smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name COc1ccc(OCC(=O)N[C@H](C)c2ccc(Cl)cc2)c([N+](=O)[O-])c1 ZINC000005051868 936315165 /nfs/dbraw/zinc/31/51/65/936315165.db2.gz GXGIPEUDHYBRFQ-LLVKDONJSA-N 0 0 364.785 3.513 20 5 FHBDRN CCO[C@H](CCNC(=O)c1cc(Br)cc([N+](=O)[O-])c1)C(C)C ZINC000431508887 936317452 /nfs/dbraw/zinc/31/74/52/936317452.db2.gz SLSANDVEVBTHIA-CQSZACIVSA-N 0 0 373.247 3.538 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1C(F)(F)F)N1CCc2sccc2C1 ZINC000582977024 936334491 /nfs/dbraw/zinc/33/44/91/936334491.db2.gz DBYJKBSSXBNFNJ-UHFFFAOYSA-N 0 0 356.325 3.874 20 5 FHBDRN C[C@@H]1C[C@@H](C)[C@H](C)N(C(=O)c2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000166579075 936335831 /nfs/dbraw/zinc/33/58/31/936335831.db2.gz AOIURDFLTZSLAI-MXWKQRLJSA-N 0 0 355.232 3.864 20 5 FHBDRN Cc1cc(F)ccc1-c1noc([C@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)n1 ZINC000612931886 936340138 /nfs/dbraw/zinc/34/01/38/936340138.db2.gz MRYZKIFIJZQPHH-NSHDSACASA-N 0 0 370.340 3.583 20 5 FHBDRN COCc1ccc([C@@H]2CCCN2C(=O)c2cc([N+](=O)[O-])cc(C)c2F)o1 ZINC000278001256 936343896 /nfs/dbraw/zinc/34/38/96/936343896.db2.gz DJGMFOHSIUKUPS-HNNXBMFYSA-N 0 0 362.357 3.759 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)cnc1Sc1nnc(NCC(F)(F)F)s1 ZINC000153647921 936356217 /nfs/dbraw/zinc/35/62/17/936356217.db2.gz MGUMPGZAIJJUJV-UHFFFAOYSA-N 0 0 371.753 3.620 20 5 FHBDRN Cc1oc(-c2ccco2)nc1CC(=O)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000162263660 936369160 /nfs/dbraw/zinc/36/91/60/936369160.db2.gz SVYVMQMAMGJMNT-UHFFFAOYSA-N 0 0 367.361 3.673 20 5 FHBDRN C[C@@H](NC(=O)N1CC[C@H](Oc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000583022214 936373706 /nfs/dbraw/zinc/37/37/06/936373706.db2.gz SSVXXQDEVHJXDN-KDOFPFPSSA-N 0 0 355.394 3.519 20 5 FHBDRN COC(=O)c1ccc(OCc2ncc(-c3ccccc3)o2)cc1[N+](=O)[O-] ZINC000613109844 936373798 /nfs/dbraw/zinc/37/37/98/936373798.db2.gz QEJLJRHJWAKKHH-UHFFFAOYSA-N 0 0 354.318 3.615 20 5 FHBDRN Cc1cccc(OC[C@H](C)NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)c1 ZINC000158763275 936375020 /nfs/dbraw/zinc/37/50/20/936375020.db2.gz MGIRFSCNBQDJLD-AWEZNQCLSA-N 0 0 367.405 3.511 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)Nc1ccc(OC)cc1OC ZINC000439885399 945064910 /nfs/dbraw/zinc/06/49/10/945064910.db2.gz BFTDAJCLCFPUIR-UHFFFAOYSA-N 0 0 361.354 3.655 20 5 FHBDRN CCCC[C@@H]1CCC[C@H]1NC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000110715627 945065794 /nfs/dbraw/zinc/06/57/94/945065794.db2.gz KRLNPCYKTICOMV-GDBMZVCRSA-N 0 0 356.426 3.869 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H]1C[C@@H]1c1cccc(F)c1 ZINC000439893079 945065891 /nfs/dbraw/zinc/06/58/91/945065891.db2.gz VRWQQUWDILKTFZ-HUUCEWRRSA-N 0 0 359.357 3.810 20 5 FHBDRN CC(C)C[C@@H]1C[C@@H](NC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)CCO1 ZINC000467224374 945068667 /nfs/dbraw/zinc/06/86/67/945068667.db2.gz VIRDYKJSLFPGTF-DZGCQCFKSA-N 0 0 369.849 3.641 20 5 FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)NCCC1=CCCC1 ZINC000162387428 937085787 /nfs/dbraw/zinc/08/57/87/937085787.db2.gz JRFWTQUNUJAREZ-UHFFFAOYSA-N 0 0 350.440 3.564 20 5 FHBDRN Cc1ccsc1CN(C)C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000514800282 937085479 /nfs/dbraw/zinc/08/54/79/937085479.db2.gz DHGZRPZUMLOWKO-UHFFFAOYSA-N 0 0 356.350 3.838 20 5 FHBDRN CC(C)N(C)c1ccccc1NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000583072710 937096710 /nfs/dbraw/zinc/09/67/10/937096710.db2.gz FAASBWJKUBZCCJ-UHFFFAOYSA-N 0 0 353.382 3.568 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N(C)C[C@@H](C)C(=O)OC(C)(C)C ZINC000458380509 937108207 /nfs/dbraw/zinc/10/82/07/937108207.db2.gz DHGAWBJKNGLUFB-CYBMUJFWSA-N 0 0 364.442 3.570 20 5 FHBDRN CCOCc1ccc(CNC(=O)CCOc2cc(C)ccc2[N+](=O)[O-])cc1 ZINC000046576269 937110545 /nfs/dbraw/zinc/11/05/45/937110545.db2.gz LSKQSAQULNVJRS-UHFFFAOYSA-N 0 0 372.421 3.525 20 5 FHBDRN CCOCc1ccccc1CNC(=O)CCOc1cc(C)ccc1[N+](=O)[O-] ZINC000046576271 937110339 /nfs/dbraw/zinc/11/03/39/937110339.db2.gz LDJNARQCIWDGFX-UHFFFAOYSA-N 0 0 372.421 3.525 20 5 FHBDRN CCc1noc(-c2ccc(C)c(NC(=O)c3ccc([N+](=O)[O-])s3)c2)n1 ZINC000176372711 937113337 /nfs/dbraw/zinc/11/33/37/937113337.db2.gz YVRZRRANAMBJIQ-UHFFFAOYSA-N 0 0 358.379 3.829 20 5 FHBDRN Cc1cc(Cl)cc2nc(SCCn3cc([N+](=O)[O-])ccc3=O)oc21 ZINC000160142341 927034364 /nfs/dbraw/zinc/03/43/64/927034364.db2.gz UZLBVBVSKPSVDM-UHFFFAOYSA-N 0 0 365.798 3.652 20 5 FHBDRN COc1cc(C(=O)N(CC2CCCCC2)C2CC2)cc([N+](=O)[O-])c1OC ZINC000610172172 927038018 /nfs/dbraw/zinc/03/80/18/927038018.db2.gz AEANATFLZPNGMG-UHFFFAOYSA-N 0 0 362.426 3.797 20 5 FHBDRN C[C@H](OC(=O)c1ccc([N+](=O)[O-])s1)C(=O)N1c2ccccc2CC[C@H]1C ZINC000023344959 927040117 /nfs/dbraw/zinc/04/01/17/927040117.db2.gz YRGPEFJXAOKXNI-NEPJUHHUSA-N 0 0 374.418 3.570 20 5 FHBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CSC[C@H]1C ZINC000557590698 927088376 /nfs/dbraw/zinc/08/83/76/927088376.db2.gz CRKPATUEKURNNU-BXUZGUMPSA-N 0 0 354.497 3.824 20 5 FHBDRN O=C(NCCNc1ccccc1[N+](=O)[O-])c1cc(C(F)(F)F)ccc1F ZINC000471104319 927123774 /nfs/dbraw/zinc/12/37/74/927123774.db2.gz ONCTZKLWBHZMNV-UHFFFAOYSA-N 0 0 371.290 3.595 20 5 FHBDRN CS[C@@H]1CCCC[C@H]1NC(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000218822363 937136446 /nfs/dbraw/zinc/13/64/46/937136446.db2.gz IUDGVYLCFKRXRF-DGCLKSJQSA-N 0 0 373.272 3.761 20 5 FHBDRN CCNC(=O)c1ccc(C)c(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000044689536 927154918 /nfs/dbraw/zinc/15/49/18/927154918.db2.gz WBQPNUQVAHPZII-UHFFFAOYSA-N 0 0 361.785 3.559 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2nc(-c3nc(Cc4cscn4)no3)cs2)cc1 ZINC000583115012 937141335 /nfs/dbraw/zinc/14/13/35/937141335.db2.gz JRBZMDWDCMHVIN-UHFFFAOYSA-N 0 0 371.403 3.816 20 5 FHBDRN COc1cc(C(=O)Nc2cc(F)ccc2Cl)cc([N+](=O)[O-])c1OC ZINC000610174452 927193313 /nfs/dbraw/zinc/19/33/13/927193313.db2.gz YRKPLNXLDZISKY-UHFFFAOYSA-N 0 0 354.721 3.657 20 5 FHBDRN COc1cc(C(=O)N[C@@H]2CCC[C@@H](C(C)C)C2)cc([N+](=O)[O-])c1OC ZINC000610174583 927193326 /nfs/dbraw/zinc/19/33/26/927193326.db2.gz REWWEMCFCHKTSR-TZMCWYRMSA-N 0 0 350.415 3.557 20 5 FHBDRN COc1c(F)ccc(F)c1C(=O)OCc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000755326740 937142978 /nfs/dbraw/zinc/14/29/78/937142978.db2.gz ZKQZXTATPGYBKD-UHFFFAOYSA-N 0 0 357.696 3.892 20 5 FHBDRN COc1ccc(C(=O)Nc2cccc([N+](=O)[O-])c2)c(Br)c1 ZINC000133636462 927210600 /nfs/dbraw/zinc/21/06/00/927210600.db2.gz CTHSXLFMHVBPTP-UHFFFAOYSA-N 0 0 351.156 3.618 20 5 FHBDRN COc1cc(C(=O)Nc2ccc(OCC3CC3)cc2)cc([N+](=O)[O-])c1OC ZINC000610175296 927229482 /nfs/dbraw/zinc/22/94/82/927229482.db2.gz SFNDSHUIDXWNEK-UHFFFAOYSA-N 0 0 372.377 3.653 20 5 FHBDRN COC(=O)c1cc([N+](=O)[O-])c(C)cc1N1C[C@H](C)C[C@@H]1c1cccnc1 ZINC000557634514 927247050 /nfs/dbraw/zinc/24/70/50/927247050.db2.gz HTAFJVYHFBMDPK-SJKOYZFVSA-N 0 0 355.394 3.672 20 5 FHBDRN Cc1ccc(NC(=O)N(CCO)[C@@H]2CCCc3ccccc32)cc1[N+](=O)[O-] ZINC000175279939 927254784 /nfs/dbraw/zinc/25/47/84/927254784.db2.gz HKBNLSVQQWWBMA-GOSISDBHSA-N 0 0 369.421 3.807 20 5 FHBDRN CCOC(=O)c1cnc(Nc2cccc([N+](=O)[O-])c2)c(Br)c1 ZINC001204415298 927260347 /nfs/dbraw/zinc/26/03/47/927260347.db2.gz HIWGSRGLMXECBF-UHFFFAOYSA-N 0 0 366.171 3.673 20 5 FHBDRN C[C@@H]1[C@@H](C)CCCN1C(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000610178770 927316893 /nfs/dbraw/zinc/31/68/93/927316893.db2.gz WXYLKHCKQVNDKQ-WDEREUQCSA-N 0 0 360.332 3.797 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N[C@H](C)[C@H](O)c1ccc(F)cc1 ZINC000120122333 927334416 /nfs/dbraw/zinc/33/44/16/927334416.db2.gz WMIOMQXBCYDKLP-PXAZEXFGSA-N 0 0 361.373 3.594 20 5 FHBDRN O=C(NCc1cc2ccccc2[nH]1)c1ccc([N+](=O)[O-])cc1Br ZINC000120134813 927388939 /nfs/dbraw/zinc/38/89/39/927388939.db2.gz GXXDTWOHXONEPT-UHFFFAOYSA-N 0 0 374.194 3.769 20 5 FHBDRN Cc1cc(NC(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)sn1 ZINC000176431130 937161822 /nfs/dbraw/zinc/16/18/22/937161822.db2.gz XUEPBXHEVZPUAA-UHFFFAOYSA-N 0 0 360.439 3.848 20 5 FHBDRN Cc1c(C(=O)N(Cc2cccs2)C[C@@H]2CCCO2)cccc1[N+](=O)[O-] ZINC000247986755 937154625 /nfs/dbraw/zinc/15/46/25/937154625.db2.gz JYCYHYABLCVCJY-AWEZNQCLSA-N 0 0 360.435 3.786 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N1CCc2c(Cl)cccc2C1 ZINC000157496493 927428851 /nfs/dbraw/zinc/42/88/51/927428851.db2.gz CGJFWSLXCOJOMT-UHFFFAOYSA-N 0 0 361.785 3.847 20 5 FHBDRN COc1ccc(OCCSc2n[nH]c(-c3ccccc3)n2)c([N+](=O)[O-])c1 ZINC000133667037 927439602 /nfs/dbraw/zinc/43/96/02/927439602.db2.gz SCGODUBQRGSMCS-UHFFFAOYSA-N 0 0 372.406 3.560 20 5 FHBDRN Cc1nn(C)c(C(=O)Nc2ccc(N3CCCC[C@H]3C)cc2C)c1[N+](=O)[O-] ZINC000153898796 927451215 /nfs/dbraw/zinc/45/12/15/927451215.db2.gz CFUXRKBYMPMGFP-CYBMUJFWSA-N 0 0 371.441 3.576 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CN[C@@H](C)c1nc(C(F)(F)F)cs1 ZINC000274679265 927493453 /nfs/dbraw/zinc/49/34/53/927493453.db2.gz ZMHHOPXWFSGQQO-QMMMGPOBSA-N 0 0 361.345 3.930 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)F)cc1N1CCC(c2ccncc2)CC1 ZINC000278100694 937170145 /nfs/dbraw/zinc/17/01/45/937170145.db2.gz WKZHTNHSQAIANM-UHFFFAOYSA-N 0 0 352.316 3.788 20 5 FHBDRN Cc1c(C(=O)N(Cc2ccco2)Cc2cccnc2)cccc1[N+](=O)[O-] ZINC000248006429 937171748 /nfs/dbraw/zinc/17/17/48/937171748.db2.gz VQRFEWXYYHLOGM-UHFFFAOYSA-N 0 0 351.362 3.734 20 5 FHBDRN C[C@@H](NC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2)c1cccc(C2CC2)c1 ZINC000579798060 927553921 /nfs/dbraw/zinc/55/39/21/927553921.db2.gz LWPYEJLYHUNGCG-LLVKDONJSA-N 0 0 354.362 3.692 20 5 FHBDRN CCO[C@@H]1C[C@@H](NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C12CCC2 ZINC000610185966 927575278 /nfs/dbraw/zinc/57/52/78/927575278.db2.gz XOIVEZLBVVGRSV-HZPDHXFCSA-N 0 0 360.435 3.887 20 5 FHBDRN O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1CC[C@@]2(C1)OCc1ccccc12 ZINC000186920272 927576424 /nfs/dbraw/zinc/57/64/24/927576424.db2.gz NQJDVBNRTDCLHI-SFHVURJKSA-N 0 0 358.781 3.520 20 5 FHBDRN C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@]2(C1)OCc1ccccc12 ZINC000186922743 927576900 /nfs/dbraw/zinc/57/69/00/927576900.db2.gz GZKGNIKFNATICX-FFXXTYGZSA-N 0 0 364.401 3.656 20 5 FHBDRN CSc1ccc(C(=O)N2CC[C@@]3(C2)OCc2ccccc23)cc1[N+](=O)[O-] ZINC000186928660 927588639 /nfs/dbraw/zinc/58/86/39/927588639.db2.gz XXNHLJVXUGAXBG-IBGZPJMESA-N 0 0 370.430 3.588 20 5 FHBDRN Cc1cc(C)cc(CS(=O)(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)c1 ZINC000409497286 937177722 /nfs/dbraw/zinc/17/77/22/937177722.db2.gz BCCOYWQZHGELDK-UHFFFAOYSA-N 0 0 374.462 3.706 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CCC[C@H]1C[C@@H](O)c1ccco1 ZINC000162575210 937183176 /nfs/dbraw/zinc/18/31/76/937183176.db2.gz SPLYAJLCYOXJRW-XJKSGUPXSA-N 0 0 359.382 3.616 20 5 FHBDRN O=[N+]([O-])c1ccccc1N1CCN(Cc2nc(Cl)ccc2Cl)CC1 ZINC000753914268 927689052 /nfs/dbraw/zinc/68/90/52/927689052.db2.gz BPPYKHYPJVUHPY-UHFFFAOYSA-N 0 0 367.236 3.619 20 5 FHBDRN CSC[C@H](C)NC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000120211424 927694917 /nfs/dbraw/zinc/69/49/17/927694917.db2.gz GQLMXWJGFHIOKY-ZDUSSCGKSA-N 0 0 359.451 3.688 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)NC[C@H]2[C@@H]3c4ccccc4C[C@H]23)cc1[N+](=O)[O-] ZINC000246864190 927701198 /nfs/dbraw/zinc/70/11/98/927701198.db2.gz LEUDPBQMVFCBEF-DOFJYSBOSA-N 0 0 365.433 3.849 20 5 FHBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)c1cccnc1N1CCCC1 ZINC000133686183 927708198 /nfs/dbraw/zinc/70/81/98/927708198.db2.gz PUWYWDGKPBOJEA-UHFFFAOYSA-N 0 0 360.801 3.804 20 5 FHBDRN CCOC(=O)c1cc(C(=O)Nc2c(C)cccc2CC)cc([N+](=O)[O-])c1 ZINC000014427989 927715394 /nfs/dbraw/zinc/71/53/94/927715394.db2.gz YHXLDPSSSUUVQU-UHFFFAOYSA-N 0 0 356.378 3.895 20 5 FHBDRN CCCOc1ccccc1NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000042295963 927737416 /nfs/dbraw/zinc/73/74/16/927737416.db2.gz NSFOCFIFILSROG-UHFFFAOYSA-N 0 0 366.377 3.822 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@](C)(C1CC1)C(F)(F)F ZINC000471137221 927744516 /nfs/dbraw/zinc/74/45/16/927744516.db2.gz OONNHTAWWVOTQC-XPTSAGLGSA-N 0 0 362.373 3.923 20 5 FHBDRN C[C@]1(c2ccccc2)C[C@H]1NC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000610190286 927785160 /nfs/dbraw/zinc/78/51/60/927785160.db2.gz IWRLZFVXDKXPMK-IEBWSBKVSA-N 0 0 374.824 3.864 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1C[C@]1(C)c1ccccc1 ZINC000610190644 927820387 /nfs/dbraw/zinc/82/03/87/927820387.db2.gz RJBLKRSJKJRFLN-BOFPYLFWSA-N 0 0 356.447 3.922 20 5 FHBDRN CCOc1ccc2c(c1)[C@@H](NC(=O)c1cc([N+](=O)[O-])c(C)s1)CCO2 ZINC000187037087 927863771 /nfs/dbraw/zinc/86/37/71/927863771.db2.gz MOXYHSNBBBBBIJ-ZDUSSCGKSA-N 0 0 362.407 3.617 20 5 FHBDRN COC(=O)c1ccc(Cl)c(NC(=O)c2cc(F)cc(C)c2[N+](=O)[O-])c1 ZINC000175729692 927865889 /nfs/dbraw/zinc/86/58/89/927865889.db2.gz YXISTVLBAVRNIT-UHFFFAOYSA-N 0 0 366.732 3.735 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)Nc1ccc(OC(C)(C)C)cc1 ZINC000610194762 927897903 /nfs/dbraw/zinc/89/79/03/927897903.db2.gz XPWHIKGMTYBKCM-UHFFFAOYSA-N 0 0 364.423 3.881 20 5 FHBDRN COc1cc(NC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)ccc1F ZINC000187090002 927907924 /nfs/dbraw/zinc/90/79/24/927907924.db2.gz SDFMURSISOOVCW-UHFFFAOYSA-N 0 0 359.357 3.939 20 5 FHBDRN Cc1c(CSC(C)C)cccc1NC(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC000187132193 927934026 /nfs/dbraw/zinc/93/40/26/927934026.db2.gz KHQPAUZEZHNADX-UHFFFAOYSA-N 0 0 361.423 3.898 20 5 FHBDRN 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3.988 20 5 FHBDRN CO[C@@H]1CCC[C@@H](OC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000064863167 929744143 /nfs/dbraw/zinc/74/41/43/929744143.db2.gz GRBBOZWCSRUQTG-ZIAGYGMSSA-N 0 0 362.407 3.833 20 5 FHBDRN CCS[C@H]1CCC[C@@H](NC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2)C1 ZINC000177640895 929762936 /nfs/dbraw/zinc/76/29/36/929762936.db2.gz JYMBHIMAZMAJAI-OLZOCXBDSA-N 0 0 367.427 3.606 20 5 FHBDRN CCc1ccc([C@H]2CN(c3ccc([N+](=O)[O-])c(C(C)=O)c3)CCO2)cc1 ZINC000579037677 929776285 /nfs/dbraw/zinc/77/62/85/929776285.db2.gz QSLVYHVVPNWOPI-HXUWFJFHSA-N 0 0 354.406 3.938 20 5 FHBDRN CC(C)c1[nH]nc(-c2nc(CSc3ccc(F)cc3)no2)c1[N+](=O)[O-] ZINC000544902902 929778728 /nfs/dbraw/zinc/77/87/28/929778728.db2.gz MWCQARPQMNWQAR-UHFFFAOYSA-N 0 0 363.374 3.923 20 5 FHBDRN C[C@H](c1ccccc1)[N@@H+]1CC[C@H](Nc2cc(C(=O)[O-])ccc2[N+](=O)[O-])C1 ZINC000572845319 929788742 /nfs/dbraw/zinc/78/87/42/929788742.db2.gz NAXVIOVERNATAF-CJNGLKHVSA-N 0 0 355.394 3.540 20 5 FHBDRN 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/nfs/dbraw/zinc/85/61/19/929856119.db2.gz ZMUMAKGFCZMREB-JTQLQIEISA-N 0 0 368.842 3.956 20 5 FHBDRN COc1ccc2c(c1)OCC[C@H]2NC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000610317205 929869531 /nfs/dbraw/zinc/86/95/31/929869531.db2.gz SQPLIFKKKAGFCU-OAHLLOKOSA-N 0 0 357.366 3.557 20 5 FHBDRN COc1ccc2c(c1)OCC[C@@H]2NC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000610317204 929870610 /nfs/dbraw/zinc/87/06/10/929870610.db2.gz SQPLIFKKKAGFCU-HNNXBMFYSA-N 0 0 357.366 3.557 20 5 FHBDRN O=C(Nc1ccccc1-c1cc(F)c(F)c(F)c1)c1cc([N+](=O)[O-])n[nH]1 ZINC000560553143 929893155 /nfs/dbraw/zinc/89/31/55/929893155.db2.gz JVZMCKYAVFCMQF-UHFFFAOYSA-N 0 0 362.267 3.655 20 5 FHBDRN CCCN(CC(C)(C)O)C(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000275690908 929918785 /nfs/dbraw/zinc/91/87/85/929918785.db2.gz DNUQODMQKIYVSG-UHFFFAOYSA-N 0 0 352.434 3.717 20 5 FHBDRN Cc1cc(-c2nnc(COC(=O)[C@@H](C)c3cccc([N+](=O)[O-])c3)o2)c(C)o1 ZINC000784990360 929920060 /nfs/dbraw/zinc/92/00/60/929920060.db2.gz HPLVCMSYYMWJBY-NSHDSACASA-N 0 0 371.349 3.702 20 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930007018 /nfs/dbraw/zinc/00/70/18/930007018.db2.gz XGHUIEYYUNTCRK-UHFFFAOYSA-N 0 0 362.455 3.522 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1F)c1ccc(O[C@H]2CC2(F)F)cc1 ZINC001125407223 930043190 /nfs/dbraw/zinc/04/31/90/930043190.db2.gz YFNVPCBNWTZOAK-AWEZNQCLSA-N 0 0 352.268 3.773 20 5 FHBDRN Cc1c(C(=O)NC2CC(c3ccccc3)C2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000728280101 930071243 /nfs/dbraw/zinc/07/12/43/930071243.db2.gz NXIMSOIGXUYTKB-UHFFFAOYSA-N 0 0 369.377 3.796 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N(C)C[C@@H](C)c1nccs1 ZINC000275736871 930073419 /nfs/dbraw/zinc/07/34/19/930073419.db2.gz BCLYFDYGUXTJRW-SNVBAGLBSA-N 0 0 353.831 3.889 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@H](CO)c1cccc(Cl)c1Cl ZINC001167344649 930077891 /nfs/dbraw/zinc/07/78/91/930077891.db2.gz AKBYECLOBAUVQU-CQSZACIVSA-N 0 0 369.204 3.673 20 5 FHBDRN Cc1nn(C(F)F)c(C)c1COC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000784998381 930091809 /nfs/dbraw/zinc/09/18/09/930091809.db2.gz DMLOHNHYMSWOBN-UHFFFAOYSA-N 0 0 364.308 3.642 20 5 FHBDRN Cc1ccn(Cc2csc(-c3ccc(Cl)cc3)n2)c(=O)c1[N+](=O)[O-] ZINC000471520262 930131200 /nfs/dbraw/zinc/13/12/00/930131200.db2.gz POGUEVTYZOETAU-UHFFFAOYSA-N 0 0 361.810 3.890 20 5 FHBDRN Cc1nn(C)c(C)c1[C@H]1OCC[C@@H]1Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000471521690 930133693 /nfs/dbraw/zinc/13/36/93/930133693.db2.gz KEBZTJIORHXNNI-BBRMVZONSA-N 0 0 350.806 3.541 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@H]2C[C@@]2(C)c2ccccc2)c1 ZINC000610367341 930162904 /nfs/dbraw/zinc/16/29/04/930162904.db2.gz MQRHDSFRTOUZPA-ICSRJNTNSA-N 0 0 354.406 3.519 20 5 FHBDRN COc1ccc(OCC[N@@H+]2CCS[C@H](c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000610369720 930172764 /nfs/dbraw/zinc/17/27/64/930172764.db2.gz FOHLBZVCQVLOMA-IBGZPJMESA-N 0 0 374.462 3.772 20 5 FHBDRN CC[C@H](NC(=O)N(C)[C@@H]1C[C@@H](OC)C12CCC2)c1cccc([N+](=O)[O-])c1 ZINC000458496671 937388567 /nfs/dbraw/zinc/38/85/67/937388567.db2.gz IMFGMCAXSNALSQ-GVDBMIGSSA-N 0 0 361.442 3.645 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCOC(C)(C)C1 ZINC000121159240 930175758 /nfs/dbraw/zinc/17/57/58/930175758.db2.gz MGPAPGMADUHLDN-GFCCVEGCSA-N 0 0 352.456 3.783 20 5 FHBDRN Cc1[nH]c2ccc(CNC(=O)CCNc3ccccc3[N+](=O)[O-])cc2c1C ZINC000064901973 930192412 /nfs/dbraw/zinc/19/24/12/930192412.db2.gz GOEUMAGTXHBIJO-UHFFFAOYSA-N 0 0 366.421 3.811 20 5 FHBDRN O=C(NCCc1cccc(F)c1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000064897714 930193452 /nfs/dbraw/zinc/19/34/52/930193452.db2.gz CBESNBUPJQCGTN-UHFFFAOYSA-N 0 0 371.393 3.830 20 5 FHBDRN Cc1cc(COC(=O)Cc2ccccc2Br)ccc1[N+](=O)[O-] ZINC001266572652 930212768 /nfs/dbraw/zinc/21/27/68/930212768.db2.gz QKUUULMJSKBQLG-UHFFFAOYSA-N 0 0 364.195 3.952 20 5 FHBDRN C[C@H]1C(=O)CC[C@@H](C(=O)N(C)Cc2cc([N+](=O)[O-])ccc2Cl)C1(C)C ZINC000275776885 930214280 /nfs/dbraw/zinc/21/42/80/930214280.db2.gz UEMTXAMZGMUUNS-FZMZJTMJSA-N 0 0 366.845 3.848 20 5 FHBDRN Cc1ccccc1CNC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000047747167 930215081 /nfs/dbraw/zinc/21/50/81/930215081.db2.gz IRTBNCPMDBXPBK-UHFFFAOYSA-N 0 0 368.311 3.774 20 5 FHBDRN O=C(C[C@H]1COCCN1Cc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1 ZINC000134137624 930217610 /nfs/dbraw/zinc/21/76/10/930217610.db2.gz APCROEHODSHCJK-INIZCTEOSA-N 0 0 374.824 3.722 20 5 FHBDRN O=[N+]([O-])c1ccc(SCCCSc2ccc([N+](=O)[O-])cn2)nc1 ZINC000160361448 930223475 /nfs/dbraw/zinc/22/34/75/930223475.db2.gz DHTYFVBAJPWSRK-UHFFFAOYSA-N 0 0 352.397 3.568 20 5 FHBDRN Cc1cccc(C[C@H](CO)N[C@@H](c2ccc([N+](=O)[O-])cc2)C(F)(F)F)c1 ZINC000580084680 930229490 /nfs/dbraw/zinc/22/94/90/930229490.db2.gz YSJVYZSFGXMRFJ-WBVHZDCISA-N 0 0 368.355 3.700 20 5 FHBDRN Cc1ccc2c(c1)CC[C@H]2NC(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F ZINC001125420919 930245914 /nfs/dbraw/zinc/24/59/14/930245914.db2.gz NGGSNLYCQYITKN-MRXNPFEDSA-N 0 0 357.385 3.526 20 5 FHBDRN C[C@@H]1CN(C)c2ccccc2N(C(=O)c2cccc(Cl)c2[N+](=O)[O-])C1 ZINC000175899761 930263457 /nfs/dbraw/zinc/26/34/57/930263457.db2.gz ZWSBIHLENOSTBY-GFCCVEGCSA-N 0 0 359.813 3.981 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])[nH]1)N(Cc1ccc(F)cc1Cl)CC1CC1 ZINC000560995067 930269548 /nfs/dbraw/zinc/26/95/48/930269548.db2.gz MULYNVPFDLVDJX-UHFFFAOYSA-N 0 0 351.765 3.768 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)C1(c2ccc(F)cc2F)CCC1 ZINC000560993543 930273674 /nfs/dbraw/zinc/27/36/74/930273674.db2.gz ZHXLTZAFJUUBGL-UHFFFAOYSA-N 0 0 374.387 3.996 20 5 FHBDRN CCCN(C[C@@H]1COc2ccccc2O1)C(=O)c1ccc(C)c([N+](=O)[O-])c1 ZINC000049957967 930282468 /nfs/dbraw/zinc/28/24/68/930282468.db2.gz SMWGSBQQIBRBAI-MRXNPFEDSA-N 0 0 370.405 3.595 20 5 FHBDRN COc1cccc(C(=O)COc2ccc(-c3ccccc3)cc2[N+](=O)[O-])n1 ZINC000580132515 930291537 /nfs/dbraw/zinc/29/15/37/930291537.db2.gz PWXTXYMHURZWAX-UHFFFAOYSA-N 0 0 364.357 3.927 20 5 FHBDRN CC(C)C[C@H]1CCCCN1C(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000785007499 930311751 /nfs/dbraw/zinc/31/17/51/930311751.db2.gz MHWVBRYVXDBYIS-GFCCVEGCSA-N 0 0 367.833 3.614 20 5 FHBDRN O=Cc1ccc([N+](=O)[O-])c(OCCOc2ccccc2C(F)(F)F)c1 ZINC000748151197 930321130 /nfs/dbraw/zinc/32/11/30/930321130.db2.gz RPFCAWLRAPPVGO-UHFFFAOYSA-N 0 0 355.268 3.884 20 5 FHBDRN COc1cc(C(=O)N[C@H](C)CCOCc2ccccc2)cc([N+](=O)[O-])c1C ZINC000583398759 937407164 /nfs/dbraw/zinc/40/71/64/937407164.db2.gz JHDOHMAIYKPCIB-CQSZACIVSA-N 0 0 372.421 3.637 20 5 FHBDRN Cc1nn(CC(=O)OCc2ccc([N+](=O)[O-])c(F)c2)cc1-c1ccccc1 ZINC000785009121 930351244 /nfs/dbraw/zinc/35/12/44/930351244.db2.gz BQQASWWZYORRIK-UHFFFAOYSA-N 0 0 369.352 3.649 20 5 FHBDRN CC(C)C[C@@H]1CCCCN1C(=O)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000785010656 930362489 /nfs/dbraw/zinc/36/24/89/930362489.db2.gz XYTTUIQQXAUCDQ-ZDUSSCGKSA-N 0 0 367.833 3.614 20 5 FHBDRN O=C(NCCc1ccccc1[N+](=O)[O-])Nc1c(F)cc(Cl)cc1F ZINC000548067944 930363450 /nfs/dbraw/zinc/36/34/50/930363450.db2.gz DZRAQUXHJKEZKL-UHFFFAOYSA-N 0 0 355.728 3.891 20 5 FHBDRN COc1ccc(C[C@H](C)Nc2cc(OC)c(F)cc2[N+](=O)[O-])cc1OC ZINC000580254981 930407702 /nfs/dbraw/zinc/40/77/02/930407702.db2.gz PMGLMBBWQRJRRH-NSHDSACASA-N 0 0 364.373 3.803 20 5 FHBDRN CC1(O)CCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)CC1 ZINC000177733882 930409362 /nfs/dbraw/zinc/40/93/62/930409362.db2.gz DJUSRGRHWBOHGL-UHFFFAOYSA-N 0 0 372.446 3.733 20 5 FHBDRN CCOc1ccc(C(=O)NC[C@@H]2CCCCC(F)(F)C2)cc1[N+](=O)[O-] ZINC000579507523 930421279 /nfs/dbraw/zinc/42/12/79/930421279.db2.gz UDXNVTFMLNNVAB-GFCCVEGCSA-N 0 0 356.369 3.939 20 5 FHBDRN O=C(N[C@@H](CCO)c1ccc(Cl)cc1)c1c[nH]c2ccc([N+](=O)[O-])cc21 ZINC000579514441 930424196 /nfs/dbraw/zinc/42/41/96/930424196.db2.gz BYHWIZMISJPSOX-INIZCTEOSA-N 0 0 373.796 3.583 20 5 FHBDRN C[C@@H]1CC(=O)c2c1c(F)ccc2OC(=O)c1cc([N+](=O)[O-])ccc1N(C)C ZINC000728288465 930438342 /nfs/dbraw/zinc/43/83/42/930438342.db2.gz GAGJRMUHXRRARB-SNVBAGLBSA-N 0 0 372.352 3.709 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N[C@@H]1[C@@H]2CCO[C@H]2C12CCCC2 ZINC000275814692 930445249 /nfs/dbraw/zinc/44/52/49/930445249.db2.gz MVCWZIPGYXNWNL-APHBMKBZSA-N 0 0 364.829 3.634 20 5 FHBDRN CC[C@H](C)Oc1ccc(-c2noc(-c3nn(CC)cc3[N+](=O)[O-])n2)cc1 ZINC000583406409 937418154 /nfs/dbraw/zinc/41/81/54/937418154.db2.gz FOCYZIVXRQVJDK-NSHDSACASA-N 0 0 357.370 3.706 20 5 FHBDRN CCc1ccc(C(=O)N[C@@H](C)COc2ccc(F)cc2F)cc1[N+](=O)[O-] ZINC001125436430 930469153 /nfs/dbraw/zinc/46/91/53/930469153.db2.gz IUDFQJPDWGXUBZ-NSHDSACASA-N 0 0 364.348 3.633 20 5 FHBDRN O=C(NC1CC1)[C@@H](Cc1ccccc1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000471558027 930516643 /nfs/dbraw/zinc/51/66/43/930516643.db2.gz IOFDDHPLUOAPCV-MRXNPFEDSA-N 0 0 359.813 3.550 20 5 FHBDRN Cc1c(NC(=O)c2ccc(OC[C@H]3CCCO3)cc2)cccc1[N+](=O)[O-] ZINC000013619112 930521864 /nfs/dbraw/zinc/52/18/64/930521864.db2.gz JOALLPUGVXGKBH-MRXNPFEDSA-N 0 0 356.378 3.713 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(OC[C@@H]2CCCO2)cc1 ZINC000013619102 930522090 /nfs/dbraw/zinc/52/20/90/930522090.db2.gz LCDOIVNWNCQNRZ-KRWDZBQOSA-N 0 0 356.378 3.713 20 5 FHBDRN COc1ccc(NC(=O)N2Cc3ccccc3OC(C)(C)C2)cc1[N+](=O)[O-] ZINC000580375041 930586995 /nfs/dbraw/zinc/58/69/95/930586995.db2.gz NGKACHOHMKETMR-UHFFFAOYSA-N 0 0 371.393 3.809 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(CC)c1ccc2[nH]ccc2c1 ZINC000471567146 930590625 /nfs/dbraw/zinc/59/06/25/930590625.db2.gz OUXDXWVIQQAUAW-UHFFFAOYSA-N 0 0 373.434 3.854 20 5 FHBDRN CN(CCOc1ccc(Cl)cc1)C(=O)c1c[nH]c2ccc([N+](=O)[O-])cc21 ZINC000109887679 930590816 /nfs/dbraw/zinc/59/08/16/930590816.db2.gz RAALBYCHTZJQKA-UHFFFAOYSA-N 0 0 373.796 3.881 20 5 FHBDRN O=C(Nc1cc(F)cc([N+](=O)[O-])c1)NC1(c2ccccc2)CCOCC1 ZINC000548087764 930590883 /nfs/dbraw/zinc/59/08/83/930590883.db2.gz TZHYACHNRIQPIH-UHFFFAOYSA-N 0 0 359.357 3.561 20 5 FHBDRN C[C@@H](NC(=O)N1CCC(C2CCOCC2)CC1)c1ccccc1[N+](=O)[O-] ZINC000561083548 930591997 /nfs/dbraw/zinc/59/19/97/930591997.db2.gz DTOJXVJVLPHQPF-CQSZACIVSA-N 0 0 361.442 3.504 20 5 FHBDRN O=C(NCCc1ccccc1[N+](=O)[O-])NCc1cc2c(s1)CCCC2 ZINC000548092742 930640077 /nfs/dbraw/zinc/64/00/77/930640077.db2.gz MWGJIJQIIKDMAV-UHFFFAOYSA-N 0 0 359.451 3.577 20 5 FHBDRN CSc1ccc(NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])nc1 ZINC000080330762 937435472 /nfs/dbraw/zinc/43/54/72/937435472.db2.gz HYFRICBUIJEQAX-UHFFFAOYSA-N 0 0 357.313 3.983 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)NCc2ccc(OC(C)C)nc2)cc1[N+](=O)[O-] ZINC000175812760 930717865 /nfs/dbraw/zinc/71/78/65/930717865.db2.gz FGPHHLSREIJRSU-CQSZACIVSA-N 0 0 372.425 3.646 20 5 FHBDRN CCN(C)[C@H](c1nc(Cc2ccc([N+](=O)[O-])c(C)c2)no1)c1ccccc1 ZINC000580481495 930730344 /nfs/dbraw/zinc/73/03/44/930730344.db2.gz AZKXZEVHIVATSX-IBGZPJMESA-N 0 0 366.421 3.918 20 5 FHBDRN CC(=O)c1ccc(OCC(=O)N2c3ccccc3CC[C@@H]2C)c([N+](=O)[O-])c1 ZINC000119148512 930748836 /nfs/dbraw/zinc/74/88/36/930748836.db2.gz MLVSPRAKFSZJDK-ZDUSSCGKSA-N 0 0 368.389 3.544 20 5 FHBDRN CCn1c2ccc(F)cc2nc1NC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000516616182 945069881 /nfs/dbraw/zinc/06/98/81/945069881.db2.gz FLKUJRWJZMPJJR-NSHDSACASA-N 0 0 356.357 3.846 20 5 FHBDRN Cc1cc(C(=O)NC2CCCCC2)ccc1NC(=O)c1ccc([N+](=O)[O-])o1 ZINC000055560339 930856442 /nfs/dbraw/zinc/85/64/42/930856442.db2.gz FSFDJTWLFQNVIZ-UHFFFAOYSA-N 0 0 371.393 3.811 20 5 FHBDRN CC(=O)c1ccc(OCC(=O)N(C2CC2)C2CCC(C)CC2)c([N+](=O)[O-])c1 ZINC000119195322 930858299 /nfs/dbraw/zinc/85/82/99/930858299.db2.gz FCALSJHYUJVSRL-UHFFFAOYSA-N 0 0 374.437 3.746 20 5 FHBDRN COc1ccc(NC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)c2ncccc12 ZINC000548112537 930864701 /nfs/dbraw/zinc/86/47/01/930864701.db2.gz CXNIHGIIUSFNAV-UHFFFAOYSA-N 0 0 362.345 3.885 20 5 FHBDRN Cc1cccc(CO[C@@H](C)C(=O)N2CCc3cc(C)c([N+](=O)[O-])cc32)c1 ZINC001266623303 930871523 /nfs/dbraw/zinc/87/15/23/930871523.db2.gz LUWWVCXIBPFIMY-HNNXBMFYSA-N 0 0 354.406 3.706 20 5 FHBDRN C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CC[C@@H](c2ccccc2F)C1 ZINC000580577043 930872503 /nfs/dbraw/zinc/87/25/03/930872503.db2.gz DXZPMVJAUGOLPG-ZIAGYGMSSA-N 0 0 357.385 3.550 20 5 FHBDRN CCOC(=O)C1CCC(Nc2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000319888966 930970913 /nfs/dbraw/zinc/97/09/13/930970913.db2.gz IYNFAKKSQPJJLK-UHFFFAOYSA-N 0 0 371.231 3.891 20 5 FHBDRN Cc1c(C(=O)N(Cc2cccc(F)c2)C[C@@H]2CCCO2)cccc1[N+](=O)[O-] ZINC000050379932 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931334577 /nfs/dbraw/zinc/33/45/77/931334577.db2.gz ADIVWLVZSPYFRR-UHFFFAOYSA-N 0 0 354.184 3.679 20 5 FHBDRN O=C(CNc1ccsc1[N+](=O)[O-])N1CCC(Cc2ccccc2)CC1 ZINC000610468802 931377783 /nfs/dbraw/zinc/37/77/83/931377783.db2.gz BMTNKARSNGZVCN-UHFFFAOYSA-N 0 0 359.451 3.550 20 5 FHBDRN CC(C)[C@@H](O)C1(CNC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)CC1 ZINC000276005458 931381868 /nfs/dbraw/zinc/38/18/68/931381868.db2.gz SLTZOIJITMOATC-HXUWFJFHSA-N 0 0 364.445 3.621 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H](C)CC1CCCCC1 ZINC000580944902 931385981 /nfs/dbraw/zinc/38/59/81/931385981.db2.gz NXJMKMLVEMSKJD-ZDUSSCGKSA-N 0 0 361.442 3.571 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)Cc2c[nH]c3ccc(F)cc23)cc1[N+](=O)[O-] ZINC000177864599 931399320 /nfs/dbraw/zinc/39/93/20/931399320.db2.gz OYCWUNCCCJFXQU-GFCCVEGCSA-N 0 0 355.369 3.944 20 5 FHBDRN Cc1nnc([C@H](C)OC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)s1 ZINC000785031301 931419339 /nfs/dbraw/zinc/41/93/39/931419339.db2.gz IRDBFSRRFBJBTF-JTQLQIEISA-N 0 0 365.414 3.759 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CCc1ccc(C(=O)NCCc2nc3ccccc3s2)cc1[N+](=O)[O-] ZINC000471650225 931994982 /nfs/dbraw/zinc/99/49/82/931994982.db2.gz VSYOHAMAMJWUFC-UHFFFAOYSA-N 0 0 355.419 3.739 20 5 FHBDRN COC(=O)c1cc(NC(=O)CCCc2ccc(C)s2)cc([N+](=O)[O-])c1 ZINC000430592307 931995651 /nfs/dbraw/zinc/99/56/51/931995651.db2.gz MKDSVYBUDPLRTF-UHFFFAOYSA-N 0 0 362.407 3.713 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)O[C@H](C)c1ccc(C(F)(F)F)cc1 ZINC000728333260 932008192 /nfs/dbraw/zinc/00/81/92/932008192.db2.gz QWOAFYKZRFEWJP-SNVBAGLBSA-N 0 0 371.315 3.813 20 5 FHBDRN COc1c(F)cc(F)cc1NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000471653833 932023615 /nfs/dbraw/zinc/02/36/15/932023615.db2.gz PSEARZWAWKFQTI-UHFFFAOYSA-N 0 0 362.292 3.544 20 5 FHBDRN COc1c(C)ccc(NC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)c1C ZINC000033172680 932037105 /nfs/dbraw/zinc/03/71/05/932037105.db2.gz FMFPBKOROGQYIH-UHFFFAOYSA-N 0 0 366.377 3.658 20 5 FHBDRN O=C(CN1CC[C@@H]1c1cccc(F)c1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000610505745 932041547 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CC(C)(NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)c1cccc(F)c1 ZINC000135263258 932111935 /nfs/dbraw/zinc/11/19/35/932111935.db2.gz YDJKRESNEMLYMF-UHFFFAOYSA-N 0 0 355.369 3.809 20 5 FHBDRN O=C(COC(=O)[C@H]1C[C@H]1c1cccc(Cl)c1)c1ccc([N+](=O)[O-])cc1 ZINC000728338653 932116968 /nfs/dbraw/zinc/11/69/68/932116968.db2.gz GFEAEVIYWJSDTP-HOTGVXAUSA-N 0 0 359.765 3.778 20 5 FHBDRN Cn1cc([N+](=O)[O-])c(C(=O)Nc2ccc(Oc3cccc(F)c3)cc2)n1 ZINC000537914446 932156108 /nfs/dbraw/zinc/15/61/08/932156108.db2.gz BKVFQCDEAVLMDH-UHFFFAOYSA-N 0 0 356.313 3.512 20 5 FHBDRN COc1ccccc1[C@@H](CNC(=O)c1cccc([N+](=O)[O-])c1C)OC(C)C ZINC000187415883 932157603 /nfs/dbraw/zinc/15/76/03/932157603.db2.gz ZOULSIPHNRYCJM-LJQANCHMSA-N 0 0 372.421 3.808 20 5 FHBDRN O=C1[C@@H](Sc2ncccc2[N+](=O)[O-])CCCN1c1ccccc1Cl ZINC000126539000 932217420 /nfs/dbraw/zinc/21/74/20/932217420.db2.gz IBCINHANFZQMCL-AWEZNQCLSA-N 0 0 363.826 3.931 20 5 FHBDRN C[C@H]1C[C@H](NC(=O)c2ccc(Br)cc2[N+](=O)[O-])C[C@@H](C)C1 ZINC000430611332 932251820 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FHBDRN C[C@H](Nc1ccc([N+](=O)[O-])c(OC(F)F)c1)c1ccc2[nH]c(=O)[nH]c2c1 ZINC000610514872 932328951 /nfs/dbraw/zinc/32/89/51/932328951.db2.gz INUXSIGWYQORGF-QMMMGPOBSA-N 0 0 364.308 3.951 20 5 FHBDRN O=C(/C=C\c1cncc(F)c1)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC000255332969 932347304 /nfs/dbraw/zinc/34/73/04/932347304.db2.gz HRAUONBVZVKQGZ-RJRFIUFISA-N 0 0 366.146 3.543 20 5 FHBDRN Cc1sc(C(=O)N2C[C@H](C)O[C@@H](c3ccsc3)C2)cc1[N+](=O)[O-] ZINC000156307750 932348461 /nfs/dbraw/zinc/34/84/61/932348461.db2.gz UBLXHFRXOAUTKF-TVQRCGJNSA-N 0 0 352.437 3.628 20 5 FHBDRN O=[N+]([O-])c1ccc(N[C@H]2CCN(c3ccc(Cl)c(Cl)c3)C2)cn1 ZINC000477137482 932349472 /nfs/dbraw/zinc/34/94/72/932349472.db2.gz VLNJCDMJPQBZKF-NSHDSACASA-N 0 0 353.209 3.987 20 5 FHBDRN Cc1cc(-c2nc(-c3ccc(Br)o3)no2)cc([N+](=O)[O-])c1 ZINC000477147909 932352523 /nfs/dbraw/zinc/35/25/23/932352523.db2.gz ADUBAQPIPLSGDE-UHFFFAOYSA-N 0 0 350.128 3.976 20 5 FHBDRN CCc1cc(NC(=O)c2csc(C(C)C)n2)c2cc([N+](=O)[O-])ccc2n1 ZINC001266776421 932358133 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C[C@@H](c1cccc([N+](=O)[O-])c1)N1CCN(C(=O)CCC2CCCC2)CC1 ZINC000097205616 932495976 /nfs/dbraw/zinc/49/59/76/932495976.db2.gz GUDODJLYDNYWGD-INIZCTEOSA-N 0 0 359.470 3.770 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(Cl)c1N1CCC(c2nncn2C2CC2)CC1 ZINC000276500256 932498334 /nfs/dbraw/zinc/49/83/34/932498334.db2.gz RHFWELXOGTXJJR-UHFFFAOYSA-N 0 0 361.833 3.867 20 5 FHBDRN CC(=O)c1ccc(NC(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)cc1Cl ZINC000581689640 932507276 /nfs/dbraw/zinc/50/72/76/932507276.db2.gz AGZIYFPCXUXXHM-UHFFFAOYSA-N 0 0 368.723 3.910 20 5 FHBDRN CCCN(C[C@H]1CCCCO1)C(=O)c1c(C)cc(Cl)cc1[N+](=O)[O-] ZINC000477370377 932519990 /nfs/dbraw/zinc/51/99/90/932519990.db2.gz CAACEEPWWVZBFT-CQSZACIVSA-N 0 0 354.834 3.978 20 5 FHBDRN O=C(COc1cccc([N+](=O)[O-])c1)N1CC=C(c2cccc(Cl)c2)CC1 ZINC000477381541 932522246 /nfs/dbraw/zinc/52/22/46/932522246.db2.gz LJXGTXFSTLCRLI-UHFFFAOYSA-N 0 0 372.808 3.943 20 5 FHBDRN CCn1c(NC(=O)c2c(C)cc(C)c([N+](=O)[O-])c2C)nc2cccnc21 ZINC000477409081 932541178 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FHBDRN COc1cc(C(=O)N(CC(C)(C)C)c2ccccn2)c([N+](=O)[O-])cc1OC ZINC000891503082 932661814 /nfs/dbraw/zinc/66/18/14/932661814.db2.gz CQBFQIBKRARUJR-UHFFFAOYSA-N 0 0 373.409 3.700 20 5 FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(F)cc1 ZINC000127311572 932683419 /nfs/dbraw/zinc/68/34/19/932683419.db2.gz FXDKIKFILQXRBG-UHFFFAOYSA-N 0 0 350.371 3.725 20 5 FHBDRN COc1ccccc1C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1C)C(C)C ZINC000477555484 932688459 /nfs/dbraw/zinc/68/84/59/932688459.db2.gz WKPXLZQKEHKQLF-GOSISDBHSA-N 0 0 356.422 3.909 20 5 FHBDRN Cc1c(Br)cc(C(=O)N2C[C@@H]3CCC[C@@H]3C2)cc1[N+](=O)[O-] ZINC000127315086 932703348 /nfs/dbraw/zinc/70/33/48/932703348.db2.gz BGLGLATZNWUFNW-PHIMTYICSA-N 0 0 353.216 3.538 20 5 FHBDRN CSc1cccc(C(=O)NC2CC(OCc3ccccc3)C2)c1[N+](=O)[O-] ZINC000548253494 932733069 /nfs/dbraw/zinc/73/30/69/932733069.db2.gz HMLNICNGDRTGRB-UHFFFAOYSA-N 0 0 372.446 3.794 20 5 FHBDRN O=C(c1cc(-c2cccc(F)c2)no1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000047904784 932744343 /nfs/dbraw/zinc/74/43/43/932744343.db2.gz OTHMGTPQDJQTPG-UHFFFAOYSA-N 0 0 353.309 3.592 20 5 FHBDRN C[C@H](C(=O)N(C)[C@@H](C)c1ccc([S@@](C)=O)cc1)c1cccc([N+](=O)[O-])c1 ZINC000581858804 932751922 /nfs/dbraw/zinc/75/19/22/932751922.db2.gz VXMGCZQGFIEFOJ-AOTXYTFASA-N 0 0 374.462 3.655 20 5 FHBDRN CCS[C@H]1CCCC[C@@H]1NC(=O)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000561583642 932758792 /nfs/dbraw/zinc/75/87/92/932758792.db2.gz HMAFYVAZLZOKGJ-RDJZCZTQSA-N 0 0 365.499 3.843 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)NCCCCNc1ccccn1 ZINC000276594661 932764249 /nfs/dbraw/zinc/76/42/49/932764249.db2.gz NNKCBHDEABCUFP-UHFFFAOYSA-N 0 0 362.817 3.574 20 5 FHBDRN COc1cnccc1[C@@H](C)NC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000187438670 932771159 /nfs/dbraw/zinc/77/11/59/932771159.db2.gz IDRBJAVJWJFQLF-SECBINFHSA-N 0 0 350.762 3.535 20 5 FHBDRN CC[C@H](OC(=O)C[C@H]1C(=O)Nc2c1cccc2F)c1cccc([N+](=O)[O-])c1 ZINC001266835746 932810974 /nfs/dbraw/zinc/81/09/74/932810974.db2.gz PAJSYOCWUNJZSI-ZBFHGGJFSA-N 0 0 372.352 3.854 20 5 FHBDRN O=[N+]([O-])c1ccc2c(-c3nc(Cc4ccc(F)cc4F)no3)c[nH]c2c1 ZINC000544947042 932812851 /nfs/dbraw/zinc/81/28/51/932812851.db2.gz PIHUBZCYNNRMGL-UHFFFAOYSA-N 0 0 356.288 3.995 20 5 FHBDRN O=C(Nc1ccc(C(F)(F)F)nc1)[C@@H]1C[C@H]1c1cccc([N+](=O)[O-])c1 ZINC001266838287 932816562 /nfs/dbraw/zinc/81/65/62/932816562.db2.gz IOYNZDQWOHNSLG-QWHCGFSZSA-N 0 0 351.284 3.751 20 5 FHBDRN C[C@H]1CCc2c(F)cccc2[C@@H]1NC(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000430671094 932851662 /nfs/dbraw/zinc/85/16/62/932851662.db2.gz WAZDWNGKPRRZMN-RNODOKPDSA-N 0 0 372.396 3.943 20 5 FHBDRN COc1ccc(C(=O)N[C@H]2c3cccc(F)c3CC[C@H]2C)cc1[N+](=O)[O-] ZINC000430672106 932853433 /nfs/dbraw/zinc/85/34/33/932853433.db2.gz YMRMQSSLTUIMQU-ADLMAVQZSA-N 0 0 358.369 3.796 20 5 FHBDRN O=C(Cc1cccc([N+](=O)[O-])c1)N(Cc1ccco1)Cc1ccc(O)cc1 ZINC000175950417 932855444 /nfs/dbraw/zinc/85/54/44/932855444.db2.gz ZOALZUCPGQBYGB-UHFFFAOYSA-N 0 0 366.373 3.665 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])N(CC1CCC1)CC(F)(F)F ZINC000175949427 932855496 /nfs/dbraw/zinc/85/54/96/932855496.db2.gz MNXZBKYKRIGYCP-UHFFFAOYSA-N 0 0 360.332 3.555 20 5 FHBDRN Cc1cc(OCC(=O)N(Cc2ccccc2)CC(F)F)ccc1[N+](=O)[O-] ZINC000430675898 932859371 /nfs/dbraw/zinc/85/93/71/932859371.db2.gz GSFWZSOBXZLTNJ-UHFFFAOYSA-N 0 0 364.348 3.576 20 5 FHBDRN COC(=O)c1cc(NC(=O)[C@@H](C)Cc2ccccc2)c(C)c([N+](=O)[O-])c1 ZINC000561615579 932870195 /nfs/dbraw/zinc/87/01/95/932870195.db2.gz KJPGSNMIHHPXPS-LBPRGKRZSA-N 0 0 356.378 3.507 20 5 FHBDRN O=c1ccc(-c2ccc(F)cc2)nn1Cc1ccc([N+](=O)[O-])cc1Cl ZINC000561618283 932874221 /nfs/dbraw/zinc/87/42/21/932874221.db2.gz VRIIHHYKGITSGI-UHFFFAOYSA-N 0 0 359.744 3.659 20 5 FHBDRN C[C@@H](Nc1ccc(Cc2nnc3n2CCC3)cc1)c1ccccc1[N+](=O)[O-] ZINC000276672120 932880921 /nfs/dbraw/zinc/88/09/21/932880921.db2.gz ZBZMXQKGGLOYKF-CQSZACIVSA-N 0 0 363.421 3.896 20 5 FHBDRN C[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)CCN1Cc1ccc([N+](=O)[O-])cc1F ZINC000134664368 932891228 /nfs/dbraw/zinc/89/12/28/932891228.db2.gz GRKIKEOHDTUWGB-OCCSQVGLSA-N 0 0 367.421 3.612 20 5 FHBDRN Cc1cc(OCC(=O)N2CCSC[C@@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000430681366 932908494 /nfs/dbraw/zinc/90/84/94/932908494.db2.gz QPXHKBXATMSVAS-GOSISDBHSA-N 0 0 372.446 3.599 20 5 FHBDRN C[C@H](CCc1ccccc1)NC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000121521249 932916910 /nfs/dbraw/zinc/91/69/10/932916910.db2.gz NDXXARSMFCDYDN-OAHLLOKOSA-N 0 0 353.422 3.684 20 5 FHBDRN O=C(Cc1ccc(F)cc1[N+](=O)[O-])Nc1ccc2[nH]c(C(F)F)nc2c1 ZINC001266852324 932921232 /nfs/dbraw/zinc/92/12/32/932921232.db2.gz XNGHHNQKCHBYTD-UHFFFAOYSA-N 0 0 364.283 3.729 20 5 FHBDRN Cc1cc(C(=O)N2CC[C@](F)(c3cc(F)cc(F)c3)C2)cc([N+](=O)[O-])c1 ZINC000581899512 932927435 /nfs/dbraw/zinc/92/74/35/932927435.db2.gz WRRNMBAAIJRNJY-GOSISDBHSA-N 0 0 364.323 3.892 20 5 FHBDRN C[C@]1(C2CCCCC2)NC(=O)N(Cc2ccc([N+](=O)[O-])cc2Cl)C1=O ZINC000561632113 932928277 /nfs/dbraw/zinc/92/82/77/932928277.db2.gz AVUZYIKAPRUXNZ-QGZVFWFLSA-N 0 0 365.817 3.639 20 5 FHBDRN COc1ccc(/C=C(/C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)cc1F ZINC000588435850 932938295 /nfs/dbraw/zinc/93/82/95/932938295.db2.gz OSWSCGWCUIBXJA-FLIBITNWSA-N 0 0 360.341 3.793 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(C(=O)NC2CC2)c1 ZINC000588436195 932942429 /nfs/dbraw/zinc/94/24/29/932942429.db2.gz HGQGWJKICMXANV-QBFSEMIESA-N 0 0 365.389 3.529 20 5 FHBDRN COc1ccc([C@@H](C)CCNC(=O)NCc2cccc([N+](=O)[O-])c2)cc1 ZINC000175976515 932944601 /nfs/dbraw/zinc/94/46/01/932944601.db2.gz SRDKKVNMMULCMX-AWEZNQCLSA-N 0 0 357.410 3.596 20 5 FHBDRN CC[C@H](CCO)CNC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000178241288 932946835 /nfs/dbraw/zinc/94/68/35/932946835.db2.gz KFIMMJOCDMTKKQ-CQSZACIVSA-N 0 0 374.462 3.884 20 5 FHBDRN CC[C@@H](CCO)CNC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000178241279 932947187 /nfs/dbraw/zinc/94/71/87/932947187.db2.gz KFIMMJOCDMTKKQ-AWEZNQCLSA-N 0 0 374.462 3.884 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(N2CCO[C@H](c3cccc(C(F)(F)F)c3)C2)n1 ZINC000178244962 932967464 /nfs/dbraw/zinc/96/74/64/932967464.db2.gz FNSNUJBFKBKUCB-HNNXBMFYSA-N 0 0 367.327 3.895 20 5 FHBDRN O=c1c2cc3ccccc3cc2ncn1C[C@H](O)c1c(F)cccc1F ZINC000051288524 932969254 /nfs/dbraw/zinc/96/92/54/932969254.db2.gz XPUHFUPOEIYRKJ-SFHVURJKSA-N 0 0 352.340 3.562 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2noc(-c3cc(F)ccc3-n3cccn3)n2)cc1 ZINC000581908968 932984319 /nfs/dbraw/zinc/98/43/19/932984319.db2.gz DPXRFSZVTGZLHX-UHFFFAOYSA-N 0 0 351.297 3.637 20 5 FHBDRN O=C(Nc1ccc(Cl)c(C(F)(F)F)c1)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC000187542529 932997934 /nfs/dbraw/zinc/99/79/34/932997934.db2.gz AXRJHSGACCNQDO-UHFFFAOYSA-N 0 0 361.663 3.620 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)NC1(Cc2cccc(F)c2)CCC1 ZINC000187549454 933000915 /nfs/dbraw/zinc/00/09/15/933000915.db2.gz LRKYFCCJVBUZBK-UHFFFAOYSA-N 0 0 356.397 3.948 20 5 FHBDRN CCc1ccc([C@H]2CCCCCN2C(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)o1 ZINC000187565479 933003912 /nfs/dbraw/zinc/00/39/12/933003912.db2.gz WYDIZZYVPGOMNY-CQSZACIVSA-N 0 0 359.382 3.608 20 5 FHBDRN Cc1ccc(C(=O)NCCc2cccc([N+](=O)[O-])c2)cc1C(F)(F)F ZINC001266862061 933019028 /nfs/dbraw/zinc/01/90/28/933019028.db2.gz CCBGKKVQEBJSSO-UHFFFAOYSA-N 0 0 352.312 3.895 20 5 FHBDRN Cc1sc(C(=O)NCCc2cccc([N+](=O)[O-])c2)cc1Br ZINC001266863164 933029209 /nfs/dbraw/zinc/02/92/09/933029209.db2.gz NBNWGKWHSMRUCD-UHFFFAOYSA-N 0 0 369.240 3.700 20 5 FHBDRN CC[C@@H](NC(=O)NCc1ccc(OC)c([N+](=O)[O-])c1)c1ccc(C)cc1 ZINC000510495434 933035308 /nfs/dbraw/zinc/03/53/08/933035308.db2.gz DGGPYFHOKDQZHW-MRXNPFEDSA-N 0 0 357.410 3.862 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N[C@H](C)c1nc(C(C)(C)C)no1 ZINC000588439756 933064167 /nfs/dbraw/zinc/06/41/67/933064167.db2.gz WMFMSFVZKFTBRY-NLYDNYMLSA-N 0 0 358.398 3.556 20 5 FHBDRN Cc1c([C@@H](C)NCc2ccncc2OC[C@H]2CCOC2)cccc1[N+](=O)[O-] ZINC000287217412 933070609 /nfs/dbraw/zinc/07/06/09/933070609.db2.gz FUBJZYAKMCGODW-CVEARBPZSA-N 0 0 371.437 3.564 20 5 FHBDRN CCCOc1ncccc1CNC(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000175999400 933073413 /nfs/dbraw/zinc/07/34/13/933073413.db2.gz PSBHDAAWDQEBOJ-CQSZACIVSA-N 0 0 372.425 3.647 20 5 FHBDRN COc1cc(NC(=O)c2ccc([N+](=O)[O-])cc2Br)ccc1F ZINC000187632758 933105723 /nfs/dbraw/zinc/10/57/23/933105723.db2.gz KHPRFNDNRANFAO-UHFFFAOYSA-N 0 0 369.146 3.757 20 5 FHBDRN CCN(CC)C(=O)c1ccc(C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)cc1 ZINC000086624678 933111454 /nfs/dbraw/zinc/11/14/54/933111454.db2.gz LWCPYRRZJHWTKA-UHFFFAOYSA-N 0 0 369.421 3.946 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N1CCO[C@@H](c2ccccc2F)C1 ZINC000588445135 933111572 /nfs/dbraw/zinc/11/15/72/933111572.db2.gz NAFDWEJKSMSIHR-LUQQZNFBSA-N 0 0 370.380 3.737 20 5 FHBDRN CC[C@@H](c1ccccc1OC)N(C)C(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000581969037 933141918 /nfs/dbraw/zinc/14/19/18/933141918.db2.gz OHLKSLKNWZKLQV-INIZCTEOSA-N 0 0 372.421 3.982 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N[C@H](C)CCc1ccc(O)cc1 ZINC000588446831 933163512 /nfs/dbraw/zinc/16/35/12/933163512.db2.gz ACNSHMMWQYJUQG-SEWDUPMJSA-N 0 0 354.406 3.841 20 5 FHBDRN O=C(NC[C@@H]1CCCS1)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12 ZINC000548378510 933165108 /nfs/dbraw/zinc/16/51/08/933165108.db2.gz APTQMCZLFGMHGT-LBPRGKRZSA-N 0 0 374.412 3.585 20 5 FHBDRN Cc1cc(OCC(=O)N2CCC[C@H]2/C=C/c2ccccc2)ccc1[N+](=O)[O-] ZINC000430786305 933230425 /nfs/dbraw/zinc/23/04/25/933230425.db2.gz PFLMAWRHEINFQT-BBVFFXRHSA-N 0 0 366.417 3.986 20 5 FHBDRN Cc1cc(OCC(=O)Nc2ccc3nc(C4CC4)oc3c2)ccc1[N+](=O)[O-] ZINC000430798617 933236536 /nfs/dbraw/zinc/23/65/36/933236536.db2.gz UYHMEBAEIOSXQG-UHFFFAOYSA-N 0 0 367.361 3.939 20 5 FHBDRN O=C(CO[C@@H]1CCCc2ccccc21)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000430784094 933236558 /nfs/dbraw/zinc/23/65/58/933236558.db2.gz PJOUEQCTALNWBP-HXUWFJFHSA-N 0 0 366.417 3.968 20 5 FHBDRN O=C(Nc1cccc2c1CCO2)c1sc(Br)cc1[N+](=O)[O-] ZINC000477722408 933239056 /nfs/dbraw/zinc/23/90/56/933239056.db2.gz UBWMWAQAKUFVLX-UHFFFAOYSA-N 0 0 369.196 3.606 20 5 FHBDRN CSc1ccc(C(=O)NCc2c(F)cc(F)c(F)c2F)cc1[N+](=O)[O-] ZINC000430811848 933247734 /nfs/dbraw/zinc/24/77/34/933247734.db2.gz SOSUBSZRFLQEKT-UHFFFAOYSA-N 0 0 374.315 3.803 20 5 FHBDRN O=[N+]([O-])c1ccc(CN2CCO[C@H](c3cccc(OC(F)F)c3)C2)cc1 ZINC000127362342 933251942 /nfs/dbraw/zinc/25/19/42/933251942.db2.gz DRGNDBGRZRFTQU-KRWDZBQOSA-N 0 0 364.348 3.770 20 5 FHBDRN O=C(Nc1cccc2c1CCO2)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000477729991 933254871 /nfs/dbraw/zinc/25/48/71/933254871.db2.gz UHHRGAYHGUKYIN-UHFFFAOYSA-N 0 0 367.386 3.906 20 5 FHBDRN Cc1ccc(OCCC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)c(C)c1 ZINC000088231116 933268647 /nfs/dbraw/zinc/26/86/47/933268647.db2.gz CDLCOZBCMZQCKQ-UHFFFAOYSA-N 0 0 354.406 3.565 20 5 FHBDRN Cc1cc(OCC(=O)N2CC[C@@H](c3ccccc3)[C@H]2C)ccc1[N+](=O)[O-] ZINC000430832776 933284663 /nfs/dbraw/zinc/28/46/63/933284663.db2.gz JFOQSHHGUPGIMV-CRAIPNDOSA-N 0 0 354.406 3.687 20 5 FHBDRN Cc1cc(OCC(=O)N2CC[C@H](c3ccccc3)[C@H]2C)ccc1[N+](=O)[O-] ZINC000430832778 933284865 /nfs/dbraw/zinc/28/48/65/933284865.db2.gz JFOQSHHGUPGIMV-QAPCUYQASA-N 0 0 354.406 3.687 20 5 FHBDRN Cc1cc(OCC(=O)N(C)Cc2ccc(Cl)s2)ccc1[N+](=O)[O-] ZINC000098074288 933289062 /nfs/dbraw/zinc/28/90/62/933289062.db2.gz ZTEJOOUCEVHQQE-UHFFFAOYSA-N 0 0 354.815 3.656 20 5 FHBDRN CCNc1ccc(C(=O)OCC)cc1NC(=O)c1cccc([N+](=O)[O-])c1C ZINC000098072642 933308628 /nfs/dbraw/zinc/30/86/28/933308628.db2.gz ZLFDGERTMCZRDY-UHFFFAOYSA-N 0 0 371.393 3.764 20 5 FHBDRN CCOC(=O)c1csc([C@@H]2CCCN2c2ccc(F)cc2[N+](=O)[O-])n1 ZINC000276774820 933329110 /nfs/dbraw/zinc/32/91/10/933329110.db2.gz HOHHLGPENOFEQG-ZDUSSCGKSA-N 0 0 365.386 3.709 20 5 FHBDRN Cc1ccc(C(=O)N[C@H](C)c2ccc(Br)cn2)cc1[N+](=O)[O-] ZINC000477767449 933373088 /nfs/dbraw/zinc/37/30/88/933373088.db2.gz RCYGOALSSWBDNG-SNVBAGLBSA-N 0 0 364.199 3.552 20 5 FHBDRN CC1(C)CN(C(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)CC2(CCCC2)O1 ZINC000408435156 933402723 /nfs/dbraw/zinc/40/27/23/933402723.db2.gz VGDKSCMYDUBLFV-UHFFFAOYSA-N 0 0 357.410 3.640 20 5 FHBDRN CCOc1ccc(COc2ccc(Br)cc2[N+](=O)[O-])nc1 ZINC000610585155 933427459 /nfs/dbraw/zinc/42/74/59/933427459.db2.gz DJVVTJDPDLQHLS-UHFFFAOYSA-N 0 0 353.172 3.730 20 5 FHBDRN COc1cc(N2C[C@H](C(F)(F)F)[C@@H](C(F)(F)F)C2)ccc1[N+](=O)[O-] ZINC000610587772 933439211 /nfs/dbraw/zinc/43/92/11/933439211.db2.gz YEXIRCBAUZAYHM-IUCAKERBSA-N 0 0 358.238 3.780 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)NC[C@@H]2OCCc3ccccc32)cc1[N+](=O)[O-] ZINC000610597070 933482914 /nfs/dbraw/zinc/48/29/14/933482914.db2.gz VAHVOZPZLSYVEN-LIRRHRJNSA-N 0 0 369.421 3.577 20 5 FHBDRN C[C@H]1Oc2ccccc2[C@@H]1Nc1ncc([N+](=O)[O-])cc1Br ZINC000561701731 933494979 /nfs/dbraw/zinc/49/49/79/933494979.db2.gz PIENOAMEVFILLC-AMIZOPFISA-N 0 0 350.172 3.686 20 5 FHBDRN Cc1c(C(=O)N2C[C@H](C(F)(F)F)[C@H](C(F)(F)F)C2)cccc1[N+](=O)[O-] ZINC000610598045 933497039 /nfs/dbraw/zinc/49/70/39/933497039.db2.gz QCOGPJVDDZMWPS-AOOOYVTPSA-N 0 0 370.249 3.716 20 5 FHBDRN Cc1c(C(=O)N2C[C@H](C(F)(F)F)[C@@H](C(F)(F)F)C2)cccc1[N+](=O)[O-] ZINC000610598047 933497244 /nfs/dbraw/zinc/49/72/44/933497244.db2.gz QCOGPJVDDZMWPS-UWVGGRQHSA-N 0 0 370.249 3.716 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NCCc1ccc(OC(C)C)cc1 ZINC000548408437 933497296 /nfs/dbraw/zinc/49/72/96/933497296.db2.gz DRYJPWVSJFVHAD-UHFFFAOYSA-N 0 0 373.409 3.755 20 5 FHBDRN O=C(Nc1ccc(OC2CCCC2)c(Cl)c1)c1c[nH]nc1[N+](=O)[O-] ZINC000548412060 933520528 /nfs/dbraw/zinc/52/05/28/933520528.db2.gz ALEQBKOVVOQFTN-UHFFFAOYSA-N 0 0 350.762 3.545 20 5 FHBDRN CC(C)N(Cc1ccc(Cl)c(Cl)c1)C(=O)c1c[nH]nc1[N+](=O)[O-] ZINC000548411970 933529304 /nfs/dbraw/zinc/52/93/04/933529304.db2.gz UKIJQDUSEOROQJ-UHFFFAOYSA-N 0 0 357.197 3.676 20 5 FHBDRN O=[N+]([O-])c1ccc(CN2CCCC[C@H]2c2nnc(C3CCOCC3)o2)cc1 ZINC000276805348 933537345 /nfs/dbraw/zinc/53/73/45/933537345.db2.gz GTBNEPWTHOZQNX-KRWDZBQOSA-N 0 0 372.425 3.599 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)Nc2ccc3c(c2)OCCCO3)cc1[N+](=O)[O-] ZINC000610627559 933547952 /nfs/dbraw/zinc/54/79/52/933547952.db2.gz AIVVOQNGFMYZBM-CYBMUJFWSA-N 0 0 371.393 3.947 20 5 FHBDRN CC(C)OCc1ccccc1CNC(=O)Nc1cc(F)cc([N+](=O)[O-])c1 ZINC000548416670 933565389 /nfs/dbraw/zinc/56/53/89/933565389.db2.gz FECKXLIWUPIRAL-UHFFFAOYSA-N 0 0 361.373 3.981 20 5 FHBDRN Cc1cccc2oc(CCNC(=O)[C@H]3C[C@@H]3c3cccc([N+](=O)[O-])c3)nc21 ZINC000933822626 933577451 /nfs/dbraw/zinc/57/74/51/933577451.db2.gz QKDLEDZFZOYPHW-CVEARBPZSA-N 0 0 365.389 3.507 20 5 FHBDRN Cc1ccccc1NC(=O)[C@H](C)OC(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000003485121 933588277 /nfs/dbraw/zinc/58/82/77/933588277.db2.gz QYNMYBACSFMGOU-NSHDSACASA-N 0 0 362.769 3.741 20 5 FHBDRN COc1ccc(NC(=O)CN2c3ccccc3SC[C@@H]2C)c([N+](=O)[O-])c1 ZINC000430999564 933642214 /nfs/dbraw/zinc/64/22/14/933642214.db2.gz LWXPPMXYVXNREQ-LBPRGKRZSA-N 0 0 373.434 3.543 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)CCCc1ccc2[nH]c(=O)[nH]c2c1 ZINC000610664435 933681668 /nfs/dbraw/zinc/68/16/68/933681668.db2.gz AETGJAHTXRMNDZ-UHFFFAOYSA-N 0 0 368.393 3.755 20 5 FHBDRN O=[N+]([O-])c1cc(F)c(CN[C@@H]2CCO[C@@H]2c2ccc(F)c(F)c2)c(F)c1 ZINC000510793444 933731144 /nfs/dbraw/zinc/73/11/44/933731144.db2.gz AFILTMRZAAMPKZ-IAGOWNOFSA-N 0 0 370.302 3.771 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])N1CCCc2cccc(OC(F)F)c21 ZINC000098106549 933761748 /nfs/dbraw/zinc/76/17/48/933761748.db2.gz PRBFEQITBMJJPQ-UHFFFAOYSA-N 0 0 362.332 3.718 20 5 FHBDRN C[C@H](CCc1ccccc1)NC(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000510802846 933761911 /nfs/dbraw/zinc/76/19/11/933761911.db2.gz JADDPOGVDTXCDU-MRXNPFEDSA-N 0 0 355.438 3.800 20 5 FHBDRN Cc1nn(C)c(C(=O)N([C@@H](C)c2ccc(Cl)cc2)C2CC2)c1[N+](=O)[O-] ZINC000098100396 933763887 /nfs/dbraw/zinc/76/38/87/933763887.db2.gz ALAZUMCYWLKECJ-NSHDSACASA-N 0 0 362.817 3.656 20 5 FHBDRN CCOc1cc(NC(=O)Cc2ccc(C)s2)c([N+](=O)[O-])cc1OCC ZINC000098101828 933771892 /nfs/dbraw/zinc/77/18/92/933771892.db2.gz PTHHTMGTFYDFGT-UHFFFAOYSA-N 0 0 364.423 3.943 20 5 FHBDRN Cc1nn(C)c(C(=O)N([C@H](C)c2ccc(Cl)cc2)C2CC2)c1[N+](=O)[O-] ZINC000098100397 933771989 /nfs/dbraw/zinc/77/19/89/933771989.db2.gz ALAZUMCYWLKECJ-LLVKDONJSA-N 0 0 362.817 3.656 20 5 FHBDRN CCOC(=O)C1CCC(CC(=O)Nc2cccc([N+](=O)[O-])c2Cl)CC1 ZINC000843591290 933784662 /nfs/dbraw/zinc/78/46/62/933784662.db2.gz XDTZOJPFNOUETJ-UHFFFAOYSA-N 0 0 368.817 3.946 20 5 FHBDRN COC(=O)Nc1cc(NC(=O)c2cccc(Cl)c2[N+](=O)[O-])ccc1F ZINC000176141013 933821552 /nfs/dbraw/zinc/82/15/52/933821552.db2.gz BXJMTDOFHPBFBX-UHFFFAOYSA-N 0 0 367.720 3.818 20 5 FHBDRN O=c1[nH]cnc2cc(NCCCCc3ccc(F)c(F)c3)c([N+](=O)[O-])cc12 ZINC000548447050 933848657 /nfs/dbraw/zinc/84/86/57/933848657.db2.gz SAPNJABAVRUMAY-UHFFFAOYSA-N 0 0 374.347 3.957 20 5 FHBDRN O=C(Nc1ccc(Br)c([N+](=O)[O-])c1)c1nccc2cccnc21 ZINC001266938652 933856322 /nfs/dbraw/zinc/85/63/22/933856322.db2.gz MDUCKXSVRGRCES-UHFFFAOYSA-N 0 0 373.166 3.553 20 5 FHBDRN C[C@H](NC(=O)N[C@@H]1COc2c1cccc2Cl)c1cccc([N+](=O)[O-])c1 ZINC000610707408 933858243 /nfs/dbraw/zinc/85/82/43/933858243.db2.gz GTILGUGRUZGLHI-ZUZCIYMTSA-N 0 0 361.785 3.742 20 5 FHBDRN CC1(C)CN(S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])c2ccccc21 ZINC000610706790 933861505 /nfs/dbraw/zinc/86/15/05/933861505.db2.gz CBSBKKQMHQIJSC-UHFFFAOYSA-N 0 0 366.826 3.735 20 5 FHBDRN O=C(N[C@@H]1COc2c1cccc2Cl)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000610709605 933872869 /nfs/dbraw/zinc/87/28/69/933872869.db2.gz DEGPAJWFZNQIIH-CYBMUJFWSA-N 0 0 353.161 3.765 20 5 FHBDRN CCNc1ccc(C(=O)N[C@H]2COc3c2cccc3Cl)cc1[N+](=O)[O-] ZINC000610709811 933877214 /nfs/dbraw/zinc/87/72/14/933877214.db2.gz WPBGQLBUSOHMEN-AWEZNQCLSA-N 0 0 361.785 3.544 20 5 FHBDRN O=C(N[C@H]1COc2c1cccc2Cl)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000610712502 933886169 /nfs/dbraw/zinc/88/61/69/933886169.db2.gz MFWMHSRATKWABH-ZDUSSCGKSA-N 0 0 357.753 3.593 20 5 FHBDRN COc1cccc(Cc2noc(-c3c[nH]c4ccc([N+](=O)[O-])cc43)n2)c1 ZINC000544979138 933888626 /nfs/dbraw/zinc/88/86/26/933888626.db2.gz KHFVJZZLKRPBIA-UHFFFAOYSA-N 0 0 350.334 3.726 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)NCc1ncc(-c2ccccc2)cn1 ZINC000588463891 933889632 /nfs/dbraw/zinc/88/96/32/933889632.db2.gz GUNLFTYFHAOVEW-PTNGSMBKSA-N 0 0 374.400 3.772 20 5 FHBDRN CC(=O)N(C)c1ccc(NC(=O)c2cc(Cl)c(C)cc2[N+](=O)[O-])cc1 ZINC001125550672 933895387 /nfs/dbraw/zinc/89/53/87/933895387.db2.gz PGQDVVXTKCDXLL-UHFFFAOYSA-N 0 0 361.785 3.792 20 5 FHBDRN COc1ccccc1OCCCNc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000610715410 933906259 /nfs/dbraw/zinc/90/62/59/933906259.db2.gz SDFNKQVPZZMLRT-UHFFFAOYSA-N 0 0 350.346 3.632 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(C)cc2OC)cc1OC ZINC000055818821 933906327 /nfs/dbraw/zinc/90/63/27/933906327.db2.gz CPTXAGSKZGBBCO-UHFFFAOYSA-N 0 0 360.366 3.571 20 5 FHBDRN CC(C)(CNc1ncc([N+](=O)[O-])cc1Br)[C@@H]1CCCCO1 ZINC000610716825 933913890 /nfs/dbraw/zinc/91/38/90/933913890.db2.gz VXIUAMWVEVQHNP-LBPRGKRZSA-N 0 0 358.236 3.760 20 5 FHBDRN Cc1cccc(CC2CN(c3ncc([N+](=O)[O-])cc3Br)C2)c1 ZINC000610716443 933921632 /nfs/dbraw/zinc/92/16/32/933921632.db2.gz QPGGVYNIWRRXPB-UHFFFAOYSA-N 0 0 362.227 3.740 20 5 FHBDRN O=C(N[C@@H]1C[C@H]1c1ccccc1Br)c1ccc([N+](=O)[O-])cc1 ZINC000431150988 933943863 /nfs/dbraw/zinc/94/38/63/933943863.db2.gz IBZUBFGKUARDFL-DZGCQCFKSA-N 0 0 361.195 3.643 20 5 FHBDRN COc1cccc([C@H]2CN(c3ccc4ncccc4c3[N+](=O)[O-])CCO2)c1 ZINC000178403591 933957030 /nfs/dbraw/zinc/95/70/30/933957030.db2.gz MLMDSGLDUYSIEB-LJQANCHMSA-N 0 0 365.389 3.730 20 5 FHBDRN O=C(C[C@H]1CCCN1Cc1nc2cc([N+](=O)[O-])ccc2o1)c1ccccc1 ZINC000610720136 933958023 /nfs/dbraw/zinc/95/80/23/933958023.db2.gz UFJSVWAANHCBPV-OAHLLOKOSA-N 0 0 365.389 3.973 20 5 FHBDRN Cc1nc(-c2ccccc2)ncc1C(=O)N1CCc2c1cccc2[N+](=O)[O-] ZINC000178404067 933959200 /nfs/dbraw/zinc/95/92/00/933959200.db2.gz PPZHHWYNUIGOPK-UHFFFAOYSA-N 0 0 360.373 3.563 20 5 FHBDRN C[C@@H](NC(=O)N(C)CCc1cccc([N+](=O)[O-])c1)c1c(F)cccc1F ZINC000510896283 933982794 /nfs/dbraw/zinc/98/27/94/933982794.db2.gz KPXYSBWJOZDNFR-GFCCVEGCSA-N 0 0 363.364 3.818 20 5 FHBDRN CSCc1cccc(CNC(=O)c2ccc([N+](=O)[O-])c3cccnc23)c1 ZINC000187656809 933983388 /nfs/dbraw/zinc/98/33/88/933983388.db2.gz AHVFXTQFNYDBNL-UHFFFAOYSA-N 0 0 367.430 3.936 20 5 FHBDRN CCc1ccc(C(=O)N(CC[NH+](C)C)Cc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000471943238 933986499 /nfs/dbraw/zinc/98/64/99/933986499.db2.gz VHDCOFDOPRFYBM-UHFFFAOYSA-N 0 0 373.428 3.500 20 5 FHBDRN O=C(NCc1nc(-c2ccncc2)cs1)c1cccc(Cl)c1[N+](=O)[O-] ZINC000176072540 934004419 /nfs/dbraw/zinc/00/44/19/934004419.db2.gz CZAOLDGCKPJJQH-UHFFFAOYSA-N 0 0 374.809 3.697 20 5 FHBDRN COC(=O)c1ccccc1C(=O)c1ccc(NC2CC=CC2)c([N+](=O)[O-])c1 ZINC000610735276 934022526 /nfs/dbraw/zinc/02/25/26/934022526.db2.gz SORXVHZBOUHUPY-UHFFFAOYSA-N 0 0 366.373 3.743 20 5 FHBDRN Cc1c(NC(=O)C2C[C@H](C)O[C@@H](C)C2)cc(Br)cc1[N+](=O)[O-] ZINC000431182995 934052626 /nfs/dbraw/zinc/05/26/26/934052626.db2.gz WFDKCBJSHXYDCV-IUCAKERBSA-N 0 0 371.231 3.808 20 5 FHBDRN C[C@@H](c1ccccc1)n1ccc(=NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])[nH]1 ZINC000610746338 934069394 /nfs/dbraw/zinc/06/93/94/934069394.db2.gz ZNVDXTQLFJUSRZ-LBPRGKRZSA-N 0 0 370.796 3.728 20 5 FHBDRN O=C(COC(=O)c1cccc([N+](=O)[O-])c1)Nc1c(Cl)cccc1Cl ZINC000003506688 934158511 /nfs/dbraw/zinc/15/85/11/934158511.db2.gz UXIGLPLOQUGSJJ-UHFFFAOYSA-N 0 0 369.160 3.697 20 5 FHBDRN O=C(c1cccc(Cl)c1[N+](=O)[O-])N1CCO[C@H](c2ccccc2F)C1 ZINC000176128036 934197165 /nfs/dbraw/zinc/19/71/65/934197165.db2.gz GRRYZICNYNXPFZ-HNNXBMFYSA-N 0 0 364.760 3.601 20 5 FHBDRN CC(C)[C@@H]1c2ccccc2CCN1C(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000610792271 934209045 /nfs/dbraw/zinc/20/90/45/934209045.db2.gz XCZKFEXXAAZHSD-HXUWFJFHSA-N 0 0 354.406 3.756 20 5 FHBDRN O=[N+]([O-])c1cccc(Br)c1OCCOc1ccccc1F ZINC000431217980 934217891 /nfs/dbraw/zinc/21/78/91/934217891.db2.gz DEJIGGSVRKZMPL-UHFFFAOYSA-N 0 0 356.147 3.954 20 5 FHBDRN CCCN(Cc1cc([N+](=O)[O-])ccc1OC)C[C@@H]1COc2ccccc2O1 ZINC000610795968 934222640 /nfs/dbraw/zinc/22/26/40/934222640.db2.gz NKBYIQRKOBQPJU-QGZVFWFLSA-N 0 0 372.421 3.655 20 5 FHBDRN CN1C(=O)N(CCCCc2ccc([N+](=O)[O-])cc2)C(=O)[C@H]1c1ccccc1 ZINC000431228420 934230070 /nfs/dbraw/zinc/23/00/70/934230070.db2.gz HSCLVIFJQZQYFC-GOSISDBHSA-N 0 0 367.405 3.553 20 5 FHBDRN CCCCO[C@@H](C)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000431237619 934240343 /nfs/dbraw/zinc/24/03/43/934240343.db2.gz QWQSWVXRMCXFID-JTQLQIEISA-N 0 0 359.220 3.809 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H](CC(C)C)C(=O)OC(C)(C)C ZINC000535678406 934257806 /nfs/dbraw/zinc/25/78/06/934257806.db2.gz BNAQTTPEZDXYIA-HNNXBMFYSA-N 0 0 365.430 3.781 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NC1CCC(OC)CC1 ZINC000458053542 934262175 /nfs/dbraw/zinc/26/21/75/934262175.db2.gz ABSPYFJXJIPQOD-UHFFFAOYSA-N 0 0 352.456 3.784 20 5 FHBDRN CCc1cccc2c1OCC[C@@H]2NC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000535671694 934266939 /nfs/dbraw/zinc/26/69/39/934266939.db2.gz IFAFMHSJWFCZAH-HNNXBMFYSA-N 0 0 365.389 3.892 20 5 FHBDRN C[C@H]1CN(C(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)[C@@H](c2ccccc2)CO1 ZINC000535705668 934287227 /nfs/dbraw/zinc/28/72/27/934287227.db2.gz XQXALSFSDWXBGD-SCLBCKFNSA-N 0 0 365.389 3.678 20 5 FHBDRN Cc1cccc(OCCN(C)C(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)c1 ZINC000535696360 934289798 /nfs/dbraw/zinc/28/97/98/934289798.db2.gz KEQQPAYCLWXJQP-UHFFFAOYSA-N 0 0 353.378 3.536 20 5 FHBDRN CCCOC1(CNC(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)CCCCC1 ZINC000535698542 934292430 /nfs/dbraw/zinc/29/24/30/934292430.db2.gz DIFGLGZIXABFLY-UHFFFAOYSA-N 0 0 359.426 3.935 20 5 FHBDRN COc1ccc([C@@H](C)NC(=O)c2c[nH]c3cccc([N+](=O)[O-])c32)cc1F ZINC000535698323 934292560 /nfs/dbraw/zinc/29/25/60/934292560.db2.gz IZRFLTVLVDNYBN-SNVBAGLBSA-N 0 0 357.341 3.715 20 5 FHBDRN Cc1nn(C)c(C(=O)N2CC3(CCCCC3)[C@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000458121897 934318824 /nfs/dbraw/zinc/31/88/24/934318824.db2.gz IEWSCFZYZGFJCY-GOSISDBHSA-N 0 0 368.437 3.784 20 5 FHBDRN Cc1n[nH]c(C(=O)N2CC3(CCCCC3)[C@@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000458131581 934322614 /nfs/dbraw/zinc/32/26/14/934322614.db2.gz QMPDJROCFDMUFM-KRWDZBQOSA-N 0 0 354.410 3.774 20 5 FHBDRN Cc1n[nH]c(C(=O)N2CC3(CCCCC3)[C@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000458132166 934323002 /nfs/dbraw/zinc/32/30/02/934323002.db2.gz QMPDJROCFDMUFM-QGZVFWFLSA-N 0 0 354.410 3.774 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N1CC2(CCCCC2)[C@H]1c1ccccc1 ZINC000458137974 934327614 /nfs/dbraw/zinc/32/76/14/934327614.db2.gz VWTZBGYHFQIWIR-LJQANCHMSA-N 0 0 368.437 3.634 20 5 FHBDRN COc1ccc(OC(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])cc1F ZINC001125557456 934366779 /nfs/dbraw/zinc/36/67/79/934366779.db2.gz OALSEQSYBPYUCB-UHFFFAOYSA-N 0 0 367.354 3.692 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)Nc1cnc(-c2ccccc2)s1 ZINC000535795242 934389078 /nfs/dbraw/zinc/38/90/78/934389078.db2.gz YVIBTHVWENGMQI-UHFFFAOYSA-N 0 0 355.375 3.736 20 5 FHBDRN C[C@@H](Cc1cccc(F)c1)N(C)C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000458238485 934402311 /nfs/dbraw/zinc/40/23/11/934402311.db2.gz GGBKYDGJJJMJDQ-ZDUSSCGKSA-N 0 0 369.396 3.847 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1cnn(CC(F)(F)F)c1 ZINC000158063465 934416533 /nfs/dbraw/zinc/41/65/33/934416533.db2.gz WBQHVRSBVXTCBC-UHFFFAOYSA-N 0 0 374.344 3.718 20 5 FHBDRN CCc1cnccc1[C@@H](C)NC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000538108951 934442880 /nfs/dbraw/zinc/44/28/80/934442880.db2.gz YZCNBUUIVPURML-CYBMUJFWSA-N 0 0 356.426 3.848 20 5 FHBDRN Cc1cc2cc(NC(=O)C(=O)Nc3c(C)ccc([N+](=O)[O-])c3C)ccc2[nH]1 ZINC000121659684 934479964 /nfs/dbraw/zinc/47/99/64/934479964.db2.gz GPXRLVVLWZYSBX-UHFFFAOYSA-N 0 0 366.377 3.579 20 5 FHBDRN O=C(c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)N(CC1CC1)c1ccccc1 ZINC000084235092 934492109 /nfs/dbraw/zinc/49/21/09/934492109.db2.gz LOSPOHLGBJPURE-UHFFFAOYSA-N 0 0 362.389 3.837 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)NC[C@@H]2CCOc3ccccc32)cc1[N+](=O)[O-] ZINC000176174727 934497862 /nfs/dbraw/zinc/49/78/62/934497862.db2.gz NVLILEYBMPDZEZ-HOCLYGCPSA-N 0 0 369.421 3.830 20 5 FHBDRN O=C(OCc1ccc([N+](=O)[O-])cc1)c1cc([N+](=O)[O-])cc(Cl)c1F ZINC000754987137 934497941 /nfs/dbraw/zinc/49/79/41/934497941.db2.gz LAWQFERKSNEXPU-UHFFFAOYSA-N 0 0 354.677 3.653 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N1CCN(C)c2ccc(F)cc21 ZINC000535826479 934535587 /nfs/dbraw/zinc/53/55/87/934535587.db2.gz BENGVRNIVSHBIE-UHFFFAOYSA-N 0 0 357.385 3.756 20 5 FHBDRN Cc1nccn1-c1ccc([C@@H](C)NC(=O)c2ccc([N+](=O)[O-])cc2F)cc1 ZINC000176190667 934559196 /nfs/dbraw/zinc/55/91/96/934559196.db2.gz ZHQMPZONIFXXLR-GFCCVEGCSA-N 0 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FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)NCc1coc(-c2cccs2)n1 ZINC000176252558 934666740 /nfs/dbraw/zinc/66/67/40/934666740.db2.gz MYQUOALXNLFFJN-UHFFFAOYSA-N 0 0 357.391 3.560 20 5 FHBDRN CC1=CCN(c2ccc(S(=O)(=O)Nc3ccccc3)cc2[N+](=O)[O-])CC1 ZINC000535887985 934713197 /nfs/dbraw/zinc/71/31/97/934713197.db2.gz KWIMPCRSIWTWIL-UHFFFAOYSA-N 0 0 373.434 3.552 20 5 FHBDRN CCOc1cc(C(=O)N(C)c2ccccc2OCC)c([N+](=O)[O-])cc1OC ZINC000535893419 934722006 /nfs/dbraw/zinc/72/20/06/934722006.db2.gz VFNHNOCUOIKYQE-UHFFFAOYSA-N 0 0 374.393 3.677 20 5 FHBDRN CCc1cc(N2CCc3ncccc3C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000611006510 934742701 /nfs/dbraw/zinc/74/27/01/934742701.db2.gz HVDGNPMKJYLNIP-UHFFFAOYSA-N 0 0 361.405 3.572 20 5 FHBDRN CC[C@H](Nc1ccccc1[N+](=O)[O-])[C@H](c1ccc(C)cc1)n1cncn1 ZINC000535909245 934775817 /nfs/dbraw/zinc/77/58/17/934775817.db2.gz HAFNSRHIXVOQSB-LPHOPBHVSA-N 0 0 351.410 3.975 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(CN(C)C)c(Cl)c1 ZINC000478020071 934788979 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O=C(CCc1cccc([N+](=O)[O-])c1)N1CCC(OCC2CCCC2)CC1 ZINC000119474331 934828906 /nfs/dbraw/zinc/82/89/06/934828906.db2.gz FHCBOORZKVPICK-UHFFFAOYSA-N 0 0 360.454 3.725 20 5 FHBDRN COc1ccc(C[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2F)cc1OC ZINC000511000468 934846993 /nfs/dbraw/zinc/84/69/93/934846993.db2.gz HAVNSRPZXVQBJP-LLVKDONJSA-N 0 0 362.357 3.568 20 5 FHBDRN O=c1onc(-c2ccc([N+](=O)[O-])cc2)n1CCc1ccc2ccccc2c1 ZINC000511005423 934855246 /nfs/dbraw/zinc/85/52/46/934855246.db2.gz QOHQTPOTCRBWPF-UHFFFAOYSA-N 0 0 361.357 3.807 20 5 FHBDRN COc1ccc(NC(=O)c2ncoc2-c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000472033206 934860781 /nfs/dbraw/zinc/86/07/81/934860781.db2.gz XKEDVNHHGQQHBJ-UHFFFAOYSA-N 0 0 357.297 3.650 20 5 FHBDRN O=[N+]([O-])c1ccc(CN2CCOCC2)cc1N1CCC[C@H]1c1cccs1 ZINC000472035191 934864493 /nfs/dbraw/zinc/86/44/93/934864493.db2.gz NRCGBOOPPMGIFX-KRWDZBQOSA-N 0 0 373.478 3.830 20 5 FHBDRN C[C@H]1CC[C@H](C(F)(F)F)CN1C(=O)c1c[nH]c2ccc([N+](=O)[O-])cc21 ZINC000611561838 934867906 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369.396 3.964 20 5 FHBDRN CCCc1n[nH]c(C(=O)N2CC=C(c3cc(C)cc(C)c3)CC2)c1[N+](=O)[O-] ZINC000538819476 934910280 /nfs/dbraw/zinc/91/02/80/934910280.db2.gz XKQSECOUQLDIEI-UHFFFAOYSA-N 0 0 368.437 3.817 20 5 FHBDRN COc1cc(C(=O)NCC[C@H]2CCC[C@@H](C)C2)c([N+](=O)[O-])cc1OC ZINC000115278460 934912511 /nfs/dbraw/zinc/91/25/11/934912511.db2.gz KTXBGXHUZCOWDJ-CHWSQXEVSA-N 0 0 350.415 3.558 20 5 FHBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NCCCc1cccs1 ZINC000538805121 934913691 /nfs/dbraw/zinc/91/36/91/934913691.db2.gz CDWIMKJJTXVUDQ-NSHDSACASA-N 0 0 368.842 3.826 20 5 FHBDRN COc1ccc(CNC(=O)c2coc(C3CCCCC3)n2)cc1[N+](=O)[O-] ZINC000548587267 934933507 /nfs/dbraw/zinc/93/35/07/934933507.db2.gz PNIFYIBASWWSOO-UHFFFAOYSA-N 0 0 359.382 3.569 20 5 FHBDRN COc1ccc(-c2ccc(CN[C@H](CO)c3ccsc3)o2)c([N+](=O)[O-])c1 ZINC000472066156 934934113 /nfs/dbraw/zinc/93/41/13/934934113.db2.gz QFVUXCLXUQNFFQ-MRXNPFEDSA-N 0 0 374.418 3.748 20 5 FHBDRN C[C@@H]1CCC[C@H](OC(=O)c2ccc(Cn3cc([N+](=O)[O-])cn3)cc2)[C@@H]1C ZINC001267053598 934936384 /nfs/dbraw/zinc/93/63/84/934936384.db2.gz UEQHMWPJUQJUOQ-LBTNJELSSA-N 0 0 357.410 3.821 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)O[C@H]2CCc3cccnc32)cc1SC ZINC000277312836 934937487 /nfs/dbraw/zinc/93/74/87/934937487.db2.gz WTUBJTOOGMJETL-ZDUSSCGKSA-N 0 0 360.391 3.565 20 5 FHBDRN CCCN(C(=O)c1cc(C)cc([N+](=O)[O-])c1)[C@@H](C)C(=O)Nc1ccccc1 ZINC000119631922 934939948 /nfs/dbraw/zinc/93/99/48/934939948.db2.gz ZPDXKJPDHGJTEY-HNNXBMFYSA-N 0 0 369.421 3.783 20 5 FHBDRN COc1ccc2c(c1)C=C(C(=O)Nc1c(C)ccc([N+](=O)[O-])c1C)CO2 ZINC000119627540 934939980 /nfs/dbraw/zinc/93/99/80/934939980.db2.gz XSBUISPDHCYJCO-UHFFFAOYSA-N 0 0 354.362 3.635 20 5 FHBDRN NC(=O)c1cccc(Oc2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])c1 ZINC000071895740 934952688 /nfs/dbraw/zinc/95/26/88/934952688.db2.gz XDKVLIQUFGISPE-UHFFFAOYSA-N 0 0 362.341 3.717 20 5 FHBDRN C[C@H]1C[C@H](c2ccccc2)N(S(=O)(=O)CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000511026298 934953268 /nfs/dbraw/zinc/95/32/68/934953268.db2.gz 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C[C@H](Nc1ccc2c(c1)C(=O)CCC2)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000426183293 945092112 /nfs/dbraw/zinc/09/21/12/945092112.db2.gz KTHVMNBQUKVOKU-LBPRGKRZSA-N 0 0 353.378 3.553 20 5 FHBDRN CCOC(=O)c1cc(NC(=O)c2cc([N+](=O)[O-])ccc2C)c(F)cc1C ZINC000551679244 935326892 /nfs/dbraw/zinc/32/68/92/935326892.db2.gz QBWDKZHUDICSHV-UHFFFAOYSA-N 0 0 360.341 3.780 20 5 FHBDRN Cc1c(NCc2cccc([N+](=O)[O-])c2)cccc1C(=O)N1CCSCC1 ZINC000539935731 935327757 /nfs/dbraw/zinc/32/77/57/935327757.db2.gz NTKXPQBQZCBGGR-UHFFFAOYSA-N 0 0 371.462 3.704 20 5 FHBDRN C[C@H](Nc1ccc2ncccc2c1[N+](=O)[O-])c1nnc2n1CCCCC2 ZINC000551707609 935331372 /nfs/dbraw/zinc/33/13/72/935331372.db2.gz PNKCVVNCMAPTBV-LBPRGKRZSA-N 0 0 352.398 3.634 20 5 FHBDRN CCOC(=O)c1cc(C(=O)Nc2ccc(Cl)cc2C)cc([N+](=O)[O-])c1 ZINC000014492905 935331855 /nfs/dbraw/zinc/33/18/55/935331855.db2.gz RSVFHDBUFKUKDB-UHFFFAOYSA-N 0 0 362.769 3.986 20 5 FHBDRN O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)NC[C@@H]1CCCc2ccccc21 ZINC000582144099 935341969 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936266941 /nfs/dbraw/zinc/26/69/41/936266941.db2.gz XJSMZDCEUFVPJT-UHFFFAOYSA-N 0 0 363.373 3.755 20 5 FHBDRN Cc1cc(C)c(NC(=O)CN(C)c2ncc(Cl)cc2[N+](=O)[O-])c(C)c1 ZINC000153567339 936273973 /nfs/dbraw/zinc/27/39/73/936273973.db2.gz ZNGUPAOGDACJDN-UHFFFAOYSA-N 0 0 362.817 3.643 20 5 FHBDRN CC[C@H](C)NC(=O)c1cccc(CNc2ncc(Cl)cc2[N+](=O)[O-])c1 ZINC000153593621 936295053 /nfs/dbraw/zinc/29/50/53/936295053.db2.gz IEFHQAKKFAQPHK-NSHDSACASA-N 0 0 362.817 3.784 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1SCC1CCCC1)N1CC(F)(F)C1 ZINC000612641159 936295967 /nfs/dbraw/zinc/29/59/67/936295967.db2.gz FGLORAHEEPPIRX-UHFFFAOYSA-N 0 0 356.394 3.968 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CCC[C@@]1(CO)c1ccccc1 ZINC001203151127 936298795 /nfs/dbraw/zinc/29/87/95/936298795.db2.gz SEPSNUPZGVCOOK-HXUWFJFHSA-N 0 0 369.421 3.727 20 5 FHBDRN CCO[C@H](C)c1nc(CN(C)c2cc([N+](=O)[O-])ccc2C(C)=O)cs1 ZINC000582926426 936298946 /nfs/dbraw/zinc/29/89/46/936298946.db2.gz LLHDYQQQVFDFES-GFCCVEGCSA-N 0 0 363.439 3.988 20 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938254836 /nfs/dbraw/zinc/25/48/36/938254836.db2.gz HFXXIWJNPQUJPZ-NSHDSACASA-N 0 0 362.357 3.727 20 5 FHBDRN CCOc1ccc(C(=O)Nc2ncc(-c3cccnc3)s2)cc1[N+](=O)[O-] ZINC000583457475 938261468 /nfs/dbraw/zinc/26/14/68/938261468.db2.gz HCURAXLICIKSNI-UHFFFAOYSA-N 0 0 370.390 3.764 20 5 FHBDRN CCC1(CC)CCCN(c2cccc(S(C)(=O)=O)c2[N+](=O)[O-])CC1 ZINC000302608376 938282366 /nfs/dbraw/zinc/28/23/66/938282366.db2.gz ACXUJVWNVNXQAH-UHFFFAOYSA-N 0 0 354.472 3.795 20 5 FHBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)N1CC(c2cccc(Cl)c2)C1 ZINC000458564266 938283084 /nfs/dbraw/zinc/28/30/84/938283084.db2.gz AJQDQGXELRASRJ-UHFFFAOYSA-N 0 0 359.813 3.600 20 5 FHBDRN C[C@H](Cc1cccc(F)c1)N(C)C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000458566032 938284471 /nfs/dbraw/zinc/28/44/71/938284471.db2.gz BVMLIAIDFCCSOF-CQSZACIVSA-N 0 0 359.401 3.549 20 5 FHBDRN CCCC[C@H](C)N(C)C(=O)Nc1cc(C(=O)OC)cc([N+](=O)[O-])c1C ZINC000583534811 938295752 /nfs/dbraw/zinc/29/57/52/938295752.db2.gz GFRKBTABIDWGAA-NSHDSACASA-N 0 0 351.403 3.732 20 5 FHBDRN COc1ccc(CC[C@@H](C)NC(=O)c2cc(F)cc(C)c2[N+](=O)[O-])cc1 ZINC000176790752 938312704 /nfs/dbraw/zinc/31/27/04/938312704.db2.gz VKFMTNWQRVAXLH-CYBMUJFWSA-N 0 0 360.385 3.802 20 5 FHBDRN COc1cc(N2CC[C@]3(C2)CCc2ccccc2O3)c(F)cc1[N+](=O)[O-] ZINC000583623534 938323893 /nfs/dbraw/zinc/32/38/93/938323893.db2.gz OUKKVMHXXDIIGR-IBGZPJMESA-N 0 0 358.369 3.717 20 5 FHBDRN O=C(Nc1ccc2c[nH]nc2c1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000128140861 938328012 /nfs/dbraw/zinc/32/80/12/938328012.db2.gz AXMZOJBYJBDDSQ-UHFFFAOYSA-N 0 0 350.256 3.742 20 5 FHBDRN COc1cccc(C(=O)Nc2cc(C)nc3ccc([N+](=O)[O-])cc32)c1F ZINC000161805549 938330809 /nfs/dbraw/zinc/33/08/09/938330809.db2.gz DQXIVUARUIEFCV-UHFFFAOYSA-N 0 0 355.325 3.851 20 5 FHBDRN C[C@H](CNC(=O)NCCc1ccccc1[N+](=O)[O-])c1ccc(F)cc1F ZINC000075108793 938339817 /nfs/dbraw/zinc/33/98/17/938339817.db2.gz VUTKTCQRNRQDCX-GFCCVEGCSA-N 0 0 363.364 3.518 20 5 FHBDRN C[C@H](NC(=O)NC1(Cc2ccc(F)cc2)CC1)c1ccccc1[N+](=O)[O-] ZINC000458627545 938344477 /nfs/dbraw/zinc/34/44/77/938344477.db2.gz WCGDFJSMOXSYRK-ZDUSSCGKSA-N 0 0 357.385 3.869 20 5 FHBDRN Cc1nc([C@H]2CCCCCN2C(=O)[C@H](C)c2cccc([N+](=O)[O-])c2)no1 ZINC000583668257 938348163 /nfs/dbraw/zinc/34/81/63/938348163.db2.gz MHNLOSXKFLDRGC-MLGOLLRUSA-N 0 0 358.398 3.534 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N1CC[C@H](c2ccc(OC)cc2)C1 ZINC000536100236 938353454 /nfs/dbraw/zinc/35/34/54/938353454.db2.gz TVOANEFKGAAWDZ-HNNXBMFYSA-N 0 0 370.405 3.632 20 5 FHBDRN O=C(c1ccc(Cl)c([N+](=O)[O-])c1)n1ccccc1=Nc1ccccc1 ZINC000255576767 938360066 /nfs/dbraw/zinc/36/00/66/938360066.db2.gz AJSQTIOWFMFKBU-UHFFFAOYSA-N 0 0 353.765 3.971 20 5 FHBDRN O=[N+]([O-])c1ncccc1-c1nc(-c2ccc(Br)c(F)c2)no1 ZINC001213172278 938367953 /nfs/dbraw/zinc/36/79/53/938367953.db2.gz SEKXXUHNDKFHPB-UHFFFAOYSA-N 0 0 365.118 3.608 20 5 FHBDRN COCc1cccc(C(=O)Nc2cc(C)nc3ccc([N+](=O)[O-])cc32)c1 ZINC000161856889 938379385 /nfs/dbraw/zinc/37/93/85/938379385.db2.gz VXBHNLOONTXBFZ-UHFFFAOYSA-N 0 0 351.362 3.850 20 5 FHBDRN Cc1cc(NC(=O)[C@H]2OCCc3ccccc32)c2cc([N+](=O)[O-])ccc2n1 ZINC000161851865 938379759 /nfs/dbraw/zinc/37/97/59/938379759.db2.gz YNFMOOPPDWBXTK-IBGZPJMESA-N 0 0 363.373 3.704 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NCC1(c2ccccn2)CCC1 ZINC000583744673 938386638 /nfs/dbraw/zinc/38/66/38/938386638.db2.gz SSNKNGRJKDAPMD-UHFFFAOYSA-N 0 0 371.462 3.954 20 5 FHBDRN Cc1ccc(CN(C2CC2)S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000056095442 938390320 /nfs/dbraw/zinc/39/03/20/938390320.db2.gz IQDFDOPXUJLILW-UHFFFAOYSA-N 0 0 370.814 3.503 20 5 FHBDRN O=[N+]([O-])c1cccc2c(N3CCC(Oc4ncccc4F)CC3)ccnc21 ZINC000432136034 945172272 /nfs/dbraw/zinc/17/22/72/945172272.db2.gz AJKDRYUKXWLEKV-UHFFFAOYSA-N 0 0 368.368 3.725 20 5 FHBDRN O=C(NCC1Cc2ccccc2C1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000437258159 945172822 /nfs/dbraw/zinc/17/28/22/945172822.db2.gz TYVRZKPEVYBOMQ-UHFFFAOYSA-N 0 0 364.323 3.758 20 5 FHBDRN O=[N+]([O-])c1cccc2c(N3CCC(n4cc(Cl)cn4)CC3)ccnc21 ZINC000432137906 945173132 /nfs/dbraw/zinc/17/31/32/945173132.db2.gz JKGDKEGEQCDCHV-UHFFFAOYSA-N 0 0 357.801 3.834 20 5 FHBDRN COc1ccc(C)cc1[C@H](C)NC(=O)NCc1cccc([N+](=O)[O-])c1C ZINC000458686948 938425589 /nfs/dbraw/zinc/42/55/89/938425589.db2.gz IHMKRKTUIZIVRB-AWEZNQCLSA-N 0 0 357.410 3.781 20 5 FHBDRN CCOC(=O)c1ccc(NC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)cc1 ZINC000052604113 938427049 /nfs/dbraw/zinc/42/70/49/938427049.db2.gz LGFXTYRGAHKURF-UHFFFAOYSA-N 0 0 353.334 3.505 20 5 FHBDRN Cc1ccc(SCCNC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)cc1 ZINC000052605131 938430225 /nfs/dbraw/zinc/43/02/25/938430225.db2.gz WZCHQILQSKGIOS-UHFFFAOYSA-N 0 0 355.419 3.907 20 5 FHBDRN Cc1cc(C[C@H](C)NC(=O)c2csc([N+](=O)[O-])c2)n(-c2ccccc2)n1 ZINC000178984070 938437574 /nfs/dbraw/zinc/43/75/74/938437574.db2.gz UJDLWDPBXQGLIT-LBPRGKRZSA-N 0 0 370.434 3.511 20 5 FHBDRN COc1cccc(C(=O)COc2c(Br)cccc2[N+](=O)[O-])c1 ZINC000178983852 938437596 /nfs/dbraw/zinc/43/75/96/938437596.db2.gz ONWIHZBHSMLBJV-UHFFFAOYSA-N 0 0 366.167 3.628 20 5 FHBDRN CCN(CC)c1ccc(-c2noc(-c3ccc(F)cc3[N+](=O)[O-])n2)cn1 ZINC000583844701 938445001 /nfs/dbraw/zinc/44/50/01/938445001.db2.gz XLCVXSGUYRQDHU-UHFFFAOYSA-N 0 0 357.345 3.692 20 5 FHBDRN COc1cc(-c2noc(CN3CCc4c3cccc4[N+](=O)[O-])n2)ccc1C ZINC000583842004 938445950 /nfs/dbraw/zinc/44/59/50/938445950.db2.gz XJINNSBFCHYJCT-UHFFFAOYSA-N 0 0 366.377 3.525 20 5 FHBDRN C[C@H](NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1)[C@H](O)Cc1ccccc1 ZINC000178994270 938459417 /nfs/dbraw/zinc/45/94/17/938459417.db2.gz QDAFOWKJTRLNRO-BLLLJJGKSA-N 0 0 370.430 3.531 20 5 FHBDRN C[C@H]1COCC[C@@H]1NC(=O)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12 ZINC000278476875 938464468 /nfs/dbraw/zinc/46/44/68/938464468.db2.gz KHBSSHPVPFSYHT-QFYYESIMSA-N 0 0 372.371 3.527 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(C(=O)N[C@H]2CCOC3(CCCCC3)C2)c1F ZINC000278491210 938477233 /nfs/dbraw/zinc/47/72/33/938477233.db2.gz YVEXKRHVKLFDRO-ZDUSSCGKSA-N 0 0 350.390 3.654 20 5 FHBDRN O=C(N[C@@H](c1noc(-c2ccc([N+](=O)[O-])s2)n1)C1CC1)c1ccccc1 ZINC000583924249 938485547 /nfs/dbraw/zinc/48/55/47/938485547.db2.gz MKASSUQBVSNDRK-CQSZACIVSA-N 0 0 370.390 3.587 20 5 FHBDRN Cc1ccc([C@]2(C)CCN(C(=O)c3n[nH]c4ccc([N+](=O)[O-])cc43)C2)cc1 ZINC000583927867 938486460 /nfs/dbraw/zinc/48/64/60/938486460.db2.gz NQLIPZJYBUBUJI-HXUWFJFHSA-N 0 0 364.405 3.583 20 5 FHBDRN O=[N+]([O-])c1ccc(NCCCc2nccs2)nc1-c1ccc(F)cc1 ZINC000583967152 938507333 /nfs/dbraw/zinc/50/73/33/938507333.db2.gz ONFZLRNAIBRECW-UHFFFAOYSA-N 0 0 358.398 3.719 20 5 FHBDRN CC[C@@](C)(O)CN(Cc1ccccc1)C(=O)c1cc(F)cc([N+](=O)[O-])c1 ZINC000440038422 945181038 /nfs/dbraw/zinc/18/10/38/945181038.db2.gz RZUBRMNWZZKIQR-LJQANCHMSA-N 0 0 360.385 3.537 20 5 FHBDRN Cc1ccc2c(c1)CN(C(=O)NCCc1c[nH]c3ccc([N+](=O)[O-])cc13)C2 ZINC000583968340 938508479 /nfs/dbraw/zinc/50/84/79/938508479.db2.gz QWOHEDNYWSXRGZ-UHFFFAOYSA-N 0 0 364.405 3.652 20 5 FHBDRN CCOc1ccc(N(C)C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)cc1 ZINC000135468884 938509187 /nfs/dbraw/zinc/50/91/87/938509187.db2.gz JQMUCGSBCVSTJL-UHFFFAOYSA-N 0 0 353.378 3.680 20 5 FHBDRN Cc1ccc(-c2ccncc2)cc1NC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 ZINC000102260349 938517194 /nfs/dbraw/zinc/51/71/94/938517194.db2.gz XYARFOGQHNHALY-UHFFFAOYSA-N 0 0 365.393 3.536 20 5 FHBDRN C[C@H](c1nccs1)N1CCN(c2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000432141205 945182701 /nfs/dbraw/zinc/18/27/01/945182701.db2.gz CNTIIPWNHIQEGH-LLVKDONJSA-N 0 0 352.847 3.588 20 5 FHBDRN CCC[N@H+](CC)Cc1ccc(C(=O)Nc2cc([N+](=O)[O-])ccc2[O-])cc1 ZINC000536192707 938541912 /nfs/dbraw/zinc/54/19/12/938541912.db2.gz PHQDHFJBCRLDAR-UHFFFAOYSA-N 0 0 357.410 3.785 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)N(Cc2ccco2)c2ccc(F)cc2C)n1 ZINC000427195344 945184653 /nfs/dbraw/zinc/18/46/53/945184653.db2.gz DDGIZXFMDFNQFM-UHFFFAOYSA-N 0 0 372.356 3.699 20 5 FHBDRN O=[N+]([O-])c1ccccc1Cc1noc(-c2ccn(C3CCCCC3)n2)n1 ZINC000584019184 938547948 /nfs/dbraw/zinc/54/79/48/938547948.db2.gz RKCVGLHAMFLOJS-UHFFFAOYSA-N 0 0 353.382 3.937 20 5 FHBDRN CC(C)c1nn(C)c(Cl)c1C(=O)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000161982288 938548260 /nfs/dbraw/zinc/54/82/60/938548260.db2.gz CAZWOGOVKPJDPZ-UHFFFAOYSA-N 0 0 362.817 3.698 20 5 FHBDRN Cc1cc(F)cc(C(=O)NC[C@H](O)c2ccc3ccccc3c2)c1[N+](=O)[O-] ZINC000176808694 938563913 /nfs/dbraw/zinc/56/39/13/938563913.db2.gz HBOKAKTURINNEG-SFHVURJKSA-N 0 0 368.364 3.659 20 5 FHBDRN CC(C)[C@@H](CNC(=O)NCCc1cccc([N+](=O)[O-])c1)Nc1ccccc1 ZINC000536201259 938566060 /nfs/dbraw/zinc/56/60/60/938566060.db2.gz MRJAPKGJAZHPDH-LJQANCHMSA-N 0 0 370.453 3.573 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C(=O)OC(C)(C)C)C(C)C ZINC000566856642 938594673 /nfs/dbraw/zinc/59/46/73/938594673.db2.gz HPEMPDOYNIQWFY-HNNXBMFYSA-N 0 0 350.415 3.710 20 5 FHBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)C[C@H]1OC(=O)c2ccccc21 ZINC000135497428 938595022 /nfs/dbraw/zinc/59/50/22/938595022.db2.gz HWWLKPNHQDQKJV-OAHLLOKOSA-N 0 0 360.753 3.797 20 5 FHBDRN CCc1noc2ncc(C(=O)Nc3cc([N+](=O)[O-])c(Cl)cc3C)cc12 ZINC000135494218 938599047 /nfs/dbraw/zinc/59/90/47/938599047.db2.gz AREKCILYFWSYMF-UHFFFAOYSA-N 0 0 360.757 3.908 20 5 FHBDRN O=Cc1ccc(OCc2coc(-c3c(F)cccc3F)n2)c([N+](=O)[O-])c1 ZINC000162030891 938601645 /nfs/dbraw/zinc/60/16/45/938601645.db2.gz BAQITPVHYCEBLK-UHFFFAOYSA-N 0 0 360.272 3.920 20 5 FHBDRN CC(=O)c1cc(F)c(NC(=O)[C@H](C)c2cccc([N+](=O)[O-])c2)c(F)c1F ZINC000584150448 938622072 /nfs/dbraw/zinc/62/20/72/938622072.db2.gz ZZBWBGXIMYRNAR-MRVPVSSYSA-N 0 0 366.295 3.957 20 5 FHBDRN COc1ccc(OC2CCN(c3c(OC)cccc3[N+](=O)[O-])CC2)cc1 ZINC000519181728 945196087 /nfs/dbraw/zinc/19/60/87/945196087.db2.gz OVRQGUHSLHBLQW-UHFFFAOYSA-N 0 0 358.394 3.660 20 5 FHBDRN Cc1ccc(S(=O)(=O)NCc2csc3ccccc23)c([N+](=O)[O-])c1 ZINC000507390510 945191963 /nfs/dbraw/zinc/19/19/63/945191963.db2.gz LANMSLMOMXOFLL-UHFFFAOYSA-N 0 0 362.432 3.596 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCc1nc2ccccc2o1 ZINC000584206184 938638026 /nfs/dbraw/zinc/63/80/26/938638026.db2.gz IVJREURWZYLURP-HNNXBMFYSA-N 0 0 367.405 3.664 20 5 FHBDRN CCc1cc(CC)nc(N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)n1 ZINC000584223643 938645113 /nfs/dbraw/zinc/64/51/13/938645113.db2.gz SVHCNTPEWZIACJ-UHFFFAOYSA-N 0 0 356.426 3.557 20 5 FHBDRN Cc1csc2nc(CS[C@@H](C)c3ccccc3[N+](=O)[O-])cc(=O)n12 ZINC000437269447 945192905 /nfs/dbraw/zinc/19/29/05/945192905.db2.gz QRSVTNPPDCXXAA-NSHDSACASA-N 0 0 361.448 3.967 20 5 FHBDRN C[C@@H]1C[C@@H](c2ccccc2)N(C(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)C1 ZINC000573154546 938654431 /nfs/dbraw/zinc/65/44/31/938654431.db2.gz BPNFBUPGELZXRK-DOMZBBRYSA-N 0 0 354.362 3.547 20 5 FHBDRN O=c1[nH]c(N[C@@H]2CC[C@H](c3ccc(F)cc3)C2)nc2ccc([N+](=O)[O-])cc12 ZINC000573155043 938654696 /nfs/dbraw/zinc/65/46/96/938654696.db2.gz XSVRPMAXPILTOV-GXTWGEPZSA-N 0 0 368.368 3.553 20 5 FHBDRN O=C(NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)c1cccc(-n2cccc2)c1 ZINC000584254953 938661267 /nfs/dbraw/zinc/66/12/67/938661267.db2.gz MLKNGELGAAGSMH-UHFFFAOYSA-N 0 0 374.400 3.839 20 5 FHBDRN Cc1ccc(F)cc1NC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000052933809 938662668 /nfs/dbraw/zinc/66/26/68/938662668.db2.gz UNCNLVNSRDUSOJ-UHFFFAOYSA-N 0 0 354.341 3.695 20 5 FHBDRN Cc1cn2c(nc(C)c2-c2noc(-c3cc([N+](=O)[O-])ccc3C)n2)s1 ZINC000426560643 945194959 /nfs/dbraw/zinc/19/49/59/945194959.db2.gz QXHPIPIZYTWZEW-UHFFFAOYSA-N 0 0 355.379 3.946 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)NCC[C@@](C)(O)c1ccccc1 ZINC000278716059 938680135 /nfs/dbraw/zinc/68/01/35/938680135.db2.gz QZJCLXZGOOEXAO-GOSISDBHSA-N 0 0 362.813 3.584 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)cc(Cl)c1N1CCOCC2(CCOCC2)C1 ZINC000408109598 945196445 /nfs/dbraw/zinc/19/64/45/945196445.db2.gz YTCNTJTXQICMAB-UHFFFAOYSA-N 0 0 361.225 3.535 20 5 FHBDRN Cn1cc(C(=O)Nc2ccc3ccccc3n2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000052984807 938690477 /nfs/dbraw/zinc/69/04/77/938690477.db2.gz AMEQDTJNQVAZBX-UHFFFAOYSA-N 0 0 373.372 3.796 20 5 FHBDRN Cc1c(C(=O)N(C)Cc2cc([N+](=O)[O-])ccc2Cl)cccc1[N+](=O)[O-] ZINC000052991037 938695936 /nfs/dbraw/zinc/69/59/36/938695936.db2.gz AVTAYPBQRUBFHZ-UHFFFAOYSA-N 0 0 363.757 3.737 20 5 FHBDRN CCOc1cc(COC(=O)c2c(F)cc(F)cc2F)ccc1[N+](=O)[O-] ZINC000755547158 938697632 /nfs/dbraw/zinc/69/76/32/938697632.db2.gz GLEYXCDKOSSBMR-UHFFFAOYSA-N 0 0 355.268 3.768 20 5 FHBDRN COc1ccc2c(c1)ncc([N+](=O)[O-])c2N[C@@H](C)c1cnn(C(C)C)c1 ZINC000573196224 938699589 /nfs/dbraw/zinc/69/95/89/938699589.db2.gz JUZUYZFOKOYJGE-LBPRGKRZSA-N 0 0 355.398 3.524 20 5 FHBDRN CCOC(=O)c1ccnc(N2CC3(CCC3)[C@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000432148576 945197426 /nfs/dbraw/zinc/19/74/26/945197426.db2.gz NBMZAPAKUSGLOY-QGZVFWFLSA-N 0 0 367.405 3.898 20 5 FHBDRN O=C(NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)c1cccc(F)c1Cl ZINC000584374282 938720849 /nfs/dbraw/zinc/72/08/49/938720849.db2.gz ZLGUWRRVQWPCEQ-UHFFFAOYSA-N 0 0 361.760 3.841 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)O[C@H](C)c1ccc(F)c(Cl)c1 ZINC000065659515 938779108 /nfs/dbraw/zinc/77/91/08/938779108.db2.gz ANDGZSQJWXUBFL-SECBINFHSA-N 0 0 355.753 3.587 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@H](Oc2ccccc2)C1 ZINC000843619148 938784747 /nfs/dbraw/zinc/78/47/47/938784747.db2.gz HZTCTFGPSHQERK-ZDRDQBANSA-N 0 0 352.390 3.678 20 5 FHBDRN C[C@@H](NC(=O)N1CCOc2ccc([N+](=O)[O-])cc2C1)[C@@H](C)c1ccccc1 ZINC000584383634 938786857 /nfs/dbraw/zinc/78/68/57/938786857.db2.gz IUDJMIHRGNWOTH-HUUCEWRRSA-N 0 0 369.421 3.691 20 5 FHBDRN Cc1nn(CCC(=O)N2CCCC[C@@H]2CCC(C)C)c(C)c1[N+](=O)[O-] ZINC000128169890 938789199 /nfs/dbraw/zinc/78/91/99/938789199.db2.gz WFPGKRAOVQBLCH-MRXNPFEDSA-N 0 0 350.463 3.616 20 5 FHBDRN Cc1cc(C)c(S(=O)(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)s1 ZINC000431548409 938798618 /nfs/dbraw/zinc/79/86/18/938798618.db2.gz DIOKKMNBFFHHNO-GFCCVEGCSA-N 0 0 354.453 3.621 20 5 FHBDRN CCS[C@@H]1CCCC[C@H]1NC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000427210889 945205740 /nfs/dbraw/zinc/20/57/40/945205740.db2.gz FBHQDGAKGBGUJA-NVXWUHKLSA-N 0 0 361.467 3.730 20 5 FHBDRN CN(Cc1nc2c(s1)CCCC2)C(=O)/C=C/c1ccc([N+](=O)[O-])cc1 ZINC000176841799 938820592 /nfs/dbraw/zinc/82/05/92/938820592.db2.gz OONBXSOZOVNCKG-DHZHZOJOSA-N 0 0 357.435 3.602 20 5 FHBDRN CC[C@@H](CNC(=O)Cc1cccc([N+](=O)[O-])c1C)Oc1ccccc1F ZINC000128182288 938823913 /nfs/dbraw/zinc/82/39/13/938823913.db2.gz OBTWKKZLQPBEFI-HNNXBMFYSA-N 0 0 360.385 3.559 20 5 FHBDRN O=C(N[C@@H]1C[C@H]1c1ccc(Br)cc1)c1ccccc1[N+](=O)[O-] ZINC000437291056 945206972 /nfs/dbraw/zinc/20/69/72/945206972.db2.gz VTLIPYLXKKQSDB-UONOGXRCSA-N 0 0 361.195 3.643 20 5 FHBDRN Cc1c(CC(=O)N[C@H](C)c2nc(C(F)(F)F)cs2)cccc1[N+](=O)[O-] ZINC000278762482 938830603 /nfs/dbraw/zinc/83/06/03/938830603.db2.gz OCJQUSABMVNJET-SECBINFHSA-N 0 0 373.356 3.798 20 5 FHBDRN Cc1nccn1-c1ccc([C@H](C)NC(=O)c2cc(C)ccc2[N+](=O)[O-])cc1 ZINC000086248221 938843441 /nfs/dbraw/zinc/84/34/41/938843441.db2.gz ZBKJXMQINAUSBC-AWEZNQCLSA-N 0 0 364.405 3.888 20 5 FHBDRN Cc1nccn1-c1ccc([C@@H](C)NC(=O)c2cc(C)ccc2[N+](=O)[O-])cc1 ZINC000086248223 938843489 /nfs/dbraw/zinc/84/34/89/938843489.db2.gz ZBKJXMQINAUSBC-CQSZACIVSA-N 0 0 364.405 3.888 20 5 FHBDRN Cc1c(CC(=O)NCCc2ccccc2C(F)(F)F)cccc1[N+](=O)[O-] ZINC000438897845 945211056 /nfs/dbraw/zinc/21/10/56/945211056.db2.gz GBYQKYYNZILLPC-UHFFFAOYSA-N 0 0 366.339 3.823 20 5 FHBDRN Cc1ccc(C[C@H](C)NC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)c(C)c1 ZINC000518211164 945211562 /nfs/dbraw/zinc/21/15/62/945211562.db2.gz IEXGTDROXPHQLL-INIZCTEOSA-N 0 0 365.433 3.914 20 5 FHBDRN Cc1cc(C)cc(N2CC[C@@H](C(=O)Nc3cc([N+](=O)[O-])ccc3C)C2=O)c1 ZINC000053059272 938877597 /nfs/dbraw/zinc/87/75/97/938877597.db2.gz VLUWTLFDUINXSZ-KRWDZBQOSA-N 0 0 367.405 3.512 20 5 FHBDRN O=C(CCCOCc1ccccc1)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000162228350 938884839 /nfs/dbraw/zinc/88/48/39/938884839.db2.gz JYXHBBXCXBYPBK-UHFFFAOYSA-N 0 0 354.406 3.871 20 5 FHBDRN CCS[C@@H]1CCCC[C@H]1NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000427236806 945213646 /nfs/dbraw/zinc/21/36/46/945213646.db2.gz ANDXVDDPKFQUEJ-NVXWUHKLSA-N 0 0 363.483 3.963 20 5 FHBDRN Cc1cc(C)n(CCCNc2cc(C)c([N+](=O)[O-])cc2Br)n1 ZINC000302623082 938906793 /nfs/dbraw/zinc/90/67/93/938906793.db2.gz AEZZQUURPFHZJJ-UHFFFAOYSA-N 0 0 367.247 3.981 20 5 FHBDRN Cc1cccc([C@H](NC(=O)COc2ccc([N+](=O)[O-])cc2)C(F)(F)F)c1 ZINC000511825858 945216551 /nfs/dbraw/zinc/21/65/51/945216551.db2.gz MHBDPICUSIBHQJ-INIZCTEOSA-N 0 0 368.311 3.702 20 5 FHBDRN Cc1cc(OCc2nc(CC(F)(F)F)no2)c(Cl)cc1[N+](=O)[O-] ZINC000506431358 945216798 /nfs/dbraw/zinc/21/67/98/945216798.db2.gz GJDMQRHDHIFJIO-UHFFFAOYSA-N 0 0 351.668 3.623 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2ncn(CCOc3ccc(F)cc3Cl)n2)c1 ZINC000093903982 938931956 /nfs/dbraw/zinc/93/19/56/938931956.db2.gz LFRQBPRGSUAYBN-UHFFFAOYSA-N 0 0 362.748 3.725 20 5 FHBDRN COc1ccc(NC(=O)COc2cc(C)c([N+](=O)[O-])cc2Cl)cc1 ZINC000506430989 945218079 /nfs/dbraw/zinc/21/80/79/945218079.db2.gz FJNCQAMUAHSIAI-UHFFFAOYSA-N 0 0 350.758 3.583 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC(C)(C)c1ccc(F)cc1 ZINC000728591524 938959181 /nfs/dbraw/zinc/95/91/81/938959181.db2.gz GVTZPKCKJJFPJB-UHFFFAOYSA-N 0 0 366.414 3.510 20 5 FHBDRN O=[N+]([O-])c1cccc(CS(=O)(=O)N2CC[C@@H]2c2ccc(Cl)cc2)c1 ZINC000511258972 938965659 /nfs/dbraw/zinc/96/56/59/938965659.db2.gz HGEIMZDGIQEODG-MRXNPFEDSA-N 0 0 366.826 3.525 20 5 FHBDRN COc1ccc(NC(=O)c2nc(-c3ccccc3)[nH]c2C)cc1[N+](=O)[O-] ZINC000611889889 938965903 /nfs/dbraw/zinc/96/59/03/938965903.db2.gz CTGDZLVJGLWHCG-UHFFFAOYSA-N 0 0 352.350 3.554 20 5 FHBDRN O=C(Nc1cc(CC2CC2)nn1-c1ccccc1)c1ccc([N+](=O)[O-])o1 ZINC000158891784 938966549 /nfs/dbraw/zinc/96/65/49/938966549.db2.gz QGBWNABZEGFHJM-UHFFFAOYSA-N 0 0 352.350 3.578 20 5 FHBDRN C[C@H](c1ccc(Cl)cc1)N1CCN(C(=O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000050964764 938967034 /nfs/dbraw/zinc/96/70/34/938967034.db2.gz BWFVLYCEWDASOX-CQSZACIVSA-N 0 0 373.840 3.767 20 5 FHBDRN O=[N+]([O-])c1cc(CN(Cc2cccc(F)c2)C[C@@H]2CCCO2)cs1 ZINC000050963536 938967070 /nfs/dbraw/zinc/96/70/70/938967070.db2.gz GWNFNXPUGZXKNX-INIZCTEOSA-N 0 0 350.415 3.977 20 5 FHBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)N2CC[C@@H]2c2ccc(Cl)cc2)cc1 ZINC000511261931 938968275 /nfs/dbraw/zinc/96/82/75/938968275.db2.gz YEKVRRUNPNWBEA-MRXNPFEDSA-N 0 0 366.826 3.525 20 5 FHBDRN Cc1[nH]c2ccc(CNC(=O)NCc3ccc([N+](=O)[O-])cc3)cc2c1C ZINC000065696644 938972643 /nfs/dbraw/zinc/97/26/43/938972643.db2.gz ALMGCZGUYJBGQZ-UHFFFAOYSA-N 0 0 352.394 3.692 20 5 FHBDRN CC(=O)OCCCc1cccc(NC(=O)c2cc(F)cc(C)c2[N+](=O)[O-])c1 ZINC000135569773 938975107 /nfs/dbraw/zinc/97/51/07/938975107.db2.gz OWUDGRMUODRFOY-UHFFFAOYSA-N 0 0 374.368 3.790 20 5 FHBDRN O=[N+]([O-])c1ccc(N[C@@H]2CCOc3c(Br)cccc32)nc1 ZINC000409640501 938979165 /nfs/dbraw/zinc/97/91/65/938979165.db2.gz VFROFVDJMXKFMR-GFCCVEGCSA-N 0 0 350.172 3.688 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CC[C@H]1c1ccc(Cl)cc1 ZINC000511277185 938979892 /nfs/dbraw/zinc/97/98/92/938979892.db2.gz QHLGGNUCZPCGHP-HNNXBMFYSA-N 0 0 366.826 3.692 20 5 FHBDRN CCOc1cc(NC(=O)N2CC(C)=C[C@@H](C)C2)c([N+](=O)[O-])cc1OCC ZINC000431577004 938980820 /nfs/dbraw/zinc/98/08/20/938980820.db2.gz FCOTZXDONMRQHI-GFCCVEGCSA-N 0 0 363.414 3.822 20 5 FHBDRN Cc1cnc(N[C@H]2CCOc3c(Br)cccc32)c([N+](=O)[O-])c1 ZINC000409653810 938984940 /nfs/dbraw/zinc/98/49/40/938984940.db2.gz WAEIKXQBCGMEDA-LBPRGKRZSA-N 0 0 364.199 3.996 20 5 FHBDRN Cc1cc(C(=O)Nc2ccc(O[C@@H]3CCCC[C@@H]3O)cc2)cc([N+](=O)[O-])c1 ZINC000135655601 938986125 /nfs/dbraw/zinc/98/61/25/938986125.db2.gz WBHZIOBTWRXARW-RBUKOAKNSA-N 0 0 370.405 3.838 20 5 FHBDRN CCC[C@H](C)[C@H]1CCCN1C(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000785180645 938991504 /nfs/dbraw/zinc/99/15/04/938991504.db2.gz TUGCKMOZEXKEAN-XHDPSFHLSA-N 0 0 367.833 3.614 20 5 FHBDRN COc1cc(NC(=O)Cc2cccc(F)c2[N+](=O)[O-])ccc1OC(C)C ZINC000867443204 938993195 /nfs/dbraw/zinc/99/31/95/938993195.db2.gz SMQHAEFYZKEFAB-UHFFFAOYSA-N 0 0 362.357 3.711 20 5 FHBDRN Cc1cc(F)cc(C(=O)NCc2ccc(OC(F)(F)F)cc2)c1[N+](=O)[O-] ZINC000176909732 938993361 /nfs/dbraw/zinc/99/33/61/938993361.db2.gz YFWNUAWVQBJAMB-UHFFFAOYSA-N 0 0 372.274 3.871 20 5 FHBDRN COC(=O)c1nc([C@@H]2CCCN2c2ccc([N+](=O)[O-])c(C)c2)sc1C ZINC000480582563 938996064 /nfs/dbraw/zinc/99/60/64/938996064.db2.gz UOJNJUPSGKTGFT-AWEZNQCLSA-N 0 0 361.423 3.796 20 5 FHBDRN COC(=O)[C@H](Cc1ccc(C)cc1)Sc1ccc(C(C)=O)cc1[N+](=O)[O-] ZINC000480582855 938996075 /nfs/dbraw/zinc/99/60/75/938996075.db2.gz VKGOGHHATXBRSK-SFHVURJKSA-N 0 0 373.430 3.982 20 5 FHBDRN Cc1cc(Cl)c(C(=O)NCCc2cc(F)cc(F)c2)cc1[N+](=O)[O-] ZINC001125758266 938999223 /nfs/dbraw/zinc/99/92/23/938999223.db2.gz XVAFCDWOJUEYOL-UHFFFAOYSA-N 0 0 354.740 3.807 20 5 FHBDRN CSc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccccc1N1CCOC1=O ZINC001125765385 939002792 /nfs/dbraw/zinc/00/27/92/939002792.db2.gz HNNMMVBJDLVPRQ-UHFFFAOYSA-N 0 0 373.390 3.526 20 5 FHBDRN CCN(Cc1ccc(OC)cc1)C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000065725171 939007224 /nfs/dbraw/zinc/00/72/24/939007224.db2.gz MQHSMHHNFZCBNA-UHFFFAOYSA-N 0 0 367.405 3.607 20 5 FHBDRN COc1cccc(SCC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000027661129 939011082 /nfs/dbraw/zinc/01/10/82/939011082.db2.gz ZSXHFRMYPRUARC-UHFFFAOYSA-N 0 0 352.799 3.988 20 5 FHBDRN Cc1ncc(/C=C\C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)s1 ZINC000255620445 939011414 /nfs/dbraw/zinc/01/14/14/939011414.db2.gz DSJQXARQAXILMB-HYXAFXHYSA-N 0 0 355.322 3.613 20 5 FHBDRN Cc1n[nH]c(C(=O)N2CCCCC[C@H]2/C=C/c2cccs2)c1[N+](=O)[O-] ZINC000611988606 939015322 /nfs/dbraw/zinc/01/53/22/939015322.db2.gz UXGCWJVVMZMLBI-XEHSLEBBSA-N 0 0 360.439 3.786 20 5 FHBDRN C[C@@H](NC(=O)[C@@H](C)Oc1ccc(F)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000065735436 939017347 /nfs/dbraw/zinc/01/73/47/939017347.db2.gz CWROIANBRQSLNI-GHMZBOCLSA-N 0 0 350.321 3.518 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]cc(Cc3nc(COc4cccc(F)c4)no3)c2c1 ZINC000188074627 939017704 /nfs/dbraw/zinc/01/77/04/939017704.db2.gz MIARJNJJOBAKBV-UHFFFAOYSA-N 0 0 368.324 3.768 20 5 FHBDRN Cc1ccc(C)c(N(C)C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)c1 ZINC000179257849 939017760 /nfs/dbraw/zinc/01/77/60/939017760.db2.gz OADHZGXFKJEFFG-UHFFFAOYSA-N 0 0 350.378 3.674 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])c(S(C)(=O)=O)c1)c1ccc(F)cc1 ZINC000179257476 939017783 /nfs/dbraw/zinc/01/77/83/939017783.db2.gz FCABDRHMFIOTIR-SNVBAGLBSA-N 0 0 355.412 3.991 20 5 FHBDRN O=C(Nc1ccnn1[C@H]1CCCc2ccccc21)c1ccc([N+](=O)[O-])cc1 ZINC000065727518 939017836 /nfs/dbraw/zinc/01/78/36/939017836.db2.gz JBEHFYBYWGLKKX-SFHVURJKSA-N 0 0 362.389 3.969 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)NCCc1ccc(Cl)s1 ZINC000065733965 939018372 /nfs/dbraw/zinc/01/83/72/939018372.db2.gz CWIRJPARYCHGLW-UHFFFAOYSA-N 0 0 363.826 3.623 20 5 FHBDRN CN(CCCc1ccccc1)C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000065733302 939018392 /nfs/dbraw/zinc/01/83/92/939018392.db2.gz GIEFZHQIWRRIBH-UHFFFAOYSA-N 0 0 351.406 3.641 20 5 FHBDRN C[C@@H]1CO[C@H](c2ccccc2)CN1C(=O)/C=C\c1ccc([N+](=O)[O-])cc1 ZINC000255630281 939018852 /nfs/dbraw/zinc/01/88/52/939018852.db2.gz AKNBCAUMHXIHQH-KZULLRDHSA-N 0 0 352.390 3.597 20 5 FHBDRN CSc1cccc(C(=O)N[C@@H](C)c2nc3ccccc3n2C)c1[N+](=O)[O-] ZINC000188168119 939021449 /nfs/dbraw/zinc/02/14/49/939021449.db2.gz QBKDTHQKCULMEG-NSHDSACASA-N 0 0 370.434 3.694 20 5 FHBDRN CCN(Cc1ccc(OC)cc1)C(=O)c1cc(OC)c(C)c([N+](=O)[O-])c1 ZINC000188175758 939022518 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O=C(Nc1ccc(OC2CCCC2)c(Cl)c1)c1cc([N+](=O)[O-])n[nH]1 ZINC000506753758 945229440 /nfs/dbraw/zinc/22/94/40/945229440.db2.gz SVSQYWRIRPAEFO-UHFFFAOYSA-N 0 0 350.762 3.545 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC[C@H]1c1ccsc1 ZINC000065791863 939152256 /nfs/dbraw/zinc/15/22/56/939152256.db2.gz DKDIYGCZUQVIDU-HNNXBMFYSA-N 0 0 366.464 3.745 20 5 FHBDRN O=C(O[C@@H]1COc2cc(Cl)ccc21)c1cc(F)c([N+](=O)[O-])cc1F ZINC000785215218 939154037 /nfs/dbraw/zinc/15/40/37/939154037.db2.gz NUNUUFWZFYERJF-CQSZACIVSA-N 0 0 355.680 3.817 20 5 FHBDRN Cc1cccc([C@H](NC(=O)COc2cccc([N+](=O)[O-])c2)C(F)(F)F)c1 ZINC000511829176 945232364 /nfs/dbraw/zinc/23/23/64/945232364.db2.gz UZWPITNQMLBIFU-INIZCTEOSA-N 0 0 368.311 3.702 20 5 FHBDRN O=C(c1cnc2ccc(F)cc2c1)N1CCCc2ccc([N+](=O)[O-])cc21 ZINC000179509415 939196259 /nfs/dbraw/zinc/19/62/59/939196259.db2.gz VVOYVGVERHNNAM-UHFFFAOYSA-N 0 0 351.337 3.875 20 5 FHBDRN C[C@H](C(=O)NCc1ccc(Br)s1)c1cccc([N+](=O)[O-])c1 ZINC000235429844 939202339 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364.760 3.682 20 5 FHBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N(CC1CCC1)c1ccccc1 ZINC000437324482 945241806 /nfs/dbraw/zinc/24/18/06/945241806.db2.gz PEMGSHCDUVUJTJ-UHFFFAOYSA-N 0 0 360.435 3.899 20 5 FHBDRN CCN(Cc1ccccc1Cl)S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-] ZINC000507447965 945242107 /nfs/dbraw/zinc/24/21/07/945242107.db2.gz JJGCYLXGQRJVMJ-UHFFFAOYSA-N 0 0 368.842 3.767 20 5 FHBDRN O=[N+]([O-])c1cccc2c(NC[C@@]3(CO)C[C@H]3c3ccc(F)cc3)ccnc21 ZINC000432174993 945259821 /nfs/dbraw/zinc/25/98/21/945259821.db2.gz VKHIYZNTVWTJID-OXJNMPFZSA-N 0 0 367.380 3.860 20 5 FHBDRN CCCNC(=O)c1cccc(NC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000047519416 945260131 /nfs/dbraw/zinc/26/01/31/945260131.db2.gz WHKIIHQZJAFPBF-CYBMUJFWSA-N 0 0 370.409 3.617 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)NCc1ccccc1-n1cccn1 ZINC000438955836 945263549 /nfs/dbraw/zinc/26/35/49/945263549.db2.gz NECYYQNNYPKVPV-UHFFFAOYSA-N 0 0 370.796 3.672 20 5 FHBDRN O=C(NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)[C@@H]1CC[C@@H](C(F)(F)F)C1 ZINC000518250209 945265092 /nfs/dbraw/zinc/26/50/92/945265092.db2.gz VGRWITVVALMORE-ZYHUDNBSSA-N 0 0 369.343 3.713 20 5 FHBDRN CC[C@H](C)N(Cc1ccccc1)S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-] ZINC000507493968 945265391 /nfs/dbraw/zinc/26/53/91/945265391.db2.gz MGGOZSURCRSBFT-HNNXBMFYSA-N 0 0 362.451 3.893 20 5 FHBDRN CS(=O)(=O)c1ccc(N[C@H]2CCCc3ccc(F)cc32)c([N+](=O)[O-])c1 ZINC000092964341 945267228 /nfs/dbraw/zinc/26/72/28/945267228.db2.gz YVMJVGRBEPABNT-HNNXBMFYSA-N 0 0 364.398 3.627 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1OCC(=O)Nc1ccc(Cl)cc1C ZINC000506765317 945270303 /nfs/dbraw/zinc/27/03/03/945270303.db2.gz DYKSIVORAGHIRB-UHFFFAOYSA-N 0 0 350.758 3.583 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@@]1(C)CCCc2ccccc21 ZINC000511850554 945273499 /nfs/dbraw/zinc/27/34/99/945273499.db2.gz RUFYEVIHRYMWPO-FQEVSTJZSA-N 0 0 354.406 3.514 20 5 FHBDRN CCSc1ccc([C@H](C)NS(=O)(=O)c2ccc([N+](=O)[O-])s2)cc1 ZINC000507488115 945274876 /nfs/dbraw/zinc/27/48/76/945274876.db2.gz TXLMJDTUMSZXJR-JTQLQIEISA-N 0 0 372.493 3.808 20 5 FHBDRN CCc1nn(C)cc1-c1noc([C@@H](C)Sc2ccc([N+](=O)[O-])cc2)n1 ZINC000426584755 945276302 /nfs/dbraw/zinc/27/63/02/945276302.db2.gz AMFYSKMEPVTELF-SNVBAGLBSA-N 0 0 359.411 3.794 20 5 FHBDRN Cc1cn(-c2c(F)cccc2F)nc1C(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000188415740 939874034 /nfs/dbraw/zinc/87/40/34/939874034.db2.gz NXSWKVYAQZRVLC-UHFFFAOYSA-N 0 0 372.331 3.928 20 5 FHBDRN CC(C)Oc1ncccc1NC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000437368060 945278132 /nfs/dbraw/zinc/27/81/32/945278132.db2.gz AFVICEFNXNGOIX-UHFFFAOYSA-N 0 0 370.409 3.974 20 5 FHBDRN CCS[C@@H]1CC[C@@H](N(C)C(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)C1 ZINC000188461422 939884881 /nfs/dbraw/zinc/88/48/81/939884881.db2.gz IQZVAKDHPBLCRC-ZIAGYGMSSA-N 0 0 352.456 3.658 20 5 FHBDRN COc1cccc(CC2CCN(C(=O)c3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000612217905 939891198 /nfs/dbraw/zinc/89/11/98/939891198.db2.gz FBLRXKJNDLQUDG-UHFFFAOYSA-N 0 0 354.406 3.698 20 5 FHBDRN Cc1nn(C(C)(C)C)c(C)c1C(=O)OCc1ccc(N(C)C)c([N+](=O)[O-])c1 ZINC000785234462 939891329 /nfs/dbraw/zinc/89/13/29/939891329.db2.gz XIYYDASSPIGKJS-UHFFFAOYSA-N 0 0 374.441 3.586 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NCc1ccc([C@H](C)O)cc1 ZINC000179599731 939893208 /nfs/dbraw/zinc/89/32/08/939893208.db2.gz LVZSYUHVAVHNRR-LBPRGKRZSA-N 0 0 360.435 3.690 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(F)cc2OCC(F)F)c1 ZINC000179611275 939894082 /nfs/dbraw/zinc/89/40/82/939894082.db2.gz VALGSVKVSKWBGP-UHFFFAOYSA-N 0 0 370.283 3.639 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N[C@H]1COc2cc(F)cc(F)c21 ZINC000612222538 939894693 /nfs/dbraw/zinc/89/46/93/939894693.db2.gz CMPKCCYOTHFLBH-ZDUSSCGKSA-N 0 0 362.332 3.662 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NCc1ccc(C)c(OC)c1 ZINC000179597237 939896393 /nfs/dbraw/zinc/89/63/93/939896393.db2.gz TVSPFQDCMPDNQE-UHFFFAOYSA-N 0 0 360.435 3.954 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)c1cc(-c2ccc3c(c2)CCO3)no1 ZINC000136257254 939905884 /nfs/dbraw/zinc/90/58/84/939905884.db2.gz PAMOLDLKNJIMID-UHFFFAOYSA-N 0 0 365.345 3.745 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N(Cc1ccccc1)c1ccncc1 ZINC000179673857 939916965 /nfs/dbraw/zinc/91/69/65/939916965.db2.gz JNQFRIUBHUPBCE-UHFFFAOYSA-N 0 0 363.373 3.602 20 5 FHBDRN C[C@H]1CO[C@@H](c2ccccc2)CN1C(=O)C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000410463361 939917430 /nfs/dbraw/zinc/91/74/30/939917430.db2.gz CWMOXDCNBIPRCD-HNAYVOBHSA-N 0 0 368.433 3.861 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)F)cc1Oc1cncc(Br)c1 ZINC000236113684 939922914 /nfs/dbraw/zinc/92/29/14/939922914.db2.gz WAWWGKLVMLLOMV-UHFFFAOYSA-N 0 0 364.077 3.958 20 5 FHBDRN CC1(C)[C@@H](O)C[C@@H]1NC(=O)c1cc([N+](=O)[O-])ccc1SC1CCCC1 ZINC000614665961 939923679 /nfs/dbraw/zinc/92/36/79/939923679.db2.gz QQRMYDPZRPKCKG-HOTGVXAUSA-N 0 0 364.467 3.519 20 5 FHBDRN Cc1onc(-c2cccnc2)c1C(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000375811424 939926135 /nfs/dbraw/zinc/92/61/35/939926135.db2.gz WJFCDRKPQQEYJD-LBPRGKRZSA-N 0 0 366.377 3.753 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)Nc1ccc2c(c1)N(C)CCO2 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0 0 365.407 3.788 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)N1C[C@H](c2ccccc2)[C@H]2CCC[C@H]21 ZINC000376075735 940276662 /nfs/dbraw/zinc/27/66/62/940276662.db2.gz YNOWUWOJYZMPFI-BHIYHBOVSA-N 0 0 351.406 3.707 20 5 FHBDRN NC(=O)NCc1ccc(NCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)cc1 ZINC000180047055 940324315 /nfs/dbraw/zinc/32/43/15/940324315.db2.gz HQPGFTCGXMISBH-UHFFFAOYSA-N 0 0 366.377 3.635 20 5 FHBDRN O=[N+]([O-])c1cccc(OCc2nc(Cc3ccc4ccccc4n3)no2)c1 ZINC000612894174 940331776 /nfs/dbraw/zinc/33/17/76/940331776.db2.gz WKXZVZLOPFOGMW-UHFFFAOYSA-N 0 0 362.345 3.696 20 5 FHBDRN COc1cccc([C@@H](C)c2noc(COc3ccccc3[N+](=O)[O-])n2)c1 ZINC000612918187 940336172 /nfs/dbraw/zinc/33/61/72/940336172.db2.gz WBOAPPGNRSULCF-GFCCVEGCSA-N 0 0 355.350 3.717 20 5 FHBDRN O=[N+]([O-])c1ccc(-n2cc(-c3nc([C@H]4CCc5ccccc54)no3)cn2)cc1 ZINC000612933085 940344165 /nfs/dbraw/zinc/34/41/65/940344165.db2.gz LNLABWSNQLKIJV-SFHVURJKSA-N 0 0 373.372 3.909 20 5 FHBDRN COc1ccc2c(c1)C[C@H](c1nc(-c3ccc([N+](=O)[O-])cc3C)no1)CO2 ZINC000612936106 940345440 /nfs/dbraw/zinc/34/54/40/940345440.db2.gz AMTNFJXNBAHFOZ-ZDUSSCGKSA-N 0 0 367.361 3.681 20 5 FHBDRN O=[N+]([O-])c1ccc(OCc2nc([C@H]3CCc4ccccc4C3)no2)cc1 ZINC000612951581 940356224 /nfs/dbraw/zinc/35/62/24/940356224.db2.gz JMDIESMOKDOXER-HNNXBMFYSA-N 0 0 351.362 3.829 20 5 FHBDRN O=C(Nc1cccc(C(F)(F)F)c1)c1cc([N+](=O)[O-])cc2c1OCCO2 ZINC000066266361 940370451 /nfs/dbraw/zinc/37/04/51/940370451.db2.gz AUUIPOHYYWMJPW-UHFFFAOYSA-N 0 0 368.267 3.637 20 5 FHBDRN O=[N+]([O-])c1cc(F)ccc1N1CCc2c(ncn2-c2ccc(F)cc2)C1 ZINC000511858074 945312554 /nfs/dbraw/zinc/31/25/54/945312554.db2.gz IKVDDFULHSNKMP-UHFFFAOYSA-N 0 0 356.332 3.621 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccc(F)cc1-n1cccc1 ZINC000427381564 945312708 /nfs/dbraw/zinc/31/27/08/945312708.db2.gz IAVCUQGXUMRHFD-UHFFFAOYSA-N 0 0 355.325 3.786 20 5 FHBDRN O=C(Nc1cccc(Cl)c1Cl)c1cc([N+](=O)[O-])cc2c1OCCO2 ZINC000066267855 940380482 /nfs/dbraw/zinc/38/04/82/940380482.db2.gz OXDBTHMBQQKFKH-UHFFFAOYSA-N 0 0 369.160 3.925 20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])Nc1cncc(Cl)c1Cl ZINC000180070587 940382869 /nfs/dbraw/zinc/38/28/69/940382869.db2.gz GVACXQVVRDLRAI-UHFFFAOYSA-N 0 0 355.181 3.737 20 5 FHBDRN CC[C@@H](CNC(=O)c1cccc(Cl)c1[N+](=O)[O-])Oc1ccccc1F ZINC000177720688 940385784 /nfs/dbraw/zinc/38/57/84/940385784.db2.gz PCUPBZVMTQEAAO-NSHDSACASA-N 0 0 366.776 3.975 20 5 FHBDRN CC[C@H](C)c1ccc(S(=O)(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)cc1 ZINC000543860130 940393304 /nfs/dbraw/zinc/39/33/04/940393304.db2.gz PRPSGHFECAJOQS-LBPRGKRZSA-N 0 0 364.423 3.918 20 5 FHBDRN CCN(C(=O)c1cc([N+](=O)[O-])cc2c1OCCO2)c1cc(C)cc(C)c1 ZINC000066290190 940393901 /nfs/dbraw/zinc/39/39/01/940393901.db2.gz HYVXEMSPVPVFLH-UHFFFAOYSA-N 0 0 356.378 3.650 20 5 FHBDRN Cc1cc(C)c(NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)cc1O ZINC000613031878 940400942 /nfs/dbraw/zinc/40/09/42/940400942.db2.gz QICUAQLZXCSRMO-UHFFFAOYSA-N 0 0 365.183 3.932 20 5 FHBDRN Cn1c(SCc2ccc(Cl)c([N+](=O)[O-])c2)nnc1-c1ccccn1 ZINC000124720798 945314861 /nfs/dbraw/zinc/31/48/61/945314861.db2.gz IOBHFSONOCLJBP-UHFFFAOYSA-N 0 0 361.814 3.731 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)N(C)[C@@H]2CCC[C@@H]2c2ccc(C)cc2)n1 ZINC000427360316 945314847 /nfs/dbraw/zinc/31/48/47/945314847.db2.gz YTUNIVZJPFGFKG-HZPDHXFCSA-N 0 0 356.426 3.528 20 5 FHBDRN Cc1cc(C)cc(C[C@@H](C)Nc2cc3nc[nH]c(=O)c3cc2[N+](=O)[O-])c1 ZINC000579897726 940413381 /nfs/dbraw/zinc/41/33/81/940413381.db2.gz XLILFMKNPVFFTK-CYBMUJFWSA-N 0 0 352.394 3.904 20 5 FHBDRN CCOc1cccc(N2CCO[C@@H](CCc3ccccc3)C2)c1[N+](=O)[O-] ZINC000613050051 940421469 /nfs/dbraw/zinc/42/14/69/940421469.db2.gz JSYQRGLYRRNVBC-KRWDZBQOSA-N 0 0 356.422 3.832 20 5 FHBDRN CC(=O)c1cc(N[C@@H]2CCN(Cc3ccccn3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000376177161 940422861 /nfs/dbraw/zinc/42/28/61/940422861.db2.gz ZZMPTIRSBROWJR-AUUYWEPGSA-N 0 0 368.437 3.515 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)N2CCc3cc(-c4ccccc4)ccc32)n1 ZINC000427369455 945319793 /nfs/dbraw/zinc/31/97/93/945319793.db2.gz GRDXODXEODTFLW-UHFFFAOYSA-N 0 0 362.389 3.681 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N1CCOC[C@H]1c1ccccc1 ZINC000580012265 940430537 /nfs/dbraw/zinc/43/05/37/940430537.db2.gz ROHFFBPOUVWLOD-SFHVURJKSA-N 0 0 355.394 3.763 20 5 FHBDRN C[C@@H](CC(=O)OCCn1cc([N+](=O)[O-])cn1)c1ccc(C(F)(F)F)cc1 ZINC000177788603 940439640 /nfs/dbraw/zinc/43/96/40/940439640.db2.gz MPVMZPXMCUITPA-NSHDSACASA-N 0 0 371.315 3.547 20 5 FHBDRN Cc1c(CN2C(=O)[C@@H]3C[C@H](C4CCCCC4)CN3C2=O)cccc1[N+](=O)[O-] ZINC000431735726 940442755 /nfs/dbraw/zinc/44/27/55/940442755.db2.gz KVYBRGDEXAXHDG-WMZOPIPTSA-N 0 0 371.437 3.636 20 5 FHBDRN COCCCCN(Cc1ccccc1)C(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000066337699 940448211 /nfs/dbraw/zinc/44/82/11/940448211.db2.gz NPHXJAALFLGFSB-UHFFFAOYSA-N 0 0 371.437 3.733 20 5 FHBDRN COC(=O)c1ccc(OCc2ncc(-c3ccccc3C)o2)cc1[N+](=O)[O-] ZINC000613110507 940452644 /nfs/dbraw/zinc/45/26/44/940452644.db2.gz PVWFDGZCHIOROA-UHFFFAOYSA-N 0 0 368.345 3.924 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)c2cc3ccccc3oc2=O)cc1[N+](=O)[O-] ZINC000177837656 940459764 /nfs/dbraw/zinc/45/97/64/940459764.db2.gz ZGCVDCQJNAQMRR-LBPRGKRZSA-N 0 0 352.346 3.501 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)cc1[N+](=O)[O-] ZINC000177844772 940462271 /nfs/dbraw/zinc/46/22/71/940462271.db2.gz CMIRDLJJZXSYOH-BCRSCGJKSA-N 0 0 355.350 3.702 20 5 FHBDRN COc1cc(Br)ccc1C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000111073909 945322802 /nfs/dbraw/zinc/32/28/02/945322802.db2.gz HKAIMLZGYKYZBS-UHFFFAOYSA-N 0 0 351.156 3.618 20 5 FHBDRN Cc1cccc(NC2CCN(C(=O)c3cc(Cl)c[nH]3)CC2)c1[N+](=O)[O-] ZINC000376205862 940466683 /nfs/dbraw/zinc/46/66/83/940466683.db2.gz UGRXJCGIRNSZKE-UHFFFAOYSA-N 0 0 362.817 3.601 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCN(c3ccc(Cl)cn3)CC2)c2ccncc21 ZINC000066372687 940468350 /nfs/dbraw/zinc/46/83/50/940468350.db2.gz KWWLJNGMDPNGFC-UHFFFAOYSA-N 0 0 369.812 3.518 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)c2ccc(Br)nc2)cc1[N+](=O)[O-] ZINC000177866004 940471665 /nfs/dbraw/zinc/47/16/65/940471665.db2.gz TZUUOAZGXURDEG-JTQLQIEISA-N 0 0 364.199 3.552 20 5 FHBDRN CCC[C@]1(C(F)(F)F)CCCN1C(=O)c1ccc([N+](=O)[O-])cc1OC ZINC000427395656 945323781 /nfs/dbraw/zinc/32/37/81/945323781.db2.gz QFZBFLIAUBYPJX-OAHLLOKOSA-N 0 0 360.332 3.941 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCc1cc(C)ccc1OC ZINC000613175687 940476063 /nfs/dbraw/zinc/47/60/63/940476063.db2.gz MRXAEDSMYGFMJX-MRXNPFEDSA-N 0 0 356.422 3.797 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1F)N[C@H]1CCCN(c2ccccc2)C1 ZINC000580500302 940477174 /nfs/dbraw/zinc/47/71/74/940477174.db2.gz FDJDJJPSQPFXPN-ZDUSSCGKSA-N 0 0 358.373 3.524 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H]1OCCc2ccccc21 ZINC000613183884 940479031 /nfs/dbraw/zinc/47/90/31/940479031.db2.gz ARVULONOYOEKCC-OXJNMPFZSA-N 0 0 368.433 3.594 20 5 FHBDRN C[C@H](C(=O)Nc1nc(C2CCOCC2)cs1)c1cccc([N+](=O)[O-])c1 ZINC000580594310 940480189 /nfs/dbraw/zinc/48/01/89/940480189.db2.gz OQXMQOUZXWBPEK-NSHDSACASA-N 0 0 361.423 3.688 20 5 FHBDRN C[C@H](NC(=O)c1ccc2c(c1)CCCCC2=O)c1cccc([N+](=O)[O-])c1 ZINC000580645117 940481164 /nfs/dbraw/zinc/48/11/64/940481164.db2.gz WJFYGOKSYWIALB-ZDUSSCGKSA-N 0 0 352.390 3.995 20 5 FHBDRN CC[C@H](NC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F)c1ccc(OC)cc1 ZINC000580736042 940483447 /nfs/dbraw/zinc/48/34/47/940483447.db2.gz IILWCLQKULDOQK-KRWDZBQOSA-N 0 0 364.348 3.692 20 5 FHBDRN CN(C)c1ncccc1CN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000180112474 940483857 /nfs/dbraw/zinc/48/38/57/940483857.db2.gz WBIFRZXRYYYYPM-HXUWFJFHSA-N 0 0 362.433 3.935 20 5 FHBDRN Cc1sc(C(=O)N[C@H]2CC(C)(C)Oc3ccc(N)cc32)cc1[N+](=O)[O-] ZINC000580709390 940484289 /nfs/dbraw/zinc/48/42/89/940484289.db2.gz XAXUUKXPXFAVTD-LBPRGKRZSA-N 0 0 361.423 3.579 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2nc3c(cccc3Cl)n2C)c1 ZINC000549007701 940486387 /nfs/dbraw/zinc/48/63/87/940486387.db2.gz VJEZDQWWKKKMFR-UHFFFAOYSA-N 0 0 374.784 3.786 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc3cnn(CC)c3c2)c1 ZINC000549008648 940488116 /nfs/dbraw/zinc/48/81/16/940488116.db2.gz BCGUOPQGYPQADC-UHFFFAOYSA-N 0 0 354.366 3.615 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)N2CCc3cc(Cl)nnc3C2)cc1[N+](=O)[O-] ZINC000843626306 940488414 /nfs/dbraw/zinc/48/84/14/940488414.db2.gz LNGGICHZEFHDNK-UHFFFAOYSA-N 0 0 374.828 3.534 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)c1cscc1Br ZINC000580883404 940490080 /nfs/dbraw/zinc/49/00/80/940490080.db2.gz MXNKRLPJFKVPBY-UHFFFAOYSA-N 0 0 369.240 3.734 20 5 FHBDRN CC(C)C(=O)c1ccc([C@@H](C)C(=O)NCc2cccc([N+](=O)[O-])c2)cc1 ZINC000549009330 940490686 /nfs/dbraw/zinc/49/06/86/940490686.db2.gz ITLUIZULWPLIEW-CQSZACIVSA-N 0 0 354.406 3.853 20 5 FHBDRN Cc1cccc(CN(C)c2nnc(-c3ccc([N+](=O)[O-])cc3)n2C2CC2)n1 ZINC000581257436 940497993 /nfs/dbraw/zinc/49/79/93/940497993.db2.gz VHYZJKAIDNTJHQ-UHFFFAOYSA-N 0 0 364.409 3.528 20 5 FHBDRN COC(=O)c1cc(NCc2cc(OC)c(F)cc2[N+](=O)[O-])ccc1Cl ZINC000613273320 940499143 /nfs/dbraw/zinc/49/91/43/940499143.db2.gz ZCIRJFUTJINHHJ-UHFFFAOYSA-N 0 0 368.748 3.795 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N[C@H]1c2ccc(F)cc2O[C@H]1C ZINC000581335181 940499632 /nfs/dbraw/zinc/49/96/32/940499632.db2.gz AJJGLJFVURREOY-XXFAHNHDSA-N 0 0 364.760 3.948 20 5 FHBDRN O=C(NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)c1cc2c(s1)CCCC2 ZINC000581452131 940504176 /nfs/dbraw/zinc/50/41/76/940504176.db2.gz IPQWAYQRLZDHBH-UHFFFAOYSA-N 0 0 369.446 3.989 20 5 FHBDRN CO[C@@H]1C[C@@H](c2ccccc2)CC[C@@H]1NC(=O)c1cc([N+](=O)[O-])ccc1C ZINC000581480584 940504648 /nfs/dbraw/zinc/50/46/48/940504648.db2.gz ZTQQTIUYJCBJBP-FFZOFVMBSA-N 0 0 368.433 3.984 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CCN(C)c2ccccc2C1 ZINC000613297111 940506222 /nfs/dbraw/zinc/50/62/22/940506222.db2.gz BMPPFOKLLJTJQF-UHFFFAOYSA-N 0 0 354.410 3.696 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@]3(C2)CCc2ccccc2O3)c1 ZINC000581580412 940509382 /nfs/dbraw/zinc/50/93/82/940509382.db2.gz YEUBYKJQVNXYHH-FQEVSTJZSA-N 0 0 352.390 3.513 20 5 FHBDRN C[C@@H](Nc1ccc(C(N)=O)cc1OCC(F)F)c1ccccc1[N+](=O)[O-] ZINC000581758108 940511772 /nfs/dbraw/zinc/51/17/72/940511772.db2.gz PXIMDBPFVUVEMZ-SNVBAGLBSA-N 0 0 365.336 3.511 20 5 FHBDRN CCOC(=O)c1cc(COC)cc(NCCc2ccc([N+](=O)[O-])cc2)c1 ZINC000427402852 945327649 /nfs/dbraw/zinc/32/76/49/945327649.db2.gz DLKKBQUUFJFMMG-UHFFFAOYSA-N 0 0 358.394 3.573 20 5 FHBDRN O=C(c1c(Cl)cccc1[N+](=O)[O-])N1C[C@@H]2CCC(=O)c3cccc1c32 ZINC000184382767 945331606 /nfs/dbraw/zinc/33/16/06/945331606.db2.gz DFUOXIGFZOKLRS-JTQLQIEISA-N 0 0 356.765 3.969 20 5 FHBDRN Nc1ccc(-c2noc([C@H]3C[C@@H]3c3cc(F)ccc3F)n2)cc1[N+](=O)[O-] ZINC000581915609 940625684 /nfs/dbraw/zinc/62/56/84/940625684.db2.gz KWUPUTZRFUNFDO-PWSUYJOCSA-N 0 0 358.304 3.776 20 5 FHBDRN COc1ccc(CC(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)cc1 ZINC000581839453 940626117 /nfs/dbraw/zinc/62/61/17/940626117.db2.gz HHLYQDVQKBHTHO-UHFFFAOYSA-N 0 0 365.183 3.547 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1)CN(Cc1csc(Br)c1)CCO2 ZINC000581913725 940633361 /nfs/dbraw/zinc/63/33/61/940633361.db2.gz XMLMWLRVCYTJIP-UHFFFAOYSA-N 0 0 369.240 3.813 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(Cc2noc(COc3cc(C)cc(C)c3)n2)c1 ZINC000582056158 940644511 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FHBDRN COc1cc(CN2CCC[C@H](CC(=O)OC(C)(C)C)C2)ccc1[N+](=O)[O-] ZINC000540907720 940758132 /nfs/dbraw/zinc/75/81/32/940758132.db2.gz LPEQLMCEUWXUIM-CQSZACIVSA-N 0 0 364.442 3.547 20 5 FHBDRN CNc1ccc([N+](=O)[O-])cc1NC(=O)c1cc(C(C)C)nc2onc(C)c21 ZINC000582609359 940758514 /nfs/dbraw/zinc/75/85/14/940758514.db2.gz JQGZGASYYLWGJU-UHFFFAOYSA-N 0 0 369.381 3.857 20 5 FHBDRN Cc1ccc(F)cc1NC(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000582629050 940767024 /nfs/dbraw/zinc/76/70/24/940767024.db2.gz HJTASXQMQQOIMB-UHFFFAOYSA-N 0 0 356.357 3.888 20 5 FHBDRN Cc1c(F)ccc([N+](=O)[O-])c1C(=O)Nc1cccc(OC[C@H]2CCCO2)c1 ZINC000843762274 945348232 /nfs/dbraw/zinc/34/82/32/945348232.db2.gz WXVALCGPNHCRKZ-OAHLLOKOSA-N 0 0 374.368 3.852 20 5 FHBDRN O=c1c2ccc(F)cc2ncn1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000549035151 940784231 /nfs/dbraw/zinc/78/42/31/940784231.db2.gz SFEVPDWHPLJGCT-UHFFFAOYSA-N 0 0 367.258 3.511 20 5 FHBDRN Cc1ccc(-c2noc([C@H](C)NC(=O)c3ccc([N+](=O)[O-])cc3)n2)cc1F ZINC000472556117 940785702 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CCS[C@H]1CCCC[C@@H]1NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000175258191 940832643 /nfs/dbraw/zinc/83/26/43/940832643.db2.gz UZKQRHXJSFVIPJ-RDJZCZTQSA-N 0 0 374.466 3.575 20 5 FHBDRN C[C@@H](NS(=O)(=O)Cc1ccccc1[N+](=O)[O-])c1ccc2c(c1)CCCC2 ZINC000472567529 940845420 /nfs/dbraw/zinc/84/54/20/940845420.db2.gz COFGJHQCGSRCFR-CQSZACIVSA-N 0 0 374.462 3.654 20 5 FHBDRN CC(=O)c1ccc(OCc2nc(-c3cccc([N+](=O)[O-])c3)no2)c(F)c1 ZINC000170853825 940858165 /nfs/dbraw/zinc/85/81/65/940858165.db2.gz BQTYPUKHJPUSPR-UHFFFAOYSA-N 0 0 357.297 3.566 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CCOC2(CCC2)C1 ZINC000426618331 945355548 /nfs/dbraw/zinc/35/55/48/945355548.db2.gz FDQYFGBOJSEPIX-INIZCTEOSA-N 0 0 361.442 3.617 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H](C)OC[C@@H]2c2ccccc2)c1 ZINC000175433602 940869443 /nfs/dbraw/zinc/86/94/43/940869443.db2.gz RXSBOYGWPABEHK-FZKQIMNGSA-N 0 0 372.446 3.919 20 5 FHBDRN COc1c(O)ccc(CN[C@H](C)c2ccccc2OC(C)C)c1[N+](=O)[O-] ZINC000892600139 940901669 /nfs/dbraw/zinc/90/16/69/940901669.db2.gz PQFOJFPRSJCUQX-CYBMUJFWSA-N 0 0 360.410 3.947 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CN[C@H](C(=O)OC(C)(C)C)c1ccccc1 ZINC000180273005 940905529 /nfs/dbraw/zinc/90/55/29/940905529.db2.gz HJVMOCQEPVBHNA-SFHVURJKSA-N 0 0 372.421 3.776 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)NCCc2cc(C)c(O)c(C)c2)c1 ZINC000188669474 940916759 /nfs/dbraw/zinc/91/67/59/940916759.db2.gz RCYWWPMBLSNRQC-UHFFFAOYSA-N 0 0 360.435 3.612 20 5 FHBDRN C[C@@H]1c2ccccc2CCN1C(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000170957219 940935792 /nfs/dbraw/zinc/93/57/92/940935792.db2.gz TYDLVMYUIXKAJN-CQSZACIVSA-N 0 0 362.389 3.540 20 5 FHBDRN O=C(NCc1ccc(Cl)s1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000180307257 940949220 /nfs/dbraw/zinc/94/92/20/940949220.db2.gz UHYUYADYUQOUER-UHFFFAOYSA-N 0 0 362.741 3.841 20 5 FHBDRN C[C@H](Nc1ncc(Cl)cc1[N+](=O)[O-])c1noc(Cc2ccccc2)n1 ZINC000153918781 945363103 /nfs/dbraw/zinc/36/31/03/945363103.db2.gz PUBGUFOOUFJCMN-JTQLQIEISA-N 0 0 359.773 3.790 20 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941022229 /nfs/dbraw/zinc/02/22/29/941022229.db2.gz GURLBYFIOLYVHK-CQSZACIVSA-N 0 0 352.394 3.614 20 5 FHBDRN C[C@@H]1CO[C@H](c2ccccc2)CN1c1ncnc2sc([N+](=O)[O-])cc21 ZINC000376446385 941023225 /nfs/dbraw/zinc/02/32/25/941023225.db2.gz FZHNBZXWKLFRKZ-RISCZKNCSA-N 0 0 356.407 3.566 20 5 FHBDRN CCOc1cc2c(cc1CNC(=O)Nc1cccc([N+](=O)[O-])c1)O[C@H](C)C2 ZINC000024366347 941023683 /nfs/dbraw/zinc/02/36/83/941023683.db2.gz OBWDBLBHZUYXFE-GFCCVEGCSA-N 0 0 371.393 3.639 20 5 FHBDRN C[C@H](c1nnc(-c2ccc(Cl)c(Cl)c2)o1)n1cc([N+](=O)[O-])cn1 ZINC000180500976 941032569 /nfs/dbraw/zinc/03/25/69/941032569.db2.gz IFFQZMOEDDYFHM-SSDOTTSWSA-N 0 0 354.153 3.757 20 5 FHBDRN COc1ccccc1[C@H](C)CC(=O)OCc1ccc(OC)c([N+](=O)[O-])c1 ZINC000728662527 941041323 /nfs/dbraw/zinc/04/13/23/941041323.db2.gz PMLBZHRJDJQNQH-CYBMUJFWSA-N 0 0 359.378 3.849 20 5 FHBDRN O=C(Nc1ccncc1[N+](=O)[O-])N1CCCCC[C@H]1/C=C\c1ccccc1 ZINC000540980963 941049635 /nfs/dbraw/zinc/04/96/35/941049635.db2.gz WFOAQUUDBSSQRY-MQNTZWLQSA-N 0 0 366.421 3.902 20 5 FHBDRN CC(C)(C)c1nc2cc(NC(=O)c3c(N)cccc3[N+](=O)[O-])ccc2o1 ZINC000180643774 941057943 /nfs/dbraw/zinc/05/79/43/941057943.db2.gz LKNIOFDGBPRCKF-UHFFFAOYSA-N 0 0 354.366 3.868 20 5 FHBDRN Nc1cccc([N+](=O)[O-])c1C(=O)NCc1cccc(Oc2ccccc2)c1 ZINC000180656537 941060156 /nfs/dbraw/zinc/06/01/56/941060156.db2.gz SPCXSAOIZIEZCA-UHFFFAOYSA-N 0 0 363.373 3.899 20 5 FHBDRN COc1ccccc1[C@H](C)CC(=O)OCCOc1ccccc1[N+](=O)[O-] ZINC000728663611 941065572 /nfs/dbraw/zinc/06/55/72/941065572.db2.gz VAPZYCDZEFWILD-CQSZACIVSA-N 0 0 359.378 3.719 20 5 FHBDRN Cc1nc(CC(C)C)oc1C(=O)Nc1ccnn1-c1ccc([N+](=O)[O-])cc1 ZINC000188762157 941077132 /nfs/dbraw/zinc/07/71/32/941077132.db2.gz PKWIRYPVUJLCTF-UHFFFAOYSA-N 0 0 369.381 3.528 20 5 FHBDRN CCc1nc(NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)sc1C ZINC000180798328 941079189 /nfs/dbraw/zinc/07/91/89/941079189.db2.gz OESBXAOGSVCSDY-UHFFFAOYSA-N 0 0 357.338 3.776 20 5 FHBDRN CC(C)(NC(=O)CSc1nc2ccccc2o1)c1ccc([N+](=O)[O-])cc1 ZINC000176885639 941080847 /nfs/dbraw/zinc/08/08/47/941080847.db2.gz SHQVXGQGTDUNAX-UHFFFAOYSA-N 0 0 371.418 3.880 20 5 FHBDRN COc1ccc(-c2nc(CNc3cc([N+](=O)[O-])c(C)cc3C)no2)cc1 ZINC000176867138 941081586 /nfs/dbraw/zinc/08/15/86/941081586.db2.gz LRSVEPZYMCJMLH-UHFFFAOYSA-N 0 0 354.366 3.882 20 5 FHBDRN Cc1ccc(C2CCN(C(=O)c3ccc(Cl)cc3[N+](=O)[O-])CC2)cn1 ZINC000376496062 941084336 /nfs/dbraw/zinc/08/43/36/941084336.db2.gz UFSBHRRICHTAAT-UHFFFAOYSA-N 0 0 359.813 3.971 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CCC(n3c(C)ccc3C)CC2)c1 ZINC000549085986 941085512 /nfs/dbraw/zinc/08/55/12/941085512.db2.gz FJFBQIRKOBXUEB-UHFFFAOYSA-N 0 0 371.437 3.889 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CCC[C@H](C)CC2)cc1OC ZINC000188791500 941086557 /nfs/dbraw/zinc/08/65/57/941086557.db2.gz YFOWRWDVIMTIDJ-QWHCGFSZSA-N 0 0 350.415 3.701 20 5 FHBDRN O=[N+]([O-])c1ccc2oc(CN3CCC(Oc4ccc(F)cc4)CC3)nc2c1 ZINC000177079953 941098652 /nfs/dbraw/zinc/09/86/52/941098652.db2.gz HDNQXWJAAIOMNN-UHFFFAOYSA-N 0 0 371.368 3.919 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(N2CCC[C@H]2CC(=O)c2ccc(F)cc2)n1 ZINC000541004968 941101222 /nfs/dbraw/zinc/10/12/22/941101222.db2.gz CRYDFQKMHPPIJI-INIZCTEOSA-N 0 0 357.385 3.988 20 5 FHBDRN CCOc1cc(C(=O)N[C@H]2CCC[C@H](C)CC2)c([N+](=O)[O-])cc1OC ZINC000188850113 941118576 /nfs/dbraw/zinc/11/85/76/941118576.db2.gz ZASPYDWFOYNMJF-STQMWFEESA-N 0 0 350.415 3.701 20 5 FHBDRN C[C@H]1CN(C(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)CC[C@H]1c1ccccc1 ZINC000181272791 941119312 /nfs/dbraw/zinc/11/93/12/941119312.db2.gz PEZFLTURNXGRSJ-XJKSGUPXSA-N 0 0 368.389 3.589 20 5 FHBDRN O=C(Nc1ccc(F)cn1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000103072258 941121988 /nfs/dbraw/zinc/12/19/88/941121988.db2.gz FVVKSUVVXJFPFH-UHFFFAOYSA-N 0 0 366.352 3.993 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)S(=O)(=O)Cc1nnc(C(C)C)s1 ZINC000414424532 941125515 /nfs/dbraw/zinc/12/55/15/941125515.db2.gz GHRBRWQRVHMWJH-LLVKDONJSA-N 0 0 369.468 3.554 20 5 FHBDRN CCN(Cc1ccccc1C)S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000146752793 941130601 /nfs/dbraw/zinc/13/06/01/941130601.db2.gz FCTGTLBIWOQOJO-UHFFFAOYSA-N 0 0 368.842 3.767 20 5 FHBDRN O=C(C[C@H]1CCCO1)Nc1ccc(OCc2ccccc2)cc1[N+](=O)[O-] ZINC000188954011 941131624 /nfs/dbraw/zinc/13/16/24/941131624.db2.gz GOZHBPMALLEOER-OAHLLOKOSA-N 0 0 356.378 3.681 20 5 FHBDRN O=C(N[C@H]1CCOc2c(F)cccc21)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000188957993 941134089 /nfs/dbraw/zinc/13/40/89/941134089.db2.gz IOCPXMNPDBHBOG-AWEZNQCLSA-N 0 0 350.733 3.641 20 5 FHBDRN COc1cc(C(=O)Nc2ccc3c(c2)C(=O)CCC3)cc([N+](=O)[O-])c1C ZINC000188981145 941138053 /nfs/dbraw/zinc/13/80/53/941138053.db2.gz QZYIKWVZLJUNSO-UHFFFAOYSA-N 0 0 354.362 3.683 20 5 FHBDRN CC(C)c1ccc(C(=O)N[C@H](C)c2ccc(NC(N)=O)cc2)cc1[N+](=O)[O-] ZINC000189027564 941142382 /nfs/dbraw/zinc/14/23/82/941142382.db2.gz NEHQGVZWOBNCGA-GFCCVEGCSA-N 0 0 370.409 3.700 20 5 FHBDRN COc1ccccc1CN(C(=O)c1cc(OC)c(C)c([N+](=O)[O-])c1)C1CC1 ZINC000189041727 941144060 /nfs/dbraw/zinc/14/40/60/941144060.db2.gz DYYPEANTBFKZAG-UHFFFAOYSA-N 0 0 370.405 3.725 20 5 FHBDRN O=[N+]([O-])c1cccc(CN(Cc2nc(-c3ccccc3F)no2)C2CC2)c1 ZINC000189092223 941145283 /nfs/dbraw/zinc/14/52/83/941145283.db2.gz CUCONGPMKCQNCG-UHFFFAOYSA-N 0 0 368.368 3.949 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H](C)Oc2ncccc21 ZINC000189070890 941146162 /nfs/dbraw/zinc/14/61/62/941146162.db2.gz IRTQIJOVCUUIFL-GFCCVEGCSA-N 0 0 373.434 3.918 20 5 FHBDRN CC(C)c1nnc2ccc(NC(=O)c3ccc(Cl)cc3[N+](=O)[O-])cn21 ZINC000189075062 941146631 /nfs/dbraw/zinc/14/66/31/941146631.db2.gz HUJHBBQIRUFWRE-UHFFFAOYSA-N 0 0 359.773 3.667 20 5 FHBDRN Cc1csc([C@H]2COCCN2c2ccc([N+](=O)[O-])c(OC(F)F)c2)n1 ZINC000189136070 941147315 /nfs/dbraw/zinc/14/73/15/941147315.db2.gz WKDHSZLSMMDWBL-GFCCVEGCSA-N 0 0 371.365 3.539 20 5 FHBDRN CCSc1cc(CNC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)ccn1 ZINC000189104475 941148408 /nfs/dbraw/zinc/14/84/08/941148408.db2.gz RBWFUVPFIBFJCB-UHFFFAOYSA-N 0 0 365.842 3.614 20 5 FHBDRN CC1(C)CN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)CC2(CCCC2)O1 ZINC000189165796 941149314 /nfs/dbraw/zinc/14/93/14/941149314.db2.gz OFBODAGYRAFNHP-UHFFFAOYSA-N 0 0 352.818 3.812 20 5 FHBDRN Cc1cc(Br)cc(NC(=O)c2c(N)cccc2[N+](=O)[O-])c1 ZINC000189213859 941153407 /nfs/dbraw/zinc/15/34/07/941153407.db2.gz OYKJNUDNKMKVJM-UHFFFAOYSA-N 0 0 350.172 3.500 20 5 FHBDRN CCOc1ccc(C(=O)Nc2ccc3c(c2)C(=O)CCC3)cc1[N+](=O)[O-] ZINC000177973330 941156080 /nfs/dbraw/zinc/15/60/80/941156080.db2.gz KXEJLKOJZMIPMJ-UHFFFAOYSA-N 0 0 354.362 3.765 20 5 FHBDRN COc1ccc2[nH]c(C(=O)N[C@H](C)c3ccc(C)c([N+](=O)[O-])c3)cc2c1 ZINC000189395689 941157087 /nfs/dbraw/zinc/15/70/87/941157087.db2.gz OHNIQNXECLZZFZ-GFCCVEGCSA-N 0 0 353.378 3.884 20 5 FHBDRN COc1cc(NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)ccc1F ZINC000189420015 941157226 /nfs/dbraw/zinc/15/72/26/941157226.db2.gz WUHNVJNSYTYUFS-UHFFFAOYSA-N 0 0 373.384 3.598 20 5 FHBDRN COc1cc(NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)ccc1F ZINC000189452498 941158159 /nfs/dbraw/zinc/15/81/59/941158159.db2.gz DLZIEUUCNQFNOK-UHFFFAOYSA-N 0 0 359.357 3.595 20 5 FHBDRN COc1cc(C(=O)N2CC(C)(C)Oc3ccccc32)cc([N+](=O)[O-])c1C ZINC000189534953 941161121 /nfs/dbraw/zinc/16/11/21/941161121.db2.gz RGGXDHHPRBHZFE-UHFFFAOYSA-N 0 0 356.378 3.730 20 5 FHBDRN Cc1cc(Oc2cccc(I)c2)ncc1[N+](=O)[O-] ZINC000092026680 941166709 /nfs/dbraw/zinc/16/67/09/941166709.db2.gz YISGVQNKXADUDU-UHFFFAOYSA-N 0 0 356.119 3.695 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N[C@H]1CCOc2c(F)cccc21 ZINC000189629779 941232264 /nfs/dbraw/zinc/23/22/64/941232264.db2.gz QVJGLRJJZBKBLL-HNNXBMFYSA-N 0 0 358.369 3.913 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCCCC[C@H]1c1ncon1 ZINC000189635511 941235831 /nfs/dbraw/zinc/23/58/31/941235831.db2.gz YGQKQNSDIYNVHC-RDJZCZTQSA-N 0 0 372.425 3.690 20 5 FHBDRN CC(=O)c1ccc(NC[C@@](C)(Cc2ccccc2)[C@@H](C)O)c([N+](=O)[O-])c1 ZINC000189652613 941242524 /nfs/dbraw/zinc/24/25/24/941242524.db2.gz ZBPYITLDYDFSJN-FOIQADDNSA-N 0 0 356.422 3.839 20 5 FHBDRN Cc1cc(C(=O)N2C[C@]3(C[C@@H]4CC[C@H]3C4)OC(C)(C)C2)cc([N+](=O)[O-])c1 ZINC000407973085 941246891 /nfs/dbraw/zinc/24/68/91/941246891.db2.gz OZKGLRMJVNSIGA-IIMJZQEZSA-N 0 0 358.438 3.713 20 5 FHBDRN COc1cccc(C2(NC(=O)CSc3ccccc3[N+](=O)[O-])CC2)c1 ZINC000122227560 941252497 /nfs/dbraw/zinc/25/24/97/941252497.db2.gz JKPOKUZNUCXRDM-UHFFFAOYSA-N 0 0 358.419 3.501 20 5 FHBDRN COC[C@@H](Cc1ccccc1)N(C)C(=O)Nc1c(C)ccc([N+](=O)[O-])c1C ZINC000189737868 941266484 /nfs/dbraw/zinc/26/64/84/941266484.db2.gz URBDQDXMSHVRSP-QGZVFWFLSA-N 0 0 371.437 3.933 20 5 FHBDRN C[C@H](C1CC1)n1cc(NC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)cn1 ZINC000189757024 941273413 /nfs/dbraw/zinc/27/34/13/941273413.db2.gz LZYCOVXFUHOYBW-SNVBAGLBSA-N 0 0 363.805 3.737 20 5 FHBDRN Cc1c(CC(=O)N2CCC(N(C)c3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000178606049 941283373 /nfs/dbraw/zinc/28/33/73/941283373.db2.gz WORCMUINUHWVEY-UHFFFAOYSA-N 0 0 367.449 3.573 20 5 FHBDRN COc1cc(CN2CCC[C@@H]2c2csc(C)n2)c([N+](=O)[O-])cc1F ZINC000189829730 941284443 /nfs/dbraw/zinc/28/44/43/941284443.db2.gz ZNXNDNLUAUNAAD-CQSZACIVSA-N 0 0 351.403 3.845 20 5 FHBDRN O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1CC2(CCOCC2)c2ccccc21 ZINC000189859588 941290110 /nfs/dbraw/zinc/29/01/10/941290110.db2.gz FYNOVCPUAORKJX-UHFFFAOYSA-N 0 0 372.808 3.957 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CCN(c2ccccc2F)C[C@H]1C ZINC000189902809 941297493 /nfs/dbraw/zinc/29/74/93/941297493.db2.gz FOQQPKPWGZNFEJ-CQSZACIVSA-N 0 0 372.400 3.785 20 5 FHBDRN CCCN(c1cccc([N+](=O)[O-])c1)S(=O)(=O)c1cc(C)cnc1Cl ZINC001211646472 941315275 /nfs/dbraw/zinc/31/52/75/941315275.db2.gz VWRCZJSIYXCKME-UHFFFAOYSA-N 0 0 369.830 3.557 20 5 FHBDRN CC1(C)CN(C(=O)c2ccc(Cl)cc2[N+](=O)[O-])CC2(CCCC2)O1 ZINC000189965268 941317294 /nfs/dbraw/zinc/31/72/94/941317294.db2.gz RZTHBRPGHWLVOA-UHFFFAOYSA-N 0 0 352.818 3.812 20 5 FHBDRN O=[N+]([O-])c1ccccc1CN(Cc1nnc(-c2ccccc2)o1)C1CC1 ZINC000179240450 941341754 /nfs/dbraw/zinc/34/17/54/941341754.db2.gz UQRNVPILFPBBAS-UHFFFAOYSA-N 0 0 350.378 3.809 20 5 FHBDRN Cc1[nH]c2ccc(CNC(=O)COc3ccc([N+](=O)[O-])c(C)c3)cc2c1C ZINC000431835970 941367041 /nfs/dbraw/zinc/36/70/41/941367041.db2.gz QAFGWSNLPFQZLY-UHFFFAOYSA-N 0 0 367.405 3.697 20 5 FHBDRN CCS[C@@H]1CC[C@H](N(C)S(=O)(=O)c2c(C)ccc(C)c2[N+](=O)[O-])C1 ZINC000190031219 941379111 /nfs/dbraw/zinc/37/91/11/941379111.db2.gz OAXOMDDZBKUKQX-UONOGXRCSA-N 0 0 372.512 3.506 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)N2CCCC[C@H]2c2cc[nH]n2)cc1[N+](=O)[O-] ZINC000376699850 941383809 /nfs/dbraw/zinc/38/38/09/941383809.db2.gz KPUSYTUZPWUTCP-CJNGLKHVSA-N 0 0 357.414 3.624 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)N2CCCC[C@H]2c2cc[nH]n2)cc1[N+](=O)[O-] ZINC000376699849 941383839 /nfs/dbraw/zinc/38/38/39/941383839.db2.gz KPUSYTUZPWUTCP-BBRMVZONSA-N 0 0 357.414 3.624 20 5 FHBDRN CCC[N@H+](CC(=O)[O-])Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000414687242 941439044 /nfs/dbraw/zinc/43/90/44/941439044.db2.gz WXSDJRYQWSRWLX-UHFFFAOYSA-N 0 0 362.357 3.823 20 5 FHBDRN Cc1nc([C@H]2CCCCN2c2ccc([N+](=O)[O-])c(OC(F)F)c2)no1 ZINC000376812010 941439764 /nfs/dbraw/zinc/43/97/64/941439764.db2.gz UKRUPNXLIMWZNY-GFCCVEGCSA-N 0 0 354.313 3.619 20 5 FHBDRN O=C(Nc1cc2c(cc1[N+](=O)[O-])OCCCO2)[C@@H]1C[C@]1(F)c1ccccc1 ZINC000414733072 941451419 /nfs/dbraw/zinc/45/14/19/941451419.db2.gz CINBUVUINPAICC-DJJJIMSYSA-N 0 0 372.352 3.580 20 5 FHBDRN O=[N+]([O-])c1ccccc1Cc1noc(-c2cccnc2C(F)(F)F)n1 ZINC000472656201 941504227 /nfs/dbraw/zinc/50/42/27/941504227.db2.gz OEASMIMVLYZUNT-UHFFFAOYSA-N 0 0 350.256 3.649 20 5 FHBDRN CC(=O)Nc1cccc([C@H](C)NC(=O)c2c(Cl)cccc2[N+](=O)[O-])c1 ZINC000110198261 941530361 /nfs/dbraw/zinc/53/03/61/941530361.db2.gz DWDRMASHCBVUNK-JTQLQIEISA-N 0 0 361.785 3.698 20 5 FHBDRN COc1ccccc1-c1nnc(COc2ccc(Cl)c([N+](=O)[O-])c2)o1 ZINC000377176191 941541765 /nfs/dbraw/zinc/54/17/65/941541765.db2.gz QHAHGZKXPCZQGK-UHFFFAOYSA-N 0 0 361.741 3.886 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(OC(F)F)cc1 ZINC000549157025 941548129 /nfs/dbraw/zinc/54/81/29/941548129.db2.gz SRLCCUNXIOPJNF-UHFFFAOYSA-N 0 0 365.336 3.903 20 5 FHBDRN O=C(Nc1ccc(Cl)cc1-n1cccn1)c1cc(F)cc([N+](=O)[O-])c1 ZINC000472685968 941565120 /nfs/dbraw/zinc/56/51/20/941565120.db2.gz VOUHLRJTKCSCHI-UHFFFAOYSA-N 0 0 360.732 3.825 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)Nc1nc(CN2CCCCCC2)cs1 ZINC000549171430 941581021 /nfs/dbraw/zinc/58/10/21/941581021.db2.gz FPTDKDJZBNOCTM-UHFFFAOYSA-N 0 0 374.466 3.988 20 5 FHBDRN Cn1ccc([C@@H](NC(=O)c2ccccc2[N+](=O)[O-])c2ccc(Cl)cc2)n1 ZINC000377233268 941585408 /nfs/dbraw/zinc/58/54/08/941585408.db2.gz RXKVCNIRRADDRZ-KRWDZBQOSA-N 0 0 370.796 3.501 20 5 FHBDRN CCn1c(SCCC(C)(C)OC)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000468464698 941588149 /nfs/dbraw/zinc/58/81/49/941588149.db2.gz BDRKKLVXDNFPLR-UHFFFAOYSA-N 0 0 350.444 3.780 20 5 FHBDRN COc1ccc(NC(=O)N[C@@H](C)c2cccc(F)c2F)cc1[N+](=O)[O-] ZINC000541106310 941599955 /nfs/dbraw/zinc/59/99/55/941599955.db2.gz PBMLYIJWUZCHOG-VIFPVBQESA-N 0 0 351.309 3.764 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(N[C@@H](C)[C@H](OC)c2ccc(OC)cc2)c1 ZINC000541113245 941605567 /nfs/dbraw/zinc/60/55/67/941605567.db2.gz VHKYTHIJJZAYKJ-SGTLLEGYSA-N 0 0 374.393 3.578 20 5 FHBDRN C[C@@H](c1cccs1)N(Cc1ccccc1)C(=O)c1c[nH]nc1[N+](=O)[O-] ZINC000549192122 941616874 /nfs/dbraw/zinc/61/68/74/941616874.db2.gz WCFYGHATQKGHHV-LBPRGKRZSA-N 0 0 356.407 3.783 20 5 FHBDRN CO[C@H]1CCC[C@H](C(=O)N(Cc2ccccc2[N+](=O)[O-])CC(F)(F)F)C1 ZINC000565555151 941617641 /nfs/dbraw/zinc/61/76/41/941617641.db2.gz KQMCJFDRCQEVHE-JSGCOSHPSA-N 0 0 374.359 3.691 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2cccc(Cl)c2OC)c1 ZINC000549201589 941636582 /nfs/dbraw/zinc/63/65/82/941636582.db2.gz MNDBPFZDOXWTFR-UHFFFAOYSA-N 0 0 350.758 3.908 20 5 FHBDRN O=C(NC[C@@H](O)COc1ccccc1)c1cc2ccccc2c2cccnc12 ZINC000613664716 941649485 /nfs/dbraw/zinc/64/94/85/941649485.db2.gz JOOGRSODHJJXAP-QGZVFWFLSA-N 0 0 372.424 3.558 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NCc2c(F)cccc2Cl)c1 ZINC000549212937 941649849 /nfs/dbraw/zinc/64/98/49/941649849.db2.gz DKSZVFBEQOALJO-UHFFFAOYSA-N 0 0 352.749 3.716 20 5 FHBDRN CC(C)Cn1nccc1NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000122355945 941661006 /nfs/dbraw/zinc/66/10/06/941661006.db2.gz YSWOHBJNSFOJIR-UHFFFAOYSA-N 0 0 371.422 3.823 20 5 FHBDRN COc1ccc(OCCOc2cccc3ccc(C)nc32)c([N+](=O)[O-])c1 ZINC000541125456 941673474 /nfs/dbraw/zinc/67/34/74/941673474.db2.gz XLWCACOUZGDGGE-UHFFFAOYSA-N 0 0 354.362 3.918 20 5 FHBDRN C[C@H]1C[C@@H](c2ccc(C(F)(F)F)cc2)N(C(=O)c2c[nH]nc2[N+](=O)[O-])C1 ZINC000549223307 941675321 /nfs/dbraw/zinc/67/53/21/941675321.db2.gz IFSAQFFJTWYZOE-ZANVPECISA-N 0 0 368.315 3.560 20 5 FHBDRN CC(=O)c1ccc(C(=O)Nc2ccnn2-c2ccc([N+](=O)[O-])cc2)cc1C ZINC001125859070 941682008 /nfs/dbraw/zinc/68/20/08/941682008.db2.gz JQLBGMSYABLNON-UHFFFAOYSA-N 0 0 364.361 3.544 20 5 FHBDRN COc1cc(C(=O)NC[C@H]2CSc3ccccc32)cc([N+](=O)[O-])c1C ZINC000452215807 941688288 /nfs/dbraw/zinc/68/82/88/941688288.db2.gz VIXABKNZERYVAI-ZDUSSCGKSA-N 0 0 358.419 3.531 20 5 FHBDRN Cn1cc([N+](=O)[O-])cc1C(=O)Nc1ccc(-c2cn3ccsc3n2)cc1 ZINC000024476446 941689908 /nfs/dbraw/zinc/68/99/08/941689908.db2.gz XSLMOQBKVUVPEA-UHFFFAOYSA-N 0 0 367.390 3.562 20 5 FHBDRN Cc1cccc2cc(C(=O)N3CCC(n4ccc([N+](=O)[O-])n4)CC3)sc21 ZINC000377398924 941691847 /nfs/dbraw/zinc/69/18/47/941691847.db2.gz DENFXFIBBOXBHQ-UHFFFAOYSA-N 0 0 370.434 3.792 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)OCc1nc(Cl)ccc1Cl ZINC000729203502 941693822 /nfs/dbraw/zinc/69/38/22/941693822.db2.gz LDVUFOQDSSMCGV-UHFFFAOYSA-N 0 0 357.149 3.662 20 5 FHBDRN CC(C)Oc1cc(C(=O)N[C@](C)(C2CC2)C(F)(F)F)ccc1[N+](=O)[O-] ZINC000415244925 941699050 /nfs/dbraw/zinc/69/90/50/941699050.db2.gz UIFCOHNVZMZFRS-OAHLLOKOSA-N 0 0 360.332 3.843 20 5 FHBDRN COC(=O)[C@@H](CCOc1ccc(C(C)=O)cc1[N+](=O)[O-])c1ccccc1 ZINC000564953484 941710632 /nfs/dbraw/zinc/71/06/32/941710632.db2.gz IILPSQWEVUCZSV-INIZCTEOSA-N 0 0 357.362 3.523 20 5 FHBDRN CC(C)(C)Cc1ccccc1C(=O)OCC(=O)Nc1cccc([N+](=O)[O-])c1 ZINC001125859491 941716006 /nfs/dbraw/zinc/71/60/06/941716006.db2.gz TYVKFEYQMLHXFG-UHFFFAOYSA-N 0 0 370.405 3.979 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CN1CCCC[C@@H]1c1noc(C2CC2)n1 ZINC000377431025 941718210 /nfs/dbraw/zinc/71/82/10/941718210.db2.gz HFBHPQGRDLJFQC-OAHLLOKOSA-N 0 0 358.398 3.591 20 5 FHBDRN CC/C=C(/C)C(=O)N1CCCC[C@H]1CCOC(=O)c1cccc([N+](=O)[O-])c1 ZINC000729324827 941719003 /nfs/dbraw/zinc/71/90/03/941719003.db2.gz IJSGIPPXCUFENM-OLMDTSMNSA-N 0 0 374.437 3.879 20 5 FHBDRN Cc1onc(-c2ccncc2)c1-c1nc(Cc2ccc([N+](=O)[O-])cc2)no1 ZINC000377441375 941726822 /nfs/dbraw/zinc/72/68/22/941726822.db2.gz GHNIKCVKEIQQGH-UHFFFAOYSA-N 0 0 363.333 3.594 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000024068428 941730126 /nfs/dbraw/zinc/73/01/26/941730126.db2.gz TWIFGOWGXVCVFU-LLVKDONJSA-N 0 0 361.379 3.931 20 5 FHBDRN CN(C[C@H]1CCN(c2c(F)cc([N+](=O)[O-])cc2F)C1)C(=O)OC(C)(C)C ZINC000178870769 941733754 /nfs/dbraw/zinc/73/37/54/941733754.db2.gz WLLISWWDELXOBH-LLVKDONJSA-N 0 0 371.384 3.566 20 5 FHBDRN C[C@H](O)c1ccc(CNC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000178864311 941735297 /nfs/dbraw/zinc/73/52/97/941735297.db2.gz SAVNTQCFVCJZAD-AWEZNQCLSA-N 0 0 369.421 3.522 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(-c3nccs3)cc2)c1 ZINC000067299328 941738371 /nfs/dbraw/zinc/73/83/71/941738371.db2.gz MHOQGNJQDQJOMN-UHFFFAOYSA-N 0 0 355.375 3.979 20 5 FHBDRN Cc1oc(-c2ccccc2)nc1CCNC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000377481037 941759758 /nfs/dbraw/zinc/75/97/58/941759758.db2.gz GFYCTISGEIMVOM-UHFFFAOYSA-N 0 0 351.362 3.531 20 5 FHBDRN Cc1c(C(=O)NCCc2coc(-c3ccc(F)cc3)n2)cccc1[N+](=O)[O-] ZINC000377486630 941762079 /nfs/dbraw/zinc/76/20/79/941762079.db2.gz NSXAZUQUNXMRTR-UHFFFAOYSA-N 0 0 369.352 3.670 20 5 FHBDRN CC(C)CCc1cc(=NC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)[nH][nH]1 ZINC000445263611 941764267 /nfs/dbraw/zinc/76/42/67/941764267.db2.gz QOOVYTUNVFKMQQ-UHFFFAOYSA-N 0 0 374.444 3.667 20 5 FHBDRN COc1ccc(CNC(=O)N(C)Cc2cc(C)cc(C)c2)cc1[N+](=O)[O-] ZINC000433562633 941765815 /nfs/dbraw/zinc/76/58/15/941765815.db2.gz XRDOIWGXUQRPHX-UHFFFAOYSA-N 0 0 357.410 3.562 20 5 FHBDRN Cc1cc(NC[C@@H](O)COc2ccc(C(F)(F)F)cc2)ccc1[N+](=O)[O-] ZINC000513173420 941766263 /nfs/dbraw/zinc/76/62/63/941766263.db2.gz JMEYWVALCUEQFU-CQSZACIVSA-N 0 0 370.327 3.774 20 5 FHBDRN CCOC(=O)C1CCC(CC(=O)Nc2cc([N+](=O)[O-])ccc2CC)CC1 ZINC000583631970 941769403 /nfs/dbraw/zinc/76/94/03/941769403.db2.gz JCMJCOMNZQGMAP-UHFFFAOYSA-N 0 0 362.426 3.855 20 5 FHBDRN O=[N+]([O-])c1ccc(Cl)cc1OCc1nc(Cc2cccc(F)c2)no1 ZINC000783027763 941769963 /nfs/dbraw/zinc/76/99/63/941769963.db2.gz JWVQKYOGUPCRCV-UHFFFAOYSA-N 0 0 363.732 3.940 20 5 FHBDRN O=C(CCc1ccc(F)cc1F)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000583656574 941787299 /nfs/dbraw/zinc/78/72/99/941787299.db2.gz AMRYMDBXLKXUBM-UHFFFAOYSA-N 0 0 373.359 3.646 20 5 FHBDRN O=[N+]([O-])c1ccccc1Sc1nnc2ccc(Br)cn21 ZINC000549266816 941794101 /nfs/dbraw/zinc/79/41/01/941794101.db2.gz HENRRMKRZOAYOB-UHFFFAOYSA-N 0 0 351.185 3.551 20 5 FHBDRN CC(C)[C@@H](C)Sc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-] ZINC000463016192 941795821 /nfs/dbraw/zinc/79/58/21/941795821.db2.gz YZQMZVKDGSADEO-CYBMUJFWSA-N 0 0 372.512 3.906 20 5 FHBDRN C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)C(=O)OC(C)(C)C ZINC000415405876 941803000 /nfs/dbraw/zinc/80/30/00/941803000.db2.gz ORQAQMAMIDUECN-QMMMGPOBSA-N 0 0 362.304 3.530 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CCC[C@H](Oc2ccccc2)C1 ZINC000412127059 941806980 /nfs/dbraw/zinc/80/69/80/941806980.db2.gz RULGPIVQPNUSSG-SLFFLAALSA-N 0 0 366.417 3.768 20 5 FHBDRN CCn1cc([C@H]2OCCC[C@@H]2Nc2ccc([N+](=O)[O-])c3cnccc23)cn1 ZINC000433629420 941811235 /nfs/dbraw/zinc/81/12/35/941811235.db2.gz VUBVIYGNTZJNPN-PKOBYXMFSA-N 0 0 367.409 3.692 20 5 FHBDRN C[C@H](NCc1coc(-c2ccc([N+](=O)[O-])cc2)n1)c1c(F)cncc1F ZINC000513241920 941811321 /nfs/dbraw/zinc/81/13/21/941811321.db2.gz NBJCPXPVDWPPLQ-JTQLQIEISA-N 0 0 360.320 3.774 20 5 FHBDRN C[C@@H](NC(=O)Nc1ncc(C(F)(F)F)s1)c1cccc([N+](=O)[O-])c1 ZINC000549274654 941819878 /nfs/dbraw/zinc/81/98/78/941819878.db2.gz HTMJEIOQVWQCRG-SSDOTTSWSA-N 0 0 360.317 3.953 20 5 FHBDRN CCOc1ccc(NC(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)cc1OCC ZINC000616177143 941820974 /nfs/dbraw/zinc/82/09/74/941820974.db2.gz JMBBANUMQQUCSN-UHFFFAOYSA-N 0 0 374.393 3.962 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(C)C1CCC(C(C)C)CC1 ZINC000433665981 941826203 /nfs/dbraw/zinc/82/62/03/941826203.db2.gz FCCWOFWWWQIAAJ-UHFFFAOYSA-N 0 0 361.442 3.515 20 5 FHBDRN CCOC(=O)c1cccc([N+](=O)[O-])c1NC1CC(C)(C)N(O)C(C)(C)C1 ZINC001167718370 941830849 /nfs/dbraw/zinc/83/08/49/941830849.db2.gz POTUUULCHAWKRV-UHFFFAOYSA-N 0 0 365.430 3.594 20 5 FHBDRN O=C(NCCc1cc2ccccc2o1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412134368 941831606 /nfs/dbraw/zinc/83/16/06/941831606.db2.gz YORMPESBBAFNNA-ZWKOTPCHSA-N 0 0 350.374 3.803 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N(C)[C@H](C)Cc2ccc(C)cc2)c1F ZINC000412138345 941833712 /nfs/dbraw/zinc/83/37/12/941833712.db2.gz ZGRPBSSXNVPIBG-CQSZACIVSA-N 0 0 374.412 3.683 20 5 FHBDRN Cc1c(C[S@@](C)=O)cccc1NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412138678 941833719 /nfs/dbraw/zinc/83/37/19/941833719.db2.gz STZJTHQJCXAXJK-PAPQREIWSA-N 0 0 372.446 3.524 20 5 FHBDRN Cc1csc([C@@H](NC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)C2CC2)n1 ZINC000412140627 941835183 /nfs/dbraw/zinc/83/51/83/941835183.db2.gz VETONOXQRVBOSS-XHSDSOJGSA-N 0 0 357.435 3.731 20 5 FHBDRN C[C@@H](C(=O)N(C)CCc1cccc([N+](=O)[O-])c1)[C@@H]1OCCc2sccc21 ZINC000513304349 941837128 /nfs/dbraw/zinc/83/71/28/941837128.db2.gz XGHKETZHTNOPBR-ACJLOTCBSA-N 0 0 374.462 3.607 20 5 FHBDRN O=C(c1csc(-c2ccc([N+](=O)[O-])cc2)n1)N1CC[C@H](c2ccco2)C1 ZINC000377613393 941840489 /nfs/dbraw/zinc/84/04/89/941840489.db2.gz ZGMYRAYLYNBLKB-ZDUSSCGKSA-N 0 0 369.402 3.941 20 5 FHBDRN Cc1cccc(-n2cc(C(=O)Nc3cc([N+](=O)[O-])c(Cl)cc3C)nn2)c1 ZINC000118687362 941842345 /nfs/dbraw/zinc/84/23/45/941842345.db2.gz INGFIBMRPHSRRH-UHFFFAOYSA-N 0 0 371.784 3.698 20 5 FHBDRN CCOCc1ccccc1CNc1ccc([N+](=O)[O-])c(C(=O)OCC)c1 ZINC000433692125 941842702 /nfs/dbraw/zinc/84/27/02/941842702.db2.gz ZGZFGSYTVXAOSB-UHFFFAOYSA-N 0 0 358.394 3.920 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CCOC[C@@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000412157641 941853184 /nfs/dbraw/zinc/85/31/84/941853184.db2.gz GUFFXVDOVWRPOA-GOSISDBHSA-N 0 0 370.405 3.596 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])c(Cl)c1)c1ccc(Br)nc1 ZINC000118825147 941856000 /nfs/dbraw/zinc/85/60/00/941856000.db2.gz IGNBSRVRNZBVJU-UHFFFAOYSA-N 0 0 356.563 3.658 20 5 FHBDRN C[C@H](NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)[C@@H]1Oc2ccccc2[C@@H]1C ZINC000412170949 941858565 /nfs/dbraw/zinc/85/85/65/941858565.db2.gz JPAMKDASBVKPJA-RDCBPCMLSA-N 0 0 366.417 3.768 20 5 FHBDRN C[C@H]1CN(C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)[C@@H](c2ccccc2)CO1 ZINC000412178383 941860804 /nfs/dbraw/zinc/86/08/04/941860804.db2.gz WIEYJOFIFSPALI-VVHHDAOASA-N 0 0 366.417 3.687 20 5 FHBDRN CCSCC[C@@H](C)N(C)C(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1 ZINC000412171877 941861662 /nfs/dbraw/zinc/86/16/62/941861662.db2.gz FHYHEZGQQRDSSV-CYBMUJFWSA-N 0 0 354.472 3.986 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N(C)CC2(c3ccccc3)CC2)c1 ZINC000549293776 941863033 /nfs/dbraw/zinc/86/30/33/941863033.db2.gz LKLURMBDHRKEAC-UHFFFAOYSA-N 0 0 354.406 3.797 20 5 FHBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1COc1ccccc1C(=O)N(C)C ZINC000433740923 941866570 /nfs/dbraw/zinc/86/65/70/941866570.db2.gz FPLPVZFCMWWRNA-UHFFFAOYSA-N 0 0 358.394 3.663 20 5 FHBDRN CC[C@@H]1c2ccsc2CCN1C(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000047625331 941866938 /nfs/dbraw/zinc/86/69/38/941866938.db2.gz DUNSJSDTMMVPNQ-CQSZACIVSA-N 0 0 360.435 3.961 20 5 FHBDRN COC(=O)c1cc(NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)c(C)cc1C ZINC000472821471 941867080 /nfs/dbraw/zinc/86/70/80/941867080.db2.gz DCVAQVHMFDHSNC-UHFFFAOYSA-N 0 0 370.405 3.915 20 5 FHBDRN CC(C)(C)N(Cc1ccccn1)C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000415508696 941867158 /nfs/dbraw/zinc/86/71/58/941867158.db2.gz VNNWHNQRVWEXHC-ZWKOTPCHSA-N 0 0 353.422 3.921 20 5 FHBDRN O=C(NC1CCC2(CCOCC2)CC1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412181061 941868992 /nfs/dbraw/zinc/86/89/92/941868992.db2.gz XBYZBDLMDIZDCL-ZWKOTPCHSA-N 0 0 358.438 3.554 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N[C@@H](c2ccc(F)cc2)C2CCC2)c1[N+](=O)[O-] ZINC000433758470 941872314 /nfs/dbraw/zinc/87/23/14/941872314.db2.gz LABUZMSUBUFLEX-OAHLLOKOSA-N 0 0 360.389 3.852 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)NC(C)(C)c2cccc(Cl)c2)c1[N+](=O)[O-] ZINC000433759263 941872918 /nfs/dbraw/zinc/87/29/18/941872918.db2.gz PWJXKYRHEFVEPW-UHFFFAOYSA-N 0 0 350.806 3.760 20 5 FHBDRN Cc1cc(C)n(Cc2cccc(C(=O)Oc3c(C)cccc3[N+](=O)[O-])c2)n1 ZINC000760014524 941874844 /nfs/dbraw/zinc/87/48/44/941874844.db2.gz ARLQBLHIVJSZLT-UHFFFAOYSA-N 0 0 365.389 3.984 20 5 FHBDRN C[C@@H](NC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1)c1cnn(C)c1 ZINC000119268127 941875481 /nfs/dbraw/zinc/87/54/81/941875481.db2.gz RTAICKSZOBBSIU-CYBMUJFWSA-N 0 0 365.393 3.563 20 5 FHBDRN CC[C@H](Cc1ccc(Cl)cc1)NC(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-] ZINC000433768642 941875640 /nfs/dbraw/zinc/87/56/40/941875640.db2.gz KTRATUORBVNPBB-CYBMUJFWSA-N 0 0 364.833 3.846 20 5 FHBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[C@@H](OC)C1 ZINC000472826044 941877057 /nfs/dbraw/zinc/87/70/57/941877057.db2.gz BBXAOWBQHUMZKS-GXTWGEPZSA-N 0 0 352.456 3.784 20 5 FHBDRN O=C(C1CCC(OC(F)F)CC1)N1CCCc2ccc([N+](=O)[O-])cc21 ZINC000513380650 941877437 /nfs/dbraw/zinc/87/74/37/941877437.db2.gz KAAWHRYKLNWNND-UHFFFAOYSA-N 0 0 354.353 3.672 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)NCCCc2ccc(C(C)C)cc2)c1[N+](=O)[O-] ZINC000433771501 941877795 /nfs/dbraw/zinc/87/77/95/941877795.db2.gz QPINDMJBAQWUBN-UHFFFAOYSA-N 0 0 358.442 3.927 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N[C@@H]2CCCC[C@H]2Cc2ccccc2)c1[N+](=O)[O-] ZINC000433760367 941879180 /nfs/dbraw/zinc/87/91/80/941879180.db2.gz UUMYPMACVAVLFX-JKSUJKDBSA-N 0 0 370.453 3.973 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N2CC[C@@H](c3ccccc3)[C@@H]2C)c1F ZINC000412182222 941881603 /nfs/dbraw/zinc/88/16/03/941881603.db2.gz ZGHHTKJCNYENLR-DZGCQCFKSA-N 0 0 372.396 3.690 20 5 FHBDRN COc1cccc2c1CC[C@@H]2NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412183585 941882514 /nfs/dbraw/zinc/88/25/14/941882514.db2.gz ICODMQMZJQFULD-KSZLIROESA-N 0 0 352.390 3.511 20 5 FHBDRN Cc1cn([C@@H](C)c2ccccc2)[nH]c1=NC(=O)c1cc([N+](=O)[O-])c(C)s1 ZINC000472828132 941882535 /nfs/dbraw/zinc/88/25/35/941882535.db2.gz SCQQTHAYVNZBGV-LBPRGKRZSA-N 0 0 370.434 3.753 20 5 FHBDRN CCOc1cc(NCCCc2nc3ccccc3n2C)ccc1[N+](=O)[O-] ZINC000433766656 941883573 /nfs/dbraw/zinc/88/35/73/941883573.db2.gz QUYXRWPDKFPMPY-UHFFFAOYSA-N 0 0 354.410 3.925 20 5 FHBDRN COc1ccc(CNc2ccc([N+](=O)[O-])c(OC(F)F)c2)c(OC)c1 ZINC000462784519 941884701 /nfs/dbraw/zinc/88/47/01/941884701.db2.gz FZBHOLHOJDAOHR-UHFFFAOYSA-N 0 0 354.309 3.826 20 5 FHBDRN Cc1c(NC(=O)C2CCC(OC[C@@H]3CCCO3)CC2)cccc1[N+](=O)[O-] ZINC000549300368 941886210 /nfs/dbraw/zinc/88/62/10/941886210.db2.gz SRHIHQLTLAEGIA-GPANFISMSA-N 0 0 362.426 3.596 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N(c1ccccc1)[C@@H]1CCOC1 ZINC000415541922 941887971 /nfs/dbraw/zinc/88/79/71/941887971.db2.gz PAAKONRFTKAVQM-CEXWTWQISA-N 0 0 352.390 3.520 20 5 FHBDRN O=C(CSc1ccccc1[N+](=O)[O-])N1CC[C@@H](Cc2ccc(F)cc2)C1 ZINC000119541099 941890388 /nfs/dbraw/zinc/89/03/88/941890388.db2.gz TXLOEZPGENIUMA-HNNXBMFYSA-N 0 0 374.437 3.917 20 5 FHBDRN CC(C)N(CC(=O)N([C@H](C)C1CC1)C1CC1)Cc1ccc([N+](=O)[O-])cc1 ZINC000513397189 941890715 /nfs/dbraw/zinc/89/07/15/941890715.db2.gz JUDRYIQZYJDGQS-OAHLLOKOSA-N 0 0 359.470 3.595 20 5 FHBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)Nc1c2c(ccc1Cl)OCC2 ZINC000433784225 941890852 /nfs/dbraw/zinc/89/08/52/941890852.db2.gz VARGCXIQDNDOSI-UHFFFAOYSA-N 0 0 361.785 3.547 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N[C@@H](c2ccc(F)cc2)C(F)(F)F)c1[N+](=O)[O-] ZINC000433773843 941891855 /nfs/dbraw/zinc/89/18/55/941891855.db2.gz IZRCBGGAAKJAQH-ZDUSSCGKSA-N 0 0 374.294 3.614 20 5 FHBDRN CC(C)c1[nH]nc(C(=O)Nc2ccnn2-c2cccc(Cl)c2)c1[N+](=O)[O-] ZINC000433774160 941892107 /nfs/dbraw/zinc/89/21/07/941892107.db2.gz KCJRQXFBJQDABK-UHFFFAOYSA-N 0 0 374.788 3.533 20 5 FHBDRN C[C@@H](NC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)c1ccncc1F ZINC000513383500 941892441 /nfs/dbraw/zinc/89/24/41/941892441.db2.gz QEMFRPZNWMBFKE-MRVPVSSYSA-N 0 0 357.263 3.639 20 5 FHBDRN C[C@H](CNc1ccc([N+](=O)[O-])c(NC[C@H](C)C(F)(F)F)n1)C(F)(F)F ZINC000433786489 941895807 /nfs/dbraw/zinc/89/58/07/941895807.db2.gz XPOPWNHPHRFLSB-SFYZADRCSA-N 0 0 374.285 3.632 20 5 FHBDRN CCc1ccc(NC(=O)Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)cc1 ZINC000103463505 941897757 /nfs/dbraw/zinc/89/77/57/941897757.db2.gz FFHHYJDYLGIMRJ-UHFFFAOYSA-N 0 0 350.378 3.659 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CCc3ccc(F)cc3C2)ccc1[N+](=O)[O-] ZINC000412195344 941897768 /nfs/dbraw/zinc/89/77/68/941897768.db2.gz JDMXSRPFFBMDKK-UHFFFAOYSA-N 0 0 358.369 3.720 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N(C[C@H]1CCCO1)C1CCCC1 ZINC000412197175 941898511 /nfs/dbraw/zinc/89/85/11/941898511.db2.gz UZYBZFJFKYXNHY-CEXWTWQISA-N 0 0 358.438 3.649 20 5 FHBDRN O=C(Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1)Nc1ccccc1Cl ZINC000103463451 941898959 /nfs/dbraw/zinc/89/89/59/941898959.db2.gz PBVJLXBOWQMDAE-UHFFFAOYSA-N 0 0 356.769 3.750 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2cnn(Cc3cn4cc(Cl)ccc4n3)c2)cc1 ZINC000103463169 941899544 /nfs/dbraw/zinc/89/95/44/941899544.db2.gz FINNRCSMMNOKOL-UHFFFAOYSA-N 0 0 353.769 3.808 20 5 FHBDRN CC(C)Oc1cc(C(=O)NCc2ccn(C3CCCC3)n2)ccc1[N+](=O)[O-] ZINC000412198987 941899572 /nfs/dbraw/zinc/89/95/72/941899572.db2.gz NVSSPXBZZPMIHE-UHFFFAOYSA-N 0 0 372.425 3.624 20 5 FHBDRN COc1ccc(NC(=O)[C@H](C)Oc2ccc(SC)cc2)c([N+](=O)[O-])c1 ZINC000513406178 941900071 /nfs/dbraw/zinc/90/00/71/941900071.db2.gz NUSAAOZRFHNGIE-NSHDSACASA-N 0 0 362.407 3.731 20 5 FHBDRN Cc1cc(NCCOCC(F)(F)C(F)F)c2cccc([N+](=O)[O-])c2n1 ZINC000433808072 941904793 /nfs/dbraw/zinc/90/47/93/941904793.db2.gz AQFLQUFSSWQZHH-UHFFFAOYSA-N 0 0 361.295 3.780 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCc1ccc(-n2ccnc2)cc1 ZINC000119899831 941906045 /nfs/dbraw/zinc/90/60/45/941906045.db2.gz BLRUPKQRYHGRLR-UHFFFAOYSA-N 0 0 365.393 3.719 20 5 FHBDRN C[C@H]1CCC[C@H](c2nc(-c3ccc(-n4cncn4)c([N+](=O)[O-])c3)no2)C1 ZINC000453204692 941913759 /nfs/dbraw/zinc/91/37/59/941913759.db2.gz WFWHJMZFHMJUKH-AAEUAGOBSA-N 0 0 354.370 3.519 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N[C@H]1CCO[C@@H]1c1ccc(Cl)cc1 ZINC000182427208 941923065 /nfs/dbraw/zinc/92/30/65/941923065.db2.gz KXNYZMWNYJSKIF-PKOBYXMFSA-N 0 0 374.824 3.827 20 5 FHBDRN Cc1cc(C(=O)N[C@H]2CCO[C@@H]2c2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000182433467 941924837 /nfs/dbraw/zinc/92/48/37/941924837.db2.gz JVPWLZOTPQGKMJ-DOTOQJQBSA-N 0 0 360.797 3.817 20 5 FHBDRN CC1=C(c2ccco2)CN(C(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)CC1 ZINC000513451004 941937601 /nfs/dbraw/zinc/93/76/01/941937601.db2.gz HGZKKDCMWLPNKJ-UHFFFAOYSA-N 0 0 351.362 3.989 20 5 FHBDRN CC(C)c1[nH]nc(C(=O)Nc2ccccc2OC(F)(F)F)c1[N+](=O)[O-] ZINC000433850707 941940179 /nfs/dbraw/zinc/94/01/79/941940179.db2.gz CAIGBSCNLKUBMX-UHFFFAOYSA-N 0 0 358.276 3.592 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)COc2cccc3cccnc32)cc1[N+](=O)[O-] ZINC000182564028 941943976 /nfs/dbraw/zinc/94/39/76/941943976.db2.gz WCPKKQUUUUFREI-CQSZACIVSA-N 0 0 365.389 3.708 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N(C)C1CCN(c2ccc(F)cc2)CC1 ZINC000365671300 941945149 /nfs/dbraw/zinc/94/51/49/941945149.db2.gz JMSLTMGMSLGQPN-UHFFFAOYSA-N 0 0 371.412 3.783 20 5 FHBDRN CS[C@@H]1CCCCN(C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000182574320 941945187 /nfs/dbraw/zinc/94/51/87/941945187.db2.gz ZJDGMNRDZWEFRL-LLVKDONJSA-N 0 0 360.382 3.554 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N(C)C1CCN(c2cccc(F)c2)CC1 ZINC000365671888 941945698 /nfs/dbraw/zinc/94/56/98/941945698.db2.gz LHJHGJIPQZTYBF-UHFFFAOYSA-N 0 0 371.412 3.783 20 5 FHBDRN COc1cccc2[nH]cc(CC(=O)N3c4ccc([N+](=O)[O-])cc4C[C@H]3C)c21 ZINC000182600698 941946324 /nfs/dbraw/zinc/94/63/24/941946324.db2.gz OCUAFBIIGYFOEN-GFCCVEGCSA-N 0 0 365.389 3.605 20 5 FHBDRN CN(Cc1cc(F)c(F)c(F)c1)C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412242205 941953413 /nfs/dbraw/zinc/95/34/13/941953413.db2.gz LYHPECSRECDZGI-UONOGXRCSA-N 0 0 364.323 3.774 20 5 FHBDRN COc1ccc([C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2C)C(F)(F)F)cc1 ZINC000182640253 941957226 /nfs/dbraw/zinc/95/72/26/941957226.db2.gz AIHWPORJEVKRAQ-OAHLLOKOSA-N 0 0 368.311 3.945 20 5 FHBDRN Cc1cnc([C@H](C)CNC(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)s1 ZINC000412250226 941959901 /nfs/dbraw/zinc/95/99/01/941959901.db2.gz KKCOUNURCGVQNT-LLVKDONJSA-N 0 0 363.439 3.680 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]cc(Cc3noc([C@@H]4OC[C@H]5CCC[C@@H]45)n3)c2c1 ZINC000377748492 941960965 /nfs/dbraw/zinc/96/09/65/941960965.db2.gz RIJGIWOCMSAFCI-OMXAPOSASA-N 0 0 354.366 3.538 20 5 FHBDRN CC(C)(C)Oc1ccc(CNC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)cn1 ZINC000412248949 941963634 /nfs/dbraw/zinc/96/36/34/941963634.db2.gz LHVDLCAJDQQNAT-DLBZAZTESA-N 0 0 369.421 3.587 20 5 FHBDRN O=C(N[C@@H](c1c(F)cccc1F)C(F)(F)F)c1csc([N+](=O)[O-])c1 ZINC000182733367 941963608 /nfs/dbraw/zinc/96/36/08/941963608.db2.gz GHEDEULNQXXZOW-NSHDSACASA-N 0 0 366.267 3.968 20 5 FHBDRN Cn1cc(Oc2ccccc2C(=O)Nc2ccc([N+](=O)[O-])cc2F)cn1 ZINC000509925026 941986640 /nfs/dbraw/zinc/98/66/40/941986640.db2.gz JIORSYGDYBSZHA-UHFFFAOYSA-N 0 0 356.313 3.512 20 5 FHBDRN Cc1cc(C)c2c(c1)CN(C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)CC2 ZINC000412258654 941988406 /nfs/dbraw/zinc/98/84/06/941988406.db2.gz KJUQGXWSKUJZFN-VQTJNVASSA-N 0 0 350.418 3.900 20 5 FHBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CSC1(C)C ZINC000549335264 941994398 /nfs/dbraw/zinc/99/43/98/941994398.db2.gz OEMQBENDWDTQMJ-AWEZNQCLSA-N 0 0 354.497 3.967 20 5 FHBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CSC1(C)C ZINC000549335267 941994459 /nfs/dbraw/zinc/99/44/59/941994459.db2.gz OEMQBENDWDTQMJ-CQSZACIVSA-N 0 0 354.497 3.967 20 5 FHBDRN COCCC1(CNC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)CCCCC1 ZINC000412260452 941997845 /nfs/dbraw/zinc/99/78/45/941997845.db2.gz NMYNKCICRGCNIS-ZWKOTPCHSA-N 0 0 360.454 3.802 20 5 FHBDRN Cc1cc(Br)c(O)c(NC(=O)c2ccc([N+](=O)[O-])s2)c1 ZINC000182926961 942007201 /nfs/dbraw/zinc/00/72/01/942007201.db2.gz ADUCOKRNUIPSRF-UHFFFAOYSA-N 0 0 357.185 3.685 20 5 FHBDRN COc1ccc(C(=O)N2CC[C@](C)(c3ccc(C)cc3)C2)cc1[N+](=O)[O-] ZINC000433952926 942014355 /nfs/dbraw/zinc/01/43/55/942014355.db2.gz YGYQVCOHSWCGRY-FQEVSTJZSA-N 0 0 354.406 3.716 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N2CCCC23CCCCC3)cc1OC ZINC000484230058 942018209 /nfs/dbraw/zinc/01/82/09/942018209.db2.gz VFQZIRHBHPPUFX-UHFFFAOYSA-N 0 0 362.426 3.941 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CC[C@H](c2c(F)cccc2F)C1 ZINC000412274149 942022006 /nfs/dbraw/zinc/02/20/06/942022006.db2.gz RPKKZYPFCSMSSW-CWRNSKLLSA-N 0 0 372.371 3.993 20 5 FHBDRN CC[C@@H](C)COc1cc([N+](=O)[O-])c(Cn2cccc(C)c2=O)cc1OC ZINC000513591213 942030111 /nfs/dbraw/zinc/03/01/11/942030111.db2.gz DCAVRKXCYJSOED-CYBMUJFWSA-N 0 0 360.410 3.547 20 5 FHBDRN CC(C)c1[nH]nc(C(=O)Nc2ccc(-c3ccccc3)cn2)c1[N+](=O)[O-] ZINC000433992795 942032184 /nfs/dbraw/zinc/03/21/84/942032184.db2.gz FHWYEBGOWHPKPZ-UHFFFAOYSA-N 0 0 351.366 3.756 20 5 FHBDRN O=C(c1nc2c(s1)CCC2)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000415759344 942037742 /nfs/dbraw/zinc/03/77/42/942037742.db2.gz LKFKTLLAIPMBHO-ZDUSSCGKSA-N 0 0 357.435 3.560 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N2CC[C@](C)(CCc3ccccc3)C2)c1[N+](=O)[O-] ZINC000434012962 942039581 /nfs/dbraw/zinc/03/95/81/942039581.db2.gz RRIZWVVAUDIHDF-FQEVSTJZSA-N 0 0 370.453 3.926 20 5 FHBDRN O=c1c([N+](=O)[O-])cccn1CCCCOc1cccc(C(F)(F)F)c1 ZINC000102203199 942043327 /nfs/dbraw/zinc/04/33/27/942043327.db2.gz FVTKHCMDXZROOS-UHFFFAOYSA-N 0 0 356.300 3.635 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1Cl)N1CCC[C@]2(CCCCO2)C1 ZINC000377876396 942047584 /nfs/dbraw/zinc/04/75/84/942047584.db2.gz XFONEGRCQVEYGI-MRXNPFEDSA-N 0 0 353.806 3.815 20 5 FHBDRN Cc1c(C(=O)N[C@@H]2CC(C)(C)Oc3ccc(N)cc32)cccc1[N+](=O)[O-] ZINC000377884373 942051147 /nfs/dbraw/zinc/05/11/47/942051147.db2.gz NPOPBPZQXOVCRY-OAHLLOKOSA-N 0 0 355.394 3.518 20 5 FHBDRN CC(C)(CNC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)Oc1ccccc1 ZINC000513640733 942051515 /nfs/dbraw/zinc/05/15/15/942051515.db2.gz RIKXBJXHCJWOKW-UHFFFAOYSA-N 0 0 353.378 3.664 20 5 FHBDRN COc1ccc([C@H](NC(=O)CNc2cccc([N+](=O)[O-])c2C)C2CC2)cc1 ZINC000025604186 942062684 /nfs/dbraw/zinc/06/26/84/942062684.db2.gz BTYNRUSUCBPWCM-HXUWFJFHSA-N 0 0 369.421 3.591 20 5 FHBDRN CC(C)(CNC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)C(F)(F)F ZINC000584542023 942064092 /nfs/dbraw/zinc/06/40/92/942064092.db2.gz NZIFNSMQFBGEHL-UHFFFAOYSA-N 0 0 359.348 3.513 20 5 FHBDRN CC1(C)CN(C(=O)COc2cccc([N+](=O)[O-])c2)C[C@@H]1c1ccccc1 ZINC000434086385 942075439 /nfs/dbraw/zinc/07/54/39/942075439.db2.gz CDJNEWITVIYDPL-GOSISDBHSA-N 0 0 354.406 3.626 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)Nc2ccc(Cl)cc2F)c1C ZINC000015243530 942076086 /nfs/dbraw/zinc/07/60/86/942076086.db2.gz IJNSJGGUCROPHG-UHFFFAOYSA-N 0 0 358.778 3.805 20 5 FHBDRN CCOc1ccc([C@H](C)NC(=O)c2cc([N+](=O)[O-])ccc2OC)cc1OC ZINC000501850077 942077816 /nfs/dbraw/zinc/07/78/16/942077816.db2.gz ZHHBSLZUDMMMJH-LBPRGKRZSA-N 0 0 374.393 3.502 20 5 FHBDRN CCCC1(c2noc([C@@H](C)NC(=O)c3cccc([N+](=O)[O-])c3)n2)CCC1 ZINC000420518747 942078614 /nfs/dbraw/zinc/07/86/14/942078614.db2.gz UORVPTOBXKSUBW-GFCCVEGCSA-N 0 0 358.398 3.691 20 5 FHBDRN O=C(N[C@H]1CCc2cc(F)ccc21)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513686203 942079825 /nfs/dbraw/zinc/07/98/25/942079825.db2.gz XBUJPDLXVBQPAA-ZDUSSCGKSA-N 0 0 366.295 3.753 20 5 FHBDRN CCNC(=O)N(C)c1cccc(Nc2c(F)cc([N+](=O)[O-])cc2F)c1 ZINC000480845810 942081052 /nfs/dbraw/zinc/08/10/52/942081052.db2.gz SOKPMFMYRQHBSA-UHFFFAOYSA-N 0 0 350.325 3.782 20 5 FHBDRN C[C@@H](Nc1nc2ccccc2cc1[N+](=O)[O-])c1ccc(Br)cn1 ZINC000480851834 942081457 /nfs/dbraw/zinc/08/14/57/942081457.db2.gz KXBAMOIRGUFKRL-SNVBAGLBSA-N 0 0 373.210 3.896 20 5 FHBDRN Cc1ccc(-c2nc(-c3ccc([N+](=O)[O-])c4c3CCCN4)no2)nc1C ZINC000420501406 942084794 /nfs/dbraw/zinc/08/47/94/942084794.db2.gz OPOLOZMCHMQECI-UHFFFAOYSA-N 0 0 351.366 3.682 20 5 FHBDRN Cc1nn(CCC(=O)Nc2scnc2-c2ccccc2)c(C)c1[N+](=O)[O-] ZINC000102724649 942088026 /nfs/dbraw/zinc/08/80/26/942088026.db2.gz JSIMXPGSNUOJAH-UHFFFAOYSA-N 0 0 371.422 3.560 20 5 FHBDRN O=C(COc1ccccc1[N+](=O)[O-])Nc1scnc1-c1ccccc1 ZINC000102725946 942088036 /nfs/dbraw/zinc/08/80/36/942088036.db2.gz NBCZEWHYNXRSRE-UHFFFAOYSA-N 0 0 355.375 3.736 20 5 FHBDRN CO[C@H]1c2ccccc2C[C@H]1NC(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000413357371 942091334 /nfs/dbraw/zinc/09/13/34/942091334.db2.gz JRYIDJQTFDLFSK-XVSDVWIESA-N 0 0 369.421 3.576 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)Nc1cccc(OCCCOC)c1 ZINC000280063959 942095628 /nfs/dbraw/zinc/09/56/28/942095628.db2.gz MUMUAFYKMQSFKQ-UHFFFAOYSA-N 0 0 374.393 3.661 20 5 FHBDRN CO[C@H]1CCCN(C(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)C1 ZINC000102762335 942101169 /nfs/dbraw/zinc/10/11/69/942101169.db2.gz GOIOROCZXRFGOO-INIZCTEOSA-N 0 0 355.394 3.589 20 5 FHBDRN CC(C)C[C@H]1C[C@@H](NC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])CCO1 ZINC000280068802 942101198 /nfs/dbraw/zinc/10/11/98/942101198.db2.gz HLVYXILRDZBCQP-STQMWFEESA-N 0 0 372.824 3.640 20 5 FHBDRN CC(=O)c1cc([N+](=O)[O-])ccc1OCC(=O)N1c2ccccc2CC[C@H]1C ZINC000584544302 942102230 /nfs/dbraw/zinc/10/22/30/942102230.db2.gz WWVDJBPFTWZIQY-CYBMUJFWSA-N 0 0 368.389 3.544 20 5 FHBDRN CC(C)(C)OC1CC(CCNC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)C1 ZINC000412306639 942110446 /nfs/dbraw/zinc/11/04/46/942110446.db2.gz RMEOEBHGYHVXOT-GGXGYQBMSA-N 0 0 360.454 3.798 20 5 FHBDRN Cc1nnc(NC(=O)c2cc([N+](=O)[O-])ccc2SC(C)C)n1C1CC1 ZINC000501908351 942110780 /nfs/dbraw/zinc/11/07/80/942110780.db2.gz OMLTWALAEDKILE-UHFFFAOYSA-N 0 0 361.427 3.582 20 5 FHBDRN Cn1cnc([N+](=O)[O-])c1N1CCCC[C@H]1c1nc2cc(Cl)ccc2[nH]1 ZINC000413378156 942113715 /nfs/dbraw/zinc/11/37/15/942113715.db2.gz PHLIEAPRKPQDMA-ZDUSSCGKSA-N 0 0 360.805 3.590 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CCC[C@H]2c2ccc(Br)cn2)s1 ZINC000413383198 942123547 /nfs/dbraw/zinc/12/35/47/942123547.db2.gz XDYJPXOAPGHJTR-JTQLQIEISA-N 0 0 355.217 3.550 20 5 FHBDRN O=C(NCCc1cccc2[nH]ccc21)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000501950774 942129730 /nfs/dbraw/zinc/12/97/30/942129730.db2.gz RLNLPVJMYGVSHI-UHFFFAOYSA-N 0 0 360.373 3.597 20 5 FHBDRN CC(C)NC(=O)c1ccc(N2CCC[C@@H](CC(F)(F)F)C2)c([N+](=O)[O-])c1 ZINC000420634159 942131440 /nfs/dbraw/zinc/13/14/40/942131440.db2.gz SUGYEDMIDUJVFJ-LBPRGKRZSA-N 0 0 373.375 3.902 20 5 FHBDRN O=C(NC[C@H]1CCSC1)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000280304789 942162412 /nfs/dbraw/zinc/16/24/12/942162412.db2.gz XITWRDYQGRQKTK-OAHLLOKOSA-N 0 0 372.446 3.657 20 5 FHBDRN CSc1ccc(CCNC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)cc1 ZINC000412314151 942165433 /nfs/dbraw/zinc/16/54/33/942165433.db2.gz RPIPTQZCYYGDPC-ZWKOTPCHSA-N 0 0 356.447 3.779 20 5 FHBDRN Cc1ncc(CNc2cc(C(F)(F)C(F)(F)F)ncc2[N+](=O)[O-])o1 ZINC000413424003 942168382 /nfs/dbraw/zinc/16/83/82/942168382.db2.gz ORGJXCGWUSEQGU-UHFFFAOYSA-N 0 0 352.219 3.552 20 5 FHBDRN C[C@@H](CC(F)F)C(=O)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F ZINC000413430379 942170387 /nfs/dbraw/zinc/17/03/87/942170387.db2.gz DZLFAKFEAASGLR-VIFPVBQESA-N 0 0 354.275 3.777 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCCCC2)c(-c2nc(C3CCOCC3)no2)c1 ZINC000280389472 942173724 /nfs/dbraw/zinc/17/37/24/942173724.db2.gz WPAWURREVCLZOE-UHFFFAOYSA-N 0 0 358.398 3.529 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N[C@H](CC(F)F)c1ccccc1 ZINC000420731006 942179408 /nfs/dbraw/zinc/17/94/08/942179408.db2.gz FDCSJMAZGOBELY-CYBMUJFWSA-N 0 0 370.377 3.578 20 5 FHBDRN C[C@@]1(CNC(=O)c2cc([N+](=O)[O-])ccc2Cl)OCCc2sccc21 ZINC000290454115 942179636 /nfs/dbraw/zinc/17/96/36/942179636.db2.gz UUXFSOJMCVLOQT-INIZCTEOSA-N 0 0 366.826 3.528 20 5 FHBDRN COc1ccc([C@H](CO)CNc2cc(C)nc3c2cccc3[N+](=O)[O-])cc1 ZINC000413432077 942183276 /nfs/dbraw/zinc/18/32/76/942183276.db2.gz BVBOOQWDSMFWQS-HNNXBMFYSA-N 0 0 367.405 3.648 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)NC2CCC3(CCOCC3)CC2)c1 ZINC000378029046 942184773 /nfs/dbraw/zinc/18/47/73/942184773.db2.gz HIOREJASFOXWMN-UHFFFAOYSA-N 0 0 364.467 3.786 20 5 FHBDRN Cc1nn(C)c(C(=O)Nc2ccc(F)cc2-c2ccc(F)cc2)c1[N+](=O)[O-] ZINC000103038953 942186988 /nfs/dbraw/zinc/18/69/88/942186988.db2.gz YXRWNDPHSZTCHN-UHFFFAOYSA-N 0 0 372.331 3.834 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2C[C@H](C)Oc3ccccc32)ccc1[N+](=O)[O-] ZINC000413445060 942191288 /nfs/dbraw/zinc/19/12/88/942191288.db2.gz WCWROJJVRDRHOP-ZDUSSCGKSA-N 0 0 356.378 3.810 20 5 FHBDRN CN(C(=O)COc1cccc([N+](=O)[O-])c1)[C@H](c1ccccc1)C(F)(F)F ZINC000103049934 942197997 /nfs/dbraw/zinc/19/79/97/942197997.db2.gz SWANGMBORPQFQC-MRXNPFEDSA-N 0 0 368.311 3.736 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N(C)[C@H](c2ccccc2)C(F)(F)F)c1 ZINC000103049076 942198050 /nfs/dbraw/zinc/19/80/50/942198050.db2.gz LBXKCVOSLUBKOS-OAHLLOKOSA-N 0 0 368.311 3.979 20 5 FHBDRN CS[C@H](C)CNC(=O)c1ccc(N2C[C@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000502079403 942207514 /nfs/dbraw/zinc/20/75/14/942207514.db2.gz NOJOLNRCKVYLKW-HZSPNIEDSA-N 0 0 365.499 3.558 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)NC[C@H]1CC12CCSCC2 ZINC000420828151 942215072 /nfs/dbraw/zinc/21/50/72/942215072.db2.gz CXJXWHVYZIKLGO-GFCCVEGCSA-N 0 0 369.874 3.581 20 5 FHBDRN C[C@H](c1ccccc1)N1C[C@H](COc2cc(F)ccc2[N+](=O)[O-])OC1=O ZINC001225579434 942220905 /nfs/dbraw/zinc/22/09/05/942220905.db2.gz UCWHJLWQDSWQGM-IUODEOHRSA-N 0 0 360.341 3.695 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)NC[C@@H]2CC23CCSCC3)cc1[N+](=O)[O-] ZINC000420816873 942221158 /nfs/dbraw/zinc/22/11/58/942221158.db2.gz ZBRCNMYZCSVYKR-HIFRSBDPSA-N 0 0 363.483 3.797 20 5 FHBDRN CCOCCC1(CNC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000183186253 942223296 /nfs/dbraw/zinc/22/32/96/942223296.db2.gz GFKZVTNEMFKRTB-UHFFFAOYSA-N 0 0 372.874 3.663 20 5 FHBDRN CCC(CC)(OC)c1noc([C@H]2CC(c3ccccc3[N+](=O)[O-])=NO2)n1 ZINC000290491581 942225120 /nfs/dbraw/zinc/22/51/20/942225120.db2.gz OMBYJZVGXZGKSN-CQSZACIVSA-N 0 0 360.370 3.505 20 5 FHBDRN CC(C)(C)C(=O)CNC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000122809030 942236770 /nfs/dbraw/zinc/23/67/70/942236770.db2.gz YCQJDMQHASLVNY-UHFFFAOYSA-N 0 0 369.421 3.552 20 5 FHBDRN CC(C)(C)c1ccc([C@H]2CCCN2c2nccc(C(N)=O)c2[N+](=O)[O-])cc1 ZINC000290509154 942237446 /nfs/dbraw/zinc/23/74/46/942237446.db2.gz LNNPLUHQOILZKT-MRXNPFEDSA-N 0 0 368.437 3.728 20 5 FHBDRN Cc1c(NC(=O)NC2CC(F)(F)C2)cc(Br)cc1[N+](=O)[O-] ZINC000280716477 942238176 /nfs/dbraw/zinc/23/81/76/942238176.db2.gz JEOXELOVDHQKNG-UHFFFAOYSA-N 0 0 364.146 3.585 20 5 FHBDRN O=C(Cc1cc(F)c(Cl)cc1[N+](=O)[O-])N1CCC[C@H]1c1nccs1 ZINC000365755751 942241811 /nfs/dbraw/zinc/24/18/11/942241811.db2.gz ZCSSYPPSSIIBAE-LBPRGKRZSA-N 0 0 369.805 3.750 20 5 FHBDRN CC(C)c1nc2n(n1)CCC[C@@H]2NC(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000187873637 942242091 /nfs/dbraw/zinc/24/20/91/942242091.db2.gz ILZLHVHNUJNBPW-HNNXBMFYSA-N 0 0 371.441 3.698 20 5 FHBDRN CCC(=O)Nc1cccc(C(=O)N2c3ccc([N+](=O)[O-])cc3C[C@@H]2C)c1 ZINC000103375633 942248441 /nfs/dbraw/zinc/24/84/41/942248441.db2.gz HKJUVKYKMBNWBE-LBPRGKRZSA-N 0 0 353.378 3.535 20 5 FHBDRN COc1cc(C(=O)N2c3ccc([N+](=O)[O-])cc3C[C@@H]2C)cc(OC)c1C ZINC000103377841 942248463 /nfs/dbraw/zinc/24/84/63/942248463.db2.gz CCIKKLQETDMURQ-NSHDSACASA-N 0 0 356.378 3.512 20 5 FHBDRN Cc1c(C(=O)N2c3ccc([N+](=O)[O-])cc3C[C@H]2C)cnn1-c1ccccc1 ZINC000103376637 942248543 /nfs/dbraw/zinc/24/85/43/942248543.db2.gz AKYLDEGYJKNOJG-CYBMUJFWSA-N 0 0 362.389 3.680 20 5 FHBDRN CC(C)(C)c1ccc(Cn2cc(Br)cc([N+](=O)[O-])c2=O)cc1 ZINC000502140274 942253463 /nfs/dbraw/zinc/25/34/63/942253463.db2.gz VHAKNDDABIRTED-UHFFFAOYSA-N 0 0 365.227 3.865 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NCCCCc1nc(C)cs1 ZINC000122848170 942256460 /nfs/dbraw/zinc/25/64/60/942256460.db2.gz LNXOSNSIJZMWRD-UHFFFAOYSA-N 0 0 364.427 3.513 20 5 FHBDRN COc1cc(CN(C)c2ncc([N+](=O)[O-])cc2C(F)(F)F)cc(OC)c1 ZINC000413074755 942259653 /nfs/dbraw/zinc/25/96/53/942259653.db2.gz OOXMQFCADWHEEU-UHFFFAOYSA-N 0 0 371.315 3.662 20 5 FHBDRN CCOC(=O)c1cc(C(=O)N(C)[C@H](C)c2ccccc2)cc([N+](=O)[O-])c1 ZINC000015596776 942263025 /nfs/dbraw/zinc/26/30/25/942263025.db2.gz PZTHAPXHJSGHKX-CYBMUJFWSA-N 0 0 356.378 3.605 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CCC[C@H](CC(F)(F)F)C1 ZINC000420946988 942270148 /nfs/dbraw/zinc/27/01/48/942270148.db2.gz MJNCGNLVZWCUJJ-GFCCVEGCSA-N 0 0 359.348 3.506 20 5 FHBDRN CSCC(=O)Nc1ccc(OCc2c(F)cccc2[N+](=O)[O-])cc1 ZINC000103463044 942273877 /nfs/dbraw/zinc/27/38/77/942273877.db2.gz QUMIJOGCTWEDNH-UHFFFAOYSA-N 0 0 350.371 3.614 20 5 FHBDRN Cc1ccn(C2CCN(Cc3ccc([N+](=O)[O-])cc3C(F)(F)F)CC2)n1 ZINC000366733731 942273867 /nfs/dbraw/zinc/27/38/67/942273867.db2.gz AUJHNQKLYXEELS-UHFFFAOYSA-N 0 0 368.359 3.956 20 5 FHBDRN C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCC[C@@H](CC(F)(F)F)C1 ZINC000420955965 942274844 /nfs/dbraw/zinc/27/48/44/942274844.db2.gz XJDGOGFKXLZOMN-RYUDHWBXSA-N 0 0 359.348 3.586 20 5 FHBDRN CC(C)(C)[C@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CCO1 ZINC000481012401 942275572 /nfs/dbraw/zinc/27/55/72/942275572.db2.gz ZEKODJGIACBUKC-GXTWGEPZSA-N 0 0 374.359 3.937 20 5 FHBDRN CCOc1cc(C(=O)N[C@@H]2CC[C@@H](C)[C@H](C)C2)c([N+](=O)[O-])cc1OC ZINC000183459128 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COc1cccc(C=C2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)c1 ZINC000472940516 942386180 /nfs/dbraw/zinc/38/61/80/942386180.db2.gz CIUDAKQVKQILAU-UHFFFAOYSA-N 0 0 352.390 3.923 20 5 FHBDRN Cc1cc(C(=O)Cn2cc([N+](=O)[O-])c(C)n2)c(C)n1Cc1cccs1 ZINC000501319063 942398569 /nfs/dbraw/zinc/39/85/69/942398569.db2.gz ZLXNUKDLQUNKEQ-UHFFFAOYSA-N 0 0 358.423 3.511 20 5 FHBDRN CC[S@](=O)[C@@H]1CCC[C@H](Nc2ncc([N+](=O)[O-])cc2C(F)(F)F)C1 ZINC000413177070 942408288 /nfs/dbraw/zinc/40/82/88/942408288.db2.gz LKPZNVOPDDUBPV-SOKFDTALSA-N 0 0 365.377 3.500 20 5 FHBDRN C[C@]1(F)CCN(C(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)C1 ZINC000501340926 942409610 /nfs/dbraw/zinc/40/96/10/942409610.db2.gz AOTZYACRXZZCNS-IBGZPJMESA-N 0 0 357.385 3.781 20 5 FHBDRN O=[N+]([O-])c1ccc2ccnc(N3CCC(OC[C@@H]4CCCCO4)CC3)c2c1 ZINC000413181287 942410236 /nfs/dbraw/zinc/41/02/36/942410236.db2.gz QDXGJNAXQONOPT-SFHVURJKSA-N 0 0 371.437 3.698 20 5 FHBDRN COc1nc(C)cc(C)c1CNC(=O)Nc1c(C)ccc([N+](=O)[O-])c1C ZINC000085637587 942412220 /nfs/dbraw/zinc/41/22/20/942412220.db2.gz RWPTYCKPCXLGCS-UHFFFAOYSA-N 0 0 358.398 3.554 20 5 FHBDRN O=[N+]([O-])c1cccc(Cl)c1OCc1cccc(CN2CCOCC2)c1 ZINC000421212618 942413145 /nfs/dbraw/zinc/41/31/45/942413145.db2.gz KQOJXHBUCNIABY-UHFFFAOYSA-N 0 0 362.813 3.659 20 5 FHBDRN Cc1cc(NC(=O)[C@H]2Cc3ccc(Cl)cc32)c2cc([N+](=O)[O-])ccc2n1 ZINC001268853731 942414259 /nfs/dbraw/zinc/41/42/59/942414259.db2.gz GVQIEOYKYSTIPW-HNNXBMFYSA-N 0 0 367.792 3.805 20 5 FHBDRN COc1ccc2cc(C(=O)Nc3ccc([N+](=O)[O-])c4ncccc34)cnc2c1 ZINC001268853991 942415485 /nfs/dbraw/zinc/41/54/85/942415485.db2.gz QRIPHZASMSPGEK-UHFFFAOYSA-N 0 0 374.356 3.952 20 5 FHBDRN CCN(C(=O)c1cc(F)ccc1[N+](=O)[O-])[C@H](C)Cc1ccc(OC)cc1 ZINC000066805826 942417803 /nfs/dbraw/zinc/41/78/03/942417803.db2.gz VXMRDJZFXVEHHW-CYBMUJFWSA-N 0 0 360.385 3.836 20 5 FHBDRN O=C(N[C@@H]1CCC[C@H]1OC(F)F)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000501346472 942423693 /nfs/dbraw/zinc/42/36/93/942423693.db2.gz DZDHLGUHPYGASO-GHMZBOCLSA-N 0 0 356.350 3.700 20 5 FHBDRN CC(C)(C(=O)NCCOc1ccccc1Cl)c1ccc([N+](=O)[O-])cc1 ZINC000501355341 942428626 /nfs/dbraw/zinc/42/86/26/942428626.db2.gz GBFLUCCQHFRUET-UHFFFAOYSA-N 0 0 362.813 3.721 20 5 FHBDRN CC(C)c1[nH]nc(C(=O)Nc2nc3c(ccc(F)c3F)s2)c1[N+](=O)[O-] ZINC000501354782 942429193 /nfs/dbraw/zinc/42/91/93/942429193.db2.gz MJSGPAPJBUZHSU-UHFFFAOYSA-N 0 0 367.337 3.582 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CCCOC2 ZINC000501341815 942432942 /nfs/dbraw/zinc/43/29/42/942432942.db2.gz RQAURRBMGZJSDG-GOSISDBHSA-N 0 0 364.467 3.740 20 5 FHBDRN Cc1nc([C@H]2CCCOC2)sc1C(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000366481112 942433858 /nfs/dbraw/zinc/43/38/58/942433858.db2.gz KMVWJUCIRAOAQP-LBPRGKRZSA-N 0 0 361.423 3.814 20 5 FHBDRN CCn1c2ccccc2nc1[C@H]1CCCN1c1ncc([N+](=O)[O-])cc1F ZINC000413184831 942437398 /nfs/dbraw/zinc/43/73/98/942437398.db2.gz KQENMUBDRHIJHC-MRXNPFEDSA-N 0 0 355.373 3.840 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N2CC[C@H](C)c3ccccc32)c1F ZINC000413184254 942437706 /nfs/dbraw/zinc/43/77/06/942437706.db2.gz XCXTYOGSXRMDJO-LBPRGKRZSA-N 0 0 358.369 3.825 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)NC2(Cc3ccccc3)CCC2)c1F ZINC000413611366 942438312 /nfs/dbraw/zinc/43/83/12/942438312.db2.gz DFNBJMSFSZLMED-UHFFFAOYSA-N 0 0 372.396 3.567 20 5 FHBDRN Cc1noc(C2CCC(Nc3ncc([N+](=O)[O-])cc3C(F)(F)F)CC2)n1 ZINC000413187328 942439106 /nfs/dbraw/zinc/43/91/06/942439106.db2.gz RJOXHXVRXCFJFR-UHFFFAOYSA-N 0 0 371.319 3.838 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CCOc3ccc(F)cc32)ccc1[N+](=O)[O-] ZINC000413614776 942440338 /nfs/dbraw/zinc/44/03/38/942440338.db2.gz HACLEMPTNASIEP-UHFFFAOYSA-N 0 0 360.341 3.560 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@H](C)c1ccc(-n2cccn2)c(F)c1 ZINC000505281483 942443248 /nfs/dbraw/zinc/44/32/48/942443248.db2.gz OWYOVHNRNQFWHZ-CYBMUJFWSA-N 0 0 368.368 3.719 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)Nc1cc(Cl)ccc1-n1cccn1 ZINC000046725004 942448723 /nfs/dbraw/zinc/44/87/23/942448723.db2.gz PHKZOKYDYJUEFS-UHFFFAOYSA-N 0 0 356.769 3.615 20 5 FHBDRN Cc1cc(NC(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc2n[nH]cc21 ZINC000501395884 942448912 /nfs/dbraw/zinc/44/89/12/942448912.db2.gz PNLOMIPMHYJPOD-LBPRGKRZSA-N 0 0 353.382 3.971 20 5 FHBDRN Cn1c(-c2ccc([N+](=O)[O-])cc2)nnc1N1CCC[C@@H](CC(F)(F)F)C1 ZINC000421259906 942449134 /nfs/dbraw/zinc/44/91/34/942449134.db2.gz IDZMEVDDCIYETD-NSHDSACASA-N 0 0 369.347 3.559 20 5 FHBDRN O=C(Nc1ccccc1OCC(F)F)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000413633524 942454035 /nfs/dbraw/zinc/45/40/35/942454035.db2.gz FGMBEMYDBGMOKR-UONOGXRCSA-N 0 0 362.332 3.981 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCO[C@H](c3ccc(F)c(F)c3)C2)c2ccncc21 ZINC000066815543 942454184 /nfs/dbraw/zinc/45/41/84/942454184.db2.gz QWXGUAFTCSKQOK-IBGZPJMESA-N 0 0 371.343 3.999 20 5 FHBDRN CCS[C@@H]1CCCCN(C(=O)Nc2ccc([N+](=O)[O-])cc2OC)C1 ZINC000122901772 942455979 /nfs/dbraw/zinc/45/59/79/942455979.db2.gz KGRGLNSGZXJUCR-CYBMUJFWSA-N 0 0 353.444 3.743 20 5 FHBDRN CCC(C)(C)[C@H]1CCCN1C(=O)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC000413647586 942457311 /nfs/dbraw/zinc/45/73/11/942457311.db2.gz AWAZNKYVSIRLBQ-OAHLLOKOSA-N 0 0 352.406 3.712 20 5 FHBDRN CCS[C@H](C)c1noc(CN(C)c2ccc([N+](=O)[O-])c3ncccc23)n1 ZINC000413192333 942459261 /nfs/dbraw/zinc/45/92/61/942459261.db2.gz INFJXMCXMSFGJJ-LLVKDONJSA-N 0 0 373.438 3.977 20 5 FHBDRN CC(C)c1ccccc1NC(=O)[C@H](C)OC(=O)c1ccc([N+](=O)[O-])s1 ZINC000015855693 942467046 /nfs/dbraw/zinc/46/70/46/942467046.db2.gz HHXITGRQNSNFKR-NSHDSACASA-N 0 0 362.407 3.964 20 5 FHBDRN CCO[C@H](C(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1)c1ccccc1 ZINC000413660639 942474244 /nfs/dbraw/zinc/47/42/44/942474244.db2.gz WHMQCQHUYCDTRU-IBGZPJMESA-N 0 0 354.406 3.864 20 5 FHBDRN O=C(N[C@H]1C[C@@]1(F)c1ccccc1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000424968452 942474923 /nfs/dbraw/zinc/47/49/23/942474923.db2.gz JLMHGJQKFAZWOQ-AZUAARDMSA-N 0 0 369.396 3.562 20 5 FHBDRN C[C@@H]1[C@@H](Cc2ccccc2)CCN1C(=O)NCc1ccccc1[N+](=O)[O-] ZINC000472949581 942481844 /nfs/dbraw/zinc/48/18/44/942481844.db2.gz JBTKIOLBZXTZNO-NVXWUHKLSA-N 0 0 353.422 3.758 20 5 FHBDRN O=C(CCC(=O)c1cccc([N+](=O)[O-])c1)Nc1ccc2c(c1)CCCC2=O ZINC000452310073 942493915 /nfs/dbraw/zinc/49/39/15/942493915.db2.gz FFDBUFIJANKZDN-UHFFFAOYSA-N 0 0 366.373 3.715 20 5 FHBDRN COc1ccc(COCCNc2ncc([N+](=O)[O-])cc2C(F)(F)F)cc1 ZINC000413220797 942498105 /nfs/dbraw/zinc/49/81/05/942498105.db2.gz QHZKDMHLEWAQKY-UHFFFAOYSA-N 0 0 371.315 3.646 20 5 FHBDRN COC(=O)c1ccc(NC(=O)c2c(C)cc(C)c([N+](=O)[O-])c2C)cc1F ZINC000092604363 942500273 /nfs/dbraw/zinc/50/02/73/942500273.db2.gz HWVLSCXBMMVCFB-UHFFFAOYSA-N 0 0 360.341 3.698 20 5 FHBDRN CC(C)Oc1cc(C(=O)N[C@H](C)c2ccc3n[nH]cc3c2)ccc1[N+](=O)[O-] ZINC000412339048 942503268 /nfs/dbraw/zinc/50/32/68/942503268.db2.gz OWIBNBLRLRVVGR-GFCCVEGCSA-N 0 0 368.393 3.749 20 5 FHBDRN Cc1ccc(C2CCN(C(=O)CCNc3ccccc3[N+](=O)[O-])CC2)cn1 ZINC000541230673 942505960 /nfs/dbraw/zinc/50/59/60/942505960.db2.gz FYGJFNZDZXQRPE-UHFFFAOYSA-N 0 0 368.437 3.506 20 5 FHBDRN C[C@H](CC(=O)c1ccc(F)cc1)NC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc21 ZINC000501503782 942514424 /nfs/dbraw/zinc/51/44/24/942514424.db2.gz NMZBAYMYDYAHQE-LLVKDONJSA-N 0 0 369.352 3.607 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N1CCc2c(F)cc(F)cc2[C@@H]1C ZINC000469229821 942514832 /nfs/dbraw/zinc/51/48/32/942514832.db2.gz ZLXYTHPRDQPCPT-JTQLQIEISA-N 0 0 362.332 3.641 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)Nc1cc(-c2ncc[nH]2)ccc1C ZINC000366524164 942517773 /nfs/dbraw/zinc/51/77/73/942517773.db2.gz VLWSBNQFIUNHGB-UHFFFAOYSA-N 0 0 352.350 3.554 20 5 FHBDRN C[C@H](CNC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N(C)c1ccccc1 ZINC000501516146 942529614 /nfs/dbraw/zinc/52/96/14/942529614.db2.gz OVDLITBLCYGMJZ-GFCCVEGCSA-N 0 0 362.817 3.895 20 5 FHBDRN CC[C@H](CNC(=O)N(C)CCc1cccc([N+](=O)[O-])c1)CC(F)(F)F ZINC000413740351 942542062 /nfs/dbraw/zinc/54/20/62/942542062.db2.gz NGZVCIAFLWOQIP-LBPRGKRZSA-N 0 0 361.364 3.757 20 5 FHBDRN Cc1cn([C@@H](C)c2ccccc2)nc1NC(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000434239980 942542013 /nfs/dbraw/zinc/54/20/13/942542013.db2.gz OKYQFDFYCCBGBC-AWEZNQCLSA-N 0 0 365.393 3.775 20 5 FHBDRN Cc1ccccc1C1=CCN(C(=O)CSc2ccc([N+](=O)[O-])cc2)C1 ZINC000501556807 942547967 /nfs/dbraw/zinc/54/79/67/942547967.db2.gz PXJKVNRXMXEUBB-UHFFFAOYSA-N 0 0 354.431 3.921 20 5 FHBDRN O=C(Nc1ccncc1[N+](=O)[O-])N1CCC[C@H](c2nc3ccccc3o2)C1 ZINC000183561851 942549352 /nfs/dbraw/zinc/54/93/52/942549352.db2.gz ODBJTSLYZBLOEZ-LBPRGKRZSA-N 0 0 367.365 3.543 20 5 FHBDRN O=C([C@H]1Cc2cc(Cl)ccc2O1)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000513839953 942552062 /nfs/dbraw/zinc/55/20/62/942552062.db2.gz UIXCJMBKQWABGB-QGZVFWFLSA-N 0 0 358.781 3.531 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)N1CC=C(c2ccccc2F)C1 ZINC000501585274 942552813 /nfs/dbraw/zinc/55/28/13/942552813.db2.gz PAQWSPYPSRCJDP-UHFFFAOYSA-N 0 0 369.396 3.852 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])c[nH]1)N1CCC[C@H](COc2ccccc2Cl)C1 ZINC000513862251 942557033 /nfs/dbraw/zinc/55/70/33/942557033.db2.gz SOIKFDWMSJADDP-LBPRGKRZSA-N 0 0 363.801 3.508 20 5 FHBDRN CCNc1ccc(C(=O)NCc2ccc(Cl)cc2OC)cc1[N+](=O)[O-] ZINC000502576593 942557446 /nfs/dbraw/zinc/55/74/46/942557446.db2.gz WTIBNYSVPAVWAT-UHFFFAOYSA-N 0 0 363.801 3.619 20 5 FHBDRN CC(C)(C)c1csc(CNc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)n1 ZINC000104659241 942561545 /nfs/dbraw/zinc/56/15/45/942561545.db2.gz VFFDNRXCXHQSCL-UHFFFAOYSA-N 0 0 360.439 3.846 20 5 FHBDRN COc1ccc(CNC(=O)[C@@H](OC(C)(C)C)c2ccccc2)cc1[N+](=O)[O-] ZINC000513854659 942564681 /nfs/dbraw/zinc/56/46/81/942564681.db2.gz SMNPLSDYMSUGOS-SFHVURJKSA-N 0 0 372.421 3.776 20 5 FHBDRN Cc1cc(C2=CCN(C(=O)c3cc(C(C)C)on3)CC2)cc([N+](=O)[O-])c1N ZINC000378307219 942565077 /nfs/dbraw/zinc/56/50/77/942565077.db2.gz PTXDANVZBGBUSU-UHFFFAOYSA-N 0 0 370.409 3.526 20 5 FHBDRN Cn1c2ccc([N+](=O)[O-])cc2nc1-c1cnn(-c2ccc(Cl)cc2)c1 ZINC000513858371 942567095 /nfs/dbraw/zinc/56/70/95/942567095.db2.gz YTCMVRPCRYYXTG-UHFFFAOYSA-N 0 0 353.769 3.988 20 5 FHBDRN COc1cc(C)c(NC(=O)CSc2ccccc2[N+](=O)[O-])cc1OC ZINC000015948787 942568465 /nfs/dbraw/zinc/56/84/65/942568465.db2.gz BCRCXADAWIZKDU-UHFFFAOYSA-N 0 0 362.407 3.651 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H](C)COCc2ccccc2)c1 ZINC000501598741 942570030 /nfs/dbraw/zinc/57/00/30/942570030.db2.gz ACRZXLPADONLKK-CQSZACIVSA-N 0 0 374.462 3.899 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCCC[C@H]1OC(F)F ZINC000501627326 942573608 /nfs/dbraw/zinc/57/36/08/942573608.db2.gz GUAGFXCLRJAPPU-ZLKJLUDKSA-N 0 0 374.409 3.742 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CCC(c3ccncc3)CC2)c(C(F)(F)F)c1 ZINC000413263497 942575248 /nfs/dbraw/zinc/57/52/48/942575248.db2.gz LJJBRHFRWPTONF-UHFFFAOYSA-N 0 0 352.316 3.788 20 5 FHBDRN CCOc1ccc(C(=O)NC[C@H](C)COCc2ccccc2)cc1[N+](=O)[O-] ZINC000501615786 942576661 /nfs/dbraw/zinc/57/66/61/942576661.db2.gz DZIUPMKITGIETE-HNNXBMFYSA-N 0 0 372.421 3.576 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)Nc1ccc(C(=O)NCC(C)C)cc1 ZINC000421449894 942580449 /nfs/dbraw/zinc/58/04/49/942580449.db2.gz PVIBRHVGQVFLBQ-UHFFFAOYSA-N 0 0 369.421 3.850 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CCC[C@@H](Oc2ccccc2)C1 ZINC000416271258 942585434 /nfs/dbraw/zinc/58/54/34/942585434.db2.gz PYYZOSZADVBJSV-OAHLLOKOSA-N 0 0 360.797 3.932 20 5 FHBDRN CC(C)(COCc1ccccc1)NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000413776191 942586123 /nfs/dbraw/zinc/58/61/23/942586123.db2.gz VVJQJNIZVAFWGN-RBUKOAKNSA-N 0 0 368.433 3.810 20 5 FHBDRN O=C(Nc1cccc2cnccc21)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000063465879 942592109 /nfs/dbraw/zinc/59/21/09/942592109.db2.gz QIFMDCMXPQEZHY-UHFFFAOYSA-N 0 0 359.345 3.581 20 5 FHBDRN CCc1ccc(NC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)cc1F ZINC000501647161 942594495 /nfs/dbraw/zinc/59/44/95/942594495.db2.gz INUWYTKYVUNHFI-UHFFFAOYSA-N 0 0 354.341 3.734 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)Nc1ccc(N2CCCCC2)cn1 ZINC000421458930 942596972 /nfs/dbraw/zinc/59/69/72/942596972.db2.gz MJWVPRIFLZWEJC-UHFFFAOYSA-N 0 0 354.410 3.849 20 5 FHBDRN COc1cc(C(=O)N[C@@H]2CC[C@@H](C)c3ccccc32)cc([N+](=O)[O-])c1OC ZINC000501682664 942597760 /nfs/dbraw/zinc/59/77/60/942597760.db2.gz WIWQLGHUDCDUMB-MLGOLLRUSA-N 0 0 370.405 3.980 20 5 FHBDRN CC(=O)N1CC[C@H](NC(=O)Nc2ccc(C)c([N+](=O)[O-])c2)c2ccccc21 ZINC000366962984 942598235 /nfs/dbraw/zinc/59/82/35/942598235.db2.gz RCFKOLGNWOJUMX-INIZCTEOSA-N 0 0 368.393 3.523 20 5 FHBDRN COc1ccc(Cl)cc1CN(C)Cc1cc([N+](=O)[O-])ccc1OC ZINC000016422609 942598382 /nfs/dbraw/zinc/59/83/82/942598382.db2.gz BTKQUVNFDHRQRD-UHFFFAOYSA-N 0 0 350.802 3.897 20 5 FHBDRN COc1ccc2c(c1)N(C(=O)c1cc([N+](=O)[O-])c(C)cc1C)C[C@H](C)O2 ZINC000421483971 942600586 /nfs/dbraw/zinc/60/05/86/942600586.db2.gz TZSPAHMNDDJJTC-ZDUSSCGKSA-N 0 0 356.378 3.648 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCCN(C)c2ccc(F)cc21 ZINC000421485478 942600827 /nfs/dbraw/zinc/60/08/27/942600827.db2.gz XPJCONNVCVMSDZ-UHFFFAOYSA-N 0 0 357.385 3.837 20 5 FHBDRN CC[C@H](CSc1ccccc1)NC(=O)COc1ccccc1[N+](=O)[O-] ZINC000501669024 942600919 /nfs/dbraw/zinc/60/09/19/942600919.db2.gz UJAKKUAVGDXQBT-CQSZACIVSA-N 0 0 360.435 3.661 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@](C)(OC)CC1 ZINC000366568280 942603281 /nfs/dbraw/zinc/60/32/81/942603281.db2.gz YPKKEFAKFJZLKW-KRWDZBQOSA-N 0 0 352.456 3.738 20 5 FHBDRN O=[N+]([O-])c1ccc2ccnc(N3CCC[C@](CO)(c4ccccc4)C3)c2c1 ZINC000413286275 942605369 /nfs/dbraw/zinc/60/53/69/942605369.db2.gz RXESSKHSUODDHT-NRFANRHFSA-N 0 0 363.417 3.674 20 5 FHBDRN CC1(C)CN(c2ncc([N+](=O)[O-])cc2C(F)(F)F)C[C@@H](C(F)(F)F)O1 ZINC000413294342 942613884 /nfs/dbraw/zinc/61/38/84/942613884.db2.gz BAMNRRFXTNFXMO-VIFPVBQESA-N 0 0 373.253 3.555 20 5 FHBDRN O=C(Nc1cccc2ccsc21)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000501691602 942614205 /nfs/dbraw/zinc/61/42/05/942614205.db2.gz GZQYVSGICPCROW-UHFFFAOYSA-N 0 0 365.374 3.643 20 5 FHBDRN CCCCOc1ccc(C(=O)N(C)Cc2ccccc2[N+](=O)[O-])c(O)c1 ZINC000190104621 942626612 /nfs/dbraw/zinc/62/66/12/942626612.db2.gz ZHBYCPHXDZMLRF-UHFFFAOYSA-N 0 0 358.394 3.752 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H](c1ccc2c(c1)OCCO2)C1CC1 ZINC000501704216 942629500 /nfs/dbraw/zinc/62/95/00/942629500.db2.gz OVSCWHBLZINYHK-LJQANCHMSA-N 0 0 368.389 3.556 20 5 FHBDRN COC[C@H](Cc1ccccc1)N(C)C(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC000421505010 942631178 /nfs/dbraw/zinc/63/11/78/942631178.db2.gz LNHPKWFTODLVIU-KRWDZBQOSA-N 0 0 356.422 3.541 20 5 FHBDRN O=[N+]([O-])c1cnc(NCCc2cnc(SC3CCCC3)nc2)c(F)c1 ZINC000413302048 942637738 /nfs/dbraw/zinc/63/77/38/942637738.db2.gz SOTZERVUBJXQDM-UHFFFAOYSA-N 0 0 363.418 3.608 20 5 FHBDRN O=[N+]([O-])c1cnc(NC[C@@]2(CO)C[C@@H]2c2ccccc2)c(C(F)(F)F)c1 ZINC000413309257 942642661 /nfs/dbraw/zinc/64/26/61/942642661.db2.gz LHJWAHQHQITGJG-GDBMZVCRSA-N 0 0 367.327 3.587 20 5 FHBDRN CSCC1CCC(NC(=O)CSc2ccc([N+](=O)[O-])cc2)CC1 ZINC000452486886 942646626 /nfs/dbraw/zinc/64/66/26/942646626.db2.gz BQRVQICUFGLZDC-UHFFFAOYSA-N 0 0 354.497 3.725 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NC[C@H]1CC[C@@H](c2ccccc2)O1 ZINC000421561559 942647493 /nfs/dbraw/zinc/64/74/93/942647493.db2.gz RRIUNZVHRIZPKZ-APWZRJJASA-N 0 0 354.406 3.862 20 5 FHBDRN CCc1ccc(C(=O)N(CC(=O)OC(C)(C)C)[C@H](C)CC)cc1[N+](=O)[O-] ZINC000502677310 942651785 /nfs/dbraw/zinc/65/17/85/942651785.db2.gz VLQOUWQXVUYCNZ-CYBMUJFWSA-N 0 0 364.442 3.740 20 5 FHBDRN Cc1c(CNC(=O)NCc2cc(F)c(Cl)cc2F)cccc1[N+](=O)[O-] ZINC000434419085 942663042 /nfs/dbraw/zinc/66/30/42/942663042.db2.gz INYICELOMXDPGQ-UHFFFAOYSA-N 0 0 369.755 3.834 20 5 FHBDRN O=[N+]([O-])c1ccc(N[C@H]2CCO[C@H](c3cccnc3)C2)c2cccnc21 ZINC000413322962 942664429 /nfs/dbraw/zinc/66/44/29/942664429.db2.gz SGSMINMOODZERM-KSSFIOAISA-N 0 0 350.378 3.870 20 5 FHBDRN CC[C@H](C)CNC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 ZINC000421577421 942668903 /nfs/dbraw/zinc/66/89/03/942668903.db2.gz FQIBMSQSXJTVGV-KBPBESRZSA-N 0 0 356.426 3.939 20 5 FHBDRN CC(C)Oc1cc(C(=O)N(C)Cc2c(F)cccc2F)ccc1[N+](=O)[O-] ZINC000412366311 942670822 /nfs/dbraw/zinc/67/08/22/942670822.db2.gz RGNVEOFAAKGSJK-UHFFFAOYSA-N 0 0 364.348 3.932 20 5 FHBDRN CCCOc1ccc(C(=O)CCC(=O)NCc2cccc([N+](=O)[O-])c2)cc1 ZINC000067329989 942672464 /nfs/dbraw/zinc/67/24/64/942672464.db2.gz AOROZMAFHAEAMG-UHFFFAOYSA-N 0 0 370.405 3.663 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1CN[C@@H](C)c1nc(-c2ccc(F)cc2)no1 ZINC000366610219 942676660 /nfs/dbraw/zinc/67/66/60/942676660.db2.gz QXHZUQGFUGOQSK-NSHDSACASA-N 0 0 372.356 3.643 20 5 FHBDRN Cc1c(Cc2noc([C@@H]3CCc4ccccc4O3)n2)cccc1[N+](=O)[O-] ZINC000420489541 942693849 /nfs/dbraw/zinc/69/38/49/942693849.db2.gz XHKQEJQYDDANMQ-KRWDZBQOSA-N 0 0 351.362 3.943 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)NC[C@H]2CCC[C@H]2C2CC2)cc1OC ZINC000413869111 942695059 /nfs/dbraw/zinc/69/50/59/942695059.db2.gz ACZRMXHOGOXTOS-KGLIPLIRSA-N 0 0 362.426 3.558 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N(CC2CC2)C2CCCCC2)c1F ZINC000413346148 942702292 /nfs/dbraw/zinc/70/22/92/942702292.db2.gz HLWSYFWLTJDVBF-UHFFFAOYSA-N 0 0 364.417 3.856 20 5 FHBDRN O=C(/C=C/c1ccc([N+](=O)[O-])cc1)N[C@H](c1ccccc1)[C@@H]1CCOC1 ZINC000378394617 942703153 /nfs/dbraw/zinc/70/31/53/942703153.db2.gz YJVZFMJCHHJPMY-JTMFDWDJSA-N 0 0 352.390 3.502 20 5 FHBDRN COC(=O)c1cc(C(=O)N[C@H]2CCC[C@@H](C(C)C)CC2)cc([N+](=O)[O-])c1 ZINC001269795202 942712630 /nfs/dbraw/zinc/71/26/30/942712630.db2.gz MIDDQOLPPAHLAR-CJNGLKHVSA-N 0 0 362.426 3.716 20 5 FHBDRN CCN(C(=O)c1nn(C)cc1[N+](=O)[O-])C(c1ccccc1)c1ccccc1 ZINC000502747635 942714023 /nfs/dbraw/zinc/71/40/23/942714023.db2.gz GGBAFCDIOLCTOH-UHFFFAOYSA-N 0 0 364.405 3.580 20 5 FHBDRN Cc1cc2sc(NC(=O)NCc3ccccc3[N+](=O)[O-])nc2cc1F ZINC000434507703 942714747 /nfs/dbraw/zinc/71/47/47/942714747.db2.gz JODSRFKQTIFDGA-UHFFFAOYSA-N 0 0 360.370 3.974 20 5 FHBDRN COCCC1(c2noc(-c3ccc([N+](=O)[O-])c(OC(C)C)c3)n2)CCC1 ZINC000420515947 942719771 /nfs/dbraw/zinc/71/97/71/942719771.db2.gz VDTWEMBIGJWTSP-UHFFFAOYSA-N 0 0 361.398 3.890 20 5 FHBDRN CC(C)(C)c1csc(CN2CCN(c3ccccc3[N+](=O)[O-])CC2)n1 ZINC000434525676 942735528 /nfs/dbraw/zinc/73/55/28/942735528.db2.gz KZGUOUWYIYTTMQ-UHFFFAOYSA-N 0 0 360.483 3.671 20 5 FHBDRN O=C(c1cccc([N+](=O)[O-])c1)N1CCCN(c2ccccc2Cl)CC1 ZINC000514088155 942738886 /nfs/dbraw/zinc/73/88/86/942738886.db2.gz JSZPSOMOMWNOJN-UHFFFAOYSA-N 0 0 359.813 3.601 20 5 FHBDRN CCOc1cccc(CN[C@@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)c1 ZINC000514092571 942743107 /nfs/dbraw/zinc/74/31/07/942743107.db2.gz FOEDXXSJZOEMCN-LJQANCHMSA-N 0 0 366.421 3.606 20 5 FHBDRN COC(=O)Cc1ccc(NC(=O)c2c(C)cc(C)c([N+](=O)[O-])c2C)cc1F ZINC000421690776 942746511 /nfs/dbraw/zinc/74/65/11/942746511.db2.gz SMBXUGVMPGUXLZ-UHFFFAOYSA-N 0 0 374.368 3.627 20 5 FHBDRN CN(C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)C1CC(OC(C)(C)C)C1 ZINC000421693511 942748988 /nfs/dbraw/zinc/74/89/88/942748988.db2.gz MPPATSGFJWKCOE-UHFFFAOYSA-N 0 0 372.368 3.614 20 5 FHBDRN CCn1c(S[C@H](C(=O)OC)C2CC2)nc2cc3ccccc3cc2c1=O ZINC000514109096 942752500 /nfs/dbraw/zinc/75/25/00/942752500.db2.gz JRSGPXVXGBXSMI-KRWDZBQOSA-N 0 0 368.458 3.613 20 5 FHBDRN CCOc1ccccc1CN(C)[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000514116508 942756129 /nfs/dbraw/zinc/75/61/29/942756129.db2.gz IIBMFQRULATAHU-HNNXBMFYSA-N 0 0 371.437 3.761 20 5 FHBDRN Cc1nn(Cc2cc(C)nc(-c3ccc(Cl)cc3)n2)c(C)c1[N+](=O)[O-] ZINC000161697901 942759328 /nfs/dbraw/zinc/75/93/28/942759328.db2.gz MPJQHSNZIMRNCV-UHFFFAOYSA-N 0 0 357.801 3.875 20 5 FHBDRN CN(Cc1ccc([S@](C)=O)cc1)c1ccc([N+](=O)[O-])cc1OC(F)F ZINC000780910795 942766053 /nfs/dbraw/zinc/76/60/53/942766053.db2.gz DARFUOLVKOJSNW-VWLOTQADSA-N 0 0 370.377 3.570 20 5 FHBDRN CCC(C)(C)c1ccc(CNC(=O)CCn2nc(C)c([N+](=O)[O-])c2C)cc1 ZINC000505431219 942766474 /nfs/dbraw/zinc/76/64/74/942766474.db2.gz PRRUJNBHHKGGLQ-UHFFFAOYSA-N 0 0 372.469 3.802 20 5 FHBDRN O=[N+]([O-])c1ccccc1/C=C\CN1CCO[C@@H](c2ccc(F)c(F)c2)C1 ZINC000513756230 942771934 /nfs/dbraw/zinc/77/19/34/942771934.db2.gz XEADYCHPQWKUFD-SIEMBAAWSA-N 0 0 360.360 3.960 20 5 FHBDRN CCN(C(=O)CCOc1ccccc1[N+](=O)[O-])c1ccc2[nH]ccc2c1 ZINC000472987101 942771924 /nfs/dbraw/zinc/77/19/24/942771924.db2.gz QJUSBEJWCMDJSK-UHFFFAOYSA-N 0 0 353.378 3.898 20 5 FHBDRN Cc1nn(CCC(=O)N2CC[C@@H](c3ccccc3)C2(C)C)c(C)c1[N+](=O)[O-] ZINC000421722025 942776080 /nfs/dbraw/zinc/77/60/80/942776080.db2.gz LPJXCGBNIVCFDZ-KRWDZBQOSA-N 0 0 370.453 3.593 20 5 FHBDRN C[C@H](C(=O)OC(C)(C)C)N(C(=O)c1ccc(Cl)cc1[N+](=O)[O-])C1CC1 ZINC000413917683 942776971 /nfs/dbraw/zinc/77/69/71/942776971.db2.gz QQRXXGYQYOOTDM-SNVBAGLBSA-N 0 0 368.817 3.583 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1Cc2ccccc2O1 ZINC000502825996 942780827 /nfs/dbraw/zinc/78/08/27/942780827.db2.gz BJCQLILLFRPTAA-HNNXBMFYSA-N 0 0 372.446 3.830 20 5 FHBDRN NC(=O)c1cccc(CSCc2ccc([N+](=O)[O-])cc2C(F)(F)F)n1 ZINC000502829089 942782967 /nfs/dbraw/zinc/78/29/67/942782967.db2.gz RZVALFPVRZSXGG-UHFFFAOYSA-N 0 0 371.340 3.541 20 5 FHBDRN CN(C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)[C@H]1CCc2ccccc21 ZINC000514164157 942784647 /nfs/dbraw/zinc/78/46/47/942784647.db2.gz FZINWTDRCQWEHL-AWEZNQCLSA-N 0 0 362.332 3.956 20 5 FHBDRN CC(C)c1ccc(C(=O)N=c2ccn(CCC(F)(F)F)[nH]2)cc1[N+](=O)[O-] ZINC000425105400 942785351 /nfs/dbraw/zinc/78/53/51/942785351.db2.gz YIYFVWNURBLBFA-UHFFFAOYSA-N 0 0 370.331 3.541 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCO[C@H](c2ccc(F)cc2)C1 ZINC000421745114 942792295 /nfs/dbraw/zinc/79/22/95/942792295.db2.gz STZBKKQMYPULKH-SFHVURJKSA-N 0 0 358.369 3.564 20 5 FHBDRN CN(CCCNC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000431871974 942795566 /nfs/dbraw/zinc/79/55/66/942795566.db2.gz NPIHJPHREGQHMJ-UHFFFAOYSA-N 0 0 370.453 3.656 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1C[C@@H](C)O[C@H](c2ccccc2)C1 ZINC000421749938 942795780 /nfs/dbraw/zinc/79/57/80/942795780.db2.gz SHLDMIFASLTKMZ-BEFAXECRSA-N 0 0 354.406 3.814 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1C[C@@H](C)O[C@@H](c2ccccc2)C1 ZINC000421749939 942795910 /nfs/dbraw/zinc/79/59/10/942795910.db2.gz SHLDMIFASLTKMZ-DNVCBOLYSA-N 0 0 354.406 3.814 20 5 FHBDRN CN(C(=O)c1cc(F)cc([N+](=O)[O-])c1)c1ccc(C(=O)NC(C)(C)C)cc1 ZINC000413924203 942798302 /nfs/dbraw/zinc/79/83/02/942798302.db2.gz MRIOKGIXOKTTQB-UHFFFAOYSA-N 0 0 373.384 3.539 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CCSc1ccc2c(c1)OCCO2 ZINC000041887143 942803312 /nfs/dbraw/zinc/80/33/12/942803312.db2.gz LSXRZPJETVMAEM-UHFFFAOYSA-N 0 0 374.418 3.795 20 5 FHBDRN C[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514195698 942806635 /nfs/dbraw/zinc/80/66/35/942806635.db2.gz SJCRGTNNBORIIH-NTZNESFSSA-N 0 0 354.353 3.989 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCC[C@@H](Nc2ccccc2)C1 ZINC000421785715 942809990 /nfs/dbraw/zinc/80/99/90/942809990.db2.gz OCXZXLLNWBBWOP-QGZVFWFLSA-N 0 0 353.422 3.928 20 5 FHBDRN CCSc1cccc(NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2C)c1 ZINC000190118744 942824600 /nfs/dbraw/zinc/82/46/00/942824600.db2.gz FKCRTGPQIGIUCW-UHFFFAOYSA-N 0 0 359.407 3.592 20 5 FHBDRN CCCNc1ccccc1NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000190121185 942824927 /nfs/dbraw/zinc/82/49/27/942824927.db2.gz MVUHTXLWMHMXCQ-UHFFFAOYSA-N 0 0 365.393 3.855 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N(Cc1ccc(O)cc1)CC1CC1 ZINC000421788549 942826080 /nfs/dbraw/zinc/82/60/80/942826080.db2.gz XXNJWGDQBTVCIU-UHFFFAOYSA-N 0 0 354.406 3.970 20 5 FHBDRN Cc1cc([C@@H]2CN(C(=O)c3cc([N+](=O)[O-])c(C)cc3C)CCO2)ccc1F ZINC000421794454 942830082 /nfs/dbraw/zinc/83/00/82/942830082.db2.gz BSYLXQYTSLOADS-IBGZPJMESA-N 0 0 372.396 3.873 20 5 FHBDRN CCCN(C[C@@H]1CCCCO1)C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514222241 942833529 /nfs/dbraw/zinc/83/35/29/942833529.db2.gz JDNPFJJQUNTOPQ-ZDUSSCGKSA-N 0 0 372.368 3.618 20 5 FHBDRN Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)N1CCC[C@H](c2nccs2)C1 ZINC000367092913 942839669 /nfs/dbraw/zinc/83/96/69/942839669.db2.gz QRFIBALWNYLSJH-NSHDSACASA-N 0 0 364.402 3.910 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]1c1ccccc1C(F)(F)F ZINC000505459727 942840045 /nfs/dbraw/zinc/84/00/45/942840045.db2.gz HWGVWXOTZRSURW-UKRRQHHQSA-N 0 0 365.311 3.603 20 5 FHBDRN CCOc1cc2c(cc1NC(=O)c1ccc([N+](=O)[O-])cc1C)O[C@@H](C)C2 ZINC000502916057 942840325 /nfs/dbraw/zinc/84/03/25/942840325.db2.gz KBUUYPZRBMNHCI-LBPRGKRZSA-N 0 0 356.378 3.878 20 5 FHBDRN CC(C)c1ccc(C(=O)Nc2c[nH]nc2-c2ccccn2)cc1[N+](=O)[O-] ZINC000190185398 942849095 /nfs/dbraw/zinc/84/90/95/942849095.db2.gz YUENIDVLSUBKEX-UHFFFAOYSA-N 0 0 351.366 3.756 20 5 FHBDRN O=C(NCc1ccc2c(c1)COC2)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000431878268 942852827 /nfs/dbraw/zinc/85/28/27/942852827.db2.gz ABQQRPCMGYZEJS-UHFFFAOYSA-N 0 0 354.387 3.770 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)N[C@@H]1CCCc2c(O)cccc21 ZINC000190202909 942853931 /nfs/dbraw/zinc/85/39/31/942853931.db2.gz LLBONPKHEGMVIN-MRXNPFEDSA-N 0 0 358.419 3.586 20 5 FHBDRN COc1ccc(OCC(=O)Nc2ccc(Cl)cc2C)cc1[N+](=O)[O-] ZINC000190183400 942855075 /nfs/dbraw/zinc/85/50/75/942855075.db2.gz AAYJFTFFBHMNLQ-UHFFFAOYSA-N 0 0 350.758 3.583 20 5 FHBDRN CC(C)Cn1c(-c2cccc([N+](=O)[O-])c2)nnc1N1C[C@@H]2CCC[C@@H]2C1 ZINC000549440872 942857492 /nfs/dbraw/zinc/85/74/92/942857492.db2.gz RAXVXECNEGVAJG-IYBDPMFKSA-N 0 0 355.442 3.746 20 5 FHBDRN COc1cc(CN2CCC(C(=O)c3ccc(F)cc3)CC2)ccc1[N+](=O)[O-] ZINC000434684867 942864180 /nfs/dbraw/zinc/86/41/80/942864180.db2.gz NHBDHCWASCDSHB-UHFFFAOYSA-N 0 0 372.396 3.837 20 5 FHBDRN CCOc1ccc2nc(NC(=O)CNc3ccccc3[N+](=O)[O-])sc2c1 ZINC000505468815 942864350 /nfs/dbraw/zinc/86/43/50/942864350.db2.gz WZHUFMOREMUPIR-UHFFFAOYSA-N 0 0 372.406 3.654 20 5 FHBDRN CC[C@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)Nc1cccc2ccsc21 ZINC000502955343 942875125 /nfs/dbraw/zinc/87/51/25/942875125.db2.gz KIJGWTBAXWVFNC-LBPRGKRZSA-N 0 0 373.438 3.681 20 5 FHBDRN CC(C)(C(=O)Nc1cccc(-c2nnco2)c1)c1ccccc1[N+](=O)[O-] ZINC000431879971 942875934 /nfs/dbraw/zinc/87/59/34/942875934.db2.gz BMKNVXZOKRJISF-UHFFFAOYSA-N 0 0 352.350 3.561 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCC[C@H]1COc1cccnc1C ZINC000421898947 942877485 /nfs/dbraw/zinc/87/74/85/942877485.db2.gz KEASQVPBYKPVJS-INIZCTEOSA-N 0 0 369.421 3.599 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CC[C@](F)(c2ccccc2C)C1 ZINC000502969131 942882149 /nfs/dbraw/zinc/88/21/49/942882149.db2.gz JZDDSALHEOUZFT-HXUWFJFHSA-N 0 0 371.412 3.721 20 5 FHBDRN O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1CC=C(c2cncc(F)c2)CC1 ZINC000378554371 942884343 /nfs/dbraw/zinc/88/43/43/942884343.db2.gz YARDNZJSSPDRPX-UHFFFAOYSA-N 0 0 361.760 3.712 20 5 FHBDRN O=C(CO[C@H]1CCCc2ccccc21)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000430090543 942884598 /nfs/dbraw/zinc/88/45/98/942884598.db2.gz OBPOEUDXKBEQTD-IBGZPJMESA-N 0 0 352.390 3.578 20 5 FHBDRN CCc1ccc([C@@H]2CN(C(=O)c3ccc(CC)c([N+](=O)[O-])c3)CCN2)cc1 ZINC000505483574 942889538 /nfs/dbraw/zinc/88/95/38/942889538.db2.gz KEWHPVTZGSMIHG-IBGZPJMESA-N 0 0 367.449 3.506 20 5 FHBDRN O=[N+]([O-])c1ccccc1OCCOc1ccc(Br)cc1F ZINC000509983817 942892477 /nfs/dbraw/zinc/89/24/77/942892477.db2.gz FOOFIJBDPHNSCV-UHFFFAOYSA-N 0 0 356.147 3.954 20 5 FHBDRN CC[C@H]1CCc2nc(NC(=O)COc3cccc([N+](=O)[O-])c3)sc2C1 ZINC000502983954 942894097 /nfs/dbraw/zinc/89/40/97/942894097.db2.gz QUIRRIZCQVXRQI-NSHDSACASA-N 0 0 361.423 3.584 20 5 FHBDRN O=C(CCC(=O)N1CCC[C@H](CC(F)(F)F)C1)c1cccc([N+](=O)[O-])c1 ZINC000421953809 942905818 /nfs/dbraw/zinc/90/58/18/942905818.db2.gz GALHEHKZOVXXNZ-GFCCVEGCSA-N 0 0 372.343 3.749 20 5 FHBDRN CC[C@@H]1CN(C(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[C@@H](CC)O1 ZINC000421961053 942909832 /nfs/dbraw/zinc/90/98/32/942909832.db2.gz FLBUBHJVBJWSJN-VXGBXAGGSA-N 0 0 360.332 3.643 20 5 FHBDRN CCOc1ccc(CN(C)C(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)cc1 ZINC000503023686 942915791 /nfs/dbraw/zinc/91/57/91/942915791.db2.gz WYRJIBRWAHFLHW-UHFFFAOYSA-N 0 0 353.378 3.747 20 5 FHBDRN O=C(N[C@H](C[C@@H]1CCOC1)c1ccccc1)c1cc(F)cc([N+](=O)[O-])c1 ZINC000510009223 942922848 /nfs/dbraw/zinc/92/28/48/942922848.db2.gz FYDLVRNKZWFCDJ-SCLBCKFNSA-N 0 0 358.369 3.632 20 5 FHBDRN CC(C)c1[nH]nc(C(=O)Nc2ccc3c(c2)C(=O)CCCC3)c1[N+](=O)[O-] ZINC000422033842 942948482 /nfs/dbraw/zinc/94/84/82/942948482.db2.gz CQYGJTKOXDIRNX-UHFFFAOYSA-N 0 0 356.382 3.603 20 5 FHBDRN Cc1c(CNC(=O)C2(c3ccc([N+](=O)[O-])cc3)CCC2)cccc1[N+](=O)[O-] ZINC001269215040 942958251 /nfs/dbraw/zinc/95/82/51/942958251.db2.gz LMZYFZURYRDVIP-UHFFFAOYSA-N 0 0 369.377 3.550 20 5 FHBDRN Cc1onc(-c2cccs2)c1C(=O)NCc1cccc([N+](=O)[O-])c1C ZINC001269216115 942960751 /nfs/dbraw/zinc/96/07/51/942960751.db2.gz UBYXWAOTABOVSU-UHFFFAOYSA-N 0 0 357.391 3.858 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)N[C@H]1CCCc2c(O)cccc21 ZINC000503100681 942973571 /nfs/dbraw/zinc/97/35/71/942973571.db2.gz DHYYWLHDZVKYGW-KRWDZBQOSA-N 0 0 369.421 3.562 20 5 FHBDRN C[C@@H](Nc1ccc2c(c1)C(=O)CCCC2)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000422086830 942992930 /nfs/dbraw/zinc/99/29/30/942992930.db2.gz PLENATNVVPEMMN-CYBMUJFWSA-N 0 0 367.405 3.943 20 5 FHBDRN CC[C@@H](CNS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])CC(F)(F)F ZINC000416591944 942994497 /nfs/dbraw/zinc/99/44/97/942994497.db2.gz IPDWOIXIWGGZBR-MRVPVSSYSA-N 0 0 374.768 3.505 20 5 FHBDRN O=C(CC1CCCC1)NC1CCC(C(=O)Nc2cccc([N+](=O)[O-])c2)CC1 ZINC000133636691 943019683 /nfs/dbraw/zinc/01/96/83/943019683.db2.gz VEFUIBFEDJYPEG-UHFFFAOYSA-N 0 0 373.453 3.789 20 5 FHBDRN C[C@@H](NS(=O)(=O)Cc1cccc([N+](=O)[O-])c1)c1ccc(C2CC2)cc1 ZINC000416654121 943021775 /nfs/dbraw/zinc/02/17/75/943021775.db2.gz CKJOEFYYGZDUBZ-CYBMUJFWSA-N 0 0 360.435 3.653 20 5 FHBDRN O=C(NCCc1ccc(Cl)s1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000514463230 943023975 /nfs/dbraw/zinc/02/39/75/943023975.db2.gz KIPHVFHDBWYNTA-UHFFFAOYSA-N 0 0 365.842 3.857 20 5 FHBDRN CCCn1nc(C)c(C(=O)Nc2cc(C)nc3ccc([N+](=O)[O-])cc32)c1C ZINC000183691526 943024675 /nfs/dbraw/zinc/02/46/75/943024675.db2.gz SMBCARHBDZKNHP-UHFFFAOYSA-N 0 0 367.409 3.927 20 5 FHBDRN CCOC(=O)C1CCC(Nc2ccc([N+](=O)[O-])c(OC(F)F)c2)CC1 ZINC000092621384 943024855 /nfs/dbraw/zinc/02/48/55/943024855.db2.gz QGQASVDFWQWVOT-UHFFFAOYSA-N 0 0 358.341 3.730 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)N[C@H]1C[C@@H]1c1ccccc1C(F)(F)F ZINC000505559315 943028244 /nfs/dbraw/zinc/02/82/44/943028244.db2.gz VFVNVVVMDQCJFS-ZBFHGGJFSA-N 0 0 364.323 3.828 20 5 FHBDRN CC(=O)N1Cc2ccc(N[C@H]3CCCc4ccc([N+](=O)[O-])cc43)cc2C1 ZINC000365818138 943028276 /nfs/dbraw/zinc/02/82/76/943028276.db2.gz IYCHGPLJVJPPQX-FQEVSTJZSA-N 0 0 351.406 3.946 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N(C)Cc2sccc2C)cc1OC ZINC000105010875 943030301 /nfs/dbraw/zinc/03/03/01/943030301.db2.gz SJMJCGHVSGUJLB-UHFFFAOYSA-N 0 0 364.423 3.644 20 5 FHBDRN CC(C)NC(=O)c1ccc(N[C@H](c2cnn(C)c2)C(C)(C)C)c([N+](=O)[O-])c1 ZINC000425241388 943032513 /nfs/dbraw/zinc/03/25/13/943032513.db2.gz QEQAEXLTXBHMQB-QGZVFWFLSA-N 0 0 373.457 3.666 20 5 FHBDRN Cc1ccc(-c2csc(Cn3cc([N+](=O)[O-])cc(Cl)c3=O)n2)cc1 ZINC000505570291 943050235 /nfs/dbraw/zinc/05/02/35/943050235.db2.gz HPVLJGMOPVAJBX-UHFFFAOYSA-N 0 0 361.810 3.890 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCC[C@@H](c3nc(C(F)(F)F)cs3)C2)cn1 ZINC000434942735 943057162 /nfs/dbraw/zinc/05/71/62/943057162.db2.gz LLQMYRFASSQEPN-SECBINFHSA-N 0 0 358.345 3.849 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N2CC3(CCC3)[C@H]2c2ccco2)c1F ZINC000412392302 943057340 /nfs/dbraw/zinc/05/73/40/943057340.db2.gz FJKXAHGEVNPMIP-GOSISDBHSA-N 0 0 374.368 3.632 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)NCC(C)(C)c2cccc(Cl)c2)c1[N+](=O)[O-] ZINC000434190586 943057585 /nfs/dbraw/zinc/05/75/85/943057585.db2.gz UMJBKNGETCRJGA-UHFFFAOYSA-N 0 0 364.833 3.802 20 5 FHBDRN Cc1ccc(NC(=O)N2CCC[C@H]2COc2cccnc2C)cc1[N+](=O)[O-] ZINC000416731320 943066724 /nfs/dbraw/zinc/06/67/24/943066724.db2.gz OGJXOMNTUBRHSB-INIZCTEOSA-N 0 0 370.409 3.682 20 5 FHBDRN Cn1c2ccccc2nc1[C@H]1CCCN1c1ncc(Cl)cc1[N+](=O)[O-] ZINC000434952096 943069743 /nfs/dbraw/zinc/06/97/43/943069743.db2.gz VKVHMVZYCVWPNJ-CQSZACIVSA-N 0 0 357.801 3.871 20 5 FHBDRN CCO[C@@H](C)c1nc(CN(C)c2ncc(Cl)cc2[N+](=O)[O-])cs1 ZINC000434953900 943070564 /nfs/dbraw/zinc/07/05/64/943070564.db2.gz DRNYYIUDYGLWRR-VIFPVBQESA-N 0 0 356.835 3.834 20 5 FHBDRN CCN(CCNC(=O)Nc1cc([N+](=O)[O-])ccc1OC)c1cccc(C)c1 ZINC000514511455 943072555 /nfs/dbraw/zinc/07/25/55/943072555.db2.gz PBSUTSQVRHVSKF-UHFFFAOYSA-N 0 0 372.425 3.560 20 5 FHBDRN Cc1nn(CCC(=O)N[C@H]2c3ccccc3CCC[C@@H]2C)c(C)c1[N+](=O)[O-] ZINC000183908587 943085867 /nfs/dbraw/zinc/08/58/67/943085867.db2.gz VKUGQNLRROMJLT-ORAYPTAESA-N 0 0 370.453 3.628 20 5 FHBDRN C[C@@H](Cn1ccc2ccccc21)C(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000505586762 943087367 /nfs/dbraw/zinc/08/73/67/943087367.db2.gz VMOSESVZEJZAKY-HNNXBMFYSA-N 0 0 351.406 3.844 20 5 FHBDRN C[C@@H](CCNC(=O)c1cc2c(cc1[N+](=O)[O-])OCCCO2)CC(C)(C)C ZINC001269250954 943094407 /nfs/dbraw/zinc/09/44/07/943094407.db2.gz LFKDBNADCGENIN-ZDUSSCGKSA-N 0 0 364.442 3.948 20 5 FHBDRN COC(=O)C[C@H]1CCC[C@@H](Oc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC001225660435 943108752 /nfs/dbraw/zinc/10/87/52/943108752.db2.gz DOHOARLXEYYSSJ-CMPLNLGQSA-N 0 0 372.215 3.858 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1OCC(=O)N(C)Cc1c(F)cccc1Cl ZINC000514561206 943110414 /nfs/dbraw/zinc/11/04/14/943110414.db2.gz NMRIPAYWQQXDCO-UHFFFAOYSA-N 0 0 366.776 3.733 20 5 FHBDRN COCCN(Cc1cccs1)C(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000514562714 943111944 /nfs/dbraw/zinc/11/19/44/943111944.db2.gz UYZJWIUUQQLGHK-UHFFFAOYSA-N 0 0 360.391 3.691 20 5 FHBDRN CCOc1cc(C(=O)O[C@@H]2CC(C)(C)OC2(C)C)c([N+](=O)[O-])cc1OC ZINC000783152749 943113723 /nfs/dbraw/zinc/11/37/23/943113723.db2.gz JKCYDSGVDWSNRP-OAHLLOKOSA-N 0 0 367.398 3.505 20 5 FHBDRN CNC(=O)c1ccc(N2CCC[C@@H]2/C=C\c2ccccc2)c([N+](=O)[O-])c1 ZINC000503294309 943114681 /nfs/dbraw/zinc/11/46/81/943114681.db2.gz DFMNJLFRAKBUHU-FPISAVPCSA-N 0 0 351.406 3.637 20 5 FHBDRN CNC(=O)c1ccc(N2CCC[C@H]2/C=C\c2ccccc2)c([N+](=O)[O-])c1 ZINC000503294308 943115028 /nfs/dbraw/zinc/11/50/28/943115028.db2.gz DFMNJLFRAKBUHU-CCCPALQASA-N 0 0 351.406 3.637 20 5 FHBDRN O=[N+]([O-])c1cc(F)ccc1C=Cc1nc(-c2nccc3[nH]ccc32)no1 ZINC000584581264 943118056 /nfs/dbraw/zinc/11/80/56/943118056.db2.gz JCVRZBAJYSLZAW-RQOWECAXSA-N 0 0 351.297 3.831 20 5 FHBDRN CCOC(=O)c1ccnc(N2CCC[C@@H]2/C=C/c2ccccc2)c1[N+](=O)[O-] ZINC000503316556 943120875 /nfs/dbraw/zinc/12/08/75/943120875.db2.gz MKUMVEJQYJTGNL-SIFUEBAJSA-N 0 0 367.405 3.849 20 5 FHBDRN O=[N+]([O-])c1cccc(F)c1COc1ccc(I)cc1 ZINC000505595237 943130943 /nfs/dbraw/zinc/13/09/43/943130943.db2.gz BYXBAGZTCXZVJN-UHFFFAOYSA-N 0 0 373.121 3.918 20 5 FHBDRN CC(C)[C@@H](CNC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F)c1ccccc1 ZINC000514629643 943161906 /nfs/dbraw/zinc/16/19/06/943161906.db2.gz UIUYMXPSZCRVTB-MRXNPFEDSA-N 0 0 362.376 3.972 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CCc2cccc(Cl)c2C1 ZINC000412426817 943162009 /nfs/dbraw/zinc/16/20/09/943162009.db2.gz ZORLDJUAOIGBCF-JKSUJKDBSA-N 0 0 356.809 3.937 20 5 FHBDRN Cn1cc([N+](=O)[O-])c(C(=O)N(Cc2ccccc2)[C@@H]2CCCC2(C)C)n1 ZINC000503418507 943174504 /nfs/dbraw/zinc/17/45/04/943174504.db2.gz BBABMDMZRWXCIC-MRXNPFEDSA-N 0 0 356.426 3.549 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC(c2ccncn2)CC1 ZINC000412430403 943177848 /nfs/dbraw/zinc/17/78/48/943177848.db2.gz QVGIZSFUEMWFHO-UHFFFAOYSA-N 0 0 372.450 3.517 20 5 FHBDRN COc1cc(C)c(Br)cc1NC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000183930313 943179990 /nfs/dbraw/zinc/17/99/90/943179990.db2.gz SCJIJZWTKSCDCU-UHFFFAOYSA-N 0 0 365.183 3.927 20 5 FHBDRN COc1ccc(-c2ccc(C[N@@H+]3C[C@@H](C(=O)[O-])CC[C@@H]3C)o2)c([N+](=O)[O-])c1 ZINC000422632703 943214216 /nfs/dbraw/zinc/21/42/16/943214216.db2.gz HNRKRHBJZBCSMU-STQMWFEESA-N 0 0 374.393 3.549 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@H](Oc3ccccc3Cl)C2)c1 ZINC000503509554 943217440 /nfs/dbraw/zinc/21/74/40/943217440.db2.gz OHSZFMSIAGWIQY-ZDUSSCGKSA-N 0 0 360.797 3.850 20 5 FHBDRN COc1cc2c(c(CNCc3ccc([N+](=O)[O-])cc3Cl)c1)O[C@@H](C)C2 ZINC000183809533 943221811 /nfs/dbraw/zinc/22/18/11/943221811.db2.gz UISBITDCAXWKHU-NSHDSACASA-N 0 0 362.813 3.870 20 5 FHBDRN C[C@@H]1CCC[C@@H](C)N(C(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000514700154 943231137 /nfs/dbraw/zinc/23/11/37/943231137.db2.gz UQYRBZJWYIEBMW-ZIAGYGMSSA-N 0 0 358.442 3.839 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)OCc1ccccc1C(N)=O ZINC000780356789 943233517 /nfs/dbraw/zinc/23/35/17/943233517.db2.gz ZODFRJMOSSQNHF-UHFFFAOYSA-N 0 0 374.418 3.553 20 5 FHBDRN COc1cc(CSc2nncn2-c2ccccc2C)c([N+](=O)[O-])cc1F ZINC000183823357 943235890 /nfs/dbraw/zinc/23/58/90/943235890.db2.gz AJXXCEFGNCTYNP-UHFFFAOYSA-N 0 0 374.397 3.924 20 5 FHBDRN O=C(Nc1ccc([C@H]2CCOC2)cc1)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000514714197 943242650 /nfs/dbraw/zinc/24/26/50/943242650.db2.gz ODSRCKSPGCENDF-INIZCTEOSA-N 0 0 367.405 3.689 20 5 FHBDRN C[C@@H](OC(=O)/C=C\Sc1ccccc1)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000214974670 943246457 /nfs/dbraw/zinc/24/64/57/943246457.db2.gz OCLJZRWTCCYLIE-YLGBQOPLSA-N 0 0 372.402 3.771 20 5 FHBDRN C[C@H](OC(=O)/C=C\Sc1ccccc1)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000214974618 943246727 /nfs/dbraw/zinc/24/67/27/943246727.db2.gz OCLJZRWTCCYLIE-HHQWOOOKSA-N 0 0 372.402 3.771 20 5 FHBDRN Cc1nccnc1CCNc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000514743771 943255674 /nfs/dbraw/zinc/25/56/74/943255674.db2.gz ZCIVLLLEXVWHHA-UHFFFAOYSA-N 0 0 362.389 3.579 20 5 FHBDRN C[C@H](C(=O)NCCCSc1ccccn1)c1ccc([N+](=O)[O-])cc1F ZINC000425300551 943260967 /nfs/dbraw/zinc/26/09/67/943260967.db2.gz UVJBBFHNZKLYNW-LBPRGKRZSA-N 0 0 363.414 3.531 20 5 FHBDRN Cc1cccc(OCCC(=O)N2CCCc3ccc([N+](=O)[O-])cc32)c1C ZINC000509968970 943261466 /nfs/dbraw/zinc/26/14/66/943261466.db2.gz GZQTXGLYZVTIGI-UHFFFAOYSA-N 0 0 354.406 3.960 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCC[C@H]2OCC[C@@H]21 ZINC000503571806 943268827 /nfs/dbraw/zinc/26/88/27/943268827.db2.gz BVHAQNDBVNHZBK-FVQBIDKESA-N 0 0 364.467 3.784 20 5 FHBDRN CC[C@H](NC(=O)N(C)CCc1cccc([N+](=O)[O-])c1)c1c(C)noc1C ZINC000511596469 943279099 /nfs/dbraw/zinc/27/90/99/943279099.db2.gz UMKVNUBYSZTBDF-INIZCTEOSA-N 0 0 360.414 3.535 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CCC[C@@H]1COc1cccnc1C ZINC000416998120 943281732 /nfs/dbraw/zinc/28/17/32/943281732.db2.gz PDZNICQTZURERE-MRXNPFEDSA-N 0 0 370.409 3.682 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])Nc1cc(F)c(F)cc1Br ZINC000435253555 943282648 /nfs/dbraw/zinc/28/26/48/943282648.db2.gz HRIKQNKWVXLMGU-UHFFFAOYSA-N 0 0 371.137 3.817 20 5 FHBDRN CC1=C[C@H](C)CN(C(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])C1 ZINC000435271833 943294381 /nfs/dbraw/zinc/29/43/81/943294381.db2.gz YRWWMJNVDVAEHG-JTQLQIEISA-N 0 0 358.316 3.574 20 5 FHBDRN Cc1c(Cl)cc(S(=O)(=O)N(C)CC2CCCCC2)cc1[N+](=O)[O-] ZINC000514779081 943297158 /nfs/dbraw/zinc/29/71/58/943297158.db2.gz YADNCKQDSDUARK-UHFFFAOYSA-N 0 0 360.863 3.757 20 5 FHBDRN COc1ccc([C@H](C)NC(=O)c2cc([N+](=O)[O-])ccc2C)c(C)c1OC ZINC000514809787 943307240 /nfs/dbraw/zinc/30/72/40/943307240.db2.gz KBDXTSDTEJODII-ZDUSSCGKSA-N 0 0 358.394 3.720 20 5 FHBDRN O=C(c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1)N1CCCO[C@@H](CF)C1 ZINC000412443872 943309500 /nfs/dbraw/zinc/30/95/00/943309500.db2.gz OIYGJVZBCKNIJA-INIZCTEOSA-N 0 0 373.384 3.539 20 5 FHBDRN O=C(c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1)N1CCCO[C@H](CF)C1 ZINC000412443873 943316728 /nfs/dbraw/zinc/31/67/28/943316728.db2.gz OIYGJVZBCKNIJA-MRXNPFEDSA-N 0 0 373.384 3.539 20 5 FHBDRN CCc1[nH]nc(C(=O)Nc2ccc(Nc3nc(C)cs3)cc2)c1[N+](=O)[O-] ZINC000514815693 943317642 /nfs/dbraw/zinc/31/76/42/943317642.db2.gz KEFUYBVWDFAKAK-UHFFFAOYSA-N 0 0 372.410 3.641 20 5 FHBDRN CS[C@H]1CCCCN(C(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000435300807 943320829 /nfs/dbraw/zinc/32/08/29/943320829.db2.gz URELBSSFMSVRGJ-ZDUSSCGKSA-N 0 0 372.874 3.761 20 5 FHBDRN Cc1c(NC(=O)NC2CCSCC2)cc(Br)cc1[N+](=O)[O-] ZINC000435322555 943322426 /nfs/dbraw/zinc/32/24/26/943322426.db2.gz DUIAQFNMMYOMFY-UHFFFAOYSA-N 0 0 374.260 3.683 20 5 FHBDRN Cc1c(NC(=O)NCCC2(C)CC2)cc(Br)cc1[N+](=O)[O-] ZINC000435323000 943323718 /nfs/dbraw/zinc/32/37/18/943323718.db2.gz IVTXNHHSJKOXBF-UHFFFAOYSA-N 0 0 356.220 3.977 20 5 FHBDRN Cc1c(NC(=O)NCCC(F)(F)F)cc(Br)cc1[N+](=O)[O-] ZINC000435324185 943323775 /nfs/dbraw/zinc/32/37/75/943323775.db2.gz TYRQUQNTQKRHSM-UHFFFAOYSA-N 0 0 370.125 3.740 20 5 FHBDRN Cc1c(NC(=O)N(C)[C@@H]2CC2(C)C)cc(Br)cc1[N+](=O)[O-] ZINC000435324994 943325712 /nfs/dbraw/zinc/32/57/12/943325712.db2.gz YHVMWLWTVQOXME-GFCCVEGCSA-N 0 0 356.220 3.928 20 5 FHBDRN COc1cc(C(=O)N[C@@H]2c3cc(C)ccc3C[C@H]2C)cc([N+](=O)[O-])c1OC ZINC000503669058 943330742 /nfs/dbraw/zinc/33/07/42/943330742.db2.gz DDNMQXKVZSYJHU-XIKOKIGWSA-N 0 0 370.405 3.584 20 5 FHBDRN Cc1c(NC(=O)NC[C@H]2CCSC2)cc(Br)cc1[N+](=O)[O-] ZINC000435328229 943332687 /nfs/dbraw/zinc/33/26/87/943332687.db2.gz KJMGORJHWPIIKZ-SECBINFHSA-N 0 0 374.260 3.540 20 5 FHBDRN O=C(CN1CC[C@@H]1c1ccc(Cl)cc1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000511602521 943337638 /nfs/dbraw/zinc/33/76/38/943337638.db2.gz BLFCPIHIMNINGF-QGZVFWFLSA-N 0 0 371.824 3.584 20 5 FHBDRN Cc1onc(-c2ccccc2)c1C(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000053215193 943350006 /nfs/dbraw/zinc/35/00/06/943350006.db2.gz HIMYTKHAJDKDRQ-UHFFFAOYSA-N 0 0 351.362 3.531 20 5 FHBDRN C[C@@H](C(=O)N1CCSC2(CCC2)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000412450418 943354821 /nfs/dbraw/zinc/35/48/21/943354821.db2.gz DWHCQMPWZUENBR-GFCCVEGCSA-N 0 0 352.431 3.726 20 5 FHBDRN O=C1c2ccccc2C(=O)N1Cc1cnc(-c2ccccc2[N+](=O)[O-])s1 ZINC000503753215 943359848 /nfs/dbraw/zinc/35/98/48/943359848.db2.gz WQOIPTXDVRVXQH-UHFFFAOYSA-N 0 0 365.370 3.515 20 5 FHBDRN CC(=O)Nc1ccc(-c2nc(-c3ccc([N+](=O)[O-])cc3C)no2)cc1F ZINC000514887075 943362975 /nfs/dbraw/zinc/36/29/75/943362975.db2.gz KDGGTIYBYQFKOM-UHFFFAOYSA-N 0 0 356.313 3.718 20 5 FHBDRN C[C@H](NC(=O)N1CCC(c2cccc(N)c2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000417138255 943365759 /nfs/dbraw/zinc/36/57/59/943365759.db2.gz NQFGAPMHCOYXPO-AWEZNQCLSA-N 0 0 368.437 3.827 20 5 FHBDRN CCCCC[C@@H]1CCCN1S(=O)(=O)CCc1ccc([N+](=O)[O-])cc1 ZINC000503782237 943366921 /nfs/dbraw/zinc/36/69/21/943366921.db2.gz CFVDZGZZAUGTNZ-MRXNPFEDSA-N 0 0 354.472 3.512 20 5 FHBDRN Cc1ccc(Sc2ccc(CN3CCC[C@@H]3C(N)=O)cc2[N+](=O)[O-])cc1 ZINC000505682235 943370564 /nfs/dbraw/zinc/37/05/64/943370564.db2.gz CNZRPGXETXXWJE-MRXNPFEDSA-N 0 0 371.462 3.504 20 5 FHBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1CCC[C@H]1/C=C\c1ccccc1 ZINC000503822287 943384323 /nfs/dbraw/zinc/38/43/23/943384323.db2.gz UFEGRIWFCYUYRK-QOHRORDFSA-N 0 0 372.446 3.770 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)c1ccc(-c2ccccc2F)o1 ZINC000053216054 943385814 /nfs/dbraw/zinc/38/58/14/943385814.db2.gz OYQDAFGIVSREBX-UHFFFAOYSA-N 0 0 354.337 3.966 20 5 FHBDRN Cc1cc(S(=O)(=O)N2CCC[C@H]2/C=C\c2ccccc2)ccc1[N+](=O)[O-] ZINC000503855798 943386112 /nfs/dbraw/zinc/38/61/12/943386112.db2.gz NTJWIWDAPIWYAK-IBSYWUHOSA-N 0 0 372.446 3.770 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)N1CCSC2(CCC2)CC1 ZINC000412451339 943398532 /nfs/dbraw/zinc/39/85/32/943398532.db2.gz JTWOYGQHPFVRGE-UHFFFAOYSA-N 0 0 363.483 3.675 20 5 FHBDRN CSc1ccc(C(=O)N2CCSC3(CCC3)CC2)cc1[N+](=O)[O-] ZINC000412455619 943398706 /nfs/dbraw/zinc/39/87/06/943398706.db2.gz UFTRDACAMKCWPW-UHFFFAOYSA-N 0 0 352.481 3.819 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])NCC1(c2ccc(F)cc2)CCC1 ZINC000503905598 943400489 /nfs/dbraw/zinc/40/04/89/943400489.db2.gz ZRTXTMZLEUPQCH-UHFFFAOYSA-N 0 0 372.396 3.741 20 5 FHBDRN CCOC(=O)C1CCC(CC(=O)N2c3ccc([N+](=O)[O-])cc3C[C@@H]2C)CC1 ZINC000514937643 943405770 /nfs/dbraw/zinc/40/57/70/943405770.db2.gz ADRSAVUHNAZIIN-NFOMZHRRSA-N 0 0 374.437 3.632 20 5 FHBDRN C[C@@H](N[C@H](Cn1ccccc1=O)c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000503926907 943412434 /nfs/dbraw/zinc/41/24/34/943412434.db2.gz IAHQFCOQDAWMSL-VQIMIIECSA-N 0 0 363.417 3.849 20 5 FHBDRN O=C1[C@@H](N2CC[C@H]2c2ccc(Cl)cc2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000511608986 943413031 /nfs/dbraw/zinc/41/30/31/943413031.db2.gz FEAZSLNULLREAI-ROUUACIJSA-N 0 0 371.824 3.801 20 5 FHBDRN O=C(Nc1cc2c(cc1Cl)CCC2=O)c1cc(F)c([N+](=O)[O-])cc1F ZINC000760018478 943443048 /nfs/dbraw/zinc/44/30/48/943443048.db2.gz WAIMUTMRBJOMFK-UHFFFAOYSA-N 0 0 366.707 3.908 20 5 FHBDRN COc1ccc(-c2noc([C@@H]3C[C@H]3c3ccc([N+](=O)[O-])cc3)n2)cc1OC ZINC000417219794 943447125 /nfs/dbraw/zinc/44/71/25/943447125.db2.gz JXJYABKANYRLEM-LSDHHAIUSA-N 0 0 367.361 3.933 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)OCCCOC2CCCC2)cc1SC ZINC000728771464 943463061 /nfs/dbraw/zinc/46/30/61/943463061.db2.gz IADOLERPGIIWDD-UHFFFAOYSA-N 0 0 369.439 3.831 20 5 FHBDRN O=C(NC[C@@H]1CCC[C@@H]1C1CC1)c1sc(Br)cc1[N+](=O)[O-] ZINC000412473367 943466983 /nfs/dbraw/zinc/46/69/83/943466983.db2.gz KDJKUDLTQABTHX-VHSXEESVSA-N 0 0 373.272 3.975 20 5 FHBDRN O=C(Nc1ccc(Br)c([N+](=O)[O-])c1)c1csc(Cl)n1 ZINC000692666160 943486698 /nfs/dbraw/zinc/48/66/98/943486698.db2.gz ZUSZLDNHLWULRN-UHFFFAOYSA-N 0 0 362.592 3.720 20 5 FHBDRN O=c1[nH]c(N[C@@H]2C[C@H]2c2cccc(Cl)c2)nc2ccc([N+](=O)[O-])cc12 ZINC000515080647 943489854 /nfs/dbraw/zinc/48/98/54/943489854.db2.gz RTWGRUTXMLVTPY-SWLSCSKDSA-N 0 0 356.769 3.865 20 5 FHBDRN CCNc1ccc(C(=O)NCCc2ccc(OC(C)C)cc2)cc1[N+](=O)[O-] ZINC000515072680 943498418 /nfs/dbraw/zinc/49/84/18/943498418.db2.gz VVOWQRWONIZILO-UHFFFAOYSA-N 0 0 371.437 3.786 20 5 FHBDRN Cc1ccncc1CN(C)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000431936768 943511680 /nfs/dbraw/zinc/51/16/80/943511680.db2.gz IRCLEUNTEIBAOU-UHFFFAOYSA-N 0 0 366.324 3.564 20 5 FHBDRN CCSc1cccc(NC(=O)c2cc(C(=O)OC)cc([N+](=O)[O-])c2)c1 ZINC000504140840 943511925 /nfs/dbraw/zinc/51/19/25/943511925.db2.gz CNEDYGYLRJADKJ-UHFFFAOYSA-N 0 0 360.391 3.746 20 5 FHBDRN Cc1ncc(CN(C)Cc2ccc(Br)cc2[N+](=O)[O-])s1 ZINC000425398509 943533596 /nfs/dbraw/zinc/53/35/96/943533596.db2.gz AQGZIVDWUGRRGL-UHFFFAOYSA-N 0 0 356.245 3.754 20 5 FHBDRN Cc1cc(N2C[C@H](C)O[C@@]3(CCO[C@H]3C)C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000515156627 943537409 /nfs/dbraw/zinc/53/74/09/943537409.db2.gz YYUMWPCWSISHFJ-MKBNYLNASA-N 0 0 374.359 3.695 20 5 FHBDRN COc1cccc(C(=O)Nc2cc(C)nn2-c2ccccc2C)c1[N+](=O)[O-] ZINC000435651402 943538184 /nfs/dbraw/zinc/53/81/84/943538184.db2.gz SJYVDEKWRSFREJ-UHFFFAOYSA-N 0 0 366.377 3.658 20 5 FHBDRN O=C(CSc1nncc2ccccc21)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000515185262 943541683 /nfs/dbraw/zinc/54/16/83/943541683.db2.gz RDKDNTJMUFJBOB-UHFFFAOYSA-N 0 0 374.809 3.922 20 5 FHBDRN CC(C)Oc1cccc(CC(=O)N2c3ccc([N+](=O)[O-])cc3C[C@@H]2C)c1 ZINC000504280110 943569976 /nfs/dbraw/zinc/56/99/76/943569976.db2.gz ONEDVWDYRSYQHS-AWEZNQCLSA-N 0 0 354.406 3.902 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1)N[C@H]1C[C@@H]1c1ccccc1OC(F)F ZINC000435726415 943570678 /nfs/dbraw/zinc/57/06/78/943570678.db2.gz PIGTZSKYOUSIRO-KGLIPLIRSA-N 0 0 363.320 3.874 20 5 FHBDRN COc1ccc(CNC(=O)C(C)(C)c2ccccc2Cl)cc1[N+](=O)[O-] ZINC000504311642 943586481 /nfs/dbraw/zinc/58/64/81/943586481.db2.gz PSEPNZMDGOGGCS-UHFFFAOYSA-N 0 0 362.813 3.851 20 5 FHBDRN CCCc1csc(NC(=O)COc2ccc([N+](=O)[O-])c3cccnc23)n1 ZINC000504311653 943586512 /nfs/dbraw/zinc/58/65/12/943586512.db2.gz PWDIXPNLSOYAHY-UHFFFAOYSA-N 0 0 372.406 3.570 20 5 FHBDRN COc1cc(C)c(NS(=O)(=O)c2cc([N+](=O)[O-])c(C)cc2C)cc1C ZINC000435734010 943587372 /nfs/dbraw/zinc/58/73/72/943587372.db2.gz XLYNVALTYQTPLJ-UHFFFAOYSA-N 0 0 364.423 3.638 20 5 FHBDRN CCOc1ccccc1CCC(=O)N1c2ccc([N+](=O)[O-])cc2C[C@@H]1C ZINC000504318420 943588560 /nfs/dbraw/zinc/58/85/60/943588560.db2.gz MJQRXVQUFWTIGT-AWEZNQCLSA-N 0 0 354.406 3.904 20 5 FHBDRN COC(=O)[C@H](C)c1ccc(NC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000417444568 943615489 /nfs/dbraw/zinc/61/54/89/943615489.db2.gz YPFDDOLTASZGEA-OLZOCXBDSA-N 0 0 371.393 3.754 20 5 FHBDRN CC(C)Oc1ccccc1CC(=O)N1c2ccc([N+](=O)[O-])cc2C[C@@H]1C ZINC000504400919 943616300 /nfs/dbraw/zinc/61/63/00/943616300.db2.gz HQPKOYRKNMFYLM-AWEZNQCLSA-N 0 0 354.406 3.902 20 5 FHBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)N(Cc1ccco1)Cc1ccco1 ZINC000126408074 943638287 /nfs/dbraw/zinc/63/82/87/943638287.db2.gz JZQPHHHHPSUWIZ-UHFFFAOYSA-N 0 0 369.377 3.735 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N[C@@](C)(c2ccccc2)C(F)(F)F)c1 ZINC000504570782 943686935 /nfs/dbraw/zinc/68/69/35/943686935.db2.gz NYJHENIUUYJYLV-INIZCTEOSA-N 0 0 368.311 3.811 20 5 FHBDRN Cc1ccc([C@@H](C)N2C(=O)N[C@@H](CC3CCCCC3)C2=O)cc1[N+](=O)[O-] ZINC000431954090 943703419 /nfs/dbraw/zinc/70/34/19/943703419.db2.gz OWEZOUBOUMPPBR-CJNGLKHVSA-N 0 0 359.426 3.855 20 5 FHBDRN Cc1cc(OC[C@@H](O)COc2ccc(F)cc2)c(Cl)cc1[N+](=O)[O-] ZINC000504673957 943739644 /nfs/dbraw/zinc/73/96/44/943739644.db2.gz SMCQSWMNMPZNCL-LBPRGKRZSA-N 0 0 355.749 3.514 20 5 FHBDRN COc1cc(C(=O)Nc2ccc(Nc3ccccc3)nc2)ccc1[N+](=O)[O-] ZINC000504677445 943740278 /nfs/dbraw/zinc/74/02/78/943740278.db2.gz PDDIUNSUTCGHMX-UHFFFAOYSA-N 0 0 364.361 3.994 20 5 FHBDRN CCSc1ccc([C@H](C)NC(=O)COc2cccc([N+](=O)[O-])c2)cc1 ZINC000504713804 943756344 /nfs/dbraw/zinc/75/63/44/943756344.db2.gz YUJAGSHCQQCONX-ZDUSSCGKSA-N 0 0 360.435 3.963 20 5 FHBDRN CN(c1ccccc1)c1ccc(C[NH2+][C@@H](CC2CC2)C(=O)[O-])cc1[N+](=O)[O-] ZINC000417615278 943765291 /nfs/dbraw/zinc/76/52/91/943765291.db2.gz CJMCNFYQTLSOQV-KRWDZBQOSA-N 0 0 369.421 3.706 20 5 FHBDRN CCCCO[C@H]1C[C@H](N(C)C(=O)c2cccc(OC)c2[N+](=O)[O-])C1(C)C ZINC000435818150 943774122 /nfs/dbraw/zinc/77/41/22/943774122.db2.gz LKVALOABUCQFTG-HOTGVXAUSA-N 0 0 364.442 3.659 20 5 FHBDRN COc1cccc(C(=O)N2CCc3c(F)cc(F)cc3[C@@H]2C)c1[N+](=O)[O-] ZINC000435808051 943782830 /nfs/dbraw/zinc/78/28/30/943782830.db2.gz KQHWXYZPSCNYIV-JTQLQIEISA-N 0 0 362.332 3.641 20 5 FHBDRN C[C@@H]1CCCN(C(=O)c2cc(F)cc3c(=O)c4cccc(F)c4[nH]c23)C1 ZINC000435814135 943787414 /nfs/dbraw/zinc/78/74/14/943787414.db2.gz QLZQJOHGHJJUQA-LLVKDONJSA-N 0 0 356.372 3.832 20 5 FHBDRN Cc1ccc2c(c1)CN(C(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1)CCO2 ZINC000584856855 943790658 /nfs/dbraw/zinc/79/06/58/943790658.db2.gz CYQXEODGLRZVMY-UHFFFAOYSA-N 0 0 354.406 3.602 20 5 FHBDRN Cc1csc(CCC(=O)N2CCS[C@H]2c2ccc([N+](=O)[O-])cc2)n1 ZINC000435820429 943793985 /nfs/dbraw/zinc/79/39/85/943793985.db2.gz XATOCZVKWAOAOV-INIZCTEOSA-N 0 0 363.464 3.567 20 5 FHBDRN C[C@H](NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1)[C@H]1OCCc2sccc21 ZINC000516885634 943795070 /nfs/dbraw/zinc/79/50/70/943795070.db2.gz YVVWMNQMUXWJCY-BJOHPYRUSA-N 0 0 366.826 3.742 20 5 FHBDRN C[C@@H](NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1)[C@H]1OCCc2sccc21 ZINC000516885636 943795243 /nfs/dbraw/zinc/79/52/43/943795243.db2.gz YVVWMNQMUXWJCY-RFAUZJTJSA-N 0 0 366.826 3.742 20 5 FHBDRN O=C(N[C@H]1C[C@H](c2cccc(Cl)c2)C1)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000437442498 943802362 /nfs/dbraw/zinc/80/23/62/943802362.db2.gz MVICFFFARQFSJZ-YEORSEQZSA-N 0 0 374.780 3.653 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NS(=O)(=O)CCc1ccc(Cl)cc1 ZINC000424215213 943802463 /nfs/dbraw/zinc/80/24/63/943802463.db2.gz ZIDXXHXQOHYSNO-UHFFFAOYSA-N 0 0 368.842 3.849 20 5 FHBDRN C[C@@H](NC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1)[C@@H]1Oc2ccccc2[C@@H]1C ZINC000437447961 943808737 /nfs/dbraw/zinc/80/87/37/943808737.db2.gz FKJCJJWDHOLJQB-WZFJYNIESA-N 0 0 369.421 3.908 20 5 FHBDRN COc1cccc(C(=O)N(C)c2cccc(OC(F)(F)F)c2)c1[N+](=O)[O-] ZINC000435863991 943813421 /nfs/dbraw/zinc/81/34/21/943813421.db2.gz ZKYQXSLMEHMDRX-UHFFFAOYSA-N 0 0 370.283 3.779 20 5 FHBDRN Cc1cccc(-c2noc(-c3cc([N+](=O)[O-])cc4c3OCCO4)n2)c1F ZINC000584867467 943826344 /nfs/dbraw/zinc/82/63/44/943826344.db2.gz LZHCERQNGWUQNR-UHFFFAOYSA-N 0 0 357.297 3.531 20 5 FHBDRN C[C@H](NC(=O)N1CCc2c(F)ccc(F)c2C1)c1cccc([N+](=O)[O-])c1 ZINC000437456090 943826503 /nfs/dbraw/zinc/82/65/03/943826503.db2.gz TZODIXNTVOXGLF-NSHDSACASA-N 0 0 361.348 3.702 20 5 FHBDRN COc1cccc(C(=O)N[C@H]2CC(C)(C)Oc3cc(F)ccc32)c1[N+](=O)[O-] ZINC000435906888 943837565 /nfs/dbraw/zinc/83/75/65/943837565.db2.gz IENSFNKINZKPOB-AWEZNQCLSA-N 0 0 374.368 3.775 20 5 FHBDRN CSc1ccc(CCNC(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)cc1 ZINC000437467868 943839330 /nfs/dbraw/zinc/83/93/30/943839330.db2.gz NVORZSIDMGBYBR-LBPRGKRZSA-N 0 0 362.426 3.918 20 5 FHBDRN Cn1ccnc1[C@H](N[C@@H]1C[C@]1(F)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000424317725 943840368 /nfs/dbraw/zinc/84/03/68/943840368.db2.gz GVNAWPDNVDIKGJ-GGPKGHCWSA-N 0 0 366.396 3.645 20 5 FHBDRN O=[N+]([O-])c1cc(F)cc(-c2nc(-c3ccc(N4CCCCC4)nc3)no2)c1 ZINC000504850841 943843021 /nfs/dbraw/zinc/84/30/21/943843021.db2.gz FBUPZPPBEQBBAW-UHFFFAOYSA-N 0 0 369.356 3.836 20 5 FHBDRN Cc1ccc(OCCCNC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)cc1 ZINC000504858362 943850218 /nfs/dbraw/zinc/85/02/18/943850218.db2.gz PGTHVUSQLWKUMS-UHFFFAOYSA-N 0 0 353.378 3.583 20 5 FHBDRN Cc1sc(C(=O)N[C@H]2C[C@H](c3cc(F)cc(F)c3)C2)cc1[N+](=O)[O-] ZINC000437503976 943850781 /nfs/dbraw/zinc/85/07/81/943850781.db2.gz YWHOHHHACPUUTD-MJHDQNEOSA-N 0 0 352.362 3.919 20 5 FHBDRN CSc1ccc(CCNC(=O)CCCNc2ccc([N+](=O)[O-])cc2)cc1 ZINC000437489838 943854463 /nfs/dbraw/zinc/85/44/63/943854463.db2.gz ADRSWMOZSUYDSH-UHFFFAOYSA-N 0 0 373.478 3.868 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)NC[C@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000437496266 943861829 /nfs/dbraw/zinc/86/18/29/943861829.db2.gz KNMHUMCWSOLWAL-UONOGXRCSA-N 0 0 373.375 3.805 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NCCCNc1ccccc1F ZINC000541488755 943865602 /nfs/dbraw/zinc/86/56/02/943865602.db2.gz LQMGPJGZOQSJMQ-UHFFFAOYSA-N 0 0 359.401 3.891 20 5 FHBDRN CCN(Cc1ccccn1)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425420260 943867595 /nfs/dbraw/zinc/86/75/95/943867595.db2.gz KVQDUEMNXYQMSY-UHFFFAOYSA-N 0 0 350.216 3.774 20 5 FHBDRN CN(CC1CCCCC1)C(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000515447428 943881290 /nfs/dbraw/zinc/88/12/90/943881290.db2.gz UFTLPJKZHOOHLN-UHFFFAOYSA-N 0 0 358.442 3.840 20 5 FHBDRN CC(C)(C(=O)N[C@@H]1[C@@H]2CCc3ccccc3[C@@H]21)c1ccc([N+](=O)[O-])cc1 ZINC000435966597 943891578 /nfs/dbraw/zinc/89/15/78/943891578.db2.gz PUVPOUJNCDLLFF-CEXWTWQISA-N 0 0 350.418 3.717 20 5 FHBDRN CCOc1ccc(OC)cc1N[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000105412401 943893752 /nfs/dbraw/zinc/89/37/52/943893752.db2.gz JLSHRPMJQISDNA-CYBMUJFWSA-N 0 0 373.409 3.750 20 5 FHBDRN CCOc1ccc(C(=O)N[C@H]2CCCOc3ccc(F)cc32)cc1[N+](=O)[O-] ZINC000053365638 943896142 /nfs/dbraw/zinc/89/61/42/943896142.db2.gz XNHKSFSFTYKYHV-HNNXBMFYSA-N 0 0 374.368 3.776 20 5 FHBDRN COc1ccc([C@H]2CCN(C(=O)CSc3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000504898202 943896562 /nfs/dbraw/zinc/89/65/62/943896562.db2.gz QJHWVYSJYYVQAA-HNNXBMFYSA-N 0 0 372.446 3.712 20 5 FHBDRN CCCOc1cccnc1-c1nc(Cc2cccc([N+](=O)[O-])c2C)no1 ZINC000516996126 943900686 /nfs/dbraw/zinc/90/06/86/943900686.db2.gz NSMYUQPPEJOZPZ-UHFFFAOYSA-N 0 0 354.366 3.728 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)NCc2ccc3c(c2)CCCN3)cc1[N+](=O)[O-] ZINC000417856738 943905972 /nfs/dbraw/zinc/90/59/72/943905972.db2.gz SNHRUEYSRBQCOL-AWEZNQCLSA-N 0 0 368.437 3.822 20 5 FHBDRN Cc1csc(Sc2ccc(C(=O)N3CC[C@@H](C)C3)cc2[N+](=O)[O-])n1 ZINC000504916200 943911888 /nfs/dbraw/zinc/91/18/88/943911888.db2.gz ZCWFSTXRUNHPCM-SNVBAGLBSA-N 0 0 363.464 3.993 20 5 FHBDRN CCc1c(NC(=O)c2cccc(OC)c2[N+](=O)[O-])cnn1-c1ccccc1 ZINC000435990111 943916290 /nfs/dbraw/zinc/91/62/90/943916290.db2.gz BTSNXIHNRJNONT-UHFFFAOYSA-N 0 0 366.377 3.604 20 5 FHBDRN O=C(N[C@H]1CCCOc2ccccc21)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000504944050 943921413 /nfs/dbraw/zinc/92/14/13/943921413.db2.gz QZTXOQBSHMLTKT-HNNXBMFYSA-N 0 0 352.346 3.985 20 5 FHBDRN CC1=C[C@@H](C)CN(C(=O)c2cccc3c(=O)c4cccc(F)c4[nH]c23)C1 ZINC000436011124 943927648 /nfs/dbraw/zinc/92/76/48/943927648.db2.gz NWQWYVIEFQKZLX-GFCCVEGCSA-N 0 0 350.393 3.859 20 5 FHBDRN CC1=C[C@H](C)CN(C(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)C1 ZINC000436003440 943934993 /nfs/dbraw/zinc/93/49/93/943934993.db2.gz LTDVILYVDKHQOB-HNNXBMFYSA-N 0 0 357.454 3.869 20 5 FHBDRN CCc1nn(C)c(Nc2cccc(COCc3ccco3)c2)c1[N+](=O)[O-] ZINC000517051776 943935723 /nfs/dbraw/zinc/93/57/23/943935723.db2.gz NOSSBQLWTINTND-UHFFFAOYSA-N 0 0 356.382 3.944 20 5 FHBDRN CC(C)COc1ncccc1C(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000437590518 943951870 /nfs/dbraw/zinc/95/18/70/943951870.db2.gz MZNLISQXCFLEAW-UHFFFAOYSA-N 0 0 369.421 3.829 20 5 FHBDRN COc1cc(/C=C/c2nc(-c3cccc([N+](=O)[O-])c3)no2)cc(OC)c1 ZINC000505002226 943955019 /nfs/dbraw/zinc/95/50/19/943955019.db2.gz FBXWOLCGOIODFN-VOTSOKGWSA-N 0 0 353.334 3.832 20 5 FHBDRN C[C@@H]1C[C@@H]1C(=O)Nc1ccc(-c2nc(-c3cccc([N+](=O)[O-])c3)no2)cc1 ZINC000504986626 943958004 /nfs/dbraw/zinc/95/80/04/943958004.db2.gz OGXNOGOZKWTFPN-BZNIZROVSA-N 0 0 364.361 3.906 20 5 FHBDRN Cc1c(C(=O)NCCc2ccc(OC(F)(F)F)cc2)cccc1[N+](=O)[O-] ZINC000500020581 943960211 /nfs/dbraw/zinc/96/02/11/943960211.db2.gz RDVCSADMIRQQKQ-UHFFFAOYSA-N 0 0 368.311 3.774 20 5 FHBDRN Cc1cc(Oc2ccc(Br)cc2[N+](=O)[O-])ncc1[N+](=O)[O-] ZINC000074766931 943962018 /nfs/dbraw/zinc/96/20/18/943962018.db2.gz ITBRYOWOPXVVDA-UHFFFAOYSA-N 0 0 354.116 3.761 20 5 FHBDRN Cc1nc(-c2ncccn2)sc1-c1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000505012409 943968989 /nfs/dbraw/zinc/96/89/89/943968989.db2.gz DJFSJISZAAMNET-UHFFFAOYSA-N 0 0 366.362 3.534 20 5 FHBDRN CCOc1cc(NC(=O)N2C[C@H](C)[C@@H](C)C2)c([N+](=O)[O-])cc1OCC ZINC000437613096 943971177 /nfs/dbraw/zinc/97/11/77/943971177.db2.gz ADLPIYPLLQBMRB-RYUDHWBXSA-N 0 0 351.403 3.512 20 5 FHBDRN CC(=O)c1cccc(O[C@H](C)c2nc(-c3cccc([N+](=O)[O-])c3)no2)c1 ZINC000505018806 943971353 /nfs/dbraw/zinc/97/13/53/943971353.db2.gz OPQINDBOCBFMDO-GFCCVEGCSA-N 0 0 353.334 3.987 20 5 FHBDRN Cc1cc(C)n(-c2ccc(-c3nc(-c4cccc([N+](=O)[O-])c4)no3)cn2)n1 ZINC000505018287 943972293 /nfs/dbraw/zinc/97/22/93/943972293.db2.gz IHLVYFBUNAYDJK-UHFFFAOYSA-N 0 0 362.349 3.509 20 5 FHBDRN CC(C)[C@@H](C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-])c1cccnc1 ZINC000436051772 943975271 /nfs/dbraw/zinc/97/52/71/943975271.db2.gz MWOGKRNLLWERAX-QGZVFWFLSA-N 0 0 361.829 3.742 20 5 FHBDRN CCC(CC)[C@@H](CCNC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)OC ZINC000437628180 943975800 /nfs/dbraw/zinc/97/58/00/943975800.db2.gz RJAZRFMBUKGDMW-GOSISDBHSA-N 0 0 363.458 3.504 20 5 FHBDRN CN(CCc1ccccc1)C(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000436063937 943984164 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Cc1noc(-c2ccc(C)c(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)c2)n1 ZINC000518285267 944235682 /nfs/dbraw/zinc/23/56/82/944235682.db2.gz JDYHJROUWYBECQ-UHFFFAOYSA-N 0 0 356.313 3.653 20 5 FHBDRN O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCC(Nc2ccc(F)cc2)CC1 ZINC000518286101 944236337 /nfs/dbraw/zinc/23/63/37/944236337.db2.gz FCLUDYPMGHXIRF-UHFFFAOYSA-N 0 0 361.348 3.590 20 5 FHBDRN COCCN(C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@H]1CCC[C@@H]1C ZINC000518287162 944237398 /nfs/dbraw/zinc/23/73/98/944237398.db2.gz VGVJOJFUDXXTID-NHYWBVRUSA-N 0 0 355.822 3.917 20 5 FHBDRN Cc1cc(C)cc([C@H]2CCN(S(=O)(=O)Cc3ccccc3[N+](=O)[O-])C2)c1 ZINC000546073415 944244187 /nfs/dbraw/zinc/24/41/87/944244187.db2.gz LKLXVPLGBNFNNU-INIZCTEOSA-N 0 0 374.462 3.531 20 5 FHBDRN CNc1ccc(C(=O)Nc2cc(OC)ccc2OC(C)C)cc1[N+](=O)[O-] ZINC000517367725 944249112 /nfs/dbraw/zinc/24/91/12/944249112.db2.gz HUOFFKBRCAFHEK-UHFFFAOYSA-N 0 0 359.382 3.685 20 5 FHBDRN CC[C@@H](C)[C@@H]([NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1)C(=O)[O-] ZINC000426662176 944252248 /nfs/dbraw/zinc/25/22/48/944252248.db2.gz WMFYUIYOKCDCBS-AUUYWEPGSA-N 0 0 371.437 3.952 20 5 FHBDRN O=c1cc(CNc2cc(C(F)(F)F)ncc2[N+](=O)[O-])c2ccccc2[nH]1 ZINC000436383510 944252545 /nfs/dbraw/zinc/25/25/45/944252545.db2.gz DMCGVFJLMVOGRX-UHFFFAOYSA-N 0 0 364.283 3.875 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N(C)C[C@@H]1CCCCO1 ZINC000505805359 944254741 /nfs/dbraw/zinc/25/47/41/944254741.db2.gz PJEUPXQLOJRBCH-AWEZNQCLSA-N 0 0 352.456 3.738 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N(C)C[C@H]1CCCCO1 ZINC000505805360 944255172 /nfs/dbraw/zinc/25/51/72/944255172.db2.gz PJEUPXQLOJRBCH-CQSZACIVSA-N 0 0 352.456 3.738 20 5 FHBDRN CC(C)(C)c1ccc(NCc2nc(CC(F)(F)F)no2)cc1[N+](=O)[O-] ZINC000517401563 944256174 /nfs/dbraw/zinc/25/61/74/944256174.db2.gz UGNCYXLSUZATAS-UHFFFAOYSA-N 0 0 358.320 3.992 20 5 FHBDRN CN(CCCOCc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1F ZINC000500206084 944262927 /nfs/dbraw/zinc/26/29/27/944262927.db2.gz PRHGRGYWWFTCBH-UHFFFAOYSA-N 0 0 361.373 3.805 20 5 FHBDRN C[C@H](Nc1cc(C(F)(F)F)ncc1[N+](=O)[O-])[C@@H]1COc2ccccc21 ZINC000436392038 944263048 /nfs/dbraw/zinc/26/30/48/944263048.db2.gz PUVSOOHLENCDTD-ONGXEEELSA-N 0 0 353.300 3.985 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2noc(CN3CCCc4cc(F)ccc43)n2)c1 ZINC000506168932 944264957 /nfs/dbraw/zinc/26/49/57/944264957.db2.gz RAEJGQHARITQGK-UHFFFAOYSA-N 0 0 354.341 3.737 20 5 FHBDRN C[C@@H](NC(=O)c1cc(F)ccc1Br)c1cccc([N+](=O)[O-])c1 ZINC000048383040 944265600 /nfs/dbraw/zinc/26/56/00/944265600.db2.gz LODSHWDZFROKLY-SECBINFHSA-N 0 0 367.174 3.987 20 5 FHBDRN CC(C)c1ccc(C[C@@H](C)NC(=O)COc2ccccc2[N+](=O)[O-])cc1 ZINC000500210148 944268262 /nfs/dbraw/zinc/26/82/62/944268262.db2.gz DXKQRYFTIIPJDG-OAHLLOKOSA-N 0 0 356.422 3.844 20 5 FHBDRN Cc1cccn2cc(CNc3cc(C(F)(F)F)ncc3[N+](=O)[O-])nc12 ZINC000436408068 944268916 /nfs/dbraw/zinc/26/89/16/944268916.db2.gz KOCUVPCOYHSWEX-UHFFFAOYSA-N 0 0 351.288 3.577 20 5 FHBDRN C[C@H](O)C[C@H](CNc1cc(C(F)(F)F)ncc1[N+](=O)[O-])c1ccccc1 ZINC000436394021 944270174 /nfs/dbraw/zinc/27/01/74/944270174.db2.gz VEHHOOOIFUZGIZ-WCQYABFASA-N 0 0 369.343 3.975 20 5 FHBDRN O=C(c1ccccc1)c1ccc(NCCOC(F)(F)F)c([N+](=O)[O-])c1 ZINC000473706540 944271770 /nfs/dbraw/zinc/27/17/70/944271770.db2.gz PXYGZSCBFXHNQQ-UHFFFAOYSA-N 0 0 354.284 3.774 20 5 FHBDRN Cc1nn(Cc2ccc(C(=O)N(C)C3CCCCC3)cc2)c(C)c1[N+](=O)[O-] ZINC000017356843 944282243 /nfs/dbraw/zinc/28/22/43/944282243.db2.gz SCYNYFLERWQLHS-UHFFFAOYSA-N 0 0 370.453 3.861 20 5 FHBDRN O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)NCc1ccccc1C(F)(F)F ZINC000517425123 944285675 /nfs/dbraw/zinc/28/56/75/944285675.db2.gz SLYUHXFTMOHXDO-UHFFFAOYSA-N 0 0 374.265 3.751 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1NC(=O)CN1Cc2ccccc2OC(C)(C)C1 ZINC000517429115 944289037 /nfs/dbraw/zinc/28/90/37/944289037.db2.gz MXJNWFXSYOCAHC-UHFFFAOYSA-N 0 0 369.421 3.515 20 5 FHBDRN C[C@H](Nc1ccc([N+](=O)[O-])c(OCc2ccccc2)n1)c1cccc(O)c1 ZINC000436422502 944295906 /nfs/dbraw/zinc/29/59/06/944295906.db2.gz MRGZISNOZATIAC-AWEZNQCLSA-N 0 0 365.389 3.869 20 5 FHBDRN COc1ccc(CNc2cc(C)c([N+](=O)[O-])cc2Br)nc1 ZINC000436431090 944301648 /nfs/dbraw/zinc/30/16/48/944301648.db2.gz KRWLADHLDVCMMD-UHFFFAOYSA-N 0 0 352.188 3.681 20 5 FHBDRN Cc1cc(C(=O)NCc2ccc3c(c2)nc(C2CC2)n3C)ccc1[N+](=O)[O-] ZINC000550160557 944303846 /nfs/dbraw/zinc/30/38/46/944303846.db2.gz RWPCSLKMZGKFFW-UHFFFAOYSA-N 0 0 364.405 3.597 20 5 FHBDRN Cc1cc(C)cc(OC[C@H](O)COc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000550153788 944307415 /nfs/dbraw/zinc/30/74/15/944307415.db2.gz YJTYEEHDFSWHHM-AWEZNQCLSA-N 0 0 351.786 3.684 20 5 FHBDRN Cc1sc(S(=O)(=O)N2CCC[C@H]2c2cccc(F)c2)cc1[N+](=O)[O-] ZINC000123251676 944310770 /nfs/dbraw/zinc/31/07/70/944310770.db2.gz IMFCXTKJCAQSPE-ZDUSSCGKSA-N 0 0 370.427 3.630 20 5 FHBDRN C[C@H]1CCN(C(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C[C@H]1C ZINC000426273826 944317668 /nfs/dbraw/zinc/31/76/68/944317668.db2.gz ABMAETVLTLYAMT-WDEREUQCSA-N 0 0 359.348 3.801 20 5 FHBDRN O=[N+]([O-])c1ccc(CSCc2nc(-c3ccc4c(c3)OCO4)no2)cc1 ZINC000105636370 944319951 /nfs/dbraw/zinc/31/99/51/944319951.db2.gz AOVWDKKSUGFIOR-UHFFFAOYSA-N 0 0 371.374 3.807 20 5 FHBDRN O=C(N[C@@H]1CCC[C@H]1OCc1ccccc1)c1ccc([N+](=O)[O-])cc1F ZINC000123266152 944322304 /nfs/dbraw/zinc/32/23/04/944322304.db2.gz RDQPCKJLZOFRBY-QZTJIDSGSA-N 0 0 358.369 3.602 20 5 FHBDRN CN(C(=O)CN1CCC[C@H]1/C=C/c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000505825148 944332088 /nfs/dbraw/zinc/33/20/88/944332088.db2.gz KGFKFIKRCDUBNY-YXBWYFRISA-N 0 0 365.433 3.735 20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])Nc1ccc(-c2csnn2)cc1 ZINC000517491112 944333329 /nfs/dbraw/zinc/33/33/29/944333329.db2.gz RROAXWGBXLDLFO-UHFFFAOYSA-N 0 0 369.406 3.554 20 5 FHBDRN Cc1cccc(CN(CC(C)C)C(=O)COc2ccccc2[N+](=O)[O-])c1 ZINC000500254520 944337362 /nfs/dbraw/zinc/33/73/62/944337362.db2.gz SCFJFTZPUYIPRE-UHFFFAOYSA-N 0 0 356.422 3.967 20 5 FHBDRN C[C@@H]1CC[C@@H](N(C)C(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C1 ZINC000426281879 944340791 /nfs/dbraw/zinc/34/07/91/944340791.db2.gz PGTYNEXSCGJZGU-ZWNOBZJWSA-N 0 0 359.348 3.944 20 5 FHBDRN O=C(NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N1CCCC12CCC2 ZINC000426280591 944344925 /nfs/dbraw/zinc/34/49/25/944344925.db2.gz MOODAJRLRLFDCY-UHFFFAOYSA-N 0 0 357.332 3.842 20 5 FHBDRN O=C(Nc1ccc(-c2nnc(-c3ccccc3)[nH]2)cc1)c1cc([N+](=O)[O-])c[nH]1 ZINC000438106912 944345302 /nfs/dbraw/zinc/34/53/02/944345302.db2.gz TXLZIMBOPLWTOT-UHFFFAOYSA-N 0 0 374.360 3.627 20 5 FHBDRN COc1ccc(CNC(=O)N2CCC[C@@H]2C2CCCCC2)cc1[N+](=O)[O-] ZINC000517499045 944345358 /nfs/dbraw/zinc/34/53/58/944345358.db2.gz QKQYLRDFHDFVHZ-MRXNPFEDSA-N 0 0 361.442 3.858 20 5 FHBDRN COc1cc(CN2CCc3[nH]c4ccccc4c3C2)c([N+](=O)[O-])cc1F ZINC000184255253 944345927 /nfs/dbraw/zinc/34/59/27/944345927.db2.gz ZMYZTTTXCBOJLG-UHFFFAOYSA-N 0 0 355.369 3.782 20 5 FHBDRN COc1cc(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)ccc1O ZINC000438109061 944347174 /nfs/dbraw/zinc/34/71/74/944347174.db2.gz IGAJHEWYMWSIBV-UHFFFAOYSA-N 0 0 374.396 3.508 20 5 FHBDRN COc1cc(CN(Cc2ccco2)C[C@@H]2CCCO2)c([N+](=O)[O-])cc1F ZINC000184251070 944349836 /nfs/dbraw/zinc/34/98/36/944349836.db2.gz RYEPEROVROTDJM-HNNXBMFYSA-N 0 0 364.373 3.517 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1OC[C@H](O)Cc1ccc(C(F)(F)F)cc1 ZINC000550178732 944354512 /nfs/dbraw/zinc/35/45/12/944354512.db2.gz NMWWMDUQPDKWIH-OAHLLOKOSA-N 0 0 355.312 3.904 20 5 FHBDRN Cc1c(CNC(=O)c2cnc3c(F)ccc(F)c3c2)cccc1[N+](=O)[O-] ZINC000506178629 944354966 /nfs/dbraw/zinc/35/49/66/944354966.db2.gz KLBDOWGUSOCYEW-UHFFFAOYSA-N 0 0 357.316 3.660 20 5 FHBDRN Nc1ccc(C(=O)N[C@H](Cc2ccccc2)c2ccccc2)cc1[N+](=O)[O-] ZINC000025283328 944362027 /nfs/dbraw/zinc/36/20/27/944362027.db2.gz IOGZGHARFHIHQE-LJQANCHMSA-N 0 0 361.401 3.891 20 5 FHBDRN C[C@H](NC(=O)c1c(Cl)cccc1[N+](=O)[O-])[C@@H]1Oc2ccccc2[C@@H]1C ZINC000438138952 944363186 /nfs/dbraw/zinc/36/31/86/944363186.db2.gz BUXZAKUNMPHHRB-PSVSLLHZSA-N 0 0 360.797 3.931 20 5 FHBDRN CC(C)(C(=O)NC[C@]1(C)CCOC2(CCC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000894663716 944369073 /nfs/dbraw/zinc/36/90/73/944369073.db2.gz OQEFHXIBIKLZBI-LJQANCHMSA-N 0 0 360.454 3.728 20 5 FHBDRN C[C@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl)[C@H]1Oc2ccccc2[C@H]1C ZINC000438159098 944371457 /nfs/dbraw/zinc/37/14/57/944371457.db2.gz SGNZQCNZULCERY-UFYHVXEKSA-N 0 0 374.824 3.860 20 5 FHBDRN O=[N+]([O-])c1cc(F)ccc1N[C@@H]1CCc2nnc(-c3ccc(F)cc3)n2C1 ZINC000505840973 944378183 /nfs/dbraw/zinc/37/81/83/944378183.db2.gz SQRMFOGVQCEMRW-CQSZACIVSA-N 0 0 371.347 3.558 20 5 FHBDRN COc1ccc(F)cc1C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000506498471 944383654 /nfs/dbraw/zinc/38/36/54/944383654.db2.gz DVVYZDLHFJAEFL-UHFFFAOYSA-N 0 0 356.256 3.596 20 5 FHBDRN COc1cccc(O[C@@H](C)CNC(=O)Nc2ccc([N+](=O)[O-])c(C)c2)c1 ZINC000473767608 944385284 /nfs/dbraw/zinc/38/52/84/944385284.db2.gz UGJUVVDTVKBOMG-ZDUSSCGKSA-N 0 0 359.382 3.501 20 5 FHBDRN CNC(=O)c1ccc(NCCOc2cccc3ccccc32)c([N+](=O)[O-])c1 ZINC000053574813 944386159 /nfs/dbraw/zinc/38/61/59/944386159.db2.gz ZOKOCBIXFFBKFC-UHFFFAOYSA-N 0 0 365.389 3.599 20 5 FHBDRN Cc1cc(NC(=O)N[C@H](c2ccccc2)[C@H]2CCOC2)ccc1[N+](=O)[O-] ZINC000473769008 944386945 /nfs/dbraw/zinc/38/69/45/944386945.db2.gz ZZDYOKHEWRQFGT-MAUKXSAKSA-N 0 0 355.394 3.803 20 5 FHBDRN CC(=O)c1cc(N[C@H](CO)c2cccc(Cl)c2F)ccc1[N+](=O)[O-] ZINC000578781234 944387475 /nfs/dbraw/zinc/38/74/75/944387475.db2.gz KZDUOHFIRRKORZ-CQSZACIVSA-N 0 0 352.749 3.735 20 5 FHBDRN O=C(COc1ccccc1[N+](=O)[O-])Nc1nc(-c2ccccc2F)cs1 ZINC000515977139 944389412 /nfs/dbraw/zinc/38/94/12/944389412.db2.gz OIFOEWJPOPQWFT-UHFFFAOYSA-N 0 0 373.365 3.875 20 5 FHBDRN CC(C)COc1ccccc1N[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000517557611 944390491 /nfs/dbraw/zinc/39/04/91/944390491.db2.gz OTKNPWFFJSBROD-SFHVURJKSA-N 0 0 369.421 3.847 20 5 FHBDRN Cc1oc(C2CC2)nc1C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000506500390 944391052 /nfs/dbraw/zinc/39/10/52/944391052.db2.gz UQQZNDIAAZZLNX-UHFFFAOYSA-N 0 0 353.281 3.622 20 5 FHBDRN CC[C@@H](NC(=O)Nc1ccc([N+](=O)[O-])c(C)c1)c1ccc2c(c1)OCCO2 ZINC000473765846 944393753 /nfs/dbraw/zinc/39/37/53/944393753.db2.gz PZCBVIVJUOSKRX-OAHLLOKOSA-N 0 0 371.393 3.947 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1C[C@@H](OC)Cc2ccccc21 ZINC000500279958 944396178 /nfs/dbraw/zinc/39/61/78/944396178.db2.gz LBZINSLJUGTLFS-LPHOPBHVSA-N 0 0 368.433 3.768 20 5 FHBDRN Cc1coc2ccc(NC(=O)N3CCC[C@@H](n4cc([N+](=O)[O-])cn4)C3)cc12 ZINC000364343690 944403548 /nfs/dbraw/zinc/40/35/48/944403548.db2.gz XHQUHRKKIDWQOJ-CQSZACIVSA-N 0 0 369.381 3.715 20 5 FHBDRN C[C@@H](c1cccc(Cl)c1)N(C)S(=O)(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000123739212 944407471 /nfs/dbraw/zinc/40/74/71/944407471.db2.gz QEXJGKCDKSLGCV-JTQLQIEISA-N 0 0 372.805 3.769 20 5 FHBDRN CCCCc1cc(=NC(=O)c2cc([N+](=O)[O-])ccc2SCCC)[nH][nH]1 ZINC000506189109 944411109 /nfs/dbraw/zinc/41/11/09/944411109.db2.gz KYKVUEMARYAZBN-UHFFFAOYSA-N 0 0 362.455 3.837 20 5 FHBDRN COc1ccc2ccccc2c1-c1cc(Cn2cc(C)c([N+](=O)[O-])n2)on1 ZINC000439188185 944411917 /nfs/dbraw/zinc/41/19/17/944411917.db2.gz PYDTWLVJJOHBNA-UHFFFAOYSA-N 0 0 364.361 3.965 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(C(=O)OCc2cnc(-c3ccccc3)s2)n1 ZINC001125936105 944417948 /nfs/dbraw/zinc/41/79/48/944417948.db2.gz PMXXLDNJCNOEHB-UHFFFAOYSA-N 0 0 355.375 3.779 20 5 FHBDRN CCN(C(=O)CCNc1ccccc1[N+](=O)[O-])[C@H](C)Cc1ccsc1 ZINC000426304143 944418908 /nfs/dbraw/zinc/41/89/08/944418908.db2.gz QDXRMJTTYAVETC-CQSZACIVSA-N 0 0 361.467 3.938 20 5 FHBDRN CO[C@H](C)C(=O)Nc1cccc(NC(=O)Nc2ccc([N+](=O)[O-])c(C)c2)c1 ZINC000473774379 944427250 /nfs/dbraw/zinc/42/72/50/944427250.db2.gz GMDCTDZOPYPEFG-GFCCVEGCSA-N 0 0 372.381 3.521 20 5 FHBDRN COC(=O)c1cc(-c2nc(-c3ccc(C)c(F)c3)no2)cc([N+](=O)[O-])c1 ZINC000517610016 944427444 /nfs/dbraw/zinc/42/74/44/944427444.db2.gz ZIFLDIKAJBFVIM-UHFFFAOYSA-N 0 0 357.297 3.546 20 5 FHBDRN COc1ccc(OCCOc2ccc(-c3nncs3)cc2)c([N+](=O)[O-])c1 ZINC000439201927 944430953 /nfs/dbraw/zinc/43/09/53/944430953.db2.gz UGRGLVHBNUOHEH-UHFFFAOYSA-N 0 0 373.390 3.580 20 5 FHBDRN CC(C)c1ccccc1OC[C@H](O)COc1cc(N(C)C)ccc1[N+](=O)[O-] ZINC000550205373 944431434 /nfs/dbraw/zinc/43/14/34/944431434.db2.gz JENAAKLQNJYIIX-INIZCTEOSA-N 0 0 374.437 3.603 20 5 FHBDRN C[C@H](NC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1)c1nccs1 ZINC000106002082 944432344 /nfs/dbraw/zinc/43/23/44/944432344.db2.gz XWBXFXNTMHXJAF-ZDUSSCGKSA-N 0 0 374.466 3.779 20 5 FHBDRN Cc1ccc(S(=O)(=O)N2CC[C@@H](C)C[C@@H]2c2ccco2)cc1[N+](=O)[O-] ZINC000439219585 944435014 /nfs/dbraw/zinc/43/50/14/944435014.db2.gz AROBBZZRAMJAOT-MLGOLLRUSA-N 0 0 364.423 3.658 20 5 FHBDRN Cc1c(Nc2cc3cc[nH]c3c([N+](=O)[O-])c2)c(=O)n(-c2ccccc2)n1C ZINC001167978029 944435141 /nfs/dbraw/zinc/43/51/41/944435141.db2.gz JHVBSJQEIPAWDZ-UHFFFAOYSA-N 0 0 363.377 3.618 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N2C[C@H](c3ccccc3)OC[C@@H]2C)c1 ZINC000110315562 944443896 /nfs/dbraw/zinc/44/38/96/944443896.db2.gz CDRXXKZREVLGPD-SCLBCKFNSA-N 0 0 372.446 3.919 20 5 FHBDRN CCOc1ccccc1[C@@H](CC)NC(=O)c1ccc([N+](=O)[O-])c(OC)c1 ZINC000505848843 944445617 /nfs/dbraw/zinc/44/56/17/944445617.db2.gz AGJPBXJKTKZWMI-OAHLLOKOSA-N 0 0 358.394 3.883 20 5 FHBDRN O=[N+]([O-])c1ccccc1CN(Cn1ncsc1=S)CC(F)(F)F ZINC000123857898 944453907 /nfs/dbraw/zinc/45/39/07/944453907.db2.gz GVFPHPPEBLLLIE-UHFFFAOYSA-N 0 0 364.374 3.604 20 5 FHBDRN COc1ccc([C@@H](OC)[C@H](C)NC(=O)Nc2ccc([N+](=O)[O-])c(C)c2)cc1 ZINC000473783638 944457960 /nfs/dbraw/zinc/45/79/60/944457960.db2.gz FBBVBDVHLPCCOI-UGSOOPFHSA-N 0 0 373.409 3.810 20 5 FHBDRN COc1ccc2c(c1)CCN(C(=O)Nc1cccc([N+](=O)[O-])c1C)CC2 ZINC000439236264 944466308 /nfs/dbraw/zinc/46/63/08/944466308.db2.gz KAXZDTNDVJLXLX-UHFFFAOYSA-N 0 0 355.394 3.545 20 5 FHBDRN CCN(C(=O)Cn1c2ccccc2c(=O)c2ccccc21)c1cccnc1C ZINC000439238101 944467877 /nfs/dbraw/zinc/46/78/77/944467877.db2.gz QGGVEWNIVHYBCN-UHFFFAOYSA-N 0 0 371.440 3.911 20 5 FHBDRN C[C@@H]1CCCC[C@H]1NC(=O)COc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000518522491 944468895 /nfs/dbraw/zinc/46/88/95/944468895.db2.gz ASZANGQCAJBBNY-ZWNOBZJWSA-N 0 0 360.332 3.687 20 5 FHBDRN O=C(NCCNc1ccc([N+](=O)[O-])cc1)c1ccc(C(F)(F)F)c(F)c1 ZINC000439242765 944472389 /nfs/dbraw/zinc/47/23/89/944472389.db2.gz APWZFRDKZVKGBU-UHFFFAOYSA-N 0 0 371.290 3.595 20 5 FHBDRN Cc1ccccc1NC(=O)[C@@H](C)OC(=O)CSc1ccccc1[N+](=O)[O-] ZINC000025062323 944478131 /nfs/dbraw/zinc/47/81/31/944478131.db2.gz QQUUJZAZABUXEY-CYBMUJFWSA-N 0 0 374.418 3.566 20 5 FHBDRN Cc1nc(-c2ccccc2)sc1[C@H](C)NC(=O)c1cc([N+](=O)[O-])cn1C ZINC000517657961 944483006 /nfs/dbraw/zinc/48/30/06/944483006.db2.gz QVWRMEMFLTWVLI-NSHDSACASA-N 0 0 370.434 3.856 20 5 FHBDRN COc1cc(COC(=O)c2nc(C)oc2-c2ccccc2)ccc1[N+](=O)[O-] ZINC000759832026 944483908 /nfs/dbraw/zinc/48/39/08/944483908.db2.gz QWWDVWFFDMTLDP-UHFFFAOYSA-N 0 0 368.345 3.924 20 5 FHBDRN Cc1c(F)ccc([N+](=O)[O-])c1C(=O)NCCCCOc1ccc(F)cc1 ZINC000843758521 944508521 /nfs/dbraw/zinc/50/85/21/944508521.db2.gz RYJMNVQJOBTZTK-UHFFFAOYSA-N 0 0 364.348 3.770 20 5 FHBDRN CCC(O)(CC)CCNC(=O)c1cc([N+](=O)[O-])ccc1SC(C)C ZINC000473053934 944509612 /nfs/dbraw/zinc/50/96/12/944509612.db2.gz CPYPXQBJWUIMAH-UHFFFAOYSA-N 0 0 354.472 3.766 20 5 FHBDRN CC(C)n1nc2c(c1NC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1)CCC2 ZINC000473800993 944523176 /nfs/dbraw/zinc/52/31/76/944523176.db2.gz AKRAOQJFFCRGQE-LBPRGKRZSA-N 0 0 357.414 3.744 20 5 FHBDRN COC(=O)c1cc(NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])cc2[nH]ccc21 ZINC000425989608 944534451 /nfs/dbraw/zinc/53/44/51/944534451.db2.gz UAJBNKDSYQOGAQ-UHFFFAOYSA-N 0 0 373.752 3.768 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])N1CCC[C@@H]1CCc1ccccc1 ZINC000518615429 944546142 /nfs/dbraw/zinc/54/61/42/944546142.db2.gz XGCNBOXYWVUKTH-GOSISDBHSA-N 0 0 368.433 3.988 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)NCc2c(OC)ccc3ccccc32)c1 ZINC000518621710 944552063 /nfs/dbraw/zinc/55/20/63/944552063.db2.gz LDPDXJNVQAQFJR-UHFFFAOYSA-N 0 0 366.373 3.695 20 5 FHBDRN COc1ccc(CSCC(=O)NCC(C)(C)C(C)C)cc1[N+](=O)[O-] ZINC000438386516 944553670 /nfs/dbraw/zinc/55/36/70/944553670.db2.gz IOAYSNAWXFRWGO-UHFFFAOYSA-N 0 0 354.472 3.635 20 5 FHBDRN O=C(NCc1cc(Cl)cc2c1OCC2)[C@@H]1C[C@H]1c1cccc([N+](=O)[O-])c1 ZINC001267966261 944561314 /nfs/dbraw/zinc/56/13/14/944561314.db2.gz AHEUZZSYXUXLCH-DLBZAZTESA-N 0 0 372.808 3.603 20 5 FHBDRN CC(C)(C)c1ccccc1NC(=O)COc1c(Cl)cncc1[N+](=O)[O-] ZINC000506554868 944561956 /nfs/dbraw/zinc/56/19/56/944561956.db2.gz KURQIHXOFSTRAR-UHFFFAOYSA-N 0 0 363.801 3.958 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CNc1cccc(Br)c1 ZINC000015288446 944564370 /nfs/dbraw/zinc/56/43/70/944564370.db2.gz FVHYUHDHUKTVJV-UHFFFAOYSA-N 0 0 364.199 3.716 20 5 FHBDRN CCOc1ccc(C(F)(F)F)cc1NC(=O)c1cc([N+](=O)[O-])cn1C ZINC000518654337 944579273 /nfs/dbraw/zinc/57/92/73/944579273.db2.gz VLHQUNPTGNSEMX-UHFFFAOYSA-N 0 0 357.288 3.603 20 5 FHBDRN O=c1ccc(C(F)(F)F)cn1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000517761603 944581169 /nfs/dbraw/zinc/58/11/69/944581169.db2.gz TUXLRISCCMLARY-UHFFFAOYSA-N 0 0 366.217 3.842 20 5 FHBDRN O=[N+]([O-])c1cc(-c2nc(Cc3ccccn3)no2)cc(C(F)(F)F)c1 ZINC000545546817 944583816 /nfs/dbraw/zinc/58/38/16/944583816.db2.gz HBDCGRRBMQLILR-UHFFFAOYSA-N 0 0 350.256 3.649 20 5 FHBDRN Cc1ncc(NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)c(C2CC2)n1 ZINC000439407911 944584233 /nfs/dbraw/zinc/58/42/33/944584233.db2.gz IJJZRTWPZKJAEB-UHFFFAOYSA-N 0 0 367.409 3.767 20 5 FHBDRN COc1ccccc1[C@]1(C)C[C@@H]1NC(=O)c1c(C)ccc([N+](=O)[O-])c1C ZINC001126466704 944586964 /nfs/dbraw/zinc/58/69/64/944586964.db2.gz QYNRXSKWBLDPOX-PXNSSMCTSA-N 0 0 354.406 3.680 20 5 FHBDRN COc1ccccc1[C@]1(C)C[C@H]1NC(=O)c1c(C)ccc([N+](=O)[O-])c1C ZINC001126466705 944587206 /nfs/dbraw/zinc/58/72/06/944587206.db2.gz QYNRXSKWBLDPOX-XLIONFOSSA-N 0 0 354.406 3.680 20 5 FHBDRN CC(C)(C)[C@@H]1CCCC[C@@H]1NS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000506223432 944588956 /nfs/dbraw/zinc/58/89/56/944588956.db2.gz LTCPOGHBIHNLMT-CVEARBPZSA-N 0 0 354.472 3.619 20 5 FHBDRN Cc1ncc(NC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)c(C2CC2)n1 ZINC000439401069 944589103 /nfs/dbraw/zinc/58/91/03/944589103.db2.gz CACDPYQGBRKYRM-UHFFFAOYSA-N 0 0 369.425 3.715 20 5 FHBDRN CC(C)(C)[C@@H]1CCCC[C@H]1NS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000506223434 944589260 /nfs/dbraw/zinc/58/92/60/944589260.db2.gz LTCPOGHBIHNLMT-HZPDHXFCSA-N 0 0 354.472 3.619 20 5 FHBDRN Cc1ccc(-c2ocnc2-c2nc(-c3ccc(N)c([N+](=O)[O-])c3)no2)cc1 ZINC000517779636 944602909 /nfs/dbraw/zinc/60/29/09/944602909.db2.gz COPDGBVWCJEGDK-UHFFFAOYSA-N 0 0 363.333 3.857 20 5 FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCCC[C@H]1C ZINC000133914301 944627782 /nfs/dbraw/zinc/62/77/82/944627782.db2.gz ITKKRASCQQOJOW-DOMZBBRYSA-N 0 0 352.456 3.642 20 5 FHBDRN C[C@@H]1Oc2cc(F)ccc2[C@H]1NC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000566698756 944632218 /nfs/dbraw/zinc/63/22/18/944632218.db2.gz OCBRPCCLJIISMW-GTNSWQLSSA-N 0 0 358.369 3.650 20 5 FHBDRN COc1ccc(C[C@@H](C)CNC(=O)c2cc([N+](=O)[O-])ccc2C)cc1OC ZINC000123705568 944651083 /nfs/dbraw/zinc/65/10/83/944651083.db2.gz YMXOSWRLKMUQLJ-CYBMUJFWSA-N 0 0 372.421 3.529 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@]1(O)CCCC(C)(C)C1 ZINC000438501737 944697926 /nfs/dbraw/zinc/69/79/26/944697926.db2.gz MFDYYSUDRKHWFA-SCLBCKFNSA-N 0 0 366.483 3.523 20 5 FHBDRN CN(CC1(CO)CC1)C(=O)c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1 ZINC000438511816 944700579 /nfs/dbraw/zinc/70/05/79/944700579.db2.gz WENADTREYSTMQO-UHFFFAOYSA-N 0 0 372.446 3.591 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H]2CCC[C@H](C(F)(F)F)C2)c1 ZINC000438512388 944702092 /nfs/dbraw/zinc/70/20/92/944702092.db2.gz XCYVAYGUANFEDV-MNOVXSKESA-N 0 0 360.332 3.702 20 5 FHBDRN O=C(c1cc2cccc([N+](=O)[O-])c2[nH]1)N1CCC[C@@H](Nc2ccccc2)C1 ZINC000426702354 944704413 /nfs/dbraw/zinc/70/44/13/944704413.db2.gz AQSZXSZASZNWRI-MRXNPFEDSA-N 0 0 364.405 3.793 20 5 FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCCCC(C)(C)C1 ZINC000438506946 944715572 /nfs/dbraw/zinc/71/55/72/944715572.db2.gz RXKQUNXTEFPQNW-UHFFFAOYSA-N 0 0 366.483 3.986 20 5 FHBDRN CSc1nc(N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc(C(F)F)n1 ZINC000516315184 944716321 /nfs/dbraw/zinc/71/63/21/944716321.db2.gz JCTINTBGJJGPIP-SECBINFHSA-N 0 0 354.382 3.948 20 5 FHBDRN CCOC(=O)c1ccnc(N[C@H]2CCCC[C@H]2SCC)c1[N+](=O)[O-] ZINC000426421515 944742614 /nfs/dbraw/zinc/74/26/14/944742614.db2.gz RRHBQVIBQPRRGA-QWHCGFSZSA-N 0 0 353.444 3.643 20 5 FHBDRN O=C([O-])[C@@H](Cc1cc(Cl)cc(Cl)c1)[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000426736062 944746129 /nfs/dbraw/zinc/74/61/29/944746129.db2.gz HWDUIWSJFAFDSF-OAHLLOKOSA-N 0 0 369.204 3.687 20 5 FHBDRN Cc1nc2ccc(CN3CCN(c4ccccc4[N+](=O)[O-])CC3)cc2s1 ZINC000426056149 944748951 /nfs/dbraw/zinc/74/89/51/944748951.db2.gz XUIZQTADLDBSAT-UHFFFAOYSA-N 0 0 368.462 3.835 20 5 FHBDRN O=C([O-])[C@H](Cc1cc(Cl)cc(Cl)c1)[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000426739388 944752500 /nfs/dbraw/zinc/75/25/00/944752500.db2.gz BYYDDGKFAHVRJJ-HNNXBMFYSA-N 0 0 369.204 3.687 20 5 FHBDRN Cc1ccc(N2CCN(C(=O)Nc3cc([N+](=O)[O-])ccc3C)CC2)cc1C ZINC000759890059 944754892 /nfs/dbraw/zinc/75/48/92/944754892.db2.gz KPLMCAKHAIFYJI-UHFFFAOYSA-N 0 0 368.437 3.874 20 5 FHBDRN CC(C)c1ccc(C[NH2+][C@@H](Cc2ccc(F)cc2)C(=O)[O-])cc1[N+](=O)[O-] ZINC000426743794 944757501 /nfs/dbraw/zinc/75/75/01/944757501.db2.gz BJDCHKOJNDUNQT-KRWDZBQOSA-N 0 0 360.385 3.643 20 5 FHBDRN CC[C@H](c1ccccc1)S(=O)(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000506925394 944757729 /nfs/dbraw/zinc/75/77/29/944757729.db2.gz IFJKIMAMFNQABC-MRXNPFEDSA-N 0 0 355.362 3.939 20 5 FHBDRN CN(C/C=C/c1ccccc1[N+](=O)[O-])CC(=O)Nc1cccc(Cl)c1 ZINC000506926988 944764685 /nfs/dbraw/zinc/76/46/85/944764685.db2.gz LIGWXKOACWOGPZ-FNORWQNLSA-N 0 0 359.813 3.832 20 5 FHBDRN O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCCc2cc(OC(F)F)ccc21 ZINC000518786948 944767818 /nfs/dbraw/zinc/76/78/18/944767818.db2.gz IETKNTHAJIXAAX-UHFFFAOYSA-N 0 0 366.295 3.928 20 5 FHBDRN C[C@]1(C(=O)[O-])CCCC[C@@H]1[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000426749824 944768778 /nfs/dbraw/zinc/76/87/78/944768778.db2.gz IUDQMBONDIBWIW-HKUYNNGSSA-N 0 0 358.394 3.978 20 5 FHBDRN C[C@H](Cc1ccccc1F)NC(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000054166738 944781939 /nfs/dbraw/zinc/78/19/39/944781939.db2.gz IROHJAAFFUFMCJ-OLZOCXBDSA-N 0 0 362.426 3.962 20 5 FHBDRN Cc1cccc(NC(=O)[C@H](C)OC(=O)CSc2ccc([N+](=O)[O-])cc2)c1 ZINC000004219403 944795114 /nfs/dbraw/zinc/79/51/14/944795114.db2.gz OTZJTEOOQJUIBI-ZDUSSCGKSA-N 0 0 374.418 3.566 20 5 FHBDRN CNc1ccc(C(=O)NC[C@H]2CCCO[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000140337205 944797051 /nfs/dbraw/zinc/79/70/51/944797051.db2.gz UBUWXIRFVJJPIX-APWZRJJASA-N 0 0 369.421 3.534 20 5 FHBDRN COc1cc(OC)cc(-c2noc(C(C)(C)c3ccccc3[N+](=O)[O-])n2)c1 ZINC000426438382 944809684 /nfs/dbraw/zinc/80/96/84/944809684.db2.gz DDHCTNDFXMSYAK-UHFFFAOYSA-N 0 0 369.377 3.988 20 5 FHBDRN Cc1cn2c(n1)[C@H](CNC(=O)c1cc3cc([N+](=O)[O-])ccc3s1)CCC2 ZINC000505903767 944812961 /nfs/dbraw/zinc/81/29/61/944812961.db2.gz KBCAJFCJZMWQCY-LBPRGKRZSA-N 0 0 370.434 3.622 20 5 FHBDRN O=C(NCCCc1cccc(C(F)(F)F)c1)c1ccccc1[N+](=O)[O-] ZINC000506972968 944818577 /nfs/dbraw/zinc/81/85/77/944818577.db2.gz OGANSSGDQCJINO-UHFFFAOYSA-N 0 0 352.312 3.976 20 5 FHBDRN C[C@H]1[C@@H](c2ccccc2)CCN1C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000126523611 944820133 /nfs/dbraw/zinc/82/01/33/944820133.db2.gz NOADTUYMIXXTQM-KXBFYZLASA-N 0 0 353.422 3.725 20 5 FHBDRN O=C([O-])[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1cc(Cl)cc(Cl)c1 ZINC000426803488 944825958 /nfs/dbraw/zinc/82/59/58/944825958.db2.gz MSLGEXLPFKHHMV-HNNXBMFYSA-N 0 0 369.204 3.687 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2nc(-c3ccc(O)cc3)no2)c(Br)c1 ZINC000436941113 944828291 /nfs/dbraw/zinc/82/82/91/944828291.db2.gz ORSMMVTWWZFIDX-UHFFFAOYSA-N 0 0 362.139 3.780 20 5 FHBDRN CC(C)c1cccc(O[C@@H](C)C(=O)NCCOc2ccc([N+](=O)[O-])cc2)c1 ZINC000518846798 944839060 /nfs/dbraw/zinc/83/90/60/944839060.db2.gz PTTOHSSZZWMWLT-HNNXBMFYSA-N 0 0 372.421 3.681 20 5 FHBDRN COc1ccc(CCC(=O)O[C@H](C)c2ccc([N+](=O)[O-])cc2)cc1OC ZINC000047176524 944851712 /nfs/dbraw/zinc/85/17/12/944851712.db2.gz NQGSNOHNOPXWDS-CYBMUJFWSA-N 0 0 359.378 3.849 20 5 FHBDRN COc1ccc([C@H]2C[C@H](NC(=O)c3c(C)cccc3[N+](=O)[O-])C2)cc1F ZINC000506302233 944856974 /nfs/dbraw/zinc/85/69/74/944856974.db2.gz SPFZTJWWVVVRMU-HDJSIYSDSA-N 0 0 358.369 3.727 20 5 FHBDRN O=C(N[C@H]1CCCc2occc21)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000120720608 944858896 /nfs/dbraw/zinc/85/88/96/944858896.db2.gz DTQJMJQVHVGPRG-INIZCTEOSA-N 0 0 355.394 3.939 20 5 FHBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NC1(Cc2ccccc2)CC1 ZINC000505910599 944859469 /nfs/dbraw/zinc/85/94/69/944859469.db2.gz AIJWBHXAQBKEEQ-ZDUSSCGKSA-N 0 0 374.824 3.907 20 5 FHBDRN Cc1n[nH]c(C(=O)N2CCC[C@H](CCCc3ccccc3)C2)c1[N+](=O)[O-] ZINC000439678140 944860173 /nfs/dbraw/zinc/86/01/73/944860173.db2.gz BLYHYEYIOFELSW-INIZCTEOSA-N 0 0 356.426 3.501 20 5 FHBDRN O=C(c1ccc2c(c1O)CCCC2)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000436975443 944865804 /nfs/dbraw/zinc/86/58/04/944865804.db2.gz AEAOYDLSEWFNSX-UHFFFAOYSA-N 0 0 366.417 3.984 20 5 FHBDRN COc1cnccc1[C@@H](C)NC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000438633105 944867068 /nfs/dbraw/zinc/86/70/68/944867068.db2.gz VFJDWKBNGFRRJL-CYBMUJFWSA-N 0 0 373.412 3.576 20 5 FHBDRN CNC(=O)c1ccc(N(C)CCc2cccc3ccccc32)c([N+](=O)[O-])c1 ZINC000507028284 944877285 /nfs/dbraw/zinc/87/72/85/944877285.db2.gz ULBDJAAXNMBKBT-UHFFFAOYSA-N 0 0 363.417 3.787 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)Nc1cc(Br)ccc1F ZINC000110649856 944882461 /nfs/dbraw/zinc/88/24/61/944882461.db2.gz VEGRNEOWYWFTCH-UHFFFAOYSA-N 0 0 369.146 3.757 20 5 FHBDRN CN(CC(=O)NCCc1cc2ccccc2s1)c1ccccc1[N+](=O)[O-] ZINC000506651678 944887412 /nfs/dbraw/zinc/88/74/12/944887412.db2.gz ARXNSRDYTHNINZ-UHFFFAOYSA-N 0 0 369.446 3.605 20 5 FHBDRN Cc1cccc(OC[C@H](C)Nc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)c1 ZINC000507023561 944890398 /nfs/dbraw/zinc/89/03/98/944890398.db2.gz WHDGSQITSHHYDV-ZDUSSCGKSA-N 0 0 355.394 3.667 20 5 FHBDRN Cc1nc2c(s1)CCC[C@H]2C(=O)N1CCCc2ccc([N+](=O)[O-])cc21 ZINC000426890979 944892884 /nfs/dbraw/zinc/89/28/84/944892884.db2.gz VMTNGJBSJMXILJ-CQSZACIVSA-N 0 0 357.435 3.759 20 5 FHBDRN CC(C)(C)OC(=O)[C@@H]1CCN(c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000426881087 944900430 /nfs/dbraw/zinc/90/04/30/944900430.db2.gz CJBKQVHMRRQDQQ-SNVBAGLBSA-N 0 0 371.231 3.525 20 5 FHBDRN CC(C)[C@H](Cc1ccc(F)cc1)NC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000437003925 944901750 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COc1c(Cl)cc(NC(=O)COc2ccccc2[N+](=O)[O-])cc1Cl ZINC000506329170 944932885 /nfs/dbraw/zinc/93/28/85/944932885.db2.gz PMHKJLGNFRQSSL-UHFFFAOYSA-N 0 0 371.176 3.928 20 5 FHBDRN CCc1cc(N2C[C@@H](C)OC(C)(C)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000518915435 944934938 /nfs/dbraw/zinc/93/49/38/944934938.db2.gz ZVSNCIIAKSEMPN-CYBMUJFWSA-N 0 0 356.426 3.618 20 5 FHBDRN CCN(c1cccc(C)c1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000511713460 944940113 /nfs/dbraw/zinc/94/01/13/944940113.db2.gz DXEWMRZZHASZEM-UHFFFAOYSA-N 0 0 354.815 3.772 20 5 FHBDRN CC[C@H](c1ccccc1OC)N(C)C(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-] ZINC000516505961 944941232 /nfs/dbraw/zinc/94/12/32/944941232.db2.gz PILZBNWLLZGJBE-CYBMUJFWSA-N 0 0 360.414 3.673 20 5 FHBDRN CC(C)c1ccccc1OCC(=O)N1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000518025917 944946191 /nfs/dbraw/zinc/94/61/91/944946191.db2.gz PRGYVNDHZVSZRF-UHFFFAOYSA-N 0 0 370.405 3.518 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1)C1(Cc2cccc(F)c2)CCOCC1 ZINC000432043848 944946580 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CCOc1ccc(C(=O)NCc2ccc(F)c(Cl)c2)cc1[N+](=O)[O-] ZINC000507117451 944964301 /nfs/dbraw/zinc/96/43/01/944964301.db2.gz FMWGHHSTGFPJEY-UHFFFAOYSA-N 0 0 352.749 3.716 20 5 FHBDRN CN(Cc1cccc2ccccc21)C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000516525126 944974407 /nfs/dbraw/zinc/97/44/07/944974407.db2.gz CNYXXHJVULTERX-UHFFFAOYSA-N 0 0 364.357 3.749 20 5 FHBDRN O=C(NCc1nc(C2CC2)cs1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000151201279 944978236 /nfs/dbraw/zinc/97/82/36/944978236.db2.gz CMWGHZXBMGASQT-UHFFFAOYSA-N 0 0 371.340 3.878 20 5 FHBDRN CC(C)OCc1ccccc1CNC(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000518963812 944981502 /nfs/dbraw/zinc/98/15/02/944981502.db2.gz MYFPTSIKWMFOFO-UHFFFAOYSA-N 0 0 371.437 3.638 20 5 FHBDRN COc1ccc(Cl)cc1NC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000124009064 944991720 /nfs/dbraw/zinc/99/17/20/944991720.db2.gz LQZKLUJSQWEEFF-UHFFFAOYSA-N 0 0 361.785 3.847 20 5 FHBDRN Cc1sc(S(=O)(=O)N(C)CCCCc2ccccc2)cc1[N+](=O)[O-] ZINC000467408708 945002534 /nfs/dbraw/zinc/00/25/34/945002534.db2.gz 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C[C@@H](Oc1ccccc1F)C(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000437116343 945038101 /nfs/dbraw/zinc/03/81/01/945038101.db2.gz IQHRZXNTSQMSFN-CYBMUJFWSA-N 0 0 358.369 3.692 20 5 FHBDRN O=C(NC1CC1)c1cc([N+](=O)[O-])ccc1N1CC[C@@H](c2cccc(F)c2)C1 ZINC000729471399 945039862 /nfs/dbraw/zinc/03/98/62/945039862.db2.gz XJWPJQQYXVLFII-CQSZACIVSA-N 0 0 369.396 3.620 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H](C)[C@H]1COc2ccccc21 ZINC000439867740 945042095 /nfs/dbraw/zinc/04/20/95/945042095.db2.gz BYBAGAQHADXBMQ-SWLSCSKDSA-N 0 0 371.393 3.680 20 5 FHBDRN C[C@@H](CNC(=O)CCNc1ccccc1[N+](=O)[O-])c1ccc(F)cc1F ZINC000437102334 945042129 /nfs/dbraw/zinc/04/21/29/945042129.db2.gz ZPSDPAQQCVWPHJ-LBPRGKRZSA-N 0 0 363.364 3.595 20 5 FHBDRN C[C@@H](C(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)c1c(F)cccc1F ZINC000516598986 945043078 /nfs/dbraw/zinc/04/30/78/945043078.db2.gz QRFSHWXUOAPQOU-LLVKDONJSA-N 0 0 373.359 3.817 20 5 FHBDRN Cc1cc(C(=O)Nc2ccc3nc(N(C)C)ccc3c2)ccc1[N+](=O)[O-] ZINC000519032168 945046364 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O=C(CCc1cccc([N+](=O)[O-])c1)NCCc1ccc(C(F)(F)F)cc1 ZINC000086994526 945369815 /nfs/dbraw/zinc/36/98/15/945369815.db2.gz VGOZHIKVFWHFPK-UHFFFAOYSA-N 0 0 366.339 3.905 20 5 FHBDRN Cc1nn(-c2ccccc2)cc1CNC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000181695452 945369752 /nfs/dbraw/zinc/36/97/52/945369752.db2.gz LJTLICCYTOQFHE-UHFFFAOYSA-N 0 0 370.796 3.672 20 5 FHBDRN O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@@H+]1CCCC[C@H]1c1ccc(F)cc1 ZINC000544146516 945373000 /nfs/dbraw/zinc/37/30/00/945373000.db2.gz RZVSXHZQGZKTKE-MSOLQXFVSA-N 0 0 374.412 3.701 20 5 FHBDRN CCc1c(NC(=O)CCOc2ccccc2[N+](=O)[O-])cnn1CCC(C)C ZINC000427434347 945374183 /nfs/dbraw/zinc/37/41/83/945374183.db2.gz IZCRGJCXSCWLSF-UHFFFAOYSA-N 0 0 374.441 3.807 20 5 FHBDRN Cc1cc(NC(=O)COc2ccccc2[N+](=O)[O-])ccc1C(F)(F)F ZINC000440299399 945386484 /nfs/dbraw/zinc/38/64/84/945386484.db2.gz VNMIJHWWBDDVQY-UHFFFAOYSA-N 0 0 354.284 3.940 20 5 FHBDRN COc1cc(C(=O)NCCc2cccc(Cl)c2Cl)ccc1[N+](=O)[O-] ZINC000511867132 945387461 /nfs/dbraw/zinc/38/74/61/945387461.db2.gz CKIXTORZCFVMGP-UHFFFAOYSA-N 0 0 369.204 3.883 20 5 FHBDRN O=[N+]([O-])c1ccc(OC[C@@H](O)CO[C@@H]2CCCc3ccccc32)c(F)c1 ZINC000153912892 945391007 /nfs/dbraw/zinc/39/10/07/945391007.db2.gz HBHMQUWKYJNCBE-MAUKXSAKSA-N 0 0 361.369 3.568 20 5 FHBDRN CCN(C(=O)c1ccc([N+](=O)[O-])cc1OC)[C@H](C)Cc1ccc(OC)cc1 ZINC000427457395 945396278 /nfs/dbraw/zinc/39/62/78/945396278.db2.gz UCZOGLIXWVBIPW-CQSZACIVSA-N 0 0 372.421 3.705 20 5 FHBDRN C[C@@H](NC(=O)CNc1ccccc1[N+](=O)[O-])c1nc(C(C)(C)C)cs1 ZINC000106797160 945403888 /nfs/dbraw/zinc/40/38/88/945403888.db2.gz AVIOJAMFLHSQQD-LLVKDONJSA-N 0 0 362.455 3.638 20 5 FHBDRN CCc1ccc(C(=O)N[C@H](c2nccs2)C(F)(F)F)cc1[N+](=O)[O-] ZINC000507641093 945408219 /nfs/dbraw/zinc/40/82/19/945408219.db2.gz PBMXQBJEOQIDGV-LLVKDONJSA-N 0 0 359.329 3.647 20 5 FHBDRN CSc1nnc(-c2noc(C(C)(C)c3ccccc3[N+](=O)[O-])n2)s1 ZINC000426640061 945449952 /nfs/dbraw/zinc/44/99/52/945449952.db2.gz QCMAAYDUHGJQIX-UHFFFAOYSA-N 0 0 363.424 3.544 20 5 FHBDRN O=[N+]([O-])c1ccc(CN2CC[C@H](c3ccccc3)S2(=O)=O)c(Cl)c1 ZINC000427511548 945452507 /nfs/dbraw/zinc/45/25/07/945452507.db2.gz KWTNEWOXAMCGBI-MRXNPFEDSA-N 0 0 366.826 3.525 20 5 FHBDRN COc1cc(C(=O)NCc2ccc(C3CCC3)cc2)c([N+](=O)[O-])cc1OC ZINC000427538085 945470110 /nfs/dbraw/zinc/47/01/10/945470110.db2.gz AEALAVZLCWWNNB-UHFFFAOYSA-N 0 0 370.405 3.810 20 5 FHBDRN C[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CC1(F)F ZINC000427543608 945474769 /nfs/dbraw/zinc/47/47/69/945474769.db2.gz NIYYAENPCRPRAS-MRVPVSSYSA-N 0 0 352.259 3.731 20 5 FHBDRN COc1cc(N[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)c(C)c(OC)c1 ZINC000507705164 945478399 /nfs/dbraw/zinc/47/83/99/945478399.db2.gz GUGOABMOMZAJDF-ZDUSSCGKSA-N 0 0 373.409 3.668 20 5 FHBDRN CN(C)c1ccccc1CNC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000438048022 945486183 /nfs/dbraw/zinc/48/61/83/945486183.db2.gz FUNBLZHAZMRITB-UHFFFAOYSA-N 0 0 367.327 3.610 20 5 FHBDRN C[C@H](c1ccc(F)cc1)[S@](=O)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000507713128 945487166 /nfs/dbraw/zinc/48/71/66/945487166.db2.gz HITPSODVRKJAIA-XELLLNAOSA-N 0 0 364.398 3.572 20 5 FHBDRN CC(C)CCO[C@@H]1CCCC[C@H]1NC(=O)c1ccc([N+](=O)[O-])cc1F ZINC000438047777 945487240 /nfs/dbraw/zinc/48/72/40/945487240.db2.gz JZPPOGDWWSYLBF-IAGOWNOFSA-N 0 0 352.406 3.838 20 5 FHBDRN Cc1ccc(OC2CCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)cc1 ZINC000519492568 945487352 /nfs/dbraw/zinc/48/73/52/945487352.db2.gz OYECWMFVVHYNGE-UHFFFAOYSA-N 0 0 352.394 3.827 20 5 FHBDRN C[C@@H](c1ccc(F)cc1)[S@@](=O)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000507713127 945487312 /nfs/dbraw/zinc/48/73/12/945487312.db2.gz HITPSODVRKJAIA-VDBVYFBLSA-N 0 0 364.398 3.572 20 5 FHBDRN Cc1cc([N+](=O)[O-])cnc1Oc1ccc(I)cc1 ZINC000052812147 945496966 /nfs/dbraw/zinc/49/69/66/945496966.db2.gz GWJFAWUWRWTUSV-UHFFFAOYSA-N 0 0 356.119 3.695 20 5 FHBDRN COc1cc(CNc2ccn(C)n2)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000151289235 945497733 /nfs/dbraw/zinc/49/77/33/945497733.db2.gz VUIWAMNDUZLYQA-UHFFFAOYSA-N 0 0 368.393 3.528 20 5 FHBDRN COc1ccc(NC(=O)Cc2cccc(Br)c2)cc1[N+](=O)[O-] ZINC000543852023 945498671 /nfs/dbraw/zinc/49/86/71/945498671.db2.gz HKCQWGYTILVBJL-UHFFFAOYSA-N 0 0 365.183 3.547 20 5 FHBDRN CC(C)(CNC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)c1ccccc1 ZINC000087035851 945502657 /nfs/dbraw/zinc/50/26/57/945502657.db2.gz BWCRSNJFPWLXJD-UHFFFAOYSA-N 0 0 353.422 3.640 20 5 FHBDRN O=[N+]([O-])c1cc2ccccc2nc1N1C[C@H]2CN(c3ccccc3)C[C@@H]2C1 ZINC000519503296 945506427 /nfs/dbraw/zinc/50/64/27/945506427.db2.gz YZAXAEGQSDIIAY-IAGOWNOFSA-N 0 0 360.417 3.716 20 5 FHBDRN C[C@H](C(=O)N[C@@H](c1ccccc1)[C@H]1CCCO1)c1ccc([N+](=O)[O-])cc1F ZINC000248600627 945520604 /nfs/dbraw/zinc/52/06/04/945520604.db2.gz UZXQASVTXSHSRR-BKTGTZMESA-N 0 0 372.396 3.874 20 5 FHBDRN C[C@@H](C(=O)Nc1nc(CN2CCCCC2)cs1)c1cccc([N+](=O)[O-])c1 ZINC000519517560 945522787 /nfs/dbraw/zinc/52/27/87/945522787.db2.gz LAMMUIKPJLYHPU-CYBMUJFWSA-N 0 0 374.466 3.779 20 5 FHBDRN Cc1cc(OCC(=O)N2CCSC3(CCCCC3)C2)ccc1[N+](=O)[O-] ZINC001149183560 945523327 /nfs/dbraw/zinc/52/33/27/945523327.db2.gz FSDXXUONGUVYMV-UHFFFAOYSA-N 0 0 364.467 3.560 20 5 FHBDRN Cc1cccc2c1CCN(CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-])C2 ZINC000729478014 945528867 /nfs/dbraw/zinc/52/88/67/945528867.db2.gz PHSPLXNPDYKVKP-UHFFFAOYSA-N 0 0 359.813 3.553 20 5 FHBDRN Cc1cccc2c1CC[C@@H]2NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1C ZINC000729442289 945543126 /nfs/dbraw/zinc/54/31/26/945543126.db2.gz MQPYAEGWGNCDJO-INIZCTEOSA-N 0 0 355.350 3.537 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1OC(=O)c1ccc(OC2CCOCC2)cc1 ZINC000760022230 945543137 /nfs/dbraw/zinc/54/31/37/945543137.db2.gz JKGYYRGDQTXCOF-UHFFFAOYSA-N 0 0 357.362 3.680 20 5 FHBDRN C[C@@H](C(=O)NCC1(O)CCC(C(C)(C)C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000519518608 945543823 /nfs/dbraw/zinc/54/38/23/945543823.db2.gz SOBFRZWLCSUSEN-PCVOSPCESA-N 0 0 362.470 3.782 20 5 FHBDRN COCc1cc([N+](=O)[O-])ccc1NC[C@@H](c1ccccc1)C(C)(C)CO ZINC000120794467 945546387 /nfs/dbraw/zinc/54/63/87/945546387.db2.gz SZPMFGJYDUTHTR-SFHVURJKSA-N 0 0 358.438 3.955 20 5 FHBDRN Cc1cc(-n2cccn2)ccc1NC(=O)[C@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1 ZINC001271234917 945552070 /nfs/dbraw/zinc/55/20/70/945552070.db2.gz HIBWJZIQRCZMPO-MSOLQXFVSA-N 0 0 362.389 3.831 20 5 FHBDRN Cc1c(F)ccc([N+](=O)[O-])c1C(=O)N1CCC([C@@H](O)c2ccccc2)CC1 ZINC000843763554 945552418 /nfs/dbraw/zinc/55/24/18/945552418.db2.gz KXDPKRAUTINUOX-IBGZPJMESA-N 0 0 372.396 3.628 20 5 FHBDRN O=C(CCCC1CCOCC1)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000281232660 945570060 /nfs/dbraw/zinc/57/00/60/945570060.db2.gz DVQJGVTUQLLUGJ-UHFFFAOYSA-N 0 0 354.834 3.504 20 5 FHBDRN COc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)cc1F ZINC000125084409 945575878 /nfs/dbraw/zinc/57/58/78/945575878.db2.gz FLJFIDXQPAOILD-UHFFFAOYSA-N 0 0 373.384 3.985 20 5 FHBDRN Cc1ccc(-c2noc(COC(=O)c3cc(Cl)ccc3[N+](=O)[O-])n2)cc1 ZINC000025112190 945579504 /nfs/dbraw/zinc/57/95/04/945579504.db2.gz AHZSNMKEUNFOKA-UHFFFAOYSA-N 0 0 373.752 3.964 20 5 FHBDRN CC(C)n1cc(Cl)c(NC(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)n1 ZINC000894880293 945589286 /nfs/dbraw/zinc/58/92/86/945589286.db2.gz FWBJPTFVKLFCBV-SECBINFHSA-N 0 0 354.769 3.907 20 5 FHBDRN O=[N+]([O-])c1ccccc1C1=NO[C@@H](c2nc([C@H]3CCC(F)(F)C3)no2)C1 ZINC000281357716 945606664 /nfs/dbraw/zinc/60/66/64/945606664.db2.gz LAOMKLWZOBJJNW-TVQRCGJNSA-N 0 0 364.308 3.746 20 5 FHBDRN O=C(CCc1ccc([N+](=O)[O-])cc1Cl)NC[C@@H]1OCCc2ccccc21 ZINC001126015137 945612860 /nfs/dbraw/zinc/61/28/60/945612860.db2.gz FRZIVPSIGZMWBW-SFHVURJKSA-N 0 0 374.824 3.611 20 5 FHBDRN C[C@@H]1C[C@H](C(=O)N(Cc2ccc([N+](=O)[O-])cc2)c2ccccc2)[C@@H](C)O1 ZINC001126493912 945627541 /nfs/dbraw/zinc/62/75/41/945627541.db2.gz WUEZHPHCAQIMTA-CLCXKQKWSA-N 0 0 354.406 3.942 20 5 FHBDRN CC(C)Cc1coc(NC(=O)c2ccc([N+](=O)[O-])cc2Br)n1 ZINC000894437078 945644478 /nfs/dbraw/zinc/64/44/78/945644478.db2.gz MXEOZYZHPDRJJW-UHFFFAOYSA-N 0 0 368.187 3.796 20 5 FHBDRN CCc1nn(C)c(CC)c1CNc1ccc([N+](=O)[O-])cc1OC(F)F ZINC000546181865 945670874 /nfs/dbraw/zinc/67/08/74/945670874.db2.gz KMHOJEYVLBNVTP-UHFFFAOYSA-N 0 0 354.357 3.667 20 5 FHBDRN CC[C@@H]1CN(C(=O)c2cccc3c(=O)c4ccccc4[nH]c23)CCCO1 ZINC000281541680 945679496 /nfs/dbraw/zinc/67/94/96/945679496.db2.gz JVZIZHBSUSXVMQ-CQSZACIVSA-N 0 0 350.418 3.735 20 5 FHBDRN CC[C@@H]1CCCN(C(=O)CSCc2ccc(OC)c([N+](=O)[O-])c2)CC1 ZINC000522691293 945679867 /nfs/dbraw/zinc/67/98/67/945679867.db2.gz SWRQEQJMJZZSOJ-CQSZACIVSA-N 0 0 366.483 3.875 20 5 FHBDRN Cc1csc([C@@H](C)NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)n1 ZINC000129391909 945692242 /nfs/dbraw/zinc/69/22/42/945692242.db2.gz HHDDANWHUMQKGW-MRVPVSSYSA-N 0 0 359.329 3.870 20 5 FHBDRN Cc1nn(CCC(=O)O[C@H](CC(C)C)c2ccccn2)c(C)c1[N+](=O)[O-] ZINC000125273336 945700388 /nfs/dbraw/zinc/70/03/88/945700388.db2.gz JDTNGHZTSNHVAU-MRXNPFEDSA-N 0 0 360.414 3.524 20 5 FHBDRN COCC[C@H](C)NC(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000522708842 945702315 /nfs/dbraw/zinc/70/23/15/945702315.db2.gz LTXVYPAXEKRTLB-ZDUSSCGKSA-N 0 0 359.382 3.934 20 5 FHBDRN C[C@@H]1CCC[C@H](CNC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)[C@H]1C ZINC001270811771 945705770 /nfs/dbraw/zinc/70/57/70/945705770.db2.gz IFENZTOPSAAJLW-QLFBSQMISA-N 0 0 356.426 3.583 20 5 FHBDRN CSCC[C@@H](N[C@@H](C)c1ccc([N+](=O)[O-])cc1)c1nnc2ccccn21 ZINC000164294727 945708859 /nfs/dbraw/zinc/70/88/59/945708859.db2.gz YDYWOJNFQQMSRB-XJKSGUPXSA-N 0 0 371.466 3.783 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N[C@@H]2CC[C@H](c3ccc(F)cc3)C2)c1[N+](=O)[O-] ZINC000473648496 945724145 /nfs/dbraw/zinc/72/41/45/945724145.db2.gz NCQZYJKSYFRMGK-GXTWGEPZSA-N 0 0 360.389 3.647 20 5 FHBDRN CC(C)(C)OC(=O)C1(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)CCCC1 ZINC000522727324 945724671 /nfs/dbraw/zinc/72/46/71/945724671.db2.gz FXMFFRZACYAADS-UHFFFAOYSA-N 0 0 368.817 3.633 20 5 FHBDRN O=C(COC(=O)C1(c2ccc(F)cc2)CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000140917668 945726961 /nfs/dbraw/zinc/72/69/61/945726961.db2.gz LPQGLYIAEZUMAF-UHFFFAOYSA-N 0 0 371.364 3.972 20 5 FHBDRN C[C@@H](COc1cccc(F)c1)NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000522744726 945740453 /nfs/dbraw/zinc/74/04/53/945740453.db2.gz JPZILJGTLTZNSA-NSHDSACASA-N 0 0 366.776 3.514 20 5 FHBDRN Cc1cccc(C(=O)Nc2cc(C(N)=O)c(Cl)cc2Cl)c1[N+](=O)[O-] ZINC000550084553 945741773 /nfs/dbraw/zinc/74/17/73/945741773.db2.gz XLPYIBWNIDGIGJ-UHFFFAOYSA-N 0 0 368.176 3.561 20 5 FHBDRN CC[C@](C)(NC(=O)CCOc1cc(C)ccc1[N+](=O)[O-])c1nccs1 ZINC000281610349 945786818 /nfs/dbraw/zinc/78/68/18/945786818.db2.gz PEELLHWKYIEZCV-KRWDZBQOSA-N 0 0 363.439 3.570 20 5 FHBDRN COc1ccc(Cc2nc(-c3ccc4onc(C)c4c3)no2)c([N+](=O)[O-])c1 ZINC001211851933 945799423 /nfs/dbraw/zinc/79/94/23/945799423.db2.gz MHZHLKKWSYPUQL-UHFFFAOYSA-N 0 0 366.333 3.694 20 5 FHBDRN C[C@H](Nc1ccc(Cl)c(N2CCNC2=O)c1)c1cccc([N+](=O)[O-])c1 ZINC000467401858 945804900 /nfs/dbraw/zinc/80/49/00/945804900.db2.gz BIEFMGQHHAQMCF-NSHDSACASA-N 0 0 360.801 3.951 20 5 FHBDRN Cc1noc(C)c1C(C)(C)C(=O)Nc1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000281698964 945816382 /nfs/dbraw/zinc/81/63/82/945816382.db2.gz PLSMWCDCKBKDTI-UHFFFAOYSA-N 0 0 354.366 3.664 20 5 FHBDRN COCCOc1ccccc1-c1nc(Cc2cccc([N+](=O)[O-])c2C)no1 ZINC000519848440 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C[C@@H](CNC(=O)N1CCC2(CC2(F)F)CC1)c1ccccc1[N+](=O)[O-] ZINC000897052975 946538809 /nfs/dbraw/zinc/53/88/09/946538809.db2.gz PHFIYUSPRDAWGW-LBPRGKRZSA-N 0 0 353.369 3.529 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NCC(=O)N(C)Cc1ccc(Cl)s1 ZINC000475163783 946541016 /nfs/dbraw/zinc/54/10/16/946541016.db2.gz NWASUBNFPULJCJ-UHFFFAOYSA-N 0 0 367.858 3.997 20 5 FHBDRN CSc1cccc(C(=O)N2CCC(OCCC(C)C)CC2)c1[N+](=O)[O-] ZINC000186160063 946542214 /nfs/dbraw/zinc/54/22/14/946542214.db2.gz RXIGXSREOJYIHE-UHFFFAOYSA-N 0 0 366.483 3.984 20 5 FHBDRN CCN(C(=O)NC[C@@H](C)c1ccccc1[N+](=O)[O-])[C@@H]1CCOC(C)(C)C1 ZINC000897058768 946545857 /nfs/dbraw/zinc/54/58/57/946545857.db2.gz RZZGDZUARGUPJP-HUUCEWRRSA-N 0 0 363.458 3.687 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1CNc1cccc(-n2cc(C)[nH]c2=O)c1 ZINC000475514578 946549055 /nfs/dbraw/zinc/54/90/55/946549055.db2.gz RAISFKGYFOYOQN-UHFFFAOYSA-N 0 0 368.393 3.805 20 5 FHBDRN C[C@@H](CNC(=O)N1CCC[C@@H](C(F)(F)F)C1)c1ccccc1[N+](=O)[O-] ZINC000897049729 946549289 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CCOCCC1(CNC(=O)c2ccc(Cl)cc2[N+](=O)[O-])CCCC1 ZINC000121259966 946585054 /nfs/dbraw/zinc/58/50/54/946585054.db2.gz PBAMVVVRLQWKSW-UHFFFAOYSA-N 0 0 354.834 3.965 20 5 FHBDRN Cc1cc(C(=O)N2CCO[C@@H](c3cccc(Cl)c3)C2)cc([N+](=O)[O-])c1 ZINC000186187888 946588123 /nfs/dbraw/zinc/58/81/23/946588123.db2.gz AIQYNQBDNQKRNM-QGZVFWFLSA-N 0 0 360.797 3.770 20 5 FHBDRN COc1c(C(=O)Nc2cccc(COCC3CC3)c2)cccc1[N+](=O)[O-] ZINC000475189159 946588650 /nfs/dbraw/zinc/58/86/50/946588650.db2.gz HLFZEKGFMLUOTJ-UHFFFAOYSA-N 0 0 356.378 3.782 20 5 FHBDRN COc1cc(OC)c(CN[C@@H](C)c2cccc([N+](=O)[O-])c2C)c(OC)c1 ZINC000164416355 946597494 /nfs/dbraw/zinc/59/74/94/946597494.db2.gz YKUYZOVMLZBAON-ZDUSSCGKSA-N 0 0 360.410 3.780 20 5 FHBDRN COCC(=O)N1CCc2c1cccc2N[C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000186588161 946605097 /nfs/dbraw/zinc/60/50/97/946605097.db2.gz QLEALPZPOPBEAJ-AWEZNQCLSA-N 0 0 369.421 3.612 20 5 FHBDRN C[C@@H](Cc1ccccc1)C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2 ZINC000112002515 946608418 /nfs/dbraw/zinc/60/84/18/946608418.db2.gz VBVYVFVMEQUZAM-ZDUSSCGKSA-N 0 0 356.378 3.573 20 5 FHBDRN Cc1ccccc1[C@H]1C[C@H](C)N(C(=O)COc2ccc([N+](=O)[O-])cc2)C1 ZINC000523099289 946611207 /nfs/dbraw/zinc/61/12/07/946611207.db2.gz OYXYXQDHMZAHCQ-HOTGVXAUSA-N 0 0 354.406 3.687 20 5 FHBDRN C[C@H]1CCCN(c2ccc(-c3nc(-c4ccon4)no3)cc2[N+](=O)[O-])C1 ZINC000545779350 946620940 /nfs/dbraw/zinc/62/09/40/946620940.db2.gz LCAHBUYEBVDHPF-NSHDSACASA-N 0 0 355.354 3.536 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]cc(Cc3noc(/C=C/c4cncc(F)c4)n3)c2c1 ZINC000545780667 946626598 /nfs/dbraw/zinc/62/65/98/946626598.db2.gz LKGZNPKISYCEGE-DAFODLJHSA-N 0 0 365.324 3.754 20 5 FHBDRN CC[C@@H](NS(=O)(=O)Cc1cccc([N+](=O)[O-])c1)c1cccc(Cl)c1 ZINC000151781804 946640601 /nfs/dbraw/zinc/64/06/01/946640601.db2.gz SAAHOXNKUJDLOP-MRXNPFEDSA-N 0 0 368.842 3.819 20 5 FHBDRN O=C(NC1CC1)c1ccc(N2CC[C@@H](c3cccc(F)c3)C2)c([N+](=O)[O-])c1 ZINC000567401105 946644730 /nfs/dbraw/zinc/64/47/30/946644730.db2.gz LNQCKQJKKTXCDP-OAHLLOKOSA-N 0 0 369.396 3.620 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)NCCCOc1ccc2ccccc2c1 ZINC000475558356 946647082 /nfs/dbraw/zinc/64/70/82/946647082.db2.gz FNPXLFWFUNGDBZ-UHFFFAOYSA-N 0 0 364.401 3.876 20 5 FHBDRN Cc1nc2nc(Sc3ccc4ncccc4c3[N+](=O)[O-])nn2c(C)c1C ZINC000112075199 946656088 /nfs/dbraw/zinc/65/60/88/946656088.db2.gz RBMJIJSPPYLJHF-UHFFFAOYSA-N 0 0 366.406 3.657 20 5 FHBDRN CC(C)(C)OC(=O)N[C@@H]1CCCN(c2ccc3ncccc3c2[N+](=O)[O-])C1 ZINC000112075433 946656576 /nfs/dbraw/zinc/65/65/76/946656576.db2.gz IYMRMUIBHDFFPR-CYBMUJFWSA-N 0 0 372.425 3.637 20 5 FHBDRN O=C1[C@H](Nc2ccc([N+](=O)[O-])nc2)CCN1c1ccc(Cl)cc1Cl ZINC000473911956 946657531 /nfs/dbraw/zinc/65/75/31/946657531.db2.gz RLPPBOAOZZBTQS-GFCCVEGCSA-N 0 0 367.192 3.514 20 5 FHBDRN C[C@@H]1C[C@@H](CNC(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CCO1 ZINC000475192368 946661024 /nfs/dbraw/zinc/66/10/24/946661024.db2.gz MPKJTJKUIPUPOF-ZJUUUORDSA-N 0 0 361.320 3.550 20 5 FHBDRN COc1cc(NC(=O)NCc2ccccc2[N+](=O)[O-])ccc1OC(C)C ZINC000186261868 946669004 /nfs/dbraw/zinc/66/90/04/946669004.db2.gz BSQKZBMIONZGAF-UHFFFAOYSA-N 0 0 359.382 3.712 20 5 FHBDRN CCc1noc(CC)c1Cc1nc(Cc2ccc([N+](=O)[O-])c(C)c2)no1 ZINC000545852959 946669995 /nfs/dbraw/zinc/66/99/95/946669995.db2.gz SIVZQNCRVUGLPD-UHFFFAOYSA-N 0 0 356.382 3.581 20 5 FHBDRN CO[C@@H]1CCCC[C@@H]1NC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000475195953 946682445 /nfs/dbraw/zinc/68/24/45/946682445.db2.gz ORTUJJGAWIVBJB-WCQYABFASA-N 0 0 361.320 3.693 20 5 FHBDRN CCS[C@@H]1CCCCN(C(=O)Nc2cc([N+](=O)[O-])ccc2OC)C1 ZINC000112120459 946688949 /nfs/dbraw/zinc/68/89/49/946688949.db2.gz NGHWUSXTKIDFPQ-CYBMUJFWSA-N 0 0 353.444 3.743 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])NC[C@@H](c1ccccc1)C(F)(F)F ZINC000186607215 946692026 /nfs/dbraw/zinc/69/20/26/946692026.db2.gz WHDAUKSHAMAYAT-AWEZNQCLSA-N 0 0 367.327 3.740 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](c1cccc(F)c1)c1ccccn1 ZINC000121430265 946705254 /nfs/dbraw/zinc/70/52/54/946705254.db2.gz SFVLIXIKMHHCSF-LJQANCHMSA-N 0 0 365.364 3.957 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(NC(=O)CC(C)C)cc2)c1 ZINC000067544531 946707578 /nfs/dbraw/zinc/70/75/78/946707578.db2.gz FHMNKNCHZAJNSD-UHFFFAOYSA-N 0 0 371.393 3.840 20 5 FHBDRN CCOc1cc2c(cc1NC(=O)c1cc(OC)ccc1[N+](=O)[O-])O[C@@H](C)C2 ZINC000067542720 946708149 /nfs/dbraw/zinc/70/81/49/946708149.db2.gz UOZDLXUULSFBTC-NSHDSACASA-N 0 0 372.377 3.578 20 5 FHBDRN O=C(Nc1cc([N+](=O)[O-])ccc1F)c1cccnc1SC(F)(F)F ZINC000067539323 946723557 /nfs/dbraw/zinc/72/35/57/946723557.db2.gz FDXLPCXJBSYZJE-UHFFFAOYSA-N 0 0 361.276 3.993 20 5 FHBDRN CC[C@@H]1c2ccccc2CCN1C(=O)c1cc(OC)c(F)cc1[N+](=O)[O-] ZINC001126149551 946725044 /nfs/dbraw/zinc/72/50/44/946725044.db2.gz MAMVTKDLIFHPGE-MRXNPFEDSA-N 0 0 358.369 3.892 20 5 FHBDRN Cc1cc(C)n(-c2ccc(C(=O)N(C)c3ccc([N+](=O)[O-])cc3)cc2F)n1 ZINC000112165807 946733888 /nfs/dbraw/zinc/73/38/88/946733888.db2.gz WGGKLPYGRCGFCR-UHFFFAOYSA-N 0 0 368.368 3.813 20 5 FHBDRN CCOc1ccccc1CCNC(=O)Nc1cc(C)c([N+](=O)[O-])cc1C ZINC000475578646 946737154 /nfs/dbraw/zinc/73/71/54/946737154.db2.gz PYKWDYGENWVVDA-UHFFFAOYSA-N 0 0 357.410 3.975 20 5 FHBDRN C[C@H]1Cc2ccccc2N(S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000104749432 946751780 /nfs/dbraw/zinc/75/17/80/946751780.db2.gz YYKWNAWVWYBBMA-NSHDSACASA-N 0 0 366.826 3.636 20 5 FHBDRN Cc1nc(CC2CC2)oc1C(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000475257246 946767356 /nfs/dbraw/zinc/76/73/56/946767356.db2.gz XWUKRMSFUYHKRG-UHFFFAOYSA-N 0 0 357.410 3.895 20 5 FHBDRN CCOc1cc(NCC2CCN(CC(F)(F)F)CC2)ccc1[N+](=O)[O-] ZINC000186640260 946769805 /nfs/dbraw/zinc/76/98/05/946769805.db2.gz RYNPHQZTDPVCCV-UHFFFAOYSA-N 0 0 361.364 3.680 20 5 FHBDRN CO[C@H](c1noc(Cc2cccc([N+](=O)[O-])c2C)n1)c1ccc(F)cc1 ZINC000546508386 946771229 /nfs/dbraw/zinc/77/12/29/946771229.db2.gz XUZRCGFNJJDOHM-KRWDZBQOSA-N 0 0 357.341 3.752 20 5 FHBDRN Cc1cccc(C)c1OCCCn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000523110402 946772400 /nfs/dbraw/zinc/77/24/00/946772400.db2.gz IFNYABSOMYRGOX-UHFFFAOYSA-N 0 0 352.394 3.939 20 5 FHBDRN C[C@H]1Cc2ccccc2N1C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000016022741 946778343 /nfs/dbraw/zinc/77/83/43/946778343.db2.gz IPHQRAVTKYUADI-HNNXBMFYSA-N 0 0 365.433 3.789 20 5 FHBDRN C[C@H]1CN(Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C[C@@H](C2CC2)O1 ZINC000475276691 946792916 /nfs/dbraw/zinc/79/29/16/946792916.db2.gz BLWWOKZEPNDUMW-SJCJKPOMSA-N 0 0 359.451 3.718 20 5 FHBDRN CCOC(=O)c1ccnc(Nc2ccc(NC(=O)C(C)C)cc2)c1[N+](=O)[O-] ZINC000523114422 946798562 /nfs/dbraw/zinc/79/85/62/946798562.db2.gz GDXDPBKMUNZBBH-UHFFFAOYSA-N 0 0 372.381 3.505 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)c1ccc2c(c1)N(C)CC2 ZINC000544387853 946814991 /nfs/dbraw/zinc/81/49/91/946814991.db2.gz VBIYEDJQAKCHCB-UHFFFAOYSA-N 0 0 353.422 3.638 20 5 FHBDRN CCCc1ccccc1NCC(=O)Nc1ccc(OCC)cc1[N+](=O)[O-] ZINC000025903167 946820417 /nfs/dbraw/zinc/82/04/17/946820417.db2.gz JMASJDGAALSGOC-UHFFFAOYSA-N 0 0 357.410 3.997 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NCC(=O)N[C@@H](C)c1ccc(C)c(C)c1 ZINC000025907954 946822514 /nfs/dbraw/zinc/82/25/14/946822514.db2.gz HEAJTRZQCNUUHT-AWEZNQCLSA-N 0 0 357.410 3.510 20 5 FHBDRN O=[N+]([O-])c1cc(F)ccc1Cc1nc([C@H]2CCOC3(CCCC3)C2)no1 ZINC000897184095 946831617 /nfs/dbraw/zinc/83/16/17/946831617.db2.gz OGQFPVMMGQYCCW-ZDUSSCGKSA-N 0 0 361.373 3.915 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1F)N1CCc2ccc(Br)cc21 ZINC000112265666 946835443 /nfs/dbraw/zinc/83/54/43/946835443.db2.gz FWOBTDZKUNVKBN-UHFFFAOYSA-N 0 0 365.158 3.699 20 5 FHBDRN CNC(=O)c1ccc(Oc2ccc(Br)c(F)c2)c([N+](=O)[O-])c1 ZINC000112333617 946856239 /nfs/dbraw/zinc/85/62/39/946856239.db2.gz IUZVSAXMDXFOTG-UHFFFAOYSA-N 0 0 369.146 3.648 20 5 FHBDRN C[C@H]1Cc2ccccc2N(S(=O)(=O)c2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000729491371 946862143 /nfs/dbraw/zinc/86/21/43/946862143.db2.gz ZZZLYMWHKDEFHG-NSHDSACASA-N 0 0 366.826 3.636 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)Nc1cc(Cl)c(Cl)cn1 ZINC000127114250 946862518 /nfs/dbraw/zinc/86/25/18/946862518.db2.gz NSCMYKZLRIEQKP-UHFFFAOYSA-N 0 0 365.176 3.959 20 5 FHBDRN C[C@@H]1Cc2ccccc2N(S(=O)(=O)c2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000729491370 946862790 /nfs/dbraw/zinc/86/27/90/946862790.db2.gz ZZZLYMWHKDEFHG-LLVKDONJSA-N 0 0 366.826 3.636 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N(C)C[C@@H]1COc2ccccc2O1 ZINC000184485589 946873220 /nfs/dbraw/zinc/87/32/20/946873220.db2.gz SOWQIJJXDQLSCH-CQSZACIVSA-N 0 0 371.393 3.515 20 5 FHBDRN CC[C@H](O)CN(Cc1ccccc1)C(=O)N[C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000458883557 946876676 /nfs/dbraw/zinc/87/66/76/946876676.db2.gz CFNXZVQHRORMHN-KXBFYZLASA-N 0 0 371.437 3.639 20 5 FHBDRN CC[C@@H](CNc1ccccc1)NC(=O)N[C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000458884698 946877449 /nfs/dbraw/zinc/87/74/49/946877449.db2.gz FSYRZMXJAYXMMN-HOCLYGCPSA-N 0 0 356.426 3.846 20 5 FHBDRN CCS[C@H]1CCCC[C@@H]1Nc1nc(C)cc(C(=O)OC)c1[N+](=O)[O-] ZINC000550390272 946889509 /nfs/dbraw/zinc/88/95/09/946889509.db2.gz QFDFOUHFZZPIBB-STQMWFEESA-N 0 0 353.444 3.561 20 5 FHBDRN CSc1cccc(C(=O)Nc2cccc(-c3ncon3)c2)c1[N+](=O)[O-] ZINC000186696834 946894056 /nfs/dbraw/zinc/89/40/56/946894056.db2.gz DWXLVNJDJCWLDE-UHFFFAOYSA-N 0 0 356.363 3.619 20 5 FHBDRN O=C(COc1ccc(C(F)(F)F)cc1)N1CCc2c1cccc2[N+](=O)[O-] ZINC000523132175 946899776 /nfs/dbraw/zinc/89/97/76/946899776.db2.gz QBERXQKGIXEUQC-UHFFFAOYSA-N 0 0 366.295 3.582 20 5 FHBDRN O=[N+]([O-])c1sc(CNCc2cccc3c2OCC3)cc1Br ZINC000897205778 946906762 /nfs/dbraw/zinc/90/67/62/946906762.db2.gz HYDWWWCZBXMXFY-UHFFFAOYSA-N 0 0 369.240 3.644 20 5 FHBDRN CC(C)(C)c1cccc2c1OCCN2C(=O)c1cccc([N+](=O)[O-])c1N ZINC000444473298 946908979 /nfs/dbraw/zinc/90/89/79/946908979.db2.gz BCXWECKFYHXGNO-UHFFFAOYSA-N 0 0 355.394 3.514 20 5 FHBDRN CC(=O)c1cc(NCc2ccc(-n3ccnc3)c(F)c2)ccc1[N+](=O)[O-] ZINC000550386946 946909219 /nfs/dbraw/zinc/90/92/19/946909219.db2.gz HBGLFRXEQVZDPH-UHFFFAOYSA-N 0 0 354.341 3.734 20 5 FHBDRN COc1ccc(SCC(=O)N2CCCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000112629105 946911316 /nfs/dbraw/zinc/91/13/16/946911316.db2.gz XGPGZFYAFBUFDM-UHFFFAOYSA-N 0 0 358.419 3.675 20 5 FHBDRN C[C@H](NC(=O)N1CCC[C@H](c2nccs2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000458885646 946915622 /nfs/dbraw/zinc/91/56/22/946915622.db2.gz GUPZEVLMDCWEJM-JSGCOSHPSA-N 0 0 360.439 3.702 20 5 FHBDRN Cc1cc(N2CCCC2)ccc1NC(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000536283905 946916840 /nfs/dbraw/zinc/91/68/40/946916840.db2.gz MGSQSVVXHVLQEW-UHFFFAOYSA-N 0 0 368.437 3.868 20 5 FHBDRN Cc1ccc([C@@H](C)CNC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)cc1 ZINC000523148974 946925434 /nfs/dbraw/zinc/92/54/34/946925434.db2.gz HZDHEFUAXTTXJC-HNNXBMFYSA-N 0 0 351.406 3.778 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N[C@H](c1ccccc1)c1ccncc1 ZINC000087062399 946933720 /nfs/dbraw/zinc/93/37/20/946933720.db2.gz KCLBPVVOLFDINZ-OAQYLSRUSA-N 0 0 361.401 3.828 20 5 FHBDRN COc1c(C(=O)N[C@@H](c2ccccc2)c2ccncc2)cccc1[N+](=O)[O-] ZINC000475605190 946941873 /nfs/dbraw/zinc/94/18/73/946941873.db2.gz XEZQQCVIQNGLDD-SFHVURJKSA-N 0 0 363.373 3.518 20 5 FHBDRN COc1ccc([C@H](NC(=O)CCc2cccc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000087064587 946944744 /nfs/dbraw/zinc/94/47/44/946944744.db2.gz STKKLMPHPCDNPF-HXUWFJFHSA-N 0 0 354.406 3.804 20 5 FHBDRN C[C@H](Oc1ccc(F)cc1Cl)C(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000112798741 946949260 /nfs/dbraw/zinc/94/92/60/946949260.db2.gz WEHHFZYRXWPWMK-NSHDSACASA-N 0 0 366.776 3.514 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N1C[C@@H]2CCCN2c2ccccc21 ZINC000609784071 946950343 /nfs/dbraw/zinc/95/03/43/946950343.db2.gz RFIJWDHHKNJTJG-HNNXBMFYSA-N 0 0 371.824 3.806 20 5 FHBDRN COc1cccc(N2CCc3c(Br)cccc3C2)c1[N+](=O)[O-] ZINC000475361394 946950907 /nfs/dbraw/zinc/95/09/07/946950907.db2.gz HGRQNEQEUDQMCA-UHFFFAOYSA-N 0 0 363.211 3.929 20 5 FHBDRN CCOc1ccccc1[C@H](CC)NC(=O)COc1ccccc1[N+](=O)[O-] ZINC000053318635 946953012 /nfs/dbraw/zinc/95/30/12/946953012.db2.gz FEXQNGQQTRUNHM-HNNXBMFYSA-N 0 0 358.394 3.640 20 5 FHBDRN O=C(N=c1cc(-c2cccc([N+](=O)[O-])c2)[nH][nH]1)c1csc2ccccc12 ZINC000523164324 946963970 /nfs/dbraw/zinc/96/39/70/946963970.db2.gz MQWFIVSFUIVSOD-UHFFFAOYSA-N 0 0 364.386 3.874 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc3[nH]ccc3c2)cc1OC ZINC000112862173 946978729 /nfs/dbraw/zinc/97/87/29/946978729.db2.gz CVQGPRXWCYTEAH-UHFFFAOYSA-N 0 0 355.350 3.736 20 5 FHBDRN COc1ccc(CSCC(=O)Nc2ccc3[nH]ccc3c2)cc1[N+](=O)[O-] ZINC000112862554 946978923 /nfs/dbraw/zinc/97/89/23/946978923.db2.gz YHYYUWSYUPVMPS-UHFFFAOYSA-N 0 0 371.418 3.957 20 5 FHBDRN CCOc1ccc(C(=O)NC(C)(C)Cc2ccc(OC)cc2)cc1[N+](=O)[O-] ZINC000438517526 946979684 /nfs/dbraw/zinc/97/96/84/946979684.db2.gz QMJUMOZRJZAUQJ-UHFFFAOYSA-N 0 0 372.421 3.753 20 5 FHBDRN O=C(Nc1nc(C2CCC2)cs1)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000444509826 946981485 /nfs/dbraw/zinc/98/14/85/946981485.db2.gz YCKQXKPQDBORHE-UHFFFAOYSA-N 0 0 370.390 3.825 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N(Cc1ccncc1)Cc1cccnc1 ZINC000112903150 946985049 /nfs/dbraw/zinc/98/50/49/946985049.db2.gz SKGDWUGZIKRZFL-UHFFFAOYSA-N 0 0 362.389 3.536 20 5 FHBDRN CC1(C)CN(C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CCCO1 ZINC000613861457 946988014 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350.415 3.522 20 5 FHBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CC3(CCC3)[C@@H]2c2ccccc2)cc1 ZINC000432263630 947011709 /nfs/dbraw/zinc/01/17/09/947011709.db2.gz IDUIKVYJWCRBAM-KRWDZBQOSA-N 0 0 358.419 3.511 20 5 FHBDRN C[C@@H]1CN(C(=O)c2ccccc2Sc2ccccc2[N+](=O)[O-])CCCO1 ZINC000440483512 947017006 /nfs/dbraw/zinc/01/70/06/947017006.db2.gz RMZCIZGCCHJWDU-CQSZACIVSA-N 0 0 372.446 3.997 20 5 FHBDRN O=C(c1ccccc1[N+](=O)[O-])N1CCC[C@H](c2nc3ccccc3o2)C1 ZINC000024695263 947018314 /nfs/dbraw/zinc/01/83/14/947018314.db2.gz KELSBFAAGUDHJZ-ZDUSSCGKSA-N 0 0 351.362 3.756 20 5 FHBDRN CCc1nc(CCNC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)cs1 ZINC000121478107 947019633 /nfs/dbraw/zinc/01/96/33/947019633.db2.gz FPJYNMXMOOAUJY-UHFFFAOYSA-N 0 0 374.466 3.530 20 5 FHBDRN CSc1cccc(C(=O)NCCc2cc(F)cc(F)c2)c1[N+](=O)[O-] ZINC000186347533 947023124 /nfs/dbraw/zinc/02/31/24/947023124.db2.gz UMRRDQOCUXPIBW-UHFFFAOYSA-N 0 0 352.362 3.567 20 5 FHBDRN O=C(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccc2sccc2c1 ZINC000444635688 947047779 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BPXQXARQPBHAQA-NSHDSACASA-N 0 0 372.812 3.620 20 5 FHBDRN CC(C)c1ccc(CCC(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000444642824 947085270 /nfs/dbraw/zinc/08/52/70/947085270.db2.gz XTOOEVUKBDBDNH-UHFFFAOYSA-N 0 0 366.421 3.844 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]c(CN3CCC(Nc4ccc(F)cc4)CC3)nc2c1 ZINC000444665536 947092450 /nfs/dbraw/zinc/09/24/50/947092450.db2.gz PCWWZEICGXWPGP-UHFFFAOYSA-N 0 0 369.400 3.687 20 5 FHBDRN Cc1ccc(CN(C(=O)COc2ccc([N+](=O)[O-])cc2Cl)C2CC2)o1 ZINC000053324590 947093598 /nfs/dbraw/zinc/09/35/98/947093598.db2.gz OGKFSMAEUQXUSM-UHFFFAOYSA-N 0 0 364.785 3.720 20 5 FHBDRN CC(C)COC[C@@H](NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccco1 ZINC000444670252 947095224 /nfs/dbraw/zinc/09/52/24/947095224.db2.gz GGZJQXASACCLGE-MRXNPFEDSA-N 0 0 358.398 3.568 20 5 FHBDRN C[C@H](OC(=O)c1ccc([N+](=O)[O-])s1)C(=O)Nc1cccc2ccccc21 ZINC000021139896 947114884 /nfs/dbraw/zinc/11/48/84/947114884.db2.gz VQQMSAFUYQFUIF-NSHDSACASA-N 0 0 370.386 3.994 20 5 FHBDRN C[C@@H](NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1nc(C2CCCCC2)no1 ZINC000444691235 947116651 /nfs/dbraw/zinc/11/66/51/947116651.db2.gz XYEAKRKHAVZBNA-LLVKDONJSA-N 0 0 370.413 3.753 20 5 FHBDRN COc1ccc(CCNc2ncc(C)cc2[N+](=O)[O-])c(Cl)c1OC ZINC000549583533 947131237 /nfs/dbraw/zinc/13/12/37/947131237.db2.gz ZQZIIRCCRABXIJ-UHFFFAOYSA-N 0 0 351.790 3.623 20 5 FHBDRN Cc1cc(CN(C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)ccc1F ZINC000444730316 947145156 /nfs/dbraw/zinc/14/51/56/947145156.db2.gz FKFCDNCWAWXXQW-UHFFFAOYSA-N 0 0 356.357 3.724 20 5 FHBDRN CCOC(=O)[C@@H]1CCN(Cc2c(F)cccc2[N+](=O)[O-])c2ccccc21 ZINC000444733495 947149218 /nfs/dbraw/zinc/14/92/18/947149218.db2.gz RFHYMBDLIIIKNX-CQSZACIVSA-N 0 0 358.369 3.791 20 5 FHBDRN CCOC(=O)[C@H]1CCN(CCc2ccc([N+](=O)[O-])cc2)c2ccccc21 ZINC000444719425 947161229 /nfs/dbraw/zinc/16/12/29/947161229.db2.gz RAZJREIDEBNJKI-SFHVURJKSA-N 0 0 354.406 3.694 20 5 FHBDRN CN(Cc1ccccc1F)C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000049929585 947181355 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O=C(Cc1cccc([N+](=O)[O-])c1)NCCc1ccc(Cl)cc1Cl ZINC000151816659 947227298 /nfs/dbraw/zinc/22/72/98/947227298.db2.gz KGFFIZHXQUXLOF-UHFFFAOYSA-N 0 0 353.205 3.803 20 5 FHBDRN O=C(Nc1nc2ccccc2[nH]1)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000444823776 947237577 /nfs/dbraw/zinc/23/75/77/947237577.db2.gz FXZZUWNRQBFHAG-UHFFFAOYSA-N 0 0 354.369 3.810 20 5 FHBDRN COC(=O)c1ccccc1NC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000123558321 947244099 /nfs/dbraw/zinc/24/40/99/947244099.db2.gz JYTWRJLQAJZHFO-UHFFFAOYSA-N 0 0 368.267 3.653 20 5 FHBDRN CC[C@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1C)c1ccc(F)cc1F ZINC000523418146 947248301 /nfs/dbraw/zinc/24/83/01/947248301.db2.gz FLFSBYPHZWXPJN-HNNXBMFYSA-N 0 0 370.377 3.611 20 5 FHBDRN CC[C@@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1C)c1ccc(F)cc1F ZINC000523418147 947248557 /nfs/dbraw/zinc/24/85/57/947248557.db2.gz FLFSBYPHZWXPJN-OAHLLOKOSA-N 0 0 370.377 3.611 20 5 FHBDRN CCOc1cc(NC(=O)N2CCCC23CCC3)c([N+](=O)[O-])cc1OCC ZINC000444832405 947265803 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/nfs/dbraw/zinc/35/06/30/947350630.db2.gz KYKDPUBNXOPDOO-ZDUSSCGKSA-N 0 0 359.382 3.501 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NCCCc1c[nH]c2ccccc12 ZINC000444918218 947353170 /nfs/dbraw/zinc/35/31/70/947353170.db2.gz GRNQQCHJIIPFPC-UHFFFAOYSA-N 0 0 368.393 3.839 20 5 FHBDRN O=C(C=CCc1cccc(F)c1)Nc1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000440607657 947357444 /nfs/dbraw/zinc/35/74/44/947357444.db2.gz BCFBJERDKRWQQQ-DUXPYHPUSA-N 0 0 351.337 3.746 20 5 FHBDRN CCCCCc1nnc(NC(=O)c2c(C)c(F)ccc2[N+](=O)[O-])s1 ZINC000843772205 947367715 /nfs/dbraw/zinc/36/77/15/947367715.db2.gz RCRFCDMIUSAKFR-UHFFFAOYSA-N 0 0 352.391 3.879 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)N1CCc2c(Cl)cccc2C1 ZINC000523566451 947373560 /nfs/dbraw/zinc/37/35/60/947373560.db2.gz ZKJHEKOUQHWZPF-UHFFFAOYSA-N 0 0 359.813 3.559 20 5 FHBDRN O=C(Nc1ccc2cc([N+](=O)[O-])ccc2n1)C1(c2ccc(Cl)cc2)CC1 ZINC000440616767 947376789 /nfs/dbraw/zinc/37/67/89/947376789.db2.gz RZNUSNNCVUGDDZ-UHFFFAOYSA-N 0 0 367.792 3.889 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1C(=O)Oc1cccc2c1CCCC(=O)N2 ZINC001271771792 947381196 /nfs/dbraw/zinc/38/11/96/947381196.db2.gz ZCJQBPOEIQJWDF-UHFFFAOYSA-N 0 0 354.362 3.706 20 5 FHBDRN COc1cc(C)cc(CNC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)c1 ZINC000444979314 947383642 /nfs/dbraw/zinc/38/36/42/947383642.db2.gz YSCQJCHWUMZVEC-UHFFFAOYSA-N 0 0 372.424 3.928 20 5 FHBDRN COc1ccc(CNC(=O)Nc2cc3[nH]ccc3cc2C)cc1[N+](=O)[O-] ZINC000444963178 947389977 /nfs/dbraw/zinc/38/99/77/947389977.db2.gz CMPIAPHSTZLPTN-UHFFFAOYSA-N 0 0 354.366 3.715 20 5 FHBDRN CCc1nc2cc(N[C@@H](C)C(=O)Nc3ccccc3[N+](=O)[O-])ccc2o1 ZINC000079323754 947401742 /nfs/dbraw/zinc/40/17/42/947401742.db2.gz GDSPEOIHBOTKTO-NSHDSACASA-N 0 0 354.366 3.738 20 5 FHBDRN C[C@H](NC(=O)N(C)Cc1cc(C(C)(C)C)n[nH]1)c1cccc([N+](=O)[O-])c1 ZINC000444989831 947403441 /nfs/dbraw/zinc/40/34/41/947403441.db2.gz PDZBWIIVBLSYHA-LBPRGKRZSA-N 0 0 359.430 3.518 20 5 FHBDRN O=C(Nc1ccc2cc([N+](=O)[O-])ccc2n1)[C@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000440629008 947412952 /nfs/dbraw/zinc/41/29/52/947412952.db2.gz XORPUGMPNLJDFE-NWDGAFQWSA-N 0 0 367.327 3.872 20 5 FHBDRN COc1cc(C(=O)N2CC[C@H](C)C[C@H]2c2ccco2)cc([N+](=O)[O-])c1OC ZINC000440627078 947414306 /nfs/dbraw/zinc/41/43/06/947414306.db2.gz HSUKGIFXOIXMSH-JSGCOSHPSA-N 0 0 374.393 3.818 20 5 FHBDRN COc1cc(C(=O)N2CC[C@@H](C)C[C@H]2c2ccco2)cc([N+](=O)[O-])c1OC ZINC000440627079 947423954 /nfs/dbraw/zinc/42/39/54/947423954.db2.gz HSUKGIFXOIXMSH-OCCSQVGLSA-N 0 0 374.393 3.818 20 5 FHBDRN C[C@@H](CNC(=O)c1cccc2c(=O)c3ccccc3[nH]c12)Oc1ccccc1 ZINC000445005463 947428308 /nfs/dbraw/zinc/42/83/08/947428308.db2.gz ROIQRAGXLCDDSH-HNNXBMFYSA-N 0 0 372.424 3.879 20 5 FHBDRN CC(C)N(Cc1ccccn1)C(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000054301298 947450514 /nfs/dbraw/zinc/45/05/14/947450514.db2.gz BUTSMSQTYMGZHG-AWEZNQCLSA-N 0 0 359.451 3.908 20 5 FHBDRN COCc1nc(CNc2c([N+](=O)[O-])c(C)nn2C)c(-c2ccccc2)s1 ZINC000440636844 947457699 /nfs/dbraw/zinc/45/76/99/947457699.db2.gz MRUSZKSIBPWOQQ-UHFFFAOYSA-N 0 0 373.438 3.519 20 5 FHBDRN COc1cccc(NC[C@@H]2CCN(c3ccc(F)c(F)c3)C2)c1[N+](=O)[O-] ZINC000613874983 947473678 /nfs/dbraw/zinc/47/36/78/947473678.db2.gz FSNSDDBGPMOMCD-LBPRGKRZSA-N 0 0 363.364 3.820 20 5 FHBDRN CC[C@H](CNC(=O)c1csc([N+](=O)[O-])c1)Oc1cccc(Cl)c1 ZINC000440649537 947478718 /nfs/dbraw/zinc/47/87/18/947478718.db2.gz SGOPFIHWOQXQIS-GFCCVEGCSA-N 0 0 354.815 3.897 20 5 FHBDRN O=C(c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)N1CCC=Cc2ccccc21 ZINC000188251600 947484172 /nfs/dbraw/zinc/48/41/72/947484172.db2.gz CVWQCXOCFQCEAX-UHFFFAOYSA-N 0 0 360.373 3.844 20 5 FHBDRN CC(C)(C)c1n[nH]cc1C(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000508517543 947498066 /nfs/dbraw/zinc/49/80/66/947498066.db2.gz IZZVPECVFOXFSS-UHFFFAOYSA-N 0 0 370.331 3.564 20 5 FHBDRN COc1ccc(CSCC(=O)N[C@H](C)CC(C)(C)C)cc1[N+](=O)[O-] ZINC000457232123 947537038 /nfs/dbraw/zinc/53/70/38/947537038.db2.gz RLLPXZXBJXHFMS-GFCCVEGCSA-N 0 0 354.472 3.778 20 5 FHBDRN Cc1ccccc1Nc1nc(Cn2cc([N+](=O)[O-])c(C)cc2=O)cs1 ZINC000128514753 947539562 /nfs/dbraw/zinc/53/95/62/947539562.db2.gz NAMWZZLCVQHNPV-UHFFFAOYSA-N 0 0 356.407 3.622 20 5 FHBDRN CCCc1nc(C)c(C(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)o1 ZINC000508520386 947540375 /nfs/dbraw/zinc/54/03/75/947540375.db2.gz OMKUMBJWJMYMRI-UHFFFAOYSA-N 0 0 371.315 3.793 20 5 FHBDRN C[C@H](c1ccccc1)n1cnnc1SCCOc1ccccc1[N+](=O)[O-] ZINC000053841315 947553925 /nfs/dbraw/zinc/55/39/25/947553925.db2.gz CYNAKBGNDKZEOQ-CQSZACIVSA-N 0 0 370.434 3.967 20 5 FHBDRN Cc1c(OCC(=O)NCCCO[C@H](C)c2ccccc2)cccc1[N+](=O)[O-] ZINC000053837826 947554078 /nfs/dbraw/zinc/55/40/78/947554078.db2.gz AJRCSLDUQVFQAY-MRXNPFEDSA-N 0 0 372.421 3.566 20 5 FHBDRN C[C@H](c1ccccc1)n1cnnc1SCCOc1cccc([N+](=O)[O-])c1 ZINC000053840993 947554287 /nfs/dbraw/zinc/55/42/87/947554287.db2.gz HYDSKCJJRUPCSX-CQSZACIVSA-N 0 0 370.434 3.967 20 5 FHBDRN CCOc1cc2c(cc1CNC(=O)c1c(C)cccc1[N+](=O)[O-])O[C@@H](C)C2 ZINC000184544263 947566393 /nfs/dbraw/zinc/56/63/93/947566393.db2.gz JCOFQIMLVWKHPD-ZDUSSCGKSA-N 0 0 370.405 3.555 20 5 FHBDRN CCOc1cc2c(cc1[C@@H]1C[C@H]1Nc1nccc(C)c1[N+](=O)[O-])O[C@H](C)C2 ZINC000523755358 947571280 /nfs/dbraw/zinc/57/12/80/947571280.db2.gz SUORVKXYKOVBLP-IVMMDQJWSA-N 0 0 369.421 3.988 20 5 FHBDRN CCOc1cc2c(cc1[C@@H]1C[C@@H]1Nc1nccc(C)c1[N+](=O)[O-])O[C@@H](C)C2 ZINC000523755359 947571439 /nfs/dbraw/zinc/57/14/39/947571439.db2.gz SUORVKXYKOVBLP-NOLJZWGESA-N 0 0 369.421 3.988 20 5 FHBDRN C[C@@H](c1nc(-c2cccs2)no1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088607122 947572547 /nfs/dbraw/zinc/57/25/47/947572547.db2.gz CGSMNWRURAVSHL-NSHDSACASA-N 0 0 356.407 3.826 20 5 FHBDRN CCCN(C(=O)CCOCC(F)(F)C(F)F)c1cccc([N+](=O)[O-])c1 ZINC000441459170 947573265 /nfs/dbraw/zinc/57/32/65/947573265.db2.gz ABGBVYSJAUIGBB-UHFFFAOYSA-N 0 0 366.311 3.645 20 5 FHBDRN Cc1cc(S(=O)(=O)NC2(c3ccccc3)CCCC2)ccc1[N+](=O)[O-] ZINC000523759090 947577742 /nfs/dbraw/zinc/57/77/42/947577742.db2.gz BQXWMFAYZNVBMW-UHFFFAOYSA-N 0 0 360.435 3.651 20 5 FHBDRN Cc1nc(-c2ccc(C(=O)NCc3ccc([N+](=O)[O-])cc3)cc2)cs1 ZINC000440682917 947578926 /nfs/dbraw/zinc/57/89/26/947578926.db2.gz QRFPFYLQPJEGCG-UHFFFAOYSA-N 0 0 353.403 3.957 20 5 FHBDRN CCO[C@@H]1C[C@H](N(C)C(=O)c2ccc([N+](=O)[O-])cc2F)C12CCCC2 ZINC000150791183 947583465 /nfs/dbraw/zinc/58/34/65/947583465.db2.gz ZNUXDYJGELLKFG-JKSUJKDBSA-N 0 0 350.390 3.544 20 5 FHBDRN C[C@H](C(=O)Nc1ccccc1Cl)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088605319 947587683 /nfs/dbraw/zinc/58/76/83/947587683.db2.gz MNBJTVHWIGBCJP-GFCCVEGCSA-N 0 0 359.813 3.634 20 5 FHBDRN CSc1ccccc1[C@H](C)Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000440676954 947594596 /nfs/dbraw/zinc/59/45/96/947594596.db2.gz UWYMZSZUZAEPAS-NSHDSACASA-N 0 0 366.464 3.893 20 5 FHBDRN CC(=O)Nc1ccc(C)c(NC(=O)c2ccc([N+](=O)[O-])c3cccnc23)c1 ZINC000159164240 947597115 /nfs/dbraw/zinc/59/71/15/947597115.db2.gz GKGQPHVELUINJL-UHFFFAOYSA-N 0 0 364.361 3.662 20 5 FHBDRN O=C(NC1CCOCC1)c1ccccc1Sc1ccccc1[N+](=O)[O-] ZINC000440684007 947598057 /nfs/dbraw/zinc/59/80/57/947598057.db2.gz UINHNMBRPHFLHO-UHFFFAOYSA-N 0 0 358.419 3.655 20 5 FHBDRN Cc1c(Cc2noc(-c3ccc4nsnc4c3)n2)cccc1[N+](=O)[O-] ZINC000445229430 947608425 /nfs/dbraw/zinc/60/84/25/947608425.db2.gz BHFQBJBXDONZQO-UHFFFAOYSA-N 0 0 353.363 3.549 20 5 FHBDRN CCO[C@H](CNC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)c1ccccc1 ZINC000445215842 947616518 /nfs/dbraw/zinc/61/65/18/947616518.db2.gz DERVFIZDBYKJJP-QGZVFWFLSA-N 0 0 353.378 3.584 20 5 FHBDRN CCOCC1(C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)c(C)s2)CC1 ZINC000440687438 947619897 /nfs/dbraw/zinc/61/98/97/947619897.db2.gz XTNDRICKRAZZPP-UHFFFAOYSA-N 0 0 361.423 3.782 20 5 FHBDRN Cc1cccc(CCC(=O)O[C@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)c1 ZINC000759935699 947620494 /nfs/dbraw/zinc/62/04/94/947620494.db2.gz ZAIKPIRXQONNNQ-IRXDYDNUSA-N 0 0 357.410 3.759 20 5 FHBDRN Cc1cccc(CCC(=O)O[C@@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)c1 ZINC000759935696 947621086 /nfs/dbraw/zinc/62/10/86/947621086.db2.gz ZAIKPIRXQONNNQ-DLBZAZTESA-N 0 0 357.410 3.759 20 5 FHBDRN C[C@H](NS(=O)(=O)c1ccccc1[N+](=O)[O-])c1cccc(C(F)(F)F)c1 ZINC000016088017 947643691 /nfs/dbraw/zinc/64/36/91/947643691.db2.gz ZSNIWBMSKWOPJQ-JTQLQIEISA-N 0 0 374.340 3.653 20 5 FHBDRN Cc1ccc(Cl)cc1NC(=O)COC(=O)c1c(C)cccc1[N+](=O)[O-] ZINC000026113318 947650866 /nfs/dbraw/zinc/65/08/66/947650866.db2.gz RTXHCWJRPXCPQV-UHFFFAOYSA-N 0 0 362.769 3.661 20 5 FHBDRN CC(C)C[C@@H]1COCCN1C(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000074951437 947662665 /nfs/dbraw/zinc/66/26/65/947662665.db2.gz CMRJSWVMHCVQNE-GFCCVEGCSA-N 0 0 360.332 3.501 20 5 FHBDRN Cc1ccc(NCCCNC(=O)N2CCc3ccsc3C2)c([N+](=O)[O-])c1 ZINC000536353990 947665086 /nfs/dbraw/zinc/66/50/86/947665086.db2.gz IRKYGNGQBKAOSB-UHFFFAOYSA-N 0 0 374.466 3.535 20 5 FHBDRN O=C(C[C@@H]1CCc2ccccc21)O[C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000759934993 947671558 /nfs/dbraw/zinc/67/15/58/947671558.db2.gz RDSZYALYHFODRC-JQHSSLGASA-N 0 0 369.421 3.938 20 5 FHBDRN Cc1cccc(C)c1OCC(=O)O[C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1 ZINC000759936678 947675167 /nfs/dbraw/zinc/67/51/67/947675167.db2.gz FVURIXVSQWPZIJ-JKSUJKDBSA-N 0 0 373.409 3.514 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H](C)[C@H]1COc2ccccc21 ZINC000248394007 947700167 /nfs/dbraw/zinc/70/01/67/947700167.db2.gz MPVNYBZRVAIMCJ-IDHHARJASA-N 0 0 368.433 3.844 20 5 FHBDRN CN(C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](CCO)c1ccccc1 ZINC000440721376 947706680 /nfs/dbraw/zinc/70/66/80/947706680.db2.gz HHAJGVUGAOXVBM-MRXNPFEDSA-N 0 0 363.801 3.836 20 5 FHBDRN C[C@H](Cc1ccccc1)C(=O)O[C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000759938648 947725524 /nfs/dbraw/zinc/72/55/24/947725524.db2.gz LIRMMXAZSMIUDA-OIISXLGYSA-N 0 0 357.410 3.697 20 5 FHBDRN O=C(NCc1cc(-c2ccccc2)no1)Nc1ccc([N+](=O)[O-])cc1F ZINC000544623469 947735033 /nfs/dbraw/zinc/73/50/33/947735033.db2.gz CITBLVGJYBCETM-UHFFFAOYSA-N 0 0 356.313 3.711 20 5 FHBDRN COc1cc2nc(NC(=O)c3ccc(C)c([N+](=O)[O-])c3)sc2cc1OC ZINC000021558416 947748268 /nfs/dbraw/zinc/74/82/68/947748268.db2.gz DHCPKEPAWLWGSZ-UHFFFAOYSA-N 0 0 373.390 3.782 20 5 FHBDRN O=[N+]([O-])c1cccc(Cl)c1NCc1cc(F)ccc1N1CCOCC1 ZINC000432308464 947791801 /nfs/dbraw/zinc/79/18/01/947791801.db2.gz RXJZJONSZHDSHJ-UHFFFAOYSA-N 0 0 365.792 3.836 20 5 FHBDRN COc1cc(F)cc2sc(NC(=O)c3ccc([N+](=O)[O-])c(C)c3)nc21 ZINC000520474278 947819218 /nfs/dbraw/zinc/81/92/18/947819218.db2.gz BPKMDDMFWGIDMO-UHFFFAOYSA-N 0 0 361.354 3.913 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)O[C@@H](C)C(=O)N[C@@H](C)c1ccccc1C ZINC000725989111 947836042 /nfs/dbraw/zinc/83/60/42/947836042.db2.gz YTFZVCQXOUESSL-GJZGRUSLSA-N 0 0 370.405 3.634 20 5 FHBDRN C[C@H](NC(=O)N1CCCC[C@H]([C@H]2CCOC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000895066843 947843568 /nfs/dbraw/zinc/84/35/68/947843568.db2.gz NUEONDNHHRJONI-XIRDDKMYSA-N 0 0 361.442 3.504 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(N2CCO[C@H](c3ccc(F)cc3Cl)C2)n1 ZINC000613896384 947855863 /nfs/dbraw/zinc/85/58/63/947855863.db2.gz BHJHBELDMODBMU-HNNXBMFYSA-N 0 0 365.792 3.977 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(N2CCO[C@@H](c3ccc(F)cc3Cl)C2)n1 ZINC000613896385 947856144 /nfs/dbraw/zinc/85/61/44/947856144.db2.gz BHJHBELDMODBMU-OAHLLOKOSA-N 0 0 365.792 3.977 20 5 FHBDRN CN(C)c1cccc2sc(C(=O)NCc3cccc([N+](=O)[O-])c3)cc21 ZINC001126251359 947873626 /nfs/dbraw/zinc/87/36/26/947873626.db2.gz ZXOBIRCMKKVOIH-UHFFFAOYSA-N 0 0 355.419 3.806 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CCO[C@@](C)(c2ccccc2)C1 ZINC000162928494 947877755 /nfs/dbraw/zinc/87/77/55/947877755.db2.gz OMIQJKFVAJLSIC-LJQANCHMSA-N 0 0 355.394 3.683 20 5 FHBDRN COc1ccc(C(=O)N(C)Cc2ccc(C(F)(F)F)cc2)cc1[N+](=O)[O-] ZINC000015473252 947882306 /nfs/dbraw/zinc/88/23/06/947882306.db2.gz VUTMBWVVOACMIJ-UHFFFAOYSA-N 0 0 368.311 3.894 20 5 FHBDRN C[C@@H]1CN(C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC(C)(C)O1 ZINC000184615579 947901517 /nfs/dbraw/zinc/90/15/17/947901517.db2.gz LVORRCZYCJNIMN-SECBINFHSA-N 0 0 361.320 3.645 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCC[C@@H]([C@@H]3CCOC3)C2)nc1-c1ccccc1 ZINC000536387309 947923875 /nfs/dbraw/zinc/92/38/75/947923875.db2.gz YLGOYUYTXWRJHP-IAGOWNOFSA-N 0 0 353.422 3.910 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CCC[C@@H](SC)C1 ZINC000248400637 947926056 /nfs/dbraw/zinc/92/60/56/947926056.db2.gz XSUPLVLFBWPYGO-HLLBOEOZSA-N 0 0 350.484 3.954 20 5 FHBDRN Cc1c(Br)cc(C(=O)N(C)Cc2ccsc2)cc1[N+](=O)[O-] ZINC000162934192 947934181 /nfs/dbraw/zinc/93/41/81/947934181.db2.gz AYIRUKOSNLJPNU-UHFFFAOYSA-N 0 0 369.240 3.999 20 5 FHBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NC[C@H]2CCCC[C@@H]2c2ccccc2)cc1 ZINC001211864956 947950133 /nfs/dbraw/zinc/95/01/33/947950133.db2.gz CGEKDKQANRAMHO-VQIMIIECSA-N 0 0 374.462 3.847 20 5 FHBDRN CC[C@@H]1CCC[C@@H](NC(=O)c2ccc(Cn3cc([N+](=O)[O-])cn3)cc2)C1 ZINC001126275239 947981954 /nfs/dbraw/zinc/98/19/54/947981954.db2.gz GNCWFFNJOKBEJK-RHSMWYFYSA-N 0 0 356.426 3.538 20 5 FHBDRN CC[C@H]1CCC[C@H](NC(=O)c2ccc(Cn3cc([N+](=O)[O-])cn3)cc2)C1 ZINC001126275241 947982910 /nfs/dbraw/zinc/98/29/10/947982910.db2.gz GNCWFFNJOKBEJK-YOEHRIQHSA-N 0 0 356.426 3.538 20 5 FHBDRN CC(=O)Nc1cc(C(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)ccc1C ZINC000129551262 948005826 /nfs/dbraw/zinc/00/58/26/948005826.db2.gz MLLXMFPCVIIYJM-UHFFFAOYSA-N 0 0 367.405 3.666 20 5 FHBDRN O=C(NCc1ccc(Cl)cc1)c1ccc([N+](=O)[O-])cc1Br ZINC000129543795 948015593 /nfs/dbraw/zinc/01/55/93/948015593.db2.gz KZRSQQAYMAJFQR-UHFFFAOYSA-N 0 0 369.602 3.941 20 5 FHBDRN COc1cc(OC)c(OC)cc1CNc1c(Cl)cccc1[N+](=O)[O-] ZINC000432321765 948021336 /nfs/dbraw/zinc/02/13/36/948021336.db2.gz HWXVCUPWMQWIED-UHFFFAOYSA-N 0 0 352.774 3.886 20 5 FHBDRN CC(C)(C)C(=O)NC[C@H]1CCCN(c2ccnc3c2cccc3[N+](=O)[O-])C1 ZINC000432319794 948021665 /nfs/dbraw/zinc/02/16/65/948021665.db2.gz ITPBGVDYLDERLA-CQSZACIVSA-N 0 0 370.453 3.522 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N2C[C@H](C)Cc3ccccc32)cc1OC ZINC000105378453 948022515 /nfs/dbraw/zinc/02/25/15/948022515.db2.gz VQTPAMQYVPNEHK-CYBMUJFWSA-N 0 0 370.405 3.841 20 5 FHBDRN O=[N+]([O-])c1c(N2CC[C@@H](Oc3ccccc3Cl)C2)nc2sccn21 ZINC000131843728 948029475 /nfs/dbraw/zinc/02/94/75/948029475.db2.gz GXQKWQXGVIZJMG-SNVBAGLBSA-N 0 0 364.814 3.615 20 5 FHBDRN COc1cccc([C@@H]2C[C@H]2C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1 ZINC000129555846 948031123 /nfs/dbraw/zinc/03/11/23/948031123.db2.gz LXHIKZOZTXQTGC-VQTJNVASSA-N 0 0 366.417 3.898 20 5 FHBDRN COc1cccc([C@@H]2C[C@@H]2C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1 ZINC000129555400 948031352 /nfs/dbraw/zinc/03/13/52/948031352.db2.gz LXHIKZOZTXQTGC-PMACEKPBSA-N 0 0 366.417 3.898 20 5 FHBDRN C[C@H](Nc1ccnc2c1cccc2[N+](=O)[O-])c1ccc(-n2ccnn2)cc1 ZINC000432322229 948039023 /nfs/dbraw/zinc/03/90/23/948039023.db2.gz KVGFKZLVQWNYRY-ZDUSSCGKSA-N 0 0 360.377 3.897 20 5 FHBDRN O=C(Nc1ccc(Br)c([N+](=O)[O-])c1)c1ccncc1Cl ZINC000094188770 948044138 /nfs/dbraw/zinc/04/41/38/948044138.db2.gz KMPJZRVPPKOSBP-UHFFFAOYSA-N 0 0 356.563 3.658 20 5 FHBDRN COc1cc(Cl)c(Cl)cc1NC(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000190752164 948044300 /nfs/dbraw/zinc/04/43/00/948044300.db2.gz LJMASZZZHLIJPK-UHFFFAOYSA-N 0 0 371.176 3.928 20 5 FHBDRN C[C@H]1Cc2ccccc2[C@@H]1NC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000087103239 948057326 /nfs/dbraw/zinc/05/73/26/948057326.db2.gz WQZHSUOGZJTQFI-ORAYPTAESA-N 0 0 351.406 3.596 20 5 FHBDRN CC(C)c1ccccc1NC(=O)[C@@H](C)Oc1ccc([N+](=O)[O-])c(CO)c1 ZINC000432325983 948073467 /nfs/dbraw/zinc/07/34/67/948073467.db2.gz NYAGVFGGYYIUNP-CYBMUJFWSA-N 0 0 358.394 3.617 20 5 FHBDRN COc1cc2c(cc1OC)CN(c1ccnc3c1cccc3[N+](=O)[O-])CC2 ZINC000432325966 948074683 /nfs/dbraw/zinc/07/46/83/948074683.db2.gz NUTBWCNGYZUKCZ-UHFFFAOYSA-N 0 0 365.389 3.723 20 5 FHBDRN CC(C)CCC[C@H](C)NC(=O)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000520491119 948075589 /nfs/dbraw/zinc/07/55/89/948075589.db2.gz XQTVMYHYSAZCDO-HNNXBMFYSA-N 0 0 358.442 3.789 20 5 FHBDRN C[C@@H](OCC1CC1)C(=O)N(Cc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000075352178 948076192 /nfs/dbraw/zinc/07/61/92/948076192.db2.gz VHFOPSPCLRCKFC-OAHLLOKOSA-N 0 0 354.406 3.943 20 5 FHBDRN C/C=C\c1ccc(OCC(=O)Nc2ccc(C)c([N+](=O)[O-])c2)c(OC)c1 ZINC000208369706 948112977 /nfs/dbraw/zinc/11/29/77/948112977.db2.gz UETSIUBTCAQWIR-PLNGDYQASA-N 0 0 356.378 3.962 20 5 FHBDRN Cc1c(C(=O)N(Cc2ccccc2)C(C)C)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000005921450 948114989 /nfs/dbraw/zinc/11/49/89/948114989.db2.gz VFYFDSUCQFKMBU-UHFFFAOYSA-N 0 0 357.366 3.862 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@@H]1c1ccncc1 ZINC000184664061 948119177 /nfs/dbraw/zinc/11/91/77/948119177.db2.gz FZSLWWWPDNMDDP-VQIMIIECSA-N 0 0 353.422 3.922 20 5 FHBDRN CN(Cc1ccccc1N1CCOCC1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000432332492 948122604 /nfs/dbraw/zinc/12/26/04/948122604.db2.gz YOPCBQZLHYAENK-UHFFFAOYSA-N 0 0 361.829 3.721 20 5 FHBDRN C[C@@H](Nc1ccnc2c1cccc2[N+](=O)[O-])c1cn(-c2ccccc2)nn1 ZINC000432334985 948143047 /nfs/dbraw/zinc/14/30/47/948143047.db2.gz ICSGKFHGDPFWKJ-CYBMUJFWSA-N 0 0 360.377 3.897 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N1CCC(OCCc2ccccc2)CC1 ZINC000511998652 948145480 /nfs/dbraw/zinc/14/54/80/948145480.db2.gz JPBLHTBADSERTM-UHFFFAOYSA-N 0 0 368.433 3.767 20 5 FHBDRN Cc1cccc(C)c1OC[C@H](C)NC(=O)c1c(C)c(F)ccc1[N+](=O)[O-] ZINC000843774475 948159395 /nfs/dbraw/zinc/15/93/95/948159395.db2.gz VNSCUOXOSFACRS-ZDUSSCGKSA-N 0 0 360.385 3.856 20 5 FHBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1C[C@@H](C)C[C@H](C)C1 ZINC000585695598 948160973 /nfs/dbraw/zinc/16/09/73/948160973.db2.gz QTCUWUXYLFGCEB-UWVGGRQHSA-N 0 0 355.232 3.784 20 5 FHBDRN Cc1cccc(C)c1NCC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000129568327 948161562 /nfs/dbraw/zinc/16/15/62/948161562.db2.gz LQRKRMWJZJCWFO-UHFFFAOYSA-N 0 0 353.422 3.815 20 5 FHBDRN Cc1nc(N2CCN(c3ccnc4c3cccc4[N+](=O)[O-])CC2)sc1C ZINC000432342337 948164326 /nfs/dbraw/zinc/16/43/26/948164326.db2.gz ISJBQPLBSYCXQF-UHFFFAOYSA-N 0 0 369.450 3.543 20 5 FHBDRN C/C=C/c1ccc(OCC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])c(OC)c1 ZINC000019160164 948164653 /nfs/dbraw/zinc/16/46/53/948164653.db2.gz PZWDMUQGLHFKHU-SNAWJCMRSA-N 0 0 372.377 3.663 20 5 FHBDRN O=C(C1CCC1)N(CCCNc1ccnc2c1cccc2[N+](=O)[O-])C1CC1 ZINC000432343082 948169831 /nfs/dbraw/zinc/16/98/31/948169831.db2.gz QZRJLXVVKQUZKW-UHFFFAOYSA-N 0 0 368.437 3.736 20 5 FHBDRN COC(=O)[C@H]1CC[C@H](Nc2nc(-c3ccccc3)ccc2[N+](=O)[O-])CC1 ZINC001167828373 948177909 /nfs/dbraw/zinc/17/79/09/948177909.db2.gz SXBPCJWNYDMVPV-SHTZXODSSA-N 0 0 355.394 3.801 20 5 FHBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CCC2(CCC2)C1 ZINC000585701015 948181385 /nfs/dbraw/zinc/18/13/85/948181385.db2.gz LTFVEBZKDRWPSO-UHFFFAOYSA-N 0 0 353.216 3.682 20 5 FHBDRN C[C@H]1CC(=O)Oc2cc(OC(=O)CSc3ccccc3[N+](=O)[O-])ccc21 ZINC000785367999 948206915 /nfs/dbraw/zinc/20/69/15/948206915.db2.gz ZNYUXMGMVOWZBM-NSHDSACASA-N 0 0 373.386 3.705 20 5 FHBDRN COC(=O)[C@@H](CC(C)C)Nc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000520517994 948209214 /nfs/dbraw/zinc/20/92/14/948209214.db2.gz CTIKOJFTGHTIOC-QGZVFWFLSA-N 0 0 370.405 3.825 20 5 FHBDRN Cc1cccc(O[C@H](C)C(=O)O[C@@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)c1 ZINC000759949024 948209168 /nfs/dbraw/zinc/20/91/68/948209168.db2.gz NJIADNCDIPTWDQ-DJIMGWMZSA-N 0 0 373.409 3.594 20 5 FHBDRN Cc1cc(N2CCN(Cc3csc(C(C)(C)C)n3)CC2)ccc1[N+](=O)[O-] ZINC000520514203 948211960 /nfs/dbraw/zinc/21/19/60/948211960.db2.gz IHSDGAICHNSXMH-UHFFFAOYSA-N 0 0 374.510 3.979 20 5 FHBDRN CC[C@@H](C)[C@@H](C)N(C(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1)C1CC1 ZINC000520524446 948229920 /nfs/dbraw/zinc/22/99/20/948229920.db2.gz NRKBGAUTMIORST-ZIAGYGMSSA-N 0 0 356.426 3.820 20 5 FHBDRN CCCN(CC)C(=O)c1ccc(C(=O)N(C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000512028226 948230481 /nfs/dbraw/zinc/23/04/81/948230481.db2.gz ZLYSTJATVLWZQC-UHFFFAOYSA-N 0 0 369.421 3.744 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N[C@H]2CCc3c2cccc3C)cc1OC ZINC000520525005 948232058 /nfs/dbraw/zinc/23/20/58/948232058.db2.gz FRIYFAVQNKVLOI-INIZCTEOSA-N 0 0 370.405 3.728 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CCc3c2cccc3C)cc1OC ZINC000520525007 948232092 /nfs/dbraw/zinc/23/20/92/948232092.db2.gz FRIYFAVQNKVLOI-MRXNPFEDSA-N 0 0 370.405 3.728 20 5 FHBDRN Cn1cnc([N+](=O)[O-])c1NCc1ccc(-c2nc3ccccc3s2)o1 ZINC000585726552 948235683 /nfs/dbraw/zinc/23/56/83/948235683.db2.gz RRRZRDOPJPRJAM-UHFFFAOYSA-N 0 0 355.379 3.810 20 5 FHBDRN CN(C(C)(C)c1ccccc1)S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000585740281 948246573 /nfs/dbraw/zinc/24/65/73/948246573.db2.gz RPIPIQWCLMVYLR-UHFFFAOYSA-N 0 0 368.842 3.804 20 5 FHBDRN Cc1c(NC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)cnn1CCC(C)C ZINC000441549132 948252445 /nfs/dbraw/zinc/25/24/45/948252445.db2.gz DQPVBWPLCQUEFS-UHFFFAOYSA-N 0 0 355.398 3.879 20 5 FHBDRN O=[N+]([O-])c1ccccc1CNc1cc2c(cc1Br)OCCO2 ZINC000126826419 948256343 /nfs/dbraw/zinc/25/63/43/948256343.db2.gz LIUQNXBAGDHQQA-UHFFFAOYSA-N 0 0 365.183 3.741 20 5 FHBDRN CC(C)(C)c1ccc(NC(=O)c2cnn(CC(F)(F)F)c2)cc1[N+](=O)[O-] ZINC000585750759 948257389 /nfs/dbraw/zinc/25/73/89/948257389.db2.gz SIGJLSXVMLPWGK-UHFFFAOYSA-N 0 0 370.331 3.903 20 5 FHBDRN Cc1c(C(=O)N[C@@H](c2ccccc2)C(C)C)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000061239927 948272001 /nfs/dbraw/zinc/27/20/01/948272001.db2.gz QLCXKZYJMNEXIC-QGZVFWFLSA-N 0 0 357.366 3.939 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)NCCc2ccc3c[nH]nc3c2)cc1[N+](=O)[O-] ZINC000585763905 948273732 /nfs/dbraw/zinc/27/37/32/948273732.db2.gz GUHMXGGAZAHQTQ-UHFFFAOYSA-N 0 0 366.421 3.741 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N([C@H](C)[C@H](C)CC)C1CC1 ZINC000520555823 948276563 /nfs/dbraw/zinc/27/65/63/948276563.db2.gz UACHMZZSQZGTOI-CHWSQXEVSA-N 0 0 354.472 3.745 20 5 FHBDRN COC(=O)[C@H]1CCN(C(=O)c2cccc(Cl)c2[N+](=O)[O-])c2ccccc21 ZINC000759955837 948283274 /nfs/dbraw/zinc/28/32/74/948283274.db2.gz JVBSXFASIGISAY-LBPRGKRZSA-N 0 0 374.780 3.555 20 5 FHBDRN CCc1nocc1CN(C)C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000512044896 948288293 /nfs/dbraw/zinc/28/82/93/948288293.db2.gz CXKDSPMFDAPLPF-UHFFFAOYSA-N 0 0 372.406 3.541 20 5 FHBDRN Cc1cc(C(=O)Nc2cn(CC(C)C)nc2C(F)F)ccc1[N+](=O)[O-] ZINC000536441877 948292059 /nfs/dbraw/zinc/29/20/59/948292059.db2.gz KNEZHABDNYRIAH-UHFFFAOYSA-N 0 0 352.341 3.946 20 5 FHBDRN CSc1ccc(C(=O)Oc2ccc(N3CCCC3=O)cc2)cc1[N+](=O)[O-] ZINC000019211354 948296973 /nfs/dbraw/zinc/29/69/73/948296973.db2.gz DZKVBJLFIATWEG-UHFFFAOYSA-N 0 0 372.402 3.663 20 5 FHBDRN Cc1sc(S(=O)(=O)N(CC2CC2)C2CCCCC2)cc1[N+](=O)[O-] ZINC000467424589 948299350 /nfs/dbraw/zinc/29/93/50/948299350.db2.gz UHKQMLLWZWEPFD-UHFFFAOYSA-N 0 0 358.485 3.698 20 5 FHBDRN O=C(Nc1ccc(-n2cnc3ccccc32)nc1)c1ccc([N+](=O)[O-])cc1 ZINC000074236729 948315157 /nfs/dbraw/zinc/31/51/57/948315157.db2.gz BYATXOKWIOJCIJ-UHFFFAOYSA-N 0 0 359.345 3.581 20 5 FHBDRN CC(=O)c1ccc(N2CCC(c3ncc4n3CCCC4)CC2)c([N+](=O)[O-])c1 ZINC000278949577 948327421 /nfs/dbraw/zinc/32/74/21/948327421.db2.gz XAOUJGIFDANDNN-UHFFFAOYSA-N 0 0 368.437 3.714 20 5 FHBDRN COc1ccc(CSCC(=O)N(C)Cc2ccsc2)cc1[N+](=O)[O-] ZINC000046166586 948330106 /nfs/dbraw/zinc/33/01/06/948330106.db2.gz AXLWUHLBESXMQM-UHFFFAOYSA-N 0 0 366.464 3.557 20 5 FHBDRN Cc1cc(C(=O)Nc2ccc(N3CCCC3)cc2C)c(N)c([N+](=O)[O-])c1 ZINC000729512606 948358868 /nfs/dbraw/zinc/35/88/68/948358868.db2.gz MFVAVADBPDZBEW-UHFFFAOYSA-N 0 0 354.410 3.646 20 5 FHBDRN O=C(CC1=CCCCC1)OCC1CCN(c2ccc([N+](=O)[O-])cn2)CC1 ZINC000106988264 948377568 /nfs/dbraw/zinc/37/75/68/948377568.db2.gz XTSXYBIYPNYNNG-UHFFFAOYSA-N 0 0 359.426 3.640 20 5 FHBDRN O=[N+]([O-])c1ccccc1OCCN1CCO[C@H](c2ccccc2Cl)C1 ZINC000507785664 948391336 /nfs/dbraw/zinc/39/13/36/948391336.db2.gz DPQDVZHUDZZWMF-SFHVURJKSA-N 0 0 362.813 3.701 20 5 FHBDRN O=C(O[C@H]([C@H]1CCCOC1)C(F)(F)F)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000279017854 948400858 /nfs/dbraw/zinc/40/08/58/948400858.db2.gz GBEATUMLZASVBN-LKFCYVNXSA-N 0 0 373.283 3.855 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)N[C@H]1CCCOc2ccccc21 ZINC000512096585 948409690 /nfs/dbraw/zinc/40/96/90/948409690.db2.gz ZEUNSUCOACLWLT-SFHVURJKSA-N 0 0 369.421 3.693 20 5 FHBDRN Cc1c(F)ccc([N+](=O)[O-])c1C(=O)N(C)CCCc1nc2ccccc2[nH]1 ZINC000843775683 948412670 /nfs/dbraw/zinc/41/26/70/948412670.db2.gz CBUBWOAQLVJMEH-UHFFFAOYSA-N 0 0 370.384 3.623 20 5 FHBDRN Cn1nc([C@H]2CCCO2)cc1NC(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000279035625 948422072 /nfs/dbraw/zinc/42/20/72/948422072.db2.gz BAKUBNIKHHTQHT-MRXNPFEDSA-N 0 0 372.425 3.730 20 5 FHBDRN CCOc1cc2c(cc1NCc1cc([N+](=O)[O-])ccc1OC)O[C@H](C)C2 ZINC000520625680 948448447 /nfs/dbraw/zinc/44/84/47/948448447.db2.gz WSJWQRSZFHHCHS-GFCCVEGCSA-N 0 0 358.394 3.938 20 5 FHBDRN Cc1c(Br)cccc1Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000536446846 948454667 /nfs/dbraw/zinc/45/46/67/948454667.db2.gz HBLJOOWNMRURGZ-UHFFFAOYSA-N 0 0 373.210 3.973 20 5 FHBDRN CN(C)C(=O)c1ccc(-c2noc(-c3ccc([N+](=O)[O-])cc3Cl)n2)cc1 ZINC000546323015 948494320 /nfs/dbraw/zinc/49/43/20/948494320.db2.gz XQLIZJCMAHYQTE-UHFFFAOYSA-N 0 0 372.768 3.667 20 5 FHBDRN CC(=O)c1cc(F)c(NC(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)c(F)c1 ZINC000520650254 948498403 /nfs/dbraw/zinc/49/84/03/948498403.db2.gz PLJCGCJIICBNJI-UHFFFAOYSA-N 0 0 370.258 3.535 20 5 FHBDRN C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)[C@@H]1C[C@@H]1c1cccc(F)c1F ZINC000150864473 948514085 /nfs/dbraw/zinc/51/40/85/948514085.db2.gz QOSXOYDZSAXDRE-VCTAVGKDSA-N 0 0 358.344 3.954 20 5 FHBDRN Cc1cc(NC(=O)c2ccc([N+](=O)[O-])n2C)ccc1Oc1cccnc1 ZINC000512136357 948520281 /nfs/dbraw/zinc/52/02/81/948520281.db2.gz QVBQLIJPYZFVMI-UHFFFAOYSA-N 0 0 352.350 3.681 20 5 FHBDRN CC1(C)C[C@H](NCc2ncnn2-c2ccccc2)c2cc([N+](=O)[O-])ccc21 ZINC000279146005 948555710 /nfs/dbraw/zinc/55/57/10/948555710.db2.gz SGCZIIXSSOREAB-SFHVURJKSA-N 0 0 363.421 3.688 20 5 FHBDRN COc1cc(CNc2c[nH]cn2)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000520672306 948556973 /nfs/dbraw/zinc/55/69/73/948556973.db2.gz PIQNENZHZJGIDS-UHFFFAOYSA-N 0 0 354.366 3.518 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)OCC(=O)c1ccc2c(c1)CCCC2 ZINC000019285107 948567753 /nfs/dbraw/zinc/56/77/53/948567753.db2.gz JPPKDXXSJHEZCP-UHFFFAOYSA-N 0 0 369.373 3.522 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@](C)(O)CCC(C)C ZINC000120927119 948574471 /nfs/dbraw/zinc/57/44/71/948574471.db2.gz BYTLPYWKBRYORD-QGZVFWFLSA-N 0 0 354.472 3.624 20 5 FHBDRN CC[C@@H]1CCc2nc(NC(=O)c3ccc([N+](=O)[O-])c(OC)c3)sc2C1 ZINC000512155953 948577941 /nfs/dbraw/zinc/57/79/41/948577941.db2.gz LMTURYXSDKQYBQ-SNVBAGLBSA-N 0 0 361.423 3.827 20 5 FHBDRN CC(=O)Nc1cccc2c1CCN(c1ccc([N+](=O)[O-])c3cccnc31)C2 ZINC000054125434 948590297 /nfs/dbraw/zinc/59/02/97/948590297.db2.gz XOKDKFMZBBKUKF-UHFFFAOYSA-N 0 0 362.389 3.664 20 5 FHBDRN O=C(Nc1cccc2c1CCCC2)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000520692703 948601738 /nfs/dbraw/zinc/60/17/38/948601738.db2.gz ZZKKWKLRUJLIEQ-UHFFFAOYSA-N 0 0 362.389 3.912 20 5 FHBDRN C[C@H](OC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)C(=O)c1ccc(F)cc1 ZINC000005671513 948618061 /nfs/dbraw/zinc/61/80/61/948618061.db2.gz YAYWLIFRCMZRMQ-VIFPVBQESA-N 0 0 351.717 3.816 20 5 FHBDRN Cc1cc(C(=O)N2CCC(=Cc3cccc(F)c3)CC2)c(N)c([N+](=O)[O-])c1 ZINC000729522754 948633052 /nfs/dbraw/zinc/63/30/52/948633052.db2.gz QJHPUYZUNZTCAI-UHFFFAOYSA-N 0 0 369.396 3.944 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1OC(F)F)N1CC2(CC2)c2ccccc21 ZINC000182089394 948634277 /nfs/dbraw/zinc/63/42/77/948634277.db2.gz NEIUIWUFGGZCGY-UHFFFAOYSA-N 0 0 360.316 3.888 20 5 FHBDRN Cc1nn(CCC(=O)N2CC[C@@H](c3ccccc3)C[C@@H]2C)c(C)c1[N+](=O)[O-] ZINC000466894571 948634347 /nfs/dbraw/zinc/63/43/47/948634347.db2.gz STYVDPZEUGXRHL-KBXCAEBGSA-N 0 0 370.453 3.593 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N=c2cc(CC3CCCCC3)[nH][nH]2)c1 ZINC000549631829 948642428 /nfs/dbraw/zinc/64/24/28/948642428.db2.gz FCFRCCSWPZACCJ-UHFFFAOYSA-N 0 0 372.425 3.514 20 5 FHBDRN CCN(Cc1ccc(C)cc1)C(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000520711858 948664167 /nfs/dbraw/zinc/66/41/67/948664167.db2.gz ZAQPALSVLFFISP-UHFFFAOYSA-N 0 0 364.405 3.751 20 5 FHBDRN CCc1n[nH]c(C(=O)N[C@@H]2C[C@@H](C)C[C@H](c3ccccc3)C2)c1[N+](=O)[O-] ZINC000412686318 948679381 /nfs/dbraw/zinc/67/93/81/948679381.db2.gz CQJPBAOCPUESLB-AEGPPILISA-N 0 0 356.426 3.583 20 5 FHBDRN Cc1cc(CN2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)ccc1Cl ZINC000507806682 948689038 /nfs/dbraw/zinc/68/90/38/948689038.db2.gz SIVAVAIZNNTFSC-UHFFFAOYSA-N 0 0 373.840 3.515 20 5 FHBDRN C[C@H](NC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1)c1cncc(F)c1 ZINC000459164736 948722659 /nfs/dbraw/zinc/72/26/59/948722659.db2.gz BMDULTXKVKKYSY-LBPRGKRZSA-N 0 0 358.373 3.564 20 5 FHBDRN COc1ccc(OCCSc2nncc3ccccc32)c([N+](=O)[O-])c1 ZINC000150870185 948743894 /nfs/dbraw/zinc/74/38/94/948743894.db2.gz OFVBPVSDDTVOIA-UHFFFAOYSA-N 0 0 357.391 3.718 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[C@H](C)[C@H]1c1cccc(F)c1 ZINC000427632819 948746770 /nfs/dbraw/zinc/74/67/70/948746770.db2.gz GEKXHARAHGXCPN-SGTLLEGYSA-N 0 0 358.369 3.966 20 5 FHBDRN Cc1ccccc1-c1noc(COC(=O)c2c(C)cccc2[N+](=O)[O-])n1 ZINC000026119266 948751875 /nfs/dbraw/zinc/75/18/75/948751875.db2.gz FATNIQGDDKIDEL-UHFFFAOYSA-N 0 0 353.334 3.619 20 5 FHBDRN C[C@@H](NC(=O)CCC(=O)c1ccc(F)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000087142615 948757022 /nfs/dbraw/zinc/75/70/22/948757022.db2.gz DQCRDBMMTLFRBC-LLVKDONJSA-N 0 0 362.332 3.713 20 5 FHBDRN CC(C)c1ccc2c(c1)[C@H](Nc1c(-c3nn[nH]n3)cccc1[N+](=O)[O-])CC2 ZINC001574416783 948760878 /nfs/dbraw/zinc/76/08/78/948760878.db2.gz HUBJLRTZEOVJRI-MRXNPFEDSA-N 0 0 364.409 3.998 20 5 FHBDRN Cc1ccc2c(c1)CC[C@@H]2NC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000520733065 948761741 /nfs/dbraw/zinc/76/17/41/948761741.db2.gz CHPWHFSMPQGCKQ-SFHVURJKSA-N 0 0 362.389 3.506 20 5 FHBDRN Cc1cc(OCC(=O)Nc2ncc(Cl)cc2Cl)ccc1[N+](=O)[O-] ZINC000021589342 948762834 /nfs/dbraw/zinc/76/28/34/948762834.db2.gz DZKMDDPUIZZSIL-UHFFFAOYSA-N 0 0 356.165 3.623 20 5 FHBDRN Cc1ccc([C@@H]2COCCN2Cc2cc([N+](=O)[O-])ccc2OC(C)C)o1 ZINC000523993946 948770094 /nfs/dbraw/zinc/77/00/94/948770094.db2.gz RBMBNURCKJXVSU-KRWDZBQOSA-N 0 0 360.410 3.857 20 5 FHBDRN C[C@@H](NC(=O)NCCCCc1ccc([N+](=O)[O-])cc1)c1cccc(O)c1 ZINC000120417524 948773516 /nfs/dbraw/zinc/77/35/16/948773516.db2.gz VKLYIPRFVBRJCK-CQSZACIVSA-N 0 0 357.410 3.684 20 5 FHBDRN Cc1cccc(C)c1NC(=O)[C@@H](C)OC(=O)c1c(C)cccc1[N+](=O)[O-] ZINC000026122039 948786042 /nfs/dbraw/zinc/78/60/42/948786042.db2.gz CEODBFOGDMTUDE-CQSZACIVSA-N 0 0 356.378 3.704 20 5 FHBDRN CC(C)c1cccc(N(C)Cc2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])c1 ZINC001574419677 948787220 /nfs/dbraw/zinc/78/72/20/948787220.db2.gz IYKGHXYJKPSUBL-UHFFFAOYSA-N 0 0 352.398 3.535 20 5 FHBDRN CCOc1cc(-c2noc(-c3c[nH]c4cc([N+](=O)[O-])ccc43)n2)ccc1O ZINC000445427089 948789660 /nfs/dbraw/zinc/78/96/60/948789660.db2.gz NPDPKVRRURCAOH-UHFFFAOYSA-N 0 0 366.333 3.897 20 5 FHBDRN Cc1ccc(NC(=O)[C@H](C)OC(=O)c2c(C)cccc2[N+](=O)[O-])c(C)c1 ZINC000026121587 948793201 /nfs/dbraw/zinc/79/32/01/948793201.db2.gz QDWDIRDLZYYUJN-AWEZNQCLSA-N 0 0 356.378 3.704 20 5 FHBDRN CCc1ccc(C(=O)Nc2nc(-c3cccs3)ns2)cc1[N+](=O)[O-] ZINC000182121881 948813501 /nfs/dbraw/zinc/81/35/01/948813501.db2.gz XTTGICMRNIUSJL-UHFFFAOYSA-N 0 0 360.420 3.990 20 5 FHBDRN COC(=O)c1cc(-c2nc(-c3c[nH]c4ccccc43)no2)cc([N+](=O)[O-])c1 ZINC000445451322 948814740 /nfs/dbraw/zinc/81/47/40/948814740.db2.gz DDKIBALTHXKGLD-UHFFFAOYSA-N 0 0 364.317 3.580 20 5 FHBDRN CC[C@H]1CCCCN1C(=O)[C@@H](C)OC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000021612214 948818319 /nfs/dbraw/zinc/81/83/19/948818319.db2.gz WDSPBDFGHIHMLT-YPMHNXCESA-N 0 0 368.817 3.585 20 5 FHBDRN CC[C@@H]1CCCCN1C(=O)[C@H](C)OC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000021612217 948818616 /nfs/dbraw/zinc/81/86/16/948818616.db2.gz WDSPBDFGHIHMLT-WCQYABFASA-N 0 0 368.817 3.585 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCC(=O)N2CCC(Cc3ccccc3)CC2)c1 ZINC000021614137 948819013 /nfs/dbraw/zinc/81/90/13/948819013.db2.gz PQIXCPGBKWQONR-UHFFFAOYSA-N 0 0 368.433 3.763 20 5 FHBDRN C[C@@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1cccc2ccccc21 ZINC000007308707 203817787 /nfs/dbraw/zinc/81/77/87/203817787.db2.gz JKGCJIFGWFQHEJ-CYBMUJFWSA-N 0 0 356.403 3.788 20 5 FHBDRN O=C(NCCNc1ccccc1[N+](=O)[O-])c1ccc(Cl)cc1Cl ZINC000008146340 203822410 /nfs/dbraw/zinc/82/24/10/203822410.db2.gz PHOWOOLMOHGTKR-UHFFFAOYSA-N 0 0 354.193 3.744 20 5 FHBDRN COC(=O)c1cc(C(=O)Nc2cccc3ccccc32)cc([N+](=O)[O-])c1 ZINC000003549117 204106123 /nfs/dbraw/zinc/10/61/23/204106123.db2.gz DEJJNGPAQKJSCE-UHFFFAOYSA-N 0 0 350.330 3.787 20 5 FHBDRN CCc1cccc(CC)c1NC(=O)COc1ccc(OC)cc1[N+](=O)[O-] ZINC000005051544 204188119 /nfs/dbraw/zinc/18/81/19/204188119.db2.gz VGXBQNFLQYGVNC-UHFFFAOYSA-N 0 0 358.394 3.746 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(Br)cc1 ZINC000007918033 204310108 /nfs/dbraw/zinc/31/01/08/204310108.db2.gz YQDBYDHXBJIYDV-UHFFFAOYSA-N 0 0 351.156 3.618 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NCC(=O)Nc1ccc(C(F)(F)F)cc1 ZINC000007952711 204311755 /nfs/dbraw/zinc/31/17/55/204311755.db2.gz YBKZEUHYFZCHRR-UHFFFAOYSA-N 0 0 369.299 3.673 20 5 FHBDRN COC(=O)c1cc(C(=O)Nc2cccc3c2CCCC3)cc([N+](=O)[O-])c1 ZINC000015302760 204607652 /nfs/dbraw/zinc/60/76/52/204607652.db2.gz FNQSPIBSUWPZEL-UHFFFAOYSA-N 0 0 354.362 3.513 20 5 FHBDRN COC(=O)c1cc(C(=O)N[C@@H](C)c2ccccc2Cl)cc([N+](=O)[O-])c1 ZINC000017908088 204658023 /nfs/dbraw/zinc/65/80/23/204658023.db2.gz IQGNRMVJVWPVTQ-JTQLQIEISA-N 0 0 362.769 3.526 20 5 FHBDRN Cc1cc(OCC(=O)c2cccc(Br)c2)ccc1[N+](=O)[O-] ZINC000037976312 204761772 /nfs/dbraw/zinc/76/17/72/204761772.db2.gz HAQRVBMPPAVVQL-UHFFFAOYSA-N 0 0 350.168 3.927 20 5 FHBDRN Cc1c(NC(=O)c2cccc(NC(=O)[C@@H]3C[C@@H]3C)c2)cccc1[N+](=O)[O-] ZINC000032660093 204933126 /nfs/dbraw/zinc/93/31/26/204933126.db2.gz RDUGXXHXPSSQLX-XHDPSFHLSA-N 0 0 353.378 3.750 20 5 FHBDRN O=C(c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)N1CCC[C@@H]2CCCC[C@@H]21 ZINC000042382189 205095529 /nfs/dbraw/zinc/09/55/29/205095529.db2.gz AFXSCZOBJHXUIC-KSSFIOAISA-N 0 0 354.410 3.575 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N1CCC[C@@H]1c1ccccc1 ZINC000044771537 205110263 /nfs/dbraw/zinc/11/02/63/205110263.db2.gz DDAXWIVQPSCRHP-CQSZACIVSA-N 0 0 366.826 3.774 20 5 FHBDRN Cc1c(C(=O)N[C@@H](c2nc3ccccc3[nH]2)C(C)C)cccc1[N+](=O)[O-] ZINC000045673944 205123977 /nfs/dbraw/zinc/12/39/77/205123977.db2.gz HNWNPIPXFNGCNJ-QGZVFWFLSA-N 0 0 352.394 3.907 20 5 FHBDRN Cc1cc(C(=O)Nc2ccc(C(=O)NC3CCCC3)cc2)ccc1[N+](=O)[O-] ZINC000047420455 205146258 /nfs/dbraw/zinc/14/62/58/205146258.db2.gz WEXLKKONXYGZLO-UHFFFAOYSA-N 0 0 367.405 3.828 20 5 FHBDRN CCc1nc(NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)sc1C ZINC000047424517 205147076 /nfs/dbraw/zinc/14/70/76/205147076.db2.gz DBJRSCURHOGYAF-UHFFFAOYSA-N 0 0 360.439 3.775 20 5 FHBDRN Cn1ncc2c1CCC[C@@H]2NC(=O)c1cc2ccccc2c2cccnc12 ZINC000052577785 205186087 /nfs/dbraw/zinc/18/60/87/205186087.db2.gz JWLWDSVUKHJCJC-IBGZPJMESA-N 0 0 356.429 3.929 20 5 FHBDRN Cn1ncc2c1CCC[C@H]2NC(=O)c1cc2ccccc2c2cccnc12 ZINC000052577784 205185225 /nfs/dbraw/zinc/18/52/25/205185225.db2.gz JWLWDSVUKHJCJC-LJQANCHMSA-N 0 0 356.429 3.929 20 5 FHBDRN CCN(C(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000057744896 205244301 /nfs/dbraw/zinc/24/43/01/205244301.db2.gz INDAPDNUMISCKC-UHFFFAOYSA-N 0 0 354.341 3.586 20 5 FHBDRN Cc1c(C(=O)N2CCC(COc3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000055423498 205219392 /nfs/dbraw/zinc/21/93/92/205219392.db2.gz QIKSJSDDPCHOEV-UHFFFAOYSA-N 0 0 354.406 3.834 20 5 FHBDRN C[C@H](NC(=O)C1(c2ccccc2)CCOCC1)c1cccc([N+](=O)[O-])c1 ZINC000055467180 205220124 /nfs/dbraw/zinc/22/01/24/205220124.db2.gz KBXKWMZORXXYKY-HNNXBMFYSA-N 0 0 354.406 3.520 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(Br)c(C)c2)c1 ZINC000060063696 205282679 /nfs/dbraw/zinc/28/26/79/205282679.db2.gz DLMABUGIKCWDHP-UHFFFAOYSA-N 0 0 365.183 3.927 20 5 FHBDRN COC(=O)c1cc(C(=O)N[C@@H](c2ccccc2)C(C)(C)C)cc([N+](=O)[O-])c1 ZINC000106217842 206014939 /nfs/dbraw/zinc/01/49/39/206014939.db2.gz GYJAGXSPMAIHGL-KRWDZBQOSA-N 0 0 370.405 3.899 20 5 FHBDRN C[C@H](NC(=O)c1cc(F)cc([N+](=O)[O-])c1N)c1cccc2ccccc21 ZINC000108074742 206026279 /nfs/dbraw/zinc/02/62/79/206026279.db2.gz QGAMBSRKBXIEGO-NSHDSACASA-N 0 0 353.353 3.960 20 5 FHBDRN Cc1ccsc1CN(C)c1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1 ZINC000108308263 206030042 /nfs/dbraw/zinc/03/00/42/206030042.db2.gz KPJMFZKJFPFRRZ-UHFFFAOYSA-N 0 0 359.451 3.837 20 5 FHBDRN Cc1cccc(N(C)C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)c1C ZINC000109271017 206051581 /nfs/dbraw/zinc/05/15/81/206051581.db2.gz SQEZGYZYVVMPKO-UHFFFAOYSA-N 0 0 350.378 3.674 20 5 FHBDRN CC(C)(C)C[C@@H]1CCCN1C(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000109515779 206059643 /nfs/dbraw/zinc/05/96/43/206059643.db2.gz MOQQYNOYJLZIAK-HNNXBMFYSA-N 0 0 356.426 3.821 20 5 FHBDRN O=C(NCc1ccc(Br)cc1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000048816983 206084860 /nfs/dbraw/zinc/08/48/60/206084860.db2.gz VXCFPTKPFJIXMQ-UHFFFAOYSA-N 0 0 369.602 3.941 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)c1cc(Br)cnc1Cl ZINC000050044894 206096606 /nfs/dbraw/zinc/09/66/06/206096606.db2.gz QBKSLRJUCFEQMZ-UHFFFAOYSA-N 0 0 370.590 3.966 20 5 FHBDRN Cc1ccc([C@@H](C)N(C)S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])cc1 ZINC000119563381 206105812 /nfs/dbraw/zinc/10/58/12/206105812.db2.gz JKIYSXPAPNIKCU-GFCCVEGCSA-N 0 0 368.842 3.938 20 5 FHBDRN COc1cc(CNc2ccc([N+](=O)[O-])cc2Cl)cc(OC)c1OC ZINC000007901972 206245681 /nfs/dbraw/zinc/24/56/81/206245681.db2.gz AHNRCYMKNPTUNR-UHFFFAOYSA-N 0 0 352.774 3.886 20 5 FHBDRN COC(=O)c1ccc(OCc2ccc(OC(F)F)cc2)c([N+](=O)[O-])c1 ZINC000060427623 221131967 /nfs/dbraw/zinc/13/19/67/221131967.db2.gz GXNJZISBNCXIFI-UHFFFAOYSA-N 0 0 353.277 3.562 20 5 FHBDRN Cc1c(CN(C)[C@H]2CCCN(c3ccccc3)C2=O)cccc1[N+](=O)[O-] ZINC000078736890 132191651 /nfs/dbraw/zinc/19/16/51/132191651.db2.gz JFWCZQIYKAJPTQ-IBGZPJMESA-N 0 0 353.422 3.531 20 5 FHBDRN CC(=O)c1ccc(N2CCN(c3cccc(C)c3C)CC2)c([N+](=O)[O-])c1 ZINC000008178115 132373709 /nfs/dbraw/zinc/37/37/09/132373709.db2.gz YFSDTECIDHREBF-UHFFFAOYSA-N 0 0 353.422 3.741 20 5 FHBDRN C[C@@H](NS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1)[C@@H](C)C1CCCCC1 ZINC000481360605 567818966 /nfs/dbraw/zinc/81/89/66/567818966.db2.gz PEZFDTAHHPQDAE-ZIAGYGMSSA-N 0 0 354.472 3.619 20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])N(CC(F)F)c1ccc(F)cc1 ZINC000490322799 567820933 /nfs/dbraw/zinc/82/09/33/567820933.db2.gz ZEXXMVCBLFBELJ-UHFFFAOYSA-N 0 0 367.327 3.834 20 5 FHBDRN O=C(NCCCOCCc1ccccc1)Nc1ccc([N+](=O)[O-])cc1F ZINC000541786462 567821467 /nfs/dbraw/zinc/82/14/67/567821467.db2.gz SEYZQZDESVJUEQ-UHFFFAOYSA-N 0 0 361.373 3.505 20 5 FHBDRN C[C@H](N(C)S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])C(C)(C)C ZINC000568056427 567822543 /nfs/dbraw/zinc/82/25/43/567822543.db2.gz PWMPINVUAYRXJN-VIFPVBQESA-N 0 0 368.377 3.669 20 5 FHBDRN Cc1cccc2c1O[C@@H](C(=O)N1CCC[C@H](c3ccc([N+](=O)[O-])cc3)C1)C2 ZINC000452863793 567828885 /nfs/dbraw/zinc/82/88/85/567828885.db2.gz MGEOBQODCMAKFF-PKOBYXMFSA-N 0 0 366.417 3.613 20 5 FHBDRN COc1cccc(F)c1C(=O)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452865296 567830333 /nfs/dbraw/zinc/83/03/33/567830333.db2.gz WURNKVWNIZHUDH-CQSZACIVSA-N 0 0 358.369 3.762 20 5 FHBDRN CN(CCOc1ccccc1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1F ZINC000541787404 567830996 /nfs/dbraw/zinc/83/09/96/567830996.db2.gz PEQWGRBQBNWFJF-UHFFFAOYSA-N 0 0 367.764 3.930 20 5 FHBDRN O=C(NCc1ccc(OC(F)(F)F)cc1)Nc1ccc([N+](=O)[O-])cc1F ZINC000541785730 567831184 /nfs/dbraw/zinc/83/11/84/567831184.db2.gz GFOFDCCJRJOZJW-UHFFFAOYSA-N 0 0 373.262 3.954 20 5 FHBDRN CC(=O)c1ccc([N+](=O)[O-])cc1N1CCN([C@H](C)c2ccsc2)CC1 ZINC000568066448 567832339 /nfs/dbraw/zinc/83/23/39/567832339.db2.gz ALLRWSISYRCNOB-CYBMUJFWSA-N 0 0 359.451 3.742 20 5 FHBDRN COCc1ccc(C(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000452862198 567834365 /nfs/dbraw/zinc/83/43/65/567834365.db2.gz DAUQAKDVAJFQAJ-SFHVURJKSA-N 0 0 354.406 3.761 20 5 FHBDRN Cc1oc(C2CC2)nc1C(=O)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452865426 567834544 /nfs/dbraw/zinc/83/45/44/567834544.db2.gz XCMMBBFKACFIJE-HNNXBMFYSA-N 0 0 355.394 3.788 20 5 FHBDRN C[NH+](C)Cc1cccc(C(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000452862605 567835184 /nfs/dbraw/zinc/83/51/84/567835184.db2.gz UXXCXSBWMNWPLL-LJQANCHMSA-N 0 0 367.449 3.676 20 5 FHBDRN Cc1cccc2c1O[C@H](C(=O)N1CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C1)C2 ZINC000452863791 567835564 /nfs/dbraw/zinc/83/55/64/567835564.db2.gz MGEOBQODCMAKFF-MJGOQNOKSA-N 0 0 366.417 3.613 20 5 FHBDRN C[C@H]1Cc2cccc(C(=O)N3CCC[C@H](c4ccc([N+](=O)[O-])cc4)C3)c2O1 ZINC000452875295 567853786 /nfs/dbraw/zinc/85/37/86/567853786.db2.gz VBIBCKNHJBKZHE-YOEHRIQHSA-N 0 0 366.417 3.938 20 5 FHBDRN CO[C@H](C)c1cccc(NS(=O)(=O)c2cc(C)cc([N+](=O)[O-])c2C)c1 ZINC000541801516 567857159 /nfs/dbraw/zinc/85/71/59/567857159.db2.gz ZUUYAOXQLBHNFL-CYBMUJFWSA-N 0 0 364.423 3.720 20 5 FHBDRN Cc1cc(NC(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)nn1[C@H](C)C1CC1 ZINC000481376872 567863310 /nfs/dbraw/zinc/86/33/10/567863310.db2.gz RWIAAOQKMBPBCI-CYBMUJFWSA-N 0 0 357.414 3.753 20 5 FHBDRN O=C(c1cc(Cl)ccc1O)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452878207 567874972 /nfs/dbraw/zinc/87/49/72/567874972.db2.gz MPNYWOTVYJJCRR-ZDUSSCGKSA-N 0 0 360.797 3.974 20 5 FHBDRN CC[C@@H](CNC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)CC(F)(F)F ZINC000412633625 567881226 /nfs/dbraw/zinc/88/12/26/567881226.db2.gz XJRRXEDTUPMFOT-GFCCVEGCSA-N 0 0 373.375 3.903 20 5 FHBDRN C[C@@H]1C[C@H](CNC(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)[C@@H](C)O1 ZINC000412637969 567881240 /nfs/dbraw/zinc/88/12/40/567881240.db2.gz HQHZPOCARGSVAS-IIAWOOMASA-N 0 0 369.421 3.882 20 5 FHBDRN C[C@@H](O)C[C@H](CNC(=O)c1cc(Cl)cc([N+](=O)[O-])c1)c1ccccc1 ZINC000159182964 567900385 /nfs/dbraw/zinc/90/03/85/567900385.db2.gz GUQZREFYCYWVKJ-IUODEOHRSA-N 0 0 362.813 3.533 20 5 FHBDRN CS(=O)(=O)c1ccc(N[C@H]2CCc3sc(Cl)cc32)c([N+](=O)[O-])c1 ZINC000568123971 567900388 /nfs/dbraw/zinc/90/03/88/567900388.db2.gz JDXWMJZHQBCCFC-JTQLQIEISA-N 0 0 372.855 3.813 20 5 FHBDRN COCc1ccccc1C(=O)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452892372 567903547 /nfs/dbraw/zinc/90/35/47/567903547.db2.gz VZCAGQKKNCMYLA-MRXNPFEDSA-N 0 0 354.406 3.761 20 5 FHBDRN O=C(c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)N1CC2(CCC2)c2ccccc21 ZINC000481411138 567905435 /nfs/dbraw/zinc/90/54/35/567905435.db2.gz DCNHPWMACIEOIJ-UHFFFAOYSA-N 0 0 374.400 3.863 20 5 FHBDRN CN(CC(C)(C)CO)C(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000452896092 567908504 /nfs/dbraw/zinc/90/85/04/567908504.db2.gz CZMHHDBALCVKPA-UHFFFAOYSA-N 0 0 374.462 3.837 20 5 FHBDRN COC(=O)c1ccc([C@@H](NCc2cccc([N+](=O)[O-])c2)C(F)(F)F)cc1 ZINC000481419323 567908934 /nfs/dbraw/zinc/90/89/34/567908934.db2.gz VYOLHUDEVQLWGY-OAHLLOKOSA-N 0 0 368.311 3.775 20 5 FHBDRN CC(C)C[C@H](C)n1nccc1NC(=O)NCCNc1ccc([N+](=O)[O-])cc1 ZINC000481436238 567937056 /nfs/dbraw/zinc/93/70/56/567937056.db2.gz BOUINRZDDPTNIR-AWEZNQCLSA-N 0 0 374.445 3.632 20 5 FHBDRN COC(=O)c1cc(C)nc(N[C@H]2CCc3sc(Cl)cc32)c1[N+](=O)[O-] ZINC000568151018 567947879 /nfs/dbraw/zinc/94/78/79/567947879.db2.gz DMQQFGQZFRSWNH-JTQLQIEISA-N 0 0 367.814 3.899 20 5 FHBDRN Cc1cccc2[nH]cc(CCNC(=O)Nc3ccc([N+](=O)[O-])cc3F)c21 ZINC000541834949 567955646 /nfs/dbraw/zinc/95/56/46/567955646.db2.gz UFCFGEQHVVIFMC-UHFFFAOYSA-N 0 0 356.357 3.888 20 5 FHBDRN Cc1c(CNC(=O)c2cc(-c3ccccc3)ns2)cccc1[N+](=O)[O-] ZINC000481468429 567966083 /nfs/dbraw/zinc/96/60/83/567966083.db2.gz VTKFYOREZMXEKL-UHFFFAOYSA-N 0 0 353.403 3.957 20 5 FHBDRN COc1cc(C(=O)NCc2cccc([N+](=O)[O-])c2C)ccc1OCC(C)C ZINC000481463733 567967722 /nfs/dbraw/zinc/96/77/22/567967722.db2.gz IJHZMGSMPZPIIO-UHFFFAOYSA-N 0 0 372.421 3.877 20 5 FHBDRN Cc1c(CNC(=O)Cc2cccc(OC(F)(F)F)c2)cccc1[N+](=O)[O-] ZINC000481469841 567970190 /nfs/dbraw/zinc/97/01/90/567970190.db2.gz VOVUBKHVJOSZOM-UHFFFAOYSA-N 0 0 368.311 3.661 20 5 FHBDRN Cc1c(C(=O)NCc2cccc([N+](=O)[O-])c2C)cnn1C1CCCCC1 ZINC000481468806 567970438 /nfs/dbraw/zinc/97/04/38/567970438.db2.gz UCCDQIUDHGQNIX-UHFFFAOYSA-N 0 0 356.426 3.843 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1C[C@@H](C)O[C@H]1C ZINC000412649455 567983134 /nfs/dbraw/zinc/98/31/34/567983134.db2.gz JWIZZJWMVRFJGA-AGIUHOORSA-N 0 0 352.456 3.640 20 5 FHBDRN CC(C)(CCc1noc(-c2cccc(NC(=O)c3ccco3)c2)n1)[N+](=O)[O-] ZINC000291034762 567984037 /nfs/dbraw/zinc/98/40/37/567984037.db2.gz FNJFCQCNIZSKCP-UHFFFAOYSA-N 0 0 370.365 3.570 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCC(Nc3ccccc3N3CCCC3)CC2)cn1 ZINC000602490743 567986136 /nfs/dbraw/zinc/98/61/36/567986136.db2.gz DZRMZXMQLYUMSK-UHFFFAOYSA-N 0 0 367.453 3.671 20 5 FHBDRN O=[N+]([O-])c1sc(CN[C@H]2CCc3c2cccc3O)cc1Br ZINC000602543012 567989858 /nfs/dbraw/zinc/98/98/58/567989858.db2.gz DNEIFAANDUTDFL-LBPRGKRZSA-N 0 0 369.240 3.902 20 5 FHBDRN Cc1ccc(C2(C(=O)NCc3cccc([N+](=O)[O-])c3C)CCOCC2)cc1 ZINC000481485663 567991630 /nfs/dbraw/zinc/99/16/30/567991630.db2.gz WORXWVVHQBTOLD-UHFFFAOYSA-N 0 0 368.433 3.576 20 5 FHBDRN COc1ccc([C@@H](C)NC(=O)Nc2ccc([N+](=O)[O-])cc2)c(C)c1OC ZINC000481487548 567992408 /nfs/dbraw/zinc/99/24/08/567992408.db2.gz VCGCWGAFNLIHQU-GFCCVEGCSA-N 0 0 359.382 3.803 20 5 FHBDRN COc1ccc(COCCCC(=O)NCc2cccc([N+](=O)[O-])c2C)cc1 ZINC000481483495 567992775 /nfs/dbraw/zinc/99/27/75/567992775.db2.gz UEHFJEXPHRNUBJ-UHFFFAOYSA-N 0 0 372.421 3.525 20 5 FHBDRN CC(C)(CCc1noc(CCC(=O)c2ccc(Cl)cc2)n1)[N+](=O)[O-] ZINC000291075948 568007337 /nfs/dbraw/zinc/00/73/37/568007337.db2.gz MMMZFHWCURRJQH-UHFFFAOYSA-N 0 0 351.790 3.526 20 5 FHBDRN CN(C)[C@H](CNC(=O)c1cc(Cl)cc(Cl)c1[N+](=O)[O-])c1ccco1 ZINC000291080199 568013971 /nfs/dbraw/zinc/01/39/71/568013971.db2.gz GMRVBXUHRICASZ-GFCCVEGCSA-N 0 0 372.208 3.527 20 5 FHBDRN CC[C@@H](NC(=O)c1ccccc1)c1noc(-c2cccc([N+](=O)[O-])c2C)n1 ZINC000568327487 568024722 /nfs/dbraw/zinc/02/47/22/568024722.db2.gz CXWZNGQENMXYFV-OAHLLOKOSA-N 0 0 366.377 3.834 20 5 FHBDRN Cc1ccc(Cc2noc(Cn3ccc4cc([N+](=O)[O-])ccc43)n2)s1 ZINC000568326929 568024766 /nfs/dbraw/zinc/02/47/66/568024766.db2.gz CLYSQNBZGPDTQP-UHFFFAOYSA-N 0 0 354.391 3.942 20 5 FHBDRN COc1ccc(CCc2nc(CCC(C)(C)[N+](=O)[O-])no2)cc1Cl ZINC000291088048 568025096 /nfs/dbraw/zinc/02/50/96/568025096.db2.gz OXDYRSZXTJTPPA-UHFFFAOYSA-N 0 0 353.806 3.505 20 5 FHBDRN O=C(N[C@@H]1CCC[C@@H](c2nc3ccccc3[nH]2)C1)c1ccc([N+](=O)[O-])s1 ZINC000568394160 568030475 /nfs/dbraw/zinc/03/04/75/568030475.db2.gz FYLSHQUQWOXSDF-VXGBXAGGSA-N 0 0 370.434 3.989 20 5 FHBDRN O=c1[nH]c(N[C@H]2C[C@H](c3ccc(Cl)cc3)C2)nc2ccc([N+](=O)[O-])cc12 ZINC000568425980 568034740 /nfs/dbraw/zinc/03/47/40/568034740.db2.gz GQSMFEXQOUHYKB-AULYBMBSSA-N 0 0 370.796 3.677 20 5 FHBDRN O=C(c1c[nH]c(-c2ccccc2)n1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000481542226 568037580 /nfs/dbraw/zinc/03/75/80/568037580.db2.gz HPZZQLBWHHZASL-UHFFFAOYSA-N 0 0 362.389 3.790 20 5 FHBDRN Cc1ccsc1-c1noc(-c2nnn(-c3cccc([N+](=O)[O-])c3)c2C)n1 ZINC000568452026 568039432 /nfs/dbraw/zinc/03/94/32/568039432.db2.gz FUISJVOXIQSKHO-UHFFFAOYSA-N 0 0 368.378 3.571 20 5 FHBDRN C[C@H]1SCCN(c2nnc(-c3cccc([N+](=O)[O-])c3)n2C2CC2)[C@H]1C ZINC000568523572 568046131 /nfs/dbraw/zinc/04/61/31/568046131.db2.gz IAMGEULYRUAUKT-NWDGAFQWSA-N 0 0 359.455 3.518 20 5 FHBDRN C[C@H]([NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1)c1cccc(N2CCCC2)c1 ZINC000181873085 568049545 /nfs/dbraw/zinc/04/95/45/568049545.db2.gz HVEWWEXITLBLRI-YWZLYKJASA-N 0 0 355.438 3.579 20 5 FHBDRN Cc1cc(F)cc2[nH]c(C(=O)N(C)CCc3ccccc3[N+](=O)[O-])cc21 ZINC000568544877 568050089 /nfs/dbraw/zinc/05/00/89/568050089.db2.gz WEHDEBZGTYWXCZ-UHFFFAOYSA-N 0 0 355.369 3.838 20 5 FHBDRN O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)N1CCC[C@H]1C1CCCCC1 ZINC000568554632 568050967 /nfs/dbraw/zinc/05/09/67/568050967.db2.gz JSAUPVBIZKQLGO-KRWDZBQOSA-N 0 0 352.381 3.987 20 5 FHBDRN Cn1cccc1[C@@H]1CCCN1C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000072905332 568057081 /nfs/dbraw/zinc/05/70/81/568057081.db2.gz KUJOQQMQMZDZPM-SFHVURJKSA-N 0 0 368.437 3.511 20 5 FHBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCCC[C@H]2c2ccccc2)c(F)c1 ZINC000568573558 568058489 /nfs/dbraw/zinc/05/84/89/568058489.db2.gz CJMNEQRNIJCLHS-INIZCTEOSA-N 0 0 364.398 3.650 20 5 FHBDRN CCNc1ccc(C(=O)NC[C@H]2CCO[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000481578556 568059562 /nfs/dbraw/zinc/05/95/62/568059562.db2.gz DBMOWGHCNRJRSH-VQIMIIECSA-N 0 0 369.421 3.534 20 5 FHBDRN O=C(NCCNc1ccc([N+](=O)[O-])cc1)Nc1ccccc1OCC1CC1 ZINC000568575078 568061151 /nfs/dbraw/zinc/06/11/51/568061151.db2.gz BEAWZXHZSYCHHZ-UHFFFAOYSA-N 0 0 370.409 3.617 20 5 FHBDRN CN(C)c1ccccc1NC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000481608466 568065196 /nfs/dbraw/zinc/06/51/96/568065196.db2.gz FDMORKHGWCHYKC-UHFFFAOYSA-N 0 0 362.817 3.678 20 5 FHBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])Nc1cc(F)ccc1F ZINC000481611490 568065399 /nfs/dbraw/zinc/06/53/99/568065399.db2.gz LAMNBYKIPGTFAI-UHFFFAOYSA-N 0 0 355.728 3.891 20 5 FHBDRN CC(C)n1cc(NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)cn1 ZINC000066386828 568066187 /nfs/dbraw/zinc/06/61/87/568066187.db2.gz BSUWRPFZUSLNNU-UHFFFAOYSA-N 0 0 357.395 3.748 20 5 FHBDRN C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC(O)(Cc2ccc(F)cc2)CC1 ZINC000481623567 568070525 /nfs/dbraw/zinc/07/05/25/568070525.db2.gz NOBDAKPEWPRORK-OAHLLOKOSA-N 0 0 358.413 3.865 20 5 FHBDRN CCC1CCC(N(C)C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)CC1 ZINC000481688077 568089227 /nfs/dbraw/zinc/08/92/27/568089227.db2.gz VETULQWXTLPXPN-UHFFFAOYSA-N 0 0 356.426 3.821 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(N2CCN(c3cccc(C(F)(F)F)c3)CC2)n1 ZINC000481709400 568091195 /nfs/dbraw/zinc/09/11/95/568091195.db2.gz FRLKBNVQDHGWCS-UHFFFAOYSA-N 0 0 366.343 3.644 20 5 FHBDRN Cc1cc(CNc2ncnc3sc([N+](=O)[O-])cc32)cc(N2CCCC2)n1 ZINC000291263435 568093003 /nfs/dbraw/zinc/09/30/03/568093003.db2.gz ZGYZVZYAXOSHSG-UHFFFAOYSA-N 0 0 370.438 3.515 20 5 FHBDRN COc1cc(C[NH2+]CCC2(F)CCC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000568683923 568122497 /nfs/dbraw/zinc/12/24/97/568122497.db2.gz DXXIATLWSHEKGR-UHFFFAOYSA-N 0 0 362.348 3.619 20 5 FHBDRN O=C(N[C@H]1C[C@H](c2ccc(F)cc2)C1)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000481790259 568124960 /nfs/dbraw/zinc/12/49/60/568124960.db2.gz AUJMXWYRXYPXSK-MQMHXKEQSA-N 0 0 353.353 3.891 20 5 FHBDRN COc1ccc(-c2ccc(CNc3ccn(C(C)C)n3)o2)c([N+](=O)[O-])c1 ZINC000481808441 568131607 /nfs/dbraw/zinc/13/16/07/568131607.db2.gz ASPSPHXBJLSDMN-UHFFFAOYSA-N 0 0 356.382 3.675 20 5 FHBDRN Cc1cc(N2CCC[C@@H](c3ncc[nH]3)C2)c(Br)cc1[N+](=O)[O-] ZINC000568706052 568132562 /nfs/dbraw/zinc/13/25/62/568132562.db2.gz XZAHJGORNNTSBB-LLVKDONJSA-N 0 0 365.231 3.773 20 5 FHBDRN O=[N+]([O-])c1cccc(CSc2nnc([C@H]3COc4ccccc4O3)o2)c1 ZINC000026435705 568133855 /nfs/dbraw/zinc/13/38/55/568133855.db2.gz QSQQYZZGXPVUKI-OAHLLOKOSA-N 0 0 371.374 3.783 20 5 FHBDRN O=[N+]([O-])c1cc(C(F)(F)F)c(Cl)cc1NC[C@@H](O)c1ccncc1 ZINC000128666228 568134565 /nfs/dbraw/zinc/13/45/65/568134565.db2.gz HWTADZXJMDLYEK-CYBMUJFWSA-N 0 0 361.707 3.808 20 5 FHBDRN Cc1cc(=O)n(Cc2ccc(OCc3ccc(F)cc3)cc2)cc1[N+](=O)[O-] ZINC000128664373 568134573 /nfs/dbraw/zinc/13/45/73/568134573.db2.gz DHXZSOFGZBOKNK-UHFFFAOYSA-N 0 0 368.364 3.831 20 5 FHBDRN CCOc1ccc(C(=O)N[C@@H](c2ccccc2)C(F)F)cc1[N+](=O)[O-] ZINC000481825809 568138647 /nfs/dbraw/zinc/13/86/47/568138647.db2.gz QBDUNLXNHYFRMS-HNNXBMFYSA-N 0 0 350.321 3.730 20 5 FHBDRN CC[C@@H]1CCC[C@H](NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C1 ZINC000128690876 568139858 /nfs/dbraw/zinc/13/98/58/568139858.db2.gz SYAHCTQEJLDRIB-WBVHZDCISA-N 0 0 359.470 3.896 20 5 FHBDRN Cc1ccc(-n2ncc(NC(=O)c3ccc([N+](=O)[O-])[nH]3)c2C(C)C)cc1 ZINC000481864471 568145123 /nfs/dbraw/zinc/14/51/23/568145123.db2.gz KDPNNZZEOFTFID-UHFFFAOYSA-N 0 0 353.382 3.793 20 5 FHBDRN O=C(c1c[nH]c2ccc([N+](=O)[O-])cc12)N1CC[C@@H](Oc2cccc(F)c2)C1 ZINC000181896483 568148885 /nfs/dbraw/zinc/14/88/85/568148885.db2.gz WPMJOWQPURXTHN-OAHLLOKOSA-N 0 0 369.352 3.509 20 5 FHBDRN O=C(c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1)N1CCCC[C@H]1CCO ZINC000128677198 568153523 /nfs/dbraw/zinc/15/35/23/568153523.db2.gz YYZKMULJXBHQQF-KRWDZBQOSA-N 0 0 369.421 3.716 20 5 FHBDRN Cc1nc(CCNC(=O)c2cc(Cl)cc(Cl)c2[N+](=O)[O-])sc1C ZINC000291438233 568160168 /nfs/dbraw/zinc/16/01/68/568160168.db2.gz YRNLSYYGIDTVPJ-UHFFFAOYSA-N 0 0 374.249 3.947 20 5 FHBDRN COC(=O)c1cc(OCC(=O)c2ccc(C(C)(C)C)cc2)ccc1[N+](=O)[O-] ZINC000481904342 568180273 /nfs/dbraw/zinc/18/02/73/568180273.db2.gz ZWEIEJVTWDBHEN-UHFFFAOYSA-N 0 0 371.389 3.941 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCOC[C@@H]2C2CCC2)nc1OCc1ccccc1 ZINC000568756062 568181452 /nfs/dbraw/zinc/18/14/52/568181452.db2.gz ICMGZORPOVTJPN-GOSISDBHSA-N 0 0 369.421 3.574 20 5 FHBDRN Cc1cc(C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)nn1-c1ccccc1 ZINC000603966957 568191411 /nfs/dbraw/zinc/19/14/11/568191411.db2.gz RFWQHCWRUFTUKH-AWEZNQCLSA-N 0 0 350.378 3.580 20 5 FHBDRN Cc1cc(NC[C@H](c2ccco2)[NH+]2CCCCC2)cc(C(=O)[O-])c1[N+](=O)[O-] ZINC000568766963 568193133 /nfs/dbraw/zinc/19/31/33/568193133.db2.gz IQIMNYZSXJDGGG-MRXNPFEDSA-N 0 0 373.409 3.834 20 5 FHBDRN CCCOc1ccc(NS(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)c(C)c1 ZINC000603986979 568195146 /nfs/dbraw/zinc/19/51/46/568195146.db2.gz FACZJBCTNRNWIV-UHFFFAOYSA-N 0 0 364.423 3.801 20 5 FHBDRN CCCOc1cn(-c2ccccc2)nc1C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000481954531 568196898 /nfs/dbraw/zinc/19/68/98/568196898.db2.gz XBZIBZSRIMFXNQ-UHFFFAOYSA-N 0 0 366.377 3.822 20 5 FHBDRN CO[C@H](C)c1cccc(NS(=O)(=O)c2c(C)cc([N+](=O)[O-])cc2C)c1 ZINC000481965578 568200195 /nfs/dbraw/zinc/20/01/95/568200195.db2.gz DYLMLDOBJDXQTK-CYBMUJFWSA-N 0 0 364.423 3.720 20 5 FHBDRN Cc1cccc([C@H]2CCCN2S(=O)(=O)c2cc([N+](=O)[O-])ccc2C)c1 ZINC000604042956 568203337 /nfs/dbraw/zinc/20/33/37/568203337.db2.gz PRVQWCDKALEOTI-QGZVFWFLSA-N 0 0 360.435 3.737 20 5 FHBDRN COc1ccc(CNC(=O)N[C@H](c2ccccc2)C2CC2)cc1[N+](=O)[O-] ZINC000604082273 568209291 /nfs/dbraw/zinc/20/92/91/568209291.db2.gz QNBCMEWYVXPGBJ-GOSISDBHSA-N 0 0 355.394 3.554 20 5 FHBDRN C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000481981468 568213427 /nfs/dbraw/zinc/21/34/27/568213427.db2.gz CLBNORRROISBNF-BXKDBHETSA-N 0 0 364.751 3.980 20 5 FHBDRN C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)CSc1ccccc1[N+](=O)[O-] ZINC000481982760 568213531 /nfs/dbraw/zinc/21/35/31/568213531.db2.gz HAPDZEWZUGHTBM-MNOVXSKESA-N 0 0 362.373 3.876 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1N[C@@H]1CCN(C(=O)CCc2ccccc2)C1 ZINC000128725688 568218573 /nfs/dbraw/zinc/21/85/73/568218573.db2.gz UWYYZCHVPYZGAN-QGZVFWFLSA-N 0 0 353.422 3.549 20 5 FHBDRN CCCCn1nnnc1COc1ccc(-c2ccccc2)cc1[N+](=O)[O-] ZINC000517914922 568219347 /nfs/dbraw/zinc/21/93/47/568219347.db2.gz GJVPEQYYCIDARQ-UHFFFAOYSA-N 0 0 353.382 3.627 20 5 FHBDRN CCc1noc(COc2ccc(Oc3nc(C)ccc3[N+](=O)[O-])cc2)n1 ZINC000481998221 568219877 /nfs/dbraw/zinc/21/98/77/568219877.db2.gz BTTZTMLZMLQKJH-UHFFFAOYSA-N 0 0 356.338 3.615 20 5 FHBDRN C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1c[nH]c2ccc([N+](=O)[O-])cc21 ZINC000482005296 568226305 /nfs/dbraw/zinc/22/63/05/568226305.db2.gz KIZVOKOGOSDZPZ-NOZJJQNGSA-N 0 0 355.316 3.879 20 5 FHBDRN C[C@@H](C(=O)N1CC[C@@H](c2c(F)cccc2F)C1)c1cccc([N+](=O)[O-])c1 ZINC000568818768 568228423 /nfs/dbraw/zinc/22/84/23/568228423.db2.gz OYYMFIMLCMSKTB-TZMCWYRMSA-N 0 0 360.360 3.993 20 5 FHBDRN C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1c[nH]c2cc([N+](=O)[O-])ccc21 ZINC000482021626 568228633 /nfs/dbraw/zinc/22/86/33/568228633.db2.gz NOMVZCIQPJSQST-RNCFNFMXSA-N 0 0 355.316 3.879 20 5 FHBDRN CCn1c(C)nc([N+](=O)[O-])c1Nc1ccc(NC(=O)CC(F)(F)F)cc1 ZINC000568805438 568228876 /nfs/dbraw/zinc/22/88/76/568228876.db2.gz UXXQABKDKFMJMI-UHFFFAOYSA-N 0 0 371.319 3.754 20 5 FHBDRN CCc1nc([C@@H](C)NC(=O)NC(C)(C)c2ccccc2[N+](=O)[O-])cs1 ZINC000291621561 568230451 /nfs/dbraw/zinc/23/04/51/568230451.db2.gz AUALIMJXVAMXPH-LLVKDONJSA-N 0 0 362.455 3.909 20 5 FHBDRN O=C(N[C@@H]1CCO[C@@H](C2CC2)C1)c1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000291631044 568232503 /nfs/dbraw/zinc/23/25/03/568232503.db2.gz FOSULOLKQUKVRX-ZWNOBZJWSA-N 0 0 359.209 3.589 20 5 FHBDRN COc1ccc2c(c1NC(=O)CCCNc1ccc([N+](=O)[O-])cc1)CCC2 ZINC000482032652 568232984 /nfs/dbraw/zinc/23/29/84/568232984.db2.gz PLRLSRZWFQCKMS-UHFFFAOYSA-N 0 0 369.421 3.923 20 5 FHBDRN Cc1ccc(CNc2c(F)cccc2[N+](=O)[O-])c(-n2cc(Cl)cn2)n1 ZINC000568861310 568237441 /nfs/dbraw/zinc/23/74/41/568237441.db2.gz HNQIQKZYZCCEGF-UHFFFAOYSA-N 0 0 361.764 3.889 20 5 FHBDRN COc1ccc2c(c1)C[C@H](C)N(C(=O)Cc1cccc([N+](=O)[O-])c1C)[C@@H]2C ZINC000541933592 568249377 /nfs/dbraw/zinc/24/93/77/568249377.db2.gz SMHUCMNMSANEBF-DZGCQCFKSA-N 0 0 368.433 3.989 20 5 FHBDRN CC[C@H](CNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)CC(F)(F)F ZINC000412653879 568250985 /nfs/dbraw/zinc/25/09/85/568250985.db2.gz ITJGFXVXPAXQIC-NSHDSACASA-N 0 0 360.332 3.653 20 5 FHBDRN O=C(NCCC[C@@H]1CCCCO1)c1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000291659446 568251564 /nfs/dbraw/zinc/25/15/64/568251564.db2.gz HNSBEESSMBEEJU-NSHDSACASA-N 0 0 361.225 3.981 20 5 FHBDRN CC(C)(C)n1ncnc1CNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000291665737 568252471 /nfs/dbraw/zinc/25/24/71/568252471.db2.gz VUVUJCNDPQYWBE-UHFFFAOYSA-N 0 0 358.229 3.538 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H](C1CC1)C(F)(F)F ZINC000568929547 568253387 /nfs/dbraw/zinc/25/33/87/568253387.db2.gz FZMNEOOIJRERIH-CQSZACIVSA-N 0 0 359.348 3.856 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(NCCOc2ccc(C(F)(F)F)cn2)n1 ZINC000541935178 568254453 /nfs/dbraw/zinc/25/44/53/568254453.db2.gz LTDBQSCMEULLGI-UHFFFAOYSA-N 0 0 356.304 3.511 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)NC[C@H]1CCO[C@@H]1c1ccccc1 ZINC000482077999 568254903 /nfs/dbraw/zinc/25/49/03/568254903.db2.gz QTNDENTUPQZWGW-VQIMIIECSA-N 0 0 369.421 3.514 20 5 FHBDRN CC(C)N(Cc1cccc(F)c1)C(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000517927427 568255550 /nfs/dbraw/zinc/25/55/50/568255550.db2.gz NMANLYALMBBENG-UHFFFAOYSA-N 0 0 360.385 3.940 20 5 FHBDRN CCOCc1nc([C@H](C)NCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)no1 ZINC000291680758 568256652 /nfs/dbraw/zinc/25/66/52/568256652.db2.gz XGXVUYMUVAIMSG-LBPRGKRZSA-N 0 0 372.381 3.625 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(N2CCN(c3nc4ccccc4s3)CC2)n1 ZINC000541934798 568257218 /nfs/dbraw/zinc/25/72/18/568257218.db2.gz VYPSUGOZCWMYKR-UHFFFAOYSA-N 0 0 369.450 3.543 20 5 FHBDRN C[C@H](CNC(=O)Nc1ccc([N+](=O)[O-])cc1F)Oc1ccc(Cl)cc1 ZINC000584688686 568258434 /nfs/dbraw/zinc/25/84/34/568258434.db2.gz DEPDBBWAOXNYME-SNVBAGLBSA-N 0 0 367.764 3.976 20 5 FHBDRN CCS[C@H](C)c1noc(CN(C)c2ccc3cc([N+](=O)[O-])ccc3n2)n1 ZINC000482095744 568263402 /nfs/dbraw/zinc/26/34/02/568263402.db2.gz FBSNINQPLRVVCJ-LLVKDONJSA-N 0 0 373.438 3.977 20 5 FHBDRN CC[C@@H](NC(=O)CCn1nc(C)c([N+](=O)[O-])c1C)C(C)(C)c1ccccc1 ZINC000120393537 568275081 /nfs/dbraw/zinc/27/50/81/568275081.db2.gz ZTGBZRXCIUWCOP-QGZVFWFLSA-N 0 0 372.469 3.671 20 5 FHBDRN CC[C@@H](C)COc1cc([N+](=O)[O-])c(CN2CCC(F)(F)C2)cc1OC ZINC000541955911 568281352 /nfs/dbraw/zinc/28/13/52/568281352.db2.gz GMRBDNQXKAIBHE-GFCCVEGCSA-N 0 0 358.385 3.869 20 5 FHBDRN C[C@H](NC(=O)c1ccc2c(c1O)OC(C)(C)C2)c1cccc([N+](=O)[O-])c1 ZINC000436682214 568286477 /nfs/dbraw/zinc/28/64/77/568286477.db2.gz POJBRKGULLCBBT-NSHDSACASA-N 0 0 356.378 3.505 20 5 FHBDRN CC(C)(C)C[C@H](NC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)C(F)(F)F ZINC000482142444 568288436 /nfs/dbraw/zinc/28/84/36/568288436.db2.gz PDZNCMDOOVAKLE-NSHDSACASA-N 0 0 358.320 3.568 20 5 FHBDRN Nc1c(C(=O)N[C@@H]2CC=C(c3ccc(F)cc3)CC2)cccc1[N+](=O)[O-] ZINC000482155027 568292464 /nfs/dbraw/zinc/29/24/64/568292464.db2.gz AQZALHLTKDIYPB-OAHLLOKOSA-N 0 0 355.369 3.682 20 5 FHBDRN C[C@@H](c1cc(F)ccc1F)N(C)C(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000569143993 568292963 /nfs/dbraw/zinc/29/29/63/568292963.db2.gz AXJQJFQYPHZCOA-VIFPVBQESA-N 0 0 370.302 3.913 20 5 FHBDRN C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)N[C@@H]3CCC[C@@H]3F)cc2[N+](=O)[O-])C1 ZINC000569145225 568293188 /nfs/dbraw/zinc/29/31/88/568293188.db2.gz ICMXDZJDAQVHOW-LQKXBSAESA-N 0 0 363.433 3.698 20 5 FHBDRN C[C@@H](C(=O)Nc1ncc2c(n1)CCC(C)(C)C2)c1cccc([N+](=O)[O-])c1 ZINC000569060620 568295652 /nfs/dbraw/zinc/29/56/52/568295652.db2.gz ZHKPTIOEHQRZTP-GFCCVEGCSA-N 0 0 354.410 3.642 20 5 FHBDRN NC(=O)c1ccnc(SC(c2ccccc2)c2ccccc2)c1[N+](=O)[O-] ZINC000569164199 568298410 /nfs/dbraw/zinc/29/84/10/568298410.db2.gz ZVKKIYQIRLAFOM-UHFFFAOYSA-N 0 0 365.414 3.970 20 5 FHBDRN Cc1onc(-c2ccccc2)c1-c1nc(Cc2ccc([N+](=O)[O-])cn2)no1 ZINC000569170136 568299406 /nfs/dbraw/zinc/29/94/06/568299406.db2.gz FDTAZKSCZJJNPJ-UHFFFAOYSA-N 0 0 363.333 3.594 20 5 FHBDRN C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000482172071 568300451 /nfs/dbraw/zinc/30/04/51/568300451.db2.gz BTIMGJOGGYSATI-ZWNOBZJWSA-N 0 0 362.373 3.876 20 5 FHBDRN CC(C)C[C@@H]1OCCC[C@@H]1NC(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000482180729 568302212 /nfs/dbraw/zinc/30/22/12/568302212.db2.gz LQPXGQYRIJHYML-JQFCIGGWSA-N 0 0 366.483 3.785 20 5 FHBDRN CCc1ccc([C@@H](CO)NCc2cc([N+](=O)[O-])ccc2OC(C)C)cc1 ZINC000541984511 568308669 /nfs/dbraw/zinc/30/86/69/568308669.db2.gz XLPQOXLSTFNJJE-LJQANCHMSA-N 0 0 358.438 3.768 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])NC[C@H]1CCCC[C@H]1C(F)(F)F ZINC000482199170 568311265 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20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1N[C@H]1CCN([C@H](C)c2ccc(F)cc2)C1=O ZINC000453065402 568318117 /nfs/dbraw/zinc/31/81/17/568318117.db2.gz UVYPAMSOJDHOER-DYVFJYSZSA-N 0 0 357.385 3.816 20 5 FHBDRN COc1cc(C(=O)NCCCC2CCCC2)c([N+](=O)[O-])cc1OC(F)F ZINC000031146494 568325526 /nfs/dbraw/zinc/32/55/26/568325526.db2.gz XEWAMWRCFUVXLX-UHFFFAOYSA-N 0 0 372.368 3.905 20 5 FHBDRN O=C(N[C@@H]1COc2cccc(F)c21)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000365216937 568327526 /nfs/dbraw/zinc/32/75/26/568327526.db2.gz CXULKUVNWCYVPZ-QGZVFWFLSA-N 0 0 374.371 3.684 20 5 FHBDRN COCCN(Cc1ccccc1)C(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000031481500 568330147 /nfs/dbraw/zinc/33/01/47/568330147.db2.gz VCBVYEPHHRAIBW-OAHLLOKOSA-N 0 0 374.462 3.751 20 5 FHBDRN Cc1c(Cl)cccc1NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000031548431 568333010 /nfs/dbraw/zinc/33/30/10/568333010.db2.gz YPEBJZQCNDBYSD-UHFFFAOYSA-N 0 0 356.769 3.995 20 5 FHBDRN C[C@H](CNC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F)CC(F)(F)F ZINC000412672799 568349843 /nfs/dbraw/zinc/34/98/43/568349843.db2.gz JALYWUPHZZERCA-ZETCQYMHSA-N 0 0 356.247 3.515 20 5 FHBDRN COc1ccc(NC(=O)CCc2ccnc3ccccc23)cc1[N+](=O)[O-] ZINC000542001086 568377410 /nfs/dbraw/zinc/37/74/10/568377410.db2.gz WUAJVESZZXBCMP-UHFFFAOYSA-N 0 0 351.362 3.723 20 5 FHBDRN O=C(CCc1cccc(Cl)c1)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000053679399 568387620 /nfs/dbraw/zinc/38/76/20/568387620.db2.gz IFMPAYCHQZXYAH-UHFFFAOYSA-N 0 0 373.840 3.530 20 5 FHBDRN O=C(c1ccc(C(F)(F)F)cc1O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000182011248 568389393 /nfs/dbraw/zinc/38/93/93/568389393.db2.gz NHRUGIIHGOEICK-UHFFFAOYSA-N 0 0 352.268 3.522 20 5 FHBDRN O=C(Nc1cc2c(cc1[N+](=O)[O-])OCCCO2)[C@@H]1CC[C@@H](C(F)(F)F)C1 ZINC000569340923 568395364 /nfs/dbraw/zinc/39/53/64/568395364.db2.gz MRWCMLLYMNHQFY-NXEZZACHSA-N 0 0 374.315 3.673 20 5 FHBDRN Cc1c(NC(=O)[C@H](C)OCC(C)C)cc(Br)cc1[N+](=O)[O-] ZINC000569419357 568401716 /nfs/dbraw/zinc/40/17/16/568401716.db2.gz HQJBSNPOQADCPR-JTQLQIEISA-N 0 0 359.220 3.665 20 5 FHBDRN COc1ccc(OC[C@H](O)COc2cccc([N+](=O)[O-])c2)c2ccccc12 ZINC000569507717 568404204 /nfs/dbraw/zinc/40/42/04/568404204.db2.gz IWJTULJHPNHMIM-OAHLLOKOSA-N 0 0 369.373 3.575 20 5 FHBDRN O=C(NCCOc1ccc([N+](=O)[O-])cc1)N1CC2(CCC2)[C@H]1c1ccco1 ZINC000569561369 568407628 /nfs/dbraw/zinc/40/76/28/568407628.db2.gz FAYRDVKIFMKWNP-QGZVFWFLSA-N 0 0 371.393 3.503 20 5 FHBDRN CCc1nc(CN(C)C(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)cs1 ZINC000569567809 568408001 /nfs/dbraw/zinc/40/80/01/568408001.db2.gz QGZZDHIRAWKLEG-UHFFFAOYSA-N 0 0 363.439 3.673 20 5 FHBDRN C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N(C)Cc1ccc(F)cc1 ZINC000006976624 568408258 /nfs/dbraw/zinc/40/82/58/568408258.db2.gz FWAVKSMOOMEPHY-GFCCVEGCSA-N 0 0 356.357 3.977 20 5 FHBDRN C[C@H](c1cccs1)N(C)C(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000032825735 568409698 /nfs/dbraw/zinc/40/96/98/568409698.db2.gz SKIDMWZYSUMSSO-GFCCVEGCSA-N 0 0 356.407 3.675 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)Nc1ccc([C@@H]2CCOC2)cc1 ZINC000569879434 568433163 /nfs/dbraw/zinc/43/31/63/568433163.db2.gz HIDJZKMJWJDMQE-MRXNPFEDSA-N 0 0 369.421 3.930 20 5 FHBDRN COC(=O)c1cc(C)nc(Oc2cncc(-c3ccccc3)c2)c1[N+](=O)[O-] ZINC000569978871 568445631 /nfs/dbraw/zinc/44/56/31/568445631.db2.gz IZHGPMVNXVEYQJ-UHFFFAOYSA-N 0 0 365.345 3.939 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N[C@H]1COc2ccc(F)cc2C1 ZINC000570004246 568449265 /nfs/dbraw/zinc/44/92/65/568449265.db2.gz VOFOJDBPIASSAT-LLVKDONJSA-N 0 0 365.748 3.513 20 5 FHBDRN CC(C)(NS(=O)(=O)c1ccc(C(F)F)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000570101623 568450737 /nfs/dbraw/zinc/45/07/37/568450737.db2.gz YZKAKQSUNNOCQE-UHFFFAOYSA-N 0 0 370.377 3.746 20 5 FHBDRN Cc1ccc(CNC(=O)c2c([N+](=O)[O-])cccc2C(F)(F)F)cc1F ZINC000570103598 568450904 /nfs/dbraw/zinc/45/09/04/568450904.db2.gz OVXONHVMLWXMHC-UHFFFAOYSA-N 0 0 356.275 3.991 20 5 FHBDRN CC1(C)[C@H](C(F)(F)F)CCN1C(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000330984705 568473893 /nfs/dbraw/zinc/47/38/93/568473893.db2.gz QKXPFZUDHJSUHM-GFCCVEGCSA-N 0 0 362.373 3.876 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2CC[C@](F)(c3ccccc3)C2)c1 ZINC000570346451 568479695 /nfs/dbraw/zinc/47/96/95/568479695.db2.gz JQYUMOYWPOZPIF-HXUWFJFHSA-N 0 0 372.396 3.769 20 5 FHBDRN O=[N+]([O-])c1cc(C(F)(F)F)ccc1NC[C@@H]1CCC2(CCOCC2)[C@@H]1O ZINC000570346211 568479721 /nfs/dbraw/zinc/47/97/21/568479721.db2.gz FETKWJJFSXNIMF-XHDPSFHLSA-N 0 0 374.359 3.593 20 5 FHBDRN O=C(NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)c1ccc(Cl)c(F)c1 ZINC000570361343 568480391 /nfs/dbraw/zinc/48/03/91/568480391.db2.gz USZQHUFHISOAAJ-UHFFFAOYSA-N 0 0 361.760 3.841 20 5 FHBDRN C/C(=C\c1nc(-c2ccncc2N(C)C)no1)c1ccc([N+](=O)[O-])cc1 ZINC000570493959 568488199 /nfs/dbraw/zinc/48/81/99/568488199.db2.gz FETSINGUVSGACT-ZRDIBKRKSA-N 0 0 351.366 3.666 20 5 FHBDRN COC(=O)[C@H](OC)c1ccccc1OCc1c(Cl)cccc1[N+](=O)[O-] ZINC000570670993 568494500 /nfs/dbraw/zinc/49/45/00/568494500.db2.gz MXBUOWKKHPDFOQ-MRXNPFEDSA-N 0 0 365.769 3.688 20 5 FHBDRN CN(C(=O)c1cc([N+](=O)[O-])cn1C)c1ccc(C(F)(F)F)cc1Cl ZINC000570584807 568496057 /nfs/dbraw/zinc/49/60/57/568496057.db2.gz YRWXGBFMSSNXNG-UHFFFAOYSA-N 0 0 361.707 3.882 20 5 FHBDRN CCOC(=O)Cc1csc(Sc2ccc([N+](=O)[O-])cc2Cl)n1 ZINC000007466907 568519762 /nfs/dbraw/zinc/51/97/62/568519762.db2.gz VMTOYFZHYIAWJS-UHFFFAOYSA-N 0 0 358.828 3.962 20 5 FHBDRN CCC[C@H](NCc1nccn1CC(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000482245174 568522670 /nfs/dbraw/zinc/52/26/70/568522670.db2.gz ZOFDUPIKJHIXIZ-AWEZNQCLSA-N 0 0 356.348 3.985 20 5 FHBDRN CCCN(CC(F)(F)F)S(=O)(=O)c1cc(Cl)c(C)c([N+](=O)[O-])c1 ZINC000063764221 568569606 /nfs/dbraw/zinc/56/96/06/568569606.db2.gz QODWHTAHBPNPIX-UHFFFAOYSA-N 0 0 374.768 3.520 20 5 FHBDRN O=C(Nc1ccccc1-n1cccn1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000049703896 568570373 /nfs/dbraw/zinc/57/03/73/568570373.db2.gz KPPKSHBMYSHOSC-UHFFFAOYSA-N 0 0 363.377 3.607 20 5 FHBDRN O=C(c1ccc(C(F)(F)F)cc1O)N1CCc2c1cccc2[N+](=O)[O-] ZINC000182042189 568579735 /nfs/dbraw/zinc/57/97/35/568579735.db2.gz NQRDCHWGYYBFCC-UHFFFAOYSA-N 0 0 352.268 3.522 20 5 FHBDRN CC[C@@]1(CNC(=O)Nc2ccc([N+](=O)[O-])cc2C)OCCc2ccccc21 ZINC000570916630 568671079 /nfs/dbraw/zinc/67/10/79/568671079.db2.gz WBOUWGUCXBKCTQ-FQEVSTJZSA-N 0 0 369.421 3.903 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(C(=O)Nc2ccc3c(c2)CCCC(=O)N3)c1F ZINC000365457683 568722132 /nfs/dbraw/zinc/72/21/32/568722132.db2.gz CVCOGGIVDXZSIH-UHFFFAOYSA-N 0 0 357.341 3.569 20 5 FHBDRN CC[C@H](Nc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-])c1cc(F)ccc1F ZINC000736368661 598975000 /nfs/dbraw/zinc/97/50/00/598975000.db2.gz ICCTYTJBJMIUDQ-ZDUSSCGKSA-N 0 0 360.324 3.616 20 5 FHBDRN C[C@@H](SCCOc1cccc(-c2nn[nH]n2)c1)c1ccccc1[N+](=O)[O-] ZINC000820550567 599222391 /nfs/dbraw/zinc/22/23/91/599222391.db2.gz WUJWAMKSPGTRPP-GFCCVEGCSA-N 0 0 371.422 3.648 20 5 FHBDRN Cc1cc(C)c(-c2nn[nH]n2)c(S[C@H](C)c2cccc([N+](=O)[O-])c2)n1 ZINC000737242720 598271314 /nfs/dbraw/zinc/27/13/14/598271314.db2.gz YERYBWUVSCCAKZ-LLVKDONJSA-N 0 0 356.411 3.640 20 5 FHBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1CSc1ccc(-c2nn[nH]n2)cc1 ZINC000735913846 598788400 /nfs/dbraw/zinc/78/84/00/598788400.db2.gz SRUNTHXCHMHBHX-UHFFFAOYSA-N 0 0 371.422 3.854 20 5 FHBDRN C[C@H](c1cccc(Cl)c1)N(C)c1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-] ZINC000736198094 598814800 /nfs/dbraw/zinc/81/48/00/598814800.db2.gz FOEZYGKQAJLJBG-SNVBAGLBSA-N 0 0 358.789 3.626 20 5 FHBDRN O=[N+]([O-])c1ccc(Oc2ccc(-c3nn[nH]n3)cc2Cl)c2ccncc21 ZINC000823645183 599317144 /nfs/dbraw/zinc/31/71/44/599317144.db2.gz PCLXGXOLFCASAH-UHFFFAOYSA-N 0 0 368.740 3.769 20 5 FHBDRN C[C@H](CNc1ccc(/C=C\C(=O)[O-])cc1[N+](=O)[O-])[N@H+](C)Cc1ccccc1 ZINC000736606912 600239567 /nfs/dbraw/zinc/23/95/67/600239567.db2.gz NDBDJUCVJZUXOF-ZHUYAKLQSA-N 0 0 369.421 3.625 20 5 FHBDRN O=C([O-])[C@H]([NH2+]CCc1ccccc1[N+](=O)[O-])c1cc(Cl)cc(Cl)c1 ZINC000833164498 601976853 /nfs/dbraw/zinc/97/68/53/601976853.db2.gz ADXYFTCZWUVDEC-OAHLLOKOSA-N 0 0 369.204 3.860 20 5 FHBDRN C[C@@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)[C@H]1CCCN(C(=O)[O-])C1 ZINC000739030650 602270521 /nfs/dbraw/zinc/27/05/21/602270521.db2.gz BNMGNDWIVBDWHR-HIFRSBDPSA-N 0 0 373.409 3.723 20 5 FHBDRN C[C@H]([NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)[C@H]1CCCN(C(=O)[O-])C1 ZINC000739032344 602270546 /nfs/dbraw/zinc/27/05/46/602270546.db2.gz WHSNVLAXSAATKW-KBPBESRZSA-N 0 0 373.409 3.723 20 5 FHBDRN O=C([O-])[C@H]1CCC[N@@H+]1Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000414687200 604527939 /nfs/dbraw/zinc/52/79/39/604527939.db2.gz WMHFILDOGADLAS-OAHLLOKOSA-N 0 0 360.341 3.575 20 5 FHBDRN C[C@@H](c1ccccc1)[NH+]1CCC(Nc2cc(C(=O)[O-])ccc2[N+](=O)[O-])CC1 ZINC000578655991 605184968 /nfs/dbraw/zinc/18/49/68/605184968.db2.gz DDUAVDOUAPBSOJ-AWEZNQCLSA-N 0 0 369.421 3.931 20 5 FHBDRN Cc1cc(N[C@H](C)c2ccc(-c3nn[nH]n3)cc2)c(Cl)cc1[N+](=O)[O-] ZINC000822209446 606136274 /nfs/dbraw/zinc/13/62/74/606136274.db2.gz JHQVLSXYXQQWDA-SNVBAGLBSA-N 0 0 358.789 3.910 20 5 FHBDRN Cc1cc(N[C@@H](C)c2ccc(-c3nn[nH]n3)cc2)c(Cl)cc1[N+](=O)[O-] ZINC000822209445 606136278 /nfs/dbraw/zinc/13/62/78/606136278.db2.gz JHQVLSXYXQQWDA-JTQLQIEISA-N 0 0 358.789 3.910 20 5 FHBDRN O=[N+]([O-])c1cccc2ccc(C=Cc3cc(-c4nn[nH]n4)cs3)nc21 ZINC000823648612 606305361 /nfs/dbraw/zinc/30/53/61/606305361.db2.gz YRKDQROPPFSPOV-SREVYHEPSA-N 0 0 350.363 3.555 20 5 FHBDRN O=[N+]([O-])c1ccc2oc(C(Cl)=Cc3ccc(-c4nn[nH]n4)s3)nc2c1 ZINC000823644202 606339717 /nfs/dbraw/zinc/33/97/17/606339717.db2.gz GPMBZNJPHJGEEC-TWGQIWQCSA-N 0 0 374.769 3.715 20 5 FHBDRN O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1NC[C@@H]1CCC[C@H](C(F)(F)F)C1 ZINC000823629909 606596232 /nfs/dbraw/zinc/59/62/32/606596232.db2.gz LOVBGPLVEBZNLL-KOLCDFICSA-N 0 0 370.335 3.556 20 5 FHBDRN C[C@H](Sc1nccc(-c2nn[nH]n2)c1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000820555739 606702477 /nfs/dbraw/zinc/70/24/77/606702477.db2.gz OTKVMGUHRURJRH-QMMMGPOBSA-N 0 0 362.802 3.677 20 5 FHBDRN O=[N+]([O-])c1ccc(C(F)(F)N2CC[C@@H](c3ccncc3)C2)nc1Cl ZINC001165043563 721927489 /nfs/dbraw/zinc/92/74/89/721927489.db2.gz LRYPXXGXSVJLNU-LLVKDONJSA-N 0 0 354.744 3.577 20 5 FHBDRN CCO[C@@H](CCNC(=O)c1cc(Br)cc([N+](=O)[O-])c1)C(C)C ZINC000431508886 936317334 /nfs/dbraw/zinc/31/73/34/936317334.db2.gz SLSANDVEVBTHIA-AWEZNQCLSA-N 0 0 373.247 3.538 20 5 FHBDRN O=C(N[C@@H]1CCOC2(CCC2)C1)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000582949609 936320262 /nfs/dbraw/zinc/32/02/62/936320262.db2.gz DOETYJPWORLKNG-DLBZAZTESA-N 0 0 373.453 3.586 20 5 FHBDRN CCOc1ccc([C@H](C)NCc2nn(C)c3ccccc23)cc1[N+](=O)[O-] ZINC000612829285 936326150 /nfs/dbraw/zinc/32/61/50/936326150.db2.gz OCPLOEFTHWXVRQ-ZDUSSCGKSA-N 0 0 354.410 3.731 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CN[C@@H](C)c1cc(OC)c(OC)cc1F ZINC000178730496 936327272 /nfs/dbraw/zinc/32/72/72/936327272.db2.gz DNOCLZMDUDLSND-NSHDSACASA-N 0 0 364.373 3.611 20 5 FHBDRN COc1ccc(CN[C@H](c2ccc([N+](=O)[O-])cc2)C(F)(F)F)cc1O ZINC000582971350 936334933 /nfs/dbraw/zinc/33/49/33/936334933.db2.gz YDTQHZOCYWNRFN-OAHLLOKOSA-N 0 0 356.300 3.702 20 5 FHBDRN C[C@H](c1nc(Cc2ccc3c(c2)CCO3)no1)c1ccc([N+](=O)[O-])cc1F ZINC000612911965 936338134 /nfs/dbraw/zinc/33/81/34/936338134.db2.gz JZUXJYICVORXIF-NSHDSACASA-N 0 0 369.352 3.794 20 5 FHBDRN C[C@@H](Nc1ncc(Cl)cc1[N+](=O)[O-])c1ccc(N2CCCC2=O)cc1 ZINC000153634362 936342987 /nfs/dbraw/zinc/34/29/87/936342987.db2.gz DOTIGEWACXFIPL-LLVKDONJSA-N 0 0 360.801 3.943 20 5 FHBDRN O=C(/C=C\c1cccnc1)OCc1ccc([N+](=O)[O-])cc1Br ZINC000255559346 936343520 /nfs/dbraw/zinc/34/35/20/936343520.db2.gz SBKORLOVBZFILO-UTCJRWHESA-N 0 0 363.167 3.509 20 5 FHBDRN O=C(Nc1ccccn1)c1cc(Br)cc([N+](=O)[O-])c1Cl ZINC000135917197 936343706 /nfs/dbraw/zinc/34/37/06/936343706.db2.gz ORHJOTRHIDMUDT-UHFFFAOYSA-N 0 0 356.563 3.658 20 5 FHBDRN COc1cccc(Cc2noc([C@H](C)Sc3ccc([N+](=O)[O-])cc3)n2)n1 ZINC000612979819 936352769 /nfs/dbraw/zinc/35/27/69/936352769.db2.gz JVZMCZDJOBMEDZ-NSHDSACASA-N 0 0 372.406 3.826 20 5 FHBDRN CCC[C@H]([NH2+]Cc1ccc(-n2cncn2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000178742814 936355451 /nfs/dbraw/zinc/35/54/51/936355451.db2.gz HJMLBUYONGTCGK-IBGZPJMESA-N 0 0 351.410 3.807 20 5 FHBDRN CCOC(=O)c1ccnc(N2CC[C@H](c3ccc(CC)cc3)C2)c1[N+](=O)[O-] ZINC000431514796 936364480 /nfs/dbraw/zinc/36/44/80/936364480.db2.gz UMCLEGDNAJFWBA-INIZCTEOSA-N 0 0 369.421 3.723 20 5 FHBDRN CCOC(=O)c1ccnc(N2CC[C@@H](c3ccc(CC)cc3)C2)c1[N+](=O)[O-] ZINC000431514797 936364558 /nfs/dbraw/zinc/36/45/58/936364558.db2.gz UMCLEGDNAJFWBA-MRXNPFEDSA-N 0 0 369.421 3.723 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NCc1cccc(NC(C)=O)c1 ZINC000135969495 936378703 /nfs/dbraw/zinc/37/87/03/936378703.db2.gz XXIDTQZFSDUNBM-UHFFFAOYSA-N 0 0 373.434 3.595 20 5 FHBDRN CCC[C@@H]1C[C@@H](c2nc(Cc3cc(OC)ccc3[N+](=O)[O-])no2)CCO1 ZINC000278035019 936386646 /nfs/dbraw/zinc/38/66/46/936386646.db2.gz ZWBSMBKFDRKRDA-SWLSCSKDSA-N 0 0 361.398 3.640 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(O[C@H]2CCCC[C@H]2O)cc1 ZINC000278042120 936388937 /nfs/dbraw/zinc/38/89/37/936388937.db2.gz SFZMVHLCEPSTKV-MSOLQXFVSA-N 0 0 370.405 3.838 20 5 FHBDRN CN(CC(=O)NCc1ccc2sccc2c1)c1ccccc1[N+](=O)[O-] ZINC000516608857 945063470 /nfs/dbraw/zinc/06/34/70/945063470.db2.gz VFOJJFYRTPUHJJ-UHFFFAOYSA-N 0 0 355.419 3.562 20 5 FHBDRN Cc1cc(C(=O)Nc2ccc([C@H](C)N3CCOCC3)cc2)cc([N+](=O)[O-])c1 ZINC000110720432 945065711 /nfs/dbraw/zinc/06/57/11/945065711.db2.gz IFTXDIARVHRJDG-HNNXBMFYSA-N 0 0 369.421 3.549 20 5 FHBDRN CCCC[C@@H]1CCC[C@@H]1NC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000110719697 945065765 /nfs/dbraw/zinc/06/57/65/945065765.db2.gz OCZQVBMYVTUHFN-PBHICJAKSA-N 0 0 356.426 3.869 20 5 FHBDRN CC(C)C[C@H]1C[C@@H](NC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)CCO1 ZINC000467224377 945068481 /nfs/dbraw/zinc/06/84/81/945068481.db2.gz VIRDYKJSLFPGTF-ZFWWWQNUSA-N 0 0 369.849 3.641 20 5 FHBDRN C[C@H](CNC(=O)c1ccc(Br)cc1[N+](=O)[O-])c1ccccc1 ZINC000079386660 937080841 /nfs/dbraw/zinc/08/08/41/937080841.db2.gz JKOLGRLGFJMUMJ-LLVKDONJSA-N 0 0 363.211 3.891 20 5 FHBDRN CC1(C)[C@H](NC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)[C@@H]2CCO[C@H]21 ZINC000278052930 937085649 /nfs/dbraw/zinc/08/56/49/937085649.db2.gz DJZDZSWDGZYPDL-CWFSZBLJSA-N 0 0 362.429 3.637 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])c1cccc(Br)c1Cl ZINC000136017394 937087479 /nfs/dbraw/zinc/08/74/79/937087479.db2.gz NQTCRMGPRXDZSU-UHFFFAOYSA-N 0 0 369.602 3.941 20 5 FHBDRN CCNc1ccc(C(=O)Nc2ccnn2-c2cccc(F)c2)cc1[N+](=O)[O-] ZINC000472279563 937089496 /nfs/dbraw/zinc/08/94/96/937089496.db2.gz VDRCSIXUAVGATB-UHFFFAOYSA-N 0 0 369.356 3.604 20 5 FHBDRN CN(C(=O)CSc1cccc(C(F)(F)F)c1)c1ccc([N+](=O)[O-])nc1 ZINC000514814979 937089552 /nfs/dbraw/zinc/08/95/52/937089552.db2.gz YFJAKJMHLPZMHI-UHFFFAOYSA-N 0 0 371.340 3.764 20 5 FHBDRN C[C@H](NC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(-n2cccn2)cc1 ZINC000514834639 937093901 /nfs/dbraw/zinc/09/39/01/937093901.db2.gz UZPLXWDPGKMWLH-GJZGRUSLSA-N 0 0 364.405 3.761 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N(C)C[C@H](C)C(=O)OC(C)(C)C ZINC000458380510 937108221 /nfs/dbraw/zinc/10/82/21/937108221.db2.gz DHGAWBJKNGLUFB-ZDUSSCGKSA-N 0 0 364.442 3.570 20 5 FHBDRN Cc1nn(C)c(NCc2cccc(COCc3ccccc3)c2)c1[N+](=O)[O-] ZINC000052104299 937117423 /nfs/dbraw/zinc/11/74/23/937117423.db2.gz APIHHBSZCTYDHQ-UHFFFAOYSA-N 0 0 366.421 3.966 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)NC2(C(F)F)CCCCC2)cc1OC ZINC000583107961 937125807 /nfs/dbraw/zinc/12/58/07/937125807.db2.gz NXRMVKQWAYNECA-UHFFFAOYSA-N 0 0 372.368 3.700 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)N[C@@H]2CCCC[C@@H]2n2cccn2)cc1[N+](=O)[O-] ZINC000176398860 937127020 /nfs/dbraw/zinc/12/70/20/937127020.db2.gz JDAYYVFCJUZMIT-UAGQMJEPSA-N 0 0 371.441 3.644 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1c[nH]nc1-c1ccccc1Cl ZINC000176402213 937127287 /nfs/dbraw/zinc/12/72/87/937127287.db2.gz LIFXWYYBMBEXRJ-UHFFFAOYSA-N 0 0 370.796 3.911 20 5 FHBDRN C[C@H](OC(=O)c1ccc([N+](=O)[O-])s1)C(=O)N1c2ccccc2CC[C@@H]1C ZINC000023344961 927040038 /nfs/dbraw/zinc/04/00/38/927040038.db2.gz YRGPEFJXAOKXNI-RYUDHWBXSA-N 0 0 374.418 3.570 20 5 FHBDRN C[C@H](Nc1nccc(C(N)=O)c1[N+](=O)[O-])c1ccc(Cl)cc1Cl ZINC000557548680 927045133 /nfs/dbraw/zinc/04/51/33/927045133.db2.gz RKFKCYAPKOUERE-ZETCQYMHSA-N 0 0 355.181 3.569 20 5 FHBDRN COC(=O)c1cc(C)nc(N2CC[C@@H](c3ccccc3)[C@H](C)C2)c1[N+](=O)[O-] ZINC000557588131 927109950 /nfs/dbraw/zinc/10/99/50/927109950.db2.gz OCOBYVTZGOCMDN-CZUORRHYSA-N 0 0 369.421 3.715 20 5 FHBDRN COc1cc(C(=O)N(C)c2cccc(SC)c2)cc([N+](=O)[O-])c1OC ZINC000610174041 927119645 /nfs/dbraw/zinc/11/96/45/927119645.db2.gz FZKIZNUWJVYVEN-UHFFFAOYSA-N 0 0 362.407 3.611 20 5 FHBDRN CCSc1cccc(CNc2cc3nc[nH]c(=O)c3cc2[N+](=O)[O-])c1 ZINC000579697881 927128658 /nfs/dbraw/zinc/12/86/58/927128658.db2.gz WIZIEKVAKACLCQ-UHFFFAOYSA-N 0 0 356.407 3.968 20 5 FHBDRN COc1cc(C(=O)N[C@@H](C)C(C)(C)c2ccccc2)cc([N+](=O)[O-])c1OC ZINC000610174254 927170428 /nfs/dbraw/zinc/17/04/28/927170428.db2.gz ROGUILYFYHWKQI-ZDUSSCGKSA-N 0 0 372.421 3.708 20 5 FHBDRN O=C(NC[C@@H]1CCCO[C@@H]1c1ccccc1)c1ccc([N+](=O)[O-])cc1F ZINC000145926301 937148115 /nfs/dbraw/zinc/14/81/15/937148115.db2.gz YHIJBYZVANNJCD-KBXCAEBGSA-N 0 0 358.369 3.632 20 5 FHBDRN COc1ccc(NC(=O)c2cc(C)n(-c3ccc(C)cc3)n2)cc1[N+](=O)[O-] ZINC000543852275 937147774 /nfs/dbraw/zinc/14/77/74/937147774.db2.gz NGCSFDUYQWGYLX-UHFFFAOYSA-N 0 0 366.377 3.658 20 5 FHBDRN C[C@@H]1CC[C@H](c2ccccc2)N(C(=O)COc2ccccc2[N+](=O)[O-])C1 ZINC000557643351 927270662 /nfs/dbraw/zinc/27/06/62/927270662.db2.gz WTKIXQSWMXHSFB-NVXWUHKLSA-N 0 0 354.406 3.973 20 5 FHBDRN CC(C)(C)C[C@H](NC(=O)Cn1ccc([N+](=O)[O-])n1)c1ccc(Cl)cc1 ZINC000610178442 927323406 /nfs/dbraw/zinc/32/34/06/927323406.db2.gz YBUWMTXYQPHRTG-AWEZNQCLSA-N 0 0 364.833 3.738 20 5 FHBDRN Cc1cccc(C(=O)Nc2ncc(C3(O)CCCCC3)s2)c1[N+](=O)[O-] ZINC000274650632 927340664 /nfs/dbraw/zinc/34/06/64/927340664.db2.gz CAEHPCJFKMREJZ-UHFFFAOYSA-N 0 0 361.423 3.764 20 5 FHBDRN CSc1cccc(C(=O)NC2CCC(OC(C)C)CC2)c1[N+](=O)[O-] ZINC000186882224 927346678 /nfs/dbraw/zinc/34/66/78/927346678.db2.gz MUOQVYNZTHTSIP-UHFFFAOYSA-N 0 0 352.456 3.783 20 5 FHBDRN COc1cc(C(=O)N2CCCC[C@H]2c2ccc(C)o2)cc([N+](=O)[O-])c1OC ZINC000610179378 927346941 /nfs/dbraw/zinc/34/69/41/927346941.db2.gz QLBKJMANJHODDC-AWEZNQCLSA-N 0 0 374.393 3.881 20 5 FHBDRN O=[N+]([O-])c1cc(I)ccc1NCCC(F)(F)F 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FHBDRN CCN(CC(=O)Nc1c(C)cccc1[N+](=O)[O-])[C@H](C)c1cccc(O)c1 ZINC000471177624 928600824 /nfs/dbraw/zinc/60/08/24/928600824.db2.gz KSQQQEIPXNXDEN-CQSZACIVSA-N 0 0 357.410 3.630 20 5 FHBDRN Cc1ncc([N+](=O)[O-])n1CC(=O)N[C@H](CC(C)(C)C)c1ccc(F)cc1 ZINC000120488199 928628234 /nfs/dbraw/zinc/62/82/34/928628234.db2.gz CKJDROMZILVJKL-OAHLLOKOSA-N 0 0 362.405 3.533 20 5 FHBDRN C[C@H](Cc1ccsc1)NC(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC001125301709 928635323 /nfs/dbraw/zinc/63/53/23/928635323.db2.gz UNFHYKIHZGXQDR-SECBINFHSA-N 0 0 369.240 3.780 20 5 FHBDRN Cc1cc(F)c2c(c1)CCCN2C(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1 ZINC000120490733 928638694 /nfs/dbraw/zinc/63/86/94/928638694.db2.gz XBZYWSKDXRCPJI-UHFFFAOYSA-N 0 0 373.340 3.852 20 5 FHBDRN Cc1cnc(COC(=O)/C=C\c2ccnc3ccccc23)c(C)c1[N+](=O)[O-] ZINC000588570332 937262877 /nfs/dbraw/zinc/26/28/77/937262877.db2.gz YWZWQEACJFKOAH-FPLPWBNLSA-N 0 0 363.373 3.911 20 5 FHBDRN C[C@@H](C(=O)N1CCC(Nc2ccc(F)cc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000583240456 937267186 /nfs/dbraw/zinc/26/71/86/937267186.db2.gz UMJYVNPARWYACQ-CQSZACIVSA-N 0 0 371.412 3.941 20 5 FHBDRN Cc1ccc(C(=O)c2ccsc2NC(=O)c2ccc([N+](=O)[O-])cn2)cc1 ZINC000583243555 937271063 /nfs/dbraw/zinc/27/10/63/937271063.db2.gz LSJJQFYQUVQCQR-UHFFFAOYSA-N 0 0 367.386 3.843 20 5 FHBDRN Cn1cc([N+](=O)[O-])cc1C(=O)N[C@H]1C[C@H](c2cccc(C(F)(F)F)c2)C1 ZINC000583241366 937273664 /nfs/dbraw/zinc/27/36/64/937273664.db2.gz JUZJFAMLSBKVKR-AULYBMBSSA-N 0 0 367.327 3.628 20 5 FHBDRN Cc1cc(C(=O)COC(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)c(C)[nH]1 ZINC000023460719 928803613 /nfs/dbraw/zinc/80/36/13/928803613.db2.gz IZLDRAQJZFFEMM-UHFFFAOYSA-N 0 0 358.394 3.877 20 5 FHBDRN Cc1c([N+](=O)[O-])cc(C(=O)N2CC[C@@H](c3ccccc3)[C@@H]2C)cc1[N+](=O)[O-] ZINC000175764835 928825506 /nfs/dbraw/zinc/82/55/06/928825506.db2.gz DTNBSIKWBJHSFN-XJKSGUPXSA-N 0 0 369.377 3.830 20 5 FHBDRN COc1ccc(NC(=O)c2ccc([N+](=O)[O-])c(C)c2)c(Br)c1 ZINC000608901414 928899406 /nfs/dbraw/zinc/89/94/06/928899406.db2.gz 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O=C(CSc1ccc([N+](=O)[O-])cc1)N1CCCO[C@H](c2ccccc2)C1 ZINC000609231372 929088629 /nfs/dbraw/zinc/08/86/29/929088629.db2.gz ZCAQMNIVHAABQZ-SFHVURJKSA-N 0 0 372.446 3.677 20 5 FHBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)NC1CCC(F)(F)CC1 ZINC000535619350 929088914 /nfs/dbraw/zinc/08/89/14/929088914.db2.gz AVAHBXPGDBCMGX-UHFFFAOYSA-N 0 0 355.385 3.795 20 5 FHBDRN CC(C)C(=O)N1CCC(Nc2ccc([N+](=O)[O-])c(-c3ccccc3)n2)CC1 ZINC000134597365 929093791 /nfs/dbraw/zinc/09/37/91/929093791.db2.gz JHYHLHBCDVDYDH-UHFFFAOYSA-N 0 0 368.437 3.716 20 5 FHBDRN O=C(N[C@@H](CC1CC1)c1ccccc1)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000610237328 929097380 /nfs/dbraw/zinc/09/73/80/929097380.db2.gz RIBKIEYBAWDTTM-HNNXBMFYSA-N 0 0 354.362 3.595 20 5 FHBDRN Cc1ccc(CNC(=O)c2c([N+](=O)[O-])cccc2C(F)(F)F)nc1C ZINC000458002499 929131225 /nfs/dbraw/zinc/13/12/25/929131225.db2.gz HEUNRPPYXRSCBA-UHFFFAOYSA-N 0 0 353.300 3.555 20 5 FHBDRN COC(=O)c1cc(C)ccc1OCc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000134692937 929148115 /nfs/dbraw/zinc/14/81/15/929148115.db2.gz GNRYKNFZBGQNAO-UHFFFAOYSA-N 0 0 368.345 3.924 20 5 FHBDRN Cc1ccccc1-c1nc(COC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)no1 ZINC000161628203 937308038 /nfs/dbraw/zinc/30/80/38/937308038.db2.gz ZMAIFNUTNDYOHE-UHFFFAOYSA-N 0 0 373.752 3.964 20 5 FHBDRN CN(Cc1cc(Br)cs1)C(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000134750110 929208816 /nfs/dbraw/zinc/20/88/16/929208816.db2.gz MYGOFCXRJBPGAY-UHFFFAOYSA-N 0 0 369.240 3.620 20 5 FHBDRN CC(C)n1c(CNC(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)nc2ccccc21 ZINC000514905916 937312017 /nfs/dbraw/zinc/31/20/17/937312017.db2.gz RTMKANQSGFAXBT-AWEZNQCLSA-N 0 0 366.421 3.945 20 5 FHBDRN C[C@@H](NC(=O)c1cc(Cl)ccc1[N+](=O)[O-])c1cnn(CC2CCC2)c1 ZINC000890677203 929231611 /nfs/dbraw/zinc/23/16/11/929231611.db2.gz LQAQCZKYHHLTAV-LLVKDONJSA-N 0 0 362.817 3.736 20 5 FHBDRN O=C(NCc1nc(-c2ccncc2)cs1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000134769058 929236314 /nfs/dbraw/zinc/23/63/14/929236314.db2.gz YGDKKFDCXLUNHD-UHFFFAOYSA-N 0 0 374.809 3.697 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N2CCC(Cc3ccccc3)CC2)c1 ZINC000060063684 929267783 /nfs/dbraw/zinc/26/77/83/929267783.db2.gz FRCMYEUKOCWTSQ-UHFFFAOYSA-N 0 0 354.406 3.698 20 5 FHBDRN O=C(NCc1cc([N+](=O)[O-])c(F)cc1F)c1ccc(C(F)(F)F)cc1 ZINC001143376971 929283366 /nfs/dbraw/zinc/28/33/66/929283366.db2.gz ONFYICTZCMPKNP-UHFFFAOYSA-N 0 0 360.238 3.822 20 5 FHBDRN CCS[C@H]1CCC[C@H](NC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)C1 ZINC000134812816 929294892 /nfs/dbraw/zinc/29/48/92/929294892.db2.gz KSHCRVXOVCHJCB-KBPBESRZSA-N 0 0 374.466 3.575 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)NCc1nc(-c2ccc(Cl)cc2)no1 ZINC000609663736 929303956 /nfs/dbraw/zinc/30/39/56/929303956.db2.gz BZNLEFFURKTPJM-UHFFFAOYSA-N 0 0 372.768 3.537 20 5 FHBDRN Cc1nc([C@@H]2CCCN2c2ccc(C(=O)NC(C)C)cc2[N+](=O)[O-])cs1 ZINC000275060156 929378412 /nfs/dbraw/zinc/37/84/12/929378412.db2.gz VXADLRXXXKFFPF-HNNXBMFYSA-N 0 0 374.466 3.839 20 5 FHBDRN O=C(NC[C@H]1CCc2ccccc2C1)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000609756274 929406280 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FHBDRN COc1cccc(NC2CCN(C(=O)c3cccc(C)c3[N+](=O)[O-])CC2)c1 ZINC000359893207 929455890 /nfs/dbraw/zinc/45/58/90/929455890.db2.gz BWWOKMQXSKZILT-UHFFFAOYSA-N 0 0 369.421 3.629 20 5 FHBDRN Cn1ccnc1[C@@H]1CCCN1C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000359906746 929469205 /nfs/dbraw/zinc/46/92/05/929469205.db2.gz YFMBFLQNLJTSND-ZDUSSCGKSA-N 0 0 356.407 3.520 20 5 FHBDRN COCCCN(C)C(=O)c1cc([N+](=O)[O-])ccc1SC1CCCC1 ZINC000120730498 929487839 /nfs/dbraw/zinc/48/78/39/929487839.db2.gz VTXYACMPJXXYIU-UHFFFAOYSA-N 0 0 352.456 3.738 20 5 FHBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)OCC[C@@H]1CCCCO1 ZINC000784956348 929521726 /nfs/dbraw/zinc/52/17/26/929521726.db2.gz ZIHAFYDSZFZCSD-INIZCTEOSA-N 0 0 365.429 3.657 20 5 FHBDRN O=C(c1c[nH]c2cc([N+](=O)[O-])ccc12)N(C[C@@H]1CCCO1)C1CCCC1 ZINC000610243271 929530698 /nfs/dbraw/zinc/53/06/98/929530698.db2.gz NCKKBHBVNFHDLV-HNNXBMFYSA-N 0 0 357.410 3.640 20 5 FHBDRN Cc1ccccc1O[C@@H](C)CNC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000610244833 929551264 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FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N2CCC[C@]2(C)Cc2ccccc2)c1 ZINC000187291059 929634407 /nfs/dbraw/zinc/63/44/07/929634407.db2.gz WEFLGWNBCRBBEI-HXUWFJFHSA-N 0 0 354.406 3.841 20 5 FHBDRN C[C@H](CC(=O)OCCn1ccc([N+](=O)[O-])n1)c1ccc(C(F)(F)F)cc1 ZINC000748122899 929640954 /nfs/dbraw/zinc/64/09/54/929640954.db2.gz RMASNBDZVSACLZ-LLVKDONJSA-N 0 0 371.315 3.547 20 5 FHBDRN CC[C@H](C)Oc1cccc(NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2C)c1 ZINC000275634972 929657589 /nfs/dbraw/zinc/65/75/89/929657589.db2.gz BTJILOTXBPWQSH-ZDUSSCGKSA-N 0 0 371.393 3.658 20 5 FHBDRN CN(CC(=O)N[C@@H](CC1CC1)c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000610294768 929696982 /nfs/dbraw/zinc/69/69/82/929696982.db2.gz WFEHVSSTSFVYRL-KRWDZBQOSA-N 0 0 353.422 3.689 20 5 FHBDRN CC1(C)[C@H](NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])[C@@H]2CCCO[C@H]21 ZINC000610294738 929703251 /nfs/dbraw/zinc/70/32/51/929703251.db2.gz ULNVZUZVAYWNHI-IACUBPJLSA-N 0 0 372.343 3.547 20 5 FHBDRN O=C(c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)N1CCC(C2CCCC2)CC1 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LQTUHWRHUMKZET-YPMHNXCESA-N 0 0 373.272 3.761 20 5 FHBDRN O=C(c1ccc(NC2CC2)c([N+](=O)[O-])c1)N1CC[C@@H]1c1cccc(F)c1 ZINC000610304528 929775264 /nfs/dbraw/zinc/77/52/64/929775264.db2.gz BMKXUKDCQNIDPU-QGZVFWFLSA-N 0 0 355.369 3.895 20 5 FHBDRN O=C(CCc1ccccc1F)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000610305485 929775838 /nfs/dbraw/zinc/77/58/38/929775838.db2.gz DWXDPCAFGPGGRH-UHFFFAOYSA-N 0 0 372.396 3.737 20 5 FHBDRN Cc1cc(C(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)c(C)s1 ZINC000610305455 929776209 /nfs/dbraw/zinc/77/62/09/929776209.db2.gz NSPJCSVGSQCJFJ-UHFFFAOYSA-N 0 0 360.435 3.957 20 5 FHBDRN CC(C)(C)OC(=O)Cc1cccc(NC(=O)c2ccc([N+](=O)[O-])s2)c1 ZINC000610306981 929777277 /nfs/dbraw/zinc/77/72/77/929777277.db2.gz PZOYADCYITXDOB-UHFFFAOYSA-N 0 0 362.407 3.793 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)N1CC[C@@H]1c1cccc(F)c1 ZINC000610305217 929779147 /nfs/dbraw/zinc/77/91/47/929779147.db2.gz NHMGRBOXOIZSGC-GOSISDBHSA-N 0 0 357.385 3.900 20 5 FHBDRN COc1ccc(C(=O)N[C@H](C)CSc2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000472285107 937359665 /nfs/dbraw/zinc/35/96/65/937359665.db2.gz WNLLXXRPYWJCNT-CYBMUJFWSA-N 0 0 360.435 3.822 20 5 FHBDRN CC[C@@H](CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])Oc1ccccc1F ZINC000177645980 929796155 /nfs/dbraw/zinc/79/61/55/929796155.db2.gz ZGOWHEHEBKIHGF-NSHDSACASA-N 0 0 366.776 3.975 20 5 FHBDRN CSc1ccc(C(=O)Nc2ccc3c(c2)nc(C)n3C)cc1[N+](=O)[O-] ZINC000610310342 929809372 /nfs/dbraw/zinc/80/93/72/929809372.db2.gz SGFSKQPDPFOOGE-UHFFFAOYSA-N 0 0 356.407 3.764 20 5 FHBDRN CC1(CNC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)CCOCC1 ZINC000275671496 929819871 /nfs/dbraw/zinc/81/98/71/929819871.db2.gz OLKMTQIDLSWKKV-UHFFFAOYSA-N 0 0 350.418 3.640 20 5 FHBDRN CCC[C@@H](CCO)CNC(=O)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000278211985 937362634 /nfs/dbraw/zinc/36/26/34/937362634.db2.gz RCRLUPDJWPOSEL-AWEZNQCLSA-N 0 0 352.434 3.622 20 5 FHBDRN CCOc1ccc(NC(=O)CN2C[C@H](C)[C@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000248336277 937363086 /nfs/dbraw/zinc/36/30/86/937363086.db2.gz GYRNYZAJOCARJG-XOBRGWDASA-N 0 0 369.421 3.625 20 5 FHBDRN CCOc1ccc(NC(=O)CN2C[C@@H](C)[C@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000248336276 937363130 /nfs/dbraw/zinc/36/31/30/937363130.db2.gz GYRNYZAJOCARJG-VLIAUNLRSA-N 0 0 369.421 3.625 20 5 FHBDRN C[C@@H](Cc1ccc(Cl)cc1Cl)C(=O)OCCn1ccc([N+](=O)[O-])n1 ZINC000748126023 929844087 /nfs/dbraw/zinc/84/40/87/929844087.db2.gz VYLLHPOOLCPDBL-JTQLQIEISA-N 0 0 372.208 3.520 20 5 FHBDRN CCN(C(=O)c1ccc([N+](=O)[O-])c(C)c1)[C@H](COC)Cc1ccccc1 ZINC000471474136 929859540 /nfs/dbraw/zinc/85/95/40/929859540.db2.gz DETRPLFWEKNCQN-SFHVURJKSA-N 0 0 356.422 3.623 20 5 FHBDRN Cc1cc(C)cc(OC[C@H](O)COc2ccc([N+](=O)[O-])c3ncccc23)c1 ZINC000471475425 929864082 /nfs/dbraw/zinc/86/40/82/929864082.db2.gz JUGCVBUVCWOGOG-HNNXBMFYSA-N 0 0 368.389 3.579 20 5 FHBDRN Cc1ccc2c(c1)O[C@H](C)CN2C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1C ZINC000175841173 929872778 /nfs/dbraw/zinc/87/27/78/929872778.db2.gz QXBDGACCKQPEOX-LLVKDONJSA-N 0 0 371.349 3.548 20 5 FHBDRN CCN(C(=O)c1ccc([N+](=O)[O-])cc1C)[C@@H](COC)Cc1ccccc1 ZINC000471476366 929873775 /nfs/dbraw/zinc/87/37/75/929873775.db2.gz OGCWVXXWJVZAOH-GOSISDBHSA-N 0 0 356.422 3.623 20 5 FHBDRN C[C@H](NCc1ccccc1[N+](=O)[O-])c1ncc(Br)cc1F ZINC000187317340 929908247 /nfs/dbraw/zinc/90/82/47/929908247.db2.gz MNTGQXAWUNJDAN-VIFPVBQESA-N 0 0 354.179 3.742 20 5 FHBDRN COc1cccc(F)c1NC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000187318846 929917594 /nfs/dbraw/zinc/91/75/94/929917594.db2.gz MGCUCIMNVIKFQZ-UHFFFAOYSA-N 0 0 356.256 3.596 20 5 FHBDRN COc1ccc(NC(=O)Cc2coc3c2ccc(F)c3F)cc1[N+](=O)[O-] ZINC001266541179 929917733 /nfs/dbraw/zinc/91/77/33/929917733.db2.gz AEBVTFIEGAGBGF-UHFFFAOYSA-N 0 0 362.288 3.809 20 5 FHBDRN COc1ccc(NC(=O)C[C@H]2OCc3cc(Cl)ccc32)cc1[N+](=O)[O-] ZINC001266541700 929923437 /nfs/dbraw/zinc/92/34/37/929923437.db2.gz QFTAMXCQPNBFBJ-MRXNPFEDSA-N 0 0 362.769 3.857 20 5 FHBDRN CN(C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2)[C@@H]1CCC[C@H]1c1ccccc1 ZINC000458022644 929934848 /nfs/dbraw/zinc/93/48/48/929934848.db2.gz IFFGTWFDTAERCS-JKSUJKDBSA-N 0 0 368.389 3.732 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)cnc1N1CCC(OCc2ccc(F)cc2)CC1 ZINC000091668756 937371710 /nfs/dbraw/zinc/37/17/10/937371710.db2.gz CWLUPCSECYOOLY-UHFFFAOYSA-N 0 0 365.792 3.968 20 5 FHBDRN CCOc1c(Cl)cccc1NC(=O)c1cccc([N+](=O)[O-])c1OC ZINC001125401462 929942423 /nfs/dbraw/zinc/94/24/23/929942423.db2.gz LJPCXPDZSCUDDS-UHFFFAOYSA-N 0 0 350.758 3.908 20 5 FHBDRN C[C@H](C(=O)N1CCC(OCc2ccccc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000583358751 937375263 /nfs/dbraw/zinc/37/52/63/937375263.db2.gz WTWKGXDMLLENLE-INIZCTEOSA-N 0 0 368.433 3.906 20 5 FHBDRN CC[C@@H]1CCc2ccccc2N1C(=O)CCn1nc(C)c([N+](=O)[O-])c1C ZINC000177663915 930001628 /nfs/dbraw/zinc/00/16/28/930001628.db2.gz CAIYZSKUALBNEU-MRXNPFEDSA-N 0 0 356.426 3.556 20 5 FHBDRN O=C(NCc1cccc([N+](=O)[O-])c1)Nc1ccc(F)c(Br)c1 ZINC000610333491 930009681 /nfs/dbraw/zinc/00/96/81/930009681.db2.gz ZZAQKOGBSUBHSA-UHFFFAOYSA-N 0 0 368.162 3.818 20 5 FHBDRN Cc1ccc([C@@H](CN2CCOCC2)Nc2ccc(F)cc2[N+](=O)[O-])cc1 ZINC000610341159 930036565 /nfs/dbraw/zinc/03/65/65/930036565.db2.gz HYJGCOATBUIORR-GOSISDBHSA-N 0 0 359.401 3.528 20 5 FHBDRN CC[C@@](C)(NC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F)c1nc(C)cs1 ZINC000579278406 930040564 /nfs/dbraw/zinc/04/05/64/930040564.db2.gz SETUUCRDFPHIOX-MRXNPFEDSA-N 0 0 369.393 3.622 20 5 FHBDRN Cc1ccc(-n2nc(C(C)C)cc2NC(=O)c2cc([N+](=O)[O-])cn2C)cc1 ZINC000610055951 930048641 /nfs/dbraw/zinc/04/86/41/930048641.db2.gz TYAHFYZQXGVQHY-UHFFFAOYSA-N 0 0 367.409 3.803 20 5 FHBDRN CCS[C@@H]1CCC[C@@H](NC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)C1 ZINC000176699092 937379704 /nfs/dbraw/zinc/37/97/04/937379704.db2.gz ATZZKTPIOCEPCI-HUUCEWRRSA-N 0 0 374.466 3.575 20 5 FHBDRN CCN(CC)C(=O)c1cccc(NC(=O)[C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000579307833 930070377 /nfs/dbraw/zinc/07/03/77/930070377.db2.gz KFFJOVHLTQPZHL-CQSZACIVSA-N 0 0 369.421 3.819 20 5 FHBDRN CC[C@H](Cc1ccccc1)N(C)C(=O)NCCOc1ccc([N+](=O)[O-])cc1 ZINC000610350986 930077322 /nfs/dbraw/zinc/07/73/22/930077322.db2.gz CMNLTDOQHYSWAP-QGZVFWFLSA-N 0 0 371.437 3.636 20 5 FHBDRN COc1cc(C(=O)O[C@H]2c3ccccc3OC[C@@H]2C)cc([N+](=O)[O-])c1C ZINC001266558155 930085079 /nfs/dbraw/zinc/08/50/79/930085079.db2.gz LVZIEGSBLHPACV-BBATYDOGSA-N 0 0 357.362 3.838 20 5 FHBDRN NC(=O)c1ccc(-c2nc(COc3cc(F)cc([N+](=O)[O-])c3)cs2)cc1 ZINC000135354101 937390002 /nfs/dbraw/zinc/39/00/02/937390002.db2.gz CEPVIGYNOSDDEW-UHFFFAOYSA-N 0 0 373.365 3.535 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CCSc3ccc(F)cc32)c1 ZINC000146153314 930123290 /nfs/dbraw/zinc/12/32/90/930123290.db2.gz VNBNKGMNRBTVDI-AWEZNQCLSA-N 0 0 362.382 3.709 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](c2nccs2)C(F)(F)F)c1C ZINC000891186622 930141749 /nfs/dbraw/zinc/14/17/49/930141749.db2.gz MKKKZNJKTPKLMN-NSHDSACASA-N 0 0 359.329 3.702 20 5 FHBDRN Cc1ccc(S(=O)(=O)C[C@H](C)Nc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000471526693 930158983 /nfs/dbraw/zinc/15/89/83/930158983.db2.gz GVNZMEIERMJDTA-LBPRGKRZSA-N 0 0 368.842 3.831 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)N2CC3(CCOCC3)[C@@H]2C2CC2)cc1[N+](=O)[O-] ZINC000458495681 937387640 /nfs/dbraw/zinc/38/76/40/937387640.db2.gz HWVJTYJVJRMRQC-KDOFPFPSSA-N 0 0 373.453 3.565 20 5 FHBDRN CC(C)OCC[C@H](O)COc1ccc([N+](=O)[O-])cc1-c1cccs1 ZINC000471527479 930169494 /nfs/dbraw/zinc/16/94/94/930169494.db2.gz IQIDZVKHETXTMC-AWEZNQCLSA-N 0 0 351.424 3.878 20 5 FHBDRN O=C(COc1cccc([N+](=O)[O-])c1)Nc1ccc(CC(F)(F)F)cc1 ZINC000127143772 930176755 /nfs/dbraw/zinc/17/67/55/930176755.db2.gz ROQQDJLOHFOBPD-UHFFFAOYSA-N 0 0 354.284 3.717 20 5 FHBDRN C[C@@H](NC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2)c1ccc(C2CC2)cc1 ZINC000580051818 930184126 /nfs/dbraw/zinc/18/41/26/930184126.db2.gz CBIIQGSPEVACRD-LLVKDONJSA-N 0 0 354.362 3.692 20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])N[C@H]1CC[C@H](c2ccc(F)cc2)C1 ZINC000471530655 930185559 /nfs/dbraw/zinc/18/55/59/930185559.db2.gz RQDSDVCOCBDIJR-RDJZCZTQSA-N 0 0 371.412 3.988 20 5 FHBDRN O=C(Nc1ccc(F)cc1OCC(F)(F)F)c1ccc([N+](=O)[O-])s1 ZINC000070868297 930189929 /nfs/dbraw/zinc/18/99/29/930189929.db2.gz LVELUJQDWYHIRR-UHFFFAOYSA-N 0 0 364.276 3.989 20 5 FHBDRN Cc1ccc(Br)c(C(=O)NCc2cccc([N+](=O)[O-])c2C)c1 ZINC000319164543 930190145 /nfs/dbraw/zinc/19/01/45/930190145.db2.gz IFSZQHFSMAXWMC-UHFFFAOYSA-N 0 0 363.211 3.904 20 5 FHBDRN Nc1ccc(C(=O)N[C@H]2CCCC[C@@H]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000728283330 930191555 /nfs/dbraw/zinc/19/15/55/930191555.db2.gz JKSWPJVGWWAQQP-QAPCUYQASA-N 0 0 353.422 3.708 20 5 FHBDRN Cc1ccccc1-c1nc(COC(=O)c2cc([N+](=O)[O-])ccc2Cl)no1 ZINC000161682401 937397555 /nfs/dbraw/zinc/39/75/55/937397555.db2.gz OGRSRMINFRDXJG-UHFFFAOYSA-N 0 0 373.752 3.964 20 5 FHBDRN O=C(N[C@@H]1CC[C@H](c2ccc(F)cc2)C1)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000471538556 930240758 /nfs/dbraw/zinc/24/07/58/930240758.db2.gz PCILSHFLHPVALF-SWLSCSKDSA-N 0 0 372.352 3.529 20 5 FHBDRN O=C(N[C@H]1CC[C@@H](c2ccc(F)cc2)C1)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000471538551 930240824 /nfs/dbraw/zinc/24/08/24/930240824.db2.gz PCILSHFLHPVALF-DOMZBBRYSA-N 0 0 372.352 3.529 20 5 FHBDRN Cc1cccc(COc2ccc(NC(=O)c3cc([N+](=O)[O-])n[nH]3)c(C)c2)c1 ZINC000510318778 930253058 /nfs/dbraw/zinc/25/30/58/930253058.db2.gz JTBXAJGJTXHYOB-UHFFFAOYSA-N 0 0 366.377 3.766 20 5 FHBDRN C[C@H](Nc1ccc([N+](=O)[O-])c2cnccc12)c1ccc2c(c1)CC(=O)N2C ZINC000728287046 930268743 /nfs/dbraw/zinc/26/87/43/930268743.db2.gz RLYBDWOZVILSES-LBPRGKRZSA-N 0 0 362.389 3.835 20 5 FHBDRN COc1ccccc1C[C@@H](C)N(C)C(=O)c1cccc(Cl)c1[N+](=O)[O-] ZINC000175901547 930277178 /nfs/dbraw/zinc/27/71/78/930277178.db2.gz SHTSFXURLZCVBJ-GFCCVEGCSA-N 0 0 362.813 3.960 20 5 FHBDRN O=[N+]([O-])c1ccccc1OC[C@H](O)CSCc1c(F)cccc1F ZINC000580140279 930298221 /nfs/dbraw/zinc/29/82/21/930298221.db2.gz HEHYQTBKYSTORD-NSHDSACASA-N 0 0 355.362 3.546 20 5 FHBDRN C[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)[C@H](c2ccco2)C1 ZINC000610389642 930306241 /nfs/dbraw/zinc/30/62/41/930306241.db2.gz SXMMQGKGBZVHPO-WFASDCNBSA-N 0 0 372.377 3.572 20 5 FHBDRN Cc1ccc2c(c1)CC[C@@H]2NC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000536010881 937402353 /nfs/dbraw/zinc/40/23/53/937402353.db2.gz DBPKWOGFPAYGLZ-SFHVURJKSA-N 0 0 351.406 3.658 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCc2cc(F)ccc2[C@H]1C ZINC000610391603 930310571 /nfs/dbraw/zinc/31/05/71/930310571.db2.gz KPIUTKIJHIYTHI-CYBMUJFWSA-N 0 0 357.385 3.600 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)N[C@@H]2C[C@H]2c2ccccc2F)cc1[N+](=O)[O-] ZINC000458505188 937408134 /nfs/dbraw/zinc/40/81/34/937408134.db2.gz MYZDFPUIZNODBT-YLQAJVPDSA-N 0 0 357.385 3.959 20 5 FHBDRN CC1(C)CC[C@@]([NH2+]Cc2cccc([N+](=O)[O-])c2)(C(=O)[O-])c2ccccc21 ZINC000580224627 930378067 /nfs/dbraw/zinc/37/80/67/930378067.db2.gz VUUJSYWRLDINCA-FQEVSTJZSA-N 0 0 354.406 3.736 20 5 FHBDRN Cc1c(CNC(=O)c2c(F)cccc2Br)cccc1[N+](=O)[O-] ZINC000319209176 930400643 /nfs/dbraw/zinc/40/06/43/930400643.db2.gz NZYCMGLKMXJNON-UHFFFAOYSA-N 0 0 367.174 3.735 20 5 FHBDRN C[C@H](C(=O)Nc1cc(-c2ccsc2)nn1C)c1cccc([N+](=O)[O-])c1 ZINC000580282620 930434687 /nfs/dbraw/zinc/43/46/87/930434687.db2.gz XKMCZCZOSAZUOG-NSHDSACASA-N 0 0 356.407 3.799 20 5 FHBDRN CC(C)Nc1ccc(F)cc1NC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000182262193 930443126 /nfs/dbraw/zinc/44/31/26/930443126.db2.gz AXTZNSRZDLEHKT-UHFFFAOYSA-N 0 0 361.329 3.535 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(=O)n1Cc1nc(-c2ccccc2Cl)cs1 ZINC000471551581 930451533 /nfs/dbraw/zinc/45/15/33/930451533.db2.gz MVBGVGZTRDSDFO-UHFFFAOYSA-N 0 0 361.810 3.890 20 5 FHBDRN CC(C)COc1ccccc1CNC(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000050121387 930454529 /nfs/dbraw/zinc/45/45/29/930454529.db2.gz IAQHLYZJODJJGQ-UHFFFAOYSA-N 0 0 357.410 3.629 20 5 FHBDRN COc1cc(Cc2noc(C3(Oc4ccccc4)CC3)n2)ccc1[N+](=O)[O-] ZINC000580300251 930458266 /nfs/dbraw/zinc/45/82/66/930458266.db2.gz FWYXQQBUFNLMSM-UHFFFAOYSA-N 0 0 367.361 3.645 20 5 FHBDRN O=C(Nc1cnn(-c2cccc(C(F)(F)F)c2)c1)c1ccc([N+](=O)[O-])o1 ZINC000070970433 930462583 /nfs/dbraw/zinc/46/25/83/930462583.db2.gz BQVVBKHDBAHDGB-UHFFFAOYSA-N 0 0 366.255 3.645 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N(C)[C@@H](C)Cc1ccc(O)cc1 ZINC000579534371 930488084 /nfs/dbraw/zinc/48/80/84/930488084.db2.gz QBIIHMCMTCPYQM-ZDUSSCGKSA-N 0 0 357.410 3.958 20 5 FHBDRN Cc1csc([C@@H](C)CNC(=O)c2c(C)cc(Cl)cc2[N+](=O)[O-])n1 ZINC000275825847 930489953 /nfs/dbraw/zinc/48/99/53/930489953.db2.gz RAEDHFLAOQJVJP-VIFPVBQESA-N 0 0 353.831 3.855 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)N1CC[C@H](Cc2ccc(F)cc2)C1 ZINC000076952730 930500137 /nfs/dbraw/zinc/50/01/37/930500137.db2.gz PQJIEAKZCWUOIV-QGZVFWFLSA-N 0 0 371.412 3.551 20 5 FHBDRN O=C(N[C@H]1CCCc2ccccc21)N1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000579540119 930503676 /nfs/dbraw/zinc/50/36/76/930503676.db2.gz BOQKBIPEKIYYMP-SFHVURJKSA-N 0 0 367.405 3.576 20 5 FHBDRN Cc1ccsc1[C@@H](CO)NC(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000536457408 930507314 /nfs/dbraw/zinc/50/73/14/930507314.db2.gz WGPUYTODYXSOJU-CQSZACIVSA-N 0 0 362.451 3.726 20 5 FHBDRN O=C(Nc1ccc(NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)cc1)NC1CC1 ZINC000118992362 930508317 /nfs/dbraw/zinc/50/83/17/930508317.db2.gz PQFJVCWBEFSQQI-UHFFFAOYSA-N 0 0 374.784 3.784 20 5 FHBDRN COc1ccc2c(c1)CCCN(C(=O)Nc1ccc([N+](=O)[O-])cc1OC)C2 ZINC000548080835 930527920 /nfs/dbraw/zinc/52/79/20/930527920.db2.gz HFOQKBBKCSGYAM-UHFFFAOYSA-N 0 0 371.393 3.592 20 5 FHBDRN O=C(N[C@@H]1CC[C@H]2CCCC[C@@H]2C1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000610434275 930531929 /nfs/dbraw/zinc/53/19/29/930531929.db2.gz SQMBMOFVQQGHEH-BFYDXBDKSA-N 0 0 368.437 3.869 20 5 FHBDRN Cc1ccc(NCCCNC(=O)N(C)CCc2ccccc2)c([N+](=O)[O-])c1 ZINC000610101973 930554441 /nfs/dbraw/zinc/55/44/41/930554441.db2.gz MNDVNSITGKEIKH-UHFFFAOYSA-N 0 0 370.453 3.589 20 5 FHBDRN O=C(N[C@@H](c1noc(-c2cccc([N+](=O)[O-])c2)n1)C1CC1)c1ccccc1 ZINC000580362920 930573718 /nfs/dbraw/zinc/57/37/18/930573718.db2.gz KQOCSXBHKMTBKX-MRXNPFEDSA-N 0 0 364.361 3.526 20 5 FHBDRN CO[C@H](c1ccc(F)cc1)[C@H](C)NC(=O)[C@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1 ZINC001266606562 930587322 /nfs/dbraw/zinc/58/73/22/930587322.db2.gz XIDWIWSADYONSL-BTINSWFASA-N 0 0 372.396 3.730 20 5 FHBDRN CO[C@H](c1ccc(F)cc1)[C@H](C)NC(=O)[C@H]1C[C@H]1c1cccc([N+](=O)[O-])c1 ZINC001266606565 930587425 /nfs/dbraw/zinc/58/74/25/930587425.db2.gz XIDWIWSADYONSL-TUCQFJRYSA-N 0 0 372.396 3.730 20 5 FHBDRN Cn1cccc1[C@@H]1CCCCN1C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000610438308 930594098 /nfs/dbraw/zinc/59/40/98/930594098.db2.gz VIOVZBSYUTUPJI-INIZCTEOSA-N 0 0 352.394 3.782 20 5 FHBDRN O=C(CCOc1ccc(F)c(Cl)c1)NCCc1ccccc1[N+](=O)[O-] ZINC000548089708 930607596 /nfs/dbraw/zinc/60/75/96/930607596.db2.gz QWUDFADVRDENQO-UHFFFAOYSA-N 0 0 366.776 3.515 20 5 FHBDRN Cc1c(C(=O)NCc2cccc([N+](=O)[O-])c2C)cnn1-c1ccc(C)cc1 ZINC000580389298 930611998 /nfs/dbraw/zinc/61/19/98/930611998.db2.gz PFUNUVKKCAERAH-UHFFFAOYSA-N 0 0 364.405 3.636 20 5 FHBDRN CCOc1c(F)cccc1C(=O)Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1 ZINC000175806785 930626616 /nfs/dbraw/zinc/62/66/16/930626616.db2.gz XOXAOGRRBZRPJN-UHFFFAOYSA-N 0 0 370.340 3.775 20 5 FHBDRN C[C@@H](C(=O)Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1)c1cccc(F)c1 ZINC000175806620 930626818 /nfs/dbraw/zinc/62/68/18/930626818.db2.gz YJRRDCJZNSRLKW-LLVKDONJSA-N 0 0 354.341 3.866 20 5 FHBDRN C[C@H](C(=O)Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1)c1cccc(F)c1 ZINC000175806600 930626977 /nfs/dbraw/zinc/62/69/77/930626977.db2.gz YJRRDCJZNSRLKW-NSHDSACASA-N 0 0 354.341 3.866 20 5 FHBDRN O=C(OCCn1cc([N+](=O)[O-])cn1)c1occc1CSc1ccccc1 ZINC000177757517 930629570 /nfs/dbraw/zinc/62/95/70/930629570.db2.gz AIHMRUFWPLZWLB-UHFFFAOYSA-N 0 0 373.390 3.534 20 5 FHBDRN O=C(NCc1ccc(Oc2cccc(F)c2)nc1)c1ccc([N+](=O)[O-])s1 ZINC000109904568 930642342 /nfs/dbraw/zinc/64/23/42/930642342.db2.gz DFCKYQRNQNZKOJ-UHFFFAOYSA-N 0 0 373.365 3.913 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2ccccc2OC(F)F)c1 ZINC000580409574 930644904 /nfs/dbraw/zinc/64/49/04/930644904.db2.gz XMYJJMOZZCHNDH-UHFFFAOYSA-N 0 0 352.293 3.847 20 5 FHBDRN Cn1cccc1C(=O)CSc1ccc(Br)cc1[N+](=O)[O-] ZINC000119104295 930675050 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FHBDRN Cc1ccc([C@H]2CCN(C(=O)NCc3ccccc3[N+](=O)[O-])C2)c(C)c1 ZINC000471590548 930826110 /nfs/dbraw/zinc/82/61/10/930826110.db2.gz NFHJLLAULSEJMT-KRWDZBQOSA-N 0 0 353.422 3.911 20 5 FHBDRN CN(Cc1cccc(O)c1)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000548116037 930889893 /nfs/dbraw/zinc/88/98/93/930889893.db2.gz QUVVTKGABYYYOY-UHFFFAOYSA-N 0 0 369.299 3.983 20 5 FHBDRN C[C@H]1CCc2ccccc2[C@@H]1NC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC001266629195 930907666 /nfs/dbraw/zinc/90/76/66/930907666.db2.gz WAYKOGKQJPISML-LHSJRXKWSA-N 0 0 363.417 3.989 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)[C@]12CCO[C@H]1CCCC2 ZINC001266631300 930925268 /nfs/dbraw/zinc/92/52/68/930925268.db2.gz RDOLVHYTUJBQLE-DZGCQCFKSA-N 0 0 358.316 3.901 20 5 FHBDRN O=C(c1ccc(F)cc1)[C@H]1CCCN(C(=O)c2cc(F)ccc2[N+](=O)[O-])C1 ZINC000737966168 930974276 /nfs/dbraw/zinc/97/42/76/930974276.db2.gz VJBYAMSOIMJCPR-ZDUSSCGKSA-N 0 0 374.343 3.608 20 5 FHBDRN Cc1cc(NC(=O)[C@H]2CC[C@H](C(F)(F)F)C2)c2cc([N+](=O)[O-])ccc2n1 ZINC000580673554 930999680 /nfs/dbraw/zinc/99/96/80/930999680.db2.gz YGWMTMXGYJKIJJ-QWRGUYRKSA-N 0 0 367.327 3.790 20 5 FHBDRN C[C@@H](Nc1c(Cl)cc(Cl)cc1[N+](=O)[O-])C(=O)NCc1ccco1 ZINC000561158952 931000562 /nfs/dbraw/zinc/00/05/62/931000562.db2.gz LGPRXXPDYUYCLE-MRVPVSSYSA-N 0 0 358.181 3.611 20 5 FHBDRN Cc1ccc(Cl)cc1NC(=O)N1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000579778096 931013377 /nfs/dbraw/zinc/01/33/77/931013377.db2.gz OQWQSJXDYAYCJP-UHFFFAOYSA-N 0 0 361.785 3.983 20 5 FHBDRN C[C@@H](C(=O)Nc1ccn(-c2ccccc2Cl)n1)c1cccc([N+](=O)[O-])c1 ZINC000579790152 931041820 /nfs/dbraw/zinc/04/18/20/931041820.db2.gz QAGSQTXCHPZXDP-GFCCVEGCSA-N 0 0 370.796 3.598 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)CSc1nccc2ccccc21 ZINC000177807577 931044297 /nfs/dbraw/zinc/04/42/97/931044297.db2.gz XODFCKHORUODBR-UHFFFAOYSA-N 0 0 367.430 3.894 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1)[C@@H](NCc1nnc(-c3ccc(F)cc3)[nH]1)CCC2 ZINC000579794169 931049100 /nfs/dbraw/zinc/04/91/00/931049100.db2.gz PUMKJRIXZGYERE-KRWDZBQOSA-N 0 0 367.384 3.686 20 5 FHBDRN CC(C)OC(=O)CCCNC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000275933533 931055084 /nfs/dbraw/zinc/05/50/84/931055084.db2.gz ICJNNHBWAXTLOQ-UHFFFAOYSA-N 0 0 366.417 3.555 20 5 FHBDRN Cc1ccccc1[C@@H](C(=O)[O-])[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000580726591 931063206 /nfs/dbraw/zinc/06/32/06/931063206.db2.gz XCWMZCWWCJYDRQ-APWZRJJASA-N 0 0 354.406 3.909 20 5 FHBDRN Cc1nc(-c2ccc(NC(=O)c3cccc(Cl)c3[N+](=O)[O-])cc2)n[nH]1 ZINC000175962204 931073418 /nfs/dbraw/zinc/07/34/18/931073418.db2.gz QISMCZGARVHFKU-UHFFFAOYSA-N 0 0 357.757 3.594 20 5 FHBDRN O=[N+]([O-])c1cccc(F)c1N1CCC(c2nc(-c3ccccc3)n[nH]2)CC1 ZINC000580731695 931074701 /nfs/dbraw/zinc/07/47/01/931074701.db2.gz UAVXXCJCOKYXFG-UHFFFAOYSA-N 0 0 367.384 3.903 20 5 FHBDRN CCC[C@H]1CN(C(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)CCO1 ZINC000275951613 931094016 /nfs/dbraw/zinc/09/40/16/931094016.db2.gz KSMXXVCXFSPZNV-HNNXBMFYSA-N 0 0 350.418 3.735 20 5 FHBDRN CO[C@@H]1CN(C(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)CC[C@@H]1C ZINC000275971734 931113650 /nfs/dbraw/zinc/11/36/50/931113650.db2.gz LGRXRVRERVSXOI-ORAYPTAESA-N 0 0 350.418 3.591 20 5 FHBDRN CC(C)(C)Cc1nnc(N2CCc3ccc([N+](=O)[O-])cc3C2)n1C1CC1 ZINC000579845281 931116455 /nfs/dbraw/zinc/11/64/55/931116455.db2.gz JDEZAHWPUIHPBV-UHFFFAOYSA-N 0 0 355.442 3.673 20 5 FHBDRN CCn1c(C)nc([N+](=O)[O-])c1N[C@@H]1CCCN(c2ccc(F)cc2C)C1 ZINC000580795000 931152870 /nfs/dbraw/zinc/15/28/70/931152870.db2.gz AULDENOMPQQLED-OAHLLOKOSA-N 0 0 361.421 3.648 20 5 FHBDRN CCC(=O)c1cccc(N[C@H](C)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])c1 ZINC000135067664 931163772 /nfs/dbraw/zinc/16/37/72/931163772.db2.gz NECMXZSGYSRMOT-GFCCVEGCSA-N 0 0 371.393 3.635 20 5 FHBDRN O=[N+]([O-])c1ccc(NC2CC(C(F)(F)F)C2)nc1-c1ccc(F)cc1 ZINC000579875471 931171659 /nfs/dbraw/zinc/17/16/59/931171659.db2.gz RKOBHLVBOYHYCR-UHFFFAOYSA-N 0 0 355.291 3.971 20 5 FHBDRN COc1cc(Cc2noc(C3(C(F)(F)F)CCC3)n2)ccc1[N+](=O)[O-] ZINC000580815774 931196288 /nfs/dbraw/zinc/19/62/88/931196288.db2.gz XXDNRNBWZUMHRQ-UHFFFAOYSA-N 0 0 357.288 3.561 20 5 FHBDRN Cc1cc(C)c(CN2CCN(C(=O)c3ccc([N+](=O)[O-])s3)CC2)c(C)c1 ZINC000064952582 931197171 /nfs/dbraw/zinc/19/71/71/931197171.db2.gz WXAZLFAGUYMUFP-UHFFFAOYSA-N 0 0 373.478 3.540 20 5 FHBDRN CC(C)(C(=O)N1CCCC[C@H]([C@@H]2CCOC2)C1)c1ccccc1[N+](=O)[O-] ZINC000891328135 931220251 /nfs/dbraw/zinc/22/02/51/931220251.db2.gz IQSJADDUEOTBCC-JKSUJKDBSA-N 0 0 360.454 3.538 20 5 FHBDRN CC(C)(NC(=O)COc1ccc([N+](=O)[O-])cc1)c1cccc(Cl)c1F ZINC000471625732 931256854 /nfs/dbraw/zinc/25/68/54/931256854.db2.gz NKAVSKITYSFGAT-UHFFFAOYSA-N 0 0 366.776 3.818 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)c2cnc(-c3ccccc3)nc2)cc1[N+](=O)[O-] ZINC000177835832 931265173 /nfs/dbraw/zinc/26/51/73/931265173.db2.gz YYNYWSINLRYKMQ-AWEZNQCLSA-N 0 0 362.389 3.851 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)[C@H](C)n2cnc3ccccc32)cc1[N+](=O)[O-] ZINC000177850080 931291103 /nfs/dbraw/zinc/29/11/03/931291103.db2.gz GVWSGLMDCSWFTC-KGLIPLIRSA-N 0 0 352.394 3.691 20 5 FHBDRN O=c1[nH]cnc2cc(N[C@@H]3C[C@@H]3c3c(F)cccc3Cl)c([N+](=O)[O-])cc12 ZINC000156673085 931301218 /nfs/dbraw/zinc/30/12/18/931301218.db2.gz OGTIFWIFZGGNFJ-ISVAXAHUSA-N 0 0 374.759 3.592 20 5 FHBDRN O=C(c1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCC[C@@]2(CCCOC2)C1 ZINC000610467135 931303952 /nfs/dbraw/zinc/30/39/52/931303952.db2.gz CDBNBHRXWFRDNV-MRXNPFEDSA-N 0 0 372.343 3.646 20 5 FHBDRN C[C@@H](NC(=O)N1CCC[C@@H](Nc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000177853404 931323751 /nfs/dbraw/zinc/32/37/51/931323751.db2.gz GPKGFPOBZFBQPR-CRAIPNDOSA-N 0 0 368.437 3.942 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)c2cccc(NC(=O)C3CC3)c2)cc1[N+](=O)[O-] ZINC000177855304 931326055 /nfs/dbraw/zinc/32/60/55/931326055.db2.gz DSIQDFBGLLXFBN-ZDUSSCGKSA-N 0 0 367.405 3.743 20 5 FHBDRN O=C1CCCc2cc(Oc3ncnc4sc([N+](=O)[O-])cc43)ccc2N1 ZINC000561237437 931331333 /nfs/dbraw/zinc/33/13/33/931331333.db2.gz FFCVFVOPCMIETI-UHFFFAOYSA-N 0 0 356.363 3.667 20 5 FHBDRN O=C(Nc1ccc(F)c(F)c1F)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000610468027 931337270 /nfs/dbraw/zinc/33/72/70/931337270.db2.gz FKNZTCBLUYVBKJ-UHFFFAOYSA-N 0 0 363.251 3.518 20 5 FHBDRN O=C([C@@H]1CC12CCCCC2)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000476992651 931345337 /nfs/dbraw/zinc/34/53/37/931345337.db2.gz FMZPKYZKXOVAEN-SFHVURJKSA-N 0 0 358.438 3.935 20 5 FHBDRN CC1(C)CC[C@@H](CNc2cccc(C(N)=O)c2[N+](=O)[O-])c2ccccc21 ZINC000561250078 931358971 /nfs/dbraw/zinc/35/89/71/931358971.db2.gz LKONNLGLJGKCPJ-ZDUSSCGKSA-N 0 0 353.422 3.961 20 5 FHBDRN CN1C(=O)c2cc(Br)ccc2N[C@@H]1c1ccc([N+](=O)[O-])cc1 ZINC000135079126 931364155 /nfs/dbraw/zinc/36/41/55/931364155.db2.gz QAZJSOYHATWIEM-AWEZNQCLSA-N 0 0 362.183 3.554 20 5 FHBDRN Cc1cccn2cc(CCNc3ccc([N+](=O)[O-])c(OC(F)F)c3)nc12 ZINC000610468880 931378079 /nfs/dbraw/zinc/37/80/79/931378079.db2.gz QRPTTZKSXFIYPR-UHFFFAOYSA-N 0 0 362.336 3.807 20 5 FHBDRN CCc1c(C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)[nH]c(C)c1C(C)=O ZINC000177866791 931390009 /nfs/dbraw/zinc/39/00/09/931390009.db2.gz UIPCCTGLNCGYLD-NSHDSACASA-N 0 0 357.410 3.796 20 5 FHBDRN COc1ccc(C(=O)CCC(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000177866038 931390161 /nfs/dbraw/zinc/39/01/61/931390161.db2.gz OANFCXKDWOYHKY-CQSZACIVSA-N 0 0 370.405 3.752 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)c2c[nH]nc2-c2ccccc2)cc1[N+](=O)[O-] ZINC000177865342 931392687 /nfs/dbraw/zinc/39/26/87/931392687.db2.gz FMIOOEGMXUCGQP-ZDUSSCGKSA-N 0 0 350.378 3.784 20 5 FHBDRN Cc1c(NC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cnn1-c1ccccc1 ZINC000156732968 931397401 /nfs/dbraw/zinc/39/74/01/931397401.db2.gz LDVUOVWEUSTISS-ZDUSSCGKSA-N 0 0 365.393 3.972 20 5 FHBDRN Cc1nc(COC(C)(C)C)oc1C(=O)N[C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000580956918 931409235 /nfs/dbraw/zinc/40/92/35/931409235.db2.gz FGTIVNJPXZYJHA-NSHDSACASA-N 0 0 361.398 3.697 20 5 FHBDRN CCO[C@@H]1C[C@@H](Nc2ccc([N+](=O)[O-])c(C(C)=O)c2)[C@H]1Oc1ccccc1 ZINC000561307069 931525121 /nfs/dbraw/zinc/52/51/21/931525121.db2.gz AWIRHLZVAJPSSW-MISYRCLQSA-N 0 0 370.405 3.834 20 5 FHBDRN Cc1cnc([C@@H](C)NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)s1 ZINC000177912008 931553151 /nfs/dbraw/zinc/55/31/51/931553151.db2.gz MVSAXHCAHDGRQH-SNVBAGLBSA-N 0 0 374.447 3.974 20 5 FHBDRN CN(C(=O)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12)[C@@H]1CCSC1 ZINC000276028162 931571927 /nfs/dbraw/zinc/57/19/27/931571927.db2.gz VZGVYQGBBNXOJF-GFCCVEGCSA-N 0 0 374.412 3.949 20 5 FHBDRN Cc1nccn1-c1ccc(CNC(=O)Nc2ccc([N+](=O)[O-])cc2)cc1F ZINC000127156332 931576360 /nfs/dbraw/zinc/57/63/60/931576360.db2.gz NTCCARCTQBWRFN-UHFFFAOYSA-N 0 0 369.356 3.550 20 5 FHBDRN Cc1cc([N+](=O)[O-])cn(Cc2csc(-c3ccc(Cl)cc3)n2)c1=O ZINC000127161954 931591202 /nfs/dbraw/zinc/59/12/02/931591202.db2.gz ADSSLKLKAUBXMS-UHFFFAOYSA-N 0 0 361.810 3.890 20 5 FHBDRN COc1ccccc1[C@H](CNC(=O)c1ccc([N+](=O)[O-])s1)OC(C)C ZINC000187395351 931605579 /nfs/dbraw/zinc/60/55/79/931605579.db2.gz VZYCTZXNOBYTCH-AWEZNQCLSA-N 0 0 364.423 3.561 20 5 FHBDRN CC(C)(NC(=O)c1cccc(Cn2ccnc2)c1)c1ccccc1[N+](=O)[O-] ZINC000581149348 931620084 /nfs/dbraw/zinc/62/00/84/931620084.db2.gz DONJOZQWNWORBI-UHFFFAOYSA-N 0 0 364.405 3.505 20 5 FHBDRN CCOc1ccc(-c2noc(-c3cccc(OC)c3[N+](=O)[O-])n2)cc1F ZINC000581158158 931628951 /nfs/dbraw/zinc/62/89/51/931628951.db2.gz YECGRZFLGOEASN-UHFFFAOYSA-N 0 0 359.313 3.858 20 5 FHBDRN CC(C)c1ccc(C(=O)N2CC[C@H](OCc3ccccn3)C2)cc1[N+](=O)[O-] ZINC000276073369 931721407 /nfs/dbraw/zinc/72/14/07/931721407.db2.gz WOPOWMRUKSIWQY-KRWDZBQOSA-N 0 0 369.421 3.545 20 5 FHBDRN CN(C[C@@H]1CCCO[C@@H]1c1ccccc1)C(=O)Cc1ccccc1[N+](=O)[O-] ZINC000050870427 931758879 /nfs/dbraw/zinc/75/88/79/931758879.db2.gz AJMYQLNDSIUJGC-GHTZIAJQSA-N 0 0 368.433 3.764 20 5 FHBDRN CCOC(=O)c1cccc(SCC(=O)N(C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000477059483 931794084 /nfs/dbraw/zinc/79/40/84/931794084.db2.gz BOMUOOXVGSHTNG-UHFFFAOYSA-N 0 0 374.418 3.527 20 5 FHBDRN O=C(CCc1nc(-c2ccc([N+](=O)[O-])cc2)no1)c1ccc(F)c(F)c1 ZINC000544931289 931824966 /nfs/dbraw/zinc/82/49/66/931824966.db2.gz CDNSQWHMVSNZDK-UHFFFAOYSA-N 0 0 359.288 3.739 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N1CCCCC[C@@H]1[C@H]1CCCCC1=O ZINC000126459649 931836995 /nfs/dbraw/zinc/83/69/95/931836995.db2.gz HCPGFVASXDGELN-QZTJIDSGSA-N 0 0 374.437 3.504 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CCC[C@H]1c1ccccc1Cl ZINC000126465792 931851898 /nfs/dbraw/zinc/85/18/98/931851898.db2.gz SJVIBVNMWUTMCN-HNNXBMFYSA-N 0 0 362.817 3.507 20 5 FHBDRN CCO[C@@H](C)c1nc(CN(C)c2cc(OC)c(F)cc2[N+](=O)[O-])cs1 ZINC000127181690 931863581 /nfs/dbraw/zinc/86/35/81/931863581.db2.gz CNYSILMAQWIHNC-JTQLQIEISA-N 0 0 369.418 3.933 20 5 FHBDRN CCCC1(CNC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)CCC1 ZINC000157121564 931884228 /nfs/dbraw/zinc/88/42/28/931884228.db2.gz WKMJVRMQWLSRAU-UHFFFAOYSA-N 0 0 359.470 3.898 20 5 FHBDRN O=[N+]([O-])c1ccc(NCc2ccnc(OC(F)F)c2)nc1-c1ccccc1 ZINC000561338150 931898988 /nfs/dbraw/zinc/89/89/88/931898988.db2.gz LJAFVTFQVPIQHJ-UHFFFAOYSA-N 0 0 372.331 3.687 20 5 FHBDRN Cc1cc(OCC(=O)Nc2ccc(-c3ccccc3)cn2)ccc1[N+](=O)[O-] ZINC000430571047 931908514 /nfs/dbraw/zinc/90/85/14/931908514.db2.gz ZYHIBMFIFNUFJA-UHFFFAOYSA-N 0 0 363.373 3.983 20 5 FHBDRN Cc1cc(OCC(=O)NCCCc2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000430572278 931912130 /nfs/dbraw/zinc/91/21/30/931912130.db2.gz FENUCKNBINKIHJ-UHFFFAOYSA-N 0 0 362.813 3.684 20 5 FHBDRN Cc1cc(OCC(=O)NCC2(Sc3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000430573587 931917653 /nfs/dbraw/zinc/91/76/53/931917653.db2.gz MEEMIJBFDNNNET-UHFFFAOYSA-N 0 0 372.446 3.723 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)N2CCC(=O)Nc3ccccc32)cc1[N+](=O)[O-] ZINC000135094353 931925647 /nfs/dbraw/zinc/92/56/47/931925647.db2.gz QYIURKTXNRKHIH-UHFFFAOYSA-N 0 0 367.405 3.881 20 5 FHBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)N[C@@H](CC2CC2)c2ccccc2)cc1 ZINC000610266980 931938657 /nfs/dbraw/zinc/93/86/57/931938657.db2.gz XTMCQTQPUILSGB-SFHVURJKSA-N 0 0 360.435 3.556 20 5 FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCC[C@@H](C)C1 ZINC000135121038 931943269 /nfs/dbraw/zinc/94/32/69/931943269.db2.gz CIQWWFXOYKURAK-CHWSQXEVSA-N 0 0 352.456 3.642 20 5 FHBDRN CSc1cccc(C(=O)NC[C@H]2CCO[C@@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000430580857 931946940 /nfs/dbraw/zinc/94/69/40/931946940.db2.gz FYRLATVDWLAPAA-RDTXWAMCSA-N 0 0 372.446 3.824 20 5 FHBDRN Cc1noc(C)c1C[C@@H](C)NC(=O)CCc1c(Cl)cccc1[N+](=O)[O-] ZINC000933255980 931990327 /nfs/dbraw/zinc/99/03/27/931990327.db2.gz HKKUGEMVDSHTKR-SNVBAGLBSA-N 0 0 365.817 3.533 20 5 FHBDRN C[C@H]1CCCCCN1C(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000510418733 932000981 /nfs/dbraw/zinc/00/09/81/932000981.db2.gz ZABAQEHFOWIBED-NSHDSACASA-N 0 0 360.332 3.941 20 5 FHBDRN CC1(C)[C@H](C(F)(F)F)CCN1C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000276179393 932003647 /nfs/dbraw/zinc/00/36/47/932003647.db2.gz IQNNEQFSIWWIIX-GFCCVEGCSA-N 0 0 355.316 3.879 20 5 FHBDRN O=[N+]([O-])c1cccc(CN(Cc2cncc(Br)c2)C2CC2)c1 ZINC000178002598 932010469 /nfs/dbraw/zinc/01/04/69/932010469.db2.gz WDYNRBISGJPXTI-UHFFFAOYSA-N 0 0 362.227 3.917 20 5 FHBDRN CC(C)(C)[C@H]1OCCC[C@H]1CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000135169054 932017931 /nfs/dbraw/zinc/01/79/31/932017931.db2.gz CACNMAMQXTWPPK-DJJJIMSYSA-N 0 0 373.453 3.576 20 5 FHBDRN COc1ccccc1[C@H]1CCN(C(=O)CCc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000933282882 932037323 /nfs/dbraw/zinc/03/73/23/932037323.db2.gz BMMIKBUIEIQFEM-HNNXBMFYSA-N 0 0 372.396 3.691 20 5 FHBDRN CN(C)C(=O)c1cccc(CSCCOc2ccccc2[N+](=O)[O-])c1 ZINC000060514965 932037373 /nfs/dbraw/zinc/03/73/73/932037373.db2.gz XMKGFGLHCCLEIF-UHFFFAOYSA-N 0 0 360.435 3.609 20 5 FHBDRN C[C@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@H]1COc2ccccc21 ZINC000165691747 932038238 /nfs/dbraw/zinc/03/82/38/932038238.db2.gz ILZFFKVMTOIILD-GXFFZTMASA-N 0 0 361.785 3.934 20 5 FHBDRN C[C@@H](CCNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21)c1ccccc1 ZINC000109971499 932057405 /nfs/dbraw/zinc/05/74/05/932057405.db2.gz ZXAKKEKLJGYLAT-HNNXBMFYSA-N 0 0 351.406 3.860 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CCC(F)(c3ccccn3)CC2)c(C(F)(F)F)c1 ZINC000581433329 932063636 /nfs/dbraw/zinc/06/36/36/932063636.db2.gz CRHQZNCKQIOYRY-UHFFFAOYSA-N 0 0 370.306 3.869 20 5 FHBDRN C[C@H]1C[C@@H](c2ccc(F)cc2)CN1C(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000135235689 932080005 /nfs/dbraw/zinc/08/00/05/932080005.db2.gz JRNPMZCBPOCZHY-DZGCQCFKSA-N 0 0 358.369 3.517 20 5 FHBDRN C[C@H]1C[C@H](c2ccc(F)cc2)CN1C(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000135235646 932080040 /nfs/dbraw/zinc/08/00/40/932080040.db2.gz JRNPMZCBPOCZHY-ZFWWWQNUSA-N 0 0 358.369 3.517 20 5 FHBDRN CCc1ccccc1NC(=O)CN(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000135236569 932085925 /nfs/dbraw/zinc/08/59/25/932085925.db2.gz OBIDFRCKHIJVRR-UHFFFAOYSA-N 0 0 353.422 3.760 20 5 FHBDRN CO[C@@H]1C[C@@H](c2ccccc2)CC[C@H]1NC(=O)c1cc([N+](=O)[O-])ccc1C ZINC000581480587 932149375 /nfs/dbraw/zinc/14/93/75/932149375.db2.gz ZTQQTIUYJCBJBP-PWIZWCRZSA-N 0 0 368.433 3.984 20 5 FHBDRN O=C(Cc1cc(Cl)ccc1Cl)OCC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000728340553 932164482 /nfs/dbraw/zinc/16/44/82/932164482.db2.gz OBMNDUPTGULSEC-UHFFFAOYSA-N 0 0 368.172 3.870 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(NCc2cccc(OCc3ccccn3)c2)n1 ZINC000121395856 932171647 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CC(C)n1nc2c(c1NC(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F)CCC2 ZINC000471674840 932297961 /nfs/dbraw/zinc/29/79/61/932297961.db2.gz XKWXKFGTSAJAMN-NSHDSACASA-N 0 0 360.389 3.742 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2noc(N3CCC[C@@H](Nc4ccccc4)C3)n2)cc1 ZINC000477128518 932346467 /nfs/dbraw/zinc/34/64/67/932346467.db2.gz RVXCSRMIVFCKBY-MRXNPFEDSA-N 0 0 365.393 3.726 20 5 FHBDRN COc1c(C(=O)N2CC[C@@](C)(c3ccc(C)cc3)C2)cccc1[N+](=O)[O-] ZINC000477141398 932349306 /nfs/dbraw/zinc/34/93/06/932349306.db2.gz FPPZJFFVVSMCGK-HXUWFJFHSA-N 0 0 354.406 3.716 20 5 FHBDRN COCc1ccccc1NC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000157360568 932383860 /nfs/dbraw/zinc/38/38/60/932383860.db2.gz GMAYEFOBLAGACI-UHFFFAOYSA-N 0 0 355.394 3.938 20 5 FHBDRN Cc1c(NC(=O)N2CC[C@@H]3OCC[C@@H]3C2)cc([N+](=O)[O-])cc1C(F)(F)F ZINC000933348231 932385982 /nfs/dbraw/zinc/38/59/82/932385982.db2.gz WRPOSTPOUIBWKX-YGRLFVJLSA-N 0 0 373.331 3.565 20 5 FHBDRN O=C1C(=Cc2ccc([N+](=O)[O-])s2)NC(=S)N1c1ccccc1Cl ZINC000588421032 932389477 /nfs/dbraw/zinc/38/94/77/932389477.db2.gz BZGQDIJDLTUNLM-JXMROGBWSA-N 0 0 365.823 3.572 20 5 FHBDRN CC(C)/C=C\C(=O)O[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000785058440 932395555 /nfs/dbraw/zinc/39/55/55/932395555.db2.gz IDXLGVCUUHJJEI-VAWSOJLPSA-N 0 0 374.315 3.696 20 5 FHBDRN CSc1ccccc1S(=O)(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000187427883 932450057 /nfs/dbraw/zinc/45/00/57/932450057.db2.gz FDPINYNENQZKDN-LBPRGKRZSA-N 0 0 366.464 3.665 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N(C)CCOc1ccccc1F ZINC000477290577 932453038 /nfs/dbraw/zinc/45/30/38/932453038.db2.gz KFKQNFFSYPAYQU-UHFFFAOYSA-N 0 0 366.776 3.847 20 5 FHBDRN C[C@@H]1CN(C(=O)c2ccccc2Sc2ccccc2[N+](=O)[O-])CCO1 ZINC000510447838 932459795 /nfs/dbraw/zinc/45/97/95/932459795.db2.gz XILFKKNWNGARFC-CYBMUJFWSA-N 0 0 358.419 3.607 20 5 FHBDRN C[C@@H]1[C@H](C)Sc2ccccc2N1C(=O)COc1ccccc1[N+](=O)[O-] ZINC000430637681 932478309 /nfs/dbraw/zinc/47/83/09/932478309.db2.gz BODLEDRNXPTBJR-OLZOCXBDSA-N 0 0 358.419 3.890 20 5 FHBDRN COc1cc(C(=O)Nc2ccc(CC(F)(F)F)cc2)ccc1[N+](=O)[O-] ZINC000127253837 932499510 /nfs/dbraw/zinc/49/95/10/932499510.db2.gz CZSXGLBXVVYZQJ-UHFFFAOYSA-N 0 0 354.284 3.961 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])c1nnc(C2CC2)n1Cc1cccs1 ZINC000581732919 932575703 /nfs/dbraw/zinc/57/57/03/932575703.db2.gz VTQGPIMLHLQORX-UHFFFAOYSA-N 0 0 369.450 3.810 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)N[C@@H]1CC[C@@H](c2ccc(F)cc2)C1 ZINC000471687650 932618327 /nfs/dbraw/zinc/61/83/27/932618327.db2.gz YERNMIBITCCXCR-NVXWUHKLSA-N 0 0 357.385 3.869 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CCC(=O)c1ccc2c(c1)CCC2 ZINC000023134628 932618916 /nfs/dbraw/zinc/61/89/16/932618916.db2.gz CIUYIIYNTDQGMP-UHFFFAOYSA-N 0 0 352.390 3.994 20 5 FHBDRN O=C(NC1CCN(c2cccs2)CC1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000127311860 932683460 /nfs/dbraw/zinc/68/34/60/932683460.db2.gz QZUJCPSRHVWHCN-UHFFFAOYSA-N 0 0 365.842 3.709 20 5 FHBDRN C[C@H]1CCc2c(F)cccc2[C@H]1NC(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000430660960 932689093 /nfs/dbraw/zinc/68/90/93/932689093.db2.gz FFPRQGSEOUWSLV-BUXKBTBVSA-N 0 0 358.369 3.553 20 5 FHBDRN COc1ccc2c(c1)[C@H](NC(=O)CCOc1ccccc1[N+](=O)[O-])CCC2 ZINC001266821788 932697640 /nfs/dbraw/zinc/69/76/40/932697640.db2.gz YPYJLIPPCHVNQU-QGZVFWFLSA-N 0 0 370.405 3.566 20 5 FHBDRN Cc1c(Br)cc(C(=O)N2C[C@H]3CCC[C@@H]3C2)cc1[N+](=O)[O-] ZINC000127315325 932704184 /nfs/dbraw/zinc/70/41/84/932704184.db2.gz BGLGLATZNWUFNW-GHMZBOCLSA-N 0 0 353.216 3.538 20 5 FHBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1N)c1ccc(C(F)(F)F)cc1 ZINC000178162686 932710299 /nfs/dbraw/zinc/71/02/99/932710299.db2.gz FLBGQULZGXBVCS-SECBINFHSA-N 0 0 353.300 3.687 20 5 FHBDRN O=C(NCc1nc(CNc2ccc([N+](=O)[O-])s2)cs1)c1ccccc1 ZINC000610542236 932729071 /nfs/dbraw/zinc/72/90/71/932729071.db2.gz DXBDKBOUACHMKS-UHFFFAOYSA-N 0 0 374.447 3.655 20 5 FHBDRN COc1ccc(NC(=O)CN2CCC[C@@H]2c2cccc(C)c2)c([N+](=O)[O-])c1 ZINC000055911135 932738301 /nfs/dbraw/zinc/73/83/01/932738301.db2.gz HVQXLWHMQSNNBB-GOSISDBHSA-N 0 0 369.421 3.687 20 5 FHBDRN Cc1cc(C(=O)Nc2cc(-c3cccc([N+](=O)[O-])c3)[nH]n2)c(F)cc1F ZINC000178171329 932738833 /nfs/dbraw/zinc/73/88/33/932738833.db2.gz QYLNLXWDWXGAMT-UHFFFAOYSA-N 0 0 358.304 3.824 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)N[C@H]1CC[C@H](c2ccc(F)cc2)C1 ZINC000471735449 932741292 /nfs/dbraw/zinc/74/12/92/932741292.db2.gz JFZOWLXBAPQYOU-WMZOPIPTSA-N 0 0 371.412 3.912 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N[C@H](C)C[C@@H](O)c1ccccc1 ZINC000276588664 932753676 /nfs/dbraw/zinc/75/36/76/932753676.db2.gz MRZSGPDXYSJTEF-MLGOLLRUSA-N 0 0 362.813 3.799 20 5 FHBDRN O=C1CCc2cc([N+](=O)[O-])c(NC[C@H]3CCC4(CCCCC4)O3)cc2N1 ZINC000477626395 932756922 /nfs/dbraw/zinc/75/69/22/932756922.db2.gz GKQVWPXKJWDSPT-CQSZACIVSA-N 0 0 359.426 3.773 20 5 FHBDRN Cc1nc(C)n(-c2ccccc2NC(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)n1 ZINC000581861372 932760286 /nfs/dbraw/zinc/76/02/86/932760286.db2.gz XSWZZJARSBMWBV-LBPRGKRZSA-N 0 0 365.393 3.535 20 5 FHBDRN CC[C@H](C(=O)O[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000003446454 932761271 /nfs/dbraw/zinc/76/12/71/932761271.db2.gz JHRALTZMKKAFDP-DYVFJYSZSA-N 0 0 356.378 3.659 20 5 FHBDRN Cc1cccc([C@@H](NCC(=O)Nc2ccccc2[N+](=O)[O-])C(F)(F)F)c1 ZINC000510470453 932764728 /nfs/dbraw/zinc/76/47/28/932764728.db2.gz IDLYMUSREILXDZ-MRXNPFEDSA-N 0 0 367.327 3.735 20 5 FHBDRN CSc1ccccc1S(=O)(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000187438645 932771198 /nfs/dbraw/zinc/77/11/98/932771198.db2.gz PGSGNXHJMLWECL-UHFFFAOYSA-N 0 0 366.464 3.530 20 5 FHBDRN C[C@H](CNC(=O)CCc1cc(F)ccc1[N+](=O)[O-])COCc1ccccc1 ZINC001125536995 932773036 /nfs/dbraw/zinc/77/30/36/932773036.db2.gz RYBWCTBTCVPMOB-OAHLLOKOSA-N 0 0 374.412 3.636 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)N(C)CC2(O)CCCCCC2)cc1[N+](=O)[O-] ZINC000187443208 932773106 /nfs/dbraw/zinc/77/31/06/932773106.db2.gz BYPYHOAQINHCOO-OAHLLOKOSA-N 0 0 363.458 3.691 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NC[C@@H](C)COCc1ccccc1 ZINC001125537218 932783478 /nfs/dbraw/zinc/78/34/78/932783478.db2.gz VJTXCVSHMQLXEC-CQSZACIVSA-N 0 0 356.422 3.794 20 5 FHBDRN CSc1ccncc1NC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000610545745 932806703 /nfs/dbraw/zinc/80/67/03/932806703.db2.gz TZCLVLRFHAXEDW-UHFFFAOYSA-N 0 0 367.814 3.773 20 5 FHBDRN CCc1ccc([C@@H](NCCOCC(F)F)c2ccc([N+](=O)[O-])cc2)o1 ZINC000471763813 932827822 /nfs/dbraw/zinc/82/78/22/932827822.db2.gz XOWBROIZTDUOCV-KRWDZBQOSA-N 0 0 354.353 3.711 20 5 FHBDRN COc1cc(NCc2nc3cc(Cl)ccc3n2C)c(F)cc1[N+](=O)[O-] ZINC000548286537 932829268 /nfs/dbraw/zinc/82/92/68/932829268.db2.gz LEWRRAZGJHQRTF-UHFFFAOYSA-N 0 0 364.764 3.895 20 5 FHBDRN C[C@@H]1C[C@H](c2ccccc2)[C@@H](C)N1C(=O)COc1ccccc1[N+](=O)[O-] ZINC000247386503 932856452 /nfs/dbraw/zinc/85/64/52/932856452.db2.gz LUMRMPZSKATSTJ-INMHGKMJSA-N 0 0 354.406 3.767 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)NCCc2ccc(Cl)cc2Cl)c1 ZINC000145385703 932865867 /nfs/dbraw/zinc/86/58/67/932865867.db2.gz VPSHNRSLFDVNQJ-UHFFFAOYSA-N 0 0 369.204 3.883 20 5 FHBDRN C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)Nc1cccc2ccn(C)c21 ZINC000471778325 932887514 /nfs/dbraw/zinc/88/75/14/932887514.db2.gz FFIQXLADWDTGPL-CYBMUJFWSA-N 0 0 352.394 3.916 20 5 FHBDRN CCOc1ccc(C(=O)N2C[C@@H](C)Oc3cc(C)ccc32)cc1[N+](=O)[O-] ZINC000178222933 932910142 /nfs/dbraw/zinc/91/01/42/932910142.db2.gz JEPKMJIWMGPRPX-CYBMUJFWSA-N 0 0 356.378 3.730 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2noc(CN3CCSC4(CCCCC4)C3)n2)c1 ZINC000175966379 932917635 /nfs/dbraw/zinc/91/76/35/932917635.db2.gz QWPSCSRPKMAIBA-UHFFFAOYSA-N 0 0 374.466 3.897 20 5 FHBDRN COc1ccc(C(C)=O)c(OC(=O)C(C)=Cc2ccc([N+](=O)[O-])cc2)c1 ZINC000588435259 932923553 /nfs/dbraw/zinc/92/35/53/932923553.db2.gz UACNKSILRSEJLN-BENRWUELSA-N 0 0 355.346 3.815 20 5 FHBDRN O=C(NCc1cccc([N+](=O)[O-])c1)N1CC[C@@H](CSc2ccccc2)C1 ZINC000175974767 932944812 /nfs/dbraw/zinc/94/48/12/932944812.db2.gz IADBWGNWGYWJQP-MRXNPFEDSA-N 0 0 371.462 3.919 20 5 FHBDRN CC(C)(CO)CNC(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000610922647 932948902 /nfs/dbraw/zinc/94/89/02/932948902.db2.gz FNBYPUVSSHAIBV-UHFFFAOYSA-N 0 0 359.382 3.527 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)c1ncsc1Br ZINC000581905809 932957700 /nfs/dbraw/zinc/95/77/00/932957700.db2.gz XZAYMWSUTGKPHA-UHFFFAOYSA-N 0 0 356.201 3.683 20 5 FHBDRN CC[C@H](CNC(=O)c1cc(F)c(F)cc1[N+](=O)[O-])Oc1ccccc1C ZINC000175982251 932958022 /nfs/dbraw/zinc/95/80/22/932958022.db2.gz OGTBTMRHSRRACG-GFCCVEGCSA-N 0 0 364.348 3.769 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(-c2nc(-c3ccccc3C(F)(F)F)no2)n1 ZINC000581908964 932984570 /nfs/dbraw/zinc/98/45/70/932984570.db2.gz DKUSQSRJZHXMMW-UHFFFAOYSA-N 0 0 353.260 3.547 20 5 FHBDRN CCc1ccccc1CSc1ccc([N+](=O)[O-])c(S(C)(=O)=O)c1 ZINC000187530094 932985567 /nfs/dbraw/zinc/98/55/67/932985567.db2.gz KUZNWDRELUUXDZ-UHFFFAOYSA-N 0 0 351.449 3.853 20 5 FHBDRN Cc1ccc(F)cc1CSc1ccc([N+](=O)[O-])c(S(C)(=O)=O)c1 ZINC000187538215 932997836 /nfs/dbraw/zinc/99/78/36/932997836.db2.gz FWODVHHYFKAWNG-UHFFFAOYSA-N 0 0 355.412 3.738 20 5 FHBDRN Cc1c(CC(=O)NC2(Cc3cccc(F)c3)CCC2)cccc1[N+](=O)[O-] ZINC000187554677 933002087 /nfs/dbraw/zinc/00/20/87/933002087.db2.gz OKFWBACQSLAZRG-UHFFFAOYSA-N 0 0 356.397 3.866 20 5 FHBDRN CCS[C@@H](C)c1noc(CN(C)[C@@H](C)c2cccc([N+](=O)[O-])c2)n1 ZINC000178269102 933003968 /nfs/dbraw/zinc/00/39/68/933003968.db2.gz GEHPUARQBIYJCZ-RYUDHWBXSA-N 0 0 350.444 3.985 20 5 FHBDRN CCOc1cccc(N2CC[C@H](n3cnc4c3CCCC4)C2)c1[N+](=O)[O-] ZINC000548333994 933009296 /nfs/dbraw/zinc/00/92/96/933009296.db2.gz BGXRCAKAVINKRR-AWEZNQCLSA-N 0 0 356.426 3.520 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CCC[C@H]1CCCc1ccccc1 ZINC000156481248 933035926 /nfs/dbraw/zinc/03/59/26/933035926.db2.gz OMEANEUAHXMMEF-GOSISDBHSA-N 0 0 370.453 3.504 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc2c(c1)CCC(=O)N2C ZINC000588438645 933059517 /nfs/dbraw/zinc/05/95/17/933059517.db2.gz JFWJIERNOFBMCK-QBFSEMIESA-N 0 0 365.389 3.546 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N1C[C@H](c2ccccc2)OC[C@@H]1C ZINC000588438579 933059628 /nfs/dbraw/zinc/05/96/28/933059628.db2.gz VIFOAUPELAORCI-YGSZSEMYSA-N 0 0 366.417 3.987 20 5 FHBDRN C[C@H](Cc1cccs1)NC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000178298360 933071307 /nfs/dbraw/zinc/07/13/07/933071307.db2.gz VPNQNDWSXHLLNM-CYBMUJFWSA-N 0 0 359.451 3.962 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)Nc1cnccc1-n1cc(C)cn1 ZINC000588440949 933071819 /nfs/dbraw/zinc/07/18/19/933071819.db2.gz JWTMPHGORINFIH-ZROIWOOFSA-N 0 0 363.377 3.526 20 5 FHBDRN O=[N+]([O-])c1ccccc1Cc1noc(/C=C\c2ccccc2-n2cccn2)n1 ZINC000581936184 933078196 /nfs/dbraw/zinc/07/81/96/933078196.db2.gz CYUWMVVYSKOLSG-KHPPLWFESA-N 0 0 373.372 3.925 20 5 FHBDRN CC(C)c1cccc(N(C)S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)c1 ZINC000146362367 933084323 /nfs/dbraw/zinc/08/43/23/933084323.db2.gz MTOYBYUVOWCEGZ-UHFFFAOYSA-N 0 0 352.387 3.682 20 5 FHBDRN COc1ccc(CNC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1F ZINC000178304887 933094446 /nfs/dbraw/zinc/09/44/46/933094446.db2.gz PDOPISZYVYMSQI-UHFFFAOYSA-N 0 0 373.384 3.617 20 5 FHBDRN COc1cccc(-c2nc(-c3ccnc(OC4CCC4)c3)no2)c1[N+](=O)[O-] ZINC000581968980 933142355 /nfs/dbraw/zinc/14/23/55/933142355.db2.gz LJZHVCQBQXLODU-UHFFFAOYSA-N 0 0 368.349 3.647 20 5 FHBDRN Cc1ccc(NC(=O)c2cnc(Oc3ccccc3)cn2)cc1[N+](=O)[O-] ZINC000090988332 933147646 /nfs/dbraw/zinc/14/76/46/933147646.db2.gz NCBUDAJGHZKQPT-UHFFFAOYSA-N 0 0 350.334 3.738 20 5 FHBDRN COC(=O)c1cc(NC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)c(C)cc1C ZINC000471858493 933179199 /nfs/dbraw/zinc/17/91/99/933179199.db2.gz RYWXPRGFMDWYEU-CYBMUJFWSA-N 0 0 371.393 3.881 20 5 FHBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N([C@@H](C)c1ccccc1)C1CC1 ZINC000510524875 933181094 /nfs/dbraw/zinc/18/10/94/933181094.db2.gz RKQZOEJANYTONL-AWEZNQCLSA-N 0 0 360.435 3.818 20 5 FHBDRN O=C(c1c[nH]c2cccc([N+](=O)[O-])c12)N1CC(Cc2ccc(F)c(F)c2)C1 ZINC000548380796 933190808 /nfs/dbraw/zinc/19/08/08/933190808.db2.gz LIHUOIQBJPXJMT-UHFFFAOYSA-N 0 0 371.343 3.669 20 5 FHBDRN CC[C@@H](CNC(=O)c1ccc([N+](=O)[O-])[nH]1)Oc1cccc(C(F)(F)F)c1 ZINC000430743760 933194539 /nfs/dbraw/zinc/19/45/39/933194539.db2.gz PYTYCWRTKHHTJR-NSHDSACASA-N 0 0 371.315 3.529 20 5 FHBDRN COc1ccc2oc(CN3CCN(c4cccc([N+](=O)[O-])c4)CC3)cc2c1 ZINC000510536036 933197635 /nfs/dbraw/zinc/19/76/35/933197635.db2.gz DDPFPYGYPYUSOE-UHFFFAOYSA-N 0 0 367.405 3.672 20 5 FHBDRN COc1ccc(NC(=O)COc2ccc([N+](=O)[O-])c(C)c2)cc1OC(C)C ZINC000430811945 933247716 /nfs/dbraw/zinc/24/77/16/933247716.db2.gz AONYKTGGCCGBCE-UHFFFAOYSA-N 0 0 374.393 3.717 20 5 FHBDRN Cc1cc(OCC(=O)NC(C)(C)c2ccc(F)c(F)c2)ccc1[N+](=O)[O-] ZINC000430805086 933249796 /nfs/dbraw/zinc/24/97/96/933249796.db2.gz HJDSHCQNKGXYFQ-UHFFFAOYSA-N 0 0 364.348 3.612 20 5 FHBDRN Cc1cc(OCC(=O)NC[C@H]2CCCC[C@@H]2C(F)(F)F)ccc1[N+](=O)[O-] ZINC000430804845 933249854 /nfs/dbraw/zinc/24/98/54/933249854.db2.gz BOGCDFCWFKPWSI-OCCSQVGLSA-N 0 0 374.359 3.767 20 5 FHBDRN Cc1cc(OCC(=O)NC[C@H]2CCC[C@@H](C(F)(F)F)C2)ccc1[N+](=O)[O-] ZINC000430807277 933250954 /nfs/dbraw/zinc/25/09/54/933250954.db2.gz LWLFCUVXNJODSO-QWHCGFSZSA-N 0 0 374.359 3.767 20 5 FHBDRN C[C@@H](NC(=O)Nc1cc2c(cc1F)CCC(=O)N2)c1cccc([N+](=O)[O-])c1 ZINC000510603654 933264184 /nfs/dbraw/zinc/26/41/84/933264184.db2.gz ZFZIDLOMGWYLKS-SNVBAGLBSA-N 0 0 372.356 3.501 20 5 FHBDRN Cc1cc(OCC(=O)N[C@@H]2CC[C@H](c3cccc(F)c3)C2)ccc1[N+](=O)[O-] ZINC000430831969 933281949 /nfs/dbraw/zinc/28/19/49/933281949.db2.gz FBXZZWLRGUFBOW-DOTOQJQBSA-N 0 0 372.396 3.874 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1CNCc1noc(-c2ccccc2C)n1 ZINC000276772575 933305800 /nfs/dbraw/zinc/30/58/00/933305800.db2.gz PBGZEWSIKLGJRG-UHFFFAOYSA-N 0 0 368.393 3.642 20 5 FHBDRN Cc1nc(NC(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cs1 ZINC000477746704 933307320 /nfs/dbraw/zinc/30/73/20/933307320.db2.gz NORVUFSVYVNUPX-UHFFFAOYSA-N 0 0 374.344 3.819 20 5 FHBDRN Cc1ccc([C@H]2NC(=O)N([C@H](C)c3cccc([N+](=O)[O-])c3)C2=O)cc1C ZINC000430878234 933344830 /nfs/dbraw/zinc/34/48/30/933344830.db2.gz NFNVGJWYDSKIIP-CXAGYDPISA-N 0 0 353.378 3.566 20 5 FHBDRN CN(C(=O)CCc1ccccc1Br)c1cccc([N+](=O)[O-])c1 ZINC000158008358 933358877 /nfs/dbraw/zinc/35/88/77/933358877.db2.gz FJAPFPKRLAZMGJ-UHFFFAOYSA-N 0 0 363.211 3.953 20 5 FHBDRN CC(C)(NC(=O)CCn1ccc2ccccc21)c1ccc([N+](=O)[O-])cc1 ZINC000430902309 933383489 /nfs/dbraw/zinc/38/34/89/933383489.db2.gz XYHFOXGDSKSMCU-UHFFFAOYSA-N 0 0 351.406 3.991 20 5 FHBDRN Cc1c(Br)cc(C(=O)N(C)CCOC(C)(C)C)cc1[N+](=O)[O-] ZINC000611072946 933434778 /nfs/dbraw/zinc/43/47/78/933434778.db2.gz LOIOVRSPKQSIOI-UHFFFAOYSA-N 0 0 373.247 3.553 20 5 FHBDRN COc1cc(N2C[C@@H](C(F)(F)F)[C@H](C(F)(F)F)C2)ccc1[N+](=O)[O-] ZINC000610587773 933439301 /nfs/dbraw/zinc/43/93/01/933439301.db2.gz YEXIRCBAUZAYHM-RKDXNWHRSA-N 0 0 358.238 3.780 20 5 FHBDRN CCCCCNC(=O)C1CCN(c2ccc([N+](=O)[O-])c(OCC)c2)CC1 ZINC000178344809 933450025 /nfs/dbraw/zinc/45/00/25/933450025.db2.gz QUWOFOQJMUNGES-UHFFFAOYSA-N 0 0 363.458 3.516 20 5 FHBDRN Cc1cccc(C(=O)N2C[C@H](C(F)(F)F)[C@@H](C(F)(F)F)C2)c1[N+](=O)[O-] ZINC000610597894 933484079 /nfs/dbraw/zinc/48/40/79/933484079.db2.gz JHCMPBIJONXWFF-UWVGGRQHSA-N 0 0 370.249 3.716 20 5 FHBDRN CC(C)CN(c1ccccc1)S(=O)(=O)CCc1ccc([N+](=O)[O-])cc1 ZINC000510715519 933503176 /nfs/dbraw/zinc/50/31/76/933503176.db2.gz UXWZXIOWADVYPH-UHFFFAOYSA-N 0 0 362.451 3.630 20 5 FHBDRN CCNc1ccc(C(=O)NCc2c(F)c(F)cc(F)c2F)cc1[N+](=O)[O-] ZINC000610603471 933504612 /nfs/dbraw/zinc/50/46/12/933504612.db2.gz WRVDEEQNNHFYIB-UHFFFAOYSA-N 0 0 371.290 3.513 20 5 FHBDRN O=[N+]([O-])c1cccc(OCCN2C[C@@H](C(F)(F)F)[C@H](C(F)(F)F)C2)c1 ZINC000610604853 933514008 /nfs/dbraw/zinc/51/40/08/933514008.db2.gz PQEMNZLUYLFBRK-VXGBXAGGSA-N 0 0 372.265 3.646 20 5 FHBDRN Cc1noc([C@H](OC(=O)c2ccc(Cl)cc2[N+](=O)[O-])c2ccccc2)n1 ZINC000176089062 933521797 /nfs/dbraw/zinc/52/17/97/933521797.db2.gz FPNSCGWMUDVHCF-OAHLLOKOSA-N 0 0 373.752 3.886 20 5 FHBDRN COc1ccc([C@@H](C)NC(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)cc1F ZINC000121596381 933538462 /nfs/dbraw/zinc/53/84/62/933538462.db2.gz BTLYOINIVGYVNR-GFCCVEGCSA-N 0 0 373.384 3.571 20 5 FHBDRN Cc1c(NC(=O)NCc2c(F)c(F)cc(F)c2F)cccc1[N+](=O)[O-] ZINC000610627451 933548409 /nfs/dbraw/zinc/54/84/09/933548409.db2.gz CUCOHVXEZGQDJP-UHFFFAOYSA-N 0 0 357.263 3.781 20 5 FHBDRN Cc1ccc(C(=O)N[C@H](C[C@H]2CCOC2)c2ccccc2)cc1[N+](=O)[O-] ZINC000159350347 933556135 /nfs/dbraw/zinc/55/61/35/933556135.db2.gz RGXANZAZLOWXMP-CRAIPNDOSA-N 0 0 354.406 3.801 20 5 FHBDRN C[C@]1(c2ccccc2)CN(C(=O)Nc2cc(F)cc([N+](=O)[O-])c2)CCO1 ZINC000548416291 933560057 /nfs/dbraw/zinc/56/00/57/933560057.db2.gz AFRVOCHVPKNLRB-GOSISDBHSA-N 0 0 359.357 3.513 20 5 FHBDRN COC[C@H]1CCCN1C(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000610635344 933569001 /nfs/dbraw/zinc/56/90/01/933569001.db2.gz CHSNMUQOLVVLPI-MRXNPFEDSA-N 0 0 355.394 3.589 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)c2noc(-c3cccc(F)c3)n2)cc1[N+](=O)[O-] ZINC000610636093 933580164 /nfs/dbraw/zinc/58/01/64/933580164.db2.gz OBFCPTGMAPLZEN-NSHDSACASA-N 0 0 370.340 3.583 20 5 FHBDRN CCC[C@H](NC(=O)c1c[nH]nc1[N+](=O)[O-])c1cccc(C(F)(F)F)c1 ZINC000548419575 933580477 /nfs/dbraw/zinc/58/04/77/933580477.db2.gz KDLXEKCSCWWIKH-LBPRGKRZSA-N 0 0 356.304 3.608 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)c2noc(-c3cccc(F)c3)n2)cc1[N+](=O)[O-] ZINC000610636092 933580633 /nfs/dbraw/zinc/58/06/33/933580633.db2.gz OBFCPTGMAPLZEN-LLVKDONJSA-N 0 0 370.340 3.583 20 5 FHBDRN CCOc1ccc([C@@H](C)NC(=O)NCCc2cccc([N+](=O)[O-])c2)cc1 ZINC000611147307 933590758 /nfs/dbraw/zinc/59/07/58/933590758.db2.gz GPUQNOWKWKNFPN-CQSZACIVSA-N 0 0 357.410 3.596 20 5 FHBDRN Cn1nnc2cc(/C=C(\c3ccncc3)c3ccc([N+](=O)[O-])cc3)ccc21 ZINC000430983840 933615103 /nfs/dbraw/zinc/61/51/03/933615103.db2.gz JIILQJHAKAEMAG-PDGQHHTCSA-N 0 0 357.373 3.860 20 5 FHBDRN C[C@H](C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)N1[C@H](C)C[C@@H]1C ZINC000548424981 933621315 /nfs/dbraw/zinc/62/13/15/933621315.db2.gz HAJCPPQVDRZEBC-GRYCIOLGSA-N 0 0 360.439 3.528 20 5 FHBDRN COC(=O)c1cccc(Br)c1COc1ccccc1[N+](=O)[O-] ZINC000430991415 933628974 /nfs/dbraw/zinc/62/89/74/933628974.db2.gz QJZMIWWAOYQFTE-UHFFFAOYSA-N 0 0 366.167 3.723 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])c(F)c1)Nc1cccnc1-c1ccccc1 ZINC000121602512 933649952 /nfs/dbraw/zinc/64/99/52/933649952.db2.gz XJJVKGGCSTZTRP-UHFFFAOYSA-N 0 0 367.336 3.813 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1F)N1CCCCC[C@@H]1[C@@H]1CCCCC1=O ZINC000610664427 933681874 /nfs/dbraw/zinc/68/18/74/933681874.db2.gz XQHMBESSNQXNMJ-DOTOQJQBSA-N 0 0 362.401 3.878 20 5 FHBDRN COc1ccc2ccc(C(=O)NCCNc3ccc([N+](=O)[O-])cc3)cc2c1 ZINC000431023483 933689412 /nfs/dbraw/zinc/68/94/12/933689412.db2.gz HTMUPDLAIPNCCL-UHFFFAOYSA-N 0 0 365.389 3.599 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])c[nH]1)N1CCC[C@@H]1c1ccccc1Br ZINC000610669716 933705018 /nfs/dbraw/zinc/70/50/18/933705018.db2.gz JXNSMNGSZMBRQT-CQSZACIVSA-N 0 0 364.199 3.663 20 5 FHBDRN O=C(NC[C@@H]1CCCSC1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000561714635 933705732 /nfs/dbraw/zinc/70/57/32/933705732.db2.gz ANJNMQSEBZQTQS-NSHDSACASA-N 0 0 363.464 3.591 20 5 FHBDRN CCN(Cc1ccc(Cl)c(Cl)c1)C(=O)c1c([N+](=O)[O-])c(C)nn1C ZINC000098100591 933766377 /nfs/dbraw/zinc/76/63/77/933766377.db2.gz QMEUWHGTKQIKPH-UHFFFAOYSA-N 0 0 371.224 3.606 20 5 FHBDRN C[C@@H](NC(=O)OC(C)(C)C)[C@H](C)c1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000276844894 933776231 /nfs/dbraw/zinc/77/62/31/933776231.db2.gz CTNPPNNPSWRZAL-WDEREUQCSA-N 0 0 362.386 3.662 20 5 FHBDRN CSCc1nnc(SCc2coc(-c3ccc([N+](=O)[O-])cc3)n2)o1 ZINC000131406654 933778049 /nfs/dbraw/zinc/77/80/49/933778049.db2.gz HOYRGEKMISVAHG-UHFFFAOYSA-N 0 0 364.408 3.788 20 5 FHBDRN CCOc1cc(CNc2cc(C(=O)N(C)C)ccc2C)ccc1[N+](=O)[O-] ZINC000276846879 933784528 /nfs/dbraw/zinc/78/45/28/933784528.db2.gz DCLNAAABKGTGAP-UHFFFAOYSA-N 0 0 357.410 3.616 20 5 FHBDRN O=C(NC[C@H]1CCC(F)(F)C1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000431083559 933807154 /nfs/dbraw/zinc/80/71/54/933807154.db2.gz ZDLMFEBPJDJSNU-QMMMGPOBSA-N 0 0 352.259 3.779 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)NCCc1cccc(Cl)c1 ZINC000510823534 933816377 /nfs/dbraw/zinc/81/63/77/933816377.db2.gz CKJHPSZGRBCOTO-UHFFFAOYSA-N 0 0 361.829 3.675 20 5 FHBDRN CCOc1cc(CNc2cccc(N3CCOC3=O)c2C)ccc1[N+](=O)[O-] ZINC000276861101 933823940 /nfs/dbraw/zinc/82/39/40/933823940.db2.gz GKXQUEDDWJFBIP-UHFFFAOYSA-N 0 0 371.393 3.871 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2noc(CNc3cc(F)cc(F)c3F)n2)cc1 ZINC000431096213 933826759 /nfs/dbraw/zinc/82/67/59/933826759.db2.gz XYUSCVTYPLTOGO-UHFFFAOYSA-N 0 0 350.256 3.674 20 5 FHBDRN CCc1ccc(C(=O)Nc2ccc3c(c2)CCCN3C(C)=O)cc1[N+](=O)[O-] ZINC000471926990 933835897 /nfs/dbraw/zinc/83/58/97/933835897.db2.gz KGZRQDXOXZULQK-UHFFFAOYSA-N 0 0 367.405 3.709 20 5 FHBDRN COC(=O)c1cccc(NCc2ccc([N+](=O)[O-])cc2OC)c1Cl ZINC000431109910 933850726 /nfs/dbraw/zinc/85/07/26/933850726.db2.gz YAKYQVZZJIQASQ-UHFFFAOYSA-N 0 0 350.758 3.656 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)N[C@H]1COc2c1cccc2Cl ZINC000610709809 933876971 /nfs/dbraw/zinc/87/69/71/933876971.db2.gz WLVWGCHUYOXNBS-AWEZNQCLSA-N 0 0 361.785 3.523 20 5 FHBDRN CCNc1ccc(C(=O)N[C@@H]2COc3c2cccc3Cl)cc1[N+](=O)[O-] ZINC000610709812 933877015 /nfs/dbraw/zinc/87/70/15/933877015.db2.gz WPBGQLBUSOHMEN-CQSZACIVSA-N 0 0 361.785 3.544 20 5 FHBDRN COCCCOc1ccccc1NC(=O)c1cc(OC)c(C)c([N+](=O)[O-])c1 ZINC000276889004 933886604 /nfs/dbraw/zinc/88/66/04/933886604.db2.gz SLSIQSGTHDBTLH-UHFFFAOYSA-N 0 0 374.393 3.579 20 5 FHBDRN O=C(CSc1ccccc1[N+](=O)[O-])N[C@H]1COc2c1cccc2Cl ZINC000610714581 933891670 /nfs/dbraw/zinc/89/16/70/933891670.db2.gz PKFIIHCTDYPTGI-LBPRGKRZSA-N 0 0 364.810 3.590 20 5 FHBDRN COc1cccc([C@H](C)NC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000510892604 933968495 /nfs/dbraw/zinc/96/84/95/933968495.db2.gz JKQRXKSRNOHSDC-AWEZNQCLSA-N 0 0 357.410 3.549 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)NCCSc1ccccc1 ZINC000510898411 933994773 /nfs/dbraw/zinc/99/47/73/933994773.db2.gz MVUIFIPKUIJPCS-UHFFFAOYSA-N 0 0 359.451 3.571 20 5 FHBDRN COC1(CC(=O)Nc2cc(Br)cc([N+](=O)[O-])c2C)CCC1 ZINC000431174383 934006168 /nfs/dbraw/zinc/00/61/68/934006168.db2.gz BSXFYORFZBCJSR-UHFFFAOYSA-N 0 0 357.204 3.563 20 5 FHBDRN Cc1ncsc1C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000431183293 934046534 /nfs/dbraw/zinc/04/65/34/934046534.db2.gz PCLYWMCLURLJOQ-UHFFFAOYSA-N 0 0 356.201 3.683 20 5 FHBDRN O=C(c1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CC(CC(F)(F)F)C1 ZINC000610744630 934061333 /nfs/dbraw/zinc/06/13/33/934061333.db2.gz AKANEOHZNXBMQI-UHFFFAOYSA-N 0 0 356.222 3.638 20 5 FHBDRN Cc1c(NC(=O)[C@@H](C)C2CCOCC2)cc(Br)cc1[N+](=O)[O-] ZINC000431183792 934064212 /nfs/dbraw/zinc/06/42/12/934064212.db2.gz QUGIWUYAFIVFBN-VIFPVBQESA-N 0 0 371.231 3.667 20 5 FHBDRN O=[N+]([O-])c1cnn(C[C@@H](O)COc2ccc(-c3ccccc3)cc2Cl)c1 ZINC000131574745 934086833 /nfs/dbraw/zinc/08/68/33/934086833.db2.gz NAWDLNCXNBJEDS-MRXNPFEDSA-N 0 0 373.796 3.552 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])s1)N(Cc1ccccc1)C[C@H](O)c1ccco1 ZINC000176178214 934133945 /nfs/dbraw/zinc/13/39/45/934133945.db2.gz UKOQLZDJXLZWQE-AWEZNQCLSA-N 0 0 372.402 3.625 20 5 FHBDRN CC(C)c1ccc(C(=O)Nc2ccc(NC(=O)C3CC3)nc2)cc1[N+](=O)[O-] ZINC000187667258 934137585 /nfs/dbraw/zinc/13/75/85/934137585.db2.gz RKHLSCOTXKECJF-UHFFFAOYSA-N 0 0 368.393 3.714 20 5 FHBDRN O=C(Cc1cccc([N+](=O)[O-])c1)NC[C@H](c1ccccc1)C(F)(F)F ZINC000187669105 934138368 /nfs/dbraw/zinc/13/83/68/934138368.db2.gz ADDWLNSTEFFPSV-OAHLLOKOSA-N 0 0 352.312 3.600 20 5 FHBDRN O=C(Nc1nc2cc(C(F)(F)F)ccc2s1)c1ccc([N+](=O)[O-])cn1 ZINC000610774130 934156957 /nfs/dbraw/zinc/15/69/57/934156957.db2.gz NGDXQVGRWOFOOV-UHFFFAOYSA-N 0 0 368.296 3.871 20 5 FHBDRN O=C(N[C@H]1CCC(F)(F)C1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000610790873 934206568 /nfs/dbraw/zinc/20/65/68/934206568.db2.gz KSNFNMHBKLOXAJ-JTQLQIEISA-N 0 0 353.350 3.636 20 5 FHBDRN O=C(N[C@@H]1CCC(F)(F)C1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000610790874 934206587 /nfs/dbraw/zinc/20/65/87/934206587.db2.gz KSNFNMHBKLOXAJ-SNVBAGLBSA-N 0 0 353.350 3.636 20 5 FHBDRN CC1CCN(c2ccc(C(=O)N[C@H]3CCC(F)(F)C3)cc2[N+](=O)[O-])CC1 ZINC000610790452 934211743 /nfs/dbraw/zinc/21/17/43/934211743.db2.gz KSBCXVHMVPZTDW-AWEZNQCLSA-N 0 0 367.396 3.749 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)NC2(C)Cc3ccccc3C2)cc1[N+](=O)[O-] ZINC000510951861 934216453 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355.225 3.935 20 5 FHBDRN C[C@@H](NC(=O)c1cc2cc([N+](=O)[O-])ccc2o1)[C@@H]1COc2ccccc21 ZINC000535860817 934606765 /nfs/dbraw/zinc/60/67/65/934606765.db2.gz OVSJBUCURGGWLB-ABAIWWIYSA-N 0 0 352.346 3.636 20 5 FHBDRN CC(C)c1[nH]nc(C(=O)Nc2ccc(Cl)c3cccnc23)c1[N+](=O)[O-] ZINC000610917209 934624533 /nfs/dbraw/zinc/62/45/33/934624533.db2.gz DWAGZMIVMQZONJ-UHFFFAOYSA-N 0 0 359.773 3.895 20 5 FHBDRN COc1ccc(NCc2csc(-c3cccc([N+](=O)[O-])c3)n2)c(OC)n1 ZINC000610947144 934643832 /nfs/dbraw/zinc/64/38/32/934643832.db2.gz FSLZNEWXBFSRSS-UHFFFAOYSA-N 0 0 372.406 3.743 20 5 FHBDRN CC(C)CCSc1ccc(C(=O)N2CCCOC[C@@H]2C)cc1[N+](=O)[O-] ZINC000610948453 934644539 /nfs/dbraw/zinc/64/45/39/934644539.db2.gz FWFPKKUIKMXYNY-AWEZNQCLSA-N 0 0 366.483 3.984 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc3c(cnn3C(F)F)c2)c1 ZINC000610961583 934658826 /nfs/dbraw/zinc/65/88/26/934658826.db2.gz HHKSWEZLFJHWKI-UHFFFAOYSA-N 0 0 362.292 3.601 20 5 FHBDRN C[C@H](c1ccc([S@](C)=O)cc1)N(C)C(=O)Nc1cccc([N+](=O)[O-])c1 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350.256 3.742 20 5 FHBDRN CS(=O)(=O)c1ccc(Oc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1 ZINC000060847838 934732174 /nfs/dbraw/zinc/73/21/74/934732174.db2.gz CQLMIARNUOAFIH-UHFFFAOYSA-N 0 0 361.297 3.809 20 5 FHBDRN CCOc1cc(C(=O)NC2CCC(C(C)C)CC2)c([N+](=O)[O-])cc1OC ZINC000119441461 934745263 /nfs/dbraw/zinc/74/52/63/934745263.db2.gz ALKPKSKZUKFCOY-UHFFFAOYSA-N 0 0 364.442 3.947 20 5 FHBDRN CCOC(=O)c1cnc2ccccc2c1NCc1ccc([N+](=O)[O-])cc1 ZINC000065227965 934750602 /nfs/dbraw/zinc/75/06/02/934750602.db2.gz FFDBEWQPQBMENP-UHFFFAOYSA-N 0 0 351.362 3.932 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)ccc1OC[C@@H](O)COc1ccc(Cl)cc1 ZINC000535909766 934778718 /nfs/dbraw/zinc/77/87/18/934778718.db2.gz KPOKUSVAPCWEAD-LBPRGKRZSA-N 0 0 358.177 3.720 20 5 FHBDRN COC(=O)c1c(CC(C)C)csc1NC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000247815707 934786164 /nfs/dbraw/zinc/78/61/64/934786164.db2.gz FYXWKPMETQSSCI-UHFFFAOYSA-N 0 0 362.407 3.894 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N1C[C@@H](C(F)(F)F)CC[C@@H]1C ZINC000611555545 934802222 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3.692 20 5 FHBDRN O=[N+]([O-])c1ccc(OCCCOc2ccc3c(c2)OCO3)c(Cl)c1 ZINC000072041587 935239331 /nfs/dbraw/zinc/23/93/31/935239331.db2.gz OTPULKDKOOARKT-UHFFFAOYSA-N 0 0 351.742 3.825 20 5 FHBDRN O=C([O-])CC[C@H](Cc1ccccc1)[NH2+]C/C=C/c1ccccc1[N+](=O)[O-] ZINC000263525842 935239377 /nfs/dbraw/zinc/23/93/77/935239377.db2.gz UADXCIPGOXGCNP-WGLAMXGCSA-N 0 0 354.406 3.674 20 5 FHBDRN CSc1ccc(NC(=O)[C@@H](C)N(C)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000511072857 935239903 /nfs/dbraw/zinc/23/99/03/935239903.db2.gz MULHCDTYSWZUQZ-CQSZACIVSA-N 0 0 373.478 3.818 20 5 FHBDRN Cc1[nH]nc(C(=O)Nc2cccc(CO[C@@H]3CCC[C@@H](C)C3)c2)c1[N+](=O)[O-] ZINC000072061723 935263895 /nfs/dbraw/zinc/26/38/95/935263895.db2.gz XTPQFSVIHGTVCD-MLGOLLRUSA-N 0 0 372.425 3.974 20 5 FHBDRN Cc1ccc2nc(CNc3cc(Br)cc([N+](=O)[O-])c3)cn2c1 ZINC000551359984 935265048 /nfs/dbraw/zinc/26/50/48/935265048.db2.gz SKVSCIOKMFMQGM-UHFFFAOYSA-N 0 0 361.199 3.926 20 5 FHBDRN CC(C)(C)c1ccc(NCc2nnnn2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000551358765 935265099 /nfs/dbraw/zinc/26/50/99/935265099.db2.gz NEPJUEMLVAOWLN-UHFFFAOYSA-N 0 0 366.425 3.539 20 5 FHBDRN CCc1nc(C)c([C@H](C)N(C)C(=O)COc2cccc([N+](=O)[O-])c2)s1 ZINC000119830215 935267698 /nfs/dbraw/zinc/26/76/98/935267698.db2.gz QWBWIBQXUZELPJ-LBPRGKRZSA-N 0 0 363.439 3.521 20 5 FHBDRN O=C(Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1)c1csc(=O)[nH]1 ZINC000472166064 935269241 /nfs/dbraw/zinc/26/92/41/935269241.db2.gz SMGVSVZKLLFULM-UHFFFAOYSA-N 0 0 357.347 3.802 20 5 FHBDRN Cc1c(CC(=O)NCC2(O)CCC(C(C)(C)C)CC2)cccc1[N+](=O)[O-] ZINC000438832705 945093277 /nfs/dbraw/zinc/09/32/77/945093277.db2.gz MZUGXNQBXDELKO-UHFFFAOYSA-N 0 0 362.470 3.529 20 5 FHBDRN C[C@@H](OCCCNC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12)c1ccccc1 ZINC000119825114 935272561 /nfs/dbraw/zinc/27/25/61/935272561.db2.gz OOPJVNJAUJPOPA-CQSZACIVSA-N 0 0 367.405 3.974 20 5 FHBDRN CNc1ccc(C(=O)Nc2cc(-c3ccccc3C)[nH]n2)cc1[N+](=O)[O-] ZINC000051438061 935281783 /nfs/dbraw/zinc/28/17/83/935281783.db2.gz OEXLKYKQCWSUPL-UHFFFAOYSA-N 0 0 351.366 3.587 20 5 FHBDRN O=C(/C=C\c1cnc2ccccc2n1)Nc1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000255480386 935283560 /nfs/dbraw/zinc/28/35/60/935283560.db2.gz HXQFJRSDJNNFRG-POHAHGRESA-N 0 0 371.356 3.738 20 5 FHBDRN Cc1ccc(-c2cc(C(=O)N[C@H](C)c3cccc([N+](=O)[O-])c3)[nH]n2)cc1 ZINC000519066297 945090086 /nfs/dbraw/zinc/09/00/86/945090086.db2.gz CTBRYUXKVAMSBY-CYBMUJFWSA-N 0 0 350.378 3.784 20 5 FHBDRN C[C@H](CC(=O)NCCc1cccc([N+](=O)[O-])c1)C(=O)c1ccc(Cl)cc1 ZINC000539705949 935284509 /nfs/dbraw/zinc/28/45/09/935284509.db2.gz HUJOMCRRPWJGOP-CYBMUJFWSA-N 0 0 374.824 3.816 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)c1csc(-c2ccc3c(c2)OCO3)n1 ZINC000072080346 935286528 /nfs/dbraw/zinc/28/65/28/935286528.db2.gz LOLDHBNGMCDLMO-UHFFFAOYSA-N 0 0 369.358 3.699 20 5 FHBDRN Cc1cc(N(C)C(=O)Cn2c3ccccc3c(=O)c3ccccc32)ccn1 ZINC000543848408 935309925 /nfs/dbraw/zinc/30/99/25/935309925.db2.gz UYDJTYQPPITLMN-UHFFFAOYSA-N 0 0 357.413 3.521 20 5 FHBDRN O=C(c1ccccc1[N+](=O)[O-])N1CC[C@@](F)(c2cc(F)cc(F)c2)C1 ZINC000551697972 935330827 /nfs/dbraw/zinc/33/08/27/935330827.db2.gz HGRVIMDSKHGBRA-KRWDZBQOSA-N 0 0 350.296 3.584 20 5 FHBDRN C[C@@H]1[C@H](C(F)(F)F)CCN1C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000472183077 935337265 /nfs/dbraw/zinc/33/72/65/935337265.db2.gz PLXSJPPIHBJMGB-LDYMZIIASA-N 0 0 365.739 3.731 20 5 FHBDRN CSc1ccccc1NC(=O)CN(C)Cc1cccc([N+](=O)[O-])c1C ZINC000051472996 935337768 /nfs/dbraw/zinc/33/77/68/935337768.db2.gz ZSHLKRGIBNEIHA-UHFFFAOYSA-N 0 0 359.451 3.696 20 5 FHBDRN O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)NC[C@H]1CCCc2ccccc21 ZINC000582144098 935341783 /nfs/dbraw/zinc/34/17/83/935341783.db2.gz WNWQSAOYFDWSCE-CYBMUJFWSA-N 0 0 360.360 3.652 20 5 FHBDRN C[C@H]1CC[C@H](NC(=O)C(=O)Nc2ccc(C(C)(C)C)c([N+](=O)[O-])c2)CC1 ZINC000551768221 935346190 /nfs/dbraw/zinc/34/61/90/935346190.db2.gz OBSYIRXRLSXMBM-JOCQHMNTSA-N 0 0 361.442 3.526 20 5 FHBDRN COc1cc(C)c(CN(C)C(=O)/C=C\c2ccc([N+](=O)[O-])cc2)cc1OC ZINC000255494591 935354824 /nfs/dbraw/zinc/35/48/24/935354824.db2.gz SYHYXVJHTSZOMU-YFHOEESVSA-N 0 0 370.405 3.592 20 5 FHBDRN C[C@@H](O)C[C@H](CNC(=O)C(C)(C)c1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000551829965 935357491 /nfs/dbraw/zinc/35/74/91/935357491.db2.gz ZBVVYDHCHFQXTN-NVXWUHKLSA-N 0 0 370.449 3.543 20 5 FHBDRN Cc1nc2ccccc2c(S[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)n1 ZINC000072205073 935361760 /nfs/dbraw/zinc/36/17/60/935361760.db2.gz NPVZYDFWYDQGFW-NSHDSACASA-N 0 0 368.418 3.966 20 5 FHBDRN CCO[C@H]1C[C@H](N(C)C(=O)c2ccc([N+](=O)[O-])c(Cl)c2)C12CCC2 ZINC000161169883 935362828 /nfs/dbraw/zinc/36/28/28/935362828.db2.gz BGIDLRJREZFLFS-GJZGRUSLSA-N 0 0 352.818 3.668 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(Cl)cc1S(=O)(=O)NC(C)(C)CC(F)(F)F ZINC001211540940 935370073 /nfs/dbraw/zinc/37/00/73/935370073.db2.gz JJBXBIZAJSIGGV-UHFFFAOYSA-N 0 0 374.768 3.566 20 5 FHBDRN Cc1nc(CCOC(=O)c2c([N+](=O)[O-])cccc2C(F)(F)F)cs1 ZINC000755101012 935374850 /nfs/dbraw/zinc/37/48/50/935374850.db2.gz BNNYKOBPKVMWCW-UHFFFAOYSA-N 0 0 360.313 3.778 20 5 FHBDRN COC(C)(C)c1noc(-c2ccc(N3CCC[C@H](C)C3)c([N+](=O)[O-])c2)n1 ZINC000085236679 935377490 /nfs/dbraw/zinc/37/74/90/935377490.db2.gz NVGLJDKETQPJQU-LBPRGKRZSA-N 0 0 360.414 3.763 20 5 FHBDRN O=C(NCCCCOCCc1ccccc1)Nc1cccc([N+](=O)[O-])c1 ZINC000047322974 945099528 /nfs/dbraw/zinc/09/95/28/945099528.db2.gz XLSPUGTUDKAFSZ-UHFFFAOYSA-N 0 0 357.410 3.756 20 5 FHBDRN O=C(NCc1cccc([N+](=O)[O-])c1)N[C@H](c1cc(F)ccc1F)C(F)F ZINC000582218868 935420444 /nfs/dbraw/zinc/42/04/44/935420444.db2.gz QORBLKVRQOHLIB-CQSZACIVSA-N 0 0 371.290 3.679 20 5 FHBDRN Cc1ccc(CNC(=O)Nc2cccc([N+](=O)[O-])c2C)c(N2CCCC2)n1 ZINC000611582749 935453525 /nfs/dbraw/zinc/45/35/25/935453525.db2.gz XYAFPUHVZDPSML-UHFFFAOYSA-N 0 0 369.425 3.529 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)C(=O)OC(C)(C)C ZINC000540455402 935458797 /nfs/dbraw/zinc/45/87/97/935458797.db2.gz GVMQXFQCDXDVJW-LLVKDONJSA-N 0 0 368.455 3.555 20 5 FHBDRN O=[N+]([O-])c1cccc(Cl)c1CN1CC[C@H](n2cnc3c2CCCC3)C1 ZINC000432113158 945102466 /nfs/dbraw/zinc/10/24/66/945102466.db2.gz FTFUZLLFSHEHBL-ZDUSSCGKSA-N 0 0 360.845 3.771 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(Cc2noc(-c3oc(CC(C)C)nc3C)n2)c1 ZINC000582267247 935468566 /nfs/dbraw/zinc/46/85/66/935468566.db2.gz JHHZYQNTBQZKPG-UHFFFAOYSA-N 0 0 372.381 3.739 20 5 FHBDRN C/C(=C\C(=O)N1CCO[C@H](c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000785123709 935486615 /nfs/dbraw/zinc/48/66/15/935486615.db2.gz IUPLIASTJLSUJK-LLLGYDHXSA-N 0 0 352.390 3.598 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(C(=O)N2CCC(C(=O)c3ccccc3)CC2)c1F ZINC000277538646 935504011 /nfs/dbraw/zinc/50/40/11/935504011.db2.gz VGEAGDQFFCSZLT-UHFFFAOYSA-N 0 0 370.380 3.777 20 5 FHBDRN Cc1c(CC(=O)NCc2ccc(C(F)(F)F)cc2)cccc1[N+](=O)[O-] ZINC000178562332 935505310 /nfs/dbraw/zinc/50/53/10/935505310.db2.gz MHBUGUQFAXQZNK-UHFFFAOYSA-N 0 0 352.312 3.781 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H](OCC)c1ccccc1 ZINC000439932596 945105341 /nfs/dbraw/zinc/10/53/41/945105341.db2.gz ONIAKKKGXPZDPH-SFHVURJKSA-N 0 0 373.409 3.893 20 5 FHBDRN O=[N+]([O-])c1ccsc1NC[C@H](O)COc1cccc(C(F)(F)F)c1 ZINC000611412255 935544937 /nfs/dbraw/zinc/54/49/37/935544937.db2.gz HVTFIMFNXSMERZ-JTQLQIEISA-N 0 0 362.329 3.527 20 5 FHBDRN COc1cc(OC)c(NC(=O)c2ccc([N+](=O)[O-])cc2OC)cc1Cl ZINC000427123444 945108492 /nfs/dbraw/zinc/10/84/92/945108492.db2.gz JQPDRYUKNTVCID-UHFFFAOYSA-N 0 0 366.757 3.526 20 5 FHBDRN Cc1cc(OCC(=O)N2CCc3cc([N+](=O)[O-])ccc32)ccc1C(C)C ZINC000478111364 935573885 /nfs/dbraw/zinc/57/38/85/935573885.db2.gz NCOYUCJMPLZQNE-UHFFFAOYSA-N 0 0 354.406 3.995 20 5 FHBDRN CC(C)Oc1ccc([C@H](C)NC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)cc1 ZINC000516667449 945109990 /nfs/dbraw/zinc/10/99/90/945109990.db2.gz PULPLQXNEJGLGP-LBPRGKRZSA-N 0 0 372.377 3.602 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@@H](CC(F)(F)F)C1 ZINC000277565662 935589891 /nfs/dbraw/zinc/58/98/91/935589891.db2.gz ZGTWLDIRDJRADJ-MNOVXSKESA-N 0 0 362.373 3.876 20 5 FHBDRN C[C@@H](NCc1ccc([N+](=O)[O-])cc1F)c1nc(-c2cccc(F)c2)no1 ZINC000478271540 935595005 /nfs/dbraw/zinc/59/50/05/935595005.db2.gz DSDGRJFICQJYFH-SNVBAGLBSA-N 0 0 360.320 3.774 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N1CCO[C@H](c2ccc(Cl)cc2)C1 ZINC000511784909 945111358 /nfs/dbraw/zinc/11/13/58/945111358.db2.gz MMKWJOZBVCKRIG-KRWDZBQOSA-N 0 0 360.797 3.770 20 5 FHBDRN CCN(CC1CCC1)C(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000478289479 935608020 /nfs/dbraw/zinc/60/80/20/935608020.db2.gz LWSULPSFDIUOCI-UHFFFAOYSA-N 0 0 355.232 3.928 20 5 FHBDRN CCN(CC1CCC1)C(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000478327072 935610658 /nfs/dbraw/zinc/61/06/58/935610658.db2.gz NNWFVDBYJMFCKE-UHFFFAOYSA-N 0 0 360.332 3.798 20 5 FHBDRN CS(=O)(=O)c1cccc(Oc2ccc([N+](=O)[O-])cc2Br)c1 ZINC000478329289 935611316 /nfs/dbraw/zinc/61/13/16/935611316.db2.gz UMRXWCMBDQGAKZ-UHFFFAOYSA-N 0 0 372.196 3.553 20 5 FHBDRN Cc1cc(OCC(=O)NC[C@@H](C)Sc2ccccc2)ccc1[N+](=O)[O-] ZINC000432116623 945112171 /nfs/dbraw/zinc/11/21/71/945112171.db2.gz QDVYTKNQQLDSID-CQSZACIVSA-N 0 0 360.435 3.579 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(C)[C@H](C)c1ccc(F)c(F)c1 ZINC000023440148 935615811 /nfs/dbraw/zinc/61/58/11/935615811.db2.gz IXTPROOROWSWPX-LLVKDONJSA-N 0 0 370.377 3.563 20 5 FHBDRN Cc1c([C@@H](C)NCc2cccc([N+](=O)[O-])c2C)nnn1-c1ccc(C)cc1 ZINC000478510863 935639023 /nfs/dbraw/zinc/63/90/23/935639023.db2.gz ZSVVSDSQBYBWEK-OAHLLOKOSA-N 0 0 365.437 3.952 20 5 FHBDRN CCCOc1ccc(C(C)(C)NC(=O)COc2ccc([N+](=O)[O-])cc2)cc1 ZINC000478526192 935641891 /nfs/dbraw/zinc/64/18/91/935641891.db2.gz AWWFTZYOHFKNEP-UHFFFAOYSA-N 0 0 372.421 3.814 20 5 FHBDRN COc1cc(F)c([N+](=O)[O-])c(NC[C@]2(O)CCC[C@H](C(F)(F)F)C2)c1 ZINC000302549992 935647217 /nfs/dbraw/zinc/64/72/17/935647217.db2.gz PYFGDCBCNHWPOY-XPTSAGLGSA-N 0 0 366.311 3.638 20 5 FHBDRN CCOc1cc(CCCNC(=O)c2cc([N+](=O)[O-])ccc2C)ccc1OC ZINC000127613818 935661742 /nfs/dbraw/zinc/66/17/42/935661742.db2.gz VUCGUEHEGVWWBF-UHFFFAOYSA-N 0 0 372.421 3.673 20 5 FHBDRN CCCCn1ccnc1-c1cccc(NC(=O)c2n[nH]c(C)c2[N+](=O)[O-])c1 ZINC000478637965 935668889 /nfs/dbraw/zinc/66/88/89/935668889.db2.gz UYGYOJFVEVQTPG-UHFFFAOYSA-N 0 0 368.397 3.542 20 5 FHBDRN CC(C)C[N@@H+]1Cc2cccc(NC(=O)c3cc([O-])cc([N+](=O)[O-])c3)c2C1 ZINC000507298553 945116139 /nfs/dbraw/zinc/11/61/39/945116139.db2.gz FBBQLGFFQULZNV-UHFFFAOYSA-N 0 0 355.394 3.524 20 5 FHBDRN COc1cc(NS(=O)(=O)c2cc([N+](=O)[O-])cc(C)c2C)c(C)cc1C ZINC000478679993 935674630 /nfs/dbraw/zinc/67/46/30/935674630.db2.gz FNGHBMOENOPLRC-UHFFFAOYSA-N 0 0 364.423 3.638 20 5 FHBDRN CCOc1cc(OCc2cccc(C(=O)NCC(C)C)c2)ccc1[N+](=O)[O-] ZINC000478729550 935687969 /nfs/dbraw/zinc/68/79/69/935687969.db2.gz AGIHQOYBJUXNGJ-UHFFFAOYSA-N 0 0 372.421 3.958 20 5 FHBDRN CCOc1cc(OCC(=O)Nc2cccc(Cl)c2)ccc1[N+](=O)[O-] ZINC000478731507 935687996 /nfs/dbraw/zinc/68/79/96/935687996.db2.gz HYBDJDMIJXQGTR-UHFFFAOYSA-N 0 0 350.758 3.664 20 5 FHBDRN O=C(N[C@H](CCc1ccccc1)C(F)(F)F)c1csc([N+](=O)[O-])c1 ZINC000478719007 935693142 /nfs/dbraw/zinc/69/31/42/935693142.db2.gz ISLSHFFGZQPOPW-GFCCVEGCSA-N 0 0 358.341 3.950 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CSCc1ccc2c(c1)OCO2 ZINC000478760674 935708599 /nfs/dbraw/zinc/70/85/99/935708599.db2.gz KHCQTAFDSHXAAG-UHFFFAOYSA-N 0 0 360.391 3.504 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@H]2COc3c2ccc(C)c3C)c1 ZINC000478777589 935716632 /nfs/dbraw/zinc/71/66/32/935716632.db2.gz YSFKVVYQQAGNHZ-INIZCTEOSA-N 0 0 370.405 3.539 20 5 FHBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)N(C)C[C@@H]1CCCO1 ZINC000478779861 935717455 /nfs/dbraw/zinc/71/74/55/935717455.db2.gz CWZYGRRNDDNSCY-AWEZNQCLSA-N 0 0 352.456 3.738 20 5 FHBDRN CC(C)[C@@H]1C[C@H](NC(=O)c2c([N+](=O)[O-])cccc2C(F)(F)F)CCO1 ZINC000582447919 935720307 /nfs/dbraw/zinc/72/03/07/935720307.db2.gz JSPZTXQWRFIHEC-MFKMUULPSA-N 0 0 360.332 3.547 20 5 FHBDRN CCO[C@@H]1C[C@@H](N(C)C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)C12CCC2 ZINC000478865649 935746263 /nfs/dbraw/zinc/74/62/63/935746263.db2.gz MWFULIKLLNJLRX-QZTJIDSGSA-N 0 0 373.453 3.589 20 5 FHBDRN Cc1cc(OCC(=O)N2CCC[C@H]3CCCC[C@H]32)c(F)cc1[N+](=O)[O-] ZINC000478909124 935753717 /nfs/dbraw/zinc/75/37/17/935753717.db2.gz LJMOJXORBBMBCH-UKRRQHHQSA-N 0 0 350.390 3.602 20 5 FHBDRN Cc1cccc(NC(=O)[C@H](C)N(C)CCc2ccccc2[N+](=O)[O-])c1C ZINC000511134821 935760301 /nfs/dbraw/zinc/76/03/01/935760301.db2.gz CEUXMUQNVOSUNX-INIZCTEOSA-N 0 0 355.438 3.713 20 5 FHBDRN C[C@H](Nc1ncc(Br)cc1[N+](=O)[O-])c1ccc(Cl)cn1 ZINC000431422279 935763333 /nfs/dbraw/zinc/76/33/33/935763333.db2.gz MVKYLVLNPOEOGZ-ZETCQYMHSA-N 0 0 357.595 3.974 20 5 FHBDRN CN(CC(=O)Nc1cccc2ccc(O)cc21)c1ccccc1[N+](=O)[O-] ZINC000127733567 935765435 /nfs/dbraw/zinc/76/54/35/935765435.db2.gz IYMAXUWJLQNYPD-UHFFFAOYSA-N 0 0 351.362 3.529 20 5 FHBDRN CN(C(=O)COc1cccc(C(F)(F)F)c1)c1cccc([N+](=O)[O-])c1 ZINC000158394134 935768073 /nfs/dbraw/zinc/76/80/73/935768073.db2.gz BCBQDQOZFCCEPW-UHFFFAOYSA-N 0 0 354.284 3.655 20 5 FHBDRN C[C@H](NC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1)c1ccccc1Cl ZINC000479011709 935769034 /nfs/dbraw/zinc/76/90/34/935769034.db2.gz APJVFOCHRRTYFI-LBPRGKRZSA-N 0 0 370.796 3.925 20 5 FHBDRN CCc1ccccc1NC(=O)[C@H](C)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000511137077 935770908 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FHBDRN COc1ccc(NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000050256200 935821370 /nfs/dbraw/zinc/82/13/70/935821370.db2.gz UEEZJCCSTOJVCJ-UHFFFAOYSA-N 0 0 355.375 3.979 20 5 FHBDRN CC(C)c1ccc(CCNC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)cc1 ZINC000018010881 945126548 /nfs/dbraw/zinc/12/65/48/945126548.db2.gz JJNXPVWJYTUWJO-UHFFFAOYSA-N 0 0 357.366 3.599 20 5 FHBDRN CN(C(=O)c1cnn(-c2ccccc2)c1C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000158493482 935825131 /nfs/dbraw/zinc/82/51/31/935825131.db2.gz SLQFYRYATNQPHT-UHFFFAOYSA-N 0 0 362.389 3.935 20 5 FHBDRN CCN(c1ccc2[nH]ccc2c1)S(=O)(=O)c1cc(C)c([N+](=O)[O-])cc1C ZINC001211548869 935827163 /nfs/dbraw/zinc/82/71/63/935827163.db2.gz JNQYQXLWBXYUJD-UHFFFAOYSA-N 0 0 373.434 3.908 20 5 FHBDRN O=C(C1CCCC1)N1CCCC[C@@H]1c1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000375715758 935830160 /nfs/dbraw/zinc/83/01/60/935830160.db2.gz ZEPLRKQALWWVIB-MRXNPFEDSA-N 0 0 370.409 3.889 20 5 FHBDRN CCn1nc(C(C)C)cc1C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000479381716 935835660 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FHBDRN C[C@H](NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)c1cccnc1 ZINC000050552768 935888671 /nfs/dbraw/zinc/88/86/71/935888671.db2.gz LYEAFCGGNSJSNX-NSHDSACASA-N 0 0 354.391 3.604 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(NC2CCN(c3nc4ccccc4s3)CC2)n1 ZINC000479779545 935889711 /nfs/dbraw/zinc/88/97/11/935889711.db2.gz RNAQRLDLOLLISQ-UHFFFAOYSA-N 0 0 369.450 3.989 20 5 FHBDRN C[C@H](c1nc(-c2ccccc2-n2cccn2)no1)c1cccc([N+](=O)[O-])c1 ZINC000582630713 935893714 /nfs/dbraw/zinc/89/37/14/935893714.db2.gz DFHQGUTUTLJADO-ZDUSSCGKSA-N 0 0 361.361 3.982 20 5 FHBDRN CC(C)NC(=O)c1ccc(N(C)CCc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000065586557 935895550 /nfs/dbraw/zinc/89/55/50/935895550.db2.gz CPQGSVNPEQHFHI-UHFFFAOYSA-N 0 0 359.401 3.551 20 5 FHBDRN Cc1noc(C)c1CN(C)C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000050574105 935896247 /nfs/dbraw/zinc/89/62/47/935896247.db2.gz WTQLXAJKNPZDAH-UHFFFAOYSA-N 0 0 372.406 3.595 20 5 FHBDRN O=[N+]([O-])c1ccnn1Cc1csc(-c2ccc(Br)cc2)n1 ZINC000128026940 935898060 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O=[N+]([O-])c1ccc2ncnc(NCCNc3cccc4ccccc43)c2c1 ZINC000611699626 935937524 /nfs/dbraw/zinc/93/75/24/935937524.db2.gz FTACIYJIWZLDBC-UHFFFAOYSA-N 0 0 359.389 3.637 20 5 FHBDRN COc1ccc(Cl)cc1CN(C)c1ncnc2ccc([N+](=O)[O-])cc21 ZINC000611700290 935939672 /nfs/dbraw/zinc/93/96/72/935939672.db2.gz NZLMRQGZZRMXFR-UHFFFAOYSA-N 0 0 358.785 3.836 20 5 FHBDRN CCOc1cc(C(=O)NC2CCC(C)(C)CC2)c([N+](=O)[O-])cc1OC ZINC000128081398 935940251 /nfs/dbraw/zinc/94/02/51/935940251.db2.gz LKNIMMXTWVPXDC-UHFFFAOYSA-N 0 0 350.415 3.701 20 5 FHBDRN O=[N+]([O-])c1ccc2ncnc(N[C@H]3CCCN(c4cccc(F)c4)C3)c2c1 ZINC000611706525 935944674 /nfs/dbraw/zinc/94/46/74/935944674.db2.gz JZODKXMAPAAHKV-AWEZNQCLSA-N 0 0 367.384 3.758 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(Cl)c1NCc1cccc(CS(C)(=O)=O)c1 ZINC000277791432 935949411 /nfs/dbraw/zinc/94/94/11/935949411.db2.gz NHOJTKQLANQXHJ-UHFFFAOYSA-N 0 0 368.842 3.713 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N2CCCc3ccc(F)cc32)cc1OC ZINC000047370484 945135592 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356.357 3.888 20 5 FHBDRN Cc1c(CNc2ncnc3ccc([N+](=O)[O-])cc32)oc2ccc(F)cc12 ZINC000611710039 935963849 /nfs/dbraw/zinc/96/38/49/935963849.db2.gz PPUXYTVDHNLGLW-UHFFFAOYSA-N 0 0 352.325 3.766 20 5 FHBDRN O=[N+]([O-])c1ccc2ncnc(N[C@H]3CCN(c4c(F)cccc4F)C3)c2c1 ZINC000611709879 935965285 /nfs/dbraw/zinc/96/52/85/935965285.db2.gz UTARSUCJYMOWOI-NSHDSACASA-N 0 0 371.347 3.507 20 5 FHBDRN CCN(CCOC)c1cccc(COc2ccc([N+](=O)[O-])cc2Cl)n1 ZINC000582718520 935978987 /nfs/dbraw/zinc/97/89/87/935978987.db2.gz OYRXXGSDOBEIBA-UHFFFAOYSA-N 0 0 365.817 3.695 20 5 FHBDRN CCOC(=O)c1ccnc(NCC2(Sc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000582718478 935980251 /nfs/dbraw/zinc/98/02/51/935980251.db2.gz NAJNKDIXYHMQDW-UHFFFAOYSA-N 0 0 373.434 3.903 20 5 FHBDRN CSc1cccc(N(C)C(=O)c2ccc3c(c2[N+](=O)[O-])OCCCO3)c1 ZINC001125620981 935980518 /nfs/dbraw/zinc/98/05/18/935980518.db2.gz GCQVVKVNKZVKCI-UHFFFAOYSA-N 0 0 374.418 3.755 20 5 FHBDRN COc1ccc(C(=O)N[C@H]2CCCO[C@@H]2c2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000074521993 935985096 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3.815 20 5 FHBDRN Cc1c(NC(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)cnn1C1CCCC1 ZINC000278556126 938531065 /nfs/dbraw/zinc/53/10/65/938531065.db2.gz IVGZKOKYBFSIQM-UHFFFAOYSA-N 0 0 364.352 3.945 20 5 FHBDRN CC(C)(C)c1ccc(NC(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)c(O)c1 ZINC000548816654 938531552 /nfs/dbraw/zinc/53/15/52/938531552.db2.gz DECYSKZWPGYSCH-UHFFFAOYSA-N 0 0 372.377 3.621 20 5 FHBDRN Cc1ncc([N+](=O)[O-])c(OCC(=O)N(C)[C@H]2CCCc3ccccc32)c1C ZINC000584005563 938532210 /nfs/dbraw/zinc/53/22/10/938532210.db2.gz XXKFZTRFIIJJCC-KRWDZBQOSA-N 0 0 369.421 3.521 20 5 FHBDRN CC(C)NC(=O)c1ccc(N[C@@H]2CCCC[C@H]2n2cccn2)c([N+](=O)[O-])c1 ZINC000080606570 938540922 /nfs/dbraw/zinc/54/09/22/938540922.db2.gz HEVPXHNIQIONFC-NVXWUHKLSA-N 0 0 371.441 3.525 20 5 FHBDRN CC(=O)c1ccc([N+](=O)[O-])cc1N1CCO[C@H](CCc2ccccc2)C1 ZINC000584015372 938546653 /nfs/dbraw/zinc/54/66/53/938546653.db2.gz DECXNTJTDUXBIV-GOSISDBHSA-N 0 0 354.406 3.635 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N[C@@H]1C[C@H]1c1ccc2ccccc2c1 ZINC000437276084 945185302 /nfs/dbraw/zinc/18/53/02/945185302.db2.gz SGBRBNZIAVEKLY-VQTJNVASSA-N 0 0 362.385 3.799 20 5 FHBDRN CCc1ccc([C@H]2CCN(C(=O)c3cc4c(c([N+](=O)[O-])c3)OCO4)C2)cc1 ZINC000584045099 938569302 /nfs/dbraw/zinc/56/93/02/938569302.db2.gz SGXJIJUPFCTVEV-HNNXBMFYSA-N 0 0 368.389 3.516 20 5 FHBDRN Cn1ccnc1Sc1cc(C(F)(F)C(F)(F)F)ncc1[N+](=O)[O-] ZINC000278595097 938569627 /nfs/dbraw/zinc/56/96/27/938569627.db2.gz ZFGJCEDLGXQJPO-UHFFFAOYSA-N 0 0 354.260 3.529 20 5 FHBDRN CCS(=O)(=O)c1ccc(CNc2c(Cl)cccc2[N+](=O)[O-])cc1 ZINC000432143453 945186730 /nfs/dbraw/zinc/18/67/30/945186730.db2.gz NWGDSGKOCSFFFG-UHFFFAOYSA-N 0 0 354.815 3.654 20 5 FHBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)N1CCC[C@@H]1Cc1ccc(F)cc1 ZINC000536207024 938580911 /nfs/dbraw/zinc/58/09/11/938580911.db2.gz HHOIRWNLZWTWGJ-GOSISDBHSA-N 0 0 371.412 3.693 20 5 FHBDRN CC(=O)c1ccc(N2CCC(Oc3ccncc3C)CC2)c([N+](=O)[O-])c1 ZINC000278607791 938580924 /nfs/dbraw/zinc/58/09/24/938580924.db2.gz ZXVYIEUGXBSIIJ-UHFFFAOYSA-N 0 0 355.394 3.549 20 5 FHBDRN C[C@H](C(=O)N[C@H](c1nccs1)C(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000584072282 938584430 /nfs/dbraw/zinc/58/44/30/938584430.db2.gz FPZGGZFVOMSLOW-GZMMTYOYSA-N 0 0 359.329 3.575 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H](C)c1ccccc1OC(F)F ZINC000427197250 945187758 /nfs/dbraw/zinc/18/77/58/945187758.db2.gz KANRGSMWPOOWEL-SNVBAGLBSA-N 0 0 366.320 3.696 20 5 FHBDRN CN(C)[C@@H](c1nc(Cc2ccccc2[N+](=O)[O-])no1)c1cccc(Cl)c1 ZINC000584078753 938585707 /nfs/dbraw/zinc/58/57/07/938585707.db2.gz WUXCSDNCZZPFDD-QGZVFWFLSA-N 0 0 372.812 3.873 20 5 FHBDRN Cc1nc([N+](=O)[O-])c(-c2noc(-c3csc4cc(C)ccc34)n2)n1C ZINC000584079563 938585910 /nfs/dbraw/zinc/58/59/10/938585910.db2.gz NSYBIKRWFMFRTH-UHFFFAOYSA-N 0 0 355.379 3.877 20 5 FHBDRN CC[C@@H](C)[C@H](NC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1)C(F)(F)F ZINC000584092855 938594768 /nfs/dbraw/zinc/59/47/68/938594768.db2.gz MMCUIQCWDMNQRJ-YGRLFVJLSA-N 0 0 359.348 3.640 20 5 FHBDRN COC(=O)C(C)(C)[C@H]1CCCN(c2ccc([N+](=O)[O-])c3cnccc32)C1 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COc1ccc(NC(=O)N2CC(Cc3ccccc3C)C2)cc1[N+](=O)[O-] ZINC000611827017 938702418 /nfs/dbraw/zinc/70/24/18/938702418.db2.gz MNPBOQPRWKFBHH-UHFFFAOYSA-N 0 0 355.394 3.618 20 5 FHBDRN Cc1ccccc1CN(C)C(=O)COc1cc(C)c([N+](=O)[O-])cc1Cl ZINC000506424854 945197281 /nfs/dbraw/zinc/19/72/81/945197281.db2.gz YJLDQMXBKVYVSK-UHFFFAOYSA-N 0 0 362.813 3.902 20 5 FHBDRN O=C(CCSc1ncnc2sccc21)Nc1ccccc1[N+](=O)[O-] ZINC000548825484 938714111 /nfs/dbraw/zinc/71/41/11/938714111.db2.gz UFQUWISYHSZXDR-UHFFFAOYSA-N 0 0 360.420 3.720 20 5 FHBDRN O=C(Cc1ccccc1)N1CC[C@@H](Nc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000432145919 945199788 /nfs/dbraw/zinc/19/97/88/945199788.db2.gz XTJIJQGXYNVFHM-CQSZACIVSA-N 0 0 359.813 3.504 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1Nc1cnn(CC(F)(F)F)c1 ZINC000118383993 938802943 /nfs/dbraw/zinc/80/29/43/938802943.db2.gz VGWADZQQWMEZEP-UHFFFAOYSA-N 0 0 365.109 3.860 20 5 FHBDRN Cc1c(NC(=O)N2CC(Cc3ccc(F)c(F)c3)C2)cccc1[N+](=O)[O-] ZINC000084294626 938827559 /nfs/dbraw/zinc/82/75/59/938827559.db2.gz KTERRCBNTCTIIW-UHFFFAOYSA-N 0 0 361.348 3.888 20 5 FHBDRN CN(Cc1c(F)cccc1Cl)C(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000086995495 938840694 /nfs/dbraw/zinc/84/06/94/938840694.db2.gz PRNMMYWEUZBFBI-UHFFFAOYSA-N 0 0 350.777 3.979 20 5 FHBDRN COc1cc(OC)c(NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)cc1F ZINC000087401001 938846014 /nfs/dbraw/zinc/84/60/14/938846014.db2.gz WSEMSIZEAOZTPD-UHFFFAOYSA-N 0 0 362.357 3.667 20 5 FHBDRN CC(C)Cc1ccc(C(=O)N2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1 ZINC000135543099 938849968 /nfs/dbraw/zinc/84/99/68/938849968.db2.gz ZFTMSGIKTYEHOE-QGZVFWFLSA-N 0 0 368.437 3.515 20 5 FHBDRN CCOc1cc(NC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)ccc1C ZINC000088379637 938854625 /nfs/dbraw/zinc/85/46/25/938854625.db2.gz UDAHENYEGDOQHF-UHFFFAOYSA-N 0 0 355.394 3.892 20 5 FHBDRN COC1(CNC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)CCCCC1 ZINC000480340757 938869480 /nfs/dbraw/zinc/86/94/80/938869480.db2.gz WFYSHORKXZXMHR-UHFFFAOYSA-N 0 0 373.356 3.667 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CC[C@]3(O)CCCC[C@@H]3C2)nc1-c1ccccc1 ZINC000090112823 938876730 /nfs/dbraw/zinc/87/67/30/938876730.db2.gz KBLWHNRPVDUIIZ-OXQOHEQNSA-N 0 0 353.422 3.788 20 5 FHBDRN COc1c(C(=O)N[C@@H]2C[C@H]2c2c(F)cccc2Cl)cccc1[N+](=O)[O-] ZINC000437280197 945211838 /nfs/dbraw/zinc/21/18/38/945211838.db2.gz GGVGXQHKOVQREN-ZWNOBZJWSA-N 0 0 364.760 3.682 20 5 FHBDRN Cc1ccc(C[C@@H](C)NC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)c(C)c1 ZINC000518211166 945212233 /nfs/dbraw/zinc/21/22/33/945212233.db2.gz IEXGTDROXPHQLL-MRXNPFEDSA-N 0 0 365.433 3.914 20 5 FHBDRN O=[N+]([O-])c1ccccc1-c1ccc(CNc2ccc(C(F)(F)F)nn2)o1 ZINC000584442711 938885026 /nfs/dbraw/zinc/88/50/26/938885026.db2.gz DJQVRNICYLQXFC-UHFFFAOYSA-N 0 0 364.283 3.698 20 5 FHBDRN C[C@H](CSc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])c1ccccc1 ZINC000480369825 938897355 /nfs/dbraw/zinc/89/73/55/938897355.db2.gz IXWGHCASTUXPGO-GFCCVEGCSA-N 0 0 351.449 3.894 20 5 FHBDRN Cc1cc(OCc2nnc(-c3ccccc3)n2C)c(Cl)cc1[N+](=O)[O-] ZINC000506434931 945214831 /nfs/dbraw/zinc/21/48/31/945214831.db2.gz YCUUBNNNYHYYBM-UHFFFAOYSA-N 0 0 358.785 3.931 20 5 FHBDRN Cc1ccc(S(=O)(=O)Nc2c(F)cccc2NC(C)C)cc1[N+](=O)[O-] ZINC000158869925 938917775 /nfs/dbraw/zinc/91/77/75/938917775.db2.gz NWBLEAWCEIIHAK-UHFFFAOYSA-N 0 0 367.402 3.663 20 5 FHBDRN O=C(c1cc(F)c([N+](=O)[O-])cc1F)N1CCc2ccc(Cl)cc2C1 ZINC000124272892 945216003 /nfs/dbraw/zinc/21/60/03/945216003.db2.gz LPFZQIIFPCRUMV-UHFFFAOYSA-N 0 0 352.724 3.725 20 5 FHBDRN CC(C)(C)OC(=O)N1CCCN(c2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000104957810 938936530 /nfs/dbraw/zinc/93/65/30/938936530.db2.gz OKDBQLMWBXIZLV-UHFFFAOYSA-N 0 0 355.822 3.695 20 5 FHBDRN COc1cc(C)c([C@@H](C)NC(=O)Nc2ccc([N+](=O)[O-])cc2)cc1OC ZINC000128223481 938936764 /nfs/dbraw/zinc/93/67/64/938936764.db2.gz DFVFIGYLLRQCPN-GFCCVEGCSA-N 0 0 359.382 3.803 20 5 FHBDRN CCC[C@@H](C)NC(=O)[C@H]1CCCN(c2ccc3ncccc3c2[N+](=O)[O-])C1 ZINC000050933878 938954831 /nfs/dbraw/zinc/95/48/31/938954831.db2.gz GMPQATPZDBTXAX-CABCVRRESA-N 0 0 370.453 3.664 20 5 FHBDRN CCc1ccc(O)c(NC(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000536218671 938956203 /nfs/dbraw/zinc/95/62/03/938956203.db2.gz CRGLJPWKGODZQG-SNVBAGLBSA-N 0 0 364.785 3.922 20 5 FHBDRN O=C(c1ccccc1)c1ccc(NCCc2nccs2)c([N+](=O)[O-])c1 ZINC000050953892 938965083 /nfs/dbraw/zinc/96/50/83/938965083.db2.gz AZWOBUVRHWEQTN-UHFFFAOYSA-N 0 0 353.403 3.937 20 5 FHBDRN Cc1ccnc(Oc2ccc(I)cc2)c1[N+](=O)[O-] ZINC000070495743 938965564 /nfs/dbraw/zinc/96/55/64/938965564.db2.gz RGWHLQJKSYRPOG-UHFFFAOYSA-N 0 0 356.119 3.695 20 5 FHBDRN O=[N+]([O-])c1cc(CN(Cc2cccc(F)c2)C[C@H]2CCCO2)cs1 ZINC000050963538 938965809 /nfs/dbraw/zinc/96/58/09/938965809.db2.gz GWNFNXPUGZXKNX-MRXNPFEDSA-N 0 0 350.415 3.977 20 5 FHBDRN COc1ccc(NC(=O)CNc2cccc(C(F)(F)F)c2)cc1[N+](=O)[O-] ZINC000611891444 938967211 /nfs/dbraw/zinc/96/72/11/938967211.db2.gz NPQNYOHRLSLKDY-UHFFFAOYSA-N 0 0 369.299 3.673 20 5 FHBDRN O=C(Cc1ccc(Nc2ccc([N+](=O)[O-])nc2)cc1)N1CCc2ccccc21 ZINC000573283957 938968731 /nfs/dbraw/zinc/96/87/31/938968731.db2.gz HDJKVKKSQCHUCY-UHFFFAOYSA-N 0 0 374.400 3.865 20 5 FHBDRN Cc1cc(C(=O)N(Cc2ccccc2[N+](=O)[O-])CC(F)(F)F)c(C)n1C ZINC000511264137 938968784 /nfs/dbraw/zinc/96/87/84/938968784.db2.gz DIASEXIZTYNHCM-UHFFFAOYSA-N 0 0 369.343 3.755 20 5 FHBDRN CCc1ccc([C@@H](COC)NC(=O)Nc2cc([N+](=O)[O-])ccc2CC)o1 ZINC000515019175 938974984 /nfs/dbraw/zinc/97/49/84/938974984.db2.gz HITRUXCZOHOHOB-MRXNPFEDSA-N 0 0 361.398 3.822 20 5 FHBDRN CN(C)c1ccc(Cl)cc1NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000179135971 938978854 /nfs/dbraw/zinc/97/88/54/938978854.db2.gz KKFSFZCIYCOFBW-UHFFFAOYSA-N 0 0 372.812 3.977 20 5 FHBDRN O=C(CSc1ccccc1[N+](=O)[O-])N[C@@H](Cc1ccccc1)C1CC1 ZINC000135603741 938980139 /nfs/dbraw/zinc/98/01/39/938980139.db2.gz DSKBVXHIBCYSMP-INIZCTEOSA-N 0 0 356.447 3.824 20 5 FHBDRN O=[N+]([O-])c1ccc(N[C@H]2CCOc3c(Br)cccc32)cn1 ZINC000409642180 938980441 /nfs/dbraw/zinc/98/04/41/938980441.db2.gz RCRNBORFMVBFCM-LBPRGKRZSA-N 0 0 350.172 3.688 20 5 FHBDRN CCOc1cc(NC(=O)N2CC(C)=C[C@H](C)C2)c([N+](=O)[O-])cc1OCC ZINC000431577006 938980809 /nfs/dbraw/zinc/98/08/09/938980809.db2.gz FCOTZXDONMRQHI-LBPRGKRZSA-N 0 0 363.414 3.822 20 5 FHBDRN COc1ccc(OCCN[C@@H](C(C)(C)C)C(F)(F)F)c([N+](=O)[O-])c1 ZINC000545214971 938984670 /nfs/dbraw/zinc/98/46/70/938984670.db2.gz ULWGAWKHSAIRCT-ZDUSSCGKSA-N 0 0 350.337 3.549 20 5 FHBDRN Cc1cnc(N[C@@H]2CCOc3c(Br)cccc32)c([N+](=O)[O-])c1 ZINC000409653808 938984990 /nfs/dbraw/zinc/98/49/90/938984990.db2.gz WAEIKXQBCGMEDA-GFCCVEGCSA-N 0 0 364.199 3.996 20 5 FHBDRN CSc1ccc(NC(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])cn1 ZINC001125743817 938990176 /nfs/dbraw/zinc/99/01/76/938990176.db2.gz PHRLNQABYCLFLM-UHFFFAOYSA-N 0 0 357.313 3.983 20 5 FHBDRN Cn1cc([N+](=O)[O-])cc1C(=O)Nc1cc(Br)ccc1Cl ZINC000061693006 938993206 /nfs/dbraw/zinc/99/32/06/938993206.db2.gz LANMBEKBTIFBNU-UHFFFAOYSA-N 0 0 358.579 3.602 20 5 FHBDRN COc1cc(CN[C@H](C)c2cnccc2C)c([N+](=O)[O-])cc1OC(F)F ZINC000611939695 938993736 /nfs/dbraw/zinc/99/37/36/938993736.db2.gz UOUSIOGWEDEXIR-LLVKDONJSA-N 0 0 367.352 3.759 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CNc1ccc(Cl)c(Cl)c1 ZINC000007971807 938994301 /nfs/dbraw/zinc/99/43/01/938994301.db2.gz HQNGTVXTGXDWHK-UHFFFAOYSA-N 0 0 370.192 3.961 20 5 FHBDRN COc1ccccc1Nc1nnc(Sc2ccc([N+](=O)[O-])cn2)s1 ZINC000142301769 938995951 /nfs/dbraw/zinc/99/59/51/938995951.db2.gz GYDCNBCCIAMLBX-UHFFFAOYSA-N 0 0 361.408 3.745 20 5 FHBDRN CCN(C(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1)c1cccc(F)c1 ZINC000179242209 938996446 /nfs/dbraw/zinc/99/64/46/938996446.db2.gz UNWFMVJSXZFHTD-UHFFFAOYSA-N 0 0 354.341 3.586 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N1CC(C)(C)[C@@H]1c1cccs1 ZINC000511304895 938997033 /nfs/dbraw/zinc/99/70/33/938997033.db2.gz DLHISCKGVCOUPX-HNNXBMFYSA-N 0 0 373.434 3.513 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)c1cc(Cl)ccc1F ZINC001267445316 939006275 /nfs/dbraw/zinc/00/62/75/939006275.db2.gz JECKULTWXNIXKY-SECBINFHSA-N 0 0 352.749 3.887 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)NCCc1cccc(Cl)c1 ZINC000065719062 939006839 /nfs/dbraw/zinc/00/68/39/939006839.db2.gz YZJXRYYTCZIRKT-UHFFFAOYSA-N 0 0 357.797 3.562 20 5 FHBDRN COc1ccc(CC(=O)NCc2c(C)oc3ccccc32)cc1[N+](=O)[O-] ZINC000545230614 939007442 /nfs/dbraw/zinc/00/74/42/939007442.db2.gz PICZYKXOSHOUSQ-UHFFFAOYSA-N 0 0 354.362 3.517 20 5 FHBDRN Cc1cc(NC[C@H](O)c2ccccc2)c(Br)cc1[N+](=O)[O-] ZINC000235906397 939013914 /nfs/dbraw/zinc/01/39/14/939013914.db2.gz BLZHJSKELCOHLM-HNNXBMFYSA-N 0 0 351.200 3.811 20 5 FHBDRN O=C(Nc1nccn1-c1ccccc1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000511322075 939014152 /nfs/dbraw/zinc/01/41/52/939014152.db2.gz QHYZHDDKHZHDQZ-UHFFFAOYSA-N 0 0 374.303 3.634 20 5 FHBDRN Cc1cc(NC[C@@H](O)c2ccsc2)c(Br)cc1[N+](=O)[O-] ZINC000235895365 939014205 /nfs/dbraw/zinc/01/42/05/939014205.db2.gz GFIWXGDPPURLKU-CYBMUJFWSA-N 0 0 357.229 3.873 20 5 FHBDRN CCC[C@H](Cc1ccccc1)N(CCC)C(=O)Cn1c(C)ncc1[N+](=O)[O-] ZINC001125779696 939015059 /nfs/dbraw/zinc/01/50/59/939015059.db2.gz DGXBBCMBXSBLAM-GOSISDBHSA-N 0 0 372.469 3.750 20 5 FHBDRN CSc1cccc(C(=O)NCCO[C@@H]2CCCC[C@H]2C)c1[N+](=O)[O-] ZINC000188060326 939017364 /nfs/dbraw/zinc/01/73/64/939017364.db2.gz JFAIREACWBQTAU-TZMCWYRMSA-N 0 0 352.456 3.642 20 5 FHBDRN O=C(NCCCCOc1ccc(Cl)cc1)c1cc(F)cc([N+](=O)[O-])c1 ZINC000609442526 939017237 /nfs/dbraw/zinc/01/72/37/939017237.db2.gz QTTLBVXHFRLUFD-UHFFFAOYSA-N 0 0 366.776 3.976 20 5 FHBDRN Cc1ccccc1OCCCN(C)C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000065730006 939017385 /nfs/dbraw/zinc/01/73/85/939017385.db2.gz ONISQNMYYFCFQF-UHFFFAOYSA-N 0 0 367.405 3.926 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])c(S(C)(=O)=O)c1)c1ccc(F)cc1 ZINC000179257472 939017772 /nfs/dbraw/zinc/01/77/72/939017772.db2.gz FCABDRHMFIOTIR-JTQLQIEISA-N 0 0 355.412 3.991 20 5 FHBDRN CCOc1cc(F)ccc1NC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000065734940 939018334 /nfs/dbraw/zinc/01/83/34/939018334.db2.gz KBWHFJDJSOHKDO-UHFFFAOYSA-N 0 0 357.341 3.726 20 5 FHBDRN CC(C)Oc1ccc(NC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)cc1 ZINC000065734115 939018341 /nfs/dbraw/zinc/01/83/41/939018341.db2.gz CKJYPUMBXBGFOA-UHFFFAOYSA-N 0 0 353.378 3.975 20 5 FHBDRN NC(=O)[C@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)c1ccccc1 ZINC000102420880 939018605 /nfs/dbraw/zinc/01/86/05/939018605.db2.gz ZJFWIDOCFIXHAV-GOSISDBHSA-N 0 0 367.430 3.640 20 5 FHBDRN COc1cc(C(=O)N[C@@H](c2ncc(C)s2)C2CC2)cc([N+](=O)[O-])c1C ZINC000188136370 939019391 /nfs/dbraw/zinc/01/93/91/939019391.db2.gz NPLZQKXTBGMWSN-OAHLLOKOSA-N 0 0 361.423 3.558 20 5 FHBDRN C[C@@H](c1nc(COc2cccc(F)c2)no1)c1ccc([N+](=O)[O-])cc1F ZINC000188155749 939020419 /nfs/dbraw/zinc/02/04/19/939020419.db2.gz KMSAFQMNHUMWMT-SNVBAGLBSA-N 0 0 361.304 3.987 20 5 FHBDRN CSc1cccc(C(=O)NCCOC2CCCCCC2)c1[N+](=O)[O-] ZINC000188167872 939021445 /nfs/dbraw/zinc/02/14/45/939021445.db2.gz DBCIHUWEICWKLI-UHFFFAOYSA-N 0 0 352.456 3.786 20 5 FHBDRN CSCCCCCNC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000188208797 939046370 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COc1c(C(=O)OCCCn2c(C)nc3ccccc32)cccc1[N+](=O)[O-] ZINC000796665429 939133170 /nfs/dbraw/zinc/13/31/70/939133170.db2.gz XXORONAQHCHLQK-UHFFFAOYSA-N 0 0 369.377 3.509 20 5 FHBDRN COc1ncnc(OC)c1CNc1ccc(-c2ccc([N+](=O)[O-])cc2)cc1 ZINC001167686399 939137885 /nfs/dbraw/zinc/13/78/85/939137885.db2.gz YREJJQNJNIZYEL-UHFFFAOYSA-N 0 0 366.377 3.681 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC(c2ccccc2)CC1 ZINC000065791826 939147742 /nfs/dbraw/zinc/14/77/42/939147742.db2.gz ZARCWHGWVHXONC-UHFFFAOYSA-N 0 0 374.462 3.726 20 5 FHBDRN COc1cccc(-c2cc(NC(=O)c3cc(C)ccc3[N+](=O)[O-])n(C)n2)c1 ZINC000179414165 939148438 /nfs/dbraw/zinc/14/84/38/939148438.db2.gz UGYMTKFWRWJPNS-UHFFFAOYSA-N 0 0 366.377 3.565 20 5 FHBDRN O=C(O[C@H]1COc2cc(Cl)ccc21)c1cc(F)c([N+](=O)[O-])cc1F ZINC000785215215 939154064 /nfs/dbraw/zinc/15/40/64/939154064.db2.gz NUNUUFWZFYERJF-AWEZNQCLSA-N 0 0 355.680 3.817 20 5 FHBDRN COc1cc(CN2Cc3ccccc3C2)c([N+](=O)[O-])cc1OC(F)F ZINC000106304504 945231241 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C[C@H]1[C@H](Cc2ccccc2)CCN1C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000472389114 939202894 /nfs/dbraw/zinc/20/28/94/939202894.db2.gz QLGMYZGUTYETMY-ZFWWWQNUSA-N 0 0 364.405 3.564 20 5 FHBDRN COC[C@H]1CN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C[C@H](C)O1 ZINC000188371318 939214300 /nfs/dbraw/zinc/21/43/00/939214300.db2.gz OTZNAWRZRFKLFH-XJKSGUPXSA-N 0 0 362.451 3.559 20 5 FHBDRN CO[C@@H](C)[C@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000188364519 939215790 /nfs/dbraw/zinc/21/57/90/939215790.db2.gz JHGOTHXUPZOOQU-STQMWFEESA-N 0 0 360.435 3.899 20 5 FHBDRN Cc1c(CC(=O)Nc2nc3c(s2)C(=O)CC(C)(C)C3)cccc1[N+](=O)[O-] ZINC000162074828 939215911 /nfs/dbraw/zinc/21/59/11/939215911.db2.gz OJPXRVDHLUJUQO-UHFFFAOYSA-N 0 0 373.434 3.696 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)N(C)Cc2cccc(Cl)c2)c1 ZINC000543679142 945236102 /nfs/dbraw/zinc/23/61/02/945236102.db2.gz QEENHZHNVIIOTJ-UHFFFAOYSA-N 0 0 368.842 3.686 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])c1c[nH]nc1-c1cc2ccccc2o1 ZINC000188392193 939223288 /nfs/dbraw/zinc/22/32/88/939223288.db2.gz UOUAWZWUHDHQSP-UHFFFAOYSA-N 0 0 362.345 3.661 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N1Cc2ccccc2OC[C@H]1C ZINC000438937319 945240018 /nfs/dbraw/zinc/24/00/18/945240018.db2.gz PISUFQACOMNRQG-GFCCVEGCSA-N 0 0 360.797 3.980 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1CCCCC[C@@H]1c1ccncc1 ZINC000427273980 945244237 /nfs/dbraw/zinc/24/42/37/945244237.db2.gz KJBLMQBHKXNDEW-QGZVFWFLSA-N 0 0 355.394 3.756 20 5 FHBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)N[C@@H]1C[C@H]1Cc1ccccc1 ZINC000440105335 945244380 /nfs/dbraw/zinc/24/43/80/945244380.db2.gz LXGLYNDDBXICDE-UYAOXDASSA-N 0 0 367.449 3.848 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](CO)[C@@H](C)CCC ZINC000516777801 945246421 /nfs/dbraw/zinc/24/64/21/945246421.db2.gz QWZHKSVRDOXPLW-SWLSCSKDSA-N 0 0 354.472 3.624 20 5 FHBDRN O=C(NCc1cccc(Br)c1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000111008466 945248341 /nfs/dbraw/zinc/24/83/41/945248341.db2.gz FAJHZBTTXQFCJO-UHFFFAOYSA-N 0 0 369.602 3.941 20 5 FHBDRN CC(=O)c1c(C)[nH]c(C(=O)N2CCc3c2cccc3[N+](=O)[O-])c1C(C)C ZINC000511836423 945250346 /nfs/dbraw/zinc/25/03/46/945250346.db2.gz ZCEQAOGYULLFDC-UHFFFAOYSA-N 0 0 355.394 3.760 20 5 FHBDRN Cc1cccc(C)c1NC(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21 ZINC000018080134 945252743 /nfs/dbraw/zinc/25/27/43/945252743.db2.gz UKHJZXMIYYNXSM-UHFFFAOYSA-N 0 0 369.377 3.538 20 5 FHBDRN CN(Cc1cccc(F)c1)C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000018080432 945252843 /nfs/dbraw/zinc/25/28/43/945252843.db2.gz XGRNFNDIPXFFIP-UHFFFAOYSA-N 0 0 357.385 3.606 20 5 FHBDRN CC(C)n1ncc2c1C[C@@H](Nc1ccnc3c1cccc3[N+](=O)[O-])CC2 ZINC000432171658 945254114 /nfs/dbraw/zinc/25/41/14/945254114.db2.gz GGDYPZRRMHBVGP-AWEZNQCLSA-N 0 0 351.410 3.890 20 5 FHBDRN C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCN2c2ccnc3c2cccc3[N+](=O)[O-])C1 ZINC000432172868 945262499 /nfs/dbraw/zinc/26/24/99/945262499.db2.gz QQRQJOBPUAKDQL-DEWZPKMOSA-N 0 0 355.438 3.909 20 5 FHBDRN C[C@@H]1CC[C@H](O)[C@@H]([C@@H]2CCCN2c2ccnc3c2cccc3[N+](=O)[O-])C1 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3.537 20 5 FHBDRN COC(=O)c1cc(NC(=O)c2ccc(C)nc2C(C)C)c(C)c([N+](=O)[O-])c1 ZINC000410759903 939953331 /nfs/dbraw/zinc/95/33/31/939953331.db2.gz HZGFIDLCYJGEOY-UHFFFAOYSA-N 0 0 371.393 3.769 20 5 FHBDRN COc1cccc(-c2nc(-c3c(C)nc4sc(C)cn43)no2)c1[N+](=O)[O-] ZINC000426582965 945285900 /nfs/dbraw/zinc/28/59/00/945285900.db2.gz AEHGUPSYCWLWTM-UHFFFAOYSA-N 0 0 371.378 3.646 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)c1ccc(N(C)C)c(F)c1 ZINC000065852746 939973054 /nfs/dbraw/zinc/97/30/54/939973054.db2.gz MLWJPCORZBCNSU-UHFFFAOYSA-N 0 0 359.401 3.851 20 5 FHBDRN COc1cc(OC)cc(-c2nnc(SCc3ccccc3[N+](=O)[O-])o2)c1 ZINC000005435331 939978148 /nfs/dbraw/zinc/97/81/48/939978148.db2.gz RLYNGRAGYLTSSL-UHFFFAOYSA-N 0 0 373.390 3.954 20 5 FHBDRN Cc1nc2c(s1)CCC[C@H]2CN(C)C(=O)c1ccc(C)c([N+](=O)[O-])c1 ZINC000364656484 939979014 /nfs/dbraw/zinc/97/90/14/939979014.db2.gz FYBMXZJTFVBAGQ-AWEZNQCLSA-N 0 0 359.451 3.860 20 5 FHBDRN CCNc1ccc(C(=O)Nc2ccc3c(c2)CCCC3=O)cc1[N+](=O)[O-] ZINC000411012660 939985944 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FHBDRN COc1cc(Cl)c(C(=O)COc2ccc([N+](=O)[O-])cc2)cc1OC ZINC000518281822 945288450 /nfs/dbraw/zinc/28/84/50/945288450.db2.gz YFLCDXOKBAQDQF-UHFFFAOYSA-N 0 0 351.742 3.527 20 5 FHBDRN CCc1nc2cc(NC(=O)Cn3ccc4cc([N+](=O)[O-])ccc43)ccc2o1 ZINC000065873148 940004810 /nfs/dbraw/zinc/00/48/10/940004810.db2.gz CAPAXJQAVXORTR-UHFFFAOYSA-N 0 0 364.361 3.892 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1cc(N(C)C)ccn1 ZINC000612346107 940014599 /nfs/dbraw/zinc/01/45/99/940014599.db2.gz FSQJXXPLSFKZFC-UHFFFAOYSA-N 0 0 360.439 3.810 20 5 FHBDRN Cc1sc(CC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)nc1C(C)C ZINC000548921092 940015228 /nfs/dbraw/zinc/01/52/28/940015228.db2.gz AJYVRFZHOOKBJW-UHFFFAOYSA-N 0 0 361.467 3.727 20 5 FHBDRN COC(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)s1 ZINC000437364256 945290699 /nfs/dbraw/zinc/29/06/99/945290699.db2.gz OABCYOFOSIIMTN-UHFFFAOYSA-N 0 0 374.296 3.714 20 5 FHBDRN COc1cccc(-c2noc(Cc3c[nH]c4ccc([N+](=O)[O-])cc34)n2)c1 ZINC000136524410 940017074 /nfs/dbraw/zinc/01/70/74/940017074.db2.gz SLLMPBXPHKCDBK-UHFFFAOYSA-N 0 0 350.334 3.726 20 5 FHBDRN CC(C)Cc1nnc(NC(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)s1 ZINC000411258940 940018706 /nfs/dbraw/zinc/01/87/06/940018706.db2.gz VQJITCVGVSXJFO-UHFFFAOYSA-N 0 0 364.427 3.684 20 5 FHBDRN Cc1cc(NC(=O)C(=O)N[C@H](C)[C@@H](C)C2CCCCC2)ccc1[N+](=O)[O-] ZINC000411278250 940021305 /nfs/dbraw/zinc/02/13/05/940021305.db2.gz PQAFSLXPHLVRJX-ZIAGYGMSSA-N 0 0 361.442 3.563 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1CN1C[C@@H](C)O[C@@H](c2ccccc2)C1 ZINC000511856618 945290072 /nfs/dbraw/zinc/29/00/72/945290072.db2.gz YTMQHJSYZRAYFL-FOIQADDNSA-N 0 0 356.422 3.956 20 5 FHBDRN Cc1ccn(C2CCN(Cc3coc(-c4ccc([N+](=O)[O-])cc4)n3)CC2)n1 ZINC000365009372 940038996 /nfs/dbraw/zinc/03/89/96/940038996.db2.gz PFYHHOBWYVIKJS-UHFFFAOYSA-N 0 0 367.409 3.592 20 5 FHBDRN CC[C@@H](C)[C@@H](C)N(C(=O)C(=O)Nc1cc([N+](=O)[O-])c(C)cc1C)C1CC1 ZINC000411402040 940039395 /nfs/dbraw/zinc/03/93/95/940039395.db2.gz OJHIFFSQOJIZGD-BXUZGUMPSA-N 0 0 361.442 3.576 20 5 FHBDRN COCCOc1cc(C)ccc1CNC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000128290686 940041459 /nfs/dbraw/zinc/04/14/59/940041459.db2.gz UEDUMSQXMHRYGN-UHFFFAOYSA-N 0 0 373.409 3.559 20 5 FHBDRN C[C@@H](OC(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F)c1ncc(Cl)n1C ZINC000755801142 940041660 /nfs/dbraw/zinc/04/16/60/940041660.db2.gz HOHFGLKGIWCLJA-DTWKUNHWSA-N 0 0 355.753 3.529 20 5 FHBDRN Cc1cc(C2CCN(c3ccc(Br)cc3[N+](=O)[O-])CC2)n[nH]1 ZINC000612397190 940043882 /nfs/dbraw/zinc/04/38/82/940043882.db2.gz HSNQIXUMKHUQSX-UHFFFAOYSA-N 0 0 365.231 3.773 20 5 FHBDRN CCc1ccc(NC(=O)C(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)cc1C ZINC000411425182 940045022 /nfs/dbraw/zinc/04/50/22/940045022.db2.gz FZLQMLUXMXAXLD-UHFFFAOYSA-N 0 0 355.394 3.660 20 5 FHBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1C[C@@H]2CCCC[C@H]2C1 ZINC000427353236 945293059 /nfs/dbraw/zinc/29/30/59/945293059.db2.gz XIHRSWWYRBKHSI-AVGNSLFASA-N 0 0 352.818 3.664 20 5 FHBDRN O=C(N[C@H]1CCOc2c(Cl)cccc21)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000411612005 940073147 /nfs/dbraw/zinc/07/31/47/940073147.db2.gz YSQGOOZNTNSRJO-UXLLHSPISA-N 0 0 372.808 3.992 20 5 FHBDRN Cc1nsc(C)c1-c1noc(CCCNc2ccc([N+](=O)[O-])cc2)n1 ZINC000426588378 945294590 /nfs/dbraw/zinc/29/45/90/945294590.db2.gz PLECVVFFLBIHDT-UHFFFAOYSA-N 0 0 359.411 3.763 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccc(C)c(-c2ncco2)c1 ZINC000365189932 940079777 /nfs/dbraw/zinc/07/97/77/940079777.db2.gz MGOCOLJBTNFXJU-UHFFFAOYSA-N 0 0 353.334 3.819 20 5 FHBDRN O=C(Nc1ncccc1Cl)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000179886997 940084020 /nfs/dbraw/zinc/08/40/20/940084020.db2.gz GUUIXNYMCJSBQP-UHFFFAOYSA-N 0 0 356.563 3.658 20 5 FHBDRN C[C@@H](C(=O)N1Cc2ccccc2OC[C@@H]1C)c1ccc([N+](=O)[O-])cc1F ZINC000612488630 940097427 /nfs/dbraw/zinc/09/74/27/940097427.db2.gz BERNPYZWLSJTMA-QWHCGFSZSA-N 0 0 358.369 3.647 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1CCCC[C@H]1c1ncc(C)s1 ZINC000365278481 940107399 /nfs/dbraw/zinc/10/73/99/940107399.db2.gz OYDQIZQSQKTAMN-AWEZNQCLSA-N 0 0 361.423 3.736 20 5 FHBDRN Cc1ccc([C@H](C)NCc2cnc(Br)s2)cc1[N+](=O)[O-] ZINC000290165381 940113753 /nfs/dbraw/zinc/11/37/53/940113753.db2.gz XWRJODSTNAZQGW-VIFPVBQESA-N 0 0 356.245 3.973 20 5 FHBDRN O=C(N[C@H]1CCc2ccccc2C1)c1c([N+](=O)[O-])cccc1C(F)(F)F ZINC000612520454 940118782 /nfs/dbraw/zinc/11/87/82/940118782.db2.gz CHKYZBDBBOVINT-ZDUSSCGKSA-N 0 0 364.323 3.901 20 5 FHBDRN CC(C)Oc1cc(C(=O)Nc2ccc3c(c2)CCCO3)ccc1[N+](=O)[O-] ZINC000411844186 940135462 /nfs/dbraw/zinc/13/54/62/940135462.db2.gz LYUDIUHFXFYHKU-UHFFFAOYSA-N 0 0 356.378 3.959 20 5 FHBDRN Cc1noc(C)c1[C@H](C)NC(=O)c1c([N+](=O)[O-])cccc1C(F)(F)F ZINC000612545680 940137604 /nfs/dbraw/zinc/13/76/04/940137604.db2.gz LZEOEJMHTMOPDW-ZETCQYMHSA-N 0 0 357.288 3.709 20 5 FHBDRN C[C@@H](NC(=O)Nc1cccnc1OCC(F)F)c1cccc([N+](=O)[O-])c1 ZINC000179939986 940147344 /nfs/dbraw/zinc/14/73/44/940147344.db2.gz ZFHHVCXIHZYZER-SNVBAGLBSA-N 0 0 366.324 3.516 20 5 FHBDRN CN(Cc1cn2c(n1)CCCC2)C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000365401277 940152389 /nfs/dbraw/zinc/15/23/89/940152389.db2.gz BQMWPXRWADHYBY-UHFFFAOYSA-N 0 0 370.434 3.615 20 5 FHBDRN CC[C@@H](CNC(=O)c1cc(F)ccc1[N+](=O)[O-])Oc1ccccc1Cl ZINC000177373070 940154863 /nfs/dbraw/zinc/15/48/63/940154863.db2.gz QZNOORBHYBUMOY-LBPRGKRZSA-N 0 0 366.776 3.975 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)Nc2cccc([C@@H](C)OC)c2)c1F ZINC000411908778 940159322 /nfs/dbraw/zinc/15/93/22/940159322.db2.gz QSFFTSWJVNBVPM-LLVKDONJSA-N 0 0 362.357 3.631 20 5 FHBDRN CN(Cc1ccc(F)cc1)C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000179947925 940159951 /nfs/dbraw/zinc/15/99/51/940159951.db2.gz WWRGWBXWTGUPFC-UHFFFAOYSA-N 0 0 354.284 3.608 20 5 FHBDRN CC(C)Oc1cc(C(=O)N[C@@H]2CCc3c2cccc3O)ccc1[N+](=O)[O-] ZINC000411980748 940170428 /nfs/dbraw/zinc/17/04/28/940170428.db2.gz JNADEADVUXSUTR-OAHLLOKOSA-N 0 0 356.378 3.505 20 5 FHBDRN CC(C)Oc1cc(C(=O)N[C@H]2CCc3c2cccc3O)ccc1[N+](=O)[O-] ZINC000411980746 940170472 /nfs/dbraw/zinc/17/04/72/940170472.db2.gz JNADEADVUXSUTR-HNNXBMFYSA-N 0 0 356.378 3.505 20 5 FHBDRN CC(=O)N(Cc1ccc(NCCc2ccc([N+](=O)[O-])cc2)cc1)C1CC1 ZINC000612598211 940171279 /nfs/dbraw/zinc/17/12/79/940171279.db2.gz WKPJMGZPPMQXKY-UHFFFAOYSA-N 0 0 353.422 3.760 20 5 FHBDRN CCN(CC)c1ccc(NC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2)cc1 ZINC000005656121 940172912 /nfs/dbraw/zinc/17/29/12/940172912.db2.gz RECXXUDAFZRSMY-UHFFFAOYSA-N 0 0 372.381 3.910 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2OCCC[C@H]2C1 ZINC000181673978 945300670 /nfs/dbraw/zinc/30/06/70/945300670.db2.gz ZXOFBROKMCMBMW-XJKSGUPXSA-N 0 0 364.467 3.736 20 5 FHBDRN CC[C@@H](NS(=O)(=O)c1ccc([N+](=O)[O-])s1)c1cccc(Cl)c1 ZINC000066000461 940175658 /nfs/dbraw/zinc/17/56/58/940175658.db2.gz RKYADSMYLLVKHH-LLVKDONJSA-N 0 0 360.844 3.739 20 5 FHBDRN CN(c1ccc(C(C)(C)C)cc1)S(=O)(=O)c1ccc([N+](=O)[O-])s1 ZINC000066001465 940176150 /nfs/dbraw/zinc/17/61/50/940176150.db2.gz PYKJWOBZEIYVQK-UHFFFAOYSA-N 0 0 354.453 3.779 20 5 FHBDRN COc1ccc(CN2CC3(CCOCC3)[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000411994645 940179809 /nfs/dbraw/zinc/17/98/09/940179809.db2.gz AQDJQSQRKZRSTC-FQEVSTJZSA-N 0 0 368.433 3.957 20 5 FHBDRN CCN(C(=O)CCNc1ccccc1[N+](=O)[O-])c1ccc2[nH]ccc2c1 ZINC000472452646 940197253 /nfs/dbraw/zinc/19/72/53/940197253.db2.gz YSLBXVVRTKKTFL-UHFFFAOYSA-N 0 0 352.394 3.931 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc(-c2ncco2)c1 ZINC000548950592 940197406 /nfs/dbraw/zinc/19/74/06/940197406.db2.gz ORQMRQVOSLXOSI-UHFFFAOYSA-N 0 0 366.377 3.956 20 5 FHBDRN Cc1c(NC(=O)N(Cc2ccccc2)[C@@H](CO)C2CC2)cccc1[N+](=O)[O-] ZINC000179988285 940198333 /nfs/dbraw/zinc/19/83/33/940198333.db2.gz JZBZJAPMMVMHKT-IBGZPJMESA-N 0 0 369.421 3.708 20 5 FHBDRN CC[C@H](C)Oc1ccc(NC(=O)COc2ccc([N+](=O)[O-])c(OC)c2)cc1 ZINC000066027551 940212891 /nfs/dbraw/zinc/21/28/91/940212891.db2.gz FEHWYOFRILVRBT-ZDUSSCGKSA-N 0 0 374.393 3.798 20 5 FHBDRN O=C(CC1CCCC1)NC1CCN(c2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000066859749 945303983 /nfs/dbraw/zinc/30/39/83/945303983.db2.gz DCBKSDUTCXPHMR-UHFFFAOYSA-N 0 0 365.861 3.914 20 5 FHBDRN CC[C@H](NC(=O)Nc1ccc(OC)c([N+](=O)[O-])c1)c1ccccc1OC ZINC000782630684 940223469 /nfs/dbraw/zinc/22/34/69/940223469.db2.gz YMPARIMJTGNDKK-AWEZNQCLSA-N 0 0 359.382 3.885 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CN[C@@H](C)c1ccc(-n2cccn2)c(F)c1 ZINC000550288915 945306286 /nfs/dbraw/zinc/30/62/86/945306286.db2.gz YCHRBSHMSPOKRJ-ZDUSSCGKSA-N 0 0 370.384 3.779 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NCc2ccc(OC(F)F)cc2)c1 ZINC000548961484 940289136 /nfs/dbraw/zinc/28/91/36/940289136.db2.gz YKAYONOPPBRFID-UHFFFAOYSA-N 0 0 366.320 3.525 20 5 FHBDRN CC(C)Oc1ccc(NS(=O)(=O)c2ccccc2[N+](=O)[O-])c(Cl)c1 ZINC000188600424 940290347 /nfs/dbraw/zinc/29/03/47/940290347.db2.gz JOGCRCFNOQUBKL-UHFFFAOYSA-N 0 0 370.814 3.836 20 5 FHBDRN CC(=O)c1cc([N+](=O)[O-])ccc1N1CCC([C@@H](O)c2ccccc2)CC1 ZINC000376089317 940293227 /nfs/dbraw/zinc/29/32/27/940293227.db2.gz RYQGGAUWGTTZQX-FQEVSTJZSA-N 0 0 354.406 3.747 20 5 FHBDRN Cc1ccc(S(=O)(=O)N(Cc2ccccc2)[C@@H](C)C2CC2)c([N+](=O)[O-])c1 ZINC000507550578 945309462 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Cc1ccc([N+](=O)[O-])cc1[C@@H](C)Sc1nncn1CCc1ccccn1 ZINC000180048821 940325201 /nfs/dbraw/zinc/32/52/01/940325201.db2.gz ZQPDZRKCCJSVCN-CQSZACIVSA-N 0 0 369.450 3.986 20 5 FHBDRN COCc1ccccc1-c1noc(-c2c[nH]c3ccc([N+](=O)[O-])cc32)n1 ZINC000612901716 940335120 /nfs/dbraw/zinc/33/51/20/940335120.db2.gz LJRSPNDRAJCRFH-UHFFFAOYSA-N 0 0 350.334 3.940 20 5 FHBDRN Cc1cccc(-c2noc(-c3ccc(N4CCCC4)c([N+](=O)[O-])c3)n2)n1 ZINC000612910752 940336739 /nfs/dbraw/zinc/33/67/39/940336739.db2.gz CXDXJRLDJSTOKP-UHFFFAOYSA-N 0 0 351.366 3.615 20 5 FHBDRN COc1cccc([C@H](C)c2noc(CCNc3ccccc3[N+](=O)[O-])n2)c1 ZINC000612916850 940338418 /nfs/dbraw/zinc/33/84/18/940338418.db2.gz ANTJUGPGDMZECC-ZDUSSCGKSA-N 0 0 368.393 3.793 20 5 FHBDRN Cc1c(C[NH2+][C@@H](c2ccccc2)C2(CO)CCOCC2)cccc1[N+](=O)[O-] ZINC000412004894 940339428 /nfs/dbraw/zinc/33/94/28/940339428.db2.gz DNQFLVGPERJKSP-FQEVSTJZSA-N 0 0 370.449 3.523 20 5 FHBDRN CC(=O)N1c2ccccc2C[C@H]1c1nc(-c2ccc([N+](=O)[O-])cc2C)no1 ZINC000612936624 940345307 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FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)N(C)[C@H]2CCC[C@H]2c2ccc(C)cc2)n1 ZINC000427360315 945314677 /nfs/dbraw/zinc/31/46/77/945314677.db2.gz YTUNIVZJPFGFKG-HOTGVXAUSA-N 0 0 356.426 3.528 20 5 FHBDRN C[C@@H]1CCc2c(F)cccc2[C@H]1NC(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000431721947 940409521 /nfs/dbraw/zinc/40/95/21/940409521.db2.gz JJHPPVLTSFCCJY-XIKOKIGWSA-N 0 0 357.385 3.857 20 5 FHBDRN CC(C)n1cc(NC(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)cn1 ZINC000579905873 940415368 /nfs/dbraw/zinc/41/53/68/940415368.db2.gz QHGWPIYDPVSXMB-UHFFFAOYSA-N 0 0 371.319 3.713 20 5 FHBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@H](CO)[C@@H]1C ZINC000414022165 940416490 /nfs/dbraw/zinc/41/64/90/940416490.db2.gz GEGCCFYFAIXITR-UONOGXRCSA-N 0 0 366.483 3.576 20 5 FHBDRN COc1cccc(C2(CNC(=O)Nc3ccc([N+](=O)[O-])cc3C)CC2)c1 ZINC000580014064 940430967 /nfs/dbraw/zinc/43/09/67/940430967.db2.gz TYQBJPUIMSPWTM-UHFFFAOYSA-N 0 0 355.394 3.765 20 5 FHBDRN O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)N1CCSc2ccccc21 ZINC000579999965 940432821 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CCOc1cc(C(=O)Nc2ccnc(C)c2Cl)c([N+](=O)[O-])cc1OC ZINC000124824491 945322410 /nfs/dbraw/zinc/32/24/10/945322410.db2.gz DQOWCGYNUAUVTC-UHFFFAOYSA-N 0 0 365.773 3.611 20 5 FHBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])c1ccc2ccccc2n1 ZINC000540899483 940464180 /nfs/dbraw/zinc/46/41/80/940464180.db2.gz ZYUYCUMHPNIKLX-UHFFFAOYSA-N 0 0 355.781 3.769 20 5 FHBDRN Cc1cccc(C(=O)N2CC[C@@]3(C2)CCc2ccccc2O3)c1[N+](=O)[O-] ZINC000580264133 940471236 /nfs/dbraw/zinc/47/12/36/940471236.db2.gz QDWFTQKWQCNIQR-HXUWFJFHSA-N 0 0 352.390 3.513 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1CCC[C@H]1/C=C/c1ccccc1 ZINC000427395160 945323619 /nfs/dbraw/zinc/32/36/19/945323619.db2.gz NTVPURSCOPKLKW-SCOAYWHSSA-N 0 0 352.390 3.921 20 5 FHBDRN COC(=O)Nc1cccc(C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000177875574 940473053 /nfs/dbraw/zinc/47/30/53/940473053.db2.gz HCXUHEGOQHBKKL-GFCCVEGCSA-N 0 0 357.366 3.573 20 5 FHBDRN C[C@@H](C(=O)N1CCN(c2cccc(F)c2)C[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000580360567 940473929 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CC[C@@H](c1ccccc1OC)N(C)C(=O)c1ccc(OC)c([N+](=O)[O-])c1 ZINC000580595241 940481993 /nfs/dbraw/zinc/48/19/93/940481993.db2.gz XKJKNOJXIWIOEC-HNNXBMFYSA-N 0 0 358.394 3.835 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)NC[C@](C)(O)c2cccs2)cc1[N+](=O)[O-] ZINC000177918904 940483135 /nfs/dbraw/zinc/48/31/35/940483135.db2.gz QVLPIMJLNKKPDD-SFHVURJKSA-N 0 0 362.451 3.591 20 5 FHBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])c1cc(-c2ccccc2)n[nH]1 ZINC000540899579 940483699 /nfs/dbraw/zinc/48/36/99/940483699.db2.gz DJKMMZZSYSQGPE-UHFFFAOYSA-N 0 0 370.796 3.611 20 5 FHBDRN COc1cc(Cc2noc([C@@H]3C[C@H]3c3cccc(O)c3)n2)ccc1[N+](=O)[O-] ZINC000580943141 940489483 /nfs/dbraw/zinc/48/94/83/940489483.db2.gz XUAZCMKIFWPJAU-LSDHHAIUSA-N 0 0 367.361 3.554 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NCc2ccc(Cl)cc2F)c1 ZINC000549007049 940489490 /nfs/dbraw/zinc/48/94/90/940489490.db2.gz SGTHNEWEYGFZOI-UHFFFAOYSA-N 0 0 352.749 3.716 20 5 FHBDRN COc1ccc(CNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c(OC)n1 ZINC000580866256 940489901 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0 357.410 3.899 20 5 FHBDRN CC(=O)Nc1cccc([C@H](C)NC(=O)C(C)(C)c2ccccc2[N+](=O)[O-])c1 ZINC000431782444 940497537 /nfs/dbraw/zinc/49/75/37/940497537.db2.gz DQINWZOZOSQYSY-ZDUSSCGKSA-N 0 0 369.421 3.708 20 5 FHBDRN Cc1cccc(CN(C)C(=O)c2cc(Br)cc([N+](=O)[O-])c2)c1 ZINC000431788151 940502246 /nfs/dbraw/zinc/50/22/46/940502246.db2.gz YZZPBIYFDQFCRB-UHFFFAOYSA-N 0 0 363.211 3.938 20 5 FHBDRN CC(C)Oc1nc(N2CC[C@H](n3ncc4ccccc43)C2)ccc1[N+](=O)[O-] ZINC000581559312 940506328 /nfs/dbraw/zinc/50/63/28/940506328.db2.gz ULVJMINDNYYOGC-HNNXBMFYSA-N 0 0 367.409 3.578 20 5 FHBDRN COc1ccc2c(c1)CC[C@H](NC(=O)Nc1cc([N+](=O)[O-])c(C)cc1C)C2 ZINC000613300159 940507043 /nfs/dbraw/zinc/50/70/43/940507043.db2.gz ICMLTSZDRWNSEP-INIZCTEOSA-N 0 0 369.421 3.899 20 5 FHBDRN COC(=O)Nc1cc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)ccc1F ZINC000066489617 940507866 /nfs/dbraw/zinc/50/78/66/940507866.db2.gz CUXXCKSWHAHQMZ-UHFFFAOYSA-N 0 0 367.720 3.818 20 5 FHBDRN COCc1nc2cc(NC(=O)[C@@H](C)c3cccc([N+](=O)[O-])c3)ccc2o1 ZINC000581644560 940509203 /nfs/dbraw/zinc/50/92/03/940509203.db2.gz RLMAFOHOPBFIQZ-NSHDSACASA-N 0 0 355.350 3.625 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)COC(=O)C(C)(C)c1ccc(F)cc1 ZINC000728648109 940510197 /nfs/dbraw/zinc/51/01/97/940510197.db2.gz LCNUYHUBFUERPX-UHFFFAOYSA-N 0 0 374.368 3.502 20 5 FHBDRN CCCc1noc(CCCC(=O)Oc2cc(Cl)ccc2[N+](=O)[O-])n1 ZINC000124779403 945328738 /nfs/dbraw/zinc/32/87/38/945328738.db2.gz DCMGRPFIPMHGBC-UHFFFAOYSA-N 0 0 353.762 3.512 20 5 FHBDRN CC(C)Sc1ccc(Cn2nc(-c3ccc([N+](=O)[O-])cc3)oc2=O)cc1 ZINC000511860667 945328747 /nfs/dbraw/zinc/32/87/47/945328747.db2.gz DTYWEJYJTFTJPB-UHFFFAOYSA-N 0 0 371.418 3.960 20 5 FHBDRN CC(C)(C)c1noc(CCCC(=O)Oc2cc(Cl)ccc2[N+](=O)[O-])n1 ZINC000124782468 945329109 /nfs/dbraw/zinc/32/91/09/945329109.db2.gz FCKZEKSIUBFOHE-UHFFFAOYSA-N 0 0 367.789 3.857 20 5 FHBDRN COc1ccc2nc(NC(=O)Cc3ccc([N+](=O)[O-])cc3F)sc2c1 ZINC000124881822 945331101 /nfs/dbraw/zinc/33/11/01/945331101.db2.gz LESRBTLDSAQVJY-UHFFFAOYSA-N 0 0 361.354 3.533 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCCC1Cc2ccccc2C1 ZINC000550288333 945334537 /nfs/dbraw/zinc/33/45/37/945334537.db2.gz XADXHVJCJAZIEM-AWEZNQCLSA-N 0 0 370.474 3.997 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N1C[C@@H](c2ccccc2)OCC1(C)C ZINC000066512009 940593388 /nfs/dbraw/zinc/59/33/88/940593388.db2.gz ICLOUUCICUTYQR-SFHVURJKSA-N 0 0 354.406 3.896 20 5 FHBDRN CCS[C@@H](C)c1noc(CN(C)Cc2cc(F)ccc2[N+](=O)[O-])n1 ZINC000178036573 940599057 /nfs/dbraw/zinc/59/90/57/940599057.db2.gz FDNYGQUFLNJBEU-JTQLQIEISA-N 0 0 354.407 3.563 20 5 FHBDRN COc1cccc(C(=O)CCCC(=O)N2CCc3ccc([N+](=O)[O-])cc32)c1 ZINC000431800318 940604971 /nfs/dbraw/zinc/60/49/71/940604971.db2.gz VZZWSYKIVPPYRT-UHFFFAOYSA-N 0 0 368.389 3.546 20 5 FHBDRN CNC(=O)c1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2SC(C)C)c1 ZINC000180129189 940607962 /nfs/dbraw/zinc/60/79/62/940607962.db2.gz JKSKQCBRJBLHNS-UHFFFAOYSA-N 0 0 373.434 3.707 20 5 FHBDRN Cc1nn(CCC(=O)NC(C)(C)c2ccc(Cl)cc2)c(C)c1[N+](=O)[O-] ZINC000066527319 940615621 /nfs/dbraw/zinc/61/56/21/940615621.db2.gz HHBWIUNPTZOLQW-UHFFFAOYSA-N 0 0 364.833 3.503 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccccc1CC(F)(F)F ZINC000427391430 945335282 /nfs/dbraw/zinc/33/52/82/945335282.db2.gz QGVCACZWQVTALI-UHFFFAOYSA-N 0 0 354.284 3.961 20 5 FHBDRN CNC(=O)c1ccc(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])cc1Cl ZINC000124854649 945335227 /nfs/dbraw/zinc/33/52/27/945335227.db2.gz BAOFWDPVKLTBJD-UHFFFAOYSA-N 0 0 368.176 3.514 20 5 FHBDRN CCCc1nc(-c2noc(Cc3c[nH]c4ccc([N+](=O)[O-])cc34)n2)co1 ZINC000581850967 940627383 /nfs/dbraw/zinc/62/73/83/940627383.db2.gz PVYBAKKJLGZKGR-UHFFFAOYSA-N 0 0 353.338 3.657 20 5 FHBDRN C[C@H](c1ccc([S@@](C)=O)cc1)N(C)C(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000581858807 940627630 /nfs/dbraw/zinc/62/76/30/940627630.db2.gz VXMGCZQGFIEFOJ-YSYWSOSGSA-N 0 0 374.462 3.655 20 5 FHBDRN COc1cc(CN2CCCO[C@@H](c3ccccc3)C2)c([N+](=O)[O-])cc1F ZINC000613379025 940650488 /nfs/dbraw/zinc/65/04/88/940650488.db2.gz VHYTWRJQRKGZKX-LJQANCHMSA-N 0 0 360.385 3.706 20 5 FHBDRN CC1=C(c2ccco2)CN(C(=O)NCCc2ccccc2[N+](=O)[O-])CC1 ZINC000511497570 940651943 /nfs/dbraw/zinc/65/19/43/940651943.db2.gz GWXSFVQTROFQMH-UHFFFAOYSA-N 0 0 355.394 3.619 20 5 FHBDRN CN(Cc1cccn1C)C(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000472537653 940654256 /nfs/dbraw/zinc/65/42/56/940654256.db2.gz XQYGMPNTYUPQED-UHFFFAOYSA-N 0 0 364.405 3.949 20 5 FHBDRN COc1cc(N2CC[C@@H](OCCCc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000431821550 940660724 /nfs/dbraw/zinc/66/07/24/940660724.db2.gz FZCLQLMDLYBUFY-GOSISDBHSA-N 0 0 356.422 3.832 20 5 FHBDRN CCN(C[C@H](O)c1ccc(C)cc1)C(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000178099366 940665281 /nfs/dbraw/zinc/66/52/81/940665281.db2.gz DANWTCKAHJBVFJ-KRWDZBQOSA-N 0 0 362.813 3.752 20 5 FHBDRN Cc1ccc(NC(=O)N2CCO[C@@H](CCc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000582448032 940672277 /nfs/dbraw/zinc/67/22/77/940672277.db2.gz OJXROLROFCYVKA-SFHVURJKSA-N 0 0 369.421 3.769 20 5 FHBDRN CCOc1cc(OCC[C@@H]2Sc3ccccc3NC2=O)ccc1[N+](=O)[O-] ZINC000582498905 940675596 /nfs/dbraw/zinc/67/55/96/940675596.db2.gz ZXUAJCBKFQLRJY-KRWDZBQOSA-N 0 0 374.418 3.875 20 5 FHBDRN Cc1cnccc1C(=O)Nc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1 ZINC000472538738 940678149 /nfs/dbraw/zinc/67/81/49/940678149.db2.gz ZROKAFIASNKCGO-UHFFFAOYSA-N 0 0 361.357 3.782 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)S(=O)(=O)Cc1ccc(F)c(F)c1 ZINC000180136213 940679180 /nfs/dbraw/zinc/67/91/80/940679180.db2.gz YHIPDAJQNDEALC-LLVKDONJSA-N 0 0 355.362 3.857 20 5 FHBDRN COc1cc(C(=O)Nc2nc(-c3cccc(O)c3)cs2)ccc1[N+](=O)[O-] ZINC000173872955 940681107 /nfs/dbraw/zinc/68/11/07/940681107.db2.gz QHENYJGLFYNWCU-UHFFFAOYSA-N 0 0 371.374 3.685 20 5 FHBDRN Cc1c(NC(=O)[C@H](C)Nc2ccccc2OCCF)cccc1[N+](=O)[O-] ZINC000414156220 940684940 /nfs/dbraw/zinc/68/49/40/940684940.db2.gz PBRPBUKBBAGAGC-ZDUSSCGKSA-N 0 0 361.373 3.691 20 5 FHBDRN CCS[C@@H]1CCC[C@H]1NC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C ZINC000178127351 940696125 /nfs/dbraw/zinc/69/61/25/940696125.db2.gz XGPNCVBTNSJUOV-TZMCWYRMSA-N 0 0 367.427 3.524 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)S(=O)(=O)Cc1csc(C2CC2)n1 ZINC000180152597 940700750 /nfs/dbraw/zinc/70/07/50/940700750.db2.gz DITYIKLXXUKSKZ-LLVKDONJSA-N 0 0 366.464 3.913 20 5 FHBDRN Cc1cccc(NC(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000174144154 940705267 /nfs/dbraw/zinc/70/52/67/940705267.db2.gz MCEWWLMUQPKHOQ-UHFFFAOYSA-N 0 0 355.394 3.979 20 5 FHBDRN CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1CC=C(c2ccc(F)cc2)CC1 ZINC000178144623 940715862 /nfs/dbraw/zinc/71/58/62/940715862.db2.gz JKISIABNXLWHDN-UHFFFAOYSA-N 0 0 369.396 3.729 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)OCc2cccc(F)c2)cc1SC ZINC000728650113 940717909 /nfs/dbraw/zinc/71/79/09/940717909.db2.gz CYYHJCLNBMJSBR-UHFFFAOYSA-N 0 0 351.355 3.821 20 5 FHBDRN CCOc1cccc(CNC(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)c1 ZINC000582559164 940719877 /nfs/dbraw/zinc/71/98/77/940719877.db2.gz OAXLDYZFEPSVKM-UHFFFAOYSA-N 0 0 368.311 3.942 20 5 FHBDRN Cn1c(C(=O)Nc2cccc(Br)c2Cl)ccc1[N+](=O)[O-] ZINC000549026420 940740397 /nfs/dbraw/zinc/74/03/97/940740397.db2.gz BSQUTOUCAAONCG-UHFFFAOYSA-N 0 0 358.579 3.602 20 5 FHBDRN CC[C@@H](N[C@H](C)c1ncc(Br)cn1)c1cccc([N+](=O)[O-])c1 ZINC000582596352 940754114 /nfs/dbraw/zinc/75/41/14/940754114.db2.gz IJWUUYBOGORHCE-QMTHXVAHSA-N 0 0 365.231 3.949 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCC(C)(C)C(F)(F)F ZINC000549034972 940771857 /nfs/dbraw/zinc/77/18/57/940771857.db2.gz WFQRTLLYRQWNHM-SECBINFHSA-N 0 0 350.362 3.780 20 5 FHBDRN CCc1ccc([C@@H](NCc2ccn(CC)n2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000414211260 940774208 /nfs/dbraw/zinc/77/42/08/940774208.db2.gz PRTXWNLUYVSWAM-IBGZPJMESA-N 0 0 354.410 3.846 20 5 FHBDRN CN(CCOc1ccc(F)cc1)C(=O)c1cccc(Cl)c1[N+](=O)[O-] ZINC000175146314 940811210 /nfs/dbraw/zinc/81/12/10/940811210.db2.gz MDRUXEGCENPESC-UHFFFAOYSA-N 0 0 352.749 3.538 20 5 FHBDRN Nc1c(C(=O)Nc2ccc3nc(C4CC4)oc3c2)cc(F)cc1[N+](=O)[O-] ZINC000175120557 940813101 /nfs/dbraw/zinc/81/31/01/940813101.db2.gz MJOGTVPEBYMIBI-UHFFFAOYSA-N 0 0 356.313 3.587 20 5 FHBDRN COc1cccc(-c2nc(-c3ccnc(C(F)(F)F)c3)no2)c1[N+](=O)[O-] ZINC000582692383 940813444 /nfs/dbraw/zinc/81/34/44/940813444.db2.gz ZUOOBRRQUJIVBX-UHFFFAOYSA-N 0 0 366.255 3.734 20 5 FHBDRN CN(CC(=O)Nc1ccc(F)cc1C(F)(F)F)c1ccccc1[N+](=O)[O-] ZINC000175187088 940824832 /nfs/dbraw/zinc/82/48/32/940824832.db2.gz XOTWUSNUEFHBSV-UHFFFAOYSA-N 0 0 371.290 3.828 20 5 FHBDRN CCS[C@H]1CCCC[C@@H]1NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000175257105 940832546 /nfs/dbraw/zinc/83/25/46/940832546.db2.gz OVOZGLNLOGSSNG-IRXDYDNUSA-N 0 0 374.466 3.575 20 5 FHBDRN C[C@H](NS(=O)(=O)Cc1ccccc1[N+](=O)[O-])c1ccc2c(c1)CCCC2 ZINC000472567527 940845394 /nfs/dbraw/zinc/84/53/94/940845394.db2.gz COFGJHQCGSRCFR-AWEZNQCLSA-N 0 0 374.462 3.654 20 5 FHBDRN O=C(N[C@@H]1CCO[C@H]1c1ccc(Cl)c(F)c1)c1ccccc1[N+](=O)[O-] ZINC000180241916 940853106 /nfs/dbraw/zinc/85/31/06/940853106.db2.gz RZNMNMAIURXJRL-ZBFHGGJFSA-N 0 0 364.760 3.647 20 5 FHBDRN Cc1cn2c(nc(C)c2-c2noc(COc3ccccc3[N+](=O)[O-])n2)s1 ZINC000426618315 945356182 /nfs/dbraw/zinc/35/61/82/945356182.db2.gz DYMZNIYHLGDABW-UHFFFAOYSA-N 0 0 371.378 3.550 20 5 FHBDRN CC(=O)c1cc(N2CCC(O)(Cc3ccc(C)cc3)CC2)ccc1[N+](=O)[O-] ZINC000376384851 940888085 /nfs/dbraw/zinc/88/80/85/940888085.db2.gz REFMKVNDOBRUFV-UHFFFAOYSA-N 0 0 368.433 3.680 20 5 FHBDRN CC1(C[S@](=O)CCC(=O)Nc2ccccc2[N+](=O)[O-])CCCCC1 ZINC000414289479 940904391 /nfs/dbraw/zinc/90/43/91/940904391.db2.gz VZBUOPNQUYIXMS-XMMPIXPASA-N 0 0 352.456 3.643 20 5 FHBDRN CC1(C[S@@](=O)CCC(=O)Nc2ccccc2[N+](=O)[O-])CCCCC1 ZINC000414289476 940904485 /nfs/dbraw/zinc/90/44/85/940904485.db2.gz VZBUOPNQUYIXMS-DEOSSOPVSA-N 0 0 352.456 3.643 20 5 FHBDRN Cc1cccnc1COC(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000180281034 940916719 /nfs/dbraw/zinc/91/67/19/940916719.db2.gz XBCHSQUMFFRRNP-UHFFFAOYSA-N 0 0 358.397 3.602 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)OCc2cccc(F)c2F)cc1SC ZINC000728657920 940921267 /nfs/dbraw/zinc/92/12/67/940921267.db2.gz RYZYWPRRRBIZBQ-UHFFFAOYSA-N 0 0 369.345 3.961 20 5 FHBDRN Cc1nc2c(cccc2C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)[nH]1 ZINC000549059857 940927018 /nfs/dbraw/zinc/92/70/18/940927018.db2.gz JRCVOJUGXTZTPM-UHFFFAOYSA-N 0 0 352.394 3.532 20 5 FHBDRN Cn1cc(-c2cccc(CNc3ncnc4sc([N+](=O)[O-])cc43)c2)cn1 ZINC000376406764 940929191 /nfs/dbraw/zinc/92/91/91/940929191.db2.gz KDPXXGCMBIHETO-UHFFFAOYSA-N 0 0 366.406 3.612 20 5 FHBDRN C[C@@H]1c2ccccc2CCN1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000170954465 940930253 /nfs/dbraw/zinc/93/02/53/940930253.db2.gz LFFUVCMDIOHRAV-CYBMUJFWSA-N 0 0 350.378 3.764 20 5 FHBDRN COc1cccc(-c2nnc(NCc3ccc([N+](=O)[O-])cc3C)o2)c1OC ZINC000186044721 940942769 /nfs/dbraw/zinc/94/27/69/940942769.db2.gz MRRUSFXVVADAMP-UHFFFAOYSA-N 0 0 370.365 3.583 20 5 FHBDRN O=C1CC[C@@H](c2cccc(N[C@H](Cc3ccccc3[N+](=O)[O-])C3CC3)c2)N1 ZINC000414313138 940945653 /nfs/dbraw/zinc/94/56/53/940945653.db2.gz KBHUIDMYQNLWOF-RBUKOAKNSA-N 0 0 365.433 3.979 20 5 FHBDRN CSCc1ccccc1NC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000186131946 940947479 /nfs/dbraw/zinc/94/74/79/940947479.db2.gz XQXDDSNYDNIJRH-UHFFFAOYSA-N 0 0 368.418 3.896 20 5 FHBDRN CC1(C)C[C@H](Nc2cccc(O[C@H]3CC(=O)N3)c2)c2cc([N+](=O)[O-])ccc21 ZINC000414318035 940958597 /nfs/dbraw/zinc/95/85/97/940958597.db2.gz LIMNBUBAQOIJIT-HKUYNNGSSA-N 0 0 367.405 3.654 20 5 FHBDRN COC(=O)[C@@H](C)Cc1ccc(NC(=O)c2cc([N+](=O)[O-])c(C)s2)cc1 ZINC000186239671 940963779 /nfs/dbraw/zinc/96/37/79/940963779.db2.gz TZVPHMONKKTKJG-JTQLQIEISA-N 0 0 362.407 3.569 20 5 FHBDRN C[C@@H](NC(=O)CCc1cn(C)c2ccccc12)c1cccc([N+](=O)[O-])c1 ZINC000175961983 940964877 /nfs/dbraw/zinc/96/48/77/940964877.db2.gz OGXPJTVYEGLUQW-CQSZACIVSA-N 0 0 351.406 3.897 20 5 FHBDRN C[C@@H](NCc1nc(-c2ccc(F)c(F)c2)no1)c1cccc([N+](=O)[O-])c1 ZINC000180407520 941005945 /nfs/dbraw/zinc/00/59/45/941005945.db2.gz WBUQKLNPBRWMFJ-SNVBAGLBSA-N 0 0 360.320 3.774 20 5 FHBDRN COc1ccc(-c2noc(CN[C@@H](C)c3cccc([N+](=O)[O-])c3)n2)cc1 ZINC000180442984 941014948 /nfs/dbraw/zinc/01/49/48/941014948.db2.gz BHCQRMIMNIQBHR-LBPRGKRZSA-N 0 0 354.366 3.504 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCN(c2cccc(Cl)c2)C1 ZINC000176312578 941018295 /nfs/dbraw/zinc/01/82/95/941018295.db2.gz IPPJIRRICIJZMT-AWEZNQCLSA-N 0 0 359.813 3.565 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCS[C@@H]4COCC[C@@H]43)o2)cc1 ZINC000180454529 941022815 /nfs/dbraw/zinc/02/28/15/941022815.db2.gz ZASZDWAABGYXCU-FUHWJXTLSA-N 0 0 360.435 3.561 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)[C@H]1Cc2ccccc2O1 ZINC000180467389 941023833 /nfs/dbraw/zinc/02/38/33/941023833.db2.gz ONQBYDVYBUBAEZ-CQSZACIVSA-N 0 0 352.268 3.556 20 5 FHBDRN O=C(c1cc2c(cc1[N+](=O)[O-])OCCO2)N1CCCC2(CCCCC2)C1 ZINC000408127236 945368569 /nfs/dbraw/zinc/36/85/69/945368569.db2.gz CDXCGOMACYDYLS-UHFFFAOYSA-N 0 0 360.410 3.553 20 5 FHBDRN Cc1c(C(=O)N2CC[C@H](OCCCc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000176339493 941027832 /nfs/dbraw/zinc/02/78/32/941027832.db2.gz DDLNAOZODTXNCQ-SFHVURJKSA-N 0 0 368.433 3.767 20 5 FHBDRN CCOC(=O)c1cc(C(=O)N([C@@H](C)CC)[C@@H](C)CC)cc([N+](=O)[O-])c1 ZINC000180515933 941039491 /nfs/dbraw/zinc/03/94/91/941039491.db2.gz YPKHKQPFYSODFQ-STQMWFEESA-N 0 0 350.415 3.811 20 5 FHBDRN CCOC(=O)c1cc(C(=O)N([C@H](C)CC)[C@@H](C)CC)cc([N+](=O)[O-])c1 ZINC000180515917 941039608 /nfs/dbraw/zinc/03/96/08/941039608.db2.gz YPKHKQPFYSODFQ-BETUJISGSA-N 0 0 350.415 3.811 20 5 FHBDRN CCOC(=O)c1cc(C(=O)N([C@H](C)CC)[C@H](C)CC)cc([N+](=O)[O-])c1 ZINC000180515951 941039675 /nfs/dbraw/zinc/03/96/75/941039675.db2.gz YPKHKQPFYSODFQ-CHWSQXEVSA-N 0 0 350.415 3.811 20 5 FHBDRN COc1cccc([C@@H]2C[C@H]2C(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000176505803 941053859 /nfs/dbraw/zinc/05/38/59/941053859.db2.gz WSZVPWDGFKSOFH-ZWKOTPCHSA-N 0 0 354.406 3.758 20 5 FHBDRN COC(=O)[C@H](NCc1ccccc1[N+](=O)[O-])c1cccc(Cl)c1Cl ZINC000180614773 941055548 /nfs/dbraw/zinc/05/55/48/941055548.db2.gz KRZFWSNIGVJPKR-OAHLLOKOSA-N 0 0 369.204 3.906 20 5 FHBDRN O=C(CSCC(F)(F)F)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC000180625993 941057331 /nfs/dbraw/zinc/05/73/31/941057331.db2.gz MKQCFWCSIUIYJQ-UHFFFAOYSA-N 0 0 373.150 3.591 20 5 FHBDRN CCOc1cc(C(=O)N2CCc3c2cccc3[N+](=O)[O-])cc(Cl)c1O ZINC000186822905 941057927 /nfs/dbraw/zinc/05/79/27/941057927.db2.gz OYWWEZGSHNQFKQ-UHFFFAOYSA-N 0 0 362.769 3.555 20 5 FHBDRN Cc1ccc(-c2csc(NC(=O)CC[C@H]3CCOC3)n2)cc1[N+](=O)[O-] ZINC000176603249 941063504 /nfs/dbraw/zinc/06/35/04/941063504.db2.gz WXPFSFCAOYHUCD-LBPRGKRZSA-N 0 0 361.423 3.782 20 5 FHBDRN COc1ccc(CSCC(=O)N[C@@H]2CC23CCCCC3)cc1[N+](=O)[O-] ZINC000180715080 941066563 /nfs/dbraw/zinc/06/65/63/941066563.db2.gz FPFHJHJLJSYCKU-MRXNPFEDSA-N 0 0 364.467 3.676 20 5 FHBDRN C[C@@H](Cc1ccc(Cl)cc1Cl)NC(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000180732965 941069909 /nfs/dbraw/zinc/06/99/09/941069909.db2.gz VKNQNYFXXHVKNM-VIFPVBQESA-N 0 0 368.220 3.845 20 5 FHBDRN Cc1nc(-c2ccccc2)sc1CNC(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000180746212 941071516 /nfs/dbraw/zinc/07/15/16/941071516.db2.gz ITXJDUKMBNXVIR-UHFFFAOYSA-N 0 0 368.418 3.539 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1)C(=O)N[C@H](CC1CCC1)c1ccccc1 ZINC000180743654 941071649 /nfs/dbraw/zinc/07/16/49/941071649.db2.gz NYLJBWOOHURYOI-GOSISDBHSA-N 0 0 367.405 3.581 20 5 FHBDRN Cc1cc(CCNC(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)cc(C)c1O ZINC000188738757 941072471 /nfs/dbraw/zinc/07/24/71/941072471.db2.gz YJIQAPNTSKHLGL-CYBMUJFWSA-N 0 0 360.385 3.519 20 5 FHBDRN COC1(C(=O)Nc2nccc3c2cccc3[N+](=O)[O-])CCC(F)(F)CC1 ZINC000892649206 941075121 /nfs/dbraw/zinc/07/51/21/941075121.db2.gz SNVKQFFMCRUTQY-UHFFFAOYSA-N 0 0 365.336 3.676 20 5 FHBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N(CC1CC1)c1ccccc1 ZINC000176772941 941076061 /nfs/dbraw/zinc/07/60/61/941076061.db2.gz UGLCJPGWJFNRPS-UHFFFAOYSA-N 0 0 366.826 3.854 20 5 FHBDRN CO[C@@H]1CC[C@@H]2OCCN(Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)[C@@H]2C1 ZINC000180813673 941080548 /nfs/dbraw/zinc/08/05/48/941080548.db2.gz OQDPGHFAPPXYBZ-POAQFYNOSA-N 0 0 372.421 3.623 20 5 FHBDRN COc1cc(C(=O)Nc2cccc(OC(F)F)c2)cc([N+](=O)[O-])c1C ZINC000188774231 941082575 /nfs/dbraw/zinc/08/25/75/941082575.db2.gz YBEIEKZWNYRVNU-UHFFFAOYSA-N 0 0 352.293 3.766 20 5 FHBDRN CC(C)CNc1nnc(SCc2nc3cc([N+](=O)[O-])ccc3o2)s1 ZINC000176935806 941086204 /nfs/dbraw/zinc/08/62/04/941086204.db2.gz JDDMWMYSDSELRL-UHFFFAOYSA-N 0 0 365.440 3.948 20 5 FHBDRN CN(C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2)c1cccc2ccccc21 ZINC000180906554 941089940 /nfs/dbraw/zinc/08/99/40/941089940.db2.gz HZFHUFCUTRIFGL-UHFFFAOYSA-N 0 0 350.330 3.753 20 5 FHBDRN CC(C)(C)c1nc2cc(NC(=O)c3c(N)cccc3[N+](=O)[O-])ccc2[nH]1 ZINC000180897229 941090406 /nfs/dbraw/zinc/09/04/06/941090406.db2.gz QSTTYIYPIYBFSB-UHFFFAOYSA-N 0 0 353.382 3.603 20 5 FHBDRN C[C@@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1F)c1nc2c(s1)CCC2 ZINC000414394368 941091358 /nfs/dbraw/zinc/09/13/58/941091358.db2.gz BCQBDRAZGLVYKL-MRVPVSSYSA-N 0 0 350.375 3.562 20 5 FHBDRN Cc1coc(-c2cc(NC(=O)c3c(N)cccc3[N+](=O)[O-])ccc2C)n1 ZINC000181210958 941110867 /nfs/dbraw/zinc/11/08/67/941110867.db2.gz NOBROXKMHXGYQT-UHFFFAOYSA-N 0 0 352.350 3.701 20 5 FHBDRN CCOc1cc(N[C@H](CC(N)=O)c2cccc(Cl)c2)ccc1[N+](=O)[O-] ZINC000181209661 941110923 /nfs/dbraw/zinc/11/09/23/941110923.db2.gz GJBNLRWAWRNLMA-CQSZACIVSA-N 0 0 363.801 3.676 20 5 FHBDRN O=C(Nc1ccc(OCc2ccccc2)cc1[N+](=O)[O-])c1cccc(F)n1 ZINC000782848547 941111286 /nfs/dbraw/zinc/11/12/86/941111286.db2.gz DVLHSJZVLBXFQK-UHFFFAOYSA-N 0 0 367.336 3.960 20 5 FHBDRN C[C@@H](Cc1ccccc1C(F)(F)F)NC(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000181202342 941112732 /nfs/dbraw/zinc/11/27/32/941112732.db2.gz QNONSUYMBMXISU-LBPRGKRZSA-N 0 0 366.339 3.904 20 5 FHBDRN Nc1cccc([N+](=O)[O-])c1C(=O)N1CCc2c(Cl)cc(Cl)cc2C1 ZINC000181219673 941114586 /nfs/dbraw/zinc/11/45/86/941114586.db2.gz VETPFIGMFRKBQN-UHFFFAOYSA-N 0 0 366.204 3.682 20 5 FHBDRN CC[C@H](CSC)NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000181249537 941115823 /nfs/dbraw/zinc/11/58/23/941115823.db2.gz SGHDTLAQDQDAFX-LLVKDONJSA-N 0 0 351.453 3.590 20 5 FHBDRN Cn1c2ccc(NC(=O)c3c(N)cccc3[N+](=O)[O-])cc2nc1C(C)(C)C ZINC000181271651 941118950 /nfs/dbraw/zinc/11/89/50/941118950.db2.gz PFBNXCJRHNQXLD-UHFFFAOYSA-N 0 0 367.409 3.614 20 5 FHBDRN Nc1ccc([N+](=O)[O-])cc1C(=O)N1CC=C(c2c[nH]c3ccccc32)CC1 ZINC000188847921 941119575 /nfs/dbraw/zinc/11/95/75/941119575.db2.gz NUEGDVVWJPZLSQ-UHFFFAOYSA-N 0 0 362.389 3.588 20 5 FHBDRN COc1cccc2[nH]cc(CC(=O)N[C@H](C)c3ccc(C)c([N+](=O)[O-])c3)c21 ZINC000181301107 941120492 /nfs/dbraw/zinc/12/04/92/941120492.db2.gz WRYJPDXDZMBOCJ-CYBMUJFWSA-N 0 0 367.405 3.813 20 5 FHBDRN Cc1c(C(=O)OCc2cnc(-c3ccc([N+](=O)[O-])cc3)o2)cnn1C(C)C ZINC000181297092 941120647 /nfs/dbraw/zinc/12/06/47/941120647.db2.gz OYGBLSZDWZQEGT-UHFFFAOYSA-N 0 0 370.365 3.693 20 5 FHBDRN Cc1cc(N2CCC(n3cccn3)CC2)c(Br)cc1[N+](=O)[O-] ZINC000302648816 941124241 /nfs/dbraw/zinc/12/42/41/941124241.db2.gz GEXOPXQYVYDIHW-UHFFFAOYSA-N 0 0 365.231 3.704 20 5 FHBDRN CCCc1[nH]nc(C(=O)Nc2ccc3cccc(Cl)c3n2)c1[N+](=O)[O-] ZINC000181339500 941124988 /nfs/dbraw/zinc/12/49/88/941124988.db2.gz OVWOIFHTXJMEGQ-UHFFFAOYSA-N 0 0 359.773 3.724 20 5 FHBDRN C[C@H](Oc1ccc2c(c1)CCC2)C(=O)OCc1ccc([N+](=O)[O-])c(F)c1 ZINC000782861096 941131860 /nfs/dbraw/zinc/13/18/60/941131860.db2.gz KIFFZXIVTFJZCB-LBPRGKRZSA-N 0 0 359.353 3.733 20 5 FHBDRN O=C(COCC1CC1)Nc1ccc(OCc2ccccc2)cc1[N+](=O)[O-] ZINC000188960111 941134114 /nfs/dbraw/zinc/13/41/14/941134114.db2.gz YHPGYQMONFTWPC-UHFFFAOYSA-N 0 0 356.378 3.539 20 5 FHBDRN O=C(CC[C@@H]1CCOC1)Nc1ccc(OCc2ccccc2)cc1[N+](=O)[O-] ZINC000188969907 941135399 /nfs/dbraw/zinc/13/53/99/941135399.db2.gz ITUNDFWDRJFNJX-MRXNPFEDSA-N 0 0 370.405 3.929 20 5 FHBDRN COc1cc(C(=O)Nc2ccc(OC(F)F)c(F)c2)cc([N+](=O)[O-])c1C ZINC000189003671 941143039 /nfs/dbraw/zinc/14/30/39/941143039.db2.gz OIBQNCDGLFYRQA-UHFFFAOYSA-N 0 0 370.283 3.905 20 5 FHBDRN CSc1cccc(C(=O)N[C@H](C)CCc2ccc(O)cc2)c1[N+](=O)[O-] ZINC000189004649 941143070 /nfs/dbraw/zinc/14/30/70/941143070.db2.gz MIKPECAYQYOSNG-GFCCVEGCSA-N 0 0 360.435 3.773 20 5 FHBDRN C[C@@H](C(=O)NCc1ccc(OC2CCCC2)nc1)c1cccc([N+](=O)[O-])c1 ZINC000583180714 941143357 /nfs/dbraw/zinc/14/33/57/941143357.db2.gz RUUPCUQXHNNLCU-CQSZACIVSA-N 0 0 369.421 3.731 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CCO[C@H](c2cccc(F)c2)C1 ZINC000066694586 941143939 /nfs/dbraw/zinc/14/39/39/941143939.db2.gz HROPBRUQHVOXAC-INIZCTEOSA-N 0 0 364.760 3.601 20 5 FHBDRN O=[N+]([O-])c1ccc(CN(Cc2nc(-c3ccccc3F)no2)C2CC2)cc1 ZINC000189143859 941147658 /nfs/dbraw/zinc/14/76/58/941147658.db2.gz BZTKODIUFOASKR-UHFFFAOYSA-N 0 0 368.368 3.949 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)NC[C@H](C)c1ccc(C(F)(F)F)cc1 ZINC000189163985 941148093 /nfs/dbraw/zinc/14/80/93/941148093.db2.gz CIYFTTXZNJKILD-JTQLQIEISA-N 0 0 367.327 3.851 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N(C)[C@@H](C)c1cnn(C)c1 ZINC000189172069 941149557 /nfs/dbraw/zinc/14/95/57/941149557.db2.gz KXSMWBPKBFADCK-LBPRGKRZSA-N 0 0 362.455 3.662 20 5 FHBDRN CCCc1[nH]nc(C(=O)Nc2cc(C)cc(Br)c2)c1[N+](=O)[O-] ZINC000189214035 941153506 /nfs/dbraw/zinc/15/35/06/941153506.db2.gz ANHPWGGBYZRGKY-UHFFFAOYSA-N 0 0 367.203 3.594 20 5 FHBDRN O=C(Nc1ccc(Cl)cc1F)c1cc([N+](=O)[O-])ccc1SCCO ZINC000136058755 941154962 /nfs/dbraw/zinc/15/49/62/941154962.db2.gz VLSHOOOQRLMFOC-UHFFFAOYSA-N 0 0 370.789 3.724 20 5 FHBDRN Cc1nc(NC(=O)[C@@H](C)Oc2ccc(C(F)(F)F)cc2)ccc1[N+](=O)[O-] ZINC000189293960 941155495 /nfs/dbraw/zinc/15/54/95/941155495.db2.gz HIQZUGBEUJDKRC-SNVBAGLBSA-N 0 0 369.299 3.723 20 5 FHBDRN COc1cc(C(=O)Nc2ccc(F)cc2NC2CC2)cc([N+](=O)[O-])c1C ZINC000189324570 941156067 /nfs/dbraw/zinc/15/60/67/941156067.db2.gz APVBJXKZOQBEQY-UHFFFAOYSA-N 0 0 359.357 3.878 20 5 FHBDRN O=[N+]([O-])c1ccc(OC[C@@H](O)CC(F)(F)F)c(Cc2ccccc2)c1 ZINC000189411284 941157310 /nfs/dbraw/zinc/15/73/10/941157310.db2.gz SKSTXDBMTZBGHT-HNNXBMFYSA-N 0 0 355.312 3.878 20 5 FHBDRN COc1cc(NC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)ccc1F ZINC000189421152 941157364 /nfs/dbraw/zinc/15/73/64/941157364.db2.gz AWJLRQJLWZBHNS-JTQLQIEISA-N 0 0 350.371 3.862 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@H]1CCO[C@H]1c1ccccc1 ZINC000189357178 941157538 /nfs/dbraw/zinc/15/75/38/941157538.db2.gz QCBAKFFEYBGVOY-KSSFIOAISA-N 0 0 371.393 3.503 20 5 FHBDRN COc1cccc(C(=O)Nc2cc3c(cc2Cl)CCC3=O)c1[N+](=O)[O-] ZINC000435970489 941158390 /nfs/dbraw/zinc/15/83/90/941158390.db2.gz IYOUVVDBMHZGJL-UHFFFAOYSA-N 0 0 360.753 3.638 20 5 FHBDRN COC[C@@H](Cc1ccccc1)N(C)C(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000189473043 941158537 /nfs/dbraw/zinc/15/85/37/941158537.db2.gz MMAUDYWEULLDMH-QGZVFWFLSA-N 0 0 357.410 3.625 20 5 FHBDRN COc1cc(C(=O)NCC[C@H](C)CC(C)(C)C)c([N+](=O)[O-])cc1OC ZINC000189474688 941158711 /nfs/dbraw/zinc/15/87/11/941158711.db2.gz MKQRHFIWHRORFT-LBPRGKRZSA-N 0 0 352.431 3.804 20 5 FHBDRN COC[C@H](Cc1ccccc1)N(C)C(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000189498409 941159246 /nfs/dbraw/zinc/15/92/46/941159246.db2.gz IPGZXGSGUJPNRX-KRWDZBQOSA-N 0 0 362.813 3.578 20 5 FHBDRN CCn1c(-c2ccc([N+](=O)[O-])cc2)nnc1N(C)Cc1ccc(OC)cc1 ZINC000549099545 941159803 /nfs/dbraw/zinc/15/98/03/941159803.db2.gz HCXBPIXDZILKSG-UHFFFAOYSA-N 0 0 367.409 3.518 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2nc(CSc3nccn4ccnc34)co2)cc1 ZINC000189436864 941159834 /nfs/dbraw/zinc/15/98/34/941159834.db2.gz FZZNPCNLXKAJHW-UHFFFAOYSA-N 0 0 353.363 3.585 20 5 FHBDRN COc1ccc(NC(=O)COc2cc(Cl)ccc2Cl)cc1[N+](=O)[O-] ZINC000541067355 941160468 /nfs/dbraw/zinc/16/04/68/941160468.db2.gz YIGMVLAAHBMOQF-UHFFFAOYSA-N 0 0 371.176 3.928 20 5 FHBDRN CSc1cccc(C(=O)N[C@@H]2CCOc3c(C)cccc32)c1[N+](=O)[O-] ZINC000189602066 941214492 /nfs/dbraw/zinc/21/44/92/941214492.db2.gz ZNOHUXMHEGKQDV-CQSZACIVSA-N 0 0 358.419 3.879 20 5 FHBDRN O=C(Nc1ncccc1-c1ccccc1)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000181425397 941218424 /nfs/dbraw/zinc/21/84/24/941218424.db2.gz ZHGBNRYQGVKYQQ-UHFFFAOYSA-N 0 0 363.329 3.638 20 5 FHBDRN CCn1c(SCCOc2ccccc2[N+](=O)[O-])nnc1-c1ccco1 ZINC000053144890 941245118 /nfs/dbraw/zinc/24/51/18/941245118.db2.gz UAMBHYOHJXRXJC-UHFFFAOYSA-N 0 0 360.395 3.637 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)Nc1cccc(-c2cc[nH]n2)c1 ZINC000376586863 941253686 /nfs/dbraw/zinc/25/36/86/941253686.db2.gz YGHFOZWBXHGTJV-UHFFFAOYSA-N 0 0 365.393 3.691 20 5 FHBDRN Cc1ccc(C(=O)N2C[C@]3(C[C@@H]4CC[C@H]3C4)OC(C)(C)C2)cc1[N+](=O)[O-] ZINC000407975501 941254128 /nfs/dbraw/zinc/25/41/28/941254128.db2.gz WWLULRLDFJZFQI-IIMJZQEZSA-N 0 0 358.438 3.713 20 5 FHBDRN COc1ccc(F)cc1[C@@H](C)NC(=O)C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000431833458 941262358 /nfs/dbraw/zinc/26/23/58/941262358.db2.gz OQIVNJZVDPHUCV-GFCCVEGCSA-N 0 0 360.385 3.898 20 5 FHBDRN C[C@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl)c1ccc(Cl)cn1 ZINC000189734773 941270629 /nfs/dbraw/zinc/27/06/29/941270629.db2.gz ORABFQDUGSJQBP-VIFPVBQESA-N 0 0 354.193 3.717 20 5 FHBDRN Cc1cnc([C@H](NC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)C2CC2)s1 ZINC000549106316 941285888 /nfs/dbraw/zinc/28/58/88/941285888.db2.gz SCPLBELZGHNATP-MRXNPFEDSA-N 0 0 374.466 3.695 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@H](C)Oc2c(Cl)cccc21 ZINC000189853818 941290705 /nfs/dbraw/zinc/29/07/05/941290705.db2.gz UNUFUCUODKRGPF-JTQLQIEISA-N 0 0 362.769 3.685 20 5 FHBDRN CC(C)c1ccc(C(=O)N[C@H](C[S@@](C)=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000189918663 941303359 /nfs/dbraw/zinc/30/33/59/941303359.db2.gz FIVMKZZBMMCMRH-WGDIFIGCSA-N 0 0 374.462 3.568 20 5 FHBDRN Cc1ccc(NC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])c(C)c1O ZINC000178794274 941304973 /nfs/dbraw/zinc/30/49/73/941304973.db2.gz DEQOUBDPHWUXKY-UHFFFAOYSA-N 0 0 364.785 3.978 20 5 FHBDRN Cc1ccc(C(=O)N(C)Cc2ccccc2[N+](=O)[O-])c(Br)c1 ZINC000178803577 941307783 /nfs/dbraw/zinc/30/77/83/941307783.db2.gz YUPAXQRFKQUQIS-UHFFFAOYSA-N 0 0 363.211 3.938 20 5 FHBDRN CSc1ccc(C(=O)N2CC3(CCCC3)OC(C)(C)C2)cc1[N+](=O)[O-] ZINC000189955443 941313069 /nfs/dbraw/zinc/31/30/69/941313069.db2.gz FFWSIQPJFDIZQU-UHFFFAOYSA-N 0 0 364.467 3.881 20 5 FHBDRN O=C(NCc1cc(F)cc(F)c1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000178846312 941313706 /nfs/dbraw/zinc/31/37/06/941313706.db2.gz RWFWCPDUABHUNP-UHFFFAOYSA-N 0 0 361.348 3.747 20 5 FHBDRN Cc1ccc(C(=O)OCc2nc(-c3cccc([N+](=O)[O-])c3)no2)cc1Cl ZINC000728673589 941319386 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3.506 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)N2CCCC[C@@H]2c2cc[nH]n2)cc1[N+](=O)[O-] ZINC000376699851 941383706 /nfs/dbraw/zinc/38/37/06/941383706.db2.gz KPUSYTUZPWUTCP-CZUORRHYSA-N 0 0 357.414 3.624 20 5 FHBDRN COc1cc(C(=O)N(C)Cc2cc(F)c(F)c(F)c2)cc([N+](=O)[O-])c1C ZINC000190042127 941408068 /nfs/dbraw/zinc/40/80/68/941408068.db2.gz RGQCVNJVXFVEQV-UHFFFAOYSA-N 0 0 368.311 3.601 20 5 FHBDRN O=C([O-])[C@@H]1CCC[N@H+](Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)C1 ZINC000414678908 941434701 /nfs/dbraw/zinc/43/47/01/941434701.db2.gz JXWAGXAQKROHKR-CQSZACIVSA-N 0 0 374.368 3.823 20 5 FHBDRN CN(c1ccccc1)c1ccc(C[N@@H+]2CCC[C@@H](C(=O)[O-])C2)cc1[N+](=O)[O-] ZINC000414672727 941436869 /nfs/dbraw/zinc/43/68/69/941436869.db2.gz CKHUYWAUYAWILO-MRXNPFEDSA-N 0 0 369.421 3.659 20 5 FHBDRN Cc1c(NC(=O)N2CCC(c3cccc(N)c3)CC2)cccc1[N+](=O)[O-] ZINC000414717085 941448158 /nfs/dbraw/zinc/44/81/58/941448158.db2.gz XOSXTTPIEOCJPO-UHFFFAOYSA-N 0 0 354.410 3.897 20 5 FHBDRN O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)N1CCC([C@H]2CCOC2)CC1 ZINC000376864186 941454692 /nfs/dbraw/zinc/45/46/92/941454692.db2.gz LEGWVBOHDOTIKM-LBPRGKRZSA-N 0 0 353.806 3.529 20 5 FHBDRN C[C@@H](C(=O)N1CC=C(c2cccnc2)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000376892133 941460851 /nfs/dbraw/zinc/46/08/51/941460851.db2.gz HXYAXUJZPYGZNE-CYBMUJFWSA-N 0 0 355.369 3.548 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@@H](C[C@@H]2CCOC2)C1 ZINC000376948888 941474879 /nfs/dbraw/zinc/47/48/79/941474879.db2.gz MPFJRTSXVUEWBK-GBESFXJTSA-N 0 0 374.481 3.829 20 5 FHBDRN CCOc1cc(NC(=O)Cc2c(C)nn(C(C)C)c2C)ccc1[N+](=O)[O-] ZINC000892738636 941501531 /nfs/dbraw/zinc/50/15/31/941501531.db2.gz BEDLTMPTHWROMA-UHFFFAOYSA-N 0 0 360.414 3.569 20 5 FHBDRN Cc1nnc([C@@H](C)NC(=O)c2cc([N+](=O)[O-])ccc2SC(C)C)s1 ZINC000545352735 941504243 /nfs/dbraw/zinc/50/42/43/941504243.db2.gz GIMXHRXULYTJON-SECBINFHSA-N 0 0 366.468 3.746 20 5 FHBDRN COC(=O)c1cc(NC(=O)[C@H]2CCC[C@@H](C(F)(F)F)C2)cc([N+](=O)[O-])c1 ZINC000136148171 941529509 /nfs/dbraw/zinc/52/95/09/941529509.db2.gz LHAKSKDKPULANL-GXSJLCMTSA-N 0 0 374.315 3.689 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1F)Nc1ccc(Cl)cc1-n1cccn1 ZINC000472674082 941539684 /nfs/dbraw/zinc/53/96/84/941539684.db2.gz MWXXCMDHQFSQMX-UHFFFAOYSA-N 0 0 374.759 3.754 20 5 FHBDRN CCC[C@@]1(CO)CC[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000290264403 941560120 /nfs/dbraw/zinc/56/01/20/941560120.db2.gz XCTHQADPHNTYPS-GOSISDBHSA-N 0 0 361.467 3.703 20 5 FHBDRN CC(C)CC[C@@H]1CCCCN1C(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000472700963 941596205 /nfs/dbraw/zinc/59/62/05/941596205.db2.gz RSKPVPOJYXRACS-HNNXBMFYSA-N 0 0 371.441 3.606 20 5 FHBDRN C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1SC1CCCC1)[C@H]1CCOC1 ZINC000158969819 941596407 /nfs/dbraw/zinc/59/64/07/941596407.db2.gz UVHQJGCVUIFISQ-OLZOCXBDSA-N 0 0 364.467 3.784 20 5 FHBDRN CN(C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCCc2cccnc21 ZINC000377257951 941598634 /nfs/dbraw/zinc/59/86/34/941598634.db2.gz QCXYDMWSGSWSCO-OAHLLOKOSA-N 0 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3.590 20 5 FHBDRN Cc1cc(NCCCS(=O)(=O)c2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000549286272 941840889 /nfs/dbraw/zinc/84/08/89/941840889.db2.gz TWPVHWTUDHVUPE-UHFFFAOYSA-N 0 0 368.842 3.833 20 5 FHBDRN CCCN(CCC)C(=O)CCC(=O)Nc1cc([N+](=O)[O-])c(Cl)cc1C ZINC000118687480 941842257 /nfs/dbraw/zinc/84/22/57/941842257.db2.gz RPFWEVVUARFVCX-UHFFFAOYSA-N 0 0 369.849 3.924 20 5 FHBDRN CCO[C@@H]1C[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)C12CCCC2 ZINC000412149528 941845757 /nfs/dbraw/zinc/84/57/57/941845757.db2.gz JUOIYFLKZCKDSS-BSDSXHPESA-N 0 0 358.438 3.552 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N(C)c1cc(OC)cc(OC)c1 ZINC000190083340 941853515 /nfs/dbraw/zinc/85/35/15/941853515.db2.gz VSCYHFVCGXOLBV-HNNXBMFYSA-N 0 0 372.421 3.844 20 5 FHBDRN C[C@@H](CNC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1F ZINC000412164071 941856900 /nfs/dbraw/zinc/85/69/00/941856900.db2.gz VXNHMWPIJNLIOW-MZPVMMEZSA-N 0 0 360.360 3.896 20 5 FHBDRN COC(=O)c1cccc(COc2cc(OC)ccc2[N+](=O)[O-])c1Cl ZINC000381930343 941858468 /nfs/dbraw/zinc/85/84/68/941858468.db2.gz PJHXWJWFLYZNFP-UHFFFAOYSA-N 0 0 351.742 3.622 20 5 FHBDRN C[C@H]1CN(C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)[C@H](c2ccccc2)CO1 ZINC000412178381 941860612 /nfs/dbraw/zinc/86/06/12/941860612.db2.gz WIEYJOFIFSPALI-GAZPGATBSA-N 0 0 366.417 3.687 20 5 FHBDRN CC(C)[C@H](CNC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)c1cccnc1 ZINC000412171948 941861663 /nfs/dbraw/zinc/86/16/63/941861663.db2.gz FLIAQQQAGOTLSE-OTWHNJEPSA-N 0 0 353.422 3.649 20 5 FHBDRN CCOC(=O)c1cc(C(=O)N2CCC[C@H](C(C)C)CC2)cc([N+](=O)[O-])c1 ZINC000513349818 941861748 /nfs/dbraw/zinc/86/17/48/941861748.db2.gz CNIMLOJLZYOQPF-AWEZNQCLSA-N 0 0 362.426 3.670 20 5 FHBDRN CCOC(=O)c1cc(C(=O)N2CCC[C@@H](C(C)C)CC2)cc([N+](=O)[O-])c1 ZINC000513349819 941861924 /nfs/dbraw/zinc/86/19/24/941861924.db2.gz CNIMLOJLZYOQPF-CQSZACIVSA-N 0 0 362.426 3.670 20 5 FHBDRN CCS[C@H]1CCC[C@H]1NC(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1 ZINC000412174257 941863276 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941890323 /nfs/dbraw/zinc/89/03/23/941890323.db2.gz KESWHXOOWFKNAQ-UHFFFAOYSA-N 0 0 371.393 3.739 20 5 FHBDRN C[C@@H](Cc1cccs1)Nc1ccc([N+](=O)[O-])c(N2CCOCC2)c1F ZINC000565224094 941891624 /nfs/dbraw/zinc/89/16/24/941891624.db2.gz ZWLORBWYNYKTEA-LBPRGKRZSA-N 0 0 365.430 3.675 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N[C@@H](C)c2ccc(F)cc2Cl)c1[N+](=O)[O-] ZINC000433773363 941892067 /nfs/dbraw/zinc/89/20/67/941892067.db2.gz GGNKKMPADFZQCW-QMMMGPOBSA-N 0 0 354.769 3.725 20 5 FHBDRN CN(c1ccc(C(C)(C)C)cc1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1F ZINC000517494604 941893966 /nfs/dbraw/zinc/89/39/66/941893966.db2.gz GQYAASNNKGBHGL-UHFFFAOYSA-N 0 0 366.414 3.857 20 5 FHBDRN Cc1cccc(C)c1NC(=O)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000103463442 941899719 /nfs/dbraw/zinc/89/97/19/941899719.db2.gz CMYNPGWMTCWGGH-UHFFFAOYSA-N 0 0 350.378 3.714 20 5 FHBDRN CCOc1cccc(CCNC(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000433792468 941900557 /nfs/dbraw/zinc/90/05/57/941900557.db2.gz NKTLYKOJNPIWHU-OAHLLOKOSA-N 0 0 371.437 3.905 20 5 FHBDRN O=[N+]([O-])c1cncc(Br)c1N1CC[C@H](CC(F)(F)F)C1 ZINC000433810074 941905648 /nfs/dbraw/zinc/90/56/48/941905648.db2.gz YBPMEQIEEZSWCA-SSDOTTSWSA-N 0 0 354.126 3.531 20 5 FHBDRN CCOc1cc(NC[C@@H](C(=O)OC)c2ccc(F)cc2)ccc1[N+](=O)[O-] ZINC000433800245 941909653 /nfs/dbraw/zinc/90/96/53/941909653.db2.gz VHAUGJOQIUPLHP-OAHLLOKOSA-N 0 0 362.357 3.501 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCC[C@@H]([C@@H](O)C(F)(F)F)C2)cc1C(F)(F)F ZINC000433799416 941909701 /nfs/dbraw/zinc/90/97/01/941909701.db2.gz RFKZDRLFGFYWAY-PRHODGIISA-N 0 0 372.265 3.753 20 5 FHBDRN CSC[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1 ZINC000517518664 941915776 /nfs/dbraw/zinc/91/57/76/941915776.db2.gz QXFBVOADIMPZJD-GFCCVEGCSA-N 0 0 358.419 3.763 20 5 FHBDRN CCOc1ccc(C(=O)NCC(C)(C)Oc2ccccc2)cc1[N+](=O)[O-] ZINC000513427611 941916073 /nfs/dbraw/zinc/91/60/73/941916073.db2.gz VFMQAUBFFBNDRU-UHFFFAOYSA-N 0 0 358.394 3.581 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NCc1ccc2c(c1)CCCN2 ZINC000415576310 941916860 /nfs/dbraw/zinc/91/68/60/941916860.db2.gz FZNRJGMMZBGJMZ-UHFFFAOYSA-N 0 0 354.410 3.891 20 5 FHBDRN Cc1c(NC(=O)N2CCC[C@H]2Cn2ccnc2C(C)C)cccc1[N+](=O)[O-] ZINC000377709279 941917713 /nfs/dbraw/zinc/91/77/13/941917713.db2.gz TTZZNFAWOKWFKP-HNNXBMFYSA-N 0 0 371.441 3.920 20 5 FHBDRN Cc1nc(CC(C)C)c(NC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)s1 ZINC000182416470 941922171 /nfs/dbraw/zinc/92/21/71/941922171.db2.gz UWEHVUCOLCDLKK-UHFFFAOYSA-N 0 0 363.395 3.539 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N(C)Cc2csc3ccccc23)c1[N+](=O)[O-] ZINC000433825448 941923175 /nfs/dbraw/zinc/92/31/75/941923175.db2.gz GRAYOYGYYIGCBY-UHFFFAOYSA-N 0 0 358.423 3.928 20 5 FHBDRN O=C(N[C@H]1CCO[C@H]1c1ccc(Cl)cc1)c1ccc([N+](=O)[O-])s1 ZINC000182435908 941924957 /nfs/dbraw/zinc/92/49/57/941924957.db2.gz VSZKNZRIGYDCMP-FZMZJTMJSA-N 0 0 352.799 3.570 20 5 FHBDRN Cc1sc(C(=O)N[C@H]2CCO[C@H]2c2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000182486441 941934190 /nfs/dbraw/zinc/93/41/90/941934190.db2.gz ISZBSJPDMRXQRS-WFASDCNBSA-N 0 0 366.826 3.878 20 5 FHBDRN C[C@@H]1C[C@@H](CCNC(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)C[C@H](C)O1 ZINC000513457220 941934763 /nfs/dbraw/zinc/93/47/63/941934763.db2.gz VOMMIQRAYXNXHT-ZSBIGDGJSA-N 0 0 374.359 3.937 20 5 FHBDRN CC(C)Oc1cc(C(=O)Nc2ccc3c(c2)N(C)CC3)ccc1[N+](=O)[O-] ZINC000412225953 941934934 /nfs/dbraw/zinc/93/49/34/941934934.db2.gz BQCDLFSFOUXWKV-UHFFFAOYSA-N 0 0 355.394 3.627 20 5 FHBDRN CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F)c1nc2ccccc2o1 ZINC000182507538 941936803 /nfs/dbraw/zinc/93/68/03/941936803.db2.gz VLQNJQOADRRCJP-UHFFFAOYSA-N 0 0 363.276 3.614 20 5 FHBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)C1CCC(OC(F)F)CC1 ZINC000513449926 941937024 /nfs/dbraw/zinc/93/70/24/941937024.db2.gz CJYXHWXCELZSNO-UHFFFAOYSA-N 0 0 370.396 3.832 20 5 FHBDRN O=C(N[C@H](c1ccccc1)[C@@H]1CCOC1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412227224 941937477 /nfs/dbraw/zinc/93/74/77/941937477.db2.gz JFSNAOCWRFCBRD-GSEOLPGOSA-N 0 0 366.417 3.592 20 5 FHBDRN CC(C)Oc1cc(C(=O)N[C@H](CCCO)c2ccccc2)ccc1[N+](=O)[O-] ZINC000412225655 941940456 /nfs/dbraw/zinc/94/04/56/941940456.db2.gz GCHZYSBGXBGCJO-QGZVFWFLSA-N 0 0 372.421 3.626 20 5 FHBDRN COc1ccc([C@@H](NC(=O)Cc2cccc([N+](=O)[O-])c2)C(F)(F)F)cc1 ZINC000182632162 941940876 /nfs/dbraw/zinc/94/08/76/941940876.db2.gz GSEWBLITAWGXBZ-MRXNPFEDSA-N 0 0 368.311 3.566 20 5 FHBDRN CCCCn1cc(CNC(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)c(C)n1 ZINC000412228555 941942115 /nfs/dbraw/zinc/94/21/15/941942115.db2.gz KWXRNRYBWRIXNH-UHFFFAOYSA-N 0 0 374.441 3.617 20 5 FHBDRN CCN(CC(=O)Nc1ccccc1OC)[C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000182606147 941947099 /nfs/dbraw/zinc/94/70/99/941947099.db2.gz DGFGGPYGMWJYCC-OAHLLOKOSA-N 0 0 371.437 3.933 20 5 FHBDRN CC(C)(Cc1nc2ccccc2[nH]1)C(=O)Nc1ccc([N+](=O)[O-])cc1F ZINC000513483056 941949448 /nfs/dbraw/zinc/94/94/48/941949448.db2.gz IUFCASXNXSOHTE-UHFFFAOYSA-N 0 0 356.357 3.818 20 5 FHBDRN CO[C@H](c1ccc(F)cc1)[C@H](C)NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412235024 941950022 /nfs/dbraw/zinc/95/00/22/941950022.db2.gz 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O=C(N[C@@H](c1cccc(OC(F)(F)F)c1)C1CC1)c1cc([N+](=O)[O-])c[nH]1 ZINC000513503732 941975770 /nfs/dbraw/zinc/97/57/70/941975770.db2.gz XCINVEOTYSEZST-CQSZACIVSA-N 0 0 369.299 3.703 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H]1CCCc2cc(N)ccc21 ZINC000415667669 941981869 /nfs/dbraw/zinc/98/18/69/941981869.db2.gz YKOJJTWOIGZDTA-INIZCTEOSA-N 0 0 370.409 3.775 20 5 FHBDRN Cc1ccc(C(=O)N2CCCC[C@H]2c2noc(C3CC3)n2)cc1[N+](=O)[O-] ZINC000377792366 941992352 /nfs/dbraw/zinc/99/23/52/941992352.db2.gz XQZGVISXAJLWFU-AWEZNQCLSA-N 0 0 356.382 3.531 20 5 FHBDRN CC(=O)c1c(C)[nH]c(C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)c1C(C)C ZINC000122649676 941994816 /nfs/dbraw/zinc/99/48/16/941994816.db2.gz GNUWQUYXOPCMEA-UHFFFAOYSA-N 0 0 369.381 3.686 20 5 FHBDRN Cc1ccc(NC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1[N+](=O)[O-] ZINC000025594547 942000988 /nfs/dbraw/zinc/00/09/88/942000988.db2.gz DHCSSFAXOKPNBW-CQSZACIVSA-N 0 0 373.434 3.598 20 5 FHBDRN O=C(Nc1ccc(-n2ccnc2)c(Cl)c1)c1ccc([N+](=O)[O-])cc1F ZINC000101665731 942003260 /nfs/dbraw/zinc/00/32/60/942003260.db2.gz IPQPLHWCHNMTLF-UHFFFAOYSA-N 0 0 360.732 3.825 20 5 FHBDRN CC[C@@H](Cc1ccccc1)N(CC)C(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-] ZINC000433937349 942010951 /nfs/dbraw/zinc/01/09/51/942010951.db2.gz SRNWJWMDUHWNQC-HNNXBMFYSA-N 0 0 358.442 3.925 20 5 FHBDRN C[C@@H]1C[C@H](c2cccnc2)N(C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)C1 ZINC000412261314 942011442 /nfs/dbraw/zinc/01/14/42/942011442.db2.gz VXTCGSPFYJCBAR-VUKOWNLVSA-N 0 0 351.406 3.703 20 5 FHBDRN C[C@H]1C[C@@H](c2cccnc2)N(C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)C1 ZINC000412261316 942011470 /nfs/dbraw/zinc/01/14/70/942011470.db2.gz VXTCGSPFYJCBAR-YFYLHZKVSA-N 0 0 351.406 3.703 20 5 FHBDRN O=C(N[C@@H]1C[C@H]1c1ccc(F)cc1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000433956993 942016719 /nfs/dbraw/zinc/01/67/19/942016719.db2.gz GQUQBEUHYGYPGF-DOTOQJQBSA-N 0 0 355.369 3.594 20 5 FHBDRN C[C@H](C1CC1)n1nccc1NC(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000072575127 942017310 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20 5 FHBDRN CCOC(=O)c1cc(C(=O)N(C)Cc2cc(C)cc(C)c2)cc([N+](=O)[O-])c1 ZINC000434000220 942035286 /nfs/dbraw/zinc/03/52/86/942035286.db2.gz XVVMPJKFYYHRTD-UHFFFAOYSA-N 0 0 370.405 3.661 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])c(Cl)c1)c1cnn(-c2ccc(F)cc2)c1 ZINC001125863596 942042755 /nfs/dbraw/zinc/04/27/55/942042755.db2.gz CFIFBYALQALAGF-UHFFFAOYSA-N 0 0 360.732 3.825 20 5 FHBDRN C[C@@H](NCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1nccn1-c1ccccc1 ZINC000377868158 942046119 /nfs/dbraw/zinc/04/61/19/942046119.db2.gz GBXHEWFKYGMFKG-CYBMUJFWSA-N 0 0 367.365 3.540 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)Nc2c(C)cccc2OC(F)F)c1 ZINC000102257168 942047935 /nfs/dbraw/zinc/04/79/35/942047935.db2.gz DWIJVBARARMDST-UHFFFAOYSA-N 0 0 352.293 3.766 20 5 FHBDRN Cc1ccc(Cl)c(NC(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)c1C ZINC000434033716 942048057 /nfs/dbraw/zinc/04/80/57/942048057.db2.gz YPUFCKHHYNUMGZ-UHFFFAOYSA-N 0 0 371.784 3.698 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N2CC[C@H](Cc3ccccc3)[C@H]2C)c1[N+](=O)[O-] ZINC000434033775 942048084 /nfs/dbraw/zinc/04/80/84/942048084.db2.gz YDMPVDGFKIELSM-UKRRQHHQSA-N 0 0 356.426 3.535 20 5 FHBDRN Cc1sc(S(=O)(=O)Oc2ccc(F)cc2Cl)cc1[N+](=O)[O-] ZINC000122686434 942055544 /nfs/dbraw/zinc/05/55/44/942055544.db2.gz AKRGSKYQFWMACT-UHFFFAOYSA-N 0 0 351.764 3.525 20 5 FHBDRN CC(=O)c1cc(C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)cs1 ZINC000549366192 942058947 /nfs/dbraw/zinc/05/89/47/942058947.db2.gz MOJVRQCEBACFDQ-UHFFFAOYSA-N 0 0 356.306 3.713 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N[C@H](c2ccccn2)C2CCCC2)c1 ZINC000377911329 942066606 /nfs/dbraw/zinc/06/66/06/942066606.db2.gz NFCVQTHVWNGGTM-SFHVURJKSA-N 0 0 355.394 3.660 20 5 FHBDRN O=C(Nc1cccc(-n2cccc2)c1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000584543092 942068972 /nfs/dbraw/zinc/06/89/72/942068972.db2.gz UNVGYRCPIZCSHU-UHFFFAOYSA-N 0 0 373.372 3.824 20 5 FHBDRN COc1ccc(C(=O)N2Cc3cc(C)ccc3CC2(C)C)cc1[N+](=O)[O-] ZINC000513679469 942069578 /nfs/dbraw/zinc/06/95/78/942069578.db2.gz FMBYOWCQXJMSHE-UHFFFAOYSA-N 0 0 354.406 3.889 20 5 FHBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NCc1cc2ccccc2[nH]1 ZINC000122694040 942070535 /nfs/dbraw/zinc/07/05/35/942070535.db2.gz XZIOWPPCTWGIIW-LLVKDONJSA-N 0 0 373.796 3.813 20 5 FHBDRN Cc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2F)cc1OCC(F)F ZINC000102625018 942075886 /nfs/dbraw/zinc/07/58/86/942075886.db2.gz QQFCOKHYMKYXOV-UHFFFAOYSA-N 0 0 354.284 3.939 20 5 FHBDRN C[C@@H](NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1)[C@H](C)c1ccccc1 ZINC000473533569 942076208 /nfs/dbraw/zinc/07/62/08/942076208.db2.gz SYIDHNPEGZRJRX-LSDHHAIUSA-N 0 0 364.405 3.703 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)Nc2ccc(F)cc2Cl)c1C ZINC000015243638 942076271 /nfs/dbraw/zinc/07/62/71/942076271.db2.gz VVYQEODZOGPANL-UHFFFAOYSA-N 0 0 358.778 3.805 20 5 FHBDRN CON1CCC(c2noc([C@@H](C)Sc3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000420517072 942077943 /nfs/dbraw/zinc/07/79/43/942077943.db2.gz NLBDXDSNGAVJDH-LLVKDONJSA-N 0 0 364.427 3.572 20 5 FHBDRN CC(C)Oc1cc(C(=O)N[C@@H]2CCCc3c(O)cccc32)ccc1[N+](=O)[O-] ZINC000412296699 942080219 /nfs/dbraw/zinc/08/02/19/942080219.db2.gz ZMZHCFHZBYPVCD-MRXNPFEDSA-N 0 0 370.405 3.895 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N(Cc2ccccc2)C2CC2)c1C ZINC000024443640 942082402 /nfs/dbraw/zinc/08/24/02/942082402.db2.gz MEQAOGXCPIDMJA-UHFFFAOYSA-N 0 0 360.435 3.565 20 5 FHBDRN COc1cc(NC(=O)Cc2c(F)c(OC)ccc2[N+](=O)[O-])c(C)cc1C ZINC000412300801 942083028 /nfs/dbraw/zinc/08/30/28/942083028.db2.gz AHVMWYUEKCSOPX-UHFFFAOYSA-N 0 0 362.357 3.549 20 5 FHBDRN C[C@@H]1COCC[C@@H]1c1noc(-c2ccnc(-c3ccccc3)c2[N+](=O)[O-])n1 ZINC000420503740 942086039 /nfs/dbraw/zinc/08/60/39/942086039.db2.gz LZMJSUCLQSNJPS-OCCSQVGLSA-N 0 0 366.377 3.847 20 5 FHBDRN O=C(Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1)c1ccc2ccccc2c1 ZINC000102715273 942086742 /nfs/dbraw/zinc/08/67/42/942086742.db2.gz NSWBRJXSCVRPPJ-UHFFFAOYSA-N 0 0 358.357 3.889 20 5 FHBDRN CO[C@@]1(C)CCCN(c2cc(C)nc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000480856247 942087797 /nfs/dbraw/zinc/08/77/97/942087797.db2.gz JLWVJDSLHPLAHQ-IBGZPJMESA-N 0 0 356.426 3.756 20 5 FHBDRN O=C(Nc1scnc1-c1ccccc1)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000102759138 942095261 /nfs/dbraw/zinc/09/52/61/942095261.db2.gz CPXGEKLWEDOJKQ-UHFFFAOYSA-N 0 0 365.374 3.847 20 5 FHBDRN O=C(Nc1ccc2c(c1)CCN2)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000415875501 942098685 /nfs/dbraw/zinc/09/86/85/942098685.db2.gz DMFPCQWDJZNEJW-MRXNPFEDSA-N 0 0 366.421 3.974 20 5 FHBDRN CNC(=O)c1ccc(Cl)c(NC(=O)c2c(Cl)cccc2[N+](=O)[O-])c1 ZINC000110224461 942104408 /nfs/dbraw/zinc/10/44/08/942104408.db2.gz ZGALEFMXJXFUNA-UHFFFAOYSA-N 0 0 368.176 3.514 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@@H](C)c1cn(C(C)(C)C)nc1C ZINC000280143945 942113956 /nfs/dbraw/zinc/11/39/56/942113956.db2.gz WBVJTSGUHXTBDV-LBPRGKRZSA-N 0 0 374.441 3.744 20 5 FHBDRN CCCO[C@H]1CCCN(C(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])CC1 ZINC000280142690 942114061 /nfs/dbraw/zinc/11/40/61/942114061.db2.gz MLNXTIGVMOPPKK-ZDUSSCGKSA-N 0 0 372.824 3.738 20 5 FHBDRN Cc1nc(N2CCC[C@H]2c2ccc(Br)cn2)ccc1[N+](=O)[O-] ZINC000413379335 942114244 /nfs/dbraw/zinc/11/42/44/942114244.db2.gz QWMXNPSMRLRWNE-AWEZNQCLSA-N 0 0 363.215 3.797 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1OC(=O)Cc1csc(-c2ccccn2)n1 ZINC000760015695 942114715 /nfs/dbraw/zinc/11/47/15/942114715.db2.gz HMBKOCUGYRTICY-UHFFFAOYSA-N 0 0 355.375 3.570 20 5 FHBDRN CCC(CC)[C@@H]1C[C@H](NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])CCO1 ZINC000183358881 942117685 /nfs/dbraw/zinc/11/76/85/942117685.db2.gz WNYJPJKFPKTIKF-CJNGLKHVSA-N 0 0 354.834 3.962 20 5 FHBDRN CO[C@H]1c2ccccc2C[C@H]1NC(=O)c1c(C)cc(Cl)cc1[N+](=O)[O-] ZINC000415901946 942120942 /nfs/dbraw/zinc/12/09/42/942120942.db2.gz VIBXZQVRHOQDRM-PBHICJAKSA-N 0 0 360.797 3.599 20 5 FHBDRN Cc1cnc([C@@H](C)CNC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])s1 ZINC000280186494 942128571 /nfs/dbraw/zinc/12/85/71/942128571.db2.gz OVEJPSKKIHGCBJ-QMMMGPOBSA-N 0 0 371.821 3.615 20 5 FHBDRN CC(C)n1ncc2cc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cnc21 ZINC000016106398 942135300 /nfs/dbraw/zinc/13/53/00/942135300.db2.gz PIIQSVCTJUVZCT-UHFFFAOYSA-N 0 0 359.773 3.826 20 5 FHBDRN CO[C@](C)([C@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F)C1CC1 ZINC000415916339 942139433 /nfs/dbraw/zinc/13/94/33/942139433.db2.gz HCIBTNGJROCPOA-BJOHPYRUSA-N 0 0 360.332 3.547 20 5 FHBDRN CCOC(=O)c1cc(N[C@H](C)c2nc3c(s2)CCC3)ccc1[N+](=O)[O-] ZINC000413392277 942139835 /nfs/dbraw/zinc/13/98/35/942139835.db2.gz IKEFUWNXFKKBMO-SNVBAGLBSA-N 0 0 361.423 3.890 20 5 FHBDRN CC(C)c1nn(C)cc1N[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000280230949 942140946 /nfs/dbraw/zinc/14/09/46/942140946.db2.gz HICDHXWVRJDKTM-JTQLQIEISA-N 0 0 365.821 3.544 20 5 FHBDRN O=C(c1ccccc1)c1ccc(N2CCC[C@H](CCO)CC2)c([N+](=O)[O-])c1 ZINC000420648723 942141619 /nfs/dbraw/zinc/14/16/19/942141619.db2.gz ZEFKZCGZZVMLRA-INIZCTEOSA-N 0 0 368.433 3.815 20 5 FHBDRN O=C(c1ccccc1)c1ccc(N2CCC[C@@H](CCO)CC2)c([N+](=O)[O-])c1 ZINC000420648724 942141652 /nfs/dbraw/zinc/14/16/52/942141652.db2.gz ZEFKZCGZZVMLRA-MRXNPFEDSA-N 0 0 368.433 3.815 20 5 FHBDRN O=C(c1ccccc1)c1ccc(NCCCC2(O)CCC2)c([N+](=O)[O-])c1 ZINC000420636361 942146332 /nfs/dbraw/zinc/14/63/32/942146332.db2.gz MYGYPENSLVIDRZ-UHFFFAOYSA-N 0 0 354.406 3.933 20 5 FHBDRN COc1ccc(C)cc1[C@@H](C)Nc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 ZINC000413419490 942162335 /nfs/dbraw/zinc/16/23/35/942162335.db2.gz ZCNOJWZGOWNOPF-GFCCVEGCSA-N 0 0 355.394 3.970 20 5 FHBDRN CCOc1ccc([C@H]2CCCN2C(=O)c2ccc(OC)c([N+](=O)[O-])c2)cc1 ZINC000016141478 942163357 /nfs/dbraw/zinc/16/33/57/942163357.db2.gz BFBHUGHDOKJGQR-QGZVFWFLSA-N 0 0 370.405 3.979 20 5 FHBDRN CC(C)Oc1cc(C(=O)N[C@@H]2C[C@H]2c2ccc(F)cc2)ccc1[N+](=O)[O-] ZINC000412314369 942165395 /nfs/dbraw/zinc/16/53/95/942165395.db2.gz WTDPKAXIEMJGAR-JKSUJKDBSA-N 0 0 358.369 3.807 20 5 FHBDRN COc1cc(CCNC(=O)c2ccc(C(C)C)cc2)c([N+](=O)[O-])cc1OC ZINC000016143216 942168907 /nfs/dbraw/zinc/16/89/07/942168907.db2.gz OSJOKVCOKSWJAL-UHFFFAOYSA-N 0 0 372.421 3.708 20 5 FHBDRN CC(C)n1c2ccccc2nc1[C@@H]1CCCN1C(=O)c1cc([N+](=O)[O-])c[nH]1 ZINC000480902484 942169334 /nfs/dbraw/zinc/16/93/34/942169334.db2.gz BPSUJNLWJLWNQK-KRWDZBQOSA-N 0 0 367.409 3.831 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])c(Cl)c1)C1(c2ccc3c(c2)OCCO3)CC1 ZINC001125864545 942174624 /nfs/dbraw/zinc/17/46/24/942174624.db2.gz WVSNSFCSLDSEGG-UHFFFAOYSA-N 0 0 374.780 3.690 20 5 FHBDRN CO[C@]1(C)CCCN(C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)CC1 ZINC000280403652 942176892 /nfs/dbraw/zinc/17/68/92/942176892.db2.gz AHKKIVNXLLIGNV-MRXNPFEDSA-N 0 0 373.356 3.619 20 5 FHBDRN CO[C@@]1(C)CCCN(C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)CC1 ZINC000280403646 942177058 /nfs/dbraw/zinc/17/70/58/942177058.db2.gz AHKKIVNXLLIGNV-INIZCTEOSA-N 0 0 373.356 3.619 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1F)NCc1cccc(C(F)(F)F)c1 ZINC000122744618 942177203 /nfs/dbraw/zinc/17/72/03/942177203.db2.gz FXAVERGSCBUMRR-UHFFFAOYSA-N 0 0 356.275 3.612 20 5 FHBDRN CCn1ccnc1[C@@H]1CCCCN1C(=O)Nc1ccc(C)c([N+](=O)[O-])c1 ZINC000280412457 942178825 /nfs/dbraw/zinc/17/88/25/942178825.db2.gz AYKGRDQBCJKDBP-HNNXBMFYSA-N 0 0 357.414 3.879 20 5 FHBDRN C[C@]1(CNC(=O)c2cc([N+](=O)[O-])ccc2Cl)OCCc2sccc21 ZINC000290454122 942178852 /nfs/dbraw/zinc/17/88/52/942178852.db2.gz UUXFSOJMCVLOQT-MRXNPFEDSA-N 0 0 366.826 3.528 20 5 FHBDRN COc1cc(C(=O)NCC(C)(C)c2ccc(C)cc2)c([N+](=O)[O-])cc1OC ZINC000103038496 942188123 /nfs/dbraw/zinc/18/81/23/942188123.db2.gz XCIOLFMBJZAFBK-UHFFFAOYSA-N 0 0 372.421 3.628 20 5 FHBDRN C[C@H](CNC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-])CC(F)(F)F ZINC000413446309 942192213 /nfs/dbraw/zinc/19/22/13/942192213.db2.gz YSLGQQZYOIOOHS-VIFPVBQESA-N 0 0 367.755 3.678 20 5 FHBDRN COc1ccc(C(=O)N(C)[C@H](c2ccccc2)C(F)(F)F)cc1[N+](=O)[O-] ZINC000103050826 942192604 /nfs/dbraw/zinc/19/26/04/942192604.db2.gz DVLPQROUJDVPFI-OAHLLOKOSA-N 0 0 368.311 3.979 20 5 FHBDRN CN(C(=O)COc1cccc([N+](=O)[O-])c1)[C@@H](c1ccccc1)C(F)(F)F ZINC000103049932 942197686 /nfs/dbraw/zinc/19/76/86/942197686.db2.gz SWANGMBORPQFQC-INIZCTEOSA-N 0 0 368.311 3.736 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)NCc1cc(C(CC)CC)no1 ZINC000280515917 942200400 /nfs/dbraw/zinc/20/04/00/942200400.db2.gz ROMNQXNXZKYFRE-UHFFFAOYSA-N 0 0 361.398 3.815 20 5 FHBDRN Cn1ccnc1[C@@H]1CCCN1Cc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000366693229 942204978 /nfs/dbraw/zinc/20/49/78/942204978.db2.gz FNIGKTYYYISCPP-AWEZNQCLSA-N 0 0 354.332 3.684 20 5 FHBDRN CN(C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)c1ccc2cc[nH]c2c1 ZINC000280565234 942208563 /nfs/dbraw/zinc/20/85/63/942208563.db2.gz LXCSTRQOFDRQAO-UHFFFAOYSA-N 0 0 364.405 3.953 20 5 FHBDRN O=C(NCCc1ccccc1[N+](=O)[O-])N1CCC[C@@H](CC(F)(F)F)C1 ZINC000420789449 942210236 /nfs/dbraw/zinc/21/02/36/942210236.db2.gz FSTCMBOLLLTWTB-LBPRGKRZSA-N 0 0 359.348 3.511 20 5 FHBDRN COC(=O)c1nc([C@@H]2CCCN2c2cccc(F)c2[N+](=O)[O-])sc1C ZINC000280591780 942211010 /nfs/dbraw/zinc/21/10/10/942211010.db2.gz WYSXAELECZTXTL-LBPRGKRZSA-N 0 0 365.386 3.627 20 5 FHBDRN CC(C)(C)C1CCN(C(=O)c2cc([N+](=O)[O-])ccc2SCCO)CC1 ZINC000472934196 942212609 /nfs/dbraw/zinc/21/26/09/942212609.db2.gz XVBJOIMLGSRULU-UHFFFAOYSA-N 0 0 366.483 3.578 20 5 FHBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)N[C@@H](CC(F)F)c1ccccc1 ZINC000420825778 942214492 /nfs/dbraw/zinc/21/44/92/942214492.db2.gz ZQZMQCGHTAMENH-INIZCTEOSA-N 0 0 363.364 3.833 20 5 FHBDRN O=C(c1cc(-n2cccc2)ccn1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000502091814 942215143 /nfs/dbraw/zinc/21/51/43/942215143.db2.gz QFPQWULTSXZGOT-UHFFFAOYSA-N 0 0 362.389 3.585 20 5 FHBDRN COc1ccc(CN(C)C(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)cc1C ZINC000103091066 942215245 /nfs/dbraw/zinc/21/52/45/942215245.db2.gz ZZMQWVWJTVNFHG-UHFFFAOYSA-N 0 0 353.378 3.665 20 5 FHBDRN COc1ccc(CN(C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)cc1C ZINC000103144471 942224019 /nfs/dbraw/zinc/22/40/19/942224019.db2.gz GBQNXADVWPIAMO-UHFFFAOYSA-N 0 0 368.393 3.594 20 5 FHBDRN CN([C@H](c1ccccc1)C(F)(F)F)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000103163043 942229033 /nfs/dbraw/zinc/22/90/33/942229033.db2.gz CBCCCTZNMTXQMR-CQSZACIVSA-N 0 0 374.340 3.519 20 5 FHBDRN CCOc1cc(F)ccc1NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513701248 942233631 /nfs/dbraw/zinc/23/36/31/942233631.db2.gz YTPVNTQZEOARCH-UHFFFAOYSA-N 0 0 370.283 3.986 20 5 FHBDRN CCCn1cc(C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2C)cn1 ZINC000280710114 942237037 /nfs/dbraw/zinc/23/70/37/942237037.db2.gz MDZYWLOMHWGZTE-UHFFFAOYSA-N 0 0 367.203 3.525 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@H]1CCSc2ccccc21 ZINC000122800206 942240774 /nfs/dbraw/zinc/24/07/74/942240774.db2.gz MNRMWJHDFXVNAD-ZDUSSCGKSA-N 0 0 359.407 3.962 20 5 FHBDRN O=C(N[C@@H]1CCc2c1cccc2O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000122799223 942240779 /nfs/dbraw/zinc/24/07/79/942240779.db2.gz SDOXMNLVKATGQO-CQSZACIVSA-N 0 0 366.295 3.737 20 5 FHBDRN O=C(NC[C@@H]1CCC(F)(F)C1)c1cc([N+](=O)[O-])ccc1Br ZINC000280728638 942240817 /nfs/dbraw/zinc/24/08/17/942240817.db2.gz NXACPQXIOXXRFQ-MRVPVSSYSA-N 0 0 363.158 3.523 20 5 FHBDRN Cc1ccccc1CCC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2 ZINC000103362556 942247034 /nfs/dbraw/zinc/24/70/34/942247034.db2.gz HEIFYDQORNOKKS-UHFFFAOYSA-N 0 0 356.378 3.636 20 5 FHBDRN COc1ccc2c(CC(=O)N3c4ccc([N+](=O)[O-])cc4C[C@H]3C)coc2c1 ZINC000103377993 942249104 /nfs/dbraw/zinc/24/91/04/942249104.db2.gz FQHQLEGDLKCVMB-GFCCVEGCSA-N 0 0 366.373 3.870 20 5 FHBDRN C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1cnc(-c2ccccc2)nc1 ZINC000103374747 942249125 /nfs/dbraw/zinc/24/91/25/942249125.db2.gz KHWSOTYRALGAGY-CYBMUJFWSA-N 0 0 360.373 3.643 20 5 FHBDRN C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1ccc(NC(=O)C2CC2)cc1 ZINC000103377699 942249183 /nfs/dbraw/zinc/24/91/83/942249183.db2.gz IEOZVLKCQAFRLD-GFCCVEGCSA-N 0 0 365.389 3.535 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N1CC[C@@H](c2ccccc2F)C1 ZINC000502139832 942252422 /nfs/dbraw/zinc/25/24/22/942252422.db2.gz MUSMHGVNJMVFDP-CYBMUJFWSA-N 0 0 362.788 3.946 20 5 FHBDRN C[C@@H](Nc1ccc(Cl)c(N2CCNC2=O)c1)c1ccc([N+](=O)[O-])cc1 ZINC000501005782 942254099 /nfs/dbraw/zinc/25/40/99/942254099.db2.gz SJQKGMMZQSVSHL-LLVKDONJSA-N 0 0 360.801 3.951 20 5 FHBDRN C[C@H](C(=O)N1CC[C@@H](c2ccccc2F)C1)c1ccc([N+](=O)[O-])cc1F ZINC000502161368 942254231 /nfs/dbraw/zinc/25/42/31/942254231.db2.gz XJVAJVGUCUDJQO-QWHCGFSZSA-N 0 0 360.360 3.993 20 5 FHBDRN COc1cc(C)cc(CNC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)c1 ZINC000501006712 942254804 /nfs/dbraw/zinc/25/48/04/942254804.db2.gz IRJCMVCNGNCYDQ-UHFFFAOYSA-N 0 0 368.311 3.861 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)N2C[C@@H]3CCCCC[C@H]32)cc1SC ZINC000378082395 942257069 /nfs/dbraw/zinc/25/70/69/942257069.db2.gz GPVUKIOQQCRLSL-WCQYABFASA-N 0 0 350.440 3.730 20 5 FHBDRN CC(C)N(C(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)C1CCCCC1 ZINC000103390405 942257604 /nfs/dbraw/zinc/25/76/04/942257604.db2.gz DXGHKLPBFQJWKY-UHFFFAOYSA-N 0 0 356.426 3.964 20 5 FHBDRN C[C@@H]1CN(c2ncc([N+](=O)[O-])cc2C(F)(F)F)C[C@H](c2ccccc2)O1 ZINC000413077831 942260839 /nfs/dbraw/zinc/26/08/39/942260839.db2.gz SHHNERCMLAYQFF-IAQYHMDHSA-N 0 0 367.327 3.975 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)N[C@@H]1CCCc2sccc21 ZINC000502175779 942265230 /nfs/dbraw/zinc/26/52/30/942265230.db2.gz SKVPNTNRLHHXOX-OAHLLOKOSA-N 0 0 359.451 3.918 20 5 FHBDRN COCc1noc(CSCc2cc([N+](=O)[O-])ccc2C(F)(F)F)n1 ZINC000419453879 942269437 /nfs/dbraw/zinc/26/94/37/942269437.db2.gz KPFFCYYSMSFXKE-UHFFFAOYSA-N 0 0 363.317 3.576 20 5 FHBDRN Cc1cc(C)c(NC(=O)CN(C)Cc2c(F)cccc2[N+](=O)[O-])c(C)c1 ZINC000103465846 942273364 /nfs/dbraw/zinc/27/33/64/942273364.db2.gz KUNXXOGBLYGNKC-UHFFFAOYSA-N 0 0 359.401 3.730 20 5 FHBDRN CCOC(=O)c1csc(CSCc2ccc([N+](=O)[O-])c(OC)c2)n1 ZINC000419481154 942275411 /nfs/dbraw/zinc/27/54/11/942275411.db2.gz QYECTKJXWLOZGT-UHFFFAOYSA-N 0 0 368.436 3.670 20 5 FHBDRN COC1([C@@H](C)NC(=O)c2cc([N+](=O)[O-])ccc2SC(C)C)CCC1 ZINC000416033911 942276359 /nfs/dbraw/zinc/27/63/59/942276359.db2.gz YQMUXVHXORVLCI-GFCCVEGCSA-N 0 0 352.456 3.783 20 5 FHBDRN COc1cccc(N(CC(C)C)C(=O)COc2ccccc2[N+](=O)[O-])c1 ZINC000501037276 942279604 /nfs/dbraw/zinc/27/96/04/942279604.db2.gz SGTQZPAWSXKDPL-UHFFFAOYSA-N 0 0 358.394 3.671 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1c2ccccc2SC[C@@H]1C ZINC000434108278 942281952 /nfs/dbraw/zinc/28/19/52/942281952.db2.gz FKKPSIAYAOPMIZ-LBPRGKRZSA-N 0 0 364.448 3.593 20 5 FHBDRN CCC[C@H](C)NC(=O)[C@H]1CCCN(c2ccc([N+](=O)[O-])c3ncccc23)C1 ZINC000413096381 942285146 /nfs/dbraw/zinc/28/51/46/942285146.db2.gz BCJIZKVBTONSQC-GJZGRUSLSA-N 0 0 370.453 3.664 20 5 FHBDRN CC(C)[C@@H](C)NC(=O)C1CCN(c2ccc([N+](=O)[O-])c3ncccc32)CC1 ZINC000413100068 942286213 /nfs/dbraw/zinc/28/62/13/942286213.db2.gz HIJLYNIVZKYOST-CQSZACIVSA-N 0 0 370.453 3.520 20 5 FHBDRN Cn1ccnc1[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)c1ccc(Cl)cc1 ZINC000015640347 942287828 /nfs/dbraw/zinc/28/78/28/942287828.db2.gz KWRXXXQOHDWQJH-MRXNPFEDSA-N 0 0 370.796 3.501 20 5 FHBDRN O=C(OCc1cc(F)cc2c1OCOC2)c1cc([N+](=O)[O-])ccc1Cl ZINC000016218490 942288046 /nfs/dbraw/zinc/28/80/46/942288046.db2.gz HYPBWXXMUXEWQO-UHFFFAOYSA-N 0 0 367.716 3.611 20 5 FHBDRN CC(C)(C)OC(=O)CC[C@@H]1CCCCN1C(=O)c1csc([N+](=O)[O-])c1 ZINC000416035547 942289916 /nfs/dbraw/zinc/28/99/16/942289916.db2.gz QWKSDOONALAKMN-ZDUSSCGKSA-N 0 0 368.455 3.773 20 5 FHBDRN O=C(c1csc([N+](=O)[O-])c1)N1CCC[C@@H]1Cc1cc(F)ccc1F ZINC000416044520 942291032 /nfs/dbraw/zinc/29/10/32/942291032.db2.gz ITDJFNIIOJQPIZ-CYBMUJFWSA-N 0 0 352.362 3.782 20 5 FHBDRN C[C@H](OC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)C(=O)Nc1cccc(F)c1 ZINC000015644060 942291669 /nfs/dbraw/zinc/29/16/69/942291669.db2.gz BSVHBEBBRMKQSV-VIFPVBQESA-N 0 0 366.732 3.571 20 5 FHBDRN CN(C(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@H]1CCC[C@H]1C(C)(C)C ZINC000419530312 942292354 /nfs/dbraw/zinc/29/23/54/942292354.db2.gz ZBFYJEHSVSJDMZ-CJNGLKHVSA-N 0 0 373.457 3.827 20 5 FHBDRN Cc1ccc(S(=O)(=O)N2c3ccccc3SC[C@@H]2C)cc1[N+](=O)[O-] ZINC000434138342 942296994 /nfs/dbraw/zinc/29/69/94/942296994.db2.gz WNLLLQFHDZUVAI-LBPRGKRZSA-N 0 0 364.448 3.593 20 5 FHBDRN C[C@@H]1CCN(C)c2ccccc2N1C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000413511407 942299475 /nfs/dbraw/zinc/29/94/75/942299475.db2.gz WIKKRUOQFONTFT-FHLIZLRMSA-N 0 0 365.433 3.960 20 5 FHBDRN CCOc1cc(CSCc2nc(C(=O)OC)cs2)ccc1[N+](=O)[O-] ZINC000419540176 942306107 /nfs/dbraw/zinc/30/61/07/942306107.db2.gz CFUMLUMKVPPNQR-UHFFFAOYSA-N 0 0 368.436 3.670 20 5 FHBDRN Cc1c(Br)cccc1CC(=O)NCc1ccccc1[N+](=O)[O-] ZINC000188866097 942308141 /nfs/dbraw/zinc/30/81/41/942308141.db2.gz YSWYFCCPONPCST-UHFFFAOYSA-N 0 0 363.211 3.525 20 5 FHBDRN CSc1cccc(C(=O)NCCCOC2CCCCC2)c1[N+](=O)[O-] ZINC000188024651 942312176 /nfs/dbraw/zinc/31/21/76/942312176.db2.gz OWUCLTXBWJSULL-UHFFFAOYSA-N 0 0 352.456 3.786 20 5 FHBDRN CSc1cccc(C(=O)NCCO[C@H]2CCCC[C@H]2C)c1[N+](=O)[O-] ZINC000188060282 942317882 /nfs/dbraw/zinc/31/78/82/942317882.db2.gz JFAIREACWBQTAU-OCCSQVGLSA-N 0 0 352.456 3.642 20 5 FHBDRN O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CC[C@H](C2CC2)C1 ZINC000481086892 942323458 /nfs/dbraw/zinc/32/34/58/942323458.db2.gz YZEZYXACNNVQTJ-NSHDSACASA-N 0 0 374.384 3.964 20 5 FHBDRN CC(=O)Nc1ccc(CCNc2ncc([N+](=O)[O-])cc2C(F)(F)F)cc1 ZINC000413127174 942324297 /nfs/dbraw/zinc/32/42/97/942324297.db2.gz VAIXNFQCJKSSDD-UHFFFAOYSA-N 0 0 368.315 3.622 20 5 FHBDRN COc1cccc(CCNC(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)c1 ZINC000549397696 942329308 /nfs/dbraw/zinc/32/93/08/942329308.db2.gz NRCYXVIYRWLTIW-UHFFFAOYSA-N 0 0 368.311 3.595 20 5 FHBDRN CCCOc1ncccc1CNC(=O)Nc1c(C)ccc([N+](=O)[O-])c1C ZINC000085634905 942330251 /nfs/dbraw/zinc/33/02/51/942330251.db2.gz RFFISQZYKFKONJ-UHFFFAOYSA-N 0 0 358.398 3.717 20 5 FHBDRN O=C(Nc1cc(F)ccc1OC[C@H]1CCCO1)c1ccc([N+](=O)[O-])cc1 ZINC000502283130 942331184 /nfs/dbraw/zinc/33/11/84/942331184.db2.gz OOSFEKMTTHTNED-OAHLLOKOSA-N 0 0 360.341 3.544 20 5 FHBDRN O=C(NCCCOC1CCCCC1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513740129 942331631 /nfs/dbraw/zinc/33/16/31/942331631.db2.gz RGWWGACHUPXPMC-UHFFFAOYSA-N 0 0 372.368 3.665 20 5 FHBDRN C[C@@H](CNc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1)CC(F)(F)F ZINC000413538967 942332292 /nfs/dbraw/zinc/33/22/92/942332292.db2.gz SXAKQGXBBMTNOS-LLVKDONJSA-N 0 0 359.348 3.831 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NC[C@H](C)N(C)c1ccccc1 ZINC000085636348 942342586 /nfs/dbraw/zinc/34/25/86/942342586.db2.gz BLMNTUWZVHPBGM-AWEZNQCLSA-N 0 0 356.426 3.858 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)N(Cc1ccncc1)Cc1cccnc1 ZINC000051283282 942344052 /nfs/dbraw/zinc/34/40/52/942344052.db2.gz SPEYEZHBCOGMLR-UHFFFAOYSA-N 0 0 363.377 3.619 20 5 FHBDRN CCOC(=O)c1ccc(OC(=O)c2cc(SC)ccc2[N+](=O)[O-])cc1 ZINC000016260853 942345147 /nfs/dbraw/zinc/34/51/47/942345147.db2.gz LAUGGGUQLIUPLR-UHFFFAOYSA-N 0 0 361.375 3.713 20 5 FHBDRN C[C@H](C(=O)N1CCSC[C@H]1C1CCC1)c1ccc([N+](=O)[O-])cc1F ZINC000416101238 942345806 /nfs/dbraw/zinc/34/58/06/942345806.db2.gz BAOCIWYDIPJWDX-ZBEGNZNMSA-N 0 0 352.431 3.582 20 5 FHBDRN Cn1cnc([N+](=O)[O-])c1N[C@@H](c1ccccc1)c1ccc2c(c1)CCCO2 ZINC000501198856 942347033 /nfs/dbraw/zinc/34/70/33/942347033.db2.gz PNKGFENYWMMGSH-SFHVURJKSA-N 0 0 364.405 3.855 20 5 FHBDRN O=C(CCCc1cccs1)Nc1ccnn1-c1ccc([N+](=O)[O-])cc1 ZINC000103931469 942347723 /nfs/dbraw/zinc/34/77/23/942347723.db2.gz JFGNQDJNVZDADJ-UHFFFAOYSA-N 0 0 356.407 3.803 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)N1CC[C@H](O)CC12CCC2 ZINC000421082057 942348771 /nfs/dbraw/zinc/34/87/71/942348771.db2.gz BQDKOFUTZCWGKQ-NSHDSACASA-N 0 0 373.331 3.525 20 5 FHBDRN Cc1cc(F)cc([C@]2(F)CCN(C(=O)c3ccc([N+](=O)[O-])s3)C2)c1 ZINC000501213589 942354335 /nfs/dbraw/zinc/35/43/35/942354335.db2.gz BJFFULRWVFXEAA-INIZCTEOSA-N 0 0 352.362 3.815 20 5 FHBDRN CCN(Cc1occc1C)c1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1 ZINC000413556059 942354519 /nfs/dbraw/zinc/35/45/19/942354519.db2.gz PUUYUXJVZIAUKU-UHFFFAOYSA-N 0 0 357.410 3.759 20 5 FHBDRN CC(C)(C)c1ccc(NC(=O)N2CCC[C@H](CCO)CC2)cc1[N+](=O)[O-] ZINC000421117884 942355164 /nfs/dbraw/zinc/35/51/64/942355164.db2.gz YCLCCZCHCKRZPI-AWEZNQCLSA-N 0 0 363.458 3.909 20 5 FHBDRN O=C1CCCN1[C@H]1CCCN(c2c(Cl)cc(Cl)cc2[N+](=O)[O-])CC1 ZINC000413567257 942355726 /nfs/dbraw/zinc/35/57/26/942355726.db2.gz KQDQSRSEOFIKQR-LBPRGKRZSA-N 0 0 372.252 3.883 20 5 FHBDRN Cc1cc(C(=O)N2CCN([C@@H](C)c3cccc(F)c3)CC2)ccc1[N+](=O)[O-] ZINC000103974804 942358008 /nfs/dbraw/zinc/35/80/08/942358008.db2.gz OIWDXYSBSQEXIC-HNNXBMFYSA-N 0 0 371.412 3.561 20 5 FHBDRN C[C@@H]1CCCC[C@H]1CNC(=O)c1cccc([N+](=O)[O-])c1Br ZINC000159093061 942362292 /nfs/dbraw/zinc/36/22/92/942362292.db2.gz LDVXWZHHKSBYCN-MNOVXSKESA-N 0 0 355.232 3.913 20 5 FHBDRN COC(=O)c1cnc(Nc2ccc(COC(C)(C)C)cc2)c([N+](=O)[O-])c1 ZINC000616374607 942370249 /nfs/dbraw/zinc/37/02/49/942370249.db2.gz PWZWMFJRPAXLOD-UHFFFAOYSA-N 0 0 359.382 3.835 20 5 FHBDRN CCC1(C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)CCOCC1 ZINC000501281598 942380566 /nfs/dbraw/zinc/38/05/66/942380566.db2.gz FGGPWLRHIFQXHZ-UHFFFAOYSA-N 0 0 357.204 3.503 20 5 FHBDRN CCc1nc2c(s1)[C@@H](N(C)C(=O)c1cccc([N+](=O)[O-])c1F)CCC2 ZINC000366801241 942383448 /nfs/dbraw/zinc/38/34/48/942383448.db2.gz DACRMEIQGBTYJF-ZDUSSCGKSA-N 0 0 363.414 3.902 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H](C)c1ccc(C2CC2)cc1 ZINC000419797786 942383949 /nfs/dbraw/zinc/38/39/49/942383949.db2.gz SWDBCAKZXRZUTF-ZDUSSCGKSA-N 0 0 367.405 3.597 20 5 FHBDRN Cc1cc(NC(=O)C(=O)N(C)[C@@H]2CCC[C@H]2C(C)(C)C)ccc1[N+](=O)[O-] ZINC000419788729 942391568 /nfs/dbraw/zinc/39/15/68/942391568.db2.gz QNSRYWAZJFWERL-GDBMZVCRSA-N 0 0 361.442 3.515 20 5 FHBDRN CCOC(=O)CN(CC(C)C)C(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000501289957 942392368 /nfs/dbraw/zinc/39/23/68/942392368.db2.gz FGXMFPXKPHQUTQ-UHFFFAOYSA-N 0 0 364.442 3.554 20 5 FHBDRN Cn1c(C(=O)N2CCCC[C@@H]2CCCc2ccccc2)ccc1[N+](=O)[O-] ZINC000502371487 942403203 /nfs/dbraw/zinc/40/32/03/942403203.db2.gz HPANZHFABJYKHR-QGZVFWFLSA-N 0 0 355.438 3.951 20 5 FHBDRN CCN(C(=O)Cc1ccc([N+](=O)[O-])cc1)[C@H](C)Cc1ccc(OC)cc1 ZINC000066806104 942403925 /nfs/dbraw/zinc/40/39/25/942403925.db2.gz AONHBXSXLNSUHN-OAHLLOKOSA-N 0 0 356.422 3.626 20 5 FHBDRN COc1ccc(Cl)cc1COC(=O)c1ccc(OC)c([N+](=O)[O-])c1 ZINC000015801516 942409724 /nfs/dbraw/zinc/40/97/24/942409724.db2.gz NKQNRSRBEGSAGI-UHFFFAOYSA-N 0 0 351.742 3.622 20 5 FHBDRN CC(C)(C(=O)NCCCCc1ccc([N+](=O)[O-])cc1)C1CCC(O)CC1 ZINC000416153534 942411740 /nfs/dbraw/zinc/41/17/40/942411740.db2.gz DEKPNUCBMFLAGV-UHFFFAOYSA-N 0 0 362.470 3.611 20 5 FHBDRN Cc1ccc(NC(=O)[C@H](C)OC(=O)c2cccc([N+](=O)[O-])c2C)cc1F ZINC000015800734 942412021 /nfs/dbraw/zinc/41/20/21/942412021.db2.gz RRPDLTZSGKQNQF-LBPRGKRZSA-N 0 0 360.341 3.535 20 5 FHBDRN Cc1ccc([C@H](C)NCc2nnc(-c3ccncc3F)s2)cc1[N+](=O)[O-] ZINC000366833107 942427630 /nfs/dbraw/zinc/42/76/30/942427630.db2.gz YTOAWWKWBHQZTR-NSHDSACASA-N 0 0 373.413 3.807 20 5 FHBDRN COc1cc(Cl)ccc1CNC(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000502420489 942436670 /nfs/dbraw/zinc/43/66/70/942436670.db2.gz YOVXOCWOWPMBNR-UHFFFAOYSA-N 0 0 366.826 3.665 20 5 FHBDRN Cc1cc(N(C)Cc2noc(C3CC3)n2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000413611412 942438034 /nfs/dbraw/zinc/43/80/34/942438034.db2.gz SKIVLRWCWPHWEN-UHFFFAOYSA-N 0 0 356.304 3.819 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CCC[C@H]2[C@@H]2CCCCC2=O)ccc1[N+](=O)[O-] ZINC000413612017 942439112 /nfs/dbraw/zinc/43/91/12/942439112.db2.gz SXXGZFNZIKAMRQ-HOTGVXAUSA-N 0 0 374.437 3.746 20 5 FHBDRN C[C@@H]1CN(c2ccc([N+](=O)[O-])c3ncccc23)C[C@H]1C(=O)OC(C)(C)C ZINC000413612197 942439144 /nfs/dbraw/zinc/43/91/44/942439144.db2.gz TVXHAWMSFIGWSZ-TZMCWYRMSA-N 0 0 357.410 3.557 20 5 FHBDRN Cc1ccc(NC(=O)[C@@H]2CCCN2C(=O)Nc2ccccc2)cc1[N+](=O)[O-] ZINC000104197158 942450412 /nfs/dbraw/zinc/45/04/12/942450412.db2.gz MZUFLUPXNYZAKP-INIZCTEOSA-N 0 0 368.393 3.538 20 5 FHBDRN COc1cccc([C@@H]2CN(c3nccc4ccc([N+](=O)[O-])cc43)CCO2)c1 ZINC000413192865 942459281 /nfs/dbraw/zinc/45/92/81/942459281.db2.gz JPGJMPQSIFPCHR-IBGZPJMESA-N 0 0 365.389 3.730 20 5 FHBDRN C[C@H](O)C[C@H](CNc1ncc([N+](=O)[O-])cc1C(F)(F)F)c1ccccc1 ZINC000413197611 942460663 /nfs/dbraw/zinc/46/06/63/942460663.db2.gz SABMBQQQIHEASN-WCQYABFASA-N 0 0 369.343 3.975 20 5 FHBDRN C[C@@H](c1ccc([N+](=O)[O-])cc1)N1C(=O)[C@@H](C)N(Cc2ccccc2)C1=O ZINC000419962313 942467605 /nfs/dbraw/zinc/46/76/05/942467605.db2.gz GWFAQZONVFPQOI-UONOGXRCSA-N 0 0 353.378 3.509 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N2c3ccccc3CC[C@@H]2C)c1C ZINC000014100739 942468508 /nfs/dbraw/zinc/46/85/08/942468508.db2.gz VVSXJPSVWWVMMP-ZDUSSCGKSA-N 0 0 360.435 3.742 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)Nc1nc2cccnc2n1C ZINC000505318706 942474818 /nfs/dbraw/zinc/47/48/18/942474818.db2.gz VQHRCNXXAZRQQF-UHFFFAOYSA-N 0 0 371.422 3.629 20 5 FHBDRN O=C(c1csc(C2CCCCC2)n1)N1CCc2ncc([N+](=O)[O-])cc2C1 ZINC000413669608 942493067 /nfs/dbraw/zinc/49/30/67/942493067.db2.gz OJGOYIRCYYHMME-UHFFFAOYSA-N 0 0 372.450 3.693 20 5 FHBDRN COC(=O)c1cc(NC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)c(C)cc1C ZINC000472953944 942511542 /nfs/dbraw/zinc/51/15/42/942511542.db2.gz OFNJFEBLIJCNRV-UHFFFAOYSA-N 0 0 367.361 3.732 20 5 FHBDRN CO[C@@](C)([C@@H](C)NC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F)C1CC1 ZINC000413702438 942512794 /nfs/dbraw/zinc/51/27/94/942512794.db2.gz XPWWLEYDNVAMDC-ABKXIKBNSA-N 0 0 373.356 3.521 20 5 FHBDRN COc1ccc(NC(=O)[C@H]2CC(C)(C)Oc3ccccc32)c([N+](=O)[O-])c1 ZINC000413707724 942513346 /nfs/dbraw/zinc/51/33/46/942513346.db2.gz ZJROIVLCZZQGET-AWEZNQCLSA-N 0 0 356.378 3.887 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@H]1/C=C\c1ccccc1 ZINC000505380866 942513912 /nfs/dbraw/zinc/51/39/12/942513912.db2.gz UYRPMTHCEBVTFI-YDZSZYSISA-N 0 0 352.390 3.921 20 5 FHBDRN C[C@@H]1C[C@@H](CO)C[N@H+](Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)C1 ZINC000421361026 942513991 /nfs/dbraw/zinc/51/39/91/942513991.db2.gz KCDPSHXHKFNLCI-GDBMZVCRSA-N 0 0 374.412 3.977 20 5 FHBDRN CC(C)OC(=O)C[C@@H]1CCCN(c2nccc3ccc([N+](=O)[O-])cc32)C1 ZINC000413227802 942514349 /nfs/dbraw/zinc/51/43/49/942514349.db2.gz IRFQKAMZGCBDND-AWEZNQCLSA-N 0 0 357.410 3.701 20 5 FHBDRN C[C@@H](CC(=O)c1ccc(F)cc1)NC(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000501505234 942515469 /nfs/dbraw/zinc/51/54/69/942515469.db2.gz TVTRXKBGGMAMLC-NSHDSACASA-N 0 0 370.336 3.871 20 5 FHBDRN CCO[C@H]1C[C@H](Nc2ccc([N+](=O)[O-])c3ncccc23)C12CCOCC2 ZINC000413228215 942516293 /nfs/dbraw/zinc/51/62/93/942516293.db2.gz KIDRFGMXSTZPRR-IRXDYDNUSA-N 0 0 357.410 3.529 20 5 FHBDRN C[C@H](CC(=O)c1ccc(F)cc1)NC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000501508117 942516916 /nfs/dbraw/zinc/51/69/16/942516916.db2.gz XATPABMXEHLUBK-CYBMUJFWSA-N 0 0 372.396 3.789 20 5 FHBDRN COc1ccc([C@H](NC(=O)c2cc(C)cc([N+](=O)[O-])c2)C(F)(F)F)cc1 ZINC000505386425 942517557 /nfs/dbraw/zinc/51/75/57/942517557.db2.gz ICSIXGNHSRAFBY-HNNXBMFYSA-N 0 0 368.311 3.945 20 5 FHBDRN CC(C)c1[nH]nc(C(=O)Nc2cc(Cl)ccc2OC(F)F)c1[N+](=O)[O-] ZINC000425046905 942520274 /nfs/dbraw/zinc/52/02/74/942520274.db2.gz LSFKWGPURASCKZ-UHFFFAOYSA-N 0 0 374.731 3.948 20 5 FHBDRN C[C@@H](CCOCc1ccccc1)NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412340685 942522541 /nfs/dbraw/zinc/52/25/41/942522541.db2.gz RHCKPZOWAMMQIC-RYGJVYDSSA-N 0 0 368.433 3.810 20 5 FHBDRN O=C(CSc1ccc2c(c1)CCC2)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000501528180 942525127 /nfs/dbraw/zinc/52/51/27/942525127.db2.gz OQMNZIMCKMEKCK-UHFFFAOYSA-N 0 0 372.402 3.543 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1OC(=O)CCc1nnc(-c2ccsc2)o1 ZINC000378292356 942534227 /nfs/dbraw/zinc/53/42/27/942534227.db2.gz UCOZNDUOTFYFJQ-UHFFFAOYSA-N 0 0 359.363 3.553 20 5 FHBDRN C[C@H](SCc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc2c(c1)OCCO2 ZINC000513819596 942537051 /nfs/dbraw/zinc/53/70/51/942537051.db2.gz ZSOVZZPVJHCHLS-LBPRGKRZSA-N 0 0 374.418 3.626 20 5 FHBDRN C[C@@H]1C[C@@H](c2cccnc2)N(c2ncc([N+](=O)[O-])cc2C(F)(F)F)C1 ZINC000413236154 942538981 /nfs/dbraw/zinc/53/89/81/942538981.db2.gz QHQNRMVTTHLKRW-YGRLFVJLSA-N 0 0 352.316 3.991 20 5 FHBDRN C[C@H](NC(=O)N[C@H]1c2ccc(F)cc2O[C@H]1C)c1ccccc1[N+](=O)[O-] ZINC000501568276 942543016 /nfs/dbraw/zinc/54/30/16/942543016.db2.gz QBAHDZBQYDHVEG-PSVSLLHZSA-N 0 0 359.357 3.616 20 5 FHBDRN CCS[C@@H]1CCC[C@H](NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000120219966 942546264 /nfs/dbraw/zinc/54/62/64/942546264.db2.gz PCETXZWVFIEZBB-DZGCQCFKSA-N 0 0 361.467 3.799 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N[C@H](c2ccc(F)cc2F)C(C)C)c1[N+](=O)[O-] ZINC000434250043 942549392 /nfs/dbraw/zinc/54/93/92/942549392.db2.gz OTYYLTHILGOQSX-ZDUSSCGKSA-N 0 0 366.368 3.847 20 5 FHBDRN Cc1cc(N2CCOCC2)ccc1NC(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC000421421602 942550853 /nfs/dbraw/zinc/55/08/53/942550853.db2.gz CPNXKDIWEKZRKU-UHFFFAOYSA-N 0 0 369.421 3.609 20 5 FHBDRN CC(=O)Nc1cccc([C@@H](C)NC(=O)c2cc([N+](=O)[O-])c(C)cc2C)c1 ZINC000421423065 942552177 /nfs/dbraw/zinc/55/21/77/942552177.db2.gz POTKPUSWWQMNCH-CYBMUJFWSA-N 0 0 355.394 3.661 20 5 FHBDRN C[C@H]1[C@H](c2ccccc2)CCN1C(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000434258030 942552732 /nfs/dbraw/zinc/55/27/32/942552732.db2.gz WOZACBDHGWLVOW-DOTOQJQBSA-N 0 0 353.422 3.801 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)NC1(Cc2ccccc2)CCC1 ZINC000472958570 942553308 /nfs/dbraw/zinc/55/33/08/942553308.db2.gz IBTYUTZFSLDUDL-UHFFFAOYSA-N 0 0 363.417 3.831 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(C(=O)N2CCN(C3CC3)c3ccc(Cl)cc32)n1 ZINC001269758912 942553827 /nfs/dbraw/zinc/55/38/27/942553827.db2.gz XOPUTJXZEUZANM-UHFFFAOYSA-N 0 0 372.812 3.581 20 5 FHBDRN CC(C)OC(=O)C[C@H]1CCCN(c2ccc([N+](=O)[O-])c3ncccc23)C1 ZINC000413245144 942559760 /nfs/dbraw/zinc/55/97/60/942559760.db2.gz ZYJJNCPIJPNMMS-CQSZACIVSA-N 0 0 357.410 3.701 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CC[C@H](COc3ccccc3)C2)c(C(F)(F)F)c1 ZINC000413248735 942561885 /nfs/dbraw/zinc/56/18/85/942561885.db2.gz SAZHDEBNCRWWEX-LBPRGKRZSA-N 0 0 367.327 3.914 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CC[C@H](n3cnc4c3CCCC4)C2)c2cccnc21 ZINC000413253685 942567956 /nfs/dbraw/zinc/56/79/56/942567956.db2.gz WAPKFJCBBSFPAR-AWEZNQCLSA-N 0 0 363.421 3.670 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N1CCC(OC2CCC2)CC1 ZINC000416260162 942569375 /nfs/dbraw/zinc/56/93/75/942569375.db2.gz RLXWJYZIADMGTB-UHFFFAOYSA-N 0 0 372.343 3.787 20 5 FHBDRN CC(C)n1ncc2c1C[C@@H](Nc1ccc([N+](=O)[O-])c3ncccc13)CC2 ZINC000413258364 942569349 /nfs/dbraw/zinc/56/93/49/942569349.db2.gz GOZOOOMQKWKTQR-AWEZNQCLSA-N 0 0 351.410 3.890 20 5 FHBDRN Cc1cc(C(=O)N2CCN(Cc3ccc(Cl)cc3)CC2)cc([N+](=O)[O-])c1 ZINC000147290032 942571566 /nfs/dbraw/zinc/57/15/66/942571566.db2.gz FYSNXCUDVMAWHY-UHFFFAOYSA-N 0 0 373.840 3.515 20 5 FHBDRN Cc1ccccc1CO[C@@H](C)C(=O)OCc1ccc(N(C)C)c([N+](=O)[O-])c1 ZINC001268940919 942574075 /nfs/dbraw/zinc/57/40/75/942574075.db2.gz CFADYYJMSBFCMM-HNNXBMFYSA-N 0 0 372.421 3.618 20 5 FHBDRN CCCOc1cccc(CC(=O)OCc2ccc(N(C)C)c([N+](=O)[O-])c2)c1 ZINC001268941263 942575305 /nfs/dbraw/zinc/57/53/05/942575305.db2.gz MOLXFWDDKUKQOG-UHFFFAOYSA-N 0 0 372.421 3.736 20 5 FHBDRN O=[N+]([O-])c1ccc(NC[C@]2(CO)C[C@@H]2c2ccc(F)cc2)c2cccnc21 ZINC000413263747 942578270 /nfs/dbraw/zinc/57/82/70/942578270.db2.gz MZBXZWRXCGFHKU-UZLBHIALSA-N 0 0 367.380 3.860 20 5 FHBDRN O=C(c1cc(C(F)(F)F)ccc1[N+](=O)[O-])N1CCC(OC2CCC2)CC1 ZINC000416264142 942578623 /nfs/dbraw/zinc/57/86/23/942578623.db2.gz CGHBNZUPMOWYPZ-UHFFFAOYSA-N 0 0 372.343 3.787 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H](Cc1ccccc1)OC ZINC000452392279 942579734 /nfs/dbraw/zinc/57/97/34/942579734.db2.gz DPNONTYXXGLCGH-UYAOXDASSA-N 0 0 370.449 3.537 20 5 FHBDRN CCOc1cc2c(cc1OCC)CN(Cc1ccccc1[N+](=O)[O-])CC2 ZINC000016418744 942582571 /nfs/dbraw/zinc/58/25/71/942582571.db2.gz TWBFVPHXQNABOR-UHFFFAOYSA-N 0 0 356.422 3.951 20 5 FHBDRN Cc1cccc2nc(CNC(=O)Nc3ccc([N+](=O)[O-])cc3Cl)n(C)c21 ZINC000120227457 942583443 /nfs/dbraw/zinc/58/34/43/942583443.db2.gz BXTORMLFWQSONX-UHFFFAOYSA-N 0 0 373.800 3.765 20 5 FHBDRN O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)Nc1cccc2ccsc21 ZINC000501652595 942587194 /nfs/dbraw/zinc/58/71/94/942587194.db2.gz YGRCEIWSOARMAJ-UHFFFAOYSA-N 0 0 369.402 3.568 20 5 FHBDRN Cc1cc(OCC(=O)NC[C@]2(C)C[C@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000501654104 942588525 /nfs/dbraw/zinc/58/85/25/942588525.db2.gz DCZFDHRUJNRYGL-PXNSSMCTSA-N 0 0 354.406 3.592 20 5 FHBDRN O=C(CSc1ccccc1[N+](=O)[O-])NCc1cccc2cccnc21 ZINC000541304740 942590638 /nfs/dbraw/zinc/59/06/38/942590638.db2.gz LYGAVUVSPMPCRF-UHFFFAOYSA-N 0 0 353.403 3.552 20 5 FHBDRN CCNc1ccc(C(=O)NCc2cccc(C(F)(F)F)c2)cc1[N+](=O)[O-] ZINC000015976997 942590684 /nfs/dbraw/zinc/59/06/84/942590684.db2.gz WUXDHLOLTRVJMB-UHFFFAOYSA-N 0 0 367.327 3.975 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCC[C@](CO)(c3ccccc3)C2)c2cccnc21 ZINC000413277109 942596543 /nfs/dbraw/zinc/59/65/43/942596543.db2.gz CTLOWERIDOIFPB-NRFANRHFSA-N 0 0 363.417 3.674 20 5 FHBDRN Cc1c(Cl)c(C(=O)N(c2cccc([N+](=O)[O-])c2)C2CCCC2)nn1C ZINC000421458378 942597633 /nfs/dbraw/zinc/59/76/33/942597633.db2.gz LNMNOBXPJIWFJL-UHFFFAOYSA-N 0 0 362.817 3.880 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@H]1[C@@H]1CCCC1=O ZINC000363802008 942606675 /nfs/dbraw/zinc/60/66/75/942606675.db2.gz CKGVMVSBFJJFNO-NJAFHUGGSA-N 0 0 358.438 3.524 20 5 FHBDRN CNc1c(C(=O)N(C)Cc2cc(Cl)ccc2F)cccc1[N+](=O)[O-] ZINC000434343732 942606775 /nfs/dbraw/zinc/60/67/75/942606775.db2.gz WTJMYHAXGLRKSO-UHFFFAOYSA-N 0 0 351.765 3.701 20 5 FHBDRN CN(Cc1cc(F)cc(F)c1)C(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000434344562 942607561 /nfs/dbraw/zinc/60/75/61/942607561.db2.gz NBIJGGKBCAEIKX-UHFFFAOYSA-N 0 0 363.364 3.724 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N2C[C@H](C)C[C@H]2c2ccccc2)c1F ZINC000412347152 942613286 /nfs/dbraw/zinc/61/32/86/942613286.db2.gz NZBQWXVDZLSIJD-DYVFJYSZSA-N 0 0 372.396 3.895 20 5 FHBDRN CC(C)(CNC(=O)NCCCCc1ccc([N+](=O)[O-])cc1)c1cccnc1 ZINC000413294612 942614014 /nfs/dbraw/zinc/61/40/14/942614014.db2.gz CZBONRVSYXXJBI-UHFFFAOYSA-N 0 0 370.453 3.590 20 5 FHBDRN CC(C)Oc1cc(C(=O)N[C@H](C)c2c(F)cncc2F)ccc1[N+](=O)[O-] ZINC000412346970 942620149 /nfs/dbraw/zinc/62/01/49/942620149.db2.gz NBGCEESTPHPFBV-SNVBAGLBSA-N 0 0 365.336 3.546 20 5 FHBDRN COc1ccc(CN(CC2CC2)C(=O)c2cccc([N+](=O)[O-])c2)c(OC)c1 ZINC000501716521 942624927 /nfs/dbraw/zinc/62/49/27/942624927.db2.gz KAGFIKUDXLJCNL-UHFFFAOYSA-N 0 0 370.405 3.664 20 5 FHBDRN CCCOc1ccccc1NC(=O)c1cc(C(=O)OCC)cc([N+](=O)[O-])c1 ZINC000015998273 942629481 /nfs/dbraw/zinc/62/94/81/942629481.db2.gz FKRAPUVBLXDYFM-UHFFFAOYSA-N 0 0 372.377 3.813 20 5 FHBDRN Cc1c(C(=O)N2CCS[C@@H]2c2ccc([N+](=O)[O-])cc2)cnn1CC(C)C ZINC000501728447 942635533 /nfs/dbraw/zinc/63/55/33/942635533.db2.gz IEQFOODRIYARLP-GOSISDBHSA-N 0 0 374.466 3.644 20 5 FHBDRN O=[N+]([O-])c1cnc(NC[C@]2(CO)C[C@H]2c2ccccc2)c(C(F)(F)F)c1 ZINC000413309260 942642472 /nfs/dbraw/zinc/64/24/72/942642472.db2.gz LHJWAHQHQITGJG-HOCLYGCPSA-N 0 0 367.327 3.587 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CCc1ccccc1O2 ZINC000421549960 942653919 /nfs/dbraw/zinc/65/39/19/942653919.db2.gz FNXGUWDGSSZHAE-NRFANRHFSA-N 0 0 366.417 3.822 20 5 FHBDRN C[C@@H]1CN(C(=O)c2cccc3c(=O)c4cccc(F)c4[nH]c23)[C@@H](C)[C@H]1C ZINC000416322425 942655970 /nfs/dbraw/zinc/65/59/70/942655970.db2.gz MVMPCQAOPXYNEU-AGIUHOORSA-N 0 0 352.409 3.937 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@@H](c1ccc(F)cc1)C(C)(C)C ZINC000501769302 942659093 /nfs/dbraw/zinc/65/90/93/942659093.db2.gz HSGFXTHNXYIKQL-KRWDZBQOSA-N 0 0 362.405 3.533 20 5 FHBDRN COc1ccc2[nH]cc(C3CCN(c4ccncc4[N+](=O)[O-])CC3)c2c1 ZINC000066810429 942660179 /nfs/dbraw/zinc/66/01/79/942660179.db2.gz IVRZWPCIRFRNNC-UHFFFAOYSA-N 0 0 352.394 3.864 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCC(c2noc(C(C)C)n2)CC1 ZINC000421572473 942664293 /nfs/dbraw/zinc/66/42/93/942664293.db2.gz DBBQXLJRXDCONR-UHFFFAOYSA-N 0 0 372.425 3.738 20 5 FHBDRN CCCN(Cc1ccc(C)cc1)C(=O)CN(C)Cc1ccccc1[N+](=O)[O-] ZINC000501776556 942667801 /nfs/dbraw/zinc/66/78/01/942667801.db2.gz PRDUMXDSAQLWBL-UHFFFAOYSA-N 0 0 369.465 3.774 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)NCC[C@H]2CCc3ccccc32)c1F ZINC000412364302 942670809 /nfs/dbraw/zinc/67/08/09/942670809.db2.gz CMHGKYKXWAIEEH-CQSZACIVSA-N 0 0 372.396 3.521 20 5 FHBDRN O=C(CC1CC(c2ccccc2)C1)NCCNc1ccc([N+](=O)[O-])cc1 ZINC000466946139 942675121 /nfs/dbraw/zinc/67/51/21/942675121.db2.gz YXSLNDSJTPFUKF-UHFFFAOYSA-N 0 0 353.422 3.707 20 5 FHBDRN C[C@H]1CCCCN1C(=O)COc1ccc([N+](=O)[O-])cc1Cc1ccccc1 ZINC000016458848 942675588 /nfs/dbraw/zinc/67/55/88/942675588.db2.gz XRBHSEDKTVDMII-INIZCTEOSA-N 0 0 368.433 3.965 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2CC[C@H](c3ccccc3C)C2)c1 ZINC000513721861 942675779 /nfs/dbraw/zinc/67/57/79/942675779.db2.gz BYGQEJULXKFYKM-KRWDZBQOSA-N 0 0 368.433 3.997 20 5 FHBDRN COc1ccc(OC)c(-c2noc([C@@H]3C[C@H]3c3ccc([N+](=O)[O-])cc3)n2)c1 ZINC000420475182 942678358 /nfs/dbraw/zinc/67/83/58/942678358.db2.gz LVKYTBRFORUAGK-LSDHHAIUSA-N 0 0 367.361 3.933 20 5 FHBDRN Cn1ccnc1SCc1cccc(C(=O)Nc2cccc([N+](=O)[O-])c2)c1 ZINC000501793067 942680361 /nfs/dbraw/zinc/68/03/61/942680361.db2.gz JKQKQDVQJMFCQS-UHFFFAOYSA-N 0 0 368.418 3.873 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CC12CCSCC2 ZINC000421591278 942687192 /nfs/dbraw/zinc/68/71/92/942687192.db2.gz PHPHEKXLWLGSLX-GFCCVEGCSA-N 0 0 366.508 3.970 20 5 FHBDRN C[C@@H]1C[C@H](c2noc(-c3ccnc(-c4ccccc4)c3[N+](=O)[O-])n2)CCO1 ZINC000420486808 942690544 /nfs/dbraw/zinc/69/05/44/942690544.db2.gz HJUASWVXTSDMPS-TZMCWYRMSA-N 0 0 366.377 3.989 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCO[C@@H](c3ccc(F)c(F)c3)C2)c2ccncc21 ZINC000066815544 942696293 /nfs/dbraw/zinc/69/62/93/942696293.db2.gz QWXGUAFTCSKQOK-LJQANCHMSA-N 0 0 371.343 3.999 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)N1CCC[C@@]1(C)Cc1ccc(F)cc1 ZINC000421616732 942701201 /nfs/dbraw/zinc/70/12/01/942701201.db2.gz BPSQLFBFIKNUDP-IBGZPJMESA-N 0 0 357.385 3.675 20 5 FHBDRN O=C(c1cc(NCCC2CC(F)(F)C2)ccc1[N+](=O)[O-])N1CCCC1 ZINC000413344870 942701297 /nfs/dbraw/zinc/70/12/97/942701297.db2.gz SBJKCHQQCYENPB-UHFFFAOYSA-N 0 0 353.369 3.678 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CCC[C@@H](C[C@@H]2CCOC2)C1 ZINC000378398028 942703274 /nfs/dbraw/zinc/70/32/74/942703274.db2.gz GPDOHNUYQLFIPR-STQMWFEESA-N 0 0 352.818 3.527 20 5 FHBDRN Cc1nc([C@H]2CCCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3o2)no1 ZINC000501833253 942705663 /nfs/dbraw/zinc/70/56/63/942705663.db2.gz YLSKDLPCVIAORB-CQSZACIVSA-N 0 0 370.365 3.790 20 5 FHBDRN CC[C@@](C)(OC)c1noc(-c2ccnc(-c3ccccc3)c2[N+](=O)[O-])n1 ZINC000420498433 942706343 /nfs/dbraw/zinc/70/63/43/942706343.db2.gz BJORQUVYIOSQCM-GOSISDBHSA-N 0 0 354.366 3.978 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])NC1(Cc2ccccc2)CCC1 ZINC000472977937 942713147 /nfs/dbraw/zinc/71/31/47/942713147.db2.gz LTYFDLCKAJFVCV-UHFFFAOYSA-N 0 0 354.406 3.645 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N1CCC[C@@H](C[C@@H]2CCOC2)C1 ZINC000378397435 942715149 /nfs/dbraw/zinc/71/51/49/942715149.db2.gz FRLHAQLHJIQDBG-STQMWFEESA-N 0 0 367.833 3.919 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)NCc2noc3c2CC(C)(C)CC3)c1C ZINC000893225747 942717915 /nfs/dbraw/zinc/71/79/15/942717915.db2.gz SWTAMOGYCFRVLD-UHFFFAOYSA-N 0 0 357.410 3.645 20 5 FHBDRN COCCC1(c2noc(-c3ccc(NC4CC4)c([N+](=O)[O-])c3)n2)CCC1 ZINC000420515581 942719711 /nfs/dbraw/zinc/71/97/11/942719711.db2.gz SGCDNTTZGMFZJX-UHFFFAOYSA-N 0 0 358.398 3.677 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CCC(F)(c2ccccc2)CC1 ZINC000434499018 942724771 /nfs/dbraw/zinc/72/47/71/942724771.db2.gz WPEVVVSIOMVFNJ-UHFFFAOYSA-N 0 0 371.412 3.803 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1cccn(CC)c1=O ZINC000413890483 942726020 /nfs/dbraw/zinc/72/60/20/942726020.db2.gz CIZKQDUHBUZPQB-UHFFFAOYSA-N 0 0 361.423 3.531 20 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/nfs/dbraw/zinc/74/82/31/942748231.db2.gz KOAMCFMTZLRJOT-NSHDSACASA-N 0 0 366.439 3.608 20 5 FHBDRN O=[N+]([O-])c1cc(F)ccc1N[C@@H](CO)c1ccc(Br)cc1 ZINC000502800578 942752915 /nfs/dbraw/zinc/75/29/15/942752915.db2.gz ZPWSLJHCOLMZHJ-ZDUSSCGKSA-N 0 0 355.163 3.642 20 5 FHBDRN CC(C)(CNC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1)c1cccnc1 ZINC000413892823 942755195 /nfs/dbraw/zinc/75/51/95/942755195.db2.gz ZFOGQIJGSNOJSC-UHFFFAOYSA-N 0 0 368.437 3.642 20 5 FHBDRN CCOc1ccccc1CN(C)[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000514116509 942755876 /nfs/dbraw/zinc/75/58/76/942755876.db2.gz IIBMFQRULATAHU-OAHLLOKOSA-N 0 0 371.437 3.761 20 5 FHBDRN CCN(Cc1ccc(Cl)s1)C(=O)c1ccc([N+](=O)[O-])c(OC)c1 ZINC000133609215 942756410 /nfs/dbraw/zinc/75/64/10/942756410.db2.gz HQHSFRGBUGDVFD-UHFFFAOYSA-N 0 0 354.815 3.981 20 5 FHBDRN CN(CC(=O)N[C@@H](CC(F)F)c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000421699213 942771296 /nfs/dbraw/zinc/77/12/96/942771296.db2.gz NCFWTOIODSEEOU-AWEZNQCLSA-N 0 0 363.364 3.544 20 5 FHBDRN CC(C)n1cc(C(C)(C)NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)nn1 ZINC000421738296 942773705 /nfs/dbraw/zinc/77/37/05/942773705.db2.gz RGMQNOBDOVKFLC-UHFFFAOYSA-N 0 0 373.438 3.647 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CCCC12CCOCC2 ZINC000367057527 942775719 /nfs/dbraw/zinc/77/57/19/942775719.db2.gz KLHAGFHBCREULA-WMZOPIPTSA-N 0 0 360.454 3.629 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1Cc2ccccc2O1 ZINC000502825997 942781023 /nfs/dbraw/zinc/78/10/23/942781023.db2.gz BJCQLILLFRPTAA-OAHLLOKOSA-N 0 0 372.446 3.830 20 5 FHBDRN C[C@@H]1c2c(Cl)cc(Cl)cc2CCN1C(=O)c1ccc([N+](=O)[O-])[nH]1 ZINC000434599946 942789537 /nfs/dbraw/zinc/78/95/37/942789537.db2.gz UPUUTCIUATXWJS-MRVPVSSYSA-N 0 0 354.193 3.989 20 5 FHBDRN COc1c(C)cnc(CN(C)C(=O)c2cc([N+](=O)[O-])c(C)cc2C)c1C ZINC000421759713 942801845 /nfs/dbraw/zinc/80/18/45/942801845.db2.gz VJOBYHHCXPQXSU-UHFFFAOYSA-N 0 0 357.410 3.504 20 5 FHBDRN COc1cc2c(c(OC)c1OC)CCN(c1ccc([N+](=O)[O-])c(C)c1)CC2 ZINC000514176589 942802486 /nfs/dbraw/zinc/80/24/86/942802486.db2.gz RSUHPESNZYCWJL-UHFFFAOYSA-N 0 0 372.421 3.534 20 5 FHBDRN COc1c(Br)c([N+](=O)[O-])c(NC2CCCC2)cc1[N+](=O)[O-] ZINC000014206372 942803252 /nfs/dbraw/zinc/80/32/52/942803252.db2.gz GFFDIWLZWZJPNY-UHFFFAOYSA-N 0 0 360.164 3.629 20 5 FHBDRN O=C(CCc1ncc(-c2ccccc2F)o1)Nc1cccc([N+](=O)[O-])c1 ZINC000014206902 942803367 /nfs/dbraw/zinc/80/33/67/942803367.db2.gz XSUTXLNKKYTWPF-UHFFFAOYSA-N 0 0 355.325 3.960 20 5 FHBDRN CCOc1ccc(C(=O)NCc2cnccc2C(C)(C)C)cc1[N+](=O)[O-] ZINC000413940147 942806178 /nfs/dbraw/zinc/80/61/78/942806178.db2.gz ROKHHUZEZSJOLT-UHFFFAOYSA-N 0 0 357.410 3.616 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N[C@H](C)CC(=O)c1ccc(F)cc1 ZINC000421782977 942808040 /nfs/dbraw/zinc/80/80/40/942808040.db2.gz FHKWWPTZKAVWTB-CYBMUJFWSA-N 0 0 358.369 3.742 20 5 FHBDRN O=C(NC[C@H]1CCc2ccccc21)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514199624 942809258 /nfs/dbraw/zinc/80/92/58/942809258.db2.gz NPCCKPXQHWNYNO-CYBMUJFWSA-N 0 0 362.332 3.656 20 5 FHBDRN CN(C)C(=O)[C@H]1CCC[C@@H](Nc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000514187149 942812397 /nfs/dbraw/zinc/81/23/97/942812397.db2.gz OWGLGVLEYHVRPT-CMPLNLGQSA-N 0 0 359.348 3.673 20 5 FHBDRN CC(C)[C@H]1C[C@@H](CC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)CCO1 ZINC000514188330 942815476 /nfs/dbraw/zinc/81/54/76/942815476.db2.gz CXAMUQDRYMMNFJ-PKOBYXMFSA-N 0 0 362.470 3.875 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N1CC[C@@H](O)[C@H]1c1ccc(Cl)cc1 ZINC000425112234 942816262 /nfs/dbraw/zinc/81/62/62/942816262.db2.gz ZDDVNZZZGGMAQK-IEBWSBKVSA-N 0 0 374.824 3.515 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N[C@@H](C)c1nc2ccccc2n1C ZINC000421774810 942817023 /nfs/dbraw/zinc/81/70/23/942817023.db2.gz VLUOAWPBIFWGGX-ZDUSSCGKSA-N 0 0 352.394 3.589 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N1CCC[C@H](Oc2ccccc2)C1 ZINC000413959669 942820481 /nfs/dbraw/zinc/82/04/81/942820481.db2.gz TULBZIXAMPFRTD-INIZCTEOSA-N 0 0 370.405 3.677 20 5 FHBDRN Cc1cccc(C(=O)N2CCCN([C@@H](C)c3ccccc3[N+](=O)[O-])CC2)c1 ZINC000434640019 942830814 /nfs/dbraw/zinc/83/08/14/942830814.db2.gz XRDPYGMFWMLNAZ-KRWDZBQOSA-N 0 0 367.449 3.812 20 5 FHBDRN O=C(NCCCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1cccs1 ZINC000514223137 942833567 /nfs/dbraw/zinc/83/35/67/942833567.db2.gz UPJZRNQDTAEURW-UHFFFAOYSA-N 0 0 373.356 3.907 20 5 FHBDRN CCCC(=O)NC[C@H]1CCCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000514223162 942833671 /nfs/dbraw/zinc/83/36/71/942833671.db2.gz UZWQCQOPYOBBBB-GFCCVEGCSA-N 0 0 373.375 3.746 20 5 FHBDRN O=C(N[C@@H]1CC[C@@H]2CCC[C@@H]2C1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514227897 942837854 /nfs/dbraw/zinc/83/78/54/942837854.db2.gz WSBGEERBLSXPKB-DMDPSCGWSA-N 0 0 354.353 3.895 20 5 FHBDRN Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)N[C@H]1CCCC[C@@H]1n1cccn1 ZINC000367093076 942839622 /nfs/dbraw/zinc/83/96/22/942839622.db2.gz RFRZTKJDTOPXKW-ZFWWWQNUSA-N 0 0 361.377 3.544 20 5 FHBDRN O=[N+]([O-])c1ccc(OCCN[C@H](c2cc(F)ccc2F)C(F)F)cc1 ZINC000434660038 942843120 /nfs/dbraw/zinc/84/31/20/942843120.db2.gz AELICEUPODIGNJ-OAHLLOKOSA-N 0 0 358.291 3.848 20 5 FHBDRN COC[C@H](Cc1ccccc1)N(C)C(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000190192656 942850131 /nfs/dbraw/zinc/85/01/31/942850131.db2.gz PKWYXITUDQXJLG-BEFAXECRSA-N 0 0 371.437 3.555 20 5 FHBDRN COc1ccc(OCc2noc(-c3ccc(Cl)cc3)n2)cc1[N+](=O)[O-] ZINC000190197114 942853523 /nfs/dbraw/zinc/85/35/23/942853523.db2.gz ADMWNZJPJKNAGG-UHFFFAOYSA-N 0 0 361.741 3.886 20 5 FHBDRN COc1cc(-c2noc(COc3ccc(OC)c([N+](=O)[O-])c3)n2)ccc1C ZINC000190181549 942854850 /nfs/dbraw/zinc/85/48/50/942854850.db2.gz ZBZGTEDEWNVYGE-UHFFFAOYSA-N 0 0 371.349 3.549 20 5 FHBDRN COC(=O)c1cnoc1COc1ccc([N+](=O)[O-])cc1Cc1ccccc1 ZINC000505468175 942861442 /nfs/dbraw/zinc/86/14/42/942861442.db2.gz SRMLUEPKRIHPDQ-UHFFFAOYSA-N 0 0 368.345 3.539 20 5 FHBDRN COc1cc(CN[C@H](c2cc(F)ccc2F)C(F)F)ccc1[N+](=O)[O-] ZINC000434688370 942865872 /nfs/dbraw/zinc/86/58/72/942865872.db2.gz LJPUGVKEYUSOIM-OAHLLOKOSA-N 0 0 358.291 3.978 20 5 FHBDRN CC(C)(CNC(=O)c1c([N+](=O)[O-])cccc1C(F)(F)F)OCC1CC1 ZINC000413996436 942875531 /nfs/dbraw/zinc/87/55/31/942875531.db2.gz AZQNRUHBSRYFLW-UHFFFAOYSA-N 0 0 360.332 3.549 20 5 FHBDRN C[C@H]1C[C@H](C(F)(F)F)CCN1C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412379347 942877739 /nfs/dbraw/zinc/87/77/39/942877739.db2.gz GMYCVDAUDRARAT-MMMKDXCPSA-N 0 0 356.344 3.888 20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])N1CCC[C@@H](CC(F)(F)F)C1 ZINC000421936183 942886847 /nfs/dbraw/zinc/88/68/47/942886847.db2.gz GJCYHYMRKJCOKX-LBPRGKRZSA-N 0 0 359.348 3.588 20 5 FHBDRN COC(=O)c1cccc(Cl)c1Cn1nc(C)c2cc([N+](=O)[O-])ccc21 ZINC000505492703 942910388 /nfs/dbraw/zinc/91/03/88/942910388.db2.gz CQCGRXIQPYHIKF-UHFFFAOYSA-N 0 0 359.769 3.741 20 5 FHBDRN CS(=O)(=O)c1ccc(N2CCC[C@H](c3ccccc3)CC2)c([N+](=O)[O-])c1 ZINC000066818496 942915995 /nfs/dbraw/zinc/91/59/95/942915995.db2.gz DUQKNLBLCDAMOD-INIZCTEOSA-N 0 0 374.462 3.772 20 5 FHBDRN O=C(c1ccccc1)N1CCC(CNc2cccc(F)c2[N+](=O)[O-])CC1 ZINC000078021241 942916806 /nfs/dbraw/zinc/91/68/06/942916806.db2.gz PLODBHNKTCIWBN-UHFFFAOYSA-N 0 0 357.385 3.698 20 5 FHBDRN CN([C@@H]1CCC[C@@H]1c1ccccc1)S(=O)(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000416538778 942927853 /nfs/dbraw/zinc/92/78/53/942927853.db2.gz BVDSOXLOIXLDRH-RTBURBONSA-N 0 0 374.462 3.693 20 5 FHBDRN Cc1cc(F)c([N+](=O)[O-])cc1C(=O)N[C@H]1CCO[C@H](c2ccccc2)C1 ZINC001269854057 942935213 /nfs/dbraw/zinc/93/52/13/942935213.db2.gz NOJQJFQIEUEPSS-KSSFIOAISA-N 0 0 358.369 3.692 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)Nc1ccc(OCC2CC2)cc1 ZINC000503065870 942947721 /nfs/dbraw/zinc/94/77/21/942947721.db2.gz MBFILQPSSRAZHZ-UHFFFAOYSA-N 0 0 355.394 3.748 20 5 FHBDRN CC(C)Cn1cnnc1[C@H]1CCCN1c1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000078022035 942948644 /nfs/dbraw/zinc/94/86/44/942948644.db2.gz KOJONBDWXPIKMU-QGZVFWFLSA-N 0 0 366.425 3.732 20 5 FHBDRN Cc1cc(Br)cc([N+](=O)[O-])c1OCc1nn(C)cc1Cl ZINC000577379386 942954673 /nfs/dbraw/zinc/95/46/73/942954673.db2.gz CURYNCLPQMPGKT-UHFFFAOYSA-N 0 0 360.595 3.632 20 5 FHBDRN Cc1cc(C)cc(CN(C)S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000434780816 942955256 /nfs/dbraw/zinc/95/52/56/942955256.db2.gz AZZGFSCTFPSHCJ-UHFFFAOYSA-N 0 0 368.842 3.686 20 5 FHBDRN Cc1c(CNC(=O)c2sccc2Br)cccc1[N+](=O)[O-] ZINC000231862799 942982464 /nfs/dbraw/zinc/98/24/64/942982464.db2.gz HOAWRBLLISTKEL-UHFFFAOYSA-N 0 0 355.213 3.657 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)c1cnn(C)c1C ZINC000503117566 942986259 /nfs/dbraw/zinc/98/62/59/942986259.db2.gz NQFWHNNDLJWLQN-NSHDSACASA-N 0 0 362.455 3.630 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)c1cn(C)nc1C ZINC000503120867 942987976 /nfs/dbraw/zinc/98/79/76/942987976.db2.gz UXJBNFRHYZZHLX-NSHDSACASA-N 0 0 362.455 3.630 20 5 FHBDRN COc1ccc(NC(=O)c2ccc(Br)cc2[N+](=O)[O-])cc1F ZINC000430057604 942994387 /nfs/dbraw/zinc/99/43/87/942994387.db2.gz HAUUHBPWWDBMRR-UHFFFAOYSA-N 0 0 369.146 3.757 20 5 FHBDRN O=C(CN1CC[C@@H]1c1ccc(Cl)cc1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000511572394 943003044 /nfs/dbraw/zinc/00/30/44/943003044.db2.gz DLDKONZVVNVDTD-QGZVFWFLSA-N 0 0 371.824 3.584 20 5 FHBDRN O=C(NCCCO[C@@H]1CCCc2ccccc21)c1ccc([N+](=O)[O-])s1 ZINC000505544858 943003541 /nfs/dbraw/zinc/00/35/41/943003541.db2.gz JQPBWHATLAFPFI-OAHLLOKOSA-N 0 0 360.435 3.870 20 5 FHBDRN COc1cc(C(=O)NC[C@H]2CCCCC(F)(F)C2)c([N+](=O)[O-])cc1OC ZINC000293747662 943007513 /nfs/dbraw/zinc/00/75/13/943007513.db2.gz VYPFYMTYKIMBDF-NSHDSACASA-N 0 0 372.368 3.557 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1OCC(=O)NCCCSc1ccccc1 ZINC000514428191 943008035 /nfs/dbraw/zinc/00/80/35/943008035.db2.gz VIKMZIQBDWNQAR-UHFFFAOYSA-N 0 0 360.435 3.581 20 5 FHBDRN CC(=O)c1c(C)[nH]c(C(=O)Nc2cc(C)nc3ccc([N+](=O)[O-])cc32)c1C ZINC000183689111 943017398 /nfs/dbraw/zinc/01/73/98/943017398.db2.gz SWQURZPHKGKQJI-UHFFFAOYSA-N 0 0 366.377 3.851 20 5 FHBDRN CC(C)c1ccc(C(=O)N2CCN[C@@H](c3cccc(F)c3)C2)cc1[N+](=O)[O-] ZINC000505552392 943017845 /nfs/dbraw/zinc/01/78/45/943017845.db2.gz ZEGUZJJNPXOSAM-GOSISDBHSA-N 0 0 371.412 3.644 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2C[C@H]3[C@@H]4C=C[C@@H](C4)[C@]3(C)C2)ccc1[N+](=O)[O-] ZINC000412388264 943020169 /nfs/dbraw/zinc/02/01/69/943020169.db2.gz XLNKFBFYRWJGPO-XXLXZOJFSA-N 0 0 356.422 3.666 20 5 FHBDRN O=[N+]([O-])c1ccc(NCCc2ccc(-n3cccn3)cc2)c2ccncc21 ZINC000014315664 943023593 /nfs/dbraw/zinc/02/35/93/943023593.db2.gz AFVPUHGTOVYSGQ-UHFFFAOYSA-N 0 0 359.389 3.983 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NCC(=O)NCCc1ccc(C(C)C)cc1 ZINC000105020046 943031094 /nfs/dbraw/zinc/03/10/94/943031094.db2.gz JGOKCPYAGGNWDD-UHFFFAOYSA-N 0 0 355.438 3.797 20 5 FHBDRN CCNc1ccc(C(=O)NC[C@H](c2cccnc2)C(C)C)cc1[N+](=O)[O-] ZINC000434169501 943037987 /nfs/dbraw/zinc/03/79/87/943037987.db2.gz JJOSFLFCESQBNW-INIZCTEOSA-N 0 0 356.426 3.591 20 5 FHBDRN Cc1ccc(OCCCc2nc(Cc3ccc([N+](=O)[O-])cn3)no2)c(C)c1 ZINC000273788613 943038844 /nfs/dbraw/zinc/03/88/44/943038844.db2.gz AQFQSVDLCLLDCT-UHFFFAOYSA-N 0 0 368.393 3.592 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC[C@@H](Oc2ccccc2)C1 ZINC000416715903 943053001 /nfs/dbraw/zinc/05/30/01/943053001.db2.gz ADNGPGNKLOGQEE-MRXNPFEDSA-N 0 0 371.393 3.679 20 5 FHBDRN CC(C)CC(C)(C)CNC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000434188688 943055975 /nfs/dbraw/zinc/05/59/75/943055975.db2.gz JSWKTOFUBNMPQR-UHFFFAOYSA-N 0 0 361.486 4.000 20 5 FHBDRN Cc1cc(CNC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc(C)n1 ZINC000422212403 943056458 /nfs/dbraw/zinc/05/64/58/943056458.db2.gz QUAOZKPUPMOAGP-UHFFFAOYSA-N 0 0 356.426 3.727 20 5 FHBDRN O=C(NC1(Cc2ccc(F)cc2)CC1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412394085 943057305 /nfs/dbraw/zinc/05/73/05/943057305.db2.gz FHSSMJYWMDLPRF-ZWKOTPCHSA-N 0 0 354.381 3.729 20 5 FHBDRN CC(C)[C@@H]1CCC[C@H](NC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)CC1 ZINC000183886633 943065316 /nfs/dbraw/zinc/06/53/16/943065316.db2.gz VOAQVYNZNCEJAY-KGLIPLIRSA-N 0 0 371.437 3.771 20 5 FHBDRN COc1cc(CN(Cc2ccc(F)cc2)C2CC2)c([N+](=O)[O-])cc1OC ZINC000434979794 943082792 /nfs/dbraw/zinc/08/27/92/943082792.db2.gz XFVBDPJYUXLMFN-UHFFFAOYSA-N 0 0 360.385 3.916 20 5 FHBDRN Cc1c(Cl)cc(S(=O)(=O)N(C)[C@H]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000514537130 943093244 /nfs/dbraw/zinc/09/32/44/943093244.db2.gz JVTOAFJSJIIGBV-YGRLFVJLSA-N 0 0 360.863 3.756 20 5 FHBDRN C[C@@H](NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)c1nc2c(s1)CCC2 ZINC000412417036 943098156 /nfs/dbraw/zinc/09/81/56/943098156.db2.gz MDUQROLTMNUQTF-DDTOSNHZSA-N 0 0 357.435 3.521 20 5 FHBDRN O=C(N[C@H]1CCOc2c(F)cccc21)C1(c2ccc([N+](=O)[O-])cc2)CCC1 ZINC001269329294 943098563 /nfs/dbraw/zinc/09/85/63/943098563.db2.gz OGVDCFHBLCTFCI-KRWDZBQOSA-N 0 0 370.380 3.796 20 5 FHBDRN COc1cccc(N(CC(C)C)C(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])c1 ZINC000434192327 943109244 /nfs/dbraw/zinc/10/92/44/943109244.db2.gz XGKWEJAKJYJSSN-UHFFFAOYSA-N 0 0 360.414 3.753 20 5 FHBDRN CCCOc1ccc(CCC(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)cc1 ZINC000536254384 943120277 /nfs/dbraw/zinc/12/02/77/943120277.db2.gz WORLVPWHAIHQHK-UHFFFAOYSA-N 0 0 368.393 3.831 20 5 FHBDRN O=C(N[C@@H]1C[C@@H]1c1ccccc1C(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000505594365 943126782 /nfs/dbraw/zinc/12/67/82/943126782.db2.gz SQUVVQMKSOKEEA-UKRRQHHQSA-N 0 0 350.296 3.900 20 5 FHBDRN CC(C)c1cc(C(=O)NCc2ccc([N+](=O)[O-])cc2)nn1-c1ccccc1 ZINC000435054086 943126847 /nfs/dbraw/zinc/12/68/47/943126847.db2.gz AHSCAQVKCZFAOX-UHFFFAOYSA-N 0 0 364.405 3.834 20 5 FHBDRN Cc1nn(C)c(Nc2ccc3c(c2)N(CC(F)F)CCS3)c1[N+](=O)[O-] ZINC000514594549 943133636 /nfs/dbraw/zinc/13/36/36/943133636.db2.gz XFFSDXDYMNWHLZ-UHFFFAOYSA-N 0 0 369.397 3.558 20 5 FHBDRN CC(C)[C@H](C)N(C(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)C1CC1 ZINC000514593918 943135570 /nfs/dbraw/zinc/13/55/70/943135570.db2.gz YUPWHLQKORRSHD-ZDUSSCGKSA-N 0 0 358.442 3.837 20 5 FHBDRN C[C@@H](CCNc1ccc(CC(=O)[O-])cc1[N+](=O)[O-])[N@H+](C)Cc1ccccc1 ZINC000514604643 943143134 /nfs/dbraw/zinc/14/31/34/943143134.db2.gz IBSNTZLLHPGEFX-HNNXBMFYSA-N 0 0 371.437 3.544 20 5 FHBDRN CCCCn1ncc(C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)c1C ZINC000435074796 943144650 /nfs/dbraw/zinc/14/46/50/943144650.db2.gz LRQKTJJYZJIPEL-UHFFFAOYSA-N 0 0 358.442 3.653 20 5 FHBDRN O=[N+]([O-])c1cccc(F)c1CN1CCN(Cc2ccc(Cl)cc2)CC1 ZINC000505601507 943157011 /nfs/dbraw/zinc/15/70/11/943157011.db2.gz GQWYUBRVRSNRIN-UHFFFAOYSA-N 0 0 363.820 3.705 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CCn2c(C(C)C)nnc2[C@H]1C ZINC000190406069 943157243 /nfs/dbraw/zinc/15/72/43/943157243.db2.gz WULUOSGFOHPDTB-CYBMUJFWSA-N 0 0 372.429 3.535 20 5 FHBDRN Cc1ccc(N(C(C)C)S(=O)(=O)CCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000503436289 943183367 /nfs/dbraw/zinc/18/33/67/943183367.db2.gz OVZGKDNMRIDCRB-UHFFFAOYSA-N 0 0 362.451 3.691 20 5 FHBDRN C[C@H](c1ccc(F)cc1F)N1CCN(c2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000505611278 943185658 /nfs/dbraw/zinc/18/56/58/943185658.db2.gz QYTCUTICCSMPOT-GFCCVEGCSA-N 0 0 365.355 3.895 20 5 FHBDRN O=[N+]([O-])c1cc(Br)cnc1N1CCC(c2ccncc2)CC1 ZINC000277219928 943185743 /nfs/dbraw/zinc/18/57/43/943185743.db2.gz RQLRMHJUQREQGQ-UHFFFAOYSA-N 0 0 363.215 3.531 20 5 FHBDRN CCOC(=O)c1cc(C(=O)N[C@H](C)[C@@H](C)c2ccccc2)cc([N+](=O)[O-])c1 ZINC000473552259 943204735 /nfs/dbraw/zinc/20/47/35/943204735.db2.gz YLQKDWOKUYTQKI-ZIAGYGMSSA-N 0 0 370.405 3.694 20 5 FHBDRN CC(=O)c1ccc([N+](=O)[O-])cc1N1CCN(Cc2cccc(Cl)c2)CC1 ZINC000514686611 943216169 /nfs/dbraw/zinc/21/61/69/943216169.db2.gz HZMQDZDAVLTEOJ-UHFFFAOYSA-N 0 0 373.840 3.773 20 5 FHBDRN Cc1c(NC(=O)NC(C)(C)c2nc3ccccc3n2C)cccc1[N+](=O)[O-] ZINC000183940634 943217299 /nfs/dbraw/zinc/21/72/99/943217299.db2.gz QZOQHDVNNUOAEB-UHFFFAOYSA-N 0 0 367.409 3.847 20 5 FHBDRN Cc1c(NCC(=O)N2CCC(Cc3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000510019902 943217465 /nfs/dbraw/zinc/21/74/65/943217465.db2.gz PSOCMWAVUWUFRL-UHFFFAOYSA-N 0 0 367.449 3.796 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)COC(=O)/C=C\Sc1ccccc1 ZINC000214970307 943217799 /nfs/dbraw/zinc/21/77/99/943217799.db2.gz VFKLKWJGFRUMIG-KTKRTIGZSA-N 0 0 372.402 3.691 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CC3(CCC3)[C@H]2C2CCOCC2)cc1OC(F)F ZINC000425289940 943219107 /nfs/dbraw/zinc/21/91/07/943219107.db2.gz ZRYHMFHTVGVIAU-MRXNPFEDSA-N 0 0 368.380 3.982 20 5 FHBDRN C[C@@H]1[C@H](C(=O)Nc2cc3c(cc2[N+](=O)[O-])OCCCO3)[C@H]1c1ccccc1 ZINC000430125987 943220677 /nfs/dbraw/zinc/22/06/77/943220677.db2.gz UZERUGBXZSMZIW-RQUSPXKASA-N 0 0 368.389 3.744 20 5 FHBDRN Cc1ccccc1[C@@H](C)N(C)C(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000503502568 943223023 /nfs/dbraw/zinc/22/30/23/943223023.db2.gz PETBOOGRUFIMTD-OAHLLOKOSA-N 0 0 364.405 3.922 20 5 FHBDRN CSc1cccc(C(=O)NCCCSc2ccccn2)c1[N+](=O)[O-] ZINC000425298553 943238019 /nfs/dbraw/zinc/23/80/19/943238019.db2.gz QTSZDGPDWHOTMN-UHFFFAOYSA-N 0 0 363.464 3.624 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc2c(c1)C(=O)CCO2 ZINC000365856895 943259756 /nfs/dbraw/zinc/25/97/56/943259756.db2.gz KCTMLSRUGHSOHF-UHFFFAOYSA-N 0 0 372.402 3.924 20 5 FHBDRN O=C(Nc1cc(Cl)cnc1Br)c1cccc([N+](=O)[O-])c1 ZINC000312362670 943291556 /nfs/dbraw/zinc/29/15/56/943291556.db2.gz KKWCLLJFBNOGAK-UHFFFAOYSA-N 0 0 356.563 3.658 20 5 FHBDRN CC(=O)c1ccc2c(c1)CN(C(=O)Nc1cc(C)c([N+](=O)[O-])cc1C)C2 ZINC000417033546 943309743 /nfs/dbraw/zinc/30/97/43/943309743.db2.gz DIKPTUSGMLGJKY-UHFFFAOYSA-N 0 0 353.378 3.962 20 5 FHBDRN Cc1cccc(CNC(=O)c2ccc(C)c([N+](=O)[O-])c2)c1Br ZINC001269415348 943316167 /nfs/dbraw/zinc/31/61/67/943316167.db2.gz WNBZWTXPYMDSFS-UHFFFAOYSA-N 0 0 363.211 3.904 20 5 FHBDRN Cc1c(NC(=O)N2CCC23CCC3)cc(Br)cc1[N+](=O)[O-] ZINC000435322874 943323681 /nfs/dbraw/zinc/32/36/81/943323681.db2.gz HPSDLPJPCHXKRP-UHFFFAOYSA-N 0 0 354.204 3.826 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(C(C)=O)cn1 ZINC000503680811 943329001 /nfs/dbraw/zinc/32/90/01/943329001.db2.gz OXWQKPORHBEHIQ-UHFFFAOYSA-N 0 0 359.407 3.947 20 5 FHBDRN Cc1c(NC(=O)N[C@@H]2CS[C@H](C)C2)cc(Br)cc1[N+](=O)[O-] ZINC000417075076 943329088 /nfs/dbraw/zinc/32/90/88/943329088.db2.gz LPBSUDIXTLQCIZ-XCBNKYQSSA-N 0 0 374.260 3.681 20 5 FHBDRN Cc1c(NC(=O)N2CC[C@](C)(F)C2)cc(Br)cc1[N+](=O)[O-] ZINC000435330531 943333789 /nfs/dbraw/zinc/33/37/89/943333789.db2.gz UEFMUQYANWLSKX-ZDUSSCGKSA-N 0 0 360.183 3.632 20 5 FHBDRN CCn1c(=O)c2ccccc2nc1SCCc1ccc([N+](=O)[O-])cc1 ZINC000042129631 943341995 /nfs/dbraw/zinc/34/19/95/943341995.db2.gz YZMBJXDRCLMEFT-UHFFFAOYSA-N 0 0 355.419 3.659 20 5 FHBDRN C[C@@H]1CC[C@@H](NC(=O)c2cccc([N+](=O)[O-])c2Br)[C@H](C)C1 ZINC000159115683 943354556 /nfs/dbraw/zinc/35/45/56/943354556.db2.gz GEUUYTIUHILGJN-CKYFFXLPSA-N 0 0 355.232 3.912 20 5 FHBDRN CCN(C(=O)c1cc(OC)c(F)cc1[N+](=O)[O-])c1ccc2[nH]ccc2c1 ZINC001269431188 943358908 /nfs/dbraw/zinc/35/89/08/943358908.db2.gz UVALCAMQKMYJNZ-UHFFFAOYSA-N 0 0 357.341 3.891 20 5 FHBDRN COc1ccc(CNC(=O)N2CC[C@@H](c3ccccc3)[C@H]2C)cc1[N+](=O)[O-] ZINC000435384568 943372294 /nfs/dbraw/zinc/37/22/94/943372294.db2.gz NEEJBKHHVSAMDV-RHSMWYFYSA-N 0 0 369.421 3.691 20 5 FHBDRN O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)N1CC(C2CCCC2)C1 ZINC000431924722 943374796 /nfs/dbraw/zinc/37/47/96/943374796.db2.gz KWDJEXSLRVEJBW-UHFFFAOYSA-N 0 0 355.341 3.850 20 5 FHBDRN O=C(CCOc1ccc(F)cc1Cl)NCCc1ccc([N+](=O)[O-])cc1 ZINC000053218881 943380199 /nfs/dbraw/zinc/38/01/99/943380199.db2.gz JUKMZIPYYXXDAL-UHFFFAOYSA-N 0 0 366.776 3.515 20 5 FHBDRN CSc1ccc(Cl)c(C(=O)NCCc2ccc([N+](=O)[O-])cc2)c1 ZINC000053215875 943381449 /nfs/dbraw/zinc/38/14/49/943381449.db2.gz ABTFBWKQENMQCG-UHFFFAOYSA-N 0 0 350.827 3.943 20 5 FHBDRN Cc1ccc(S(=O)(=O)N2CCC[C@H]2/C=C/c2ccccc2)cc1[N+](=O)[O-] ZINC000503861954 943390130 /nfs/dbraw/zinc/39/01/30/943390130.db2.gz PGNULQIKABMWNE-DVQDXYAYSA-N 0 0 372.446 3.770 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@H](C2CCC2)C1 ZINC000412465871 943392595 /nfs/dbraw/zinc/39/25/95/943392595.db2.gz UONUJTYOZAVMLE-MRXNPFEDSA-N 0 0 364.467 3.736 20 5 FHBDRN O=C1[C@H](N2CC[C@H]2c2ccc(Cl)cc2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000511608987 943412812 /nfs/dbraw/zinc/41/28/12/943412812.db2.gz FEAZSLNULLREAI-ZWKOTPCHSA-N 0 0 371.824 3.801 20 5 FHBDRN O=C1[C@@H](N2CC[C@@H]2c2ccc(Cl)cc2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000511608984 943412885 /nfs/dbraw/zinc/41/28/85/943412885.db2.gz FEAZSLNULLREAI-MSOLQXFVSA-N 0 0 371.824 3.801 20 5 FHBDRN CC(=O)CCc1ccc(OCCC(=O)Oc2c(C)cccc2[N+](=O)[O-])cc1 ZINC000760018414 943415234 /nfs/dbraw/zinc/41/52/34/943415234.db2.gz QGBUEQHWFVMPID-UHFFFAOYSA-N 0 0 371.389 3.799 20 5 FHBDRN Cc1cnn(-c2ccc(C)cc2NC(=O)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000435445843 943421242 /nfs/dbraw/zinc/42/12/42/943421242.db2.gz YCHPKOUOAVYWIG-UHFFFAOYSA-N 0 0 364.405 3.969 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NCc1cc(F)ccc1F ZINC000105285184 943439105 /nfs/dbraw/zinc/43/91/05/943439105.db2.gz FHMBJVASQQMFTJ-UHFFFAOYSA-N 0 0 363.364 3.993 20 5 FHBDRN C[C@@H](NC(=O)N1CC[C@H](COc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000503981346 943451290 /nfs/dbraw/zinc/45/12/90/943451290.db2.gz IRQQRUMPNAORPC-CVEARBPZSA-N 0 0 369.421 3.766 20 5 FHBDRN COc1cc(C)c(Br)cc1NC(=O)c1csc([N+](=O)[O-])c1 ZINC000183954338 943461332 /nfs/dbraw/zinc/46/13/32/943461332.db2.gz BZYFFDHJCLLELT-UHFFFAOYSA-N 0 0 371.212 3.988 20 5 FHBDRN C[C@H](NC(=O)N1CC[C@](F)(c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000515039289 943467906 /nfs/dbraw/zinc/46/79/06/943467906.db2.gz DTEWTWCENOSERG-IFXJQAMLSA-N 0 0 357.385 3.936 20 5 FHBDRN Cc1ccc(COC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)c(C)c1 ZINC001269481197 943473951 /nfs/dbraw/zinc/47/39/51/943473951.db2.gz OFHQXHPTAIZCMX-UHFFFAOYSA-N 0 0 351.362 3.754 20 5 FHBDRN CCC[C@@H](Cc1ccccc1)Nc1ccc([N+](=O)[O-])cc1S(C)(=O)=O ZINC000468708919 943492072 /nfs/dbraw/zinc/49/20/72/943492072.db2.gz GHXSZKQSJXWWFX-HNNXBMFYSA-N 0 0 362.451 3.822 20 5 FHBDRN CC(C)(C)C(=O)NCC(=O)OCc1nc2ccccc2c2ccccc12 ZINC000017177164 943502037 /nfs/dbraw/zinc/50/20/37/943502037.db2.gz HLWBQSVUGDETMF-UHFFFAOYSA-N 0 0 350.418 3.594 20 5 FHBDRN O=C(NC1CC1)c1ccc(N[C@H]2C[C@H](c3ccccc3F)C2)c([N+](=O)[O-])c1 ZINC000435586134 943504826 /nfs/dbraw/zinc/50/48/26/943504826.db2.gz XSMZVWRKCZGGDY-CTYIDZIISA-N 0 0 369.396 3.984 20 5 FHBDRN O=C(c1ccc(Cl)cc1[N+](=O)[O-])N1CC[C@H](COc2ccccc2)C1 ZINC000504141988 943512411 /nfs/dbraw/zinc/51/24/11/943512411.db2.gz RRUANWAKJPJHAT-ZDUSSCGKSA-N 0 0 360.797 3.789 20 5 FHBDRN Cn1c2ccc(N[C@@H]3CCCCc4ccc([N+](=O)[O-])cc43)cc2n(C)c1=O ZINC000417323683 943515515 /nfs/dbraw/zinc/51/55/15/943515515.db2.gz YNIXITHGGQGJAZ-QGZVFWFLSA-N 0 0 366.421 3.665 20 5 FHBDRN CCCN(Cc1ccc(C)cc1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1C ZINC000515207905 943568052 /nfs/dbraw/zinc/56/80/52/943568052.db2.gz HPVGJKMTGJMOEE-UHFFFAOYSA-N 0 0 362.451 3.813 20 5 FHBDRN Cc1cccc(C)c1OCCC(=O)N1c2ccc([N+](=O)[O-])cc2C[C@@H]1C ZINC000504265354 943573553 /nfs/dbraw/zinc/57/35/53/943573553.db2.gz CLBNDGFCTGEHHZ-HNNXBMFYSA-N 0 0 354.406 3.958 20 5 FHBDRN COc1cc2nc(C)sc2cc1NC(=O)c1cccc(OC)c1[N+](=O)[O-] ZINC000435730400 943573688 /nfs/dbraw/zinc/57/36/88/943573688.db2.gz YCKLYEKLXRSQBZ-UHFFFAOYSA-N 0 0 373.390 3.782 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N(C)Cc1cc(F)cc(F)c1 ZINC000434223218 943584505 /nfs/dbraw/zinc/58/45/05/943584505.db2.gz RATAHSCHAMKAMJ-UHFFFAOYSA-N 0 0 351.309 3.546 20 5 FHBDRN Cc1cc(Cl)ccc1OCC(=O)N1c2ccc([N+](=O)[O-])cc2C[C@@H]1C ZINC000504324478 943594880 /nfs/dbraw/zinc/59/48/80/943594880.db2.gz JJFCQVOHJJDCAP-LBPRGKRZSA-N 0 0 360.797 3.913 20 5 FHBDRN COC(=O)[C@@H](C)c1ccc(NC(=O)N(C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000417428655 943603108 /nfs/dbraw/zinc/60/31/08/943603108.db2.gz HSKNPSSSQLNVRT-ZDUSSCGKSA-N 0 0 371.393 3.535 20 5 FHBDRN Cc1cc(OCC(=O)Nc2ccc(O)c(C(F)(F)F)c2)ccc1[N+](=O)[O-] ZINC000435757989 943605927 /nfs/dbraw/zinc/60/59/27/943605927.db2.gz DKHLIHHZKCYLJZ-UHFFFAOYSA-N 0 0 370.283 3.645 20 5 FHBDRN CCOc1ccc(CCC(=O)N2c3ccc([N+](=O)[O-])cc3C[C@@H]2C)cc1 ZINC000504377001 943609187 /nfs/dbraw/zinc/60/91/87/943609187.db2.gz SPKNDLVEIMQIHI-AWEZNQCLSA-N 0 0 354.406 3.904 20 5 FHBDRN CCc1ccc(CNC(=O)c2ccc([N+](=O)[O-])cc2Br)s1 ZINC000150713650 943633520 /nfs/dbraw/zinc/63/35/20/943633520.db2.gz HSDHQEYTKMPLGC-UHFFFAOYSA-N 0 0 369.240 3.911 20 5 FHBDRN O=[N+]([O-])c1ccc(Oc2ncc(NC3(C4CCOCC4)CC3)cn2)cc1 ZINC001167743878 943639125 /nfs/dbraw/zinc/63/91/25/943639125.db2.gz RQDXFPGDRZKWBE-UHFFFAOYSA-N 0 0 356.382 3.548 20 5 FHBDRN COc1ccc(NC(=O)Cc2ccccc2C(F)(F)F)c([N+](=O)[O-])c1 ZINC000105364922 943640138 /nfs/dbraw/zinc/64/01/38/943640138.db2.gz HNUKRZSNYSILIF-UHFFFAOYSA-N 0 0 354.284 3.803 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN[C@@H](C)c1ccccc1Cl ZINC000008173436 943652412 /nfs/dbraw/zinc/65/24/12/943652412.db2.gz KACZBIJQIWSRKJ-NSHDSACASA-N 0 0 363.801 3.546 20 5 FHBDRN Cc1cccc(-n2nnnc2SCc2c(F)cccc2[N+](=O)[O-])c1C ZINC000504524981 943655251 /nfs/dbraw/zinc/65/52/51/943655251.db2.gz UATYPWGUSDFUDK-UHFFFAOYSA-N 0 0 359.386 3.619 20 5 FHBDRN O=[N+]([O-])c1ccccc1OCc1nc(C(F)(F)c2ccc(F)cc2)no1 ZINC000584811825 943674582 /nfs/dbraw/zinc/67/45/82/943674582.db2.gz GHHOTIOMYJIUHG-UHFFFAOYSA-N 0 0 365.267 3.836 20 5 FHBDRN CC(C)(C)c1cccc(OCCn2cnc3cc([N+](=O)[O-])ccc3c2=O)c1 ZINC000504562308 943678751 /nfs/dbraw/zinc/67/87/51/943678751.db2.gz BVICCMFWNLULRK-UHFFFAOYSA-N 0 0 367.405 3.681 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)OCCc1cccs1 ZINC000756530821 943696637 /nfs/dbraw/zinc/69/66/37/943696637.db2.gz WUJUUCUBJGJZSI-UHFFFAOYSA-N 0 0 370.224 3.747 20 5 FHBDRN O=[N+]([O-])c1ccc(-n2ccc(-c3nc(Cc4ccc(F)cc4)no3)n2)cc1 ZINC000504639545 943726377 /nfs/dbraw/zinc/72/63/77/943726377.db2.gz SAZJCKRJKOBHEY-UHFFFAOYSA-N 0 0 365.324 3.560 20 5 FHBDRN C[C@@H](CCC(=O)[O-])[NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000417608636 943748739 /nfs/dbraw/zinc/74/87/39/943748739.db2.gz JMHZBDRZSGPBCI-AWEZNQCLSA-N 0 0 357.410 3.706 20 5 FHBDRN COCCSc1ccc([C@@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000504702676 943748984 /nfs/dbraw/zinc/74/89/84/943748984.db2.gz IPFGXWDFUCUNIM-CYBMUJFWSA-N 0 0 360.435 3.824 20 5 FHBDRN CC(C)Sc1ccc([C@@H](C)NC(=O)CCn2cc([N+](=O)[O-])cn2)cc1 ZINC000504701682 943749000 /nfs/dbraw/zinc/74/90/00/943749000.db2.gz BBMRGDPZLAHAME-CYBMUJFWSA-N 0 0 362.455 3.559 20 5 FHBDRN CC(C)c1ccc(C[NH2+][C@H](CCc2ccccc2)C(=O)[O-])cc1[N+](=O)[O-] ZINC000417601370 943752496 /nfs/dbraw/zinc/75/24/96/943752496.db2.gz LIEHQTHADYTQTB-GOSISDBHSA-N 0 0 356.422 3.894 20 5 FHBDRN O=C([O-])C[C@@H](C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C(F)(F)F ZINC000417622369 943759148 /nfs/dbraw/zinc/75/91/48/943759148.db2.gz IKLJMSHDEWKLJR-JTQLQIEISA-N 0 0 372.299 3.598 20 5 FHBDRN Cc1cccc2oc(CCNC(=O)c3ccc(Cl)cc3[N+](=O)[O-])nc21 ZINC000437375305 943759424 /nfs/dbraw/zinc/75/94/24/943759424.db2.gz QXJKVXQUXAJRRC-UHFFFAOYSA-N 0 0 359.769 3.670 20 5 FHBDRN CCNc1ccc(C(=O)N2C[C@H]3CCCN3c3ccccc32)cc1[N+](=O)[O-] ZINC000515283393 943759791 /nfs/dbraw/zinc/75/97/91/943759791.db2.gz BCMYORRRZSKVDF-OAHLLOKOSA-N 0 0 366.421 3.656 20 5 FHBDRN CCSc1ccc([C@H](C)NC(=O)COc2ccccc2[N+](=O)[O-])cc1 ZINC000504695025 943760257 /nfs/dbraw/zinc/76/02/57/943760257.db2.gz MAMYASOHXFQNLM-ZDUSSCGKSA-N 0 0 360.435 3.963 20 5 FHBDRN COc1ccc(CSc2nncn2-c2ccccc2F)cc1[N+](=O)[O-] ZINC000515289237 943763121 /nfs/dbraw/zinc/76/31/21/943763121.db2.gz RJIZRZPJPKUMKI-UHFFFAOYSA-N 0 0 360.370 3.616 20 5 FHBDRN COc1cccc(C(=O)NC[C@H]2CCCC[C@H]2C(F)(F)F)c1[N+](=O)[O-] ZINC000435815518 943772504 /nfs/dbraw/zinc/77/25/04/943772504.db2.gz DICQXEXTOQKVDM-ZYHUDNBSSA-N 0 0 360.332 3.702 20 5 FHBDRN COc1cccc(C(=O)NC[C@@H]2CCCC[C@H]2C(F)(F)F)c1[N+](=O)[O-] ZINC000435815515 943772635 /nfs/dbraw/zinc/77/26/35/943772635.db2.gz DICQXEXTOQKVDM-CMPLNLGQSA-N 0 0 360.332 3.702 20 5 FHBDRN COc1ccc(CCNC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)cc1 ZINC000435818524 943774462 /nfs/dbraw/zinc/77/44/62/943774462.db2.gz MXEDBEDVTHHQEE-UHFFFAOYSA-N 0 0 372.424 3.662 20 5 FHBDRN COc1cccc(C(=O)N2CC[C@@H](Cc3ccccc3)[C@@H]2C)c1[N+](=O)[O-] ZINC000435818462 943775294 /nfs/dbraw/zinc/77/52/94/943775294.db2.gz MPBGCNWPQLZAJZ-HOCLYGCPSA-N 0 0 354.406 3.697 20 5 FHBDRN C[C@H]([C@H]([NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C(=O)[O-])C1CC1 ZINC000417642683 943790623 /nfs/dbraw/zinc/79/06/23/943790623.db2.gz WPSYZVBKFVEIOC-GTNSWQLSSA-N 0 0 360.435 3.912 20 5 FHBDRN CCNc1ccc(C(=O)Nc2nc(-c3ccccn3)cs2)cc1[N+](=O)[O-] ZINC000515326327 943791111 /nfs/dbraw/zinc/79/11/11/943791111.db2.gz JFKLNYFXGAAOOE-UHFFFAOYSA-N 0 0 369.406 3.797 20 5 FHBDRN CC1CCN(C(=O)c2cc(F)cc3c(=O)c4cccc(F)c4[nH]c23)CC1 ZINC000435822259 943794911 /nfs/dbraw/zinc/79/49/11/943794911.db2.gz OAFHLAKWRZENCG-UHFFFAOYSA-N 0 0 356.372 3.832 20 5 FHBDRN COc1cccc(C(=O)NCc2ccc(F)cc2CSC)c1[N+](=O)[O-] ZINC000435822342 943795430 /nfs/dbraw/zinc/79/54/30/943795430.db2.gz PCDSTASFZWBQEP-UHFFFAOYSA-N 0 0 364.398 3.536 20 5 FHBDRN CCOc1ccccc1N1CCN(c2cc([N+](=O)[O-])ccc2C(C)=O)CC1 ZINC000584859777 943799175 /nfs/dbraw/zinc/79/91/75/943799175.db2.gz WXRQKEJHWLFHLF-UHFFFAOYSA-N 0 0 369.421 3.523 20 5 FHBDRN COc1cc(C(=O)N=c2cc(C)n(C3CCCCC3)[nH]2)cc([N+](=O)[O-])c1C ZINC000515334713 943804201 /nfs/dbraw/zinc/80/42/01/943804201.db2.gz FBKLONPEHCMCNY-UHFFFAOYSA-N 0 0 372.425 3.596 20 5 FHBDRN O=C(COc1cccc([N+](=O)[O-])c1)N[C@H]1C[C@H](c2cccc(Cl)c2)C1 ZINC000437448378 943808842 /nfs/dbraw/zinc/80/88/42/943808842.db2.gz PBMCEZSTEQXIDP-CTYIDZIISA-N 0 0 360.797 3.689 20 5 FHBDRN CCCOc1ccccc1NC(=O)N1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000516896248 943813123 /nfs/dbraw/zinc/81/31/23/943813123.db2.gz DLCVVAZZGMASEQ-UHFFFAOYSA-N 0 0 371.393 3.810 20 5 FHBDRN Cc1sc(C(=O)N[C@H]2CCC[C@H]2OCc2ccccc2)cc1[N+](=O)[O-] ZINC000123018710 943821849 /nfs/dbraw/zinc/82/18/49/943821849.db2.gz MQPJOJHUTWULEG-GOEBONIOSA-N 0 0 360.435 3.832 20 5 FHBDRN COc1cccc(C(=O)N(Cc2cscn2)c2ccccc2)c1[N+](=O)[O-] ZINC000435867469 943822727 /nfs/dbraw/zinc/82/27/27/943822727.db2.gz MXJSLMGUIPVVBK-UHFFFAOYSA-N 0 0 369.402 3.907 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@H]1CCCC(F)(F)C1 ZINC000504837868 943826297 /nfs/dbraw/zinc/82/62/97/943826297.db2.gz YHCUWBBOUYKORV-LLVKDONJSA-N 0 0 357.357 3.941 20 5 FHBDRN C[C@@H](NC(=O)N1CCc2c(F)ccc(F)c2C1)c1cccc([N+](=O)[O-])c1 ZINC000437456089 943826494 /nfs/dbraw/zinc/82/64/94/943826494.db2.gz TZODIXNTVOXGLF-LLVKDONJSA-N 0 0 361.348 3.702 20 5 FHBDRN O=[N+]([O-])c1cc(CSCCc2ccc3c(c2)CCO3)c2c(c1)COCO2 ZINC000437458846 943827719 /nfs/dbraw/zinc/82/77/19/943827719.db2.gz GXWMAGACRWAATI-UHFFFAOYSA-N 0 0 373.430 3.872 20 5 FHBDRN CCOc1ccc(OC)cc1NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000105396829 943831715 /nfs/dbraw/zinc/83/17/15/943831715.db2.gz NRFNMTFFVFNURW-UHFFFAOYSA-N 0 0 370.365 3.664 20 5 FHBDRN Cc1cccc(N[C@@H]2CCCN(C(=O)CCC(F)(F)F)C2)c1[N+](=O)[O-] ZINC000515389392 943834322 /nfs/dbraw/zinc/83/43/22/943834322.db2.gz DIQQDWXEYXXXOC-GFCCVEGCSA-N 0 0 359.348 3.649 20 5 FHBDRN CC(C)(C)C1CC(NC(=O)c2ccc([N+](=O)[O-])cc2Br)C1 ZINC000504846523 943838518 /nfs/dbraw/zinc/83/85/18/943838518.db2.gz OEVSQQXUHXLRJV-UHFFFAOYSA-N 0 0 355.232 3.912 20 5 FHBDRN CC1(C)C[C@@H](Nc2ccc(COCCO)cc2)c2cc([N+](=O)[O-])ccc21 ZINC000424319934 943843043 /nfs/dbraw/zinc/84/30/43/943843043.db2.gz RBRWLRFEIXRYLN-LJQANCHMSA-N 0 0 356.422 3.938 20 5 FHBDRN COC(=O)c1cnc([C@H](C)N[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)s1 ZINC000424322179 943844073 /nfs/dbraw/zinc/84/40/73/943844073.db2.gz HZYLIXDPBXYIHA-IINYFYTJSA-N 0 0 361.423 3.566 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1)[C@@H](Nc1ccc(COCCO)cc1)CCCC2 ZINC000424309404 943854617 /nfs/dbraw/zinc/85/46/17/943854617.db2.gz AQIDPUSAEZQPJH-FQEVSTJZSA-N 0 0 356.422 3.983 20 5 FHBDRN Cc1cc(-c2noc(-c3ccc(OC(F)F)c([N+](=O)[O-])c3)n2)ccc1O ZINC000516949322 943855967 /nfs/dbraw/zinc/85/59/67/943855967.db2.gz HAAVFGIPOKZFJI-UHFFFAOYSA-N 0 0 363.276 3.927 20 5 FHBDRN O=C(Nc1ncccc1C(=O)c1ccc(F)cc1)c1ccccc1[N+](=O)[O-] ZINC000515410645 943858574 /nfs/dbraw/zinc/85/85/74/943858574.db2.gz KDKAGOSEAZGJPW-UHFFFAOYSA-N 0 0 365.320 3.612 20 5 FHBDRN COc1cc(Cc2noc([C@@H]3CCC[C@@H](F)C3)n2)c([N+](=O)[O-])c(OC)c1 ZINC000424355009 943861349 /nfs/dbraw/zinc/86/13/49/943861349.db2.gz IOURPLOOSZZYHL-ZYHUDNBSSA-N 0 0 365.361 3.582 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1CN1CCO[C@H](c2ccco2)C1 ZINC000425419177 943864197 /nfs/dbraw/zinc/86/41/97/943864197.db2.gz JLSHTMSUECGICH-HNNXBMFYSA-N 0 0 367.199 3.524 20 5 FHBDRN C[C@H]1CCCC[C@H]1c1nc(-c2ccc(-n3cncn3)c([N+](=O)[O-])c2)no1 ZINC000424359868 943865991 /nfs/dbraw/zinc/86/59/91/943865991.db2.gz IMSXWTBBPTXXDP-WCQYABFASA-N 0 0 354.370 3.519 20 5 FHBDRN C[C@H](NC(=O)N1CC2(CCC2)[C@@H]1C1CCOCC1)c1cccc([N+](=O)[O-])c1 ZINC000425420399 943866557 /nfs/dbraw/zinc/86/65/57/943866557.db2.gz SCUZDQKQPZZBHL-KSSFIOAISA-N 0 0 373.453 3.647 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])N[C@@H]1CC[C@@H](c2ccccc2F)C1 ZINC000435938050 943871429 /nfs/dbraw/zinc/87/14/29/943871429.db2.gz QJDGQFNAGYCPOL-ZIAGYGMSSA-N 0 0 357.385 3.598 20 5 FHBDRN O=C(Nc1ccccn1)c1cc(F)cc2c(=O)c3cccc(F)c3[nH]c12 ZINC000435939413 943872332 /nfs/dbraw/zinc/87/23/32/943872332.db2.gz NQRCLARCJUCXJA-UHFFFAOYSA-N 0 0 351.312 3.607 20 5 FHBDRN CSc1ccc(CCNC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000437512007 943872447 /nfs/dbraw/zinc/87/24/47/943872447.db2.gz HIVMEPKKCONILR-UHFFFAOYSA-N 0 0 364.854 3.872 20 5 FHBDRN CC(C)(C)CN(Cc1ccccc1)C(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 ZINC000504881635 943881269 /nfs/dbraw/zinc/88/12/69/943881269.db2.gz IRVITDPAGSNOQM-UHFFFAOYSA-N 0 0 358.442 3.601 20 5 FHBDRN CSc1ccc(CCNC(=O)c2c(Cl)cccc2[N+](=O)[O-])cc1 ZINC000437523838 943882256 /nfs/dbraw/zinc/88/22/56/943882256.db2.gz DDOGIEKGWKLQCW-UHFFFAOYSA-N 0 0 350.827 3.943 20 5 FHBDRN CSc1ccc(C(=O)N[C@@H]2[C@H]3CCc4ccccc4[C@@H]23)cc1[N+](=O)[O-] ZINC000435968830 943893223 /nfs/dbraw/zinc/89/32/23/943893223.db2.gz XGMRDTCZQWMNOV-BMGDILEWSA-N 0 0 354.431 3.775 20 5 FHBDRN Cc1c(NC(=O)NC2(C(F)F)CC2)cc(Br)cc1[N+](=O)[O-] ZINC000504895745 943893423 /nfs/dbraw/zinc/89/34/23/943893423.db2.gz QIWJRXLJLOMTNX-UHFFFAOYSA-N 0 0 364.146 3.585 20 5 FHBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)[C@H]1CCCOC1 ZINC000504913267 943909267 /nfs/dbraw/zinc/90/92/67/943909267.db2.gz DOXWDTNYASYXLV-KBPBESRZSA-N 0 0 366.483 3.888 20 5 FHBDRN COc1ccc(CC2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000504913648 943909472 /nfs/dbraw/zinc/90/94/72/943909472.db2.gz GCSHKKLRISTNQY-UHFFFAOYSA-N 0 0 354.406 3.698 20 5 FHBDRN COc1ccc(-c2ccc(C[N@@H+]3CCC[C@H](C)[C@H]3C(=O)[O-])o2)c([N+](=O)[O-])c1 ZINC000424414099 943911125 /nfs/dbraw/zinc/91/11/25/943911125.db2.gz GXPZNNWWPMFHHY-SGTLLEGYSA-N 0 0 374.393 3.549 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)NCc2cccc3c2CCCN3)cc1[N+](=O)[O-] ZINC000417859805 943912356 /nfs/dbraw/zinc/91/23/56/943912356.db2.gz WZYQLZMFVGKYDX-AWEZNQCLSA-N 0 0 368.437 3.822 20 5 FHBDRN O=[N+]([O-])c1ccc2c(ccn2Cc2nc(COc3ccccc3F)no2)c1 ZINC000436008496 943924878 /nfs/dbraw/zinc/92/48/78/943924878.db2.gz AHORQHLYMPMAJM-UHFFFAOYSA-N 0 0 368.324 3.699 20 5 FHBDRN COc1ccc(CNCC(F)(F)F)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000500000534 943925103 /nfs/dbraw/zinc/92/51/03/943925103.db2.gz ITRISASYGOVWFH-UHFFFAOYSA-N 0 0 370.327 3.834 20 5 FHBDRN CCOc1ccc([C@H](C)NCc2cc(OC)ccc2OC)cc1[N+](=O)[O-] ZINC000504928773 943925591 /nfs/dbraw/zinc/92/55/91/943925591.db2.gz DJSUINBRFWNADZ-ZDUSSCGKSA-N 0 0 360.410 3.862 20 5 FHBDRN Cc1cc([C@H]2NC(=O)N([C@@H](C)c3ccc(C)c([N+](=O)[O-])c3)C2=O)ccc1F ZINC000431958279 943928253 /nfs/dbraw/zinc/92/82/53/943928253.db2.gz ZEJJVAXPMAGYBC-YVEFUNNKSA-N 0 0 371.368 3.705 20 5 FHBDRN Cc1conc1NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000436003641 943936387 /nfs/dbraw/zinc/93/63/87/943936387.db2.gz BFTQWUROOLAWAK-UHFFFAOYSA-N 0 0 355.375 3.717 20 5 FHBDRN COC[C@@H](NCc1ccc(Br)cc1[N+](=O)[O-])c1ccccc1 ZINC000425438107 943938484 /nfs/dbraw/zinc/93/84/84/943938484.db2.gz ANRDUVHRVGZOSU-OAHLLOKOSA-N 0 0 365.227 3.835 20 5 FHBDRN Cc1cc(OCC(=O)N2C[C@H](C(C)C)Nc3ccccc32)ccc1[N+](=O)[O-] ZINC000437584887 943946105 /nfs/dbraw/zinc/94/61/05/943946105.db2.gz UPUOCISAEKNCNQ-QGZVFWFLSA-N 0 0 369.421 3.765 20 5 FHBDRN COCCn1cc(-c2nc(-c3cccc([N+](=O)[O-])c3)no2)c2ccccc21 ZINC000504980600 943949547 /nfs/dbraw/zinc/94/95/47/943949547.db2.gz LJTLHILDUIUOAU-UHFFFAOYSA-N 0 0 364.361 3.913 20 5 FHBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N(CC2CCCCC2)C2CC2)c(Cl)c1 ZINC000515518310 943950602 /nfs/dbraw/zinc/95/06/02/943950602.db2.gz FJDAXUCWXIZZIS-UHFFFAOYSA-N 0 0 372.874 3.982 20 5 FHBDRN COc1cc(/C=C\c2nc(-c3cccc([N+](=O)[O-])c3)no2)cc(OC)c1 ZINC000505002225 943954901 /nfs/dbraw/zinc/95/49/01/943954901.db2.gz FBXWOLCGOIODFN-SREVYHEPSA-N 0 0 353.334 3.832 20 5 FHBDRN CC(=O)c1cccc(OCCCc2nc(-c3cccc([N+](=O)[O-])c3)no2)c1 ZINC000504985334 943957853 /nfs/dbraw/zinc/95/78/53/943957853.db2.gz FMJKLTJSMZCCKA-UHFFFAOYSA-N 0 0 367.361 3.859 20 5 FHBDRN CC1(C)CN(Cc2ccc(Br)cc2[N+](=O)[O-])[C@@H]1[C@H]1CCCO1 ZINC000425449410 943962385 /nfs/dbraw/zinc/96/23/85/943962385.db2.gz STBCGKRSSPYOCE-HUUCEWRRSA-N 0 0 369.259 3.747 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H](c1ncccc1C)C(C)C ZINC000123040464 943967788 /nfs/dbraw/zinc/96/77/88/943967788.db2.gz RFLXQQBXIUAFQM-MRXNPFEDSA-N 0 0 358.398 3.826 20 5 FHBDRN COc1ccc(CSc2nnc(C(F)(F)F)s2)cc1[N+](=O)[O-] ZINC000436045947 943970477 /nfs/dbraw/zinc/97/04/77/943970477.db2.gz ACKYDOVRJSLWNW-UHFFFAOYSA-N 0 0 351.331 3.766 20 5 FHBDRN O=[N+]([O-])c1ccc(NCCCc2ccc(Br)cc2F)cn1 ZINC000515537294 943971521 /nfs/dbraw/zinc/97/15/21/943971521.db2.gz XEYJMBOSLFTATH-UHFFFAOYSA-N 0 0 354.179 3.936 20 5 FHBDRN Cc1cc(C(=O)NCc2ccnc(OC3CCCCC3)c2)cc([N+](=O)[O-])c1 ZINC000500029955 943971573 /nfs/dbraw/zinc/97/15/73/943971573.db2.gz ONYBEBLQAYDVTQ-UHFFFAOYSA-N 0 0 369.421 3.940 20 5 FHBDRN O=C(N[C@@H]1C[C@@H]1c1ccccc1)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000436049400 943972159 /nfs/dbraw/zinc/97/21/59/943972159.db2.gz XNJGBGZXPBRSCP-DYESRHJHSA-N 0 0 354.409 3.967 20 5 FHBDRN Cc1c(NCc2nc(C(F)F)no2)cc(Br)cc1[N+](=O)[O-] ZINC000424561964 943974707 /nfs/dbraw/zinc/97/47/07/943974707.db2.gz CRMOFNULFXYFCR-UHFFFAOYSA-N 0 0 363.118 3.598 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](CCOC)c1ccco1 ZINC000505022457 943975077 /nfs/dbraw/zinc/97/50/77/943975077.db2.gz AYSKQZMGEHDRHS-CQSZACIVSA-N 0 0 364.423 3.807 20 5 FHBDRN COc1cccc(C(=O)N[C@@H](c2cccc(C)c2)C(F)(F)F)c1[N+](=O)[O-] ZINC000436034137 943976145 /nfs/dbraw/zinc/97/61/45/943976145.db2.gz RUPXBNZJXKYWPY-HNNXBMFYSA-N 0 0 368.311 3.945 20 5 FHBDRN CCOC1CC2(C1)CCN(Cc1ccc(Br)cc1[N+](=O)[O-])C2 ZINC000425457478 943983945 /nfs/dbraw/zinc/98/39/45/943983945.db2.gz KSQFKRKHVCSNFN-UHFFFAOYSA-N 0 0 369.259 3.748 20 5 FHBDRN Cc1cccnc1CNc1c2cc(Br)ccc2ncc1[N+](=O)[O-] ZINC000517090165 944006113 /nfs/dbraw/zinc/00/61/13/944006113.db2.gz BZGCJAFEWSQLJR-UHFFFAOYSA-N 0 0 373.210 3.643 20 5 FHBDRN O=C(N[C@@H](c1nc(-c2cc([N+](=O)[O-])c[nH]2)cs1)C1CC1)c1ccccc1 ZINC000437669260 944023421 /nfs/dbraw/zinc/02/34/21/944023421.db2.gz DBYXTXFDEFNALQ-MRXNPFEDSA-N 0 0 368.418 3.928 20 5 FHBDRN O=C(NCc1ccc2c(n1)CCCC2)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000436111377 944024005 /nfs/dbraw/zinc/02/40/05/944024005.db2.gz OXKHQZVVAUZCLG-UHFFFAOYSA-N 0 0 360.801 3.844 20 5 FHBDRN CC(C)[C@H]1CCC[C@H](NC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)C1 ZINC000505067581 944026463 /nfs/dbraw/zinc/02/64/63/944026463.db2.gz DCOPNVDURFBKMP-HOCLYGCPSA-N 0 0 356.426 3.725 20 5 FHBDRN COc1ccc(CN(C)Cc2cc([N+](=O)[O-])ccc2OC(F)F)cc1 ZINC000505757885 944026471 /nfs/dbraw/zinc/02/64/71/944026471.db2.gz VMNFJXXNSODNDH-UHFFFAOYSA-N 0 0 352.337 3.837 20 5 FHBDRN CC(C)[C@@H]1CCC[C@@H](NC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)C1 ZINC000505067579 944027132 /nfs/dbraw/zinc/02/71/32/944027132.db2.gz DCOPNVDURFBKMP-GDBMZVCRSA-N 0 0 356.426 3.725 20 5 FHBDRN CCOc1cc(Sc2nnc(-c3ccoc3C)n2C)ccc1[N+](=O)[O-] ZINC000092584194 944035052 /nfs/dbraw/zinc/03/50/52/944035052.db2.gz XXUAPVWATMNSSL-UHFFFAOYSA-N 0 0 360.395 3.842 20 5 FHBDRN Cc1sc(C(=O)NCCOc2cccc3ccccc32)cc1[N+](=O)[O-] ZINC000515598696 944036198 /nfs/dbraw/zinc/03/61/98/944036198.db2.gz PLMALZRRSCDDTN-UHFFFAOYSA-N 0 0 356.403 3.927 20 5 FHBDRN Cc1ccc(C(=O)OCCOc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)nc1 ZINC000126553569 944037346 /nfs/dbraw/zinc/03/73/46/944037346.db2.gz AFMKPJRDCXZNJX-UHFFFAOYSA-N 0 0 370.283 3.553 20 5 FHBDRN Cc1ccc(S[C@H](C)C(=O)NCCNc2ccc([N+](=O)[O-])cc2)cc1 ZINC000008175744 944039094 /nfs/dbraw/zinc/03/90/94/944039094.db2.gz RZUPKXTWSVMEQB-CQSZACIVSA-N 0 0 359.451 3.612 20 5 FHBDRN CN(Cc1ccoc1)C(=O)c1cc(F)cc2c(=O)c3cccc(F)c3[nH]c12 ZINC000436149727 944048868 /nfs/dbraw/zinc/04/88/68/944048868.db2.gz JIRFCBJICMNZJA-UHFFFAOYSA-N 0 0 368.339 3.825 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)NCC2(c3ccc(F)cc3)CC2)c1 ZINC000500073454 944057318 /nfs/dbraw/zinc/05/73/18/944057318.db2.gz JNPHWSQMSZJPBS-UHFFFAOYSA-N 0 0 360.410 3.917 20 5 FHBDRN COC(=O)[C@@H](C)Sc1ccccc1C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000515639102 944072703 /nfs/dbraw/zinc/07/27/03/944072703.db2.gz NOEIMHXDSSIJDH-LLVKDONJSA-N 0 0 360.391 3.501 20 5 FHBDRN Cc1c(C(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)nnn1-c1cccc(C)c1 ZINC000515638931 944072893 /nfs/dbraw/zinc/07/28/93/944072893.db2.gz AUKQJBHDCLUOCA-UHFFFAOYSA-N 0 0 365.393 3.661 20 5 FHBDRN O=C(Nc1nc(C2CCC2)cs1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000436170364 944073335 /nfs/dbraw/zinc/07/33/35/944073335.db2.gz JRAIOWQWNARLPQ-UHFFFAOYSA-N 0 0 369.406 3.757 20 5 FHBDRN O=C(c1c[nH]c2cc([N+](=O)[O-])ccc12)N1CC[C@H](c2ccccc2F)C1 ZINC000500088336 944078351 /nfs/dbraw/zinc/07/83/51/944078351.db2.gz JEBCTZYSAZAHOZ-LBPRGKRZSA-N 0 0 353.353 3.845 20 5 FHBDRN CCSc1ccc([C@H](C)NC(=O)CNc2ccccc2[N+](=O)[O-])cc1 ZINC000505129697 944079647 /nfs/dbraw/zinc/07/96/47/944079647.db2.gz JYJXBQVRYHDBLK-ZDUSSCGKSA-N 0 0 359.451 3.996 20 5 FHBDRN C[C@@H](NC(=O)c1cc(Br)cc([N+](=O)[O-])c1)c1cccc(O)c1 ZINC000128480627 944080721 /nfs/dbraw/zinc/08/07/21/944080721.db2.gz MTQFHWMSTWCYGI-SECBINFHSA-N 0 0 365.183 3.554 20 5 FHBDRN CN(C(=O)Cc1coc(-c2ccc(Cl)cc2)n1)c1ccc([N+](=O)[O-])nc1 ZINC000517199110 944080961 /nfs/dbraw/zinc/08/09/61/944080961.db2.gz HYQLVFVCTNNXKE-UHFFFAOYSA-N 0 0 372.768 3.504 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N1CCO[C@@H](c2ccccc2Cl)C1 ZINC000505155826 944083346 /nfs/dbraw/zinc/08/33/46/944083346.db2.gz ZPFZSXQRHUXRRJ-QGZVFWFLSA-N 0 0 360.797 3.770 20 5 FHBDRN C[C@H]1CN(C(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[C@H]1C ZINC000436190572 944083582 /nfs/dbraw/zinc/08/35/82/944083582.db2.gz NMSCOSHOTHZHIN-AOOOYVTPSA-N 0 0 362.373 3.820 20 5 FHBDRN CC[C@@H](C)[C@H](NC(=O)CSc1ccccc1[N+](=O)[O-])C(F)(F)F ZINC000436173272 944085882 /nfs/dbraw/zinc/08/58/82/944085882.db2.gz RLLKSSFIQZBBKZ-RNCFNFMXSA-N 0 0 350.362 3.780 20 5 FHBDRN CC[C@H](C)[C@H](NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)C(F)(F)F ZINC000436180257 944091538 /nfs/dbraw/zinc/09/15/38/944091538.db2.gz YRXVFSXMZXLFOJ-NHYWBVRUSA-N 0 0 373.375 3.902 20 5 FHBDRN CC[C@@H](C)[C@@H](NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)C(F)(F)F ZINC000436180256 944091858 /nfs/dbraw/zinc/09/18/58/944091858.db2.gz YRXVFSXMZXLFOJ-IAQYHMDHSA-N 0 0 373.375 3.902 20 5 FHBDRN C[C@@H](C(=O)N1CCN(C2CC2)c2cc(F)ccc21)c1cccc([N+](=O)[O-])c1 ZINC000517212748 944093620 /nfs/dbraw/zinc/09/36/20/944093620.db2.gz ORTQLAGSPRZSNQ-CYBMUJFWSA-N 0 0 369.396 3.853 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CS(=O)(=O)Cc1ccc(F)cc1Cl ZINC000105519305 944093939 /nfs/dbraw/zinc/09/39/39/944093939.db2.gz FCUCYFDLUSXOLR-UHFFFAOYSA-N 0 0 373.789 3.511 20 5 FHBDRN O=C(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)N1CCC[C@@]2(CC=CCC2)C1 ZINC000517215127 944095190 /nfs/dbraw/zinc/09/51/90/944095190.db2.gz FIMLWJIMULWSFX-IBGZPJMESA-N 0 0 369.425 3.503 20 5 FHBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1Oc1ccc2nnc(C(F)F)n2n1 ZINC000092655754 944096331 /nfs/dbraw/zinc/09/63/31/944096331.db2.gz JFBLZLYFXTVULR-UHFFFAOYSA-N 0 0 355.688 3.724 20 5 FHBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F ZINC000424763087 944103377 /nfs/dbraw/zinc/10/33/77/944103377.db2.gz ZMLGDVSNJUFBAD-BGHVQYPCSA-N 0 0 370.371 3.868 20 5 FHBDRN CC[C@H](C)[C@H](NC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21)C(F)(F)F ZINC000436197985 944108708 /nfs/dbraw/zinc/10/87/08/944108708.db2.gz LPYIFLGMYAJIIH-BONVTDFDSA-N 0 0 357.332 3.643 20 5 FHBDRN COCC[C@H](C)CNC(=O)c1cc([N+](=O)[O-])ccc1SCC(C)C ZINC000412493794 944110478 /nfs/dbraw/zinc/11/04/78/944110478.db2.gz ZLXJYPAKRORCKB-ZDUSSCGKSA-N 0 0 354.472 3.745 20 5 FHBDRN COc1cccc(C)c1NC(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000436213849 944122580 /nfs/dbraw/zinc/12/25/80/944122580.db2.gz BPTOBNRQWDAXGD-NSHDSACASA-N 0 0 364.785 3.971 20 5 FHBDRN CC(C)N(C(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-])C1CCOCC1 ZINC001126444576 944124203 /nfs/dbraw/zinc/12/42/03/944124203.db2.gz ORSIOVRYKACWNP-UHFFFAOYSA-N 0 0 369.421 3.686 20 5 FHBDRN C[C@H](c1cccnc1)N(C)C(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000436239475 944126511 /nfs/dbraw/zinc/12/65/11/944126511.db2.gz GLAITLHCKJTXFB-CQSZACIVSA-N 0 0 357.413 3.910 20 5 FHBDRN O=[N+]([O-])c1ccc([C@H](NC[C@H](CO)c2ccc(F)cc2)C(F)(F)F)cc1 ZINC000584534174 944129682 /nfs/dbraw/zinc/12/96/82/944129682.db2.gz DWBUGFKULWHPIG-CJNGLKHVSA-N 0 0 372.318 3.703 20 5 FHBDRN CC(C)COC[C@@H](NC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)c1ccco1 ZINC000505184108 944130527 /nfs/dbraw/zinc/13/05/27/944130527.db2.gz ISDHMKJPVMVWHH-OAHLLOKOSA-N 0 0 371.393 3.813 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC[C@@H]1C1CCCCC1 ZINC000515711590 944134996 /nfs/dbraw/zinc/13/49/96/944134996.db2.gz OPCQJQOTDQMBCR-MRXNPFEDSA-N 0 0 352.456 3.637 20 5 FHBDRN C[C@@H]1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)[C@H]2CCCC[C@@H]12 ZINC000515711100 944135855 /nfs/dbraw/zinc/13/58/55/944135855.db2.gz FTINWEVPNFKABJ-ZLDLUXBVSA-N 0 0 372.874 3.838 20 5 FHBDRN CCOc1cc(C(=O)Nc2c(C)cccc2OC)c([N+](=O)[O-])cc1OC ZINC000436233825 944138291 /nfs/dbraw/zinc/13/82/91/944138291.db2.gz UWAXFZCBDINUFJ-UHFFFAOYSA-N 0 0 360.366 3.571 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1ccc(OC(C)C)cc1C ZINC000515697783 944138883 /nfs/dbraw/zinc/13/88/83/944138883.db2.gz XNQIZJZZLKOSEJ-UHFFFAOYSA-N 0 0 364.423 3.800 20 5 FHBDRN CC(C)(C)OC(=O)[C@@H]1CN(c2ccc([N+](=O)[O-])cn2)C[C@H]1c1ccccc1 ZINC000517232842 944140503 /nfs/dbraw/zinc/14/05/03/944140503.db2.gz GAVLLKGQRQGZRY-DLBZAZTESA-N 0 0 369.421 3.552 20 5 FHBDRN CC1=CCCN([C@H](C)C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)C1 ZINC000436268471 944142462 /nfs/dbraw/zinc/14/24/62/944142462.db2.gz UNSYLBLHPRIUEM-CYBMUJFWSA-N 0 0 372.450 3.697 20 5 FHBDRN O=C(NCCOc1ncccc1F)c1cc2ccccc2c2cccnc12 ZINC000437824017 944148838 /nfs/dbraw/zinc/14/88/38/944148838.db2.gz XIQMRHUPNBSYGQ-UHFFFAOYSA-N 0 0 361.376 3.731 20 5 FHBDRN CCOc1cccc([C@@H]2C[C@H]2NC(=O)Nc2cccc([N+](=O)[O-])c2C)c1 ZINC000436256939 944150081 /nfs/dbraw/zinc/15/00/81/944150081.db2.gz CBULQJMXFGWHEL-DOTOQJQBSA-N 0 0 355.394 3.980 20 5 FHBDRN CCOc1cc(N2CCC[C@H](c3nncn3C(C)C)C2)ccc1[N+](=O)[O-] ZINC000092655520 944152492 /nfs/dbraw/zinc/15/24/92/944152492.db2.gz VLEBENHKNHPPCB-AWEZNQCLSA-N 0 0 359.430 3.550 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC[C@](C)(c2ccccc2)C1 ZINC000500142834 944156386 /nfs/dbraw/zinc/15/63/86/944156386.db2.gz JUOAWPKRGOUDJR-IBGZPJMESA-N 0 0 374.462 3.646 20 5 FHBDRN Cc1ccc(C[C@H]2CCCN2S(=O)(=O)c2cccc([N+](=O)[O-])c2C)cc1 ZINC000500143384 944157213 /nfs/dbraw/zinc/15/72/13/944157213.db2.gz PXKADSDFTCOORL-QGZVFWFLSA-N 0 0 374.462 3.607 20 5 FHBDRN CCCCOCCNC(=O)c1cc(F)cc2c(=O)c3cccc(F)c3[nH]c12 ZINC000436307039 944174747 /nfs/dbraw/zinc/17/47/47/944174747.db2.gz MGDDGWPPABKEPM-UHFFFAOYSA-N 0 0 374.387 3.506 20 5 FHBDRN COc1cc(C(=O)N(CC2CCC2)C(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000436290378 944177054 /nfs/dbraw/zinc/17/70/54/944177054.db2.gz JPZWZMIVVAMJRK-UHFFFAOYSA-N 0 0 372.368 3.856 20 5 FHBDRN COc1cccc(CNc2cc(C(F)(F)F)ncc2[N+](=O)[O-])c1OC ZINC000436315539 944193886 /nfs/dbraw/zinc/19/38/86/944193886.db2.gz GXJDOGMXBHQLGV-UHFFFAOYSA-N 0 0 357.288 3.638 20 5 FHBDRN CCc1ccc(C(=O)N2CC(C)(C)O[C@](C)(C(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000505793512 944197891 /nfs/dbraw/zinc/19/78/91/944197891.db2.gz UWEICBNFQKJSAD-INIZCTEOSA-N 0 0 374.359 3.729 20 5 FHBDRN CN(C)C(=O)c1cccc(Oc2cc(C(F)(F)F)ncc2[N+](=O)[O-])c1 ZINC000436321101 944199264 /nfs/dbraw/zinc/19/92/64/944199264.db2.gz JEURQFBHYHPVBN-UHFFFAOYSA-N 0 0 355.272 3.503 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)N1CCC[C@H](Cc2ccccc2)C1 ZINC000517318052 944206694 /nfs/dbraw/zinc/20/66/94/944206694.db2.gz DRKSWVVOPDHETO-GOSISDBHSA-N 0 0 353.422 3.759 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)N[C@H](CC(F)(F)F)c2ccccc2C)n1 ZINC000436328683 944208227 /nfs/dbraw/zinc/20/82/27/944208227.db2.gz WJXWKHNEZDHPPS-GFCCVEGCSA-N 0 0 370.331 3.543 20 5 FHBDRN CCOc1ccc(NC(=O)NCc2ccc(OC)c([N+](=O)[O-])c2)c(C)c1 ZINC000515795712 944220477 /nfs/dbraw/zinc/22/04/77/944220477.db2.gz CCLYMVMUPNZEPR-UHFFFAOYSA-N 0 0 359.382 3.632 20 5 FHBDRN Cc1cc(NC(=O)CCc2ccccc2F)n(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000105587598 944228236 /nfs/dbraw/zinc/22/82/36/944228236.db2.gz XIANBUNXEWTPTI-UHFFFAOYSA-N 0 0 368.368 3.799 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)F)cc1N1CC[C@@H](COc2ccccc2)C1 ZINC000436348757 944230412 /nfs/dbraw/zinc/23/04/12/944230412.db2.gz ARTLQHFXBQSTRF-GFCCVEGCSA-N 0 0 367.327 3.914 20 5 FHBDRN COc1ccc(CN(C)c2ccc([N+](=O)[O-])c(OC(F)F)c2)cc1O ZINC000092689360 944231213 /nfs/dbraw/zinc/23/12/13/944231213.db2.gz OSTGZXMKWHQPHY-UHFFFAOYSA-N 0 0 354.309 3.547 20 5 FHBDRN O=C1[C@H](Nc2cccc(C(F)(F)F)c2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000518283442 944234572 /nfs/dbraw/zinc/23/45/72/944234572.db2.gz UVTPJMCSTTXPTD-OAHLLOKOSA-N 0 0 365.311 3.831 20 5 FHBDRN CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@H]3CN2c1ccc([N+](=O)[O-])c(-c2ccc(F)cc2)n1 ZINC000515817182 944237552 /nfs/dbraw/zinc/23/75/52/944237552.db2.gz GUXFBQUQFJOHIA-MQEXTWSESA-N 0 0 369.396 3.656 20 5 FHBDRN CCC(CC)(CNC(=O)c1cc2cc([N+](=O)[O-])ccc2s1)C(=O)OC ZINC000505803578 944241094 /nfs/dbraw/zinc/24/10/94/944241094.db2.gz WUYMXCXBRKPQQN-UHFFFAOYSA-N 0 0 364.423 3.519 20 5 FHBDRN C[C@H](C[C@@H]1CCCO1)NC(=O)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000436372483 944242410 /nfs/dbraw/zinc/24/24/10/944242410.db2.gz VBRXZNIUMFBWHU-OLZOCXBDSA-N 0 0 368.408 3.508 20 5 FHBDRN C[C@@H](C[C@@H]1CCCO1)NC(=O)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000436372485 944242667 /nfs/dbraw/zinc/24/26/67/944242667.db2.gz VBRXZNIUMFBWHU-STQMWFEESA-N 0 0 368.408 3.508 20 5 FHBDRN CCOc1ccc([C@@H]2C[C@H]2NC(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)cc1 ZINC000436377589 944246517 /nfs/dbraw/zinc/24/65/17/944246517.db2.gz IEZLNQFAYQPOLQ-JKSUJKDBSA-N 0 0 371.393 3.680 20 5 FHBDRN COC(=O)Cc1cccc(Oc2cc(C(F)(F)F)ncc2[N+](=O)[O-])c1 ZINC000436391521 944260215 /nfs/dbraw/zinc/26/02/15/944260215.db2.gz RFSNCVQIOHBYDL-UHFFFAOYSA-N 0 0 356.256 3.516 20 5 FHBDRN CN1CCOc2ccc(Nc3cc(C(F)(F)F)ncc3[N+](=O)[O-])cc21 ZINC000436393568 944263668 /nfs/dbraw/zinc/26/36/68/944263668.db2.gz USRAKAWTSDHGLY-UHFFFAOYSA-N 0 0 354.288 3.581 20 5 FHBDRN Cc1c2cccc(C)c2oc1C(=O)NCCOc1ccc([N+](=O)[O-])cc1 ZINC000518309170 944269461 /nfs/dbraw/zinc/26/94/61/944269461.db2.gz MCGUMZSZGQIUBS-UHFFFAOYSA-N 0 0 354.362 3.767 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)F)cc1NCCCCNc1ccccn1 ZINC000436393977 944271095 /nfs/dbraw/zinc/27/10/95/944271095.db2.gz VTIWIMBLBMINGF-UHFFFAOYSA-N 0 0 355.320 3.708 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)F)cc1N1CCO[C@H](c2ccccc2F)C1 ZINC000436396858 944272322 /nfs/dbraw/zinc/27/23/22/944272322.db2.gz ZZMFOXASZJWVQM-AWEZNQCLSA-N 0 0 371.290 3.726 20 5 FHBDRN O=C(NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N1CC2(C1)CCCC2 ZINC000426261746 944277574 /nfs/dbraw/zinc/27/75/74/944277574.db2.gz STUGPAQZHQCLEW-UHFFFAOYSA-N 0 0 357.332 3.699 20 5 FHBDRN Cc1ccc(CS(=O)(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)cc1F ZINC000184216174 944277635 /nfs/dbraw/zinc/27/76/35/944277635.db2.gz RUNBJFMDEVBPMA-UHFFFAOYSA-N 0 0 352.387 3.601 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)F)cc1NC[C@H]1CCOc2ccccc21 ZINC000436402793 944278460 /nfs/dbraw/zinc/27/84/60/944278460.db2.gz BBFFOKKZLGJGGL-SNVBAGLBSA-N 0 0 353.300 3.987 20 5 FHBDRN C[C@H](NC(=O)N1CCC(c2cccc(N)c2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000418232184 944280896 /nfs/dbraw/zinc/28/08/96/944280896.db2.gz MFRUBICRWMTZML-AWEZNQCLSA-N 0 0 368.437 3.827 20 5 FHBDRN C[C@@H]1Cc2ccc(Br)cc2CN1C(=O)c1ccc([N+](=O)[O-])o1 ZINC000500221305 944281181 /nfs/dbraw/zinc/28/11/81/944281181.db2.gz KSZKUTRBKIYYKJ-SECBINFHSA-N 0 0 365.183 3.537 20 5 FHBDRN COc1ccc(CNC(=O)[C@@H]2C[C@@]23CCCc2ccccc23)cc1[N+](=O)[O-] ZINC000439042284 944281328 /nfs/dbraw/zinc/28/13/28/944281328.db2.gz NIPHQPDPASIFLH-LAUBAEHRSA-N 0 0 366.417 3.514 20 5 FHBDRN Cc1cc(N2CCCN(C(=O)C(C)C)CC2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000549490466 944282873 /nfs/dbraw/zinc/28/28/73/944282873.db2.gz PYXKFWQZKVSLHZ-UHFFFAOYSA-N 0 0 373.375 3.617 20 5 FHBDRN O=C1CCc2cc(Nc3ccc([N+](=O)[O-])cn3)ccc2N1CC(F)(F)F ZINC000436418637 944290995 /nfs/dbraw/zinc/29/09/95/944290995.db2.gz AJHPYFGZPBXIKZ-UHFFFAOYSA-N 0 0 366.299 3.575 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)c1cn(C)nc1C(C)(C)C ZINC000426269111 944291620 /nfs/dbraw/zinc/29/16/20/944291620.db2.gz VPKXCBYJESANIM-UHFFFAOYSA-N 0 0 358.442 3.677 20 5 FHBDRN Cc1nc(NC(=O)C2(c3cccc(C(F)(F)F)c3)CC2)ccc1[N+](=O)[O-] ZINC000133867272 944296350 /nfs/dbraw/zinc/29/63/50/944296350.db2.gz RFENELVNYGIDJW-UHFFFAOYSA-N 0 0 365.311 3.987 20 5 FHBDRN NC(=O)c1ccc(CSCc2cc(F)cc3cccnc32)c([N+](=O)[O-])c1 ZINC000105629000 944296384 /nfs/dbraw/zinc/29/63/84/944296384.db2.gz PCOZHGPXNWTEFF-UHFFFAOYSA-N 0 0 371.393 3.814 20 5 FHBDRN Cc1ccc(F)c(CN(C)c2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)c1 ZINC000436429264 944299935 /nfs/dbraw/zinc/29/99/35/944299935.db2.gz GDILFVAFZZAQQO-UHFFFAOYSA-N 0 0 371.412 3.915 20 5 FHBDRN COc1ccc(OC2CCN(c3ccc([N+](=O)[O-])c(C(C)=O)c3)CC2)cc1 ZINC000515888206 944301202 /nfs/dbraw/zinc/30/12/02/944301202.db2.gz MKJJTNOYSMKDAJ-UHFFFAOYSA-N 0 0 370.405 3.854 20 5 FHBDRN O=C(Nc1cc(F)cc([N+](=O)[O-])c1)N(Cc1ccccc1)CC1(CO)CC1 ZINC000500230684 944308021 /nfs/dbraw/zinc/30/80/21/944308021.db2.gz LGDGUOQBRUNXFN-UHFFFAOYSA-N 0 0 373.384 3.541 20 5 FHBDRN C[C@H]1C[C@H](NC(=O)Nc2cccc(Oc3ccc([N+](=O)[O-])cc3)c2)CO1 ZINC000566618296 944321206 /nfs/dbraw/zinc/32/12/06/944321206.db2.gz CUBKCBGOADSIIX-JSGCOSHPSA-N 0 0 357.366 3.686 20 5 FHBDRN COc1cc(CSCCOC(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000105637845 944321704 /nfs/dbraw/zinc/32/17/04/944321704.db2.gz SMUUDDIEABTOQJ-UHFFFAOYSA-N 0 0 351.371 3.863 20 5 FHBDRN Cc1c(CC(=O)Nc2ccnn2CCc2ccccc2)cccc1[N+](=O)[O-] ZINC000164261356 944329651 /nfs/dbraw/zinc/32/96/51/944329651.db2.gz HDVHBKLXBROHFF-UHFFFAOYSA-N 0 0 364.405 3.524 20 5 FHBDRN Cc1cc(NS(=O)(=O)CCc2cccc(Cl)c2)ccc1[N+](=O)[O-] ZINC000506851153 944331401 /nfs/dbraw/zinc/33/14/01/944331401.db2.gz LLZWMTXADIHDMM-UHFFFAOYSA-N 0 0 354.815 3.541 20 5 FHBDRN O=[N+]([O-])c1cccnc1SCCOc1ccccc1Br ZINC000506851023 944332418 /nfs/dbraw/zinc/33/24/18/944332418.db2.gz KQYQNLYXNCRTNE-UHFFFAOYSA-N 0 0 355.213 3.923 20 5 FHBDRN CCOc1ccc(-c2csc(NC(=O)c3ccc([N+](=O)[O-])[nH]3)n2)cc1 ZINC000517491981 944334532 /nfs/dbraw/zinc/33/45/32/944334532.db2.gz GGVQJLRTRFIAOY-UHFFFAOYSA-N 0 0 358.379 3.697 20 5 FHBDRN CNC(=O)c1ccc(Nc2ccc(N3CCCC3)cc2C)c([N+](=O)[O-])c1 ZINC000053550224 944343734 /nfs/dbraw/zinc/34/37/34/944343734.db2.gz SMJOLGDRLAXRQU-UHFFFAOYSA-N 0 0 354.410 3.607 20 5 FHBDRN C/C=C/c1ccc(OC[C@H](O)COc2ccc(C)c([N+](=O)[O-])c2)c(OC)c1 ZINC000550175989 944346001 /nfs/dbraw/zinc/34/60/01/944346001.db2.gz XNBBOSQQINWIND-DWTRPJMMSA-N 0 0 373.405 3.764 20 5 FHBDRN O=[N+]([O-])c1cncc(Br)c1N1CC[C@@H](c2ccccc2F)C1 ZINC000518404535 944353610 /nfs/dbraw/zinc/35/36/10/944353610.db2.gz XPZMUTNTHUTBAU-SNVBAGLBSA-N 0 0 366.190 3.885 20 5 FHBDRN Cc1ccccc1-c1nc(CNC(=O)Nc2cccc([N+](=O)[O-])c2C)no1 ZINC000436491620 944360280 /nfs/dbraw/zinc/36/02/80/944360280.db2.gz ATNPWUWAZKSZJV-UHFFFAOYSA-N 0 0 367.365 3.583 20 5 FHBDRN CC[C@@H](Nc1ccccc1)C(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000438136649 944362541 /nfs/dbraw/zinc/36/25/41/944362541.db2.gz NVUJEVXNTHBJNT-GOSISDBHSA-N 0 0 353.422 3.977 20 5 FHBDRN CC(C)(C(=O)NC[C@]1(C)CCOC2(CCC2)C1)c1ccccc1[N+](=O)[O-] ZINC000894654664 944365090 /nfs/dbraw/zinc/36/50/90/944365090.db2.gz DBIGAUFLOVNTAU-LJQANCHMSA-N 0 0 360.454 3.728 20 5 FHBDRN Cc1nc2cc(CNC(=O)c3ccc([N+](=O)[O-])s3)ccc2n1C1CC1 ZINC000550183554 944365516 /nfs/dbraw/zinc/36/55/16/944365516.db2.gz IZIXRIYTNKQMPB-UHFFFAOYSA-N 0 0 356.407 3.579 20 5 FHBDRN Cc1c(F)ccc([N+](=O)[O-])c1C(=O)NC[C@@]1(C)CCOC2(CCC2)C1 ZINC000894656631 944365781 /nfs/dbraw/zinc/36/57/81/944365781.db2.gz SRUFFLAFBIVGGT-KRWDZBQOSA-N 0 0 350.390 3.512 20 5 FHBDRN COc1ccc(NC(=O)NCC2(c3ccccc3C)CC2)cc1[N+](=O)[O-] ZINC000543892427 944366160 /nfs/dbraw/zinc/36/61/60/944366160.db2.gz SDVAFYKMMIFUGX-UHFFFAOYSA-N 0 0 355.394 3.765 20 5 FHBDRN CNC(=O)c1ccc(N[C@@H](C)c2cccc(OC(F)F)c2)c([N+](=O)[O-])c1 ZINC000053562729 944366908 /nfs/dbraw/zinc/36/69/08/944366908.db2.gz NRZNDGMQALEVQU-JTQLQIEISA-N 0 0 365.336 3.729 20 5 FHBDRN COc1cc(CN(C)Cc2nc(-c3ccccc3)c[nH]2)c([N+](=O)[O-])cc1F ZINC000184266032 944371057 /nfs/dbraw/zinc/37/10/57/944371057.db2.gz BWJVDWXJCFZYAC-UHFFFAOYSA-N 0 0 370.384 3.765 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)Nc1cc(-c2ccccc2C)[nH]n1 ZINC000436490760 944373162 /nfs/dbraw/zinc/37/31/62/944373162.db2.gz USJHYBGZFBYCDP-UHFFFAOYSA-N 0 0 351.366 3.668 20 5 FHBDRN COc1cc(CN2CCc3c4ccccc4[nH]c3C2)c([N+](=O)[O-])cc1F ZINC000184271905 944373687 /nfs/dbraw/zinc/37/36/87/944373687.db2.gz VABYNYTXVNESSM-UHFFFAOYSA-N 0 0 355.369 3.782 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)[C@@H]2Oc3ccccc3[C@H]2C)c1 ZINC000438141542 944374213 /nfs/dbraw/zinc/37/42/13/944374213.db2.gz KMYKZQBGIASVIM-SEDUGSJDSA-N 0 0 372.446 4.000 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)NC[C@]2(C)CCOC3(CCC3)C2)c1 ZINC000894669824 944375688 /nfs/dbraw/zinc/37/56/88/944375688.db2.gz ANLDXSFBDMETTJ-QGZVFWFLSA-N 0 0 364.467 3.786 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)NC[C@@]2(C)CCOC3(CCC3)C2)c1 ZINC000894669823 944375724 /nfs/dbraw/zinc/37/57/24/944375724.db2.gz ANLDXSFBDMETTJ-KRWDZBQOSA-N 0 0 364.467 3.786 20 5 FHBDRN Cc1cc(N[C@H]2CCc3nnc(-c4ccc(F)cc4)n3C2)ccc1[N+](=O)[O-] ZINC000505841580 944376425 /nfs/dbraw/zinc/37/64/25/944376425.db2.gz XFUYGUOXIWOADF-INIZCTEOSA-N 0 0 367.384 3.728 20 5 FHBDRN C[C@H](C(=O)NC[C@]1(C)CCOC2(CCC2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000894660100 944381455 /nfs/dbraw/zinc/38/14/55/944381455.db2.gz IUXWFLBCVLRPEE-SCLBCKFNSA-N 0 0 364.417 3.693 20 5 FHBDRN Cc1cc(NC(=O)NCCc2c[nH]c3cc(F)ccc23)ccc1[N+](=O)[O-] ZINC000473767380 944385878 /nfs/dbraw/zinc/38/58/78/944385878.db2.gz GRPOZIAANGUVSJ-UHFFFAOYSA-N 0 0 356.357 3.888 20 5 FHBDRN Cc1cc(NC(=O)N[C@@H](c2ccccc2)[C@H]2CCOC2)ccc1[N+](=O)[O-] ZINC000473769010 944386765 /nfs/dbraw/zinc/38/67/65/944386765.db2.gz ZZDYOKHEWRQFGT-YJBOKZPZSA-N 0 0 355.394 3.803 20 5 FHBDRN O=[N+]([O-])c1cncc(Br)c1N1CC[C@H](c2cccc(F)c2)C1 ZINC000500271946 944386918 /nfs/dbraw/zinc/38/69/18/944386918.db2.gz DRADLHVYKQUOHU-NSHDSACASA-N 0 0 366.190 3.885 20 5 FHBDRN CC[C@@H](Cc1ccccc1)NC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000123626235 944389051 /nfs/dbraw/zinc/38/90/51/944389051.db2.gz YHIMUGIMVKESOK-KRWDZBQOSA-N 0 0 353.422 3.684 20 5 FHBDRN Cc1c(NCC(=O)N(C)[C@H]2CCCc3ccccc32)cccc1[N+](=O)[O-] ZINC000500273550 944390000 /nfs/dbraw/zinc/39/00/00/944390000.db2.gz XDXSFPFPQZTUPM-IBGZPJMESA-N 0 0 353.422 3.851 20 5 FHBDRN CN(C(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)c1ccc(Cl)cc1F ZINC000439153841 944393549 /nfs/dbraw/zinc/39/35/49/944393549.db2.gz FRLBYXMSCVDOER-UHFFFAOYSA-N 0 0 374.759 3.850 20 5 FHBDRN O=C(NC1CC(c2ccccc2)C1)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000123656642 944399662 /nfs/dbraw/zinc/39/96/62/944399662.db2.gz RJHJAZPRXIWUBO-UHFFFAOYSA-N 0 0 351.406 3.609 20 5 FHBDRN CC[C@@H](C)NC(=O)c1ccc(Nc2nc3sccn3c2[N+](=O)[O-])cc1 ZINC000053578645 944401773 /nfs/dbraw/zinc/40/17/73/944401773.db2.gz QEWLLHTVXIUZAV-SNVBAGLBSA-N 0 0 359.411 3.576 20 5 FHBDRN O=[N+]([O-])c1ccc(OC(F)F)c(CNc2cccc3c2OCC[C@H]3O)c1 ZINC000184084925 944402411 /nfs/dbraw/zinc/40/24/11/944402411.db2.gz KIPCZZVJBMVZBI-CQSZACIVSA-N 0 0 366.320 3.624 20 5 FHBDRN Cc1cc(F)c(Br)cc1NC(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000190255141 944403218 /nfs/dbraw/zinc/40/32/18/944403218.db2.gz IWNYJMVPVUUHGJ-UHFFFAOYSA-N 0 0 367.174 3.986 20 5 FHBDRN C[C@@H]1CCN(c2cc(C(=O)NC(C)(C)c3ccc([N+](=O)[O-])cc3)ccn2)C1 ZINC000438208472 944415819 /nfs/dbraw/zinc/41/58/19/944415819.db2.gz BDNAVPNGTUDKJE-CQSZACIVSA-N 0 0 368.437 3.501 20 5 FHBDRN CC(C)Oc1cccc(CN(C)C(=O)c2cc(F)c([N+](=O)[O-])cc2F)c1 ZINC000123800143 944416312 /nfs/dbraw/zinc/41/63/12/944416312.db2.gz JALYNYFUFZWGCD-UHFFFAOYSA-N 0 0 364.348 3.932 20 5 FHBDRN COc1cccc(CCC(=O)N2c3ccc([N+](=O)[O-])cc3C[C@@H]2C)c1OC ZINC000518476520 944417084 /nfs/dbraw/zinc/41/70/84/944417084.db2.gz XDJDELMIPNITKQ-ZDUSSCGKSA-N 0 0 370.405 3.522 20 5 FHBDRN O=C(CCCc1ccc(Cl)cc1)NCCOc1ccc([N+](=O)[O-])cc1 ZINC000517591158 944422146 /nfs/dbraw/zinc/42/21/46/944422146.db2.gz KWXQVRWVHAEBMM-UHFFFAOYSA-N 0 0 362.813 3.766 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000086624231 944424297 /nfs/dbraw/zinc/42/42/97/944424297.db2.gz UTPNHHQQNZXPGO-UHFFFAOYSA-N 0 0 363.757 3.954 20 5 FHBDRN C[C@H](NC(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1)[C@@H](O)Cc1ccccc1 ZINC000438230151 944434230 /nfs/dbraw/zinc/43/42/30/944434230.db2.gz YBRLKXOMTKUWQX-LIRRHRJNSA-N 0 0 370.449 3.614 20 5 FHBDRN CC(C)(C)OCCCCSc1ccc([N+](=O)[O-])c(S(C)(=O)=O)c1 ZINC000473776722 944435198 /nfs/dbraw/zinc/43/51/98/944435198.db2.gz DOAYRAOJMVINCW-UHFFFAOYSA-N 0 0 361.485 3.686 20 5 FHBDRN CCNc1ccc(C(=O)N2CC[C@@H](C(F)(F)F)C2(C)C)cc1[N+](=O)[O-] ZINC000327686203 944440458 /nfs/dbraw/zinc/44/04/58/944440458.db2.gz PTJJABGOHVBQAU-CYBMUJFWSA-N 0 0 359.348 3.830 20 5 FHBDRN Cc1ccc2c(c1)[C@H](NC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1)CO2 ZINC000123844795 944444552 /nfs/dbraw/zinc/44/45/52/944444552.db2.gz TZUAZTUOOOGAMG-QGZVFWFLSA-N 0 0 367.405 3.711 20 5 FHBDRN CC(C)c1ccc(CNC(=O)NCCNc2ccc([N+](=O)[O-])cc2)cc1 ZINC000518498638 944446158 /nfs/dbraw/zinc/44/61/58/944446158.db2.gz OMKNEZUGXYFOKT-UHFFFAOYSA-N 0 0 356.426 3.630 20 5 FHBDRN COc1ccc(CC(=O)N2CCC[C@@H](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000518506019 944450282 /nfs/dbraw/zinc/45/02/82/944450282.db2.gz XWJAACGCELSOIV-SFHVURJKSA-N 0 0 368.433 3.627 20 5 FHBDRN COc1ccc(CC(=O)N2CCC[C@H](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000518506018 944450661 /nfs/dbraw/zinc/45/06/61/944450661.db2.gz XWJAACGCELSOIV-GOSISDBHSA-N 0 0 368.433 3.627 20 5 FHBDRN Cc1nc(C(=O)OCCOc2ccc([N+](=O)[O-])cc2)c(-c2ccccc2)o1 ZINC000759825133 944451206 /nfs/dbraw/zinc/45/12/06/944451206.db2.gz CKMXLQDJZSAWSF-UHFFFAOYSA-N 0 0 368.345 3.794 20 5 FHBDRN CC(C)Oc1cc(C(=O)N[C@@H]2CCc3ccccc3OC2)ccc1[N+](=O)[O-] ZINC001270324790 944460837 /nfs/dbraw/zinc/46/08/37/944460837.db2.gz MKUJNXNUWQQFQP-MRXNPFEDSA-N 0 0 370.405 3.506 20 5 FHBDRN CCCC(=O)Nc1ccc(CNC(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC000046847474 944463852 /nfs/dbraw/zinc/46/38/52/944463852.db2.gz PFGKEVVBXDTVLB-UHFFFAOYSA-N 0 0 356.382 3.655 20 5 FHBDRN COc1cc(CN[C@@H](c2ccccc2)C(C)(C)CO)c([N+](=O)[O-])cc1F ZINC000566648396 944465660 /nfs/dbraw/zinc/46/56/60/944465660.db2.gz SGGBZNCDQGTSMJ-SFHVURJKSA-N 0 0 362.401 3.592 20 5 FHBDRN Cc1ccc(SC[C@@H](C)NC(=O)NCc2cccc([N+](=O)[O-])c2)cc1 ZINC000546027483 944466990 /nfs/dbraw/zinc/46/69/90/944466990.db2.gz YGIYJKITFWDIIM-CQSZACIVSA-N 0 0 359.451 3.883 20 5 FHBDRN CC(C)c1cccc(NC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])o2)c1 ZINC000517654362 944468480 /nfs/dbraw/zinc/46/84/80/944468480.db2.gz OHBDZZAOCHDDEI-HNNXBMFYSA-N 0 0 371.393 3.555 20 5 FHBDRN CC(C)(C)OC(=O)c1cnc(Oc2ccc([N+](=O)[O-])c3ncccc23)cn1 ZINC000516078383 944470533 /nfs/dbraw/zinc/47/05/33/944470533.db2.gz IBAZKNXSROATOE-UHFFFAOYSA-N 0 0 368.349 3.681 20 5 FHBDRN CO[C@@H]1Cc2ccccc2N(C(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000500305317 944471481 /nfs/dbraw/zinc/47/14/81/944471481.db2.gz HDMHEHPSVLHQKE-MRXNPFEDSA-N 0 0 354.406 3.936 20 5 FHBDRN Cc1ccc2c(c1)N(C(=O)c1ccn(-c3cccc([N+](=O)[O-])c3)n1)CCC2 ZINC000110394782 944478113 /nfs/dbraw/zinc/47/81/13/944478113.db2.gz MCIXHXGOTDKNCH-UHFFFAOYSA-N 0 0 362.389 3.682 20 5 FHBDRN O=[N+]([O-])c1cccc2c(N3CCO[C@H](c4ccc(F)cc4F)C3)ccnc21 ZINC000517662679 944486796 /nfs/dbraw/zinc/48/67/96/944486796.db2.gz QYGFALNSZFHXHY-SFHVURJKSA-N 0 0 371.343 3.999 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N1CCC[C@H]([C@H]2CCOC2)C1 ZINC000439271042 944492893 /nfs/dbraw/zinc/49/28/93/944492893.db2.gz XIMZKFOVDSQQKW-RYUDHWBXSA-N 0 0 372.343 3.502 20 5 FHBDRN Cc1ccc(NC(=O)c2cc([N+](=O)[O-])cnc2C)cc1NC(=O)C(C)(C)C ZINC000110461304 944496516 /nfs/dbraw/zinc/49/65/16/944496516.db2.gz GOXFCFAGNJJXAJ-UHFFFAOYSA-N 0 0 370.409 3.844 20 5 FHBDRN CC(C)c1nccn1Cc1cccc(NC(=O)c2cc([N+](=O)[O-])cn2C)c1 ZINC000516112492 944498174 /nfs/dbraw/zinc/49/81/74/944498174.db2.gz PEDNKEZOYINHJA-UHFFFAOYSA-N 0 0 367.409 3.554 20 5 FHBDRN Cc1ccc(C)n1C1CCN(Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000518556661 944499332 /nfs/dbraw/zinc/49/93/32/944499332.db2.gz KREAPGJFYNDGIO-UHFFFAOYSA-N 0 0 353.426 3.727 20 5 FHBDRN C[C@H](COCC(F)(F)F)Nc1ccc(Br)cc1[N+](=O)[O-] ZINC000110459690 944501756 /nfs/dbraw/zinc/50/17/56/944501756.db2.gz AUPKBKWCLLSIAU-SSDOTTSWSA-N 0 0 357.126 3.737 20 5 FHBDRN Cc1ccc(C)n1-c1sccc1C(=O)NCc1ccccc1[N+](=O)[O-] ZINC000516122770 944505976 /nfs/dbraw/zinc/50/59/76/944505976.db2.gz WHIZCVCVNJVVCH-UHFFFAOYSA-N 0 0 355.419 3.994 20 5 FHBDRN COc1cc(Cl)c(NS(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1C ZINC000516109707 944510107 /nfs/dbraw/zinc/51/01/07/944510107.db2.gz QNBSFLJMOPZTAX-UHFFFAOYSA-N 0 0 370.814 3.674 20 5 FHBDRN O=C(c1cc2cc([N+](=O)[O-])ccc2o1)N1CCN(C2CC2)c2ccccc21 ZINC000426340947 944511104 /nfs/dbraw/zinc/51/11/04/944511104.db2.gz XINBVBPTHZLJBS-UHFFFAOYSA-N 0 0 363.373 3.970 20 5 FHBDRN CC(C)(c1nc(-c2ccc([N+](=O)[O-])cc2)no1)c1ccc2c(c1)OCO2 ZINC000426344158 944516808 /nfs/dbraw/zinc/51/68/08/944516808.db2.gz AGICTZRGUOENID-UHFFFAOYSA-N 0 0 353.334 3.699 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)COc1ccc(C(C)(C)C)cc1 ZINC001270115497 944522052 /nfs/dbraw/zinc/52/20/52/944522052.db2.gz CBGFXHIJMIJITO-UHFFFAOYSA-N 0 0 370.449 3.972 20 5 FHBDRN Cc1c(NC(=O)N(C)CCCOCc2ccccc2)cccc1[N+](=O)[O-] ZINC000439316003 944522446 /nfs/dbraw/zinc/52/24/46/944522446.db2.gz JXCDEJJRPCVADI-UHFFFAOYSA-N 0 0 357.410 3.974 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H](CO)c1cccc(Cl)c1F ZINC000439334709 944531286 /nfs/dbraw/zinc/53/12/86/944531286.db2.gz XFJJVCOKTKRDIW-CQSZACIVSA-N 0 0 367.764 3.551 20 5 FHBDRN COc1c(O)ccc(CN[C@@H]2CCc3cc(F)c(F)c(F)c32)c1[N+](=O)[O-] ZINC000894745394 944531546 /nfs/dbraw/zinc/53/15/46/944531546.db2.gz LYEPDFWHDDTANI-LLVKDONJSA-N 0 0 368.311 3.503 20 5 FHBDRN Cc1ccc(NC(=O)N[C@H](CO)c2cccc(Cl)c2F)cc1[N+](=O)[O-] ZINC000439335164 944532460 /nfs/dbraw/zinc/53/24/60/944532460.db2.gz ZUTFVAVIDOHQFQ-CYBMUJFWSA-N 0 0 367.764 3.551 20 5 FHBDRN CNc1ccc(C(=O)N2CC[C@@H](c3ccc(Cl)cc3)C2)cc1[N+](=O)[O-] ZINC000517719565 944533357 /nfs/dbraw/zinc/53/33/57/944533357.db2.gz ZNUROYWMXHCVQW-CQSZACIVSA-N 0 0 359.813 3.920 20 5 FHBDRN COC(=O)c1ccc(OCCOc2ccc3ccccc3c2)c([N+](=O)[O-])c1 ZINC000506547437 944537450 /nfs/dbraw/zinc/53/74/50/944537450.db2.gz JDHOHZAPHCOSKA-UHFFFAOYSA-N 0 0 367.357 3.992 20 5 FHBDRN CCOc1cc(NC(=O)N2CC(CC(F)F)C2)c([N+](=O)[O-])cc1OCC ZINC000425610154 944538787 /nfs/dbraw/zinc/53/87/87/944538787.db2.gz PFDQJJVZEDATJY-UHFFFAOYSA-N 0 0 373.356 3.511 20 5 FHBDRN O=C(Nc1cc(Br)cc([N+](=O)[O-])c1)c1ccc([O-])c(Cl)c1 ZINC000436714282 944553673 /nfs/dbraw/zinc/55/36/73/944553673.db2.gz SVTHUPIZGILWRS-UHFFFAOYSA-N 0 0 371.574 3.969 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)Nc1ccc(OCCOC)cc1 ZINC000518625848 944555252 /nfs/dbraw/zinc/55/52/52/944555252.db2.gz SSTLFWXDVOBUNL-UHFFFAOYSA-N 0 0 359.382 3.826 20 5 FHBDRN O=C(NCCc1ccc(OC(F)F)cc1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000015098347 944557881 /nfs/dbraw/zinc/55/78/81/944557881.db2.gz PPRRWZFAOQNPIQ-UHFFFAOYSA-N 0 0 370.739 3.822 20 5 FHBDRN C[C@H](C(=O)N[C@H]1CCCN(c2cccc(F)c2)C1)c1cccc([N+](=O)[O-])c1 ZINC000518641943 944560909 /nfs/dbraw/zinc/56/09/09/944560909.db2.gz YXMAPAVWWCXQGO-YOEHRIQHSA-N 0 0 371.412 3.623 20 5 FHBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1CN(C)Cc1ccccc1[N+](=O)[O-] ZINC000729470241 944561226 /nfs/dbraw/zinc/56/12/26/944561226.db2.gz FEZGFCPIBKMQRY-UHFFFAOYSA-N 0 0 359.382 3.922 20 5 FHBDRN COC(=O)c1cc(C)nc(N2CC[C@H](C)C[C@H]2c2ccco2)c1[N+](=O)[O-] ZINC000516198577 944570475 /nfs/dbraw/zinc/57/04/75/944570475.db2.gz YLHRXIBAKKKJKK-FZMZJTMJSA-N 0 0 359.382 3.655 20 5 FHBDRN CSc1cccc(-c2nc([C@H](C)C(=O)OC(C)(C)C)no2)c1[N+](=O)[O-] ZINC000517781484 944607333 /nfs/dbraw/zinc/60/73/33/944607333.db2.gz OLYHPCVGRHCSRD-VIFPVBQESA-N 0 0 365.411 3.812 20 5 FHBDRN Cc1ccc(S(=O)(=O)N(C)[C@@H](C)c2c(F)cccc2F)cc1[N+](=O)[O-] ZINC000518691039 944608769 /nfs/dbraw/zinc/60/87/69/944608769.db2.gz ZFQUXBYTQJUQIH-NSHDSACASA-N 0 0 370.377 3.563 20 5 FHBDRN CNc1c(C(=O)NCCCc2c[nH]c3ccc(F)cc23)cccc1[N+](=O)[O-] ZINC000506238129 944617919 /nfs/dbraw/zinc/61/79/19/944617919.db2.gz MHKYEBLSNSFIDS-UHFFFAOYSA-N 0 0 370.384 3.620 20 5 FHBDRN CSc1ccc(C(=O)N(C)C[C@H]2OCCc3ccccc32)cc1[N+](=O)[O-] ZINC000506237325 944620812 /nfs/dbraw/zinc/62/08/12/944620812.db2.gz BLISNMAAPXZLFW-QGZVFWFLSA-N 0 0 372.446 3.703 20 5 FHBDRN COc1c(F)cc(F)cc1NC(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000473836489 944624745 /nfs/dbraw/zinc/62/47/45/944624745.db2.gz NZIAEOSYKBMNBY-SECBINFHSA-N 0 0 351.309 3.764 20 5 FHBDRN CC(C)CC1(CNC(=O)c2ccc([N+](=O)[O-])cc2Br)CC1 ZINC000150746314 944628653 /nfs/dbraw/zinc/62/86/53/944628653.db2.gz RBHMVTQAJUMRCF-UHFFFAOYSA-N 0 0 355.232 3.913 20 5 FHBDRN C[C@H]1Oc2cc(F)ccc2[C@@H]1NC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000566698758 944632480 /nfs/dbraw/zinc/63/24/80/944632480.db2.gz OCBRPCCLJIISMW-PIGZYNQJSA-N 0 0 358.369 3.650 20 5 FHBDRN CC(C)(C)Cc1nc2cc(NC(=O)c3cc([N+](=O)[O-])c[nH]c3=O)ccc2o1 ZINC000518706953 944634296 /nfs/dbraw/zinc/63/42/96/944634296.db2.gz JJUWCQPGENVTKR-UHFFFAOYSA-N 0 0 370.365 3.678 20 5 FHBDRN COCc1cc(CNC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)ccc1F ZINC000473835995 944641461 /nfs/dbraw/zinc/64/14/61/944641461.db2.gz KWPSTPVDAPWBFA-UHFFFAOYSA-N 0 0 360.385 3.934 20 5 FHBDRN CCC[C@@H](NC(=O)COc1c(Cl)cncc1[N+](=O)[O-])c1ccccc1 ZINC000506583652 944642343 /nfs/dbraw/zinc/64/23/43/944642343.db2.gz KGJIVHCBSWNGAU-CQSZACIVSA-N 0 0 363.801 3.680 20 5 FHBDRN Cc1nc(CN2CCC(CNc3c(C)cccc3[N+](=O)[O-])CC2)oc1C ZINC000110603465 944651231 /nfs/dbraw/zinc/65/12/31/944651231.db2.gz JPIXGVRSCFFJMK-UHFFFAOYSA-N 0 0 358.442 3.832 20 5 FHBDRN O=C(NCc1nc2c(s1)CCC2)Nc1cccc([N+](=O)[O-])c1Cl ZINC000931298131 944670226 /nfs/dbraw/zinc/67/02/26/944670226.db2.gz XKAUSYBERWWSHR-UHFFFAOYSA-N 0 0 352.803 3.515 20 5 FHBDRN COc1c(Cl)cc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)cc1Cl ZINC000506248817 944671660 /nfs/dbraw/zinc/67/16/60/944671660.db2.gz KPZIWOGXIORDDL-UHFFFAOYSA-N 0 0 374.155 3.884 20 5 FHBDRN CC[C@H]1CCC[C@H]1NC(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000426029468 944672156 /nfs/dbraw/zinc/67/21/56/944672156.db2.gz PURMKJTXLAQZFH-SMDDNHRTSA-N 0 0 359.348 3.992 20 5 FHBDRN C[C@H]1CN(C(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCC1(F)F ZINC000290782055 944677581 /nfs/dbraw/zinc/67/75/81/944677581.db2.gz CLBAZKPEGTXJOD-QMMMGPOBSA-N 0 0 352.259 3.731 20 5 FHBDRN Cc1cccc(OC(=O)c2ccc3c(c2[N+](=O)[O-])OCCCO3)c1Cl ZINC001270669343 944679772 /nfs/dbraw/zinc/67/97/72/944679772.db2.gz UQSKCLPIEKQHJD-UHFFFAOYSA-N 0 0 363.753 3.937 20 5 FHBDRN C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CC[C@@](C)(c2ccccc2)C1 ZINC000438505736 944681302 /nfs/dbraw/zinc/68/13/02/944681302.db2.gz OBMQKUJMSDZWIU-FOIQADDNSA-N 0 0 353.422 3.585 20 5 FHBDRN CC(C)c1ccc(C[NH2+]CCc2ccc(OCC(=O)[O-])cc2)cc1[N+](=O)[O-] ZINC000426685964 944684227 /nfs/dbraw/zinc/68/42/27/944684227.db2.gz LGEUHHHCWZNURO-UHFFFAOYSA-N 0 0 372.421 3.514 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1OCCOc1ccccc1Br ZINC000506868036 944685542 /nfs/dbraw/zinc/68/55/42/944685542.db2.gz YADIARRLKFMAGE-UHFFFAOYSA-N 0 0 368.183 3.824 20 5 FHBDRN CC(C)[C@H](CCO)NC(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000438493354 944686684 /nfs/dbraw/zinc/68/66/84/944686684.db2.gz VFPRMICMWIDJQM-SFHVURJKSA-N 0 0 373.409 3.916 20 5 FHBDRN C[C@@H](NC(=O)CSc1ccccc1[N+](=O)[O-])c1c(F)cccc1F ZINC000506858938 944688742 /nfs/dbraw/zinc/68/87/42/944688742.db2.gz PDPMSDVVEJMCIE-SNVBAGLBSA-N 0 0 352.362 3.843 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@H](c1ccc(CC(C)C)cc1)C1CC1 ZINC000506252148 944690685 /nfs/dbraw/zinc/69/06/85/944690685.db2.gz FGOMNYBBXQMZKB-HXUWFJFHSA-N 0 0 370.453 3.566 20 5 FHBDRN O=[N+]([O-])c1ccc(OC(F)F)c(CN[C@H]2C[C@H](CO)c3ccccc32)c1 ZINC000364431099 944693143 /nfs/dbraw/zinc/69/31/43/944693143.db2.gz DJSKUDMKVDQKSE-WBMJQRKESA-N 0 0 364.348 3.507 20 5 FHBDRN CO[C@@H](CNC(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000439515276 944699779 /nfs/dbraw/zinc/69/97/79/944699779.db2.gz PLASTSKLOMOBNR-SFHVURJKSA-N 0 0 360.385 3.975 20 5 FHBDRN COc1ccccc1[C@@]1(C)C[C@H]1NC(=O)c1c(C)c(C)ccc1[N+](=O)[O-] ZINC001126467345 944703435 /nfs/dbraw/zinc/70/34/35/944703435.db2.gz WIKFRJHSSHXWKM-YLJYHZDGSA-N 0 0 354.406 3.680 20 5 FHBDRN COC(=O)c1cc2c(o1)c(OC)ccc2/C=C/c1ccc([N+](=O)[O-])cn1 ZINC000439527089 944712637 /nfs/dbraw/zinc/71/26/37/944712637.db2.gz OTXLUDVUWBNCAQ-HWKANZROSA-N 0 0 354.318 3.702 20 5 FHBDRN CCN(CC)C(=O)c1ccccc1NCc1c(F)cc([N+](=O)[O-])cc1F ZINC000506262786 944719688 /nfs/dbraw/zinc/71/96/88/944719688.db2.gz RLAUGTMOGLNXII-UHFFFAOYSA-N 0 0 363.364 3.967 20 5 FHBDRN CC(C)(C)c1ccc(NC(=O)COc2c(Cl)cncc2[N+](=O)[O-])cc1 ZINC000506602954 944722570 /nfs/dbraw/zinc/72/25/70/944722570.db2.gz ZOHBMIZBARYQHM-UHFFFAOYSA-N 0 0 363.801 3.958 20 5 FHBDRN O=C([O-])[C@@H](CC1CCCC1)[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000426723105 944723616 /nfs/dbraw/zinc/72/36/16/944723616.db2.gz XUKXMHHMGBYVQO-QGZVFWFLSA-N 0 0 358.394 3.978 20 5 FHBDRN CSc1ccc(C(=O)NC2CCC3(CCOCC3)CC2)cc1[N+](=O)[O-] ZINC000438523479 944727706 /nfs/dbraw/zinc/72/77/06/944727706.db2.gz MMJWHJVLMIJURI-UHFFFAOYSA-N 0 0 364.467 3.786 20 5 FHBDRN COC(=O)c1[nH]c(C)c(C(=O)Nc2ccc(C(C)(C)C)c([N+](=O)[O-])c2)c1C ZINC000557154445 944737763 /nfs/dbraw/zinc/73/77/63/944737763.db2.gz DCIUVZLPDBUIKU-UHFFFAOYSA-N 0 0 373.409 3.876 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N1CCC(COc2ccccc2)CC1 ZINC000511661459 944744182 /nfs/dbraw/zinc/74/41/82/944744182.db2.gz OKZANOKLVFKMCT-UHFFFAOYSA-N 0 0 354.406 3.834 20 5 FHBDRN Cc1cn(-c2ccc(F)cc2)nc1C(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000509600016 944746822 /nfs/dbraw/zinc/74/68/22/944746822.db2.gz KRRHXDVKBNBVDJ-UHFFFAOYSA-N 0 0 368.368 3.500 20 5 FHBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@@H](c2ccc(F)cc2)C2CCC2)s1 ZINC000517869485 944746862 /nfs/dbraw/zinc/74/68/62/944746862.db2.gz GQPWMDLXJBSLFL-OAHLLOKOSA-N 0 0 370.427 3.615 20 5 FHBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@H](c2ccccc2)C2CCC2)c(F)c1 ZINC000517869497 944747212 /nfs/dbraw/zinc/74/72/12/944747212.db2.gz GSYSPZOSOJXYEW-QGZVFWFLSA-N 0 0 364.398 3.554 20 5 FHBDRN Cc1csc(Sc2ccc(C(=O)N3C[C@H](C)[C@@H]3C)cc2[N+](=O)[O-])n1 ZINC000509612518 944756882 /nfs/dbraw/zinc/75/68/82/944756882.db2.gz CMYLLMDUFIZFFH-ONGXEEELSA-N 0 0 363.464 3.991 20 5 FHBDRN O=C(Nc1ccc(OCC(F)(F)F)cc1)c1cc(F)cc([N+](=O)[O-])c1 ZINC000518791750 944772477 /nfs/dbraw/zinc/77/24/77/944772477.db2.gz ALTSKVQCORNPGF-UHFFFAOYSA-N 0 0 358.247 3.927 20 5 FHBDRN COc1ccc([C@@H](CCC(=O)[O-])[NH2+]Cc2ccc([N+](=O)[O-])cc2C)cc1 ZINC000426756744 944778320 /nfs/dbraw/zinc/77/83/20/944778320.db2.gz AECFKXKFVMUGTC-GOSISDBHSA-N 0 0 358.394 3.608 20 5 FHBDRN CC1(C)C(=O)N[C@H]1C1CCN(c2c(Cl)cc(Cl)cc2[N+](=O)[O-])CC1 ZINC000518799650 944793789 /nfs/dbraw/zinc/79/37/89/944793789.db2.gz NHRNVCBPSDOMJP-AWEZNQCLSA-N 0 0 372.252 3.643 20 5 FHBDRN Cc1oc2ccccc2c1CNC(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000467220399 944794641 /nfs/dbraw/zinc/79/46/41/944794641.db2.gz WRAPLKFZKWSPAO-UHFFFAOYSA-N 0 0 353.378 3.691 20 5 FHBDRN Cc1cc(C(=O)Nc2cc(NC(=O)N(C)C)ccc2C)cc([N+](=O)[O-])c1 ZINC000437930758 944800596 /nfs/dbraw/zinc/80/05/96/944800596.db2.gz VYUIEBMGIICILN-UHFFFAOYSA-N 0 0 356.382 3.557 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1-c1nc(Cc2ccc(-n3cccn3)cc2)no1 ZINC000518847571 944840326 /nfs/dbraw/zinc/84/03/26/944840326.db2.gz SYPKKDNPHBTCJE-UHFFFAOYSA-N 0 0 361.361 3.730 20 5 FHBDRN COc1cnccc1[C@H](C)NC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000438607852 944845793 /nfs/dbraw/zinc/84/57/93/944845793.db2.gz VDUHJOPVWHPYIO-VIFPVBQESA-N 0 0 369.299 3.508 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)F)cc1N1CCc2c(F)ccc(F)c2C1 ZINC000436413101 944846849 /nfs/dbraw/zinc/84/68/49/944846849.db2.gz TZDPMZAKMUJVPN-UHFFFAOYSA-N 0 0 359.254 3.850 20 5 FHBDRN C[C@H](OC(=O)c1ccc(N2CCCC2=O)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000047176465 944850144 /nfs/dbraw/zinc/85/01/44/944850144.db2.gz JUUZOWXPPMAPQV-ZDUSSCGKSA-N 0 0 354.362 3.640 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](C(=O)[O-])C12CC3CC(CC(C3)C1)C2 ZINC000426828375 944853515 /nfs/dbraw/zinc/85/35/15/944853515.db2.gz LFTOYYRUKQHXRO-XAPRQVHKSA-N 0 0 358.438 3.662 20 5 FHBDRN COC(=O)[C@@H](C)Cc1ccc(NCc2c(F)cc([N+](=O)[O-])cc2F)cc1 ZINC000506297995 944858460 /nfs/dbraw/zinc/85/84/60/944858460.db2.gz NSKPCRKERXEEEV-NSHDSACASA-N 0 0 364.348 3.837 20 5 FHBDRN Cc1ccc(OCCCNc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)cc1 ZINC000507016499 944864192 /nfs/dbraw/zinc/86/41/92/944864192.db2.gz YGAFMQDOCHMPIP-UHFFFAOYSA-N 0 0 355.394 3.669 20 5 FHBDRN COc1cc(C(=O)NCc2ccccc2OCC(C)C)ccc1[N+](=O)[O-] ZINC000511662756 944875044 /nfs/dbraw/zinc/87/50/44/944875044.db2.gz TVHJMDXGHPHJDH-UHFFFAOYSA-N 0 0 358.394 3.568 20 5 FHBDRN CC[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2[O-])CC[C@H]1c1ccccc1 ZINC000436982694 944875271 /nfs/dbraw/zinc/87/52/71/944875271.db2.gz UPOGKIJQUSNOOU-RHSMWYFYSA-N 0 0 354.406 3.956 20 5 FHBDRN Cc1ccc(O[C@@H](C)CNC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000511664699 944892938 /nfs/dbraw/zinc/89/29/38/944892938.db2.gz MYXJHUOYNGXQGM-INIZCTEOSA-N 0 0 371.437 3.555 20 5 FHBDRN O=C(c1cccc(NCc2c(F)cc([N+](=O)[O-])cc2F)c1)N1CCCC1 ZINC000506309674 944895464 /nfs/dbraw/zinc/89/54/64/944895464.db2.gz NSVLGAGAEZIPNS-UHFFFAOYSA-N 0 0 361.348 3.721 20 5 FHBDRN COc1ccc(C2(CNc3c([N+](=O)[O-])ncn3C)CCCCC2)cc1OC ZINC000511670115 944896612 /nfs/dbraw/zinc/89/66/12/944896612.db2.gz FVHVYVHQCHYUNO-UHFFFAOYSA-N 0 0 374.441 3.660 20 5 FHBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N(C)C[C@H]1CC=CCC1 ZINC000543194681 944899405 /nfs/dbraw/zinc/89/94/05/944899405.db2.gz ZSQRTDVBKAOXPN-OLZOCXBDSA-N 0 0 352.818 3.830 20 5 FHBDRN CC[C@H](Nc1ccccc1[N+](=O)[O-])c1ccccc1OCC(=O)N(C)C ZINC000426881282 944899921 /nfs/dbraw/zinc/89/99/21/944899921.db2.gz DHUAJRPHLDVAQD-HNNXBMFYSA-N 0 0 357.410 3.625 20 5 FHBDRN O=C(COc1cccc([N+](=O)[O-])c1)N[C@@H]1CC[C@H](Cc2ccccc2)C1 ZINC000438686302 944910941 /nfs/dbraw/zinc/91/09/41/944910941.db2.gz CUOMICHANMDFDY-IAGOWNOFSA-N 0 0 354.406 3.501 20 5 FHBDRN O=[N+]([O-])c1ccccc1Cc1noc(-c2cc3c(cc2O)CCCC3)n1 ZINC000436999414 944914242 /nfs/dbraw/zinc/91/42/42/944914242.db2.gz RKJMVDJTSQUMMD-UHFFFAOYSA-N 0 0 351.362 3.820 20 5 FHBDRN CCN(C(=O)c1ccc([N+](=O)[O-])cc1OC)[C@@H](C)c1cccc(OC)c1 ZINC000426906559 944916745 /nfs/dbraw/zinc/91/67/45/944916745.db2.gz GBUPEEDZTDNIAA-ZDUSSCGKSA-N 0 0 358.394 3.835 20 5 FHBDRN O=C1N[C@@H](CC2CCCCC2)C(=O)N1Cc1ccc([N+](=O)[O-])cc1Cl ZINC000432012683 944925989 /nfs/dbraw/zinc/92/59/89/944925989.db2.gz NYTPFXCSQKFSMU-HNNXBMFYSA-N 0 0 365.817 3.639 20 5 FHBDRN O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)Nc1cnc(-c2ccccc2)nc1 ZINC000516484215 944929451 /nfs/dbraw/zinc/92/94/51/944929451.db2.gz DZOHJPXYTPEOPR-UHFFFAOYSA-N 0 0 370.315 3.511 20 5 FHBDRN COc1ccccc1[C@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1)c1ccco1 ZINC000163780235 944930238 /nfs/dbraw/zinc/93/02/38/944930238.db2.gz DBVNXBIJLFTBGR-FQEVSTJZSA-N 0 0 366.373 3.645 20 5 FHBDRN CC(C)COc1ccc(CCNC(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC000518012159 944931702 /nfs/dbraw/zinc/93/17/02/944931702.db2.gz PFTAOFCLABGPJB-UHFFFAOYSA-N 0 0 357.410 3.994 20 5 FHBDRN Cn1cc(-c2cc(CSCc3c(F)cc([N+](=O)[O-])cc3F)on2)cn1 ZINC000507098705 944949824 /nfs/dbraw/zinc/94/98/24/944949824.db2.gz UOKSULAYDPPGAN-UHFFFAOYSA-N 0 0 366.349 3.695 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H]1CCOc2c(Cl)cccc21 ZINC000426939299 944953382 /nfs/dbraw/zinc/95/33/82/944953382.db2.gz DYZGHBIFDBXJJQ-AWEZNQCLSA-N 0 0 362.769 3.510 20 5 FHBDRN COc1cc(NC(=O)COc2ccc([N+](=O)[O-])cc2)ccc1C(F)(F)F ZINC000426944672 944958726 /nfs/dbraw/zinc/95/87/26/944958726.db2.gz XDXWRTOQLDAYES-UHFFFAOYSA-N 0 0 370.283 3.640 20 5 FHBDRN CN(C[C@H]1OCCc2ccccc21)C(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000506336488 944959799 /nfs/dbraw/zinc/95/97/99/944959799.db2.gz AJCRUVJTLSBUCD-QGZVFWFLSA-N 0 0 360.797 3.634 20 5 FHBDRN O=C(COc1ccc(Cl)c(Cl)c1)NCCc1ccc([N+](=O)[O-])cc1 ZINC000054167788 944964427 /nfs/dbraw/zinc/96/44/27/944964427.db2.gz ZTVADQRZTZUNLQ-UHFFFAOYSA-N 0 0 369.204 3.639 20 5 FHBDRN O=C(NCc1cc2c(s1)CCCC2)c1c[nH]c2cc([N+](=O)[O-])ccc21 ZINC000516523421 944972098 /nfs/dbraw/zinc/97/20/98/944972098.db2.gz NRHRKKUMZPLCQW-UHFFFAOYSA-N 0 0 355.419 3.946 20 5 FHBDRN COc1ccc([C@@H](Nc2c([N+](=O)[O-])ncn2C)c2ccc(F)cc2)cc1 ZINC000511729718 944975904 /nfs/dbraw/zinc/97/59/04/944975904.db2.gz NCIIQBNUYVSIDO-INIZCTEOSA-N 0 0 356.357 3.678 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)[C@@H]1CCCN(c2ccccc2)C1=O ZINC000432054191 944976243 /nfs/dbraw/zinc/97/62/43/944976243.db2.gz SQBXUWODFBOLOZ-INIZCTEOSA-N 0 0 367.405 3.593 20 5 FHBDRN C[C@H]1CN(c2c(Cl)cc(Cl)cc2[N+](=O)[O-])CC2(CCOCC2)O1 ZINC000408104118 944978164 /nfs/dbraw/zinc/97/81/64/944978164.db2.gz CSFXURIEOYWTGN-JTQLQIEISA-N 0 0 361.225 3.676 20 5 FHBDRN CN(Cc1ccccc1OC(F)(F)F)Cc1cc([O-])ccc1[N+](=O)[O-] ZINC000506342736 944981645 /nfs/dbraw/zinc/98/16/45/944981645.db2.gz UESOWSOAYUBWMR-UHFFFAOYSA-N 0 0 356.300 3.831 20 5 FHBDRN CC1=CCCN(C(=O)c2ccc(N3C[C@H](C)C[C@@H](C)C3)c([N+](=O)[O-])c2)C1 ZINC000437959300 944989871 /nfs/dbraw/zinc/98/98/71/944989871.db2.gz GVKFSVJBUJBOAV-HZPDHXFCSA-N 0 0 357.454 3.869 20 5 FHBDRN Cc1cc(C(=O)NCCc2coc(-c3ccc(F)cc3)n2)ccc1[N+](=O)[O-] ZINC000507158617 944991727 /nfs/dbraw/zinc/99/17/27/944991727.db2.gz SOKDRLSBVOOPEM-UHFFFAOYSA-N 0 0 369.352 3.670 20 5 FHBDRN COCC[C@@H](NC(=O)c1c([N+](=O)[O-])cccc1C(F)(F)F)c1ccco1 ZINC000516559004 945009020 /nfs/dbraw/zinc/00/90/20/945009020.db2.gz HXGDZQALGGGZJR-LLVKDONJSA-N 0 0 372.299 3.714 20 5 FHBDRN CS(=O)(=O)c1cc([N+](=O)[O-])ccc1N1CCCC2(C1)CCCCCC2 ZINC000302685930 945009221 /nfs/dbraw/zinc/00/92/21/945009221.db2.gz YEYXEHLRBJYAPW-UHFFFAOYSA-N 0 0 366.483 3.939 20 5 FHBDRN C[C@@H]1CC(C)(C)CC[C@H]1NC(=O)c1cc([N+](=O)[O-])ccc1SCCO ZINC000516572909 945025697 /nfs/dbraw/zinc/02/56/97/945025697.db2.gz UBOOYTDBQCZFJF-IUODEOHRSA-N 0 0 366.483 3.624 20 5 FHBDRN COC(=O)c1cc(CSCc2cc([N+](=O)[O-])ccc2OC)oc1C ZINC000507190138 945033388 /nfs/dbraw/zinc/03/33/88/945033388.db2.gz CJDMJCKCBQLEAX-UHFFFAOYSA-N 0 0 351.380 3.725 20 5 FHBDRN CCOC(=O)c1cc(C)sc1NC(=O)Cc1cccc([N+](=O)[O-])c1C ZINC000439860876 945034248 /nfs/dbraw/zinc/03/42/48/945034248.db2.gz XMMJTQXYEPCZFF-UHFFFAOYSA-N 0 0 362.407 3.631 20 5 FHBDRN COc1ccc(C(=O)N2C[C@H]3CCCCN3c3ccccc32)cc1[N+](=O)[O-] ZINC000519021091 945035470 /nfs/dbraw/zinc/03/54/70/945035470.db2.gz BNLCEHZEDQKQFT-OAHLLOKOSA-N 0 0 367.405 3.623 20 5 FHBDRN COc1ccc(CNC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)c(F)c1 ZINC000437113048 945035475 /nfs/dbraw/zinc/03/54/75/945035475.db2.gz FZHRGZXJZISVML-UHFFFAOYSA-N 0 0 372.274 3.691 20 5 FHBDRN CC(C)[C@H](Cc1ccc(F)cc1)N(C)C(=O)CNc1ccccc1[N+](=O)[O-] ZINC000437116171 945037387 /nfs/dbraw/zinc/03/73/87/945037387.db2.gz MXMIKFYNFXUDHK-IBGZPJMESA-N 0 0 373.428 3.872 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H]1CCCO[C@H]1C(C)C ZINC000439867074 945039665 /nfs/dbraw/zinc/03/96/65/945039665.db2.gz PVJGTGUOZHLSRL-DYVFJYSZSA-N 0 0 365.430 3.566 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H]1CCO[C@H](CC(C)C)C1 ZINC000439870636 945044552 /nfs/dbraw/zinc/04/45/52/945044552.db2.gz GWKXTUGWHCMQJV-DZGCQCFKSA-N 0 0 365.430 3.709 20 5 FHBDRN O=C(NCc1ccc(F)c(F)c1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000437132892 945044891 /nfs/dbraw/zinc/04/48/91/945044891.db2.gz IBDYQEGXHLIXRY-UHFFFAOYSA-N 0 0 360.238 3.822 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)NCCCc1cccc(OC)c1 ZINC000439871610 945045529 /nfs/dbraw/zinc/04/55/29/945045529.db2.gz JFFQFALWCNPKML-UHFFFAOYSA-N 0 0 373.409 3.756 20 5 FHBDRN O=C(NCCc1ccccc1F)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000437135528 945045883 /nfs/dbraw/zinc/04/58/83/945045883.db2.gz SKWGDLDKOAWFOM-UHFFFAOYSA-N 0 0 356.275 3.725 20 5 FHBDRN O=C(NCCOc1cccc(F)c1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000437135424 945046724 /nfs/dbraw/zinc/04/67/24/945046724.db2.gz JDDXAOXJPWSCOQ-UHFFFAOYSA-N 0 0 372.274 3.562 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)NCCc1cc2ccccc2[nH]1 ZINC000439875171 945048171 /nfs/dbraw/zinc/04/81/71/945048171.db2.gz YZMDDGZRLCVUOK-UHFFFAOYSA-N 0 0 368.393 3.839 20 5 FHBDRN CC[C@@H](NS(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1)c1ccc(F)cc1F ZINC000519034313 945048913 /nfs/dbraw/zinc/04/89/13/945048913.db2.gz MSQHXASNOIRARR-OAHLLOKOSA-N 0 0 370.377 3.611 20 5 FHBDRN COc1ccc(C)cc1CC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000437119675 945050483 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FHBDRN CCn1ncc(NC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)c1C(F)(F)F ZINC000439879123 945056696 /nfs/dbraw/zinc/05/66/96/945056696.db2.gz NKUZFOFVXATSRS-SECBINFHSA-N 0 0 371.319 3.713 20 5 FHBDRN COc1ccc2[nH]cc(Cc3nc(Cc4ccccc4[N+](=O)[O-])no3)c2c1 ZINC000519040717 945060521 /nfs/dbraw/zinc/06/05/21/945060521.db2.gz RYIWECHXSZGKNY-UHFFFAOYSA-N 0 0 364.361 3.649 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H]1CCc2cc(F)ccc21 ZINC000439881441 945061539 /nfs/dbraw/zinc/06/15/39/945061539.db2.gz MWGKQFYRHXIQOU-HNNXBMFYSA-N 0 0 359.357 3.942 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)NCc1cccc(C(F)(F)F)c1 ZINC000086989054 945370700 /nfs/dbraw/zinc/37/07/00/945370700.db2.gz KLKRRORWXNBRBR-UHFFFAOYSA-N 0 0 352.312 3.863 20 5 FHBDRN Cc1ccc(C)c2sc(NC(=O)c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3)nc21 ZINC000004331469 945371447 /nfs/dbraw/zinc/37/14/47/945371447.db2.gz ZZQFEPJESHOSDB-UHFFFAOYSA-N 0 0 372.362 3.982 20 5 FHBDRN Cc1c(CNC(=O)c2c[nH]cc2-c2ccccc2F)cccc1[N+](=O)[O-] ZINC000427437954 945378496 /nfs/dbraw/zinc/37/84/96/945378496.db2.gz ARVDAWOVGOHIOY-UHFFFAOYSA-N 0 0 353.353 3.967 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N(C)[C@@H](c1ccccc1)C(F)(F)F ZINC000427451059 945391639 /nfs/dbraw/zinc/39/16/39/945391639.db2.gz OYUXPMPNMHPRKZ-HNNXBMFYSA-N 0 0 368.311 3.979 20 5 FHBDRN CC[C@@H](CNC(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-])c1ccccc1 ZINC000018152668 945395365 /nfs/dbraw/zinc/39/53/65/945395365.db2.gz YCYZPXBJUFSGMC-ZDUSSCGKSA-N 0 0 358.394 3.536 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N(C)c1cccc(OC(F)(F)F)c1 ZINC000427472413 945401611 /nfs/dbraw/zinc/40/16/11/945401611.db2.gz QHMRJKZQXSEDMA-UHFFFAOYSA-N 0 0 370.283 3.779 20 5 FHBDRN O=C(Nc1ccc(N2CCCC2)cn1)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000507665974 945417302 /nfs/dbraw/zinc/41/73/02/945417302.db2.gz WUKISYYMFZKAGH-UHFFFAOYSA-N 0 0 352.350 3.589 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1OC(=O)c1cc(Cl)nc(N2CCCC2)c1 ZINC000760022513 945418461 /nfs/dbraw/zinc/41/84/61/945418461.db2.gz LTSGGBRWIUTJBQ-UHFFFAOYSA-N 0 0 361.785 3.771 20 5 FHBDRN CC[C@H](CNc1c([N+](=O)[O-])c(C)nn1C)Oc1ccccc1C(F)(F)F ZINC000440321217 945419739 /nfs/dbraw/zinc/41/97/39/945419739.db2.gz SDJZNVLEZQBCSF-LLVKDONJSA-N 0 0 372.347 3.925 20 5 FHBDRN C[C@H](c1ccc(F)cc1F)N1CCN(Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000507670826 945423760 /nfs/dbraw/zinc/42/37/60/945423760.db2.gz BJGILJUCNPOLDC-CQSZACIVSA-N 0 0 361.392 3.752 20 5 FHBDRN O=C(CN1CCCc2ccccc2C1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000106887033 945425795 /nfs/dbraw/zinc/42/57/95/945425795.db2.gz DAJLVMMMDIWBDO-UHFFFAOYSA-N 0 0 359.813 3.635 20 5 FHBDRN C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)C(F)(F)c1ccc(F)cc1 ZINC000728810004 945433039 /nfs/dbraw/zinc/43/30/39/945433039.db2.gz ONDJEKOHHRFELO-JTQLQIEISA-N 0 0 350.296 3.804 20 5 FHBDRN COc1cccc([C@H](C)N2CCN(Cc3cccc([N+](=O)[O-])c3C)CC2)c1 ZINC000507687481 945436394 /nfs/dbraw/zinc/43/63/94/945436394.db2.gz HPXFZMTUXSKRPZ-KRWDZBQOSA-N 0 0 369.465 3.791 20 5 FHBDRN CCCN(C[C@H]1CCCCO1)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186002781 945442825 /nfs/dbraw/zinc/44/28/25/945442825.db2.gz QGNXMHNEFIJRQX-OAHLLOKOSA-N 0 0 369.849 3.739 20 5 FHBDRN CN(Cc1c(F)cccc1F)C(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000511872934 945443426 /nfs/dbraw/zinc/44/34/26/945443426.db2.gz CVKJTTPKOIUILL-UHFFFAOYSA-N 0 0 357.316 3.693 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1)N1CCN(c2ccccc2Cl)CC1 ZINC000018175015 945445530 /nfs/dbraw/zinc/44/55/30/945445530.db2.gz ATJJTVMQCSLKIC-UHFFFAOYSA-N 0 0 360.801 3.602 20 5 FHBDRN C[C@@H](CCC[NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1)C(=O)[O-] ZINC000426643838 945456165 /nfs/dbraw/zinc/45/61/65/945456165.db2.gz SUOWVGKKJJZFKO-HNNXBMFYSA-N 0 0 371.437 3.953 20 5 FHBDRN C[C@@H](c1ccc(F)cc1F)N1CCN(Cc2ccccc2[N+](=O)[O-])CC1 ZINC000507716527 945468822 /nfs/dbraw/zinc/46/88/22/945468822.db2.gz HPWZYPXUBHLKCQ-AWEZNQCLSA-N 0 0 361.392 3.752 20 5 FHBDRN Cc1cc(S(=O)(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c(F)cc1F ZINC000440388968 945478201 /nfs/dbraw/zinc/47/82/01/945478201.db2.gz HATKMSZOBSXNIB-LLVKDONJSA-N 0 0 370.377 3.529 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)c1cc2c(C)nn(C)c2s1 ZINC000280990778 945481847 /nfs/dbraw/zinc/48/18/47/945481847.db2.gz ALMFGJCCSKISBH-UHFFFAOYSA-N 0 0 360.395 3.502 20 5 FHBDRN C[C@H](c1ccccc1F)[S@](=O)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000507714428 945488220 /nfs/dbraw/zinc/48/82/20/945488220.db2.gz PLCXHCKKCBDFJB-XELLLNAOSA-N 0 0 364.398 3.572 20 5 FHBDRN CC(=O)Nc1cccc([C@@H](C)NC(=O)CSc2ccccc2[N+](=O)[O-])c1 ZINC000506842051 945490660 /nfs/dbraw/zinc/49/06/60/945490660.db2.gz GQIWCQRHQQWLNE-GFCCVEGCSA-N 0 0 373.434 3.523 20 5 FHBDRN CC(=O)Nc1cccc([C@H](C)NC(=O)CSc2ccccc2[N+](=O)[O-])c1 ZINC000506842052 945490915 /nfs/dbraw/zinc/49/09/15/945490915.db2.gz GQIWCQRHQQWLNE-LBPRGKRZSA-N 0 0 373.434 3.523 20 5 FHBDRN CN(C(=O)c1cccc(OCC(F)(F)F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000432209767 945502805 /nfs/dbraw/zinc/50/28/05/945502805.db2.gz FXMMIPGCUFIRGW-UHFFFAOYSA-N 0 0 354.284 3.813 20 5 FHBDRN O=[N+]([O-])c1cc2ccccc2nc1N1C[C@@H]2CN(c3ccccc3)C[C@H]2C1 ZINC000519503298 945506135 /nfs/dbraw/zinc/50/61/35/945506135.db2.gz YZAXAEGQSDIIAY-IRXDYDNUSA-N 0 0 360.417 3.716 20 5 FHBDRN CC(C)CC[C@](C)(O)CNC(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000440408797 945511995 /nfs/dbraw/zinc/51/19/95/945511995.db2.gz SBCKBLQARFZMHY-IBGZPJMESA-N 0 0 350.459 3.809 20 5 FHBDRN O=[N+]([O-])c1ccc(OC2CCN(c3ccnc4cccnc43)CC2)cc1 ZINC000549522877 945536214 /nfs/dbraw/zinc/53/62/14/945536214.db2.gz HUJYQSZTJXGBGQ-UHFFFAOYSA-N 0 0 350.378 3.586 20 5 FHBDRN C[C@H]1CCN(c2ccc([N+](=O)[O-])cc2-c2nn[nH]n2)[C@H]1c1cccc(F)c1 ZINC000820726768 945539775 /nfs/dbraw/zinc/53/97/75/945539775.db2.gz BTUIOWROLCLUEK-APPDUMDISA-N 0 0 368.372 3.502 20 5 FHBDRN C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCN2C(=O)c2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000281180003 945556202 /nfs/dbraw/zinc/55/62/02/945556202.db2.gz AAQUUNAPXSMBFA-VXAPYIKBSA-N 0 0 366.845 3.650 20 5 FHBDRN C[C@H](Sc1cccnn1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000511886635 945578078 /nfs/dbraw/zinc/57/80/78/945578078.db2.gz ATEDMOJDUOSNIQ-QMMMGPOBSA-N 0 0 372.328 3.523 20 5 FHBDRN CC[C@@H](C)[C@H](C)Oc1c(Br)cc(C(=O)OC)cc1[N+](=O)[O-] ZINC001226270134 945582667 /nfs/dbraw/zinc/58/26/67/945582667.db2.gz PENXBCDQHUTYIN-BDAKNGLRSA-N 0 0 360.204 3.957 20 5 FHBDRN COc1ccc(C(=O)O[C@@H](C)c2cccc([N+](=O)[O-])c2)c(OC)c1OC ZINC000137349888 945584494 /nfs/dbraw/zinc/58/44/94/945584494.db2.gz QMUSTQLZTYOUDT-NSHDSACASA-N 0 0 361.350 3.539 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1OC(=O)/C=C/c1ccc(Br)o1 ZINC000760023517 945585670 /nfs/dbraw/zinc/58/56/70/945585670.db2.gz MVNNOCJEVJHWFN-SOFGYWHQSA-N 0 0 352.140 3.878 20 5 FHBDRN Cc1ccc(-c2nc(C(=O)Oc3c(C)cccc3[N+](=O)[O-])cs2)n1C ZINC000760023228 945602730 /nfs/dbraw/zinc/60/27/30/945602730.db2.gz PWPLJUKEHVJYMZ-UHFFFAOYSA-N 0 0 357.391 3.893 20 5 FHBDRN O=C(NCCc1cn[nH]c1)c1cc([N+](=O)[O-])ccc1SCC1CCCC1 ZINC000519636018 945609168 /nfs/dbraw/zinc/60/91/68/945609168.db2.gz OJUSWPNLRKIVEF-UHFFFAOYSA-N 0 0 374.466 3.573 20 5 FHBDRN C[C@H]1CC[C@@H](CNC(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)C1 ZINC001271268102 945610662 /nfs/dbraw/zinc/61/06/62/945610662.db2.gz YWNOLLVUGQBBOI-JKSUJKDBSA-N 0 0 359.470 3.997 20 5 FHBDRN CCCCCC[C@](C)(NC(=O)c1ccc([N+](=O)[O-])cc1C)C(=O)OCC ZINC001126015007 945613026 /nfs/dbraw/zinc/61/30/26/945613026.db2.gz ZWRYYMPUOAHMII-IBGZPJMESA-N 0 0 364.442 3.925 20 5 FHBDRN CCCCc1ccc(N(C)C[C@@H](O)COc2ccccc2[N+](=O)[O-])cc1 ZINC001167968543 945613259 /nfs/dbraw/zinc/61/32/59/945613259.db2.gz WNAQWSQPCHJQRD-GOSISDBHSA-N 0 0 358.438 3.814 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(NC(=O)C2CC2)cc1 ZINC000281389723 945619536 /nfs/dbraw/zinc/61/95/36/945619536.db2.gz OEISEPUXWOCABX-UHFFFAOYSA-N 0 0 369.377 3.594 20 5 FHBDRN CC(=O)c1c(C)cc(C)c(COC(=O)COc2ccc([N+](=O)[O-])cc2)c1C ZINC000024968282 945623973 /nfs/dbraw/zinc/62/39/73/945623973.db2.gz QQEOVPYXJXTGLO-UHFFFAOYSA-N 0 0 371.389 3.845 20 5 FHBDRN Cn1c(-c2ccc([N+](=O)[O-])cc2)nnc1N(Cc1ccc(F)cc1)C1CC1 ZINC000519674974 945625785 /nfs/dbraw/zinc/62/57/85/945625785.db2.gz YSXDBIZMRMWKEL-UHFFFAOYSA-N 0 0 367.384 3.698 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FHBDRN C[C@H](C(=O)N1CCO[C@@H](c2cccc(Cl)c2)C1)c1cccc([N+](=O)[O-])c1 ZINC000519737881 945703385 /nfs/dbraw/zinc/70/33/85/945703385.db2.gz PABCTQOPLHZENE-SCLBCKFNSA-N 0 0 374.824 3.952 20 5 FHBDRN C[C@H](NC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-])c1ccccn1 ZINC000181752814 945705111 /nfs/dbraw/zinc/70/51/11/945705111.db2.gz FUDYVXNEJSKOTG-JTQLQIEISA-N 0 0 351.815 3.613 20 5 FHBDRN Cc1nn(-c2ccccc2)c(C)c1NC(=O)Cc1ccc([N+](=O)[O-])cc1F ZINC000125304895 945709312 /nfs/dbraw/zinc/70/93/12/945709312.db2.gz BDUOGLSBXFIRQL-UHFFFAOYSA-N 0 0 368.368 3.718 20 5 FHBDRN CC(C)n1cc(Cl)c(NC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)n1 ZINC000894883671 945726195 /nfs/dbraw/zinc/72/61/95/945726195.db2.gz GBIKEJYPMMIDNB-UHFFFAOYSA-N 0 0 361.789 3.619 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(N2CCC[C@H](n3ccc(C(F)(F)F)n3)C2)c1 ZINC000543895262 945726224 /nfs/dbraw/zinc/72/62/24/945726224.db2.gz SJXCCGAUAZYRHB-NSHDSACASA-N 0 0 370.331 3.660 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)NCc1ccc2ccccc2n1 ZINC000522743967 945740159 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CCOc1ccccc1-c1noc(Cc2ccc(OC)cc2[N+](=O)[O-])n1 ZINC001211852595 945818138 /nfs/dbraw/zinc/81/81/38/945818138.db2.gz VLLHFAJNLCSZPN-UHFFFAOYSA-N 0 0 355.350 3.643 20 5 FHBDRN CO[C@@H]1CCN(C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)[C@H](C)C1 ZINC000281747254 945828620 /nfs/dbraw/zinc/82/86/20/945828620.db2.gz IUBIPTQIDGELDD-MWLCHTKSSA-N 0 0 361.320 3.645 20 5 FHBDRN O=C(N[C@@H]1CC=CCC1)c1cc(F)cc2c(=O)c3cccc(F)c3[nH]c12 ZINC000444090400 945839369 /nfs/dbraw/zinc/83/93/69/945839369.db2.gz XQEDPYKRMYHUJU-GFCCVEGCSA-N 0 0 354.356 3.798 20 5 FHBDRN CC(C)CCc1ccc(NC(=O)CNC(=O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000519880495 945841766 /nfs/dbraw/zinc/84/17/66/945841766.db2.gz BCCZOEXYNVZDCQ-UHFFFAOYSA-N 0 0 369.421 3.552 20 5 FHBDRN CC(C)(C)[C@@H]1OCCC[C@@H]1CNc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 ZINC000522800032 945845648 /nfs/dbraw/zinc/84/56/48/945845648.db2.gz AGLCQSIRQPOLMQ-FZKQIMNGSA-N 0 0 361.442 3.733 20 5 FHBDRN O=C(N[C@H]1CC=CCC1)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12 ZINC000444090852 945847764 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CC(C)[C@@H]([NH2+]Cc1cc([O-])ccc1[N+](=O)[O-])c1ccc2c(c1)OCCO2 ZINC000549536739 945872266 /nfs/dbraw/zinc/87/22/66/945872266.db2.gz WZBIMMPPXZZONP-LJQANCHMSA-N 0 0 358.394 3.559 20 5 FHBDRN O=[N+]([O-])c1ccsc1N1CCN(c2ncc(Cl)cc2Cl)CC1 ZINC000302011100 945885755 /nfs/dbraw/zinc/88/57/55/945885755.db2.gz YLRWUJBVXUUJJT-UHFFFAOYSA-N 0 0 359.238 3.685 20 5 FHBDRN C[C@H](C(=O)N[C@@H]1CCO[C@@H](c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000248718909 945888000 /nfs/dbraw/zinc/88/80/00/945888000.db2.gz CCUVWPGRASYASL-ZBQZNYHESA-N 0 0 372.396 3.874 20 5 FHBDRN CC(C)n1cc(Cl)c(NC(=O)CSc2ccc([N+](=O)[O-])cc2)n1 ZINC000894887551 945893228 /nfs/dbraw/zinc/89/32/28/945893228.db2.gz FLBKCVIVQGMAJN-UHFFFAOYSA-N 0 0 354.819 3.756 20 5 FHBDRN CN(Cc1cc(Br)ccc1F)C(=O)c1csc([N+](=O)[O-])c1 ZINC000522816358 945902661 /nfs/dbraw/zinc/90/26/61/945902661.db2.gz WZECQWNCOROVLD-UHFFFAOYSA-N 0 0 373.203 3.830 20 5 FHBDRN Cn1cnc2cc(NC(=O)c3ccc4[nH]c5ccccc5c(=O)c4c3)ccc21 ZINC000444116255 945905741 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C[C@H](NC(=O)N(C)CCOc1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000108469248 945980837 /nfs/dbraw/zinc/98/08/37/945980837.db2.gz PJEIBYTYSYSIEX-ZDUSSCGKSA-N 0 0 361.373 3.515 20 5 FHBDRN CO[C@H]1CCC[C@@H](CC(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C1 ZINC000281962922 945994218 /nfs/dbraw/zinc/99/42/18/945994218.db2.gz UBVYBXWDUDDDGH-ABAIWWIYSA-N 0 0 374.359 3.825 20 5 FHBDRN C[C@H](c1ccccc1[N+](=O)[O-])N(C)[C@H]1CCCN(c2ccccc2)C1=O ZINC000444154671 945997432 /nfs/dbraw/zinc/99/74/32/945997432.db2.gz DYBSYCFTLQCIQY-BEFAXECRSA-N 0 0 353.422 3.783 20 5 FHBDRN Cc1c([C@@H](C)NC(=O)c2ccc([N+](=O)[O-])s2)cnn1-c1ccc(F)cc1 ZINC000520000152 946005019 /nfs/dbraw/zinc/00/50/19/946005019.db2.gz CGHYFNWERTYNAB-SNVBAGLBSA-N 0 0 374.397 3.781 20 5 FHBDRN O=C(c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)N1CCCC2(CCCCC2)C1 ZINC000111161129 946007509 /nfs/dbraw/zinc/00/75/09/946007509.db2.gz AASRWHIYCXVOCI-UHFFFAOYSA-N 0 0 368.437 3.967 20 5 FHBDRN O=[N+]([O-])c1cccc(CS(=O)(=O)Cc2cccc(C(F)(F)F)c2)c1 ZINC000045307993 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FHBDRN O=C([C@@H]1C[C@@H]1c1ccccc1Cl)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088231252 946293254 /nfs/dbraw/zinc/29/32/54/946293254.db2.gz MMCDHSIKUBXUPB-IAGOWNOFSA-N 0 0 356.809 3.937 20 5 FHBDRN O=[N+]([O-])c1cc(-c2nc(-c3cccc(Cl)c3)no2)ccc1-n1cncn1 ZINC000109468214 946299486 /nfs/dbraw/zinc/29/94/86/946299486.db2.gz CZMKMIDMNLNCDO-UHFFFAOYSA-N 0 0 368.740 3.546 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(-c2nc(Cc3ccc(OC)cc3)no2)c1 ZINC000549551480 946306421 /nfs/dbraw/zinc/30/64/21/946306421.db2.gz NMDLQFGLJALULY-UHFFFAOYSA-N 0 0 355.350 3.643 20 5 FHBDRN O=[N+]([O-])c1cc(-c2nc(Cc3ccccc3)no2)ccc1N1CCCC1 ZINC000109492793 946310627 /nfs/dbraw/zinc/31/06/27/946310627.db2.gz RTUPXQYEVZRHLV-UHFFFAOYSA-N 0 0 350.378 3.836 20 5 FHBDRN Cn1cc(C(=O)NCCC2=CCCCC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000052935396 946311361 /nfs/dbraw/zinc/31/13/61/946311361.db2.gz YRXCBKQCZRQZLM-UHFFFAOYSA-N 0 0 354.410 3.616 20 5 FHBDRN CO[C@@H]1C[C@H](N(C)C(=O)c2c([N+](=O)[O-])cccc2C(F)(F)F)C12CCC2 ZINC000456559140 946334520 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20 5 FHBDRN COCCCCc1noc(-c2csc(-c3ccc([N+](=O)[O-])cc3)n2)n1 ZINC000545678066 946377759 /nfs/dbraw/zinc/37/77/59/946377759.db2.gz NDUUTLPEMRJGOS-UHFFFAOYSA-N 0 0 360.395 3.737 20 5 FHBDRN O=c1cc(-c2nc(C3Cc4ccccc4C3)no2)c2cc([N+](=O)[O-])ccc2[nH]1 ZINC000545671816 946381367 /nfs/dbraw/zinc/38/13/67/946381367.db2.gz KOPULOGNTOXEHC-UHFFFAOYSA-N 0 0 374.356 3.781 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNc1cc(C(=O)N(C)C)ccc1Cl ZINC000111186185 946396104 /nfs/dbraw/zinc/39/61/04/946396104.db2.gz MPEDBRYBNWXDLL-UHFFFAOYSA-N 0 0 363.801 3.571 20 5 FHBDRN Cn1c(-c2nc(Cc3c[nH]c4cc(Cl)ccc34)no2)ccc1[N+](=O)[O-] ZINC000545685506 946402579 /nfs/dbraw/zinc/40/25/79/946402579.db2.gz VVOGPGNWXGPPAX-UHFFFAOYSA-N 0 0 357.757 3.709 20 5 FHBDRN CSc1cccc(C(=O)NCc2ccccc2OC(F)F)c1[N+](=O)[O-] ZINC000186048583 946402818 /nfs/dbraw/zinc/40/28/18/946402818.db2.gz VUMMCGCQLYNSGD-UHFFFAOYSA-N 0 0 368.361 3.848 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)[C@H](OC)C1CC1 ZINC000456588964 946402975 /nfs/dbraw/zinc/40/29/75/946402975.db2.gz WSFXAXZEFNVWSH-BZNIZROVSA-N 0 0 352.456 3.640 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1-c1noc(-c2ccn(-c3ccccc3F)n2)n1 ZINC000545691373 946406649 /nfs/dbraw/zinc/40/66/49/946406649.db2.gz JKFHNLDROWDLQR-UHFFFAOYSA-N 0 0 365.324 3.945 20 5 FHBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1OC(=O)[C@H]1CCN(c2ccccc2)C1 ZINC001126121583 946409517 /nfs/dbraw/zinc/40/95/17/946409517.db2.gz VBPKWBHLSKXWHN-ZDUSSCGKSA-N 0 0 360.797 3.989 20 5 FHBDRN COc1ccc2c(c1)OC[C@H]2Cc1nc(-c2ccc([N+](=O)[O-])cc2C)no1 ZINC000545697461 946411335 /nfs/dbraw/zinc/41/13/35/946411335.db2.gz XDAKFWLZYGOQTC-GFCCVEGCSA-N 0 0 367.361 3.681 20 5 FHBDRN CCCc1c(C(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)[nH]c(C)c1C(C)=O ZINC000088251973 946412691 /nfs/dbraw/zinc/41/26/91/946412691.db2.gz GHVPCMZELIVWRR-UHFFFAOYSA-N 0 0 369.421 3.585 20 5 FHBDRN COc1c(C(=O)Nc2nc3c(s2)CCCCCC3)cccc1[N+](=O)[O-] ZINC000475120674 946421470 /nfs/dbraw/zinc/42/14/70/946421470.db2.gz PIJKYABSAAGXBZ-UHFFFAOYSA-N 0 0 361.423 3.971 20 5 FHBDRN CSc1cccc(C(=O)Nc2ccc(F)c(NC(C)=O)c2)c1[N+](=O)[O-] ZINC000186059304 946421535 /nfs/dbraw/zinc/42/15/35/946421535.db2.gz TWDZCOSMYBISAN-UHFFFAOYSA-N 0 0 363.370 3.667 20 5 FHBDRN Cc1ccc2c(c1)N(Cc1nnc(-c3ccc([N+](=O)[O-])cc3)o1)CCC2 ZINC000111262823 946421615 /nfs/dbraw/zinc/42/16/15/946421615.db2.gz BCAAIESGVSATPB-UHFFFAOYSA-N 0 0 350.378 3.906 20 5 FHBDRN C[C@@](CO)(NC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)C1CCCCC1 ZINC000444320876 946424088 /nfs/dbraw/zinc/42/40/88/946424088.db2.gz USTZUDJOICCEQG-INIZCTEOSA-N 0 0 374.359 3.675 20 5 FHBDRN CC[C@H](C)n1ncc(NC(=O)c2cccc(OC)c2[N+](=O)[O-])c1C1CC1 ZINC000444322461 946433475 /nfs/dbraw/zinc/43/34/75/946433475.db2.gz JIFMRCGUFKISRN-NSHDSACASA-N 0 0 358.398 3.901 20 5 FHBDRN CC(=O)N(c1nnc(S[C@H](C)c2cccc([N+](=O)[O-])c2)s1)C1CC1 ZINC000025772871 946435549 /nfs/dbraw/zinc/43/55/49/946435549.db2.gz XVXGNIMMFVJPCG-SECBINFHSA-N 0 0 364.452 3.815 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCOc2ccc(F)cc21 ZINC000088266180 946448226 /nfs/dbraw/zinc/44/82/26/946448226.db2.gz SMFHACPEZVTPSL-NSHDSACASA-N 0 0 362.382 3.640 20 5 FHBDRN COC(=O)[C@@H](Cc1ccccc1)NCc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000475136209 946452512 /nfs/dbraw/zinc/45/25/12/946452512.db2.gz HMWSATIZSGJMNV-GOSISDBHSA-N 0 0 356.422 3.592 20 5 FHBDRN Cc1ccsc1[C@@H]1C[C@H]1C(=O)N=c1cc(-c2cccc([N+](=O)[O-])c2)[nH][nH]1 ZINC000440145077 946457912 /nfs/dbraw/zinc/45/79/12/946457912.db2.gz KUCJDBBWUGSHIR-ZIAGYGMSSA-N 0 0 368.418 3.519 20 5 FHBDRN O=[N+]([O-])c1ccc(NCCCOCC2CCOCC2)c(Br)c1 ZINC000484751619 946461112 /nfs/dbraw/zinc/46/11/12/946461112.db2.gz UVGRSHGFQSBITE-UHFFFAOYSA-N 0 0 373.247 3.603 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1OC[C@H](O)c1ccccc1C(F)(F)F ZINC000179065127 946490402 /nfs/dbraw/zinc/49/04/02/946490402.db2.gz MUVJKSQLDQPAAE-ZDUSSCGKSA-N 0 0 357.284 3.735 20 5 FHBDRN Cc1nc2ccccc2n1CCNC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000043341904 946505083 /nfs/dbraw/zinc/50/50/83/946505083.db2.gz QLJANWTUDMHCFH-UHFFFAOYSA-N 0 0 373.800 3.728 20 5 FHBDRN C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH+]1CCC(CO)(C(F)(F)F)CC1 ZINC000897038003 946513057 /nfs/dbraw/zinc/51/30/57/946513057.db2.gz YRGVXWHUQOHTJY-UKTHLTGXSA-N 0 0 358.360 3.635 20 5 FHBDRN CSc1cccc(C(=O)Nc2cc(C(=O)N(C)C)ccc2C)c1[N+](=O)[O-] ZINC000186149154 946517465 /nfs/dbraw/zinc/51/74/65/946517465.db2.gz ZDOYXHCTUNYUCW-UHFFFAOYSA-N 0 0 373.434 3.579 20 5 FHBDRN C[C@@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccccc1C(F)(F)F ZINC000511895113 946536475 /nfs/dbraw/zinc/53/64/75/946536475.db2.gz VLVFCLLKVCTUHM-SNVBAGLBSA-N 0 0 374.340 3.653 20 5 FHBDRN CSc1cccc(C(=O)NCC2(c3cccc(F)c3)CC2)c1[N+](=O)[O-] ZINC000186551820 946536489 /nfs/dbraw/zinc/53/64/89/946536489.db2.gz HLRASIKPNMWGER-UHFFFAOYSA-N 0 0 360.410 3.917 20 5 FHBDRN C[C@H](CNC(=O)N1C[C@H](C)C[C@@H]1c1cccnc1)c1ccccc1[N+](=O)[O-] ZINC000897060908 946546910 /nfs/dbraw/zinc/54/69/10/946546910.db2.gz DFAJSVLLMFOPOH-SPYBWZPUSA-N 0 0 368.437 3.886 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(C)(C)c1nc2ccccc2n1C ZINC000186568570 946554337 /nfs/dbraw/zinc/55/43/37/946554337.db2.gz LMZRLSCRWQDEJG-UHFFFAOYSA-N 0 0 354.410 3.515 20 5 FHBDRN C[C@@H](CNC(=O)N1CC=C(C(F)(F)F)CC1)c1ccccc1[N+](=O)[O-] ZINC000897062659 946555481 /nfs/dbraw/zinc/55/54/81/946555481.db2.gz XALSNNMHEHQKJV-NSHDSACASA-N 0 0 357.332 3.602 20 5 FHBDRN CC(=O)c1ccc2c(c1)CN(C(=O)NC[C@H](C)c1ccccc1[N+](=O)[O-])C2 ZINC000897064482 946557040 /nfs/dbraw/zinc/55/70/40/946557040.db2.gz YUDUFHGGZZUWKJ-ZDUSSCGKSA-N 0 0 367.405 3.626 20 5 FHBDRN COc1cc(F)ccc1NC(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000025796902 946557929 /nfs/dbraw/zinc/55/79/29/946557929.db2.gz CRQKEASGFFSJIY-SNVBAGLBSA-N 0 0 350.371 3.862 20 5 FHBDRN Cc1cnc(C(C)(C)NC(=O)NC[C@H](C)c2ccccc2[N+](=O)[O-])s1 ZINC000897067134 946560452 /nfs/dbraw/zinc/56/04/52/946560452.db2.gz DTUFXCFQZLQFCZ-NSHDSACASA-N 0 0 362.455 3.698 20 5 FHBDRN CCN(C(=O)CCn1nc(C)c([N+](=O)[O-])c1C)c1ccc(Cl)cc1F ZINC000441403234 946580565 /nfs/dbraw/zinc/58/05/65/946580565.db2.gz KJJZTTNGJVINGD-UHFFFAOYSA-N 0 0 368.796 3.644 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1)N[C@@H]1C[C@H]1c1ccc(OC(F)F)cc1 ZINC000475520032 946582692 /nfs/dbraw/zinc/58/26/92/946582692.db2.gz QRMLFOLMAPLPSH-LSDHHAIUSA-N 0 0 363.320 3.874 20 5 FHBDRN CC[C@@H](NC(=O)N1CCCC[C@@H](SC)C1)c1cccc([N+](=O)[O-])c1 ZINC000129508959 946585775 /nfs/dbraw/zinc/58/57/75/946585775.db2.gz HKHMPBNVBVZSSD-HZPDHXFCSA-N 0 0 351.472 3.973 20 5 FHBDRN COc1cc(C(=O)N(C)C2CCCCCC2)c([N+](=O)[O-])cc1OC(F)F ZINC000585708665 946597867 /nfs/dbraw/zinc/59/78/67/946597867.db2.gz QWQQWVMKXMVFDQ-UHFFFAOYSA-N 0 0 372.368 4.000 20 5 FHBDRN CO[C@@H]1CCC[C@@H](CC(=O)Nc2cc(C)nn2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000475536008 946606166 /nfs/dbraw/zinc/60/61/66/946606166.db2.gz ZZVYSMXHQOOUDJ-RHSMWYFYSA-N 0 0 372.425 3.623 20 5 FHBDRN CO[C@H]1CCC[C@@H](CC(=O)Nc2cc(C)nn2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000475536007 946606306 /nfs/dbraw/zinc/60/63/06/946606306.db2.gz ZZVYSMXHQOOUDJ-PBHICJAKSA-N 0 0 372.425 3.623 20 5 FHBDRN Cc1c([C@@H]2C[C@H]2Nc2cc(C)c(C(F)(F)F)cc2[N+](=O)[O-])cnn1C ZINC000549568046 946606434 /nfs/dbraw/zinc/60/64/34/946606434.db2.gz SKHDPZIAKKJNBM-GXFFZTMASA-N 0 0 354.332 3.932 20 5 FHBDRN O=[N+]([O-])c1ccc(Cc2noc([C@H]3C[C@H]3c3c(F)cccc3F)n2)nc1 ZINC000545779293 946608127 /nfs/dbraw/zinc/60/81/27/946608127.db2.gz JKNOFPVCKOKTBU-NEPJUHHUSA-N 0 0 358.304 3.513 20 5 FHBDRN Cc1c(Cc2noc(-c3cccc(OC(C)C)n3)n2)cccc1[N+](=O)[O-] ZINC000545783870 946612522 /nfs/dbraw/zinc/61/25/22/946612522.db2.gz FZOATDHQMWSIKV-UHFFFAOYSA-N 0 0 354.366 3.726 20 5 FHBDRN Cc1c(F)ccc([N+](=O)[O-])c1C(=O)NCc1ccnc(OC2CCCC2)c1 ZINC000843766585 946620766 /nfs/dbraw/zinc/62/07/66/946620766.db2.gz OLMDXHWSGBRPPG-UHFFFAOYSA-N 0 0 373.384 3.689 20 5 FHBDRN O=[N+]([O-])c1ccc(Cc2noc(/C=C\c3ccccc3OC(F)F)n2)nc1 ZINC000545778872 946622220 /nfs/dbraw/zinc/62/22/20/946622220.db2.gz KFJMUTOXUPXLAZ-YVMONPNESA-N 0 0 374.303 3.735 20 5 FHBDRN Cn1cnc([N+](=O)[O-])c1CN(Cc1ccccc1)Cc1ccc(F)cc1 ZINC000475537380 946622385 /nfs/dbraw/zinc/62/23/85/946622385.db2.gz GOHRLIXWCIGRJJ-UHFFFAOYSA-N 0 0 354.385 3.670 20 5 FHBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)N1CCCCC[C@H]1/C=C\c1cccs1 ZINC000184437218 946624376 /nfs/dbraw/zinc/62/43/76/946624376.db2.gz QLKUGKNRAOJMFO-WSROAFLRSA-N 0 0 372.450 3.732 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)N[C@@H]1CCO[C@@H](c2ccccc2)C1 ZINC000184438439 946625906 /nfs/dbraw/zinc/62/59/06/946625906.db2.gz MLZHYGIRPYUFKW-IEBWSBKVSA-N 0 0 369.421 3.657 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)N[C@H]1CCO[C@H](c2ccccc2)C1 ZINC000184438418 946625942 /nfs/dbraw/zinc/62/59/42/946625942.db2.gz MLZHYGIRPYUFKW-HKUYNNGSSA-N 0 0 369.421 3.657 20 5 FHBDRN C[C@]1(CO)CCC[C@H]1NC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000473906632 946628508 /nfs/dbraw/zinc/62/85/08/946628508.db2.gz UDAOUDYIRMJLTF-UYAOXDASSA-N 0 0 369.421 3.619 20 5 FHBDRN Cc1cc(C(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)nc(C(F)(F)F)n1 ZINC000186218953 946629638 /nfs/dbraw/zinc/62/96/38/946629638.db2.gz QPIWXYDAZNIIMZ-UHFFFAOYSA-N 0 0 354.288 3.581 20 5 FHBDRN CCS[C@H]1CCCCN(C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)C1 ZINC000112038083 946630951 /nfs/dbraw/zinc/63/09/51/946630951.db2.gz ZTOWAWVDCZJZNJ-KRWDZBQOSA-N 0 0 374.466 3.528 20 5 FHBDRN O=C1[C@H](Nc2ncccc2[N+](=O)[O-])CCN1c1ccc(Cl)cc1Cl ZINC000473909172 946633342 /nfs/dbraw/zinc/63/33/42/946633342.db2.gz AGLXIGJQVWBCQC-LLVKDONJSA-N 0 0 367.192 3.514 20 5 FHBDRN Cc1ccc(C(=O)Nc2cc(-c3cc(F)cc(F)c3)nn2C)cc1[N+](=O)[O-] ZINC000487490665 946639973 /nfs/dbraw/zinc/63/99/73/946639973.db2.gz XEJURFDYALWHMR-UHFFFAOYSA-N 0 0 372.331 3.834 20 5 FHBDRN O=C(COC(=O)c1cc2c(s1)CCCCC2)c1cccc([N+](=O)[O-])c1 ZINC000785298259 946654018 /nfs/dbraw/zinc/65/40/18/946654018.db2.gz DDAOYCRBHZUCRY-UHFFFAOYSA-N 0 0 359.403 3.965 20 5 FHBDRN O=C(Nc1ccc(F)cc1C(F)(F)F)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000473912378 946664910 /nfs/dbraw/zinc/66/49/10/946664910.db2.gz RTMZLAZGYICNSI-UHFFFAOYSA-N 0 0 368.246 3.881 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)c1sccc1Br ZINC000070167359 946670658 /nfs/dbraw/zinc/67/06/58/946670658.db2.gz HKTRAQITKZNRDM-UHFFFAOYSA-N 0 0 357.185 3.680 20 5 FHBDRN COc1cccc(C[C@@H]2CCCN2C(=O)NCc2cccc([N+](=O)[O-])c2)c1 ZINC000067536325 946675603 /nfs/dbraw/zinc/67/56/03/946675603.db2.gz LGXPBBWDIIDLPG-KRWDZBQOSA-N 0 0 369.421 3.520 20 5 FHBDRN C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)CCc1nnc(C2CCCC2)o1 ZINC000121417491 946681821 /nfs/dbraw/zinc/68/18/21/946681821.db2.gz NBRAUNWLTYAXMJ-LBPRGKRZSA-N 0 0 370.409 3.546 20 5 FHBDRN O=[N+]([O-])c1ccc(C(F)(F)c2nc([C@@H]3CCOC4(CCC4)C3)no2)cc1 ZINC000897105979 946692122 /nfs/dbraw/zinc/69/21/22/946692122.db2.gz DVHWKZXTSGVXON-LLVKDONJSA-N 0 0 365.336 3.935 20 5 FHBDRN COC1CCC(CCNC(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)CC1 ZINC000541636054 946695446 /nfs/dbraw/zinc/69/54/46/946695446.db2.gz KMYUZGNTRBPUNN-DNOWBOINSA-N 0 0 352.406 3.549 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCCc2cc(N)ccc21 ZINC000186611085 946701261 /nfs/dbraw/zinc/70/12/61/946701261.db2.gz MASYKVPNKKJTCI-KPZWWZAWSA-N 0 0 371.462 3.851 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CCCc2cc(N)ccc21 ZINC000186611117 946701733 /nfs/dbraw/zinc/70/17/33/946701733.db2.gz MASYKVPNKKJTCI-SGTLLEGYSA-N 0 0 371.462 3.851 20 5 FHBDRN CO[C@@H]1CCC[C@@H]1CNC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000475198126 946708138 /nfs/dbraw/zinc/70/81/38/946708138.db2.gz VUMJYHPBQCEGHG-NOZJJQNGSA-N 0 0 361.320 3.550 20 5 FHBDRN CCOc1cc2c(cc1NC(=O)c1cc(OC)ccc1[N+](=O)[O-])O[C@H](C)C2 ZINC000067542718 946709106 /nfs/dbraw/zinc/70/91/06/946709106.db2.gz UOZDLXUULSFBTC-LLVKDONJSA-N 0 0 372.377 3.578 20 5 FHBDRN CCOC(=O)c1ccc(CNC(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)cc1 ZINC000475571526 946710981 /nfs/dbraw/zinc/71/09/81/946710981.db2.gz VPLKWYORBWRBKB-UHFFFAOYSA-N 0 0 371.393 3.710 20 5 FHBDRN CO[C@H](C)CN(C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)C(C)C ZINC000475209882 946726475 /nfs/dbraw/zinc/72/64/75/946726475.db2.gz NSKGFPZVNUKXLC-SNVBAGLBSA-N 0 0 363.336 3.891 20 5 FHBDRN COc1ccc(S(=O)(=O)N(C)c2ccc(C(C)C)cc2)cc1[N+](=O)[O-] ZINC000150766090 946729004 /nfs/dbraw/zinc/72/90/04/946729004.db2.gz FKRXBCXHNLOBGJ-UHFFFAOYSA-N 0 0 364.423 3.552 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1CNc1ccc(NC(=O)c2ccccc2)cn1 ZINC000475578183 946737506 /nfs/dbraw/zinc/73/75/06/946737506.db2.gz MVCLUDXJXHJYLK-UHFFFAOYSA-N 0 0 362.389 3.585 20 5 FHBDRN O=C(Nc1cc(F)c(F)c(F)c1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088390535 946739506 /nfs/dbraw/zinc/73/95/06/946739506.db2.gz ZYFOISFAMLILPO-UHFFFAOYSA-N 0 0 351.284 3.602 20 5 FHBDRN CC[C@H]1CN(C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CCS1 ZINC000475239125 946748950 /nfs/dbraw/zinc/74/89/50/946748950.db2.gz WDIRPSVRWXWMLR-JTQLQIEISA-N 0 0 363.361 3.973 20 5 FHBDRN COc1ccc(CCCNC(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)cc1 ZINC000475587868 946761323 /nfs/dbraw/zinc/76/13/23/946761323.db2.gz WLQRDYAGXLKWQZ-UHFFFAOYSA-N 0 0 357.410 3.975 20 5 FHBDRN CCc1c(C(=O)N(C)c2cccc([N+](=O)[O-])c2)cnn1-c1ccccc1C ZINC000186634992 946767037 /nfs/dbraw/zinc/76/70/37/946767037.db2.gz FZKBBDUPKWYHMG-UHFFFAOYSA-N 0 0 364.405 3.928 20 5 FHBDRN COc1ccc(NC(=O)[C@@H](C)c2cn(C)c3ccccc23)c([N+](=O)[O-])c1 ZINC000186642023 946770018 /nfs/dbraw/zinc/77/00/18/946770018.db2.gz XDZISQCFNUHVIG-LBPRGKRZSA-N 0 0 353.378 3.837 20 5 FHBDRN Cc1cccc(C(=O)N2C[C@@H](c3ccc(F)cc3)O[C@@H](C)C2)c1[N+](=O)[O-] ZINC000151993825 946770670 /nfs/dbraw/zinc/77/06/70/946770670.db2.gz ZTFYUHSKODAQNE-GUYCJALGSA-N 0 0 358.369 3.645 20 5 FHBDRN CCc1ccc([C@H](N[C@@H](C)CC[S@@](C)=O)c2ccc([N+](=O)[O-])cc2)o1 ZINC000544380945 946770844 /nfs/dbraw/zinc/77/08/44/946770844.db2.gz VLKCSGKFLQBVIO-QDOYXITCSA-N 0 0 364.467 3.586 20 5 FHBDRN Cc1cccc(C(=O)N2C[C@H](C)O[C@@H](c3ccc(F)cc3)C2)c1[N+](=O)[O-] ZINC000151993981 946771257 /nfs/dbraw/zinc/77/12/57/946771257.db2.gz ZTFYUHSKODAQNE-SUMWQHHRSA-N 0 0 358.369 3.645 20 5 FHBDRN CN(C(=O)c1cn2cc(Cl)cc(Cl)c2n1)c1ccc([N+](=O)[O-])cc1 ZINC000440422454 946774648 /nfs/dbraw/zinc/77/46/48/946774648.db2.gz RYLSFMMJPSLEMS-UHFFFAOYSA-N 0 0 365.176 3.826 20 5 FHBDRN CCO[C@H](CCNc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-])C(C)C ZINC000074772234 946774952 /nfs/dbraw/zinc/77/49/52/946774952.db2.gz JBJSAEOIZCIMRV-QGZVFWFLSA-N 0 0 351.447 3.596 20 5 FHBDRN Cc1cc(C(=O)N(C)Cc2nc(-c3ccccc3)c[nH]2)cc([N+](=O)[O-])c1 ZINC000121456841 946776327 /nfs/dbraw/zinc/77/63/27/946776327.db2.gz HBVDXXHVRGNEBS-UHFFFAOYSA-N 0 0 350.378 3.566 20 5 FHBDRN Cc1ccc(C)c(OCCCn2cnc(-c3cccc([N+](=O)[O-])c3)n2)c1 ZINC000523109042 946777444 /nfs/dbraw/zinc/77/74/44/946777444.db2.gz QDLBZVDHLKAHHR-UHFFFAOYSA-N 0 0 352.394 3.939 20 5 FHBDRN C[C@H](C(=O)Nc1nccnc1-c1ccccc1)c1ccc([N+](=O)[O-])cc1F ZINC001271731888 946793848 /nfs/dbraw/zinc/79/38/48/946793848.db2.gz JUYYMDNABAMZDM-LBPRGKRZSA-N 0 0 366.352 3.933 20 5 FHBDRN CSc1ccc(C(=O)Nc2cc(C)nn2-c2ccc([N+](=O)[O-])cc2)o1 ZINC000112232187 946810117 /nfs/dbraw/zinc/81/01/17/946810117.db2.gz NJPRXUGADONWNT-UHFFFAOYSA-N 0 0 358.379 3.656 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)c1cnc(-c2ccsc2)s1 ZINC000112238901 946810919 /nfs/dbraw/zinc/81/09/19/946810919.db2.gz SBXAAFNXXOSZKU-UHFFFAOYSA-N 0 0 359.432 3.752 20 5 FHBDRN Cc1c(CN2CC(c3nc(-c4ccccc4)no3)C2)cccc1[N+](=O)[O-] ZINC000897319797 946821476 /nfs/dbraw/zinc/82/14/76/946821476.db2.gz ZYJYEKVPFTWYCE-UHFFFAOYSA-N 0 0 350.378 3.553 20 5 FHBDRN Cc1cc(C(=O)N2CCc3ccc(Br)cc32)cc([N+](=O)[O-])c1 ZINC000112265732 946835344 /nfs/dbraw/zinc/83/53/44/946835344.db2.gz MDEIQWUBWFUMBP-UHFFFAOYSA-N 0 0 361.195 3.869 20 5 FHBDRN CSc1ccc(C(=O)Nc2nc3c(s2)CSCC3)cc1[N+](=O)[O-] ZINC000367715908 946852750 /nfs/dbraw/zinc/85/27/50/946852750.db2.gz MCBKFLKGKZZYBH-UHFFFAOYSA-N 0 0 367.477 3.815 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)NC1(Cc2ccccc2)CCC1 ZINC000473950755 946857315 /nfs/dbraw/zinc/85/73/15/946857315.db2.gz YWBVSVCBPPEDSB-UHFFFAOYSA-N 0 0 353.422 3.602 20 5 FHBDRN CC(C)(C(=O)N[C@H]1CCCOc2ccccc21)c1ccccc1[N+](=O)[O-] ZINC000550379314 946862250 /nfs/dbraw/zinc/86/22/50/946862250.db2.gz KHLPSGXSRDLRCU-INIZCTEOSA-N 0 0 354.406 3.903 20 5 FHBDRN Cc1c(C(=O)Nc2ccc([N+](=O)[O-])c(C)n2)cnn1-c1ccc(Cl)cc1 ZINC000475313575 946870095 /nfs/dbraw/zinc/87/00/95/946870095.db2.gz DZLVERXEIGRTGU-UHFFFAOYSA-N 0 0 371.784 3.698 20 5 FHBDRN Cc1noc(C)c1[C@H](C)NC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000121461582 946870281 /nfs/dbraw/zinc/87/02/81/946870281.db2.gz NPYFBOJWVXQTRS-NSHDSACASA-N 0 0 358.398 3.635 20 5 FHBDRN COc1ccc(CCNC(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)cc1F ZINC000184485744 946872716 /nfs/dbraw/zinc/87/27/16/946872716.db2.gz WKYFFACVOLFMDC-UHFFFAOYSA-N 0 0 361.373 3.724 20 5 FHBDRN Cc1cc([C@H](NC(=O)COc2ccc([N+](=O)[O-])cc2)C2CC2)ccc1F ZINC000536281158 946873848 /nfs/dbraw/zinc/87/38/48/946873848.db2.gz OKQUMNAXGWRKGI-LJQANCHMSA-N 0 0 358.369 3.689 20 5 FHBDRN Cc1ccc(N2CCCN(C(=O)c3c(C)c(F)ccc3[N+](=O)[O-])CC2)cc1 ZINC000843769258 946874415 /nfs/dbraw/zinc/87/44/15/946874415.db2.gz DCYOVRNHQSUGJL-UHFFFAOYSA-N 0 0 371.412 3.703 20 5 FHBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N[C@@H](C)c1cccc(O)c1 ZINC000444453846 946884637 /nfs/dbraw/zinc/88/46/37/946884637.db2.gz FITUBOIFFHHFAF-QWRGUYRKSA-N 0 0 364.785 3.599 20 5 FHBDRN Cc1nn(CC(=O)Nc2cccc(Oc3ccccc3)c2)cc1[N+](=O)[O-] ZINC000181820229 946888887 /nfs/dbraw/zinc/88/88/87/946888887.db2.gz XEGLHRJBZHLKPB-UHFFFAOYSA-N 0 0 352.350 3.531 20 5 FHBDRN CC(C)(NC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2F)n1)c1cccs1 ZINC001126164480 946889362 /nfs/dbraw/zinc/88/93/62/946889362.db2.gz CRWFHLPODPEAIR-UHFFFAOYSA-N 0 0 374.397 3.646 20 5 FHBDRN CC(C)SCCNC(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000485595300 946891172 /nfs/dbraw/zinc/89/11/72/946891172.db2.gz DDFZDIOXCMZRQE-UHFFFAOYSA-N 0 0 362.249 3.620 20 5 FHBDRN Cc1c(C(=O)N2CCC(Nc3ccc(F)cc3)CC2)cccc1[N+](=O)[O-] ZINC000143398857 946907126 /nfs/dbraw/zinc/90/71/26/946907126.db2.gz MXBZZVUIKODXLQ-UHFFFAOYSA-N 0 0 357.385 3.759 20 5 FHBDRN C[C@H](C(=O)Nc1cccc(-c2ncon2)c1)c1ccc([N+](=O)[O-])cc1F ZINC000184506373 946908095 /nfs/dbraw/zinc/90/80/95/946908095.db2.gz XDJABLVPEBMQSX-JTQLQIEISA-N 0 0 356.313 3.526 20 5 FHBDRN COc1cc(NC/C=C/c2ccccc2[N+](=O)[O-])cc(-n2cccn2)c1 ZINC000475340990 946911478 /nfs/dbraw/zinc/91/14/78/946911478.db2.gz BOLJSNDLUMTTDY-QPJJXVBHSA-N 0 0 350.378 3.914 20 5 FHBDRN CCS[C@H]1CCCCN(C(=O)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000458886786 946916990 /nfs/dbraw/zinc/91/69/90/946916990.db2.gz IQGPCZVPYQAJTE-BBRMVZONSA-N 0 0 351.472 3.973 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)c(NCCC2N=NC(=S)N2C2CC2)c(Cl)c1 ZINC000124171302 946937827 /nfs/dbraw/zinc/93/78/27/946937827.db2.gz ZMYPBHZVNXAXKQ-UHFFFAOYSA-N 0 0 374.253 3.771 20 5 FHBDRN Cc1nn(C)c(C)c1[C@H]1CCCN1C(=O)N[C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000458888552 946938697 /nfs/dbraw/zinc/93/86/97/946938697.db2.gz LZTPLFSULIWORM-YVEFUNNKSA-N 0 0 371.441 3.553 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(C)[C@H](c1ccccc1)C(C)C ZINC000112754809 946944489 /nfs/dbraw/zinc/94/44/89/946944489.db2.gz XSUHXHDXPOZZDM-SFHVURJKSA-N 0 0 369.421 3.697 20 5 FHBDRN C[C@H]1CCC[C@@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2Br)C1 ZINC000087067733 946945278 /nfs/dbraw/zinc/94/52/78/946945278.db2.gz BKTMGDLZAQFTBQ-CMPLNLGQSA-N 0 0 355.232 3.595 20 5 FHBDRN COc1cccc([C@H]2C[C@H]2C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000186341644 946960434 /nfs/dbraw/zinc/96/04/34/946960434.db2.gz HJRVMJQWKVYOFW-HZPDHXFCSA-N 0 0 360.797 3.677 20 5 FHBDRN Cc1ccc(C(=O)Nc2ccc(-c3n[nH]c(C4CC4)n3)cc2)cc1[N+](=O)[O-] ZINC000523178791 946984270 /nfs/dbraw/zinc/98/42/70/946984270.db2.gz JYBVYLYXOTUBDA-UHFFFAOYSA-N 0 0 363.377 3.818 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1C(=O)Nc1ncc(Br)s1 ZINC001142014277 946999220 /nfs/dbraw/zinc/99/92/20/946999220.db2.gz ZKRPKKMNSHNYKV-UHFFFAOYSA-N 0 0 356.201 3.683 20 5 FHBDRN Cc1nn(CCC(=O)N(C)Cc2ccc3ccccc3c2)c(C)c1[N+](=O)[O-] ZINC000523223926 947006979 /nfs/dbraw/zinc/00/69/79/947006979.db2.gz BKKYGPFRSBMQMM-UHFFFAOYSA-N 0 0 366.421 3.610 20 5 FHBDRN C[C@H](C[C@@H]1CCOC1)NC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000613862158 947010044 /nfs/dbraw/zinc/01/00/44/947010044.db2.gz FVMLDCORRIBUDZ-ZJUUUORDSA-N 0 0 361.320 3.550 20 5 FHBDRN Cc1cc(S(=O)(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)c(C)s1 ZINC000511927837 947015851 /nfs/dbraw/zinc/01/58/51/947015851.db2.gz SQHOSLGOGYCNQZ-UHFFFAOYSA-N 0 0 368.480 3.872 20 5 FHBDRN Cc1cc(C(=O)N2C[C@@H](C)O[C@H](c3ccc(F)cc3)C2)ccc1[N+](=O)[O-] ZINC000152013451 947022553 /nfs/dbraw/zinc/02/25/53/947022553.db2.gz DJAZXFQIZSNLSU-ACJLOTCBSA-N 0 0 358.369 3.645 20 5 FHBDRN CCOc1ccc(CCC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000186352809 947028846 /nfs/dbraw/zinc/02/88/46/947028846.db2.gz SFTUJTMFKNRVHE-UHFFFAOYSA-N 0 0 362.813 3.896 20 5 FHBDRN COCCc1cc(O)ccc1NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000444610614 947036643 /nfs/dbraw/zinc/03/66/43/947036643.db2.gz OWLXXWFBHIBHFE-UHFFFAOYSA-N 0 0 372.402 3.956 20 5 FHBDRN COc1cc(C(=O)N(C)Cc2ccc(F)c(Cl)c2)ccc1[N+](=O)[O-] ZINC000432271883 947039837 /nfs/dbraw/zinc/03/98/37/947039837.db2.gz QMKLWFJVNRDEQY-UHFFFAOYSA-N 0 0 352.749 3.668 20 5 FHBDRN CCCOc1ccc(CNc2c([N+](=O)[O-])c(C)nn2C)c(OC(F)F)c1 ZINC000152020982 947048647 /nfs/dbraw/zinc/04/86/47/947048647.db2.gz YMFOVXMTNQJGLK-UHFFFAOYSA-N 0 0 370.356 3.639 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1CC2(CCC2)[C@H]1c1ccccc1 ZINC000432279960 947064954 /nfs/dbraw/zinc/06/49/54/947064954.db2.gz LRIMCVAIZZZXCH-GOSISDBHSA-N 0 0 372.446 3.819 20 5 FHBDRN Cc1cc(F)ccc1S(=O)(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000511942821 947071339 /nfs/dbraw/zinc/07/13/39/947071339.db2.gz ZRSUGBWDIRCXHB-UHFFFAOYSA-N 0 0 366.414 3.642 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]c(CN[C@H](c3nccs3)c3ccccc3)nc2c1 ZINC000444653922 947072955 /nfs/dbraw/zinc/07/29/55/947072955.db2.gz VTGVPNFNNQMDIQ-KRWDZBQOSA-N 0 0 365.418 3.807 20 5 FHBDRN CCc1cccc(Oc2ccc(NC(=O)c3n[nH]c(C)c3[N+](=O)[O-])cn2)c1 ZINC000523300344 947078878 /nfs/dbraw/zinc/07/88/78/947078878.db2.gz LROHJISTSQACNZ-UHFFFAOYSA-N 0 0 367.365 3.628 20 5 FHBDRN C[C@@H](Cc1cccc(Cl)c1)C(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444643503 947085976 /nfs/dbraw/zinc/08/59/76/947085976.db2.gz KJBXFWFXJUAUQL-NSHDSACASA-N 0 0 372.812 3.620 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1)CN(Cc1nn(-c3ccccc3)c3c1CCC3)CC2 ZINC000438516700 947089890 /nfs/dbraw/zinc/08/98/90/947089890.db2.gz WUTBDPHJYFVFQO-UHFFFAOYSA-N 0 0 374.444 3.828 20 5 FHBDRN O=C(c1cc(F)cc(Br)c1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000049624270 947091725 /nfs/dbraw/zinc/09/17/25/947091725.db2.gz SYVJXGKMQYFVJQ-UHFFFAOYSA-N 0 0 365.158 3.699 20 5 FHBDRN O=C(Nc1cc(-c2cc(F)cc(F)c2)[nH]n1)c1ccc([N+](=O)[O-])s1 ZINC000467719532 947093551 /nfs/dbraw/zinc/09/35/51/947093551.db2.gz BUVRRMCAPHDZAH-UHFFFAOYSA-N 0 0 350.306 3.577 20 5 FHBDRN CSc1ccc(CNC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000511947403 947097399 /nfs/dbraw/zinc/09/73/99/947097399.db2.gz NYRTZXWOBDWKJJ-UHFFFAOYSA-N 0 0 359.451 3.701 20 5 FHBDRN Cc1ccc(C2CCN(Cc3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)cn1 ZINC000444684887 947109848 /nfs/dbraw/zinc/10/98/48/947109848.db2.gz MBTNLIMLOSFYTP-UHFFFAOYSA-N 0 0 351.410 3.554 20 5 FHBDRN C[C@@H](c1nc(COCc2ccccc2)no1)c1ccc([N+](=O)[O-])cc1F ZINC000544382438 947114053 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FHBDRN C[C@H](CNc1ccccc1)NC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000444744607 947181551 /nfs/dbraw/zinc/18/15/51/947181551.db2.gz PXMDWHLBMJTWBR-OAHLLOKOSA-N 0 0 371.440 3.912 20 5 FHBDRN O=C(NCc1ccc(OC2CCCCC2)nc1)c1cccc([N+](=O)[O-])c1 ZINC000523364675 947186601 /nfs/dbraw/zinc/18/66/01/947186601.db2.gz PGBMJDSWPVOPTC-UHFFFAOYSA-N 0 0 355.394 3.631 20 5 FHBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)N1CCCCC[C@@H]1c1ccco1 ZINC000184517530 947187024 /nfs/dbraw/zinc/18/70/24/947187024.db2.gz ALCPBEWGAFVSSD-MRXNPFEDSA-N 0 0 364.423 3.635 20 5 FHBDRN C[C@@H]1CCc2nc(NC(=O)N3CCc4ccc([N+](=O)[O-])cc4C3)sc2C1 ZINC000408202746 947188442 /nfs/dbraw/zinc/18/84/42/947188442.db2.gz JOSDABZCXYSCID-LLVKDONJSA-N 0 0 372.450 3.766 20 5 FHBDRN Cc1ccc(CN(CC2CC2)C(=O)/C=C\c2ccc([N+](=O)[O-])cc2)cn1 ZINC000843683775 947201940 /nfs/dbraw/zinc/20/19/40/947201940.db2.gz RRLVKILTLOTHBY-FLIBITNWSA-N 0 0 351.406 3.750 20 5 FHBDRN CCn1nc(C)c([N+](=O)[O-])c1Nc1ccc(O[C@@H]2CCCC[C@H]2O)cc1 ZINC000440553521 947215027 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CCCOc1cccc(NC(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)c1 ZINC000444839553 947274865 /nfs/dbraw/zinc/27/48/65/947274865.db2.gz QHWVMLINXWRKTG-UHFFFAOYSA-N 0 0 369.381 3.582 20 5 FHBDRN CNC(=O)c1ccc(N(C)[C@@H](C)c2cc3ccccc3o2)c([N+](=O)[O-])c1 ZINC000301305531 947276275 /nfs/dbraw/zinc/27/62/75/947276275.db2.gz ZSCZKDYWUCAONV-LBPRGKRZSA-N 0 0 353.378 3.898 20 5 FHBDRN CCOC(=O)[C@@]1(C(C)C)CCN(c2nc3ccccc3cc2[N+](=O)[O-])C1 ZINC000444865852 947291628 /nfs/dbraw/zinc/29/16/28/947291628.db2.gz SEJPXRYRTQFEFZ-IBGZPJMESA-N 0 0 357.410 3.559 20 5 FHBDRN Cn1nccc1N1CCC[C@H](Nc2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)C1 ZINC000444867969 947294174 /nfs/dbraw/zinc/29/41/74/947294174.db2.gz GCXVQMKZEAHMNG-HNNXBMFYSA-N 0 0 373.457 3.587 20 5 FHBDRN O=C(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)N[C@@H]1CC[C@H]2CCCC[C@@H]2C1 ZINC000444873205 947298197 /nfs/dbraw/zinc/29/81/97/947298197.db2.gz JGMQTGDGMHQSCO-MGPQQGTHSA-N 0 0 371.441 3.629 20 5 FHBDRN CC(C)(C(=O)NCC1(c2cccc(F)c2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000523496319 947314337 /nfs/dbraw/zinc/31/43/37/947314337.db2.gz QHWYXHSELUKINT-UHFFFAOYSA-N 0 0 356.397 3.860 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H](Cc1ccccc1)C1CC1 ZINC000444899828 947321015 /nfs/dbraw/zinc/32/10/15/947321015.db2.gz IURXTIOZSBYEMC-KRWDZBQOSA-N 0 0 355.394 3.746 20 5 FHBDRN CCOc1cccc(C(=O)NCCCNc2ccc(C)cc2[N+](=O)[O-])c1 ZINC000523512347 947323968 /nfs/dbraw/zinc/32/39/68/947323968.db2.gz WPVXDSOOLRGWPG-UHFFFAOYSA-N 0 0 357.410 3.534 20 5 FHBDRN Cc1ccc(NCCCNC(=O)c2cncc3ccccc32)c([N+](=O)[O-])c1 ZINC000523512527 947327262 /nfs/dbraw/zinc/32/72/62/947327262.db2.gz DOLWDDRVVYZQCG-UHFFFAOYSA-N 0 0 364.405 3.683 20 5 FHBDRN Cc1ccc(NCCCNC(=O)c2cccc3c2ccn3C)c([N+](=O)[O-])c1 ZINC000523514715 947327440 /nfs/dbraw/zinc/32/74/40/947327440.db2.gz XJLCFBWAZAVZCK-UHFFFAOYSA-N 0 0 366.421 3.627 20 5 FHBDRN CC(C)C1CCC(N(C)S(=O)(=O)Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000432299777 947330294 /nfs/dbraw/zinc/33/02/94/947330294.db2.gz GFKFQPVUXDSFOJ-UHFFFAOYSA-N 0 0 354.472 3.571 20 5 FHBDRN COC(=O)[C@H](CNc1c(F)cc([N+](=O)[O-])cc1F)c1ccc(C)cc1 ZINC000440589267 947334266 /nfs/dbraw/zinc/33/42/66/947334266.db2.gz RUYDSNZIUZZFOE-CYBMUJFWSA-N 0 0 350.321 3.550 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NCCCSc1ccccc1 ZINC000444897110 947335792 /nfs/dbraw/zinc/33/57/92/947335792.db2.gz FEUGHPVXGCUVSF-UHFFFAOYSA-N 0 0 361.423 3.907 20 5 FHBDRN COCCN(C(=O)Nc1ccc([N+](=O)[O-])cc1OC)[C@@H](C)c1ccccc1 ZINC000444921872 947339091 /nfs/dbraw/zinc/33/90/91/947339091.db2.gz MKIKIMIHFBWJOP-AWEZNQCLSA-N 0 0 373.409 3.845 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[C@](C)(c2ccccc2)C1 ZINC000444924856 947342333 /nfs/dbraw/zinc/34/23/33/947342333.db2.gz RIBQYYVTZMVTLI-IBGZPJMESA-N 0 0 355.394 3.799 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NCc1oc2ccccc2c1C ZINC000444915457 947352344 /nfs/dbraw/zinc/35/23/44/947352344.db2.gz WWSKRLSEMIEMCE-UHFFFAOYSA-N 0 0 355.350 3.980 20 5 FHBDRN Cn1ccnc1[C@H](Nc1c(F)cc([N+](=O)[O-])cc1F)c1ccc(F)cc1 ZINC000440602724 947354343 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FHBDRN Cc1ccccc1[C@@H]1CN(CCOc2cccc([N+](=O)[O-])c2)[C@@H](C)CO1 ZINC000441447937 947484989 /nfs/dbraw/zinc/48/49/89/947484989.db2.gz FIPLZFSSYGSQPV-JXFKEZNVSA-N 0 0 356.422 3.744 20 5 FHBDRN O=C(NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)c1ncccc1Cl ZINC000508518408 947490025 /nfs/dbraw/zinc/49/00/25/947490025.db2.gz NSGFHUUFJZOOIS-UHFFFAOYSA-N 0 0 359.691 3.592 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)N1CCC[C@H]1C[C@H](O)c1ccc(F)cc1 ZINC000162829988 947523493 /nfs/dbraw/zinc/52/34/93/947523493.db2.gz QWPGGTLMQBXXEN-ROUUACIJSA-N 0 0 373.384 3.854 20 5 FHBDRN CC[C@@H](C)[C@H](CNC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C)OC ZINC000458959105 947526155 /nfs/dbraw/zinc/52/61/55/947526155.db2.gz FSEVOAMHFZNQMU-PBHICJAKSA-N 0 0 351.447 3.576 20 5 FHBDRN CC(=O)N(c1ccc(NC(=O)c2ccccc2[N+](=O)[O-])cc1)[C@@H]1C[C@@H]1C ZINC000294266266 947532094 /nfs/dbraw/zinc/53/20/94/947532094.db2.gz UQNDGOTYRCJIQT-KPZWWZAWSA-N 0 0 353.378 3.608 20 5 FHBDRN CCc1noc(-c2ccc(C)c(NC(=O)c3ccc(F)cc3[N+](=O)[O-])c2)n1 ZINC000150783661 947532916 /nfs/dbraw/zinc/53/29/16/947532916.db2.gz NDYNLFICEBEEKN-UHFFFAOYSA-N 0 0 370.340 3.907 20 5 FHBDRN C[C@H]1C(=O)CC[C@@H](C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)C1(C)C ZINC000440672866 947558539 /nfs/dbraw/zinc/55/85/39/947558539.db2.gz RCCUIDQXBFGRCU-GWCFXTLKSA-N 0 0 352.818 3.506 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])c1cc(-c2ccccc2Cl)n[nH]1 ZINC000053868172 947570559 /nfs/dbraw/zinc/57/05/59/947570559.db2.gz JCBLFZXGAFPMSQ-UHFFFAOYSA-N 0 0 356.769 3.568 20 5 FHBDRN Cc1cccc(C)c1NC(=O)[C@H](C)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088606328 947571556 /nfs/dbraw/zinc/57/15/56/947571556.db2.gz SGOVMRIAZZNPBS-HNNXBMFYSA-N 0 0 353.422 3.597 20 5 FHBDRN Cc1cc(S(=O)(=O)N(C)[C@@H](c2ccccc2)C(C)C)ccc1[N+](=O)[O-] ZINC000523758100 947576688 /nfs/dbraw/zinc/57/66/88/947576688.db2.gz OPCDQXQPSPAVKC-GOSISDBHSA-N 0 0 362.451 3.921 20 5 FHBDRN CC(=O)c1ccc(Cl)c(NC(=O)CCOc2ccccc2[N+](=O)[O-])c1 ZINC000150792641 947576920 /nfs/dbraw/zinc/57/69/20/947576920.db2.gz JMRCVBPZBWXPCK-UHFFFAOYSA-N 0 0 362.769 3.858 20 5 FHBDRN CO[C@H]1CCN(c2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000440684035 947597281 /nfs/dbraw/zinc/59/72/81/947597281.db2.gz ZUFRYRWEJWSBON-YOEHRIQHSA-N 0 0 354.406 3.830 20 5 FHBDRN Cc1cc(Cc2noc(-c3cc4ccccc4c(=O)[nH]3)n2)ccc1[N+](=O)[O-] ZINC000445237909 947634864 /nfs/dbraw/zinc/63/48/64/947634864.db2.gz VFMYXZPQSMIILE-UHFFFAOYSA-N 0 0 362.345 3.798 20 5 FHBDRN Cc1cc(Cc2noc(-c3ccc4nsnc4c3)n2)ccc1[N+](=O)[O-] ZINC000445239068 947635794 /nfs/dbraw/zinc/63/57/94/947635794.db2.gz YGXQJZKQHHAJNX-UHFFFAOYSA-N 0 0 353.363 3.549 20 5 FHBDRN COc1ccccc1NC(=O)c1sc(Br)cc1[N+](=O)[O-] ZINC000445246737 947644924 /nfs/dbraw/zinc/64/49/24/947644924.db2.gz FBSUBUAWTUJISL-UHFFFAOYSA-N 0 0 357.185 3.680 20 5 FHBDRN O=C(Cn1cc([N+](=O)[O-])cn1)N[C@@H](CC1CCCCC1)c1ccccc1 ZINC000523850266 947650789 /nfs/dbraw/zinc/65/07/89/947650789.db2.gz ODKRCTKDTMLLJX-SFHVURJKSA-N 0 0 356.426 3.619 20 5 FHBDRN O=C(Cn1cc([N+](=O)[O-])cn1)N[C@H](CC1CCCCC1)c1ccccc1 ZINC000523850265 947650996 /nfs/dbraw/zinc/65/09/96/947650996.db2.gz ODKRCTKDTMLLJX-GOSISDBHSA-N 0 0 356.426 3.619 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N1CCSC[C@H]1c1ccc(C)cc1 ZINC000523850082 947651079 /nfs/dbraw/zinc/65/10/79/947651079.db2.gz KPLJUCUPNVRCIF-KRWDZBQOSA-N 0 0 372.446 3.842 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1C(=O)OCC(=O)c1cccc(C(F)(F)F)c1 ZINC000026114036 947654594 /nfs/dbraw/zinc/65/45/94/947654594.db2.gz ZQKYVUUNUYZPBG-UHFFFAOYSA-N 0 0 367.279 3.962 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2nc(CN[C@@H](CO)c3cccc(F)c3)cs2)c1 ZINC000523840046 947660736 /nfs/dbraw/zinc/66/07/36/947660736.db2.gz OUMJUMGAFHOJPL-KRWDZBQOSA-N 0 0 373.409 3.681 20 5 FHBDRN COC(=O)[C@@H](NCc1ccc([N+](=O)[O-])cc1Cl)c1cc(C)cc(C)c1 ZINC000428396982 947689217 /nfs/dbraw/zinc/68/92/17/947689217.db2.gz FIXZTHVNJDYZDU-KRWDZBQOSA-N 0 0 362.813 3.869 20 5 FHBDRN CS[C@@H](C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2)c1ccccc1 ZINC000414751791 947701790 /nfs/dbraw/zinc/70/17/90/947701790.db2.gz JJIYCGXNCRFFNR-QGZVFWFLSA-N 0 0 374.418 3.799 20 5 FHBDRN O=C(CNc1cc([N+](=O)[O-])ccc1Sc1cccs1)N1CCCC1 ZINC000152097248 947728224 /nfs/dbraw/zinc/72/82/24/947728224.db2.gz MUBJDBAIKJFNTR-UHFFFAOYSA-N 0 0 363.464 3.842 20 5 FHBDRN CCCN(C(=O)c1cc(OC)c(OC)cc1OC)c1cccc([N+](=O)[O-])c1 ZINC000441469105 947729306 /nfs/dbraw/zinc/72/93/06/947729306.db2.gz HHKIANUHKQNELP-UHFFFAOYSA-N 0 0 374.393 3.677 20 5 FHBDRN CC(C)(NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)c1cccs1 ZINC000523962030 947753858 /nfs/dbraw/zinc/75/38/58/947753858.db2.gz SQPPOZAZEZEBIV-UHFFFAOYSA-N 0 0 359.451 3.922 20 5 FHBDRN CCO[C@@H]1C[C@@H]([N@H+](C)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1(C)C ZINC000536363698 947769674 /nfs/dbraw/zinc/76/96/74/947769674.db2.gz QUUZHSTYCIFTSX-IAGOWNOFSA-N 0 0 359.426 3.885 20 5 FHBDRN Cc1ccccc1[C@@H]1CN(CCOc2ccc([N+](=O)[O-])cc2)[C@@H](C)CO1 ZINC000441472388 947791813 /nfs/dbraw/zinc/79/18/13/947791813.db2.gz XKPZOYOJJCRRPD-JXFKEZNVSA-N 0 0 356.422 3.744 20 5 FHBDRN C/C(=C/c1ccccn1)C(=O)N1CCS[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC001126234355 947793982 /nfs/dbraw/zinc/79/39/82/947793982.db2.gz LUHOKQNOKIOYNY-SQVRQVGWSA-N 0 0 355.419 3.667 20 5 FHBDRN O=C(/C=C/c1ccc([N+](=O)[O-])cc1)N(Cc1ccncc1)Cc1cccnc1 ZINC000120368360 947838849 /nfs/dbraw/zinc/83/88/49/947838849.db2.gz HKSCXSBBSFDSDV-VMPITWQZSA-N 0 0 374.400 3.627 20 5 FHBDRN Cc1sc(C(=O)N2C[C@@H](C)N(Cc3ccccc3)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000500440475 947878887 /nfs/dbraw/zinc/87/88/87/947878887.db2.gz KQLQBHOQJHJJAA-KGLIPLIRSA-N 0 0 373.478 3.700 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])NCc1ccc(C(F)F)cc1 ZINC000184614720 947888272 /nfs/dbraw/zinc/88/82/72/947888272.db2.gz PSAIVXPWDRYEPN-UHFFFAOYSA-N 0 0 350.321 3.618 20 5 FHBDRN CC1(C)C[C@@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2)c2ccc(F)cc2O1 ZINC000484887311 947900910 /nfs/dbraw/zinc/90/09/10/947900910.db2.gz WYDVRCMXZQPCDJ-MRXNPFEDSA-N 0 0 358.369 3.695 20 5 FHBDRN COc1cc(Oc2ccc(C)nc2Br)c([N+](=O)[O-])cc1OC ZINC000130147687 947901233 /nfs/dbraw/zinc/90/12/33/947901233.db2.gz QQIBNOLQVCMBLS-UHFFFAOYSA-N 0 0 369.171 3.870 20 5 FHBDRN O=C(NCCCc1ccccn1)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000184616833 947903492 /nfs/dbraw/zinc/90/34/92/947903492.db2.gz BZOCKQQWIOPHOE-UHFFFAOYSA-N 0 0 368.315 3.763 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCC[C@@H]([C@H]3CCOC3)C2)nc1-c1ccccc1 ZINC000536387319 947924129 /nfs/dbraw/zinc/92/41/29/947924129.db2.gz YLGOYUYTXWRJHP-SJORKVTESA-N 0 0 353.422 3.910 20 5 FHBDRN CN(Cc1cc(Cl)cn1C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000152319628 947928190 /nfs/dbraw/zinc/92/81/90/947928190.db2.gz RDEXIYVHZJZQCO-UHFFFAOYSA-N 0 0 357.197 3.904 20 5 FHBDRN CC(C)[C@@H](NC(=O)Cn1ccc([N+](=O)[O-])n1)c1ccc(C(C)(C)C)cc1 ZINC000511977832 947945775 /nfs/dbraw/zinc/94/57/75/947945775.db2.gz QKGNHLHHEAEWSW-GOSISDBHSA-N 0 0 358.442 3.602 20 5 FHBDRN CC[C@H](c1ccccc1)N(CC(=O)OC)C(=O)c1cc(C)cc([N+](=O)[O-])c1 ZINC000536403989 947991238 /nfs/dbraw/zinc/99/12/38/947991238.db2.gz YETCJGIDIOSNGL-GOSISDBHSA-N 0 0 370.405 3.670 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@H]1CCN(c2ccc(Cl)cc2)C1=O ZINC000053059264 948010941 /nfs/dbraw/zinc/01/09/41/948010941.db2.gz BTYLNUGFNYHYBL-OAHLLOKOSA-N 0 0 373.796 3.548 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1CCN(c2ccc(Cl)cc2)C1=O ZINC000053059263 948010990 /nfs/dbraw/zinc/01/09/90/948010990.db2.gz BTYLNUGFNYHYBL-HNNXBMFYSA-N 0 0 373.796 3.548 20 5 FHBDRN Cc1ccc([C@@H](Cn2ccnc2)NC(=O)c2ccccc2[N+](=O)[O-])c(C)c1 ZINC000441490720 948019037 /nfs/dbraw/zinc/01/90/37/948019037.db2.gz RBDQHCFKOJBRCP-GOSISDBHSA-N 0 0 364.405 3.579 20 5 FHBDRN Cc1ccc([C@H](Cn2ccnc2)NC(=O)c2csc([N+](=O)[O-])c2)c(C)c1 ZINC000441492716 948026914 /nfs/dbraw/zinc/02/69/14/948026914.db2.gz RNEVSQPKPPXNHS-INIZCTEOSA-N 0 0 370.434 3.641 20 5 FHBDRN CCCOc1ccc(CNC(=O)CCc2cccc([N+](=O)[O-])c2)cc1OC ZINC000087100103 948027121 /nfs/dbraw/zinc/02/71/21/948027121.db2.gz HFTUKHUKFNSIIO-UHFFFAOYSA-N 0 0 372.421 3.641 20 5 FHBDRN Cc1cccc(C2=CCN(C(=O)COc3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000536412997 948027847 /nfs/dbraw/zinc/02/78/47/948027847.db2.gz GPBLQNPQPCFDTE-UHFFFAOYSA-N 0 0 352.390 3.598 20 5 FHBDRN O=C(CNc1ccnc2c1cccc2[N+](=O)[O-])N1CCCc2ccccc21 ZINC000432322654 948036895 /nfs/dbraw/zinc/03/68/95/948036895.db2.gz BJVQBRJIIARGGS-UHFFFAOYSA-N 0 0 362.389 3.534 20 5 FHBDRN O=[N+]([O-])c1cccc2c(N3CCO[C@@H](c4ccccc4F)C3)ccnc21 ZINC000432323109 948056756 /nfs/dbraw/zinc/05/67/56/948056756.db2.gz OWPBPCKZQQERMT-GOSISDBHSA-N 0 0 353.353 3.860 20 5 FHBDRN CCOc1cccc(C(=O)O[C@@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)c1 ZINC000759945476 948072526 /nfs/dbraw/zinc/07/25/26/948072526.db2.gz GOSOXCCPSCJKBE-JKSUJKDBSA-N 0 0 359.382 3.531 20 5 FHBDRN O=[N+]([O-])c1cccc2c(NCCc3ccc4c(c3)OCCO4)ccnc21 ZINC000432328042 948083508 /nfs/dbraw/zinc/08/35/08/948083508.db2.gz VJWUPUAEXSPTBN-UHFFFAOYSA-N 0 0 351.362 3.569 20 5 FHBDRN CNC(=O)c1ccc(N[C@H](C)c2nc(C(F)(F)F)cs2)c([N+](=O)[O-])c1 ZINC000278911029 948085104 /nfs/dbraw/zinc/08/51/04/948085104.db2.gz ZXHWKVTXJUDXCD-SSDOTTSWSA-N 0 0 374.344 3.603 20 5 FHBDRN COc1ccccc1C(=O)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F ZINC000106188607 948091450 /nfs/dbraw/zinc/09/14/50/948091450.db2.gz QMSGBSOWWMUACY-UHFFFAOYSA-N 0 0 368.311 3.808 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@H]1c1ccncc1 ZINC000184664096 948119191 /nfs/dbraw/zinc/11/91/91/948119191.db2.gz FZSLWWWPDNMDDP-APWZRJJASA-N 0 0 353.422 3.922 20 5 FHBDRN COC(=O)c1ccc(CNc2c(Cl)cccc2[N+](=O)[O-])cc1OC ZINC000432343738 948171104 /nfs/dbraw/zinc/17/11/04/948171104.db2.gz ZWEZMYQEWJHNMD-UHFFFAOYSA-N 0 0 350.758 3.656 20 5 FHBDRN Cc1ccc(NCCCNC(=O)c2ccc(C(C)C)cn2)c([N+](=O)[O-])c1 ZINC001126294933 948172334 /nfs/dbraw/zinc/17/23/34/948172334.db2.gz PSEAIGWHPNIGBA-UHFFFAOYSA-N 0 0 356.426 3.654 20 5 FHBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)N[C@@H]2CCCC[C@@H]2c2ccccc2)cc1 ZINC000512008056 948175751 /nfs/dbraw/zinc/17/57/51/948175751.db2.gz LKRUSNMONNTTJS-RTBURBONSA-N 0 0 374.462 3.741 20 5 FHBDRN CCN(Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-])CC(F)(F)F ZINC000106438609 948188778 /nfs/dbraw/zinc/18/87/78/948188778.db2.gz XEDGYNFTBJTMFN-UHFFFAOYSA-N 0 0 358.263 3.589 20 5 FHBDRN CC(=O)c1cc(NCc2cccnc2OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000585703198 948202610 /nfs/dbraw/zinc/20/26/10/948202610.db2.gz LKVMMMNQXRBBIB-UHFFFAOYSA-N 0 0 369.299 3.746 20 5 FHBDRN O=C(NCc1coc(-c2ccccc2)n1)[C@@H]1C[C@H]1c1cccc([N+](=O)[O-])c1 ZINC001126298614 948205110 /nfs/dbraw/zinc/20/51/10/948205110.db2.gz PFHBOJBZQLXFDJ-ZWKOTPCHSA-N 0 0 363.373 3.670 20 5 FHBDRN Cc1csc(-c2cccc(C(=O)NCCc3cccc([N+](=O)[O-])c3)c2)n1 ZINC000125926341 948205196 /nfs/dbraw/zinc/20/51/96/948205196.db2.gz VFRDILSYJNHVEK-UHFFFAOYSA-N 0 0 367.430 3.999 20 5 FHBDRN C[C@H](CO[C@H]1CCOC1)Nc1cc(Cl)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000133806388 948210646 /nfs/dbraw/zinc/21/06/46/948210646.db2.gz XHXGKJPFFIGBHA-BDAKNGLRSA-N 0 0 368.739 3.873 20 5 FHBDRN O=C(Nc1cnn(-c2ccccc2Cl)c1)c1ccc([N+](=O)[O-])cc1F ZINC000106671119 948213487 /nfs/dbraw/zinc/21/34/87/948213487.db2.gz JLCBNDZZUAAFFP-UHFFFAOYSA-N 0 0 360.732 3.825 20 5 FHBDRN O=[N+]([O-])c1cccc(Cc2nc(-c3cc(OC(F)F)ccc3F)no2)c1 ZINC000585727554 948236816 /nfs/dbraw/zinc/23/68/16/948236816.db2.gz STSLXCPJYICJLR-UHFFFAOYSA-N 0 0 365.267 3.976 20 5 FHBDRN C[C@H](c1ccccc1[N+](=O)[O-])N1CCN(C(=O)CC2CCCCC2)CC1 ZINC000441547998 948244350 /nfs/dbraw/zinc/24/43/50/948244350.db2.gz RWZSYGSAATXCHL-MRXNPFEDSA-N 0 0 359.470 3.770 20 5 FHBDRN CCC(C)(C)[C@H]1CCCN1C(=O)COc1ccc([N+](=O)[O-])c2cccnc12 ZINC000441547298 948244529 /nfs/dbraw/zinc/24/45/29/948244529.db2.gz POGQLXIUVZBGKM-QGZVFWFLSA-N 0 0 371.437 3.949 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H]1CCC[C@@H]1Cc1ccccc1 ZINC000427593580 948253693 /nfs/dbraw/zinc/25/36/93/948253693.db2.gz LLBXPWVIOVIMPE-QAPCUYQASA-N 0 0 354.406 3.745 20 5 FHBDRN C[S@](=O)c1ccc(C(=O)Nc2ccc(C(C)(C)C)c([N+](=O)[O-])c2)cc1 ZINC000585750702 948257334 /nfs/dbraw/zinc/25/73/34/948257334.db2.gz ADOQJKAWMHKSMC-VWLOTQADSA-N 0 0 360.435 3.882 20 5 FHBDRN Cc1ccn(-c2ccc(NC(=O)[C@@H](C)c3ccc([N+](=O)[O-])cc3F)cc2)n1 ZINC000585753500 948260266 /nfs/dbraw/zinc/26/02/66/948260266.db2.gz SNULABSHBGPHAM-ZDUSSCGKSA-N 0 0 368.368 3.970 20 5 FHBDRN Cc1ccc(CNC(=O)Nc2ccc([N+](=O)[O-])cc2C)c(N2CCCC2)n1 ZINC000163048781 948263536 /nfs/dbraw/zinc/26/35/36/948263536.db2.gz LRKPKJLHKNZPCE-UHFFFAOYSA-N 0 0 369.425 3.529 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCC(=O)NCCc2ccc(C(C)C)cc2)c1 ZINC000019192821 948264940 /nfs/dbraw/zinc/26/49/40/948264940.db2.gz KVFLSRYOOFRQPI-UHFFFAOYSA-N 0 0 356.422 3.764 20 5 FHBDRN Cc1ccc([C@@H]2C[C@H](C)N(S(=O)(=O)c3cccc([N+](=O)[O-])c3C)C2)cc1 ZINC001211698937 948270553 /nfs/dbraw/zinc/27/05/53/948270553.db2.gz BFMUEMGISAUWTB-WMLDXEAASA-N 0 0 374.462 3.778 20 5 FHBDRN CC(C)(c1ccccc1)[S@](=O)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000507777571 948271284 /nfs/dbraw/zinc/27/12/84/948271284.db2.gz SNHTWKFPTVOGJR-RUZDIDTESA-N 0 0 360.435 3.607 20 5 FHBDRN O=C(O[C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)c1cnc2ccsc2c1 ZINC000759956344 948282461 /nfs/dbraw/zinc/28/24/61/948282461.db2.gz YDRVCJOFYBUKIF-UONOGXRCSA-N 0 0 372.406 3.742 20 5 FHBDRN O=[N+]([O-])c1cccc([C@@H](O)CSc2nnc3sc4ccccc4n23)c1 ZINC000136845691 948287385 /nfs/dbraw/zinc/28/73/85/948287385.db2.gz UDVXXJUGTWGWED-ZDUSSCGKSA-N 0 0 372.431 3.678 20 5 FHBDRN CN1CC[C@@H](c2noc(-c3ccc(F)cc3[N+](=O)[O-])n2)c2ccccc21 ZINC000544326754 948289650 /nfs/dbraw/zinc/28/96/50/948289650.db2.gz YRPWVZKSMMUTQR-CYBMUJFWSA-N 0 0 354.341 3.756 20 5 FHBDRN COc1cc(N2CCC[C@@H]2[C@H]2CCCC[C@@]2(C)O)c(F)cc1[N+](=O)[O-] ZINC000585788728 948295014 /nfs/dbraw/zinc/29/50/14/948295014.db2.gz KEWUPOGHHDMELK-RVZJWNSFSA-N 0 0 352.406 3.653 20 5 FHBDRN COc1cc(N2CCC[C@@H]2[C@H]2CCCC[C@]2(C)O)c(F)cc1[N+](=O)[O-] ZINC000585788724 948295252 /nfs/dbraw/zinc/29/52/52/948295252.db2.gz KEWUPOGHHDMELK-DFHBCGBQSA-N 0 0 352.406 3.653 20 5 FHBDRN CCc1nc(CCNC(=O)[C@@H](CC)Cc2ccc([N+](=O)[O-])cc2)cs1 ZINC000184724041 948300422 /nfs/dbraw/zinc/30/04/22/948300422.db2.gz YRWWRUWADPGJFD-AWEZNQCLSA-N 0 0 361.467 3.541 20 5 FHBDRN Cc1ccc(NC(=O)c2ccn(-c3ccc(F)cc3F)n2)cc1[N+](=O)[O-] ZINC000184727476 948300470 /nfs/dbraw/zinc/30/04/70/948300470.db2.gz QEKGVUPNRCQYKT-UHFFFAOYSA-N 0 0 358.304 3.619 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)c1ccn(-c2ccc(F)cc2F)n1 ZINC000184728420 948300888 /nfs/dbraw/zinc/30/08/88/948300888.db2.gz PYUBZZBWSVKVAD-UHFFFAOYSA-N 0 0 358.304 3.619 20 5 FHBDRN Cc1nn(Cc2ccc(Cl)cc2)c(C)c1Cn1c(C)ncc1[N+](=O)[O-] ZINC000432384239 948301676 /nfs/dbraw/zinc/30/16/76/948301676.db2.gz ATLZYVCPUIRKAM-UHFFFAOYSA-N 0 0 359.817 3.663 20 5 FHBDRN Cc1nc(C)c([C@H](C)N(C)C(=O)CSc2ccccc2[N+](=O)[O-])s1 ZINC000106838171 948315207 /nfs/dbraw/zinc/31/52/07/948315207.db2.gz XEQZTHLUYINLOC-NSHDSACASA-N 0 0 365.480 3.980 20 5 FHBDRN COc1ccc(CCC(=O)NCCc2cccc([N+](=O)[O-])c2)cc1Cl ZINC000125966201 948331079 /nfs/dbraw/zinc/33/10/79/948331079.db2.gz UXYJQJOSGDTNDQ-UHFFFAOYSA-N 0 0 362.813 3.548 20 5 FHBDRN CCc1c(NC(=O)Cc2ccc(OC)c([N+](=O)[O-])c2)cnn1C(CC)CC ZINC000574692756 948331229 /nfs/dbraw/zinc/33/12/29/948331229.db2.gz TXFKOSZDFNTQEC-UHFFFAOYSA-N 0 0 374.441 3.905 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CC(C)(C)O[C@@H]2CCC[C@H]21 ZINC000441596585 948332144 /nfs/dbraw/zinc/33/21/44/948332144.db2.gz ITWXQRXZALZAJL-CGTJXYLNSA-N 0 0 360.454 3.722 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CC(C)(C)O[C@@H]2CCC[C@H]21 ZINC000441612348 948358487 /nfs/dbraw/zinc/35/84/87/948358487.db2.gz ONOSCQLNKFRTTB-APHBMKBZSA-N 0 0 364.467 3.634 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)Nc2nc(/C=C/c3ccccc3)cs2)n1 ZINC000427600564 948361116 /nfs/dbraw/zinc/36/11/16/948361116.db2.gz UNCMWIATNYWEGL-CMDGGOBGSA-N 0 0 369.406 3.690 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)NC[C@@H](C)c2ccccc2)cc1SC ZINC000075474507 948369158 /nfs/dbraw/zinc/36/91/58/948369158.db2.gz GRRLTIIPOZRIBU-GFCCVEGCSA-N 0 0 360.435 3.859 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@@H](Nc2ccccc2)C1 ZINC000184754407 948375555 /nfs/dbraw/zinc/37/55/55/948375555.db2.gz ZJCKNFXHGSBHSF-PKOBYXMFSA-N 0 0 367.449 3.877 20 5 FHBDRN C[C@@H](CC(C)(C)c1ccccc1)NC(=O)COc1cccc([N+](=O)[O-])c1 ZINC000520614433 948397135 /nfs/dbraw/zinc/39/71/35/948397135.db2.gz LYYITEFXYVIPNV-HNNXBMFYSA-N 0 0 356.422 3.846 20 5 FHBDRN Cc1ccc(Cl)c(OC[C@H](O)COc2c(F)cccc2[N+](=O)[O-])c1 ZINC000184778962 948417854 /nfs/dbraw/zinc/41/78/54/948417854.db2.gz KRTGLCQZGCFRIG-NSHDSACASA-N 0 0 355.749 3.514 20 5 FHBDRN O=[N+]([O-])c1cccc(F)c1OC[C@@H](O)CO[C@@H]1CCCc2ccccc21 ZINC000184775449 948427351 /nfs/dbraw/zinc/42/73/51/948427351.db2.gz XZHCCZDENXLKQE-KBXCAEBGSA-N 0 0 361.369 3.568 20 5 FHBDRN O=[N+]([O-])c1cccc(F)c1OC[C@H](O)CO[C@@H]1CCCc2ccccc21 ZINC000184775483 948427506 /nfs/dbraw/zinc/42/75/06/948427506.db2.gz XZHCCZDENXLKQE-RDTXWAMCSA-N 0 0 361.369 3.568 20 5 FHBDRN Cc1cc(Br)cc(C)c1NC(=O)c1cc([N+](=O)[O-])cn1C ZINC000107236562 948433007 /nfs/dbraw/zinc/43/30/07/948433007.db2.gz XBUXFHYPTCKYGJ-UHFFFAOYSA-N 0 0 352.188 3.565 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1CCC[C@H]1Cc1ccc(F)cc1 ZINC000427610266 948458577 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/nfs/dbraw/zinc/70/23/46/948702346.db2.gz TWFREUKJGVEITO-UHFFFAOYSA-N 0 0 359.407 3.889 20 5 FHBDRN C[C@H](CCc1ccc(O)cc1)NC(=O)c1c[nH]c2cccc([N+](=O)[O-])c21 ZINC000536480198 948716410 /nfs/dbraw/zinc/71/64/10/948716410.db2.gz GUETXYSQZPCMCK-GFCCVEGCSA-N 0 0 353.378 3.533 20 5 FHBDRN O=C(Nc1nccn1Cc1ccccc1)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000536482100 948720056 /nfs/dbraw/zinc/72/00/56/948720056.db2.gz OVCQFFYVEUZKDC-UHFFFAOYSA-N 0 0 361.361 3.573 20 5 FHBDRN COc1c2ccccc2oc1CNCc1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000474010008 948721366 /nfs/dbraw/zinc/72/13/66/948721366.db2.gz NRQLZEFAJXEBKC-UHFFFAOYSA-N 0 0 372.377 3.657 20 5 FHBDRN O=C(c1c[nH]c2cccc([N+](=O)[O-])c12)N1CCC(OC2CCCC2)CC1 ZINC000536482876 948727481 /nfs/dbraw/zinc/72/74/81/948727481.db2.gz XLRNZWHHPKUROU-UHFFFAOYSA-N 0 0 357.410 3.640 20 5 FHBDRN O=[N+]([O-])c1cc(F)cc(-c2nc(-c3ccc(Br)cn3)no2)c1 ZINC000445387335 948736712 /nfs/dbraw/zinc/73/67/12/948736712.db2.gz YGYIPDDLOPZTHY-UHFFFAOYSA-N 0 0 365.118 3.608 20 5 FHBDRN Cc1nc(NC(=O)c2cc(Cl)cc(Br)c2)ccc1[N+](=O)[O-] ZINC000152103788 948741314 /nfs/dbraw/zinc/74/13/14/948741314.db2.gz RJESWZUGGHIAKG-UHFFFAOYSA-N 0 0 370.590 3.966 20 5 FHBDRN COc1c(C(=O)N(Cc2ccsc2)c2cccnc2)cccc1[N+](=O)[O-] ZINC000440738298 948744899 /nfs/dbraw/zinc/74/48/99/948744899.db2.gz PTUZWOQLEHIPKC-UHFFFAOYSA-N 0 0 369.402 3.907 20 5 FHBDRN COc1ccc(NC(=O)NCc2c(F)cccc2Cl)cc1[N+](=O)[O-] ZINC000542034796 948779763 /nfs/dbraw/zinc/77/97/63/948779763.db2.gz JTQCTZFANVECJH-UHFFFAOYSA-N 0 0 353.737 3.718 20 5 FHBDRN CCCCOc1ncccc1CNC(=O)c1c(C)c(F)ccc1[N+](=O)[O-] ZINC000843777611 948781201 /nfs/dbraw/zinc/78/12/01/948781201.db2.gz IEQUWQBZYUFNTR-UHFFFAOYSA-N 0 0 361.373 3.546 20 5 FHBDRN Cc1cnc(N[C@H]2CCCN([C@H](C)c3ccc(F)cc3)C2=O)c([N+](=O)[O-])c1 ZINC000549645214 948797966 /nfs/dbraw/zinc/79/79/66/948797966.db2.gz NCXZFBQUBHORIZ-CJNGLKHVSA-N 0 0 372.400 3.601 20 5 FHBDRN COc1cc(OC)cc(-c2noc(-c3ccc([N+](=O)[O-])cc3Cl)n2)c1 ZINC000445448343 948806210 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CCOc1cc(F)ccc1NC(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000046518565 205136881 /nfs/dbraw/zinc/13/68/81/205136881.db2.gz XLUBBJAUGWSSMT-UHFFFAOYSA-N 0 0 350.371 3.863 20 5 FHBDRN O=C(Nc1ccc(-c2cn3cccnc3n2)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000047081125 205140989 /nfs/dbraw/zinc/14/09/89/205140989.db2.gz UMHBZWKSIZQZMG-UHFFFAOYSA-N 0 0 359.345 3.557 20 5 FHBDRN COc1ccc(C)cc1[C@@H](C)Nc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-] ZINC000054368873 205200965 /nfs/dbraw/zinc/20/09/65/205200965.db2.gz BHBAKTYGIUMHDN-CYBMUJFWSA-N 0 0 369.421 3.977 20 5 FHBDRN O=C(Nc1ccccc1OC[C@H]1CCCCO1)c1csc([N+](=O)[O-])c1 ZINC000056349753 205229500 /nfs/dbraw/zinc/22/95/00/205229500.db2.gz XNUJBZQJHKEVRN-CYBMUJFWSA-N 0 0 362.407 3.857 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1)N[C@H](c1ccc(F)cc1)[C@@H]1CCCO1 ZINC000056347154 205230326 /nfs/dbraw/zinc/23/03/26/205230326.db2.gz WFOPMSGSMPQOIO-DLBZAZTESA-N 0 0 359.357 3.776 20 5 FHBDRN Cc1ccc(NC(=O)C2(c3cccc(F)c3)CCOCC2)cc1[N+](=O)[O-] ZINC000057179530 205235837 /nfs/dbraw/zinc/23/58/37/205235837.db2.gz OIGGWFRPYGGLTA-UHFFFAOYSA-N 0 0 358.369 3.729 20 5 FHBDRN CC(C)C(=O)Nc1ccc(N[C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000067472001 205373765 /nfs/dbraw/zinc/37/37/65/205373765.db2.gz AKJRIYQTKCGQTF-CYBMUJFWSA-N 0 0 370.409 3.628 20 5 FHBDRN CCCc1n[nH]c(C(=O)N[C@H]2CCC(C)(C)c3ccccc32)c1[N+](=O)[O-] ZINC000078593407 205627114 /nfs/dbraw/zinc/62/71/14/205627114.db2.gz AYACCTCLPRVYIQ-AWEZNQCLSA-N 0 0 356.426 3.813 20 5 FHBDRN Cc1nn(-c2ccccc2)c(C)c1CNC(=O)c1cccc(C)c1[N+](=O)[O-] ZINC000018202451 220228136 /nfs/dbraw/zinc/22/81/36/220228136.db2.gz GVSOKUBVXLZVAE-UHFFFAOYSA-N 0 0 364.405 3.636 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(C)c(Br)c1 ZINC000097111329 205898221 /nfs/dbraw/zinc/89/82/21/205898221.db2.gz GVIKXHRQWJTEJD-UHFFFAOYSA-N 0 0 365.183 3.927 20 5 FHBDRN CCc1c(C(=O)Nc2cccc([N+](=O)[O-])c2C)cnn1Cc1ccccc1 ZINC000097295442 205904256 /nfs/dbraw/zinc/90/42/56/205904256.db2.gz JVGHGOSKHBDNGA-UHFFFAOYSA-N 0 0 364.405 3.963 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)Cc1nc(-c2ccccc2)oc1C ZINC000105555532 206006423 /nfs/dbraw/zinc/00/64/23/206006423.db2.gz HJHQKNWEEFLWRE-UHFFFAOYSA-N 0 0 367.361 3.748 20 5 FHBDRN O=C(COc1cccc([N+](=O)[O-])c1)Nc1ccc(-c2nccs2)cc1 ZINC000105974206 206012123 /nfs/dbraw/zinc/01/21/23/206012123.db2.gz OZAHWBXGPRRKBI-UHFFFAOYSA-N 0 0 355.375 3.736 20 5 FHBDRN CCN(Cc1ccccc1Cl)S(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1 ZINC000106267533 206015043 /nfs/dbraw/zinc/01/50/43/206015043.db2.gz GSJMMSZRFGKKHN-UHFFFAOYSA-N 0 0 368.842 3.767 20 5 FHBDRN CC(C)(C)[C@H](NS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000109064756 206045875 /nfs/dbraw/zinc/04/58/75/206045875.db2.gz CUORZHOGLPEOQH-QGZVFWFLSA-N 0 0 362.451 3.802 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)NCCc1cc(Cl)cc(Cl)c1 ZINC000109207266 206050972 /nfs/dbraw/zinc/05/09/72/206050972.db2.gz UJRIVSPYPYPNCB-UHFFFAOYSA-N 0 0 353.205 3.803 20 5 FHBDRN Cc1cc(C(=O)NCCc2ccccc2Br)ccc1[N+](=O)[O-] ZINC000109483453 206059941 /nfs/dbraw/zinc/05/99/41/206059941.db2.gz ODZARRSTLDEDOQ-UHFFFAOYSA-N 0 0 363.211 3.638 20 5 FHBDRN O=C(Nc1ccc2[nH]c([C@H]3CCCO3)nc2c1)c1csc([N+](=O)[O-])c1 ZINC000115848014 206097790 /nfs/dbraw/zinc/09/77/90/206097790.db2.gz ZCUGMJYDTGQUPP-CYBMUJFWSA-N 0 0 358.379 3.636 20 5 FHBDRN CCCNC(=O)c1cccc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000107620557 206245203 /nfs/dbraw/zinc/24/52/03/206245203.db2.gz ADVBVLIPPIUQDI-UHFFFAOYSA-N 0 0 361.785 3.640 20 5 FHBDRN COc1cc(C)c(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1OC ZINC000011644518 206284222 /nfs/dbraw/zinc/28/42/22/206284222.db2.gz NBNHQKIDXSPFRF-UHFFFAOYSA-N 0 0 350.758 3.826 20 5 FHBDRN COc1ccc(Br)cc1NC(=O)c1cccc([N+](=O)[O-])c1C ZINC000056035738 206382110 /nfs/dbraw/zinc/38/21/10/206382110.db2.gz SLEPCDQPJLRNEZ-UHFFFAOYSA-N 0 0 365.183 3.927 20 5 FHBDRN COc1ccccc1N(C)C(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000055743295 206382923 /nfs/dbraw/zinc/38/29/23/206382923.db2.gz VDEKHEKJSDAVCE-UHFFFAOYSA-N 0 0 365.183 3.643 20 5 FHBDRN CC1CCC(C)(NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)CC1 ZINC000109966898 132246085 /nfs/dbraw/zinc/24/60/85/132246085.db2.gz IYHDYQFETRKRMY-UHFFFAOYSA-N 0 0 359.470 3.896 20 5 FHBDRN Cc1noc([C@@H]2CCCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])C2)n1 ZINC000054676159 132303350 /nfs/dbraw/zinc/30/33/50/132303350.db2.gz MVTQAPDCOPZYOG-SNVBAGLBSA-N 0 0 356.304 3.689 20 5 FHBDRN CCOc1ccc(C(=O)N2CCCc3cccc(OC)c32)cc1[N+](=O)[O-] ZINC000047447481 535700445 /nfs/dbraw/zinc/70/04/45/535700445.db2.gz UBACRSCJUGDXCJ-UHFFFAOYSA-N 0 0 356.378 3.595 20 5 FHBDRN COC[C@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1F)c1ccc(F)c(F)c1 ZINC000541787070 567830163 /nfs/dbraw/zinc/83/01/63/567830163.db2.gz GPEKBCQTYAFEFI-HNNXBMFYSA-N 0 0 369.299 3.521 20 5 FHBDRN COC[C@@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1F)c1ccc(F)c(F)c1 ZINC000541787073 567831256 /nfs/dbraw/zinc/83/12/56/567831256.db2.gz GPEKBCQTYAFEFI-OAHLLOKOSA-N 0 0 369.299 3.521 20 5 FHBDRN Cc1ccn2ncc(C(=O)N3CCC[C@@H](c4ccc([N+](=O)[O-])cc4)C3)c2c1 ZINC000452864382 567831752 /nfs/dbraw/zinc/83/17/52/567831752.db2.gz WFAJVZJXGHAHBH-MRXNPFEDSA-N 0 0 364.405 3.571 20 5 FHBDRN O=C(c1ccc(C(F)(F)F)[nH]1)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452863003 567832492 /nfs/dbraw/zinc/83/24/92/567832492.db2.gz LNLNAKRSWVYODT-GFCCVEGCSA-N 0 0 367.327 3.962 20 5 FHBDRN CO[C@H](CNC(=O)Nc1ccc([N+](=O)[O-])cc1F)c1ccc(Cl)cc1 ZINC000541785379 567832973 /nfs/dbraw/zinc/83/29/73/567832973.db2.gz NYPNRTSOQMUYAM-OAHLLOKOSA-N 0 0 367.764 3.897 20 5 FHBDRN CCc1nc(CC(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cs1 ZINC000452867982 567834134 /nfs/dbraw/zinc/83/41/34/567834134.db2.gz YJSRXMXJQHPMER-AWEZNQCLSA-N 0 0 359.451 3.562 20 5 FHBDRN O=C(c1cccc2nccnc21)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452862654 567835892 /nfs/dbraw/zinc/83/58/92/567835892.db2.gz UZCJJXQNZJLXMA-OAHLLOKOSA-N 0 0 362.389 3.558 20 5 FHBDRN CCOCCC1(C(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)CCC1 ZINC000452861727 567838231 /nfs/dbraw/zinc/83/82/31/567838231.db2.gz UJDGKROFLJTRSX-QGZVFWFLSA-N 0 0 360.454 3.898 20 5 FHBDRN C[C@H](Oc1ccccc1)C(=O)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452872844 567874491 /nfs/dbraw/zinc/87/44/91/567874491.db2.gz JQKCUGLQLVWBAK-RDJZCZTQSA-N 0 0 354.406 3.768 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1cccc(-c2ccccc2)c1 ZINC000568102827 567883319 /nfs/dbraw/zinc/88/33/19/567883319.db2.gz RKFZLXFPPYPKHW-UHFFFAOYSA-N 0 0 350.378 3.796 20 5 FHBDRN COc1ccc(OC)c(C(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000452883473 567885035 /nfs/dbraw/zinc/88/50/35/567885035.db2.gz PPSUJOTZVJMFAW-OAHLLOKOSA-N 0 0 370.405 3.632 20 5 FHBDRN COc1cccc(C(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)c1OC ZINC000452884469 567886487 /nfs/dbraw/zinc/88/64/87/567886487.db2.gz QCBICNSVPYHHHG-OAHLLOKOSA-N 0 0 370.405 3.632 20 5 FHBDRN O=[N+]([O-])c1ccc(SC[C@H](O)Cc2ccc(C(F)(F)F)cc2)nc1 ZINC000159183393 567900422 /nfs/dbraw/zinc/90/04/22/567900422.db2.gz CPDACAKPKWNTEH-CYBMUJFWSA-N 0 0 358.341 3.704 20 5 FHBDRN CC(C)Oc1cccc([C@@H](C)NC(=O)COc2cccc([N+](=O)[O-])c2)c1 ZINC000481408550 567905933 /nfs/dbraw/zinc/90/59/33/567905933.db2.gz CXXCQRWEVUEOJQ-CQSZACIVSA-N 0 0 358.394 3.638 20 5 FHBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)N[C@H](C1CCCC1)C(F)(F)F ZINC000481403295 567905971 /nfs/dbraw/zinc/90/59/71/567905971.db2.gz OWIOVMRCZDJJCX-CQSZACIVSA-N 0 0 359.348 3.558 20 5 FHBDRN CC(C)[C@@H]1C[C@H](CNC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CCO1 ZINC000452891673 567909116 /nfs/dbraw/zinc/90/91/16/567909116.db2.gz OOOLWEYNMMHXEY-DOMZBBRYSA-N 0 0 362.451 3.991 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H]1c2ccc(F)cc2O[C@@H]1C ZINC000517910421 567909122 /nfs/dbraw/zinc/90/91/22/567909122.db2.gz FTRBLLZEOYAKPC-QGHHPUGFSA-N 0 0 359.357 3.940 20 5 FHBDRN CCN(c1ccc(F)cc1)S(=O)(=O)c1cc(C)cc([N+](=O)[O-])c1C ZINC000541819663 567909261 /nfs/dbraw/zinc/90/92/61/567909261.db2.gz PHZJUUNNNWIRRS-UHFFFAOYSA-N 0 0 352.387 3.566 20 5 FHBDRN CCS[C@@H]1CCCCN(S(=O)(=O)c2cc(C)cc([N+](=O)[O-])c2C)C1 ZINC000541822871 567914622 /nfs/dbraw/zinc/91/46/22/567914622.db2.gz UJRAGQCPLGPBDL-CQSZACIVSA-N 0 0 372.512 3.508 20 5 FHBDRN COc1cc(C(=O)N2CC3(CCC3)c3ccccc32)cc([N+](=O)[O-])c1C ZINC000481436105 567941892 /nfs/dbraw/zinc/94/18/92/567941892.db2.gz NXULKJCEEOKPML-UHFFFAOYSA-N 0 0 352.390 3.994 20 5 FHBDRN Cc1ccc(C(=O)N2CCS[C@@H]2c2ccc([N+](=O)[O-])cc2)c(O)c1C ZINC000436588136 567947082 /nfs/dbraw/zinc/94/70/82/567947082.db2.gz HFXHTDVJRPZZEK-GOSISDBHSA-N 0 0 358.419 3.805 20 5 FHBDRN O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1CCO[C@@H](c2ccsc2)C1 ZINC000120366391 567959878 /nfs/dbraw/zinc/95/98/78/567959878.db2.gz OWNNGFYRRJHEFD-CQSZACIVSA-N 0 0 352.799 3.523 20 5 FHBDRN CCCOc1ccc(CCC(=O)NCc2cccc([N+](=O)[O-])c2C)cc1 ZINC000481468254 567965641 /nfs/dbraw/zinc/96/56/41/567965641.db2.gz RXYGOAKQVWGEGX-UHFFFAOYSA-N 0 0 356.422 3.941 20 5 FHBDRN Cc1c(CNC(=O)c2c(Cl)c3ccccc3n2C)cccc1[N+](=O)[O-] ZINC000481475257 567972160 /nfs/dbraw/zinc/97/21/60/567972160.db2.gz CKRMZQWKSZRUFX-UHFFFAOYSA-N 0 0 357.797 3.978 20 5 FHBDRN CSc1ccc(O[C@H](C)C(=O)NCc2cccc([N+](=O)[O-])c2C)cc1 ZINC000481477499 567972200 /nfs/dbraw/zinc/97/22/00/567972200.db2.gz NXUKWOZHRGKZAZ-CYBMUJFWSA-N 0 0 360.435 3.709 20 5 FHBDRN Cc1cc(C(=O)NCc2cccc([N+](=O)[O-])c2C)c(C)n1-c1nccs1 ZINC000481483884 567987514 /nfs/dbraw/zinc/98/75/14/567987514.db2.gz UMDPNTPQWBBKDI-UHFFFAOYSA-N 0 0 370.434 3.697 20 5 FHBDRN COc1ccc([C@H](C)NC(=O)Nc2ccc([N+](=O)[O-])cc2)c(C)c1OC ZINC000481487549 567989171 /nfs/dbraw/zinc/98/91/71/567989171.db2.gz VCGCWGAFNLIHQU-LBPRGKRZSA-N 0 0 359.382 3.803 20 5 FHBDRN CCCCCn1cc(CNCc2nc3cc([N+](=O)[O-])ccc3o2)c(C)n1 ZINC000602582350 567993826 /nfs/dbraw/zinc/99/38/26/567993826.db2.gz WXTJHMBIVFTRBD-UHFFFAOYSA-N 0 0 357.414 3.721 20 5 FHBDRN Cc1cc(C(=O)NCc2cccc([N+](=O)[O-])c2C)nn1C1CCCCC1 ZINC000481502933 567998032 /nfs/dbraw/zinc/99/80/32/567998032.db2.gz RDOCJGCNFVOERV-UHFFFAOYSA-N 0 0 356.426 3.843 20 5 FHBDRN O=C(c1cc2c(cc1O)CCCC2)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000436608408 568032452 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ZINC000481627867 568072129 /nfs/dbraw/zinc/07/21/29/568072129.db2.gz NVVSFPIOONMZDB-KRWDZBQOSA-N 0 0 371.437 3.548 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Cc1cc(F)c(F)cc1F ZINC000159265612 568081725 /nfs/dbraw/zinc/08/17/25/568081725.db2.gz WHPUQLWJPCBZIT-UHFFFAOYSA-N 0 0 366.339 3.992 20 5 FHBDRN Cn1cc(NC(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)c(C2CC2)n1 ZINC000291215163 568082955 /nfs/dbraw/zinc/08/29/55/568082955.db2.gz BQYWPKSRPNFXTI-UHFFFAOYSA-N 0 0 369.303 3.869 20 5 FHBDRN CCN(CCNC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccccc1C ZINC000481687919 568089370 /nfs/dbraw/zinc/08/93/70/568089370.db2.gz UFGAOXUFNCIBPQ-UHFFFAOYSA-N 0 0 361.829 3.813 20 5 FHBDRN Cn1cc([C@@H](NC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C(C)(C)C)cn1 ZINC000481705818 568090530 /nfs/dbraw/zinc/09/05/30/568090530.db2.gz WDJXDSBBLPIXQV-CQSZACIVSA-N 0 0 365.821 3.891 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2ncn(C[C@@H](O)Cc3ccc4ccccc4c3)n2)c1 ZINC000481707698 568090834 /nfs/dbraw/zinc/09/08/34/568090834.db2.gz UGVSHJREKQSCEM-FQEVSTJZSA-N 0 0 374.400 3.610 20 5 FHBDRN COc1cc(OC[C@H](O)Cc2ccc3ccccc3c2)ccc1[N+](=O)[O-] ZINC000481702485 568092140 /nfs/dbraw/zinc/09/21/40/568092140.db2.gz HVVHSLSRXUESFX-QGZVFWFLSA-N 0 0 353.374 3.739 20 5 FHBDRN CN(C)c1ccc([N+](=O)[O-])c(OC[C@H](O)Cc2ccc3ccccc3c2)c1 ZINC000481717541 568093970 /nfs/dbraw/zinc/09/39/70/568093970.db2.gz KLDLWPVRAKHECG-LJQANCHMSA-N 0 0 366.417 3.796 20 5 FHBDRN CCO[C@H]1C[C@@H](N(C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1(C)C ZINC000481724936 568098402 /nfs/dbraw/zinc/09/84/02/568098402.db2.gz CUTSDFSECJQLFF-KGLIPLIRSA-N 0 0 355.822 3.916 20 5 FHBDRN CSc1ccc(CSC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1 ZINC000481734761 568099836 /nfs/dbraw/zinc/09/98/36/568099836.db2.gz HTGQHBYPECXMFV-OAHLLOKOSA-N 0 0 365.476 3.990 20 5 FHBDRN CCN(C(=O)c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1)C1COC1 ZINC000452983513 568125652 /nfs/dbraw/zinc/12/56/52/568125652.db2.gz ZUHTZHBQIUBHLO-UHFFFAOYSA-N 0 0 358.419 3.607 20 5 FHBDRN C[C@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)c1cc([N+](=O)[O-])nn1C ZINC000481803830 568130707 /nfs/dbraw/zinc/13/07/07/568130707.db2.gz XCQXQTCZDLILQM-CQSZACIVSA-N 0 0 364.405 3.829 20 5 FHBDRN O=[N+]([O-])c1ccc(NCC[C@H]2COc3ccccc3O2)c2ncccc12 ZINC000481815021 568137123 /nfs/dbraw/zinc/13/71/23/568137123.db2.gz MUPGZHPKVFSYFX-ZDUSSCGKSA-N 0 0 351.362 3.785 20 5 FHBDRN Cn1nc([N+](=O)[O-])cc1C(=O)Nc1cc(F)ccc1Oc1ccccc1 ZINC000481876320 568140541 /nfs/dbraw/zinc/14/05/41/568140541.db2.gz SZVSEJIQDJEBAG-UHFFFAOYSA-N 0 0 356.313 3.512 20 5 FHBDRN O=C(c1scnc1C(F)(F)F)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000291447854 568163530 /nfs/dbraw/zinc/16/35/30/568163530.db2.gz JLWIDAWNUOZSHW-UHFFFAOYSA-N 0 0 357.313 3.663 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N(c1cccc(C(F)(F)F)c1)C(C)C ZINC000159332108 568163931 /nfs/dbraw/zinc/16/39/31/568163931.db2.gz PGVPDXYNRHFSDN-UHFFFAOYSA-N 0 0 370.331 3.560 20 5 FHBDRN COC(=O)c1cc(OCC(=O)Nc2ccccc2C(C)C)ccc1[N+](=O)[O-] ZINC000481897527 568169584 /nfs/dbraw/zinc/16/95/84/568169584.db2.gz MKYIMMDBGPRYNL-UHFFFAOYSA-N 0 0 372.377 3.522 20 5 FHBDRN COc1cc(C)c(NC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)cc1F ZINC000481909674 568178190 /nfs/dbraw/zinc/17/81/90/568178190.db2.gz OGUADSDWHAMIRN-UHFFFAOYSA-N 0 0 359.357 3.641 20 5 FHBDRN CC[C@@H](NC(=O)CCOc1ccccc1[N+](=O)[O-])c1ccc(OC)cc1 ZINC000603950405 568187156 /nfs/dbraw/zinc/18/71/56/568187156.db2.gz IQBCWWWVYTUFJZ-MRXNPFEDSA-N 0 0 358.394 3.640 20 5 FHBDRN CC[C@H](C)c1ccc([C@@H](NC(=O)Cn2ccc([N+](=O)[O-])n2)C(C)C)cc1 ZINC000603950548 568187197 /nfs/dbraw/zinc/18/71/97/568187197.db2.gz SCNPSRBAQZXAEO-LIRRHRJNSA-N 0 0 358.442 3.818 20 5 FHBDRN COC(=O)c1cc(OCc2cc(-c3ccc(C)cc3)no2)ccc1[N+](=O)[O-] ZINC000481922840 568187921 /nfs/dbraw/zinc/18/79/21/568187921.db2.gz MUVWUUKLXIYYCF-UHFFFAOYSA-N 0 0 368.345 3.924 20 5 FHBDRN COCCOc1cccc(NC(=O)c2ccc(SC)c([N+](=O)[O-])c2)c1 ZINC000603973072 568188800 /nfs/dbraw/zinc/18/88/00/568188800.db2.gz YFWFHOBKYNDNOO-UHFFFAOYSA-N 0 0 362.407 3.594 20 5 FHBDRN COC(=O)c1ccsc1NC(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000603965326 568191017 /nfs/dbraw/zinc/19/10/17/568191017.db2.gz MNUBIJLUPRKRRZ-VIFPVBQESA-N 0 0 366.420 3.562 20 5 FHBDRN CC1CC[NH+](Cc2ccc(NC(=O)c3ccc([O-])c([N+](=O)[O-])c3)cc2)CC1 ZINC000436637858 568196685 /nfs/dbraw/zinc/19/66/85/568196685.db2.gz CHYJHWNZJKKTIR-UHFFFAOYSA-N 0 0 369.421 3.785 20 5 FHBDRN CCC1(CNC(=O)c2cc(Cl)cc(Cl)c2[N+](=O)[O-])CCOCC1 ZINC000291552598 568196759 /nfs/dbraw/zinc/19/67/59/568196759.db2.gz UUNCGGBVCIMYFQ-UHFFFAOYSA-N 0 0 361.225 3.838 20 5 FHBDRN CCOCCC1(CNc2ncc([N+](=O)[O-])cc2Br)CCC1 ZINC000481992449 568216048 /nfs/dbraw/zinc/21/60/48/568216048.db2.gz OHYIPLUQALXCMA-UHFFFAOYSA-N 0 0 358.236 3.761 20 5 FHBDRN O=C(Nc1ccncc1[N+](=O)[O-])N1CC=C(c2cccc3ccccc32)CC1 ZINC000541907831 568216369 /nfs/dbraw/zinc/21/63/69/568216369.db2.gz NJMMGYJFQAAIRK-UHFFFAOYSA-N 0 0 374.400 3.886 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)Nc2nc(C)cc(C3CC3)n2)cc1SC ZINC000291578486 568216457 /nfs/dbraw/zinc/21/64/57/568216457.db2.gz KGWJATWDEXDLFR-UHFFFAOYSA-N 0 0 374.422 3.553 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N1CCC[C@@H]1[C@@H]1C[C@H](C)CC[C@H]1O ZINC000408262800 568223432 /nfs/dbraw/zinc/22/34/32/568223432.db2.gz ZQVQQPLABJIPDC-QRVDHSFSSA-N 0 0 374.481 3.922 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(N2C[C@H](CC(=O)N(C)C)c3cc(Cl)ccc32)n1 ZINC000482007144 568226463 /nfs/dbraw/zinc/22/64/63/568226463.db2.gz OFEKFDGCPYTTEY-LBPRGKRZSA-N 0 0 374.828 3.665 20 5 FHBDRN C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000482010690 568226836 /nfs/dbraw/zinc/22/68/36/568226836.db2.gz RFLNILLIXDPMLR-NWDGAFQWSA-N 0 0 360.332 3.553 20 5 FHBDRN C[C@H](C(=O)N1CC[C@@H](c2c(F)cccc2F)C1)c1cccc([N+](=O)[O-])c1 ZINC000568818765 568231101 /nfs/dbraw/zinc/23/11/01/568231101.db2.gz OYYMFIMLCMSKTB-GXTWGEPZSA-N 0 0 360.360 3.993 20 5 FHBDRN Cc1c(CC(=O)NCc2cccc(C(F)(F)F)c2)cccc1[N+](=O)[O-] ZINC000159391853 568241655 /nfs/dbraw/zinc/24/16/55/568241655.db2.gz VHLLHCMZBHCIJU-UHFFFAOYSA-N 0 0 352.312 3.781 20 5 FHBDRN O=C(c1ccc(OC(F)F)c([N+](=O)[O-])c1)N1CC[C@H]1Cc1ccccc1 ZINC000541925647 568249873 /nfs/dbraw/zinc/24/98/73/568249873.db2.gz AYPSRNGMCUHJJC-AWEZNQCLSA-N 0 0 362.332 3.653 20 5 FHBDRN CC(C)Oc1nc(N2CCC(F)(c3cccnc3)CC2)ccc1[N+](=O)[O-] ZINC000568901146 568250002 /nfs/dbraw/zinc/25/00/02/568250002.db2.gz NFMZTXASEOPUMO-UHFFFAOYSA-N 0 0 360.389 3.637 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)NC[C@H](C)CC(F)(F)F)cc1SC ZINC000412657964 568250135 /nfs/dbraw/zinc/25/01/35/568250135.db2.gz ONTBFOJVFGXXMB-MRVPVSSYSA-N 0 0 366.361 3.644 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)NC[C@@H](C)CC(F)(F)F)cc1SC ZINC000412657967 568250136 /nfs/dbraw/zinc/25/01/36/568250136.db2.gz ONTBFOJVFGXXMB-QMMMGPOBSA-N 0 0 366.361 3.644 20 5 FHBDRN COc1cc(C(=O)N[C@@H]2CCO[C@@H](c3ccccc3)C2)cc([N+](=O)[O-])c1C ZINC000190294611 568252752 /nfs/dbraw/zinc/25/27/52/568252752.db2.gz WHVVBDLLGDEMQI-VQIMIIECSA-N 0 0 370.405 3.562 20 5 FHBDRN O=C(CCc1nc(CCCc2ccccc2)no1)c1cccc([N+](=O)[O-])c1 ZINC000453027026 568254079 /nfs/dbraw/zinc/25/40/79/568254079.db2.gz LYCIDKMTTVMPSB-UHFFFAOYSA-N 0 0 365.389 3.969 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(N2CCC[C@H]2Cn2cnc3ccccc32)n1 ZINC000541935190 568254312 /nfs/dbraw/zinc/25/43/12/568254312.db2.gz MPFPARAUOPTJPT-HNNXBMFYSA-N 0 0 351.410 3.625 20 5 FHBDRN CCCOc1cn(-c2ccccc2)nc1C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000482081183 568254976 /nfs/dbraw/zinc/25/49/76/568254976.db2.gz WFBBLRBTGKPASQ-UHFFFAOYSA-N 0 0 366.377 3.822 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(N2CCc3c(Br)cccc3C2)n1 ZINC000541935328 568258317 /nfs/dbraw/zinc/25/83/17/568258317.db2.gz PCVUXYLVFHYOBO-UHFFFAOYSA-N 0 0 362.227 3.932 20 5 FHBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1C[C@@H](C)O[C@H]1C ZINC000412665664 568258604 /nfs/dbraw/zinc/25/86/04/568258604.db2.gz XWZMFIJYJCKFKC-RDBSUJKOSA-N 0 0 366.483 3.886 20 5 FHBDRN CN(Cc1cnn(-c2ccccc2)c1)C(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000007830916 568258865 /nfs/dbraw/zinc/25/88/65/568258865.db2.gz WJKAGWOKWGHLJC-UHFFFAOYSA-N 0 0 370.796 3.706 20 5 FHBDRN C[C@@H](c1ccc(F)cc1)N(C)C(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000049618198 568259087 /nfs/dbraw/zinc/25/90/87/568259087.db2.gz DOHXQTNGVICVFT-ZDUSSCGKSA-N 0 0 368.368 3.753 20 5 FHBDRN O=C(c1ccc(F)cc1[N+](=O)[O-])N1CCO[C@@H](c2ccc(Cl)s2)C1 ZINC000366035781 568260682 /nfs/dbraw/zinc/26/06/82/568260682.db2.gz WEMXKFUMOUJUDO-GFCCVEGCSA-N 0 0 370.789 3.663 20 5 FHBDRN C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1[O-])c1nc(-c2ccccc2)cs1 ZINC000436665054 568260769 /nfs/dbraw/zinc/26/07/69/568260769.db2.gz MVTMOOOSLRWXCB-NSHDSACASA-N 0 0 369.402 3.915 20 5 FHBDRN COCCn1c2ccccc2nc1Sc1nc(C)cc(C)c1[N+](=O)[O-] ZINC000541936188 568261038 /nfs/dbraw/zinc/26/10/38/568261038.db2.gz RTIFLYYFLLSCGH-UHFFFAOYSA-N 0 0 358.423 3.754 20 5 FHBDRN Cc1cc(C(=O)N(C)Cc2ccc(Br)s2)ccc1[N+](=O)[O-] ZINC000007980676 568273408 /nfs/dbraw/zinc/27/34/08/568273408.db2.gz WQBIRXQIXWXVGD-UHFFFAOYSA-N 0 0 369.240 3.999 20 5 FHBDRN CCc1ccc([C@H]2CCCN(C(=O)c3cc([N+](=O)[O-])ccc3[O-])C2)cc1 ZINC000436684802 568279981 /nfs/dbraw/zinc/27/99/81/568279981.db2.gz HABLGTQHPJGOMF-INIZCTEOSA-N 0 0 354.406 3.883 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@H](C(C)(C)C)C1 ZINC000330963746 568280504 /nfs/dbraw/zinc/28/05/04/568280504.db2.gz METMSIIQFUDSNV-INIZCTEOSA-N 0 0 366.483 3.982 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N(C)[C@H]2CCCC[C@H]2C(F)(F)F)c1 ZINC000291732115 568283326 /nfs/dbraw/zinc/28/33/26/568283326.db2.gz RQUCRZGZNXGNBV-OCCSQVGLSA-N 0 0 360.332 3.797 20 5 FHBDRN Cc1ccc2[nH]c(SCCC(=O)Nc3ccccc3[N+](=O)[O-])nc2c1 ZINC000026358992 568286451 /nfs/dbraw/zinc/28/64/51/568286451.db2.gz UTFCYTHNQCTMLP-UHFFFAOYSA-N 0 0 356.407 3.900 20 5 FHBDRN Nc1c(C(=O)N[C@@H]2CC=C(c3ccc(F)cc3)CC2)cc(F)cc1[N+](=O)[O-] ZINC000482138871 568287725 /nfs/dbraw/zinc/28/77/25/568287725.db2.gz HHKHLWKEONXZOD-OAHLLOKOSA-N 0 0 373.359 3.821 20 5 FHBDRN Cc1ccccc1NC(=O)Cc1noc(/C=C/c2ccccc2[N+](=O)[O-])n1 ZINC000609473862 568292670 /nfs/dbraw/zinc/29/26/70/568292670.db2.gz BOXOUGPUGRVGFH-ZHACJKMWSA-N 0 0 364.361 3.638 20 5 FHBDRN C[C@H](c1cc(F)ccc1F)N(C)C(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000569143984 568292966 /nfs/dbraw/zinc/29/29/66/568292966.db2.gz AXJQJFQYPHZCOA-SECBINFHSA-N 0 0 370.302 3.913 20 5 FHBDRN COc1ccccc1SCC(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000482157448 568293208 /nfs/dbraw/zinc/29/32/08/568293208.db2.gz ZYPBUSFJOVCQMY-UHFFFAOYSA-N 0 0 374.462 3.835 20 5 FHBDRN CCOc1cc(NC(=O)NC[C@H](C)C2CC2)c([N+](=O)[O-])cc1OCC ZINC000604401961 568294846 /nfs/dbraw/zinc/29/48/46/568294846.db2.gz GMFGTWARYRHGBB-NSHDSACASA-N 0 0 351.403 3.560 20 5 FHBDRN CCC(=O)Nc1ccc(C)c(NC(=O)[C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000569063495 568295963 /nfs/dbraw/zinc/29/59/63/568295963.db2.gz RKYADGWXQFKVTC-CYBMUJFWSA-N 0 0 355.394 3.994 20 5 FHBDRN Cc1nc2ccc(NC(=O)Cc3c(F)cc([N+](=O)[O-])cc3F)cc2s1 ZINC000569165052 568298514 /nfs/dbraw/zinc/29/85/14/568298514.db2.gz QQYDBQNJKCHWHJ-UHFFFAOYSA-N 0 0 363.345 3.972 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)NCCc1c[nH]c2cc(F)ccc12 ZINC000604522193 568305152 /nfs/dbraw/zinc/30/51/52/568305152.db2.gz QLTLIIVJKRMLMA-UHFFFAOYSA-N 0 0 370.384 3.599 20 5 FHBDRN COc1cccc(-c2c[nH]cc2C(=O)NCc2cccc([N+](=O)[O-])c2)c1 ZINC000604572530 568315057 /nfs/dbraw/zinc/31/50/57/568315057.db2.gz LWPOWZADXPFPGG-UHFFFAOYSA-N 0 0 351.362 3.529 20 5 FHBDRN O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCC2(CC2)CC1 ZINC000609477331 568324501 /nfs/dbraw/zinc/32/45/01/568324501.db2.gz QGAPBKUAVQYXQA-UHFFFAOYSA-N 0 0 371.359 3.818 20 5 FHBDRN CC(C)Cc1nnc(NC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)s1 ZINC000032892181 568324559 /nfs/dbraw/zinc/32/45/59/568324559.db2.gz DLZPQAHJLYQNCI-SNVBAGLBSA-N 0 0 366.468 3.764 20 5 FHBDRN CCOc1ccc(-c2noc(-c3cccc(SC)c3[N+](=O)[O-])n2)cn1 ZINC000569288401 568334214 /nfs/dbraw/zinc/33/42/14/568334214.db2.gz HNOZEUTYXVMPLU-UHFFFAOYSA-N 0 0 358.379 3.827 20 5 FHBDRN COc1ccc2cccc(CC(=O)N3CCc4ccc([N+](=O)[O-])cc43)c2c1 ZINC000128800951 568346057 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O=C(Nc1cccc(Cn2cccn2)c1)c1ccc([N+](=O)[O-])cc1Cl ZINC000032468090 568391098 /nfs/dbraw/zinc/39/10/98/568391098.db2.gz SZHATKLNYLLRGV-UHFFFAOYSA-N 0 0 356.769 3.745 20 5 FHBDRN CC(C)(C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1cccnc1 ZINC000542002124 568394285 /nfs/dbraw/zinc/39/42/85/568394285.db2.gz IUMPMGQIDUHGKK-UHFFFAOYSA-N 0 0 351.309 3.508 20 5 FHBDRN Cc1cc(C(=O)COc2cccc([N+](=O)[O-])c2)c(C)n1Cc1ccco1 ZINC000006061047 568397533 /nfs/dbraw/zinc/39/75/33/568397533.db2.gz SLXXMQUNELCYKP-UHFFFAOYSA-N 0 0 354.362 3.916 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(N2CCCC[C@H]2c2nnc(C3CCC3)o2)n1 ZINC000569382300 568399909 /nfs/dbraw/zinc/39/99/09/568399909.db2.gz JDTIMAORVUIOTO-AWEZNQCLSA-N 0 0 357.414 3.989 20 5 FHBDRN Cc1nc(NC(=O)[C@@H](C)Cc2cncc3ccccc32)ccc1[N+](=O)[O-] ZINC000569405780 568401085 /nfs/dbraw/zinc/40/10/85/568401085.db2.gz UYDVOAANARSUIP-LBPRGKRZSA-N 0 0 350.378 3.664 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1OCC(=O)c1cccc(Br)c1 ZINC000006290827 568401466 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359.426 3.512 20 5 FHBDRN O=C([O-])[C@@H]([NH2+]CCc1ccccc1[N+](=O)[O-])c1cc(Cl)cc(Cl)c1 ZINC000833164497 601977241 /nfs/dbraw/zinc/97/72/41/601977241.db2.gz ADXYFTCZWUVDEC-HNNXBMFYSA-N 0 0 369.204 3.860 20 5 FHBDRN C[C@H]([NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)[C@H]1CCCN(C(=O)[O-])C1 ZINC000739032396 602270463 /nfs/dbraw/zinc/27/04/63/602270463.db2.gz WYIKLLBJGJDCDR-ZFWWWQNUSA-N 0 0 373.409 3.723 20 5 FHBDRN O=C([O-])[C@H]1CC12CC[NH+](Cc1ccc(-c3cccc([N+](=O)[O-])c3)o1)CC2 ZINC000833771605 604650153 /nfs/dbraw/zinc/65/01/53/604650153.db2.gz KQPZRTQSYHHJQM-MRXNPFEDSA-N 0 0 356.378 3.542 20 5 FHBDRN O=C([O-])[C@H]1CC12CC[NH+](Cc1ccc(-c3ccc([N+](=O)[O-])cc3)o1)CC2 ZINC000833771992 604650953 /nfs/dbraw/zinc/65/09/53/604650953.db2.gz WPPIEAUZNFDRSH-MRXNPFEDSA-N 0 0 356.378 3.542 20 5 FHBDRN C[C@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C[C@@H]1C(=O)[O-] ZINC000833628943 604666040 /nfs/dbraw/zinc/66/60/40/604666040.db2.gz CUDJETDLCNATKJ-HZMBPMFUSA-N 0 0 364.785 3.661 20 5 FHBDRN 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ZINC000823630239 607164186 /nfs/dbraw/zinc/16/41/86/607164186.db2.gz SXDSTSLAQXLJNB-UHFFFAOYSA-N 0 0 369.193 3.628 20 5 FHBDRN O=[N+]([O-])c1ccc(CSc2ccc(-c3nn[nH]n3)cc2Cl)c(F)c1 ZINC000826498519 607845992 /nfs/dbraw/zinc/84/59/92/607845992.db2.gz YNAWQNJPVBWUKN-UHFFFAOYSA-N 0 0 365.777 3.860 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2ccc(CNc3ccc(-c4nn[nH]n4)cc3)o2)cc1 ZINC000826498078 608869428 /nfs/dbraw/zinc/86/94/28/608869428.db2.gz HFFHSFPUCHFWTA-UHFFFAOYSA-N 0 0 362.349 3.647 20 5 FHBDRN COc1cc(CS[C@@H](C)c2ccc(-c3nn[nH]n3)cc2)ccc1[N+](=O)[O-] ZINC000826180185 609440107 /nfs/dbraw/zinc/44/01/07/609440107.db2.gz VWWDKWNAPQXUBA-NSHDSACASA-N 0 0 371.422 3.778 20 5 FHBDRN Cc1ccnc([C@H]2CCN(C(=O)[C@H](C)c3ccc([N+](=O)[O-])cc3F)C2)c1 ZINC000572899026 936324585 /nfs/dbraw/zinc/32/45/85/936324585.db2.gz QIWLZLSFPKPMNU-KGLIPLIRSA-N 0 0 357.385 3.557 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)ccc1-c1nc(Cc2cn3ccccc3n2)no1 ZINC000612872748 936332755 /nfs/dbraw/zinc/33/27/55/936332755.db2.gz JZGPOJJXOVJWAD-UHFFFAOYSA-N 0 0 355.741 3.537 20 5 FHBDRN Cc1cccc(CS(=O)(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1 ZINC000171077316 936335575 /nfs/dbraw/zinc/33/55/75/936335575.db2.gz UDVZGPLTVSFTDP-UHFFFAOYSA-N 0 0 362.451 3.644 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)c1nc(-c2cccc(C(N)=O)c2)no1 ZINC000612900489 936337177 /nfs/dbraw/zinc/33/71/77/936337177.db2.gz APZPMPZDOHUKSJ-SNVBAGLBSA-N 0 0 370.390 3.597 20 5 FHBDRN Cc1ccc([C@H]2COCCN2C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)o1 ZINC000162056724 936341699 /nfs/dbraw/zinc/34/16/99/936341699.db2.gz FPIMSVJWZPTNHC-OAHLLOKOSA-N 0 0 359.382 3.718 20 5 FHBDRN O=C(C/C=C\c1cccc(F)c1)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000572911323 936342242 /nfs/dbraw/zinc/34/22/42/936342242.db2.gz ZHGWPBSDSMCMNB-RQOWECAXSA-N 0 0 367.380 3.977 20 5 FHBDRN Cc1cc(N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)nc(-c2cccnc2)n1 ZINC000153638999 936345838 /nfs/dbraw/zinc/34/58/38/936345838.db2.gz KYZLUGGTBGYLCQ-UHFFFAOYSA-N 0 0 361.405 3.924 20 5 FHBDRN CS(=O)(=O)c1cc([N+](=O)[O-])ccc1NC[C@@H](c1ccccc1)C1CC1 ZINC000431512637 936346982 /nfs/dbraw/zinc/34/69/82/936346982.db2.gz PZLWPBHIFSRGMV-INIZCTEOSA-N 0 0 360.435 3.604 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)Nc2c(F)cccc2F)cc1OC ZINC000061431452 936349435 /nfs/dbraw/zinc/34/94/35/936349435.db2.gz DPYVYQGVNQVNKR-UHFFFAOYSA-N 0 0 352.293 3.533 20 5 FHBDRN O=C(NCc1noc2c1CCCC2)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000572913902 936349842 /nfs/dbraw/zinc/34/98/42/936349842.db2.gz VWIOOLMBJWKSMG-UHFFFAOYSA-N 0 0 357.391 3.606 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(Cc2noc(Cc3coc4ccccc34)n2)c1 ZINC000582990570 936351616 /nfs/dbraw/zinc/35/16/16/936351616.db2.gz QWTOWIMSKHHFDF-UHFFFAOYSA-N 0 0 365.345 3.914 20 5 FHBDRN Cc1c(Cc2noc([C@@H]3CCCCN3C(=O)C(C)C)n2)cccc1[N+](=O)[O-] ZINC000582989885 936352428 /nfs/dbraw/zinc/35/24/28/936352428.db2.gz FVIVUFOTNHNJKZ-INIZCTEOSA-N 0 0 372.425 3.587 20 5 FHBDRN C[C@@H]1CN(C(=O)c2cccc3c(=O)c4ccccc4[nH]c23)CC(C)(C)O1 ZINC000278018761 936370979 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3.877 20 5 FHBDRN COc1ccc(C)cc1[C@@H](C)NCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000161539992 937126813 /nfs/dbraw/zinc/12/68/13/937126813.db2.gz LQNXVZDOMSWZCN-CYBMUJFWSA-N 0 0 368.393 3.813 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H]1CCO[C@H](c2ccccc2)C1 ZINC000162476138 937127883 /nfs/dbraw/zinc/12/78/83/937127883.db2.gz BDPKKJMELMTUFH-QAPCUYQASA-N 0 0 355.394 3.945 20 5 FHBDRN COc1c(F)ccc(F)c1C(=O)OCc1cc([N+](=O)[O-])ccc1Cl ZINC000755323790 937128790 /nfs/dbraw/zinc/12/87/90/937128790.db2.gz FAZNSSPKVKBFLF-UHFFFAOYSA-N 0 0 357.696 3.892 20 5 FHBDRN Cc1cc(Cl)ccc1NC(=O)[C@@H](C)OC(=O)c1ccc([N+](=O)[O-])s1 ZINC000023344303 927037272 /nfs/dbraw/zinc/03/72/72/927037272.db2.gz AIYYIFCLSOAZFB-SECBINFHSA-N 0 0 368.798 3.802 20 5 FHBDRN CCCOc1ccccc1[C@H](CC(C)C)NC(=O)c1[nH]ncc1[N+](=O)[O-] ZINC000126827612 927080394 /nfs/dbraw/zinc/08/03/94/927080394.db2.gz PHHIGNVHBOJBKL-AWEZNQCLSA-N 0 0 360.414 3.624 20 5 FHBDRN CCN(C(=O)c1cc(OC)c(OC)c([N+](=O)[O-])c1)[C@@H]1CCCC[C@H]1C ZINC000610174698 927178117 /nfs/dbraw/zinc/17/81/17/927178117.db2.gz XMCKIRHBMAYTQC-TZMCWYRMSA-N 0 0 350.415 3.653 20 5 FHBDRN O=[N+]([O-])c1ccc(N[C@H]2CCN(c3ccnc4c(Cl)cccc34)C2)nc1 ZINC000557639431 927253779 /nfs/dbraw/zinc/25/37/79/927253779.db2.gz HAPXTZVTQLVTQX-LBPRGKRZSA-N 0 0 369.812 3.882 20 5 FHBDRN Cc1nn(CCC(=O)N2C[C@@H](C)CC[C@@H]2c2ccccc2)c(C)c1[N+](=O)[O-] ZINC000557638896 927256418 /nfs/dbraw/zinc/25/64/18/927256418.db2.gz PERUOVSWIFFMDF-KBXCAEBGSA-N 0 0 370.453 3.798 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1CCCOc2c(F)cccc21 ZINC000471108921 927259259 /nfs/dbraw/zinc/25/92/59/927259259.db2.gz AIRXCKCXOWOFBY-AWEZNQCLSA-N 0 0 374.368 3.776 20 5 FHBDRN CO[C@H](c1ccccc1F)[C@H](C)Nc1ncnc2sc([N+](=O)[O-])cc21 ZINC000557646127 927271083 /nfs/dbraw/zinc/27/10/83/927271083.db2.gz ZSXPZAPNQMWANZ-XPTSAGLGSA-N 0 0 362.386 3.927 20 5 FHBDRN COCCOc1ccc(NC(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)cc1 ZINC000120116587 927309394 /nfs/dbraw/zinc/30/93/94/927309394.db2.gz KJIVDKFJNKSJRS-UHFFFAOYSA-N 0 0 359.382 3.881 20 5 FHBDRN C[C@H](c1ccc([S@](C)=O)cc1)N(C)c1ncc(Cl)cc1[N+](=O)[O-] ZINC000153891167 927318608 /nfs/dbraw/zinc/31/86/08/927318608.db2.gz HWJDORSTGLQUHW-DJNLSKAYSA-N 0 0 353.831 3.578 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCCN(c2ccccc2Cl)C1 ZINC000610179575 927343384 /nfs/dbraw/zinc/34/33/84/927343384.db2.gz SBQZASGBLFEJHI-CQSZACIVSA-N 0 0 373.840 3.955 20 5 FHBDRN Cc1c(CC(=O)N[C@@H]2CCC[C@@H]2OCc2ccccc2)cccc1[N+](=O)[O-] ZINC000133655762 927351028 /nfs/dbraw/zinc/35/10/28/927351028.db2.gz DWCZOSDXQXVABC-QUCCMNQESA-N 0 0 368.433 3.700 20 5 FHBDRN COc1ccc(C(=O)Nc2ccc([N+](=O)[O-])cc2)c(Br)c1 ZINC000133659070 927352943 /nfs/dbraw/zinc/35/29/43/927352943.db2.gz DIOYIXXORMFHMS-UHFFFAOYSA-N 0 0 351.156 3.618 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)Nc2cc(F)cc(F)c2F)cc1SC ZINC000558229680 927441110 /nfs/dbraw/zinc/44/11/10/927441110.db2.gz HXZBHQCVNZJKOD-UHFFFAOYSA-N 0 0 372.324 3.995 20 5 FHBDRN CCc1c(NC(=O)CCc2cccc([N+](=O)[O-])c2)onc1C(F)(F)F ZINC000274659751 927443869 /nfs/dbraw/zinc/44/38/69/927443869.db2.gz DYFQUNYVSQIERO-UHFFFAOYSA-N 0 0 357.288 3.735 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N1C[C@H](C)[C@@H]1c1ccccc1 ZINC000175290303 927457489 /nfs/dbraw/zinc/45/74/89/927457489.db2.gz HFHGIRKLBFKGOQ-SCLBCKFNSA-N 0 0 355.394 3.506 20 5 FHBDRN Cc1c(C(=O)O[C@@H]2CCCOc3ccccc32)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC001266274547 927518342 /nfs/dbraw/zinc/51/83/42/927518342.db2.gz TVFJJTZTSXAVIH-QGZVFWFLSA-N 0 0 372.333 3.882 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)NCc1ccc(C(F)F)cc1 ZINC000471121459 927556930 /nfs/dbraw/zinc/55/69/30/927556930.db2.gz IGDXRRUFPDLJED-UHFFFAOYSA-N 0 0 350.321 3.861 20 5 FHBDRN O=C(c1cc(Cl)ccc1[N+](=O)[O-])N1CC[C@]2(C1)OCc1ccccc12 ZINC000186909857 927567013 /nfs/dbraw/zinc/56/70/13/927567013.db2.gz UDBVPJVHCAKBCB-GOSISDBHSA-N 0 0 358.781 3.520 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CCC[C@H]1C[C@H](O)c1ccco1 ZINC000162574978 937183098 /nfs/dbraw/zinc/18/30/98/937183098.db2.gz SPLYAJLCYOXJRW-BBRMVZONSA-N 0 0 359.382 3.616 20 5 FHBDRN O=C(Nc1cc(Br)ccc1NC1CC1)c1ccc([N+](=O)[O-])o1 ZINC000471131096 927662598 /nfs/dbraw/zinc/66/25/98/927662598.db2.gz OALBDFJTIHCURQ-UHFFFAOYSA-N 0 0 366.171 3.777 20 5 FHBDRN COCC1(CC(=O)N(CC2CC2)c2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000843537797 927678524 /nfs/dbraw/zinc/67/85/24/927678524.db2.gz CFKORNJZWFNQSI-UHFFFAOYSA-N 0 0 352.818 3.808 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1CN1CCN([C@H](C)c2ccsc2)CC1 ZINC000430193547 927781097 /nfs/dbraw/zinc/78/10/97/927781097.db2.gz GPNAZDDJGPFVRX-CQSZACIVSA-N 0 0 361.467 3.544 20 5 FHBDRN CC[C@@H](C)COc1cc([N+](=O)[O-])c(CN(C)[C@H]2CCCOC2)cc1OC ZINC000510077272 927791492 /nfs/dbraw/zinc/79/14/92/927791492.db2.gz BORDWRQBNTWHSO-ZBFHGGJFSA-N 0 0 366.458 3.639 20 5 FHBDRN O=C(CCNc1ccc([N+](=O)[O-])s1)Nc1ccc(Br)cc1 ZINC000064029752 927800401 /nfs/dbraw/zinc/80/04/01/927800401.db2.gz JLVLQDJTJQHSOS-UHFFFAOYSA-N 0 0 370.228 3.860 20 5 FHBDRN CC[C@H](NC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1)c1nc(C)cs1 ZINC000120223372 927805843 /nfs/dbraw/zinc/80/58/43/927805843.db2.gz CZDZMNMXLDOLCJ-AWEZNQCLSA-N 0 0 360.439 3.579 20 5 FHBDRN O=C(C1=Cc2cc(F)ccc2OC1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000120233164 927831968 /nfs/dbraw/zinc/83/19/68/927831968.db2.gz BJVRPQWDKIFACI-UHFFFAOYSA-N 0 0 368.364 3.701 20 5 FHBDRN COc1cc(NC(=O)c2cc(F)cc(C)c2[N+](=O)[O-])c(OC)cc1Cl ZINC000175728999 927856919 /nfs/dbraw/zinc/85/69/19/927856919.db2.gz CSHITKNQWKRRCB-UHFFFAOYSA-N 0 0 368.748 3.965 20 5 FHBDRN COc1cc(NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)ccc1F ZINC000187034539 927859702 /nfs/dbraw/zinc/85/97/02/927859702.db2.gz BMWBQSNSBAJTTK-UHFFFAOYSA-N 0 0 359.357 3.939 20 5 FHBDRN O=[N+]([O-])c1cc(CN2CCC[C@](O)(C(F)(F)F)CC2)ccc1Cl ZINC000285605724 927875259 /nfs/dbraw/zinc/87/52/59/927875259.db2.gz PVMDYLKPKXVMDP-CYBMUJFWSA-N 0 0 352.740 3.528 20 5 FHBDRN Cc1cccc(-c2nnc(SCCOc3cccc([N+](=O)[O-])c3)n2C)c1 ZINC000097363171 927885908 /nfs/dbraw/zinc/88/59/08/927885908.db2.gz VHLWYOFJCSAKKR-UHFFFAOYSA-N 0 0 370.434 3.870 20 5 FHBDRN Cc1cc(F)cc(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c1[N+](=O)[O-] ZINC000175732126 927886943 /nfs/dbraw/zinc/88/69/43/927886943.db2.gz JXDZTAITTFIFQA-UHFFFAOYSA-N 0 0 371.368 3.531 20 5 FHBDRN Cc1ccc(S(=O)(=O)Nc2ccc(CC(F)(F)F)cc2)cc1[N+](=O)[O-] ZINC000610193686 927891876 /nfs/dbraw/zinc/89/18/76/927891876.db2.gz DDZKHNXIWMNLIW-UHFFFAOYSA-N 0 0 374.340 3.809 20 5 FHBDRN CCCN(Cc1ccc([N+](=O)[O-])cc1OC)[C@H](C)C(=O)Nc1ccccc1 ZINC000430198488 927898270 /nfs/dbraw/zinc/89/82/70/927898270.db2.gz YRQIUMQTGJBOTG-OAHLLOKOSA-N 0 0 371.437 3.843 20 5 FHBDRN O=C(c1ccn(-c2ccccc2[N+](=O)[O-])n1)N1CCC[C@H]2CCCC[C@H]21 ZINC000126852949 927905457 /nfs/dbraw/zinc/90/54/57/927905457.db2.gz CZRBVMVXMDTNDZ-GDBMZVCRSA-N 0 0 354.410 3.575 20 5 FHBDRN CSc1cccc(C(=O)N[C@H](C)[C@@H](c2ccccc2)[NH+](C)C)c1[N+](=O)[O-] ZINC000187093020 927908021 /nfs/dbraw/zinc/90/80/21/927908021.db2.gz WYCNLIXTKHUXDU-DYVFJYSZSA-N 0 0 373.478 3.738 20 5 FHBDRN COC[C@@H](NCc1ccc([N+](=O)[O-])c(OC)c1)c1cccc(Cl)c1 ZINC000583170023 937201624 /nfs/dbraw/zinc/20/16/24/937201624.db2.gz IGNLORPVHYTDGS-OAHLLOKOSA-N 0 0 350.802 3.734 20 5 FHBDRN CCc1nc(C)c([C@@H](C)N(C)C(=O)c2ccc(NC)c([N+](=O)[O-])c2)s1 ZINC000610199344 927940574 /nfs/dbraw/zinc/94/05/74/927940574.db2.gz SAURGAIUIDYGCK-LLVKDONJSA-N 0 0 362.455 3.797 20 5 FHBDRN Cc1nc([C@@H]2CCCN2C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)cs1 ZINC000187137769 927943013 /nfs/dbraw/zinc/94/30/13/927943013.db2.gz POXCTIDIHGDQAA-AWEZNQCLSA-N 0 0 351.815 3.990 20 5 FHBDRN O=C(NCc1coc(-c2ccccc2)n1)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000610200802 927949849 /nfs/dbraw/zinc/94/98/49/927949849.db2.gz XGJRXNOKHAFLFS-UHFFFAOYSA-N 0 0 362.345 3.661 20 5 FHBDRN COc1ccccc1[C@@]1(C)C[C@@H]1NC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000610200545 927951633 /nfs/dbraw/zinc/95/16/33/927951633.db2.gz JQKYGTAHKOSQGJ-FUHWJXTLSA-N 0 0 360.797 3.717 20 5 FHBDRN C[C@H]1CN(C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)CCC1(F)F ZINC000583176739 937208230 /nfs/dbraw/zinc/20/82/30/937208230.db2.gz SPFUKZODLHXFBY-ZDUSSCGKSA-N 0 0 355.385 3.604 20 5 FHBDRN CCC[C@@H]1C[C@@H](C(=O)OCCSc2ccc([N+](=O)[O-])cc2)CCO1 ZINC000784935154 928020886 /nfs/dbraw/zinc/02/08/86/928020886.db2.gz ICWFTAXMGJCFEJ-DZGCQCFKSA-N 0 0 353.440 3.825 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1CN1CCC(Oc2ccc(C)cc2)CC1 ZINC000430206503 928025897 /nfs/dbraw/zinc/02/58/97/928025897.db2.gz WIWWGMARSKRTFG-UHFFFAOYSA-N 0 0 356.422 3.955 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1CN1CCC(Nc2cccc(C)c2)CC1 ZINC000430206532 928026293 /nfs/dbraw/zinc/02/62/93/928026293.db2.gz WLMMUCZOJXBGKU-UHFFFAOYSA-N 0 0 355.438 3.988 20 5 FHBDRN C[C@]1(c2ccccc2)C[C@@H]1NC(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000610204789 928034200 /nfs/dbraw/zinc/03/42/00/928034200.db2.gz CLZJWGDXOBOOMY-AZUAARDMSA-N 0 0 353.422 3.633 20 5 FHBDRN Cc1ccc(C(=O)N(C)C)cc1NC(=O)c1cccc(Cl)c1[N+](=O)[O-] ZINC000175741903 928036350 /nfs/dbraw/zinc/03/63/50/928036350.db2.gz FAOADFGZNUIMBU-UHFFFAOYSA-N 0 0 361.785 3.511 20 5 FHBDRN C[C@@H]1C[C@H]1C(=O)O[C@H](c1ccc(Br)cc1)C(C)(C)[N+](=O)[O-] ZINC000753944588 928040202 /nfs/dbraw/zinc/04/02/02/928040202.db2.gz AELIBCAKEACBRJ-OASPWFOLSA-N 0 0 356.216 3.745 20 5 FHBDRN C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1CC(=O)N[C@@H](c1ccccc1)C1CC1 ZINC000728200727 928068290 /nfs/dbraw/zinc/06/82/90/928068290.db2.gz AACTUOLVEJCULU-QKKBWIMNSA-N 0 0 365.433 3.613 20 5 FHBDRN CCc1nc(C)c(C(=O)OCCSc2ccc([N+](=O)[O-])cc2)s1 ZINC000784937619 928070078 /nfs/dbraw/zinc/07/00/78/928070078.db2.gz KPUKKTXDIXARRV-UHFFFAOYSA-N 0 0 352.437 3.871 20 5 FHBDRN COCCN(Cc1ccccc1)C(=O)Nc1cc([N+](=O)[O-])c(C)cc1C ZINC000120313161 928079610 /nfs/dbraw/zinc/07/96/10/928079610.db2.gz LWPBMNLKEQCCFK-UHFFFAOYSA-N 0 0 357.410 3.892 20 5 FHBDRN CC(C)(NC(=O)CCCOc1ccccc1F)c1ccc([N+](=O)[O-])cc1 ZINC000176497972 937217423 /nfs/dbraw/zinc/21/74/23/937217423.db2.gz HEFJGNRENLQEFQ-UHFFFAOYSA-N 0 0 360.385 3.944 20 5 FHBDRN CC(C)(NC(=O)c1ccn(-c2ccc(F)cc2)n1)c1ccc([N+](=O)[O-])cc1 ZINC000176502445 937218107 /nfs/dbraw/zinc/21/81/07/937218107.db2.gz IDOVTEOKRXARMT-UHFFFAOYSA-N 0 0 368.368 3.585 20 5 FHBDRN Cc1ccc(OCC(=O)N2CCS[C@@H]2c2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000610210295 928093683 /nfs/dbraw/zinc/09/36/83/928093683.db2.gz HAFTTWLPMYVCKO-LJQANCHMSA-N 0 0 372.446 3.865 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)OCCSc2ccc([N+](=O)[O-])cc2)c1 ZINC000784938035 928148165 /nfs/dbraw/zinc/14/81/65/928148165.db2.gz NXHIPKAZIIPCKF-UHFFFAOYSA-N 0 0 362.363 3.761 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1CN1CCC[C@@H]1c1cccc2c1OCCO2 ZINC000430212811 928169453 /nfs/dbraw/zinc/16/94/53/928169453.db2.gz QAOVLVMIBAFLGV-QGZVFWFLSA-N 0 0 370.405 3.712 20 5 FHBDRN CO[C@H](C)c1cccc(NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)c1 ZINC000126879159 928171392 /nfs/dbraw/zinc/17/13/92/928171392.db2.gz AWDQRCXPSKNFHP-GFCCVEGCSA-N 0 0 353.378 3.965 20 5 FHBDRN CCOc1ccc([C@H](C)NCc2ccc([N+](=O)[O-])cc2OC)cc1OC ZINC000430215428 928188794 /nfs/dbraw/zinc/18/87/94/928188794.db2.gz GZGXUBCLKGIVAE-ZDUSSCGKSA-N 0 0 360.410 3.862 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1CN[C@H](C)c1nc(C2CCCCC2)no1 ZINC000430214792 928197166 /nfs/dbraw/zinc/19/71/66/928197166.db2.gz FHDKGYQWQFISBN-GFCCVEGCSA-N 0 0 360.414 3.885 20 5 FHBDRN COc1ccc([C@H]2CCCN2Cc2ccc([N+](=O)[O-])cc2OC)c(OC)c1 ZINC000430217048 928227839 /nfs/dbraw/zinc/22/78/39/928227839.db2.gz GFOJLZUVBMQLCJ-GOSISDBHSA-N 0 0 372.421 3.958 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])c1csc(-c2ccc(F)cc2)n1 ZINC000097427460 928252692 /nfs/dbraw/zinc/25/26/92/928252692.db2.gz RFWQXKYINLGXCA-UHFFFAOYSA-N 0 0 357.366 3.787 20 5 FHBDRN CN(Cc1ccc([S@@](C)=O)cc1)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000154149093 928254884 /nfs/dbraw/zinc/25/48/84/928254884.db2.gz OCAIHEITCYXCCY-QHCPKHFHSA-N 0 0 352.843 3.618 20 5 FHBDRN CC[C@@](C)(NC(=O)CSc1ccc([N+](=O)[O-])cc1)c1nccs1 ZINC000154149787 928255519 /nfs/dbraw/zinc/25/55/19/928255519.db2.gz OESBVXRFWVPOAN-OAHLLOKOSA-N 0 0 351.453 3.585 20 5 FHBDRN CCOc1ccc2nc(NC(=O)Cc3cccc([N+](=O)[O-])c3)sc2c1 ZINC000610220288 928274843 /nfs/dbraw/zinc/27/48/43/928274843.db2.gz UOWBZKRSEZLGBW-UHFFFAOYSA-N 0 0 357.391 3.784 20 5 FHBDRN CCc1c(C(=O)Oc2cccc([N+](=O)[O-])c2C)cnn1Cc1ccccc1 ZINC001125297300 928332485 /nfs/dbraw/zinc/33/24/85/928332485.db2.gz LFNJZDZXHUHSMG-UHFFFAOYSA-N 0 0 365.389 3.930 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)Nc1nc(-c2cccnc2)cs1 ZINC000126962773 928347296 /nfs/dbraw/zinc/34/72/96/928347296.db2.gz OSRBGCDDEAJAED-UHFFFAOYSA-N 0 0 372.431 3.844 20 5 FHBDRN COc1ccc(S(=O)(=O)Oc2ccc([N+](=O)[O-])cc2Cl)c(C)c1C ZINC000097575841 928370385 /nfs/dbraw/zinc/37/03/85/928370385.db2.gz WKUDDMDJRRBITP-UHFFFAOYSA-N 0 0 371.798 3.641 20 5 FHBDRN O=[N+]([O-])c1ncccc1Oc1cc(C(F)(F)F)nc(-c2ccncc2)n1 ZINC000097600734 928380348 /nfs/dbraw/zinc/38/03/48/928380348.db2.gz DHNOXUQFBIRBCH-UHFFFAOYSA-N 0 0 363.255 3.653 20 5 FHBDRN CCc1ccc(C(=O)Nc2cnc(-c3cccc(O)c3)nc2)cc1[N+](=O)[O-] ZINC000175339042 928392747 /nfs/dbraw/zinc/39/27/47/928392747.db2.gz FJNFWJKZVSDFHD-UHFFFAOYSA-N 0 0 364.361 3.572 20 5 FHBDRN Cc1c(CC(=O)N(C)Cc2nc(C(F)(F)F)cs2)cccc1[N+](=O)[O-] ZINC000127038014 928422659 /nfs/dbraw/zinc/42/26/59/928422659.db2.gz OVQAFWDQXKSYNF-UHFFFAOYSA-N 0 0 373.356 3.580 20 5 FHBDRN CCc1noc2ncc(C(=O)OCCSc3ccc([N+](=O)[O-])cc3)cc12 ZINC000784941172 928427911 /nfs/dbraw/zinc/42/79/11/928427911.db2.gz ZSKMVANVYMTMHO-UHFFFAOYSA-N 0 0 373.390 3.643 20 5 FHBDRN COc1cc(CN(Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc(OC)c1OC ZINC000127056118 928456684 /nfs/dbraw/zinc/45/66/84/928456684.db2.gz ROMIFWLKMPAOSB-UHFFFAOYSA-N 0 0 372.421 3.785 20 5 FHBDRN CN(C(=O)c1ccc([N+](=O)[O-])o1)c1ccc(Br)cc1Cl ZINC000097712524 928495140 /nfs/dbraw/zinc/49/51/40/928495140.db2.gz FLBVYSAGQDHVMZ-UHFFFAOYSA-N 0 0 359.563 3.880 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCOc2c(C)cccc21 ZINC000588569177 937251888 /nfs/dbraw/zinc/25/18/88/937251888.db2.gz OKKRVTMFJSPUSD-RXXLQFRUSA-N 0 0 352.390 3.947 20 5 FHBDRN CC(C)(C)[C@@H](COc1ccccc1F)NC(=O)Cc1ccccc1[N+](=O)[O-] ZINC000261426481 928555606 /nfs/dbraw/zinc/55/56/06/928555606.db2.gz BMRAEVSLYGYIIR-GOSISDBHSA-N 0 0 374.412 3.886 20 5 FHBDRN O=C(Cc1ccoc1)Nc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1 ZINC000120478204 928558609 /nfs/dbraw/zinc/55/86/09/928558609.db2.gz XBSVEADDBQWQIQ-UHFFFAOYSA-N 0 0 350.330 3.600 20 5 FHBDRN CCOc1ccc([C@@H](C)Nc2ccc(C(N)=O)cc2[N+](=O)[O-])cc1OCC ZINC000015170031 928583315 /nfs/dbraw/zinc/58/33/15/928583315.db2.gz VJCVCTRNRLADNB-GFCCVEGCSA-N 0 0 373.409 3.664 20 5 FHBDRN COc1ccc(/C=C(/C)C(=O)OCc2ncc(C)c([N+](=O)[O-])c2C)cc1F ZINC000588570269 937261773 /nfs/dbraw/zinc/26/17/73/937261773.db2.gz ILLOBMVBDCCKOU-XFFZJAGNSA-N 0 0 374.368 3.901 20 5 FHBDRN COC(=O)/C=C\c1ccc(NCc2ccn(C3CCCC3)n2)c([N+](=O)[O-])c1 ZINC000254987377 928687718 /nfs/dbraw/zinc/68/77/18/928687718.db2.gz KALHSJIMKBEBQH-CLFYSBASSA-N 0 0 370.409 3.705 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(-c2ncon2)cc1 ZINC000608874449 928705189 /nfs/dbraw/zinc/70/51/89/928705189.db2.gz GLZPYDMAWIIWKB-LLVKDONJSA-N 0 0 370.390 3.764 20 5 FHBDRN CC[C@H](NC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1)[C@@H]1CCCCO1 ZINC000655350938 928764166 /nfs/dbraw/zinc/76/41/66/928764166.db2.gz UQFLYSCBKKJFFM-PXNSSMCTSA-N 0 0 364.445 3.759 20 5 FHBDRN CC[C@H](NC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1)[C@H]1CCCCO1 ZINC000655350937 928764640 /nfs/dbraw/zinc/76/46/40/928764640.db2.gz UQFLYSCBKKJFFM-FXAWDEMLSA-N 0 0 364.445 3.759 20 5 FHBDRN O=[N+]([O-])c1c(Cl)ccc2nc(N3CCO[C@H](C(F)(F)F)C3)ccc21 ZINC001167083966 928776051 /nfs/dbraw/zinc/77/60/51/928776051.db2.gz IZHHVUFOGUNTIA-NSHDSACASA-N 0 0 361.707 3.564 20 5 FHBDRN O=C(COC/C=C/c1ccccc1)Nc1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000120529499 928777850 /nfs/dbraw/zinc/77/78/50/928777850.db2.gz OMJMFRYFPOQZKF-QPJJXVBHSA-N 0 0 363.373 3.812 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1CN[C@@H]1CCc2cc(F)c(OC)cc21 ZINC000509426608 928894555 /nfs/dbraw/zinc/89/45/55/928894555.db2.gz SXPBRDAUZHWCQG-QGZVFWFLSA-N 0 0 360.385 3.918 20 5 FHBDRN O=C(N[C@H]1CC12CCCC2)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000430263151 928897508 /nfs/dbraw/zinc/89/75/08/928897508.db2.gz ZLEKFISFKJHWIC-ZDUSSCGKSA-N 0 0 358.316 3.598 20 5 FHBDRN Cc1cc(NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)nc2)ccc1[N+](=O)[O-] ZINC000052219370 937284708 /nfs/dbraw/zinc/28/47/08/937284708.db2.gz CKRMHXHBFKCTMF-HUUCEWRRSA-N 0 0 356.426 3.524 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1CCC[C@@H](c2ccccc2)CC1 ZINC000608981903 928940860 /nfs/dbraw/zinc/94/08/60/928940860.db2.gz UEITXEYHTILSLR-QGZVFWFLSA-N 0 0 374.462 3.862 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@H](C[C@@H](C)O)c1ccccc1 ZINC000162780077 937290310 /nfs/dbraw/zinc/29/03/10/937290310.db2.gz FBPNFOKVOJSDBB-ZBFHGGJFSA-N 0 0 357.410 3.579 20 5 FHBDRN Cc1c(NC(=O)c2cccc(NC(=O)[C@H]3C[C@@H]3C)c2)cccc1[N+](=O)[O-] ZINC000032660089 928968823 /nfs/dbraw/zinc/96/88/23/928968823.db2.gz RDUGXXHXPSSQLX-NHYWBVRUSA-N 0 0 353.378 3.750 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)N1CCC(OCC2CCCCC2)CC1 ZINC000610236971 928977126 /nfs/dbraw/zinc/97/71/26/928977126.db2.gz FFCVWQGUAWDBIF-UHFFFAOYSA-N 0 0 360.454 3.725 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)N[C@@H](C)Cc2ccsc2)cc1SC ZINC000609126732 928986096 /nfs/dbraw/zinc/98/60/96/928986096.db2.gz LLUIVQMVRPURGW-JTQLQIEISA-N 0 0 366.464 3.748 20 5 FHBDRN COc1ccc(CC(=O)N[C@H](CC2CC2)c2ccccc2)cc1[N+](=O)[O-] ZINC000610236489 929025627 /nfs/dbraw/zinc/02/56/27/929025627.db2.gz ZAKJUAAZNOFEJV-QGZVFWFLSA-N 0 0 354.406 3.804 20 5 FHBDRN C/C(=C/C(=O)NCc1cc([N+](=O)[O-])c(F)cc1F)c1ccc(F)cc1 ZINC001143376365 929037116 /nfs/dbraw/zinc/03/71/16/929037116.db2.gz ANWQJTVVYYMZJS-POHAHGRESA-N 0 0 350.296 3.732 20 5 FHBDRN CO[C@H](C)c1cccc(NC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)c1 ZINC000134581337 929070592 /nfs/dbraw/zinc/07/05/92/929070592.db2.gz JKAZUTDADAMILT-CYBMUJFWSA-N 0 0 366.377 3.740 20 5 FHBDRN Cc1c(NC(=O)N2CCCO[C@H](c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000609252606 929084435 /nfs/dbraw/zinc/08/44/35/929084435.db2.gz WMBWIFPCRZWXRO-SFHVURJKSA-N 0 0 355.394 3.899 20 5 FHBDRN O=C(Nc1ncc(Cc2ccc(F)cc2F)s1)c1ccc([N+](=O)[O-])[nH]1 ZINC000510139199 929106456 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366.483 3.984 20 5 FHBDRN CO[C@]1(C)C[C@@H](NC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)C1(C)C ZINC000547749406 929290856 /nfs/dbraw/zinc/29/08/56/929290856.db2.gz OFEHRDUWUATIEK-XMSQKQJNSA-N 0 0 364.445 3.615 20 5 FHBDRN CO[C@@]1(C)C[C@H](NC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)C1(C)C ZINC000547749403 929291101 /nfs/dbraw/zinc/29/11/01/929291101.db2.gz OFEHRDUWUATIEK-AVRDEDQJSA-N 0 0 364.445 3.615 20 5 FHBDRN Cc1cc(C(=O)Nc2ccc([N+](=O)[O-])c(C)c2)nn1-c1c(F)cccc1F ZINC000471226584 929299371 /nfs/dbraw/zinc/29/93/71/929299371.db2.gz DXZIAVNRNCAHJV-UHFFFAOYSA-N 0 0 372.331 3.928 20 5 FHBDRN Cc1cc([C@H]2CN(C(=O)c3cccc(C)c3[N+](=O)[O-])CCO2)ccc1F ZINC000134817231 929303937 /nfs/dbraw/zinc/30/39/37/929303937.db2.gz XNBHMSNLTKBMCT-QGZVFWFLSA-N 0 0 358.369 3.564 20 5 FHBDRN Cc1c2ccccc2n(C)c1CNC(=O)CSc1ccccc1[N+](=O)[O-] ZINC000471229036 929337251 /nfs/dbraw/zinc/33/72/51/929337251.db2.gz ZJDWXBORXNUOCN-UHFFFAOYSA-N 0 0 369.446 3.803 20 5 FHBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCC[C@H](c2ccncn2)C1 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Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CCc2sc(Cl)cc2C1 ZINC000583378965 937393309 /nfs/dbraw/zinc/39/33/09/937393309.db2.gz XHRDKCBXDXTXOA-UHFFFAOYSA-N 0 0 365.842 3.615 20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])N[C@H]1CC[C@@H](c2ccc(F)cc2)C1 ZINC000471530656 930185485 /nfs/dbraw/zinc/18/54/85/930185485.db2.gz RQDSDVCOCBDIJR-WBVHZDCISA-N 0 0 371.412 3.988 20 5 FHBDRN CCN(CCc1nccs1)C(=O)c1c(C)cc(Cl)cc1[N+](=O)[O-] ZINC000275761738 930186244 /nfs/dbraw/zinc/18/62/44/930186244.db2.gz FVRPSQMIRARQTL-UHFFFAOYSA-N 0 0 353.831 3.718 20 5 FHBDRN CNC(=O)c1ccc(Sc2ccccc2Br)c([N+](=O)[O-])c1 ZINC000064905194 930194213 /nfs/dbraw/zinc/19/42/13/930194213.db2.gz CUXOGLANLGRDDJ-UHFFFAOYSA-N 0 0 367.224 3.868 20 5 FHBDRN Cc1cccc(C(C)C)c1NC(=O)Cn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000045021883 930197040 /nfs/dbraw/zinc/19/70/40/930197040.db2.gz MDLYXHVDQWSXJF-UHFFFAOYSA-N 0 0 369.377 3.573 20 5 FHBDRN CC(=O)Nc1cc(NC(=O)Cc2ccc(F)cc2[N+](=O)[O-])ccc1Cl ZINC001125416014 930207552 /nfs/dbraw/zinc/20/75/52/930207552.db2.gz YJOYSWLTUISXTA-UHFFFAOYSA-N 0 0 365.748 3.527 20 5 FHBDRN Cc1cc(COC(=O)c2cnc(F)c(Br)c2)ccc1[N+](=O)[O-] ZINC001266572643 930213018 /nfs/dbraw/zinc/21/30/18/930213018.db2.gz PZLAEGZSSLCELF-UHFFFAOYSA-N 0 0 369.146 3.557 20 5 FHBDRN CCCC(=O)Nc1cccc(CNc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c1 ZINC000052324661 937396334 /nfs/dbraw/zinc/39/63/34/937396334.db2.gz NPNGCRFPGALDMA-UHFFFAOYSA-N 0 0 358.354 3.854 20 5 FHBDRN COc1cc(C(=O)N[C@@H]2CC[C@H](c3ccc(F)cc3)C2)ccc1[N+](=O)[O-] ZINC000471535274 930225368 /nfs/dbraw/zinc/22/53/68/930225368.db2.gz DMVIDQLFCTVCSF-XJKSGUPXSA-N 0 0 358.369 3.809 20 5 FHBDRN Cc1cn(C(C)(C)C(=O)OCc2cccc([N+](=O)[O-])c2)nc1C(F)(F)F ZINC001125419260 930226158 /nfs/dbraw/zinc/22/61/58/930226158.db2.gz USEPQTACOHUWCB-UHFFFAOYSA-N 0 0 371.315 3.597 20 5 FHBDRN CC(C)Oc1cc(C(=O)OCc2cccc([N+](=O)[O-])c2)ccc1[N+](=O)[O-] ZINC001125419340 930226772 /nfs/dbraw/zinc/22/67/72/930226772.db2.gz YSDLWLYYXGKADP-UHFFFAOYSA-N 0 0 360.322 3.647 20 5 FHBDRN CCN(Cc1ccc(OC)c(OC)c1)C(=O)c1c(C)cccc1[N+](=O)[O-] ZINC000560883801 930239334 /nfs/dbraw/zinc/23/93/34/930239334.db2.gz NJPFVUNROMVFGU-UHFFFAOYSA-N 0 0 358.394 3.583 20 5 FHBDRN C[C@H]([C@H]1Cc2ccccc2O1)N(C)C(=O)CSc1ccccc1[N+](=O)[O-] ZINC000580120149 930269462 /nfs/dbraw/zinc/26/94/62/930269462.db2.gz WGQQAHGBQSAHQN-CXAGYDPISA-N 0 0 372.446 3.538 20 5 FHBDRN COC[C@H](CC(C)(C)C)NC(=O)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000655305886 930272048 /nfs/dbraw/zinc/27/20/48/930272048.db2.gz VPHMOGOEYFFTKO-AWEZNQCLSA-N 0 0 366.461 3.862 20 5 FHBDRN Cn1c(COc2ccccc2)nnc1S/C=C\c1ccc([N+](=O)[O-])o1 ZINC000255170741 930277350 /nfs/dbraw/zinc/27/73/50/930277350.db2.gz GOGXLNQIEVERRA-KTKRTIGZSA-N 0 0 358.379 3.658 20 5 FHBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)Nc1ccnn1Cc1ccc(F)cc1 ZINC000255172171 930288361 /nfs/dbraw/zinc/28/83/61/930288361.db2.gz VCYPQSVCGOQWEM-YHYXMXQVSA-N 0 0 366.352 3.631 20 5 FHBDRN Cc1c(NC(=O)N2CCC(Oc3ncccc3F)CC2)cccc1[N+](=O)[O-] ZINC000278234293 937401079 /nfs/dbraw/zinc/40/10/79/937401079.db2.gz VLWFIBDNMMAPBW-UHFFFAOYSA-N 0 0 374.372 3.513 20 5 FHBDRN COc1cc(C(=O)O[C@H](c2ccccc2)c2ccccn2)ccc1[N+](=O)[O-] ZINC000134154604 930317413 /nfs/dbraw/zinc/31/74/13/930317413.db2.gz SUKDOHLJZJFGFI-LJQANCHMSA-N 0 0 364.357 3.945 20 5 FHBDRN C[C@@H]1CN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C[C@H](C(F)(F)F)O1 ZINC000610398570 930362499 /nfs/dbraw/zinc/36/24/99/930362499.db2.gz KMJOWOOMPXBFQF-AMIZOPFISA-N 0 0 374.340 3.601 20 5 FHBDRN C[C@H]1CN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C[C@@H](C(F)(F)F)O1 ZINC000610398573 930362570 /nfs/dbraw/zinc/36/25/70/930362570.db2.gz KMJOWOOMPXBFQF-SDBXPKJASA-N 0 0 374.340 3.601 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1F)c1cc(Br)cnc1Cl ZINC000050045737 930381028 /nfs/dbraw/zinc/38/10/28/930381028.db2.gz SZGJEJJSTIAICR-UHFFFAOYSA-N 0 0 374.553 3.797 20 5 FHBDRN COC(=O)/C=C\c1ccc(N[C@@H]2COc3c2ccc(C)c3C)c([N+](=O)[O-])c1 ZINC000728287600 930386840 /nfs/dbraw/zinc/38/68/40/930386840.db2.gz RQADSTLESZDVLU-UXHZXRBQSA-N 0 0 368.389 3.943 20 5 FHBDRN O=C(NC[C@H]1COc2ccccc21)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000580253669 930407697 /nfs/dbraw/zinc/40/76/97/930407697.db2.gz ICTCNDBZMDMASY-HNNXBMFYSA-N 0 0 370.408 3.587 20 5 FHBDRN COc1ccc(C[C@@H](C)Nc2cc(OC)c(F)cc2[N+](=O)[O-])cc1OC ZINC000580254980 930407928 /nfs/dbraw/zinc/40/79/28/930407928.db2.gz PMGLMBBWQRJRRH-LLVKDONJSA-N 0 0 364.373 3.803 20 5 FHBDRN O=C(N[C@H](CCO)c1ccc(Cl)cc1)c1c[nH]c2ccc([N+](=O)[O-])cc21 ZINC000579514442 930424444 /nfs/dbraw/zinc/42/44/44/930424444.db2.gz BYHWIZMISJPSOX-MRXNPFEDSA-N 0 0 373.796 3.583 20 5 FHBDRN C[C@@H](NC(=O)Nc1nnc(-c2ccco2)s1)c1cccc([N+](=O)[O-])c1 ZINC000047785896 930456087 /nfs/dbraw/zinc/45/60/87/930456087.db2.gz LGCHPSMJVPDLQV-SECBINFHSA-N 0 0 359.367 3.589 20 5 FHBDRN Cc1ccc(NCCCNC(=O)Nc2cc(F)cc(F)c2)c([N+](=O)[O-])c1 ZINC000610092719 930459742 /nfs/dbraw/zinc/45/97/42/930459742.db2.gz RVOUDGRRTSFRED-UHFFFAOYSA-N 0 0 364.352 3.805 20 5 FHBDRN C[C@H]1CN(C(=O)c2cc(F)cc3c(=O)c4cc(F)ccc4[nH]c23)CCCO1 ZINC000275817506 930468910 /nfs/dbraw/zinc/46/89/10/930468910.db2.gz MFWWAPPYMRDBBU-NSHDSACASA-N 0 0 372.371 3.623 20 5 FHBDRN C[C@@H]1CN(C(=O)c2cc(F)cc3c(=O)c4cc(F)ccc4[nH]c23)CCCO1 ZINC000275817493 930469173 /nfs/dbraw/zinc/46/91/73/930469173.db2.gz MFWWAPPYMRDBBU-LLVKDONJSA-N 0 0 372.371 3.623 20 5 FHBDRN C[C@@H](OC(=O)c1cc(F)c(F)cc1[N+](=O)[O-])c1nc2ccccc2n1C ZINC000175931489 930492200 /nfs/dbraw/zinc/49/22/00/930492200.db2.gz BPRMFUWZPGUBIF-SECBINFHSA-N 0 0 361.304 3.678 20 5 FHBDRN CN(CCC(F)(F)F)C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000064935317 930504957 /nfs/dbraw/zinc/50/49/57/930504957.db2.gz UPTKHAOAOHZSTE-UHFFFAOYSA-N 0 0 359.329 3.743 20 5 FHBDRN Cc1ccc(OC[C@H](O)COc2ccc(Cl)cc2[N+](=O)[O-])c(C)c1 ZINC000561050493 930506558 /nfs/dbraw/zinc/50/65/58/930506558.db2.gz QPAQJWNKCSWHON-AWEZNQCLSA-N 0 0 351.786 3.684 20 5 FHBDRN C[C@H](COc1cccc(F)c1)NC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000050153177 930514405 /nfs/dbraw/zinc/51/44/05/930514405.db2.gz PGIDFEHYIUYSFA-OLZOCXBDSA-N 0 0 361.373 3.562 20 5 FHBDRN CC(C)CCSc1ccc(C(=O)N[C@H](C)C(C)(C)O)cc1[N+](=O)[O-] ZINC000610430261 930520109 /nfs/dbraw/zinc/52/01/09/930520109.db2.gz KDSKMOHXGOXWSW-GFCCVEGCSA-N 0 0 354.472 3.622 20 5 FHBDRN COc1ccc(NC(=O)c2sc(C(C)(C)OC)nc2C)cc1[N+](=O)[O-] ZINC000583412634 937420086 /nfs/dbraw/zinc/42/00/86/937420086.db2.gz NVTQVWKPWCMKBN-UHFFFAOYSA-N 0 0 365.411 3.502 20 5 FHBDRN Cn1cc(CNc2ccc([N+](=O)[O-])c3cnccc23)c(C(F)(F)F)n1 ZINC000119030000 930542661 /nfs/dbraw/zinc/54/26/61/930542661.db2.gz WFAHPHBLVAXZMG-UHFFFAOYSA-N 0 0 351.288 3.507 20 5 FHBDRN CCOc1cc(NC(=O)N2C[C@@H]3CCC[C@H]3C2)c([N+](=O)[O-])cc1OCC ZINC000119041563 930557901 /nfs/dbraw/zinc/55/79/01/930557901.db2.gz GTQISEQACRFLHM-STQMWFEESA-N 0 0 363.414 3.656 20 5 FHBDRN CCOc1ccc(C2=CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000091930395 930571981 /nfs/dbraw/zinc/57/19/81/930571981.db2.gz ILGSBWUMTFDVOT-UHFFFAOYSA-N 0 0 352.390 3.923 20 5 FHBDRN C[C@H](NC(=O)N1CCC(C2CCOCC2)CC1)c1ccccc1[N+](=O)[O-] ZINC000561083547 930592505 /nfs/dbraw/zinc/59/25/05/930592505.db2.gz DTOJXVJVLPHQPF-AWEZNQCLSA-N 0 0 361.442 3.504 20 5 FHBDRN O=C(NC1(c2cccc(Br)c2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000610118697 930613911 /nfs/dbraw/zinc/61/39/11/930613911.db2.gz BCNZMQFAMCBQIT-UHFFFAOYSA-N 0 0 361.195 3.776 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])N(C1CC1)[C@@H]1CCc2ccccc21 ZINC000109897420 930622489 /nfs/dbraw/zinc/62/24/89/930622489.db2.gz QCTVAHSZGRUKLW-GOSISDBHSA-N 0 0 351.406 3.685 20 5 FHBDRN Cc1cc(F)ccc1Cc1noc(-c2n[nH]c3ccc([N+](=O)[O-])cc32)n1 ZINC000580398611 930624573 /nfs/dbraw/zinc/62/45/73/930624573.db2.gz UZDACDDMECJZEZ-UHFFFAOYSA-N 0 0 353.313 3.559 20 5 FHBDRN O=C(COc1cccc([N+](=O)[O-])c1)Nc1cccc(NC2CCCC2)c1 ZINC000109898304 930626805 /nfs/dbraw/zinc/62/68/05/930626805.db2.gz PLAMHJNZYRYPPT-UHFFFAOYSA-N 0 0 355.394 3.967 20 5 FHBDRN COc1ncc(-n2c3ccccc3cc3c(=O)c(N)ccc2-3)cc1Cl ZINC001211049143 930635743 /nfs/dbraw/zinc/63/57/43/930635743.db2.gz GAIISGIQZFASPM-UHFFFAOYSA-N 0 0 351.793 3.735 20 5 FHBDRN Cc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2N)ccc1Br ZINC000050212624 930636661 /nfs/dbraw/zinc/63/66/61/930636661.db2.gz OLAJDPLPINZTBO-UHFFFAOYSA-N 0 0 350.172 3.500 20 5 FHBDRN CCC(CC)[C@@H]1C[C@H](NC(=O)c2cc(F)c([N+](=O)[O-])cc2F)CCO1 ZINC000155740989 930659541 /nfs/dbraw/zinc/65/95/41/930659541.db2.gz DOAWVISVTXPRFA-BZNIZROVSA-N 0 0 356.369 3.587 20 5 FHBDRN O=C(Nc1ccc(-n2ccnc2)c(F)c1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000119101444 930661112 /nfs/dbraw/zinc/66/11/12/930661112.db2.gz SLVRLPKRMRLJPJ-UHFFFAOYSA-N 0 0 360.732 3.825 20 5 FHBDRN COc1ccc([C@@H](C)NCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)cc1 ZINC000537027182 930771502 /nfs/dbraw/zinc/77/15/02/930771502.db2.gz LVMYCQPNYMNMFP-GFCCVEGCSA-N 0 0 354.366 3.504 20 5 FHBDRN COC[C@@H](NC(=O)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12)C1CC1 ZINC000275907054 930825589 /nfs/dbraw/zinc/82/55/89/930825589.db2.gz CVBKJRDTMRZNFP-QGZVFWFLSA-N 0 0 372.371 3.527 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000050292841 930828500 /nfs/dbraw/zinc/82/85/00/930828500.db2.gz IZZIZSZUMNEWCW-UHFFFAOYSA-N 0 0 370.346 3.879 20 5 FHBDRN C[C@H]1CO[C@H](c2ccccc2)CN1C(=O)c1cccc(Cl)c1[N+](=O)[O-] ZINC000175820777 930831358 /nfs/dbraw/zinc/83/13/58/930831358.db2.gz ZMPJCURJBWVFKS-LRDDRELGSA-N 0 0 360.797 3.850 20 5 FHBDRN CCc1nc2ccc(Cl)cn2c1C(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000071448739 930903785 /nfs/dbraw/zinc/90/37/85/930903785.db2.gz IEQRBNVDFFHPBA-UHFFFAOYSA-N 0 0 374.784 3.719 20 5 FHBDRN C[C@H](Cc1ccsc1)Nc1cc(CN2CCOCC2)ccc1[N+](=O)[O-] ZINC000580694579 931022969 /nfs/dbraw/zinc/02/29/69/931022969.db2.gz YTIJUIPUKBGPTF-CQSZACIVSA-N 0 0 361.467 3.532 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)NCCCc1ccc(Cl)cc1Cl ZINC000471612898 931040598 /nfs/dbraw/zinc/04/05/98/931040598.db2.gz VAAFNTSHLNEASE-UHFFFAOYSA-N 0 0 368.220 3.968 20 5 FHBDRN O=C(N[C@H](Cn1cccn1)c1ccccc1)c1ccc([N+](=O)[O-])cc1Cl ZINC000610154861 931046290 /nfs/dbraw/zinc/04/62/90/931046290.db2.gz NHGOXDZEEVPSMY-QGZVFWFLSA-N 0 0 370.796 3.616 20 5 FHBDRN CC(=O)c1ccc(N[C@H](Cn2cccn2)c2ccccc2)c([N+](=O)[O-])c1 ZINC000610160565 931077798 /nfs/dbraw/zinc/07/77/98/931077798.db2.gz YDAQMRSIXPODBY-GOSISDBHSA-N 0 0 350.378 3.847 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H](COC)c1ccc(F)cc1 ZINC000580744306 931091824 /nfs/dbraw/zinc/09/18/24/931091824.db2.gz LEOGQVVZYGTHBQ-KRWDZBQOSA-N 0 0 361.373 3.806 20 5 FHBDRN CC1(C)C[C@H](NC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)CCO1 ZINC000275966762 931107903 /nfs/dbraw/zinc/10/79/03/931107903.db2.gz NBQLYGICUCIWFG-CQSZACIVSA-N 0 0 350.418 3.781 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)NCC2([C@H](O)c3ccccc3)CC2)c1 ZINC000155836518 931107960 /nfs/dbraw/zinc/10/79/60/931107960.db2.gz NCMNPNHCPYZMLI-QGZVFWFLSA-N 0 0 372.446 3.560 20 5 FHBDRN C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C(=O)O[C@@H](c1cccnc1)c1ccccc1[N+](=O)[O-] ZINC001266649739 931136476 /nfs/dbraw/zinc/13/64/76/931136476.db2.gz SWYLVYWQQXBMDN-UELOOKOOSA-N 0 0 352.390 3.915 20 5 FHBDRN CCC(=O)c1cccc(N[C@@H](C)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])c1 ZINC000135067641 931164026 /nfs/dbraw/zinc/16/40/26/931164026.db2.gz NECMXZSGYSRMOT-LBPRGKRZSA-N 0 0 371.393 3.635 20 5 FHBDRN CC(C)Nc1ccc([N+](=O)[O-])cc1NCc1cc(Br)no1 ZINC000834645714 931180722 /nfs/dbraw/zinc/18/07/22/931180722.db2.gz JQZFCCUEXSQQSU-UHFFFAOYSA-N 0 0 355.192 3.778 20 5 FHBDRN CC(C)(NC(=O)Cc1ccc([N+](=O)[O-])cc1)c1cccc(Cl)c1F ZINC000471618648 931183240 /nfs/dbraw/zinc/18/32/40/931183240.db2.gz BYBWNABAYBWKCC-UHFFFAOYSA-N 0 0 350.777 3.981 20 5 FHBDRN COc1ccc(CNC(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1F ZINC000175867161 931203028 /nfs/dbraw/zinc/20/30/28/931203028.db2.gz DRZOMZUWYONFJJ-LBPRGKRZSA-N 0 0 361.373 3.611 20 5 FHBDRN CSc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC[C@H]([C@@H]2CCOC2)C1 ZINC000891326884 931212658 /nfs/dbraw/zinc/21/26/58/931212658.db2.gz WHGMHPFXZIVNPT-UONOGXRCSA-N 0 0 364.467 3.596 20 5 FHBDRN O=C(c1cccc([N+](=O)[O-])c1Cl)N1CCCC[C@@H]([C@@H]2CCOC2)C1 ZINC000891327851 931216487 /nfs/dbraw/zinc/21/64/87/931216487.db2.gz HWMMGKHNUDDKCL-CHWSQXEVSA-N 0 0 352.818 3.527 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2noc(Cc3ccc(Br)cc3)n2)c1 ZINC000013921210 931260281 /nfs/dbraw/zinc/26/02/81/931260281.db2.gz XFQJVRDKRJZHHZ-UHFFFAOYSA-N 0 0 360.167 3.998 20 5 FHBDRN O=C(c1ccc2ccc(Cl)cc2n1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000084073572 931268285 /nfs/dbraw/zinc/26/82/85/931268285.db2.gz WQYQEYUSMXPGNQ-UHFFFAOYSA-N 0 0 353.765 3.999 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)c2c(F)c(F)cc(F)c2F)cc1[N+](=O)[O-] ZINC000177852672 931294476 /nfs/dbraw/zinc/29/44/76/931294476.db2.gz KRVLYVJATDRKHY-MRVPVSSYSA-N 0 0 356.275 3.951 20 5 FHBDRN O=C(c1cc2cc([N+](=O)[O-])ccc2o1)N1CCCC[C@H]([C@H]2CCOC2)C1 ZINC000891337748 931300947 /nfs/dbraw/zinc/30/09/47/931300947.db2.gz TWHFIFXMARSAEW-KBPBESRZSA-N 0 0 358.394 3.620 20 5 FHBDRN COc1ccc(SCC(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000177855002 931324314 /nfs/dbraw/zinc/32/43/14/931324314.db2.gz HCZWVQJRDFLIIK-CYBMUJFWSA-N 0 0 360.435 3.881 20 5 FHBDRN CCc1nc2c(s1)[C@@H](N(C)C(=O)NCc1cccc([N+](=O)[O-])c1)CCC2 ZINC000177859699 931330528 /nfs/dbraw/zinc/33/05/28/931330528.db2.gz HSZLACWXNNHDSB-HNNXBMFYSA-N 0 0 374.466 3.833 20 5 FHBDRN C[C@@H]1CCN(C(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)[C@H](c2ccco2)C1 ZINC000182255708 931368818 /nfs/dbraw/zinc/36/88/18/931368818.db2.gz KFKYPWWTNYXAMV-YPMHNXCESA-N 0 0 358.350 3.530 20 5 FHBDRN Cc1oc(-c2cccs2)nc1CSCc1c([N+](=O)[O-])ncn1C ZINC000476997043 931374956 /nfs/dbraw/zinc/37/49/56/931374956.db2.gz AWHFOFXVBJLFEQ-UHFFFAOYSA-N 0 0 350.425 3.787 20 5 FHBDRN O=C(C[C@@H](c1ccc(O)cc1)C1CC1)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000580938694 931379892 /nfs/dbraw/zinc/37/98/92/931379892.db2.gz QCHAGROHTDODSR-LJQANCHMSA-N 0 0 366.417 3.769 20 5 FHBDRN CCCNC(=O)c1cccc(C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000177863013 931387245 /nfs/dbraw/zinc/38/72/45/931387245.db2.gz GAMBJHWAJVECSF-AWEZNQCLSA-N 0 0 369.421 3.534 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)c2ccc(Br)cn2)cc1[N+](=O)[O-] ZINC000177865868 931389717 /nfs/dbraw/zinc/38/97/17/931389717.db2.gz AEZPNJGRAAIKBR-JTQLQIEISA-N 0 0 364.199 3.552 20 5 FHBDRN Cn1cnc([N+](=O)[O-])c1CSCc1csc(Cc2ccccc2)n1 ZINC000477012308 931389863 /nfs/dbraw/zinc/38/98/63/931389863.db2.gz OUSWGHOCXCGFIB-UHFFFAOYSA-N 0 0 360.464 3.809 20 5 FHBDRN CC(=O)Nc1cc(C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)ccc1C ZINC000177865623 931390020 /nfs/dbraw/zinc/39/00/20/931390020.db2.gz YNTNWLPDZAZDOU-CYBMUJFWSA-N 0 0 355.394 3.661 20 5 FHBDRN CSc1ncc(Cl)c(C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)n1 ZINC000177872092 931393955 /nfs/dbraw/zinc/39/39/55/931393955.db2.gz XMWHDCUAKBKNPP-SECBINFHSA-N 0 0 366.830 3.560 20 5 FHBDRN Cc1cc(F)cc(C(=O)Nc2ccc(N3CCO[C@@H](C)C3)cc2)c1[N+](=O)[O-] ZINC000156747350 931405861 /nfs/dbraw/zinc/40/58/61/931405861.db2.gz WFMGQSPAJWDDQO-ZDUSSCGKSA-N 0 0 373.384 3.520 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)[C@@H](C)Cn1ncc2ccccc21 ZINC000561288468 931421281 /nfs/dbraw/zinc/42/12/81/931421281.db2.gz MYPVYNBGGNGNCA-AWEZNQCLSA-N 0 0 352.394 3.836 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)[C@@H]2C[C@@]23CCc2ccccc23)cc1[N+](=O)[O-] ZINC000177876576 931430929 /nfs/dbraw/zinc/43/09/29/931430929.db2.gz PXYNLUBYQFZEQC-DHUIEDIVSA-N 0 0 350.418 3.985 20 5 FHBDRN O=C(NC[C@H]1CC[C@H](c2ccccc2)O1)Nc1ccc([N+](=O)[O-])cc1F ZINC000580975481 931442808 /nfs/dbraw/zinc/44/28/08/931442808.db2.gz WAWFGAJEXNYKKR-RHSMWYFYSA-N 0 0 359.357 3.776 20 5 FHBDRN Nc1cc([N+](=O)[O-])ccc1C(=O)OCc1ccccc1Oc1cccnc1 ZINC000728313828 931445509 /nfs/dbraw/zinc/44/55/09/931445509.db2.gz JVXLWGACQSWEOH-UHFFFAOYSA-N 0 0 365.345 3.721 20 5 FHBDRN C[C@](CO)(NCc1ccc([N+](=O)[O-])cc1F)c1cccc(C(F)(F)F)c1 ZINC000610476371 931540793 /nfs/dbraw/zinc/54/07/93/931540793.db2.gz AZOUFKAQAHFOBP-MRXNPFEDSA-N 0 0 372.318 3.750 20 5 FHBDRN CC[C@@H](CNC(=O)c1cc(F)c(F)cc1[N+](=O)[O-])Oc1cccc(C)c1 ZINC000175976022 931551707 /nfs/dbraw/zinc/55/17/07/931551707.db2.gz HTCQLLSFZVMCRA-LBPRGKRZSA-N 0 0 364.348 3.769 20 5 FHBDRN Cc1cnc([C@@H](C)NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)s1 ZINC000177904302 931552409 /nfs/dbraw/zinc/55/24/09/931552409.db2.gz FXTRLSGIQGZNPW-CYBMUJFWSA-N 0 0 374.466 3.841 20 5 FHBDRN C[C@]1(c2ccccc2)CN(C(=O)c2ccc(Cl)cc2[N+](=O)[O-])CCO1 ZINC000156815823 931559095 /nfs/dbraw/zinc/55/90/95/931559095.db2.gz NAOBEBMRKKPEHJ-GOSISDBHSA-N 0 0 360.797 3.636 20 5 FHBDRN COc1ccccc1[C@@H](CNC(=O)c1ccc(C)c([N+](=O)[O-])c1)OC(C)C ZINC000187389984 931593690 /nfs/dbraw/zinc/59/36/90/931593690.db2.gz RELVFDUOZPSBKN-LJQANCHMSA-N 0 0 372.421 3.808 20 5 FHBDRN Cc1ccc2c(c1)nc(CNC(=O)c1c(C)cc(C)c([N+](=O)[O-])c1C)n2C ZINC000187398059 931607194 /nfs/dbraw/zinc/60/71/94/931607194.db2.gz YFPIGYATDLFRIC-UHFFFAOYSA-N 0 0 366.421 3.645 20 5 FHBDRN CCOc1ccc(C(=O)NCCc2c[nH]c3cc(F)ccc23)cc1[N+](=O)[O-] ZINC000050767330 931608959 /nfs/dbraw/zinc/60/89/59/931608959.db2.gz LAKFVYRZNHBUFB-UHFFFAOYSA-N 0 0 371.368 3.586 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N[C@@H]1CCOc2c(Cl)cccc21 ZINC000087173092 931647070 /nfs/dbraw/zinc/64/70/70/931647070.db2.gz WKKCWMSSXSPPAP-MRXNPFEDSA-N 0 0 360.797 3.821 20 5 FHBDRN Cc1cccc(O[C@H](C)CNC(=O)C(C)(C)c2ccccc2[N+](=O)[O-])c1 ZINC000581181799 931648046 /nfs/dbraw/zinc/64/80/46/931648046.db2.gz ODIZQIJZQJPLMV-OAHLLOKOSA-N 0 0 356.422 3.765 20 5 FHBDRN O=C(OCc1ccc(Cl)nc1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000175982889 931687675 /nfs/dbraw/zinc/68/76/75/931687675.db2.gz MAVXAUZDACPPTI-UHFFFAOYSA-N 0 0 371.574 3.763 20 5 FHBDRN Cc1cc(OCC(=O)N[C@@H]2CCC[C@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000430539413 931705199 /nfs/dbraw/zinc/70/51/99/931705199.db2.gz DVGIIMBQZDHISU-ZWKOTPCHSA-N 0 0 354.406 3.735 20 5 FHBDRN O=C(NCc1ccc(OC(F)F)cc1)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000048315690 931736609 /nfs/dbraw/zinc/73/66/09/931736609.db2.gz VMUIXNOWNXUQFO-UHFFFAOYSA-N 0 0 361.304 3.608 20 5 FHBDRN C[C@@H](CC(=O)c1ccc(F)cc1)NC(=O)C=Cc1ccc([N+](=O)[O-])cc1 ZINC000255283682 931736761 /nfs/dbraw/zinc/73/67/61/931736761.db2.gz PHWOTDADVVDVLA-KPVYPLCOSA-N 0 0 356.353 3.525 20 5 FHBDRN C[C@@H](OCCCNC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)c1ccccc1 ZINC000048316996 931739883 /nfs/dbraw/zinc/73/98/83/931739883.db2.gz ITMYLOZNYQNBES-CQSZACIVSA-N 0 0 367.405 3.974 20 5 FHBDRN CCOC(=O)c1cccc(SCc2nc3cc([N+](=O)[O-])ccc3[nH]2)c1 ZINC000477052456 931741840 /nfs/dbraw/zinc/74/18/40/931741840.db2.gz TWXXXUJFOWFPQM-UHFFFAOYSA-N 0 0 357.391 3.940 20 5 FHBDRN CC(C)Oc1cccc([C@H](C)NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)c1 ZINC000048323463 931754970 /nfs/dbraw/zinc/75/49/70/931754970.db2.gz CVRCOZPBUDCREF-NSHDSACASA-N 0 0 361.373 3.594 20 5 FHBDRN CC(C)[C@H]1CCCCCN1C(=O)c1ccc2c(c1[N+](=O)[O-])OCCCO2 ZINC001266691114 931763658 /nfs/dbraw/zinc/76/36/58/931763658.db2.gz HUQZDCATJIHCHN-OAHLLOKOSA-N 0 0 362.426 3.797 20 5 FHBDRN CC(C)[C@@H]1CCCCCN1C(=O)c1ccc2c(c1[N+](=O)[O-])OCCCO2 ZINC001266691113 931763814 /nfs/dbraw/zinc/76/38/14/931763814.db2.gz HUQZDCATJIHCHN-HNNXBMFYSA-N 0 0 362.426 3.797 20 5 FHBDRN CC[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2SCC(C)C)CCO1 ZINC000134422203 931764496 /nfs/dbraw/zinc/76/44/96/931764496.db2.gz SHWSZYXSJBCJTD-CQSZACIVSA-N 0 0 352.456 3.594 20 5 FHBDRN Cc1c(NC(=O)Cc2ccc(OC(F)(F)F)cc2)cccc1[N+](=O)[O-] ZINC000042391474 931772859 /nfs/dbraw/zinc/77/28/59/931772859.db2.gz LCEIGIOGIFCYLW-UHFFFAOYSA-N 0 0 354.284 3.983 20 5 FHBDRN CC(C)(NC(=O)c1cc(-c2ccccc2)no1)c1ccc([N+](=O)[O-])cc1 ZINC000430550425 931797119 /nfs/dbraw/zinc/79/71/19/931797119.db2.gz OOTLBOCOGZTCPM-UHFFFAOYSA-N 0 0 351.362 3.915 20 5 FHBDRN CC(C)(NC(=O)CCCOc1cccc(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000430553854 931806913 /nfs/dbraw/zinc/80/69/13/931806913.db2.gz PPKJCFORCNMHKA-UHFFFAOYSA-N 0 0 360.385 3.944 20 5 FHBDRN O=C(Nc1ncc(Cl)s1)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000610492629 931810086 /nfs/dbraw/zinc/81/00/86/931810086.db2.gz JPAGLJHWIYGADO-UHFFFAOYSA-N 0 0 351.693 3.976 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N1CCCCC[C@@H]1[C@@H]1CCCCC1=O ZINC000126459260 931836889 /nfs/dbraw/zinc/83/68/89/931836889.db2.gz HCPGFVASXDGELN-ZWKOTPCHSA-N 0 0 374.437 3.504 20 5 FHBDRN Cc1cc(OCC(=O)NC2(c3ccc(Cl)cc3)CC2)ccc1[N+](=O)[O-] ZINC000430564591 931880430 /nfs/dbraw/zinc/88/04/30/931880430.db2.gz MHSMITUNXOEULN-UHFFFAOYSA-N 0 0 360.797 3.741 20 5 FHBDRN Cc1cc(OCC(=O)N[C@H](c2ccccc2)C2CCC2)ccc1[N+](=O)[O-] ZINC000430571981 931908492 /nfs/dbraw/zinc/90/84/92/931908492.db2.gz OULYFQYYJXMODN-HXUWFJFHSA-N 0 0 354.406 3.940 20 5 FHBDRN CCOc1ccc(NC(=O)CNc2ccc(C(C)=O)c(C)c2)c([N+](=O)[O-])c1 ZINC000135098969 931925153 /nfs/dbraw/zinc/92/51/53/931925153.db2.gz NPUIECBOIXQEQX-UHFFFAOYSA-N 0 0 371.393 3.555 20 5 FHBDRN Cc1cc2c(s1)N(c1ncc([N+](=O)[O-])cn1)c1ccccc1NC2=N ZINC001167456789 931932392 /nfs/dbraw/zinc/93/23/92/931932392.db2.gz LUWUYOMHLBPEHC-UHFFFAOYSA-N 0 0 352.379 3.575 20 5 FHBDRN C[C@@H](c1ccccc1F)N(C)C(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000135113456 931935099 /nfs/dbraw/zinc/93/50/99/931935099.db2.gz VEYZORRHYVTUMB-ZDUSSCGKSA-N 0 0 368.368 3.753 20 5 FHBDRN COc1cc(OCC(=O)N2CCCCC[C@@H]2c2ccco2)ccc1[N+](=O)[O-] ZINC000135136278 931958488 /nfs/dbraw/zinc/95/84/88/931958488.db2.gz HWPDTJWGYARRLQ-OAHLLOKOSA-N 0 0 374.393 3.719 20 5 FHBDRN C[C@H](NC(=O)NCC[C@@H]1CNc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000891380520 931969528 /nfs/dbraw/zinc/96/95/28/931969528.db2.gz CHLDIMSRAKVBRL-DZGCQCFKSA-N 0 0 354.410 3.554 20 5 FHBDRN CC(C)c1ccc(C(=O)O[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000003387090 931985964 /nfs/dbraw/zinc/98/59/64/931985964.db2.gz IUYJMZPEMWMNLO-CYBMUJFWSA-N 0 0 356.378 3.902 20 5 FHBDRN CC(C)c1ccc(C(=O)OCC(=O)Nc2cc([N+](=O)[O-])ccc2F)cc1 ZINC000003387386 931986890 /nfs/dbraw/zinc/98/68/90/931986890.db2.gz OMCKLFPYWZMGJP-UHFFFAOYSA-N 0 0 360.341 3.653 20 5 FHBDRN CCOC(CCNC(=O)c1cc2ccccc2c2cccnc12)OCC ZINC000276178969 932001467 /nfs/dbraw/zinc/00/14/67/932001467.db2.gz GZLPRBUJIAIOIA-UHFFFAOYSA-N 0 0 352.434 3.907 20 5 FHBDRN CC(C)(CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)c1cccc(F)c1 ZINC000135159904 932006048 /nfs/dbraw/zinc/00/60/48/932006048.db2.gz NZEFBOFFCALTII-UHFFFAOYSA-N 0 0 369.396 3.852 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2nnc(CN3CC[C@@H]3c3cccc(F)c3)o2)cc1 ZINC000610505075 932018303 /nfs/dbraw/zinc/01/83/03/932018303.db2.gz ZJQSZAIEKDAHHH-MRXNPFEDSA-N 0 0 354.341 3.731 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2nnc(CN3CC[C@H]3c3cccc(F)c3)o2)cc1 ZINC000610505074 932022624 /nfs/dbraw/zinc/02/26/24/932022624.db2.gz ZJQSZAIEKDAHHH-INIZCTEOSA-N 0 0 354.341 3.731 20 5 FHBDRN CCOc1ccc(NC(=O)CN2CC[C@@H]2c2cccc(F)c2)c([N+](=O)[O-])c1 ZINC000610505525 932026459 /nfs/dbraw/zinc/02/64/59/932026459.db2.gz NLFFYAIVFZIPBA-QGZVFWFLSA-N 0 0 373.384 3.518 20 5 FHBDRN COc1cc(OCC(=O)Oc2cc(C)ccc2Cl)ccc1[N+](=O)[O-] ZINC000121349249 932036393 /nfs/dbraw/zinc/03/63/93/932036393.db2.gz KAMGZNYIIDOXAJ-UHFFFAOYSA-N 0 0 351.742 3.550 20 5 FHBDRN CCc1ccc(CCNC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)cc1 ZINC000135208645 932049455 /nfs/dbraw/zinc/04/94/55/932049455.db2.gz MHAJLELBNABBOI-UHFFFAOYSA-N 0 0 351.406 3.540 20 5 FHBDRN CSc1cccc(NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])n1 ZINC000561376133 932054993 /nfs/dbraw/zinc/05/49/93/932054993.db2.gz YPSPBRBVPAKPAH-UHFFFAOYSA-N 0 0 357.313 3.983 20 5 FHBDRN COc1ccccc1Cc1nnc(SCc2ccc([N+](=O)[O-])cc2)o1 ZINC000066257964 932066639 /nfs/dbraw/zinc/06/66/39/932066639.db2.gz XWHXZQOKFVAHAF-UHFFFAOYSA-N 0 0 357.391 3.870 20 5 FHBDRN Cc1c(Br)c(NCCOc2ccccc2)ncc1[N+](=O)[O-] ZINC000165749403 932070669 /nfs/dbraw/zinc/07/06/69/932070669.db2.gz LCRRKCVHAKPRAN-UHFFFAOYSA-N 0 0 352.188 3.552 20 5 FHBDRN CC(C)CO[C@H](C)c1noc(CN(Cc2ccccc2[N+](=O)[O-])C2CC2)n1 ZINC000135232423 932076747 /nfs/dbraw/zinc/07/67/47/932076747.db2.gz UMFIRWZDPMWWAC-CQSZACIVSA-N 0 0 374.441 3.876 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)NCc2ccc(C3CCC3)cc2)cc1C ZINC001211514923 932123852 /nfs/dbraw/zinc/12/38/52/932123852.db2.gz CGYKPCBEAMRUGV-UHFFFAOYSA-N 0 0 374.462 3.958 20 5 FHBDRN COc1cc(F)c([C@H](C)NCc2ccc([N+](=O)[O-])c(F)c2)cc1OC ZINC000276295364 932147575 /nfs/dbraw/zinc/14/75/75/932147575.db2.gz IUJANRZQQXXFQO-JTQLQIEISA-N 0 0 352.337 3.741 20 5 FHBDRN COc1ccccc1[C@H](CNC(=O)c1cccc([N+](=O)[O-])c1C)OC(C)C ZINC000187415865 932158063 /nfs/dbraw/zinc/15/80/63/932158063.db2.gz ZOULSIPHNRYCJM-IBGZPJMESA-N 0 0 372.421 3.808 20 5 FHBDRN CS(=O)(=O)c1cc([N+](=O)[O-])ccc1N[C@H]1CCCc2sccc21 ZINC000276307901 932162754 /nfs/dbraw/zinc/16/27/54/932162754.db2.gz OAUQTISROYDDJS-LBPRGKRZSA-N 0 0 352.437 3.549 20 5 FHBDRN Cc1nnc([C@@H]2Cc3ccccc3CN2Cc2ccc([N+](=O)[O-])c(F)c2)o1 ZINC000276318041 932181466 /nfs/dbraw/zinc/18/14/66/932181466.db2.gz NYKFPSHFCDDTPU-SFHVURJKSA-N 0 0 368.368 3.725 20 5 FHBDRN COC(=O)c1cc(NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)c(C)cc1C ZINC000471671402 932240419 /nfs/dbraw/zinc/24/04/19/932240419.db2.gz WHILKFFYTHRVNO-UHFFFAOYSA-N 0 0 362.769 3.904 20 5 FHBDRN Cc1ccccc1Cc1nnc(CN(C)Cc2ccccc2[N+](=O)[O-])o1 ZINC000178058689 932243873 /nfs/dbraw/zinc/24/38/73/932243873.db2.gz ISOHJMLJPCPZOV-UHFFFAOYSA-N 0 0 352.394 3.509 20 5 FHBDRN CCCc1ccccc1NC(=O)C(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000178064931 932265703 /nfs/dbraw/zinc/26/57/03/932265703.db2.gz SCIJZJMRMDFWIS-AWEZNQCLSA-N 0 0 369.421 3.672 20 5 FHBDRN COc1cc(C)c(NC(=O)N2CCOc3ccc([N+](=O)[O-])cc3C2)cc1C ZINC000581577786 932269435 /nfs/dbraw/zinc/26/94/35/932269435.db2.gz URWPSPYUNYPKNV-UHFFFAOYSA-N 0 0 371.393 3.647 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N[C@@H](C)c1ccc2c(c1)CC(=O)N2 ZINC000276369165 932277921 /nfs/dbraw/zinc/27/79/21/932277921.db2.gz CIKINPUMXCUPNP-LBPRGKRZSA-N 0 0 368.393 3.589 20 5 FHBDRN COC(=O)c1cc(C(=O)N2CC(C)(C)[C@H]2c2cccs2)cc([N+](=O)[O-])c1 ZINC000581599917 932295555 /nfs/dbraw/zinc/29/55/55/932295555.db2.gz LLGFQOLRJXJABP-OAHLLOKOSA-N 0 0 374.418 3.666 20 5 FHBDRN Cc1ccc(CN(c2ccc(C(=O)NC(C)C)cc2[N+](=O)[O-])C2CC2)o1 ZINC000610514901 932328823 /nfs/dbraw/zinc/32/88/23/932328823.db2.gz MDQIQRQLWOMFEG-UHFFFAOYSA-N 0 0 357.410 3.803 20 5 FHBDRN Cc1ccn(C(=O)c2ccc([N+](=O)[O-])cc2C)c(=NC2CCCCC2)c1 ZINC000255335529 932352063 /nfs/dbraw/zinc/35/20/63/932352063.db2.gz QFKPBPHJTYXHFI-UHFFFAOYSA-N 0 0 353.422 3.935 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCCC[C@H]1CCCC[C@@H]1O ZINC000134568064 932359371 /nfs/dbraw/zinc/35/93/71/932359371.db2.gz KZQJKCVUPVNYCJ-VBQJREDUSA-N 0 0 366.483 3.523 20 5 FHBDRN CCc1cc(NC(=O)[C@@H]2CCO[C@@H](C(C)C)C2)c2cc([N+](=O)[O-])ccc2n1 ZINC001266776768 932360409 /nfs/dbraw/zinc/36/04/09/932360409.db2.gz GULORRIPSOTDSO-BFUOFWGJSA-N 0 0 371.437 3.517 20 5 FHBDRN Cc1c(NC(=O)N2CCCOC[C@H]2C)cc([N+](=O)[O-])cc1C(F)(F)F ZINC000933344110 932361660 /nfs/dbraw/zinc/36/16/60/932361660.db2.gz XLQAKRUIAMPHKS-SECBINFHSA-N 0 0 361.320 3.565 20 5 FHBDRN COc1ccc(Cc2nc(-c3ccc4c(c3)CCC4)no2)cc1[N+](=O)[O-] ZINC000581637659 932366446 /nfs/dbraw/zinc/36/64/46/932366446.db2.gz ICMBZTVOYVOYCO-UHFFFAOYSA-N 0 0 351.362 3.733 20 5 FHBDRN C[C@@H](Cc1cccc(O)c1)NC(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000581637466 932367282 /nfs/dbraw/zinc/36/72/82/932367282.db2.gz XSQJMURHZAOQAG-HNNXBMFYSA-N 0 0 371.437 3.554 20 5 FHBDRN CC(C)Oc1cccnc1C(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000430626655 932388939 /nfs/dbraw/zinc/38/89/39/932388939.db2.gz RZHKUPATFXCHFD-UHFFFAOYSA-N 0 0 357.410 3.530 20 5 FHBDRN CCOC(=O)[C@H](NCCc1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1 ZINC000477341884 932485184 /nfs/dbraw/zinc/48/51/84/932485184.db2.gz PMSITHISTFZKDV-QGZVFWFLSA-N 0 0 362.813 3.685 20 5 FHBDRN C[C@H](NC(=O)NCc1ccccc1[N+](=O)[O-])c1c(F)cccc1Cl ZINC000175920572 932500539 /nfs/dbraw/zinc/50/05/39/932500539.db2.gz LBDVSDUJNIOZLJ-JTQLQIEISA-N 0 0 351.765 3.948 20 5 FHBDRN CCS[C@@H]1CCC[C@H]1NC(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000178109395 932513355 /nfs/dbraw/zinc/51/33/55/932513355.db2.gz OIWKNGUVNNACPC-KCPJHIHWSA-N 0 0 354.497 3.866 20 5 FHBDRN CCC[C@H](C)[C@H]1CCCN1C(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000178110115 932513790 /nfs/dbraw/zinc/51/37/90/932513790.db2.gz WTNACHJGKXAPDK-GOEBONIOSA-N 0 0 356.426 3.821 20 5 FHBDRN CCC[C@@H](C)[C@@H]1CCCN1C(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000178110079 932514250 /nfs/dbraw/zinc/51/42/50/932514250.db2.gz WTNACHJGKXAPDK-ZBFHGGJFSA-N 0 0 356.426 3.821 20 5 FHBDRN COc1ccccc1C/C(C)=C\C(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000255365516 932514772 /nfs/dbraw/zinc/51/47/72/932514772.db2.gz WSNXTEAMAHZHOW-SQFISAMPSA-N 0 0 354.406 3.751 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N1CC=C(c2cccc(Cl)c2)CC1 ZINC000477370368 932522717 /nfs/dbraw/zinc/52/27/17/932522717.db2.gz BXLBBTAQGSFXMG-UHFFFAOYSA-N 0 0 372.808 3.943 20 5 FHBDRN C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000477401213 932536354 /nfs/dbraw/zinc/53/63/54/932536354.db2.gz SBHSNWVEZLBQAB-SMDDNHRTSA-N 0 0 369.343 3.739 20 5 FHBDRN COc1ccc([C@H]2CCCN2C(=O)NCc2cccc([N+](=O)[O-])c2)cc1 ZINC000127271551 932538401 /nfs/dbraw/zinc/53/84/01/932538401.db2.gz QEYKMQVWUCTZAR-GOSISDBHSA-N 0 0 355.394 3.650 20 5 FHBDRN C[C@@H](NC(=O)N1CCO[C@@H](c2cccs2)C1)c1cccc([N+](=O)[O-])c1 ZINC000156365870 932553546 /nfs/dbraw/zinc/55/35/46/932553546.db2.gz SCLDHLXOKWOJFO-IUODEOHRSA-N 0 0 361.423 3.500 20 5 FHBDRN O=C(OCc1ccc(F)cc1F)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000781712628 932558394 /nfs/dbraw/zinc/55/83/94/932558394.db2.gz KJNIURYFMJHWGB-UHFFFAOYSA-N 0 0 359.231 3.831 20 5 FHBDRN Cc1cnc(Cl)c(NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)c1 ZINC000276539775 932600845 /nfs/dbraw/zinc/60/08/45/932600845.db2.gz WAUVIJSRWAYJAA-UHFFFAOYSA-N 0 0 374.828 3.807 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)NCc1ccccc1-n1ccnc1 ZINC000477448351 932617256 /nfs/dbraw/zinc/61/72/56/932617256.db2.gz MXOWUUVJESELQU-UHFFFAOYSA-N 0 0 370.796 3.672 20 5 FHBDRN CCC[C@@H]1[C@@H](C)CCCN1C(=O)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000785068845 932657943 /nfs/dbraw/zinc/65/79/43/932657943.db2.gz ZPNDHCCTBISJAR-SMDDNHRTSA-N 0 0 367.833 3.614 20 5 FHBDRN CC(C)(c1nc(-c2ccc3c(c2)OCCO3)no1)c1ccc([N+](=O)[O-])cc1 ZINC000544944534 932662399 /nfs/dbraw/zinc/66/23/99/932662399.db2.gz DSLNCQKNPIMWPS-UHFFFAOYSA-N 0 0 367.361 3.742 20 5 FHBDRN COc1c(F)cc(F)cc1NC(=O)CCOc1cc(C)ccc1[N+](=O)[O-] ZINC000561555873 932666450 /nfs/dbraw/zinc/66/64/50/932666450.db2.gz ILXYWXCHMNKCHQ-UHFFFAOYSA-N 0 0 366.320 3.598 20 5 FHBDRN O=C(Nc1ccnc(Cl)c1F)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000891505824 932673572 /nfs/dbraw/zinc/67/35/72/932673572.db2.gz KXEABHUGVIGBDR-UHFFFAOYSA-N 0 0 364.764 3.635 20 5 FHBDRN CCNc1ccc(C(=O)N2C[C@@H](C)Oc3ccc(C)cc32)cc1[N+](=O)[O-] ZINC000477539586 932675310 /nfs/dbraw/zinc/67/53/10/932675310.db2.gz XENDUNCWZDNLKQ-CYBMUJFWSA-N 0 0 355.394 3.763 20 5 FHBDRN CSc1ccc(C(=O)N(C)Cc2ccc(Cl)nc2)cc1[N+](=O)[O-] ZINC000023890617 932706679 /nfs/dbraw/zinc/70/66/79/932706679.db2.gz DUKUNWNVDRJFLG-UHFFFAOYSA-N 0 0 351.815 3.637 20 5 FHBDRN CCOC(=O)c1sc(CNc2ccc(Cl)cc2[N+](=O)[O-])nc1C ZINC000610542188 932730379 /nfs/dbraw/zinc/73/03/79/932730379.db2.gz ITWOSQNHZCQNFX-UHFFFAOYSA-N 0 0 355.803 3.802 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N1CCOC2(C1)CCCCCC2 ZINC000178168130 932738418 /nfs/dbraw/zinc/73/84/18/932738418.db2.gz BHYHOXAWBYICSP-UHFFFAOYSA-N 0 0 363.414 3.561 20 5 FHBDRN Cc1ccc(C(=O)OCC(=O)Nc2cc([N+](=O)[O-])ccc2Cl)cc1C ZINC000003443589 932752827 /nfs/dbraw/zinc/75/28/27/932752827.db2.gz BSBUDFJLRINPMD-UHFFFAOYSA-N 0 0 362.769 3.661 20 5 FHBDRN CC[C@H](NC(=O)N(C)CC1(O)CCCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000187441916 932772054 /nfs/dbraw/zinc/77/20/54/932772054.db2.gz HNXSNWRLVUSGPL-KRWDZBQOSA-N 0 0 363.458 3.773 20 5 FHBDRN CC[C@H](OC(=O)c1ccc(-c2cnn(C)c2)o1)c1cccc([N+](=O)[O-])c1 ZINC001266835691 932811249 /nfs/dbraw/zinc/81/12/49/932811249.db2.gz NIVZXQKFSFPMKQ-HNNXBMFYSA-N 0 0 355.350 3.896 20 5 FHBDRN CCNc1cc(C)ccc1NC(=O)c1cc(OC)c(OC)c([N+](=O)[O-])c1 ZINC000276656602 932819620 /nfs/dbraw/zinc/81/96/20/932819620.db2.gz VFFZITXUYVCWRX-UHFFFAOYSA-N 0 0 359.382 3.605 20 5 FHBDRN COCc1cc([N+](=O)[O-])ccc1NCc1nc2cc(Cl)ccc2n1C ZINC000548286622 932829316 /nfs/dbraw/zinc/82/93/16/932829316.db2.gz FFICSRIQNNJPIC-UHFFFAOYSA-N 0 0 360.801 3.893 20 5 FHBDRN CSCc1cccc(NC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)c1 ZINC000134661680 932836354 /nfs/dbraw/zinc/83/63/54/932836354.db2.gz RRIOBKBESJGVMM-UHFFFAOYSA-N 0 0 368.418 3.896 20 5 FHBDRN Nc1c(C(=O)Nc2cccc(Oc3ccncc3)c2)cccc1[N+](=O)[O-] ZINC000178199012 932844745 /nfs/dbraw/zinc/84/47/45/932844745.db2.gz FJLPVJNZECTLGG-UHFFFAOYSA-N 0 0 350.334 3.617 20 5 FHBDRN Cc1cccc(C(=O)NCCc2cn(C)c3cc(F)ccc23)c1[N+](=O)[O-] ZINC000187458257 932878014 /nfs/dbraw/zinc/87/80/14/932878014.db2.gz HIQWBTXEHRPBNP-UHFFFAOYSA-N 0 0 355.369 3.507 20 5 FHBDRN CCN(Cc1cccc(F)c1)C(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000121520766 932916578 /nfs/dbraw/zinc/91/65/78/932916578.db2.gz UHULOIVGYRRPFR-UHFFFAOYSA-N 0 0 353.353 3.944 20 5 FHBDRN CCOc1cccc([C@H](C)NC(=O)[C@@H]2C[C@H]2c2cccc([N+](=O)[O-])c2)c1 ZINC001125542206 932941788 /nfs/dbraw/zinc/94/17/88/932941788.db2.gz WLBXMJFLIWOIKO-FASAQXTFSA-N 0 0 354.406 3.974 20 5 FHBDRN O=[N+]([O-])c1cnccc1N1CCC[C@H](c2nc(C(F)(F)F)cs2)C1 ZINC000610929869 932942080 /nfs/dbraw/zinc/94/20/80/932942080.db2.gz KCXZETCEGGSWDF-VIFPVBQESA-N 0 0 358.345 3.849 20 5 FHBDRN C[C@H](CNC(=O)NCc1cccc([N+](=O)[O-])c1)Oc1ccccc1Cl ZINC000175974693 932944357 /nfs/dbraw/zinc/94/43/57/932944357.db2.gz PTGWWXAYWQABKY-GFCCVEGCSA-N 0 0 363.801 3.515 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NCc1nc(-c2ccc(F)c(C)c2)no1 ZINC000178236943 932945437 /nfs/dbraw/zinc/94/54/37/932945437.db2.gz WTKYTWKEJZIUQF-UHFFFAOYSA-N 0 0 358.329 3.713 20 5 FHBDRN CC(C)c1ccc(C(=O)NCc2nc(-c3cccs3)no2)cc1[N+](=O)[O-] ZINC000187489784 932948976 /nfs/dbraw/zinc/94/89/76/932948976.db2.gz JPHWIOYRJMVJOH-UHFFFAOYSA-N 0 0 372.406 3.760 20 5 FHBDRN CN(Cc1cc([N+](=O)[O-])ccc1Cl)C[C@@H](O)c1ccc(F)c(F)c1 ZINC000051287067 932959337 /nfs/dbraw/zinc/95/93/37/932959337.db2.gz XGUNLJCBTMJJQM-MRXNPFEDSA-N 0 0 356.756 3.692 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)Oc1cccc(NC(=O)C2CC2)c1 ZINC000588437074 932960935 /nfs/dbraw/zinc/96/09/35/932960935.db2.gz GFIOWNOJWPFAFC-QBFSEMIESA-N 0 0 366.373 3.952 20 5 FHBDRN Cc1cccc(C(=O)OCC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c1C ZINC000003452298 932973554 /nfs/dbraw/zinc/97/35/54/932973554.db2.gz YLXGLXPEIUGELU-UHFFFAOYSA-N 0 0 362.769 3.661 20 5 FHBDRN O=[N+]([O-])c1cc2ccccc2nc1NC1CCC(O)(c2cccnc2)CC1 ZINC000276688163 932973851 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CC(C)NC(=O)c1ccc(NCC(C)(C)[C@H]2CCCCO2)c([N+](=O)[O-])c1 ZINC000610716731 933913977 /nfs/dbraw/zinc/91/39/77/933913977.db2.gz PIWGRLDZGPGDQQ-QGZVFWFLSA-N 0 0 363.458 3.740 20 5 FHBDRN Cc1c(Cl)cccc1NC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000109984930 933962363 /nfs/dbraw/zinc/96/23/63/933962363.db2.gz QSNOMIQMJZWHMS-UHFFFAOYSA-N 0 0 357.753 3.650 20 5 FHBDRN Cc1cccc(C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2C)n1 ZINC000431175540 934008395 /nfs/dbraw/zinc/00/83/95/934008395.db2.gz PIMMNYKSOUGUDR-UHFFFAOYSA-N 0 0 350.172 3.621 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)N1CC[C@H](C(F)(F)F)C2(CCC2)C1 ZINC000510910053 934011649 /nfs/dbraw/zinc/01/16/49/934011649.db2.gz FOXQTYJQFTVSGZ-AWEZNQCLSA-N 0 0 371.359 3.859 20 5 FHBDRN Cc1nc(C)c(C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2C)s1 ZINC000431178070 934013792 /nfs/dbraw/zinc/01/37/92/934013792.db2.gz IXZSQINTNZLMAJ-UHFFFAOYSA-N 0 0 370.228 3.991 20 5 FHBDRN Cc1c(NC(=O)CC[C@@H]2CC[C@H](C)O2)cc(Br)cc1[N+](=O)[O-] ZINC000431179034 934018674 /nfs/dbraw/zinc/01/86/74/934018674.db2.gz LDOXVJARLLDMQA-CABZTGNLSA-N 0 0 371.231 3.952 20 5 FHBDRN Cc1c(NC(=O)c2cc(Cl)ccn2)cc(Br)cc1[N+](=O)[O-] ZINC000431175978 934019059 /nfs/dbraw/zinc/01/90/59/934019059.db2.gz BIGPBIXWFQWCJI-UHFFFAOYSA-N 0 0 370.590 3.966 20 5 FHBDRN CC(=O)c1ccc(Nc2ccn([C@H](C)c3ccccc3)n2)c([N+](=O)[O-])c1 ZINC000610735203 934024429 /nfs/dbraw/zinc/02/44/29/934024429.db2.gz IKRDPGZVYKAXKW-CYBMUJFWSA-N 0 0 350.378 3.769 20 5 FHBDRN C[C@H](C[C@H]1CCOC1)NC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000610742483 934044806 /nfs/dbraw/zinc/04/48/06/934044806.db2.gz LMSAAOHARCRWKH-HUUCEWRRSA-N 0 0 369.421 3.883 20 5 FHBDRN O=C(c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])N1CC(C2CCCC2)C1 ZINC000477892371 934077939 /nfs/dbraw/zinc/07/79/39/934077939.db2.gz FHFVRSDBEFGVJI-UHFFFAOYSA-N 0 0 372.343 3.798 20 5 FHBDRN COc1cc(-c2noc(-c3ccc(C)c([N+](=O)[O-])c3)n2)cc(OC)c1OC ZINC000134793537 934108711 /nfs/dbraw/zinc/10/87/11/934108711.db2.gz YDTKDAVHILDXQJ-UHFFFAOYSA-N 0 0 371.349 3.646 20 5 FHBDRN COCC(=O)N1CCc2cc(N[C@H](C)c3ccc(C)c([N+](=O)[O-])c3)ccc21 ZINC000187664287 934132703 /nfs/dbraw/zinc/13/27/03/934132703.db2.gz SVVYWHOIIKIKIL-CQSZACIVSA-N 0 0 369.421 3.612 20 5 FHBDRN CCNc1ccc(C(=O)Nc2ccc(C(F)(F)F)nc2)cc1[N+](=O)[O-] ZINC000133409860 934141858 /nfs/dbraw/zinc/14/18/58/934141858.db2.gz NBHDNDPBZNHGNN-UHFFFAOYSA-N 0 0 354.288 3.693 20 5 FHBDRN O=C([O-])CC1(C[NH2+]Cc2cc([N+](=O)[O-])ccc2OC(F)F)CCCCC1 ZINC000276963007 934141935 /nfs/dbraw/zinc/14/19/35/934141935.db2.gz FXYABOPKLQRAHZ-UHFFFAOYSA-N 0 0 372.368 3.711 20 5 FHBDRN Nc1c(C(=O)Nc2ccc(OC(F)F)c3ncccc23)cccc1[N+](=O)[O-] ZINC000176121036 934148854 /nfs/dbraw/zinc/14/88/54/934148854.db2.gz FGCGNGNNIAWJKA-UHFFFAOYSA-N 0 0 374.303 3.579 20 5 FHBDRN O=C(CC[C@@H]1CCOC1)Oc1ccc(Cc2ccccc2)cc1[N+](=O)[O-] ZINC000176190186 934203488 /nfs/dbraw/zinc/20/34/88/934203488.db2.gz MIEFOWMRWRAQLQ-MRXNPFEDSA-N 0 0 355.390 3.908 20 5 FHBDRN Cc1ccc(S(=O)(=O)N2C[C@H](C)C[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000510965133 934237147 /nfs/dbraw/zinc/23/71/47/934237147.db2.gz GMDDTTVAJWAIJX-GDBMZVCRSA-N 0 0 360.435 3.675 20 5 FHBDRN CC[C@@H]1CC[C@@H](C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2C)O1 ZINC000431233345 934237255 /nfs/dbraw/zinc/23/72/55/934237255.db2.gz DTLZEVWFCDVXSO-MFKMUULPSA-N 0 0 357.204 3.562 20 5 FHBDRN COc1ccc(CC(=O)N(C)Cc2ccc(Cl)c(F)c2)cc1[N+](=O)[O-] ZINC000535671088 934264557 /nfs/dbraw/zinc/26/45/57/934264557.db2.gz ROAPNPCYVWVEDG-UHFFFAOYSA-N 0 0 366.776 3.597 20 5 FHBDRN CCc1nnc([C@@H](C)Nc2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])[nH]1 ZINC000535692779 934270978 /nfs/dbraw/zinc/27/09/78/934270978.db2.gz MIDCJVACKIUIIN-GFCCVEGCSA-N 0 0 365.393 3.679 20 5 FHBDRN COC(=O)c1cc(OCc2ccc(OC)c(Cl)c2)ccc1[N+](=O)[O-] ZINC000535690938 934285088 /nfs/dbraw/zinc/28/50/88/934285088.db2.gz YZFIKILJLWOMAU-UHFFFAOYSA-N 0 0 351.742 3.622 20 5 FHBDRN C[C@@H]1CN(C(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)[C@H](c2ccccc2)CO1 ZINC000535705641 934287473 /nfs/dbraw/zinc/28/74/73/934287473.db2.gz XQXALSFSDWXBGD-ACJLOTCBSA-N 0 0 365.389 3.678 20 5 FHBDRN O=C(N[C@H]1C[C@H]1c1c(F)cccc1F)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000535697263 934291772 /nfs/dbraw/zinc/29/17/72/934291772.db2.gz WZFGVXYBJIDVER-OTYXRUKQSA-N 0 0 357.316 3.640 20 5 FHBDRN Cc1nc(C)c([C@@H](C)N(C)C(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)s1 ZINC000535702024 934296784 /nfs/dbraw/zinc/29/67/84/934296784.db2.gz USLFHZZNCVGCKD-SNVBAGLBSA-N 0 0 358.423 3.983 20 5 FHBDRN CC(C)[C@@]1(C)C[C@H]1NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000458104930 934304098 /nfs/dbraw/zinc/30/40/98/934304098.db2.gz MOENSOQYZLXUBZ-UKRRQHHQSA-N 0 0 360.332 3.700 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1Cc2cccc(OC)c2C1 ZINC000458125219 934309915 /nfs/dbraw/zinc/30/99/15/934309915.db2.gz DOAHBHQVPUCZSU-ZDUSSCGKSA-N 0 0 372.446 3.613 20 5 FHBDRN Cc1ccncc1CN(C)C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000477936216 934324596 /nfs/dbraw/zinc/32/45/96/934324596.db2.gz XOFCHORLYCDJJN-UHFFFAOYSA-N 0 0 368.418 3.694 20 5 FHBDRN Cc1nn(CCC(=O)N2CC3(CCCCC3)[C@H]2C(C)C)c(C)c1[N+](=O)[O-] ZINC000458193483 934365452 /nfs/dbraw/zinc/36/54/52/934365452.db2.gz PNHIZHYMGLVWHB-GOSISDBHSA-N 0 0 362.474 3.616 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1C[C@@H](OC)C12CCC2 ZINC000458203715 934375129 /nfs/dbraw/zinc/37/51/29/934375129.db2.gz WFDTVONOIMCLGZ-JKSUJKDBSA-N 0 0 364.467 3.784 20 5 FHBDRN CCc1ccc(O)c(C(=O)N2CCS[C@@H]2c2ccc([N+](=O)[O-])cc2)c1 ZINC000535793011 934384747 /nfs/dbraw/zinc/38/47/47/934384747.db2.gz UGPGHBVWCDRISC-GOSISDBHSA-N 0 0 358.419 3.751 20 5 FHBDRN CCc1nn(C)c(N[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)c1[N+](=O)[O-] ZINC000535795917 934390609 /nfs/dbraw/zinc/39/06/09/934390609.db2.gz CTDSQPLIWPSUFO-GXFFZTMASA-N 0 0 354.332 3.878 20 5 FHBDRN CCc1cnc(CN(C)C(=O)CCc2c(Cl)cccc2[N+](=O)[O-])s1 ZINC000934048280 934444756 /nfs/dbraw/zinc/44/47/56/934444756.db2.gz NNBDCLKECOZAKO-UHFFFAOYSA-N 0 0 367.858 3.858 20 5 FHBDRN COc1cc([N+](=O)[O-])cnc1N1C[C@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 ZINC000891958489 934451192 /nfs/dbraw/zinc/45/11/92/934451192.db2.gz YPNUDKYDASNROH-OCAPTIKFSA-N 0 0 373.253 3.566 20 5 FHBDRN CC[C@@]1(C)Oc2ccc(NC(=O)c3n[nH]c(C(C)C)c3[N+](=O)[O-])cc2O1 ZINC000277052993 934467330 /nfs/dbraw/zinc/46/73/30/934467330.db2.gz HDQHFAUPGMLHHS-KRWDZBQOSA-N 0 0 360.370 3.591 20 5 FHBDRN O=C(c1ccc(Cl)cc1[N+](=O)[O-])N(CCc1ccccc1)[C@H]1CCOC1 ZINC000176156990 934481122 /nfs/dbraw/zinc/48/11/22/934481122.db2.gz JNBZRVKDGREMSS-INIZCTEOSA-N 0 0 374.824 3.722 20 5 FHBDRN O=C(NCCCc1cccs1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000535822594 934513205 /nfs/dbraw/zinc/51/32/05/934513205.db2.gz LOAWFERJMRBKPB-UHFFFAOYSA-N 0 0 359.451 3.963 20 5 FHBDRN Cc1cc(CNC(=O)c2ccc(Sc3ccc([N+](=O)[O-])cc3)cc2)[nH]n1 ZINC000610860660 934534405 /nfs/dbraw/zinc/53/44/05/934534405.db2.gz CAJFYZCSJKFWLN-UHFFFAOYSA-N 0 0 368.418 3.708 20 5 FHBDRN O=C(c1c[nH]c2cc([N+](=O)[O-])ccc12)N1CCC[C@H]1c1ccc(O)cc1 ZINC000610887325 934564997 /nfs/dbraw/zinc/56/49/97/934564997.db2.gz PTRGMGTWNOUEOD-SFHVURJKSA-N 0 0 351.362 3.759 20 5 FHBDRN COc1ccccc1CC(C)(C)NC(=O)N[C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000458275205 934576830 /nfs/dbraw/zinc/57/68/30/934576830.db2.gz DDLQIAGTUNIRIY-AWEZNQCLSA-N 0 0 371.437 3.985 20 5 FHBDRN COc1cc(OC)cc(N(C)C(=O)c2cccc(SC)c2[N+](=O)[O-])c1 ZINC000468156223 934579415 /nfs/dbraw/zinc/57/94/15/934579415.db2.gz XCVOQPVMDDFAEL-UHFFFAOYSA-N 0 0 362.407 3.611 20 5 FHBDRN COc1cc(C(=O)N(CC2CC2)c2ccccc2)c([N+](=O)[O-])cc1OC ZINC000084241802 934604863 /nfs/dbraw/zinc/60/48/63/934604863.db2.gz ZDWNOFIWOGWXRD-UHFFFAOYSA-N 0 0 356.378 3.669 20 5 FHBDRN O=C(N[C@@H]1CCC[C@@H]2C[C@@H]21)c1cc(F)cc2c(=O)c3cccc(F)c3[nH]c12 ZINC000458302390 934610833 /nfs/dbraw/zinc/61/08/33/934610833.db2.gz QJJWJQYNTPTUPB-ANTHHZPCSA-N 0 0 368.383 3.878 20 5 FHBDRN O=[N+]([O-])c1ncccc1N1CCC[C@@H](c2nc(C(F)(F)F)cs2)C1 ZINC000610929897 934626352 /nfs/dbraw/zinc/62/63/52/934626352.db2.gz RTVHZCBPACISNR-SECBINFHSA-N 0 0 358.345 3.849 20 5 FHBDRN CC(C)c1[nH]nc(C(=O)Nc2ccc3c(cnn3C(C)C)c2)c1[N+](=O)[O-] ZINC000610922968 934627725 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3.647 20 5 FHBDRN O=C(c1cnc(-c2ccccc2)s1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000119974491 935386349 /nfs/dbraw/zinc/38/63/49/935386349.db2.gz CYLZEGYYPIWSJD-UHFFFAOYSA-N 0 0 351.387 3.921 20 5 FHBDRN C[C@H](NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)c1ccc(F)c(F)c1 ZINC000014575165 935390910 /nfs/dbraw/zinc/39/09/10/935390910.db2.gz MXEGDMKEKOTBOU-JTQLQIEISA-N 0 0 361.348 3.938 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)NCCCNc1ccccc1F ZINC000582206256 935397371 /nfs/dbraw/zinc/39/73/71/935397371.db2.gz VUGJSJRLBFZNMK-UHFFFAOYSA-N 0 0 365.792 3.548 20 5 FHBDRN COc1cc(C2(C(=O)N3CCc4c(cccc4[N+](=O)[O-])C3)CC2)ccc1C ZINC000161189189 935405993 /nfs/dbraw/zinc/40/59/93/935405993.db2.gz SECKLIMEKHUPNR-UHFFFAOYSA-N 0 0 366.417 3.528 20 5 FHBDRN CCOc1ccc2c(c1)[C@H](NC(=O)/C=C\c1ccc([N+](=O)[O-])cc1)CCO2 ZINC000588507481 935409786 /nfs/dbraw/zinc/40/97/86/935409786.db2.gz MWZYRHYIXOBGCV-PRCIHIDRSA-N 0 0 368.389 3.647 20 5 FHBDRN CCN(CC(=O)Nc1cc([N+](=O)[O-])ccc1C)Cc1c(F)cccc1F ZINC000507273660 945100062 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CC(C)[C@@H]1CN(C(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)CCS1 ZINC000437203710 945114332 /nfs/dbraw/zinc/11/43/32/945114332.db2.gz QTTLATVBRBKLAJ-DOMZBBRYSA-N 0 0 354.497 3.675 20 5 FHBDRN O=[N+]([O-])c1cc(C(F)(F)F)cc([N+](=O)[O-])c1NCc1ncccc1F ZINC000127607008 935654335 /nfs/dbraw/zinc/65/43/35/935654335.db2.gz SNRYXGLUSCVBPT-UHFFFAOYSA-N 0 0 360.223 3.668 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])c2cccnc12)N(CC1CC1)CC1CCC1 ZINC000478600601 935662507 /nfs/dbraw/zinc/66/25/07/935662507.db2.gz YPWAWYSCOLIRQA-UHFFFAOYSA-N 0 0 369.421 3.561 20 5 FHBDRN CCCc1[nH]nc(C(=O)Nc2cc(C(F)(F)F)ccc2F)c1[N+](=O)[O-] ZINC000158625840 935669912 /nfs/dbraw/zinc/66/99/12/935669912.db2.gz KEGYMUKMSBQNRQ-UHFFFAOYSA-N 0 0 360.267 3.681 20 5 FHBDRN CC[C@@H](CSC)N(C)C(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000091220812 935671435 /nfs/dbraw/zinc/67/14/35/935671435.db2.gz ZUBLZBVKSYYPKQ-JTQLQIEISA-N 0 0 350.362 3.827 20 5 FHBDRN O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1CCO[C@]2(CCc3ccccc32)C1 ZINC000158289138 935679151 /nfs/dbraw/zinc/67/91/51/935679151.db2.gz DCIYFBDSMOKHDG-LJQANCHMSA-N 0 0 372.808 3.562 20 5 FHBDRN CCOc1cc(OCC(=O)Nc2ccccc2Cl)ccc1[N+](=O)[O-] ZINC000478729741 935687818 /nfs/dbraw/zinc/68/78/18/935687818.db2.gz DLFRLMRXFXLZDI-UHFFFAOYSA-N 0 0 350.758 3.664 20 5 FHBDRN Cc1cc(C(=O)Nc2cc([N+](=O)[O-])c(F)cc2F)nn1-c1ccccc1 ZINC000120085986 935698466 /nfs/dbraw/zinc/69/84/66/935698466.db2.gz HXGFTXOQXUJUQE-UHFFFAOYSA-N 0 0 358.304 3.619 20 5 FHBDRN O=C(CN1CCC=C(c2ccco2)C1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000511124166 935704811 /nfs/dbraw/zinc/70/48/11/935704811.db2.gz KTTSTJUNWSNVMQ-UHFFFAOYSA-N 0 0 361.785 3.569 20 5 FHBDRN CN(C(=O)Cc1cccc(OC(F)(F)F)c1)c1cccc([N+](=O)[O-])c1 ZINC000158324973 935730982 /nfs/dbraw/zinc/73/09/82/935730982.db2.gz KWJMSXDZYKEJCU-UHFFFAOYSA-N 0 0 354.284 3.699 20 5 FHBDRN COc1cc(N[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)ccc1F ZINC000187744568 935742093 /nfs/dbraw/zinc/74/20/93/935742093.db2.gz LAXOABCFIFGEKE-SECBINFHSA-N 0 0 367.764 3.835 20 5 FHBDRN O=C(Nc1cc(F)cc(Cl)c1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000158346064 935744838 /nfs/dbraw/zinc/74/48/38/935744838.db2.gz UONMLQLRUVJSIB-UHFFFAOYSA-N 0 0 360.732 3.825 20 5 FHBDRN CCO[C@H]1C[C@@H](N(C)C(=O)c2cc3cc([N+](=O)[O-])ccc3o2)C12CCC2 ZINC000478868879 935746403 /nfs/dbraw/zinc/74/64/03/935746403.db2.gz AVAYLBZSDJUNCP-SJORKVTESA-N 0 0 358.394 3.761 20 5 FHBDRN Cn1nccc1-c1ccc(F)cc1OCCOc1ccc([N+](=O)[O-])cc1 ZINC000478879933 935748397 /nfs/dbraw/zinc/74/83/97/935748397.db2.gz CPFXRGVSZLCRHS-UHFFFAOYSA-N 0 0 357.341 3.592 20 5 FHBDRN Cc1c(CNC(=O)N[C@@H]2C[C@@H]2c2c(F)cccc2F)cccc1[N+](=O)[O-] ZINC000478856297 935748863 /nfs/dbraw/zinc/74/88/63/935748863.db2.gz LZHPBUQXTUCDCW-SWLSCSKDSA-N 0 0 361.348 3.537 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)N1CCSC2(CCCCC2)C1 ZINC000431419403 935750327 /nfs/dbraw/zinc/75/03/27/935750327.db2.gz GUZBNUXXQBJTKA-UHFFFAOYSA-N 0 0 366.508 3.965 20 5 FHBDRN Cc1noc([C@H](OC(=O)c2cc([N+](=O)[O-])ccc2Cl)c2ccccc2)n1 ZINC000176672678 935752238 /nfs/dbraw/zinc/75/22/38/935752238.db2.gz BUQQJJGEWPNQPD-OAHLLOKOSA-N 0 0 373.752 3.886 20 5 FHBDRN Cc1ccc(NC(=O)c2cc(Br)cnc2Cl)cc1[N+](=O)[O-] ZINC000050044529 935753422 /nfs/dbraw/zinc/75/34/22/935753422.db2.gz OBJIPLXJNAZWIS-UHFFFAOYSA-N 0 0 370.590 3.966 20 5 FHBDRN CC[C@]1(c2ccc(C)cc2)CC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C1=O ZINC000158362609 935754748 /nfs/dbraw/zinc/75/47/48/935754748.db2.gz UDYDMBYEVUPYEM-HXUWFJFHSA-N 0 0 352.390 3.510 20 5 FHBDRN CCCOCc1ccccc1CNC(=O)NCc1cccc([N+](=O)[O-])c1C ZINC000478931141 935756746 /nfs/dbraw/zinc/75/67/46/935756746.db2.gz CTPFPCUPBOBNJV-UHFFFAOYSA-N 0 0 371.437 3.829 20 5 FHBDRN COc1ccc(F)cc1[C@H](C)NC(=O)NCc1cccc([N+](=O)[O-])c1C ZINC000478932514 935757221 /nfs/dbraw/zinc/75/72/21/935757221.db2.gz UWSCURZYLGOZOZ-LBPRGKRZSA-N 0 0 361.373 3.611 20 5 FHBDRN COc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2SCC(C)C)cn1 ZINC000478950161 935762894 /nfs/dbraw/zinc/76/28/94/935762894.db2.gz GTDVBPJZHRZLBK-UHFFFAOYSA-N 0 0 361.423 3.999 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1)c1cnc2c(cnn2Cc2ccccc2)c1 ZINC000023680320 935776501 /nfs/dbraw/zinc/77/65/01/935776501.db2.gz KSXVEKRXTVZQPQ-UHFFFAOYSA-N 0 0 373.372 3.640 20 5 FHBDRN Cc1ccccc1CCNC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000127761612 935777838 /nfs/dbraw/zinc/77/78/38/935777838.db2.gz ZQPFVYQVGPGDEG-UHFFFAOYSA-N 0 0 353.422 3.820 20 5 FHBDRN Cc1c(OCC(=O)Nc2ccc(OC(F)F)cc2)cccc1[N+](=O)[O-] ZINC000047355664 945123411 /nfs/dbraw/zinc/12/34/11/945123411.db2.gz RXGLCIMIBRGFCV-UHFFFAOYSA-N 0 0 352.293 3.522 20 5 FHBDRN CCn1cc(OC(=O)c2cc(OCc3ccccc3)ccc2[N+](=O)[O-])cn1 ZINC000785132699 935787720 /nfs/dbraw/zinc/78/77/20/935787720.db2.gz LWPJMORYANJXPE-UHFFFAOYSA-N 0 0 367.361 3.609 20 5 FHBDRN COCc1nc(C)c(C(=O)Nc2cc([N+](=O)[O-])c(Cl)cc2C)s1 ZINC000135113603 935798927 /nfs/dbraw/zinc/79/89/27/935798927.db2.gz FYCSSUFHLKUQOV-UHFFFAOYSA-N 0 0 355.803 3.720 20 5 FHBDRN Cc1nc(C)c([C@H](C)N(C)C(=O)c2cc([N+](=O)[O-])cc(C)c2F)s1 ZINC000277671957 935807466 /nfs/dbraw/zinc/80/74/66/935807466.db2.gz MKIZCILIRHKPCB-JTQLQIEISA-N 0 0 351.403 3.949 20 5 FHBDRN CC(=O)N1CCCCC[C@H]1C1CCN(c2nc(C)cc(C)c2[N+](=O)[O-])CC1 ZINC000611616397 935808389 /nfs/dbraw/zinc/80/83/89/935808389.db2.gz KVYCDJVYJOYRCM-SFHVURJKSA-N 0 0 374.485 3.614 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NS(=O)(=O)c1ccc(C(F)F)cc1 ZINC000582538568 935810219 /nfs/dbraw/zinc/81/02/19/935810219.db2.gz OCIWQPKMQPKWND-UHFFFAOYSA-N 0 0 356.350 3.950 20 5 FHBDRN COC(=O)c1ccc(C)c(NC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000047351464 945125500 /nfs/dbraw/zinc/12/55/00/945125500.db2.gz APUGHTUPPMONHI-GFCCVEGCSA-N 0 0 357.366 3.573 20 5 FHBDRN Cc1cccc(C(=O)Nc2ccn(-c3ccccc3Cl)n2)c1[N+](=O)[O-] ZINC000158470266 935817851 /nfs/dbraw/zinc/81/78/51/935817851.db2.gz YYCFLZZCGLKPAQ-UHFFFAOYSA-N 0 0 356.769 3.995 20 5 FHBDRN COc1ccccc1NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000050256160 935821386 /nfs/dbraw/zinc/82/13/86/935821386.db2.gz YHBRTIQKNDFVGV-UHFFFAOYSA-N 0 0 355.375 3.979 20 5 FHBDRN COc1cc(CCNC(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)ccc1C ZINC000127852734 935825163 /nfs/dbraw/zinc/82/51/63/935825163.db2.gz GEYVVCMJILMYCV-UHFFFAOYSA-N 0 0 357.410 3.893 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCc1ccc2c(c1)OCCCO2 ZINC000127877203 935829047 /nfs/dbraw/zinc/82/90/47/935829047.db2.gz YTVZQYBTEWTYHS-UHFFFAOYSA-N 0 0 371.393 3.695 20 5 FHBDRN CCn1nc(C)c([N+](=O)[O-])c1NCCc1ccc(-n2nc(C)cc2C)cc1 ZINC000479372176 935831212 /nfs/dbraw/zinc/83/12/12/935831212.db2.gz DYTLPFBVHBCVQN-UHFFFAOYSA-N 0 0 368.441 3.577 20 5 FHBDRN C[C@H](CNC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1)C(F)(F)F ZINC000479401753 935835311 /nfs/dbraw/zinc/83/53/11/935835311.db2.gz YFMLYPBPYGFPNO-GFCCVEGCSA-N 0 0 373.375 3.759 20 5 FHBDRN Cc1cc(C(=O)N(Cc2ncc[nH]2)c2cccc(F)c2)ccc1[N+](=O)[O-] ZINC000479378365 935835594 /nfs/dbraw/zinc/83/55/94/935835594.db2.gz DJVMUGVWEYSVCY-UHFFFAOYSA-N 0 0 354.341 3.612 20 5 FHBDRN O=C(COc1cccc([N+](=O)[O-])c1)N[C@H]1CC=C(c2ccc(F)cc2)CC1 ZINC000479411462 935837338 /nfs/dbraw/zinc/83/73/38/935837338.db2.gz QSVIEBGTIHRJCQ-KRWDZBQOSA-N 0 0 370.380 3.865 20 5 FHBDRN CC[C@H]1[C@@H](C)CCN1C(=O)c1ccc(Cn2nc(C)c([N+](=O)[O-])c2C)cc1 ZINC000479431512 935838666 /nfs/dbraw/zinc/83/86/66/935838666.db2.gz ZQRUZMLZSZBGIF-UGSOOPFHSA-N 0 0 370.453 3.717 20 5 FHBDRN CC(C)CC[C@H]1CCCCN1C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000127938113 935850995 /nfs/dbraw/zinc/85/09/95/935850995.db2.gz AJURLAKZVKTXEP-MRXNPFEDSA-N 0 0 371.441 3.606 20 5 FHBDRN CCC(=O)c1ccc(C(=O)NCCCNc2ccc(C)cc2[N+](=O)[O-])cc1 ZINC000472232321 935859553 /nfs/dbraw/zinc/85/95/53/935859553.db2.gz JCPMMPXMGNIXIP-UHFFFAOYSA-N 0 0 369.421 3.728 20 5 FHBDRN Cc1cc(F)cc(C(=O)N(C)Cc2nc3ccccc3s2)c1[N+](=O)[O-] ZINC000176693854 935863780 /nfs/dbraw/zinc/86/37/80/935863780.db2.gz BOHBHKOBSKUARK-UHFFFAOYSA-N 0 0 359.382 3.924 20 5 FHBDRN CC(C)Oc1ccc(CNC(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)cc1 ZINC000121825811 935864746 /nfs/dbraw/zinc/86/47/46/935864746.db2.gz OPZDHJPREXICBF-UHFFFAOYSA-N 0 0 369.421 3.650 20 5 FHBDRN Cc1cc(F)cc(C(=O)NCCSCc2ccccc2F)c1[N+](=O)[O-] ZINC000176693145 935865210 /nfs/dbraw/zinc/86/52/10/935865210.db2.gz LKBSQNKVFALIEL-UHFFFAOYSA-N 0 0 366.389 3.845 20 5 FHBDRN O=C(NC[C@H](Cc1ccccc1)C(F)(F)F)c1ccc(F)cc1[N+](=O)[O-] ZINC000516692224 945129536 /nfs/dbraw/zinc/12/95/36/945129536.db2.gz GDELHHYCPHBGTA-LBPRGKRZSA-N 0 0 370.302 3.885 20 5 FHBDRN COc1ccc2nc(NC(=O)c3cc(F)cc(C)c3[N+](=O)[O-])sc2c1 ZINC000176700724 935870749 /nfs/dbraw/zinc/87/07/49/935870749.db2.gz VUDRLHMZLFUIAR-UHFFFAOYSA-N 0 0 361.354 3.913 20 5 FHBDRN O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccn(-c2ccccc2Cl)n1 ZINC000158624628 935872240 /nfs/dbraw/zinc/87/22/40/935872240.db2.gz MVYFNOPNSKMOGH-UHFFFAOYSA-N 0 0 356.769 3.615 20 5 FHBDRN O=C(c1cccc2ccccc21)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000015382320 945130168 /nfs/dbraw/zinc/13/01/68/945130168.db2.gz YFGLSWKVJOKNIE-UHFFFAOYSA-N 0 0 361.401 3.710 20 5 FHBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)Nc1nc(C2CC2)c[nH]1 ZINC000289259852 935875392 /nfs/dbraw/zinc/87/53/92/935875392.db2.gz GKKJWLAOWBKEDN-UHFFFAOYSA-N 0 0 365.187 3.519 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)NC[C@@](C)(O)C2CCCCC2)cc1[N+](=O)[O-] ZINC000479698658 935881013 /nfs/dbraw/zinc/88/10/13/935881013.db2.gz DVBLGNJTXRWOTN-AUUYWEPGSA-N 0 0 363.458 3.595 20 5 FHBDRN CO[C@H](c1ccccc1Cl)[C@@H](C)NC(=O)c1ccc([N+](=O)[O-])s1 ZINC000479755440 935887599 /nfs/dbraw/zinc/88/75/99/935887599.db2.gz OPLSYNIPYUKIJH-OTYXRUKQSA-N 0 0 354.815 3.816 20 5 FHBDRN C[C@H]1CN(C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)c2cccc(F)c2O1 ZINC000479761984 935887897 /nfs/dbraw/zinc/88/78/97/935887897.db2.gz FPUJDMMJFFVFKL-JTQLQIEISA-N 0 0 364.760 3.744 20 5 FHBDRN CC(C)COCCCNC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000050554385 935888499 /nfs/dbraw/zinc/88/84/99/935888499.db2.gz PUBSRXRYGJRPOD-UHFFFAOYSA-N 0 0 363.439 3.511 20 5 FHBDRN CCOc1cc(Cl)ccc1-c1nc(-c2ccc(N)c([N+](=O)[O-])c2)no1 ZINC000582631758 935894603 /nfs/dbraw/zinc/89/46/03/935894603.db2.gz XEYZVINEXVVBOJ-UHFFFAOYSA-N 0 0 360.757 3.946 20 5 FHBDRN CC(C)(C)OC(=O)CCCCOC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000785140108 935899475 /nfs/dbraw/zinc/89/94/75/935899475.db2.gz UCKDDKAJFCWVAR-UHFFFAOYSA-N 0 0 357.790 3.917 20 5 FHBDRN Cc1cc(NC(=O)NC(C)(C)c2ccccc2[N+](=O)[O-])n(C(C)(C)C)n1 ZINC000582642012 935901255 /nfs/dbraw/zinc/90/12/55/935901255.db2.gz XFNSLQRTRFFCDC-UHFFFAOYSA-N 0 0 359.430 3.912 20 5 FHBDRN COc1cc(N[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)c(C)cc1C ZINC000479831968 935902356 /nfs/dbraw/zinc/90/23/56/935902356.db2.gz SWNDILDWCAACPT-CQSZACIVSA-N 0 0 357.410 3.968 20 5 FHBDRN CC(C)(NC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000728499845 935909102 /nfs/dbraw/zinc/90/91/02/935909102.db2.gz IZBNALKUXYYZJZ-UHFFFAOYSA-N 0 0 368.368 3.585 20 5 FHBDRN COc1ccc(NC(=O)Cn2nc(C)c3cc([N+](=O)[O-])ccc32)cc1Cl ZINC000479938686 935921482 /nfs/dbraw/zinc/92/14/82/935921482.db2.gz HKFUVAGAHKTZDH-UHFFFAOYSA-N 0 0 374.784 3.554 20 5 FHBDRN Cc1nn(CC(=O)N[C@H](C)c2ccc(C)c(C)c2)c2ccc([N+](=O)[O-])cc12 ZINC000479947292 935927541 /nfs/dbraw/zinc/92/75/41/935927541.db2.gz OFSSTDZWBCEOJW-CQSZACIVSA-N 0 0 366.421 3.747 20 5 FHBDRN Cc1cc(Cl)c(S(=O)(=O)N2CCC[C@@H]3CCC[C@@H]32)cc1[N+](=O)[O-] ZINC000176725661 935932943 /nfs/dbraw/zinc/93/29/43/935932943.db2.gz DUNLXEUOIIJXAO-AAEUAGOBSA-N 0 0 358.847 3.510 20 5 FHBDRN CN(CCCOc1ccc(F)cc1)c1ncnc2ccc([N+](=O)[O-])cc21 ZINC000611702620 935942249 /nfs/dbraw/zinc/94/22/49/935942249.db2.gz WOAHEVVLVQEWJS-UHFFFAOYSA-N 0 0 356.357 3.582 20 5 FHBDRN Cc1cc(Cl)cc2cc(-c3noc(-c4cc([N+](=O)[O-])nn4C)n3)oc21 ZINC000582692253 935943447 /nfs/dbraw/zinc/94/34/47/935943447.db2.gz UPGZWBYMQJRDJW-UHFFFAOYSA-N 0 0 359.729 3.753 20 5 FHBDRN COc1ccccc1C[C@@H](C)N(C)c1ncnc2ccc([N+](=O)[O-])cc21 ZINC000611706593 935944721 /nfs/dbraw/zinc/94/47/21/935944721.db2.gz IMOPFJHXNOLNEH-CYBMUJFWSA-N 0 0 352.394 3.614 20 5 FHBDRN Cc1ccc(-c2csc(NC(=O)[C@H]3CCCOCC3)n2)cc1[N+](=O)[O-] ZINC000375729559 935948531 /nfs/dbraw/zinc/94/85/31/935948531.db2.gz GSRSAXYIEGRPKI-LBPRGKRZSA-N 0 0 361.423 3.782 20 5 FHBDRN O=[N+]([O-])c1ccc2ncnc(N3CC[C@@H](COCc4ccccc4)C3)c2c1 ZINC000611707174 935949314 /nfs/dbraw/zinc/94/93/14/935949314.db2.gz LLMIITFYBRYIRC-MRXNPFEDSA-N 0 0 364.405 3.581 20 5 FHBDRN CC(C)C(=O)Nc1cccc(-c2noc(-c3ccc([N+](=O)[O-])s3)n2)c1 ZINC000582697826 935955621 /nfs/dbraw/zinc/95/56/21/935955621.db2.gz MKCGYJGGXPUSBF-UHFFFAOYSA-N 0 0 358.379 3.968 20 5 FHBDRN Cn1ccnc1C[C@@H](Nc1ncnc2ccc([N+](=O)[O-])cc21)c1ccccc1 ZINC000611708870 935959376 /nfs/dbraw/zinc/95/93/76/935959376.db2.gz RUACTOUTQIIREM-GOSISDBHSA-N 0 0 374.404 3.667 20 5 FHBDRN O=[N+]([O-])c1ccc2ncnc(N[C@@H]3CCN(c4c(F)cccc4F)C3)c2c1 ZINC000611709878 935965116 /nfs/dbraw/zinc/96/51/16/935965116.db2.gz UTARSUCJYMOWOI-LLVKDONJSA-N 0 0 371.347 3.507 20 5 FHBDRN C[C@@H](CC1CCCCC1)C(=O)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000135528288 935967105 /nfs/dbraw/zinc/96/71/05/935967105.db2.gz KUGNMWQUURKPKK-GOEBONIOSA-N 0 0 360.458 3.609 20 5 FHBDRN COC(=O)c1cc(C)nc(N[C@@H](c2ccc(OC)cc2)C(C)C)c1[N+](=O)[O-] ZINC000582713851 935974852 /nfs/dbraw/zinc/97/48/52/935974852.db2.gz IRPDXCIECRTGTH-MRXNPFEDSA-N 0 0 373.409 3.903 20 5 FHBDRN Cc1cc(C)cc(CCNC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)c1 ZINC000135568274 935978988 /nfs/dbraw/zinc/97/89/88/935978988.db2.gz NIGUZGAMQBHVIY-UHFFFAOYSA-N 0 0 351.406 3.594 20 5 FHBDRN COc1ccc(C(=O)N[C@H]2CCCO[C@H]2c2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000074521996 935985220 /nfs/dbraw/zinc/98/52/20/935985220.db2.gz NRIZSFODZLJSRH-LPHOPBHVSA-N 0 0 370.405 3.562 20 5 FHBDRN O=C([C@@H]1C[C@H]2CC[C@@H]1O2)N(Cc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000075352076 936004325 /nfs/dbraw/zinc/00/43/25/936004325.db2.gz RELNPVYIVTVBII-QRVBRYPASA-N 0 0 352.390 3.696 20 5 FHBDRN O=C(c1ccc(OC(F)F)c([N+](=O)[O-])c1)N1CCCc2sccc2C1 ZINC000611614965 936008683 /nfs/dbraw/zinc/00/86/83/936008683.db2.gz NRLPGHPQIMANBK-UHFFFAOYSA-N 0 0 368.361 3.846 20 5 FHBDRN Cc1cc([C@@H]2CN(c3ncnc4ccc([N+](=O)[O-])cc43)CCO2)ccc1F ZINC000611712387 936020961 /nfs/dbraw/zinc/02/09/61/936020961.db2.gz JPUIKULQAPMAQR-SFHVURJKSA-N 0 0 368.368 3.563 20 5 FHBDRN CCOc1ccc(-c2nc(-c3cn(C)nc3C(C)C)no2)cc1[N+](=O)[O-] ZINC000426204056 945141088 /nfs/dbraw/zinc/14/10/88/945141088.db2.gz DIHFOACDWPKVTR-UHFFFAOYSA-N 0 0 357.370 3.567 20 5 FHBDRN O=c1[nH]c(N2CCC[C@H](c3ccccc3)C2)nc2ccc([N+](=O)[O-])cc12 ZINC000431482538 936027637 /nfs/dbraw/zinc/02/76/37/936027637.db2.gz GNIVCQFHUNCTHR-AWEZNQCLSA-N 0 0 350.378 3.628 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)ccc1-c1nc(COCC(F)(F)C(F)F)no1 ZINC000277849839 936031447 /nfs/dbraw/zinc/03/14/47/936031447.db2.gz BHAWZLVOHOMCCE-UHFFFAOYSA-N 0 0 369.658 3.715 20 5 FHBDRN CSCc1cc(F)ccc1CNc1ncnc2ccc([N+](=O)[O-])cc21 ZINC000611709190 936033542 /nfs/dbraw/zinc/03/35/42/936033542.db2.gz RKMGEDIQQJSLFD-UHFFFAOYSA-N 0 0 358.398 3.574 20 5 FHBDRN Cc1ccc2c(c1C)OC[C@@H]2NC(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000077417531 936050971 /nfs/dbraw/zinc/05/09/71/936050971.db2.gz DOXPKMAKJVEJTD-DYVFJYSZSA-N 0 0 355.394 3.706 20 5 FHBDRN COc1ccc(/C=C\C(=O)Nc2cc([N+](=O)[O-])c(F)cc2F)cc1OC ZINC000255540501 936057748 /nfs/dbraw/zinc/05/77/48/936057748.db2.gz BMMQJTSROGSJDS-XQRVVYSFSA-N 0 0 364.304 3.542 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)C1(c2ccccc2C)CCC1 ZINC000472255497 936068621 /nfs/dbraw/zinc/06/86/21/936068621.db2.gz FBMRYEWZCYWLCF-UHFFFAOYSA-N 0 0 354.406 3.650 20 5 FHBDRN CO[C@@H](c1ccc(F)cc1)[C@H](C)Nc1ncnc2ccc([N+](=O)[O-])cc21 ZINC000611714374 936072239 /nfs/dbraw/zinc/07/22/39/936072239.db2.gz PTRNZHSKKDVTDC-APPDUMDISA-N 0 0 356.357 3.865 20 5 FHBDRN CO[C@@H](c1ccccc1F)[C@@H](C)Nc1ncnc2ccc([N+](=O)[O-])cc21 ZINC000611714741 936078430 /nfs/dbraw/zinc/07/84/30/936078430.db2.gz ZQMYIJHMUHVUIK-PIGZYNQJSA-N 0 0 356.357 3.865 20 5 FHBDRN COC(=O)c1ccc(CCNc2ccc([N+](=O)[O-])c3cccnc23)cc1 ZINC000024202964 936081162 /nfs/dbraw/zinc/08/11/62/936081162.db2.gz JXYODUKLEVAPFL-UHFFFAOYSA-N 0 0 351.362 3.584 20 5 FHBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)Nc1c(F)cccc1Cl ZINC000611917971 936086713 /nfs/dbraw/zinc/08/67/13/936086713.db2.gz PUERMLFWCSMPRV-UHFFFAOYSA-N 0 0 365.169 3.842 20 5 FHBDRN CN(C(=O)c1sc(Br)cc1[N+](=O)[O-])C(C1CC1)C1CC1 ZINC000277885028 936091078 /nfs/dbraw/zinc/09/10/78/936091078.db2.gz BWEBBBKRUBGFNV-UHFFFAOYSA-N 0 0 359.245 3.679 20 5 FHBDRN CC(C)OC1CCN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])CC1 ZINC000582765646 936094170 /nfs/dbraw/zinc/09/41/70/936094170.db2.gz KGZYZZKDADMGLP-UHFFFAOYSA-N 0 0 360.332 3.643 20 5 FHBDRN COc1cccc(F)c1CNc1cc([N+](=O)[O-])cc(Br)n1 ZINC001167612761 936095726 /nfs/dbraw/zinc/09/57/26/936095726.db2.gz FXCSNKYPTOMQIR-UHFFFAOYSA-N 0 0 356.151 3.512 20 5 FHBDRN CC(=O)c1ccc(OCc2cc([N+](=O)[O-])ccc2Cl)c([N+](=O)[O-])c1 ZINC000178659871 936112214 /nfs/dbraw/zinc/11/22/14/936112214.db2.gz KZMKNYXARVKGEQ-UHFFFAOYSA-N 0 0 350.714 3.938 20 5 FHBDRN O=C(Nc1ccc(O[C@H]2CCCC[C@H]2O)cc1)c1cc(F)ccc1[N+](=O)[O-] ZINC000135684503 936116883 /nfs/dbraw/zinc/11/68/83/936116883.db2.gz DXCISESPZMAUAR-MSOLQXFVSA-N 0 0 374.368 3.669 20 5 FHBDRN Cc1cnc(C2CCN(C(=O)Cc3cccc([N+](=O)[O-])c3C)CC2)s1 ZINC000277912315 936152902 /nfs/dbraw/zinc/15/29/02/936152902.db2.gz GKWMVPLVPAYZAF-UHFFFAOYSA-N 0 0 359.451 3.617 20 5 FHBDRN COc1ccc2c(c1)CC[C@@H](Nc1ncnc3ccc([N+](=O)[O-])cc31)C2 ZINC000612098504 936163002 /nfs/dbraw/zinc/16/30/02/936163002.db2.gz RDGDUGALTPYJEJ-CQSZACIVSA-N 0 0 350.378 3.516 20 5 FHBDRN CCN(Cc1c(F)cccc1F)C(=O)CCc1cc(F)ccc1[N+](=O)[O-] ZINC001125629319 936174777 /nfs/dbraw/zinc/17/47/77/936174777.db2.gz PQMRJJAIYIKZOA-UHFFFAOYSA-N 0 0 366.339 3.993 20 5 FHBDRN Cc1cc(NCc2ccc([N+](=O)[O-])cc2F)ccc1-n1nnnc1C(C)C ZINC000612200212 936200064 /nfs/dbraw/zinc/20/00/64/936200064.db2.gz UUGKUFAISVGWLZ-UHFFFAOYSA-N 0 0 370.388 3.754 20 5 FHBDRN COc1ccc(CN(Cc2ccco2)Cc2cccnc2)cc1[N+](=O)[O-] ZINC000511206466 936209338 /nfs/dbraw/zinc/20/93/38/936209338.db2.gz ZNUFPMUKSLIOGA-UHFFFAOYSA-N 0 0 353.378 3.794 20 5 FHBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])N1CC[C@@H](c2ccco2)C1 ZINC000612286689 936212580 /nfs/dbraw/zinc/21/25/80/936212580.db2.gz YHIOGDPAZVTFMD-LLVKDONJSA-N 0 0 366.826 3.949 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](c1nc2ccccc2[nH]1)C(C)C ZINC000061205747 936216716 /nfs/dbraw/zinc/21/67/16/936216716.db2.gz VPGWVGMJGLIUMC-KRWDZBQOSA-N 0 0 368.393 3.607 20 5 FHBDRN Cc1ccccc1[C@]1(C)NC(=O)N(Cc2ccc([N+](=O)[O-])cc2Cl)C1=O ZINC000611727153 936218337 /nfs/dbraw/zinc/21/83/37/936218337.db2.gz HMVQEJSAENGHAO-SFHVURJKSA-N 0 0 373.796 3.524 20 5 FHBDRN CCn1c(C)nc([N+](=O)[O-])c1N1C[C@H](c2cc(C)ccc2C)OC[C@@H]1C ZINC000572875875 936218379 /nfs/dbraw/zinc/21/83/79/936218379.db2.gz GRQIXRUTNYLENB-WMLDXEAASA-N 0 0 358.442 3.703 20 5 FHBDRN COc1cc(C(=O)N(Cc2ccc(F)cc2)C2CC2)c([N+](=O)[O-])cc1OC ZINC000061212513 936219421 /nfs/dbraw/zinc/21/94/21/936219421.db2.gz NNWONTHFANGAKM-UHFFFAOYSA-N 0 0 374.368 3.556 20 5 FHBDRN O=C(c1c[nH]c2cc([N+](=O)[O-])ccc12)N1CC[C@@H](Oc2cccc(F)c2)C1 ZINC000612375666 936228832 /nfs/dbraw/zinc/22/88/32/936228832.db2.gz USZIZTUOHCBYSV-OAHLLOKOSA-N 0 0 369.352 3.509 20 5 FHBDRN COC(=O)c1cc(C(=O)N2CC[C@H](C(C)(C)C)C[C@@H]2C)cc([N+](=O)[O-])c1 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368.433 3.627 20 5 FHBDRN COc1ccc([C@H](Cc2ccccc2)NC(=O)c2ccc([N+](=O)[O-])o2)cc1 ZINC000582879187 936249762 /nfs/dbraw/zinc/24/97/62/936249762.db2.gz YGGHPSZCVKHMCE-KRWDZBQOSA-N 0 0 366.373 3.910 20 5 FHBDRN Cc1ccc(N2CCN(C(=O)c3cc([N+](=O)[O-])c(C)cc3C)CC2)c(C)c1 ZINC001167632654 936251392 /nfs/dbraw/zinc/25/13/92/936251392.db2.gz LMRJIDFHKXNPMD-UHFFFAOYSA-N 0 0 367.449 3.791 20 5 FHBDRN COc1cc(Nc2ncc(Cl)cc2[N+](=O)[O-])ccc1N1CCCC1=O ZINC000153550097 936260097 /nfs/dbraw/zinc/26/00/97/936260097.db2.gz FNANWSYQNXUNST-UHFFFAOYSA-N 0 0 362.773 3.522 20 5 FHBDRN COCCCN(CCOC)C(=O)c1cc2ccccc2c2cccnc12 ZINC000511212697 936262126 /nfs/dbraw/zinc/26/21/26/936262126.db2.gz WUWNQNFWTOFTEA-UHFFFAOYSA-N 0 0 352.434 3.513 20 5 FHBDRN O=C(CCc1c(Cl)cccc1[N+](=O)[O-])NCCc1ccc(Cl)nc1 ZINC000934724899 936275516 /nfs/dbraw/zinc/27/55/16/936275516.db2.gz DTTAXFVLPRNVAP-UHFFFAOYSA-N 0 0 368.220 3.588 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N(Cc1ccccc1)[C@@H]1CCCC1(C)C ZINC000427170522 945154181 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CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1c2ccccc2O[C@H]1C ZINC000583466213 938265683 /nfs/dbraw/zinc/26/56/83/938265683.db2.gz UUJUXHHQGQYZII-OHNRDTAOSA-N 0 0 354.406 3.802 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1c2ccccc2O[C@@H]1C ZINC000583466215 938265790 /nfs/dbraw/zinc/26/57/90/938265790.db2.gz UUJUXHHQGQYZII-ZXYWRSMDSA-N 0 0 354.406 3.802 20 5 FHBDRN C[C@H](C[C@H](O)c1ccccc1)NC(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000161738199 938274242 /nfs/dbraw/zinc/27/42/42/938274242.db2.gz YCYWTWJHXDRINL-LBTNJELSSA-N 0 0 374.462 3.704 20 5 FHBDRN C[C@@H](CNC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1)c1ccc(F)cc1 ZINC000536047604 938276730 /nfs/dbraw/zinc/27/67/30/938276730.db2.gz KLXHTIMYKWLIPT-ZDUSSCGKSA-N 0 0 357.385 3.605 20 5 FHBDRN COc1ccc(NC(=O)CSCc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000611775401 938293977 /nfs/dbraw/zinc/29/39/77/938293977.db2.gz ZQHBTBGCNOLUTN-UHFFFAOYSA-N 0 0 350.371 3.614 20 5 FHBDRN C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1)c1cn[nH]c1 ZINC000536071576 938305382 /nfs/dbraw/zinc/30/53/82/938305382.db2.gz VVJVQVXPYQBLMM-GFCCVEGCSA-N 0 0 368.418 3.960 20 5 FHBDRN Cc1cc(OCC(=O)N(CC(F)(F)F)C(C)C)c(Cl)cc1[N+](=O)[O-] ZINC000506415078 945163822 /nfs/dbraw/zinc/16/38/22/945163822.db2.gz IAAWUGREIZYFAN-UHFFFAOYSA-N 0 0 368.739 3.735 20 5 FHBDRN CC(C)Oc1nc(N2CC[C@H](COCc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000583575010 938308105 /nfs/dbraw/zinc/30/81/05/938308105.db2.gz PRSBEZHSGRSDQP-KRWDZBQOSA-N 0 0 371.437 3.820 20 5 FHBDRN CC[C@H](C)NC(=O)CCNc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000052448134 938309830 /nfs/dbraw/zinc/30/98/30/938309830.db2.gz OIVQHROHBLVTLZ-AWEZNQCLSA-N 0 0 369.421 3.543 20 5 FHBDRN O=C(NCc1ccco1)c1cccc(CNc2ccc([N+](=O)[O-])cc2F)c1 ZINC000052454128 938309841 /nfs/dbraw/zinc/30/98/41/938309841.db2.gz XXXOXAFIHJOTAR-UHFFFAOYSA-N 0 0 369.352 3.869 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)F)cc1Sc1nnc(C2CC2)n1C1CC1 ZINC000278331527 938310305 /nfs/dbraw/zinc/31/03/05/938310305.db2.gz IIQAZKCIDFCFLV-UHFFFAOYSA-N 0 0 371.344 3.964 20 5 FHBDRN COc1cccc(CO[C@@H](C)c2nc(-c3ccc([N+](=O)[O-])s3)no2)c1 ZINC000278335405 938311983 /nfs/dbraw/zinc/31/19/83/938311983.db2.gz ZYBCXGUUITYAPJ-JTQLQIEISA-N 0 0 361.379 3.993 20 5 FHBDRN CO[C@H](C)c1nc(CNc2cc(C(F)(F)F)ncc2[N+](=O)[O-])cs1 ZINC000278337585 938314158 /nfs/dbraw/zinc/31/41/58/938314158.db2.gz IXARFXMTRFRJPO-SSDOTTSWSA-N 0 0 362.333 3.785 20 5 FHBDRN O=C(c1ccccc1)c1ccc(NCc2nc(C3CC3)no2)c([N+](=O)[O-])c1 ZINC000052473376 938321993 /nfs/dbraw/zinc/32/19/93/938321993.db2.gz CMJIYTOUNDKFQW-UHFFFAOYSA-N 0 0 364.361 3.698 20 5 FHBDRN CC[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1F)c1ccc(OC)c(OC)c1 ZINC000583619229 938325218 /nfs/dbraw/zinc/32/52/18/938325218.db2.gz CKOKKUOOFRHHAV-HNNXBMFYSA-N 0 0 362.357 3.632 20 5 FHBDRN CCOc1ccc(C(=O)Nc2cc(F)c(F)cc2OC)cc1[N+](=O)[O-] ZINC000583665262 938348456 /nfs/dbraw/zinc/34/84/56/938348456.db2.gz OQZBXMLASIQXGX-UHFFFAOYSA-N 0 0 352.293 3.533 20 5 FHBDRN CCCCOc1ncccc1CNC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000583668135 938351797 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FHBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)NC2CC(c3ccccc3)C2)c1 ZINC000077475305 938375273 /nfs/dbraw/zinc/37/52/73/938375273.db2.gz ZWJBZHSAKXAWJA-UHFFFAOYSA-N 0 0 354.406 3.735 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)N(Cc2cccc(F)c2)C2CCCC2)n1 ZINC000427185973 945169403 /nfs/dbraw/zinc/16/94/03/945169403.db2.gz LBAOTZFUOLSBJK-UHFFFAOYSA-N 0 0 360.389 3.535 20 5 FHBDRN Cc1cc(NC(=O)[C@@H]2OCCc3ccccc32)c2cc([N+](=O)[O-])ccc2n1 ZINC000161852007 938379441 /nfs/dbraw/zinc/37/94/41/938379441.db2.gz YNFMOOPPDWBXTK-LJQANCHMSA-N 0 0 363.373 3.704 20 5 FHBDRN Cc1cc(NC(=O)[C@H]2Cc3cc(F)ccc3O2)c2cc([N+](=O)[O-])ccc2n1 ZINC000161860020 938379645 /nfs/dbraw/zinc/37/96/45/938379645.db2.gz CAWJRWREXOWFIK-GOSISDBHSA-N 0 0 367.336 3.533 20 5 FHBDRN COC[C@@H](OC(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1)c1nccs1 ZINC000278395022 938382937 /nfs/dbraw/zinc/38/29/37/938382937.db2.gz GFHCMEFNOUPKJJ-CQSZACIVSA-N 0 0 350.396 3.719 20 5 FHBDRN Cc1c2ccccc2oc(=O)c1C(=O)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000161866877 938392407 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C[C@H](SCCN1C(=O)c2ccccc2C1=O)c1ccccc1[N+](=O)[O-] ZINC000437258556 945172852 /nfs/dbraw/zinc/17/28/52/945172852.db2.gz LOBSFTDMDJGFDT-LBPRGKRZSA-N 0 0 356.403 3.685 20 5 FHBDRN CC(C)c1ccc(Cl)c(S(=O)(=O)N(C)c2ccc([N+](=O)[O-])nc2)c1 ZINC000583803252 938423126 /nfs/dbraw/zinc/42/31/26/938423126.db2.gz YLNRBKGYRFQZON-UHFFFAOYSA-N 0 0 369.830 3.592 20 5 FHBDRN Cc1c(CNC(=O)N[C@@H](C)CCCc2cccnc2)cccc1[N+](=O)[O-] ZINC000458685984 938426521 /nfs/dbraw/zinc/42/65/21/938426521.db2.gz HQXNAWLFQKWAGA-AWEZNQCLSA-N 0 0 356.426 3.509 20 5 FHBDRN C[C@](NC(=O)Cc1ccccc1[N+](=O)[O-])(c1ccccc1)C(F)(F)F ZINC000536137216 938434129 /nfs/dbraw/zinc/43/41/29/938434129.db2.gz ZICYUMMYLJPEEK-INIZCTEOSA-N 0 0 352.312 3.731 20 5 FHBDRN O=C(c1cc(Cl)ccc1[N+](=O)[O-])N1CCCc2c([N+](=O)[O-])cccc21 ZINC000161900263 938435869 /nfs/dbraw/zinc/43/58/69/938435869.db2.gz BWIQEIWUDJCVAS-UHFFFAOYSA-N 0 0 361.741 3.749 20 5 FHBDRN Cc1cc(N[C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])ccc1C(N)=O ZINC000437259854 945175670 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FHBDRN CCSCc1ccccc1-c1nc(Cc2ccc([N+](=O)[O-])cn2)no1 ZINC000583960595 938504963 /nfs/dbraw/zinc/50/49/63/938504963.db2.gz LBKXOOLVVKZLHK-UHFFFAOYSA-N 0 0 356.407 3.884 20 5 FHBDRN Cn1c2ccccc2cc(CNc2ccnc3c2cccc3[N+](=O)[O-])c1=O ZINC000432141582 945180821 /nfs/dbraw/zinc/18/08/21/945180821.db2.gz WDZNGUCUUHMFQB-UHFFFAOYSA-N 0 0 360.373 3.607 20 5 FHBDRN O=C1[C@@H](Nc2ccnc3c2cccc3[N+](=O)[O-])CCCN1C1CCCCC1 ZINC000432139702 945181074 /nfs/dbraw/zinc/18/10/74/945181074.db2.gz MTBWZKHVMKOQLD-KRWDZBQOSA-N 0 0 368.437 3.879 20 5 FHBDRN O=C(c1csc(-c2ccccn2)n1)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000161976284 938533740 /nfs/dbraw/zinc/53/37/40/938533740.db2.gz USGRYSBFQLCXTK-UHFFFAOYSA-N 0 0 366.402 3.706 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N(C)C[C@@H]1CCCC[C@@H]1O ZINC000507365696 945184529 /nfs/dbraw/zinc/18/45/29/945184529.db2.gz XNPDRCLWERDDME-BBRMVZONSA-N 0 0 366.483 3.720 20 5 FHBDRN C[C@H](NC(=O)c1[nH]ncc1[N+](=O)[O-])c1ccc(-c2ccc(F)cc2)cc1 ZINC000091821012 938547309 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CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@]1(O)CCC[C@H]1C ZINC000584073723 938581403 /nfs/dbraw/zinc/58/14/03/938581403.db2.gz MACBIXUOXVWIJY-ACJLOTCBSA-N 0 0 366.483 3.624 20 5 FHBDRN CC(C)CCOc1ccccc1CNC(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000584086678 938592580 /nfs/dbraw/zinc/59/25/80/938592580.db2.gz XHBYLOILKQNPDI-UHFFFAOYSA-N 0 0 356.422 3.879 20 5 FHBDRN C[C@H](NC(=O)N1CCc2c3ccccc3[nH]c2C1)c1cccc([N+](=O)[O-])c1 ZINC000179045004 938598557 /nfs/dbraw/zinc/59/85/57/938598557.db2.gz BGTQLKCTEUOPEU-ZDUSSCGKSA-N 0 0 364.405 3.905 20 5 FHBDRN C/C(=C\c1cccc([N+](=O)[O-])c1)CNc1ccc(C(N)=O)c(OC(C)C)c1 ZINC000437264529 945189291 /nfs/dbraw/zinc/18/92/91/945189291.db2.gz YONSQHKSRWTLMD-NTEUORMPSA-N 0 0 369.421 3.996 20 5 FHBDRN COc1cc(CNC(=O)Nc2ccc([N+](=O)[O-])cc2)ccc1OC(F)F ZINC000052806293 938605009 /nfs/dbraw/zinc/60/50/09/938605009.db2.gz BTHLSYRLXXTDNB-UHFFFAOYSA-N 0 0 367.308 3.527 20 5 FHBDRN O=C(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)N1CCC[C@H]1c1cccs1 ZINC000278640850 938610046 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362.389 3.588 20 5 FHBDRN CCOC(=O)c1ccnc(NCc2ccc(C(C)(F)F)cc2)c1[N+](=O)[O-] ZINC000432144217 945194136 /nfs/dbraw/zinc/19/41/36/945194136.db2.gz WGPMOQIDVVHFPY-UHFFFAOYSA-N 0 0 365.336 3.890 20 5 FHBDRN O=[N+]([O-])c1ncccc1OS(=O)(=O)c1cc2cc(Cl)ccc2s1 ZINC000176815403 938669878 /nfs/dbraw/zinc/66/98/78/938669878.db2.gz BUQGKDGLEOUEFJ-UHFFFAOYSA-N 0 0 370.795 3.626 20 5 FHBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1CN1C[C@@H](C)C(=O)Nc2ccccc21 ZINC000467141078 938673279 /nfs/dbraw/zinc/67/32/79/938673279.db2.gz HJBFCFCPKOXOFN-CQSZACIVSA-N 0 0 369.421 3.977 20 5 FHBDRN C[C@@H]1CC[C@@H](NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C[C@H]1C ZINC000248639255 938680987 /nfs/dbraw/zinc/68/09/87/938680987.db2.gz YWUVVFXCYUFBGN-BFYDXBDKSA-N 0 0 359.470 3.752 20 5 FHBDRN C[C@H](CNC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1)Oc1ccccc1Cl ZINC000584325729 938687722 /nfs/dbraw/zinc/68/77/22/938687722.db2.gz YKCKDPLXOCPQPP-CHWSQXEVSA-N 0 0 362.813 3.935 20 5 FHBDRN COC(=O)c1cnc(N2CCC[C@H](Cc3ccc(C)cc3)C2)c([N+](=O)[O-])c1 ZINC000584326140 938688387 /nfs/dbraw/zinc/68/83/87/938688387.db2.gz XNGSWOULXXUPFA-MRXNPFEDSA-N 0 0 369.421 3.544 20 5 FHBDRN C[C@H](NC(=O)c1ccc([N+](=O)[O-])s1)c1nc(C(F)(F)F)cs1 ZINC000278731290 938697431 /nfs/dbraw/zinc/69/74/31/938697431.db2.gz LVIKTSJPRSWOJG-YFKPBYRVSA-N 0 0 351.331 3.623 20 5 FHBDRN COc1ccc(NC(=O)N2CCS[C@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000611824614 938698470 /nfs/dbraw/zinc/69/84/70/938698470.db2.gz WTETZOXVEVQYDY-KRWDZBQOSA-N 0 0 373.434 3.925 20 5 FHBDRN COc1ccc2c(c1)ncc([N+](=O)[O-])c2N[C@H](C)c1cnn(C(C)C)c1 ZINC000573196223 938699566 /nfs/dbraw/zinc/69/95/66/938699566.db2.gz JUZUYZFOKOYJGE-GFCCVEGCSA-N 0 0 355.398 3.524 20 5 FHBDRN Cc1cc(Nc2ccc3c(c2)N(C(=O)C(C)(C)C)CCO3)ncc1[N+](=O)[O-] ZINC000074742320 938706737 /nfs/dbraw/zinc/70/67/37/938706737.db2.gz ZILBQHXQSFCWCM-UHFFFAOYSA-N 0 0 370.409 3.813 20 5 FHBDRN CCOC1(CNC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)CCCC1 ZINC000506425431 945202117 /nfs/dbraw/zinc/20/21/17/945202117.db2.gz AGFNIKUORDOWJV-ZDUSSCGKSA-N 0 0 352.456 3.541 20 5 FHBDRN C[C@@H]1C[C@@H](c2cccs2)CN1C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000371002445 945203080 /nfs/dbraw/zinc/20/30/80/945203080.db2.gz ZRNANUZVUDBYIN-ZYHUDNBSSA-N 0 0 361.379 3.583 20 5 FHBDRN O=C(C1CCC(C(F)(F)F)CC1)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000584385237 938793736 /nfs/dbraw/zinc/79/37/36/938793736.db2.gz MAQARMROIXAPCL-UHFFFAOYSA-N 0 0 356.344 3.848 20 5 FHBDRN C[C@H](C(=O)NCc1nc2cccc(Cl)c2n1C)c1cccc([N+](=O)[O-])c1 ZINC000584385182 938793760 /nfs/dbraw/zinc/79/37/60/938793760.db2.gz AQFNPGUQQABSKQ-NSHDSACASA-N 0 0 372.812 3.555 20 5 FHBDRN CCOc1cc(COC(=O)c2c(F)ccc(F)c2F)ccc1[N+](=O)[O-] ZINC000755566380 938802600 /nfs/dbraw/zinc/80/26/00/938802600.db2.gz BQBWWLVQJKGGSP-UHFFFAOYSA-N 0 0 355.268 3.768 20 5 FHBDRN C[C@H](Cc1cccs1)Nc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1 ZINC000077524023 938803352 /nfs/dbraw/zinc/80/33/52/938803352.db2.gz CLZMDJIEBGJIIS-CYBMUJFWSA-N 0 0 359.451 3.935 20 5 FHBDRN CCS[C@H]1CCCC[C@H]1NC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000427210891 945205285 /nfs/dbraw/zinc/20/52/85/945205285.db2.gz FBHQDGAKGBGUJA-WBVHZDCISA-N 0 0 361.467 3.730 20 5 FHBDRN Cc1n[nH]c(C(=O)N(C)[C@H](C)[C@H](C)c2ccc(Cl)cc2)c1[N+](=O)[O-] ZINC000082000299 938806925 /nfs/dbraw/zinc/80/69/25/938806925.db2.gz XOGHXYKVLZFJHJ-GXSJLCMTSA-N 0 0 350.806 3.544 20 5 FHBDRN COc1cc(Cc2nc3cc4ccccc4cc3c(=O)[nH]2)ccc1[N+](=O)[O-] ZINC000083022897 938808922 /nfs/dbraw/zinc/80/89/22/938808922.db2.gz GQSJQCIFKFWEQY-UHFFFAOYSA-N 0 0 361.357 3.584 20 5 FHBDRN O=[N+]([O-])c1ccc2oc(CN3CC=C(c4ccc(O)cc4)CC3)nc2c1 ZINC000083132616 938815430 /nfs/dbraw/zinc/81/54/30/938815430.db2.gz KKJITAOEQQFJNC-UHFFFAOYSA-N 0 0 351.362 3.731 20 5 FHBDRN Cc1cccc(CCNC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)c1 ZINC001125703452 938824999 /nfs/dbraw/zinc/82/49/99/938824999.db2.gz ISZWCAFOLQWVRD-UHFFFAOYSA-N 0 0 352.312 3.895 20 5 FHBDRN CC(=O)c1ccc(NCCc2nccn2Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000024203461 938844419 /nfs/dbraw/zinc/84/44/19/938844419.db2.gz GNMSOESJUJOUJP-UHFFFAOYSA-N 0 0 364.405 3.697 20 5 FHBDRN O=C(NCCc1ccc[nH]1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000089353305 938859145 /nfs/dbraw/zinc/85/91/45/938859145.db2.gz DMCXIKDIDZBANW-UHFFFAOYSA-N 0 0 364.405 3.508 20 5 FHBDRN CCn1c(=O)c2ccccc2nc1SCc1cc([N+](=O)[O-])ccc1OC ZINC000024216764 938862953 /nfs/dbraw/zinc/86/29/53/938862953.db2.gz AJWKMOASBZQVHF-UHFFFAOYSA-N 0 0 371.418 3.626 20 5 FHBDRN CC(C)c1ccc([C@]2(C)CC(=O)N(Cc3ccccc3[N+](=O)[O-])C2=O)cc1 ZINC000431550291 938865021 /nfs/dbraw/zinc/86/50/21/938865021.db2.gz LKMRATRLWJMXRI-NRFANRHFSA-N 0 0 366.417 3.935 20 5 FHBDRN Cn1c(C(=O)N[C@@H]2C[C@H]2c2ccc(Cl)cc2Cl)ccc1[N+](=O)[O-] ZINC000437278750 945210802 /nfs/dbraw/zinc/21/08/02/945210802.db2.gz VCLPMYWLZYEBSE-CMPLNLGQSA-N 0 0 354.193 3.526 20 5 FHBDRN CC(C)COC[C@H](NC(=O)[C@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1)c1ccco1 ZINC001125707722 938868855 /nfs/dbraw/zinc/86/88/55/938868855.db2.gz DRLWGJDVFDRPKA-SQNIBIBYSA-N 0 0 372.421 3.821 20 5 FHBDRN O=[N+]([O-])c1ccc(Nc2cnn(C[C@H]3CCCO3)c2)nc1-c1ccccc1 ZINC000090071762 938870166 /nfs/dbraw/zinc/87/01/66/938870166.db2.gz UJPZWTIVEPFVOB-MRXNPFEDSA-N 0 0 365.393 3.776 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC(C(=O)C(F)(F)F)CC1 ZINC000289896079 938873159 /nfs/dbraw/zinc/87/31/59/938873159.db2.gz UBXOBBBQYJMQLH-UHFFFAOYSA-N 0 0 373.331 3.533 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)c1ccc(Oc2ccccc2)cn1 ZINC000548826900 938873937 /nfs/dbraw/zinc/87/39/37/938873937.db2.gz MNCKTLXCVUMQBD-UHFFFAOYSA-N 0 0 363.373 3.755 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)cnc1N1CCC[C@H](OCc2ccccc2F)C1 ZINC000480351472 938878604 /nfs/dbraw/zinc/87/86/04/938878604.db2.gz BWMIOSJIARJHDZ-AWEZNQCLSA-N 0 0 365.792 3.968 20 5 FHBDRN CC(C)c1ccc(CN2CCC[C@H]2C(=O)NCc2ccco2)cc1[N+](=O)[O-] ZINC000128207348 938901730 /nfs/dbraw/zinc/90/17/30/938901730.db2.gz ZKBUGRIMMJXHOF-SFHVURJKSA-N 0 0 371.437 3.592 20 5 FHBDRN C[C@@H](NC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1)[C@H](C)C1CCCCC1 ZINC000480390344 938905783 /nfs/dbraw/zinc/90/57/83/938905783.db2.gz 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CC(C)c1cc(NC(=O)c2ccc(N3CCC[C@@H](C)C3)c([N+](=O)[O-])c2)n[nH]1 ZINC000143688715 938950339 /nfs/dbraw/zinc/95/03/39/938950339.db2.gz SCDJWGMZYYJMFM-CYBMUJFWSA-N 0 0 371.441 3.930 20 5 FHBDRN CN(Cc1ccco1)C(=O)COc1ccc(-c2ccccc2)cc1[N+](=O)[O-] ZINC000145244481 938952828 /nfs/dbraw/zinc/95/28/28/938952828.db2.gz IRZRJYHEYTUJGE-UHFFFAOYSA-N 0 0 366.373 3.892 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1c(F)cccc1NC(C)C ZINC000158873199 938959024 /nfs/dbraw/zinc/95/90/24/938959024.db2.gz XKVXJNFCLHFENZ-UHFFFAOYSA-N 0 0 367.402 3.663 20 5 FHBDRN O=[N+]([O-])c1cnc(N[C@H](c2cc(F)cc(Br)c2)C2CC2)nc1 ZINC000480505351 938966176 /nfs/dbraw/zinc/96/61/76/938966176.db2.gz GHBRCMDIHIPBAE-ZDUSSCGKSA-N 0 0 367.178 3.850 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1)N1CC[C@H](Oc2ccccc2Cl)C1 ZINC000179123175 938976806 /nfs/dbraw/zinc/97/68/06/938976806.db2.gz WPGIZRLQVVVPQE-AWEZNQCLSA-N 0 0 361.785 3.933 20 5 FHBDRN O=[N+]([O-])c1cc2cnn(CCOCC(F)(F)C(F)F)c2c(Cl)c1 ZINC000468390016 938978032 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362.426 3.845 20 5 FHBDRN Cc1cc(C)c(S(=O)(=O)NCC2CC(c3ccccc3)C2)cc1[N+](=O)[O-] ZINC001211628071 939015517 /nfs/dbraw/zinc/01/55/17/939015517.db2.gz XTCXXYHMXDOVED-UHFFFAOYSA-N 0 0 374.462 3.684 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)c2ccc(OC(F)F)cc2)c1 ZINC000146570396 939016632 /nfs/dbraw/zinc/01/66/32/939016632.db2.gz GPJSVHWADDXINL-SNVBAGLBSA-N 0 0 366.320 3.696 20 5 FHBDRN CC(C)c1ccc(C(=O)Nc2nc(-c3nccn3C)cs2)cc1[N+](=O)[O-] ZINC000188052691 939017276 /nfs/dbraw/zinc/01/72/76/939017276.db2.gz CKEIAJGNEPMPMA-UHFFFAOYSA-N 0 0 371.422 3.828 20 5 FHBDRN O=C(Nc1ccc(OC(=O)C(F)F)cc1)c1cc([N+](=O)[O-])ccc1Cl ZINC000176982719 939025232 /nfs/dbraw/zinc/02/52/32/939025232.db2.gz CKKZWAQEEMJBQQ-UHFFFAOYSA-N 0 0 370.695 3.671 20 5 FHBDRN CN(CCOC(C)(C)C)C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000612051681 939027835 /nfs/dbraw/zinc/02/78/35/939027835.db2.gz FSUKBIBTCVRREJ-UHFFFAOYSA-N 0 0 360.863 3.614 20 5 FHBDRN CSc1cccc(C(=O)NC[C@@H](C[C@@H](C)O)c2ccccc2)c1[N+](=O)[O-] ZINC000188208409 939046222 /nfs/dbraw/zinc/04/62/22/939046222.db2.gz QHFRZERVMAXNHE-UKRRQHHQSA-N 0 0 374.462 3.601 20 5 FHBDRN COc1ccc2c(c1)CC[C@H](NC(=O)c1c(C)cc(C)c([N+](=O)[O-])c1C)C2 ZINC000612087425 939048173 /nfs/dbraw/zinc/04/81/73/939048173.db2.gz FZKIUICYYXARIN-KRWDZBQOSA-N 0 0 368.433 3.816 20 5 FHBDRN Cc1ccc(NC(=O)c2ccc(NCC3(CO)CCC3)c([N+](=O)[O-])c2)cc1 ZINC000612113656 939071704 /nfs/dbraw/zinc/07/17/04/939071704.db2.gz RYCUEOFTASPBKQ-UHFFFAOYSA-N 0 0 369.421 3.730 20 5 FHBDRN CN(C(=O)c1ccc2nc(C(F)(F)F)cn2c1)c1cccc([N+](=O)[O-])c1 ZINC000472361248 939086232 /nfs/dbraw/zinc/08/62/32/939086232.db2.gz RTCXBTJYNLLPTN-UHFFFAOYSA-N 0 0 364.283 3.538 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NCc1ccc(NC(C)=O)cc1 ZINC000179357302 939091645 /nfs/dbraw/zinc/09/16/45/939091645.db2.gz BSBNASNJARDNMC-UHFFFAOYSA-N 0 0 373.434 3.595 20 5 FHBDRN CC[C@@H](CNC(=O)c1cc([N+](=O)[O-])c[nH]1)Oc1ccccc1C(F)(F)F ZINC000440091117 945226749 /nfs/dbraw/zinc/22/67/49/945226749.db2.gz JQHRCPIVQJGKJX-NSHDSACASA-N 0 0 371.315 3.529 20 5 FHBDRN O=C(NC[C@H]1CCC[C@H](C(F)(F)F)C1)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000438923179 945227428 /nfs/dbraw/zinc/22/74/28/945227428.db2.gz XTQFTCJPZRJABA-UWVGGRQHSA-N 0 0 370.331 3.570 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)Nc2cnn(-c3ccc(C)cc3C)c2)c1 ZINC000188265842 939126193 /nfs/dbraw/zinc/12/61/93/939126193.db2.gz BKFDCMODBAZDDQ-UHFFFAOYSA-N 0 0 366.377 3.658 20 5 FHBDRN C[C@@H](Oc1ccc(C(F)(F)F)cc1)C(=O)NCc1ccccc1[N+](=O)[O-] ZINC000188281857 939127893 /nfs/dbraw/zinc/12/78/93/939127893.db2.gz QWHWBDRHXUGUAE-LLVKDONJSA-N 0 0 368.311 3.697 20 5 FHBDRN Cc1ccc(CC(=O)NCc2ccccc2[N+](=O)[O-])cc1Br ZINC000188282053 939127949 /nfs/dbraw/zinc/12/79/49/939127949.db2.gz ZVHICWKLQASIJD-UHFFFAOYSA-N 0 0 363.211 3.525 20 5 FHBDRN O=C(c1ccn(-c2ccccc2[N+](=O)[O-])n1)N1CCC[C@@H]2CCCC[C@H]21 ZINC000179374510 939130502 /nfs/dbraw/zinc/13/05/02/939130502.db2.gz CZRBVMVXMDTNDZ-GOEBONIOSA-N 0 0 354.410 3.575 20 5 FHBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)N1CC[C@H](COCc2ccccc2)C1 ZINC000255712924 939136541 /nfs/dbraw/zinc/13/65/41/939136541.db2.gz RBIWZTNHQRMTNH-POGDKVGISA-N 0 0 366.417 3.673 20 5 FHBDRN CN(C(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1)[C@@H]1CCc2ccccc21 ZINC000179384395 939139390 /nfs/dbraw/zinc/13/93/90/939139390.db2.gz VZGLYYQBCVYFMD-QGZVFWFLSA-N 0 0 362.389 3.540 20 5 FHBDRN CC(=O)Nc1ccc(C)c(C(=O)Nc2ccc3cc([N+](=O)[O-])ccc3n2)c1 ZINC000188289901 939139617 /nfs/dbraw/zinc/13/96/17/939139617.db2.gz DKTJOLWBZSLNOW-UHFFFAOYSA-N 0 0 364.361 3.662 20 5 FHBDRN CC(C)(NC(=O)Nc1ccc2oc(=O)ccc2c1)c1ccc([N+](=O)[O-])cc1 ZINC000177054550 939146625 /nfs/dbraw/zinc/14/66/25/939146625.db2.gz HLCPUYSGFNDPBU-UHFFFAOYSA-N 0 0 367.361 3.758 20 5 FHBDRN COc1ccc(COCCNc2ccnc3c2cccc3[N+](=O)[O-])cc1 ZINC000432160539 945231170 /nfs/dbraw/zinc/23/11/70/945231170.db2.gz DPWGVNQQSMERJL-UHFFFAOYSA-N 0 0 353.378 3.780 20 5 FHBDRN COc1ccc(C[C@@H](C)C(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000179452031 939163834 /nfs/dbraw/zinc/16/38/34/939163834.db2.gz ZKWSTNADDDBXQV-OAHLLOKOSA-N 0 0 368.433 3.973 20 5 FHBDRN COc1ccc(C)cc1[C@@H](C)[NH2+]CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000102692009 939184614 /nfs/dbraw/zinc/18/46/14/939184614.db2.gz OPLJMLVYBWSGAW-CQSZACIVSA-N 0 0 357.410 3.510 20 5 FHBDRN Cc1cccnc1[C@H](NC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1)C(C)C ZINC000124322814 945233299 /nfs/dbraw/zinc/23/32/99/945233299.db2.gz MDIFBGKFFXLMBN-GOSISDBHSA-N 0 0 368.437 3.763 20 5 FHBDRN O=C(c1c[nH]c(=O)c([N+](=O)[O-])c1)N1Cc2ccccc2-c2ccccc2C1 ZINC000188360806 939214081 /nfs/dbraw/zinc/21/40/81/939214081.db2.gz FPSOCYUBGVMUAK-UHFFFAOYSA-N 0 0 361.357 3.518 20 5 FHBDRN CCc1nc([C@H](C)Nc2c3ccccc3n(C)c(=O)c2[N+](=O)[O-])cs1 ZINC000892469065 939222454 /nfs/dbraw/zinc/22/24/54/939222454.db2.gz BSTGTDVESLDVRM-JTQLQIEISA-N 0 0 358.423 3.639 20 5 FHBDRN Cc1ccc([C@@H]2OCCC[C@@H]2NC(=O)Cc2cccc([N+](=O)[O-])c2C)cc1 ZINC000438933652 945238225 /nfs/dbraw/zinc/23/82/25/945238225.db2.gz FPDYVJUMKZTKAZ-RXVVDRJESA-N 0 0 368.433 3.791 20 5 FHBDRN Cc1csc([C@H]2COCCN2Cc2c(Cl)cccc2[N+](=O)[O-])n1 ZINC000432163050 945238366 /nfs/dbraw/zinc/23/83/66/945238366.db2.gz MYMGXMVYNZQLOT-CQSZACIVSA-N 0 0 353.831 3.587 20 5 FHBDRN CC1(C)Oc2ccc(NC(=O)N3CCc4c(cccc4[N+](=O)[O-])C3)cc2O1 ZINC000124334339 945240232 /nfs/dbraw/zinc/24/02/32/945240232.db2.gz CEPQCEMFPCPKJD-UHFFFAOYSA-N 0 0 369.377 3.692 20 5 FHBDRN CC(C)CC(CC(C)C)NC(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F ZINC001125968370 945241540 /nfs/dbraw/zinc/24/15/40/945241540.db2.gz DCUTZTPNPMLRMK-UHFFFAOYSA-N 0 0 353.438 3.991 20 5 FHBDRN Cc1cc(OCC(=O)N2CCC(c3ccccc3)=N2)c(Cl)cc1[N+](=O)[O-] ZINC000506443510 945242922 /nfs/dbraw/zinc/24/29/22/945242922.db2.gz FQAGVMPIUQLICN-UHFFFAOYSA-N 0 0 373.796 3.572 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N(C1CC1)[C@H]1CCc2ccccc21 ZINC000427273393 945243296 /nfs/dbraw/zinc/24/32/96/945243296.db2.gz IWUHRQOINJTWKM-SFHVURJKSA-N 0 0 352.390 3.896 20 5 FHBDRN Cc1ccc(OC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)cc1F ZINC001270577359 945249503 /nfs/dbraw/zinc/24/95/03/945249503.db2.gz QNVZOGRWFBOTIG-UHFFFAOYSA-N 0 0 355.325 3.662 20 5 FHBDRN CCOC(=O)c1csc(CCNc2c(Cl)cccc2[N+](=O)[O-])n1 ZINC000432167782 945255546 /nfs/dbraw/zinc/25/55/46/945255546.db2.gz RSTDHDKONMHVDB-UHFFFAOYSA-N 0 0 355.803 3.536 20 5 FHBDRN CC(C)c1ccc(C(=O)Nc2ccncc2Br)cc1[N+](=O)[O-] ZINC000438948219 945255563 /nfs/dbraw/zinc/25/55/63/945255563.db2.gz MLYPTRCHKOKNLY-UHFFFAOYSA-N 0 0 364.199 3.550 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)NCCc1cc(F)c(F)c(F)c1 ZINC000438948268 945255787 /nfs/dbraw/zinc/25/57/87/945255787.db2.gz CUWWNMAHYQXUJC-UHFFFAOYSA-N 0 0 372.730 3.946 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)NCc1ccn(C2CCCC2)n1 ZINC000438952583 945260813 /nfs/dbraw/zinc/26/08/13/945260813.db2.gz MUPGWNWFPBXZGI-UHFFFAOYSA-N 0 0 362.817 3.798 20 5 FHBDRN COc1cccc([N+](=O)[O-])c1N(C)CC(=O)Nc1c(C)cc(C)cc1C ZINC000516812499 945260842 /nfs/dbraw/zinc/26/08/42/945260842.db2.gz PAQPRXZMLCTRNQ-UHFFFAOYSA-N 0 0 357.410 3.604 20 5 FHBDRN CC(C)(C)c1ccc2c(c1)CN(c1ccc(C(N)=O)cc1[N+](=O)[O-])CC2 ZINC000511843664 945262736 /nfs/dbraw/zinc/26/27/36/945262736.db2.gz JRJBTZPVKPVZMF-UHFFFAOYSA-N 0 0 353.422 3.554 20 5 FHBDRN O=C(NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)[C@H]1CC[C@H](C(F)(F)F)C1 ZINC000518250207 945265199 /nfs/dbraw/zinc/26/51/99/945265199.db2.gz VGRWITVVALMORE-JQWIXIFHSA-N 0 0 369.343 3.713 20 5 FHBDRN CC(C)(C(=O)NCc1ccncc1C(F)(F)F)c1ccc([N+](=O)[O-])cc1 ZINC000519608555 945270291 /nfs/dbraw/zinc/27/02/91/945270291.db2.gz GTXFTUZZGDIMBN-UHFFFAOYSA-N 0 0 367.327 3.603 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1OCC(=O)Nc1ccccc1C(C)(C)C ZINC000506765289 945270310 /nfs/dbraw/zinc/27/03/10/945270310.db2.gz DSIQFOLEKCWGJY-UHFFFAOYSA-N 0 0 358.394 3.918 20 5 FHBDRN Cc1cccc(C(=O)Nc2ccc([C@@H](C)N3CCOCC3)cc2)c1[N+](=O)[O-] ZINC000106405425 945271506 /nfs/dbraw/zinc/27/15/06/945271506.db2.gz DMJCJHPMFGVKLG-OAHLLOKOSA-N 0 0 369.421 3.549 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1CN[C@@H](C)c1ccc(-n2cccn2)c(F)c1 ZINC000550286384 945274571 /nfs/dbraw/zinc/27/45/71/945274571.db2.gz KLMSLVGQDQSVGU-ZDUSSCGKSA-N 0 0 370.384 3.779 20 5 FHBDRN CCOC(=O)c1cccc(NC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000047524386 945275826 /nfs/dbraw/zinc/27/58/26/945275826.db2.gz AQIFUFKWFSWXHL-GFCCVEGCSA-N 0 0 357.366 3.654 20 5 FHBDRN CC(C)c1ccoc1-c1noc(Cc2cc3c(cc2[N+](=O)[O-])OCCO3)n1 ZINC000426248592 945277803 /nfs/dbraw/zinc/27/78/03/945277803.db2.gz BMDBNIMXSFMPNX-UHFFFAOYSA-N 0 0 371.349 3.723 20 5 FHBDRN CCC[C@@]1(C)CCCN(C(=O)c2cc(OC)c(OC)c([N+](=O)[O-])c2)C1 ZINC000437371064 945279624 /nfs/dbraw/zinc/27/96/24/945279624.db2.gz IMUZAMADXOEDBV-SFHVURJKSA-N 0 0 350.415 3.654 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NCc1ccc([C@@H](C)O)cc1 ZINC000179599717 939893142 /nfs/dbraw/zinc/89/31/42/939893142.db2.gz LVZSYUHVAVHNRR-GFCCVEGCSA-N 0 0 360.435 3.690 20 5 FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCCC[C@@H]1C ZINC000179618541 939895917 /nfs/dbraw/zinc/89/59/17/939895917.db2.gz XTOAQMCHGORDHR-KBPBESRZSA-N 0 0 366.483 3.889 20 5 FHBDRN C/C(=C\c1ccc(Cl)cc1)C(=O)OCC(=O)Nc1cccc([N+](=O)[O-])c1 ZINC001125791651 939896324 /nfs/dbraw/zinc/89/63/24/939896324.db2.gz PJXRRSKHKOCJCI-FMIVXFBMSA-N 0 0 374.780 3.833 20 5 FHBDRN O=C(COc1cccc([N+](=O)[O-])c1)OCc1cnc(-c2ccccc2)s1 ZINC000120102662 939899417 /nfs/dbraw/zinc/89/94/17/939899417.db2.gz LADXZSWEWAEFDF-UHFFFAOYSA-N 0 0 370.386 3.841 20 5 FHBDRN CC(C(=O)OC[C@H]1CCCN1C(=O)c1ccccc1[N+](=O)[O-])=C1CCCC1 ZINC000162238912 939909165 /nfs/dbraw/zinc/90/91/65/939909165.db2.gz HUBSKGTVYVOANT-MRXNPFEDSA-N 0 0 372.421 3.633 20 5 FHBDRN CSc1cccc(C(=O)NC[C@H]2CCc3ccccc3C2)c1[N+](=O)[O-] ZINC000614414871 939911571 /nfs/dbraw/zinc/91/15/71/939911571.db2.gz ARTBNHNBOCZNAC-ZDUSSCGKSA-N 0 0 356.447 3.852 20 5 FHBDRN CSc1cccc(C(=O)NCc2c(F)c(F)cc(F)c2F)c1[N+](=O)[O-] ZINC000614415698 939911776 /nfs/dbraw/zinc/91/17/76/939911776.db2.gz REMAKMUSDKNMNI-UHFFFAOYSA-N 0 0 374.315 3.803 20 5 FHBDRN C[C@@H](CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)Sc1ccccc1 ZINC000136306957 939915958 /nfs/dbraw/zinc/91/59/58/939915958.db2.gz ZAJVBTCDAONHLX-ZDUSSCGKSA-N 0 0 369.446 3.916 20 5 FHBDRN O=C(OCc1ncc(C(F)(F)F)s1)[C@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1 ZINC001270582415 945284576 /nfs/dbraw/zinc/28/45/76/945284576.db2.gz MONLQZVUZFSEIC-MNOVXSKESA-N 0 0 372.324 3.917 20 5 FHBDRN O=C(NCc1cccc([N+](=O)[O-])c1)c1c[nH]c2cccc(Br)c12 ZINC000179683643 939923349 /nfs/dbraw/zinc/92/33/49/939923349.db2.gz FAWLFLTZOBDPLV-UHFFFAOYSA-N 0 0 374.194 3.769 20 5 FHBDRN CCn1c(SCc2ncc(C)s2)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000179724801 939929285 /nfs/dbraw/zinc/92/92/85/939929285.db2.gz JPYMGCGSGFCCLB-UHFFFAOYSA-N 0 0 361.452 3.930 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)OCCOCC(F)(F)F ZINC000179755958 939931892 /nfs/dbraw/zinc/93/18/92/939931892.db2.gz MMXFOUXHFHKUPG-UHFFFAOYSA-N 0 0 367.345 3.831 20 5 FHBDRN Cc1cc(C(=O)N[C@H](C)c2cccc(N3CCCC3=O)c2)ccc1[N+](=O)[O-] ZINC000065830773 939934683 /nfs/dbraw/zinc/93/46/83/939934683.db2.gz BMZPCFOCZGVWLG-CQSZACIVSA-N 0 0 367.405 3.521 20 5 FHBDRN CCCc1ccccc1NC(=O)N1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1 ZINC000364382657 939936529 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364.405 3.952 20 5 FHBDRN Cn1cnc(-c2ccc(F)cc2)c1NC(=O)c1cc(F)ccc1[N+](=O)[O-] ZINC000364477865 939950158 /nfs/dbraw/zinc/95/01/58/939950158.db2.gz APGNUQGKJPOTCS-UHFFFAOYSA-N 0 0 358.304 3.526 20 5 FHBDRN Cc1coc(-c2cc(NC(=O)COc3ccccc3[N+](=O)[O-])ccc2C)n1 ZINC000120855536 945284836 /nfs/dbraw/zinc/28/48/36/945284836.db2.gz FARSCTQDGIVSCT-UHFFFAOYSA-N 0 0 367.361 3.884 20 5 FHBDRN C[C@@H](c1ccc(C(=O)N(C)c2ccc([N+](=O)[O-])nc2)cc1)C(F)(F)F ZINC000410812346 939961639 /nfs/dbraw/zinc/96/16/39/939961639.db2.gz XGFGOJHTYIVQDZ-JTQLQIEISA-N 0 0 353.300 3.932 20 5 FHBDRN Cc1cccc(C(=O)N2CCCC2)c1NC(=O)c1ccc([N+](=O)[O-])cc1C ZINC000154058079 939962447 /nfs/dbraw/zinc/96/24/47/939962447.db2.gz TWONGQUTTNXFEV-UHFFFAOYSA-N 0 0 367.405 3.700 20 5 FHBDRN O=C(c1cc(F)c([N+](=O)[O-])cc1F)N1CC2(CCOCC2)c2ccccc21 ZINC000364612172 939968407 /nfs/dbraw/zinc/96/84/07/939968407.db2.gz IZKFMQYOSAKQPO-UHFFFAOYSA-N 0 0 374.343 3.582 20 5 FHBDRN CC(C)(NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(F)(F)F ZINC000410955660 939978532 /nfs/dbraw/zinc/97/85/32/939978532.db2.gz SMGSXSKCHYKEQJ-UHFFFAOYSA-N 0 0 359.329 3.789 20 5 FHBDRN CC(C)(NC(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-])C(F)(F)F ZINC000410960940 939978663 /nfs/dbraw/zinc/97/86/63/939978663.db2.gz FXRYOLRMWUZPBJ-UHFFFAOYSA-N 0 0 353.300 3.728 20 5 FHBDRN Cc1cccc(-c2nnc(SCC(=O)Nc3ccccc3[N+](=O)[O-])o2)c1 ZINC000005434710 939980363 /nfs/dbraw/zinc/98/03/63/939980363.db2.gz IYCAWPLYQBKPDP-UHFFFAOYSA-N 0 0 370.390 3.684 20 5 FHBDRN COC(=O)c1cc(C(=O)N2CC[C@H](C)c3cccc(C)c32)cc([N+](=O)[O-])c1 ZINC000410985463 939981190 /nfs/dbraw/zinc/98/11/90/939981190.db2.gz VDTROUVBIYNOQZ-LBPRGKRZSA-N 0 0 368.389 3.844 20 5 FHBDRN O=C(Nc1cccc(I)c1)c1ccc([N+](=O)[O-])s1 ZINC000005443558 939982991 /nfs/dbraw/zinc/98/29/91/939982991.db2.gz AYOAHWPXBXHACZ-UHFFFAOYSA-N 0 0 374.159 3.513 20 5 FHBDRN COC[C@H]1CCN1C(=O)c1ccccc1Sc1ccccc1[N+](=O)[O-] ZINC000410974891 939983817 /nfs/dbraw/zinc/98/38/17/939983817.db2.gz MCOXJXFAJDXJBY-CYBMUJFWSA-N 0 0 358.419 3.607 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)c1cc(-c2ccco2)n[nH]1 ZINC000065864898 939985069 /nfs/dbraw/zinc/98/50/69/939985069.db2.gz FPZUOXPUSDNAKX-UHFFFAOYSA-N 0 0 354.366 3.629 20 5 FHBDRN C[C@H]1COCCN1C(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000411011411 939986026 /nfs/dbraw/zinc/98/60/26/939986026.db2.gz MHGAQAPOEZTHDM-ZDUSSCGKSA-N 0 0 358.419 3.607 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)Nc1cc(Cl)cnc1OC(C)C ZINC000411051680 939991562 /nfs/dbraw/zinc/99/15/62/939991562.db2.gz UIHORQONQFBXRV-UHFFFAOYSA-N 0 0 365.773 3.691 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1cc(-c2ncco2)ccc1C ZINC000364781002 939999298 /nfs/dbraw/zinc/99/92/98/939999298.db2.gz YAVJZDIJKAGSAG-UHFFFAOYSA-N 0 0 353.334 3.819 20 5 FHBDRN O=C(Nc1ccccc1)C1CCN(Cc2cc(F)ccc2[N+](=O)[O-])CC1 ZINC000047541417 945288269 /nfs/dbraw/zinc/28/82/69/945288269.db2.gz NPOHVDCLFJQWGV-UHFFFAOYSA-N 0 0 357.385 3.585 20 5 FHBDRN CCc1ccc([C@@H](C)NC(=O)Cc2c(F)c(OC)ccc2[N+](=O)[O-])cc1 ZINC000411139409 940002386 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FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N[C@@H](C)CCc1ccc(O)cc1 ZINC000179862758 940013994 /nfs/dbraw/zinc/01/39/94/940013994.db2.gz LWNYGMPYRWEPMZ-AWEZNQCLSA-N 0 0 356.422 3.977 20 5 FHBDRN CN(C)c1ccccc1NC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000136536573 940020335 /nfs/dbraw/zinc/02/03/35/940020335.db2.gz XZAONCBCLHFFAY-UHFFFAOYSA-N 0 0 354.410 3.857 20 5 FHBDRN CC[C@@H](SC)C(=O)Nc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1 ZINC000437365499 945290978 /nfs/dbraw/zinc/29/09/78/945290978.db2.gz OUFJRDJHFKOCII-MRXNPFEDSA-N 0 0 358.419 3.906 20 5 FHBDRN CCCOc1cccc(NC(=O)Cc2c(F)c(OC)ccc2[N+](=O)[O-])c1 ZINC000411379997 940033476 /nfs/dbraw/zinc/03/34/76/940033476.db2.gz GIXRGJUYVYWKMO-UHFFFAOYSA-N 0 0 362.357 3.713 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H](C)c1c(C)cccc1C ZINC000411354804 940035609 /nfs/dbraw/zinc/03/56/09/940035609.db2.gz NUGLFCNXIBSFJB-HNNXBMFYSA-N 0 0 369.421 3.644 20 5 FHBDRN CCCOc1ccc(NC(=O)C(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)cc1 ZINC000411403894 940039511 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Cc1cc(NC(=O)C(=O)Nc2cccc(C3CCC3)c2)ccc1[N+](=O)[O-] ZINC000411546036 940061283 /nfs/dbraw/zinc/06/12/83/940061283.db2.gz RXDQXJUSYVJOEF-UHFFFAOYSA-N 0 0 353.378 3.748 20 5 FHBDRN CCO[C@H]1CCCN(C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1 ZINC000612432979 940064995 /nfs/dbraw/zinc/06/49/95/940064995.db2.gz XXRJVLZXOYFSQP-NSHDSACASA-N 0 0 361.320 3.646 20 5 FHBDRN COCCOc1ccc(NC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)cc1F ZINC000411597177 940069169 /nfs/dbraw/zinc/06/91/69/940069169.db2.gz RTCKKAPQJYJEOX-JKSUJKDBSA-N 0 0 374.368 3.501 20 5 FHBDRN C[C@H](C(=O)Nc1ccc2c(c1)OCCCO2)c1ccc([N+](=O)[O-])cc1F ZINC000612442111 940071158 /nfs/dbraw/zinc/07/11/58/940071158.db2.gz HVPLDSJCWAUPMF-NSHDSACASA-N 0 0 360.341 3.637 20 5 FHBDRN Cc1c(Br)c(NCC(C)(C)c2ccncc2)ncc1[N+](=O)[O-] ZINC000612449568 940075338 /nfs/dbraw/zinc/07/53/38/940075338.db2.gz KWPISFQSOAYQBJ-UHFFFAOYSA-N 0 0 365.231 3.845 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N1CCC[C@@]2(CCCCO2)C1 ZINC000365197870 940080304 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Cc1ccc(C(=O)NCC2CC2)cc1NC(=O)c1ccc(C)c([N+](=O)[O-])c1 ZINC000188585146 940185675 /nfs/dbraw/zinc/18/56/75/940185675.db2.gz UDKUNZDFASZTHC-UHFFFAOYSA-N 0 0 367.405 3.604 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1F)NC1CCN(c2cccs2)CC1 ZINC000612616096 940187047 /nfs/dbraw/zinc/18/70/47/940187047.db2.gz VVCULAHFKPASFF-UHFFFAOYSA-N 0 0 364.402 3.586 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1F)N1CC[C@H](Oc2cccc(F)c2)C1 ZINC000612616799 940187422 /nfs/dbraw/zinc/18/74/22/940187422.db2.gz YZRFBIARGKFAMN-AWEZNQCLSA-N 0 0 363.320 3.558 20 5 FHBDRN CCc1cccc(CC(=O)N2CCS[C@@H]2c2ccc([N+](=O)[O-])cc2)c1 ZINC000507525473 945302280 /nfs/dbraw/zinc/30/22/80/945302280.db2.gz DWJNISGGVXHKGO-LJQANCHMSA-N 0 0 356.447 3.974 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1[C@H](C)Sc1nnc(-c2ccncc2)n1C ZINC000179984547 940197420 /nfs/dbraw/zinc/19/74/20/940197420.db2.gz WIPJJCVNFBMGRE-LBPRGKRZSA-N 0 0 355.423 3.947 20 5 FHBDRN CCOc1ccc(C(=O)N2CCc3cc([N+](=O)[O-])ccc32)cc1OCC ZINC000612646235 940200208 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FHBDRN COc1ccccc1Oc1ccc(NC(=O)c2ccc([N+](=O)[O-])n2C)cc1 ZINC000612705111 940232560 /nfs/dbraw/zinc/23/25/60/940232560.db2.gz JIZXQEHLJXFVQT-UHFFFAOYSA-N 0 0 367.361 3.987 20 5 FHBDRN COc1ccc(NCc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)cc1OC ZINC000177552857 940274553 /nfs/dbraw/zinc/27/45/53/940274553.db2.gz SXPWALGUXUPUMA-UHFFFAOYSA-N 0 0 368.393 3.625 20 5 FHBDRN Nc1nccc(C(=O)N[C@@H]2CCC[C@@H](c3cccc(Cl)c3)C2)c1[N+](=O)[O-] ZINC000570410617 940293978 /nfs/dbraw/zinc/29/39/78/940293978.db2.gz IMOJVDLLHHPUPQ-TZMCWYRMSA-N 0 0 374.828 3.512 20 5 FHBDRN Cc1cc2c(cc1C)N(S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])CC2 ZINC000507553353 945309617 /nfs/dbraw/zinc/30/96/17/945309617.db2.gz RNIGLHIGEPXSKK-UHFFFAOYSA-N 0 0 366.826 3.616 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(NC(=O)C(C)C)cc2)c1 ZINC000548961252 940300070 /nfs/dbraw/zinc/30/00/70/940300070.db2.gz NGENTBHZAAWOAE-UHFFFAOYSA-N 0 0 371.393 3.840 20 5 FHBDRN O=C(c1ccc(Br)cc1[N+](=O)[O-])N1CC2(C1)CCCCC2 ZINC000612851375 940309043 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O=[N+]([O-])c1cc(F)ccc1/C=C\c1nc(Cc2ccc3c(c2)CCO3)no1 ZINC000612912254 940337680 /nfs/dbraw/zinc/33/76/80/940337680.db2.gz VGTMJSDZNPWFAX-UTCJRWHESA-N 0 0 367.336 3.813 20 5 FHBDRN COc1cccc([C@@H](C)c2noc(Cc3ccc(OC)c([N+](=O)[O-])c3)n2)c1 ZINC000612917325 940339138 /nfs/dbraw/zinc/33/91/38/940339138.db2.gz JWGRQJCLGROXCH-GFCCVEGCSA-N 0 0 369.377 3.738 20 5 FHBDRN CN(Cc1nc(Cc2c[nH]c3ccc([N+](=O)[O-])cc23)no1)c1ccccc1 ZINC000612961997 940363368 /nfs/dbraw/zinc/36/33/68/940363368.db2.gz NCRYBXCNODIFMZ-UHFFFAOYSA-N 0 0 363.377 3.686 20 5 FHBDRN O=[N+]([O-])c1ccc(Cc2noc([C@@H]3CCc4c3cccc4Cl)n2)nc1 ZINC000612969321 940367615 /nfs/dbraw/zinc/36/76/15/940367615.db2.gz YJLSNMFGYDLPFO-CQSZACIVSA-N 0 0 356.769 3.695 20 5 FHBDRN COc1ccc(CSc2nnc(Cc3cccs3)o2)cc1[N+](=O)[O-] ZINC000066261368 940370745 /nfs/dbraw/zinc/37/07/45/940370745.db2.gz XIMACOHCRGOKOM-UHFFFAOYSA-N 0 0 363.420 3.931 20 5 FHBDRN COc1cc(C(=O)N[C@H]2CC[C@H](c3ccccc3)C2)c([N+](=O)[O-])cc1OC ZINC000376148507 940371756 /nfs/dbraw/zinc/37/17/56/940371756.db2.gz IOVNXVUTLGKWFC-GJZGRUSLSA-N 0 0 370.405 3.678 20 5 FHBDRN CCOCCCNC(=O)c1cc([N+](=O)[O-])ccc1SC1CCCC1 ZINC000124621323 945312934 /nfs/dbraw/zinc/31/29/34/945312934.db2.gz IHSBORQTDREWKT-UHFFFAOYSA-N 0 0 352.456 3.786 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H](C)Oc3ccc(C)cc32)c1 ZINC000548972488 940388561 /nfs/dbraw/zinc/38/85/61/940388561.db2.gz VVHOVUSGCADJQY-CYBMUJFWSA-N 0 0 356.378 3.730 20 5 FHBDRN CC[C@@H](C)[C@@H](NC(=O)c1nn(CC)cc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000427358997 945313972 /nfs/dbraw/zinc/31/39/72/945313972.db2.gz TVVYYAVFCLAPBT-IAQYHMDHSA-N 0 0 364.833 3.982 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)C(F)(F)F)cc1N1CC(c2ccccn2)C1 ZINC000894845687 945314155 /nfs/dbraw/zinc/31/41/55/945314155.db2.gz KPLNKPYOVLCHSG-UHFFFAOYSA-N 0 0 374.269 3.643 20 5 FHBDRN CCOc1cc(OCc2noc(-c3ccc(OC)cc3)n2)ccc1[N+](=O)[O-] ZINC000188611154 940404287 /nfs/dbraw/zinc/40/42/87/940404287.db2.gz QAZXMMPZQKGFIO-UHFFFAOYSA-N 0 0 371.349 3.631 20 5 FHBDRN Cc1cc(C)c(NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)cc1O ZINC000613032120 940408343 /nfs/dbraw/zinc/40/83/43/940408343.db2.gz ZZNCHPUDYGCFHN-UHFFFAOYSA-N 0 0 352.293 3.771 20 5 FHBDRN Cc1cc(C)c(NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)cc1O ZINC000613032410 940408368 /nfs/dbraw/zinc/40/83/68/940408368.db2.gz ILLCLUDCSSELOI-UHFFFAOYSA-N 0 0 352.293 3.771 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc2nc(C)c(C)nc2c1 ZINC000579903921 940421039 /nfs/dbraw/zinc/42/10/39/940421039.db2.gz BAJCPITVMCOPBT-UHFFFAOYSA-N 0 0 350.378 3.970 20 5 FHBDRN C[C@@H]1CCc2c(F)cccc2[C@@H]1NC(=O)NCc1ccccc1[N+](=O)[O-] ZINC000431731932 940430962 /nfs/dbraw/zinc/43/09/62/940430962.db2.gz KNUWZZZNYDMEQI-KZULUSFZSA-N 0 0 357.385 3.857 20 5 FHBDRN C[C@H]1CCc2c(F)cccc2[C@@H]1NC(=O)NCc1ccccc1[N+](=O)[O-] ZINC000431731931 940430995 /nfs/dbraw/zinc/43/09/95/940430995.db2.gz KNUWZZZNYDMEQI-KPZWWZAWSA-N 0 0 357.385 3.857 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)Nc2cccc(COC(C)(C)C)c2C)n1 ZINC000427370077 945320893 /nfs/dbraw/zinc/32/08/93/945320893.db2.gz NNLBENVWRHCTOX-UHFFFAOYSA-N 0 0 360.414 3.687 20 5 FHBDRN CC(C)[C@](C)(O)CNC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 ZINC000440211092 945321426 /nfs/dbraw/zinc/32/14/26/945321426.db2.gz FRASZLULLWOOIP-LJQANCHMSA-N 0 0 358.394 3.524 20 5 FHBDRN CCc1ccccc1-c1noc(COc2ccc([N+](=O)[O-])c(OC)c2)n1 ZINC000545611270 945321784 /nfs/dbraw/zinc/32/17/84/945321784.db2.gz QJNPFEQFDZHXIY-UHFFFAOYSA-N 0 0 355.350 3.795 20 5 FHBDRN CCc1cc2c(ncnc2Oc2ccc(C(=O)OC)c([N+](=O)[O-])c2)s1 ZINC000613114310 940454012 /nfs/dbraw/zinc/45/40/12/940454012.db2.gz WIFWDHAZZMZFCV-UHFFFAOYSA-N 0 0 359.363 3.741 20 5 FHBDRN Cc1ccc(CS(=O)(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1C ZINC000580237747 940470366 /nfs/dbraw/zinc/47/03/66/940470366.db2.gz DKLGZVGMPGDKJE-HNNXBMFYSA-N 0 0 362.451 3.701 20 5 FHBDRN Cc1ccc2ncc(-c3noc(-c4c[nH]c5ccc([N+](=O)[O-])cc45)n3)n2c1 ZINC000580258211 940471079 /nfs/dbraw/zinc/47/10/79/940471079.db2.gz RLQBNDZZRFLEHG-UHFFFAOYSA-N 0 0 360.333 3.749 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N1CC[C@@H](C2CCOCC2)C1 ZINC000376210995 940473033 /nfs/dbraw/zinc/47/30/33/940473033.db2.gz MRGQOGVVYUVSKX-GFCCVEGCSA-N 0 0 353.806 3.529 20 5 FHBDRN C[C@H]1C[C@H](c2ccsc2)CN1c1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1 ZINC000376212649 940474664 /nfs/dbraw/zinc/47/46/64/940474664.db2.gz OLKYUVAWJCBFNA-JQWIXIFHSA-N 0 0 356.407 3.688 20 5 FHBDRN CC(C)(C)n1cc(-c2noc(C(C)(C)c3ccccc3[N+](=O)[O-])n2)cn1 ZINC000426600601 945324076 /nfs/dbraw/zinc/32/40/76/945324076.db2.gz JWADPLAGUCBXSO-UHFFFAOYSA-N 0 0 355.398 3.922 20 5 FHBDRN Cc1ccc(-c2csc(NC(=O)[C@@H]3CCC(=O)[C@@H](C)C3)n2)cc1[N+](=O)[O-] ZINC000580587833 940479891 /nfs/dbraw/zinc/47/98/91/940479891.db2.gz FYAIQYWRLCHLEK-WCQYABFASA-N 0 0 373.434 3.971 20 5 FHBDRN Cc1ccc(-c2csc(NC(=O)[C@H]3CCC(=O)[C@@H](C)C3)n2)cc1[N+](=O)[O-] ZINC000580587831 940480012 /nfs/dbraw/zinc/48/00/12/940480012.db2.gz FYAIQYWRLCHLEK-AAEUAGOBSA-N 0 0 373.434 3.971 20 5 FHBDRN O=C(c1ncsc1C(F)(F)F)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000549006519 940485645 /nfs/dbraw/zinc/48/56/45/940485645.db2.gz KCIJVIXBDRIACH-UHFFFAOYSA-N 0 0 371.340 3.875 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@@H](c3ccc(F)cc3)C2)c1 ZINC000549006437 940485728 /nfs/dbraw/zinc/48/57/28/940485728.db2.gz NUUMBGDVKDOHNR-CQSZACIVSA-N 0 0 358.369 3.762 20 5 FHBDRN NC(=O)c1ccc(NCCCO[C@H]2CCCc3ccccc32)c([N+](=O)[O-])c1 ZINC000427384632 945330174 /nfs/dbraw/zinc/33/01/74/945330174.db2.gz PAIMTYMQLJTYRB-IBGZPJMESA-N 0 0 369.421 3.590 20 5 FHBDRN CCc1ccc([C@H]2CN(C(=O)[C@H](C)c3cccc([N+](=O)[O-])c3)CCO2)cc1 ZINC000580986435 940491598 /nfs/dbraw/zinc/49/15/98/940491598.db2.gz PHRXKUCHAHOXCR-FOIQADDNSA-N 0 0 368.433 3.861 20 5 FHBDRN C[C@@H](C(=O)N1CCN([C@H](C)c2ccsc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000581166119 940494779 /nfs/dbraw/zinc/49/47/79/940494779.db2.gz PBPRVMJANIFVQN-HUUCEWRRSA-N 0 0 373.478 3.665 20 5 FHBDRN CCOc1cc(C(=O)N(C)C[C@H](C)c2ccccc2)c([N+](=O)[O-])cc1OC ZINC000066459546 940494892 /nfs/dbraw/zinc/49/48/92/940494892.db2.gz DJKPVGALQYSXBQ-AWEZNQCLSA-N 0 0 372.421 3.878 20 5 FHBDRN C[C@@H](c1nc(CCn2cnc3ccccc32)no1)c1cccc([N+](=O)[O-])c1 ZINC000581183862 940495094 /nfs/dbraw/zinc/49/50/94/940495094.db2.gz VMCPSJKHMSLACF-CYBMUJFWSA-N 0 0 363.377 3.722 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])n[nH]1)N1CCCC[C@H]1c1ccccc1C(F)(F)F ZINC000511462151 940495370 /nfs/dbraw/zinc/49/53/70/940495370.db2.gz LWQTWYLUCWYSTA-ZDUSSCGKSA-N 0 0 368.315 3.704 20 5 FHBDRN Cc1nnc(CCNc2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])s1 ZINC000581282531 940498334 /nfs/dbraw/zinc/49/83/34/940498334.db2.gz FYFPTAVGTGPZPS-UHFFFAOYSA-N 0 0 368.418 3.640 20 5 FHBDRN O=c1c([N+](=O)[O-])cc2c(n1Cc1csc(C3CCCC3)n1)CCCC2 ZINC000581310257 940498488 /nfs/dbraw/zinc/49/84/88/940498488.db2.gz RUTLBRDTSCCAPM-UHFFFAOYSA-N 0 0 359.451 3.798 20 5 FHBDRN CN(C(=O)CSCc1cccc(Cl)c1)c1ccc([N+](=O)[O-])nc1 ZINC000581393426 940503272 /nfs/dbraw/zinc/50/32/72/940503272.db2.gz QIOHZBLHLQKGGC-UHFFFAOYSA-N 0 0 351.815 3.539 20 5 FHBDRN O=C(N[C@@H](c1noc(-c2ccccc2[N+](=O)[O-])n1)C1CC1)c1ccccc1 ZINC000581455725 940504235 /nfs/dbraw/zinc/50/42/35/940504235.db2.gz XCRCSBKPCWGDPW-MRXNPFEDSA-N 0 0 364.361 3.526 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1nc(Cc2ccccc2)cs1 ZINC000427382902 945330260 /nfs/dbraw/zinc/33/02/60/945330260.db2.gz GWSCWJUBOQVDLY-UHFFFAOYSA-N 0 0 369.402 3.903 20 5 FHBDRN COc1nc(C)cc(C)c1CNC(=O)Nc1cc([N+](=O)[O-])c(C)cc1C ZINC000613296337 940506269 /nfs/dbraw/zinc/50/62/69/940506269.db2.gz SXDAVTHMCBPENG-UHFFFAOYSA-N 0 0 358.398 3.554 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NC[C@H]1OCCc2ccccc21 ZINC000613300705 940508833 /nfs/dbraw/zinc/50/88/33/940508833.db2.gz XEYVCCUSQBWGEX-GOSISDBHSA-N 0 0 355.394 3.647 20 5 FHBDRN O=C(CCc1nc(C2Cc3ccccc3C2)no1)c1cccc([N+](=O)[O-])c1 ZINC000581708418 940510485 /nfs/dbraw/zinc/51/04/85/940510485.db2.gz QHNLVMWRJXBTFZ-UHFFFAOYSA-N 0 0 363.373 3.676 20 5 FHBDRN CC(=O)Nc1cc(Cl)ccc1NC(=O)Cc1ccc(F)cc1[N+](=O)[O-] ZINC001125809808 940510970 /nfs/dbraw/zinc/51/09/70/940510970.db2.gz GGKNSFWGOZZTRB-UHFFFAOYSA-N 0 0 365.748 3.527 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)Nc2ccnn2Cc2ccccc2F)c1C ZINC001125809835 940511168 /nfs/dbraw/zinc/51/11/68/940511168.db2.gz GPJNZBYVUIHNCH-UHFFFAOYSA-N 0 0 368.368 3.848 20 5 FHBDRN Cc1c(NC(=O)NCc2ccc(Br)cc2)cccc1[N+](=O)[O-] ZINC000106578352 945330692 /nfs/dbraw/zinc/33/06/92/945330692.db2.gz QVQBOESCADEZQF-UHFFFAOYSA-N 0 0 364.199 3.987 20 5 FHBDRN Cc1c(C(=O)N2C[C@@H](c3ccccc3)OCC2(C)C)cccc1[N+](=O)[O-] ZINC000066512847 940592512 /nfs/dbraw/zinc/59/25/12/940592512.db2.gz KKCFBDMQSIOFNE-SFHVURJKSA-N 0 0 354.406 3.896 20 5 FHBDRN Cc1nn(CCC(=O)NC2(c3cccc(C)c3)CCCC2)c(C)c1[N+](=O)[O-] ZINC000066511449 940592897 /nfs/dbraw/zinc/59/28/97/940592897.db2.gz WGOKHJYSRXFGFF-UHFFFAOYSA-N 0 0 370.453 3.692 20 5 FHBDRN Cc1cccc(C)c1OC[C@H](C)NC(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000511480463 940596539 /nfs/dbraw/zinc/59/65/39/940596539.db2.gz JWUQJVNHWMQCQO-INIZCTEOSA-N 0 0 372.421 3.564 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)NCCCc1cccc(F)c1 ZINC000511480702 940597927 /nfs/dbraw/zinc/59/79/27/940597927.db2.gz DJPLFAIWJKPXSL-UHFFFAOYSA-N 0 0 359.401 3.551 20 5 FHBDRN Cc1noc(C)c1[C@@H](C)CNC(=O)c1c([N+](=O)[O-])cccc1C(F)(F)F ZINC000581851993 940627347 /nfs/dbraw/zinc/62/73/47/940627347.db2.gz NFDQCXIFPSIVDO-QMMMGPOBSA-N 0 0 371.315 3.752 20 5 FHBDRN CCCOc1ccc(S(=O)(=O)Nc2cc([N+](=O)[O-])ccc2CC)cc1 ZINC000581856750 940627802 /nfs/dbraw/zinc/62/78/02/940627802.db2.gz MZXNOCCFVJCZEG-UHFFFAOYSA-N 0 0 364.423 3.747 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)Nc1cccc(C(=O)OC(C)(C)C)c1 ZINC000581886280 940629836 /nfs/dbraw/zinc/62/98/36/940629836.db2.gz YLHYPHFPDZDFEV-UHFFFAOYSA-N 0 0 357.366 3.506 20 5 FHBDRN CCC[C@H](Cc1ccccc1)N(CCC)C(=O)Cn1cc([N+](=O)[O-])nc1C ZINC000066545968 940632880 /nfs/dbraw/zinc/63/28/80/940632880.db2.gz MBYSYYAXCYLLIS-GOSISDBHSA-N 0 0 372.469 3.750 20 5 FHBDRN CCCc1ccc(NC(=O)C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000178066802 940632972 /nfs/dbraw/zinc/63/29/72/940632972.db2.gz NQWRUSPJFOAGNG-CQSZACIVSA-N 0 0 369.421 3.672 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N1CCc2ccc(OC)cc2CC1 ZINC000581995838 940639973 /nfs/dbraw/zinc/63/99/73/940639973.db2.gz DRNZMBPNCOGMHF-UHFFFAOYSA-N 0 0 369.421 3.799 20 5 FHBDRN CC(C)CCSc1ccc(C(=O)N2Cc3cncnc3C2)cc1[N+](=O)[O-] ZINC000582132526 940649273 /nfs/dbraw/zinc/64/92/73/940649273.db2.gz PDKOBGMAECLZAZ-UHFFFAOYSA-N 0 0 372.450 3.679 20 5 FHBDRN CCc1ccc([C@@H]2CCN(C(=O)NCc3ccccc3[N+](=O)[O-])C2)cc1 ZINC000431816738 940652829 /nfs/dbraw/zinc/65/28/29/940652829.db2.gz YXMNQMDIPMKEEO-GOSISDBHSA-N 0 0 353.422 3.856 20 5 FHBDRN Cc1cccc2c1CC[C@@H]2Nc1cc(CN2CCOCC2)ccc1[N+](=O)[O-] ZINC000582221363 940654916 /nfs/dbraw/zinc/65/49/16/940654916.db2.gz YQNQAKWGPNUBHS-IBGZPJMESA-N 0 0 367.449 3.835 20 5 FHBDRN CCOC(=O)c1cc(COC)cc(NCc2cccc([N+](=O)[O-])c2C)c1 ZINC000427404183 945338351 /nfs/dbraw/zinc/33/83/51/945338351.db2.gz AHFOQZHXVJMANB-UHFFFAOYSA-N 0 0 358.394 3.838 20 5 FHBDRN Cc1ccccc1C1(C(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)CC1 ZINC000582325241 940665708 /nfs/dbraw/zinc/66/57/08/940665708.db2.gz AGOLJXPVBZHMKX-UHFFFAOYSA-N 0 0 363.417 3.775 20 5 FHBDRN O=C(c1cc(N2CCC[C@H]2c2ccccn2)ccc1[N+](=O)[O-])N1CCCC1 ZINC000582395864 940669547 /nfs/dbraw/zinc/66/95/47/940669547.db2.gz QEYOOSQVWQMJMS-IBGZPJMESA-N 0 0 366.421 3.567 20 5 FHBDRN COc1ccc2c(c1)CCCCN2C(=O)c1ccc([N+](=O)[O-])cc1OC ZINC000427407354 945339369 /nfs/dbraw/zinc/33/93/69/945339369.db2.gz XAOXOXXCJZKLPU-UHFFFAOYSA-N 0 0 356.378 3.595 20 5 FHBDRN Cc1ccc(-c2ccnn2C)cc1NC(=O)c1c(F)cccc1[N+](=O)[O-] ZINC001270598226 945339795 /nfs/dbraw/zinc/33/97/95/945339795.db2.gz RGCOQIDWZDUUGJ-UHFFFAOYSA-N 0 0 354.341 3.695 20 5 FHBDRN Cc1nc(CS(=O)(=O)[C@@H](C)c2cc([N+](=O)[O-])ccc2C)sc1C ZINC000180149743 940699183 /nfs/dbraw/zinc/69/91/83/940699183.db2.gz MFFHWZBKKWIOSN-LBPRGKRZSA-N 0 0 354.453 3.653 20 5 FHBDRN O=[N+]([O-])c1ccc2ncnc(N3CCO[C@H](c4cccc(Cl)c4)C3)c2c1 ZINC000613431323 940702108 /nfs/dbraw/zinc/70/21/08/940702108.db2.gz ZLVSKIVHUCRRHE-KRWDZBQOSA-N 0 0 370.796 3.769 20 5 FHBDRN O=[N+]([O-])c1ncccc1N1CCN(c2c(Cl)cccc2Cl)CC1 ZINC000613433356 940703810 /nfs/dbraw/zinc/70/38/10/940703810.db2.gz DXTTYDLYNZYLJN-UHFFFAOYSA-N 0 0 353.209 3.623 20 5 FHBDRN COc1cc(C(=O)Nc2c(F)cccc2NC2CC2)cc([N+](=O)[O-])c1C ZINC000188649395 940734934 /nfs/dbraw/zinc/73/49/34/940734934.db2.gz DULYMFXFLWIHJT-UHFFFAOYSA-N 0 0 359.357 3.878 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N1CC[C@](F)(c2ccccc2F)C1 ZINC000549025773 940737287 /nfs/dbraw/zinc/73/72/87/940737287.db2.gz PZCYDQAAUJKOLK-LJQANCHMSA-N 0 0 360.360 3.764 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1OC(F)F)N1CCC[C@H](C(F)(F)F)C1 ZINC000180167716 940742979 /nfs/dbraw/zinc/74/29/79/940742979.db2.gz BZMAGMGDOLZTLG-QMMMGPOBSA-N 0 0 368.258 3.611 20 5 FHBDRN O=C(Nc1cc(Cl)ccc1NCc1ccccc1)c1cc([N+](=O)[O-])n[nH]1 ZINC000582624231 940754638 /nfs/dbraw/zinc/75/46/38/940754638.db2.gz GMMMHSYJSDTOHX-UHFFFAOYSA-N 0 0 371.784 3.836 20 5 FHBDRN O=C(N[C@@H](c1nccs1)C(F)(F)F)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000507591521 945346051 /nfs/dbraw/zinc/34/60/51/945346051.db2.gz VJTSOBFUNOCVQF-NSHDSACASA-N 0 0 371.296 3.831 20 5 FHBDRN CCN(Cc1ccc(Cl)s1)C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000180179643 940765462 /nfs/dbraw/zinc/76/54/62/940765462.db2.gz FICDQMJZDZLRLZ-UHFFFAOYSA-N 0 0 368.798 3.701 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN[C@@H](C(C)(C)C)C(F)(F)F ZINC000540917114 940786505 /nfs/dbraw/zinc/78/65/05/940786505.db2.gz CPXBQJVFSINWPB-AWEZNQCLSA-N 0 0 361.364 3.798 20 5 FHBDRN CN1Cc2c(cccc2N[C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)C1=O ZINC000414230158 940802365 /nfs/dbraw/zinc/80/23/65/940802365.db2.gz SXNQJNLQBHKGKZ-SFHVURJKSA-N 0 0 351.406 3.614 20 5 FHBDRN CC[C@H](NC(=O)c1nn(CC)cc1[N+](=O)[O-])c1cccc2ccccc21 ZINC000894850064 945350244 /nfs/dbraw/zinc/35/02/44/945350244.db2.gz HSIBLEDYUFLTFD-INIZCTEOSA-N 0 0 352.394 3.846 20 5 FHBDRN Cn1ncc([N+](=O)[O-])c1Nc1cccc(C[S@](=O)C2CCCCC2)c1 ZINC000892577253 940823370 /nfs/dbraw/zinc/82/33/70/940823370.db2.gz QFKRZELSPREPFF-VWLOTQADSA-N 0 0 362.455 3.653 20 5 FHBDRN O=C(Nc1cccc(NC(=O)C2CCCCC2)c1)c1ccc([N+](=O)[O-])[nH]1 ZINC000427430436 945355790 /nfs/dbraw/zinc/35/57/90/945355790.db2.gz CBCPSQOOSQXYNP-UHFFFAOYSA-N 0 0 356.382 3.694 20 5 FHBDRN O=C(Nc1c(F)cccc1F)c1ccc(Br)cc1[N+](=O)[O-] ZINC000175502042 940872936 /nfs/dbraw/zinc/87/29/36/940872936.db2.gz DAVWDBWPSZRLOB-UHFFFAOYSA-N 0 0 357.110 3.888 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)Nc1c(F)cccc1Br ZINC000175516906 940882454 /nfs/dbraw/zinc/88/24/54/940882454.db2.gz JXSAJJLCNBFPHK-UHFFFAOYSA-N 0 0 369.146 3.757 20 5 FHBDRN CC(C)(NC(=O)N[C@@H](CCCO)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000175573671 940890253 /nfs/dbraw/zinc/89/02/53/940890253.db2.gz GNXZKVFLNDFWLM-SFHVURJKSA-N 0 0 371.437 3.643 20 5 FHBDRN COc1c(O)ccc(CN[C@@H](C)c2ccccc2OC(C)C)c1[N+](=O)[O-] ZINC000892600140 940901719 /nfs/dbraw/zinc/90/17/19/940901719.db2.gz PQFOJFPRSJCUQX-ZDUSSCGKSA-N 0 0 360.410 3.947 20 5 FHBDRN CC(C)(C(=O)NC1CCC(C)(c2ccccc2)CC1)n1cc([N+](=O)[O-])cn1 ZINC000427420898 945358694 /nfs/dbraw/zinc/35/86/94/945358694.db2.gz MYAUDRBIEVCLRN-UHFFFAOYSA-N 0 0 370.453 3.543 20 5 FHBDRN COc1cc(OCC(=O)N2CC[C@@H](C)C[C@@H]2c2ccco2)ccc1[N+](=O)[O-] ZINC000175668822 940906677 /nfs/dbraw/zinc/90/66/77/940906677.db2.gz XYPUPSPEOATHQV-CZUORRHYSA-N 0 0 374.393 3.575 20 5 FHBDRN Cc1nc(NC(=O)Cc2csc(-c3cccc(F)c3)n2)ccc1[N+](=O)[O-] ZINC000175678159 940907723 /nfs/dbraw/zinc/90/77/23/940907723.db2.gz VSBVFNLGVXYPSB-UHFFFAOYSA-N 0 0 372.381 3.742 20 5 FHBDRN O=C(N[C@@H]1C[C@H]2OCCC[C@H]12)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000188669730 940916674 /nfs/dbraw/zinc/91/66/74/940916674.db2.gz QAUJLNRYQTYAGQ-SZVBFZGTSA-N 0 0 367.405 3.636 20 5 FHBDRN CCC[C@H]1SCCN1C(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000511864170 945360342 /nfs/dbraw/zinc/36/03/42/945360342.db2.gz KIYKMTIBVPYPMS-CYBMUJFWSA-N 0 0 373.272 3.981 20 5 FHBDRN O=[N+]([O-])c1ccc2oc(CN3CCO[C@H](CCc4ccccc4)C3)nc2c1 ZINC000186063493 940939572 /nfs/dbraw/zinc/93/95/72/940939572.db2.gz PRHFNPYEVZNCMQ-QGZVFWFLSA-N 0 0 367.405 3.570 20 5 FHBDRN COc1ccc(CNC(=O)CCCc2ccccc2Cl)cc1[N+](=O)[O-] ZINC000582934195 940947452 /nfs/dbraw/zinc/94/74/52/940947452.db2.gz DYDPRHFXXACIGG-UHFFFAOYSA-N 0 0 362.813 3.896 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc3oc(COC)nc3c2)c1 ZINC000549064697 940972631 /nfs/dbraw/zinc/97/26/31/940972631.db2.gz UBKRPEPJQLJORQ-UHFFFAOYSA-N 0 0 371.349 3.533 20 5 FHBDRN Cc1cc(F)c2[nH]c(=O)cc(C(=O)N(C)Cc3ccccc3[N+](=O)[O-])c2c1 ZINC000180334836 940977655 /nfs/dbraw/zinc/97/76/55/940977655.db2.gz WBKUFEKPARXJDV-UHFFFAOYSA-N 0 0 369.352 3.568 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)c1cccc2c1OCCO2 ZINC000180470420 941019249 /nfs/dbraw/zinc/01/92/49/941019249.db2.gz RPUKJIYEXQGWRU-UHFFFAOYSA-N 0 0 368.267 3.637 20 5 FHBDRN CCN(Cc1c(F)cccc1F)C(=O)c1ccc([N+](=O)[O-])cc1OC ZINC000427445212 945368165 /nfs/dbraw/zinc/36/81/65/945368165.db2.gz ZBCXFBJFZLVMRA-UHFFFAOYSA-N 0 0 350.321 3.544 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)NCCC1CCCC1 ZINC000176347905 941024466 /nfs/dbraw/zinc/02/44/66/941024466.db2.gz UHVQZSMVIMVXMB-UHFFFAOYSA-N 0 0 355.232 3.596 20 5 FHBDRN CC(C)c1nnc2n1CCN(C(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1)[C@H]2C ZINC000188712124 941030473 /nfs/dbraw/zinc/03/04/73/941030473.db2.gz LZBCWWPCWMHAFA-ZDUSSCGKSA-N 0 0 371.441 3.650 20 5 FHBDRN CCc1cc(NC(=O)c2ccc(C)nc2C)c2cc([N+](=O)[O-])ccc2n1 ZINC000180505547 941035154 /nfs/dbraw/zinc/03/51/54/941035154.db2.gz TUIKGSCHPJOEDZ-UHFFFAOYSA-N 0 0 350.378 3.970 20 5 FHBDRN CC(=O)c1cc(N[C@@H](c2ccn(C)n2)c2ccc(F)cc2)ccc1[N+](=O)[O-] ZINC000376452201 941037319 /nfs/dbraw/zinc/03/73/19/941037319.db2.gz YDSOPGCEXKOTAA-LJQANCHMSA-N 0 0 368.368 3.872 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CC(C)(C)OC1(C)C ZINC000180529186 941037471 /nfs/dbraw/zinc/03/74/71/941037471.db2.gz YSDUJAKEDAUWNW-BXUZGUMPSA-N 0 0 352.456 3.538 20 5 FHBDRN CCCCN1CCc2ccc(NC(=O)Cc3ccccc3[N+](=O)[O-])cc21 ZINC000472594547 941042177 /nfs/dbraw/zinc/04/21/77/941042177.db2.gz ARCGPMDMFRQOCU-UHFFFAOYSA-N 0 0 353.422 3.939 20 5 FHBDRN O=[N+]([O-])c1ccccc1-c1ccc(CN2CCO[C@H]([C@@H]3CCCO3)C2)s1 ZINC000180562989 941048027 /nfs/dbraw/zinc/04/80/27/941048027.db2.gz UQMZYXBWAZHTMM-ROUUACIJSA-N 0 0 374.462 3.703 20 5 FHBDRN C[C@H](NC(=O)c1c(N)cccc1[N+](=O)[O-])c1ccc(OC(F)(F)F)cc1 ZINC000180641090 941059224 /nfs/dbraw/zinc/05/92/24/941059224.db2.gz MFYVAMAYAISOLN-VIFPVBQESA-N 0 0 369.299 3.567 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1F)N1CC[C@@H](OCCCc2ccccc2)C1 ZINC000176596673 941062859 /nfs/dbraw/zinc/06/28/59/941062859.db2.gz MDEZRZKRMWGRLB-QGZVFWFLSA-N 0 0 372.396 3.598 20 5 FHBDRN CC(C)Oc1ccc(CC[C@@H](C)NC(=O)c2c(N)cccc2[N+](=O)[O-])cc1 ZINC000180678990 941063165 /nfs/dbraw/zinc/06/31/65/941063165.db2.gz JTRAESBVKYDIMS-CQSZACIVSA-N 0 0 371.437 3.715 20 5 FHBDRN CCC(=O)Nc1cccc(C(=O)Nc2ccc3cc([N+](=O)[O-])ccc3n2)c1 ZINC000176703585 941070303 /nfs/dbraw/zinc/07/03/03/941070303.db2.gz IETWHMPSXFCSEC-UHFFFAOYSA-N 0 0 364.361 3.744 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2nc(CN(Cc3cccnc3)C3CC3)co2)cc1 ZINC000180742804 941070752 /nfs/dbraw/zinc/07/07/52/941070752.db2.gz ZBXXIHWBXCAYGK-UHFFFAOYSA-N 0 0 350.378 3.809 20 5 FHBDRN Cc1cnc(OCC(=O)N(Cc2ccco2)c2ccccc2)c([N+](=O)[O-])c1 ZINC000176706882 941070761 /nfs/dbraw/zinc/07/07/61/941070761.db2.gz BPEMPVJNGOZJSU-UHFFFAOYSA-N 0 0 367.361 3.503 20 5 FHBDRN COc1ccccc1OCCC(=O)Nc1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000176702970 941072185 /nfs/dbraw/zinc/07/21/85/941072185.db2.gz HXOXDZILDLIXPB-UHFFFAOYSA-N 0 0 367.361 3.559 20 5 FHBDRN COC(=O)c1cc([N+](=O)[O-])c(NCc2nccc3ccccc32)cc1OC ZINC001167702716 941073914 /nfs/dbraw/zinc/07/39/14/941073914.db2.gz FUTFRZXSXTUROK-UHFFFAOYSA-N 0 0 367.361 3.550 20 5 FHBDRN COc1cccc2[nH]cc(CC(=O)N[C@@H](C)c3cccc([N+](=O)[O-])c3)c21 ZINC000180774576 941074819 /nfs/dbraw/zinc/07/48/19/941074819.db2.gz JWWJSDFVUAWBIE-LBPRGKRZSA-N 0 0 353.378 3.505 20 5 FHBDRN O=C(c1cc2c(c([N+](=O)[O-])c1)OCO2)N1CCC[C@H]1CCc1ccccc1 ZINC000180776500 941074905 /nfs/dbraw/zinc/07/49/05/941074905.db2.gz SVINFTLLGAFPMJ-INIZCTEOSA-N 0 0 368.389 3.561 20 5 FHBDRN C[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1)c1noc(-c2ccc(Cl)cc2)n1 ZINC000176772631 941075978 /nfs/dbraw/zinc/07/59/78/941075978.db2.gz QLFNHGJXEBEPDW-JTQLQIEISA-N 0 0 372.768 3.789 20 5 FHBDRN C[C@H](NC(=O)c1c(N)cccc1[N+](=O)[O-])c1cccc(Cl)c1Cl ZINC000180792617 941076919 /nfs/dbraw/zinc/07/69/19/941076919.db2.gz QUXXUAMWTYNLQJ-QMMMGPOBSA-N 0 0 354.193 3.975 20 5 FHBDRN CCN([C@@H](C)Cc1ccsc1)S(=O)(=O)c1c(C)cccc1[N+](=O)[O-] ZINC000188763592 941077276 /nfs/dbraw/zinc/07/72/76/941077276.db2.gz PRCCTTQJCSDBHT-ZDUSSCGKSA-N 0 0 368.480 3.607 20 5 FHBDRN O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(F)cc1OCC(F)F ZINC000180799687 941079132 /nfs/dbraw/zinc/07/91/32/941079132.db2.gz GNANINLHYCGKCB-UHFFFAOYSA-N 0 0 354.284 3.559 20 5 FHBDRN Nc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(COC2CCCC2)cc1 ZINC000180803950 941079946 /nfs/dbraw/zinc/07/99/46/941079946.db2.gz DPMHZBRLWFOQBK-UHFFFAOYSA-N 0 0 355.394 3.889 20 5 FHBDRN Cc1ccccc1[C@H]1CCCN1C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000180807331 941080743 /nfs/dbraw/zinc/08/07/43/941080743.db2.gz YMKWVJQSPZHWOR-OAHLLOKOSA-N 0 0 354.362 3.609 20 5 FHBDRN C[C@@H](NC(=O)c1c(N)cccc1[N+](=O)[O-])c1ccc(-c2ccncc2)cc1 ZINC000180838027 941084407 /nfs/dbraw/zinc/08/44/07/941084407.db2.gz MJRSTZNSHUQFMC-CYBMUJFWSA-N 0 0 362.389 3.730 20 5 FHBDRN CCOc1cccc2cc([C@H](C)NC(=O)c3c(N)cccc3[N+](=O)[O-])oc21 ZINC000180891393 941088406 /nfs/dbraw/zinc/08/84/06/941088406.db2.gz TZXUGPVRXRKHJJ-NSHDSACASA-N 0 0 369.377 3.813 20 5 FHBDRN Cn1ccc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3OC(F)F)cc21 ZINC000180903081 941090545 /nfs/dbraw/zinc/09/05/45/941090545.db2.gz GUFUQSCTRKLUOY-UHFFFAOYSA-N 0 0 361.304 3.940 20 5 FHBDRN O=[N+]([O-])c1ccc2oc(CN3CCN(c4ccc(Cl)cc4)CC3)nc2c1 ZINC000177024156 941094615 /nfs/dbraw/zinc/09/46/15/941094615.db2.gz GQEPODXRFFNBAF-UHFFFAOYSA-N 0 0 372.812 3.712 20 5 FHBDRN O=C(Nc1ccnn1-c1ccccc1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000541006141 941100112 /nfs/dbraw/zinc/10/01/12/941100112.db2.gz MSJBQFHTSWAIHD-UHFFFAOYSA-N 0 0 374.303 3.634 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[C@@H](Oc2cccc(F)c2)C1 ZINC000188826453 941100807 /nfs/dbraw/zinc/10/08/07/941100807.db2.gz PEPNBKALXZCBJE-MRXNPFEDSA-N 0 0 359.357 3.728 20 5 FHBDRN Nc1cccc([N+](=O)[O-])c1C(=O)NCc1ccc(OC2CCCCC2)cc1 ZINC000181005668 941102798 /nfs/dbraw/zinc/10/27/98/941102798.db2.gz XCPYQFOSSOZRNF-UHFFFAOYSA-N 0 0 369.421 3.819 20 5 FHBDRN O=C(CCc1ccoc1)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F ZINC000177131654 941102866 /nfs/dbraw/zinc/10/28/66/941102866.db2.gz NEKQVBRKKCXCDR-UHFFFAOYSA-N 0 0 356.300 3.712 20 5 FHBDRN CC(=O)c1ccc(N[C@@H](c2nccn2C)c2cccc(F)c2)c([N+](=O)[O-])c1 ZINC000365525425 941103567 /nfs/dbraw/zinc/10/35/67/941103567.db2.gz CIGQAICVBROJNH-GOSISDBHSA-N 0 0 368.368 3.872 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1OC(F)F)N1CC[C@H](c2ccccc2)C1 ZINC000181151110 941109047 /nfs/dbraw/zinc/10/90/47/941109047.db2.gz REDLHTPYRKQRJN-ZDUSSCGKSA-N 0 0 362.332 3.826 20 5 FHBDRN COC[C@H](NC(=O)c1ccc([N+](=O)[O-])c(Cl)c1)c1ccc(F)c(F)c1 ZINC000181136144 941110621 /nfs/dbraw/zinc/11/06/21/941110621.db2.gz CYKQHWNJGRTWCA-AWEZNQCLSA-N 0 0 370.739 3.644 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N[C@H]2CCCC[C@H]2C(C)C)cc1OC ZINC000103056141 941115092 /nfs/dbraw/zinc/11/50/92/941115092.db2.gz YXXIQFYPYJTBMS-ZFWWWQNUSA-N 0 0 364.442 3.947 20 5 FHBDRN Cc1nn(-c2ccccc2)cc1NC(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000181235533 941116662 /nfs/dbraw/zinc/11/66/62/941116662.db2.gz SJDJMHSJEHTZQQ-UHFFFAOYSA-N 0 0 350.378 3.660 20 5 FHBDRN C[C@H](NCc1cc(F)ccc1[N+](=O)[O-])c1ccc(N2CCOC2=O)cc1 ZINC000181274324 941118556 /nfs/dbraw/zinc/11/85/56/941118556.db2.gz MTTGVOKOSZODGH-LBPRGKRZSA-N 0 0 359.357 3.541 20 5 FHBDRN Cc1nn(-c2ccccc2)cc1CNC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000188851056 941118764 /nfs/dbraw/zinc/11/87/64/941118764.db2.gz SLJDUMANOJFRIO-UHFFFAOYSA-N 0 0 365.393 3.719 20 5 FHBDRN C[C@@H]1CN(C(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)CC[C@H]1c1ccccc1 ZINC000181272777 941119451 /nfs/dbraw/zinc/11/94/51/941119451.db2.gz PEZFLTURNXGRSJ-CZUORRHYSA-N 0 0 368.389 3.589 20 5 FHBDRN C[C@H](NCc1c(F)cccc1[N+](=O)[O-])c1ccc(N2CCOC2=O)cc1 ZINC000181287707 941120323 /nfs/dbraw/zinc/12/03/23/941120323.db2.gz BDFWDAOEBISFEX-LBPRGKRZSA-N 0 0 359.357 3.541 20 5 FHBDRN CC[C@@H](c1ccc(F)cc1F)S(=O)(=O)Cc1ccccc1[N+](=O)[O-] ZINC000414419704 941120515 /nfs/dbraw/zinc/12/05/15/941120515.db2.gz UESODIJAQDZRDL-INIZCTEOSA-N 0 0 355.362 3.939 20 5 FHBDRN CC[C@H](NC(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1)c1cccs1 ZINC000188871506 941123219 /nfs/dbraw/zinc/12/32/19/941123219.db2.gz VMOBAVRZOBSEAK-HNNXBMFYSA-N 0 0 361.423 3.580 20 5 FHBDRN Cc1cc(C(=O)Nc2ccccc2-c2nncn2C(C)C)cc([N+](=O)[O-])c1 ZINC000177501200 941130022 /nfs/dbraw/zinc/13/00/22/941130022.db2.gz GOSHUFOCABBTKV-UHFFFAOYSA-N 0 0 365.393 3.995 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)c2occc2Br)cc1[N+](=O)[O-] ZINC000177547582 941133711 /nfs/dbraw/zinc/13/37/11/941133711.db2.gz ZZEUAVUUVIYPIM-VIFPVBQESA-N 0 0 353.172 3.750 20 5 FHBDRN CCSc1cc(CNC(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)ccn1 ZINC000189096795 941145473 /nfs/dbraw/zinc/14/54/73/941145473.db2.gz CVZMYWBYIKDLJR-LLVKDONJSA-N 0 0 363.414 3.661 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)Nc1ccc(Cl)c(OC(F)F)c1 ZINC000181393287 941145496 /nfs/dbraw/zinc/14/54/96/941145496.db2.gz JTOVQGXSFLXEGB-UHFFFAOYSA-N 0 0 357.700 3.805 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)Nc1cc(F)cc(F)c1Br ZINC000189067469 941146247 /nfs/dbraw/zinc/14/62/47/941146247.db2.gz KZWIDIFWPVETTN-UHFFFAOYSA-N 0 0 372.125 3.591 20 5 FHBDRN CN(CC1(CO)CC1)C(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000189114130 941146754 /nfs/dbraw/zinc/14/67/54/941146754.db2.gz HKARLFUNPQYINO-UHFFFAOYSA-N 0 0 372.446 3.591 20 5 FHBDRN Cc1c(NCC(=O)Nc2ccc(OC(F)F)cc2)cccc1[N+](=O)[O-] ZINC000007975231 941148930 /nfs/dbraw/zinc/14/89/30/941148930.db2.gz BWKVFONBSAJDEH-UHFFFAOYSA-N 0 0 351.309 3.555 20 5 FHBDRN COc1cc(Br)ccc1CNCc1csc([N+](=O)[O-])c1 ZINC000189186863 941151152 /nfs/dbraw/zinc/15/11/52/941151152.db2.gz QKPUFMRGBRGJLW-UHFFFAOYSA-N 0 0 357.229 3.717 20 5 FHBDRN C[C@@H](C1CC1)n1cc(NCc2cc([N+](=O)[O-])ccc2OC(F)F)cn1 ZINC000189255036 941154131 /nfs/dbraw/zinc/15/41/31/941154131.db2.gz WFRHRXGGTUYQKM-JTQLQIEISA-N 0 0 352.341 3.976 20 5 FHBDRN CCOc1ccc(C(=O)N(C)CC2(c3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000189214140 941154563 /nfs/dbraw/zinc/15/45/63/941154563.db2.gz LLRIBGMAFRVBJN-UHFFFAOYSA-N 0 0 354.406 3.797 20 5 FHBDRN Cc1csc([C@@H]2COCCN2Cc2ccc(Cl)cc2[N+](=O)[O-])n1 ZINC000189308852 941155728 /nfs/dbraw/zinc/15/57/28/941155728.db2.gz HBTWMZMTJYTPQD-AWEZNQCLSA-N 0 0 353.831 3.587 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCc1cc(F)ccc1OC ZINC000189416339 941157358 /nfs/dbraw/zinc/15/73/58/941157358.db2.gz XFSCWMGEVOYIST-AWEZNQCLSA-N 0 0 360.385 3.628 20 5 FHBDRN Cn1cc(CCNC(=O)c2ccccc2[N+](=O)[O-])c2ccc(Cl)cc21 ZINC000189355363 941157507 /nfs/dbraw/zinc/15/75/07/941157507.db2.gz QNLYJNHGCJPEDO-UHFFFAOYSA-N 0 0 357.797 3.712 20 5 FHBDRN CC[C@](C)(O)CN(Cc1ccccc1)C(=O)c1ccc(C)c([N+](=O)[O-])c1 ZINC000189467324 941158517 /nfs/dbraw/zinc/15/85/17/941158517.db2.gz NPALUQVPMGDMIJ-FQEVSTJZSA-N 0 0 356.422 3.707 20 5 FHBDRN CC(C)CC[C@@H](NC(=O)C(=O)Nc1cc(F)cc([N+](=O)[O-])c1)C(C)(C)C ZINC000472624769 941159964 /nfs/dbraw/zinc/15/99/64/941159964.db2.gz SIWCHKLLWUGQPI-OAHLLOKOSA-N 0 0 367.421 3.640 20 5 FHBDRN Cc1c([C@H]2CCCN2C(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)cnn1C ZINC000120155386 941161592 /nfs/dbraw/zinc/16/15/92/941161592.db2.gz HZONBPVXNUATAV-MRXNPFEDSA-N 0 0 357.414 3.623 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)c1ccncc1OC ZINC000189591407 941166571 /nfs/dbraw/zinc/16/65/71/941166571.db2.gz XHWOAGDVWHCGMR-NSHDSACASA-N 0 0 361.423 3.601 20 5 FHBDRN COc1cnccc1[C@H](C)NC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000189612558 941221699 /nfs/dbraw/zinc/22/16/99/941221699.db2.gz UAIBOSPEAOXKHQ-VIFPVBQESA-N 0 0 369.299 3.508 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCCCC[C@H]1c1ncon1 ZINC000189635533 941235933 /nfs/dbraw/zinc/23/59/33/941235933.db2.gz YGQKQNSDIYNVHC-WBVHZDCISA-N 0 0 372.425 3.690 20 5 FHBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])N1C[C@@H]2CCCC[C@H]2C1 ZINC000178367603 941237236 /nfs/dbraw/zinc/23/72/36/941237236.db2.gz OTGTXWJDRBGIDH-STQMWFEESA-N 0 0 352.818 3.666 20 5 FHBDRN O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCCC[C@@H]1c1noc(C2CC2)n1 ZINC000376583634 941241223 /nfs/dbraw/zinc/24/12/23/941241223.db2.gz YUNPGSNSTZIGIN-SIFUEBAJSA-N 0 0 368.393 3.622 20 5 FHBDRN CO[C@@H](CNC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)c1ccccc1 ZINC000178469880 941262942 /nfs/dbraw/zinc/26/29/42/941262942.db2.gz UPTIAKUJRISPAM-HNNXBMFYSA-N 0 0 368.311 3.731 20 5 FHBDRN CCOCc1nc(C)cc(Oc2ccc(Br)cc2[N+](=O)[O-])n1 ZINC000892683672 941263655 /nfs/dbraw/zinc/26/36/55/941263655.db2.gz MVNZAJUIFQSCIP-UHFFFAOYSA-N 0 0 368.187 3.785 20 5 FHBDRN C[C@H](NC(=O)c1ccc([N+](=O)[O-])c2cccnc12)c1ccc(Cl)cn1 ZINC000189755984 941273255 /nfs/dbraw/zinc/27/32/55/941273255.db2.gz MEQFGIDJJFKYMF-JTQLQIEISA-N 0 0 356.769 3.682 20 5 FHBDRN C[C@H](NC(=O)Nc1cc2c(cc1F)NC(=O)CC2)c1cccc([N+](=O)[O-])c1 ZINC000189765413 941277573 /nfs/dbraw/zinc/27/75/73/941277573.db2.gz MDWYVEDHDRHDCF-JTQLQIEISA-N 0 0 372.356 3.501 20 5 FHBDRN Cc1cc(NCCC(=O)N2CCCCC2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000549105454 941283400 /nfs/dbraw/zinc/28/34/00/941283400.db2.gz FQQJMJZMOVBUEG-UHFFFAOYSA-N 0 0 359.348 3.737 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N1CC2(CCOCC2)c2ccccc21 ZINC000189819186 941283813 /nfs/dbraw/zinc/28/38/13/941283813.db2.gz XGVCLISNKPQWAD-UHFFFAOYSA-N 0 0 366.417 3.622 20 5 FHBDRN COc1cc(C(=O)N2CCc3c([nH]c4ccccc43)C2)cc([N+](=O)[O-])c1C ZINC000189827119 941284220 /nfs/dbraw/zinc/28/42/20/941284220.db2.gz SRJQMLYERSSQNJ-UHFFFAOYSA-N 0 0 365.389 3.592 20 5 FHBDRN CC[C@@](C)(COc1ncccc1Cl)NC(=O)c1csc([N+](=O)[O-])c1 ZINC000178736861 941299787 /nfs/dbraw/zinc/29/97/87/941299787.db2.gz YUOCSROZDAFIKA-HNNXBMFYSA-N 0 0 369.830 3.682 20 5 FHBDRN Cc1ccc(C(=O)O[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1Cl ZINC000728673340 941305444 /nfs/dbraw/zinc/30/54/44/941305444.db2.gz MKCMFHQWUQYWGF-LLVKDONJSA-N 0 0 362.769 3.741 20 5 FHBDRN CC(C)[C@@H]1CCCC[C@@H]1NC(=O)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000103326264 941352653 /nfs/dbraw/zinc/35/26/53/941352653.db2.gz PVDYFGVZNRKDLV-JSGCOSHPSA-N 0 0 367.833 3.518 20 5 FHBDRN Cc1nc2c(s1)[C@H](Nc1cc3c(cc1[N+](=O)[O-])CCC(=O)N3)CCC2 ZINC000376638038 941370255 /nfs/dbraw/zinc/37/02/55/941370255.db2.gz VSOYEMBMLDZRAI-GFCCVEGCSA-N 0 0 358.423 3.734 20 5 FHBDRN CN(c1ccccc1)c1ccc(C[N@H+](C)CCCC(=O)[O-])cc1[N+](=O)[O-] ZINC000414635541 941420437 /nfs/dbraw/zinc/42/04/37/941420437.db2.gz HJZDLRNMPOMOAK-UHFFFAOYSA-N 0 0 357.410 3.659 20 5 FHBDRN O=C(c1ccc(-n2cccc2)c(F)c1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000110186371 941445166 /nfs/dbraw/zinc/44/51/66/941445166.db2.gz DQIMYFWBAWTXDD-UHFFFAOYSA-N 0 0 351.337 3.728 20 5 FHBDRN CCc1ccc(C(=O)N2CCN(c3ccccc3F)C[C@H]2C)cc1[N+](=O)[O-] ZINC000616106531 941449511 /nfs/dbraw/zinc/44/95/11/941449511.db2.gz WDDUQBAHAKAUSQ-CQSZACIVSA-N 0 0 371.412 3.647 20 5 FHBDRN C[C@H](SCc1c([N+](=O)[O-])ncn1C)c1nc(-c2cccc(F)c2)no1 ZINC000376940018 941470741 /nfs/dbraw/zinc/47/07/41/941470741.db2.gz DGVZRVBWDYIKBF-VIFPVBQESA-N 0 0 363.374 3.512 20 5 FHBDRN CC(=O)Nc1cc(N[C@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)ccc1C ZINC000472649204 941471204 /nfs/dbraw/zinc/47/12/04/941471204.db2.gz TXDKLCBDQRMWNC-DOTOQJQBSA-N 0 0 357.414 3.654 20 5 FHBDRN C[C@H](NC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-])c1cccc(O)c1 ZINC000183649147 941528422 /nfs/dbraw/zinc/52/84/22/941528422.db2.gz YSTOTYQKJIBJJN-JTQLQIEISA-N 0 0 366.826 3.923 20 5 FHBDRN CC(=O)c1ccc([N+](=O)[O-])cc1N1CC[C@@H](n2cc3ccccc3n2)C1 ZINC000377192994 941551513 /nfs/dbraw/zinc/55/15/13/941551513.db2.gz NKEOVXHFNSDMIM-MRXNPFEDSA-N 0 0 350.378 3.599 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CCC(F)(c2ccccn2)CC1 ZINC000565093677 941566241 /nfs/dbraw/zinc/56/62/41/941566241.db2.gz OKXJKBCURPMWSS-DLBZAZTESA-N 0 0 369.396 3.581 20 5 FHBDRN Cc1ccc(Cc2ccccn2)cc1NC(=O)c1cccc([N+](=O)[O-])c1N ZINC000549164398 941569087 /nfs/dbraw/zinc/56/90/87/941569087.db2.gz FPKCRALKYWRNKG-UHFFFAOYSA-N 0 0 362.389 3.724 20 5 FHBDRN Cc1c(NC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)cnn1CCC(C)C ZINC000122349299 941590640 /nfs/dbraw/zinc/59/06/40/941590640.db2.gz WMFRCVHBDMYFFR-UHFFFAOYSA-N 0 0 355.398 3.879 20 5 FHBDRN CCN(C(=O)c1ccc([N+](=O)[O-])c(OC)c1)[C@@H]1CCCc2cccnc21 ZINC000377253337 941598102 /nfs/dbraw/zinc/59/81/02/941598102.db2.gz UENZETHSDONPBK-MRXNPFEDSA-N 0 0 355.394 3.538 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NCCOc2ccc(C(C)C)cc2)c1 ZINC000549189769 941611271 /nfs/dbraw/zinc/61/12/71/941611271.db2.gz ASAAXDNDEYXUCS-UHFFFAOYSA-N 0 0 372.421 3.926 20 5 FHBDRN CC(C)(C)OCc1cc(C(=O)N2CCCCc3cc([N+](=O)[O-])ccc32)no1 ZINC000892854167 941619084 /nfs/dbraw/zinc/61/90/84/941619084.db2.gz QKNMLEGIYQSOLK-UHFFFAOYSA-N 0 0 373.409 3.881 20 5 FHBDRN O=C(Nc1ccc2c[nH]nc2c1)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000549192904 941619619 /nfs/dbraw/zinc/61/96/19/941619619.db2.gz LZEQQPIWCKOIKY-UHFFFAOYSA-N 0 0 350.256 3.742 20 5 FHBDRN CCn1c(C)nc([N+](=O)[O-])c1N[C@H](C)c1ccc(-n2cccn2)c(F)c1 ZINC000549200060 941630764 /nfs/dbraw/zinc/63/07/64/941630764.db2.gz SKOZIFOAEQOBJS-LLVKDONJSA-N 0 0 358.377 3.618 20 5 FHBDRN CCC1(CC)CCC(NC(=O)C(=O)Nc2cc(F)cc([N+](=O)[O-])c2)CC1 ZINC000472722172 941631269 /nfs/dbraw/zinc/63/12/69/941631269.db2.gz GXJSCDLWAGQISK-UHFFFAOYSA-N 0 0 365.405 3.538 20 5 FHBDRN Cc1ccc(OCCOc2ccccc2[N+](=O)[O-])c(C(=O)NCC(C)C)c1 ZINC000541123771 941631323 /nfs/dbraw/zinc/63/13/23/941631323.db2.gz OWJUPXPPIDMRFQ-UHFFFAOYSA-N 0 0 372.421 3.747 20 5 FHBDRN Cc1cc(F)cc2c1N(C(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1)CCC2 ZINC000066786083 941637822 /nfs/dbraw/zinc/63/78/22/941637822.db2.gz XPQDSAGDKJZYTR-UHFFFAOYSA-N 0 0 373.340 3.852 20 5 FHBDRN C[C@@H](NS(=O)(=O)Cc1ccccc1[N+](=O)[O-])[C@H](C)C1CCCCC1 ZINC000545365953 941643299 /nfs/dbraw/zinc/64/32/99/941643299.db2.gz AFKIFECPLUBLLH-UONOGXRCSA-N 0 0 354.472 3.619 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CCCc3cccc(OC)c32)c1 ZINC000549213846 941655694 /nfs/dbraw/zinc/65/56/94/941655694.db2.gz PPGGNKRNAJWSNI-UHFFFAOYSA-N 0 0 356.378 3.595 20 5 FHBDRN Cn1cc([N+](=O)[O-])cc1C(=O)Nc1nc(-c2ccc(F)c(F)c2)cs1 ZINC000024464265 941660198 /nfs/dbraw/zinc/66/01/98/941660198.db2.gz WDBAGMIDWVZKRV-UHFFFAOYSA-N 0 0 364.333 3.587 20 5 FHBDRN Cn1cc([N+](=O)[O-])cc1C(=O)Nc1nc(-c2ccccc2Cl)cs1 ZINC000024469226 941660818 /nfs/dbraw/zinc/66/08/18/941660818.db2.gz ZWLZOTZVMWMSGJ-UHFFFAOYSA-N 0 0 362.798 3.963 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(C(=O)Nc2nc3c(s2)CSCC3)c1F ZINC000377355266 941666577 /nfs/dbraw/zinc/66/65/77/941666577.db2.gz UEWNDMFPFJNRQD-UHFFFAOYSA-N 0 0 353.400 3.540 20 5 FHBDRN COc1ccc(CC(=O)OC[C@@H]2CCCc3ccccc32)cc1[N+](=O)[O-] ZINC000729217180 941694368 /nfs/dbraw/zinc/69/43/68/941694368.db2.gz FJTAISDEIASFAP-INIZCTEOSA-N 0 0 355.390 3.809 20 5 FHBDRN CC(C)(C)CCCCNC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000729231133 941697245 /nfs/dbraw/zinc/69/72/45/941697245.db2.gz SILLGVRKOSAUQT-UHFFFAOYSA-N 0 0 362.474 3.643 20 5 FHBDRN COC(=O)[C@H](CCOc1ccc(C(C)=O)cc1[N+](=O)[O-])c1ccccc1 ZINC000564953492 941710525 /nfs/dbraw/zinc/71/05/25/941710525.db2.gz IILPSQWEVUCZSV-MRXNPFEDSA-N 0 0 357.362 3.523 20 5 FHBDRN C[C@@H]1Oc2cc(F)ccc2[C@@H]1NC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000377418179 941711491 /nfs/dbraw/zinc/71/14/91/941711491.db2.gz GQUMPLWLZUYBGJ-VXJOIVPMSA-N 0 0 350.733 3.639 20 5 FHBDRN Cc1csc(NC2CCN(c3nc4ccccc4cc3[N+](=O)[O-])CC2)n1 ZINC000473520622 941711563 /nfs/dbraw/zinc/71/15/63/941711563.db2.gz IQVSDDKRMPJHEB-UHFFFAOYSA-N 0 0 369.450 3.989 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2nnc(CN3CCSc4ccccc43)o2)cc1 ZINC000072553528 941716472 /nfs/dbraw/zinc/71/64/72/941716472.db2.gz WPNMRRZOCGVKPK-UHFFFAOYSA-N 0 0 354.391 3.757 20 5 FHBDRN CC(C)Oc1cccc(CN(C)[C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000120656986 941724842 /nfs/dbraw/zinc/72/48/42/941724842.db2.gz RPVZGRHIJOCGFX-HNNXBMFYSA-N 0 0 371.437 3.841 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N[C@@H](C)Cc2ccc(C)cc2C)c1F ZINC000412096013 941728503 /nfs/dbraw/zinc/72/85/03/941728503.db2.gz SGFJHRRWODTLCC-AWEZNQCLSA-N 0 0 374.412 3.649 20 5 FHBDRN Cc1noc(C)c1CSCC(=O)O[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000729358207 941731386 /nfs/dbraw/zinc/73/13/86/941731386.db2.gz KOFBBYUEZYCFAF-LLVKDONJSA-N 0 0 350.396 3.737 20 5 FHBDRN CS(=O)(=O)c1ccc(N(Cc2ccccc2)CC2CCC2)c([N+](=O)[O-])c1 ZINC000513167498 941744804 /nfs/dbraw/zinc/74/48/04/941744804.db2.gz PIUUMJSLVFXQBF-UHFFFAOYSA-N 0 0 374.462 3.805 20 5 FHBDRN O=[N+]([O-])c1ccc(NCc2ccc(Cn3ccnc3)cc2)c2ccncc21 ZINC000047537812 941755781 /nfs/dbraw/zinc/75/57/81/941755781.db2.gz BSZFBXXTQLCPHI-UHFFFAOYSA-N 0 0 359.389 4.000 20 5 FHBDRN COc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)cc1OC ZINC000549255936 941766639 /nfs/dbraw/zinc/76/66/39/941766639.db2.gz AVALQLMZZJPGAO-UHFFFAOYSA-N 0 0 370.283 3.883 20 5 FHBDRN CS(=O)(=O)c1cc([N+](=O)[O-])ccc1NCC1CC(c2ccccc2)C1 ZINC000549258628 941774679 /nfs/dbraw/zinc/77/46/79/941774679.db2.gz MESNSBLOMFUTBP-UHFFFAOYSA-N 0 0 360.435 3.604 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1ccc(OCC(F)(F)F)cn1 ZINC000433589742 941778017 /nfs/dbraw/zinc/77/80/17/941778017.db2.gz IAVHTHBSODSKMY-UHFFFAOYSA-N 0 0 369.299 3.800 20 5 FHBDRN CC(C)OC(=O)c1ccc(O[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000513203749 941779317 /nfs/dbraw/zinc/77/93/17/941779317.db2.gz JMSOSFQYVOXLAO-ZDUSSCGKSA-N 0 0 372.377 3.566 20 5 FHBDRN CS[C@H]1CCC[C@H](NC(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)C1 ZINC000412113540 941794568 /nfs/dbraw/zinc/79/45/68/941794568.db2.gz DALKJEPVXNCUJY-KBPBESRZSA-N 0 0 352.456 3.786 20 5 FHBDRN O=C(NCc1ccccc1OC1CCC1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412129498 941812081 /nfs/dbraw/zinc/81/20/81/941812081.db2.gz UTKLBVCSYHNSTC-RBUKOAKNSA-N 0 0 366.417 3.946 20 5 FHBDRN COc1cc(NC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)ccc1Cl ZINC000433656383 941817283 /nfs/dbraw/zinc/81/72/83/941817283.db2.gz MLNRZRVMALIIIT-UHFFFAOYSA-N 0 0 361.785 3.847 20 5 FHBDRN C[C@@H](Sc1ccc(N)cc1Cl)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000513255020 941819796 /nfs/dbraw/zinc/81/97/96/941819796.db2.gz CKYHTEKWRVLCCD-SECBINFHSA-N 0 0 351.815 3.950 20 5 FHBDRN COC(=O)c1cnc(NCCc2c[nH]c3cc(Cl)ccc23)c([N+](=O)[O-])c1 ZINC000616176916 941820253 /nfs/dbraw/zinc/82/02/53/941820253.db2.gz KOCLNJKTNJFMSG-UHFFFAOYSA-N 0 0 374.784 3.566 20 5 FHBDRN CNC(=O)c1ccc(N2CC[C@](C)(CCc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000433645420 941820333 /nfs/dbraw/zinc/82/03/33/941820333.db2.gz OWIZXCGDEMQCND-NRFANRHFSA-N 0 0 367.449 3.804 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN1C[C@H](C)C[C@H]1c1ccccc1 ZINC000513257434 941821167 /nfs/dbraw/zinc/82/11/67/941821167.db2.gz QTHFMJNGIHPREW-KDOFPFPSSA-N 0 0 369.421 3.625 20 5 FHBDRN CCC1(CC)CN(C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)CCS1 ZINC000468605999 941825327 /nfs/dbraw/zinc/82/53/27/941825327.db2.gz CNOGHRNVYHMQGD-UHFFFAOYSA-N 0 0 374.466 3.528 20 5 FHBDRN Cc1ccc(NCCCNC(=O)[C@H]2CC[C@@H](C(F)(F)F)C2)c([N+](=O)[O-])c1 ZINC000513312235 941840096 /nfs/dbraw/zinc/84/00/96/941840096.db2.gz MQUOIKMPRCHQOY-QWHCGFSZSA-N 0 0 373.375 3.800 20 5 FHBDRN CCOC(=O)c1cc(NC[C@@H]2CCN(c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000433700442 941840228 /nfs/dbraw/zinc/84/02/28/941840228.db2.gz BXHCEZDXGVNSGG-HNNXBMFYSA-N 0 0 369.421 3.710 20 5 FHBDRN COc1cccc(F)c1[C@@H](C)NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412146262 941841403 /nfs/dbraw/zinc/84/14/03/941841403.db2.gz OSYIQZAZIVYREZ-BYCMXARLSA-N 0 0 358.369 3.723 20 5 FHBDRN CC(C)(CC(F)F)C(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000412148402 941842423 /nfs/dbraw/zinc/84/24/23/941842423.db2.gz IMSGSPYZGDMYLM-UHFFFAOYSA-N 0 0 356.369 3.646 20 5 FHBDRN COc1ccc(F)cc1C(=O)N1CCS[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000513316975 941850884 /nfs/dbraw/zinc/85/08/84/941850884.db2.gz IPZHHOOFCDEGPR-KRWDZBQOSA-N 0 0 362.382 3.630 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N[C@H](C)[C@@H](C)c2ccccc2)c1F ZINC000412165282 941857648 /nfs/dbraw/zinc/85/76/48/941857648.db2.gz UOAOVNFQVGLNJR-CHWSQXEVSA-N 0 0 360.385 3.593 20 5 FHBDRN COCCCOc1cccc(NC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)c1 ZINC000412169751 941858609 /nfs/dbraw/zinc/85/86/09/941858609.db2.gz COYVFUBXIQNAGS-RBUKOAKNSA-N 0 0 370.405 3.752 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@H](CC(F)(F)F)C1 ZINC000433741475 941860693 /nfs/dbraw/zinc/86/06/93/941860693.db2.gz IBWFYOKIMDGLIK-ZIAGYGMSSA-N 0 0 358.360 3.964 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)NCCOc2ccccc2C(C)(C)C)c1[N+](=O)[O-] ZINC000433743634 941861624 /nfs/dbraw/zinc/86/16/24/941861624.db2.gz CCCUQRKISISQIU-UHFFFAOYSA-N 0 0 374.441 3.548 20 5 FHBDRN COc1ccccc1[C@@H]1C[C@H]1C(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000412175300 941863957 /nfs/dbraw/zinc/86/39/57/941863957.db2.gz YWMDZUSHPGLPFV-RRQGHBQHSA-N 0 0 354.406 3.893 20 5 FHBDRN COc1cc(C(=O)N[C@@H]2CC(C)(C)c3ccccc32)cc([N+](=O)[O-])c1OC ZINC000431847559 941874464 /nfs/dbraw/zinc/87/44/64/941874464.db2.gz WJLDQBSAOMMKIU-OAHLLOKOSA-N 0 0 370.405 3.764 20 5 FHBDRN COC(=O)c1cc(C(C)C)ccc1NC(=O)c1n[nH]c(C(C)C)c1[N+](=O)[O-] ZINC000433768226 941875152 /nfs/dbraw/zinc/87/51/52/941875152.db2.gz YMOUGEBNBLPZQS-UHFFFAOYSA-N 0 0 374.397 3.604 20 5 FHBDRN Cc1ccc(C[C@H]2CCCN2C(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])cc1 ZINC000433768675 941875937 /nfs/dbraw/zinc/87/59/37/941875937.db2.gz LDXVYJFPVGMGDO-OAHLLOKOSA-N 0 0 356.426 3.597 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N2CCC[C@@H](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000433772178 941878086 /nfs/dbraw/zinc/87/80/86/941878086.db2.gz CBCDTUMNYSNZMS-HNNXBMFYSA-N 0 0 356.426 3.536 20 5 FHBDRN CC(C)c1[nH]nc(C(=O)Nc2ccnc(-c3ccccc3)c2)c1[N+](=O)[O-] ZINC000433771891 941878206 /nfs/dbraw/zinc/87/82/06/941878206.db2.gz AAEXDALBTXCFQU-UHFFFAOYSA-N 0 0 351.366 3.756 20 5 FHBDRN CC(C)Oc1cc(C(=O)N(C)CCOCc2ccccc2)ccc1[N+](=O)[O-] ZINC000412182166 941881802 /nfs/dbraw/zinc/88/18/02/941881802.db2.gz JMNBFSRYUFBRGY-UHFFFAOYSA-N 0 0 372.421 3.671 20 5 FHBDRN Cc1cn([C@H](C)c2ccccc2)[nH]c1=NC(=O)c1cc([N+](=O)[O-])c(C)s1 ZINC000472828129 941882635 /nfs/dbraw/zinc/88/26/35/941882635.db2.gz SCQQTHAYVNZBGV-GFCCVEGCSA-N 0 0 370.434 3.753 20 5 FHBDRN O=C(COc1ccc2ccccc2c1)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000119425277 941884383 /nfs/dbraw/zinc/88/43/83/941884383.db2.gz CEFPKPRYVDYTLX-UHFFFAOYSA-N 0 0 362.385 3.712 20 5 FHBDRN COc1c(C)cnc(CN(C)c2ccc([N+](=O)[O-])c3cccnc32)c1C ZINC000433776737 941885174 /nfs/dbraw/zinc/88/51/74/941885174.db2.gz ZTZZYLDAPREHPR-UHFFFAOYSA-N 0 0 352.394 3.800 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2C[C@@H]2c2c(F)cccc2F)c1 ZINC000549300821 941890144 /nfs/dbraw/zinc/89/01/44/941890144.db2.gz XIENAEUPMPDHAD-XHDPSFHLSA-N 0 0 362.332 3.558 20 5 FHBDRN C[C@H]1CC(c2nc(-c3ccc(-n4cncn4)c([N+](=O)[O-])c3)no2)C[C@H](C)C1 ZINC000453207187 941890506 /nfs/dbraw/zinc/89/05/06/941890506.db2.gz ZFWQZOMRLBOGGF-VXGBXAGGSA-N 0 0 368.397 3.765 20 5 FHBDRN C[C@H]1CN(C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)C[C@@H](c2ccsc2)O1 ZINC000412191788 941890983 /nfs/dbraw/zinc/89/09/83/941890983.db2.gz ZHCJIAVXYLZMFM-BIMQEMHKSA-N 0 0 372.446 3.748 20 5 FHBDRN O=C(c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)N1CCCCCO1 ZINC000472831030 941891704 /nfs/dbraw/zinc/89/17/04/941891704.db2.gz XOUGCVOAQGDQJD-UHFFFAOYSA-N 0 0 355.394 3.765 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)COC/C=C/c2ccccc2)cc1[N+](=O)[O-] ZINC000119657340 941896252 /nfs/dbraw/zinc/89/62/52/941896252.db2.gz CVXZTNMYGSMCKG-YXMGTMDOSA-N 0 0 354.406 3.810 20 5 FHBDRN Cc1cn([C@H](C)c2ccccc2)[nH]c1=NC(=O)c1cc([N+](=O)[O-])ccc1C ZINC000472834478 941902449 /nfs/dbraw/zinc/90/24/49/941902449.db2.gz QBXWQLZCSZNSKJ-OAHLLOKOSA-N 0 0 364.405 3.692 20 5 FHBDRN CC(C)Oc1cc(C(=O)N[C@H](C)[C@@H]2COc3ccccc32)ccc1[N+](=O)[O-] ZINC000412210453 941909100 /nfs/dbraw/zinc/90/91/00/941909100.db2.gz HCSSBIPITBPFRC-CJNGLKHVSA-N 0 0 370.405 3.677 20 5 FHBDRN O=C(N[C@H]1CCOC2(CCCCC2)C1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412203970 941912347 /nfs/dbraw/zinc/91/23/47/941912347.db2.gz KRUYAIIQYQJKLO-RYQLBKOJSA-N 0 0 358.438 3.696 20 5 FHBDRN COc1ccc(CN(Cc2cc[nH]n2)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000513416044 941912845 /nfs/dbraw/zinc/91/28/45/941912845.db2.gz MHSXPZRCGHYNBW-UHFFFAOYSA-N 0 0 352.394 3.529 20 5 FHBDRN CC(C)Oc1cc(C(=O)N[C@H](c2cccnc2)C2CC2)ccc1[N+](=O)[O-] ZINC000412215556 941924154 /nfs/dbraw/zinc/92/41/54/941924154.db2.gz IDJBIUHWWCSXED-SFHVURJKSA-N 0 0 355.394 3.658 20 5 FHBDRN CN(C(=O)OC(C)(C)C)C1CCN(c2ccc([N+](=O)[O-])cc2F)CC1 ZINC000201631670 941927104 /nfs/dbraw/zinc/92/71/04/941927104.db2.gz XILFDSOCFGRCJL-UHFFFAOYSA-N 0 0 353.394 3.570 20 5 FHBDRN CC(C)c1[nH]nc(C(=O)Nc2ccc(-c3nccs3)cc2)c1[N+](=O)[O-] ZINC000433834635 941931346 /nfs/dbraw/zinc/93/13/46/941931346.db2.gz DHDHIHIVSFBCTL-UHFFFAOYSA-N 0 0 357.395 3.817 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1OC(F)F)N1CCC[C@@H]2CCCC[C@H]21 ZINC000182491648 941934175 /nfs/dbraw/zinc/93/41/75/941934175.db2.gz HNLPTRLVUXZPSM-SMDDNHRTSA-N 0 0 354.353 3.991 20 5 FHBDRN C[C@H]1c2c(F)cccc2CCN1C(=O)CCc1cc(F)ccc1[N+](=O)[O-] ZINC001126393305 941934415 /nfs/dbraw/zinc/93/44/15/941934415.db2.gz DHUZADCIXBECCN-LBPRGKRZSA-N 0 0 360.360 3.952 20 5 FHBDRN COc1cccc(CCC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)c1F ZINC000513449966 941937273 /nfs/dbraw/zinc/93/72/73/941937273.db2.gz DKCWAKAFKXFIHC-UHFFFAOYSA-N 0 0 374.412 3.814 20 5 FHBDRN CC[C@@H](C)n1[nH]c(=NC(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)cc1C ZINC000412229314 941942614 /nfs/dbraw/zinc/94/26/14/941942614.db2.gz HJXAWCGUGAPUKY-GFCCVEGCSA-N 0 0 360.414 3.532 20 5 FHBDRN Cc1cc2sc(NC(=O)c3n[nH]c(C(C)C)c3[N+](=O)[O-])nc2c(C)c1 ZINC000433857533 941944620 /nfs/dbraw/zinc/94/46/20/941944620.db2.gz JYPNLFOTIJCIFX-UHFFFAOYSA-N 0 0 359.411 3.920 20 5 FHBDRN Cc1ccc(C(=O)N2CCN([C@H](C)c3cc([N+](=O)[O-])ccc3C)CC2)s1 ZINC000182683657 941952470 /nfs/dbraw/zinc/95/24/70/941952470.db2.gz QKGFFZUAQCUFPL-OAHLLOKOSA-N 0 0 373.478 3.792 20 5 FHBDRN Cc1cn(C2CCCCC2)[nH]c1=NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412248237 941956909 /nfs/dbraw/zinc/95/69/09/941956909.db2.gz RBSWQRIHGATORL-ZWKOTPCHSA-N 0 0 368.437 3.769 20 5 FHBDRN CC(C)c1[nH]nc(C(=O)Nc2ccc(Cc3ccncc3)cc2)c1[N+](=O)[O-] ZINC000433869551 941958151 /nfs/dbraw/zinc/95/81/51/941958151.db2.gz SFWASTMJBORFDA-UHFFFAOYSA-N 0 0 365.393 3.679 20 5 FHBDRN O=C(N[C@@H]1CCC[C@H](CO)C1)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000412923030 941962560 /nfs/dbraw/zinc/96/25/60/941962560.db2.gz YERXVMUYLXTKLQ-WMLDXEAASA-N 0 0 369.421 3.619 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)NCC[C@@H]1CCCCO1 ZINC000182802536 941968558 /nfs/dbraw/zinc/96/85/58/941968558.db2.gz XDJCIQGAJLTATK-AWEZNQCLSA-N 0 0 352.456 3.784 20 5 FHBDRN COc1cc(CSC[C@H]2CCCO2)c([N+](=O)[O-])cc1OCC(F)F ZINC000182812266 941970832 /nfs/dbraw/zinc/97/08/32/941970832.db2.gz BYXBALYOGDVPCI-LLVKDONJSA-N 0 0 363.382 3.660 20 5 FHBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])NC1CCC2(CC2)CC1 ZINC000433914628 941982142 /nfs/dbraw/zinc/98/21/42/941982142.db2.gz ZSUPENZJNOKVTN-UHFFFAOYSA-N 0 0 351.834 3.813 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)NCc2ccc(-c3ccncc3)cc2)c1 ZINC000377780486 941983215 /nfs/dbraw/zinc/98/32/15/941983215.db2.gz LZFJMTHPUHGPRP-UHFFFAOYSA-N 0 0 363.373 3.595 20 5 FHBDRN Cc1cc(C(=O)N2CCSCC2)ccc1NCc1ccc([N+](=O)[O-])cc1 ZINC000101541981 941985672 /nfs/dbraw/zinc/98/56/72/941985672.db2.gz HUNSTBIKHIDOEG-UHFFFAOYSA-N 0 0 371.462 3.704 20 5 FHBDRN COC1CCC(CCNC(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)CC1 ZINC000412254446 941990117 /nfs/dbraw/zinc/99/01/17/941990117.db2.gz NRCPBJGFMCUZNF-UHFFFAOYSA-N 0 0 364.442 3.707 20 5 FHBDRN Cc1cc(Br)c(O)c(NC(=O)Cc2ccccc2[N+](=O)[O-])c1 ZINC000182927574 942008385 /nfs/dbraw/zinc/00/83/85/942008385.db2.gz SNJWGSFUBKQEJW-UHFFFAOYSA-N 0 0 365.183 3.553 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)NCC2(CCO)CCCCC2)cc1[N+](=O)[O-] ZINC000433965492 942011444 /nfs/dbraw/zinc/01/14/44/942011444.db2.gz BYIUGMRXADSRCC-UHFFFAOYSA-N 0 0 362.470 3.955 20 5 FHBDRN Cc1ccccc1NC1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000377818391 942011574 /nfs/dbraw/zinc/01/15/74/942011574.db2.gz GMXXNJKDIYMFOQ-UHFFFAOYSA-N 0 0 353.422 3.549 20 5 FHBDRN Cc1cccc(C(=O)Nc2ccc(-c3n[nH]c(C4CC4)n3)cc2)c1[N+](=O)[O-] ZINC000101843365 942014664 /nfs/dbraw/zinc/01/46/64/942014664.db2.gz JUBRYSMTYMTEEP-UHFFFAOYSA-N 0 0 363.377 3.818 20 5 FHBDRN CN(CC1(c2ccccc2)CC1)C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412268658 942016059 /nfs/dbraw/zinc/01/60/59/942016059.db2.gz JVDFERUHHZDANE-RBUKOAKNSA-N 0 0 350.418 3.889 20 5 FHBDRN Cc1nc(-c2ccsc2)ccc1C(=O)NCc1ccccc1[N+](=O)[O-] ZINC000101815617 942016613 /nfs/dbraw/zinc/01/66/13/942016613.db2.gz LSCVYQSRDQQPDI-UHFFFAOYSA-N 0 0 353.403 3.957 20 5 FHBDRN CC(C)Oc1cc(C(=O)N[C@@H](C)c2ccc(Cl)cn2)ccc1[N+](=O)[O-] ZINC000412270321 942016711 /nfs/dbraw/zinc/01/67/11/942016711.db2.gz OIFARVGVERSEJO-NSHDSACASA-N 0 0 363.801 3.921 20 5 FHBDRN CSc1cccc(C(=O)N(C)Cc2cc(F)cc(F)c2)c1[N+](=O)[O-] ZINC000434000138 942035242 /nfs/dbraw/zinc/03/52/42/942035242.db2.gz XAEQTEICXNRZRD-UHFFFAOYSA-N 0 0 352.362 3.867 20 5 FHBDRN COc1cc(C(=O)N2CCC(F)(c3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000434037613 942049789 /nfs/dbraw/zinc/04/97/89/942049789.db2.gz RREIJZNURKLUFL-UHFFFAOYSA-N 0 0 358.369 3.704 20 5 FHBDRN CCOc1cccc(CNC(=O)c2ccc([N+](=O)[O-])cc2)c1OC(F)F ZINC000129360739 942052439 /nfs/dbraw/zinc/05/24/39/942052439.db2.gz GITBHNIDGBNTOP-UHFFFAOYSA-N 0 0 366.320 3.525 20 5 FHBDRN Cc1ccccc1C[C@@H](C)NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513652241 942056799 /nfs/dbraw/zinc/05/67/99/942056799.db2.gz KMWJVVLQVLHHCW-GFCCVEGCSA-N 0 0 364.348 3.866 20 5 FHBDRN CN(Cc1ccccc1F)C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513657493 942058643 /nfs/dbraw/zinc/05/86/43/942058643.db2.gz HKUZFOQGIRRRCO-UHFFFAOYSA-N 0 0 354.284 3.608 20 5 FHBDRN Cc1ccc(C(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)nc1C ZINC000412281934 942060314 /nfs/dbraw/zinc/06/03/14/942060314.db2.gz ASVJFSJJDQCXJK-UHFFFAOYSA-N 0 0 353.300 3.555 20 5 FHBDRN Cn1ccnc1[C@H](NCc1ccc(Cl)s1)c1cccc([N+](=O)[O-])c1 ZINC000513662625 942070527 /nfs/dbraw/zinc/07/05/27/942070527.db2.gz YACHUTWNTGLDDP-OAHLLOKOSA-N 0 0 362.842 3.922 20 5 FHBDRN C[C@@H](Cc1ccccc1F)NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513663197 942071154 /nfs/dbraw/zinc/07/11/54/942071154.db2.gz FGHYNRAQYMWBGL-JTQLQIEISA-N 0 0 368.311 3.696 20 5 FHBDRN O=C(COc1ccc(F)cc1[N+](=O)[O-])Nc1ccc(Br)cc1 ZINC000102599754 942072908 /nfs/dbraw/zinc/07/29/08/942072908.db2.gz SEBFCYHYRJFJOY-UHFFFAOYSA-N 0 0 369.146 3.514 20 5 FHBDRN C[C@H]1COc2ccccc2N1C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000183050974 942073121 /nfs/dbraw/zinc/07/31/21/942073121.db2.gz XYFWZSQBVOHZRI-JTQLQIEISA-N 0 0 364.304 3.624 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])c1ccccc1NCc1cccnc1 ZINC000434082940 942074362 /nfs/dbraw/zinc/07/43/62/942074362.db2.gz NHLVDYGCYVBKAA-UHFFFAOYSA-N 0 0 362.389 3.532 20 5 FHBDRN COc1cc(C(=O)Nc2ccc(C)c(OCC(F)F)c2)ccc1[N+](=O)[O-] ZINC000102625025 942075637 /nfs/dbraw/zinc/07/56/37/942075637.db2.gz CKJAATGCVVXGAN-UHFFFAOYSA-N 0 0 366.320 3.808 20 5 FHBDRN COCCC1(c2noc(-c3ccc(N4CCCC4)c([N+](=O)[O-])c3)n2)CCC1 ZINC000420517818 942077607 /nfs/dbraw/zinc/07/76/07/942077607.db2.gz NMDAFXDFGIYRFT-UHFFFAOYSA-N 0 0 372.425 3.703 20 5 FHBDRN O=C1c2ccc(F)cc2C(=O)N1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000549375810 942079421 /nfs/dbraw/zinc/07/94/21/942079421.db2.gz JIRIEBLWHZEODM-UHFFFAOYSA-N 0 0 368.242 3.549 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CC[C@@H](C(F)(F)F)[C@@H]2C)ccc1[N+](=O)[O-] ZINC000412297260 942080828 /nfs/dbraw/zinc/08/08/28/942080828.db2.gz HQCOPOUHBNCFAY-CMPLNLGQSA-N 0 0 360.332 3.795 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N(C)Cc2cc(C)ccc2C)c1F ZINC000412298664 942082434 /nfs/dbraw/zinc/08/24/34/942082434.db2.gz GTFKRIVPYGPCIB-UHFFFAOYSA-N 0 0 360.385 3.560 20 5 FHBDRN CCS(=O)(=O)c1ccc(CN[C@H](C)c2cccc([N+](=O)[O-])c2C)s1 ZINC000279990199 942084768 /nfs/dbraw/zinc/08/47/68/942084768.db2.gz FGJFEPFRVQYQGX-GFCCVEGCSA-N 0 0 368.480 3.609 20 5 FHBDRN CCSc1cc(CNC(=O)c2cc(Cl)c(C)cc2[N+](=O)[O-])ccn1 ZINC000836783599 942094388 /nfs/dbraw/zinc/09/43/88/942094388.db2.gz JSCOLGOXUCNVQX-UHFFFAOYSA-N 0 0 365.842 3.994 20 5 FHBDRN Cc1cc(C)c(S(=O)(=O)N(C)[C@@H](C)C2CCCCC2)cc1[N+](=O)[O-] ZINC001211650894 942094817 /nfs/dbraw/zinc/09/48/17/942094817.db2.gz BSSCVVYQXMLBPL-AWEZNQCLSA-N 0 0 354.472 3.801 20 5 FHBDRN CCn1c(C)nc([N+](=O)[O-])c1Nc1ccc2c(c1)CN(CC(F)(F)F)C2 ZINC000413361845 942098086 /nfs/dbraw/zinc/09/80/86/942098086.db2.gz AJEIRZIQPIBLAI-UHFFFAOYSA-N 0 0 369.347 3.741 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1COC(=O)c1nc(-c2ccccc2)[nH]c1C ZINC000728727224 942102769 /nfs/dbraw/zinc/10/27/69/942102769.db2.gz JTHPCYDGCAZMAN-UHFFFAOYSA-N 0 0 367.361 3.659 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N(CCC(F)(F)F)CC1CC1 ZINC000280107326 942108630 /nfs/dbraw/zinc/10/86/30/942108630.db2.gz PIJUOFGCKLXYDN-UHFFFAOYSA-N 0 0 360.332 3.798 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(-n3ccc(C)n3)cc2)c1 ZINC000501908405 942110006 /nfs/dbraw/zinc/11/00/06/942110006.db2.gz PGAOYMDUXOSNEV-UHFFFAOYSA-N 0 0 366.377 3.740 20 5 FHBDRN CCOc1cccc([C@@H]2C[C@H]2NC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)c1 ZINC000412306511 942110436 /nfs/dbraw/zinc/11/04/36/942110436.db2.gz FNZPTCLQLXSZRH-VNTMZGSJSA-N 0 0 366.417 3.769 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CCCC[C@@H]2c2nc3cc(Cl)ccc3[nH]2)nc1 ZINC000413380777 942115113 /nfs/dbraw/zinc/11/51/13/942115113.db2.gz VHGRHSULMCWXHV-CQSZACIVSA-N 0 0 358.789 3.646 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])N[C@@H](C[C@H]1CCOC1)c1ccccc1 ZINC000163827814 942116754 /nfs/dbraw/zinc/11/67/54/942116754.db2.gz AIEBXDHZZIOGHO-QAPCUYQASA-N 0 0 369.421 3.562 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N2C[C@@H](C)Cc3ccccc32)c1F ZINC000413371501 942121229 /nfs/dbraw/zinc/12/12/29/942121229.db2.gz MXZCNBYAOHIJRH-LBPRGKRZSA-N 0 0 358.369 3.510 20 5 FHBDRN CC[C@H](C)[C@@H](C)N(C(=O)Cc1c(F)c(OC)ccc1[N+](=O)[O-])C1CC1 ZINC000413372523 942122219 /nfs/dbraw/zinc/12/22/19/942122219.db2.gz OPDJJVITKROLIF-NWDGAFQWSA-N 0 0 352.406 3.711 20 5 FHBDRN Cc1ccn(C2CCN(C(=O)Nc3c(C)ccc([N+](=O)[O-])c3C)CC2)n1 ZINC000377983403 942122922 /nfs/dbraw/zinc/12/29/22/942122922.db2.gz CHRUOSHHRXNFCV-UHFFFAOYSA-N 0 0 357.414 3.586 20 5 FHBDRN NC(=O)c1cccc([N+](=O)[O-])c1N[C@@H]1CCCc2sc(Cl)cc21 ZINC000420627042 942125145 /nfs/dbraw/zinc/12/51/45/942125145.db2.gz KNEVUMWYIDAMDF-SNVBAGLBSA-N 0 0 351.815 3.898 20 5 FHBDRN COc1cccc(N2CC[C@H](C(F)(F)F)C3(CCOCC3)C2)c1[N+](=O)[O-] ZINC000413394509 942141785 /nfs/dbraw/zinc/14/17/85/942141785.db2.gz HDDNIPGXUYICEQ-AWEZNQCLSA-N 0 0 374.359 3.789 20 5 FHBDRN Cc1ccc(NC(=O)c2ccc(N3CC[C@@]34CCOC4)c([N+](=O)[O-])c2)cc1 ZINC000420640476 942148450 /nfs/dbraw/zinc/14/84/50/942148450.db2.gz MUIPVEHGKXFJQO-FQEVSTJZSA-N 0 0 367.405 3.525 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)NCCc2cccc3[nH]ccc32)c1 ZINC000501956262 942148611 /nfs/dbraw/zinc/14/86/11/942148611.db2.gz PUJFLDCSKZGCHA-UHFFFAOYSA-N 0 0 355.419 3.771 20 5 FHBDRN O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)N1CCC[C@H]1C1CCC1 ZINC000102953397 942154435 /nfs/dbraw/zinc/15/44/35/942154435.db2.gz XHALJCSYFXHQLN-ZDUSSCGKSA-N 0 0 355.341 3.993 20 5 FHBDRN CC(C)(C)OC(=O)[C@@H]1CC[C@@H]1C(=O)Nc1ccc([N+](=O)[O-])c(Cl)c1 ZINC001125864534 942161371 /nfs/dbraw/zinc/16/13/71/942161371.db2.gz WLDUOSZKQYGHAL-WDEREUQCSA-N 0 0 354.790 3.555 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)N(C)[C@@H]2CCCC[C@@H]2C)cc1SC ZINC000102984892 942166661 /nfs/dbraw/zinc/16/66/61/942166661.db2.gz INIJSZJSNPBFQH-WCQYABFASA-N 0 0 352.456 3.976 20 5 FHBDRN CCn1nc(C)c([N+](=O)[O-])c1N1CCC(n2c(C)nc3ccccc32)CC1 ZINC000280366300 942168093 /nfs/dbraw/zinc/16/80/93/942168093.db2.gz YCYQSJRFWSPDMM-UHFFFAOYSA-N 0 0 368.441 3.619 20 5 FHBDRN Cc1ccc(OCCCNC(=O)CCOc2cc(C)ccc2[N+](=O)[O-])cc1 ZINC000513727867 942169783 /nfs/dbraw/zinc/16/97/83/942169783.db2.gz PJZSQOHNPBVQJB-UHFFFAOYSA-N 0 0 372.421 3.566 20 5 FHBDRN Cc1ccc(S(=O)(=O)N[C@H](CC(F)F)c2ccccc2)cc1[N+](=O)[O-] ZINC000420733572 942169804 /nfs/dbraw/zinc/16/98/04/942169804.db2.gz IEBMCCOCPXEUHH-CQSZACIVSA-N 0 0 370.377 3.578 20 5 FHBDRN Cc1ccc(S(=O)(=O)N[C@@H](CC(F)F)c2ccccc2)cc1[N+](=O)[O-] ZINC000420733571 942169846 /nfs/dbraw/zinc/16/98/46/942169846.db2.gz IEBMCCOCPXEUHH-AWEZNQCLSA-N 0 0 370.377 3.578 20 5 FHBDRN Cc1cc(C(=O)N2CCC[C@H]2c2nc(C(C)(C)C)no2)ccc1[N+](=O)[O-] ZINC000280361824 942171575 /nfs/dbraw/zinc/17/15/75/942171575.db2.gz TYYZBLDPGFXFMS-AWEZNQCLSA-N 0 0 358.398 3.561 20 5 FHBDRN CCOc1ccccc1CNC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513693691 942176652 /nfs/dbraw/zinc/17/66/52/942176652.db2.gz ICNUVARDHKHUIP-UHFFFAOYSA-N 0 0 366.320 3.525 20 5 FHBDRN Cn1cc([N+](=O)[O-])c(C(=O)N[C@@H](CC2CCCCC2)c2ccccc2)n1 ZINC000502034380 942181484 /nfs/dbraw/zinc/18/14/84/942181484.db2.gz TUFOVBZFUZQASB-INIZCTEOSA-N 0 0 356.426 3.770 20 5 FHBDRN CCOC(=O)CC[C@H]1CCCN(c2ccc([N+](=O)[O-])c3cnccc32)C1 ZINC000128377963 942183405 /nfs/dbraw/zinc/18/34/05/942183405.db2.gz ZZNQTCXGNBQGQL-CQSZACIVSA-N 0 0 357.410 3.703 20 5 FHBDRN C[C@@H](NC(=O)N1CCC[C@H](Oc2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000413440561 942185258 /nfs/dbraw/zinc/18/52/58/942185258.db2.gz SAVUSZWOMJHGDG-WBVHZDCISA-N 0 0 369.421 3.909 20 5 FHBDRN COCCC[C@H](C)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000280522948 942197187 /nfs/dbraw/zinc/19/71/87/942197187.db2.gz GHUJGIXBVDMYDX-VIFPVBQESA-N 0 0 359.220 3.667 20 5 FHBDRN O=C(NCCc1ccccc1[N+](=O)[O-])N[C@H](CC(F)F)c1ccccc1 ZINC000420787317 942209822 /nfs/dbraw/zinc/20/98/22/942209822.db2.gz BZHWRJPDIKKKDU-OAHLLOKOSA-N 0 0 363.364 3.833 20 5 FHBDRN Cc1cc(NCc2cccnc2-n2ccnc2)c2cccc([N+](=O)[O-])c2n1 ZINC000378050033 942209869 /nfs/dbraw/zinc/20/98/69/942209869.db2.gz LAPLCKNUGXZTIG-UHFFFAOYSA-N 0 0 360.377 3.644 20 5 FHBDRN O=[N+]([O-])c1ccc2ccnc(N3CCC[C@@H](c4nnc5ccccn54)C3)c2c1 ZINC000413039761 942220976 /nfs/dbraw/zinc/22/09/76/942220976.db2.gz VMBJZIRRDRZBFR-OAHLLOKOSA-N 0 0 374.404 3.570 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)NC[C@H]2CC23CCSCC3)cc1[N+](=O)[O-] ZINC000420816874 942221176 /nfs/dbraw/zinc/22/11/76/942221176.db2.gz ZBRCNMYZCSVYKR-UKRRQHHQSA-N 0 0 363.483 3.797 20 5 FHBDRN COC(=O)c1nc([C@@H]2CCCN2Cc2csc([N+](=O)[O-])c2)sc1C ZINC000280631243 942222239 /nfs/dbraw/zinc/22/22/39/942222239.db2.gz YWPKKUZTGQPXBA-NSHDSACASA-N 0 0 367.452 3.545 20 5 FHBDRN O=C(NCCn1cccc1)c1cc([N+](=O)[O-])ccc1SC1CCCC1 ZINC000122764358 942226450 /nfs/dbraw/zinc/22/64/50/942226450.db2.gz PLSCLRPNAWAHCT-UHFFFAOYSA-N 0 0 359.451 3.861 20 5 FHBDRN C[C@@H](CO)N(CC1CCC1)C(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000280665298 942226804 /nfs/dbraw/zinc/22/68/04/942226804.db2.gz FTRIMLXFZIRWMP-AWEZNQCLSA-N 0 0 364.445 3.717 20 5 FHBDRN CCOc1ccc2c(c1)CCN(C(=O)c1cc3cc([N+](=O)[O-])ccc3o1)C2 ZINC000434103304 942228731 /nfs/dbraw/zinc/22/87/31/942228731.db2.gz YBWGGTOVULRJFN-UHFFFAOYSA-N 0 0 366.373 3.938 20 5 FHBDRN CC(C)(C)O[C@H](C(=O)NCCNc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000513701650 942229127 /nfs/dbraw/zinc/22/91/27/942229127.db2.gz XSRSCZUSUVJZMK-SFHVURJKSA-N 0 0 371.437 3.679 20 5 FHBDRN C[C@@H](OCC(F)(F)F)c1noc(CCc2cc(F)ccc2[N+](=O)[O-])n1 ZINC000924095634 942230033 /nfs/dbraw/zinc/23/00/33/942230033.db2.gz BUQUIFBRZQQJAI-MRVPVSSYSA-N 0 0 363.267 3.542 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N[C@@H](C)c1cc(C)cc(C)c1 ZINC000502127260 942235565 /nfs/dbraw/zinc/23/55/65/942235565.db2.gz NECVVIFUYCBNBA-AWEZNQCLSA-N 0 0 357.410 3.781 20 5 FHBDRN Cc1nc(-c2ccccc2NC(=O)CCc2cccc([N+](=O)[O-])c2)no1 ZINC000378077823 942246147 /nfs/dbraw/zinc/24/61/47/942246147.db2.gz RAIRYJBCQKJHGD-UHFFFAOYSA-N 0 0 352.350 3.525 20 5 FHBDRN COc1cccc(CNc2ncc([N+](=O)[O-])cc2C(F)(F)F)c1OC ZINC000413061885 942248084 /nfs/dbraw/zinc/24/80/84/942248084.db2.gz AFVVDZRKOBLASD-UHFFFAOYSA-N 0 0 357.288 3.638 20 5 FHBDRN C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1ccc(Br)o1 ZINC000103377434 942249171 /nfs/dbraw/zinc/24/91/71/942249171.db2.gz PKRVTYRKWRYRSX-MRVPVSSYSA-N 0 0 351.156 3.542 20 5 FHBDRN CCOc1c(Cl)cc(CNc2ncc([N+](=O)[O-])cc2F)cc1OC ZINC000413070420 942251535 /nfs/dbraw/zinc/25/15/35/942251535.db2.gz LMVOXMDWINURHY-UHFFFAOYSA-N 0 0 355.753 3.802 20 5 FHBDRN C[C@@H](C(=O)N1CC[C@H](c2ccccc2F)C1)c1ccc([N+](=O)[O-])cc1F ZINC000502161367 942254566 /nfs/dbraw/zinc/25/45/66/942254566.db2.gz XJVAJVGUCUDJQO-OLZOCXBDSA-N 0 0 360.360 3.993 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)N2C[C@@H]3CCCCC[C@@H]32)cc1SC ZINC000378082393 942256895 /nfs/dbraw/zinc/25/68/95/942256895.db2.gz GPVUKIOQQCRLSL-AAEUAGOBSA-N 0 0 350.440 3.730 20 5 FHBDRN C[C@@H](c1ccc(-n2cncn2)cc1)N(C)Cc1c(F)cccc1[N+](=O)[O-] ZINC000103465312 942273279 /nfs/dbraw/zinc/27/32/79/942273279.db2.gz NWOJCBPDHVTREU-ZDUSSCGKSA-N 0 0 355.373 3.508 20 5 FHBDRN C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCC[C@@H](CC(F)(F)F)C1 ZINC000420955297 942274495 /nfs/dbraw/zinc/27/44/95/942274495.db2.gz WEWXKOZEMIEEIP-NEPJUHHUSA-N 0 0 359.348 3.586 20 5 FHBDRN O=C(Nc1cccc(CN2CCCCC2=O)c1)Nc1cccc([N+](=O)[O-])c1 ZINC000051235870 942279576 /nfs/dbraw/zinc/27/95/76/942279576.db2.gz XUXIKOYCFZXIKS-UHFFFAOYSA-N 0 0 368.393 3.751 20 5 FHBDRN C[C@@H]1C[C@@H](Nc2cc(C(F)(F)C(F)(F)F)ncc2[N+](=O)[O-])CS1 ZINC000413506373 942281040 /nfs/dbraw/zinc/28/10/40/942281040.db2.gz AZZJNDUWUQIUOW-RNFRBKRXSA-N 0 0 357.304 3.950 20 5 FHBDRN CCCCCC(=O)NC1CCN(c2ccc([N+](=O)[O-])c3ncccc23)CC1 ZINC000413096244 942285123 /nfs/dbraw/zinc/28/51/23/942285123.db2.gz AZWKXJZWQBNUDM-UHFFFAOYSA-N 0 0 370.453 3.808 20 5 FHBDRN Cn1c2ccccc2c(Cl)c1C(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000122858287 942287425 /nfs/dbraw/zinc/28/74/25/942287425.db2.gz JWWACWHLHPTUIX-UHFFFAOYSA-N 0 0 369.768 3.869 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N(C)c1cccc(C(C)C)c1 ZINC000063181960 942289126 /nfs/dbraw/zinc/28/91/26/942289126.db2.gz XUCXYNRURBNHEK-UHFFFAOYSA-N 0 0 364.423 3.552 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)Nc2cccc(SC)c2)cc1OC ZINC000015629930 942290074 /nfs/dbraw/zinc/29/00/74/942290074.db2.gz ZABWEQQMCUIMTF-UHFFFAOYSA-N 0 0 362.407 3.976 20 5 FHBDRN CC(C)(C)c1ccncc1CNc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 ZINC000413515818 942290454 /nfs/dbraw/zinc/29/04/54/942290454.db2.gz NIYSWOQTVMPYCV-UHFFFAOYSA-N 0 0 354.410 3.784 20 5 FHBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1c2ccccc2SC[C@H]1C ZINC000434109106 942291651 /nfs/dbraw/zinc/29/16/51/942291651.db2.gz NRPNBLKRIGNTRO-LLVKDONJSA-N 0 0 364.448 3.593 20 5 FHBDRN CC1(C)C[C@H](C(=O)N2CCc3ccc([N+](=O)[O-])cc32)c2ccccc2O1 ZINC000413109940 942293384 /nfs/dbraw/zinc/29/33/84/942293384.db2.gz RSVQKFMFODQMLM-INIZCTEOSA-N 0 0 352.390 3.829 20 5 FHBDRN Cc1cncc(CCC(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)c1 ZINC000513736662 942295431 /nfs/dbraw/zinc/29/54/31/942295431.db2.gz IEYJNBWDHLKAHY-UHFFFAOYSA-N 0 0 364.199 3.632 20 5 FHBDRN COc1ccccc1CCNC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000103597295 942295801 /nfs/dbraw/zinc/29/58/01/942295801.db2.gz ULZPVYVGGLQRPY-UHFFFAOYSA-N 0 0 371.437 3.766 20 5 FHBDRN O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)N1CCCC[C@@H]1C(F)F ZINC000502220244 942298358 /nfs/dbraw/zinc/29/83/58/942298358.db2.gz OZLPUKGQHHWMEU-SNVBAGLBSA-N 0 0 365.283 3.848 20 5 FHBDRN COc1cc(C(=O)NC(C)(C)Cc2ccc(C)cc2)cc([N+](=O)[O-])c1OC ZINC000416052153 942302002 /nfs/dbraw/zinc/30/20/02/942302002.db2.gz BYGNCRKOVZZBSH-UHFFFAOYSA-N 0 0 372.421 3.672 20 5 FHBDRN CO[C@@H](CNC(=O)c1cc([N+](=O)[O-])ccc1SC(C)C)CC(C)C ZINC000416051829 942302114 /nfs/dbraw/zinc/30/21/14/942302114.db2.gz BVLGVGIRCTXZSM-CQSZACIVSA-N 0 0 354.472 3.886 20 5 FHBDRN C[C@@H](NC(=O)Nc1cc(Br)cc([N+](=O)[O-])c1)c1ccccn1 ZINC000501085898 942302301 /nfs/dbraw/zinc/30/23/01/942302301.db2.gz OZGHISPTQLNVTD-SECBINFHSA-N 0 0 365.187 3.635 20 5 FHBDRN CC[C@@H](Cc1ccccc1)NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000128428339 942302484 /nfs/dbraw/zinc/30/24/84/942302484.db2.gz MHOABWYEJNARAH-INIZCTEOSA-N 0 0 351.406 3.756 20 5 FHBDRN O=[N+]([O-])c1ccc(OCCSCc2ccn(CC(F)(F)F)n2)cc1 ZINC000419535092 942303640 /nfs/dbraw/zinc/30/36/40/942303640.db2.gz RFUQTHXHFUFKBJ-UHFFFAOYSA-N 0 0 361.345 3.666 20 5 FHBDRN Cc1n[nH]c(C(=O)NCc2ccccc2Sc2ccccc2)c1[N+](=O)[O-] ZINC000501096287 942305706 /nfs/dbraw/zinc/30/57/06/942305706.db2.gz WKXMEDWPXVSINI-UHFFFAOYSA-N 0 0 368.418 3.708 20 5 FHBDRN CC(C)c1ccccc1NC(=O)[C@H](C)OC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000015652901 942306664 /nfs/dbraw/zinc/30/66/64/942306664.db2.gz RAGUDMULKFUWOF-ZDUSSCGKSA-N 0 0 356.378 3.902 20 5 FHBDRN Cc1c(Cl)cccc1NC(=O)[C@H](C)OC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000015652898 942306709 /nfs/dbraw/zinc/30/67/09/942306709.db2.gz FDJNAYHPVWHSAW-NSHDSACASA-N 0 0 362.769 3.741 20 5 FHBDRN CC[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1C)c1ccc2c(c1)OCCO2 ZINC000502236016 942309542 /nfs/dbraw/zinc/30/95/42/942309542.db2.gz WETOQKPSCADMQI-MRXNPFEDSA-N 0 0 356.378 3.556 20 5 FHBDRN O=C(NC[C@H]1CC12CCSCC2)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000421038942 942312368 /nfs/dbraw/zinc/31/23/68/942312368.db2.gz JXWHLYVGMFVLLP-SNVBAGLBSA-N 0 0 355.847 3.903 20 5 FHBDRN CCC(=O)c1ccc(N2CCC[C@@H]2C[C@@H](O)c2ccco2)c([N+](=O)[O-])c1 ZINC000366425945 942312909 /nfs/dbraw/zinc/31/29/09/942312909.db2.gz DJMHKCDFERZIEI-RDTXWAMCSA-N 0 0 358.394 3.873 20 5 FHBDRN COc1cc(C(=O)N[C@@H](C)c2ccc(C3CC3)cc2)c([N+](=O)[O-])cc1OC ZINC000416064881 942312849 /nfs/dbraw/zinc/31/28/49/942312849.db2.gz PQUHCZFNKPVDPA-LBPRGKRZSA-N 0 0 370.405 3.980 20 5 FHBDRN CCOc1cc(CSCc2cc(=O)[nH]c(C3CC3)n2)ccc1[N+](=O)[O-] ZINC000419581046 942313529 /nfs/dbraw/zinc/31/35/29/942313529.db2.gz CBHPMWTYKMNZAG-UHFFFAOYSA-N 0 0 361.423 3.800 20 5 FHBDRN CSc1cccc(C(=O)Nc2n[nH]c(-c3ccc(C)cc3)n2)c1[N+](=O)[O-] ZINC000188032879 942314980 /nfs/dbraw/zinc/31/49/80/942314980.db2.gz FACWVSVHUCYTLY-UHFFFAOYSA-N 0 0 369.406 3.663 20 5 FHBDRN CCc1onc(C)c1NC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000183219008 942315667 /nfs/dbraw/zinc/31/56/67/942315667.db2.gz AYHQRXIJASBOSG-UHFFFAOYSA-N 0 0 355.803 3.838 20 5 FHBDRN O=[N+]([O-])c1cnc(NCC2(c3ccccc3Cl)CCOCC2)c(F)c1 ZINC000413128663 942325510 /nfs/dbraw/zinc/32/55/10/942325510.db2.gz OKEMBGJKLCYRLK-UHFFFAOYSA-N 0 0 365.792 3.943 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CCN(C)c3cc(F)ccc32)ccc1[N+](=O)[O-] ZINC000413537600 942327108 /nfs/dbraw/zinc/32/71/08/942327108.db2.gz WXNQMEYXGPSVAP-UHFFFAOYSA-N 0 0 373.384 3.618 20 5 FHBDRN CSc1cccc(C(=O)N2C[C@H](C)O[C@@H](c3ccccc3)C2)c1[N+](=O)[O-] ZINC000188082625 942328192 /nfs/dbraw/zinc/32/81/92/942328192.db2.gz XJTJODYFLKHIOL-XJKSGUPXSA-N 0 0 372.446 3.919 20 5 FHBDRN O=c1c2cc(Cl)ccc2ncn1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000501144267 942328627 /nfs/dbraw/zinc/32/86/27/942328627.db2.gz AIJFWAWMTVZUDG-UHFFFAOYSA-N 0 0 350.161 3.660 20 5 FHBDRN CC1(C)CN(C(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)[C@@H]1[C@@H]1CCCO1 ZINC000290646818 942330698 /nfs/dbraw/zinc/33/06/98/942330698.db2.gz QPBYKXCPDZAJOT-UONOGXRCSA-N 0 0 372.343 3.643 20 5 FHBDRN CC1(C)CN(C(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)[C@@H]1[C@H]1CCCO1 ZINC000290646821 942330948 /nfs/dbraw/zinc/33/09/48/942330948.db2.gz QPBYKXCPDZAJOT-ZIAGYGMSSA-N 0 0 372.343 3.643 20 5 FHBDRN O=C(Nc1cc(F)cc(F)c1Br)c1ccccc1[N+](=O)[O-] ZINC000188095293 942334860 /nfs/dbraw/zinc/33/48/60/942334860.db2.gz XKPFWLXAHMKLIS-UHFFFAOYSA-N 0 0 357.110 3.888 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CCSC[C@H]2C2CCC2)ccc1[N+](=O)[O-] ZINC000416094220 942335983 /nfs/dbraw/zinc/33/59/83/942335983.db2.gz OTJFGDPLBODKHZ-INIZCTEOSA-N 0 0 364.467 3.740 20 5 FHBDRN Cc1ccc(CSc2ccc([N+](=O)[O-])c(S(C)(=O)=O)c2)c(C)c1 ZINC000419656242 942337604 /nfs/dbraw/zinc/33/76/04/942337604.db2.gz ZFFSCBRPQZCLIM-UHFFFAOYSA-N 0 0 351.449 3.907 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@](F)(c2ccccc2C)C1 ZINC000501171142 942338995 /nfs/dbraw/zinc/33/89/95/942338995.db2.gz DVSIQEAUTZRQLE-LJQANCHMSA-N 0 0 358.369 3.623 20 5 FHBDRN COc1cc(C(=O)N2CC[C@](F)(c3ccccc3C)C2)ccc1[N+](=O)[O-] ZINC000501172232 942339807 /nfs/dbraw/zinc/33/98/07/942339807.db2.gz HVLHFEGGAUWWOE-LJQANCHMSA-N 0 0 358.369 3.623 20 5 FHBDRN CC(C)NC(=O)[C@@H]1CCC[C@H](Nc2ncc([N+](=O)[O-])cc2C(F)(F)F)C1 ZINC000413150505 942344072 /nfs/dbraw/zinc/34/40/72/942344072.db2.gz VEVABCPLUVXXOI-MNOVXSKESA-N 0 0 374.363 3.504 20 5 FHBDRN COc1ccc([C@H]2CCCN2Cc2ccc(OC)c([N+](=O)[O-])c2)cc1OC ZINC000051283950 942344189 /nfs/dbraw/zinc/34/41/89/942344189.db2.gz HOOIHGQULIMFLG-MRXNPFEDSA-N 0 0 372.421 3.958 20 5 FHBDRN COc1cccc([C@@H]2C[C@H]2CNC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000413145222 942348615 /nfs/dbraw/zinc/34/86/15/942348615.db2.gz NSHZOKPSMVZWHB-AXHNFQJDSA-N 0 0 369.421 3.767 20 5 FHBDRN COc1c(C(=O)N2CC[C@@](F)(c3ccccc3C)C2)cccc1[N+](=O)[O-] ZINC000501218525 942349536 /nfs/dbraw/zinc/34/95/36/942349536.db2.gz RAYQHRIQFOMKNS-IBGZPJMESA-N 0 0 358.369 3.623 20 5 FHBDRN CN(CCCC(=O)OC(C)(C)C)c1ncc([N+](=O)[O-])cc1C(F)(F)F ZINC000413154945 942351930 /nfs/dbraw/zinc/35/19/30/942351930.db2.gz LKBFCXVUFRMREQ-UHFFFAOYSA-N 0 0 363.336 3.567 20 5 FHBDRN Cn1ccnc1[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(Cl)cc1 ZINC000016261688 942354597 /nfs/dbraw/zinc/35/45/97/942354597.db2.gz WXJBJCBAVSWEDL-INIZCTEOSA-N 0 0 370.796 3.501 20 5 FHBDRN Cc1ccccc1[C@H]1CCCN1S(=O)(=O)CCc1ccc([N+](=O)[O-])cc1 ZINC000183521772 942356072 /nfs/dbraw/zinc/35/60/72/942356072.db2.gz DPVCGYFYCQDCEG-LJQANCHMSA-N 0 0 374.462 3.613 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N1CCSC[C@H]1C1CCC1 ZINC000416113851 942357538 /nfs/dbraw/zinc/35/75/38/942357538.db2.gz OJDVDKKLDJNASP-HNNXBMFYSA-N 0 0 354.859 3.535 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)[C@H]1CC(C)(C)Oc2ccccc21 ZINC000412326028 942367509 /nfs/dbraw/zinc/36/75/09/942367509.db2.gz BEDHSUXZZWOEMA-SFHVURJKSA-N 0 0 368.433 3.941 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)C[C@@H](c1ccc(O)cc1)C1CC1 ZINC000412328544 942369368 /nfs/dbraw/zinc/36/93/68/942369368.db2.gz CAGBFYRPFHMDTN-LJQANCHMSA-N 0 0 368.433 3.885 20 5 FHBDRN O=C(N[C@H](COc1ccccc1)c1ccccc1)c1ccc([N+](=O)[O-])o1 ZINC000502346738 942373539 /nfs/dbraw/zinc/37/35/39/942373539.db2.gz QYACAADNHOSJCK-MRXNPFEDSA-N 0 0 352.346 3.738 20 5 FHBDRN Cc1nn(Cc2nnc(-c3c(Cl)cccc3Cl)o2)cc1[N+](=O)[O-] ZINC000501277122 942378367 /nfs/dbraw/zinc/37/83/67/942378367.db2.gz MHQCCQBKNXAKKM-UHFFFAOYSA-N 0 0 354.153 3.505 20 5 FHBDRN CCC[C@@H]1C[C@@H](C(=O)Nc2cc(-c3cccc([N+](=O)[O-])c3)[nH]n2)CCO1 ZINC000183527772 942384043 /nfs/dbraw/zinc/38/40/43/942384043.db2.gz UTNNKAJNNGOHIA-DZGCQCFKSA-N 0 0 358.398 3.519 20 5 FHBDRN COc1ccccc1O[C@@H](C)CNc1ncc([N+](=O)[O-])cc1C(F)(F)F ZINC000413170428 942393635 /nfs/dbraw/zinc/39/36/35/942393635.db2.gz PCGATBIUSYUTEQ-JTQLQIEISA-N 0 0 371.315 3.897 20 5 FHBDRN C[C@@H](OC(=O)c1cc(Cl)ccc1[N+](=O)[O-])C(=O)Nc1cccc(F)c1 ZINC000015798209 942399382 /nfs/dbraw/zinc/39/93/82/942399382.db2.gz YEQDWDHYDJVBBY-SECBINFHSA-N 0 0 366.732 3.571 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)NCCSCCC(F)(F)F)c1C ZINC000893174945 942405152 /nfs/dbraw/zinc/40/51/52/942405152.db2.gz FWQNWAORXJVZOQ-UHFFFAOYSA-N 0 0 350.362 3.627 20 5 FHBDRN Cc1cc(NC(=O)c2cc3ccccc3n2C)c2cc([N+](=O)[O-])ccc2n1 ZINC001268853747 942414514 /nfs/dbraw/zinc/41/45/14/942414514.db2.gz HRJOQQUMMJGDNH-UHFFFAOYSA-N 0 0 360.373 3.617 20 5 FHBDRN COc1nc(C(=O)Nc2ccc([N+](=O)[O-])c3ncccc23)cc2ccccc21 ZINC001268850339 942417297 /nfs/dbraw/zinc/41/72/97/942417297.db2.gz WKNDXNWGCWJEEV-UHFFFAOYSA-N 0 0 374.356 3.952 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NCC(=O)C1CCC(F)(F)CC1 ZINC000424876692 942423634 /nfs/dbraw/zinc/42/36/34/942423634.db2.gz GUCAWPDVKAHGNM-UHFFFAOYSA-N 0 0 368.380 3.644 20 5 FHBDRN COc1cc2[nH]c(CCCNc3ncc([N+](=O)[O-])cc3F)cc2c(OC)c1 ZINC000413184747 942437341 /nfs/dbraw/zinc/43/73/41/942437341.db2.gz KJBZAGQJJULWMW-UHFFFAOYSA-N 0 0 374.372 3.672 20 5 FHBDRN CO[C@H](C)c1nc(CNc2ncc([N+](=O)[O-])cc2C(F)(F)F)cs1 ZINC000413186712 942438317 /nfs/dbraw/zinc/43/83/17/942438317.db2.gz PTNJOBPYYKGXBB-SSDOTTSWSA-N 0 0 362.333 3.785 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCC[C@@H](c3noc(C4CC4)n3)C2)c2cccnc21 ZINC000413189649 942439916 /nfs/dbraw/zinc/43/99/16/942439916.db2.gz ZCUONSGODXBCFQ-CYBMUJFWSA-N 0 0 365.393 3.787 20 5 FHBDRN COc1ccc([C@H]2C[C@H](NC(=O)c3cc(C)cc([N+](=O)[O-])c3)C2)cc1F ZINC000501360362 942441946 /nfs/dbraw/zinc/44/19/46/942441946.db2.gz NDBOAVICTXEFNS-CTYIDZIISA-N 0 0 358.369 3.727 20 5 FHBDRN CCOc1ccc(NC(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)cc1CO ZINC000413621066 942442055 /nfs/dbraw/zinc/44/20/55/942442055.db2.gz FKMJBNNJWNUHTD-UHFFFAOYSA-N 0 0 374.393 3.525 20 5 FHBDRN CCC(=O)c1ccc(N[C@@H]2CCCc3cn(CCOC)nc32)c([N+](=O)[O-])c1 ZINC000366828933 942442942 /nfs/dbraw/zinc/44/29/42/942442942.db2.gz PMOZIZDCFXOFNN-MRXNPFEDSA-N 0 0 372.425 3.520 20 5 FHBDRN O=C(Nc1ccccc1O[C@H]1CCOC1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000413631823 942454224 /nfs/dbraw/zinc/45/42/24/942454224.db2.gz YLLMAJWXOGCXNG-YESZJQIVSA-N 0 0 368.389 3.505 20 5 FHBDRN CC(C)Cn1nc(-c2ccccc2)cc1NC(=O)c1ccc([N+](=O)[O-])n1C ZINC000501409982 942465433 /nfs/dbraw/zinc/46/54/33/942465433.db2.gz UIJKVRORCPNEBI-UHFFFAOYSA-N 0 0 367.409 3.705 20 5 FHBDRN CCCOc1ccc(CNC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)cn1 ZINC000502467051 942466659 /nfs/dbraw/zinc/46/66/59/942466659.db2.gz YCWQEPWUODVWEA-UHFFFAOYSA-N 0 0 371.418 3.923 20 5 FHBDRN CC(C)c1ccccc1NC(=O)[C@@H](C)OC(=O)c1ccc([N+](=O)[O-])s1 ZINC000015855691 942466684 /nfs/dbraw/zinc/46/66/84/942466684.db2.gz HHXITGRQNSNFKR-LLVKDONJSA-N 0 0 362.407 3.964 20 5 FHBDRN CN1CC[C@H](Nc2ncc([N+](=O)[O-])cc2F)[C@@H]1c1ccc(Cl)cc1 ZINC000413200735 942473464 /nfs/dbraw/zinc/47/34/64/942473464.db2.gz FICWALRATIJNFV-GJZGRUSLSA-N 0 0 350.781 3.640 20 5 FHBDRN CSc1ccc([N+](=O)[O-])cc1C(=O)Nc1nccn1-c1ccccc1 ZINC001269118653 942492084 /nfs/dbraw/zinc/49/20/84/942492084.db2.gz AREHHSIKLSFVFQ-UHFFFAOYSA-N 0 0 354.391 3.755 20 5 FHBDRN Cc1nc([C@H]2CCCCN2Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)no1 ZINC000366890108 942494079 /nfs/dbraw/zinc/49/40/79/942494079.db2.gz XIONJGCNVIWJNH-MRXNPFEDSA-N 0 0 369.381 3.668 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1C[C@H]2CCC(=O)c3cccc1c32 ZINC000413685528 942498889 /nfs/dbraw/zinc/49/88/89/942498889.db2.gz FFVBSFRDJXYDET-XOKHGSTOSA-N 0 0 362.385 3.805 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)C[C@H](c1ccc(O)cc1)C1CC1 ZINC000412331482 942500313 /nfs/dbraw/zinc/50/03/13/942500313.db2.gz VJEYRQXFRMNXCB-FQEVSTJZSA-N 0 0 368.433 3.885 20 5 FHBDRN CC(C)Oc1cc(C(=O)NCCC2C[C@@H](C)O[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000412331304 942500438 /nfs/dbraw/zinc/50/04/38/942500438.db2.gz NLKKHWPKBGEQRI-ZIAGYGMSSA-N 0 0 364.442 3.706 20 5 FHBDRN CCc1cccc(CC(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000505363698 942503956 /nfs/dbraw/zinc/50/39/56/942503956.db2.gz FWVSUHGSMSJYDQ-UHFFFAOYSA-N 0 0 368.433 3.770 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N1CCC[C@@H]1/C=C/c1ccccc1 ZINC000505367218 942505258 /nfs/dbraw/zinc/50/52/58/942505258.db2.gz UCRAAHFRZNGJBO-KBOKABMXSA-N 0 0 352.390 3.678 20 5 FHBDRN CCN(C(=O)c1c([N+](=O)[O-])cnn1C)C(c1ccccc1)c1ccccc1 ZINC000501497419 942509530 /nfs/dbraw/zinc/50/95/30/942509530.db2.gz VCXNQJGDRWOPNT-UHFFFAOYSA-N 0 0 364.405 3.580 20 5 FHBDRN Cc1cccc(OC[C@H](C)NC(=O)CSc2ccc([N+](=O)[O-])cc2)c1 ZINC000054165206 942529229 /nfs/dbraw/zinc/52/92/29/942529229.db2.gz OMZDAVAQCAKYCW-AWEZNQCLSA-N 0 0 360.435 3.579 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)Nc1nn(C2CCCCC2)cc1C ZINC000434231651 942536061 /nfs/dbraw/zinc/53/60/61/942536061.db2.gz RKDZMRUSRMXBFG-UHFFFAOYSA-N 0 0 373.413 3.679 20 5 FHBDRN CC(C)n1nc2c(c1NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)CCC2 ZINC000413713605 942544544 /nfs/dbraw/zinc/54/45/44/942544544.db2.gz NWCNVXSZVWKLAH-JKSUJKDBSA-N 0 0 354.410 3.603 20 5 FHBDRN Cn1cc(C(=O)N2CCCc3c([N+](=O)[O-])cccc32)c(C2CCCCC2)n1 ZINC000513833726 942547194 /nfs/dbraw/zinc/54/71/94/942547194.db2.gz IDJRILSAOPYIDD-UHFFFAOYSA-N 0 0 368.437 3.969 20 5 FHBDRN O=C(COc1ccc(F)cc1Cl)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000513833772 942547456 /nfs/dbraw/zinc/54/74/56/942547456.db2.gz ISYBOGOVHBUCKQ-UHFFFAOYSA-N 0 0 364.760 3.746 20 5 FHBDRN CCC[C@H](NC(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-])c1ccc(F)cc1F ZINC000434249400 942548909 /nfs/dbraw/zinc/54/89/09/942548909.db2.gz MDTXAWUOJUEMJA-ZDUSSCGKSA-N 0 0 366.368 3.991 20 5 FHBDRN O=C([C@@H]1CC[C@H]2C[C@H]2C1)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F ZINC000421420474 942550149 /nfs/dbraw/zinc/55/01/49/942550149.db2.gz BCNMIDDCJUJZMY-SCRDCRAPSA-N 0 0 356.344 3.922 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCC(C(=O)c2ccccc2)CC1 ZINC000421421430 942550935 /nfs/dbraw/zinc/55/09/35/942550935.db2.gz NNJBKKIYVWJFAP-UHFFFAOYSA-N 0 0 366.417 3.947 20 5 FHBDRN CCOc1ccc(CCC(=O)N2CCCc3c([N+](=O)[O-])cccc32)cc1 ZINC000513843338 942553764 /nfs/dbraw/zinc/55/37/64/942553764.db2.gz XUYWBWSSWPQZQJ-UHFFFAOYSA-N 0 0 354.406 3.906 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NCc1cccc(OC(F)F)c1 ZINC000122906254 942554031 /nfs/dbraw/zinc/55/40/31/942554031.db2.gz IPDTWEJLDAMLMC-UHFFFAOYSA-N 0 0 367.308 3.527 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)Nc1cccc(C(=O)N2CCCC2)c1 ZINC000421426377 942554370 /nfs/dbraw/zinc/55/43/70/942554370.db2.gz GEDHZEZUYKVLQE-UHFFFAOYSA-N 0 0 367.405 3.700 20 5 FHBDRN COC(=O)[C@@H](c1c(F)cccc1Cl)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000541280344 942554616 /nfs/dbraw/zinc/55/46/16/942554616.db2.gz IXMWIEJZKUIBNO-MRXNPFEDSA-N 0 0 366.776 3.733 20 5 FHBDRN CC(C)OC(=O)C[C@@H]1CCCN(c2ccc([N+](=O)[O-])c3ncccc23)C1 ZINC000413245142 942559479 /nfs/dbraw/zinc/55/94/79/942559479.db2.gz ZYJJNCPIJPNMMS-AWEZNQCLSA-N 0 0 357.410 3.701 20 5 FHBDRN O=C(C[C@H]1CCCCCN1C(=O)Cc1cccc([N+](=O)[O-])c1)c1ccco1 ZINC000434267280 942562322 /nfs/dbraw/zinc/56/23/22/942562322.db2.gz RCEQCBKIHSKDPH-MRXNPFEDSA-N 0 0 370.405 3.775 20 5 FHBDRN C[C@@](CO)(CNc1ncc([N+](=O)[O-])cc1C(F)(F)F)Cc1ccccc1 ZINC000413256886 942568833 /nfs/dbraw/zinc/56/88/33/942568833.db2.gz DMKGQWILFULANT-INIZCTEOSA-N 0 0 369.343 3.662 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CCO[C@H](c2cccc(O)c2)C1 ZINC000120222933 942572703 /nfs/dbraw/zinc/57/27/03/942572703.db2.gz CPQBOIQVNJGPDP-SFHVURJKSA-N 0 0 371.393 3.523 20 5 FHBDRN Cc1cn(-c2ccc(F)cc2)nc1C(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000509541386 942572812 /nfs/dbraw/zinc/57/28/12/942572812.db2.gz JVYKDEXJCCPRHG-CYBMUJFWSA-N 0 0 368.368 3.719 20 5 FHBDRN CN(C(=O)c1nccnc1Sc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000541297142 942578911 /nfs/dbraw/zinc/57/89/11/942578911.db2.gz YSSFGJJXQUCRQO-UHFFFAOYSA-N 0 0 366.402 3.813 20 5 FHBDRN C[C@H]1COc2ccccc2CN1C(=O)CCc1ccc([N+](=O)[O-])cc1Cl ZINC001268949023 942579071 /nfs/dbraw/zinc/57/90/71/942579071.db2.gz WLGGHONFKTZIOJ-ZDUSSCGKSA-N 0 0 374.824 3.991 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N(Cc1ccco1)C[C@H]1CCCO1 ZINC000421447664 942579632 /nfs/dbraw/zinc/57/96/32/942579632.db2.gz SJUVXZOKNLDAQG-MRXNPFEDSA-N 0 0 358.394 3.626 20 5 FHBDRN C[C@@H]1CC[C@H](O)[C@@H]([C@@H]2CCCN2c2ccc([N+](=O)[O-])c3ncccc32)C1 ZINC000413266169 942584822 /nfs/dbraw/zinc/58/48/22/942584822.db2.gz KAVSSUOFBRUYOE-RGPZOAQRSA-N 0 0 355.438 3.909 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)Nc1ccc(C(=O)NC(C)C)c(C)c1 ZINC000421463430 942584847 /nfs/dbraw/zinc/58/48/47/942584847.db2.gz VTKUCMSKIMSIJU-UHFFFAOYSA-N 0 0 369.421 3.911 20 5 FHBDRN C[C@@H]1CC[C@H](O)[C@@H]([C@H]2CCCN2c2ccc([N+](=O)[O-])c3ncccc32)C1 ZINC000413266172 942584958 /nfs/dbraw/zinc/58/49/58/942584958.db2.gz KAVSSUOFBRUYOE-ZIGSKRJUSA-N 0 0 355.438 3.909 20 5 FHBDRN CCc1ccc([C@@H]2COCCN2C(=O)c2cc([N+](=O)[O-])c(C)cc2C)o1 ZINC000421465261 942586102 /nfs/dbraw/zinc/58/61/02/942586102.db2.gz BYEXHGFLTRHJKX-KRWDZBQOSA-N 0 0 358.394 3.581 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CCOCc3ccccc32)ccc1[N+](=O)[O-] ZINC000413777225 942586187 /nfs/dbraw/zinc/58/61/87/942586187.db2.gz FESZMGIDCAMJOK-UHFFFAOYSA-N 0 0 356.378 3.559 20 5 FHBDRN O=C(Nc1cc(-c2ccco2)nn1-c1cccc([N+](=O)[O-])c1)[C@@H]1CC12CC2 ZINC000421468131 942588282 /nfs/dbraw/zinc/58/82/82/942588282.db2.gz FXOFJKOYVWBPFA-AWEZNQCLSA-N 0 0 364.361 3.779 20 5 FHBDRN Cc1ccc(NC(=O)Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)cc1C ZINC000501681134 942597776 /nfs/dbraw/zinc/59/77/76/942597776.db2.gz SMTUUAGYTVLFCK-UHFFFAOYSA-N 0 0 350.378 3.714 20 5 FHBDRN CC(C)(CC(F)F)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000413791231 942598049 /nfs/dbraw/zinc/59/80/49/942598049.db2.gz LIFKEEFMHLINCE-UHFFFAOYSA-N 0 0 351.147 3.977 20 5 FHBDRN O=C(c1cc2cc([N+](=O)[O-])ccc2o1)N1CCOc2cccc(F)c2C1 ZINC000513911032 942603836 /nfs/dbraw/zinc/60/38/36/942603836.db2.gz JPKOZZQDDPYBNH-UHFFFAOYSA-N 0 0 356.309 3.515 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)NC[C@]2(C)C[C@H]2c2ccccc2)c1 ZINC000501674229 942604285 /nfs/dbraw/zinc/60/42/85/942604285.db2.gz ZUYRGZIHYKVZKW-UWJYYQICSA-N 0 0 368.433 3.982 20 5 FHBDRN O=C(Nc1nccs1)C1CCN(c2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000366572479 942606243 /nfs/dbraw/zinc/60/62/43/942606243.db2.gz SDVDXVVTQPSULR-UHFFFAOYSA-N 0 0 366.830 3.560 20 5 FHBDRN COc1cccc(C2=CCN(C(=O)c3ccc(SC)c([N+](=O)[O-])c3)C2)c1 ZINC000501677119 942607068 /nfs/dbraw/zinc/60/70/68/942607068.db2.gz VGLQKLAHVGPOSM-UHFFFAOYSA-N 0 0 370.430 3.865 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](CO)CC1CCCC1 ZINC000513924924 942609629 /nfs/dbraw/zinc/60/96/29/942609629.db2.gz ZVZSRCSUCWRMPR-CQSZACIVSA-N 0 0 366.483 3.768 20 5 FHBDRN COc1ccc(CNC(=O)CCOc2ccc(C(C)C)cc2)cc1[N+](=O)[O-] ZINC000501701084 942622031 /nfs/dbraw/zinc/62/20/31/942622031.db2.gz KKUJPWYXZYZBBS-UHFFFAOYSA-N 0 0 372.421 3.812 20 5 FHBDRN COc1ccc(C)cc1NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513720684 942623688 /nfs/dbraw/zinc/62/36/88/942623688.db2.gz NHIOAXGALCHCIW-UHFFFAOYSA-N 0 0 352.293 3.766 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1C[C@@H]2CCC(=O)c3cccc1c32 ZINC000421519291 942625262 /nfs/dbraw/zinc/62/52/62/942625262.db2.gz PLLQESUTOBNTPP-ZDUSSCGKSA-N 0 0 350.374 3.932 20 5 FHBDRN COc1ccc(CNC(=O)C[C@@H](C)c2ccc(F)cc2F)cc1[N+](=O)[O-] ZINC000501718866 942627142 /nfs/dbraw/zinc/62/71/42/942627142.db2.gz PHEUZPDADDGTGL-LLVKDONJSA-N 0 0 364.348 3.692 20 5 FHBDRN C[C@@]1(CNC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C[C@H]1c1ccccc1 ZINC000501710143 942632085 /nfs/dbraw/zinc/63/20/85/942632085.db2.gz XQXCCCUUDWGBBJ-RXVVDRJESA-N 0 0 363.417 3.929 20 5 FHBDRN CC(C)(C)[N@@H+]1CCc2nc(NC(=O)c3ccc([N+](=O)[O-])s3)sc2C1 ZINC000425075954 942632650 /nfs/dbraw/zinc/63/26/50/942632650.db2.gz FHTWXVMOHUBMSZ-UHFFFAOYSA-N 0 0 366.468 3.522 20 5 FHBDRN CCCCc1ccc(NC(=O)[C@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000104712969 942633699 /nfs/dbraw/zinc/63/36/99/942633699.db2.gz FIHBUYJXCLTIHF-AWEZNQCLSA-N 0 0 369.421 3.694 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCC[C@H]1CCCCO1 ZINC000505415842 942633621 /nfs/dbraw/zinc/63/36/21/942633621.db2.gz QWHKLSZCMGTEOP-CQSZACIVSA-N 0 0 352.456 3.786 20 5 FHBDRN CCN(Cc1nc2ccccc2c(=O)[nH]1)[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000434392190 942643613 /nfs/dbraw/zinc/64/36/13/942643613.db2.gz YZJXOSCEZXKVEP-ZDUSSCGKSA-N 0 0 352.394 3.827 20 5 FHBDRN Cc1c(Cl)c(C(=O)Nc2ccc(C(C)(C)C)c([N+](=O)[O-])c2)nn1C ZINC000421548124 942653886 /nfs/dbraw/zinc/65/38/86/942653886.db2.gz ZXWAWXNYROFGBJ-UHFFFAOYSA-N 0 0 350.806 3.840 20 5 FHBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)N[C@@H](c2ccccc2)C2CCC2)cc1 ZINC000104742835 942661361 /nfs/dbraw/zinc/66/13/61/942661361.db2.gz DJHQGQDVAZSGFF-SFHVURJKSA-N 0 0 360.435 3.556 20 5 FHBDRN O=C(c1cc2c(c([N+](=O)[O-])c1)OCO2)N1CCCCC[C@H]1c1ccco1 ZINC000182061414 942664065 /nfs/dbraw/zinc/66/40/65/942664065.db2.gz NKUWQSVUSSNOTI-ZDUSSCGKSA-N 0 0 358.350 3.674 20 5 FHBDRN CC[C@@H](C)CNC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 ZINC000421577424 942669001 /nfs/dbraw/zinc/66/90/01/942669001.db2.gz FQIBMSQSXJTVGV-ZIAGYGMSSA-N 0 0 356.426 3.939 20 5 FHBDRN CC[C@H](C)CNC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 ZINC000421577423 942669108 /nfs/dbraw/zinc/66/91/08/942669108.db2.gz FQIBMSQSXJTVGV-UONOGXRCSA-N 0 0 356.426 3.939 20 5 FHBDRN CC(C)Oc1cc(C(=O)N(C)Cc2ccccc2N(C)C)ccc1[N+](=O)[O-] ZINC000412363647 942669503 /nfs/dbraw/zinc/66/95/03/942669503.db2.gz RJWYOXSXHLQYKQ-UHFFFAOYSA-N 0 0 371.437 3.720 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])Nc1ccnc(OCc2ccccc2)c1 ZINC000501779043 942669557 /nfs/dbraw/zinc/66/95/57/942669557.db2.gz IDOJFCHZJCMLMN-UHFFFAOYSA-N 0 0 363.373 3.750 20 5 FHBDRN CC1(C)C[C@@H](NC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)C(C)(C)O1 ZINC000183603864 942669693 /nfs/dbraw/zinc/66/96/93/942669693.db2.gz TYAITUNQZYBOFS-MRXNPFEDSA-N 0 0 361.442 3.615 20 5 FHBDRN CC1(C)CN(C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)Cc2ccccc2O1 ZINC000412361854 942669942 /nfs/dbraw/zinc/66/99/42/942669942.db2.gz QHICKGYKNLBSQB-ZWKOTPCHSA-N 0 0 366.417 3.898 20 5 FHBDRN O=C(NCC[C@@H]1CCc2ccccc21)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412366094 942670545 /nfs/dbraw/zinc/67/05/45/942670545.db2.gz DSKQWPJSFFNMKY-FFZOFVMBSA-N 0 0 350.418 3.935 20 5 FHBDRN CC[C@H](NC(=O)NCCNc1ccccc1[N+](=O)[O-])c1ccc(C)cc1 ZINC000514017087 942673354 /nfs/dbraw/zinc/67/33/54/942673354.db2.gz DJNAENUNSKRGOG-INIZCTEOSA-N 0 0 356.426 3.766 20 5 FHBDRN CC(C)[C@@H](C)NC(=O)COc1ccc([N+](=O)[O-])cc1Cc1ccccc1 ZINC000016458871 942675891 /nfs/dbraw/zinc/67/58/91/942675891.db2.gz LSLKDBPFKVIHHV-OAHLLOKOSA-N 0 0 356.422 3.725 20 5 FHBDRN CSc1ccc(C(=O)NC[C@@H]2CC23CCSCC3)cc1[N+](=O)[O-] ZINC000421588596 942684578 /nfs/dbraw/zinc/68/45/78/942684578.db2.gz IYWMABNUWJIPJT-LBPRGKRZSA-N 0 0 352.481 3.580 20 5 FHBDRN Cn1cc(CN2CCc3cc(F)ccc32)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000549425964 942694685 /nfs/dbraw/zinc/69/46/85/942694685.db2.gz UVKXFBHKYSAWHR-UHFFFAOYSA-N 0 0 352.369 3.697 20 5 FHBDRN CN(Cc1ccc(F)cc1)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000047864569 942697031 /nfs/dbraw/zinc/69/70/31/942697031.db2.gz ILKJFMCKDXVBGH-UHFFFAOYSA-N 0 0 369.299 3.999 20 5 FHBDRN Cc1nc([N+](=O)[O-])c(-c2noc(/C=C/c3ccc(C4CC4)cc3)n2)n1C ZINC000420493239 942699577 /nfs/dbraw/zinc/69/95/77/942699577.db2.gz NHIAJCBWXGTBJI-BJMVGYQFSA-N 0 0 351.366 3.735 20 5 FHBDRN CC[C@H]1CN(c2ccccc2)CCN1C(=O)c1cc([N+](=O)[O-])c(C)s1 ZINC000183622979 942705519 /nfs/dbraw/zinc/70/55/19/942705519.db2.gz DJKZRAGGLUZKIV-AWEZNQCLSA-N 0 0 359.451 3.706 20 5 FHBDRN COc1ccc(CC(=O)Nc2cccc(-c3ncc(C)o3)c2)cc1[N+](=O)[O-] ZINC000066812110 942710832 /nfs/dbraw/zinc/71/08/32/942710832.db2.gz JYXXRYDBABDBSZ-UHFFFAOYSA-N 0 0 367.361 3.748 20 5 FHBDRN CN(C1CCCCC1)S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000416356573 942716797 /nfs/dbraw/zinc/71/67/97/942716797.db2.gz BLUXHFWRACSSLV-UHFFFAOYSA-N 0 0 366.361 3.567 20 5 FHBDRN C[C@@H]1CCC[C@@H](NC(=O)c2cccc([N+](=O)[O-])c2Br)[C@@H]1C ZINC000159026785 942717170 /nfs/dbraw/zinc/71/71/70/942717170.db2.gz VHLBKUWQWLGOFY-CKYFFXLPSA-N 0 0 355.232 3.912 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1OC(F)F)N1CC[C@H](C2CCCC2)C1 ZINC000421647315 942720116 /nfs/dbraw/zinc/72/01/16/942720116.db2.gz UNCKUZDINSQDSA-LBPRGKRZSA-N 0 0 354.353 3.849 20 5 FHBDRN Cc1ccc(C(=O)NCc2ccc(F)cc2Br)cc1[N+](=O)[O-] ZINC000502786073 942740677 /nfs/dbraw/zinc/74/06/77/942740677.db2.gz VNGZMKZBPWEIQA-UHFFFAOYSA-N 0 0 367.174 3.735 20 5 FHBDRN O=C(NCCc1cccnc1)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 ZINC000514091878 942741476 /nfs/dbraw/zinc/74/14/76/942741476.db2.gz YWBFNKUOBSJOMK-UHFFFAOYSA-N 0 0 363.373 3.755 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N(C(C)C)[C@@H](C)c1ccsc1 ZINC000421689802 942746044 /nfs/dbraw/zinc/74/60/44/942746044.db2.gz KVKHDGGPGRRJHU-LBPRGKRZSA-N 0 0 350.444 3.550 20 5 FHBDRN CC(C)(CNC(=O)NC(C)(C)c1ccccc1[N+](=O)[O-])c1cccnc1 ZINC000413891556 942754442 /nfs/dbraw/zinc/75/44/42/942754442.db2.gz WCJSVVQTYUTDME-UHFFFAOYSA-N 0 0 356.426 3.502 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)CCc1ncc(-c2ccccc2)o1 ZINC000014182451 942755234 /nfs/dbraw/zinc/75/52/34/942755234.db2.gz KWDVGVXGPQEBJU-UHFFFAOYSA-N 0 0 367.361 3.830 20 5 FHBDRN COc1ccc(NC(=O)[C@@H](C)N2C[C@H](C)c3ccccc32)c([N+](=O)[O-])c1 ZINC000434569264 942762169 /nfs/dbraw/zinc/76/21/69/942762169.db2.gz FLEWQXOYXBRVLI-QWHCGFSZSA-N 0 0 355.394 3.554 20 5 FHBDRN CCOC(=O)c1ccc(F)c(C)c1NC(=O)c1ccc([N+](=O)[O-])s1 ZINC000505432446 942763835 /nfs/dbraw/zinc/76/38/35/942763835.db2.gz ASYYIZPWVGAWFQ-UHFFFAOYSA-N 0 0 352.343 3.533 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])[nH]1)N1CCC[C@@H](COc2ccccc2Cl)C1 ZINC000514149440 942774333 /nfs/dbraw/zinc/77/43/33/942774333.db2.gz MPPLNFRIYRSCDJ-GFCCVEGCSA-N 0 0 363.801 3.508 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCCC12CCOCC2 ZINC000367057526 942775610 /nfs/dbraw/zinc/77/56/10/942775610.db2.gz KLHAGFHBCREULA-SJLPKXTDSA-N 0 0 360.454 3.629 20 5 FHBDRN COC(=O)CCCOc1ccc(CNc2ccc(F)cc2[N+](=O)[O-])cc1 ZINC000513757357 942780430 /nfs/dbraw/zinc/78/04/30/942780430.db2.gz YHWYFRHTJZILLA-UHFFFAOYSA-N 0 0 362.357 3.678 20 5 FHBDRN Cc1cc(C(=O)N2CC[C@@H](O)[C@H]2c2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000425103836 942783819 /nfs/dbraw/zinc/78/38/19/942783819.db2.gz BYWCNLGWMDYSPR-IAGOWNOFSA-N 0 0 360.797 3.505 20 5 FHBDRN Cc1ncc([N+](=O)[O-])n1Cc1csc(COc2ccc(Cl)cc2)n1 ZINC000502834777 942785763 /nfs/dbraw/zinc/78/57/63/942785763.db2.gz XQFPBULZKFUNQA-UHFFFAOYSA-N 0 0 364.814 3.837 20 5 FHBDRN CC[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F)c1nc(C)cs1 ZINC000181599357 942789174 /nfs/dbraw/zinc/78/91/74/942789174.db2.gz UIZVJBMUIMOVLO-NSHDSACASA-N 0 0 371.365 3.842 20 5 FHBDRN CCC[C@@H](NC(=O)Cn1nc(C)c2cc([N+](=O)[O-])ccc21)c1ccccc1 ZINC000502845869 942793332 /nfs/dbraw/zinc/79/33/32/942793332.db2.gz OZQRVOFBNFPGOE-GOSISDBHSA-N 0 0 366.421 3.911 20 5 FHBDRN CCc1ccc([C@@H](C)NC(=O)Cn2nc(C)c3cc([N+](=O)[O-])ccc32)cc1 ZINC000502848862 942794599 /nfs/dbraw/zinc/79/45/99/942794599.db2.gz VNHUIBPZLAWONJ-CYBMUJFWSA-N 0 0 366.421 3.693 20 5 FHBDRN CCn1c(CCNC(=O)c2cc([N+](=O)[O-])c(C)cc2C)nc2ccccc21 ZINC000421756499 942800112 /nfs/dbraw/zinc/80/01/12/942800112.db2.gz JZYKBNWZVVUXIY-UHFFFAOYSA-N 0 0 366.421 3.554 20 5 FHBDRN COc1cccc2c1CCN(C(=O)Nc1c(C)c([N+](=O)[O-])ccc1F)CC2 ZINC000367073659 942808655 /nfs/dbraw/zinc/80/86/55/942808655.db2.gz ULUDVGHONDWCKD-UHFFFAOYSA-N 0 0 373.384 3.684 20 5 FHBDRN Nc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC000413941450 942812504 /nfs/dbraw/zinc/81/25/04/942812504.db2.gz APJHPXLCQFYMTB-TZMCWYRMSA-N 0 0 359.813 3.897 20 5 FHBDRN Cc1cc(NC(=O)[C@H]2CCC(=O)N(C)[C@@H]2c2cccs2)ccc1[N+](=O)[O-] ZINC000378478914 942814171 /nfs/dbraw/zinc/81/41/71/942814171.db2.gz ZQCLTNPXNZLZJV-GUYCJALGSA-N 0 0 373.434 3.513 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC2(CCOCC2)[C@H]1c1ccccc1 ZINC000413951985 942818504 /nfs/dbraw/zinc/81/85/04/942818504.db2.gz HPSHTCMIMNFBQJ-LJQANCHMSA-N 0 0 366.417 3.897 20 5 FHBDRN O=C(Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1)c1ccnc2ccccc21 ZINC000104874545 942821916 /nfs/dbraw/zinc/82/19/16/942821916.db2.gz HPEHISYHCBBZDT-UHFFFAOYSA-N 0 0 359.345 3.785 20 5 FHBDRN CCS[C@H]1CCCCN(C(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)C1 ZINC000514219828 942828089 /nfs/dbraw/zinc/82/80/89/942828089.db2.gz VRURJFVEHDJPIK-LBPRGKRZSA-N 0 0 374.409 3.944 20 5 FHBDRN COc1ccc(Cl)c(NC(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)c1 ZINC000190152216 942828595 /nfs/dbraw/zinc/82/85/95/942828595.db2.gz WUASRLRAXKNUPR-UHFFFAOYSA-N 0 0 350.758 3.826 20 5 FHBDRN CCc1nc([C@H](C)NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)cs1 ZINC000514224168 942835079 /nfs/dbraw/zinc/83/50/79/942835079.db2.gz YPCMQZXIAYTFRR-QMMMGPOBSA-N 0 0 371.365 3.706 20 5 FHBDRN O=C(N[C@H]1C[C@H]1c1ccccc1C(F)(F)F)c1csc([N+](=O)[O-])c1 ZINC000505460316 942841975 /nfs/dbraw/zinc/84/19/75/942841975.db2.gz MNQUWRHDHLCTDL-JQWIXIFHSA-N 0 0 356.325 3.961 20 5 FHBDRN CC1(C)CN(C(=O)CNc2ccccc2[N+](=O)[O-])C[C@H]1c1ccccc1 ZINC000434661026 942844109 /nfs/dbraw/zinc/84/41/09/942844109.db2.gz CDPPCPYMMIBGDE-INIZCTEOSA-N 0 0 353.422 3.659 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1Oc1ccccc1)N1CCO[C@@H]2CCC[C@@H]21 ZINC000514234436 942845837 /nfs/dbraw/zinc/84/58/37/942845837.db2.gz OCFDULZGYMELGH-PKOBYXMFSA-N 0 0 368.389 3.781 20 5 FHBDRN CC(C)c1ccc(C(=O)N[C@@H](CCCO)c2ccccc2)cc1[N+](=O)[O-] ZINC000190170946 942848646 /nfs/dbraw/zinc/84/86/46/942848646.db2.gz WKCISUVYIWXWHF-SFHVURJKSA-N 0 0 356.422 3.962 20 5 FHBDRN COc1ccc(OCc2nnc(-c3ccc(Cl)cc3)o2)cc1[N+](=O)[O-] ZINC000190197351 942853254 /nfs/dbraw/zinc/85/32/54/942853254.db2.gz FLEZDOZAGYWVQK-UHFFFAOYSA-N 0 0 361.741 3.886 20 5 FHBDRN COc1cc(C(=O)Nc2ccccc2-n2nccc2C)cc([N+](=O)[O-])c1C ZINC000190198368 942854341 /nfs/dbraw/zinc/85/43/41/942854341.db2.gz LEYNDUFWVIMFDW-UHFFFAOYSA-N 0 0 366.377 3.658 20 5 FHBDRN O=[N+]([O-])c1ccccc1N1CCN(Cc2coc(-c3cccs3)n2)CC1 ZINC000016565080 942855078 /nfs/dbraw/zinc/85/50/78/942855078.db2.gz CHWXZRURCQDFFN-UHFFFAOYSA-N 0 0 370.434 3.634 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CC3(CCC3)[C@@H]2[C@@H]2CCCO2)ccc1[N+](=O)[O-] ZINC000412378356 942855686 /nfs/dbraw/zinc/85/56/86/942855686.db2.gz ZKWKLPXVNKBINR-WMZOPIPTSA-N 0 0 374.437 3.556 20 5 FHBDRN C[C@@H](CNC(=O)c1c([N+](=O)[O-])cccc1C(F)(F)F)CC(F)(F)F ZINC000413973155 942856519 /nfs/dbraw/zinc/85/65/19/942856519.db2.gz DDZMQWKTWCIBIF-SSDOTTSWSA-N 0 0 358.238 3.932 20 5 FHBDRN CCc1ccc([C@H]2CN(C(=O)c3cc(Cl)cc([N+](=O)[O-])c3)CCN2)cc1 ZINC000505469208 942863225 /nfs/dbraw/zinc/86/32/25/942863225.db2.gz NTRUPXYRKWCEHP-GOSISDBHSA-N 0 0 373.840 3.597 20 5 FHBDRN C[C@@H]1C[C@@H](NC(=O)c2c(N)cccc2[N+](=O)[O-])C[C@@H](c2ccccc2)C1 ZINC000413995310 942874901 /nfs/dbraw/zinc/87/49/01/942874901.db2.gz STXXGWMMUGVSSW-CWRNSKLLSA-N 0 0 353.422 3.879 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N(C[C@H](C)c1ccccc1)[C@@H](C)CO ZINC000421905178 942879661 /nfs/dbraw/zinc/87/96/61/942879661.db2.gz IQEANXUYOJBVKO-IRXDYDNUSA-N 0 0 370.449 3.838 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N1CCC[C@@H](CC(F)(F)F)C1 ZINC000421933782 942886017 /nfs/dbraw/zinc/88/60/17/942886017.db2.gz AZPDJMZSSHOHIS-JTQLQIEISA-N 0 0 364.751 3.982 20 5 FHBDRN CCc1ccc([C@@H]2CN(C(=O)c3ccc([N+](=O)[O-])cc3Cl)CCN2)cc1 ZINC000505483774 942890368 /nfs/dbraw/zinc/89/03/68/942890368.db2.gz MBLSICSDVXPVJT-SFHVURJKSA-N 0 0 373.840 3.597 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1Cc2ccc(O)cc2C2(CC2)C1 ZINC000421919624 942890792 /nfs/dbraw/zinc/89/07/92/942890792.db2.gz XQYBTGUXMNRCCE-UHFFFAOYSA-N 0 0 352.390 3.605 20 5 FHBDRN Cc1cc(C)c(S(=O)(=O)N(CC(F)F)c2ccccc2)cc1[N+](=O)[O-] ZINC000430081225 942890979 /nfs/dbraw/zinc/89/09/79/942890979.db2.gz WFOXKFNSBSHQDJ-UHFFFAOYSA-N 0 0 370.377 3.672 20 5 FHBDRN C[C@@H](CNC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc21)Oc1ccc(Cl)cc1 ZINC000430098390 942910382 /nfs/dbraw/zinc/91/03/82/942910382.db2.gz IVSYNDIPXHFGQQ-NSHDSACASA-N 0 0 373.796 3.927 20 5 FHBDRN CN([C@@H]1CCC[C@@H]1c1ccccc1)S(=O)(=O)c1ccccc1[N+](=O)[O-] ZINC000416546903 942935677 /nfs/dbraw/zinc/93/56/77/942935677.db2.gz UKQZBZZOFFVUQA-HZPDHXFCSA-N 0 0 360.435 3.552 20 5 FHBDRN CN([C@@H]1CCC[C@@H]1c1ccccc1)S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000416547673 942937873 /nfs/dbraw/zinc/93/78/73/942937873.db2.gz WBYABGROCWPYJH-RTBURBONSA-N 0 0 374.462 3.693 20 5 FHBDRN COc1ccc(NC(=O)Cc2nc(-c3cccs3)oc2C)c([N+](=O)[O-])c1 ZINC000514339435 942939636 /nfs/dbraw/zinc/93/96/36/942939636.db2.gz RPIZQRBZOMMUIO-UHFFFAOYSA-N 0 0 373.390 3.810 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(c2ccnn2CC)CC1 ZINC000434759857 942948084 /nfs/dbraw/zinc/94/80/84/942948084.db2.gz XKJIIAOJIRHHAK-UHFFFAOYSA-N 0 0 358.442 3.590 20 5 FHBDRN O=C(CCC(=O)N1Cc2ccc(Cl)cc2C1)c1cccc([N+](=O)[O-])c1 ZINC001299171731 942949389 /nfs/dbraw/zinc/94/93/89/942949389.db2.gz VTAXZVKDEVDSDT-UHFFFAOYSA-N 0 0 358.781 3.754 20 5 FHBDRN CC(C)c1[nH]nc(C(=O)Nc2ccc(-n3cccn3)c(Cl)c2)c1[N+](=O)[O-] ZINC000434185804 942962067 /nfs/dbraw/zinc/96/20/67/942962067.db2.gz BADOCXPKOHSMMY-UHFFFAOYSA-N 0 0 374.788 3.533 20 5 FHBDRN C[C@H]1CCCC[C@H]1OCCNC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000503097878 942985057 /nfs/dbraw/zinc/98/50/57/942985057.db2.gz GXKBEPHAWGWISV-XHDPSFHLSA-N 0 0 355.822 3.965 20 5 FHBDRN C[C@@H](Nc1ccc(NC(=O)c2cc([N+](=O)[O-])n[nH]2)cc1)c1ccccc1 ZINC000509958376 942986072 /nfs/dbraw/zinc/98/60/72/942986072.db2.gz IMEKACPLORGMAE-GFCCVEGCSA-N 0 0 351.366 3.743 20 5 FHBDRN Cc1cc(NCc2csc(-c3cccc([N+](=O)[O-])c3)n2)nn1C(C)C ZINC000422117458 943003658 /nfs/dbraw/zinc/00/36/58/943003658.db2.gz GPQPKDSTTUBWCC-UHFFFAOYSA-N 0 0 357.439 3.838 20 5 FHBDRN O=C(Nc1cc(-c2ccco2)nn1-c1cccc([N+](=O)[O-])c1)C1=CCC1 ZINC000503138422 943005278 /nfs/dbraw/zinc/00/52/78/943005278.db2.gz JOEQNAICRVPRJK-UHFFFAOYSA-N 0 0 350.334 3.699 20 5 FHBDRN COC(=O)c1cnoc1COc1ccc(-c2ccccc2)cc1[N+](=O)[O-] ZINC000505553847 943012001 /nfs/dbraw/zinc/01/20/01/943012001.db2.gz RBMQGFHOIRWIJQ-UHFFFAOYSA-N 0 0 354.318 3.615 20 5 FHBDRN O=C(N[C@@H]1C[C@H]1c1ccccc1C(F)(F)F)c1ccc([N+](=O)[O-])s1 ZINC000505551571 943017022 /nfs/dbraw/zinc/01/70/22/943017022.db2.gz SRPVOXUXNQAQJZ-GXSJLCMTSA-N 0 0 356.325 3.961 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)N(C)C2CC(OC(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000422167711 943019882 /nfs/dbraw/zinc/01/98/82/943019882.db2.gz BNYVPMRAOBQZOM-JEYLPNPQSA-N 0 0 363.458 3.952 20 5 FHBDRN Cc1cc(NC(=O)c2csc([N+](=O)[O-])c2)cnc1N1CCCC[C@@H]1C ZINC000503175871 943023214 /nfs/dbraw/zinc/02/32/14/943023214.db2.gz NTVSUGOCPPRTHM-LBPRGKRZSA-N 0 0 360.439 3.991 20 5 FHBDRN Cc1cc(NC(=O)c2csc([N+](=O)[O-])c2)cnc1N1CCCC[C@H]1C ZINC000503175870 943023501 /nfs/dbraw/zinc/02/35/01/943023501.db2.gz NTVSUGOCPPRTHM-GFCCVEGCSA-N 0 0 360.439 3.991 20 5 FHBDRN COC(=O)c1cc(N[C@H](c2cnn(C)c2)C(C)(C)C)cc(C)c1[N+](=O)[O-] ZINC000425232202 943027361 /nfs/dbraw/zinc/02/73/61/943027361.db2.gz FHBOZHUEBTUAJT-MRXNPFEDSA-N 0 0 360.414 3.623 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)C(C)(C)COCc1ccccc1 ZINC000503182312 943033014 /nfs/dbraw/zinc/03/30/14/943033014.db2.gz SESNZDRCBAWSCG-UHFFFAOYSA-N 0 0 356.422 3.796 20 5 FHBDRN CCn1nccc1NC(=O)c1ccc(N2C[C@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000514472004 943042851 /nfs/dbraw/zinc/04/28/51/943042851.db2.gz OVDADQMXXZJLRK-OKILXGFUSA-N 0 0 371.441 3.546 20 5 FHBDRN O=C(OCc1cccc(F)c1F)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000016685731 943050702 /nfs/dbraw/zinc/05/07/02/943050702.db2.gz VYZYRUAXAPNCLU-UHFFFAOYSA-N 0 0 372.121 3.993 20 5 FHBDRN C[C@H](c1ccccc1[N+](=O)[O-])N(C)CC(=O)N(C)[C@H](C)c1ccccc1 ZINC000503190392 943051054 /nfs/dbraw/zinc/05/10/54/943051054.db2.gz QDDMATXSDRCYMW-HZPDHXFCSA-N 0 0 355.438 3.807 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1OCc1cc(Cl)c2c(c1)OCCCO2 ZINC000014344501 943054205 /nfs/dbraw/zinc/05/42/05/943054205.db2.gz WNNNKOKTKMIRHW-UHFFFAOYSA-N 0 0 365.769 3.997 20 5 FHBDRN CCOc1cc(C(=O)N([C@H](C)C(C)C)C2CC2)c([N+](=O)[O-])cc1OC ZINC000514498345 943054502 /nfs/dbraw/zinc/05/45/02/943054502.db2.gz JUWFFXBLBNWNTG-GFCCVEGCSA-N 0 0 350.415 3.651 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)cnc1NCCc1nc(-c2ccncc2)cs1 ZINC000434942728 943057303 /nfs/dbraw/zinc/05/73/03/943057303.db2.gz LKIWOCXUGMFYIT-UHFFFAOYSA-N 0 0 361.814 3.816 20 5 FHBDRN CCO[C@@H]1C[C@@H](N(C)C(=O)c2ccc(OC)c([N+](=O)[O-])c2)C1(CC)CC ZINC000434171456 943065945 /nfs/dbraw/zinc/06/59/45/943065945.db2.gz CRBTYJAPBALMFG-IAGOWNOFSA-N 0 0 364.442 3.659 20 5 FHBDRN Cc1ccc2c(CCC(=O)Nc3n[nH]c4ccc([N+](=O)[O-])cc43)c[nH]c2c1 ZINC000536253603 943066342 /nfs/dbraw/zinc/06/63/42/943066342.db2.gz PTSOZJFQRJVMLT-UHFFFAOYSA-N 0 0 363.377 3.832 20 5 FHBDRN C[C@H](c1cccc(Nc2ncc(Cl)cc2[N+](=O)[O-])c1)N1CCOCC1 ZINC000434945712 943066780 /nfs/dbraw/zinc/06/67/80/943066780.db2.gz FPKAARYKMUOLID-GFCCVEGCSA-N 0 0 362.817 3.780 20 5 FHBDRN C[C@H]1[C@@H](c2ccccc2)c2ccccc2CCN1c1c([N+](=O)[O-])ncn1C ZINC000434947341 943067885 /nfs/dbraw/zinc/06/78/85/943067885.db2.gz PIZBDSTYJBPTGX-KXBFYZLASA-N 0 0 362.433 3.911 20 5 FHBDRN CCOCCOCc1cccc(CNc2ncc(Cl)cc2[N+](=O)[O-])c1 ZINC000434952692 943070509 /nfs/dbraw/zinc/07/05/09/943070509.db2.gz YYFPSRKUFTVSRQ-UHFFFAOYSA-N 0 0 365.817 3.808 20 5 FHBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H](OC)C1CC1 ZINC000511580271 943072522 /nfs/dbraw/zinc/07/25/22/943072522.db2.gz WSLAUOYAIZAROY-OAHLLOKOSA-N 0 0 352.456 3.642 20 5 FHBDRN NC(=O)c1ccc(CN2CC3(CCCC3)c3ccccc32)c([N+](=O)[O-])c1 ZINC000434984034 943085078 /nfs/dbraw/zinc/08/50/78/943085078.db2.gz VAUIURNBMPAOLU-UHFFFAOYSA-N 0 0 351.406 3.526 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCc1ccc(F)cc1F ZINC000514532414 943088927 /nfs/dbraw/zinc/08/89/27/943088927.db2.gz QQVPCIGRWXNRHC-JTQLQIEISA-N 0 0 352.362 3.670 20 5 FHBDRN C[C@H]1CCCN(c2ccc(C(=O)NCc3cccc(F)c3)cc2[N+](=O)[O-])C1 ZINC000514532438 943089019 /nfs/dbraw/zinc/08/90/19/943089019.db2.gz WENVMUZNBVDFPT-AWEZNQCLSA-N 0 0 371.412 3.900 20 5 FHBDRN CC(C)(C)c1ccc2c(c1)CCN2C(=O)COc1ccccc1[N+](=O)[O-] ZINC001269887115 943089272 /nfs/dbraw/zinc/08/92/72/943089272.db2.gz PXRQETSULXQSQP-UHFFFAOYSA-N 0 0 354.406 3.860 20 5 FHBDRN COCC[C@@H](Nc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1)c1ccco1 ZINC000503258454 943089987 /nfs/dbraw/zinc/08/99/87/943089987.db2.gz YOLMZURRJOIQSC-MRXNPFEDSA-N 0 0 373.409 3.614 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1Br)N1CCc2c1cccc2F ZINC000183733289 943092248 /nfs/dbraw/zinc/09/22/48/943092248.db2.gz WWWDRXPSGVTZIU-UHFFFAOYSA-N 0 0 365.158 3.699 20 5 FHBDRN Cc1c(CN(C)CC(=O)N(C)[C@H](C)c2ccccc2)cccc1[N+](=O)[O-] ZINC000503266321 943098505 /nfs/dbraw/zinc/09/85/05/943098505.db2.gz UHYLBRHAQFAVAN-MRXNPFEDSA-N 0 0 355.438 3.555 20 5 FHBDRN Cc1c(CN(C)CC(=O)N(C)[C@@H](C)c2ccccc2)cccc1[N+](=O)[O-] ZINC000503266319 943098529 /nfs/dbraw/zinc/09/85/29/943098529.db2.gz UHYLBRHAQFAVAN-INIZCTEOSA-N 0 0 355.438 3.555 20 5 FHBDRN O=[N+]([O-])c1ccccc1/C=C/CNCc1noc(-c2ccccc2F)n1 ZINC000435025438 943109631 /nfs/dbraw/zinc/10/96/31/943109631.db2.gz DAFXRTAFFBTELH-FNORWQNLSA-N 0 0 354.341 3.587 20 5 FHBDRN CCOc1ccc(CN(C(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])C(C)C)cc1 ZINC000434192093 943111929 /nfs/dbraw/zinc/11/19/29/943111929.db2.gz UWXWCWDOCGXLKA-UHFFFAOYSA-N 0 0 374.441 3.891 20 5 FHBDRN COCC[C@H](Nc1cc(C)nc(-c2ccc([N+](=O)[O-])cc2)n1)c1ccco1 ZINC000503305345 943112350 /nfs/dbraw/zinc/11/23/50/943112350.db2.gz TVDQUEAUKMFGFY-INIZCTEOSA-N 0 0 368.393 3.565 20 5 FHBDRN Cc1ccc([C@H](CC(=O)OC(C)C)NC(=O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000014383050 943128608 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3.500 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N(C)CCC1CCOCC1 ZINC000503416904 943173739 /nfs/dbraw/zinc/17/37/39/943173739.db2.gz CWCQBSVVXODYQK-UHFFFAOYSA-N 0 0 366.483 3.986 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H](OCC(C)C)C1 ZINC000503419954 943175526 /nfs/dbraw/zinc/17/55/26/943175526.db2.gz ILUIFAAZEILUCC-OAHLLOKOSA-N 0 0 366.483 3.984 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H](OCC(C)C)C1 ZINC000503419952 943175736 /nfs/dbraw/zinc/17/57/36/943175736.db2.gz ILUIFAAZEILUCC-HNNXBMFYSA-N 0 0 366.483 3.984 20 5 FHBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)N2CCCC3(CCCCC3)C2)cc1 ZINC000503454657 943191273 /nfs/dbraw/zinc/19/12/73/943191273.db2.gz IGCTZSPNKOZVRN-UHFFFAOYSA-N 0 0 366.483 3.513 20 5 FHBDRN CCOC(=O)C[C@](C)(NC(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1)C(C)C ZINC001269911321 943196011 /nfs/dbraw/zinc/19/60/11/943196011.db2.gz FDBKMXRAKVXPRK-IBGZPJMESA-N 0 0 364.442 3.816 20 5 FHBDRN CCOC(=O)c1cc(C(=O)N[C@H](C)[C@H](C)c2ccccc2)cc([N+](=O)[O-])c1 ZINC000473552257 943204537 /nfs/dbraw/zinc/20/45/37/943204537.db2.gz YLQKDWOKUYTQKI-UONOGXRCSA-N 0 0 370.405 3.694 20 5 FHBDRN O=[N+]([O-])c1ccc(CNCc2cncc(Br)c2)c(Cl)c1 ZINC000183807443 943218632 /nfs/dbraw/zinc/21/86/32/943218632.db2.gz JPIPMMMRJUGABR-UHFFFAOYSA-N 0 0 356.607 3.696 20 5 FHBDRN C[C@@H]1[C@@H](C(=O)Nc2cc3c(cc2[N+](=O)[O-])OCCCO3)[C@@H]1c1ccccc1 ZINC000430125988 943221115 /nfs/dbraw/zinc/22/11/15/943221115.db2.gz UZERUGBXZSMZIW-YXKWSERDSA-N 0 0 368.389 3.744 20 5 FHBDRN Cc1ccc2c(c1)N(C(=O)Cc1c(F)cc([N+](=O)[O-])cc1F)C[C@H](C)O2 ZINC000514688791 943224151 /nfs/dbraw/zinc/22/41/51/943224151.db2.gz SKGGHOFRUJQDET-NSHDSACASA-N 0 0 362.332 3.538 20 5 FHBDRN COc1cccc(C2(CNc3cc4c(cc3[N+](=O)[O-])CCC(=O)N4)CC2)c1 ZINC000514699457 943230764 /nfs/dbraw/zinc/23/07/64/943230764.db2.gz YITVVRYWHRDUCL-UHFFFAOYSA-N 0 0 367.405 3.632 20 5 FHBDRN CCn1c(SCCOCC2CCC2)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000416927694 943232399 /nfs/dbraw/zinc/23/23/99/943232399.db2.gz SYOKGQCWYKFNTD-UHFFFAOYSA-N 0 0 362.455 3.782 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CCC1(CNC(=O)Nc2cc(Br)cc([N+](=O)[O-])c2C)CC1 ZINC000435322884 943323699 /nfs/dbraw/zinc/32/36/99/943323699.db2.gz HRJXIVOKEXSHRE-UHFFFAOYSA-N 0 0 356.220 3.977 20 5 FHBDRN Cc1c(NC(=O)NCC2CCCC2)cc(Br)cc1[N+](=O)[O-] ZINC000435323162 943323795 /nfs/dbraw/zinc/32/37/95/943323795.db2.gz KDAYDEXMYQOZKK-UHFFFAOYSA-N 0 0 356.220 3.977 20 5 FHBDRN COC(=O)[C@H](C)c1cccc(NCc2cc(OC)c(F)cc2[N+](=O)[O-])c1 ZINC000417075697 943329144 /nfs/dbraw/zinc/32/91/44/943329144.db2.gz KWKFKAMVQMFEFO-LLVKDONJSA-N 0 0 362.357 3.631 20 5 FHBDRN O=C(Nc1cccc2c1OCCC2=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000503681693 943329359 /nfs/dbraw/zinc/32/93/59/943329359.db2.gz RRUPGQSJCDFMKA-UHFFFAOYSA-N 0 0 352.302 3.559 20 5 FHBDRN CC(C)(C(=O)N1CC[C@@H](COc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000505667040 943341750 /nfs/dbraw/zinc/34/17/50/943341750.db2.gz YNDNDVMGNRVDIU-MRXNPFEDSA-N 0 0 368.433 3.800 20 5 FHBDRN CN(CCCCNC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)c1ccccc1 ZINC000053212910 943343192 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FHBDRN CC(C)n1c(CNC(=O)[C@H](C)c2cccc([N+](=O)[O-])c2)nc2ccccc21 ZINC000514905917 943376324 /nfs/dbraw/zinc/37/63/24/943376324.db2.gz RTMKANQSGFAXBT-CQSZACIVSA-N 0 0 366.421 3.945 20 5 FHBDRN O=C(CSc1cccc2cccnc21)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000053222141 943376307 /nfs/dbraw/zinc/37/63/07/943376307.db2.gz PCXSNYZPEFPIOH-UHFFFAOYSA-N 0 0 365.414 3.824 20 5 FHBDRN CC[C@H](CC(F)(F)F)NC(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000545482090 943376713 /nfs/dbraw/zinc/37/67/13/943376713.db2.gz AZSOBEIPWSWGIJ-CYBMUJFWSA-N 0 0 361.364 3.948 20 5 FHBDRN Cc1ccc(Cl)c(O[C@@H](C)C(=O)NCCc2ccc([N+](=O)[O-])cc2)c1 ZINC000053218942 943382509 /nfs/dbraw/zinc/38/25/09/943382509.db2.gz SNBJDNHRTXFWIR-ZDUSSCGKSA-N 0 0 362.813 3.683 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)c1csc(-c2cccs2)n1 ZINC000053216864 943386656 /nfs/dbraw/zinc/38/66/56/943386656.db2.gz LXKOFXJVVYUIKO-UHFFFAOYSA-N 0 0 359.432 3.752 20 5 FHBDRN Cc1oc(-c2ccccc2)nc1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000514927179 943398312 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CC[C@](C)(COc1ncccc1Cl)NC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000435456174 943435524 /nfs/dbraw/zinc/43/55/24/943435524.db2.gz FGJAYHQSHOBNBH-QGZVFWFLSA-N 0 0 363.801 3.621 20 5 FHBDRN CC(C)CCN(CCC(C)C)C(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000514995863 943439848 /nfs/dbraw/zinc/43/98/48/943439848.db2.gz IKDXUOPODVFJKZ-UHFFFAOYSA-N 0 0 364.442 3.900 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)N1CCC[C@@H]1/C=C/c1ccccc1 ZINC000504007601 943454958 /nfs/dbraw/zinc/45/49/58/943454958.db2.gz GFKBXNZIZAOTLD-VEGGFIAOSA-N 0 0 351.406 3.982 20 5 FHBDRN Cc1cc(NC[C@H](CO)Cc2ccco2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000549467066 943457744 /nfs/dbraw/zinc/45/77/44/943457744.db2.gz OSPXGHADFHZDDV-LLVKDONJSA-N 0 0 358.316 3.778 20 5 FHBDRN CCN(CC)C(=O)c1ccc(C(=O)Oc2ccc(C)cc2[N+](=O)[O-])cc1 ZINC000103737560 943467548 /nfs/dbraw/zinc/46/75/48/943467548.db2.gz ODTWFDWHXUZSIG-UHFFFAOYSA-N 0 0 356.378 3.604 20 5 FHBDRN CCOC1CC(CSc2nnc(-c3ccc([N+](=O)[O-])cc3)n2CC)C1 ZINC000505705424 943474354 /nfs/dbraw/zinc/47/43/54/943474354.db2.gz IYGSPSVXEHHPLL-UHFFFAOYSA-N 0 0 362.455 3.780 20 5 FHBDRN COc1cccc(C(=O)Nc2cccc(-c3nccs3)c2)c1[N+](=O)[O-] ZINC000435548748 943481190 /nfs/dbraw/zinc/48/11/90/943481190.db2.gz GWBFPEYYLWBUOY-UHFFFAOYSA-N 0 0 355.375 3.979 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)OCc1ccc2c(c1)CCO2 ZINC000728772514 943494628 /nfs/dbraw/zinc/49/46/28/943494628.db2.gz UGRNTSAJHSXWSC-GFCCVEGCSA-N 0 0 359.403 3.754 20 5 FHBDRN CNC(=O)c1ccc(Oc2ccccc2OC(F)(F)F)c([N+](=O)[O-])c1 ZINC000183963579 943498486 /nfs/dbraw/zinc/49/84/86/943498486.db2.gz JSISLAPTCADSKV-UHFFFAOYSA-N 0 0 356.256 3.645 20 5 FHBDRN O=C([C@@H]1CC[C@H](Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)C1)N1CCCC1 ZINC000435583973 943502158 /nfs/dbraw/zinc/50/21/58/943502158.db2.gz MGQSKQSUCAJFIG-NEPJUHHUSA-N 0 0 371.359 3.817 20 5 FHBDRN CCOC(=O)c1ccnc(N[C@H]2C[C@H](c3ccccc3F)C2)c1[N+](=O)[O-] ZINC000435587231 943505469 /nfs/dbraw/zinc/50/54/69/943505469.db2.gz BVMNIAQKSXUNGU-HAQNSBGRSA-N 0 0 359.357 3.664 20 5 FHBDRN COc1cc(C(=O)Nc2ccc(OC)c3cccnc23)c([N+](=O)[O-])cc1F ZINC001269499010 943506878 /nfs/dbraw/zinc/50/68/78/943506878.db2.gz NFUIMXYVLWXAEO-UHFFFAOYSA-N 0 0 371.324 3.552 20 5 FHBDRN COc1cccc(C(=O)N(CCc2ccccc2)CC(C)C)c1[N+](=O)[O-] ZINC000435616254 943516942 /nfs/dbraw/zinc/51/69/42/943516942.db2.gz KDRYQQIWIHRAAB-UHFFFAOYSA-N 0 0 356.422 3.944 20 5 FHBDRN Cc1cc(F)cc2c1CN(C(=O)c1c[nH]c3cccc([N+](=O)[O-])c31)CC2 ZINC000504136499 943519228 /nfs/dbraw/zinc/51/92/28/943519228.db2.gz OZCJQPYJSVIZFC-UHFFFAOYSA-N 0 0 353.353 3.722 20 5 FHBDRN COc1cccc(C(=O)N[C@H](C)c2ccccc2OC(F)F)c1[N+](=O)[O-] ZINC000435633484 943520989 /nfs/dbraw/zinc/52/09/89/943520989.db2.gz CJIOWMWLWUNLKB-SNVBAGLBSA-N 0 0 366.320 3.696 20 5 FHBDRN CCOc1ccc(C(=O)N2CC[C@H](COc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000504154652 943523228 /nfs/dbraw/zinc/52/32/28/943523228.db2.gz BPHRCHGWUKEOJM-HNNXBMFYSA-N 0 0 370.405 3.535 20 5 FHBDRN CCOc1ccc(C(=O)N2C[C@@H]3CCCN3c3ccccc32)cc1[N+](=O)[O-] ZINC000515171410 943535563 /nfs/dbraw/zinc/53/55/63/943535563.db2.gz DKORFEABXDZXII-HNNXBMFYSA-N 0 0 367.405 3.623 20 5 FHBDRN C[C@@H](C(=O)N[C@@H](C)COc1ccc(F)cc1F)c1cccc([N+](=O)[O-])c1 ZINC000584754576 943536436 /nfs/dbraw/zinc/53/64/36/943536436.db2.gz BNVDHTNNGRNDGC-NWDGAFQWSA-N 0 0 364.348 3.560 20 5 FHBDRN CC(C)(C)Oc1cccc(CNC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)n1 ZINC000504207096 943538340 /nfs/dbraw/zinc/53/83/40/943538340.db2.gz DVJDAQMTGIBDEQ-UHFFFAOYSA-N 0 0 368.393 3.578 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1)[C@@H](NCc1nccc(C(F)(F)F)n1)CCCC2 ZINC000417358070 943538896 /nfs/dbraw/zinc/53/88/96/943538896.db2.gz HMTRAVNPGHTRAI-AWEZNQCLSA-N 0 0 366.343 3.961 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N[C@@H]1CCCc2cc(N)ccc21 ZINC000423543736 943552816 /nfs/dbraw/zinc/55/28/16/943552816.db2.gz HPYGPMUBURLUNB-QGZVFWFLSA-N 0 0 353.422 3.910 20 5 FHBDRN CC[C@@H](O)CN(Cc1ccccc1)C(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000435710593 943557904 /nfs/dbraw/zinc/55/79/04/943557904.db2.gz VOVLQXBSGFSOLI-QGZVFWFLSA-N 0 0 368.389 3.754 20 5 FHBDRN O=C(Cc1ccccc1F)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F ZINC000515198972 943561395 /nfs/dbraw/zinc/56/13/95/943561395.db2.gz GUXAVZLBWIVERW-UHFFFAOYSA-N 0 0 370.302 3.868 20 5 FHBDRN CN(C)[C@H](c1nc(-c2cccc([N+](=O)[O-])c2)no1)c1cccc(Cl)c1 ZINC000504252763 943563514 /nfs/dbraw/zinc/56/35/14/943563514.db2.gz KEUVPSLYSRHHCN-HNNXBMFYSA-N 0 0 358.785 3.949 20 5 FHBDRN CCc1cccc(-c2nc(Cc3cc(OC)ccc3[N+](=O)[O-])no2)c1O ZINC000515202806 943564401 /nfs/dbraw/zinc/56/44/01/943564401.db2.gz IOZRZALUNJPLIN-UHFFFAOYSA-N 0 0 355.350 3.512 20 5 FHBDRN Nc1c(C(=O)Nc2ccc(OCC(F)(F)F)c(F)c2)cccc1[N+](=O)[O-] ZINC000504260875 943565779 /nfs/dbraw/zinc/56/57/79/943565779.db2.gz IBGGYLOZJVYAJW-UHFFFAOYSA-N 0 0 373.262 3.510 20 5 FHBDRN CCOCCOc1ccccc1-c1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000504260763 943565787 /nfs/dbraw/zinc/56/57/87/943565787.db2.gz QKBSCBGOLCIZJS-UHFFFAOYSA-N 0 0 355.350 3.727 20 5 FHBDRN COc1ccc(Cl)cc1CC(=O)N1c2ccc([N+](=O)[O-])cc2C[C@@H]1C ZINC000504275729 943568166 /nfs/dbraw/zinc/56/81/66/943568166.db2.gz YZMSKEGUCWWAML-NSHDSACASA-N 0 0 360.797 3.777 20 5 FHBDRN COC(=O)[C@@H](C)c1ccc(NC(=O)NCc2cccc([N+](=O)[O-])c2C)cc1 ZINC000417399899 943581783 /nfs/dbraw/zinc/58/17/83/943581783.db2.gz XJGLZSGOTLVDLL-ZDUSSCGKSA-N 0 0 371.393 3.501 20 5 FHBDRN C[C@H](Cc1ccsc1)Nc1ccc([N+](=O)[O-])c(N2CCOCC2)c1F ZINC000566479035 943586703 /nfs/dbraw/zinc/58/67/03/943586703.db2.gz PPFVQNYMZWTSIF-GFCCVEGCSA-N 0 0 365.430 3.675 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1F)N[C@@H]1C[C@H]1c1c(F)cccc1F ZINC000435733866 943587494 /nfs/dbraw/zinc/58/74/94/943587494.db2.gz UXNJXQIWYFUIMP-YMTOWFKASA-N 0 0 351.284 3.690 20 5 FHBDRN CN(c1cccc([N+](=O)[O-])c1)S(=O)(=O)c1cc(Cl)cc(Cl)c1 ZINC000513813339 943589069 /nfs/dbraw/zinc/58/90/69/943589069.db2.gz BQJGRIIMPGBXIK-UHFFFAOYSA-N 0 0 361.206 3.727 20 5 FHBDRN O=C(NCCc1ccc(Cl)cc1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000017297587 943590168 /nfs/dbraw/zinc/59/01/68/943590168.db2.gz DNQRPZVAEZKAOU-UHFFFAOYSA-N 0 0 373.840 3.821 20 5 FHBDRN O=C(c1n[nH]c2ccc([N+](=O)[O-])cc21)N1CCC[C@H]1/C=C/c1ccccc1 ZINC000504336635 943599903 /nfs/dbraw/zinc/59/99/03/943599903.db2.gz OLWIECGOHGMYPB-HVHJFMEUSA-N 0 0 362.389 3.789 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2cnn(Cc3nc(-c4ccccc4F)no3)c2)c1 ZINC000435770260 943600881 /nfs/dbraw/zinc/60/08/81/943600881.db2.gz NYOPCMXNEJDNBW-UHFFFAOYSA-N 0 0 365.324 3.696 20 5 FHBDRN COc1cc(COc2ccccc2NC(=O)C2CC2)c([N+](=O)[O-])cc1F ZINC000183967835 943605069 /nfs/dbraw/zinc/60/50/69/943605069.db2.gz RICSNJVCZZOMBZ-UHFFFAOYSA-N 0 0 360.341 3.670 20 5 FHBDRN COc1ccccc1-n1cnnc1SCc1c(F)cccc1[N+](=O)[O-] ZINC000504553677 943676051 /nfs/dbraw/zinc/67/60/51/943676051.db2.gz PRZFWQLLIQDYKK-UHFFFAOYSA-N 0 0 360.370 3.616 20 5 FHBDRN C[C@](NC(=O)Cc1cccc([N+](=O)[O-])c1)(c1ccccc1)C(F)(F)F ZINC000504571001 943686841 /nfs/dbraw/zinc/68/68/41/943686841.db2.gz QCHQFNIPLAIVHP-INIZCTEOSA-N 0 0 352.312 3.731 20 5 FHBDRN COC(=O)c1cc(C(=O)NC(CC(C)C)CC(C)C)cc([N+](=O)[O-])c1 ZINC000504573544 943687648 /nfs/dbraw/zinc/68/76/48/943687648.db2.gz XQEZMVOZKKXEDM-UHFFFAOYSA-N 0 0 350.415 3.572 20 5 FHBDRN CCc1ccc2c(c1)[C@@H](NC(=O)/C=C\c1ccc([N+](=O)[O-])cc1)CCO2 ZINC001267861766 943696630 /nfs/dbraw/zinc/69/66/30/943696630.db2.gz OJSXHPCFFIZVGX-TWVNLXSWSA-N 0 0 352.390 3.810 20 5 FHBDRN Cc1csc(C[C@H]2CCN(C(=O)Nc3ccc([N+](=O)[O-])cc3C)C2)n1 ZINC000930882919 943736023 /nfs/dbraw/zinc/73/60/23/943736023.db2.gz LZROLESVOSOUDP-CYBMUJFWSA-N 0 0 360.439 3.765 20 5 FHBDRN O=C(c1csc([N+](=O)[O-])c1)N1CCC[C@@H](Oc2ccccc2Cl)C1 ZINC000504670345 943737479 /nfs/dbraw/zinc/73/74/79/943737479.db2.gz QBLMLEAGJXGDBK-GFCCVEGCSA-N 0 0 366.826 3.993 20 5 FHBDRN O=C(c1csc([N+](=O)[O-])c1)N1CCC[C@H](Oc2ccccc2Cl)C1 ZINC000504670346 943737622 /nfs/dbraw/zinc/73/76/22/943737622.db2.gz QBLMLEAGJXGDBK-LBPRGKRZSA-N 0 0 366.826 3.993 20 5 FHBDRN COCCSc1ccc([C@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000504702677 943748701 /nfs/dbraw/zinc/74/87/01/943748701.db2.gz IPFGXWDFUCUNIM-ZDUSSCGKSA-N 0 0 360.435 3.824 20 5 FHBDRN CCSc1ccc([C@@H](C)NC(=O)COc2cccc([N+](=O)[O-])c2)cc1 ZINC000504713803 943756306 /nfs/dbraw/zinc/75/63/06/943756306.db2.gz YUJAGSHCQQCONX-CYBMUJFWSA-N 0 0 360.435 3.963 20 5 FHBDRN CC[C@H](C)[C@@H](C)N(C(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-])C1CC1 ZINC000105380753 943757695 /nfs/dbraw/zinc/75/76/95/943757695.db2.gz FAOHLGSWVCIBRZ-NWDGAFQWSA-N 0 0 350.415 3.651 20 5 FHBDRN Cn1c(C(=O)N[C@H]2C[C@H](c3ccc(C(F)(F)F)cc3)C2)ccc1[N+](=O)[O-] ZINC000437392031 943758576 /nfs/dbraw/zinc/75/85/76/943758576.db2.gz IDHWIJHSIYCRGY-AULYBMBSSA-N 0 0 367.327 3.628 20 5 FHBDRN CCNc1ccc(C(=O)N2C[C@@H]3CCCN3c3ccccc32)cc1[N+](=O)[O-] ZINC000515283392 943759615 /nfs/dbraw/zinc/75/96/15/943759615.db2.gz BCMYORRRZSKVDF-HNNXBMFYSA-N 0 0 366.421 3.656 20 5 FHBDRN CC(C)(NC(=O)N[C@@H]1[C@H]2CCc3ccccc3[C@@H]12)c1ccc([N+](=O)[O-])cc1 ZINC000435790842 943759722 /nfs/dbraw/zinc/75/97/22/943759722.db2.gz NZKYGGHYLJHDIO-IPMKNSEASA-N 0 0 365.433 3.858 20 5 FHBDRN CCOc1cc(NC(=O)[C@H]2CCC[C@@H](F)C2)c([N+](=O)[O-])cc1OCC ZINC000425409560 943761310 /nfs/dbraw/zinc/76/13/10/943761310.db2.gz AWQUKGLQXDYFFF-NWDGAFQWSA-N 0 0 354.378 3.859 20 5 FHBDRN CC(C)(CNC(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCc2ccccc2C1 ZINC000504737036 943763020 /nfs/dbraw/zinc/76/30/20/943763020.db2.gz HXJPOVWDXCDUJQ-UHFFFAOYSA-N 0 0 368.437 3.553 20 5 FHBDRN C[C@@H]1CN(C(=O)c2cc3cc([N+](=O)[O-])ccc3o2)[C@H](c2ccccc2)CO1 ZINC000437380070 943764595 /nfs/dbraw/zinc/76/45/95/943764595.db2.gz LKYVUFJOENZEQK-DYVFJYSZSA-N 0 0 366.373 3.943 20 5 FHBDRN O=C(c1cc(F)cc2c(=O)c3cccc(F)c3[nH]c12)N1CCCCCC1 ZINC000435814614 943771683 /nfs/dbraw/zinc/77/16/83/943771683.db2.gz XWFWBEUPQDOZLF-UHFFFAOYSA-N 0 0 356.372 3.976 20 5 FHBDRN CCSc1ccc([C@@H](C)NC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)cc1 ZINC000504728446 943772653 /nfs/dbraw/zinc/77/26/53/943772653.db2.gz CMVIHYVIZDKEBF-GFCCVEGCSA-N 0 0 362.455 3.516 20 5 FHBDRN Cc1ccc2c(C(=O)N3CCc4ncc([N+](=O)[O-])cc4C3)csc2c1 ZINC000435800025 943776893 /nfs/dbraw/zinc/77/68/93/943776893.db2.gz NZEKQAYUXGZELK-UHFFFAOYSA-N 0 0 353.403 3.711 20 5 FHBDRN COc1cccc(C(=O)NCc2ccc(-c3cccnc3)cc2)c1[N+](=O)[O-] ZINC000435810076 943784596 /nfs/dbraw/zinc/78/45/96/943784596.db2.gz RRVIQNDPELECPQ-UHFFFAOYSA-N 0 0 363.373 3.595 20 5 FHBDRN COc1cc(C(=O)NC2CC(C(C)(C)C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000504757913 943786086 /nfs/dbraw/zinc/78/60/86/943786086.db2.gz WKNFUINATSNJRH-UHFFFAOYSA-N 0 0 372.368 3.759 20 5 FHBDRN C[C@H]([C@@H]([NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C(=O)[O-])C1CC1 ZINC000417642681 943791037 /nfs/dbraw/zinc/79/10/37/943791037.db2.gz WPSYZVBKFVEIOC-APPDUMDISA-N 0 0 360.435 3.912 20 5 FHBDRN Cc1cc(OCC(=O)N2CC[C@H](C)c3cccc(O)c32)ccc1[N+](=O)[O-] ZINC000435823494 943796635 /nfs/dbraw/zinc/79/66/35/943796635.db2.gz DCJIEZYINJLDOM-LBPRGKRZSA-N 0 0 356.378 3.528 20 5 FHBDRN O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)Nc1cccc(Br)c1 ZINC000584859802 943799104 /nfs/dbraw/zinc/79/91/04/943799104.db2.gz XGXBOKPGNMLZSO-UHFFFAOYSA-N 0 0 371.137 3.817 20 5 FHBDRN O=C(CSc1ccccc1[N+](=O)[O-])Nc1cccnc1N1CCCCC1 ZINC001269611093 943799511 /nfs/dbraw/zinc/79/95/11/943799511.db2.gz BJAFAZTZNNMPJU-UHFFFAOYSA-N 0 0 372.450 3.711 20 5 FHBDRN CC(C)N(Cc1ccccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)n1C ZINC000515333116 943802483 /nfs/dbraw/zinc/80/24/83/943802483.db2.gz ZLABTMSAFBGTMZ-UHFFFAOYSA-N 0 0 351.410 3.805 20 5 FHBDRN CCOc1ncccc1-c1noc(/C=C/c2ccc(F)cc2[N+](=O)[O-])n1 ZINC000515334746 943804079 /nfs/dbraw/zinc/80/40/79/943804079.db2.gz OAKUNZXWVQSFRJ-SOFGYWHQSA-N 0 0 356.313 3.748 20 5 FHBDRN O=C(N[C@H]1C[C@H](c2ccccc2F)C1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000437448562 943807823 /nfs/dbraw/zinc/80/78/23/943807823.db2.gz OJPIBKKHEQOJQM-CTYIDZIISA-N 0 0 369.396 3.984 20 5 FHBDRN C[C@@H](C(=O)N[C@@H](CCO)c1ccc(Cl)cc1)c1cccc([N+](=O)[O-])c1 ZINC000584863737 943810757 /nfs/dbraw/zinc/81/07/57/943810757.db2.gz ZRORMMIIHPSSBW-PXAZEXFGSA-N 0 0 362.813 3.592 20 5 FHBDRN C[C@@H](C(=O)N[C@H](CCO)c1ccc(Cl)cc1)c1cccc([N+](=O)[O-])c1 ZINC000584863739 943810883 /nfs/dbraw/zinc/81/08/83/943810883.db2.gz ZRORMMIIHPSSBW-SJKOYZFVSA-N 0 0 362.813 3.592 20 5 FHBDRN O=C(N[C@H]1C[C@H](c2cccc(F)c2)C1)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000437433942 943811845 /nfs/dbraw/zinc/81/18/45/943811845.db2.gz KKSKYAYROLOBJR-MQMHXKEQSA-N 0 0 353.353 3.891 20 5 FHBDRN COc1ccc(CN[C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)c(OC)n1 ZINC000516896956 943813373 /nfs/dbraw/zinc/81/33/73/943813373.db2.gz USFAEPJNDHCINL-MRXNPFEDSA-N 0 0 357.410 3.519 20 5 FHBDRN CC(C)c1cccnc1NC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000504824632 943828700 /nfs/dbraw/zinc/82/87/00/943828700.db2.gz IUMMSCCFWLKWSC-UHFFFAOYSA-N 0 0 351.366 3.551 20 5 FHBDRN O=C(COc1ccc(Cc2ccccc2)cc1[N+](=O)[O-])[C@H]1CCCOC1 ZINC000184017459 943829095 /nfs/dbraw/zinc/82/90/95/943829095.db2.gz GJXLPAJKCDODBP-KRWDZBQOSA-N 0 0 355.390 3.560 20 5 FHBDRN CC(C)c1cccnc1NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000504824129 943829410 /nfs/dbraw/zinc/82/94/10/943829410.db2.gz GACQSBPGVIVVLP-UHFFFAOYSA-N 0 0 351.366 3.551 20 5 FHBDRN COc1cccc(C(=O)N[C@H]2C[C@H]2c2c(F)cccc2Cl)c1[N+](=O)[O-] ZINC000435878315 943829671 /nfs/dbraw/zinc/82/96/71/943829671.db2.gz ZBLOCZAKCDCZAN-MFKMUULPSA-N 0 0 364.760 3.682 20 5 FHBDRN CCN(CCCNC(=O)Nc1cc([N+](=O)[O-])ccc1C)c1ccccc1 ZINC000515385689 943831618 /nfs/dbraw/zinc/83/16/18/943831618.db2.gz GQPWVVWYHQLXGE-UHFFFAOYSA-N 0 0 356.426 3.941 20 5 FHBDRN Cn1ccnc1[C@H](N[C@H]1C[C@@]1(F)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000424317729 943840131 /nfs/dbraw/zinc/84/01/31/943840131.db2.gz GVNAWPDNVDIKGJ-NLWGTHIKSA-N 0 0 366.396 3.645 20 5 FHBDRN O=C(NCc1c(F)cc(F)c(F)c1F)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000435910217 943847868 /nfs/dbraw/zinc/84/78/68/943847868.db2.gz CWCHUAZODJNBCM-UHFFFAOYSA-N 0 0 367.258 3.563 20 5 FHBDRN C[C@@H](c1noc(-c2ccc(N3CCCC3)c([N+](=O)[O-])c2)n1)c1nccs1 ZINC000424359434 943864225 /nfs/dbraw/zinc/86/42/25/943864225.db2.gz CSKFZMIFPFOCGW-NSHDSACASA-N 0 0 371.422 3.853 20 5 FHBDRN O=C(Nc1nc2ccccc2[nH]1)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000435935891 943869924 /nfs/dbraw/zinc/86/99/24/943869924.db2.gz KVHNNFSCHOOLIV-UHFFFAOYSA-N 0 0 354.369 3.810 20 5 FHBDRN C[C@H](c1cccnc1)N(C)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425417384 943871269 /nfs/dbraw/zinc/87/12/69/943871269.db2.gz HQYYKPLCKHFOBK-LLVKDONJSA-N 0 0 350.216 3.945 20 5 FHBDRN Cc1ccc(SCCNC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)cc1 ZINC000014803692 943875609 /nfs/dbraw/zinc/87/56/09/943875609.db2.gz AYFUIYNHKCBOHL-UHFFFAOYSA-N 0 0 371.462 4.000 20 5 FHBDRN O=C(NC(C1CC1)C1CC1)c1cc(F)cc2c(=O)c3cccc(F)c3[nH]c12 ZINC000435948273 943886550 /nfs/dbraw/zinc/88/65/50/943886550.db2.gz HZZDIIYAJVDGDL-UHFFFAOYSA-N 0 0 368.383 3.878 20 5 FHBDRN COC(=O)c1cc(C)nc(N2CC[C@@H](c3ccc(C)cc3C)C2)c1[N+](=O)[O-] ZINC000516987101 943891906 /nfs/dbraw/zinc/89/19/06/943891906.db2.gz CZECBIXBBRTNBB-OAHLLOKOSA-N 0 0 369.421 3.696 20 5 FHBDRN CSc1ccc(C(=O)N[C@@H]2[C@@H]3CCc4ccccc4[C@@H]32)cc1[N+](=O)[O-] ZINC000435968831 943892928 /nfs/dbraw/zinc/89/29/28/943892928.db2.gz XGMRDTCZQWMNOV-FHLIZLRMSA-N 0 0 354.431 3.775 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N2CCC(Cc3ccc(F)cc3)CC2)c1 ZINC000504921718 943899667 /nfs/dbraw/zinc/89/96/67/943899667.db2.gz YASJDJOCSXAQKQ-UHFFFAOYSA-N 0 0 372.396 3.837 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])NC1(c2ccccc2)CCCCC1 ZINC000505735367 943907373 /nfs/dbraw/zinc/90/73/73/943907373.db2.gz CSWSWLDJUPVRNW-UHFFFAOYSA-N 0 0 353.422 3.983 20 5 FHBDRN Cc1cc(N2CCCCCC2)ccc1NC(=O)c1cc([N+](=O)[O-])c[nH]c1=O ZINC000515473258 943912983 /nfs/dbraw/zinc/91/29/83/943912983.db2.gz XODBFBDKJDWFOD-UHFFFAOYSA-N 0 0 370.409 3.637 20 5 FHBDRN CCC[C@@]1(CO)CCN(c2ccc([N+](=O)[O-])c(OCc3ccccc3)n2)C1 ZINC000515474688 943915466 /nfs/dbraw/zinc/91/54/66/943915466.db2.gz QZVMVAOOCQYIGR-HXUWFJFHSA-N 0 0 371.437 3.558 20 5 FHBDRN COc1cccc(C(=O)N2CCOc3c2cccc3C(C)(C)C)c1[N+](=O)[O-] ZINC000436009058 943924963 /nfs/dbraw/zinc/92/49/63/943924963.db2.gz CLXKLQASFOMBIR-UHFFFAOYSA-N 0 0 370.405 3.940 20 5 FHBDRN Cc1c(NC(=O)c2cnn(CC(C)C)c2C(F)F)cccc1[N+](=O)[O-] ZINC000120275695 943927363 /nfs/dbraw/zinc/92/73/63/943927363.db2.gz WJEMOZITWNTDKJ-UHFFFAOYSA-N 0 0 352.341 3.946 20 5 FHBDRN Cn1c(C(=O)NCc2ccc(Oc3ccccc3)cc2)ccc1[N+](=O)[O-] ZINC000504931659 943927944 /nfs/dbraw/zinc/92/79/44/943927944.db2.gz WDUCKVRBNSXHLW-UHFFFAOYSA-N 0 0 351.362 3.656 20 5 FHBDRN COc1cc(NC(=O)N[C@H](C)c2ccccc2[N+](=O)[O-])c(C)c(OC)c1 ZINC000504950360 943931296 /nfs/dbraw/zinc/93/12/96/943931296.db2.gz RYBCGVAYWRLYHV-GFCCVEGCSA-N 0 0 359.382 3.803 20 5 FHBDRN O=[N+]([O-])c1cc(-c2nc(COc3ccccc3F)no2)ccc1NC1CC1 ZINC000436000337 943931809 /nfs/dbraw/zinc/93/18/09/943931809.db2.gz CJKUVIMXBSPXSA-UHFFFAOYSA-N 0 0 370.340 3.937 20 5 FHBDRN CCOc1ccc(C(=O)NCCCOc2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000504958735 943935295 /nfs/dbraw/zinc/93/52/95/943935295.db2.gz AZAPIIXDJAAXTG-UHFFFAOYSA-N 0 0 358.394 3.501 20 5 FHBDRN CCc1ccc(C(=O)N2CCCC[C@@H]2c2nccn2CC)cc1[N+](=O)[O-] ZINC000436006436 943939390 /nfs/dbraw/zinc/93/93/90/943939390.db2.gz YUCGTZDWJLGZTJ-MRXNPFEDSA-N 0 0 356.426 3.741 20 5 FHBDRN COC1(CNC(=O)CCc2ccc([N+](=O)[O-])cc2Cl)CCCCC1 ZINC001269654260 943941859 /nfs/dbraw/zinc/94/18/59/943941859.db2.gz MJWSQKCMZJAMOX-UHFFFAOYSA-N 0 0 354.834 3.646 20 5 FHBDRN COc1cccc(C(=O)N2CCC[C@H]2/C=C/c2ccccc2)c1[N+](=O)[O-] ZINC000436023403 943942962 /nfs/dbraw/zinc/94/29/62/943942962.db2.gz WEDFMHOCYSSAGO-DBTPVHCXSA-N 0 0 352.390 3.921 20 5 FHBDRN Cc1ccc(CSCCNC(=O)NCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000515512251 943943791 /nfs/dbraw/zinc/94/37/91/943943791.db2.gz KJCJIRLRHDMUCE-UHFFFAOYSA-N 0 0 359.451 3.636 20 5 FHBDRN CC(C)N(Cc1cccc(Cl)c1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000515513706 943946926 /nfs/dbraw/zinc/94/69/26/943946926.db2.gz CBUFDISZRIPSDZ-UHFFFAOYSA-N 0 0 368.842 3.848 20 5 FHBDRN CC1(C)CN(Cc2ccc(Br)cc2[N+](=O)[O-])[C@H]1[C@@H]1CCCO1 ZINC000425449408 943962744 /nfs/dbraw/zinc/96/27/44/943962744.db2.gz STBCGKRSSPYOCE-GJZGRUSLSA-N 0 0 369.259 3.747 20 5 FHBDRN O=C1CCSc2ccc(-c3nc(-c4cccc([N+](=O)[O-])c4)no3)cc2N1 ZINC000505018606 943972175 /nfs/dbraw/zinc/97/21/75/943972175.db2.gz MHFGZGLIHCTHEX-UHFFFAOYSA-N 0 0 368.374 3.746 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2noc(-c3cc(-c4ccc(F)cc4)[nH]n3)n2)c1 ZINC000505020185 943974145 /nfs/dbraw/zinc/97/41/45/943974145.db2.gz ZKXNLFPOKRAKEG-UHFFFAOYSA-N 0 0 351.297 3.841 20 5 FHBDRN C[C@@]1(NC(=O)CCOc2ccccc2[N+](=O)[O-])CCCc2ccccc21 ZINC000506079758 943977490 /nfs/dbraw/zinc/97/74/90/943977490.db2.gz MHEZMCDAZAOJII-HXUWFJFHSA-N 0 0 354.406 3.732 20 5 FHBDRN COC[C@@H](C)Nc1ccccc1NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000437620060 943982154 /nfs/dbraw/zinc/98/21/54/943982154.db2.gz YKPCYWPUFBPULT-LLVKDONJSA-N 0 0 363.801 3.947 20 5 FHBDRN Cc1nc(-c2ccccc2)sc1[C@H](C)NC(=O)c1cc([N+](=O)[O-])c[nH]1 ZINC000053424461 943984701 /nfs/dbraw/zinc/98/47/01/943984701.db2.gz DPRRIIBVFORTGV-JTQLQIEISA-N 0 0 356.407 3.846 20 5 FHBDRN Cc1ncc(CN(C)C(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)s1 ZINC000436065213 943985213 /nfs/dbraw/zinc/98/52/13/943985213.db2.gz OQJNLOAUULICGU-UHFFFAOYSA-N 0 0 363.442 3.718 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2noc(-c3nn(-c4ccccc4)c4c3CCC4)n2)c1 ZINC000505036764 943992382 /nfs/dbraw/zinc/99/23/82/943992382.db2.gz TZHMAESNGGQXRF-UHFFFAOYSA-N 0 0 373.372 3.986 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N[C@@]2(c3ccc(Cl)cc3)C[C@H]2C)c1[N+](=O)[O-] ZINC000505750097 943996290 /nfs/dbraw/zinc/99/62/90/943996290.db2.gz OJROSGLIOFDWBP-QGHHPUGFSA-N 0 0 362.817 3.760 20 5 FHBDRN O=C(NCCNc1ccc([N+](=O)[O-])cc1)c1ncsc1-c1ccccc1 ZINC000437650519 944001136 /nfs/dbraw/zinc/00/11/36/944001136.db2.gz LMKKVZWIMHVZBH-UHFFFAOYSA-N 0 0 368.418 3.560 20 5 FHBDRN CCCOc1cccc(NC(=O)NCCNc2ccc([N+](=O)[O-])cc2)c1 ZINC000505066659 944008870 /nfs/dbraw/zinc/00/88/70/944008870.db2.gz PDUMMINSAFHFCA-UHFFFAOYSA-N 0 0 358.398 3.617 20 5 FHBDRN C[C@@H]1CCc2ccccc2N1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000506095579 944014359 /nfs/dbraw/zinc/01/43/59/944014359.db2.gz NTRBNLAYRSBFPV-CYBMUJFWSA-N 0 0 350.378 3.986 20 5 FHBDRN CN(C)c1ccccc1NC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000436107869 944021999 /nfs/dbraw/zinc/02/19/99/944021999.db2.gz WMFDNJVOTQPEAJ-UHFFFAOYSA-N 0 0 357.413 4.000 20 5 FHBDRN CC(C)[C@H]1CCC[C@H](NC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000505080205 944022651 /nfs/dbraw/zinc/02/26/51/944022651.db2.gz CVONGARHHYPUQE-HOTGVXAUSA-N 0 0 370.453 3.940 20 5 FHBDRN COc1ccc([C@@H](C)N(C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)cc1 ZINC000506101273 944023703 /nfs/dbraw/zinc/02/37/03/944023703.db2.gz CNXYVOKKBPDSII-CYBMUJFWSA-N 0 0 368.393 3.846 20 5 FHBDRN O=[N+]([O-])c1ccc(OCc2cc3c(c(Br)c2)OCO3)cc1 ZINC000515590096 944023671 /nfs/dbraw/zinc/02/36/71/944023671.db2.gz DUTUVRIYRSFIQJ-UHFFFAOYSA-N 0 0 352.140 3.665 20 5 FHBDRN Cc1nc2ccc(NC(=O)NCCNc3ccc([N+](=O)[O-])cc3)cc2s1 ZINC000505090873 944031305 /nfs/dbraw/zinc/03/13/05/944031305.db2.gz MMPXRWGAKQMCME-UHFFFAOYSA-N 0 0 371.422 3.747 20 5 FHBDRN O=C(NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N[C@H]1CCC[C@H](F)C1 ZINC000517133950 944034094 /nfs/dbraw/zinc/03/40/94/944034094.db2.gz IUJALNVVUDBGBD-RYUDHWBXSA-N 0 0 363.311 3.694 20 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CC(C)(C)c1ccc(CNC(=O)CCOc2ccccc2[N+](=O)[O-])cc1 ZINC000515642040 944085865 /nfs/dbraw/zinc/08/58/65/944085865.db2.gz LNKSWSXLHZZCKF-UHFFFAOYSA-N 0 0 356.422 3.978 20 5 FHBDRN CO[C@@]1(C)C[C@@H](N(C)C(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1(C)C ZINC000437756618 944087489 /nfs/dbraw/zinc/08/74/89/944087489.db2.gz VGMQBCWFRZECPQ-CJNGLKHVSA-N 0 0 374.359 3.889 20 5 FHBDRN O=C(NCCc1ccccc1[N+](=O)[O-])N[C@@H]1C[C@H]1c1cccc(Cl)c1 ZINC000437758188 944088649 /nfs/dbraw/zinc/08/86/49/944088649.db2.gz LXPRNDRHBZXVEZ-JKSUJKDBSA-N 0 0 359.813 3.646 20 5 FHBDRN CC1(C)CC[C@H](CNC(=O)c2c([N+](=O)[O-])cccc2C(F)(F)F)OC1 ZINC000893331925 944092116 /nfs/dbraw/zinc/09/21/16/944092116.db2.gz MCSYJDSKQPCTHZ-SNVBAGLBSA-N 0 0 360.332 3.549 20 5 FHBDRN Cc1ccc(C(=O)N2CCO[C@@H](c3ccccc3Cl)C2)cc1[N+](=O)[O-] ZINC000505149196 944094268 /nfs/dbraw/zinc/09/42/68/944094268.db2.gz RAWMRLXYYCDADB-QGZVFWFLSA-N 0 0 360.797 3.770 20 5 FHBDRN O=C([O-])[C@H](CC[N@H+](Cc1ccccc1[N+](=O)[O-])C1CC1)c1ccccc1 ZINC000515660293 944104050 /nfs/dbraw/zinc/10/40/50/944104050.db2.gz VDDYHBPLRQSLRQ-GOSISDBHSA-N 0 0 354.406 3.818 20 5 FHBDRN C[C@@H](NC(=O)c1cc(F)cc([N+](=O)[O-])c1)c1ccc(-n2cccn2)c(F)c1 ZINC000505171341 944104694 /nfs/dbraw/zinc/10/46/94/944104694.db2.gz OKCKSJHNAYYKQO-LLVKDONJSA-N 0 0 372.331 3.550 20 5 FHBDRN CCc1nocc1CN(C)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425488492 944105115 /nfs/dbraw/zinc/10/51/15/944105115.db2.gz XDCDECAEHBDXEL-UHFFFAOYSA-N 0 0 354.204 3.540 20 5 FHBDRN O=[N+]([O-])c1cn(CC[S@@](=O)c2cc(Cl)ccc2Cl)nc1C1CC1 ZINC000436199472 944109586 /nfs/dbraw/zinc/10/95/86/944109586.db2.gz RZPFTMRBYGCDGL-HSZRJFAPSA-N 0 0 374.249 3.783 20 5 FHBDRN COc1cccc(C)c1NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000436224537 944115045 /nfs/dbraw/zinc/11/50/45/944115045.db2.gz CIKLHVFHDDQXJC-UHFFFAOYSA-N 0 0 352.293 3.766 20 5 FHBDRN COc1ccc(C)cc1NC(=O)[C@H]1CCCN1c1ccc([N+](=O)[O-])c(C)c1 ZINC000092655639 944119003 /nfs/dbraw/zinc/11/90/03/944119003.db2.gz QNEVKHIPJVYPCF-GOSISDBHSA-N 0 0 369.421 3.828 20 5 FHBDRN Cc1ccncc1CN(C)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425491002 944123623 /nfs/dbraw/zinc/12/36/23/944123623.db2.gz ZWKWYZDQVVANQF-UHFFFAOYSA-N 0 0 350.216 3.693 20 5 FHBDRN CC[C@H](N[C@H]1CCc2c1cccc2[N+](=O)[O-])c1nnc2n1CCCCC2 ZINC000517245744 944138284 /nfs/dbraw/zinc/13/82/84/944138284.db2.gz AJHVUWNNHZYEBY-HOTGVXAUSA-N 0 0 355.442 3.641 20 5 FHBDRN COc1ccccc1[C@@H]1CCN(c2ccc([N+](=O)[O-])c(OC(C)C)n2)C1 ZINC000517246498 944140044 /nfs/dbraw/zinc/14/00/44/944140044.db2.gz XVCIEGXUQDKJBF-CQSZACIVSA-N 0 0 357.410 3.780 20 5 FHBDRN Cc1ccc(C[C@@H]2CCCN2S(=O)(=O)c2c(C)cccc2[N+](=O)[O-])cc1 ZINC000500138574 944158837 /nfs/dbraw/zinc/15/88/37/944158837.db2.gz BXXCMHKQTKJRFE-KRWDZBQOSA-N 0 0 374.462 3.607 20 5 FHBDRN O=C(NC[C@H]1CCCCC(F)(F)C1)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000517271679 944159011 /nfs/dbraw/zinc/15/90/11/944159011.db2.gz LABJZTFVYYJEBB-ZDUSSCGKSA-N 0 0 367.396 3.878 20 5 FHBDRN Cc1ccccc1C[C@H](C)N(C)C(=O)NCCOc1ccc([N+](=O)[O-])cc1 ZINC000517274890 944161895 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COCCOc1ccccc1CNc1cc(C(F)(F)F)ncc1[N+](=O)[O-] ZINC000436315730 944193893 /nfs/dbraw/zinc/19/38/93/944193893.db2.gz UXNVGYKDTSNQCT-UHFFFAOYSA-N 0 0 371.315 3.646 20 5 FHBDRN C[C@@]1(Cc2ccccc2)CCCN1C(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000469304701 944200118 /nfs/dbraw/zinc/20/01/18/944200118.db2.gz UEDMUWCTLKRSON-FQEVSTJZSA-N 0 0 354.406 3.597 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCCc1ccc(O)cc1 ZINC000505793045 944200847 /nfs/dbraw/zinc/20/08/47/944200847.db2.gz PHNMMROQZXEZHM-UHFFFAOYSA-N 0 0 360.435 3.775 20 5 FHBDRN CCn1cc(-c2ccc(OC(=O)c3cc(F)cc(C)c3[N+](=O)[O-])cc2)nn1 ZINC000759782709 944210139 /nfs/dbraw/zinc/21/01/39/944210139.db2.gz CJEWDFJREWYTKY-UHFFFAOYSA-N 0 0 370.340 3.540 20 5 FHBDRN CCOc1cccc([C@@H](C)NC(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)c1 ZINC000123161557 944217768 /nfs/dbraw/zinc/21/77/68/944217768.db2.gz PADISSJBBWHPSX-CQSZACIVSA-N 0 0 369.421 3.822 20 5 FHBDRN Cc1ccccc1CCNC(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC000550131167 944236773 /nfs/dbraw/zinc/23/67/73/944236773.db2.gz YUAYJDUEEVRGET-UHFFFAOYSA-N 0 0 361.401 3.938 20 5 FHBDRN COc1cccc(C(C)=CC(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)c1 ZINC000759789248 944239454 /nfs/dbraw/zinc/23/94/54/944239454.db2.gz STOCRYNUICXOJF-FLIBITNWSA-N 0 0 352.350 3.522 20 5 FHBDRN Cc1ccccc1[C@@H](CC(F)(F)F)NC(=O)c1ccc([N+](=O)[O-])cn1 ZINC000518295958 944241814 /nfs/dbraw/zinc/24/18/14/944241814.db2.gz IZOPCDLIPDDNCD-CQSZACIVSA-N 0 0 353.300 3.722 20 5 FHBDRN CC[C@@H]1C[C@@H](C)CN1C(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000426253319 944241990 /nfs/dbraw/zinc/24/19/90/944241990.db2.gz AFXQNSWADAGOLN-ZWNOBZJWSA-N 0 0 359.348 3.944 20 5 FHBDRN COC(=O)c1ccc(Oc2cc(C(F)(F)F)ncc2[N+](=O)[O-])cc1OC ZINC000436373427 944243260 /nfs/dbraw/zinc/24/32/60/944243260.db2.gz WGHFGYUYIQORDS-UHFFFAOYSA-N 0 0 372.255 3.596 20 5 FHBDRN COc1ccc(CNC(=O)N2CCC[C@H]2c2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000515831369 944249789 /nfs/dbraw/zinc/24/97/89/944249789.db2.gz NRIUPLHFEMCAOW-KRWDZBQOSA-N 0 0 369.421 3.959 20 5 FHBDRN COc1ccc(CNC(=O)N2CCC[C@@H]2c2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000515831371 944250218 /nfs/dbraw/zinc/25/02/18/944250218.db2.gz NRIUPLHFEMCAOW-QGZVFWFLSA-N 0 0 369.421 3.959 20 5 FHBDRN COCCCOc1cc(C)ccc1CNc1c2c(ccc1[N+](=O)[O-])NCC2 ZINC000436381534 944250684 /nfs/dbraw/zinc/25/06/84/944250684.db2.gz AKBHUYCLMBHDCQ-UHFFFAOYSA-N 0 0 371.437 3.899 20 5 FHBDRN CC[C@H](C)[C@H]([NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1)C(=O)[O-] ZINC000426662179 944251843 /nfs/dbraw/zinc/25/18/43/944251843.db2.gz WMFYUIYOKCDCBS-LIRRHRJNSA-N 0 0 371.437 3.952 20 5 FHBDRN O=C(Nc1ccc(-n2ccnc2)c(F)c1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000518292794 944254583 /nfs/dbraw/zinc/25/45/83/944254583.db2.gz QITQQRUXEPWXLZ-UHFFFAOYSA-N 0 0 360.732 3.825 20 5 FHBDRN CC[C@@H](C)[C@@H](C(=O)NCCOc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000518309534 944271562 /nfs/dbraw/zinc/27/15/62/944271562.db2.gz RGAOLDXIWQFWBV-DNVCBOLYSA-N 0 0 356.422 3.920 20 5 FHBDRN COc1cccc(O[C@H](C)CNc2cc(C(F)(F)F)ncc2[N+](=O)[O-])c1 ZINC000436397437 944273520 /nfs/dbraw/zinc/27/35/20/944273520.db2.gz NJDZGYYFYNJZGA-SNVBAGLBSA-N 0 0 371.315 3.897 20 5 FHBDRN Cc1cscc1CNC(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000426263499 944278771 /nfs/dbraw/zinc/27/87/71/944278771.db2.gz MXLSZBFRMXZGHI-UHFFFAOYSA-N 0 0 373.356 3.983 20 5 FHBDRN Cc1ccc([C@H](NC(=O)NCCOc2ccc([N+](=O)[O-])cc2)C2CC2)cc1 ZINC000518332666 944281216 /nfs/dbraw/zinc/28/12/16/944281216.db2.gz AMXIYUWCNJHDMU-IBGZPJMESA-N 0 0 369.421 3.733 20 5 FHBDRN C[C@H]1Cc2ccc(Br)cc2CN1C(=O)c1ccc([N+](=O)[O-])o1 ZINC000500221306 944281342 /nfs/dbraw/zinc/28/13/42/944281342.db2.gz KSZKUTRBKIYYKJ-VIFPVBQESA-N 0 0 365.183 3.537 20 5 FHBDRN O=C(N[C@H]1CCc2ccccc2C1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000438015113 944285597 /nfs/dbraw/zinc/28/55/97/944285597.db2.gz DYNPKOUMAVQLLN-SFHVURJKSA-N 0 0 365.433 3.826 20 5 FHBDRN COc1cccc(C2=CCN(c3cc(C(F)(F)F)ncc3[N+](=O)[O-])C2)c1 ZINC000436413173 944285751 /nfs/dbraw/zinc/28/57/51/944285751.db2.gz HRMPLQPZKPPWAG-UHFFFAOYSA-N 0 0 365.311 3.921 20 5 FHBDRN CCn1c(C)nc([N+](=O)[O-])c1N1C[C@H](c2ccccc2Cl)OC[C@@H]1C ZINC000517424493 944286757 /nfs/dbraw/zinc/28/67/57/944286757.db2.gz HUKXLTPOBVKKLA-XHDPSFHLSA-N 0 0 364.833 3.739 20 5 FHBDRN COc1cc(CN2CC=C(c3ccc(O)cc3)CC2)c([N+](=O)[O-])cc1F ZINC000184230101 944288071 /nfs/dbraw/zinc/28/80/71/944288071.db2.gz UXXOZNJJRJMFOQ-UHFFFAOYSA-N 0 0 358.369 3.737 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)F)cc1NCc1ccccc1-n1ccnc1 ZINC000436417945 944292878 /nfs/dbraw/zinc/29/28/78/944292878.db2.gz GSCSVPYBLHHPAP-UHFFFAOYSA-N 0 0 363.299 3.806 20 5 FHBDRN CCCN(CC(F)F)C(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000426266181 944294970 /nfs/dbraw/zinc/29/49/70/944294970.db2.gz JZQJLISXKSZGBQ-UHFFFAOYSA-N 0 0 369.290 3.800 20 5 FHBDRN C[C@@]1(CNC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)CCCS1 ZINC000467344666 944296703 /nfs/dbraw/zinc/29/67/03/944296703.db2.gz CNDBRJJKPJHSHF-INIZCTEOSA-N 0 0 363.464 3.734 20 5 FHBDRN Cc1ccc(NC(=O)c2ccc(NCc3cccnn3)c([N+](=O)[O-])c2)cc1 ZINC000436430307 944300812 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FHBDRN CC(=O)c1c(C)[nH]c(C(=O)N2CCc3ccc([N+](=O)[O-])cc32)c1C(C)C ZINC000123266016 944322067 /nfs/dbraw/zinc/32/20/67/944322067.db2.gz DFNQYWHXYIJLDK-UHFFFAOYSA-N 0 0 355.394 3.760 20 5 FHBDRN C[C@H](SCc1ccc(C(N)=O)cc1[N+](=O)[O-])c1ccc(F)cc1F ZINC000105633712 944322387 /nfs/dbraw/zinc/32/23/87/944322387.db2.gz JHLAPIVDJSFPIR-VIFPVBQESA-N 0 0 352.362 3.966 20 5 FHBDRN O=[N+]([O-])c1ccc(N[C@@H]2CCc3nnc(-c4ccc(F)cc4)n3C2)c(F)c1 ZINC000505829604 944328162 /nfs/dbraw/zinc/32/81/62/944328162.db2.gz BUJHYGRBBSUSNY-CYBMUJFWSA-N 0 0 371.347 3.558 20 5 FHBDRN CN(C(=O)CN1CCC[C@@H]1/C=C\c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000505825149 944330809 /nfs/dbraw/zinc/33/08/09/944330809.db2.gz KGFKFIKRCDUBNY-ZBTAVZRMSA-N 0 0 365.433 3.735 20 5 FHBDRN COCC1(CCNC(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)CC1 ZINC000518379289 944330822 /nfs/dbraw/zinc/33/08/22/944330822.db2.gz HLDVXGPEWMMRMY-UHFFFAOYSA-N 0 0 369.421 3.885 20 5 FHBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)NCc1cccc(O)c1 ZINC000137369241 944331824 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Cc1nn(CCCC(=O)c2ccc(Br)cc2)cc1[N+](=O)[O-] ZINC000436474459 944354231 /nfs/dbraw/zinc/35/42/31/944354231.db2.gz OZOPIOZOTVUHGW-UHFFFAOYSA-N 0 0 352.188 3.525 20 5 FHBDRN O=C(/C=C/c1ccc([N+](=O)[O-])cc1)N1CCC(OC2CCCCC2)CC1 ZINC000123412646 944359080 /nfs/dbraw/zinc/35/90/80/944359080.db2.gz MTNKPKLBDQNSBH-DHZHZOJOSA-N 0 0 358.438 3.948 20 5 FHBDRN CN(CCOCc1ccccc1)C(=O)C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000518410443 944359190 /nfs/dbraw/zinc/35/91/90/944359190.db2.gz QRHKJGKXLXPFQQ-UHFFFAOYSA-N 0 0 356.422 3.548 20 5 FHBDRN CO[C@]1(C)C[C@H](N(C)C(=O)c2cc(SC)ccc2[N+](=O)[O-])C1(C)C ZINC000437770764 944359598 /nfs/dbraw/zinc/35/95/98/944359598.db2.gz GJMIODSCHFWSBY-WMLDXEAASA-N 0 0 352.456 3.592 20 5 FHBDRN C[C@H](c1cccc([N+](=O)[O-])c1)S(=O)(=O)Cc1cccc(OC(F)F)c1 ZINC000105715137 944359860 /nfs/dbraw/zinc/35/98/60/944359860.db2.gz UZZAUCFNAOHCSO-LLVKDONJSA-N 0 0 371.361 3.872 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CCc2c(F)ccc(F)c2C1 ZINC000438135469 944360191 /nfs/dbraw/zinc/36/01/91/944360191.db2.gz KAZJNRBNYFSQHK-UHFFFAOYSA-N 0 0 352.724 3.725 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CS(=O)(=O)[C@@H](C)c1ccc(Cl)cc1 ZINC000105723976 944362083 /nfs/dbraw/zinc/36/20/83/944362083.db2.gz NOAQYDZPWCOQTD-NSHDSACASA-N 0 0 369.826 3.933 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)N[C@@H]1CCO[C@H]1c1ccc(F)c(F)c1 ZINC000123458370 944363593 /nfs/dbraw/zinc/36/35/93/944363593.db2.gz QPYAATXKEVAKOV-CVEARBPZSA-N 0 0 363.320 3.525 20 5 FHBDRN CC(C)(NC(=O)c1cnc(-c2ccccc2)nc1)c1ccccc1[N+](=O)[O-] ZINC000518416708 944363649 /nfs/dbraw/zinc/36/36/49/944363649.db2.gz GWXWSFALBWRWKM-UHFFFAOYSA-N 0 0 362.389 3.717 20 5 FHBDRN C[C@]1(CNC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)CCOC2(CCC2)C1 ZINC000894655042 944365324 /nfs/dbraw/zinc/36/53/24/944365324.db2.gz JURNOTZURNVHLC-SCTDSRPQSA-N 0 0 358.438 3.554 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)[C@@H](NC(=O)c1ccccc1)C(C)C ZINC000086624564 944367820 /nfs/dbraw/zinc/36/78/20/944367820.db2.gz BEGXVRNNZCHBDJ-KRWDZBQOSA-N 0 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ZINC000086625359 944381429 /nfs/dbraw/zinc/38/14/29/944381429.db2.gz RUZIBHAFJKJKME-UHFFFAOYSA-N 0 0 353.378 3.812 20 5 FHBDRN C[C@H](NC(=O)[C@@H](c1cccc(Cl)c1)N(C)C)c1cccc([N+](=O)[O-])c1 ZINC000518443809 944381436 /nfs/dbraw/zinc/38/14/36/944381436.db2.gz SDVIFEVQONEKIO-YVEFUNNKSA-N 0 0 361.829 3.728 20 5 FHBDRN C[C@]1(CNC(=O)c2ccc([N+](=O)[O-])c3cccnc23)CCOC2(CCC2)C1 ZINC000894660870 944383491 /nfs/dbraw/zinc/38/34/91/944383491.db2.gz UKHLSAWSAGPCJO-IBGZPJMESA-N 0 0 369.421 3.612 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(NCc2cc(C)cc3c(C)c(C)[nH]c32)n1 ZINC000439162927 944386007 /nfs/dbraw/zinc/38/60/07/944386007.db2.gz QGHKEOFZHGLIRF-UHFFFAOYSA-N 0 0 368.393 3.795 20 5 FHBDRN COc1ccccc1[C@@H](C)N(C)C(=O)COc1ccc(C)cc1[N+](=O)[O-] ZINC000053571679 944386443 /nfs/dbraw/zinc/38/64/43/944386443.db2.gz GIWCENSPOCLOAZ-CQSZACIVSA-N 0 0 358.394 3.510 20 5 FHBDRN CCOCCOc1ccccc1C(=O)Nc1c(C)ccc([N+](=O)[O-])c1C ZINC000086624637 944388480 /nfs/dbraw/zinc/38/84/80/944388480.db2.gz GEHUNXJSLATBHT-UHFFFAOYSA-N 0 0 358.394 3.879 20 5 FHBDRN O=C(c1cc(F)cc([N+](=O)[O-])c1)N(Cc1cccs1)C[C@@H]1CCCO1 ZINC000517558750 944390169 /nfs/dbraw/zinc/39/01/69/944390169.db2.gz KRVNZQRGFPZPKE-HNNXBMFYSA-N 0 0 364.398 3.617 20 5 FHBDRN Nc1cccc([N+](=O)[O-])c1C(=O)NCCCOc1ccc2ccccc2c1 ZINC000500279818 944396583 /nfs/dbraw/zinc/39/65/83/944396583.db2.gz SFXYPDPHFNOLCW-UHFFFAOYSA-N 0 0 365.389 3.529 20 5 FHBDRN CCc1ccc(C(=O)NC[C@@H]2CCO[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000190255594 944398276 /nfs/dbraw/zinc/39/82/76/944398276.db2.gz CNDZJAGVCLIFQK-HKUYNNGSSA-N 0 0 354.406 3.665 20 5 FHBDRN COc1ccc(NC(=O)Cc2coc(-c3cccs3)n2)c([N+](=O)[O-])c1 ZINC000105942825 944398562 /nfs/dbraw/zinc/39/85/62/944398562.db2.gz ADCQNSOZQRBEPQ-UHFFFAOYSA-N 0 0 359.363 3.501 20 5 FHBDRN COCCc1ccc(OCCCC(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 ZINC000105942865 944399021 /nfs/dbraw/zinc/39/90/21/944399021.db2.gz AKVVUGLKMKGJLF-UHFFFAOYSA-N 0 0 372.421 3.890 20 5 FHBDRN O=C(CNc1ccc([N+](=O)[O-])c2cnccc12)Nc1ccc(Cl)cc1 ZINC000053578465 944400477 /nfs/dbraw/zinc/40/04/77/944400477.db2.gz GVGXCOHTLQDKQL-UHFFFAOYSA-N 0 0 356.769 3.847 20 5 FHBDRN Cc1ccc(S(=O)(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)cc1Cl ZINC000473772034 944407276 /nfs/dbraw/zinc/40/72/76/944407276.db2.gz HYVPGNSFGHRRPH-UHFFFAOYSA-N 0 0 354.815 3.974 20 5 FHBDRN O=C(N[C@@H]1CCC[C@@H]1c1ccccc1)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000518454901 944407754 /nfs/dbraw/zinc/40/77/54/944407754.db2.gz ARZBVSIKCASTOC-GDBMZVCRSA-N 0 0 350.378 3.537 20 5 FHBDRN Cc1cc(NC(=O)Nc2cnn(Cc3ccccc3)c2)ccc1[N+](=O)[O-] ZINC000473772856 944410502 /nfs/dbraw/zinc/41/05/02/944410502.db2.gz MJEDBBRKNCLLOV-UHFFFAOYSA-N 0 0 351.366 3.792 20 5 FHBDRN CCOc1c(Cl)cccc1CN1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000425958572 944410819 /nfs/dbraw/zinc/41/08/19/944410819.db2.gz OCTUHIICDVJJKL-UHFFFAOYSA-N 0 0 364.833 3.681 20 5 FHBDRN Cc1cc(NC(=O)NCCc2ccc(F)c(F)c2F)ccc1[N+](=O)[O-] ZINC000473774177 944413129 /nfs/dbraw/zinc/41/31/29/944413129.db2.gz GUYLUKYWYAJXML-UHFFFAOYSA-N 0 0 353.300 3.685 20 5 FHBDRN Cc1cccc(CN(C)C(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])n1 ZINC000426303347 944417127 /nfs/dbraw/zinc/41/71/27/944417127.db2.gz MMSMRJPUMXTJQO-UHFFFAOYSA-N 0 0 353.300 3.589 20 5 FHBDRN CC[C@H](CC(F)(F)F)NC(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000467216926 944420246 /nfs/dbraw/zinc/42/02/46/944420246.db2.gz YYXXTTSGNTYIBT-SECBINFHSA-N 0 0 353.728 3.778 20 5 FHBDRN CO[C@@H]1Cc2ccccc2N(C(=O)c2cc(SC)ccc2[N+](=O)[O-])C1 ZINC000500289096 944423536 /nfs/dbraw/zinc/42/35/36/944423536.db2.gz PJVJWCDWVGPWES-CYBMUJFWSA-N 0 0 358.419 3.535 20 5 FHBDRN O=C(CSc1ccccc1Cl)NCCOc1ccc([N+](=O)[O-])cc1 ZINC000517591621 944423860 /nfs/dbraw/zinc/42/38/60/944423860.db2.gz YVVHSNUSXQOOOO-UHFFFAOYSA-N 0 0 366.826 3.536 20 5 FHBDRN CC(=O)Nc1cc(Cl)ccc1NC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc21 ZINC000106025484 944425863 /nfs/dbraw/zinc/42/58/63/944425863.db2.gz UDUNIQNLSBXLLU-UHFFFAOYSA-N 0 0 372.768 3.940 20 5 FHBDRN COc1ccc(CNC(=O)Nc2cccc(CSC)c2)cc1[N+](=O)[O-] ZINC000517611919 944429098 /nfs/dbraw/zinc/42/90/98/944429098.db2.gz GNFGECIORSLSMQ-UHFFFAOYSA-N 0 0 361.423 3.788 20 5 FHBDRN CCSc1nnc(NC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)s1 ZINC000439204307 944432116 /nfs/dbraw/zinc/43/21/16/944432116.db2.gz JEJIMTNHOUSONE-UHFFFAOYSA-N 0 0 352.441 3.934 20 5 FHBDRN Cc1ccc(OC(=O)CCC(=O)c2ccc3c(c2)CCC3)cc1[N+](=O)[O-] ZINC000783416260 944435371 /nfs/dbraw/zinc/43/53/71/944435371.db2.gz ZOVFLBMAQANUAF-UHFFFAOYSA-N 0 0 353.374 3.960 20 5 FHBDRN Cc1cn(CC(=O)Nc2cccc(Oc3ccccc3)c2)nc1[N+](=O)[O-] ZINC000439210256 944438814 /nfs/dbraw/zinc/43/88/14/944438814.db2.gz OFTMRVBEVRZZDE-UHFFFAOYSA-N 0 0 352.350 3.531 20 5 FHBDRN COc1ccc(CNc2ncccn2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000438258356 944441099 /nfs/dbraw/zinc/44/10/99/944441099.db2.gz YMZXXNHBUHZZHR-UHFFFAOYSA-N 0 0 366.377 3.585 20 5 FHBDRN Cc1cc(NC(=O)N[C@@H](C)c2ccccc2-n2cccn2)ccc1[N+](=O)[O-] ZINC000473780826 944446857 /nfs/dbraw/zinc/44/68/57/944446857.db2.gz LBWVJKVHDICRGF-AWEZNQCLSA-N 0 0 365.393 3.972 20 5 FHBDRN CSC[C@H]1CCCN(Cc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000312695646 944449288 /nfs/dbraw/zinc/44/92/88/944449288.db2.gz NCNYFWHGPCPTHK-LBPRGKRZSA-N 0 0 359.289 3.932 20 5 FHBDRN COc1cc(OCC(=O)N2CCC(C)(C)c3ccccc32)ccc1[N+](=O)[O-] ZINC000516038563 944449662 /nfs/dbraw/zinc/44/96/62/944449662.db2.gz RGTUOCHXEVTFHV-UHFFFAOYSA-N 0 0 370.405 3.697 20 5 FHBDRN Cc1nc(C(=O)OCC(=O)c2ccc([N+](=O)[O-])cc2)c(-c2ccccc2)o1 ZINC000759825907 944453915 /nfs/dbraw/zinc/45/39/15/944453915.db2.gz GOSYJVYJRSCMMB-UHFFFAOYSA-N 0 0 366.329 3.598 20 5 FHBDRN O=[N+]([O-])c1ccc(S(=O)(=O)Oc2ccccc2F)c(C(F)(F)F)c1 ZINC000162670038 944454687 /nfs/dbraw/zinc/45/46/87/944454687.db2.gz XHSAAJKDSVJXRH-UHFFFAOYSA-N 0 0 365.260 3.520 20 5 FHBDRN COC(=O)c1ccc(OCC[C@@H](C)OCc2ccccc2)c([N+](=O)[O-])c1 ZINC000473784093 944456803 /nfs/dbraw/zinc/45/68/03/944456803.db2.gz UYAVTTJXWNTGBT-CQSZACIVSA-N 0 0 359.378 3.756 20 5 FHBDRN O=C(c1cc(Cl)cc(Cl)c1[N+](=O)[O-])N1CC[C@@H]([C@H]2CCCO2)C1 ZINC000894703814 944457771 /nfs/dbraw/zinc/45/77/71/944457771.db2.gz HGNKITZZPFVTSU-NOZJJQNGSA-N 0 0 359.209 3.543 20 5 FHBDRN Cc1cc(NC(=O)NCc2ncoc2-c2ccccc2)ccc1[N+](=O)[O-] ZINC000473783561 944457787 /nfs/dbraw/zinc/45/77/87/944457787.db2.gz SNMRILFWPVLXNA-UHFFFAOYSA-N 0 0 352.350 3.880 20 5 FHBDRN O=C(Nc1nnc(CC2CCCCC2)s1)c1cc([O-])cc([N+](=O)[O-])c1 ZINC000506198898 944459176 /nfs/dbraw/zinc/45/91/76/944459176.db2.gz LKLTXZMHCKJQOH-UHFFFAOYSA-N 0 0 362.411 3.527 20 5 FHBDRN COc1cc(C)c([C@@H](C)NC(=O)c2cc(F)cc([N+](=O)[O-])c2)cc1OC ZINC000517638186 944459423 /nfs/dbraw/zinc/45/94/23/944459423.db2.gz IFRPPYATHNUFLT-LLVKDONJSA-N 0 0 362.357 3.551 20 5 FHBDRN CCN(C(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])c1cccnc1C ZINC000439233256 944460055 /nfs/dbraw/zinc/46/00/55/944460055.db2.gz GSVYIQAXVFMLHJ-LBPRGKRZSA-N 0 0 363.801 3.772 20 5 FHBDRN CC(C)(NC(=O)Cc1cccc(OC(F)F)c1)c1ccccc1[N+](=O)[O-] ZINC000516078973 944470453 /nfs/dbraw/zinc/47/04/53/944470453.db2.gz IKMDLEADJXPMCU-UHFFFAOYSA-N 0 0 364.348 3.790 20 5 FHBDRN Cc1cc(NC(=O)N2CCC(Cc3cccnc3)CC2)ccc1[N+](=O)[O-] ZINC000473790838 944473881 /nfs/dbraw/zinc/47/38/81/944473881.db2.gz VYVYRHFVHYANOZ-UHFFFAOYSA-N 0 0 354.410 3.785 20 5 FHBDRN COc1cc(C(=O)N2CCCc3ccc(C)cc32)c([N+](=O)[O-])cc1OC ZINC000110393649 944478136 /nfs/dbraw/zinc/47/81/36/944478136.db2.gz REDZKSAPJWGKNT-UHFFFAOYSA-N 0 0 356.378 3.513 20 5 FHBDRN O=C(c1cc2cc(F)ccc2s1)N1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1 ZINC000364366611 944478276 /nfs/dbraw/zinc/47/82/76/944478276.db2.gz VJZOZBAPUQEYEF-CYBMUJFWSA-N 0 0 374.397 3.622 20 5 FHBDRN O=C(c1ccnc(-c2ccccc2)c1[N+](=O)[O-])N(CC(F)(F)F)C1CC1 ZINC000439260813 944478866 /nfs/dbraw/zinc/47/88/66/944478866.db2.gz QBJVAEMDYCPIDO-UHFFFAOYSA-N 0 0 365.311 3.824 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N1CCN(C2CC2)c2ccccc21 ZINC000426333914 944482208 /nfs/dbraw/zinc/48/22/08/944482208.db2.gz KJSYYWBFPVZQCQ-UHFFFAOYSA-N 0 0 371.824 3.806 20 5 FHBDRN Cc1cc(NC(=O)NCCCOCCc2ccccc2)ccc1[N+](=O)[O-] ZINC000473787629 944485236 /nfs/dbraw/zinc/48/52/36/944485236.db2.gz NQJFEOLHJHYBFS-UHFFFAOYSA-N 0 0 357.410 3.674 20 5 FHBDRN COc1cc(C)c(CN(C)C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)cc1OC ZINC000025762484 944485470 /nfs/dbraw/zinc/48/54/70/944485470.db2.gz SYHYXVJHTSZOMU-JXMROGBWSA-N 0 0 370.405 3.592 20 5 FHBDRN C[C@@H](Cc1ccccc1F)NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000054166797 944485768 /nfs/dbraw/zinc/48/57/68/944485768.db2.gz WGMPHQCCEFIFHT-AWEZNQCLSA-N 0 0 371.412 3.695 20 5 FHBDRN O=[N+]([O-])c1cc2cnn(Cc3ccn(-c4ccccc4F)n3)c2c(Cl)c1 ZINC000438301853 944486855 /nfs/dbraw/zinc/48/68/55/944486855.db2.gz GWPFZELBWOUYRB-UHFFFAOYSA-N 0 0 371.759 3.971 20 5 FHBDRN CCC[C@@H](NC(=O)CN(C)CCc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000516094319 944492793 /nfs/dbraw/zinc/49/27/93/944492793.db2.gz XWWKECWNCPJUJN-HXUWFJFHSA-N 0 0 369.465 3.727 20 5 FHBDRN COc1cc(Cc2noc(-c3ccc(C)cc3C)n2)c([N+](=O)[O-])c(OC)c1 ZINC000517673495 944496860 /nfs/dbraw/zinc/49/68/60/944496860.db2.gz UVEJXIGAEWOCIN-UHFFFAOYSA-N 0 0 369.377 3.870 20 5 FHBDRN CCOc1cc(C(=O)NC[C@H]2C[C@@H]2c2ccccc2)c([N+](=O)[O-])cc1OC ZINC000110451946 944501870 /nfs/dbraw/zinc/50/18/70/944501870.db2.gz GCOLRIIFMYPSBE-HUUCEWRRSA-N 0 0 370.405 3.536 20 5 FHBDRN CCOc1ccc(C(=O)N(C)[C@H](C)c2sc(C)nc2C)cc1[N+](=O)[O-] ZINC000518562871 944504581 /nfs/dbraw/zinc/50/45/81/944504581.db2.gz NNSDTQRXIOGUHO-LLVKDONJSA-N 0 0 363.439 3.900 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H](C)c1cc(F)ccc1OC ZINC000046985740 944506265 /nfs/dbraw/zinc/50/62/65/944506265.db2.gz KDWWLTRTKGKFNN-JTQLQIEISA-N 0 0 363.345 3.634 20 5 FHBDRN O=C(NCCOC1CCCCC1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000425981122 944509365 /nfs/dbraw/zinc/50/93/65/944509365.db2.gz PWZBEUXLVDYCNK-UHFFFAOYSA-N 0 0 361.442 3.618 20 5 FHBDRN CC(C)(CNC(=O)c1ccc([N+](=O)[O-])o1)c1ccc(Br)cc1 ZINC000047021845 944512909 /nfs/dbraw/zinc/51/29/09/944512909.db2.gz QLVGNCUBIOYPDK-UHFFFAOYSA-N 0 0 367.199 3.658 20 5 FHBDRN CCc1cccc(C)c1NC(=O)c1nnn(-c2cccc([N+](=O)[O-])c2)c1C ZINC000073562805 944520229 /nfs/dbraw/zinc/52/02/29/944520229.db2.gz WWJWJUYCZIOFEQ-UHFFFAOYSA-N 0 0 365.393 3.607 20 5 FHBDRN Cn1c2ccccc2c(N[C@H](c2ccccn2)C2CCC2)c([N+](=O)[O-])c1=O ZINC000894726085 944528845 /nfs/dbraw/zinc/52/88/45/944528845.db2.gz OVVQMEMWNYOVJV-KRWDZBQOSA-N 0 0 364.405 3.795 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)c1cc(F)cc2ccncc21 ZINC001270116042 944528878 /nfs/dbraw/zinc/52/88/78/944528878.db2.gz QDSJKJLILZPAAI-UHFFFAOYSA-N 0 0 353.353 3.597 20 5 FHBDRN C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(-c2nnc(C)o2)c1 ZINC000184293647 944530009 /nfs/dbraw/zinc/53/00/09/944530009.db2.gz HYETWGLVMNKMRH-ZRDIBKRKSA-N 0 0 364.361 3.995 20 5 FHBDRN C[C@H](C(=O)N1C[C@@H]2CCC[C@]2(C(F)(F)F)C1)c1cccc([N+](=O)[O-])c1 ZINC000894380101 944534741 /nfs/dbraw/zinc/53/47/41/944534741.db2.gz NMBQDHKSMGIMNE-RBOXIYTFSA-N 0 0 356.344 3.889 20 5 FHBDRN COc1cc(C(=O)Nc2ccccc2OC(F)(F)F)ccc1[N+](=O)[O-] ZINC000133904914 944541848 /nfs/dbraw/zinc/54/18/48/944541848.db2.gz RETWJZZDMFWZBN-UHFFFAOYSA-N 0 0 356.256 3.754 20 5 FHBDRN Cc1c(F)ccc([N+](=O)[O-])c1C(=O)N1CCC(C(=O)c2ccccc2)CC1 ZINC000843759714 944551346 /nfs/dbraw/zinc/55/13/46/944551346.db2.gz VDKCRVQGLPOCRN-UHFFFAOYSA-N 0 0 370.380 3.777 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N[C@@H]1CCc2sc(Cl)cc21 ZINC000518621024 944552081 /nfs/dbraw/zinc/55/20/81/944552081.db2.gz YAMWEUYYFLVTJJ-LLVKDONJSA-N 0 0 372.855 3.584 20 5 FHBDRN Cc1sc(S(=O)(=O)N(c2ccc(F)cc2)C(C)C)cc1[N+](=O)[O-] ZINC000123925789 944553005 /nfs/dbraw/zinc/55/30/05/944553005.db2.gz IPJAJKSQUDMNQH-UHFFFAOYSA-N 0 0 358.416 3.708 20 5 FHBDRN C[C@H](NC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)[C@@H]1Oc2ccccc2[C@H]1C ZINC000438389416 944555878 /nfs/dbraw/zinc/55/58/78/944555878.db2.gz FOEXIHZDKXFDEX-UYSIFFEZSA-N 0 0 365.389 3.759 20 5 FHBDRN CC(C)OCc1ccccc1CNC(=O)CSc1cccc([N+](=O)[O-])c1 ZINC000509728664 944557481 /nfs/dbraw/zinc/55/74/81/944557481.db2.gz KIVGWUMKWYWICV-UHFFFAOYSA-N 0 0 374.462 3.928 20 5 FHBDRN O=C(NCc1cc(Cl)cc2c1OCC2)[C@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1 ZINC001267966282 944561392 /nfs/dbraw/zinc/56/13/92/944561392.db2.gz AHEUZZSYXUXLCH-SJORKVTESA-N 0 0 372.808 3.603 20 5 FHBDRN COc1cc(-c2nc3cc(Br)ccc3[nH]2)c([N+](=O)[O-])cc1O ZINC000436741822 944570324 /nfs/dbraw/zinc/57/03/24/944570324.db2.gz TXMSKIPYRNNAEF-UHFFFAOYSA-N 0 0 364.155 3.615 20 5 FHBDRN O=C(N[C@H]1CCc2c1cccc2O)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000517763996 944583934 /nfs/dbraw/zinc/58/39/34/944583934.db2.gz UNCPGKMWIDGPFA-AWEZNQCLSA-N 0 0 366.295 3.737 20 5 FHBDRN Cc1ccc(N(Cc2cccs2)C(=O)c2cc([N+](=O)[O-])cnc2N)cc1 ZINC000759858401 944584531 /nfs/dbraw/zinc/58/45/31/944584531.db2.gz MUUXLJNGCHZIBR-UHFFFAOYSA-N 0 0 368.418 3.789 20 5 FHBDRN C[C@@H]1CCN(S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])[C@H]2CCCC[C@@H]12 ZINC000518661517 944585616 /nfs/dbraw/zinc/58/56/16/944585616.db2.gz KGJDXXGHTVHFRK-DYEKYZERSA-N 0 0 372.874 3.838 20 5 FHBDRN O=[N+]([O-])c1cccc2c(NCc3nnc(-c4ccc(F)cc4)[nH]3)ccnc21 ZINC000518666168 944588440 /nfs/dbraw/zinc/58/84/40/944588440.db2.gz BMXPBUYQMHBHCH-UHFFFAOYSA-N 0 0 364.340 3.679 20 5 FHBDRN O=C(Cn1ncc2ccc([N+](=O)[O-])cc21)OCCCSc1ccccc1 ZINC000759856703 944590979 /nfs/dbraw/zinc/59/09/79/944590979.db2.gz GEXUVUIOQDWKGS-UHFFFAOYSA-N 0 0 371.418 3.670 20 5 FHBDRN CN(CC(C)(C)C)c1nnc(-c2ccc([N+](=O)[O-])cc2)n1C[C@@H]1CCCO1 ZINC000566692379 944598197 /nfs/dbraw/zinc/59/81/97/944598197.db2.gz RYKZTRHXUSGMFQ-INIZCTEOSA-N 0 0 373.457 3.515 20 5 FHBDRN Cc1cc(NC(=O)NCCNc2ccc([N+](=O)[O-])cc2)ccc1OC(C)C ZINC000438435341 944601638 /nfs/dbraw/zinc/60/16/38/944601638.db2.gz MJLOVSWZTJWHOZ-UHFFFAOYSA-N 0 0 372.425 3.924 20 5 FHBDRN C[C@H](OC(=O)c1ccc2c(c1)CCCC2)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000017669160 944627179 /nfs/dbraw/zinc/62/71/79/944627179.db2.gz TYUVHIMYRFEKJG-ZDUSSCGKSA-N 0 0 368.389 3.658 20 5 FHBDRN COc1cc(-c2noc(C(C)(C)c3ccccc3[N+](=O)[O-])n2)ccc1O ZINC000436783287 944629592 /nfs/dbraw/zinc/62/95/92/944629592.db2.gz LPIZBKJTZNBBMP-UHFFFAOYSA-N 0 0 355.350 3.685 20 5 FHBDRN CC(C)(c1nc(-c2ccc3c(c2)OCO3)no1)c1ccccc1[N+](=O)[O-] ZINC000426391738 944634051 /nfs/dbraw/zinc/63/40/51/944634051.db2.gz RWYOOYFFOLOAPN-UHFFFAOYSA-N 0 0 353.334 3.699 20 5 FHBDRN COc1cc(C)c(NC(=O)c2cc(SC)ccc2[N+](=O)[O-])cc1OC ZINC000018228363 944648346 /nfs/dbraw/zinc/64/83/46/944648346.db2.gz UFSRQNGWXJXICK-UHFFFAOYSA-N 0 0 362.407 3.895 20 5 FHBDRN CN(CC(=O)NC[C@H]1CCC[C@H](C(F)(F)F)C1)c1ccccc1[N+](=O)[O-] ZINC000438478181 944657141 /nfs/dbraw/zinc/65/71/41/944657141.db2.gz VQWFAKMKLZPIND-STQMWFEESA-N 0 0 373.375 3.516 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NCc1ccncc1OCC(F)F ZINC000519580987 944667095 /nfs/dbraw/zinc/66/70/95/944667095.db2.gz CSSULSRAESHTJY-GFCCVEGCSA-N 0 0 351.353 3.793 20 5 FHBDRN CC[C@@H]1CCC[C@H]1NC(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000426029465 944672053 /nfs/dbraw/zinc/67/20/53/944672053.db2.gz PURMKJTXLAQZFH-BXUZGUMPSA-N 0 0 359.348 3.992 20 5 FHBDRN CC[C@H](C)[C@H](C)N(C(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)C1CC1 ZINC000517833613 944680315 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CC(C)Cn1c(-c2cccc([N+](=O)[O-])c2)nnc1N(C)CC[C@@H]1CCCO1 ZINC000549502850 944698193 /nfs/dbraw/zinc/69/81/93/944698193.db2.gz BGCYYGPTGSERMR-KRWDZBQOSA-N 0 0 373.457 3.515 20 5 FHBDRN COc1ccc(C(=O)NC[C@@H]2CCC[C@H](C(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000438511707 944700457 /nfs/dbraw/zinc/70/04/57/944700457.db2.gz HDVYGQATDZMJTO-PWSUYJOCSA-N 0 0 360.332 3.702 20 5 FHBDRN COc1ccc(CC(C)(C)NC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)cc1 ZINC000438513555 944704316 /nfs/dbraw/zinc/70/43/16/944704316.db2.gz IUJWESWIGJBLQK-UHFFFAOYSA-N 0 0 367.405 3.836 20 5 FHBDRN C[C@@H](NCc1ccc(OCC(F)(F)F)nc1)c1ccccc1[N+](=O)[O-] ZINC000516304444 944706421 /nfs/dbraw/zinc/70/64/21/944706421.db2.gz DDBBAOUIUZTRGL-LLVKDONJSA-N 0 0 355.316 3.782 20 5 FHBDRN O=C(Nc1nc(C(F)(F)F)cs1)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000546201798 944706409 /nfs/dbraw/zinc/70/64/09/944706409.db2.gz XZDWWFYMXPKDDE-UHFFFAOYSA-N 0 0 356.285 3.804 20 5 FHBDRN COc1cc(C(=O)NC[C@H]2CCC[C@H](C(F)(F)F)C2)ccc1[N+](=O)[O-] ZINC000438514628 944706699 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3.869 20 5 FHBDRN CC(C)(C(=O)N1CCC[C@@H](Nc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000426710733 944733646 /nfs/dbraw/zinc/73/36/46/944733646.db2.gz KUCUOCOQAJKCML-GOSISDBHSA-N 0 0 367.449 3.976 20 5 FHBDRN CCc1[nH]nc(C(=O)Nc2cc(Cl)ccc2OC(C)C)c1[N+](=O)[O-] ZINC000426728724 944736533 /nfs/dbraw/zinc/73/65/33/944736533.db2.gz WYKPCKXXCOQIKH-UHFFFAOYSA-N 0 0 352.778 3.573 20 5 FHBDRN C[C@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccc2c(c1)CC(=O)N2 ZINC000047156215 944738168 /nfs/dbraw/zinc/73/81/68/944738168.db2.gz OFMWSXAXURNRTP-VIFPVBQESA-N 0 0 374.784 3.626 20 5 FHBDRN CC(C)(C)S(=O)(=O)Cc1ccc(NCc2ccccc2[N+](=O)[O-])cc1 ZINC000126587225 944742269 /nfs/dbraw/zinc/74/22/69/944742269.db2.gz GENCOYLBUVYLSK-UHFFFAOYSA-N 0 0 362.451 3.920 20 5 FHBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@H](c2ccc(F)cc2)C2CCC2)s1 ZINC000517869482 944746966 /nfs/dbraw/zinc/74/69/66/944746966.db2.gz GQPWMDLXJBSLFL-HNNXBMFYSA-N 0 0 370.427 3.615 20 5 FHBDRN COC1CCC(CC(=O)N2CCS[C@H]2c2ccc([N+](=O)[O-])cc2)CC1 ZINC000759887947 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FHBDRN CC(C)(c1nc(-c2ccc3nccnc3c2)no1)c1ccccc1[N+](=O)[O-] ZINC000426438161 944810758 /nfs/dbraw/zinc/81/07/58/944810758.db2.gz RPTWTNWCRUEIPK-UHFFFAOYSA-N 0 0 361.361 3.914 20 5 FHBDRN O=C1CCc2cc([N+](=O)[O-])c(NC3CCC4(CCOCC4)CC3)cc2N1 ZINC000439615494 944814276 /nfs/dbraw/zinc/81/42/76/944814276.db2.gz SFPISRKLHWXZQQ-UHFFFAOYSA-N 0 0 359.426 3.631 20 5 FHBDRN C[C@H]1CN(C(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])CCC1(F)F ZINC000426792552 944815686 /nfs/dbraw/zinc/81/56/86/944815686.db2.gz JZSQDSWMVOFIBY-VIFPVBQESA-N 0 0 364.801 3.844 20 5 FHBDRN O=C(CSc1ccccc1[N+](=O)[O-])NCc1ccc(F)c(Cl)c1 ZINC000506974854 944821334 /nfs/dbraw/zinc/82/13/34/944821334.db2.gz SNODGTMCPPFPKE-UHFFFAOYSA-N 0 0 354.790 3.796 20 5 FHBDRN COc1cc(C)cc(-c2nc(Cc3ccc([N+](=O)[O-])c(C)c3)no2)c1O ZINC000436946916 944833923 /nfs/dbraw/zinc/83/39/23/944833923.db2.gz CNEMXEWEFNDOKN-UHFFFAOYSA-N 0 0 355.350 3.567 20 5 FHBDRN O=C([O-])[C@@H](Cc1ccco1)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000426812416 944834549 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362.798 3.552 20 5 FHBDRN COCCCOc1ccc(Nc2c(F)cccc2[N+](=O)[O-])cc1OC ZINC000516557381 945023607 /nfs/dbraw/zinc/02/36/07/945023607.db2.gz MEJAJOASNVNYOE-UHFFFAOYSA-N 0 0 350.346 3.901 20 5 FHBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)N1CCCC[C@H]1C(F)F ZINC000507200282 945026165 /nfs/dbraw/zinc/02/61/65/945026165.db2.gz BDZBJRBVGNQSGL-HNNXBMFYSA-N 0 0 355.385 3.747 20 5 FHBDRN Cc1ccccc1[C@H]1CCN(CC(=O)Nc2c(C)cccc2[N+](=O)[O-])C1 ZINC000507203060 945027946 /nfs/dbraw/zinc/02/79/46/945027946.db2.gz IPQAOQRXNSCKQM-INIZCTEOSA-N 0 0 353.422 3.640 20 5 FHBDRN Cc1ccc(NCCCNC(=O)N2CCCC[C@@H]2C(F)F)c([N+](=O)[O-])c1 ZINC000507203431 945029321 /nfs/dbraw/zinc/02/93/21/945029321.db2.gz JBHYAGMOCNQDGT-CQSZACIVSA-N 0 0 370.400 3.534 20 5 FHBDRN COc1cc(C(=O)NCCc2cccc3ccccc32)c([N+](=O)[O-])cc1F ZINC001125952457 945031202 /nfs/dbraw/zinc/03/12/02/945031202.db2.gz UQYWINURSBOJSN-UHFFFAOYSA-N 0 0 368.364 3.868 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)c1ccnc(-c2ccccc2)n1 ZINC001270544307 945035333 /nfs/dbraw/zinc/03/53/33/945035333.db2.gz PRCORZNJCKUHDV-UHFFFAOYSA-N 0 0 364.361 3.703 20 5 FHBDRN C[C@H](C(=O)N[C@H]1c2ccc(F)cc2O[C@H]1C)c1ccc([N+](=O)[O-])cc1F ZINC000519021542 945035454 /nfs/dbraw/zinc/03/54/54/945035454.db2.gz OOFMVHCMVKVZEV-FJHFEUQMSA-N 0 0 362.332 3.615 20 5 FHBDRN CCOc1ccc([C@@H]2C[C@H]2NC(=O)NCc2cccc([N+](=O)[O-])c2C)cc1 ZINC000437851421 945036373 /nfs/dbraw/zinc/03/63/73/945036373.db2.gz KPMGHQIYHSNBJD-ZWKOTPCHSA-N 0 0 369.421 3.657 20 5 FHBDRN O=C(NC1CC1)c1cc([N+](=O)[O-])ccc1N1CC[C@H](c2cccc(F)c2)C1 ZINC000729471398 945040133 /nfs/dbraw/zinc/04/01/33/945040133.db2.gz XJWPJQQYXVLFII-AWEZNQCLSA-N 0 0 369.396 3.620 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N(C)C[C@@H]1CCCOC1 ZINC000506361661 945041243 /nfs/dbraw/zinc/04/12/43/945041243.db2.gz FDMJFONIOVUZJP-ZDUSSCGKSA-N 0 0 352.456 3.596 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H](C)[C@@H]1COc2ccccc21 ZINC000439867742 945041357 /nfs/dbraw/zinc/04/13/57/945041357.db2.gz BYBAGAQHADXBMQ-WFASDCNBSA-N 0 0 371.393 3.680 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N(C)CCN(C)c1ccccc1 ZINC000439869680 945042397 /nfs/dbraw/zinc/04/23/97/945042397.db2.gz DOEKPNQOQSDTMW-UHFFFAOYSA-N 0 0 372.425 3.594 20 5 FHBDRN O=[N+]([O-])c1ccc(OC(F)F)c(CN2CCO[C@H](c3ccccc3)C2)c1 ZINC000506369741 945044947 /nfs/dbraw/zinc/04/49/47/945044947.db2.gz MUQSWIMIBCANCR-KRWDZBQOSA-N 0 0 364.348 3.770 20 5 FHBDRN CC[C@H](c1ccccc1)N(CC(C)C)C(=O)Cn1c(C)ncc1[N+](=O)[O-] ZINC001125954685 945045411 /nfs/dbraw/zinc/04/54/11/945045411.db2.gz BYMJXPOGRMKGDY-QGZVFWFLSA-N 0 0 358.442 3.736 20 5 FHBDRN CNC(=O)c1ccc(Oc2cccc(Oc3ccccn3)c2)c([N+](=O)[O-])c1 ZINC000516607048 945049867 /nfs/dbraw/zinc/04/98/67/945049867.db2.gz AGUBDNZDQHYPSR-UHFFFAOYSA-N 0 0 365.345 3.934 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H](O)C(CC)CC ZINC000506372179 945049898 /nfs/dbraw/zinc/04/98/98/945049898.db2.gz NTZSZHSUVYJXSP-OAHLLOKOSA-N 0 0 354.472 3.624 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N(CCOC)[C@@H]1CC[C@H](C)C1 ZINC000439889818 945051316 /nfs/dbraw/zinc/05/13/16/945051316.db2.gz XFDKWJJVSNJNCS-UONOGXRCSA-N 0 0 365.430 3.662 20 5 FHBDRN CN1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3o2)c2ccc(F)cc21 ZINC000437123236 945053395 /nfs/dbraw/zinc/05/33/95/945053395.db2.gz JDQTXOHEFDLRTA-UHFFFAOYSA-N 0 0 355.325 3.577 20 5 FHBDRN O=C(NCCCc1c[nH]c2ccccc12)NCCc1cccc([N+](=O)[O-])c1 ZINC000126534762 945060662 /nfs/dbraw/zinc/06/06/62/945060662.db2.gz JHCBETCEAXNHSJ-UHFFFAOYSA-N 0 0 366.421 3.551 20 5 FHBDRN Cc1sc(S(=O)(=O)N(CC(C)C)c2ccccc2)cc1[N+](=O)[O-] ZINC000507612669 945375657 /nfs/dbraw/zinc/37/56/57/945375657.db2.gz GXYXTHJONKRXPY-UHFFFAOYSA-N 0 0 354.453 3.816 20 5 FHBDRN CCc1n[nH]c(C(=O)N2CCC[C@@H](CCCc3ccccc3)C2)c1[N+](=O)[O-] ZINC000440306218 945389521 /nfs/dbraw/zinc/38/95/21/945389521.db2.gz QOJKBIDGAYNYCF-MRXNPFEDSA-N 0 0 370.453 3.755 20 5 FHBDRN CCN(C(=O)NCc1ccc([N+](=O)[O-])cc1Cl)[C@H](C)c1cccnc1 ZINC000185999561 945409010 /nfs/dbraw/zinc/40/90/10/945409010.db2.gz VUKSIIDBXZBHOY-GFCCVEGCSA-N 0 0 362.817 3.936 20 5 FHBDRN CN(Cc1nc2ccccc2s1)C(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000087005001 945425382 /nfs/dbraw/zinc/42/53/82/945425382.db2.gz LQRUCAQQWDBMDK-UHFFFAOYSA-N 0 0 355.419 3.796 20 5 FHBDRN CCN1C(=O)c2ccc(Cl)cc2N[C@@H]1c1ccc(OC)c([N+](=O)[O-])c1 ZINC000106899584 945428679 /nfs/dbraw/zinc/42/86/79/945428679.db2.gz NISGWRYKIKTQAF-INIZCTEOSA-N 0 0 361.785 3.843 20 5 FHBDRN O=C(NCc1cc(F)cc(F)c1)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000184384187 945429400 /nfs/dbraw/zinc/42/94/00/945429400.db2.gz PJFFUTBHWIFXID-UHFFFAOYSA-N 0 0 355.728 3.526 20 5 FHBDRN COc1cccc(NC(=O)COc2ccc([N+](=O)[O-])c3ccccc23)c1 ZINC000151732866 945436685 /nfs/dbraw/zinc/43/66/85/945436685.db2.gz XMNGIDBZEMEEII-UHFFFAOYSA-N 0 0 352.346 3.774 20 5 FHBDRN O=[N+]([O-])c1ccc(NCCNC(=S)Nc2ccccc2Cl)cc1 ZINC000018166314 945436773 /nfs/dbraw/zinc/43/67/73/945436773.db2.gz SXYBYHCLZUERIL-UHFFFAOYSA-N 0 0 350.831 3.647 20 5 FHBDRN CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)CCCC1CCOCC1 ZINC000280877759 945449071 /nfs/dbraw/zinc/44/90/71/945449071.db2.gz BYJPIDDANZNDFJ-UHFFFAOYSA-N 0 0 354.834 3.804 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])[C@H]1c2cc(Cl)cc(Cl)c2C[C@H]1O ZINC000507685643 945449641 /nfs/dbraw/zinc/44/96/41/945449641.db2.gz DIXXVTUYCGMBIX-SJORKVTESA-N 0 0 367.232 3.992 20 5 FHBDRN Cc1nccc(NC(=O)c2ccc(Br)cc2[N+](=O)[O-])c1Cl ZINC000125011563 945458216 /nfs/dbraw/zinc/45/82/16/945458216.db2.gz ZYAXLZOEEPRGAM-UHFFFAOYSA-N 0 0 370.590 3.966 20 5 FHBDRN O=c1[nH]c(N[C@@H]2CCC[C@@H](C(F)(F)F)C2)nc2ccc([N+](=O)[O-])cc12 ZINC000280949304 945476645 /nfs/dbraw/zinc/47/66/45/945476645.db2.gz JMYFIYJMZKRGGX-RKDXNWHRSA-N 0 0 356.304 3.777 20 5 FHBDRN C[C@H](NC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)c1ccc(F)c(F)c1 ZINC000087022553 945478178 /nfs/dbraw/zinc/47/81/78/945478178.db2.gz INMRXJUDHVNGEU-NSHDSACASA-N 0 0 361.348 3.702 20 5 FHBDRN O=C(N[C@H]1C[C@H](c2ccccc2)C1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000438047857 945486241 /nfs/dbraw/zinc/48/62/41/945486241.db2.gz HUYGMQKLGUQNBL-SAABIXHNSA-N 0 0 351.406 3.609 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)N[C@H]1C[C@H](c2cccc(F)c2)C1 ZINC000438055505 945488924 /nfs/dbraw/zinc/48/89/24/945488924.db2.gz OLUTVQMYMBSRFZ-JCNLHEQBSA-N 0 0 357.385 3.822 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N(C)Cc2ccc(Cl)cc2)c1C ZINC000015329301 945490606 /nfs/dbraw/zinc/49/06/06/945490606.db2.gz JIEHWXRZSYMMIX-UHFFFAOYSA-N 0 0 368.842 3.686 20 5 FHBDRN CC[C@@H](C)COc1cc([N+](=O)[O-])c(CN2CCC[C@H]2CF)cc1OC ZINC000550032316 945497593 /nfs/dbraw/zinc/49/75/93/945497593.db2.gz KEVFQFSYPIJGGJ-HIFRSBDPSA-N 0 0 354.422 3.962 20 5 FHBDRN C[C@@H]1CCN(CCn2ccc([N+](=O)[O-])n2)c2cc(Cl)ccc2S1 ZINC000440395571 945502952 /nfs/dbraw/zinc/50/29/52/945502952.db2.gz YJLMVUPOVPEHHI-LLVKDONJSA-N 0 0 352.847 3.836 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)NCc1ccnc(N2CCCCCC2)c1 ZINC000107180358 945512389 /nfs/dbraw/zinc/51/23/89/945512389.db2.gz YPMASJMECWZUES-UHFFFAOYSA-N 0 0 368.437 3.609 20 5 FHBDRN COc1ccc(NC(=O)[C@H](C)Oc2ccc(SC)cc2)cc1[N+](=O)[O-] ZINC000543856968 945517551 /nfs/dbraw/zinc/51/75/51/945517551.db2.gz QJCJWVXRCMQDBJ-NSHDSACASA-N 0 0 362.407 3.731 20 5 FHBDRN COc1ccc(CCCCC(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)cc1 ZINC000543857034 945517876 /nfs/dbraw/zinc/51/78/76/945517876.db2.gz RZVMGVGOQJKZIE-UHFFFAOYSA-N 0 0 358.394 3.964 20 5 FHBDRN O=C1CCc2cc(Nc3ncccc3[N+](=O)[O-])ccc2N1CC(F)(F)F ZINC000436421928 945530379 /nfs/dbraw/zinc/53/03/79/945530379.db2.gz KTFGIMZICDESJX-UHFFFAOYSA-N 0 0 366.299 3.575 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)C1(c2ccccc2)CCOCC1 ZINC000281194477 945550571 /nfs/dbraw/zinc/55/05/71/945550571.db2.gz BSJHLCKFAVWIHT-UHFFFAOYSA-N 0 0 370.405 3.680 20 5 FHBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CC[C@H](C2CC2)C1 ZINC000550303811 945551142 /nfs/dbraw/zinc/55/11/42/945551142.db2.gz NRHMYWNBXWFBDE-NSHDSACASA-N 0 0 353.216 3.538 20 5 FHBDRN O=[N+]([O-])c1ccccc1-c1cnn(Cc2noc(C3CCCCC3)n2)c1 ZINC000519618525 945562833 /nfs/dbraw/zinc/56/28/33/945562833.db2.gz SKXWUYAPOFASGR-UHFFFAOYSA-N 0 0 353.382 3.937 20 5 FHBDRN O=C(c1cc(F)c([N+](=O)[O-])cc1F)N(Cc1ccco1)c1ccccn1 ZINC000125084598 945574607 /nfs/dbraw/zinc/57/46/07/945574607.db2.gz SPWNKXSOSGGTFA-UHFFFAOYSA-N 0 0 359.288 3.708 20 5 FHBDRN CC[C@H](C)[C@H](C)Oc1c(Br)cc(C(=O)OC)cc1[N+](=O)[O-] ZINC001226270142 945582931 /nfs/dbraw/zinc/58/29/31/945582931.db2.gz PENXBCDQHUTYIN-IUCAKERBSA-N 0 0 360.204 3.957 20 5 FHBDRN O=c1c2cc([N+](=O)[O-])ccc2nc2n1CC/C2=C\c1cccc(F)c1F ZINC000107417617 945598460 /nfs/dbraw/zinc/59/84/60/945598460.db2.gz DZTJNFNIRXPKAC-DHZHZOJOSA-N 0 0 355.300 3.527 20 5 FHBDRN Cc1cccc2c1CC[C@@H]2NC(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1 ZINC001126019235 945617818 /nfs/dbraw/zinc/61/78/18/945617818.db2.gz IHZBOMBWVXWDNO-KRWDZBQOSA-N 0 0 362.389 3.506 20 5 FHBDRN Cc1cc(C(=O)Nc2cncc(Cl)c2Br)cc([N+](=O)[O-])c1 ZINC000519673081 945623652 /nfs/dbraw/zinc/62/36/52/945623652.db2.gz ZBRDSIXPQWJPIW-UHFFFAOYSA-N 0 0 370.590 3.966 20 5 FHBDRN CCn1ncc2cc(C(=O)Nc3cc([N+](=O)[O-])c(C)cc3C)c(C)nc21 ZINC000281452198 945637765 /nfs/dbraw/zinc/63/77/65/945637765.db2.gz LPTJICZDHIMAJI-UHFFFAOYSA-N 0 0 353.382 3.537 20 5 FHBDRN C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1cc(Cl)nc(Cl)c1 ZINC000728812039 945667223 /nfs/dbraw/zinc/66/72/23/945667223.db2.gz VTDWQIHNJAFQPV-QMMMGPOBSA-N 0 0 352.177 3.888 20 5 FHBDRN Cc1c(C(=O)N2CCCC[C@H]2C2CCC2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000843743313 945682229 /nfs/dbraw/zinc/68/22/29/945682229.db2.gz LTBRDZVQCWDPHV-HNNXBMFYSA-N 0 0 361.398 3.915 20 5 FHBDRN Cn1c(SCc2ccc(Cl)c([N+](=O)[O-])c2)nnc1-c1cccnc1 ZINC000127072720 945705674 /nfs/dbraw/zinc/70/56/74/945705674.db2.gz DZIWGCOCVQSUSL-UHFFFAOYSA-N 0 0 361.814 3.731 20 5 FHBDRN O=C(Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1)[C@H]1[C@@H]2CCC(=O)[C@@H]21 ZINC001126031715 945717111 /nfs/dbraw/zinc/71/71/11/945717111.db2.gz NAAMHZWPRDRVQN-NXHRZFHOSA-N 0 0 352.346 3.551 20 5 FHBDRN O=C(Nc1ccc2cc([N+](=O)[O-])ccc2n1)[C@@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000440629010 945719511 /nfs/dbraw/zinc/71/95/11/945719511.db2.gz XORPUGMPNLJDFE-VXGBXAGGSA-N 0 0 367.327 3.872 20 5 FHBDRN O=C(Nc1ccc(Cl)cn1)[C@@H]1CCCN(c2ccsc2[N+](=O)[O-])C1 ZINC000063263170 945727522 /nfs/dbraw/zinc/72/75/22/945727522.db2.gz IRAOVSKIUQTECU-SNVBAGLBSA-N 0 0 366.830 3.560 20 5 FHBDRN CC(C)Cc1ncc(NC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)cn1 ZINC000473651870 945731360 /nfs/dbraw/zinc/73/13/60/945731360.db2.gz ZFASWSAPGFYRHQ-UHFFFAOYSA-N 0 0 372.428 3.922 20 5 FHBDRN C[C@@H](C(=O)N1C[C@H](C)C[C@H]1c1cccnc1)c1ccc([N+](=O)[O-])cc1F ZINC000248625005 945740630 /nfs/dbraw/zinc/74/06/30/945740630.db2.gz USGZGPUIXDVSKH-VFVRVIDISA-N 0 0 357.385 3.842 20 5 FHBDRN COc1cccc(C(=O)NCc2ccc(-c3ccccc3)o2)c1[N+](=O)[O-] ZINC000444039525 945746547 /nfs/dbraw/zinc/74/65/47/945746547.db2.gz MGBODXZGOLVXEZ-UHFFFAOYSA-N 0 0 352.346 3.793 20 5 FHBDRN CC[C@@H](c1ccccc1OC)N(C)C(=O)c1cccc(OC)c1[N+](=O)[O-] ZINC000519778803 945756042 /nfs/dbraw/zinc/75/60/42/945756042.db2.gz JAIFVDZFPMUNAJ-HNNXBMFYSA-N 0 0 358.394 3.835 20 5 FHBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc2nccnc2c1 ZINC000140942955 945769915 /nfs/dbraw/zinc/76/99/15/945769915.db2.gz CKHYXNVIQWYASX-SNVBAGLBSA-N 0 0 372.768 3.597 20 5 FHBDRN C/C(=C\C1CCC(C)CC1)C(=O)N1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC001271319007 945769957 /nfs/dbraw/zinc/76/99/57/945769957.db2.gz VXKBKRUGXRMLQO-FYWRMAATSA-N 0 0 360.458 3.727 20 5 FHBDRN CSc1ccc(C(=O)N=c2cc(C3CCCCC3)[nH][nH]2)cc1[N+](=O)[O-] ZINC000426659807 945794462 /nfs/dbraw/zinc/79/44/62/945794462.db2.gz IVNHWUWGMVOUSB-UHFFFAOYSA-N 0 0 360.439 3.762 20 5 FHBDRN CC1(C)[C@@H]2CN(C(=O)c3cccc4c(=O)c5cccc(F)c5[nH]c34)C[C@@H]21 ZINC000444075794 945798943 /nfs/dbraw/zinc/79/89/43/945798943.db2.gz PZDOJKQGJPOKEE-GASCZTMLSA-N 0 0 350.393 3.548 20 5 FHBDRN O=C(Nc1cccc(C(F)(F)F)c1)c1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000020674524 945800105 /nfs/dbraw/zinc/80/01/05/945800105.db2.gz XVENOBFCTRNBNQ-UHFFFAOYSA-N 0 0 368.267 3.637 20 5 FHBDRN CC1(C)CO[C@H](CCNC(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000894497174 945805378 /nfs/dbraw/zinc/80/53/78/945805378.db2.gz IHJFVAWXYMLQMU-LLVKDONJSA-N 0 0 360.332 3.549 20 5 FHBDRN C[C@@H](C(=O)Nc1ccc2nnc(C3CCC3)n2c1)c1cccc([N+](=O)[O-])c1 ZINC000519851593 945819692 /nfs/dbraw/zinc/81/96/92/945819692.db2.gz CLAAIFJJYPNZKA-GFCCVEGCSA-N 0 0 365.393 3.647 20 5 FHBDRN Cc1ccccc1[C@H](c1noc(CCn2cc([N+](=O)[O-])cn2)n1)C(C)C ZINC000519854360 945823038 /nfs/dbraw/zinc/82/30/38/945823038.db2.gz CCBBXENKQMIGMV-QGZVFWFLSA-N 0 0 355.398 3.513 20 5 FHBDRN CCn1ccnc1[C@@H]1CCCCN1C(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000281736631 945833192 /nfs/dbraw/zinc/83/31/92/945833192.db2.gz JCGKLYZGMJZRTC-HNNXBMFYSA-N 0 0 362.817 3.832 20 5 FHBDRN Cc1cc(NCC(=O)Nc2ccc(Br)cc2)ccc1[N+](=O)[O-] ZINC000108089305 945855531 /nfs/dbraw/zinc/85/55/31/945855531.db2.gz MAYOXZBSPNIVDZ-UHFFFAOYSA-N 0 0 364.199 3.716 20 5 FHBDRN CN(C)c1cc(F)c(C(=O)N(C)c2ccc3cc[nH]c3c2)cc1[N+](=O)[O-] ZINC001271557083 945863040 /nfs/dbraw/zinc/86/30/40/945863040.db2.gz ILSDPYDWUHDYCP-UHFFFAOYSA-N 0 0 356.357 3.558 20 5 FHBDRN COCCN(CCc1ccccc1)C(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000519906228 945870330 /nfs/dbraw/zinc/87/03/30/945870330.db2.gz QOFYYDQKPLSGFO-UHFFFAOYSA-N 0 0 357.410 3.626 20 5 FHBDRN COc1ccc(C(C)(C)CNC(=O)c2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000063721547 945873985 /nfs/dbraw/zinc/87/39/85/945873985.db2.gz KTGMODWKHBLCHB-UHFFFAOYSA-N 0 0 362.813 3.964 20 5 FHBDRN O=[N+]([O-])c1ccc(C(F)(F)F)c(CN2CC[C@@H](n3cc(Cl)cn3)C2)c1 ZINC000550105076 945875958 /nfs/dbraw/zinc/87/59/58/945875958.db2.gz IBQQUKXCGMFBOH-CYBMUJFWSA-N 0 0 374.750 3.911 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)Nc1nnc(Cc2ccccc2F)s1 ZINC000108207346 945889300 /nfs/dbraw/zinc/88/93/00/945889300.db2.gz UZNHNNUATDUTOA-UHFFFAOYSA-N 0 0 372.381 3.737 20 5 FHBDRN CO[C@H]1CCN(C(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)[C@H](C)C1 ZINC000281861333 945890395 /nfs/dbraw/zinc/89/03/95/945890395.db2.gz VKZFZVPMPRROCD-HIFRSBDPSA-N 0 0 350.418 3.733 20 5 FHBDRN Cc1ccc(Cc2cnc(NC(=O)c3ccc([N+](=O)[O-])[nH]3)s2)cc1C ZINC000487477792 945893731 /nfs/dbraw/zinc/89/37/31/945893731.db2.gz UVZZRVYAFQVFQC-UHFFFAOYSA-N 0 0 356.407 3.839 20 5 FHBDRN CC[C@@H](C(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)c1ccccc1 ZINC000519556194 945894658 /nfs/dbraw/zinc/89/46/58/945894658.db2.gz GBBNEDQVIRHFFB-QGZVFWFLSA-N 0 0 351.406 3.929 20 5 FHBDRN CC[C@H](C(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)c1ccccc1 ZINC000519556191 945895225 /nfs/dbraw/zinc/89/52/25/945895225.db2.gz GBBNEDQVIRHFFB-KRWDZBQOSA-N 0 0 351.406 3.929 20 5 FHBDRN COc1ccc(CCC(=O)N2CCc3c2cccc3[N+](=O)[O-])cc1Cl ZINC000078149499 945901438 /nfs/dbraw/zinc/90/14/38/945901438.db2.gz QUQLRKXPCIEBCQ-UHFFFAOYSA-N 0 0 360.797 3.779 20 5 FHBDRN O=C(c1cc(F)cc2c(=O)c3cccc(F)c3[nH]c12)N1CCC12CCC2 ZINC000444121131 945919888 /nfs/dbraw/zinc/91/98/88/945919888.db2.gz JPEKHQMLBDVRLK-UHFFFAOYSA-N 0 0 354.356 3.728 20 5 FHBDRN CO[C@H](CNC(=O)c1cccc2c(=O)c3cccc(F)c3[nH]c12)C(C)(C)C ZINC000444118285 945922215 /nfs/dbraw/zinc/92/22/15/945922215.db2.gz WNAHOFLLHOZAOX-MRXNPFEDSA-N 0 0 370.424 3.611 20 5 FHBDRN COC(=O)c1ccc(OC(=O)c2ccc([N+](=O)[O-])cc2Cl)c(Cl)c1 ZINC000894522697 945924719 /nfs/dbraw/zinc/92/47/19/945924719.db2.gz COWUPOCAPXAONI-UHFFFAOYSA-N 0 0 370.144 3.907 20 5 FHBDRN O=C(NC[C@H]1CCC2(CCC2)CO1)c1c([N+](=O)[O-])cccc1C(F)(F)F ZINC000894529140 945925311 /nfs/dbraw/zinc/92/53/11/945925311.db2.gz UFIQAEZUFXPFNI-LLVKDONJSA-N 0 0 372.343 3.693 20 5 FHBDRN COCc1ccc(CNc2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)cc1 ZINC000108310887 945929321 /nfs/dbraw/zinc/92/93/21/945929321.db2.gz WQSLHMBUSMXALR-UHFFFAOYSA-N 0 0 369.421 3.589 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CC(OCCCc2ccccc2)C1 ZINC000473685470 945936251 /nfs/dbraw/zinc/93/62/51/945936251.db2.gz GYNNKNKUQHFXLR-UHFFFAOYSA-N 0 0 369.421 3.769 20 5 FHBDRN Cc1ccc([C@@H]2C[C@@H](C)N(C(=O)CNc3ccccc3[N+](=O)[O-])C2)cc1 ZINC000428328637 945937468 /nfs/dbraw/zinc/93/74/68/945937468.db2.gz ZRZRCNDBWMSICV-NVXWUHKLSA-N 0 0 353.422 3.720 20 5 FHBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)N1CC[C@@H](C2CCC2)C1 ZINC000665677614 945944753 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946015662 /nfs/dbraw/zinc/01/56/62/946015662.db2.gz VNHZDNGQHJSPJB-LBPRGKRZSA-N 0 0 370.434 3.950 20 5 FHBDRN CCc1[nH]nc(C(=O)Nc2ccc(Cl)cc2-n2cccc2)c1[N+](=O)[O-] ZINC000444170314 946016450 /nfs/dbraw/zinc/01/64/50/946016450.db2.gz MWGGHWUHDSUSIV-UHFFFAOYSA-N 0 0 359.773 3.577 20 5 FHBDRN COCc1c2ccccc2oc1C(=O)N1CCc2c1cccc2[N+](=O)[O-] ZINC000078149684 946028305 /nfs/dbraw/zinc/02/83/05/946028305.db2.gz LQCSYJAGNVCDBT-UHFFFAOYSA-N 0 0 352.346 3.690 20 5 FHBDRN COc1ccc2c(c1)CC[C@H](NC(=O)Nc1ccc([N+](=O)[O-])c(C)c1)C2 ZINC000613784417 946037977 /nfs/dbraw/zinc/03/79/77/946037977.db2.gz QAEHDHIEUZXCSY-INIZCTEOSA-N 0 0 355.394 3.591 20 5 FHBDRN CSc1ccc(C(=O)NC[C@H]2CCOc3ccccc32)cc1[N+](=O)[O-] ZINC000108736798 946053146 /nfs/dbraw/zinc/05/31/46/946053146.db2.gz KJYDFDICNCPLEZ-CYBMUJFWSA-N 0 0 358.419 3.613 20 5 FHBDRN COc1ccc2nc(NC(=O)COc3ccc([N+](=O)[O-])c(C)c3)sc2c1 ZINC000001284569 946056331 /nfs/dbraw/zinc/05/63/31/946056331.db2.gz HUNTUDACCALAAX-UHFFFAOYSA-N 0 0 373.390 3.539 20 5 FHBDRN CSc1ccc([N+](=O)[O-])cc1C(=O)Nc1cc(CC(C)(C)C)nn1C ZINC001126081660 946065833 /nfs/dbraw/zinc/06/58/33/946065833.db2.gz GGXJHLIPXKBOBO-UHFFFAOYSA-N 0 0 362.455 3.891 20 5 FHBDRN COc1ccc(C(=O)CCCC(=O)NCc2cccc([N+](=O)[O-])c2C)cc1 ZINC000508467945 946066719 /nfs/dbraw/zinc/06/67/19/946066719.db2.gz KFEULFZNUVUHMC-UHFFFAOYSA-N 0 0 370.405 3.581 20 5 FHBDRN CC(C)C1CCN([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000444202876 946068091 /nfs/dbraw/zinc/06/80/91/946068091.db2.gz XUMVQKICPFVJJX-LBPRGKRZSA-N 0 0 353.850 3.943 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc3c(c2)COC3)cc1SC ZINC000508469378 946068208 /nfs/dbraw/zinc/06/82/08/946068208.db2.gz YJCWBQQFISKXBE-UHFFFAOYSA-N 0 0 360.391 3.608 20 5 FHBDRN COc1cc(C(=O)NCc2ccc(C(C)(C)C)cc2)c([N+](=O)[O-])cc1OC ZINC000074373990 946070575 /nfs/dbraw/zinc/07/05/75/946070575.db2.gz CEGDSAPPRGEEQE-UHFFFAOYSA-N 0 0 372.421 3.840 20 5 FHBDRN CC(=O)N1CCN(Cc2ccc([N+](=O)[O-])cc2Cl)CC12CCCCC2 ZINC000408174321 946095324 /nfs/dbraw/zinc/09/53/24/946095324.db2.gz IYTXLOMWKIJXLG-UHFFFAOYSA-N 0 0 365.861 3.615 20 5 FHBDRN Cn1c(NC(=O)CCOc2ccccc2[N+](=O)[O-])nc2c1cccc2Cl ZINC000184415810 946096050 /nfs/dbraw/zinc/09/60/50/946096050.db2.gz VSJITLPQPZOCQM-UHFFFAOYSA-N 0 0 374.784 3.543 20 5 FHBDRN O=C(N[C@@H]1C=CCCC1)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12 ZINC000444231888 946103390 /nfs/dbraw/zinc/10/33/90/946103390.db2.gz KNHZVMSOXFQLDF-CYBMUJFWSA-N 0 0 354.356 3.798 20 5 FHBDRN CSc1cccc(C(=O)Nc2nc3c(s2)C(=O)CCC3)c1[N+](=O)[O-] ZINC000186444403 946114297 /nfs/dbraw/zinc/11/42/97/946114297.db2.gz GGYADOLNZLEESL-UHFFFAOYSA-N 0 0 363.420 3.545 20 5 FHBDRN O=C(N[C@H]1CC[C@@H](CO)CC1)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000151763731 946121106 /nfs/dbraw/zinc/12/11/06/946121106.db2.gz IWNHSXPBSNVVBM-CZIWCDLHSA-N 0 0 369.421 3.619 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)Nc1ccc2oc3ccccc3c2c1 ZINC000520100921 946121422 /nfs/dbraw/zinc/12/14/22/946121422.db2.gz DEIQYVNBOWPWSC-UHFFFAOYSA-N 0 0 350.334 3.638 20 5 FHBDRN C[C@@H](C(=O)Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1)c1ccccc1F ZINC000109020214 946124513 /nfs/dbraw/zinc/12/45/13/946124513.db2.gz XPMVWPIURSZRJK-LLVKDONJSA-N 0 0 354.341 3.866 20 5 FHBDRN O=C(c1cccc2c(=O)c3cccc(F)c3[nH]c12)N1C[C@@H]2CCC[C@@H]2C1 ZINC000444250234 946124715 /nfs/dbraw/zinc/12/47/15/946124715.db2.gz UFNVENXHVJFLRQ-BETUJISGSA-N 0 0 350.393 3.693 20 5 FHBDRN O=C(c1cccc2c(=O)c3cccc(F)c3[nH]c12)N1CCC(C(F)F)CC1 ZINC000444253296 946129023 /nfs/dbraw/zinc/12/90/23/946129023.db2.gz UCJFQYPFHYDPKD-UHFFFAOYSA-N 0 0 374.362 3.938 20 5 FHBDRN CCc1c(C(=O)Nc2cc([N+](=O)[O-])ccc2C)cnn1-c1ccccc1 ZINC000074382096 946133454 /nfs/dbraw/zinc/13/34/54/946133454.db2.gz ZQMUAZHQBJEIFS-UHFFFAOYSA-N 0 0 350.378 3.904 20 5 FHBDRN CCOc1ccc(C(=O)N2CCC[C@@H]2c2cccc(OC)c2)cc1[N+](=O)[O-] ZINC000045755851 946135911 /nfs/dbraw/zinc/13/59/11/946135911.db2.gz DEXODLAIGXSRBW-QGZVFWFLSA-N 0 0 370.405 3.979 20 5 FHBDRN CC(C)(C(=O)NCCNc1ccccc1[N+](=O)[O-])c1cccc(Cl)c1 ZINC000522949075 946139646 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Cc1c(-c2nc(-c3ccc4c(c3)CCC(=O)N4)no2)cccc1[N+](=O)[O-] ZINC000545773571 946585988 /nfs/dbraw/zinc/58/59/88/946585988.db2.gz ANRGIHUKFWTDDB-UHFFFAOYSA-N 0 0 350.334 3.505 20 5 FHBDRN CC(C)COC(=O)Nc1cccc(NC(=O)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC000067519179 946587404 /nfs/dbraw/zinc/58/74/04/946587404.db2.gz CULPOXQZKJEFBH-UHFFFAOYSA-N 0 0 371.393 3.981 20 5 FHBDRN CSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H](C)Cc1cccs1 ZINC001126581468 946588263 /nfs/dbraw/zinc/58/82/63/946588263.db2.gz FZWBXSNTCWLLDZ-NSHDSACASA-N 0 0 350.465 3.987 20 5 FHBDRN CCc1ccc(NC(=O)[C@@H]2C[C@@H]2c2cccc([N+](=O)[O-])c2)c(C(=O)OC)c1 ZINC001126142526 946600125 /nfs/dbraw/zinc/60/01/25/946600125.db2.gz GAXSKUZNEGGCGD-HZPDHXFCSA-N 0 0 368.389 3.686 20 5 FHBDRN CCC[C@H](C)[C@H]1CCCN1C(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000159145678 946600279 /nfs/dbraw/zinc/60/02/79/946600279.db2.gz MCYVEJCUNUINFQ-GOEBONIOSA-N 0 0 356.426 3.821 20 5 FHBDRN C[C@H](CC(F)(F)F)NC(=O)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000444327886 946606220 /nfs/dbraw/zinc/60/62/20/946606220.db2.gz RMKRQHAGZUCYHX-SECBINFHSA-N 0 0 366.314 3.891 20 5 FHBDRN CCC[C@@H](C)[C@@H]1CCCN1C(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000159145285 946612832 /nfs/dbraw/zinc/61/28/32/946612832.db2.gz MCYVEJCUNUINFQ-ZBFHGGJFSA-N 0 0 356.426 3.821 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NC[C@@H]1[C@@H]2Cc3ccccc3[C@H]12 ZINC000475546109 946616762 /nfs/dbraw/zinc/61/67/62/946616762.db2.gz FWGUFNFVCXJLAW-FCEWJHQRSA-N 0 0 351.406 3.919 20 5 FHBDRN Cc1cc(S(=O)(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)sc1Cl ZINC000473908196 946629093 /nfs/dbraw/zinc/62/90/93/946629093.db2.gz VAVMXCDOYKGCTP-VIFPVBQESA-N 0 0 360.844 3.658 20 5 FHBDRN CC(C)Oc1ccccc1C(=O)Nc1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000468903239 946641500 /nfs/dbraw/zinc/64/15/00/946641500.db2.gz HJWQMSDBWDTYKJ-UHFFFAOYSA-N 0 0 351.362 3.604 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1)N1CCCC[C@H]1c1nc2ccccc2[nH]1 ZINC000456698084 946650820 /nfs/dbraw/zinc/65/08/20/946650820.db2.gz OLJIZNQQKVWPGG-KRWDZBQOSA-N 0 0 350.378 3.839 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1CN[C@@H](CO)c1ccccc1OC(F)(F)F ZINC000475563852 946656002 /nfs/dbraw/zinc/65/60/02/946656002.db2.gz WQAZFODMRHNTFR-HNNXBMFYSA-N 0 0 370.327 3.625 20 5 FHBDRN O=[N+]([O-])c1c(Sc2nnc(N3CCCC3)s2)ccc2ncccc21 ZINC000112076289 946656276 /nfs/dbraw/zinc/65/62/76/946656276.db2.gz MPDIEWPANWMFLW-UHFFFAOYSA-N 0 0 359.436 3.746 20 5 FHBDRN O=C(c1ccc(F)cc1[N+](=O)[O-])N1CCO[C@@H](c2cccc(Cl)c2)C1 ZINC000186247425 946656485 /nfs/dbraw/zinc/65/64/85/946656485.db2.gz FVJKKWGTAQKDGK-MRXNPFEDSA-N 0 0 364.760 3.601 20 5 FHBDRN O=C(Nc1nc2ccccc2s1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088333038 946669778 /nfs/dbraw/zinc/66/97/78/946669778.db2.gz QHAXJVDPNBEBBF-UHFFFAOYSA-N 0 0 354.391 3.795 20 5 FHBDRN CC[C@H](CSC)NC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000475192874 946673479 /nfs/dbraw/zinc/67/34/79/946673479.db2.gz MWXLYRAUYRCMQB-MRVPVSSYSA-N 0 0 351.350 3.877 20 5 FHBDRN CCN(CCNC(=O)c1c(C)c(F)ccc1[N+](=O)[O-])c1ccccc1C ZINC000843767246 946688767 /nfs/dbraw/zinc/68/87/67/946688767.db2.gz CJVUEZXDHDEHCN-UHFFFAOYSA-N 0 0 359.401 3.607 20 5 FHBDRN O=C(Nc1cnc(-c2cccc(O)c2)nc1)c1cc([N+](=O)[O-])ccc1Cl ZINC000112115094 946689255 /nfs/dbraw/zinc/68/92/55/946689255.db2.gz HKMZZUDOQLZSJO-UHFFFAOYSA-N 0 0 370.752 3.663 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)Nc2cc(-c3cc(F)cc(F)c3)nn2C)c1 ZINC000487497587 946689403 /nfs/dbraw/zinc/68/94/03/946689403.db2.gz FFJHSTGYWORMMZ-UHFFFAOYSA-N 0 0 372.331 3.834 20 5 FHBDRN C[C@@H]1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2Br)C[C@H]1C ZINC000541636263 946692513 /nfs/dbraw/zinc/69/25/13/946692513.db2.gz QXXISCUFBYKIIS-GMTAPVOTSA-N 0 0 355.232 3.912 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](c1cccc(F)c1)c1ccccn1 ZINC000121430100 946705154 /nfs/dbraw/zinc/70/51/54/946705154.db2.gz SFVLIXIKMHHCSF-IBGZPJMESA-N 0 0 365.364 3.957 20 5 FHBDRN CCOc1ccc(OCC)c(NC(=O)c2cc(OC)ccc2[N+](=O)[O-])c1 ZINC000067538814 946709355 /nfs/dbraw/zinc/70/93/55/946709355.db2.gz VXHOWOVIOXDCOD-UHFFFAOYSA-N 0 0 360.366 3.653 20 5 FHBDRN C[C@H](Cc1ccc(O)cc1)NC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000151986269 946741072 /nfs/dbraw/zinc/74/10/72/946741072.db2.gz LKBHNLSKAFVZGI-SNVBAGLBSA-N 0 0 368.311 3.680 20 5 FHBDRN C[C@H](NC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)[C@@H]1CCCCO1 ZINC000475221241 946742450 /nfs/dbraw/zinc/74/24/50/946742450.db2.gz UPZAZYIMWCZMEG-ZANVPECISA-N 0 0 361.320 3.693 20 5 FHBDRN C[C@@H](NC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)[C@H]1CCCCO1 ZINC000475221235 946742542 /nfs/dbraw/zinc/74/25/42/946742542.db2.gz UPZAZYIMWCZMEG-NOZJJQNGSA-N 0 0 361.320 3.693 20 5 FHBDRN CC1(C)CN(C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CCS1 ZINC000475239628 946747415 /nfs/dbraw/zinc/74/74/15/946747415.db2.gz WVAPHAOKFQFSKH-UHFFFAOYSA-N 0 0 363.361 3.973 20 5 FHBDRN O=C(Nc1c(-c2cccnc2)nc2ccccn21)c1ccc([N+](=O)[O-])cc1 ZINC000440408966 946752116 /nfs/dbraw/zinc/75/21/16/946752116.db2.gz SEZIPRBTLVKOEH-UHFFFAOYSA-N 0 0 359.345 3.557 20 5 FHBDRN C[C@@H](NC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)[C@@H]1CCCOC1 ZINC000475232586 946755474 /nfs/dbraw/zinc/75/54/74/946755474.db2.gz JVEYTUHYOORJPE-NXEZZACHSA-N 0 0 361.320 3.550 20 5 FHBDRN COc1ccc(NC(=O)c2csc(Br)c2C)c([N+](=O)[O-])c1 ZINC000186641888 946770128 /nfs/dbraw/zinc/77/01/28/946770128.db2.gz KIGWHYOCHGEJKD-UHFFFAOYSA-N 0 0 371.212 3.988 20 5 FHBDRN CCc1c(C(=O)Nc2ccc([N+](=O)[O-])c(C)n2)cnn1-c1ccccc1C ZINC000186290552 946770547 /nfs/dbraw/zinc/77/05/47/946770547.db2.gz RLJQZGUHMKOJJW-UHFFFAOYSA-N 0 0 365.393 3.607 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])N[C@H]1CCC[C@@H]1Cc1ccccc1 ZINC000609975991 946773312 /nfs/dbraw/zinc/77/33/12/946773312.db2.gz QTZXQCJOVUZAIQ-MSOLQXFVSA-N 0 0 368.433 3.891 20 5 FHBDRN CCOC(=O)c1cc(C(=O)N(C)[C@@H](C)c2ccccc2F)cc([N+](=O)[O-])c1 ZINC000121454092 946775777 /nfs/dbraw/zinc/77/57/77/946775777.db2.gz OZYVMNNKUVABKY-LBPRGKRZSA-N 0 0 374.368 3.744 20 5 FHBDRN C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1cc(=O)[nH]c2ccc(F)cc21 ZINC000523113367 946789045 /nfs/dbraw/zinc/78/90/45/946789045.db2.gz NKERTQCWYGDHQQ-SNVBAGLBSA-N 0 0 367.336 3.579 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H](c1ccccc1C)C(C)C ZINC000112222048 946803923 /nfs/dbraw/zinc/80/39/23/946803923.db2.gz DVFWFWSUEYEITG-GOSISDBHSA-N 0 0 369.421 3.664 20 5 FHBDRN CCOc1ncc(C(=O)N2c3ccc([N+](=O)[O-])cc3C[C@@H]2C)cc1Cl ZINC000112234769 946811279 /nfs/dbraw/zinc/81/12/79/946811279.db2.gz DWDYHUNYXGREFL-JTQLQIEISA-N 0 0 361.785 3.633 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)NCc2ccc(Cl)s2)cc1OC ZINC000025911786 946821993 /nfs/dbraw/zinc/82/19/93/946821993.db2.gz KOYYHYLHEMKWCW-UHFFFAOYSA-N 0 0 370.814 3.647 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N[C@H](c2ccccc2)C(F)(F)F)c1 ZINC000067549344 946827288 /nfs/dbraw/zinc/82/72/88/946827288.db2.gz VMCQUHFGVNQJDY-CQSZACIVSA-N 0 0 354.284 3.637 20 5 FHBDRN O=[N+]([O-])c1ccc(NCc2cc(Br)cs2)c([N+](=O)[O-])c1 ZINC000048564088 946840338 /nfs/dbraw/zinc/84/03/38/946840338.db2.gz AHLDQLWSLCVFJY-UHFFFAOYSA-N 0 0 358.173 3.939 20 5 FHBDRN O=[N+]([O-])c1ccc(NCc2cc3c(c(Br)c2)OCO3)s1 ZINC000049100035 946865738 /nfs/dbraw/zinc/86/57/38/946865738.db2.gz OFPRDFJCANRWJI-UHFFFAOYSA-N 0 0 357.185 3.760 20 5 FHBDRN Cc1cc(NC(=O)CO[C@@H]2CCC[C@@H](C)C2)n(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000261483974 946865895 /nfs/dbraw/zinc/86/58/95/946865895.db2.gz YSLFKSVJHWFOPV-CXAGYDPISA-N 0 0 372.425 3.623 20 5 FHBDRN Cc1nn(-c2ccccc2)cc1C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186316240 946876319 /nfs/dbraw/zinc/87/63/19/946876319.db2.gz URLSJTBWBPWDEJ-UHFFFAOYSA-N 0 0 370.796 3.672 20 5 FHBDRN C[C@H](NC(=O)N1CCC(c2nccs2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000458884542 946877220 /nfs/dbraw/zinc/87/72/20/946877220.db2.gz DEVWJXYDVYCSQP-LBPRGKRZSA-N 0 0 360.439 3.702 20 5 FHBDRN C[C@H](CCCC(F)(F)F)NC(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000511905542 946909654 /nfs/dbraw/zinc/90/96/54/946909654.db2.gz ZEWUAZUXOBZCAU-GFCCVEGCSA-N 0 0 361.364 3.900 20 5 FHBDRN CO[C@H](C(=O)NCc1cccc([N+](=O)[O-])c1)c1ccccc1C(F)(F)F ZINC001126173028 946910045 /nfs/dbraw/zinc/91/00/45/946910045.db2.gz RLBKJJFORWHYQG-HNNXBMFYSA-N 0 0 368.311 3.618 20 5 FHBDRN C[C@@H]1[C@@H](C(=O)N2c3ccc([N+](=O)[O-])cc3C[C@@H]2C)CCN1c1ccccc1 ZINC000475341675 946911484 /nfs/dbraw/zinc/91/14/84/946911484.db2.gz DMEODHXCGMANKI-KHYOSLBOSA-N 0 0 365.433 3.787 20 5 FHBDRN COc1cccc(NC(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)c1 ZINC000485615258 946912810 /nfs/dbraw/zinc/91/28/10/946912810.db2.gz OCAVFWDRMLDZJZ-UHFFFAOYSA-N 0 0 369.299 3.944 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1C[C@H]1c1cccc(F)c1F ZINC000186324363 946913069 /nfs/dbraw/zinc/91/30/69/946913069.db2.gz NMLVPTHTLSMWKW-QWHCGFSZSA-N 0 0 366.751 3.946 20 5 FHBDRN COc1cc(N2CCC[C@H](c3nc(C)cs3)C2)c([N+](=O)[O-])cc1F ZINC000123876161 946915823 /nfs/dbraw/zinc/91/58/23/946915823.db2.gz IGAKGYOXVNLECP-NSHDSACASA-N 0 0 351.403 3.891 20 5 FHBDRN C[C@@H](NC(=O)c1ccc(F)cc1[N+](=O)[O-])c1cccc(OC(F)F)c1 ZINC000121267511 946918705 /nfs/dbraw/zinc/91/87/05/946918705.db2.gz UHYBEDGUSUIRQY-SECBINFHSA-N 0 0 354.284 3.826 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1)CN(c1cncc(-c3cccs3)n1)CCO2 ZINC000549581163 946919137 /nfs/dbraw/zinc/91/91/37/946919137.db2.gz NDHCPAPLHMPFKH-UHFFFAOYSA-N 0 0 354.391 3.512 20 5 FHBDRN O=C1CCCC(=O)N1c1cccc(NC/C=C\c2ccccc2[N+](=O)[O-])c1 ZINC000475350838 946924846 /nfs/dbraw/zinc/92/48/46/946924846.db2.gz ZHADULPRDVHZMC-ALCCZGGFSA-N 0 0 365.389 3.764 20 5 FHBDRN Cc1c(F)ccc([N+](=O)[O-])c1C(=O)N1CCC(N(C)c2ccccc2)CC1 ZINC000843771438 946927486 /nfs/dbraw/zinc/92/74/86/946927486.db2.gz HWILTNVEIKGRKD-UHFFFAOYSA-N 0 0 371.412 3.783 20 5 FHBDRN CCOC(=O)C1CCC(O)(COc2ccc([N+](=O)[O-])c3ccccc23)CC1 ZINC000432247059 946930691 /nfs/dbraw/zinc/93/06/91/946930691.db2.gz QJYRSELVLASKSB-UHFFFAOYSA-N 0 0 373.405 3.611 20 5 FHBDRN COc1cccc(SCC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000186333516 946936199 /nfs/dbraw/zinc/93/61/99/946936199.db2.gz YVIPGNVTAWVQAW-UHFFFAOYSA-N 0 0 366.826 3.665 20 5 FHBDRN CCOc1ccc(F)c(NC(=O)N(C)Cc2ccccc2[N+](=O)[O-])c1F ZINC000536289699 946950951 /nfs/dbraw/zinc/95/09/51/946950951.db2.gz FBOITHFSKFUKDT-UHFFFAOYSA-N 0 0 365.336 3.936 20 5 FHBDRN CCN(Cc1c([N+](=O)[O-])ncn1C)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000475365738 946951170 /nfs/dbraw/zinc/95/11/70/946951170.db2.gz SBENSOPKSRHCDM-NSHDSACASA-N 0 0 356.348 3.930 20 5 FHBDRN Cc1cc(C(=O)N2CCC(Nc3ccc(F)cc3)CC2)ccc1[N+](=O)[O-] ZINC000143406271 946952481 /nfs/dbraw/zinc/95/24/81/946952481.db2.gz LTVSXBWOWHOSOY-UHFFFAOYSA-N 0 0 357.385 3.759 20 5 FHBDRN CCn1c2ccc(F)cc2nc1Cn1nc(C)c2cc([N+](=O)[O-])ccc21 ZINC000432249850 946955553 /nfs/dbraw/zinc/95/55/53/946955553.db2.gz GHYZEIIOXJPYIX-UHFFFAOYSA-N 0 0 353.357 3.810 20 5 FHBDRN COc1c(OS(=O)(=O)Cc2cccc([N+](=O)[O-])c2)ccc2ccccc21 ZINC001211896435 946958815 /nfs/dbraw/zinc/95/88/15/946958815.db2.gz CLUKISSTPIENIF-UHFFFAOYSA-N 0 0 373.386 3.665 20 5 FHBDRN O=[N+]([O-])c1cc(Br)cnc1N1CCC[C@@H](C(F)(F)F)C1 ZINC000088437481 946968573 /nfs/dbraw/zinc/96/85/73/946968573.db2.gz FUMJRQVMTNIIOH-SSDOTTSWSA-N 0 0 354.126 3.531 20 5 FHBDRN Cc1cccc(C(=O)N2CCC(Nc3ccc(F)cc3)CC2)c1[N+](=O)[O-] ZINC000143422965 946968707 /nfs/dbraw/zinc/96/87/07/946968707.db2.gz OZZFYCMNRGUIGB-UHFFFAOYSA-N 0 0 357.385 3.759 20 5 FHBDRN Cc1ccc(NC(=O)C(=O)N[C@H](CC(C)C)c2ccccc2)cc1[N+](=O)[O-] ZINC000048975697 946989652 /nfs/dbraw/zinc/98/96/52/946989652.db2.gz WFCKXCUMTBMIAH-QGZVFWFLSA-N 0 0 369.421 3.745 20 5 FHBDRN C[C@@H]1CCCN(C(=O)c2ccc(N3C[C@H](C)C[C@@H](C)C3)c([N+](=O)[O-])c2)C1 ZINC000025967728 946998044 /nfs/dbraw/zinc/99/80/44/946998044.db2.gz BCJIMJBZBQIPPD-BZUAXINKSA-N 0 0 359.470 3.949 20 5 FHBDRN COC(=O)[C@@H]1c2ccccc2CCN1Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783571490 947000262 /nfs/dbraw/zinc/00/02/62/947000262.db2.gz FCNPTIBARJVAID-KRWDZBQOSA-N 0 0 360.797 3.521 20 5 FHBDRN COC1CCN(C(=O)c2ccccc2Sc2ccccc2[N+](=O)[O-])CC1 ZINC000440451678 947000197 /nfs/dbraw/zinc/00/01/97/947000197.db2.gz JLHWGZXMQJCLIB-UHFFFAOYSA-N 0 0 372.446 3.997 20 5 FHBDRN COC(=O)c1cc(NC(=O)CCc2cccc([N+](=O)[O-])c2)ccc1Cl ZINC000087061125 947000929 /nfs/dbraw/zinc/00/09/29/947000929.db2.gz JVSULSVVTFLCCM-UHFFFAOYSA-N 0 0 362.769 3.606 20 5 FHBDRN Cc1nn(CCC(=O)N[C@@H](CC(C)C)c2ccccc2)c(C)c1[N+](=O)[O-] ZINC000523227967 947011127 /nfs/dbraw/zinc/01/11/27/947011127.db2.gz ZWKFZBGWSJMZKG-KRWDZBQOSA-N 0 0 358.442 3.702 20 5 FHBDRN CC(C)(C)Oc1cc(N[C@@H]2CCOC23CCOCC3)ccc1[N+](=O)[O-] ZINC000897326924 947011207 /nfs/dbraw/zinc/01/12/07/947011207.db2.gz UNNIMAGKWPEMTR-MRXNPFEDSA-N 0 0 350.415 3.522 20 5 FHBDRN O=C(c1cc2c(cccc2F)s1)N1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000785307518 947015077 /nfs/dbraw/zinc/01/50/77/947015077.db2.gz RRAVAOQJZYHFNP-UHFFFAOYSA-N 0 0 374.397 3.622 20 5 FHBDRN Cc1ccc(S(=O)(=O)N2CC3(CCC3)[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000432268524 947022493 /nfs/dbraw/zinc/02/24/93/947022493.db2.gz OTLARAFBUHSHJN-SFHVURJKSA-N 0 0 372.446 3.819 20 5 FHBDRN CC(=O)Nc1ccc(NC(=O)CSc2ccc([N+](=O)[O-])cc2)cc1C ZINC000893540971 947023688 /nfs/dbraw/zinc/02/36/88/947023688.db2.gz NXILBDCBAFKLPE-UHFFFAOYSA-N 0 0 359.407 3.592 20 5 FHBDRN CC(C)[C@H](NC(=O)c1cc([N+](=O)[O-])nn1C)c1ccc(C(C)(C)C)cc1 ZINC000511930333 947029107 /nfs/dbraw/zinc/02/91/07/947029107.db2.gz OEHIBZUSFYWKDH-KRWDZBQOSA-N 0 0 358.442 3.753 20 5 FHBDRN O=C(CCC(=O)c1cccs1)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186352294 947029180 /nfs/dbraw/zinc/02/91/80/947029180.db2.gz FYGAONDKZOQSII-UHFFFAOYSA-N 0 0 352.799 3.589 20 5 FHBDRN Cc1ccccc1[C@@H](CC(F)(F)F)NC(=O)c1cccc([N+](=O)[O-])c1N ZINC000444621216 947054054 /nfs/dbraw/zinc/05/40/54/947054054.db2.gz BBFFGMCFXYYDTR-CYBMUJFWSA-N 0 0 367.327 3.909 20 5 FHBDRN COc1ccccc1[C@@H]1CCN(c2ncnc3cccc([N+](=O)[O-])c32)C1 ZINC000544393335 947058535 /nfs/dbraw/zinc/05/85/35/947058535.db2.gz JACVULIVAQGYOE-CYBMUJFWSA-N 0 0 350.378 3.541 20 5 FHBDRN CC[C@@H](C)Oc1ccc(C(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000444628647 947059191 /nfs/dbraw/zinc/05/91/91/947059191.db2.gz DIPSCTZRJSJQEO-GFCCVEGCSA-N 0 0 368.393 3.578 20 5 FHBDRN C[C@H](C(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1cc2ccccc2o1 ZINC000444634019 947063773 /nfs/dbraw/zinc/06/37/73/947063773.db2.gz WVZDZQSKUBHTJI-NSHDSACASA-N 0 0 364.361 3.637 20 5 FHBDRN O=C(C[C@H]1CCCc2ccccc21)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444633613 947064483 /nfs/dbraw/zinc/06/44/83/947064483.db2.gz DDOZHRAGDVDCMI-CQSZACIVSA-N 0 0 364.405 3.598 20 5 FHBDRN C[C@H](C(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1cccc(Cl)c1 ZINC000444634286 947065757 /nfs/dbraw/zinc/06/57/57/947065757.db2.gz YHSBNGUBEQDMKO-JTQLQIEISA-N 0 0 358.785 3.544 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N(C)[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000074446258 947067635 /nfs/dbraw/zinc/06/76/35/947067635.db2.gz DZCINNLKZWNAHI-IBGZPJMESA-N 0 0 367.449 3.640 20 5 FHBDRN Cc1ccc(C(=O)COc2ccc(Br)cc2[N+](=O)[O-])cc1 ZINC000088086704 947072031 /nfs/dbraw/zinc/07/20/31/947072031.db2.gz KVCMXYHCZFENFA-UHFFFAOYSA-N 0 0 350.168 3.927 20 5 FHBDRN O=[N+]([O-])c1ccc(NCc2cc(F)cc3c2OCOC3)c2ccncc21 ZINC000523296898 947074273 /nfs/dbraw/zinc/07/42/73/947074273.db2.gz PMBUHHKGECWVQV-UHFFFAOYSA-N 0 0 355.325 3.761 20 5 FHBDRN CCS[C@@H]1CCC[C@@H]1NC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000182291737 947081409 /nfs/dbraw/zinc/08/14/09/947081409.db2.gz PJBLKVGZDULGPF-WCQYABFASA-N 0 0 360.382 3.600 20 5 FHBDRN COCCc1ccnc(NCc2csc(-c3cccc([N+](=O)[O-])c3)n2)c1 ZINC000508503589 947082559 /nfs/dbraw/zinc/08/25/59/947082559.db2.gz IOKWSNUKFPYELU-UHFFFAOYSA-N 0 0 370.434 3.914 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]c(CN3CCC[C@H](Nc4ccccc4)C3)nc2c1 ZINC000444664683 947090919 /nfs/dbraw/zinc/09/09/19/947090919.db2.gz OHSBPTSEPWTYFU-HNNXBMFYSA-N 0 0 351.410 3.548 20 5 FHBDRN C[C@@H](c1ccccc1F)N(C)C(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000049653514 947102572 /nfs/dbraw/zinc/10/25/72/947102572.db2.gz LBKICCVHIODRJH-ZDUSSCGKSA-N 0 0 368.368 3.753 20 5 FHBDRN CCOc1ccc([C@@H](C)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1OC ZINC000444682937 947107351 /nfs/dbraw/zinc/10/73/51/947107351.db2.gz CAKPFQCKXRSSRO-GFCCVEGCSA-N 0 0 370.409 3.729 20 5 FHBDRN COc1ccc(C(=O)N(C)Cc2ccc(F)c(Cl)c2)cc1[N+](=O)[O-] ZINC000432287799 947111888 /nfs/dbraw/zinc/11/18/88/947111888.db2.gz VFOLGNLOMFYWDM-UHFFFAOYSA-N 0 0 352.749 3.668 20 5 FHBDRN Cc1sc(C(=O)Nc2cc(-c3cc(F)cc(F)c3)[nH]n2)cc1[N+](=O)[O-] ZINC000467723448 947124037 /nfs/dbraw/zinc/12/40/37/947124037.db2.gz OWODIVRCKRAHLA-UHFFFAOYSA-N 0 0 364.333 3.885 20 5 FHBDRN CN(CC1(c2ccccc2)CC1)C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000444361554 947129809 /nfs/dbraw/zinc/12/98/09/947129809.db2.gz CLDMWRIVCDVSTG-UHFFFAOYSA-N 0 0 365.433 3.973 20 5 FHBDRN COc1ccc(CSCC(=O)N2CCC[C@H](C(C)C)C2)cc1[N+](=O)[O-] ZINC000444359268 947130755 /nfs/dbraw/zinc/13/07/55/947130755.db2.gz BKVOKUBQQKAZAI-HNNXBMFYSA-N 0 0 366.483 3.731 20 5 FHBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CC3(CCC3)[C@@H]2c2ccccc2)s1 ZINC000432299410 947175017 /nfs/dbraw/zinc/17/50/17/947175017.db2.gz DOWZLQYFIHQLNL-HNNXBMFYSA-N 0 0 364.448 3.572 20 5 FHBDRN CC(C)(C)c1ccc(S(=O)(=O)N2CCc3c2cccc3[N+](=O)[O-])cc1 ZINC000523417232 947246708 /nfs/dbraw/zinc/24/67/08/947246708.db2.gz WJRYZSGALMFBDX-UHFFFAOYSA-N 0 0 360.435 3.644 20 5 FHBDRN C[C@@H](c1ccc(Cl)c(Cl)c1)N(C)C(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC000444849688 947261787 /nfs/dbraw/zinc/26/17/87/947261787.db2.gz OBVDUVYQQLNMOA-QMMMGPOBSA-N 0 0 370.192 3.835 20 5 FHBDRN Cc1ccccc1CNC(=O)c1sc(Br)cc1[N+](=O)[O-] ZINC000444830837 947263021 /nfs/dbraw/zinc/26/30/21/947263021.db2.gz YVLYSSZKYQTJNX-UHFFFAOYSA-N 0 0 355.213 3.657 20 5 FHBDRN CN(Cc1ccccc1)C(=O)c1sc(Br)cc1[N+](=O)[O-] ZINC000444831274 947263548 /nfs/dbraw/zinc/26/35/48/947263548.db2.gz ZHSXYXQRXJRMKP-UHFFFAOYSA-N 0 0 355.213 3.691 20 5 FHBDRN CCOC(=O)Cc1cccc(NC(=O)Nc2cccc([N+](=O)[O-])c2C)c1 ZINC000523438327 947266513 /nfs/dbraw/zinc/26/65/13/947266513.db2.gz XYVXTLGRSKMOJC-UHFFFAOYSA-N 0 0 357.366 3.653 20 5 FHBDRN O=C(NC1CC1)c1ccc(N2CCC[C@@]3(CC=CCC3)C2)c([N+](=O)[O-])c1 ZINC000301307452 947277409 /nfs/dbraw/zinc/27/74/09/947277409.db2.gz ZJAUNPLFFLFYLP-FQEVSTJZSA-N 0 0 355.438 3.814 20 5 FHBDRN CCC[C@H](C)c1cc(=NC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)[nH][nH]1 ZINC000439898728 947278639 /nfs/dbraw/zinc/27/86/39/947278639.db2.gz GJVWRFVJSVOQJV-RYUDHWBXSA-N 0 0 362.455 3.763 20 5 FHBDRN COc1ccccc1[C@@H]1CCN(C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000523489125 947306025 /nfs/dbraw/zinc/30/60/25/947306025.db2.gz SERXBQXYLVSFOZ-OAHLLOKOSA-N 0 0 368.433 3.897 20 5 FHBDRN CC(C)(C(=O)Nc1nc(-c2ccc[nH]2)cs1)c1ccc([N+](=O)[O-])cc1 ZINC000523497198 947315659 /nfs/dbraw/zinc/31/56/59/947315659.db2.gz QWHNNYILTHPOKS-UHFFFAOYSA-N 0 0 356.407 3.963 20 5 FHBDRN COCCOc1ccc(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])c(C)c1 ZINC000121507597 947321129 /nfs/dbraw/zinc/32/11/29/947321129.db2.gz KGONGLZUGQYYCI-UHFFFAOYSA-N 0 0 364.785 3.834 20 5 FHBDRN Cc1cccnc1C(F)(F)C(=O)OCc1cc([N+](=O)[O-])ccc1Cl ZINC000783585329 947326434 /nfs/dbraw/zinc/32/64/34/947326434.db2.gz FSSBMCSUFTZQKM-UHFFFAOYSA-N 0 0 356.712 3.787 20 5 FHBDRN CNC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccc(-c2ccncc2)cc1 ZINC000523513707 947326590 /nfs/dbraw/zinc/32/65/90/947326590.db2.gz UQFRHIPNVRBHQH-UHFFFAOYSA-N 0 0 362.389 3.629 20 5 FHBDRN O=c1[nH]cnc2cc(NCc3ccc(-c4ccncc4)cc3)c([N+](=O)[O-])cc21 ZINC000523515176 947326818 /nfs/dbraw/zinc/32/68/18/947326818.db2.gz VHJWEDIKRSNZHI-UHFFFAOYSA-N 0 0 373.372 3.918 20 5 FHBDRN Cc1ccc(-n2nc(C(C)C)cc2NC(=O)c2cc([N+](=O)[O-])c[nH]2)cc1 ZINC000523513681 947326938 /nfs/dbraw/zinc/32/69/38/947326938.db2.gz SPSDZWWIFNRZBJ-UHFFFAOYSA-N 0 0 353.382 3.793 20 5 FHBDRN Cc1nn(C)c(-c2nc(-c3ccc(Cl)c(Cl)c3)no2)c1[N+](=O)[O-] ZINC000546243380 947330622 /nfs/dbraw/zinc/33/06/22/947330622.db2.gz BANOZUKWDIZKTB-UHFFFAOYSA-N 0 0 354.153 3.661 20 5 FHBDRN O=C(Nc1ccc(O[C@H]2CCOC2)cc1)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000523503810 947335143 /nfs/dbraw/zinc/33/51/43/947335143.db2.gz MQOVYHDMTYVSOD-INIZCTEOSA-N 0 0 368.345 3.761 20 5 FHBDRN C[C@H]1CCC[C@H](C)C1NC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000523504166 947335318 /nfs/dbraw/zinc/33/53/18/947335318.db2.gz ICNWOHUWFNXDHU-UWVGGRQHSA-N 0 0 355.232 3.912 20 5 FHBDRN CC(C)Oc1cc(C(=O)NCc2ccc3ncccc3c2)ccc1[N+](=O)[O-] ZINC001271527292 947341463 /nfs/dbraw/zinc/34/14/63/947341463.db2.gz GZIMMHJIRMSCNO-UHFFFAOYSA-N 0 0 365.389 3.860 20 5 FHBDRN Cc1ncc(-c2ccccc2)cc1NC(=O)COc1cccc([N+](=O)[O-])c1 ZINC000536317692 947345288 /nfs/dbraw/zinc/34/52/88/947345288.db2.gz APWYDSRDVZUMCS-UHFFFAOYSA-N 0 0 363.373 3.983 20 5 FHBDRN O=[N+]([O-])c1nn(Cc2ccccc2C(F)(F)F)cc1Br ZINC000383468080 947349437 /nfs/dbraw/zinc/34/94/37/947349437.db2.gz QARDTVZNJIGZHD-UHFFFAOYSA-N 0 0 350.094 3.621 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NCc1c(F)cccc1Cl ZINC000444938321 947360669 /nfs/dbraw/zinc/36/06/69/947360669.db2.gz XITZLFZSVNLNOM-UHFFFAOYSA-N 0 0 353.737 3.718 20 5 FHBDRN Cc1ccccc1[C@@H](CC(F)(F)F)NC(=O)Nc1ccncc1[N+](=O)[O-] ZINC000444939542 947362654 /nfs/dbraw/zinc/36/26/54/947362654.db2.gz BIWSWUOSBRXZBX-CYBMUJFWSA-N 0 0 368.315 3.535 20 5 FHBDRN Cc1nc(-c2ccsc2)ccc1C(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000523540322 947372248 /nfs/dbraw/zinc/37/22/48/947372248.db2.gz OYVAIWPEKOWASQ-UHFFFAOYSA-N 0 0 353.403 3.957 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])N1CC2(CCC2)c2c1cccc2F ZINC000523571591 947381759 /nfs/dbraw/zinc/38/17/59/947381759.db2.gz QJFGHQGCLNITBI-UHFFFAOYSA-N 0 0 370.380 3.971 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1[C@H]2Cc3ccccc3[C@@H]12 ZINC000248387238 947389385 /nfs/dbraw/zinc/38/93/85/947389385.db2.gz APPOEKFOXKOOOS-ZVEHZALQSA-N 0 0 350.418 3.618 20 5 FHBDRN CC(C)[C@H]1N(C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)CC12CCCC2 ZINC000457181129 947394229 /nfs/dbraw/zinc/39/42/29/947394229.db2.gz XFESBLDFZUXVSI-GOSISDBHSA-N 0 0 368.437 3.821 20 5 FHBDRN O=C(NC1(c2nccs2)CCCC1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000121518846 947395240 /nfs/dbraw/zinc/39/52/40/947395240.db2.gz CIHLUKQMTVNCOJ-UHFFFAOYSA-N 0 0 351.815 3.904 20 5 FHBDRN Cn1cc([N+](=O)[O-])cc1-c1nc(-c2cc(F)cc(Br)c2)no1 ZINC000546271815 947404738 /nfs/dbraw/zinc/40/47/38/947404738.db2.gz HVMKQCLNKMKPOL-UHFFFAOYSA-N 0 0 367.134 3.552 20 5 FHBDRN C[C@H](C(=O)O[C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)c1cccc(F)c1 ZINC000759931672 947407752 /nfs/dbraw/zinc/40/77/52/947407752.db2.gz LTEHCQBCQGKCRG-VBNZEHGJSA-N 0 0 361.373 3.761 20 5 FHBDRN CC(C)(Oc1ccc(F)cc1)C(=O)Nc1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000440631060 947413896 /nfs/dbraw/zinc/41/38/96/947413896.db2.gz VGGCKGZECLISFS-UHFFFAOYSA-N 0 0 369.352 3.500 20 5 FHBDRN O=C(N=c1cc(C2CCCC2)[nH][nH]1)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000445014122 947414522 /nfs/dbraw/zinc/41/45/22/947414522.db2.gz WMDFCWOLCSOCSN-UHFFFAOYSA-N 0 0 372.428 3.736 20 5 FHBDRN Cc1ccc(C(=O)N2C[C@@H](c3ccc(F)cc3)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000152065093 947417518 /nfs/dbraw/zinc/41/75/18/947417518.db2.gz MFFKXOXWKSGYJT-UGSOOPFHSA-N 0 0 358.369 3.645 20 5 FHBDRN Cc1c(F)ccc([N+](=O)[O-])c1C(=O)NCCCCN(C)c1ccccc1 ZINC000843772125 947421089 /nfs/dbraw/zinc/42/10/89/947421089.db2.gz SOVDCXYQQXVYRH-UHFFFAOYSA-N 0 0 359.401 3.689 20 5 FHBDRN CCCN(C(=O)c1ccc(NC(C)=O)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000441445120 947454625 /nfs/dbraw/zinc/45/46/25/947454625.db2.gz IEGBLOMCWZXASY-UHFFFAOYSA-N 0 0 359.357 3.749 20 5 FHBDRN O=C(Cc1ccc(F)cc1F)OCc1cnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000152069029 947456123 /nfs/dbraw/zinc/45/61/23/947456123.db2.gz NZVODJDQWCLDBD-UHFFFAOYSA-N 0 0 374.299 3.814 20 5 FHBDRN Cc1cn(-c2ccccc2)nc1NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000120325952 947486374 /nfs/dbraw/zinc/48/63/74/947486374.db2.gz CRIYTBURWDNPTL-UHFFFAOYSA-N 0 0 356.769 3.995 20 5 FHBDRN O=C(COc1ccc(Cl)c(Cl)c1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000021377876 947499849 /nfs/dbraw/zinc/49/98/49/947499849.db2.gz BYHZJOAYSIDROS-UHFFFAOYSA-N 0 0 367.188 3.870 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CC2(CCC2)[C@@H]1c1ccccc1 ZINC000432301255 947507207 /nfs/dbraw/zinc/50/72/07/947507207.db2.gz IJTMZALADCFUFS-SFHVURJKSA-N 0 0 372.446 3.819 20 5 FHBDRN CCNC(=O)c1cccc(NC(=O)c2c(C)cc(C)c([N+](=O)[O-])c2C)c1 ZINC000093906662 947512401 /nfs/dbraw/zinc/51/24/01/947512401.db2.gz CHKCMDIUQVFKQS-UHFFFAOYSA-N 0 0 355.394 3.522 20 5 FHBDRN CC(C)[C@@H]1CCCN(S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000523705688 947516279 /nfs/dbraw/zinc/51/62/79/947516279.db2.gz XLHUPTBYKPJADQ-GFCCVEGCSA-N 0 0 360.863 3.695 20 5 FHBDRN C[C@@H](CCC1CCCCC1)NC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000523709317 947519311 /nfs/dbraw/zinc/51/93/11/947519311.db2.gz ODRJPWNPCXSZMI-AWEZNQCLSA-N 0 0 371.441 3.654 20 5 FHBDRN O=C(O[C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)c1cccc(F)c1Cl ZINC000759932185 947522203 /nfs/dbraw/zinc/52/22/03/947522203.db2.gz MXXYSAYPNDVVHV-QWHCGFSZSA-N 0 0 367.764 3.925 20 5 FHBDRN O=C(N[C@H](C1CC1)C1CCC1)c1ccc([N+](=O)[O-])cc1Br ZINC000457220854 947524118 /nfs/dbraw/zinc/52/41/18/947524118.db2.gz CQSYDWDNDHGSCO-AWEZNQCLSA-N 0 0 353.216 3.666 20 5 FHBDRN CC(C)N(Cc1ccccc1)C(=O)[C@H](C)Oc1cc(F)ccc1[N+](=O)[O-] ZINC000021390102 947528236 /nfs/dbraw/zinc/52/82/36/947528236.db2.gz XSBXBMCZIDVPGN-AWEZNQCLSA-N 0 0 360.385 3.938 20 5 FHBDRN CCO[C@H]1C[C@H](N(C)C(=O)c2cc([N+](=O)[O-])c(C)s2)C12CCCC2 ZINC000150787107 947549888 /nfs/dbraw/zinc/54/98/88/947549888.db2.gz LLBMGTKNPLNFFC-GJZGRUSLSA-N 0 0 352.456 3.775 20 5 FHBDRN Cc1cccc([C@@H](C)NS(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])c1C ZINC000523734405 947554713 /nfs/dbraw/zinc/55/47/13/947554713.db2.gz RHJHHWOPQYLMEB-GFCCVEGCSA-N 0 0 368.842 3.905 20 5 FHBDRN O=C(CSC1CCCCC1)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2 ZINC000053849854 947560291 /nfs/dbraw/zinc/56/02/91/947560291.db2.gz ITDFDFQQHZWYAM-UHFFFAOYSA-N 0 0 366.439 3.761 20 5 FHBDRN Cc1ccnc(NCCc2ccc(F)c(Br)c2)c1[N+](=O)[O-] ZINC000523755399 947571396 /nfs/dbraw/zinc/57/13/96/947571396.db2.gz XPEFQDBBNBQLKN-UHFFFAOYSA-N 0 0 354.179 3.854 20 5 FHBDRN Cc1cc(S(=O)(=O)NCc2csc3ccccc23)ccc1[N+](=O)[O-] ZINC000523757715 947573160 /nfs/dbraw/zinc/57/31/60/947573160.db2.gz WJSHOUOYEWSSSJ-UHFFFAOYSA-N 0 0 362.432 3.596 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CCc1nc(Cc2ccc(C(C)(C)C)cc2)no1 ZINC000445181135 947574395 /nfs/dbraw/zinc/57/43/95/947574395.db2.gz DAADPQRKXQLNMQ-UHFFFAOYSA-N 0 0 369.425 3.614 20 5 FHBDRN CCN([C@H](C)c1ccc(F)cc1)S(=O)(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000523757055 947574548 /nfs/dbraw/zinc/57/45/48/947574548.db2.gz WWQOOTFBAUHFSY-CYBMUJFWSA-N 0 0 366.414 3.814 20 5 FHBDRN CN(C)c1cccc(CNC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)c1 ZINC000445186245 947579016 /nfs/dbraw/zinc/57/90/16/947579016.db2.gz LROIEADCUOZEID-UHFFFAOYSA-N 0 0 371.440 3.677 20 5 FHBDRN CN(Cc1cn(C)nc1C(F)(F)F)c1ccc([N+](=O)[O-])c2cnccc21 ZINC000127621844 947584192 /nfs/dbraw/zinc/58/41/92/947584192.db2.gz SRHOUDCPYOQRJY-UHFFFAOYSA-N 0 0 365.315 3.532 20 5 FHBDRN O=[N+]([O-])c1ccc(Cc2noc(-c3ccccc3C(F)(F)F)n2)nc1 ZINC000445229801 947610486 /nfs/dbraw/zinc/61/04/86/947610486.db2.gz CZPSEXUQEHPDDN-UHFFFAOYSA-N 0 0 350.256 3.649 20 5 FHBDRN C[C@@H]1CC(=O)CC[C@H]1c1nc(Cc2c[nH]c3ccc([N+](=O)[O-])cc23)no1 ZINC000445232662 947612509 /nfs/dbraw/zinc/61/25/09/947612509.db2.gz BPGSJUKKMAHWKH-QMTHXVAHSA-N 0 0 354.366 3.523 20 5 FHBDRN O=[N+]([O-])c1ccc(Cc2noc(Cc3ccoc3)n2)c(Br)c1 ZINC000445235588 947630560 /nfs/dbraw/zinc/63/05/60/947630560.db2.gz OMLKUDJYYJQAKA-UHFFFAOYSA-N 0 0 364.155 3.515 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])c(Cl)c1)N1CCC[C@H]1c1ccc2c(c1)OCO2 ZINC000136906755 947641989 /nfs/dbraw/zinc/64/19/89/947641989.db2.gz UWIGOXXLYCALAF-AWEZNQCLSA-N 0 0 374.780 3.954 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1C(=O)OCC(=O)N(c1ccccc1)C(C)C ZINC000026113140 947650155 /nfs/dbraw/zinc/65/01/55/947650155.db2.gz DWVRUFVNHRDYRV-UHFFFAOYSA-N 0 0 356.378 3.502 20 5 FHBDRN CC[C@@H](C)c1ccc(NC(=O)Cc2noc(-c3ccc([N+](=O)[O-])[nH]3)n2)cc1 ZINC000445271971 947653663 /nfs/dbraw/zinc/65/36/63/947653663.db2.gz GJXRNJQDJUYHPP-LLVKDONJSA-N 0 0 369.381 3.668 20 5 FHBDRN O=C(C[C@@H]1CCc2ccccc21)O[C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1 ZINC000759934997 947671705 /nfs/dbraw/zinc/67/17/05/947671705.db2.gz RDSZYALYHFODRC-RYQLBKOJSA-N 0 0 369.421 3.938 20 5 FHBDRN Cc1cccc(C)c1OCC(=O)O[C@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1 ZINC000759936676 947674361 /nfs/dbraw/zinc/67/43/61/947674361.db2.gz FVURIXVSQWPZIJ-HOTGVXAUSA-N 0 0 373.409 3.514 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])N1CC2(CCC2)c2c1cccc2F ZINC000523856746 947687340 /nfs/dbraw/zinc/68/73/40/947687340.db2.gz UBSAZUZTEJGTOR-UHFFFAOYSA-N 0 0 355.369 3.614 20 5 FHBDRN Cc1cc(C)cc(OCC(=O)O[C@@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)c1 ZINC000759936059 947691649 /nfs/dbraw/zinc/69/16/49/947691649.db2.gz DRSOCCYDPZQCID-IAGOWNOFSA-N 0 0 373.409 3.514 20 5 FHBDRN CCOc1cnc(-c2noc([C@@H](C)Sc3ccc([N+](=O)[O-])cc3)n2)cn1 ZINC000445307690 947693588 /nfs/dbraw/zinc/69/35/88/947693588.db2.gz OLSBPYNOAVYTDO-SNVBAGLBSA-N 0 0 373.394 3.687 20 5 FHBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])Nc1cc(F)cc(F)c1 ZINC000523879366 947704715 /nfs/dbraw/zinc/70/47/15/947704715.db2.gz FYFPEISRZIHGMK-UHFFFAOYSA-N 0 0 356.712 3.934 20 5 FHBDRN CC(C)C(C)(C)CNC(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000189442803 947718544 /nfs/dbraw/zinc/71/85/44/947718544.db2.gz NAUPUQNWFKTQFT-UHFFFAOYSA-N 0 0 350.462 3.953 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)NCc1cccc(Cl)c1Cl ZINC000523905359 947722445 /nfs/dbraw/zinc/72/24/45/947722445.db2.gz OWCQMVSVSLLFTH-UHFFFAOYSA-N 0 0 368.220 3.944 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1F)c1cn2cc(Cl)cc(Cl)c2n1 ZINC000440723367 947724962 /nfs/dbraw/zinc/72/49/62/947724962.db2.gz VCDCRLPSLWCVHM-UHFFFAOYSA-N 0 0 369.139 3.941 20 5 FHBDRN O=C(NC[C@H]1CCOC2(CCC2)C1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000458996683 947730625 /nfs/dbraw/zinc/73/06/25/947730625.db2.gz HCMZPHWKBOKTRS-INIZCTEOSA-N 0 0 373.453 3.618 20 5 FHBDRN CC(C)(C)OC(=O)CCCOC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000785336647 947739003 /nfs/dbraw/zinc/73/90/03/947739003.db2.gz ZQDRPWYVEKTJKF-UHFFFAOYSA-N 0 0 351.399 3.538 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)Oc1ccc([C@@H](C)c2ccccc2)cc1 ZINC000728851745 947745256 /nfs/dbraw/zinc/74/52/56/947745256.db2.gz DIBHVERMCXOEKY-AWEZNQCLSA-N 0 0 365.389 3.857 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)Oc1ccc([C@H](C)c2ccccc2)cc1 ZINC000728851747 947745343 /nfs/dbraw/zinc/74/53/43/947745343.db2.gz DIBHVERMCXOEKY-CQSZACIVSA-N 0 0 365.389 3.857 20 5 FHBDRN O=[N+]([O-])c1ccc(OC[C@H](O)COc2ccccc2Cl)c2cccnc21 ZINC000184584243 947747656 /nfs/dbraw/zinc/74/76/56/947747656.db2.gz MLOODXBFERYIPO-LBPRGKRZSA-N 0 0 374.780 3.615 20 5 FHBDRN Cc1ccc(NC(=O)Cc2noc(-c3ccc([N+](=O)[O-])cc3C)n2)c(C)c1 ZINC000445363734 947754423 /nfs/dbraw/zinc/75/44/23/947754423.db2.gz KPRMMQWBIUHCPO-UHFFFAOYSA-N 0 0 366.377 3.751 20 5 FHBDRN C[C@@H](C(=O)NCc1ccccc1Br)c1cccc([N+](=O)[O-])c1 ZINC000319543625 947756883 /nfs/dbraw/zinc/75/68/83/947756883.db2.gz LBZCDEFPBBHPDV-LLVKDONJSA-N 0 0 363.211 3.777 20 5 FHBDRN Cc1cc(F)c(C(=O)O[C@@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)cc1F ZINC000759940092 947790349 /nfs/dbraw/zinc/79/03/49/947790349.db2.gz NUMHHMIJQDFLND-LSDHHAIUSA-N 0 0 365.336 3.719 20 5 FHBDRN O=C(NC[C@H]1CCOC2(CCC2)C1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000459005114 947792918 /nfs/dbraw/zinc/79/29/18/947792918.db2.gz JVLMLWKTKKWSHM-HNNXBMFYSA-N 0 0 373.453 3.618 20 5 FHBDRN Cc1cc(C(=O)N2C[C@@H](C)N(Cc3ccccc3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000500441177 947804073 /nfs/dbraw/zinc/80/40/73/947804073.db2.gz XOQSSTCLYBLGGQ-SJORKVTESA-N 0 0 367.449 3.638 20 5 FHBDRN CC[C@H](CSC)NC(=O)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000454766701 947811844 /nfs/dbraw/zinc/81/18/44/947811844.db2.gz RBSXFKFYQPKHOI-LSDHHAIUSA-N 0 0 351.472 3.625 20 5 FHBDRN O=C(O[C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)c1ccc(Cl)s1 ZINC000759943432 947836398 /nfs/dbraw/zinc/83/63/98/947836398.db2.gz DWMAKKNSJUCLID-VHSXEESVSA-N 0 0 355.803 3.847 20 5 FHBDRN CC[C@@]1(C)Oc2ccc(NC(=O)NCc3ccccc3[N+](=O)[O-])cc2O1 ZINC000190450514 947836760 /nfs/dbraw/zinc/83/67/60/947836760.db2.gz HLESDGNHUCMSDL-SFHVURJKSA-N 0 0 357.366 3.814 20 5 FHBDRN Cc1cc(NC(=O)N2CC[C@]3(C2)OCc2ccccc23)ccc1[N+](=O)[O-] ZINC000184607923 947841824 /nfs/dbraw/zinc/84/18/24/947841824.db2.gz DDMMXRQFGPBRNB-LJQANCHMSA-N 0 0 353.378 3.567 20 5 FHBDRN COc1cccc(Br)c1OC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000150823125 947852596 /nfs/dbraw/zinc/85/25/96/947852596.db2.gz JIYJITUSFRUCTC-UHFFFAOYSA-N 0 0 352.140 3.585 20 5 FHBDRN CC(C)c1ccc(CN(C)c2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])cc1 ZINC000015168620 947867897 /nfs/dbraw/zinc/86/78/97/947867897.db2.gz ZAHNOBQXHCBELP-UHFFFAOYSA-N 0 0 362.451 3.758 20 5 FHBDRN C[C@H](NC(=O)N1CC[C@@H]2CC[C@@]21c1cccnc1)c1ccc([N+](=O)[O-])cc1 ZINC000895067899 947868291 /nfs/dbraw/zinc/86/82/91/947868291.db2.gz ZBBKFRGXYSQEOO-UVFQYZLESA-N 0 0 366.421 3.772 20 5 FHBDRN CCOc1ccc2c(c1)[C@@H](Nc1ncnc3ccc([N+](=O)[O-])cc31)CCO2 ZINC000613898851 947870433 /nfs/dbraw/zinc/87/04/33/947870433.db2.gz RAUOROTURFOSJW-KRWDZBQOSA-N 0 0 366.377 3.872 20 5 FHBDRN Cc1sc(C(=O)N2C[C@H](C)N(Cc3ccccc3)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000500440473 947879120 /nfs/dbraw/zinc/87/91/20/947879120.db2.gz KQLQBHOQJHJJAA-KBPBESRZSA-N 0 0 373.478 3.700 20 5 FHBDRN CCOc1cc(CN2CCO[C@@](C)(c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000520481024 947928661 /nfs/dbraw/zinc/92/86/61/947928661.db2.gz SFFGXOJNLJXLHQ-HXUWFJFHSA-N 0 0 356.422 3.741 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCN(Cc3ccco3)CC2)nc1-c1ccccc1 ZINC000536391311 947957677 /nfs/dbraw/zinc/95/76/77/947957677.db2.gz ULIZOSXPQFBZDS-UHFFFAOYSA-N 0 0 364.405 3.572 20 5 FHBDRN Cc1ccc(-c2nnc([C@@H](C)Oc3ccc([N+](=O)[O-])c(CO)c3)o2)cc1 ZINC000432316125 947968702 /nfs/dbraw/zinc/96/87/02/947968702.db2.gz UXSRJVYODXMWQL-GFCCVEGCSA-N 0 0 355.350 3.586 20 5 FHBDRN COc1cc(COC(=O)Cc2cccs2)c([N+](=O)[O-])cc1OC(F)F ZINC000105299668 947987379 /nfs/dbraw/zinc/98/73/79/947987379.db2.gz NPZCLLYGXMWLPW-UHFFFAOYSA-N 0 0 373.333 3.552 20 5 FHBDRN O=[N+]([O-])c1cc2cc(Br)cnc2c(NC2(CO)CCCC2)c1 ZINC001167807322 947993093 /nfs/dbraw/zinc/99/30/93/947993093.db2.gz RBBCSQPTWGUYBT-UHFFFAOYSA-N 0 0 366.215 3.623 20 5 FHBDRN Cc1c(NC(=O)N(C)CC(F)(F)F)cc(Br)cc1[N+](=O)[O-] ZINC000280815157 947994334 /nfs/dbraw/zinc/99/43/34/947994334.db2.gz SUDPSXXTLCPDRN-UHFFFAOYSA-N 0 0 370.125 3.692 20 5 FHBDRN CC(C)(C)C(=O)NC[C@@H]1CCCN(c2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000432320191 948014378 /nfs/dbraw/zinc/01/43/78/948014378.db2.gz MMTUCFFJIYHXSH-LBPRGKRZSA-N 0 0 353.850 3.627 20 5 FHBDRN CC(=O)c1ccc2c(c1)CCN(c1ccnc3c1cccc3[N+](=O)[O-])CC2 ZINC000432321771 948021495 /nfs/dbraw/zinc/02/14/95/948021495.db2.gz HYFHWMBUURNPMP-UHFFFAOYSA-N 0 0 361.401 3.951 20 5 FHBDRN COc1cccc([C@H]2C[C@@H]2C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1 ZINC000129555599 948031417 /nfs/dbraw/zinc/03/14/17/948031417.db2.gz LXHIKZOZTXQTGC-UXHICEINSA-N 0 0 366.417 3.898 20 5 FHBDRN Cc1nc2cc(F)cc(C(=O)OCc3cccc([N+](=O)[O-])c3)c2nc1C ZINC000053956864 948035925 /nfs/dbraw/zinc/03/59/25/948035925.db2.gz IHENZRXDNBSUPW-UHFFFAOYSA-N 0 0 355.325 3.651 20 5 FHBDRN COc1ccccc1N1CC[C@@H](Nc2ccnc3c2cccc3[N+](=O)[O-])C1 ZINC000432326493 948069565 /nfs/dbraw/zinc/06/95/65/948069565.db2.gz PNNIAVKLDZEEAO-CQSZACIVSA-N 0 0 364.405 3.842 20 5 FHBDRN O=[N+]([O-])c1cccc2c(N3CCN(c4ccccc4F)CC3)ccnc21 ZINC000432326462 948070110 /nfs/dbraw/zinc/07/01/10/948070110.db2.gz PJAXLRJGVIMQOD-UHFFFAOYSA-N 0 0 352.369 3.609 20 5 FHBDRN COc1cccc(N2CC[C@H](Nc3ccnc4c3cccc4[N+](=O)[O-])C2)c1 ZINC000432326174 948073260 /nfs/dbraw/zinc/07/32/60/948073260.db2.gz AKAWGJYXADLWTP-AWEZNQCLSA-N 0 0 364.405 3.842 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N(Cc1cccs1)C(C)C ZINC000511989348 948074877 /nfs/dbraw/zinc/07/48/77/948074877.db2.gz LGCQPMBOYWINQI-UHFFFAOYSA-N 0 0 354.453 3.564 20 5 FHBDRN COc1cccc([C@H](C)C(=O)O[C@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)c1 ZINC000759945236 948075456 /nfs/dbraw/zinc/07/54/56/948075456.db2.gz TWGXQXHORIYNEU-JQFCIGGWSA-N 0 0 373.409 3.631 20 5 FHBDRN O=[N+]([O-])c1cccc2c(N3CCN(Cc4cccc(F)c4)CC3)ccnc21 ZINC000432328981 948091587 /nfs/dbraw/zinc/09/15/87/948091587.db2.gz NEBPQIXSBNDIMI-UHFFFAOYSA-N 0 0 366.396 3.604 20 5 FHBDRN O=C(Nc1ccc(OC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1)c1ccco1 ZINC000136922484 948109484 /nfs/dbraw/zinc/10/94/84/948109484.db2.gz DCVHBZKYDPXZKB-KRWDZBQOSA-N 0 0 368.345 3.553 20 5 FHBDRN Cc1cccc(N2CCC(Nc3ccnc4c3cccc4[N+](=O)[O-])CC2)n1 ZINC000432330847 948115162 /nfs/dbraw/zinc/11/51/62/948115162.db2.gz GKKKKYLDETWMIP-UHFFFAOYSA-N 0 0 363.421 3.927 20 5 FHBDRN Cc1ccccc1N1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000520495619 948115546 /nfs/dbraw/zinc/11/55/46/948115546.db2.gz KNWUVFXDCLQMEA-UHFFFAOYSA-N 0 0 365.389 3.612 20 5 FHBDRN CCc1ccc(CC)c(NC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)c1 ZINC000075365727 948116338 /nfs/dbraw/zinc/11/63/38/948116338.db2.gz ZMWVLJSQIGIRMM-UHFFFAOYSA-N 0 0 365.389 3.813 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N(C)Cc1ccc(F)c(Cl)c1 ZINC000432332011 948125722 /nfs/dbraw/zinc/12/57/22/948125722.db2.gz SCXTWGKOEAIMMM-UHFFFAOYSA-N 0 0 372.805 3.516 20 5 FHBDRN O=C(CCCOc1ccccc1)O[C@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1 ZINC000759947176 948131392 /nfs/dbraw/zinc/13/13/92/948131392.db2.gz WFBLBBBSTSEETE-IRXDYDNUSA-N 0 0 373.409 3.677 20 5 FHBDRN COc1ccc(CNc2c(Cl)cccc2[N+](=O)[O-])c(OC)c1OC ZINC000432333220 948139213 /nfs/dbraw/zinc/13/92/13/948139213.db2.gz ANLUDTYRPSZXGV-UHFFFAOYSA-N 0 0 352.774 3.886 20 5 FHBDRN O=C(c1ccn(-c2ccccc2)n1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000129570768 948144709 /nfs/dbraw/zinc/14/47/09/948144709.db2.gz IBRVXJGXAGLGNI-UHFFFAOYSA-N 0 0 362.389 3.585 20 5 FHBDRN Cc1cccc(C)c1OC[C@@H](C)NC(=O)c1c(C)c(F)ccc1[N+](=O)[O-] ZINC000843774474 948147029 /nfs/dbraw/zinc/14/70/29/948147029.db2.gz VNSCUOXOSFACRS-CYBMUJFWSA-N 0 0 360.385 3.856 20 5 FHBDRN O=C(Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1)C1CCC(O)CC1 ZINC000280819866 948150876 /nfs/dbraw/zinc/15/08/76/948150876.db2.gz HTBFZUSTXIXBQA-UHFFFAOYSA-N 0 0 356.378 3.877 20 5 FHBDRN O=C(CNc1ccnc2c1cccc2[N+](=O)[O-])Nc1ccc(Cl)cc1 ZINC000432338097 948154000 /nfs/dbraw/zinc/15/40/00/948154000.db2.gz UKFFINWJNIZWOE-UHFFFAOYSA-N 0 0 356.769 3.847 20 5 FHBDRN C[NH+](C)[C@H](CNc1ccnc2c1cccc2[N+](=O)[O-])c1ccc(F)cc1 ZINC000432337910 948156341 /nfs/dbraw/zinc/15/63/41/948156341.db2.gz COJGDMFTJYWNCC-GOSISDBHSA-N 0 0 354.385 3.997 20 5 FHBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N(C)Cc1ccsc1 ZINC000585695648 948161140 /nfs/dbraw/zinc/16/11/40/948161140.db2.gz MAGBBOPYIJMWST-UHFFFAOYSA-N 0 0 369.240 3.999 20 5 FHBDRN COc1ccc(NC(=O)c2ccc(Br)c(C)c2)cc1[N+](=O)[O-] ZINC000388549764 948170447 /nfs/dbraw/zinc/17/04/47/948170447.db2.gz HRRCVQSHRGMWSC-UHFFFAOYSA-N 0 0 365.183 3.927 20 5 FHBDRN C[C@@H](Nc1ccc(C(=O)N[C@@H](C)C2CC2)cc1[N+](=O)[O-])c1ccccn1 ZINC000053084447 948172753 /nfs/dbraw/zinc/17/27/53/948172753.db2.gz PNSOVRJETMVQIH-QWHCGFSZSA-N 0 0 354.410 3.691 20 5 FHBDRN O=C(Cn1ccc(-c2ccsc2)n1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000106437226 948188839 /nfs/dbraw/zinc/18/88/39/948188839.db2.gz WSTBOFMUUXMDDY-UHFFFAOYSA-N 0 0 362.798 3.812 20 5 FHBDRN CN(Cc1nc([C@@H]2C[C@H]2c2ccccc2)no1)c1ccccc1[N+](=O)[O-] ZINC000512027130 948222372 /nfs/dbraw/zinc/22/23/72/948222372.db2.gz SMHHWDALHKVIIW-LSDHHAIUSA-N 0 0 350.378 3.885 20 5 FHBDRN CCn1ncc(C(=O)N2CCc3c2cccc3[N+](=O)[O-])c1-c1ccccc1 ZINC000427592639 948233761 /nfs/dbraw/zinc/23/37/61/948233761.db2.gz GOEMAEWDHPYFKO-UHFFFAOYSA-N 0 0 362.389 3.681 20 5 FHBDRN C[C@@H]([NH2+]Cc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)C(=O)[O-] ZINC000585731797 948241122 /nfs/dbraw/zinc/24/11/22/948241122.db2.gz BMSYRAPVBJIRJF-SNVBAGLBSA-N 0 0 350.758 3.603 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])N1CCCC[C@@H]1Cc1ccc(F)cc1 ZINC000520540589 948250654 /nfs/dbraw/zinc/25/06/54/948250654.db2.gz JFVHNSAMXBKNIK-GOSISDBHSA-N 0 0 356.397 3.900 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H]1CCC[C@H]1Cc1ccccc1 ZINC000427593578 948253440 /nfs/dbraw/zinc/25/34/40/948253440.db2.gz LLBXPWVIOVIMPE-MAUKXSAKSA-N 0 0 354.406 3.745 20 5 FHBDRN CC(=O)NCc1ccc(C(=O)Nc2ccc(C(C)(C)C)c([N+](=O)[O-])c2)cc1 ZINC000585750324 948262015 /nfs/dbraw/zinc/26/20/15/948262015.db2.gz LBCBXKPZNPONDJ-UHFFFAOYSA-N 0 0 369.421 3.781 20 5 FHBDRN CC[C@H](C)N(Cc1ccccc1)C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000060461709 948264537 /nfs/dbraw/zinc/26/45/37/948264537.db2.gz NBJJFJYCJDAVNI-ZDUSSCGKSA-N 0 0 357.366 3.944 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCCC[C@H]1c1ncc[nH]1 ZINC000184717409 948268693 /nfs/dbraw/zinc/26/86/93/948268693.db2.gz DZAWUCUYUFCDDU-WBVHZDCISA-N 0 0 356.426 3.640 20 5 FHBDRN CC(C)(c1ccccc1)[S@@](=O)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000507777572 948271138 /nfs/dbraw/zinc/27/11/38/948271138.db2.gz SNHTWKFPTVOGJR-VWLOTQADSA-N 0 0 360.435 3.607 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1CCSC[C@@H]1c1ccc(C)cc1 ZINC000427595612 948273372 /nfs/dbraw/zinc/27/33/72/948273372.db2.gz DWIPXLKNTORDSZ-QGZVFWFLSA-N 0 0 372.446 3.842 20 5 FHBDRN CCc1c(C(=O)N2CCc3c2cccc3[N+](=O)[O-])cnn1CCC(C)C ZINC000427596209 948288612 /nfs/dbraw/zinc/28/86/12/948288612.db2.gz ZOOPALMINNRBOZ-UHFFFAOYSA-N 0 0 356.426 3.603 20 5 FHBDRN C[C@H](NC(=O)CCc1cc(F)ccc1[N+](=O)[O-])c1ccc(F)c(F)c1 ZINC001126307663 948294389 /nfs/dbraw/zinc/29/43/89/948294389.db2.gz CDTYVKUUFRIMHL-JTQLQIEISA-N 0 0 352.312 3.822 20 5 FHBDRN Cc1ccc([C@H]2C[C@@H](C)N(S(=O)(=O)c3ccc(C)c([N+](=O)[O-])c3)C2)cc1 ZINC001211699415 948303600 /nfs/dbraw/zinc/30/36/00/948303600.db2.gz IPQFNSQRUVKTNI-WBVHZDCISA-N 0 0 374.462 3.778 20 5 FHBDRN CCSc1ccccc1C(=O)N=c1cc(-c2cccc([N+](=O)[O-])c2)[nH][nH]1 ZINC000520570435 948305280 /nfs/dbraw/zinc/30/52/80/948305280.db2.gz JJUDIVOFRNZFAV-UHFFFAOYSA-N 0 0 368.418 3.771 20 5 FHBDRN CC(C)Oc1cc(NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)ccn1 ZINC000614591749 948307270 /nfs/dbraw/zinc/30/72/70/948307270.db2.gz PRIHNIUCDNTDFE-UHFFFAOYSA-N 0 0 356.382 3.604 20 5 FHBDRN Cc1cc(OCC(=O)Nc2cc(Cl)cc(F)c2F)ccc1[N+](=O)[O-] ZINC000441591383 948317528 /nfs/dbraw/zinc/31/75/28/948317528.db2.gz YTKMQNYCRMCMNT-UHFFFAOYSA-N 0 0 356.712 3.852 20 5 FHBDRN CCOC(=O)c1cc(NCc2nc3cc(C)ccc3[nH]2)ccc1[N+](=O)[O-] ZINC000467784748 948327940 /nfs/dbraw/zinc/32/79/40/948327940.db2.gz IBAJETPDZKGRKO-UHFFFAOYSA-N 0 0 354.366 3.568 20 5 FHBDRN COc1ccc(NC(C)=O)cc1N(C(=O)c1ccc([N+](=O)[O-])cc1)C(C)C ZINC000441598908 948333919 /nfs/dbraw/zinc/33/39/19/948333919.db2.gz CAABAAHVRUJZOP-UHFFFAOYSA-N 0 0 371.393 3.617 20 5 FHBDRN COc1ccc(CC(=O)N2CCS[C@@H]2c2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC001126309130 948337557 /nfs/dbraw/zinc/33/75/57/948337557.db2.gz VYINAVWHFXABKX-LJQANCHMSA-N 0 0 372.446 3.729 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N(C)[C@H](C)Cc1ccc(Cl)cc1 ZINC000427600983 948352654 /nfs/dbraw/zinc/35/26/54/948352654.db2.gz JGBQHGHNFXNIDR-GFCCVEGCSA-N 0 0 362.813 3.960 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1CCC[C@H]1Cc1ccc(C)cc1 ZINC000427604795 948391753 /nfs/dbraw/zinc/39/17/53/948391753.db2.gz SBLAYCVJXWBAPP-INIZCTEOSA-N 0 0 354.406 3.759 20 5 FHBDRN CC(C)OC(=O)C[C@H](NC(=O)C1=CCCCC1)c1ccccc1[N+](=O)[O-] ZINC000125977311 948394103 /nfs/dbraw/zinc/39/41/03/948394103.db2.gz DEYSGYCEUXFLQO-INIZCTEOSA-N 0 0 360.410 3.594 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCc1sc(C)nc1C ZINC000184769134 948401259 /nfs/dbraw/zinc/40/12/59/948401259.db2.gz RGFDQXFLDDVWAZ-HNNXBMFYSA-N 0 0 361.467 3.596 20 5 FHBDRN CC(C)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])cn2C)c(C(F)(F)F)c1 ZINC000520624622 948431322 /nfs/dbraw/zinc/43/13/22/948431322.db2.gz QODBNSKFCOFEMW-UHFFFAOYSA-N 0 0 371.315 3.992 20 5 FHBDRN CC(C)CCSc1ccc(C(=O)N[C@H]2CCOC[C@H]2C)cc1[N+](=O)[O-] ZINC000432446459 948440318 /nfs/dbraw/zinc/44/03/18/948440318.db2.gz JRRQPEQOJVFHJO-HIFRSBDPSA-N 0 0 366.483 3.888 20 5 FHBDRN COC(=O)c1cc(C(=O)Nc2ccc(COC(C)C)cc2)cc([N+](=O)[O-])c1 ZINC000512116038 948458122 /nfs/dbraw/zinc/45/81/22/948458122.db2.gz RRSONOMVCDXZPH-UHFFFAOYSA-N 0 0 372.377 3.559 20 5 FHBDRN Cc1c(C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)nnn1CC1CCCC1 ZINC000279068071 948465026 /nfs/dbraw/zinc/46/50/26/948465026.db2.gz CQQKUFXHGXBSKI-UHFFFAOYSA-N 0 0 357.414 3.554 20 5 FHBDRN COc1ccc(-c2ccc(C[NH2+]CCc3c(C)noc3C)o2)c([N+](=O)[O-])c1 ZINC000107321118 948466703 /nfs/dbraw/zinc/46/67/03/948466703.db2.gz YPGLVHYAFMOGKY-UHFFFAOYSA-N 0 0 371.393 3.801 20 5 FHBDRN C[C@H](C(=O)Oc1ccc2c(c1)OC(=O)C[C@H]2C)c1cccc([N+](=O)[O-])c1 ZINC000785375131 948467591 /nfs/dbraw/zinc/46/75/91/948467591.db2.gz IHXQESDMFXIVTI-NEPJUHHUSA-N 0 0 355.346 3.717 20 5 FHBDRN CC(F)(F)CNC(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000520636455 948468271 /nfs/dbraw/zinc/46/82/71/948468271.db2.gz 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ZINC000452884416 567887166 /nfs/dbraw/zinc/88/71/66/567887166.db2.gz PXDFHDMEZMNXGD-GOSISDBHSA-N 0 0 354.406 3.761 20 5 FHBDRN CC(=O)c1ccc(CC(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000452888147 567887890 /nfs/dbraw/zinc/88/78/90/567887890.db2.gz SKQFBBXGQOVDMC-LJQANCHMSA-N 0 0 366.417 3.746 20 5 FHBDRN COc1cccc(CC(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000452887410 567896749 /nfs/dbraw/zinc/89/67/49/567896749.db2.gz SBSOWYXLIXOGRT-KRWDZBQOSA-N 0 0 354.406 3.552 20 5 FHBDRN Cc1cc(C(=O)N[C@H](C[C@@H]2CCOC2)c2ccccc2)cc([N+](=O)[O-])c1 ZINC000159186758 567899903 /nfs/dbraw/zinc/89/99/03/567899903.db2.gz WZVMZCBEHRLHDE-HNAYVOBHSA-N 0 0 354.406 3.801 20 5 FHBDRN C[C@H](O)C[C@H](CNC(=O)c1cc(Cl)cc([N+](=O)[O-])c1)c1ccccc1 ZINC000159182825 567906177 /nfs/dbraw/zinc/90/61/77/567906177.db2.gz GUQZREFYCYWVKJ-SWLSCSKDSA-N 0 0 362.813 3.533 20 5 FHBDRN COc1ccc(C(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cc1OC ZINC000452895714 567908973 /nfs/dbraw/zinc/90/89/73/567908973.db2.gz 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Cc1cccc2c(CCC(=O)NCc3cccc([N+](=O)[O-])c3C)c[nH]c21 ZINC000481472991 567965801 /nfs/dbraw/zinc/96/58/01/567965801.db2.gz GAYGXYTUFDMNEK-UHFFFAOYSA-N 0 0 351.406 3.942 20 5 FHBDRN Cc1c(CNC(=O)Cc2ccc(Br)cc2)cccc1[N+](=O)[O-] ZINC000481469834 567965992 /nfs/dbraw/zinc/96/59/92/567965992.db2.gz VMFLWBKVVUDZHU-UHFFFAOYSA-N 0 0 363.211 3.525 20 5 FHBDRN Cc1c(C(=O)NCc2cccc([N+](=O)[O-])c2C)cnn1-c1cccc(C)c1 ZINC000481471850 567967837 /nfs/dbraw/zinc/96/78/37/567967837.db2.gz BNAOJDOWMVSRMF-UHFFFAOYSA-N 0 0 364.405 3.636 20 5 FHBDRN Cc1c(CNC(=O)c2cnc(-c3ccccc3)s2)cccc1[N+](=O)[O-] ZINC000481464803 567970548 /nfs/dbraw/zinc/97/05/48/567970548.db2.gz KXHQHWGZCUJDET-UHFFFAOYSA-N 0 0 353.403 3.957 20 5 FHBDRN Cc1ccc(OCCCC(=O)NCc2cccc([N+](=O)[O-])c2C)cc1C ZINC000481478947 567972222 /nfs/dbraw/zinc/97/22/22/567972222.db2.gz ZXNXFLAMBYBHKF-UHFFFAOYSA-N 0 0 356.422 3.995 20 5 FHBDRN CC(C)(CCc1noc(-c2ccc(Oc3ccccc3)nc2)n1)[N+](=O)[O-] ZINC000291033721 567972969 /nfs/dbraw/zinc/97/29/69/567972969.db2.gz FMWQJVFOUPWHBT-UHFFFAOYSA-N 0 0 354.366 3.912 20 5 FHBDRN Cc1c(CNC(=O)Cc2cccc(C(F)(F)F)c2)cccc1[N+](=O)[O-] ZINC000481476879 567975407 /nfs/dbraw/zinc/97/54/07/567975407.db2.gz GYQMMWCCCYHGQG-UHFFFAOYSA-N 0 0 352.312 3.781 20 5 FHBDRN Cc1noc2nc(C3CC3)cc(C(=O)NCc3cccc([N+](=O)[O-])c3C)c12 ZINC000481475790 567977919 /nfs/dbraw/zinc/97/79/19/567977919.db2.gz SMTXMBNDZWAVCV-UHFFFAOYSA-N 0 0 366.377 3.555 20 5 FHBDRN Cc1c(CNC(=O)c2csc(Cc3ccccc3)n2)cccc1[N+](=O)[O-] ZINC000481479957 567978554 /nfs/dbraw/zinc/97/85/54/567978554.db2.gz KTKABESDXFGJDA-UHFFFAOYSA-N 0 0 367.430 3.881 20 5 FHBDRN COc1ccc2c(CC(=O)NCc3cccc([N+](=O)[O-])c3C)coc2c1 ZINC000481489828 567987851 /nfs/dbraw/zinc/98/78/51/567987851.db2.gz IDJPQABPCKBNSR-UHFFFAOYSA-N 0 0 354.362 3.517 20 5 FHBDRN CCCC(CCC)SCC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000064048746 567993847 /nfs/dbraw/zinc/99/38/47/567993847.db2.gz JDUALUOCQXQWCF-UHFFFAOYSA-N 0 0 354.428 3.964 20 5 FHBDRN CCOc1ccc2cc(C(=O)NCc3cccc([N+](=O)[O-])c3C)[nH]c2c1 ZINC000481501644 567997898 /nfs/dbraw/zinc/99/78/98/567997898.db2.gz KOBSXMREVZKANG-UHFFFAOYSA-N 0 0 353.378 3.713 20 5 FHBDRN O=[N+]([O-])c1cc(C(F)(F)F)ccc1CN1CCC(c2ccon2)CC1 ZINC000602717913 568014844 /nfs/dbraw/zinc/01/48/44/568014844.db2.gz KFKYRQITXBMQRR-UHFFFAOYSA-N 0 0 355.316 3.981 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)ccc1CN[C@H](c1ccncc1)C1(CO)CCC1 ZINC000602899872 568015071 /nfs/dbraw/zinc/01/50/71/568015071.db2.gz BJHMKYKBCPKHMG-QGZVFWFLSA-N 0 0 361.829 3.637 20 5 FHBDRN CC(C)(CCc1noc(Cc2cc(F)ccc2Br)n1)[N+](=O)[O-] ZINC000291090165 568018205 /nfs/dbraw/zinc/01/82/05/568018205.db2.gz PGEGEAYGVUBFND-UHFFFAOYSA-N 0 0 372.194 3.550 20 5 FHBDRN Cc1c(CNC(=O)[C@H]2C[C@@H]2c2cc(F)c(F)c(F)c2)cccc1[N+](=O)[O-] ZINC000481504434 568021690 /nfs/dbraw/zinc/02/16/90/568021690.db2.gz WLSZBKOQEASAFV-OLZOCXBDSA-N 0 0 364.323 3.740 20 5 FHBDRN C[C@H]1CCC[C@@H](N(C)C(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000568341540 568026440 /nfs/dbraw/zinc/02/64/40/568026440.db2.gz SEBOIMODGBALPH-DZGCQCFKSA-N 0 0 358.442 3.839 20 5 FHBDRN Cc1c(CNC(=O)Cc2ccccc2Br)cccc1[N+](=O)[O-] ZINC000481504488 568031361 /nfs/dbraw/zinc/03/13/61/568031361.db2.gz XCMUUWGCUZTIFD-UHFFFAOYSA-N 0 0 363.211 3.525 20 5 FHBDRN CCN1C(=O)C(C)(C)N[C@@H]1c1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000602756307 568031853 /nfs/dbraw/zinc/03/18/53/568031853.db2.gz HBNVGXKZCXIVPG-KRWDZBQOSA-N 0 0 373.384 3.755 20 5 FHBDRN O=C(Nc1ccc(-c2ccccc2)nn1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000150820747 568032819 /nfs/dbraw/zinc/03/28/19/568032819.db2.gz YTDPRKYSIBINNC-UHFFFAOYSA-N 0 0 354.753 3.958 20 5 FHBDRN O=[N+]([O-])c1ccc(OC[C@H](O)COc2c(Cl)cccc2Cl)cc1 ZINC000568354240 568033363 /nfs/dbraw/zinc/03/33/63/568033363.db2.gz DIVDLKNROWNZIK-NSHDSACASA-N 0 0 358.177 3.720 20 5 FHBDRN O=C(c1cc2c(c([N+](=O)[O-])c1)OCO2)N1CC[C@@H]1c1ccc(Cl)cc1 ZINC000568425296 568034708 /nfs/dbraw/zinc/03/47/08/568034708.db2.gz YSAYKRNNYVWNRP-CYBMUJFWSA-N 0 0 360.753 3.564 20 5 FHBDRN Cc1nc(-c2ccco2)ccc1C(=O)NCc1cccc([N+](=O)[O-])c1C ZINC000481503953 568040804 /nfs/dbraw/zinc/04/08/04/568040804.db2.gz VSJBCHJQAYITPP-UHFFFAOYSA-N 0 0 351.362 3.797 20 5 FHBDRN Cn1nc([N+](=O)[O-])cc1C(=O)N[C@@H](c1ccccc1)c1cccc(Cl)c1 ZINC000481536314 568043893 /nfs/dbraw/zinc/04/38/93/568043893.db2.gz JKURFUHKZDNOSC-KRWDZBQOSA-N 0 0 370.796 3.501 20 5 FHBDRN C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)N3CCC[C@@H]3CF)cc2[N+](=O)[O-])C1 ZINC000568552316 568050459 /nfs/dbraw/zinc/05/04/59/568050459.db2.gz VSWGQBDZTCWFGA-IJEWVQPXSA-N 0 0 363.433 3.651 20 5 FHBDRN O=C(NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)c1c[nH]c2cc(F)ccc12 ZINC000568573157 568058456 /nfs/dbraw/zinc/05/84/56/568058456.db2.gz QPHSGFWILSEIMA-UHFFFAOYSA-N 0 0 366.352 3.669 20 5 FHBDRN O=[N+]([O-])c1ccc(CN2CCO[C@@H](c3ccc(F)cc3Cl)C2)cc1 ZINC000481578548 568059213 /nfs/dbraw/zinc/05/92/13/568059213.db2.gz DAIIXJFYHOYHQZ-QGZVFWFLSA-N 0 0 350.777 3.961 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCCc1ccc(C)nc1 ZINC000541880259 568061130 /nfs/dbraw/zinc/06/11/30/568061130.db2.gz JICLUZURQKYUTC-UHFFFAOYSA-N 0 0 359.451 3.773 20 5 FHBDRN CCCNC(=O)c1ccccc1C(=O)c1ccc(SC)c([N+](=O)[O-])c1 ZINC000024737249 568061570 /nfs/dbraw/zinc/06/15/70/568061570.db2.gz BUPAEZNINWZFND-UHFFFAOYSA-N 0 0 358.419 3.688 20 5 FHBDRN CC(C)(CCc1noc(Cc2ccc(F)c(Br)c2)n1)[N+](=O)[O-] ZINC000291151797 568064063 /nfs/dbraw/zinc/06/40/63/568064063.db2.gz ZOUMAQJWRGQYSE-UHFFFAOYSA-N 0 0 372.194 3.550 20 5 FHBDRN CC(=O)c1cccc(NC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000481607836 568065348 /nfs/dbraw/zinc/06/53/48/568065348.db2.gz BZCVQXUUPGHCST-UHFFFAOYSA-N 0 0 361.785 3.815 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCc1cc2n(n1)CCCC2 ZINC000603140857 568067036 /nfs/dbraw/zinc/06/70/36/568067036.db2.gz BDSNUFAFYCFXDK-UHFFFAOYSA-N 0 0 374.466 3.560 20 5 FHBDRN O=C(NC[C@@H]1CCC2(CCCCC2)O1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000481635482 568074845 /nfs/dbraw/zinc/07/48/45/568074845.db2.gz IWWJXCBQFQJBAB-HNNXBMFYSA-N 0 0 352.818 3.860 20 5 FHBDRN C[C@H](C(=O)NC[C@@H]1CCC2(CCCCC2)O1)c1ccc([N+](=O)[O-])cc1F ZINC000481634113 568074917 /nfs/dbraw/zinc/07/49/17/568074917.db2.gz PMYKTXQMOPBPCA-ZFWWWQNUSA-N 0 0 364.417 3.836 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(Nc2ccc(CS(=O)(=O)C(C)(C)C)cc2)n1 ZINC000481678161 568085332 /nfs/dbraw/zinc/08/53/32/568085332.db2.gz PBXPJIYFSCNBER-UHFFFAOYSA-N 0 0 363.439 3.755 20 5 FHBDRN COc1cc(OC[C@H](O)COc2ccccc2C(C)C)ccc1[N+](=O)[O-] ZINC000481705803 568090629 /nfs/dbraw/zinc/09/06/29/568090629.db2.gz WBLIEUBMYWAKSS-AWEZNQCLSA-N 0 0 361.394 3.546 20 5 FHBDRN COc1cc(OC[C@@H](O)COc2cccc3ccccc32)ccc1[N+](=O)[O-] ZINC000481707036 568091551 /nfs/dbraw/zinc/09/15/51/568091551.db2.gz QBDFMZJQFQMYHL-OAHLLOKOSA-N 0 0 369.373 3.575 20 5 FHBDRN CN(Cc1ccc(F)cc1Br)C(=O)c1cccc([N+](=O)[O-])c1 ZINC000481706119 568091614 /nfs/dbraw/zinc/09/16/14/568091614.db2.gz XLAIAJXTRUQKLU-UHFFFAOYSA-N 0 0 367.174 3.769 20 5 FHBDRN CCN(CCOC)C(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(OC)cc1 ZINC000481716573 568093978 /nfs/dbraw/zinc/09/39/78/568093978.db2.gz XTNCQZYRKAAJCI-UHFFFAOYSA-N 0 0 374.393 3.504 20 5 FHBDRN Cc1cc(=O)[nH]c2cc(C(=O)N[C@@H](C)c3cccc([N+](=O)[O-])c3)ccc12 ZINC000568672100 568117002 /nfs/dbraw/zinc/11/70/02/568117002.db2.gz BPZKONFFJCTTHA-LBPRGKRZSA-N 0 0 351.362 3.648 20 5 FHBDRN Cn1nc([N+](=O)[O-])cc1C(=O)Nc1ccccc1Oc1cc(F)cc(F)c1 ZINC000481780580 568123393 /nfs/dbraw/zinc/12/33/93/568123393.db2.gz BDTFXZVOYIOLHW-UHFFFAOYSA-N 0 0 374.303 3.651 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C(C)C)[C@@H](CO)C(C)C ZINC000452980373 568126192 /nfs/dbraw/zinc/12/61/92/568126192.db2.gz INJCYBSAOSCICZ-RDJZCZTQSA-N 0 0 368.499 3.726 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)Cc1c(C)nn(C(F)F)c1C ZINC000291383226 568127976 /nfs/dbraw/zinc/12/79/76/568127976.db2.gz FNOZJIOJOLDVLB-UHFFFAOYSA-N 0 0 352.341 3.547 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)c1cnn(CCC(F)(F)F)c1 ZINC000291389450 568129321 /nfs/dbraw/zinc/12/93/21/568129321.db2.gz GGZIVPXEOFUACB-UHFFFAOYSA-N 0 0 356.304 3.558 20 5 FHBDRN O=C(NC[C@H]1CCN(c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1Cl ZINC000024814626 568130578 /nfs/dbraw/zinc/13/05/78/568130578.db2.gz JJTABZDBHKJTBT-CYBMUJFWSA-N 0 0 359.813 3.505 20 5 FHBDRN O=C(N[C@@H](c1ccccc1)C(F)F)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000481823689 568138656 /nfs/dbraw/zinc/13/86/56/568138656.db2.gz IHBAJSFOPLRIBC-INIZCTEOSA-N 0 0 372.331 3.517 20 5 FHBDRN O=C(c1c[nH]c2ccc([N+](=O)[O-])cc12)N1CC[C@H](Oc2cccc(F)c2)C1 ZINC000181896503 568148886 /nfs/dbraw/zinc/14/88/86/568148886.db2.gz WPMJOWQPURXTHN-HNNXBMFYSA-N 0 0 369.352 3.509 20 5 FHBDRN COC(=O)c1cc(OCc2ccccc2Br)ccc1[N+](=O)[O-] ZINC000481898993 568160906 /nfs/dbraw/zinc/16/09/06/568160906.db2.gz LNEFWLOXZSXMRZ-UHFFFAOYSA-N 0 0 366.167 3.723 20 5 FHBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])N1CCc2sccc2C1 ZINC000481940370 568194365 /nfs/dbraw/zinc/19/43/65/568194365.db2.gz FDNGWHAZOBOPKX-UHFFFAOYSA-N 0 0 365.842 3.620 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)Nc1cc(Cl)ccc1F ZINC000481949689 568195380 /nfs/dbraw/zinc/19/53/80/568195380.db2.gz CDJHAEZFKLFRGC-UHFFFAOYSA-N 0 0 358.778 3.805 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N(C)[C@H](C)c1ccc(F)cc1 ZINC000481959214 568196940 /nfs/dbraw/zinc/19/69/40/568196940.db2.gz ADZHNJWVAYNSAO-CYBMUJFWSA-N 0 0 366.414 3.732 20 5 FHBDRN COC(=O)c1cc(OCc2nc(-c3ccsc3)oc2C)ccc1[N+](=O)[O-] ZINC000481958650 568196956 /nfs/dbraw/zinc/19/69/56/568196956.db2.gz BXJVJXFPMAJZDQ-UHFFFAOYSA-N 0 0 374.374 3.985 20 5 FHBDRN C[C@@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1F)c1cccc2ccccc21 ZINC000604019498 568199707 /nfs/dbraw/zinc/19/97/07/568199707.db2.gz HBMBYVKNEHZTQO-GFCCVEGCSA-N 0 0 374.393 3.927 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1nc(SC)ns1 ZINC000481964811 568200044 /nfs/dbraw/zinc/20/00/44/568200044.db2.gz FOMOYFPYCUVTQW-UHFFFAOYSA-N 0 0 356.454 3.533 20 5 FHBDRN Cc1ccc(S(=O)(=O)N(C)[C@@H](C)c2cccc(Cl)c2)cc1[N+](=O)[O-] ZINC000604041485 568203125 /nfs/dbraw/zinc/20/31/25/568203125.db2.gz BPDJMBCEWYZTTJ-LBPRGKRZSA-N 0 0 368.842 3.938 20 5 FHBDRN COc1c(Cl)cccc1[N-]S(=O)(=O)c1c(C)cc([N+](=O)[O-])cc1C ZINC000481974877 568212498 /nfs/dbraw/zinc/21/24/98/568212498.db2.gz UBOZNKFSKVWHHG-UHFFFAOYSA-N 0 0 370.814 3.674 20 5 FHBDRN CC[C@@H](Cc1ccc(C)cc1)N(CC)C(=O)Nc1ccncc1[N+](=O)[O-] ZINC000541907456 568216467 /nfs/dbraw/zinc/21/64/67/568216467.db2.gz QAMDEMSMWJFPRA-INIZCTEOSA-N 0 0 356.426 3.595 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CCc2ccc(Cl)cc2C1 ZINC000128723843 568218408 /nfs/dbraw/zinc/21/84/08/568218408.db2.gz KUSMGJFGDWKEQA-UHFFFAOYSA-N 0 0 369.808 3.857 20 5 FHBDRN O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)NCCCc1cccc(Cl)c1 ZINC000568791765 568218757 /nfs/dbraw/zinc/21/87/57/568218757.db2.gz DAFOWZLAKSTOCQ-UHFFFAOYSA-N 0 0 368.767 3.818 20 5 FHBDRN C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000482004094 568226217 /nfs/dbraw/zinc/22/62/17/568226217.db2.gz BLIBJGDEGKNRPJ-DOMZBBRYSA-N 0 0 373.375 3.976 20 5 FHBDRN C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1c[nH]c2ccc([N+](=O)[O-])cc21 ZINC000482005300 568226280 /nfs/dbraw/zinc/22/62/80/568226280.db2.gz KIZVOKOGOSDZPZ-ZANVPECISA-N 0 0 355.316 3.879 20 5 FHBDRN CCN(C(=O)Cc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CCOC(C)(C)C1 ZINC000291622431 568230554 /nfs/dbraw/zinc/23/05/54/568230554.db2.gz NHFUYMWJTLHFJZ-CQSZACIVSA-N 0 0 354.834 3.597 20 5 FHBDRN NC(=O)c1ccc(CNc2cc(Cl)c(Cl)cc2F)c([N+](=O)[O-])c1 ZINC000490376880 568231737 /nfs/dbraw/zinc/23/17/37/568231737.db2.gz XFORMQOVVXWKFD-UHFFFAOYSA-N 0 0 358.156 3.752 20 5 FHBDRN C[C@H]1C(=O)CC[C@H](C(=O)NCc2cc([N+](=O)[O-])ccc2Cl)C1(C)C ZINC000275726086 568235263 /nfs/dbraw/zinc/23/52/63/568235263.db2.gz WTKGXOKJPSMWPX-GXFFZTMASA-N 0 0 352.818 3.506 20 5 FHBDRN CCCc1nc(C)c(CNc2ccc(C(=O)NC(C)C)cc2[N+](=O)[O-])o1 ZINC000291636922 568236119 /nfs/dbraw/zinc/23/61/19/568236119.db2.gz BZKMVLFLZNISGB-UHFFFAOYSA-N 0 0 360.414 3.594 20 5 FHBDRN O=C(Nc1ccc(NC(=O)c2ccc([N+](=O)[O-])s2)cc1)c1ccco1 ZINC000011204865 568237858 /nfs/dbraw/zinc/23/78/58/568237858.db2.gz FRQCYWREFVQQAB-UHFFFAOYSA-N 0 0 357.347 3.754 20 5 FHBDRN C[C@@H]1[C@@H](Cc2ccccc2)CCN1c1cc2nc[nH]c(=O)c2cc1[N+](=O)[O-] ZINC000568864394 568238601 /nfs/dbraw/zinc/23/86/01/568238601.db2.gz JIOBEAQGDCFCKI-UKRRQHHQSA-N 0 0 364.405 3.701 20 5 FHBDRN CCOC(=O)c1sc([C@H](C)Nc2nc(C)cc(C)c2[N+](=O)[O-])nc1C ZINC000541933428 568245848 /nfs/dbraw/zinc/24/58/48/568245848.db2.gz LKPAOVXBHNLPOX-NSHDSACASA-N 0 0 364.427 3.721 20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])N1CC=C(c2ccc(F)cc2)CC1 ZINC000302998643 568249289 /nfs/dbraw/zinc/24/92/89/568249289.db2.gz XTVUPWOFVQFFRJ-UHFFFAOYSA-N 0 0 369.396 3.852 20 5 FHBDRN O=C(Nc1ccncc1[N+](=O)[O-])N1CCCC[C@@H]1CCCc1ccccc1 ZINC000541924516 568250928 /nfs/dbraw/zinc/25/09/28/568250928.db2.gz UJXJEKZASTYMAG-QGZVFWFLSA-N 0 0 368.437 3.821 20 5 FHBDRN COc1cc(CNCc2occc2C)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000291660559 568251647 /nfs/dbraw/zinc/25/16/47/568251647.db2.gz DYWXWXVXFJJTES-UHFFFAOYSA-N 0 0 374.315 3.736 20 5 FHBDRN O=[N+]([O-])c1cnc2ccccc2c1Sc1nnc(N2CCCC2)s1 ZINC000291668838 568252458 /nfs/dbraw/zinc/25/24/58/568252458.db2.gz PSDQTVFJGIWIFF-UHFFFAOYSA-N 0 0 359.436 3.746 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(NCC2CCN(C(=O)c3ccccc3)CC2)n1 ZINC000541932636 568252924 /nfs/dbraw/zinc/25/29/24/568252924.db2.gz SMGOSRUTFYQYMC-UHFFFAOYSA-N 0 0 368.437 3.571 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1[O-])N1CC[C@](F)(c2cccc(Cl)c2)C1 ZINC000436661289 568253321 /nfs/dbraw/zinc/25/33/21/568253321.db2.gz CORCQMQUSZEXFQ-QGZVFWFLSA-N 0 0 364.760 3.665 20 5 FHBDRN O=C(NCC(F)(F)c1ccccc1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000568937846 568253906 /nfs/dbraw/zinc/25/39/06/568253906.db2.gz OYQUKMYCAFAWDB-UHFFFAOYSA-N 0 0 372.274 3.718 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(N[C@H](c2nccn2C)c2ccccc2F)n1 ZINC000541935146 568254514 /nfs/dbraw/zinc/25/45/14/568254514.db2.gz INVZYYSEUQOCJM-HNNXBMFYSA-N 0 0 355.373 3.681 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(N2CCO[C@H](c3ccc(F)c(Cl)c3)C2)n1 ZINC000541935553 568254540 /nfs/dbraw/zinc/25/45/40/568254540.db2.gz YBAPHSGTMLOXSZ-HNNXBMFYSA-N 0 0 365.792 3.977 20 5 FHBDRN CC[C@@](C)(NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)C(F)(F)F ZINC000541935599 568257311 /nfs/dbraw/zinc/25/73/11/568257311.db2.gz BDVOZWHDWMTBDB-GFCCVEGCSA-N 0 0 356.247 3.657 20 5 FHBDRN Cc1ccc(C)c(N2CCN(C(=O)c3cc(Cl)cc([N+](=O)[O-])c3)CC2)c1 ZINC000482085622 568257949 /nfs/dbraw/zinc/25/79/49/568257949.db2.gz ZNECCPINUKZDFN-UHFFFAOYSA-N 0 0 373.840 3.827 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])N1C[C@@H](c2ccccc2)C2(CCC2)C1 ZINC000412667692 568258357 /nfs/dbraw/zinc/25/83/57/568258357.db2.gz HYRVVMSNDIOVEM-SFHVURJKSA-N 0 0 350.418 3.934 20 5 FHBDRN COc1ccc2c(c1)C[C@H](C)N(C(=O)Cc1ccccc1[N+](=O)[O-])[C@@H]2C ZINC000541934611 568261071 /nfs/dbraw/zinc/26/10/71/568261071.db2.gz RCGGSGOLASMRBF-UONOGXRCSA-N 0 0 354.406 3.680 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(N[C@@H](c2nccn2C)c2ccccc2F)n1 ZINC000541935147 568261085 /nfs/dbraw/zinc/26/10/85/568261085.db2.gz INVZYYSEUQOCJM-OAHLLOKOSA-N 0 0 355.373 3.681 20 5 FHBDRN CCOC(=O)c1ccnc(NCc2ccccc2OC2CCC2)c1[N+](=O)[O-] ZINC000150845860 568266136 /nfs/dbraw/zinc/26/61/36/568266136.db2.gz RENGRZVVCZWVDT-UHFFFAOYSA-N 0 0 371.393 3.710 20 5 FHBDRN Cc1nc(-c2noc([C@H](C)Oc3ccc(Cl)cc3[N+](=O)[O-])n2)co1 ZINC000569013748 568266503 /nfs/dbraw/zinc/26/65/03/568266503.db2.gz MXEBIPCVJGYMCH-ZETCQYMHSA-N 0 0 350.718 3.735 20 5 FHBDRN Cc1nc(-c2noc([C@@H](C)Oc3ccc(Cl)cc3[N+](=O)[O-])n2)co1 ZINC000569013747 568266550 /nfs/dbraw/zinc/26/65/50/568266550.db2.gz MXEBIPCVJGYMCH-SSDOTTSWSA-N 0 0 350.718 3.735 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N[C@H]1c2ccc(F)cc2O[C@H]1C ZINC000482131598 568269940 /nfs/dbraw/zinc/26/99/40/568269940.db2.gz PAWLVPFXZDNKCD-APPDUMDISA-N 0 0 359.357 3.994 20 5 FHBDRN CC(C)(NC(=O)C[C@@H]1OCCc2ccccc21)c1ccccc1[N+](=O)[O-] ZINC000569033613 568269991 /nfs/dbraw/zinc/26/99/91/568269991.db2.gz BFIOVCYTYYSBFC-SFHVURJKSA-N 0 0 354.406 3.650 20 5 FHBDRN C[C@@H]1C[C@H](c2ccc(C(F)(F)F)cc2)N(c2c([N+](=O)[O-])ncn2C)C1 ZINC000482105447 568275103 /nfs/dbraw/zinc/27/51/03/568275103.db2.gz ZEOVUJLXIABCGD-ZWNOBZJWSA-N 0 0 354.332 3.935 20 5 FHBDRN Cc1cc(C(=O)NC[C@H](c2ccccc2Cl)N(C)C)ccc1[N+](=O)[O-] ZINC000008262428 568285052 /nfs/dbraw/zinc/28/50/52/568285052.db2.gz YSJPOEQIJYUAIU-QGZVFWFLSA-N 0 0 361.829 3.589 20 5 FHBDRN CCCCn1ncc(NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)c1C ZINC000541959287 568285176 /nfs/dbraw/zinc/28/51/76/568285176.db2.gz SUSVJLWSCAOHMU-UHFFFAOYSA-N 0 0 368.340 3.754 20 5 FHBDRN CCOc1ccc(C(=O)N(C)Cc2ccc(Cl)s2)cc1[N+](=O)[O-] ZINC000008265588 568285296 /nfs/dbraw/zinc/28/52/96/568285296.db2.gz ONMJMCVUEQKAEE-UHFFFAOYSA-N 0 0 354.815 3.981 20 5 FHBDRN CC(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)cc1C ZINC000181964581 568288673 /nfs/dbraw/zinc/28/86/73/568288673.db2.gz BBEQYLZPDPUOCS-UHFFFAOYSA-N 0 0 364.304 3.960 20 5 FHBDRN COc1ccccc1[C@H](N[C@H](C)c1ccc([N+](=O)[O-])cc1)c1nccn1C ZINC000128774238 568290932 /nfs/dbraw/zinc/29/09/32/568290932.db2.gz LOKSQTNPYKGELE-KUHUBIRLSA-N 0 0 366.421 3.777 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1)CN(Cc1coc(-c3cccc(F)c3)n1)CCO2 ZINC000569055695 568292726 /nfs/dbraw/zinc/29/27/26/568292726.db2.gz OSMRMUMCYOIXQH-UHFFFAOYSA-N 0 0 369.352 3.784 20 5 FHBDRN O=[N+]([O-])c1ccn(C2CCN(Cc3cscc3C(F)(F)F)CC2)n1 ZINC000569057609 568293546 /nfs/dbraw/zinc/29/35/46/568293546.db2.gz CEDXZHCMSXAAFJ-UHFFFAOYSA-N 0 0 360.361 3.709 20 5 FHBDRN CC1(C)CN(C(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)[C@H]1c1cccs1 ZINC000569164050 568298277 /nfs/dbraw/zinc/29/82/77/568298277.db2.gz YHPQWTARSIXCGY-HNNXBMFYSA-N 0 0 360.391 3.608 20 5 FHBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1COc1cccc(C(=O)NC2CC2)c1 ZINC000517933645 568301397 /nfs/dbraw/zinc/30/13/97/568301397.db2.gz IEFWZLWPPZYVKU-UHFFFAOYSA-N 0 0 370.405 3.853 20 5 FHBDRN CO[C@H]1CCN(C(=O)c2ccc(SCCC(C)C)c([N+](=O)[O-])c2)C1 ZINC000482186610 568301451 /nfs/dbraw/zinc/30/14/51/568301451.db2.gz UGBSJUCDHOHAMD-AWEZNQCLSA-N 0 0 352.456 3.594 20 5 FHBDRN CN(C(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)c1cccc2ncccc21 ZINC000128783949 568307818 /nfs/dbraw/zinc/30/78/18/568307818.db2.gz UFCHUHRJHHEKMT-UHFFFAOYSA-N 0 0 373.372 3.605 20 5 FHBDRN O=C(NC[C@H]1CCCC[C@@H]1C(F)(F)F)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000482193700 568310678 /nfs/dbraw/zinc/31/06/78/568310678.db2.gz PNJDEVRNJVDFJD-SKDRFNHKSA-N 0 0 370.331 3.570 20 5 FHBDRN Cc1noc(-c2ccc(C)c(NC(=O)c3ccc([N+](=O)[O-])cc3C)c2)n1 ZINC000604562494 568311706 /nfs/dbraw/zinc/31/17/06/568311706.db2.gz HFEQXNHSVLLMOB-UHFFFAOYSA-N 0 0 352.350 3.822 20 5 FHBDRN COc1ccc(C(=O)NC[C@H]2CCCC[C@H]2C(F)(F)F)cc1[N+](=O)[O-] ZINC000482211542 568312975 /nfs/dbraw/zinc/31/29/75/568312975.db2.gz JVQPTKKYKDTJJN-VXGBXAGGSA-N 0 0 360.332 3.702 20 5 FHBDRN CCCc1cc(NC(=O)c2cc(Cl)cc(Cl)c2[N+](=O)[O-])n(C)n1 ZINC000291800273 568317195 /nfs/dbraw/zinc/31/71/95/568317195.db2.gz RHKGEMUDFWJABQ-UHFFFAOYSA-N 0 0 357.197 3.840 20 5 FHBDRN Cc1cc(C(=O)Nc2ccc(C(=O)NC(C)(C)C)cc2)ccc1[N+](=O)[O-] ZINC000031070402 568322773 /nfs/dbraw/zinc/32/27/73/568322773.db2.gz CAPOYQVPNAGRGG-UHFFFAOYSA-N 0 0 355.394 3.684 20 5 FHBDRN CCCOc1cc(CN2CCOc3ccc([N+](=O)[O-])cc3C2)ccc1OC ZINC000569296790 568344090 /nfs/dbraw/zinc/34/40/90/568344090.db2.gz KLDLYMHEXVVECE-UHFFFAOYSA-N 0 0 372.421 3.787 20 5 FHBDRN C[C@@]1(c2ccc(F)cc2)CCN(C(=O)NCc2cccc([N+](=O)[O-])c2)C1 ZINC000584695697 568348488 /nfs/dbraw/zinc/34/84/88/568348488.db2.gz DKTWVZZCLIIWOJ-LJQANCHMSA-N 0 0 357.385 3.607 20 5 FHBDRN CS[C@@H]1CCC[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000181995487 568371739 /nfs/dbraw/zinc/37/17/39/568371739.db2.gz BZQJGAITJZLUJY-GXSJLCMTSA-N 0 0 360.382 3.600 20 5 FHBDRN CCN(CC)S(=O)(=O)c1ccc(OCC2CCCCC2)c([N+](=O)[O-])c1 ZINC000005193099 568376865 /nfs/dbraw/zinc/37/68/65/568376865.db2.gz LKNLIWWTFQJGPU-UHFFFAOYSA-N 0 0 370.471 3.584 20 5 FHBDRN CCSc1nnc(SCC(=O)Nc2c(C)cccc2[N+](=O)[O-])s1 ZINC000005450290 568385610 /nfs/dbraw/zinc/38/56/10/568385610.db2.gz KFGHOAUNGKBHEP-UHFFFAOYSA-N 0 0 370.481 3.598 20 5 FHBDRN COc1ccc(NC(=O)CCc2c(C)nn(CC(C)C)c2C)cc1[N+](=O)[O-] ZINC000541998577 568389470 /nfs/dbraw/zinc/38/94/70/568389470.db2.gz UPKONLVAJQULRB-UHFFFAOYSA-N 0 0 374.441 3.644 20 5 FHBDRN O=[N+]([O-])c1ccc(C(F)(F)F)c(CNc2cccc3c2OCCO3)c1 ZINC000453076746 568391366 /nfs/dbraw/zinc/39/13/66/568391366.db2.gz MMFZYNZVHJTSJB-UHFFFAOYSA-N 0 0 354.284 3.997 20 5 FHBDRN Cc1c(C(=O)Nc2cccc([N+](=O)[O-])c2C)cnn1-c1ccc(F)cc1F ZINC000032659997 568395655 /nfs/dbraw/zinc/39/56/55/568395655.db2.gz GYXVELNVHMTPMX-UHFFFAOYSA-N 0 0 372.331 3.928 20 5 FHBDRN Cc1nc(NC(=O)[C@H](C)Cc2cncc3ccccc32)ccc1[N+](=O)[O-] ZINC000569405779 568401038 /nfs/dbraw/zinc/40/10/38/568401038.db2.gz UYDVOAANARSUIP-GFCCVEGCSA-N 0 0 350.378 3.664 20 5 FHBDRN C[C@H](Nc1ccc(C(=O)N2CCC[C@@H](F)C2)cc1[N+](=O)[O-])c1ccccn1 ZINC000569586369 568408633 /nfs/dbraw/zinc/40/86/33/568408633.db2.gz NMYILHOYLKKONJ-DZGCQCFKSA-N 0 0 372.400 3.737 20 5 FHBDRN C[C@H](CNC(=O)c1ccc([N+](=O)[O-])cc1Br)CC(F)(F)F ZINC000412678933 568411279 /nfs/dbraw/zinc/41/12/79/568411279.db2.gz OUFZYGLCKMJBRY-ZETCQYMHSA-N 0 0 369.137 3.676 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CC[C@@](F)(c3ccccc3)C2)c(Br)c1 ZINC000569710456 568413354 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FHBDRN C[C@H](SCCOc1cccc(-c2nn[nH]n2)c1)c1ccccc1[N+](=O)[O-] ZINC000820550568 599222346 /nfs/dbraw/zinc/22/23/46/599222346.db2.gz WUJWAMKSPGTRPP-LBPRGKRZSA-N 0 0 371.422 3.648 20 5 FHBDRN O=C([O-])c1ccc(C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)cc1 ZINC000426710682 597137136 /nfs/dbraw/zinc/13/71/36/597137136.db2.gz XDOQYMHIPZFPQN-UHFFFAOYSA-N 0 0 352.346 3.843 20 5 FHBDRN CC(C)(C)Sc1ccc(Nc2ncc([N+](=O)[O-])cc2-c2nn[nH]n2)cc1 ZINC000735643031 598499762 /nfs/dbraw/zinc/49/97/62/598499762.db2.gz KGZNFLVGMOHCOR-UHFFFAOYSA-N 0 0 371.426 3.804 20 5 FHBDRN O=[N+]([O-])c1ccc(N[C@@H]2CCSc3ccc(F)cc32)c(-c2nn[nH]n2)c1 ZINC000823639825 599321683 /nfs/dbraw/zinc/32/16/83/599321683.db2.gz HYRDTPQIYAPXDS-CQSZACIVSA-N 0 0 372.385 3.563 20 5 FHBDRN C[C@H](SCCOc1cccc([N+](=O)[O-])c1)c1ccc(-c2nn[nH]n2)cc1 ZINC000736188611 599325964 /nfs/dbraw/zinc/32/59/64/599325964.db2.gz LQUMKNKMSWRKGK-LBPRGKRZSA-N 0 0 371.422 3.648 20 5 FHBDRN C[C@@H](SCCOc1ccc([N+](=O)[O-])cc1)c1ccc(-c2nn[nH]n2)cc1 ZINC000736190999 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3.993 20 5 FHBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1Oc1ccc(Cl)c(-c2nn[nH]n2)n1 ZINC000822201181 606467229 /nfs/dbraw/zinc/46/72/29/606467229.db2.gz UVCJVRCKZMBFAX-UHFFFAOYSA-N 0 0 367.152 3.577 20 5 FHBDRN O=[N+]([O-])c1ccc(NC[C@@H]2CCC[C@@H](C(F)(F)F)C2)c(-c2nn[nH]n2)c1 ZINC000823640059 606595918 /nfs/dbraw/zinc/59/59/18/606595918.db2.gz QSFWOTYPYDXZNW-NXEZZACHSA-N 0 0 370.335 3.556 20 5 FHBDRN O=[N+]([O-])c1ccc(Cl)c(CNc2c(Cl)cccc2-c2nn[nH]n2)c1 ZINC000823639449 606801383 /nfs/dbraw/zinc/80/13/83/606801383.db2.gz AMVSOQYIXSYJHK-UHFFFAOYSA-N 0 0 365.180 3.694 20 5 FHBDRN O=[N+]([O-])c1cc(C(F)(F)F)ccc1Oc1ccc(-c2nn[nH]n2)cc1F ZINC000823635334 607129628 /nfs/dbraw/zinc/12/96/28/607129628.db2.gz VYLNZDIECTXPDX-UHFFFAOYSA-N 0 0 369.234 3.725 20 5 FHBDRN O=[N+]([O-])c1ccc(Oc2cccc(F)c2-c2nn[nH]n2)cc1C(F)(F)F ZINC000826499343 607934630 /nfs/dbraw/zinc/93/46/30/607934630.db2.gz FLGCTDAMGLYBDW-UHFFFAOYSA-N 0 0 369.234 3.725 20 5 FHBDRN O=[N+]([O-])c1ccc(CNc2ccc(-c3nn[nH]n3)cc2Cl)c(Cl)c1 ZINC000826498023 609445035 /nfs/dbraw/zinc/44/50/35/609445035.db2.gz DRLHEQWMHLNTCO-UHFFFAOYSA-N 0 0 365.180 3.694 20 5 FHBDRN Cc1cc(C(=O)OCC(=O)c2cccc(C(F)(F)F)c2)ccc1[N+](=O)[O-] ZINC000024212592 936316249 /nfs/dbraw/zinc/31/62/49/936316249.db2.gz ARXSAZLSKDCMAN-UHFFFAOYSA-N 0 0 367.279 3.962 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N2CCO[C@H](c3cccs3)C2)c1 ZINC000161930847 936323677 /nfs/dbraw/zinc/32/36/77/936323677.db2.gz HOEBFFCZGXPSFT-AWEZNQCLSA-N 0 0 364.448 3.592 20 5 FHBDRN CCC(CC)c1cc(CNC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)on1 ZINC000135906416 936332512 /nfs/dbraw/zinc/33/25/12/936332512.db2.gz MXPLIUQFWRUTLF-UHFFFAOYSA-N 0 0 370.409 3.827 20 5 FHBDRN Cc1nn(C)c(NCc2cccc(COCc3ccco3)c2)c1[N+](=O)[O-] ZINC000052040208 936357134 /nfs/dbraw/zinc/35/71/34/936357134.db2.gz XSIFXQWEDRQMQE-UHFFFAOYSA-N 0 0 356.382 3.559 20 5 FHBDRN COC(=O)c1ccc(Br)c(Nc2ccc(C)c([N+](=O)[O-])c2)n1 ZINC001213663662 936359742 /nfs/dbraw/zinc/35/97/42/936359742.db2.gz RLYNTXGOTSABFL-UHFFFAOYSA-N 0 0 366.171 3.591 20 5 FHBDRN O=C(c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1)N1CCn2nccc21 ZINC000583015417 936368881 /nfs/dbraw/zinc/36/88/81/936368881.db2.gz HJNFARUWLFNOMN-UHFFFAOYSA-N 0 0 366.402 3.603 20 5 FHBDRN Cc1ccc(C(=O)N2CCC(Nc3ncc(Cl)cc3[N+](=O)[O-])CC2)cc1 ZINC000153685129 936383271 /nfs/dbraw/zinc/38/32/71/936383271.db2.gz KZLLGBHMVLRWED-UHFFFAOYSA-N 0 0 374.828 3.668 20 5 FHBDRN CC1(C)[C@H](NC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)[C@H]2CCO[C@@H]21 ZINC000278052932 937085900 /nfs/dbraw/zinc/08/59/00/937085900.db2.gz DJZDZSWDGZYPDL-YSGRDPCXSA-N 0 0 362.429 3.637 20 5 FHBDRN COC(=O)c1cc(C(C)C)ccc1NC(=O)c1cccc(OC)c1[N+](=O)[O-] ZINC000435756417 937088926 /nfs/dbraw/zinc/08/89/26/937088926.db2.gz QZHPKMOQMHMVRA-UHFFFAOYSA-N 0 0 372.377 3.766 20 5 FHBDRN COc1ccc(NC(=O)N(Cc2cccc(O)c2)CC2CC2)cc1[N+](=O)[O-] ZINC000514820971 937090253 /nfs/dbraw/zinc/09/02/53/937090253.db2.gz WLMGPJOATQNPQR-UHFFFAOYSA-N 0 0 371.393 3.753 20 5 FHBDRN Cn1c(C(=O)Nc2ccc(Br)cc2Cl)ccc1[N+](=O)[O-] ZINC000514846839 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MHFLVBJYZCQMBP-HFBDOXOYSA-N 0 0 356.407 3.965 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2noc(-c3c(C(F)F)nc4n3CCCC4)n2)c1 ZINC000866845309 927198416 /nfs/dbraw/zinc/19/84/16/927198416.db2.gz DURLWJQORBEWFN-UHFFFAOYSA-N 0 0 361.308 3.782 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCc1cccc2c1OCCCO2 ZINC000120100643 927206868 /nfs/dbraw/zinc/20/68/68/927206868.db2.gz PMXCJIKYMBQVPW-UHFFFAOYSA-N 0 0 371.393 3.695 20 5 FHBDRN COc1cc(C(=O)NCc2oc3ccccc3c2C)cc([N+](=O)[O-])c1OC ZINC000610175967 927212192 /nfs/dbraw/zinc/21/21/92/927212192.db2.gz PTKHEPIDWCIHSL-UHFFFAOYSA-N 0 0 370.361 3.597 20 5 FHBDRN COc1cc(C(=O)N[C@@H](C)c2cccc(C)c2C)cc([N+](=O)[O-])c1OC ZINC000610176447 927245531 /nfs/dbraw/zinc/24/55/31/927245531.db2.gz MGGQOBXUQBQBDE-ZDUSSCGKSA-N 0 0 358.394 3.720 20 5 FHBDRN COc1cc(C(=O)N(C)CC2CCCCC2)c([N+](=O)[O-])cc1OC(F)F ZINC000044710731 927262805 /nfs/dbraw/zinc/26/28/05/927262805.db2.gz PPIHTZJPUFQQLQ-UHFFFAOYSA-N 0 0 372.368 3.857 20 5 FHBDRN Cc1c(F)ccc([N+](=O)[O-])c1C(=O)OCc1nc(-c2ccsc2)no1 ZINC001266263637 927279048 /nfs/dbraw/zinc/27/90/48/927279048.db2.gz PIELLNXAJICCLQ-UHFFFAOYSA-N 0 0 363.326 3.511 20 5 FHBDRN C[C@H](C(=O)N[C@H]1CCCN(C)c2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000583128206 937150155 /nfs/dbraw/zinc/15/01/55/937150155.db2.gz QXZHURWSWOUQMV-KSSFIOAISA-N 0 0 353.422 3.786 20 5 FHBDRN C[C@H](CNC(=O)c1cc([N+](=O)[O-])ccc1SCCO)C1CCCCC1 ZINC000598439089 927305551 /nfs/dbraw/zinc/30/55/51/927305551.db2.gz FJOUIQKEXMQFNL-CYBMUJFWSA-N 0 0 366.483 3.625 20 5 FHBDRN C[C@@H](c1ccc([S@](C)=O)cc1)N(C)c1ncc(Cl)cc1[N+](=O)[O-] ZINC000153891048 927315902 /nfs/dbraw/zinc/31/59/02/927315902.db2.gz HWJDORSTGLQUHW-SDWAUSNYSA-N 0 0 353.831 3.578 20 5 FHBDRN COc1cccc(C(=O)NCC(F)(F)c2ccc(Cl)cc2)c1[N+](=O)[O-] ZINC000557694299 927325660 /nfs/dbraw/zinc/32/56/60/927325660.db2.gz VNNYKFCUHYUFQW-UHFFFAOYSA-N 0 0 370.739 3.779 20 5 FHBDRN COc1ccccc1[C@]1(C)C[C@@H]1NC(=O)c1cc(SC)ccc1[N+](=O)[O-] ZINC000610181621 927400252 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Cc1c(CN2CCN(Cc3ccccc3Cl)CC2)cccc1[N+](=O)[O-] ZINC001167655942 937171304 /nfs/dbraw/zinc/17/13/04/937171304.db2.gz DRRTVCRKXMFUQY-UHFFFAOYSA-N 0 0 359.857 3.874 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@@H](c2cc(C)ccn2)C1 ZINC000583153197 937179483 /nfs/dbraw/zinc/17/94/83/937179483.db2.gz IXJVOGZAQGWQLE-ZWKOTPCHSA-N 0 0 367.449 3.883 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)COc1ccccc1C(F)(F)F ZINC000248012452 937176141 /nfs/dbraw/zinc/17/61/41/937176141.db2.gz ZMXAQQOHFBDXJY-UHFFFAOYSA-N 0 0 354.284 3.940 20 5 FHBDRN CCCCC1CCC(NS(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000063198802 927613769 /nfs/dbraw/zinc/61/37/69/927613769.db2.gz GHXDCEIVCGQDFQ-UHFFFAOYSA-N 0 0 354.472 3.763 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc2c(c1)OCCCO2 ZINC000022652918 927645692 /nfs/dbraw/zinc/64/56/92/927645692.db2.gz ZDCBADMUUOUXGK-LBPRGKRZSA-N 0 0 374.418 3.875 20 5 FHBDRN CC[C@](C)(NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl)c1nccs1 ZINC000153955992 927673033 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O=[N+]([O-])c1ccc(N2CCN(Cc3cc(Cl)ccc3Cl)CC2)cn1 ZINC000610212764 928131101 /nfs/dbraw/zinc/13/11/01/928131101.db2.gz YQYLQHKQUWQBKI-UHFFFAOYSA-N 0 0 367.236 3.619 20 5 FHBDRN COCCOc1cccc(NC(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)c1 ZINC000120323928 928132913 /nfs/dbraw/zinc/13/29/13/928132913.db2.gz ZFWQJDNGKGMHOE-UHFFFAOYSA-N 0 0 359.382 3.881 20 5 FHBDRN CC(C)n1ncc2cc(CN3c4ccc([N+](=O)[O-])cc4C[C@H]3C)cnc21 ZINC000728201580 928136402 /nfs/dbraw/zinc/13/64/02/928136402.db2.gz OPWAVEZNFGVNMB-CYBMUJFWSA-N 0 0 351.410 3.872 20 5 FHBDRN Cc1ccc(NC(=O)Nc2ccc(O[C@@H]3CCOC3)cc2)cc1[N+](=O)[O-] ZINC000157524758 928137542 /nfs/dbraw/zinc/13/75/42/928137542.db2.gz PZNBGCVWSVQUII-MRXNPFEDSA-N 0 0 357.366 3.715 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)NCCSCC(F)(F)F)cc1[N+](=O)[O-] ZINC000535815676 928155868 /nfs/dbraw/zinc/15/58/68/928155868.db2.gz ZUOMTXRPLAYIJX-UHFFFAOYSA-N 0 0 364.389 3.918 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1CN(C)Cc1ccccc1N1CCCC1 ZINC000430214249 928182093 /nfs/dbraw/zinc/18/20/93/928182093.db2.gz YBYXVIKWPVMXBS-UHFFFAOYSA-N 0 0 355.438 3.836 20 5 FHBDRN CC(=O)c1ccc(OS(=O)(=O)c2cccc([N+](=O)[O-])c2C)c(Cl)c1 ZINC000120348548 928208979 /nfs/dbraw/zinc/20/89/79/928208979.db2.gz JZHNAUWQGOTQFX-UHFFFAOYSA-N 0 0 369.782 3.527 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1F)N1CC2(CCC2)[C@@H]1C1CCOCC1 ZINC000583198396 937229108 /nfs/dbraw/zinc/22/91/08/937229108.db2.gz KIEKFMMJNLHUDV-INIZCTEOSA-N 0 0 363.389 3.547 20 5 FHBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)NCCc1ccc(F)cc1 ZINC000014898685 928235045 /nfs/dbraw/zinc/23/50/45/928235045.db2.gz ZTKGBMZAZAVPTM-UHFFFAOYSA-N 0 0 374.415 3.653 20 5 FHBDRN COc1ccc(-c2noc(CN3c4ccc([N+](=O)[O-])cc4C[C@H]3C)n2)cc1 ZINC000728202083 928245978 /nfs/dbraw/zinc/24/59/78/928245978.db2.gz XHMYROWKZOFNOT-GFCCVEGCSA-N 0 0 366.377 3.605 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1OC(=O)[C@H]1CCCCN1C(=O)c1cccs1 ZINC000097427081 928252816 /nfs/dbraw/zinc/25/28/16/928252816.db2.gz ATEFSPVDBRDOPS-CQSZACIVSA-N 0 0 374.418 3.565 20 5 FHBDRN COCCCn1nccc1/C=C(/c1ccncc1)c1ccc([N+](=O)[O-])cc1 ZINC000559137494 928279080 /nfs/dbraw/zinc/27/90/80/928279080.db2.gz HWORNVSSWPCJPW-HMMYKYKNSA-N 0 0 364.405 3.812 20 5 FHBDRN CCOc1cc2c(cc1CNC(=O)c1cc(C)ccc1[N+](=O)[O-])O[C@H](C)C2 ZINC000610221224 928285348 /nfs/dbraw/zinc/28/53/48/928285348.db2.gz BXNOXIYMAATBFS-CYBMUJFWSA-N 0 0 370.405 3.555 20 5 FHBDRN O=C(OCCSc1ccc([N+](=O)[O-])cc1)c1cc2ccccc2[nH]c1=O ZINC000784939000 928308926 /nfs/dbraw/zinc/30/89/26/928308926.db2.gz PAIXQIFKKIOHEJ-UHFFFAOYSA-N 0 0 370.386 3.798 20 5 FHBDRN O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(OCc2ccccc2)nc1 ZINC000610224778 928310696 /nfs/dbraw/zinc/31/06/96/928310696.db2.gz QRUUZNCHZLOEDT-UHFFFAOYSA-N 0 0 363.373 3.750 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N1CCC[C@@H](C(F)(F)F)[C@@H]1C ZINC000471162512 928312378 /nfs/dbraw/zinc/31/23/78/928312378.db2.gz PWKYRFDGKQBUGU-WDEREUQCSA-N 0 0 360.332 3.797 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1CN1CC(c2nc3ccccc3s2)C1 ZINC000430227507 928315215 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Cc1cccc(C2=CCN(C(=O)NCCc3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000536408708 930488420 /nfs/dbraw/zinc/48/84/20/930488420.db2.gz UQDXWWDFUNWTOS-UHFFFAOYSA-N 0 0 365.433 3.945 20 5 FHBDRN C[C@H]1C[C@@H](CNC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)CCO1 ZINC000275834646 930510673 /nfs/dbraw/zinc/51/06/73/930510673.db2.gz BKEJWOVMUCWJAD-KBPBESRZSA-N 0 0 350.418 3.639 20 5 FHBDRN CC1(CNC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)CCOCC1 ZINC000278243855 937419702 /nfs/dbraw/zinc/41/97/02/937419702.db2.gz VFTMQZROJQVANQ-UHFFFAOYSA-N 0 0 350.418 3.640 20 5 FHBDRN Cn1cc(CNc2ccc3cc([N+](=O)[O-])ccc3n2)c(C(F)(F)F)n1 ZINC000119003807 930529566 /nfs/dbraw/zinc/52/95/66/930529566.db2.gz BAGRFTHYVZMARC-UHFFFAOYSA-N 0 0 351.288 3.507 20 5 FHBDRN O=C(N[C@H](c1cc2ccccc2o1)c1ccccc1)c1c[nH]nc1[N+](=O)[O-] ZINC000548084333 930569986 /nfs/dbraw/zinc/56/99/86/930569986.db2.gz MACVYLQLVNPIGP-KRWDZBQOSA-N 0 0 362.345 3.584 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)c1ccc2[nH]c(=O)oc2c1 ZINC000611768628 937431227 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Cc1cc(C)cc(OCCNC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)c1 ZINC000109914466 930650439 /nfs/dbraw/zinc/65/04/39/930650439.db2.gz LFTAUWYFTJZCLY-UHFFFAOYSA-N 0 0 353.378 3.502 20 5 FHBDRN CC(=O)c1ccc(OCC(=O)Nc2cc(Cl)ccc2C)c([N+](=O)[O-])c1 ZINC000119097952 930661405 /nfs/dbraw/zinc/66/14/05/930661405.db2.gz OJSKWUVJACXUHP-UHFFFAOYSA-N 0 0 362.769 3.777 20 5 FHBDRN CC(=O)c1ccc(OCC(=O)Nc2ccc(F)cc2Cl)c([N+](=O)[O-])c1 ZINC000119099530 930661587 /nfs/dbraw/zinc/66/15/87/930661587.db2.gz RIHMHAVNRGGYSD-UHFFFAOYSA-N 0 0 366.732 3.607 20 5 FHBDRN COc1c(-c2nc(-c3ccc(OC(F)F)cc3)no2)cccc1[N+](=O)[O-] ZINC000579642806 930686715 /nfs/dbraw/zinc/68/67/15/930686715.db2.gz XZPXFOHDAASKJV-UHFFFAOYSA-N 0 0 363.276 3.922 20 5 FHBDRN CC(=O)c1ccc(OCc2cc(Cl)c3c(c2)OCCO3)c([N+](=O)[O-])c1 ZINC000119114155 930692031 /nfs/dbraw/zinc/69/20/31/930692031.db2.gz WSWKCGNOZLFTBX-UHFFFAOYSA-N 0 0 363.753 3.801 20 5 FHBDRN Cc1csc(C[C@@H]2CCCN(C(=O)c3cc([N+](=O)[O-])ccc3F)C2)n1 ZINC000924346735 930693084 /nfs/dbraw/zinc/69/30/84/930693084.db2.gz PEOMKKYNMXJQNP-LBPRGKRZSA-N 0 0 363.414 3.594 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)NCc2ccc(OC(C)C)nc2)cc1[N+](=O)[O-] ZINC000175812783 930717926 /nfs/dbraw/zinc/71/79/26/930717926.db2.gz FGPHHLSREIJRSU-AWEZNQCLSA-N 0 0 372.425 3.646 20 5 FHBDRN Cn1nc(-c2ccc(F)cc2F)cc1NC(=O)c1csc([N+](=O)[O-])c1 ZINC000579671830 930741324 /nfs/dbraw/zinc/74/13/24/930741324.db2.gz DVYAROXFKQEDQM-UHFFFAOYSA-N 0 0 364.333 3.587 20 5 FHBDRN COc1ccc(CNC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)cc1 ZINC000050256943 930746705 /nfs/dbraw/zinc/74/67/05/930746705.db2.gz KTGHLPKLADMPGW-UHFFFAOYSA-N 0 0 369.402 3.657 20 5 FHBDRN COc1ccc(CNC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000050256922 930747152 /nfs/dbraw/zinc/74/71/52/930747152.db2.gz XJHGHFJMPZVPFF-UHFFFAOYSA-N 0 0 369.402 3.657 20 5 FHBDRN CC(=O)c1ccc(OCC(=O)N[C@H](c2ccccc2)C(C)C)c([N+](=O)[O-])c1 ZINC000119165638 930796351 /nfs/dbraw/zinc/79/63/51/930796351.db2.gz HRJWFMDZENJCPE-FQEVSTJZSA-N 0 0 370.405 3.690 20 5 FHBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)NCc1cccs1 ZINC000580530906 930813409 /nfs/dbraw/zinc/81/34/09/930813409.db2.gz FHHPWDFZGBTXIZ-UHFFFAOYSA-N 0 0 355.213 3.657 20 5 FHBDRN O=C(NCCOc1ccccc1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000050290449 930823238 /nfs/dbraw/zinc/82/32/38/930823238.db2.gz WPUJHLZNYLKNHM-UHFFFAOYSA-N 0 0 369.402 3.527 20 5 FHBDRN CC(=O)Nc1ccc(C)c2c1CCCN2C(=O)c1csc([N+](=O)[O-])c1 ZINC000275909830 930830469 /nfs/dbraw/zinc/83/04/69/930830469.db2.gz WAWFYUFZGRLTGD-UHFFFAOYSA-N 0 0 359.407 3.516 20 5 FHBDRN CCO[C@H](C)c1nc(COc2ccc(C(C)=O)cc2[N+](=O)[O-])cs1 ZINC000119185878 930830571 /nfs/dbraw/zinc/83/05/71/930830571.db2.gz LPEHVFSDJXPURQ-LLVKDONJSA-N 0 0 350.396 3.930 20 5 FHBDRN CN(CCc1cccs1)c1nnc(-c2cccc([N+](=O)[O-])c2)n1C1CC1 ZINC000580575318 930871687 /nfs/dbraw/zinc/87/16/87/930871687.db2.gz MEZZYFAMXZPLKF-UHFFFAOYSA-N 0 0 369.450 3.929 20 5 FHBDRN Cc1ccc(Br)cc1NC(=O)COc1ccccc1[N+](=O)[O-] ZINC000046372712 930874337 /nfs/dbraw/zinc/87/43/37/930874337.db2.gz RAUMYDWMKIHRSF-UHFFFAOYSA-N 0 0 365.183 3.683 20 5 FHBDRN CCOC(=O)[C@@H]1CC[C@H](C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1 ZINC001266630978 930921106 /nfs/dbraw/zinc/92/11/06/930921106.db2.gz IQHPLQPHZONXES-VHSXEESVSA-N 0 0 374.315 3.532 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N1CCN(C)C[C@H]1c1ccccc1 ZINC000580645820 930960492 /nfs/dbraw/zinc/96/04/92/930960492.db2.gz BDZJZFSQFZOVNV-IBGZPJMESA-N 0 0 368.437 3.678 20 5 FHBDRN O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N(Cc1ccco1)C[C@H]1CCCO1 ZINC000119266545 931000515 /nfs/dbraw/zinc/00/05/15/931000515.db2.gz JFIHHGIYKXZSGB-MRXNPFEDSA-N 0 0 364.785 3.663 20 5 FHBDRN CCOc1ccc(C(=O)N2C[C@@H](CC)Oc3ccccc32)cc1[N+](=O)[O-] ZINC000071500072 931009123 /nfs/dbraw/zinc/00/91/23/931009123.db2.gz APQNHFWNPZHIHB-CQSZACIVSA-N 0 0 356.378 3.811 20 5 FHBDRN C[C@H]1C[C@H](NC(=O)c2cc(F)cc3c(=O)c4cc(F)ccc4[nH]c23)CS1 ZINC000580701087 931022104 /nfs/dbraw/zinc/02/21/04/931022104.db2.gz HOOWUPPWMPWUQJ-CABZTGNLSA-N 0 0 374.412 3.583 20 5 FHBDRN CCCOc1ccc(COC(=O)CCNc2ccccc2[N+](=O)[O-])cc1 ZINC001125467876 931054033 /nfs/dbraw/zinc/05/40/33/931054033.db2.gz OTFGKAMONFFWFF-UHFFFAOYSA-N 0 0 358.394 3.929 20 5 FHBDRN O=C(COc1ccccc1[N+](=O)[O-])Nc1ncc(-c2ccccc2)s1 ZINC000119308552 931068595 /nfs/dbraw/zinc/06/85/95/931068595.db2.gz WCVQNCOZQWPOGY-UHFFFAOYSA-N 0 0 355.375 3.736 20 5 FHBDRN C[C@H](NC(=O)CCCNc1ccc([N+](=O)[O-])cc1)c1ccc(F)c(F)c1 ZINC000023794032 931071574 /nfs/dbraw/zinc/07/15/74/931071574.db2.gz YSYXAGYFRRWZJX-LBPRGKRZSA-N 0 0 363.364 3.943 20 5 FHBDRN O=C(Nc1ccc(OCC2CCOCC2)cc1)c1ccc([N+](=O)[O-])cc1F ZINC000135065350 931092175 /nfs/dbraw/zinc/09/21/75/931092175.db2.gz VLXMNHDYJHDNIS-UHFFFAOYSA-N 0 0 374.368 3.792 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)Nc1nnc(C(C)(C)C)s1 ZINC000275955230 931102627 /nfs/dbraw/zinc/10/26/27/931102627.db2.gz VALQOVVZIHYJMM-UHFFFAOYSA-N 0 0 354.819 3.958 20 5 FHBDRN CC(C)(C)n1cc(NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)cn1 ZINC000119324906 931211484 /nfs/dbraw/zinc/21/14/84/931211484.db2.gz XVMKTFIWFKCWKW-UHFFFAOYSA-N 0 0 367.203 3.561 20 5 FHBDRN O=C(NCCCCc1ccc(F)c(F)c1)NCc1cccc([N+](=O)[O-])c1 ZINC000548137257 931211490 /nfs/dbraw/zinc/21/14/90/931211490.db2.gz QPDLZRYXEFDFRF-UHFFFAOYSA-N 0 0 363.364 3.695 20 5 FHBDRN CSc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC[C@@H]([C@H]2CCOC2)C1 ZINC000891326882 931212959 /nfs/dbraw/zinc/21/29/59/931212959.db2.gz WHGMHPFXZIVNPT-KGLIPLIRSA-N 0 0 364.467 3.596 20 5 FHBDRN CNc1ccc(C(=O)Nc2c(C)noc2-c2ccccc2)cc1[N+](=O)[O-] ZINC000548137619 931216745 /nfs/dbraw/zinc/21/67/45/931216745.db2.gz UTEHKQQNPINERP-UHFFFAOYSA-N 0 0 352.350 3.852 20 5 FHBDRN COc1ccc(F)cc1[C@@H](C)NC(=O)c1cc(SC)ccc1[N+](=O)[O-] ZINC000046403038 931238479 /nfs/dbraw/zinc/23/84/79/931238479.db2.gz SVNWCHQWXBOESK-SNVBAGLBSA-N 0 0 364.398 3.955 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCCC[C@H]([C@@H]2CCOC2)C1 ZINC000891334399 931253487 /nfs/dbraw/zinc/25/34/87/931253487.db2.gz IRTDCOCQILZVDV-CEXWTWQISA-N 0 0 374.481 3.829 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)Cc2ccc(OC(F)F)cc2)cc1[N+](=O)[O-] ZINC000177839277 931267771 /nfs/dbraw/zinc/26/77/71/931267771.db2.gz JRHDLCFWLAACRS-LBPRGKRZSA-N 0 0 364.348 3.925 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)Cc2ccc(-n3cccn3)cc2)cc1[N+](=O)[O-] ZINC000177846267 931286414 /nfs/dbraw/zinc/28/64/14/931286414.db2.gz YJSGWCNBOMNHDJ-OAHLLOKOSA-N 0 0 364.405 3.509 20 5 FHBDRN COc1cccc(SCC(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000177850644 931291417 /nfs/dbraw/zinc/29/14/17/931291417.db2.gz CGAIMQDZENKTJP-ZDUSSCGKSA-N 0 0 360.435 3.881 20 5 FHBDRN Cc1nn(C(C)(C)C)cc1[C@H](C)NCc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000157789426 931318319 /nfs/dbraw/zinc/31/83/19/931318319.db2.gz FCEZQPLHAGTRDR-NSHDSACASA-N 0 0 357.414 3.847 20 5 FHBDRN CCC(CC)C(=O)N1CCN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC1 ZINC000610468391 931322600 /nfs/dbraw/zinc/32/26/00/931322600.db2.gz XKWNHZOZUKUOGP-UHFFFAOYSA-N 0 0 373.375 3.698 20 5 FHBDRN Cn1cnc([N+](=O)[O-])c1CSCc1csc(-c2cccs2)n1 ZINC000476992110 931335558 /nfs/dbraw/zinc/33/55/58/931335558.db2.gz DLQPWTIUYJYSCZ-UHFFFAOYSA-N 0 0 352.466 3.947 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H]1CCCN(c2ccccc2)C1 ZINC000580921108 931346150 /nfs/dbraw/zinc/34/61/50/931346150.db2.gz CNMHMPBNMCUVPJ-INIZCTEOSA-N 0 0 368.437 3.948 20 5 FHBDRN CSc1ccc(C(=O)N2CCCC[C@H]([C@H]3CCOC3)C2)cc1[N+](=O)[O-] ZINC000891343206 931347256 /nfs/dbraw/zinc/34/72/56/931347256.db2.gz SRIMORYTOBPJBX-GJZGRUSLSA-N 0 0 364.467 3.596 20 5 FHBDRN CSc1ccc(C(=O)N2CCCC[C@H]([C@@H]3CCOC3)C2)cc1[N+](=O)[O-] ZINC000891343208 931347568 /nfs/dbraw/zinc/34/75/68/931347568.db2.gz SRIMORYTOBPJBX-LSDHHAIUSA-N 0 0 364.467 3.596 20 5 FHBDRN COc1c(C(=O)N[C@@H](C)c2cc3cccc(F)c3o2)cccc1[N+](=O)[O-] ZINC000476994981 931376011 /nfs/dbraw/zinc/37/60/11/931376011.db2.gz KWEFOQIALGPBHF-JTQLQIEISA-N 0 0 358.325 3.980 20 5 FHBDRN CN(c1cccc2ccccc21)S(=O)(=O)CCc1ccccc1[N+](=O)[O-] ZINC000156717326 931382361 /nfs/dbraw/zinc/38/23/61/931382361.db2.gz FXAXOARSQZKBEF-UHFFFAOYSA-N 0 0 370.430 3.757 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H](c1ccccc1)C(C)(C)C ZINC000126087465 931382404 /nfs/dbraw/zinc/38/24/04/931382404.db2.gz AJDVVXPMEQGLAG-KRWDZBQOSA-N 0 0 369.421 3.745 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)COc2ccc(F)cc2Cl)cc1[N+](=O)[O-] ZINC000177864674 931391879 /nfs/dbraw/zinc/39/18/79/931391879.db2.gz BHHQSUREGBYHQD-NSHDSACASA-N 0 0 366.776 3.952 20 5 FHBDRN COc1cc(CCC(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc(OC)c1 ZINC000177864358 931392068 /nfs/dbraw/zinc/39/20/68/931392068.db2.gz UYQOUQCMTDZNFB-AWEZNQCLSA-N 0 0 372.421 3.730 20 5 FHBDRN COc1ccccc1[C@@]1(C)C[C@H]1NC(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000610181889 931396488 /nfs/dbraw/zinc/39/64/88/931396488.db2.gz KTXVZAWGUXHTIT-UYAOXDASSA-N 0 0 366.373 3.810 20 5 FHBDRN COC(=O)c1ccc2c(c1)CN(c1ccc([N+](=O)[O-])c(C(F)(F)F)c1)C2 ZINC000610470695 931406747 /nfs/dbraw/zinc/40/67/47/931406747.db2.gz DKSPRBNGNMTVPK-UHFFFAOYSA-N 0 0 366.295 3.920 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)c2ccn(-c3ccccc3)n2)cc1[N+](=O)[O-] ZINC000177874177 931429920 /nfs/dbraw/zinc/42/99/20/931429920.db2.gz OFRVJALMZUGTHN-AWEZNQCLSA-N 0 0 350.378 3.580 20 5 FHBDRN CC(C)(NC(=O)CCc1nc2ccccc2o1)c1ccc([N+](=O)[O-])cc1 ZINC000430531460 931431978 /nfs/dbraw/zinc/43/19/78/931431978.db2.gz VCYPVUQSYDTSJG-UHFFFAOYSA-N 0 0 353.378 3.720 20 5 FHBDRN CC[C@@H](NC(=O)c1ccccc1)c1noc(-c2ccc(C)c([N+](=O)[O-])c2)n1 ZINC000580980423 931440903 /nfs/dbraw/zinc/44/09/03/931440903.db2.gz NRFVAQLSSLMRIW-OAHLLOKOSA-N 0 0 366.377 3.834 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]cc(Cc3nc(COCc4ccccc4)no3)c2c1 ZINC000580984370 931443792 /nfs/dbraw/zinc/44/37/92/931443792.db2.gz MFTSWSMOLKLBLZ-UHFFFAOYSA-N 0 0 364.361 3.767 20 5 FHBDRN C/C(=C/c1ccccc1)CN(C)S(=O)(=O)c1cc(C)cc([N+](=O)[O-])c1C ZINC001211508023 931540221 /nfs/dbraw/zinc/54/02/21/931540221.db2.gz WXYBOOYXZAYAQX-GDNBJRDFSA-N 0 0 374.462 3.936 20 5 FHBDRN O=C(NCC1(CCOCc2ccccc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000187359668 931552530 /nfs/dbraw/zinc/55/25/30/931552530.db2.gz FLBIAYJVADUPJG-UHFFFAOYSA-N 0 0 354.406 3.712 20 5 FHBDRN O=[N+]([O-])c1cnccc1N1CCO[C@H](c2cccc(C(F)(F)F)c2)C1 ZINC000610480096 931578683 /nfs/dbraw/zinc/57/86/83/931578683.db2.gz MWNJOQPCZCJBHC-HNNXBMFYSA-N 0 0 353.300 3.587 20 5 FHBDRN COc1ccc(-n2cnnc2SCc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000610479984 931579441 /nfs/dbraw/zinc/57/94/41/931579441.db2.gz CMUKQXSFNUYEEH-UHFFFAOYSA-N 0 0 360.370 3.616 20 5 FHBDRN O=C(NCC1(CCOCc2ccccc2)CC1)c1csc([N+](=O)[O-])c1 ZINC000187375107 931586030 /nfs/dbraw/zinc/58/60/30/931586030.db2.gz KBGNCPUNTUGIFI-UHFFFAOYSA-N 0 0 360.435 3.773 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)NC2(Cc3cccc(F)c3)CCC2)c1 ZINC000187390681 931602539 /nfs/dbraw/zinc/60/25/39/931602539.db2.gz DKNJTBOBNOGVNP-UHFFFAOYSA-N 0 0 358.369 3.638 20 5 FHBDRN C[C@@H]1C(=O)CC[C@H](C(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])C1(C)C ZINC000276047632 931643794 /nfs/dbraw/zinc/64/37/94/931643794.db2.gz YLIRJWUIJVPPRA-BXUZGUMPSA-N 0 0 366.845 3.548 20 5 FHBDRN Cc1cc(Cc2noc(-c3ccnn3-c3ccccc3)n2)ccc1[N+](=O)[O-] ZINC000581217497 931691742 /nfs/dbraw/zinc/69/17/42/931691742.db2.gz KNOAPHDJSCNMOI-UHFFFAOYSA-N 0 0 361.361 3.730 20 5 FHBDRN COc1ccc([C@@H](NC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)C2CC2)cc1 ZINC000048319659 931743945 /nfs/dbraw/zinc/74/39/45/931743945.db2.gz FDSWDTCQLYOOBI-SFHVURJKSA-N 0 0 365.389 3.966 20 5 FHBDRN CCCN(C(=O)c1cc([N+](=O)[O-])c[nH]1)[C@H]1C[C@@H](OCC)C12CCCCC2 ZINC000610206086 931819027 /nfs/dbraw/zinc/81/90/27/931819027.db2.gz ODDKJUZDJNIUTA-DLBZAZTESA-N 0 0 363.458 3.903 20 5 FHBDRN CCCc1nc(COC(=O)CCOc2cc(C)ccc2[N+](=O)[O-])cs1 ZINC000728325386 931827025 /nfs/dbraw/zinc/82/70/25/931827025.db2.gz MPIJSLXQVXIPLI-UHFFFAOYSA-N 0 0 364.423 3.825 20 5 FHBDRN Cc1ncc([N+](=O)[O-])c(OCc2ccc(OCC(F)(F)F)nc2)c1C ZINC000581321334 931831731 /nfs/dbraw/zinc/83/17/31/931831731.db2.gz HMZKCRXRDXMTOT-UHFFFAOYSA-N 0 0 357.288 3.522 20 5 FHBDRN Cc1cc(OCC(=O)N(CC(C)(C)C)CC(F)(F)F)ccc1[N+](=O)[O-] ZINC000430558120 931840615 /nfs/dbraw/zinc/84/06/15/931840615.db2.gz YDMROEAKYRCGCA-UHFFFAOYSA-N 0 0 362.348 3.719 20 5 FHBDRN Nc1ccc(-c2noc(COc3ccc(F)cc3Cl)n2)cc1[N+](=O)[O-] ZINC000544932135 931850408 /nfs/dbraw/zinc/85/04/08/931850408.db2.gz DMGAHJWTFMKEFA-UHFFFAOYSA-N 0 0 364.720 3.599 20 5 FHBDRN Cc1nn(C(C)(C)C)cc1[C@H](C)NC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000156149985 931852463 /nfs/dbraw/zinc/85/24/63/931852463.db2.gz IMWQDCJMABSYIU-JTQLQIEISA-N 0 0 364.833 3.999 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2nc(CN3CCc4c(F)cccc4C3)co2)cc1 ZINC000121299820 931876400 /nfs/dbraw/zinc/87/64/00/931876400.db2.gz QDQGXTSDTCWOBP-UHFFFAOYSA-N 0 0 353.353 3.947 20 5 FHBDRN COc1cc(C(=O)N(Cc2ccccc2)C(C)C)c([N+](=O)[O-])cc1OC ZINC000022197207 931889912 /nfs/dbraw/zinc/88/99/12/931889912.db2.gz KJKZTINFXULPHE-UHFFFAOYSA-N 0 0 358.394 3.663 20 5 FHBDRN Cc1cc(OCC(=O)NCC(C)(C)c2ccc(F)cc2)ccc1[N+](=O)[O-] ZINC000430566919 931890605 /nfs/dbraw/zinc/89/06/05/931890605.db2.gz DXYXVVQQBPLWPT-UHFFFAOYSA-N 0 0 360.385 3.515 20 5 FHBDRN C[C@@H]1[C@H](C(=O)Nc2ccnn2-c2ccc([N+](=O)[O-])cc2)[C@H]1c1ccccc1 ZINC000430570072 931904184 /nfs/dbraw/zinc/90/41/84/931904184.db2.gz IEBPTWMGJRAFCP-BKTGTZMESA-N 0 0 362.389 3.769 20 5 FHBDRN O=[N+]([O-])c1cc(Br)cnc1N1CCC=C(c2ccco2)C1 ZINC000561338634 931915286 /nfs/dbraw/zinc/91/52/86/931915286.db2.gz PECSOMAKGKGTNB-UHFFFAOYSA-N 0 0 350.172 3.639 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)NCc2ccnc(OC3CCCC3)c2)c1 ZINC000610224178 931920280 /nfs/dbraw/zinc/92/02/80/931920280.db2.gz PALTYPUWRNXIJV-UHFFFAOYSA-N 0 0 355.394 3.550 20 5 FHBDRN Cc1cccc(OC(F)F)c1NC(=O)COc1ccc([N+](=O)[O-])c(C)c1 ZINC000430576061 931934696 /nfs/dbraw/zinc/93/46/96/931934696.db2.gz RMZVGTQNKCQZNH-UHFFFAOYSA-N 0 0 366.320 3.831 20 5 FHBDRN CCc1ccc([C@@H]2COCCN2C(=O)Nc2ccc([N+](=O)[O-])c(C)c2)o1 ZINC000121305461 931941692 /nfs/dbraw/zinc/94/16/92/931941692.db2.gz ZDUZPEZSBGAKAR-INIZCTEOSA-N 0 0 359.382 3.664 20 5 FHBDRN CN(C[C@@H]1CCCO[C@@H]1c1ccccc1)c1nc2sccn2c1[N+](=O)[O-] ZINC000050956787 931949818 /nfs/dbraw/zinc/94/98/18/931949818.db2.gz UWIXEPNDBZLWOE-LSDHHAIUSA-N 0 0 372.450 3.908 20 5 FHBDRN CCCc1nc(COC(=O)CCOc2ccccc2[N+](=O)[O-])cs1 ZINC000728330998 931982600 /nfs/dbraw/zinc/98/26/00/931982600.db2.gz XDVKETSELZLXSS-UHFFFAOYSA-N 0 0 350.396 3.516 20 5 FHBDRN C[C@@H](CCc1ccccc1)NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000033147210 931990876 /nfs/dbraw/zinc/99/08/76/931990876.db2.gz JMHWJRDNNOAYKA-HNNXBMFYSA-N 0 0 364.405 3.532 20 5 FHBDRN CCN(C[C@H]1CCCO1)C(=O)c1cc([N+](=O)[O-])ccc1SC(C)C ZINC000121327245 931994483 /nfs/dbraw/zinc/99/44/83/931994483.db2.gz VRZMFZBPVYEUHM-CQSZACIVSA-N 0 0 352.456 3.736 20 5 FHBDRN COc1cc(C(=O)N[C@@H](C)[C@H](C)C2CCCCC2)c([N+](=O)[O-])cc1OC ZINC000177999761 932005886 /nfs/dbraw/zinc/00/58/86/932005886.db2.gz AHRSBUDAIARIIW-STQMWFEESA-N 0 0 364.442 3.947 20 5 FHBDRN C[C@@H]1CN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[C@H](C(F)(F)F)O1 ZINC000610411882 932022264 /nfs/dbraw/zinc/02/22/64/932022264.db2.gz BGKMWXHOPHKYQT-RDDDGLTNSA-N 0 0 358.238 3.770 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)C1(Cc2ccccc2Cl)CC1 ZINC000187409233 932038189 /nfs/dbraw/zinc/03/81/89/932038189.db2.gz OGWBGADABVLMQM-UHFFFAOYSA-N 0 0 358.825 3.930 20 5 FHBDRN CN(Cc1ccc(Cl)c(F)c1)C(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000135190756 932041952 /nfs/dbraw/zinc/04/19/52/932041952.db2.gz GZEJQEAZCZMGLO-UHFFFAOYSA-N 0 0 365.792 3.771 20 5 FHBDRN COc1ccccc1[C@H](CNC(=O)c1csc([N+](=O)[O-])c1)OC(C)C ZINC000187411872 932042849 /nfs/dbraw/zinc/04/28/49/932042849.db2.gz HTCLGMAMGMEKDD-HNNXBMFYSA-N 0 0 364.423 3.561 20 5 FHBDRN O=C(COc1cccc([N+](=O)[O-])c1)N1CCCCC[C@H]1[C@@H]1CCCCC1=O ZINC000610664412 932097649 /nfs/dbraw/zinc/09/76/49/932097649.db2.gz IHYFXOOROCDGKT-ROUUACIJSA-N 0 0 374.437 3.504 20 5 FHBDRN Cc1noc(C)c1[C@@H](C)Nc1ncc([N+](=O)[O-])c(C)c1Br ZINC000165788190 932110850 /nfs/dbraw/zinc/11/08/50/932110850.db2.gz GNSJIJQPJZTGSZ-SSDOTTSWSA-N 0 0 355.192 3.839 20 5 FHBDRN O=C(COC(=O)[C@@H]1C[C@@H]1c1cccc(Cl)c1)c1ccc([N+](=O)[O-])cc1 ZINC000728338658 932116594 /nfs/dbraw/zinc/11/65/94/932116594.db2.gz GFEAEVIYWJSDTP-HZPDHXFCSA-N 0 0 359.765 3.778 20 5 FHBDRN O=C(NCCc1ccc(F)c(F)c1F)c1ccc([N+](=O)[O-])cc1Cl ZINC000543354051 945070260 /nfs/dbraw/zinc/07/02/60/945070260.db2.gz USDXYNNMWSFFGG-UHFFFAOYSA-N 0 0 358.703 3.638 20 5 FHBDRN CCc1nn(C)c(N[C@@H](Cc2ccc(C)cc2)c2ccccn2)c1[N+](=O)[O-] ZINC000581495120 932165572 /nfs/dbraw/zinc/16/55/72/932165572.db2.gz SFWXUKPAHXJSRN-SFHVURJKSA-N 0 0 365.437 3.990 20 5 FHBDRN Cc1cc(C)c(NC(=O)C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c(C)c1 ZINC000178062791 932245253 /nfs/dbraw/zinc/24/52/53/932245253.db2.gz BQTDQJPDEPGBLQ-HNNXBMFYSA-N 0 0 369.421 3.644 20 5 FHBDRN O=C(NCc1cccc([N+](=O)[O-])c1)NC[C@H]1CCCC[C@@H]1C(F)(F)F ZINC000610509880 932255451 /nfs/dbraw/zinc/25/54/51/932255451.db2.gz VVEVHQDGUTYFBA-OCCSQVGLSA-N 0 0 359.348 3.763 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)C(=O)Nc2ccc(C(C)C)cc2)cc1[N+](=O)[O-] ZINC000178068105 932271416 /nfs/dbraw/zinc/27/14/16/932271416.db2.gz FDQRXXOVAJBTBG-AWEZNQCLSA-N 0 0 369.421 3.843 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)NC(C)(C)CCC(=O)OC(C)(C)C ZINC000178073871 932311141 /nfs/dbraw/zinc/31/11/41/932311141.db2.gz HKPCSCNTPZGZSN-UHFFFAOYSA-N 0 0 350.415 3.534 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N[C@H]1CCCc2[nH]c(=O)ccc21 ZINC000276391682 932319764 /nfs/dbraw/zinc/31/97/64/932319764.db2.gz IKUZPKJWJBFXPR-AWEZNQCLSA-N 0 0 356.382 3.511 20 5 FHBDRN Cc1ccccc1[C@@H]1CN(c2nc3sccn3c2[N+](=O)[O-])[C@H](C)CO1 ZINC000610516251 932330643 /nfs/dbraw/zinc/33/06/43/932330643.db2.gz MMLODHMFRSNNNW-OCCSQVGLSA-N 0 0 358.423 3.579 20 5 FHBDRN Cc1cnc([C@H](C)NC(=O)c2ccc(Br)cc2[N+](=O)[O-])s1 ZINC000430619313 932342319 /nfs/dbraw/zinc/34/23/19/932342319.db2.gz AKTWSSCONXRICS-QMMMGPOBSA-N 0 0 370.228 3.613 20 5 FHBDRN C[C@H](NC(=O)/C=C\c1ccc([N+](=O)[O-])cc1)c1cccc(-n2cccn2)c1 ZINC000255330846 932347793 /nfs/dbraw/zinc/34/77/93/932347793.db2.gz OALWLTVUBYPFJE-QIENPNARSA-N 0 0 362.389 3.671 20 5 FHBDRN CCS[C@H]1CCC[C@@H]1NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000178088394 932354265 /nfs/dbraw/zinc/35/42/65/932354265.db2.gz FBSZFQPOUYNQLA-YOEHRIQHSA-N 0 0 363.483 3.599 20 5 FHBDRN CCS[C@H]1CCC[C@H]1NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000178088421 932354551 /nfs/dbraw/zinc/35/45/51/932354551.db2.gz FBSZFQPOUYNQLA-PBHICJAKSA-N 0 0 363.483 3.599 20 5 FHBDRN Nc1c(C(=O)Nc2cccnc2Oc2ccccc2)cccc1[N+](=O)[O-] ZINC000610519975 932377906 /nfs/dbraw/zinc/37/79/06/932377906.db2.gz CGTZLAIFQFBTOU-UHFFFAOYSA-N 0 0 350.334 3.617 20 5 FHBDRN CC(C)/C=C/C(=O)O[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000785058438 932395423 /nfs/dbraw/zinc/39/54/23/932395423.db2.gz IDXLGVCUUHJJEI-LJJSCBMDSA-N 0 0 374.315 3.696 20 5 FHBDRN Cc1ccc(O)c(NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)c1 ZINC000127235205 932438099 /nfs/dbraw/zinc/43/80/99/932438099.db2.gz VZPRCWBEERQBQN-UHFFFAOYSA-N 0 0 351.156 3.624 20 5 FHBDRN Cc1ccccc1NC(=O)COC(=O)C1(c2ccc([N+](=O)[O-])cc2)CCC1 ZINC001266793038 932462958 /nfs/dbraw/zinc/46/29/58/932462958.db2.gz WRGIWUILUHFEQQ-UHFFFAOYSA-N 0 0 368.389 3.507 20 5 FHBDRN O=[N+]([O-])c1c2cccnc2ccc1N1CCO[C@]2(CCc3ccccc32)C1 ZINC000157886802 932467693 /nfs/dbraw/zinc/46/76/93/932467693.db2.gz NFTCTIHATHGYNP-OAQYLSRUSA-N 0 0 361.401 3.821 20 5 FHBDRN COC(=O)c1cc(C)nc(N(C)Cc2ccc(Cl)c(F)c2)c1[N+](=O)[O-] ZINC000581684008 932489082 /nfs/dbraw/zinc/48/90/82/932489082.db2.gz RDUSBBHONQFGNV-UHFFFAOYSA-N 0 0 367.764 3.514 20 5 FHBDRN COc1c(Cl)cccc1NC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000134594062 932498943 /nfs/dbraw/zinc/49/89/43/932498943.db2.gz CMMZDVPIWLLVHN-UHFFFAOYSA-N 0 0 372.768 3.695 20 5 FHBDRN C[C@H](CNC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)c1ccncc1 ZINC000610526796 932499849 /nfs/dbraw/zinc/49/98/49/932499849.db2.gz XGJAOCHGTMKHLN-GFCCVEGCSA-N 0 0 368.418 3.647 20 5 FHBDRN C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000477381047 932522387 /nfs/dbraw/zinc/52/23/87/932522387.db2.gz DUSWQHBFMWNGDL-YGRLFVJLSA-N 0 0 369.343 3.808 20 5 FHBDRN COCCCC[C@H](NC(=O)NCc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000471682063 932556504 /nfs/dbraw/zinc/55/65/04/932556504.db2.gz DKIANIANXDAPEW-IBGZPJMESA-N 0 0 371.437 3.952 20 5 FHBDRN O=[N+]([O-])c1ccc(CN2CCC[C@](O)(C(F)(F)F)CC2)c(Cl)c1 ZINC000285406720 932560558 /nfs/dbraw/zinc/56/05/58/932560558.db2.gz CVNPXKPSUQOCOE-CYBMUJFWSA-N 0 0 352.740 3.528 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)NCC1([C@H](O)c2ccccc2)CC1 ZINC000276531079 932571237 /nfs/dbraw/zinc/57/12/37/932571237.db2.gz DSHMVBLMLRNIHX-QGZVFWFLSA-N 0 0 374.824 3.800 20 5 FHBDRN C[C@H]1C[C@@H](NC(=O)OC(C)(C)C)CCN1Cc1csc([N+](=O)[O-])c1 ZINC000134630999 932613523 /nfs/dbraw/zinc/61/35/23/932613523.db2.gz OQLUXANVNLSTAZ-AAEUAGOBSA-N 0 0 355.460 3.534 20 5 FHBDRN O=C(Nc1ccc2ccccc2c1)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000022559798 932632668 /nfs/dbraw/zinc/63/26/68/932632668.db2.gz AYMBJIASTCPIJM-UHFFFAOYSA-N 0 0 359.345 3.581 20 5 FHBDRN O=C(NCCc1cccnc1)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000023874988 932636550 /nfs/dbraw/zinc/63/65/50/932636550.db2.gz HPKMEYCRWYKTOR-UHFFFAOYSA-N 0 0 362.389 3.706 20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])N[C@H]1CCCc2ccc(F)cc21 ZINC000477490987 932647037 /nfs/dbraw/zinc/64/70/37/932647037.db2.gz BQSOYQKEFDFBNM-INIZCTEOSA-N 0 0 357.385 3.730 20 5 FHBDRN O=[N+]([O-])c1ccc([C@@H](NCC2(CF)CCOCC2)C(F)(F)F)cc1 ZINC000564458477 932656930 /nfs/dbraw/zinc/65/69/30/932656930.db2.gz FWMGSJJYRWTGMM-CYBMUJFWSA-N 0 0 350.312 3.554 20 5 FHBDRN C[C@H](OC(=O)Cc1cccc([N+](=O)[O-])c1)c1nc2ccc(Cl)cc2n1C ZINC000176025939 932675204 /nfs/dbraw/zinc/67/52/04/932675204.db2.gz OJJWDVXPIIMOIO-NSHDSACASA-N 0 0 373.796 3.982 20 5 FHBDRN CCc1ccc(OCC(=O)c2ccc3c(c2)C(C)(C)C(=O)N3)c([N+](=O)[O-])c1 ZINC000477540446 932677442 /nfs/dbraw/zinc/67/74/42/932677442.db2.gz VRUOXLDLQDZTAM-UHFFFAOYSA-N 0 0 368.389 3.649 20 5 FHBDRN Cc1nc(-c2ccc(NC(=O)c3cccc([N+](=O)[O-])c3N)cc2)cs1 ZINC000178150752 932678306 /nfs/dbraw/zinc/67/83/06/932678306.db2.gz ARADADQUEFZRTI-UHFFFAOYSA-N 0 0 354.391 3.861 20 5 FHBDRN Cc1ccc2c(c1)N(C(=O)CCNc1ccccc1[N+](=O)[O-])C[C@H](C)O2 ZINC000477551843 932681886 /nfs/dbraw/zinc/68/18/86/932681886.db2.gz RTQCYJDUCKQYKS-AWEZNQCLSA-N 0 0 355.394 3.519 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1ccccc1CCC(F)(F)F ZINC000156386799 932685259 /nfs/dbraw/zinc/68/52/59/932685259.db2.gz ODZDHMIMPYXDLH-UHFFFAOYSA-N 0 0 370.331 3.623 20 5 FHBDRN O=c1c(Br)cc([N+](=O)[O-])cn1CCc1ccc2ccccc2c1 ZINC000477555544 932688494 /nfs/dbraw/zinc/68/84/94/932688494.db2.gz FJMVXGBJLLDSDT-UHFFFAOYSA-N 0 0 373.206 3.915 20 5 FHBDRN COC(=O)c1ccc(CNc2ccc(Cl)cc2[N+](=O)[O-])nc1C1CC1 ZINC000302056748 932708498 /nfs/dbraw/zinc/70/84/98/932708498.db2.gz ZTDPHPPJUVBHTP-UHFFFAOYSA-N 0 0 361.785 3.919 20 5 FHBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1N)c1ccc(C(F)(F)F)cc1 ZINC000178162671 932710334 /nfs/dbraw/zinc/71/03/34/932710334.db2.gz FLBGQULZGXBVCS-VIFPVBQESA-N 0 0 353.300 3.687 20 5 FHBDRN C[C@H]1CCc2c(F)cccc2[C@H]1NC(=O)COc1cccc([N+](=O)[O-])c1 ZINC000430662599 932728424 /nfs/dbraw/zinc/72/84/24/932728424.db2.gz KCTZTZMEBFAVJT-BUXKBTBVSA-N 0 0 358.369 3.553 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N(C)[C@@H](COC)Cc1ccccc1 ZINC000581854363 932747206 /nfs/dbraw/zinc/74/72/06/932747206.db2.gz XDAQAFRENZCPRN-GOSISDBHSA-N 0 0 371.437 3.879 20 5 FHBDRN Cc1ccc(Cl)cc1NC(=O)COC(=O)c1cccc([N+](=O)[O-])c1C ZINC000003444526 932760210 /nfs/dbraw/zinc/76/02/10/932760210.db2.gz DTRCDBCWUSJUHN-UHFFFAOYSA-N 0 0 362.769 3.661 20 5 FHBDRN CC[C@H](Nc1ccc([N+](=O)[O-])s1)[C@@H]1CN(Cc2ccccc2)CCO1 ZINC000610756131 932791365 /nfs/dbraw/zinc/79/13/65/932791365.db2.gz YKMHNKUTMVEYAL-HOTGVXAUSA-N 0 0 361.467 3.748 20 5 FHBDRN Cc1cc(Br)cc(NC(=O)NCc2cccc([N+](=O)[O-])c2)c1 ZINC000548274443 932793481 /nfs/dbraw/zinc/79/34/81/932793481.db2.gz SWWUZRNKSXONHN-UHFFFAOYSA-N 0 0 364.199 3.987 20 5 FHBDRN COC(=O)c1csc(NC(=O)c2cc([N+](=O)[O-])ccc2SC)c1C ZINC001266832900 932809088 /nfs/dbraw/zinc/80/90/88/932809088.db2.gz MZLMYYAIIUESGU-UHFFFAOYSA-N 0 0 366.420 3.726 20 5 FHBDRN Cc1ccc(S(=O)(=O)N([C@@H](C)c2ccccc2)C2CC2)c([N+](=O)[O-])c1 ZINC000510472633 932849729 /nfs/dbraw/zinc/84/97/29/932849729.db2.gz NHQUEDIMZSLOSG-AWEZNQCLSA-N 0 0 360.435 3.818 20 5 FHBDRN Cc1cc(OCC(=O)N2C[C@@H](c3ccccc3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000430673968 932856153 /nfs/dbraw/zinc/85/61/53/932856153.db2.gz AOPWJPAEJJDSIL-RDJZCZTQSA-N 0 0 354.406 3.687 20 5 FHBDRN C[C@@H]1C[C@@H](c2ccccc2)[C@@H](C)N1C(=O)COc1ccccc1[N+](=O)[O-] ZINC000247386490 932856355 /nfs/dbraw/zinc/85/63/55/932856355.db2.gz LUMRMPZSKATSTJ-BFYDXBDKSA-N 0 0 354.406 3.767 20 5 FHBDRN C[C@@H](c1ccccc1)N(C1CC1)S(=O)(=O)CCc1ccc([N+](=O)[O-])cc1 ZINC000510476687 932856413 /nfs/dbraw/zinc/85/64/13/932856413.db2.gz YNSFAOKTLOJWKD-HNNXBMFYSA-N 0 0 374.462 3.693 20 5 FHBDRN Cc1c(NC(=O)[C@@H](C)Nc2cnn([C@H](C)C3CC3)c2)cccc1[N+](=O)[O-] ZINC000187475447 932910451 /nfs/dbraw/zinc/91/04/51/932910451.db2.gz XSUYPGPCAMMCBB-CHWSQXEVSA-N 0 0 357.414 3.510 20 5 FHBDRN Cc1ccc(S(=O)(=O)N(C)[C@@H](C)c2cc(F)ccc2F)c([N+](=O)[O-])c1 ZINC000101573026 932928158 /nfs/dbraw/zinc/92/81/58/932928158.db2.gz FJTYKECWQZRJGH-NSHDSACASA-N 0 0 370.377 3.563 20 5 FHBDRN CC[C@H](c1ccncc1)N(CC)C(=O)COc1ccc([N+](=O)[O-])c(C)c1 ZINC000430686659 932941205 /nfs/dbraw/zinc/94/12/05/932941205.db2.gz NQEXULQHQHPLNT-QGZVFWFLSA-N 0 0 357.410 3.677 20 5 FHBDRN Cc1cc(OCC(=O)N2C[C@H](c3ccc(F)cc3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000430687604 932946193 /nfs/dbraw/zinc/94/61/93/932946193.db2.gz RMZVOTNUKHDPAX-GDBMZVCRSA-N 0 0 372.396 3.826 20 5 FHBDRN Cc1cc(OCC(=O)N2C[C@@H](c3ccc(F)cc3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000430687606 932946205 /nfs/dbraw/zinc/94/62/05/932946205.db2.gz RMZVOTNUKHDPAX-HOCLYGCPSA-N 0 0 372.396 3.826 20 5 FHBDRN Cc1c2ccccc2oc1C(=O)COC(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000023950704 932947114 /nfs/dbraw/zinc/94/71/14/932947114.db2.gz MAKKCYNDJUBQHK-UHFFFAOYSA-N 0 0 353.330 3.998 20 5 FHBDRN COc1ccc(/C=C(/C)C(=O)N(C)Cc2ccccc2[N+](=O)[O-])cc1F ZINC000588436886 932955476 /nfs/dbraw/zinc/95/54/76/932955476.db2.gz ZKVWGHDDZVQDSG-RAXLEYEMSA-N 0 0 358.369 3.804 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)NCc1ccc(-n2cccn2)cc1 ZINC000588436671 932958631 /nfs/dbraw/zinc/95/86/31/932958631.db2.gz AJWSBSKUDNNPDH-SQFISAMPSA-N 0 0 362.389 3.500 20 5 FHBDRN Cn1cc([C@H](NC/C=C/c2ccccc2[N+](=O)[O-])c2ccc(F)cc2)cn1 ZINC000187512093 932966458 /nfs/dbraw/zinc/96/64/58/932966458.db2.gz BSZVXHOASMXZIO-PEAOBZDDSA-N 0 0 366.396 3.860 20 5 FHBDRN C[C@H]1CC[C@H](c2ccccc2)N(S(=O)(=O)c2ccccc2[N+](=O)[O-])C1 ZINC000510492756 933003003 /nfs/dbraw/zinc/00/30/03/933003003.db2.gz YUSGOUZXBZKYKZ-GOEBONIOSA-N 0 0 360.435 3.757 20 5 FHBDRN Cc1cc(C(=O)NCCc2cccc([N+](=O)[O-])c2)sc1Br ZINC001266862094 933015708 /nfs/dbraw/zinc/01/57/08/933015708.db2.gz DDBHNLUQYVODOZ-UHFFFAOYSA-N 0 0 369.240 3.700 20 5 FHBDRN O=c1[nH]cnc2cc(N[C@H]3C[C@H](c4cc(F)cc(F)c4)C3)c([N+](=O)[O-])cc12 ZINC000581922202 933034355 /nfs/dbraw/zinc/03/43/55/933034355.db2.gz UHAIEHDSPKMZME-MJHDQNEOSA-N 0 0 372.331 3.880 20 5 FHBDRN CN(CC(=O)N(C)[C@H]1CCCc2ccccc21)Cc1ccccc1[N+](=O)[O-] ZINC000043783899 933035303 /nfs/dbraw/zinc/03/53/03/933035303.db2.gz BAYGMLNAEVXTBJ-FQEVSTJZSA-N 0 0 367.449 3.563 20 5 FHBDRN O=C(/C=C\c1cnc2ccccc2n1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000255390006 933043635 /nfs/dbraw/zinc/04/36/35/933043635.db2.gz DWGNTEBERKELPL-XFXZXTDPSA-N 0 0 374.400 3.742 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)OCc1nc(-c2ccccc2)no1 ZINC000588438229 933055397 /nfs/dbraw/zinc/05/53/97/933055397.db2.gz DQUSPVHIAFIYSG-QBFSEMIESA-N 0 0 365.345 3.792 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(C(=O)N(C)C)c(C)c1 ZINC000588438819 933062622 /nfs/dbraw/zinc/06/26/22/933062622.db2.gz SJGDHJVWPRAOIL-KAMYIIQDSA-N 0 0 367.405 3.647 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N(C)CCOCc1ccccc1 ZINC000588440410 933069468 /nfs/dbraw/zinc/06/94/68/933069468.db2.gz JBBWCEYZTMWYNQ-PEZBUJJGSA-N 0 0 354.406 3.673 20 5 FHBDRN CN(C(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])o1)C1CCCCC1 ZINC000043793448 933086945 /nfs/dbraw/zinc/08/69/45/933086945.db2.gz UVSCPKJHYFQDMN-UHFFFAOYSA-N 0 0 371.393 3.845 20 5 FHBDRN CC[C@@H](c1ccccc1OC)N(C)C(=O)c1ccc([N+](=O)[O-])c(OC)c1 ZINC000561657774 933088501 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O=C(N[C@H]1CCCC(F)(F)C1)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000548377603 933161923 /nfs/dbraw/zinc/16/19/23/933161923.db2.gz YZFSAYISTDNXPE-ZDUSSCGKSA-N 0 0 356.372 3.989 20 5 FHBDRN C[C@H]1CC[C@@H](c2ccccc2)N(S(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000510507608 933164508 /nfs/dbraw/zinc/16/45/08/933164508.db2.gz IHPHPXGXSRLPLF-KXBFYZLASA-N 0 0 374.462 3.898 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N([C@H](C)c1ccccc1)C1CC1 ZINC000510509048 933165121 /nfs/dbraw/zinc/16/51/21/933165121.db2.gz TXPCRBJXIINWNM-CQSZACIVSA-N 0 0 360.435 3.818 20 5 FHBDRN CC(=Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H](C)CC(=O)c1cccs1 ZINC000588447292 933169649 /nfs/dbraw/zinc/16/96/49/933169649.db2.gz MJIDPVBOOSKKJY-KXXVWKPMSA-N 0 0 358.419 3.837 20 5 FHBDRN Cc1cc(S(=O)(=O)N([C@@H](C)c2ccccc2)C2CC2)ccc1[N+](=O)[O-] ZINC000510519593 933185119 /nfs/dbraw/zinc/18/51/19/933185119.db2.gz UTUKFNOHPCFFGX-AWEZNQCLSA-N 0 0 360.435 3.818 20 5 FHBDRN Cc1nc(-c2ccccc2NC(=O)c2cccc([N+](=O)[O-])c2N)cs1 ZINC000477702214 933193589 /nfs/dbraw/zinc/19/35/89/933193589.db2.gz KOPVNVCYSZPMNW-UHFFFAOYSA-N 0 0 354.391 3.861 20 5 FHBDRN Cc1cc(OCC(=O)NC2(Cc3cccc(F)c3)CCC2)ccc1[N+](=O)[O-] ZINC000430786905 933229863 /nfs/dbraw/zinc/22/98/63/933229863.db2.gz SFYWQJNFMDXSBQ-UHFFFAOYSA-N 0 0 372.396 3.703 20 5 FHBDRN C[C@@H]1CCCC[C@H]1CCNC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000510576007 933241098 /nfs/dbraw/zinc/24/10/98/933241098.db2.gz UTUMJZTZJJGEAQ-CABCVRRESA-N 0 0 356.426 3.727 20 5 FHBDRN C[C@@H](CC(=O)c1ccc(F)cc1)NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000127352955 933250970 /nfs/dbraw/zinc/25/09/70/933250970.db2.gz VLVIWIXEYGOZIG-JTQLQIEISA-N 0 0 364.760 3.779 20 5 FHBDRN Cc1cc(OCC(=O)N(Cc2ccccn2)C(C)(C)C)ccc1[N+](=O)[O-] ZINC000430808211 933252348 /nfs/dbraw/zinc/25/23/48/933252348.db2.gz YMHMRLQIPSHYTA-UHFFFAOYSA-N 0 0 357.410 3.504 20 5 FHBDRN COc1cc(C(=O)NCC[C@@H]2CCCC[C@@H]2C)c([N+](=O)[O-])cc1OC ZINC000510603884 933264996 /nfs/dbraw/zinc/26/49/96/933264996.db2.gz YRPOWAVIXBWFTP-STQMWFEESA-N 0 0 350.415 3.558 20 5 FHBDRN Cc1cc(OCC(=O)Nc2c3c(ccc2Cl)OCC3)ccc1[N+](=O)[O-] ZINC000430833972 933276642 /nfs/dbraw/zinc/27/66/42/933276642.db2.gz AFBNQKYJQTXWRL-UHFFFAOYSA-N 0 0 362.769 3.509 20 5 FHBDRN COc1c(Cl)cccc1NC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088374307 933287753 /nfs/dbraw/zinc/28/77/53/933287753.db2.gz ITWWCRMNVRBSLR-UHFFFAOYSA-N 0 0 361.785 3.847 20 5 FHBDRN CCc1ccc(C(=O)NCCc2nc(C(C)(C)C)cs2)cc1[N+](=O)[O-] ZINC000471871181 933308664 /nfs/dbraw/zinc/30/86/64/933308664.db2.gz OYMWKRIJBSEHAD-UHFFFAOYSA-N 0 0 361.467 3.884 20 5 FHBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)N[C@@H]1C[C@H]1c1ccccc1 ZINC000430847967 933312309 /nfs/dbraw/zinc/31/23/09/933312309.db2.gz NUXZYKXYEIFECE-RBUKOAKNSA-N 0 0 353.422 3.773 20 5 FHBDRN Cc1cccc([C@H]2NC(=O)N([C@@H](C)c3cccc([N+](=O)[O-])c3)C2=O)c1C ZINC000430853428 933322723 /nfs/dbraw/zinc/32/27/23/933322723.db2.gz WFPRJPDQBOVVHN-SUMWQHHRSA-N 0 0 353.378 3.566 20 5 FHBDRN Cc1cccc([C@@H]2NC(=O)N([C@@H](C)c3cccc([N+](=O)[O-])c3)C2=O)c1C ZINC000430853427 933323353 /nfs/dbraw/zinc/32/33/53/933323353.db2.gz WFPRJPDQBOVVHN-GUYCJALGSA-N 0 0 353.378 3.566 20 5 FHBDRN Cc1cc(C)cc([C@H]2NC(=O)N([C@@H](C)c3cccc([N+](=O)[O-])c3)C2=O)c1 ZINC000430878176 933342712 /nfs/dbraw/zinc/34/27/12/933342712.db2.gz MCARNYQKCSEZMA-SUMWQHHRSA-N 0 0 353.378 3.566 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)N[C@H]2C[C@@H]2c2cccc(F)c2)cc1[N+](=O)[O-] ZINC000176018455 933359201 /nfs/dbraw/zinc/35/92/01/933359201.db2.gz WPEHRUGVPYEPHT-VUCTXSBTSA-N 0 0 357.385 3.959 20 5 FHBDRN C[C@H](CC(=O)c1ccccc1F)C(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000430882874 933369494 /nfs/dbraw/zinc/36/94/94/933369494.db2.gz NJSCIVHOXUQFHQ-CYBMUJFWSA-N 0 0 372.396 3.994 20 5 FHBDRN C[C@H](c1ccc(-n2cncn2)cc1)N(C)c1ccc([N+](=O)[O-])c2cnccc21 ZINC000098081123 933416821 /nfs/dbraw/zinc/41/68/21/933416821.db2.gz IBMPXAWKZWWQEW-CQSZACIVSA-N 0 0 374.404 3.921 20 5 FHBDRN C[C@@H]1CC[C@H](NC(=O)c2ccc(Br)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000430924601 933422521 /nfs/dbraw/zinc/42/25/21/933422521.db2.gz AUQCPAWTIDSDIB-BREBYQMCSA-N 0 0 355.232 3.912 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)N2CCN(C)c3ccccc3C2)cc1[N+](=O)[O-] ZINC000610596926 933469949 /nfs/dbraw/zinc/46/99/49/933469949.db2.gz WBBMRFRDXVOGJP-OAHLLOKOSA-N 0 0 368.437 3.626 20 5 FHBDRN Cc1cc(C(=O)N2C[C@H](C(F)(F)F)[C@@H](C(F)(F)F)C2)ccc1[N+](=O)[O-] ZINC000610598094 933482442 /nfs/dbraw/zinc/48/24/42/933482442.db2.gz SBLDMACQCOBJLR-UWVGGRQHSA-N 0 0 370.249 3.716 20 5 FHBDRN Cc1cccc(C)c1CN(C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000933768632 933492441 /nfs/dbraw/zinc/49/24/41/933492441.db2.gz PJKDPTFIABVXGV-UHFFFAOYSA-N 0 0 352.394 3.894 20 5 FHBDRN C[C@@H]1CN(S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])c2ccccc21 ZINC000131272631 933505669 /nfs/dbraw/zinc/50/56/69/933505669.db2.gz NMDBKYGQJKBLAQ-SNVBAGLBSA-N 0 0 352.799 3.561 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H](C(F)(F)F)[C@H](C(F)(F)F)C2)c1 ZINC000610605539 933513346 /nfs/dbraw/zinc/51/33/46/933513346.db2.gz SGXDKCSJGMYMCO-NXEZZACHSA-N 0 0 370.249 3.716 20 5 FHBDRN O=C(CCc1ccccc1Br)NCc1ccc([N+](=O)[O-])cc1 ZINC000055798880 933534261 /nfs/dbraw/zinc/53/42/61/933534261.db2.gz RMEZLAPGRBMNHR-UHFFFAOYSA-N 0 0 363.211 3.606 20 5 FHBDRN CC(C)(C(=O)NCc1c(F)c(F)cc(F)c1F)c1ccc([N+](=O)[O-])cc1 ZINC000610624400 933544206 /nfs/dbraw/zinc/54/42/06/933544206.db2.gz XQLPPGPJGBSCHG-UHFFFAOYSA-N 0 0 370.302 3.745 20 5 FHBDRN CC(C)(NC(=O)c1cc2c([nH]c1=O)CCCCC2)c1ccc([N+](=O)[O-])cc1 ZINC000610624224 933544620 /nfs/dbraw/zinc/54/46/20/933544620.db2.gz UJOSAUKOJSOLAW-UHFFFAOYSA-N 0 0 369.421 3.629 20 5 FHBDRN C/C=C\c1ccc(OS(=O)(=O)Cc2ccccc2[N+](=O)[O-])c(OC)c1 ZINC000588452247 933546971 /nfs/dbraw/zinc/54/69/71/933546971.db2.gz DWSVFYQUSDEHKI-UTCJRWHESA-N 0 0 363.391 3.545 20 5 FHBDRN O=C(Nc1cccc(Cl)c1SCC(F)F)c1c[nH]nc1[N+](=O)[O-] ZINC000548419951 933578445 /nfs/dbraw/zinc/57/84/45/933578445.db2.gz XOEAMKNXSBMHJI-UHFFFAOYSA-N 0 0 362.745 3.581 20 5 FHBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)N1CC(Cc2ccccc2)C1 ZINC000610643017 933583673 /nfs/dbraw/zinc/58/36/73/933583673.db2.gz JQUOYMZJRDUCRE-UHFFFAOYSA-N 0 0 367.449 3.802 20 5 FHBDRN CCc1ccc(C(=O)N[C@@H](c2ccccc2)[C@@H]2CCCO2)cc1[N+](=O)[O-] ZINC000471904884 933601945 /nfs/dbraw/zinc/60/19/45/933601945.db2.gz IDMQBZRSCBMBER-OALUTQOASA-N 0 0 354.406 3.807 20 5 FHBDRN CCc1ccc(C(=O)N[C@@H](CCC(=O)OC)c2ccccc2)cc1[N+](=O)[O-] ZINC000471905297 933605687 /nfs/dbraw/zinc/60/56/87/933605687.db2.gz AYRBJDZYBSSBNV-KRWDZBQOSA-N 0 0 370.405 3.582 20 5 FHBDRN O=C(NCCc1ccccc1[N+](=O)[O-])NCC1(Cc2ccc(F)cc2)CC1 ZINC000548423478 933610209 /nfs/dbraw/zinc/61/02/09/933610209.db2.gz JCGUAIVFWOVPPN-UHFFFAOYSA-N 0 0 371.412 3.599 20 5 FHBDRN O=C(Nc1ccc2cc([N+](=O)[O-])ccc2n1)c1ccccc1OC1CCC1 ZINC000610653755 933649676 /nfs/dbraw/zinc/64/96/76/933649676.db2.gz JKMGVHSXFHZUHC-UHFFFAOYSA-N 0 0 363.373 3.749 20 5 FHBDRN CCc1ccc(C(=O)N[C@H]2CCCN(c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000471910204 933661473 /nfs/dbraw/zinc/66/14/73/933661473.db2.gz HPPCHHCMOVBJJX-KRWDZBQOSA-N 0 0 353.422 3.556 20 5 FHBDRN Cc1cccc(CC2CN(C(=O)Cc3ccc([N+](=O)[O-])cc3Cl)C2)c1 ZINC000610659777 933671198 /nfs/dbraw/zinc/67/11/98/933671198.db2.gz SGCSQWBAOUMYNQ-UHFFFAOYSA-N 0 0 358.825 3.800 20 5 FHBDRN CCOc1cc(CS[C@@H](C)c2nc(COC)no2)ccc1[N+](=O)[O-] ZINC000276834084 933689773 /nfs/dbraw/zinc/68/97/73/933689773.db2.gz BVYCZAPIXHMZJW-JTQLQIEISA-N 0 0 353.400 3.517 20 5 FHBDRN COc1ccc2ccc(C(=O)NCCNc3ccccc3[N+](=O)[O-])cc2c1 ZINC000431032200 933710296 /nfs/dbraw/zinc/71/02/96/933710296.db2.gz AVZFBUNYLGWXNU-UHFFFAOYSA-N 0 0 365.389 3.599 20 5 FHBDRN COc1cc(C(=O)N(C)[C@@H](C)c2c(F)cccc2F)ccc1[N+](=O)[O-] ZINC000510783945 933726347 /nfs/dbraw/zinc/72/63/47/933726347.db2.gz OFXCOMRVSOPOPB-JTQLQIEISA-N 0 0 350.321 3.715 20 5 FHBDRN COc1ccc(NC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)c2ncccc12 ZINC000548440864 933784522 /nfs/dbraw/zinc/78/45/22/933784522.db2.gz DRPFPEVSXSGWHB-UHFFFAOYSA-N 0 0 362.345 3.885 20 5 FHBDRN Cc1c(NC(=O)c2n[nH]c(C3CC3)c2Br)cccc1[N+](=O)[O-] ZINC000065094943 933805557 /nfs/dbraw/zinc/80/55/57/933805557.db2.gz VKUPGDUICMGMOL-UHFFFAOYSA-N 0 0 365.187 3.519 20 5 FHBDRN CNC(=O)c1cc([N+](=O)[O-])ccc1NCc1c(OC)ccc2ccccc21 ZINC000510819382 933809509 /nfs/dbraw/zinc/80/95/09/933809509.db2.gz CQEGMBNMBZISJM-UHFFFAOYSA-N 0 0 365.389 3.728 20 5 FHBDRN Cc1c(NC(=O)N[C@@H]2CCN(c3cccc(Cl)c3)C2)cccc1[N+](=O)[O-] ZINC000431080559 933812680 /nfs/dbraw/zinc/81/26/80/933812680.db2.gz AYJVXTHZMUBXMR-CQSZACIVSA-N 0 0 374.828 3.957 20 5 FHBDRN CC(=O)Nc1ccc(F)c(NC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000431086287 933815237 /nfs/dbraw/zinc/81/52/37/933815237.db2.gz MVEGYQPGHKUAEZ-UHFFFAOYSA-N 0 0 374.372 3.749 20 5 FHBDRN Cc1ccccc1CNC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000510842833 933847710 /nfs/dbraw/zinc/84/77/10/933847710.db2.gz LQPVFPMGMRXJQA-UHFFFAOYSA-N 0 0 351.309 3.826 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H]1CCN(c2cccc(Cl)c2)C1 ZINC000431109497 933847815 /nfs/dbraw/zinc/84/78/15/933847815.db2.gz XBPXKMNGKWBSDP-CQSZACIVSA-N 0 0 374.828 3.957 20 5 FHBDRN CCOc1cc(O)ccc1NC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F ZINC000276882790 933868380 /nfs/dbraw/zinc/86/83/80/933868380.db2.gz MCPMCTURYIAZHJ-UHFFFAOYSA-N 0 0 362.357 3.755 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)N[C@H]1COc2c1cccc2Cl ZINC000610709648 933871499 /nfs/dbraw/zinc/87/14/99/933871499.db2.gz ICQYXODXBQNBIJ-AWEZNQCLSA-N 0 0 364.810 3.590 20 5 FHBDRN CN(C[C@@H]1CCCO[C@H]1c1ccccc1)C(=O)c1ccc(F)cc1[N+](=O)[O-] ZINC000610712016 933893470 /nfs/dbraw/zinc/89/34/70/933893470.db2.gz KXKLDDCUQDNYLX-KXBFYZLASA-N 0 0 372.396 3.974 20 5 FHBDRN CC(C)(CNC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])[C@H]1CCCCO1 ZINC000610719914 933957973 /nfs/dbraw/zinc/95/79/73/933957973.db2.gz UYCJAQCCALWLKP-CQSZACIVSA-N 0 0 374.359 3.939 20 5 FHBDRN C[C@H](CC(=O)N1CCS[C@H]1c1ccc([N+](=O)[O-])cc1)c1ccncc1 ZINC000610723587 933974794 /nfs/dbraw/zinc/97/47/94/933974794.db2.gz VQGQYKBMSUIZPT-ACJLOTCBSA-N 0 0 357.435 3.758 20 5 FHBDRN CCCOc1cc(NC(=O)N2CCCC2)c([N+](=O)[O-])cc1OCCC ZINC000043878527 933974936 /nfs/dbraw/zinc/97/49/36/933974936.db2.gz WOJYEXLUWGSBEW-UHFFFAOYSA-N 0 0 351.403 3.800 20 5 FHBDRN Cc1nn(C)cc1[C@@H]1CCCN1c1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000610726482 933992840 /nfs/dbraw/zinc/99/28/40/933992840.db2.gz WORDLWNRBCWFFM-AWEZNQCLSA-N 0 0 354.332 3.997 20 5 FHBDRN Cc1c(NC(=O)CC[C@@H]2CCCCO2)cc(Br)cc1[N+](=O)[O-] ZINC000431183949 934061184 /nfs/dbraw/zinc/06/11/84/934061184.db2.gz RDRZBTPMDYNGSB-LBPRGKRZSA-N 0 0 371.231 3.954 20 5 FHBDRN O=C(Nc1ccc(NC(=O)c2ccccc2)cn1)c1csc([N+](=O)[O-])c1 ZINC000477887867 934066595 /nfs/dbraw/zinc/06/65/95/934066595.db2.gz FPYLRAHVIRSDEO-UHFFFAOYSA-N 0 0 368.374 3.556 20 5 FHBDRN C[C@@H](c1ccccc1)n1ccc(=NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)[nH]1 ZINC000610746030 934071116 /nfs/dbraw/zinc/07/11/16/934071116.db2.gz NJSHAQLSNHINOU-LBPRGKRZSA-N 0 0 370.796 3.728 20 5 FHBDRN COc1cc(C(=O)Nc2cc(C)nn2-c2ccccc2)cc([N+](=O)[O-])c1C ZINC000477889620 934075602 /nfs/dbraw/zinc/07/56/02/934075602.db2.gz JCKMKFMOEABEKB-UHFFFAOYSA-N 0 0 366.377 3.658 20 5 FHBDRN Cc1c(NC(=O)c2ncc(F)cc2F)cc(Br)cc1[N+](=O)[O-] ZINC000431185010 934078302 /nfs/dbraw/zinc/07/83/02/934078302.db2.gz XITIBPVBCHWMQN-UHFFFAOYSA-N 0 0 372.125 3.591 20 5 FHBDRN COc1ccc(C)cc1CNc1ncc(Br)cc1[N+](=O)[O-] ZINC000610769596 934138575 /nfs/dbraw/zinc/13/85/75/934138575.db2.gz XXUXMRXHPOAOBB-UHFFFAOYSA-N 0 0 352.188 3.681 20 5 FHBDRN O=C1[C@H](Nc2cccc([N+](=O)[O-])c2)CCN1c1ccccc1C(F)(F)F ZINC000471969690 934147855 /nfs/dbraw/zinc/14/78/55/934147855.db2.gz JUQCWHKKNMALBK-CQSZACIVSA-N 0 0 365.311 3.831 20 5 FHBDRN O=C(CCc1ccc(Br)cc1)NCc1ccc([N+](=O)[O-])cc1 ZINC000176128496 934183992 /nfs/dbraw/zinc/18/39/92/934183992.db2.gz PXVBSTRPMSZAGI-UHFFFAOYSA-N 0 0 363.211 3.606 20 5 FHBDRN CC(C)[C@@H]1c2ccccc2CCN1S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000610785505 934184817 /nfs/dbraw/zinc/18/48/17/934184817.db2.gz ZCOITLJMQDQBNP-LJQANCHMSA-N 0 0 374.462 3.680 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CCC(c3ccncc3)CC2)c(Br)c1 ZINC000276975487 934193080 /nfs/dbraw/zinc/19/30/80/934193080.db2.gz FAYXPLVFBFGNCJ-UHFFFAOYSA-N 0 0 363.215 3.531 20 5 FHBDRN CCc1ccc(C(=O)NCc2cn(-c3ccccc3)nc2C)cc1[N+](=O)[O-] ZINC000510958551 934226306 /nfs/dbraw/zinc/22/63/06/934226306.db2.gz MSFARRXYZZINNT-UHFFFAOYSA-N 0 0 364.405 3.581 20 5 FHBDRN Cc1c(NC(=O)CCc2ccco2)cc(Br)cc1[N+](=O)[O-] ZINC000431226302 934228138 /nfs/dbraw/zinc/22/81/38/934228138.db2.gz WBDDQNHNGNYDER-UHFFFAOYSA-N 0 0 353.172 3.830 20 5 FHBDRN COc1cc(C)c(NC(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)cc1OC ZINC000535678570 934258267 /nfs/dbraw/zinc/25/82/67/934258267.db2.gz CTKZXGKTJHWANO-UHFFFAOYSA-N 0 0 355.350 3.654 20 5 FHBDRN Cc1ncc(CNC(=O)c2ccc(SCCC(C)C)c([N+](=O)[O-])c2)o1 ZINC000458067841 934261038 /nfs/dbraw/zinc/26/10/38/934261038.db2.gz XYTLNQWWOVIPDV-UHFFFAOYSA-N 0 0 363.439 3.959 20 5 FHBDRN O=C(c1c[nH]c2cccc([N+](=O)[O-])c12)N1CC[C@H](Cc2ccc(F)cc2)C1 ZINC000535694381 934272209 /nfs/dbraw/zinc/27/22/09/934272209.db2.gz CXUFWDACIKCNJS-CQSZACIVSA-N 0 0 367.380 3.920 20 5 FHBDRN C[C@H]1CN(C)c2ccccc2N(C(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)C1 ZINC000535705487 934301758 /nfs/dbraw/zinc/30/17/58/934301758.db2.gz PSEQVQUNJMKCSP-ZDUSSCGKSA-N 0 0 364.405 3.809 20 5 FHBDRN CC(C)[C@]1(C)C[C@H]1NC(=O)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000458108165 934306264 /nfs/dbraw/zinc/30/62/64/934306264.db2.gz FDRAJWYIWHUNCR-IERDGZPVSA-N 0 0 352.409 3.985 20 5 FHBDRN Cc1c(F)ccc([N+](=O)[O-])c1C(=O)NCc1cccc(Br)c1 ZINC001125555643 934306883 /nfs/dbraw/zinc/30/68/83/934306883.db2.gz NKOINFUOTXPNPH-UHFFFAOYSA-N 0 0 367.174 3.735 20 5 FHBDRN Cc1cccc2c1CC[C@@H]2NC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000535718787 934317159 /nfs/dbraw/zinc/31/71/59/934317159.db2.gz TVWDTBSQAPSXCY-INIZCTEOSA-N 0 0 362.389 3.506 20 5 FHBDRN Cc1nn(Cc2ccc(C(=O)N[C@@H]3C[C@]3(C)C(C)C)cc2)c(C)c1[N+](=O)[O-] ZINC000458148544 934323187 /nfs/dbraw/zinc/32/31/87/934323187.db2.gz OSBKYVUAXUAKRV-YLJYHZDGSA-N 0 0 370.453 3.621 20 5 FHBDRN O=C(NC1CCC(C(F)F)CC1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000458135476 934324216 /nfs/dbraw/zinc/32/42/16/934324216.db2.gz CORSPJYZQRPGMO-UHFFFAOYSA-N 0 0 367.396 3.749 20 5 FHBDRN CCC[C@@]1(C(F)(F)F)CCCN1C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000535752404 934329650 /nfs/dbraw/zinc/32/96/50/934329650.db2.gz KAMPQZYVDYEBMZ-HNNXBMFYSA-N 0 0 374.315 3.661 20 5 FHBDRN CCC[C@]1(C(F)(F)F)CCCN1C(=O)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000535752559 934330003 /nfs/dbraw/zinc/33/00/03/934330003.db2.gz ZPDWHZGXGYJYGG-MRXNPFEDSA-N 0 0 374.359 3.870 20 5 FHBDRN Cc1cc(Cl)cc(C)c1CN1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000535785570 934374542 /nfs/dbraw/zinc/37/45/42/934374542.db2.gz XWCIVQIZKCHCGC-UHFFFAOYSA-N 0 0 360.845 3.582 20 5 FHBDRN Cc1ncc2c(n1)CCN(Cc1ccc(-c3ccc([N+](=O)[O-])cc3)s1)C2 ZINC000535790155 934381579 /nfs/dbraw/zinc/38/15/79/934381579.db2.gz PWQGEPFIMPJSTK-UHFFFAOYSA-N 0 0 366.446 3.980 20 5 FHBDRN C[C@H](Cc1cccc(F)c1)N(C)C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000458238484 934402104 /nfs/dbraw/zinc/40/21/04/934402104.db2.gz GGBKYDGJJJMJDQ-CYBMUJFWSA-N 0 0 369.396 3.847 20 5 FHBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)Nc1csc(-c2ccncc2)n1 ZINC000588470463 934411651 /nfs/dbraw/zinc/41/16/51/934411651.db2.gz CJSGRTSOOVQBCN-UTCJRWHESA-N 0 0 352.375 3.765 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H](c2ccccc2)C(F)(F)F)c1 ZINC000187683681 934468238 /nfs/dbraw/zinc/46/82/38/934468238.db2.gz YAALOBUOERRDHO-AWEZNQCLSA-N 0 0 368.311 3.679 20 5 FHBDRN CC(C)n1ncc2c1C[C@@H](Nc1ccc([N+](=O)[O-])c3cccnc13)CC2 ZINC000477968862 934472051 /nfs/dbraw/zinc/47/20/51/934472051.db2.gz RXJRRVZKDBOCOR-AWEZNQCLSA-N 0 0 351.410 3.890 20 5 FHBDRN Cc1ccc(NC(=O)COC(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1Cl ZINC000003520297 934487288 /nfs/dbraw/zinc/48/72/88/934487288.db2.gz KAMUIXMEMKRRJZ-UHFFFAOYSA-N 0 0 362.769 3.661 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)NC[C@H]1CCCO[C@@H]1c1ccccc1 ZINC000277117702 934496015 /nfs/dbraw/zinc/49/60/15/934496015.db2.gz RGTBHHDLBVUKGR-DNVCBOLYSA-N 0 0 370.405 3.501 20 5 FHBDRN Cc1cc(NC(=O)c2cccc([N+](=O)[O-])c2N)ccc1Oc1cccnc1 ZINC000176176245 934497809 /nfs/dbraw/zinc/49/78/09/934497809.db2.gz YSRYYVCLVYJQKT-UHFFFAOYSA-N 0 0 364.361 3.925 20 5 FHBDRN O=C(NCc1cocn1)c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1 ZINC000610860542 934534381 /nfs/dbraw/zinc/53/43/81/934534381.db2.gz JUXSHVPVQYSFOW-UHFFFAOYSA-N 0 0 355.375 3.664 20 5 FHBDRN O=C(c1ccccc1[N+](=O)[O-])N(Cc1ccc(F)cc1)C1CCOCC1 ZINC000277140088 934548384 /nfs/dbraw/zinc/54/83/84/934548384.db2.gz PEALJKVQLVRRLD-UHFFFAOYSA-N 0 0 358.369 3.555 20 5 FHBDRN Cc1ccc(C(=O)N(Cc2ccc(F)cc2)C2CCOCC2)cc1[N+](=O)[O-] ZINC000277142421 934557840 /nfs/dbraw/zinc/55/78/40/934557840.db2.gz PIUXAUQFUPXQBB-UHFFFAOYSA-N 0 0 372.396 3.864 20 5 FHBDRN C[C@@H]1CO[C@@H](c2cccc(Cl)c2)CN1C(=O)c1ccccc1[N+](=O)[O-] ZINC000187685185 934560575 /nfs/dbraw/zinc/56/05/75/934560575.db2.gz QTDDYPAKIJUNPL-SJKOYZFVSA-N 0 0 360.797 3.850 20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])Nc1ccc(-c2nncs2)cc1 ZINC000535838210 934575702 /nfs/dbraw/zinc/57/57/02/934575702.db2.gz RKJKQOZBQJKLCG-UHFFFAOYSA-N 0 0 369.406 3.554 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N1CCC[C@H]1CC(=O)c1cccs1 ZINC000176212391 934606621 /nfs/dbraw/zinc/60/66/21/934606621.db2.gz ZGDOJHPHPJCRMC-ZDUSSCGKSA-N 0 0 358.419 3.842 20 5 FHBDRN CCCN(CC(F)(F)F)C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000610904662 934606706 /nfs/dbraw/zinc/60/67/06/934606706.db2.gz SFNVRZKPJVPJNC-UHFFFAOYSA-N 0 0 369.137 3.772 20 5 FHBDRN O=C1NCCc2ccc(NCc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)cc21 ZINC000610911086 934611820 /nfs/dbraw/zinc/61/18/20/934611820.db2.gz OBQZGETVDSIZON-UHFFFAOYSA-N 0 0 363.373 3.753 20 5 FHBDRN Cc1nc(-c2ccc(NC(=O)c3cc(Cl)ccc3[N+](=O)[O-])cc2)n[nH]1 ZINC000065187104 934617878 /nfs/dbraw/zinc/61/78/78/934617878.db2.gz ULHCVUMMVQCTDW-UHFFFAOYSA-N 0 0 357.757 3.594 20 5 FHBDRN Cc1nc(-c2ccc(NC(=O)c3n[nH]c(C(C)C)c3[N+](=O)[O-])cc2)oc1C ZINC000610920511 934625421 /nfs/dbraw/zinc/62/54/21/934625421.db2.gz QSQFCSRZDYRFEB-UHFFFAOYSA-N 0 0 369.381 3.965 20 5 FHBDRN Cn1ccnc1C[C@H](Nc1ncc(Cl)cc1[N+](=O)[O-])c1ccccc1 ZINC000610929468 934626485 /nfs/dbraw/zinc/62/64/85/934626485.db2.gz LSBPEOCBHOOTER-AWEZNQCLSA-N 0 0 357.801 3.773 20 5 FHBDRN COc1ccc([C@@H]2CCCN2Cc2cc3c(cc2[N+](=O)[O-])OCCO3)cc1 ZINC000610931005 934632629 /nfs/dbraw/zinc/63/26/29/934632629.db2.gz BHCUMEGKRDTJTI-KRWDZBQOSA-N 0 0 370.405 3.712 20 5 FHBDRN O=C(C=Cc1ccc([N+](=O)[O-])cc1)N1CCC[C@H]1CC(=O)c1cccs1 ZINC000176216181 934638003 /nfs/dbraw/zinc/63/80/03/934638003.db2.gz ORXOBQFDLUZUCN-JCVNQNCUSA-N 0 0 370.430 3.934 20 5 FHBDRN Cc1sc(C(=O)NC[C@@H]2CCCO[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000145700089 934639681 /nfs/dbraw/zinc/63/96/81/934639681.db2.gz PXXYDWWMUHZEND-WMLDXEAASA-N 0 0 360.435 3.862 20 5 FHBDRN CC(C)CCSc1ccc(C(=O)N2CCCOC[C@H]2C)cc1[N+](=O)[O-] ZINC000610948454 934644571 /nfs/dbraw/zinc/64/45/71/934644571.db2.gz FWFPKKUIKMXYNY-CQSZACIVSA-N 0 0 366.483 3.984 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])S(=O)(=O)/C=C\c1cccc(Cl)c1 ZINC000588480782 934648784 /nfs/dbraw/zinc/64/87/84/934648784.db2.gz XNTDUBJZAWVMOX-KTKRTIGZSA-N 0 0 366.826 3.681 20 5 FHBDRN O=Cc1ccc(OCC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c(Cl)c1 ZINC000065204812 934649123 /nfs/dbraw/zinc/64/91/23/934649123.db2.gz BYQOYEIOQDNWDI-UHFFFAOYSA-N 0 0 369.160 3.732 20 5 FHBDRN CCOC(=O)CCC1CCN(c2ccc([N+](=O)[O-])c3cnccc32)CC1 ZINC000610969764 934665295 /nfs/dbraw/zinc/66/52/95/934665295.db2.gz NUPOABADHXNMCQ-UHFFFAOYSA-N 0 0 357.410 3.703 20 5 FHBDRN CCC[C@H](NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)C1CCC1 ZINC000458318605 934677279 /nfs/dbraw/zinc/67/72/79/934677279.db2.gz ZJJWUXGJYCSXSM-KRWDZBQOSA-N 0 0 359.470 3.896 20 5 FHBDRN CNc1ccc(C(=O)O[C@H](c2ccccc2)c2cccnc2)cc1[N+](=O)[O-] ZINC000728418355 934705220 /nfs/dbraw/zinc/70/52/20/934705220.db2.gz LGVKFUVMZPZQQL-LJQANCHMSA-N 0 0 363.373 3.978 20 5 FHBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)N1CC[C@H](c2c(F)cccc2F)C1 ZINC000588484328 934709517 /nfs/dbraw/zinc/70/95/17/934709517.db2.gz JXRJVNHMWPRFBT-PIZKADEWSA-N 0 0 358.344 3.902 20 5 FHBDRN Cc1cc(N2CC[C@@H](O)CC(C)(C)C2)c(Br)cc1[N+](=O)[O-] ZINC000395526874 934747842 /nfs/dbraw/zinc/74/78/42/934747842.db2.gz ZEBONKKKBOWOFV-LLVKDONJSA-N 0 0 357.248 3.653 20 5 FHBDRN Cc1cc(N2CC[C@H](O)CC(C)(C)C2)c(Br)cc1[N+](=O)[O-] ZINC000395526878 934748050 /nfs/dbraw/zinc/74/80/50/934748050.db2.gz ZEBONKKKBOWOFV-NSHDSACASA-N 0 0 357.248 3.653 20 5 FHBDRN CN1CC[C@@H](C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)c2ccccc21 ZINC000611011372 934752890 /nfs/dbraw/zinc/75/28/90/934752890.db2.gz WDHOMBXIAAASMM-LJQANCHMSA-N 0 0 367.449 3.657 20 5 FHBDRN O=C([O-])C[C@@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)C12CC3CC(CC(C3)C1)C2 ZINC000277187047 934767238 /nfs/dbraw/zinc/76/72/38/934767238.db2.gz FPEZZNGYQXOIKI-ZVQXUQNISA-N 0 0 358.438 3.744 20 5 FHBDRN C[C@H](NC(=O)NCc1ccccc1[N+](=O)[O-])c1cccc(N2CCCC2)c1 ZINC000176299097 934789591 /nfs/dbraw/zinc/78/95/91/934789591.db2.gz PDYQCKBMNCNHJB-HNNXBMFYSA-N 0 0 368.437 3.755 20 5 FHBDRN CN(C(=O)c1cccc(C(=O)OC(C)(C)C)c1)c1cccc([N+](=O)[O-])c1 ZINC000091962372 934807415 /nfs/dbraw/zinc/80/74/15/934807415.db2.gz HYZBHNYLHGUQIX-UHFFFAOYSA-N 0 0 356.378 3.827 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])s1)N(Cc1ccc(F)cc1)C1CCOCC1 ZINC000277235658 934823617 /nfs/dbraw/zinc/82/36/17/934823617.db2.gz XYSJAAHUDKGMAD-UHFFFAOYSA-N 0 0 364.398 3.617 20 5 FHBDRN CCc1oc(C(=O)Nc2cc(C)nn2-c2ccc([N+](=O)[O-])cc2)cc1C ZINC000119468039 934826225 /nfs/dbraw/zinc/82/62/25/934826225.db2.gz RDHRJALJHCWFSJ-UHFFFAOYSA-N 0 0 354.366 3.805 20 5 FHBDRN C[C@H](NC(=O)N1CCO[C@@](C)(c2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000119463526 934826430 /nfs/dbraw/zinc/82/64/30/934826430.db2.gz LRVVGXQGTQSTGC-MGPUTAFESA-N 0 0 369.421 3.613 20 5 FHBDRN Cc1cc(Cl)c(S(=O)(=O)Oc2ccc(F)cc2F)cc1[N+](=O)[O-] ZINC000176639405 934827199 /nfs/dbraw/zinc/82/71/99/934827199.db2.gz UUVFBVAUJOMFQM-UHFFFAOYSA-N 0 0 363.725 3.603 20 5 FHBDRN CC(C)(C)c1ccc(C2(NC(=O)Cn3cc([N+](=O)[O-])cn3)CCCC2)cc1 ZINC000510998340 934840883 /nfs/dbraw/zinc/84/08/83/934840883.db2.gz WQEQVMCBIBSFNP-UHFFFAOYSA-N 0 0 370.453 3.675 20 5 FHBDRN C[C@@H]1CC[C@@H](C(F)(F)F)CN1C(=O)c1c[nH]c2ccc([N+](=O)[O-])cc21 ZINC000611561837 934867999 /nfs/dbraw/zinc/86/79/99/934867999.db2.gz VMKAUBQOPZNRBK-NXEZZACHSA-N 0 0 355.316 3.879 20 5 FHBDRN C[C@H]1CCN(C(=O)CNc2ccccc2[N+](=O)[O-])[C@@H]1c1cccc(F)c1 ZINC000472036674 934868112 /nfs/dbraw/zinc/86/81/12/934868112.db2.gz DZOIATZYUKKTNT-DJJJIMSYSA-N 0 0 357.385 3.756 20 5 FHBDRN CN(C/C=C\c1ccccc1[N+](=O)[O-])Cc1nccn1Cc1ccccc1 ZINC000538730138 934892820 /nfs/dbraw/zinc/89/28/20/934892820.db2.gz JEFOWENLXLZXPF-XFFZJAGNSA-N 0 0 362.433 3.985 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)Nc1cnc2ccccc2c1 ZINC000071842969 934893875 /nfs/dbraw/zinc/89/38/75/934893875.db2.gz PLMCPSFQYQIVAW-UHFFFAOYSA-N 0 0 350.378 3.974 20 5 FHBDRN O=C(NCc1cc([N+](=O)[O-])ccc1Cl)N1CC[C@@H](CC(F)(F)F)C1 ZINC000277304961 934909697 /nfs/dbraw/zinc/90/96/97/934909697.db2.gz CGUOMBWNJBTRNI-VIFPVBQESA-N 0 0 365.739 3.732 20 5 FHBDRN O=C(c1ccc2sccc2c1)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000472067734 934937394 /nfs/dbraw/zinc/93/73/94/934937394.db2.gz KCROXSXBNLBYGC-AWEZNQCLSA-N 0 0 368.418 3.531 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1F)Nc1ccccc1Br ZINC000121716194 934940553 /nfs/dbraw/zinc/94/05/53/934940553.db2.gz GVUIAAILDUNKHR-UHFFFAOYSA-N 0 0 353.147 3.678 20 5 FHBDRN COc1ccc2ccc(OC(=O)COc3cccc([N+](=O)[O-])c3)cc2c1 ZINC000071880220 934942186 /nfs/dbraw/zinc/94/21/86/934942186.db2.gz NUDGOPDGGHSVDZ-UHFFFAOYSA-N 0 0 353.330 3.741 20 5 FHBDRN Cn1c(=O)c2cc3ccccc3cc2nc1SCc1nccn1C(F)F ZINC000684688364 934961472 /nfs/dbraw/zinc/96/14/72/934961472.db2.gz NFQVOFHZPDWTQK-UHFFFAOYSA-N 0 0 372.400 3.971 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N1CC[C@H](CC(F)(F)F)C1 ZINC000277332013 934973720 /nfs/dbraw/zinc/97/37/20/934973720.db2.gz DXWIMRVELNKBHM-SECBINFHSA-N 0 0 350.724 3.592 20 5 FHBDRN CCn1c(SCc2c(C)noc2C)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000156965696 934987204 /nfs/dbraw/zinc/98/72/04/934987204.db2.gz USXCRYWQFKGJOU-UHFFFAOYSA-N 0 0 359.411 3.770 20 5 FHBDRN CCN(C(=O)c1nn(C)cc1[N+](=O)[O-])[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000539026402 934991386 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Cc1cnc(C2CCN(C(=O)c3cc(F)c(F)cc3[N+](=O)[O-])CC2)s1 ZINC000277366480 935022987 /nfs/dbraw/zinc/02/29/87/935022987.db2.gz FLGXDLJIEQSOBM-UHFFFAOYSA-N 0 0 367.377 3.658 20 5 FHBDRN CC[C@H](c1ccncc1)N(CC)C(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1 ZINC000157159280 935026402 /nfs/dbraw/zinc/02/64/02/935026402.db2.gz DCZZCJPGYNAEAC-OAHLLOKOSA-N 0 0 372.381 3.820 20 5 FHBDRN CO[C@H](c1ccc(Br)cc1)[C@@H](C)Nc1ncccc1[N+](=O)[O-] ZINC000539107186 935028652 /nfs/dbraw/zinc/02/86/52/935028652.db2.gz PROXEKXSCZDHIK-YGRLFVJLSA-N 0 0 366.215 3.940 20 5 FHBDRN C[C@@H](NCc1ccc(C(N)=O)cc1[N+](=O)[O-])c1cccc(C(F)(F)F)c1 ZINC000119684113 935036549 /nfs/dbraw/zinc/03/65/49/935036549.db2.gz PFXLPZLDVZOHGJ-SNVBAGLBSA-N 0 0 367.327 3.563 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)NCCC2=CCCCC2)cc1SC ZINC000075465603 945072692 /nfs/dbraw/zinc/07/26/92/945072692.db2.gz DMEIBVGPXOQZGT-UHFFFAOYSA-N 0 0 350.440 3.946 20 5 FHBDRN Cc1nn(C)c(NC(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)c1Cl ZINC000892137120 935090430 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CC1=C(c2ccco2)CN(c2nnc(-c3cccc([N+](=O)[O-])c3)n2C)CC1 ZINC000562012754 935226222 /nfs/dbraw/zinc/22/62/22/935226222.db2.gz UNWBDORDCWPQOR-UHFFFAOYSA-N 0 0 365.393 3.667 20 5 FHBDRN CCn1c(C)nc([N+](=O)[O-])c1N1CCCC[C@H]1c1nc2ccccc2[nH]1 ZINC000450881095 935229638 /nfs/dbraw/zinc/22/96/38/935229638.db2.gz YJIPUKWBQNKWBK-HNNXBMFYSA-N 0 0 354.414 3.728 20 5 FHBDRN Cn1cc([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)cn1 ZINC000548671084 935235852 /nfs/dbraw/zinc/23/58/52/935235852.db2.gz SDTJCNUZTPEWOB-OAHLLOKOSA-N 0 0 370.434 3.910 20 5 FHBDRN CCc1c(C(=O)N2CCc3cc([N+](=O)[O-])ccc32)cnn1CCC(C)C ZINC000427104137 945086415 /nfs/dbraw/zinc/08/64/15/945086415.db2.gz MEPMCRBGOSOXSB-UHFFFAOYSA-N 0 0 356.426 3.603 20 5 FHBDRN CCOc1ncccc1C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000014376705 935242597 /nfs/dbraw/zinc/24/25/97/935242597.db2.gz DRKBPMDXYBRAJI-UHFFFAOYSA-N 0 0 370.390 3.764 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N(C)CCOCc1ccccc1 ZINC000439912533 945087159 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FHBDRN CCCOc1ccccc1[C@H](CC(C)C)NC(=O)c1[nH]nc(C)c1[N+](=O)[O-] ZINC000074549048 935981644 /nfs/dbraw/zinc/98/16/44/935981644.db2.gz JIFNQVNZSYWNGF-HNNXBMFYSA-N 0 0 374.441 3.932 20 5 FHBDRN CCCCS(=O)(=O)Nc1ccc(Nc2cc(C)c([N+](=O)[O-])cn2)cc1 ZINC000074765520 935988339 /nfs/dbraw/zinc/98/83/39/935988339.db2.gz FYTLKNNDRMHLLW-UHFFFAOYSA-N 0 0 364.427 3.584 20 5 FHBDRN C[C@@H](Nc1ncnc2ccc([N+](=O)[O-])cc21)c1ccccc1-n1cccn1 ZINC000611710950 936002118 /nfs/dbraw/zinc/00/21/18/936002118.db2.gz JNSIPRPRPKSOAX-CYBMUJFWSA-N 0 0 360.377 3.897 20 5 FHBDRN CCN(CCC(F)(F)F)C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000611614815 936008672 /nfs/dbraw/zinc/00/86/72/936008672.db2.gz HNRDWXZKTXZQOC-UHFFFAOYSA-N 0 0 356.247 3.611 20 5 FHBDRN C[C@H](Nc1ccc([N+](=O)[O-])cc1Cl)c1ncc(Br)cn1 ZINC000431480448 936012056 /nfs/dbraw/zinc/01/20/56/936012056.db2.gz BFGAUOSEDMUQFA-ZETCQYMHSA-N 0 0 357.595 3.974 20 5 FHBDRN Cc1nn(C(C)C)c(C)c1CC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000582732481 936016403 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C[C@@H](NC(=O)Nc1ccccc1N1CCCC1=O)c1cccc([N+](=O)[O-])c1 ZINC000047394607 945145487 /nfs/dbraw/zinc/14/54/87/945145487.db2.gz DHEFRWJHTMXPKY-CYBMUJFWSA-N 0 0 368.393 3.604 20 5 FHBDRN COc1cc(CCNC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)ccc1C ZINC000078145934 936065731 /nfs/dbraw/zinc/06/57/31/936065731.db2.gz IMWZMKYNQILRRD-UHFFFAOYSA-N 0 0 356.422 3.548 20 5 FHBDRN CCC[C@@H](C)C(=O)Oc1cc([N+](=O)[O-])ccc1I ZINC000781747410 936074793 /nfs/dbraw/zinc/07/47/93/936074793.db2.gz OHHBHFSSUTUOLF-MRVPVSSYSA-N 0 0 363.151 3.541 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CC[C@@H](Cc2ccccc2)C1 ZINC000135671500 936089102 /nfs/dbraw/zinc/08/91/02/936089102.db2.gz NIBCFNXVCLEGLB-INIZCTEOSA-N 0 0 363.417 3.710 20 5 FHBDRN CCCn1ncnc1CSCc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000582765496 936094342 /nfs/dbraw/zinc/09/43/42/936094342.db2.gz YWRYZSRKZZRFMA-UHFFFAOYSA-N 0 0 359.411 3.685 20 5 FHBDRN CO[C@H]1CCCN(c2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])CC1 ZINC000611931460 936101833 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3.747 20 5 FHBDRN O=C(NC1CC1)c1ccc(N2CCC[C@H]2c2cccc(F)c2)c([N+](=O)[O-])c1 ZINC000091454669 936174660 /nfs/dbraw/zinc/17/46/60/936174660.db2.gz FMCMWSXZHNSFFV-KRWDZBQOSA-N 0 0 369.396 3.968 20 5 FHBDRN CC[C@](C)(NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)c1nc(C)cs1 ZINC000135735256 936177858 /nfs/dbraw/zinc/17/78/58/936177858.db2.gz ZBSOEFRRXOVCQN-SFHVURJKSA-N 0 0 372.450 3.825 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1F)Nc1ccc(OC(F)(F)F)cc1 ZINC000121949152 936179827 /nfs/dbraw/zinc/17/98/27/936179827.db2.gz GXFBTBAEBMKQHM-UHFFFAOYSA-N 0 0 358.247 3.814 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])N[C@@H](C1CCCCC1)C(F)(F)F ZINC000439997693 945149075 /nfs/dbraw/zinc/14/90/75/945149075.db2.gz WGKHIRPPPHNYQW-HNNXBMFYSA-N 0 0 359.348 3.634 20 5 FHBDRN CCOc1cc(N[C@@H](C)c2ncc(Br)cn2)ccc1[N+](=O)[O-] ZINC000431496715 936203757 /nfs/dbraw/zinc/20/37/57/936203757.db2.gz SXILJPGUYSFJCI-VIFPVBQESA-N 0 0 367.203 3.719 20 5 FHBDRN CC(C)n1cc2cc(NC(=O)COc3ccc([N+](=O)[O-])c(F)c3)ccc2n1 ZINC000135260047 936223933 /nfs/dbraw/zinc/22/39/33/936223933.db2.gz PSECWEWHJPXPDD-UHFFFAOYSA-N 0 0 372.356 3.682 20 5 FHBDRN CC(C)NC(=O)c1ccc(N[C@H]2CCc3c2cccc3O)c([N+](=O)[O-])c1 ZINC000091484975 936227351 /nfs/dbraw/zinc/22/73/51/936227351.db2.gz CRGQVYWSFGMBAJ-HNNXBMFYSA-N 0 0 355.394 3.538 20 5 FHBDRN O=C(c1c[nH]c2cccc([N+](=O)[O-])c12)N1CC[C@@H](Oc2cccc(F)c2)C1 ZINC000612375116 936228998 /nfs/dbraw/zinc/22/89/98/936228998.db2.gz HEZVYIUSDBLVJN-CQSZACIVSA-N 0 0 369.352 3.509 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1 ZINC001203151086 936233601 /nfs/dbraw/zinc/23/36/01/936233601.db2.gz RWWVBFLONHPRFW-PKOBYXMFSA-N 0 0 369.421 3.942 20 5 FHBDRN Cc1cccc(NC2CCN(C(=O)c3ccc(F)cc3[N+](=O)[O-])CC2)c1 ZINC000135841850 936270543 /nfs/dbraw/zinc/27/05/43/936270543.db2.gz TXQXUXUFQQCYQT-UHFFFAOYSA-N 0 0 357.385 3.759 20 5 FHBDRN O=C(c1c([N+](=O)[O-])cccc1C(F)(F)F)N1CCC[C@H]([C@@H]2CCOC2)C1 ZINC000612556187 936275409 /nfs/dbraw/zinc/27/54/09/936275409.db2.gz KLPURRPAEIKRRB-NWDGAFQWSA-N 0 0 372.343 3.502 20 5 FHBDRN CCn1ncc(C(=O)N(C)Cc2ccccc2[N+](=O)[O-])c1-c1ccccc1 ZINC000427169372 945153340 /nfs/dbraw/zinc/15/33/40/945153340.db2.gz COHOTZVZUAGYJG-UHFFFAOYSA-N 0 0 364.405 3.750 20 5 FHBDRN COc1ccc(CN[C@@H](C)c2nc(-c3ccncc3)cs2)cc1[N+](=O)[O-] ZINC000124115935 945153489 /nfs/dbraw/zinc/15/34/89/945153489.db2.gz RFCPQUWFSQNEDC-LBPRGKRZSA-N 0 0 370.434 3.973 20 5 FHBDRN C[C@H](C(=O)N[C@H]1CCN(c2ccc(Cl)cc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000516696896 945153460 /nfs/dbraw/zinc/15/34/60/945153460.db2.gz HYTFIWSFXJQGKO-BBRMVZONSA-N 0 0 373.840 3.747 20 5 FHBDRN O=C(CSc1ccccc1[N+](=O)[O-])Nc1cccc(OCCF)c1 ZINC000124127195 945154707 /nfs/dbraw/zinc/15/47/07/945154707.db2.gz VPQDWHUJQOGMOR-UHFFFAOYSA-N 0 0 350.371 3.674 20 5 FHBDRN Cc1c(Cc2noc(-c3noc4c3C[C@@H](C)CC4)n2)cccc1[N+](=O)[O-] ZINC000582930853 936298324 /nfs/dbraw/zinc/29/83/24/936298324.db2.gz ATLTUHDOYATREQ-JTQLQIEISA-N 0 0 354.366 3.657 20 5 FHBDRN Cn1c2ccccc2nc1-c1ccc(NC(=O)c2ccc([N+](=O)[O-])[nH]2)cc1 ZINC000519130146 945156347 /nfs/dbraw/zinc/15/63/47/945156347.db2.gz FZFQWTQUSYIOAG-UHFFFAOYSA-N 0 0 361.361 3.729 20 5 FHBDRN CCOc1cccc([C@@H]2C[C@H]2NC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)c1 ZINC000437235395 945159316 /nfs/dbraw/zinc/15/93/16/945159316.db2.gz VKBRAEPLOHDRCS-HNAYVOBHSA-N 0 0 365.389 3.761 20 5 FHBDRN Cc1cc(OCC(=O)Nc2ccc(F)cc2F)c(Cl)cc1[N+](=O)[O-] ZINC000506418098 945159991 /nfs/dbraw/zinc/15/99/91/945159991.db2.gz VEQLFMAWYPEDAI-UHFFFAOYSA-N 0 0 356.712 3.852 20 5 FHBDRN CNC(=O)c1ccc(N2CC3(CCC3)[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000432135574 945161025 /nfs/dbraw/zinc/16/10/25/945161025.db2.gz JSVLHEHBVXAIGH-SFHVURJKSA-N 0 0 351.406 3.686 20 5 FHBDRN O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1ccccc1OC1CC1 ZINC000583462749 938264045 /nfs/dbraw/zinc/26/40/45/938264045.db2.gz WLDPBNWSFLMARI-UHFFFAOYSA-N 0 0 364.304 3.990 20 5 FHBDRN COc1cc(C(=O)N(C)C2CCCCC2)c([N+](=O)[O-])cc1OC(F)F ZINC000283235593 938264209 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370.192 3.738 20 5 FHBDRN CC(=O)NCC[C@H]1CCCN(c2c(Cl)cc(Cl)cc2[N+](=O)[O-])C1 ZINC000583893814 938471093 /nfs/dbraw/zinc/47/10/93/938471093.db2.gz QIVDBUYBPRDPCZ-LLVKDONJSA-N 0 0 360.241 3.644 20 5 FHBDRN CCCC[C@@H](NC(=O)c1cccc2c(=O)c3ccccc3[nH]c12)C(=O)OC ZINC000278490207 938473856 /nfs/dbraw/zinc/47/38/56/938473856.db2.gz JUJLGKVGZZFTIL-QGZVFWFLSA-N 0 0 366.417 3.555 20 5 FHBDRN O=C(N[C@H]1CC=C(c2ccc(F)cc2)CC1)c1cc([O-])cc([N+](=O)[O-])c1 ZINC000507361158 945178851 /nfs/dbraw/zinc/17/88/51/945178851.db2.gz MHRCGMXGABXLER-INIZCTEOSA-N 0 0 356.353 3.805 20 5 FHBDRN O=C(CSc1ccccc1[N+](=O)[O-])N[C@@H](c1ccccc1)[C@@H]1CCOC1 ZINC000544055869 938488775 /nfs/dbraw/zinc/48/87/75/938488775.db2.gz IYIGJTNCNRCZBJ-BEFAXECRSA-N 0 0 372.446 3.581 20 5 FHBDRN O=[N+]([O-])c1cccc2c(NC[C@@H](CO)Cc3ccc(F)c(F)c3)ccnc21 ZINC000432139991 945179565 /nfs/dbraw/zinc/17/95/65/945179565.db2.gz NXPDRHKBXKHUPH-ZDUSSCGKSA-N 0 0 373.359 3.684 20 5 FHBDRN CN(Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)Cc1ccc(OC(F)F)cc1 ZINC000052689499 938490968 /nfs/dbraw/zinc/49/09/68/938490968.db2.gz GELGKYRVMCQKKW-UHFFFAOYSA-N 0 0 362.336 3.705 20 5 FHBDRN C[C@@H]1CCC[C@@H](NC(=O)COc2ccc([N+](=O)[O-])cc2C(F)(F)F)[C@H]1C ZINC000516715120 945179804 /nfs/dbraw/zinc/17/98/04/945179804.db2.gz OIHNQXNPTPQRAF-UHIISALHSA-N 0 0 374.359 3.933 20 5 FHBDRN Cc1noc([C@@H]2CCCN2Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])n1 ZINC000289780377 938491760 /nfs/dbraw/zinc/49/17/60/938491760.db2.gz MQSWHYRWMFHYMO-LBPRGKRZSA-N 0 0 357.197 3.930 20 5 FHBDRN Cc1ocnc1CNc1cc(C(F)(F)C(F)(F)F)ncc1[N+](=O)[O-] ZINC000278510159 938492495 /nfs/dbraw/zinc/49/24/95/938492495.db2.gz RJQODGZJABTWHU-UHFFFAOYSA-N 0 0 352.219 3.552 20 5 FHBDRN CC(C)(C)C1=CCN(S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000536165257 938493121 /nfs/dbraw/zinc/49/31/21/938493121.db2.gz IOOUWGMNDMIUHH-UHFFFAOYSA-N 0 0 358.847 3.615 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1CNc1cccc(C(=O)N(C)CC)c1 ZINC000583957809 938503989 /nfs/dbraw/zinc/50/39/89/938503989.db2.gz NTMHVQGYTFGUJA-UHFFFAOYSA-N 0 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CC[C@@H](Nc1ncc([N+](=O)[O-])c(C)c1Br)C(=O)OC(C)(C)C ZINC000584139875 938613334 /nfs/dbraw/zinc/61/33/34/938613334.db2.gz IJJMRFLAHFSEKY-SECBINFHSA-N 0 0 374.235 3.593 20 5 FHBDRN O=C(NC[C@@H]1CCO[C@@H]1c1ccccc1)c1c[nH]c2ccc([N+](=O)[O-])cc21 ZINC000584145282 938616646 /nfs/dbraw/zinc/61/66/46/938616646.db2.gz QZMIBMWLWHIILP-IFXJQAMLSA-N 0 0 365.389 3.584 20 5 FHBDRN C[C@H](c1cccc(Cl)c1)N(C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1F ZINC000056119025 938624867 /nfs/dbraw/zinc/62/48/67/938624867.db2.gz UHADSCIGOXKNNX-SNVBAGLBSA-N 0 0 372.805 3.769 20 5 FHBDRN O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCc2ccc(O)cc2C1 ZINC000052865619 938636832 /nfs/dbraw/zinc/63/68/32/938636832.db2.gz ULXJDDCVTWYNHW-UHFFFAOYSA-N 0 0 354.387 3.714 20 5 FHBDRN Cc1ccc(OCc2csc(-c3ccc(C(N)=O)cc3)n2)c([N+](=O)[O-])c1 ZINC000052890182 938646023 /nfs/dbraw/zinc/64/60/23/938646023.db2.gz OTKSBYVDQJMVCV-UHFFFAOYSA-N 0 0 369.402 3.705 20 5 FHBDRN Cc1ccc2nc(CS[C@@H](C)c3ccccc3[N+](=O)[O-])cc(=O)n2c1 ZINC000437270921 945196190 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COCCOc1cccc(C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c1 ZINC000052981059 938691124 /nfs/dbraw/zinc/69/11/24/938691124.db2.gz GTQYUEBITHJETD-UHFFFAOYSA-N 0 0 350.758 3.526 20 5 FHBDRN Cc1nn(C(C)(C)C)cc1[C@H](C)NC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000584344189 938693920 /nfs/dbraw/zinc/69/39/20/938693920.db2.gz SBTOOWUZMDXWKN-OLZOCXBDSA-N 0 0 358.442 3.836 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1N1CCC[C@@]2(CCCOC2)C1 ZINC000080706568 938698009 /nfs/dbraw/zinc/69/80/09/938698009.db2.gz GTEWBWHPIAQGHT-OAHLLOKOSA-N 0 0 355.232 3.754 20 5 FHBDRN Cc1ccc(C(=O)N(C)c2nnc(-c3ccccc3)s2)cc1[N+](=O)[O-] ZINC000080799557 938700091 /nfs/dbraw/zinc/70/00/91/938700091.db2.gz ASTOBRAWWWSKKQ-UHFFFAOYSA-N 0 0 354.391 3.698 20 5 FHBDRN Cc1cc(NCc2cccc(OCc3ccccn3)c2)ncc1[N+](=O)[O-] ZINC000074740892 938707354 /nfs/dbraw/zinc/70/73/54/938707354.db2.gz ZDNXMUNJUPJHCK-UHFFFAOYSA-N 0 0 350.378 3.884 20 5 FHBDRN Cn1cc(-c2nc(-c3ccsc3)no2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000584383070 938786297 /nfs/dbraw/zinc/78/62/97/938786297.db2.gz BQGOXKQDUWRWOZ-UHFFFAOYSA-N 0 0 353.363 3.774 20 5 FHBDRN Cn1ncnc1NCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000162200842 938796461 /nfs/dbraw/zinc/79/64/61/938796461.db2.gz LZQACLAAPIAFBC-UHFFFAOYSA-N 0 0 359.773 3.781 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCCN(C)c2cc(F)ccc21 ZINC000516758275 945204932 /nfs/dbraw/zinc/20/49/32/945204932.db2.gz OKJUURNYDBUXRE-UHFFFAOYSA-N 0 0 357.385 3.837 20 5 FHBDRN CCCc1n[nH]c(C(=O)NCC(C)(C)c2ccc(CC)cc2)c1[N+](=O)[O-] ZINC000431549969 938813282 /nfs/dbraw/zinc/81/32/82/938813282.db2.gz ZBOFKRYGYPPTBX-UHFFFAOYSA-N 0 0 358.442 3.540 20 5 FHBDRN O=C(N[C@@H]1C[C@H]1c1c(F)cccc1F)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000437291819 945206866 /nfs/dbraw/zinc/20/68/66/945206866.db2.gz WCDBYHPUCUYBBV-BXUZGUMPSA-N 0 0 352.724 3.812 20 5 FHBDRN CCC(=O)c1ccc(NCC2CCN(CC(F)(F)F)CC2)c([N+](=O)[O-])c1 ZINC000480322155 938845265 /nfs/dbraw/zinc/84/52/65/938845265.db2.gz BIYIBFFLUHWZDD-UHFFFAOYSA-N 0 0 373.375 3.874 20 5 FHBDRN COc1ccc(NC(=O)Nc2cnn(CC(C)C)c2C2CC2)cc1[N+](=O)[O-] ZINC000480319966 938851373 /nfs/dbraw/zinc/85/13/73/938851373.db2.gz PGWACJICBPZMTR-UHFFFAOYSA-N 0 0 373.413 3.977 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC[C@@H]1c1c(C)n[nH]c1C ZINC000289864964 938854323 /nfs/dbraw/zinc/85/43/23/938854323.db2.gz RFZWIMMEFHYCBC-MRXNPFEDSA-N 0 0 357.414 3.866 20 5 FHBDRN CN(CCN(C)C(=O)OC(C)(C)C)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000782493893 938856350 /nfs/dbraw/zinc/85/63/50/938856350.db2.gz SYUBFJVFUCBAEN-UHFFFAOYSA-N 0 0 357.838 3.547 20 5 FHBDRN Cc1cccc([C@H]2CCN(C(=O)Cc3c(F)cc([N+](=O)[O-])cc3F)C2)c1 ZINC000573242144 938856700 /nfs/dbraw/zinc/85/67/00/938856700.db2.gz CBCSCNTVVQVZFB-AWEZNQCLSA-N 0 0 360.360 3.740 20 5 FHBDRN Cc1cc(OCC(=O)N([C@@H](C)C2CC2)C2CC2)c(Cl)cc1[N+](=O)[O-] ZINC000506434020 945211660 /nfs/dbraw/zinc/21/16/60/945211660.db2.gz UCFMAYXZFHXXMM-NSHDSACASA-N 0 0 352.818 3.725 20 5 FHBDRN CCN(Cc1ccccc1)c1ccc(C(=O)c2nccn2C)cc1[N+](=O)[O-] ZINC000480348791 938878373 /nfs/dbraw/zinc/87/83/73/938878373.db2.gz NYJUTDJTNQKAEL-UHFFFAOYSA-N 0 0 364.405 3.586 20 5 FHBDRN Cc1ccccc1OCCN(C)C(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000024220792 938885915 /nfs/dbraw/zinc/88/59/15/938885915.db2.gz OBXXKGYZZSXCCH-HNNXBMFYSA-N 0 0 374.462 3.921 20 5 FHBDRN COc1ccc(OCC(=O)c2cccc(C(F)(F)F)c2)c([N+](=O)[O-])c1 ZINC000024220922 938885925 /nfs/dbraw/zinc/88/59/25/938885925.db2.gz PNSXDJLYFFDPIW-UHFFFAOYSA-N 0 0 355.268 3.884 20 5 FHBDRN CC[C@@H](OC(=O)Cn1ccc2ccccc2c1=O)c1cccc([N+](=O)[O-])c1 ZINC001267374931 938905848 /nfs/dbraw/zinc/90/58/48/938905848.db2.gz VOKCWMWNEQIWSX-GOSISDBHSA-N 0 0 366.373 3.604 20 5 FHBDRN Cc1ccc(CN(C)Cc2nc([C@@H](C)OCC(C)C)no2)cc1[N+](=O)[O-] ZINC000093885691 938931395 /nfs/dbraw/zinc/93/13/95/938931395.db2.gz UXJHRQKASWDHAG-CQSZACIVSA-N 0 0 362.430 3.652 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(C)[C@@H](C)c1ccc(F)cc1 ZINC000065685274 938937504 /nfs/dbraw/zinc/93/75/04/938937504.db2.gz STNHAVUMHNVQCA-LBPRGKRZSA-N 0 0 366.414 3.678 20 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CCc1ccc(C(=O)NCc2ccc(OC(F)F)c(F)c2)cc1[N+](=O)[O-] ZINC000511295348 938993562 /nfs/dbraw/zinc/99/35/62/938993562.db2.gz VAPQYFKFDWADFZ-UHFFFAOYSA-N 0 0 368.311 3.828 20 5 FHBDRN CCc1nn(C)c(N[C@H](c2ccc(C)cc2)c2ccccn2)c1[N+](=O)[O-] ZINC000480572728 938994223 /nfs/dbraw/zinc/99/42/23/938994223.db2.gz BTWUJXNSTRANPG-QGZVFWFLSA-N 0 0 351.410 3.796 20 5 FHBDRN COC(=O)[C@@H](Cc1ccc(C)cc1)Sc1ccc(C(C)=O)cc1[N+](=O)[O-] ZINC000480582853 938996046 /nfs/dbraw/zinc/99/60/46/938996046.db2.gz VKGOGHHATXBRSK-GOSISDBHSA-N 0 0 373.430 3.982 20 5 FHBDRN O=[N+]([O-])c1cnc(Nc2ccc(N3CCCCC3)c3ncccc23)nc1 ZINC000480582683 938996066 /nfs/dbraw/zinc/99/60/66/938996066.db2.gz UHIOMQDVMLNHRM-UHFFFAOYSA-N 0 0 350.382 3.667 20 5 FHBDRN O=[N+]([O-])c1ccccc1CN(Cc1cncc(Br)c1)C1CC1 ZINC000179242492 938996417 /nfs/dbraw/zinc/99/64/17/938996417.db2.gz PRIVBXQZMOOOTL-UHFFFAOYSA-N 0 0 362.227 3.917 20 5 FHBDRN Cc1cc2c(cc1C)[C@H](C(=O)N1CCCc3c([N+](=O)[O-])cccc31)CO2 ZINC000472343499 939001240 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FHBDRN Cc1ccc(CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)cc1Br ZINC000188072502 939017552 /nfs/dbraw/zinc/01/75/52/939017552.db2.gz WYSBJQMCSIJIGE-UHFFFAOYSA-N 0 0 363.211 3.871 20 5 FHBDRN CC(C)c1ccc(C(=O)N(C)[C@H]2CCCc3c2cnn3C)cc1[N+](=O)[O-] ZINC000188064081 939017584 /nfs/dbraw/zinc/01/75/84/939017584.db2.gz ZTVFCBRLUFKJEW-INIZCTEOSA-N 0 0 356.426 3.601 20 5 FHBDRN CC(C)Oc1ccccc1NC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000065733123 939018383 /nfs/dbraw/zinc/01/83/83/939018383.db2.gz PYDOQUJSALXCNS-UHFFFAOYSA-N 0 0 353.378 3.975 20 5 FHBDRN CCOc1ccc(COC(=O)Cc2cccc([N+](=O)[O-])c2C)cc1OC ZINC000796849781 939018642 /nfs/dbraw/zinc/01/86/42/939018642.db2.gz WDXNFSFXRINNGI-UHFFFAOYSA-N 0 0 359.378 3.596 20 5 FHBDRN Cc1ccc(C)c(OC2CCN(C(=O)c3ccc([N+](=O)[O-])s3)CC2)c1 ZINC000065742270 939021724 /nfs/dbraw/zinc/02/17/24/939021724.db2.gz SPJSLKWNUMBUCW-UHFFFAOYSA-N 0 0 360.435 3.957 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N(Cc1ccc(C(C)C)cc1)C1CC1 ZINC000065737119 939021726 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CC[C@@H](NC(=O)NCCCCc1ccc([N+](=O)[O-])cc1)c1c(C)noc1C ZINC000179359570 939091359 /nfs/dbraw/zinc/09/13/59/939091359.db2.gz GVXYDGLMAPOAHB-QGZVFWFLSA-N 0 0 374.441 3.973 20 5 FHBDRN O=C(c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)N1CCC=Cc2ccccc21 ZINC000188245758 939092876 /nfs/dbraw/zinc/09/28/76/939092876.db2.gz WXLYYXOGCVCODS-UHFFFAOYSA-N 0 0 360.373 3.844 20 5 FHBDRN CC(C)(C(=O)N1CC[C@H](Oc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000516772865 945229396 /nfs/dbraw/zinc/22/93/96/945229396.db2.gz NPRLJOXFXIDHMT-INIZCTEOSA-N 0 0 372.396 3.691 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CCc2[nH]c3ccccc3c2C1 ZINC000179399958 939142496 /nfs/dbraw/zinc/14/24/96/939142496.db2.gz PQMRYDIOBLTRGK-UHFFFAOYSA-N 0 0 374.400 3.685 20 5 FHBDRN CCc1n[nH]c(C(=O)N(Cc2ccco2)Cc2ccc(C)s2)c1[N+](=O)[O-] ZINC000188295832 939150517 /nfs/dbraw/zinc/15/05/17/939150517.db2.gz FNSOCFVZYRQBCB-UHFFFAOYSA-N 0 0 374.422 3.686 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]cc(-c3nc(COc4ccccc4F)no3)c2c1 ZINC000188299050 939151261 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360.385 3.928 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)NC[C@H]1C[C@@H]1c1ccccc1 ZINC000111050714 945285197 /nfs/dbraw/zinc/28/51/97/945285197.db2.gz TXBWNPRIQPTVNF-VQIMIIECSA-N 0 0 353.422 3.707 20 5 FHBDRN CCN(C(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-])c1cccnc1C ZINC000410812424 939961620 /nfs/dbraw/zinc/96/16/20/939961620.db2.gz NFFBWWVHQBNHMU-UHFFFAOYSA-N 0 0 353.300 3.984 20 5 FHBDRN CCN(CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)[C@H](C)c1ccc(F)cc1 ZINC000053088526 939962813 /nfs/dbraw/zinc/96/28/13/939962813.db2.gz NSPGKMATUHSSQO-CQSZACIVSA-N 0 0 359.401 3.780 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)Cc1cnc2ccccc2n1 ZINC000410877388 939963696 /nfs/dbraw/zinc/96/36/96/939963696.db2.gz QBKUCVJEMLZFEO-CYBMUJFWSA-N 0 0 364.405 3.918 20 5 FHBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])N1CC[C@H](c2ccco2)C1 ZINC000612286690 939970158 /nfs/dbraw/zinc/97/01/58/939970158.db2.gz YHIOGDPAZVTFMD-NSHDSACASA-N 0 0 366.826 3.949 20 5 FHBDRN C[C@H]1C[C@@H](O)CCN1C(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 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373.434 3.513 20 5 FHBDRN CCCCc1cnc(NC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)nc1 ZINC000411077319 939993676 /nfs/dbraw/zinc/99/36/76/939993676.db2.gz YGCYGPRNRRCGSZ-LBPRGKRZSA-N 0 0 360.439 3.847 20 5 FHBDRN CCO[C@@H]1CCCC[C@H]1NC(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000411079815 939994433 /nfs/dbraw/zinc/99/44/33/939994433.db2.gz HKFCPNNAHOMEIM-ZIAGYGMSSA-N 0 0 360.332 3.691 20 5 FHBDRN O=C(NCc1nc2cc(Cl)ccc2s1)c1cc(F)cc([N+](=O)[O-])c1 ZINC000518280745 945287737 /nfs/dbraw/zinc/28/77/37/945287737.db2.gz MCCUPBDQGSUVGK-UHFFFAOYSA-N 0 0 365.773 3.927 20 5 FHBDRN CCN(c1ccnc(NC(=O)c2ccc([N+](=O)[O-])cc2C)n1)C1CCCC1 ZINC000411104316 939998768 /nfs/dbraw/zinc/99/87/68/939998768.db2.gz LNVRNVMJFLOEFO-UHFFFAOYSA-N 0 0 369.425 3.714 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N[C@@]2(C)CCCC[C@@H]2C)cc1OC ZINC000411093572 940000989 /nfs/dbraw/zinc/00/09/89/940000989.db2.gz KQRBUILBCOFRPG-SGTLLEGYSA-N 0 0 350.415 3.701 20 5 FHBDRN Cc1c(C(=O)N[C@H](C)[C@H](C)c2ccccc2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000177183556 940002277 /nfs/dbraw/zinc/00/22/77/940002277.db2.gz AMTLEXVADSLOPT-WCQYABFASA-N 0 0 357.366 3.733 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])Nc1ccccc1OC1CCCC1 ZINC000065872429 940004392 /nfs/dbraw/zinc/00/43/92/940004392.db2.gz DWHRFDZTZOTZKY-UHFFFAOYSA-N 0 0 355.394 3.967 20 5 FHBDRN CN(Cc1cc(Cl)cc(Cl)c1)C(=O)CNc1ccccc1[N+](=O)[O-] ZINC000065872555 940005186 /nfs/dbraw/zinc/00/51/86/940005186.db2.gz MVYFHJOAGVUIFO-UHFFFAOYSA-N 0 0 368.220 3.972 20 5 FHBDRN CCOc1ccc(CN(C)C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)cc1 ZINC000411172167 940006937 /nfs/dbraw/zinc/00/69/37/940006937.db2.gz ZAEVWGRGWKMXRL-RBUKOAKNSA-N 0 0 354.406 3.756 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)C(=O)N(CC1CCCCC1)C1CC1 ZINC000411180965 940007292 /nfs/dbraw/zinc/00/72/92/940007292.db2.gz OCRXDILDYNQVMX-UHFFFAOYSA-N 0 0 373.453 3.721 20 5 FHBDRN O=C(Nc1ccc2[nH]c(C(F)F)nc2c1)c1ccc(F)cc1[N+](=O)[O-] ZINC000179862187 940014231 /nfs/dbraw/zinc/01/42/31/940014231.db2.gz XSOLOEQHJFRWOW-UHFFFAOYSA-N 0 0 350.256 3.800 20 5 FHBDRN Cc1cccc(C(=O)Nc2ccc3c(c2)C(=O)CC(C)(C)O3)c1[N+](=O)[O-] ZINC000375880449 940014381 /nfs/dbraw/zinc/01/43/81/940014381.db2.gz VXGCAIJIWJXOKI-UHFFFAOYSA-N 0 0 354.362 3.899 20 5 FHBDRN Cc1cc(NC(=O)C(=O)N[C@H]2CCC[C@H]2CCC(C)C)ccc1[N+](=O)[O-] ZINC000411221325 940015314 /nfs/dbraw/zinc/01/53/14/940015314.db2.gz MWROVJODYQFODN-HOCLYGCPSA-N 0 0 361.442 3.563 20 5 FHBDRN CC(C)N(Cc1ccc(Cl)c(Cl)c1)C(=O)c1n[nH]cc1[N+](=O)[O-] ZINC000136535428 940020355 /nfs/dbraw/zinc/02/03/55/940020355.db2.gz JLAULTCWEHAXFL-UHFFFAOYSA-N 0 0 357.197 3.676 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CCC[C@H]1Cc1ccccc1 ZINC000411245728 940021818 /nfs/dbraw/zinc/02/18/18/940021818.db2.gz KZIAWCKYJRMOCW-SLFFLAALSA-N 0 0 350.418 3.932 20 5 FHBDRN CC(C)(C)OC(=O)CCCNC(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000465273080 940026551 /nfs/dbraw/zinc/02/65/51/940026551.db2.gz DYRQHVNENOVFSC-UHFFFAOYSA-N 0 0 364.442 3.744 20 5 FHBDRN C[C@@](O)(C1CCN(C/C=C\c2ccccc2[N+](=O)[O-])CC1)C(F)(F)F ZINC000545244331 940028250 /nfs/dbraw/zinc/02/82/50/940028250.db2.gz NMHAXTXCVYVCFK-DQOPKJQZSA-N 0 0 358.360 3.633 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])N1CCC[C@H]1Cc1ccccc1Cl ZINC000065892453 940030049 /nfs/dbraw/zinc/03/00/49/940030049.db2.gz WPRMCMIPWGGVPG-HNNXBMFYSA-N 0 0 373.840 3.894 20 5 FHBDRN O=C(N[C@@H]1C[C@H]1c1cc(F)c(F)c(F)c1)c1ccc([N+](=O)[O-])cc1Cl ZINC000437364030 945290951 /nfs/dbraw/zinc/29/09/51/945290951.db2.gz NRHKOMBZFHWFQG-IINYFYTJSA-N 0 0 370.714 3.951 20 5 FHBDRN C[C@]1(O)CCCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)C1 ZINC000179864554 940033776 /nfs/dbraw/zinc/03/37/76/940033776.db2.gz KNKRUMLGDFEHIO-IBGZPJMESA-N 0 0 372.446 3.733 20 5 FHBDRN Cc1nnc(-c2cccc(C(=O)N3c4ccc([N+](=O)[O-])cc4C[C@@H]3C)c2)o1 ZINC000159692591 940034639 /nfs/dbraw/zinc/03/46/39/940034639.db2.gz UDUVSDCRVNOFDD-NSHDSACASA-N 0 0 364.361 3.545 20 5 FHBDRN C[C@H](CC(C)(C)c1ccccc1)NC(=O)CNc1ccccc1[N+](=O)[O-] ZINC000065899094 940038691 /nfs/dbraw/zinc/03/86/91/940038691.db2.gz RUGJQTIBMZSUKO-OAHLLOKOSA-N 0 0 355.438 3.879 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])NCCc1cc(Cl)cc(Cl)c1 ZINC000065899098 940039476 /nfs/dbraw/zinc/03/94/76/940039476.db2.gz WXYZXIJXFOCOSZ-UHFFFAOYSA-N 0 0 368.220 3.672 20 5 FHBDRN CC[C@](C)([NH2+]CCC(=O)Nc1ccc([N+](=O)[O-])cc1)c1nc(C)cs1 ZINC000411389442 940041050 /nfs/dbraw/zinc/04/10/50/940041050.db2.gz PQGOXCLPTDVQIT-KRWDZBQOSA-N 0 0 362.455 3.603 20 5 FHBDRN O=C(OCc1coc(-c2ccc(F)c(F)c2)n1)c1cccc([N+](=O)[O-])c1 ZINC000728613709 940049299 /nfs/dbraw/zinc/04/92/99/940049299.db2.gz RKULPMHXOIMEOH-UHFFFAOYSA-N 0 0 360.272 3.885 20 5 FHBDRN CC(C)c1nc2n(n1)CCC[C@H]2Nc1nc2ccccc2cc1[N+](=O)[O-] ZINC000365049462 940049387 /nfs/dbraw/zinc/04/93/87/940049387.db2.gz ZBGAJALXDUJROT-CQSZACIVSA-N 0 0 352.398 3.805 20 5 FHBDRN Cc1cc(NC(=O)C(=O)N2CC(C)(C)[C@@H]2c2cccs2)ccc1[N+](=O)[O-] ZINC000411524350 940058002 /nfs/dbraw/zinc/05/80/02/940058002.db2.gz KKXLHISUWJANGF-HNNXBMFYSA-N 0 0 373.434 3.513 20 5 FHBDRN CC(C)Oc1ccccc1CNC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000411536380 940063867 /nfs/dbraw/zinc/06/38/67/940063867.db2.gz BDPVTYFDLOECGM-ZWKOTPCHSA-N 0 0 354.406 3.802 20 5 FHBDRN COc1ccc2c(c1)CC[C@H](Nc1ncnc3cccc([N+](=O)[O-])c31)C2 ZINC000612451349 940075309 /nfs/dbraw/zinc/07/53/09/940075309.db2.gz XLULBHIFYQDONY-AWEZNQCLSA-N 0 0 350.378 3.516 20 5 FHBDRN C[C@H]1CN(C(=O)c2c(Cl)cccc2[N+](=O)[O-])C[C@H](c2ccccc2)O1 ZINC000136651238 940075816 /nfs/dbraw/zinc/07/58/16/940075816.db2.gz REXOQIJSGVEWSG-BLLLJJGKSA-N 0 0 360.797 3.850 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CCCCc2c(Cl)cccc21 ZINC000612494709 940102082 /nfs/dbraw/zinc/10/20/82/940102082.db2.gz XZCZHSXOWISQRF-UHFFFAOYSA-N 0 0 362.817 3.513 20 5 FHBDRN CCc1ccc([C@H](C)NC(=O)CN(C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000548935342 940104140 /nfs/dbraw/zinc/10/41/40/940104140.db2.gz JJLHBXLEMQMQEZ-INIZCTEOSA-N 0 0 369.465 3.509 20 5 FHBDRN C[C@H](c1ccc(F)cc1)N(C)C(=O)COc1cc([N+](=O)[O-])ccc1Cl ZINC000177328008 940117339 /nfs/dbraw/zinc/11/73/39/940117339.db2.gz SFWRJGSEVABHDZ-LLVKDONJSA-N 0 0 366.776 3.986 20 5 FHBDRN Cc1c(NCC(=O)Nc2ccc(Br)cc2)cccc1[N+](=O)[O-] ZINC000007975029 940142580 /nfs/dbraw/zinc/14/25/80/940142580.db2.gz OMWXVZUXVCLOEX-UHFFFAOYSA-N 0 0 364.199 3.716 20 5 FHBDRN O=C(CN1CCSC2(CCC2)CC1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000411872114 940145572 /nfs/dbraw/zinc/14/55/72/940145572.db2.gz UHSRYOIYOKCDKS-UHFFFAOYSA-N 0 0 369.874 3.548 20 5 FHBDRN O=C(NCc1ccc(Cl)cn1)c1c([N+](=O)[O-])cccc1C(F)(F)F ZINC000612561844 940146320 /nfs/dbraw/zinc/14/63/20/940146320.db2.gz HFAZLQCQNGBJTD-UHFFFAOYSA-N 0 0 359.691 3.592 20 5 FHBDRN C[C@@H](NC(=O)C(C)(C)c1ccccc1[N+](=O)[O-])c1nc2ccccc2[nH]1 ZINC000431661722 940151393 /nfs/dbraw/zinc/15/13/93/940151393.db2.gz QZUWWMRWPLRITD-GFCCVEGCSA-N 0 0 352.394 3.626 20 5 FHBDRN COc1cc(CN(C)c2ccc(C(=O)NC(C)(C)C)cc2)ccc1[N+](=O)[O-] ZINC000411899732 940153750 /nfs/dbraw/zinc/15/37/50/940153750.db2.gz LHSYTNVJIRCJSJ-UHFFFAOYSA-N 0 0 371.437 3.768 20 5 FHBDRN C[C@@H](c1ccccc1[N+](=O)[O-])N1CC[C@@]2(C1)CC(=O)c1ccccc1O2 ZINC000411984791 940173313 /nfs/dbraw/zinc/17/33/13/940173313.db2.gz NFFSGKGRNMXNFI-XOBRGWDASA-N 0 0 352.390 3.766 20 5 FHBDRN O=C(NCCc1ccc(C(F)(F)F)cc1)NCc1cccc([N+](=O)[O-])c1 ZINC000062648249 940174321 /nfs/dbraw/zinc/17/43/21/940174321.db2.gz DXVQOIZYCJSYCH-UHFFFAOYSA-N 0 0 367.327 3.656 20 5 FHBDRN Cc1ccc(CN(C(C)C)S(=O)(=O)c2cccc([N+](=O)[O-])c2C)s1 ZINC000066002047 940175796 /nfs/dbraw/zinc/17/57/96/940175796.db2.gz NOCIHPWTWJEXCN-UHFFFAOYSA-N 0 0 368.480 3.872 20 5 FHBDRN O=C(Nc1ccc2c(c1)COC2)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000092047797 940180325 /nfs/dbraw/zinc/18/03/25/940180325.db2.gz DKPNIOUQGOZUIM-UHFFFAOYSA-N 0 0 352.268 3.896 20 5 FHBDRN C[C@@H](NC(=O)Nc1ccc2c(c1)OC(C)(C)O2)c1cccc([N+](=O)[O-])c1 ZINC000047552068 945301739 /nfs/dbraw/zinc/30/17/39/945301739.db2.gz MADVQOBJWISCDX-LLVKDONJSA-N 0 0 357.366 3.985 20 5 FHBDRN COc1cc(OCC(=O)Nc2ccc(C(C)(C)C)cc2)ccc1[N+](=O)[O-] ZINC000066013266 940188714 /nfs/dbraw/zinc/18/87/14/940188714.db2.gz MTQXZIRNKHRXHT-UHFFFAOYSA-N 0 0 358.394 3.918 20 5 FHBDRN CCCc1nc(C)c(C(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)s1 ZINC000584492482 940192209 /nfs/dbraw/zinc/19/22/09/940192209.db2.gz HMIWJWRHFFJEEZ-UHFFFAOYSA-N 0 0 372.450 3.766 20 5 FHBDRN CC(C)(C(=O)NCc1ccccc1[N+](=O)[O-])c1ccc(Cl)cc1F ZINC000188591312 940202316 /nfs/dbraw/zinc/20/23/16/940202316.db2.gz BAJIGJVHAHCAIT-UHFFFAOYSA-N 0 0 350.777 3.981 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1Cl)N1C[C@H]2CCC(=O)c3cccc1c32 ZINC000184376298 945303125 /nfs/dbraw/zinc/30/31/25/945303125.db2.gz ROAZOKPJJVWEIK-SNVBAGLBSA-N 0 0 356.765 3.969 20 5 FHBDRN CC(C)(C)Oc1ccc(CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])cn1 ZINC000180000440 940210638 /nfs/dbraw/zinc/21/06/38/940210638.db2.gz LOPHFRZPMRYCKN-UHFFFAOYSA-N 0 0 363.801 3.751 20 5 FHBDRN CC[C@@H](C)NC(=O)c1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2F)c(C)c1 ZINC000066034218 940212463 /nfs/dbraw/zinc/21/24/63/940212463.db2.gz POOQNCZBEYVHKB-GFCCVEGCSA-N 0 0 373.384 3.823 20 5 FHBDRN CC[C@@H](C)NC(=O)c1ccc(NC(=O)c2ccccc2[N+](=O)[O-])c(C)c1 ZINC000066035018 940212864 /nfs/dbraw/zinc/21/28/64/940212864.db2.gz RQTJBBABJRZIEH-CYBMUJFWSA-N 0 0 355.394 3.684 20 5 FHBDRN CCCCC1CCC(NC(=O)COc2ccc([N+](=O)[O-])c(OC)c2)CC1 ZINC000066028121 940212906 /nfs/dbraw/zinc/21/29/06/940212906.db2.gz UTHWTOWYHGPAOD-UHFFFAOYSA-N 0 0 364.442 3.847 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NCC2(c3ccc(F)cc3)CC2)c1 ZINC000548954234 940227231 /nfs/dbraw/zinc/22/72/31/940227231.db2.gz KKWHJHGIRIQDQI-UHFFFAOYSA-N 0 0 358.369 3.594 20 5 FHBDRN Cc1ccc2[nH]c(CNC(=O)NC(C)(C)c3ccc([N+](=O)[O-])cc3)nc2c1 ZINC000431669142 940234997 /nfs/dbraw/zinc/23/49/97/940234997.db2.gz FABGEGIHGBXRGK-UHFFFAOYSA-N 0 0 367.409 3.514 20 5 FHBDRN O=C(c1cc(Cl)ccc1Cl)N1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000376046737 940236551 /nfs/dbraw/zinc/23/65/51/940236551.db2.gz REHCTAMBHDJVNM-UHFFFAOYSA-N 0 0 369.208 3.575 20 5 FHBDRN CC(C)(C(=O)N1CC=C(c2ccc(O)cc2)CC1)c1ccccc1[N+](=O)[O-] ZINC000431673967 940240076 /nfs/dbraw/zinc/24/00/76/940240076.db2.gz QJPHIIIKUIIMOI-UHFFFAOYSA-N 0 0 366.417 3.894 20 5 FHBDRN Cc1ccc(S(=O)(=O)N2CCC[C@@H]2c2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000507528506 945305577 /nfs/dbraw/zinc/30/55/77/945305577.db2.gz JOVVLRYWJMAYFB-OAHLLOKOSA-N 0 0 364.398 3.568 20 5 FHBDRN C[C@H](CNC(=O)c1cc2cc([N+](=O)[O-])ccc2o1)COCc1ccccc1 ZINC000507532437 945307638 /nfs/dbraw/zinc/30/76/38/945307638.db2.gz MFNLMRLHDICQEL-CQSZACIVSA-N 0 0 368.389 3.924 20 5 FHBDRN Nc1ccc(-c2noc(C3(c4ccc(F)cc4)CCC3)n2)cc1[N+](=O)[O-] ZINC000612855621 940314379 /nfs/dbraw/zinc/31/43/79/940314379.db2.gz RGRDLXFEVOGJHG-UHFFFAOYSA-N 0 0 354.341 3.836 20 5 FHBDRN O=[N+]([O-])c1cc(F)cc(-c2nc(Cc3ccc(OC(F)F)cc3)no2)c1 ZINC000612868929 940316900 /nfs/dbraw/zinc/31/69/00/940316900.db2.gz AHGSZOOXYIAGGK-UHFFFAOYSA-N 0 0 365.267 3.976 20 5 FHBDRN Cc1cc(F)cc(-c2noc([C@@H](C)NC(=O)c3cccc([N+](=O)[O-])c3)n2)c1 ZINC000612890789 940329622 /nfs/dbraw/zinc/32/96/22/940329622.db2.gz DIHAWJHZGFUBNW-LLVKDONJSA-N 0 0 370.340 3.583 20 5 FHBDRN C[C@H](c1ncc(C(C)(C)C)o1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000177633038 940330008 /nfs/dbraw/zinc/33/00/08/940330008.db2.gz SKCAJSJTEAYSSJ-CQSZACIVSA-N 0 0 358.442 3.764 20 5 FHBDRN CCCCO[C@H]1C[C@@H](NC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])C1(C)C ZINC000177642809 940332417 /nfs/dbraw/zinc/33/24/17/940332417.db2.gz YDRPBSSKPJVSDB-CABCVRRESA-N 0 0 356.369 3.587 20 5 FHBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)c1nc(CCC2CCCCC2)no1 ZINC000612906964 940333688 /nfs/dbraw/zinc/33/36/88/940333688.db2.gz JGOAAYGHCWRWEI-ZDUSSCGKSA-N 0 0 372.425 3.982 20 5 FHBDRN Cc1ccc(Cc2noc(-c3ccc(NC4CC4)c([N+](=O)[O-])c3)n2)cn1 ZINC000612908538 940333942 /nfs/dbraw/zinc/33/39/42/940333942.db2.gz XPDHLBAMIWSZQZ-UHFFFAOYSA-N 0 0 351.366 3.513 20 5 FHBDRN COc1cccc([C@H](C)c2noc(-c3ccc([N+](=O)[O-])c(OC)c3)n2)c1 ZINC000612918155 940336275 /nfs/dbraw/zinc/33/62/75/940336275.db2.gz UDUVTBNGSGVXFV-NSHDSACASA-N 0 0 355.350 3.814 20 5 FHBDRN O=[N+]([O-])c1ccccc1NCCc1noc(CCc2ccccc2F)n1 ZINC000612928343 940341537 /nfs/dbraw/zinc/34/15/37/940341537.db2.gz ABLKDHHWUGWUFK-UHFFFAOYSA-N 0 0 356.357 3.557 20 5 FHBDRN O=[N+]([O-])c1cccc(Cc2nc(Cc3nc4cc(F)ccc4s3)no2)c1 ZINC000612932083 940343876 /nfs/dbraw/zinc/34/38/76/940343876.db2.gz OIGGNIQDQPXEKP-UHFFFAOYSA-N 0 0 370.365 3.908 20 5 FHBDRN CCCN(CCC)C(=O)CCCc1nc(-c2ccc([N+](=O)[O-])cc2C)no1 ZINC000612935418 940345110 /nfs/dbraw/zinc/34/51/10/940345110.db2.gz IVRQBADNHANBOK-UHFFFAOYSA-N 0 0 374.441 3.925 20 5 FHBDRN COc1ccc2c(ccn2Cc2nc(-c3ccc([N+](=O)[O-])cc3C)no2)c1 ZINC000612936112 940345482 /nfs/dbraw/zinc/34/54/82/940345482.db2.gz FTVAWYDEDVLMQJ-UHFFFAOYSA-N 0 0 364.361 3.965 20 5 FHBDRN C[C@@H]1CCCC[C@@H]1NC(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000086971281 945316356 /nfs/dbraw/zinc/31/63/56/945316356.db2.gz KQHHDKFNVBXUOJ-YGRLFVJLSA-N 0 0 355.232 3.595 20 5 FHBDRN O=C(OCCCc1ccccc1Br)c1ccc([N+](=O)[O-])o1 ZINC000782664626 940349099 /nfs/dbraw/zinc/34/90/99/940349099.db2.gz IUTCALARSCLXIQ-UHFFFAOYSA-N 0 0 354.156 3.740 20 5 FHBDRN O=[N+]([O-])c1cc(Br)cc(-c2nc([C@@H]3CCCS3)no2)c1 ZINC000612948869 940354612 /nfs/dbraw/zinc/35/46/12/940354612.db2.gz ADJIAJIDIOXWOQ-JTQLQIEISA-N 0 0 356.201 3.975 20 5 FHBDRN COc1cc(Cc2noc(Cc3cc4ccccc4o3)n2)ccc1[N+](=O)[O-] ZINC000612966249 940360136 /nfs/dbraw/zinc/36/01/36/940360136.db2.gz LYCITQONIOHKPJ-UHFFFAOYSA-N 0 0 365.345 3.914 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)NCCc1nc2ccccc2n1C(F)F ZINC000511402944 940367376 /nfs/dbraw/zinc/36/73/76/940367376.db2.gz ZBNXSMDXUVJOMU-UHFFFAOYSA-N 0 0 374.347 3.621 20 5 FHBDRN CC(C)(C)N(CC(=O)Nc1ccc(F)cc1)Cc1cccc([N+](=O)[O-])c1 ZINC000506789626 945317699 /nfs/dbraw/zinc/31/76/99/945317699.db2.gz IKJOHIWEJPMGGK-UHFFFAOYSA-N 0 0 359.401 3.973 20 5 FHBDRN CCOc1cc(OCC(=O)Nc2c(C)cc(C)cc2C)ccc1[N+](=O)[O-] ZINC000188608089 940392364 /nfs/dbraw/zinc/39/23/64/940392364.db2.gz BWDUMCZPFBJTBL-UHFFFAOYSA-N 0 0 358.394 3.936 20 5 FHBDRN COc1cccc2c1CCCCN2C(=O)c1ccc([N+](=O)[O-])cc1OC ZINC000427369306 945319901 /nfs/dbraw/zinc/31/99/01/945319901.db2.gz FFKKQGQRHHVEEN-UHFFFAOYSA-N 0 0 356.378 3.595 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)NCCOC1CCCCCC1 ZINC000511421052 940431611 /nfs/dbraw/zinc/43/16/11/940431611.db2.gz MUSWTQPMYJBRMY-UHFFFAOYSA-N 0 0 363.458 3.518 20 5 FHBDRN Cc1oc(NC(=O)c2ccc(Br)cc2[N+](=O)[O-])nc1C1CC1 ZINC000892518752 940431666 /nfs/dbraw/zinc/43/16/66/940431666.db2.gz DIDXLUFNSMRQOO-UHFFFAOYSA-N 0 0 366.171 3.783 20 5 FHBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CCC[C@H]1C1CCC1 ZINC000102869716 940431906 /nfs/dbraw/zinc/43/19/06/940431906.db2.gz YPRNBIQJCANGFC-RISCZKNCSA-N 0 0 352.818 3.807 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1CCc2c(F)cc(F)cc2[C@@H]1C ZINC000427369010 945320245 /nfs/dbraw/zinc/32/02/45/945320245.db2.gz ZNXLCZWQNFOODE-JTQLQIEISA-N 0 0 362.332 3.641 20 5 FHBDRN C[C@H](CC(=O)OCCn1cc([N+](=O)[O-])cn1)c1cccc(C(F)(F)F)c1 ZINC000177792033 940437079 /nfs/dbraw/zinc/43/70/79/940437079.db2.gz USQYMBFIDCALPY-LLVKDONJSA-N 0 0 371.315 3.547 20 5 FHBDRN CN(C(=O)c1cccc([N+](=O)[O-])c1)c1nc2c(s1)COc1ccccc1-2 ZINC000376187666 940438626 /nfs/dbraw/zinc/43/86/26/940438626.db2.gz LNLOHCWGDFNFSR-UHFFFAOYSA-N 0 0 367.386 3.887 20 5 FHBDRN C[C@H](CC(=O)OCCn1cc([N+](=O)[O-])cn1)c1ccc(C(F)(F)F)cc1 ZINC000177788618 940439668 /nfs/dbraw/zinc/43/96/68/940439668.db2.gz MPVMZPXMCUITPA-LLVKDONJSA-N 0 0 371.315 3.547 20 5 FHBDRN Cc1c(CN2C(=O)[C@H]3C[C@@H](C4CCCCC4)CN3C2=O)cccc1[N+](=O)[O-] ZINC000431735725 940442835 /nfs/dbraw/zinc/44/28/35/940442835.db2.gz KVYBRGDEXAXHDG-SJLPKXTDSA-N 0 0 371.437 3.636 20 5 FHBDRN COC(=O)c1ccc(OCc2ccc(SC)c(OC)c2)cc1[N+](=O)[O-] ZINC000613109494 940451906 /nfs/dbraw/zinc/45/19/06/940451906.db2.gz LELPFFJZKOSLCX-UHFFFAOYSA-N 0 0 363.391 3.691 20 5 FHBDRN Cc1cc(C)c(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2F)c(Cl)c1 ZINC000613112017 940452573 /nfs/dbraw/zinc/45/25/73/940452573.db2.gz INRLNFLDZZFYQO-UHFFFAOYSA-N 0 0 358.778 3.805 20 5 FHBDRN CCOc1ccc(C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1[N+](=O)[O-] ZINC000177850347 940463152 /nfs/dbraw/zinc/46/31/52/940463152.db2.gz ZGXYGCPOXXQKNR-LBPRGKRZSA-N 0 0 373.365 3.701 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1[N+](=O)[O-] ZINC000177871142 940470266 /nfs/dbraw/zinc/47/02/66/940470266.db2.gz LDEDRLRQVQIQSR-SNVBAGLBSA-N 0 0 363.757 3.956 20 5 FHBDRN Cc1oc(NC(=O)c2c(Br)cccc2[N+](=O)[O-])nc1C1CC1 ZINC000892528907 940473692 /nfs/dbraw/zinc/47/36/92/940473692.db2.gz PQRIPSOUTHAEGW-UHFFFAOYSA-N 0 0 366.171 3.783 20 5 FHBDRN C[C@H](C(=O)Nc1cccc(OC[C@H]2CCCO2)c1)c1cccc([N+](=O)[O-])c1 ZINC000580507617 940477366 /nfs/dbraw/zinc/47/73/66/940477366.db2.gz QFUKXQJBOCYXAC-IFXJQAMLSA-N 0 0 370.405 3.895 20 5 FHBDRN Cc1c(Cc2noc(-c3ccc(NC4CC4)nc3)n2)cccc1[N+](=O)[O-] ZINC000580504831 940477431 /nfs/dbraw/zinc/47/74/31/940477431.db2.gz NEEXMIBQKLOJPX-UHFFFAOYSA-N 0 0 351.366 3.513 20 5 FHBDRN O=[N+]([O-])c1ccccc1-c1nc(Cc2cc(C(F)(F)F)ccn2)no1 ZINC000463123845 945318352 /nfs/dbraw/zinc/31/83/52/945318352.db2.gz LEYVWYCZTOVRBI-UHFFFAOYSA-N 0 0 350.256 3.649 20 5 FHBDRN C[C@@H]1C[C@@H](c2cccs2)CN1c1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1 ZINC000376217535 940481549 /nfs/dbraw/zinc/48/15/49/940481549.db2.gz DYHCFUBCPRIFRN-GHMZBOCLSA-N 0 0 356.407 3.688 20 5 FHBDRN O=[N+]([O-])c1c2cccnc2ccc1N1CC2(CCC2)[C@@H]1C1CCOCC1 ZINC000580710518 940484188 /nfs/dbraw/zinc/48/41/88/940484188.db2.gz DCHAAPWNNOYZHN-IBGZPJMESA-N 0 0 353.422 3.929 20 5 FHBDRN Cc1cc(C(=O)N2CC[C@@H](Oc3ccc(Cl)cc3)C2)ccc1[N+](=O)[O-] ZINC000580793740 940487403 /nfs/dbraw/zinc/48/74/03/940487403.db2.gz OMKOFLDXTNPNPG-MRXNPFEDSA-N 0 0 360.797 3.850 20 5 FHBDRN O=C(Nc1ccc2c(c1)COC2)c1c([N+](=O)[O-])cccc1C(F)(F)F ZINC000580918634 940488828 /nfs/dbraw/zinc/48/88/28/940488828.db2.gz BKMFZEWPTBCMOH-UHFFFAOYSA-N 0 0 352.268 3.896 20 5 FHBDRN CNc1c(C(=O)Nc2ccc3c(cnn3C(C)C)c2)cccc1[N+](=O)[O-] ZINC000613234181 940489691 /nfs/dbraw/zinc/48/96/91/940489691.db2.gz NOMSFTLESHWPCP-UHFFFAOYSA-N 0 0 353.382 3.819 20 5 FHBDRN COc1cc(-c2noc(COc3c(C)c(C)ncc3[N+](=O)[O-])n2)ccc1C ZINC000580962882 940490918 /nfs/dbraw/zinc/49/09/18/940490918.db2.gz JJIMVGSLCAXKPJ-UHFFFAOYSA-N 0 0 370.365 3.553 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC=C(c2ccccn2)C1 ZINC000581076307 940492941 /nfs/dbraw/zinc/49/29/41/940492941.db2.gz CWPWCNFNPVKOCP-QGZVFWFLSA-N 0 0 365.433 3.874 20 5 FHBDRN Cc1ccc2cccc(NC(=O)c3cnn(-c4ccc([N+](=O)[O-])cc4)c3)c2n1 ZINC000066462214 940494914 /nfs/dbraw/zinc/49/49/14/940494914.db2.gz PNXGAGRZMLAFTP-UHFFFAOYSA-N 0 0 373.372 3.889 20 5 FHBDRN O=C(NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)N[C@@H]1CC12CCCCC2 ZINC000581211463 940496758 /nfs/dbraw/zinc/49/67/58/940496758.db2.gz FJGKZPVDCQMFSF-QGZVFWFLSA-N 0 0 356.426 3.641 20 5 FHBDRN COc1cccc(-c2nc([C@H](OC)c3ccc(F)cc3)no2)c1[N+](=O)[O-] ZINC000581335954 940499639 /nfs/dbraw/zinc/49/96/39/940499639.db2.gz LTWWJVJDIANGAP-OAHLLOKOSA-N 0 0 359.313 3.528 20 5 FHBDRN COc1cccc(CNC(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)c1 ZINC000581381940 940502913 /nfs/dbraw/zinc/50/29/13/940502913.db2.gz JFXQXZVZBDHYQX-UHFFFAOYSA-N 0 0 354.284 3.552 20 5 FHBDRN C[C@H]1c2cc(F)cc(F)c2CCN1c1ncnc2ccc([N+](=O)[O-])cc21 ZINC000613284619 940505286 /nfs/dbraw/zinc/50/52/86/940505286.db2.gz TXRWJTJJSFMFMA-JTQLQIEISA-N 0 0 356.332 3.940 20 5 FHBDRN O=C(Nc1nc(-c2ccc3c(c2)CCCC3)cs1)c1c[nH]nc1[N+](=O)[O-] ZINC000581561045 940506489 /nfs/dbraw/zinc/50/64/89/940506489.db2.gz FPZKIGSODBGGEJ-UHFFFAOYSA-N 0 0 369.406 3.573 20 5 FHBDRN CCN(Cc1ccc(C)cc1)C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000581647503 940509193 /nfs/dbraw/zinc/50/91/93/940509193.db2.gz DJULFEPWFQUNED-UHFFFAOYSA-N 0 0 354.406 3.915 20 5 FHBDRN O=C1OC(c2cccnc2)=N/C1=C\c1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000178015345 940509826 /nfs/dbraw/zinc/50/98/26/940509826.db2.gz OITFQPYELKENFD-GDNBJRDFSA-N 0 0 361.313 3.594 20 5 FHBDRN C[C@H]1CCCN1C(=O)c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1 ZINC000173127914 940511134 /nfs/dbraw/zinc/51/11/34/940511134.db2.gz RUVSHPWSWNFUOK-VIFPVBQESA-N 0 0 369.208 3.712 20 5 FHBDRN Cc1ccc(Sc2ccc(CN(CC(N)=O)C(C)C)cc2[N+](=O)[O-])cc1 ZINC000506790966 945329790 /nfs/dbraw/zinc/32/97/90/945329790.db2.gz VOTQGQXTYIGPDS-UHFFFAOYSA-N 0 0 373.478 3.750 20 5 FHBDRN COc1ccccc1C[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1OC)C(C)C ZINC000427384011 945331084 /nfs/dbraw/zinc/33/10/84/945331084.db2.gz MACPQRIYJFNVDD-QGZVFWFLSA-N 0 0 372.421 3.609 20 5 FHBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)c1c(F)cc(C(F)(F)F)cc1F ZINC000581697780 940589495 /nfs/dbraw/zinc/58/94/95/940589495.db2.gz YZRBHIJBKMBBNF-UHFFFAOYSA-N 0 0 374.265 3.864 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)N[C@@H]2C[C@H]3CCC(C)(C)c4cccc2c43)n1 ZINC000427388866 945334612 /nfs/dbraw/zinc/33/46/12/945334612.db2.gz CHBSHFPZGLIPIV-IUODEOHRSA-N 0 0 368.437 3.841 20 5 FHBDRN O=[N+]([O-])c1ccc(Cc2noc(-c3ccccc3N3CCCCC3)n2)nc1 ZINC000581850618 940627368 /nfs/dbraw/zinc/62/73/68/940627368.db2.gz YTJREPZSYRCMLR-UHFFFAOYSA-N 0 0 365.393 3.621 20 5 FHBDRN CC[C@H](c1cccc(OC)c1)N(C)C(=O)c1ccc(OC)c([N+](=O)[O-])c1 ZINC000581964418 940635538 /nfs/dbraw/zinc/63/55/38/940635538.db2.gz KWTOKQQDBFUFNZ-MRXNPFEDSA-N 0 0 358.394 3.835 20 5 FHBDRN C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2Cl)[C@H](c2ccccc2)CO1 ZINC000173672502 940659838 /nfs/dbraw/zinc/65/98/38/940659838.db2.gz SONYFLUFCFCUEJ-PXAZEXFGSA-N 0 0 360.797 3.850 20 5 FHBDRN CCSc1cccc(-c2noc(CCn3nc(C)c([N+](=O)[O-])c3C)n2)c1 ZINC000426612498 945338377 /nfs/dbraw/zinc/33/83/77/945338377.db2.gz YFODLFHWICXUGS-UHFFFAOYSA-N 0 0 373.438 3.813 20 5 FHBDRN C[C@@H](NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)c1cc2n(n1)CCC2 ZINC000414145013 940674333 /nfs/dbraw/zinc/67/43/33/940674333.db2.gz MEAKVZWRYFMGPC-SNVBAGLBSA-N 0 0 354.332 3.607 20 5 FHBDRN COc1ccc(CS(=O)(=O)[C@@H](C)c2cc([N+](=O)[O-])ccc2C)cc1F ZINC000180135717 940679407 /nfs/dbraw/zinc/67/94/07/940679407.db2.gz LCUQGHQDXQXTDN-LBPRGKRZSA-N 0 0 367.398 3.727 20 5 FHBDRN CCCN(Cn1nc(-c2ccc([N+](=O)[O-])cc2)n(CC)c1=S)C1CC1 ZINC000178113602 940682484 /nfs/dbraw/zinc/68/24/84/940682484.db2.gz ALULNKQAEUHYFE-UHFFFAOYSA-N 0 0 361.471 3.841 20 5 FHBDRN Nc1c(C(=O)Nc2ccc(F)c(C(F)(F)F)c2)cc(F)cc1[N+](=O)[O-] ZINC000327658246 940685534 /nfs/dbraw/zinc/68/55/34/940685534.db2.gz GHNRWTWHOGJGSQ-UHFFFAOYSA-N 0 0 361.226 3.726 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)C(C)(C)c1ccc(F)cc1 ZINC000728650045 940720574 /nfs/dbraw/zinc/72/05/74/940720574.db2.gz BCXALJQLEBMJRK-UHFFFAOYSA-N 0 0 374.368 3.502 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@H]2CCCC[C@H]21 ZINC000180163008 940721935 /nfs/dbraw/zinc/72/19/35/940721935.db2.gz FJYBAMHFEATGOH-HZPDHXFCSA-N 0 0 364.467 3.879 20 5 FHBDRN C[C@@H](C(=O)N1CC[C@](F)(c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000582558400 940724404 /nfs/dbraw/zinc/72/44/04/940724404.db2.gz DVCNUJXCLUWZOJ-BFUOFWGJSA-N 0 0 360.360 3.935 20 5 FHBDRN O=C(Cn1cc(-c2ccccc2[N+](=O)[O-])cn1)N1CCC[C@@H]2CCCC[C@H]21 ZINC000582556606 940724896 /nfs/dbraw/zinc/72/48/96/940724896.db2.gz PFSIGJYDCUIWJH-MAUKXSAKSA-N 0 0 368.437 3.640 20 5 FHBDRN COC(=O)c1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)c1 ZINC000549032781 940767834 /nfs/dbraw/zinc/76/78/34/940767834.db2.gz LSYSVPMHDMTZKE-UHFFFAOYSA-N 0 0 368.267 3.653 20 5 FHBDRN CC[C@@H]1CN(C(=O)Cn2c3ccccc3c(=O)c3ccccc32)CCS1 ZINC000174788412 940776428 /nfs/dbraw/zinc/77/64/28/940776428.db2.gz HODAURPLSBQKJU-OAHLLOKOSA-N 0 0 366.486 3.509 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCN(c2nccc(C(C)C)n2)CC1 ZINC000613498662 940787268 /nfs/dbraw/zinc/78/72/68/940787268.db2.gz RTSUWNDIFNCHSZ-MRXNPFEDSA-N 0 0 369.469 3.700 20 5 FHBDRN CCC[C@H](NCc1ccccc1S(C)(=O)=O)c1cccc([N+](=O)[O-])c1 ZINC000414229121 940800963 /nfs/dbraw/zinc/80/09/63/940800963.db2.gz FBQYQUUZMMRNGS-KRWDZBQOSA-N 0 0 362.451 3.629 20 5 FHBDRN Cc1nnc(CNc2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])s1 ZINC000540940420 940827863 /nfs/dbraw/zinc/82/78/63/940827863.db2.gz RNBCQWKOFWSBQV-UHFFFAOYSA-N 0 0 354.391 3.598 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C[S@@](=O)C1CCC(C(F)(F)F)CC1 ZINC000414263454 940859260 /nfs/dbraw/zinc/85/92/60/940859260.db2.gz JNESVSFEHAFBTM-UDSWRNRHSA-N 0 0 365.373 3.973 20 5 FHBDRN COc1cc(C(=O)N2CC[C@H](C)C[C@H]2c2ccco2)c([N+](=O)[O-])cc1OC ZINC000175464869 940867861 /nfs/dbraw/zinc/86/78/61/940867861.db2.gz RKJBKVNKWQGPHB-WFASDCNBSA-N 0 0 374.393 3.818 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N1CCS[C@H]2CCCC[C@@H]21 ZINC000175442390 940870328 /nfs/dbraw/zinc/87/03/28/940870328.db2.gz SGXHRMXHASACLS-GJZGRUSLSA-N 0 0 354.859 3.677 20 5 FHBDRN CC(=O)c1ccc(NC(=O)c2ccc(Br)cc2[N+](=O)[O-])cc1 ZINC000175492911 940871352 /nfs/dbraw/zinc/87/13/52/940871352.db2.gz YWYZDKZVANMTEH-UHFFFAOYSA-N 0 0 363.167 3.812 20 5 FHBDRN O=C(NCCOc1ccccc1C(F)(F)F)c1ccc([N+](=O)[O-])cc1F ZINC000106654654 945357266 /nfs/dbraw/zinc/35/72/66/945357266.db2.gz ZXYSQDIUORLWFV-UHFFFAOYSA-N 0 0 372.274 3.562 20 5 FHBDRN COc1ccccc1C(C)(C)NC(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000170899183 940899133 /nfs/dbraw/zinc/89/91/33/940899133.db2.gz RLMHLFUIANHEIL-CYBMUJFWSA-N 0 0 357.410 3.899 20 5 FHBDRN O=C1c2ccccc2C(=O)N1CCCSc1ccc([N+](=O)[O-])cc1F ZINC000613527034 940916646 /nfs/dbraw/zinc/91/66/46/940916646.db2.gz UZQIBNUHYMMJOK-UHFFFAOYSA-N 0 0 360.366 3.512 20 5 FHBDRN Cc1ccc(CN(C)C(=O)c2ccc(Br)cc2[N+](=O)[O-])s1 ZINC000175761984 940922481 /nfs/dbraw/zinc/92/24/81/940922481.db2.gz DFGQJLHXWPHNJP-UHFFFAOYSA-N 0 0 369.240 3.999 20 5 FHBDRN Cc1csc([C@@H](C)CNC(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)n1 ZINC000186077684 940941444 /nfs/dbraw/zinc/94/14/44/940941444.db2.gz JOOBXTZFBYWWKY-GXSJLCMTSA-N 0 0 351.403 3.522 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1c2ccccc2SC[C@@H]1C ZINC000472582590 940948728 /nfs/dbraw/zinc/94/87/28/940948728.db2.gz XIDAKAVIDMKMCL-ZDUSSCGKSA-N 0 0 357.435 3.843 20 5 FHBDRN CCOc1cccc(CN(CCO)Cc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000452046627 940954150 /nfs/dbraw/zinc/95/41/50/940954150.db2.gz LHXCPFISYVQFBI-UHFFFAOYSA-N 0 0 364.829 3.641 20 5 FHBDRN Cc1cccnc1COC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000180314463 940959576 /nfs/dbraw/zinc/95/95/76/940959576.db2.gz SKIWYNNMXZVHJT-UHFFFAOYSA-N 0 0 355.375 3.779 20 5 FHBDRN O=C1NCCc2c(N[C@H]3CCC[C@H]3Cc3ccccc3[N+](=O)[O-])cccc21 ZINC000414322033 940968001 /nfs/dbraw/zinc/96/80/01/940968001.db2.gz RUSKZNYSZOYCNU-KSSFIOAISA-N 0 0 365.433 3.704 20 5 FHBDRN COc1cc(NC(=O)NCc2cccc([N+](=O)[O-])c2)ccc1OC(C)C ZINC000186271507 940969653 /nfs/dbraw/zinc/96/96/53/940969653.db2.gz IGCAOPOWHODETE-UHFFFAOYSA-N 0 0 359.382 3.712 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc3c(C)n[nH]c3c2)cc1SC ZINC000180330878 940973525 /nfs/dbraw/zinc/97/35/25/940973525.db2.gz JRGQYEPTDBSUJX-UHFFFAOYSA-N 0 0 372.406 3.762 20 5 FHBDRN CCNc1ccc(C(=O)OCc2nc(C)c3ccccc3n2)cc1[N+](=O)[O-] ZINC000892618405 940984710 /nfs/dbraw/zinc/98/47/10/940984710.db2.gz OMOJSBXERFDIOA-UHFFFAOYSA-N 0 0 366.377 3.635 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@H]1CC(=O)c1cccs1 ZINC000176215837 940999585 /nfs/dbraw/zinc/99/95/85/940999585.db2.gz NKHQBBNIVIGHIA-ZDUSSCGKSA-N 0 0 358.419 3.842 20 5 FHBDRN O=C(Cc1cccc([N+](=O)[O-])c1)Nc1cccc(-c2noc(C3CC3)n2)c1 ZINC000176195177 941001119 /nfs/dbraw/zinc/00/11/19/941001119.db2.gz KNTPZZYSCZAHGL-UHFFFAOYSA-N 0 0 364.361 3.703 20 5 FHBDRN COc1ccc(-c2nc(CN[C@@H](C)c3cccc([N+](=O)[O-])c3)no2)cc1 ZINC000180394165 941003779 /nfs/dbraw/zinc/00/37/79/941003779.db2.gz CEGAJJGEUOGWSJ-LBPRGKRZSA-N 0 0 354.366 3.504 20 5 FHBDRN C[C@H](NCc1cn(-c2ccc(Cl)cc2)nn1)c1cccc([N+](=O)[O-])c1 ZINC000180407074 941005904 /nfs/dbraw/zinc/00/59/04/941005904.db2.gz BNCKEVPEMIFNBR-LBPRGKRZSA-N 0 0 357.801 3.680 20 5 FHBDRN COc1ccccc1-c1nnc(CN[C@@H](C)c2cccc([N+](=O)[O-])c2)o1 ZINC000180422019 941010346 /nfs/dbraw/zinc/01/03/46/941010346.db2.gz LIGZIAYPGDYIPV-LBPRGKRZSA-N 0 0 354.366 3.504 20 5 FHBDRN C[C@@H](NCC(=O)Nc1nc(-c2ccco2)cs1)c1cccc([N+](=O)[O-])c1 ZINC000180433537 941014378 /nfs/dbraw/zinc/01/43/78/941014378.db2.gz YFLARMCGZIGUQZ-LLVKDONJSA-N 0 0 372.406 3.601 20 5 FHBDRN COCCCOc1cccc(NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)c1 ZINC000176288998 941018877 /nfs/dbraw/zinc/01/88/77/941018877.db2.gz SSUUUSZAUBFCOR-UHFFFAOYSA-N 0 0 364.785 3.916 20 5 FHBDRN CC(C)[C@@H](CNC(=O)CCCNc1ccc([N+](=O)[O-])cc1)c1cccnc1 ZINC000176335990 941020481 /nfs/dbraw/zinc/02/04/81/941020481.db2.gz BXTNGXVGXQVSBQ-LJQANCHMSA-N 0 0 370.453 3.738 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)[C@@H]1Cc2ccccc2O1 ZINC000180467408 941023828 /nfs/dbraw/zinc/02/38/28/941023828.db2.gz ONQBYDVYBUBAEZ-AWEZNQCLSA-N 0 0 352.268 3.556 20 5 FHBDRN CCOc1ccc(C(=O)N2c3ccc([N+](=O)[O-])cc3C[C@@H]2C)cc1OCC ZINC000511507639 941032992 /nfs/dbraw/zinc/03/29/92/941032992.db2.gz QHIJIBQPUAYWFU-ZDUSSCGKSA-N 0 0 370.405 3.984 20 5 FHBDRN C[C@H](C(=O)Nc1cc(C(F)(F)F)ccn1)c1ccc([N+](=O)[O-])cc1F ZINC000186700612 941045343 /nfs/dbraw/zinc/04/53/43/941045343.db2.gz DHQCMRCTNNXQED-QMMMGPOBSA-N 0 0 357.263 3.890 20 5 FHBDRN O=C1Nc2cc(Br)ccc2/C1=C\c1csc([N+](=O)[O-])c1 ZINC000180573506 941046181 /nfs/dbraw/zinc/04/61/81/941046181.db2.gz DHRLDDYZYGIEHH-XCVCLJGOSA-N 0 0 351.181 3.912 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2ccc(CN3CCO[C@@H]([C@@H]4CCCO4)C3)s2)cc1 ZINC000180560506 941048099 /nfs/dbraw/zinc/04/80/99/941048099.db2.gz PEBJPJWBMVFBRH-ZWKOTPCHSA-N 0 0 374.462 3.703 20 5 FHBDRN C[C@H](NC(=O)c1c(N)cccc1[N+](=O)[O-])c1cccc(C(F)(F)F)c1 ZINC000180598135 941049609 /nfs/dbraw/zinc/04/96/09/941049609.db2.gz MLJIAGJJSLHBKQ-VIFPVBQESA-N 0 0 353.300 3.687 20 5 FHBDRN CSc1cccc(C(=O)NCC2(c3ccccn3)CCC2)c1[N+](=O)[O-] ZINC000376460596 941053176 /nfs/dbraw/zinc/05/31/76/941053176.db2.gz KHFUYWGMCBSHOC-UHFFFAOYSA-N 0 0 357.435 3.563 20 5 FHBDRN CCc1ccc([C@H]2CCN(C(=O)COc3cccc([N+](=O)[O-])c3)C2)cc1 ZINC000580111087 941053911 /nfs/dbraw/zinc/05/39/11/941053911.db2.gz QTLWPAXUMGJRHM-KRWDZBQOSA-N 0 0 354.406 3.552 20 5 FHBDRN O=C(NCc1cccc([N+](=O)[O-])c1)NC[C@H](c1ccccc1)C(F)(F)F ZINC000186784504 941056138 /nfs/dbraw/zinc/05/61/38/941056138.db2.gz TZZMOZRBWARSBP-OAHLLOKOSA-N 0 0 367.327 3.740 20 5 FHBDRN CC(=O)c1cc(N2CCC(c3noc(C(F)F)n3)CC2)ccc1[N+](=O)[O-] ZINC000376466878 941058719 /nfs/dbraw/zinc/05/87/19/941058719.db2.gz KWTPPKQPROQVGI-UHFFFAOYSA-N 0 0 366.324 3.502 20 5 FHBDRN COc1cc(C(=O)Nc2cc(C)nn2-c2ccccc2C)ccc1[N+](=O)[O-] ZINC000102981354 941062391 /nfs/dbraw/zinc/06/23/91/941062391.db2.gz KTAHXWUJQZBOEK-UHFFFAOYSA-N 0 0 366.377 3.658 20 5 FHBDRN Cc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2C)n(-c2ccccc2C)n1 ZINC000102981381 941062438 /nfs/dbraw/zinc/06/24/38/941062438.db2.gz WRXCEALHGFOOIX-UHFFFAOYSA-N 0 0 350.378 3.958 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCc1cc(C)c(O)c(C)c1 ZINC000188733716 941063884 /nfs/dbraw/zinc/06/38/84/941063884.db2.gz SENMQCQUNZTYCX-SFHVURJKSA-N 0 0 370.449 3.845 20 5 FHBDRN CC(=O)c1cc(N2CCC[C@H](c3ncc4n3CCCC4)C2)ccc1[N+](=O)[O-] ZINC000376474982 941067003 /nfs/dbraw/zinc/06/70/03/941067003.db2.gz QIBIQEOTUKJFDP-HNNXBMFYSA-N 0 0 368.437 3.714 20 5 FHBDRN C[C@@H](NC(=O)NCc1ccc(OC(C)(C)C)nc1)c1cccc([N+](=O)[O-])c1 ZINC000180718524 941068436 /nfs/dbraw/zinc/06/84/36/941068436.db2.gz JYFXDOPFCLHJMB-CYBMUJFWSA-N 0 0 372.425 3.728 20 5 FHBDRN CCC(CC)[C@@H]1C[C@@H](NC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)CCO1 ZINC000180718612 941068447 /nfs/dbraw/zinc/06/84/47/941068447.db2.gz WNLJCHJOMSIBSV-OWQGQXMQSA-N 0 0 363.458 3.939 20 5 FHBDRN C[C@H](NC(=O)NCc1ccc(OC(C)(C)C)nc1)c1cccc([N+](=O)[O-])c1 ZINC000180718503 941068512 /nfs/dbraw/zinc/06/85/12/941068512.db2.gz JYFXDOPFCLHJMB-ZDUSSCGKSA-N 0 0 372.425 3.728 20 5 FHBDRN O=c1[nH]c(N2CC[C@@H](c3c(F)cccc3F)C2)nc2ccc([N+](=O)[O-])cc12 ZINC000376486534 941075559 /nfs/dbraw/zinc/07/55/59/941075559.db2.gz IHHOIIWKLIYFQR-SNVBAGLBSA-N 0 0 372.331 3.516 20 5 FHBDRN Cc1cnc([C@H](C)CNC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)s1 ZINC000187083613 941077760 /nfs/dbraw/zinc/07/77/60/941077760.db2.gz HMRSTFJXYCLDDO-LLVKDONJSA-N 0 0 362.455 3.698 20 5 FHBDRN CSc1ccc(C(=O)NC(C)(C)c2ncc(C)s2)cc1[N+](=O)[O-] ZINC000176868908 941081751 /nfs/dbraw/zinc/08/17/51/941081751.db2.gz WMFLPCSGAXMXJY-UHFFFAOYSA-N 0 0 351.453 3.747 20 5 FHBDRN C[C@@H]1CN(C(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)c2ccccc2O1 ZINC000541002957 941083108 /nfs/dbraw/zinc/08/31/08/941083108.db2.gz JFPUMVZLIWTJPA-SNVBAGLBSA-N 0 0 364.304 3.624 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)ccc1CN1CCC[C@H](c2nncn2C2CC2)C1 ZINC000180860642 941086049 /nfs/dbraw/zinc/08/60/49/941086049.db2.gz YUMBVHGDHMABRT-ZDUSSCGKSA-N 0 0 361.833 3.554 20 5 FHBDRN Cc1ncc([N+](=O)[O-])n1CC(=O)Nc1ccc(-c2ccccc2)c(C)c1 ZINC001267592885 941086953 /nfs/dbraw/zinc/08/69/53/941086953.db2.gz YNCDPKLHVLXOOV-UHFFFAOYSA-N 0 0 350.378 3.714 20 5 FHBDRN Cc1ccccc1C1(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2C)CC1 ZINC000843632011 941086988 /nfs/dbraw/zinc/08/69/88/941086988.db2.gz MCVUCCMMGCHWLP-UHFFFAOYSA-N 0 0 355.350 3.539 20 5 FHBDRN Cc1nn(C)c(C(=O)N2CCCCC[C@H]2/C=C/c2cccs2)c1[N+](=O)[O-] ZINC000180922766 941092443 /nfs/dbraw/zinc/09/24/43/941092443.db2.gz NBKUSGCDOVLQHA-HBWSCVEGSA-N 0 0 374.466 3.796 20 5 FHBDRN CCS[C@@H]1CCCC[C@H]1NC(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000511512472 941094092 /nfs/dbraw/zinc/09/40/92/941094092.db2.gz LBTVUELSEKZKKS-IAGOWNOFSA-N 0 0 365.499 3.843 20 5 FHBDRN Cc1cc(F)c(S(=O)(=O)Cc2c(Cl)cccc2[N+](=O)[O-])cc1F ZINC000549087077 941094435 /nfs/dbraw/zinc/09/44/35/941094435.db2.gz LMSYUBRZIDSGBV-UHFFFAOYSA-N 0 0 361.753 3.809 20 5 FHBDRN Cc1nc(CC2CC2)sc1C(=O)N1CCCc2ccc([N+](=O)[O-])cc21 ZINC000188808707 941095272 /nfs/dbraw/zinc/09/52/72/941095272.db2.gz DYNCFTUDNISUSM-UHFFFAOYSA-N 0 0 357.435 3.905 20 5 FHBDRN C[C@H]1C[C@H](C)CN(c2ccc(C(=O)N(C)Cc3ccco3)cc2[N+](=O)[O-])C1 ZINC000255945352 941096778 /nfs/dbraw/zinc/09/67/78/941096778.db2.gz DUFNWPXRNJAZCO-GJZGRUSLSA-N 0 0 371.437 3.942 20 5 FHBDRN Cc1nc(CN2CCC(CNc3nc(C)cc(C)c3[N+](=O)[O-])CC2)oc1C ZINC000541005685 941101371 /nfs/dbraw/zinc/10/13/71/941101371.db2.gz ZKVYCDHRFUAORE-UHFFFAOYSA-N 0 0 373.457 3.536 20 5 FHBDRN CN(C)c1cccc(CN[C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)n1 ZINC000181020729 941104027 /nfs/dbraw/zinc/10/40/27/941104027.db2.gz QFZKJXGDEBYOPM-NRFANRHFSA-N 0 0 362.433 3.935 20 5 FHBDRN COc1ccc([C@H](CCO)Nc2ccc([N+](=O)[O-])c(OC(F)F)c2)cc1 ZINC000181208415 941110900 /nfs/dbraw/zinc/11/09/00/941110900.db2.gz ITHRIQMLLBRNLR-AWEZNQCLSA-N 0 0 368.336 3.740 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1F)N1CCC[C@H](Oc2ccccc2)C1 ZINC000414409683 941111301 /nfs/dbraw/zinc/11/13/01/941111301.db2.gz NYYOEFCNDDJREL-HNNXBMFYSA-N 0 0 359.357 3.809 20 5 FHBDRN CC(C)[C@H]1N(C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC12CCOCC2 ZINC000414415408 941116793 /nfs/dbraw/zinc/11/67/93/941116793.db2.gz OPOHTNYESNGURW-OAHLLOKOSA-N 0 0 367.833 3.917 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])N[C@H](C1CCCC1)C(F)(F)F ZINC000177636057 941141531 /nfs/dbraw/zinc/14/15/31/941141531.db2.gz ZXTDSGXUUDAKCQ-OAHLLOKOSA-N 0 0 360.332 3.601 20 5 FHBDRN CCN1C(=O)c2ccc(Cl)cc2N[C@@H]1c1ccc([N+](=O)[O-])c(OC)c1 ZINC000092198485 941145414 /nfs/dbraw/zinc/14/54/14/941145414.db2.gz OOPVXCLRHJXOGB-INIZCTEOSA-N 0 0 361.785 3.843 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H](C)Oc2ncccc21 ZINC000189058469 941145925 /nfs/dbraw/zinc/14/59/25/941145925.db2.gz GJNXOBJAELSZLG-LLVKDONJSA-N 0 0 359.407 3.530 20 5 FHBDRN Cc1cnc([C@H](C)NC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)s1 ZINC000177918485 941153115 /nfs/dbraw/zinc/15/31/15/941153115.db2.gz BEKPRQSJRNXBGI-WDEREUQCSA-N 0 0 351.453 3.718 20 5 FHBDRN O=C(Cc1cnc2ccccc2c1)Nc1ccc([N+](=O)[O-])c2ncccc12 ZINC000189202141 941153978 /nfs/dbraw/zinc/15/39/78/941153978.db2.gz VDMPIJYTJAOZRV-UHFFFAOYSA-N 0 0 358.357 3.872 20 5 FHBDRN Cc1nn(CCC(=O)N[C@H]2CCc3ccc(C(C)C)cc32)c(C)c1[N+](=O)[O-] ZINC000189224229 941154992 /nfs/dbraw/zinc/15/49/92/941154992.db2.gz DKZRKCKBSKHEQN-SFHVURJKSA-N 0 0 370.453 3.725 20 5 FHBDRN CSc1ccc(C(=O)Nc2ccc3nnc(C(C)C)n3c2)cc1[N+](=O)[O-] ZINC000189240049 941155108 /nfs/dbraw/zinc/15/51/08/941155108.db2.gz DTCHYHINUKMTQE-UHFFFAOYSA-N 0 0 371.422 3.735 20 5 FHBDRN CC[C@@H](C)Oc1ccc(NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 ZINC000189292999 941155574 /nfs/dbraw/zinc/15/55/74/941155574.db2.gz MUDGXHCYYHBTSY-CYBMUJFWSA-N 0 0 371.393 3.658 20 5 FHBDRN CSc1cccc(C(=O)Nc2ccc3nnc(C(C)C)n3c2)c1[N+](=O)[O-] ZINC000189299106 941155792 /nfs/dbraw/zinc/15/57/92/941155792.db2.gz YLJLKQDIUNPZDS-UHFFFAOYSA-N 0 0 371.422 3.735 20 5 FHBDRN COc1ccc(F)cc1CNC(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000189306042 941155804 /nfs/dbraw/zinc/15/58/04/941155804.db2.gz WNKJFWQMBDUHAD-LLVKDONJSA-N 0 0 364.398 3.540 20 5 FHBDRN Cc1ccc(NC(=O)NC[C@@H]2CCO[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000189360660 941157511 /nfs/dbraw/zinc/15/75/11/941157511.db2.gz XBALYYRCFAJAQQ-YJBOKZPZSA-N 0 0 355.394 3.803 20 5 FHBDRN COC[C@H](Cc1ccccc1)N(C)C(=O)c1ccc(SC)c([N+](=O)[O-])c1 ZINC000189466497 941158527 /nfs/dbraw/zinc/15/85/27/941158527.db2.gz CHEFVRYIBUQGMD-INIZCTEOSA-N 0 0 374.462 3.646 20 5 FHBDRN COc1cc(C(=O)NCC[C@@H](C)CC(C)(C)C)c([N+](=O)[O-])cc1OC ZINC000189474706 941158664 /nfs/dbraw/zinc/15/86/64/941158664.db2.gz MKQRHFIWHRORFT-GFCCVEGCSA-N 0 0 352.431 3.804 20 5 FHBDRN CC(C)CCSc1ccc(C(=O)N2CC[C@H](C)[C@H]2CO)cc1[N+](=O)[O-] ZINC000189492460 941159132 /nfs/dbraw/zinc/15/91/32/941159132.db2.gz FFRXZFCTSXNTRQ-XJKSGUPXSA-N 0 0 366.483 3.576 20 5 FHBDRN COc1cc(C(=O)N2CCC[C@@H]2c2cccc(C)n2)cc([N+](=O)[O-])c1C ZINC000189502312 941159360 /nfs/dbraw/zinc/15/93/60/941159360.db2.gz AAUWRMSCRDEZEN-MRXNPFEDSA-N 0 0 355.394 3.593 20 5 FHBDRN COC(=O)CC1(CC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)CCCC1 ZINC000189573721 941161388 /nfs/dbraw/zinc/16/13/88/941161388.db2.gz WQACATAIBKBVOA-UHFFFAOYSA-N 0 0 374.437 3.599 20 5 FHBDRN CCN(Cc1c[nH]c2ccccc12)C(=O)c1cc(OC)ccc1[N+](=O)[O-] ZINC000189578087 941162201 /nfs/dbraw/zinc/16/22/01/941162201.db2.gz ZFZKCKPXFVOROX-UHFFFAOYSA-N 0 0 353.378 3.747 20 5 FHBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)N1C[C@@H]2CCCC[C@@H]2C1 ZINC000178311262 941222803 /nfs/dbraw/zinc/22/28/03/941222803.db2.gz QDXXOPDIRSXQOF-CALCHBBNSA-N 0 0 360.457 3.803 20 5 FHBDRN COCc1cc([N+](=O)[O-])ccc1NC[C@@](C)(Cc1ccccc1)[C@H](C)O ZINC000189648519 941240379 /nfs/dbraw/zinc/24/03/79/941240379.db2.gz YCJYPFKSNYQRJO-MGPUTAFESA-N 0 0 358.438 3.783 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@]2(C[C@@H]3CC[C@H]2C3)OC(C)(C)C1 ZINC000407976026 941254600 /nfs/dbraw/zinc/25/46/00/941254600.db2.gz YRQYAHJUDVQMSQ-SIFCLUCFSA-N 0 0 358.438 3.713 20 5 FHBDRN C[C@@H](C1CC1)n1cc(NC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)cn1 ZINC000189710948 941264478 /nfs/dbraw/zinc/26/44/78/941264478.db2.gz VRGVWZXVKKROMR-ZDUSSCGKSA-N 0 0 369.425 3.959 20 5 FHBDRN C[C@H](NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)c1ccc(Cl)cn1 ZINC000189741558 941271499 /nfs/dbraw/zinc/27/14/99/941271499.db2.gz MEGOEJIVFWFIJI-JTQLQIEISA-N 0 0 360.801 3.709 20 5 FHBDRN Cc1ccc(C)c(S(=O)(=O)N(C)[C@@H]2CCc3ccccc32)c1[N+](=O)[O-] ZINC000189820397 941283914 /nfs/dbraw/zinc/28/39/14/941283914.db2.gz XDJSDBGVFRABOI-MRXNPFEDSA-N 0 0 360.435 3.520 20 5 FHBDRN O=c1ccc(-c2cccc([N+](=O)[O-])c2)nn1Cc1ccc(Cl)c(F)c1 ZINC000189840433 941287475 /nfs/dbraw/zinc/28/74/75/941287475.db2.gz ODJNLNCKUZJZJL-UHFFFAOYSA-N 0 0 359.744 3.659 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H](C)Oc2c(Cl)cccc21 ZINC000189853802 941290633 /nfs/dbraw/zinc/29/06/33/941290633.db2.gz UNUFUCUODKRGPF-SNVBAGLBSA-N 0 0 362.769 3.685 20 5 FHBDRN O=C(c1c(Cl)cccc1[N+](=O)[O-])N1CC2(CCOCC2)c2ccccc21 ZINC000189863125 941290685 /nfs/dbraw/zinc/29/06/85/941290685.db2.gz QLBUCJAICBOSJD-UHFFFAOYSA-N 0 0 372.808 3.957 20 5 FHBDRN O=[N+]([O-])c1ccc(Cl)cc1S(=O)(=O)Nc1c(F)cccc1Cl ZINC000782931980 941296350 /nfs/dbraw/zinc/29/63/50/941296350.db2.gz MGPDRLSTQZLAET-UHFFFAOYSA-N 0 0 365.169 3.842 20 5 FHBDRN C[C@H](CNC(=O)c1c(N)cccc1[N+](=O)[O-])c1ccc(C(F)(F)F)cc1 ZINC000189919923 941303345 /nfs/dbraw/zinc/30/33/45/941303345.db2.gz PMMAMLPRGKUTDT-SNVBAGLBSA-N 0 0 367.327 3.729 20 5 FHBDRN C[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1)c1nc(-c2ccc(Cl)cc2)no1 ZINC000103248055 941309529 /nfs/dbraw/zinc/30/95/29/941309529.db2.gz RWXSSQZNGSZNGY-SNVBAGLBSA-N 0 0 372.768 3.789 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)NCc1ccc(C(C)(F)F)cc1 ZINC000490237404 941313881 /nfs/dbraw/zinc/31/38/81/941313881.db2.gz CFNWVCLYIXAOAA-UHFFFAOYSA-N 0 0 350.321 3.645 20 5 FHBDRN COC(=O)C[C@](C)(NCc1ccc(C(C)C)c([N+](=O)[O-])c1)c1ccncc1 ZINC000190020863 941346542 /nfs/dbraw/zinc/34/65/42/941346542.db2.gz LIVWPYCXOWBKNR-FQEVSTJZSA-N 0 0 371.437 3.681 20 5 FHBDRN O=C(N[C@H]1CCc2c1cccc2O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000122270256 941362254 /nfs/dbraw/zinc/36/22/54/941362254.db2.gz DCBKJWAPDITSPP-SFHVURJKSA-N 0 0 367.405 3.662 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[C@@H](c2ccccc2)[C@@H](CO)C1 ZINC000376631751 941374214 /nfs/dbraw/zinc/37/42/14/941374214.db2.gz XEIJDLGRNRFQFU-AEFFLSMTSA-N 0 0 369.421 3.533 20 5 FHBDRN CCS[C@@H]1CC[C@@H](N(C)S(=O)(=O)c2c(C)ccc(C)c2[N+](=O)[O-])C1 ZINC000190031258 941379138 /nfs/dbraw/zinc/37/91/38/941379138.db2.gz OAXOMDDZBKUKQX-ZIAGYGMSSA-N 0 0 372.512 3.506 20 5 FHBDRN O=C(NCCCc1c[nH]c2ccccc12)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412051020 941413682 /nfs/dbraw/zinc/41/36/82/941413682.db2.gz ARRZMPYTBVBYQW-RBUKOAKNSA-N 0 0 363.417 3.929 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC(c2cccc(N)c2)CC1 ZINC000414668748 941432432 /nfs/dbraw/zinc/43/24/32/941432432.db2.gz ZFRPASBMYYHXEA-UHFFFAOYSA-N 0 0 354.410 3.897 20 5 FHBDRN CCOc1ccc(NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])cc1OC ZINC000007975655 941444518 /nfs/dbraw/zinc/44/45/18/941444518.db2.gz HQDIAUJYVQCJBF-UHFFFAOYSA-N 0 0 350.758 3.908 20 5 FHBDRN Cc1cc(N[C@@H](CO)c2ccsc2)c(Br)cc1[N+](=O)[O-] ZINC000302652788 941457008 /nfs/dbraw/zinc/45/70/08/941457008.db2.gz GVHMMLJXSIXNDN-LBPRGKRZSA-N 0 0 357.229 3.873 20 5 FHBDRN Cc1noc(C2CCN(c3cc(C)c(C(F)(F)F)cc3[N+](=O)[O-])CC2)n1 ZINC000549127979 941484682 /nfs/dbraw/zinc/48/46/82/941484682.db2.gz HWIXVXBYLYKEON-UHFFFAOYSA-N 0 0 370.331 3.997 20 5 FHBDRN CN(C)c1cc(C(=O)Nc2ccc([N+](=O)[O-])cc2F)c2ccccc2n1 ZINC000564293462 941502444 /nfs/dbraw/zinc/50/24/44/941502444.db2.gz MEQXXCUEJIQCTK-UHFFFAOYSA-N 0 0 354.341 3.600 20 5 FHBDRN COc1c(O)ccc(CNCc2ccccc2C(F)(F)F)c1[N+](=O)[O-] ZINC000892740695 941505851 /nfs/dbraw/zinc/50/58/51/941505851.db2.gz LMHWZUMTMDKWEI-UHFFFAOYSA-N 0 0 356.300 3.618 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N[C@H](C)c2cc(C)cc(C)c2)c1F ZINC000412053997 941559311 /nfs/dbraw/zinc/55/93/11/941559311.db2.gz HCPARAZEJMSVCI-CYBMUJFWSA-N 0 0 360.385 3.779 20 5 FHBDRN CC[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)CCO1 ZINC000051083355 941559700 /nfs/dbraw/zinc/55/97/00/941559700.db2.gz APQCVOVMUMRKQK-HNNXBMFYSA-N 0 0 356.378 3.638 20 5 FHBDRN CC1=C(c2ccco2)CN([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)CC1 ZINC000549162248 941560570 /nfs/dbraw/zinc/56/05/70/941560570.db2.gz OLVRYFFSJVFEOY-AWEZNQCLSA-N 0 0 355.394 3.694 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N(C)CCCC(=O)OC(C)(C)C)c1 ZINC000066777401 941588859 /nfs/dbraw/zinc/58/88/59/941588859.db2.gz XRNJZCMOCJXHSY-UHFFFAOYSA-N 0 0 368.455 3.511 20 5 FHBDRN O=C(N1CCC[C@@H]1c1nccs1)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000377260873 941600504 /nfs/dbraw/zinc/60/05/04/941600504.db2.gz ZUPSYDVEPJRCJL-GFCCVEGCSA-N 0 0 353.350 3.507 20 5 FHBDRN CCCO[C@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)CC1 ZINC000412061556 941617632 /nfs/dbraw/zinc/61/76/32/941617632.db2.gz AWRXYHPVQBBUHN-INIZCTEOSA-N 0 0 364.442 3.803 20 5 FHBDRN Cc1c(C(=O)Nc2ccc(F)c(Cl)c2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000005678273 941630188 /nfs/dbraw/zinc/63/01/88/941630188.db2.gz BHOMKPZZOYMYRI-UHFFFAOYSA-N 0 0 353.693 3.856 20 5 FHBDRN Cn1cc([N+](=O)[O-])cc1C(=O)Nc1nc(-c2cc(F)ccc2F)cs1 ZINC000024476567 941689989 /nfs/dbraw/zinc/68/99/89/941689989.db2.gz PTVKZBYCKUAILA-UHFFFAOYSA-N 0 0 364.333 3.587 20 5 FHBDRN Cc1ccsc1C(=O)Nc1ccc(OC(=O)c2cc([N+](=O)[O-])c[nH]2)cc1 ZINC000729214474 941695518 /nfs/dbraw/zinc/69/55/18/941695518.db2.gz QMXRLBREDQZTJZ-UHFFFAOYSA-N 0 0 371.374 3.764 20 5 FHBDRN O=[N+]([O-])c1cccc(OS(=O)(=O)Cc2c(Cl)cccc2Cl)c1 ZINC000729267493 941705154 /nfs/dbraw/zinc/70/51/54/941705154.db2.gz LPQDRJZEIOZBJX-UHFFFAOYSA-N 0 0 362.190 3.810 20 5 FHBDRN O=C(C1CCCCC1)N1CCC[C@@H]1c1nc(-c2ccccc2[N+](=O)[O-])no1 ZINC000377423076 941709969 /nfs/dbraw/zinc/70/99/69/941709969.db2.gz HVYDTLRJNSPYRQ-MRXNPFEDSA-N 0 0 370.409 3.889 20 5 FHBDRN O=C(C1CCCCC1)N1CCC[C@H]1c1nc(-c2ccccc2[N+](=O)[O-])no1 ZINC000377423075 941710080 /nfs/dbraw/zinc/71/00/80/941710080.db2.gz HVYDTLRJNSPYRQ-INIZCTEOSA-N 0 0 370.409 3.889 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)N[C@H](C(C)(C)C)C(F)(F)F ZINC000549240722 941711529 /nfs/dbraw/zinc/71/15/29/941711529.db2.gz IRRZNPLJMXJVRR-CYBMUJFWSA-N 0 0 361.364 3.756 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)Nc1cnc2c(c1)CCCC2 ZINC000541143783 941712024 /nfs/dbraw/zinc/71/20/24/941712024.db2.gz LUMMVJCIRFHBGO-UHFFFAOYSA-N 0 0 354.410 3.699 20 5 FHBDRN Cc1csc(Nc2cccc(NC(=O)c3ccc([N+](=O)[O-])n3C)c2)n1 ZINC000729334867 941721243 /nfs/dbraw/zinc/72/12/43/941721243.db2.gz PBLSUAGAEIUQLS-UHFFFAOYSA-N 0 0 357.395 3.694 20 5 FHBDRN O=C(Nc1nccs1)C1CCN(c2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000377440042 941724741 /nfs/dbraw/zinc/72/47/41/941724741.db2.gz UTPZOTCZCCJPQX-UHFFFAOYSA-N 0 0 366.830 3.560 20 5 FHBDRN C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2Cl)c2ccccc2N(C)C1=O ZINC000365568681 941726851 /nfs/dbraw/zinc/72/68/51/941726851.db2.gz SMBOVLOHWJQDSV-LLVKDONJSA-N 0 0 373.796 3.508 20 5 FHBDRN CSc1cccc(C(=O)N2CC(Cc3ccccc3C)C2)c1[N+](=O)[O-] ZINC000614445779 941735356 /nfs/dbraw/zinc/73/53/56/941735356.db2.gz YGEWDXNZHGRQLF-UHFFFAOYSA-N 0 0 356.447 3.940 20 5 FHBDRN O=[N+]([O-])c1ccc(Cc2noc([C@H]3CC[C@@H](c4ccccc4)O3)n2)nc1 ZINC000377455983 941736689 /nfs/dbraw/zinc/73/66/89/941736689.db2.gz GWTLCGYGCGZBOQ-JKSUJKDBSA-N 0 0 352.350 3.556 20 5 FHBDRN CC(C)N(Cc1ccccc1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000047542881 941754826 /nfs/dbraw/zinc/75/48/26/941754826.db2.gz ORIUJUKRZOXLBS-UHFFFAOYSA-N 0 0 368.842 3.848 20 5 FHBDRN COC(=O)c1cccc(NC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)c1C ZINC000047539677 941755421 /nfs/dbraw/zinc/75/54/21/941755421.db2.gz DHPUBVHNCXIMJG-GFCCVEGCSA-N 0 0 357.366 3.573 20 5 FHBDRN COc1ccc(NC(=O)NCC2CC(c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000549255876 941767277 /nfs/dbraw/zinc/76/72/77/941767277.db2.gz XXCUJHUZZKGLTI-UHFFFAOYSA-N 0 0 355.394 3.919 20 5 FHBDRN CCOc1cccc(CCNC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000433566058 941772200 /nfs/dbraw/zinc/77/22/00/941772200.db2.gz RBESTNYEFHRSAQ-UHFFFAOYSA-N 0 0 356.422 3.630 20 5 FHBDRN CCc1cc(=O)c2cc(NC(=O)c3ccc([N+](=O)[O-])c(Cl)c3)ccc2[nH]1 ZINC000122524951 941788324 /nfs/dbraw/zinc/78/83/24/941788324.db2.gz PHPXBKYJTDCDHX-UHFFFAOYSA-N 0 0 371.780 3.904 20 5 FHBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NC[C@@H]1C[C@H]1c1ccccc1 ZINC000509921854 941805939 /nfs/dbraw/zinc/80/59/39/941805939.db2.gz BCAZEJRXOZMNFC-NOLJZWGESA-N 0 0 374.824 3.935 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)Nc1cnn(C)c1Cl ZINC000892959149 941806536 /nfs/dbraw/zinc/80/65/36/941806536.db2.gz BKSGTGBOYCJUFW-UHFFFAOYSA-N 0 0 354.819 3.735 20 5 FHBDRN O=C(NCCc1c[nH]c2ccc(F)cc12)c1c(Cl)cccc1[N+](=O)[O-] ZINC000137125185 941807563 /nfs/dbraw/zinc/80/75/63/941807563.db2.gz XGZNUVKPKSSFDY-UHFFFAOYSA-N 0 0 361.760 3.841 20 5 FHBDRN CN(C(=O)COc1cc(F)cc([N+](=O)[O-])c1)[C@H]1CCCc2ccccc21 ZINC000433627693 941810394 /nfs/dbraw/zinc/81/03/94/941810394.db2.gz CSZHCBGWRDGDJF-SFHVURJKSA-N 0 0 358.369 3.649 20 5 FHBDRN Cn1cnc([N+](=O)[O-])c1CN(Cc1c(Cl)cccc1Cl)C1CC1 ZINC000513257286 941821566 /nfs/dbraw/zinc/82/15/66/941821566.db2.gz QLCGSPUFLDNRCE-UHFFFAOYSA-N 0 0 355.225 3.800 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N[C@@H](c2ccccc2C)C2CC2)c1F ZINC000412131637 941824762 /nfs/dbraw/zinc/82/47/62/941824762.db2.gz WHYQWIZZVDKQKX-HXUWFJFHSA-N 0 0 372.396 3.861 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N(C)[C@@H](C)c2ccccc2Cl)c1[N+](=O)[O-] ZINC000433669810 941827773 /nfs/dbraw/zinc/82/77/73/941827773.db2.gz MSTCPYCUDGDJHV-JTQLQIEISA-N 0 0 350.806 3.928 20 5 FHBDRN O=C(COc1ccccc1[N+](=O)[O-])Nc1cc(-c2ccccc2)ns1 ZINC000118617240 941832049 /nfs/dbraw/zinc/83/20/49/941832049.db2.gz LFDPZPZNVLWBDD-UHFFFAOYSA-N 0 0 355.375 3.736 20 5 FHBDRN Cc1ccc(NCCCNC(=O)[C@H]2CC[C@H](C(F)(F)F)C2)c([N+](=O)[O-])c1 ZINC000513312236 941840160 /nfs/dbraw/zinc/84/01/60/941840160.db2.gz MQUOIKMPRCHQOY-STQMWFEESA-N 0 0 373.375 3.800 20 5 FHBDRN O=C(NC[C@H]1CCO[C@@H]1c1ccccc1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412142604 941840931 /nfs/dbraw/zinc/84/09/31/941840931.db2.gz YEWQZNIBTJTHRJ-GSEOLPGOSA-N 0 0 366.417 3.592 20 5 FHBDRN Cc1oc(-c2cccs2)nc1CC(=O)Nc1ccc(F)c([N+](=O)[O-])c1 ZINC000024502945 941841984 /nfs/dbraw/zinc/84/19/84/941841984.db2.gz WQBZBXXEGMUXMH-UHFFFAOYSA-N 0 0 361.354 3.940 20 5 FHBDRN CC[C@@H](NC(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1)c1c(C)nn(C)c1C ZINC000412150095 941845829 /nfs/dbraw/zinc/84/58/29/941845829.db2.gz RJZFLSZSOQKKAM-OAHLLOKOSA-N 0 0 374.441 3.613 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CCS[C@H](C(C)C)C2)ccc1[N+](=O)[O-] ZINC000412150076 941845917 /nfs/dbraw/zinc/84/59/17/941845917.db2.gz KGWDJHQGPNPLPJ-INIZCTEOSA-N 0 0 352.456 3.596 20 5 FHBDRN CCn1cc([C@H]2CN(c3c(Cl)cc(Cl)cc3[N+](=O)[O-])CCO2)cn1 ZINC000583950035 941848036 /nfs/dbraw/zinc/84/80/36/941848036.db2.gz IMMCHWXEAIOCMV-CQSZACIVSA-N 0 0 371.224 3.696 20 5 FHBDRN C[C@H](NC(=O)NC[C@@H]1CCO[C@H]1c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000190080510 941849327 /nfs/dbraw/zinc/84/93/27/941849327.db2.gz VOAJAINQTSZYKB-FNHZYXHNSA-N 0 0 369.421 3.733 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CN(Cc1ccnc(OC(C)C)c1)C1CC1 ZINC000513319120 941852273 /nfs/dbraw/zinc/85/22/73/941852273.db2.gz LLZCJYPQQJJIEY-UHFFFAOYSA-N 0 0 371.437 3.950 20 5 FHBDRN C[C@@H](CNC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)Sc1ccccc1 ZINC000412153379 941852759 /nfs/dbraw/zinc/85/27/59/941852759.db2.gz WPMGJOYODHIBDK-DOPJRALCSA-N 0 0 356.447 3.995 20 5 FHBDRN O=C1[C@@H](Nc2ccccc2C(F)(F)F)CCN1c1cccc([N+](=O)[O-])c1 ZINC000433726805 941857774 /nfs/dbraw/zinc/85/77/74/941857774.db2.gz KKGDXYIIPIQRCE-HNNXBMFYSA-N 0 0 365.311 3.831 20 5 FHBDRN CC(C)Oc1cc(C(=O)N(C)[C@@H](C)Cc2ccc(O)cc2)ccc1[N+](=O)[O-] ZINC000412176858 941864684 /nfs/dbraw/zinc/86/46/84/941864684.db2.gz ABZKHIAIZRLLNI-AWEZNQCLSA-N 0 0 372.421 3.791 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2nc3ccc(F)cc3n2CC)c1 ZINC000549295110 941866360 /nfs/dbraw/zinc/86/63/60/941866360.db2.gz YBNRHHVNLQCDLW-UHFFFAOYSA-N 0 0 372.356 3.755 20 5 FHBDRN CCN(C(=O)c1ccc(Sc2ccc(C)cc2)c([N+](=O)[O-])c1)[C@@H](C)CO ZINC000513345574 941866574 /nfs/dbraw/zinc/86/65/74/941866574.db2.gz LFYMQQDHICNPJT-AWEZNQCLSA-N 0 0 374.462 3.897 20 5 FHBDRN CCCN(CCc1cccc(F)c1)C(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-] ZINC000433748780 941872732 /nfs/dbraw/zinc/87/27/32/941872732.db2.gz MKZLAFMDPDUTLN-UHFFFAOYSA-N 0 0 362.405 3.675 20 5 FHBDRN COC(=O)c1cc(NC(=O)Cc2cccc(C3CC3)c2)c(C)c([N+](=O)[O-])c1 ZINC000415518099 941873291 /nfs/dbraw/zinc/87/32/91/941873291.db2.gz LOLYFTDQJMFJPQ-UHFFFAOYSA-N 0 0 368.389 3.748 20 5 FHBDRN COC(=O)c1cc(NC(=O)[C@H]2C[C@]2(F)c2ccccc2)c(C)c([N+](=O)[O-])c1 ZINC000415519451 941873958 /nfs/dbraw/zinc/87/39/58/941873958.db2.gz PASLGPMTSNWDRT-KUHUBIRLSA-N 0 0 372.352 3.513 20 5 FHBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[C@@H](OC)C1 ZINC000472826049 941876992 /nfs/dbraw/zinc/87/69/92/941876992.db2.gz BBXAOWBQHUMZKS-TZMCWYRMSA-N 0 0 352.456 3.784 20 5 FHBDRN C[C@]1(CNC(=O)c2ccc(Cl)cc2[N+](=O)[O-])OCCc2sccc21 ZINC000290315721 941880748 /nfs/dbraw/zinc/88/07/48/941880748.db2.gz HRAPOZNXFDHLBO-MRXNPFEDSA-N 0 0 366.826 3.528 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)CCc2ccc(OC)cc2)c1 ZINC000549299003 941882860 /nfs/dbraw/zinc/88/28/60/941882860.db2.gz GMIZXAVVEJLCAM-CQSZACIVSA-N 0 0 372.421 3.753 20 5 FHBDRN O=[N+]([O-])c1cc(Br)cnc1SCc1ccc2c(c1)OCO2 ZINC000480790200 941896821 /nfs/dbraw/zinc/89/68/21/941896821.db2.gz XSATVTVPSDDKDC-UHFFFAOYSA-N 0 0 369.196 3.773 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CCOC2(C1)CCCCCC2 ZINC000412194409 941897426 /nfs/dbraw/zinc/89/74/26/941897426.db2.gz OIQWNBNYHHAVAI-ZWKOTPCHSA-N 0 0 358.438 3.650 20 5 FHBDRN CN(C)c1nc2cc(NC(=O)[C@@H]3C[C@H]3c3ccc([N+](=O)[O-])cc3)ccc2o1 ZINC000412197480 941898584 /nfs/dbraw/zinc/89/85/84/941898584.db2.gz SRMUVFZDFKONAP-LSDHHAIUSA-N 0 0 366.377 3.544 20 5 FHBDRN COc1ccc(NC(=O)[C@@H](C)Oc2ccc(SC)cc2)c([N+](=O)[O-])c1 ZINC000513406177 941900408 /nfs/dbraw/zinc/90/04/08/941900408.db2.gz NUSAAOZRFHNGIE-LLVKDONJSA-N 0 0 362.407 3.731 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N(CCc2ccc(F)cc2)C2CC2)c1 ZINC000549306862 941902140 /nfs/dbraw/zinc/90/21/40/941902140.db2.gz PZSMWTZFTXEQPQ-UHFFFAOYSA-N 0 0 372.396 3.980 20 5 FHBDRN COC(=O)c1cc(NC(=O)c2cc(SC)ccc2[N+](=O)[O-])c(C)cc1C ZINC000472834013 941904769 /nfs/dbraw/zinc/90/47/69/941904769.db2.gz DQZWKETXKOGEMR-UHFFFAOYSA-N 0 0 374.418 3.972 20 5 FHBDRN Cc1cccc(NC2CCN(C(=O)Nc3cccc([N+](=O)[O-])c3C)CC2)n1 ZINC000377713482 941919530 /nfs/dbraw/zinc/91/95/30/941919530.db2.gz XSCZZEGCZFMABK-UHFFFAOYSA-N 0 0 369.425 3.715 20 5 FHBDRN CC(C)Oc1cc(C(=O)N[C@@H](c2cccnc2)C2CC2)ccc1[N+](=O)[O-] ZINC000412215555 941924129 /nfs/dbraw/zinc/92/41/29/941924129.db2.gz IDJBIUHWWCSXED-GOSISDBHSA-N 0 0 355.394 3.658 20 5 FHBDRN O=C(N[C@H]1CCO[C@@H]1c1ccc(Cl)cc1)c1ccc(F)cc1[N+](=O)[O-] ZINC000182452926 941926155 /nfs/dbraw/zinc/92/61/55/941926155.db2.gz QYZLEDYKKRQNQZ-GOEBONIOSA-N 0 0 364.760 3.647 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1OC(F)F)N1CCC[C@H]2CCCC[C@@H]21 ZINC000182491591 941934348 /nfs/dbraw/zinc/93/43/48/941934348.db2.gz HNLPTRLVUXZPSM-RISCZKNCSA-N 0 0 354.353 3.991 20 5 FHBDRN CC(C)Oc1cc(C(=O)N(CC(F)F)CC2CCC2)ccc1[N+](=O)[O-] ZINC000412221264 941937899 /nfs/dbraw/zinc/93/78/99/941937899.db2.gz QOXNNJVHGGHZPO-UHFFFAOYSA-N 0 0 356.369 3.889 20 5 FHBDRN CC(C)Oc1cc(C(=O)N[C@H]2CCO[C@H](C(C)(C)C)C2)ccc1[N+](=O)[O-] ZINC000412230110 941942487 /nfs/dbraw/zinc/94/24/87/941942487.db2.gz KRFUNZOKKQYXKW-YOEHRIQHSA-N 0 0 364.442 3.706 20 5 FHBDRN CC(C)c1[nH]nc(C(=O)Nc2ccc(Br)cc2F)c1[N+](=O)[O-] ZINC000433855925 941942800 /nfs/dbraw/zinc/94/28/00/941942800.db2.gz WKAHBULRKMQBLT-UHFFFAOYSA-N 0 0 371.166 3.595 20 5 FHBDRN COc1ccc([C@H](NC(=O)c2ccc([N+](=O)[O-])s2)C(F)(F)F)cc1 ZINC000182603687 941946888 /nfs/dbraw/zinc/94/68/88/941946888.db2.gz ITIKSNOHDGKZGX-LBPRGKRZSA-N 0 0 360.313 3.698 20 5 FHBDRN O=C(Nc1ccccc1-n1cccn1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000182616360 941947774 /nfs/dbraw/zinc/94/77/74/941947774.db2.gz YPVTUQNGLJHPLX-UHFFFAOYSA-N 0 0 374.303 3.634 20 5 FHBDRN COc1ccccc1[C@@H]1C[C@H]1C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000412238903 941950383 /nfs/dbraw/zinc/95/03/83/941950383.db2.gz FMXWQFAPKSMIAE-JKSUJKDBSA-N 0 0 374.824 3.719 20 5 FHBDRN Cc1nc(-c2ccc(NC(=O)c3ccccc3[N+](=O)[O-])cc2Cl)n[nH]1 ZINC000182687898 941952775 /nfs/dbraw/zinc/95/27/75/941952775.db2.gz PGVUJYOIUYZQEH-UHFFFAOYSA-N 0 0 357.757 3.594 20 5 FHBDRN O=C1Nc2ccccc2[C@H]1C1CCN(c2ncc([N+](=O)[O-])cc2Cl)CC1 ZINC000377743082 941953285 /nfs/dbraw/zinc/95/32/85/941953285.db2.gz KVKXJFXHJLWQFX-MRXNPFEDSA-N 0 0 372.812 3.596 20 5 FHBDRN Cc1c(C(=O)Nc2ccc(NC[C@@H]3CCCO3)c(F)c2)cccc1[N+](=O)[O-] ZINC000129347582 941953739 /nfs/dbraw/zinc/95/37/39/941953739.db2.gz AGEPVNIYIAGJDU-AWEZNQCLSA-N 0 0 373.384 3.886 20 5 FHBDRN CCC[C@@H]1C[C@@H](C(=O)Nc2cc(C)nn2-c2ccc([N+](=O)[O-])cc2)CCO1 ZINC000182773925 941959476 /nfs/dbraw/zinc/95/94/76/941959476.db2.gz IVCBMERWXGBDCS-WMLDXEAASA-N 0 0 372.425 3.623 20 5 FHBDRN CCOC1(CNC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)CCCC1 ZINC000458841455 941973847 /nfs/dbraw/zinc/97/38/47/941973847.db2.gz BWSTZZIYYMNJNN-UHFFFAOYSA-N 0 0 361.442 3.618 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H](C)C[C@@H]2c2cccnc2)c1 ZINC000182838949 941978560 /nfs/dbraw/zinc/97/85/60/941978560.db2.gz QXWDNYPAQIDPMD-YVEFUNNKSA-N 0 0 357.435 3.935 20 5 FHBDRN COc1ccc(-c2noc([C@@H](C)Sc3ncccc3[N+](=O)[O-])n2)cc1 ZINC000129346831 941979670 /nfs/dbraw/zinc/97/96/70/941979670.db2.gz DAEQBTIZFAOAJJ-SNVBAGLBSA-N 0 0 358.379 3.902 20 5 FHBDRN O=C(Nc1ccncc1F)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000122645723 941994967 /nfs/dbraw/zinc/99/49/67/941994967.db2.gz FXKNBARXLSAKAE-UHFFFAOYSA-N 0 0 366.352 3.993 20 5 FHBDRN CCNc1ccc(C(=O)Nc2cncc(Cl)c2Cl)cc1[N+](=O)[O-] ZINC000480808334 942010876 /nfs/dbraw/zinc/01/08/76/942010876.db2.gz XPLJLBKLMIIQKA-UHFFFAOYSA-N 0 0 355.181 3.981 20 5 FHBDRN Cc1cc(C(=O)Nc2ccc(-c3n[nH]c(C4CC4)n3)cc2)cc([N+](=O)[O-])c1 ZINC000101842685 942014905 /nfs/dbraw/zinc/01/49/05/942014905.db2.gz GKOKMHRLZJPXNE-UHFFFAOYSA-N 0 0 363.377 3.818 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1Cl)N[C@@H]1C[C@H](CO)c2ccccc21 ZINC000377820827 942018558 /nfs/dbraw/zinc/01/85/58/942018558.db2.gz IIIXPODTIZYWPU-QMTHXVAHSA-N 0 0 361.785 3.591 20 5 FHBDRN CCOC(=O)c1ccnc(N[C@@H]2CCO[C@@H](C(CC)CC)C2)c1[N+](=O)[O-] ZINC000182969753 942032076 /nfs/dbraw/zinc/03/20/76/942032076.db2.gz PDHYNYCDYADTES-UKRRQHHQSA-N 0 0 365.430 3.562 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N(CC[NH+](C)C)Cc1ccccc1 ZINC000085619962 942034723 /nfs/dbraw/zinc/03/47/23/942034723.db2.gz MGSZBHGTGNRFDP-UHFFFAOYSA-N 0 0 370.453 3.807 20 5 FHBDRN C[C@@H]1CCc2nc(NC(=O)N(C)CCc3ccccc3[N+](=O)[O-])sc2C1 ZINC000513606634 942045257 /nfs/dbraw/zinc/04/52/57/942045257.db2.gz SAXZPIBELPFEKL-GFCCVEGCSA-N 0 0 374.466 3.883 20 5 FHBDRN COc1ccccc1[C@@H](CC(C)C)NC(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-] ZINC000434028697 942046051 /nfs/dbraw/zinc/04/60/51/942046051.db2.gz WTKGWFDGGVQMIW-CQSZACIVSA-N 0 0 374.441 3.967 20 5 FHBDRN Cc1ccc(-c2nc(CCNC(=O)c3cc(C)cc([N+](=O)[O-])c3)co2)cc1 ZINC000102358522 942050318 /nfs/dbraw/zinc/05/03/18/942050318.db2.gz PNLDYKTYGUOVRC-UHFFFAOYSA-N 0 0 365.389 3.839 20 5 FHBDRN C[C@H](c1cccc([N+](=O)[O-])c1)N1CCN(C(=O)c2ccc(Cl)cc2)CC1 ZINC000025604303 942051926 /nfs/dbraw/zinc/05/19/26/942051926.db2.gz WHCWBNSDKLSVRZ-CQSZACIVSA-N 0 0 373.840 3.767 20 5 FHBDRN Cc1cccc(CCN[C@@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)c1 ZINC000513654027 942057554 /nfs/dbraw/zinc/05/75/54/942057554.db2.gz GVRKVEXBTFNQIW-LJQANCHMSA-N 0 0 350.422 3.558 20 5 FHBDRN CC(C)(CNC(=O)CSc1ccccc1[N+](=O)[O-])Oc1ccccc1 ZINC000513654948 942057942 /nfs/dbraw/zinc/05/79/42/942057942.db2.gz YKDACTFFPWITRF-UHFFFAOYSA-N 0 0 360.435 3.661 20 5 FHBDRN Cc1cnc(C2CCN(C(=O)[C@@H]3C[C@H]3c3ccc([N+](=O)[O-])cc3)CC2)s1 ZINC000412284626 942063902 /nfs/dbraw/zinc/06/39/02/942063902.db2.gz AQEVTBGGQIUGSQ-DLBZAZTESA-N 0 0 371.462 3.869 20 5 FHBDRN CCOC(=O)CC[C@H]1CCCN(c2ccc3ncccc3c2[N+](=O)[O-])C1 ZINC000128362623 942072226 /nfs/dbraw/zinc/07/22/26/942072226.db2.gz LJQURIFFGPUXJU-CQSZACIVSA-N 0 0 357.410 3.703 20 5 FHBDRN Cc1ccc2c(c1)CC[C@H]2NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513680412 942079298 /nfs/dbraw/zinc/07/92/98/942079298.db2.gz OLOHIBQSMMYNDL-CQSZACIVSA-N 0 0 362.332 3.922 20 5 FHBDRN C[C@@H](Nc1ccc(N2CCCC2)c(F)c1)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000120683789 942080917 /nfs/dbraw/zinc/08/09/17/942080917.db2.gz MHJADRHKXXZXDA-CYBMUJFWSA-N 0 0 372.400 3.773 20 5 FHBDRN CC(C)Oc1cc(-c2nc(CCC3CCOCC3)no2)ccc1[N+](=O)[O-] ZINC000420503525 942086264 /nfs/dbraw/zinc/08/62/64/942086264.db2.gz NETSTBAJTQAWMN-UHFFFAOYSA-N 0 0 361.398 3.791 20 5 FHBDRN O=C(COc1cccc([N+](=O)[O-])c1)Nc1ccc(F)cc1C(F)(F)F ZINC000102738532 942090337 /nfs/dbraw/zinc/09/03/37/942090337.db2.gz FSHHDEAHEXYSRA-UHFFFAOYSA-N 0 0 358.247 3.770 20 5 FHBDRN Cc1ccc(CNC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)c(C)c1 ZINC000513724663 942090736 /nfs/dbraw/zinc/09/07/36/942090736.db2.gz LGVWCFSXJROQDR-UHFFFAOYSA-N 0 0 350.321 3.743 20 5 FHBDRN Cc1cc(C)c(S(=O)(=O)N(C)[C@H](C)C2CCCCC2)cc1[N+](=O)[O-] ZINC001211650895 942095044 /nfs/dbraw/zinc/09/50/44/942095044.db2.gz BSSCVVYQXMLBPL-CQSZACIVSA-N 0 0 354.472 3.801 20 5 FHBDRN O=[N+]([O-])c1cccc(CCc2nc(C3(c4ccccc4F)CC3)no2)c1 ZINC000420532638 942095185 /nfs/dbraw/zinc/09/51/85/942095185.db2.gz TVCVZGHANUHKAT-UHFFFAOYSA-N 0 0 353.353 3.982 20 5 FHBDRN O=C(Nc1cc(F)ccc1Cl)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000102740872 942096621 /nfs/dbraw/zinc/09/66/21/942096621.db2.gz DFUPOAXFBUWUDM-UHFFFAOYSA-N 0 0 360.732 3.825 20 5 FHBDRN CCOc1ccc(-c2nc(Cc3ccc([N+](=O)[O-])c(C)c3)no2)cc1OC ZINC000545851035 942097163 /nfs/dbraw/zinc/09/71/63/942097163.db2.gz VTRWOIUGFIKVDD-UHFFFAOYSA-N 0 0 369.377 3.951 20 5 FHBDRN O=C(NCCc1ccc(Cl)cc1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513722824 942097754 /nfs/dbraw/zinc/09/77/54/942097754.db2.gz ACGAPWQYXKDTHV-UHFFFAOYSA-N 0 0 370.739 3.822 20 5 FHBDRN Cc1ccc(NC(=S)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cc1C ZINC000006966549 942098463 /nfs/dbraw/zinc/09/84/63/942098463.db2.gz RWXRIRHUGCBWIK-UHFFFAOYSA-N 0 0 370.478 3.731 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1CCO[C@H](c2ccccc2)C1 ZINC000280071499 942101954 /nfs/dbraw/zinc/10/19/54/942101954.db2.gz QKCXOSQKURBSSM-QAPCUYQASA-N 0 0 370.405 3.644 20 5 FHBDRN Cc1ccc(C2(C(=O)N[C@@H](C)c3cccc([N+](=O)[O-])c3)CCOCC2)cc1 ZINC000110230736 942104307 /nfs/dbraw/zinc/10/43/07/942104307.db2.gz JVLLTFKAESHGIG-INIZCTEOSA-N 0 0 368.433 3.829 20 5 FHBDRN Cc1csc([C@H](C)CNC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])n1 ZINC000280097217 942106234 /nfs/dbraw/zinc/10/62/34/942106234.db2.gz JRMNCTWKXVKZCB-MRVPVSSYSA-N 0 0 371.821 3.615 20 5 FHBDRN Cc1cccc(NC(=S)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c1C ZINC000006967961 942109181 /nfs/dbraw/zinc/10/91/81/942109181.db2.gz IHMQOTAYVXWKNJ-UHFFFAOYSA-N 0 0 370.478 3.731 20 5 FHBDRN O=C(NCc1c(F)cccc1Cl)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513725470 942113524 /nfs/dbraw/zinc/11/35/24/942113524.db2.gz QGLZBKWSTUQULE-UHFFFAOYSA-N 0 0 374.702 3.919 20 5 FHBDRN COCC1(CCNC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])CCC1 ZINC000501919533 942113753 /nfs/dbraw/zinc/11/37/53/942113753.db2.gz VJWGVHLXWFEDKO-UHFFFAOYSA-N 0 0 372.874 3.663 20 5 FHBDRN CCCOc1cc(O)ccc1NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412302830 942117005 /nfs/dbraw/zinc/11/70/05/942117005.db2.gz MTKICRUUUUDOGW-JKSUJKDBSA-N 0 0 356.378 3.831 20 5 FHBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])Nc1ccc2c(c1)CCCN2 ZINC000415887504 942117277 /nfs/dbraw/zinc/11/72/77/942117277.db2.gz OWXBBJJPVIMPNF-UHFFFAOYSA-N 0 0 374.828 3.971 20 5 FHBDRN COc1cc(C(=O)N(c2ccccc2)[C@@H]2C[C@@H]2C)c([N+](=O)[O-])cc1OC ZINC000415899469 942118787 /nfs/dbraw/zinc/11/87/87/942118787.db2.gz HXGDTWHQNXEXHT-SWLSCSKDSA-N 0 0 356.378 3.667 20 5 FHBDRN CC(=O)c1ccc2c(c1)CN(C(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1)C2 ZINC000413372147 942121543 /nfs/dbraw/zinc/12/15/43/942121543.db2.gz XDIIDVWQCLHRPO-CYBMUJFWSA-N 0 0 367.405 3.892 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N(c2ccccc2)[C@@H]2C[C@H]2C)c1F ZINC000415893467 942121742 /nfs/dbraw/zinc/12/17/42/942121742.db2.gz PIZAREXRKHWEPA-MLGOLLRUSA-N 0 0 358.369 3.727 20 5 FHBDRN Cc1nc(Nc2ccc3c(c2)CN(CC(F)(F)F)C3)ccc1[N+](=O)[O-] ZINC000413374216 942122142 /nfs/dbraw/zinc/12/21/42/942122142.db2.gz QVKOOKPLPQCRCJ-UHFFFAOYSA-N 0 0 352.316 3.920 20 5 FHBDRN Cc1cc(F)ccc1C1CCN(c2c(C(N)=O)cccc2[N+](=O)[O-])CC1 ZINC000420622585 942123743 /nfs/dbraw/zinc/12/37/43/942123743.db2.gz DKENWVPVGAXTNJ-UHFFFAOYSA-N 0 0 357.385 3.525 20 5 FHBDRN Cc1cnc([C@H](C)CNC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])s1 ZINC000280186492 942128802 /nfs/dbraw/zinc/12/88/02/942128802.db2.gz OVEJPSKKIHGCBJ-MRVPVSSYSA-N 0 0 371.821 3.615 20 5 FHBDRN Cc1nc2ccccc2n1C1CCN(c2ncc([N+](=O)[O-])cc2C)CC1 ZINC000280201969 942133999 /nfs/dbraw/zinc/13/39/99/942133999.db2.gz JNXQRPXHTGHXHT-UHFFFAOYSA-N 0 0 351.410 3.798 20 5 FHBDRN COc1cc(C(=O)N[C@H](C)[C@H](C)c2ccccc2)cc([N+](=O)[O-])c1OC ZINC000473541653 942136223 /nfs/dbraw/zinc/13/62/23/942136223.db2.gz PQQDNORRNXHZDY-QWHCGFSZSA-N 0 0 358.394 3.534 20 5 FHBDRN CO[C@@](C)([C@@H](C)NC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])C1CC1 ZINC000415917923 942142306 /nfs/dbraw/zinc/14/23/06/942142306.db2.gz KATXLHPWUKDUKM-PSLIRLAXSA-N 0 0 360.332 3.547 20 5 FHBDRN O=C(NCc1cccc(Cl)c1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513726217 942143135 /nfs/dbraw/zinc/14/31/35/942143135.db2.gz VIILVYMTJZAVHS-UHFFFAOYSA-N 0 0 356.712 3.780 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCCCC2)c(-c2nc(Cc3ccccn3)no2)c1 ZINC000280266194 942146152 /nfs/dbraw/zinc/14/61/52/942146152.db2.gz KHTWNDOHJUUSHF-UHFFFAOYSA-N 0 0 365.393 3.621 20 5 FHBDRN CC(C)(C)[C@@H]1C[C@@H](NC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])CCO1 ZINC000280272102 942147768 /nfs/dbraw/zinc/14/77/68/942147768.db2.gz VCKZDBIGKFNZKZ-NHYWBVRUSA-N 0 0 372.824 3.640 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)[C@](C)(OC)C1CC1 ZINC000415922215 942148945 /nfs/dbraw/zinc/14/89/45/942148945.db2.gz TUPCRHCGJWBPNE-GTNSWQLSSA-N 0 0 352.456 3.640 20 5 FHBDRN O=[N+]([O-])c1ccc2oc(CN3CC[C@H](Oc4cccc(F)c4)C3)nc2c1 ZINC000183381398 942151936 /nfs/dbraw/zinc/15/19/36/942151936.db2.gz LRXBQQGRXUXTMD-HNNXBMFYSA-N 0 0 357.341 3.528 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)NCC1(c2ccncc2)CCCC1 ZINC000501984245 942153460 /nfs/dbraw/zinc/15/34/60/942153460.db2.gz LIKPFDHSDLKVRX-UHFFFAOYSA-N 0 0 373.840 3.814 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)NC[C@@H]2CCC[C@H](C)C2)cc1SC ZINC000102999646 942167089 /nfs/dbraw/zinc/16/70/89/942167089.db2.gz YAQVYXQBTDGLKP-NWDGAFQWSA-N 0 0 352.456 3.881 20 5 FHBDRN Cc1ccc(CN(C)C(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)cc1 ZINC000513694486 942175642 /nfs/dbraw/zinc/17/56/42/942175642.db2.gz RFNVXSDPOJKTJF-UHFFFAOYSA-N 0 0 350.321 3.777 20 5 FHBDRN Cn1cc([N+](=O)[O-])c(C(=O)N[C@H](CC2CCCCC2)c2ccccc2)n1 ZINC000502034381 942181369 /nfs/dbraw/zinc/18/13/69/942181369.db2.gz TUFOVBZFUZQASB-MRXNPFEDSA-N 0 0 356.426 3.770 20 5 FHBDRN NC(=O)c1ccnc(N2CC3(CCCCC3)[C@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000413434097 942183754 /nfs/dbraw/zinc/18/37/54/942183754.db2.gz KVVBZVGEROLSMQ-QGZVFWFLSA-N 0 0 366.421 3.601 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2C[C@@H](C)Oc3ccccc32)ccc1[N+](=O)[O-] ZINC000413445059 942191064 /nfs/dbraw/zinc/19/10/64/942191064.db2.gz WCWROJJVRDRHOP-CYBMUJFWSA-N 0 0 356.378 3.810 20 5 FHBDRN O=C(Nc1cnn(Cc2ccccc2)c1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000110238545 942213473 /nfs/dbraw/zinc/21/34/73/942213473.db2.gz RBNCEHZPFXTFNE-UHFFFAOYSA-N 0 0 356.769 3.745 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N(C)Cc2ccccc2Cl)c1C ZINC000480940937 942215838 /nfs/dbraw/zinc/21/58/38/942215838.db2.gz WQUCQTJTTXSZKR-UHFFFAOYSA-N 0 0 368.842 3.686 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)NC[C@H]2CC23CCSCC3)cc1[N+](=O)[O-] ZINC000420816872 942221027 /nfs/dbraw/zinc/22/10/27/942221027.db2.gz ZBRCNMYZCSVYKR-DZGCQCFKSA-N 0 0 363.483 3.797 20 5 FHBDRN COc1cc(NC2CCN(C(=O)c3ccc(C)cc3)CC2)ccc1[N+](=O)[O-] ZINC000290488101 942224522 /nfs/dbraw/zinc/22/45/22/942224522.db2.gz CERINTWPJCEEGH-UHFFFAOYSA-N 0 0 369.421 3.629 20 5 FHBDRN COc1cc(C(=O)N(C)Cc2ccc(C(F)(F)F)cc2)ccc1[N+](=O)[O-] ZINC000159033940 942232931 /nfs/dbraw/zinc/23/29/31/942232931.db2.gz FQVVLURYKLEHTE-UHFFFAOYSA-N 0 0 368.311 3.894 20 5 FHBDRN CCOC(=O)c1ccccc1N(C)C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000413476173 942233727 /nfs/dbraw/zinc/23/37/27/942233727.db2.gz ZQALTUPFDSYDLR-DLBZAZTESA-N 0 0 368.389 3.538 20 5 FHBDRN C[C@H](Cc1cncc2ccccc21)C(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000480956297 942236778 /nfs/dbraw/zinc/23/67/78/942236778.db2.gz ILVYLHGSZVOLCT-OAHLLOKOSA-N 0 0 363.417 3.980 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CSc1ccc(N)cc1Cl ZINC000502133670 942238130 /nfs/dbraw/zinc/23/81/30/942238130.db2.gz YEZFYMWFHFSRMH-UHFFFAOYSA-N 0 0 351.815 3.870 20 5 FHBDRN COc1ccc(CNC(=O)NCc2cccc3ccccc32)cc1[N+](=O)[O-] ZINC000502118264 942240395 /nfs/dbraw/zinc/24/03/95/942240395.db2.gz GOYZTMSGAHLMJN-UHFFFAOYSA-N 0 0 365.389 3.756 20 5 FHBDRN Nc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(Cl)c(OC(F)F)c1 ZINC000183199812 942243960 /nfs/dbraw/zinc/24/39/60/942243960.db2.gz RQCSKMUOVAQBGC-UHFFFAOYSA-N 0 0 357.700 3.684 20 5 FHBDRN Cc1ccc2nc(SCc3c(F)cccc3[N+](=O)[O-])n(C)c(=O)c2c1 ZINC000103350054 942246289 /nfs/dbraw/zinc/24/62/89/942246289.db2.gz VKCKONWKVSPZMF-UHFFFAOYSA-N 0 0 359.382 3.582 20 5 FHBDRN COc1cc(C(=O)N2[C@H](C)CCC[C@@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000103368244 942246743 /nfs/dbraw/zinc/24/67/43/942246743.db2.gz SWRKPVQZUNZRRD-AOOOYVTPSA-N 0 0 358.341 3.608 20 5 FHBDRN COc1cc(C(=O)N2[C@@H](C)CCC[C@@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000103368247 942246874 /nfs/dbraw/zinc/24/68/74/942246874.db2.gz SWRKPVQZUNZRRD-UWVGGRQHSA-N 0 0 358.341 3.608 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)OCC(=O)Nc2cc(C)ccc2C)c1 ZINC000016195956 942246836 /nfs/dbraw/zinc/24/68/36/942246836.db2.gz SIHGQADZFGFKTI-UHFFFAOYSA-N 0 0 374.418 3.729 20 5 FHBDRN CCc1ccc(C(=O)COC(=O)c2cc(SC)ccc2[N+](=O)[O-])cc1 ZINC000016196320 942248252 /nfs/dbraw/zinc/24/82/52/942248252.db2.gz SZGJCPBUHYYEQC-UHFFFAOYSA-N 0 0 359.403 3.919 20 5 FHBDRN C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1cccc(Br)c1 ZINC000103377521 942248714 /nfs/dbraw/zinc/24/87/14/942248714.db2.gz QEEHEDXJNJWKGK-SNVBAGLBSA-N 0 0 361.195 3.949 20 5 FHBDRN COc1ccc2nc(C(=O)N3c4ccc([N+](=O)[O-])cc4C[C@@H]3C)ccc2c1 ZINC000103376507 942248716 /nfs/dbraw/zinc/24/87/16/942248716.db2.gz SZIGRVMUJHPLOU-LBPRGKRZSA-N 0 0 363.373 3.743 20 5 FHBDRN CC(C)c1ncc(Cl)c(C(=O)N2c3ccc([N+](=O)[O-])cc3C[C@@H]2C)n1 ZINC000103375373 942248979 /nfs/dbraw/zinc/24/89/79/942248979.db2.gz MARBBTKBVGLACD-JTQLQIEISA-N 0 0 360.801 3.753 20 5 FHBDRN C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1ccn(-c2ccccc2F)n1 ZINC000103375871 942249341 /nfs/dbraw/zinc/24/93/41/942249341.db2.gz GSHUZMRLKFNFNV-LBPRGKRZSA-N 0 0 366.352 3.511 20 5 FHBDRN CCOc1cc(CNc2ncc([N+](=O)[O-])cc2F)ccc1OC(F)F ZINC000413067425 942250369 /nfs/dbraw/zinc/25/03/69/942250369.db2.gz CFHFRLZFQIYJMM-UHFFFAOYSA-N 0 0 357.288 3.741 20 5 FHBDRN C[C@H](C(=O)N1CC[C@H](c2ccccc2F)C1)c1ccc([N+](=O)[O-])cc1F ZINC000502161369 942254474 /nfs/dbraw/zinc/25/44/74/942254474.db2.gz XJVAJVGUCUDJQO-STQMWFEESA-N 0 0 360.360 3.993 20 5 FHBDRN COc1cc(CN2CCC[C@H](CC(F)(F)F)C2)c([N+](=O)[O-])cc1F ZINC000420940515 942265839 /nfs/dbraw/zinc/26/58/39/942265839.db2.gz DJYGKVXLFGQHPF-SNVBAGLBSA-N 0 0 350.312 3.907 20 5 FHBDRN CC(C)c1nc([C@@H]2CCCN2c2ccc([N+](=O)[O-])c3ncccc23)no1 ZINC000413096513 942285087 /nfs/dbraw/zinc/28/50/87/942285087.db2.gz AKPWSFXXCJLTOY-HNNXBMFYSA-N 0 0 353.382 3.991 20 5 FHBDRN Cc1noc(-c2ccc(CNC(=O)c3c(C)c(C)ccc3[N+](=O)[O-])cc2)n1 ZINC001267736743 942285160 /nfs/dbraw/zinc/28/51/60/942285160.db2.gz VWZQIQSCQGCYIG-UHFFFAOYSA-N 0 0 366.377 3.500 20 5 FHBDRN CCn1cc([C@@H]2OCC[C@H]2CNc2ccc3ncccc3c2[N+](=O)[O-])cn1 ZINC000413517621 942290955 /nfs/dbraw/zinc/29/09/55/942290955.db2.gz SMIAWXWRBAISDE-ORAYPTAESA-N 0 0 367.409 3.549 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CCC[C@H](c3nccs3)C2)c(C(F)(F)F)c1 ZINC000413105343 942291643 /nfs/dbraw/zinc/29/16/43/942291643.db2.gz LHWCURJHQMVXOS-VIFPVBQESA-N 0 0 358.345 3.849 20 5 FHBDRN CCn1cc([C@@H]2OCC[C@H]2CNc2ccc([N+](=O)[O-])cc2Cl)cn1 ZINC000413519403 942291954 /nfs/dbraw/zinc/29/19/54/942291954.db2.gz WEDQQHWAZWMIES-MEDUHNTESA-N 0 0 350.806 3.654 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N(C)C[C@H]1CCCC[C@@H]1O ZINC000183471223 942293577 /nfs/dbraw/zinc/29/35/77/942293577.db2.gz VUOYIVAYVKBUMM-CJNGLKHVSA-N 0 0 366.483 3.718 20 5 FHBDRN Cc1cc(S(=O)(=O)N2CCC[C@@H](C(C)(C)C)C2)c(C)cc1[N+](=O)[O-] ZINC001211651470 942293665 /nfs/dbraw/zinc/29/36/65/942293665.db2.gz VPNRYXFTOLBALN-CQSZACIVSA-N 0 0 354.472 3.658 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H](CC(C)C)OC ZINC000416055118 942300032 /nfs/dbraw/zinc/30/00/32/942300032.db2.gz GGSUGJZKMLFXLD-CQSZACIVSA-N 0 0 354.472 3.888 20 5 FHBDRN CO[C@](C)([C@H](C)Nc1ncc([N+](=O)[O-])c(C)c1Br)C1CC1 ZINC000413524898 942300928 /nfs/dbraw/zinc/30/09/28/942300928.db2.gz XGLJNGACFLFUTL-LKFCYVNXSA-N 0 0 358.236 3.676 20 5 FHBDRN CN(CCCn1ccnc1)C(=O)Nc1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000501084149 942301786 /nfs/dbraw/zinc/30/17/86/942301786.db2.gz JGZKJHZVZSASOH-UHFFFAOYSA-N 0 0 359.430 3.643 20 5 FHBDRN C[C@@H](c1cnn(C)c1)N(C)C(=O)Nc1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000501110379 942302589 /nfs/dbraw/zinc/30/25/89/942302589.db2.gz WPGGCUWNAWJSLD-LBPRGKRZSA-N 0 0 359.430 3.851 20 5 FHBDRN CC[C@](C)(NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)c1nc(C)cs1 ZINC000413523879 942309656 /nfs/dbraw/zinc/30/96/56/942309656.db2.gz ZCWVRJPCANZKSW-DAYGRLMNSA-N 0 0 359.451 3.905 20 5 FHBDRN CN(Cc1nccn1CC(F)(F)F)c1ccc([N+](=O)[O-])c2ncccc12 ZINC000413115191 942310558 /nfs/dbraw/zinc/31/05/58/942310558.db2.gz FRWFBRALJZDERM-UHFFFAOYSA-N 0 0 365.315 3.538 20 5 FHBDRN CS(=O)(=O)c1cc(SCC2CCC(F)(F)CC2)ccc1[N+](=O)[O-] ZINC000419602412 942320688 /nfs/dbraw/zinc/32/06/88/942320688.db2.gz KHQNHWIEOVQUHV-UHFFFAOYSA-N 0 0 365.423 3.916 20 5 FHBDRN Cn1cc([C@@H]2OCC[C@H]2CNc2c(Cl)cc(Cl)cc2[N+](=O)[O-])cn1 ZINC000413532916 942322682 /nfs/dbraw/zinc/32/26/82/942322682.db2.gz NYTMAZVHWCHMQN-BJOHPYRUSA-N 0 0 371.224 3.825 20 5 FHBDRN CNC(=O)c1ccc(N[C@@H]2CC[C@H](c3ccccc3F)C2)c([N+](=O)[O-])c1 ZINC000481092463 942326933 /nfs/dbraw/zinc/32/69/33/942326933.db2.gz PDAUHHAITWIRGV-GXTWGEPZSA-N 0 0 357.385 3.842 20 5 FHBDRN CC[C@H](NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)[C@H]1CC1(C)C ZINC000416079954 942326945 /nfs/dbraw/zinc/32/69/45/942326945.db2.gz LDECWQAAPAPUAQ-CVEARBPZSA-N 0 0 359.470 3.752 20 5 FHBDRN CCOc1cccc(N2CC[C@]3(C2)CC(=O)c2ccccc2O3)c1[N+](=O)[O-] ZINC000413542213 942340411 /nfs/dbraw/zinc/34/04/11/942340411.db2.gz XUSBTMDVBAUAQU-HXUWFJFHSA-N 0 0 368.389 3.608 20 5 FHBDRN CC(C)NC(=O)[C@@H]1CCC[C@@H](Nc2nccc3ccc([N+](=O)[O-])cc32)C1 ZINC000413149279 942343772 /nfs/dbraw/zinc/34/37/72/942343772.db2.gz ROXSCLPDWPKJQM-HUUCEWRRSA-N 0 0 356.426 3.638 20 5 FHBDRN CSCCCCCNC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000188142437 942347252 /nfs/dbraw/zinc/34/72/52/942347252.db2.gz OKEQPJRQFNCVLK-UHFFFAOYSA-N 0 0 365.480 3.981 20 5 FHBDRN O=[N+]([O-])c1cnc(NC[C@@H](CCO)c2ccccc2)c(C(F)(F)F)c1 ZINC000413157992 942353798 /nfs/dbraw/zinc/35/37/98/942353798.db2.gz UWWYFBXYQQWMDH-GFCCVEGCSA-N 0 0 355.316 3.587 20 5 FHBDRN C[C@@H](CCc1ccccc1[N+](=O)[O-])Nc1cccc2c1ccn(C)c2=O ZINC000502323164 942354070 /nfs/dbraw/zinc/35/40/70/942354070.db2.gz UIDNFNITXKKIMI-AWEZNQCLSA-N 0 0 351.406 3.880 20 5 FHBDRN Cc1nn(C)c(NCC2(c3c(F)cccc3F)CCCC2)c1[N+](=O)[O-] ZINC000502324524 942355623 /nfs/dbraw/zinc/35/56/23/942355623.db2.gz KTWPHWLFDRWDFG-UHFFFAOYSA-N 0 0 350.369 3.839 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N1CCSC[C@@H]1C1CCC1 ZINC000416113793 942357519 /nfs/dbraw/zinc/35/75/19/942357519.db2.gz OFRFENGBQHRYGA-CQSZACIVSA-N 0 0 374.384 3.971 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N1CCSC[C@H]1C1CCC1 ZINC000416113792 942357590 /nfs/dbraw/zinc/35/75/90/942357590.db2.gz OFRFENGBQHRYGA-AWEZNQCLSA-N 0 0 374.384 3.971 20 5 FHBDRN CC(C)c1ncncc1C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000501283961 942372125 /nfs/dbraw/zinc/37/21/25/942372125.db2.gz JFVCKDLDWJJUAI-UHFFFAOYSA-N 0 0 365.187 3.523 20 5 FHBDRN CC[C@@H](Cc1ccccc1)N(CC)C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000501283161 942372244 /nfs/dbraw/zinc/37/22/44/942372244.db2.gz LCBSFHWPBXWXOT-HNNXBMFYSA-N 0 0 366.421 3.955 20 5 FHBDRN O=C(NCCc1ccccc1[N+](=O)[O-])Nc1ccc2c(c1)C(=O)CCCC2 ZINC000421144508 942372400 /nfs/dbraw/zinc/37/24/00/942372400.db2.gz VRJYFMPMGXAVDQ-UHFFFAOYSA-N 0 0 367.405 3.868 20 5 FHBDRN Cc1nn(CC(=O)N[C@@H](CC(C)(C)C)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000501273337 942377449 /nfs/dbraw/zinc/37/74/49/942377449.db2.gz IIVDRTBUCIFXMN-HNNXBMFYSA-N 0 0 362.405 3.533 20 5 FHBDRN Cc1ccc(NC(=O)C(=O)N(C)[C@@H]2CCC[C@@H]2C(C)(C)C)cc1[N+](=O)[O-] ZINC000419794409 942382547 /nfs/dbraw/zinc/38/25/47/942382547.db2.gz LBDFMFGZUUMEDE-LSDHHAIUSA-N 0 0 361.442 3.515 20 5 FHBDRN Cc1c(NC(=O)C(=O)N(C)[C@H]2CCC[C@@H]2C(C)(C)C)cccc1[N+](=O)[O-] ZINC000419789989 942391686 /nfs/dbraw/zinc/39/16/86/942391686.db2.gz DKLWETDANQPZED-BBRMVZONSA-N 0 0 361.442 3.515 20 5 FHBDRN Cc1c(NC(=O)C(=O)N(C)[C@@H]2CCC[C@H]2C(C)(C)C)cccc1[N+](=O)[O-] ZINC000419789992 942392299 /nfs/dbraw/zinc/39/22/99/942392299.db2.gz DKLWETDANQPZED-CZUORRHYSA-N 0 0 361.442 3.515 20 5 FHBDRN Cc1cc(NC(=O)C(=O)N[C@H](C)c2ccc(C3CC3)cc2)ccc1[N+](=O)[O-] ZINC000419822041 942398404 /nfs/dbraw/zinc/39/84/04/942398404.db2.gz WJSMDYKKITXXFG-CYBMUJFWSA-N 0 0 367.405 3.597 20 5 FHBDRN C[C@@H]1CCN(C(=O)c2ccc(Br)cc2[N+](=O)[O-])C[C@@H](C)C1 ZINC000502370572 942402679 /nfs/dbraw/zinc/40/26/79/942402679.db2.gz VLCWALAQKFOLCO-MNOVXSKESA-N 0 0 355.232 3.866 20 5 FHBDRN CN(Cc1noc(C2CC2)n1)c1ccc([N+](=O)[O-])c(-c2ccccc2)n1 ZINC000413606301 942405804 /nfs/dbraw/zinc/40/58/04/942405804.db2.gz LRDZEFOVUQGZID-UHFFFAOYSA-N 0 0 351.366 3.554 20 5 FHBDRN COc1c(C)cc(C(=O)Nc2cc(C)nc3ccc([N+](=O)[O-])cc32)cc1C ZINC001268853649 942414381 /nfs/dbraw/zinc/41/43/81/942414381.db2.gz DEVLPLPBZMSCGR-UHFFFAOYSA-N 0 0 365.389 3.751 20 5 FHBDRN Cc1cc(NC(=O)CCCc2ccc(F)cc2)c2cc([N+](=O)[O-])ccc2n1 ZINC001268853950 942415253 /nfs/dbraw/zinc/41/52/53/942415253.db2.gz OYIYXKHYGIESDO-UHFFFAOYSA-N 0 0 367.380 3.974 20 5 FHBDRN O=[N+]([O-])c1ccc(CN2CCC[C@H](c3ccncn3)C2)c(C(F)(F)F)c1 ZINC000378222415 942416867 /nfs/dbraw/zinc/41/68/67/942416867.db2.gz WEMYYCAKWMZXNM-ZDUSSCGKSA-N 0 0 366.343 3.783 20 5 FHBDRN COc1ccc([C@H]2C[C@H](NC(=O)c3cc([N+](=O)[O-])c(C)s3)C2)cc1F ZINC000501338029 942419130 /nfs/dbraw/zinc/41/91/30/942419130.db2.gz ZQEFGPNTONLWRE-HAQNSBGRSA-N 0 0 364.398 3.788 20 5 FHBDRN Cc1c(NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)cnn1CC(C)C ZINC000501345565 942422491 /nfs/dbraw/zinc/42/24/91/942422491.db2.gz WMSVIOHAVBEXAA-UHFFFAOYSA-N 0 0 371.441 3.608 20 5 FHBDRN C[C@@H]1[C@@H](Cc2ccccc2)CCN1C(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000472944507 942431701 /nfs/dbraw/zinc/43/17/01/942431701.db2.gz ADLGOUQLJHRPOX-CRAIPNDOSA-N 0 0 353.422 3.758 20 5 FHBDRN COc1ccc(OC)c([C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)c1 ZINC000015827798 942435047 /nfs/dbraw/zinc/43/50/47/942435047.db2.gz JQZFOQWUYBFRAB-CYBMUJFWSA-N 0 0 362.407 3.651 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CCO[C@H](c3cccc(C(F)(F)F)c3)C2)c(F)c1 ZINC000413184071 942437701 /nfs/dbraw/zinc/43/77/01/942437701.db2.gz NCPMHVVDPUQTTJ-AWEZNQCLSA-N 0 0 371.290 3.726 20 5 FHBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)NC[C@@H]1C[C@H]1C1CCC1 ZINC000424901086 942438591 /nfs/dbraw/zinc/43/85/91/942438591.db2.gz YCKHTTNZEWVRQK-LPHOPBHVSA-N 0 0 360.457 3.707 20 5 FHBDRN Cn1c(CNC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)nc2ccccc21 ZINC000015832165 942454253 /nfs/dbraw/zinc/45/42/53/942454253.db2.gz DYABCSJMDVSNEJ-UHFFFAOYSA-N 0 0 366.402 3.626 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1-c1nc(-c2ccc(N3CCCC3)cn2)no1 ZINC000421249622 942455651 /nfs/dbraw/zinc/45/56/51/942455651.db2.gz JDZNCHMHCXTMNW-UHFFFAOYSA-N 0 0 365.393 3.924 20 5 FHBDRN CCS[C@H]1CC[C@H](N(C)C(=O)Nc2ccc([N+](=O)[O-])cc2OC)C1 ZINC000122896198 942457324 /nfs/dbraw/zinc/45/73/24/942457324.db2.gz HKRCXRDVYPCKQU-AAEUAGOBSA-N 0 0 353.444 3.741 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CCO[C@H](c3ccsc3)C2)c(C(F)(F)F)c1 ZINC000413192529 942458848 /nfs/dbraw/zinc/45/88/48/942458848.db2.gz NFQIQYRPXSWOIQ-LBPRGKRZSA-N 0 0 359.329 3.648 20 5 FHBDRN CC(C)n1cc2c(n1)C[C@@H](Nc1ncc([N+](=O)[O-])cc1C(F)(F)F)CC2 ZINC000413199567 942464504 /nfs/dbraw/zinc/46/45/04/942464504.db2.gz LYAHGHRJDSCOSR-NSHDSACASA-N 0 0 369.347 3.755 20 5 FHBDRN O=C(c1ccc(Cn2cc([N+](=O)[O-])cn2)cc1)N1CCCC12CCCCC2 ZINC001269745034 942466569 /nfs/dbraw/zinc/46/65/69/942466569.db2.gz LNAFJNFVKXKGSJ-UHFFFAOYSA-N 0 0 368.437 3.779 20 5 FHBDRN O=C(C1CCCCC1)N1CC[C@H](Nc2nccc3ccc([N+](=O)[O-])cc32)C1 ZINC000413206948 942477780 /nfs/dbraw/zinc/47/77/80/942477780.db2.gz ZIHQQUABZQNJNS-INIZCTEOSA-N 0 0 368.437 3.736 20 5 FHBDRN CN1CC[C@H](Nc2ncc([N+](=O)[O-])cc2F)[C@H]1c1ccc(Cl)c(F)c1 ZINC000413212438 942487005 /nfs/dbraw/zinc/48/70/05/942487005.db2.gz YSKZOARHPCJHPV-LSDHHAIUSA-N 0 0 368.771 3.779 20 5 FHBDRN O=C(COc1ccccc1[N+](=O)[O-])N1CCC[C@@H]1/C=C\c1ccccc1 ZINC000505372278 942491119 /nfs/dbraw/zinc/49/11/19/942491119.db2.gz IMOHPOBOQLZCOE-MUSGIIIZSA-N 0 0 352.390 3.678 20 5 FHBDRN CO[C@](C)([C@H](C)NC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C)C1CC1 ZINC000413686630 942499131 /nfs/dbraw/zinc/49/91/31/942499131.db2.gz JTEABZFSZQUDSE-IFXJQAMLSA-N 0 0 363.458 3.718 20 5 FHBDRN O=[N+]([O-])c1ccc(NCCCc2nnc3n2CCCCC3)c2ccncc21 ZINC000066813784 942500093 /nfs/dbraw/zinc/50/00/93/942500093.db2.gz KDNXVEBZCLUOCL-UHFFFAOYSA-N 0 0 366.425 3.506 20 5 FHBDRN COC(=O)c1cccc(COc2ccc(OC)cc2[N+](=O)[O-])c1Cl ZINC000381976451 942502530 /nfs/dbraw/zinc/50/25/30/942502530.db2.gz WDILUBZQXXDZCE-UHFFFAOYSA-N 0 0 351.742 3.622 20 5 FHBDRN CCOc1ccc(OCC)c(N[C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000052774481 942507528 /nfs/dbraw/zinc/50/75/28/942507528.db2.gz RZQIKEHUTKWHBF-ZDUSSCGKSA-N 0 0 373.409 3.831 20 5 FHBDRN CCOc1ccc(OCC)c(N[C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000052774482 942508822 /nfs/dbraw/zinc/50/88/22/942508822.db2.gz RZQIKEHUTKWHBF-CYBMUJFWSA-N 0 0 373.409 3.831 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)C1(c2ccccc2)CCC1 ZINC000016376271 942511351 /nfs/dbraw/zinc/51/13/51/942511351.db2.gz YIDUCYIRTYLXKG-UHFFFAOYSA-N 0 0 368.389 3.507 20 5 FHBDRN O=[N+]([O-])c1cnc(N[C@H]2CCO[C@@H]2c2ccc(Cl)c(F)c2)c(F)c1 ZINC000413228780 942516203 /nfs/dbraw/zinc/51/62/03/942516203.db2.gz QHRFQIZLYLPOPC-UONOGXRCSA-N 0 0 355.728 3.864 20 5 FHBDRN CCn1ccnc1[C@H]1OCCC[C@@H]1Nc1ccc([N+](=O)[O-])c2ncccc12 ZINC000413228755 942516285 /nfs/dbraw/zinc/51/62/85/942516285.db2.gz CEDHSFHAZXAIOX-YJBOKZPZSA-N 0 0 367.409 3.692 20 5 FHBDRN COc1ccccc1CCN(C)C(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000104457096 942517155 /nfs/dbraw/zinc/51/71/55/942517155.db2.gz LPBNCHMEFVFGKR-AWEZNQCLSA-N 0 0 374.462 3.785 20 5 FHBDRN NC(=O)c1ccnc(N[C@H](c2ccc(F)cc2)C2CCCC2)c1[N+](=O)[O-] ZINC000290709493 942520904 /nfs/dbraw/zinc/52/09/04/942520904.db2.gz XEPAVIIWFUICAT-HNNXBMFYSA-N 0 0 358.373 3.571 20 5 FHBDRN COc1ccc([C@H](NC(=O)c2ccc(C)c([N+](=O)[O-])c2)C(F)(F)F)cc1 ZINC000505402173 942527960 /nfs/dbraw/zinc/52/79/60/942527960.db2.gz ICXNIBYFNRHCET-HNNXBMFYSA-N 0 0 368.311 3.945 20 5 FHBDRN COc1ccc([C@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2)C(F)(F)F)cc1 ZINC000505404673 942529580 /nfs/dbraw/zinc/52/95/80/942529580.db2.gz VHSNUMHNQWLJMB-AWEZNQCLSA-N 0 0 372.274 3.776 20 5 FHBDRN O=C(c1ccc(F)c2ccccc12)N1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1 ZINC000366528685 942533222 /nfs/dbraw/zinc/53/32/22/942533222.db2.gz GAPAPBXQSFAPGF-ZDUSSCGKSA-N 0 0 368.368 3.561 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N2C[C@@H](C)C[C@@H]2c2ccccc2F)c1[N+](=O)[O-] ZINC000434242291 942542771 /nfs/dbraw/zinc/54/27/71/942542771.db2.gz LHCIKUMHKBCWQC-SMDDNHRTSA-N 0 0 360.389 3.804 20 5 FHBDRN CC(C)Oc1cc(C(=O)Nc2c3c(nn2C(C)C)CCC3)ccc1[N+](=O)[O-] ZINC000413716102 942544625 /nfs/dbraw/zinc/54/46/25/942544625.db2.gz SVDOSBGCEJLCIV-UHFFFAOYSA-N 0 0 372.425 3.900 20 5 FHBDRN Cc1ccccc1C1=CCN(C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000501550814 942545036 /nfs/dbraw/zinc/54/50/36/942545036.db2.gz DWUQBQWTFJGQBX-UHFFFAOYSA-N 0 0 374.400 3.628 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)N1CC=C(c2ccccc2F)C1 ZINC000501553458 942545857 /nfs/dbraw/zinc/54/58/57/942545857.db2.gz LJOAZYSLIRWAQL-UHFFFAOYSA-N 0 0 365.364 3.614 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N2C[C@H](C)C[C@@H]2c2cccc(F)c2)c1[N+](=O)[O-] ZINC000434246430 942546437 /nfs/dbraw/zinc/54/64/37/942546437.db2.gz SQMPHSIZWZZWFT-BXUZGUMPSA-N 0 0 360.389 3.804 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N2C[C@H](C)C[C@H]2c2cccc(F)c2)c1[N+](=O)[O-] ZINC000434246432 942546582 /nfs/dbraw/zinc/54/65/82/942546582.db2.gz SQMPHSIZWZZWFT-RISCZKNCSA-N 0 0 360.389 3.804 20 5 FHBDRN O=[N+]([O-])c1cc(CN2CC[C@]23CCOC3)ccc1Oc1ccc(F)cc1 ZINC000421398017 942548839 /nfs/dbraw/zinc/54/88/39/942548839.db2.gz NCNBBAGBJGVBLU-LJQANCHMSA-N 0 0 358.369 3.891 20 5 FHBDRN C[C@@H](CCc1ccccc1[N+](=O)[O-])NC1(c2noc(C(F)F)n2)CCC1 ZINC000366536441 942550415 /nfs/dbraw/zinc/55/04/15/942550415.db2.gz QVUJVXLRCKDCSY-NSHDSACASA-N 0 0 366.368 3.906 20 5 FHBDRN COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N2CC[C@H](F)C2)cc1 ZINC000452380200 942550763 /nfs/dbraw/zinc/55/07/63/942550763.db2.gz RJDRMYCBPVQCQA-LBPRGKRZSA-N 0 0 360.341 3.580 20 5 FHBDRN COC(=O)c1cccc2c1CCCN2C(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC000421421828 942550966 /nfs/dbraw/zinc/55/09/66/942550966.db2.gz NZZSHZXBORPKCN-UHFFFAOYSA-N 0 0 368.389 3.591 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N[C@@H](C)c1ccccc1OC(F)F ZINC000501564412 942551376 /nfs/dbraw/zinc/55/13/76/942551376.db2.gz CTFLHBCGILVYQT-NSHDSACASA-N 0 0 350.321 3.996 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC=C(c2ccc(Cl)cc2)CC1 ZINC000434255762 942551725 /nfs/dbraw/zinc/55/17/25/942551725.db2.gz JNZFAOMSHWCYEG-UHFFFAOYSA-N 0 0 357.797 3.881 20 5 FHBDRN C[C@@H](Oc1ccc(F)c(F)c1)C(=O)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000513842730 942552887 /nfs/dbraw/zinc/55/28/87/942552887.db2.gz NQQSQDMSLYBAED-LLVKDONJSA-N 0 0 362.332 3.620 20 5 FHBDRN COc1ccc(OCCCC(=O)N2CCCc3c([N+](=O)[O-])cccc32)cc1 ZINC000513842866 942554163 /nfs/dbraw/zinc/55/41/63/942554163.db2.gz PMHHEGJCOPKLJA-UHFFFAOYSA-N 0 0 370.405 3.742 20 5 FHBDRN CCOc1ccc(C(=O)N2CC=C(c3ccccc3F)C2)cc1[N+](=O)[O-] ZINC000501574110 942557536 /nfs/dbraw/zinc/55/75/36/942557536.db2.gz YABRMFUCYPBULW-UHFFFAOYSA-N 0 0 356.353 3.672 20 5 FHBDRN COc1ccc2c(c1NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)CCC2 ZINC000413755112 942559280 /nfs/dbraw/zinc/55/92/80/942559280.db2.gz BOQXZIICQAMUOL-DLBZAZTESA-N 0 0 352.390 3.834 20 5 FHBDRN CCN(Cc1ccc(OC)c(OC)c1)C(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC000421414874 942560652 /nfs/dbraw/zinc/56/06/52/942560652.db2.gz BMNQBJZWXWHVLK-UHFFFAOYSA-N 0 0 372.421 3.891 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CC=C(c2ccc(O)cc2)CC1 ZINC000421417698 942562397 /nfs/dbraw/zinc/56/23/97/942562397.db2.gz CBUZDKMPSSXOEA-UHFFFAOYSA-N 0 0 352.390 3.847 20 5 FHBDRN Cc1ccccc1C1=CCN(C(=O)CCOc2ccccc2[N+](=O)[O-])C1 ZINC000501608968 942566057 /nfs/dbraw/zinc/56/60/57/942566057.db2.gz ARSGYAHVHWAGCM-UHFFFAOYSA-N 0 0 352.390 3.598 20 5 FHBDRN Cc1nc(C2(NC(=O)c3cc([N+](=O)[O-])c(C)cc3C)CCCCCC2)no1 ZINC000421428212 942566329 /nfs/dbraw/zinc/56/63/29/942566329.db2.gz KTJNKWFGNVIQTE-UHFFFAOYSA-N 0 0 372.425 3.883 20 5 FHBDRN Cc1ccc2oc(SCc3nc(-c4ccc([N+](=O)[O-])cc4)no3)nc2n1 ZINC000541287390 942567314 /nfs/dbraw/zinc/56/73/14/942567314.db2.gz WFELRPCNGGOPHJ-UHFFFAOYSA-N 0 0 369.362 3.782 20 5 FHBDRN O=C(Cc1csc2ccccc12)Nc1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000536252388 942571382 /nfs/dbraw/zinc/57/13/82/942571382.db2.gz GDXJBYJLOTVOCX-UHFFFAOYSA-N 0 0 352.375 3.867 20 5 FHBDRN CC1CCN(c2ccc(C(=O)N3CC[C@H](C)[C@H](C)C3)cc2[N+](=O)[O-])CC1 ZINC000501613226 942575330 /nfs/dbraw/zinc/57/53/30/942575330.db2.gz BZIDIEAVOBYTMY-JKSUJKDBSA-N 0 0 359.470 3.949 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)Nc1cccnc1N1CCCCC1 ZINC000421444719 942577405 /nfs/dbraw/zinc/57/74/05/942577405.db2.gz JIYKYBNUQRMOCH-UHFFFAOYSA-N 0 0 354.410 3.849 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NC[C@]2(C)C[C@H]2c2ccccc2)c1 ZINC000501645921 942579403 /nfs/dbraw/zinc/57/94/03/942579403.db2.gz MISBDVJYPPIHCU-PXNSSMCTSA-N 0 0 354.406 3.917 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N(Cc1ccco1)CC(F)(F)F ZINC000413278649 942586580 /nfs/dbraw/zinc/58/65/80/942586580.db2.gz GYMCWJIWGRDRSM-LSDHHAIUSA-N 0 0 368.311 3.882 20 5 FHBDRN CCn1nccc1C1CCN(c2ccc([N+](=O)[O-])c3ncccc23)CC1 ZINC000413271903 942595023 /nfs/dbraw/zinc/59/50/23/942595023.db2.gz TVAMIGQNKVFKOA-UHFFFAOYSA-N 0 0 351.410 3.743 20 5 FHBDRN CCOC(=O)CN(C(=O)c1cccc([N+](=O)[O-])c1C)[C@H](C)c1ccccc1 ZINC000513920358 942595336 /nfs/dbraw/zinc/59/53/36/942595336.db2.gz NKPMNFCEWOMSQE-OAHLLOKOSA-N 0 0 370.405 3.670 20 5 FHBDRN COc1ccc([C@H]2CCN(C(=O)c3cc([N+](=O)[O-])c(C)cc3C)C2)cc1 ZINC000421457423 942596979 /nfs/dbraw/zinc/59/69/79/942596979.db2.gz AVYAEWOBOBJSHG-INIZCTEOSA-N 0 0 354.406 3.850 20 5 FHBDRN COc1cc(CSCc2cc(C)no2)c([N+](=O)[O-])cc1OCC(F)F ZINC000502636033 942602739 /nfs/dbraw/zinc/60/27/39/942602739.db2.gz JRLJZUDSZKZQBU-UHFFFAOYSA-N 0 0 374.365 3.977 20 5 FHBDRN Cn1nccc1C1C[C@H]2CC[C@@H](C1)N2c1ccc([N+](=O)[O-])c2ncccc12 ZINC000413283932 942603648 /nfs/dbraw/zinc/60/36/48/942603648.db2.gz AQPMJJNJKQFCIO-GOOCMWNKSA-N 0 0 363.421 3.792 20 5 FHBDRN Cc1cccnc1NC(=O)C1CCN(c2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000366574353 942607099 /nfs/dbraw/zinc/60/70/99/942607099.db2.gz VAIXFJFZFJJMDU-UHFFFAOYSA-N 0 0 374.828 3.807 20 5 FHBDRN COC(=O)[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])c(C)cc2C)c2ccccc21 ZINC000421494165 942607314 /nfs/dbraw/zinc/60/73/14/942607314.db2.gz DVYMSGPWQSFKGU-HNNXBMFYSA-N 0 0 368.389 3.519 20 5 FHBDRN CSc1ccc(C(=O)N[C@@H]2CCCC[C@H]2OC(F)F)cc1[N+](=O)[O-] ZINC000501686170 942609756 /nfs/dbraw/zinc/60/97/56/942609756.db2.gz YCVCXKHJKNYSSE-ZYHUDNBSSA-N 0 0 360.382 3.597 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)N[C@@H]1C[C@H]1c1cccc(F)c1 ZINC000067333989 942614169 /nfs/dbraw/zinc/61/41/69/942614169.db2.gz QDXTYLNKGXGQEW-ZWKOTPCHSA-N 0 0 357.385 3.598 20 5 FHBDRN COc1cc(C(=O)N(C)[C@@H]2CCC[C@H]2C(C)(C)C)cc([N+](=O)[O-])c1OC ZINC000416292911 942617495 /nfs/dbraw/zinc/61/74/95/942617495.db2.gz QEWIDYKDDOCYII-ZIAGYGMSSA-N 0 0 364.442 3.899 20 5 FHBDRN CO[C@@H](c1ccccc1F)[C@H](C)NC(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC000421513410 942619293 /nfs/dbraw/zinc/61/92/93/942619293.db2.gz QADSCMCBWUOUJF-SCLBCKFNSA-N 0 0 360.385 3.857 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])c2cccnc12)N1CCC2(Cc3ccccc3C2)C1 ZINC000378343628 942620211 /nfs/dbraw/zinc/62/02/11/942620211.db2.gz URTRZODFGDIALZ-UHFFFAOYSA-N 0 0 373.412 3.774 20 5 FHBDRN C[C@@]1(O)CCCN(C(=O)c2ccc(Sc3ccc([N+](=O)[O-])cc3)cc2)C1 ZINC000501705886 942630316 /nfs/dbraw/zinc/63/03/16/942630316.db2.gz XRZMTLMCMMSOCP-LJQANCHMSA-N 0 0 372.446 3.733 20 5 FHBDRN CC1(C)C[C@H](NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)C(C)(C)O1 ZINC000183576752 942631874 /nfs/dbraw/zinc/63/18/74/942631874.db2.gz DDLXCEJSZIKMHL-INIZCTEOSA-N 0 0 361.442 3.615 20 5 FHBDRN COc1cc(OCC(=O)Nc2cccc3ccsc32)ccc1[N+](=O)[O-] ZINC000501721850 942633414 /nfs/dbraw/zinc/63/34/14/942633414.db2.gz WLLDCOIDFIBGTP-UHFFFAOYSA-N 0 0 358.375 3.836 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCC[C@@H]1CCCCO1 ZINC000505415841 942633557 /nfs/dbraw/zinc/63/35/57/942633557.db2.gz QWHKLSZCMGTEOP-AWEZNQCLSA-N 0 0 352.456 3.786 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N[C@@H](C)[C@H](c1ccccc1)[NH+](C)C ZINC000421526899 942637590 /nfs/dbraw/zinc/63/75/90/942637590.db2.gz XPFLPZBVZDGTBJ-HNAYVOBHSA-N 0 0 355.438 3.633 20 5 FHBDRN Cc1nn(C(C)(C)C)cc1[C@@H](C)NC(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC000421527831 942638472 /nfs/dbraw/zinc/63/84/72/942638472.db2.gz ZIFZPMCKVRWYGE-CYBMUJFWSA-N 0 0 358.442 3.963 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)Nc1cccc(NC(=O)N(C)C)c1C ZINC000421535541 942644396 /nfs/dbraw/zinc/64/43/96/942644396.db2.gz MSOSINATZYTFJO-UHFFFAOYSA-N 0 0 370.409 3.866 20 5 FHBDRN Cc1cnc(C2CCN(C(=O)c3cc([N+](=O)[O-])c(C)cc3C)CC2)s1 ZINC000421562929 942647912 /nfs/dbraw/zinc/64/79/12/942647912.db2.gz RGWZXHNSYFDONM-UHFFFAOYSA-N 0 0 359.451 3.996 20 5 FHBDRN O=[N+]([O-])c1cnccc1NCc1ccc(Cn2cnc3ccccc32)cc1 ZINC000066811263 942659437 /nfs/dbraw/zinc/65/94/37/942659437.db2.gz MSGHXXKFKDQMIP-UHFFFAOYSA-N 0 0 359.389 4.000 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)Nc1ncc(C2CCOCC2)s1 ZINC000421567251 942661207 /nfs/dbraw/zinc/66/12/07/942661207.db2.gz CNFLPNXFGKFVAE-UHFFFAOYSA-N 0 0 361.423 3.814 20 5 FHBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)N[C@H](c2ccccc2)C2CCC2)cc1 ZINC000104742839 942662037 /nfs/dbraw/zinc/66/20/37/942662037.db2.gz DJHQGQDVAZSGFF-GOSISDBHSA-N 0 0 360.435 3.556 20 5 FHBDRN COc1cc(NC(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)cc(OC)c1C ZINC000412354612 942662281 /nfs/dbraw/zinc/66/22/81/942662281.db2.gz BRCKHHLAOHEHGL-UHFFFAOYSA-N 0 0 374.393 3.960 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(N2CCC3(CC2)OCCc2ccccc23)n1 ZINC000413323960 942664302 /nfs/dbraw/zinc/66/43/02/942664302.db2.gz DLKJUPJBFAWIII-UHFFFAOYSA-N 0 0 353.422 3.675 20 5 FHBDRN O=[N+]([O-])c1cnc(N[C@@H]2CCO[C@@H](c3ccncc3)C2)c(C(F)(F)F)c1 ZINC000413325485 942665296 /nfs/dbraw/zinc/66/52/96/942665296.db2.gz VSONDPDGQAZWFD-BXUZGUMPSA-N 0 0 368.315 3.736 20 5 FHBDRN O=C(N[C@@H](CO)CC1CCCCC1)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000416329895 942668733 /nfs/dbraw/zinc/66/87/33/942668733.db2.gz CMRKOGWTQIKRQC-CYBMUJFWSA-N 0 0 374.359 3.675 20 5 FHBDRN O=C(NC[C@@H]1CC12CCSCC2)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000421593949 942675810 /nfs/dbraw/zinc/67/58/10/942675810.db2.gz XJDOLJDXTNGPOB-JTQLQIEISA-N 0 0 374.384 3.877 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)NCC2CCC(F)(F)CC2)c1 ZINC000501813489 942679553 /nfs/dbraw/zinc/67/95/53/942679553.db2.gz KZKIBHFLIVNUQZ-UHFFFAOYSA-N 0 0 356.369 3.614 20 5 FHBDRN CSC[C@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)C1 ZINC000412368300 942680460 /nfs/dbraw/zinc/68/04/60/942680460.db2.gz UWKIAQDARFMKCA-ZDUSSCGKSA-N 0 0 352.456 3.597 20 5 FHBDRN Cc1c(Nc2ncc([N+](=O)[O-])cc2C(F)(F)F)cnn1C1CCOCC1 ZINC000413333698 942683198 /nfs/dbraw/zinc/68/31/98/942683198.db2.gz RMTHBFBMCPTKRF-UHFFFAOYSA-N 0 0 371.319 3.609 20 5 FHBDRN O=C(NC[C@@H]1CC12CCSCC2)c1c([N+](=O)[O-])cccc1C(F)(F)F ZINC000421589216 942685871 /nfs/dbraw/zinc/68/58/71/942685871.db2.gz KTPAFHSBJZRACF-JTQLQIEISA-N 0 0 374.384 3.877 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CC12CCSCC2 ZINC000421591279 942687069 /nfs/dbraw/zinc/68/70/69/942687069.db2.gz PHPHEKXLWLGSLX-LBPRGKRZSA-N 0 0 366.508 3.970 20 5 FHBDRN Cc1ccc(Cc2noc(-c3ccc([N+](=O)[O-])c(OC(C)C)c3)n2)cn1 ZINC000420485159 942689530 /nfs/dbraw/zinc/68/95/30/942689530.db2.gz UQUKRMKIQQWJIB-UHFFFAOYSA-N 0 0 354.366 3.726 20 5 FHBDRN CCOc1ccc(-c2noc([C@@H]3C[C@H]3c3ccc([N+](=O)[O-])cc3)n2)cn1 ZINC000420485184 942689824 /nfs/dbraw/zinc/68/98/24/942689824.db2.gz UYXZLRUATSUKSN-LSDHHAIUSA-N 0 0 352.350 3.710 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N1CC=C(c2ccc(Cl)nc2)CC1 ZINC000378390172 942692472 /nfs/dbraw/zinc/69/24/72/942692472.db2.gz ATXDJWWORKLBAT-UHFFFAOYSA-N 0 0 373.796 3.581 20 5 FHBDRN Cc1cc(Cc2noc(-c3cc(COC(C)(C)C)on3)n2)ccc1[N+](=O)[O-] ZINC000420489149 942694849 /nfs/dbraw/zinc/69/48/49/942694849.db2.gz UVOWBACVVTXWRK-UHFFFAOYSA-N 0 0 372.381 3.847 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)NC[C@H]2CCC[C@@H]2C2CC2)cc1OC ZINC000413869117 942696305 /nfs/dbraw/zinc/69/63/05/942696305.db2.gz ACZRMXHOGOXTOS-ZIAGYGMSSA-N 0 0 362.426 3.558 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N(C)c1nc2ccccc2n1C ZINC000183620098 942698815 /nfs/dbraw/zinc/69/88/15/942698815.db2.gz KLBCLMVBQRJRSY-HNNXBMFYSA-N 0 0 366.421 3.713 20 5 FHBDRN Cc1cc(C)cc(NC(=S)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000006963039 942698845 /nfs/dbraw/zinc/69/88/45/942698845.db2.gz BZJSIEKQVTZCBN-UHFFFAOYSA-N 0 0 370.478 3.731 20 5 FHBDRN COc1c(C(=O)N2CCC[C@]2(C)Cc2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000421617910 942701830 /nfs/dbraw/zinc/70/18/30/942701830.db2.gz FIGIYDXBODZVCY-HXUWFJFHSA-N 0 0 372.396 3.980 20 5 FHBDRN CO[C@](C)(c1noc(-c2ccnc(-c3ccccc3)c2[N+](=O)[O-])n1)C1CC1 ZINC000420498238 942706396 /nfs/dbraw/zinc/70/63/96/942706396.db2.gz AJLVFVZXQQDNLJ-IBGZPJMESA-N 0 0 366.377 3.978 20 5 FHBDRN Cc1sc(C(=O)N2C[C@@H](C(=O)OC(C)(C)C)CC[C@@H]2C)cc1[N+](=O)[O-] ZINC000421634372 942712500 /nfs/dbraw/zinc/71/25/00/942712500.db2.gz PKTXUAHRYWIIIO-JQWIXIFHSA-N 0 0 368.455 3.547 20 5 FHBDRN Cc1ncccc1Cc1noc(C(C)(C)c2ccc([N+](=O)[O-])cc2F)n1 ZINC000420511462 942715752 /nfs/dbraw/zinc/71/57/52/942715752.db2.gz OKJWPGWYTQORGH-UHFFFAOYSA-N 0 0 356.357 3.737 20 5 FHBDRN Cc1cc(NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)cn2ccnc12 ZINC000502751584 942717450 /nfs/dbraw/zinc/71/74/50/942717450.db2.gz BBCSRDUJHQXPIT-UHFFFAOYSA-N 0 0 356.357 3.606 20 5 FHBDRN COCCO[C@@H]1CCCN(C(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000514073430 942718558 /nfs/dbraw/zinc/71/85/58/942718558.db2.gz WSPLGVBMWXUPKC-QGZVFWFLSA-N 0 0 364.445 3.656 20 5 FHBDRN O=C(C1CCN(c2ccccc2[N+](=O)[O-])CC1)N1CC[C@@H](C2CCCC2)C1 ZINC000421654228 942722276 /nfs/dbraw/zinc/72/22/76/942722276.db2.gz KKSSGBYCBDFRNT-GOSISDBHSA-N 0 0 371.481 3.850 20 5 FHBDRN CCC[C@H](NC(=O)[C@H](C)Oc1ccc([N+](=O)[O-])c(CO)c1)c1ccccc1 ZINC000431865392 942738817 /nfs/dbraw/zinc/73/88/17/942738817.db2.gz PVCPZUMWEYVQRB-KSSFIOAISA-N 0 0 372.421 3.512 20 5 FHBDRN Cc1ccc(-n2nc(C(=O)Nc3ccc([N+](=O)[O-])cc3)c3c2CCC3)cc1 ZINC000502778843 942739406 /nfs/dbraw/zinc/73/94/06/942739406.db2.gz RZNHKZGUUIRBPB-UHFFFAOYSA-N 0 0 362.389 3.830 20 5 FHBDRN CC[C@@H](C)COc1cc([N+](=O)[O-])c(Cn2c(C)csc2=O)cc1OC ZINC000514104507 942748494 /nfs/dbraw/zinc/74/84/94/942748494.db2.gz KOAMCFMTZLRJOT-LLVKDONJSA-N 0 0 366.439 3.608 20 5 FHBDRN O=C(Nc1ccncc1[N+](=O)[O-])N1CC=C(c2c[nH]c3ccccc32)CC1 ZINC000183628115 942749696 /nfs/dbraw/zinc/74/96/96/942749696.db2.gz BLERYCPHBKVNFS-UHFFFAOYSA-N 0 0 363.377 3.792 20 5 FHBDRN CCCNc1ccc(CNC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)cc1 ZINC000434552423 942750936 /nfs/dbraw/zinc/75/09/36/942750936.db2.gz TYVLPTNEAIDEHY-UHFFFAOYSA-N 0 0 352.394 3.828 20 5 FHBDRN Cc1cc(OCC(=O)N[C@@H](CC(F)F)c2ccccc2)ccc1[N+](=O)[O-] ZINC000421696691 942751683 /nfs/dbraw/zinc/75/16/83/942751683.db2.gz BRIOBSHTRVRNGM-HNNXBMFYSA-N 0 0 364.348 3.795 20 5 FHBDRN CCCNc1ccc(CNC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)cc1 ZINC000434555831 942753590 /nfs/dbraw/zinc/75/35/90/942753590.db2.gz XQZWSRYZBCDOAS-UHFFFAOYSA-N 0 0 352.394 3.828 20 5 FHBDRN O=C(NCc1csc(CCc2ccccc2)n1)c1ccc([N+](=O)[O-])cc1 ZINC000434557702 942754862 /nfs/dbraw/zinc/75/48/62/942754862.db2.gz QBNOYWBSNHIKPY-UHFFFAOYSA-N 0 0 367.430 3.767 20 5 FHBDRN CCCc1n[nH]c(C(=O)N2CC=C(c3ccc(Cl)cc3)CC2)c1[N+](=O)[O-] ZINC000434558571 942755529 /nfs/dbraw/zinc/75/55/29/942755529.db2.gz LCJLPRLIARSAOO-UHFFFAOYSA-N 0 0 374.828 3.853 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccc2c(c1)C(=O)CCCC2 ZINC000421717244 942769769 /nfs/dbraw/zinc/76/97/69/942769769.db2.gz XBFPKGTXXOEBJD-UHFFFAOYSA-N 0 0 354.362 3.765 20 5 FHBDRN O=[N+]([O-])c1ccccc1/C=C/CN1CCO[C@@H](c2ccc(F)c(F)c2)C1 ZINC000513756229 942771897 /nfs/dbraw/zinc/77/18/97/942771897.db2.gz XEADYCHPQWKUFD-MEDHRJKHSA-N 0 0 360.360 3.960 20 5 FHBDRN CC1(C)[C@H](c2ccccc2)CCN1C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000421720300 942776112 /nfs/dbraw/zinc/77/61/12/942776112.db2.gz BFYKVPBLJRWHFZ-INIZCTEOSA-N 0 0 364.405 3.879 20 5 FHBDRN O=C(c1ccc(OC(F)F)c([N+](=O)[O-])c1)N1CCC[C@H]2CCCC[C@@H]21 ZINC000514139450 942777576 /nfs/dbraw/zinc/77/75/76/942777576.db2.gz ALFHKRPRMQKHSG-YPMHNXCESA-N 0 0 354.353 3.991 20 5 FHBDRN O=C(c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)N1CC[C@@H]1C1CC1 ZINC000452503592 942782594 /nfs/dbraw/zinc/78/25/94/942782594.db2.gz SXWKVHYMUBPMSD-GOSISDBHSA-N 0 0 351.406 3.831 20 5 FHBDRN Cc1cc(NC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)cn2ccnc12 ZINC000502830119 942783244 /nfs/dbraw/zinc/78/32/44/942783244.db2.gz KPNOVWWXBOCROY-GFCCVEGCSA-N 0 0 356.407 3.670 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000421745113 942792330 /nfs/dbraw/zinc/79/23/30/942792330.db2.gz STZBKKQMYPULKH-GOSISDBHSA-N 0 0 358.369 3.564 20 5 FHBDRN CC[C@H](NCc1nc(-c2ccccc2OC)no1)c1cccc([N+](=O)[O-])c1 ZINC000378462095 942795041 /nfs/dbraw/zinc/79/50/41/942795041.db2.gz LNFGYNCSWJLBCH-INIZCTEOSA-N 0 0 368.393 3.894 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1C[C@H](C)O[C@@H](c2ccccc2)C1 ZINC000421749940 942796030 /nfs/dbraw/zinc/79/60/30/942796030.db2.gz SHLDMIFASLTKMZ-HNAYVOBHSA-N 0 0 354.406 3.814 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)Nc1ccccc1NC(=O)NC(C)C ZINC000421751330 942797172 /nfs/dbraw/zinc/79/71/72/942797172.db2.gz LZYXRPLCQLACPO-UHFFFAOYSA-N 0 0 370.409 3.994 20 5 FHBDRN Cc1csc([C@@H](NC(=O)NC[C@H](C)c2ccccc2[N+](=O)[O-])C2CC2)n1 ZINC000893244460 942808510 /nfs/dbraw/zinc/80/85/10/942808510.db2.gz OXEBJDTYKCIQRU-ZBEGNZNMSA-N 0 0 374.466 3.914 20 5 FHBDRN Cc1cc(C)n(-c2cccc(NC(=O)c3ccc([N+](=O)[O-])cc3C)c2)n1 ZINC000513758189 942813153 /nfs/dbraw/zinc/81/31/53/942813153.db2.gz YAWOTJUKSSMNDR-UHFFFAOYSA-N 0 0 350.378 3.958 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N(Cc1ccccc1)[C@H](CO)C1CC1 ZINC000421797782 942819228 /nfs/dbraw/zinc/81/92/28/942819228.db2.gz VLJOGFBGPCPTSE-HXUWFJFHSA-N 0 0 368.433 3.625 20 5 FHBDRN CS[C@@H]1CCC[C@@H](NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)C1 ZINC000514194799 942819850 /nfs/dbraw/zinc/81/98/50/942819850.db2.gz LZSYPCOWGKEATK-GHMZBOCLSA-N 0 0 360.382 3.600 20 5 FHBDRN O=C1C[C@@H](c2cccc(Nc3ccc(C(F)(F)F)cc3[N+](=O)[O-])c2)CN1 ZINC000514214992 942823302 /nfs/dbraw/zinc/82/33/02/942823302.db2.gz QBLSGADNQUOHCS-LLVKDONJSA-N 0 0 365.311 3.961 20 5 FHBDRN CCOc1ccc(NC(=O)CN2CCSc3ccccc32)c([N+](=O)[O-])c1 ZINC000016556290 942825899 /nfs/dbraw/zinc/82/58/99/942825899.db2.gz UDWSNJOJKMUEQD-UHFFFAOYSA-N 0 0 373.434 3.544 20 5 FHBDRN C[C@@H]1Cc2ccccc2CN1C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514220201 942827293 /nfs/dbraw/zinc/82/72/93/942827293.db2.gz YOGLISYMZIGVIH-LLVKDONJSA-N 0 0 362.332 3.783 20 5 FHBDRN CCOc1cc(CS(=O)(=O)Cc2c(C)cccc2C)ccc1[N+](=O)[O-] ZINC000434637179 942829183 /nfs/dbraw/zinc/82/91/83/942829183.db2.gz MCVCJYLARSYBCT-UHFFFAOYSA-N 0 0 363.435 3.725 20 5 FHBDRN O=C(N[C@H]1C[C@H]1c1cccc(F)c1)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000067333947 942839678 /nfs/dbraw/zinc/83/96/78/942839678.db2.gz NWSGGLWPGWZQEK-WMZOPIPTSA-N 0 0 369.396 3.620 20 5 FHBDRN Nc1cccc([N+](=O)[O-])c1C(=O)N1CC[C@](F)(c2cccc(Cl)c2)C1 ZINC000514229912 942840681 /nfs/dbraw/zinc/84/06/81/942840681.db2.gz UPGHLHXCNFAKGX-QGZVFWFLSA-N 0 0 363.776 3.541 20 5 FHBDRN O=C(N[C@H]1C[C@@H]1c1ccccc1C(F)(F)F)c1csc([N+](=O)[O-])c1 ZINC000505460317 942841793 /nfs/dbraw/zinc/84/17/93/942841793.db2.gz MNQUWRHDHLCTDL-PWSUYJOCSA-N 0 0 356.325 3.961 20 5 FHBDRN Cc1ccccc1[C@]1(F)CCN([C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000502905085 942845558 /nfs/dbraw/zinc/84/55/58/942845558.db2.gz CUXNPOZYDAPCAI-QRWLVFNGSA-N 0 0 371.412 3.801 20 5 FHBDRN COC(=O)c1cnc(NCc2cccc(COC(C)(C)C)c2)c([N+](=O)[O-])c1 ZINC000190171437 942848588 /nfs/dbraw/zinc/84/85/88/942848588.db2.gz LMPBDSZWIITAGC-UHFFFAOYSA-N 0 0 373.409 3.704 20 5 FHBDRN CCc1ccc(C(=O)N2CC3(CCC3)[C@H]2C2CCOCC2)cc1[N+](=O)[O-] ZINC000425128538 942848901 /nfs/dbraw/zinc/84/89/01/942848901.db2.gz ZKSZVVTWGRBAGB-GOSISDBHSA-N 0 0 358.438 3.579 20 5 FHBDRN CC(C)c1ccc(C(=O)N2CCC[C@H](Cc3nccn3C)C2)cc1[N+](=O)[O-] ZINC000190172864 942849329 /nfs/dbraw/zinc/84/93/29/942849329.db2.gz QFORFBVGZLTILP-OAHLLOKOSA-N 0 0 370.453 3.547 20 5 FHBDRN COc1ccc(OCC(=O)N[C@H](C)c2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000190180100 942854759 /nfs/dbraw/zinc/85/47/59/942854759.db2.gz LNKXGVRQCAQSNG-LLVKDONJSA-N 0 0 364.785 3.513 20 5 FHBDRN C[C@H]1C[C@@H](c2ccccc2)C[C@@H](NC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)C1 ZINC000413977959 942858285 /nfs/dbraw/zinc/85/82/85/942858285.db2.gz HYQWCWZBAIMENT-UAGQMJEPSA-N 0 0 370.453 3.615 20 5 FHBDRN Cc1ccc(C(=O)Nc2cccc(Cl)c2-n2cccn2)cc1[N+](=O)[O-] ZINC000502941663 942859839 /nfs/dbraw/zinc/85/98/39/942859839.db2.gz WYXCDMIYIZSOPN-UHFFFAOYSA-N 0 0 356.769 3.995 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)c1csc(Cc2cccc(F)c2)n1 ZINC000502949254 942864916 /nfs/dbraw/zinc/86/49/16/942864916.db2.gz GOEKHKWJMFWJFA-UHFFFAOYSA-N 0 0 371.393 3.711 20 5 FHBDRN CCOc1ccc(C(=O)Nc2ccc([C@@H](C)C(=O)OC)cc2)cc1[N+](=O)[O-] ZINC000413990608 942869203 /nfs/dbraw/zinc/86/92/03/942869203.db2.gz NIVIMUWANZBZIA-GFCCVEGCSA-N 0 0 372.377 3.522 20 5 FHBDRN O=[N+]([O-])c1cccc(NCc2cc3c(cc2Br)OCO3)c1 ZINC000035053493 942874286 /nfs/dbraw/zinc/87/42/86/942874286.db2.gz DLWPAPBXXPZNBU-UHFFFAOYSA-N 0 0 351.156 3.698 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N(Cc1ccccc1)CC1(CO)CC1 ZINC000421893908 942874804 /nfs/dbraw/zinc/87/48/04/942874804.db2.gz SXCIGJYPWVHZOT-UHFFFAOYSA-N 0 0 368.433 3.627 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N(C)[C@@H](CO)c1ccc(Cl)cc1 ZINC000421893679 942874971 /nfs/dbraw/zinc/87/49/71/942874971.db2.gz PFZAUOOGPPSLMC-KRWDZBQOSA-N 0 0 362.813 3.671 20 5 FHBDRN O=C(COc1ccccc1[N+](=O)[O-])Nc1ccnc(Oc2ccccc2)c1 ZINC000509985586 942880660 /nfs/dbraw/zinc/88/06/60/942880660.db2.gz MHJPJUPMMAXAKX-UHFFFAOYSA-N 0 0 365.345 3.800 20 5 FHBDRN O=C(NC[C@@H]1C[C@H]1c1ccccc1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000509985236 942880714 /nfs/dbraw/zinc/88/07/14/942880714.db2.gz XJXSHZXDCKHCDU-KBPBESRZSA-N 0 0 362.332 3.730 20 5 FHBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])NC[C@@H]1C[C@H]1c1ccccc1 ZINC000509985452 942880989 /nfs/dbraw/zinc/88/09/89/942880989.db2.gz LRLRPRMAZSZCSI-HOCLYGCPSA-N 0 0 374.824 3.937 20 5 FHBDRN Cc1c(CNS(=O)(=O)c2csc3ccccc32)cccc1[N+](=O)[O-] ZINC000509987048 942882824 /nfs/dbraw/zinc/88/28/24/942882824.db2.gz OHDSYEODYRKJGI-UHFFFAOYSA-N 0 0 362.432 3.596 20 5 FHBDRN Cc1cc(C(=O)Nc2ccc([N+](=O)[O-])c(C)n2)ccc1NC(=O)CC(C)C ZINC000133619117 942885998 /nfs/dbraw/zinc/88/59/98/942885998.db2.gz RTVLTOHFMLXXFI-UHFFFAOYSA-N 0 0 370.409 3.844 20 5 FHBDRN Cc1cc(C)cc([C@H]2CCN(S(=O)(=O)Cc3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000544113022 942899840 /nfs/dbraw/zinc/89/98/40/942899840.db2.gz UJFCVBTWTPNVPR-KRWDZBQOSA-N 0 0 374.462 3.531 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)Nc1cccc2c1OCC[C@H]2O ZINC000183838752 942908329 /nfs/dbraw/zinc/90/83/29/942908329.db2.gz UIHAVAKIUWPXRU-CQSZACIVSA-N 0 0 363.757 3.708 20 5 FHBDRN O=C(c1c[nH]c2cccc([N+](=O)[O-])c12)N1CCC[C@H](CC(F)(F)F)C1 ZINC000421977959 942914619 /nfs/dbraw/zinc/91/46/19/942914619.db2.gz YFVSSYVUEAELBT-SNVBAGLBSA-N 0 0 355.316 3.881 20 5 FHBDRN O=C(N[C@@H]1C[C@@H]1c1ccccc1C(F)(F)F)c1ccccc1[N+](=O)[O-] ZINC000505501040 942916338 /nfs/dbraw/zinc/91/63/38/942916338.db2.gz YUTFQHCAXYBEIV-TZMCWYRMSA-N 0 0 350.296 3.900 20 5 FHBDRN Cc1c(C(=O)N2CCC(C(=O)c3cccs3)CC2)cccc1[N+](=O)[O-] ZINC000365803384 942917316 /nfs/dbraw/zinc/91/73/16/942917316.db2.gz FPWQCXPXJNLCCH-UHFFFAOYSA-N 0 0 358.419 3.700 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@H](CC)O[C@@H](CC)C1 ZINC000421987781 942921326 /nfs/dbraw/zinc/92/13/26/942921326.db2.gz ULBJVLACBFAPNE-KBPBESRZSA-N 0 0 352.456 3.736 20 5 FHBDRN O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)N1CCC[C@H](CC(F)(F)F)C1 ZINC000421966149 942922599 /nfs/dbraw/zinc/92/25/99/942922599.db2.gz OWVNVAIXQYCPEJ-SECBINFHSA-N 0 0 366.286 3.607 20 5 FHBDRN CC(C)Cn1cnnc1[C@H]1CCCN1c1ccc([N+](=O)[O-])c2cnccc21 ZINC000078021993 942923224 /nfs/dbraw/zinc/92/32/24/942923224.db2.gz ORZLEVZASJQZAL-GOSISDBHSA-N 0 0 366.425 3.732 20 5 FHBDRN Cc1cc(OCC(=O)N(Cc2ccc(F)cc2)C2CC2)ccc1[N+](=O)[O-] ZINC000430114872 942928548 /nfs/dbraw/zinc/92/85/48/942928548.db2.gz FDMTTZWRYODTQZ-UHFFFAOYSA-N 0 0 358.369 3.612 20 5 FHBDRN COc1cc(CSc2nc(C)nc(C)c2C(C)=O)c([N+](=O)[O-])cc1F ZINC000183848436 942928598 /nfs/dbraw/zinc/92/85/98/942928598.db2.gz JLPYNGCKEJJSTP-UHFFFAOYSA-N 0 0 365.386 3.644 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)N[C@H](CCO)c2ccccc2)cc1[N+](=O)[O-] ZINC000434742109 942934210 /nfs/dbraw/zinc/93/42/10/942934210.db2.gz MNDCLRYGDWJPKI-QGZVFWFLSA-N 0 0 356.422 3.746 20 5 FHBDRN Cc1cc(=O)n(Cc2c(Cl)cccc2[N+](=O)[O-])cc1Br ZINC000434751808 942943531 /nfs/dbraw/zinc/94/35/31/942943531.db2.gz IWUUGFKVILHOPW-UHFFFAOYSA-N 0 0 357.591 3.529 20 5 FHBDRN O=C1CCOc2c(NCc3coc(-c4ccc([N+](=O)[O-])cc4)n3)cccc21 ZINC000378602595 942947649 /nfs/dbraw/zinc/94/76/49/942947649.db2.gz XTJGJNNYMXXETO-UHFFFAOYSA-N 0 0 365.345 3.827 20 5 FHBDRN O=C(CCc1ncc(-c2ccccc2)o1)Nc1ccc(F)c([N+](=O)[O-])c1 ZINC000014266676 942956524 /nfs/dbraw/zinc/95/65/24/942956524.db2.gz BRVJBYBKFMEAAG-UHFFFAOYSA-N 0 0 355.325 3.960 20 5 FHBDRN CCN(C(=O)c1ccc(Cl)cc1[N+](=O)[O-])c1ccc(OC)c(OC)c1 ZINC000505520793 942961819 /nfs/dbraw/zinc/96/18/19/942961819.db2.gz MRRBIFKKCBYULT-UHFFFAOYSA-N 0 0 364.785 3.932 20 5 FHBDRN Cc1c(CNC(=O)c2cccc(F)c2OC(F)(F)F)cccc1[N+](=O)[O-] ZINC001269216643 942962588 /nfs/dbraw/zinc/96/25/88/942962588.db2.gz YSNNAKYKFBIUMQ-UHFFFAOYSA-N 0 0 372.274 3.871 20 5 FHBDRN Cc1nnc(SCc2nc3cc([N+](=O)[O-])ccc3o2)n1-c1ccccc1 ZINC000434794632 942972576 /nfs/dbraw/zinc/97/25/76/942972576.db2.gz FWFMQYUKAIIWDG-UHFFFAOYSA-N 0 0 367.390 3.917 20 5 FHBDRN NC(=O)c1ccc(NCCCCOc2ccc(Cl)cc2)c([N+](=O)[O-])c1 ZINC000014275755 942972738 /nfs/dbraw/zinc/97/27/38/942972738.db2.gz IGFFYOFHSPDDFP-UHFFFAOYSA-N 0 0 363.801 3.618 20 5 FHBDRN CCOC(=O)c1oc2ccccc2c1COc1ccc([N+](=O)[O-])cc1C=O ZINC000016655375 943000283 /nfs/dbraw/zinc/00/02/83/943000283.db2.gz UZFOVGSLAXTHRN-UHFFFAOYSA-N 0 0 369.329 3.909 20 5 FHBDRN O=C(NC[C@@H]1COc2ccccc2O1)c1cc2ccccc2c2cccnc12 ZINC000514420514 943003465 /nfs/dbraw/zinc/00/34/65/943003465.db2.gz DWKXBKHFZNPOLZ-MRXNPFEDSA-N 0 0 370.408 3.958 20 5 FHBDRN Cc1cc(NC(=O)c2cnc(C)nc2C(C)C)c2cc([N+](=O)[O-])ccc2n1 ZINC000183684140 943004421 /nfs/dbraw/zinc/00/44/21/943004421.db2.gz OLBZMBSCTGUOQN-UHFFFAOYSA-N 0 0 365.393 3.926 20 5 FHBDRN O=C(NCCCO[C@H]1CCCc2ccccc21)c1csc([N+](=O)[O-])c1 ZINC000505556422 943014211 /nfs/dbraw/zinc/01/42/11/943014211.db2.gz YTCYYFRCPJGKRK-INIZCTEOSA-N 0 0 360.435 3.870 20 5 FHBDRN Cc1cc(NC(=O)c2ccccc2[N+](=O)[O-])cnc1N1CCCC[C@H]1C ZINC000503165671 943029294 /nfs/dbraw/zinc/02/92/94/943029294.db2.gz RGHRZIFMFVGIJG-CQSZACIVSA-N 0 0 354.410 3.929 20 5 FHBDRN C[C@@H](NS(=O)(=O)CCc1ccccc1[N+](=O)[O-])c1ccc(C2CC2)cc1 ZINC000416672382 943035152 /nfs/dbraw/zinc/03/51/52/943035152.db2.gz YPASYZQWOSYJNE-CQSZACIVSA-N 0 0 374.462 3.695 20 5 FHBDRN C[C@@H]1c2ccccc2CCN1c1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-] ZINC000425238389 943041570 /nfs/dbraw/zinc/04/15/70/943041570.db2.gz UWPAOFFBPZRHQB-CYBMUJFWSA-N 0 0 351.406 3.611 20 5 FHBDRN COC(=O)c1cc([N+](=O)[O-])cn(Cc2ccc(C3CCCCC3)cc2)c1=O ZINC000505564943 943045674 /nfs/dbraw/zinc/04/56/74/943045674.db2.gz REMPJFXHJPLWOP-UHFFFAOYSA-N 0 0 370.405 3.639 20 5 FHBDRN CCCCCN(C(=O)COc1ccc([N+](=O)[O-])c2cccnc12)C(C)C ZINC000434921512 943047577 /nfs/dbraw/zinc/04/75/77/943047577.db2.gz JIYGNOAYQTZUPG-UHFFFAOYSA-N 0 0 359.426 3.949 20 5 FHBDRN O=C(c1cnc(Cl)cc1C(F)(F)F)N1CCc2c1cccc2[N+](=O)[O-] ZINC001126431039 943067831 /nfs/dbraw/zinc/06/78/31/943067831.db2.gz WJHFGXKQBIGZTK-UHFFFAOYSA-N 0 0 371.702 3.865 20 5 FHBDRN CCN(CCNC(=O)Nc1cccc([N+](=O)[O-])c1C)c1cccc(C)c1 ZINC000514506333 943068666 /nfs/dbraw/zinc/06/86/66/943068666.db2.gz YQOIFGDJKBUEIH-UHFFFAOYSA-N 0 0 356.426 3.860 20 5 FHBDRN COCCCOc1cc(C)ccc1CNc1ncc(Cl)cc1[N+](=O)[O-] ZINC000434958627 943073094 /nfs/dbraw/zinc/07/30/94/943073094.db2.gz OGFMUFGGVMAUIS-UHFFFAOYSA-N 0 0 365.817 3.979 20 5 FHBDRN CC(C)c1[nH]nc(C(=O)Nc2ccc(F)c(C(F)(F)F)c2)c1[N+](=O)[O-] ZINC000434189844 943076902 /nfs/dbraw/zinc/07/69/02/943076902.db2.gz FRVBOJBGIGNNHV-UHFFFAOYSA-N 0 0 360.267 3.852 20 5 FHBDRN O=C(COc1c(Cl)cccc1Cl)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000514520484 943078557 /nfs/dbraw/zinc/07/85/57/943078557.db2.gz FRWJKLGGPVHJAS-UHFFFAOYSA-N 0 0 367.188 3.870 20 5 FHBDRN O=C(Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1)Nc1ccc(F)c(Cl)c1 ZINC000505582005 943080330 /nfs/dbraw/zinc/08/03/30/943080330.db2.gz NTGWJXVQWGMWEG-UHFFFAOYSA-N 0 0 374.759 3.890 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)Cc1c[nH]c2cccc(Cl)c12 ZINC000431900995 943081986 /nfs/dbraw/zinc/08/19/86/943081986.db2.gz HXHDPKHGTMPWLH-UHFFFAOYSA-N 0 0 357.797 3.931 20 5 FHBDRN C[C@@H]1CCCN(c2ccc(C(=O)NCc3cccc(F)c3)cc2[N+](=O)[O-])C1 ZINC000514532439 943089267 /nfs/dbraw/zinc/08/92/67/943089267.db2.gz WENVMUZNBVDFPT-CQSZACIVSA-N 0 0 371.412 3.900 20 5 FHBDRN C[C@@H](NC(=O)c1ccccc1[N+](=O)[O-])c1nc2ccccc2n1C(F)F ZINC000014368177 943089634 /nfs/dbraw/zinc/08/96/34/943089634.db2.gz JNMOVLMOQPTJMH-SNVBAGLBSA-N 0 0 360.320 3.831 20 5 FHBDRN CCOC(=O)c1cc(N2CC[C@H](COc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000503286560 943104943 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FHBDRN Cc1nc(C(F)(F)F)ccc1C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000183756491 943123914 /nfs/dbraw/zinc/12/39/14/943123914.db2.gz KJWUILYTPSGITI-UHFFFAOYSA-N 0 0 373.718 3.900 20 5 FHBDRN O=C(CSc1nncn1-c1cccc(Cl)c1)c1ccc([N+](=O)[O-])cc1 ZINC000514586595 943127564 /nfs/dbraw/zinc/12/75/64/943127564.db2.gz VXXISRXKVLPUEH-UHFFFAOYSA-N 0 0 374.809 3.804 20 5 FHBDRN CCCN(C)c1nnc(-c2cccc([N+](=O)[O-])c2)n1Cc1ccccc1 ZINC000514588478 943128551 /nfs/dbraw/zinc/12/85/51/943128551.db2.gz GYXAGSXPVJBQAW-UHFFFAOYSA-N 0 0 351.410 3.748 20 5 FHBDRN Cc1c(NC(=O)CN[C@@H](c2ccccc2)C(F)(F)F)cccc1[N+](=O)[O-] ZINC000126382393 943137488 /nfs/dbraw/zinc/13/74/88/943137488.db2.gz GKAGDSLHEVZNFA-INIZCTEOSA-N 0 0 367.327 3.735 20 5 FHBDRN CC(C)c1ncc(Cl)c(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)n1 ZINC000183767191 943137838 /nfs/dbraw/zinc/13/78/38/943137838.db2.gz CUFUKEXOHMITOZ-UHFFFAOYSA-N 0 0 369.208 3.745 20 5 FHBDRN CC(C)CN(CC(C)C)C(=O)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000505597513 943146779 /nfs/dbraw/zinc/14/67/79/943146779.db2.gz RJFBNBYRHSDTEJ-UHFFFAOYSA-N 0 0 358.442 3.599 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OC[C@@H](O)CO[C@H]2CCCc3ccccc32)c1 ZINC000514616787 943152704 /nfs/dbraw/zinc/15/27/04/943152704.db2.gz GQPIOFIENCSALJ-LPHOPBHVSA-N 0 0 357.406 3.737 20 5 FHBDRN Cc1ccc(C(=O)NCc2sccc2Br)cc1[N+](=O)[O-] ZINC000058765911 943156181 /nfs/dbraw/zinc/15/61/81/943156181.db2.gz FHFOIBHPZXUEST-UHFFFAOYSA-N 0 0 355.213 3.657 20 5 FHBDRN Cc1nc(CC2CC2)oc1-c1nc(Cc2cccc([N+](=O)[O-])c2C)no1 ZINC000514632570 943163340 /nfs/dbraw/zinc/16/33/40/943163340.db2.gz QVIQZUQMLHICAN-UHFFFAOYSA-N 0 0 354.366 3.793 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](CO)c1ccsc1 ZINC000505609398 943166872 /nfs/dbraw/zinc/16/68/72/943166872.db2.gz PBLUFIZRXAPUPQ-CQSZACIVSA-N 0 0 366.464 3.622 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCC1(C)CCOCC1 ZINC000503416552 943173996 /nfs/dbraw/zinc/17/39/96/943173996.db2.gz BUYRKPISVMIKFD-UHFFFAOYSA-N 0 0 352.456 3.643 20 5 FHBDRN CCOc1cc(N2CC[C@@H](O)[C@H]2c2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000425280416 943176427 /nfs/dbraw/zinc/17/64/27/943176427.db2.gz KDEQGRDARQYICW-SJLPKXTDSA-N 0 0 362.813 3.959 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1nnc2cc(C)ccn21 ZINC000503429039 943178107 /nfs/dbraw/zinc/17/81/07/943178107.db2.gz MYDAFYZSLZUGJO-UHFFFAOYSA-N 0 0 371.422 3.700 20 5 FHBDRN Cc1ccoc1CN(C)C(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000584582412 943183506 /nfs/dbraw/zinc/18/35/06/943183506.db2.gz LNVJMCAITGCQMG-UHFFFAOYSA-N 0 0 372.299 3.710 20 5 FHBDRN CCN(CC)c1ncc(CNCc2ccc([N+](=O)[O-])cc2Cl)s1 ZINC000183799396 943185852 /nfs/dbraw/zinc/18/58/52/943185852.db2.gz WUCNJPITAYXZLE-UHFFFAOYSA-N 0 0 354.863 3.841 20 5 FHBDRN CC(C)N(c1ccc(F)cc1)S(=O)(=O)CCc1ccc([N+](=O)[O-])cc1 ZINC000503428071 943188170 /nfs/dbraw/zinc/18/81/70/943188170.db2.gz CBJANFKXDWETLP-UHFFFAOYSA-N 0 0 366.414 3.521 20 5 FHBDRN CCN(c1cc(C)cc(C)c1)S(=O)(=O)CCc1ccc([N+](=O)[O-])cc1 ZINC000503450488 943188386 /nfs/dbraw/zinc/18/83/86/943188386.db2.gz XKBFVJYHKXWMRY-UHFFFAOYSA-N 0 0 362.451 3.610 20 5 FHBDRN O=C(NCc1ccnc(OC2CCCCC2)c1)c1ccc([N+](=O)[O-])cc1F ZINC000503451071 943188580 /nfs/dbraw/zinc/18/85/80/943188580.db2.gz VSMHAZBAALCZKJ-UHFFFAOYSA-N 0 0 373.384 3.770 20 5 FHBDRN COc1cc(C(=O)NCc2ccc(Cl)cc2Cl)ccc1[N+](=O)[O-] ZINC000511588059 943210999 /nfs/dbraw/zinc/21/09/99/943210999.db2.gz WYZIJLVDLDGBMQ-UHFFFAOYSA-N 0 0 355.177 3.840 20 5 FHBDRN COc1cc(-c2nc(-c3cnc4ccc(C)cn43)no2)cc([N+](=O)[O-])c1C ZINC000514690760 943224500 /nfs/dbraw/zinc/22/45/00/943224500.db2.gz IWJAYAPWSCKAQM-UHFFFAOYSA-N 0 0 365.349 3.585 20 5 FHBDRN COc1cccc(CN(C)Cc2cc([N+](=O)[O-])ccc2OC(F)F)c1 ZINC000505627969 943237090 /nfs/dbraw/zinc/23/70/90/943237090.db2.gz BWAMBCNQFQLCOI-UHFFFAOYSA-N 0 0 352.337 3.837 20 5 FHBDRN CC1(C)CCC[C@@H](NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3F)n2)C1 ZINC001269388830 943249313 /nfs/dbraw/zinc/24/93/13/943249313.db2.gz ARFBDCUFTSQWIQ-GFCCVEGCSA-N 0 0 360.389 3.618 20 5 FHBDRN O=C(N[C@@H]1CCC[C@@H](c2nc3ccccc3[nH]2)C1)c1ccc([N+](=O)[O-])o1 ZINC000514728436 943256802 /nfs/dbraw/zinc/25/68/02/943256802.db2.gz VELDNIINOKAQJW-VXGBXAGGSA-N 0 0 354.366 3.520 20 5 FHBDRN O=C(NCC[C@@H]1CCOC1)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000541447177 943272607 /nfs/dbraw/zinc/27/26/07/943272607.db2.gz QWAHDCYKTGRMQL-CQSZACIVSA-N 0 0 371.393 3.935 20 5 FHBDRN COc1cccc([C@@H]2C[C@H]2CNC(=O)Nc2ccc([N+](=O)[O-])cc2OC)c1 ZINC000417000786 943283631 /nfs/dbraw/zinc/28/36/31/943283631.db2.gz RXZMFWQIQILMHD-BBRMVZONSA-N 0 0 371.393 3.537 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CCC[C@H](Oc2ccccc2)C1 ZINC000416998585 943289197 /nfs/dbraw/zinc/28/91/97/943289197.db2.gz PRJZEARWHKXQTB-KRWDZBQOSA-N 0 0 355.394 3.979 20 5 FHBDRN Cc1c(NC(=O)N2CCCCCO2)cc(Br)cc1[N+](=O)[O-] ZINC000514794072 943295708 /nfs/dbraw/zinc/29/57/08/943295708.db2.gz XLMPISPBLWYZCV-UHFFFAOYSA-N 0 0 358.192 3.615 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC(C)(C)[C@H]1C ZINC000503616743 943302671 /nfs/dbraw/zinc/30/26/71/943302671.db2.gz IJLVFBCEYXAOOL-GFCCVEGCSA-N 0 0 352.456 3.736 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCCc1csc(C)n1 ZINC000503638101 943304266 /nfs/dbraw/zinc/30/42/66/943304266.db2.gz RJOKNWUAJSRREK-UHFFFAOYSA-N 0 0 365.480 3.834 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N1CC[C@@H](COc2ccccc2)C1 ZINC000505655546 943319034 /nfs/dbraw/zinc/31/90/34/943319034.db2.gz DDRDIJUEOQJHIQ-CQSZACIVSA-N 0 0 374.824 3.718 20 5 FHBDRN C[C@@H](c1ccccc1Br)N(C)C(=O)c1ccc([N+](=O)[O-])n1C ZINC000503654680 943323393 /nfs/dbraw/zinc/32/33/93/943323393.db2.gz MNGGAHWZJWVXSK-JTQLQIEISA-N 0 0 366.215 3.529 20 5 FHBDRN CCCCOCCNC(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000435326472 943325669 /nfs/dbraw/zinc/32/56/69/943325669.db2.gz DARMHCKNKAMUKY-UHFFFAOYSA-N 0 0 374.235 3.604 20 5 FHBDRN COC(=O)[C@@H](C)c1cccc(NCc2cc(OC)c(F)cc2[N+](=O)[O-])c1 ZINC000417075698 943328924 /nfs/dbraw/zinc/32/89/24/943328924.db2.gz KWKFKAMVQMFEFO-NSHDSACASA-N 0 0 362.357 3.631 20 5 FHBDRN CSCCCNC(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000435330407 943333714 /nfs/dbraw/zinc/33/37/14/943333714.db2.gz SLYRUFOPJSHRLV-UHFFFAOYSA-N 0 0 362.249 3.540 20 5 FHBDRN Cc1c(NC(=O)N[C@@H]2C[C@H]2C2CC2)cc(Br)cc1[N+](=O)[O-] ZINC000435329855 943334720 /nfs/dbraw/zinc/33/47/20/943334720.db2.gz QYAHKZAVUXKJCF-CMPLNLGQSA-N 0 0 354.204 3.586 20 5 FHBDRN CCCOc1ccc2c(c1)CCN(C(=O)c1cc([N+](=O)[O-])ccc1C)C2 ZINC000435390889 943378681 /nfs/dbraw/zinc/37/86/81/943378681.db2.gz QQRGJFGNRZOONE-UHFFFAOYSA-N 0 0 354.406 3.891 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N1CC2(CCOCC2)[C@H]1C(C)C ZINC000417150153 943382579 /nfs/dbraw/zinc/38/25/79/943382579.db2.gz JSMXVOSPECQJML-QGZVFWFLSA-N 0 0 361.442 3.826 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)c1ccc(OCC(F)(F)F)cc1 ZINC000053218277 943385786 /nfs/dbraw/zinc/38/57/86/943385786.db2.gz ZLRNQZGQHCMRSF-UHFFFAOYSA-N 0 0 368.311 3.508 20 5 FHBDRN Cc1cc(S(=O)(=O)N2CCC[C@H]2/C=C/c2ccccc2)ccc1[N+](=O)[O-] ZINC000503855796 943386354 /nfs/dbraw/zinc/38/63/54/943386354.db2.gz NTJWIWDAPIWYAK-FVNWOWOISA-N 0 0 372.446 3.770 20 5 FHBDRN O=C(NC[C@H]1CCC[C@H]1C1CC1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000412460063 943399356 /nfs/dbraw/zinc/39/93/56/943399356.db2.gz GKZRUMMRBCNYGD-MSOLQXFVSA-N 0 0 371.481 3.754 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)NC[C@H]2CCC[C@H]2C2CC2)cc1SC ZINC000412460167 943399541 /nfs/dbraw/zinc/39/95/41/943399541.db2.gz FINJEXFUUNRPHN-OLZOCXBDSA-N 0 0 364.467 3.881 20 5 FHBDRN COc1cc(C(=O)NCCc2c(Cl)cccc2Cl)ccc1[N+](=O)[O-] ZINC000511609682 943419865 /nfs/dbraw/zinc/41/98/65/943419865.db2.gz KXFIVUMVOCNJEQ-UHFFFAOYSA-N 0 0 369.204 3.883 20 5 FHBDRN CCC(=O)c1ccc(NCc2ccc(C[S@](C)=O)cc2)c([N+](=O)[O-])c1 ZINC000514958191 943422288 /nfs/dbraw/zinc/42/22/88/943422288.db2.gz UZEXXZNNGSUVNS-VWLOTQADSA-N 0 0 360.435 3.678 20 5 FHBDRN CCn1c(=O)c2sccc2nc1SCCc1ccc([N+](=O)[O-])cc1 ZINC000042156355 943426460 /nfs/dbraw/zinc/42/64/60/943426460.db2.gz OXPNWOANPLXAFQ-UHFFFAOYSA-N 0 0 361.448 3.721 20 5 FHBDRN CCCNc1ccc(CNC(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)cc1 ZINC000434212538 943438012 /nfs/dbraw/zinc/43/80/12/943438012.db2.gz VJGBVALNLYORJG-UHFFFAOYSA-N 0 0 358.398 3.747 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N(C)c1ccc(Cl)cc1F ZINC000435486834 943442893 /nfs/dbraw/zinc/44/28/93/943442893.db2.gz LHYVNFPUUXWJPK-UHFFFAOYSA-N 0 0 372.805 3.829 20 5 FHBDRN CSC[C@@H]1CCCN1C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000541466254 943444823 /nfs/dbraw/zinc/44/48/23/943444823.db2.gz NUCOGXLLGSNSRT-NSHDSACASA-N 0 0 360.888 3.694 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)N1CCC[C@H]1/C=C\c1ccccc1 ZINC000504007602 943454867 /nfs/dbraw/zinc/45/48/67/943454867.db2.gz GFKBXNZIZAOTLD-YFWYWMRJSA-N 0 0 351.406 3.982 20 5 FHBDRN CCOC(=O)c1ccnc(N2CCC(C)(c3ccccc3)CC2)c1[N+](=O)[O-] ZINC000511614427 943460017 /nfs/dbraw/zinc/46/00/17/943460017.db2.gz ZWMWRMMNBZRVMQ-UHFFFAOYSA-N 0 0 369.421 3.725 20 5 FHBDRN CCOc1cc2c(cc1NC(=O)c1cccc(OC)c1[N+](=O)[O-])O[C@@H](C)C2 ZINC000435519527 943463445 /nfs/dbraw/zinc/46/34/45/943463445.db2.gz MAUZVQSPSTVIJR-NSHDSACASA-N 0 0 372.377 3.578 20 5 FHBDRN COCCCCN(Cc1ccccc1)C(=O)c1cccc(OC)c1[N+](=O)[O-] ZINC000435520619 943463513 /nfs/dbraw/zinc/46/35/13/943463513.db2.gz SFZDISIVMKBDLV-UHFFFAOYSA-N 0 0 372.421 3.672 20 5 FHBDRN CNc1ccc(C(=O)N[C@H]2C[C@H](c3cccc(Cl)c3)C2)cc1[N+](=O)[O-] ZINC000515032700 943463623 /nfs/dbraw/zinc/46/36/23/943463623.db2.gz OFKKDOKQEVYRFK-CTYIDZIISA-N 0 0 359.813 3.966 20 5 FHBDRN O=C(NC[C@H]1CCC[C@@H]1C1CC1)c1sc(Br)cc1[N+](=O)[O-] ZINC000412473365 943464968 /nfs/dbraw/zinc/46/49/68/943464968.db2.gz KDJKUDLTQABTHX-NXEZZACHSA-N 0 0 373.272 3.975 20 5 FHBDRN O=C(NC[C@@H]1CCC[C@H]1C1CC1)c1sc(Br)cc1[N+](=O)[O-] ZINC000412473366 943466307 /nfs/dbraw/zinc/46/63/07/943466307.db2.gz KDJKUDLTQABTHX-UWVGGRQHSA-N 0 0 373.272 3.975 20 5 FHBDRN COc1cccc([C@@H]2C[C@@H](C)CN2CC(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000544118556 943473830 /nfs/dbraw/zinc/47/38/30/943473830.db2.gz YBKQFBGBJXCCEM-KUHUBIRLSA-N 0 0 369.421 3.625 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])NC1(c2cccc(C(F)(F)F)c2)CC1 ZINC000515048654 943473858 /nfs/dbraw/zinc/47/38/58/943473858.db2.gz MSEVAJIZNAKOJC-UHFFFAOYSA-N 0 0 364.323 3.962 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000123000609 943474754 /nfs/dbraw/zinc/47/47/54/943474754.db2.gz PWZFLLOOQODWBH-NSHDSACASA-N 0 0 374.353 3.703 20 5 FHBDRN CCOC(=O)c1cc(C(=O)N2CC[C@H](C)[C@H]3CCCC[C@@H]32)cc([N+](=O)[O-])c1 ZINC000515058553 943479865 /nfs/dbraw/zinc/47/98/65/943479865.db2.gz QQEXPQFYQULVGF-VHSSKADRSA-N 0 0 374.437 3.812 20 5 FHBDRN CCOCCCn1c(-c2cccc([N+](=O)[O-])c2)nnc1N1CCC(C)(C)C1 ZINC000515075548 943485768 /nfs/dbraw/zinc/48/57/68/943485768.db2.gz RMMSEILMVQBURJ-UHFFFAOYSA-N 0 0 373.457 3.516 20 5 FHBDRN Cn1cc([N+](=O)[O-])c(C(=O)Nc2c(F)cc(F)cc2-c2ccccc2)n1 ZINC000504091450 943496790 /nfs/dbraw/zinc/49/67/90/943496790.db2.gz RQVLIRYJCSLYAS-UHFFFAOYSA-N 0 0 358.304 3.526 20 5 FHBDRN O=[N+]([O-])c1c(N[C@H]2C[C@H](c3cc(F)cc(F)c3)C2)nc2sccn21 ZINC000435582601 943501214 /nfs/dbraw/zinc/50/12/14/943501214.db2.gz FHWRAUYXYYLYEU-OTCDBFHCSA-N 0 0 350.350 3.940 20 5 FHBDRN NC(=O)c1ccc(N[C@@H]2C[C@H]2c2ccc(Cl)cc2Cl)c([N+](=O)[O-])c1 ZINC000435577102 943510667 /nfs/dbraw/zinc/51/06/67/943510667.db2.gz YFEHJLMRQGUBJK-SMDDNHRTSA-N 0 0 366.204 3.969 20 5 FHBDRN O=C(c1ccc(Cl)cc1[N+](=O)[O-])N1CC[C@@H](COc2ccccc2)C1 ZINC000504141982 943512423 /nfs/dbraw/zinc/51/24/23/943512423.db2.gz RRUANWAKJPJHAT-CYBMUJFWSA-N 0 0 360.797 3.789 20 5 FHBDRN CC(C)(C)c1cccc(OCCNC(=O)c2ccc([N+](=O)[O-])cc2F)c1 ZINC000504141990 943512528 /nfs/dbraw/zinc/51/25/28/943512528.db2.gz RSOPQNIUMKFGMC-UHFFFAOYSA-N 0 0 360.385 3.840 20 5 FHBDRN Cc1cc(F)cc2c1CN(C(=O)c1c[nH]c3cc([N+](=O)[O-])ccc31)CC2 ZINC000504153184 943522759 /nfs/dbraw/zinc/52/27/59/943522759.db2.gz DVZQDUXVENUAHW-UHFFFAOYSA-N 0 0 353.353 3.722 20 5 FHBDRN C[C@H](NC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1)c1ccc2n[nH]cc2c1 ZINC000511618625 943524546 /nfs/dbraw/zinc/52/45/46/943524546.db2.gz RSHOGYZSCZHRTD-LBPRGKRZSA-N 0 0 367.409 3.767 20 5 FHBDRN CC(C)(C)Oc1cccc(CNC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)n1 ZINC000504181861 943530479 /nfs/dbraw/zinc/53/04/79/943530479.db2.gz MZPBXVMBOBYBRX-UHFFFAOYSA-N 0 0 368.393 3.578 20 5 FHBDRN C[C@@H](NC(=O)c1cc2cc([N+](=O)[O-])ccc2o1)c1ccc2c(c1)OCO2 ZINC000515172409 943547913 /nfs/dbraw/zinc/54/79/13/943547913.db2.gz DLYOZSJWQRZASM-SNVBAGLBSA-N 0 0 354.318 3.561 20 5 FHBDRN O=C(c1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCc2cc(F)ccc2C1 ZINC000509976173 943572708 /nfs/dbraw/zinc/57/27/08/943572708.db2.gz KFMWKEXDPWOFHY-UHFFFAOYSA-N 0 0 368.286 3.951 20 5 FHBDRN O=C(NCc1ccc2ccccc2n1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000515213942 943575527 /nfs/dbraw/zinc/57/55/27/943575527.db2.gz VAPNTQVCYXHSPU-UHFFFAOYSA-N 0 0 362.389 3.647 20 5 FHBDRN C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)C(C)(C)Oc1ccc(F)cc1 ZINC000504293488 943576772 /nfs/dbraw/zinc/57/67/72/943576772.db2.gz PTKBYRKYEZCFQN-LBPRGKRZSA-N 0 0 358.369 3.869 20 5 FHBDRN CC1(C)CN(C(=O)c2cc([N+](=O)[O-])ccc2SCCO)CC(C)(C)C1 ZINC000468715338 943587385 /nfs/dbraw/zinc/58/73/85/943587385.db2.gz PSLDKPYEXKZCFS-UHFFFAOYSA-N 0 0 366.483 3.578 20 5 FHBDRN CCCOc1ccc(OCC(=O)N2c3ccc([N+](=O)[O-])cc3C[C@H]2C)cc1 ZINC000504340969 943592880 /nfs/dbraw/zinc/59/28/80/943592880.db2.gz JVPMDWZEHYVOBQ-CQSZACIVSA-N 0 0 370.405 3.740 20 5 FHBDRN COc1cccc(C(=O)Nc2nc3cc(F)c(F)cc3s2)c1[N+](=O)[O-] ZINC000435755875 943604493 /nfs/dbraw/zinc/60/44/93/943604493.db2.gz NJVDFQGTJHXZTJ-UHFFFAOYSA-N 0 0 365.317 3.744 20 5 FHBDRN COc1cc(COc2cccc(NC(=O)C3CC3)c2)c([N+](=O)[O-])cc1F ZINC000183967689 943604684 /nfs/dbraw/zinc/60/46/84/943604684.db2.gz FYQYHCKWOWMYRE-UHFFFAOYSA-N 0 0 360.341 3.670 20 5 FHBDRN CCOc1ccc(NC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)c(F)c1 ZINC000417477238 943631530 /nfs/dbraw/zinc/63/15/30/943631530.db2.gz RIDNWCCUBFZZBO-UHFFFAOYSA-N 0 0 361.373 3.839 20 5 FHBDRN COc1ccc(-c2nc3cc([N+](=O)[O-])ccc3n2C)c(Br)c1 ZINC000504486440 943643042 /nfs/dbraw/zinc/64/30/42/943643042.db2.gz ADSJKHVRIVPURQ-UHFFFAOYSA-N 0 0 362.183 3.920 20 5 FHBDRN Cc1ccc([C@H](C)N2C(=O)[C@@H](c3ccccc3)N(C)C2=O)cc1[N+](=O)[O-] ZINC000431950489 943657092 /nfs/dbraw/zinc/65/70/92/943657092.db2.gz LNFMGILOYLYIQO-SUMWQHHRSA-N 0 0 353.378 3.600 20 5 FHBDRN CCc1ccc2c(c1)[C@H](NC(=O)[C@@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1)CCO2 ZINC001267861793 943697132 /nfs/dbraw/zinc/69/71/32/943697132.db2.gz PEKNDOWNKQHMLE-ZHALLVOQSA-N 0 0 366.417 3.901 20 5 FHBDRN CCc1ccc2c(c1)[C@H](NC(=O)[C@@H]1C[C@H]1c1cccc([N+](=O)[O-])c1)CCO2 ZINC001267861792 943697303 /nfs/dbraw/zinc/69/73/03/943697303.db2.gz PEKNDOWNKQHMLE-YQVWRLOYSA-N 0 0 366.417 3.901 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)Nc1nnc(CC2CCCCC2)s1 ZINC000504592279 943702613 /nfs/dbraw/zinc/70/26/13/943702613.db2.gz KYLGUMUDEXPVRU-UHFFFAOYSA-N 0 0 360.439 3.750 20 5 FHBDRN COc1ccc(NC(=O)NC(C)(C)COCc2ccccc2)cc1[N+](=O)[O-] ZINC000504614196 943707145 /nfs/dbraw/zinc/70/71/45/943707145.db2.gz WGCVTFUMIBUXKJ-UHFFFAOYSA-N 0 0 373.409 3.720 20 5 FHBDRN O=[N+]([O-])c1cccc(-n2ccc(-c3nc(Cc4ccc(F)cc4)no3)n2)c1 ZINC000504653750 943718568 /nfs/dbraw/zinc/71/85/68/943718568.db2.gz SLHQWCPKLMKBAV-UHFFFAOYSA-N 0 0 365.324 3.560 20 5 FHBDRN CC(C)(C)Oc1ccncc1NC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000504638290 943725359 /nfs/dbraw/zinc/72/53/59/943725359.db2.gz WUBCJALFDXGEOC-UHFFFAOYSA-N 0 0 354.366 3.901 20 5 FHBDRN Cc1ccccc1OC[C@@H](O)COc1cc(C)c([N+](=O)[O-])cc1Cl ZINC000504672939 943739065 /nfs/dbraw/zinc/73/90/65/943739065.db2.gz HJNIKUOSLBFMDS-CYBMUJFWSA-N 0 0 351.786 3.684 20 5 FHBDRN Cc1ccc([C@@H](C)N2C(=O)CN([C@@H](C)c3ccccc3)C2=O)cc1[N+](=O)[O-] ZINC000431955494 943743385 /nfs/dbraw/zinc/74/33/85/943743385.db2.gz QULWQYCQKLWIHH-LSDHHAIUSA-N 0 0 367.405 3.990 20 5 FHBDRN CCOc1ccccc1[C@H](CC)NC(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000053318287 943745688 /nfs/dbraw/zinc/74/56/88/943745688.db2.gz RTDDABXVDJKXNS-KRWDZBQOSA-N 0 0 358.394 3.640 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1CSCCOCC(F)F ZINC000424129632 943757863 /nfs/dbraw/zinc/75/78/63/943757863.db2.gz YIVAPTGMGCOUFI-UHFFFAOYSA-N 0 0 356.188 3.872 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])N1CCC[C@@H](Oc2ccccc2Cl)C1 ZINC000504691408 943758007 /nfs/dbraw/zinc/75/80/07/943758007.db2.gz HTJGUGDRCWGMOF-OAHLLOKOSA-N 0 0 374.824 3.861 20 5 FHBDRN CCOc1cc(C(=O)NC[C@H]2CCC[C@@H]2C2CC2)c([N+](=O)[O-])cc1OC ZINC000412484508 943758241 /nfs/dbraw/zinc/75/82/41/943758241.db2.gz XIRQYVVOTMORRF-ZIAGYGMSSA-N 0 0 362.426 3.558 20 5 FHBDRN CCC[C@]1(C)CCCN(C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)C1 ZINC000437393122 943770841 /nfs/dbraw/zinc/77/08/41/943770841.db2.gz ZNFNGTXAZHOUJL-LJQANCHMSA-N 0 0 356.426 3.823 20 5 FHBDRN C[C@H]1C[C@H](C)CN(C(=O)c2cccc3c(=O)c4cccc(F)c4[nH]c23)C1 ZINC000435815408 943772444 /nfs/dbraw/zinc/77/24/44/943772444.db2.gz FHQFFJKPISMKMF-STQMWFEESA-N 0 0 352.409 3.939 20 5 FHBDRN Cc1cc(OCC(=O)N[C@H]2C[C@H](c3cccc(Cl)c3)C2)ccc1[N+](=O)[O-] ZINC000437396826 943773186 /nfs/dbraw/zinc/77/31/86/943773186.db2.gz RZFIBSWMMMHYQW-KOMQPUFPSA-N 0 0 374.824 3.998 20 5 FHBDRN Cc1c(CS(=O)(=O)c2ncc(C(C)C)n2C(C)C)cccc1[N+](=O)[O-] ZINC000424208947 943775266 /nfs/dbraw/zinc/77/52/66/943775266.db2.gz RFQUGWMTISATOF-UHFFFAOYSA-N 0 0 365.455 3.778 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N[C@H]1C[C@H](c2ccccc2F)C1 ZINC000437407196 943782376 /nfs/dbraw/zinc/78/23/76/943782376.db2.gz OMMPQPMEVSRYES-JOCQHMNTSA-N 0 0 362.788 3.992 20 5 FHBDRN O=C(N[C@H]1C[C@@H]1c1ccccc1OC(F)F)c1cc(F)cc([N+](=O)[O-])c1 ZINC000437411306 943784418 /nfs/dbraw/zinc/78/44/18/943784418.db2.gz NGPFBGUWYGQIJF-KGLIPLIRSA-N 0 0 366.295 3.621 20 5 FHBDRN O=C(N[C@H]1C[C@H](c2ccc(C(F)(F)F)cc2)C1)c1ccc([N+](=O)[O-])o1 ZINC000437414706 943787409 /nfs/dbraw/zinc/78/74/09/943787409.db2.gz RPDTUWHUFFZSBT-UMSPYCQHSA-N 0 0 354.284 3.883 20 5 FHBDRN O=C(NCCSc1ccccc1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000008173980 943789439 /nfs/dbraw/zinc/78/94/39/943789439.db2.gz VJYPUAPQTQSWGR-UHFFFAOYSA-N 0 0 357.435 3.691 20 5 FHBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)N1CCC[C@H]1Cc1ccccc1 ZINC000126552739 943794945 /nfs/dbraw/zinc/79/49/45/943794945.db2.gz FBLIWFSXFDKHRM-SFHVURJKSA-N 0 0 353.422 3.554 20 5 FHBDRN COc1ccc(Cc2noc(-c3ccc(NC4CC4)c([N+](=O)[O-])c3)n2)cc1 ZINC000504787569 943795469 /nfs/dbraw/zinc/79/54/69/943795469.db2.gz UBCLRXJOAOMVAN-UHFFFAOYSA-N 0 0 366.377 3.819 20 5 FHBDRN O=C(N[C@@H]1CCc2ccccc2C1)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000435822921 943795752 /nfs/dbraw/zinc/79/57/52/943795752.db2.gz WLRFZIOKWQWLRF-GOSISDBHSA-N 0 0 368.436 3.969 20 5 FHBDRN C[C@@H](c1ccc(F)c(F)c1)N(C)C(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000516888683 943797951 /nfs/dbraw/zinc/79/79/51/943797951.db2.gz CZRMCFXTVNEHNZ-VIFPVBQESA-N 0 0 370.302 3.913 20 5 FHBDRN CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)c1ccc(Br)o1 ZINC000053334618 943798154 /nfs/dbraw/zinc/79/81/54/943798154.db2.gz FABNSXZLOLYPES-UHFFFAOYSA-N 0 0 373.590 3.876 20 5 FHBDRN CC(C)OCCCNC(=O)c1cc(F)cc2c(=O)c3cccc(F)c3[nH]c12 ZINC000435827557 943798724 /nfs/dbraw/zinc/79/87/24/943798724.db2.gz SLOLLENPVUEVGJ-UHFFFAOYSA-N 0 0 374.387 3.504 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)c1cncc(C(F)(F)F)c1 ZINC000516890776 943798866 /nfs/dbraw/zinc/79/88/66/943798866.db2.gz OTPWFCMCCWUBHN-UHFFFAOYSA-N 0 0 355.272 3.660 20 5 FHBDRN O=C(NCc1cccc([N+](=O)[O-])c1)NCc1ccc(-c2ccco2)cc1F ZINC000515340836 943807590 /nfs/dbraw/zinc/80/75/90/943807590.db2.gz NJEQSVCEZPTLEQ-UHFFFAOYSA-N 0 0 369.352 3.993 20 5 FHBDRN COc1ccc(CN[C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)c(OC)n1 ZINC000516896955 943813498 /nfs/dbraw/zinc/81/34/98/943813498.db2.gz USFAEPJNDHCINL-INIZCTEOSA-N 0 0 357.410 3.519 20 5 FHBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NC1CC(C(C)(C)C)C1 ZINC000504802578 943817927 /nfs/dbraw/zinc/81/79/27/943817927.db2.gz IREDXAQLDTWCRF-XSRFYTQQSA-N 0 0 354.834 3.956 20 5 FHBDRN COc1cccc(C(=O)N[C@@H](c2ccc(F)cc2)C(F)(F)F)c1[N+](=O)[O-] ZINC000435867764 943822719 /nfs/dbraw/zinc/82/27/19/943822719.db2.gz PYENSEJCTGSMMP-AWEZNQCLSA-N 0 0 372.274 3.776 20 5 FHBDRN CCN(Cc1cc(Br)ccc1F)c1ccc([N+](=O)[O-])nc1 ZINC000516919441 943828388 /nfs/dbraw/zinc/82/83/88/943828388.db2.gz JSICWIMOZNFAPX-UHFFFAOYSA-N 0 0 354.179 3.918 20 5 FHBDRN Cc1cc(NC(=O)Cc2ccc([N+](=O)[O-])cc2)cnc1N1CCCC[C@H]1C ZINC000504844922 943837847 /nfs/dbraw/zinc/83/78/47/943837847.db2.gz BNQOPFWPVNEZJW-OAHLLOKOSA-N 0 0 368.437 3.858 20 5 FHBDRN Cc1ccc([C@H]2C[C@H](C)CCN2C(=O)CNc2ccccc2[N+](=O)[O-])o1 ZINC000437470932 943841390 /nfs/dbraw/zinc/84/13/90/943841390.db2.gz JUSSGMZJPXWBIH-CXAGYDPISA-N 0 0 357.410 3.908 20 5 FHBDRN Cc1cc(OCC(=O)N[C@H]2C[C@H](c3ccc(Cl)cc3)C2)ccc1[N+](=O)[O-] ZINC000435915563 943853838 /nfs/dbraw/zinc/85/38/38/943853838.db2.gz GLGDUTXBARUGLR-KOMQPUFPSA-N 0 0 374.824 3.998 20 5 FHBDRN Cc1c(C(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)[nH]c2c1C(=O)CCC2 ZINC000437490275 943855560 /nfs/dbraw/zinc/85/55/60/943855560.db2.gz COOSLKMQNWGSPN-UHFFFAOYSA-N 0 0 367.405 3.555 20 5 FHBDRN O=C(NCc1c(F)cc(F)c(F)c1F)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000435919458 943856843 /nfs/dbraw/zinc/85/68/43/943856843.db2.gz YCPJHGWKHATTKR-UHFFFAOYSA-N 0 0 367.258 3.563 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1Cl)N1CC[C@@H](n2cc(Cl)cn2)C1 ZINC000290762118 943862914 /nfs/dbraw/zinc/86/29/14/943862914.db2.gz ROPYMTCVVRYVPW-SNVBAGLBSA-N 0 0 370.196 3.577 20 5 FHBDRN CCOc1ccc(C(=O)N2CC[C@@H](c3ccccc3C)C2)cc1[N+](=O)[O-] ZINC000504900610 943876942 /nfs/dbraw/zinc/87/69/42/943876942.db2.gz AJCVQRYWAPYXQZ-MRXNPFEDSA-N 0 0 354.406 3.932 20 5 FHBDRN CSc1ccc(CCNC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000437530863 943892011 /nfs/dbraw/zinc/89/20/11/943892011.db2.gz XKTLGMYPEFWSBG-UHFFFAOYSA-N 0 0 350.827 3.943 20 5 FHBDRN COc1c(C)cc(CN(C)C(=O)CCNc2ccccc2[N+](=O)[O-])cc1C ZINC000506065236 943894991 /nfs/dbraw/zinc/89/49/91/943894991.db2.gz WJRRKWYJARGJJY-UHFFFAOYSA-N 0 0 371.437 3.681 20 5 FHBDRN CCOc1ccc(NC(=O)CN(CC2CC2)c2ccccc2)c([N+](=O)[O-])c1 ZINC000437537294 943899977 /nfs/dbraw/zinc/89/99/77/943899977.db2.gz MLNJYGPDOCQQIB-UHFFFAOYSA-N 0 0 369.421 3.849 20 5 FHBDRN Cn1c(-c2ccccc2F)nnc1N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000516997287 943901967 /nfs/dbraw/zinc/90/19/67/943901967.db2.gz CUMVITLCQSCUNQ-UHFFFAOYSA-N 0 0 367.384 3.698 20 5 FHBDRN O=[N+]([O-])c1ccc2c(ccn2Cc2nc(COc3cccc(F)c3)no2)c1 ZINC000435982431 943908380 /nfs/dbraw/zinc/90/83/80/943908380.db2.gz JPRWHFJQIKWFIX-UHFFFAOYSA-N 0 0 368.324 3.699 20 5 FHBDRN COc1cc(NC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)c(C)c(OC)c1 ZINC000504915370 943911296 /nfs/dbraw/zinc/91/12/96/943911296.db2.gz SPWXWRHUJBLVEA-UHFFFAOYSA-N 0 0 373.409 3.977 20 5 FHBDRN Cc1nc([C@H](C)NCc2ccc(Br)cc2[N+](=O)[O-])cs1 ZINC000425433615 943911996 /nfs/dbraw/zinc/91/19/96/943911996.db2.gz NSVZWSGNDQNMHT-QMMMGPOBSA-N 0 0 356.245 3.973 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)N[C@@H](CC(F)(F)F)c2ccccc2C)n1 ZINC000436328686 943913139 /nfs/dbraw/zinc/91/31/39/943913139.db2.gz WJXWKHNEZDHPPS-LBPRGKRZSA-N 0 0 370.331 3.543 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)NCCCOCC(F)(F)F)cc1[N+](=O)[O-] ZINC000120274892 943922814 /nfs/dbraw/zinc/92/28/14/943922814.db2.gz ZYOGXVSFXKOYNI-UHFFFAOYSA-N 0 0 362.348 3.591 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N1CCC(Cc2ccc(F)cc2)CC1 ZINC000504954651 943933607 /nfs/dbraw/zinc/93/36/07/943933607.db2.gz YYCKRMRNLDIPPC-UHFFFAOYSA-N 0 0 372.396 3.594 20 5 FHBDRN CCC1(C)CCN(C(=O)CSCc2ccc(OC)c([N+](=O)[O-])c2)CC1 ZINC000504965149 943942784 /nfs/dbraw/zinc/94/27/84/943942784.db2.gz INNLONLSXCLYGT-UHFFFAOYSA-N 0 0 366.483 3.875 20 5 FHBDRN COc1cccc(C(=O)N2CCC[C@H]2/C=C\c2ccccc2)c1[N+](=O)[O-] ZINC000436023400 943943042 /nfs/dbraw/zinc/94/30/42/943943042.db2.gz WEDFMHOCYSSAGO-AHKFDXCISA-N 0 0 352.390 3.921 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)CC(=O)C12CC3CC(CC(C3)C1)C2 ZINC000517042836 943944915 /nfs/dbraw/zinc/94/49/15/943944915.db2.gz DWNJPKOIKXQPFX-UHFFFAOYSA-N 0 0 356.466 3.855 20 5 FHBDRN COc1ccc(OC)c(/C=C/c2nc(-c3cccc([N+](=O)[O-])c3)no2)c1 ZINC000504975762 943946662 /nfs/dbraw/zinc/94/66/62/943946662.db2.gz WPMNQIJUKAKCLU-RMKNXTFCSA-N 0 0 353.334 3.832 20 5 FHBDRN CC1=C[C@@H](C)CN(C(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000436016078 943953830 /nfs/dbraw/zinc/95/38/30/943953830.db2.gz YOTKAZAWNVYIEL-LLVKDONJSA-N 0 0 371.359 3.840 20 5 FHBDRN COc1cccc(C(=O)N2CCc3c(cccc3C(C)C)C2)c1[N+](=O)[O-] ZINC000436016145 943954361 /nfs/dbraw/zinc/95/43/61/943954361.db2.gz JICDBNYNTSRFLJ-UHFFFAOYSA-N 0 0 354.406 3.925 20 5 FHBDRN COc1ccc(/C=C/c2nc(-c3cccc([N+](=O)[O-])c3)no2)c(OC)c1 ZINC000504990441 943960513 /nfs/dbraw/zinc/96/05/13/943960513.db2.gz FXIOMXSLTDNMKK-VQHVLOKHSA-N 0 0 353.334 3.832 20 5 FHBDRN CCOc1ccc(C(=O)Nc2ccccc2N[C@H](C)COC)cc1[N+](=O)[O-] ZINC000437606826 943963329 /nfs/dbraw/zinc/96/33/29/943963329.db2.gz OHQDBSYFLRAZAD-CYBMUJFWSA-N 0 0 373.409 3.693 20 5 FHBDRN CCOc1ccc(C(=O)Nc2ccccc2N[C@@H](C)COC)cc1[N+](=O)[O-] ZINC000437606832 943963390 /nfs/dbraw/zinc/96/33/90/943963390.db2.gz OHQDBSYFLRAZAD-ZDUSSCGKSA-N 0 0 373.409 3.693 20 5 FHBDRN CSC[C@H]1CCCN(Cc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000425450873 943965083 /nfs/dbraw/zinc/96/50/83/943965083.db2.gz WFCJDDUBFLSPEL-NSHDSACASA-N 0 0 359.289 3.932 20 5 FHBDRN COc1cccc(C(=O)N[C@@](C)(c2ccccc2)C(F)(F)F)c1[N+](=O)[O-] ZINC000436042165 943966358 /nfs/dbraw/zinc/96/63/58/943966358.db2.gz FPYBZOHTXOCTFF-INIZCTEOSA-N 0 0 368.311 3.811 20 5 FHBDRN COC[C@@H](C)Nc1ccccc1NC(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000437609860 943966902 /nfs/dbraw/zinc/96/69/02/943966902.db2.gz CPRSTDYAJPKCGF-CQSZACIVSA-N 0 0 357.410 3.613 20 5 FHBDRN O=C(N[C@@H]1C[C@H]1c1ccccc1)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000436043113 943967057 /nfs/dbraw/zinc/96/70/57/943967057.db2.gz INWBXEIPISCXGA-UONOGXRCSA-N 0 0 350.296 3.900 20 5 FHBDRN O=C(N[C@H]1C[C@H]1c1ccccc1)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000436044032 943968189 /nfs/dbraw/zinc/96/81/89/943968189.db2.gz AWKGWVWQMUVAPY-ICSRJNTNSA-N 0 0 354.409 3.967 20 5 FHBDRN C[C@@H]1C[C@@H]1C(=O)Nc1cccc(-c2nc(-c3cccc([N+](=O)[O-])c3)no2)c1 ZINC000505012790 943968163 /nfs/dbraw/zinc/96/81/63/943968163.db2.gz GTPABHOQWATRSX-BZNIZROVSA-N 0 0 364.361 3.906 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2noc(Cc3ccccc3Br)n2)c1 ZINC000505012592 943969340 /nfs/dbraw/zinc/96/93/40/943969340.db2.gz FNWUDPBKBRLEFQ-UHFFFAOYSA-N 0 0 360.167 3.998 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1CN1CCOC[C@@H](C2CCC2)C1 ZINC000425451351 943971127 /nfs/dbraw/zinc/97/11/27/943971127.db2.gz WXTPXVYFKIVROF-AWEZNQCLSA-N 0 0 369.259 3.606 20 5 FHBDRN CCOc1cc(NC(=O)N2C[C@H](C)[C@H](C)C2)c([N+](=O)[O-])cc1OCC ZINC000437613098 943971310 /nfs/dbraw/zinc/97/13/10/943971310.db2.gz ADLPIYPLLQBMRB-TXEJJXNPSA-N 0 0 351.403 3.512 20 5 FHBDRN O=C(N[C@@H]1C[C@H]1c1ccccc1)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000436034575 943976837 /nfs/dbraw/zinc/97/68/37/943976837.db2.gz AWKGWVWQMUVAPY-AZUAARDMSA-N 0 0 354.409 3.967 20 5 FHBDRN CCc1nc(NC(=O)c2ccc([N+](=O)[O-])cc2Br)sc1C ZINC000150720614 943980103 /nfs/dbraw/zinc/98/01/03/943980103.db2.gz ACFFHIZRCLKIGX-UHFFFAOYSA-N 0 0 370.228 3.937 20 5 FHBDRN O=C(NCCOC1CCCC1)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000436067208 943987537 /nfs/dbraw/zinc/98/75/37/943987537.db2.gz PUKGNAIXZDCNRC-UHFFFAOYSA-N 0 0 368.408 3.509 20 5 FHBDRN C[C@@H](Nc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-])c1c(F)cccc1F ZINC000515554527 943988899 /nfs/dbraw/zinc/98/88/99/943988899.db2.gz NDEAJXBWBJKBLB-SNVBAGLBSA-N 0 0 361.348 3.938 20 5 FHBDRN COc1cccc(C(=O)N2[C@H](C)Cc3cc(F)ccc3[C@@H]2C)c1[N+](=O)[O-] ZINC000436054377 943995129 /nfs/dbraw/zinc/99/51/29/943995129.db2.gz VJYKMRLRFWCZKM-NEPJUHHUSA-N 0 0 358.369 3.891 20 5 FHBDRN CCCN(CCC)C(=O)CCCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000505055043 943998264 /nfs/dbraw/zinc/99/82/64/943998264.db2.gz MRSGHRZBWCSECW-UHFFFAOYSA-N 0 0 360.414 3.616 20 5 FHBDRN CCOc1ccc(C(=O)NCC2(c3ccc(F)cc3)CC2)cc1[N+](=O)[O-] ZINC000500043911 944003872 /nfs/dbraw/zinc/00/38/72/944003872.db2.gz PEXQSQKCHCVENJ-UHFFFAOYSA-N 0 0 358.369 3.594 20 5 FHBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])Nc1c(O)cccc1F ZINC000092550546 944004000 /nfs/dbraw/zinc/00/40/00/944004000.db2.gz WTBMCRIXBKRQAQ-UHFFFAOYSA-N 0 0 354.721 3.501 20 5 FHBDRN O=C(NCC1(c2ccc(F)cc2)CC1)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000500044696 944005317 /nfs/dbraw/zinc/00/53/17/944005317.db2.gz GEYGFRRWALPTBV-UHFFFAOYSA-N 0 0 354.337 3.942 20 5 FHBDRN COCC[C@H](C)NC(=O)c1ccc(SCCC(C)C)c([N+](=O)[O-])c1 ZINC000505066038 944006957 /nfs/dbraw/zinc/00/69/57/944006957.db2.gz JSWBYFWJJWYLGM-ZDUSSCGKSA-N 0 0 354.472 3.888 20 5 FHBDRN O=C(NCCNc1ccc([N+](=O)[O-])cc1)Nc1ccc(F)c(Cl)c1 ZINC000505066923 944007603 /nfs/dbraw/zinc/00/76/03/944007603.db2.gz UFTZCLKOBNSKTQ-UHFFFAOYSA-N 0 0 352.753 3.621 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H](C)c1cc(C)cc(C)c1 ZINC000515561229 944011635 /nfs/dbraw/zinc/01/16/35/944011635.db2.gz FSLPWCJBNBEUHY-AWEZNQCLSA-N 0 0 369.421 3.590 20 5 FHBDRN O=[N+]([O-])c1cccc(CS(=O)(=O)Cc2nc(-c3ccccc3)cs2)c1 ZINC000436093468 944023951 /nfs/dbraw/zinc/02/39/51/944023951.db2.gz YZKVFPKNQAYHEB-UHFFFAOYSA-N 0 0 374.443 3.833 20 5 FHBDRN Cc1ccc(NC(=O)c2cc(F)cc3c(=O)c4cc(F)ccc4[nH]c23)nc1 ZINC000436096692 944028471 /nfs/dbraw/zinc/02/84/71/944028471.db2.gz GNRRSPHCAHEBAI-UHFFFAOYSA-N 0 0 365.339 3.915 20 5 FHBDRN Cc1ccc([C@@H]2CCCN2C(=O)C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000517113383 944031095 /nfs/dbraw/zinc/03/10/95/944031095.db2.gz ACEODURYCQYCJS-KRWDZBQOSA-N 0 0 367.405 3.514 20 5 FHBDRN O=C(NC1(c2ccc(Cl)cc2)CCOCC1)c1ccc([N+](=O)[O-])s1 ZINC000505117076 944046823 /nfs/dbraw/zinc/04/68/23/944046823.db2.gz KJWPYBVSAOCRDW-UHFFFAOYSA-N 0 0 366.826 3.745 20 5 FHBDRN O=C(CSc1ccccc1[N+](=O)[O-])N1CC[C@H](c2ccccc2F)C1 ZINC000500071598 944048809 /nfs/dbraw/zinc/04/88/09/944048809.db2.gz YBZVHVUWBWICPE-ZDUSSCGKSA-N 0 0 360.410 3.842 20 5 FHBDRN CCC[C@@]1(C)CCCN(S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000437707563 944049462 /nfs/dbraw/zinc/04/94/62/944049462.db2.gz ZOQJYCGNHWVANK-HNNXBMFYSA-N 0 0 360.863 3.839 20 5 FHBDRN CCC[C@@H](NS(=O)(=O)Cc1ccccc1[N+](=O)[O-])C1CCCCC1 ZINC000546065731 944050318 /nfs/dbraw/zinc/05/03/18/944050318.db2.gz LANUIWFNZUSUFR-MRXNPFEDSA-N 0 0 354.472 3.763 20 5 FHBDRN CN(Cc1ccoc1)C(=O)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12 ZINC000436155266 944060164 /nfs/dbraw/zinc/06/01/64/944060164.db2.gz RYVKCKFGOFMUHE-UHFFFAOYSA-N 0 0 368.339 3.825 20 5 FHBDRN CC[C@H](C)[C@@H](NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)C(F)(F)F ZINC000436166549 944068621 /nfs/dbraw/zinc/06/86/21/944068621.db2.gz CUTHLCOISMOCMS-BJOHPYRUSA-N 0 0 357.332 3.712 20 5 FHBDRN CC[C@H](C)[C@@H](NC(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F)C(F)(F)F ZINC000436167879 944071841 /nfs/dbraw/zinc/07/18/41/944071841.db2.gz HJLXKWHLTFGDBO-IGJMFERPSA-N 0 0 350.312 3.931 20 5 FHBDRN Cc1c(C(=O)NC2(c3ccc(Cl)cc3)CCOCC2)cccc1[N+](=O)[O-] ZINC000505128803 944077553 /nfs/dbraw/zinc/07/75/53/944077553.db2.gz IGGBRENRNNUMLG-UHFFFAOYSA-N 0 0 374.824 3.992 20 5 FHBDRN COc1ccccc1C[C@@H](C)N(C)C(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000123092313 944085223 /nfs/dbraw/zinc/08/52/23/944085223.db2.gz FUXXGLRBLKRLNT-CYBMUJFWSA-N 0 0 373.409 3.707 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])NCc1ccccc1C(F)(F)F ZINC000515641792 944085796 /nfs/dbraw/zinc/08/57/96/944085796.db2.gz OUXWCTGUSFWDSM-UHFFFAOYSA-N 0 0 368.311 3.699 20 5 FHBDRN Cc1sc(C(=O)N2CC(C)(C)O[C@](C)(C(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000505768603 944093567 /nfs/dbraw/zinc/09/35/67/944093567.db2.gz KIONTWJHJIQBPV-ZDUSSCGKSA-N 0 0 366.361 3.537 20 5 FHBDRN COc1cccc(-c2nc(-c3ccnc(OC(C)C)c3)no2)c1[N+](=O)[O-] ZINC000517201309 944100159 /nfs/dbraw/zinc/10/01/59/944100159.db2.gz BLFSHITZRXWLAF-UHFFFAOYSA-N 0 0 356.338 3.503 20 5 FHBDRN CCO[C@@H]1CCN(Cc2ccc(Br)cc2[N+](=O)[O-])C[C@H]1C ZINC000425492136 944111397 /nfs/dbraw/zinc/11/13/97/944111397.db2.gz MVVFCPBCZXGOCK-IAQYHMDHSA-N 0 0 357.248 3.604 20 5 FHBDRN CN(C(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)c1ccc2cc[nH]c2c1 ZINC000473583551 944114406 /nfs/dbraw/zinc/11/44/06/944114406.db2.gz RXFFANQJMIRZKI-UHFFFAOYSA-N 0 0 361.361 3.538 20 5 FHBDRN CCOc1ccc(C(=O)N(CCOC)[C@@H](C)c2ccccc2)cc1[N+](=O)[O-] ZINC000500115548 944122621 /nfs/dbraw/zinc/12/26/21/944122621.db2.gz AJMGCRJGINJBCJ-HNNXBMFYSA-N 0 0 372.421 3.843 20 5 FHBDRN Cc1c(CC(=O)NCc2ccc(-c3cccnc3)cc2)cccc1[N+](=O)[O-] ZINC000126497313 944132401 /nfs/dbraw/zinc/13/24/01/944132401.db2.gz AHGDKRVUAUIKCL-UHFFFAOYSA-N 0 0 361.401 3.824 20 5 FHBDRN Cc1cc(OC(C)C)ccc1NC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000515698935 944140777 /nfs/dbraw/zinc/14/07/77/944140777.db2.gz BNJJIIKJGGUICX-UHFFFAOYSA-N 0 0 358.350 3.671 20 5 FHBDRN Cc1nc2ccccc2n1CCC(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000500126834 944141310 /nfs/dbraw/zinc/14/13/10/944141310.db2.gz YDOMOMCFIAUKDA-AWEZNQCLSA-N 0 0 366.421 3.829 20 5 FHBDRN COc1ccc(CNC(=O)CCc2cc3ccccc3o2)cc1[N+](=O)[O-] ZINC000515728994 944142877 /nfs/dbraw/zinc/14/28/77/944142877.db2.gz QBNZWXSTWPMSBB-UHFFFAOYSA-N 0 0 354.362 3.599 20 5 FHBDRN O=[N+]([O-])c1cc(CN2CCC[C@@H](Oc3ccccc3)C2)c2c(c1)COCO2 ZINC000418100341 944154252 /nfs/dbraw/zinc/15/42/52/944154252.db2.gz PEJWLHBXIPUGOT-LJQANCHMSA-N 0 0 370.405 3.505 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)F)cc1NCCc1nc2ccccc2[nH]1 ZINC000436275449 944172294 /nfs/dbraw/zinc/17/22/94/944172294.db2.gz PGXNFPSOMXNMIF-UHFFFAOYSA-N 0 0 351.288 3.540 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N(C1CC1)C1CCC(C)CC1 ZINC000515752466 944179928 /nfs/dbraw/zinc/17/99/28/944179928.db2.gz VELBPSJCEJEZCC-UHFFFAOYSA-N 0 0 352.456 3.635 20 5 FHBDRN COc1ccc(OC)c(CCNc2cc(C(F)(F)F)ncc2[N+](=O)[O-])c1 ZINC000436303141 944187164 /nfs/dbraw/zinc/18/71/64/944187164.db2.gz CBQWATJJVRUMAM-UHFFFAOYSA-N 0 0 371.315 3.680 20 5 FHBDRN CC(C)(c1nc(-c2n[nH]c3ccccc32)no1)c1ccc([N+](=O)[O-])cc1F ZINC000566586725 944190449 /nfs/dbraw/zinc/19/04/49/944190449.db2.gz DVMYHMXQKKVJEO-UHFFFAOYSA-N 0 0 367.340 3.986 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)F)cc1N1CCO[C@@H](C2CCCCC2)C1 ZINC000436322309 944200124 /nfs/dbraw/zinc/20/01/24/944200124.db2.gz BVURQNGAZKVYKS-CQSZACIVSA-N 0 0 359.348 3.794 20 5 FHBDRN CCc1ccc(C(C)(C)C(=O)NCc2ccc(OC)c([N+](=O)[O-])c2)cc1 ZINC000425928542 944203038 /nfs/dbraw/zinc/20/30/38/944203038.db2.gz YLRGAVZBYHWHGB-UHFFFAOYSA-N 0 0 356.422 3.760 20 5 FHBDRN COc1ccc(CNC(=O)N[C@@H](c2ccccc2)C(C)C)cc1[N+](=O)[O-] ZINC000515778161 944203639 /nfs/dbraw/zinc/20/36/39/944203639.db2.gz YLZFTXFXGIJPOV-GOSISDBHSA-N 0 0 357.410 3.800 20 5 FHBDRN CC[C@@H](NC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12)c1ccc(OC)cc1 ZINC000515786271 944212175 /nfs/dbraw/zinc/21/21/75/944212175.db2.gz LPPOORYCFMPJLN-QGZVFWFLSA-N 0 0 353.378 3.966 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)F)cc1Nc1ccc(OC2COC2)cc1 ZINC000436327757 944221249 /nfs/dbraw/zinc/22/12/49/944221249.db2.gz STEJQXPDZYNMGT-UHFFFAOYSA-N 0 0 355.272 3.530 20 5 FHBDRN CCOc1cc(N[C@H](c2nnc3ccccn32)C(C)C)ccc1[N+](=O)[O-] ZINC000092684065 944231223 /nfs/dbraw/zinc/23/12/23/944231223.db2.gz QYTUQPDUKLGGSV-KRWDZBQOSA-N 0 0 355.398 3.845 20 5 FHBDRN O=C(N[C@@H](c1ccc(F)cc1)[C@H]1CCCO1)c1cc(F)cc([N+](=O)[O-])c1 ZINC000518286695 944238225 /nfs/dbraw/zinc/23/82/25/944238225.db2.gz JOOWFWMZBIOGCL-SJORKVTESA-N 0 0 362.332 3.523 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H]1C[C@H]1c1c(F)cccc1F ZINC000436380266 944250092 /nfs/dbraw/zinc/25/00/92/944250092.db2.gz XRJMMESLBIIPQP-QMTHXVAHSA-N 0 0 363.320 3.559 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)F)cc1NCc1cccc(-n2ccnc2)c1 ZINC000436381394 944250607 /nfs/dbraw/zinc/25/06/07/944250607.db2.gz AGBBHUNJILIVGZ-UHFFFAOYSA-N 0 0 363.299 3.806 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1N1CC[C@@H](OCCCc3ccccc3)C1)CCN2 ZINC000436384468 944254167 /nfs/dbraw/zinc/25/41/67/944254167.db2.gz FTKCUYZCQKJBMR-QGZVFWFLSA-N 0 0 367.449 3.791 20 5 FHBDRN Cc1cc(C(=O)Cn2nccc2[N+](=O)[O-])c(C)n1CCC1=CCCCC1 ZINC000515842604 944260487 /nfs/dbraw/zinc/26/04/87/944260487.db2.gz KROXYUHTQCJKCN-UHFFFAOYSA-N 0 0 356.426 3.983 20 5 FHBDRN CCc1nnc(-c2cccc(NC(=O)c3ccc(F)cc3[N+](=O)[O-])c2)o1 ZINC000133855225 944260717 /nfs/dbraw/zinc/26/07/17/944260717.db2.gz ZWSALUJGFKRVNR-UHFFFAOYSA-N 0 0 356.313 3.599 20 5 FHBDRN CCOc1ccc([C@@H]2C[C@H]2NC(=O)Nc2ccc([N+](=O)[O-])cc2C)cc1 ZINC000436379296 944265573 /nfs/dbraw/zinc/26/55/73/944265573.db2.gz PNWXYLQDBSWIFQ-FUHWJXTLSA-N 0 0 355.394 3.980 20 5 FHBDRN CC[C@@H]1CCc2nc(NC(=O)c3ccc(NC)c([N+](=O)[O-])c3)sc2C1 ZINC000515828965 944265796 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FHBDRN O=C(Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1)N[C@@H]1CCCOC1 ZINC000517428590 944289107 /nfs/dbraw/zinc/28/91/07/944289107.db2.gz GSZPJVMIIVTIRG-CQSZACIVSA-N 0 0 357.366 3.688 20 5 FHBDRN O=C(NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N1C[C@@H]2CCCC[C@@H]2C1 ZINC000426268982 944291131 /nfs/dbraw/zinc/29/11/31/944291131.db2.gz RQMXYLSFQQFTHA-BETUJISGSA-N 0 0 371.359 3.945 20 5 FHBDRN NC(=O)c1ccc(CSCc2coc(-c3ccccc3)n2)c([N+](=O)[O-])c1 ZINC000105626641 944293428 /nfs/dbraw/zinc/29/34/28/944293428.db2.gz JJPWIANSWFVEJO-UHFFFAOYSA-N 0 0 369.402 3.782 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)c2ccnc(N3CC[C@@H](C)C3)c2)cc1[N+](=O)[O-] ZINC000438026559 944294777 /nfs/dbraw/zinc/29/47/77/944294777.db2.gz GTGRWBYZBOYFTO-UKRRQHHQSA-N 0 0 368.437 3.635 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H](O)CC(C)(C)C ZINC000506474435 944299784 /nfs/dbraw/zinc/29/97/84/944299784.db2.gz MTGCOOYVYDPVNN-CYBMUJFWSA-N 0 0 354.472 3.624 20 5 FHBDRN CS(=O)(=O)c1ccc(/C=C/c2nc3cc([N+](=O)[O-])ccc3s2)cc1 ZINC000515865920 944300121 /nfs/dbraw/zinc/30/01/21/944300121.db2.gz WZXUCKUAXRZXQL-RUDMXATFSA-N 0 0 360.416 3.778 20 5 FHBDRN COc1cccc(COCc2noc(/C=C/c3cccc([N+](=O)[O-])c3)n2)c1 ZINC000518344313 944301653 /nfs/dbraw/zinc/30/16/53/944301653.db2.gz KLTBGLWHIKHKFW-CMDGGOBGSA-N 0 0 367.361 3.874 20 5 FHBDRN COc1cccc(C2(CNC(=O)c3cccc([N+](=O)[O-])c3)CCCC2)c1 ZINC000517458157 944301792 /nfs/dbraw/zinc/30/17/92/944301792.db2.gz JSNQZWOVQGBTHE-UHFFFAOYSA-N 0 0 354.406 3.845 20 5 FHBDRN Cc1nc(C)n(Cc2cccc(NCc3cccc([N+](=O)[O-])c3C)c2)n1 ZINC000425943048 944311782 /nfs/dbraw/zinc/31/17/82/944311782.db2.gz HMVDTOAUTPWKTI-UHFFFAOYSA-N 0 0 351.410 3.772 20 5 FHBDRN CCCCc1noc(CSCc2cc(OC)c(F)cc2[N+](=O)[O-])n1 ZINC000184039425 944312363 /nfs/dbraw/zinc/31/23/63/944312363.db2.gz IBSFEBULJIYGGH-UHFFFAOYSA-N 0 0 355.391 3.902 20 5 FHBDRN CCCOc1ncccc1CNc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-] ZINC000140038118 944314491 /nfs/dbraw/zinc/31/44/91/944314491.db2.gz VCZITWGZEBAYJR-UHFFFAOYSA-N 0 0 372.425 3.529 20 5 FHBDRN C[C@@H](SCc1ccc(C(N)=O)cc1[N+](=O)[O-])c1cc(F)ccc1F ZINC000105633281 944319448 /nfs/dbraw/zinc/31/94/48/944319448.db2.gz BUPRVBYQCDQAQX-SECBINFHSA-N 0 0 352.362 3.966 20 5 FHBDRN Cc1ccc(C)c(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2nc[nH]n2)c1 ZINC000500243929 944319889 /nfs/dbraw/zinc/31/98/89/944319889.db2.gz XJYKZHAIZJLCHI-UHFFFAOYSA-N 0 0 369.406 3.733 20 5 FHBDRN C[C@@H]1C[C@@H](C)CN(C(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C1 ZINC000426276802 944321054 /nfs/dbraw/zinc/32/10/54/944321054.db2.gz KHKHRFVIJPJADU-GHMZBOCLSA-N 0 0 359.348 3.801 20 5 FHBDRN COc1ccccc1[C@H](C)N(C)C(=O)COc1cc(C)ccc1[N+](=O)[O-] ZINC000053542501 944329529 /nfs/dbraw/zinc/32/95/29/944329529.db2.gz FFZVLZOSUFCOMR-AWEZNQCLSA-N 0 0 358.394 3.510 20 5 FHBDRN C[C@@H](CC(F)(F)F)NC(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000426277385 944333367 /nfs/dbraw/zinc/33/33/67/944333367.db2.gz KEGGMECOSVVSAL-ZETCQYMHSA-N 0 0 373.253 3.754 20 5 FHBDRN COc1ccc(C(=O)NCCSc2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000015028487 944336957 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FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)N[C@@H]1CCO[C@@H]1c1ccc(F)c(F)c1 ZINC000123457904 944363774 /nfs/dbraw/zinc/36/37/74/944363774.db2.gz QPYAATXKEVAKOV-HZPDHXFCSA-N 0 0 363.320 3.525 20 5 FHBDRN COc1c(CNC(=O)Nc2ccc([N+](=O)[O-])cc2F)oc2ccccc21 ZINC000473755251 944366637 /nfs/dbraw/zinc/36/66/37/944366637.db2.gz DNWGPICMQULFPB-UHFFFAOYSA-N 0 0 359.313 3.810 20 5 FHBDRN CCCN(Cc1ccc(C)cc1)C(=O)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000515957675 944366868 /nfs/dbraw/zinc/36/68/68/944366868.db2.gz VPYGSUYNTCOJOI-UHFFFAOYSA-N 0 0 369.421 3.589 20 5 FHBDRN COC(=O)c1ccc(C)c(NC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)c1O ZINC000436484546 944369483 /nfs/dbraw/zinc/36/94/83/944369483.db2.gz MWOJAKKTRYVOEC-UHFFFAOYSA-N 0 0 372.377 3.771 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)NCc1cc2c(s1)CCCC2 ZINC000517543787 944373557 /nfs/dbraw/zinc/37/35/57/944373557.db2.gz MGFSXQCBTAVFDF-UHFFFAOYSA-N 0 0 359.451 3.577 20 5 FHBDRN Cc1ccc(NC(=O)N2CCOc3ccc([N+](=O)[O-])cc3C2)cc1Cl ZINC000518443511 944381478 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CC(C)COC[C@H](NC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccco1 ZINC000518458402 944398074 /nfs/dbraw/zinc/39/80/74/944398074.db2.gz KLDXMAMSWZHUBP-YOEHRIQHSA-N 0 0 360.410 3.821 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)Cc1coc(-c2cccs2)n1 ZINC000105942822 944398504 /nfs/dbraw/zinc/39/85/04/944398504.db2.gz XEQKAMTZIFYRDB-UHFFFAOYSA-N 0 0 359.363 3.501 20 5 FHBDRN CO[C@@H]1Cc2ccccc2N(C(=O)c2c(C)cc(C)c([N+](=O)[O-])c2C)C1 ZINC000500283691 944404188 /nfs/dbraw/zinc/40/41/88/944404188.db2.gz TZIIGWUGNIWWCH-MRXNPFEDSA-N 0 0 354.406 3.738 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccnn1Cc1ccccc1F ZINC000105972322 944406519 /nfs/dbraw/zinc/40/65/19/944406519.db2.gz ODMIIUYUEZTUEY-UHFFFAOYSA-N 0 0 354.341 3.539 20 5 FHBDRN O=C(Nc1cnn(Cc2ccccc2)c1)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000516003533 944407607 /nfs/dbraw/zinc/40/76/07/944407607.db2.gz UJJBQCCUQAGSQC-UHFFFAOYSA-N 0 0 362.345 3.838 20 5 FHBDRN COc1ccc(CN(C(=O)c2cccc([N+](=O)[O-])c2)c2ccncc2)cc1 ZINC000151187126 944408144 /nfs/dbraw/zinc/40/81/44/944408144.db2.gz WEXXXGBPUAPAPW-UHFFFAOYSA-N 0 0 363.373 3.845 20 5 FHBDRN CN(C(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)c1ccc(Cl)cc1F ZINC000439185280 944409040 /nfs/dbraw/zinc/40/90/40/944409040.db2.gz IHITXNNVKZSTLE-UHFFFAOYSA-N 0 0 374.759 3.850 20 5 FHBDRN CN(Cc1cccc([N+](=O)[O-])c1)[C@H]1c2cc(Cl)cc(Cl)c2C[C@@H]1O ZINC000518474002 944413812 /nfs/dbraw/zinc/41/38/12/944413812.db2.gz QZVGDWRBCGVSRC-IRXDYDNUSA-N 0 0 367.232 3.992 20 5 FHBDRN C[C@@H]1CC[C@H](NC(=O)c2cccc([N+](=O)[O-])c2Br)C[C@@H]1C ZINC000159123243 944413859 /nfs/dbraw/zinc/41/38/59/944413859.db2.gz QEHQCXQRACZJKN-VWYCJHECSA-N 0 0 355.232 3.912 20 5 FHBDRN COc1ccccc1OC[C@@H](C)CNC(=O)Nc1ccc([N+](=O)[O-])c(C)c1 ZINC000473773960 944413976 /nfs/dbraw/zinc/41/39/76/944413976.db2.gz QCGNJAGBSCOSQN-ZDUSSCGKSA-N 0 0 373.409 3.748 20 5 FHBDRN COc1ccc(CN(C(=O)CSc2cccc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000509725090 944421423 /nfs/dbraw/zinc/42/14/23/944421423.db2.gz BYLFMAPFSZDDOK-UHFFFAOYSA-N 0 0 372.446 3.887 20 5 FHBDRN CC[C@@H](NC(=O)N[C@H]1COc2ccc(F)cc21)c1cccc([N+](=O)[O-])c1 ZINC000467217318 944423470 /nfs/dbraw/zinc/42/34/70/944423470.db2.gz LGFZWMQPXPZJIH-CVEARBPZSA-N 0 0 359.357 3.618 20 5 FHBDRN C[C@H]1CC(CCNC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)C[C@H](C)O1 ZINC000517592660 944423967 /nfs/dbraw/zinc/42/39/67/944423967.db2.gz ZPYHSRVSONHRTN-QWRGUYRKSA-N 0 0 372.368 3.520 20 5 FHBDRN Cc1ccnc(C)c1NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000425586455 944424527 /nfs/dbraw/zinc/42/45/27/944424527.db2.gz KYUVVZCESUVGSX-UHFFFAOYSA-N 0 0 369.299 3.800 20 5 FHBDRN Cc1ccn(-c2ccccc2CNC(=O)Nc2ccc([N+](=O)[O-])c(C)c2)n1 ZINC000473774269 944427158 /nfs/dbraw/zinc/42/71/58/944427158.db2.gz RSGGZGBOFXWRMN-UHFFFAOYSA-N 0 0 365.393 3.719 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)Nc1cccc(Cl)c1-n1cccn1 ZINC000046777466 944436122 /nfs/dbraw/zinc/43/61/22/944436122.db2.gz LEJQHTTYSCOWHJ-UHFFFAOYSA-N 0 0 356.769 3.615 20 5 FHBDRN COc1cccc(OCCCNC(=O)Nc2ccc([N+](=O)[O-])c(C)c2)c1 ZINC000473780046 944438219 /nfs/dbraw/zinc/43/82/19/944438219.db2.gz SGINRAKYYAKEOK-UHFFFAOYSA-N 0 0 359.382 3.502 20 5 FHBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1CC[C@@H](C)C[C@H]1c1ccco1 ZINC000439235695 944448250 /nfs/dbraw/zinc/44/82/50/944448250.db2.gz QBFSZGVMWVPBMR-DOMZBBRYSA-N 0 0 364.423 3.658 20 5 FHBDRN C[C@H](C(=O)N1CC[C@H](c2cccc(F)c2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000584556387 944450481 /nfs/dbraw/zinc/45/04/81/944450481.db2.gz CACQYDWEJHHXCX-JSGCOSHPSA-N 0 0 360.360 3.993 20 5 FHBDRN COc1ccc([C@H](OC)[C@@H](C)NC(=O)Nc2ccc([N+](=O)[O-])c(C)c2)cc1 ZINC000473783636 944457834 /nfs/dbraw/zinc/45/78/34/944457834.db2.gz FBBVBDVHLPCCOI-FZKQIMNGSA-N 0 0 373.409 3.810 20 5 FHBDRN COC(=O)c1cc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc2[nH]ccc21 ZINC000425973317 944460284 /nfs/dbraw/zinc/46/02/84/944460284.db2.gz HUDLPZILASMJFA-UHFFFAOYSA-N 0 0 373.752 3.768 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)NCCc1ccc(SC)cc1 ZINC000439240963 944470704 /nfs/dbraw/zinc/47/07/04/944470704.db2.gz WJFKIUUSZJDMPS-UHFFFAOYSA-N 0 0 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3.553 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]c(CSc3nnc(C(F)(F)F)s3)nc2c1 ZINC000473800177 944521569 /nfs/dbraw/zinc/52/15/69/944521569.db2.gz XQIARBLSNREZIO-UHFFFAOYSA-N 0 0 361.330 3.634 20 5 FHBDRN O=C(NCCc1ccccc1[N+](=O)[O-])N[C@@H]1CCc2sc(Cl)cc21 ZINC000519571775 944523458 /nfs/dbraw/zinc/52/34/58/944523458.db2.gz KVZSKKCVARJGQQ-GFCCVEGCSA-N 0 0 365.842 3.839 20 5 FHBDRN C[C@H]1CO[C@H](c2ccccc2Cl)CN1C(=O)Cc1ccccc1[N+](=O)[O-] ZINC000110515800 944524293 /nfs/dbraw/zinc/52/42/93/944524293.db2.gz JQSWYYUWDUFDSS-UGSOOPFHSA-N 0 0 374.824 3.779 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)N2CCC[C@@H](C(C)C)C2)c1 ZINC000780925353 944528073 /nfs/dbraw/zinc/52/80/73/944528073.db2.gz DBSWUQIFLXJNBF-GFCCVEGCSA-N 0 0 360.863 3.613 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)N2CCC[C@H](C(C)C)C2)c1 ZINC000780925355 944528592 /nfs/dbraw/zinc/52/85/92/944528592.db2.gz DBSWUQIFLXJNBF-LBPRGKRZSA-N 0 0 360.863 3.613 20 5 FHBDRN Cc1cc(C(=O)N[C@@]2(Cc3ccc(Cl)cc3)CCOC2)ccc1[N+](=O)[O-] ZINC000500329618 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C[C@H](NC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1)[C@H]1Oc2ccccc2[C@H]1C ZINC000426673939 944633300 /nfs/dbraw/zinc/63/33/00/944633300.db2.gz IJZWFHKJEQDURT-TYILLQQXSA-N 0 0 368.433 3.942 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])NCCc1cc2ccccc2s1 ZINC000506582939 944635725 /nfs/dbraw/zinc/63/57/25/944635725.db2.gz YJOFLTRTOXZUAI-UHFFFAOYSA-N 0 0 370.430 3.937 20 5 FHBDRN CC[C@H](c1cccc(OC)c1)N(C)C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000566703488 944642092 /nfs/dbraw/zinc/64/20/92/944642092.db2.gz LYTRPBLXBBNVKB-OAHLLOKOSA-N 0 0 372.377 3.555 20 5 FHBDRN CC(C)N(C)c1ccccc1CNC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000438465385 944648121 /nfs/dbraw/zinc/64/81/21/944648121.db2.gz KLAWPJOQUWYGJP-UHFFFAOYSA-N 0 0 366.421 3.851 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NC(C)(C)C(=O)c1ccccc1 ZINC000566707478 944659669 /nfs/dbraw/zinc/65/96/69/944659669.db2.gz XANQTURLWPYECT-CYBMUJFWSA-N 0 0 372.446 3.853 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)NCCc1cccc2[nH]ccc21 ZINC000506250008 944674820 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CCO[C@@H]1C[C@H](N(C)C(=O)c2ccc([N+](=O)[O-])cc2[O-])C12CCCCC2 ZINC000436869113 944734869 /nfs/dbraw/zinc/73/48/69/944734869.db2.gz LLARQFMCRBFBPY-DLBZAZTESA-N 0 0 362.426 3.500 20 5 FHBDRN COc1ccc([C@H]2CCCN2C(=O)Nc2cccc([N+](=O)[O-])c2)c(OC)c1 ZINC000017742736 944739391 /nfs/dbraw/zinc/73/93/91/944739391.db2.gz YWGMNJUGIMGDMT-QGZVFWFLSA-N 0 0 371.393 3.981 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCC[C@H]1c1cccc(F)c1 ZINC000053717766 944747687 /nfs/dbraw/zinc/74/76/87/944747687.db2.gz PFUHAMHLRCKDJU-KRWDZBQOSA-N 0 0 373.384 3.518 20 5 FHBDRN CC/C(=C\C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1)c1ccccc1 ZINC000728800552 944750908 /nfs/dbraw/zinc/75/09/08/944750908.db2.gz GHLDZSCCWKRBBA-WUKNDPDISA-N 0 0 365.433 3.737 20 5 FHBDRN C[C@@H]1CN(C(=O)c2ccn(-c3c(Cl)cc([N+](=O)[O-])cc3Cl)n2)[C@H]1C ZINC000509609153 944755776 /nfs/dbraw/zinc/75/57/76/944755776.db2.gz FQOADCWLYMIDHZ-BDAKNGLRSA-N 0 0 369.208 3.568 20 5 FHBDRN CC(=O)NC1(c2noc(C(C)(C)c3ccccc3[N+](=O)[O-])n2)CCCCC1 ZINC000426430215 944764393 /nfs/dbraw/zinc/76/43/93/944764393.db2.gz OKQUOMHGVUVCGE-UHFFFAOYSA-N 0 0 372.425 3.599 20 5 FHBDRN COc1ccc(-c2ccc(C[NH2+][C@@H]3CCC[C@]3(C)C(=O)[O-])o2)c([N+](=O)[O-])c1 ZINC000426748956 944768024 /nfs/dbraw/zinc/76/80/24/944768024.db2.gz BJYDKJPDUZGBMN-MJGOQNOKSA-N 0 0 374.393 3.596 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](C(=O)[O-])c1ccc(Cl)c(F)c1 ZINC000426754949 944775226 /nfs/dbraw/zinc/77/52/26/944775226.db2.gz VJUSOIQNOGTBDL-HNNXBMFYSA-N 0 0 352.749 3.611 20 5 FHBDRN CN(C(=O)c1ccc(Br)cc1F)c1ccc([N+](=O)[O-])cc1 ZINC000020362469 944798095 /nfs/dbraw/zinc/79/80/95/944798095.db2.gz JWMUPANFSUNLPJ-UHFFFAOYSA-N 0 0 353.147 3.773 20 5 FHBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1C[C@H](C)S[C@@H](C)C1 ZINC000550278938 944800192 /nfs/dbraw/zinc/80/01/92/944800192.db2.gz SUOHAXHPQPMIGK-IUCAKERBSA-N 0 0 373.272 3.632 20 5 FHBDRN CCOc1ccc(C(=O)N[C@@H](C2CCCC2)C(F)(F)F)cc1[N+](=O)[O-] ZINC000437927166 944800652 /nfs/dbraw/zinc/80/06/52/944800652.db2.gz DEVKUJWTOODUKS-AWEZNQCLSA-N 0 0 360.332 3.844 20 5 FHBDRN CN(Cc1ccco1)C(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000017791492 944807140 /nfs/dbraw/zinc/80/71/40/944807140.db2.gz LOECJQGHQMEUBE-UHFFFAOYSA-N 0 0 371.315 3.667 20 5 FHBDRN CCc1cccc2c1OCC[C@@H]2NC(=O)CSc1ccccc1[N+](=O)[O-] ZINC000506967630 944814542 /nfs/dbraw/zinc/81/45/42/944814542.db2.gz ARRYHQOVVUGUSM-HNNXBMFYSA-N 0 0 372.446 3.889 20 5 FHBDRN CCOc1ccccc1[C@H](CC)NC(=O)CNc1ccccc1[N+](=O)[O-] ZINC000505904825 944818151 /nfs/dbraw/zinc/81/81/51/944818151.db2.gz WUXKURKHQOVVCA-HNNXBMFYSA-N 0 0 357.410 3.673 20 5 FHBDRN O=C([O-])[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1cc(Cl)cc(Cl)c1 ZINC000426819188 944842031 /nfs/dbraw/zinc/84/20/31/944842031.db2.gz UVOIIZKKDHJMTM-AWEZNQCLSA-N 0 0 369.204 3.687 20 5 FHBDRN CCCCOc1ccccc1NC(=O)NCCOc1ccc([N+](=O)[O-])cc1 ZINC000518838750 944846543 /nfs/dbraw/zinc/84/65/43/944846543.db2.gz NYTHPOCEMJYHRE-UHFFFAOYSA-N 0 0 373.409 3.974 20 5 FHBDRN CC(C)[C@@H](CC(F)(F)F)NC(=O)CSc1ccccc1[N+](=O)[O-] ZINC000438615144 944848963 /nfs/dbraw/zinc/84/89/63/944848963.db2.gz RDCKPKXLTVSJRN-SNVBAGLBSA-N 0 0 350.362 3.780 20 5 FHBDRN COc1ccc(OC)c(-c2noc(C(C)(C)c3ccccc3[N+](=O)[O-])n2)c1 ZINC000426450935 944849070 /nfs/dbraw/zinc/84/90/70/944849070.db2.gz OVBMQXOHYNMZOS-UHFFFAOYSA-N 0 0 369.377 3.988 20 5 FHBDRN CC(C)[C@H](CC(F)(F)F)NC(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000438620063 944852311 /nfs/dbraw/zinc/85/23/11/944852311.db2.gz FSLSYQRXHZCUDS-RNCFNFMXSA-N 0 0 350.312 3.931 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)N1CC(CC(F)F)C1 ZINC000425660956 944857322 /nfs/dbraw/zinc/85/73/22/944857322.db2.gz KDZNVGSEUXZEKW-UHFFFAOYSA-N 0 0 353.247 3.733 20 5 FHBDRN C[C@H](NC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CCC[C@@H](C)C1 ZINC000454075506 944860336 /nfs/dbraw/zinc/86/03/36/944860336.db2.gz BIDSAMPRCNXCLF-GRYCIOLGSA-N 0 0 367.833 3.518 20 5 FHBDRN COC(=O)c1ccc(-c2noc(/C=C\c3ccccc3[N+](=O)[O-])n2)cc1 ZINC000518866753 944862207 /nfs/dbraw/zinc/86/22/07/944862207.db2.gz MLCYFIIKCCZGOW-KHPPLWFESA-N 0 0 351.318 3.602 20 5 FHBDRN CCc1cccc2c1OCC[C@H]2NC(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000507016195 944863909 /nfs/dbraw/zinc/86/39/09/944863909.db2.gz VUVSIWJMCXLFMC-MRXNPFEDSA-N 0 0 370.405 3.566 20 5 FHBDRN CC(C)[C@H](Cc1ccc(F)cc1)N(C)C(=O)c1ccc([N+](=O)[O-])cc1[O-] ZINC000436980337 944869324 /nfs/dbraw/zinc/86/93/24/944869324.db2.gz MWBJTQFSYCWBET-KRWDZBQOSA-N 0 0 360.385 3.779 20 5 FHBDRN C[C@H](C(=O)N(C)Cc1nc(-c2ccccc2)c[nH]1)c1cccc([N+](=O)[O-])c1 ZINC000518857434 944870807 /nfs/dbraw/zinc/87/08/07/944870807.db2.gz VGELZOVVNYNOPX-AWEZNQCLSA-N 0 0 364.405 3.747 20 5 FHBDRN CC(C)[C@H](CC(=O)[O-])[NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000426832362 944871034 /nfs/dbraw/zinc/87/10/34/944871034.db2.gz JDEHZJARMZKRQE-KRWDZBQOSA-N 0 0 371.437 3.952 20 5 FHBDRN O=C(Nc1cc(C2CC2)nn1-c1ccccc1)c1ccc([N+](=O)[O-])cc1[O-] ZINC000436982615 944875061 /nfs/dbraw/zinc/87/50/61/944875061.db2.gz XTIVVOZNLCJLIP-UHFFFAOYSA-N 0 0 364.361 3.616 20 5 FHBDRN CCC1(C)CCN(c2ccc(C(=O)c3nccn3C)cc2[N+](=O)[O-])CC1 ZINC000507028823 944875930 /nfs/dbraw/zinc/87/59/30/944875930.db2.gz AEWIECMDQWMALI-UHFFFAOYSA-N 0 0 356.426 3.576 20 5 FHBDRN CC(C)(NC(=O)N[C@@H]1CCCc2cc(N)ccc21)c1ccc([N+](=O)[O-])cc1 ZINC000418555217 944876633 /nfs/dbraw/zinc/87/66/33/944876633.db2.gz OHBLQOLPQAGKOS-GOSISDBHSA-N 0 0 368.437 3.789 20 5 FHBDRN Cc1cncc(CCc2nc(Cc3c[nH]c4ccc([N+](=O)[O-])cc34)no2)c1 ZINC000426464467 944878094 /nfs/dbraw/zinc/87/80/94/944878094.db2.gz YXOGKGFVJVDDBW-UHFFFAOYSA-N 0 0 363.377 3.539 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[C@@H](Cc2ccccc2)[C@H]1C ZINC000426869562 944884300 /nfs/dbraw/zinc/88/43/00/944884300.db2.gz STZDPONWGRMUGP-ZBFHGGJFSA-N 0 0 354.406 3.697 20 5 FHBDRN Cc1ccc2c(c1C)OC[C@H]2NC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000431980451 944893536 /nfs/dbraw/zinc/89/35/36/944893536.db2.gz JFVIMYPUQKJLND-QGZVFWFLSA-N 0 0 369.421 3.880 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccc2c(c1)OC1(CCCC1)O2 ZINC000426877497 944898374 /nfs/dbraw/zinc/89/83/74/944898374.db2.gz XDSUZBBDPFOEFN-UHFFFAOYSA-N 0 0 370.361 3.897 20 5 FHBDRN Cc1nn(-c2ccccc2)cc1NC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000511673140 944898407 /nfs/dbraw/zinc/89/84/07/944898407.db2.gz QBDNNKOYCVDORG-UHFFFAOYSA-N 0 0 361.361 3.823 20 5 FHBDRN COc1ccc(C(=O)N[C@@H]2CC[C@@H](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000438670994 944901564 /nfs/dbraw/zinc/90/15/64/944901564.db2.gz FFTBKASQWAOQHC-DOTOQJQBSA-N 0 0 354.406 3.745 20 5 FHBDRN CCCN(CC[NH+]1CCCCCC1)c1cc(C)c([N+](=O)[O-])c(C(=O)[O-])c1 ZINC000516472782 944905615 /nfs/dbraw/zinc/90/56/15/944905615.db2.gz HQIGSCZJGMAYNJ-UHFFFAOYSA-N 0 0 363.458 3.694 20 5 FHBDRN COCCCC[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1[O-])c1ccccc1 ZINC000437007338 944905633 /nfs/dbraw/zinc/90/56/33/944905633.db2.gz ZYCPKJTZALLDOQ-KRWDZBQOSA-N 0 0 358.394 3.588 20 5 FHBDRN O=[N+]([O-])c1cccc2ccc(/C=C/c3cnnn3Cc3ccccc3)nc21 ZINC000426901094 944910779 /nfs/dbraw/zinc/91/07/79/944910779.db2.gz OOMGTXZPRYUGBM-VAWYXSNFSA-N 0 0 357.373 3.953 20 5 FHBDRN Cc1ccc(-c2nc(C)c(C(=O)NCCc3ccc([N+](=O)[O-])cc3)s2)o1 ZINC000054167669 944912136 /nfs/dbraw/zinc/91/21/36/944912136.db2.gz BYYIEQLERKMILX-UHFFFAOYSA-N 0 0 371.418 3.901 20 5 FHBDRN COc1cc(C(=O)N[C@@H](Cc2ccc(F)cc2)C(C)C)ccc1[N+](=O)[O-] ZINC000437001260 944917668 /nfs/dbraw/zinc/91/76/68/944917668.db2.gz CEYWOPRWGBYZJU-INIZCTEOSA-N 0 0 360.385 3.740 20 5 FHBDRN Cc1[nH]c2c(cc(C)cc2CNC(=O)c2cc([N+](=O)[O-])cnc2C)c1C ZINC000518902300 944920752 /nfs/dbraw/zinc/92/07/52/944920752.db2.gz CIWKYKHCCGFOJL-UHFFFAOYSA-N 0 0 352.394 3.635 20 5 FHBDRN Cc1cc(OCC(=O)Nc2ccnn2[C@@H](C)CC(C)C)ccc1[N+](=O)[O-] ZINC000426893509 944924260 /nfs/dbraw/zinc/92/42/60/944924260.db2.gz HUODJISCPTXNKX-AWEZNQCLSA-N 0 0 360.414 3.724 20 5 FHBDRN CC[C@@H](CNc1ccc(C(=O)NC)cc1[N+](=O)[O-])Oc1cccc(C)c1 ZINC000426896697 944926132 /nfs/dbraw/zinc/92/61/32/944926132.db2.gz MSNYATZLBSUBTP-HNNXBMFYSA-N 0 0 357.410 3.532 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1CCC(Oc2ccc(C)cc2)CC1 ZINC000426897954 944926268 /nfs/dbraw/zinc/92/62/68/944926268.db2.gz RQFMNKUPKINRHJ-UHFFFAOYSA-N 0 0 370.405 3.595 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])N[C@H]1CC[C@H](Cc2ccccc2)C1 ZINC000438688334 944926962 /nfs/dbraw/zinc/92/69/62/944926962.db2.gz VMYAZQLIDBNTPR-MSOLQXFVSA-N 0 0 368.433 3.891 20 5 FHBDRN Cc1c(CNC(=O)N[C@@H]2C[C@H]2c2cccc(Cl)c2)cccc1[N+](=O)[O-] ZINC000437841253 944941284 /nfs/dbraw/zinc/94/12/84/944941284.db2.gz LCRJNPQCVFENDD-JKSUJKDBSA-N 0 0 359.813 3.912 20 5 FHBDRN CSc1cc2c(cc1NC(=O)c1ccc([N+](=O)[O-])cc1C)OCCO2 ZINC000505937365 944944983 /nfs/dbraw/zinc/94/49/83/944944983.db2.gz HZWKUBKPMIHTSK-UHFFFAOYSA-N 0 0 360.391 3.649 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CSCC(=O)Nc1ccc(F)cc1 ZINC000507098690 944950089 /nfs/dbraw/zinc/95/00/89/944950089.db2.gz UGDAWIUPFZWKMP-UHFFFAOYSA-N 0 0 350.371 3.614 20 5 FHBDRN CN(C)C(=O)c1cccc(CNc2ccc([N+](=O)[O-])cc2C(F)(F)F)c1 ZINC000511727601 944952811 /nfs/dbraw/zinc/95/28/11/944952811.db2.gz RAXVOJJAIBALIH-UHFFFAOYSA-N 0 0 367.327 3.928 20 5 FHBDRN Cc1c([N+](=O)[O-])cc(C(=O)N[C@H](C)c2ccccc2Cl)cc1[N+](=O)[O-] ZINC000017908119 944970606 /nfs/dbraw/zinc/97/06/06/944970606.db2.gz FGDZXOMUHKIYDH-SNVBAGLBSA-N 0 0 363.757 3.956 20 5 FHBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1Cn1ccnc1C(=O)c1cccs1 ZINC000506675975 944970614 /nfs/dbraw/zinc/97/06/14/944970614.db2.gz NPGPPQYMDZWKEU-UHFFFAOYSA-N 0 0 371.418 3.919 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)N[C@@H]1C[C@H]1c1ccc(Cl)cc1 ZINC000437955670 944981202 /nfs/dbraw/zinc/98/12/02/944981202.db2.gz OZYWKUMIORKICZ-JKSUJKDBSA-N 0 0 359.813 3.946 20 5 FHBDRN C[C@@H]1C[C@H]1c1ccc(CNC(=O)CCCNc2ccc([N+](=O)[O-])cc2)o1 ZINC000516535266 944987582 /nfs/dbraw/zinc/98/75/82/944987582.db2.gz ATFXPANTDWCUOY-CXAGYDPISA-N 0 0 357.410 3.820 20 5 FHBDRN CC[C@@H](C)n1ncc(NC(=O)c2ccc([N+](=O)[O-])cc2OC)c1C1CC1 ZINC000427028482 945008649 /nfs/dbraw/zinc/00/86/49/945008649.db2.gz MJAVFQFDIYGJJX-LLVKDONJSA-N 0 0 358.398 3.901 20 5 FHBDRN Cc1c([C@@H](C)NCc2ncn(Cc3cccc(F)c3)n2)cccc1[N+](=O)[O-] ZINC000437087699 945008715 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372.381 3.716 20 5 FHBDRN Cc1ccc(C(=O)NCc2ccc(F)cc2C(F)(F)F)cc1[N+](=O)[O-] ZINC000107542124 945696588 /nfs/dbraw/zinc/69/65/88/945696588.db2.gz STHSCFJFFIPVSB-UHFFFAOYSA-N 0 0 356.275 3.991 20 5 FHBDRN Cc1nnc(-c2ccc(NC(=O)[C@@H]3C[C@H]3c3ccc([N+](=O)[O-])cc3)cc2)o1 ZINC001126494963 945702310 /nfs/dbraw/zinc/70/23/10/945702310.db2.gz KUQUQCCZSIVLQF-DLBZAZTESA-N 0 0 364.361 3.695 20 5 FHBDRN C[C@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)c1c([N+](=O)[O-])cnn1C ZINC000125303892 945709167 /nfs/dbraw/zinc/70/91/67/945709167.db2.gz AYDFQVOABILMLW-CQSZACIVSA-N 0 0 364.405 3.829 20 5 FHBDRN O=C([O-])c1ccccc1CC[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000426658111 945710753 /nfs/dbraw/zinc/71/07/53/945710753.db2.gz VMEXTEPJCUWGCX-UHFFFAOYSA-N 0 0 366.373 3.885 20 5 FHBDRN CC(C)Oc1ccc(OC(=O)c2ccc3c(c2[N+](=O)[O-])OCCCO3)cc1 ZINC001126031152 945711455 /nfs/dbraw/zinc/71/14/55/945711455.db2.gz ZKIKJBLPESLMHC-UHFFFAOYSA-N 0 0 373.361 3.763 20 5 FHBDRN CCOc1cc(C(=O)N(C)[C@@H](C)CCSCC)c([N+](=O)[O-])cc1OC 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FHBDRN O=[N+]([O-])c1ccc(SCCOc2ccccc2Br)nc1 ZINC000506848553 945916301 /nfs/dbraw/zinc/91/63/01/945916301.db2.gz ZIWOZSMQHVOZOD-UHFFFAOYSA-N 0 0 355.213 3.923 20 5 FHBDRN CCCOc1ccc(NC(=O)c2cc(OC)c(OC)c([N+](=O)[O-])c2)cc1 ZINC000508464289 945935236 /nfs/dbraw/zinc/93/52/36/945935236.db2.gz BUFRGGVLVKFRHQ-UHFFFAOYSA-N 0 0 360.366 3.653 20 5 FHBDRN C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000281931376 945947546 /nfs/dbraw/zinc/94/75/46/945947546.db2.gz HJNNIDOKAQLREJ-ZCPGHIKRSA-N 0 0 372.421 3.743 20 5 FHBDRN COc1ccc(OC)c([C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])c(C)c2)c1 ZINC000015827547 945949050 /nfs/dbraw/zinc/94/90/50/945949050.db2.gz NJHXJOZPPCZOEB-SFHVURJKSA-N 0 0 370.405 3.898 20 5 FHBDRN Cc1ccc(C[C@@H]2CCCN2C(=O)Cc2ccc(F)cc2[N+](=O)[O-])cc1 ZINC001126058378 945953814 /nfs/dbraw/zinc/95/38/14/945953814.db2.gz CXOOPYGHSFFHRM-SFHVURJKSA-N 0 0 356.397 3.819 20 5 FHBDRN COC(=O)c1ccccc1NC(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000025010299 945960575 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FHBDRN O=C(c1ccccc1Oc1cccnc1)N1CCc2c1cccc2[N+](=O)[O-] ZINC000078149448 946000913 /nfs/dbraw/zinc/00/09/13/946000913.db2.gz UIJWZMQCZVMLBI-UHFFFAOYSA-N 0 0 361.357 3.985 20 5 FHBDRN CN(CCCc1ccccc1)C(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000108599556 946017668 /nfs/dbraw/zinc/01/76/68/946017668.db2.gz NEAJMIJCSUMCQX-UHFFFAOYSA-N 0 0 355.438 3.878 20 5 FHBDRN CCn1ccnc1[C@@H]1CCCCN1C(=O)c1ccc(SC)c([N+](=O)[O-])c1 ZINC000281978123 946023256 /nfs/dbraw/zinc/02/32/56/946023256.db2.gz ZBEDWRIVLMVVBG-AWEZNQCLSA-N 0 0 374.466 3.901 20 5 FHBDRN COC(=O)c1cc(NC(=O)c2[nH]c3ccccc3c2Cl)cc([N+](=O)[O-])c1 ZINC000522869437 946033874 /nfs/dbraw/zinc/03/38/74/946033874.db2.gz PDSDNXVMSSRDNO-UHFFFAOYSA-N 0 0 373.752 3.768 20 5 FHBDRN C[C@H](Cc1ccsc1)NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000108656824 946033985 /nfs/dbraw/zinc/03/39/85/946033985.db2.gz BJFXBBLAHRQDLP-CYBMUJFWSA-N 0 0 359.451 3.618 20 5 FHBDRN COc1cc(C(=O)N(Cc2ccco2)C2CCCC2)c([N+](=O)[O-])cc1OC ZINC000045467505 946051678 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3.821 20 5 FHBDRN C[C@H](CNC(=O)N1CCC(c2cccnc2)CC1)c1ccccc1[N+](=O)[O-] ZINC000897061201 946548356 /nfs/dbraw/zinc/54/83/56/946548356.db2.gz GCHVFBHNOGNHGZ-OAHLLOKOSA-N 0 0 368.437 3.683 20 5 FHBDRN COC(=O)c1cc(C(=O)N[C@@H](C)c2ccccc2SC)cc([N+](=O)[O-])c1 ZINC000441395266 946551372 /nfs/dbraw/zinc/55/13/72/946551372.db2.gz NQGANPDLULDRQO-NSHDSACASA-N 0 0 374.418 3.594 20 5 FHBDRN CCO[C@H]1C[C@@H](N(C)C(=O)c2cccc(SC)c2[N+](=O)[O-])C1(C)C ZINC000186560743 946552031 /nfs/dbraw/zinc/55/20/31/946552031.db2.gz MITFAAHCXZGHST-KGLIPLIRSA-N 0 0 352.456 3.592 20 5 FHBDRN CCCC[C@@H](COC)NC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000609927670 946552324 /nfs/dbraw/zinc/55/23/24/946552324.db2.gz AXZIVIPYRBEXHO-JTQLQIEISA-N 0 0 361.345 3.523 20 5 FHBDRN COc1c(C(=O)NCc2oc3ccc(F)cc3c2C)cccc1[N+](=O)[O-] ZINC000475178519 946554510 /nfs/dbraw/zinc/55/45/10/946554510.db2.gz RVAWIJZBKMHGMM-UHFFFAOYSA-N 0 0 358.325 3.727 20 5 FHBDRN O=C(NCc1cccc(Br)c1)Nc1cccc([N+](=O)[O-])c1 ZINC000048334116 946579103 /nfs/dbraw/zinc/57/91/03/946579103.db2.gz YZQWFJXIBPVLND-UHFFFAOYSA-N 0 0 350.172 3.679 20 5 FHBDRN CCOc1ccc2nc(NC(=O)c3cccc([N+](=O)[O-])c3OC)sc2c1 ZINC000475536954 946603555 /nfs/dbraw/zinc/60/35/55/946603555.db2.gz LKWXZURMODRNLO-UHFFFAOYSA-N 0 0 373.390 3.864 20 5 FHBDRN O=C(Nc1cccc(Cl)n1)c1cccc([N+](=O)[O-])c1Br ZINC000159147393 946605153 /nfs/dbraw/zinc/60/51/53/946605153.db2.gz RHWYEGLKAIHRJM-UHFFFAOYSA-N 0 0 356.563 3.658 20 5 FHBDRN COC(=O)[C@H](Cc1c[nH]c2ccccc12)Nc1cc(C)ccc1[N+](=O)[O-] ZINC000475531047 946607848 /nfs/dbraw/zinc/60/78/48/946607848.db2.gz VUZRKASCLBNSPB-KRWDZBQOSA-N 0 0 353.378 3.581 20 5 FHBDRN Cc1c(NC(=O)[C@@H](C)N2Cc3ccccc3C3(CC3)C2)cccc1[N+](=O)[O-] ZINC000186205692 946619482 /nfs/dbraw/zinc/61/94/82/946619482.db2.gz ZDDYIJLZVVILCP-OAHLLOKOSA-N 0 0 365.433 3.778 20 5 FHBDRN CSc1cccc(C(=O)N2CCCN(c3ccccc3)CC2)c1[N+](=O)[O-] ZINC000186207866 946620674 /nfs/dbraw/zinc/62/06/74/946620674.db2.gz RWQDRTSUJZSUTA-UHFFFAOYSA-N 0 0 371.462 3.669 20 5 FHBDRN Cc1ccc(C)c([C@H]2CCCN2C(=O)CNc2ccccc2[N+](=O)[O-])c1 ZINC000475544622 946628599 /nfs/dbraw/zinc/62/85/99/946628599.db2.gz VIWMZRYUZUHMBC-GOSISDBHSA-N 0 0 353.422 3.987 20 5 FHBDRN Cc1cc(S(=O)(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)sc1Cl ZINC000473908195 946628886 /nfs/dbraw/zinc/62/88/86/946628886.db2.gz VAVMXCDOYKGCTP-SECBINFHSA-N 0 0 360.844 3.658 20 5 FHBDRN CCc1nc(Cc2nc(Cc3c[nH]c4ccc([N+](=O)[O-])cc34)no2)cs1 ZINC000545782968 946631558 /nfs/dbraw/zinc/63/15/58/946631558.db2.gz QHLPREAKWBQDFN-UHFFFAOYSA-N 0 0 369.406 3.660 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(N2CCC[C@H]2c2nc3c(n2C)CCCC3)n1 ZINC000614771792 946656109 /nfs/dbraw/zinc/65/61/09/946656109.db2.gz SOXQPOQKVVLQIW-INIZCTEOSA-N 0 0 355.442 3.560 20 5 FHBDRN Cc1sc(C(=O)N2C[C@H](C)O[C@@H](c3ccc(F)cc3)C2)cc1[N+](=O)[O-] ZINC000151932695 946657814 /nfs/dbraw/zinc/65/78/14/946657814.db2.gz NHVYDTKLKMHIEM-ZUZCIYMTSA-N 0 0 364.398 3.706 20 5 FHBDRN CO[C@@H]1C[C@@H](NC(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1(C)C ZINC000475192499 946660912 /nfs/dbraw/zinc/66/09/12/946660912.db2.gz TZNFYZBAPFEXPM-VXGBXAGGSA-N 0 0 361.320 3.549 20 5 FHBDRN CCOc1cc(N2CCC[C@@H]2c2nc3c(n2C)CCCC3)ccc1[N+](=O)[O-] ZINC000614771732 946664766 /nfs/dbraw/zinc/66/47/66/946664766.db2.gz QMGNBTFODGTSRS-GOSISDBHSA-N 0 0 370.453 3.947 20 5 FHBDRN Cc1cnc([C@@H](C)NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)s1 ZINC000545828214 946664881 /nfs/dbraw/zinc/66/48/81/946664881.db2.gz SPNAUUVEXXVZBB-SNVBAGLBSA-N 0 0 351.403 3.654 20 5 FHBDRN COc1ccc(CN2CCC[C@H]2c2nc3c(n2C)CCCC3)cc1[N+](=O)[O-] ZINC000614771255 946666172 /nfs/dbraw/zinc/66/61/72/946666172.db2.gz CQOOMMMNIQSATI-KRWDZBQOSA-N 0 0 370.453 3.553 20 5 FHBDRN COCCOc1cccc(C(=O)Nc2cc([N+](=O)[O-])ccc2NC(C)C)c1 ZINC000456197270 946667022 /nfs/dbraw/zinc/66/70/22/946667022.db2.gz XUAGNTDAAJAZGF-UHFFFAOYSA-N 0 0 373.409 3.693 20 5 FHBDRN Cc1c(F)ccc([N+](=O)[O-])c1C(=O)N1CCC(OCCC(C)C)CC1 ZINC000843767488 946668538 /nfs/dbraw/zinc/66/85/38/946668538.db2.gz IBZDZNJIGLXCRV-UHFFFAOYSA-N 0 0 352.406 3.710 20 5 FHBDRN O=C(O[C@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)c1cc2ccccc2o1 ZINC000759927269 946672739 /nfs/dbraw/zinc/67/27/39/946672739.db2.gz CTXSKXXNJAHHOK-ZFWWWQNUSA-N 0 0 355.350 3.878 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)N[C@@H]2C[C@@H]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000428360092 946673956 /nfs/dbraw/zinc/67/39/56/946673956.db2.gz IENQCFQCBLKILJ-JCGIZDLHSA-N 0 0 353.422 3.895 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])c1ccnc(SCC(F)(F)F)c1 ZINC000112573483 946674735 /nfs/dbraw/zinc/67/47/35/946674735.db2.gz AEKGSZWRGDBKFN-UHFFFAOYSA-N 0 0 371.340 3.574 20 5 FHBDRN CCO[C@@H]1C[C@H](NC(=O)C2(c3ccc([N+](=O)[O-])cc3)CCC2)C12CCCC2 ZINC001126607374 946677824 /nfs/dbraw/zinc/67/78/24/946677824.db2.gz UEXZAUUDFCIIGG-ZWKOTPCHSA-N 0 0 372.465 3.871 20 5 FHBDRN Cc1nc2ccc(NC(=O)N3CCc4ccc([N+](=O)[O-])cc4C3)cc2o1 ZINC000088350920 946684868 /nfs/dbraw/zinc/68/48/68/946684868.db2.gz DXNODDBFGFGGNV-UHFFFAOYSA-N 0 0 352.350 3.635 20 5 FHBDRN COc1cc(CN2CCC[C@H]2c2nc3c([nH]2)CCCC3)c([N+](=O)[O-])cc1F ZINC000614777616 946689834 /nfs/dbraw/zinc/68/98/34/946689834.db2.gz NJEFECFKRSYWGW-INIZCTEOSA-N 0 0 374.416 3.682 20 5 FHBDRN COC(=O)[C@H](C)NCc1ccc(Sc2ccc(C)cc2)c([N+](=O)[O-])c1 ZINC000475203096 946716209 /nfs/dbraw/zinc/71/62/09/946716209.db2.gz LGFPKWRQCIJXMH-ZDUSSCGKSA-N 0 0 360.435 3.706 20 5 FHBDRN CN(C)C(=O)c1ccc(NC(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)cc1 ZINC000048434391 946717818 /nfs/dbraw/zinc/71/78/18/946717818.db2.gz SASCZMDGBBPVJL-UHFFFAOYSA-N 0 0 369.421 3.846 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)N1CCOCC2(CCC2)C1 ZINC000475207933 946724384 /nfs/dbraw/zinc/72/43/84/946724384.db2.gz XVONRDOBZYDOLK-UHFFFAOYSA-N 0 0 373.331 3.648 20 5 FHBDRN O=C(c1c(Cl)cccc1[N+](=O)[O-])N1CC(Cc2ccc(F)c(F)c2)C1 ZINC000444434737 946764641 /nfs/dbraw/zinc/76/46/41/946764641.db2.gz RWUBVRZOJGUTOX-UHFFFAOYSA-N 0 0 366.751 3.841 20 5 FHBDRN CC(C)OC1CCC(NC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000151993017 946774690 /nfs/dbraw/zinc/77/46/90/946774690.db2.gz BBMFGBPVIRFVPZ-UHFFFAOYSA-N 0 0 363.458 3.865 20 5 FHBDRN C[C@H](N[C@@H](c1nccn1C)c1cccc(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000128505402 946787136 /nfs/dbraw/zinc/78/71/36/946787136.db2.gz XOVPIWDTEVJVTN-SCLBCKFNSA-N 0 0 354.385 3.908 20 5 FHBDRN CCOC(=O)Nc1ccc(C(=O)OCc2cc([N+](=O)[O-])ccc2OC)cc1 ZINC000025136661 946789998 /nfs/dbraw/zinc/78/99/98/946789998.db2.gz KAVYFHJRIWXONF-UHFFFAOYSA-N 0 0 374.349 3.529 20 5 FHBDRN CCOC(=O)c1ccnc(N2CCC[C@H]2Cc2ccccc2C)c1[N+](=O)[O-] ZINC000523115569 946803839 /nfs/dbraw/zinc/80/38/39/946803839.db2.gz OVFURCSDEORHIV-INIZCTEOSA-N 0 0 369.421 3.686 20 5 FHBDRN O=[N+]([O-])c1cc(I)ccc1NCc1ccccc1 ZINC000048543820 946809813 /nfs/dbraw/zinc/80/98/13/946809813.db2.gz YDNOFRVFLJUUDQ-UHFFFAOYSA-N 0 0 354.147 3.812 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)NCc2ccc(F)cc2C(F)(F)F)c1 ZINC000067548648 946828995 /nfs/dbraw/zinc/82/89/95/946828995.db2.gz DPTOMSIWRKFKDX-UHFFFAOYSA-N 0 0 372.274 3.691 20 5 FHBDRN CCCN(CCC)C(=O)CCCC(=O)Nc1cc([N+](=O)[O-])c(C)cc1C ZINC000112268191 946835603 /nfs/dbraw/zinc/83/56/03/946835603.db2.gz YPOWFLBJOCCHPG-UHFFFAOYSA-N 0 0 363.458 3.969 20 5 FHBDRN COc1cc(-c2noc(-c3ccccc3[N+](=O)[O-])n2)ccc1OC(F)F ZINC000113005916 946846773 /nfs/dbraw/zinc/84/67/73/946846773.db2.gz LPVGXKPDUKWPEF-UHFFFAOYSA-N 0 0 363.276 3.922 20 5 FHBDRN O=[N+]([O-])c1c(F)cccc1NCCCc1nc(-c2ccc(F)cc2)no1 ZINC000302168574 946849772 /nfs/dbraw/zinc/84/97/72/946849772.db2.gz PMBCEPVXOHZYQD-UHFFFAOYSA-N 0 0 360.320 3.968 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)c1ccc(OC(F)F)cn1 ZINC000475319376 946852747 /nfs/dbraw/zinc/85/27/47/946852747.db2.gz LXFRJDVGTYPDHM-UHFFFAOYSA-N 0 0 365.336 3.642 20 5 FHBDRN CN(Cc1nc([C@@H]2CCOC3(CCCC3)C2)no1)c1ccccc1[N+](=O)[O-] ZINC000897188426 946875486 /nfs/dbraw/zinc/87/54/86/946875486.db2.gz CGBSPORLIJQDLD-CQSZACIVSA-N 0 0 372.425 3.821 20 5 FHBDRN Cc1oc(-c2ccsc2)nc1Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000112521908 946897583 /nfs/dbraw/zinc/89/75/83/946897583.db2.gz SPNCNUOFEFNUHC-UHFFFAOYSA-N 0 0 367.390 3.927 20 5 FHBDRN COc1cc(C)c(CN(C)C(=O)c2c(C)cccc2[N+](=O)[O-])cc1OC ZINC000184499764 946906581 /nfs/dbraw/zinc/90/65/81/946906581.db2.gz AGLGSUVWJUCDCA-UHFFFAOYSA-N 0 0 358.394 3.501 20 5 FHBDRN Cc1c(F)ccc([N+](=O)[O-])c1C(=O)NCc1ccc(OC2CCCC2)nc1 ZINC000843768772 946908181 /nfs/dbraw/zinc/90/81/81/946908181.db2.gz MSJHNVUBAIZCLF-UHFFFAOYSA-N 0 0 373.384 3.689 20 5 FHBDRN C[C@H](NS(=O)(=O)Cc1ccccc1[N+](=O)[O-])c1cc2ccccc2o1 ZINC000129765882 946909142 /nfs/dbraw/zinc/90/91/42/946909142.db2.gz ODFBHZGPKQCRKC-LBPRGKRZSA-N 0 0 360.391 3.522 20 5 FHBDRN CCOc1cc(C(=O)N2C[C@@H](C)CC(C)(C)C2)c([N+](=O)[O-])cc1OC ZINC000544323480 946909293 /nfs/dbraw/zinc/90/92/93/946909293.db2.gz SPOPYVXCXJCHPY-LBPRGKRZSA-N 0 0 350.415 3.510 20 5 FHBDRN NC(=O)c1ccc(CNc2ccc(Cl)c(C(F)(F)F)c2)c([N+](=O)[O-])c1 ZINC000026159308 946911226 /nfs/dbraw/zinc/91/12/26/946911226.db2.gz IQAWHZBQMBVPJG-UHFFFAOYSA-N 0 0 373.718 3.978 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@H]1C[C@H]1c1cccc(F)c1F ZINC000186324325 946912689 /nfs/dbraw/zinc/91/26/89/946912689.db2.gz NMLVPTHTLSMWKW-STQMWFEESA-N 0 0 366.751 3.946 20 5 FHBDRN CCC(=O)Nc1ccc(C)c(NC(=O)NCCc2cccc([N+](=O)[O-])c2)c1 ZINC000536284239 946916815 /nfs/dbraw/zinc/91/68/15/946916815.db2.gz WQWBMKJDHIIBSS-UHFFFAOYSA-N 0 0 370.409 3.616 20 5 FHBDRN Cc1nc(CC2CC2)oc1C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000475348067 946919692 /nfs/dbraw/zinc/91/96/92/946919692.db2.gz LQRMYHQILMDQOI-UHFFFAOYSA-N 0 0 367.308 3.697 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N[C@@H](c1ccccc1)c1ccncc1 ZINC000087062397 946919821 /nfs/dbraw/zinc/91/98/21/946919821.db2.gz KCLBPVVOLFDINZ-NRFANRHFSA-N 0 0 361.401 3.828 20 5 FHBDRN COc1ccc(CCCN(C)C(=O)c2c(C)c(F)ccc2[N+](=O)[O-])cc1 ZINC000843771411 946927899 /nfs/dbraw/zinc/92/78/99/946927899.db2.gz HFLNAELQBJVFJA-UHFFFAOYSA-N 0 0 360.385 3.756 20 5 FHBDRN Cc1c(NC(=O)c2ccc([N+](=O)[O-])cc2C)cnn1-c1ccccc1F ZINC000129779050 946930055 /nfs/dbraw/zinc/93/00/55/946930055.db2.gz MLQVOXWXWHJXQZ-UHFFFAOYSA-N 0 0 354.341 3.789 20 5 FHBDRN CC(C)CN(C(=O)Cc1ccc([N+](=O)[O-])cc1Br)C1CC1 ZINC000087065860 946935287 /nfs/dbraw/zinc/93/52/87/946935287.db2.gz ADZWEAXTKMUBON-UHFFFAOYSA-N 0 0 355.232 3.547 20 5 FHBDRN C[C@@H](Oc1ccc(F)c(F)c1)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186333769 946937028 /nfs/dbraw/zinc/93/70/28/946937028.db2.gz KPNBICRDFCCGPG-SECBINFHSA-N 0 0 370.739 3.610 20 5 FHBDRN CSCC1(CCNC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)CC1 ZINC000597988555 946941168 /nfs/dbraw/zinc/94/11/68/946941168.db2.gz ROPXSYIQQCYJNB-UHFFFAOYSA-N 0 0 366.486 3.944 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1CNc1cccc(N2C(=O)CCCC2=O)c1 ZINC000475358533 946941535 /nfs/dbraw/zinc/94/15/35/946941535.db2.gz OYDISSPXFLVQRC-UHFFFAOYSA-N 0 0 353.378 3.559 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1C[C@@H]1c1c(F)cccc1F ZINC000186337693 946949886 /nfs/dbraw/zinc/94/98/86/946949886.db2.gz PJCRKOUCXAOJTO-NWDGAFQWSA-N 0 0 366.751 3.946 20 5 FHBDRN CCn1ncc2ccc(NC(=O)c3cccc(SC)c3[N+](=O)[O-])cc21 ZINC000186335963 946950400 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COc1ccc(OC)c([C@H](C)Nc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)c1 ZINC000112963798 946998845 /nfs/dbraw/zinc/99/88/45/946998845.db2.gz YGMDJPUEZLVCPN-NSHDSACASA-N 0 0 371.393 3.670 20 5 FHBDRN CC(C)OC(=O)C[C@H](NCc1c(F)cccc1[N+](=O)[O-])c1ccccc1 ZINC000181820736 947001600 /nfs/dbraw/zinc/00/16/00/947001600.db2.gz LBHHAUSFHGGLRP-KRWDZBQOSA-N 0 0 360.385 3.907 20 5 FHBDRN Cc1cc(C(=O)N[C@@H](c2ccc(F)cc2)[C@@H]2CCCO2)cc([N+](=O)[O-])c1 ZINC000148255545 947012341 /nfs/dbraw/zinc/01/23/41/947012341.db2.gz SMNKUPWXUONXFU-ROUUACIJSA-N 0 0 358.369 3.692 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)Nc2cc(-c3ccccc3C)nn2C)c1 ZINC000074807594 947021963 /nfs/dbraw/zinc/02/19/63/947021963.db2.gz QGKVOBVSUVBPNR-UHFFFAOYSA-N 0 0 350.378 3.864 20 5 FHBDRN CC[C@H](C[C@H](C)CO)NC(=O)c1cc(F)c(Cl)c([N+](=O)[O-])c1Cl ZINC000897245283 947022592 /nfs/dbraw/zinc/02/25/92/947022592.db2.gz UPIFKNLCOVGKLR-JGVFFNPUSA-N 0 0 367.204 3.568 20 5 FHBDRN CCN(CC(C)C)C(=O)c1ccc(Cn2nc(C)c([N+](=O)[O-])c2C)cc1 ZINC000025974662 947030179 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O=[N+]([O-])c1ccc(C[NH+]2CCC(CN3CCc4ccccc43)CC2)cc1 ZINC000523582049 947397774 /nfs/dbraw/zinc/39/77/74/947397774.db2.gz GSQGMJBDRBZCLH-UHFFFAOYSA-N 0 0 351.450 3.870 20 5 FHBDRN C[C@H](C(=O)O[C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1)c1cccc(F)c1 ZINC000759931663 947406109 /nfs/dbraw/zinc/40/61/09/947406109.db2.gz LTEHCQBCQGKCRG-MAZHCROVSA-N 0 0 361.373 3.761 20 5 FHBDRN C[C@H](C(=O)O[C@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)c1cccc(F)c1 ZINC000759931667 947407576 /nfs/dbraw/zinc/40/75/76/947407576.db2.gz LTEHCQBCQGKCRG-RCBQFDQVSA-N 0 0 361.373 3.761 20 5 FHBDRN Cc1c(COC(C)(C)C)cccc1NC(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC000445015424 947416042 /nfs/dbraw/zinc/41/60/42/947416042.db2.gz UHLQUXXVINDKDO-UHFFFAOYSA-N 0 0 359.382 3.571 20 5 FHBDRN C[C@H](CNC(=O)c1cccc2c(=O)c3ccccc3[nH]c12)Oc1ccccc1 ZINC000445005465 947428546 /nfs/dbraw/zinc/42/85/46/947428546.db2.gz ROIQRAGXLCDDSH-OAHLLOKOSA-N 0 0 372.424 3.879 20 5 FHBDRN CCO[C@H](CCNC(=O)c1cccc2c(=O)c3ccccc3[nH]c12)C(C)C ZINC000445004559 947428633 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FHBDRN Cc1c(C(=O)N2C[C@@H](C)O[C@H](c3ccc(F)cc3)C2)cccc1[N+](=O)[O-] ZINC000152074836 947520233 /nfs/dbraw/zinc/52/02/33/947520233.db2.gz ZRHQJOXBOVLDRM-XIKOKIGWSA-N 0 0 358.369 3.645 20 5 FHBDRN Cc1ccc(CC(=O)NCc2ccc([N+](=O)[O-])cc2)cc1Br ZINC000188324951 947529251 /nfs/dbraw/zinc/52/92/51/947529251.db2.gz MPGHXFRADGDJPZ-UHFFFAOYSA-N 0 0 363.211 3.525 20 5 FHBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)N(Cc1ccco1)Cc1ccccc1 ZINC000016086309 947550637 /nfs/dbraw/zinc/55/06/37/947550637.db2.gz GFYWAWJNADUALV-UHFFFAOYSA-N 0 0 372.402 3.579 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N(C)Cc1cc(C(C)(C)C)n[nH]1 ZINC000445168668 947565860 /nfs/dbraw/zinc/56/58/60/947565860.db2.gz XDQGESKKYTUWIS-UHFFFAOYSA-N 0 0 359.430 3.896 20 5 FHBDRN CSC1(COC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)CCC1 ZINC000799690331 947568998 /nfs/dbraw/zinc/56/89/98/947568998.db2.gz GHGVCAQQGCQJJG-UHFFFAOYSA-N 0 0 350.440 3.638 20 5 FHBDRN COC(=O)c1sc2nc(C)nc(NCc3cccc([N+](=O)[O-])c3)c2c1C ZINC000067383878 947572606 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3.643 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)NCCC1=CCCCCC1 ZINC000184563430 947592075 /nfs/dbraw/zinc/59/20/75/947592075.db2.gz WGURGLQLHKYLND-UHFFFAOYSA-N 0 0 359.426 3.547 20 5 FHBDRN COc1ccc(CN(C)C(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)cc1O ZINC000120344854 947598415 /nfs/dbraw/zinc/59/84/15/947598415.db2.gz KSQQVENHVGLSPP-UHFFFAOYSA-N 0 0 372.421 3.879 20 5 FHBDRN CCOCCC1(CNC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CC1 ZINC000159170692 947601123 /nfs/dbraw/zinc/60/11/23/947601123.db2.gz UDMVNOFBWMVGFL-UHFFFAOYSA-N 0 0 360.332 3.550 20 5 FHBDRN Cc1csc(N(C)C(=O)Cn2c3ccccc3c(=O)c3ccccc32)n1 ZINC000643197404 947609649 /nfs/dbraw/zinc/60/96/49/947609649.db2.gz ULBBJPBIYZPINV-UHFFFAOYSA-N 0 0 363.442 3.583 20 5 FHBDRN CCCN(C(=O)c1cc2cnn(CC)c2nc1C)c1cccc([N+](=O)[O-])c1 ZINC000441462804 947611835 /nfs/dbraw/zinc/61/18/35/947611835.db2.gz CKKVHVCAEVSLST-UHFFFAOYSA-N 0 0 367.409 3.725 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N1CC=C(c2c[nH]c3ncccc23)CC1 ZINC000445253477 947628947 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FHBDRN CC(C)(C(=O)NCCc1nc2c(s1)CCCC2)c1ccc([N+](=O)[O-])cc1 ZINC000536360440 947728280 /nfs/dbraw/zinc/72/82/80/947728280.db2.gz ARPWKQWHPUPFRZ-UHFFFAOYSA-N 0 0 373.478 3.567 20 5 FHBDRN O=C(N[C@H](c1nccs1)c1ccccc1)c1cc([N+](=O)[O-])ccc1F ZINC000728850295 947738731 /nfs/dbraw/zinc/73/87/31/947738731.db2.gz RBMLVGMWMSINFR-HNNXBMFYSA-N 0 0 357.366 3.710 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])o1)N1CCC[C@@H]1c1nc2cc(Cl)ccc2[nH]1 ZINC000440730343 947740115 /nfs/dbraw/zinc/74/01/15/947740115.db2.gz JFVPIVVCBWLJCT-GFCCVEGCSA-N 0 0 360.757 3.695 20 5 FHBDRN Cc1ccc(OCC(=O)O[C@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)cc1C ZINC000759937797 947741866 /nfs/dbraw/zinc/74/18/66/947741866.db2.gz IXLWWHXJQQGZBE-IRXDYDNUSA-N 0 0 373.409 3.514 20 5 FHBDRN Cc1ccc(Oc2ccc(NC(=O)c3c(F)cccc3[N+](=O)[O-])cc2)nn1 ZINC001126223951 947756477 /nfs/dbraw/zinc/75/64/77/947756477.db2.gz VSEGRKNPIZSBNF-UHFFFAOYSA-N 0 0 368.324 3.877 20 5 FHBDRN CC(C)c1cnc(NC(=O)c2cc3c(cc2[N+](=O)[O-])OCCCO3)s1 ZINC001126230051 947780445 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20 5 FHBDRN O=C(NCCNc1ccc([N+](=O)[O-])cc1)N[C@@H]1CCC[C@@H]1c1ccccc1 ZINC000609546585 947896002 /nfs/dbraw/zinc/89/60/02/947896002.db2.gz CIWIYKFZALROAQ-RTBURBONSA-N 0 0 368.437 3.642 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(CC(C)(C)C)CC(C)(C)C ZINC000441486159 947967717 /nfs/dbraw/zinc/96/77/17/947967717.db2.gz CMLRNBKLITZRMJ-UHFFFAOYSA-N 0 0 363.458 3.763 20 5 FHBDRN CCCN(C(=O)C(=O)c1ccc2c(c1)CCC2)c1cccc([N+](=O)[O-])c1 ZINC000441486043 947968099 /nfs/dbraw/zinc/96/80/99/947968099.db2.gz MIWNXHALAIDTTA-UHFFFAOYSA-N 0 0 352.390 3.709 20 5 FHBDRN Cc1cc(OCC(=O)N(CCc2cccc(F)c2)C2CC2)ccc1[N+](=O)[O-] ZINC001126273670 947970128 /nfs/dbraw/zinc/97/01/28/947970128.db2.gz OMAUCLHUAHTVQU-UHFFFAOYSA-N 0 0 372.396 3.655 20 5 FHBDRN O=C(NCc1cc([N+](=O)[O-])ccc1Cl)N[C@@H](c1ccncc1)C1CC1 ZINC000893601956 948000499 /nfs/dbraw/zinc/00/04/99/948000499.db2.gz MENHFHXLTRBJQU-MRXNPFEDSA-N 0 0 360.801 3.594 20 5 FHBDRN CC(C)CC(=O)N1CCC(Nc2ccnc3c2cccc3[N+](=O)[O-])CC1 ZINC000432319240 948004073 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FHBDRN COc1ccc(CCNc2c(Cl)cccc2[N+](=O)[O-])c(OC)c1OC ZINC000432334351 948141672 /nfs/dbraw/zinc/14/16/72/948141672.db2.gz GGDVYXAANUWEBD-UHFFFAOYSA-N 0 0 366.801 3.929 20 5 FHBDRN CC(C)n1cnnc1[C@H]1CCCN(c2ccnc3c2cccc3[N+](=O)[O-])C1 ZINC000432335094 948144645 /nfs/dbraw/zinc/14/46/45/948144645.db2.gz ILUCYTFJAJPOAM-AWEZNQCLSA-N 0 0 366.425 3.699 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)Nc2cccc(-c3nc[nH]n3)c2)cc1[N+](=O)[O-] ZINC000512002704 948152161 /nfs/dbraw/zinc/15/21/61/948152161.db2.gz TVSOCHIWOPIWBH-UHFFFAOYSA-N 0 0 365.393 3.930 20 5 FHBDRN C[NH+](C)[C@@H](CNc1ccnc2c1cccc2[N+](=O)[O-])c1ccc(F)cc1 ZINC000432337911 948156625 /nfs/dbraw/zinc/15/66/25/948156625.db2.gz COJGDMFTJYWNCC-SFHVURJKSA-N 0 0 354.385 3.997 20 5 FHBDRN C[C@H](Nc1ccc(C(=O)N[C@@H](C)C2CC2)cc1[N+](=O)[O-])c1ccccn1 ZINC000053084444 948172984 /nfs/dbraw/zinc/17/29/84/948172984.db2.gz PNSOVRJETMVQIH-STQMWFEESA-N 0 0 354.410 3.691 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1OC(F)F)N1Cc2ccccc2C2(CC2)C1 ZINC000184684808 948178010 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FHBDRN COC(=O)c1cccc(CNc2cc(Br)cc([N+](=O)[O-])c2)c1 ZINC000585728967 948237754 /nfs/dbraw/zinc/23/77/54/948237754.db2.gz HWMHEWZJBDMXFD-UHFFFAOYSA-N 0 0 365.183 3.756 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1OC[C@H]1COc2ccccc2O1 ZINC000585732229 948241226 /nfs/dbraw/zinc/24/12/26/948241226.db2.gz DQHYDUUNZWTQTK-NSHDSACASA-N 0 0 366.167 3.576 20 5 FHBDRN COC(=O)c1cc(C(=O)N[C@@H](c2ccccc2)C2CCC2)cc([N+](=O)[O-])c1 ZINC000520534356 948241864 /nfs/dbraw/zinc/24/18/64/948241864.db2.gz AAXORVDYKUTDNE-SFHVURJKSA-N 0 0 368.389 3.653 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)[C@H](C)Cn2ncc3ccccc32)cc1[N+](=O)[O-] ZINC000585745496 948251310 /nfs/dbraw/zinc/25/13/10/948251310.db2.gz KKNNYBUTIUFZKF-HUUCEWRRSA-N 0 0 366.421 3.766 20 5 FHBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N[C@H]2CCCC[C@H]2c2ccccc2)c1 ZINC000512036151 948255115 /nfs/dbraw/zinc/25/51/15/948255115.db2.gz DXZTXCKGNPFDQA-ROUUACIJSA-N 0 0 360.435 3.600 20 5 FHBDRN Cc1ccccc1C(=O)NCC(=O)Nc1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000585750752 948257017 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3.656 20 5 FHBDRN CCC(C)(C)[C@H]1CCCN1C(=O)c1cc(OC)c(OC)c([N+](=O)[O-])c1 ZINC000441587957 948321074 /nfs/dbraw/zinc/32/10/74/948321074.db2.gz RGVGWBDREJZTOY-OAHLLOKOSA-N 0 0 350.415 3.653 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CC(C)(C)O[C@@H]2CCC[C@H]21 ZINC000441596586 948332306 /nfs/dbraw/zinc/33/23/06/948332306.db2.gz ITWXQRXZALZAJL-KBAYOESNSA-N 0 0 360.454 3.722 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CC(C)(C)O[C@@H]2CCC[C@H]21 ZINC000441612349 948358960 /nfs/dbraw/zinc/35/89/60/948358960.db2.gz ONOSCQLNKFRTTB-DAXOMENPSA-N 0 0 364.467 3.634 20 5 FHBDRN O=C(NCC[C@H]1CCCS1(=O)=O)c1c2ccccc2cc2ccccc21 ZINC000893634749 948359895 /nfs/dbraw/zinc/35/98/95/948359895.db2.gz APJAWNQTJDNTAF-QGZVFWFLSA-N 0 0 367.470 3.690 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)Nc2nc(/C=C\c3ccccc3)cs2)n1 ZINC000427600567 948361008 /nfs/dbraw/zinc/36/10/08/948361008.db2.gz UNCMWIATNYWEGL-HJWRWDBZSA-N 0 0 369.406 3.690 20 5 FHBDRN C[C@@H](C(=O)N1Cc2ccccc2OC(C)(C)C1)c1cccc([N+](=O)[O-])c1 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CC(C)Oc1cc(O)ccc1NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000432464285 948494967 /nfs/dbraw/zinc/49/49/67/948494967.db2.gz YBDIXTMSEIALEP-UHFFFAOYSA-N 0 0 364.785 3.922 20 5 FHBDRN O=C1CC[C@H]2CN(Cc3cc([N+](=O)[O-])cc4c3OCOC4)c3cccc1c32 ZINC000184798411 948547366 /nfs/dbraw/zinc/54/73/66/948547366.db2.gz FIEXMPVIHWZDCT-LBPRGKRZSA-N 0 0 366.373 3.542 20 5 FHBDRN CC[C@@H](C)[C@@H](C)N(C(=O)COc1ccc([N+](=O)[O-])c2cccnc12)C1CC1 ZINC000432488411 948563339 /nfs/dbraw/zinc/56/33/39/948563339.db2.gz FJEKZLARVTYKQL-ZIAGYGMSSA-N 0 0 371.437 3.947 20 5 FHBDRN CC[C@H]1CCc2nc(NC(=O)c3ccc([N+](=O)[O-])c(OC)c3)sc2C1 ZINC000512155952 948577845 /nfs/dbraw/zinc/57/78/45/948577845.db2.gz LMTURYXSDKQYBQ-JTQLQIEISA-N 0 0 361.423 3.827 20 5 FHBDRN C[C@H](c1nc(-c2ccnc(OC(F)F)c2)no1)c1cccc([N+](=O)[O-])c1 ZINC000571087045 948581463 /nfs/dbraw/zinc/58/14/63/948581463.db2.gz XDQACWUCKLMXIK-VIFPVBQESA-N 0 0 362.292 3.793 20 5 FHBDRN CS(=O)(=O)c1ccc(Sc2c(F)cc(F)cc2F)c([N+](=O)[O-])c1 ZINC000054125351 948589688 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COC(=O)c1ccc(-c2noc(C(C)(C)c3ccccc3[N+](=O)[O-])n2)cc1 ZINC000427631344 948743714 /nfs/dbraw/zinc/74/37/14/948743714.db2.gz QNXDZKWERZUESL-UHFFFAOYSA-N 0 0 367.361 3.757 20 5 FHBDRN COc1ccc(C(=O)NC2(c3ccc(F)cc3F)CCC2)cc1[N+](=O)[O-] ZINC000536493110 948744957 /nfs/dbraw/zinc/74/49/57/948744957.db2.gz MNJGXOKRPTYMCZ-UHFFFAOYSA-N 0 0 362.332 3.691 20 5 FHBDRN CC(C)CN(C(=O)Cc1ccc([N+](=O)[O-])cc1Br)C(C)C ZINC000087139869 948748237 /nfs/dbraw/zinc/74/82/37/948748237.db2.gz KHRJXMWDLSQWED-UHFFFAOYSA-N 0 0 357.248 3.793 20 5 FHBDRN C[C@H]1CN(C(=O)c2ccccc2Sc2ccccc2[N+](=O)[O-])[C@@H](C)CO1 ZINC000440743767 948754735 /nfs/dbraw/zinc/75/47/35/948754735.db2.gz BFXHMDJEEKVHDG-KBPBESRZSA-N 0 0 372.446 3.995 20 5 FHBDRN CCCC1CCC(NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000520733138 948761220 /nfs/dbraw/zinc/76/12/20/948761220.db2.gz HMIHXKTYNDYRQA-UHFFFAOYSA-N 0 0 356.426 3.869 20 5 FHBDRN Cc1cc(OCC(=O)N2CCC(Cc3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000021587334 948761352 /nfs/dbraw/zinc/76/13/52/948761352.db2.gz USNSCXQEYJZFQS-UHFFFAOYSA-N 0 0 368.433 3.763 20 5 FHBDRN O=[N+]([O-])c1cc(F)ccc1-c1nc(-c2ccc(-c3nnco3)cc2)no1 ZINC000445406031 948773377 /nfs/dbraw/zinc/77/33/77/948773377.db2.gz VDWQWFOZKZGHGM-UHFFFAOYSA-N 0 0 353.269 3.501 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1C(=O)O[C@H](C)C(=O)Nc1ccccc1Cl ZINC000026121516 948787895 /nfs/dbraw/zinc/78/78/95/948787895.db2.gz XFVMCPWDMRHGGW-LLVKDONJSA-N 0 0 362.769 3.741 20 5 FHBDRN CCOc1cc(-c2noc(/C=C\c3cccc([N+](=O)[O-])c3)n2)ccc1O ZINC000445419048 948802289 /nfs/dbraw/zinc/80/22/89/948802289.db2.gz PULJTBSVOPBQRW-TWGQIWQCSA-N 0 0 353.334 3.920 20 5 FHBDRN CCOc1cc(NC(=O)CC[C@H]2CCCCO2)c([N+](=O)[O-])cc1OCC ZINC000609498060 948811554 /nfs/dbraw/zinc/81/15/54/948811554.db2.gz MRIIBUVCHRYMHB-CYBMUJFWSA-N 0 0 366.414 3.680 20 5 FHBDRN Cc1ccccc1[C@H]1CN(C(=O)NCc2cccc([N+](=O)[O-])c2)[C@H](C)CO1 ZINC000073900256 948816217 /nfs/dbraw/zinc/81/62/17/948816217.db2.gz TYEQBXBNIHFUAB-DNVCBOLYSA-N 0 0 369.421 3.575 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]cc(-c3nc(-c4cnn(-c5ccccc5)c4)no3)c2c1 ZINC000445435382 948818045 /nfs/dbraw/zinc/81/80/45/948818045.db2.gz IZBPJKPINIQHAX-UHFFFAOYSA-N 0 0 372.344 3.979 20 5 FHBDRN CCc1c(C(=O)Nc2cccc([N+](=O)[O-])c2)cnn1-c1ccc(OC)cc1 ZINC000184819414 948818751 /nfs/dbraw/zinc/81/87/51/948818751.db2.gz CYWSNVSJMHOOCI-UHFFFAOYSA-N 0 0 366.377 3.604 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCC(=O)c2ccc(NC(=O)C(C)C)cc2)c1 ZINC000021616168 948818809 /nfs/dbraw/zinc/81/88/09/948818809.db2.gz FQQFVNJPXRMCRL-UHFFFAOYSA-N 0 0 356.378 3.759 20 5 FHBDRN Cn1c(=O)c2c3c(sc2nc1SCc1ccccc1[N+](=O)[O-])CCC3 ZINC000005570688 203810912 /nfs/dbraw/zinc/81/09/12/203810912.db2.gz YATPJQSIQSMARD-UHFFFAOYSA-N 0 0 373.459 3.684 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@H]1c1ccncc1 ZINC000027275788 203884086 /nfs/dbraw/zinc/88/40/86/203884086.db2.gz XGLVQSXTDZAPCP-GUYCJALGSA-N 0 0 357.435 3.834 20 5 FHBDRN Cc1ccc(NC(=O)COc2cccc([N+](=O)[O-])c2)cc1Br ZINC000006061721 204235694 /nfs/dbraw/zinc/23/56/94/204235694.db2.gz BBSHSSUHYTWFBD-UHFFFAOYSA-N 0 0 365.183 3.683 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NCC(=O)Nc1cccc(Cl)c1Cl ZINC000007952714 204311893 /nfs/dbraw/zinc/31/18/93/204311893.db2.gz WUYBTRNEANVTJD-UHFFFAOYSA-N 0 0 370.192 3.961 20 5 FHBDRN COC(=O)c1cc(C(=O)N[C@H](C)c2cccc(Cl)c2)cc([N+](=O)[O-])c1 ZINC000008033970 204315829 /nfs/dbraw/zinc/31/58/29/204315829.db2.gz CMIZNEWOAYFTDR-SNVBAGLBSA-N 0 0 362.769 3.526 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N[C@H](C)CCCC(C)C)cc1OC ZINC000028241003 204878699 /nfs/dbraw/zinc/87/86/99/204878699.db2.gz IGYWLYPPAGIZMN-CYBMUJFWSA-N 0 0 352.431 3.947 20 5 FHBDRN COc1ccc(C(=O)Nc2cccc(OC(F)(F)F)c2)cc1[N+](=O)[O-] ZINC000031075085 204915022 /nfs/dbraw/zinc/91/50/22/204915022.db2.gz HQEFMFRGOWXHBN-UHFFFAOYSA-N 0 0 356.256 3.754 20 5 FHBDRN CC[C@]1(c2ccc(Cl)cc2)NC(=O)N(Cc2ccccc2[N+](=O)[O-])C1=O ZINC000041098478 205088502 /nfs/dbraw/zinc/08/85/02/205088502.db2.gz PWIQOVFINCHXPB-GOSISDBHSA-N 0 0 373.796 3.606 20 5 FHBDRN CC[C@]1(c2ccc(Cl)cc2)NC(=O)N(Cc2cccc([N+](=O)[O-])c2)C1=O ZINC000041098484 205088735 /nfs/dbraw/zinc/08/87/35/205088735.db2.gz KOGPNUJEYUJXMM-GOSISDBHSA-N 0 0 373.796 3.606 20 5 FHBDRN CC[C@@]1(c2ccc(Cl)cc2)NC(=O)N(Cc2ccccc2[N+](=O)[O-])C1=O ZINC000041098475 205088755 /nfs/dbraw/zinc/08/87/55/205088755.db2.gz PWIQOVFINCHXPB-SFHVURJKSA-N 0 0 373.796 3.606 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(NC(=O)[C@H]2C[C@@H]2C)cc1 ZINC000041776008 205091830 /nfs/dbraw/zinc/09/18/30/205091830.db2.gz DVRFDGWEADWDNF-LRDDRELGSA-N 0 0 353.378 3.750 20 5 FHBDRN Cc1c(C(=O)Nc2ccc(Cl)c(C(=O)N(C)C)c2)cccc1[N+](=O)[O-] ZINC000041933055 205093207 /nfs/dbraw/zinc/09/32/07/205093207.db2.gz KLDSDVJEJWGKFG-UHFFFAOYSA-N 0 0 361.785 3.511 20 5 FHBDRN Cc1cc(C(=O)N[C@H](c2nc3ccccc3[nH]2)C(C)C)ccc1[N+](=O)[O-] ZINC000045673853 205123084 /nfs/dbraw/zinc/12/30/84/205123084.db2.gz NOVUTHQHJWWLGZ-KRWDZBQOSA-N 0 0 352.394 3.907 20 5 FHBDRN COc1ccc(OC)c([C@H](C)NC(=O)Nc2cc([N+](=O)[O-])ccc2C)c1 ZINC000043149140 205100637 /nfs/dbraw/zinc/10/06/37/205100637.db2.gz FVDZWZHJCKZSOA-LBPRGKRZSA-N 0 0 359.382 3.803 20 5 FHBDRN COc1ccc(OC)c([C@@H](C)NC(=O)Nc2cc([N+](=O)[O-])ccc2C)c1 ZINC000043149141 205100965 /nfs/dbraw/zinc/10/09/65/205100965.db2.gz FVDZWZHJCKZSOA-GFCCVEGCSA-N 0 0 359.382 3.803 20 5 FHBDRN COc1ccc(OC)c([C@@H](C)NC(=O)Nc2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000043147415 205101041 /nfs/dbraw/zinc/10/10/41/205101041.db2.gz PXUJEMIPNIRBSA-GFCCVEGCSA-N 0 0 359.382 3.803 20 5 FHBDRN O=C(Nc1cccc(C(F)(F)F)c1)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000046304934 205136113 /nfs/dbraw/zinc/13/61/13/205136113.db2.gz RVOIHJGFYVNCEQ-UHFFFAOYSA-N 0 0 350.256 3.742 20 5 FHBDRN C[C@H](c1ccncc1)N(C)C(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000047277726 205145122 /nfs/dbraw/zinc/14/51/22/205145122.db2.gz RIURVJQMKJWYRK-MRXNPFEDSA-N 0 0 371.440 3.769 20 5 FHBDRN COc1cc(C(=O)N2CCc3ccc([N+](=O)[O-])cc32)ccc1OC(C)C ZINC000054757939 205203570 /nfs/dbraw/zinc/20/35/70/205203570.db2.gz HBAVHEZTPNQFOP-UHFFFAOYSA-N 0 0 356.378 3.594 20 5 FHBDRN Cc1cc(F)ccc1NC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000052955040 205189044 /nfs/dbraw/zinc/18/90/44/205189044.db2.gz TZHNJDNXLAYZIQ-UHFFFAOYSA-N 0 0 354.341 3.695 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)N[C@@H](c1ccc(F)cc1)[C@H]1CCCO1 ZINC000056352180 205229436 /nfs/dbraw/zinc/22/94/36/205229436.db2.gz GFSPQXXZRYAFLR-SJORKVTESA-N 0 0 359.357 3.776 20 5 FHBDRN CC[C@H]1CCc2nc(NC(=O)COc3ccc([N+](=O)[O-])cc3)sc2C1 ZINC000059318107 205280542 /nfs/dbraw/zinc/28/05/42/205280542.db2.gz COWWFELZWUWYPG-NSHDSACASA-N 0 0 361.423 3.584 20 5 FHBDRN Cc1c(C(=O)N[C@H](c2ccc3c(c2)OCCO3)C2CC2)cccc1[N+](=O)[O-] ZINC000059852334 205283310 /nfs/dbraw/zinc/28/33/10/205283310.db2.gz ZVHAIXHUIJPRLE-IBGZPJMESA-N 0 0 368.389 3.556 20 5 FHBDRN CCCN(C(=O)Cc1ccc([N+](=O)[O-])cc1)[C@H]1CCc2ccccc2C1 ZINC000065883278 205361452 /nfs/dbraw/zinc/36/14/52/205361452.db2.gz FBUXROMZSVOHOI-FQEVSTJZSA-N 0 0 352.434 3.933 20 5 FHBDRN CC(C)C(=O)Nc1ccc(N[C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000067472000 205373509 /nfs/dbraw/zinc/37/35/09/205373509.db2.gz AKJRIYQTKCGQTF-ZDUSSCGKSA-N 0 0 370.409 3.628 20 5 FHBDRN COc1ccc(COc2ccc([N+](=O)[O-])cc2)c(Br)c1OC ZINC000071971001 205457452 /nfs/dbraw/zinc/45/74/52/205457452.db2.gz RCEQNXDWPZEHJW-UHFFFAOYSA-N 0 0 368.183 3.954 20 5 FHBDRN O=c1oc2ccc([N+](=O)[O-])cc2n1Cc1csc(-c2ccc(F)cc2)n1 ZINC000097121496 205898719 /nfs/dbraw/zinc/89/87/19/205898719.db2.gz YFRZBCPIVMJZOQ-UHFFFAOYSA-N 0 0 371.349 3.814 20 5 FHBDRN CC(=O)Nc1cc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)ccc1F ZINC000042664735 206001415 /nfs/dbraw/zinc/00/14/15/206001415.db2.gz ZTHMZVBETLYTRW-UHFFFAOYSA-N 0 0 351.721 3.598 20 5 FHBDRN CCOc1cc(NC(=O)c2ccc(F)c(F)c2)c([N+](=O)[O-])cc1OCC ZINC000119114954 206106238 /nfs/dbraw/zinc/10/62/38/206106238.db2.gz PHPZRTRTZJHQCJ-UHFFFAOYSA-N 0 0 366.320 3.923 20 5 FHBDRN CSc1ccccc1NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000122893230 206114386 /nfs/dbraw/zinc/11/43/86/206114386.db2.gz ZQVLSWDHYLABKH-UHFFFAOYSA-N 0 0 354.391 3.755 20 5 FHBDRN O=C(COc1cc(F)ccc1[N+](=O)[O-])c1cccc(Br)c1 ZINC000007758126 206244488 /nfs/dbraw/zinc/24/44/88/206244488.db2.gz HBBIOWSAPGKPAO-UHFFFAOYSA-N 0 0 354.131 3.758 20 5 FHBDRN C[C@H](Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])c1ccccc1Cl ZINC000008054099 206246208 /nfs/dbraw/zinc/24/62/08/206246208.db2.gz ZWMVVDGQRZKSKN-JTQLQIEISA-N 0 0 354.815 3.825 20 5 FHBDRN COc1ccc(C(=O)Nc2ccc(C)cc2Br)cc1[N+](=O)[O-] ZINC000006287294 206242190 /nfs/dbraw/zinc/24/21/90/206242190.db2.gz ZKIKODCJFOFFAQ-UHFFFAOYSA-N 0 0 365.183 3.927 20 5 FHBDRN CNc1ccc(C(=O)NCc2cccc(C(F)(F)F)c2)cc1[N+](=O)[O-] ZINC000015976906 206316787 /nfs/dbraw/zinc/31/67/87/206316787.db2.gz NIJSCSGJSCWZCX-UHFFFAOYSA-N 0 0 353.300 3.585 20 5 FHBDRN O=C(Nc1ccccc1)NC1CCN(c2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000054981237 132303178 /nfs/dbraw/zinc/30/31/78/132303178.db2.gz VKIRGUVLTIKMHP-UHFFFAOYSA-N 0 0 358.373 3.524 20 5 FHBDRN Cc1ccc(NC(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1Cl ZINC000018172924 132373836 /nfs/dbraw/zinc/37/38/36/132373836.db2.gz HFBYWJLSEYIAFE-UHFFFAOYSA-N 0 0 374.828 3.911 20 5 FHBDRN O=[N+]([O-])c1c(F)cccc1N1CCC(c2nc(-c3ccccn3)no2)CC1 ZINC000079089620 132377373 /nfs/dbraw/zinc/37/73/73/132377373.db2.gz FZRWNKNQVDLNIL-UHFFFAOYSA-N 0 0 369.356 3.563 20 5 FHBDRN CCN(CC)C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000066325472 136136849 /nfs/dbraw/zinc/13/68/49/136136849.db2.gz VJGLGTIIOUDILW-UHFFFAOYSA-N 0 0 373.375 3.698 20 5 FHBDRN Cc1oc(C2CC2)nc1C(=O)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452865427 567828814 /nfs/dbraw/zinc/82/88/14/567828814.db2.gz XCMMBBFKACFIJE-OAHLLOKOSA-N 0 0 355.394 3.788 20 5 FHBDRN Cc1ccc(C(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)c(O)c1C ZINC000452867963 567834115 /nfs/dbraw/zinc/83/41/15/567834115.db2.gz YFTHXJMTPKWXKU-MRXNPFEDSA-N 0 0 354.406 3.937 20 5 FHBDRN Cc1cnc(CCCC(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)o1 ZINC000452868304 567838245 /nfs/dbraw/zinc/83/82/45/567838245.db2.gz PPXPIDRJWPTKNM-MRXNPFEDSA-N 0 0 357.410 3.620 20 5 FHBDRN Cc1nc(CCNC(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)sc1C ZINC000150805630 567843465 /nfs/dbraw/zinc/84/34/65/567843465.db2.gz UAPFIPZQHUZAOF-LBPRGKRZSA-N 0 0 362.455 3.579 20 5 FHBDRN COc1ccc(NC(=O)N2C[C@@H](C)C[C@@H]2c2cccnc2)cc1[N+](=O)[O-] ZINC000541797125 567867170 /nfs/dbraw/zinc/86/71/70/567867170.db2.gz SVJMBEASKALZEC-SWLSCSKDSA-N 0 0 356.382 3.613 20 5 FHBDRN CC(C)(C)Oc1cccc(CCC(=O)N2CCc3cc([N+](=O)[O-])ccc32)n1 ZINC000159189134 567900413 /nfs/dbraw/zinc/90/04/13/567900413.db2.gz YUGMVXHYJPHPGE-UHFFFAOYSA-N 0 0 369.421 3.689 20 5 FHBDRN O=C(c1ccc(Cl)cc1O)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452890756 567903616 /nfs/dbraw/zinc/90/36/16/567903616.db2.gz VAKXGPOTAZJQRG-ZDUSSCGKSA-N 0 0 360.797 3.974 20 5 FHBDRN O=[N+]([O-])c1ccc(SC[C@@H](O)Cc2ccc(C(F)(F)F)cc2)nc1 ZINC000159183254 567907168 /nfs/dbraw/zinc/90/71/68/567907168.db2.gz CPDACAKPKWNTEH-ZDUSSCGKSA-N 0 0 358.341 3.704 20 5 FHBDRN CC(C)Oc1cccc([C@H](C)NC(=O)COc2ccccc2[N+](=O)[O-])c1 ZINC000481413817 567908291 /nfs/dbraw/zinc/90/82/91/567908291.db2.gz LROMAMYUFLUIOU-AWEZNQCLSA-N 0 0 358.394 3.638 20 5 FHBDRN Cc1ccc(OCC(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000452893654 567909535 /nfs/dbraw/zinc/90/95/35/567909535.db2.gz XGFYHZKTOCRTKV-KRWDZBQOSA-N 0 0 354.406 3.688 20 5 FHBDRN COc1ccc(CCC(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000452890553 567911146 /nfs/dbraw/zinc/91/11/46/567911146.db2.gz UUHLCMREIIQZRG-GOSISDBHSA-N 0 0 368.433 3.942 20 5 FHBDRN C[C@@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1)c1nccn1-c1ccccc1 ZINC000481429360 567924893 /nfs/dbraw/zinc/92/48/93/567924893.db2.gz WMYRISBZDDRSPF-CYBMUJFWSA-N 0 0 351.366 3.663 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)N2CCC[C@H](C3CC3)C2)cc1SC ZINC000290993559 567926231 /nfs/dbraw/zinc/92/62/31/567926231.db2.gz VLRCCSKBCNMTKH-LBPRGKRZSA-N 0 0 350.440 3.588 20 5 FHBDRN COC(=O)c1ccc([C@H](NCc2ccccc2[N+](=O)[O-])C(F)(F)F)cc1 ZINC000481432510 567928560 /nfs/dbraw/zinc/92/85/60/567928560.db2.gz GLZRYSOQBACGRN-HNNXBMFYSA-N 0 0 368.311 3.775 20 5 FHBDRN O=[N+]([O-])c1ccccc1NCCc1noc(-c2cc3[nH]ccc3s2)n1 ZINC000568136793 567931046 /nfs/dbraw/zinc/93/10/46/567931046.db2.gz BVQWWSCPPKPQRV-UHFFFAOYSA-N 0 0 355.379 3.842 20 5 FHBDRN O=C(NCCCc1c[nH]c2ccccc12)Nc1ccc([N+](=O)[O-])cc1F ZINC000541833495 567933406 /nfs/dbraw/zinc/93/34/06/567933406.db2.gz FVQLJPDYYLXNQK-UHFFFAOYSA-N 0 0 356.357 3.970 20 5 FHBDRN O=[N+]([O-])c1cccc(CS(=O)(=O)NC2(Cc3ccccc3)CCCC2)c1 ZINC000541826910 567936173 /nfs/dbraw/zinc/93/61/73/567936173.db2.gz IAOFDAMYQYVACJ-UHFFFAOYSA-N 0 0 374.462 3.570 20 5 FHBDRN O=[N+]([O-])c1ccc(SC[C@H](O)COc2ccc3ccccc3c2)nc1 ZINC000159191301 567946254 /nfs/dbraw/zinc/94/62/54/567946254.db2.gz NTBRNLBAXYEQES-MRXNPFEDSA-N 0 0 356.403 3.675 20 5 FHBDRN Cc1sc(C(=O)N2CCC[C@@H](c3c[nH]c4ncccc34)C2)cc1[N+](=O)[O-] ZINC000602198283 567950522 /nfs/dbraw/zinc/95/05/22/567950522.db2.gz OYHPOUYVILJAGJ-GFCCVEGCSA-N 0 0 370.434 3.861 20 5 FHBDRN COc1cc(C(=O)N[C@H]2C[C@H](c3ccc(F)cc3)C2)cc([N+](=O)[O-])c1C ZINC000481447393 567953878 /nfs/dbraw/zinc/95/38/78/567953878.db2.gz UNPRICYKVNMWCD-SAZUREKKSA-N 0 0 358.369 3.727 20 5 FHBDRN CC(C)(CCc1noc(C[C@@H](O)c2cc(Cl)cc(Cl)c2)n1)[N+](=O)[O-] ZINC000291014066 567957948 /nfs/dbraw/zinc/95/79/48/567957948.db2.gz BOGMFZJMHUQALE-GFCCVEGCSA-N 0 0 374.224 3.640 20 5 FHBDRN CC(C)(CCc1noc(Cc2ccc(F)cc2Br)n1)[N+](=O)[O-] ZINC000291019174 567964090 /nfs/dbraw/zinc/96/40/90/567964090.db2.gz CCWNDRLJAVLAOD-UHFFFAOYSA-N 0 0 372.194 3.550 20 5 FHBDRN Cc1oc(-c2ccccc2)nc1CC(=O)NCc1cccc([N+](=O)[O-])c1C ZINC000481470142 567965506 /nfs/dbraw/zinc/96/55/06/567965506.db2.gz ALKYJUVVVXBOHE-UHFFFAOYSA-N 0 0 365.389 3.726 20 5 FHBDRN Cc1c(CNC(=O)c2cccc([C@H]3CCCOC3)c2)cccc1[N+](=O)[O-] ZINC000481472506 567967695 /nfs/dbraw/zinc/96/76/95/567967695.db2.gz KQFGBTFCGBEDDB-SFHVURJKSA-N 0 0 354.406 3.727 20 5 FHBDRN Cc1c(CNC(=O)c2ccc(F)cc2C(F)(F)F)cccc1[N+](=O)[O-] ZINC000481469794 567970246 /nfs/dbraw/zinc/97/02/46/567970246.db2.gz UYEZEEWWFYREHA-UHFFFAOYSA-N 0 0 356.275 3.991 20 5 FHBDRN Cc1c(CNC(=O)c2cc(F)cc(Br)c2)cccc1[N+](=O)[O-] ZINC000481465914 567970394 /nfs/dbraw/zinc/97/03/94/567970394.db2.gz NYZKJIMEGAFOHF-UHFFFAOYSA-N 0 0 367.174 3.735 20 5 FHBDRN Cc1c(CNC(=O)CSc2ccccc2Cl)cccc1[N+](=O)[O-] ZINC000481475770 567975437 /nfs/dbraw/zinc/97/54/37/567975437.db2.gz SIXGYVUSUZSQLQ-UHFFFAOYSA-N 0 0 350.827 3.965 20 5 FHBDRN Cc1c(CNC(=O)CCc2cn(C)c3ccccc23)cccc1[N+](=O)[O-] ZINC000481479264 567977406 /nfs/dbraw/zinc/97/74/06/567977406.db2.gz KOTZQXLNSPXLAG-UHFFFAOYSA-N 0 0 351.406 3.644 20 5 FHBDRN Cc1nc(-c2ccccc2)oc1C(=O)NCc1cccc([N+](=O)[O-])c1C ZINC000481473661 567977534 /nfs/dbraw/zinc/97/75/34/567977534.db2.gz IHJJJKGLSGGMIZ-UHFFFAOYSA-N 0 0 351.362 3.797 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1C[C@@H](C)O[C@@H]1C ZINC000412649789 567980267 /nfs/dbraw/zinc/98/02/67/567980267.db2.gz JWIZZJWMVRFJGA-UPJWGTAASA-N 0 0 352.456 3.640 20 5 FHBDRN CC(C)c1cc(CNCc2cc(Br)c([N+](=O)[O-])s2)on1 ZINC000602544998 567990056 /nfs/dbraw/zinc/99/00/56/567990056.db2.gz KDSKFHWHQYFWSP-UHFFFAOYSA-N 0 0 360.233 3.820 20 5 FHBDRN CC(C)(CCc1noc(C[C@H](c2ccccc2)C(F)(F)F)n1)[N+](=O)[O-] ZINC000291051825 567991073 /nfs/dbraw/zinc/99/10/73/567991073.db2.gz IINUUAXBXJQFOZ-GFCCVEGCSA-N 0 0 357.332 3.946 20 5 FHBDRN C[C@H]1CCCN(c2cc(C(=O)N(C)c3ccc([N+](=O)[O-])cc3)ccn2)C1 ZINC000291053033 567991393 /nfs/dbraw/zinc/99/13/93/567991393.db2.gz CEXALFBAUSDGHN-AWEZNQCLSA-N 0 0 354.410 3.503 20 5 FHBDRN CO[C@H](c1ccc(F)cc1)[C@H](C)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602583517 567994044 /nfs/dbraw/zinc/99/40/44/567994044.db2.gz XVBABKPRXGJLGT-VOJFVSQTSA-N 0 0 359.357 3.741 20 5 FHBDRN Cc1nc(-c2ccc(CCNc3c([N+](=O)[O-])c(C)nn3C)cc2)cs1 ZINC000051476565 567994863 /nfs/dbraw/zinc/99/48/63/567994863.db2.gz MJIRZEUCWDSHJN-UHFFFAOYSA-N 0 0 357.439 3.723 20 5 FHBDRN CSc1ccc(O[C@H](C)c2nc(CCC(C)(C)[N+](=O)[O-])no2)cc1 ZINC000291061646 568008908 /nfs/dbraw/zinc/00/89/08/568008908.db2.gz KAWZNAQEADDJLJ-LLVKDONJSA-N 0 0 351.428 3.919 20 5 FHBDRN Cc1cc(C)n(Cc2cccc(-c3nc(CCC(C)(C)[N+](=O)[O-])no3)c2)n1 ZINC000291090123 568021447 /nfs/dbraw/zinc/02/14/47/568021447.db2.gz PFCNRUYTLQIBJK-UHFFFAOYSA-N 0 0 369.425 3.586 20 5 FHBDRN COCc1cc(OCCOc2ccccc2[N+](=O)[O-])c2cc(F)ccc2n1 ZINC000568332054 568025234 /nfs/dbraw/zinc/02/52/34/568025234.db2.gz FYDBFVLVNGITMO-UHFFFAOYSA-N 0 0 372.352 3.886 20 5 FHBDRN O=[N+]([O-])c1cc(F)c(CSc2n[nH]c(-c3ccccc3O)n2)c(F)c1 ZINC000436604104 568033906 /nfs/dbraw/zinc/03/39/06/568033906.db2.gz IWCLUQHIUNUHQL-UHFFFAOYSA-N 0 0 364.333 3.656 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(-c2nc(-c3nccnc3SCC)no2)c1 ZINC000568452421 568039389 /nfs/dbraw/zinc/03/93/89/568039389.db2.gz XLZWNGUFBNWMEJ-UHFFFAOYSA-N 0 0 373.394 3.613 20 5 FHBDRN COc1ccc2c(c1)C1(CC1)CN(C(=O)Cc1cccc([N+](=O)[O-])c1C)C2 ZINC000568454644 568039782 /nfs/dbraw/zinc/03/97/82/568039782.db2.gz YQOAOJPWOGGOLI-UHFFFAOYSA-N 0 0 366.417 3.528 20 5 FHBDRN CC(=O)Nc1cccc([C@@H](C)NC(=O)[C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000568466266 568040715 /nfs/dbraw/zinc/04/07/15/568040715.db2.gz RALOWVBXAFIRBW-CHWSQXEVSA-N 0 0 355.394 3.534 20 5 FHBDRN Cc1cc(-c2nc(CCC(C)(C)[N+](=O)[O-])no2)c2c(n1)onc2C(C)C ZINC000291104203 568047498 /nfs/dbraw/zinc/04/74/98/568047498.db2.gz RUBQOTUCJQMAMV-UHFFFAOYSA-N 0 0 359.386 3.693 20 5 FHBDRN Cn1cccc1[C@H]1CCCN1C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000072905335 568057063 /nfs/dbraw/zinc/05/70/63/568057063.db2.gz KUJOQQMQMZDZPM-GOSISDBHSA-N 0 0 368.437 3.511 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)NCCc1cccc(OC)c1OC ZINC000568570940 568057180 /nfs/dbraw/zinc/05/71/80/568057180.db2.gz OBRCVEMTMVXVTP-UHFFFAOYSA-N 0 0 373.409 3.539 20 5 FHBDRN CC(C)(CCc1noc(-c2ccc(F)cc2Br)n1)[N+](=O)[O-] ZINC000291126240 568058768 /nfs/dbraw/zinc/05/87/68/568058768.db2.gz VPZUQSPDRAPECS-UHFFFAOYSA-N 0 0 358.167 3.626 20 5 FHBDRN CCC[C@H]([NH2+]C[C@H](O)COc1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000481582669 568060501 /nfs/dbraw/zinc/06/05/01/568060501.db2.gz OUBXAUBAHOMQOU-HKUYNNGSSA-N 0 0 362.401 3.605 20 5 FHBDRN CCOCCCNC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000024735321 568063727 /nfs/dbraw/zinc/06/37/27/568063727.db2.gz GPUZFGWZBDVLJP-UHFFFAOYSA-N 0 0 360.435 3.902 20 5 FHBDRN COc1cc(C(=O)NC[C@@H]2CCC3(CCCCC3)O2)cc([N+](=O)[O-])c1C ZINC000481630141 568071426 /nfs/dbraw/zinc/07/14/26/568071426.db2.gz OUJUBSZSMDRRBI-HNNXBMFYSA-N 0 0 362.426 3.524 20 5 FHBDRN O=C(NC[C@H]1CCC2(CCCCC2)O1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000481628597 568071765 /nfs/dbraw/zinc/07/17/65/568071765.db2.gz OXQKBJJNPYQTRM-MRXNPFEDSA-N 0 0 373.453 3.781 20 5 FHBDRN CCOc1ccc(C(=O)NC[C@H]2CCC3(CCCCC3)O2)cc1[N+](=O)[O-] ZINC000481623544 568072078 /nfs/dbraw/zinc/07/20/78/568072078.db2.gz NGQYNYKKJLMEJO-OAHLLOKOSA-N 0 0 362.426 3.605 20 5 FHBDRN CC(=O)Nc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2F)c(Cl)c1 ZINC000067944996 568082357 /nfs/dbraw/zinc/08/23/57/568082357.db2.gz RNQUXGDAUMWHSE-UHFFFAOYSA-N 0 0 351.721 3.598 20 5 FHBDRN COc1cc(OC[C@@H](O)COc2ccccc2C(C)C)ccc1[N+](=O)[O-] ZINC000481705804 568090303 /nfs/dbraw/zinc/09/03/03/568090303.db2.gz WBLIEUBMYWAKSS-CQSZACIVSA-N 0 0 361.394 3.546 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(N(C)CCCc2cc(-c3ccc(F)cc3)n[nH]2)n1 ZINC000481705717 568091000 /nfs/dbraw/zinc/09/10/00/568091000.db2.gz VVGADVIFNOEARU-UHFFFAOYSA-N 0 0 369.400 3.896 20 5 FHBDRN COc1ccc(C(=O)Nc2cc(Br)ccc2C)cc1[N+](=O)[O-] ZINC000043288842 568091540 /nfs/dbraw/zinc/09/15/40/568091540.db2.gz WVQHLXYJHQOXGI-UHFFFAOYSA-N 0 0 365.183 3.927 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1OC[C@H](O)Cc1ccc2ccccc2c1 ZINC000481703865 568095034 /nfs/dbraw/zinc/09/50/34/568095034.db2.gz LRMUNNCSKZDZJS-GOSISDBHSA-N 0 0 353.374 3.739 20 5 FHBDRN CC(=O)c1cc([N+](=O)[O-])ccc1OC[C@H](O)Cc1ccc2ccccc2c1 ZINC000481729446 568098281 /nfs/dbraw/zinc/09/82/81/568098281.db2.gz XBDUWTUZEPJMET-LJQANCHMSA-N 0 0 365.385 3.933 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2ncn(C[C@H](O)Cc3ccc4ccccc4c3)n2)cc1 ZINC000481735246 568100085 /nfs/dbraw/zinc/10/00/85/568100085.db2.gz YJWMTHQIETZSGM-HXUWFJFHSA-N 0 0 374.400 3.610 20 5 FHBDRN CC(C)Oc1nc(N[C@@H]2CCO[C@@H](c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000568647623 568106901 /nfs/dbraw/zinc/10/69/01/568106901.db2.gz USVGLXQOAIKQFC-NVXWUHKLSA-N 0 0 357.410 3.531 20 5 FHBDRN COCCC1(CNC(=O)c2cc(Cl)cc(Cl)c2[N+](=O)[O-])CCC1 ZINC000291329467 568115468 /nfs/dbraw/zinc/11/54/68/568115468.db2.gz LGBFRCFDINQKRG-UHFFFAOYSA-N 0 0 361.225 3.838 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(N2CCCC2)cn1 ZINC000481771110 568119212 /nfs/dbraw/zinc/11/92/12/568119212.db2.gz ABGNVZDCJWBARM-UHFFFAOYSA-N 0 0 372.450 3.954 20 5 FHBDRN C[C@@H]1C[C@@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2O1 ZINC000452983037 568119552 /nfs/dbraw/zinc/11/95/52/568119552.db2.gz BWOMKPBFWRTJJO-BDJLRTHQSA-N 0 0 360.797 3.819 20 5 FHBDRN CCc1oc2ccccc2c1CN(C)S(=O)(=O)c1cccc([N+](=O)[O-])c1 ZINC000216364009 568119960 /nfs/dbraw/zinc/11/99/60/568119960.db2.gz JWMAKHVDKWBQSM-UHFFFAOYSA-N 0 0 374.418 3.724 20 5 FHBDRN CC[C@@H](Oc1ccccc1F)C(=O)N1c2ccc([N+](=O)[O-])cc2C[C@@H]1C ZINC000481773990 568123539 /nfs/dbraw/zinc/12/35/39/568123539.db2.gz CMYQYDKFOMNXFE-YVEFUNNKSA-N 0 0 358.369 3.869 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C(C)C)[C@H](CO)C(C)C ZINC000452980372 568123704 /nfs/dbraw/zinc/12/37/04/568123704.db2.gz INJCYBSAOSCICZ-NVXWUHKLSA-N 0 0 368.499 3.726 20 5 FHBDRN Cc1ccc(Oc2ccccc2)c(NC(=O)c2cc([N+](=O)[O-])nn2C)c1 ZINC000481798534 568127723 /nfs/dbraw/zinc/12/77/23/568127723.db2.gz VCPLYPVABWDXOY-UHFFFAOYSA-N 0 0 352.350 3.681 20 5 FHBDRN Cc1ccnc(NCCNc2ccc([N+](=O)[O-])cc2)c1Br ZINC000584671890 568128907 /nfs/dbraw/zinc/12/89/07/568128907.db2.gz PZAJHBFIIYEVPH-UHFFFAOYSA-N 0 0 351.204 3.585 20 5 FHBDRN CSc1ccc(C(=O)NC[C@@H]2CCN(c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000024813430 568130628 /nfs/dbraw/zinc/13/06/28/568130628.db2.gz QXULWHDDUDTDCP-AWEZNQCLSA-N 0 0 371.462 3.573 20 5 FHBDRN COc1cccc(C(=O)N2CCC(c3ccccc3F)CC2)c1[N+](=O)[O-] ZINC000568713670 568136035 /nfs/dbraw/zinc/13/60/35/568136035.db2.gz YYVNDUXEHQXMHS-UHFFFAOYSA-N 0 0 358.369 3.762 20 5 FHBDRN CC[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)CCO1 ZINC000481831958 568138553 /nfs/dbraw/zinc/13/85/53/568138553.db2.gz VZOOAEGGLWHODB-OAHLLOKOSA-N 0 0 372.446 3.997 20 5 FHBDRN CC[C@@H]1CCC[C@@H](NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C1 ZINC000128691364 568139847 /nfs/dbraw/zinc/13/98/47/568139847.db2.gz SYAHCTQEJLDRIB-NVXWUHKLSA-N 0 0 359.470 3.896 20 5 FHBDRN O=C(NC[C@@H]1CCC2(CCCCC2)O1)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000481876973 568140484 /nfs/dbraw/zinc/14/04/84/568140484.db2.gz VNWAFWCBUDINCY-AWEZNQCLSA-N 0 0 357.410 3.688 20 5 FHBDRN Cn1nc([N+](=O)[O-])cc1C(=O)N(Cc1ccccc1)c1ccc(Cl)cc1 ZINC000481867206 568163847 /nfs/dbraw/zinc/16/38/47/568163847.db2.gz LJXNHOSGNYXDSX-UHFFFAOYSA-N 0 0 370.796 3.829 20 5 FHBDRN COC1(CNC(=O)NC(C)(C)c2ccccc2[N+](=O)[O-])CCC(C)CC1 ZINC000490366320 568183408 /nfs/dbraw/zinc/18/34/08/568183408.db2.gz JKEIXHDOESQWLQ-UHFFFAOYSA-N 0 0 363.458 3.724 20 5 FHBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])NCc1ccccc1Cl ZINC000481918388 568183802 /nfs/dbraw/zinc/18/38/02/568183802.db2.gz FTUXVJUKQTYFBZ-UHFFFAOYSA-N 0 0 368.220 3.944 20 5 FHBDRN O=C(Nc1ccc(-c2nnco2)cc1)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000481930306 568189684 /nfs/dbraw/zinc/18/96/84/568189684.db2.gz JNGUJFXJAUAFLV-UHFFFAOYSA-N 0 0 350.290 3.643 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)CCc1nc(C2CCCC2)no1 ZINC000291527089 568192632 /nfs/dbraw/zinc/19/26/32/568192632.db2.gz ZELOXMVNZQCZGD-UHFFFAOYSA-N 0 0 358.398 3.769 20 5 FHBDRN COCCOc1cc(C)ccc1NC(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000603986931 568195162 /nfs/dbraw/zinc/19/51/62/568195162.db2.gz YASMCTIYNCLFGG-UHFFFAOYSA-N 0 0 370.361 3.927 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)c1ccc2c(c1)OCO2 ZINC000481954785 568196892 /nfs/dbraw/zinc/19/68/92/568196892.db2.gz YGTHCIYWNLMOFN-NSHDSACASA-N 0 0 374.418 3.927 20 5 FHBDRN CCCc1ccc(-c2nc(NC(=O)c3n[nH]cc3[N+](=O)[O-])sc2C)cc1 ZINC000159367123 568196981 /nfs/dbraw/zinc/19/69/81/568196981.db2.gz XHAGCXPLEOFTDV-UHFFFAOYSA-N 0 0 371.422 3.955 20 5 FHBDRN CCOc1ccccc1N(C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000159364122 568196983 /nfs/dbraw/zinc/19/69/83/568196983.db2.gz STJCVLJLVVXKMT-UHFFFAOYSA-N 0 0 354.366 3.680 20 5 FHBDRN O=[N+]([O-])c1ccc(NCCCc2cccs2)c(F)c1N1CCOCC1 ZINC000568782461 568209406 /nfs/dbraw/zinc/20/94/06/568209406.db2.gz RCVFFWYRXNTRFQ-UHFFFAOYSA-N 0 0 365.430 3.677 20 5 FHBDRN COC(=O)c1ccc(C)c(NC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)c1 ZINC000007471790 568234701 /nfs/dbraw/zinc/23/47/01/568234701.db2.gz WQEHTJAURQPZCY-LBPRGKRZSA-N 0 0 374.418 3.809 20 5 FHBDRN O=C(N[C@@H]1CCCOc2c(F)cccc21)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000482034286 568234956 /nfs/dbraw/zinc/23/49/56/568234956.db2.gz AKSMAZVRKYXSAG-MRXNPFEDSA-N 0 0 369.352 3.859 20 5 FHBDRN COc1ccc(CNC(=O)c2ccc(Oc3ccccc3)o2)cc1[N+](=O)[O-] ZINC000482038007 568235825 /nfs/dbraw/zinc/23/58/25/568235825.db2.gz FKRBRCLMLCPLDS-UHFFFAOYSA-N 0 0 368.345 3.919 20 5 FHBDRN CCc1cc(NC(=O)c2cn(C)nc2C2CC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000291641826 568236555 /nfs/dbraw/zinc/23/65/55/568236555.db2.gz GHNSCNQZEGORDF-UHFFFAOYSA-N 0 0 365.393 3.569 20 5 FHBDRN C[C@H]1[C@@H](Cc2ccccc2)CCN1c1cc2nc[nH]c(=O)c2cc1[N+](=O)[O-] ZINC000568864392 568238614 /nfs/dbraw/zinc/23/86/14/568238614.db2.gz JIOBEAQGDCFCKI-DZGCQCFKSA-N 0 0 364.405 3.701 20 5 FHBDRN CCOc1ccc(C(=O)NC[C@H]([NH3+])c2ccc(C(C)C)cc2)cc1[N+](=O)[O-] ZINC000236906214 568248028 /nfs/dbraw/zinc/24/80/28/568248028.db2.gz RZPBUVOHRVTIQV-KRWDZBQOSA-N 0 0 371.437 3.547 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(NCc2ccc(C(=O)N3CCCCC3)cc2)n1 ZINC000541933651 568250656 /nfs/dbraw/zinc/25/06/56/568250656.db2.gz XSRYWVRGEZMQMO-UHFFFAOYSA-N 0 0 368.437 3.845 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)NCc1ccc(C2CC2)cc1F ZINC000568912527 568251965 /nfs/dbraw/zinc/25/19/65/568251965.db2.gz VQJITNFUUDDKBL-UHFFFAOYSA-N 0 0 358.369 3.940 20 5 FHBDRN Cc1cccc(NC(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])c1Br ZINC000291664928 568252509 /nfs/dbraw/zinc/25/25/09/568252509.db2.gz LDOFIZGDNFGFNB-UHFFFAOYSA-N 0 0 367.203 3.765 20 5 FHBDRN O=C(COc1ccccc1[N+](=O)[O-])N1C[C@@H](c2ccccc2)C2(CCC2)C1 ZINC000412664823 568254986 /nfs/dbraw/zinc/25/49/86/568254986.db2.gz DDZNUIREVHXAAP-KRWDZBQOSA-N 0 0 366.417 3.770 20 5 FHBDRN COc1ccc2c(c1)C[C@@H](C)N(C(=O)Cc1ccccc1[N+](=O)[O-])[C@H]2C ZINC000541934610 568258347 /nfs/dbraw/zinc/25/83/47/568258347.db2.gz RCGGSGOLASMRBF-KGLIPLIRSA-N 0 0 354.406 3.680 20 5 FHBDRN Cc1noc(C)c1CCC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000181957758 568262675 /nfs/dbraw/zinc/26/26/75/568262675.db2.gz LYNOXMKMUPCYRU-UHFFFAOYSA-N 0 0 357.288 3.790 20 5 FHBDRN Cc1noc([C@H](C)N(C)Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)n1 ZINC000569001868 568262971 /nfs/dbraw/zinc/26/29/71/568262971.db2.gz NFYBRZIRANPIOM-JTQLQIEISA-N 0 0 359.411 3.603 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)N[C@@H]1CCCOc2ccccc21 ZINC000568995916 568265484 /nfs/dbraw/zinc/26/54/84/568265484.db2.gz FSQJGJJDPXCVEP-QGZVFWFLSA-N 0 0 369.421 3.693 20 5 FHBDRN Cc1ccc(NCCCNC(=O)Nc2ccc(Cl)cn2)c([N+](=O)[O-])c1 ZINC000482098545 568267986 /nfs/dbraw/zinc/26/79/86/568267986.db2.gz TYDCJCMISFBODE-UHFFFAOYSA-N 0 0 363.805 3.575 20 5 FHBDRN CC(C)N(CC(=O)N[C@@H]1CCC[C@@H](C)[C@H]1C)Cc1ccc([N+](=O)[O-])cc1 ZINC000604411542 568272183 /nfs/dbraw/zinc/27/21/83/568272183.db2.gz HNCGMOULNALHPG-GPMSIDNRSA-N 0 0 361.486 3.746 20 5 FHBDRN CN(Cc1ccc(Br)s1)C(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000007980732 568273455 /nfs/dbraw/zinc/27/34/55/568273455.db2.gz HMXJBOIJUOLOOS-UHFFFAOYSA-N 0 0 369.240 3.620 20 5 FHBDRN O=C(NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)c1cccc(Cl)c1F ZINC000569045760 568275877 /nfs/dbraw/zinc/27/58/77/568275877.db2.gz CWKRGKGASABMEH-UHFFFAOYSA-N 0 0 361.760 3.841 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1CC(C)(C)[C@H]1c1ccccc1 ZINC000604374200 568276851 /nfs/dbraw/zinc/27/68/51/568276851.db2.gz PVFHCBICHSTCDK-QGZVFWFLSA-N 0 0 360.435 3.675 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)NC[C@@H]2CC3CCC2CC3)cc1SC ZINC000569104473 568277223 /nfs/dbraw/zinc/27/72/23/568277223.db2.gz IUORBXDTBWCELW-BPCQOVAHSA-N 0 0 364.467 3.881 20 5 FHBDRN CC[C@@H](C)n1ncc(NC(=O)N(C)CCc2ccccc2[N+](=O)[O-])c1C ZINC000482143769 568284986 /nfs/dbraw/zinc/28/49/86/568284986.db2.gz SMHYDYBTYAWNTA-CYBMUJFWSA-N 0 0 359.430 3.777 20 5 FHBDRN CC(C)(C)C[C@@H](NC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)C(F)(F)F ZINC000482142442 568288477 /nfs/dbraw/zinc/28/84/77/568288477.db2.gz PDZNCMDOOVAKLE-LLVKDONJSA-N 0 0 358.320 3.568 20 5 FHBDRN Cc1cccc(OC[C@@H](O)CNc2cc(C)nc3c2cccc3[N+](=O)[O-])c1 ZINC000302004464 568300989 /nfs/dbraw/zinc/30/09/89/568300989.db2.gz KFNGVIWDQMAPQN-HNNXBMFYSA-N 0 0 367.405 3.612 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)c(N2CCN(Cc3cccnc3)CC2)c(Cl)c1 ZINC000302032109 568301510 /nfs/dbraw/zinc/30/15/10/568301510.db2.gz NREJVFBTGOKFHT-UHFFFAOYSA-N 0 0 367.236 3.619 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCCO[C@H]1CC(C)C ZINC000482181733 568302392 /nfs/dbraw/zinc/30/23/92/568302392.db2.gz OBSNORBQXWXBBF-QRQLOZEOSA-N 0 0 362.470 3.873 20 5 FHBDRN O=C(c1cc(Br)ccc1F)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000029251150 568304462 /nfs/dbraw/zinc/30/44/62/568304462.db2.gz ZKCFCTOJRCHXCS-UHFFFAOYSA-N 0 0 365.158 3.699 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2noc(Cc3cncn3Cc3ccccc3)n2)s1 ZINC000569175637 568304688 /nfs/dbraw/zinc/30/46/88/568304688.db2.gz SOZCGIZSFZHWKI-UHFFFAOYSA-N 0 0 367.390 3.542 20 5 FHBDRN C[C@](O)(C1CCN(c2nccc3c2cccc3[N+](=O)[O-])CC1)C(F)(F)F ZINC000569189175 568306928 /nfs/dbraw/zinc/30/69/28/568306928.db2.gz PNTRHRZXPULJRP-INIZCTEOSA-N 0 0 369.343 3.673 20 5 FHBDRN CCc1nn(C)c(N[C@H]2CCC[C@@H](c3nc4ccccc4[nH]3)C2)c1[N+](=O)[O-] ZINC000569217566 568313289 /nfs/dbraw/zinc/31/32/89/568313289.db2.gz QULOYSIBPLWFMB-OLZOCXBDSA-N 0 0 368.441 3.905 20 5 FHBDRN Cc1c(N[C@@H]2CCN([C@@H](C)c3ccc(F)cc3)C2=O)cccc1[N+](=O)[O-] ZINC000453064193 568319810 /nfs/dbraw/zinc/31/98/10/568319810.db2.gz ONKWOAKAYOIUEH-SUMWQHHRSA-N 0 0 357.385 3.816 20 5 FHBDRN COc1cc(C(=O)NCC2(c3ccccc3Cl)CC2)ccc1[N+](=O)[O-] ZINC000482221158 568321161 /nfs/dbraw/zinc/32/11/61/568321161.db2.gz OAGPZZMYEJZZLU-UHFFFAOYSA-N 0 0 360.797 3.718 20 5 FHBDRN Cc1nn(CC(=O)N[C@@H](c2ccccc2)C2CCCCC2)c(C)c1[N+](=O)[O-] ZINC000031799273 568340179 /nfs/dbraw/zinc/34/01/79/568340179.db2.gz ODAYOWZBEVQTFZ-IBGZPJMESA-N 0 0 370.453 3.846 20 5 FHBDRN COc1ccc(COc2ccc(Br)cc2OC)cc1[N+](=O)[O-] ZINC000319719308 568347252 /nfs/dbraw/zinc/34/72/52/568347252.db2.gz WZIOJDAAZFIBNE-UHFFFAOYSA-N 0 0 368.183 3.954 20 5 FHBDRN O=[N+]([O-])c1cc(F)ccc1N1CCC[C@H](c2nc(C(F)(F)F)c[nH]2)C1 ZINC000584699391 568349086 /nfs/dbraw/zinc/34/90/86/568349086.db2.gz VNXOVSUUCOYMNG-VIFPVBQESA-N 0 0 358.295 3.860 20 5 FHBDRN CCNC(=O)Nc1c(C)cccc1NC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000584704565 568349563 /nfs/dbraw/zinc/34/95/63/568349563.db2.gz ICLAJAGIVCBBRF-CYBMUJFWSA-N 0 0 370.409 3.787 20 5 FHBDRN COc1cc(Cc2noc(-c3cccc(C)c3)n2)c([N+](=O)[O-])c(OC)c1 ZINC000569311354 568364526 /nfs/dbraw/zinc/36/45/26/568364526.db2.gz IQCYSZMLCZNOED-UHFFFAOYSA-N 0 0 355.350 3.561 20 5 FHBDRN Cc1cc(N2CC[C@H]([C@H]3CCOC3)C2)c(Br)cc1[N+](=O)[O-] ZINC000408297861 568367651 /nfs/dbraw/zinc/36/76/51/568367651.db2.gz MBJARZBHYZCYAD-RYUDHWBXSA-N 0 0 355.232 3.529 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1CC=C(c2ccc(Cl)nc2)CC1 ZINC000365255037 568372248 /nfs/dbraw/zinc/37/22/48/568372248.db2.gz GQRWRTQFUSUQFX-UHFFFAOYSA-N 0 0 373.796 3.581 20 5 FHBDRN C[C@@]1(F)CCCN(c2nc(N3CCC[C@](C)(F)C3)sc2[N+](=O)[O-])C1 ZINC000569315499 568375962 /nfs/dbraw/zinc/37/59/62/568375962.db2.gz QJJJQSHTIWESKF-CABCVRRESA-N 0 0 360.430 3.708 20 5 FHBDRN COc1ccc(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)cc1[N+](=O)[O-] ZINC000542000406 568379262 /nfs/dbraw/zinc/37/92/62/568379262.db2.gz HSDXNUXIVUYBSU-UHFFFAOYSA-N 0 0 364.423 3.702 20 5 FHBDRN CC(C)n1cnnc1S[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000005506197 568390446 /nfs/dbraw/zinc/39/04/46/568390446.db2.gz CZSIRDLNEFUYOX-SNVBAGLBSA-N 0 0 360.399 3.671 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N2CC[C@H](C)c3ccccc32)c1C ZINC000032444319 568390541 /nfs/dbraw/zinc/39/05/41/568390541.db2.gz BXKBXQXLXPDZPZ-LBPRGKRZSA-N 0 0 360.435 3.914 20 5 FHBDRN COC(=O)c1ccccc1OCCSCCc1ccc([N+](=O)[O-])cc1 ZINC000542003714 568390898 /nfs/dbraw/zinc/39/08/98/568390898.db2.gz GCOUSNDRPDQXQF-UHFFFAOYSA-N 0 0 361.419 3.736 20 5 FHBDRN CCn1c(C)nc([N+](=O)[O-])c1Nc1ccc(Br)c(OC)c1 ZINC000569465947 568399441 /nfs/dbraw/zinc/39/94/41/568399441.db2.gz ZVVURNHWLLIULO-UHFFFAOYSA-N 0 0 355.192 3.634 20 5 FHBDRN CCc1ccccc1NC(=O)CN(C)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000541998848 568399459 /nfs/dbraw/zinc/39/94/59/568399459.db2.gz OEAGSCCRNDOJIK-UHFFFAOYSA-N 0 0 361.829 3.881 20 5 FHBDRN CCC[C@H](NC(=O)c1c[nH]nc1[N+](=O)[O-])c1ccc(Cl)c(Cl)c1 ZINC000569475569 568401917 /nfs/dbraw/zinc/40/19/17/568401917.db2.gz ZRUGLFNVQKQDRR-LBPRGKRZSA-N 0 0 357.197 3.896 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)NC[C@H]1CC[C@H](c2ccccc2)O1 ZINC000569500296 568403781 /nfs/dbraw/zinc/40/37/81/568403781.db2.gz SCWJFYUPUAMHQD-SJLPKXTDSA-N 0 0 372.446 3.723 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CSc1ccc2c(c1)OCCCO2 ZINC000006436724 568406941 /nfs/dbraw/zinc/40/69/41/568406941.db2.gz MLEZHFAVBTVIBT-UHFFFAOYSA-N 0 0 374.418 3.795 20 5 FHBDRN CCc1nnc(CNc2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])s1 ZINC000569559614 568407541 /nfs/dbraw/zinc/40/75/41/568407541.db2.gz AWSCMOMPRJQPCW-UHFFFAOYSA-N 0 0 368.418 3.852 20 5 FHBDRN CC(C)c1[nH+]c(CNCc2nc3cc([N+](=O)[O-])ccc3[nH]2)c2ccccn21 ZINC000569582097 568408361 /nfs/dbraw/zinc/40/83/61/568408361.db2.gz XRRGUUTXOZUDGP-UHFFFAOYSA-N 0 0 364.409 3.532 20 5 FHBDRN CC(C)Sc1ccc(Cn2cnc3sc([N+](=O)[O-])cc3c2=O)cc1 ZINC000569692890 568411846 /nfs/dbraw/zinc/41/18/46/568411846.db2.gz VCBKJSJTOXHLHY-UHFFFAOYSA-N 0 0 361.448 3.915 20 5 FHBDRN COc1cc(C)c(NC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)cc1C ZINC000569711197 568413331 /nfs/dbraw/zinc/41/33/31/568413331.db2.gz RITZTGSBOKSZEQ-UHFFFAOYSA-N 0 0 357.410 3.927 20 5 FHBDRN COc1ccc2oc(-c3nc(-c4ccc(N)c([N+](=O)[O-])c4)no3)c(C)c2c1 ZINC000569773581 568423055 /nfs/dbraw/zinc/42/30/55/568423055.db2.gz RIYAWXGRSKWICS-UHFFFAOYSA-N 0 0 366.333 3.957 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NCCCN(CC)c2ccccc2)c1 ZINC000569815775 568427209 /nfs/dbraw/zinc/42/72/09/568427209.db2.gz DVQGLIHAIHBYDP-UHFFFAOYSA-N 0 0 371.437 3.640 20 5 FHBDRN C[C@@H]1C[C@H](CCNC(=O)c2c([N+](=O)[O-])cccc2C(F)(F)F)CCO1 ZINC000569859498 568431009 /nfs/dbraw/zinc/43/10/09/568431009.db2.gz VAPDDDLQDIQLFW-GHMZBOCLSA-N 0 0 360.332 3.549 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)N2CC(C)(C)[C@H]2[C@H]2CCCO2)cc1[N+](=O)[O-] ZINC000569895463 568434615 /nfs/dbraw/zinc/43/46/15/568434615.db2.gz PYKANNVLMVQYGW-IAOVAPTHSA-N 0 0 361.442 3.563 20 5 FHBDRN CCOc1cccc(N2CCC(Oc3cc(C)ccn3)CC2)c1[N+](=O)[O-] ZINC000570014768 568440765 /nfs/dbraw/zinc/44/07/65/568440765.db2.gz HZDMZOBKIGJQEF-UHFFFAOYSA-N 0 0 357.410 3.745 20 5 FHBDRN C[C@@H](C(=O)Nc1ccc(Br)cc1O)c1cccc([N+](=O)[O-])c1 ZINC000570025958 568441821 /nfs/dbraw/zinc/44/18/21/568441821.db2.gz CDBHOOUDEFYAMM-SECBINFHSA-N 0 0 365.183 3.805 20 5 FHBDRN COc1ccc([C@@H](C)NC(=O)CSc2ccc([N+](=O)[O-])cc2)cc1F ZINC000007074481 568441900 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CCc1cccc(CC)c1NC(=O)COc1cc(OC)ccc1[N+](=O)[O-] ZINC000570160576 568457383 /nfs/dbraw/zinc/45/73/83/568457383.db2.gz GCEGNXQHVHBOAK-UHFFFAOYSA-N 0 0 358.394 3.746 20 5 FHBDRN O=C(NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)[C@@H]1C[C@]1(F)c1ccccc1 ZINC000570179866 568459529 /nfs/dbraw/zinc/45/95/29/568459529.db2.gz CEDWRYFBGPIVTN-PXNSSMCTSA-N 0 0 367.380 3.620 20 5 FHBDRN COc1ccc(CC(=O)N2CC(C)(C)[C@@H]2c2cccs2)cc1[N+](=O)[O-] ZINC000570238666 568465088 /nfs/dbraw/zinc/46/50/88/568465088.db2.gz SIKOYWYEPKXNOC-KRWDZBQOSA-N 0 0 360.435 3.817 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])c([O-])c1)N1C[C@@H](c2ccccc2)C2(CCC2)C1 ZINC000412680026 568474384 /nfs/dbraw/zinc/47/43/84/568474384.db2.gz SJSUDCQIULGNEQ-INIZCTEOSA-N 0 0 352.390 3.710 20 5 FHBDRN COc1cc(CN2CC[C@H](C(F)(F)F)C2(C)C)c([N+](=O)[O-])cc1F ZINC000330990750 568476992 /nfs/dbraw/zinc/47/69/92/568476992.db2.gz SFVOYWPUZOJQAT-ZDUSSCGKSA-N 0 0 350.312 3.905 20 5 FHBDRN Cn1cc(C(F)(F)F)nc1[C@H]1CCCN(c2c(F)cccc2[N+](=O)[O-])C1 ZINC000570538071 568485533 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FHBDRN Cc1ccc(NS(=O)(=O)c2cc(Cl)c(C)c([N+](=O)[O-])c2)c(F)c1 ZINC000007419254 568505605 /nfs/dbraw/zinc/50/56/05/568505605.db2.gz ODPAHZKRVCZAAM-UHFFFAOYSA-N 0 0 358.778 3.805 20 5 FHBDRN CCc1ccccc1NS(=O)(=O)c1cc(Cl)c(C)c([N+](=O)[O-])c1 ZINC000007420208 568505799 /nfs/dbraw/zinc/50/57/99/568505799.db2.gz NYWUAQXJWRYQJP-UHFFFAOYSA-N 0 0 354.815 3.920 20 5 FHBDRN CCOC(=O)Cc1csc(Sc2ccc(C(C)=O)cc2[N+](=O)[O-])n1 ZINC000007466901 568519733 /nfs/dbraw/zinc/51/97/33/568519733.db2.gz LEFRLGRPCZCXFQ-UHFFFAOYSA-N 0 0 366.420 3.511 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1OCC(=O)N[C@H](CC(C)C)c1ccccc1 ZINC000007510119 568525420 /nfs/dbraw/zinc/52/54/20/568525420.db2.gz SJPSVQRIAQVSDT-QGZVFWFLSA-N 0 0 372.421 3.886 20 5 FHBDRN CC(C)N1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)CC1 ZINC000049657047 568553028 /nfs/dbraw/zinc/55/30/28/568553028.db2.gz PODAZFZSQGBKIU-UHFFFAOYSA-N 0 0 369.421 3.553 20 5 FHBDRN O=C(c1ccn(-c2cccc([N+](=O)[O-])c2)n1)N1CCCCc2ccccc21 ZINC000049726955 568575279 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371.422 3.778 20 5 FHBDRN CC[C@H](Nc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-])c1ccc(F)cc1F ZINC000736367316 599528327 /nfs/dbraw/zinc/52/83/27/599528327.db2.gz AIBLYVYKAXGFIT-ZDUSSCGKSA-N 0 0 360.324 3.616 20 5 FHBDRN Cc1cccc([C@@H]2CCCN2c2ccc([N+](=O)[O-])cc2-c2nn[nH]n2)c1C ZINC000822299673 599577766 /nfs/dbraw/zinc/57/77/66/599577766.db2.gz QOKIENQKRIDQNL-KRWDZBQOSA-N 0 0 364.409 3.733 20 5 FHBDRN C[C@@H](CNc1ccc(/C=C/C(=O)[O-])cc1[N+](=O)[O-])[N@H+](C)Cc1ccccc1 ZINC000736606909 600239578 /nfs/dbraw/zinc/23/95/78/600239578.db2.gz NDBDJUCVJZUXOF-GDXASINISA-N 0 0 369.421 3.625 20 5 FHBDRN CC[C@](C)(CC(=O)[O-])[NH2+]Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000828664633 601432358 /nfs/dbraw/zinc/43/23/58/601432358.db2.gz DHDWZRLLEVHTRG-GOSISDBHSA-N 0 0 362.382 3.596 20 5 FHBDRN CCCC[N@H+](C)CC1CCN(c2cc(C)c([N+](=O)[O-])c(C(=O)[O-])c2)CC1 ZINC000567980107 601545091 /nfs/dbraw/zinc/54/50/91/601545091.db2.gz MKAHGDOQRRDRGE-UHFFFAOYSA-N 0 0 363.458 3.550 20 5 FHBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](c1ccccc1)[C@H](C)C(=O)[O-] ZINC000827058535 601657929 /nfs/dbraw/zinc/65/79/29/601657929.db2.gz IWMSLXDDIHIPHC-LIRRHRJNSA-N 0 0 372.421 3.934 20 5 FHBDRN O=[N+]([O-])c1ccc(NC[C@H]2CCC[C@H](C(F)(F)F)C2)c(-c2nn[nH]n2)c1 ZINC000823640060 606596023 /nfs/dbraw/zinc/59/60/23/606596023.db2.gz QSFWOTYPYDXZNW-UWVGGRQHSA-N 0 0 370.335 3.556 20 5 FHBDRN O=[N+]([O-])c1c(-c2nn[nH]n2)ccnc1Oc1ccc(Cl)c2ccccc12 ZINC000823630285 607162069 /nfs/dbraw/zinc/16/20/69/607162069.db2.gz VVUZDDJZJGSUQK-UHFFFAOYSA-N 0 0 368.740 3.769 20 5 FHBDRN CC(=O)N(c1nnc(S[C@H](C)c2ccccc2[N+](=O)[O-])s1)C1CC1 ZINC000078958806 936320829 /nfs/dbraw/zinc/32/08/29/936320829.db2.gz KROHJFNKYQRLRH-SECBINFHSA-N 0 0 364.452 3.815 20 5 FHBDRN Cc1nccn1-c1ccc(CNc2ncc(Cl)cc2[N+](=O)[O-])cc1F ZINC000153620396 936328307 /nfs/dbraw/zinc/32/83/07/936328307.db2.gz FTCGNAQDXZCAFH-UHFFFAOYSA-N 0 0 361.764 3.889 20 5 FHBDRN O=C(C/C=C/c1cccc(F)c1)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000572911322 936340281 /nfs/dbraw/zinc/34/02/81/936340281.db2.gz ZHGWPBSDSMCMNB-DUXPYHPUSA-N 0 0 367.380 3.977 20 5 FHBDRN COc1cccc([C@@H](C)c2noc(CCNc3ccccc3[N+](=O)[O-])n2)c1 ZINC000612916849 936342002 /nfs/dbraw/zinc/34/20/02/936342002.db2.gz ANTJUGPGDMZECC-CYBMUJFWSA-N 0 0 368.393 3.793 20 5 FHBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)c1nc([C@H]2CCCC[C@@H]2C)no1 ZINC000612928327 936343859 /nfs/dbraw/zinc/34/38/59/936343859.db2.gz SXKNCMUQBKWJEB-HUBLWGQQSA-N 0 0 358.398 3.763 20 5 FHBDRN CO[C@H](C)c1nc(CNC(=O)c2c(C)cc(Cl)cc2[N+](=O)[O-])cs1 ZINC000278002526 936345830 /nfs/dbraw/zinc/34/58/30/936345830.db2.gz OKOXCFZPXTXORS-SECBINFHSA-N 0 0 369.830 3.651 20 5 FHBDRN Cc1cc(C)c(OC(=O)CCc2nnc(-c3ccccc3)o2)c([N+](=O)[O-])c1 ZINC000061432520 936349384 /nfs/dbraw/zinc/34/93/84/936349384.db2.gz KDKIDNLVOZCDQG-UHFFFAOYSA-N 0 0 367.361 3.800 20 5 FHBDRN Cc1cc(C)c(S(=O)(=O)Nc2cc(F)ccc2Cl)cc1[N+](=O)[O-] ZINC000583000706 936358381 /nfs/dbraw/zinc/35/83/81/936358381.db2.gz BINMJJGNFPSVBB-UHFFFAOYSA-N 0 0 358.778 3.805 20 5 FHBDRN CCC[C@@]1(COC)CCCN1C(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000583004340 936365090 /nfs/dbraw/zinc/36/50/90/936365090.db2.gz WZTOBRFIICJREI-IBGZPJMESA-N 0 0 363.458 3.595 20 5 FHBDRN CC(C)OC(=O)CCCNC(=O)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000278020637 936370074 /nfs/dbraw/zinc/37/00/74/936370074.db2.gz JHYHXNPFYPNLBJ-UHFFFAOYSA-N 0 0 366.417 3.555 20 5 FHBDRN CCC[C@@H](NC(=O)COC(=O)c1ccc([N+](=O)[O-])c(C)c1)c1ccccc1 ZINC000005135966 936389039 /nfs/dbraw/zinc/38/90/39/936389039.db2.gz DRQATVCLGVUHGU-QGZVFWFLSA-N 0 0 370.405 3.718 20 5 FHBDRN COc1ccc(/C=C\C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1OC ZINC000255565488 936390152 /nfs/dbraw/zinc/39/01/52/936390152.db2.gz ROBWOQOSMXEYER-JKEYDSJLSA-N 0 0 370.405 3.811 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@H](c1cccnc1)C(C)C ZINC000439884595 945063868 /nfs/dbraw/zinc/06/38/68/945063868.db2.gz VOAOMSPDIVXOIB-MRXNPFEDSA-N 0 0 372.425 3.950 20 5 FHBDRN CNc1c(C(=O)N2CC[C@](F)(c3ccccc3C)C2)cccc1[N+](=O)[O-] 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FHBDRN Cc1ccccc1[C@@H]1CN(CCCOc2ccc([N+](=O)[O-])cc2)CCO1 ZINC000610217918 928218484 /nfs/dbraw/zinc/21/84/84/928218484.db2.gz XXDQAGFSLULXGG-FQEVSTJZSA-N 0 0 356.422 3.746 20 5 FHBDRN Cc1cccc(-c2nc(CC(=O)NCc3ccccc3[N+](=O)[O-])cs2)c1 ZINC000097427459 928252105 /nfs/dbraw/zinc/25/21/05/928252105.db2.gz ADOXNWGVNSLHFN-UHFFFAOYSA-N 0 0 367.430 3.886 20 5 FHBDRN CC[C@@H]1C[C@H](CC(=O)OCCSc2ccc([N+](=O)[O-])cc2)CCO1 ZINC000784937994 928275177 /nfs/dbraw/zinc/27/51/77/928275177.db2.gz MIFFBSHTERPRKD-UKRRQHHQSA-N 0 0 353.440 3.825 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N2CCN(Cc3ccc(Cl)cc3)CC2)c1 ZINC000610221116 928276520 /nfs/dbraw/zinc/27/65/20/928276520.db2.gz AJXAZHBTTAMLLX-UHFFFAOYSA-N 0 0 373.840 3.515 20 5 FHBDRN O=C(COc1ccccc1[N+](=O)[O-])N(CC1CCCCC1)c1ccccn1 ZINC000157584298 928299954 /nfs/dbraw/zinc/29/99/54/928299954.db2.gz BUDCVDOJYHCJAE-UHFFFAOYSA-N 0 0 369.421 3.982 20 5 FHBDRN O=[N+]([O-])c1cccc(S(=O)(=O)Nc2cc(C(F)F)ccc2Cl)c1 ZINC000578139194 928301681 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370.434 3.511 20 5 FHBDRN O=C(Cc1cccc([N+](=O)[O-])c1)Nc1cc(F)ccc1N1CCCCC1 ZINC000610227413 928368575 /nfs/dbraw/zinc/36/85/75/928368575.db2.gz RDKYMIMABXFRRV-UHFFFAOYSA-N 0 0 357.385 3.905 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N2CCc3ccc(Br)cc32)c1 ZINC000610228691 928373223 /nfs/dbraw/zinc/37/32/23/928373223.db2.gz RMYVSLKDROQSOX-UHFFFAOYSA-N 0 0 361.195 3.869 20 5 FHBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1nc(C2CC2)cs1 ZINC000120432416 928379757 /nfs/dbraw/zinc/37/97/57/928379757.db2.gz ZTJWMIILZHCCCW-QMMMGPOBSA-N 0 0 367.814 3.988 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N1CCCC[C@@H]1c1ccccc1 ZINC000430235711 928384435 /nfs/dbraw/zinc/38/44/35/928384435.db2.gz FLLWHXYWUANFCU-GOSISDBHSA-N 0 0 367.405 3.596 20 5 FHBDRN C[C@@H]1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])s2)[C@@H]1c1cccc(F)c1 ZINC000175336605 928389466 /nfs/dbraw/zinc/38/94/66/928389466.db2.gz KMFKNNTWMFTPGH-BMIGLBTASA-N 0 0 370.427 3.567 20 5 FHBDRN CC[C@@H](C)[C@H](NC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)C(F)(F)F 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370.833 3.738 20 5 FHBDRN O=C(COc1ccc(F)cc1)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC000755369248 937271543 /nfs/dbraw/zinc/27/15/43/937271543.db2.gz CFOHGXKPPYTJHR-UHFFFAOYSA-N 0 0 369.146 3.514 20 5 FHBDRN O=C(/C=C\c1cccnc1)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000254991407 928748959 /nfs/dbraw/zinc/74/89/59/928748959.db2.gz JZYUHNUFALGTAU-SREVYHEPSA-N 0 0 352.375 3.765 20 5 FHBDRN CC[C@@H](Cc1ccccc1)N(C)C(=O)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000610234649 928820649 /nfs/dbraw/zinc/82/06/49/928820649.db2.gz AGJFSQNNHLPVDX-KRWDZBQOSA-N 0 0 356.422 3.626 20 5 FHBDRN Cc1c([N+](=O)[O-])cc(C(=O)N2CC[C@H](c3ccccc3)[C@@H]2C)cc1[N+](=O)[O-] ZINC000175764813 928825377 /nfs/dbraw/zinc/82/53/77/928825377.db2.gz DTNBSIKWBJHSFN-BBRMVZONSA-N 0 0 369.377 3.830 20 5 FHBDRN C[C@@H](Oc1ccccc1)C(=O)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC000755370571 937282823 /nfs/dbraw/zinc/28/28/23/937282823.db2.gz BTRZNBWOHWCVGP-SNVBAGLBSA-N 0 0 365.183 3.763 20 5 FHBDRN CNc1ccc(C(=O)N2CC[C@H](c3cccc(Cl)c3)C2)cc1[N+](=O)[O-] ZINC000548791315 937284022 /nfs/dbraw/zinc/28/40/22/937284022.db2.gz YWWPBHLLVYVDNQ-AWEZNQCLSA-N 0 0 359.813 3.920 20 5 FHBDRN C[C@@H]1CCN(C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)[C@H]2CCCC[C@@H]12 ZINC000229918711 928906066 /nfs/dbraw/zinc/90/60/66/928906066.db2.gz WDNYDCXCLYHMLM-LJHODMEESA-N 0 0 368.437 3.821 20 5 FHBDRN CN(C)C(=O)CC1CCN(c2c(Cl)cc(Cl)cc2[N+](=O)[O-])CC1 ZINC000579866799 928909597 /nfs/dbraw/zinc/90/95/97/928909597.db2.gz HSODUJSCMQGENM-UHFFFAOYSA-N 0 0 360.241 3.596 20 5 FHBDRN COc1cccc(C(=O)NC[C@@H]2[C@@H](c3ccccc3)C2(C)C)c1[N+](=O)[O-] ZINC000457993004 928951607 /nfs/dbraw/zinc/95/16/07/928951607.db2.gz KHQZNDPZAUAYFZ-NVXWUHKLSA-N 0 0 354.406 3.773 20 5 FHBDRN Cc1cc(C)c2cc(C(=O)NCCc3ccccc3[N+](=O)[O-])sc2n1 ZINC000610237185 928954236 /nfs/dbraw/zinc/95/42/36/928954236.db2.gz SHJYYMOEYFHNHY-UHFFFAOYSA-N 0 0 355.419 3.794 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@H](C[C@H](C)O)c1ccccc1 ZINC000162780247 937290172 /nfs/dbraw/zinc/29/01/72/937290172.db2.gz 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C[C@@H](NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)c1ccc2n[nH]cc2c1 ZINC000579870294 928989324 /nfs/dbraw/zinc/98/93/24/928989324.db2.gz PBYRRHPKHCVPMZ-LLVKDONJSA-N 0 0 365.393 3.536 20 5 FHBDRN COc1cc(F)cc2sc(NC(=O)c3cc([N+](=O)[O-])ccc3C)nc21 ZINC000609141838 929001242 /nfs/dbraw/zinc/00/12/42/929001242.db2.gz QQNQQDBSKBYGOI-UHFFFAOYSA-N 0 0 361.354 3.913 20 5 FHBDRN Cn1cc([N+](=O)[O-])cc1C(=O)NC1(c2cccc(C(F)(F)F)c2)CCC1 ZINC000610237558 929067106 /nfs/dbraw/zinc/06/71/06/929067106.db2.gz GCIZMXFHAHACMZ-UHFFFAOYSA-N 0 0 367.327 3.761 20 5 FHBDRN CC(C)(C)OCc1cc(CNC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)no1 ZINC000274949775 929070690 /nfs/dbraw/zinc/07/06/90/929070690.db2.gz DHLWEMYIBZWYIT-UHFFFAOYSA-N 0 0 373.365 3.574 20 5 FHBDRN O=C(OC[C@@H]1CCCO1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000021729632 929090411 /nfs/dbraw/zinc/09/04/11/929090411.db2.gz HRCLRLXVNALZPM-INIZCTEOSA-N 0 0 356.378 3.543 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCN([C@H](C)c2cccc(F)c2)CC1 ZINC000176619861 937303855 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COc1cc([C@@H](C)Nc2ccc(C(C)=O)cc2[N+](=O)[O-])cc(OC)c1OC ZINC000052242937 937312660 /nfs/dbraw/zinc/31/26/60/937312660.db2.gz XSTINXNYHPMUPI-LLVKDONJSA-N 0 0 374.393 3.996 20 5 FHBDRN C[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1cnn(CC2CCC2)c1 ZINC000890675978 929228280 /nfs/dbraw/zinc/22/82/80/929228280.db2.gz AMBCEZWZGUEOKZ-NSHDSACASA-N 0 0 362.817 3.736 20 5 FHBDRN CCN(CCc1nccs1)c1cc(C)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000535986838 937314533 /nfs/dbraw/zinc/31/45/33/937314533.db2.gz GKWZINHVDYGHBK-UHFFFAOYSA-N 0 0 369.450 3.886 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)NCCOc2ccc(C(C)(C)C)cc2)c1 ZINC000060063801 929267676 /nfs/dbraw/zinc/26/76/76/929267676.db2.gz RJGCGXYFFSMFIE-UHFFFAOYSA-N 0 0 372.421 3.710 20 5 FHBDRN Cc1nc([C@H]2CCCN2c2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)cs1 ZINC000275048905 929293937 /nfs/dbraw/zinc/29/39/37/929293937.db2.gz SHWQJQXJKRANOY-CQSZACIVSA-N 0 0 358.423 3.586 20 5 FHBDRN Cc1cccc(CCNC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000609724495 929355485 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O=C(NC[C@H]1CSCCS1)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000278191912 937328881 /nfs/dbraw/zinc/32/88/81/937328881.db2.gz OXWWDBZUUYUZGN-LBPRGKRZSA-N 0 0 370.499 3.672 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1c2ccccc2N(C)CC[C@H]1C ZINC000471235731 929435909 /nfs/dbraw/zinc/43/59/09/929435909.db2.gz UGENQPGDZBUGMK-OAHLLOKOSA-N 0 0 368.437 3.577 20 5 FHBDRN O=[N+]([O-])c1ccc(N[C@@H]2CCN(c3ccc(C(F)(F)F)cc3)C2)cn1 ZINC000609797292 929484465 /nfs/dbraw/zinc/48/44/65/929484465.db2.gz FIFOBEIQTAHUIL-CYBMUJFWSA-N 0 0 352.316 3.699 20 5 FHBDRN CCC[C@@]1(CO)CCCN1C(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000278194590 937336433 /nfs/dbraw/zinc/33/64/33/937336433.db2.gz RTWYXVIYKSAIMK-QFIPXVFZSA-N 0 0 364.445 3.861 20 5 FHBDRN O=C(c1ccc(Cl)cc1[N+](=O)[O-])N(C[C@H]1CCCO1)C1CCCC1 ZINC000610243270 929530005 /nfs/dbraw/zinc/53/00/05/929530005.db2.gz MLAJLPWCMKBTQH-CQSZACIVSA-N 0 0 352.818 3.812 20 5 FHBDRN COc1cc(C(=O)N(C)[C@H]2CCCc3ccccc32)c([N+](=O)[O-])cc1F ZINC000583308269 937338131 /nfs/dbraw/zinc/33/81/31/937338131.db2.gz UUONWKQKDWPPHV-INIZCTEOSA-N 0 0 358.369 3.892 20 5 FHBDRN CCc1cc(N2CCS[C@H](C)[C@@H]2C)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000609823079 929542174 /nfs/dbraw/zinc/54/21/74/929542174.db2.gz BDNZVDPHCDHQTG-QWHCGFSZSA-N 0 0 358.467 3.944 20 5 FHBDRN CCOc1ccc(OC(C)(C)C(=O)NCCc2ccccc2[N+](=O)[O-])cc1 ZINC000547761852 929548257 /nfs/dbraw/zinc/54/82/57/929548257.db2.gz NQBCMCMXNLGIHL-UHFFFAOYSA-N 0 0 372.421 3.510 20 5 FHBDRN COc1ccc(NC(=O)Cn2ccc3c2cccc3[N+](=O)[O-])cc1Cl ZINC000609849753 929579321 /nfs/dbraw/zinc/57/93/21/929579321.db2.gz GPVOYBLECQHMGH-UHFFFAOYSA-N 0 0 359.769 3.850 20 5 FHBDRN CO[C@@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2SC(C)C)CC1 ZINC000360002872 929582225 /nfs/dbraw/zinc/58/22/25/929582225.db2.gz YQUJQIWXUIUNBG-CQSZACIVSA-N 0 0 352.456 3.736 20 5 FHBDRN CC(C)C[C@@H](NC(=O)c1c[nH]nc1[N+](=O)[O-])c1cccc(C(F)(F)F)c1 ZINC000547764078 929587318 /nfs/dbraw/zinc/58/73/18/929587318.db2.gz CCCQFSPXPXEMKI-CYBMUJFWSA-N 0 0 370.331 3.854 20 5 FHBDRN O=C(Nc1nnc(C2CC2)s1)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000610291705 929651037 /nfs/dbraw/zinc/65/10/37/929651037.db2.gz XMHFVTBNMKOOAZ-UHFFFAOYSA-N 0 0 358.301 3.595 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2C[C@H]2c2c(F)cccc2Cl)c1 ZINC000121062192 929668098 /nfs/dbraw/zinc/66/80/98/929668098.db2.gz HWCTWBTWJIONAU-QMTHXVAHSA-N 0 0 364.760 3.682 20 5 FHBDRN CO[C@H](C)CN(C)c1ccc(C(=O)Nc2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000579969233 929672154 /nfs/dbraw/zinc/67/21/54/929672154.db2.gz POLJEJOHEFUOIW-CQSZACIVSA-N 0 0 357.410 3.627 20 5 FHBDRN C[C@@H]1CO[C@H](c2ccccc2)CN1C(=O)c1cccc(Cl)c1[N+](=O)[O-] ZINC000175820761 929681611 /nfs/dbraw/zinc/68/16/11/929681611.db2.gz ZMPJCURJBWVFKS-WBMJQRKESA-N 0 0 360.797 3.850 20 5 FHBDRN CN(CC(=O)N1CCC(c2ccccc2F)CC1)c1ccccc1[N+](=O)[O-] ZINC000610294401 929705160 /nfs/dbraw/zinc/70/51/60/929705160.db2.gz AUSWXZYODTUEFH-UHFFFAOYSA-N 0 0 371.412 3.576 20 5 FHBDRN COc1ccc(CC(=O)N2C[C@@H](C)C[C@H]2c2ccccc2F)cc1[N+](=O)[O-] ZINC000610295714 929711340 /nfs/dbraw/zinc/71/13/40/929711340.db2.gz HFLMFDAUGPYSBM-GUYCJALGSA-N 0 0 372.396 3.895 20 5 FHBDRN COC(=O)c1cc(Cl)nc(Cl)c1Nc1cccc([N+](=O)[O-])c1F ZINC001210377822 929714346 /nfs/dbraw/zinc/71/43/46/929714346.db2.gz AXCMHWBHXUIEJQ-UHFFFAOYSA-N 0 0 360.128 3.966 20 5 FHBDRN C[C@@H](O)CCN(C)C(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000176678413 937353219 /nfs/dbraw/zinc/35/32/19/937353219.db2.gz DTULMRAHNFRSFB-CYBMUJFWSA-N 0 0 360.435 3.589 20 5 FHBDRN C[C@H](c1ncc(C(C)(C)C)o1)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000177633980 929722079 /nfs/dbraw/zinc/72/20/79/929722079.db2.gz SUBVBOWJAVQAIK-CQSZACIVSA-N 0 0 358.442 3.764 20 5 FHBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N([C@@H](C)C1CC1)C1CC1 ZINC000121064583 929730900 /nfs/dbraw/zinc/73/09/00/929730900.db2.gz OQBKEGARWAWTEV-QWRGUYRKSA-N 0 0 352.818 3.805 20 5 FHBDRN CNC(=O)CNCc1ccc(Oc2ccc(C(C)(C)C)cc2)c([N+](=O)[O-])c1 ZINC000579981448 929746114 /nfs/dbraw/zinc/74/61/14/929746114.db2.gz PDPHTTQGKCJESV-UHFFFAOYSA-N 0 0 371.437 3.520 20 5 FHBDRN Cn1cc([N+](=O)[O-])cc1-c1nc(-c2ccc(Br)cc2F)no1 ZINC000578951265 929747148 /nfs/dbraw/zinc/74/71/48/929747148.db2.gz DJPPWXFKJZXTCG-UHFFFAOYSA-N 0 0 367.134 3.552 20 5 FHBDRN O=C(c1cc(C2CC2)nn1-c1ccccc1)N1CCc2c1cccc2[N+](=O)[O-] ZINC000609973274 929747932 /nfs/dbraw/zinc/74/79/32/929747932.db2.gz BKBVGRREAICLNN-UHFFFAOYSA-N 0 0 374.400 3.861 20 5 FHBDRN CCN(C(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C1CCC1 ZINC000609974346 929747998 /nfs/dbraw/zinc/74/79/98/929747998.db2.gz GJCNVDIYLWAIBA-UHFFFAOYSA-N 0 0 359.348 3.817 20 5 FHBDRN CCNC(=O)c1cccc(CNc2ccc([N+](=O)[O-])c3cccnc23)c1 ZINC000052281515 937356073 /nfs/dbraw/zinc/35/60/73/937356073.db2.gz ZFGVUQGDWOMHRA-UHFFFAOYSA-N 0 0 350.378 3.505 20 5 FHBDRN C[C@H]1CN(C(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)C[C@H](C)S1 ZINC000610300909 929751866 /nfs/dbraw/zinc/75/18/66/929751866.db2.gz KFCNNRRKGSJHIH-QWRGUYRKSA-N 0 0 363.464 3.684 20 5 FHBDRN C[C@@H]1CN(C(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)C[C@H](C)S1 ZINC000610300908 929752103 /nfs/dbraw/zinc/75/21/03/929752103.db2.gz KFCNNRRKGSJHIH-PHIMTYICSA-N 0 0 363.464 3.684 20 5 FHBDRN CNc1ccc(C(=O)N2CC[C@H](CSc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000610303919 929770454 /nfs/dbraw/zinc/77/04/54/929770454.db2.gz YGHZNPFXUJSZHE-AWEZNQCLSA-N 0 0 371.462 3.891 20 5 FHBDRN CC(C)(C)OC(=O)Cc1cccc(NC(=O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000610306045 929775409 /nfs/dbraw/zinc/77/54/09/929775409.db2.gz MKLBHQLEBAONJV-UHFFFAOYSA-N 0 0 356.378 3.731 20 5 FHBDRN O=C(c1cc2ccsc2[nH]1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000610305599 929776382 /nfs/dbraw/zinc/77/63/82/929776382.db2.gz SKNZKSPYQWJSJN-UHFFFAOYSA-N 0 0 371.418 3.821 20 5 FHBDRN COc1ccc(S(=O)(=O)Nc2cc([N+](=O)[O-])c(Cl)cc2C)c(C)c1 ZINC000134058597 929785615 /nfs/dbraw/zinc/78/56/15/929785615.db2.gz XBCPOBOJKOMAKU-UHFFFAOYSA-N 0 0 370.814 3.674 20 5 FHBDRN CC[C@@H](NC(=O)N1CCOC[C@H]1CC1CCC1)c1cccc([N+](=O)[O-])c1 ZINC000458485395 937359473 /nfs/dbraw/zinc/35/94/73/937359473.db2.gz CDZGLPZKKZVIGC-QZTJIDSGSA-N 0 0 361.442 3.647 20 5 FHBDRN COc1ccccc1Cc1noc(-c2cccc(SC)c2[N+](=O)[O-])n1 ZINC000583346945 937363527 /nfs/dbraw/zinc/36/35/27/937363527.db2.gz QGXBBFPIFWDFRL-UHFFFAOYSA-N 0 0 357.391 3.966 20 5 FHBDRN COc1ccc(C(=O)N2CC[C@@H](Cc3ccccc3)[C@H]2C)cc1[N+](=O)[O-] ZINC000471477768 929876964 /nfs/dbraw/zinc/87/69/64/929876964.db2.gz VSVAVLATLNRKGK-ZBFHGGJFSA-N 0 0 354.406 3.697 20 5 FHBDRN CC(=O)c1ccc(OCC(=O)C23CC4CC(CC(C4)C2)C3)c([N+](=O)[O-])c1 ZINC000121098117 929891856 /nfs/dbraw/zinc/89/18/56/929891856.db2.gz NMYAJIMAXITBSM-UHFFFAOYSA-N 0 0 357.406 3.962 20 5 FHBDRN COc1ccc(NC(=O)c2ccc(SC(F)(F)F)nc2)cc1[N+](=O)[O-] ZINC001266541228 929917872 /nfs/dbraw/zinc/91/78/72/929917872.db2.gz BNTGQCWPDUGJRH-UHFFFAOYSA-N 0 0 373.312 3.863 20 5 FHBDRN COc1ccc(NC(=O)C(F)(F)c2cc(F)cc(F)c2)cc1[N+](=O)[O-] ZINC001266541240 929918449 /nfs/dbraw/zinc/91/84/49/929918449.db2.gz CGDNWMXCHJXVNC-UHFFFAOYSA-N 0 0 358.247 3.612 20 5 FHBDRN CN(CCC(F)(F)F)C(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC001125401493 929940812 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373.372 3.796 20 5 FHBDRN Cc1ccc(C(=O)N[C@H](CO)c2cccc(Cl)c2Cl)cc1[N+](=O)[O-] ZINC001167340964 930018099 /nfs/dbraw/zinc/01/80/99/930018099.db2.gz BIIMOBIZGMJFNW-CYBMUJFWSA-N 0 0 369.204 3.673 20 5 FHBDRN CC1CCN(c2ccc(C(=O)Nc3c(O)cccc3F)cc2[N+](=O)[O-])CC1 ZINC000610339902 930031300 /nfs/dbraw/zinc/03/13/00/930031300.db2.gz ZQOMQFYICRLWIM-UHFFFAOYSA-N 0 0 373.384 3.928 20 5 FHBDRN CCOc1ccc([C@H](C)NC(=O)NCCc2ccccc2[N+](=O)[O-])cc1 ZINC000610345588 930051002 /nfs/dbraw/zinc/05/10/02/930051002.db2.gz ZUKIEDHHHXRUDC-AWEZNQCLSA-N 0 0 357.410 3.596 20 5 FHBDRN CC(C)(COC(=O)/C=C/c1ccc([N+](=O)[O-])cc1)C1OCC(C)(C)CO1 ZINC000121134146 930081519 /nfs/dbraw/zinc/08/15/19/930081519.db2.gz XGYFCYIVYCIOQI-JXMROGBWSA-N 0 0 363.410 3.577 20 5 FHBDRN O=C(Nc1ccc(Br)c([N+](=O)[O-])c1)c1cccc2nccnc21 ZINC000754385154 930095959 /nfs/dbraw/zinc/09/59/59/930095959.db2.gz PMLPYABJRDUNHZ-UHFFFAOYSA-N 0 0 373.166 3.553 20 5 FHBDRN CCn1c(C)cc(C(=O)NCCCNc2ccc(C)cc2[N+](=O)[O-])c1C ZINC000610069620 930106154 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355.369 3.652 20 5 FHBDRN O=[N+]([O-])c1cccc(CNc2ccc3nccnc3c2Br)c1 ZINC000319457190 930556521 /nfs/dbraw/zinc/55/65/21/930556521.db2.gz ULXDZGWQHXCPJB-UHFFFAOYSA-N 0 0 359.183 3.913 20 5 FHBDRN CCCOc1cc(O)ccc1NC(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000430485803 930568881 /nfs/dbraw/zinc/56/88/81/930568881.db2.gz NLBPXIFXEUBSLN-UHFFFAOYSA-N 0 0 373.409 3.920 20 5 FHBDRN Cc1ccccc1-c1nnc(N(Cc2ccccc2[N+](=O)[O-])C2CC2)n1C ZINC000580364445 930575473 /nfs/dbraw/zinc/57/54/73/930575473.db2.gz PSPWXONCGGEMBX-UHFFFAOYSA-N 0 0 363.421 3.868 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1C(=O)NCC(C)(C)c1ccc2c(c1)OCO2 ZINC001125445704 930585968 /nfs/dbraw/zinc/58/59/68/930585968.db2.gz JTLUQZBZLSQIHP-UHFFFAOYSA-N 0 0 370.405 3.648 20 5 FHBDRN CCN(c1ccc2[nH]ccc2c1)S(=O)(=O)c1cccc([N+](=O)[O-])c1C ZINC000471566313 930588205 /nfs/dbraw/zinc/58/82/05/930588205.db2.gz NFEPFEBZDHMQBX-UHFFFAOYSA-N 0 0 359.407 3.600 20 5 FHBDRN CCN(c1ccc2[nH]ccc2c1)S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1 ZINC000471567100 930590504 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ZINC000785020346 930821075 /nfs/dbraw/zinc/82/10/75/930821075.db2.gz XGURHUUMHVAEJB-UHFFFAOYSA-N 0 0 355.818 3.869 20 5 FHBDRN CC[C@@H](NS(=O)(=O)c1ccc([N+](=O)[O-])c(C)c1)c1cc(F)ccc1F ZINC000610136002 930821091 /nfs/dbraw/zinc/82/10/91/930821091.db2.gz FSUYEDFMHLKSTE-OAHLLOKOSA-N 0 0 370.377 3.611 20 5 FHBDRN O=C(N[C@@H](c1ccsc1)c1ccc(Cl)cc1)c1[nH]ncc1[N+](=O)[O-] ZINC000119191405 930831313 /nfs/dbraw/zinc/83/13/13/930831313.db2.gz IHUNKPNGDCKZCD-CYBMUJFWSA-N 0 0 362.798 3.552 20 5 FHBDRN CCc1ccc(-c2nc(Cn3cc([N+](=O)[O-])c(C)cc3=O)cs2)cc1 ZINC000177790510 930846110 /nfs/dbraw/zinc/84/61/10/930846110.db2.gz DUJJMAQOTOPCAC-UHFFFAOYSA-N 0 0 355.419 3.799 20 5 FHBDRN Cc1cc2c(cc1[N+](=O)[O-])N(C(=O)Cc1nsc3ccccc31)CC2 ZINC001266623255 930871587 /nfs/dbraw/zinc/87/15/87/930871587.db2.gz JTTTVDRWEDZJHJ-UHFFFAOYSA-N 0 0 353.403 3.645 20 5 FHBDRN Cc1nc(CN(C)C(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)cs1 ZINC000050354709 930932060 /nfs/dbraw/zinc/93/20/60/930932060.db2.gz QDIFGQJUMYJENF-UHFFFAOYSA-N 0 0 374.447 3.755 20 5 FHBDRN CN(C(=O)c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1)c1ncccn1 ZINC000580626527 930944302 /nfs/dbraw/zinc/94/43/02/930944302.db2.gz ZIKSJZXGYCCLHC-UHFFFAOYSA-N 0 0 366.402 3.813 20 5 FHBDRN CN(c1ccccc1)C1CCN(C(=O)c2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000160576281 930955077 /nfs/dbraw/zinc/95/50/77/930955077.db2.gz WUEVYLKUCHWJHI-UHFFFAOYSA-N 0 0 373.840 3.989 20 5 FHBDRN COc1cc(COc2ccc(C(C)=O)cc2)c([N+](=O)[O-])cc1OC(F)F ZINC000119243629 930959460 /nfs/dbraw/zinc/95/94/60/930959460.db2.gz WPWKPHKAJPTGLL-UHFFFAOYSA-N 0 0 367.304 3.986 20 5 FHBDRN COc1ccc(C(=O)Nc2cn(CC(C)C)nc2C(F)F)cc1[N+](=O)[O-] ZINC000535641802 930968641 /nfs/dbraw/zinc/96/86/41/930968641.db2.gz UKGFBTUVOUWYQL-UHFFFAOYSA-N 0 0 368.340 3.646 20 5 FHBDRN O=C(COCC(F)(F)F)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000548128907 931040633 /nfs/dbraw/zinc/04/06/33/931040633.db2.gz FZCSYCHGASTQHQ-UHFFFAOYSA-N 0 0 370.283 3.905 20 5 FHBDRN COCCOc1ccccc1NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000119301295 931062723 /nfs/dbraw/zinc/06/27/23/931062723.db2.gz MFLMZDFJIIKXKS-UHFFFAOYSA-N 0 0 350.758 3.526 20 5 FHBDRN CC1(C)CN(C(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)CC[C@@H]1O ZINC000275955410 931102493 /nfs/dbraw/zinc/10/24/93/931102493.db2.gz ZCEWTZRXPNFRMV-SFHVURJKSA-N 0 0 370.405 3.620 20 5 FHBDRN COC(=O)[C@@H](C)c1ccc(NC(=O)[C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000580760848 931119086 /nfs/dbraw/zinc/11/90/86/931119086.db2.gz DLBLHVDVEVASLL-OLZOCXBDSA-N 0 0 356.378 3.614 20 5 FHBDRN COC(=O)c1cnc(NCc2ccc(OC3CCCC3)cc2)c([N+](=O)[O-])c1 ZINC000579850639 931129731 /nfs/dbraw/zinc/12/97/31/931129731.db2.gz KKLBBPSCHKFACX-UHFFFAOYSA-N 0 0 371.393 3.710 20 5 FHBDRN C[C@@H]1C[C@@H]1[C@@H]1C[C@H]1C(=O)O[C@@H](c1cccnc1)c1ccccc1[N+](=O)[O-] ZINC001266649737 931136521 /nfs/dbraw/zinc/13/65/21/931136521.db2.gz SWYLVYWQQXBMDN-QEVGBQTESA-N 0 0 352.390 3.915 20 5 FHBDRN Cc1ccc(-c2nc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)n[nH]2)o1 ZINC000177822279 931185901 /nfs/dbraw/zinc/18/59/01/931185901.db2.gz ZBGOLUWHSVBIKY-UHFFFAOYSA-N 0 0 369.362 3.748 20 5 FHBDRN Cc1cc(N2CC[C@@H](c3nccn3C)C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000580821434 931198413 /nfs/dbraw/zinc/19/84/13/931198413.db2.gz ANLAFMDQOVQFIG-LLVKDONJSA-N 0 0 354.332 3.649 20 5 FHBDRN CCCOc1ccc(OCC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000430520264 931201729 /nfs/dbraw/zinc/20/17/29/931201729.db2.gz NXSSONHVZCHUAE-UHFFFAOYSA-N 0 0 372.421 3.814 20 5 FHBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N(CC2CCC2)c2ccccc2)s1 ZINC000084042572 931213593 /nfs/dbraw/zinc/21/35/93/931213593.db2.gz ZRLYTLKKGJCVLQ-UHFFFAOYSA-N 0 0 352.437 3.652 20 5 FHBDRN O=C(c1cccc(Cl)c1[N+](=O)[O-])N1CCCC[C@@H]([C@@H]2CCOC2)C1 ZINC000891330073 931227464 /nfs/dbraw/zinc/22/74/64/931227464.db2.gz BUFIDUVQRNJNDU-CHWSQXEVSA-N 0 0 352.818 3.527 20 5 FHBDRN Cc1ccc(OC2CCN(C(=O)c3cc([N+](=O)[O-])cnc3C)CC2)cc1C ZINC000046399192 931227494 /nfs/dbraw/zinc/22/74/94/931227494.db2.gz FVZMYINMWYDPCL-UHFFFAOYSA-N 0 0 369.421 3.599 20 5 FHBDRN O=C(c1cccc(Cl)c1[N+](=O)[O-])N1CCCC[C@H]([C@@H]2CCOC2)C1 ZINC000891330075 931227956 /nfs/dbraw/zinc/22/79/56/931227956.db2.gz BUFIDUVQRNJNDU-QWHCGFSZSA-N 0 0 352.818 3.527 20 5 FHBDRN C[C@H](C(=O)N1CCCC[C@@H]([C@H]2CCOC2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000891334574 931255354 /nfs/dbraw/zinc/25/53/54/931255354.db2.gz JPDLQBMJAPQRSY-ZNMIVQPWSA-N 0 0 364.417 3.503 20 5 FHBDRN O=C(c1c(Cl)cccc1[N+](=O)[O-])N1CCCC[C@H]([C@@H]2CCOC2)C1 ZINC000891335405 931263266 /nfs/dbraw/zinc/26/32/66/931263266.db2.gz NETCKEDWUBMRPN-QWHCGFSZSA-N 0 0 352.818 3.527 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(Cc2noc(-c3csc(Cl)c3)n2)c1 ZINC000580859333 931274964 /nfs/dbraw/zinc/27/49/64/931274964.db2.gz OADJNBQFFSVAGW-UHFFFAOYSA-N 0 0 351.771 3.959 20 5 FHBDRN COc1cccc(CO[C@@H](C)C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000177846165 931285476 /nfs/dbraw/zinc/28/54/76/931285476.db2.gz QZNVWECFJSTPCT-GJZGRUSLSA-N 0 0 372.421 3.694 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)CCn2cnc3ccccc32)cc1[N+](=O)[O-] ZINC000177844126 931289092 /nfs/dbraw/zinc/28/90/92/931289092.db2.gz WSKUJVRFMGJWOZ-CQSZACIVSA-N 0 0 352.394 3.520 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)c2cccc(N3CCCC3=O)c2)cc1[N+](=O)[O-] ZINC000177848578 931293006 /nfs/dbraw/zinc/29/30/06/931293006.db2.gz BBCTUIOQUFNDFW-CQSZACIVSA-N 0 0 367.405 3.521 20 5 FHBDRN COC(=O)Nc1ccccc1C(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000177852073 931313375 /nfs/dbraw/zinc/31/33/75/931313375.db2.gz CGOCXBNRCXVNKV-GFCCVEGCSA-N 0 0 357.366 3.573 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CCCC[C@@H]([C@@H]2CCOC2)C1 ZINC000891340417 931320633 /nfs/dbraw/zinc/32/06/33/931320633.db2.gz QMZZGZICSHQPMO-CHWSQXEVSA-N 0 0 352.818 3.527 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)c2cccc(NC(=O)C3CC3)c2)cc1[N+](=O)[O-] ZINC000177855294 931326444 /nfs/dbraw/zinc/32/64/44/931326444.db2.gz DSIQDFBGLLXFBN-CYBMUJFWSA-N 0 0 367.405 3.743 20 5 FHBDRN CN(c1ncnc2sc([N+](=O)[O-])cc21)[C@H]1CCCN(c2ccccc2)C1 ZINC000561233430 931336003 /nfs/dbraw/zinc/33/60/03/931336003.db2.gz NDLADCFXFLEXIP-AWEZNQCLSA-N 0 0 369.450 3.705 20 5 FHBDRN Cc1nc(N[C@H](c2nccn2C)c2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000471628393 931338329 /nfs/dbraw/zinc/33/83/29/931338329.db2.gz MHMJRJKUGUAVST-INIZCTEOSA-N 0 0 357.801 3.887 20 5 FHBDRN C[C@H]1Oc2ccccc2[C@H]1NC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000580915649 931341578 /nfs/dbraw/zinc/34/15/78/931341578.db2.gz WGFFWBYMBMKHBE-PSLIRLAXSA-N 0 0 366.295 3.866 20 5 FHBDRN COc1ccc(C(=O)N2CCCCC[C@H]2c2c(C)n[nH]c2C)cc1[N+](=O)[O-] ZINC000155916427 931348754 /nfs/dbraw/zinc/34/87/54/931348754.db2.gz WEIDMSNJKOYBJH-HNNXBMFYSA-N 0 0 372.425 3.701 20 5 FHBDRN O=C1[C@@H](Nc2ccc([N+](=O)[O-])nc2)CCN1c1ccc(Cl)c(Cl)c1 ZINC000477007281 931389753 /nfs/dbraw/zinc/38/97/53/931389753.db2.gz BQURAAOJLPMHTH-ZDUSSCGKSA-N 0 0 367.192 3.514 20 5 FHBDRN CCCN(CCc1cccs1)c1nc(C)cc(C(=O)OC)c1[N+](=O)[O-] ZINC000561267688 931389903 /nfs/dbraw/zinc/38/99/03/931389903.db2.gz JRHUSNXYIPAZPD-UHFFFAOYSA-N 0 0 363.439 3.605 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)c2ccc(-n3ccnc3)cc2)cc1[N+](=O)[O-] ZINC000177871729 931395527 /nfs/dbraw/zinc/39/55/27/931395527.db2.gz FPLVDQPHNVWVGR-AWEZNQCLSA-N 0 0 350.378 3.580 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1C[C@@H]1Cc1ccccc1 ZINC000610186168 931404985 /nfs/dbraw/zinc/40/49/85/931404985.db2.gz HPLHJWCMUMURDE-DHSIGJKJSA-N 0 0 356.447 3.823 20 5 FHBDRN O=C(NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)NCc1ccccc1Cl ZINC000580974542 931434858 /nfs/dbraw/zinc/43/48/58/931434858.db2.gz BEHJGJCARUBMGO-UHFFFAOYSA-N 0 0 372.812 3.771 20 5 FHBDRN C[C@@H]1C[C@@H](C(C)(C)C)CCN1S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000557864820 931437463 /nfs/dbraw/zinc/43/74/63/931437463.db2.gz VMDQILQBNKTNCM-HIFRSBDPSA-N 0 0 354.472 3.571 20 5 FHBDRN COc1ccc(NC(=O)/C=C\c2nc3ccccc3s2)c([N+](=O)[O-])c1 ZINC000255252255 931516951 /nfs/dbraw/zinc/51/69/51/931516951.db2.gz LHXXPSGAIMMXRS-HJWRWDBZSA-N 0 0 355.375 3.865 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)Nc2cccc(-c3cnco3)c2)c1C ZINC000048230602 931522153 /nfs/dbraw/zinc/52/21/53/931522153.db2.gz WBLDQQSRVASQJK-UHFFFAOYSA-N 0 0 373.390 3.667 20 5 FHBDRN CC(C)(C)OC(=O)c1ccc(NC(=O)c2ccccc2[N+](=O)[O-])c(F)c1 ZINC000126163403 931525340 /nfs/dbraw/zinc/52/53/40/931525340.db2.gz KPMMPGDFFUFKTC-UHFFFAOYSA-N 0 0 360.341 3.942 20 5 FHBDRN O=C(N[C@H]1CCOC2(CCC2)C1)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000276020848 931539335 /nfs/dbraw/zinc/53/93/35/931539335.db2.gz VBVGCXWCQVQYQT-HNNXBMFYSA-N 0 0 362.429 3.925 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)NCc1csc(-c2ccco2)n1 ZINC000177904712 931546529 /nfs/dbraw/zinc/54/65/29/931546529.db2.gz DAAOKWRIQWDSJK-UHFFFAOYSA-N 0 0 372.406 3.653 20 5 FHBDRN CCc1nnc([C@@H](C)OC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)o1 ZINC000785032938 931551742 /nfs/dbraw/zinc/55/17/42/931551742.db2.gz UVVJQVNPNKQICJ-LLVKDONJSA-N 0 0 363.373 3.545 20 5 FHBDRN O=C(NCC1(CCOCc2ccccc2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000187368337 931569777 /nfs/dbraw/zinc/56/97/77/931569777.db2.gz SEZHXROXONJMOA-UHFFFAOYSA-N 0 0 354.406 3.712 20 5 FHBDRN Cc1c(C(=O)N2CC(C)(C)Oc3ccccc32)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000160776077 931595383 /nfs/dbraw/zinc/59/53/83/931595383.db2.gz SKGNWWSBDHYYHZ-UHFFFAOYSA-N 0 0 371.349 3.629 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1cccc(N(C)C)n1 ZINC000121274209 931597908 /nfs/dbraw/zinc/59/79/08/931597908.db2.gz WKMDDPBXZUKNRF-UHFFFAOYSA-N 0 0 360.439 3.810 20 5 FHBDRN COc1ccccc1[C@H](C)NC(=O)COc1cc(Cl)ccc1[N+](=O)[O-] ZINC000121281168 931636060 /nfs/dbraw/zinc/63/60/60/931636060.db2.gz OLIMRMAEHCZVHB-NSHDSACASA-N 0 0 364.785 3.513 20 5 FHBDRN CC(C)(C)c1ccc([C@@H](NCCn2ccc([N+](=O)[O-])n2)C(F)(F)F)cc1 ZINC000610485019 931641928 /nfs/dbraw/zinc/64/19/28/931641928.db2.gz TUHNLUAAFJFHHF-OAHLLOKOSA-N 0 0 370.375 3.982 20 5 FHBDRN O=C(Nc1ccc(-c2c[nH]cn2)cc1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000519059791 945070168 /nfs/dbraw/zinc/07/01/68/945070168.db2.gz TZONXRLLYXGNKP-UHFFFAOYSA-N 0 0 363.377 3.812 20 5 FHBDRN Cn1cnc([N+](=O)[O-])c1CSCc1ccc(OCC(F)(F)F)cc1 ZINC000477019555 931694212 /nfs/dbraw/zinc/69/42/12/931694212.db2.gz VBXXMMZWRAOEFQ-UHFFFAOYSA-N 0 0 361.345 3.703 20 5 FHBDRN C[C@H](CC(=O)c1ccc(F)cc1)NC(=O)C=Cc1ccc([N+](=O)[O-])cc1 ZINC000255283683 931736596 /nfs/dbraw/zinc/73/65/96/931736596.db2.gz PHWOTDADVVDVLA-XFVCYKSVSA-N 0 0 356.353 3.525 20 5 FHBDRN CN(C[C@@H]1CCCO[C@@H]1c1ccccc1)C(=O)c1csc([N+](=O)[O-])c1 ZINC000050862750 931738718 /nfs/dbraw/zinc/73/87/18/931738718.db2.gz VTKGRFOOLKEIPF-WMLDXEAASA-N 0 0 360.435 3.896 20 5 FHBDRN CN(C[C@H]1CCCO[C@@H]1c1ccccc1)C(=O)c1csc([N+](=O)[O-])c1 ZINC000050862751 931739163 /nfs/dbraw/zinc/73/91/63/931739163.db2.gz VTKGRFOOLKEIPF-RHSMWYFYSA-N 0 0 360.435 3.896 20 5 FHBDRN O=C(Nc1ccsc1)c1cc([N+](=O)[O-])ccc1I ZINC000096731290 931755797 /nfs/dbraw/zinc/75/57/97/931755797.db2.gz QJDOGYGQFYPLNL-UHFFFAOYSA-N 0 0 374.159 3.513 20 5 FHBDRN COc1cccc(C2(CNc3cccc(C(N)=O)c3[N+](=O)[O-])CCCC2)c1 ZINC000581267488 931756363 /nfs/dbraw/zinc/75/63/63/931756363.db2.gz ACOZTCPDEGIKJT-UHFFFAOYSA-N 0 0 369.421 3.626 20 5 FHBDRN O=C(NCc1ccc(Br)cc1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000096731201 931756370 /nfs/dbraw/zinc/75/63/70/931756370.db2.gz KNMBNGZLYYDSOP-UHFFFAOYSA-N 0 0 369.602 3.941 20 5 FHBDRN CCOc1cc(C(=O)Nc2ccc(C3CCC3)cn2)c([N+](=O)[O-])cc1OC ZINC000581272558 931769742 /nfs/dbraw/zinc/76/97/42/931769742.db2.gz TYRXKUPVJLYJPC-UHFFFAOYSA-N 0 0 371.393 3.917 20 5 FHBDRN CC(C)(NC(=O)c1ccc(C(F)(F)F)cn1)c1ccc([N+](=O)[O-])cc1 ZINC000430545760 931772832 /nfs/dbraw/zinc/77/28/32/931772832.db2.gz QUNIYTGSDLZTHX-UHFFFAOYSA-N 0 0 353.300 3.674 20 5 FHBDRN Cc1cc(NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)ccc1O ZINC000157013572 931774207 /nfs/dbraw/zinc/77/42/07/931774207.db2.gz WZDURPNBPJWPEO-UHFFFAOYSA-N 0 0 355.375 3.985 20 5 FHBDRN C[C@]1(c2ccccc2)CN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)CCO1 ZINC000157095767 931834212 /nfs/dbraw/zinc/83/42/12/931834212.db2.gz IMIZQNSZKNWJOT-GOSISDBHSA-N 0 0 360.797 3.636 20 5 FHBDRN Cc1c(CC(=O)N[C@@H](C)c2nc(C3CCCCC3)no2)cccc1[N+](=O)[O-] ZINC000126467692 931851884 /nfs/dbraw/zinc/85/18/84/931851884.db2.gz FLLSIMNJMFPZSM-ZDUSSCGKSA-N 0 0 372.425 3.754 20 5 FHBDRN CC[C@H](NC(=O)c1ccccc1)c1noc(-c2cc(C)cc([N+](=O)[O-])c2)n1 ZINC000581336432 931853238 /nfs/dbraw/zinc/85/32/38/931853238.db2.gz KQWTUQNPDXSPFI-INIZCTEOSA-N 0 0 366.377 3.834 20 5 FHBDRN O=[N+]([O-])c1ccc(N[C@@H]2CCN(c3ccc(Cl)c(Cl)c3)C2)nc1 ZINC000477082190 931867477 /nfs/dbraw/zinc/86/74/77/931867477.db2.gz AADKCIFRXYWNRE-SNVBAGLBSA-N 0 0 353.209 3.987 20 5 FHBDRN Cc1c(Br)cc(C(=O)N2C[C@@H](C)CC[C@H]2C)cc1[N+](=O)[O-] ZINC000510392396 931887496 /nfs/dbraw/zinc/88/74/96/931887496.db2.gz DDTWQASJJRVCND-VHSXEESVSA-N 0 0 355.232 3.926 20 5 FHBDRN Cc1c(Br)cc(C(=O)N2C[C@H](C)CC[C@@H]2C)cc1[N+](=O)[O-] ZINC000510392398 931887782 /nfs/dbraw/zinc/88/77/82/931887782.db2.gz DDTWQASJJRVCND-ZJUUUORDSA-N 0 0 355.232 3.926 20 5 FHBDRN C[C@@H]1CN(C(=O)c2c[nH]c3ccc([N+](=O)[O-])cc32)C[C@H](c2ccsc2)O1 ZINC000156170831 931900783 /nfs/dbraw/zinc/90/07/83/931900783.db2.gz RYGSGKGZVXIFIX-PIGZYNQJSA-N 0 0 371.418 3.740 20 5 FHBDRN CN1CCCN(C(=O)c2ccc([N+](=O)[O-])cc2Cl)c2ccc(F)cc21 ZINC000078191696 931907477 /nfs/dbraw/zinc/90/74/77/931907477.db2.gz LSOIPRHXEPPTBT-UHFFFAOYSA-N 0 0 363.776 3.874 20 5 FHBDRN CCc1ccc([C@H]2COCCN2C(=O)Nc2ccc([N+](=O)[O-])c(C)c2)o1 ZINC000121305581 931941877 /nfs/dbraw/zinc/94/18/77/931941877.db2.gz ZDUZPEZSBGAKAR-MRXNPFEDSA-N 0 0 359.382 3.664 20 5 FHBDRN Cc1cc(OCC(=O)N(CC(F)(F)F)c2ccccc2)ccc1[N+](=O)[O-] ZINC000430583806 931959358 /nfs/dbraw/zinc/95/93/58/931959358.db2.gz TXVBKYISRZMRKI-UHFFFAOYSA-N 0 0 368.311 3.878 20 5 FHBDRN CC[C@@H]1CCN1C(=O)c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1 ZINC000561350097 931968771 /nfs/dbraw/zinc/96/87/71/931968771.db2.gz GGHKIGIMNXQVSW-SECBINFHSA-N 0 0 369.208 3.712 20 5 FHBDRN CSc1ccc(S(=O)(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000175891825 931973775 /nfs/dbraw/zinc/97/37/75/931973775.db2.gz OEDJDSMXDFCICX-UHFFFAOYSA-N 0 0 366.464 3.530 20 5 FHBDRN COC(=O)c1cc(NC(=O)c2ccc(OC(C)(C)C)cc2)cc([N+](=O)[O-])c1 ZINC000430591992 931978524 /nfs/dbraw/zinc/97/85/24/931978524.db2.gz LKNQYRLUYQDARO-UHFFFAOYSA-N 0 0 372.377 3.811 20 5 FHBDRN COc1cc(C(=O)N2CCCCC[C@H]2c2ccco2)c([N+](=O)[O-])cc1OC ZINC000135161590 932005739 /nfs/dbraw/zinc/00/57/39/932005739.db2.gz NIXSYONFLNDXDH-AWEZNQCLSA-N 0 0 374.393 3.963 20 5 FHBDRN C[C@@H]1CN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C[C@@H](C(F)(F)F)O1 ZINC000610398572 932011334 /nfs/dbraw/zinc/01/13/34/932011334.db2.gz KMJOWOOMPXBFQF-OQPBUACISA-N 0 0 374.340 3.601 20 5 FHBDRN Cc1cc(C)cc([C@H](C)NC(=O)C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)c1 ZINC000121370789 932049777 /nfs/dbraw/zinc/04/97/77/932049777.db2.gz MMNDINGVJAYJLN-HNNXBMFYSA-N 0 0 369.421 3.644 20 5 FHBDRN Cn1cnc([N+](=O)[O-])c1N[C@@H](COCc1ccccc1)c1ccccc1 ZINC000077232851 932060314 /nfs/dbraw/zinc/06/03/14/932060314.db2.gz PNFYVGMISMOXNB-KRWDZBQOSA-N 0 0 352.394 3.698 20 5 FHBDRN CN(C[C@H](O)C1CC1)C(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000610572261 932065893 /nfs/dbraw/zinc/06/58/93/932065893.db2.gz MNBBKHRSVBXRQO-SFHVURJKSA-N 0 0 371.393 3.622 20 5 FHBDRN Cn1ncc(CN(Cc2ccccc2[N+](=O)[O-])C2CC2)c1C(F)(F)F ZINC000135223965 932075663 /nfs/dbraw/zinc/07/56/63/932075663.db2.gz KUWUHPPKEFCRMA-UHFFFAOYSA-N 0 0 354.332 3.512 20 5 FHBDRN C[C@H]1C[C@@H](c2ccc(F)cc2)CN1C(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000135239553 932081700 /nfs/dbraw/zinc/08/17/00/932081700.db2.gz YGTXGDVGDMMBHZ-GOEBONIOSA-N 0 0 372.396 3.907 20 5 FHBDRN COc1ccc(OCc2ccc(OCC(F)(F)F)nc2)c([N+](=O)[O-])c1 ZINC000134492783 932085589 /nfs/dbraw/zinc/08/55/89/932085589.db2.gz HIZXLRJYJYQYHE-UHFFFAOYSA-N 0 0 358.272 3.519 20 5 FHBDRN CCN(c1ccc(C(=O)OCC(=O)c2ccc([N+](=O)[O-])cc2)cc1)C(C)C ZINC000728339260 932120645 /nfs/dbraw/zinc/12/06/45/932120645.db2.gz TXOPQEXCJJNHNV-UHFFFAOYSA-N 0 0 370.405 3.869 20 5 FHBDRN Cc1ccc([C@@H]2CN(C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)CCO2)o1 ZINC000165797518 932122985 /nfs/dbraw/zinc/12/29/85/932122985.db2.gz GQUGRVPGDLGSPQ-HNNXBMFYSA-N 0 0 365.773 3.755 20 5 FHBDRN CCn1c(C)nc([N+](=O)[O-])c1N1CCC(C(=O)c2ccc(C)cc2)CC1 ZINC000581509868 932186228 /nfs/dbraw/zinc/18/62/28/932186228.db2.gz WDNRKFLYLSCTGQ-UHFFFAOYSA-N 0 0 356.426 3.527 20 5 FHBDRN COc1c(C(=O)Nc2ccc(C)c(Br)c2)cccc1[N+](=O)[O-] ZINC000317591676 932223444 /nfs/dbraw/zinc/22/34/44/932223444.db2.gz RIOVMXWKZAUQHZ-UHFFFAOYSA-N 0 0 365.183 3.927 20 5 FHBDRN COc1ccccc1C(C)(C)CNC(=O)CCc1cc(F)ccc1[N+](=O)[O-] ZINC001125516007 932259058 /nfs/dbraw/zinc/25/90/58/932259058.db2.gz HFBSKSGVPNKTBH-UHFFFAOYSA-N 0 0 374.412 3.769 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@H](c1cccc(C)c1)C(C)(C)C ZINC000178063041 932265076 /nfs/dbraw/zinc/26/50/76/932265076.db2.gz WWOAXOCSRCTASX-GOSISDBHSA-N 0 0 358.442 3.702 20 5 FHBDRN CNC(=O)c1ccc(N[C@H]2CCc3sc(Cl)cc32)c([N+](=O)[O-])c1 ZINC000581580568 932275621 /nfs/dbraw/zinc/27/56/21/932275621.db2.gz HJCIFXDAHAHXNA-JTQLQIEISA-N 0 0 351.815 3.769 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(N2CCC[C@@H](c3nc(C(F)(F)F)c[nH]3)C2)n1 ZINC000581587064 932282747 /nfs/dbraw/zinc/28/27/47/932282747.db2.gz ZEZFUMQUWMPHAS-LLVKDONJSA-N 0 0 369.347 3.733 20 5 FHBDRN COc1ccc(C(=O)N(C)c2cccc([N+](=O)[O-])c2)cc1-c1ccccn1 ZINC000119408627 932295847 /nfs/dbraw/zinc/29/58/47/932295847.db2.gz SHZPSZPYKFBVMY-UHFFFAOYSA-N 0 0 363.373 3.942 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)c2ccc(C(=O)NC(C)C)cc2)cc1[N+](=O)[O-] ZINC000119403007 932296523 /nfs/dbraw/zinc/29/65/23/932296523.db2.gz ZWGBYSLDIADTST-AWEZNQCLSA-N 0 0 369.421 3.532 20 5 FHBDRN C[C@@H](NC(=O)N(C[C@@H]1CCCO1)C1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000175902640 932320343 /nfs/dbraw/zinc/32/03/43/932320343.db2.gz JARGNJUURLICHO-KDOFPFPSSA-N 0 0 361.442 3.789 20 5 FHBDRN Cc1ccccc1[C@H]1CN(c2nc3sccn3c2[N+](=O)[O-])[C@H](C)CO1 ZINC000610516252 932331499 /nfs/dbraw/zinc/33/14/99/932331499.db2.gz MMLODHMFRSNNNW-TZMCWYRMSA-N 0 0 358.423 3.579 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)NC[C@H](C)c2ccc(C)cc2)cc1OC ZINC000127201376 932343563 /nfs/dbraw/zinc/34/35/63/932343563.db2.gz QJDNYQDTBXSYGU-AWEZNQCLSA-N 0 0 372.421 3.844 20 5 FHBDRN COc1c(C(=O)N2CC[C@](C)(c3ccc(C)cc3)C2)cccc1[N+](=O)[O-] ZINC000477141397 932349620 /nfs/dbraw/zinc/34/96/20/932349620.db2.gz FPPZJFFVVSMCGK-FQEVSTJZSA-N 0 0 354.406 3.716 20 5 FHBDRN CC[C@@H](c1ccccc1)[C@H]1CCCN1S(=O)(=O)c1ccccc1[N+](=O)[O-] ZINC000477162685 932360876 /nfs/dbraw/zinc/36/08/76/932360876.db2.gz OVYCUQRXWCFGIJ-DLBZAZTESA-N 0 0 374.462 3.942 20 5 FHBDRN Cc1c(NC(=O)NC2CC(F)(F)C2)cc([N+](=O)[O-])cc1C(F)(F)F ZINC000933343118 932360887 /nfs/dbraw/zinc/36/08/87/932360887.db2.gz OXZILINUAURGNB-UHFFFAOYSA-N 0 0 353.247 3.841 20 5 FHBDRN CCc1cc(NC(=O)[C@H](C)Cc2ccco2)c2cc([N+](=O)[O-])ccc2n1 ZINC001266777431 932363810 /nfs/dbraw/zinc/36/38/10/932363810.db2.gz PWNPZIXSPRWQOV-GFCCVEGCSA-N 0 0 353.378 3.538 20 5 FHBDRN Cc1oc(-c2cccs2)nc1Cn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000097121498 932383041 /nfs/dbraw/zinc/38/30/41/932383041.db2.gz FFGBIPLKGCBUJS-UHFFFAOYSA-N 0 0 357.347 3.576 20 5 FHBDRN O=C(NCCCCOCc1ccccc1)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000064995870 932420104 /nfs/dbraw/zinc/42/01/04/932420104.db2.gz YIPCRQDFBJNKMZ-UHFFFAOYSA-N 0 0 362.813 3.975 20 5 FHBDRN CCc1n[nH]c(=O)c(CNc2c(Cl)cc([N+](=O)[O-])cc2Cl)c1CC ZINC000127235565 932438263 /nfs/dbraw/zinc/43/82/63/932438263.db2.gz NEPYBHUSVNCUPR-UHFFFAOYSA-N 0 0 371.224 3.722 20 5 FHBDRN CSc1ccccc1C(=O)O[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000003420620 932493951 /nfs/dbraw/zinc/49/39/51/932493951.db2.gz RYRLAMSFOJTIHC-NSHDSACASA-N 0 0 360.391 3.501 20 5 FHBDRN Cc1ccccc1N1C(=O)C(=Cc2ccc([N+](=O)[O-])cc2Cl)NC1=S ZINC000588425262 932504376 /nfs/dbraw/zinc/50/43/76/932504376.db2.gz ZYFHVSJOUWGXBR-RIYZIHGNSA-N 0 0 373.821 3.819 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N[C@@H](C)c1nc2ccccc2n1C ZINC000477373035 932522178 /nfs/dbraw/zinc/52/21/78/932522178.db2.gz MTPWPGQTLKMFPE-NSHDSACASA-N 0 0 372.812 3.934 20 5 FHBDRN CC(C)(C)[C@H](NC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1)c1cccc(F)c1 ZINC000178104032 932523765 /nfs/dbraw/zinc/52/37/65/932523765.db2.gz XGBZWRDNGXRJPX-MRXNPFEDSA-N 0 0 373.384 3.576 20 5 FHBDRN Cc1cn2c(nc(C)c2CN(C)C(=O)c2ccc(C)c([N+](=O)[O-])c2)s1 ZINC000161003704 932528836 /nfs/dbraw/zinc/52/88/36/932528836.db2.gz LZEHQYMLUFTVJS-UHFFFAOYSA-N 0 0 358.423 3.501 20 5 FHBDRN C[C@@H](NC(=O)N1CCO[C@H](c2cccs2)C1)c1cccc([N+](=O)[O-])c1 ZINC000156365625 932552603 /nfs/dbraw/zinc/55/26/03/932552603.db2.gz SCLDHLXOKWOJFO-DOMZBBRYSA-N 0 0 361.423 3.500 20 5 FHBDRN CC(C)(NC(=O)c1ccn(C2CCCCC2)n1)c1ccccc1[N+](=O)[O-] ZINC000581730743 932570343 /nfs/dbraw/zinc/57/03/43/932570343.db2.gz SVVNPBMIDQJPGK-UHFFFAOYSA-N 0 0 356.426 3.962 20 5 FHBDRN O=[N+]([O-])c1cc2ccccc2nc1N1CCCN2c3ccccc3C[C@H]2C1 ZINC000581758680 932617416 /nfs/dbraw/zinc/61/74/16/932617416.db2.gz WSJHWSHLBHNWNX-KRWDZBQOSA-N 0 0 360.417 3.784 20 5 FHBDRN CN(Cc1cccc(OC(F)(F)F)c1)C(=O)c1ccc(F)cc1[N+](=O)[O-] ZINC000127289877 932622767 /nfs/dbraw/zinc/62/27/67/932622767.db2.gz FRJYJSXBRWGSIV-UHFFFAOYSA-N 0 0 372.274 3.905 20 5 FHBDRN CC1(C)[C@H](OCc2ccccc2)C[C@@H]1NC(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000471692893 932631268 /nfs/dbraw/zinc/63/12/68/932631268.db2.gz LCIZQXJPJDWKTK-RBUKOAKNSA-N 0 0 368.433 3.637 20 5 FHBDRN O=[N+]([O-])c1cnc(NC[C@@]2(O)CCC[C@H](C(F)(F)F)C2)c(Cl)c1 ZINC000302495839 932684586 /nfs/dbraw/zinc/68/45/86/932684586.db2.gz BIIVAEKOUCMOCU-QPUJVOFHSA-N 0 0 353.728 3.539 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N(C)Cc1ccc(Cl)nc1 ZINC000023891420 932706911 /nfs/dbraw/zinc/70/69/11/932706911.db2.gz APEMSNCHDOLELE-NSHDSACASA-N 0 0 365.842 3.782 20 5 FHBDRN Cc1c(CNS(=O)(=O)c2ccc(C(C)(C)C)s2)cccc1[N+](=O)[O-] ZINC001211518715 932712985 /nfs/dbraw/zinc/71/29/85/932712985.db2.gz XWDMJNNACKUYLE-UHFFFAOYSA-N 0 0 368.480 3.741 20 5 FHBDRN C[C@@H]1CCc2c(F)cccc2[C@H]1NC(=O)COc1cccc([N+](=O)[O-])c1 ZINC000430662598 932728112 /nfs/dbraw/zinc/72/81/12/932728112.db2.gz KCTZTZMEBFAVJT-BLVKFPJESA-N 0 0 358.369 3.553 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCC[C@H]1c1cccc(C)c1 ZINC000055911162 932737813 /nfs/dbraw/zinc/73/78/13/932737813.db2.gz NRZPMLLJKWMLCQ-SFHVURJKSA-N 0 0 369.421 3.687 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)NCc1nc(C(C)C)cs1 ZINC000178168209 932737887 /nfs/dbraw/zinc/73/78/87/932737887.db2.gz HXQDPZOBILMAFE-UHFFFAOYSA-N 0 0 350.400 3.505 20 5 FHBDRN CCOC(=O)N[C@@H]1CCCN(c2c(Cl)cc([N+](=O)[O-])cc2Cl)C1 ZINC000302051016 932749837 /nfs/dbraw/zinc/74/98/37/932749837.db2.gz XGOKNOMYPILUJX-SECBINFHSA-N 0 0 362.213 3.617 20 5 FHBDRN CSc1ccncc1NC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000610544177 932761273 /nfs/dbraw/zinc/76/12/73/932761273.db2.gz UMDYWWRUHSCPFK-SECBINFHSA-N 0 0 367.814 3.771 20 5 FHBDRN CCS[C@H]1CCCC[C@H]1NC(=O)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000561583644 932764022 /nfs/dbraw/zinc/76/40/22/932764022.db2.gz HMAFYVAZLZOKGJ-WBVHZDCISA-N 0 0 365.499 3.843 20 5 FHBDRN COc1ccc(CSCc2ncnn2-c2ccccc2)cc1[N+](=O)[O-] ZINC000512388107 932781968 /nfs/dbraw/zinc/78/19/68/932781968.db2.gz SGJMEYRHILNWKI-UHFFFAOYSA-N 0 0 356.407 3.618 20 5 FHBDRN CSc1ccncc1NC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000610546064 932804789 /nfs/dbraw/zinc/80/47/89/932804789.db2.gz YMLDZUNQSXTYBV-UHFFFAOYSA-N 0 0 368.212 3.727 20 5 FHBDRN CC[C@H](OC(=O)Cc1ccn(CC(F)(F)F)n1)c1cccc([N+](=O)[O-])c1 ZINC001266835569 932811061 /nfs/dbraw/zinc/81/10/61/932811061.db2.gz IGJGUDUODFTZLN-AWEZNQCLSA-N 0 0 371.315 3.591 20 5 FHBDRN C[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)CCN1Cc1c(F)cccc1[N+](=O)[O-] ZINC000134661406 932836503 /nfs/dbraw/zinc/83/65/03/932836503.db2.gz DLVIPOHQEJKRMR-OLZOCXBDSA-N 0 0 367.421 3.612 20 5 FHBDRN Nc1c(C(=O)Nc2ccccc2-c2nc3ccccc3[nH]2)cccc1[N+](=O)[O-] ZINC000178198137 932840372 /nfs/dbraw/zinc/84/03/72/932840372.db2.gz IAJWYXVOOVGHTD-UHFFFAOYSA-N 0 0 373.372 3.973 20 5 FHBDRN COc1ccc(C(=O)N[C@@H]2c3cccc(F)c3CC[C@H]2C)cc1[N+](=O)[O-] ZINC000430672116 932853328 /nfs/dbraw/zinc/85/33/28/932853328.db2.gz YMRMQSSLTUIMQU-ZMZPIMSZSA-N 0 0 358.369 3.796 20 5 FHBDRN CCc1ccc(C(=O)Nc2ccc(N3CCCCC3)cn2)cc1[N+](=O)[O-] ZINC000471774740 932864334 /nfs/dbraw/zinc/86/43/34/932864334.db2.gz SSYUHPFPLNSIHV-UHFFFAOYSA-N 0 0 354.410 3.795 20 5 FHBDRN O=C(Cn1ccc([N+](=O)[O-])n1)Nc1cccc(Sc2ccccc2)c1 ZINC000609375236 932913164 /nfs/dbraw/zinc/91/31/64/932913164.db2.gz OXOPCZLUOUGYOG-UHFFFAOYSA-N 0 0 354.391 3.581 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N2CCCCC[C@@H]2c2cccn2C)c1[N+](=O)[O-] ZINC000610917257 932930563 /nfs/dbraw/zinc/93/05/63/932930563.db2.gz OGMRDNUTOBBCIM-CQSZACIVSA-N 0 0 359.430 3.537 20 5 FHBDRN COc1ccc(OC)c([C@@H](C)NC(=O)/C(C)=C\c2ccc([N+](=O)[O-])cc2)c1 ZINC000588436003 932937480 /nfs/dbraw/zinc/93/74/80/932937480.db2.gz JRIPJQMKJCSSEU-YBEMTRGBSA-N 0 0 370.405 3.893 20 5 FHBDRN COc1ccc(NC(=O)/C(C)=C\c2ccc(OC)c(F)c2)c([N+](=O)[O-])c1 ZINC000588435854 932938262 /nfs/dbraw/zinc/93/82/62/932938262.db2.gz QTPDIWOVQHPGSX-FLIBITNWSA-N 0 0 360.341 3.793 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1C(=O)NC(C)C ZINC000588436569 932953946 /nfs/dbraw/zinc/95/39/46/932953946.db2.gz AOVOMAVGYZFRRR-OWBHPGMISA-N 0 0 367.405 3.775 20 5 FHBDRN C[C@H](NC(=O)c1ccc([N+](=O)[O-])cn1)c1ccc(Oc2cccnc2)cc1 ZINC000581904879 932954298 /nfs/dbraw/zinc/95/42/98/932954298.db2.gz GPALWJJOAOPKSU-ZDUSSCGKSA-N 0 0 364.361 3.668 20 5 FHBDRN CN(Cc1cc([N+](=O)[O-])ccc1Cl)C[C@@H](O)c1ccc(F)cc1F ZINC000051286902 932958618 /nfs/dbraw/zinc/95/86/18/932958618.db2.gz VBXCHYZMMRAVTD-MRXNPFEDSA-N 0 0 356.756 3.692 20 5 FHBDRN O=C(c1csc([N+](=O)[O-])c1)N1CCc2sc(Br)cc2C1 ZINC000610934251 932960199 /nfs/dbraw/zinc/96/01/99/932960199.db2.gz FKJCDRFEQWNZDL-UHFFFAOYSA-N 0 0 373.253 3.679 20 5 FHBDRN O=c1c2cc3ccccc3cc2ncn1C[C@@H](O)c1ccc(F)cc1F ZINC000051288507 932969537 /nfs/dbraw/zinc/96/95/37/932969537.db2.gz BIWFAJSIDNTTEQ-LJQANCHMSA-N 0 0 352.340 3.562 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](C)CSc2ccc(C)cc2)c1 ZINC000187593862 933016823 /nfs/dbraw/zinc/01/68/23/933016823.db2.gz OLZRMLRHPNCSGZ-ZDUSSCGKSA-N 0 0 360.435 3.822 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)CCCc1ccc(F)c(F)c1 ZINC000175990982 933028508 /nfs/dbraw/zinc/02/85/08/933028508.db2.gz VWOHOKONTRXNRC-UHFFFAOYSA-N 0 0 364.348 3.521 20 5 FHBDRN Cc1noc(C(F)F)c1C(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000610962386 933031579 /nfs/dbraw/zinc/03/15/79/933031579.db2.gz MNIOTPQQKSDCEB-UHFFFAOYSA-N 0 0 351.309 3.634 20 5 FHBDRN CCOc1ccc(-c2noc(CN(C)Cc3ccccc3[N+](=O)[O-])n2)cc1 ZINC000043783815 933034961 /nfs/dbraw/zinc/03/49/61/933034961.db2.gz UFHXYZOGZPRFAJ-UHFFFAOYSA-N 0 0 368.393 3.676 20 5 FHBDRN CCSCC[C@H](C)N(C)c1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1 ZINC000135347421 933045634 /nfs/dbraw/zinc/04/56/34/933045634.db2.gz OZMJZGJQAJLXFT-AWEZNQCLSA-N 0 0 365.499 3.799 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(-c2noc(C)n2)c1 ZINC000588437441 933051015 /nfs/dbraw/zinc/05/10/15/933051015.db2.gz KNKPCQCFHGFMAQ-BENRWUELSA-N 0 0 364.361 3.995 20 5 FHBDRN CCOc1cc(N2CCC[C@@H]2c2nc3c([nH]2)CCCC3)ccc1[N+](=O)[O-] ZINC000548346105 933056118 /nfs/dbraw/zinc/05/61/18/933056118.db2.gz AEWQKJMNVOPIJY-QGZVFWFLSA-N 0 0 356.426 3.937 20 5 FHBDRN CC[C@@H](NC(=O)Nc1c(C)ccc([N+](=O)[O-])c1C)c1c(C)nn(C)c1C ZINC000085637148 933065660 /nfs/dbraw/zinc/06/56/60/933065660.db2.gz XRONAZIBKIDCPC-CQSZACIVSA-N 0 0 359.430 3.835 20 5 FHBDRN CCc1ccc([C@@H](COC)NC(=O)/C(C)=C\c2ccc([N+](=O)[O-])cc2)o1 ZINC000588439433 933065741 /nfs/dbraw/zinc/06/57/41/933065741.db2.gz VOBMSSZSSLWSEQ-QAAVPBIRSA-N 0 0 358.394 3.657 20 5 FHBDRN COc1ccccc1O[C@@H](C)CNC(=O)/C(C)=C\c1ccc([N+](=O)[O-])cc1 ZINC000588439586 933065745 /nfs/dbraw/zinc/06/57/45/933065745.db2.gz AFHJETISOATBSJ-ZSMUJPCHSA-N 0 0 370.405 3.590 20 5 FHBDRN O=[N+]([O-])c1ccccc1/C=C/CN1CCN(C/C=C\c2ccccc2)CC1 ZINC000033324102 933068568 /nfs/dbraw/zinc/06/85/68/933068568.db2.gz NRGYNZQRBTVEKK-KMJJTFSOSA-N 0 0 363.461 3.939 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccnc1OCC(F)F ZINC000588441615 933072728 /nfs/dbraw/zinc/07/27/28/933072728.db2.gz VFOCFVIIVCVHNY-LUAWRHEFSA-N 0 0 363.320 3.676 20 5 FHBDRN Cc1ccc(NC(=O)COc2ccc([N+](=O)[O-])c(C)c2)cc1OC(F)F ZINC000430697812 933075646 /nfs/dbraw/zinc/07/56/46/933075646.db2.gz YEKZZNKZJBKQPU-UHFFFAOYSA-N 0 0 366.320 3.831 20 5 FHBDRN Cc1nn(Cc2ccccc2)c(C)c1CNc1cc(C)c([N+](=O)[O-])cn1 ZINC000074727255 933078107 /nfs/dbraw/zinc/07/81/07/933078107.db2.gz BQNUWGNTSVBIBG-UHFFFAOYSA-N 0 0 351.410 3.772 20 5 FHBDRN CC[C@@H](NC(=O)COc1ccc([N+](=O)[O-])c(C)c1)c1ccc(F)cc1F ZINC000430698617 933083036 /nfs/dbraw/zinc/08/30/36/933083036.db2.gz ZSDGRMBJLMDZRJ-MRXNPFEDSA-N 0 0 364.348 3.828 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)NCc1cnn(-c2ccccc2)c1 ZINC000588443972 933090037 /nfs/dbraw/zinc/09/00/37/933090037.db2.gz RNMABXNRGSOADT-PTNGSMBKSA-N 0 0 362.389 3.500 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N1CCO[C@H](c2ccc(F)cc2)C1 ZINC000588444168 933097696 /nfs/dbraw/zinc/09/76/96/933097696.db2.gz LWTXDOFAQUHAGL-IFMUVIIVSA-N 0 0 370.380 3.737 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(N2CCCC2)nc1 ZINC000588444255 933098540 /nfs/dbraw/zinc/09/85/40/933098540.db2.gz ZNJHPUPFXFLKHN-OWBHPGMISA-N 0 0 352.394 3.632 20 5 FHBDRN Cc1c(NC(=O)CN(C)c2ccccc2[N+](=O)[O-])cccc1C(F)(F)F ZINC000471843143 933107756 /nfs/dbraw/zinc/10/77/56/933107756.db2.gz FMDHIRSNQSTKCU-UHFFFAOYSA-N 0 0 367.327 3.997 20 5 FHBDRN Cc1cc(OCC(=O)Nc2ccccc2OCC2CC2)ccc1[N+](=O)[O-] ZINC000430702729 933113387 /nfs/dbraw/zinc/11/33/87/933113387.db2.gz RQYHBSQREAXWHA-UHFFFAOYSA-N 0 0 356.378 3.710 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)c2cc(Cc3ccccc3)n[nH]2)cc1[N+](=O)[O-] ZINC000581957237 933113855 /nfs/dbraw/zinc/11/38/55/933113855.db2.gz AETYNNMNUVELKI-AWEZNQCLSA-N 0 0 364.405 3.708 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(NCCCOc2ccc(C(F)(F)F)cn2)n1 ZINC000477692330 933169712 /nfs/dbraw/zinc/16/97/12/933169712.db2.gz KEPBFTZOKIQNIO-UHFFFAOYSA-N 0 0 356.304 3.593 20 5 FHBDRN Cc1ccc(S(=O)(=O)N([C@@H](C)c2ccccc2)C2CC2)cc1[N+](=O)[O-] ZINC000510524580 933180020 /nfs/dbraw/zinc/18/00/20/933180020.db2.gz QIEDEHWXTLPRHY-AWEZNQCLSA-N 0 0 360.435 3.818 20 5 FHBDRN CCn1c2ccc(C)cc2nc1NC(=O)COc1ccc([N+](=O)[O-])c(C)c1 ZINC000430785592 933229432 /nfs/dbraw/zinc/22/94/32/933229432.db2.gz XHVDJSOBVJFLKL-UHFFFAOYSA-N 0 0 368.393 3.599 20 5 FHBDRN Cc1cc(OCC(=O)N(C)c2ccc(OC(C)C)cc2)ccc1[N+](=O)[O-] ZINC000430786948 933229984 /nfs/dbraw/zinc/22/99/84/933229984.db2.gz DOGGTJCFXLRDKP-UHFFFAOYSA-N 0 0 358.394 3.732 20 5 FHBDRN Cc1cc(OCC(=O)N2CCC[C@@H]2/C=C\c2ccccc2)ccc1[N+](=O)[O-] ZINC000430786306 933230542 /nfs/dbraw/zinc/23/05/42/933230542.db2.gz PFLMAWRHEINFQT-HJCTWCACSA-N 0 0 366.417 3.986 20 5 FHBDRN COC(=O)c1cc(NC(=O)[C@@H]2[C@@H](C)[C@@H]2c2ccccc2)c(C)c([N+](=O)[O-])c1 ZINC000430800793 933237830 /nfs/dbraw/zinc/23/78/30/933237830.db2.gz UYDCEXZDYWFBCP-JBBXEZCESA-N 0 0 368.389 3.678 20 5 FHBDRN Cc1cc(OCC(=O)N2[C@H](C)c3ccc(F)cc3C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000430802218 933238182 /nfs/dbraw/zinc/23/81/82/933238182.db2.gz KKRCOCFWWUBANC-UONOGXRCSA-N 0 0 372.396 3.956 20 5 FHBDRN C/C=C\c1ccc(NC(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000510581007 933245324 /nfs/dbraw/zinc/24/53/24/933245324.db2.gz QUGBNLMJILXVAS-IHWYPQMZSA-N 0 0 359.769 3.859 20 5 FHBDRN COc1cc(C(=O)NCC[C@H]2CCCC[C@@H]2C)c([N+](=O)[O-])cc1OC ZINC000510603883 933264972 /nfs/dbraw/zinc/26/49/72/933264972.db2.gz YRPOWAVIXBWFTP-QWHCGFSZSA-N 0 0 350.415 3.558 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1N1CCCCC1)N1C[C@H]2CCCC[C@@H]2C1 ZINC000178328760 933270428 /nfs/dbraw/zinc/27/04/28/933270428.db2.gz DEZKPFDAPPANKX-HZPDHXFCSA-N 0 0 357.454 3.847 20 5 FHBDRN COc1cc(NC(=O)COc2ccc([N+](=O)[O-])c(C)c2)ccc1Cl ZINC000430832265 933282193 /nfs/dbraw/zinc/28/21/93/933282193.db2.gz YITIOLKEOUZSFB-UHFFFAOYSA-N 0 0 350.758 3.583 20 5 FHBDRN COC(=O)c1cnc(Nc2cccc(Oc3ccccn3)c2)c([N+](=O)[O-])c1 ZINC000477741954 933285031 /nfs/dbraw/zinc/28/50/31/933285031.db2.gz HPICYWJIKKIUCH-UHFFFAOYSA-N 0 0 366.333 3.707 20 5 FHBDRN CC(C)N(Cc1ccco1)C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000477738308 933286814 /nfs/dbraw/zinc/28/68/14/933286814.db2.gz DGFWDEUBDZDUFS-UHFFFAOYSA-N 0 0 357.410 3.839 20 5 FHBDRN COC(=O)c1cnc(NCc2ccc(C)cc2OC(C)(C)C)c([N+](=O)[O-])c1 ZINC000477747348 933316838 /nfs/dbraw/zinc/31/68/38/933316838.db2.gz YQHREQMMQCMVMA-UHFFFAOYSA-N 0 0 373.409 3.874 20 5 FHBDRN C[C@@H]1CN(C(=O)c2ccc(Sc3ccc([N+](=O)[O-])cc3)cc2)CCO1 ZINC000510639445 933341517 /nfs/dbraw/zinc/34/15/17/933341517.db2.gz QMVPPEMLWAILGD-CYBMUJFWSA-N 0 0 358.419 3.607 20 5 FHBDRN Cc1ccc2c(c1)N(Cc1nnc(-c3ccc([N+](=O)[O-])cc3)o1)C[C@H](C)O2 ZINC000477768285 933373161 /nfs/dbraw/zinc/37/31/61/933373161.db2.gz STQLZITWIYRLAA-ZDUSSCGKSA-N 0 0 366.377 3.741 20 5 FHBDRN CC(C)(C)n1cc(NC(=O)c2ccc(Br)cc2[N+](=O)[O-])cn1 ZINC000430938614 933447740 /nfs/dbraw/zinc/44/77/40/933447740.db2.gz INSOFIIIKWHEHE-UHFFFAOYSA-N 0 0 367.203 3.561 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1)N1C[C@@H](C(F)(F)F)[C@H](C(F)(F)F)C1 ZINC000610591571 933455677 /nfs/dbraw/zinc/45/56/77/933455677.db2.gz RSWKIUXHECAMSS-NXEZZACHSA-N 0 0 371.237 3.799 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1)N1C[C@H](C(F)(F)F)[C@H](C(F)(F)F)C1 ZINC000610591570 933455950 /nfs/dbraw/zinc/45/59/50/933455950.db2.gz RSWKIUXHECAMSS-AOOOYVTPSA-N 0 0 371.237 3.799 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@H](C(F)(F)F)[C@H](C(F)(F)F)C1 ZINC000610598263 933494680 /nfs/dbraw/zinc/49/46/80/933494680.db2.gz ZSPJIMQPTWYFLI-PHIMTYICSA-N 0 0 370.249 3.716 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)NCc1c(F)cc(F)c(F)c1F ZINC000430968409 933526228 /nfs/dbraw/zinc/52/62/28/933526228.db2.gz ALAGPBHFEYHQEJ-UHFFFAOYSA-N 0 0 357.263 3.781 20 5 FHBDRN Cc1c(C(=O)NCCc2ccccc2[N+](=O)[O-])cccc1-c1ccccn1 ZINC000548418300 933569439 /nfs/dbraw/zinc/56/94/39/933569439.db2.gz CCPGYSDGGSZKDC-UHFFFAOYSA-N 0 0 361.401 3.938 20 5 FHBDRN CC(C)(NC(=O)CCCn1cnc2ccccc21)c1ccc([N+](=O)[O-])cc1 ZINC000610637468 933580551 /nfs/dbraw/zinc/58/05/51/933580551.db2.gz LCUINZHDFNQIBA-UHFFFAOYSA-N 0 0 366.421 3.776 20 5 FHBDRN Cc1cc(C)cc([C@@H]2CCN(C(=O)NCCc3ccccc3[N+](=O)[O-])C2)c1 ZINC000548423150 933595562 /nfs/dbraw/zinc/59/55/62/933595562.db2.gz POYVEKZXRPMMMZ-GOSISDBHSA-N 0 0 367.449 3.953 20 5 FHBDRN CCc1ccc(C(=O)N[C@H](c2ccccc2)[C@@H]2CCCO2)cc1[N+](=O)[O-] ZINC000471904885 933602100 /nfs/dbraw/zinc/60/21/00/933602100.db2.gz IDMQBZRSCBMBER-RBUKOAKNSA-N 0 0 354.406 3.807 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CCC[C@@H]1C(=O)OC(C)(C)C ZINC000276828767 933623656 /nfs/dbraw/zinc/62/36/56/933623656.db2.gz QLVVJODLEINCDP-CQSZACIVSA-N 0 0 363.414 3.550 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)N(CC(F)F)CC1CCC1 ZINC000535658087 933646873 /nfs/dbraw/zinc/64/68/73/933646873.db2.gz JNGDJPBOQQIZMV-UHFFFAOYSA-N 0 0 355.385 3.681 20 5 FHBDRN C[C@@H]1[C@@H](C(F)(F)F)CCN1C(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000471907695 933653606 /nfs/dbraw/zinc/65/36/06/933653606.db2.gz VFSRETSTULVUID-DOMZBBRYSA-N 0 0 373.375 3.900 20 5 FHBDRN C[C@@H](C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)N1CCC[C@@H](C)C1 ZINC000610655867 933658960 /nfs/dbraw/zinc/65/89/60/933658960.db2.gz VWUAOZQHJJUGGR-OLZOCXBDSA-N 0 0 374.466 3.777 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])s1)N1CC(Cc2ccc(C(F)(F)F)cc2)C1 ZINC000610660561 933678375 /nfs/dbraw/zinc/67/83/75/933678375.db2.gz VEQYEHVEBWTKFR-UHFFFAOYSA-N 0 0 370.352 3.990 20 5 FHBDRN 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FHBDRN CSCc1nc2ccccc2n1CC(=O)Oc1c(C)cccc1[N+](=O)[O-] ZINC000760021508 945084807 /nfs/dbraw/zinc/08/48/07/945084807.db2.gz BFXAYWSRGMYHOL-UHFFFAOYSA-N 0 0 371.418 3.722 20 5 FHBDRN COc1cc(OC)cc(OCCCN(C)Cc2csc([N+](=O)[O-])c2)c1 ZINC000084865823 935226895 /nfs/dbraw/zinc/22/68/95/935226895.db2.gz HHTQIADDQZAHRL-UHFFFAOYSA-N 0 0 366.439 3.574 20 5 FHBDRN Cc1cc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000450871837 935228997 /nfs/dbraw/zinc/22/89/97/935228997.db2.gz BOFFIXSRPKHZGB-UFBFGSQYSA-N 0 0 372.265 3.672 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)Oc1cccc(F)c1 ZINC000755073279 935231927 /nfs/dbraw/zinc/23/19/27/935231927.db2.gz PMSRDKLLAGBEHC-UHFFFAOYSA-N 0 0 354.131 3.645 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)N1CCC(CC(F)(F)F)CC1 ZINC000551268674 935237597 /nfs/dbraw/zinc/23/75/97/935237597.db2.gz JFQXAWQWHDFSGJ-UHFFFAOYSA-N 0 0 359.348 3.511 20 5 FHBDRN O=[N+]([O-])c1ccc(CN(Cc2ccccc2)C[C@H](O)C(F)(F)F)cc1 ZINC000611575437 935238678 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C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCCc1cc2ccccc2[nH]1 ZINC000119824881 935272495 /nfs/dbraw/zinc/27/24/95/935272495.db2.gz JHWQSOHZPRYJBZ-CYBMUJFWSA-N 0 0 369.446 3.916 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1OCC(=O)Nc1ccc(C)cc1Cl ZINC000072068152 935275318 /nfs/dbraw/zinc/27/53/18/935275318.db2.gz XTZGYBYZUAHCJF-UHFFFAOYSA-N 0 0 350.758 3.583 20 5 FHBDRN O=C(NCc1cc(-c2ccccc2)on1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000119837718 935276835 /nfs/dbraw/zinc/27/68/35/935276835.db2.gz ZDPPYBGADDQXFP-UHFFFAOYSA-N 0 0 357.753 3.833 20 5 FHBDRN COC(=O)[C@H](C)[C@H](NC(=O)Nc1cc([N+](=O)[O-])ccc1C)c1ccccc1 ZINC000119848517 935280747 /nfs/dbraw/zinc/28/07/47/935280747.db2.gz TXDDHXUOTZBBJI-DYVFJYSZSA-N 0 0 371.393 3.575 20 5 FHBDRN CCOc1ccc(NC(=O)[C@@H]2C[C@H]2c2cccc([N+](=O)[O-])c2)cc1OC ZINC001125582983 935296918 /nfs/dbraw/zinc/29/69/18/935296918.db2.gz INOWCKXYVMWHJA-JKSUJKDBSA-N 0 0 356.378 3.744 20 5 FHBDRN C[C@H](CCc1ccccc1F)C(=O)NCCNc1ccccc1[N+](=O)[O-] ZINC000463442576 935301552 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FHBDRN COc1c(C)cnc(CN(C)Cc2c(F)cc([N+](=O)[O-])cc2F)c1C ZINC000451370904 935367997 /nfs/dbraw/zinc/36/79/97/935367997.db2.gz CSCXXHLNTAFKJU-UHFFFAOYSA-N 0 0 351.353 3.525 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H](C)c1ccncc1CC ZINC000439937605 945096768 /nfs/dbraw/zinc/09/67/68/945096768.db2.gz YQFQQMYPOZIARK-GFCCVEGCSA-N 0 0 358.398 3.834 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NCC(=O)Nc1ccccc1OC(F)F ZINC000085288964 935416724 /nfs/dbraw/zinc/41/67/24/935416724.db2.gz ICXLKMPJKPCPOZ-UHFFFAOYSA-N 0 0 365.336 3.864 20 5 FHBDRN CCc1nn(C)cc1NC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000091164025 935438199 /nfs/dbraw/zinc/43/81/99/935438199.db2.gz FHOVDUBWSUDEFJ-UHFFFAOYSA-N 0 0 365.393 3.887 20 5 FHBDRN CC(=O)CCc1ccc(O[C@@H](C)C(=O)N(C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000158261718 935466011 /nfs/dbraw/zinc/46/60/11/935466011.db2.gz AVAGLYDSPLOUGV-HNNXBMFYSA-N 0 0 370.405 3.547 20 5 FHBDRN Cc1ccc(NC(=O)c2ccc3nc(C(F)(F)F)cn3c2)cc1[N+](=O)[O-] ZINC000472211935 935511218 /nfs/dbraw/zinc/51/12/18/935511218.db2.gz BVRMLUJXVKKYRX-UHFFFAOYSA-N 0 0 364.283 3.822 20 5 FHBDRN CCc1ccc([C@@H]2CCN(C(=O)c3cc4c(cc3[N+](=O)[O-])OCO4)C2)cc1 ZINC000582319137 935521694 /nfs/dbraw/zinc/52/16/94/935521694.db2.gz DTKMEFVKUAQXIU-OAHLLOKOSA-N 0 0 368.389 3.516 20 5 FHBDRN Cc1nc(Cc2noc(C(C)(C)c3ccc([N+](=O)[O-])cc3F)n2)cs1 ZINC000582325726 935524399 /nfs/dbraw/zinc/52/43/99/935524399.db2.gz VDFRBJDAIBOKSF-UHFFFAOYSA-N 0 0 362.386 3.799 20 5 FHBDRN Cc1cccnc1[C@H](NC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12)C(C)C ZINC000115406202 935529170 /nfs/dbraw/zinc/52/91/70/935529170.db2.gz GSEOFPKQIKTMLT-QGZVFWFLSA-N 0 0 352.394 3.907 20 5 FHBDRN CCc1c(C(=O)N(C)c2cccc([N+](=O)[O-])c2)cnn1-c1ccccc1 ZINC000158098428 935557240 /nfs/dbraw/zinc/55/72/40/935557240.db2.gz XMSRSBFIOUFGOS-UHFFFAOYSA-N 0 0 350.378 3.620 20 5 FHBDRN Cn1nc([N+](=O)[O-])cc1C(=O)N1CCC(c2cccc3ccccc32)CC1 ZINC000478075486 935565783 /nfs/dbraw/zinc/56/57/83/935565783.db2.gz HIMYRSMNSGAPEI-UHFFFAOYSA-N 0 0 364.405 3.501 20 5 FHBDRN Cc1ccc(C)c(S(=O)(=O)N(Cc2ccccc2)C2CC2)c1[N+](=O)[O-] ZINC000478139556 935577123 /nfs/dbraw/zinc/57/71/23/935577123.db2.gz SZJYHVFYLKIPGZ-UHFFFAOYSA-N 0 0 360.435 3.565 20 5 FHBDRN Cc1ccccc1Cc1nc(CN(C)CCc2ccccc2[N+](=O)[O-])no1 ZINC000511104596 935579095 /nfs/dbraw/zinc/57/90/95/935579095.db2.gz HNJLWFNCDZRDNF-UHFFFAOYSA-N 0 0 366.421 3.552 20 5 FHBDRN CCOc1cc(NC[C@H]2CC[C@@H](c3nc(C4CC4)no3)O2)ccc1[N+](=O)[O-] ZINC000431389290 935581116 /nfs/dbraw/zinc/58/11/16/935581116.db2.gz YBSBVUVBLIPKPX-HIFRSBDPSA-N 0 0 374.397 3.586 20 5 FHBDRN Cn1c(CN[C@H]2CCc3c2cccc3[N+](=O)[O-])nc2cc(Cl)ccc21 ZINC000582370445 935581749 /nfs/dbraw/zinc/58/17/49/935581749.db2.gz PXASZUCEXGXBHI-AWEZNQCLSA-N 0 0 356.813 3.912 20 5 FHBDRN COC(=O)c1cnc(SCc2ccc(OC)c(Cl)c2)c([N+](=O)[O-])c1 ZINC000478152971 935582005 /nfs/dbraw/zinc/58/20/05/935582005.db2.gz JNSBFFFDWYHAJE-UHFFFAOYSA-N 0 0 368.798 3.731 20 5 FHBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1Cn1cnc2ccc(Cl)cc2c1=O ZINC000511106990 935583764 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20 5 FHBDRN CC[C@H](C)c1ncc(NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)cn1 ZINC000478331711 935610535 /nfs/dbraw/zinc/61/05/35/935610535.db2.gz RBUNVBDVPLGNLV-NSHDSACASA-N 0 0 360.389 3.954 20 5 FHBDRN CS(=O)(=O)c1ccc(Oc2ccc([N+](=O)[O-])cc2Br)cc1 ZINC000478324175 935610701 /nfs/dbraw/zinc/61/07/01/935610701.db2.gz NXEIHVPZWJGGDR-UHFFFAOYSA-N 0 0 372.196 3.553 20 5 FHBDRN COC(=O)c1coc(/C=C(\c2ccncc2)c2ccc([N+](=O)[O-])cc2)c1 ZINC000478339543 935615825 /nfs/dbraw/zinc/61/58/25/935615825.db2.gz AXQHEIZVJSJYRF-WQRHYEAKSA-N 0 0 350.330 3.958 20 5 FHBDRN Cc1ccc(C(=O)Nc2cccc([N+](=O)[O-])c2C)c(Br)n1 ZINC000158184729 935617795 /nfs/dbraw/zinc/61/77/95/935617795.db2.gz LWZMLMXAFXEKBE-UHFFFAOYSA-N 0 0 350.172 3.621 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@H](c2ccccc2)[C@H]2COCC[C@H]21 ZINC000287948298 935619956 /nfs/dbraw/zinc/61/99/56/935619956.db2.gz QGYCABZSROYRGH-VAMGGRTRSA-N 0 0 366.417 3.548 20 5 FHBDRN O=C([C@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1)N(Cc1ccco1)c1ccccn1 ZINC001125595886 935622541 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BNXAYOYTSAVYBA-UHFFFAOYSA-N 0 0 353.353 3.737 20 5 FHBDRN C[C@@H]1CCC[C@@H]1CNC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000536143242 938449751 /nfs/dbraw/zinc/44/97/51/938449751.db2.gz ZZJAENYRJRCYRU-GHMZBOCLSA-N 0 0 360.332 3.702 20 5 FHBDRN COc1cccc(C[C@H]2CCCN2c2nc3cc([N+](=O)[O-])ccc3[nH]2)c1 ZINC000583851859 938450863 /nfs/dbraw/zinc/45/08/63/938450863.db2.gz KXYRLCQXCHASGV-CQSZACIVSA-N 0 0 352.394 3.691 20 5 FHBDRN O=C(N[C@@H]1[C@H]2CCc3ccccc3[C@@H]12)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000158797067 938462779 /nfs/dbraw/zinc/46/27/79/938462779.db2.gz KNIMVFOHMLCULQ-QKYXUNIQSA-N 0 0 359.385 3.601 20 5 FHBDRN O=C(NCC1=CCCOC1)c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1 ZINC000583878740 938464158 /nfs/dbraw/zinc/46/41/58/938464158.db2.gz YSRUGLNLIQMPAF-UHFFFAOYSA-N 0 0 370.430 3.823 20 5 FHBDRN CC1(C)CCc2nc(NC(=O)c3c(Cl)cccc3[N+](=O)[O-])ncc2C1 ZINC000278482541 938469382 /nfs/dbraw/zinc/46/93/82/938469382.db2.gz IBXGGFTVLAIIKV-UHFFFAOYSA-N 0 0 360.801 3.805 20 5 FHBDRN CC(C)(NC(=O)CCCc1ccc(O)c(F)c1)c1ccccc1[N+](=O)[O-] ZINC000583890151 938472161 /nfs/dbraw/zinc/47/21/61/938472161.db2.gz SQNKFPRBGLLUHO-UHFFFAOYSA-N 0 0 360.385 3.814 20 5 FHBDRN Cc1ccccc1O[C@@H](C)CNC(=O)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000583923444 938487599 /nfs/dbraw/zinc/48/75/99/938487599.db2.gz NBLNMIFNOXDQJB-INIZCTEOSA-N 0 0 371.437 3.555 20 5 FHBDRN C[C@@H]1CCC[C@H](NC(=O)COc2ccc([N+](=O)[O-])cc2C(F)(F)F)[C@H]1C ZINC000516715119 945179652 /nfs/dbraw/zinc/17/96/52/945179652.db2.gz OIHNQXNPTPQRAF-SUNKGSAMSA-N 0 0 374.359 3.933 20 5 FHBDRN Cc1nc(Cl)ccc1C(=O)Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1 ZINC000161954980 938501725 /nfs/dbraw/zinc/50/17/25/938501725.db2.gz SUAQTGAJUXFMQR-UHFFFAOYSA-N 0 0 357.757 3.594 20 5 FHBDRN COc1ccc(CNC(=O)c2c([N+](=O)[O-])cccc2C(F)(F)F)cc1 ZINC000583961559 938505596 /nfs/dbraw/zinc/50/55/96/938505596.db2.gz GFCFOXVHZZUCDN-UHFFFAOYSA-N 0 0 354.284 3.552 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)Nc1cc(CCc2ccccc2)ccn1 ZINC000427194149 945184340 /nfs/dbraw/zinc/18/43/40/945184340.db2.gz YDRAUIBNLUHITP-UHFFFAOYSA-N 0 0 361.401 3.956 20 5 FHBDRN Cc1c(Br)cc(C(=O)N[C@H]2CCC[C@@H](F)C2)cc1[N+](=O)[O-] ZINC000583996416 938526060 /nfs/dbraw/zinc/52/60/60/938526060.db2.gz QULHGDKMCMHCQH-MNOVXSKESA-N 0 0 359.195 3.676 20 5 FHBDRN CC(=O)c1cc(NCc2cc(Cl)c3c(c2)OCCO3)ccc1[N+](=O)[O-] ZINC000584010721 938542321 /nfs/dbraw/zinc/54/23/21/938542321.db2.gz IJJDQYGGPDJWKO-UHFFFAOYSA-N 0 0 362.769 3.834 20 5 FHBDRN CN(CCOc1ccccc1)C(=O)c1c([N+](=O)[O-])cccc1C(F)(F)F ZINC000584020927 938551060 /nfs/dbraw/zinc/55/10/60/938551060.db2.gz YLNYHEXLWRTRCU-UHFFFAOYSA-N 0 0 368.311 3.765 20 5 FHBDRN C[C@@H]1C[C@H](Nc2cc(C(F)(F)C(F)(F)F)ncc2[N+](=O)[O-])CCO1 ZINC000278582836 938553583 /nfs/dbraw/zinc/55/35/83/938553583.db2.gz YFYBPIVBQNAEMT-HTQZYQBOSA-N 0 0 355.263 3.623 20 5 FHBDRN COc1cc(N2CCC(c3ncc4n3CCCC4)CC2)c(F)cc1[N+](=O)[O-] ZINC000278581323 938555434 /nfs/dbraw/zinc/55/54/34/938555434.db2.gz CRKNNIPSSFBKQA-UHFFFAOYSA-N 0 0 374.416 3.659 20 5 FHBDRN CCCN(Cc1c(F)cccc1Cl)C(=O)c1nn(CC)cc1[N+](=O)[O-] ZINC000427194868 945185611 /nfs/dbraw/zinc/18/56/11/945185611.db2.gz XZUVXOGXFLNDTC-UHFFFAOYSA-N 0 0 368.796 3.656 20 5 FHBDRN Cc1cc(F)cc(C(=O)NC[C@@H](O)c2ccc3ccccc3c2)c1[N+](=O)[O-] ZINC000176808709 938563848 /nfs/dbraw/zinc/56/38/48/938563848.db2.gz HBOKAKTURINNEG-GOSISDBHSA-N 0 0 368.364 3.659 20 5 FHBDRN O=[N+]([O-])c1ccc(Cl)cc1S(=O)(=O)N1CCC[C@H]1c1ccccc1 ZINC000725820355 938567189 /nfs/dbraw/zinc/56/71/89/938567189.db2.gz GYOYFIZSFSKDAN-AWEZNQCLSA-N 0 0 366.826 3.774 20 5 FHBDRN CN(Cc1ccccn1)c1cc(C(F)(F)C(F)(F)F)ncc1[N+](=O)[O-] ZINC000278602467 938573336 /nfs/dbraw/zinc/57/33/36/938573336.db2.gz ZNFRTGXTXBCOIR-UHFFFAOYSA-N 0 0 362.258 3.675 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)N2CC[C@H](Cc3ccncc3)C2)cc1[N+](=O)[O-] ZINC000611803049 938576236 /nfs/dbraw/zinc/57/62/36/938576236.db2.gz KRDOANDSRKOKLO-MRXNPFEDSA-N 0 0 367.449 3.992 20 5 FHBDRN O=C(c1c(Cl)cccc1[N+](=O)[O-])N1CCCc2c([N+](=O)[O-])cccc21 ZINC000162003938 938577025 /nfs/dbraw/zinc/57/70/25/938577025.db2.gz KFVBQVBYPBGZMB-UHFFFAOYSA-N 0 0 361.741 3.749 20 5 FHBDRN CCOC(=O)c1cc(NCc2nc(-c3cccs3)c[nH]2)ccc1[N+](=O)[O-] ZINC000584075056 938587187 /nfs/dbraw/zinc/58/71/87/938587187.db2.gz PLEOFDBCWPOQHT-UHFFFAOYSA-N 0 0 372.406 3.835 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])NCC1(c2ccccc2Cl)CC1 ZINC000480252769 938590815 /nfs/dbraw/zinc/59/08/15/938590815.db2.gz NIKBLRYZACPLSK-UHFFFAOYSA-N 0 0 359.813 3.779 20 5 FHBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)c1ccc(Br)cn1 ZINC000135498657 938597378 /nfs/dbraw/zinc/59/73/78/938597378.db2.gz SETWRVZPESUUMX-UHFFFAOYSA-N 0 0 370.590 3.966 20 5 FHBDRN Cc1ccc(NC(=O)N2CC3(CCC3)[C@H]2C2CCOCC2)cc1[N+](=O)[O-] ZINC000584109471 938600721 /nfs/dbraw/zinc/60/07/21/938600721.db2.gz DUGUHERFVHAZCL-QGZVFWFLSA-N 0 0 359.426 3.716 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N1CCC[C@]2(C1)OCc1ccccc12 ZINC000584148379 938617848 /nfs/dbraw/zinc/61/78/48/938617848.db2.gz QTYQESSHPXSOCN-HXUWFJFHSA-N 0 0 352.390 3.565 20 5 FHBDRN COc1cc(Cc2noc([C@@H]3Cc4cccc(C)c4O3)n2)ccc1[N+](=O)[O-] ZINC000584154659 938620037 /nfs/dbraw/zinc/62/00/37/938620037.db2.gz GKQRWARBLACXEM-INIZCTEOSA-N 0 0 367.361 3.562 20 5 FHBDRN COc1cc(CNCc2nc3cc([N+](=O)[O-])ccc3[nH]2)ccc1OC(C)C ZINC000278674063 938638176 /nfs/dbraw/zinc/63/81/76/938638176.db2.gz LTHZQPPKYOLYQY-UHFFFAOYSA-N 0 0 370.409 3.557 20 5 FHBDRN C[C@@H](C(=O)N1CCC(Cc2cccnc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000584206706 938640669 /nfs/dbraw/zinc/64/06/69/938640669.db2.gz VAMGHUNKKACJJJ-OAHLLOKOSA-N 0 0 353.422 3.575 20 5 FHBDRN CCOc1ccc(NC(=O)CCOc2ccccc2[N+](=O)[O-])cc1OCC ZINC000054916021 938640780 /nfs/dbraw/zinc/64/07/80/938640780.db2.gz WLRJDMIMOATZSD-UHFFFAOYSA-N 0 0 374.393 3.800 20 5 FHBDRN O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000162092375 938644579 /nfs/dbraw/zinc/64/45/79/938644579.db2.gz WKXLARJMDVNXLJ-UHFFFAOYSA-N 0 0 361.741 3.749 20 5 FHBDRN COc1cc(Cl)c(C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)cc1OC ZINC000124236652 945192997 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20 5 FHBDRN CCCCSc1nnc(Sc2c([N+](=O)[O-])c(CC)nn2C)s1 ZINC000584357489 938702425 /nfs/dbraw/zinc/70/24/25/938702425.db2.gz OGIBRXMYHLLVBF-UHFFFAOYSA-N 0 0 359.502 3.786 20 5 FHBDRN O=[N+]([O-])c1ccc(NCc2cccc(N3CCOCC3)c2)c2ncccc12 ZINC000432145940 945199890 /nfs/dbraw/zinc/19/98/90/945199890.db2.gz XXNIRDJVTPEIBA-UHFFFAOYSA-N 0 0 364.405 3.592 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)Nc1ccc2c(c1)CCCO2 ZINC000506015805 945200240 /nfs/dbraw/zinc/20/02/40/945200240.db2.gz YMWKCSRSAXSMNM-UHFFFAOYSA-N 0 0 351.362 3.513 20 5 FHBDRN CC[C@@H]1c2ccsc2CCN1S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-] ZINC000507383493 945204161 /nfs/dbraw/zinc/20/41/61/945204161.db2.gz SWKKUNVNYICXFO-CYBMUJFWSA-N 0 0 366.464 3.663 20 5 FHBDRN C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CCC(F)(F)[C@@H](C)C1 ZINC000289878495 938863426 /nfs/dbraw/zinc/86/34/26/938863426.db2.gz RGPVJKGSTLEVJS-WDEREUQCSA-N 0 0 352.341 3.683 20 5 FHBDRN COc1ccc(NC(=O)CCSc2ncccc2[N+](=O)[O-])cc1Cl ZINC000480359998 938880172 /nfs/dbraw/zinc/88/01/72/938880172.db2.gz DZGNKUWORKEBIC-UHFFFAOYSA-N 0 0 367.814 3.773 20 5 FHBDRN O=C(NCCCCOCc1ccccc1)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000170798297 938884959 /nfs/dbraw/zinc/88/49/59/938884959.db2.gz XPPPHUSISBEVRZ-UHFFFAOYSA-N 0 0 364.348 3.600 20 5 FHBDRN Cc1nc(C(F)(F)F)ccc1C(=O)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000179097702 938886054 /nfs/dbraw/zinc/88/60/54/938886054.db2.gz CBENZUKNNBVBNK-UHFFFAOYSA-N 0 0 365.311 3.910 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CSc1nnc(-c2ccccc2OC)o1 ZINC000024222688 938886553 /nfs/dbraw/zinc/88/65/53/938886553.db2.gz XOXOPNVEWMPTAR-UHFFFAOYSA-N 0 0 373.390 3.954 20 5 FHBDRN CC[C@@H](OC(=O)C1CCN(CC(F)F)CC1)c1cccc([N+](=O)[O-])c1 ZINC001267374267 938902350 /nfs/dbraw/zinc/90/23/50/938902350.db2.gz HAZZHHUQGNIHTK-OAHLLOKOSA-N 0 0 356.369 3.566 20 5 FHBDRN C[C@@H](c1ccc(Cl)c(Cl)c1)[S@@](=O)CCn1cc([N+](=O)[O-])cn1 ZINC000158851557 938910871 /nfs/dbraw/zinc/91/08/71/938910871.db2.gz HSDMBRUZNDJIDP-GTUYJWLHSA-N 0 0 362.238 3.608 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC[C@@H]1c1ccc(C)cc1 ZINC000065685441 938942089 /nfs/dbraw/zinc/94/20/89/938942089.db2.gz BERMEHQEMSVVNV-GOSISDBHSA-N 0 0 374.462 3.991 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1C(F)(F)F)c1ccc2c(c1)COC2 ZINC000140284923 938945596 /nfs/dbraw/zinc/94/55/96/938945596.db2.gz GOHOWEBYYUSCKE-UHFFFAOYSA-N 0 0 367.279 3.906 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(C)Cc1cccc(Cl)c1 ZINC000065684971 938945656 /nfs/dbraw/zinc/94/56/56/938945656.db2.gz DXCWUWUTQQBYBY-UHFFFAOYSA-N 0 0 368.842 3.631 20 5 FHBDRN O=[N+]([O-])c1cccc(CS(=O)(=O)N2CC[C@H]2c2ccc(Cl)cc2)c1 ZINC000511258971 938965575 /nfs/dbraw/zinc/96/55/75/938965575.db2.gz HGEIMZDGIQEODG-INIZCTEOSA-N 0 0 366.826 3.525 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)Nc1cc(F)c(OC(C)C)c(F)c1 ZINC000544062500 938966644 /nfs/dbraw/zinc/96/66/44/938966644.db2.gz RSQQLAHUECJNHU-UHFFFAOYSA-N 0 0 351.309 3.616 20 5 FHBDRN O=C(c1ccc2c(c1)OCCCO2)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000179148966 938979788 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3.570 20 5 FHBDRN O=[N+]([O-])c1cccc(OC[C@H](O)CSc2nc3ccccc3s2)c1 ZINC000061715266 938993873 /nfs/dbraw/zinc/99/38/73/938993873.db2.gz SRFUTBDYMONRJA-LBPRGKRZSA-N 0 0 362.432 3.737 20 5 FHBDRN Cc1c(NC(=O)[C@H](C)N2CC[C@H](CC(F)(F)F)C2)cccc1[N+](=O)[O-] ZINC000278781143 938994918 /nfs/dbraw/zinc/99/49/18/938994918.db2.gz NOZWZAULEFEUJS-NWDGAFQWSA-N 0 0 359.348 3.505 20 5 FHBDRN CCOC(=O)c1cccc(Sc2ncnc3cccc([N+](=O)[O-])c32)c1 ZINC000480581923 938996054 /nfs/dbraw/zinc/99/60/54/938996054.db2.gz OBQWAWCTKVHWQC-UHFFFAOYSA-N 0 0 355.375 3.866 20 5 FHBDRN COc1ccc(CNC(=O)CCCOc2ccc(C)cc2C)cc1[N+](=O)[O-] ZINC000480582128 938996111 /nfs/dbraw/zinc/99/61/11/938996111.db2.gz PBZMEWCGBJMIIF-UHFFFAOYSA-N 0 0 372.421 3.696 20 5 FHBDRN COc1cc(C)c(NC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)cc1OC ZINC000065715148 938996793 /nfs/dbraw/zinc/99/67/93/938996793.db2.gz XGNISNWNGDWLON-UHFFFAOYSA-N 0 0 369.377 3.514 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)Nc1ccc(Oc2cccc(C)c2)cc1 ZINC000065715690 938996816 /nfs/dbraw/zinc/99/68/16/938996816.db2.gz INDPUBQMPSWDFR-UHFFFAOYSA-N 0 0 366.377 3.839 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1cc(C(=O)NC)ccc1C ZINC000179244769 938997754 /nfs/dbraw/zinc/99/77/54/938997754.db2.gz XVMCOTQEXAFQEB-UHFFFAOYSA-N 0 0 373.434 3.627 20 5 FHBDRN O=C(Nc1ccc(F)cc1OCCC(F)(F)F)c1ccc([N+](=O)[O-])cn1 ZINC000548844676 938998021 /nfs/dbraw/zinc/99/80/21/938998021.db2.gz OYFZVMXQDKRRRS-UHFFFAOYSA-N 0 0 373.262 3.712 20 5 FHBDRN Cc1cccc([C@H]2CCCN2C(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)n1 ZINC000166874778 939005910 /nfs/dbraw/zinc/00/59/10/939005910.db2.gz GNOPQEPWWMYEAO-GOSISDBHSA-N 0 0 350.378 3.757 20 5 FHBDRN Cc1cc(F)cc(C(=O)N2CCc3[nH]c4ccc(F)cc4c3C2)c1[N+](=O)[O-] ZINC000176937687 939007515 /nfs/dbraw/zinc/00/75/15/939007515.db2.gz IGUIHHWMKXFMKB-UHFFFAOYSA-N 0 0 371.343 3.861 20 5 FHBDRN Cc1cc(NC(=O)c2cc([N+](=O)[O-])cn2C)cc(C)c1Br ZINC000235873371 939013845 /nfs/dbraw/zinc/01/38/45/939013845.db2.gz JKDXAPHYCIAZKC-UHFFFAOYSA-N 0 0 352.188 3.565 20 5 FHBDRN O=[N+]([O-])c1cccc2c(NCc3cccc(N4CCOCC4)c3)ccnc21 ZINC000432157555 945220756 /nfs/dbraw/zinc/22/07/56/945220756.db2.gz RZRGWBHNNWCZEG-UHFFFAOYSA-N 0 0 364.405 3.592 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)Nc1cccc(OC(F)F)c1 ZINC000065733559 939017845 /nfs/dbraw/zinc/01/78/45/939017845.db2.gz RVJPYBXJNDYPHC-UHFFFAOYSA-N 0 0 361.304 3.790 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1ccccc1-c1ccccc1 ZINC000065736684 939018531 /nfs/dbraw/zinc/01/85/31/939018531.db2.gz YYPDYQJJJQLIEY-UHFFFAOYSA-N 0 0 350.378 3.796 20 5 FHBDRN COC(=O)c1ccc(CN(C)Cc2cc([N+](=O)[O-])ccc2Cl)s1 ZINC000176955685 939020064 /nfs/dbraw/zinc/02/00/64/939020064.db2.gz WBECNYQYCFNZDE-UHFFFAOYSA-N 0 0 354.815 3.728 20 5 FHBDRN Cc1noc(C)c1[C@@H](C)NC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000612044764 939025399 /nfs/dbraw/zinc/02/53/99/939025399.db2.gz WDYOUEBVQVVTMI-MRVPVSSYSA-N 0 0 369.830 3.823 20 5 FHBDRN COCc1nc2cc(NC(=O)c3cccc(SC)c3[N+](=O)[O-])ccc2o1 ZINC000188187367 939030091 /nfs/dbraw/zinc/03/00/91/939030091.db2.gz HPBLTYOSGXEDDQ-UHFFFAOYSA-N 0 0 373.390 3.857 20 5 FHBDRN CC1CCN(c2ccc(C(=O)N(C)CCC(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000065759187 939041891 /nfs/dbraw/zinc/04/18/91/939041891.db2.gz PZJWRIQMPIRTIS-UHFFFAOYSA-N 0 0 373.375 3.856 20 5 FHBDRN COc1ccc2c(c1)CC[C@H](NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1)C2 ZINC000612084792 939047052 /nfs/dbraw/zinc/04/70/52/939047052.db2.gz KBVIZOUVHBLXJI-HNNXBMFYSA-N 0 0 360.797 3.544 20 5 FHBDRN COc1ccc2c(c1)CC[C@@H](NC(=O)c1cc3cc([N+](=O)[O-])ccc3o1)C2 ZINC000612087419 939048203 /nfs/dbraw/zinc/04/82/03/939048203.db2.gz FDWZDLZERVQLJG-OAHLLOKOSA-N 0 0 366.373 3.637 20 5 FHBDRN COc1c(Cl)cccc1NC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000124313996 945223237 /nfs/dbraw/zinc/22/32/37/945223237.db2.gz VTOPPROMPOGFSM-UHFFFAOYSA-N 0 0 361.785 3.847 20 5 FHBDRN CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)c1cc(F)c([O-])c(F)c1 ZINC000177028506 939063835 /nfs/dbraw/zinc/06/38/35/939063835.db2.gz DLTGJQUWQNSRKC-UHFFFAOYSA-N 0 0 356.712 3.504 20 5 FHBDRN 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Cc1sc(C(=O)N2CC=C(c3ccc(Cl)nc3)CC2)cc1[N+](=O)[O-] ZINC000376151326 940381549 /nfs/dbraw/zinc/38/15/49/940381549.db2.gz QLEIKWKONVKXJM-UHFFFAOYSA-N 0 0 363.826 3.943 20 5 FHBDRN Cc1ccc([C@H](C)N(C)C(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)cc1 ZINC000066289272 940393946 /nfs/dbraw/zinc/39/39/46/940393946.db2.gz AZQPRUOZGGZMCM-ZDUSSCGKSA-N 0 0 356.378 3.508 20 5 FHBDRN COc1cccc([C@@H]2C[C@H]2CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])c1 ZINC000414009401 940399070 /nfs/dbraw/zinc/39/90/70/940399070.db2.gz MFXWCRDAMAEUST-JSGCOSHPSA-N 0 0 360.797 3.790 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000133946353 945314748 /nfs/dbraw/zinc/31/47/48/945314748.db2.gz NNRRJIJYRKNKBF-UHFFFAOYSA-N 0 0 356.338 3.700 20 5 FHBDRN Cc1cc(C)c(NC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)cc1O ZINC000613032468 940403309 /nfs/dbraw/zinc/40/33/09/940403309.db2.gz MDBZKMDGDZZYEO-UHFFFAOYSA-N 0 0 366.377 3.570 20 5 FHBDRN CC[C@@H]1c2ccsc2CCN1C(=O)c1cc([N+](=O)[O-])cc2c1OCCO2 ZINC000066306014 940404606 /nfs/dbraw/zinc/40/46/06/940404606.db2.gz USJPDCILBLMCGI-CQSZACIVSA-N 0 0 374.418 3.577 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)Nc2cc(O)c(C)cc2C)cc1SC ZINC000613032415 940408527 /nfs/dbraw/zinc/40/85/27/940408527.db2.gz IZQZTXFNZYQLLX-UHFFFAOYSA-N 0 0 362.407 3.900 20 5 FHBDRN Cc1oc(NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)nc1C1CC1 ZINC000892517886 940422310 /nfs/dbraw/zinc/42/23/10/940422310.db2.gz HGOBJRMULKRLCC-UHFFFAOYSA-N 0 0 366.171 3.783 20 5 FHBDRN CC(=O)c1cc(N[C@@H]2CCN(Cc3ccccn3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000376177162 940422894 /nfs/dbraw/zinc/42/28/94/940422894.db2.gz ZZMPTIRSBROWJR-IFXJQAMLSA-N 0 0 368.437 3.515 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N(C)Cc1ccccc1N1CCCC1 ZINC000511417712 940428231 /nfs/dbraw/zinc/42/82/31/940428231.db2.gz YVTQFODCXQCEDN-UHFFFAOYSA-N 0 0 353.422 3.776 20 5 FHBDRN CC(C)[C@H](c1nc(CCNc2ccccc2[N+](=O)[O-])no1)c1cccnc1 ZINC000580002697 940433203 /nfs/dbraw/zinc/43/32/03/940433203.db2.gz KTSJAGBNWAQRGV-SFHVURJKSA-N 0 0 367.409 3.815 20 5 FHBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])N[C@@H]1C[C@H]1c1ccco1 ZINC000414034199 940433771 /nfs/dbraw/zinc/43/37/71/940433771.db2.gz MGVFCJWBRMMKJR-GHMZBOCLSA-N 0 0 352.799 3.606 20 5 FHBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CCC[C@H]1C1CCC1 ZINC000102869713 940436405 /nfs/dbraw/zinc/43/64/05/940436405.db2.gz YPRNBIQJCANGFC-FZMZJTMJSA-N 0 0 352.818 3.807 20 5 FHBDRN CCCCOc1ccccc1NC(=O)c1cc([N+](=O)[O-])cc2c1OCCO2 ZINC000066332044 940439078 /nfs/dbraw/zinc/43/90/78/940439078.db2.gz SGVHFTSZHBLDFQ-UHFFFAOYSA-N 0 0 372.377 3.797 20 5 FHBDRN O=[N+]([O-])c1cccc(CN(CC(F)(F)F)C2CC2)c1Br ZINC000236129387 940441032 /nfs/dbraw/zinc/44/10/32/940441032.db2.gz FXBGGLXVDGIDQT-UHFFFAOYSA-N 0 0 353.138 3.884 20 5 FHBDRN O=[N+]([O-])c1ccccc1N1CCN(Cc2cnc(C3CCC3)s2)CC1 ZINC000160434925 940447306 /nfs/dbraw/zinc/44/73/06/940447306.db2.gz VQSDULKCQOBYFY-UHFFFAOYSA-N 0 0 358.467 3.641 20 5 FHBDRN COC(=O)c1ccc(OCC(=O)Nc2ccc(C(C)C)cc2)cc1[N+](=O)[O-] ZINC000613109994 940452324 /nfs/dbraw/zinc/45/23/24/940452324.db2.gz RQFXPYUAFODLRF-UHFFFAOYSA-N 0 0 372.377 3.522 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])cc1[N+](=O)[O-] ZINC000177833945 940459078 /nfs/dbraw/zinc/45/90/78/940459078.db2.gz UTIKEIFODFWSHH-SNVBAGLBSA-N 0 0 363.757 3.956 20 5 FHBDRN Cc1[nH]nc(C(=O)N(CC2CC2)c2cccc(C(F)(F)F)c2)c1[N+](=O)[O-] ZINC000427392981 945322716 /nfs/dbraw/zinc/32/27/16/945322716.db2.gz YYKVICBCZJBXEA-UHFFFAOYSA-N 0 0 368.315 3.702 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1[C@H](C)Sc1nnc(-c2ccccn2)n1C ZINC000180093554 940469955 /nfs/dbraw/zinc/46/99/55/940469955.db2.gz JNXTXQUITIUZDN-LBPRGKRZSA-N 0 0 355.423 3.947 20 5 FHBDRN Cc1ccccc1CN(C)C(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000580267123 940471284 /nfs/dbraw/zinc/47/12/84/940471284.db2.gz NYVCPOPORIKZSP-UHFFFAOYSA-N 0 0 366.421 3.769 20 5 FHBDRN CS[C@@H]1CCC[C@H](Nc2cc(CN3CCOCC3)ccc2[N+](=O)[O-])C1 ZINC000580280211 940471729 /nfs/dbraw/zinc/47/17/29/940471729.db2.gz BYIBRBYSXJAXAZ-JKSUJKDBSA-N 0 0 365.499 3.513 20 5 FHBDRN C[C@@H]1C[C@@H](c2ccsc2)CN1c1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1 ZINC000376212652 940474653 /nfs/dbraw/zinc/47/46/53/940474653.db2.gz OLKYUVAWJCBFNA-ZYHUDNBSSA-N 0 0 356.407 3.688 20 5 FHBDRN Cc1c(NC(=O)[C@H](C)C(C)(F)F)cc(Br)cc1[N+](=O)[O-] ZINC000511440610 940474825 /nfs/dbraw/zinc/47/48/25/940474825.db2.gz AASKVBJWPZVCBE-ZETCQYMHSA-N 0 0 351.147 3.896 20 5 FHBDRN Cc1c(Cc2noc(-c3cncc(C(F)(F)F)c3)n2)cccc1[N+](=O)[O-] ZINC000580376930 940475390 /nfs/dbraw/zinc/47/53/90/940475390.db2.gz FXJHUIFLKTVWTN-UHFFFAOYSA-N 0 0 364.283 3.958 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)N2CCOc3ccc([N+](=O)[O-])cc3C2)cc1 ZINC000580493787 940476860 /nfs/dbraw/zinc/47/68/60/940476860.db2.gz RDPJZCLNSFBIBN-AWEZNQCLSA-N 0 0 355.394 3.568 20 5 FHBDRN O=[N+]([O-])c1ccc2ncnc(N[C@@H]3CCO[C@H](c4ccccc4)C3)c2c1 ZINC000613188209 940480637 /nfs/dbraw/zinc/48/06/37/940480637.db2.gz UWMBRQQFYKBDMC-KDOFPFPSSA-N 0 0 350.378 3.870 20 5 FHBDRN COc1c(F)cc(F)cc1NC(=O)c1cc(SC)ccc1[N+](=O)[O-] ZINC000472521342 940482434 /nfs/dbraw/zinc/48/24/34/940482434.db2.gz RVMHPSCHZQUFTK-UHFFFAOYSA-N 0 0 354.334 3.856 20 5 FHBDRN CC[C@@H](NC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F)c1ccc(OC)cc1 ZINC000580736047 940483378 /nfs/dbraw/zinc/48/33/78/940483378.db2.gz IILWCLQKULDOQK-QGZVFWFLSA-N 0 0 364.348 3.692 20 5 FHBDRN Cc1cc(C(=O)Nc2ccc3[nH]c([C@H]4CCCO4)nc3c2)ccc1[N+](=O)[O-] ZINC000066445383 940489264 /nfs/dbraw/zinc/48/92/64/940489264.db2.gz BNIQWLQNVGPTIE-QGZVFWFLSA-N 0 0 366.377 3.883 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CCc3cccc(F)c3[C@H]2C)c1 ZINC000549009949 940491388 /nfs/dbraw/zinc/49/13/88/940491388.db2.gz OBYASKZXLNHNNE-GFCCVEGCSA-N 0 0 358.369 3.892 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc3nc(OC)ccc3c2)c1 ZINC000549009871 940491719 /nfs/dbraw/zinc/49/17/19/940491719.db2.gz JKOMWWZMVXQJSP-UHFFFAOYSA-N 0 0 367.361 3.803 20 5 FHBDRN COc1cnc2ccccc2c1C(=O)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000549009124 940492715 /nfs/dbraw/zinc/49/27/15/940492715.db2.gz KONKXAUYXLUDNA-UHFFFAOYSA-N 0 0 363.373 3.745 20 5 FHBDRN O=[N+]([O-])c1ccc(NCCNc2nc(C(F)F)nc3ccccc32)cc1 ZINC000066451455 940494318 /nfs/dbraw/zinc/49/43/18/940494318.db2.gz NPYMKCLVZOXTHN-UHFFFAOYSA-N 0 0 359.336 4.000 20 5 FHBDRN Cn1c(Sc2nc3c(cc2[N+](=O)[O-])CCCC3)nnc1-c1cccs1 ZINC000581187609 940495165 /nfs/dbraw/zinc/49/51/65/940495165.db2.gz DCIMSIONBXRFPY-UHFFFAOYSA-N 0 0 373.463 3.877 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CC[C@@H](c2ccccc2)[C@H](C)C1 ZINC000581343104 940499825 /nfs/dbraw/zinc/49/98/25/940499825.db2.gz YWZIZDPBHDKXGM-SJLPKXTDSA-N 0 0 367.449 3.967 20 5 FHBDRN C[C@H](C(=O)NC[C@@H]1CCO[C@H]1c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000581404057 940501384 /nfs/dbraw/zinc/50/13/84/940501384.db2.gz HYCJQGBWEDRQEJ-FNHZYXHNSA-N 0 0 354.406 3.592 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)Nc1ccc(Cl)cc1OC(F)F ZINC000186013322 940501623 /nfs/dbraw/zinc/50/16/23/940501623.db2.gz DVFBPHJAUVDIMP-UHFFFAOYSA-N 0 0 372.711 3.867 20 5 FHBDRN COc1ccc(NC(=O)Cc2ccc(C(F)(F)F)cc2)c([N+](=O)[O-])c1 ZINC000613289712 940504637 /nfs/dbraw/zinc/50/46/37/940504637.db2.gz HTQLAIHVRYKLPC-UHFFFAOYSA-N 0 0 354.284 3.803 20 5 FHBDRN COc1cccc([C@H]2C[C@H](NC(=O)[C@H](C)c3cccc([N+](=O)[O-])c3)C2)c1 ZINC000581532560 940505988 /nfs/dbraw/zinc/50/59/88/940505988.db2.gz MQTNPYPXMLQDML-KBRIMQKVSA-N 0 0 354.406 3.769 20 5 FHBDRN CSc1cccc(-c2nc(-c3ccc(NC(C)=O)cc3)no2)c1[N+](=O)[O-] ZINC000581573361 940506880 /nfs/dbraw/zinc/50/68/80/940506880.db2.gz RQVBJASSQSEKDK-UHFFFAOYSA-N 0 0 370.390 3.992 20 5 FHBDRN C[C@@H]1CC(CCNc2ncc([N+](=O)[O-])cc2Br)C[C@@H](C)O1 ZINC000581501274 940507406 /nfs/dbraw/zinc/50/74/06/940507406.db2.gz PHEYGMGRFKJMGV-NXEZZACHSA-N 0 0 358.236 3.758 20 5 FHBDRN COc1ccc(NC(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)c(C)c1 ZINC000581512860 940507805 /nfs/dbraw/zinc/50/78/05/940507805.db2.gz SAZUHFIKFNANJX-UHFFFAOYSA-N 0 0 368.393 3.757 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1C[C@H](c2ccccc2C)OC[C@H]1C ZINC000427386118 945332584 /nfs/dbraw/zinc/33/25/84/945332584.db2.gz CVASWLQQPYVDGB-AUUYWEPGSA-N 0 0 370.405 3.514 20 5 FHBDRN Cc1c(C(=O)N2C[C@H](c3ccccc3)OCC2(C)C)cccc1[N+](=O)[O-] ZINC000066512846 940592987 /nfs/dbraw/zinc/59/29/87/940592987.db2.gz KKCFBDMQSIOFNE-GOSISDBHSA-N 0 0 354.406 3.896 20 5 FHBDRN Cc1cccc(C)c1OC[C@@H](C)NC(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000511480464 940596596 /nfs/dbraw/zinc/59/65/96/940596596.db2.gz JWUQJVNHWMQCQO-MRXNPFEDSA-N 0 0 372.421 3.564 20 5 FHBDRN COc1cc(C)c(NCc2nc(-c3cccc([N+](=O)[O-])c3)no2)cc1OC ZINC000102886448 940619491 /nfs/dbraw/zinc/61/94/91/940619491.db2.gz MUXGXSNRRNYOBF-UHFFFAOYSA-N 0 0 370.365 3.583 20 5 FHBDRN Cc1c(C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)cnn1C(C)C ZINC000581949952 940634126 /nfs/dbraw/zinc/63/41/26/940634126.db2.gz CSBUKKCWPWQITA-UHFFFAOYSA-N 0 0 367.203 3.695 20 5 FHBDRN NC(=O)c1ccc(NCCCc2cccc(C(F)(F)F)c2)c([N+](=O)[O-])c1 ZINC000506798867 945336531 /nfs/dbraw/zinc/33/65/31/945336531.db2.gz WWKKDEURKXYLAI-UHFFFAOYSA-N 0 0 367.327 3.757 20 5 FHBDRN O=C([O-])c1ccc([N+](=O)[O-])c(NC[C@@H](c2ccccc2)[NH+]2CCCC2)c1 ZINC000582065579 940644920 /nfs/dbraw/zinc/64/49/20/940644920.db2.gz WYUSIOQUHXNIBQ-SFHVURJKSA-N 0 0 355.394 3.542 20 5 FHBDRN C[C@@H]1CN(C(=O)CSc2ccc([N+](=O)[O-])cc2)[C@@H](c2ccccc2)CO1 ZINC000173671291 940659652 /nfs/dbraw/zinc/65/96/52/940659652.db2.gz XDWLLXFTGVKFMD-RDTXWAMCSA-N 0 0 372.446 3.676 20 5 FHBDRN C[C@@H]1CN(C(=O)CSc2ccc([N+](=O)[O-])cc2)[C@H](c2ccccc2)CO1 ZINC000173671267 940659848 /nfs/dbraw/zinc/65/98/48/940659848.db2.gz XDWLLXFTGVKFMD-KDOFPFPSSA-N 0 0 372.446 3.676 20 5 FHBDRN C[C@@H]1CN(C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)[C@H](c2ccccc2)CO1 ZINC000173718801 940663185 /nfs/dbraw/zinc/66/31/85/940663185.db2.gz KBEMCFHIFRXQDJ-ACJLOTCBSA-N 0 0 374.824 3.779 20 5 FHBDRN C[C@H]1CN(C(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)[C@H](c2ccccc2)CO1 ZINC000173724471 940664456 /nfs/dbraw/zinc/66/44/56/940664456.db2.gz PENGFPNWZLQRHP-DJJJIMSYSA-N 0 0 365.389 3.678 20 5 FHBDRN C[C@@H](NC(=O)NCCOc1ccc([N+](=O)[O-])cc1)c1cccc(Cl)c1 ZINC000582461989 940667362 /nfs/dbraw/zinc/66/73/62/940667362.db2.gz LPVSBGNUBQTPJP-GFCCVEGCSA-N 0 0 363.801 3.687 20 5 FHBDRN COc1ccc(OCCSCc2nc(C(C)(C)C)no2)c([N+](=O)[O-])c1 ZINC000173783351 940668348 /nfs/dbraw/zinc/66/83/48/940668348.db2.gz MMBBNFCFQBSOAC-UHFFFAOYSA-N 0 0 367.427 3.596 20 5 FHBDRN CC(C)[C@H](c1noc(Cn2ccc([N+](=O)[O-])n2)n1)c1ccc(Cl)cc1 ZINC000582453127 940672294 /nfs/dbraw/zinc/67/22/94/940672294.db2.gz UMKFSNQAZDOTFG-HNNXBMFYSA-N 0 0 361.789 3.664 20 5 FHBDRN C[C@H](NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)c1cc2n(n1)CCC2 ZINC000414145006 940674242 /nfs/dbraw/zinc/67/42/42/940674242.db2.gz MEAKVZWRYFMGPC-JTQLQIEISA-N 0 0 354.332 3.607 20 5 FHBDRN COc1ccccc1C1(NC(=O)/C(C)=C\c2ccc([N+](=O)[O-])cc2)CC1 ZINC000843670329 945339234 /nfs/dbraw/zinc/33/92/34/945339234.db2.gz OVDGOGLXGBKYTP-YPKPFQOOSA-N 0 0 352.390 3.812 20 5 FHBDRN O=C(Nc1cnc2ccccc2c1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000180151612 940699697 /nfs/dbraw/zinc/69/96/97/940699697.db2.gz KLKQBQISLPFVEU-UHFFFAOYSA-N 0 0 359.288 3.997 20 5 FHBDRN Cc1cc(O)ccc1NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000174129350 940704362 /nfs/dbraw/zinc/70/43/62/940704362.db2.gz PPXRPDOQMKMDSJ-UHFFFAOYSA-N 0 0 355.375 3.985 20 5 FHBDRN C[C@@H]1C[C@@H](CCNC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C[C@H](C)O1 ZINC000549020660 940709420 /nfs/dbraw/zinc/70/94/20/940709420.db2.gz KAKDKDUPCPPMRT-ZSBIGDGJSA-N 0 0 374.359 3.937 20 5 FHBDRN O=C(c1ccc(N2CCCC2)c(F)c1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000106604316 945342647 /nfs/dbraw/zinc/34/26/47/945342647.db2.gz OEWFSXDERLVRPI-UHFFFAOYSA-N 0 0 355.369 3.537 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(NC[C@H]2CCC[C@H](C(F)(F)F)C2)n1 ZINC000582562193 940724430 /nfs/dbraw/zinc/72/44/30/940724430.db2.gz LQSURUWOEMNLBT-UWVGGRQHSA-N 0 0 361.320 3.557 20 5 FHBDRN CN(Cc1nc2ccccc2s1)C(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000047610435 945345266 /nfs/dbraw/zinc/34/52/66/945345266.db2.gz HIYYNRZIYMVCRJ-UHFFFAOYSA-N 0 0 371.418 3.632 20 5 FHBDRN CC(=O)c1ccc(NCCOc2cccc(C(F)(F)F)n2)c([N+](=O)[O-])c1 ZINC000540906012 940747342 /nfs/dbraw/zinc/74/73/42/940747342.db2.gz SJGQFKJWXPTFON-UHFFFAOYSA-N 0 0 369.299 3.702 20 5 FHBDRN CC(C)COC[C@H](Nc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2)c1ccco1 ZINC000170640285 940755552 /nfs/dbraw/zinc/75/55/52/940755552.db2.gz PDXMQNDYOLLCBG-INIZCTEOSA-N 0 0 373.409 3.898 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](C)c2nc(-c3cccc(F)c3)no2)c1 ZINC000174735912 940765891 /nfs/dbraw/zinc/76/58/91/940765891.db2.gz NTIBXBAXEQAONN-NSHDSACASA-N 0 0 370.340 3.583 20 5 FHBDRN CC(C)CCSc1ccc(C(=O)N[C@H]2CCCOC2)cc1[N+](=O)[O-] ZINC000111129485 945346868 /nfs/dbraw/zinc/34/68/68/945346868.db2.gz PLXQLLKVTFPTRD-AWEZNQCLSA-N 0 0 352.456 3.642 20 5 FHBDRN CSc1ccccc1N(C)S(=O)(=O)c1cc([N+](=O)[O-])cc(C)c1C ZINC000174972627 940792881 /nfs/dbraw/zinc/79/28/81/940792881.db2.gz RCBMJUKVEQFXGH-UHFFFAOYSA-N 0 0 366.464 3.759 20 5 FHBDRN CN(CC(=O)N[C@H](c1ccco1)c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000175033889 940803425 /nfs/dbraw/zinc/80/34/25/940803425.db2.gz YHZACYCDWWEVFG-FQEVSTJZSA-N 0 0 365.389 3.530 20 5 FHBDRN COc1ccc(NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])c(OC)c1 ZINC000175040000 940804228 /nfs/dbraw/zinc/80/42/28/940804228.db2.gz UPORYFOCLZKZMV-UHFFFAOYSA-N 0 0 370.283 3.883 20 5 FHBDRN Cc1cc(N2CCc3c(ncn3-c3ccc(F)cc3)C2)ccc1[N+](=O)[O-] ZINC000511863587 945350966 /nfs/dbraw/zinc/35/09/66/945350966.db2.gz KLMFWQISCLPXRL-UHFFFAOYSA-N 0 0 352.369 3.791 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])N(Cc1ccco1)Cc1ccc(O)cc1 ZINC000170797158 940823732 /nfs/dbraw/zinc/82/37/32/940823732.db2.gz UBBOYLZASKVXRN-UHFFFAOYSA-N 0 0 366.373 3.665 20 5 FHBDRN O=C(c1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCSc2ncccc21 ZINC000175238659 940834429 /nfs/dbraw/zinc/83/44/29/940834429.db2.gz KZYNSIUOMJYKRZ-UHFFFAOYSA-N 0 0 369.324 3.761 20 5 FHBDRN Cc1ccc(NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)cc1C(=O)N(C)C ZINC000175374164 940856831 /nfs/dbraw/zinc/85/68/31/940856831.db2.gz ZQDZPOFWUZSPLV-UHFFFAOYSA-N 0 0 361.785 3.511 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1)[C@H](NCc1nccc(C(F)(F)F)n1)CCC2 ZINC000414266675 940864664 /nfs/dbraw/zinc/86/46/64/940864664.db2.gz VZNIKKISKPUUOS-CYBMUJFWSA-N 0 0 352.316 3.571 20 5 FHBDRN O=C(NCCCc1ccccc1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000175504067 940873444 /nfs/dbraw/zinc/87/34/44/940873444.db2.gz IJRIMZUAWPUKCJ-UHFFFAOYSA-N 0 0 363.211 3.720 20 5 FHBDRN O=C(C[C@@H](O)c1ccc(Cl)cc1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000180251068 940882707 /nfs/dbraw/zinc/88/27/07/940882707.db2.gz HZTBYEXRHXNGRT-GOSISDBHSA-N 0 0 374.824 3.863 20 5 FHBDRN COc1ccc(-c2nc(C(=O)Nc3ccc([N+](=O)[O-])c(C)n3)cs2)cc1 ZINC000175666306 940910683 /nfs/dbraw/zinc/91/06/83/940910683.db2.gz XLEAVMNPTPUVDX-UHFFFAOYSA-N 0 0 370.390 3.683 20 5 FHBDRN Cc1csc([C@H](C)NC(=O)c2ccc(Br)cc2[N+](=O)[O-])n1 ZINC000175757257 940921272 /nfs/dbraw/zinc/92/12/72/940921272.db2.gz XNOOTJMIEXZDCL-QMMMGPOBSA-N 0 0 370.228 3.613 20 5 FHBDRN COc1c(O)ccc(C[NH2+][C@@H](C)c2ccc(OC(C)C)cc2)c1[N+](=O)[O-] ZINC000892603678 940922009 /nfs/dbraw/zinc/92/20/09/940922009.db2.gz PWKCUVIRMSSXNT-ZDUSSCGKSA-N 0 0 360.410 3.947 20 5 FHBDRN COCCOc1cc(C)ccc1NC(=O)c1cccc(Cl)c1[N+](=O)[O-] ZINC000175760923 940922337 /nfs/dbraw/zinc/92/23/37/940922337.db2.gz DCPVEHJFFCAUBD-UHFFFAOYSA-N 0 0 364.785 3.834 20 5 FHBDRN O=C(c1ncccc1C(F)(F)F)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000180291396 940926379 /nfs/dbraw/zinc/92/63/79/940926379.db2.gz NIGYGJVOMCFDCR-UHFFFAOYSA-N 0 0 365.311 3.813 20 5 FHBDRN CC(C)n1c2ccccc2nc1[C@H]1CCCN(c2c([N+](=O)[O-])cnn2C)C1 ZINC000892606021 940927120 /nfs/dbraw/zinc/92/71/20/940927120.db2.gz VXSZESDIPVTTGG-AWEZNQCLSA-N 0 0 368.441 3.643 20 5 FHBDRN Cc1c(NC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)cnn1-c1ccccc1F ZINC000255905193 940958484 /nfs/dbraw/zinc/95/84/84/940958484.db2.gz XHXOFGZHWVGZIG-FLIBITNWSA-N 0 0 366.352 3.880 20 5 FHBDRN CCC[C@H](Nc1cccc(O[C@H]2CC(=O)N2)c1)c1cccc([N+](=O)[O-])c1 ZINC000414325363 940975329 /nfs/dbraw/zinc/97/53/29/940975329.db2.gz WZZVNNNYAUCGIU-HKUYNNGSSA-N 0 0 355.394 3.773 20 5 FHBDRN CCOCc1nc(C)cc(Oc2ccc([N+](=O)[O-])cc2Br)n1 ZINC000892616801 940980799 /nfs/dbraw/zinc/98/07/99/940980799.db2.gz RCLGZAOHUUUDQR-UHFFFAOYSA-N 0 0 368.187 3.785 20 5 FHBDRN O=C(c1ccc(Cl)cc1[N+](=O)[O-])N(CCc1ccccc1)[C@@H]1CCOC1 ZINC000176156976 940994398 /nfs/dbraw/zinc/99/43/98/940994398.db2.gz JNBZRVKDGREMSS-MRXNPFEDSA-N 0 0 374.824 3.722 20 5 FHBDRN O=C(N[C@H](c1nccs1)C(F)(F)F)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000507604091 945366790 /nfs/dbraw/zinc/36/67/90/945366790.db2.gz UCMPUFXCLGGLOO-SECBINFHSA-N 0 0 365.720 3.738 20 5 FHBDRN CC(C)(C)c1cc(NC(=O)c2ccc(N)c([N+](=O)[O-])c2)n(C(C)(C)C)n1 ZINC000066672057 941011449 /nfs/dbraw/zinc/01/14/49/941011449.db2.gz ISVJNIYUAWBJPT-UHFFFAOYSA-N 0 0 359.430 3.678 20 5 FHBDRN C[C@@H]([NH2+]CC(=O)Nc1cccc(C(F)(F)F)c1)c1cccc([N+](=O)[O-])c1 ZINC000180453447 941021923 /nfs/dbraw/zinc/02/19/23/941021923.db2.gz NPHATSJWQZVTFV-LLVKDONJSA-N 0 0 367.327 3.903 20 5 FHBDRN CCN(Cc1occc1C)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000412025862 941023866 /nfs/dbraw/zinc/02/38/66/941023866.db2.gz KBCQXRCNYQEOGZ-LBPRGKRZSA-N 0 0 365.817 3.999 20 5 FHBDRN CCc1cc(=O)c2cc(NC(=O)c3c(Cl)cccc3[N+](=O)[O-])ccc2[nH]1 ZINC000180476663 941026219 /nfs/dbraw/zinc/02/62/19/941026219.db2.gz PGXFUBDABUQSGM-UHFFFAOYSA-N 0 0 371.780 3.904 20 5 FHBDRN C[C@H](C(=O)Nc1ccc(OCc2ccccc2)cc1)n1cc([N+](=O)[O-])cn1 ZINC000180502261 941032448 /nfs/dbraw/zinc/03/24/48/941032448.db2.gz YRENTEVVIJLKEP-CQSZACIVSA-N 0 0 366.377 3.570 20 5 FHBDRN Cc1nc(CSCc2cc([N+](=O)[O-])cc3c2OCOC3)sc1C ZINC000176414589 941036862 /nfs/dbraw/zinc/03/68/62/941036862.db2.gz NWGNCBRUJFUDDW-UHFFFAOYSA-N 0 0 352.437 3.968 20 5 FHBDRN COc1cc(F)cc(CNC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)c1 ZINC000180556123 941047198 /nfs/dbraw/zinc/04/71/98/941047198.db2.gz ZWGYMJQARHBRSZ-UHFFFAOYSA-N 0 0 373.384 3.617 20 5 FHBDRN CC(=O)c1cc(N2CCC(O)(Cc3ccccc3F)CC2)ccc1[N+](=O)[O-] ZINC000376459817 941049064 /nfs/dbraw/zinc/04/90/64/941049064.db2.gz GOVJWAKXEGZPCE-UHFFFAOYSA-N 0 0 372.396 3.511 20 5 FHBDRN C[C@@H](CC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1)C(=O)c1cccc(F)c1 ZINC000176505332 941053513 /nfs/dbraw/zinc/05/35/13/941053513.db2.gz AICUSWMADNJLRI-ZDUSSCGKSA-N 0 0 372.396 3.994 20 5 FHBDRN C[C@H](NC(=O)c1c(N)cccc1[N+](=O)[O-])c1ccc(C(F)(F)F)cc1 ZINC000180639113 941057408 /nfs/dbraw/zinc/05/74/08/941057408.db2.gz URRJSLJYIJYJPI-VIFPVBQESA-N 0 0 353.300 3.687 20 5 FHBDRN Cc1nc(Br)ccc1NC(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000180679528 941063722 /nfs/dbraw/zinc/06/37/22/941063722.db2.gz NKFQVXVSGIEKEA-UHFFFAOYSA-N 0 0 364.199 3.632 20 5 FHBDRN Nc1cccc([N+](=O)[O-])c1C(=O)NCc1ccccc1Oc1ccccc1 ZINC000180719317 941068456 /nfs/dbraw/zinc/06/84/56/941068456.db2.gz LSSZVLDGRLWOML-UHFFFAOYSA-N 0 0 363.373 3.899 20 5 FHBDRN CCC(CC)[C@H]1C[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2Cl)CCO1 ZINC000180842209 941084595 /nfs/dbraw/zinc/08/45/95/941084595.db2.gz XAUPYGVQJWZKNC-BLLLJJGKSA-N 0 0 354.834 3.962 20 5 FHBDRN CCC(CC)[C@H]1C[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2Cl)CCO1 ZINC000180842178 941084650 /nfs/dbraw/zinc/08/46/50/941084650.db2.gz XAUPYGVQJWZKNC-MLGOLLRUSA-N 0 0 354.834 3.962 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CCC[C@@H](C)CC2)cc1OC ZINC000188791541 941086633 /nfs/dbraw/zinc/08/66/33/941086633.db2.gz YFOWRWDVIMTIDJ-CHWSQXEVSA-N 0 0 350.415 3.701 20 5 FHBDRN O=[N+]([O-])c1ccc2oc(CSc3nccn3Cc3ccccn3)nc2c1 ZINC000176940939 941086784 /nfs/dbraw/zinc/08/67/84/941086784.db2.gz VCTGLAYEHDJTRD-UHFFFAOYSA-N 0 0 367.390 3.668 20 5 FHBDRN Nc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc2c(c1)nc1n2CCCCC1 ZINC000180900675 941090660 /nfs/dbraw/zinc/09/06/60/941090660.db2.gz MWEUMIDDFSZIHF-UHFFFAOYSA-N 0 0 365.393 3.505 20 5 FHBDRN C[C@@H](NC(=O)c1ccc(F)cc1[N+](=O)[O-])c1ccc(Br)cc1 ZINC000177045047 941095622 /nfs/dbraw/zinc/09/56/22/941095622.db2.gz FCAQAPZSCMBVHO-SECBINFHSA-N 0 0 367.174 3.987 20 5 FHBDRN C[C@H](CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1)CC(F)F ZINC000843633496 941096377 /nfs/dbraw/zinc/09/63/77/941096377.db2.gz WPSVHOKPNBPWTN-LBPRGKRZSA-N 0 0 355.385 3.606 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H](c1ccccc1)[C@@H]1CCCO1 ZINC000188834143 941106699 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FHBDRN CCN(Cc1c[nH]c2ccccc12)C(=O)Cc1cccc([N+](=O)[O-])c1C ZINC000188886872 941127406 /nfs/dbraw/zinc/12/74/06/941127406.db2.gz HTUSPBLSPWWQOU-UHFFFAOYSA-N 0 0 351.406 3.976 20 5 FHBDRN COc1cc(C(=O)N(CC2CCC2)CC(F)(F)F)cc([N+](=O)[O-])c1C ZINC000188968896 941135553 /nfs/dbraw/zinc/13/55/53/941135553.db2.gz XTQTXNUYBHVCNH-UHFFFAOYSA-N 0 0 360.332 3.716 20 5 FHBDRN COCCN(CCc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])c(C)c1 ZINC000545329760 941136773 /nfs/dbraw/zinc/13/67/73/941136773.db2.gz GQIUVAJHQRDMHW-UHFFFAOYSA-N 0 0 357.410 3.626 20 5 FHBDRN CSc1cccc(C(=O)N[C@H](C)CC(=O)c2cccs2)c1[N+](=O)[O-] ZINC000189016296 941141546 /nfs/dbraw/zinc/14/15/46/941141546.db2.gz KDVOSRJLTSMJAA-SNVBAGLBSA-N 0 0 364.448 3.770 20 5 FHBDRN O=C(c1ccc(Cl)cc1[N+](=O)[O-])N1CCO[C@H](c2cccc(F)c2)C1 ZINC000066694996 941143272 /nfs/dbraw/zinc/14/32/72/941143272.db2.gz SCWRZPQYKPHKND-INIZCTEOSA-N 0 0 364.760 3.601 20 5 FHBDRN CCOc1ccccc1CN(C)C(=O)c1cc(OC)c(C)c([N+](=O)[O-])c1 ZINC000189040314 941144089 /nfs/dbraw/zinc/14/40/89/941144089.db2.gz MYAQZXSYTMHFKQ-UHFFFAOYSA-N 0 0 358.394 3.583 20 5 FHBDRN Cc1nc(CC(C)C)oc1C(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000189042027 941144116 /nfs/dbraw/zinc/14/41/16/941144116.db2.gz MKSNMZDJLMCCNS-UHFFFAOYSA-N 0 0 357.410 3.895 20 5 FHBDRN COc1cc(C(=O)N2CC[C@H](c3ccccc3)[C@@H]2C)cc([N+](=O)[O-])c1C ZINC000189102865 941145385 /nfs/dbraw/zinc/14/53/85/941145385.db2.gz PLXGWLJIKWLSHX-YOEHRIQHSA-N 0 0 354.406 3.930 20 5 FHBDRN COc1ccc(CC(C)(C)NC(=O)CSc2ccc([N+](=O)[O-])cc2)cc1 ZINC000189159096 941148101 /nfs/dbraw/zinc/14/81/01/941148101.db2.gz WUKOPHMTSAGVMP-UHFFFAOYSA-N 0 0 374.462 3.833 20 5 FHBDRN Cc1c(Br)cccc1CC(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000189104287 941148351 /nfs/dbraw/zinc/14/83/51/941148351.db2.gz FHEWRBGYSZRRGN-UHFFFAOYSA-N 0 0 363.211 3.525 20 5 FHBDRN O=C(c1cc(Cl)ccc1[N+](=O)[O-])N1CCO[C@@H](c2ccccc2F)C1 ZINC000066691054 941149851 /nfs/dbraw/zinc/14/98/51/941149851.db2.gz ZNGVNCQKYDHDBM-MRXNPFEDSA-N 0 0 364.760 3.601 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])c2ncccc12)c1cccnc1C(F)(F)F ZINC000189202110 941153958 /nfs/dbraw/zinc/15/39/58/941153958.db2.gz XNZOMEGLXBIEJB-UHFFFAOYSA-N 0 0 362.267 3.809 20 5 FHBDRN O=[N+]([O-])c1cccc(NS(=O)(=O)c2ccc(CC(F)(F)F)cc2)c1 ZINC000189224248 941154915 /nfs/dbraw/zinc/15/49/15/941154915.db2.gz UIFIMIPNVMDASG-UHFFFAOYSA-N 0 0 360.313 3.500 20 5 FHBDRN CSc1ccccc1N(C)S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-] ZINC000189305647 941155794 /nfs/dbraw/zinc/15/57/94/941155794.db2.gz WVUVWKDNFAESHF-UHFFFAOYSA-N 0 0 366.464 3.759 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)NCc1ccc(Cl)cc1F ZINC000189278606 941156716 /nfs/dbraw/zinc/15/67/16/941156716.db2.gz HBQJVECRQNRCKL-UHFFFAOYSA-N 0 0 361.760 3.728 20 5 FHBDRN CCSc1cc(CNc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])ccn1 ZINC000189347811 941157574 /nfs/dbraw/zinc/15/75/74/941157574.db2.gz CDCMZIFFNOLNEU-UHFFFAOYSA-N 0 0 372.450 3.606 20 5 FHBDRN CC[C@@](C)(O)CN(Cc1ccccc1)C(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000189491184 941159083 /nfs/dbraw/zinc/15/90/83/941159083.db2.gz MPJXWPVHKMADNM-HXUWFJFHSA-N 0 0 356.422 3.707 20 5 FHBDRN COC[C@H](Cc1ccccc1)N(C)C(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000189499796 941159387 /nfs/dbraw/zinc/15/93/87/941159387.db2.gz LTBLTUGOZOZLCV-PBHICJAKSA-N 0 0 374.412 3.554 20 5 FHBDRN CCC[C@@H](NC(=O)C(=O)Nc1cc(F)cc([N+](=O)[O-])c1)C1CCCCC1 ZINC000472624300 941161384 /nfs/dbraw/zinc/16/13/84/941161384.db2.gz POPKXMNQVJCPRG-MRXNPFEDSA-N 0 0 365.405 3.538 20 5 FHBDRN CC(C)CCOC1CCN(C(=O)CSc2ccccc2[N+](=O)[O-])CC1 ZINC000544098410 941166568 /nfs/dbraw/zinc/16/65/68/941166568.db2.gz IPGOVLXBNNDIGK-UHFFFAOYSA-N 0 0 366.483 3.741 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)NCc1nccn1-c1ccccc1 ZINC000549101614 941214861 /nfs/dbraw/zinc/21/48/61/941214861.db2.gz GGBGPDQZQHAMDT-UHFFFAOYSA-N 0 0 370.796 3.672 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCCCC[C@@H]1c1ncon1 ZINC000189635496 941235859 /nfs/dbraw/zinc/23/58/59/941235859.db2.gz YGQKQNSDIYNVHC-NVXWUHKLSA-N 0 0 372.425 3.690 20 5 FHBDRN C[C@@H](NCc1c(F)cccc1[N+](=O)[O-])c1cccc(N2CCCC2=O)c1 ZINC000181432558 941237719 /nfs/dbraw/zinc/23/77/19/941237719.db2.gz BNHHIKKASFQPIO-CYBMUJFWSA-N 0 0 357.385 3.712 20 5 FHBDRN CCOC(C)(C)c1nc(Cc2ccc([N+](=O)[O-])cc2Br)no1 ZINC000601367296 941257774 /nfs/dbraw/zinc/25/77/74/941257774.db2.gz PGISXASDKUIPDO-UHFFFAOYSA-N 0 0 370.203 3.603 20 5 FHBDRN Cc1ccc(C)c(S(=O)(=O)N[C@@H](C)c2cccc(F)c2F)c1[N+](=O)[O-] ZINC000480700405 941305253 /nfs/dbraw/zinc/30/52/53/941305253.db2.gz RXHODKKZMMDTGI-NSHDSACASA-N 0 0 370.377 3.529 20 5 FHBDRN COC[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1)C1CC1 ZINC000178828930 941310903 /nfs/dbraw/zinc/31/09/03/941310903.db2.gz PFRUHNICDJZLSU-KRWDZBQOSA-N 0 0 372.446 3.901 20 5 FHBDRN Cc1cc(-c2nc(C(=O)N3CCCc4ccc([N+](=O)[O-])cc43)co2)ccn1 ZINC001125847999 941330211 /nfs/dbraw/zinc/33/02/11/941330211.db2.gz FMMSQOUIWFNXSK-UHFFFAOYSA-N 0 0 364.361 3.546 20 5 FHBDRN Cc1ccccc1CCNC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000179037811 941332541 /nfs/dbraw/zinc/33/25/41/941332541.db2.gz RQRHNMQYXAIQIC-UHFFFAOYSA-N 0 0 353.422 3.820 20 5 FHBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2CCCC[C@H]2C1 ZINC000408001759 941332826 /nfs/dbraw/zinc/33/28/26/941332826.db2.gz ACPLGUYRBAOTJM-RYUDHWBXSA-N 0 0 367.243 3.928 20 5 FHBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CCS[C@H](C)[C@H]1C ZINC000408004553 941338172 /nfs/dbraw/zinc/33/81/72/941338172.db2.gz YEWHIIMXGIMKHH-NXEZZACHSA-N 0 0 373.272 3.632 20 5 FHBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CCSC(C)(C)C1 ZINC000408005943 941342288 /nfs/dbraw/zinc/34/22/88/941342288.db2.gz UEGSSOFWILCMNR-UHFFFAOYSA-N 0 0 373.272 3.633 20 5 FHBDRN COc1cc(F)c([N+](=O)[O-])c(N2CCC(CCCn3ccnc3)CC2)c1 ZINC000782973920 941359925 /nfs/dbraw/zinc/35/99/25/941359925.db2.gz KRTDTSGSVXQCHU-UHFFFAOYSA-N 0 0 362.405 3.636 20 5 FHBDRN CCc1[nH]nc(C(=O)Nc2cc(-c3ccccc3)cnc2C)c1[N+](=O)[O-] ZINC000376633769 941369521 /nfs/dbraw/zinc/36/95/21/941369521.db2.gz HIDHKHVHHKLNCT-UHFFFAOYSA-N 0 0 351.366 3.503 20 5 FHBDRN Cc1ccc(NC(=O)N2CCC(n3ccc([N+](=O)[O-])n3)CC2)c(Cl)c1 ZINC000376635626 941369941 /nfs/dbraw/zinc/36/99/41/941369941.db2.gz XXLLZKYGIKJBOU-UHFFFAOYSA-N 0 0 363.805 3.622 20 5 FHBDRN COc1ccc(-c2ccc(CN[C@@H](C)c3csnn3)o2)c([N+](=O)[O-])c1 ZINC000414549679 941377715 /nfs/dbraw/zinc/37/77/15/941377715.db2.gz LTWDIJKKGIBLHG-JTQLQIEISA-N 0 0 360.395 3.566 20 5 FHBDRN C[C@H]([C@@H]1Cc2ccccc2O1)N(C)C(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000136107487 941379999 /nfs/dbraw/zinc/37/99/99/941379999.db2.gz AROKBKMJVJYOKT-KSMMKXTCSA-N 0 0 369.421 3.689 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N2CCN(C)c3cc(F)ccc32)c1 ZINC000072535292 941404233 /nfs/dbraw/zinc/40/42/33/941404233.db2.gz DREHDTADMAISAS-UHFFFAOYSA-N 0 0 361.398 3.552 20 5 FHBDRN O=C(COc1cccc([N+](=O)[O-])c1)NC1(c2ccc(Cl)cc2)CCC1 ZINC000573113914 941418385 /nfs/dbraw/zinc/41/83/85/941418385.db2.gz XBLGSVFJVGARIM-UHFFFAOYSA-N 0 0 360.797 3.823 20 5 FHBDRN CN(c1ccccc1)c1ccc(C[NH+]2CCC(C(=O)[O-])CC2)cc1[N+](=O)[O-] ZINC000414637780 941421577 /nfs/dbraw/zinc/42/15/77/941421577.db2.gz MSOUZLDHHLZPPJ-UHFFFAOYSA-N 0 0 369.421 3.659 20 5 FHBDRN Cc1ccc(NC(=O)N2CCC(c3cccc(N)c3)CC2)cc1[N+](=O)[O-] ZINC000414652022 941425817 /nfs/dbraw/zinc/42/58/17/941425817.db2.gz CVMGNWFUFOMCCK-UHFFFAOYSA-N 0 0 354.410 3.897 20 5 FHBDRN O=C(Nc1cc2c(cc1[N+](=O)[O-])OCCCO2)[C@@H]1C[C@@]1(F)c1ccccc1 ZINC000414733074 941451533 /nfs/dbraw/zinc/45/15/33/941451533.db2.gz CINBUVUINPAICC-ORAYPTAESA-N 0 0 372.352 3.580 20 5 FHBDRN CCC(=O)c1ccc(N2CCC(n3cc(Cl)cn3)CC2)c([N+](=O)[O-])c1 ZINC000377091509 941517313 /nfs/dbraw/zinc/51/73/13/941517313.db2.gz MWWSLWPNQQPAEA-UHFFFAOYSA-N 0 0 362.817 3.879 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCCC[C@@H]1c1cc[nH]n1 ZINC000377163351 941537428 /nfs/dbraw/zinc/53/74/28/941537428.db2.gz ADVMQHOGZBPYFT-BLLLJJGKSA-N 0 0 360.439 3.552 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)CC(=O)Nc1cccc2ccccc21 ZINC000549153734 941540140 /nfs/dbraw/zinc/54/01/40/941540140.db2.gz ODMHQVXTPNZGLW-UHFFFAOYSA-N 0 0 363.417 3.861 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N[C@@H](C)c2cc(C)cc(C)c2)c1F ZINC000412054000 941559572 /nfs/dbraw/zinc/55/95/72/941559572.db2.gz HCPARAZEJMSVCI-ZDUSSCGKSA-N 0 0 360.385 3.779 20 5 FHBDRN CS[C@H]1CCCCN(c2nnc(-c3cccc([N+](=O)[O-])c3)n2C2CC2)C1 ZINC000565126925 941569375 /nfs/dbraw/zinc/56/93/75/941569375.db2.gz DETLEEBVFKFIHO-INIZCTEOSA-N 0 0 373.482 3.910 20 5 FHBDRN Cc1nc2c(o1)CCC[C@H]2NCc1ccc(Br)cc1[N+](=O)[O-] ZINC000926848663 941573187 /nfs/dbraw/zinc/57/31/87/941573187.db2.gz CLMULXLJNIEHAG-GFCCVEGCSA-N 0 0 366.215 3.821 20 5 FHBDRN O=C(N1CCC[C@H]1c1nccs1)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000377260875 941600698 /nfs/dbraw/zinc/60/06/98/941600698.db2.gz ZUPSYDVEPJRCJL-LBPRGKRZSA-N 0 0 353.350 3.507 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(N[C@@H](C)[C@@H](OC)c2ccc(OC)cc2)c1 ZINC000541113243 941605691 /nfs/dbraw/zinc/60/56/91/941605691.db2.gz VHKYTHIJJZAYKJ-KPZWWZAWSA-N 0 0 374.393 3.578 20 5 FHBDRN Cc1cc(NC[C@@H](CO)c2ccccc2)c(Br)cc1[N+](=O)[O-] ZINC000302659903 941612500 /nfs/dbraw/zinc/61/25/00/941612500.db2.gz IBKRITJKMBQLKV-ZDUSSCGKSA-N 0 0 365.227 3.854 20 5 FHBDRN Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)N[C@@H]1CCOC2(CCCC2)C1 ZINC000377283262 941617769 /nfs/dbraw/zinc/61/77/69/941617769.db2.gz ODVAUVCROXHDGX-GFCCVEGCSA-N 0 0 351.378 3.656 20 5 FHBDRN O=[N+]([O-])c1cc(I)ccc1N[C@@H]1CC[C@@H](F)C1 ZINC000549196134 941621047 /nfs/dbraw/zinc/62/10/47/941621047.db2.gz FWTXLIMONURYHR-VXNVDRBHSA-N 0 0 350.131 3.502 20 5 FHBDRN CCOc1ccc(C(=O)Nc2ccccc2OC(F)F)cc1[N+](=O)[O-] ZINC000005672155 941622566 /nfs/dbraw/zinc/62/25/66/941622566.db2.gz MAPQRZKRRZEKHI-UHFFFAOYSA-N 0 0 352.293 3.847 20 5 FHBDRN O=C(NCc1ccc(Sc2ccc(F)cc2)cc1)c1c[nH]nc1[N+](=O)[O-] ZINC000549198908 941629040 /nfs/dbraw/zinc/62/90/40/941629040.db2.gz BXCNGYNXENTTAY-UHFFFAOYSA-N 0 0 372.381 3.538 20 5 FHBDRN O=C(Cc1cc(F)c(Cl)cc1[N+](=O)[O-])N1CCC[C@H]1c1cccnc1 ZINC000365553551 941635128 /nfs/dbraw/zinc/63/51/28/941635128.db2.gz BXJLSOOIOFEJKG-HNNXBMFYSA-N 0 0 363.776 3.689 20 5 FHBDRN CC(C)COc1ccccc1[C@H](CC(C)C)NC(=O)c1c[nH]nc1[N+](=O)[O-] ZINC000549204468 941641829 /nfs/dbraw/zinc/64/18/29/941641829.db2.gz LJERNHHHKLESPN-INIZCTEOSA-N 0 0 374.441 3.870 20 5 FHBDRN CC(C)COc1ccccc1[C@@H](CC(C)C)NC(=O)c1c[nH]nc1[N+](=O)[O-] ZINC000549204469 941641896 /nfs/dbraw/zinc/64/18/96/941641896.db2.gz LJERNHHHKLESPN-MRXNPFEDSA-N 0 0 374.441 3.870 20 5 FHBDRN Cc1cc(Cl)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1SCCO ZINC000136181384 941646326 /nfs/dbraw/zinc/64/63/26/941646326.db2.gz JCCZJEVHZCZNIO-UHFFFAOYSA-N 0 0 366.826 3.893 20 5 FHBDRN Cc1ccc(-c2csc(NC(=O)c3cc([N+](=O)[O-])cn3C)n2)c(C)c1 ZINC000024470572 941661223 /nfs/dbraw/zinc/66/12/23/941661223.db2.gz GEHZRBZFOQOQIJ-UHFFFAOYSA-N 0 0 356.407 3.926 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N[C@@H]1CCCC[C@H]1n1cccn1 ZINC000120177170 941666628 /nfs/dbraw/zinc/66/66/28/941666628.db2.gz SULRNVQBYSQGCA-GDBMZVCRSA-N 0 0 357.414 3.714 20 5 FHBDRN Cc1cnn([C@H]2CCN(C(=O)c3cc4ccccc4c4cccnc34)C2)c1 ZINC000377362094 941674881 /nfs/dbraw/zinc/67/48/81/941674881.db2.gz ZYDYAJCMPFMPBW-KRWDZBQOSA-N 0 0 356.429 3.980 20 5 FHBDRN COc1ccc(-c2nc(NC(=O)c3cc([N+](=O)[O-])cn3C)sc2C)cc1 ZINC000024473788 941694233 /nfs/dbraw/zinc/69/42/33/941694233.db2.gz SNYCCJFMKLVCDR-UHFFFAOYSA-N 0 0 372.406 3.626 20 5 FHBDRN C[C@@H](c1cccs1)c1noc(-c2cc([N+](=O)[O-])cc3c2OCCO3)n1 ZINC000583347524 941697591 /nfs/dbraw/zinc/69/75/91/941697591.db2.gz RXCFCSWGUWGCDP-VIFPVBQESA-N 0 0 359.363 3.629 20 5 FHBDRN CN(C)C(=O)Sc1ccc(NC(=O)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000729241985 941699424 /nfs/dbraw/zinc/69/94/24/941699424.db2.gz BIYBRNMAGFJKEH-UHFFFAOYSA-N 0 0 359.407 3.550 20 5 FHBDRN COc1ccc(NC(=O)CCC(=O)c2ccc3c(c2)CCC3)cc1[N+](=O)[O-] ZINC000541140205 941708517 /nfs/dbraw/zinc/70/85/17/941708517.db2.gz QACZYXCVYSBUCG-UHFFFAOYSA-N 0 0 368.389 3.694 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@@H]1CCCN(c2ccccc2)C1 ZINC000433553823 941709574 /nfs/dbraw/zinc/70/95/74/941709574.db2.gz HGTOUMGVMUPHEH-INIZCTEOSA-N 0 0 368.437 3.941 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)N[C@@H](C(C)(C)C)C(F)(F)F ZINC000549240723 941711107 /nfs/dbraw/zinc/71/11/07/941711107.db2.gz IRRZNPLJMXJVRR-ZDUSSCGKSA-N 0 0 361.364 3.756 20 5 FHBDRN COc1ccc(CNC(=O)c2csc(-c3ccc(C)o3)n2)cc1[N+](=O)[O-] ZINC000513164509 941712700 /nfs/dbraw/zinc/71/27/00/941712700.db2.gz HYTLZICKKTWNKQ-UHFFFAOYSA-N 0 0 373.390 3.558 20 5 FHBDRN CC/C=C(\C)C(=O)N1CCCC[C@H]1CCOC(=O)c1cccc([N+](=O)[O-])c1 ZINC000729324828 941718920 /nfs/dbraw/zinc/71/89/20/941718920.db2.gz IJSGIPPXCUFENM-QRMGNNRRSA-N 0 0 374.437 3.879 20 5 FHBDRN O=C(c1c[nH]nc1[N+](=O)[O-])N1CCC(c2cccc(Cl)c2Cl)CC1 ZINC000566043176 941721535 /nfs/dbraw/zinc/72/15/35/941721535.db2.gz DZENPTQQIFRSTH-UHFFFAOYSA-N 0 0 369.208 3.645 20 5 FHBDRN CC(=O)N1CCSc2ccc(NC(=O)c3c(C)cccc3[N+](=O)[O-])cc21 ZINC000377452166 941728485 /nfs/dbraw/zinc/72/84/85/941728485.db2.gz WBAYWTBVTPZIGK-UHFFFAOYSA-N 0 0 371.418 3.614 20 5 FHBDRN C[C@H](NC(=O)c1cc(F)c(F)cc1[N+](=O)[O-])c1nccn1-c1ccccc1 ZINC000377446542 941730120 /nfs/dbraw/zinc/73/01/20/941730120.db2.gz FLJGNBZPMCKPCO-NSHDSACASA-N 0 0 372.331 3.550 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]cc(Cc3noc(C4(C5CC5)CCOCC4)n3)c2c1 ZINC000377476105 941754125 /nfs/dbraw/zinc/75/41/25/941754125.db2.gz QNFZHWQPJJVKAZ-UHFFFAOYSA-N 0 0 368.393 3.508 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)OCc1cccc(-n2cccn2)c1 ZINC000122465852 941758977 /nfs/dbraw/zinc/75/89/77/941758977.db2.gz YWFPBFPXGULHFY-UHFFFAOYSA-N 0 0 369.402 3.616 20 5 FHBDRN CN(CC(=O)NC(C)(C)C)Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000120671531 941760035 /nfs/dbraw/zinc/76/00/35/941760035.db2.gz MSGAGGYUFBPIJX-UHFFFAOYSA-N 0 0 361.467 3.670 20 5 FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC(C(C)C)CC1 ZINC000120677491 941764561 /nfs/dbraw/zinc/76/45/61/941764561.db2.gz KIASFJPMOITCJN-UHFFFAOYSA-N 0 0 366.483 3.842 20 5 FHBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CCC[C@H]1C1CCC1 ZINC000120675322 941765300 /nfs/dbraw/zinc/76/53/00/941765300.db2.gz QOAMLUQYODNAEA-AWEZNQCLSA-N 0 0 353.216 3.762 20 5 FHBDRN O=c1[nH]cnc2cc(NCC3CC(c4ccccc4)C3)c([N+](=O)[O-])cc21 ZINC000549256004 941766779 /nfs/dbraw/zinc/76/67/79/941766779.db2.gz CWELDLSWSNEMAD-UHFFFAOYSA-N 0 0 350.378 3.849 20 5 FHBDRN CCCOc1ccc(CNC(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)cc1 ZINC000122485653 941771450 /nfs/dbraw/zinc/77/14/50/941771450.db2.gz FKYJCDJUBBQUCH-UHFFFAOYSA-N 0 0 369.421 3.652 20 5 FHBDRN C[C@@H]([C@H]1Cc2ccccc2O1)N(C)C(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000433569741 941774075 /nfs/dbraw/zinc/77/40/75/941774075.db2.gz ISFOKLZYVWPCEE-KPZWWZAWSA-N 0 0 374.824 3.641 20 5 FHBDRN CC(C)OC(=O)c1ccc(O[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000513203748 941779264 /nfs/dbraw/zinc/77/92/64/941779264.db2.gz JMSOSFQYVOXLAO-CYBMUJFWSA-N 0 0 372.377 3.566 20 5 FHBDRN CC[C@]1(CNC(=O)c2ccc([N+](=O)[O-])c(C)c2)OCCc2ccccc21 ZINC000574008496 941782406 /nfs/dbraw/zinc/78/24/06/941782406.db2.gz UPYMYAHEKBINRQ-HXUWFJFHSA-N 0 0 354.406 3.511 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])N[C@H](c1cc(F)ccc1F)C(F)F ZINC000433621018 941789868 /nfs/dbraw/zinc/78/98/68/941789868.db2.gz DNSPPCHSFFVFKL-CQSZACIVSA-N 0 0 371.290 3.679 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(OCc2cc(-c3ccc(C)cc3)no2)c1 ZINC000513219046 941792207 /nfs/dbraw/zinc/79/22/07/941792207.db2.gz SFEMBLCJSCTNEL-UHFFFAOYSA-N 0 0 368.345 3.924 20 5 FHBDRN CC(C)CCOC(=O)[C@@H](C)Oc1ccc(Br)c([N+](=O)[O-])c1 ZINC001225504969 941793269 /nfs/dbraw/zinc/79/32/69/941793269.db2.gz FCTGYKXUPZTEEG-SNVBAGLBSA-N 0 0 360.204 3.714 20 5 FHBDRN Cc1cc([C@@H](C)Nc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])ccc1F ZINC000433611270 941797363 /nfs/dbraw/zinc/79/73/63/941797363.db2.gz ALVUNPYQYBJIDR-LLVKDONJSA-N 0 0 352.387 3.619 20 5 FHBDRN CCCc1ccc(NC(=O)c2nnn(-c3cccc([N+](=O)[O-])c3)c2C)cc1 ZINC000024496726 941801982 /nfs/dbraw/zinc/80/19/82/941801982.db2.gz NGLLOQSPFXPWSV-UHFFFAOYSA-N 0 0 365.393 3.689 20 5 FHBDRN Cc1cc(NCCCn2cc(Br)cn2)c(F)cc1[N+](=O)[O-] ZINC000314313639 941820328 /nfs/dbraw/zinc/82/03/28/941820328.db2.gz IDQPXLISUNKADC-UHFFFAOYSA-N 0 0 357.183 3.504 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN1C[C@H](C)C[C@@H]1c1ccccc1 ZINC000513257437 941821228 /nfs/dbraw/zinc/82/12/28/941821228.db2.gz QTHFMJNGIHPREW-RDTXWAMCSA-N 0 0 369.421 3.625 20 5 FHBDRN Cc1cnc(COC(=O)[C@H]2CC[C@@H](c3ccccc3)O2)c(C)c1[N+](=O)[O-] ZINC000377582319 941823301 /nfs/dbraw/zinc/82/33/01/941823301.db2.gz DIAVQMUCVOAKDL-DLBZAZTESA-N 0 0 356.378 3.570 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N[C@H](c2ccccc2)C2CCC2)c1F ZINC000412131382 941824787 /nfs/dbraw/zinc/82/47/87/941824787.db2.gz WHVGWCXJMTZGLN-HXUWFJFHSA-N 0 0 372.396 3.943 20 5 FHBDRN Cn1cnc([N+](=O)[O-])c1NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 ZINC000025572978 941832668 /nfs/dbraw/zinc/83/26/68/941832668.db2.gz JBOJUDKRBBQEBR-BQBZGAKWSA-N 0 0 360.258 3.650 20 5 FHBDRN Cc1cccnc1[C@@H](NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)C(C)C ZINC000412138901 941833544 /nfs/dbraw/zinc/83/35/44/941833544.db2.gz RCDXPOFOXUVTDL-KSZLIROESA-N 0 0 353.422 3.915 20 5 FHBDRN CO[C@H](CNC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)c1ccc(Cl)cc1 ZINC000412138888 941833598 /nfs/dbraw/zinc/83/35/98/941833598.db2.gz QZHOHBNWPJRDDE-RCCFBDPRSA-N 0 0 374.824 3.856 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)Cc1c[nH]c2cccc(Cl)c12 ZINC000513299003 941841695 /nfs/dbraw/zinc/84/16/95/941841695.db2.gz QXMKUMVHSADDBW-UHFFFAOYSA-N 0 0 371.824 3.973 20 5 FHBDRN O=[N+]([O-])c1cc2ccccc2nc1N1Cc2cnn(-c3ccccc3)c2C1 ZINC000549285879 941843345 /nfs/dbraw/zinc/84/33/45/941843345.db2.gz OAFFQJAWMAFHMB-UHFFFAOYSA-N 0 0 357.373 3.849 20 5 FHBDRN CO[C@@H](CNC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)c1cccc(Cl)c1 ZINC000412150000 941845710 /nfs/dbraw/zinc/84/57/10/941845710.db2.gz KCEFUMBIDRMSCS-KSZLIROESA-N 0 0 374.824 3.856 20 5 FHBDRN CC(=O)N1C[C@H](C)CN(C(=O)c2cc([N+](=O)[O-])ccc2C)c2ccccc21 ZINC000365617047 941847627 /nfs/dbraw/zinc/84/76/27/941847627.db2.gz DVBKRMKAPKKPML-ZDUSSCGKSA-N 0 0 367.405 3.553 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N1CCC=C(c2ccncc2)C1 ZINC000513339642 941853973 /nfs/dbraw/zinc/85/39/73/941853973.db2.gz XYSOLZDQRJNSCF-UHFFFAOYSA-N 0 0 358.785 3.964 20 5 FHBDRN CCO[C@H](CCNC(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1)C(C)C ZINC000412161279 941856582 /nfs/dbraw/zinc/85/65/82/941856582.db2.gz PQHBUDIJXMIMOI-MRXNPFEDSA-N 0 0 352.431 3.563 20 5 FHBDRN C[C@@H](CNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F)Oc1ccccc1 ZINC000545828122 941857203 /nfs/dbraw/zinc/85/72/03/941857203.db2.gz ULDIYNNRJQBHFQ-ZDUSSCGKSA-N 0 0 360.385 3.595 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)N1CCOc2c(Cl)cccc21 ZINC000472816407 941860799 /nfs/dbraw/zinc/86/07/99/941860799.db2.gz JEXXQXFFDLAMBY-UHFFFAOYSA-N 0 0 364.810 3.766 20 5 FHBDRN CC[C@@H]1CCCC[C@H]1c1nc(-c2ccc(-n3cncn3)c([N+](=O)[O-])c2)no1 ZINC000453206330 941862558 /nfs/dbraw/zinc/86/25/58/941862558.db2.gz YJWNKXJVJGITHW-TZMCWYRMSA-N 0 0 368.397 3.909 20 5 FHBDRN CCS[C@H]1CCC[C@@H]1NC(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1 ZINC000412174256 941862893 /nfs/dbraw/zinc/86/28/93/941862893.db2.gz XNZMMNLTMSYPAH-BBRMVZONSA-N 0 0 352.456 3.786 20 5 FHBDRN COc1ccccc1[C@@H]1C[C@H]1C(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000412175303 941864082 /nfs/dbraw/zinc/86/40/82/941864082.db2.gz YWMDZUSHPGLPFV-XOKHGSTOSA-N 0 0 354.406 3.893 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)c1cccn1Cc1cccs1 ZINC000513342693 941864520 /nfs/dbraw/zinc/86/45/20/941864520.db2.gz IQEWEAYSHMWACC-UHFFFAOYSA-N 0 0 369.446 3.821 20 5 FHBDRN COc1cc(C(=O)Nc2ccc(C)c(OC(F)F)c2)ccc1[N+](=O)[O-] ZINC000513346140 941866536 /nfs/dbraw/zinc/86/65/36/941866536.db2.gz QZWYKLXMJXPIKQ-UHFFFAOYSA-N 0 0 352.293 3.766 20 5 FHBDRN C[C@@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1c(F)cncc1F ZINC000513347346 941867475 /nfs/dbraw/zinc/86/74/75/941867475.db2.gz IMPJXNDRUNNARL-SSDOTTSWSA-N 0 0 356.716 3.804 20 5 FHBDRN CCn1cc(C(=O)N(C)CCc2cccc([N+](=O)[O-])c2)c2ccccc21 ZINC000513354632 941873500 /nfs/dbraw/zinc/87/35/00/941873500.db2.gz WYZLAJGLAJUBII-UHFFFAOYSA-N 0 0 351.406 3.884 20 5 FHBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[C@H](OC)C1 ZINC000472826047 941877147 /nfs/dbraw/zinc/87/71/47/941877147.db2.gz BBXAOWBQHUMZKS-JSGCOSHPSA-N 0 0 352.456 3.784 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N[C@H]2CCC[C@@H]2Cc2ccccc2)c1[N+](=O)[O-] ZINC000433763961 941881409 /nfs/dbraw/zinc/88/14/09/941881409.db2.gz FMSZYHQLNVVUGB-CABCVRRESA-N 0 0 356.426 3.583 20 5 FHBDRN CO[C@@H]1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2SCC(C)C)C1 ZINC000472826303 941883799 /nfs/dbraw/zinc/88/37/99/941883799.db2.gz OUOVQJKXZABBOQ-TZMCWYRMSA-N 0 0 352.456 3.640 20 5 FHBDRN CO[C@@H]1CC[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2SCC(C)C)C1 ZINC000472826300 941883915 /nfs/dbraw/zinc/88/39/15/941883915.db2.gz OUOVQJKXZABBOQ-GXTWGEPZSA-N 0 0 352.456 3.640 20 5 FHBDRN Cc1ccccc1CN(C)C(=O)CN(Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000513392898 941888480 /nfs/dbraw/zinc/88/84/80/941888480.db2.gz ZLXPTLKPEHRUHC-UHFFFAOYSA-N 0 0 369.465 3.772 20 5 FHBDRN CC(C)Oc1cc(C(=O)N(c2ccccc2)[C@H]2CCOC2)ccc1[N+](=O)[O-] ZINC000415543301 941892766 /nfs/dbraw/zinc/89/27/66/941892766.db2.gz RQVRSAYVAIJKND-KRWDZBQOSA-N 0 0 370.405 3.818 20 5 FHBDRN C[C@H](NCc1c(Cl)cccc1[N+](=O)[O-])c1ccc(S(C)(=O)=O)cc1 ZINC000119643809 941893623 /nfs/dbraw/zinc/89/36/23/941893623.db2.gz LADVEVFPHNZIEA-NSHDSACASA-N 0 0 368.842 3.503 20 5 FHBDRN CO[C@@H]1CC[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2NCc2ccccc2)C1 ZINC000472832147 941895209 /nfs/dbraw/zinc/89/52/09/941895209.db2.gz ZVGVDDZMRHALRJ-DOTOQJQBSA-N 0 0 369.421 3.504 20 5 FHBDRN COc1cccc(C[C@H]2CCCN2C(=O)NCc2ccccc2[N+](=O)[O-])c1 ZINC000517499607 941895567 /nfs/dbraw/zinc/89/55/67/941895567.db2.gz WRSZSYRCEJYOMX-QGZVFWFLSA-N 0 0 369.421 3.520 20 5 FHBDRN CCOc1ccc2c(c1)CCN(C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)C2 ZINC000412197960 941898881 /nfs/dbraw/zinc/89/88/81/941898881.db2.gz MIUGKYZDYPOZRE-VQTJNVASSA-N 0 0 366.417 3.682 20 5 FHBDRN O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CCC[C@H]([C@@H](O)C(F)(F)F)C1 ZINC000433794372 941902139 /nfs/dbraw/zinc/90/21/39/941902139.db2.gz XIGZWIMVHCUBDX-QPUJVOFHSA-N 0 0 372.265 3.753 20 5 FHBDRN O=C(N[C@@H]1CCO[C@@H]1c1ccc(Cl)cc1)c1ccc([N+](=O)[O-])s1 ZINC000182435850 941924764 /nfs/dbraw/zinc/92/47/64/941924764.db2.gz VSZKNZRIGYDCMP-BXUZGUMPSA-N 0 0 352.799 3.570 20 5 FHBDRN O=C(C[C@@H](c1ccc(O)cc1)C1CC1)Nc1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000412217418 941925424 /nfs/dbraw/zinc/92/54/24/941925424.db2.gz LHHIXPNRMFFHHO-OAHLLOKOSA-N 0 0 366.377 3.699 20 5 FHBDRN CCC[C@@H](C)NC(=O)[C@H]1CCCN(c2nc3ccccc3cc2[N+](=O)[O-])C1 ZINC000473528912 941925467 /nfs/dbraw/zinc/92/54/67/941925467.db2.gz IBJLNKACGCIJIZ-ZBFHGGJFSA-N 0 0 370.453 3.664 20 5 FHBDRN O=C(NC[C@@H]1[C@@H]2Cc3ccccc3[C@H]12)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000182489852 941934167 /nfs/dbraw/zinc/93/41/67/941934167.db2.gz HFLNBRNRFRSUCL-LXZKKBNFSA-N 0 0 374.343 3.512 20 5 FHBDRN Cc1cn([C@@H](C)c2ccccc2)[nH]c1=NC(=O)c1ccc(C)c([N+](=O)[O-])c1 ZINC000472846831 941939017 /nfs/dbraw/zinc/93/90/17/941939017.db2.gz JCJXROBRWIKFAV-HNNXBMFYSA-N 0 0 364.405 3.692 20 5 FHBDRN CCOC(=O)CC1(NC(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)CCCC1 ZINC000433854987 941942984 /nfs/dbraw/zinc/94/29/84/941942984.db2.gz YWYXRDWQXYRZNH-UHFFFAOYSA-N 0 0 363.414 3.599 20 5 FHBDRN Cc1nc(-c2ccc(NC(=O)c3cccc(C)c3[N+](=O)[O-])cc2Cl)n[nH]1 ZINC000182692122 941952549 /nfs/dbraw/zinc/95/25/49/941952549.db2.gz CFUBRVQCJYUDQH-UHFFFAOYSA-N 0 0 371.784 3.902 20 5 FHBDRN C[C@H]1CCc2onc(C(=O)N3CCS[C@H]3c3ccc([N+](=O)[O-])cc3)c2C1 ZINC000433865105 941953310 /nfs/dbraw/zinc/95/33/10/941953310.db2.gz NQIFJZBJSQJDLK-VOJFVSQTSA-N 0 0 373.434 3.595 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N(C)Cc2c(F)cccc2Cl)c1[N+](=O)[O-] ZINC000433865418 941954264 /nfs/dbraw/zinc/95/42/64/941954264.db2.gz AKXNRSQNGTZSGK-UHFFFAOYSA-N 0 0 354.769 3.506 20 5 FHBDRN C[C@H]1CCc2onc(C(=O)Nc3ccc([N+](=O)[O-])c(C(F)(F)F)c3)c2C1 ZINC000433867911 941955318 /nfs/dbraw/zinc/95/53/18/941955318.db2.gz KISAEZZLYSZXAQ-QMMMGPOBSA-N 0 0 369.299 3.979 20 5 FHBDRN COc1ccc([C@H](NC(=O)c2ccc([N+](=O)[O-])cc2F)C(F)(F)F)cc1 ZINC000182640857 941957144 /nfs/dbraw/zinc/95/71/44/941957144.db2.gz RPLYMDWKRYYDLP-AWEZNQCLSA-N 0 0 372.274 3.776 20 5 FHBDRN O=C(N[C@H](c1c(F)cccc1F)C(F)(F)F)c1csc([N+](=O)[O-])c1 ZINC000182733386 941963477 /nfs/dbraw/zinc/96/34/77/941963477.db2.gz GHEDEULNQXXZOW-LLVKDONJSA-N 0 0 366.267 3.968 20 5 FHBDRN COc1ccc([C@H](NC(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])C(C)C)cc1 ZINC000433874145 941965188 /nfs/dbraw/zinc/96/51/88/941965188.db2.gz UWZBVWTXPDUVII-CQSZACIVSA-N 0 0 360.414 3.577 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCN([C@@H](C)c2cccnc2)CC1 ZINC000182807562 941970055 /nfs/dbraw/zinc/97/00/55/941970055.db2.gz YOJBYJLPGUSXRF-IRXDYDNUSA-N 0 0 354.454 3.738 20 5 FHBDRN CCn1cnnc1-c1cccc(NC(=O)c2c(Cl)cccc2[N+](=O)[O-])c1 ZINC000110209677 941977016 /nfs/dbraw/zinc/97/70/16/941977016.db2.gz IULZLKJNNOKJHO-UHFFFAOYSA-N 0 0 371.784 3.779 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H](C)C[C@H]2c2cccnc2)c1 ZINC000182838986 941978617 /nfs/dbraw/zinc/97/86/17/941978617.db2.gz QXWDNYPAQIDPMD-SJCJKPOMSA-N 0 0 357.435 3.935 20 5 FHBDRN O=C(Nc1ccc(F)cc1C(F)(F)F)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000182855424 941982226 /nfs/dbraw/zinc/98/22/26/941982226.db2.gz VZZHYUNODUBMMA-UHFFFAOYSA-N 0 0 372.230 3.734 20 5 FHBDRN Cc1cn(-c2ccc(F)cc2)nc1C(=O)Nc1ccc([N+](=O)[O-])cc1F ZINC000509927318 941987860 /nfs/dbraw/zinc/98/78/60/941987860.db2.gz PKWDJWZBTYAVHM-UHFFFAOYSA-N 0 0 358.304 3.619 20 5 FHBDRN O=C(CNC(=O)Nc1ccc([N+](=O)[O-])cc1)Nc1cccc2ccccc21 ZINC000101602853 941990395 /nfs/dbraw/zinc/99/03/95/941990395.db2.gz LVZGJRXUXVWWLN-UHFFFAOYSA-N 0 0 364.361 3.508 20 5 FHBDRN C[C@@H]1C[C@@H](c2cccs2)CN1C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000377805576 942003650 /nfs/dbraw/zinc/00/36/50/942003650.db2.gz VTTRKDSVSZGUHK-GHMZBOCLSA-N 0 0 356.407 3.551 20 5 FHBDRN C[C@@H](c1cccs1)N(Cc1ccccc1)C(=O)c1c([N+](=O)[O-])cnn1C ZINC000500982145 942009449 /nfs/dbraw/zinc/00/94/49/942009449.db2.gz JXXYQQYBCFJKNA-ZDUSSCGKSA-N 0 0 370.434 3.793 20 5 FHBDRN Cc1nc(CCCC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)cs1 ZINC000163787287 942013429 /nfs/dbraw/zinc/01/34/29/942013429.db2.gz ILPMQNMFCPRSAC-UHFFFAOYSA-N 0 0 359.451 3.874 20 5 FHBDRN COc1ccc(NC(=O)c2ccc(-c3ccco3)nc2C)c([N+](=O)[O-])c1 ZINC000101809544 942016390 /nfs/dbraw/zinc/01/63/90/942016390.db2.gz NBHBRTCJBLBMPC-UHFFFAOYSA-N 0 0 353.334 3.819 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1Cl)N[C@H]1C[C@@H](CO)c2ccccc21 ZINC000377820825 942018441 /nfs/dbraw/zinc/01/84/41/942018441.db2.gz IIIXPODTIZYWPU-HZMBPMFUSA-N 0 0 361.785 3.591 20 5 FHBDRN COc1ccc(C(=O)N2CCC[C@H]2Cc2ccccc2C)cc1[N+](=O)[O-] ZINC000513567375 942020699 /nfs/dbraw/zinc/02/06/99/942020699.db2.gz ROFGWSBIEINAKH-KRWDZBQOSA-N 0 0 354.406 3.759 20 5 FHBDRN O=C(N[C@H]1CCO[C@H](c2ccccc2)C1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412271999 942021049 /nfs/dbraw/zinc/02/10/49/942021049.db2.gz PSGAOMGRUPQLMW-FFGOWVMKSA-N 0 0 366.417 3.735 20 5 FHBDRN O=C(CC[C@H]1CCOC1)N(Cc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000433981212 942022673 /nfs/dbraw/zinc/02/26/73/942022673.db2.gz MVLWNFCIDDMRTC-KRWDZBQOSA-N 0 0 354.406 3.945 20 5 FHBDRN Cc1sc(C(=O)NC[C@@H]2CCCN(c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000433986885 942025554 /nfs/dbraw/zinc/02/55/54/942025554.db2.gz YWZXQCBOLJJIMD-AWEZNQCLSA-N 0 0 359.451 3.611 20 5 FHBDRN O=[N+]([O-])c1cc(-c2nc(COc3ccccc3)no2)ccc1OC(F)F ZINC000513591371 942030329 /nfs/dbraw/zinc/03/03/29/942030329.db2.gz FQNRJMGQMHECJY-UHFFFAOYSA-N 0 0 363.276 3.825 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N[C@H](C)c2ccccc2C(F)(F)F)c1[N+](=O)[O-] ZINC000433997196 942033514 /nfs/dbraw/zinc/03/35/14/942033514.db2.gz NCLVHUWNBBOCQB-SECBINFHSA-N 0 0 370.331 3.951 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CC[C@H](Nc2ccccc2)C1 ZINC000085621072 942034730 /nfs/dbraw/zinc/03/47/30/942034730.db2.gz SNXCFXFGAPRDHO-INIZCTEOSA-N 0 0 354.410 3.930 20 5 FHBDRN O=C(c1nc2c(s1)CCC2)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000415759343 942037722 /nfs/dbraw/zinc/03/77/22/942037722.db2.gz LKFKTLLAIPMBHO-CYBMUJFWSA-N 0 0 357.435 3.560 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N2CC[C@@](C)(CCc3ccccc3)C2)c1[N+](=O)[O-] ZINC000434012964 942039437 /nfs/dbraw/zinc/03/94/37/942039437.db2.gz RRIZWVVAUDIHDF-HXUWFJFHSA-N 0 0 370.453 3.926 20 5 FHBDRN Cn1cc(NC(=O)CCNc2ccccc2[N+](=O)[O-])c(C2CCCCC2)n1 ZINC000452271746 942039544 /nfs/dbraw/zinc/03/95/44/942039544.db2.gz QXIFSSDXVFXXLE-UHFFFAOYSA-N 0 0 371.441 3.817 20 5 FHBDRN CSc1ccc(Cl)cc1NC(=O)CCn1nc(C)c([N+](=O)[O-])c1C ZINC000102242244 942044892 /nfs/dbraw/zinc/04/48/92/942044892.db2.gz VJCVHHGZXSFGJO-UHFFFAOYSA-N 0 0 368.846 3.812 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N[C@@H](C)c2c(F)cccc2Cl)c1[N+](=O)[O-] ZINC000434027930 942054294 /nfs/dbraw/zinc/05/42/94/942054294.db2.gz ODRAOPLASQMIDT-QMMMGPOBSA-N 0 0 354.769 3.725 20 5 FHBDRN Cc1nn(C)c(Sc2nnc(-c3ccc4ccccc4c3)o2)c1[N+](=O)[O-] ZINC000513651501 942055754 /nfs/dbraw/zinc/05/57/54/942055754.db2.gz AZJNBJVPIOILMK-UHFFFAOYSA-N 0 0 367.390 3.991 20 5 FHBDRN CCn1c(-c2ccc([N+](=O)[O-])cc2)nnc1N1CC[C@]2(CC[C@H](C)C2)C1 ZINC000549367584 942063739 /nfs/dbraw/zinc/06/37/39/942063739.db2.gz BUROUIUUFYKOLS-LIRRHRJNSA-N 0 0 355.442 3.890 20 5 FHBDRN COCCN(C[C@@H]1CC=CCC1)C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412289961 942066648 /nfs/dbraw/zinc/06/66/48/942066648.db2.gz UPVBXJVADVCMQZ-AYOQOUSVSA-N 0 0 358.438 3.530 20 5 FHBDRN C[C@@H](CN[C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000513684656 942074983 /nfs/dbraw/zinc/07/49/83/942074983.db2.gz UAARNEOPDKESJI-LIRRHRJNSA-N 0 0 368.412 3.950 20 5 FHBDRN O=C(NCCF)c1cc([N+](=O)[O-])ccc1NCc1ccccc1Cl ZINC000437698512 942076447 /nfs/dbraw/zinc/07/64/47/942076447.db2.gz WGVOFRLQHFGFMU-UHFFFAOYSA-N 0 0 351.765 3.560 20 5 FHBDRN C[C@@H](NC(=O)c1ccc(OC2CCCC2)nc1)c1cccc([N+](=O)[O-])c1 ZINC000513685961 942080034 /nfs/dbraw/zinc/08/00/34/942080034.db2.gz UPVHGYPQTFTOMP-CYBMUJFWSA-N 0 0 355.394 3.802 20 5 FHBDRN COc1ccc(NC(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cc1N ZINC000415857769 942090948 /nfs/dbraw/zinc/09/09/48/942090948.db2.gz RVJJKEVYHNEJEI-CQSZACIVSA-N 0 0 370.409 3.597 20 5 FHBDRN CC(C)(C)OC(=O)[C@@]1(C)CCN(c2ccc([N+](=O)[O-])c3cnccc32)C1 ZINC000413358380 942091387 /nfs/dbraw/zinc/09/13/87/942091387.db2.gz MPNDXTAOVZUJOK-IBGZPJMESA-N 0 0 357.410 3.701 20 5 FHBDRN O=C(Nc1cc(F)ccc1Cl)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000102740450 942096756 /nfs/dbraw/zinc/09/67/56/942096756.db2.gz STVJQJVPMCUWDQ-UHFFFAOYSA-N 0 0 360.732 3.825 20 5 FHBDRN COc1cc(C(=O)Nc2cc(F)ccc2Cl)c([N+](=O)[O-])cc1OC ZINC000102742204 942096867 /nfs/dbraw/zinc/09/68/67/942096867.db2.gz AMODOCRYUJIQSH-UHFFFAOYSA-N 0 0 354.721 3.657 20 5 FHBDRN COc1cccc([C@H](C)NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)c1 ZINC000513722842 942097723 /nfs/dbraw/zinc/09/77/23/942097723.db2.gz AJNIGXGRSVMNDF-JTQLQIEISA-N 0 0 366.320 3.696 20 5 FHBDRN CC1(C)CN(C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)[C@@H]1[C@H]1CCCO1 ZINC000290412960 942098505 /nfs/dbraw/zinc/09/85/05/942098505.db2.gz MYHPEIPKNAXDOV-ZIAGYGMSSA-N 0 0 353.806 3.670 20 5 FHBDRN Cc1nc2cc(C(=O)N(Cc3cccc([N+](=O)[O-])c3)C3CC3)ccc2o1 ZINC000280094661 942101247 /nfs/dbraw/zinc/10/12/47/942101247.db2.gz OPSBIHNXEBHSKD-UHFFFAOYSA-N 0 0 351.362 3.849 20 5 FHBDRN Cn1c(C(=O)NCC2(c3ccc(F)cc3)CCCCC2)ccc1[N+](=O)[O-] ZINC000501903661 942107192 /nfs/dbraw/zinc/10/71/92/942107192.db2.gz LCKIXOSQFXACDC-UHFFFAOYSA-N 0 0 359.401 3.704 20 5 FHBDRN CCn1nc(C)c([N+](=O)[O-])c1Nc1ccc2c(c1)CN(CC(F)(F)F)C2 ZINC000413376799 942113780 /nfs/dbraw/zinc/11/37/80/942113780.db2.gz WCOZXQYHXKBRHH-UHFFFAOYSA-N 0 0 369.347 3.741 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])N[C@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000163827458 942114873 /nfs/dbraw/zinc/11/48/73/942114873.db2.gz AIEBXDHZZIOGHO-MAUKXSAKSA-N 0 0 369.421 3.562 20 5 FHBDRN Cc1cnc([C@@H](C)NC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])s1 ZINC000280171448 942116853 /nfs/dbraw/zinc/11/68/53/942116853.db2.gz OANYLMIDTCBCMG-MRVPVSSYSA-N 0 0 357.794 3.572 20 5 FHBDRN COc1cc(C(=O)N(c2ccccc2)[C@@H]2C[C@H]2C)c([N+](=O)[O-])cc1OC ZINC000415899467 942118611 /nfs/dbraw/zinc/11/86/11/942118611.db2.gz HXGDTWHQNXEXHT-IUODEOHRSA-N 0 0 356.378 3.667 20 5 FHBDRN CC[C@H](C)c1ncc(NC(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)cn1 ZINC000412310140 942120664 /nfs/dbraw/zinc/12/06/64/942120664.db2.gz PXUHGPUQRXQJQB-LBPRGKRZSA-N 0 0 358.398 3.938 20 5 FHBDRN CCOC(=O)c1cc(C(=O)N(c2ccccc2)[C@H]2C[C@@H]2C)cc([N+](=O)[O-])c1 ZINC000415899194 942124924 /nfs/dbraw/zinc/12/49/24/942124924.db2.gz WBIRRURXACGLJJ-UGSOOPFHSA-N 0 0 368.389 3.827 20 5 FHBDRN CC1(C)[C@H](c2ccccc2)CCN1c1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000420633917 942129657 /nfs/dbraw/zinc/12/96/57/942129657.db2.gz COBYIMKFOKHGCI-INIZCTEOSA-N 0 0 374.462 3.771 20 5 FHBDRN COC(=O)c1cc(N2CCC[C@H](CC(F)(F)F)C2)cc(C)c1[N+](=O)[O-] ZINC000420631193 942129669 /nfs/dbraw/zinc/12/96/69/942129669.db2.gz QHICAKYAURCRGG-LLVKDONJSA-N 0 0 360.332 3.859 20 5 FHBDRN CCN(CC)C(=O)c1ccc(C(=O)Oc2c(C)cccc2[N+](=O)[O-])cc1 ZINC000760015748 942137545 /nfs/dbraw/zinc/13/75/45/942137545.db2.gz HZXFVRWDXQEEQK-UHFFFAOYSA-N 0 0 356.378 3.604 20 5 FHBDRN C[C@H](CCCc1cccnc1)Nc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 ZINC000413395881 942143168 /nfs/dbraw/zinc/14/31/68/942143168.db2.gz OBTLJNXZOWRIHJ-CYBMUJFWSA-N 0 0 354.410 3.698 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)Nc2cccc(N3CCC3=O)c2)cc1[N+](=O)[O-] ZINC000280300255 942154742 /nfs/dbraw/zinc/15/47/42/942154742.db2.gz XAMSWMCAHGOTCN-CYBMUJFWSA-N 0 0 368.393 3.523 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(N2CC[C@@H](C(F)(F)F)C3(CCOCC3)C2)n1 ZINC000413413510 942160817 /nfs/dbraw/zinc/16/08/17/942160817.db2.gz WFGOHOKKIODPNP-CYBMUJFWSA-N 0 0 373.375 3.792 20 5 FHBDRN CC1(C)Oc2ccsc2[C@@H](Nc2c(F)cc([N+](=O)[O-])cc2F)[C@@H]1O ZINC000413415795 942161683 /nfs/dbraw/zinc/16/16/83/942161683.db2.gz IMEZRBUNJFGAHQ-OCCSQVGLSA-N 0 0 356.350 3.620 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)N(C)[C@H]2CCC[C@H](C)C2)cc1SC ZINC000102985511 942166563 /nfs/dbraw/zinc/16/65/63/942166563.db2.gz FLPBQVTUCAVKRF-RYUDHWBXSA-N 0 0 352.456 3.976 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CCC[C@H](C)[C@H]2C)cc1SC ZINC000102983427 942166566 /nfs/dbraw/zinc/16/65/66/942166566.db2.gz PHPATBXOMUOYJB-DMDPSCGWSA-N 0 0 352.456 3.880 20 5 FHBDRN CSc1ccc(C(=O)NCCc2cccc3[nH]ccc32)cc1[N+](=O)[O-] ZINC000502024206 942168494 /nfs/dbraw/zinc/16/84/94/942168494.db2.gz ROICVTZXVWGUDD-UHFFFAOYSA-N 0 0 355.419 3.771 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1n[nH]c(-c2ccc(C)o2)n1 ZINC000181888071 942175559 /nfs/dbraw/zinc/17/55/59/942175559.db2.gz FCNMIKXNXXTKTQ-UHFFFAOYSA-N 0 0 373.394 3.646 20 5 FHBDRN CCOc1ccc(C(=O)N(C)Cc2ccc(OC)c(C)c2)cc1[N+](=O)[O-] ZINC000103023188 942183399 /nfs/dbraw/zinc/18/33/99/942183399.db2.gz ZXPMVGDMSKUGQJ-UHFFFAOYSA-N 0 0 358.394 3.583 20 5 FHBDRN CC(=O)N1CCCc2cc(NC(=O)c3ccc(Cl)cc3[N+](=O)[O-])ccc21 ZINC000502045553 942185836 /nfs/dbraw/zinc/18/58/36/942185836.db2.gz FPZCTWBOEHKPBK-UHFFFAOYSA-N 0 0 373.796 3.800 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccnn1-c1cccc(Cl)c1 ZINC000103034362 942187340 /nfs/dbraw/zinc/18/73/40/942187340.db2.gz IFYJUBNKYGDVBK-UHFFFAOYSA-N 0 0 372.768 3.695 20 5 FHBDRN C[C@H](NC(=O)N1C[C@H](C)C[C@@H]1c1cccnc1)c1cccc([N+](=O)[O-])c1 ZINC000183156941 942192179 /nfs/dbraw/zinc/19/21/79/942192179.db2.gz SHOFAGZXVFKMPA-QWQRMKEZSA-N 0 0 354.410 3.844 20 5 FHBDRN O=C(Nc1cccc2ncccc21)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513728987 942209219 /nfs/dbraw/zinc/20/92/19/942209219.db2.gz CQMRBXKZZZFBIT-UHFFFAOYSA-N 0 0 359.288 3.997 20 5 FHBDRN CC(C)n1nccc1[C@H]1OCC[C@@H]1c1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000280588827 942210437 /nfs/dbraw/zinc/21/04/37/942210437.db2.gz NOXGRGLXBXQBES-HOCLYGCPSA-N 0 0 369.381 3.667 20 5 FHBDRN CCN(c1ccc(F)c(F)c1)S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-] ZINC000480932920 942211668 /nfs/dbraw/zinc/21/16/68/942211668.db2.gz IUQQTMFYFUBDAP-UHFFFAOYSA-N 0 0 370.377 3.705 20 5 FHBDRN CCC(=O)c1ccc(N2CCC(c3nncn3C(C)C)CC2)c([N+](=O)[O-])c1 ZINC000280647962 942220952 /nfs/dbraw/zinc/22/09/52/942220952.db2.gz FAXHDUCJNPLNPZ-UHFFFAOYSA-N 0 0 371.441 3.744 20 5 FHBDRN O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CCC(c2ccncn2)CC1 ZINC000413469153 942222852 /nfs/dbraw/zinc/22/28/52/942222852.db2.gz JMXVAFYYBZROMH-UHFFFAOYSA-N 0 0 352.316 3.788 20 5 FHBDRN C[C@@]1(CNC(=O)c2cc(Cl)ccc2[N+](=O)[O-])OCCc2sccc21 ZINC000290488218 942223711 /nfs/dbraw/zinc/22/37/11/942223711.db2.gz XFFNISKUYJIJII-INIZCTEOSA-N 0 0 366.826 3.528 20 5 FHBDRN CC(C)(C)Oc1cc(N2CCC(c3ccncn3)CC2)ccc1[N+](=O)[O-] ZINC000413476169 942233819 /nfs/dbraw/zinc/23/38/19/942233819.db2.gz ZPHSVTKDGSSRAA-UHFFFAOYSA-N 0 0 356.426 3.946 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N(C)Cc2ccc(Cl)s2)c1C ZINC000480961081 942237962 /nfs/dbraw/zinc/23/79/62/942237962.db2.gz NCCKSPGONDSKGI-UHFFFAOYSA-N 0 0 374.871 3.747 20 5 FHBDRN Cc1c(CNC(=O)NCc2cnccc2C(C)(C)C)cccc1[N+](=O)[O-] ZINC000413487852 942239765 /nfs/dbraw/zinc/23/97/65/942239765.db2.gz YSVZKLQAKIVHAC-UHFFFAOYSA-N 0 0 356.426 3.595 20 5 FHBDRN COC(=O)Nc1cccc(C(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)c1 ZINC000163858241 942246244 /nfs/dbraw/zinc/24/62/44/942246244.db2.gz QWALPIYNBFYCNY-UHFFFAOYSA-N 0 0 369.377 3.578 20 5 FHBDRN COc1ccc(CSCC(=O)N2[C@@H](C)CCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000103367138 942246852 /nfs/dbraw/zinc/24/68/52/942246852.db2.gz HWMZWHNCIYVAIH-STQMWFEESA-N 0 0 352.456 3.626 20 5 FHBDRN Cc1nn(Cc2ccc(C(=O)N3[C@H](C)CCC[C@H]3C)cc2)c(C)c1[N+](=O)[O-] ZINC000103369068 942246866 /nfs/dbraw/zinc/24/68/66/942246866.db2.gz PLHDPYBRGVPMSW-ZIAGYGMSSA-N 0 0 370.453 3.860 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)O[C@H](C)C(=O)Nc2ccccc2)c1 ZINC000016196554 942247922 /nfs/dbraw/zinc/24/79/22/942247922.db2.gz HURQITIMUKVVAX-LLVKDONJSA-N 0 0 360.391 3.501 20 5 FHBDRN COc1ccc(SCC(=O)N2c3ccc([N+](=O)[O-])cc3C[C@H]2C)cc1 ZINC000103377081 942248636 /nfs/dbraw/zinc/24/86/36/942248636.db2.gz FRKZUGXBFFDXKZ-GFCCVEGCSA-N 0 0 358.419 3.673 20 5 FHBDRN COc1cc(C(=O)Nc2cccc(C)c2Br)ccc1[N+](=O)[O-] ZINC000159044290 942249638 /nfs/dbraw/zinc/24/96/38/942249638.db2.gz CGHOWMVGEZXBCC-UHFFFAOYSA-N 0 0 365.183 3.927 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@@H](c1cccnc1)C(C)C ZINC000122837406 942252246 /nfs/dbraw/zinc/25/22/46/942252246.db2.gz VKESELVTWUVTNN-OAHLLOKOSA-N 0 0 358.398 3.560 20 5 FHBDRN O=[N+]([O-])c1ccc(N2C[C@H](O)C[C@H]2c2ccccc2)cc1OC(F)F ZINC000413494952 942255327 /nfs/dbraw/zinc/25/53/27/942255327.db2.gz AWVJSWXOYZPARH-HIFRSBDPSA-N 0 0 350.321 3.509 20 5 FHBDRN CC(C)N(C(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)C1CCCCC1 ZINC000103390330 942256614 /nfs/dbraw/zinc/25/66/14/942256614.db2.gz XYDSPRMEYMJQER-UHFFFAOYSA-N 0 0 356.426 3.964 20 5 FHBDRN CCc1cc(NC(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)ccc1C ZINC000480998458 942261085 /nfs/dbraw/zinc/26/10/85/942261085.db2.gz MEZLIXUPDRLKQD-UHFFFAOYSA-N 0 0 368.437 3.820 20 5 FHBDRN COCc1nc(CSCc2cc([N+](=O)[O-])ccc2C(F)(F)F)no1 ZINC000419456329 942261467 /nfs/dbraw/zinc/26/14/67/942261467.db2.gz SMCJEQGYJSUCFJ-UHFFFAOYSA-N 0 0 363.317 3.576 20 5 FHBDRN CCn1c(SCc2ccc(OC)c([N+](=O)[O-])c2)nnc1-c1cccnc1 ZINC000122849641 942264015 /nfs/dbraw/zinc/26/40/15/942264015.db2.gz ULGDJYAPHGWCDS-UHFFFAOYSA-N 0 0 371.422 3.569 20 5 FHBDRN O=C(Nc1cc2c(cc1Cl)OCCO2)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000413081642 942271555 /nfs/dbraw/zinc/27/15/55/942271555.db2.gz YAHXIHDICSCXDK-QWHCGFSZSA-N 0 0 374.780 3.762 20 5 FHBDRN CC(C)(C)OC(=O)c1cccc(CN2CCc3ncc([N+](=O)[O-])cc3C2)c1 ZINC000501032163 942277088 /nfs/dbraw/zinc/27/70/88/942277088.db2.gz LWUOEIFQVOUMIP-UHFFFAOYSA-N 0 0 369.421 3.503 20 5 FHBDRN O=[N+]([O-])c1cc(CN[C@H](CC(F)F)c2ccccc2)c2c(c1)COCO2 ZINC000420987203 942283282 /nfs/dbraw/zinc/28/32/82/942283282.db2.gz ONIAVLITTVEHNS-MRXNPFEDSA-N 0 0 364.348 3.947 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1F)N1CCC[C@@H]1Cc1cc(F)ccc1F ZINC000416042196 942287405 /nfs/dbraw/zinc/28/74/05/942287405.db2.gz FJOTTWYRDVJALT-CYBMUJFWSA-N 0 0 364.323 3.859 20 5 FHBDRN C[C@@H](OC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)C(=O)Nc1cccc(F)c1 ZINC000015644059 942291844 /nfs/dbraw/zinc/29/18/44/942291844.db2.gz BSVHBEBBRMKQSV-SECBINFHSA-N 0 0 366.732 3.571 20 5 FHBDRN C[C@@H]1CCCN(c2ccc(C(=O)N3CC[C@H](C4CC4)C3)cc2[N+](=O)[O-])C1 ZINC000481043058 942292748 /nfs/dbraw/zinc/29/27/48/942292748.db2.gz QXXBOWROKDBWNE-PBHICJAKSA-N 0 0 357.454 3.703 20 5 FHBDRN C[C@@H]1CSCCN(C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000501079576 942299079 /nfs/dbraw/zinc/29/90/79/942299079.db2.gz AOBLBVCOWQKGKK-VIFPVBQESA-N 0 0 374.260 3.574 20 5 FHBDRN O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1C[C@@H](O)C[C@@H]1c1ccccc1 ZINC000413512902 942299983 /nfs/dbraw/zinc/29/99/83/942299983.db2.gz YABCGRCTSXWABE-DZGCQCFKSA-N 0 0 352.312 3.926 20 5 FHBDRN O=[N+]([O-])c1ccc(N2C[C@H](O)C[C@@H]2c2ccccc2)cc1C(F)(F)F ZINC000413513018 942299988 /nfs/dbraw/zinc/29/99/88/942299988.db2.gz YFDBBXXEJQIIJX-CZUORRHYSA-N 0 0 352.312 3.926 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CSCc1ccn(CC(F)(F)F)n1 ZINC000419523245 942300760 /nfs/dbraw/zinc/30/07/60/942300760.db2.gz ARDBHVZHMKSWHT-UHFFFAOYSA-N 0 0 361.345 3.796 20 5 FHBDRN C[C@H](C(=O)N1CC[C@@H](c2cccc(F)c2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000584556386 942301180 /nfs/dbraw/zinc/30/11/80/942301180.db2.gz CACQYDWEJHHXCX-GXTWGEPZSA-N 0 0 360.360 3.993 20 5 FHBDRN C[C@H](c1cnn(C)c1)N(C)C(=O)Nc1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000501110378 942302870 /nfs/dbraw/zinc/30/28/70/942302870.db2.gz WPGGCUWNAWJSLD-GFCCVEGCSA-N 0 0 359.430 3.851 20 5 FHBDRN Cc1noc2nc(C)cc(C(=O)N(Cc3cccc([N+](=O)[O-])c3)C3CC3)c12 ZINC000163889832 942305174 /nfs/dbraw/zinc/30/51/74/942305174.db2.gz WKUCDVJNCDNIAF-UHFFFAOYSA-N 0 0 366.377 3.553 20 5 FHBDRN C[C@H]1CN(C)c2ccccc2N(C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)C1 ZINC000413522926 942309314 /nfs/dbraw/zinc/30/93/14/942309314.db2.gz SRKPZBNYLDBHJE-JCGIZDLHSA-N 0 0 365.433 3.817 20 5 FHBDRN CCn1cc(C2CCN(c3ccc([N+](=O)[O-])c4ncccc34)CC2)cn1 ZINC000413112937 942309642 /nfs/dbraw/zinc/30/96/42/942309642.db2.gz VWUYWRXOCZQXQV-UHFFFAOYSA-N 0 0 351.410 3.743 20 5 FHBDRN CC(C)(C)OC(=O)C1CCN(c2ccc([N+](=O)[O-])c3ncccc23)CC1 ZINC000413115873 942311037 /nfs/dbraw/zinc/31/10/37/942311037.db2.gz GTKCJMQGYKKODX-UHFFFAOYSA-N 0 0 357.410 3.701 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1COCc2ccccc21 ZINC000419554182 942311400 /nfs/dbraw/zinc/31/14/00/942311400.db2.gz GWKYGFVKOHYMKV-IBGZPJMESA-N 0 0 369.421 3.786 20 5 FHBDRN C[C@H](NC(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)c1ccc(C2CC2)cc1 ZINC000416071720 942318740 /nfs/dbraw/zinc/31/87/40/942318740.db2.gz XSNQADNFDDKSAH-LBPRGKRZSA-N 0 0 368.389 3.734 20 5 FHBDRN CCOc1cc(N2CC[C@]3(C2)CC(=O)c2ccccc2O3)ccc1[N+](=O)[O-] ZINC000413530921 942319059 /nfs/dbraw/zinc/31/90/59/942319059.db2.gz LLYVTJMGXWNQJG-HXUWFJFHSA-N 0 0 368.389 3.608 20 5 FHBDRN CC[C@@H](CC(=O)NCCc1ccccc1[N+](=O)[O-])c1ccc(OC)cc1 ZINC000501135955 942323670 /nfs/dbraw/zinc/32/36/70/942323670.db2.gz AIQVZAGKXQCIRI-HNNXBMFYSA-N 0 0 356.422 3.846 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCCOc1ccc(F)cc1F ZINC000085635010 942327165 /nfs/dbraw/zinc/32/71/65/942327165.db2.gz MVHUAIOCZRXATQ-UHFFFAOYSA-N 0 0 365.336 3.690 20 5 FHBDRN COc1ccc(C(=O)N2CC[C@](F)(c3ccccc3C)C2)cc1[N+](=O)[O-] ZINC000501160753 942331233 /nfs/dbraw/zinc/33/12/33/942331233.db2.gz AVURRZSCPDVNGK-LJQANCHMSA-N 0 0 358.369 3.623 20 5 FHBDRN O=C(COc1ccc(F)c(Br)c1)c1cccc([N+](=O)[O-])c1 ZINC000137052891 942334704 /nfs/dbraw/zinc/33/47/04/942334704.db2.gz XWTGGXGPLCVVRH-UHFFFAOYSA-N 0 0 354.131 3.758 20 5 FHBDRN CC[C@@H]1C[C@H](NC(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CCO1 ZINC000421085764 942338004 /nfs/dbraw/zinc/33/80/04/942338004.db2.gz IPRFBRJXDMSLNT-GHMZBOCLSA-N 0 0 361.320 3.693 20 5 FHBDRN CC(C)NC(=O)[C@H]1CCC[C@@H](Nc2ccc([N+](=O)[O-])c3ncccc23)C1 ZINC000413138999 942338122 /nfs/dbraw/zinc/33/81/22/942338122.db2.gz DKINHDMOHYDZQO-UONOGXRCSA-N 0 0 356.426 3.638 20 5 FHBDRN C[C@@H](OC(=O)c1ccc([N+](=O)[O-])cc1Cl)C(=O)Nc1cccc(F)c1 ZINC000015709966 942340091 /nfs/dbraw/zinc/34/00/91/942340091.db2.gz KYDHIMHGWCNVHM-SECBINFHSA-N 0 0 366.732 3.571 20 5 FHBDRN CCCc1nc(C)c(C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)o1 ZINC000513741113 942341070 /nfs/dbraw/zinc/34/10/70/942341070.db2.gz FZWQXVIYLHZEJB-UHFFFAOYSA-N 0 0 368.187 3.859 20 5 FHBDRN CN(Cc1cc([N+](=O)[O-])ccc1Cl)C[C@H](O)c1ccc(F)c(F)c1 ZINC000051287065 942344160 /nfs/dbraw/zinc/34/41/60/942344160.db2.gz XGUNLJCBTMJJQM-INIZCTEOSA-N 0 0 356.756 3.692 20 5 FHBDRN Cc1ccccc1[C@@]1(F)CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000501221252 942350425 /nfs/dbraw/zinc/35/04/25/942350425.db2.gz IISLDZJHYZBOJN-LJQANCHMSA-N 0 0 360.360 3.682 20 5 FHBDRN COCCCCN(C)C(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000416103725 942350894 /nfs/dbraw/zinc/35/08/94/942350894.db2.gz QKTDZQXHCZHZDL-UHFFFAOYSA-N 0 0 371.437 3.706 20 5 FHBDRN CC(C)[C@H]1N(C(=O)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)CC12CCOCC2 ZINC000413566107 942353239 /nfs/dbraw/zinc/35/32/39/942353239.db2.gz IHQOLDCRFDPAMZ-WMLDXEAASA-N 0 0 361.442 3.502 20 5 FHBDRN O=C(NC[C@@H](Cc1ccccc1)C(F)(F)F)c1ccccc1[N+](=O)[O-] ZINC000584560791 942359083 /nfs/dbraw/zinc/35/90/83/942359083.db2.gz BWWBAJQOIMNGRQ-CYBMUJFWSA-N 0 0 352.312 3.746 20 5 FHBDRN Cc1ccc(C(=O)Nc2cc(F)ccc2OC[C@@H]2CCCO2)cc1[N+](=O)[O-] ZINC000502330588 942364277 /nfs/dbraw/zinc/36/42/77/942364277.db2.gz GEOXXEOQKRXTDP-HNNXBMFYSA-N 0 0 374.368 3.852 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)Nc1ccc(C)c(NC(C)=O)c1 ZINC000502334975 942366664 /nfs/dbraw/zinc/36/66/64/942366664.db2.gz UPUHLLNIOQQVJH-UHFFFAOYSA-N 0 0 358.354 3.514 20 5 FHBDRN COc1cccc([C@@H]2C[C@H]2CNc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)c1 ZINC000413578083 942371389 /nfs/dbraw/zinc/37/13/89/942371389.db2.gz SHMQKHRPYFYBID-HOCLYGCPSA-N 0 0 367.405 3.704 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1NCc1nnc(C2CC2)s1 ZINC000413581425 942375629 /nfs/dbraw/zinc/37/56/29/942375629.db2.gz MVPUGISJZDKOCS-UHFFFAOYSA-N 0 0 355.217 3.698 20 5 FHBDRN Cc1cc(F)cc2c1CN(C(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1)CC2 ZINC000501273062 942376153 /nfs/dbraw/zinc/37/61/53/942376153.db2.gz GRVUKZOMIVBMHS-UHFFFAOYSA-N 0 0 356.397 3.905 20 5 FHBDRN Cc1ccc(NC(=O)C(=O)N(C)[C@H]2CCC[C@H]2C(C)(C)C)cc1[N+](=O)[O-] ZINC000419794402 942382339 /nfs/dbraw/zinc/38/23/39/942382339.db2.gz LBDFMFGZUUMEDE-CABCVRRESA-N 0 0 361.442 3.515 20 5 FHBDRN Cc1ccc(NC(=O)C(=O)N(C)[C@@H]2CCC[C@H]2C(C)(C)C)cc1[N+](=O)[O-] ZINC000419794407 942382555 /nfs/dbraw/zinc/38/25/55/942382555.db2.gz LBDFMFGZUUMEDE-HUUCEWRRSA-N 0 0 361.442 3.515 20 5 FHBDRN O=C(NC1CC1)c1ccc(N2CC[C@H](c3ccccc3F)C2)c([N+](=O)[O-])c1 ZINC000501287360 942390833 /nfs/dbraw/zinc/39/08/33/942390833.db2.gz XLQRBVIPQUSTHN-AWEZNQCLSA-N 0 0 369.396 3.620 20 5 FHBDRN O=C(Nc1cc(Br)cc([N+](=O)[O-])c1)c1cccc2nccnc21 ZINC000501291007 942394556 /nfs/dbraw/zinc/39/45/56/942394556.db2.gz SYEVWVDWTSCQJF-UHFFFAOYSA-N 0 0 373.166 3.553 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1ccc(OC2CCCC2)nc1 ZINC000513710959 942398430 /nfs/dbraw/zinc/39/84/30/942398430.db2.gz ZXVLXGIFRVNSKY-UHFFFAOYSA-N 0 0 355.394 3.583 20 5 FHBDRN CCc1ncsc1C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000501304140 942402537 /nfs/dbraw/zinc/40/25/37/942402537.db2.gz DLYPXPNWCFHEKB-UHFFFAOYSA-N 0 0 356.201 3.629 20 5 FHBDRN C[C@@]1(F)CCN(C(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)C1 ZINC000501340928 942410000 /nfs/dbraw/zinc/41/00/00/942410000.db2.gz AOTZYACRXZZCNS-LJQANCHMSA-N 0 0 357.385 3.781 20 5 FHBDRN CCOC(=O)/C=C/c1ccc(NC(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000016303972 942410980 /nfs/dbraw/zinc/41/09/80/942410980.db2.gz KNTWVAHNBJDCHF-YRNVUSSQSA-N 0 0 354.362 3.732 20 5 FHBDRN C[C@H](CCc1ccc(O)cc1)NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000413625333 942431468 /nfs/dbraw/zinc/43/14/68/942431468.db2.gz NKXCSYDDSRFNMP-ZNZDAUKMSA-N 0 0 354.406 3.541 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CCC[C@H]2[C@H]2CCCCC2=O)ccc1[N+](=O)[O-] ZINC000413612016 942438939 /nfs/dbraw/zinc/43/89/39/942438939.db2.gz SXXGZFNZIKAMRQ-CVEARBPZSA-N 0 0 374.437 3.746 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CCc3ccc(F)c(F)c3C2)c(C(F)(F)F)c1 ZINC000413188756 942439132 /nfs/dbraw/zinc/43/91/32/942439132.db2.gz AIMWRMDXNXMXNY-UHFFFAOYSA-N 0 0 359.254 3.850 20 5 FHBDRN Cc1cccc(OC[C@@H](C)NC(=O)CSc2ccc([N+](=O)[O-])cc2)c1 ZINC000054165205 942447989 /nfs/dbraw/zinc/44/79/89/942447989.db2.gz OMZDAVAQCAKYCW-CQSZACIVSA-N 0 0 360.435 3.579 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1-c1nc(C[C@@H]2COc3ccccc3O2)no1 ZINC000421260030 942449147 /nfs/dbraw/zinc/44/91/47/942449147.db2.gz IQLDUUNQTUSGMR-CYBMUJFWSA-N 0 0 367.361 3.644 20 5 FHBDRN C[C@H](Nc1ncc([N+](=O)[O-])cc1C(F)(F)F)c1ccc([S@](C)=O)cc1 ZINC000413199050 942455905 /nfs/dbraw/zinc/45/59/05/942455905.db2.gz IIBSIESGNDWIJQ-USOBGDSLSA-N 0 0 373.356 3.919 20 5 FHBDRN CC(C)[C@@H](NS(=O)(=O)c1ccccc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000014099916 942458450 /nfs/dbraw/zinc/45/84/50/942458450.db2.gz ANWOUBKGMYVQCY-MRXNPFEDSA-N 0 0 368.842 3.924 20 5 FHBDRN CCS[C@@H](C)c1noc(CN(C)c2ccc([N+](=O)[O-])c3ncccc23)n1 ZINC000413192335 942459055 /nfs/dbraw/zinc/45/90/55/942459055.db2.gz INFJXMCXMSFGJJ-NSHDSACASA-N 0 0 373.438 3.977 20 5 FHBDRN COc1cccc([C@H]2CN(c3nccc4ccc([N+](=O)[O-])cc43)CCO2)c1 ZINC000413192866 942459176 /nfs/dbraw/zinc/45/91/76/942459176.db2.gz JPGJMPQSIFPCHR-LJQANCHMSA-N 0 0 365.389 3.730 20 5 FHBDRN COc1cccc([C@@H]2CN(c3ccc([N+](=O)[O-])c4ncccc34)CCO2)c1 ZINC000413194784 942459704 /nfs/dbraw/zinc/45/97/04/942459704.db2.gz MAVRDHSGHVZTFK-IBGZPJMESA-N 0 0 365.389 3.730 20 5 FHBDRN O=[N+]([O-])c1cnc(NCc2ccn(C3CCCC3)n2)c(C(F)(F)F)c1 ZINC000413196796 942460635 /nfs/dbraw/zinc/46/06/35/942460635.db2.gz FVXMINIHDUCSOB-UHFFFAOYSA-N 0 0 355.320 3.932 20 5 FHBDRN C[C@H](NC(=O)c1ccc(N2CCC[C@@H](C)C2)c([N+](=O)[O-])c1)C(F)(F)F ZINC000424952276 942466095 /nfs/dbraw/zinc/46/60/95/942466095.db2.gz NZCUZAMUJKAQAF-MNOVXSKESA-N 0 0 359.348 3.512 20 5 FHBDRN COc1cc(C(=O)N2CCC=C(c3ccccc3)C2)c([N+](=O)[O-])cc1OC ZINC000501420328 942466610 /nfs/dbraw/zinc/46/66/10/942466610.db2.gz SWEMPWXZFIMSFI-UHFFFAOYSA-N 0 0 368.389 3.542 20 5 FHBDRN O=C(c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)N1CCC=C(c2ccccc2)C1 ZINC000501419716 942467724 /nfs/dbraw/zinc/46/77/24/942467724.db2.gz IIOLYVQLTPETOJ-UHFFFAOYSA-N 0 0 374.400 3.710 20 5 FHBDRN C[C@H](NC(=O)COc1ccc([N+](=O)[O-])c2cccnc12)C1CCCCC1 ZINC000424988939 942476046 /nfs/dbraw/zinc/47/60/46/942476046.db2.gz BPBPNYNWURXOTN-ZDUSSCGKSA-N 0 0 357.410 3.607 20 5 FHBDRN COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N[C@@H]2CC23CC3)cc1 ZINC000424993435 942477396 /nfs/dbraw/zinc/47/73/96/942477396.db2.gz WYMLPWNWHJZCNL-QGZVFWFLSA-N 0 0 354.362 3.678 20 5 FHBDRN CN(Cc1cn(C)nc1C(F)(F)F)c1nccc2ccc([N+](=O)[O-])cc21 ZINC000413209384 942478730 /nfs/dbraw/zinc/47/87/30/942478730.db2.gz UCZAQPREHWHHNB-UHFFFAOYSA-N 0 0 365.315 3.532 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc([C@H]2CCCOC2)cc1 ZINC000502499660 942479700 /nfs/dbraw/zinc/47/97/00/942479700.db2.gz GKOUKDHZMLAATE-HNNXBMFYSA-N 0 0 356.378 3.750 20 5 FHBDRN COc1cc(CNc2ccccc2C(=O)N2CCCC2)c([N+](=O)[O-])cc1F ZINC000184002325 942480339 /nfs/dbraw/zinc/48/03/39/942480339.db2.gz BVZJGPZXQHTBBG-UHFFFAOYSA-N 0 0 373.384 3.591 20 5 FHBDRN Cc1nnc(Sc2ncc([N+](=O)[O-])cc2F)n1[C@H]1CCC[C@@H](C)C1 ZINC000413214794 942489171 /nfs/dbraw/zinc/48/91/71/942489171.db2.gz WQAHINATVBUSTG-KOLCDFICSA-N 0 0 351.407 3.931 20 5 FHBDRN CCCN(C(=O)c1ccc([N+](=O)[O-])c(C)c1)[C@@H](C)C(=O)Nc1ccccc1 ZINC000502496403 942490282 /nfs/dbraw/zinc/49/02/82/942490282.db2.gz TYFAVORMVRKUCY-HNNXBMFYSA-N 0 0 369.421 3.783 20 5 FHBDRN C[C@H]1C[C@H](CO)C[N@H+](Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)C1 ZINC000421361028 942513807 /nfs/dbraw/zinc/51/38/07/942513807.db2.gz KCDPSHXHKFNLCI-HOCLYGCPSA-N 0 0 374.412 3.977 20 5 FHBDRN Cn1ccnc1[C@H](NC[C@H]1CC12CCSCC2)c1cccc([N+](=O)[O-])c1 ZINC000421375364 942526562 /nfs/dbraw/zinc/52/65/62/942526562.db2.gz IMHQIFUOUCTJCP-NVXWUHKLSA-N 0 0 372.494 3.541 20 5 FHBDRN O=[N+]([O-])c1cccc2c1CCCN2S(=O)(=O)c1cccc(Cl)c1F ZINC000513814208 942532416 /nfs/dbraw/zinc/53/24/16/942532416.db2.gz UMVWLFRGIOHRPH-UHFFFAOYSA-N 0 0 370.789 3.529 20 5 FHBDRN Cc1ccccc1C[C@H](C)NC(=O)CSCc1ccc([N+](=O)[O-])cc1 ZINC000513814512 942533815 /nfs/dbraw/zinc/53/38/15/942533815.db2.gz AGYZVAJEEIUSDU-HNNXBMFYSA-N 0 0 358.463 3.884 20 5 FHBDRN Cc1cccc(OCCNC(=O)[C@H](C)SCc2ccc([N+](=O)[O-])cc2)c1 ZINC000513816351 942534294 /nfs/dbraw/zinc/53/42/94/942534294.db2.gz MCHCCVHEUJTSTA-HNNXBMFYSA-N 0 0 374.462 3.720 20 5 FHBDRN Cc1cccc(OCCNC(=O)[C@@H](C)SCc2ccc([N+](=O)[O-])cc2)c1 ZINC000513816352 942534387 /nfs/dbraw/zinc/53/43/87/942534387.db2.gz MCHCCVHEUJTSTA-OAHLLOKOSA-N 0 0 374.462 3.720 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N[C@@H]2CCCC[C@@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000434228870 942534976 /nfs/dbraw/zinc/53/49/76/942534976.db2.gz PRDFDAVRSYNQCZ-HUUCEWRRSA-N 0 0 356.426 3.898 20 5 FHBDRN Cc1cn(C2CCCCC2)nc1NC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000434230348 942535213 /nfs/dbraw/zinc/53/52/13/942535213.db2.gz YPBYBFOLGHAJEW-UHFFFAOYSA-N 0 0 357.414 3.979 20 5 FHBDRN Cc1ccccc1CCNC(=O)[C@H](C)SCc1ccc([N+](=O)[O-])cc1 ZINC000513820162 942537852 /nfs/dbraw/zinc/53/78/52/942537852.db2.gz KHNLJCVVCRMJEP-HNNXBMFYSA-N 0 0 358.463 3.884 20 5 FHBDRN O=[N+]([O-])c1ccc2ccnc(NCc3nnc(C4CC4)n3C3CC3)c2c1 ZINC000413232701 942537966 /nfs/dbraw/zinc/53/79/66/942537966.db2.gz NABCTCCXEYYKQU-UHFFFAOYSA-N 0 0 350.382 3.559 20 5 FHBDRN CC[C@H](NC(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-])C(C)(C)c1ccccc1 ZINC000434244283 942544153 /nfs/dbraw/zinc/54/41/53/942544153.db2.gz RNLQSYGBLUBPCT-AWEZNQCLSA-N 0 0 358.442 3.928 20 5 FHBDRN C[C@H]1CCN(C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)c2c(O)cccc21 ZINC000413716771 942544567 /nfs/dbraw/zinc/54/45/67/942544567.db2.gz UYESGLAIALGWEI-AFAVFJNCSA-N 0 0 352.390 3.944 20 5 FHBDRN CCS[C@H]1CCC[C@H](NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000120220119 942546494 /nfs/dbraw/zinc/54/64/94/942546494.db2.gz PCETXZWVFIEZBB-ZFWWWQNUSA-N 0 0 361.467 3.799 20 5 FHBDRN CCOc1cccc([C@H]2C[C@H]2NC(=O)CSc2ccccc2[N+](=O)[O-])c1 ZINC000541269872 942547030 /nfs/dbraw/zinc/54/70/30/942547030.db2.gz AKKCVSGDVNYXEU-HZPDHXFCSA-N 0 0 372.446 3.758 20 5 FHBDRN CO[C@H](C)C(=O)Nc1cccc(NC(=O)Nc2cc([N+](=O)[O-])ccc2C)c1 ZINC000502587541 942550803 /nfs/dbraw/zinc/55/08/03/942550803.db2.gz ILXXCVXEXJWHCQ-GFCCVEGCSA-N 0 0 372.381 3.521 20 5 FHBDRN CC(C)OC(=O)C[C@H](NC(=O)[C@@H]1CC[C@H]2C[C@H]2C1)c1ccccc1[N+](=O)[O-] ZINC000421421309 942551583 /nfs/dbraw/zinc/55/15/83/942551583.db2.gz MWMQZVZBKADOAH-IVSAIRAKSA-N 0 0 374.437 3.530 20 5 FHBDRN Cn1cc(CCC(=O)N2CCCc3c([N+](=O)[O-])cccc32)c2ccccc21 ZINC000513840206 942552295 /nfs/dbraw/zinc/55/22/95/942552295.db2.gz YUKMUAGUNQQXHH-UHFFFAOYSA-N 0 0 363.417 3.999 20 5 FHBDRN Cc1n[nH]c(C)c1[C@@H]1CCCN1C(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000183562320 942554271 /nfs/dbraw/zinc/55/42/71/942554271.db2.gz SBQXAZKULUHEEM-QFYYESIMSA-N 0 0 360.389 3.541 20 5 FHBDRN Cc1n[nH]c(C)c1[C@@H]1CCCN1C(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000183562356 942554490 /nfs/dbraw/zinc/55/44/90/942554490.db2.gz SBQXAZKULUHEEM-HWPZZCPQSA-N 0 0 360.389 3.541 20 5 FHBDRN CC(C)c1nccc(C2CCN(C(=O)Nc3cccc([N+](=O)[O-])c3)CC2)n1 ZINC000378301057 942555578 /nfs/dbraw/zinc/55/55/78/942555578.db2.gz FHLZXACIXXUDSW-UHFFFAOYSA-N 0 0 369.425 3.920 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N1CCC[C@@H]1c1cccnc1 ZINC000366544711 942556312 /nfs/dbraw/zinc/55/63/12/942556312.db2.gz FXBLDVKJEUQJSO-OAHLLOKOSA-N 0 0 365.311 3.986 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CCO[C@@H](c3ccc(C(F)(F)F)cc3)C2)c(F)c1 ZINC000413243956 942558837 /nfs/dbraw/zinc/55/88/37/942558837.db2.gz MGVWBSDDSFUJQW-CQSZACIVSA-N 0 0 371.290 3.726 20 5 FHBDRN C[C@H](NC(=O)CSc1ccccc1[N+](=O)[O-])[C@H]1Oc2ccccc2[C@@H]1C ZINC000541301351 942562809 /nfs/dbraw/zinc/56/28/09/942562809.db2.gz TWELCWJMOIKVEW-JMERFSKESA-N 0 0 372.446 3.756 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC(OC2CCC2)CC1 ZINC000416257779 942563905 /nfs/dbraw/zinc/56/39/05/942563905.db2.gz KEZBCLQITFJAFA-INIZCTEOSA-N 0 0 360.454 3.724 20 5 FHBDRN COc1ccc(CCCN(C)C(=O)c2cc([N+](=O)[O-])c(C)cc2C)cc1 ZINC000421453866 942565438 /nfs/dbraw/zinc/56/54/38/942565438.db2.gz VODIGOLMTKRWHE-UHFFFAOYSA-N 0 0 356.422 3.925 20 5 FHBDRN COc1ccc2c(c1)CCN(c1ncc([N+](=O)[O-])cc1C(F)(F)F)CC2 ZINC000413254415 942567868 /nfs/dbraw/zinc/56/78/68/942567868.db2.gz CNLPXLZJZCMDPI-UHFFFAOYSA-N 0 0 367.327 3.622 20 5 FHBDRN C[C@@H](CNC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)COCc1ccccc1 ZINC000501613192 942574947 /nfs/dbraw/zinc/57/49/47/942574947.db2.gz BNENAKFSVKNYJD-AWEZNQCLSA-N 0 0 367.405 3.659 20 5 FHBDRN CN(C)c1ccc(COC(=O)c2ccc(F)c3occc32)cc1[N+](=O)[O-] ZINC001268941147 942575054 /nfs/dbraw/zinc/57/50/54/942575054.db2.gz JTHHBUIYKBXBMU-UHFFFAOYSA-N 0 0 358.325 3.903 20 5 FHBDRN COc1cc(C(=O)Nc2cnn(CC(C)C)c2C(C)C)ccc1[N+](=O)[O-] ZINC000501619492 942577822 /nfs/dbraw/zinc/57/78/22/942577822.db2.gz PSBYSBMUYPPRIZ-UHFFFAOYSA-N 0 0 360.414 3.832 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NC[C@H](c1ccco1)N1CCCCC1 ZINC000421462864 942583195 /nfs/dbraw/zinc/58/31/95/942583195.db2.gz YWPDLHZRLZJTPQ-GOSISDBHSA-N 0 0 371.437 3.762 20 5 FHBDRN COCCn1nc(C)c(NCc2ccc(-c3ccccc3[N+](=O)[O-])o2)c1C ZINC000183294755 942584243 /nfs/dbraw/zinc/58/42/43/942584243.db2.gz QWMRJCONSNOFLR-UHFFFAOYSA-N 0 0 370.409 3.927 20 5 FHBDRN C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCN2c2ccc([N+](=O)[O-])c3ncccc32)C1 ZINC000413266167 942584610 /nfs/dbraw/zinc/58/46/10/942584610.db2.gz KAVSSUOFBRUYOE-DEWZPKMOSA-N 0 0 355.438 3.909 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)NC[C@]1(C)C[C@H]1c1ccccc1 ZINC000501642953 942585345 /nfs/dbraw/zinc/58/53/45/942585345.db2.gz TVYZJLDTQIZDBA-YWZLYKJASA-N 0 0 354.406 3.917 20 5 FHBDRN O=[N+]([O-])c1ccc2ccnc(NC[C@]3(CO)C[C@H]3c3ccc(F)cc3)c2c1 ZINC000413268108 942585780 /nfs/dbraw/zinc/58/57/80/942585780.db2.gz RLRGDEXREPCNMJ-ICSRJNTNSA-N 0 0 367.380 3.860 20 5 FHBDRN Cc1c2ccccc2sc1[C@@H](C)NC(=O)CCn1cc([N+](=O)[O-])cn1 ZINC001267747586 942586582 /nfs/dbraw/zinc/58/65/82/942586582.db2.gz GHFRUVUDTIIDDK-GFCCVEGCSA-N 0 0 358.423 3.582 20 5 FHBDRN C[C@H](NC(=O)Nc1ccncc1[N+](=O)[O-])c1ncc(-c2ccccc2)o1 ZINC000183568222 942590315 /nfs/dbraw/zinc/59/03/15/942590315.db2.gz HOUAUZDDEKHJIF-NSHDSACASA-N 0 0 353.338 3.528 20 5 FHBDRN C[C@@H](NC(=O)Nc1ccncc1[N+](=O)[O-])c1ncc(-c2ccccc2)o1 ZINC000183568242 942590455 /nfs/dbraw/zinc/59/04/55/942590455.db2.gz HOUAUZDDEKHJIF-LLVKDONJSA-N 0 0 353.338 3.528 20 5 FHBDRN O=C(Nc1ccc(-c2ccccn2)cn1)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000378331541 942593265 /nfs/dbraw/zinc/59/32/65/942593265.db2.gz JAQALNBAVQAGQK-UHFFFAOYSA-N 0 0 371.356 3.852 20 5 FHBDRN CCOC(=O)CN(C(=O)c1cc([N+](=O)[O-])c(C)cc1C)c1ccc(F)cc1 ZINC000421453004 942594505 /nfs/dbraw/zinc/59/45/05/942594505.db2.gz ULJFJQHSEHMHSK-UHFFFAOYSA-N 0 0 374.368 3.561 20 5 FHBDRN C[C@H]1CCCC[C@@H]1OCCNC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513719377 942595185 /nfs/dbraw/zinc/59/51/85/942595185.db2.gz BSGMIOVCNRKAEW-FZMZJTMJSA-N 0 0 372.368 3.521 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CC[C@H](COCc2ccccc2)C1 ZINC000421487306 942602649 /nfs/dbraw/zinc/60/26/49/942602649.db2.gz YOQTUGRYDQMFSB-SFHVURJKSA-N 0 0 368.433 3.891 20 5 FHBDRN O=[N+]([O-])c1cnc(N[C@H](c2cncc(Br)c2)C2CC2)c(F)c1 ZINC000413284853 942604489 /nfs/dbraw/zinc/60/44/89/942604489.db2.gz BOZWRNHBVLWRQK-ZDUSSCGKSA-N 0 0 367.178 3.850 20 5 FHBDRN CCc1ccccc1NC(=O)Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1 ZINC000501676611 942605442 /nfs/dbraw/zinc/60/54/42/942605442.db2.gz QURSPXDHTIOMMC-UHFFFAOYSA-N 0 0 350.378 3.659 20 5 FHBDRN Cc1cc(C)cc(NC(=O)Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)c1 ZINC000501677544 942606258 /nfs/dbraw/zinc/60/62/58/942606258.db2.gz VGFKMLXTSJCOOT-UHFFFAOYSA-N 0 0 350.378 3.714 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N[C@@H](c1ccccc1)[C@@H]1CCOC1 ZINC000421499839 942610948 /nfs/dbraw/zinc/61/09/48/942610948.db2.gz BHDKCDXVKJRSHI-APWZRJJASA-N 0 0 354.406 3.719 20 5 FHBDRN CC(C)(C)Oc1cccc(CNC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)n1 ZINC000502654800 942620805 /nfs/dbraw/zinc/62/08/05/942620805.db2.gz NCAZCHRBVSOSHY-UHFFFAOYSA-N 0 0 368.393 3.578 20 5 FHBDRN O=C(CCC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1)c1cccc(F)c1 ZINC000502657626 942622794 /nfs/dbraw/zinc/62/27/94/942622794.db2.gz WWTCYQKNKKXKEP-UHFFFAOYSA-N 0 0 370.380 3.888 20 5 FHBDRN CN(C(=O)[C@]1(C)CC1(F)F)c1nc(-c2ccccc2[N+](=O)[O-])cs1 ZINC000421504325 942630273 /nfs/dbraw/zinc/63/02/73/942630273.db2.gz HISNVYPQWVOTSR-AWEZNQCLSA-N 0 0 353.350 3.726 20 5 FHBDRN COc1ccc(CNC(=O)c2sc(C(C)(C)C)nc2C)cc1[N+](=O)[O-] ZINC000501705633 942630459 /nfs/dbraw/zinc/63/04/59/942630459.db2.gz WQUPVWOONBQJCR-UHFFFAOYSA-N 0 0 363.439 3.596 20 5 FHBDRN CC(C)Nc1ccc([N+](=O)[O-])cc1NC(=O)[C@H]1Oc2ccccc2O[C@H]1C ZINC000413829396 942650431 /nfs/dbraw/zinc/65/04/31/942650431.db2.gz CDMAXINLRSRXHH-SGTLLEGYSA-N 0 0 371.393 3.582 20 5 FHBDRN CO[C@H](CNc1ncc([N+](=O)[O-])cc1C(F)(F)F)Cc1ccccc1 ZINC000413320428 942658876 /nfs/dbraw/zinc/65/88/76/942658876.db2.gz DVYPLDNIFHKVRD-ZDUSSCGKSA-N 0 0 355.316 3.678 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CC(c3ccccc3F)C2)ccc1[N+](=O)[O-] ZINC000412354233 942661745 /nfs/dbraw/zinc/66/17/45/942661745.db2.gz JLGARTNOMLHYHQ-UHFFFAOYSA-N 0 0 358.369 3.761 20 5 FHBDRN CCOc1cc(NC(=O)N(C)[C@@H](C)C(C)C)c([N+](=O)[O-])cc1OCC ZINC000501759302 942662804 /nfs/dbraw/zinc/66/28/04/942662804.db2.gz NMCCXKDLYGCENL-LBPRGKRZSA-N 0 0 353.419 3.900 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CCOCC23CCCCC3)ccc1[N+](=O)[O-] ZINC000413843451 942664230 /nfs/dbraw/zinc/66/42/30/942664230.db2.gz JMWFIXJGYXSKIQ-UHFFFAOYSA-N 0 0 362.426 3.557 20 5 FHBDRN CC(=O)N(c1ccc(NC(=O)c2cc([N+](=O)[O-])c(C)cc2C)cc1)C1CC1 ZINC000421572056 942665054 /nfs/dbraw/zinc/66/50/54/942665054.db2.gz AZXPCJDVOSNVOO-UHFFFAOYSA-N 0 0 367.405 3.979 20 5 FHBDRN Cc1cc(CNC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])cc(C)n1 ZINC000421575769 942666500 /nfs/dbraw/zinc/66/65/00/942666500.db2.gz KWSPKOLYROHJPS-UHFFFAOYSA-N 0 0 365.842 3.669 20 5 FHBDRN COc1ccc([C@H](NC(=O)NCCc2ccc([N+](=O)[O-])cc2)C(C)C)cc1 ZINC000514015607 942671943 /nfs/dbraw/zinc/67/19/43/942671943.db2.gz MPZAXGFEZDAGQU-LJQANCHMSA-N 0 0 371.437 3.842 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2CC[C@@H](c3ccccc3C)C2)c1 ZINC000513721862 942675902 /nfs/dbraw/zinc/67/59/02/942675902.db2.gz BYGQEJULXKFYKM-QGZVFWFLSA-N 0 0 368.433 3.997 20 5 FHBDRN CCCCc1c(C)nc2nc(Sc3ccncc3[N+](=O)[O-])nn2c1C ZINC000066809942 942679450 /nfs/dbraw/zinc/67/94/50/942679450.db2.gz AZUOTBLIQNRLQM-UHFFFAOYSA-N 0 0 358.427 3.538 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H]2CC23CCSCC3)c1 ZINC000421591124 942686715 /nfs/dbraw/zinc/68/67/15/942686715.db2.gz OWNFTOBTRSJRMJ-NSHDSACASA-N 0 0 352.481 3.580 20 5 FHBDRN CCOc1ccc([C@@H](C)NC(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1OC ZINC000501819035 942687367 /nfs/dbraw/zinc/68/73/67/942687367.db2.gz QIDATQMIFVQAIO-CYBMUJFWSA-N 0 0 358.394 3.802 20 5 FHBDRN C[C@H](c1ccccc1)[C@H](C)NC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000473540303 942687652 /nfs/dbraw/zinc/68/76/52/942687652.db2.gz GSUQBVOYWAJGDT-GJZGRUSLSA-N 0 0 351.406 3.858 20 5 FHBDRN Cc1cc(Cc2noc([C@@H]3CCc4ccccc4O3)n2)ccc1[N+](=O)[O-] ZINC000420486217 942691690 /nfs/dbraw/zinc/69/16/90/942691690.db2.gz DLYHMOGAGPBNGA-KRWDZBQOSA-N 0 0 351.362 3.943 20 5 FHBDRN COC1(c2noc(-c3ccnc(-c4ccccc4)c3[N+](=O)[O-])n2)CCC1 ZINC000420489686 942693495 /nfs/dbraw/zinc/69/34/95/942693495.db2.gz GVOUGEKUGWARBY-UHFFFAOYSA-N 0 0 352.350 3.732 20 5 FHBDRN Cc1ccc(C(=O)N2CCC(Nc3ccc(F)cc3[N+](=O)[O-])CC2)cc1 ZINC000066813105 942693569 /nfs/dbraw/zinc/69/35/69/942693569.db2.gz NELOAQUNVPZSDN-UHFFFAOYSA-N 0 0 357.385 3.759 20 5 FHBDRN COC1CCC(Cc2noc([C@@H]3C[C@H]3c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000420489629 942693780 /nfs/dbraw/zinc/69/37/80/942693780.db2.gz GHMIUSIRPIBPPK-XEXHBRLRSA-N 0 0 357.410 3.997 20 5 FHBDRN CN(Cc1cccc(C(F)(F)F)c1)C(=O)COc1cccc([N+](=O)[O-])c1 ZINC000502742464 942694964 /nfs/dbraw/zinc/69/49/64/942694964.db2.gz VIKBOYVMSPRGOF-UHFFFAOYSA-N 0 0 368.311 3.651 20 5 FHBDRN COc1ccc(Oc2cc(CNc3ccncc3[N+](=O)[O-])ccn2)cc1 ZINC000066809548 942701394 /nfs/dbraw/zinc/70/13/94/942701394.db2.gz OHRPLHNXVFIQEP-UHFFFAOYSA-N 0 0 352.350 3.798 20 5 FHBDRN COc1cccc(C(=O)N2CCC[C@]2(C)Cc2ccc(F)cc2)c1[N+](=O)[O-] ZINC000421616158 942701737 /nfs/dbraw/zinc/70/17/37/942701737.db2.gz AJLMNZILJLRWTA-HXUWFJFHSA-N 0 0 372.396 3.980 20 5 FHBDRN O=C(/C=C/c1ccc([N+](=O)[O-])cc1)N[C@H](c1ccccc1)[C@H]1CCOC1 ZINC000378394618 942703650 /nfs/dbraw/zinc/70/36/50/942703650.db2.gz YJVZFMJCHHJPMY-ZNPHBUKXSA-N 0 0 352.390 3.502 20 5 FHBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)c1c[nH]c2cc(F)ccc12 ZINC000434490328 942709481 /nfs/dbraw/zinc/70/94/81/942709481.db2.gz CLQAIYKXEQVNKX-UHFFFAOYSA-N 0 0 355.369 3.968 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N1CCC[C@H](C[C@@H]2CCOC2)C1 ZINC000378397433 942714890 /nfs/dbraw/zinc/71/48/90/942714890.db2.gz FRLHAQLHJIQDBG-OLZOCXBDSA-N 0 0 367.833 3.919 20 5 FHBDRN Cn1cc([N+](=O)[O-])c(-c2nc([C@H]3CCC(C)(C)c4ccccc43)no2)n1 ZINC000420512877 942715996 /nfs/dbraw/zinc/71/59/96/942715996.db2.gz YLKAAZGFDXMIFF-LBPRGKRZSA-N 0 0 353.382 3.582 20 5 FHBDRN CC[C@H](C)[C@H]1CCCCN1C(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F ZINC001126425559 942724267 /nfs/dbraw/zinc/72/42/67/942724267.db2.gz NDNJQCJADMOHEY-SWLSCSKDSA-N 0 0 351.422 3.841 20 5 FHBDRN CC(C)c1[nH]nc(C(=O)Nc2nc3c(s2)CC(C)(C)CC3)c1[N+](=O)[O-] ZINC000416362260 942732267 /nfs/dbraw/zinc/73/22/67/942732267.db2.gz SZSPABRNGOQKFV-UHFFFAOYSA-N 0 0 363.443 3.665 20 5 FHBDRN CCc1ccc(C(=O)N2CCC[C@@H]2COc2cccnc2C)cc1[N+](=O)[O-] ZINC000416363112 942734521 /nfs/dbraw/zinc/73/45/21/942734521.db2.gz ZJBBFGUSBUAJPK-QGZVFWFLSA-N 0 0 369.421 3.544 20 5 FHBDRN CCC[C@H](NC(=O)[C@@H](C)Oc1ccc([N+](=O)[O-])c(CO)c1)c1ccccc1 ZINC000431865391 942738669 /nfs/dbraw/zinc/73/86/69/942738669.db2.gz PVCPZUMWEYVQRB-KDOFPFPSSA-N 0 0 372.421 3.512 20 5 FHBDRN O=[N+]([O-])c1cc(F)c(N[C@H](CO)c2ccc(Br)cc2)c(F)c1 ZINC000502788457 942742100 /nfs/dbraw/zinc/74/21/00/942742100.db2.gz FJOHIDLFQLRCQM-CYBMUJFWSA-N 0 0 373.153 3.781 20 5 FHBDRN CCN(C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)c1cccc(OC)c1 ZINC000514109042 942750964 /nfs/dbraw/zinc/75/09/64/942750964.db2.gz IXIMAACMEOELGZ-UHFFFAOYSA-N 0 0 366.320 3.872 20 5 FHBDRN CC[C@@H](C)COc1cc([N+](=O)[O-])c(Cn2nnc3ccccc32)cc1OC ZINC000514099948 942758824 /nfs/dbraw/zinc/75/88/24/942758824.db2.gz OZWXNGKKHBKARL-CYBMUJFWSA-N 0 0 370.409 3.821 20 5 FHBDRN O=C(NCc1csc(CCc2ccccc2)n1)c1csc([N+](=O)[O-])c1 ZINC000434566695 942759743 /nfs/dbraw/zinc/75/97/43/942759743.db2.gz QPHWGKHFTSJRBH-UHFFFAOYSA-N 0 0 373.459 3.828 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(C(=O)O[C@@H](COC(C)C)c2cccc(F)c2)n1 ZINC001269809614 942761047 /nfs/dbraw/zinc/76/10/47/942761047.db2.gz FDDREIHYWHREBE-KRWDZBQOSA-N 0 0 362.357 3.760 20 5 FHBDRN O=C(N[C@@H](c1c(F)cccc1F)C(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000505432470 942763861 /nfs/dbraw/zinc/76/38/61/942763861.db2.gz BAOMFFIQAPTMCH-ZDUSSCGKSA-N 0 0 360.238 3.906 20 5 FHBDRN O=[N+]([O-])c1ccccc1/C=C\CN1CCO[C@H](c2ccc(F)c(F)c2)C1 ZINC000513756231 942772518 /nfs/dbraw/zinc/77/25/18/942772518.db2.gz XEADYCHPQWKUFD-UABKOXTMSA-N 0 0 360.360 3.960 20 5 FHBDRN O=C(c1ccc(OC(F)F)c([N+](=O)[O-])c1)N1CCC[C@H]1c1cccnc1 ZINC000514139768 942776366 /nfs/dbraw/zinc/77/63/66/942776366.db2.gz GFUGZDPEVMUQIG-ZDUSSCGKSA-N 0 0 363.320 3.569 20 5 FHBDRN COc1ccc(-c2cnc(Cn3nc(C)c4cc([N+](=O)[O-])ccc43)o2)cc1 ZINC000502842296 942790355 /nfs/dbraw/zinc/79/03/55/942790355.db2.gz JFVIZQALNYGIGQ-UHFFFAOYSA-N 0 0 364.361 3.965 20 5 FHBDRN O=C(c1ccc(OC(F)F)c([N+](=O)[O-])c1)N1CCCc2cccc(F)c21 ZINC000514156303 942790584 /nfs/dbraw/zinc/79/05/84/942790584.db2.gz QRIUKZLICLALBA-UHFFFAOYSA-N 0 0 366.295 3.928 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)Nc1nc(CN2CCCCC2)cs1 ZINC000421749411 942795855 /nfs/dbraw/zinc/79/58/55/942795855.db2.gz PXTSDQABCFFEEX-UHFFFAOYSA-N 0 0 374.466 3.906 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[C@@H](O)[C@H]1c1ccc(Cl)cc1 ZINC000425105977 942799774 /nfs/dbraw/zinc/79/97/74/942799774.db2.gz IZNUYJWWCNAUNA-IAGOWNOFSA-N 0 0 360.797 3.505 20 5 FHBDRN O=[N+]([O-])c1ccnn1Cc1csc(COc2ccc(Cl)cc2)n1 ZINC000502856029 942800751 /nfs/dbraw/zinc/80/07/51/942800751.db2.gz NOFTYYQORPKSSF-UHFFFAOYSA-N 0 0 350.787 3.529 20 5 FHBDRN O=C(COC(=O)c1occc1-c1ccccc1)Nc1cccc([N+](=O)[O-])c1 ZINC000016537390 942804270 /nfs/dbraw/zinc/80/42/70/942804270.db2.gz XAIMVBQXESJJFQ-UHFFFAOYSA-N 0 0 366.329 3.650 20 5 FHBDRN CCOc1ccc(C(=O)Nc2cccc([C@@H](C)C(=O)OC)c2)cc1[N+](=O)[O-] ZINC000413940701 942806104 /nfs/dbraw/zinc/80/61/04/942806104.db2.gz SQRRWCRNMSIHSV-GFCCVEGCSA-N 0 0 372.377 3.522 20 5 FHBDRN O=C(Nc1cc(F)c(F)c(F)c1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514200417 942810159 /nfs/dbraw/zinc/81/01/59/942810159.db2.gz VATCVUPIPBWWSU-UHFFFAOYSA-N 0 0 362.210 3.866 20 5 FHBDRN Nc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1CC[C@H](c2ccc(Cl)cc2)C1 ZINC000413941440 942812612 /nfs/dbraw/zinc/81/26/12/942812612.db2.gz APJHPXLCQFYMTB-GXTWGEPZSA-N 0 0 359.813 3.897 20 5 FHBDRN CNc1c(C(=O)N2CC[C@H](C(F)(F)F)C3(CCC3)C2)cccc1[N+](=O)[O-] ZINC000514191293 942817704 /nfs/dbraw/zinc/81/77/04/942817704.db2.gz XENYYBUETKVPGJ-ZDUSSCGKSA-N 0 0 371.359 3.831 20 5 FHBDRN O=C(c1c(Cl)cccc1[N+](=O)[O-])N1CCC[C@H](Oc2ccccc2)C1 ZINC000413957369 942819652 /nfs/dbraw/zinc/81/96/52/942819652.db2.gz POQUMSUCLKPDNP-AWEZNQCLSA-N 0 0 360.797 3.932 20 5 FHBDRN C[C@H](CNC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1)N(C)c1ccccc1 ZINC000431874165 942820692 /nfs/dbraw/zinc/82/06/92/942820692.db2.gz XFZVEPFFHHXMIY-OAHLLOKOSA-N 0 0 370.453 3.654 20 5 FHBDRN O=C(N[C@H]1C[C@@H]1C1CCCCC1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514218923 942827426 /nfs/dbraw/zinc/82/74/26/942827426.db2.gz PDSZMTXKMPDFKT-OLZOCXBDSA-N 0 0 354.353 3.895 20 5 FHBDRN O=C(c1cc(-n2cccc2)ccn1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000502884632 942828258 /nfs/dbraw/zinc/82/82/58/942828258.db2.gz IAGSHPBZKOARJB-UHFFFAOYSA-N 0 0 362.389 3.585 20 5 FHBDRN O=C([C@@H]1CCc2ccccc2O1)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000412374352 942828583 /nfs/dbraw/zinc/82/85/83/942828583.db2.gz DRYUSXGTYUEUJU-XLIONFOSSA-N 0 0 366.417 3.695 20 5 FHBDRN CO[C@@](C)([C@H](C)NC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-])C1CC1 ZINC000413965516 942839392 /nfs/dbraw/zinc/83/93/92/942839392.db2.gz XIORNNKUYFRVFS-QFYYESIMSA-N 0 0 372.874 3.660 20 5 FHBDRN CO[C@](C)([C@H](C)NC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-])C1CC1 ZINC000413965512 942839635 /nfs/dbraw/zinc/83/96/35/942839635.db2.gz XIORNNKUYFRVFS-MGPLVRAMSA-N 0 0 372.874 3.660 20 5 FHBDRN NC(=O)c1ccc(COc2ccc([N+](=O)[O-])cc2Cc2ccccc2)cc1 ZINC000016557062 942841611 /nfs/dbraw/zinc/84/16/11/942841611.db2.gz CSDPZNXEQSWUMA-UHFFFAOYSA-N 0 0 362.385 3.864 20 5 FHBDRN COc1ccc(OCc2nc(-c3ccc(Cl)cc3)no2)cc1[N+](=O)[O-] ZINC000190195672 942853301 /nfs/dbraw/zinc/85/33/01/942853301.db2.gz PWYCQLLQUHCCRS-UHFFFAOYSA-N 0 0 361.741 3.886 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)N[C@H]1CCCc2c(O)cccc21 ZINC000190202891 942854271 /nfs/dbraw/zinc/85/42/71/942854271.db2.gz LLBONPKHEGMVIN-INIZCTEOSA-N 0 0 358.419 3.586 20 5 FHBDRN CCn1c(NC(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)nc2cc(F)ccc21 ZINC000190177260 942854611 /nfs/dbraw/zinc/85/46/11/942854611.db2.gz HQRKUUNSSCCCHA-UHFFFAOYSA-N 0 0 372.356 3.673 20 5 FHBDRN CC(C)[C@H]1N(C(=O)C(C)(C)c2ccccc2[N+](=O)[O-])CC12CCOCC2 ZINC000413972949 942856717 /nfs/dbraw/zinc/85/67/17/942856717.db2.gz JIXZADVMGAADHP-QGZVFWFLSA-N 0 0 360.454 3.536 20 5 FHBDRN Cc1ccccc1[C@]1(F)CCN(CC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1 ZINC000502943320 942861033 /nfs/dbraw/zinc/86/10/33/942861033.db2.gz CZDOAAHXCUWPQX-FQEVSTJZSA-N 0 0 371.412 3.721 20 5 FHBDRN C[C@@H]1CCC[C@H]1CNC(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000545459471 942866689 /nfs/dbraw/zinc/86/66/89/942866689.db2.gz YLRQTALIFCNUKB-PWSUYJOCSA-N 0 0 359.348 3.849 20 5 FHBDRN CC(C)[C@@H]1N(C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)CC12CCOCC2 ZINC000413990965 942869919 /nfs/dbraw/zinc/86/99/19/942869919.db2.gz ZYIYJMCQWWBEMB-KRWDZBQOSA-N 0 0 360.454 3.536 20 5 FHBDRN Cc1cccc([C@@H]2CCCN2CC(=O)Nc2ccc([N+](=O)[O-])cc2C)c1 ZINC000434707982 942873682 /nfs/dbraw/zinc/87/36/82/942873682.db2.gz BCDJDAVLLALDCF-IBGZPJMESA-N 0 0 353.422 3.987 20 5 FHBDRN O=C(c1c(Cl)cccc1[N+](=O)[O-])N1CC=C(c2cncc(F)c2)CC1 ZINC000378542004 942873797 /nfs/dbraw/zinc/87/37/97/942873797.db2.gz XEZSDTBWAOUEGQ-UHFFFAOYSA-N 0 0 361.760 3.712 20 5 FHBDRN C[C@@H]1C[C@@H](C(F)(F)F)CCN1C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412379349 942877909 /nfs/dbraw/zinc/87/79/09/942877909.db2.gz GMYCVDAUDRARAT-UEEZHKSASA-N 0 0 356.344 3.888 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N(C[C@@H](C)c1ccccc1)[C@@H](C)CO ZINC000421905188 942879713 /nfs/dbraw/zinc/87/97/13/942879713.db2.gz IQEANXUYOJBVKO-SJORKVTESA-N 0 0 370.449 3.838 20 5 FHBDRN C[C@@H](NC(=O)c1ccc([C@@H]2CCCOC2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000502966304 942880275 /nfs/dbraw/zinc/88/02/75/942880275.db2.gz TYONDTGIYHWMAJ-RDTXWAMCSA-N 0 0 354.406 3.980 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N[C@H](CCO)c1ccc(Cl)cc1 ZINC000421906429 942880698 /nfs/dbraw/zinc/88/06/98/942880698.db2.gz LBFNDRMTZPIBCH-MRXNPFEDSA-N 0 0 362.813 3.719 20 5 FHBDRN C[C@@]1(Cc2ccc(F)cc2)CCCN1C(=O)c1cccc([N+](=O)[O-])c1N ZINC000421928023 942882741 /nfs/dbraw/zinc/88/27/41/942882741.db2.gz VGNMCYBGHYGJIZ-IBGZPJMESA-N 0 0 357.385 3.554 20 5 FHBDRN CCc1ccc([C@H]2CN(C(=O)c3ccc(CC)c([N+](=O)[O-])c3)CCN2)cc1 ZINC000505483575 942889893 /nfs/dbraw/zinc/88/98/93/942889893.db2.gz KEWHPVTZGSMIHG-LJQANCHMSA-N 0 0 367.449 3.506 20 5 FHBDRN O=C(c1ccc(Cl)cc1[N+](=O)[O-])N1CC[C@@H](n2ncc3ccccc32)C1 ZINC000378566207 942893845 /nfs/dbraw/zinc/89/38/45/942893845.db2.gz GESAZMCBBFRJKM-CQSZACIVSA-N 0 0 370.796 3.685 20 5 FHBDRN COc1ccc(NC(=O)c2ccc([N+](=O)[O-])n2C)cc1Cc1ccccc1 ZINC000514316359 942895368 /nfs/dbraw/zinc/89/53/68/942895368.db2.gz CCPNINVODYMIQL-UHFFFAOYSA-N 0 0 365.389 3.785 20 5 FHBDRN CC(C)c1ccc(CN2CCCC[C@@H]2CCS(C)(=O)=O)cc1[N+](=O)[O-] ZINC000430105472 942902211 /nfs/dbraw/zinc/90/22/11/942902211.db2.gz WHNAMUJAKICAGD-MRXNPFEDSA-N 0 0 368.499 3.507 20 5 FHBDRN COc1ccc(NC(=O)CO[C@@H]2CCCc3ccccc32)c([N+](=O)[O-])c1 ZINC000430092402 942903849 /nfs/dbraw/zinc/90/38/49/942903849.db2.gz ZWBMPSSVJJPCLO-GOSISDBHSA-N 0 0 356.378 3.636 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2noc(COc3ccnc(C(F)(F)F)c3)n2)cc1 ZINC000430106879 942919865 /nfs/dbraw/zinc/91/98/65/942919865.db2.gz VOFRXNCGQXXLJX-UHFFFAOYSA-N 0 0 366.255 3.638 20 5 FHBDRN CC(C)Oc1cccnc1C(=O)OCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000756438235 942921029 /nfs/dbraw/zinc/92/10/29/942921029.db2.gz QEBZNGOSUPGBCW-UHFFFAOYSA-N 0 0 350.758 3.787 20 5 FHBDRN O=c1[nH]cnc2cc(N3CCC[C@H](c4ccccc4)CC3)c([N+](=O)[O-])cc12 ZINC000066818531 942922474 /nfs/dbraw/zinc/92/24/74/942922474.db2.gz WBGBGLLRHRYYFQ-HNNXBMFYSA-N 0 0 364.405 3.605 20 5 FHBDRN CN([C@H]1CCC[C@@H]1c1ccccc1)S(=O)(=O)c1ccccc1[N+](=O)[O-] ZINC000416546895 942935717 /nfs/dbraw/zinc/93/57/17/942935717.db2.gz UKQZBZZOFFVUQA-CVEARBPZSA-N 0 0 360.435 3.552 20 5 FHBDRN CCOc1ccc(NC(=O)CNc2c(F)cccc2Cl)c([N+](=O)[O-])c1 ZINC000434747630 942938660 /nfs/dbraw/zinc/93/86/60/942938660.db2.gz MHYOEVYFZOKBAY-UHFFFAOYSA-N 0 0 367.764 3.837 20 5 FHBDRN Cc1ccc([C@]2(C)CCN(CC(=O)Nc3ccccc3[N+](=O)[O-])C2)cc1 ZINC000434750127 942940697 /nfs/dbraw/zinc/94/06/97/942940697.db2.gz YBVJIPOHWOBLJH-HXUWFJFHSA-N 0 0 353.422 3.505 20 5 FHBDRN Cc1c(CNC(=O)Cc2csc(C3CCCC3)n2)cccc1[N+](=O)[O-] ZINC001269216041 942961215 /nfs/dbraw/zinc/96/12/15/942961215.db2.gz RYABGHUGHVDYOD-UHFFFAOYSA-N 0 0 359.451 3.876 20 5 FHBDRN O=C(NCc1cccc(Cl)c1Cl)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000514370708 942961776 /nfs/dbraw/zinc/96/17/76/942961776.db2.gz RSGSRAQDAXCJRC-UHFFFAOYSA-N 0 0 365.176 3.708 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N2CC[C@H](c3ccccc3)C2(C)C)c1[N+](=O)[O-] ZINC000422061544 942970910 /nfs/dbraw/zinc/97/09/10/942970910.db2.gz FNBREOZBWXIYJD-CQSZACIVSA-N 0 0 356.426 3.850 20 5 FHBDRN O=C(c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1)N1CC[C@@]12CCOC2 ZINC000422076150 942972651 /nfs/dbraw/zinc/97/26/51/942972651.db2.gz STKNCQWYKUGDLD-IBGZPJMESA-N 0 0 370.430 3.751 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)ccc1NC[C@@H](c1ccccc1)N1CCOCC1 ZINC000514391896 942980015 /nfs/dbraw/zinc/98/00/15/942980015.db2.gz QGBLHONEJABMPU-SFHVURJKSA-N 0 0 361.829 3.734 20 5 FHBDRN CC(=O)c1ccc(C(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cc1O ZINC000412381654 942981987 /nfs/dbraw/zinc/98/19/87/942981987.db2.gz UNHBJIDYLSBJOL-MRXNPFEDSA-N 0 0 368.389 3.523 20 5 FHBDRN Cc1ccccc1CN(CC(=O)Nc1ccc([N+](=O)[O-])cc1C)C1CC1 ZINC000434831081 942983707 /nfs/dbraw/zinc/98/37/07/942983707.db2.gz WDJRHFKAGZQEQU-UHFFFAOYSA-N 0 0 353.422 3.815 20 5 FHBDRN COc1cc(C2(C(=O)NCCc3ccc([N+](=O)[O-])cc3)CCC2)ccc1C ZINC000503139240 943005267 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COCCN(CC(=O)Nc1ccc([N+](=O)[O-])cc1C)[C@H](C)c1ccccc1 ZINC000434894987 943032428 /nfs/dbraw/zinc/03/24/28/943032428.db2.gz JYRYLXIKEFCPPD-MRXNPFEDSA-N 0 0 371.437 3.551 20 5 FHBDRN C[C@@H]1c2c(Cl)cc(Cl)cc2CCN1Cc1c([N+](=O)[O-])ncn1C ZINC000434905210 943041877 /nfs/dbraw/zinc/04/18/77/943041877.db2.gz QJDAFHUDLQLXLE-SECBINFHSA-N 0 0 355.225 3.754 20 5 FHBDRN COc1ccc(OCc2nnc(-c3ccc(Cl)cc3)o2)c([N+](=O)[O-])c1 ZINC000014351115 943055466 /nfs/dbraw/zinc/05/54/66/943055466.db2.gz NYUWGUPFMAYRFE-UHFFFAOYSA-N 0 0 361.741 3.886 20 5 FHBDRN COc1cc(Cl)c(F)c(C(=O)N2CCc3c2cccc3[N+](=O)[O-])c1 ZINC001126430440 943063999 /nfs/dbraw/zinc/06/39/99/943063999.db2.gz NEHFSTDPMQLWRW-UHFFFAOYSA-N 0 0 350.733 3.599 20 5 FHBDRN C[C@@H](NC(=O)NCC1(Cc2ccccc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000434968550 943076815 /nfs/dbraw/zinc/07/68/15/943076815.db2.gz STOQPYZPQOZPEJ-OAHLLOKOSA-N 0 0 353.422 3.978 20 5 FHBDRN C[C@@H](C1CC1)N(Cc1ccccc1)C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000514528353 943085696 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CCN(C(=O)NCCc1ccc([N+](=O)[O-])cc1)[C@@H](C)Cc1ccsc1 ZINC000190398231 943141120 /nfs/dbraw/zinc/14/11/20/943141120.db2.gz LTGANWCFCOFTMN-AWEZNQCLSA-N 0 0 361.467 3.862 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)NC1(c2nc(C)cs2)CCC1 ZINC000435075521 943144775 /nfs/dbraw/zinc/14/47/75/943144775.db2.gz PTHXYLXGZAAFKB-UHFFFAOYSA-N 0 0 362.411 3.569 20 5 FHBDRN COc1ccc2c(c1)CCC[C@@H]2N(C)C(=O)c1cc([N+](=O)[O-])ccc1OC ZINC000505597467 943146554 /nfs/dbraw/zinc/14/65/54/943146554.db2.gz RDENGRJVQDRNEX-SFHVURJKSA-N 0 0 370.405 3.762 20 5 FHBDRN Cc1ccc(C(=O)Nc2ccnn2CCc2ccccc2)cc1[N+](=O)[O-] ZINC000503363740 943149285 /nfs/dbraw/zinc/14/92/85/943149285.db2.gz VQZQZHNGEZSKQZ-UHFFFAOYSA-N 0 0 350.378 3.595 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OC[C@H](O)CO[C@H]2CCCc3ccccc32)c1 ZINC000514616786 943152381 /nfs/dbraw/zinc/15/23/81/943152381.db2.gz GQPIOFIENCSALJ-APWZRJJASA-N 0 0 357.406 3.737 20 5 FHBDRN Cc1cccc(C(=O)NCc2sccc2Br)c1[N+](=O)[O-] ZINC000058767458 943156143 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943382207 /nfs/dbraw/zinc/38/22/07/943382207.db2.gz PXUIWVIASQRLQH-INIZCTEOSA-N 0 0 370.796 3.685 20 5 FHBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1CCC[C@@H]1/C=C\c1ccccc1 ZINC000503822286 943384615 /nfs/dbraw/zinc/38/46/15/943384615.db2.gz UFEGRIWFCYUYRK-MUSGIIIZSA-N 0 0 372.446 3.770 20 5 FHBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1CCC[C@H]1/C=C/c1ccccc1 ZINC000503822288 943385189 /nfs/dbraw/zinc/38/51/89/943385189.db2.gz UFEGRIWFCYUYRK-UJGDBWEASA-N 0 0 372.446 3.770 20 5 FHBDRN O=C(N[C@H](Cc1ccc(Cl)cc1)c1ccccn1)c1cc([N+](=O)[O-])c[nH]1 ZINC000503875706 943393786 /nfs/dbraw/zinc/39/37/86/943393786.db2.gz PPMYUMAFNHGKFF-MRXNPFEDSA-N 0 0 370.796 3.685 20 5 FHBDRN Cc1ccc2[nH]c(SCCC(=O)Nc3ccc([N+](=O)[O-])cc3)nc2c1 ZINC000514943265 943395771 /nfs/dbraw/zinc/39/57/71/943395771.db2.gz VHCWTFLZRGXAAM-UHFFFAOYSA-N 0 0 356.407 3.900 20 5 FHBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N1CCCO[C@@H](CF)C1 ZINC000412458141 943399478 /nfs/dbraw/zinc/39/94/78/943399478.db2.gz ZJILGZPSWWJAEH-AWEZNQCLSA-N 0 0 370.446 3.544 20 5 FHBDRN Cc1cnn(-c2ccc(C)cc2NC(=O)c2ccc([N+](=O)[O-])c(C)c2)c1 ZINC000435453237 943412839 /nfs/dbraw/zinc/41/28/39/943412839.db2.gz RWIUKXPAUJMJTQ-UHFFFAOYSA-N 0 0 350.378 3.958 20 5 FHBDRN CC(C)CCN(CCC(C)C)C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000514994821 943438953 /nfs/dbraw/zinc/43/89/53/943438953.db2.gz XDQYFXGLIWRNGG-UHFFFAOYSA-N 0 0 350.415 3.858 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1)[C@H](NCc1n[nH]cc1Br)CCCC2 ZINC000515003838 943444843 /nfs/dbraw/zinc/44/48/43/943444843.db2.gz CMSFACBNMKLFDU-CQSZACIVSA-N 0 0 365.231 3.638 20 5 FHBDRN CC(C)(C)OC(=O)[C@@H]1[C@H](c2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1(C)C ZINC000417241230 943468288 /nfs/dbraw/zinc/46/82/88/943468288.db2.gz RBHLTJXSULGCRV-OLZOCXBDSA-N 0 0 359.382 3.726 20 5 FHBDRN O=C(COc1cccc([N+](=O)[O-])c1)Nc1ccc2oc(C3CC3)nc2c1 ZINC000505705224 943475298 /nfs/dbraw/zinc/47/52/98/943475298.db2.gz GVGBBSBOCRBNLN-UHFFFAOYSA-N 0 0 353.334 3.631 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1OC(=O)[C@H](C)Oc1ccc(Cl)cc1 ZINC000014601252 943489966 /nfs/dbraw/zinc/48/99/66/943489966.db2.gz OAERDCSNAHAQPI-JTQLQIEISA-N 0 0 351.742 3.630 20 5 FHBDRN COc1c(CN[C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)c(C)nn1C ZINC000162381158 943492033 /nfs/dbraw/zinc/49/20/33/943492033.db2.gz NLHQVTPDQUBKLH-LJQANCHMSA-N 0 0 366.421 3.525 20 5 FHBDRN C[C@@H]1C[C@@H](C)CN(C(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000017167373 943493661 /nfs/dbraw/zinc/49/36/61/943493661.db2.gz RKDYAHHUAGNVKR-VXGBXAGGSA-N 0 0 373.375 3.920 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(Cl)c1N[C@H]1CC[C@@H](C(=O)N2CCCC2)C1 ZINC000435602098 943512443 /nfs/dbraw/zinc/51/24/43/943512443.db2.gz SRZBWHWBZOTZSB-OLZOCXBDSA-N 0 0 351.834 3.760 20 5 FHBDRN Cc1cc(F)c([N+](=O)[O-])cc1C(=O)N1CCCO[C@@H](c2ccccc2)C1 ZINC001125902199 943520156 /nfs/dbraw/zinc/52/01/56/943520156.db2.gz HJJMQXYZJIJFES-GOSISDBHSA-N 0 0 358.369 3.646 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1)[C@@H](NCc1ncnn1-c1ccccc1)CCCC2 ZINC000417333872 943522005 /nfs/dbraw/zinc/52/20/05/943522005.db2.gz 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CC(C)c1c(C(=O)Nc2ccc([N+](=O)[O-])cc2)cnn1-c1ccccn1 ZINC000515205004 943565771 /nfs/dbraw/zinc/56/57/71/943565771.db2.gz GATASHXBFWHUBN-UHFFFAOYSA-N 0 0 351.366 3.551 20 5 FHBDRN COc1ccc(OCCCC(=O)N2c3ccc([N+](=O)[O-])cc3C[C@H]2C)cc1 ZINC000504279021 943569277 /nfs/dbraw/zinc/56/92/77/943569277.db2.gz HXQXFDHHAGWPGL-CQSZACIVSA-N 0 0 370.405 3.740 20 5 FHBDRN CCOC(=O)[C@H]1CCC[C@H](COC(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000781891666 943582991 /nfs/dbraw/zinc/58/29/91/943582991.db2.gz MZUYHFFJRFODHF-RYUDHWBXSA-N 0 0 369.801 3.775 20 5 FHBDRN C[C@H]1CCCC[C@H]1OCCNC(=O)CSCc1ccc([N+](=O)[O-])cc1 ZINC000513813209 943585795 /nfs/dbraw/zinc/58/57/95/943585795.db2.gz ZFVQSJSHCBDDCY-WMLDXEAASA-N 0 0 366.483 3.540 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2cnn(Cc3nc(-c4ccccc4F)no3)c2)cc1 ZINC000435770668 943600897 /nfs/dbraw/zinc/60/08/97/943600897.db2.gz GQQDMWRBXORBOS-UHFFFAOYSA-N 0 0 365.324 3.696 20 5 FHBDRN COc1cc(C(=O)Nc2ccc([N+](=O)[O-])c(C)n2)cc(OC)c1C(C)C ZINC000511627646 943608632 /nfs/dbraw/zinc/60/86/32/943608632.db2.gz LUVBRRAXFLZNKU-UHFFFAOYSA-N 0 0 359.382 3.691 20 5 FHBDRN Cc1ccccc1C[NH+]1CCC(Nc2ccc([N+](=O)[O-])c(C(=O)[O-])c2)CC1 ZINC000549471435 943616274 /nfs/dbraw/zinc/61/62/74/943616274.db2.gz LMGVZULSJLAEBZ-UHFFFAOYSA-N 0 0 369.421 3.678 20 5 FHBDRN CC(=O)c1cc(N[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)ccc1F ZINC000504417160 943623167 /nfs/dbraw/zinc/62/31/67/943623167.db2.gz YPFTUPKABVBAKW-LLVKDONJSA-N 0 0 359.357 3.684 20 5 FHBDRN Cc1ccc([C@H](C)OC(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)cc1 ZINC000014667763 943633617 /nfs/dbraw/zinc/63/36/17/943633617.db2.gz IBCWMTRBKOLLMG-HNNXBMFYSA-N 0 0 370.405 3.658 20 5 FHBDRN Cc1ccc([C@@H](C)N2C(=O)[C@H](C)N(Cc3ccccc3)C2=O)cc1[N+](=O)[O-] ZINC000431952173 943654961 /nfs/dbraw/zinc/65/49/61/943654961.db2.gz QBNHVMZCLQAXJE-CABCVRRESA-N 0 0 367.405 3.817 20 5 FHBDRN COc1cc(C(=O)NCC2(c3ccc(F)cc3)CCC2)ccc1[N+](=O)[O-] ZINC000504574505 943688884 /nfs/dbraw/zinc/68/88/84/943688884.db2.gz FGEDOEKSTWIENK-UHFFFAOYSA-N 0 0 358.369 3.594 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1CO[C@@H]1CCCc2c[nH]nc21 ZINC000424093944 943728401 /nfs/dbraw/zinc/72/84/01/943728401.db2.gz SNHRVRMMVFIQMH-CYBMUJFWSA-N 0 0 352.188 3.675 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)N1CCC[C@@H](Oc2ccccc2Cl)C1 ZINC000504661123 943733467 /nfs/dbraw/zinc/73/34/67/943733467.db2.gz FBGYESYSMPLKSH-MRXNPFEDSA-N 0 0 374.824 3.861 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1CN1CCOC2(CCCC2)C1 ZINC000584835580 943740009 /nfs/dbraw/zinc/74/00/09/943740009.db2.gz PAKZSIWBCVJZHU-UHFFFAOYSA-N 0 0 355.232 3.502 20 5 FHBDRN CC[C@H](CSc1ccccc1)NC(=O)c1cc([N+](=O)[O-])ccc1OC ZINC000504708526 943751610 /nfs/dbraw/zinc/75/16/10/943751610.db2.gz RIAFTGIFFPOXAR-CYBMUJFWSA-N 0 0 360.435 3.904 20 5 FHBDRN CC[C@@H](CSc1ccccc1)NC(=O)c1cc([N+](=O)[O-])ccc1OC ZINC000504708528 943751757 /nfs/dbraw/zinc/75/17/57/943751757.db2.gz RIAFTGIFFPOXAR-ZDUSSCGKSA-N 0 0 360.435 3.904 20 5 FHBDRN COc1cc(C)c(NC(=O)CSc2ccc([N+](=O)[O-])cc2)cc1OC ZINC000014712942 943752727 /nfs/dbraw/zinc/75/27/27/943752727.db2.gz UEMXVJMSVLMGET-UHFFFAOYSA-N 0 0 362.407 3.651 20 5 FHBDRN CCC[C@]1(C)CCCN(C(=O)c2nnn(-c3cccc([N+](=O)[O-])c3)c2C)C1 ZINC000437375964 943761327 /nfs/dbraw/zinc/76/13/27/943761327.db2.gz LCGDKFCRKUVMSF-LJQANCHMSA-N 0 0 371.441 3.526 20 5 FHBDRN C[C@H]1CN(C(=O)c2cc3cc([N+](=O)[O-])ccc3o2)[C@H](c2ccccc2)CO1 ZINC000437380071 943764740 /nfs/dbraw/zinc/76/47/40/943764740.db2.gz LKYVUFJOENZEQK-GUYCJALGSA-N 0 0 366.373 3.943 20 5 FHBDRN CS[C@H]1CCCCN(C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000435779718 943766066 /nfs/dbraw/zinc/76/60/66/943766066.db2.gz SHBCLPKBTXJJLY-KRWDZBQOSA-N 0 0 365.499 3.845 20 5 FHBDRN CCC[C@@]1(C)CCCN(C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)C1 ZINC000437393121 943771029 /nfs/dbraw/zinc/77/10/29/943771029.db2.gz ZNFNGTXAZHOUJL-IBGZPJMESA-N 0 0 356.426 3.823 20 5 FHBDRN COc1cc(CN(C(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)C2CC2)ccc1O ZINC000516860461 943773420 /nfs/dbraw/zinc/77/34/20/943773420.db2.gz XQZJJFKKMGUFJQ-ZDUSSCGKSA-N 0 0 370.405 3.604 20 5 FHBDRN CC(C)(CNC(=O)CSc1ccccc1[N+](=O)[O-])c1ccccc1F ZINC000504747527 943779130 /nfs/dbraw/zinc/77/91/30/943779130.db2.gz FURKIQUYKQTDPL-UHFFFAOYSA-N 0 0 362.426 3.920 20 5 FHBDRN COc1ccccc1CNC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000435833621 943789908 /nfs/dbraw/zinc/78/99/08/943789908.db2.gz GHVHHKCWOBEXCH-UHFFFAOYSA-N 0 0 358.397 3.620 20 5 FHBDRN CC(C)OCc1cccc(NC(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)c1 ZINC000515326386 943791108 /nfs/dbraw/zinc/79/11/08/943791108.db2.gz AUHCWIUBZWMURK-UHFFFAOYSA-N 0 0 364.348 3.979 20 5 FHBDRN CCOc1ccc(C(=O)N[C@H]2C[C@H](c3ccccc3F)C2)cc1[N+](=O)[O-] ZINC000437443598 943803167 /nfs/dbraw/zinc/80/31/67/943803167.db2.gz CLEQVEVODOVPJP-HDJSIYSDSA-N 0 0 358.369 3.809 20 5 FHBDRN COC[C@@H](C)Nc1ccccc1NC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000516905471 943804048 /nfs/dbraw/zinc/80/40/48/943804048.db2.gz NDODSJSLKWZQJJ-KGLIPLIRSA-N 0 0 357.410 3.784 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2nc(-c3cccc(OCc4cccnc4)c3)no2)[nH]1 ZINC000504809171 943807378 /nfs/dbraw/zinc/80/73/78/943807378.db2.gz HQXBLZQENUCYNS-UHFFFAOYSA-N 0 0 363.333 3.614 20 5 FHBDRN O=C([C@@H]1CC[C@H](Cc2ccccc2)O1)N1CCCc2ccc([N+](=O)[O-])cc21 ZINC001125911224 943815807 /nfs/dbraw/zinc/81/58/07/943815807.db2.gz KZLREYFORSVKFN-QUCCMNQESA-N 0 0 366.417 3.664 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)N[C@H]1C[C@H](c2ccccc2F)C1 ZINC000437439639 943816565 /nfs/dbraw/zinc/81/65/65/943816565.db2.gz PFPWXQGCKGBOGG-JOCQHMNTSA-N 0 0 360.410 3.888 20 5 FHBDRN CNc1c(C(=O)N[C@H]2C[C@H](c3cc(F)cc(F)c3)C2)cccc1[N+](=O)[O-] ZINC000437463565 943832305 /nfs/dbraw/zinc/83/23/05/943832305.db2.gz AAEJZTFFWSVROZ-YEORSEQZSA-N 0 0 361.348 3.591 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1CN1CCC[C@]2(CCCOC2)C1 ZINC000425411986 943836187 /nfs/dbraw/zinc/83/61/87/943836187.db2.gz BLJJGPOWLNYKKU-INIZCTEOSA-N 0 0 369.259 3.750 20 5 FHBDRN CC1(C)CN(C(=O)c2ccc([N+](=O)[O-])c3cccnc23)[C@H]1c1ccncc1 ZINC000516929417 943838667 /nfs/dbraw/zinc/83/86/67/943838667.db2.gz YZYKEFGFMOHYAI-SFHVURJKSA-N 0 0 362.389 3.761 20 5 FHBDRN CC(C)(C)c1noc(CCCC(=O)NC(C)(C)c2ccccc2[N+](=O)[O-])n1 ZINC000515407584 943855043 /nfs/dbraw/zinc/85/50/43/943855043.db2.gz ASFFDMLBFNGWKK-UHFFFAOYSA-N 0 0 374.441 3.650 20 5 FHBDRN C[C@H](NC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1)[C@H]1CCCOC1 ZINC000504867539 943856209 /nfs/dbraw/zinc/85/62/09/943856209.db2.gz SCUAJNGBJATDPP-HOCLYGCPSA-N 0 0 369.421 3.883 20 5 FHBDRN Cc1ccc(OCCCNC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)cc1 ZINC000504867778 943856245 /nfs/dbraw/zinc/85/62/45/943856245.db2.gz BGBCIGSUJSNYIA-UHFFFAOYSA-N 0 0 369.421 3.676 20 5 FHBDRN C[C@H]1CN(C(=O)c2ccc(N3C[C@H](C)C[C@H](C)C3)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000435932252 943866999 /nfs/dbraw/zinc/86/69/99/943866999.db2.gz ASOUQHLVQLVZOX-FZKCQIBNSA-N 0 0 359.470 3.805 20 5 FHBDRN CC(C)CO[C@H]1CCN(Cc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000425421864 943869490 /nfs/dbraw/zinc/86/94/90/943869490.db2.gz MNLDIYHCSLRRIO-AWEZNQCLSA-N 0 0 357.248 3.604 20 5 FHBDRN O=C(Nc1nc2ccccc2[nH]1)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000435940699 943873218 /nfs/dbraw/zinc/87/32/18/943873218.db2.gz YQJURWGKEIGVJV-UHFFFAOYSA-N 0 0 372.359 3.949 20 5 FHBDRN CSc1ccc(CCNC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)cc1 ZINC000437514930 943874026 /nfs/dbraw/zinc/87/40/26/943874026.db2.gz ORWOKORIXMYEPH-UHFFFAOYSA-N 0 0 369.446 3.630 20 5 FHBDRN CCOc1ccc([C@H](C)NCc2nnc(C(C)C)s2)cc1[N+](=O)[O-] ZINC000504899907 943877965 /nfs/dbraw/zinc/87/79/65/943877965.db2.gz OESUODBHAQCQHD-NSHDSACASA-N 0 0 350.444 3.819 20 5 FHBDRN CN(CCOc1ccccc1C(C)(C)C)C(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000435946776 943885521 /nfs/dbraw/zinc/88/55/21/943885521.db2.gz BZRCESJMEVJONJ-UHFFFAOYSA-N 0 0 371.437 3.626 20 5 FHBDRN CCCc1cc(C(=O)N2CCc3ncc([N+](=O)[O-])cc3C2)ccc1Cl ZINC000473035200 943887037 /nfs/dbraw/zinc/88/70/37/943887037.db2.gz KHLWKCFMGAQFGX-UHFFFAOYSA-N 0 0 359.813 3.794 20 5 FHBDRN C[C@H]1C[C@H](C)CN(c2ccc(C(=O)N(C)CCC3CC3)cc2[N+](=O)[O-])C1 ZINC000437507752 943887442 /nfs/dbraw/zinc/88/74/42/943887442.db2.gz XGXKRCKDNOCTCE-GJZGRUSLSA-N 0 0 359.470 3.949 20 5 FHBDRN O=C(Nc1cccc2c[nH]nc21)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000435950327 943888861 /nfs/dbraw/zinc/88/88/61/943888861.db2.gz QETQXGLKRYHRQL-UHFFFAOYSA-N 0 0 372.359 3.949 20 5 FHBDRN CCOc1ccc(OC)cc1N[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000105412397 943894250 /nfs/dbraw/zinc/89/42/50/943894250.db2.gz JLSHRPMJQISDNA-ZDUSSCGKSA-N 0 0 373.409 3.750 20 5 FHBDRN O=C([O-])c1ccccc1OCC[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000566509422 943894540 /nfs/dbraw/zinc/89/45/40/943894540.db2.gz DZBXJMDHANNBKH-MRXNPFEDSA-N 0 0 370.405 3.551 20 5 FHBDRN O=C(Nc1cccc(OCCF)c1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000123026069 943895037 /nfs/dbraw/zinc/89/50/37/943895037.db2.gz HCSUIKIYOBCVQZ-UHFFFAOYSA-N 0 0 359.357 3.533 20 5 FHBDRN CCOc1ccc([C@H](C)[NH2+]CCOc2ccc(OC)cc2)cc1[N+](=O)[O-] ZINC000504905123 943903208 /nfs/dbraw/zinc/90/32/08/943903208.db2.gz CPVQSTYGGQORKP-AWEZNQCLSA-N 0 0 360.410 3.732 20 5 FHBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)[C@@H]1CCCOC1 ZINC000504913269 943909407 /nfs/dbraw/zinc/90/94/07/943909407.db2.gz DOXWDTNYASYXLV-UONOGXRCSA-N 0 0 366.483 3.888 20 5 FHBDRN O=[N+]([O-])c1c(NCCOc2cccc3ccccc32)nc2sccn21 ZINC000515501406 943929036 /nfs/dbraw/zinc/92/90/36/943929036.db2.gz GBEPMQHQCKNINJ-UHFFFAOYSA-N 0 0 354.391 3.948 20 5 FHBDRN CC1=C[C@H](C)CN(C(=O)c2cc(F)cc3c(=O)c4cccc(F)c4[nH]c23)C1 ZINC000436013140 943929250 /nfs/dbraw/zinc/92/92/50/943929250.db2.gz XHXMTHNZURHCDY-NSHDSACASA-N 0 0 368.383 3.998 20 5 FHBDRN O=C(NCc1cccc([N+](=O)[O-])c1)c1c(Cl)nccc1C(F)(F)F ZINC000126492812 943935944 /nfs/dbraw/zinc/93/59/44/943935944.db2.gz BCQWPUNDSJBWMS-UHFFFAOYSA-N 0 0 359.691 3.592 20 5 FHBDRN COC[C@@H](C)Nc1ccccc1NC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000437593419 943936181 /nfs/dbraw/zinc/93/61/81/943936181.db2.gz TWHRRFZUVZYDGG-GFCCVEGCSA-N 0 0 368.393 3.775 20 5 FHBDRN COC[C@@H](C)Nc1ccccc1NC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000437601007 943942304 /nfs/dbraw/zinc/94/23/04/943942304.db2.gz JCISTZQTHSMURZ-GFCCVEGCSA-N 0 0 368.393 3.775 20 5 FHBDRN Cc1ccc(OCCCNC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)cc1 ZINC000504970955 943944464 /nfs/dbraw/zinc/94/44/64/943944464.db2.gz LSMXYJDIPUAGNM-UHFFFAOYSA-N 0 0 353.378 3.583 20 5 FHBDRN CCOC(=O)c1cc(-c2nc(CCc3ccccc3)no2)cc([N+](=O)[O-])c1 ZINC000504969185 943944618 /nfs/dbraw/zinc/94/46/18/943944618.db2.gz NVDFOAWEYTZQOH-UHFFFAOYSA-N 0 0 367.361 3.607 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N(CC1CCCCC1)C1CC1 ZINC000515518177 943950547 /nfs/dbraw/zinc/95/05/47/943950547.db2.gz VFMSVTLYAZZTIX-UHFFFAOYSA-N 0 0 352.456 3.637 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2noc(Cc3csc(-c4ccccn4)n3)n2)c1 ZINC000504997252 943951954 /nfs/dbraw/zinc/95/19/54/943951954.db2.gz YTTKFQYIQLMHLK-UHFFFAOYSA-N 0 0 365.374 3.754 20 5 FHBDRN O=[N+]([O-])c1cccc(-n2ccc(-c3nc(CCc4ccccc4)no3)n2)c1 ZINC000504987330 943959021 /nfs/dbraw/zinc/95/90/21/943959021.db2.gz WYSPEYMEVNPXQZ-UHFFFAOYSA-N 0 0 361.361 3.616 20 5 FHBDRN COc1cc(CCNC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)ccc1Cl ZINC000566524411 943962563 /nfs/dbraw/zinc/96/25/63/943962563.db2.gz YMNGULWHHCTGFB-UHFFFAOYSA-N 0 0 373.796 3.711 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1CN1CCOC[C@H](C2CCC2)C1 ZINC000425451352 943971279 /nfs/dbraw/zinc/97/12/79/943971279.db2.gz WXTPXVYFKIVROF-CQSZACIVSA-N 0 0 369.259 3.606 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])N[C@@H]1C[C@H]1c1ccc(Cl)c(F)c1 ZINC000437630657 943977673 /nfs/dbraw/zinc/97/76/73/943977673.db2.gz PMOUIBZVOUSXDS-SWLSCSKDSA-N 0 0 363.776 3.743 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2noc(-c3cccc(OC[C@H]4CCCO4)c3)n2)c1 ZINC000505045839 943980436 /nfs/dbraw/zinc/98/04/36/943980436.db2.gz ZLZGJIHTGRTQQN-QGZVFWFLSA-N 0 0 367.361 3.870 20 5 FHBDRN C[C@@H](NC(=O)N[C@@H]1C[C@H]1c1c(F)cccc1F)c1cccc([N+](=O)[O-])c1 ZINC000437634223 943981622 /nfs/dbraw/zinc/98/16/22/943981622.db2.gz GQGIPHAHIYOIRK-CKUKBARFSA-N 0 0 361.348 3.789 20 5 FHBDRN C[C@H](Nc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-])c1c(F)cccc1F ZINC000515554526 943988197 /nfs/dbraw/zinc/98/81/97/943988197.db2.gz NDEAJXBWBJKBLB-JTQLQIEISA-N 0 0 361.348 3.938 20 5 FHBDRN O=[N+]([O-])c1ccc2nc(N3CCC[C@@H](OCC(F)(F)F)C3)ccc2c1 ZINC000515555173 943990096 /nfs/dbraw/zinc/99/00/96/943990096.db2.gz WARXDZYSFGISDW-CYBMUJFWSA-N 0 0 355.316 3.691 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2noc(-c3ccc(OCC(F)(F)F)nc3)n2)c1 ZINC000505034351 943990302 /nfs/dbraw/zinc/99/03/02/943990302.db2.gz CFHJJNMUXYXHKK-UHFFFAOYSA-N 0 0 366.255 3.648 20 5 FHBDRN CCCN(CCC)C(=O)CCCc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000505035988 943991354 /nfs/dbraw/zinc/99/13/54/943991354.db2.gz OTRSJNAEZPFTEU-UHFFFAOYSA-N 0 0 360.414 3.616 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2noc(CN(Cc3ccc(F)cc3)C3CC3)n2)c1 ZINC000506088141 943993685 /nfs/dbraw/zinc/99/36/85/943993685.db2.gz IKWMMPWMENBQNX-UHFFFAOYSA-N 0 0 368.368 3.949 20 5 FHBDRN COc1cccc(C(=O)N2[C@@H](C)Cc3cc(F)ccc3[C@@H]2C)c1[N+](=O)[O-] ZINC000436054379 943995243 /nfs/dbraw/zinc/99/52/43/943995243.db2.gz VJYKMRLRFWCZKM-RYUDHWBXSA-N 0 0 358.369 3.891 20 5 FHBDRN CN(c1ccccc1)c1ccc(C[NH2+][C@@H]2CC[C@H](C(=O)[O-])C2)cc1[N+](=O)[O-] ZINC000424608700 944006400 /nfs/dbraw/zinc/00/64/00/944006400.db2.gz BMHZOSYOEZBQAB-JKSUJKDBSA-N 0 0 369.421 3.706 20 5 FHBDRN COc1cc([C@H](C)NCc2ccc(Br)cc2[N+](=O)[O-])ccn1 ZINC000425460270 944006774 /nfs/dbraw/zinc/00/67/74/944006774.db2.gz RCBGLILSSLKJAO-JTQLQIEISA-N 0 0 366.215 3.612 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1OC(=O)CSC(=S)N1CCC(C)CC1 ZINC000760020313 944010432 /nfs/dbraw/zinc/01/04/32/944010432.db2.gz XMGGTQVNSDGOTB-UHFFFAOYSA-N 0 0 368.480 3.559 20 5 FHBDRN O=C(Nc1ccc(Nc2ncccn2)cc1)Nc1ccc([N+](=O)[O-])cc1F ZINC000436101675 944017092 /nfs/dbraw/zinc/01/70/92/944017092.db2.gz QKPIGCLBRWTMKO-UHFFFAOYSA-N 0 0 368.328 3.912 20 5 FHBDRN COc1cc(NCc2cn(C)nc2-c2ccccc2)c([N+](=O)[O-])cc1OC ZINC000302147015 944021184 /nfs/dbraw/zinc/02/11/84/944021184.db2.gz GXBQUDLKYLBHCC-UHFFFAOYSA-N 0 0 368.393 3.625 20 5 FHBDRN O=C(Nc1cc(CC2CCCCC2)[nH]n1)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000515587296 944021372 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CCOc1ccc(C(=O)N(C)Cc2cc(C)c(OC)c(C)c2)cc1[N+](=O)[O-] ZINC000506104950 944039507 /nfs/dbraw/zinc/03/95/07/944039507.db2.gz KGMCQXKKLXVDLJ-UHFFFAOYSA-N 0 0 372.421 3.891 20 5 FHBDRN CCOc1cc(C(=O)NCc2ccc([C@@H]3C[C@H]3C)o2)c([N+](=O)[O-])cc1OC ZINC000515620381 944054508 /nfs/dbraw/zinc/05/45/08/944054508.db2.gz SUOPGFSDPNOUJA-DGCLKSJQSA-N 0 0 374.393 3.649 20 5 FHBDRN CN(CCC(F)(F)F)C(=O)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000436146045 944055337 /nfs/dbraw/zinc/05/53/37/944055337.db2.gz BONBFYPDFBEODH-UHFFFAOYSA-N 0 0 366.314 3.845 20 5 FHBDRN O=C(Nc1ccccc1O)c1cc(F)cc2c(=O)c3cccc(F)c3[nH]c12 ZINC000436148576 944056666 /nfs/dbraw/zinc/05/66/66/944056666.db2.gz GCQVQDUYMJGOEH-UHFFFAOYSA-N 0 0 366.323 3.917 20 5 FHBDRN CN(Cc1ccc(C(C)(C)C)cc1)C(=O)COc1ccccc1[N+](=O)[O-] ZINC000014911951 944066011 /nfs/dbraw/zinc/06/60/11/944066011.db2.gz GZNRJFFUWJVQCY-UHFFFAOYSA-N 0 0 356.422 3.930 20 5 FHBDRN Cc1nc(NC(=O)c2ccc([N+](=O)[O-])n2C)sc1Cc1ccccc1F ZINC000515634544 944067017 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O=[N+]([O-])c1ccc(NCCCc2nnc3n2CCCCC3)c2ncccc12 ZINC000092649080 944093032 /nfs/dbraw/zinc/09/30/32/944093032.db2.gz CGYDKKIXYBNGBP-UHFFFAOYSA-N 0 0 366.425 3.506 20 5 FHBDRN CO[C@H]1c2ccccc2C[C@H]1NC(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000412492522 944096028 /nfs/dbraw/zinc/09/60/28/944096028.db2.gz AQVVQLDPKJJDIZ-PJSAGSTRSA-N 0 0 372.446 3.504 20 5 FHBDRN C[C@H](Nc1nn2cc(C3CCCC3)nc2s1)c1cccc([N+](=O)[O-])c1 ZINC000436194456 944105264 /nfs/dbraw/zinc/10/52/64/944105264.db2.gz BARZIAITMQIDBZ-NSHDSACASA-N 0 0 357.439 3.952 20 5 FHBDRN CC[C@@H](C)[C@@H](NC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21)C(F)(F)F ZINC000436197987 944108462 /nfs/dbraw/zinc/10/84/62/944108462.db2.gz LPYIFLGMYAJIIH-MEBBXXQBSA-N 0 0 357.332 3.643 20 5 FHBDRN Cn1c(C(=O)Nc2nc3c(ccc4c3CCCC4)s2)ccc1[N+](=O)[O-] ZINC000505186026 944115710 /nfs/dbraw/zinc/11/57/10/944115710.db2.gz WRPVOWLGWQDKEK-UHFFFAOYSA-N 0 0 356.407 3.674 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CS(=O)(=O)Cc1c(C)cc(C)cc1C ZINC000105523595 944118029 /nfs/dbraw/zinc/11/80/29/944118029.db2.gz FYRPAXUPXGRJNH-UHFFFAOYSA-N 0 0 363.435 3.644 20 5 FHBDRN CC(C)c1ccc(OCCNC(=O)CCOc2ccccc2[N+](=O)[O-])cc1 ZINC000515703708 944129667 /nfs/dbraw/zinc/12/96/67/944129667.db2.gz WAUXAIDFCRGNOJ-UHFFFAOYSA-N 0 0 372.421 3.682 20 5 FHBDRN COC(=O)c1c(C)csc1NC(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000515705410 944129842 /nfs/dbraw/zinc/12/98/42/944129842.db2.gz XKKUFEIBVPTTRN-SECBINFHSA-N 0 0 366.370 3.633 20 5 FHBDRN CCCOc1ccc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2C)c(C)c1 ZINC000515699346 944139867 /nfs/dbraw/zinc/13/98/67/944139867.db2.gz MZDFHKKMORDODV-UHFFFAOYSA-N 0 0 364.423 3.801 20 5 FHBDRN COc1cc(CN(C)C[C@H](C)OC)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000517263107 944142563 /nfs/dbraw/zinc/14/25/63/944142563.db2.gz VINSKJOFYOEGSZ-HNNXBMFYSA-N 0 0 374.437 3.649 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)F)cc1NCc1cnn(-c2ccccc2)c1 ZINC000436261316 944154156 /nfs/dbraw/zinc/15/41/56/944154156.db2.gz BBCIYZUMQKPMNY-UHFFFAOYSA-N 0 0 363.299 3.806 20 5 FHBDRN O=C(NC[C@@H]1CCCCC(F)(F)C1)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000517271675 944159477 /nfs/dbraw/zinc/15/94/77/944159477.db2.gz LABJZTFVYYJEBB-CYBMUJFWSA-N 0 0 367.396 3.878 20 5 FHBDRN CC[C@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1F)c1ccc(Cl)cc1 ZINC000515741402 944161178 /nfs/dbraw/zinc/16/11/78/944161178.db2.gz BLEWYKLXEQUABL-AWEZNQCLSA-N 0 0 372.805 3.817 20 5 FHBDRN CSc1ccc(CCNC(=O)NCc2cccc([N+](=O)[O-])c2C)cc1 ZINC000437848133 944162550 /nfs/dbraw/zinc/16/25/50/944162550.db2.gz CVNKIKKRMLIWHF-UHFFFAOYSA-N 0 0 359.451 3.667 20 5 FHBDRN Nc1cccc([N+](=O)[O-])c1C(=O)N1CC=C(c2ccc(Cl)cc2)CC1 ZINC000500150062 944167010 /nfs/dbraw/zinc/16/70/10/944167010.db2.gz RVIXTYUTEKINPZ-UHFFFAOYSA-N 0 0 357.797 3.760 20 5 FHBDRN CCCN(Cc1ccc(C)cc1)S(=O)(=O)c1c(C)cccc1[N+](=O)[O-] ZINC000515731224 944167913 /nfs/dbraw/zinc/16/79/13/944167913.db2.gz LWHMHRJTZJLJBW-UHFFFAOYSA-N 0 0 362.451 3.813 20 5 FHBDRN CCN([C@@H](C)c1ccc(F)cc1)S(=O)(=O)c1cc([N+](=O)[O-])ccc1C ZINC000515751377 944179194 /nfs/dbraw/zinc/17/91/94/944179194.db2.gz ICFJQDJHJHEJBI-ZDUSSCGKSA-N 0 0 366.414 3.814 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2ccc(CN3CCN(Cc4ccco4)CC3)o2)cc1 ZINC000506152767 944182889 /nfs/dbraw/zinc/18/28/89/944182889.db2.gz ZTXNEDPUURBALX-UHFFFAOYSA-N 0 0 367.405 3.766 20 5 FHBDRN O=C(N[C@@H]1C[C@H]1c1cccc(Cl)c1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000437871107 944188812 /nfs/dbraw/zinc/18/88/12/944188812.db2.gz KGRBMWJVLXYSMO-ZWKOTPCHSA-N 0 0 371.824 3.872 20 5 FHBDRN COc1ccc(C(=O)N2CCC[C@@H](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000517313083 944201321 /nfs/dbraw/zinc/20/13/21/944201321.db2.gz RELXLQHBWVAFHS-INIZCTEOSA-N 0 0 354.406 3.698 20 5 FHBDRN CCOC(=O)c1ccc(CNc2cc(C(F)(F)F)ncc2[N+](=O)[O-])cc1 ZINC000436310424 944206789 /nfs/dbraw/zinc/20/67/89/944206789.db2.gz UQUAQPZNQBSEJH-UHFFFAOYSA-N 0 0 369.299 3.797 20 5 FHBDRN Cc1ccc2c(c1)nc(CNc1cc(C(F)(F)F)ncc1[N+](=O)[O-])n2C ZINC000436327114 944208069 /nfs/dbraw/zinc/20/80/69/944208069.db2.gz FLDXAAQVBODUFU-UHFFFAOYSA-N 0 0 365.315 3.816 20 5 FHBDRN CC[C@H](NC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12)c1ccc(OC)cc1 ZINC000515786270 944212502 /nfs/dbraw/zinc/21/25/02/944212502.db2.gz LPPOORYCFMPJLN-KRWDZBQOSA-N 0 0 353.378 3.966 20 5 FHBDRN Cc1ccsc1CNC(=O)c1cc([N+](=O)[O-])cc(Br)c1C ZINC000515806641 944223093 /nfs/dbraw/zinc/22/30/93/944223093.db2.gz PZNXTAYMICAZJS-UHFFFAOYSA-N 0 0 369.240 3.966 20 5 FHBDRN Cc1cc(N[C@@H]2CCc3nc(C)ncc3C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000549489297 944225501 /nfs/dbraw/zinc/22/55/01/944225501.db2.gz VTVAXYPWXZHXBK-GFCCVEGCSA-N 0 0 366.343 3.990 20 5 FHBDRN Cc1cc(NC(=O)c2cccc(C)c2C)n(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000105587160 944227755 /nfs/dbraw/zinc/22/77/55/944227755.db2.gz JGAZKTXZPCRPMI-UHFFFAOYSA-N 0 0 350.378 3.958 20 5 FHBDRN COC(=O)Cc1cccc(Nc2ccc([N+](=O)[O-])c(OC(F)F)c2)c1 ZINC000092684718 944235051 /nfs/dbraw/zinc/23/50/51/944235051.db2.gz AVEDHTTXNRNFHW-UHFFFAOYSA-N 0 0 352.293 3.655 20 5 FHBDRN COc1ccccc1C(C)=CC(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000759789449 944235580 /nfs/dbraw/zinc/23/55/80/944235580.db2.gz WAKPEYUXNVBORU-LUAWRHEFSA-N 0 0 352.350 3.522 20 5 FHBDRN COc1cc(CN2C[C@@H](c3ccccc3)OC[C@@H]2C)c([N+](=O)[O-])cc1F ZINC000184197150 944235946 /nfs/dbraw/zinc/23/59/46/944235946.db2.gz SXPQOLMWYKCEMC-DJJJIMSYSA-N 0 0 360.385 3.705 20 5 FHBDRN CCc1ccc([C@H](CO)Nc2ccc([N+](=O)[O-])c(OC(F)F)c2)cc1 ZINC000092688411 944237531 /nfs/dbraw/zinc/23/75/31/944237531.db2.gz KWFULAWQPDWNBI-AWEZNQCLSA-N 0 0 352.337 3.904 20 5 FHBDRN Cc1cc(=O)oc2cc(OCC(=O)c3ccc([N+](=O)[O-])cc3)c(Cl)cc12 ZINC000785396210 944246616 /nfs/dbraw/zinc/24/66/16/944246616.db2.gz LHRRYLYRKJLEMJ-UHFFFAOYSA-N 0 0 373.748 3.925 20 5 FHBDRN COc1ccc(NC(=O)NCCc2ccc(SC)cc2)cc1[N+](=O)[O-] ZINC000436377188 944247507 /nfs/dbraw/zinc/24/75/07/944247507.db2.gz FXGQWNCVEODCKV-UHFFFAOYSA-N 0 0 361.423 3.690 20 5 FHBDRN COc1ccc(NC(=O)N[C@@H]2C[C@H]2c2c(F)cccc2F)cc1[N+](=O)[O-] ZINC000436378491 944247595 /nfs/dbraw/zinc/24/75/95/944247595.db2.gz MEZUYYLIPNCXKY-ZWNOBZJWSA-N 0 0 363.320 3.559 20 5 FHBDRN COc1ccc(C(=O)Nc2cc(-c3nc(C)no3)ccc2C)cc1[N+](=O)[O-] ZINC000518301635 944247904 /nfs/dbraw/zinc/24/79/04/944247904.db2.gz GZSUKZYGFGGJHZ-UHFFFAOYSA-N 0 0 368.349 3.523 20 5 FHBDRN CCc1ccc([C@@H](CO)Nc2ccc([N+](=O)[O-])c(OC(F)F)c2)cc1 ZINC000092688410 944249992 /nfs/dbraw/zinc/24/99/92/944249992.db2.gz KWFULAWQPDWNBI-CQSZACIVSA-N 0 0 352.337 3.904 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCCc2c1cnn2C ZINC000505805396 944254663 /nfs/dbraw/zinc/25/46/63/944254663.db2.gz QCWIDQBLTBZDCK-HNNXBMFYSA-N 0 0 374.466 3.638 20 5 FHBDRN CCc1ccnc(CNC(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)c1 ZINC000436379804 944264719 /nfs/dbraw/zinc/26/47/19/944264719.db2.gz ZWIPCQFXRBJNRB-UHFFFAOYSA-N 0 0 368.315 3.893 20 5 FHBDRN C[C@@H](O)C[C@@H](CNc1cc(C(F)(F)F)ncc1[N+](=O)[O-])c1ccccc1 ZINC000436394022 944270292 /nfs/dbraw/zinc/27/02/92/944270292.db2.gz VEHHOOOIFUZGIZ-YPMHNXCESA-N 0 0 369.343 3.975 20 5 FHBDRN CC(C)Oc1cc(CNc2cc(C(F)(F)F)ncc2[N+](=O)[O-])ccn1 ZINC000436398349 944274404 /nfs/dbraw/zinc/27/44/04/944274404.db2.gz FDNSNUHWEVCVPX-UHFFFAOYSA-N 0 0 356.304 3.803 20 5 FHBDRN CC(C)NC(=O)[C@H]1CCC[C@@H](Nc2cc(C(F)(F)F)ncc2[N+](=O)[O-])C1 ZINC000436398500 944274464 /nfs/dbraw/zinc/27/44/64/944274464.db2.gz VEIYMTYVTVDVKG-WDEREUQCSA-N 0 0 374.363 3.504 20 5 FHBDRN O=C(Nc1cc(F)cc([N+](=O)[O-])c1)N[C@@H]1C[C@H]1c1c(F)cccc1F ZINC000436397872 944275112 /nfs/dbraw/zinc/27/51/12/944275112.db2.gz BADPRDVJIFHSGY-BXUZGUMPSA-N 0 0 351.284 3.690 20 5 FHBDRN Cc1c(NC(=O)N2CCC=C(C)C2)cc(Br)cc1[N+](=O)[O-] ZINC000436399444 944275887 /nfs/dbraw/zinc/27/58/87/944275887.db2.gz ITVSSMMAQAPIGY-UHFFFAOYSA-N 0 0 354.204 3.850 20 5 FHBDRN C[C@H](OCc1ccccc1)C(=O)Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1 ZINC000184033990 944277315 /nfs/dbraw/zinc/27/73/15/944277315.db2.gz HPCOTQONGMGMQM-ZDUSSCGKSA-N 0 0 366.377 3.529 20 5 FHBDRN CCC1(CNC(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CCC1 ZINC000426264753 944283993 /nfs/dbraw/zinc/28/39/93/944283993.db2.gz RLHSQFOJQACUFV-UHFFFAOYSA-N 0 0 359.348 3.993 20 5 FHBDRN Cc1csc(CCCCNC(=O)C(C)(C)c2ccccc2[N+](=O)[O-])n1 ZINC000550143102 944284645 /nfs/dbraw/zinc/28/46/45/944284645.db2.gz FEJSVJQXYHHNSF-UHFFFAOYSA-N 0 0 361.467 3.776 20 5 FHBDRN COc1ccc(Cl)cc1CSCc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000105623970 944294667 /nfs/dbraw/zinc/29/46/67/944294667.db2.gz ZSYHWDBSKBVXGE-UHFFFAOYSA-N 0 0 366.826 3.789 20 5 FHBDRN COc1cc(CN2C[C@H](C)O[C@@H](c3ccsc3)C2)c([N+](=O)[O-])cc1F ZINC000184236301 944306873 /nfs/dbraw/zinc/30/68/73/944306873.db2.gz FROYGDHLQZRQQV-APPDUMDISA-N 0 0 366.414 3.766 20 5 FHBDRN CCCn1c2ccccc2nc1NC(=O)Cc1cccc([N+](=O)[O-])c1C ZINC000439081202 944321995 /nfs/dbraw/zinc/32/19/95/944321995.db2.gz VAVDRBZFGIZHCO-UHFFFAOYSA-N 0 0 352.394 3.844 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2ncn(CN(Cc3ccc(F)cc3)C3CC3)n2)c1 ZINC000123263377 944323225 /nfs/dbraw/zinc/32/32/25/944323225.db2.gz JFYXHQAMOWNEJM-UHFFFAOYSA-N 0 0 367.384 3.615 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])s1)N1CCO[C@H](c2ccc(F)cc2Cl)C1 ZINC000184249548 944328869 /nfs/dbraw/zinc/32/88/69/944328869.db2.gz ARWKGRWJBCICTR-LBPRGKRZSA-N 0 0 370.789 3.663 20 5 FHBDRN Cc1cccc(OC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)c1Cl ZINC001270654734 944338608 /nfs/dbraw/zinc/33/86/08/944338608.db2.gz AKEVIMGKXFKQBF-UHFFFAOYSA-N 0 0 357.753 3.962 20 5 FHBDRN O=c1[nH]c(N(Cc2ccco2)Cc2ccco2)nc2ccc([N+](=O)[O-])cc12 ZINC000439099113 944343331 /nfs/dbraw/zinc/34/33/31/944343331.db2.gz JFAIBEBCIVJSMB-UHFFFAOYSA-N 0 0 366.333 3.636 20 5 FHBDRN CNC(=O)c1ccc(NCc2ccc3cc(OC)ccc3c2)c([N+](=O)[O-])c1 ZINC000053555268 944343619 /nfs/dbraw/zinc/34/36/19/944343619.db2.gz MSRFMKPFWNVTFP-UHFFFAOYSA-N 0 0 365.389 3.728 20 5 FHBDRN Cc1ccc(C[C@H]2CCCN(C(=O)Cc3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000518419540 944350741 /nfs/dbraw/zinc/35/07/41/944350741.db2.gz SQPYSINZOUHTQI-LJQANCHMSA-N 0 0 352.434 3.927 20 5 FHBDRN Cc1nn([C@@H](C(=O)Nc2ccc(C)cc2)c2ccccc2)cc1[N+](=O)[O-] ZINC000436472878 944352461 /nfs/dbraw/zinc/35/24/61/944352461.db2.gz BJNZXBXKRDSLDS-GOSISDBHSA-N 0 0 350.378 3.636 20 5 FHBDRN Cc1nn([C@H](C)c2cccc(NC(=O)c3ccccc3)c2)cc1[N+](=O)[O-] ZINC000436473362 944353684 /nfs/dbraw/zinc/35/36/84/944353684.db2.gz HNVCNEQEOWRIBT-CQSZACIVSA-N 0 0 350.378 3.961 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N1CCC(OC2CCCCC2)CC1 ZINC000123356755 944356309 /nfs/dbraw/zinc/35/63/09/944356309.db2.gz HFISWPPBNBYCIT-UHFFFAOYSA-N 0 0 362.426 3.557 20 5 FHBDRN Cc1ccc(OC[C@H](O)Cc2ccc(C(F)(F)F)cc2)cc1[N+](=O)[O-] ZINC000550179359 944358793 /nfs/dbraw/zinc/35/87/93/944358793.db2.gz XIXNDYNFSQGKTJ-CQSZACIVSA-N 0 0 355.312 3.904 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1OC[C@@H](O)COCc1ccc(Cl)cc1 ZINC000550179400 944358945 /nfs/dbraw/zinc/35/89/45/944358945.db2.gz ZEMRJHXZEQTVBU-INIZCTEOSA-N 0 0 351.786 3.513 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)N(CCC(F)(F)F)CC1CC1 ZINC000438138244 944363546 /nfs/dbraw/zinc/36/35/46/944363546.db2.gz AEYHSFFMOWQNLI-UHFFFAOYSA-N 0 0 369.343 3.741 20 5 FHBDRN C[C@H]1CN(C(=O)c2ccc(Cl)cc2[N+](=O)[O-])C[C@H](c2ccccc2)O1 ZINC000140074273 944364529 /nfs/dbraw/zinc/36/45/29/944364529.db2.gz YJOPBTGRVWASQN-YVEFUNNKSA-N 0 0 360.797 3.850 20 5 FHBDRN COc1ccc(S(=O)(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)c(C)c1C ZINC000473755937 944364909 /nfs/dbraw/zinc/36/49/09/944364909.db2.gz IXKNTQQDMHZUGD-UHFFFAOYSA-N 0 0 364.423 3.638 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(C(=O)NC[C@@]2(C)CCOC3(CCC3)C2)c1F ZINC000894655852 944366251 /nfs/dbraw/zinc/36/62/51/944366251.db2.gz KIYJGKIJNPMGOE-KRWDZBQOSA-N 0 0 350.390 3.512 20 5 FHBDRN O=C(Nc1ccc2[nH]c(-c3ccccc3)nc2c1)c1ccc([N+](=O)[O-])cn1 ZINC000515957313 944367736 /nfs/dbraw/zinc/36/77/36/944367736.db2.gz PUGZDFTVNAGIPG-UHFFFAOYSA-N 0 0 359.345 3.785 20 5 FHBDRN CCc1cc(NCc2ccc(O)cc2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000053556619 944368303 /nfs/dbraw/zinc/36/83/03/944368303.db2.gz JKSQQHHRLDWNPX-UHFFFAOYSA-N 0 0 350.378 3.932 20 5 FHBDRN CNC(=O)c1ccc(Nc2cccc(OCC(F)(F)F)c2)c([N+](=O)[O-])c1 ZINC000053560237 944368664 /nfs/dbraw/zinc/36/86/64/944368664.db2.gz LGQAKKHFFQKNOE-UHFFFAOYSA-N 0 0 369.299 3.639 20 5 FHBDRN CCn1c(SCc2ccc([N+](=O)[O-])cc2F)nnc1-c1ccccn1 ZINC000123522935 944374202 /nfs/dbraw/zinc/37/42/02/944374202.db2.gz FAOWPKNKJDMBCC-UHFFFAOYSA-N 0 0 359.386 3.700 20 5 FHBDRN C[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)[C@H]1Oc2ccccc2[C@H]1C ZINC000438141602 944374512 /nfs/dbraw/zinc/37/45/12/944374512.db2.gz PYVHCNLONVGVPT-RLFDGXBXSA-N 0 0 360.797 3.931 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)[C@@H]2Oc3ccccc3[C@@H]2C)c1 ZINC000438141543 944374531 /nfs/dbraw/zinc/37/45/31/944374531.db2.gz KMYKZQBGIASVIM-VNBZBWLYSA-N 0 0 372.446 4.000 20 5 FHBDRN Cc1cc(NC(=O)NC[C@@H]2CCO[C@@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000473765977 944376288 /nfs/dbraw/zinc/37/62/88/944376288.db2.gz QUIHCIXMVNKSBB-MAUKXSAKSA-N 0 0 355.394 3.803 20 5 FHBDRN O=C(c1c(Cl)cccc1[N+](=O)[O-])N1CCc2c(F)ccc(F)c2C1 ZINC000438149956 944380736 /nfs/dbraw/zinc/38/07/36/944380736.db2.gz VJKUBOVBSXDPQM-UHFFFAOYSA-N 0 0 352.724 3.725 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cnc(CC2CC2)nc1 ZINC000500272340 944381262 /nfs/dbraw/zinc/38/12/62/944381262.db2.gz OYNPIWHMJNRDMN-UHFFFAOYSA-N 0 0 369.425 3.780 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)N1CCc2c(F)ccc(F)c2C1 ZINC000438170248 944383568 /nfs/dbraw/zinc/38/35/68/944383568.db2.gz YUPVCKDDEWNFNO-UHFFFAOYSA-N 0 0 364.373 3.550 20 5 FHBDRN Cc1ccc(NC(=O)C(C)C)cc1NC(=O)c1cc(F)cc([N+](=O)[O-])c1 ZINC000517557971 944389499 /nfs/dbraw/zinc/38/94/99/944389499.db2.gz VMJPLCKDZIEXLF-UHFFFAOYSA-N 0 0 359.357 3.889 20 5 FHBDRN CC(C)COc1ccccc1N[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000517557610 944390282 /nfs/dbraw/zinc/39/02/82/944390282.db2.gz OTKNPWFFJSBROD-GOSISDBHSA-N 0 0 369.421 3.847 20 5 FHBDRN CC(C)(CNC(=O)COc1cccc([N+](=O)[O-])c1)c1ccc(Cl)cc1 ZINC000515980573 944392262 /nfs/dbraw/zinc/39/22/62/944392262.db2.gz PUHSFTXEVRNVFT-UHFFFAOYSA-N 0 0 362.813 3.721 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@H]1CCC[C@H]1c1ccccc1 ZINC000518440237 944392495 /nfs/dbraw/zinc/39/24/95/944392495.db2.gz FBLAIHICLKIYOZ-IRXDYDNUSA-N 0 0 360.435 3.518 20 5 FHBDRN O=[N+]([O-])c1ccccc1-c1ccc(CN2CCOc3cc(O)ccc3C2)o1 ZINC000518439737 944393133 /nfs/dbraw/zinc/39/31/33/944393133.db2.gz GUKXQUUXSLFKLN-UHFFFAOYSA-N 0 0 366.373 3.955 20 5 FHBDRN CC(C)COC[C@@H](NC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccco1 ZINC000518458401 944397938 /nfs/dbraw/zinc/39/79/38/944397938.db2.gz KLDXMAMSWZHUBP-WMLDXEAASA-N 0 0 360.410 3.821 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@](C)(O)[C@@H](C)CC ZINC000506500599 944400629 /nfs/dbraw/zinc/40/06/29/944400629.db2.gz QTISGIBQAXNRHM-YVEFUNNKSA-N 0 0 354.472 3.624 20 5 FHBDRN Cc1c(C(=O)Nc2ccnn2Cc2ccccc2F)cccc1[N+](=O)[O-] ZINC000105974062 944406365 /nfs/dbraw/zinc/40/63/65/944406365.db2.gz YMGJLSUQQPPPKC-UHFFFAOYSA-N 0 0 354.341 3.539 20 5 FHBDRN C[C@@H](NC(=O)Cc1coc(-c2cccs2)n1)c1cccc([N+](=O)[O-])c1 ZINC000105952485 944410432 /nfs/dbraw/zinc/41/04/32/944410432.db2.gz SWNLIRMPRSLULO-LLVKDONJSA-N 0 0 357.391 3.731 20 5 FHBDRN Cc1ccc2oc(C(=O)N3CCN(c4cccc([N+](=O)[O-])c4)CC3)cc2c1 ZINC000516007627 944411918 /nfs/dbraw/zinc/41/19/18/944411918.db2.gz DNUXEGSJFSCMDO-UHFFFAOYSA-N 0 0 365.389 3.612 20 5 FHBDRN Cc1cc(F)c([N+](=O)[O-])cc1C(=O)NC[C@H](C)Oc1ccc(Cl)cc1 ZINC001126448123 944416341 /nfs/dbraw/zinc/41/63/41/944416341.db2.gz TVYZDSLHOACSHC-NSHDSACASA-N 0 0 366.776 3.893 20 5 FHBDRN Cc1cc(NC(=O)NCCc2cc(F)c(F)c(F)c2)ccc1[N+](=O)[O-] ZINC000473774844 944416762 /nfs/dbraw/zinc/41/67/62/944416762.db2.gz JHBVOTMQEBWAFL-UHFFFAOYSA-N 0 0 353.300 3.685 20 5 FHBDRN COc1ccc(CNC(=O)c2c[nH]cc2-c2ccccc2)cc1[N+](=O)[O-] ZINC000515998975 944419357 /nfs/dbraw/zinc/41/93/57/944419357.db2.gz HKGACDXOOTWGGT-UHFFFAOYSA-N 0 0 351.362 3.529 20 5 FHBDRN CCOc1cc(NC(=O)N(C)CC2CCC2)c([N+](=O)[O-])cc1OCC ZINC000111715364 944419796 /nfs/dbraw/zinc/41/97/96/944419796.db2.gz NARQUCBDMFOPED-UHFFFAOYSA-N 0 0 351.403 3.656 20 5 FHBDRN C[C@@H]1C[C@@H](CCNC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)C[C@H](C)O1 ZINC000517592661 944424687 /nfs/dbraw/zinc/42/46/87/944424687.db2.gz ZPYHSRVSONHRTN-ZSBIGDGJSA-N 0 0 372.368 3.520 20 5 FHBDRN Cc1cc(NC(=O)N[C@H](C)c2ccc([S@@](C)=O)cc2)ccc1[N+](=O)[O-] ZINC000473774327 944426812 /nfs/dbraw/zinc/42/68/12/944426812.db2.gz SFJUOEUWEYFWHE-XELLLNAOSA-N 0 0 361.423 3.523 20 5 FHBDRN CC[C@H](NC(=O)CSCc1ccc(OC)c([N+](=O)[O-])c1)C(C)(C)C ZINC000518484266 944428808 /nfs/dbraw/zinc/42/88/08/944428808.db2.gz PBZFEHWZKBPGCA-HNNXBMFYSA-N 0 0 354.472 3.778 20 5 FHBDRN Cc1cc(NCC(=O)N2CCc3ccc([N+](=O)[O-])cc32)c(Cl)cc1F ZINC000506193887 944439555 /nfs/dbraw/zinc/43/95/55/944439555.db2.gz PPVBSLRIDBRVIK-UHFFFAOYSA-N 0 0 363.776 3.697 20 5 FHBDRN CCN(C(=O)c1sc(Br)cc1[N+](=O)[O-])c1cccnc1C ZINC000439233033 944447027 /nfs/dbraw/zinc/44/70/27/944447027.db2.gz YHJNZDBMUAEHRB-UHFFFAOYSA-N 0 0 370.228 3.789 20 5 FHBDRN Cc1cc(Br)ccc1CNC(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000110324608 944452441 /nfs/dbraw/zinc/45/24/41/944452441.db2.gz WCUSFZNOXMBJLR-UHFFFAOYSA-N 0 0 363.211 3.525 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)c1cccc(OC(C)C)c1 ZINC000046809914 944453849 /nfs/dbraw/zinc/45/38/49/944453849.db2.gz ZOGAPQSREZAGLP-CYBMUJFWSA-N 0 0 358.394 3.882 20 5 FHBDRN COc1ccccc1Oc1ccc(CNC(=O)c2ccc([N+](=O)[O-])o2)cc1 ZINC000110359516 944455617 /nfs/dbraw/zinc/45/56/17/944455617.db2.gz LUAIIKMLPFHLNR-UHFFFAOYSA-N 0 0 368.345 3.919 20 5 FHBDRN CN(Cc1nc(-c2cccs2)no1)c1nc2c(cc1[N+](=O)[O-])CCCC2 ZINC000516054321 944456566 /nfs/dbraw/zinc/45/65/66/944456566.db2.gz GFWWMZOHJNBZLM-UHFFFAOYSA-N 0 0 371.422 3.617 20 5 FHBDRN CC[C@@H]1CCCCN1C(=O)[C@H](C)OC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000011028878 944457982 /nfs/dbraw/zinc/45/79/82/944457982.db2.gz RBTGPXHNPJQECX-NWDGAFQWSA-N 0 0 368.817 3.585 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2nnc(CN[C@@H]3CCCC[C@@H]3C(F)(F)F)o2)cc1 ZINC000516058418 944460063 /nfs/dbraw/zinc/46/00/63/944460063.db2.gz AMAQRHQSSJYLEU-QWHCGFSZSA-N 0 0 370.331 3.856 20 5 FHBDRN CCCC(=O)Nc1ccc(CNC(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000046848164 944463821 /nfs/dbraw/zinc/46/38/21/944463821.db2.gz YUOSRCBEJJCWOI-UHFFFAOYSA-N 0 0 356.382 3.655 20 5 FHBDRN Cc1nnc(-c2cccc(NC(=O)Nc3ccc([N+](=O)[O-])c(C)c3)c2)n1C ZINC000473788872 944466777 /nfs/dbraw/zinc/46/67/77/944466777.db2.gz QXJOTGZECIOISW-UHFFFAOYSA-N 0 0 366.381 3.651 20 5 FHBDRN CCCCOc1ccc(CCNC(=O)c2cc([N+](=O)[O-])ccc2OC)cc1 ZINC000500306441 944467325 /nfs/dbraw/zinc/46/73/25/944467325.db2.gz JMTRKVVYOCZEKT-UHFFFAOYSA-N 0 0 372.421 3.755 20 5 FHBDRN Cc1cccc(NC(=O)[C@H](C)OC(=O)CSc2ccccc2[N+](=O)[O-])c1 ZINC000025059432 944477087 /nfs/dbraw/zinc/47/70/87/944477087.db2.gz SWNPDCITMVRCPS-ZDUSSCGKSA-N 0 0 374.418 3.566 20 5 FHBDRN O=[N+]([O-])c1ccc(NC(=S)N2CCC(OCc3ccccc3)CC2)cc1 ZINC000017516552 944478689 /nfs/dbraw/zinc/47/86/89/944478689.db2.gz QYZQWRJGJDVZTN-UHFFFAOYSA-N 0 0 371.462 3.973 20 5 FHBDRN O=C(c1cccc([N+](=O)[O-])c1Br)N1CCC[C@@H]2CCC[C@@H]21 ZINC000159127662 944480163 /nfs/dbraw/zinc/48/01/63/944480163.db2.gz LCGCNHYEVWESCP-JQWIXIFHSA-N 0 0 353.216 3.762 20 5 FHBDRN O=C(NC1CC1)c1ccc(CN(Cc2csc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000054174015 944482155 /nfs/dbraw/zinc/48/21/55/944482155.db2.gz VRONITYBPADRQK-UHFFFAOYSA-N 0 0 371.462 3.713 20 5 FHBDRN CO[C@H](c1ccc(F)cc1)[C@@H](C)NC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000517662599 944485822 /nfs/dbraw/zinc/48/58/22/944485822.db2.gz HLYNEEXHVBLCJY-VFVRVIDISA-N 0 0 360.385 3.730 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](c1ccccc1)c1ccccn1 ZINC000072753213 944488314 /nfs/dbraw/zinc/48/83/14/944488314.db2.gz VDDCRACVGDFTLX-IBGZPJMESA-N 0 0 363.373 3.518 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCN(C)c2ccccc21 ZINC000110474865 944499986 /nfs/dbraw/zinc/49/99/86/944499986.db2.gz UDJLYVZFSZUVNB-ZDUSSCGKSA-N 0 0 357.435 3.558 20 5 FHBDRN CN(C(=O)CCSc1ccc(Cl)cc1)c1ccc([N+](=O)[O-])nc1 ZINC000439285608 944503341 /nfs/dbraw/zinc/50/33/41/944503341.db2.gz OXKBUFAHCUZYBP-UHFFFAOYSA-N 0 0 351.815 3.788 20 5 FHBDRN COCC1(Nc2ccc(C(=O)Nc3ccc(C)cc3)cc2[N+](=O)[O-])CC1 ZINC000516124729 944506533 /nfs/dbraw/zinc/50/65/33/944506533.db2.gz WHXKQFSFODZVTI-UHFFFAOYSA-N 0 0 355.394 3.746 20 5 FHBDRN O=[N+]([O-])c1ccc2c(ccnc2N2CCN(Cc3ccsc3)CC2)c1 ZINC000584570748 944507007 /nfs/dbraw/zinc/50/70/07/944507007.db2.gz ANEBVHBKFNMTCU-UHFFFAOYSA-N 0 0 354.435 3.527 20 5 FHBDRN Cc1nn(Cc2ccn(-c3ccccc3F)n2)c2ccc([N+](=O)[O-])cc12 ZINC000438323391 944509409 /nfs/dbraw/zinc/50/94/09/944509409.db2.gz PIPFCCBDMNIEPI-UHFFFAOYSA-N 0 0 351.341 3.626 20 5 FHBDRN C[C@@H]1C[C@H](C(F)(F)F)CCN1C(=O)CSc1ccccc1[N+](=O)[O-] ZINC000452643336 944522356 /nfs/dbraw/zinc/52/23/56/944522356.db2.gz ALTRSWJZZLPYJZ-GHMZBOCLSA-N 0 0 362.373 3.876 20 5 FHBDRN COc1ccc(Br)cc1CN(C)Cc1cccc([N+](=O)[O-])c1 ZINC000015296689 944522826 /nfs/dbraw/zinc/52/28/26/944522826.db2.gz AUSBSEZTFVFHFV-UHFFFAOYSA-N 0 0 365.227 3.998 20 5 FHBDRN O=C(NCCc1ccccc1[N+](=O)[O-])N[C@H]1CCc2sc(Cl)cc21 ZINC000519571777 944523039 /nfs/dbraw/zinc/52/30/39/944523039.db2.gz KVZSKKCVARJGQQ-LBPRGKRZSA-N 0 0 365.842 3.839 20 5 FHBDRN C[C@@H]1CO[C@@H](c2ccccc2Cl)CN1C(=O)c1ccc([N+](=O)[O-])cc1 ZINC000110518294 944524005 /nfs/dbraw/zinc/52/40/05/944524005.db2.gz YIIHJOXCSMLLGV-SJKOYZFVSA-N 0 0 360.797 3.850 20 5 FHBDRN Cn1cc([N+](=O)[O-])cc1C(=O)Nc1cccc(OCc2cccc(F)c2)c1 ZINC000516140449 944527724 /nfs/dbraw/zinc/52/77/24/944527724.db2.gz ZCAVYIUDWDLBHS-UHFFFAOYSA-N 0 0 369.352 3.904 20 5 FHBDRN COc1ccc(NC(=O)NCC(C)(C)Oc2ccccc2)cc1[N+](=O)[O-] ZINC000543886799 944529272 /nfs/dbraw/zinc/52/92/72/944529272.db2.gz YIDSKSMHZNXRJM-UHFFFAOYSA-N 0 0 359.382 3.583 20 5 FHBDRN Cc1c(NC(=O)[C@@H](C)N2CC[C@](F)(c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000516162277 944531902 /nfs/dbraw/zinc/53/19/02/944531902.db2.gz UJCVBOSOLNSBSW-FOIQADDNSA-N 0 0 371.412 3.801 20 5 FHBDRN COc1cc(CN(Cc2ccccc2)[C@@H](C)CCO)c([N+](=O)[O-])cc1F ZINC000184296064 944532769 /nfs/dbraw/zinc/53/27/69/944532769.db2.gz LWRPGIXQJFDGQV-AWEZNQCLSA-N 0 0 362.401 3.516 20 5 FHBDRN Cn1ccnc1[C@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000017590318 944543837 /nfs/dbraw/zinc/54/38/37/944543837.db2.gz NLCLBPPPXAYUHL-MRXNPFEDSA-N 0 0 371.328 3.577 20 5 FHBDRN CC(C)(C)c1cc(NC(=O)CNc2ccccc2[N+](=O)[O-])n(C(C)(C)C)n1 ZINC000110564482 944544720 /nfs/dbraw/zinc/54/47/20/944544720.db2.gz FNTFFNSULJQVOH-UHFFFAOYSA-N 0 0 373.457 3.894 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@]1(Cc2ccc(Cl)cc2)CCOC1 ZINC000500336457 944546203 /nfs/dbraw/zinc/54/62/03/944546203.db2.gz VVVRUXBNVKLIDD-IBGZPJMESA-N 0 0 374.824 3.688 20 5 FHBDRN CC1(CNC(=O)c2cc([N+](=O)[O-])ccc2Br)CC(F)(F)C1 ZINC000893359187 944563064 /nfs/dbraw/zinc/56/30/64/944563064.db2.gz TWUPPYIQGDHWDS-UHFFFAOYSA-N 0 0 363.158 3.523 20 5 FHBDRN CN(Cc1ccccc1-c1ccccc1)C(=O)CCn1cc([N+](=O)[O-])cn1 ZINC000506557044 944566540 /nfs/dbraw/zinc/56/65/40/944566540.db2.gz CJKVVPSDCVUOFQ-UHFFFAOYSA-N 0 0 364.405 3.507 20 5 FHBDRN COC(=O)c1cc(C)nc(N2CC[C@@H](C)C[C@@H]2c2ccco2)c1[N+](=O)[O-] ZINC000516198576 944570780 /nfs/dbraw/zinc/57/07/80/944570780.db2.gz YLHRXIBAKKKJKK-BXUZGUMPSA-N 0 0 359.382 3.655 20 5 FHBDRN C[C@@H](NC(=O)COc1c(Cl)cncc1[N+](=O)[O-])c1ccccc1Cl ZINC000506561278 944572625 /nfs/dbraw/zinc/57/26/25/944572625.db2.gz LWUJNMVOFQQFKK-SECBINFHSA-N 0 0 370.192 3.553 20 5 FHBDRN CSc1ccc(C(=O)N2CC[C@H](Oc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000517746250 944572813 /nfs/dbraw/zinc/57/28/13/944572813.db2.gz XXIDFGJWYNBCDS-HNNXBMFYSA-N 0 0 358.419 3.610 20 5 FHBDRN CSCCCN(C)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000439381651 944573986 /nfs/dbraw/zinc/57/39/86/944573986.db2.gz FABBAMNFEWMTQU-UHFFFAOYSA-N 0 0 351.350 3.830 20 5 FHBDRN CSCc1cccc(CNC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)c1 ZINC000438395731 944574350 /nfs/dbraw/zinc/57/43/50/944574350.db2.gz GVAGVMTXFINBHG-UHFFFAOYSA-N 0 0 371.462 3.962 20 5 FHBDRN CO[C@@H]1C[C@@H](c2ccccc2)CC[C@@H]1NC(=O)Cc1ccccc1[N+](=O)[O-] ZINC000517767006 944586928 /nfs/dbraw/zinc/58/69/28/944586928.db2.gz QIIHCWYRNUGUSP-XKGZKEIXSA-N 0 0 368.433 3.605 20 5 FHBDRN COc1ccccc1[C@@]1(C)C[C@H]1NC(=O)c1c(C)ccc([N+](=O)[O-])c1C ZINC001126466706 944587276 /nfs/dbraw/zinc/58/72/76/944587276.db2.gz QYNRXSKWBLDPOX-YLJYHZDGSA-N 0 0 354.406 3.680 20 5 FHBDRN CN(Cc1cc2ccccc2o1)C(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000516210463 944591320 /nfs/dbraw/zinc/59/13/20/944591320.db2.gz LEUUTNXLILJDRI-UHFFFAOYSA-N 0 0 360.316 3.820 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(N3CCCC3)c(F)c2)c1 ZINC000147451394 944598509 /nfs/dbraw/zinc/59/85/09/944598509.db2.gz DSYSOTOBSILIFD-UHFFFAOYSA-N 0 0 359.357 3.595 20 5 FHBDRN Cc1ncc(NC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)c(C2CC2)n1 ZINC000439429280 944606695 /nfs/dbraw/zinc/60/66/95/944606695.db2.gz YIDRWWRQMLPWDG-UHFFFAOYSA-N 0 0 367.409 3.767 20 5 FHBDRN CC[C@@H](C)C(=O)Nc1cccc(CNC(=O)Nc2cccc([N+](=O)[O-])c2)c1 ZINC000047139454 944612913 /nfs/dbraw/zinc/61/29/13/944612913.db2.gz SZKXNCIZVYHDSO-CYBMUJFWSA-N 0 0 370.409 3.901 20 5 FHBDRN CC(C)(CCCc1ccccc1)CNc1nccc(C(N)=O)c1[N+](=O)[O-] ZINC000517791626 944615334 /nfs/dbraw/zinc/61/53/34/944615334.db2.gz QLIQRSLCFKLXDU-UHFFFAOYSA-N 0 0 356.426 3.550 20 5 FHBDRN Cc1ccc(Cl)cc1NC(=O)COc1c(Cl)cncc1[N+](=O)[O-] ZINC000506577841 944623899 /nfs/dbraw/zinc/62/38/99/944623899.db2.gz KKIIJLSGOJYMLT-UHFFFAOYSA-N 0 0 356.165 3.623 20 5 FHBDRN COc1ccc(-c2noc(C(C)(C)c3ccccc3[N+](=O)[O-])n2)cc1OC ZINC000426388714 944625390 /nfs/dbraw/zinc/62/53/90/944625390.db2.gz AKZZMXIKWLTCGP-UHFFFAOYSA-N 0 0 369.377 3.988 20 5 FHBDRN COc1cc(C(=O)NCc2ccc(C(F)(F)F)cc2)ccc1[N+](=O)[O-] ZINC000133913536 944627814 /nfs/dbraw/zinc/62/78/14/944627814.db2.gz FCQLVKGKWHDHCE-UHFFFAOYSA-N 0 0 354.284 3.552 20 5 FHBDRN CC(C)(C(=O)NCCNc1ccc([N+](=O)[O-])cc1)c1ccc(Cl)cc1 ZINC000517786089 944628511 /nfs/dbraw/zinc/62/85/11/944628511.db2.gz VTYHBKSIAIJDID-UHFFFAOYSA-N 0 0 361.829 3.754 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(N3CCCC3=O)cc2)c1 ZINC000018230915 944655878 /nfs/dbraw/zinc/65/58/78/944655878.db2.gz YDYQOJDNMCNMQT-UHFFFAOYSA-N 0 0 371.418 3.696 20 5 FHBDRN C[C@@H](CC(=O)OC(C)(C)C)Oc1ccc([N+](=O)[O-])cc1Br ZINC001226040749 944674703 /nfs/dbraw/zinc/67/47/03/944674703.db2.gz IEMIMPPYBNZWOD-VIFPVBQESA-N 0 0 360.204 3.856 20 5 FHBDRN CCCCOc1ccc(C(=O)N(C)CCc2ccccc2[N+](=O)[O-])c(O)c1 ZINC000436828474 944675888 /nfs/dbraw/zinc/67/58/88/944675888.db2.gz HZVSUSFALORPCN-UHFFFAOYSA-N 0 0 372.421 3.794 20 5 FHBDRN Cc1ccc([C@@H]2CCCN2S(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1C ZINC000518734156 944686050 /nfs/dbraw/zinc/68/60/50/944686050.db2.gz JDXPJYKJWGVFCY-SFHVURJKSA-N 0 0 360.435 3.737 20 5 FHBDRN CC(C)(c1nc(Cc2ccccc2[N+](=O)[O-])no1)c1ccc2c(c1)OCO2 ZINC000426405352 944689145 /nfs/dbraw/zinc/68/91/45/944689145.db2.gz LVSROXQFIAEHDA-UHFFFAOYSA-N 0 0 367.361 3.623 20 5 FHBDRN C[C@H]1CC[C@@H]1NC(=O)c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1 ZINC000557150682 944694020 /nfs/dbraw/zinc/69/40/20/944694020.db2.gz HRZHBBIPBTVQBF-UFBFGSQYSA-N 0 0 369.208 3.616 20 5 FHBDRN CCOCc1ccccc1CNC(=O)CSc1ccccc1[N+](=O)[O-] ZINC000506862234 944694233 /nfs/dbraw/zinc/69/42/33/944694233.db2.gz ZYLRIFPFCCKJQW-UHFFFAOYSA-N 0 0 360.435 3.540 20 5 FHBDRN Cc1cc(F)ccc1C1CCN(C(=O)COc2ccc([N+](=O)[O-])cc2)CC1 ZINC000516303645 944705078 /nfs/dbraw/zinc/70/50/78/944705078.db2.gz HMLGXBQFMVKEOR-UHFFFAOYSA-N 0 0 372.396 3.827 20 5 FHBDRN O=C(Nc1nc(-c2cccc(O)c2)cs1)c1cc(F)cc([N+](=O)[O-])c1 ZINC000439530547 944716312 /nfs/dbraw/zinc/71/63/12/944716312.db2.gz YNUIOXWOOYCVLL-UHFFFAOYSA-N 0 0 359.338 3.815 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H](C)[C@@H]1Oc2ccccc2[C@@H]1C ZINC000438507628 944716973 /nfs/dbraw/zinc/71/69/73/944716973.db2.gz UIPDUIBSXCOBKG-VNBZBWLYSA-N 0 0 371.393 3.678 20 5 FHBDRN Cc1ccc(N2CCN(C(=O)/C=C/c3ccc([N+](=O)[O-])cc3)CC2)cc1C ZINC000759882479 944718025 /nfs/dbraw/zinc/71/80/25/944718025.db2.gz OSGCPYHNAWBLLD-UXBLZVDNSA-N 0 0 365.433 3.574 20 5 FHBDRN COc1cc(Br)c(/C=C/c2ccc([N+](=O)[O-])cn2)cc1OC ZINC000439519995 944723493 /nfs/dbraw/zinc/72/34/93/944723493.db2.gz KTBKVYFRUHNFMW-ONEGZZNKSA-N 0 0 365.183 3.940 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])Nc1ccc(OC(F)(F)F)cc1 ZINC000516329649 944729998 /nfs/dbraw/zinc/72/99/98/944729998.db2.gz YSXCDJPGRFIKRM-UHFFFAOYSA-N 0 0 355.272 3.544 20 5 FHBDRN O=C(Cn1cc2ccccc2n1)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000436867034 944732057 /nfs/dbraw/zinc/73/20/57/944732057.db2.gz BXIQKWAXNGHYRK-UHFFFAOYSA-N 0 0 364.283 3.602 20 5 FHBDRN C[C@@]1(C(=O)[O-])CCCC[C@H]1[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000426729002 944736953 /nfs/dbraw/zinc/73/69/53/944736953.db2.gz ZDKNPURPEBKPFZ-IEBWSBKVSA-N 0 0 358.394 3.978 20 5 FHBDRN O=C(Nc1nc(C(F)(F)F)c[nH]1)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000506912286 944739016 /nfs/dbraw/zinc/73/90/16/944739016.db2.gz QRJWIXKPAHLWMO-UHFFFAOYSA-N 0 0 372.306 3.676 20 5 FHBDRN O=C(c1nc(Cl)ccc1F)N1CCS[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000759888121 944748668 /nfs/dbraw/zinc/74/86/68/944748668.db2.gz FCPRLPPDCCOVCJ-HNNXBMFYSA-N 0 0 367.789 3.670 20 5 FHBDRN O=C(N[C@@H]1C[C@H]1C1CCCCC1)c1ccn(-c2ccc([N+](=O)[O-])cc2F)n1 ZINC001270677721 944752351 /nfs/dbraw/zinc/75/23/51/944752351.db2.gz YGYGPIAJLZDHJW-WMLDXEAASA-N 0 0 372.400 3.618 20 5 FHBDRN O=C(NCCSc1ccccc1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000015136531 944755113 /nfs/dbraw/zinc/75/51/13/944755113.db2.gz XZJQDQFLOASOTR-UHFFFAOYSA-N 0 0 371.462 3.717 20 5 FHBDRN Cc1nc(Cc2nnc(SCc3csc([N+](=O)[O-])c3)o2)cs1 ZINC000047171619 944755751 /nfs/dbraw/zinc/75/57/51/944755751.db2.gz HDSKLUGALHNQAI-UHFFFAOYSA-N 0 0 354.438 3.687 20 5 FHBDRN Cc1csc(Sc2ccc(C(=O)N3C[C@H](C)[C@H]3C)cc2[N+](=O)[O-])n1 ZINC000509612515 944755840 /nfs/dbraw/zinc/75/58/40/944755840.db2.gz CMYLLMDUFIZFFH-GXSJLCMTSA-N 0 0 363.464 3.991 20 5 FHBDRN O=C(Nc1nnc(CC2CCCCC2)s1)c1cc(F)cc([N+](=O)[O-])c1 ZINC000518789454 944770391 /nfs/dbraw/zinc/77/03/91/944770391.db2.gz UMVNPJMCCUICNV-UHFFFAOYSA-N 0 0 364.402 3.961 20 5 FHBDRN CC[C@@H](CO)N(Cc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1F ZINC000426061283 944773735 /nfs/dbraw/zinc/77/37/35/944773735.db2.gz MZEWZOYWAYWCJZ-AWEZNQCLSA-N 0 0 361.373 3.539 20 5 FHBDRN O=C(CCC1CCCC1)N1CCN(C/C=C\c2ccccc2[N+](=O)[O-])CC1 ZINC000506618154 944776102 /nfs/dbraw/zinc/77/61/02/944776102.db2.gz RZWQXYYBMZLITJ-UITAMQMPSA-N 0 0 371.481 3.723 20 5 FHBDRN C[C@H](C(=O)N1CCC(c2ccc(O)cc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000516378348 944779963 /nfs/dbraw/zinc/77/99/63/944779963.db2.gz PSSHYDRZEOVGRS-AWEZNQCLSA-N 0 0 354.406 3.810 20 5 FHBDRN O=C(c1cc(NCc2ccc(F)c(F)c2)ccc1[N+](=O)[O-])N1CCCC1 ZINC000516365633 944788650 /nfs/dbraw/zinc/78/86/50/944788650.db2.gz HNGFKBWELANLSE-UHFFFAOYSA-N 0 0 361.348 3.721 20 5 FHBDRN CNc1ccc(C(=O)NC[C@@H]2CCCO[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000140337040 944795879 /nfs/dbraw/zinc/79/58/79/944795879.db2.gz UBUWXIRFVJJPIX-LPHOPBHVSA-N 0 0 369.421 3.534 20 5 FHBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)N1CCC(COc2ccccc2)CC1 ZINC000729430807 944797782 /nfs/dbraw/zinc/79/77/82/944797782.db2.gz AAZMKRNLIRPBIT-FLIBITNWSA-N 0 0 366.417 3.926 20 5 FHBDRN COc1ccc(C2(NC(=O)CSc3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000518808113 944801729 /nfs/dbraw/zinc/80/17/29/944801729.db2.gz ZRCFFXZPNDEZHH-UHFFFAOYSA-N 0 0 358.419 3.501 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1[O-])N1CCC(c2cccc(Cl)c2)CC1 ZINC000436920250 944803347 /nfs/dbraw/zinc/80/33/47/944803347.db2.gz GAJXSJCTGMODBP-UHFFFAOYSA-N 0 0 360.797 3.974 20 5 FHBDRN O=C([O-])[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1ccc(Cl)c(Cl)c1 ZINC000426767294 944805266 /nfs/dbraw/zinc/80/52/66/944805266.db2.gz LRMRLPHMYRGQSY-HNNXBMFYSA-N 0 0 369.204 3.687 20 5 FHBDRN Cc1cc2cc(C[NH2+][C@@H](Cc3ccc([N+](=O)[O-])cc3)C(=O)[O-])oc2cc1C ZINC000426789408 944813243 /nfs/dbraw/zinc/81/32/43/944813243.db2.gz ULIJPSRBLVAEQJ-SFHVURJKSA-N 0 0 368.389 3.743 20 5 FHBDRN COc1cccc(C2(c3noc(-c4n[nH]c(C(C)C)c4[N+](=O)[O-])n3)CC2)c1 ZINC000518836649 944828020 /nfs/dbraw/zinc/82/80/20/944828020.db2.gz KPNOTXROWPDNPD-UHFFFAOYSA-N 0 0 369.381 3.580 20 5 FHBDRN O=C([O-])[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1ccc(Cl)cc1Cl ZINC000426809801 944831396 /nfs/dbraw/zinc/83/13/96/944831396.db2.gz GNBRVNJGLSLSQP-AWEZNQCLSA-N 0 0 369.204 3.687 20 5 FHBDRN O=C([O-])[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1cc(Cl)ccc1Cl ZINC000426815447 944837949 /nfs/dbraw/zinc/83/79/49/944837949.db2.gz FQGADBDITBHBCD-AWEZNQCLSA-N 0 0 369.204 3.687 20 5 FHBDRN Cc1cccc([C@H]2CCCN2C(=O)NCCOc2ccc([N+](=O)[O-])cc2)c1 ZINC000518827765 944838043 /nfs/dbraw/zinc/83/80/43/944838043.db2.gz MQCMBXMBXSBUES-LJQANCHMSA-N 0 0 369.421 3.829 20 5 FHBDRN COCCOc1ccc(F)cc1NCc1c(F)cc([N+](=O)[O-])cc1F ZINC000506294146 944842446 /nfs/dbraw/zinc/84/24/46/944842446.db2.gz IPUWDXCEUCMOHG-UHFFFAOYSA-N 0 0 356.300 3.649 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H](C)N(Cc3ccccc3)C[C@H]2C)c1 ZINC000500424130 944857158 /nfs/dbraw/zinc/85/71/58/944857158.db2.gz MIXSDCMVRMXSQM-IAGOWNOFSA-N 0 0 367.449 3.638 20 5 FHBDRN COC1CCC(CNC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000426848023 944865776 /nfs/dbraw/zinc/86/57/76/944865776.db2.gz KQDNGTKKHLKIFN-UHFFFAOYSA-N 0 0 360.332 3.549 20 5 FHBDRN COc1cnccc1[C@H](C)NC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000438633107 944867180 /nfs/dbraw/zinc/86/71/80/944867180.db2.gz VFJDWKBNGFRRJL-ZDUSSCGKSA-N 0 0 373.412 3.576 20 5 FHBDRN CCCCCN([C@@H](C)CCC)S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC ZINC000517955737 944869427 /nfs/dbraw/zinc/86/94/27/944869427.db2.gz OSBHXHICBUAPCS-AWEZNQCLSA-N 0 0 372.487 3.973 20 5 FHBDRN CC(C)c1nnc(CNC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)s1 ZINC000467407264 944869941 /nfs/dbraw/zinc/86/99/41/944869941.db2.gz SJRCHHBEGWVZTI-UHFFFAOYSA-N 0 0 355.807 3.545 20 5 FHBDRN C[C@@H](C(=O)N(C)Cc1nc(-c2ccccc2)c[nH]1)c1cccc([N+](=O)[O-])c1 ZINC000518857435 944871149 /nfs/dbraw/zinc/87/11/49/944871149.db2.gz VGELZOVVNYNOPX-CQSZACIVSA-N 0 0 364.405 3.747 20 5 FHBDRN CCC(CC)Sc1ccc(S(=O)(=O)N(CC)CC)cc1[N+](=O)[O-] ZINC000507026187 944874898 /nfs/dbraw/zinc/87/48/98/944874898.db2.gz DLVGBPXHLCKOKL-UHFFFAOYSA-N 0 0 360.501 3.906 20 5 FHBDRN O=C(CNc1ccc2c3c(cccc31)CC2)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000517964735 944880343 /nfs/dbraw/zinc/88/03/43/944880343.db2.gz YEXYYTMVHFTFNY-UHFFFAOYSA-N 0 0 373.412 3.848 20 5 FHBDRN COc1cc(C(=O)Nc2cc(Br)ccc2F)ccc1[N+](=O)[O-] ZINC000110648516 944882299 /nfs/dbraw/zinc/88/22/99/944882299.db2.gz HLSIJTNMAHEIKI-UHFFFAOYSA-N 0 0 369.146 3.757 20 5 FHBDRN C[C@]1(O)CCCN(C(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)CC1 ZINC000473592037 944889448 /nfs/dbraw/zinc/88/94/48/944889448.db2.gz VCBTYGYNEFVYPN-FQEVSTJZSA-N 0 0 369.421 3.716 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)NCCC(C)(C)C(=O)OC(C)(C)C ZINC000425671878 944895308 /nfs/dbraw/zinc/89/53/08/944895308.db2.gz URKZTGLGRYKMMR-UHFFFAOYSA-N 0 0 365.430 3.783 20 5 FHBDRN CC(C)NC(=O)c1ccc(N(C)[C@H]2CCc3ccccc3C2)c([N+](=O)[O-])c1 ZINC000511676142 944901559 /nfs/dbraw/zinc/90/15/59/944901559.db2.gz RZTFIZNSEBVKBI-SFHVURJKSA-N 0 0 367.449 3.727 20 5 FHBDRN CC(C)NC(=O)c1ccc(N(C)[C@@H]2CCc3ccccc3C2)c([N+](=O)[O-])c1 ZINC000511676141 944901739 /nfs/dbraw/zinc/90/17/39/944901739.db2.gz RZTFIZNSEBVKBI-GOSISDBHSA-N 0 0 367.449 3.727 20 5 FHBDRN COc1ccc(CSCC(=O)NCc2sccc2C)cc1[N+](=O)[O-] ZINC000518887306 944907586 /nfs/dbraw/zinc/90/75/86/944907586.db2.gz HSIMLHDQJRFUNG-UHFFFAOYSA-N 0 0 366.464 3.523 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)N[C@H]2CCOC3(CCCC3)C2)cc1[N+](=O)[O-] ZINC000151234506 944909528 /nfs/dbraw/zinc/90/95/28/944909528.db2.gz XFLGOTGFLCUWNI-ZBFHGGJFSA-N 0 0 361.442 3.755 20 5 FHBDRN COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)NCC[C@@H](C)F)cc1 ZINC000507071582 944914394 /nfs/dbraw/zinc/91/43/94/944914394.db2.gz WBMJOGAKAJBTPN-GFCCVEGCSA-N 0 0 362.357 3.874 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1F)N[C@H]1CC[C@@H](Cc2ccccc2)C1 ZINC000438676573 944917737 /nfs/dbraw/zinc/91/77/37/944917737.db2.gz DLYOFONCENSEFV-RDJZCZTQSA-N 0 0 356.397 3.804 20 5 FHBDRN CCN(c1cccc(Cl)c1)S(=O)(=O)c1cccc([N+](=O)[O-])c1C ZINC000511690089 944921017 /nfs/dbraw/zinc/92/10/17/944921017.db2.gz ZBKLIUDSNCZALQ-UHFFFAOYSA-N 0 0 354.815 3.772 20 5 FHBDRN CC(C)c1cccc(O[C@@H](C)C(=O)NCCc2ccc([N+](=O)[O-])cc2)c1 ZINC000505934145 944924364 /nfs/dbraw/zinc/92/43/64/944924364.db2.gz USPZYDRQIGXLKU-HNNXBMFYSA-N 0 0 356.422 3.844 20 5 FHBDRN CCOc1ccc(C(=O)Nc2ccccc2-c2cn[nH]c2)cc1[N+](=O)[O-] ZINC000439750044 944928299 /nfs/dbraw/zinc/92/82/99/944928299.db2.gz GVFDWFMSIHOMTO-UHFFFAOYSA-N 0 0 352.350 3.636 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H](C)O[C@H](CC)C1 ZINC000506329311 944932567 /nfs/dbraw/zinc/93/25/67/944932567.db2.gz FLBLCRXMAAABNK-TZMCWYRMSA-N 0 0 352.456 3.736 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H](C)COc1cccc(C)c1 ZINC000506325703 944941003 /nfs/dbraw/zinc/94/10/03/944941003.db2.gz JHLXFVWLJTWJCV-ZDUSSCGKSA-N 0 0 359.382 3.501 20 5 FHBDRN Cc1cccc([C@@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2)C(F)(F)F)c1 ZINC000511722448 944946409 /nfs/dbraw/zinc/94/64/09/944946409.db2.gz QBXCKOMAJQFKCG-MRXNPFEDSA-N 0 0 352.312 3.866 20 5 FHBDRN COC(=O)c1cccc(NC2CCN(c3cc(C)ccc3[N+](=O)[O-])CC2)c1 ZINC000432045210 944946594 /nfs/dbraw/zinc/94/65/94/944946594.db2.gz HYNPHTFQCSYRRB-UHFFFAOYSA-N 0 0 369.421 3.771 20 5 FHBDRN CCCOc1ccc(CN(CCC)c2c([N+](=O)[O-])ncn2C)cc1OC ZINC000432049547 944952999 /nfs/dbraw/zinc/95/29/99/944952999.db2.gz VXSWZJMVCRVTEN-UHFFFAOYSA-N 0 0 362.430 3.542 20 5 FHBDRN COc1cc(C(=O)Oc2c(C)cccc2[N+](=O)[O-])ccc1OC(F)F ZINC000760022630 944954951 /nfs/dbraw/zinc/95/49/51/944954951.db2.gz MXZOGZOAURPWQR-UHFFFAOYSA-N 0 0 353.277 3.732 20 5 FHBDRN Cc1c(NC(=O)[C@H](C)N2CC[C@H]2Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000437839597 944955348 /nfs/dbraw/zinc/95/53/48/944955348.db2.gz UZSWBAXAFLOTTN-RDJZCZTQSA-N 0 0 353.422 3.547 20 5 FHBDRN CCNc1ccc(C(=O)Nc2cc(F)c(F)cc2OC)cc1[N+](=O)[O-] ZINC000516518234 944967540 /nfs/dbraw/zinc/96/75/40/944967540.db2.gz CTKRVUWNEHWTSY-UHFFFAOYSA-N 0 0 351.309 3.566 20 5 FHBDRN O=[N+]([O-])c1cc(C(F)(F)F)ccc1NCc1ccnc(-n2cccn2)c1 ZINC000106048169 944991059 /nfs/dbraw/zinc/99/10/59/944991059.db2.gz DSWZYUCDHCCJBY-UHFFFAOYSA-N 0 0 363.299 3.806 20 5 FHBDRN COc1ccc(CSCC(=O)N(C)[C@@H](C)C(C)(C)C)cc1[N+](=O)[O-] ZINC000518973785 944997719 /nfs/dbraw/zinc/99/77/19/944997719.db2.gz PUPKKATXBFTAMK-LBPRGKRZSA-N 0 0 354.472 3.730 20 5 FHBDRN CC[C@](C)(NC(=O)CCNc1ccccc1[N+](=O)[O-])c1nc(C)cs1 ZINC000151200382 945006624 /nfs/dbraw/zinc/00/66/24/945006624.db2.gz HAVKHTLMOGRSOT-KRWDZBQOSA-N 0 0 362.455 3.603 20 5 FHBDRN Cc1ccc([C@H](C)NCc2ncn(Cc3cccc(F)c3)n2)cc1[N+](=O)[O-] ZINC000437088650 945009391 /nfs/dbraw/zinc/00/93/91/945009391.db2.gz MBSVUKIJGMDFOD-AWEZNQCLSA-N 0 0 369.400 3.533 20 5 FHBDRN O=[N+]([O-])c1cccc(OC[C@H](O)CNc2cccc(NC3CCCC3)c2)c1 ZINC000516563410 945013935 /nfs/dbraw/zinc/01/39/35/945013935.db2.gz IDUZHGSXVAFEJC-LJQANCHMSA-N 0 0 371.437 3.801 20 5 FHBDRN C[C@H](Oc1ccc(F)cc1)C(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000437097264 945015407 /nfs/dbraw/zinc/01/54/07/945015407.db2.gz MSLWDSWUNAUOHG-ZDUSSCGKSA-N 0 0 358.369 3.692 20 5 FHBDRN COc1cc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc2c1OCCO2 ZINC000507173176 945022034 /nfs/dbraw/zinc/02/20/34/945022034.db2.gz LAJXJPKYALTCLL-UHFFFAOYSA-N 0 0 372.421 3.785 20 5 FHBDRN Cc1ccccc1[C@@H]1CCN(CC(=O)Nc2c(C)cccc2[N+](=O)[O-])C1 ZINC000507203061 945028299 /nfs/dbraw/zinc/02/82/99/945028299.db2.gz IPQAOQRXNSCKQM-MRXNPFEDSA-N 0 0 353.422 3.640 20 5 FHBDRN Cc1ccc(NCCCNC(=O)N2CCCC[C@H]2C(F)F)c([N+](=O)[O-])c1 ZINC000507203430 945028889 /nfs/dbraw/zinc/02/88/89/945028889.db2.gz JBHYAGMOCNQDGT-AWEZNQCLSA-N 0 0 370.400 3.534 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)Nc1cccc(C(C)C)c1 ZINC000439854867 945031230 /nfs/dbraw/zinc/03/12/30/945031230.db2.gz JRYDCRZRVHEPNT-UHFFFAOYSA-N 0 0 371.393 3.694 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)NC1(c2ccccc2F)CC1 ZINC000439866159 945038853 /nfs/dbraw/zinc/03/88/53/945038853.db2.gz BIMVBEAWTNMMCJ-UHFFFAOYSA-N 0 0 359.357 3.943 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)NC1(c2ccc(F)cc2)CC1 ZINC000439866660 945041124 /nfs/dbraw/zinc/04/11/24/945041124.db2.gz MPOPDKYZJOWUKX-UHFFFAOYSA-N 0 0 359.357 3.943 20 5 FHBDRN C[C@H](C(=O)Nc1nc(C(F)(F)F)cs1)c1ccc([N+](=O)[O-])cc1F ZINC000541607170 945044640 /nfs/dbraw/zinc/04/46/40/945044640.db2.gz BJGYNUMHLACRPR-LURJTMIESA-N 0 0 363.292 3.951 20 5 FHBDRN CCO[C@@H]1C[C@@H](NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)C12CCCC2 ZINC000437121602 945051585 /nfs/dbraw/zinc/05/15/85/945051585.db2.gz CSZRMTSAPIDGFL-IAGOWNOFSA-N 0 0 358.394 3.809 20 5 FHBDRN CCO[C@@H]1C[C@H](NC(=O)c2ccc(SC)c([N+](=O)[O-])c2)C12CCCC2 ZINC000437123489 945052591 /nfs/dbraw/zinc/05/25/91/945052591.db2.gz DWIFZOSRAYSDPH-JKSUJKDBSA-N 0 0 364.467 3.784 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N2CCCc3ccccc3C2)cc1OC ZINC000106712948 945372007 /nfs/dbraw/zinc/37/20/07/945372007.db2.gz MMMSQJKIHGJKRZ-UHFFFAOYSA-N 0 0 370.405 3.591 20 5 FHBDRN O=C(N[C@@H](c1nccs1)C(F)(F)F)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000507610026 945372605 /nfs/dbraw/zinc/37/26/05/945372605.db2.gz HGLPPRQUNOFAMV-VIFPVBQESA-N 0 0 365.720 3.738 20 5 FHBDRN COc1ccccc1CN(C)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000185995891 945385860 /nfs/dbraw/zinc/38/58/60/945385860.db2.gz RSCZARWURQZIEZ-UHFFFAOYSA-N 0 0 363.801 3.598 20 5 FHBDRN Cc1cc(NC(=O)COc2ccc([N+](=O)[O-])cc2)ccc1C(F)(F)F ZINC000440298084 945386643 /nfs/dbraw/zinc/38/66/43/945386643.db2.gz OZXGOUJDFIXFGJ-UHFFFAOYSA-N 0 0 354.284 3.940 20 5 FHBDRN COc1ccccc1[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])cc1OC ZINC000427453054 945393228 /nfs/dbraw/zinc/39/32/28/945393228.db2.gz WWIWZXIKYOLIDQ-MRXNPFEDSA-N 0 0 356.378 3.589 20 5 FHBDRN Cc1c(N[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)cccc1-c1ncco1 ZINC000427457126 945395854 /nfs/dbraw/zinc/39/58/54/945395854.db2.gz SEQJPJZTMUXJLE-CYBMUJFWSA-N 0 0 366.377 3.997 20 5 FHBDRN Cc1cc(C(=O)OCc2csc(-c3ccccn3)n2)cc([N+](=O)[O-])c1 ZINC000124958967 945400409 /nfs/dbraw/zinc/40/04/09/945400409.db2.gz LBFALDSMYHUWDQ-UHFFFAOYSA-N 0 0 355.375 3.779 20 5 FHBDRN O=C(N[C@@H]1CCCC(F)(F)C1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000426631296 945403111 /nfs/dbraw/zinc/40/31/11/945403111.db2.gz XNDZFCRJDYDSDU-CYBMUJFWSA-N 0 0 353.369 3.847 20 5 FHBDRN Cc1nn(CCC(=O)Nc2cc(-c3ccccc3)ns2)c(C)c1[N+](=O)[O-] ZINC000124972006 945408021 /nfs/dbraw/zinc/40/80/21/945408021.db2.gz UHBMGUHBHJVVTP-UHFFFAOYSA-N 0 0 371.422 3.560 20 5 FHBDRN CN(Cc1cc(Cl)cn1C)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000185999156 945409074 /nfs/dbraw/zinc/40/90/74/945409074.db2.gz PVDQNRBEXABIFE-UHFFFAOYSA-N 0 0 371.224 3.582 20 5 FHBDRN CSc1cccc(C(=O)NCCOc2ccc(Cl)cc2)c1[N+](=O)[O-] ZINC000186002272 945418433 /nfs/dbraw/zinc/41/84/33/945418433.db2.gz MUIFGIUXIBQSIK-UHFFFAOYSA-N 0 0 366.826 3.779 20 5 FHBDRN CC(C)OC(=O)CC[C@@H](C)NC(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000473612413 945421220 /nfs/dbraw/zinc/42/12/20/945421220.db2.gz RFFUAUFLGMLXGQ-CYBMUJFWSA-N 0 0 350.415 3.568 20 5 FHBDRN O=C(NCc1ccc(Br)cc1)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000107039284 945462882 /nfs/dbraw/zinc/46/28/82/945462882.db2.gz HLHGIKNANPWJLQ-UHFFFAOYSA-N 0 0 374.194 3.769 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)Nc1ncc(-c2ccc(F)cc2)s1 ZINC000432207503 945462944 /nfs/dbraw/zinc/46/29/44/945462944.db2.gz YSXOCNSATIFOGR-UHFFFAOYSA-N 0 0 373.365 3.875 20 5 FHBDRN O=C(CC[S@@](=O)Cc1ccc(Cl)cc1)Nc1ccccc1[N+](=O)[O-] ZINC000507699747 945465191 /nfs/dbraw/zinc/46/51/91/945465191.db2.gz VCBMXMOUJZHVLY-XMMPIXPASA-N 0 0 366.826 3.526 20 5 FHBDRN COc1ccc(CN(C)[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1 ZINC000015440701 945469227 /nfs/dbraw/zinc/46/92/27/945469227.db2.gz SXZMIXXCTYISPG-ZDUSSCGKSA-N 0 0 368.393 3.846 20 5 FHBDRN COc1ccc(C)cc1[C@@H](C)NC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000087023236 945470551 /nfs/dbraw/zinc/47/05/51/945470551.db2.gz UOCZEHFUGBEJOF-CQSZACIVSA-N 0 0 369.421 3.741 20 5 FHBDRN C[C@@H](NC(=O)c1ccc([N+](=O)[O-])o1)c1ccc(F)c(Br)c1 ZINC000507705485 945477317 /nfs/dbraw/zinc/47/73/17/945477317.db2.gz FKYIREJTUGLUOI-SSDOTTSWSA-N 0 0 357.135 3.580 20 5 FHBDRN COc1ccc(CNC(=O)N[C@H](C)Cc2ccc(C)cc2C)cc1[N+](=O)[O-] ZINC000519490813 945482500 /nfs/dbraw/zinc/48/25/00/945482500.db2.gz TYXGHWKZBXVMGJ-OAHLLOKOSA-N 0 0 371.437 3.651 20 5 FHBDRN O=[N+]([O-])c1cccc(Cl)c1CN1CC[C@@H](c2ccccc2)S1(=O)=O ZINC000427532101 945483470 /nfs/dbraw/zinc/48/34/70/945483470.db2.gz WJEVUNMHDBNIOV-INIZCTEOSA-N 0 0 366.826 3.525 20 5 FHBDRN C[C@H](c1ccc(F)cc1)[S@@](=O)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000507713129 945487407 /nfs/dbraw/zinc/48/74/07/945487407.db2.gz HITPSODVRKJAIA-YDBLSZJJSA-N 0 0 364.398 3.572 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])c2ncccc12)c1ccnc(OC2CCC2)c1 ZINC000184392339 945496794 /nfs/dbraw/zinc/49/67/94/945496794.db2.gz CSDBYCNOKFLIFY-UHFFFAOYSA-N 0 0 364.361 3.722 20 5 FHBDRN CCc1cnc(N2CCN(Cc3ccc([N+](=O)[O-])cc3Cl)CC2)s1 ZINC000543858203 945546378 /nfs/dbraw/zinc/54/63/78/945546378.db2.gz UUFICVQPARYGHE-UHFFFAOYSA-N 0 0 366.874 3.589 20 5 FHBDRN C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000281185090 945548615 /nfs/dbraw/zinc/54/86/15/945548615.db2.gz AFFZKHRJJPEDBD-VXAPYIKBSA-N 0 0 366.845 3.650 20 5 FHBDRN CNC(=O)COc1ccc(N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c(C)c1 ZINC000281181390 945555940 /nfs/dbraw/zinc/55/59/40/945555940.db2.gz QPGOQBHFNMDNBY-AWEZNQCLSA-N 0 0 357.410 3.510 20 5 FHBDRN COc1ccc(Br)cc1NC(=O)c1ccc([N+](=O)[O-])cc1F ZINC000056036646 945558131 /nfs/dbraw/zinc/55/81/31/945558131.db2.gz JIACUOKDBWBVPH-UHFFFAOYSA-N 0 0 369.146 3.757 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)N1CC[C@H](c2c(F)cccc2F)C1 ZINC000184403006 945566407 /nfs/dbraw/zinc/56/64/07/945566407.db2.gz SFSDPDFVHVURPK-ZDUSSCGKSA-N 0 0 361.348 3.572 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)c1cccc([C@H]2CCOC2)c1 ZINC000281235987 945570832 /nfs/dbraw/zinc/57/08/32/945570832.db2.gz FHKYGPDFZRHUQJ-HNNXBMFYSA-N 0 0 356.378 3.750 20 5 FHBDRN Cc1cccc2c1CCN([C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)C2 ZINC000729478548 945574623 /nfs/dbraw/zinc/57/46/23/945574623.db2.gz XCSQHLAJBSQVOY-CYBMUJFWSA-N 0 0 373.840 3.942 20 5 FHBDRN CC(C)n1cc(Cl)c(NC(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)n1 ZINC000894880297 945588854 /nfs/dbraw/zinc/58/88/54/945588854.db2.gz FWBJPTFVKLFCBV-VIFPVBQESA-N 0 0 354.769 3.907 20 5 FHBDRN C[C@H]1CCCC[C@@H]1Cc1nc(-c2ccc(-n3cncn3)c([N+](=O)[O-])c2)no1 ZINC000519625551 945594992 /nfs/dbraw/zinc/59/49/92/945594992.db2.gz DSFMSYNAIKBCJH-QWHCGFSZSA-N 0 0 368.397 3.594 20 5 FHBDRN CO[C@H]1CCC[C@H]1C(=O)N(Cc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC001126572034 945600269 /nfs/dbraw/zinc/60/02/69/945600269.db2.gz BDTMPWNREGATBM-MOPGFXCFSA-N 0 0 354.406 3.943 20 5 FHBDRN C[C@@H]1CC[C@H](O)[C@@H]([C@@H]2CCCN2C(=O)c2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000281391749 945620948 /nfs/dbraw/zinc/62/09/48/945620948.db2.gz MXWQWFQIYWXVRN-OFIKQIQMSA-N 0 0 366.845 3.650 20 5 FHBDRN CC(C)n1cc(Cl)c(NC(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)n1 ZINC000894881809 945621064 /nfs/dbraw/zinc/62/10/64/945621064.db2.gz GPRSQVWWWAOPBV-UHFFFAOYSA-N 0 0 358.732 3.756 20 5 FHBDRN C[C@@H]1CC[C@@]2(CCN(c3ccc([N+](=O)[O-])c(C(=O)N4CCCC4)c3)C2)C1 ZINC000302057936 945634827 /nfs/dbraw/zinc/63/48/27/945634827.db2.gz RLRLMNACQKSIOE-FOIQADDNSA-N 0 0 357.454 3.847 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](C)c1ccc(-n2ccnn2)cc1 ZINC000181745316 945635146 /nfs/dbraw/zinc/63/51/46/945635146.db2.gz HHLJUFBTEZPEBW-GJZGRUSLSA-N 0 0 351.410 3.896 20 5 FHBDRN CC(C)n1cc(Cl)c(NC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)n1 ZINC000894882622 945656908 /nfs/dbraw/zinc/65/69/08/945656908.db2.gz BPHJMODJEJRUSC-UHFFFAOYSA-N 0 0 357.197 3.860 20 5 FHBDRN CCC[N@H+](Cc1cccc([N+](=O)[O-])c1)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000729479935 945667059 /nfs/dbraw/zinc/66/70/59/945667059.db2.gz JINNMFYFSOQMPU-QGZVFWFLSA-N 0 0 363.458 3.816 20 5 FHBDRN C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1cc(Cl)nc(Cl)c1 ZINC000728812038 945667619 /nfs/dbraw/zinc/66/76/19/945667619.db2.gz VTDWQIHNJAFQPV-MRVPVSSYSA-N 0 0 352.177 3.888 20 5 FHBDRN CC1(C)C[C@H]1CNC(=O)c1cc(F)cc2c(=O)c3cccc(F)c3[nH]c12 ZINC000444006817 945699827 /nfs/dbraw/zinc/69/98/27/945699827.db2.gz BMPQIUISLQBRMD-JTQLQIEISA-N 0 0 356.372 3.735 20 5 FHBDRN CCCCN(CCOC)C(=O)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000444001481 945708993 /nfs/dbraw/zinc/70/89/93/945708993.db2.gz HRXRWMSGSANLEZ-UHFFFAOYSA-N 0 0 370.424 3.709 20 5 FHBDRN O=C(N=c1cc(C2CCCC2)[nH][nH]1)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000444020123 945715827 /nfs/dbraw/zinc/71/58/27/945715827.db2.gz DUOAQGLPTONOLB-UHFFFAOYSA-N 0 0 372.428 3.736 20 5 FHBDRN C[C@H](CC1CC1)NC(=O)c1cc(F)cc2c(=O)c3cccc(F)c3[nH]c12 ZINC000444007858 945719301 /nfs/dbraw/zinc/71/93/01/945719301.db2.gz COWXVXTYGYKTMD-SNVBAGLBSA-N 0 0 356.372 3.878 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)O[C@@H](C)C(=O)c1cccc(Cl)c1 ZINC000018344451 945720512 /nfs/dbraw/zinc/72/05/12/945720512.db2.gz AJVULEWDRUYLDP-JTQLQIEISA-N 0 0 363.753 3.685 20 5 FHBDRN O=C(N[C@H]1CCSC1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000487349763 945730406 /nfs/dbraw/zinc/73/04/06/945730406.db2.gz DCMMICMATNLETI-LBPRGKRZSA-N 0 0 360.460 3.981 20 5 FHBDRN CCCC[C@@H](COC)NC(=O)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000444036080 945742179 /nfs/dbraw/zinc/74/21/79/945742179.db2.gz CKHZSNNAWAGYIZ-ZDUSSCGKSA-N 0 0 370.424 3.755 20 5 FHBDRN COc1cc(Cl)ccc1CNc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 ZINC000107675287 945748738 /nfs/dbraw/zinc/74/87/38/945748738.db2.gz TWSUQHJDAAKMSD-UHFFFAOYSA-N 0 0 361.785 3.754 20 5 FHBDRN CN(C[C@H]1CCCOC1)c1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000107674463 945749010 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ZINC001126041609 945799752 /nfs/dbraw/zinc/79/97/52/945799752.db2.gz OJEMTKUJLRGUJX-MRXNPFEDSA-N 0 0 371.412 3.750 20 5 FHBDRN C[C@@H]1CCCCN(C(=O)Cc2ccc([N+](=O)[O-])cc2Br)C1 ZINC000184408811 945802537 /nfs/dbraw/zinc/80/25/37/945802537.db2.gz ODIYMWCQHCFHHU-LLVKDONJSA-N 0 0 355.232 3.548 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@H](CC(C)C)c1ccc(Cl)cc1 ZINC000121303599 945821332 /nfs/dbraw/zinc/82/13/32/945821332.db2.gz GVQCAOVKBCXXCV-OAHLLOKOSA-N 0 0 364.833 3.657 20 5 FHBDRN Cc1ccc(-c2cc(C(=O)N3CCc4c3cccc4[N+](=O)[O-])n[nH]2)cc1C ZINC000444083008 945828188 /nfs/dbraw/zinc/82/81/88/945828188.db2.gz IFKJNOPEURDMBA-UHFFFAOYSA-N 0 0 362.389 3.805 20 5 FHBDRN O=[N+]([O-])c1ccc(C(F)(F)F)c(CN2CC[C@@H](COC(F)F)C2)c1 ZINC000550097543 945833059 /nfs/dbraw/zinc/83/30/59/945833059.db2.gz RSEPGPRTCXTMKC-SECBINFHSA-N 0 0 354.275 3.675 20 5 FHBDRN COC(C)(C)C[C@H](C)NC(=O)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000444085775 945833263 /nfs/dbraw/zinc/83/32/63/945833263.db2.gz IFKDOTPDFBGSGQ-LBPRGKRZSA-N 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359.385 3.646 20 5 FHBDRN O=C(c1ccnc(Oc2ccccc2)c1)N1CCc2c1cccc2[N+](=O)[O-] ZINC000078148852 945896634 /nfs/dbraw/zinc/89/66/34/945896634.db2.gz DZBIIILFBLZTCU-UHFFFAOYSA-N 0 0 361.357 3.985 20 5 FHBDRN C[C@H](NC(=O)Nc1cccc([N+](=O)[O-])c1)c1ccc(NC(=O)C2CC2)cc1 ZINC000045032793 945898741 /nfs/dbraw/zinc/89/87/41/945898741.db2.gz SDQDBSQNAKUJGE-LBPRGKRZSA-N 0 0 368.393 3.826 20 5 FHBDRN CSc1ccc(C(=O)Nc2cc(CC(C)(C)C)nn2C)cc1[N+](=O)[O-] ZINC000108243818 945898977 /nfs/dbraw/zinc/89/89/77/945898977.db2.gz HNXAVQDWLDFYCZ-UHFFFAOYSA-N 0 0 362.455 3.891 20 5 FHBDRN O=C(c1cc(NCCc2ccccc2F)ccc1[N+](=O)[O-])N1CCCC1 ZINC000108307879 945925025 /nfs/dbraw/zinc/92/50/25/945925025.db2.gz OQIAUQDGGWHWMQ-UHFFFAOYSA-N 0 0 357.385 3.625 20 5 FHBDRN O=C(Nc1cccc(-c2ccc3c(c2)CCO3)n1)c1ccccc1[N+](=O)[O-] ZINC000108312400 945928821 /nfs/dbraw/zinc/92/88/21/945928821.db2.gz FFYALCSZLCTBCZ-UHFFFAOYSA-N 0 0 361.357 3.844 20 5 FHBDRN O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCN(C2CCCC2)CC1 ZINC000045084208 945930192 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FHBDRN C[C@H](Oc1ccc([N+](=O)[O-])c(Cl)c1)C(=O)Nc1cc(F)ccc1F ZINC000127155933 946030039 /nfs/dbraw/zinc/03/00/39/946030039.db2.gz YQPUTHPLHHOPNW-QMMMGPOBSA-N 0 0 356.712 3.932 20 5 FHBDRN CN(C(=O)c1ccc([N+](=O)[O-])cc1Br)c1ccc(Cl)cn1 ZINC000151857788 946030513 /nfs/dbraw/zinc/03/05/13/946030513.db2.gz XFURXBDGDTXOPP-UHFFFAOYSA-N 0 0 370.590 3.682 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)NCC1(c2ccccc2)CCC1 ZINC000045371537 946030802 /nfs/dbraw/zinc/03/08/02/946030802.db2.gz YCDZZWYEQAMTBC-UHFFFAOYSA-N 0 0 353.422 3.858 20 5 FHBDRN CCN(CC)[C@@H](C(=O)OCc1ccc([N+](=O)[O-])c(F)c1)c1ccccc1 ZINC000783586793 946040874 /nfs/dbraw/zinc/04/08/74/946040874.db2.gz MXYYOMZVDAGOSY-GOSISDBHSA-N 0 0 360.385 3.860 20 5 FHBDRN COC(=O)c1cc(C(=O)N(c2ccccc2)C2CCCC2)cc([N+](=O)[O-])c1 ZINC000108745100 946049680 /nfs/dbraw/zinc/04/96/80/946049680.db2.gz RGLHEXNXSPATEW-UHFFFAOYSA-N 0 0 368.389 3.971 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1OCC(=O)Nc1ccccc1Br ZINC000001284411 946053219 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COC(=O)c1cc(NC(=O)CCc2ccc(Cl)cc2)cc([N+](=O)[O-])c1 ZINC000522921930 946098931 /nfs/dbraw/zinc/09/89/31/946098931.db2.gz VZKVHYJEQJRTBF-UHFFFAOYSA-N 0 0 362.769 3.606 20 5 FHBDRN C[C@H](C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2)c1ccccc1F ZINC000108959598 946107554 /nfs/dbraw/zinc/10/75/54/946107554.db2.gz PGYQVPGQMZZAMI-NSHDSACASA-N 0 0 360.341 3.637 20 5 FHBDRN CC[C@@H](CC1CCCCC1)C(=O)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000522931438 946113235 /nfs/dbraw/zinc/11/32/35/946113235.db2.gz LPNHMBPHYKMMER-IRXDYDNUSA-N 0 0 374.485 3.999 20 5 FHBDRN COc1cc(C)cc(CNC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)c1 ZINC000444245275 946114824 /nfs/dbraw/zinc/11/48/24/946114824.db2.gz QRLVGAVCNZQVAS-UHFFFAOYSA-N 0 0 372.424 3.928 20 5 FHBDRN Cc1cccc(CCNC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000121333606 946119784 /nfs/dbraw/zinc/11/97/84/946119784.db2.gz WYQWCYNTHFNMLA-UHFFFAOYSA-N 0 0 353.422 3.820 20 5 FHBDRN CCc1nc(CN(C)C(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)cs1 ZINC000109030492 946125660 /nfs/dbraw/zinc/12/56/60/946125660.db2.gz FSGKRAJWHJUXAW-NSHDSACASA-N 0 0 365.480 3.753 20 5 FHBDRN Cc1noc(C)c1CNC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000109056451 946141961 /nfs/dbraw/zinc/14/19/61/946141961.db2.gz NYDUJRYPXPTNFE-UHFFFAOYSA-N 0 0 366.377 3.873 20 5 FHBDRN O=[N+]([O-])c1cnc(Sc2nnc(-c3cccc4ccccc43)o2)nc1 ZINC000302156463 946150092 /nfs/dbraw/zinc/15/00/92/946150092.db2.gz MWHMSDWXJICRRH-UHFFFAOYSA-N 0 0 351.347 3.739 20 5 FHBDRN CNc1ccc(C(=O)N2C[C@H](C)C[C@H]2c2cccc(OC)c2)cc1[N+](=O)[O-] ZINC000544318876 946153644 /nfs/dbraw/zinc/15/36/44/946153644.db2.gz KXUFIPXMRFDMAM-ACJLOTCBSA-N 0 0 369.421 3.868 20 5 FHBDRN Cc1oc(-c2ccco2)nc1CC(=O)O[C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000159941618 946174925 /nfs/dbraw/zinc/17/49/25/946174925.db2.gz MCGFFIGMEWHYFK-LLVKDONJSA-N 0 0 356.334 3.998 20 5 FHBDRN CCc1n[nH]c(C(=O)N(C)[C@H]2CCC[C@@H]2c2ccc(C)cc2)c1[N+](=O)[O-] ZINC000444295651 946180616 /nfs/dbraw/zinc/18/06/16/946180616.db2.gz FBVKRRXZUTXSOG-ZBFHGGJFSA-N 0 0 356.426 3.597 20 5 FHBDRN COc1cccc([C@H]2C[C@H](NC(=O)c3c[nH]c4ccc([N+](=O)[O-])cc34)C2)c1 ZINC000456510276 946182923 /nfs/dbraw/zinc/18/29/23/946182923.db2.gz NJNCNCLPMQDBRG-HDJSIYSDSA-N 0 0 365.389 3.761 20 5 FHBDRN C[C@H]1CN(C(=O)c2cccc3c(=O)c4cccc(F)c4[nH]c23)CC[C@@H]1C ZINC000444297587 946183058 /nfs/dbraw/zinc/18/30/58/946183058.db2.gz KAUJEUAELOGBMW-STQMWFEESA-N 0 0 352.409 3.939 20 5 FHBDRN Cc1sc(S(=O)(=O)N2CCC[C@@H]2C2CCCCC2)cc1[N+](=O)[O-] ZINC000467416257 946189016 /nfs/dbraw/zinc/18/90/16/946189016.db2.gz GDULXPBTCWXPBS-CYBMUJFWSA-N 0 0 358.485 3.698 20 5 FHBDRN O=C(NCc1cccc(NC(=O)C2CCC2)c1)Nc1ccc([N+](=O)[O-])cc1 ZINC000045841233 946190497 /nfs/dbraw/zinc/19/04/97/946190497.db2.gz DEIWFOKKYKLRJS-UHFFFAOYSA-N 0 0 368.393 3.655 20 5 FHBDRN CC[C@@H](c1ccccc1)N(CC)S(=O)(=O)c1ccc([N+](=O)[O-])cc1F ZINC000520155362 946202650 /nfs/dbraw/zinc/20/26/50/946202650.db2.gz DROSFHSBDLGSIO-INIZCTEOSA-N 0 0 366.414 3.896 20 5 FHBDRN CN(C)c1ccc(Cl)cc1NC(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000522992067 946206577 /nfs/dbraw/zinc/20/65/77/946206577.db2.gz JAZXLNRGLPSTNF-UHFFFAOYSA-N 0 0 362.817 3.678 20 5 FHBDRN O=C(O[C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1)c1coc2ccccc12 ZINC000759926738 946211476 /nfs/dbraw/zinc/21/14/76/946211476.db2.gz BSKXABRFLYLBCB-ZBFHGGJFSA-N 0 0 355.350 3.878 20 5 FHBDRN Cc1ncc(-c2ccc(NC(=O)c3n[nH]c4ccc([N+](=O)[O-])cc43)cc2)o1 ZINC000045898095 946223942 /nfs/dbraw/zinc/22/39/42/946223942.db2.gz KUWRAAJUSLRDAR-UHFFFAOYSA-N 0 0 363.333 3.687 20 5 FHBDRN COc1ccc(Cl)cc1N(C)C(=O)c1cc([N+](=O)[O-])c(F)cc1C ZINC001126096336 946224989 /nfs/dbraw/zinc/22/49/89/946224989.db2.gz JSPDBLVGWKETKV-UHFFFAOYSA-N 0 0 352.749 3.981 20 5 FHBDRN O=C(N[C@@H]1CCO[C@@H](c2cccs2)C1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000456515882 946231354 /nfs/dbraw/zinc/23/13/54/946231354.db2.gz BJJGIQRCUZVYOE-ZWNOBZJWSA-N 0 0 366.826 3.960 20 5 FHBDRN COc1c(C(=O)Nc2ccc3cnn(C(C)C)c3c2)cccc1[N+](=O)[O-] ZINC000475459270 946237900 /nfs/dbraw/zinc/23/79/00/946237900.db2.gz NPQJQAOJDUCRIK-UHFFFAOYSA-N 0 0 354.366 3.786 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)NCc1ccc(OC2CCCC2)nc1 ZINC000045930480 946247092 /nfs/dbraw/zinc/24/70/92/946247092.db2.gz SGTGUSAHYFBHHO-UHFFFAOYSA-N 0 0 370.409 3.941 20 5 FHBDRN Cc1ccc(N(C(C)C)S(=O)(=O)c2c(F)cccc2[N+](=O)[O-])cc1 ZINC000109344409 946253313 /nfs/dbraw/zinc/25/33/13/946253313.db2.gz QZAJKWWVADYMQJ-UHFFFAOYSA-N 0 0 352.387 3.646 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2noc(-c3cnc(Oc4ccccc4)cn3)n2)cc1 ZINC000546258601 946267356 /nfs/dbraw/zinc/26/73/56/946267356.db2.gz UXDZHTQDMFSOKK-UHFFFAOYSA-N 0 0 361.317 3.894 20 5 FHBDRN Cc1ccc([C@H]2C[C@@H](C)N(C(=O)COc3ccc([N+](=O)[O-])c(C)c3)C2)cc1 ZINC001270835957 946278753 /nfs/dbraw/zinc/27/87/53/946278753.db2.gz QRJMKUFKOTVSGL-AEFFLSMTSA-N 0 0 368.433 3.995 20 5 FHBDRN CCOc1ccc(CNC(=O)c2cccc(SC)c2[N+](=O)[O-])cc1F ZINC000186461851 946284936 /nfs/dbraw/zinc/28/49/36/946284936.db2.gz WXQCZKBYXIUDPK-UHFFFAOYSA-N 0 0 364.398 3.785 20 5 FHBDRN CN(CC1CCCC1)C(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000109431876 946291736 /nfs/dbraw/zinc/29/17/36/946291736.db2.gz LIPUONFITHYHLQ-UHFFFAOYSA-N 0 0 360.332 3.798 20 5 FHBDRN O=[N+]([O-])c1ccc(CN2CCN(Cc3ccc(Cl)s3)CC2)cc1 ZINC000018935523 946299893 /nfs/dbraw/zinc/29/98/93/946299893.db2.gz XBPKVOYCLCPBPE-UHFFFAOYSA-N 0 0 351.859 3.628 20 5 FHBDRN O=C(Nc1nc(-c2ccc[nH]2)cs1)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000053791657 946305589 /nfs/dbraw/zinc/30/55/89/946305589.db2.gz HAZMNFZTNIDWPX-UHFFFAOYSA-N 0 0 353.363 3.780 20 5 FHBDRN CC(C)c1csc(NC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)n1 ZINC000053791997 946307618 /nfs/dbraw/zinc/30/76/18/946307618.db2.gz DGZJZFJFOMCJMO-UHFFFAOYSA-N 0 0 371.422 3.828 20 5 FHBDRN COc1ccc(Cc2noc(CSc3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000109552845 946333055 /nfs/dbraw/zinc/33/30/55/946333055.db2.gz NGDRICBXSGVVMH-UHFFFAOYSA-N 0 0 357.391 3.870 20 5 FHBDRN COc1cccc([C@@H]2CCN(C(=O)c3cc([N+](=O)[O-])cnc3C)C2(C)C)c1 ZINC000893477708 946349822 /nfs/dbraw/zinc/34/98/22/946349822.db2.gz UBTBXVYQFMEXOT-SFHVURJKSA-N 0 0 369.421 3.715 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1Cc1nc(-c2ccc(-c3ccccc3)cc2)no1 ZINC000109614120 946352411 /nfs/dbraw/zinc/35/24/11/946352411.db2.gz IZMINVKZKBPINI-UHFFFAOYSA-N 0 0 361.361 3.865 20 5 FHBDRN CN(C(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-])c1ccc(Cl)nc1 ZINC001270844090 946354238 /nfs/dbraw/zinc/35/42/38/946354238.db2.gz IVIVIOGKVUTKPA-UHFFFAOYSA-N 0 0 358.156 3.641 20 5 FHBDRN CC(C)(C(=O)N[C@@H]1CCO[C@H](c2cccs2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000456564249 946354658 /nfs/dbraw/zinc/35/46/58/946354658.db2.gz YRYFVRQCWOERMR-ZBFHGGJFSA-N 0 0 374.462 3.970 20 5 FHBDRN CCCOc1ccc(CNC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)cc1 ZINC000087056480 946359017 /nfs/dbraw/zinc/35/90/17/946359017.db2.gz NAWVICYKQWGZBX-UHFFFAOYSA-N 0 0 369.421 3.652 20 5 FHBDRN CCCC1(C(=O)OCC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])CCC1 ZINC000759466553 946369214 /nfs/dbraw/zinc/36/92/14/946369214.db2.gz ORAVSALVSBWZHS-UHFFFAOYSA-N 0 0 354.790 3.700 20 5 FHBDRN NC(=O)c1ccc(CSCc2cc(-c3ccccc3)on2)c([N+](=O)[O-])c1 ZINC000129746063 946375074 /nfs/dbraw/zinc/37/50/74/946375074.db2.gz KZMSVLHVVOVNNC-UHFFFAOYSA-N 0 0 369.402 3.782 20 5 FHBDRN CCO[C@@H]1C[C@H](Nc2c3c(ccc2[N+](=O)[O-])NCC3)[C@H]1Oc1ccccc1 ZINC000302900779 946376054 /nfs/dbraw/zinc/37/60/54/946376054.db2.gz SVFRJJMPKLEVKB-ILZDJORESA-N 0 0 369.421 3.600 20 5 FHBDRN COc1ccc(C(=O)N[C@@H](C)c2cc3cccc(F)c3o2)cc1[N+](=O)[O-] ZINC000475099149 946377840 /nfs/dbraw/zinc/37/78/40/946377840.db2.gz XOALTDTXRKBHQK-JTQLQIEISA-N 0 0 358.325 3.980 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)NCc1coc(-c2cccs2)n1 ZINC000043149539 946397855 /nfs/dbraw/zinc/39/78/55/946397855.db2.gz KUZFRIVQYWGEGO-UHFFFAOYSA-N 0 0 358.379 3.941 20 5 FHBDRN CSc1cccc(C(=O)Nc2ccc(NC(=O)C3CC3)cc2)c1[N+](=O)[O-] ZINC000186044875 946399702 /nfs/dbraw/zinc/39/97/02/946399702.db2.gz XBGIATMJNQDZQJ-UHFFFAOYSA-N 0 0 371.418 3.918 20 5 FHBDRN COc1cc(C)c(NC(=O)CCCNc2ccc([N+](=O)[O-])cc2)cc1F ZINC000186043982 946400203 /nfs/dbraw/zinc/40/02/03/946400203.db2.gz YEMPXPSPXQNKNV-UHFFFAOYSA-N 0 0 361.373 3.882 20 5 FHBDRN C[C@H](NS(=O)(=O)c1cccc([N+](=O)[O-])c1)c1ccccc1C(F)(F)F ZINC000511894816 946405688 /nfs/dbraw/zinc/40/56/88/946405688.db2.gz UJNROXFKNSBOEL-JTQLQIEISA-N 0 0 374.340 3.653 20 5 FHBDRN Cc1nc(-c2ccccc2)oc1C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088252198 946412984 /nfs/dbraw/zinc/41/29/84/946412984.db2.gz NALSYYLDOVYPIL-UHFFFAOYSA-N 0 0 363.373 3.757 20 5 FHBDRN O=C(COc1ccccc1[N+](=O)[O-])N[C@H]1CCC[C@@H]1Cc1ccccc1 ZINC000121368020 946422215 /nfs/dbraw/zinc/42/22/15/946422215.db2.gz YAJWDUVYLXXDPS-SJORKVTESA-N 0 0 354.406 3.501 20 5 FHBDRN CN(CC(=O)Nc1cc(-c2ccccc2)ns1)c1ccccc1[N+](=O)[O-] ZINC000475490119 946424793 /nfs/dbraw/zinc/42/47/93/946424793.db2.gz ZKKRKKWYVBATLE-UHFFFAOYSA-N 0 0 368.418 3.793 20 5 FHBDRN Nc1c(C(=O)Nc2cc(-c3ccccc3)ns2)cc(F)cc1[N+](=O)[O-] ZINC000475489998 946424990 /nfs/dbraw/zinc/42/49/90/946424990.db2.gz XPZIPFCACGYTJY-UHFFFAOYSA-N 0 0 358.354 3.692 20 5 FHBDRN COC[C@H](Sc1ccc([N+](=O)[O-])cc1C(=O)NC1CC1)c1ccccc1 ZINC000897004249 946434784 /nfs/dbraw/zinc/43/47/84/946434784.db2.gz XVQPSTXFSSBXKX-SFHVURJKSA-N 0 0 372.446 3.967 20 5 FHBDRN O=c1[nH]c2ccccc2cc1CSCCOc1ccccc1[N+](=O)[O-] ZINC000111380319 946445968 /nfs/dbraw/zinc/44/59/68/946445968.db2.gz RQXMWBITIOHMLC-UHFFFAOYSA-N 0 0 356.403 3.749 20 5 FHBDRN CN(CCc1ccccc1)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000047866285 946445982 /nfs/dbraw/zinc/44/59/82/946445982.db2.gz RVQXSXYTCFOIFV-UHFFFAOYSA-N 0 0 365.336 3.903 20 5 FHBDRN COc1c(C(=O)N[C@H]2CCOc3c(Cl)cccc32)cccc1[N+](=O)[O-] ZINC000475124742 946446039 /nfs/dbraw/zinc/44/60/39/946446039.db2.gz ZODKMWUQZCPNRO-ZDUSSCGKSA-N 0 0 362.769 3.510 20 5 FHBDRN Cn1cc([N+](=O)[O-])cc1C(=O)N[C@H](c1cccs1)c1ccc(F)cc1 ZINC000025812451 946446800 /nfs/dbraw/zinc/44/68/00/946446800.db2.gz KABHCBSLOZRVKJ-INIZCTEOSA-N 0 0 359.382 3.653 20 5 FHBDRN CSc1cccc(C(=O)Nc2cccc(NC(=O)C3CC3)c2)c1[N+](=O)[O-] ZINC000186075907 946446837 /nfs/dbraw/zinc/44/68/37/946446837.db2.gz ADTCZGJWJLJBRZ-UHFFFAOYSA-N 0 0 371.418 3.918 20 5 FHBDRN Cc1noc(C)c1[C@H](C)CNc1ncc(Br)cc1[N+](=O)[O-] ZINC000129500652 946448558 /nfs/dbraw/zinc/44/85/58/946448558.db2.gz AGUWSEYIEUQSCD-SSDOTTSWSA-N 0 0 355.192 3.573 20 5 FHBDRN CCCC1(CNC(=O)CSCc2ccc(OC)c([N+](=O)[O-])c2)CC1 ZINC000151900556 946450371 /nfs/dbraw/zinc/45/03/71/946450371.db2.gz XQUKFBVATHBKOV-UHFFFAOYSA-N 0 0 352.456 3.533 20 5 FHBDRN CCOc1ccccc1[C@H](CC)NC(=O)c1ccc(NC)c([N+](=O)[O-])c1 ZINC000523093774 946466239 /nfs/dbraw/zinc/46/62/39/946466239.db2.gz PWYXYAGAPDUHRQ-HNNXBMFYSA-N 0 0 357.410 3.916 20 5 FHBDRN Cc1cc([C@H](C)NC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)c(C)s1 ZINC000111562422 946485116 /nfs/dbraw/zinc/48/51/16/946485116.db2.gz WKGFYTTUZBOWKH-JTQLQIEISA-N 0 0 371.418 3.606 20 5 FHBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)N[C@@H]1C[C@@H]1c1ccccc1 ZINC000067513803 946496287 /nfs/dbraw/zinc/49/62/87/946496287.db2.gz LPHYGECHCRCGCL-WOJBJXKFSA-N 0 0 368.436 3.827 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)NC[C@@H]2C[C@H]2c2ccccc2)c1 ZINC000111672221 946509294 /nfs/dbraw/zinc/50/92/94/946509294.db2.gz MNFUYWMNIJCFIG-IRXDYDNUSA-N 0 0 354.406 3.592 20 5 FHBDRN CSc1cccc(C(=O)Nc2ccc(OCC(C)C)nc2)c1[N+](=O)[O-] ZINC000186517547 946509643 /nfs/dbraw/zinc/50/96/43/946509643.db2.gz VYAYYPSSSGMAJO-UHFFFAOYSA-N 0 0 361.423 3.999 20 5 FHBDRN CCOC(=O)c1cc(C(=O)NC[C@@H](C)c2ccc(C)cc2)cc([N+](=O)[O-])c1 ZINC000523097850 946537485 /nfs/dbraw/zinc/53/74/85/946537485.db2.gz RGMUEXOYBFNJSJ-CQSZACIVSA-N 0 0 370.405 3.613 20 5 FHBDRN COc1c(C(=O)NC[C@@H]2CCCO[C@@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000475163115 946537962 /nfs/dbraw/zinc/53/79/62/946537962.db2.gz FPLUBOSTDYJJLD-MAUKXSAKSA-N 0 0 370.405 3.501 20 5 FHBDRN C[C@@H](CNC(=O)N1CCC(c2cccnc2)CC1)c1ccccc1[N+](=O)[O-] ZINC000897061199 946548269 /nfs/dbraw/zinc/54/82/69/946548269.db2.gz GCHVFBHNOGNHGZ-HNNXBMFYSA-N 0 0 368.437 3.683 20 5 FHBDRN Cc1ccc2c(CCNC(=O)CCc3cccc([N+](=O)[O-])c3)cn(C)c2c1 ZINC000186557807 946551809 /nfs/dbraw/zinc/55/18/09/946551809.db2.gz UPNVNHLBGUSJIX-UHFFFAOYSA-N 0 0 365.433 3.686 20 5 FHBDRN C[C@@H](NCc1ccc(-c2ccccc2[N+](=O)[O-])s1)c1nnc2n1CCC2 ZINC000237435743 946552197 /nfs/dbraw/zinc/55/21/97/946552197.db2.gz KUIHAABWTVWKLT-GFCCVEGCSA-N 0 0 369.450 3.712 20 5 FHBDRN C[C@H](CNC(=O)N1CCC[C@@H]1c1cccn1C)c1ccccc1[N+](=O)[O-] ZINC000897074267 946553412 /nfs/dbraw/zinc/55/34/12/946553412.db2.gz CJSJTBUMPHCLBO-RDTXWAMCSA-N 0 0 356.426 3.584 20 5 FHBDRN Cc1cccc([C@@H]2CCCN2C(=O)NC[C@@H](C)c2ccccc2[N+](=O)[O-])n1 ZINC000897068301 946562464 /nfs/dbraw/zinc/56/24/64/946562464.db2.gz UPYOCEGWTGHQCE-KUHUBIRLSA-N 0 0 368.437 3.948 20 5 FHBDRN CCCO[C@@H]1CCCN(C(=O)NC[C@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000897070228 946566300 /nfs/dbraw/zinc/56/63/00/946566300.db2.gz BPSXTELBTQHVHS-JKSUJKDBSA-N 0 0 363.458 3.689 20 5 FHBDRN CCN(C(=O)COc1cccc([N+](=O)[O-])c1)c1ccc(Cl)cc1F ZINC000441404474 946582193 /nfs/dbraw/zinc/58/21/93/946582193.db2.gz SLKAMVFSGVCNOM-UHFFFAOYSA-N 0 0 352.749 3.819 20 5 FHBDRN CC(C)N(Cc1c([N+](=O)[O-])ncn1C)Cc1cccc(C(F)(F)F)c1 ZINC000475523818 946586195 /nfs/dbraw/zinc/58/61/95/946586195.db2.gz FKSLMSPNIHCIHN-UHFFFAOYSA-N 0 0 356.348 3.758 20 5 FHBDRN CC(C)[C@H]1CN(C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CCO1 ZINC000475189818 946597614 /nfs/dbraw/zinc/59/76/14/946597614.db2.gz LGMCFINAZFPYQW-CYBMUJFWSA-N 0 0 361.320 3.502 20 5 FHBDRN Cn1cnc([N+](=O)[O-])c1CN1CCC(c2cccc3ccccc32)CC1 ZINC000475526490 946597887 /nfs/dbraw/zinc/59/78/87/946597887.db2.gz FPHGWJDDSXTDPN-UHFFFAOYSA-N 0 0 350.422 3.861 20 5 FHBDRN CSc1cccc(C(=O)NC[C@@H](C)Oc2ccccc2C)c1[N+](=O)[O-] ZINC000186593641 946609847 /nfs/dbraw/zinc/60/98/47/946609847.db2.gz VPRAJXCPYVWOEA-CYBMUJFWSA-N 0 0 360.435 3.822 20 5 FHBDRN C[C@@]1(Cc2ccccc2)CCCN1C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000186223877 946627546 /nfs/dbraw/zinc/62/75/46/946627546.db2.gz VNGKOFMZSWNVGS-FQEVSTJZSA-N 0 0 368.389 3.561 20 5 FHBDRN CC[C@@H](NC(=O)Nc1cc(C)c([N+](=O)[O-])cc1C)c1c(C)nn(C)c1C ZINC000475544811 946628349 /nfs/dbraw/zinc/62/83/49/946628349.db2.gz HOYOMPMHKVPYQS-CQSZACIVSA-N 0 0 359.430 3.835 20 5 FHBDRN Cc1c(Cc2noc([C@H](C)OC[C@H]3CCCCO3)n2)cccc1[N+](=O)[O-] ZINC000545781816 946628628 /nfs/dbraw/zinc/62/86/28/946628628.db2.gz SJOBTXJGJGGIFC-DZGCQCFKSA-N 0 0 361.398 3.524 20 5 FHBDRN C[C@@]1(CO)CCC[C@H]1NC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000473906631 946628676 /nfs/dbraw/zinc/62/86/76/946628676.db2.gz UDAOUDYIRMJLTF-QUCCMNQESA-N 0 0 369.421 3.619 20 5 FHBDRN CC[C@@H](CNc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2)Oc1cccc(F)c1 ZINC000440198481 946628752 /nfs/dbraw/zinc/62/87/52/946628752.db2.gz OPWCYVOTUXEKGF-AWEZNQCLSA-N 0 0 373.384 3.888 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NCCOc1ccc(F)cc1F ZINC000475556721 946629888 /nfs/dbraw/zinc/62/98/88/946629888.db2.gz RYKMGDSYIPMRTC-UHFFFAOYSA-N 0 0 365.336 3.690 20 5 FHBDRN Cc1c(Cc2noc(-c3occc3Br)n2)cccc1[N+](=O)[O-] ZINC000545774839 946632883 /nfs/dbraw/zinc/63/28/83/946632883.db2.gz GWLZHEUUKPXGSF-UHFFFAOYSA-N 0 0 364.155 3.900 20 5 FHBDRN CSc1cccc(C(=O)NC[C@@H](C)Oc2ccc(F)cc2)c1[N+](=O)[O-] ZINC000186594459 946635861 /nfs/dbraw/zinc/63/58/61/946635861.db2.gz DOACLKTYTVGBJR-LLVKDONJSA-N 0 0 364.398 3.653 20 5 FHBDRN Cc1ccc(NCCCNC(=O)N(C)[C@H](C)c2cccnc2)c([N+](=O)[O-])c1 ZINC000121399542 946655882 /nfs/dbraw/zinc/65/58/82/946655882.db2.gz MQVWPEGBVBTKSI-OAHLLOKOSA-N 0 0 371.441 3.503 20 5 FHBDRN CC(=O)c1ccc(OCC(=O)N(Cc2ccccc2)C(C)C)c([N+](=O)[O-])c1 ZINC000121393686 946655899 /nfs/dbraw/zinc/65/58/99/946655899.db2.gz RFBXEDJQGMMFBV-UHFFFAOYSA-N 0 0 370.405 3.613 20 5 FHBDRN CCS(=O)(=O)Nc1ccc(Nc2ccc3ncccc3c2[N+](=O)[O-])cc1 ZINC000112075138 946656007 /nfs/dbraw/zinc/65/60/07/946656007.db2.gz GNVCSPBDNLWQAA-UHFFFAOYSA-N 0 0 372.406 3.648 20 5 FHBDRN CO[C@H]1C[C@@H](NC(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1(C)C ZINC000475192496 946660761 /nfs/dbraw/zinc/66/07/61/946660761.db2.gz TZNFYZBAPFEXPM-NEPJUHHUSA-N 0 0 361.320 3.549 20 5 FHBDRN O=[N+]([O-])c1cccnc1SCc1nc(-c2cc(F)c(F)c(F)c2)no1 ZINC000134022452 946673378 /nfs/dbraw/zinc/67/33/78/946673378.db2.gz RESNAKRQHMFEEM-UHFFFAOYSA-N 0 0 368.296 3.749 20 5 FHBDRN Cc1nn(CC(=O)N[C@H](C)c2ccc(Cl)cc2Cl)c(C)c1[N+](=O)[O-] ZINC000015997041 946681757 /nfs/dbraw/zinc/68/17/57/946681757.db2.gz IQXIFKJBZYKJDH-MRVPVSSYSA-N 0 0 371.224 3.592 20 5 FHBDRN CN(Cc1nc(-c2ccccc2)c[nH]1)C(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000121418896 946681861 /nfs/dbraw/zinc/68/18/61/946681861.db2.gz HAXKBNKZWTXTNC-UHFFFAOYSA-N 0 0 370.796 3.911 20 5 FHBDRN CCCOc1cccc(NC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)c1 ZINC000088352284 946685500 /nfs/dbraw/zinc/68/55/00/946685500.db2.gz VWEPRMQBLCKEEA-UHFFFAOYSA-N 0 0 355.394 3.974 20 5 FHBDRN CCOc1cccc(CCNC(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)c1 ZINC000475568046 946688428 /nfs/dbraw/zinc/68/84/28/946688428.db2.gz ZRRHEJHMAKJTEU-UHFFFAOYSA-N 0 0 357.410 3.975 20 5 FHBDRN CCc1ccc(CN(C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)cc1 ZINC000051373210 946690650 /nfs/dbraw/zinc/69/06/50/946690650.db2.gz OMQZRHBXVNAZAR-UHFFFAOYSA-N 0 0 352.394 3.839 20 5 FHBDRN Cc1ccn(-c2ccccc2CNC(=O)c2ccc(Cl)cc2[N+](=O)[O-])n1 ZINC000151991935 946691858 /nfs/dbraw/zinc/69/18/58/946691858.db2.gz DUYSHHWBFKPKPR-UHFFFAOYSA-N 0 0 370.796 3.672 20 5 FHBDRN CC(=O)c1cc(NCCCn2c(C)nc3ccccc32)ccc1[N+](=O)[O-] ZINC000550345453 946700606 /nfs/dbraw/zinc/70/06/06/946700606.db2.gz GZEWRPQJKCTFKR-UHFFFAOYSA-N 0 0 352.394 3.958 20 5 FHBDRN CCS[C@H]1CCCCN(C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000112134686 946705691 /nfs/dbraw/zinc/70/56/91/946705691.db2.gz WRNPTKMGFFRZJL-BBRMVZONSA-N 0 0 351.472 3.973 20 5 FHBDRN CO[C@H]1CCC[C@H]1CNC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000475198130 946708377 /nfs/dbraw/zinc/70/83/77/946708377.db2.gz VUMJYHPBQCEGHG-ZANVPECISA-N 0 0 361.320 3.550 20 5 FHBDRN COCCOc1ccccc1CNC(=O)Nc1cc(C)c([N+](=O)[O-])cc1C ZINC000475576480 946726303 /nfs/dbraw/zinc/72/63/03/946726303.db2.gz UKVSZAVJFCMMPC-UHFFFAOYSA-N 0 0 373.409 3.559 20 5 FHBDRN C[C@H](C[C@@H]1CCCO1)NC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000475217519 946733297 /nfs/dbraw/zinc/73/32/97/946733297.db2.gz WYISLUXBJPEVME-KOLCDFICSA-N 0 0 361.320 3.693 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1cnn(-c2ccccc2C)c1 ZINC000112164276 946733398 /nfs/dbraw/zinc/73/33/98/946733398.db2.gz HKEHNYIYKQFVAE-UHFFFAOYSA-N 0 0 350.378 3.958 20 5 FHBDRN Cc1c(C(=O)Nc2cccc([N+](=O)[O-])c2)cnn1-c1ccccc1Cl ZINC000112164184 946735097 /nfs/dbraw/zinc/73/50/97/946735097.db2.gz SLKWSOKNAIHNGL-UHFFFAOYSA-N 0 0 356.769 3.995 20 5 FHBDRN O=C(CC[S@](=O)c1ccc2ccccc2c1)Nc1ccccc1[N+](=O)[O-] ZINC000507742956 946745359 /nfs/dbraw/zinc/74/53/59/946745359.db2.gz QSBJXXGAXIZPIU-SANMLTNESA-N 0 0 368.414 3.884 20 5 FHBDRN CCCN(Cc1ccc(F)cc1[N+](=O)[O-])[C@@H](C)C(=O)Nc1ccccc1 ZINC001168074009 946752249 /nfs/dbraw/zinc/75/22/49/946752249.db2.gz PBAWFDCBCXDUEV-AWEZNQCLSA-N 0 0 359.401 3.973 20 5 FHBDRN O=[N+]([O-])c1ccc(CN2CCSC[C@@H]2c2nccs2)c(Cl)c1 ZINC000186639963 946768422 /nfs/dbraw/zinc/76/84/22/946768422.db2.gz AHCQPMDIHYGBDJ-CYBMUJFWSA-N 0 0 355.872 3.995 20 5 FHBDRN CCOCCC1(CNc2ccc(C(=O)NC(C)C)cc2[N+](=O)[O-])CCC1 ZINC000134029301 946786356 /nfs/dbraw/zinc/78/63/56/946786356.db2.gz PQQQULYZDOTPSA-UHFFFAOYSA-N 0 0 363.458 3.742 20 5 FHBDRN C[C@@H](N[C@H](c1nccn1C)c1cccc(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000128505172 946798905 /nfs/dbraw/zinc/79/89/05/946798905.db2.gz XOVPIWDTEVJVTN-ACJLOTCBSA-N 0 0 354.385 3.908 20 5 FHBDRN CCOC(=O)c1ccnc(NCc2oc3ccccc3c2C)c1[N+](=O)[O-] ZINC000523115175 946803461 /nfs/dbraw/zinc/80/34/61/946803461.db2.gz XMZNGFUDHMZYRX-UHFFFAOYSA-N 0 0 355.350 3.833 20 5 FHBDRN CCOc1cccc(CNc2ncc(Br)cc2[N+](=O)[O-])c1 ZINC000048552607 946820863 /nfs/dbraw/zinc/82/08/63/946820863.db2.gz QFYHOGNLRYBFKA-UHFFFAOYSA-N 0 0 352.188 3.763 20 5 FHBDRN CC(C)(C)c1nc(CC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)cs1 ZINC000186306886 946840430 /nfs/dbraw/zinc/84/04/30/946840430.db2.gz ZORSLFITUWELCY-UHFFFAOYSA-N 0 0 367.858 3.861 20 5 FHBDRN CN(Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)Cc1ccccc1Cl ZINC000025917478 946842713 /nfs/dbraw/zinc/84/27/13/946842713.db2.gz PYWJAIPQVGHBQT-UHFFFAOYSA-N 0 0 358.785 3.930 20 5 FHBDRN Cn1cc(CCC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)c2ccccc21 ZINC000186312896 946845456 /nfs/dbraw/zinc/84/54/56/946845456.db2.gz AFJOJNHWZYOXOB-UHFFFAOYSA-N 0 0 371.824 3.989 20 5 FHBDRN CC(C)c1cc(NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)n[nH]1 ZINC000051380735 946881589 /nfs/dbraw/zinc/88/15/89/946881589.db2.gz AGMNKUVEZPDXLI-UHFFFAOYSA-N 0 0 357.395 3.817 20 5 FHBDRN Cc1ccccc1[C@@H](CC(C)C)NC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000112478582 946884428 /nfs/dbraw/zinc/88/44/28/946884428.db2.gz SRKTWSAGHFOMLX-GOSISDBHSA-N 0 0 369.421 3.745 20 5 FHBDRN Cc1conc1NC(=O)c1ccc(N2C[C@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000123534240 946887709 /nfs/dbraw/zinc/88/77/09/946887709.db2.gz KASSNBKWHMPIEY-TXEJJXNPSA-N 0 0 358.398 3.626 20 5 FHBDRN Cc1cc2cc[nH]c2cc1NC(=O)c1cc([N+](=O)[O-])ccc1SCCO ZINC000444458585 946894309 /nfs/dbraw/zinc/89/43/09/946894309.db2.gz VBFYRHKUYJZVGA-UHFFFAOYSA-N 0 0 371.418 3.721 20 5 FHBDRN Cc1c(CS(=O)(=O)Cc2ccc(F)cc2Cl)cccc1[N+](=O)[O-] ZINC000048717420 946897025 /nfs/dbraw/zinc/89/70/25/946897025.db2.gz KYIINNRTSPKEFE-UHFFFAOYSA-N 0 0 357.790 3.811 20 5 FHBDRN C[C@H](NC(=O)c1ccc(F)cc1[N+](=O)[O-])c1cccc(OC(F)F)c1 ZINC000121267359 946900988 /nfs/dbraw/zinc/90/09/88/946900988.db2.gz UHYBEDGUSUIRQY-VIFPVBQESA-N 0 0 354.284 3.826 20 5 FHBDRN Cc1ccc(CNc2cccc(N3C(=O)CCCC3=O)c2)cc1[N+](=O)[O-] ZINC000475336390 946905498 /nfs/dbraw/zinc/90/54/98/946905498.db2.gz OJNQFDAOLYPKOD-UHFFFAOYSA-N 0 0 353.378 3.559 20 5 FHBDRN COc1cccc([C@H]2C[C@H](C)CN2C(=O)c2cc([N+](=O)[O-])cnc2C)c1 ZINC000544323743 946906824 /nfs/dbraw/zinc/90/68/24/946906824.db2.gz ZKTFRKCDRVCUHW-KPZWWZAWSA-N 0 0 355.394 3.530 20 5 FHBDRN C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)[C@H]1CCN(c2ccccc2)[C@@H]1C ZINC000475341674 946910315 /nfs/dbraw/zinc/91/03/15/946910315.db2.gz DMEODHXCGMANKI-CLCXKQKWSA-N 0 0 365.433 3.787 20 5 FHBDRN COC(=O)c1cc(C(=O)N(C)[C@H](c2ccccc2)C(C)C)cc([N+](=O)[O-])c1 ZINC000112588028 946916766 /nfs/dbraw/zinc/91/67/66/946916766.db2.gz SQEFXEKPKFBHRQ-SFHVURJKSA-N 0 0 370.405 3.851 20 5 FHBDRN CC(C)OCc1ccc(NC(=O)NCCc2cccc([N+](=O)[O-])c2)cc1 ZINC000536283260 946918264 /nfs/dbraw/zinc/91/82/64/946918264.db2.gz DIFOTTBFYJLGCF-UHFFFAOYSA-N 0 0 357.410 3.884 20 5 FHBDRN Cc1nn(-c2ccccc2)c(C)c1CNC(=O)c1c(C)cccc1[N+](=O)[O-] ZINC000184510157 946920754 /nfs/dbraw/zinc/92/07/54/946920754.db2.gz CRJKOHVJIDFGIO-UHFFFAOYSA-N 0 0 364.405 3.636 20 5 FHBDRN CN(Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)Cc1ccc(Cl)cc1 ZINC000025944126 946923327 /nfs/dbraw/zinc/92/33/27/946923327.db2.gz TWHIZTSCFCOGQI-UHFFFAOYSA-N 0 0 358.785 3.930 20 5 FHBDRN Cn1cc([N+](=O)[O-])cc1C(=O)Nc1cc(F)ccc1SCC(F)F ZINC000523147604 946924660 /nfs/dbraw/zinc/92/46/60/946924660.db2.gz QHVOTXHHZATZBG-UHFFFAOYSA-N 0 0 359.329 3.682 20 5 FHBDRN CC[C@H](NC(=O)Cc1ccc(OC)c([N+](=O)[O-])c1)c1ccc(F)cc1F ZINC000523147216 946924711 /nfs/dbraw/zinc/92/47/11/946924711.db2.gz VIAIQMIXMOZHRP-HNNXBMFYSA-N 0 0 364.348 3.692 20 5 FHBDRN CC(C)(C)C(=O)NC[C@@H]1CCCN(c2ccc3ncccc3c2[N+](=O)[O-])C1 ZINC000112695564 946930471 /nfs/dbraw/zinc/93/04/71/946930471.db2.gz FMWIVTVLVFRVCM-AWEZNQCLSA-N 0 0 370.453 3.522 20 5 FHBDRN CCS[C@@H]1CC[C@@H](N(C)C(=O)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000458890435 946942306 /nfs/dbraw/zinc/94/23/06/946942306.db2.gz PPHKTUYXQOWOIF-APHBMKBZSA-N 0 0 351.472 3.971 20 5 FHBDRN CN(C(=O)c1cc(F)c(Cl)c([N+](=O)[O-])c1Cl)[C@H]1CCSC1 ZINC000897222046 946942653 /nfs/dbraw/zinc/94/26/53/946942653.db2.gz LBNINXDASZRELQ-LURJTMIESA-N 0 0 353.202 3.618 20 5 FHBDRN Cc1c(NC(=O)C(=O)N(C)[C@@H](c2ccccc2)C(C)C)cccc1[N+](=O)[O-] ZINC000112754716 946944351 /nfs/dbraw/zinc/94/43/51/946944351.db2.gz MUNRVQLDWUCRQW-GOSISDBHSA-N 0 0 369.421 3.697 20 5 FHBDRN C[C@H](NC(=O)N1CC[C@H](Nc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000458892929 946947754 /nfs/dbraw/zinc/94/77/54/946947754.db2.gz VXUBMGGCLZOZAP-YOEHRIQHSA-N 0 0 354.410 3.552 20 5 FHBDRN CCOc1ccc(F)c(NC(=O)NCCc2cccc([N+](=O)[O-])c2)c1F ZINC000536288317 946949070 /nfs/dbraw/zinc/94/90/70/946949070.db2.gz IIWMHCLRCFUNRY-UHFFFAOYSA-N 0 0 365.336 3.636 20 5 FHBDRN COc1cccc(NCc2cn(-c3ccc(F)cc3)nc2C)c1[N+](=O)[O-] ZINC000475361998 946953966 /nfs/dbraw/zinc/95/39/66/946953966.db2.gz RBBZCMWJJNOMLR-UHFFFAOYSA-N 0 0 356.357 3.849 20 5 FHBDRN CC[C@@H](C)n1ncc(NC(=O)COc2ccc([N+](=O)[O-])c(C)c2)c1C1CC1 ZINC000432249976 946955567 /nfs/dbraw/zinc/95/55/67/946955567.db2.gz IDURJJGTWDEZCZ-CYBMUJFWSA-N 0 0 372.425 3.966 20 5 FHBDRN O=C(NCCCCc1ccccc1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000021044546 947008681 /nfs/dbraw/zinc/00/86/81/947008681.db2.gz GZHDWFHZQPYYKJ-UHFFFAOYSA-N 0 0 353.422 3.922 20 5 FHBDRN C[C@H](NC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1)c1cccc2ccccc21 ZINC000523228172 947010563 /nfs/dbraw/zinc/01/05/63/947010563.db2.gz LFFMOGMLMDBWDS-ZDUSSCGKSA-N 0 0 352.394 3.557 20 5 FHBDRN CCc1[nH]nc(C(=O)N2C[C@H](c3ccccc3)c3ccccc32)c1[N+](=O)[O-] ZINC000444576762 947013500 /nfs/dbraw/zinc/01/35/00/947013500.db2.gz VWQRROTZLHFJQC-OAHLLOKOSA-N 0 0 362.389 3.673 20 5 FHBDRN CCCN(CC)C(=O)c1ccc(C(=O)Nc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000511926875 947019290 /nfs/dbraw/zinc/01/92/90/947019290.db2.gz MUMSJQXLDPHMTI-UHFFFAOYSA-N 0 0 373.384 3.858 20 5 FHBDRN C[C@@H](Cc1ccccc1F)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186350649 947027300 /nfs/dbraw/zinc/02/73/00/947027300.db2.gz DJRUTSUODCMDIH-NSHDSACASA-N 0 0 350.777 3.882 20 5 FHBDRN COC(=O)c1ccc(F)c(Cn2ncc3cc([N+](=O)[O-])cc(Cl)c32)c1 ZINC000511932789 947038922 /nfs/dbraw/zinc/03/89/22/947038922.db2.gz BWKGYMCFVACPFB-UHFFFAOYSA-N 0 0 363.732 3.572 20 5 FHBDRN CCOCCC1(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)CCCC1 ZINC000186353890 947040305 /nfs/dbraw/zinc/04/03/05/947040305.db2.gz GZKSVDZFMGXKGO-UHFFFAOYSA-N 0 0 354.834 3.851 20 5 FHBDRN CC(C)Cn1cc(NC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)cn1 ZINC000473974966 947042092 /nfs/dbraw/zinc/04/20/92/947042092.db2.gz CCXCCRKAHULWES-UHFFFAOYSA-N 0 0 369.328 3.693 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)N1CCC(c2ncc3n2CCCC3)CC1 ZINC000278854350 947050084 /nfs/dbraw/zinc/05/00/84/947050084.db2.gz MANVMICYAPYNAI-UHFFFAOYSA-N 0 0 369.425 3.539 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNCc1cscc1Br ZINC000511938595 947053842 /nfs/dbraw/zinc/05/38/42/947053842.db2.gz BFGUOGZOBRTRMH-UHFFFAOYSA-N 0 0 357.229 3.717 20 5 FHBDRN C[C@H](CCC(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccccc1 ZINC000444637314 947056713 /nfs/dbraw/zinc/05/67/13/947056713.db2.gz QFJUKFSSAVHXBX-CYBMUJFWSA-N 0 0 352.394 3.671 20 5 FHBDRN CC(C)[C@@H](C(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccc(F)cc1 ZINC000444630954 947061430 /nfs/dbraw/zinc/06/14/30/947061430.db2.gz JLPOBRMMFJYHQO-GOSISDBHSA-N 0 0 370.384 3.666 20 5 FHBDRN CC[C@H](C)[C@H](C(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccccc1 ZINC000444632958 947062286 /nfs/dbraw/zinc/06/22/86/947062286.db2.gz QYIGTAOSNFBTSY-DJJJIMSYSA-N 0 0 366.421 3.917 20 5 FHBDRN CN(Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)Cc1nc(C(F)(F)F)cs1 ZINC000444654856 947073577 /nfs/dbraw/zinc/07/35/77/947073577.db2.gz YNQCHKDFTVVUJX-UHFFFAOYSA-N 0 0 371.344 3.578 20 5 FHBDRN CC(C)(CCC(=O)N[C@@H]1CCC[C@@H](c2nc3ccccc3[nH]2)C1)[N+](=O)[O-] ZINC000843683582 947079320 /nfs/dbraw/zinc/07/93/20/947079320.db2.gz AAKPSTWBXTXAFR-ZIAGYGMSSA-N 0 0 358.442 3.541 20 5 FHBDRN CC(C)(C)Oc1ccccc1CNC(=O)CCNc1ccccc1[N+](=O)[O-] ZINC001126587480 947080725 /nfs/dbraw/zinc/08/07/25/947080725.db2.gz BENPLPQKZMWPEC-UHFFFAOYSA-N 0 0 371.437 3.891 20 5 FHBDRN COc1ccc2c(c1)CCC[C@@H]2N(C)C(=O)c1ccc([N+](=O)[O-])c(OC)c1 ZINC000511945818 947081786 /nfs/dbraw/zinc/08/17/86/947081786.db2.gz WUCOADVCZWZMHY-KRWDZBQOSA-N 0 0 370.405 3.762 20 5 FHBDRN CCCCOc1cc(OC)ccc1C(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000469922910 947090343 /nfs/dbraw/zinc/09/03/43/947090343.db2.gz HPOAESPIEDYETN-UHFFFAOYSA-N 0 0 370.405 3.985 20 5 FHBDRN CC(C)(C)[C@@H]1OCCC[C@@H]1CNC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000522808415 947099447 /nfs/dbraw/zinc/09/94/47/947099447.db2.gz NYROAYURBBWRAB-CXAGYDPISA-N 0 0 359.426 3.647 20 5 FHBDRN CC(C)OC(=O)C[C@H](NC(=O)C[C@@H]1C=CCCC1)c1ccccc1[N+](=O)[O-] ZINC000186375281 947112235 /nfs/dbraw/zinc/11/22/35/947112235.db2.gz FWCYUVQXVZBEPY-WBVHZDCISA-N 0 0 374.437 3.840 20 5 FHBDRN Cc1ccc(CN(CC2CC2)C(=O)c2cc(F)cc(C)c2[N+](=O)[O-])cn1 ZINC000843683109 947113865 /nfs/dbraw/zinc/11/38/65/947113865.db2.gz LHAYCVZLUNFJIY-UHFFFAOYSA-N 0 0 357.385 3.798 20 5 FHBDRN Nc1c(C(=O)N2CC3(CCCC3)c3c2cccc3F)cc(F)cc1[N+](=O)[O-] ZINC000523335795 947136883 /nfs/dbraw/zinc/13/68/83/947136883.db2.gz DTZFDZSEGSGOFE-UHFFFAOYSA-N 0 0 373.359 3.927 20 5 FHBDRN CN(CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)Cc1cc(F)cc(F)c1 ZINC000444712414 947140861 /nfs/dbraw/zinc/14/08/61/947140861.db2.gz ZMGACYMFSVFJOE-UHFFFAOYSA-N 0 0 369.755 3.597 20 5 FHBDRN O=C(c1ccc(NC2CC2)c([N+](=O)[O-])c1)N1CCC[C@H]1c1ccncc1 ZINC000026001033 947144906 /nfs/dbraw/zinc/14/49/06/947144906.db2.gz HZRPLBRTARTYGH-KRWDZBQOSA-N 0 0 352.394 3.541 20 5 FHBDRN Cc1cc(C(F)(F)F)ccc1CNC(=O)Nc1ccncc1[N+](=O)[O-] ZINC000188187492 947145939 /nfs/dbraw/zinc/14/59/39/947145939.db2.gz IFAWWVMVGHDFJO-UHFFFAOYSA-N 0 0 354.288 3.639 20 5 FHBDRN CC1(c2cccc(Cl)c2)CCN(C(=O)Nc2ccncc2[N+](=O)[O-])CC1 ZINC000432293562 947148732 /nfs/dbraw/zinc/14/87/32/947148732.db2.gz IZJYAXYRYIBIFF-UHFFFAOYSA-N 0 0 374.828 3.651 20 5 FHBDRN CCCN(C(=O)CCCNC(=O)[C@@H]1CC=CCC1)c1cccc([N+](=O)[O-])c1 ZINC000441432014 947157606 /nfs/dbraw/zinc/15/76/06/947157606.db2.gz FDKGCBFDEDGAEO-MRXNPFEDSA-N 0 0 373.453 3.591 20 5 FHBDRN O=[N+]([O-])c1cc(F)ccc1N1CCN(c2nc3ccccc3s2)CC1 ZINC000301075985 947163587 /nfs/dbraw/zinc/16/35/87/947163587.db2.gz ISJGBXGUVJFEPR-UHFFFAOYSA-N 0 0 358.398 3.670 20 5 FHBDRN Cc1ccc(C(=O)N[C@H](c2cccc(F)c2)c2ccccn2)cc1[N+](=O)[O-] ZINC000121285080 947169269 /nfs/dbraw/zinc/16/92/69/947169269.db2.gz FBDUQMVHYUHBIP-LJQANCHMSA-N 0 0 365.364 3.957 20 5 FHBDRN Cn1cnc2cc(NC(=O)CCOc3ccc(Cl)cc3[N+](=O)[O-])ccc21 ZINC000440540336 947181419 /nfs/dbraw/zinc/18/14/19/947181419.db2.gz MXPZLRUXUBSERT-UHFFFAOYSA-N 0 0 374.784 3.543 20 5 FHBDRN Cc1cc(C)n(-c2ccccc2CNC(=O)Nc2cccc([N+](=O)[O-])c2)n1 ZINC000151820176 947184532 /nfs/dbraw/zinc/18/45/32/947184532.db2.gz QMZFLZQXEAXJDR-UHFFFAOYSA-N 0 0 365.393 3.719 20 5 FHBDRN NC(=O)c1cc(NCc2coc(-c3ccc([N+](=O)[O-])cc3)n2)ccc1Cl ZINC000536302112 947194769 /nfs/dbraw/zinc/19/47/69/947194769.db2.gz KTKQYHXFAAFAOK-UHFFFAOYSA-N 0 0 372.768 3.614 20 5 FHBDRN Cc1ccc(C[C@H](C)N(C)C(=O)CCOc2ccccc2[N+](=O)[O-])cc1 ZINC000523406902 947216926 /nfs/dbraw/zinc/21/69/26/947216926.db2.gz YPXNKRAUUBURBY-INIZCTEOSA-N 0 0 356.422 3.762 20 5 FHBDRN CC(C)[C@@H]1[C@@H](C(C)C)CN1C(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000456315288 947238199 /nfs/dbraw/zinc/23/81/99/947238199.db2.gz DVHOZVYAWWZFEE-SJLPKXTDSA-N 0 0 356.426 3.533 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H](OC)C[C@H]1C ZINC000441435761 947239463 /nfs/dbraw/zinc/23/94/63/947239463.db2.gz FNTXLWXQQRAUAD-TZMCWYRMSA-N 0 0 352.456 3.736 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NCC(C)(C)c1ccccn1 ZINC000458920856 947242179 /nfs/dbraw/zinc/24/21/79/947242179.db2.gz MELMJEJHNDTNNT-UHFFFAOYSA-N 0 0 370.453 3.888 20 5 FHBDRN O=C(Nc1ccc2c(c1)OCCO2)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000444828785 947243528 /nfs/dbraw/zinc/24/35/28/947243528.db2.gz WPTRUHWEDNVZLO-UHFFFAOYSA-N 0 0 372.380 3.705 20 5 FHBDRN CCOc1ccccc1[C@@H](CC)NC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000523415477 947246239 /nfs/dbraw/zinc/24/62/39/947246239.db2.gz LPGBPMGEVYNWJX-CQSZACIVSA-N 0 0 372.377 3.603 20 5 FHBDRN CC[C@@H](NS(=O)(=O)c1c(C)cccc1[N+](=O)[O-])c1ccc(F)cc1F ZINC000523416844 947247718 /nfs/dbraw/zinc/24/77/18/947247718.db2.gz FTZUZGFFXRXXBW-CQSZACIVSA-N 0 0 370.377 3.611 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC(C)(C)c1cccc(Cl)c1 ZINC000523417811 947248098 /nfs/dbraw/zinc/24/80/98/947248098.db2.gz TUEDXONZKOGEFV-UHFFFAOYSA-N 0 0 368.842 3.770 20 5 FHBDRN Cc1cn2cc(NC(=O)N(Cc3ccc([N+](=O)[O-])cc3)C(C)C)ccc2n1 ZINC000523423911 947255869 /nfs/dbraw/zinc/25/58/69/947255869.db2.gz QQDMAOMTGXATHW-UHFFFAOYSA-N 0 0 367.409 3.993 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)N1CC[C@H](c2ccccc2)C1 ZINC000519915947 947259872 /nfs/dbraw/zinc/25/98/72/947259872.db2.gz XOFBMDHUGLAYGX-KRWDZBQOSA-N 0 0 353.422 3.803 20 5 FHBDRN COc1cccc(CN(C)C(=O)c2cccc3c(=O)c4ccccc4[nH]c23)c1 ZINC000444831066 947261553 /nfs/dbraw/zinc/26/15/53/947261553.db2.gz YCFHMFOLICYEFQ-UHFFFAOYSA-N 0 0 372.424 3.962 20 5 FHBDRN CC(C)CCSc1ccc(C(=O)Nc2nncs2)cc1[N+](=O)[O-] ZINC000021213466 947263900 /nfs/dbraw/zinc/26/39/00/947263900.db2.gz FVPUNLMMLNGLKJ-UHFFFAOYSA-N 0 0 352.441 3.837 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N(C)Cc1nc(-c2ccccc2)c[nH]1 ZINC000121297730 947277570 /nfs/dbraw/zinc/27/75/70/947277570.db2.gz KGIVWMJJWRZJBG-UHFFFAOYSA-N 0 0 350.378 3.566 20 5 FHBDRN CN(C(=O)c1ccc([N+](=O)[O-])[nH]1)c1ccc(OCc2ccccc2)cc1 ZINC000440578635 947287027 /nfs/dbraw/zinc/28/70/27/947287027.db2.gz WLNPOAZKABTLKB-UHFFFAOYSA-N 0 0 351.362 3.779 20 5 FHBDRN CCO[C@@H](CNc1cc(C)c([N+](=O)[O-])c(C(=O)OC)c1)c1ccccc1 ZINC000444867623 947294086 /nfs/dbraw/zinc/29/40/86/947294086.db2.gz CPPNMFDNYGMAGW-KRWDZBQOSA-N 0 0 358.394 3.880 20 5 FHBDRN CCC[C@H](NC(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccccc1 ZINC000444887364 947314707 /nfs/dbraw/zinc/31/47/07/947314707.db2.gz HMJRZUOPOTUZLS-HNNXBMFYSA-N 0 0 367.409 3.812 20 5 FHBDRN CC[C@H](NC(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccc(C)cc1 ZINC000444888430 947316069 /nfs/dbraw/zinc/31/60/69/947316069.db2.gz QASXPLLQWWREKT-HNNXBMFYSA-N 0 0 367.409 3.730 20 5 FHBDRN COc1ccc(CSCC(=O)NC2C[C@H](C)C[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000523512839 947326020 /nfs/dbraw/zinc/32/60/20/947326020.db2.gz UZTZXBXGIUGLDA-CHWSQXEVSA-N 0 0 366.483 3.778 20 5 FHBDRN Cc1ccc(NCCCNC(=O)C2(c3ccccc3)CC2)c([N+](=O)[O-])c1 ZINC000523512860 947325906 /nfs/dbraw/zinc/32/59/06/947325906.db2.gz WAIXLZRVJBLISV-UHFFFAOYSA-N 0 0 353.422 3.553 20 5 FHBDRN COc1ccccc1CCN(C)C(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000523500684 947333226 /nfs/dbraw/zinc/33/32/26/947333226.db2.gz NUWVHODCUGEHQP-UHFFFAOYSA-N 0 0 356.422 3.582 20 5 FHBDRN O=C(c1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCC(OCC2CC2)CC1 ZINC000440592576 947335017 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CCCN(C(=O)Cc1cccc(OCCOC)c1)c1cccc([N+](=O)[O-])c1 ZINC000441461433 947601919 /nfs/dbraw/zinc/60/19/19/947601919.db2.gz GEGKEZMHMMKMMG-UHFFFAOYSA-N 0 0 372.421 3.606 20 5 FHBDRN C[C@@H]1CCC[C@H](C)N1C(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000087086907 947606020 /nfs/dbraw/zinc/60/60/20/947606020.db2.gz PIGDHSDNZOJKDT-PHIMTYICSA-N 0 0 355.232 3.689 20 5 FHBDRN COc1ccc(COc2cccc3c2C(=O)CC(C)(C)O3)cc1[N+](=O)[O-] ZINC000427573581 947606353 /nfs/dbraw/zinc/60/63/53/947606353.db2.gz KLVWORCYJTWITH-UHFFFAOYSA-N 0 0 357.362 3.926 20 5 FHBDRN COC(=O)c1ccc(C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)c(F)c1 ZINC000475624126 947625898 /nfs/dbraw/zinc/62/58/98/947625898.db2.gz YVEILGWPKYLCTA-UHFFFAOYSA-N 0 0 374.368 3.571 20 5 FHBDRN Cc1c(Cc2noc(-c3cc4ccccc4c(=O)[nH]3)n2)cccc1[N+](=O)[O-] ZINC000445228540 947626149 /nfs/dbraw/zinc/62/61/49/947626149.db2.gz MSNOBGBKWVGKDJ-UHFFFAOYSA-N 0 0 362.345 3.798 20 5 FHBDRN CCCOc1cccnc1C(=O)OCc1ccc([N+](=O)[O-])cc1Cl ZINC000758944796 947627568 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Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(-c2n[nH]c(C3CC3)n2)cc1 ZINC000523852915 947653476 /nfs/dbraw/zinc/65/34/76/947653476.db2.gz ZOPIGQCXNHPZRG-UHFFFAOYSA-N 0 0 363.377 3.818 20 5 FHBDRN CCc1cccc(CC)c1NC(=O)COC(=O)c1c(C)cccc1[N+](=O)[O-] ZINC000026113634 947656010 /nfs/dbraw/zinc/65/60/10/947656010.db2.gz YPABWBCNDHOJTG-UHFFFAOYSA-N 0 0 370.405 3.824 20 5 FHBDRN CCc1cccc(C)c1NC(=O)COC(=O)c1c(C)cccc1[N+](=O)[O-] ZINC000026115447 947668482 /nfs/dbraw/zinc/66/84/82/947668482.db2.gz BQOQJEDYJWZJTL-UHFFFAOYSA-N 0 0 356.378 3.570 20 5 FHBDRN COc1cc(C(=O)N2CC3(CCC3)c3c2cccc3F)ccc1[N+](=O)[O-] ZINC000523860911 947671550 /nfs/dbraw/zinc/67/15/50/947671550.db2.gz LQVQKUCWTMUAOV-UHFFFAOYSA-N 0 0 356.353 3.825 20 5 FHBDRN CC[C@H](Cc1ccc(Cl)cc1)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000523854958 947686913 /nfs/dbraw/zinc/68/69/13/947686913.db2.gz XLSQVJRZAZFATA-CQSZACIVSA-N 0 0 368.842 3.548 20 5 FHBDRN CO[C@@](C)(CNC(=O)NC(C)(C)c1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000458990334 947700361 /nfs/dbraw/zinc/70/03/61/947700361.db2.gz SSSVDWDFCOZVSR-FQEVSTJZSA-N 0 0 371.437 3.691 20 5 FHBDRN COc1cccc(N2C[C@H](C(F)(F)F)[C@@H](C(F)(F)F)C2)c1[N+](=O)[O-] ZINC000613884228 947701561 /nfs/dbraw/zinc/70/15/61/947701561.db2.gz SDIMFQVAAFIKEP-YUMQZZPRSA-N 0 0 358.238 3.780 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H](C)[C@H]1COc2ccccc21 ZINC000248394010 947702577 /nfs/dbraw/zinc/70/25/77/947702577.db2.gz MPVNYBZRVAIMCJ-ZSZQSSIHSA-N 0 0 368.433 3.844 20 5 FHBDRN COc1cc(F)cc2sc(NC(=O)c3cc([N+](=O)[O-])ccc3F)nc21 ZINC000728849323 947710175 /nfs/dbraw/zinc/71/01/75/947710175.db2.gz OIXLGIKPSRDOQY-UHFFFAOYSA-N 0 0 365.317 3.744 20 5 FHBDRN Cc1cccc([C@H](C)C(=O)O[C@@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)c1 ZINC000759936795 947710294 /nfs/dbraw/zinc/71/02/94/947710294.db2.gz VQPQGGJXAPXWHJ-BHYGNILZSA-N 0 0 357.410 3.930 20 5 FHBDRN CC(C)c1ccc(C(=O)Nc2ccc(C(=O)N(C)C)cc2)cc1[N+](=O)[O-] ZINC000190444754 947713210 /nfs/dbraw/zinc/71/32/10/947713210.db2.gz PDQFZYCLTMSQHX-UHFFFAOYSA-N 0 0 355.394 3.672 20 5 FHBDRN O=C(NCC1CCOCC1)c1ccccc1Sc1ccccc1[N+](=O)[O-] ZINC000440722684 947724695 /nfs/dbraw/zinc/72/46/95/947724695.db2.gz FJNGBVGQXWIEOZ-UHFFFAOYSA-N 0 0 372.446 3.902 20 5 FHBDRN CCc1ccc(NC(=O)Cc2noc(-c3cc(C)cc([N+](=O)[O-])c3)n2)cc1 ZINC000445322644 947725962 /nfs/dbraw/zinc/72/59/62/947725962.db2.gz WIRUHFJFNWGNBS-UHFFFAOYSA-N 0 0 366.377 3.697 20 5 FHBDRN O=C(Cc1noc(-c2cccc([N+](=O)[O-])c2)n1)Nc1cccc2ccccc21 ZINC000445337317 947737194 /nfs/dbraw/zinc/73/71/94/947737194.db2.gz QACIZBQAUATEPK-UHFFFAOYSA-N 0 0 374.356 3.979 20 5 FHBDRN Cc1csc([C@@H](C)NC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)n1 ZINC000121559361 947748762 /nfs/dbraw/zinc/74/87/62/947748762.db2.gz WIIPUEQLFCMVHF-GFCCVEGCSA-N 0 0 360.439 3.795 20 5 FHBDRN Cn1cc(CCNC(=O)c2cccc([N+](=O)[O-])c2)c2ccc(Cl)cc21 ZINC000440731382 947754910 /nfs/dbraw/zinc/75/49/10/947754910.db2.gz YWCLIKLSSKNJFP-UHFFFAOYSA-N 0 0 357.797 3.712 20 5 FHBDRN CC(C)OCc1cccc(N[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)c1 ZINC000141438735 947756861 /nfs/dbraw/zinc/75/68/61/947756861.db2.gz ADDINNKLRANAKH-CQSZACIVSA-N 0 0 357.410 3.959 20 5 FHBDRN O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@@H]1Cc2cc(Cl)ccc2O1 ZINC000105044236 947783185 /nfs/dbraw/zinc/78/31/85/947783185.db2.gz SEOAMVXNHSVRFP-AWEZNQCLSA-N 0 0 353.161 3.844 20 5 FHBDRN COC(=O)c1ccc(Oc2nc(-c3ccccc3)ns2)cc1[N+](=O)[O-] ZINC000613890285 947811476 /nfs/dbraw/zinc/81/14/76/947811476.db2.gz NJIKZKXVOHPBFO-UHFFFAOYSA-N 0 0 357.347 3.692 20 5 FHBDRN COc1cccc([C@H]2C[C@H](NC(=O)N[C@@H](C)c3ccccc3[N+](=O)[O-])C2)c1 ZINC000454760691 947820327 /nfs/dbraw/zinc/82/03/27/947820327.db2.gz MOSZOSSBGWUPCZ-BPUTZDHNSA-N 0 0 369.421 3.910 20 5 FHBDRN Cc1cccc(C)c1NC(=O)[C@@H](C)OC(=O)/C=C\c1ccc([N+](=O)[O-])cc1 ZINC000728868506 947829856 /nfs/dbraw/zinc/82/98/56/947829856.db2.gz VETDRHDZOUWJNZ-HMVFGEFZSA-N 0 0 368.389 3.795 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)OCC(=O)N[C@@H](c1ccccc1)C(C)C ZINC000725987724 947832073 /nfs/dbraw/zinc/83/20/73/947832073.db2.gz NVBLRRKEICRWRH-LJQANCHMSA-N 0 0 370.405 3.574 20 5 FHBDRN COc1cccc(Br)c1OC(=O)c1ccc([N+](=O)[O-])s1 ZINC000150823595 947851382 /nfs/dbraw/zinc/85/13/82/947851382.db2.gz SXMJTJKOFJJGRZ-UHFFFAOYSA-N 0 0 358.169 3.647 20 5 FHBDRN CCCCN(C)c1nnc(-c2cccc([N+](=O)[O-])c2)n1C[C@H]1CCCCO1 ZINC000549605306 947885153 /nfs/dbraw/zinc/88/51/53/947885153.db2.gz BWVDECIHNFZSDT-QGZVFWFLSA-N 0 0 373.457 3.659 20 5 FHBDRN O=[N+]([O-])c1cccc(Cl)c1N1CCn2c(nnc2-c2ccccc2)C1 ZINC000432313508 947902419 /nfs/dbraw/zinc/90/24/19/947902419.db2.gz RZPOQWDAOBKMAO-UHFFFAOYSA-N 0 0 355.785 3.527 20 5 FHBDRN CCc1nc([C@@H](C)NC(=O)C2(c3ccc([N+](=O)[O-])cc3)CCC2)cs1 ZINC001126261321 947909826 /nfs/dbraw/zinc/90/98/26/947909826.db2.gz VBDPPCNLTJKZRF-GFCCVEGCSA-N 0 0 359.451 3.913 20 5 FHBDRN CC(C)[C@H](C)NC(=O)C1CCN(c2ccnc3c2cccc3[N+](=O)[O-])CC1 ZINC000432314356 947928972 /nfs/dbraw/zinc/92/89/72/947928972.db2.gz NWWRODNSEOWLMP-AWEZNQCLSA-N 0 0 370.453 3.520 20 5 FHBDRN CCOC(=O)CC1CCN(c2ccc([N+](=O)[O-])c(-c3ccccc3)n2)CC1 ZINC000536391041 947957142 /nfs/dbraw/zinc/95/71/42/947957142.db2.gz QQJKIIBJDNZJQM-UHFFFAOYSA-N 0 0 369.421 3.826 20 5 FHBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)c1cccc([C@H]2CCOC2)c1 ZINC000536395378 947993270 /nfs/dbraw/zinc/99/32/70/947993270.db2.gz MKKMOEVDLLZAIE-IBGZPJMESA-N 0 0 368.433 3.851 20 5 FHBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)c1cccc([C@@H]2CCOC2)c1 ZINC000536395381 947993399 /nfs/dbraw/zinc/99/33/99/947993399.db2.gz MKKMOEVDLLZAIE-LJQANCHMSA-N 0 0 368.433 3.851 20 5 FHBDRN O=C(c1cccc([C@H]2CCOC2)c1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000536396931 947995515 /nfs/dbraw/zinc/99/55/15/947995515.db2.gz ZXOLXKHZGFEOAP-SFHVURJKSA-N 0 0 366.417 3.904 20 5 FHBDRN Cc1cc(C)c(CNC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)cn1 ZINC000459067170 948023635 /nfs/dbraw/zinc/02/36/35/948023635.db2.gz BGZCFVVIHOVXNC-UHFFFAOYSA-N 0 0 356.426 3.727 20 5 FHBDRN Cc1cccc(NC(=O)[C@H]2CCCN(c3c(Cl)cccc3[N+](=O)[O-])C2)n1 ZINC000432321503 948026691 /nfs/dbraw/zinc/02/66/91/948026691.db2.gz VEZPUAWDPVMFIW-ZDUSSCGKSA-N 0 0 374.828 3.807 20 5 FHBDRN CC(C)CO[C@@H](C)c1noc(COc2cc(Cl)ccc2[N+](=O)[O-])n1 ZINC000072920291 948040384 /nfs/dbraw/zinc/04/03/84/948040384.db2.gz MYXALTXUJCYGIX-JTQLQIEISA-N 0 0 355.778 3.944 20 5 FHBDRN COc1ccccc1N1CC[C@H](Nc2ccnc3c2cccc3[N+](=O)[O-])C1 ZINC000432326492 948070176 /nfs/dbraw/zinc/07/01/76/948070176.db2.gz PNNIAVKLDZEEAO-AWEZNQCLSA-N 0 0 364.405 3.842 20 5 FHBDRN O=C(CCCc1ccccc1)O[C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000759945508 948072898 /nfs/dbraw/zinc/07/28/98/948072898.db2.gz HCLMYNKRXXFIKS-SJORKVTESA-N 0 0 357.410 3.841 20 5 FHBDRN COc1cccc([C@H](C)C(=O)O[C@@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)c1 ZINC000759945230 948079076 /nfs/dbraw/zinc/07/90/76/948079076.db2.gz TWGXQXHORIYNEU-IAOVAPTHSA-N 0 0 373.409 3.631 20 5 FHBDRN C[C@@]1(CCNC(=O)c2cc([N+](=O)[O-])ccc2Cl)CC1(Cl)Cl ZINC000839416305 948088488 /nfs/dbraw/zinc/08/84/88/948088488.db2.gz VOLLRURDSSTYFP-GFCCVEGCSA-N 0 0 351.617 3.952 20 5 FHBDRN CCOc1ccc(C(=O)Oc2ccc3c(c2)OC(=O)C[C@H]3C)cc1[N+](=O)[O-] ZINC000785360489 948098919 /nfs/dbraw/zinc/09/89/19/948098919.db2.gz BOEPZKAQQKHGKY-LLVKDONJSA-N 0 0 371.345 3.625 20 5 FHBDRN O=C(N[C@H]1C[C@H]1Cc1ccccc1)C1(c2ccc([N+](=O)[O-])cc2)CCC1 ZINC001126288145 948101663 /nfs/dbraw/zinc/10/16/63/948101663.db2.gz AFGHADBHURVMEW-APWZRJJASA-N 0 0 350.418 3.764 20 5 FHBDRN O=C(N[C@@H]1C[C@H]1Cc1ccccc1)C1(c2ccc([N+](=O)[O-])cc2)CCC1 ZINC001126288148 948101826 /nfs/dbraw/zinc/10/18/26/948101826.db2.gz AFGHADBHURVMEW-VQIMIIECSA-N 0 0 350.418 3.764 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H](OC)c1ccccc1 ZINC000184668549 948124357 /nfs/dbraw/zinc/12/43/57/948124357.db2.gz YDATWMIHZJAQGP-VQIMIIECSA-N 0 0 356.422 3.667 20 5 FHBDRN Cc1ccc(CCC(=O)O[C@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)cc1 ZINC000759945966 948129755 /nfs/dbraw/zinc/12/97/55/948129755.db2.gz ULYTYCMJJYJALY-IRXDYDNUSA-N 0 0 357.410 3.759 20 5 FHBDRN O=C(CCCOc1ccccc1)O[C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000759947179 948131117 /nfs/dbraw/zinc/13/11/17/948131117.db2.gz WFBLBBBSTSEETE-SJORKVTESA-N 0 0 373.409 3.677 20 5 FHBDRN Cc1ccc(NCCCNC(=O)c2cc3c(o2)CCCC3)c([N+](=O)[O-])c1 ZINC001126293819 948155017 /nfs/dbraw/zinc/15/50/17/948155017.db2.gz JDHBIHFWHXXGMZ-UHFFFAOYSA-N 0 0 357.410 3.607 20 5 FHBDRN O=C(NC1CCC(F)(F)CC1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000536436628 948160395 /nfs/dbraw/zinc/16/03/95/948160395.db2.gz SQCQLVKYZWRJAF-UHFFFAOYSA-N 0 0 367.396 3.505 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@@H](C)Cn1ccc2ccccc21 ZINC000507771205 948162935 /nfs/dbraw/zinc/16/29/35/948162935.db2.gz ZGZMYCNVDYLUTI-AWEZNQCLSA-N 0 0 367.405 3.511 20 5 FHBDRN CCCCCC(=O)NC1CCN(c2ccnc3c2cccc3[N+](=O)[O-])CC1 ZINC000432339893 948163535 /nfs/dbraw/zinc/16/35/35/948163535.db2.gz KRFFSTQQYWXDGV-UHFFFAOYSA-N 0 0 370.453 3.808 20 5 FHBDRN CCn1c(SCC(=O)NC(C)(C)C)nc2cc3ccccc3cc2c1=O ZINC000022178058 948166848 /nfs/dbraw/zinc/16/68/48/948166848.db2.gz PQCYRLGNKODNAU-UHFFFAOYSA-N 0 0 369.490 3.576 20 5 FHBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)N[C@H]2CCCC[C@H]2c2ccccc2)cc1 ZINC000512008052 948175935 /nfs/dbraw/zinc/17/59/35/948175935.db2.gz LKRUSNMONNTTJS-OALUTQOASA-N 0 0 374.462 3.741 20 5 FHBDRN Cc1cn(-c2ccccc2)nc1NC(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000106537472 948198184 /nfs/dbraw/zinc/19/81/84/948198184.db2.gz QYECRQOPJVDXGD-CQSZACIVSA-N 0 0 365.393 3.972 20 5 FHBDRN COC(=O)c1cc(C)nc(N[C@H]2CCC[C@H](C(F)(F)F)C2)c1[N+](=O)[O-] ZINC000585702611 948209398 /nfs/dbraw/zinc/20/93/98/948209398.db2.gz SPBYYFBIKVDZAL-UWVGGRQHSA-N 0 0 361.320 3.618 20 5 FHBDRN CC(C)COc1ccc(C(=O)OCC(=O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000785367355 948212918 /nfs/dbraw/zinc/21/29/18/948212918.db2.gz JXMSWDHBZUOUGR-UHFFFAOYSA-N 0 0 357.362 3.669 20 5 FHBDRN CC(C)(CC(=O)NCc1ccccc1[N+](=O)[O-])CC(=O)c1ccccc1 ZINC000441545934 948241478 /nfs/dbraw/zinc/24/14/78/948241478.db2.gz MJYAFVVGCQGPRB-UHFFFAOYSA-N 0 0 354.406 3.900 20 5 FHBDRN Cc1cc(C(=O)N2CCCC2)ccc1NCc1ccc([N+](=O)[O-])cc1F ZINC000585731655 948242438 /nfs/dbraw/zinc/24/24/38/948242438.db2.gz UXQVRZZCNDVOLQ-UHFFFAOYSA-N 0 0 357.385 3.890 20 5 FHBDRN Cc1ccncc1NC(=O)c1ccc(N2CCC[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000520546773 948263711 /nfs/dbraw/zinc/26/37/11/948263711.db2.gz ZHECNHNQTXMVMA-CYBMUJFWSA-N 0 0 354.410 3.787 20 5 FHBDRN O=C(O[C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1)c1cccc2cc[nH]c21 ZINC000759954176 948270418 /nfs/dbraw/zinc/27/04/18/948270418.db2.gz YEUMGMYRGIHLSO-CABCVRRESA-N 0 0 354.366 3.613 20 5 FHBDRN O=C(O[C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)c1cccc2cc[nH]c21 ZINC000759954182 948270546 /nfs/dbraw/zinc/27/05/46/948270546.db2.gz YEUMGMYRGIHLSO-LSDHHAIUSA-N 0 0 354.366 3.613 20 5 FHBDRN C[C@H](NCCOc1ccccc1[N+](=O)[O-])c1nc(C(F)(F)F)cs1 ZINC000278940093 948311549 /nfs/dbraw/zinc/31/15/49/948311549.db2.gz NJFNXKOIKMWQCH-VIFPVBQESA-N 0 0 361.345 3.800 20 5 FHBDRN CCc1nocc1CN(C)C(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000512052635 948315024 /nfs/dbraw/zinc/31/50/24/948315024.db2.gz AYAWSIFOIUPPEG-UHFFFAOYSA-N 0 0 361.401 3.504 20 5 FHBDRN O=[N+]([O-])c1cccc([C@H](O)CSc2nc(-c3ccc(F)cc3)c[nH]2)c1 ZINC000136854304 948319865 /nfs/dbraw/zinc/31/98/65/948319865.db2.gz GIRKYXDDEJYORH-MRXNPFEDSA-N 0 0 359.382 3.950 20 5 FHBDRN Cc1nn(C)c(C(=O)N(CC(C)C)[C@H](C)c2ccccc2C)c1[N+](=O)[O-] ZINC000585810411 948338626 /nfs/dbraw/zinc/33/86/26/948338626.db2.gz SVKMPLCVYLOIIX-OAHLLOKOSA-N 0 0 358.442 3.805 20 5 FHBDRN CSc1ccc(C(=O)Oc2ccc3ccc(=O)oc3c2)cc1[N+](=O)[O-] ZINC000006236424 948346697 /nfs/dbraw/zinc/34/66/97/948346697.db2.gz GRGMREMAWGQNNJ-UHFFFAOYSA-N 0 0 357.343 3.642 20 5 FHBDRN CC1(C)C[C@H](Nc2ccc(CS(C)(=O)=O)cc2)c2cc([N+](=O)[O-])ccc21 ZINC000278971877 948354258 /nfs/dbraw/zinc/35/42/58/948354258.db2.gz CFCVCKUVGHOJNY-SFHVURJKSA-N 0 0 374.462 3.974 20 5 FHBDRN Cc1noc([C@H](C)N(C)C(=O)Nc2ccc(C(C)(C)C)c([N+](=O)[O-])c2)n1 ZINC000520603975 948378770 /nfs/dbraw/zinc/37/87/70/948378770.db2.gz HYIUTMZDLRRVEF-JTQLQIEISA-N 0 0 361.402 3.809 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccc2nn(C(C)C)cc2c1 ZINC000427601411 948379340 /nfs/dbraw/zinc/37/93/40/948379340.db2.gz YXWKMTMBGUHEOO-UHFFFAOYSA-N 0 0 354.366 3.786 20 5 FHBDRN COC(=O)c1ccc(NCc2cc([N+](=O)[O-])ccc2OC(F)F)cc1 ZINC000432421703 948381664 /nfs/dbraw/zinc/38/16/64/948381664.db2.gz AWIDFIKYJPZYPS-UHFFFAOYSA-N 0 0 352.293 3.595 20 5 FHBDRN C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)Cc1cccc(OC(F)F)c1 ZINC000107109689 948394234 /nfs/dbraw/zinc/39/42/34/948394234.db2.gz MCLLPGCFQKZQAW-LLVKDONJSA-N 0 0 362.332 3.717 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)Cc1cccc(OC(F)F)c1 ZINC000107092148 948396758 /nfs/dbraw/zinc/39/67/58/948396758.db2.gz JDOQWJDWPPKTGY-UHFFFAOYSA-N 0 0 350.321 3.994 20 5 FHBDRN CCn1nc(NC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])cc1C1CC1 ZINC000279054649 948443146 /nfs/dbraw/zinc/44/31/46/948443146.db2.gz BMAXLJZAJVMTSY-UHFFFAOYSA-N 0 0 366.780 3.662 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H]1CCCc2ccc(F)cc21 ZINC000432448312 948445799 /nfs/dbraw/zinc/44/57/99/948445799.db2.gz SHSVYQGOCPRQOJ-OAHLLOKOSA-N 0 0 359.357 3.942 20 5 FHBDRN CCOc1cc2c(cc1NCc1cc([N+](=O)[O-])ccc1OC)O[C@@H](C)C2 ZINC000520625681 948448877 /nfs/dbraw/zinc/44/88/77/948448877.db2.gz WSJWQRSZFHHCHS-LBPRGKRZSA-N 0 0 358.394 3.938 20 5 FHBDRN Cc1cc(N2CC(C)(C)O[C@]3(CCCOC3)C2)c2cccc([N+](=O)[O-])c2n1 ZINC000408337239 948480398 /nfs/dbraw/zinc/48/03/98/948480398.db2.gz FLKOCZHCRFVION-HXUWFJFHSA-N 0 0 371.437 3.616 20 5 FHBDRN Cc1cc(C(=O)Nc2ncc(-c3ccccc3)s2)c(N)c([N+](=O)[O-])c1 ZINC000729519979 948486478 /nfs/dbraw/zinc/48/64/78/948486478.db2.gz MHYQFHAFPOQUQZ-UHFFFAOYSA-N 0 0 354.391 3.861 20 5 FHBDRN Cc1cc(C(=O)O[C@@H](C)C(=O)c2ccc3c(c2)CCC3)ccc1[N+](=O)[O-] ZINC000005634981 948537067 /nfs/dbraw/zinc/53/70/67/948537067.db2.gz LESWNSZFTNLFCJ-ZDUSSCGKSA-N 0 0 353.374 3.820 20 5 FHBDRN CC(C)[C@H](CC(F)(F)F)NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000438619941 948562514 /nfs/dbraw/zinc/56/25/14/948562514.db2.gz OOQICLUOXAADOT-VIFPVBQESA-N 0 0 370.274 3.903 20 5 FHBDRN Cc1cc(C)cc(C[C@@H](C)NC(=O)COc2ccc([N+](=O)[O-])c(C)c2)c1 ZINC001126516498 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Cc1ccc(CCNC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000523954353 948732142 /nfs/dbraw/zinc/73/21/42/948732142.db2.gz ZUBZBHZAFVISBZ-UHFFFAOYSA-N 0 0 362.813 3.684 20 5 FHBDRN CC(C)CC(=O)Nc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2F)cc1 ZINC000054570676 948735815 /nfs/dbraw/zinc/73/58/15/948735815.db2.gz BCDCQZFZDCFOGH-UHFFFAOYSA-N 0 0 359.357 3.971 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[C@@H](C)[C@@H]1c1cccc(F)c1 ZINC000427632818 948746304 /nfs/dbraw/zinc/74/63/04/948746304.db2.gz GEKXHARAHGXCPN-KZULUSFZSA-N 0 0 358.369 3.966 20 5 FHBDRN CN(Cc1nc(Cc2ccc3c(c2)CCC3)no1)c1ccccc1[N+](=O)[O-] ZINC000445384035 948753578 /nfs/dbraw/zinc/75/35/78/948753578.db2.gz KHEZPICWJAYEBL-UHFFFAOYSA-N 0 0 364.405 3.694 20 5 FHBDRN CCOc1cccc(N2CC[C@@H](n3ncc4ccccc43)C2)c1[N+](=O)[O-] ZINC000546582019 948754698 /nfs/dbraw/zinc/75/46/98/948754698.db2.gz LZJGCWROPCOTBO-OAHLLOKOSA-N 0 0 352.394 3.795 20 5 FHBDRN COc1cc(-c2noc(-c3c[nH]c4cc([N+](=O)[O-])ccc43)n2)ccc1F ZINC000546415199 948773410 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FHBDRN CN(CC(=O)Nc1ccc(Cl)c(Cl)c1)c1ccccc1[N+](=O)[O-] ZINC000008051587 203820620 /nfs/dbraw/zinc/82/06/20/203820620.db2.gz GKBCCIIKZYCZGE-UHFFFAOYSA-N 0 0 354.193 3.977 20 5 FHBDRN Cc1nc(-c2cccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)c2)no1 ZINC000064823470 203904179 /nfs/dbraw/zinc/90/41/79/203904179.db2.gz ZJVQXLIZZHBPRX-UHFFFAOYSA-N 0 0 358.741 3.859 20 5 FHBDRN Cc1cccc(C(=O)NCCc2ccc(C(F)(F)F)cc2)c1[N+](=O)[O-] ZINC000017918641 204657209 /nfs/dbraw/zinc/65/72/09/204657209.db2.gz HPTRZGFQGIOZDN-UHFFFAOYSA-N 0 0 352.312 3.895 20 5 FHBDRN COc1cc(C(=O)N(C)Cc2ccc(Cl)cc2)c([N+](=O)[O-])cc1OC ZINC000029005281 204892583 /nfs/dbraw/zinc/89/25/83/204892583.db2.gz WVYPBQWYJWRHGY-UHFFFAOYSA-N 0 0 364.785 3.538 20 5 FHBDRN CC(C)[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1F)c1ccc2c(c1)OCCO2 ZINC000054513869 205200877 /nfs/dbraw/zinc/20/08/77/205200877.db2.gz GTYBYNIZIVNJNV-SFHVURJKSA-N 0 0 374.368 3.632 20 5 FHBDRN C[C@H](CCc1ccc(Br)cc1)NC(=O)c1ccc([N+](=O)[O-])o1 ZINC000053221662 205191708 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354.406 3.973 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)Nc1nc(-c2ccccc2F)cs1 ZINC000072007146 205460966 /nfs/dbraw/zinc/46/09/66/205460966.db2.gz RCQYTYXBZFIYLO-UHFFFAOYSA-N 0 0 373.365 3.875 20 5 FHBDRN O=C(Nc1cc([N+](=O)[O-])ccc1F)c1cc(Cl)c2c(c1)OCCCO2 ZINC000104906247 206003640 /nfs/dbraw/zinc/00/36/40/206003640.db2.gz LZWOBPIYZQYCTL-UHFFFAOYSA-N 0 0 366.732 3.801 20 5 FHBDRN O=C(Nc1ccc(F)c(Cl)c1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000107755850 206023919 /nfs/dbraw/zinc/02/39/19/206023919.db2.gz VNXMTCAGOYQAMM-UHFFFAOYSA-N 0 0 360.732 3.825 20 5 FHBDRN CN(Cc1cc(Cl)cc(Cl)c1)c1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000108092179 206027907 /nfs/dbraw/zinc/02/79/07/206027907.db2.gz QVSYLXQVIGARSD-UHFFFAOYSA-N 0 0 354.193 3.637 20 5 FHBDRN COc1ccc(S[C@H](C)C(=O)N2CCc3cc([N+](=O)[O-])ccc32)cc1 ZINC000108258901 206029301 /nfs/dbraw/zinc/02/93/01/206029301.db2.gz FJNJRYMYDGGVFL-GFCCVEGCSA-N 0 0 358.419 3.673 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@H](C)c1ccc(Cl)cc1Cl ZINC000109188917 206048778 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O=[N+]([O-])c1cc(Br)ccc1N1CCO[C@H](c2ccccc2)C1 ZINC000097286503 132228245 /nfs/dbraw/zinc/22/82/45/132228245.db2.gz VBSCQEAXRIPROL-INIZCTEOSA-N 0 0 363.211 3.935 20 5 FHBDRN CC(C)[C@H](C)NC(=O)C1CCN(c2ccc([N+](=O)[O-])c3cccnc32)CC1 ZINC000109806981 132374396 /nfs/dbraw/zinc/37/43/96/132374396.db2.gz VHYPBFGYFNLAEI-AWEZNQCLSA-N 0 0 370.453 3.520 20 5 FHBDRN O=C(Nc1ccc2c(c1)CCCC2)c1cc([N+](=O)[O-])ccc1SCCO ZINC000452862815 567828801 /nfs/dbraw/zinc/82/88/01/567828801.db2.gz LCBAGFUOPOEBKN-UHFFFAOYSA-N 0 0 372.446 3.810 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1F)N1CCC[C@H](Nc2ccccc2)C1 ZINC000541785212 567830708 /nfs/dbraw/zinc/83/07/08/567830708.db2.gz IVFBPKFWJUBLQP-AWEZNQCLSA-N 0 0 358.373 3.842 20 5 FHBDRN Cc1cnc(CCCC(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)o1 ZINC000452868302 567833453 /nfs/dbraw/zinc/83/34/53/567833453.db2.gz PPXPIDRJWPTKNM-INIZCTEOSA-N 0 0 357.410 3.620 20 5 FHBDRN COc1cccc(F)c1C(=O)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452865294 567833789 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368.433 3.906 20 5 FHBDRN O=c1c(Cl)c(Cl)cnn1Cc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000159173335 567838279 /nfs/dbraw/zinc/83/82/79/567838279.db2.gz MQYIUZLWYCOTMZ-UHFFFAOYSA-N 0 0 368.098 3.525 20 5 FHBDRN CCO[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)C[C@H]1C ZINC000452865676 567838504 /nfs/dbraw/zinc/83/85/04/567838504.db2.gz NWIDLOLRADQNAQ-YGRLFVJLSA-N 0 0 360.332 3.501 20 5 FHBDRN COc1ccc(Cl)c(NS(=O)(=O)c2cc(C)cc([N+](=O)[O-])c2C)c1 ZINC000541799899 567857172 /nfs/dbraw/zinc/85/71/72/567857172.db2.gz PFKVPGRRYGEESJ-UHFFFAOYSA-N 0 0 370.814 3.674 20 5 FHBDRN CC(C)Oc1ccc(C(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cn1 ZINC000452874632 567875840 /nfs/dbraw/zinc/87/58/40/567875840.db2.gz KMSUZCVPGNODIN-KRWDZBQOSA-N 0 0 369.421 3.797 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)Nc2cccc(SC)n2)cc1SC ZINC000568096908 567879435 /nfs/dbraw/zinc/87/94/35/567879435.db2.gz GXJLLFHRQSNPKA-UHFFFAOYSA-N 0 0 365.436 3.695 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCO[C@@H](c3ccc(C(F)(F)F)cc3)C2)cn1 ZINC000568100595 567881672 /nfs/dbraw/zinc/88/16/72/567881672.db2.gz UEYZZEWDKMNIRH-CQSZACIVSA-N 0 0 353.300 3.587 20 5 FHBDRN O=C(Nc1nc(Cc2ccccc2)ns1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000120352150 567891455 /nfs/dbraw/zinc/89/14/55/567891455.db2.gz FAJPZSMFCMZFKO-UHFFFAOYSA-N 0 0 374.809 3.943 20 5 FHBDRN CCCN1CCN(C(=O)c2cc([N+](=O)[O-])c(C)s2)c2ccc(F)cc21 ZINC000481394973 567892147 /nfs/dbraw/zinc/89/21/47/567892147.db2.gz YMIOORAHKBHSFC-UHFFFAOYSA-N 0 0 363.414 3.981 20 5 FHBDRN O=C(c1ccc(Cl)cc1O)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452890753 567903814 /nfs/dbraw/zinc/90/38/14/567903814.db2.gz VAKXGPOTAZJQRG-CYBMUJFWSA-N 0 0 360.797 3.974 20 5 FHBDRN Cc1ccccc1[C@@H](C)N(C)S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000517909792 567908076 /nfs/dbraw/zinc/90/80/76/567908076.db2.gz OKHXAXUQGQXNMK-GFCCVEGCSA-N 0 0 368.842 3.938 20 5 FHBDRN COC(=O)c1ccc([C@H](NCc2ccc([N+](=O)[O-])cc2)C(F)(F)F)cc1 ZINC000481419998 567909328 /nfs/dbraw/zinc/90/93/28/567909328.db2.gz XGZUUTKFEXWPJQ-HNNXBMFYSA-N 0 0 368.311 3.775 20 5 FHBDRN CO[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)C[C@H]1C ZINC000452895959 567909718 /nfs/dbraw/zinc/90/97/18/567909718.db2.gz SZOBMZNMZUZMNB-RDTXWAMCSA-N 0 0 370.405 3.884 20 5 FHBDRN CC[C@H](Oc1ccccc1F)C(=O)N1CCCc2ccc([N+](=O)[O-])cc21 ZINC000481438330 567934552 /nfs/dbraw/zinc/93/45/52/567934552.db2.gz QWVFUWPFJPWEAR-KRWDZBQOSA-N 0 0 358.369 3.871 20 5 FHBDRN Cc1ccc(-c2nc(Cc3nc(CCC(C)(C)[N+](=O)[O-])no3)cs2)o1 ZINC000291007911 567957236 /nfs/dbraw/zinc/95/72/36/567957236.db2.gz ANNRQDQLXYFLCR-UHFFFAOYSA-N 0 0 362.411 3.673 20 5 FHBDRN COc1ccc(S[C@@H](C)C(=O)NCc2cccc([N+](=O)[O-])c2C)cc1 ZINC000481464163 567963740 /nfs/dbraw/zinc/96/37/40/567963740.db2.gz HVRPSZTYQYTKSI-ZDUSSCGKSA-N 0 0 360.435 3.709 20 5 FHBDRN Cc1c(CNC(=O)Cc2coc3cc4c(cc23)CCC4)cccc1[N+](=O)[O-] ZINC000481465598 567964784 /nfs/dbraw/zinc/96/47/84/567964784.db2.gz KKPTUHXLPXSXOH-UHFFFAOYSA-N 0 0 364.401 3.997 20 5 FHBDRN CCOc1ccc(C(=O)CCC(=O)NCc2cccc([N+](=O)[O-])c2C)cc1 ZINC000481465045 567965596 /nfs/dbraw/zinc/96/55/96/567965596.db2.gz JKNNTGPKXFPNFV-UHFFFAOYSA-N 0 0 370.405 3.581 20 5 FHBDRN Cc1nn(CC(C)C)c(C)c1CCC(=O)NCc1cccc([N+](=O)[O-])c1C ZINC000481467930 567967431 /nfs/dbraw/zinc/96/74/31/567967431.db2.gz UGZNGYDAXXTUGX-UHFFFAOYSA-N 0 0 372.469 3.622 20 5 FHBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@H]2C[C@H](c3ccc(Cl)cc3)C2)s1 ZINC000481465216 567967696 /nfs/dbraw/zinc/96/76/96/567967696.db2.gz NLUPJTWUJGUBEP-UMSPYCQHSA-N 0 0 372.855 3.534 20 5 FHBDRN CCn1cc(CC(=O)NCc2cccc([N+](=O)[O-])c2C)c2ccccc21 ZINC000481470985 567967823 /nfs/dbraw/zinc/96/78/23/567967823.db2.gz ZQQRQGUZQPIOKA-UHFFFAOYSA-N 0 0 351.406 3.737 20 5 FHBDRN Cc1c(CNC(=O)[C@@H](C)Oc2ccc(F)cc2Cl)cccc1[N+](=O)[O-] ZINC000481465434 567970182 /nfs/dbraw/zinc/97/01/82/567970182.db2.gz JYFUXTQZYVLILF-LLVKDONJSA-N 0 0 366.776 3.779 20 5 FHBDRN Cc1c(CNC(=O)COc2cccc3ccccc32)cccc1[N+](=O)[O-] ZINC000481468331 567970329 /nfs/dbraw/zinc/97/03/29/567970329.db2.gz SMFOJGIQVFJOCO-UHFFFAOYSA-N 0 0 350.374 3.752 20 5 FHBDRN Cc1c(CNC(=O)CSc2nccc3ccccc32)cccc1[N+](=O)[O-] ZINC000481469836 567970397 /nfs/dbraw/zinc/97/03/97/567970397.db2.gz VMYFZBZWYJYGQF-UHFFFAOYSA-N 0 0 367.430 3.860 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1ccccc1Nc1ccccc1 ZINC000128553950 567972492 /nfs/dbraw/zinc/97/24/92/567972492.db2.gz JSGIWVCFDMVHQX-UHFFFAOYSA-N 0 0 365.393 3.872 20 5 FHBDRN Cc1oc(-c2cccs2)nc1CC(=O)NCc1cccc([N+](=O)[O-])c1C ZINC000481476437 567974241 /nfs/dbraw/zinc/97/42/41/567974241.db2.gz FZJCFWNIMNSEQI-UHFFFAOYSA-N 0 0 371.418 3.787 20 5 FHBDRN COc1ccc([C@@H](NC(=O)c2cccc(SC)c2[N+](=O)[O-])C2CC2)cn1 ZINC000602413733 567977966 /nfs/dbraw/zinc/97/79/66/567977966.db2.gz NSUHEKDQYCUKAR-INIZCTEOSA-N 0 0 373.434 3.601 20 5 FHBDRN COc1ccc([C@@H](NC(=O)c2cc(SC)ccc2[N+](=O)[O-])C2CC2)cn1 ZINC000602418127 567978427 /nfs/dbraw/zinc/97/84/27/567978427.db2.gz VXVXIAALXALPEY-KRWDZBQOSA-N 0 0 373.434 3.601 20 5 FHBDRN Cc1c(CNC(=O)c2ccc(-c3ccccc3)[nH]c2=O)cccc1[N+](=O)[O-] ZINC000481480424 567980839 /nfs/dbraw/zinc/98/08/39/567980839.db2.gz MXAWKFUDBSTZRE-UHFFFAOYSA-N 0 0 363.373 3.601 20 5 FHBDRN Cc1ccc(-c2cnc(CCc3nc(CCC(C)(C)[N+](=O)[O-])no3)o2)cc1 ZINC000291034855 567983264 /nfs/dbraw/zinc/98/32/64/567983264.db2.gz FOBYDRCMMHAIDS-UHFFFAOYSA-N 0 0 370.409 3.806 20 5 FHBDRN O=[N+]([O-])c1ccc2oc(CNc3ccccc3O[C@@H]3CCOC3)nc2c1 ZINC000602492096 567986267 /nfs/dbraw/zinc/98/62/67/567986267.db2.gz MJABTHCDJPNOBO-CYBMUJFWSA-N 0 0 355.350 3.516 20 5 FHBDRN Cc1c(CNC(=O)c2cnc(Cc3ccccc3)s2)cccc1[N+](=O)[O-] ZINC000481485666 567987636 /nfs/dbraw/zinc/98/76/36/567987636.db2.gz ZYBKSABSYYXFBZ-UHFFFAOYSA-N 0 0 367.430 3.881 20 5 FHBDRN CCOc1c(Cl)cccc1CC(=O)NCc1cccc([N+](=O)[O-])c1C ZINC000481502950 567998218 /nfs/dbraw/zinc/99/82/18/567998218.db2.gz RGCRBLQNNDCGRG-UHFFFAOYSA-N 0 0 362.813 3.814 20 5 FHBDRN CC(=O)c1cccc(OCCCC(=O)NCc2cccc([N+](=O)[O-])c2C)c1 ZINC000481494118 568005842 /nfs/dbraw/zinc/00/58/42/568005842.db2.gz QXCPPKQTRAJWLL-UHFFFAOYSA-N 0 0 370.405 3.581 20 5 FHBDRN O=[N+]([O-])c1ccc(NCCNc2nnc(Cc3ccc(F)cc3)s2)cc1 ZINC000302098390 568006071 /nfs/dbraw/zinc/00/60/71/568006071.db2.gz KDEXBHFGXXIPMI-UHFFFAOYSA-N 0 0 373.413 3.700 20 5 FHBDRN CCOc1ccccc1C(F)(F)c1nc(CCC(C)(C)[N+](=O)[O-])no1 ZINC000291078167 568011856 /nfs/dbraw/zinc/01/18/56/568011856.db2.gz NAZKIDAGKOEQRP-UHFFFAOYSA-N 0 0 355.341 3.596 20 5 FHBDRN COc1cc(-c2nc(-c3ccc4cnn(C)c4c3)no2)cc([N+](=O)[O-])c1C ZINC000568325614 568024764 /nfs/dbraw/zinc/02/47/64/568024764.db2.gz MVIOJILPCVWKQM-UHFFFAOYSA-N 0 0 365.349 3.516 20 5 FHBDRN O=C(N[C@@H]1CCC[C@H](c2nc3ccccc3[nH]2)C1)c1ccc([N+](=O)[O-])s1 ZINC000568394158 568030405 /nfs/dbraw/zinc/03/04/05/568030405.db2.gz FYLSHQUQWOXSDF-NWDGAFQWSA-N 0 0 370.434 3.989 20 5 FHBDRN O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCCc2c(OC(F)F)cccc21 ZINC000568432478 568031550 /nfs/dbraw/zinc/03/15/50/568031550.db2.gz YIWTUAWMJXQBER-UHFFFAOYSA-N 0 0 366.295 3.928 20 5 FHBDRN Cc1c(CNC(=O)[C@@H]2C[C@@H]2c2cc(F)c(F)c(F)c2)cccc1[N+](=O)[O-] ZINC000481504433 568032424 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O=C(COc1ccc(Cl)cc1[N+](=O)[O-])Nc1ccccc1OC(F)F ZINC000024721025 568048923 /nfs/dbraw/zinc/04/89/23/568048923.db2.gz KZQUOBCHXAZYAH-UHFFFAOYSA-N 0 0 372.711 3.867 20 5 FHBDRN C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)N3CCC[C@H]3CF)cc2[N+](=O)[O-])C1 ZINC000568552312 568050489 /nfs/dbraw/zinc/05/04/89/568050489.db2.gz VSWGQBDZTCWFGA-FMKPAKJESA-N 0 0 363.433 3.651 20 5 FHBDRN COc1cccc2c1[C@H](C(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1)CC2 ZINC000481548937 568050697 /nfs/dbraw/zinc/05/06/97/568050697.db2.gz YWINMPVVZAQRPX-GOSISDBHSA-N 0 0 366.417 3.824 20 5 FHBDRN COC(=O)c1cc(NC(=O)c2ccc(F)cc2[N+](=O)[O-])cc(Cl)c1F ZINC000481613007 568065301 /nfs/dbraw/zinc/06/53/01/568065301.db2.gz STFQJUDZFJZKRY-UHFFFAOYSA-N 0 0 370.695 3.565 20 5 FHBDRN O=C(Nc1cn[nH]c1)c1cc([N+](=O)[O-])ccc1NCc1ccccc1Cl ZINC000481630767 568067951 /nfs/dbraw/zinc/06/79/51/568067951.db2.gz WPUKXGNCOXJSTA-UHFFFAOYSA-N 0 0 371.784 3.836 20 5 FHBDRN O=C(NC[C@@H]1CCC2(CCCCC2)O1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000481628595 568071783 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358.360 3.993 20 5 FHBDRN CC(C)CO[C@H](C)c1noc(CNc2ccc(Cl)c([N+](=O)[O-])c2)n1 ZINC000072910954 568109620 /nfs/dbraw/zinc/10/96/20/568109620.db2.gz BCDQOYFUIPZFAF-SNVBAGLBSA-N 0 0 354.794 3.977 20 5 FHBDRN Cn1ccnc1[C@H](N[C@H]1C[C@@H]1Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000568660949 568113096 /nfs/dbraw/zinc/11/30/96/568113096.db2.gz ZALFKGOGCOWKCQ-YSIASYRMSA-N 0 0 362.433 3.639 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)N[C@@H]1C[C@H]1c1ccc(Cl)cc1 ZINC000568666612 568115227 /nfs/dbraw/zinc/11/52/27/568115227.db2.gz VRCKFQBMAQJPMF-DLBZAZTESA-N 0 0 373.840 3.988 20 5 FHBDRN CC[C@]1(CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])OCCc2ccccc21 ZINC000291380296 568128367 /nfs/dbraw/zinc/12/83/67/568128367.db2.gz CEMSWTJUMOXSTC-LJQANCHMSA-N 0 0 374.824 3.856 20 5 FHBDRN COCC1(CNC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)CCCCC1 ZINC000568701812 568129459 /nfs/dbraw/zinc/12/94/59/568129459.db2.gz OQOKZOFDNLOAHQ-AWEZNQCLSA-N 0 0 366.483 3.789 20 5 FHBDRN CN(C(=O)CCOc1ccccc1[N+](=O)[O-])c1cccc2ncccc21 ZINC000128669150 568134476 /nfs/dbraw/zinc/13/44/76/568134476.db2.gz AOCLEJNYRMDBCG-UHFFFAOYSA-N 0 0 351.362 3.575 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2ncccc2CCCCOC)c1 ZINC000291411335 568136169 /nfs/dbraw/zinc/13/61/69/568136169.db2.gz GMUJCJNNOBMGQN-UHFFFAOYSA-N 0 0 373.409 3.610 20 5 FHBDRN COc1cc(C(=O)N(C)c2cccc([N+](=O)[O-])c2)sc1Br ZINC000128684969 568139852 /nfs/dbraw/zinc/13/98/52/568139852.db2.gz KNLJOGXQZAPQAS-UHFFFAOYSA-N 0 0 371.212 3.704 20 5 FHBDRN Cn1nc([N+](=O)[O-])cc1C(=O)N[C@H](c1ccc(Cl)cc1)C1CCCC1 ZINC000481883898 568146492 /nfs/dbraw/zinc/14/64/92/568146492.db2.gz SYKSGVYQHBBAKO-INIZCTEOSA-N 0 0 362.817 3.643 20 5 FHBDRN CCOC(=O)c1ccnc(Oc2ccc(C(=O)CC)cc2F)c1[N+](=O)[O-] ZINC000481834742 568147937 /nfs/dbraw/zinc/14/79/37/568147937.db2.gz CRIFWFJXNSTVMT-UHFFFAOYSA-N 0 0 362.313 3.691 20 5 FHBDRN Cc1nn(C)c(C(=O)N(C)[C@@H](C)c2ccc(Cl)cc2Cl)c1[N+](=O)[O-] ZINC000128678439 568153383 /nfs/dbraw/zinc/15/33/83/568153383.db2.gz DJYKOOBMEQQJOW-VIFPVBQESA-N 0 0 371.224 3.777 20 5 FHBDRN COc1ccc(NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1OC ZINC000463247124 568155603 /nfs/dbraw/zinc/15/56/03/568155603.db2.gz GTSGFLXBENLUSG-UHFFFAOYSA-N 0 0 370.283 3.883 20 5 FHBDRN Cc1cc(C)c(S(=O)(=O)Nc2ccc(C)c3ncccc23)cc1[N+](=O)[O-] ZINC000481850396 568159454 /nfs/dbraw/zinc/15/94/54/568159454.db2.gz WYOUWPHBNCGEBD-UHFFFAOYSA-N 0 0 371.418 3.869 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)NC[C@@H]1CCC2(CCCCC2)O1 ZINC000481869382 568163294 /nfs/dbraw/zinc/16/32/94/568163294.db2.gz ORKYXJBIYUFGFG-HNNXBMFYSA-N 0 0 366.845 3.789 20 5 FHBDRN C[C@@H]1CCCN(c2ccc(C(=O)N3C[C@@H]4CCC[C@H]4C3)cc2[N+](=O)[O-])C1 ZINC000408248891 568187005 /nfs/dbraw/zinc/18/70/05/568187005.db2.gz LKRDITODLZXZKR-PVAVHDDUSA-N 0 0 357.454 3.703 20 5 FHBDRN COc1c(C)ccc(NS(=O)(=O)c2c(C)cc([N+](=O)[O-])cc2C)c1C ZINC000481958948 568196909 /nfs/dbraw/zinc/19/69/09/568196909.db2.gz VADUKSBJFFXBNM-UHFFFAOYSA-N 0 0 364.423 3.638 20 5 FHBDRN O=C(N[C@@H](c1ccccc1)C(F)F)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000481959465 568196943 /nfs/dbraw/zinc/19/69/43/568196943.db2.gz GTTKYBOEPSADIH-INIZCTEOSA-N 0 0 372.331 3.517 20 5 FHBDRN Cc1cccc(N(C)C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)c1C ZINC000604011620 568198539 /nfs/dbraw/zinc/19/85/39/568198539.db2.gz OJPBFGZPNCLLHK-UHFFFAOYSA-N 0 0 350.378 3.674 20 5 FHBDRN CC(C)n1cc2c(n1)C[C@H](Nc1ccc([N+](=O)[O-])c3cnccc13)CC2 ZINC000481966197 568200379 /nfs/dbraw/zinc/20/03/79/568200379.db2.gz GRSLLCDBTWUHJD-CQSZACIVSA-N 0 0 351.410 3.890 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)[N-]c1ccc2ccn(C)c2c1 ZINC000481967697 568201617 /nfs/dbraw/zinc/20/16/17/568201617.db2.gz XSPVNEDKYGWUDX-UHFFFAOYSA-N 0 0 359.407 3.504 20 5 FHBDRN Cc1cc(N(C)Cc2ccc(F)cc2Br)ncc1[N+](=O)[O-] ZINC000302721909 568202877 /nfs/dbraw/zinc/20/28/77/568202877.db2.gz MNJHBZWZBMZACD-UHFFFAOYSA-N 0 0 354.179 3.836 20 5 FHBDRN CCCC(=O)NC[C@@H]1CCCN(c2cc(C)nc3c2cccc3[N+](=O)[O-])C1 ZINC000302035246 568205374 /nfs/dbraw/zinc/20/53/74/568205374.db2.gz UIXAGKAYWHCKAF-HNNXBMFYSA-N 0 0 370.453 3.584 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N(C)[C@@H](C)c1ccccc1F ZINC000481975491 568212784 /nfs/dbraw/zinc/21/27/84/568212784.db2.gz GNQKMGJJCRKJKI-ZDUSSCGKSA-N 0 0 366.414 3.732 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N[C@H](c1ccccc1)C(F)F ZINC000481984709 568215467 /nfs/dbraw/zinc/21/54/67/568215467.db2.gz NGZJALXJXYTDKB-OAHLLOKOSA-N 0 0 354.740 3.913 20 5 FHBDRN CCOc1ccc(NS(=O)(=O)c2c(C)cc([N+](=O)[O-])cc2C)c(C)c1 ZINC000481984550 568215480 /nfs/dbraw/zinc/21/54/80/568215480.db2.gz VIFFPUQNVALTIL-UHFFFAOYSA-N 0 0 364.423 3.720 20 5 FHBDRN COC1CCC(N(C)C(=O)c2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC1 ZINC000291604346 568226231 /nfs/dbraw/zinc/22/62/31/568226231.db2.gz ABEXYRHEFSLETH-UHFFFAOYSA-N 0 0 361.225 3.931 20 5 FHBDRN CCCCS(=O)(=O)Nc1ccc(Nc2nc(C)ccc2[N+](=O)[O-])cc1 ZINC000482013171 568226994 /nfs/dbraw/zinc/22/69/94/568226994.db2.gz XTCJDHRWPDKYEB-UHFFFAOYSA-N 0 0 364.427 3.584 20 5 FHBDRN CCNc1ccc(C(=O)NCc2ccc3ccccc3n2)cc1[N+](=O)[O-] ZINC000075909308 568227393 /nfs/dbraw/zinc/22/73/93/568227393.db2.gz HXJXAWRBLLKNKO-UHFFFAOYSA-N 0 0 350.378 3.505 20 5 FHBDRN Nc1c(C(=O)Nc2ccc(Oc3cccnc3)cc2)cc(F)cc1[N+](=O)[O-] ZINC000568810504 568229436 /nfs/dbraw/zinc/22/94/36/568229436.db2.gz QQTMBIWFEOHOFH-UHFFFAOYSA-N 0 0 368.324 3.756 20 5 FHBDRN O=C(N[C@@H]1CCO[C@H](C2CC2)C1)c1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000291631042 568232492 /nfs/dbraw/zinc/23/24/92/568232492.db2.gz FOSULOLKQUKVRX-MFKMUULPSA-N 0 0 359.209 3.589 20 5 FHBDRN O=C(N[C@H]1CCCOc2c(F)cccc21)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000482034285 568234944 /nfs/dbraw/zinc/23/49/44/568234944.db2.gz AKSMAZVRKYXSAG-INIZCTEOSA-N 0 0 369.352 3.859 20 5 FHBDRN C[C@@H](C(=O)N[C@@H](c1ccccc1)C(F)F)c1ccc([N+](=O)[O-])cc1F ZINC000482048377 568238609 /nfs/dbraw/zinc/23/86/09/568238609.db2.gz YHYFWUSKYXLXIF-BMIGLBTASA-N 0 0 352.312 3.960 20 5 FHBDRN CCS[C@H]1CCCC[C@H]1NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000541927812 568240083 /nfs/dbraw/zinc/24/00/83/568240083.db2.gz NONGCDKUKIPDFE-RISCZKNCSA-N 0 0 374.409 3.990 20 5 FHBDRN CC(C)[C@H]1C[C@H](NC(=O)c2cc(Cl)cc(Cl)c2[N+](=O)[O-])CCO1 ZINC000291650840 568241852 /nfs/dbraw/zinc/24/18/52/568241852.db2.gz GXQBBVUGDJQFSI-ZWNOBZJWSA-N 0 0 361.225 3.835 20 5 FHBDRN CC[NH+](CC)Cc1ccc(CNc2cc(C(=O)[O-])ccc2[N+](=O)[O-])cc1 ZINC000568887893 568248124 /nfs/dbraw/zinc/24/81/24/568248124.db2.gz PCQJPNWDRWWEJU-UHFFFAOYSA-N 0 0 357.410 3.747 20 5 FHBDRN CCc1ccccc1OCC(=O)N1CCS[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000568891254 568248511 /nfs/dbraw/zinc/24/85/11/568248511.db2.gz RFVZZMRNDSSMKX-IBGZPJMESA-N 0 0 372.446 3.810 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1C[C@@H](C)O[C@@H]1C ZINC000412659752 568250478 /nfs/dbraw/zinc/25/04/78/568250478.db2.gz SJGGVYHBRHMXFX-UPJWGTAASA-N 0 0 352.456 3.639 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1C[C@@H](C)O[C@H]1C ZINC000412659743 568250493 /nfs/dbraw/zinc/25/04/93/568250493.db2.gz SJGGVYHBRHMXFX-AGIUHOORSA-N 0 0 352.456 3.639 20 5 FHBDRN CCOc1ccc(C(=O)NCCc2c[nH]c3c2cccc3C)cc1[N+](=O)[O-] ZINC000128747732 568251864 /nfs/dbraw/zinc/25/18/64/568251864.db2.gz VSCAAQDONQLBIB-UHFFFAOYSA-N 0 0 367.405 3.756 20 5 FHBDRN CC(C)[C@H]1C[C@@H](CC(=O)Nc2ccnn2-c2ccc([N+](=O)[O-])cc2)CCO1 ZINC000541930236 568253197 /nfs/dbraw/zinc/25/31/97/568253197.db2.gz HJCOOXVFSCWLBP-WMLDXEAASA-N 0 0 372.425 3.560 20 5 FHBDRN CCOc1cc(C(=O)Nc2cc(F)cc(F)c2)c([N+](=O)[O-])cc1OC ZINC000016305754 568253765 /nfs/dbraw/zinc/25/37/65/568253765.db2.gz BLUKYGYVBVWDMU-UHFFFAOYSA-N 0 0 352.293 3.533 20 5 FHBDRN CC(=O)Nc1ccc(C)c(NC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)c1 ZINC000120388392 568256887 /nfs/dbraw/zinc/25/68/87/568256887.db2.gz WMYUWYHMMYFEPQ-UHFFFAOYSA-N 0 0 352.350 3.595 20 5 FHBDRN COc1ccc2c(c1)C[C@@H](C)N(C(=O)c1cc([N+](=O)[O-])ccc1OC)[C@H]2C ZINC000541934488 568258110 /nfs/dbraw/zinc/25/81/10/568258110.db2.gz QKLNIVINGMKFRU-OLZOCXBDSA-N 0 0 370.405 3.760 20 5 FHBDRN CCC(CC)[C@H]1C[C@H](NC(=O)N(C)Cc2ccccc2[N+](=O)[O-])CCO1 ZINC000181959920 568260872 /nfs/dbraw/zinc/26/08/72/568260872.db2.gz LGBOKBOSLPTKEI-SJLPKXTDSA-N 0 0 363.458 3.720 20 5 FHBDRN Cc1ccc(Cl)c(OC[C@@H](O)COc2c(C)cccc2[N+](=O)[O-])c1 ZINC000584688923 568261383 /nfs/dbraw/zinc/26/13/83/568261383.db2.gz PXSDFLNKSHMHNQ-CYBMUJFWSA-N 0 0 351.786 3.684 20 5 FHBDRN COc1c(C(=O)N[C@H]2CCCC[C@H]2CC(F)(F)F)cccc1[N+](=O)[O-] ZINC000453039884 568264947 /nfs/dbraw/zinc/26/49/47/568264947.db2.gz JDZJBVXSDFVVOO-JQWIXIFHSA-N 0 0 360.332 3.844 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)C1C[C@H]2CCC[C@@H](C1)C2=O ZINC000181956141 568267886 /nfs/dbraw/zinc/26/78/86/568267886.db2.gz IGJVRCSXZPLOQB-ZACCUICWSA-N 0 0 370.327 3.948 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CNc1ccc(Cl)cc1Cl ZINC000007972322 568269562 /nfs/dbraw/zinc/26/95/62/568269562.db2.gz FMAIYXOEYAWOCY-UHFFFAOYSA-N 0 0 370.192 3.961 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)c1coc(-c2ccccc2)n1 ZINC000569030823 568269877 /nfs/dbraw/zinc/26/98/77/568269877.db2.gz UVKOMBMHWPSCQU-UHFFFAOYSA-N 0 0 351.362 3.565 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)NC[C@H](C)Oc2ccccc2)cc1[N+](=O)[O-] ZINC000489615513 568272253 /nfs/dbraw/zinc/27/22/53/568272253.db2.gz FHJINYXHYHSUJX-LSDHHAIUSA-N 0 0 357.410 3.731 20 5 FHBDRN CN(CC(=O)Nc1ccc(OC(F)(F)F)cc1)c1ccccc1[N+](=O)[O-] ZINC000007979250 568273035 /nfs/dbraw/zinc/27/30/35/568273035.db2.gz XLKCXXUUVLNZQP-UHFFFAOYSA-N 0 0 369.299 3.568 20 5 FHBDRN C[C@@H](NC(=O)c1ccc(Cl)cc1[N+](=O)[O-])c1nccn1-c1ccccc1 ZINC000569027030 568275285 /nfs/dbraw/zinc/27/52/85/568275285.db2.gz HSRYURHJBRYEGU-GFCCVEGCSA-N 0 0 370.796 3.925 20 5 FHBDRN C[C@H](NC(=O)c1ccc(Cl)cc1[N+](=O)[O-])c1nccn1-c1ccccc1 ZINC000569027031 568275360 /nfs/dbraw/zinc/27/53/60/568275360.db2.gz HSRYURHJBRYEGU-LBPRGKRZSA-N 0 0 370.796 3.925 20 5 FHBDRN CC1(C)CN(C(=O)Nc2cc(F)cc([N+](=O)[O-])c2)CC2(CCCC2)O1 ZINC000408276578 568286313 /nfs/dbraw/zinc/28/63/13/568286313.db2.gz JKXOGPZPRSNOFQ-UHFFFAOYSA-N 0 0 351.378 3.689 20 5 FHBDRN CC1(C)CN(C(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])[C@@H]1[C@@H]1CCCO1 ZINC000291736510 568286737 /nfs/dbraw/zinc/28/67/37/568286737.db2.gz XGTMMHOYQHCTPS-UONOGXRCSA-N 0 0 372.343 3.643 20 5 FHBDRN COc1ccccc1[C@H](N[C@@H](C)c1ccc([N+](=O)[O-])cc1)c1nccn1C ZINC000128773984 568290825 /nfs/dbraw/zinc/29/08/25/568290825.db2.gz LOKSQTNPYKGELE-LIRRHRJNSA-N 0 0 366.421 3.777 20 5 FHBDRN Cc1c(CC(=O)Nc2nc(CC(F)(F)F)cs2)cccc1[N+](=O)[O-] ZINC000569147581 568294240 /nfs/dbraw/zinc/29/42/40/568294240.db2.gz PWPHWAHSCHLUBP-UHFFFAOYSA-N 0 0 359.329 3.646 20 5 FHBDRN CCN(C(=O)c1cc(OC)c(OC(F)F)cc1[N+](=O)[O-])[C@H](C)C(C)C ZINC000604470755 568294563 /nfs/dbraw/zinc/29/45/63/568294563.db2.gz LUTUUXWQPGTACM-SNVBAGLBSA-N 0 0 360.357 3.711 20 5 FHBDRN CN(Cc1ccc(Cl)cc1Cl)c1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000008051499 568295628 /nfs/dbraw/zinc/29/56/28/568295628.db2.gz NKZPTZJTLWBCJD-UHFFFAOYSA-N 0 0 354.193 3.637 20 5 FHBDRN Cc1ccc(OCCNC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)cc1 ZINC000008331958 568303222 /nfs/dbraw/zinc/30/32/22/568303222.db2.gz ZIKUOTLKJJMBAR-UHFFFAOYSA-N 0 0 356.403 3.927 20 5 FHBDRN COc1cc(OCc2nc(-c3ccc(Cl)cc3)no2)ccc1[N+](=O)[O-] ZINC000609473977 568309078 /nfs/dbraw/zinc/30/90/78/568309078.db2.gz MONCFLKIMXCQLP-UHFFFAOYSA-N 0 0 361.741 3.886 20 5 FHBDRN CCc1coc(NC(=O)c2ccc(N3C[C@H](C)C[C@@H](C)C3)c([N+](=O)[O-])c2)n1 ZINC000569234488 568317056 /nfs/dbraw/zinc/31/70/56/568317056.db2.gz ANUXYVTUTBXGID-CHWSQXEVSA-N 0 0 372.425 3.880 20 5 FHBDRN O=[N+]([O-])c1c[nH]c(-c2nc(-c3ccc(OCc4cccnc4)cc3)no2)c1 ZINC000609475707 568321977 /nfs/dbraw/zinc/32/19/77/568321977.db2.gz YHTHKMLRWJQXGH-UHFFFAOYSA-N 0 0 363.333 3.614 20 5 FHBDRN Cn1ccc(-c2noc(-c3csc(-c4ccc([N+](=O)[O-])cc4)n3)n2)c1 ZINC000569272753 568324609 /nfs/dbraw/zinc/32/46/09/568324609.db2.gz FSYLKRCYHIMRBW-UHFFFAOYSA-N 0 0 353.363 3.774 20 5 FHBDRN CCCn1nccc1NC(=O)c1ccc(N2CCC[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000031770422 568343079 /nfs/dbraw/zinc/34/30/79/568343079.db2.gz DLCJARMGAPKCAK-AWEZNQCLSA-N 0 0 371.441 3.690 20 5 FHBDRN CC(=O)Nc1ccccc1CNc1cc(C(F)(F)F)ncc1[N+](=O)[O-] ZINC000569302897 568351082 /nfs/dbraw/zinc/35/10/82/568351082.db2.gz NBAOEQFDCYPJJC-UHFFFAOYSA-N 0 0 354.288 3.579 20 5 FHBDRN COc1ccc(C2(C(=O)Nc3ccc(OC)c([N+](=O)[O-])c3)CCC2)cc1 ZINC000541995467 568377662 /nfs/dbraw/zinc/37/76/62/568377662.db2.gz TUFFKSPMMNJKHA-UHFFFAOYSA-N 0 0 356.378 3.672 20 5 FHBDRN COc1ccc(NC(=O)CCCc2cc(F)ccc2F)cc1[N+](=O)[O-] ZINC000541999962 568378140 /nfs/dbraw/zinc/37/81/40/568378140.db2.gz FPNOIMUJGODESF-UHFFFAOYSA-N 0 0 350.321 3.843 20 5 FHBDRN COc1ccc(NC(=O)c2cc(C)sc2Br)cc1[N+](=O)[O-] ZINC000541995458 568382735 /nfs/dbraw/zinc/38/27/35/568382735.db2.gz SNVNCMIDQJYZHM-UHFFFAOYSA-N 0 0 371.212 3.988 20 5 FHBDRN Cc1c(C(=O)N2CCN(Cc3cccc(Cl)c3)CC2)cccc1[N+](=O)[O-] ZINC000032484171 568393032 /nfs/dbraw/zinc/39/30/32/568393032.db2.gz LLSKXOLXXHHXAQ-UHFFFAOYSA-N 0 0 373.840 3.515 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2nnc(CSc3ncnc4sccc43)o2)cc1 ZINC000006115321 568395617 /nfs/dbraw/zinc/39/56/17/568395617.db2.gz CKSJEUDGFWUFPZ-UHFFFAOYSA-N 0 0 371.403 3.942 20 5 FHBDRN CC(C)(C(=O)NCC1(c2ccccn2)CCC1)c1ccccc1[N+](=O)[O-] ZINC000569373605 568396749 /nfs/dbraw/zinc/39/67/49/568396749.db2.gz NGKDZJKAUYVSIA-UHFFFAOYSA-N 0 0 353.422 3.506 20 5 FHBDRN CC(C)CCSc1ccc(C(=O)N[C@@H]2CCCC[C@H]2O)cc1[N+](=O)[O-] ZINC000482228679 568399684 /nfs/dbraw/zinc/39/96/84/568399684.db2.gz LLNFPRUGUSXWRO-GDBMZVCRSA-N 0 0 366.483 3.766 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(N2CCCC[C@@H]2c2nnc(C3CCC3)o2)n1 ZINC000569382301 568399945 /nfs/dbraw/zinc/39/99/45/568399945.db2.gz JDTIMAORVUIOTO-CQSZACIVSA-N 0 0 357.414 3.989 20 5 FHBDRN COc1ccc(C[C@H](C)Nc2ccc([N+](=O)[O-])c(C(C)=O)c2)cc1OC ZINC000569491971 568403349 /nfs/dbraw/zinc/40/33/49/568403349.db2.gz SQTATRMPDVZGLI-LBPRGKRZSA-N 0 0 358.394 3.858 20 5 FHBDRN CC[C@]1(c2ccc(C)cc2)CC(=O)N(CCc2ccc([N+](=O)[O-])cc2)C1=O ZINC000569525891 568405463 /nfs/dbraw/zinc/40/54/63/568405463.db2.gz XHHGURNTENAJIG-OAQYLSRUSA-N 0 0 366.417 3.553 20 5 FHBDRN COc1cc(Cc2noc(-c3oc(C(C)C)nc3C)n2)ccc1[N+](=O)[O-] ZINC000569648349 568411397 /nfs/dbraw/zinc/41/13/97/568411397.db2.gz HTMATHIRFNRAHZ-UHFFFAOYSA-N 0 0 358.354 3.664 20 5 FHBDRN CC(C)c1nc2cc(NC[C@@H](O)COc3cccc([N+](=O)[O-])c3)ccc2o1 ZINC000569687256 568411850 /nfs/dbraw/zinc/41/18/50/568411850.db2.gz QEHCTQUFCDYQPJ-OAHLLOKOSA-N 0 0 371.393 3.711 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H](C)c1nnc([C@@H](C)CC)[nH]1 ZINC000569652543 568415201 /nfs/dbraw/zinc/41/52/01/568415201.db2.gz AJFINNQYWBKVBL-QWRGUYRKSA-N 0 0 360.418 3.672 20 5 FHBDRN O=C(NCCc1cccc(F)c1F)c1c([N+](=O)[O-])cccc1C(F)(F)F ZINC000569889742 568433838 /nfs/dbraw/zinc/43/38/38/568433838.db2.gz YFCOBEPGSILDCK-UHFFFAOYSA-N 0 0 374.265 3.864 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2noc(-c3cnn(-c4ccccc4F)c3)n2)s1 ZINC000569912775 568435717 /nfs/dbraw/zinc/43/57/17/568435717.db2.gz CDTAJSARMFSBGD-UHFFFAOYSA-N 0 0 357.326 3.698 20 5 FHBDRN COCCN(CCCc1ccccc1)C(=O)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000570018661 568440933 /nfs/dbraw/zinc/44/09/33/568440933.db2.gz LNTGZKJVXIQREY-QGZVFWFLSA-N 0 0 370.449 3.806 20 5 FHBDRN COc1cc(C(=O)Nc2ccc(-c3c[nH]cn3)cc2)cc([N+](=O)[O-])c1C ZINC000570103472 568450882 /nfs/dbraw/zinc/45/08/82/568450882.db2.gz HEKPAKITKQXHBD-UHFFFAOYSA-N 0 0 352.350 3.554 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1OC[C@H](O)COCc1ccc(Cl)cc1 ZINC000570110646 568451533 /nfs/dbraw/zinc/45/15/33/568451533.db2.gz SMVCSIOBAOAOAO-MRXNPFEDSA-N 0 0 351.786 3.513 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)N1CCC[C@@H](c2ccncc2)C1 ZINC000570121319 568452429 /nfs/dbraw/zinc/45/24/29/568452429.db2.gz CGYOFNQGZUQUNN-QGZVFWFLSA-N 0 0 368.437 3.588 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)Nc1cccc(CC(=O)OC)c1 ZINC000570132122 568453277 /nfs/dbraw/zinc/45/32/77/568453277.db2.gz LOUYGACGUUFRJE-UHFFFAOYSA-N 0 0 357.366 3.517 20 5 FHBDRN CN(C)c1ccccc1NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000033121887 568459376 /nfs/dbraw/zinc/45/93/76/568459376.db2.gz YBENCSRFZDHYGW-UHFFFAOYSA-N 0 0 354.410 3.513 20 5 FHBDRN CC(C)C[C@@H](Nc1nccc(C(N)=O)c1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000570192990 568460223 /nfs/dbraw/zinc/46/02/23/568460223.db2.gz PZWGXECHCBLALT-CQSZACIVSA-N 0 0 362.817 3.941 20 5 FHBDRN O=C(c1c(Cl)cccc1[N+](=O)[O-])N1CCC(Cc2nccs2)CC1 ZINC000601743423 568460661 /nfs/dbraw/zinc/46/06/61/568460661.db2.gz RLRXFPVLDNWVTL-UHFFFAOYSA-N 0 0 365.842 3.800 20 5 FHBDRN COc1cc(C(=O)NC[C@H]2CC[C@@H](c3ccccc3)O2)cc([N+](=O)[O-])c1C ZINC000570210172 568461705 /nfs/dbraw/zinc/46/17/05/568461705.db2.gz VMHUZYLRXXOSEO-AEFFLSMTSA-N 0 0 370.405 3.562 20 5 FHBDRN CS(=O)(=O)c1ccc(N[C@H]2CCSc3ccccc32)c([N+](=O)[O-])c1 ZINC000007186781 568469943 /nfs/dbraw/zinc/46/99/43/568469943.db2.gz NKIDBBUQLPQCKO-ZDUSSCGKSA-N 0 0 364.448 3.647 20 5 FHBDRN C[C@H](NC(=O)N1CCO[C@](C)(c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000570407301 568483330 /nfs/dbraw/zinc/48/33/30/568483330.db2.gz PNQWOBJMCIGGLE-YWZLYKJASA-N 0 0 369.421 3.613 20 5 FHBDRN O=C([O-])c1ccc(C[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)c(F)c1 ZINC000570583918 568495505 /nfs/dbraw/zinc/49/55/05/568495505.db2.gz OFPPJNSEGBBBAV-HNNXBMFYSA-N 0 0 358.369 3.812 20 5 FHBDRN O=C(CSc1ccccc1Cl)NCCNc1ccc([N+](=O)[O-])cc1 ZINC000007350271 568496792 /nfs/dbraw/zinc/49/67/92/568496792.db2.gz NMSMTBGZWIQRNM-UHFFFAOYSA-N 0 0 365.842 3.569 20 5 FHBDRN O=[N+]([O-])c1ccc(NCc2cc3ccccc3o2)c(F)c1N1CCOCC1 ZINC000570724334 568508978 /nfs/dbraw/zinc/50/89/78/568508978.db2.gz MYBYPEKWOQYWNY-UHFFFAOYSA-N 0 0 371.368 3.929 20 5 FHBDRN CCCc1n[nH]c(C(=O)N(CC)C[C@H](CC)c2ccccc2)c1[N+](=O)[O-] ZINC000482254509 568536574 /nfs/dbraw/zinc/53/65/74/568536574.db2.gz UAAHVBWZITWFMR-AWEZNQCLSA-N 0 0 358.442 3.926 20 5 FHBDRN C[C@@H]1CC[C@H](O)[C@@H]([C@@H]2CCCN2c2nc3ccccc3cc2[N+](=O)[O-])C1 ZINC000542006776 568561741 /nfs/dbraw/zinc/56/17/41/568561741.db2.gz DHVRPACAPHPZTM-OVLVRJBISA-N 0 0 355.438 3.909 20 5 FHBDRN NC(=O)Cc1ccc(NC(=O)c2cc3ccccc3c3cccnc23)cc1 ZINC000049682344 568565406 /nfs/dbraw/zinc/56/54/06/568565406.db2.gz LOXDJCOJVDSKLR-UHFFFAOYSA-N 0 0 355.397 3.668 20 5 FHBDRN Cc1ccc(NC(=O)CCc2nnc(-c3ccccc3)o2)cc1[N+](=O)[O-] ZINC000020893728 568566542 /nfs/dbraw/zinc/56/65/42/568566542.db2.gz JYXKDNMPUNYHOY-UHFFFAOYSA-N 0 0 352.350 3.525 20 5 FHBDRN Cc1cc(C)c(-c2nn[nH]n2)c(S[C@H](C)c2ccccc2[N+](=O)[O-])n1 ZINC000822193474 599124534 /nfs/dbraw/zinc/12/45/34/599124534.db2.gz YXCOFWGCIVSIIH-LLVKDONJSA-N 0 0 356.411 3.640 20 5 FHBDRN CC(C)Cc1ccc([C@H](C)Nc2ncc([N+](=O)[O-])cc2-c2nn[nH]n2)cc1 ZINC000820108565 599230073 /nfs/dbraw/zinc/23/00/73/599230073.db2.gz NGGQVLCNQUOCQR-LBPRGKRZSA-N 0 0 367.413 3.542 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCC[C@H](c3ccccc3)CC2)c(-c2nn[nH]n2)c1 ZINC000738371962 598459879 /nfs/dbraw/zinc/45/98/79/598459879.db2.gz ZSPLOQWHVQZKHH-HNNXBMFYSA-N 0 0 364.409 3.549 20 5 FHBDRN C[C@@H](c1ccc(Cl)cc1)N(C)c1ccc([N+](=O)[O-])cc1-c1nn[nH]n1 ZINC000736198145 598814417 /nfs/dbraw/zinc/81/44/17/598814417.db2.gz GOLLZAIOGIJNMX-JTQLQIEISA-N 0 0 358.789 3.626 20 5 FHBDRN O=[N+]([O-])c1cnc(Oc2ccc(-c3ccccc3)cc2)c(-c2nn[nH]n2)c1 ZINC000738374947 599325363 /nfs/dbraw/zinc/32/53/63/599325363.db2.gz UPDJOHHTNDVHSV-UHFFFAOYSA-N 0 0 360.333 3.629 20 5 FHBDRN O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1Nc1ccc(CC(F)(F)F)cc1 ZINC000823629894 599580718 /nfs/dbraw/zinc/58/07/18/599580718.db2.gz KYYRMNDFSINRCK-UHFFFAOYSA-N 0 0 364.287 3.623 20 5 FHBDRN O=C([O-])N1CCC[C@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000739929728 599860725 /nfs/dbraw/zinc/86/07/25/599860725.db2.gz XYQFJCDNDSVQFB-LBPRGKRZSA-N 0 0 361.423 3.555 20 5 FHBDRN COc1ccc(-c2ccc(C[NH2+]C3CCC(C(=O)[O-])CC3)o2)c([N+](=O)[O-])c1 ZINC000426680124 600007837 /nfs/dbraw/zinc/00/78/37/600007837.db2.gz KUBSOWKRMPXUTI-UHFFFAOYSA-N 0 0 374.393 3.596 20 5 FHBDRN O=C([O-])/C=C\c1ccc(NC2CC[NH+](C3CCCCC3)CC2)c([N+](=O)[O-])c1 ZINC000833195142 601202068 /nfs/dbraw/zinc/20/20/68/601202068.db2.gz CMBFOPHBWHHFJL-CLFYSBASSA-N 0 0 373.453 3.902 20 5 FHBDRN CC[NH+](CC)CC1CCN(c2cc(Cl)c(C(=O)[O-])cc2[N+](=O)[O-])CC1 ZINC000829671951 602251643 /nfs/dbraw/zinc/25/16/43/602251643.db2.gz UBBQQDSHCAXWMS-UHFFFAOYSA-N 0 0 369.849 3.505 20 5 FHBDRN C[C@@H]([NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)[C@@H]1CCCN(C(=O)[O-])C1 ZINC000739032351 602270495 /nfs/dbraw/zinc/27/04/95/602270495.db2.gz WHSNVLAXSAATKW-ZIAGYGMSSA-N 0 0 373.409 3.723 20 5 FHBDRN O=[N+]([O-])c1ccccc1-c1nc(-c2ccc(-c3nn[nH]n3)cc2)cs1 ZINC000823647456 606155716 /nfs/dbraw/zinc/15/57/16/606155716.db2.gz KBJLFZJADFUFJV-UHFFFAOYSA-N 0 0 350.363 3.565 20 5 FHBDRN O=[N+]([O-])c1cccc2ccc(C=Cc3ccc(-c4nn[nH]n4)s3)nc21 ZINC000823648421 606389964 /nfs/dbraw/zinc/38/99/64/606389964.db2.gz WTSFHDVWUUTGQA-VOTSOKGWSA-N 0 0 350.363 3.555 20 5 FHBDRN O=[N+]([O-])c1ccc(NC[C@@H]2CCC[C@H](C(F)(F)F)C2)c(-c2nn[nH]n2)c1 ZINC000823640062 606595854 /nfs/dbraw/zinc/59/58/54/606595854.db2.gz QSFWOTYPYDXZNW-ZJUUUORDSA-N 0 0 370.335 3.556 20 5 FHBDRN O=[N+]([O-])c1c(-c2nn[nH]n2)ccnc1Sc1cc(Cl)ccc1Cl ZINC000823629667 607163855 /nfs/dbraw/zinc/16/38/55/607163855.db2.gz DROIVGQPYAVICN-UHFFFAOYSA-N 0 0 369.193 3.628 20 5 FHBDRN CCCn1c2ccc(-c3nn[nH]n3)cc2nc1-c1ccc(C)c([N+](=O)[O-])c1 ZINC000825352659 607974998 /nfs/dbraw/zinc/97/49/98/607974998.db2.gz OUMKNUOLYGCJTK-UHFFFAOYSA-N 0 0 363.381 3.510 20 5 FHBDRN O=[N+]([O-])c1ccc(Oc2ccc(-c3ccccc3)nc2)c(-c2nn[nH]n2)c1 ZINC000826499689 608797735 /nfs/dbraw/zinc/79/77/35/608797735.db2.gz SHMYJBGPDPGLQI-UHFFFAOYSA-N 0 0 360.333 3.629 20 5 FHBDRN CC(C)Nc1ccc(C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)cn1 ZINC000135274002 936316899 /nfs/dbraw/zinc/31/68/99/936316899.db2.gz BWHTYMCMJKACDK-UHFFFAOYSA-N 0 0 354.410 3.615 20 5 FHBDRN Cc1cccc(OCCN(C)C(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)c1 ZINC000024215603 936325634 /nfs/dbraw/zinc/32/56/34/936325634.db2.gz WXWCAJDIQFWXDM-HNNXBMFYSA-N 0 0 374.462 3.921 20 5 FHBDRN Cc1ccc(Nc2ncccc2I)cc1[N+](=O)[O-] ZINC001213661381 936334532 /nfs/dbraw/zinc/33/45/32/936334532.db2.gz DLOJCXXQIRQTPD-UHFFFAOYSA-N 0 0 355.135 3.646 20 5 FHBDRN O=[N+]([O-])c1ccc(N[C@@H]2CCc3ccccc3C2)c(F)c1N1CCOCC1 ZINC000582990377 936351908 /nfs/dbraw/zinc/35/19/08/936351908.db2.gz GOAFMKMNSRXQPB-MRXNPFEDSA-N 0 0 371.412 3.540 20 5 FHBDRN Cc1cc(S(=O)(=O)N2CC[C@@H]2c2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000511223875 936356734 /nfs/dbraw/zinc/35/67/34/936356734.db2.gz SRNQRJPLWSLKCQ-MRXNPFEDSA-N 0 0 366.826 3.692 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NC2(C(F)(F)F)CCCCC2)c1 ZINC000583037004 936387597 /nfs/dbraw/zinc/38/75/97/936387597.db2.gz DSSJJTHMQJANGV-UHFFFAOYSA-N 0 0 360.332 3.989 20 5 FHBDRN CCOCc1ccccc1CNC(=O)Nc1cc([N+](=O)[O-])ccc1OCC ZINC000439885674 945065251 /nfs/dbraw/zinc/06/52/51/945065251.db2.gz AMHSEWQWVTVCFD-UHFFFAOYSA-N 0 0 373.409 3.852 20 5 FHBDRN Cc1cc(C(=O)Nc2ccc([C@@H](C)N3CCOCC3)cc2)cc([N+](=O)[O-])c1 ZINC000110720429 945065438 /nfs/dbraw/zinc/06/54/38/945065438.db2.gz IFTXDIARVHRJDG-OAHLLOKOSA-N 0 0 369.421 3.549 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N(C)CCOc1ccc(C)cc1 ZINC000439886720 945066858 /nfs/dbraw/zinc/06/68/58/945066858.db2.gz HRXPGIZRNHJIKP-UHFFFAOYSA-N 0 0 373.409 3.845 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H]1CCC[C@H](SC)C1 ZINC000439903745 945068225 /nfs/dbraw/zinc/06/82/25/945068225.db2.gz QTVTWKDNJJADKW-YPMHNXCESA-N 0 0 353.444 3.789 20 5 FHBDRN CC(C)(CCC(=O)OCc1c(F)ccc(Br)c1F)[N+](=O)[O-] ZINC000835385707 937092490 /nfs/dbraw/zinc/09/24/90/937092490.db2.gz NWNNIUMGWPGZID-UHFFFAOYSA-N 0 0 366.158 3.606 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N(C[C@@H]1CCCO1)C1CCCC1 ZINC000136028970 937093009 /nfs/dbraw/zinc/09/30/09/937093009.db2.gz IOMMCEUUYGYAKJ-KRWDZBQOSA-N 0 0 371.437 3.569 20 5 FHBDRN CC(C)C[C@H]1CCN(C(=O)c2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000075087331 937095941 /nfs/dbraw/zinc/09/59/41/937095941.db2.gz UIEAEJIBQIFBSU-LLVKDONJSA-N 0 0 355.232 3.866 20 5 FHBDRN Cc1nc2c(cnn2C(C)C)cc1C(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000247931780 937106686 /nfs/dbraw/zinc/10/66/86/937106686.db2.gz CTPNJTGXIYNLBI-UHFFFAOYSA-N 0 0 357.345 3.620 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)Nc1cccc(NC(=O)C2CC2)c1 ZINC000046576654 937110477 /nfs/dbraw/zinc/11/04/77/937110477.db2.gz WUKOZMYKAOMMAQ-UHFFFAOYSA-N 0 0 371.418 3.674 20 5 FHBDRN O=C(c1cccc2c(=O)c3ccccc3[nH]c12)N1CCOC2(CCCC2)C1 ZINC000278081432 937128253 /nfs/dbraw/zinc/12/82/53/937128253.db2.gz HGRGTIADDIKKLZ-UHFFFAOYSA-N 0 0 362.429 3.879 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CNc1ccc(OC(C)C)cc1F ZINC000052109743 937134231 /nfs/dbraw/zinc/13/42/31/937134231.db2.gz AVXDTMBGQPWHBA-UHFFFAOYSA-N 0 0 361.373 3.880 20 5 FHBDRN COc1cc(C(=O)Nc2cccc(C(F)F)c2)cc([N+](=O)[O-])c1OC ZINC000610173575 927130817 /nfs/dbraw/zinc/13/08/17/927130817.db2.gz MKYVJDVIJSKUPF-UHFFFAOYSA-N 0 0 352.293 3.802 20 5 FHBDRN Cc1c(OC[C@@H](O)c2cccc(Br)c2)cccc1[N+](=O)[O-] ZINC000755325866 937137175 /nfs/dbraw/zinc/13/71/75/937137175.db2.gz YLNYEBNABRWQOW-CQSZACIVSA-N 0 0 352.184 3.778 20 5 FHBDRN C[C@@H]1C[C@H](c2ccccc2)CN1c1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1 ZINC000557600141 927144416 /nfs/dbraw/zinc/14/44/16/927144416.db2.gz WSRFGMAFUZACLK-OCCSQVGLSA-N 0 0 350.378 3.626 20 5 FHBDRN O=[N+]([O-])c1cc2c(Cl)ncnc2c(N2CCC[C@@H]2c2nccs2)c1 ZINC001167047230 927170484 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FHBDRN CSc1cccc(C(=O)NCC2(C)Cc3ccccc3C2)c1[N+](=O)[O-] ZINC000186946644 927600139 /nfs/dbraw/zinc/60/01/39/927600139.db2.gz KMDMDJMZJKWSDF-UHFFFAOYSA-N 0 0 356.447 3.852 20 5 FHBDRN Cn1cc(C(=O)N(CCC2CC2)CC2CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000598466137 927647042 /nfs/dbraw/zinc/64/70/42/927647042.db2.gz KWUFVXYHNUQCKC-UHFFFAOYSA-N 0 0 368.437 3.648 20 5 FHBDRN CC(C)CSCCNC(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000535947434 937187836 /nfs/dbraw/zinc/18/78/36/937187836.db2.gz CSOOPNLUEUUODL-NSHDSACASA-N 0 0 360.863 3.521 20 5 FHBDRN CCc1ccc(NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)cc1C ZINC000535808723 927725985 /nfs/dbraw/zinc/72/59/85/927725985.db2.gz SNXLMWYWWRQDDK-UHFFFAOYSA-N 0 0 350.378 3.904 20 5 FHBDRN COc1ccccc1NC(=O)C1CCN(c2ccc([N+](=O)[O-])s2)CC1 ZINC000064029475 927794497 /nfs/dbraw/zinc/79/44/97/927794497.db2.gz XNIXOPZNPCZSIG-UHFFFAOYSA-N 0 0 361.423 3.520 20 5 FHBDRN Cc1c(NC(=O)N(Cc2ccccc2)[C@H](CO)C(C)C)cccc1[N+](=O)[O-] ZINC000175303243 927817929 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3.564 20 5 FHBDRN COc1ccc(C(=O)N2CCC[C@](C)(c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000499908635 928832205 /nfs/dbraw/zinc/83/22/05/928832205.db2.gz TWZCMWAFNFCNCF-FQEVSTJZSA-N 0 0 354.406 3.797 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])N(c1ccccn1)C1CCCC1 ZINC000154463718 928854225 /nfs/dbraw/zinc/85/42/25/928854225.db2.gz PUSDDROOPYUIOF-UHFFFAOYSA-N 0 0 355.394 3.735 20 5 FHBDRN CCN(CCc1nccs1)C(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000131246424 928879753 /nfs/dbraw/zinc/87/97/53/928879753.db2.gz JCBVKNAKCFPMRX-GFCCVEGCSA-N 0 0 365.480 3.623 20 5 FHBDRN O=[N+]([O-])c1ccc2nc(Cl)cc(N3CCO[C@H](C(F)(F)F)C3)c2c1 ZINC001167085729 928890302 /nfs/dbraw/zinc/89/03/02/928890302.db2.gz ZPTMZBLOWHFTKQ-LBPRGKRZSA-N 0 0 361.707 3.564 20 5 FHBDRN O=C(N[C@@H]1CC12CCCC2)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000430263150 928898119 /nfs/dbraw/zinc/89/81/19/928898119.db2.gz ZLEKFISFKJHWIC-CYBMUJFWSA-N 0 0 358.316 3.598 20 5 FHBDRN O=C(c1cccc2c1OCO2)N(c1cccc([N+](=O)[O-])c1)C1CCCC1 ZINC000120544070 928909231 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Cc1nc2ccccc2n1CCCNC(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000134600159 929094817 /nfs/dbraw/zinc/09/48/17/929094817.db2.gz WDXASGRUMHQPTP-UHFFFAOYSA-N 0 0 372.812 3.726 20 5 FHBDRN CC(C)(C)OC1CCN(Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)CC1 ZINC000120614502 929107677 /nfs/dbraw/zinc/10/76/77/929107677.db2.gz BHBHEXLVLDLFSR-UHFFFAOYSA-N 0 0 358.442 3.695 20 5 FHBDRN CC(C)Cc1ccc([C@H](C)C(=O)N2CCc3ncc([N+](=O)[O-])cc3C2)cc1 ZINC000430276526 929121151 /nfs/dbraw/zinc/12/11/51/929121151.db2.gz CXFDTKVRABHMLW-HNNXBMFYSA-N 0 0 367.449 3.877 20 5 FHBDRN COc1ccc([C@H]2CCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)c(OC)c1 ZINC000609441541 929141829 /nfs/dbraw/zinc/14/18/29/929141829.db2.gz IPCBOTPMPBHEGC-QGZVFWFLSA-N 0 0 374.368 3.728 20 5 FHBDRN O=C(NCc1ccccc1OC1CCCC1)c1cc(F)cc([N+](=O)[O-])c1 ZINC000609442172 929142738 /nfs/dbraw/zinc/14/27/38/929142738.db2.gz ATBSHZCIPZTHEW-UHFFFAOYSA-N 0 0 358.369 3.985 20 5 FHBDRN CSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)c1cnn(CC2CCC2)c1 ZINC000890668016 929152672 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5 FHBDRN O=[N+]([O-])c1ccc(NCc2cnn(Cc3ccccc3)c2)c2ncccc12 ZINC000052243985 937311841 /nfs/dbraw/zinc/31/18/41/937311841.db2.gz DYMLTEFAJRISKO-UHFFFAOYSA-N 0 0 359.389 4.000 20 5 FHBDRN Cc1c2ccccc2n(C)c1CNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000471220420 929226391 /nfs/dbraw/zinc/22/63/91/929226391.db2.gz NJKBKTXDXPVYMJ-UHFFFAOYSA-N 0 0 365.433 3.989 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N[C@@H]1[C@@H]2CCO[C@H]2C12CCCC2 ZINC000246088038 929255314 /nfs/dbraw/zinc/25/53/14/929255314.db2.gz IKKJOMRHSOIOIX-BMGDILEWSA-N 0 0 358.438 3.598 20 5 FHBDRN Cc1ccc(CN(CCn2cc([N+](=O)[O-])ccc2=O)c2ccc(F)cc2)o1 ZINC000535628103 929317130 /nfs/dbraw/zinc/31/71/30/929317130.db2.gz BCKGUCSSDOAZAG-UHFFFAOYSA-N 0 0 371.368 3.504 20 5 FHBDRN Cc1c2ccccc2n(C)c1CNC(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000471227142 929319406 /nfs/dbraw/zinc/31/94/06/929319406.db2.gz MSIUMZZVGQPXIH-UHFFFAOYSA-N 0 0 374.400 3.873 20 5 FHBDRN O=C(/C=C\c1cncc(F)c1)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000255029472 929336165 /nfs/dbraw/zinc/33/61/65/929336165.db2.gz XKHUOEVPACATJF-PLNGDYQASA-N 0 0 370.365 3.904 20 5 FHBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])N[C@H]1C[C@H]1c1ccccc1 ZINC000609725124 929355121 /nfs/dbraw/zinc/35/51/21/929355121.db2.gz GRNZLWRVROHBOU-GJZGRUSLSA-N 0 0 360.797 3.689 20 5 FHBDRN Cc1cccc(C)c1Oc1ccccc1NC(=O)c1c[nH]nc1[N+](=O)[O-] ZINC000547755949 929369139 /nfs/dbraw/zinc/36/91/39/929369139.db2.gz KUCSKUWQNXXHMT-UHFFFAOYSA-N 0 0 352.350 3.979 20 5 FHBDRN C[C@@H]1CCC[C@H](OCc2cccc(NC(=O)c3c[nH]nc3[N+](=O)[O-])c2)C1 ZINC000547757635 929373855 /nfs/dbraw/zinc/37/38/55/929373855.db2.gz CMGQSVAEPPDALO-DOMZBBRYSA-N 0 0 358.398 3.666 20 5 FHBDRN COC(=O)c1ccc2nc(SCc3cc([N+](=O)[O-])ccc3OC)oc2c1 ZINC000609752789 929393959 /nfs/dbraw/zinc/39/39/59/929393959.db2.gz MOTHOFLZFPCSJA-UHFFFAOYSA-N 0 0 374.374 3.824 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1NC(=O)CN1c2ccccc2N(C)CC[C@H]1C ZINC000471232864 929400584 /nfs/dbraw/zinc/40/05/84/929400584.db2.gz DPTIBGBTOSWSQV-OAHLLOKOSA-N 0 0 368.437 3.577 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1c2ccccc2N(C)CC[C@H]1C ZINC000471233953 929410961 /nfs/dbraw/zinc/41/09/61/929410961.db2.gz GVAZPMGAAGYOSU-OAHLLOKOSA-N 0 0 368.437 3.577 20 5 FHBDRN O=C(NC[C@@H]1CSCCS1)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000278191909 937329124 /nfs/dbraw/zinc/32/91/24/937329124.db2.gz OXWWDBZUUYUZGN-GFCCVEGCSA-N 0 0 370.499 3.672 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)NC[C@H]1CCc2ccccc2C1 ZINC000609787631 929473260 /nfs/dbraw/zinc/47/32/60/929473260.db2.gz OFMSXCIESBYYTQ-ZDUSSCGKSA-N 0 0 358.825 3.712 20 5 FHBDRN COc1cc(C(=O)NCc2c(C)c3ccccc3n2C)cc([N+](=O)[O-])c1C ZINC000471236693 929511113 /nfs/dbraw/zinc/51/11/13/929511113.db2.gz YOQLMODNGIOYTG-UHFFFAOYSA-N 0 0 367.405 3.642 20 5 FHBDRN O=C(c1c[nH]c2ccc([N+](=O)[O-])cc12)N(C[C@@H]1CCCO1)C1CCCC1 ZINC000610243295 929530674 /nfs/dbraw/zinc/53/06/74/929530674.db2.gz XDTFDDWTTDUTDR-HNNXBMFYSA-N 0 0 357.410 3.640 20 5 FHBDRN Cc1nc(C2(NC(=O)c3ccc([N+](=O)[O-])cc3Cl)CCCCC2)no1 ZINC000023507792 929550156 /nfs/dbraw/zinc/55/01/56/929550156.db2.gz HASNMEUDVNYBAH-UHFFFAOYSA-N 0 0 364.789 3.529 20 5 FHBDRN CCCOc1cc(NC(=O)c2ccccn2)c([N+](=O)[O-])cc1OCCC ZINC000017741847 929615441 /nfs/dbraw/zinc/61/54/41/929615441.db2.gz MVYURBIXDWQGKT-UHFFFAOYSA-N 0 0 359.382 3.820 20 5 FHBDRN CCc1ccc(C(=O)N(CC)[C@H](COC)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000471444422 929632090 /nfs/dbraw/zinc/63/20/90/929632090.db2.gz RAESYDMNXPYJMR-IBGZPJMESA-N 0 0 370.449 3.877 20 5 FHBDRN C[C@@H]1CCCCCN1S(=O)(=O)c1c(Cl)ccc([N+](=O)[O-])c1Cl ZINC001211573816 937349356 /nfs/dbraw/zinc/34/93/56/937349356.db2.gz XVIKOFMBMQYTSO-SECBINFHSA-N 0 0 367.254 3.855 20 5 FHBDRN C[C@@H]1C[C@@H](C(=O)N(Cc2ccccc2[N+](=O)[O-])CC(F)(F)F)C[C@H](C)O1 ZINC000247248111 929669959 /nfs/dbraw/zinc/66/99/59/929669959.db2.gz XBIRHKCWMVQUFM-DABQJJPHSA-N 0 0 374.359 3.689 20 5 FHBDRN COc1cc(F)c([C@@H](C)NC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)cc1OC ZINC000255125203 929670847 /nfs/dbraw/zinc/67/08/47/929670847.db2.gz UMZQECMFMQEIKY-OJIASSBASA-N 0 0 374.368 3.642 20 5 FHBDRN COc1ccc(Br)c(OCc2ccc([N+](=O)[O-])c(OC)c2)c1 ZINC000558470971 929671825 /nfs/dbraw/zinc/67/18/25/929671825.db2.gz LXPBMBOODBTJRM-UHFFFAOYSA-N 0 0 368.183 3.954 20 5 FHBDRN Cc1c(NC(=O)N2C[C@@H](C)O[C@@H](c3ccsc3)C2)cccc1[N+](=O)[O-] ZINC000155472304 929672185 /nfs/dbraw/zinc/67/21/85/929672185.db2.gz LXORERYFDUTIHT-BDJLRTHQSA-N 0 0 361.423 3.959 20 5 FHBDRN Cc1c(NC(=O)Nc2ccccc2O[C@@H]2CCOC2)cccc1[N+](=O)[O-] ZINC000155473441 929677644 /nfs/dbraw/zinc/67/76/44/929677644.db2.gz OXZDHUNBTBUHNX-CYBMUJFWSA-N 0 0 357.366 3.715 20 5 FHBDRN CCN(C(=O)c1cc(C)cc([N+](=O)[O-])c1)[C@H](COC)Cc1ccccc1 ZINC000471448173 929677691 /nfs/dbraw/zinc/67/76/91/929677691.db2.gz BJDFRZGULHHUOE-IBGZPJMESA-N 0 0 356.422 3.623 20 5 FHBDRN CCn1ccnc1SCC(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000011888888 929687722 /nfs/dbraw/zinc/68/77/22/929687722.db2.gz DVBRVWCVJYLJCS-UHFFFAOYSA-N 0 0 374.344 3.561 20 5 FHBDRN CC(=O)c1ccc(NC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)cc1C ZINC000134964373 929691828 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Cc1cccc(CN(C)C(=O)NCCCNc2ccc(C)cc2[N+](=O)[O-])c1 ZINC000610102383 930539460 /nfs/dbraw/zinc/53/94/60/930539460.db2.gz ZCKQKAQSUWHUIG-UHFFFAOYSA-N 0 0 370.453 3.855 20 5 FHBDRN CO[C@H]1CCC[C@@H](CC(=O)OCCSc2ccc([N+](=O)[O-])cc2)C1 ZINC000796828443 930554066 /nfs/dbraw/zinc/55/40/66/930554066.db2.gz OHDUKYYKVVSZBH-HIFRSBDPSA-N 0 0 353.440 3.825 20 5 FHBDRN CCN(c1ccc2[nH]ccc2c1)S(=O)(=O)c1cc([N+](=O)[O-])ccc1C ZINC000471566163 930580847 /nfs/dbraw/zinc/58/08/47/930580847.db2.gz MRJPDDGWVYYFGQ-UHFFFAOYSA-N 0 0 359.407 3.600 20 5 FHBDRN C[C@@H](c1nc(-c2cccnc2N2CCCC2)no1)c1cccc([N+](=O)[O-])c1 ZINC000580376728 930590362 /nfs/dbraw/zinc/59/03/62/930590362.db2.gz WRTSWPCKOQHUDL-CYBMUJFWSA-N 0 0 365.393 3.792 20 5 FHBDRN COc1ccc(Br)c(CN(C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000536639954 930591489 /nfs/dbraw/zinc/59/14/89/930591489.db2.gz XIOWCIVODPTVQL-UHFFFAOYSA-N 0 0 365.227 3.998 20 5 FHBDRN Cc1cc(C(=O)NCCc2ccccc2[N+](=O)[O-])nn1C1CCCCC1 ZINC000548089706 930607607 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FHBDRN O=C(NC1(C2CCCCC2)CC1)c1cc([N+](=O)[O-])ncc1Br ZINC000891275638 930643774 /nfs/dbraw/zinc/64/37/74/930643774.db2.gz FPNDFGAVYXDEBM-UHFFFAOYSA-N 0 0 368.231 3.595 20 5 FHBDRN CC(C)Oc1ccccc1[C@@H](C)NC(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000548094564 930658589 /nfs/dbraw/zinc/65/85/89/930658589.db2.gz KABFBSPBHAJDDP-OAHLLOKOSA-N 0 0 371.437 3.985 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc(O)c(C(F)(F)F)c1 ZINC000134224921 930664179 /nfs/dbraw/zinc/66/41/79/930664179.db2.gz GUIQWRJHJQRECB-UHFFFAOYSA-N 0 0 354.284 3.891 20 5 FHBDRN COc1cc(C(=O)N(C)Cc2cc3ccccc3o2)cc([N+](=O)[O-])c1OC ZINC000471577837 930677814 /nfs/dbraw/zinc/67/78/14/930677814.db2.gz MESPTWSTDJNXBY-UHFFFAOYSA-N 0 0 370.361 3.630 20 5 FHBDRN CC(=O)c1ccc(OCc2nc(Cc3ccccc3C)no2)c([N+](=O)[O-])c1 ZINC000119109840 930678430 /nfs/dbraw/zinc/67/84/30/930678430.db2.gz ZUQWSRKHMIXKGP-UHFFFAOYSA-N 0 0 367.361 3.659 20 5 FHBDRN CC[C@@H]1c2ccccc2CCN1C(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000074645029 930680208 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3.653 20 5 FHBDRN O=[N+]([O-])c1cc2c(ncnc2NCc2ccc(OC3CCCC3)nc2)s1 ZINC000561134149 930816330 /nfs/dbraw/zinc/81/63/30/930816330.db2.gz UPTZRYKQFMWOBM-UHFFFAOYSA-N 0 0 371.422 3.928 20 5 FHBDRN C[C@@H]1CO[C@@H](c2ccccc2)CN1C(=O)c1cccc(Cl)c1[N+](=O)[O-] ZINC000175820795 930828039 /nfs/dbraw/zinc/82/80/39/930828039.db2.gz ZMPJCURJBWVFKS-MLGOLLRUSA-N 0 0 360.797 3.850 20 5 FHBDRN CCOc1ccc(NC(=O)CN([C@H](C)c2ccco2)C2CC2)c([N+](=O)[O-])c1 ZINC000119189831 930830902 /nfs/dbraw/zinc/83/09/02/930830902.db2.gz XYOQDWVXEBTENX-CYBMUJFWSA-N 0 0 373.409 3.751 20 5 FHBDRN Cc1n[nH]c2cc(NC(=O)[C@@H](C)Sc3ccc([N+](=O)[O-])cc3)ccc12 ZINC000091827127 930831592 /nfs/dbraw/zinc/83/15/92/930831592.db2.gz JMZGFFMRXRKUEK-LLVKDONJSA-N 0 0 356.407 3.899 20 5 FHBDRN COc1ccc(NC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)c(OC)c1OC ZINC000275911274 930832995 /nfs/dbraw/zinc/83/29/95/930832995.db2.gz WDYSTDPGIVMDKX-UHFFFAOYSA-N 0 0 374.393 3.996 20 5 FHBDRN COc1ccc(C(C)(C)CNC(=O)c2cc([N+](=O)[O-])c(F)cc2C)cc1 ZINC001125457223 930847688 /nfs/dbraw/zinc/84/76/88/930847688.db2.gz ZYWHGDYMKIZHGC-UHFFFAOYSA-N 0 0 360.385 3.759 20 5 FHBDRN CC[C@@H](C(=O)Nc1cc(C(=O)OC)cc([N+](=O)[O-])c1)c1ccc(OC)cc1 ZINC000537199424 930862560 /nfs/dbraw/zinc/86/25/60/930862560.db2.gz PYLNGPPUQABQIA-QGZVFWFLSA-N 0 0 372.377 3.522 20 5 FHBDRN CC(C)[C@H]1C[C@H](NC(=O)c2ccnc(-c3ccccc3)c2[N+](=O)[O-])CCO1 ZINC001266623283 930871599 /nfs/dbraw/zinc/87/15/99/930871599.db2.gz LBFBDYBUNYTNRT-NVXWUHKLSA-N 0 0 369.421 3.590 20 5 FHBDRN CNc1ccc(C(=O)N[C@@H](C)CSc2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000548113259 930881444 /nfs/dbraw/zinc/88/14/44/930881444.db2.gz URIKDEGLGVAJIX-ZDUSSCGKSA-N 0 0 359.451 3.856 20 5 FHBDRN O=Cc1ccc([N+](=O)[O-])c(OCc2ccnc(-c3ccc(F)cc3)n2)c1 ZINC000119220291 930892097 /nfs/dbraw/zinc/89/20/97/930892097.db2.gz FOLDYSKQHYSHJJ-UHFFFAOYSA-N 0 0 353.309 3.582 20 5 FHBDRN COCCCOc1ccccc1NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000119214112 930893000 /nfs/dbraw/zinc/89/30/00/930893000.db2.gz KBWQVAZDSCSUAR-UHFFFAOYSA-N 0 0 364.785 3.916 20 5 FHBDRN CCc1nc2ccc(Cl)cn2c1C(=O)Nc1ccc(OC)c([N+](=O)[O-])c1 ZINC000071448735 930904093 /nfs/dbraw/zinc/90/40/93/930904093.db2.gz UQHBIXQLMIOVOD-UHFFFAOYSA-N 0 0 374.784 3.719 20 5 FHBDRN O=C(NCCCOC1CCCC1)c1c([N+](=O)[O-])cccc1C(F)(F)F ZINC000580602308 930913458 /nfs/dbraw/zinc/91/34/58/930913458.db2.gz FAABTKVBHVHBDZ-UHFFFAOYSA-N 0 0 360.332 3.693 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(NCC(F)(F)c2ccc(Cl)cc2)n1 ZINC000579746242 930924270 /nfs/dbraw/zinc/92/42/70/930924270.db2.gz MTVJJYMJXBPNFJ-UHFFFAOYSA-N 0 0 371.727 3.634 20 5 FHBDRN C[C@H](Cc1ccc(O)cc1)NC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000119236557 930931067 /nfs/dbraw/zinc/93/10/67/930931067.db2.gz KXDVLYFKZVZMQS-CQSZACIVSA-N 0 0 369.421 3.606 20 5 FHBDRN O=C(c1c[nH]c2ccc([N+](=O)[O-])cc12)N1CCc2c(F)cc(F)cc2C1 ZINC000134280276 930952685 /nfs/dbraw/zinc/95/26/85/930952685.db2.gz FFFRAKHAROMOIM-UHFFFAOYSA-N 0 0 357.316 3.553 20 5 FHBDRN O=C(c1cccc([N+](=O)[O-])c1)N(Cc1cccc(F)c1)C[C@H]1CCCO1 ZINC000050379623 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0 363.364 3.943 20 5 FHBDRN Cc1ccc(NC(=O)N[C@@H](C)COc2ccc(F)cc2F)cc1[N+](=O)[O-] ZINC000510344029 931099668 /nfs/dbraw/zinc/09/96/68/931099668.db2.gz BKIASMKVEUXWAG-NSHDSACASA-N 0 0 365.336 3.770 20 5 FHBDRN Cc1ccc(C(=O)Nc2cccc(CN3CCCCC3=O)c2)cc1[N+](=O)[O-] ZINC000050474974 931105329 /nfs/dbraw/zinc/10/53/29/931105329.db2.gz IMXDJSQOKWYFAB-UHFFFAOYSA-N 0 0 367.405 3.668 20 5 FHBDRN CCC(=O)c1cccc(N[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)c1 ZINC000135069415 931162537 /nfs/dbraw/zinc/16/25/37/931162537.db2.gz XVBVUOHNTONAIH-ZDUSSCGKSA-N 0 0 355.394 3.935 20 5 FHBDRN CSCC[C@H](C)N(C)C(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000134314851 931168373 /nfs/dbraw/zinc/16/83/73/931168373.db2.gz RFDHQXCQOYXVMU-WDEREUQCSA-N 0 0 360.863 3.616 20 5 FHBDRN C[C@@H](CNC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1)COCc1ccccc1 ZINC000580808351 931177099 /nfs/dbraw/zinc/17/70/99/931177099.db2.gz YPQOYQGDABTDLQ-HOTGVXAUSA-N 0 0 356.422 3.667 20 5 FHBDRN O=C(c1cccc([N+](=O)[O-])c1Cl)N1CCCC[C@H]([C@@H]2CCOC2)C1 ZINC000891327853 931216532 /nfs/dbraw/zinc/21/65/32/931216532.db2.gz HWMMGKHNUDDKCL-QWHCGFSZSA-N 0 0 352.818 3.527 20 5 FHBDRN O=[N+]([O-])c1ccc(S(=O)(=O)Nc2ccc(Oc3ccncc3)cc2)cc1 ZINC000050534611 931237361 /nfs/dbraw/zinc/23/73/61/931237361.db2.gz MBSXVEQKUSZPJF-UHFFFAOYSA-N 0 0 371.374 3.583 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)CCCc2nc(C(C)(C)C)no2)cc1[N+](=O)[O-] ZINC000177835493 931263936 /nfs/dbraw/zinc/26/39/36/931263936.db2.gz ZOZOZDOAYHLDAE-ZDUSSCGKSA-N 0 0 374.441 3.784 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)c2ccc(NC(=O)C3CC3)cc2)cc1[N+](=O)[O-] ZINC000177843375 931288765 /nfs/dbraw/zinc/28/87/65/931288765.db2.gz OAINTBSNOCLKNQ-ZDUSSCGKSA-N 0 0 367.405 3.743 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])c(Cl)c1)N1CCCC[C@H]([C@@H]2CCOC2)C1 ZINC000891338217 931304991 /nfs/dbraw/zinc/30/49/91/931304991.db2.gz YJEQGXZHEIFLMA-UONOGXRCSA-N 0 0 352.818 3.527 20 5 FHBDRN CC(=O)c1cccc(O[C@H](C)C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000177862222 931331215 /nfs/dbraw/zinc/33/12/15/931331215.db2.gz LPSAFBLMGLOFMQ-DZGCQCFKSA-N 0 0 370.405 3.751 20 5 FHBDRN CC(=O)c1cccc(O[C@@H](C)C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000177862248 931331447 /nfs/dbraw/zinc/33/14/47/931331447.db2.gz LPSAFBLMGLOFMQ-ZFWWWQNUSA-N 0 0 370.405 3.751 20 5 FHBDRN C[C@@H]1Oc2ccccc2[C@H]1NC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000580915651 931341910 /nfs/dbraw/zinc/34/19/10/931341910.db2.gz WGFFWBYMBMKHBE-VFZGTOFNSA-N 0 0 366.295 3.866 20 5 FHBDRN CN1C(=O)c2cc(Br)ccc2N[C@@H]1c1csc([N+](=O)[O-])c1 ZINC000135076443 931366614 /nfs/dbraw/zinc/36/66/14/931366614.db2.gz UYJUOPZURNJVLT-LBPRGKRZSA-N 0 0 368.212 3.615 20 5 FHBDRN Cc1noc(Cl)c1CCC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000126078509 931379823 /nfs/dbraw/zinc/37/98/23/931379823.db2.gz KFFOLUYDRKWHFI-UHFFFAOYSA-N 0 0 363.801 3.668 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC[C@H]1c1cccc(C)n1 ZINC000177867529 931391162 /nfs/dbraw/zinc/39/11/62/931391162.db2.gz LVKWZDHRHACUQF-INIZCTEOSA-N 0 0 356.382 3.676 20 5 FHBDRN COc1ccc(OC)c(CCC(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000177864964 931392757 /nfs/dbraw/zinc/39/27/57/931392757.db2.gz FZJYTUSRELDWBL-CQSZACIVSA-N 0 0 372.421 3.730 20 5 FHBDRN Cc1ccc2cccc(NC(=O)COc3ccc([N+](=O)[O-])c(C)c3)c2n1 ZINC000430530280 931403891 /nfs/dbraw/zinc/40/38/91/931403891.db2.gz QSBCFGJHHLROJH-UHFFFAOYSA-N 0 0 351.362 3.777 20 5 FHBDRN CCNc1ccc(C(=O)NCc2c(Cl)cccc2OC)cc1[N+](=O)[O-] ZINC000393116676 931414277 /nfs/dbraw/zinc/41/42/77/931414277.db2.gz RNPQAARIHKSYPQ-UHFFFAOYSA-N 0 0 363.801 3.619 20 5 FHBDRN C[C@@H](c1ccc(F)cc1)N(C)C(=O)COc1cc(Cl)ccc1[N+](=O)[O-] ZINC000121265245 931475662 /nfs/dbraw/zinc/47/56/62/931475662.db2.gz ZPCQFWSWCPZTNY-NSHDSACASA-N 0 0 366.776 3.986 20 5 FHBDRN COC(=O)c1ccc2nc(SCc3ccc([N+](=O)[O-])cc3F)oc2c1 ZINC000610480387 931578093 /nfs/dbraw/zinc/57/80/93/931578093.db2.gz SYHWKADYVARGGK-UHFFFAOYSA-N 0 0 362.338 3.954 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CCCO[C@@H]2CC(C)C)c1 ZINC000187383380 931588154 /nfs/dbraw/zinc/58/81/54/931588154.db2.gz CZZKBWBGWMCQAP-GDBMZVCRSA-N 0 0 352.456 3.640 20 5 FHBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])C1([C@@H]2CCCCO2)CCC1 ZINC001266677576 931607064 /nfs/dbraw/zinc/60/70/64/931607064.db2.gz LBQABWVFPSKGKV-INIZCTEOSA-N 0 0 366.845 3.646 20 5 FHBDRN Cc1noc(C)c1N(C)C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000610483240 931607077 /nfs/dbraw/zinc/60/70/77/931607077.db2.gz CCZVEUAIGLDJOG-UHFFFAOYSA-N 0 0 358.379 3.600 20 5 FHBDRN CC(C)(C)OC(=O)c1ccc(NC(=O)c2cccc([N+](=O)[O-])c2)c(F)c1 ZINC000126217383 931619937 /nfs/dbraw/zinc/61/99/37/931619937.db2.gz OZCUINWGCYUEFA-UHFFFAOYSA-N 0 0 360.341 3.942 20 5 FHBDRN C[C@@H](C(=O)N1CCN([C@@H](C)c2ccsc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000581166117 931629822 /nfs/dbraw/zinc/62/98/22/931629822.db2.gz PBPRVMJANIFVQN-CABCVRRESA-N 0 0 373.478 3.665 20 5 FHBDRN Cc1sc(CC(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)nc1C(C)C ZINC000581170959 931638361 /nfs/dbraw/zinc/63/83/61/931638361.db2.gz CPGLWQMIHOKSLY-UHFFFAOYSA-N 0 0 359.451 3.611 20 5 FHBDRN Cc1cc(C(=O)NC(C)C)ccc1NC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000581175190 931642286 /nfs/dbraw/zinc/64/22/86/931642286.db2.gz MXOCIZMXSNWQBA-CQSZACIVSA-N 0 0 369.421 3.784 20 5 FHBDRN COC(=O)c1cc(C)nc(N[C@H](C)c2ccc(SC)cc2)c1[N+](=O)[O-] ZINC000561318655 931643819 /nfs/dbraw/zinc/64/38/19/931643819.db2.gz QOKADDBXMXVGTP-LLVKDONJSA-N 0 0 361.423 3.980 20 5 FHBDRN COc1ccc(CC(=O)Nc2cc(C(F)(F)F)ccc2O)cc1[N+](=O)[O-] ZINC000610484619 931659396 /nfs/dbraw/zinc/65/93/96/931659396.db2.gz OMUQXIYIRBPDSO-UHFFFAOYSA-N 0 0 370.283 3.509 20 5 FHBDRN O=[N+]([O-])c1ccccc1-c1ccc(CN(CCCO)Cc2ccccn2)o1 ZINC000581217660 931690577 /nfs/dbraw/zinc/69/05/77/931690577.db2.gz HCYZYLCRFCFVCE-UHFFFAOYSA-N 0 0 367.405 3.634 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000156056103 931703944 /nfs/dbraw/zinc/70/39/44/931703944.db2.gz PUINALZCBDAWIG-QGZVFWFLSA-N 0 0 359.357 3.648 20 5 FHBDRN Cn1ncc2ccc(CNc3ccc([N+](=O)[O-])cc3Br)cc21 ZINC000581224912 931705107 /nfs/dbraw/zinc/70/51/07/931705107.db2.gz LHGKRFXLFBQBGM-UHFFFAOYSA-N 0 0 361.199 3.856 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[C@H](COCc2ccccc2)C1 ZINC000156071327 931721435 /nfs/dbraw/zinc/72/14/35/931721435.db2.gz RCJZPGMLNICQHQ-KRWDZBQOSA-N 0 0 369.421 3.974 20 5 FHBDRN COC(=O)c1cc([N+](=O)[O-])c(C)cc1NCc1ccc2ncccc2c1 ZINC000561326579 931727638 /nfs/dbraw/zinc/72/76/38/931727638.db2.gz XPZKAMJNTYXUIE-UHFFFAOYSA-N 0 0 351.362 3.850 20 5 FHBDRN CN(C[C@H]1CCCO[C@H]1c1ccccc1)C(=O)c1ccc([N+](=O)[O-])cc1F ZINC000050861881 931742322 /nfs/dbraw/zinc/74/23/22/931742322.db2.gz WBBRPLSAPRKZRC-BEFAXECRSA-N 0 0 372.396 3.974 20 5 FHBDRN COc1ccccc1CCC(=O)N1CCS[C@@H]1c1ccc([N+](=O)[O-])cc1 ZINC000610209936 931743100 /nfs/dbraw/zinc/74/31/00/931743100.db2.gz LIQZDQOCEUAUIX-LJQANCHMSA-N 0 0 372.446 3.810 20 5 FHBDRN COC(=O)c1cc(C)nc(N2CC[C@H](c3ccccc3)C[C@@H]2C)c1[N+](=O)[O-] ZINC000581256468 931743972 /nfs/dbraw/zinc/74/39/72/931743972.db2.gz AWMBLPRIWJSHQJ-HOCLYGCPSA-N 0 0 369.421 3.857 20 5 FHBDRN O=C(NCc1ccccc1Br)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000096731190 931755902 /nfs/dbraw/zinc/75/59/02/931755902.db2.gz AULPBECUQRNILH-UHFFFAOYSA-N 0 0 369.602 3.941 20 5 FHBDRN CN(Cc1ccc(Cl)c(F)c1)c1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1 ZINC000581268355 931760905 /nfs/dbraw/zinc/76/09/05/931760905.db2.gz PPAONSMIOHFEBX-UHFFFAOYSA-N 0 0 362.748 3.673 20 5 FHBDRN CSc1ccc(C(=O)N2CCO[C@@](C)(c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000157012074 931774382 /nfs/dbraw/zinc/77/43/82/931774382.db2.gz PPCWAIORGJRSEJ-LJQANCHMSA-N 0 0 372.446 3.705 20 5 FHBDRN CC(C)(NC(=O)c1cc(-c2ccccc2)on1)c1ccc([N+](=O)[O-])cc1 ZINC000430551474 931804140 /nfs/dbraw/zinc/80/41/40/931804140.db2.gz PYDKFNGVQNDFSP-UHFFFAOYSA-N 0 0 351.362 3.915 20 5 FHBDRN CCS[C@@H]1CC[C@@H](N(C)C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000126422960 931815200 /nfs/dbraw/zinc/81/52/00/931815200.db2.gz ZVXQBSKLNQFPKT-JGGQBBKZSA-N 0 0 351.472 3.971 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1NCc1ccccc1)N1CCC[C@@H]1CF ZINC000581329785 931841842 /nfs/dbraw/zinc/84/18/42/931841842.db2.gz FMROYEWQLRQIJQ-MRXNPFEDSA-N 0 0 357.385 3.781 20 5 FHBDRN Cc1cccc2c(CC(=O)NC(C)(C)c3ccccc3[N+](=O)[O-])c[nH]c21 ZINC000581328327 931842121 /nfs/dbraw/zinc/84/21/21/931842121.db2.gz VDQSIGIRHOLOOG-UHFFFAOYSA-N 0 0 351.406 3.979 20 5 FHBDRN CCC[C@@H](C)NC(=O)[C@H]1CCCN(c2ccc([N+](=O)[O-])c3cccnc32)C1 ZINC000050933951 931869069 /nfs/dbraw/zinc/86/90/69/931869069.db2.gz VGZZEIDFNLYXIO-CABCVRRESA-N 0 0 370.453 3.664 20 5 FHBDRN Cc1c(Br)cc(C(=O)N2C[C@@H](C)CC[C@@H]2C)cc1[N+](=O)[O-] ZINC000510392394 931888206 /nfs/dbraw/zinc/88/82/06/931888206.db2.gz DDTWQASJJRVCND-UWVGGRQHSA-N 0 0 355.232 3.926 20 5 FHBDRN C[C@H]1CN(C(=O)c2c[nH]c3ccc([N+](=O)[O-])cc32)C[C@@H](c2ccsc2)O1 ZINC000156171188 931900818 /nfs/dbraw/zinc/90/08/18/931900818.db2.gz RYGSGKGZVXIFIX-GTNSWQLSSA-N 0 0 371.418 3.740 20 5 FHBDRN O=[N+]([O-])c1ccc(NCCCc2nc(Cc3ccccc3F)no2)cc1 ZINC000544934671 931902749 /nfs/dbraw/zinc/90/27/49/931902749.db2.gz DZERXCDPKYOYBT-UHFFFAOYSA-N 0 0 356.357 3.752 20 5 FHBDRN O=C(Nc1cnns1)c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1 ZINC000477092562 931909312 /nfs/dbraw/zinc/90/93/12/931909312.db2.gz SZVGXORALASWKR-UHFFFAOYSA-N 0 0 358.404 3.850 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N[C@H]1c2ccc(F)cc2O[C@H]1C ZINC000477091415 931910627 /nfs/dbraw/zinc/91/06/27/931910627.db2.gz YQQCLTQXEQDQIT-APPDUMDISA-N 0 0 359.357 3.994 20 5 FHBDRN O=C(NC[C@H]1CCO[C@@H]1c1ccccc1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000430572962 931913753 /nfs/dbraw/zinc/91/37/53/931913753.db2.gz LBNJWZFHMJUOTD-CXAGYDPISA-N 0 0 360.797 3.756 20 5 FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCC[C@H](C)C1 ZINC000135121060 931942977 /nfs/dbraw/zinc/94/29/77/931942977.db2.gz CIQWWFXOYKURAK-QWHCGFSZSA-N 0 0 352.456 3.642 20 5 FHBDRN C[C@H](C(=O)NC[C@H]1CCO[C@H]1c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000581404059 931966180 /nfs/dbraw/zinc/96/61/80/931966180.db2.gz HYCJQGBWEDRQEJ-YJLNNSPDSA-N 0 0 354.406 3.592 20 5 FHBDRN CN(Cc1ccc(Cl)s1)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000060471334 931966770 /nfs/dbraw/zinc/96/67/70/931966770.db2.gz DMUZXPYJSWHJNJ-UHFFFAOYSA-N 0 0 364.814 3.992 20 5 FHBDRN O=C(COC(=O)c1ccc(F)c(C(F)(F)F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000728334283 932035292 /nfs/dbraw/zinc/03/52/92/932035292.db2.gz WNUNZQLTFDGZLZ-UHFFFAOYSA-N 0 0 371.242 3.792 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)N1CC[C@H](Cc2ccc(F)cc2)C1 ZINC000135190816 932042865 /nfs/dbraw/zinc/04/28/65/932042865.db2.gz KDKAEMQHKCFNFQ-OAHLLOKOSA-N 0 0 374.437 3.917 20 5 FHBDRN COc1ccc(NC(C)=O)c(NC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)c1 ZINC000187413008 932043651 /nfs/dbraw/zinc/04/36/51/932043651.db2.gz NJNKDJVWXBQQMH-UHFFFAOYSA-N 0 0 371.393 3.938 20 5 FHBDRN Cc1cc(C)c(-c2csc(NC(=O)c3cc([N+](=O)[O-])nn3C)n2)c(C)c1 ZINC000548172924 932064542 /nfs/dbraw/zinc/06/45/42/932064542.db2.gz YEOKDNATDVSPHB-UHFFFAOYSA-N 0 0 371.422 3.629 20 5 FHBDRN CC(C)c1csc(NC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)n1 ZINC000033229243 932068473 /nfs/dbraw/zinc/06/84/73/932068473.db2.gz XFNNYJSJYLTLKY-UHFFFAOYSA-N 0 0 357.395 3.613 20 5 FHBDRN O=[N+]([O-])c1ccccc1CN(Cc1nc(-c2ccccc2)no1)C1CC1 ZINC000135239499 932079357 /nfs/dbraw/zinc/07/93/57/932079357.db2.gz PECRNPOPPUJKQT-UHFFFAOYSA-N 0 0 350.378 3.809 20 5 FHBDRN CCOCCC1(CNC(=O)c2c([N+](=O)[O-])cccc2C(F)(F)F)CC1 ZINC000581456554 932090233 /nfs/dbraw/zinc/09/02/33/932090233.db2.gz KEMOBALRXCYZKI-UHFFFAOYSA-N 0 0 360.332 3.550 20 5 FHBDRN CCS[C@H]1CCC[C@H]1NC(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000178031205 932140420 /nfs/dbraw/zinc/14/04/20/932140420.db2.gz VOSQLKRDCJAPSH-CVEARBPZSA-N 0 0 351.472 3.577 20 5 FHBDRN Cc1nc2ccccc2c2c(NC(=O)C[C@@H]3COC(=O)C3)c3ccccc3n21 ZINC000160927057 932182816 /nfs/dbraw/zinc/18/28/16/932182816.db2.gz IDFCLGAQDJIELH-AWEZNQCLSA-N 0 0 373.412 3.841 20 5 FHBDRN CC[C@@H](CNc1ccc(C(=O)Nc2ccc(C)cc2)cc1[N+](=O)[O-])OC ZINC000581521246 932200359 /nfs/dbraw/zinc/20/03/59/932200359.db2.gz MWFWCWDWMNCPTP-INIZCTEOSA-N 0 0 357.410 3.992 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)Nc2cnc(Cl)c(C)c2)cc1OC ZINC000178069653 932268330 /nfs/dbraw/zinc/26/83/30/932268330.db2.gz RMTJACXXKCFFLY-UHFFFAOYSA-N 0 0 365.773 3.611 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CCCc3sccc3C2)c(Br)c1 ZINC000610512395 932283486 /nfs/dbraw/zinc/28/34/86/932283486.db2.gz WBRGSJRMMJVQHH-UHFFFAOYSA-N 0 0 354.229 3.767 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@H]2CCCOc3ccccc32)c1 ZINC000157273251 932285359 /nfs/dbraw/zinc/28/53/59/932285359.db2.gz ANZQVQZYHHRTJQ-INIZCTEOSA-N 0 0 370.405 3.702 20 5 FHBDRN C[C@H]1c2ccsc2CCN1c1ncc([N+](=O)[O-])cc1Br ZINC000610512188 932288251 /nfs/dbraw/zinc/28/82/51/932288251.db2.gz XCGWEZQCSUROJZ-QMMMGPOBSA-N 0 0 354.229 3.938 20 5 FHBDRN C[C@@H]1c2ccsc2CCN1c1ncc([N+](=O)[O-])cc1Br ZINC000610512187 932288680 /nfs/dbraw/zinc/28/86/80/932288680.db2.gz XCGWEZQCSUROJZ-MRVPVSSYSA-N 0 0 354.229 3.938 20 5 FHBDRN COC(=O)c1cc(C(=O)N2CC(C)(C)[C@@H]2c2cccs2)cc([N+](=O)[O-])c1 ZINC000581599916 932295766 /nfs/dbraw/zinc/29/57/66/932295766.db2.gz LLGFQOLRJXJABP-HNNXBMFYSA-N 0 0 374.418 3.666 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CC[C@H]2c2cccc(F)c2)c(Br)c1 ZINC000610512596 932313144 /nfs/dbraw/zinc/31/31/44/932313144.db2.gz QBSULTDCFYBKOQ-ZDUSSCGKSA-N 0 0 352.163 3.843 20 5 FHBDRN COc1ccccc1[C@H](CNC(=O)c1ccc([N+](=O)[O-])cc1C)OC(C)C ZINC000187422655 932316408 /nfs/dbraw/zinc/31/64/08/932316408.db2.gz PPSSHKGHPYSZOA-IBGZPJMESA-N 0 0 372.421 3.808 20 5 FHBDRN CCn1c(C)nc([N+](=O)[O-])c1NCc1ccc(OC)c(Br)c1 ZINC000581628808 932348417 /nfs/dbraw/zinc/34/84/17/932348417.db2.gz PBXPDDZWGMMJQK-UHFFFAOYSA-N 0 0 369.219 3.503 20 5 FHBDRN COc1c(C(=O)N(CCC(F)(F)F)CC(F)(F)F)cccc1[N+](=O)[O-] ZINC000477147807 932353341 /nfs/dbraw/zinc/35/33/41/932353341.db2.gz CYODBENESRCPDJ-UHFFFAOYSA-N 0 0 374.237 3.560 20 5 FHBDRN CCN(C[C@@H](O)c1ccc(C)cc1)C(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000178084654 932358181 /nfs/dbraw/zinc/35/81/81/932358181.db2.gz WKDAZJNAAAHZBF-QGZVFWFLSA-N 0 0 362.813 3.752 20 5 FHBDRN Cc1ccccc1-c1nc(COC(=O)c2cccc(C)c2[N+](=O)[O-])no1 ZINC000160977756 932358511 /nfs/dbraw/zinc/35/85/11/932358511.db2.gz IFYFPLDTYRLKPS-UHFFFAOYSA-N 0 0 353.334 3.619 20 5 FHBDRN CCN(C(=O)COc1ncc(C)cc1[N+](=O)[O-])c1cccc2ccccc21 ZINC000477157629 932360700 /nfs/dbraw/zinc/36/07/00/932360700.db2.gz RRFFNWPTHQSCBB-UHFFFAOYSA-N 0 0 365.389 3.883 20 5 FHBDRN Cc1c(NC(=O)N2CCC23CCOCC3)cc([N+](=O)[O-])cc1C(F)(F)F ZINC000933343117 932360741 /nfs/dbraw/zinc/36/07/41/932360741.db2.gz OXXNWWZYYLMXKP-UHFFFAOYSA-N 0 0 373.331 3.709 20 5 FHBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2C[C@H](c3ccccc3)[C@H]3CCC[C@H]32)cc1 ZINC000510440193 932361050 /nfs/dbraw/zinc/36/10/50/932361050.db2.gz BQYLCYFJZAHADY-GUDVDZBRSA-N 0 0 372.446 3.552 20 5 FHBDRN CCc1cc(NC(=O)[C@H](CC)OC2CCCC2)c2cc([N+](=O)[O-])ccc2n1 ZINC001266777038 932361800 /nfs/dbraw/zinc/36/18/00/932361800.db2.gz JDGFTBIHMGRNDR-IBGZPJMESA-N 0 0 371.437 3.804 20 5 FHBDRN Cc1c(NC(=O)N[C@@H]2CCO[C@@H](C)C2)cc([N+](=O)[O-])cc1C(F)(F)F ZINC000933344207 932362560 /nfs/dbraw/zinc/36/25/60/932362560.db2.gz YIBUAJUFRBYWIN-WCBMZHEXSA-N 0 0 361.320 3.611 20 5 FHBDRN Cc1c(NC(=O)N2CCC3(CCO3)CC2)cc([N+](=O)[O-])cc1C(F)(F)F ZINC000933343646 932362756 /nfs/dbraw/zinc/36/27/56/932362756.db2.gz HUVWZRHVDZMHAI-UHFFFAOYSA-N 0 0 373.331 3.709 20 5 FHBDRN O=C(Cc1csc(-c2cccs2)n1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000247343730 932374866 /nfs/dbraw/zinc/37/48/66/932374866.db2.gz AXZQBBDOLUKQKV-UHFFFAOYSA-N 0 0 371.443 3.912 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N[C@H]2CCCCC2(C)C)cc1OC ZINC000157365762 932390107 /nfs/dbraw/zinc/39/01/07/932390107.db2.gz QBZDPUOVMOQLNS-INIZCTEOSA-N 0 0 350.415 3.701 20 5 FHBDRN Cn1cc(-c2cccc(CNC(=O)c3ccc(Cl)cc3[N+](=O)[O-])c2)cn1 ZINC000126725629 932399814 /nfs/dbraw/zinc/39/98/14/932399814.db2.gz RBKVFNRDKQEKGQ-UHFFFAOYSA-N 0 0 370.796 3.579 20 5 FHBDRN O=[N+]([O-])c1cc(CSc2nnc3ccccn32)ccc1Br ZINC000157875460 932441652 /nfs/dbraw/zinc/44/16/52/932441652.db2.gz NABACMBUQZVTSH-UHFFFAOYSA-N 0 0 365.212 3.692 20 5 FHBDRN O=c1[nH]c(-c2ccc(Cn3cccn3)cc2)nc2cc3ccccc3cc21 ZINC000077251960 932444516 /nfs/dbraw/zinc/44/45/16/932444516.db2.gz LGNMHCGXERDRFY-UHFFFAOYSA-N 0 0 352.397 3.988 20 5 FHBDRN CC(C)C[C@H]1OCCC[C@@H]1NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000477277616 932445375 /nfs/dbraw/zinc/44/53/75/932445375.db2.gz DTPQJKQZYRUFKW-SWLSCSKDSA-N 0 0 372.368 3.520 20 5 FHBDRN COC1(CNC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)CCC(C)CC1 ZINC000477298465 932456647 /nfs/dbraw/zinc/45/66/47/932456647.db2.gz UJSMDOQFWJLFDE-FVRSWCFKSA-N 0 0 366.483 3.787 20 5 FHBDRN COC1(CNC(=O)c2c([N+](=O)[O-])cccc2C(F)(F)F)CCC(C)CC1 ZINC000477319718 932470679 /nfs/dbraw/zinc/47/06/79/932470679.db2.gz IQYJDYNMCUSDBG-UHFFFAOYSA-N 0 0 374.359 3.939 20 5 FHBDRN CC[C@H](NC(=O)c1ccc(-n2cccn2)c(C)c1)c1cccc([N+](=O)[O-])c1 ZINC001266794753 932471585 /nfs/dbraw/zinc/47/15/85/932471585.db2.gz GIKWCBKAPHIQSD-SFHVURJKSA-N 0 0 364.405 3.970 20 5 FHBDRN COC1(CNC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)CCC(C)CC1 ZINC000477330979 932481021 /nfs/dbraw/zinc/48/10/21/932481021.db2.gz OYHRKMMIJLBIBK-UHFFFAOYSA-N 0 0 372.368 3.521 20 5 FHBDRN CN(C(=O)c1csc([N+](=O)[O-])c1)[C@H]1C[C@@H](Oc2ccccc2)C1(C)C ZINC000581687114 932497531 /nfs/dbraw/zinc/49/75/31/932497531.db2.gz RJERTEGRHGRRDO-LSDHHAIUSA-N 0 0 360.435 3.974 20 5 FHBDRN Nc1c(C(=O)N2CC=C(c3cccc(Cl)c3)CC2)cccc1[N+](=O)[O-] ZINC000477360560 932501392 /nfs/dbraw/zinc/50/13/92/932501392.db2.gz YFMUERJKDVJCBB-UHFFFAOYSA-N 0 0 357.797 3.760 20 5 FHBDRN CCS[C@H]1CCC[C@H]1NC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000178106173 932509698 /nfs/dbraw/zinc/50/96/98/932509698.db2.gz QNGPQEUSKDXGRZ-OLZOCXBDSA-N 0 0 373.272 3.761 20 5 FHBDRN CCS[C@@H]1CCC[C@H]1NC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000178106158 932509729 /nfs/dbraw/zinc/50/97/29/932509729.db2.gz QNGPQEUSKDXGRZ-CHWSQXEVSA-N 0 0 373.272 3.761 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H](C)c1ccncc1 ZINC000610530415 932519183 /nfs/dbraw/zinc/51/91/83/932519183.db2.gz LQRSTBHPDQIPGM-OAHLLOKOSA-N 0 0 356.426 3.714 20 5 FHBDRN CC(=O)Nc1cccc(NC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)c1 ZINC000023120505 932534690 /nfs/dbraw/zinc/53/46/90/932534690.db2.gz ATYSHOLQVQKVHU-LLVKDONJSA-N 0 0 359.407 3.673 20 5 FHBDRN COc1ccc([C@@H](C)N(C)C(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)cc1 ZINC000129991538 932539111 /nfs/dbraw/zinc/53/91/11/932539111.db2.gz RVFDBDDDVQBZKM-GFCCVEGCSA-N 0 0 353.378 3.918 20 5 FHBDRN CCS[C@@H]1CCC[C@@H]1NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000178109096 932541892 /nfs/dbraw/zinc/54/18/92/932541892.db2.gz KEMJAIKQRAEQTM-DOTOQJQBSA-N 0 0 363.483 3.599 20 5 FHBDRN Cc1coc(-c2cccc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3C)c2)n1 ZINC000126789144 932547598 /nfs/dbraw/zinc/54/75/98/932547598.db2.gz ZKJHOVMWOJJZQW-UHFFFAOYSA-N 0 0 373.390 3.667 20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])Nc1ccc(F)cc1NC1CC1 ZINC000157441823 932550656 /nfs/dbraw/zinc/55/06/56/932550656.db2.gz DOXQCOVMGHKHEG-UHFFFAOYSA-N 0 0 358.373 3.749 20 5 FHBDRN Cc1c(NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)cccc1N(C)C ZINC000781715407 932574109 /nfs/dbraw/zinc/57/41/09/932574109.db2.gz KHFRNNJAEXRRDT-UHFFFAOYSA-N 0 0 365.336 3.823 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCO[C@H](c3ccc(F)cc3)C2)c(OC(F)F)c1 ZINC000302050851 932574546 /nfs/dbraw/zinc/57/45/46/932574546.db2.gz NSMZNZJBVOSWNN-INIZCTEOSA-N 0 0 368.311 3.913 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)N(C)[C@H](C)C1CCCCC1 ZINC000559021356 932574956 /nfs/dbraw/zinc/57/49/56/932574956.db2.gz VXCCFJIAJGIUBP-CQSZACIVSA-N 0 0 361.442 3.577 20 5 FHBDRN O=[N+]([O-])c1ccc(NCc2cc(Cl)c3c(c2)OCCO3)c([N+](=O)[O-])c1 ZINC000097286523 932582484 /nfs/dbraw/zinc/58/24/84/932582484.db2.gz LBNVQJLOECRHMA-UHFFFAOYSA-N 0 0 365.729 3.540 20 5 FHBDRN Cc1ccc([C@H]2CCN(C(=O)NCc3ccc([N+](=O)[O-])cc3)C2)c(C)c1 ZINC000471687999 932609536 /nfs/dbraw/zinc/60/95/36/932609536.db2.gz ZORLXOFWLDLDKX-KRWDZBQOSA-N 0 0 353.422 3.911 20 5 FHBDRN O=C(N1CCc2ccccc21)N1CCS[C@@H]1c1ccc([N+](=O)[O-])cc1 ZINC000477486613 932647400 /nfs/dbraw/zinc/64/74/00/932647400.db2.gz HMHFUVBDSVNDJF-QGZVFWFLSA-N 0 0 355.419 3.825 20 5 FHBDRN COc1cccc(CNC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1 ZINC000098022656 932665557 /nfs/dbraw/zinc/66/55/57/932665557.db2.gz ANIACFHBZNSWTP-UHFFFAOYSA-N 0 0 357.410 3.724 20 5 FHBDRN CC1(C)[C@H](NC(=O)Cc2ccccc2[N+](=O)[O-])C[C@@H]1OCc1ccccc1 ZINC000471713959 932689300 /nfs/dbraw/zinc/68/93/00/932689300.db2.gz OWCVFWCQXQLBOJ-MOPGFXCFSA-N 0 0 368.433 3.637 20 5 FHBDRN COc1ccc(F)c(NC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000477569582 932695334 /nfs/dbraw/zinc/69/53/34/932695334.db2.gz GTBRPPFVRXPJQV-UHFFFAOYSA-N 0 0 367.764 3.760 20 5 FHBDRN C[C@H]1CCc2c(F)cccc2[C@@H]1NC(=O)COc1ccccc1[N+](=O)[O-] ZINC000430660298 932697687 /nfs/dbraw/zinc/69/76/87/932697687.db2.gz DAELLFFTCMFXSK-HXPMCKFVSA-N 0 0 358.369 3.553 20 5 FHBDRN COc1ccc2c(c1)[C@H](NC(=O)CSc1ccc([N+](=O)[O-])cc1)CCC2 ZINC001266821799 932697809 /nfs/dbraw/zinc/69/78/09/932697809.db2.gz YUANCTBDPJDKOV-GOSISDBHSA-N 0 0 372.446 3.889 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)Nc1ccccc1OCC(F)F ZINC000178154187 932702366 /nfs/dbraw/zinc/70/23/66/932702366.db2.gz OFVUOBCTKVXMIM-UHFFFAOYSA-N 0 0 367.308 3.891 20 5 FHBDRN COc1ccc(NC(=O)CN2CCC[C@H]2c2cccc(C)c2)c([N+](=O)[O-])c1 ZINC000055911134 932737149 /nfs/dbraw/zinc/73/71/49/932737149.db2.gz HVQXLWHMQSNNBB-SFHVURJKSA-N 0 0 369.421 3.687 20 5 FHBDRN CCCc1cc(C(=O)N2CCS[C@H]2c2ccc([N+](=O)[O-])cc2)cc(=O)[nH]1 ZINC000933505122 932739949 /nfs/dbraw/zinc/73/99/49/932739949.db2.gz WIFKVJPEPKOHCE-SFHVURJKSA-N 0 0 373.434 3.536 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N(C)[C@H](COC)Cc1ccccc1 ZINC000581854364 932747099 /nfs/dbraw/zinc/74/70/99/932747099.db2.gz XDAQAFRENZCPRN-SFHVURJKSA-N 0 0 371.437 3.879 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(NCc2cccc(Cl)c2Cl)n1 ZINC000572866235 932767038 /nfs/dbraw/zinc/76/70/38/932767038.db2.gz YWOCRVRBKKBFMM-UHFFFAOYSA-N 0 0 356.165 3.695 20 5 FHBDRN O=C(c1coc(C2CCCCC2)n1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000548277350 932798058 /nfs/dbraw/zinc/79/80/58/932798058.db2.gz YWKCGCBGIAAUEB-UHFFFAOYSA-N 0 0 355.394 3.829 20 5 FHBDRN CC[C@H](OC(=O)c1ccc(Cn2ccnn2)cc1)c1cccc([N+](=O)[O-])c1 ZINC001266835773 932811068 /nfs/dbraw/zinc/81/10/68/932811068.db2.gz QCAOBHRZOHSCAI-SFHVURJKSA-N 0 0 366.377 3.543 20 5 FHBDRN CCc1nn(C)c(Cl)c1C(=O)O[C@@H](CC)c1cccc([N+](=O)[O-])c1 ZINC001266835707 932811237 /nfs/dbraw/zinc/81/12/37/932811237.db2.gz NYQUBRGHFJCNOZ-ZDUSSCGKSA-N 0 0 351.790 3.852 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1C ZINC001266834922 932813301 /nfs/dbraw/zinc/81/33/01/932813301.db2.gz IOPLEDXVXVZKEE-UHFFFAOYSA-N 0 0 369.377 3.925 20 5 FHBDRN COc1ccc(C[C@@H](C)C(=O)N2CCCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000135291833 932826848 /nfs/dbraw/zinc/82/68/48/932826848.db2.gz LCFBFMPCNMSMBR-CQSZACIVSA-N 0 0 354.406 3.761 20 5 FHBDRN CC(=O)OCCCc1cccc(NC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)c1 ZINC000588433204 932829325 /nfs/dbraw/zinc/82/93/25/932829325.db2.gz WSJSLXVYWCSNIT-XFXZXTDPSA-N 0 0 368.389 3.742 20 5 FHBDRN C[C@H]1C[C@@H](NC(=O)OC(C)(C)C)CCN1Cc1c(F)cccc1[N+](=O)[O-] ZINC000134661429 932837419 /nfs/dbraw/zinc/83/74/19/932837419.db2.gz DLVIPOHQEJKRMR-STQMWFEESA-N 0 0 367.421 3.612 20 5 FHBDRN C[C@H]1CCc2c(F)cccc2[C@H]1NC(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000430671093 932851692 /nfs/dbraw/zinc/85/16/92/932851692.db2.gz WAZDWNGKPRRZMN-RBZFPXEDSA-N 0 0 372.396 3.943 20 5 FHBDRN C[C@H](c1ccccc1)N(C1CC1)S(=O)(=O)CCc1ccc([N+](=O)[O-])cc1 ZINC000510476689 932856195 /nfs/dbraw/zinc/85/61/95/932856195.db2.gz YNSFAOKTLOJWKD-OAHLLOKOSA-N 0 0 374.462 3.693 20 5 FHBDRN Cc1cc(OCC(=O)N2C[C@@H](c3ccccc3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000430673969 932856403 /nfs/dbraw/zinc/85/64/03/932856403.db2.gz AOPWJPAEJJDSIL-WBVHZDCISA-N 0 0 354.406 3.687 20 5 FHBDRN O=C1CCCCN1C1CCN(c2c(Cl)cc([N+](=O)[O-])cc2Cl)CC1 ZINC000127340975 932864231 /nfs/dbraw/zinc/86/42/31/932864231.db2.gz UALMZBXBMAVXGD-UHFFFAOYSA-N 0 0 372.252 3.883 20 5 FHBDRN CCc1ccc(-c2nc(-c3cnn4c3nc(C)cc4C)no2)cc1[N+](=O)[O-] ZINC000178210686 932882186 /nfs/dbraw/zinc/88/21/86/932882186.db2.gz CDHGIYSIXQFKHT-UHFFFAOYSA-N 0 0 364.365 3.534 20 5 FHBDRN CC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1N)c1ccccc1OC(F)F ZINC000175966549 932885537 /nfs/dbraw/zinc/88/55/37/932885537.db2.gz BPQIRODNWKSYPR-GFCCVEGCSA-N 0 0 365.336 3.660 20 5 FHBDRN C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)Nc1cccc2ccn(C)c21 ZINC000471778326 932887385 /nfs/dbraw/zinc/88/73/85/932887385.db2.gz FFIQXLADWDTGPL-ZDUSSCGKSA-N 0 0 352.394 3.916 20 5 FHBDRN C[C@@H](NC(=O)NCCc1c[nH]c2cc(F)ccc12)c1cccc([N+](=O)[O-])c1 ZINC000051279178 932901579 /nfs/dbraw/zinc/90/15/79/932901579.db2.gz LQYLEBBQIQQCBI-GFCCVEGCSA-N 0 0 370.384 3.818 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)N2CCC[C@H](OCC3CC3)C2)cc1[N+](=O)[O-] ZINC000548308054 932912969 /nfs/dbraw/zinc/91/29/69/932912969.db2.gz QPSTYSRNKZXHHG-INIZCTEOSA-N 0 0 360.454 3.924 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(C(=O)NC2CC2)cc1 ZINC000588436121 932941797 /nfs/dbraw/zinc/94/17/97/932941797.db2.gz WNSCLLXXOCFWOM-SEYXRHQNSA-N 0 0 365.389 3.529 20 5 FHBDRN COc1ccc([C@H](C)CCNC(=O)NCc2cccc([N+](=O)[O-])c2)cc1 ZINC000175976531 932945430 /nfs/dbraw/zinc/94/54/30/932945430.db2.gz SRDKKVNMMULCMX-CQSZACIVSA-N 0 0 357.410 3.596 20 5 FHBDRN CCSCC[C@@H](C)Nc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1 ZINC000135337352 932967084 /nfs/dbraw/zinc/96/70/84/932967084.db2.gz HJANIGCRXVHLNM-CYBMUJFWSA-N 0 0 351.472 3.774 20 5 FHBDRN O=[N+]([O-])c1cccc(Cc2nc(-c3ccc(Br)o3)no2)c1 ZINC000178267304 933003876 /nfs/dbraw/zinc/00/38/76/933003876.db2.gz GZOSHDPELBQSGU-UHFFFAOYSA-N 0 0 350.128 3.591 20 5 FHBDRN CSc1ccncc1NC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000610960553 933010724 /nfs/dbraw/zinc/01/07/24/933010724.db2.gz QTWDRFHLHSDGTE-UHFFFAOYSA-N 0 0 357.313 3.983 20 5 FHBDRN Cc1c([N+](=O)[O-])cc(C(=O)Nc2ccccc2N2CCCC2)cc1[N+](=O)[O-] ZINC000022641954 933018592 /nfs/dbraw/zinc/01/85/92/933018592.db2.gz OVFIWQUZOTWGGI-UHFFFAOYSA-N 0 0 370.365 3.664 20 5 FHBDRN O=C(Cc1ccc(O)cc1Cl)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000178280212 933021774 /nfs/dbraw/zinc/02/17/74/933021774.db2.gz ICHUQZOJRHRBQZ-UHFFFAOYSA-N 0 0 362.813 3.635 20 5 FHBDRN COC(=O)c1ccc(NC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)c(F)c1 ZINC000187623304 933066705 /nfs/dbraw/zinc/06/67/05/933066705.db2.gz IPIZSQUMOHPGIU-UHFFFAOYSA-N 0 0 360.341 3.896 20 5 FHBDRN O=[N+]([O-])c1ccccc1/C=C\CN1CCN(C/C=C/c2ccccc2)CC1 ZINC000033324103 933068814 /nfs/dbraw/zinc/06/88/14/933068814.db2.gz NRGYNZQRBTVEKK-NGSBCVAZSA-N 0 0 363.461 3.939 20 5 FHBDRN O=C(c1cccc(OC(F)(F)F)c1)N1CCc2c1cccc2[N+](=O)[O-] ZINC000178303027 933070439 /nfs/dbraw/zinc/07/04/39/933070439.db2.gz LWZZKZHSBDUGJJ-UHFFFAOYSA-N 0 0 352.268 3.696 20 5 FHBDRN COC(=O)Nc1ccc(NC(=O)C(C)=Cc2ccc([N+](=O)[O-])cc2)cc1F ZINC000588441725 933074013 /nfs/dbraw/zinc/07/40/13/933074013.db2.gz ZGSKEUVPOMZOJO-LUAWRHEFSA-N 0 0 373.340 3.954 20 5 FHBDRN CSc1ccccc1C(=O)O[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000023982100 933104374 /nfs/dbraw/zinc/10/43/74/933104374.db2.gz XNJVJSBROLNLNM-LBPRGKRZSA-N 0 0 374.418 3.809 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N1CCO[C@H](c2cccc(F)c2)C1 ZINC000588445132 933110956 /nfs/dbraw/zinc/11/09/56/933110956.db2.gz LGNNSBGQWITMTO-RNUYOQPASA-N 0 0 370.380 3.737 20 5 FHBDRN C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)NCCCCc1nc(C)cs1 ZINC000588445067 933110969 /nfs/dbraw/zinc/11/09/69/933110969.db2.gz VCGPCYRDPFPGJM-ACCUITESSA-N 0 0 359.451 3.902 20 5 FHBDRN CC(=O)N(C)c1ccc(OCc2coc(-c3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000134707496 933123408 /nfs/dbraw/zinc/12/34/08/933123408.db2.gz AYYHYRKGTHUEHJ-UHFFFAOYSA-N 0 0 367.361 3.812 20 5 FHBDRN O=C(/C=C\c1ccnc(Cl)c1)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000255395526 933148234 /nfs/dbraw/zinc/14/82/34/933148234.db2.gz GGFJFEVJJMLLFS-RJRFIUFISA-N 0 0 369.711 3.897 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N(C)[C@@H](C)Cc1ccc(O)cc1 ZINC000588446885 933163709 /nfs/dbraw/zinc/16/37/09/933163709.db2.gz QSTHMIBTJHEQFN-ZSMUJPCHSA-N 0 0 354.406 3.793 20 5 FHBDRN C[C@@H]1CC[C@H](c2ccccc2)N(S(=O)(=O)Cc2cccc([N+](=O)[O-])c2)C1 ZINC000510506653 933167990 /nfs/dbraw/zinc/16/79/90/933167990.db2.gz BEUFXUJSXUSTSE-DNVCBOLYSA-N 0 0 374.462 3.898 20 5 FHBDRN Cc1cc(S(=O)(=O)N([C@H](C)c2ccccc2)C2CC2)ccc1[N+](=O)[O-] ZINC000510519594 933185177 /nfs/dbraw/zinc/18/51/77/933185177.db2.gz UTUKFNOHPCFFGX-CQSZACIVSA-N 0 0 360.435 3.818 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N1CC[C@H](c2ccccc2C)C1 ZINC000510545722 933210799 /nfs/dbraw/zinc/21/07/99/933210799.db2.gz MJRCLRRLEKQUMQ-HNNXBMFYSA-N 0 0 369.421 3.611 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)NCC[C@@H]2CCCC[C@@H]2C)cc1OC ZINC000510547242 933211404 /nfs/dbraw/zinc/21/14/04/933211404.db2.gz OKAYIQAWFHCHSB-KBPBESRZSA-N 0 0 364.442 3.948 20 5 FHBDRN C[C@H](c1ccccc1)N(C1CC1)S(=O)(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000510562082 933227505 /nfs/dbraw/zinc/22/75/05/933227505.db2.gz ZETKIOXIYNHZGX-GFCCVEGCSA-N 0 0 364.398 3.648 20 5 FHBDRN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1C[C@H](C)O[C@]2(CCO[C@H](C)C2)C1 ZINC000430780865 933233230 /nfs/dbraw/zinc/23/32/30/933233230.db2.gz PPTJTRAFSDEPFE-QPXHVOONSA-N 0 0 360.454 3.657 20 5 FHBDRN Cc1cc(OCC(=O)N(C)Cc2ccc(F)c(Cl)c2)ccc1[N+](=O)[O-] ZINC000430796161 933243975 /nfs/dbraw/zinc/24/39/75/933243975.db2.gz JMCIIVBZHQJJIC-UHFFFAOYSA-N 0 0 366.776 3.733 20 5 FHBDRN CCN(Cc1c[nH]c2ccccc12)C(=O)COc1ccc([N+](=O)[O-])c(C)c1 ZINC000430820732 933261724 /nfs/dbraw/zinc/26/17/24/933261724.db2.gz LDUYATKRWUQUDZ-UHFFFAOYSA-N 0 0 367.405 3.812 20 5 FHBDRN O=C(Nc1cccc(-c2noc(C3CC3)n2)c1)c1cccc([N+](=O)[O-])c1 ZINC000088234929 933269441 /nfs/dbraw/zinc/26/94/41/933269441.db2.gz LCKSEYRXWHJNHJ-UHFFFAOYSA-N 0 0 350.334 3.775 20 5 FHBDRN Cc1cc(OCC(=O)N2CCC(F)(c3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000430825437 933272232 /nfs/dbraw/zinc/27/22/32/933272232.db2.gz ZHIAXYYYPMPUPO-UHFFFAOYSA-N 0 0 372.396 3.769 20 5 FHBDRN O=[N+]([O-])c1ccc(OCCCN2CCO[C@]3(CCc4ccccc43)C2)cc1 ZINC000510640208 933335662 /nfs/dbraw/zinc/33/56/62/933335662.db2.gz ZGZACYQWEHXZGH-OAQYLSRUSA-N 0 0 368.433 3.538 20 5 FHBDRN CC(C)(NC(=O)c1cc(-c2ccccc2)n[nH]1)c1ccc([N+](=O)[O-])cc1 ZINC000430888226 933366398 /nfs/dbraw/zinc/36/63/98/933366398.db2.gz IKCVVUJVPGWETJ-UHFFFAOYSA-N 0 0 350.378 3.650 20 5 FHBDRN Cc1cc(O[C@H](C)C(=O)N2CCc3cc([N+](=O)[O-])ccc32)ccc1Cl ZINC000510661806 933378624 /nfs/dbraw/zinc/37/86/24/933378624.db2.gz AXPPHBUZBSTLMH-GFCCVEGCSA-N 0 0 360.797 3.913 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)NCc1ccccc1-n1ccnc1 ZINC000588448091 933383499 /nfs/dbraw/zinc/38/34/99/933383499.db2.gz GPCWIOZRFAWQEH-QINSGFPZSA-N 0 0 362.389 3.500 20 5 FHBDRN C[C@@H]1CC[C@@H](NC(=O)c2ccc(Br)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000430924603 933422892 /nfs/dbraw/zinc/42/28/92/933422892.db2.gz AUQCPAWTIDSDIB-GIPNMCIBSA-N 0 0 355.232 3.912 20 5 FHBDRN Cc1ccc(C[C@H](C)NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)s1 ZINC000135388924 933445099 /nfs/dbraw/zinc/44/50/99/933445099.db2.gz DVDXPMZXBKBDAR-NSHDSACASA-N 0 0 357.435 3.736 20 5 FHBDRN COc1ccc(COCCC(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000610599264 933491349 /nfs/dbraw/zinc/49/13/49/933491349.db2.gz BMOGIZMHFWAGRS-OAHLLOKOSA-N 0 0 372.421 3.696 20 5 FHBDRN COc1ccc2c(ccn2CC(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000610599298 933491565 /nfs/dbraw/zinc/49/15/65/933491565.db2.gz HJIZQDKHODQNIQ-CQSZACIVSA-N 0 0 367.405 3.744 20 5 FHBDRN C[C@H](NC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)c1ccccc1Cl ZINC000109982575 933504700 /nfs/dbraw/zinc/50/47/00/933504700.db2.gz TTYQIFWNDRZGFG-JTQLQIEISA-N 0 0 371.780 3.581 20 5 FHBDRN COc1ccc(CN2C[C@H](C(F)(F)F)[C@H](C(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000610604864 933514597 /nfs/dbraw/zinc/51/45/97/933514597.db2.gz QDJWXOUKJZUCMU-AOOOYVTPSA-N 0 0 372.265 3.776 20 5 FHBDRN O=C(COc1ccccc1[N+](=O)[O-])Nc1ccc(CC(F)(F)F)cc1 ZINC000127374320 933517045 /nfs/dbraw/zinc/51/70/45/933517045.db2.gz LWJQMKMRWNVSKK-UHFFFAOYSA-N 0 0 354.284 3.717 20 5 FHBDRN CC(C)[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)c2ccccc2N1 ZINC000176087047 933519925 /nfs/dbraw/zinc/51/99/25/933519925.db2.gz YIRFQIOFYUKOJU-INIZCTEOSA-N 0 0 370.365 3.600 20 5 FHBDRN COc1ccc(C)cc1[C@@H](C)NC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000121598798 933548428 /nfs/dbraw/zinc/54/84/28/933548428.db2.gz YAKCZCJBMLCKKQ-CQSZACIVSA-N 0 0 369.421 3.741 20 5 FHBDRN Cc1ccc(C(=O)NCCc2ccccc2[N+](=O)[O-])c(Br)c1 ZINC000548418373 933573681 /nfs/dbraw/zinc/57/36/81/933573681.db2.gz NLHIQAMQCHCAJU-UHFFFAOYSA-N 0 0 363.211 3.638 20 5 FHBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)NC[C@@H]1CCCC[C@@H]1C(F)(F)F ZINC000611147933 933590471 /nfs/dbraw/zinc/59/04/71/933590471.db2.gz DCYJPOJHHMPCEV-ZFWWWQNUSA-N 0 0 373.375 3.805 20 5 FHBDRN CC(C)Cn1ncc(NC(=O)c2ccc(F)cc2[N+](=O)[O-])c1C(F)F ZINC000535657417 933601870 /nfs/dbraw/zinc/60/18/70/933601870.db2.gz DQBTUNLXRBRFKU-UHFFFAOYSA-N 0 0 356.304 3.776 20 5 FHBDRN CC[C@H](NC(=O)CCn1nc(C)c([N+](=O)[O-])c1C)c1ccc(Cl)s1 ZINC000510751545 933629419 /nfs/dbraw/zinc/62/94/19/933629419.db2.gz PJUJUOHHBJONHE-NSHDSACASA-N 0 0 370.862 3.781 20 5 FHBDRN Cc1nn(C)c(C(=O)N[C@H](c2ccc(CC(C)C)cc2)C(C)C)c1[N+](=O)[O-] ZINC000098097646 933639351 /nfs/dbraw/zinc/63/93/51/933639351.db2.gz LYSPZUITRGQEMS-KRWDZBQOSA-N 0 0 372.469 3.962 20 5 FHBDRN Cc1nn(C)c(C(=O)Nc2nc(-c3ccc(C)cc3)c(C)s2)c1[N+](=O)[O-] ZINC000098098393 933640746 /nfs/dbraw/zinc/64/07/46/933640746.db2.gz RCWJBPNXPWEHGR-UHFFFAOYSA-N 0 0 371.422 3.629 20 5 FHBDRN CN(CC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)c1ccccc1 ZINC000610653633 933643524 /nfs/dbraw/zinc/64/35/24/933643524.db2.gz NXRUPMCJVIHYKB-UHFFFAOYSA-N 0 0 368.418 3.793 20 5 FHBDRN Cc1cc(C(=O)COc2ccc([N+](=O)[O-])cc2F)c(C)n1CC(F)(F)F ZINC000060807145 933649287 /nfs/dbraw/zinc/64/92/87/933649287.db2.gz KEVFSHDPGFJFDW-UHFFFAOYSA-N 0 0 374.290 3.976 20 5 FHBDRN CCn1c2ccccc2nc1[C@@H](C)NC(=O)c1ccc(F)cc1[N+](=O)[O-] ZINC000135416087 933649341 /nfs/dbraw/zinc/64/93/41/933649341.db2.gz ATCAWJAEYGXCAM-LLVKDONJSA-N 0 0 356.357 3.595 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1F)N1CCCCC[C@H]1[C@@H]1CCCCC1=O ZINC000610664429 933682023 /nfs/dbraw/zinc/68/20/23/933682023.db2.gz XQHMBESSNQXNMJ-RDJZCZTQSA-N 0 0 362.401 3.878 20 5 FHBDRN Cc1cn(-c2ccc(F)cc2)nc1C(=O)Nc1cc(F)cc([N+](=O)[O-])c1 ZINC000510777213 933708954 /nfs/dbraw/zinc/70/89/54/933708954.db2.gz ASUXBXOMMLLUOQ-UHFFFAOYSA-N 0 0 358.304 3.619 20 5 FHBDRN COc1cc(C(=O)NCCOc2ccc3ccccc3c2)ccc1[N+](=O)[O-] ZINC000510786731 933719842 /nfs/dbraw/zinc/71/98/42/933719842.db2.gz IREHKHGFUNSBHF-UHFFFAOYSA-N 0 0 366.373 3.565 20 5 FHBDRN CCN(C(=O)COc1ccc([N+](=O)[O-])c(C)c1)[C@H](C)c1cccc(OC)c1 ZINC000510796185 933730529 /nfs/dbraw/zinc/73/05/29/933730529.db2.gz STOOEWXOEPAYOE-OAHLLOKOSA-N 0 0 372.421 3.900 20 5 FHBDRN CCOC(=O)c1cc(NCc2cccc([N+](=O)[O-])c2)cc(C(=O)OCC)c1 ZINC000610674983 933737962 /nfs/dbraw/zinc/73/79/62/933737962.db2.gz BPMNCTUWKAUZBG-UHFFFAOYSA-N 0 0 372.377 3.560 20 5 FHBDRN CCN(C(=O)COc1ccc([N+](=O)[O-])c(C)c1)c1ccc(F)c(F)c1 ZINC000510790950 933743211 /nfs/dbraw/zinc/74/32/11/933743211.db2.gz CNFCNRYAZDRGJU-UHFFFAOYSA-N 0 0 350.321 3.613 20 5 FHBDRN Cc1ccc(-c2nnc(NC(=O)Cc3ccccc3[N+](=O)[O-])s2)c(C)c1 ZINC000065083185 933749979 /nfs/dbraw/zinc/74/99/79/933749979.db2.gz PFPPRBHMKBTABC-UHFFFAOYSA-N 0 0 368.418 3.911 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)NCCCSc1ccccc1 ZINC000510802677 933752235 /nfs/dbraw/zinc/75/22/35/933752235.db2.gz IEPOSQQUFSIZJG-UHFFFAOYSA-N 0 0 373.478 3.961 20 5 FHBDRN CCc1ccc(C(=O)N(C)C(C)(C)c2ccc3c(c2)OCO3)cc1[N+](=O)[O-] ZINC000471919432 933761873 /nfs/dbraw/zinc/76/18/73/933761873.db2.gz PMLAWPGQOPNXKW-UHFFFAOYSA-N 0 0 370.405 3.893 20 5 FHBDRN Cc1cc(OCC(=O)N(C)[C@@H](C)c2cc(F)ccc2F)ccc1[N+](=O)[O-] ZINC000510811704 933779809 /nfs/dbraw/zinc/77/98/09/933779809.db2.gz KGMGQAPGYQDXQM-LBPRGKRZSA-N 0 0 364.348 3.780 20 5 FHBDRN C[C@@H](O)CC(C)(C)CNC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000176038957 933785837 /nfs/dbraw/zinc/78/58/37/933785837.db2.gz PPWANQPMKIJHQT-CQSZACIVSA-N 0 0 371.437 3.865 20 5 FHBDRN C[C@@H]1CCCC[C@@H]1NC(=O)COc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000535661244 933791379 /nfs/dbraw/zinc/79/13/79/933791379.db2.gz KOACAWHERYYPEK-PWSUYJOCSA-N 0 0 360.332 3.687 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1CNc1cc(C(N)=O)c(Cl)cc1Cl ZINC000431087800 933818273 /nfs/dbraw/zinc/81/82/73/933818273.db2.gz BTNBEGKUVSARJM-UHFFFAOYSA-N 0 0 370.192 3.621 20 5 FHBDRN O=C(CCNc1ccc([C@H]2CCOC2)cc1)Nc1ccccc1[N+](=O)[O-] ZINC000563010465 933832164 /nfs/dbraw/zinc/83/21/64/933832164.db2.gz RWHSXPIAIVFNRK-HNNXBMFYSA-N 0 0 355.394 3.539 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2COc3c2cccc3Cl)c1 ZINC000610709345 933875094 /nfs/dbraw/zinc/87/50/94/933875094.db2.gz GLQYJLWHDQEPRB-ZDUSSCGKSA-N 0 0 364.810 3.834 20 5 FHBDRN CCc1ccc(C(=O)Nc2ccnn2-c2ccccc2C)cc1[N+](=O)[O-] ZINC000471933334 933901315 /nfs/dbraw/zinc/90/13/15/933901315.db2.gz RMRLJMNQSWSRJP-UHFFFAOYSA-N 0 0 350.378 3.904 20 5 FHBDRN CCC(=O)c1cccc(NC(=O)NCc2cc([N+](=O)[O-])ccc2OC)c1 ZINC000178408277 933969063 /nfs/dbraw/zinc/96/90/63/933969063.db2.gz AADQKVHQNFSFLW-UHFFFAOYSA-N 0 0 357.366 3.518 20 5 FHBDRN Cc1nn(C)cc1[C@H]1CCCN1C(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000610729397 933988135 /nfs/dbraw/zinc/98/81/35/933988135.db2.gz LTBFUFYXYDVKQM-QGZVFWFLSA-N 0 0 370.453 3.912 20 5 FHBDRN Cc1cccc(C(=O)OCC(=O)Nc2ccccc2C(C)C)c1[N+](=O)[O-] ZINC000003495198 933991105 /nfs/dbraw/zinc/99/11/05/933991105.db2.gz VFXURNGBPJFNCK-UHFFFAOYSA-N 0 0 356.378 3.822 20 5 FHBDRN COCCC1(C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2C)CCC1 ZINC000431176670 934012432 /nfs/dbraw/zinc/01/24/32/934012432.db2.gz DSUSFUAGRDCLKW-UHFFFAOYSA-N 0 0 371.231 3.811 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)c1c(Cl)cccc1Cl ZINC000176078790 934027736 /nfs/dbraw/zinc/02/77/36/934027736.db2.gz OJTOZBHYEARMPP-UHFFFAOYSA-N 0 0 355.177 3.840 20 5 FHBDRN COc1ccc(S(=O)(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)c(C)c1C ZINC000091054438 934051559 /nfs/dbraw/zinc/05/15/59/934051559.db2.gz HMDXLWJIENMHGF-UHFFFAOYSA-N 0 0 364.423 3.638 20 5 FHBDRN Cc1sc(S(=O)(=O)N2CCC[C@H]2c2ccccc2C)cc1[N+](=O)[O-] ZINC000467085835 934052471 /nfs/dbraw/zinc/05/24/71/934052471.db2.gz QJHPASWWBRANCO-AWEZNQCLSA-N 0 0 366.464 3.799 20 5 FHBDRN CCc1ccc(C(=O)N=c2ccn([C@@H](C)c3ccccc3)[nH]2)cc1[N+](=O)[O-] ZINC000610746089 934070750 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O=C(NCc1nc2cc(F)ccc2[nH]1)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000176114968 934147911 /nfs/dbraw/zinc/14/79/11/934147911.db2.gz XYXPBGBBKLDJBD-UHFFFAOYSA-N 0 0 370.365 3.755 20 5 FHBDRN CC(C)[C@H]1c2ccccc2CCN1C(=O)COc1ccccc1[N+](=O)[O-] ZINC000610790871 934206186 /nfs/dbraw/zinc/20/61/86/934206186.db2.gz KQDLTHLLAQTCJZ-FQEVSTJZSA-N 0 0 354.406 3.756 20 5 FHBDRN C[C@H]1CCCN(c2ccc(C(=O)N[C@@H]3CCC(F)(F)C3)cc2[N+](=O)[O-])C1 ZINC000610791223 934206231 /nfs/dbraw/zinc/20/62/31/934206231.db2.gz XVCBNBIIWACRBS-GXTWGEPZSA-N 0 0 367.396 3.749 20 5 FHBDRN CC(C)[C@H]1c2ccccc2CCN1C(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000610792270 934209269 /nfs/dbraw/zinc/20/92/69/934209269.db2.gz XCZKFEXXAAZHSD-FQEVSTJZSA-N 0 0 354.406 3.756 20 5 FHBDRN CC1CCN(c2ccc(C(=O)N[C@@H]3CCC(F)(F)C3)cc2[N+](=O)[O-])CC1 ZINC000610790453 934211945 /nfs/dbraw/zinc/21/19/45/934211945.db2.gz KSBCXVHMVPZTDW-CQSZACIVSA-N 0 0 367.396 3.749 20 5 FHBDRN Cc1sc(S(=O)(=O)N2C[C@H](C)C[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000510967585 934238936 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FHBDRN COc1ccc([C@H](C)NC(=O)c2c[nH]c3cccc([N+](=O)[O-])c32)cc1F ZINC000535698322 934292251 /nfs/dbraw/zinc/29/22/51/934292251.db2.gz IZRFLTVLVDNYBN-JTQLQIEISA-N 0 0 357.341 3.715 20 5 FHBDRN O=C(N[C@@H](C1CCCC1)C(F)(F)F)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000176137126 934299485 /nfs/dbraw/zinc/29/94/85/934299485.db2.gz WZIPONZKQHMEET-AWEZNQCLSA-N 0 0 355.316 3.927 20 5 FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N(CC1CC1)C(C)C ZINC000535723448 934310867 /nfs/dbraw/zinc/31/08/67/934310867.db2.gz LVNPLXPDWXTCIN-UHFFFAOYSA-N 0 0 352.456 3.594 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)NC1CCC(C(F)F)CC1 ZINC000458152638 934335276 /nfs/dbraw/zinc/33/52/76/934335276.db2.gz WFXWJFFNAZMXSW-UHFFFAOYSA-N 0 0 355.385 3.727 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1CN1CCC[C@@H](OCC(F)(F)F)C1 ZINC000535786604 934376827 /nfs/dbraw/zinc/37/68/27/934376827.db2.gz XLRVFQCWPIGZDE-CQSZACIVSA-N 0 0 362.348 3.537 20 5 FHBDRN C[C@@H]1Cc2cc(F)ccc2[C@H](C)N1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000535793853 934387234 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CCOc1cc(CSCc2nc([C@H](C)OC)no2)ccc1[N+](=O)[O-] ZINC000277069677 934475305 /nfs/dbraw/zinc/47/53/05/934475305.db2.gz NKTDPUATAMVJNM-JTQLQIEISA-N 0 0 353.400 3.517 20 5 FHBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@H]2CCC[C@H]21 ZINC000431261671 934477104 /nfs/dbraw/zinc/47/71/04/934477104.db2.gz RYNBHYTZBJSRBF-CVEARBPZSA-N 0 0 364.467 3.881 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)c1ccc(Oc2ccccc2)o1 ZINC000176157487 934481059 /nfs/dbraw/zinc/48/10/59/934481059.db2.gz JMBGLFDCQYXQFN-UHFFFAOYSA-N 0 0 352.346 3.953 20 5 FHBDRN Cc1ccc(NC(=O)C(=O)N[C@@H](C)[C@@H](C)C2CCCCC2)cc1[N+](=O)[O-] ZINC000176162265 934481696 /nfs/dbraw/zinc/48/16/96/934481696.db2.gz YWVQJLOZLJRMHI-KGLIPLIRSA-N 0 0 361.442 3.563 20 5 FHBDRN COCc1nc(C(=O)Nc2cccc(Oc3ccc([N+](=O)[O-])cc3)c2)co1 ZINC000548497167 934486302 /nfs/dbraw/zinc/48/63/02/934486302.db2.gz DKHAOEXRDSQMTF-UHFFFAOYSA-N 0 0 369.333 3.774 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N(Cc1ccc(F)cc1)C1CCOCC1 ZINC000277107823 934492746 /nfs/dbraw/zinc/49/27/46/934492746.db2.gz MUGRPQUYARNXAR-UHFFFAOYSA-N 0 0 372.396 3.864 20 5 FHBDRN COC(=O)C(C)(C)[C@@H](NC(=O)c1cc(C)cc([N+](=O)[O-])c1)c1ccccc1 ZINC000610824360 934499216 /nfs/dbraw/zinc/49/92/16/934499216.db2.gz REIQHEQJNRLKGI-KRWDZBQOSA-N 0 0 370.405 3.574 20 5 FHBDRN C[C@@H](COc1ccccc1)NC(=O)CCc1ccc([N+](=O)[O-])cc1Cl ZINC001125559353 934501242 /nfs/dbraw/zinc/50/12/42/934501242.db2.gz BUKHABRUNSKZSF-ZDUSSCGKSA-N 0 0 362.813 3.765 20 5 FHBDRN COC1CCC(C)(CNC(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000471982725 934519208 /nfs/dbraw/zinc/51/92/08/934519208.db2.gz YSJHSTWNMQJREX-ICXUMSERSA-N 0 0 363.458 3.859 20 5 FHBDRN COc1ccc(CCNC(=O)c2c(C)cc(C)c([N+](=O)[O-])c2C)c(OC)c1 ZINC000535825212 934534921 /nfs/dbraw/zinc/53/49/21/934534921.db2.gz PLIWPDAQGCLQNC-UHFFFAOYSA-N 0 0 372.421 3.510 20 5 FHBDRN CC(C)c1ccc(CN2CCS(=O)(=O)c3ccccc3C2)cc1[N+](=O)[O-] ZINC000187688935 934561235 /nfs/dbraw/zinc/56/12/35/934561235.db2.gz JDXXDACOHLVWHN-UHFFFAOYSA-N 0 0 374.462 3.508 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COc1cc([N+](=O)[O-])ccc1OCC(=O)N[C@H](C)c1ccc(Cl)cc1 ZINC000072068068 935275957 /nfs/dbraw/zinc/27/59/57/935275957.db2.gz JHTYNDWBLXAEFZ-LLVKDONJSA-N 0 0 364.785 3.513 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1OCc1nc(-c2cccc(Cl)c2)no1 ZINC000072068025 935276136 /nfs/dbraw/zinc/27/61/36/935276136.db2.gz KXTWACLSKPHCJY-UHFFFAOYSA-N 0 0 361.741 3.886 20 5 FHBDRN C/C(=C\C(=O)NCc1cn2cc(Cl)ccc2n1)c1ccc([N+](=O)[O-])cc1 ZINC000785116784 935277849 /nfs/dbraw/zinc/27/78/49/935277849.db2.gz MKCUACNVUIAGTE-XYOKQWHBSA-N 0 0 370.796 3.616 20 5 FHBDRN O=[N+]([O-])c1ccccc1OCCOc1nc(-c2ccccc2Cl)no1 ZINC000072068241 935279518 /nfs/dbraw/zinc/27/95/18/935279518.db2.gz LXGMAKWNYLGIPC-UHFFFAOYSA-N 0 0 361.741 3.756 20 5 FHBDRN COC(=O)[C@@H](C)[C@@H](NC(=O)Nc1cc([N+](=O)[O-])ccc1C)c1ccccc1 ZINC000119848651 935280346 /nfs/dbraw/zinc/28/03/46/935280346.db2.gz TXDDHXUOTZBBJI-SUMWQHHRSA-N 0 0 371.393 3.575 20 5 FHBDRN Cc1ccccc1-c1nc(CN(C)CCc2ccccc2[N+](=O)[O-])no1 ZINC000511076475 935289104 /nfs/dbraw/zinc/28/91/04/935289104.db2.gz XEKSJTBTDSNHFN-UHFFFAOYSA-N 0 0 352.394 3.628 20 5 FHBDRN O=C(Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1)C12CC3CC(CC(C3)C1)C2 ZINC000072085958 935289493 /nfs/dbraw/zinc/28/94/93/935289493.db2.gz BYKZKPMQPMYUKY-UHFFFAOYSA-N 0 0 366.421 3.639 20 5 FHBDRN COCC[C@H]1CCCCN(C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000468213924 935301035 /nfs/dbraw/zinc/30/10/35/935301035.db2.gz CRMSAOTZSGLZGS-JKSUJKDBSA-N 0 0 363.458 3.812 20 5 FHBDRN COc1cc(OCC(=O)Nc2nc3c(cccc3C)s2)ccc1[N+](=O)[O-] ZINC000068754435 935301602 /nfs/dbraw/zinc/30/16/02/935301602.db2.gz JEAPHBCTVCBXCA-UHFFFAOYSA-N 0 0 373.390 3.539 20 5 FHBDRN O=C(c1ccc(OC(F)F)c(F)c1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000551559232 935310050 /nfs/dbraw/zinc/31/00/50/935310050.db2.gz JYXCBDPEPSGQHF-UHFFFAOYSA-N 0 0 366.295 3.534 20 5 FHBDRN COc1c(N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc(Cl)cc1C(N)=O ZINC000551567119 935311497 /nfs/dbraw/zinc/31/14/97/935311497.db2.gz OVLHNPDMGJIPCB-SNVBAGLBSA-N 0 0 363.801 3.837 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])s1)N1CC[C@@](F)(c2cc(F)cc(F)c2)C1 ZINC000551686695 935329092 /nfs/dbraw/zinc/32/90/92/935329092.db2.gz NAIHLIAKSBTBLP-HNNXBMFYSA-N 0 0 356.325 3.645 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1Cl)N1Cc2cnn(-c3ccccc3)c2C1 ZINC000582144649 935331673 /nfs/dbraw/zinc/33/16/73/935331673.db2.gz WPPGRZIRJDEEMR-UHFFFAOYSA-N 0 0 368.780 3.590 20 5 FHBDRN CCc1nccn1C[C@H]1CCCN1c1ccc([N+](=O)[O-])c(OC(F)F)c1 ZINC000540035711 935346731 /nfs/dbraw/zinc/34/67/31/935346731.db2.gz SGKSPJFYJBWBRO-CYBMUJFWSA-N 0 0 366.368 3.624 20 5 FHBDRN CCc1ccc([C@H](NCc2cc(C)nn2C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000551812888 935352633 /nfs/dbraw/zinc/35/26/33/935352633.db2.gz GSVJMSDCGYPQRM-LJQANCHMSA-N 0 0 354.410 3.671 20 5 FHBDRN C[C@@H](O)C[C@@H](CNC(=O)C(C)(C)c1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000551829967 935357090 /nfs/dbraw/zinc/35/70/90/935357090.db2.gz ZBVVYDHCHFQXTN-WBVHZDCISA-N 0 0 370.449 3.543 20 5 FHBDRN CCCOc1ccc(CNC(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1OC ZINC000582158850 935366051 /nfs/dbraw/zinc/36/60/51/935366051.db2.gz XAEOQTDYNJXHIT-AWEZNQCLSA-N 0 0 372.421 3.812 20 5 FHBDRN C[C@H](Nc1ccc2c(c1)C(=O)CCC2)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000426187028 945097033 /nfs/dbraw/zinc/09/70/33/945097033.db2.gz OIYWWWJYFYQGQL-LBPRGKRZSA-N 0 0 353.378 3.553 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)N[C@@H](c2ccccc2)c2ccc(C)cc2)n1 ZINC000427112098 945097439 /nfs/dbraw/zinc/09/74/39/945097439.db2.gz YYXQUPPPKOCKTP-SFHVURJKSA-N 0 0 364.405 3.639 20 5 FHBDRN CCc1coc(NC(=O)c2ccc(N3CCC[C@@H](C)C3)c([N+](=O)[O-])c2)n1 ZINC000551957539 935391205 /nfs/dbraw/zinc/39/12/05/935391205.db2.gz KYXQQUJDRMVLLE-GFCCVEGCSA-N 0 0 358.398 3.634 20 5 FHBDRN COc1cc(OCC(=O)Nc2c(C)cccc2Cl)ccc1[N+](=O)[O-] ZINC000085296755 935416793 /nfs/dbraw/zinc/41/67/93/935416793.db2.gz AFBJMIRTUGSQFN-UHFFFAOYSA-N 0 0 350.758 3.583 20 5 FHBDRN O=C(Nc1csc(-c2ccncc2)n1)c1c[nH]c2cc([N+](=O)[O-])ccc21 ZINC000431374853 935425966 /nfs/dbraw/zinc/42/59/66/935425966.db2.gz PSBAVJQUZQAGGW-UHFFFAOYSA-N 0 0 365.374 3.847 20 5 FHBDRN Cc1nn(C)c(C(=O)N2CCCC[C@@H]2CCCc2ccccc2)c1[N+](=O)[O-] ZINC000161195265 935447856 /nfs/dbraw/zinc/44/78/56/935447856.db2.gz SLMJCZAQHRPMCW-QGZVFWFLSA-N 0 0 370.453 3.654 20 5 FHBDRN COc1ccc2c(c1)N(C(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1)C[C@H](C)O2 ZINC000582278418 935474767 /nfs/dbraw/zinc/47/47/67/935474767.db2.gz KACLWRVJLCPLKT-STQMWFEESA-N 0 0 356.378 3.521 20 5 FHBDRN Cc1c(C(=O)NCc2cccc([N+](=O)[O-])c2)cnn1-c1cc(C)ccc1C ZINC000178553229 935482425 /nfs/dbraw/zinc/48/24/25/935482425.db2.gz RZTGCGHOYHTWRC-UHFFFAOYSA-N 0 0 364.405 3.636 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2CCC[C@@H]2c2cccc(C)n2)c1 ZINC000540619743 935509479 /nfs/dbraw/zinc/50/94/79/935509479.db2.gz MIOQKTCIYBWSGG-QGZVFWFLSA-N 0 0 369.421 3.739 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)Nc1c(-c2ccc(F)cc2)ncn1C ZINC000120061832 935509497 /nfs/dbraw/zinc/50/94/97/935509497.db2.gz IWYVIRSSUTZIHG-UHFFFAOYSA-N 0 0 354.341 3.695 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CCc3ccccc32)cc1SC ZINC000263993722 935526830 /nfs/dbraw/zinc/52/68/30/935526830.db2.gz HXLBEIVUTFYROK-CQSZACIVSA-N 0 0 358.419 3.743 20 5 FHBDRN CO[C@@H]1CCOc2c(NC(=O)[C@H](C)c3cccc([N+](=O)[O-])c3)cccc21 ZINC000548728768 935540986 /nfs/dbraw/zinc/54/09/86/935540986.db2.gz VCHUHTWIBADKHB-SJKOYZFVSA-N 0 0 356.378 3.807 20 5 FHBDRN Cc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2C)nn1-c1cc(C)cc(C)c1 ZINC000540745576 935554918 /nfs/dbraw/zinc/55/49/18/935554918.db2.gz GJSJMVJFPRAAII-UHFFFAOYSA-N 0 0 364.405 3.688 20 5 FHBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC(OC)CC1 ZINC000540745601 935555030 /nfs/dbraw/zinc/55/50/30/935555030.db2.gz BWSNNFMDAKZVIB-UHFFFAOYSA-N 0 0 352.456 3.738 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(OC(F)F)cn2)c1 ZINC000582364280 935575403 /nfs/dbraw/zinc/57/54/03/935575403.db2.gz AJKGLJBBKDDPTN-UHFFFAOYSA-N 0 0 355.322 3.565 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2ccnn2-c2ccccc2C)c1 ZINC000582372811 935576747 /nfs/dbraw/zinc/57/67/47/935576747.db2.gz PZCRLKSATKSXAQ-UHFFFAOYSA-N 0 0 366.377 3.740 20 5 FHBDRN Cc1ccc(C)c(S(=O)(=O)N2CCC[C@H]3CCCC[C@H]32)c1[N+](=O)[O-] ZINC000478147467 935579185 /nfs/dbraw/zinc/57/91/85/935579185.db2.gz XQUQPYRFNGAAEP-HUUCEWRRSA-N 0 0 352.456 3.555 20 5 FHBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)[C@H]1CCCO1 ZINC000135045825 935583741 /nfs/dbraw/zinc/58/37/41/935583741.db2.gz OYKAAIMGAWJIRZ-SWLSCSKDSA-N 0 0 352.456 3.640 20 5 FHBDRN CCc1ccc([C@H]2COCCN2C(=O)c2ccc([N+](=O)[O-])c(Cl)c2)o1 ZINC000158137688 935583805 /nfs/dbraw/zinc/58/38/05/935583805.db2.gz RPMKPMBNXPGVNA-OAHLLOKOSA-N 0 0 364.785 3.617 20 5 FHBDRN O=[N+]([O-])c1cc(F)ccc1CN1CC[C@H](OCCCc2ccccc2)C1 ZINC001167568374 935594348 /nfs/dbraw/zinc/59/43/48/935594348.db2.gz QVQBIFASXPHFDJ-IBGZPJMESA-N 0 0 358.413 3.958 20 5 FHBDRN O=C(N[C@@H]1C[C@H]1c1ccc(OC(F)F)cc1)c1ccc(F)cc1[N+](=O)[O-] ZINC000478241714 935596097 /nfs/dbraw/zinc/59/60/97/935596097.db2.gz QTXQKVSWYVLNEV-UONOGXRCSA-N 0 0 366.295 3.621 20 5 FHBDRN COc1ccc(N(C(=O)c2cc([N+](=O)[O-])ccc2OC)C(C)C)cc1F ZINC000158153894 935596174 /nfs/dbraw/zinc/59/61/74/935596174.db2.gz NSAKRZMNZZHGFE-UHFFFAOYSA-N 0 0 362.357 3.806 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N[C@@H]2CC[C@@H](c3cccc(F)c3)C2)c1[N+](=O)[O-] ZINC000478246098 935597224 /nfs/dbraw/zinc/59/72/24/935597224.db2.gz CRKGTOUOGHZWQD-TZMCWYRMSA-N 0 0 360.389 3.647 20 5 FHBDRN CC(C)C1CCC(NC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC1 ZINC000478275302 935605476 /nfs/dbraw/zinc/60/54/76/935605476.db2.gz DZLQPSFTMAMEKJ-UHFFFAOYSA-N 0 0 370.453 3.940 20 5 FHBDRN COC(=O)c1cnc(Nc2ccc(NC(=O)CC(C)C)cc2)c([N+](=O)[O-])c1 ZINC000478287015 935608170 /nfs/dbraw/zinc/60/81/70/935608170.db2.gz UDGMDOPMLJTOJE-UHFFFAOYSA-N 0 0 372.381 3.505 20 5 FHBDRN COC(=O)Cc1cccc(NC(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)c1 ZINC000478331625 935610724 /nfs/dbraw/zinc/61/07/24/935610724.db2.gz BAFWEDOHEVHUQX-UHFFFAOYSA-N 0 0 370.405 3.860 20 5 FHBDRN Cc1nc(CC(C)C)c(NC(=O)CCOc2ccccc2[N+](=O)[O-])s1 ZINC000127559998 935622094 /nfs/dbraw/zinc/62/20/94/935622094.db2.gz ILFIIVYEASGXEU-UHFFFAOYSA-N 0 0 363.439 3.966 20 5 FHBDRN Cc1c(CN[C@@H](C)c2ncc(Br)s2)cccc1[N+](=O)[O-] ZINC000478489000 935635629 /nfs/dbraw/zinc/63/56/29/935635629.db2.gz LRMVLEWETSMDLK-VIFPVBQESA-N 0 0 356.245 3.973 20 5 FHBDRN COc1ccccc1-c1nn(C)cc1C(=O)Nc1ccc(C)c([N+](=O)[O-])c1 ZINC000127585274 935641521 /nfs/dbraw/zinc/64/15/21/935641521.db2.gz HMXVTXPWTJXQSV-UHFFFAOYSA-N 0 0 366.377 3.565 20 5 FHBDRN Cc1nn(C)c(N2CCC[C@H](COc3ccccc3Cl)C2)c1[N+](=O)[O-] ZINC000158238971 935642445 /nfs/dbraw/zinc/64/24/45/935642445.db2.gz ZLBVBXIJSAEEBZ-ZDUSSCGKSA-N 0 0 364.833 3.586 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(F)cc2OCC(F)F)c1 ZINC000091215508 935645544 /nfs/dbraw/zinc/64/55/44/935645544.db2.gz WSXNVUHBTKJWIJ-UHFFFAOYSA-N 0 0 354.284 3.939 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])N[C@H]1C[C@H](c2ccc(Cl)cc2)C1 ZINC000478552842 935651148 /nfs/dbraw/zinc/65/11/48/935651148.db2.gz MXWOYFXIHCYWCH-CTYIDZIISA-N 0 0 359.813 3.723 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N[C@H]1C[C@H](c2ccc(Cl)cc2)C1 ZINC000478580648 935653556 /nfs/dbraw/zinc/65/35/56/935653556.db2.gz LSWBKFZXDWTSGW-CTYIDZIISA-N 0 0 360.797 3.689 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](CO)CCC(C)(C)C ZINC000478595952 935663031 /nfs/dbraw/zinc/66/30/31/935663031.db2.gz TUAJINUZUYIYFQ-LBPRGKRZSA-N 0 0 354.472 3.624 20 5 FHBDRN CC(C)[C@H]1CN(C(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)CCS1 ZINC000437203711 945115864 /nfs/dbraw/zinc/11/58/64/945115864.db2.gz QTTLATVBRBKLAJ-IUODEOHRSA-N 0 0 354.497 3.675 20 5 FHBDRN CN(C(=O)c1cc(F)c(F)cc1Br)c1cccc([N+](=O)[O-])c1 ZINC000158278362 935676529 /nfs/dbraw/zinc/67/65/29/935676529.db2.gz SOVCBOHVUXXALT-UHFFFAOYSA-N 0 0 371.137 3.912 20 5 FHBDRN CCOc1cc(OCC(=O)N[C@H](C)c2ccc(C)c(C)c2)ccc1[N+](=O)[O-] ZINC000478729563 935687815 /nfs/dbraw/zinc/68/78/15/935687815.db2.gz ALZOIODUCNDXCU-OAHLLOKOSA-N 0 0 372.421 3.867 20 5 FHBDRN CC(C)(Cc1nc(-c2ncc(F)cc2[N+](=O)[O-])no1)c1ccccc1F ZINC001211544841 935693313 /nfs/dbraw/zinc/69/33/13/935693313.db2.gz INEMQEOOYQIMNK-UHFFFAOYSA-N 0 0 360.320 3.838 20 5 FHBDRN CCO[C@H](C(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)c1ccccc1 ZINC000582445127 935717290 /nfs/dbraw/zinc/71/72/90/935717290.db2.gz DRYGKYXINGDXLV-IBGZPJMESA-N 0 0 367.405 3.513 20 5 FHBDRN CCn1c2ccc(F)cc2nc1CN(C)CCc1ccccc1[N+](=O)[O-] ZINC000511127369 935724205 /nfs/dbraw/zinc/72/42/05/935724205.db2.gz VGSJXMJXGAKAFG-UHFFFAOYSA-N 0 0 356.401 3.778 20 5 FHBDRN CCC1(CNC(=O)CSCc2ccc(OC)c([N+](=O)[O-])c2)CCCC1 ZINC000472226189 935726867 /nfs/dbraw/zinc/72/68/67/935726867.db2.gz UFHFTAZOYPRALX-UHFFFAOYSA-N 0 0 366.483 3.923 20 5 FHBDRN Cc1cc(NC(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])cc(C)c1O ZINC000478810445 935729797 /nfs/dbraw/zinc/72/97/97/935729797.db2.gz DOSPJZDLHFLSSI-NSHDSACASA-N 0 0 364.785 3.977 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1OCC(=O)c1cc(C)c(F)cc1Cl ZINC000127683919 935733694 /nfs/dbraw/zinc/73/36/94/935733694.db2.gz RGMULFXORDXINS-UHFFFAOYSA-N 0 0 353.733 3.966 20 5 FHBDRN O=C(N[C@H](CCc1ccccc1)C(F)(F)F)c1ccc([N+](=O)[O-])cc1 ZINC000478832760 935736134 /nfs/dbraw/zinc/73/61/34/935736134.db2.gz MVNHUDRGHDPKOU-OAHLLOKOSA-N 0 0 352.312 3.888 20 5 FHBDRN COc1ccc(C[C@H](C)CNC(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)cc1 ZINC000478846721 935740373 /nfs/dbraw/zinc/74/03/73/935740373.db2.gz VWFZSOLSVOCUNK-ZDUSSCGKSA-N 0 0 372.421 3.529 20 5 FHBDRN CCO[C@H]1C[C@@H](N(C)C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)C12CCC2 ZINC000478856595 935745575 /nfs/dbraw/zinc/74/55/75/935745575.db2.gz GFNPDWAANVKSPG-CVEARBPZSA-N 0 0 366.845 3.597 20 5 FHBDRN Cc1nn(C)c(C(=O)N(Cc2ccc(C(C)C)cc2)C2CC2)c1[N+](=O)[O-] ZINC000127698243 935746189 /nfs/dbraw/zinc/74/61/89/935746189.db2.gz DUXVTTAYWHGCAZ-UHFFFAOYSA-N 0 0 356.426 3.565 20 5 FHBDRN COc1cc(C(=O)Nc2cc(C(F)(F)F)ccc2O)cc([N+](=O)[O-])c1C ZINC000478878436 935748306 /nfs/dbraw/zinc/74/83/06/935748306.db2.gz GSKFQTAXROKUGH-UHFFFAOYSA-N 0 0 370.283 3.889 20 5 FHBDRN CCC1(CC)CC(=O)N(Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C(=O)C1 ZINC000478881291 935748535 /nfs/dbraw/zinc/74/85/35/935748535.db2.gz HMORBZAZYQWNEF-UHFFFAOYSA-N 0 0 371.393 3.705 20 5 FHBDRN Cc1cc(OCC(=O)N2CCC[C@H]3CCCC[C@@H]32)c(F)cc1[N+](=O)[O-] ZINC000478909123 935753737 /nfs/dbraw/zinc/75/37/37/935753737.db2.gz LJMOJXORBBMBCH-HIFRSBDPSA-N 0 0 350.390 3.602 20 5 FHBDRN Cc1ccc(NC(=O)c2cc(N(C)C)nc3ccccc32)cc1[N+](=O)[O-] ZINC000509568164 945121620 /nfs/dbraw/zinc/12/16/20/945121620.db2.gz LHHAADYYBJTKNJ-UHFFFAOYSA-N 0 0 350.378 3.770 20 5 FHBDRN Cc1cc(N2CCOCC2)ccc1N[C@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000582497535 935777143 /nfs/dbraw/zinc/77/71/43/935777143.db2.gz VOFCMQWINVZDDD-IBGZPJMESA-N 0 0 353.422 3.839 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCc1ccc(OC(C)C)nc1 ZINC000127769610 935780804 /nfs/dbraw/zinc/78/08/04/935780804.db2.gz HNKZVLRGBUMEPO-UHFFFAOYSA-N 0 0 358.398 3.716 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc2c(cc1F)NC(=O)CC2 ZINC000588526078 935782553 /nfs/dbraw/zinc/78/25/53/935782553.db2.gz DDSRLOSQZHXMMF-FLIBITNWSA-N 0 0 369.352 3.661 20 5 FHBDRN C[C@H]1CCN(C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)c2ccccc21 ZINC000519100335 945123922 /nfs/dbraw/zinc/12/39/22/945123922.db2.gz GFCAWMHUYHMQGH-AWEZNQCLSA-N 0 0 362.389 3.935 20 5 FHBDRN Cc1ccc(CNC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1F ZINC000127791820 935795391 /nfs/dbraw/zinc/79/53/91/935795391.db2.gz LKGNTUBKGJNZPV-UHFFFAOYSA-N 0 0 357.385 3.917 20 5 FHBDRN CCOc1cccc([C@@H]2C[C@H]2NC(=O)Cc2cccc([N+](=O)[O-])c2C)c1 ZINC000437210704 945124520 /nfs/dbraw/zinc/12/45/20/945124520.db2.gz FCOPRELKLOFINF-ZWKOTPCHSA-N 0 0 354.406 3.517 20 5 FHBDRN O=C(NC[C@H](O)c1cc2ccccc2s1)Nc1cccc([N+](=O)[O-])c1 ZINC000176679963 935802744 /nfs/dbraw/zinc/80/27/44/935802744.db2.gz ASBFEZSXUNNVBF-AWEZNQCLSA-N 0 0 357.391 3.665 20 5 FHBDRN CCc1c(C(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)cnn1C(CC)CC ZINC000479161197 935811145 /nfs/dbraw/zinc/81/11/45/935811145.db2.gz UDVZFISWJCSWIX-UHFFFAOYSA-N 0 0 370.453 3.913 20 5 FHBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)Nc1nnc(/C=C/c2ccco2)s1 ZINC000255508649 935813757 /nfs/dbraw/zinc/81/37/57/935813757.db2.gz VZUXQNZFYJCSNC-APQBBXBWSA-N 0 0 368.374 3.862 20 5 FHBDRN O=C(N[C@@H]1[C@H]2CCO[C@@H]2C12CCC2)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000277684609 935814893 /nfs/dbraw/zinc/81/48/93/935814893.db2.gz ADAVNIIXXNGJEP-HBGVWJBISA-N 0 0 374.440 3.781 20 5 FHBDRN Cc1c(CNC(=O)N[C@H](Cc2ccccc2)C2CC2)cccc1[N+](=O)[O-] ZINC000479302876 935823691 /nfs/dbraw/zinc/82/36/91/935823691.db2.gz PJGAXPLHWMCIDX-GOSISDBHSA-N 0 0 353.422 3.724 20 5 FHBDRN CCC(=O)c1ccc(NCc2nc(-c3cccc(F)c3)no2)c([N+](=O)[O-])c1 ZINC000479299146 935823703 /nfs/dbraw/zinc/82/37/03/935823703.db2.gz BORBDAHUANZVFT-UHFFFAOYSA-N 0 0 370.340 3.989 20 5 FHBDRN COc1ccccc1O[C@@H](C)CNC(=O)Nc1c(C)ccc([N+](=O)[O-])c1C ZINC000127856823 935824557 /nfs/dbraw/zinc/82/45/57/935824557.db2.gz YLTAHHWFQFTSGU-ZDUSSCGKSA-N 0 0 373.409 3.809 20 5 FHBDRN CC(C)(C)c1ncc(NC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)cn1 ZINC000158503063 935824852 /nfs/dbraw/zinc/82/48/52/935824852.db2.gz VLCVDASSAHIDAD-UHFFFAOYSA-N 0 0 369.425 3.879 20 5 FHBDRN CCC(=O)c1ccc(NC[C@@](C)(CO)Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000479279509 935825002 /nfs/dbraw/zinc/82/50/02/935825002.db2.gz HDGQLGZASWHKJA-FQEVSTJZSA-N 0 0 356.422 3.841 20 5 FHBDRN O=C(Cn1cc(-c2ccccc2[N+](=O)[O-])cn1)N1CCC[C@@H]2CCCC[C@@H]21 ZINC000582556609 935826352 /nfs/dbraw/zinc/82/63/52/935826352.db2.gz PFSIGJYDCUIWJH-YJBOKZPZSA-N 0 0 368.437 3.640 20 5 FHBDRN O=C(Cn1cc(-c2ccccc2[N+](=O)[O-])cn1)N1CCC[C@H]2CCCC[C@@H]21 ZINC000582556607 935826401 /nfs/dbraw/zinc/82/64/01/935826401.db2.gz PFSIGJYDCUIWJH-QAPCUYQASA-N 0 0 368.437 3.640 20 5 FHBDRN CCCN(C(=O)CNc1ccccc1[N+](=O)[O-])[C@@H]1CCCc2cccnc21 ZINC000479350044 935828562 /nfs/dbraw/zinc/82/85/62/935828562.db2.gz QOWNFQHVQUFGDI-GOSISDBHSA-N 0 0 368.437 3.718 20 5 FHBDRN CCOc1ncccc1NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000050314101 935829676 /nfs/dbraw/zinc/82/96/76/935829676.db2.gz MAJLHOBAHGCFAN-UHFFFAOYSA-N 0 0 370.390 3.764 20 5 FHBDRN CCCC(=O)Nc1ccc(C(=O)CSc2ncccc2[N+](=O)[O-])cc1 ZINC000127885800 935834152 /nfs/dbraw/zinc/83/41/52/935834152.db2.gz RKQLPXKUBKHKIL-UHFFFAOYSA-N 0 0 359.407 3.703 20 5 FHBDRN COc1ccc(CNC(=O)Cc2c[nH]c3cccc(Cl)c23)cc1[N+](=O)[O-] ZINC000431452592 935835050 /nfs/dbraw/zinc/83/50/50/935835050.db2.gz OSEIQUZWDLRLFO-UHFFFAOYSA-N 0 0 373.796 3.597 20 5 FHBDRN COC(=O)c1ccc(OCCc2c(F)cccc2Cl)c([N+](=O)[O-])c1 ZINC000519104436 945127632 /nfs/dbraw/zinc/12/76/32/945127632.db2.gz VCBGNNNRIUASDK-UHFFFAOYSA-N 0 0 353.733 3.795 20 5 FHBDRN CC(C)[C@@H](NC(=O)CSc1ncccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000127905322 935836643 /nfs/dbraw/zinc/83/66/43/935836643.db2.gz OAWNTMMNYBUHCL-MRXNPFEDSA-N 0 0 363.414 3.735 20 5 FHBDRN COc1ccc(OCC(=O)N[C@@H](CC(C)C)c2ccccc2)cc1[N+](=O)[O-] ZINC000479411285 935837150 /nfs/dbraw/zinc/83/71/50/935837150.db2.gz OBCGBZPBPOSNTJ-KRWDZBQOSA-N 0 0 372.421 3.886 20 5 FHBDRN C[C@@H](c1ccncc1)N(C)C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000050355412 935837621 /nfs/dbraw/zinc/83/76/21/935837621.db2.gz RGKADWOCGNGYHD-LBPRGKRZSA-N 0 0 368.418 3.947 20 5 FHBDRN CN(C(=O)CCc1cccc(OC(C)(C)C)n1)c1cccc([N+](=O)[O-])c1 ZINC000158590124 935849093 /nfs/dbraw/zinc/84/90/93/935849093.db2.gz CJAROAPFCRNFBL-UHFFFAOYSA-N 0 0 357.410 3.763 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H](c2ccccc2)C2CC2)c1 ZINC000562087582 935853261 /nfs/dbraw/zinc/85/32/61/935853261.db2.gz OYEIORBOPZKSAM-SFHVURJKSA-N 0 0 354.406 3.917 20 5 FHBDRN CCc1ccc([C@@H](NCCN2CC=CCC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000479539231 935855961 /nfs/dbraw/zinc/85/59/61/935855961.db2.gz GINDZVWYPPIRLA-FQEVSTJZSA-N 0 0 355.438 3.691 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N[C@@H]1c2ccc(F)cc2O[C@H]1C ZINC000479561326 935860502 /nfs/dbraw/zinc/86/05/02/935860502.db2.gz HSMBGMNFBBUAAE-GTNSWQLSSA-N 0 0 359.357 3.994 20 5 FHBDRN CC(C)c1ccc(C(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000015382222 945129985 /nfs/dbraw/zinc/12/99/85/945129985.db2.gz YPQCCYLPVWOISN-UHFFFAOYSA-N 0 0 353.422 3.681 20 5 FHBDRN Cc1c(CNC(=O)NCc2ncoc2-c2ccccc2)cccc1[N+](=O)[O-] ZINC000479671361 935874251 /nfs/dbraw/zinc/87/42/51/935874251.db2.gz GGORBQLRCBBUCM-UHFFFAOYSA-N 0 0 366.377 3.558 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1OCC(=O)c1sccc1Br ZINC000050505881 935876085 /nfs/dbraw/zinc/87/60/85/935876085.db2.gz FHDRMOACKJDIKW-UHFFFAOYSA-N 0 0 372.196 3.689 20 5 FHBDRN O=C(N[C@H](c1ccccc1)C1CCC1)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000519126597 945130627 /nfs/dbraw/zinc/13/06/27/945130627.db2.gz DWRPRVDULFJNAN-QGZVFWFLSA-N 0 0 350.378 3.742 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)N[C@H](CCc1ccccc1)C(F)(F)F ZINC000479715618 935882843 /nfs/dbraw/zinc/88/28/43/935882843.db2.gz WFJLQQLHIDZPJJ-MRXNPFEDSA-N 0 0 366.339 3.817 20 5 FHBDRN CC(C)(NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1)c1ccc(F)cc1 ZINC000728500098 935888232 /nfs/dbraw/zinc/88/82/32/935888232.db2.gz PCINUNVKGZULLU-UHFFFAOYSA-N 0 0 368.368 3.585 20 5 FHBDRN CCc1ccc([C@@H]2CCN(C(=O)Cc3c(F)cc([N+](=O)[O-])cc3F)C2)cc1 ZINC000562116819 935889909 /nfs/dbraw/zinc/88/99/09/935889909.db2.gz ASZKEKMKEGDMNU-OAHLLOKOSA-N 0 0 374.387 3.994 20 5 FHBDRN COc1ccccc1CN(Cc1ccccc1[N+](=O)[O-])C[C@H]1CCCO1 ZINC000051798470 935890014 /nfs/dbraw/zinc/89/00/14/935890014.db2.gz BZJVPOHYJGJIEY-GOSISDBHSA-N 0 0 356.422 3.785 20 5 FHBDRN O=[N+]([O-])c1ccccc1NCCc1noc([C@@H]2CCCC(F)(F)C2)n1 ZINC000582631137 935892338 /nfs/dbraw/zinc/89/23/38/935892338.db2.gz NNZWCGQUMDBMGP-LLVKDONJSA-N 0 0 352.341 3.925 20 5 FHBDRN O=C(Nc1cnn(Cc2ccccc2)c1)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000065582312 935896171 /nfs/dbraw/zinc/89/61/71/935896171.db2.gz PEWZZRLNTPLNAD-UHFFFAOYSA-N 0 0 361.361 3.573 20 5 FHBDRN CSc1ccc(O[C@H](C)C(=O)N2CCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000128041046 935906437 /nfs/dbraw/zinc/90/64/37/935906437.db2.gz LCWKJJUBLCTIIF-GFCCVEGCSA-N 0 0 358.419 3.673 20 5 FHBDRN Cc1ccc(NC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)cc1[N+](=O)[O-] ZINC000121835825 935913987 /nfs/dbraw/zinc/91/39/87/935913987.db2.gz YKYZPBRSONOWGC-UHFFFAOYSA-N 0 0 374.309 3.589 20 5 FHBDRN Cc1cc(Cl)c(S(=O)(=O)N2CCC[C@H]3CCC[C@@H]32)cc1[N+](=O)[O-] ZINC000176725642 935932634 /nfs/dbraw/zinc/93/26/34/935932634.db2.gz DUNLXEUOIIJXAO-YPMHNXCESA-N 0 0 358.847 3.510 20 5 FHBDRN C[C@@H](C(=O)NCC1CCN(c2ccccc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000548749771 935937079 /nfs/dbraw/zinc/93/70/79/935937079.db2.gz RYJHRJXUKJGZQY-MRXNPFEDSA-N 0 0 367.449 3.731 20 5 FHBDRN Cc1cc(N[C@@H](C)c2c(F)cncc2F)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000582682730 935937520 /nfs/dbraw/zinc/93/75/20/935937520.db2.gz DUSGWVGEPHFQPC-NSHDSACASA-N 0 0 371.347 3.628 20 5 FHBDRN O=[N+]([O-])c1ccc2ncnc(N[C@@H]3CCN(c4ccc(F)cc4F)C3)c2c1 ZINC000611706490 935945177 /nfs/dbraw/zinc/94/51/77/935945177.db2.gz MZWBQVYLGPRAKC-GFCCVEGCSA-N 0 0 371.347 3.507 20 5 FHBDRN Cc1c(CN(c2ccc(Cl)cc2F)S(C)(=O)=O)cccc1[N+](=O)[O-] ZINC000047370090 945135310 /nfs/dbraw/zinc/13/53/10/945135310.db2.gz NBDFPRRXJVHWGZ-UHFFFAOYSA-N 0 0 372.805 3.662 20 5 FHBDRN C[C@H]1CO[C@H](c2ccccc2)CN1c1ncnc2ccc([N+](=O)[O-])cc21 ZINC000611707569 935948436 /nfs/dbraw/zinc/94/84/36/935948436.db2.gz JSVJCTRVFWUQBA-UGSOOPFHSA-N 0 0 350.378 3.504 20 5 FHBDRN CCC(=O)c1ccc(N[C@@H]2CCc3cn(C(C)C)nc3C2)c([N+](=O)[O-])c1 ZINC000480068199 935957129 /nfs/dbraw/zinc/95/71/29/935957129.db2.gz ICYBATNDXKHFEE-OAHLLOKOSA-N 0 0 356.426 3.934 20 5 FHBDRN CCOc1cc(Cl)ccc1CNC(=O)c1cc(OC)ccc1[N+](=O)[O-] ZINC000158760866 935962675 /nfs/dbraw/zinc/96/26/75/935962675.db2.gz BOTRPIHMLPAUPC-UHFFFAOYSA-N 0 0 364.785 3.586 20 5 FHBDRN Cc1ccc(NC(=O)[C@H](c2ccccc2)N2C[C@H](C)[C@@H]2C)c([N+](=O)[O-])c1 ZINC000519115173 945137551 /nfs/dbraw/zinc/13/75/51/945137551.db2.gz LVSMVOFPGQCLEC-DOXZYTNZSA-N 0 0 353.422 3.923 20 5 FHBDRN CC(C)c1ccc(C(=O)Nc2ccc([S@@](C)=O)c(F)c2)cc1[N+](=O)[O-] ZINC000187784968 935998245 /nfs/dbraw/zinc/99/82/45/935998245.db2.gz HJSKOYCALNSAIQ-RUZDIDTESA-N 0 0 364.398 3.847 20 5 FHBDRN COc1cccc(F)c1CNc1nc(C2CC2)nc(Cl)c1[N+](=O)[O-] ZINC001167606093 935999709 /nfs/dbraw/zinc/99/97/09/935999709.db2.gz BJEXXWHNLKSWFA-UHFFFAOYSA-N 0 0 352.753 3.675 20 5 FHBDRN 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/nfs/dbraw/zinc/12/11/60/936121160.db2.gz CWIOJYVSNQLZQB-LBPRGKRZSA-N 0 0 371.393 3.639 20 5 FHBDRN Cc1cccc(Cn2nccc2NC(=O)Cc2cccc([N+](=O)[O-])c2C)c1 ZINC000178666402 936130680 /nfs/dbraw/zinc/13/06/80/936130680.db2.gz XCUVVCFXWMIVDJ-UHFFFAOYSA-N 0 0 364.405 3.638 20 5 FHBDRN CCOC(=O)[C@@H](CNc1ccc(C(C)=O)cc1[N+](=O)[O-])c1ccccc1 ZINC000078405982 936146865 /nfs/dbraw/zinc/14/68/65/936146865.db2.gz YYWQVOXNQCEAHS-INIZCTEOSA-N 0 0 356.378 3.556 20 5 FHBDRN O=C(c1cc(F)ccc1[N+](=O)[O-])N1CC[C@@H](OCCCc2ccccc2)C1 ZINC000176742790 936158316 /nfs/dbraw/zinc/15/83/16/936158316.db2.gz SLJZWSOLLXJAEQ-QGZVFWFLSA-N 0 0 372.396 3.598 20 5 FHBDRN CN(c1ccc2ccccc2c1)S(=O)(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000121950593 936179880 /nfs/dbraw/zinc/17/98/80/936179880.db2.gz NIYMYOOVDJMYGN-UHFFFAOYSA-N 0 0 360.366 3.712 20 5 FHBDRN NC(=O)Nc1ccc(CNc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)cc1 ZINC000078504930 936183492 /nfs/dbraw/zinc/18/34/92/936183492.db2.gz JKMZWAYNTVPZNJ-UHFFFAOYSA-N 0 0 354.288 3.716 20 5 FHBDRN COc1cccc(CC2CCN(C(=O)c3ccc([N+](=O)[O-])s3)CC2)c1 ZINC000612217898 936198599 /nfs/dbraw/zinc/19/85/99/936198599.db2.gz BPHAAGWJNFZNRK-UHFFFAOYSA-N 0 0 360.435 3.760 20 5 FHBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CCc2cccc(F)c21 ZINC000431495269 936198696 /nfs/dbraw/zinc/19/86/96/936198696.db2.gz OFDXYFFKHUZIAS-UHFFFAOYSA-N 0 0 365.158 3.699 20 5 FHBDRN O=C(Nc1ccc([C@@H]2CCOC2)cc1)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000582837556 936200321 /nfs/dbraw/zinc/20/03/21/936200321.db2.gz KRBMDXJAQMLWKB-CYBMUJFWSA-N 0 0 351.362 3.832 20 5 FHBDRN CCOc1cc(N[C@H](C)c2ncc(Br)cn2)ccc1[N+](=O)[O-] ZINC000431496714 936203912 /nfs/dbraw/zinc/20/39/12/936203912.db2.gz SXILJPGUYSFJCI-SECBINFHSA-N 0 0 367.203 3.719 20 5 FHBDRN CCOC(=O)c1ccnc(N[C@H]2C[C@H](c3ccc(F)cc3)C2)c1[N+](=O)[O-] ZINC000431497568 936209026 /nfs/dbraw/zinc/20/90/26/936209026.db2.gz RLSMIRKXRKDECM-MQMHXKEQSA-N 0 0 359.357 3.664 20 5 FHBDRN CC(C)[C@@H](O)C(C)(C)CNC(=O)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000277932083 936209888 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3.736 20 5 FHBDRN O=[N+]([O-])c1ccccc1OCC[NH+]1CCC(COc2ccccc2)CC1 ZINC000065612414 936250261 /nfs/dbraw/zinc/25/02/61/936250261.db2.gz XAXQSISTXDGDTC-UHFFFAOYSA-N 0 0 356.422 3.765 20 5 FHBDRN CC[C@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2SCCOC)C1 ZINC000135818278 936252519 /nfs/dbraw/zinc/25/25/19/936252519.db2.gz HQERZGARURXHAM-ZDUSSCGKSA-N 0 0 352.456 3.596 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CSc1nccn1-c1ccccc1 ZINC000027485979 936267424 /nfs/dbraw/zinc/26/74/24/936267424.db2.gz ZQDXWFNGDPVREO-UHFFFAOYSA-N 0 0 368.418 3.820 20 5 FHBDRN Cc1cn2c(nc(C)c2-c2noc(CNc3ccccc3[N+](=O)[O-])n2)s1 ZINC000426547302 945153209 /nfs/dbraw/zinc/15/32/09/945153209.db2.gz DSXOVLVZXQZVDZ-UHFFFAOYSA-N 0 0 370.394 3.583 20 5 FHBDRN CC(C)CO[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000582919644 936296791 /nfs/dbraw/zinc/29/67/91/936296791.db2.gz JLYBJTIWQCWWDD-GFCCVEGCSA-N 0 0 360.332 3.501 20 5 FHBDRN O=C(Nc1nc(C2CC2)cs1)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000026050656 945154811 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/nfs/dbraw/zinc/29/86/83/938298683.db2.gz FQNAKHXMWFOWJH-SECBINFHSA-N 0 0 369.290 3.649 20 5 FHBDRN Cc1cc(NC(=O)c2ncoc2[C@H]2CCCO2)c2cc([N+](=O)[O-])ccc2n1 ZINC000161765188 938299523 /nfs/dbraw/zinc/29/95/23/938299523.db2.gz PGIHOWOYEWLWDE-OAHLLOKOSA-N 0 0 368.349 3.543 20 5 FHBDRN COc1ccc(Oc2cc(CNc3ccc([N+](=O)[O-])cn3)ccn2)cc1 ZINC000052427230 938300138 /nfs/dbraw/zinc/30/01/38/938300138.db2.gz FIUJPKDZOAYXRN-UHFFFAOYSA-N 0 0 352.350 3.798 20 5 FHBDRN Cc1noc(C2CCN(Cc3ccc([N+](=O)[O-])cc3C(F)(F)F)CC2)n1 ZINC000178921827 938300592 /nfs/dbraw/zinc/30/05/92/938300592.db2.gz HLBNTSNNPWFNTI-UHFFFAOYSA-N 0 0 370.331 3.685 20 5 FHBDRN Cc1cc(F)cc(C(=O)N2CCC(COc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000176785750 938302144 /nfs/dbraw/zinc/30/21/44/938302144.db2.gz HAHYKTDXNKAUCG-UHFFFAOYSA-N 0 0 372.396 3.974 20 5 FHBDRN CN(Cc1cc2ccccc2o1)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000472293563 938305729 /nfs/dbraw/zinc/30/57/29/938305729.db2.gz KTYQZKABJLNNQA-SFHVURJKSA-N 0 0 365.389 3.578 20 5 FHBDRN CC(=O)c1ccc(CNc2cc(C(F)(F)F)ncc2[N+](=O)[O-])nc1C ZINC000278331522 938310327 /nfs/dbraw/zinc/31/03/27/938310327.db2.gz IIONMPGMTYPZAU-UHFFFAOYSA-N 0 0 354.288 3.527 20 5 FHBDRN CCc1nn(C)c(NCc2ccc(C)cc2OCC(F)(F)F)c1[N+](=O)[O-] ZINC000091737595 938319049 /nfs/dbraw/zinc/31/90/49/938319049.db2.gz PLYWYPAQOABLOI-UHFFFAOYSA-N 0 0 372.347 3.752 20 5 FHBDRN Cc1ccc(NC(=O)[C@H](OC2CCOCC2)c2ccccc2)cc1[N+](=O)[O-] ZINC000536085273 938319996 /nfs/dbraw/zinc/31/99/96/938319996.db2.gz RCYCYTXZQRLRCY-LJQANCHMSA-N 0 0 370.405 3.779 20 5 FHBDRN Cc1cc(NCc2cc(F)ccc2F)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000519156469 945164781 /nfs/dbraw/zinc/16/47/81/945164781.db2.gz MCBNBVYKWDSAAO-UHFFFAOYSA-N 0 0 356.332 3.672 20 5 FHBDRN CC(C)[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)C1(CO)CCCC1 ZINC000583640388 938335814 /nfs/dbraw/zinc/33/58/14/938335814.db2.gz JKVACQUTJAMHAZ-OAHLLOKOSA-N 0 0 354.834 3.555 20 5 FHBDRN CCc1cccc(CC)c1NC(=O)CN1CCc2c1cccc2[N+](=O)[O-] ZINC000178946196 938337577 /nfs/dbraw/zinc/33/75/77/938337577.db2.gz GHHAXQYOPWQIRB-UHFFFAOYSA-N 0 0 353.422 3.721 20 5 FHBDRN CCCCc1c(C)nc2nc(Sc3ncccc3[N+](=O)[O-])nn2c1C ZINC000052487370 938339423 /nfs/dbraw/zinc/33/94/23/938339423.db2.gz UYGGJJCSEWJJMQ-UHFFFAOYSA-N 0 0 358.427 3.538 20 5 FHBDRN CC(C)(C)c1ncc(C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)cn1 ZINC000583657634 938346222 /nfs/dbraw/zinc/34/62/22/938346222.db2.gz WAEMNNQXMGLFHW-UHFFFAOYSA-N 0 0 368.315 3.953 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)NCC(C)(C)c1ccccc1F ZINC000536097752 938347836 /nfs/dbraw/zinc/34/78/36/938347836.db2.gz CYXRZSSSABEERX-UHFFFAOYSA-N 0 0 360.385 3.840 20 5 FHBDRN Cc1nc([C@@H]2CCCCCN2C(=O)[C@H](C)c2cccc([N+](=O)[O-])c2)no1 ZINC000583668258 938347864 /nfs/dbraw/zinc/34/78/64/938347864.db2.gz MHNLOSXKFLDRGC-WBMJQRKESA-N 0 0 358.398 3.534 20 5 FHBDRN O=C(NCCc1cccs1)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC000536103834 938359570 /nfs/dbraw/zinc/35/95/70/938359570.db2.gz SJTVAYNZHKGMJH-UHFFFAOYSA-N 0 0 353.403 3.691 20 5 FHBDRN Cc1nn(Cc2ccc(C(=O)N3CCCCC[C@@H]3C)cc2)c(C)c1[N+](=O)[O-] ZINC000074650214 938361154 /nfs/dbraw/zinc/36/11/54/938361154.db2.gz PYHFDVAIABFNOV-AWEZNQCLSA-N 0 0 370.453 3.861 20 5 FHBDRN CC(C)[C@@H](NC(=O)CNc1ccccc1[N+](=O)[O-])c1ccc(F)cc1F ZINC000468346080 938371654 /nfs/dbraw/zinc/37/16/54/938371654.db2.gz MMHVHXUMEFXKCP-GOSISDBHSA-N 0 0 363.364 3.798 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)c2nccn2-c2ccccc2)c1 ZINC000583713619 938372086 /nfs/dbraw/zinc/37/20/86/938372086.db2.gz FWCXKWAJJFXCAE-CQSZACIVSA-N 0 0 350.378 3.580 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)N(CCc2ccccc2F)C2CCCC2)n1 ZINC000427184667 945169235 /nfs/dbraw/zinc/16/92/35/945169235.db2.gz ISSJVGCANAVQSV-UHFFFAOYSA-N 0 0 374.416 3.578 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)Nc1ccc2c(c1)CCCO2 ZINC000506005946 945169468 /nfs/dbraw/zinc/16/94/68/945169468.db2.gz AJULNEXUJIMTQL-UHFFFAOYSA-N 0 0 355.394 3.751 20 5 FHBDRN CC(C)(C(=O)N1CCC(c2ccncc2)CC1)c1ccccc1[N+](=O)[O-] ZINC000507358186 945170311 /nfs/dbraw/zinc/17/03/11/945170311.db2.gz LXUGFJMGNWWADY-UHFFFAOYSA-N 0 0 353.422 3.674 20 5 FHBDRN Cc1ccccc1[C@@H](C)NC(=O)[C@@H](C)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000046599518 938430965 /nfs/dbraw/zinc/43/09/65/938430965.db2.gz XBUPCUFPOJMAEJ-HZPDHXFCSA-N 0 0 355.438 3.601 20 5 FHBDRN Cc1ccccc1OCCN(C)C(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000052616701 938444262 /nfs/dbraw/zinc/44/42/62/938444262.db2.gz MYFFHGBJDUFBTA-UHFFFAOYSA-N 0 0 353.378 3.536 20 5 FHBDRN C[C@@H](Nc1cc(C(F)(F)F)ncc1[N+](=O)[O-])c1ccc([S@@](C)=O)cc1 ZINC000278453636 938444840 /nfs/dbraw/zinc/44/48/40/938444840.db2.gz RZGDDRFUAQNSMI-UVJXUPGXSA-N 0 0 373.356 3.919 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)Nc2nncn2-c2ccccc2)cc1[N+](=O)[O-] ZINC000536147790 938453541 /nfs/dbraw/zinc/45/35/41/938453541.db2.gz DKHIJCXIPDMDJY-UHFFFAOYSA-N 0 0 365.393 3.725 20 5 FHBDRN O=[N+]([O-])c1cccc2c(N3CCC[C@@H](Oc4ncccc4F)C3)ccnc21 ZINC000432140551 945176387 /nfs/dbraw/zinc/17/63/87/945176387.db2.gz WXNDMCRLJTZCGK-CYBMUJFWSA-N 0 0 368.368 3.725 20 5 FHBDRN CCO[C@@H](C)c1nc(Cn2ccc3cc([N+](=O)[O-])ccc3c2=O)cs1 ZINC000583872060 938462231 /nfs/dbraw/zinc/46/22/31/938462231.db2.gz NMIARXUJPGRQAD-NSHDSACASA-N 0 0 359.407 3.512 20 5 FHBDRN O=C(NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N[C@H]1CCC[C@@H]2C[C@@H]21 ZINC000458711214 938466344 /nfs/dbraw/zinc/46/63/44/938466344.db2.gz XAOYRKNNGVKHHF-SWHYSGLUSA-N 0 0 357.332 3.601 20 5 FHBDRN COc1ccccc1-c1cccc(NC(=O)c2cc([N+](=O)[O-])c[nH]c2=O)c1 ZINC000583923427 938487583 /nfs/dbraw/zinc/48/75/83/938487583.db2.gz LYHCJCQTDGITGY-UHFFFAOYSA-N 0 0 365.345 3.623 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ncc3c(n2)CCC(C)(C)C3)c1 ZINC000278506959 938488617 /nfs/dbraw/zinc/48/86/17/938488617.db2.gz MGPHZZLMARPKNJ-UHFFFAOYSA-N 0 0 372.450 3.874 20 5 FHBDRN CCCNC(=O)C1CCN(c2c(Cl)cc(Cl)cc2[N+](=O)[O-])CC1 ZINC000583951535 938497277 /nfs/dbraw/zinc/49/72/77/938497277.db2.gz FKJHZYYONAJGDQ-UHFFFAOYSA-N 0 0 360.241 3.644 20 5 FHBDRN CC(C)Oc1ccc(Nc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)cc1 ZINC000302615486 938498738 /nfs/dbraw/zinc/49/87/38/938498738.db2.gz FWQLLZGJNYGGIU-UHFFFAOYSA-N 0 0 350.396 3.529 20 5 FHBDRN CCc1nn(C)c(Oc2ccc(C(=O)Nc3ccccc3)cc2)c1[N+](=O)[O-] ZINC000584015347 938546661 /nfs/dbraw/zinc/54/66/61/938546661.db2.gz BJXXEOQLTLEQAO-UHFFFAOYSA-N 0 0 366.377 3.935 20 5 FHBDRN CC(=O)c1ccc([N+](=O)[O-])cc1N1CCO[C@@H](CCc2ccccc2)C1 ZINC000584015373 938546727 /nfs/dbraw/zinc/54/67/27/938546727.db2.gz DECXNTJTDUXBIV-SFHVURJKSA-N 0 0 354.406 3.635 20 5 FHBDRN CC[C@@H](NS(=O)(=O)Cc1cccc([N+](=O)[O-])c1)c1ccc(Cl)cc1 ZINC000151482623 938550240 /nfs/dbraw/zinc/55/02/40/938550240.db2.gz PCAOFQDXVGGRFF-MRXNPFEDSA-N 0 0 368.842 3.819 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N(C)[C@@H](C)c1cc(F)ccc1F ZINC000427195160 945185872 /nfs/dbraw/zinc/18/58/72/945185872.db2.gz AZTVSCLOFNPOHK-JTQLQIEISA-N 0 0 350.321 3.715 20 5 FHBDRN Cc1ccc(S(=O)(=O)N[C@H](c2ccco2)c2ccccc2)cc1[N+](=O)[O-] ZINC000052782409 938579766 /nfs/dbraw/zinc/57/97/66/938579766.db2.gz DGMYNEOUQYZTDJ-SFHVURJKSA-N 0 0 372.402 3.564 20 5 FHBDRN COC(=O)C(C)(C)[C@H]1CCCN(c2ccc([N+](=O)[O-])c3cccnc32)C1 ZINC000092950201 945187851 /nfs/dbraw/zinc/18/78/51/945187851.db2.gz KLOWLHMRYWCAGL-ZDUSSCGKSA-N 0 0 357.410 3.559 20 5 FHBDRN CC[C@H](C)[C@@H](NC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1)C(F)(F)F ZINC000584092853 938594698 /nfs/dbraw/zinc/59/46/98/938594698.db2.gz MMCUIQCWDMNQRJ-IINYFYTJSA-N 0 0 359.348 3.640 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)NCc1cc(Br)ccc1F ZINC000052798476 938595406 /nfs/dbraw/zinc/59/54/06/938595406.db2.gz ZQUOLOBIDQOYMV-UHFFFAOYSA-N 0 0 367.174 3.735 20 5 FHBDRN O=c1[nH]cnc2cc(NCc3ccc(C4CC4)cc3F)c([N+](=O)[O-])cc12 ZINC000584089229 938595696 /nfs/dbraw/zinc/59/56/96/938595696.db2.gz XWGHQODEPAOOEF-UHFFFAOYSA-N 0 0 354.341 3.872 20 5 FHBDRN Cc1ccnc([C@@H]2CCN(C(=O)C(C)(C)c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000584122839 938609200 /nfs/dbraw/zinc/60/92/00/938609200.db2.gz DDPKQJKHASVUNN-OAHLLOKOSA-N 0 0 353.422 3.592 20 5 FHBDRN CN(C(=O)c1cnc(-c2ccccc2F)s1)c1ccc([N+](=O)[O-])nc1 ZINC000584136586 938614426 /nfs/dbraw/zinc/61/44/26/938614426.db2.gz HIGOFXFKMUWYEG-UHFFFAOYSA-N 0 0 358.354 3.529 20 5 FHBDRN Cc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2SC2CCCC2)nn1C ZINC000162054094 938616893 /nfs/dbraw/zinc/61/68/93/938616893.db2.gz MTCSKQVUHQMQCN-UHFFFAOYSA-N 0 0 360.439 3.924 20 5 FHBDRN CC(C)c1nn(C)cc1-c1noc(-c2c[nH]c3cc([N+](=O)[O-])ccc23)n1 ZINC000426220328 945190877 /nfs/dbraw/zinc/19/08/77/945190877.db2.gz OTZMSKHVUXOLLY-UHFFFAOYSA-N 0 0 352.354 3.650 20 5 FHBDRN COc1c(C(=O)N[C@H]2CCc3sc(Cl)cc32)cccc1[N+](=O)[O-] ZINC000584203512 938639503 /nfs/dbraw/zinc/63/95/03/938639503.db2.gz QXCSDKNOKOQXBM-JTQLQIEISA-N 0 0 352.799 3.736 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N2CCCc3c([N+](=O)[O-])cccc32)c1 ZINC000162081643 938639549 /nfs/dbraw/zinc/63/95/49/938639549.db2.gz HQJQOWJLJXQCQJ-UHFFFAOYSA-N 0 0 373.390 3.818 20 5 FHBDRN C[C@H](C(=O)N1CCC(Cc2cccnc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000584206705 938640734 /nfs/dbraw/zinc/64/07/34/938640734.db2.gz VAMGHUNKKACJJJ-HNNXBMFYSA-N 0 0 353.422 3.575 20 5 FHBDRN Cc1ccc([C@H](C)N(C)C(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000278684302 938648362 /nfs/dbraw/zinc/64/83/62/938648362.db2.gz MHJQELSFBQJUKI-ZDUSSCGKSA-N 0 0 367.409 3.682 20 5 FHBDRN Cn1cc(C(=O)NCc2cccc(Cl)c2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000052932972 938662506 /nfs/dbraw/zinc/66/25/06/938662506.db2.gz MECPWLGTRFZRIP-UHFFFAOYSA-N 0 0 370.796 3.579 20 5 FHBDRN O=C(OCc1ccnc(Cl)c1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000176817447 938671735 /nfs/dbraw/zinc/67/17/35/938671735.db2.gz ZZMWDCQFOANVQI-UHFFFAOYSA-N 0 0 371.574 3.763 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])o1)N1CCC(c2c[nH]c3cc(F)ccc32)CC1 ZINC000110970082 945196409 /nfs/dbraw/zinc/19/64/09/945196409.db2.gz GISBPWIGXZSPGQ-UHFFFAOYSA-N 0 0 357.341 3.828 20 5 FHBDRN COc1ccc(NC(=O)NCC(C)(C)c2ccccc2OC)cc1[N+](=O)[O-] ZINC000611823771 938695040 /nfs/dbraw/zinc/69/50/40/938695040.db2.gz SJRHMIMIYUGGRZ-UHFFFAOYSA-N 0 0 373.409 3.711 20 5 FHBDRN COc1ccc(NC(=O)NCc2ccccc2N2CCCC2)cc1[N+](=O)[O-] ZINC000611825628 938696764 /nfs/dbraw/zinc/69/67/64/938696764.db2.gz ATHDPAHSYAGIBI-UHFFFAOYSA-N 0 0 370.409 3.525 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)OCc1ccc(-c2ccccc2)cc1 ZINC000065660309 938721812 /nfs/dbraw/zinc/72/18/12/938721812.db2.gz LBBQKWUUBPUBNQ-UHFFFAOYSA-N 0 0 365.389 3.900 20 5 FHBDRN C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@H](Oc2ccccc2)C1 ZINC000843619147 938784420 /nfs/dbraw/zinc/78/44/20/938784420.db2.gz HZTCTFGPSHQERK-LLLGYDHXSA-N 0 0 352.390 3.678 20 5 FHBDRN Cc1noc(C)c1[C@H](C)NCc1ccc(Br)cc1[N+](=O)[O-] ZINC000162199817 938796050 /nfs/dbraw/zinc/79/60/50/938796050.db2.gz JGFCXFMFPBCMLN-QMMMGPOBSA-N 0 0 354.204 3.813 20 5 FHBDRN Cc1ccc(NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)cc1C(=O)N(C)C ZINC000081630035 938799675 /nfs/dbraw/zinc/79/96/75/938799675.db2.gz RPZUSBWFZAPHEF-UHFFFAOYSA-N 0 0 369.421 3.521 20 5 FHBDRN CC[C@H]1CCCCN1C(=O)CSCc1ccc(OC)c([N+](=O)[O-])c1 ZINC000506017299 945206323 /nfs/dbraw/zinc/20/63/23/945206323.db2.gz QCKAPKLDEIUCOK-AWEZNQCLSA-N 0 0 352.456 3.628 20 5 FHBDRN CC(C)NC(=O)c1ccc(N2CCC[C@H](C(F)(F)F)[C@H]2C)c([N+](=O)[O-])c1 ZINC000480312857 938832019 /nfs/dbraw/zinc/83/20/19/938832019.db2.gz YKOJCCOXDROJHY-YPMHNXCESA-N 0 0 373.375 3.900 20 5 FHBDRN CC(C)Cc1ccc(C(=O)N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1 ZINC000135543080 938850316 /nfs/dbraw/zinc/85/03/16/938850316.db2.gz ZFTMSGIKTYEHOE-KRWDZBQOSA-N 0 0 368.437 3.515 20 5 FHBDRN CCC(=O)c1ccc(N[C@@H]2CCCN(C3CCCCC3)C2=O)c([N+](=O)[O-])c1 ZINC000480330556 938859712 /nfs/dbraw/zinc/85/97/12/938859712.db2.gz RUYRYMAZFCJNMP-QGZVFWFLSA-N 0 0 373.453 3.923 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(N2CCN(c3nccc4sccc43)CC2)n1 ZINC000584432153 938867271 /nfs/dbraw/zinc/86/72/71/938867271.db2.gz UCPBOPAVESKPEU-UHFFFAOYSA-N 0 0 369.450 3.543 20 5 FHBDRN C[C@H](Nc1ccc([N+](=O)[O-])c(-c2ccccc2)n1)c1nnc2ccccn21 ZINC000090068947 938869370 /nfs/dbraw/zinc/86/93/70/938869370.db2.gz FEBUATGBMJZCSE-ZDUSSCGKSA-N 0 0 360.377 3.873 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CSc1nnc(-c2ccccc2)n1C ZINC000024216431 938869475 /nfs/dbraw/zinc/86/94/75/938869475.db2.gz RIUIYOTWYMTZFJ-UHFFFAOYSA-N 0 0 356.407 3.691 20 5 FHBDRN O=C(c1ccccc1OC1CC1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000584433531 938873107 /nfs/dbraw/zinc/87/31/07/938873107.db2.gz GDDOBWKPUGTKQU-UHFFFAOYSA-N 0 0 352.390 3.941 20 5 FHBDRN C[C@H](CCNC(=O)N1CCC(n2ccc([N+](=O)[O-])n2)CC1)CC(C)(C)C ZINC000426226306 945212024 /nfs/dbraw/zinc/21/20/24/945212024.db2.gz HDHNZRRGVNMFOL-CQSZACIVSA-N 0 0 365.478 3.600 20 5 FHBDRN COCc1nc(CNCc2ccc(-c3ccccc3[N+](=O)[O-])o2)cs1 ZINC000584439867 938882449 /nfs/dbraw/zinc/88/24/49/938882449.db2.gz PWZJYGWMJKJCQO-UHFFFAOYSA-N 0 0 359.407 3.748 20 5 FHBDRN CC[C@@H](OC(=O)c1nnn(-c2ccccc2)c1C)c1cccc([N+](=O)[O-])c1 ZINC001267373932 938897315 /nfs/dbraw/zinc/89/73/15/938897315.db2.gz CLGKKZBDEVHGSL-QGZVFWFLSA-N 0 0 366.377 3.792 20 5 FHBDRN CCOc1ccc(Oc2ccc(C(=O)c3nccn3C)cc2[N+](=O)[O-])cc1 ZINC000480412441 938908309 /nfs/dbraw/zinc/90/83/09/938908309.db2.gz AOIZCZAUBHFQSW-UHFFFAOYSA-N 0 0 367.361 3.750 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCSc2ncccc21 ZINC000158855825 938911379 /nfs/dbraw/zinc/91/13/79/938911379.db2.gz XUIWXOGKDLTRBI-UHFFFAOYSA-N 0 0 361.448 3.854 20 5 FHBDRN CCS[C@@H]1CCCCN(C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)C1 ZINC000480418195 938911999 /nfs/dbraw/zinc/91/19/99/938911999.db2.gz KCVYOOJXLUKRGG-OAHLLOKOSA-N 0 0 363.483 3.917 20 5 FHBDRN C[C@H](Nc1ccc([N+](=O)[O-])c(OC(F)F)c1)[C@@H](O)c1ccc(F)cc1 ZINC000092653343 938917045 /nfs/dbraw/zinc/91/70/45/938917045.db2.gz QJKWKTFGCOOGIU-BJOHPYRUSA-N 0 0 356.300 3.869 20 5 FHBDRN CC(C)c1ccc(CN2CCC([C@@H](O)C(F)(F)F)CC2)cc1[N+](=O)[O-] ZINC000093766534 938929991 /nfs/dbraw/zinc/92/99/91/938929991.db2.gz MTZYISUZKHKUEL-MRXNPFEDSA-N 0 0 360.376 3.853 20 5 FHBDRN CCCC1CCC(NC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000065681024 938942068 /nfs/dbraw/zinc/94/20/68/938942068.db2.gz PQNASZVXSOCYDI-UHFFFAOYSA-N 0 0 356.426 3.869 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)Nc1nc(-c2ccc[nH]2)cs1 ZINC000028252973 938943134 /nfs/dbraw/zinc/94/31/34/938943134.db2.gz JTLRXJRNOBFUSX-UHFFFAOYSA-N 0 0 360.420 3.777 20 5 FHBDRN CCS[C@H]1CCCCN(C(=O)CSc2ccccc2[N+](=O)[O-])C1 ZINC000480452455 938946300 /nfs/dbraw/zinc/94/63/00/938946300.db2.gz YJDLHONTKVMLCX-ZDUSSCGKSA-N 0 0 354.497 3.821 20 5 FHBDRN COc1ccc(C(=O)Nc2ccccc2NCC(F)(F)F)cc1[N+](=O)[O-] ZINC000142261161 938948647 /nfs/dbraw/zinc/94/86/47/938948647.db2.gz JVXUZOQVZOOETM-UHFFFAOYSA-N 0 0 369.299 3.830 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccc(C(=O)NC2CCCC2)cc1 ZINC000511824707 945217910 /nfs/dbraw/zinc/21/79/10/945217910.db2.gz SYBYMTRUUQQXOP-UHFFFAOYSA-N 0 0 367.405 3.828 20 5 FHBDRN CC(C)(NS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000728591708 938957673 /nfs/dbraw/zinc/95/76/73/938957673.db2.gz KSDCVTUSBDHYCR-UHFFFAOYSA-N 0 0 372.805 3.601 20 5 FHBDRN O=C(C[C@H]1CCCN1c1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1ccccc1 ZINC000302038263 938962893 /nfs/dbraw/zinc/96/28/93/938962893.db2.gz KONSXNBJBLKPIE-CQSZACIVSA-N 0 0 355.350 3.745 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2ccc(CN3CCN(c4ccccn4)CC3)o2)cc1 ZINC000158885672 938964088 /nfs/dbraw/zinc/96/40/88/938964088.db2.gz YVNABGKAXHFVTH-UHFFFAOYSA-N 0 0 364.405 3.572 20 5 FHBDRN Cc1ccnc(Oc2ccccc2I)c1[N+](=O)[O-] ZINC000070495747 938965599 /nfs/dbraw/zinc/96/55/99/938965599.db2.gz JAZRUVNXINLKSU-UHFFFAOYSA-N 0 0 356.119 3.695 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)N2CC(C)(C)[C@@H]2C(C)C)cc1SC ZINC000480518086 938967320 /nfs/dbraw/zinc/96/73/20/938967320.db2.gz JDUPUCIAJDAFHB-HNNXBMFYSA-N 0 0 352.456 3.832 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)Nc1cccc(Oc2cnccn2)c1 ZINC000511263149 938967879 /nfs/dbraw/zinc/96/78/79/938967879.db2.gz WJAJVJQMXSCQDO-UHFFFAOYSA-N 0 0 350.334 3.738 20 5 FHBDRN CC[C@@H](C)n1ncc(C(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])c1C ZINC000480539220 938969936 /nfs/dbraw/zinc/96/99/36/938969936.db2.gz KANPMJMSTVTJPW-LLVKDONJSA-N 0 0 364.833 3.697 20 5 FHBDRN O=C(CSc1ncccc1[N+](=O)[O-])NCC1(c2ccccc2)CCCC1 ZINC000065692906 938972159 /nfs/dbraw/zinc/97/21/59/938972159.db2.gz 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LVSDBYUYAVVREO-JTQLQIEISA-N 0 0 357.391 3.588 20 5 FHBDRN Cc1cccc(NC(=O)CSCC(=O)Nc2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000015409296 945273952 /nfs/dbraw/zinc/27/39/52/945273952.db2.gz MEBPWAGSNACQKO-UHFFFAOYSA-N 0 0 373.434 3.522 20 5 FHBDRN COc1cc(C(=O)N2CCC[C@@H]2Cc2ccc(F)cc2)ccc1[N+](=O)[O-] ZINC000511851730 945274501 /nfs/dbraw/zinc/27/45/01/945274501.db2.gz KSQQSZIGUDNSCU-MRXNPFEDSA-N 0 0 358.369 3.590 20 5 FHBDRN Cc1ccc(N2CCCN(C(=O)CCc3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000124390801 945274583 /nfs/dbraw/zinc/27/45/83/945274583.db2.gz PXFNOBDAMCADRV-UHFFFAOYSA-N 0 0 367.449 3.575 20 5 FHBDRN O=C(Nc1cccc(-c2cccs2)c1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000124383499 945274697 /nfs/dbraw/zinc/27/46/97/945274697.db2.gz POYNZEVECNOANO-UHFFFAOYSA-N 0 0 367.386 3.901 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1-c1nc(-c2ccc(OC(C)(C)C)cn2)no1 ZINC000426585834 945277023 /nfs/dbraw/zinc/27/70/23/945277023.db2.gz HITWNLCBXOMEJE-UHFFFAOYSA-N 0 0 370.365 3.893 20 5 FHBDRN O=C(Nc1ccnn1-c1ccc([N+](=O)[O-])cc1)c1cc(F)cc2ccoc21 ZINC001125790614 939875781 /nfs/dbraw/zinc/87/57/81/939875781.db2.gz DPBUIABHMIVFOY-UHFFFAOYSA-N 0 0 366.308 3.918 20 5 FHBDRN CC(C)CC[C@](C)(O)CNC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000440166791 945278095 /nfs/dbraw/zinc/27/80/95/945278095.db2.gz CMJAPQCZPJQJNL-KRWDZBQOSA-N 0 0 350.440 3.727 20 5 FHBDRN CCc1n[nH]c(C(=O)N2CCCC[C@H]2c2cc3ccccc3[nH]2)c1[N+](=O)[O-] ZINC000188446482 939877630 /nfs/dbraw/zinc/87/76/30/939877630.db2.gz YBLYPACBRYPSKA-INIZCTEOSA-N 0 0 367.409 3.729 20 5 FHBDRN O=C(Nc1ccc(OC(F)F)cc1)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000179533131 939882545 /nfs/dbraw/zinc/88/25/45/939882545.db2.gz CNDQLIMQOWGNDX-UHFFFAOYSA-N 0 0 359.288 3.997 20 5 FHBDRN O=C(c1n[nH]cc1[N+](=O)[O-])N1CCC[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000179551855 939884093 /nfs/dbraw/zinc/88/40/93/939884093.db2.gz SQSSMNBLXIWDFZ-NSHDSACASA-N 0 0 355.181 3.602 20 5 FHBDRN COc1ccc(CCNC(=O)c2c(C)cc(C)c([N+](=O)[O-])c2C)cc1F ZINC000179539031 939884542 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CC(C)c1nn(C)cc1-c1noc(-c2ccc(NC3CC3)c([N+](=O)[O-])c2)n1 ZINC000426247777 945280942 /nfs/dbraw/zinc/28/09/42/945280942.db2.gz HAKOTNXSJUBZQS-UHFFFAOYSA-N 0 0 368.397 3.743 20 5 FHBDRN O=C(Nc1c[nH]nc1-c1ccccn1)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000179666246 939912827 /nfs/dbraw/zinc/91/28/27/939912827.db2.gz FWNDDEDTKZDJTK-UHFFFAOYSA-N 0 0 365.374 3.847 20 5 FHBDRN O=C(N[C@@H]1C[C@@H]1c1cccc(F)c1)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000179670599 939913472 /nfs/dbraw/zinc/91/34/72/939913472.db2.gz FHOCICXJJGMCCY-HZPDHXFCSA-N 0 0 351.337 3.568 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1CC[C@@H]1c1ccc(Cl)cc1 ZINC000511331208 939913781 /nfs/dbraw/zinc/91/37/81/939913781.db2.gz CXEWXWRHTLLAHO-CQSZACIVSA-N 0 0 366.826 3.692 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CCO[C@H](c2ccc(F)c(C)c2)C1 ZINC000136302384 939914926 /nfs/dbraw/zinc/91/49/26/939914926.db2.gz FWMXKVRKTIUKGA-SFHVURJKSA-N 0 0 373.384 3.956 20 5 FHBDRN CC(C)N(Cc1cccs1)C(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000278785267 939915966 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FHBDRN COc1ccc(NC(=O)c2ccc(-c3ccco3)nc2C)cc1[N+](=O)[O-] ZINC000543858006 939947767 /nfs/dbraw/zinc/94/77/67/939947767.db2.gz JXIOWJHCGDMWPW-UHFFFAOYSA-N 0 0 353.334 3.819 20 5 FHBDRN COCCN(C(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-])[C@H]1CCC[C@H]1C ZINC000410765837 939954796 /nfs/dbraw/zinc/95/47/96/939954796.db2.gz YAFFNYQWTQCJPU-RISCZKNCSA-N 0 0 374.359 3.891 20 5 FHBDRN CC(C)(C(=O)Nc1ncc2c(n1)CCC(C)(C)C2)c1ccccc1[N+](=O)[O-] ZINC000410776251 939957040 /nfs/dbraw/zinc/95/70/40/939957040.db2.gz OPMNVOQLPLWWQP-UHFFFAOYSA-N 0 0 368.437 3.816 20 5 FHBDRN Cc1nc(-c2cccc(NC(=O)c3cc([N+](=O)[O-])cnc3C)c2)[nH]c1C ZINC000364517381 939957845 /nfs/dbraw/zinc/95/78/45/939957845.db2.gz XXUGQNJSMVUQLX-UHFFFAOYSA-N 0 0 351.366 3.557 20 5 FHBDRN COc1ccc(NC(=O)c2cc([N+](=O)[O-])c[nH]2)cc1Cc1ccccc1 ZINC000053094214 939958894 /nfs/dbraw/zinc/95/88/94/939958894.db2.gz GHZVYUCBZIVHGW-UHFFFAOYSA-N 0 0 351.362 3.775 20 5 FHBDRN Cc1c(NC(=O)Cc2cc(Br)ccc2F)cccc1[N+](=O)[O-] ZINC000136428450 939966419 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COC(=O)c1cc(C(=O)N2CC[C@@H](C)c3cccc(C)c32)cc([N+](=O)[O-])c1 ZINC000410985460 939981244 /nfs/dbraw/zinc/98/12/44/939981244.db2.gz VDTROUVBIYNOQZ-GFCCVEGCSA-N 0 0 368.389 3.844 20 5 FHBDRN COc1ccc2c(n1)N(C(=O)c1cc([N+](=O)[O-])ccc1SC(C)C)CC2 ZINC000411053923 939991608 /nfs/dbraw/zinc/99/16/08/939991608.db2.gz ZGLQRTIURNYEJC-UHFFFAOYSA-N 0 0 373.434 3.702 20 5 FHBDRN COc1cccc(C(=O)NC2(Cc3cccc(Cl)c3)CC2)c1[N+](=O)[O-] ZINC000411058754 939991654 /nfs/dbraw/zinc/99/16/54/939991654.db2.gz DHADESBYQGIQBB-UHFFFAOYSA-N 0 0 360.797 3.762 20 5 FHBDRN COc1ccc(C(=O)Nc2ncc(-c3ccccc3)s2)cc1[N+](=O)[O-] ZINC000047542842 945287699 /nfs/dbraw/zinc/28/76/99/945287699.db2.gz HPQVOQLNBWJOMC-UHFFFAOYSA-N 0 0 355.375 3.979 20 5 FHBDRN COc1ccc2c(c1)CCCN(C(=O)c1cc([N+](=O)[O-])ccc1Cl)C2 ZINC000728612093 939996222 /nfs/dbraw/zinc/99/62/22/939996222.db2.gz KJSJJBDWSNOCPS-UHFFFAOYSA-N 0 0 360.797 3.845 20 5 FHBDRN CC(C)c1ccc(C(=O)Nc2ccc3c(n2)CCCC3=O)cc1[N+](=O)[O-] ZINC000411069307 939996883 /nfs/dbraw/zinc/99/68/83/939996883.db2.gz GCKJWDXXOZOTEE-UHFFFAOYSA-N 0 0 353.378 3.885 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H]1CC[C@@H]2CCCC[C@@H]2C1 ZINC000411133947 940002288 /nfs/dbraw/zinc/00/22/88/940002288.db2.gz ISDXCEFRICDMER-ARFHVFGLSA-N 0 0 373.453 3.625 20 5 FHBDRN CC[C@](C)(O)CN(Cc1ccccc1)c1ncnc2ccc([N+](=O)[O-])cc21 ZINC000615179663 940006812 /nfs/dbraw/zinc/00/68/12/940006812.db2.gz JYNBFCSQYBHFMZ-FQEVSTJZSA-N 0 0 366.421 3.706 20 5 FHBDRN Nc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC[C@H]1c1nc2ccccc2o1 ZINC000364932319 940024921 /nfs/dbraw/zinc/02/49/21/940024921.db2.gz HWWILYVSXGSORD-INIZCTEOSA-N 0 0 366.377 3.686 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N[C@@H](c2ccccc2)C2CC2)c1F ZINC000411290305 940027856 /nfs/dbraw/zinc/02/78/56/940027856.db2.gz IOGDCWBMCGAAEG-IBGZPJMESA-N 0 0 358.369 3.553 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCC[C@@H]1c1cccc2ccccc21 ZINC000065892802 940029966 /nfs/dbraw/zinc/02/99/66/940029966.db2.gz VHQDELOGWOAQQB-GOSISDBHSA-N 0 0 364.405 3.617 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N(Cc2cccs2)C2CC2)c1F ZINC000411322452 940031519 /nfs/dbraw/zinc/03/15/19/940031519.db2.gz IIUTZNGNCGYIMP-UHFFFAOYSA-N 0 0 364.398 3.538 20 5 FHBDRN CCN(Cc1ccc(OC)cc1)C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000411359851 940035850 /nfs/dbraw/zinc/03/58/50/940035850.db2.gz YJLZIYIKFLNFGB-RBUKOAKNSA-N 0 0 354.406 3.756 20 5 FHBDRN CC(C)Oc1ccc(CNC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)cc1 ZINC000411367471 940036585 /nfs/dbraw/zinc/03/65/85/940036585.db2.gz ZZCSXFARZVGZIF-RBUKOAKNSA-N 0 0 354.406 3.802 20 5 FHBDRN CCC1CCC(N(C(=O)C(=O)Nc2ccc([N+](=O)[O-])c(C)c2)C2CC2)CC1 ZINC000411382079 940041037 /nfs/dbraw/zinc/04/10/37/940041037.db2.gz DISXZIXPSDSIFX-UHFFFAOYSA-N 0 0 373.453 3.802 20 5 FHBDRN Cc1ccn(C2CCN(C(=O)N[C@H](C)c3ccc(C)c([N+](=O)[O-])c3)CC2)n1 ZINC000365004874 940041774 /nfs/dbraw/zinc/04/17/74/940041774.db2.gz UOZKKXHLHCCNTK-OAHLLOKOSA-N 0 0 371.441 3.516 20 5 FHBDRN CCOc1cccc(NC2CCN(C(=O)c3ccoc3C)CC2)c1[N+](=O)[O-] ZINC000365046028 940043400 /nfs/dbraw/zinc/04/34/00/940043400.db2.gz PLOYMMQJUIBMQM-UHFFFAOYSA-N 0 0 373.409 3.612 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)C(=O)N(C)[C@H](C)C1CCCCC1 ZINC000411514631 940056376 /nfs/dbraw/zinc/05/63/76/940056376.db2.gz XRJJMHDRYSMDON-CQSZACIVSA-N 0 0 361.442 3.577 20 5 FHBDRN CC(C)Oc1cc(C(=O)N(C)CCc2ccc(F)cc2)ccc1[N+](=O)[O-] ZINC000411601125 940069423 /nfs/dbraw/zinc/06/94/23/940069423.db2.gz GCWYTJNVLVNXLA-UHFFFAOYSA-N 0 0 360.385 3.836 20 5 FHBDRN Cc1ccc(-c2noc(COC(=O)c3cccc(C)c3[N+](=O)[O-])n2)cc1 ZINC000013159752 940076205 /nfs/dbraw/zinc/07/62/05/940076205.db2.gz LTXNNLNPCFUPMS-UHFFFAOYSA-N 0 0 353.334 3.619 20 5 FHBDRN CCCN(CCc1ccccn1)C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000411634295 940080222 /nfs/dbraw/zinc/08/02/22/940080222.db2.gz PCYDPBGRYUTRAW-RBUKOAKNSA-N 0 0 353.422 3.575 20 5 FHBDRN COc1ccc(NC(=O)/C=C(\C)Cc2ccccc2OC)c([N+](=O)[O-])c1 ZINC000255867140 940081690 /nfs/dbraw/zinc/08/16/90/940081690.db2.gz ROKROBOXWOLCGZ-ACCUITESSA-N 0 0 356.378 3.740 20 5 FHBDRN CC[C@@H](C)NC(=O)[C@@H](C)Nc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000065945958 940086944 /nfs/dbraw/zinc/08/69/44/940086944.db2.gz GQQAWNFXVSUCMG-ZIAGYGMSSA-N 0 0 369.421 3.541 20 5 FHBDRN Cc1ccc(NC(=O)N(CCCO)[C@@H]2CCc3ccccc32)cc1[N+](=O)[O-] ZINC000085545523 940087667 /nfs/dbraw/zinc/08/76/67/940087667.db2.gz UKALNFSNGKJHON-GOSISDBHSA-N 0 0 369.421 3.807 20 5 FHBDRN C[C@@H](C(=O)NCc1c(F)c(F)cc(F)c1F)c1ccc([N+](=O)[O-])cc1F ZINC000612477999 940093708 /nfs/dbraw/zinc/09/37/08/940093708.db2.gz ZJBDUKSZDBSBCG-SSDOTTSWSA-N 0 0 374.265 3.710 20 5 FHBDRN CCC[C@@H](NC(=O)C(=O)Nc1cc([N+](=O)[O-])c(C)cc1C)C1CCCC1 ZINC000411714369 940095086 /nfs/dbraw/zinc/09/50/86/940095086.db2.gz FCTMZIGPKHQQIB-OAHLLOKOSA-N 0 0 361.442 3.625 20 5 FHBDRN COc1c(O)ccc(CN[C@H](C)c2ccccc2OC(F)F)c1[N+](=O)[O-] ZINC000892500000 940102534 /nfs/dbraw/zinc/10/25/34/940102534.db2.gz DGGTUTLBYQDZBM-SNVBAGLBSA-N 0 0 368.336 3.761 20 5 FHBDRN CCCC(=O)N1CCCC[C@@H]1c1nc(Cc2ccc([N+](=O)[O-])c(C)c2)no1 ZINC000290155949 940109488 /nfs/dbraw/zinc/10/94/88/940109488.db2.gz SIDONDDIACVBEW-MRXNPFEDSA-N 0 0 372.425 3.731 20 5 FHBDRN COc1ccc(NC(=O)CCc2cccc(OC(C)(C)C)n2)c([N+](=O)[O-])c1 ZINC000158937981 940114165 /nfs/dbraw/zinc/11/41/65/940114165.db2.gz VNFXIKGSROJLJK-UHFFFAOYSA-N 0 0 373.409 3.747 20 5 FHBDRN O=C(c1cccc([N+](=O)[O-])c1Br)N1CC[C@H](c2ccco2)C1 ZINC000365296835 940115265 /nfs/dbraw/zinc/11/52/65/940115265.db2.gz QJXMRSUKBDGUHP-JTQLQIEISA-N 0 0 365.183 3.580 20 5 FHBDRN Cc1ccc(C)n1C1CCN(C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)CC1 ZINC000411774151 940116154 /nfs/dbraw/zinc/11/61/54/940116154.db2.gz ZQXORPARGYFYNG-VQTJNVASSA-N 0 0 367.449 3.980 20 5 FHBDRN Cc1c([N+](=O)[O-])cc(C(=O)N2CCC(C)=C(c3ccco3)C2)cc1[N+](=O)[O-] ZINC000375963339 940117711 /nfs/dbraw/zinc/11/77/11/940117711.db2.gz SZLYOYIFNFXYSH-UHFFFAOYSA-N 0 0 371.349 3.724 20 5 FHBDRN Cc1ccc(S(=O)(=O)N(C)Cc2c(F)cccc2Cl)c([N+](=O)[O-])c1 ZINC000507518897 945298222 /nfs/dbraw/zinc/29/82/22/945298222.db2.gz UUYCTZOVEGENRX-UHFFFAOYSA-N 0 0 372.805 3.516 20 5 FHBDRN O=C(COCC(F)(F)F)N(CC1CC1)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000102837213 940138680 /nfs/dbraw/zinc/13/86/80/940138680.db2.gz BHLGNJBITAGOND-UHFFFAOYSA-N 0 0 366.723 3.570 20 5 FHBDRN C[C@H](C(=O)N1CCC[C@@H]1c1ccc(O)cc1)c1ccc([N+](=O)[O-])cc1F ZINC000612553746 940142179 /nfs/dbraw/zinc/14/21/79/940142179.db2.gz YUNROIGOVNTBIU-KPZWWZAWSA-N 0 0 358.369 3.907 20 5 FHBDRN COc1cc(C)ccc1CNC(=O)c1c([N+](=O)[O-])cccc1C(F)(F)F ZINC000612554904 940142709 /nfs/dbraw/zinc/14/27/09/940142709.db2.gz KDETZFHBFZKWSJ-UHFFFAOYSA-N 0 0 368.311 3.861 20 5 FHBDRN O=C(CN1CCSC2(CCC2)CC1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000411871594 940149270 /nfs/dbraw/zinc/14/92/70/940149270.db2.gz RWKBVECVHVILGD-UHFFFAOYSA-N 0 0 369.874 3.548 20 5 FHBDRN Cc1cc(NC(=O)N2CCC(c3noc(C4CC4)n3)CC2)ccc1[N+](=O)[O-] ZINC000365390210 940149490 /nfs/dbraw/zinc/14/94/90/940149490.db2.gz ZXXXIIRNVNNBRO-UHFFFAOYSA-N 0 0 371.397 3.575 20 5 FHBDRN Cn1c(C(=O)Nc2nc3c(cccc3C(F)(F)F)s2)ccc1[N+](=O)[O-] ZINC000612574197 940153262 /nfs/dbraw/zinc/15/32/62/940153262.db2.gz HYJYWBQEUDEZHA-UHFFFAOYSA-N 0 0 370.312 3.814 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]2OCCC[C@@H]2C1 ZINC000181673959 945300627 /nfs/dbraw/zinc/30/06/27/945300627.db2.gz ZXOFBROKMCMBMW-CJNGLKHVSA-N 0 0 364.467 3.736 20 5 FHBDRN CCn1c(COC(=O)c2cc([N+](=O)[O-])c(C)s2)nc2c1cccc2F ZINC000728619490 940174075 /nfs/dbraw/zinc/17/40/75/940174075.db2.gz JFGJDQGMRVCKGY-UHFFFAOYSA-N 0 0 363.370 3.830 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N1CCC(C(=O)c2cccs2)CC1 ZINC000365489265 940178675 /nfs/dbraw/zinc/17/86/75/940178675.db2.gz ZQRYXPLNNOERKJ-UHFFFAOYSA-N 0 0 358.419 3.700 20 5 FHBDRN O=C(NCc1ccccc1N1CCCC1)Nc1ccc([N+](=O)[O-])cc1F ZINC000612611345 940181906 /nfs/dbraw/zinc/18/19/06/940181906.db2.gz RQNBMYUJECFQBV-UHFFFAOYSA-N 0 0 358.373 3.656 20 5 FHBDRN CC(=O)Nc1cc(NC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)ccc1C ZINC000047547787 945301725 /nfs/dbraw/zinc/30/17/25/945301725.db2.gz QHTVUNOPSWRKMR-LBPRGKRZSA-N 0 0 356.382 3.744 20 5 FHBDRN C[C@H](CNC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1)Oc1ccccc1 ZINC000431664013 940198730 /nfs/dbraw/zinc/19/87/30/940198730.db2.gz JWLRASZYXIXOKO-CQSZACIVSA-N 0 0 357.410 3.597 20 5 FHBDRN COc1cc(N2CC[C@@H](n3ncc4ccccc43)C2)c(F)cc1[N+](=O)[O-] ZINC000511359647 940199513 /nfs/dbraw/zinc/19/95/13/940199513.db2.gz JKERJSZULCTOPO-CYBMUJFWSA-N 0 0 356.357 3.544 20 5 FHBDRN COc1cc(OCC(=O)N(CC2CCCCC2)C2CC2)ccc1[N+](=O)[O-] ZINC000066025450 940204608 /nfs/dbraw/zinc/20/46/08/940204608.db2.gz ZWYYXKQTUGEONB-UHFFFAOYSA-N 0 0 362.426 3.554 20 5 FHBDRN Cn1nc(CNc2ccc([N+](=O)[O-])c(-c3ccccc3)n2)c2ccccc21 ZINC000612666960 940208731 /nfs/dbraw/zinc/20/87/31/940208731.db2.gz OAKMFBGGBBTFLS-UHFFFAOYSA-N 0 0 359.389 3.578 20 5 FHBDRN CC[C@@H](C)NC(=O)c1ccc(NC(=O)c2cccc([N+](=O)[O-])c2C)c(C)c1 ZINC000066034973 940212482 /nfs/dbraw/zinc/21/24/82/940212482.db2.gz BWKHUGYEGFUDBI-CYBMUJFWSA-N 0 0 369.421 3.992 20 5 FHBDRN O=C(NC[C@@H](O)c1ccccc1Cl)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000124501821 945303877 /nfs/dbraw/zinc/30/38/77/945303877.db2.gz NBIPLRHDGIVKAW-CQSZACIVSA-N 0 0 370.192 3.757 20 5 FHBDRN O=C(NCc1cccc([N+](=O)[O-])c1)Nc1nc(Cc2ccccc2)cs1 ZINC000584494738 940220629 /nfs/dbraw/zinc/22/06/29/940220629.db2.gz XGSMDKHUBIIGGI-UHFFFAOYSA-N 0 0 368.418 3.964 20 5 FHBDRN O=C(c1cccc(Cl)c1Cl)N1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000376042761 940234603 /nfs/dbraw/zinc/23/46/03/940234603.db2.gz FIMBUSDPLMAVJV-UHFFFAOYSA-N 0 0 369.208 3.575 20 5 FHBDRN COc1ccccc1SCC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000124537647 945305205 /nfs/dbraw/zinc/30/52/05/945305205.db2.gz WEBPDJBGKDYACM-UHFFFAOYSA-N 0 0 372.446 3.887 20 5 FHBDRN Cc1cc(CC(=O)OCc2ccc(Oc3cccc([N+](=O)[O-])c3)cc2)no1 ZINC000177518118 940246935 /nfs/dbraw/zinc/24/69/35/940246935.db2.gz LFZKWFNZPDGOEX-UHFFFAOYSA-N 0 0 368.345 3.969 20 5 FHBDRN COc1cc(S(=O)(=O)N(C)c2ccc3ccccc3c2)ccc1[N+](=O)[O-] ZINC000124453525 945307283 /nfs/dbraw/zinc/30/72/83/945307283.db2.gz UVLBVLMXKOOIFC-UHFFFAOYSA-N 0 0 372.402 3.582 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1N1CCCC[C@H]1c1cc[nH]n1 ZINC000572644027 940269744 /nfs/dbraw/zinc/26/97/44/940269744.db2.gz ZTAKJURMNTVJGO-LBPRGKRZSA-N 0 0 351.204 3.812 20 5 FHBDRN C[C@H](Nc1ccc([N+](=O)[O-])cc1OC(F)F)c1ccc2[nH]c(=O)[nH]c2c1 ZINC000612778811 940272416 /nfs/dbraw/zinc/27/24/16/940272416.db2.gz QJYKKPWNPHNMCD-QMMMGPOBSA-N 0 0 364.308 3.951 20 5 FHBDRN Cc1cc(NC(=O)c2ccc(Br)c([N+](=O)[O-])c2)cnc1Cl ZINC000177557565 940276211 /nfs/dbraw/zinc/27/62/11/940276211.db2.gz JQLGXWDCLLCRJC-UHFFFAOYSA-N 0 0 370.590 3.966 20 5 FHBDRN C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1ncsc1C(F)(F)F ZINC000548961265 940299722 /nfs/dbraw/zinc/29/97/22/940299722.db2.gz NPDDMSXKXZERAE-ZETCQYMHSA-N 0 0 357.313 3.662 20 5 FHBDRN Nc1ccc(-c2noc([C@H]3CCc4c3cccc4Cl)n2)cc1[N+](=O)[O-] ZINC000612856143 940315190 /nfs/dbraw/zinc/31/51/90/940315190.db2.gz SOFLGJYJNAEPFH-LBPRGKRZSA-N 0 0 356.769 3.959 20 5 FHBDRN CN(C)c1nc2ccc(NC(=O)C(C)(C)c3ccc([N+](=O)[O-])cc3)cc2o1 ZINC000426592198 945311085 /nfs/dbraw/zinc/31/10/85/945311085.db2.gz XEQOTXSPXJMIQM-UHFFFAOYSA-N 0 0 368.393 3.718 20 5 FHBDRN O=C(CSc1ccccc1[N+](=O)[O-])Nc1nccn1-c1ccccc1 ZINC000511391200 940321274 /nfs/dbraw/zinc/32/12/74/940321274.db2.gz OEAJDIWHOVYMAW-UHFFFAOYSA-N 0 0 354.391 3.511 20 5 FHBDRN Cc1cccc(C(=O)N(C)Cc2ccc(Br)s2)c1[N+](=O)[O-] ZINC000018107347 945311457 /nfs/dbraw/zinc/31/14/57/945311457.db2.gz MUEYFUSNOXYYGR-UHFFFAOYSA-N 0 0 369.240 3.999 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)c1nc(COCC(F)(F)F)no1 ZINC000612874124 940322275 /nfs/dbraw/zinc/32/22/75/940322275.db2.gz JHBOFFWGTNZPSH-MRVPVSSYSA-N 0 0 363.317 3.910 20 5 FHBDRN Cc1ccc(C(=O)N(C)Cc2ccc(Br)s2)cc1[N+](=O)[O-] ZINC000018107467 945311514 /nfs/dbraw/zinc/31/15/14/945311514.db2.gz WWKMKCOZPIFPBA-UHFFFAOYSA-N 0 0 369.240 3.999 20 5 FHBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)c1nc(CC2=CCCCC2)no1 ZINC000612895082 940327586 /nfs/dbraw/zinc/32/75/86/940327586.db2.gz JFFQPPRFJVASFJ-GFCCVEGCSA-N 0 0 356.382 3.512 20 5 FHBDRN CC1(C)SC[C@H]1Nc1cc(C(F)(F)C(F)(F)F)ncc1[N+](=O)[O-] ZINC000548964591 940336232 /nfs/dbraw/zinc/33/62/32/940336232.db2.gz JXNNCYQLBOHZPR-SECBINFHSA-N 0 0 357.304 3.950 20 5 FHBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)c1nc(CC2CCCCC2)no1 ZINC000612912403 940337556 /nfs/dbraw/zinc/33/75/56/940337556.db2.gz DAGMQPSMKSUZHW-GFCCVEGCSA-N 0 0 358.398 3.592 20 5 FHBDRN CCc1c(C(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)cnn1CCC(C)C ZINC000427367307 945318185 /nfs/dbraw/zinc/31/81/85/945318185.db2.gz RZPOAUMYHPNNSO-UHFFFAOYSA-N 0 0 360.414 3.661 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)NCCc1nc2ccccc2n1C(F)F ZINC000511397678 940343582 /nfs/dbraw/zinc/34/35/82/940343582.db2.gz FVASBDRFOUMCIE-UHFFFAOYSA-N 0 0 374.347 3.621 20 5 FHBDRN O=[N+]([O-])c1ccccc1-c1nc(Cc2nc3cc(F)ccc3s2)no1 ZINC000612932276 940344015 /nfs/dbraw/zinc/34/40/15/940344015.db2.gz ZDRHJFAZRKNNBX-UHFFFAOYSA-N 0 0 356.338 3.984 20 5 FHBDRN O=[N+]([O-])c1ccccc1NCc1nc([C@@H]2CCc3ccccc3C2)no1 ZINC000612952228 940356993 /nfs/dbraw/zinc/35/69/93/940356993.db2.gz YLGFQGARVBKSKW-OAHLLOKOSA-N 0 0 350.378 3.862 20 5 FHBDRN COc1cc(Cc2noc(CNc3ccccc3Cl)n2)ccc1[N+](=O)[O-] ZINC000612963462 940364496 /nfs/dbraw/zinc/36/44/96/940364496.db2.gz PNUJXOQAWMRUFM-UHFFFAOYSA-N 0 0 374.784 3.843 20 5 FHBDRN COc1cc(Cc2noc(C[C@H]3CCc4ccccc43)n2)ccc1[N+](=O)[O-] ZINC000612967918 940364731 /nfs/dbraw/zinc/36/47/31/940364731.db2.gz QVKFYPAOBAOREW-OAHLLOKOSA-N 0 0 365.389 3.850 20 5 FHBDRN COc1cccc(Cc2noc(/C=C(/C)c3ccc([N+](=O)[O-])cc3)n2)n1 ZINC000612979978 940375396 /nfs/dbraw/zinc/37/53/96/940375396.db2.gz PMLTXIUZAFQVLK-BENRWUELSA-N 0 0 352.350 3.533 20 5 FHBDRN O=[N+]([O-])c1cccc(Cl)c1OS(=O)(=O)c1cccc2cccnc21 ZINC000177703698 940375534 /nfs/dbraw/zinc/37/55/34/940375534.db2.gz HHGVCPTYRPIXSH-UHFFFAOYSA-N 0 0 364.766 3.564 20 5 FHBDRN CC(C)(C(=O)Nc1ccc2c(c1)OCCCO2)c1ccc([N+](=O)[O-])cc1F ZINC000612992116 940378271 /nfs/dbraw/zinc/37/82/71/940378271.db2.gz QZPUFNJUDQDUCT-UHFFFAOYSA-N 0 0 374.368 3.812 20 5 FHBDRN Cc1cccc2sc(NC(=O)c3cc([N+](=O)[O-])cc4c3OCCO4)nc21 ZINC000066270591 940381056 /nfs/dbraw/zinc/38/10/56/940381056.db2.gz MTLCGFOGFPQYRE-UHFFFAOYSA-N 0 0 371.374 3.536 20 5 FHBDRN CC(C)Cn1ncnc1CSc1ccc(Br)cc1[N+](=O)[O-] ZINC000180072726 940383080 /nfs/dbraw/zinc/38/30/80/940383080.db2.gz RTZXQUNLWHVASZ-UHFFFAOYSA-N 0 0 371.260 3.897 20 5 FHBDRN CC(C)(c1nc(-c2ccc3c(c2)OCO3)no1)c1ccc([N+](=O)[O-])cc1F ZINC000613005912 940387285 /nfs/dbraw/zinc/38/72/85/940387285.db2.gz ZXJVQGXBXATWOY-UHFFFAOYSA-N 0 0 371.324 3.839 20 5 FHBDRN CCC[C@@H]1CCCC[C@@H]1NC(=O)c1ccc2c(c1[N+](=O)[O-])OCCCO2 ZINC001125803232 940391460 /nfs/dbraw/zinc/39/14/60/940391460.db2.gz VQWHEPASYDPOSG-HIFRSBDPSA-N 0 0 362.426 3.845 20 5 FHBDRN CC1CCC(N(C(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)C2CC2)CC1 ZINC000066288657 940393308 /nfs/dbraw/zinc/39/33/08/940393308.db2.gz GSPCNFDRUDYTCF-UHFFFAOYSA-N 0 0 360.410 3.549 20 5 FHBDRN O=C(NC1Cc2ccccc2C1)c1c([N+](=O)[O-])cccc1C(F)(F)F ZINC000613031617 940401401 /nfs/dbraw/zinc/40/14/01/940401401.db2.gz ZQHOMKOATUABKE-UHFFFAOYSA-N 0 0 350.296 3.511 20 5 FHBDRN CCOc1cc(OCc2nc(-c3ccc(OC)cc3)no2)ccc1[N+](=O)[O-] ZINC000188611727 940404189 /nfs/dbraw/zinc/40/41/89/940404189.db2.gz SJTNIVIOVBPBOT-UHFFFAOYSA-N 0 0 371.349 3.631 20 5 FHBDRN CCn1ncc(C(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)c1-c1ccccc1 ZINC000427367448 945318489 /nfs/dbraw/zinc/31/84/89/945318489.db2.gz SIRYHHCGPLBECI-UHFFFAOYSA-N 0 0 366.377 3.739 20 5 FHBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@H](CO)[C@H]1C ZINC000414022168 940416515 /nfs/dbraw/zinc/41/65/15/940416515.db2.gz GEGCCFYFAIXITR-ZIAGYGMSSA-N 0 0 366.483 3.576 20 5 FHBDRN COC(=O)c1ccc(NC(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1Cl ZINC000579902922 940420335 /nfs/dbraw/zinc/42/03/35/940420335.db2.gz NJQFRGRNKLDSBW-JTQLQIEISA-N 0 0 362.769 3.777 20 5 FHBDRN CCOc1cc(OCC(=O)N2CCC[C@H]3CCCC[C@H]32)ccc1[N+](=O)[O-] ZINC000188618213 940423239 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3.895 20 5 FHBDRN CCCOc1cc(C)ccc1NC(=O)c1cc([N+](=O)[O-])cc2c1OCCO2 ZINC000066329453 940439079 /nfs/dbraw/zinc/43/90/79/940439079.db2.gz XDNFTQCPNYLMRA-UHFFFAOYSA-N 0 0 372.377 3.716 20 5 FHBDRN COCCC1(C(=O)N(C)Cc2cc([N+](=O)[O-])ccc2Cl)CCCC1 ZINC000177800676 940440622 /nfs/dbraw/zinc/44/06/22/940440622.db2.gz DBTCQHFKFYKDAM-UHFFFAOYSA-N 0 0 354.834 3.804 20 5 FHBDRN Cc1ccc(S(=O)(=O)N[C@@H](C)c2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000507547818 945320941 /nfs/dbraw/zinc/32/09/41/945320941.db2.gz STNNNJADCFBVEC-NSHDSACASA-N 0 0 354.815 3.596 20 5 FHBDRN Cc1c(CN2C(=O)[C@H]3C[C@H](C4CCCCC4)CN3C2=O)cccc1[N+](=O)[O-] ZINC000431735724 940442931 /nfs/dbraw/zinc/44/29/31/940442931.db2.gz KVYBRGDEXAXHDG-FUHWJXTLSA-N 0 0 371.437 3.636 20 5 FHBDRN COC(=O)c1ccc(OCc2cccc(OC(F)F)c2)cc1[N+](=O)[O-] ZINC000613109243 940452201 /nfs/dbraw/zinc/45/22/01/940452201.db2.gz XAGRBBBLKVHVMA-UHFFFAOYSA-N 0 0 353.277 3.562 20 5 FHBDRN COC(=O)c1ccc(OCc2nc(-c3ccsc3)oc2C)cc1[N+](=O)[O-] ZINC000613109793 940452257 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CCOc1ccc([N+](=O)[O-])cc1NC(=O)NCCc1ccc(F)cc1F ZINC000580273156 940471522 /nfs/dbraw/zinc/47/15/22/940471522.db2.gz RPKYYKVGCYUHDD-UHFFFAOYSA-N 0 0 365.336 3.636 20 5 FHBDRN C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N1CC[C@@H](CC2CC2)C1 ZINC000580336091 940473187 /nfs/dbraw/zinc/47/31/87/940473187.db2.gz XPBFGMJTPFNYLR-YPMHNXCESA-N 0 0 351.834 3.697 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc2c(c1)OCCCO2 ZINC000613170704 940475277 /nfs/dbraw/zinc/47/52/77/940475277.db2.gz GHPRPWFCSNMZBX-HNNXBMFYSA-N 0 0 370.405 3.964 20 5 FHBDRN CN(Cc1cccs1)C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000431764881 940480932 /nfs/dbraw/zinc/48/09/32/940480932.db2.gz JNDBWISOHMLNKE-UHFFFAOYSA-N 0 0 355.213 3.691 20 5 FHBDRN C[C@H]1C[C@@H](c2cccs2)CN1c1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1 ZINC000376217538 940481554 /nfs/dbraw/zinc/48/15/54/940481554.db2.gz DYHCFUBCPRIFRN-WDEREUQCSA-N 0 0 356.407 3.688 20 5 FHBDRN C[C@H]1C[C@H](c2cccs2)CN1c1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1 ZINC000376217537 940481652 /nfs/dbraw/zinc/48/16/52/940481652.db2.gz DYHCFUBCPRIFRN-QWRGUYRKSA-N 0 0 356.407 3.688 20 5 FHBDRN O=c1[nH]c(N2CCC[C@@H]2Cc2ccc(F)cc2)nc2ccc([N+](=O)[O-])cc12 ZINC000580666955 940481815 /nfs/dbraw/zinc/48/18/15/940481815.db2.gz KDMHTEOOVNKJBW-CQSZACIVSA-N 0 0 368.368 3.594 20 5 FHBDRN COc1cc(Cc2noc(C[C@H]3CCC[C@@H]3C)n2)c([N+](=O)[O-])c(OC)c1 ZINC000580601787 940482184 /nfs/dbraw/zinc/48/21/84/940482184.db2.gz QJIOMUQYMOQTRF-NWDGAFQWSA-N 0 0 361.398 3.565 20 5 FHBDRN COCCOc1ccc(F)cc1NC(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000066432380 940486739 /nfs/dbraw/zinc/48/67/39/940486739.db2.gz KZXIBYXBLYBGNV-UHFFFAOYSA-N 0 0 368.748 3.665 20 5 FHBDRN O=C(Nc1ccnn1-c1ccc([N+](=O)[O-])cc1)c1ccccc1OC1CC1 ZINC000580915218 940488769 /nfs/dbraw/zinc/48/87/69/940488769.db2.gz MEHOGQQQNRUFME-UHFFFAOYSA-N 0 0 364.361 3.574 20 5 FHBDRN CNc1c(C(=O)Nc2ccc3c(cnn3C(F)F)c2)cccc1[N+](=O)[O-] ZINC000613234982 940489875 /nfs/dbraw/zinc/48/98/75/940489875.db2.gz GDPXFHKHYNVAOK-UHFFFAOYSA-N 0 0 361.308 3.634 20 5 FHBDRN CC(=O)c1ccc([N+](=O)[O-])cc1N1CCN(C/C=C/c2ccccc2)CC1 ZINC000581032512 940490521 /nfs/dbraw/zinc/49/05/21/940490521.db2.gz MXVBGCYRBOCXLT-VMPITWQZSA-N 0 0 365.433 3.633 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CC(Cc2ccccc2)C1 ZINC000613241327 940490824 /nfs/dbraw/zinc/49/08/24/940490824.db2.gz NRGORCCTFNLZTI-IBGZPJMESA-N 0 0 352.434 3.865 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1[C@H](C)c2ccc(F)cc2C[C@@H]1C ZINC000427399644 945325655 /nfs/dbraw/zinc/32/56/55/945325655.db2.gz POVSQRVVHRLFSH-NWDGAFQWSA-N 0 0 358.369 3.891 20 5 FHBDRN NC(=O)c1cccc(Sc2ccc([N+](=O)[O-])c(-c3ccccc3)n2)c1 ZINC000581164350 940494761 /nfs/dbraw/zinc/49/47/61/940494761.db2.gz IIEKPCKGFXQYJE-UHFFFAOYSA-N 0 0 351.387 3.907 20 5 FHBDRN Cc1ccc2cccc(NC(=O)c3ccn(-c4ccc([N+](=O)[O-])cc4)n3)c2n1 ZINC000066462089 940495007 /nfs/dbraw/zinc/49/50/07/940495007.db2.gz MVAXGDFLTHKHDS-UHFFFAOYSA-N 0 0 373.372 3.889 20 5 FHBDRN Cc1ncsc1CN(C)c1cc(C)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000066467637 940498180 /nfs/dbraw/zinc/49/81/80/940498180.db2.gz DCGLTJOGRBLEOL-UHFFFAOYSA-N 0 0 355.423 3.762 20 5 FHBDRN CC(C)[C@@H](C)NC(=O)C1CCN(Cc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000163513629 940499905 /nfs/dbraw/zinc/49/99/05/940499905.db2.gz ROLBSBQLWDMLQY-CYBMUJFWSA-N 0 0 367.877 3.621 20 5 FHBDRN CNc1ccc(C(=O)N(Cc2c(F)cccc2F)C2CC2)cc1[N+](=O)[O-] ZINC000581303458 940500974 /nfs/dbraw/zinc/50/09/74/940500974.db2.gz GHNFOYIMBWPKBL-UHFFFAOYSA-N 0 0 361.348 3.720 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000427398954 945326698 /nfs/dbraw/zinc/32/66/98/945326698.db2.gz KYFURSMLSYUPTF-KSSFIOAISA-N 0 0 370.405 3.501 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1Oc1ccccc1)N1CC[C@@H]2OCC[C@@H]2C1 ZINC000581491228 940505364 /nfs/dbraw/zinc/50/53/64/940505364.db2.gz JSTFGIMRPWCDFV-KDOFPFPSSA-N 0 0 368.389 3.638 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)Oc1cc(Cl)ccc1[N+](=O)[O-] ZINC000124847108 945327526 /nfs/dbraw/zinc/32/75/26/945327526.db2.gz XKUQVFOAWUHALK-UHFFFAOYSA-N 0 0 368.754 3.854 20 5 FHBDRN O=C(Nc1ccccc1OCC1CC1)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000124770793 945327847 /nfs/dbraw/zinc/32/78/47/945327847.db2.gz UAPLMCDWXDDHRG-UHFFFAOYSA-N 0 0 367.405 3.974 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)Nc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000124792489 945329496 /nfs/dbraw/zinc/32/94/96/945329496.db2.gz NHOHFQMCTDZCIT-UHFFFAOYSA-N 0 0 374.740 3.819 20 5 FHBDRN NC(=O)c1ccc(NCCCO[C@@H]2CCCc3ccccc32)c([N+](=O)[O-])c1 ZINC000427384633 945329796 /nfs/dbraw/zinc/32/97/96/945329796.db2.gz PAIMTYMQLJTYRB-LJQANCHMSA-N 0 0 369.421 3.590 20 5 FHBDRN Cc1sc(S(=O)(=O)N2CC[C@H](C)C[C@@H]2c2ccco2)cc1[N+](=O)[O-] ZINC000124876203 945331142 /nfs/dbraw/zinc/33/11/42/945331142.db2.gz WDHORVHUATULKJ-GXFFZTMASA-N 0 0 370.452 3.720 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1cc(OC)c(C(C)C)c(OC)c1 ZINC000427390328 945334507 /nfs/dbraw/zinc/33/45/07/945334507.db2.gz JFAURKLPLCTRMQ-UHFFFAOYSA-N 0 0 374.393 3.996 20 5 FHBDRN COc1nc(C)cc(C)c1CNC(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC001125810145 940588219 /nfs/dbraw/zinc/58/82/19/940588219.db2.gz UACDLUULVBYBGT-UHFFFAOYSA-N 0 0 357.410 3.669 20 5 FHBDRN CCOc1cc(NC(=O)c2cc(OC)c(OC)cc2[N+](=O)[O-])ccc1C ZINC000066525974 940608074 /nfs/dbraw/zinc/60/80/74/940608074.db2.gz XXJQQXOIGVYACP-UHFFFAOYSA-N 0 0 360.366 3.571 20 5 FHBDRN O=C(Nc1ccc(F)c([N+](=O)[O-])c1)c1ccc(F)c(Br)c1 ZINC000173346609 940612536 /nfs/dbraw/zinc/61/25/36/940612536.db2.gz IODPWMXJTFJNKT-UHFFFAOYSA-N 0 0 357.110 3.888 20 5 FHBDRN COc1ccc2c(c1)C[C@H](C)N(C(=O)c1ccc([N+](=O)[O-])cc1OC)[C@H]2C ZINC000427391339 945335310 /nfs/dbraw/zinc/33/53/10/945335310.db2.gz QEDRVSAKWFHEQP-STQMWFEESA-N 0 0 370.405 3.760 20 5 FHBDRN CCOc1ccc(NC(=O)CN2Cc3ccccc3[C@H]2C)c([N+](=O)[O-])c1 ZINC000542133097 940627697 /nfs/dbraw/zinc/62/76/97/940627697.db2.gz OMDIIJKYENOHRE-CYBMUJFWSA-N 0 0 355.394 3.509 20 5 FHBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1ncc(OC)cn1 ZINC000581892461 940630389 /nfs/dbraw/zinc/63/03/89/940630389.db2.gz MOWXYOJDVPKPIC-UHFFFAOYSA-N 0 0 362.411 3.538 20 5 FHBDRN CSc1ccc(OC[C@@H](O)COc2cc(C)c([N+](=O)[O-])cc2F)cc1 ZINC000414129369 940635390 /nfs/dbraw/zinc/63/53/90/940635390.db2.gz UUPCKQRJCFMCBO-GFCCVEGCSA-N 0 0 367.398 3.583 20 5 FHBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CCC[C@H](C)[C@H]1C ZINC000581991731 940638138 /nfs/dbraw/zinc/63/81/38/940638138.db2.gz ZRVUWXQPZASGSW-GXSJLCMTSA-N 0 0 355.232 3.926 20 5 FHBDRN COCC1(c2noc(-c3c[nH]c4ccc([N+](=O)[O-])cc43)n2)CCCCC1 ZINC000582152256 940650851 /nfs/dbraw/zinc/65/08/51/940650851.db2.gz MFMAOQQUDPJMQE-UHFFFAOYSA-N 0 0 356.382 3.974 20 5 FHBDRN COc1ccc(CSCC(=O)NCC2(C)CCCCC2)cc1[N+](=O)[O-] ZINC000582094093 940652946 /nfs/dbraw/zinc/65/29/46/940652946.db2.gz USJBEIPZDIWMFO-UHFFFAOYSA-N 0 0 366.483 3.923 20 5 FHBDRN CSc1ccc(C(=O)N2C[C@H](C)OC[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000173680400 940653968 /nfs/dbraw/zinc/65/39/68/940653968.db2.gz VKSSOADAZWTOOP-SUMWQHHRSA-N 0 0 372.446 3.919 20 5 FHBDRN CCN(C[C@H](O)c1ccc(C)cc1)C(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000178097194 940664643 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Cc1ccc([N+](=O)[O-])cc1[C@H](C)S(=O)(=O)Cc1csc(C2CC2)n1 ZINC000180152611 940700651 /nfs/dbraw/zinc/70/06/51/940700651.db2.gz DITYIKLXXUKSKZ-NSHDSACASA-N 0 0 366.464 3.913 20 5 FHBDRN Cc1cc(O)ccc1NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000174137431 940704815 /nfs/dbraw/zinc/70/48/15/940704815.db2.gz ZJDSFDPYOSEEGZ-UHFFFAOYSA-N 0 0 355.375 3.985 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1)N1CC[C@@H](COCc2ccccc2)C1 ZINC000174179656 940712261 /nfs/dbraw/zinc/71/22/61/940712261.db2.gz DFHXZQYLHYUUBA-MRXNPFEDSA-N 0 0 355.394 3.665 20 5 FHBDRN C[C@@H](CNC(=O)CSc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1F ZINC000174309526 940719484 /nfs/dbraw/zinc/71/94/84/940719484.db2.gz VBTKIIIIZFBDJI-NSHDSACASA-N 0 0 366.389 3.885 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2nc(-c3cccc(OCc4ccccc4)n3)no2)[nH]1 ZINC000582561538 940724996 /nfs/dbraw/zinc/72/49/96/940724996.db2.gz RSBUHMPAZAFWGB-UHFFFAOYSA-N 0 0 363.333 3.614 20 5 FHBDRN COc1ccc(NC(=O)CCOc2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000170561210 940732081 /nfs/dbraw/zinc/73/20/81/940732081.db2.gz RGBRFFLCIFVJHZ-UHFFFAOYSA-N 0 0 350.758 3.664 20 5 FHBDRN C[C@H](Cc1cccc(O)c1)NC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000438011040 945343883 /nfs/dbraw/zinc/34/38/83/945343883.db2.gz YTYFWLMFOXYWBT-CQSZACIVSA-N 0 0 369.421 3.606 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)N(Cc1ccccc1)CC(F)F ZINC000174617238 940750434 /nfs/dbraw/zinc/75/04/34/940750434.db2.gz OLAJIUPWHJVVFA-UHFFFAOYSA-N 0 0 366.389 3.981 20 5 FHBDRN COc1cc(C)c(CN(C)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1OC ZINC000170700090 940783481 /nfs/dbraw/zinc/78/34/81/940783481.db2.gz YPJNRCUBSWLABO-UHFFFAOYSA-N 0 0 359.382 3.584 20 5 FHBDRN Cc1ccc(C(N)=O)c(OCc2cc([N+](=O)[O-])ccc2C(F)(F)F)c1 ZINC000549037789 940793227 /nfs/dbraw/zinc/79/32/27/940793227.db2.gz VLVWCLWONSCDCY-UHFFFAOYSA-N 0 0 354.284 3.600 20 5 FHBDRN CCOc1ccc([C@H](C)Nc2cccc3c2CN(C)C3=O)cc1[N+](=O)[O-] ZINC000414224451 940798018 /nfs/dbraw/zinc/79/80/18/940798018.db2.gz LSHIWDBCEBTSNJ-LBPRGKRZSA-N 0 0 355.394 3.752 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1SCCc2sccc21 ZINC000175071380 940807076 /nfs/dbraw/zinc/80/70/76/940807076.db2.gz CMPBNODWSQVDIM-CQSZACIVSA-N 0 0 350.421 3.634 20 5 FHBDRN Cc1cncc(C(=O)Nc2ccc([N+](=O)[O-])cc2C(=O)c2ccccc2)c1 ZINC000175085368 940809246 /nfs/dbraw/zinc/80/92/46/940809246.db2.gz JDWDDZUDEHQUEI-UHFFFAOYSA-N 0 0 361.357 3.782 20 5 FHBDRN COc1c(O)ccc(CNCc2ccc(F)cc2C(F)(F)F)c1[N+](=O)[O-] ZINC000892576481 940824992 /nfs/dbraw/zinc/82/49/92/940824992.db2.gz DSOPTQRPHSSAGD-UHFFFAOYSA-N 0 0 374.290 3.757 20 5 FHBDRN COc1ccc(/C=C/C(=O)Nc2cc([N+](=O)[O-])c(F)cc2F)cc1OC ZINC000124917950 945355996 /nfs/dbraw/zinc/35/59/96/945355996.db2.gz BMMQJTSROGSJDS-GQCTYLIASA-N 0 0 364.304 3.542 20 5 FHBDRN CC(=O)c1cccc(NC(=O)c2ccc(Br)cc2[N+](=O)[O-])c1 ZINC000175501487 940873171 /nfs/dbraw/zinc/87/31/71/940873171.db2.gz TUQFRRBYAYIACH-UHFFFAOYSA-N 0 0 363.167 3.812 20 5 FHBDRN CCc1ccsc1C(=O)Nc1cc(C)nn1-c1ccc([N+](=O)[O-])cc1 ZINC000066660479 940897412 /nfs/dbraw/zinc/89/74/12/940897412.db2.gz MAFPOKOUDXVJMO-UHFFFAOYSA-N 0 0 356.407 3.965 20 5 FHBDRN CCCc1cnc(NC(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])s1 ZINC000180265801 940897686 /nfs/dbraw/zinc/89/76/86/940897686.db2.gz WMFKMTNRTSINKF-UHFFFAOYSA-N 0 0 367.452 3.987 20 5 FHBDRN COc1ccc([C@H]2CCCN2C(=O)Cc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000124924870 945358551 /nfs/dbraw/zinc/35/85/51/945358551.db2.gz LMYKTFOMBSOCLZ-GOSISDBHSA-N 0 0 358.369 3.649 20 5 FHBDRN Cc1nc(NC(=O)Cc2csc(-c3cccs3)n2)ccc1[N+](=O)[O-] ZINC000175670547 940907028 /nfs/dbraw/zinc/90/70/28/940907028.db2.gz SNXCJMORKNSXDI-UHFFFAOYSA-N 0 0 360.420 3.664 20 5 FHBDRN CCCCOc1ccc(C(=O)Nc2ccc([N+](=O)[O-])c(C)n2)cc1OC ZINC000175674771 940907459 /nfs/dbraw/zinc/90/74/59/940907459.db2.gz IMKLLFAHDONYDG-UHFFFAOYSA-N 0 0 359.382 3.738 20 5 FHBDRN Cc1ccc2c(c1)N(C(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)CC2 ZINC000122107337 940914691 /nfs/dbraw/zinc/91/46/91/940914691.db2.gz XAEBCPNSSBEYSN-UHFFFAOYSA-N 0 0 362.389 3.507 20 5 FHBDRN COc1ccc(NC(=O)NCc2ccccc2OCC(C)C)cc1[N+](=O)[O-] ZINC000543893952 945361667 /nfs/dbraw/zinc/36/16/67/945361667.db2.gz OIDIOSNRRJCBFL-UHFFFAOYSA-N 0 0 373.409 3.960 20 5 FHBDRN C[C@@H]1C[C@H]1C(=O)Nc1ccc(C(=O)OCc2ccc([N+](=O)[O-])c(F)c2)cc1 ZINC000782782903 940955467 /nfs/dbraw/zinc/95/54/67/940955467.db2.gz ITPRHIKUHJUKSW-IAQYHMDHSA-N 0 0 372.352 3.685 20 5 FHBDRN Cc1ccc(-c2nc(NC(=O)[C@H](C)c3ccc([N+](=O)[O-])cc3F)n[nH]2)cc1 ZINC000186293583 940975344 /nfs/dbraw/zinc/97/53/44/940975344.db2.gz WQCCAAVLWANSLQ-LLVKDONJSA-N 0 0 369.356 3.570 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1ccc(C(F)(F)F)cc1O ZINC000180383883 940996366 /nfs/dbraw/zinc/99/63/66/940996366.db2.gz FAVHWMQRPUANFG-UHFFFAOYSA-N 0 0 354.284 3.591 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@H](Oc2ccccc2)C1 ZINC000580076768 941008425 /nfs/dbraw/zinc/00/84/25/941008425.db2.gz GAZHHJGODBZZLE-PXNSSMCTSA-N 0 0 368.433 3.843 20 5 FHBDRN Cc1nsc(C)c1-c1noc(-c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)n1 ZINC000426622439 945368052 /nfs/dbraw/zinc/36/80/52/945368052.db2.gz GIDYTDWMFCFMAC-UHFFFAOYSA-N 0 0 368.378 3.571 20 5 FHBDRN Cc1ccc(C(=O)N2CC[C@H](OCCCc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000176330625 941023661 /nfs/dbraw/zinc/02/36/61/941023661.db2.gz QJSRQPMFSUPFIN-IBGZPJMESA-N 0 0 368.433 3.767 20 5 FHBDRN Cc1ccc(C(=O)N2CC[C@@H](OCCCc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000176330642 941023727 /nfs/dbraw/zinc/02/37/27/941023727.db2.gz QJSRQPMFSUPFIN-LJQANCHMSA-N 0 0 368.433 3.767 20 5 FHBDRN Cc1cc(C(=O)Nc2nnc(Cc3ccc(F)cc3)s2)ccc1[N+](=O)[O-] ZINC000106704454 945369255 /nfs/dbraw/zinc/36/92/55/945369255.db2.gz ZPHVHBZDHVAYSK-UHFFFAOYSA-N 0 0 372.381 3.737 20 5 FHBDRN C[C@@H]1CN(C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)[C@@H]2CCCC[C@@H]21 ZINC000180508821 941038601 /nfs/dbraw/zinc/03/86/01/941038601.db2.gz RHAFZNAUSLNXGV-DJIMGWMZSA-N 0 0 357.454 3.846 20 5 FHBDRN CC(C)(C)c1ccc([C@H]2CCCN2C(=O)c2cc([N+](=O)[O-])cnc2N)cc1 ZINC000180538065 941040490 /nfs/dbraw/zinc/04/04/90/941040490.db2.gz LHZHZPGHZHBGKB-QGZVFWFLSA-N 0 0 368.437 3.847 20 5 FHBDRN CCc1c(NC(=O)c2ccc([N+](=O)[O-])o2)cnn1-c1ccc(Cl)cc1 ZINC000376455944 941046009 /nfs/dbraw/zinc/04/60/09/941046009.db2.gz UDMUCUMSYZRYGN-UHFFFAOYSA-N 0 0 360.757 3.842 20 5 FHBDRN CC(C)(NC(=O)[C@H]1SCCc2ccccc21)c1ccc([N+](=O)[O-])cc1 ZINC000176497038 941055317 /nfs/dbraw/zinc/05/53/17/941055317.db2.gz RFSSJQOQBLIVFP-KRWDZBQOSA-N 0 0 356.447 3.977 20 5 FHBDRN C[C@@H](NC(=O)c1c(N)cccc1[N+](=O)[O-])c1ccc(C(F)(F)F)cc1 ZINC000180639132 941057404 /nfs/dbraw/zinc/05/74/04/941057404.db2.gz URRJSLJYIJYJPI-SECBINFHSA-N 0 0 353.300 3.687 20 5 FHBDRN O=C(Nc1ccc(Br)c([N+](=O)[O-])c1)c1csc([N+](=O)[O-])c1 ZINC000180629414 941057589 /nfs/dbraw/zinc/05/75/89/941057589.db2.gz ILXJPTTYJXSJLW-UHFFFAOYSA-N 0 0 372.156 3.579 20 5 FHBDRN CCS[C@H]1CCC[C@H]1NC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000176536781 941058430 /nfs/dbraw/zinc/05/84/30/941058430.db2.gz XKGCCXOMZFGFRT-YPMHNXCESA-N 0 0 373.272 3.761 20 5 FHBDRN O=C(N[C@@H]1CC12CCCCC2)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000180640111 941059159 /nfs/dbraw/zinc/05/91/59/941059159.db2.gz AXENRWYRPZKPET-GOSISDBHSA-N 0 0 357.454 3.650 20 5 FHBDRN CCn1c(C)nc([N+](=O)[O-])c1NCc1cc(Br)ccc1OC ZINC000583105335 941059867 /nfs/dbraw/zinc/05/98/67/941059867.db2.gz VPCUQJPIUISEKN-UHFFFAOYSA-N 0 0 369.219 3.503 20 5 FHBDRN COC(=O)c1cc(NC(=O)[C@@H](C)c2ccc(Cl)s2)cc([N+](=O)[O-])c1 ZINC000176645895 941067950 /nfs/dbraw/zinc/06/79/50/941067950.db2.gz GWQKYCQLFXQAES-QMMMGPOBSA-N 0 0 368.798 3.839 20 5 FHBDRN C[C@H](Cc1ccc(Cl)cc1Cl)NC(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000180732981 941069901 /nfs/dbraw/zinc/06/99/01/941069901.db2.gz VKNQNYFXXHVKNM-SECBINFHSA-N 0 0 368.220 3.845 20 5 FHBDRN Cc1nn(C)c(C)c1CCCNC(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000180769849 941073515 /nfs/dbraw/zinc/07/35/15/941073515.db2.gz LHOVXSGFLGJFPW-UHFFFAOYSA-N 0 0 372.469 3.605 20 5 FHBDRN C[NH+](C)[C@H](CC(=O)Nc1cc(Cl)cc([N+](=O)[O-])c1[O-])c1ccccc1 ZINC000431829437 941090754 /nfs/dbraw/zinc/09/07/54/941090754.db2.gz WXIUXPMMYQARRF-CQSZACIVSA-N 0 0 363.801 3.585 20 5 FHBDRN COc1ccc2c(c1)OCC[C@@H]2NC(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000365524016 941097371 /nfs/dbraw/zinc/09/73/71/941097371.db2.gz BXSWYXWTCDIEML-AWEZNQCLSA-N 0 0 362.769 3.510 20 5 FHBDRN C[C@@H](Cc1ccc(C(F)(F)F)cc1)NC(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000181071320 941106862 /nfs/dbraw/zinc/10/68/62/941106862.db2.gz DKTQVMLMCNZAHD-JTQLQIEISA-N 0 0 367.327 3.557 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)Nc1ccc(OCc2cccnc2)cc1 ZINC000103047646 941107712 /nfs/dbraw/zinc/10/77/12/941107712.db2.gz MKLPLKKAHYDTMP-UHFFFAOYSA-N 0 0 363.373 3.750 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)N1CC2(CCOCC2)[C@@H]1c1ccccc1 ZINC000414406468 941107843 /nfs/dbraw/zinc/10/78/43/941107843.db2.gz KJPDHHFLRPOFIN-SFHVURJKSA-N 0 0 367.405 3.980 20 5 FHBDRN CC[C@@H](CSC)NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000181181705 941112063 /nfs/dbraw/zinc/11/20/63/941112063.db2.gz CJPLRATZWGPWKK-NSHDSACASA-N 0 0 351.453 3.590 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)N[C@@H](CCO)C2CCCCC2)cc1[N+](=O)[O-] ZINC000120142289 941114655 /nfs/dbraw/zinc/11/46/55/941114655.db2.gz KNQNPQDHLSSEKA-PBHICJAKSA-N 0 0 363.458 3.595 20 5 FHBDRN Cc1ccccc1[C@@H]1C[C@@H](C)N(C(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)C1 ZINC000181255948 941117816 /nfs/dbraw/zinc/11/78/16/941117816.db2.gz YUUXVVNTOYEPOZ-UKRRQHHQSA-N 0 0 368.389 3.650 20 5 FHBDRN CC[C@@H](CNc1c([N+](=O)[O-])c(C)nn1C)Oc1cccc(C(F)(F)F)c1 ZINC000431831959 941124612 /nfs/dbraw/zinc/12/46/12/941124612.db2.gz NUIQQQVNEWRMDJ-LBPRGKRZSA-N 0 0 372.347 3.925 20 5 FHBDRN CC(C)(C)C(=O)N1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000128303814 941126056 /nfs/dbraw/zinc/12/60/56/941126056.db2.gz BIWWFJWHTDINIW-UHFFFAOYSA-N 0 0 371.437 3.545 20 5 FHBDRN Cc1cccc(C)c1CNC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000122191730 941128990 /nfs/dbraw/zinc/12/89/90/941128990.db2.gz FSCIGFAMMBCVQC-UHFFFAOYSA-N 0 0 363.211 3.904 20 5 FHBDRN O=C(c1ccc(Cl)cc1[N+](=O)[O-])N1CCC[C@H]1[C@H]1CCCCC1=O ZINC000177618540 941139605 /nfs/dbraw/zinc/13/96/05/941139605.db2.gz FKWICVRRTARJHV-OCCSQVGLSA-N 0 0 350.802 3.612 20 5 FHBDRN COCc1cccc(CC(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)c1 ZINC000189001309 941142956 /nfs/dbraw/zinc/14/29/56/941142956.db2.gz MFSDKPGVCCBQCG-UHFFFAOYSA-N 0 0 368.311 3.941 20 5 FHBDRN COc1ccc(CC(C)(C)NC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)cc1 ZINC000189059045 941146060 /nfs/dbraw/zinc/14/60/60/941146060.db2.gz YKZGHUZMOSYIPI-UHFFFAOYSA-N 0 0 367.405 3.836 20 5 FHBDRN C[C@@H](NCc1noc(-c2ccc(F)cc2F)n1)c1cccc([N+](=O)[O-])c1 ZINC000189159457 941148046 /nfs/dbraw/zinc/14/80/46/941148046.db2.gz AXGKPVMWNYNXIW-SNVBAGLBSA-N 0 0 360.320 3.774 20 5 FHBDRN COc1ccc(CC(C)(C)NC(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)cc1 ZINC000189158338 941148049 /nfs/dbraw/zinc/14/80/49/941148049.db2.gz TUPBSGRSHVQRLS-CYBMUJFWSA-N 0 0 374.412 3.984 20 5 FHBDRN Cc1ccc([C@@H](C)NCc2nc(-c3ccccc3F)no2)cc1[N+](=O)[O-] ZINC000189170216 941149435 /nfs/dbraw/zinc/14/94/35/941149435.db2.gz CVDYEIFOFRFTEB-GFCCVEGCSA-N 0 0 356.357 3.943 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc3nnc(C(C)C)n3c2)c1 ZINC000189259250 941154132 /nfs/dbraw/zinc/15/41/32/941154132.db2.gz VELMTMPRXJYORC-UHFFFAOYSA-N 0 0 371.422 3.735 20 5 FHBDRN O=C(NC1CCCCCCC1)c1cc([N+](=O)[O-])ccc1SCCO ZINC000136060741 941154990 /nfs/dbraw/zinc/15/49/90/941154990.db2.gz GHCFEZBDFQUIQV-UHFFFAOYSA-N 0 0 352.456 3.522 20 5 FHBDRN C[C@@H](C1CC1)n1cc(NC(=O)CCCNc2ccc([N+](=O)[O-])cc2)cn1 ZINC000189326156 941156310 /nfs/dbraw/zinc/15/63/10/941156310.db2.gz MGAMJZQSFHWOEL-ZDUSSCGKSA-N 0 0 357.414 3.593 20 5 FHBDRN COC(=O)CC1(CC(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)CCCC1 ZINC000189395513 941157070 /nfs/dbraw/zinc/15/70/70/941157070.db2.gz WFGHECOFYGKKPP-CQSZACIVSA-N 0 0 362.426 3.594 20 5 FHBDRN CC[C@@](C)(O)CN(Cc1ccccc1)C(=O)Cc1cccc([N+](=O)[O-])c1C ZINC000189459104 941158260 /nfs/dbraw/zinc/15/82/60/941158260.db2.gz SPUVTNUHOQBNBA-OAQYLSRUSA-N 0 0 370.449 3.636 20 5 FHBDRN COC[C@H](Cc1ccccc1)N(C)C(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000189473016 941158496 /nfs/dbraw/zinc/15/84/96/941158496.db2.gz MMAUDYWEULLDMH-KRWDZBQOSA-N 0 0 357.410 3.625 20 5 FHBDRN COC[C@H](Cc1ccccc1)N(C)C(=O)Nc1ccc(C)c([N+](=O)[O-])c1 ZINC000189472549 941158568 /nfs/dbraw/zinc/15/85/68/941158568.db2.gz CWOMRBNQGMQDLI-KRWDZBQOSA-N 0 0 357.410 3.625 20 5 FHBDRN Cc1nn(-c2ccccc2)cc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000181415024 941158998 /nfs/dbraw/zinc/15/89/98/941158998.db2.gz KEEYIYLQMKVOQM-UHFFFAOYSA-N 0 0 356.769 3.995 20 5 FHBDRN O=C(Nc1ccc2c(c1)CCCC(=O)N2)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000120160327 941160221 /nfs/dbraw/zinc/16/02/21/941160221.db2.gz BBPIRFFLMDFDHT-UHFFFAOYSA-N 0 0 359.769 3.775 20 5 FHBDRN CCN(Cc1c[nH]c2ccccc12)C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000189558744 941161263 /nfs/dbraw/zinc/16/12/63/941161263.db2.gz LYKICQQWXRKEFS-UHFFFAOYSA-N 0 0 363.377 3.615 20 5 FHBDRN COc1ccc2[nH]c(C(=O)N(Cc3ccc([N+](=O)[O-])cc3)C3CC3)cc2c1 ZINC000189573777 941161376 /nfs/dbraw/zinc/16/13/76/941161376.db2.gz MPNCZUWUEOQOOM-UHFFFAOYSA-N 0 0 365.389 3.890 20 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FHBDRN Cc1ccc(-n2cccn2)cc1NC(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000189815222 941283318 /nfs/dbraw/zinc/28/33/18/941283318.db2.gz YTJNRYLEAGUQOG-UHFFFAOYSA-N 0 0 373.372 3.889 20 5 FHBDRN C[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1)c1nc(-c2ccc(Cl)cc2)no1 ZINC000103248053 941309651 /nfs/dbraw/zinc/30/96/51/941309651.db2.gz RWXSSQZNGSZNGY-JTQLQIEISA-N 0 0 372.768 3.789 20 5 FHBDRN Cc1c(NC(=O)N(C)Cc2ccccc2[N+](=O)[O-])cnn1-c1ccccc1 ZINC000178974739 941328433 /nfs/dbraw/zinc/32/84/33/941328433.db2.gz PWTLMOQJAIOYEP-UHFFFAOYSA-N 0 0 365.393 3.753 20 5 FHBDRN Cc1ccccc1[C@H](NC(=O)c1c([N+](=O)[O-])cnn1C)C1CCC(C)CC1 ZINC000122257663 941335009 /nfs/dbraw/zinc/33/50/09/941335009.db2.gz XANXWTMMJMFGOW-LEHRNKBSSA-N 0 0 370.453 3.934 20 5 FHBDRN Cc1ccc2c(c1)[C@H](Nc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)CCC2 ZINC000190021146 941346586 /nfs/dbraw/zinc/34/65/86/941346586.db2.gz WENXXDPGIFZNHF-MRXNPFEDSA-N 0 0 360.435 3.796 20 5 FHBDRN CCO[C@H](C)c1nc(CC(=O)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)cs1 ZINC000452184273 941366397 /nfs/dbraw/zinc/36/63/97/941366397.db2.gz SFYSYDBIUQCPNE-NWDGAFQWSA-N 0 0 363.439 3.569 20 5 FHBDRN C[C@@H](CC(=O)N[C@@H](C)c1ccc([N+](=O)[O-])cc1)C(=O)c1cccc(F)c1 ZINC000452183318 941366663 /nfs/dbraw/zinc/36/66/63/941366663.db2.gz OGMOBQBUMUBTMP-STQMWFEESA-N 0 0 358.369 3.820 20 5 FHBDRN Cc1cc(Br)oc1C(=O)N1c2ccc([N+](=O)[O-])cc2C[C@H]1C ZINC000103375672 941379883 /nfs/dbraw/zinc/37/98/83/941379883.db2.gz GOEGSRASVZOABP-SECBINFHSA-N 0 0 365.183 3.850 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)N2CCCC[C@@H]2c2cc[nH]n2)cc1[N+](=O)[O-] ZINC000376699852 941383778 /nfs/dbraw/zinc/38/37/78/941383778.db2.gz KPUSYTUZPWUTCP-XJKSGUPXSA-N 0 0 357.414 3.624 20 5 FHBDRN C[C@@H](NC(=O)c1csc([N+](=O)[O-])c1)c1nc(C(F)(F)F)cs1 ZINC000278809399 941385175 /nfs/dbraw/zinc/38/51/75/941385175.db2.gz SHSOWFJSHTYFPU-RXMQYKEDSA-N 0 0 351.331 3.623 20 5 FHBDRN O=[N+]([O-])c1ccccc1-c1ccc(CNCc2cnc3n2CCCC3)o1 ZINC000376716531 941388359 /nfs/dbraw/zinc/38/83/59/941388359.db2.gz NQBCBGGQKAPFLX-UHFFFAOYSA-N 0 0 352.394 3.677 20 5 FHBDRN CNC(=O)c1ccc(Cl)cc1NC(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000122276338 941399896 /nfs/dbraw/zinc/39/98/96/941399896.db2.gz HDTZYLOKQGRONQ-UHFFFAOYSA-N 0 0 368.176 3.514 20 5 FHBDRN O=C(c1c[nH]c2cccc([N+](=O)[O-])c21)N1CCSC2(CCCCC2)C1 ZINC000408024414 941404853 /nfs/dbraw/zinc/40/48/53/941404853.db2.gz ALHWPKOIHCQRPW-UHFFFAOYSA-N 0 0 359.451 3.968 20 5 FHBDRN CCOc1cn(-c2ccccc2)nc1C(=O)OCc1ccccc1[N+](=O)[O-] ZINC000728681384 941421603 /nfs/dbraw/zinc/42/16/03/941421603.db2.gz JDKKWYUWSDOUHD-UHFFFAOYSA-N 0 0 367.361 3.536 20 5 FHBDRN C[C@H](Nc1ccc([N+](=O)[O-])c(OC(F)F)c1)c1nnc2n1CCCCC2 ZINC000376812198 941439922 /nfs/dbraw/zinc/43/99/22/941439922.db2.gz VQBFUFGQGZDLPW-JTQLQIEISA-N 0 0 367.356 3.687 20 5 FHBDRN O=C([O-])CCCC[NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000414688252 941439953 /nfs/dbraw/zinc/43/99/53/941439953.db2.gz YBOKLMKXRADXCY-UHFFFAOYSA-N 0 0 362.357 3.871 20 5 FHBDRN COc1ccc([C@@H](C)NC(=O)c2c(Cl)cccc2[N+](=O)[O-])cc1F ZINC000110182889 941442091 /nfs/dbraw/zinc/44/20/91/941442091.db2.gz XSLKHHLYOMWQQU-SECBINFHSA-N 0 0 352.749 3.887 20 5 FHBDRN Cc1cccc(N2CCN(C(=O)c3c(Cl)cccc3[N+](=O)[O-])CC2)c1 ZINC000110186020 941444531 /nfs/dbraw/zinc/44/45/31/941444531.db2.gz GKIRUPMHIXOFTP-UHFFFAOYSA-N 0 0 359.813 3.519 20 5 FHBDRN C[C@@H](C(=O)N1CC=C(c2cncc(F)c2)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000376892119 941460973 /nfs/dbraw/zinc/46/09/73/941460973.db2.gz HSVDSXCCBZSOGA-GFCCVEGCSA-N 0 0 373.359 3.687 20 5 FHBDRN O=C(Cn1cnc2cc(F)c(F)cc21)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000024381033 941483189 /nfs/dbraw/zinc/48/31/89/941483189.db2.gz WYZMNZWROIRYJG-UHFFFAOYSA-N 0 0 366.711 3.515 20 5 FHBDRN C[C@@H]1CCN(c2nnc(-c3cccc([N+](=O)[O-])c3)n2Cc2ccccc2)C1 ZINC000549131201 941498669 /nfs/dbraw/zinc/49/86/69/941498669.db2.gz WNCGRROHRPABGT-OAHLLOKOSA-N 0 0 363.421 3.748 20 5 FHBDRN O=C(c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)N1Cc2cccc(Cl)c2C1 ZINC000377100271 941520945 /nfs/dbraw/zinc/52/09/45/941520945.db2.gz IPGBUNKVDNOPAI-UHFFFAOYSA-N 0 0 369.764 3.658 20 5 FHBDRN C[C@H](NC(=O)c1cc(F)c([N+](=O)[O-])cc1F)c1nccn1-c1ccccc1 ZINC000377121062 941525359 /nfs/dbraw/zinc/52/53/59/941525359.db2.gz XXJBIVKWCTZLEQ-NSHDSACASA-N 0 0 372.331 3.550 20 5 FHBDRN COC(=O)c1cc(NC(=O)[C@@H]2CCC[C@H](C(F)(F)F)C2)cc([N+](=O)[O-])c1 ZINC000136148058 941529150 /nfs/dbraw/zinc/52/91/50/941529150.db2.gz LHAKSKDKPULANL-KOLCDFICSA-N 0 0 374.315 3.689 20 5 FHBDRN CC(C)[C@@H](NC(=O)N1CCC(n2ccc([N+](=O)[O-])n2)CC1)c1ccccc1 ZINC000377182508 941539200 /nfs/dbraw/zinc/53/92/00/941539200.db2.gz FLATZFPGMGYBPW-GOSISDBHSA-N 0 0 371.441 3.535 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC(C)=C(c2ccco2)C1 ZINC000549162228 941560694 /nfs/dbraw/zinc/56/06/94/941560694.db2.gz NHYSLEHANSWSNQ-UHFFFAOYSA-N 0 0 357.366 3.908 20 5 FHBDRN COCCN(C(=O)Nc1ccc(OC)c([N+](=O)[O-])c1)[C@@H](C)c1ccccc1 ZINC000541107685 941595743 /nfs/dbraw/zinc/59/57/43/941595743.db2.gz UMJBMCOCCWHJKS-AWEZNQCLSA-N 0 0 373.409 3.845 20 5 FHBDRN 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CCOc1cccc([C@@H]2C[C@@H]2NC(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000565753043 941646747 /nfs/dbraw/zinc/64/67/47/941646747.db2.gz WLVRCRXFUIGWIV-AGRHKRQWSA-N 0 0 354.406 3.769 20 5 FHBDRN Cc1nc2ccccc2c2c(NC(=O)CCn3ccnn3)c3ccccc3n21 ZINC000549212673 941650662 /nfs/dbraw/zinc/65/06/62/941650662.db2.gz UYYXHUWHGGBMSK-UHFFFAOYSA-N 0 0 370.416 3.569 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N(Cc2ccccc2F)C2CC2)c1 ZINC000549214730 941656147 /nfs/dbraw/zinc/65/61/47/941656147.db2.gz XOIKJUYWOGCYLL-UHFFFAOYSA-N 0 0 358.369 3.937 20 5 FHBDRN O=C(Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1)N[C@@H]1CCCC[C@H]1O ZINC000480751951 941657118 /nfs/dbraw/zinc/65/71/18/941657118.db2.gz FCPAEBSKBZUNKP-QZTJIDSGSA-N 0 0 371.393 3.812 20 5 FHBDRN Cc1ccc(C(=O)N[C@H]2CC(C)(C)Oc3ccc(N)cc32)cc1[N+](=O)[O-] ZINC000565827870 941660261 /nfs/dbraw/zinc/66/02/61/941660261.db2.gz FMTSSWUVYTUWRB-HNNXBMFYSA-N 0 0 355.394 3.518 20 5 FHBDRN Cc1ccccc1-c1noc(COC(=O)c2ccc(C)c([N+](=O)[O-])c2)n1 ZINC000024469538 941661336 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FHBDRN Cc1csc(Nc2cccc(NC(=O)c3cc([N+](=O)[O-])cn3C)c2)n1 ZINC000729333434 941720835 /nfs/dbraw/zinc/72/08/35/941720835.db2.gz FEJKUAIIVUZLJI-UHFFFAOYSA-N 0 0 357.395 3.694 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(NC2(Cc3cccc(F)c3)CCOCC2)n1 ZINC000549245278 941724813 /nfs/dbraw/zinc/72/48/13/941724813.db2.gz OMZRXDNLUNOILJ-UHFFFAOYSA-N 0 0 359.401 3.950 20 5 FHBDRN COC[C@@H](Cc1ccccc1)NC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000472774987 941746081 /nfs/dbraw/zinc/74/60/81/941746081.db2.gz RPDFBEOGOJJQAL-CYBMUJFWSA-N 0 0 363.801 3.627 20 5 FHBDRN CCOc1ccc([C@@H](C)NC(=O)c2cc([N+](=O)[O-])c(C)s2)cc1OC ZINC000047543592 941756051 /nfs/dbraw/zinc/75/60/51/941756051.db2.gz KNIQKMNAWDTXTP-SNVBAGLBSA-N 0 0 364.423 3.863 20 5 FHBDRN COC(=O)C12CCC(c3nc(-c4cc(C)c([N+](=O)[O-])cc4C)no3)(CC1)C2 ZINC000377483702 941757079 /nfs/dbraw/zinc/75/70/79/941757079.db2.gz FEESPJWVEROTAO-UHFFFAOYSA-N 0 0 371.393 3.637 20 5 FHBDRN Cc1onc(-c2cccnc2)c1C(=O)Nc1cc([N+](=O)[O-])c(C)cc1F ZINC000377486135 941758351 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COc1ccc(F)cc1C(=O)N1CCS[C@@H]1c1ccc([N+](=O)[O-])cc1 ZINC000513316977 941851019 /nfs/dbraw/zinc/85/10/19/941851019.db2.gz IPZHHOOFCDEGPR-QGZVFWFLSA-N 0 0 362.382 3.630 20 5 FHBDRN Cc1oc(C(C)C)nc1C(=O)N1CCS[C@@H]1c1ccc([N+](=O)[O-])cc1 ZINC000513316506 941851414 /nfs/dbraw/zinc/85/14/14/941851414.db2.gz DYCYCOLVSUZBGJ-QGZVFWFLSA-N 0 0 361.423 3.902 20 5 FHBDRN COc1cc2c(cc1F)CC[C@@H]2NC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000513338653 941853229 /nfs/dbraw/zinc/85/32/29/941853229.db2.gz NKKISNBBNDEGJU-AWEZNQCLSA-N 0 0 369.352 3.641 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2ncc(C(F)(F)F)s2)c1 ZINC000549293057 941864293 /nfs/dbraw/zinc/86/42/93/941864293.db2.gz BMJRCTYEIDNPBN-UHFFFAOYSA-N 0 0 361.301 3.721 20 5 FHBDRN O=[N+]([O-])c1cccc(Cl)c1CN1CCC(OC[C@H]2CCCCO2)CC1 ZINC000119301029 941877610 /nfs/dbraw/zinc/87/76/10/941877610.db2.gz MJJJXCQQZSNGHD-OAHLLOKOSA-N 0 0 368.861 3.798 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)N1CCOc2c(Cl)cccc21 ZINC000472827998 941881160 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FHBDRN CSc1ccc(C(=O)NCC(C)(C)Oc2ccccc2)cc1[N+](=O)[O-] ZINC000513408677 941902780 /nfs/dbraw/zinc/90/27/80/941902780.db2.gz OTEPGPMEYHXOGE-UHFFFAOYSA-N 0 0 360.435 3.904 20 5 FHBDRN CC[C@@H]1CCCC[C@@H]1c1nc(-c2ccc(-n3cncn3)c([N+](=O)[O-])c2)no1 ZINC000453206329 941904847 /nfs/dbraw/zinc/90/48/47/941904847.db2.gz YJWNKXJVJGITHW-OCCSQVGLSA-N 0 0 368.397 3.909 20 5 FHBDRN Cc1cc(C(=O)N[C@@H]2CCO[C@H]2c2ccc(Cl)cc2)cc([N+](=O)[O-])c1 ZINC000182442501 941925117 /nfs/dbraw/zinc/92/51/17/941925117.db2.gz WZQBBUFWCLSHCP-SJORKVTESA-N 0 0 360.797 3.817 20 5 FHBDRN O=C(N[C@@H]1CCO[C@@H]1c1ccc(Cl)cc1)c1csc([N+](=O)[O-])c1 ZINC000182443813 941925536 /nfs/dbraw/zinc/92/55/36/941925536.db2.gz FCGADUHUNPIHNH-TZMCWYRMSA-N 0 0 352.799 3.570 20 5 FHBDRN CCC[C@H](C)NC(=O)[C@H]1CCCN(c2nc3ccccc3cc2[N+](=O)[O-])C1 ZINC000473528911 941925584 /nfs/dbraw/zinc/92/55/84/941925584.db2.gz IBJLNKACGCIJIZ-HOCLYGCPSA-N 0 0 370.453 3.664 20 5 FHBDRN Cc1c2ccccc2oc1[C@@H](C)NC(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-] ZINC000433834810 941930236 /nfs/dbraw/zinc/93/02/36/941930236.db2.gz DYDYGQFSPHQBKU-LLVKDONJSA-N 0 0 356.382 3.987 20 5 FHBDRN CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F)[C@H]1CCc2ccccc21 ZINC000182511034 941936828 /nfs/dbraw/zinc/93/68/28/941936828.db2.gz OYSCWVJGDWVCFN-HNNXBMFYSA-N 0 0 362.332 3.956 20 5 FHBDRN CC1(C)CC(Nc2nccc(Br)c2[N+](=O)[O-])CC(C)(C)N1O ZINC001167721399 941938540 /nfs/dbraw/zinc/93/85/40/941938540.db2.gz XRLOBKBNQQKNTP-UHFFFAOYSA-N 0 0 373.251 3.575 20 5 FHBDRN CC(C)N(Cc1ccc(Br)cc1)C(=O)c1ccc([N+](=O)[O-])[nH]1 ZINC000513461584 941941254 /nfs/dbraw/zinc/94/12/54/941941254.db2.gz ZLSPSJKXPRYLTB-UHFFFAOYSA-N 0 0 366.215 3.736 20 5 FHBDRN Cc1cn([C@H](C)c2ccccc2)[nH]c1=NC(=O)c1ccc([N+](=O)[O-])cc1C ZINC000472851925 941949963 /nfs/dbraw/zinc/94/99/63/941949963.db2.gz OVNHDDPNDLGPEP-OAHLLOKOSA-N 0 0 364.405 3.692 20 5 FHBDRN O=C(Nc1ccc(O[C@@H]2CCCC[C@H]2O)cc1)Nc1cccc([N+](=O)[O-])c1 ZINC000513472403 941951686 /nfs/dbraw/zinc/95/16/86/941951686.db2.gz DRGOPBXHZZNVCN-QZTJIDSGSA-N 0 0 371.393 3.921 20 5 FHBDRN CCCCN1CCc2ccc(NC(=O)c3cc([N+](=O)[O-])cnc3C)cc21 ZINC000122624059 941956421 /nfs/dbraw/zinc/95/64/21/941956421.db2.gz BMHHGLDAJQQWLH-UHFFFAOYSA-N 0 0 354.410 3.713 20 5 FHBDRN CCC[C@H]1C[C@@H](C(=O)Nc2cc(C)nn2-c2ccc([N+](=O)[O-])cc2)CCO1 ZINC000182773941 941959460 /nfs/dbraw/zinc/95/94/60/941959460.db2.gz IVCBMERWXGBDCS-YOEHRIQHSA-N 0 0 372.425 3.623 20 5 FHBDRN Cc1cc(F)c([N+](=O)[O-])cc1C(=O)Nc1nc2c(cccc2Cl)n1C ZINC001267692125 941963220 /nfs/dbraw/zinc/96/32/20/941963220.db2.gz OUXUXCPTLOWQBT-UHFFFAOYSA-N 0 0 362.748 3.835 20 5 FHBDRN COc1ccc([C@@H](NC(=O)CNc2cc([N+](=O)[O-])ccc2C)C2CC2)cc1 ZINC000025596997 941964727 /nfs/dbraw/zinc/96/47/27/941964727.db2.gz GOZVBFUGRBZUEM-FQEVSTJZSA-N 0 0 369.421 3.591 20 5 FHBDRN COC(=O)c1ccc(Cl)c(COc2ccc(C(C)=O)cc2[N+](=O)[O-])c1 ZINC000182763170 941965770 /nfs/dbraw/zinc/96/57/70/941965770.db2.gz IRUDAEJYYJLZQO-UHFFFAOYSA-N 0 0 363.753 3.816 20 5 FHBDRN Cc1cc(NC(=O)N2CC[C@@H](COCc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000182762031 941965911 /nfs/dbraw/zinc/96/59/11/941965911.db2.gz BFTATYLHDJVFKF-QGZVFWFLSA-N 0 0 369.421 3.974 20 5 FHBDRN CN(Cc1cc(Cl)ccc1F)C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000433898264 941970188 /nfs/dbraw/zinc/97/01/88/941970188.db2.gz RYAFMPQAQXFEEJ-UHFFFAOYSA-N 0 0 365.792 3.771 20 5 FHBDRN COc1c(C(=O)N2CC[C@@H](C(F)(F)F)C3(CCC3)C2)cccc1[N+](=O)[O-] ZINC000513501120 941974397 /nfs/dbraw/zinc/97/43/97/941974397.db2.gz QXOYJZLLOJXGKV-CYBMUJFWSA-N 0 0 372.343 3.798 20 5 FHBDRN CC1(C)CN(C(=O)c2cc([N+](=O)[O-])c[nH]2)c2ccc(Br)cc21 ZINC000513521940 941980824 /nfs/dbraw/zinc/98/08/24/941980824.db2.gz VAHJYEMYGQUYTQ-UHFFFAOYSA-N 0 0 364.199 3.623 20 5 FHBDRN Cc1nc([C@H]2CCCCCN2C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)no1 ZINC000412260525 941997893 /nfs/dbraw/zinc/99/78/93/941997893.db2.gz VAICVDASKGZSHP-GVDBMIGSSA-N 0 0 370.409 3.534 20 5 FHBDRN CCOc1ccc([C@H](O)C2CCN(c3ccc(N)cc3[N+](=O)[O-])CC2)cc1 ZINC000365704253 942001046 /nfs/dbraw/zinc/00/10/46/942001046.db2.gz PCKQFBPHIDPPEN-FQEVSTJZSA-N 0 0 371.437 3.526 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])[nH]1)N1CC[C@@](F)(c2cccc(C(F)(F)F)c2)C1 ZINC000513533881 942002106 /nfs/dbraw/zinc/00/21/06/942002106.db2.gz UHZHMALSZOUNPS-HNNXBMFYSA-N 0 0 371.290 3.653 20 5 FHBDRN Cc1cccc(C2(CNC(=O)c3[nH]nc(C(C)C)c3[N+](=O)[O-])CCCC2)c1 ZINC000433938068 942003743 /nfs/dbraw/zinc/00/37/43/942003743.db2.gz BSASLCAIOOFDQA-UHFFFAOYSA-N 0 0 370.453 3.992 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)Nc1ncc(-c2ccccc2F)s1 ZINC000549336327 942004320 /nfs/dbraw/zinc/00/43/20/942004320.db2.gz WKSRDKWRFVWDSY-UHFFFAOYSA-N 0 0 358.354 3.813 20 5 FHBDRN CC1(C)CN(C(=O)Nc2cccc([N+](=O)[O-])c2Cl)[C@@H]1[C@@H]1CCCO1 ZINC000377822596 942015387 /nfs/dbraw/zinc/01/53/87/942015387.db2.gz YQVKCYVXHQOEGW-GXTWGEPZSA-N 0 0 353.806 3.670 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2cccc(-c3ncc[nH]3)c2)c1 ZINC000549341446 942015586 /nfs/dbraw/zinc/01/55/86/942015586.db2.gz YKCKQKMQHDIYPJ-UHFFFAOYSA-N 0 0 352.350 3.636 20 5 FHBDRN COCC[C@H]1CCCCN(C(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)C1 ZINC000412270573 942017092 /nfs/dbraw/zinc/01/70/92/942017092.db2.gz NFPGTCVYYPCOAI-OAHLLOKOSA-N 0 0 364.442 3.661 20 5 FHBDRN CC(C)(C)OCc1cccc(CNC(=O)NCc2ccccc2[N+](=O)[O-])c1 ZINC000101937866 942026649 /nfs/dbraw/zinc/02/66/49/942026649.db2.gz FGGPALAYNUOJER-UHFFFAOYSA-N 0 0 371.437 3.909 20 5 FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)NC1CCC2(CC2)CC1 ZINC000433992633 942032196 /nfs/dbraw/zinc/03/21/96/942032196.db2.gz DRSKUDPEXFSGOM-UHFFFAOYSA-N 0 0 364.467 3.786 20 5 FHBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])NC1CCC2(CC2)CC1 ZINC000433997213 942033589 /nfs/dbraw/zinc/03/35/89/942033589.db2.gz NJASMTNZMCMBRL-UHFFFAOYSA-N 0 0 352.818 3.856 20 5 FHBDRN Cc1cc(Br)ccc1CN(C)C(=O)c1ccc([N+](=O)[O-])cc1 ZINC000433998092 942034352 /nfs/dbraw/zinc/03/43/52/942034352.db2.gz DDVIKDBMIHIAIT-UHFFFAOYSA-N 0 0 363.211 3.938 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCc1ccc(-n2cccn2)cc1 ZINC000085620122 942035190 /nfs/dbraw/zinc/03/51/90/942035190.db2.gz UFNMJSTZXTWLDE-UHFFFAOYSA-N 0 0 365.393 3.719 20 5 FHBDRN COc1ccc(CSCC(=O)NC2CCC3(CC3)CC2)cc1[N+](=O)[O-] ZINC000433999521 942035382 /nfs/dbraw/zinc/03/53/82/942035382.db2.gz PDWQLFUTJLAVLG-UHFFFAOYSA-N 0 0 364.467 3.676 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)NC[C@@H]2CCCC[C@H]2C(F)(F)F)c1[N+](=O)[O-] ZINC000434012719 942039648 /nfs/dbraw/zinc/03/96/48/942039648.db2.gz QJNPBDQINQIMMD-VHSXEESVSA-N 0 0 362.352 3.540 20 5 FHBDRN CC(C)Oc1cc(C(=O)Nc2ccc3c(n2)CCCC3=O)ccc1[N+](=O)[O-] ZINC000415771719 942044042 /nfs/dbraw/zinc/04/40/42/942044042.db2.gz DGQGRSNTDZLZMA-UHFFFAOYSA-N 0 0 369.377 3.548 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1Cl)N1CCC([C@H]2CCCOC2)CC1 ZINC000377873180 942044953 /nfs/dbraw/zinc/04/49/53/942044953.db2.gz IEVWNCCGGNZKCG-ZDUSSCGKSA-N 0 0 367.833 3.919 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N2CC[C@@H](Cc3ccccc3)[C@H]2C)c1[N+](=O)[O-] ZINC000434033773 942048240 /nfs/dbraw/zinc/04/82/40/942048240.db2.gz YDMPVDGFKIELSM-HIFRSBDPSA-N 0 0 356.426 3.535 20 5 FHBDRN O=C(Nc1cc(F)c(F)cc1F)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000181569620 942049973 /nfs/dbraw/zinc/04/99/73/942049973.db2.gz AOJIJHOXKZHGRH-UHFFFAOYSA-N 0 0 362.210 3.866 20 5 FHBDRN Cc1nn(CCC(=O)N(C)Cc2ccc(C(C)C)cc2)c(C)c1[N+](=O)[O-] ZINC000102322580 942051529 /nfs/dbraw/zinc/05/15/29/942051529.db2.gz YNBFKSNZBUHULJ-UHFFFAOYSA-N 0 0 358.442 3.580 20 5 FHBDRN C/C(=C/c1cccc([N+](=O)[O-])c1)CNc1ccc(CS(C)(=O)=O)cc1 ZINC000468629983 942058011 /nfs/dbraw/zinc/05/80/11/942058011.db2.gz KDGPYVQGFXQBMU-UVTDQMKNSA-N 0 0 360.435 3.655 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N(C)[C@@H](C)C2CCCCC2)c1F ZINC000412282820 942061323 /nfs/dbraw/zinc/06/13/23/942061323.db2.gz CGJDBZDPEVCCPP-LBPRGKRZSA-N 0 0 352.406 3.712 20 5 FHBDRN Cc1csc(N(C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)C2CC2)n1 ZINC000183010729 942063131 /nfs/dbraw/zinc/06/31/31/942063131.db2.gz VQACAGFMWAFYCW-UHFFFAOYSA-N 0 0 369.349 3.770 20 5 FHBDRN Cc1c(CNC(=O)C[C@@H](c2ccc(O)cc2)C2CC2)cccc1[N+](=O)[O-] ZINC000412290398 942066813 /nfs/dbraw/zinc/06/68/13/942066813.db2.gz MHNRHZJRNTWNNF-GOSISDBHSA-N 0 0 354.406 3.809 20 5 FHBDRN CCOCc1cccc(NC(=O)CCOc2cc(C)ccc2[N+](=O)[O-])c1 ZINC000102502120 942067280 /nfs/dbraw/zinc/06/72/80/942067280.db2.gz UYHHUXVLZGWYNR-UHFFFAOYSA-N 0 0 358.394 3.847 20 5 FHBDRN CCC[C@@]1(COC)CCCN1C(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1 ZINC000412295405 942074878 /nfs/dbraw/zinc/07/48/78/942074878.db2.gz UPUKNDIBWMYETI-IBGZPJMESA-N 0 0 364.442 3.803 20 5 FHBDRN CN(Cc1ccc(F)cc1)C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513685452 942076145 /nfs/dbraw/zinc/07/61/45/942076145.db2.gz NKISUMRRKLNJQR-UHFFFAOYSA-N 0 0 354.284 3.608 20 5 FHBDRN O=C(Nc1ccc2c(c1)CCN2)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000415846683 942081142 /nfs/dbraw/zinc/08/11/42/942081142.db2.gz YVFDXSGDUOJGEM-UHFFFAOYSA-N 0 0 352.394 3.759 20 5 FHBDRN COCC1(CCNC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CCC1 ZINC000501855748 942083027 /nfs/dbraw/zinc/08/30/27/942083027.db2.gz CHJJYLNBEVQGLC-UHFFFAOYSA-N 0 0 360.332 3.550 20 5 FHBDRN CCOC(=O)c1cc(C(=O)Nc2cc(F)ccc2Cl)cc([N+](=O)[O-])c1 ZINC000102741911 942096654 /nfs/dbraw/zinc/09/66/54/942096654.db2.gz QPPKEAJSJVTSEQ-UHFFFAOYSA-N 0 0 366.732 3.816 20 5 FHBDRN C[C@H](CSc1ccc([N+](=O)[O-])c(S(C)(=O)=O)c1)c1ccccc1 ZINC000183333584 942098161 /nfs/dbraw/zinc/09/81/61/942098161.db2.gz ZDBWDYSUBWKDMN-GFCCVEGCSA-N 0 0 351.449 3.894 20 5 FHBDRN Cc1nc2ccccc2n1C1CCN(c2nccc(C)c2[N+](=O)[O-])CC1 ZINC000280097958 942106184 /nfs/dbraw/zinc/10/61/84/942106184.db2.gz ASIPVBYMAPIFLS-UHFFFAOYSA-N 0 0 351.410 3.798 20 5 FHBDRN Cc1csc([C@@H](C)CNC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])n1 ZINC000280097220 942106339 /nfs/dbraw/zinc/10/63/39/942106339.db2.gz JRMNCTWKXVKZCB-QMMMGPOBSA-N 0 0 371.821 3.615 20 5 FHBDRN Cc1nc(N2CCC[C@@H]2c2ccc(Br)cn2)ccc1[N+](=O)[O-] ZINC000413379336 942114348 /nfs/dbraw/zinc/11/43/48/942114348.db2.gz QWMXNPSMRLRWNE-CQSZACIVSA-N 0 0 363.215 3.797 20 5 FHBDRN O=[N+]([O-])c1ccccc1NCCNc1nnc(Cc2ccccc2)s1 ZINC000302088386 942117063 /nfs/dbraw/zinc/11/70/63/942117063.db2.gz OIJXAWUGYXLUFW-UHFFFAOYSA-N 0 0 355.423 3.561 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)NC[C@@H]1CCO[C@H]1c1ccccc1 ZINC000280170468 942122348 /nfs/dbraw/zinc/12/23/48/942122348.db2.gz XNNYJTHYJZSXQK-KXBFYZLASA-N 0 0 370.405 3.501 20 5 FHBDRN COc1cc(C(=O)N2C[C@@H](C)O[C@H](c3ccccc3)C2)cc([N+](=O)[O-])c1C ZINC000190102394 942123668 /nfs/dbraw/zinc/12/36/68/942123668.db2.gz AVIDZCMYTCGBQY-YJYMSZOUSA-N 0 0 370.405 3.514 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(N2CCC[C@@H]2c2ccc(Br)cn2)n1 ZINC000413383194 942123766 /nfs/dbraw/zinc/12/37/66/942123766.db2.gz XCUGHKVLAAHHGR-CYBMUJFWSA-N 0 0 363.215 3.797 20 5 FHBDRN CCNc1ccc(C(=O)Nc2cccc([C@H](C)C(=O)OC)c2)cc1[N+](=O)[O-] ZINC000415907042 942135146 /nfs/dbraw/zinc/13/51/46/942135146.db2.gz MDZHNJVNWWIGPJ-LBPRGKRZSA-N 0 0 371.393 3.555 20 5 FHBDRN CNc1ccc(C(=O)N[C@H]2CCSc3ccc(F)cc32)cc1[N+](=O)[O-] ZINC000016110725 942135319 /nfs/dbraw/zinc/13/53/19/942135319.db2.gz XRAGZOUEMMPOFZ-ZDUSSCGKSA-N 0 0 361.398 3.743 20 5 FHBDRN C[C@@H]1CC[C@H](CNc2cc(C(F)(F)C(F)(F)F)ncc2[N+](=O)[O-])O1 ZINC000413381474 942136659 /nfs/dbraw/zinc/13/66/59/942136659.db2.gz WHKTUFJIXBTMFY-HTQZYQBOSA-N 0 0 355.263 3.623 20 5 FHBDRN CC(=O)c1cc(N2C[C@H](C)C[C@H](C(=O)OC(C)(C)C)C2)ccc1[N+](=O)[O-] ZINC000420643451 942138519 /nfs/dbraw/zinc/13/85/19/942138519.db2.gz UJIDGEXOGXEREY-OCCSQVGLSA-N 0 0 362.426 3.602 20 5 FHBDRN CC(=O)c1cc(N2C[C@H](C)C[C@@H](C(=O)OC(C)(C)C)C2)ccc1[N+](=O)[O-] ZINC000420643452 942138635 /nfs/dbraw/zinc/13/86/35/942138635.db2.gz UJIDGEXOGXEREY-TZMCWYRMSA-N 0 0 362.426 3.602 20 5 FHBDRN CO[C@@](C)([C@H](C)NC(=O)c1c([N+](=O)[O-])cccc1C(F)(F)F)C1CC1 ZINC000415914548 942139465 /nfs/dbraw/zinc/13/94/65/942139465.db2.gz AXXQLCGQDNXJSK-VFZGTOFNSA-N 0 0 360.332 3.547 20 5 FHBDRN CO[C@](C)([C@H](C)NC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-])C1CC1 ZINC000415914759 942139774 /nfs/dbraw/zinc/13/97/74/942139774.db2.gz BSVHCLJOSSGVLX-BJOHPYRUSA-N 0 0 360.332 3.547 20 5 FHBDRN C[C@H](c1cccnc1)N(C)C(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-] ZINC000280233670 942141276 /nfs/dbraw/zinc/14/12/76/942141276.db2.gz ROHCVAFYDSLDCL-SNVBAGLBSA-N 0 0 351.765 3.544 20 5 FHBDRN Cc1cccc(C(=O)NCCCc2c[nH]c3ccc(F)cc23)c1[N+](=O)[O-] ZINC000501965111 942142175 /nfs/dbraw/zinc/14/21/75/942142175.db2.gz AMDFKFIUWGEYLQ-UHFFFAOYSA-N 0 0 355.369 3.886 20 5 FHBDRN Cc1nc2c(cccc2C(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)o1 ZINC000280237129 942142555 /nfs/dbraw/zinc/14/25/55/942142555.db2.gz WNDLMVSXXBPWJS-UHFFFAOYSA-N 0 0 351.362 3.849 20 5 FHBDRN O=[N+]([O-])c1cc(Br)cnc1NC[C@@H]1CC12CCSCC2 ZINC000420652555 942143322 /nfs/dbraw/zinc/14/33/22/942143322.db2.gz MQHYTSOHBFUEIS-VIFPVBQESA-N 0 0 358.261 3.698 20 5 FHBDRN CC[C@H](C)[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)C(=O)OC(C)(C)C ZINC000159016050 942146281 /nfs/dbraw/zinc/14/62/81/942146281.db2.gz LDOFEQKVUYENKN-HZMBPMFUSA-N 0 0 370.833 3.734 20 5 FHBDRN COc1ccccc1C1(CNC(=O)c2cc(C)ccc2[N+](=O)[O-])CCC1 ZINC000545428765 942147834 /nfs/dbraw/zinc/14/78/34/942147834.db2.gz PHWFDGJQZRMVJP-UHFFFAOYSA-N 0 0 354.406 3.764 20 5 FHBDRN C[C@@H](Nc1ccc([N+](=O)[O-])cc1Br)[C@H](O)Cc1ccccc1 ZINC000501982433 942152564 /nfs/dbraw/zinc/15/25/64/942152564.db2.gz KOORHONBRBJSRH-BDJLRTHQSA-N 0 0 365.227 3.761 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCCc1cccc2[nH]ccc21 ZINC000501973063 942156107 /nfs/dbraw/zinc/15/61/07/942156107.db2.gz IRWZQUMLRPPMCP-CYBMUJFWSA-N 0 0 369.446 3.916 20 5 FHBDRN COc1ccc(C(=O)NCc2ccccc2N2CCCCC2)cc1[N+](=O)[O-] ZINC000183126788 942158777 /nfs/dbraw/zinc/15/87/77/942158777.db2.gz ZMVMWYCEDJZKOL-UHFFFAOYSA-N 0 0 369.421 3.524 20 5 FHBDRN Cc1cc(C(=O)NCCCc2c[nH]c3ccc(F)cc23)ccc1[N+](=O)[O-] ZINC000502004246 942164986 /nfs/dbraw/zinc/16/49/86/942164986.db2.gz VLIGZUYZAMMKNV-UHFFFAOYSA-N 0 0 355.369 3.886 20 5 FHBDRN Cc1sc(C(=O)Nc2ccc(NC(=O)NC(C)C)cc2)cc1[N+](=O)[O-] ZINC000024466016 942170700 /nfs/dbraw/zinc/17/07/00/942170700.db2.gz HEWIWSJIQIIJTR-UHFFFAOYSA-N 0 0 362.411 3.747 20 5 FHBDRN C[C@H](Nc1ccc(NC(=O)c2nn(C)cc2[N+](=O)[O-])cc1)c1ccccc1 ZINC000502020201 942175673 /nfs/dbraw/zinc/17/56/73/942175673.db2.gz UJOMLVZTOPLERC-ZDUSSCGKSA-N 0 0 365.393 3.754 20 5 FHBDRN COc1cccc(C=C2CCN(C(=O)Cc3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000472931745 942180885 /nfs/dbraw/zinc/18/08/85/942180885.db2.gz LBHQJYSBEQYNRM-UHFFFAOYSA-N 0 0 366.417 3.852 20 5 FHBDRN C[C@H](CNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21)c1ccc(F)cc1 ZINC000502034376 942181343 /nfs/dbraw/zinc/18/13/43/942181343.db2.gz SZWKVIBJZNZPCQ-CYBMUJFWSA-N 0 0 355.369 3.609 20 5 FHBDRN CCOC(=O)CC[C@@H]1CCCN(c2ccc([N+](=O)[O-])c3cnccc32)C1 ZINC000128377750 942182336 /nfs/dbraw/zinc/18/23/36/942182336.db2.gz ZZNQTCXGNBQGQL-AWEZNQCLSA-N 0 0 357.410 3.703 20 5 FHBDRN Cc1c(CC(=O)NCc2ccccc2N2CCCCC2)cccc1[N+](=O)[O-] ZINC000183149535 942184613 /nfs/dbraw/zinc/18/46/13/942184613.db2.gz QABCNAJCJXCXDP-UHFFFAOYSA-N 0 0 367.449 3.752 20 5 FHBDRN COc1ccc(-c2nsc(NC(=O)c3cc(C)cc([N+](=O)[O-])c3)n2)cc1 ZINC000103034852 942187904 /nfs/dbraw/zinc/18/79/04/942187904.db2.gz XBCCKIIPROUHMD-UHFFFAOYSA-N 0 0 370.390 3.683 20 5 FHBDRN C[C@H](CC(=O)c1cccs1)NC(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000159026588 942191447 /nfs/dbraw/zinc/19/14/47/942191447.db2.gz YTMPIHKALLKXOG-LLVKDONJSA-N 0 0 369.402 3.596 20 5 FHBDRN CC(C)NC(=O)c1ccc(N2Cc3ccc(Cl)cc3C2)c([N+](=O)[O-])c1 ZINC000413446384 942192251 /nfs/dbraw/zinc/19/22/51/942192251.db2.gz HAGYWPYAOGIUIL-UHFFFAOYSA-N 0 0 359.813 3.907 20 5 FHBDRN CC(C)n1nccc1[C@H]1OCC[C@@H]1c1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000280545067 942203963 /nfs/dbraw/zinc/20/39/63/942203963.db2.gz IKZUFMFKCSHZDZ-HOCLYGCPSA-N 0 0 369.381 3.667 20 5 FHBDRN O=[N+]([O-])c1cnc2ccc(Br)cc2c1NCCc1ccco1 ZINC000502079451 942207589 /nfs/dbraw/zinc/20/75/89/942207589.db2.gz YHLOCQHITAPZNN-UHFFFAOYSA-N 0 0 362.183 3.575 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CC[C@@H](O)[C@H](C3CCCC3)C2)cc1C(F)(F)F ZINC000413449869 942209913 /nfs/dbraw/zinc/20/99/13/942209913.db2.gz KOGQABJXUNWIQQ-XJKSGUPXSA-N 0 0 358.360 3.991 20 5 FHBDRN Cc1cccc2[nH]cc(CCNC(=O)c3c[nH]c4ccc([N+](=O)[O-])cc34)c21 ZINC000103128098 942212757 /nfs/dbraw/zinc/21/27/57/942212757.db2.gz JSBYZGJMVZNIOL-UHFFFAOYSA-N 0 0 362.389 3.838 20 5 FHBDRN CC[C@]1(CO)CCCN(c2cc(C)c([N+](=O)[O-])cc2Br)C1 ZINC000302663941 942217795 /nfs/dbraw/zinc/21/77/95/942217795.db2.gz IVXIRGKPPDMKKH-HNNXBMFYSA-N 0 0 357.248 3.655 20 5 FHBDRN CCC(=O)c1ccc(N2CCC[C@H](c3nnc(C4CC4)[nH]3)C2)c([N+](=O)[O-])c1 ZINC000280646482 942221191 /nfs/dbraw/zinc/22/11/91/942221191.db2.gz DXHLKNSOSASACT-AWEZNQCLSA-N 0 0 369.425 3.567 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@H](C)c1c(F)cccc1OC ZINC000122773282 942223260 /nfs/dbraw/zinc/22/32/60/942223260.db2.gz GMQLBNWRDRQEGP-SNVBAGLBSA-N 0 0 363.345 3.634 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N(C)[C@H]1CCc2ccccc2C1 ZINC000122781053 942223301 /nfs/dbraw/zinc/22/33/01/942223301.db2.gz SECYLLNHPZEFMI-HNNXBMFYSA-N 0 0 355.394 3.625 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CN[C@@H](C(=O)OC(C)(C)C)c1ccccc1 ZINC000159039801 942227121 /nfs/dbraw/zinc/22/71/21/942227121.db2.gz HJVMOCQEPVBHNA-GOSISDBHSA-N 0 0 372.421 3.776 20 5 FHBDRN COc1ccccc1[C@H](NC(=O)c1ccc([N+](=O)[O-])s1)c1ccco1 ZINC000129367090 942228227 /nfs/dbraw/zinc/22/82/27/942228227.db2.gz YFDAFBAHLKLZST-INIZCTEOSA-N 0 0 358.375 3.777 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N[C@@H](C)c2ccc(F)cc2F)c1C ZINC000480956671 942230126 /nfs/dbraw/zinc/23/01/26/942230126.db2.gz PJINNFNNAWUTBI-NSHDSACASA-N 0 0 370.377 3.529 20 5 FHBDRN O=[N+]([O-])c1cccc(S(=O)(=O)Nc2ccc(F)c(C(F)(F)F)c2)c1 ZINC000103181343 942232576 /nfs/dbraw/zinc/23/25/76/942232576.db2.gz LURVVWYTBYWSPG-UHFFFAOYSA-N 0 0 364.276 3.554 20 5 FHBDRN O=C(N[C@H]1CCc2c1cccc2O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000122798991 942235354 /nfs/dbraw/zinc/23/53/54/942235354.db2.gz SDOXMNLVKATGQO-AWEZNQCLSA-N 0 0 366.295 3.737 20 5 FHBDRN CC(C)Oc1cc(C(=O)N(C)Cc2cnc(C(C)C)nc2)ccc1[N+](=O)[O-] ZINC000412320167 942235564 /nfs/dbraw/zinc/23/55/64/942235564.db2.gz KODKTZCKELLEMZ-UHFFFAOYSA-N 0 0 372.425 3.568 20 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/nfs/dbraw/zinc/24/08/95/942240895.db2.gz FNHWZAMOZOSZMD-WOJBJXKFSA-N 0 0 368.433 3.782 20 5 FHBDRN CC(C)[C@@H]1CCCC[C@H]1NC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000103326278 942244465 /nfs/dbraw/zinc/24/44/65/942244465.db2.gz KPNONADDNNUHSP-GXTWGEPZSA-N 0 0 367.833 3.518 20 5 FHBDRN C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)Cc1ccc(OC(F)F)cc1 ZINC000103376972 942247921 /nfs/dbraw/zinc/24/79/21/942247921.db2.gz HJWCHKOYCGAICV-NSHDSACASA-N 0 0 362.332 3.717 20 5 FHBDRN C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1ccc(Br)cc1 ZINC000103377596 942249004 /nfs/dbraw/zinc/24/90/04/942249004.db2.gz ZNLKIAFRNJQWCP-JTQLQIEISA-N 0 0 361.195 3.949 20 5 FHBDRN CC1CCN(c2ccc(C(=O)N3CC[C@H](C4CC4)C3)cc2[N+](=O)[O-])CC1 ZINC000480989964 942251900 /nfs/dbraw/zinc/25/19/00/942251900.db2.gz XOZPULKMRHSYIT-KRWDZBQOSA-N 0 0 357.454 3.703 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)Nc1ccc(C(=O)N(C)C)cc1F ZINC000416012449 942253327 /nfs/dbraw/zinc/25/33/27/942253327.db2.gz LEQUCEBRDCLRHO-UHFFFAOYSA-N 0 0 373.384 3.613 20 5 FHBDRN O=C(NC1(c2ccc(Br)cc2)CCC1)c1ccc([N+](=O)[O-])o1 ZINC000055821648 942259080 /nfs/dbraw/zinc/25/90/80/942259080.db2.gz IPOZMNOIJUQOIR-UHFFFAOYSA-N 0 0 365.183 3.760 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1N1C[C@@H](O)C[C@H]1c1ccccc1 ZINC000413498648 942259183 /nfs/dbraw/zinc/25/91/83/942259183.db2.gz HMPYAHQFBKBSGF-ZFWWWQNUSA-N 0 0 363.211 3.670 20 5 FHBDRN C[C@H]1CN(c2ncc([N+](=O)[O-])cc2C(F)(F)F)C[C@H](c2ccccc2)O1 ZINC000413077833 942260853 /nfs/dbraw/zinc/26/08/53/942260853.db2.gz SHHNERCMLAYQFF-XHDPSFHLSA-N 0 0 367.327 3.975 20 5 FHBDRN CCCCC[C@H]1CCCN1S(=O)(=O)CCc1ccccc1[N+](=O)[O-] ZINC000501014813 942263169 /nfs/dbraw/zinc/26/31/69/942263169.db2.gz RGUXTCNKNZFHFI-INIZCTEOSA-N 0 0 354.472 3.512 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)NCCc2c[nH]c3ccccc23)c1 ZINC000016206310 942268097 /nfs/dbraw/zinc/26/80/97/942268097.db2.gz WODWNLJJTDGERU-UHFFFAOYSA-N 0 0 355.419 3.771 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CSCc1nn(C)cc1Br ZINC000419472484 942271209 /nfs/dbraw/zinc/27/12/09/942271209.db2.gz AWHCNHHBYUQESE-UHFFFAOYSA-N 0 0 372.244 3.533 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)N(C)[C@@H]2CCCC[C@@H]2c2ccccc2)n1 ZINC000416021682 942273260 /nfs/dbraw/zinc/27/32/60/942273260.db2.gz YSHSTEVEBKMALK-HZPDHXFCSA-N 0 0 356.426 3.610 20 5 FHBDRN CSc1ccccc1NC(=O)CN(C)Cc1c(F)cccc1[N+](=O)[O-] ZINC000103465007 942273337 /nfs/dbraw/zinc/27/33/37/942273337.db2.gz KEHMPPSVSKNNDF-UHFFFAOYSA-N 0 0 363.414 3.526 20 5 FHBDRN CC(C)(C)[C@@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CCO1 ZINC000481012405 942274331 /nfs/dbraw/zinc/27/43/31/942274331.db2.gz ZEKODJGIACBUKC-JSGCOSHPSA-N 0 0 374.359 3.937 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)N1CCO[C@H](c2ccccc2Cl)C1 ZINC000103502498 942278075 /nfs/dbraw/zinc/27/80/75/942278075.db2.gz YYVAZJXKIWBABG-INIZCTEOSA-N 0 0 361.785 3.854 20 5 FHBDRN O=C(c1csc(Cl)c1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000187969442 942280818 /nfs/dbraw/zinc/28/08/18/942280818.db2.gz NVJJOYVQGLENMG-UHFFFAOYSA-N 0 0 366.826 3.993 20 5 FHBDRN CCn1cc([C@@H]2OCC[C@H]2CNc2c(Cl)cccc2[N+](=O)[O-])cn1 ZINC000413506945 942280892 /nfs/dbraw/zinc/28/08/92/942280892.db2.gz DLWXRGXBZNWKOU-MEDUHNTESA-N 0 0 350.806 3.654 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(NCC2(c3ccc(F)cc3)CCOCC2)c1 ZINC000518348608 942280979 /nfs/dbraw/zinc/28/09/79/942280979.db2.gz DCJKDQDHTJSAQE-UHFFFAOYSA-N 0 0 360.385 3.903 20 5 FHBDRN CC(=O)c1ccc2c(c1)CN(c1cc(C(F)(F)F)ncc1[N+](=O)[O-])C2 ZINC000413506193 942281035 /nfs/dbraw/zinc/28/10/35/942281035.db2.gz PYKLRMMXHROSES-UHFFFAOYSA-N 0 0 351.284 3.731 20 5 FHBDRN CCC(CC)[C@@H]1C[C@H](NC(=O)CSc2ccc([N+](=O)[O-])cc2)CCO1 ZINC000183467321 942288896 /nfs/dbraw/zinc/28/88/96/942288896.db2.gz FOZUYGCPWBENLL-PBHICJAKSA-N 0 0 366.483 3.787 20 5 FHBDRN Cc1ccc(Cl)cc1NC(=O)[C@@H](C)OC(=O)c1cccc([N+](=O)[O-])c1 ZINC000015644489 942291958 /nfs/dbraw/zinc/29/19/58/942291958.db2.gz WOXUYSNGRIQJNH-LLVKDONJSA-N 0 0 362.769 3.741 20 5 FHBDRN CCC[C@H](C)NC(=O)[C@@H]1CCCN(c2nccc3ccc([N+](=O)[O-])cc32)C1 ZINC000413108939 942293299 /nfs/dbraw/zinc/29/32/99/942293299.db2.gz SCNNXYQDVFQFAL-GOEBONIOSA-N 0 0 370.453 3.664 20 5 FHBDRN Cc1nsc(C)c1C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000513736673 942295723 /nfs/dbraw/zinc/29/57/23/942295723.db2.gz INTLZNIBCACLLU-UHFFFAOYSA-N 0 0 356.201 3.683 20 5 FHBDRN CC(C)c1ccccc1OCCC(=O)NCCNc1ccc([N+](=O)[O-])cc1 ZINC000502223587 942300371 /nfs/dbraw/zinc/30/03/71/942300371.db2.gz XXCWCIWLUJTYTN-UHFFFAOYSA-N 0 0 371.437 3.715 20 5 FHBDRN CN(C[C@@H]1OCCc2ccccc21)c1ncc([N+](=O)[O-])cc1C(F)(F)F ZINC000413102153 942302078 /nfs/dbraw/zinc/30/20/78/942302078.db2.gz DXGHHGSAJRICDX-HNNXBMFYSA-N 0 0 367.327 3.759 20 5 FHBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1Cn1nc(-c2ccccc2)ccc1=O ZINC000103719113 942303920 /nfs/dbraw/zinc/30/39/20/942303920.db2.gz AIZFBXYAHORYIW-UHFFFAOYSA-N 0 0 365.389 3.654 20 5 FHBDRN Nc1ccc([N+](=O)[O-])cc1C(=O)OCc1csc(-c2ccc(F)cc2)n1 ZINC000024534855 942304809 /nfs/dbraw/zinc/30/48/09/942304809.db2.gz TVLOTZWTWSMRQQ-UHFFFAOYSA-N 0 0 373.365 3.797 20 5 FHBDRN O=[N+]([O-])c1ccc(OCc2cc3c(cc2Br)OCCO3)cc1 ZINC000005864192 942305710 /nfs/dbraw/zinc/30/57/10/942305710.db2.gz CYNDSCIEYMHIBP-UHFFFAOYSA-N 0 0 366.167 3.708 20 5 FHBDRN CC(C)c1ccccc1NC(=O)[C@@H](C)OC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000015652899 942306412 /nfs/dbraw/zinc/30/64/12/942306412.db2.gz RAGUDMULKFUWOF-CYBMUJFWSA-N 0 0 356.378 3.902 20 5 FHBDRN CC(=O)c1ccc(NC(=O)COc2ccc([N+](=O)[O-])c(F)c2)cc1Cl ZINC000783078897 942306889 /nfs/dbraw/zinc/30/68/89/942306889.db2.gz QRKDPYHWRUBIOV-UHFFFAOYSA-N 0 0 366.732 3.607 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)Cc1ccccc1Br ZINC000103736346 942307529 /nfs/dbraw/zinc/30/75/29/942307529.db2.gz MKHBXEFXRFKIFX-UHFFFAOYSA-N 0 0 365.183 3.547 20 5 FHBDRN Cc1nnc([C@@H](C)NC(=O)Nc2ccc(C(C)(C)C)c([N+](=O)[O-])c2)s1 ZINC000501103860 942309220 /nfs/dbraw/zinc/30/92/20/942309220.db2.gz DSUFZCDNPWFIDB-SECBINFHSA-N 0 0 363.443 3.935 20 5 FHBDRN COc1cc2c(c(OC)c1)N(C(=O)c1cc([N+](=O)[O-])ccc1C)CCC2 ZINC000416058030 942310040 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942340898 /nfs/dbraw/zinc/34/08/98/942340898.db2.gz NUIFDJNGLJBICP-UHFFFAOYSA-N 0 0 374.409 3.881 20 5 FHBDRN O=C(CN1CCC[C@@H]1Cc1ccccc1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000025439717 942342632 /nfs/dbraw/zinc/34/26/32/942342632.db2.gz QGBHGDKUXBRZFZ-OAHLLOKOSA-N 0 0 373.840 3.894 20 5 FHBDRN C[C@H](Sc1ncc([N+](=O)[O-])cc1Br)C(=O)OC(C)(C)C ZINC000481109675 942343314 /nfs/dbraw/zinc/34/33/14/942343314.db2.gz MYQVHILJCJAQMN-ZETCQYMHSA-N 0 0 363.233 3.575 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N1CCc2cc(F)cc(C)c2C1 ZINC000501194755 942345162 /nfs/dbraw/zinc/34/51/62/942345162.db2.gz BDVMYQVFVKTZLP-UHFFFAOYSA-N 0 0 358.369 3.640 20 5 FHBDRN COCCOc1ccc(NC(=O)c2c(Cl)cccc2[N+](=O)[O-])cc1F ZINC000110246384 942350278 /nfs/dbraw/zinc/35/02/78/942350278.db2.gz NIGLZOWIDPLSSZ-UHFFFAOYSA-N 0 0 368.748 3.665 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N2CCSC[C@@H]2C2CCC2)c1 ZINC000416105382 942351093 /nfs/dbraw/zinc/35/10/93/942351093.db2.gz FLUZMSXRGJDKSM-OAHLLOKOSA-N 0 0 352.481 3.674 20 5 FHBDRN CCC(CC)[C@H]1C[C@@H](NC(=O)Nc2ccc([N+](=O)[O-])cc2OC)CCO1 ZINC000122877064 942353992 /nfs/dbraw/zinc/35/39/92/942353992.db2.gz GVKRFTGTWXNGAU-XJKSGUPXSA-N 0 0 365.430 3.709 20 5 FHBDRN COc1ccc2c(c1)OC(C)(C)CN(C(=O)Nc1ccc([N+](=O)[O-])cc1)C2 ZINC000421099969 942357896 /nfs/dbraw/zinc/35/78/96/942357896.db2.gz PRBRSUQFSJPETF-UHFFFAOYSA-N 0 0 371.393 3.809 20 5 FHBDRN Cc1cc(C(=O)N2CCN([C@H](C)c3cccc(F)c3)CC2)ccc1[N+](=O)[O-] ZINC000103974808 942358177 /nfs/dbraw/zinc/35/81/77/942358177.db2.gz OIWDXYSBSQEXIC-OAHLLOKOSA-N 0 0 371.412 3.561 20 5 FHBDRN Cc1nn(Cc2nnc(-c3ccc(Cl)cc3Cl)o2)cc1[N+](=O)[O-] ZINC000501232387 942362450 /nfs/dbraw/zinc/36/24/50/942362450.db2.gz JMMDJKSCFGOGDA-UHFFFAOYSA-N 0 0 354.153 3.505 20 5 FHBDRN Cc1ccc(C(=O)Nc2cc(F)ccc2OC[C@H]2CCCO2)cc1[N+](=O)[O-] ZINC000502330589 942364315 /nfs/dbraw/zinc/36/43/15/942364315.db2.gz GEOXXEOQKRXTDP-OAHLLOKOSA-N 0 0 374.368 3.852 20 5 FHBDRN Cc1ccccc1[C@@]1(F)CCN(C(=O)COc2ccc([N+](=O)[O-])c(C)c2)C1 ZINC000501259249 942367655 /nfs/dbraw/zinc/36/76/55/942367655.db2.gz QDGXRFVVYSBHBD-HXUWFJFHSA-N 0 0 372.396 3.688 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N(CC1CCC1)CC(F)(F)F ZINC000413574577 942368117 /nfs/dbraw/zinc/36/81/17/942368117.db2.gz NNUFESQHISPBTF-LSDHHAIUSA-N 0 0 356.344 3.889 20 5 FHBDRN Cc1nn(CC(=O)Nc2c(C)cccc2Cl)c2ccc([N+](=O)[O-])cc12 ZINC000501260936 942368280 /nfs/dbraw/zinc/36/82/80/942368280.db2.gz KPJMUKPMMWJHJR-UHFFFAOYSA-N 0 0 358.785 3.853 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)c1cc[nH]c(=O)c1 ZINC000502339917 942369674 /nfs/dbraw/zinc/36/96/74/942369674.db2.gz PIZFAYMTDZSYAY-LLVKDONJSA-N 0 0 361.423 3.689 20 5 FHBDRN Cc1nn(Cc2ccn(-c3c(F)cccc3F)n2)c2ccc([N+](=O)[O-])cc12 ZINC000501264538 942369991 /nfs/dbraw/zinc/36/99/91/942369991.db2.gz XEWAJGMOWVXULI-UHFFFAOYSA-N 0 0 369.331 3.765 20 5 FHBDRN Cc1nn(Cc2nn(-c3ccccc3)c3c2CCC3)c2ccc([N+](=O)[O-])cc12 ZINC000501264557 942370266 /nfs/dbraw/zinc/37/02/66/942370266.db2.gz RSJNLGJUDJAYBY-UHFFFAOYSA-N 0 0 373.416 3.976 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ZINC000501306394 942403261 /nfs/dbraw/zinc/40/32/61/942403261.db2.gz UNCBARJAEPPXNH-UHFFFAOYSA-N 0 0 373.166 3.553 20 5 FHBDRN CC(=O)Nc1cccc(CC(=O)Nc2cc([N+](=O)[O-])ccc2NC(C)C)c1 ZINC000424867297 942413991 /nfs/dbraw/zinc/41/39/91/942413991.db2.gz GUAZMXMDEXGRQL-UHFFFAOYSA-N 0 0 370.409 3.555 20 5 FHBDRN Cc1cc(NC(=O)c2cc(C)c(F)c(C)c2)c2cc([N+](=O)[O-])ccc2n1 ZINC001268853858 942414393 /nfs/dbraw/zinc/41/43/93/942414393.db2.gz MBJOKWCVMRXIEB-UHFFFAOYSA-N 0 0 353.353 3.882 20 5 FHBDRN Cc1cc(NC(=O)CCO[C@@H](C)CC(C)C)c2cc([N+](=O)[O-])ccc2n1 ZINC001268853951 942414909 /nfs/dbraw/zinc/41/49/09/942414909.db2.gz OYOKMCPQBJXJHZ-AWEZNQCLSA-N 0 0 359.426 3.653 20 5 FHBDRN Cc1ccc(O[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])c3ncccc23)cc1 ZINC001268850511 942418657 /nfs/dbraw/zinc/41/86/57/942418657.db2.gz ZWLDEXXTNRBDLI-ZDUSSCGKSA-N 0 0 351.362 3.857 20 5 FHBDRN COc1ccc(OC(=O)Cc2coc3cc4c(cc23)CCC4)c([N+](=O)[O-])c1 ZINC000014785460 942418621 /nfs/dbraw/zinc/41/86/21/942418621.db2.gz 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CCS[C@@H]1CC[C@@H](N(C)C(=O)Nc2ccc([N+](=O)[O-])cc2OC)C1 ZINC000122896426 942456229 /nfs/dbraw/zinc/45/62/29/942456229.db2.gz HKRCXRDVYPCKQU-DGCLKSJQSA-N 0 0 353.444 3.741 20 5 FHBDRN Cn1c(-c2cccc([N+](=O)[O-])c2)nnc1N1CCC[C@H](CC(F)(F)F)C1 ZINC000421263395 942457466 /nfs/dbraw/zinc/45/74/66/942457466.db2.gz PAUUBCPDLMADPA-LLVKDONJSA-N 0 0 369.347 3.559 20 5 FHBDRN O=C(C1CCCCC1)N1CC[C@H](Nc2ccc([N+](=O)[O-])c3ncccc23)C1 ZINC000413194183 942458860 /nfs/dbraw/zinc/45/88/60/942458860.db2.gz PKXBBHPEJIZRSZ-HNNXBMFYSA-N 0 0 368.437 3.736 20 5 FHBDRN CN(CCN(C)c1ccccc1)C(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000502456463 942459030 /nfs/dbraw/zinc/45/90/30/942459030.db2.gz TYKHGKMTMWODNT-UHFFFAOYSA-N 0 0 353.378 3.549 20 5 FHBDRN C[C@@H](NC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1)C(F)(F)F ZINC000424947929 942459557 /nfs/dbraw/zinc/45/95/57/942459557.db2.gz HVMZQEPQWVIDBH-LLVKDONJSA-N 0 0 359.348 3.512 20 5 FHBDRN CC[C@]1(c2ccccc2)NC(=O)N([C@@H](C)c2ccc([N+](=O)[O-])cc2)C1=O ZINC000419970236 942471766 /nfs/dbraw/zinc/47/17/66/942471766.db2.gz UEMQKARNVUWLKS-ORAYPTAESA-N 0 0 353.378 3.513 20 5 FHBDRN O=C(NCc1ccc(Cl)s1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513714305 942474113 /nfs/dbraw/zinc/47/41/13/942474113.db2.gz BBZZDCOZVOEUQH-UHFFFAOYSA-N 0 0 362.741 3.841 20 5 FHBDRN CC(C)n1cc2c(n1)C[C@@H](Nc1ccc([N+](=O)[O-])c3ncccc13)CC2 ZINC000413213695 942488075 /nfs/dbraw/zinc/48/80/75/942488075.db2.gz YMQZDYJWIODOEB-AWEZNQCLSA-N 0 0 351.410 3.890 20 5 FHBDRN O=C(COc1ccccc1[N+](=O)[O-])N1CCC[C@H]1/C=C\c1ccccc1 ZINC000505372279 942491267 /nfs/dbraw/zinc/49/12/67/942491267.db2.gz IMOHPOBOQLZCOE-QOHRORDFSA-N 0 0 352.390 3.678 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)NCc1cnccc1C(C)(C)C ZINC000413666438 942493135 /nfs/dbraw/zinc/49/31/35/942493135.db2.gz IGBVNCPOCUAJCY-UHFFFAOYSA-N 0 0 370.453 3.671 20 5 FHBDRN O=C(NCc1cccc(OC(F)F)c1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000110260667 942499080 /nfs/dbraw/zinc/49/90/80/942499080.db2.gz UAQUTAYHEAVTAB-UHFFFAOYSA-N 0 0 356.712 3.780 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCO[C@H](c3cccc(F)c3)C2)c2ncccc12 ZINC000066814869 942500394 /nfs/dbraw/zinc/50/03/94/942500394.db2.gz FHRFTZFGMREABA-SFHVURJKSA-N 0 0 353.353 3.860 20 5 FHBDRN C[C@@H](C(=O)Nc1ccc2c(c1)CCCC2=O)c1ccc([N+](=O)[O-])cc1F ZINC000452311272 942505288 /nfs/dbraw/zinc/50/52/88/942505288.db2.gz IQTMMFPAZJWASR-LLVKDONJSA-N 0 0 356.353 3.995 20 5 FHBDRN Cc1cc(N2CCCC2)ccc1N[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000052774372 942506279 /nfs/dbraw/zinc/50/62/79/942506279.db2.gz BJBQPHPTYKMKNC-OAHLLOKOSA-N 0 0 368.437 3.943 20 5 FHBDRN O=C(Nc1cc(F)c(F)cc1F)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000104477993 942512671 /nfs/dbraw/zinc/51/26/71/942512671.db2.gz PEOVCZFCYMRTBD-UHFFFAOYSA-N 0 0 351.284 3.839 20 5 FHBDRN COc1ccc(NC(=O)[C@@H]2CC(C)(C)Oc3ccccc32)c([N+](=O)[O-])c1 ZINC000413707726 942512797 /nfs/dbraw/zinc/51/27/97/942512797.db2.gz ZJROIVLCZZQGET-CQSZACIVSA-N 0 0 356.378 3.887 20 5 FHBDRN C[C@H](CC(=O)c1ccc(F)cc1)NC(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000501505233 942514540 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3.644 20 5 FHBDRN C[C@@H]1C[C@H](c2cccnc2)N(c2ncc([N+](=O)[O-])cc2C(F)(F)F)C1 ZINC000413236151 942539040 /nfs/dbraw/zinc/53/90/40/942539040.db2.gz QHQNRMVTTHLKRW-QMTHXVAHSA-N 0 0 352.316 3.991 20 5 FHBDRN CC(C)(Cc1nc2ccccc2[nH]1)C(=O)N1CCc2c1cccc2[N+](=O)[O-] ZINC000541255753 942539875 /nfs/dbraw/zinc/53/98/75/942539875.db2.gz TZTSPIXCLVCKIW-UHFFFAOYSA-N 0 0 364.405 3.629 20 5 FHBDRN CCNc1ccc(C(=O)NCc2ccc(OC(C)C)cc2)cc1[N+](=O)[O-] ZINC000501544976 942540633 /nfs/dbraw/zinc/54/06/33/942540633.db2.gz TXSVAEMCVOXMHH-UHFFFAOYSA-N 0 0 357.410 3.744 20 5 FHBDRN C[C@@H]1[C@@H](c2ccccc2)CCN1C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000434240280 942541933 /nfs/dbraw/zinc/54/19/33/942541933.db2.gz RGXRBKACACGDRZ-BEFAXECRSA-N 0 0 363.417 3.954 20 5 FHBDRN O=C(COc1ccccc1[N+](=O)[O-])N1CC=C(c2ccc(Cl)cc2)CC1 ZINC000434245489 942544757 /nfs/dbraw/zinc/54/47/57/942544757.db2.gz XFXGGGOVQXJZRW-UHFFFAOYSA-N 0 0 372.808 3.943 20 5 FHBDRN CS[C@@H](CNC(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])C(C)(C)C ZINC000541271480 942547752 /nfs/dbraw/zinc/54/77/52/942547752.db2.gz FYSHTUMVJYMUME-HZMBPMFUSA-N 0 0 374.890 3.909 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1)c1nccnc1Sc1ccccc1 ZINC000541268200 942549099 /nfs/dbraw/zinc/54/90/99/942549099.db2.gz ZIZFZJHNRJPQOT-UHFFFAOYSA-N 0 0 352.375 3.788 20 5 FHBDRN CSC1(CNC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)CCC1 ZINC000434151471 942552237 /nfs/dbraw/zinc/55/22/37/942552237.db2.gz FKIQZMVIJHTDLE-UHFFFAOYSA-N 0 0 351.472 3.502 20 5 FHBDRN O=C(COc1ccc(F)c(Cl)c1)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000513841040 942553025 /nfs/dbraw/zinc/55/30/25/942553025.db2.gz LKHGRLYJIWZHIT-UHFFFAOYSA-N 0 0 364.760 3.746 20 5 FHBDRN C[C@H](CNC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1)CC(F)(F)F ZINC000413754524 942559500 /nfs/dbraw/zinc/55/95/00/942559500.db2.gz ZSODBKYGMCJGNC-NSHDSACASA-N 0 0 359.348 3.857 20 5 FHBDRN COCCN(Cc1scnc1C)c1ccc([N+](=O)[O-])c2ncccc12 ZINC000413260707 942561699 /nfs/dbraw/zinc/56/16/99/942561699.db2.gz FRGUTALAEYUHTE-UHFFFAOYSA-N 0 0 358.423 3.561 20 5 FHBDRN O=C(NCc1ccccc1OC(F)F)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000014127221 942561890 /nfs/dbraw/zinc/56/18/90/942561890.db2.gz PKBKBWDJILXGAR-UHFFFAOYSA-N 0 0 356.712 3.780 20 5 FHBDRN CC(C)(C)c1csc(CCNc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)n1 ZINC000104659191 942561913 /nfs/dbraw/zinc/56/19/13/942561913.db2.gz IHXPGAJTMFHKLA-UHFFFAOYSA-N 0 0 374.466 3.888 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1C[C@@H](c2ccccc2)OC[C@H]1C ZINC000421452690 942565113 /nfs/dbraw/zinc/56/51/13/942565113.db2.gz BKHUNONXRRHYCY-BEFAXECRSA-N 0 0 354.406 3.814 20 5 FHBDRN COc1ccc(-c2nc3cc([N+](=O)[O-])ccc3n2C)cc1Br ZINC000513855666 942565418 /nfs/dbraw/zinc/56/54/18/942565418.db2.gz IYUISGIOLKGCCF-UHFFFAOYSA-N 0 0 362.183 3.920 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)N2CCOc3c(F)cccc3C2)cc1[N+](=O)[O-] ZINC000434277165 942567787 /nfs/dbraw/zinc/56/77/87/942567787.db2.gz AIOSSZDGUJDSKJ-ZDUSSCGKSA-N 0 0 373.384 3.708 20 5 FHBDRN CC(=O)Nc1cccc2c1CCCN2C(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC000421441415 942574985 /nfs/dbraw/zinc/57/49/85/942574985.db2.gz BTUBUDDESBBTIJ-UHFFFAOYSA-N 0 0 367.405 3.763 20 5 FHBDRN Cc1nc(-c2ccccc2)sc1[C@@H](C)NC(=O)c1ccc([N+](=O)[O-])n1C ZINC000501633665 942582046 /nfs/dbraw/zinc/58/20/46/942582046.db2.gz XCSVGZYATIBDAW-LLVKDONJSA-N 0 0 370.434 3.856 20 5 FHBDRN C[C@@H](c1cccc([N+](=O)[O-])c1)N(C)CC(=O)N(C)[C@@H](C)c1ccccc1 ZINC000016419970 942582506 /nfs/dbraw/zinc/58/25/06/942582506.db2.gz XSJQVSWTDPBFGV-HOTGVXAUSA-N 0 0 355.438 3.807 20 5 FHBDRN COC(=O)c1cc(C(=O)O[C@@H](C)c2ccc(Cl)cc2)cc([N+](=O)[O-])c1 ZINC000015963898 942584971 /nfs/dbraw/zinc/58/49/71/942584971.db2.gz ZOZAJGMXSKHZOU-JTQLQIEISA-N 0 0 363.753 3.953 20 5 FHBDRN COC(=O)CCc1ccc(NC(=O)c2cc([N+](=O)[O-])c(C)cc2C)cc1 ZINC000421475216 942592763 /nfs/dbraw/zinc/59/27/63/942592763.db2.gz UDECICYADQILDV-UHFFFAOYSA-N 0 0 356.378 3.570 20 5 FHBDRN C[C@@H]1CCCN(c2ccc(C(=O)N3CC[C@@H](C)[C@@H](C)C3)cc2[N+](=O)[O-])C1 ZINC000501647069 942594348 /nfs/dbraw/zinc/59/43/48/942594348.db2.gz NRJAXVJEMPEAOI-OAGGEKHMSA-N 0 0 359.470 3.949 20 5 FHBDRN Cc1cccc(NC(=O)CN(C)C(=O)c2cc([N+](=O)[O-])c(C)cc2C)c1C ZINC000421454952 942595335 /nfs/dbraw/zinc/59/53/35/942595335.db2.gz PUKRBNCMEQGBGP-UHFFFAOYSA-N 0 0 369.421 3.539 20 5 FHBDRN O=[N+]([O-])c1cnc(NC2CCN(c3nccs3)CC2)c(C(F)(F)F)c1 ZINC000413274302 942595793 /nfs/dbraw/zinc/59/57/93/942595793.db2.gz UBESJBKNOWBALN-UHFFFAOYSA-N 0 0 373.360 3.546 20 5 FHBDRN CCC[C@H](NC(=O)c1cc([N+](=O)[O-])c(C)cc1C)c1nnc2ccccn21 ZINC000421458854 942597020 /nfs/dbraw/zinc/59/70/20/942597020.db2.gz CSYFEBXVUNHGOG-HNNXBMFYSA-N 0 0 367.409 3.526 20 5 FHBDRN CC(C)N(C(=O)Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1)c1ccccc1 ZINC000501676857 942606813 /nfs/dbraw/zinc/60/68/13/942606813.db2.gz UFHZOKBLIVPNOR-UHFFFAOYSA-N 0 0 364.405 3.900 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)OCc2cc(Cl)cc3c2OCC3)c1 ZINC001268972636 942608327 /nfs/dbraw/zinc/60/83/27/942608327.db2.gz YLZCLXDRIXHQJJ-UHFFFAOYSA-N 0 0 363.753 3.549 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)Nc1cccc(OCC(F)F)n1 ZINC000421496314 942609589 /nfs/dbraw/zinc/60/95/89/942609589.db2.gz MADOQWCXXCZYMY-UHFFFAOYSA-N 0 0 351.309 3.503 20 5 FHBDRN C[C@@]1(CNC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)C[C@H]1c1ccccc1 ZINC000501688568 942612039 /nfs/dbraw/zinc/61/20/39/942612039.db2.gz LXTFYCKFGSSIQI-RXVVDRJESA-N 0 0 363.417 3.860 20 5 FHBDRN CCOC(=O)c1ccccc1N(C)C(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC000421479132 942613006 /nfs/dbraw/zinc/61/30/06/942613006.db2.gz XZXRVYZEVIFPBJ-UHFFFAOYSA-N 0 0 356.378 3.665 20 5 FHBDRN COc1ccc([C@@H](OC)[C@H](C)NC(=O)c2cc([N+](=O)[O-])c(C)cc2C)cc1 ZINC000421514929 942620079 /nfs/dbraw/zinc/62/00/79/942620079.db2.gz RJQFJUXLQLBGJX-LIRRHRJNSA-N 0 0 372.421 3.726 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CC[C@@H](COc2ccccc2)C1 ZINC000421518506 942623557 /nfs/dbraw/zinc/62/35/57/942623557.db2.gz VPDSSJAIKWIAEU-MRXNPFEDSA-N 0 0 354.406 3.753 20 5 FHBDRN O=C(NCCc1cccc(Cl)c1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513719740 942630531 /nfs/dbraw/zinc/63/05/31/942630531.db2.gz DNODBRUWJKZNCC-UHFFFAOYSA-N 0 0 370.739 3.822 20 5 FHBDRN CO[C@@H](c1ccc(F)cc1)[C@H](C)NC(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC000421505369 942631153 /nfs/dbraw/zinc/63/11/53/942631153.db2.gz IPJRCHADXWKPQA-SCLBCKFNSA-N 0 0 360.385 3.857 20 5 FHBDRN CCc1cccc2c1OCC[C@H]2NC(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000513955222 942633297 /nfs/dbraw/zinc/63/32/97/942633297.db2.gz XEXBBJPIESRXHV-OAHLLOKOSA-N 0 0 371.393 3.811 20 5 FHBDRN O=C(OCCCc1ccncc1)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000016003774 942633473 /nfs/dbraw/zinc/63/34/73/942633473.db2.gz XNVIYRSQUORGKA-UHFFFAOYSA-N 0 0 369.421 3.770 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])Nc1ccc2cccc(Cl)c2n1 ZINC000505417346 942640723 /nfs/dbraw/zinc/64/07/23/942640723.db2.gz XTTGGRTWJGWAEG-UHFFFAOYSA-N 0 0 371.780 3.626 20 5 FHBDRN COCCC[C@H](Cc1ccccc1)NC(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC000421533986 942642871 /nfs/dbraw/zinc/64/28/71/942642871.db2.gz KSXSNGHXIIEFQL-GOSISDBHSA-N 0 0 370.449 3.979 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)C[C@H]1OCCc2ccsc21 ZINC000366988908 942651630 /nfs/dbraw/zinc/65/16/30/942651630.db2.gz JGIKWKGEGGCSQI-OAHLLOKOSA-N 0 0 362.407 3.698 20 5 FHBDRN O=[N+]([O-])c1ccc(N[C@@H]2CCO[C@@H](c3ccccn3)C2)c2cccnc21 ZINC000413313055 942655081 /nfs/dbraw/zinc/65/50/81/942655081.db2.gz HHNVXPCKEMUXMS-FZKQIMNGSA-N 0 0 350.378 3.870 20 5 FHBDRN O=[N+]([O-])c1cnccc1Oc1ccc(S(=O)(=O)c2ccccc2)cc1 ZINC000066809471 942656187 /nfs/dbraw/zinc/65/61/87/942656187.db2.gz GBNLXPGWGLXOSS-UHFFFAOYSA-N 0 0 356.359 3.615 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCO[C@H](c3ccc(F)c(F)c3)C2)c2ncccc12 ZINC000066815347 942656193 /nfs/dbraw/zinc/65/61/93/942656193.db2.gz OTHNODJZVAUKMT-SFHVURJKSA-N 0 0 371.343 3.999 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CC[C@@H](c3cccc(Br)c3)C2)c(F)c1 ZINC000413318609 942657716 /nfs/dbraw/zinc/65/77/16/942657716.db2.gz NRIHIWGIVDZUHZ-LLVKDONJSA-N 0 0 366.190 3.885 20 5 FHBDRN O=C(Nc1cccc(CNc2ccncc2[N+](=O)[O-])c1)c1cccc(F)c1 ZINC000066809994 942658437 /nfs/dbraw/zinc/65/84/37/942658437.db2.gz CQJHYKYKMCMNKN-UHFFFAOYSA-N 0 0 366.352 3.993 20 5 FHBDRN CN(Cc1cccc(F)c1)C(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000584563338 942659200 /nfs/dbraw/zinc/65/92/00/942659200.db2.gz WRJJCPNDTQNYBL-UHFFFAOYSA-N 0 0 370.384 3.599 20 5 FHBDRN CCN(C)C(=O)c1cccc(NC(=O)c2cc([N+](=O)[O-])c(C)cc2C)c1 ZINC000421557930 942659522 /nfs/dbraw/zinc/65/95/22/942659522.db2.gz OFXKHTRNWRDYIE-UHFFFAOYSA-N 0 0 355.394 3.556 20 5 FHBDRN O=C(NCCOc1ccc([N+](=O)[O-])cc1)[C@H]1CCC[C@H]1Cc1ccccc1 ZINC001125876612 942663778 /nfs/dbraw/zinc/66/37/78/942663778.db2.gz OILKIAJBJCGFQH-PXNSSMCTSA-N 0 0 368.433 3.749 20 5 FHBDRN COC(=O)c1ccc(C(F)(F)F)cc1NC(=O)c1ccccc1[N+](=O)[O-] ZINC000501760972 942663811 /nfs/dbraw/zinc/66/38/11/942663811.db2.gz YCOFMIYZJJXYGW-UHFFFAOYSA-N 0 0 368.267 3.653 20 5 FHBDRN O=C(NCCOc1ccc([N+](=O)[O-])cc1)[C@H]1CCC[C@@H]1Cc1ccccc1 ZINC001125876613 942663961 /nfs/dbraw/zinc/66/39/61/942663961.db2.gz OILKIAJBJCGFQH-XLIONFOSSA-N 0 0 368.433 3.749 20 5 FHBDRN CC(C)(NCc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NCC1CCCCC1 ZINC000502718954 942681263 /nfs/dbraw/zinc/68/12/63/942681263.db2.gz UPLOSYHMHPKJBA-UHFFFAOYSA-N 0 0 367.877 3.813 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)NCCC[C@@H]2CCCC[C@H]2O)cc1[N+](=O)[O-] ZINC000434469974 942690868 /nfs/dbraw/zinc/69/08/68/942690868.db2.gz LTLKNLVFZUVBBX-KBXCAEBGSA-N 0 0 362.470 3.953 20 5 FHBDRN C[C@@H](CCc1ccco1)NC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000047864812 942696964 /nfs/dbraw/zinc/69/69/64/942696964.db2.gz WOMRYBUDTULLGU-JTQLQIEISA-N 0 0 369.324 3.932 20 5 FHBDRN O=C(/C=C/c1cccc([N+](=O)[O-])c1)N[C@@H](c1ccccc1)[C@H]1CCOC1 ZINC000378386789 942697174 /nfs/dbraw/zinc/69/71/74/942697174.db2.gz BQCMEYPRTDTVDA-KQLHMXSUSA-N 0 0 352.390 3.502 20 5 FHBDRN CCc1ccc([C@H]2CCN(C(=O)NCCc3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000431865173 942697292 /nfs/dbraw/zinc/69/72/92/942697292.db2.gz NUEZWUXAQIGNCJ-IBGZPJMESA-N 0 0 367.449 3.899 20 5 FHBDRN O=C(N[C@@H](c1ccccc1)[C@H]1CCOC1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000378387805 942699243 /nfs/dbraw/zinc/69/92/43/942699243.db2.gz LIXCBDCRTZRYAY-GUYCJALGSA-N 0 0 360.797 3.756 20 5 FHBDRN O=C(Nc1cccc2c1CCCC2)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000514048031 942704441 /nfs/dbraw/zinc/70/44/41/942704441.db2.gz SBUACXDTXZXDQL-UHFFFAOYSA-N 0 0 362.389 3.912 20 5 FHBDRN COc1ccc(C(=O)N2CCC[C@@]2(C)Cc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000421621873 942706045 /nfs/dbraw/zinc/70/60/45/942706045.db2.gz YAQZQJUGWIYIOG-FQEVSTJZSA-N 0 0 372.396 3.980 20 5 FHBDRN CC1(NC(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCCC1 ZINC000502761597 942708356 /nfs/dbraw/zinc/70/83/56/942708356.db2.gz AFEOHIJIGYZKRO-UHFFFAOYSA-N 0 0 359.348 3.865 20 5 FHBDRN COC(=O)c1cc(C(=O)N[C@@H]2CCC[C@H](C(C)C)CC2)cc([N+](=O)[O-])c1 ZINC001269795205 942712661 /nfs/dbraw/zinc/71/26/61/942712661.db2.gz MIDDQOLPPAHLAR-XJKSGUPXSA-N 0 0 362.426 3.716 20 5 FHBDRN Cc1cc(NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])cn2ccnc12 ZINC000502749980 942716454 /nfs/dbraw/zinc/71/64/54/942716454.db2.gz VNIRKXYEYCTVHR-UHFFFAOYSA-N 0 0 364.283 3.822 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)N2CC[C@H](C3CCCC3)C2)cc1SC ZINC000421646692 942719659 /nfs/dbraw/zinc/71/96/59/942719659.db2.gz PXXYMLSHIAPLMD-ZDUSSCGKSA-N 0 0 364.467 3.978 20 5 FHBDRN O=C(C1CCN(c2ccccc2[N+](=O)[O-])CC1)N1CC[C@H](C2CCCC2)C1 ZINC000421654229 942722556 /nfs/dbraw/zinc/72/25/56/942722556.db2.gz KKSSGBYCBDFRNT-SFHVURJKSA-N 0 0 371.481 3.850 20 5 FHBDRN CCOc1cc(C(=O)N2CC[C@@H](C3CCCC3)C2)c([N+](=O)[O-])cc1OC ZINC000421655767 942722825 /nfs/dbraw/zinc/72/28/25/942722825.db2.gz OKDMPGNPOBCJHD-CQSZACIVSA-N 0 0 362.426 3.654 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCO[C@H](CC)C1 ZINC000421672485 942737417 /nfs/dbraw/zinc/73/74/17/942737417.db2.gz UOCZZEASJYSPPX-TZMCWYRMSA-N 0 0 352.456 3.784 20 5 FHBDRN CN(C)c1ccccc1NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514108951 942750759 /nfs/dbraw/zinc/75/07/59/942750759.db2.gz HWNYNBRTMYTKCM-UHFFFAOYSA-N 0 0 351.309 3.515 20 5 FHBDRN O=C(Nc1nc(C2CC2)cs1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514128067 942760895 /nfs/dbraw/zinc/76/08/95/942760895.db2.gz CVVJXDXPHQJCDE-UHFFFAOYSA-N 0 0 355.322 3.782 20 5 FHBDRN CC(C)CC[C@@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)c1ccc(Cl)cc1 ZINC000502812192 942764145 /nfs/dbraw/zinc/76/41/45/942764145.db2.gz SBDNMSNUTGAKCU-MRXNPFEDSA-N 0 0 364.833 3.738 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])Nc1ccc2c(c1)C(=O)CCCC2 ZINC000421712990 942765045 /nfs/dbraw/zinc/76/50/45/942765045.db2.gz FZQXTGDLXQQGKV-UHFFFAOYSA-N 0 0 368.389 3.912 20 5 FHBDRN CN(CCCCO)C(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000472985491 942767416 /nfs/dbraw/zinc/76/74/16/942767416.db2.gz ALYBQKDXFAQONM-UHFFFAOYSA-N 0 0 360.435 3.591 20 5 FHBDRN Cn1cnc([N+](=O)[O-])c1N[C@@H](Cc1ccc(Cl)cc1)c1ccccn1 ZINC000502802324 942771692 /nfs/dbraw/zinc/77/16/92/942771692.db2.gz KFLLZNWNJVFNHD-HNNXBMFYSA-N 0 0 357.801 3.773 20 5 FHBDRN O=C(CCC(=O)c1cccc(F)c1)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000502820241 942775734 /nfs/dbraw/zinc/77/57/34/942775734.db2.gz VIUWLWVEDZSBKM-UHFFFAOYSA-N 0 0 372.396 3.836 20 5 FHBDRN CC1(C)[C@@H](c2ccccc2)CCN1C(=O)COc1ccccc1[N+](=O)[O-] ZINC000421722733 942777512 /nfs/dbraw/zinc/77/75/12/942777512.db2.gz PXMBKYAUNQSWHB-MRXNPFEDSA-N 0 0 354.406 3.768 20 5 FHBDRN O=C(Nc1nc2c(s1)CCCC2)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514143743 942779842 /nfs/dbraw/zinc/77/98/42/942779842.db2.gz JUVAWZMMCYLVOI-UHFFFAOYSA-N 0 0 369.349 3.784 20 5 FHBDRN CC(C)(CCC(=O)Nc1cc(F)c(N2CCCCC2)c(F)c1)[N+](=O)[O-] ZINC000828025759 942784351 /nfs/dbraw/zinc/78/43/51/942784351.db2.gz ORVINNULRCKSGW-UHFFFAOYSA-N 0 0 355.385 3.729 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N=c1cc(C)n(C(C)C)[nH]1 ZINC000421731254 942784465 /nfs/dbraw/zinc/78/44/65/942784465.db2.gz FNZMQQRLCXBQHH-UHFFFAOYSA-N 0 0 362.455 3.857 20 5 FHBDRN CC[C@H]1C[C@H](CC(=O)Nc2cc(C)nn2-c2ccc([N+](=O)[O-])cc2)CCO1 ZINC000514156750 942789819 /nfs/dbraw/zinc/78/98/19/942789819.db2.gz WTSDBUBLMTVLRH-PBHICJAKSA-N 0 0 372.425 3.623 20 5 FHBDRN CCC[C@H](NC(=O)Cn1nc(C)c2cc([N+](=O)[O-])ccc21)c1ccccc1 ZINC000502845870 942793674 /nfs/dbraw/zinc/79/36/74/942793674.db2.gz OZQRVOFBNFPGOE-SFHVURJKSA-N 0 0 366.421 3.911 20 5 FHBDRN CC[C@H](CNC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)CC(F)(F)F ZINC000413924779 942799001 /nfs/dbraw/zinc/79/90/01/942799001.db2.gz ZGXBQYKOURABBE-NSHDSACASA-N 0 0 359.348 3.641 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)N2C[C@@H](O)C[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000413930050 942800173 /nfs/dbraw/zinc/80/01/73/942800173.db2.gz BMBJAVGNNYVKOH-FUHWJXTLSA-N 0 0 368.433 3.840 20 5 FHBDRN CCC1CCC(NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)(C(=O)OC)CC1 ZINC000434161254 942804749 /nfs/dbraw/zinc/80/47/49/942804749.db2.gz VBMZPNAAJZWAJY-UHFFFAOYSA-N 0 0 374.393 3.583 20 5 FHBDRN CC(C)c1ccc(C(=O)N2C[C@H](O)C[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000413936199 942805456 /nfs/dbraw/zinc/80/54/56/942805456.db2.gz HKEWJYJCCSPNJP-SJLPKXTDSA-N 0 0 354.406 3.666 20 5 FHBDRN COC(=O)CCCOc1ccc(CNc2ccc([N+](=O)[O-])c(C)c2)cc1 ZINC000514181746 942806312 /nfs/dbraw/zinc/80/63/12/942806312.db2.gz FNMMXTBUVRUHCS-UHFFFAOYSA-N 0 0 358.394 3.847 20 5 FHBDRN Cc1oc(C)c(C(=O)OCC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])c1C ZINC000016541957 942809293 /nfs/dbraw/zinc/80/92/93/942809293.db2.gz ODQYYWPBJTZAJN-UHFFFAOYSA-N 0 0 366.757 3.562 20 5 FHBDRN Cn1c2ccccc2cc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1=O ZINC000584568150 942809820 /nfs/dbraw/zinc/80/98/20/942809820.db2.gz AATKYERCCBYMCW-UHFFFAOYSA-N 0 0 363.417 3.611 20 5 FHBDRN COc1ccc(OC(=O)c2cc(=O)[nH]c3c(F)cc(C)cc23)cc1[N+](=O)[O-] ZINC001269176853 942811770 /nfs/dbraw/zinc/81/17/70/942811770.db2.gz XIDDQHBFYMKQFX-UHFFFAOYSA-N 0 0 372.308 3.524 20 5 FHBDRN Nc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC000413941447 942812629 /nfs/dbraw/zinc/81/26/29/942812629.db2.gz APJHPXLCQFYMTB-OCCSQVGLSA-N 0 0 359.813 3.897 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCOCC2)[C@H]1c1ccccc1 ZINC000413950047 942813803 /nfs/dbraw/zinc/81/38/03/942813803.db2.gz DPOFOTWDFKBHIA-LJQANCHMSA-N 0 0 366.417 3.897 20 5 FHBDRN COCC1CCC(NC(=O)c2ccnc(-c3ccccc3)c2[N+](=O)[O-])CC1 ZINC000413955322 942818939 /nfs/dbraw/zinc/81/89/39/942818939.db2.gz MDNIBUQRIIKCBR-UHFFFAOYSA-N 0 0 369.421 3.592 20 5 FHBDRN Cc1ccccc1[C@@]1(F)CCN(Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000502893364 942822138 /nfs/dbraw/zinc/82/21/38/942822138.db2.gz PSFVXADRKPFARQ-HXUWFJFHSA-N 0 0 372.396 3.840 20 5 FHBDRN O=C(N[C@H]1C[C@@H]1Cc1ccccc1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514217704 942825541 /nfs/dbraw/zinc/82/55/41/942825541.db2.gz GSKTUGNFIUMNRN-KBPBESRZSA-N 0 0 362.332 3.557 20 5 FHBDRN O=C(N[C@@H]1C[C@H]1Cc1ccccc1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514217707 942825654 /nfs/dbraw/zinc/82/56/54/942825654.db2.gz GSKTUGNFIUMNRN-ZIAGYGMSSA-N 0 0 362.332 3.557 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)Nc1ccc(-c2nc3ccccc3[nH]2)cn1 ZINC001125883028 942839065 /nfs/dbraw/zinc/83/90/65/942839065.db2.gz FWASBRIUMDDCRJ-UHFFFAOYSA-N 0 0 373.372 3.714 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CC[C@@H](C(F)(F)F)C(C)(C)C1 ZINC000190175773 942854017 /nfs/dbraw/zinc/85/40/17/942854017.db2.gz LNMLRBJIGREIJD-CQSZACIVSA-N 0 0 373.375 3.752 20 5 FHBDRN CCOC(=O)c1csc(CCNc2ccc([N+](=O)[O-])cc2Cl)n1 ZINC000190208147 942858799 /nfs/dbraw/zinc/85/87/99/942858799.db2.gz VMAQAYHCFQIRQH-UHFFFAOYSA-N 0 0 355.803 3.536 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)NCCc1c[nH]c2cc(C)ccc12 ZINC000502942861 942860556 /nfs/dbraw/zinc/86/05/56/942860556.db2.gz WYJMLFXJMHBFAP-UHFFFAOYSA-N 0 0 368.393 3.757 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CCSc1ncccc1Cl ZINC000041905662 942862755 /nfs/dbraw/zinc/86/27/55/942862755.db2.gz IEYBVDHBIIAFSI-UHFFFAOYSA-N 0 0 367.814 3.773 20 5 FHBDRN CN(C1(C)CCCC1)S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000416474221 942864294 /nfs/dbraw/zinc/86/42/94/942864294.db2.gz GNMMISLDNJCCCJ-UHFFFAOYSA-N 0 0 366.361 3.567 20 5 FHBDRN Cc1cc(NC(=O)c2cc([N+](=O)[O-])c(C)cc2Cl)n(-c2ccccn2)n1 ZINC001125884750 942870513 /nfs/dbraw/zinc/87/05/13/942870513.db2.gz XTZIYGDKSWGNNA-UHFFFAOYSA-N 0 0 371.784 3.698 20 5 FHBDRN CC[C@H](CNC(=O)Cc1ccc([N+](=O)[O-])cc1Cl)CC(F)(F)F ZINC000413995836 942874860 /nfs/dbraw/zinc/87/48/60/942874860.db2.gz APUKIDFYRUBUAJ-VIFPVBQESA-N 0 0 352.740 3.886 20 5 FHBDRN CC(C)(C)[C@@H]1CCC[C@H]1NC(=O)c1cc([N+](=O)[O-])ccc1SCCO ZINC000413997615 942876156 /nfs/dbraw/zinc/87/61/56/942876156.db2.gz WFEFLVBOVGQESN-HUUCEWRRSA-N 0 0 366.483 3.624 20 5 FHBDRN COc1ccc(NC(=O)CN(C)Cc2ccc(C(C)C)cc2)c([N+](=O)[O-])c1 ZINC000016588139 942880263 /nfs/dbraw/zinc/88/02/63/942880263.db2.gz PFSCFSASJJBLAO-UHFFFAOYSA-N 0 0 371.437 3.797 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1nccn1-c1ccccc1 ZINC000430087656 942882774 /nfs/dbraw/zinc/88/27/74/942882774.db2.gz DTUAZFKXXBWXKW-CYBMUJFWSA-N 0 0 368.418 3.900 20 5 FHBDRN Cc1nc(NC(=O)c2ncoc2-c2ccccc2Cl)ccc1[N+](=O)[O-] ZINC000133619296 942886323 /nfs/dbraw/zinc/88/63/23/942886323.db2.gz UBICONMVOYSSFJ-UHFFFAOYSA-N 0 0 358.741 3.859 20 5 FHBDRN CCO[C@H]1C[C@@H](N(C)C(=O)c2ccc([N+](=O)[O-])c(OC)c2)C1(CC)CC ZINC000434184156 942898518 /nfs/dbraw/zinc/89/85/18/942898518.db2.gz REJSHVYERHAEGL-SJORKVTESA-N 0 0 364.442 3.659 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])c2cccnc12)N1CCC[C@H](CC(F)(F)F)C1 ZINC000421956384 942906425 /nfs/dbraw/zinc/90/64/25/942906425.db2.gz HYHCBTUTQAVCFH-LLVKDONJSA-N 0 0 367.327 3.948 20 5 FHBDRN CCOc1ccc(CCNC(=O)c2ccc([N+](=O)[O-])cc2C)cc1OCC ZINC000511564013 942909238 /nfs/dbraw/zinc/90/92/38/942909238.db2.gz YQFVHAIAIWGPDJ-UHFFFAOYSA-N 0 0 372.421 3.673 20 5 FHBDRN CCn1nc(C)c(CNc2ccc(Br)cc2[N+](=O)[O-])c1C ZINC000066816877 942910438 /nfs/dbraw/zinc/91/04/38/942910438.db2.gz HOLQZWIJFLLNGL-UHFFFAOYSA-N 0 0 353.220 3.803 20 5 FHBDRN O=C(N[C@H]1C[C@@H]1c1ccccc1C(F)(F)F)c1ccccc1[N+](=O)[O-] ZINC000505501039 942916650 /nfs/dbraw/zinc/91/66/50/942916650.db2.gz YUTFQHCAXYBEIV-OCCSQVGLSA-N 0 0 350.296 3.900 20 5 FHBDRN CSc1ccc(Cl)c(C(=O)NCCNc2ccc([N+](=O)[O-])cc2)c1 ZINC000008174987 942916671 /nfs/dbraw/zinc/91/66/71/942916671.db2.gz GZWQCTFXGGYKIS-UHFFFAOYSA-N 0 0 365.842 3.812 20 5 FHBDRN O=C(Cc1ccc(Cl)c(Cl)c1)NCCNc1ccc([N+](=O)[O-])cc1 ZINC000008175017 942919096 /nfs/dbraw/zinc/91/90/96/942919096.db2.gz YOMFJORWNUPUME-UHFFFAOYSA-N 0 0 368.220 3.672 20 5 FHBDRN CC[C@@H](CNc1ccccc1)NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412380942 942925230 /nfs/dbraw/zinc/92/52/30/942925230.db2.gz YVHRILZLZITKAZ-ZYSHUDEJSA-N 0 0 353.422 3.705 20 5 FHBDRN CCOc1ccc(C(=O)NC[C@@H]2CCO[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000190218114 942940084 /nfs/dbraw/zinc/94/00/84/942940084.db2.gz JGHRGYNXABIWBO-LPHOPBHVSA-N 0 0 370.405 3.501 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N[C@H](CC(F)F)c2ccccc2)c1[N+](=O)[O-] ZINC000422029806 942946304 /nfs/dbraw/zinc/94/63/04/942946304.db2.gz VNBZKWDLMNKXMO-LLVKDONJSA-N 0 0 352.341 3.568 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N[C@@H](CC(F)F)c2ccccc2)c1[N+](=O)[O-] ZINC000422029811 942946503 /nfs/dbraw/zinc/94/65/03/942946503.db2.gz VNBZKWDLMNKXMO-NSHDSACASA-N 0 0 352.341 3.568 20 5 FHBDRN COc1ccccc1C1(CNC(=O)Nc2cccc([N+](=O)[O-])c2C)CC1 ZINC000503066323 942948580 /nfs/dbraw/zinc/94/85/80/942948580.db2.gz NVSGWBKVJNAYME-UHFFFAOYSA-N 0 0 355.394 3.765 20 5 FHBDRN COc1cc(CN2CCc3cc(F)cc(C)c3C2)c([N+](=O)[O-])cc1OC ZINC000503052452 942952516 /nfs/dbraw/zinc/95/25/16/942952516.db2.gz YXHHUDHTZLEIPQ-UHFFFAOYSA-N 0 0 360.385 3.618 20 5 FHBDRN Cc1nc([C@@H]2CCCCCN2C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)no1 ZINC000378610908 942955404 /nfs/dbraw/zinc/95/54/04/942955404.db2.gz RWLGRYCXDFIWDL-AWEZNQCLSA-N 0 0 364.789 3.697 20 5 FHBDRN Cc1nc(NC(=O)c2cc(-c3cccc(Cl)c3)no2)ccc1[N+](=O)[O-] ZINC000133632380 942955623 /nfs/dbraw/zinc/95/56/23/942955623.db2.gz JLYUNRRJULDVBL-UHFFFAOYSA-N 0 0 358.741 3.859 20 5 FHBDRN C[C@@H](O)c1ccc(CNC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000178359437 942958820 /nfs/dbraw/zinc/95/88/20/942958820.db2.gz WLHRJFBPVVXASC-CQSZACIVSA-N 0 0 369.421 3.522 20 5 FHBDRN CCC[N@H+](Cc1cc([O-])ccc1[N+](=O)[O-])[C@H](C)CC(=O)Nc1ccccc1 ZINC000503082082 942965433 /nfs/dbraw/zinc/96/54/33/942965433.db2.gz FAYRLDSDXYCATN-OAHLLOKOSA-N 0 0 371.437 3.930 20 5 FHBDRN C[C@@H]1CCCC[C@H]1OCCNC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000503097876 942984955 /nfs/dbraw/zinc/98/49/55/942984955.db2.gz GXKBEPHAWGWISV-IAQYHMDHSA-N 0 0 355.822 3.965 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)NCCc1c[nH]c2ccccc12 ZINC000549449161 942995807 /nfs/dbraw/zinc/99/58/07/942995807.db2.gz RCZJAKKPMWBUHI-UHFFFAOYSA-N 0 0 366.421 3.503 20 5 FHBDRN CC[C@H](NC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-])C1CCOCC1 ZINC000543120872 942996654 /nfs/dbraw/zinc/99/66/54/942996654.db2.gz WMBLRGBCTCPERD-ZDUSSCGKSA-N 0 0 372.874 3.662 20 5 FHBDRN O=C(N[C@@H]1CC[C@H]2CCCC[C@H]2C1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000514431041 943000554 /nfs/dbraw/zinc/00/05/54/943000554.db2.gz BOAFJUWZDAUAAJ-HLLBOEOZSA-N 0 0 368.437 3.869 20 5 FHBDRN O=C(NC1CCCC1)c1ccccc1OCc1c(F)cccc1[N+](=O)[O-] ZINC000505560790 943020903 /nfs/dbraw/zinc/02/09/03/943020903.db2.gz XFTRPCJCVGYFFB-UHFFFAOYSA-N 0 0 358.369 3.985 20 5 FHBDRN C[C@H](NS(=O)(=O)Cc1cccc([N+](=O)[O-])c1)c1ccc(C2CC2)cc1 ZINC000416654125 943021682 /nfs/dbraw/zinc/02/16/82/943021682.db2.gz CKJOEFYYGZDUBZ-ZDUSSCGKSA-N 0 0 360.435 3.653 20 5 FHBDRN C[C@H](NS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1)c1ccc(C2CC2)cc1 ZINC000416663408 943026531 /nfs/dbraw/zinc/02/65/31/943026531.db2.gz LVZDJTZEOOOYCJ-ZDUSSCGKSA-N 0 0 360.435 3.653 20 5 FHBDRN C[C@@H](NS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1)c1ccc(C2CC2)cc1 ZINC000416663405 943026616 /nfs/dbraw/zinc/02/66/16/943026616.db2.gz LVZDJTZEOOOYCJ-CYBMUJFWSA-N 0 0 360.435 3.653 20 5 FHBDRN Cc1cc(NC(=O)c2ccccc2[N+](=O)[O-])cnc1N1CCCC[C@@H]1C ZINC000503165670 943029041 /nfs/dbraw/zinc/02/90/41/943029041.db2.gz RGHRZIFMFVGIJG-AWEZNQCLSA-N 0 0 354.410 3.929 20 5 FHBDRN COc1cc(NC(=O)N2CC(Oc3ccc([N+](=O)[O-])cc3)C2)c(C)cc1C ZINC000434896265 943033121 /nfs/dbraw/zinc/03/31/21/943033121.db2.gz NZUBCJZORQPXFV-UHFFFAOYSA-N 0 0 371.393 3.515 20 5 FHBDRN Cc1cc(NC(=O)c2cccc([N+](=O)[O-])c2)cnc1N1CCCC[C@H]1C ZINC000503186147 943034361 /nfs/dbraw/zinc/03/43/61/943034361.db2.gz WHVAYORWWLUCBB-CQSZACIVSA-N 0 0 354.410 3.929 20 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FHBDRN CCCn1nccc1C1CCN(C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000503242274 943081248 /nfs/dbraw/zinc/08/12/48/943081248.db2.gz OQORWKSSCJMKQK-UHFFFAOYSA-N 0 0 371.441 3.921 20 5 FHBDRN CNc1ccc(C(=O)N(CCc2ccccc2)CC(C)C)cc1[N+](=O)[O-] ZINC000514535326 943091478 /nfs/dbraw/zinc/09/14/78/943091478.db2.gz VONNJJUYNYPLML-UHFFFAOYSA-N 0 0 355.438 3.977 20 5 FHBDRN COc1cc(NC(=O)CCc2cccc([N+](=O)[O-])c2)ccc1OC(C)C ZINC000183913637 943096123 /nfs/dbraw/zinc/09/61/23/943096123.db2.gz PDYDNOSVTAMBFE-UHFFFAOYSA-N 0 0 358.394 3.962 20 5 FHBDRN O=C(CCNC(=O)c1cc2ccccc2c2cccnc12)Nc1ccccn1 ZINC000613729078 943098401 /nfs/dbraw/zinc/09/84/01/943098401.db2.gz QZTOAEQORQNWJR-UHFFFAOYSA-N 0 0 370.412 3.542 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N1CCc2c1cccc2F ZINC000183739561 943100265 /nfs/dbraw/zinc/10/02/65/943100265.db2.gz FXFHTSDNNNZOIL-UHFFFAOYSA-N 0 0 354.259 3.956 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)N2CCc3c2cccc3F)cc1SC ZINC000183742595 943100817 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20 5 FHBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CCc2c1cccc2F ZINC000183782797 943149842 /nfs/dbraw/zinc/14/98/42/943149842.db2.gz VYOPCHBDTZPTIL-UHFFFAOYSA-N 0 0 365.158 3.699 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)NCc1sccc1Br ZINC000058765785 943156074 /nfs/dbraw/zinc/15/60/74/943156074.db2.gz GDEKZIGVZKBFOK-UHFFFAOYSA-N 0 0 355.213 3.657 20 5 FHBDRN NC(=O)c1ccnc(Oc2cc(Cl)c(Cl)cc2Cl)c1[N+](=O)[O-] ZINC000514638753 943170968 /nfs/dbraw/zinc/17/09/68/943170968.db2.gz LXONKSJMVLSLNZ-UHFFFAOYSA-N 0 0 362.556 3.841 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H]2COCC[C@H]21 ZINC000503416921 943173879 /nfs/dbraw/zinc/17/38/79/943173879.db2.gz DBLIKYNEMRDUEW-CZUORRHYSA-N 0 0 364.467 3.738 20 5 FHBDRN Cc1nc(NC(=O)C[C@H](c2ccccc2)C(F)(F)F)ccc1[N+](=O)[O-] ZINC000133683825 943183395 /nfs/dbraw/zinc/18/33/95/943183395.db2.gz ZYTBJOFLLPECGS-GFCCVEGCSA-N 0 0 353.300 3.973 20 5 FHBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)N2CCC[C@@H]2C2CCCCC2)cc1 ZINC000503439058 943184806 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20 5 FHBDRN Cc1c(Cl)cccc1C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000781871055 943241311 /nfs/dbraw/zinc/24/13/11/943241311.db2.gz NQDDWODEBVBLEK-UHFFFAOYSA-N 0 0 359.813 3.519 20 5 FHBDRN O=[N+]([O-])c1cccc2c1CC[C@@H]2Nc1cc(F)cc(N2CCOCC2)c1 ZINC000514738842 943251574 /nfs/dbraw/zinc/25/15/74/943251574.db2.gz LHHFDUUZUMGCCC-SFHVURJKSA-N 0 0 357.385 3.670 20 5 FHBDRN O=C(NCc1ccncn1)c1cc([N+](=O)[O-])ccc1SCC1CCCC1 ZINC000425310653 943276384 /nfs/dbraw/zinc/27/63/84/943276384.db2.gz OBNMSMVYEHPXTL-UHFFFAOYSA-N 0 0 372.450 3.597 20 5 FHBDRN Cc1nnc(-c2cccc(NC(=O)[C@H](C)c3cccc([N+](=O)[O-])c3)c2)o1 ZINC000514771717 943280594 /nfs/dbraw/zinc/28/05/94/943280594.db2.gz XMMDUIJJDUXYAF-LLVKDONJSA-N 0 0 352.350 3.695 20 5 FHBDRN C[C@H]1[C@H](c2nc(Cc3ccc([N+](=O)[O-])cc3Br)no2)C1(F)F ZINC000514785983 943290294 /nfs/dbraw/zinc/29/02/94/943290294.db2.gz OMRAYDINKMABNQ-UPONEAKYSA-N 0 0 374.141 3.700 20 5 FHBDRN Cc1c(CNC(=O)N2CC(C)(C)[C@@H]2c2ccncc2)cccc1[N+](=O)[O-] ZINC000431915591 943292565 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O=C(Nc1ccc(Cl)c(F)c1)c1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000584649785 943335713 /nfs/dbraw/zinc/33/57/13/943335713.db2.gz WEHZZHNYDUASOU-UHFFFAOYSA-N 0 0 362.704 3.690 20 5 FHBDRN CN(Cc1noc(C2CC2)n1)C(=O)Nc1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000417114578 943354905 /nfs/dbraw/zinc/35/49/05/943354905.db2.gz ORGHZAZJXJBRIX-UHFFFAOYSA-N 0 0 373.413 3.817 20 5 FHBDRN CC(C)C(=O)Nc1ccc(NC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)cc1 ZINC000048315622 943355612 /nfs/dbraw/zinc/35/56/12/943355612.db2.gz OZCGQVQLQRGONP-UHFFFAOYSA-N 0 0 366.377 3.923 20 5 FHBDRN COc1cc(C(=O)N2Cc3ccccc3C(C)(C)C2)c([N+](=O)[O-])cc1OC ZINC000536255941 943363651 /nfs/dbraw/zinc/36/36/51/943363651.db2.gz CAWNMQMAISZSOS-UHFFFAOYSA-N 0 0 370.405 3.546 20 5 FHBDRN CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1NCc1noc2ccccc12 ZINC000514896012 943366464 /nfs/dbraw/zinc/36/64/64/943366464.db2.gz BJIPQYZMXJNMRK-UHFFFAOYSA-N 0 0 359.313 3.664 20 5 FHBDRN C[C@@H](NC(=O)N[C@H]1CCCc2cc(N)ccc21)c1cccc([N+](=O)[O-])c1 ZINC000417136918 943374049 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FHBDRN Cc1cnn(-c2ccc(C)cc2NC(=O)c2cc(C)ccc2[N+](=O)[O-])c1 ZINC000435445729 943420980 /nfs/dbraw/zinc/42/09/80/943420980.db2.gz GWAUZZQDAUYARI-UHFFFAOYSA-N 0 0 350.378 3.958 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc2c1OCCC2=O ZINC000503931959 943423226 /nfs/dbraw/zinc/42/32/26/943423226.db2.gz WRSOROXYFRZDOT-NSHDSACASA-N 0 0 372.402 3.679 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)N(C)c2ccc(Cl)cc2F)c1 ZINC000435475397 943432864 /nfs/dbraw/zinc/43/28/64/943432864.db2.gz SXZOEVWFZJVPHH-UHFFFAOYSA-N 0 0 372.805 3.829 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)N1CCC[C@@H]1/C=C\c1ccccc1 ZINC000504007598 943454861 /nfs/dbraw/zinc/45/48/61/943454861.db2.gz GFKBXNZIZAOTLD-IBWPDUFMSA-N 0 0 351.406 3.982 20 5 FHBDRN O=C(c1cc(C(F)(F)F)ccc1[N+](=O)[O-])N1CC[C@@H](c2ccncc2)C1 ZINC000566453462 943457578 /nfs/dbraw/zinc/45/75/78/943457578.db2.gz XYXMEAQVPGRRSS-GFCCVEGCSA-N 0 0 365.311 3.638 20 5 FHBDRN CCOCc1nc([C@H](C)Nc2ccc(C(F)(F)F)cc2[N+](=O)[O-])no1 ZINC000290749284 943485020 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366.320 3.696 20 5 FHBDRN O=[N+]([O-])c1cc(F)cc(Br)c1NC1(C2CCOCC2)CC1 ZINC001167743392 943534499 /nfs/dbraw/zinc/53/44/99/943534499.db2.gz AKWGFZFEWKQTGP-UHFFFAOYSA-N 0 0 359.195 3.868 20 5 FHBDRN O=C1C[C@H](Oc2cccc(N[C@H]3CCCCc4ccc([N+](=O)[O-])cc43)c2)N1 ZINC000417358714 943538185 /nfs/dbraw/zinc/53/81/85/943538185.db2.gz IAJQRIFCYNGPCT-ICSRJNTNSA-N 0 0 367.405 3.699 20 5 FHBDRN CS(=O)(=O)c1ccccc1CN[C@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417385925 943563292 /nfs/dbraw/zinc/56/32/92/943563292.db2.gz YDXPLKYSTLTMNQ-SFHVURJKSA-N 0 0 374.462 3.556 20 5 FHBDRN C[C@H](Oc1ccc(F)c(F)c1)C(=O)N1c2ccc([N+](=O)[O-])cc2C[C@H]1C ZINC000504274678 943568174 /nfs/dbraw/zinc/56/81/74/943568174.db2.gz MGJXJZKLPDMGAP-MNOVXSKESA-N 0 0 362.332 3.618 20 5 FHBDRN C[C@H](Oc1ccccc1Cl)C(=O)N1c2ccc([N+](=O)[O-])cc2C[C@@H]1C ZINC000504278470 943569960 /nfs/dbraw/zinc/56/99/60/943569960.db2.gz CHNMVVMIRRNDRK-RYUDHWBXSA-N 0 0 360.797 3.993 20 5 FHBDRN CCOc1ccc(CN(C)C(=O)CSCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000513812273 943575419 /nfs/dbraw/zinc/57/54/19/943575419.db2.gz IHHLCXKKMHIOSH-UHFFFAOYSA-N 0 0 374.462 3.885 20 5 FHBDRN C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1ccc(C(F)(F)F)cn1 ZINC000504293769 943576635 /nfs/dbraw/zinc/57/66/35/943576635.db2.gz STFOVBYNHJFQQZ-SECBINFHSA-N 0 0 351.284 3.600 20 5 FHBDRN Cc1cccc(OCCC(=O)N2c3ccc([N+](=O)[O-])cc3C[C@@H]2C)c1C ZINC000504312058 943586490 /nfs/dbraw/zinc/58/64/90/943586490.db2.gz XSBVEKPUFJDTHN-AWEZNQCLSA-N 0 0 354.406 3.958 20 5 FHBDRN C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)CCCOc1cccc(F)c1 ZINC000504393751 943614148 /nfs/dbraw/zinc/61/41/48/943614148.db2.gz JOEKRGCLTKKUAM-ZDUSSCGKSA-N 0 0 358.369 3.871 20 5 FHBDRN Cc1nc(NC(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)nc2c1CCCC2 ZINC000414760296 943615859 /nfs/dbraw/zinc/61/58/59/943615859.db2.gz YBYXMBAEYLLILX-UHFFFAOYSA-N 0 0 370.409 3.612 20 5 FHBDRN C[C@@H](NC(=O)COc1ccc(C(F)(F)F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000053286603 943618828 /nfs/dbraw/zinc/61/88/28/943618828.db2.gz JOFZKWMAJXFSGI-LLVKDONJSA-N 0 0 368.311 3.870 20 5 FHBDRN Cc1ccc(-c2nnc(SCCOc3ccccc3[N+](=O)[O-])n2C)cc1 ZINC000053287346 943620441 /nfs/dbraw/zinc/62/04/41/943620441.db2.gz TVIYFJDZRZGFQJ-UHFFFAOYSA-N 0 0 370.434 3.870 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)c1ccc(Cl)c(Br)c1 ZINC000228982124 943624857 /nfs/dbraw/zinc/62/48/57/943624857.db2.gz NVEWZPALWCMPRN-UHFFFAOYSA-N 0 0 369.602 3.941 20 5 FHBDRN CC(C)c1nnc2ccc(NC(=O)C(C)(C)c3ccccc3[N+](=O)[O-])cn21 ZINC000504536926 943651622 /nfs/dbraw/zinc/65/16/22/943651622.db2.gz WLQXWYGMIQHTCP-UHFFFAOYSA-N 0 0 367.409 3.677 20 5 FHBDRN COCc1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000150715721 943658999 /nfs/dbraw/zinc/65/89/99/943658999.db2.gz SXSIGNIXBMQBIW-UHFFFAOYSA-N 0 0 365.183 3.756 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N[C@](C)(c2ccccc2)C(F)(F)F)c1 ZINC000504570783 943686737 /nfs/dbraw/zinc/68/67/37/943686737.db2.gz NYJHENIUUYJYLV-MRXNPFEDSA-N 0 0 368.311 3.811 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@](C)(c1ccccc1)C(F)(F)F ZINC000504586447 943698386 /nfs/dbraw/zinc/69/83/86/943698386.db2.gz UIVSIWGWUFNRFU-OAHLLOKOSA-N 0 0 353.300 3.506 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N1CCC(Nc2nccs2)CC1 ZINC000190420083 943698894 /nfs/dbraw/zinc/69/88/94/943698894.db2.gz JCTOMVHPGWTKGB-UHFFFAOYSA-N 0 0 374.466 3.693 20 5 FHBDRN Cc1ccc([C@H](C)N2C(=O)CN([C@H](C)c3ccccc3)C2=O)cc1[N+](=O)[O-] ZINC000431955491 943742347 /nfs/dbraw/zinc/74/23/47/943742347.db2.gz QULWQYCQKLWIHH-CABCVRRESA-N 0 0 367.405 3.990 20 5 FHBDRN CCNc1ccc(C(=O)Nc2cc(OC)c(OC)cc2C)cc1[N+](=O)[O-] ZINC000014712997 943752598 /nfs/dbraw/zinc/75/25/98/943752598.db2.gz CUDBBEPDQLIRLS-UHFFFAOYSA-N 0 0 359.382 3.605 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N[C@@H]1CCCC[C@H]1OC(F)F ZINC000504715322 943756607 /nfs/dbraw/zinc/75/66/07/943756607.db2.gz FJNCLQSNOZTVDS-BXUZGUMPSA-N 0 0 357.357 3.884 20 5 FHBDRN CC[C@@H](C)[C@@H](C)N(C(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-])C1CC1 ZINC000105380751 943756632 /nfs/dbraw/zinc/75/66/32/943756632.db2.gz FAOHLGSWVCIBRZ-VXGBXAGGSA-N 0 0 350.415 3.651 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])N1CCC[C@H](Oc2ccccc2Cl)C1 ZINC000504691407 943757810 /nfs/dbraw/zinc/75/78/10/943757810.db2.gz HTJGUGDRCWGMOF-HNNXBMFYSA-N 0 0 374.824 3.861 20 5 FHBDRN CCOc1ccc(C(=O)N[C@@H]2C[C@H]2c2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000437377454 943761132 /nfs/dbraw/zinc/76/11/32/943761132.db2.gz XIRGDZYVVWVAGZ-LSDHHAIUSA-N 0 0 360.797 3.933 20 5 FHBDRN CCC[C@]1(C)CCCN(C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000437377673 943761536 /nfs/dbraw/zinc/76/15/36/943761536.db2.gz VNABHWURDSXONP-LJQANCHMSA-N 0 0 356.426 3.823 20 5 FHBDRN Cc1ccccc1OCCN(C)C(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000515286763 943762084 /nfs/dbraw/zinc/76/20/84/943762084.db2.gz GIMNDDHUFINHBL-UHFFFAOYSA-N 0 0 354.362 3.800 20 5 FHBDRN COCC[C@@H](C)CNC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 ZINC000412483286 943762209 /nfs/dbraw/zinc/76/22/09/943762209.db2.gz KHBHDCZRGQQLRC-OAHLLOKOSA-N 0 0 371.437 3.609 20 5 FHBDRN COc1ccc(C(=O)NCc2ccc(-c3cccnc3)cc2)cc1[N+](=O)[O-] ZINC000437380801 943763978 /nfs/dbraw/zinc/76/39/78/943763978.db2.gz AJFSJOBVIVLBPI-UHFFFAOYSA-N 0 0 363.373 3.595 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2C[C@H]2c2cc(F)c(F)c(F)c2)c1 ZINC000437381266 943765682 /nfs/dbraw/zinc/76/56/82/943765682.db2.gz QUNLTSZUCRPOQC-IINYFYTJSA-N 0 0 350.296 3.606 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])N[C@H]1C[C@H](c2cccc(Cl)c2)C1 ZINC000437402230 943778829 /nfs/dbraw/zinc/77/88/29/943778829.db2.gz BMMUDILWGPZGJQ-CTYIDZIISA-N 0 0 359.813 3.723 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1C[C@H](c2cccc(Cl)c2)C1 ZINC000437413488 943787562 /nfs/dbraw/zinc/78/75/62/943787562.db2.gz ZXKMKPGSBOFLLO-MQMHXKEQSA-N 0 0 360.797 3.933 20 5 FHBDRN Nc1ccc(-c2noc([C@H]3C[C@@H]3c3ccc(F)cc3F)n2)cc1[N+](=O)[O-] ZINC000515329563 943792395 /nfs/dbraw/zinc/79/23/95/943792395.db2.gz VETVPZGSQWGNQL-NEPJUHHUSA-N 0 0 358.304 3.776 20 5 FHBDRN Cc1c(C(=O)NCc2ccc(F)cc2Br)cccc1[N+](=O)[O-] ZINC000053326807 943792876 /nfs/dbraw/zinc/79/28/76/943792876.db2.gz XQMVTJQAGVMXKY-UHFFFAOYSA-N 0 0 367.174 3.735 20 5 FHBDRN CC[C@H](CC[NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1)C(=O)[O-] ZINC000417651473 943799030 /nfs/dbraw/zinc/79/90/30/943799030.db2.gz PNAVNRJEDGTERD-MRXNPFEDSA-N 0 0 371.437 3.953 20 5 FHBDRN O=C(NCCc1ccccc1F)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000435829899 943800479 /nfs/dbraw/zinc/80/04/79/943800479.db2.gz YUBCEXYDGHAWJJ-UHFFFAOYSA-N 0 0 360.388 3.793 20 5 FHBDRN O=C(CSc1nncc2ccccc21)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000515338597 943806852 /nfs/dbraw/zinc/80/68/52/943806852.db2.gz WQKGKGSOIKGIIC-UHFFFAOYSA-N 0 0 374.809 3.922 20 5 FHBDRN COc1cc(C(=O)N[C@H]2C[C@H](c3ccccc3F)C2)cc([N+](=O)[O-])c1C ZINC000437438821 943816071 /nfs/dbraw/zinc/81/60/71/943816071.db2.gz KJQJXVIWSWZCQP-MQMHXKEQSA-N 0 0 358.369 3.727 20 5 FHBDRN CCCN(C(=O)COc1ccc([N+](=O)[O-])cc1)[C@@H]1CCc2ccccc21 ZINC000515371731 943817161 /nfs/dbraw/zinc/81/71/61/943817161.db2.gz KTPROZVLRMQJJP-LJQANCHMSA-N 0 0 354.406 3.900 20 5 FHBDRN CCc1ccc([C@H]2COCCN2C(=O)Nc2cc([N+](=O)[O-])ccc2CC)o1 ZINC000584869674 943825313 /nfs/dbraw/zinc/82/53/13/943825313.db2.gz SIIZQTNTWOTIGF-QGZVFWFLSA-N 0 0 373.409 3.918 20 5 FHBDRN CCc1ccc([C@@H]2COCCN2C(=O)Nc2cc([N+](=O)[O-])ccc2CC)o1 ZINC000584869673 943825385 /nfs/dbraw/zinc/82/53/85/943825385.db2.gz SIIZQTNTWOTIGF-KRWDZBQOSA-N 0 0 373.409 3.918 20 5 FHBDRN C[C@H]1COCC[C@@H]1C(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000435872260 943825746 /nfs/dbraw/zinc/82/57/46/943825746.db2.gz NNXQINBTKUDJHA-UGSOOPFHSA-N 0 0 356.378 3.998 20 5 FHBDRN COc1cccc(C(=O)N[C@@H]2C[C@H]2c2c(F)cccc2Cl)c1[N+](=O)[O-] ZINC000435878316 943829887 /nfs/dbraw/zinc/82/98/87/943829887.db2.gz ZBLOCZAKCDCZAN-ZWNOBZJWSA-N 0 0 364.760 3.682 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H]1CCCC[C@@H]1C(F)(F)F ZINC000516925513 943832458 /nfs/dbraw/zinc/83/24/58/943832458.db2.gz REVFPJCWJWDISC-WDEREUQCSA-N 0 0 361.320 3.846 20 5 FHBDRN CC(C)c1cccnc1NC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000504831756 943836749 /nfs/dbraw/zinc/83/67/49/943836749.db2.gz PGZCGKHYQJGXGA-UHFFFAOYSA-N 0 0 351.366 3.551 20 5 FHBDRN Cc1cccc(CN(C)Cc2ccc(Br)cc2[N+](=O)[O-])n1 ZINC000425412854 943838083 /nfs/dbraw/zinc/83/80/83/943838083.db2.gz GCHMWRKFTWVUHZ-UHFFFAOYSA-N 0 0 350.216 3.693 20 5 FHBDRN COc1ccc(-c2ccc(C[NH2+][C@@H](CC3CCC3)C(=O)[O-])o2)c([N+](=O)[O-])c1 ZINC000417702014 943838182 /nfs/dbraw/zinc/83/81/82/943838182.db2.gz KCOJBMTXKCMGGI-INIZCTEOSA-N 0 0 374.393 3.596 20 5 FHBDRN CC[C@H](NS(=O)(=O)c1cccc([N+](=O)[O-])c1)c1cccc(Cl)c1 ZINC000515374776 943839891 /nfs/dbraw/zinc/83/98/91/943839891.db2.gz MLAWXRGTVZUAPK-HNNXBMFYSA-N 0 0 354.815 3.678 20 5 FHBDRN CCn1c(C)nc([N+](=O)[O-])c1N[C@@H]1COc2c1ccc(Cl)c2Cl ZINC000515398168 943847383 /nfs/dbraw/zinc/84/73/83/943847383.db2.gz NGKQJEWNNILEII-SNVBAGLBSA-N 0 0 357.197 3.972 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N(C)CCc1ccccn1 ZINC000505723672 943851831 /nfs/dbraw/zinc/85/18/31/943851831.db2.gz SZFFGBFWGQHQTH-UHFFFAOYSA-N 0 0 359.451 3.807 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(C)c(NC(C)=O)c2)c1 ZINC000515405121 943853203 /nfs/dbraw/zinc/85/32/03/943853203.db2.gz MTGCDSKCRVZXRQ-UHFFFAOYSA-N 0 0 357.366 3.513 20 5 FHBDRN CC(=O)c1cc(NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)ccc1C ZINC000584478298 943853705 /nfs/dbraw/zinc/85/37/05/943853705.db2.gz NUHOQMPAYRZIFZ-UHFFFAOYSA-N 0 0 353.378 3.932 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)NC(C)(C)c2ccccc2F)c1 ZINC000515418125 943863550 /nfs/dbraw/zinc/86/35/50/943863550.db2.gz LHKRJOJBMBNCTI-UHFFFAOYSA-N 0 0 360.385 3.863 20 5 FHBDRN Nc1cccc([N+](=O)[O-])c1C(=O)NC1CC(F)(c2cccc(Cl)c2)C1 ZINC000435941609 943873101 /nfs/dbraw/zinc/87/31/01/943873101.db2.gz MFCBTXJWSKOAPM-UHFFFAOYSA-N 0 0 363.776 3.588 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1CN(Cc1cccnc1)C1CC1 ZINC000425418827 943873477 /nfs/dbraw/zinc/87/34/77/943873477.db2.gz JWANOSUXRIGITA-UHFFFAOYSA-N 0 0 362.227 3.917 20 5 FHBDRN CCc1ncc(NC(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)cn1 ZINC000437515418 943876460 /nfs/dbraw/zinc/87/64/60/943876460.db2.gz PPRRMOXTJMAGLQ-UHFFFAOYSA-N 0 0 363.377 3.943 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1Cl)N1CC[C@H](n2cc(Cl)cn2)C1 ZINC000290762116 943880938 /nfs/dbraw/zinc/88/09/38/943880938.db2.gz ROPYMTCVVRYVPW-JTQLQIEISA-N 0 0 370.196 3.577 20 5 FHBDRN COc1ccccc1C1(c2noc(COc3ccccc3[N+](=O)[O-])n2)CC1 ZINC000516985703 943889653 /nfs/dbraw/zinc/88/96/53/943889653.db2.gz RLUCMUNSRMGWGH-UHFFFAOYSA-N 0 0 367.361 3.645 20 5 FHBDRN O=C(CN1CCS[C@H]2CCCC[C@@H]21)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000437531026 943892602 /nfs/dbraw/zinc/89/26/02/943892602.db2.gz ZFFNEBFILLZDJD-ZFWWWQNUSA-N 0 0 369.874 3.547 20 5 FHBDRN Cc1ocnc1-c1noc(-c2cc([N+](=O)[O-])cc(Br)c2C)n1 ZINC000516996532 943901101 /nfs/dbraw/zinc/90/11/01/943901101.db2.gz SJEQFZAOMGCLEN-UHFFFAOYSA-N 0 0 365.143 3.679 20 5 FHBDRN COc1cccc(C2(CNC(=O)Nc3ccc([N+](=O)[O-])c(C)c3)CC2)c1 ZINC000515465837 943903327 /nfs/dbraw/zinc/90/33/27/943903327.db2.gz PCDVSPQCISLCBY-UHFFFAOYSA-N 0 0 355.394 3.765 20 5 FHBDRN Cc1noc(-c2ccc(C)c(NC(=O)NCc3ccccc3[N+](=O)[O-])c2)n1 ZINC000515468802 943909046 /nfs/dbraw/zinc/90/90/46/943909046.db2.gz CBNPIJPEFAZOAW-UHFFFAOYSA-N 0 0 367.365 3.583 20 5 FHBDRN O=C(c1n[nH]c2ccc([N+](=O)[O-])cc21)N1CCCC[C@@H]1c1ccccc1 ZINC000504913661 943909397 /nfs/dbraw/zinc/90/93/97/943909397.db2.gz GIADIPBOPRVSEN-QGZVFWFLSA-N 0 0 350.378 3.839 20 5 FHBDRN CC(C)(C)C1CC(NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C1 ZINC000504941506 943919565 /nfs/dbraw/zinc/91/95/65/943919565.db2.gz DPGBTYWDHDRONE-UHFFFAOYSA-N 0 0 359.470 3.752 20 5 FHBDRN Cc1cc([C@@H]2NC(=O)N([C@@H](C)c3ccc(C)c([N+](=O)[O-])c3)C2=O)ccc1F ZINC000431958277 943928356 /nfs/dbraw/zinc/92/83/56/943928356.db2.gz ZEJJVAXPMAGYBC-SJCJKPOMSA-N 0 0 371.368 3.705 20 5 FHBDRN COc1ccc2c(c1)C[C@H](C)N(C(=O)c1cccc(OC)c1[N+](=O)[O-])[C@@H]2C ZINC000436020920 943940883 /nfs/dbraw/zinc/94/08/83/943940883.db2.gz MOIHZSGAGJYNHQ-QWHCGFSZSA-N 0 0 370.405 3.760 20 5 FHBDRN COc1cc(C(=O)Nc2ccc([N+](=O)[O-])cc2)sc1Br ZINC000120276912 943941474 /nfs/dbraw/zinc/94/14/74/943941474.db2.gz LISISDWSMCFVIX-UHFFFAOYSA-N 0 0 357.185 3.680 20 5 FHBDRN Cc1ccc(S(=O)(=O)N(C2CC2)C2CCC(C)CC2)cc1[N+](=O)[O-] ZINC000515514190 943946957 /nfs/dbraw/zinc/94/69/57/943946957.db2.gz NSGDTOFCJYVANY-UHFFFAOYSA-N 0 0 352.456 3.635 20 5 FHBDRN Cc1ccccc1[C@H]1CCN(C(=O)CCOc2ccccc2[N+](=O)[O-])C1 ZINC000504976045 943947801 /nfs/dbraw/zinc/94/78/01/943947801.db2.gz ADPXITZJHQSACK-INIZCTEOSA-N 0 0 354.406 3.688 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1CN1CCC[C@@H]1[C@@H]1CCCO1 ZINC000425444417 943953244 /nfs/dbraw/zinc/95/32/44/943953244.db2.gz NOUKWSQAGZTQKY-HIFRSBDPSA-N 0 0 355.232 3.501 20 5 FHBDRN CSc1nc(-c2nc(-c3cccc([N+](=O)[O-])c3)no2)c2ccccn21 ZINC000504986358 943957721 /nfs/dbraw/zinc/95/77/21/943957721.db2.gz MVHREBAOCXFVFK-UHFFFAOYSA-N 0 0 353.363 3.681 20 5 FHBDRN C[C@@H]1C[C@H]1C(=O)Nc1ccc(-c2nc(-c3cccc([N+](=O)[O-])c3)no2)cc1 ZINC000504986625 943957849 /nfs/dbraw/zinc/95/78/49/943957849.db2.gz OGXNOGOZKWTFPN-BDJLRTHQSA-N 0 0 364.361 3.906 20 5 FHBDRN CCC(CC)[C@@H](CCNC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1)OC ZINC000437603819 943960498 /nfs/dbraw/zinc/96/04/98/943960498.db2.gz IZRUTKHQYLBOSM-SUMWQHHRSA-N 0 0 351.447 3.796 20 5 FHBDRN CCN(c1ccc(-c2nc(-c3cccc([N+](=O)[O-])c3)no2)cn1)C(C)C ZINC000504992859 943961631 /nfs/dbraw/zinc/96/16/31/943961631.db2.gz YLISXNRKTUVJDT-UHFFFAOYSA-N 0 0 353.382 3.942 20 5 FHBDRN CC[C@@H](c1ccccc1OC)N(C)c1ccc(C(=O)NC)cc1[N+](=O)[O-] ZINC000566524348 943962298 /nfs/dbraw/zinc/96/22/98/943962298.db2.gz WXWRIERWXQWEGO-HNNXBMFYSA-N 0 0 357.410 3.551 20 5 FHBDRN CC1(C)CN(Cc2ccc(Br)cc2[N+](=O)[O-])[C@H]1[C@H]1CCCO1 ZINC000425449405 943962719 /nfs/dbraw/zinc/96/27/19/943962719.db2.gz STBCGKRSSPYOCE-CABCVRRESA-N 0 0 369.259 3.747 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2noc(CSCc3nc4ccccc4[nH]3)n2)c1 ZINC000505009626 943966441 /nfs/dbraw/zinc/96/64/41/943966441.db2.gz VSMXWQMSDDYDET-UHFFFAOYSA-N 0 0 367.390 3.955 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N2c3ccccc3NC(=O)C2(C)C)c1 ZINC000517069040 943969125 /nfs/dbraw/zinc/96/91/25/943969125.db2.gz SFNCUTNKSWIBKJ-UHFFFAOYSA-N 0 0 371.418 3.694 20 5 FHBDRN Cc1c(-c2nc(-c3cccc([N+](=O)[O-])c3)no2)cnn1Cc1ccccc1 ZINC000505013430 943969239 /nfs/dbraw/zinc/96/92/39/943969239.db2.gz KQFKRZZRWXTFHZ-UHFFFAOYSA-N 0 0 361.361 3.865 20 5 FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@H]1c1ccccc1 ZINC000436045669 943970447 /nfs/dbraw/zinc/97/04/47/943970447.db2.gz YGBYXRWAJNUSFL-DOTOQJQBSA-N 0 0 372.446 3.619 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])N[C@H]1C[C@H](c2cc(F)cc(F)c2)C1 ZINC000437629604 943976636 /nfs/dbraw/zinc/97/66/36/943976636.db2.gz MFSPCNSQELWUDP-SAZUREKKSA-N 0 0 361.348 3.618 20 5 FHBDRN CC(C)[C@H]1CCC[C@H](NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000505041175 943978147 /nfs/dbraw/zinc/97/81/47/943978147.db2.gz JQRKZUFGRBITOX-GJZGRUSLSA-N 0 0 356.426 3.725 20 5 FHBDRN CN(Cc1ccc(OC(F)(F)F)cc1)C(=O)c1csc([N+](=O)[O-])c1 ZINC000515553166 943987178 /nfs/dbraw/zinc/98/71/78/943987178.db2.gz ULPOMEJZNFIBKW-UHFFFAOYSA-N 0 0 360.313 3.827 20 5 FHBDRN CSc1cnn(-c2ccccc2)c1NC(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000150720451 943988547 /nfs/dbraw/zinc/98/85/47/943988547.db2.gz XVIIZAISGGWRNL-UHFFFAOYSA-N 0 0 368.418 3.684 20 5 FHBDRN O=C(NCC1CCCC1)c1cc(F)cc2c(=O)c3cccc(F)c3[nH]c12 ZINC000436070757 943991723 /nfs/dbraw/zinc/99/17/23/943991723.db2.gz WAAYNSLLAIXGHC-UHFFFAOYSA-N 0 0 356.372 3.880 20 5 FHBDRN CCOc1ccc(C(=O)N[C@H]2CCCc3c(O)cccc32)cc1[N+](=O)[O-] ZINC000190247798 943998640 /nfs/dbraw/zinc/99/86/40/943998640.db2.gz XDBOGSXKNGZRBX-HNNXBMFYSA-N 0 0 356.378 3.507 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)N[C@@H]1C[C@H]1c1cccc(Cl)c1 ZINC000437640537 944006767 /nfs/dbraw/zinc/00/67/67/944006767.db2.gz XVPOWWCGJIWMQQ-DLBZAZTESA-N 0 0 359.813 3.646 20 5 FHBDRN C[C@H](c1cccc([N+](=O)[O-])c1)N1CCN(C(=O)CC2CCCCC2)CC1 ZINC000110299706 944033039 /nfs/dbraw/zinc/03/30/39/944033039.db2.gz MMCDNCYOMYMYEC-MRXNPFEDSA-N 0 0 359.470 3.770 20 5 FHBDRN O=C(Nc1ccc(Nc2ncccn2)cc1)Nc1ccc([N+](=O)[O-])cc1 ZINC000436112666 944044043 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COc1cc(CNC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)ccc1C ZINC000436145402 944054655 /nfs/dbraw/zinc/05/46/55/944054655.db2.gz UOPVVJARKNZZOD-UHFFFAOYSA-N 0 0 372.424 3.928 20 5 FHBDRN C/C=C/c1ccc(OCC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)c(OC)c1 ZINC000053453423 944054876 /nfs/dbraw/zinc/05/48/76/944054876.db2.gz WAAQYEYGSCPQSC-YVARQFDVSA-N 0 0 370.405 3.893 20 5 FHBDRN C[C@@H]1CCC[C@@H](c2noc(-c3cccc([N+](=O)[O-])c3N3CCOCC3)n2)C1 ZINC000566553998 944060460 /nfs/dbraw/zinc/06/04/60/944060460.db2.gz GZHXTNRMQADKGA-ZIAGYGMSSA-N 0 0 372.425 3.775 20 5 FHBDRN CCSc1ccc([C@@H](C)NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)cc1 ZINC000505126815 944074736 /nfs/dbraw/zinc/07/47/36/944074736.db2.gz WBHISGJFJNDTMK-SNVBAGLBSA-N 0 0 363.414 3.919 20 5 FHBDRN CC[C@H](C)[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F)C(F)(F)F ZINC000436184138 944078892 /nfs/dbraw/zinc/07/88/92/944078892.db2.gz SWTVAFMHPJNYQY-WRWORJQWSA-N 0 0 370.274 3.903 20 5 FHBDRN CC[C@@H](C)[C@@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl)C(F)(F)F ZINC000436190937 944084510 /nfs/dbraw/zinc/08/45/10/944084510.db2.gz XIRLVHSIHYTAPZ-AMIZOPFISA-N 0 0 352.740 3.884 20 5 FHBDRN Cc1csc(-c2cccc(C(=O)NCc3ccccc3[N+](=O)[O-])c2)n1 ZINC000150727734 944084588 /nfs/dbraw/zinc/08/45/88/944084588.db2.gz VYZBEGUFCCRHKZ-UHFFFAOYSA-N 0 0 353.403 3.957 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCc1cc(CC)ccn1 ZINC000437755897 944086740 /nfs/dbraw/zinc/08/67/40/944086740.db2.gz UDKXKUNOVMPFFE-UHFFFAOYSA-N 0 0 359.451 3.984 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@@H]1CCCO[C@H]1C(C)(C)C ZINC000123094953 944089546 /nfs/dbraw/zinc/08/95/46/944089546.db2.gz GGXMKPCJBSPOSF-BLLLJJGKSA-N 0 0 365.430 3.566 20 5 FHBDRN CCc1ccccc1CCn1cc([N+](=O)[O-])c(C)c(Br)c1=O ZINC000436202060 944096537 /nfs/dbraw/zinc/09/65/37/944096537.db2.gz CUAKOEJTOVKHSS-UHFFFAOYSA-N 0 0 365.227 3.633 20 5 FHBDRN C[C@@H](c1cccc([N+](=O)[O-])c1)N1CCN(C(=O)CC2CCCCC2)CC1 ZINC000110299702 944099534 /nfs/dbraw/zinc/09/95/34/944099534.db2.gz MMCDNCYOMYMYEC-INIZCTEOSA-N 0 0 359.470 3.770 20 5 FHBDRN COc1ccc(C)cc1NC(=O)[C@@H]1CCCN1c1ccc([N+](=O)[O-])c(C)c1 ZINC000092655638 944105014 /nfs/dbraw/zinc/10/50/14/944105014.db2.gz QNEVKHIPJVYPCF-SFHVURJKSA-N 0 0 369.421 3.828 20 5 FHBDRN CO[C@H]1CCN(Cc2ccc(Br)cc2[N+](=O)[O-])CC1(C)C ZINC000425495790 944118284 /nfs/dbraw/zinc/11/82/84/944118284.db2.gz TWHHGBQLXDRCAQ-AWEZNQCLSA-N 0 0 357.248 3.604 20 5 FHBDRN O=C(N[C@H]1COc2ccccc21)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000436229400 944118635 /nfs/dbraw/zinc/11/86/35/944118635.db2.gz DKTDOSBERDRCPI-KRWDZBQOSA-N 0 0 374.371 3.684 20 5 FHBDRN COC[C@@H]1CCCN(Cc2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000425495241 944119896 /nfs/dbraw/zinc/11/98/96/944119896.db2.gz SEZBEUMHOLZCBD-GFCCVEGCSA-N 0 0 357.248 3.606 20 5 FHBDRN CC[C@H](C)n1ncc(Nc2ccc(C(=O)NC)cc2[N+](=O)[O-])c1C1CC1 ZINC000517226766 944123600 /nfs/dbraw/zinc/12/36/00/944123600.db2.gz XOIJOIAPGWQUOD-NSHDSACASA-N 0 0 357.414 3.743 20 5 FHBDRN O=C(CC1CCCC1)NCCNc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000505774419 944125727 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CCOc1cccc([C@@H]2C[C@H]2NC(=O)Nc2cc([N+](=O)[O-])ccc2OC)c1 ZINC000436265888 944141690 /nfs/dbraw/zinc/14/16/90/944141690.db2.gz XJZASGVTFHGRIG-JKSUJKDBSA-N 0 0 371.393 3.680 20 5 FHBDRN CC1=CCCN([C@@H](C)C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)C1 ZINC000436268472 944142179 /nfs/dbraw/zinc/14/21/79/944142179.db2.gz UNSYLBLHPRIUEM-ZDUSSCGKSA-N 0 0 372.450 3.697 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1COc2ccccc2C1 ZINC000505780439 944145561 /nfs/dbraw/zinc/14/55/61/944145561.db2.gz BCSWAYABFLOWBO-AWEZNQCLSA-N 0 0 372.446 3.830 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])[nH]1)N1CCc2sccc2[C@H]1c1cccs1 ZINC000515717680 944148292 /nfs/dbraw/zinc/14/82/92/944148292.db2.gz TUXYUAXHPQKINX-HNNXBMFYSA-N 0 0 359.432 3.834 20 5 FHBDRN CCn1c2ccccc2nc1[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])cc1 ZINC000506141868 944150066 /nfs/dbraw/zinc/15/00/66/944150066.db2.gz CDMOXFHSGVVNLR-GOSISDBHSA-N 0 0 364.405 3.942 20 5 FHBDRN O=C(c1cccc([N+](=O)[O-])c1)N1CCC(c2noc3cc(F)ccc32)CC1 ZINC000290770322 944154197 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COc1ccc(CNC(=O)Nc2cccc(Cl)c2F)cc1[N+](=O)[O-] ZINC000515767157 944192008 /nfs/dbraw/zinc/19/20/08/944192008.db2.gz UXFPJQZRMONPLU-UHFFFAOYSA-N 0 0 353.737 3.718 20 5 FHBDRN O=C(Nc1ccc2[nH]cnc2c1)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000436318578 944196872 /nfs/dbraw/zinc/19/68/72/944196872.db2.gz OYAJKRGPFGSYMG-UHFFFAOYSA-N 0 0 372.359 3.949 20 5 FHBDRN COc1ccc(CNC(=O)N(C)[C@H](C)c2ccccc2C)cc1[N+](=O)[O-] ZINC000515779520 944204764 /nfs/dbraw/zinc/20/47/64/944204764.db2.gz XWRPIVOATMZGCD-CQSZACIVSA-N 0 0 357.410 3.814 20 5 FHBDRN Cc1c(NC(=O)c2ccc([N+](=O)[O-])c3cccnc23)cnn1CC(C)C ZINC000500173028 944210551 /nfs/dbraw/zinc/21/05/51/944210551.db2.gz QXAVWCRBKQMOTN-UHFFFAOYSA-N 0 0 353.382 3.556 20 5 FHBDRN CCOc1ccc(CNC(=O)c2ccc(SC)c([N+](=O)[O-])c2)cc1F ZINC000517309512 944214535 /nfs/dbraw/zinc/21/45/35/944214535.db2.gz KWRYVNNSZGFGIE-UHFFFAOYSA-N 0 0 364.398 3.785 20 5 FHBDRN CCOc1ccccc1C(=O)Nc1cc(C)nn1-c1ccc([N+](=O)[O-])cc1 ZINC000105586642 944228409 /nfs/dbraw/zinc/22/84/09/944228409.db2.gz NKRVIFMLMRMAKP-UHFFFAOYSA-N 0 0 366.377 3.740 20 5 FHBDRN C[C@H](Nc1ccc(C(=O)NC[C@@H]2C[C@H]2C)cc1[N+](=O)[O-])c1ccccn1 ZINC000053510617 944231106 /nfs/dbraw/zinc/23/11/06/944231106.db2.gz HXCAHAUNNDXQER-IPYPFGDCSA-N 0 0 354.410 3.549 20 5 FHBDRN O=C(CNc1c(F)cccc1[N+](=O)[O-])Nc1ccc(Br)cc1 ZINC000517345123 944232425 /nfs/dbraw/zinc/23/24/25/944232425.db2.gz VQTMXOVPECJATB-UHFFFAOYSA-N 0 0 368.162 3.547 20 5 FHBDRN CC(C)Oc1ccc(F)cc1N[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000518283342 944234243 /nfs/dbraw/zinc/23/42/43/944234243.db2.gz RRQZWHWMNOHGPP-INIZCTEOSA-N 0 0 373.384 3.739 20 5 FHBDRN COc1ccccc1C(C)=CC(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000759789451 944235936 /nfs/dbraw/zinc/23/59/36/944235936.db2.gz WAKPEYUXNVBORU-PKNBQFBNSA-N 0 0 352.350 3.522 20 5 FHBDRN CC1=CCCN(C(=O)c2cc(F)cc3c(=O)c4cccc(F)c4[nH]c23)C1 ZINC000437966749 944244712 /nfs/dbraw/zinc/24/47/12/944244712.db2.gz XNGBXCCDWAPGSN-UHFFFAOYSA-N 0 0 354.356 3.752 20 5 FHBDRN Cc1c(CNC(=O)c2cc([N+](=O)[O-])ccc2SC2CCCC2)cnn1C ZINC000162600626 944247138 /nfs/dbraw/zinc/24/71/38/944247138.db2.gz YWPPTAAUSPYSAR-UHFFFAOYSA-N 0 0 374.466 3.601 20 5 FHBDRN Cc1cc(F)cc(C(=O)NCCc2ccc(OC(C)C)cc2)c1[N+](=O)[O-] ZINC000123175108 944255288 /nfs/dbraw/zinc/25/52/88/944255288.db2.gz HRGQDEHBHDPHEP-UHFFFAOYSA-N 0 0 360.385 3.802 20 5 FHBDRN O=C(NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N(CC1CC1)CC1CC1 ZINC000426261038 944258993 /nfs/dbraw/zinc/25/89/93/944258993.db2.gz NNNMYUXKMOGYSE-UHFFFAOYSA-N 0 0 371.359 3.945 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)F)cc1N1CCOC2(C1)CCCCCC2 ZINC000436393307 944263776 /nfs/dbraw/zinc/26/37/76/944263776.db2.gz TZSNOMDNOFGVQL-UHFFFAOYSA-N 0 0 359.348 3.938 20 5 FHBDRN CCC(=O)Nc1cccc(CNC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000515845996 944264050 /nfs/dbraw/zinc/26/40/50/944264050.db2.gz BJVXFLUSQQVQAB-CYBMUJFWSA-N 0 0 370.409 3.504 20 5 FHBDRN Cc1ccc(SCCC(=O)NCCOc2ccc([N+](=O)[O-])cc2)cc1 ZINC000518307630 944269824 /nfs/dbraw/zinc/26/98/24/944269824.db2.gz ZHFFKSIEUIOSCU-UHFFFAOYSA-N 0 0 360.435 3.581 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)F)cc1N1CCc2ccc(F)c(F)c2C1 ZINC000436395616 944270988 /nfs/dbraw/zinc/27/09/88/944270988.db2.gz XWULPNCHRVEFSH-UHFFFAOYSA-N 0 0 359.254 3.850 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)F)cc1NC[C@H](CCO)c1ccccc1 ZINC000436397831 944273537 /nfs/dbraw/zinc/27/35/37/944273537.db2.gz QMBXINISKFUUKM-LBPRGKRZSA-N 0 0 355.316 3.587 20 5 FHBDRN CC(C)n1cc2c(n1)C[C@@H](Nc1cc(C(F)(F)F)ncc1[N+](=O)[O-])CC2 ZINC000436400419 944277097 /nfs/dbraw/zinc/27/70/97/944277097.db2.gz JYWSVWUBELJZTC-NSHDSACASA-N 0 0 369.347 3.755 20 5 FHBDRN CN(C)c1cccc(CN(C)c2cc(C(F)(F)F)ncc2[N+](=O)[O-])c1 ZINC000436402867 944278752 /nfs/dbraw/zinc/27/87/52/944278752.db2.gz CEEZTCAIUCJGJQ-UHFFFAOYSA-N 0 0 354.332 3.711 20 5 FHBDRN C[C@H](Cc1ccsc1)Nc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1 ZINC000518332577 944281353 /nfs/dbraw/zinc/28/13/53/944281353.db2.gz CMYASFNVYRYYJL-CYBMUJFWSA-N 0 0 359.451 3.935 20 5 FHBDRN C[C@H](NC(=O)NCc1cccc2c1CCCN2)c1ccc([N+](=O)[O-])cc1 ZINC000418233058 944281813 /nfs/dbraw/zinc/28/18/13/944281813.db2.gz NVBHJXTWLSYWAU-ZDUSSCGKSA-N 0 0 354.410 3.513 20 5 FHBDRN CC[C@H]1[C@H](C)CCN1C(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000426265047 944286155 /nfs/dbraw/zinc/28/61/55/944286155.db2.gz SQTPNDWSDAVJCV-YGRLFVJLSA-N 0 0 359.348 3.944 20 5 FHBDRN CCn1c(C)nc([N+](=O)[O-])c1N1C[C@@H](c2ccccc2Cl)OC[C@@H]1C ZINC000517424492 944286455 /nfs/dbraw/zinc/28/64/55/944286455.db2.gz HUKXLTPOBVKKLA-NHYWBVRUSA-N 0 0 364.833 3.739 20 5 FHBDRN Cc1nc2cc(CNC(=O)Nc3cccc([N+](=O)[O-])c3)ccc2n1C1CC1 ZINC000515870197 944286663 /nfs/dbraw/zinc/28/66/63/944286663.db2.gz UFLLBNYSAOKRSS-UHFFFAOYSA-N 0 0 365.393 3.910 20 5 FHBDRN CC(C)CCO[C@@H]1CCCC[C@H]1NC(=O)Cc1ccc([N+](=O)[O-])cc1F ZINC000438018904 944288382 /nfs/dbraw/zinc/28/83/82/944288382.db2.gz ZTCMHCKJFCMIRE-QZTJIDSGSA-N 0 0 366.433 3.767 20 5 FHBDRN COc1cc(CN(C)Cc2cnn(-c3ccccc3)c2)c([N+](=O)[O-])cc1F ZINC000184230757 944288485 /nfs/dbraw/zinc/28/84/85/944288485.db2.gz UQCFKRLYSGQWIS-UHFFFAOYSA-N 0 0 370.384 3.560 20 5 FHBDRN O=[N+]([O-])c1c(NCCc2cc(-c3ccncc3)n[nH]2)ccc2ncccc21 ZINC000436421701 944295036 /nfs/dbraw/zinc/29/50/36/944295036.db2.gz JQQQRMMPQLVAON-UHFFFAOYSA-N 0 0 360.377 3.583 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)F)cc1Oc1cccc(-n2ccnc2)c1 ZINC000436409405 944297594 /nfs/dbraw/zinc/29/75/94/944297594.db2.gz YQBBLVMSZLQYDF-UHFFFAOYSA-N 0 0 350.256 3.987 20 5 FHBDRN C[C@H]1CCCC[C@H]1Oc1ncc(I)cc1[N+](=O)[O-] ZINC001226126689 944298039 /nfs/dbraw/zinc/29/80/39/944298039.db2.gz AOWNDGAYEDRBDH-GZMMTYOYSA-N 0 0 362.167 3.552 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)N(C)c1nc2cccc(Cl)c2s1 ZINC000436411854 944300081 /nfs/dbraw/zinc/30/00/81/944300081.db2.gz QPYPAYPBYDHUES-UHFFFAOYSA-N 0 0 362.798 3.838 20 5 FHBDRN Cc1ccc(C(=O)NCc2ccc3c(c2)nc(C2CC2)n3C)cc1[N+](=O)[O-] ZINC000550161719 944304571 /nfs/dbraw/zinc/30/45/71/944304571.db2.gz UUXDSKLJYAKZSQ-UHFFFAOYSA-N 0 0 364.405 3.597 20 5 FHBDRN CSCC[C@H](NCc1ccc(C)c([N+](=O)[O-])c1)c1nnc2ccccn21 ZINC000123240416 944309267 /nfs/dbraw/zinc/30/92/67/944309267.db2.gz SULPNPYNOMUGIM-HNNXBMFYSA-N 0 0 371.466 3.530 20 5 FHBDRN COc1cc(CSCc2nc(C(C)(C)C)no2)c([N+](=O)[O-])cc1F ZINC000184039650 944316412 /nfs/dbraw/zinc/31/64/12/944316412.db2.gz MUKQQECIAPXYGB-UHFFFAOYSA-N 0 0 355.391 3.856 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2noc(CN3CCc4c(Cl)cccc4C3)n2)c1 ZINC000133870378 944322702 /nfs/dbraw/zinc/32/27/02/944322702.db2.gz GIQNWXSGWBYQQG-UHFFFAOYSA-N 0 0 370.796 3.857 20 5 FHBDRN Cc1ccc([C@@H](CNc2cc(C(=O)[O-])ccc2[N+](=O)[O-])[NH+]2CCCC2)cc1 ZINC000518381875 944333695 /nfs/dbraw/zinc/33/36/95/944333695.db2.gz ZUVYMUJDNLUQQS-LJQANCHMSA-N 0 0 369.421 3.850 20 5 FHBDRN COc1ccc(CSCC(=O)NCC2(C)CCCC2)cc1[N+](=O)[O-] ZINC000517482386 944338630 /nfs/dbraw/zinc/33/86/30/944338630.db2.gz NPGBHTVMISTRQS-UHFFFAOYSA-N 0 0 352.456 3.533 20 5 FHBDRN C[C@@H]1CC[C@H](N(C)C(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C1 ZINC000426281878 944340411 /nfs/dbraw/zinc/34/04/11/944340411.db2.gz PGTYNEXSCGJZGU-MFKMUULPSA-N 0 0 359.348 3.944 20 5 FHBDRN CNC(=O)c1ccc(Sc2nc(-c3ccc(F)cc3)c[nH]2)c([N+](=O)[O-])c1 ZINC000053552642 944342929 /nfs/dbraw/zinc/34/29/29/944342929.db2.gz HKBBKZHSBNWPQT-UHFFFAOYSA-N 0 0 372.381 3.635 20 5 FHBDRN Cc1nn([C@H](c2nc(-c3ccccc3)no2)c2ccccc2)cc1[N+](=O)[O-] ZINC000436474440 944354165 /nfs/dbraw/zinc/35/41/65/944354165.db2.gz OPXRJSAYUFKVNI-KRWDZBQOSA-N 0 0 361.361 3.787 20 5 FHBDRN COc1ccc2ccc(OC[C@H](O)COc3cccc([N+](=O)[O-])c3)cc2c1 ZINC000550178661 944354869 /nfs/dbraw/zinc/35/48/69/944354869.db2.gz LXPULRGTKQOISV-QGZVFWFLSA-N 0 0 369.373 3.575 20 5 FHBDRN Cc1csc(NC(=O)c2cc([N+](=O)[O-])cc(Br)c2C)n1 ZINC000550178244 944356856 /nfs/dbraw/zinc/35/68/56/944356856.db2.gz GFXRLMUGPQPQBW-UHFFFAOYSA-N 0 0 356.201 3.683 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N(C)Cc1ccc(Br)s1 ZINC000184261346 944358847 /nfs/dbraw/zinc/35/88/47/944358847.db2.gz FZSJWKLXRRXZIE-UHFFFAOYSA-N 0 0 369.240 3.999 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1OC[C@H](O)COCc1ccc(Cl)cc1 ZINC000550179401 944359265 /nfs/dbraw/zinc/35/92/65/944359265.db2.gz ZEMRJHXZEQTVBU-MRXNPFEDSA-N 0 0 351.786 3.513 20 5 FHBDRN Cc1ccc(NC(=O)N[C@@H](c2cccs2)C(C)(C)CO)cc1[N+](=O)[O-] ZINC000436492477 944360547 /nfs/dbraw/zinc/36/05/47/944360547.db2.gz ZZIXFVMASZUWKF-HNNXBMFYSA-N 0 0 363.439 3.846 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])c1c(Cl)nccc1C(F)(F)F ZINC000123464193 944364624 /nfs/dbraw/zinc/36/46/24/944364624.db2.gz UNIXZNLGJHJPLC-UHFFFAOYSA-N 0 0 359.691 3.592 20 5 FHBDRN Cc1c(F)ccc([N+](=O)[O-])c1C(=O)NC[C@]1(C)CCOC2(CCC2)C1 ZINC000894656632 944365910 /nfs/dbraw/zinc/36/59/10/944365910.db2.gz SRUFFLAFBIVGGT-QGZVFWFLSA-N 0 0 350.390 3.512 20 5 FHBDRN CCc1cc(NCc2ccnc(OC)c2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000053556350 944366958 /nfs/dbraw/zinc/36/69/58/944366958.db2.gz URDVBQULBDQEOI-UHFFFAOYSA-N 0 0 365.393 3.630 20 5 FHBDRN CNC(=O)c1ccc(Nc2ccc(NC(=O)CC(C)C)cc2)c([N+](=O)[O-])c1 ZINC000053556823 944368292 /nfs/dbraw/zinc/36/82/92/944368292.db2.gz CBYAVOQCBQVJES-UHFFFAOYSA-N 0 0 370.409 3.683 20 5 FHBDRN O=C(Cn1ccc([N+](=O)[O-])n1)Oc1ccc(-c2ccccc2)cc1Cl ZINC000123556953 944371518 /nfs/dbraw/zinc/37/15/18/944371518.db2.gz IDGXJIQBCYWWBC-UHFFFAOYSA-N 0 0 357.753 3.717 20 5 FHBDRN C[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)[C@@H]1Oc2ccccc2[C@@H]1C ZINC000438141601 944374605 /nfs/dbraw/zinc/37/46/05/944374605.db2.gz PYVHCNLONVGVPT-PSVSLLHZSA-N 0 0 360.797 3.931 20 5 FHBDRN Cc1sc(S(=O)(=O)N[C@H](c2ccccc2C)C2CC2)cc1[N+](=O)[O-] ZINC000467404013 944376955 /nfs/dbraw/zinc/37/69/55/944376955.db2.gz YCGUENKYSABDMU-INIZCTEOSA-N 0 0 366.464 3.703 20 5 FHBDRN CCOc1ccc(C(=O)N[C@H](C)[C@H]2Oc3ccccc3[C@@H]2C)cc1[N+](=O)[O-] ZINC000438147080 944378823 /nfs/dbraw/zinc/37/88/23/944378823.db2.gz XTYNAOGUENJBAH-QUJCMNEKSA-N 0 0 370.405 3.677 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCCCNc1ccccn1 ZINC000506494697 944380781 /nfs/dbraw/zinc/38/07/81/944380781.db2.gz MLTGUGAXOLYQKB-UHFFFAOYSA-N 0 0 374.466 3.724 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)N([C@@H](C)c2ccccc2)C2CCCC2)n1 ZINC000425574451 944383370 /nfs/dbraw/zinc/38/33/70/944383370.db2.gz BWMFURSFADBSMS-AWEZNQCLSA-N 0 0 356.426 3.957 20 5 FHBDRN Cc1cc(F)cc(C(=O)NC[C@]2(C)CCOC3(CCC3)C2)c1[N+](=O)[O-] ZINC000894661170 944383666 /nfs/dbraw/zinc/38/36/66/944383666.db2.gz BYZTZZUPBFFSCQ-QGZVFWFLSA-N 0 0 350.390 3.512 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N1CCc2ccc(O)cc2C1 ZINC000438172710 944385642 /nfs/dbraw/zinc/38/56/42/944385642.db2.gz ALVCBJBQVXVDIF-UHFFFAOYSA-N 0 0 366.295 3.518 20 5 FHBDRN CNC(=O)c1ccc(N[C@@H](C)c2ccccc2OC(C)C)c([N+](=O)[O-])c1 ZINC000053572433 944386748 /nfs/dbraw/zinc/38/67/48/944386748.db2.gz LQUMVTIOHCMURY-ZDUSSCGKSA-N 0 0 357.410 3.915 20 5 FHBDRN CNC(=O)c1ccc(N[C@H](C)c2ccc(OC(C)C)cc2)c([N+](=O)[O-])c1 ZINC000053572640 944387377 /nfs/dbraw/zinc/38/73/77/944387377.db2.gz IIEUISUPDJTEMO-CYBMUJFWSA-N 0 0 357.410 3.915 20 5 FHBDRN O=C(CC1CCCC1)N1CCCN(C/C=C/c2ccccc2[N+](=O)[O-])CC1 ZINC000506499133 944387883 /nfs/dbraw/zinc/38/78/83/944387883.db2.gz JMNQLOXXSZWWJB-BJMVGYQFSA-N 0 0 371.481 3.723 20 5 FHBDRN CC(C)(C)NC(=O)c1cccc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2)c1 ZINC000517557326 944388722 /nfs/dbraw/zinc/38/87/22/944388722.db2.gz BOPHCEYIEDJXID-UHFFFAOYSA-N 0 0 359.357 3.515 20 5 FHBDRN C[C@H](OC(=O)c1cc([N+](=O)[O-])ccc1Cl)c1cn(-c2ccccc2)nn1 ZINC000123624814 944389063 /nfs/dbraw/zinc/38/90/63/944389063.db2.gz JWZFOKCMCOOXGU-NSHDSACASA-N 0 0 372.768 3.747 20 5 FHBDRN C[C@]1(CNC(=O)c2cc([N+](=O)[O-])ccc2Cl)CCOC2(CCC2)C1 ZINC000894673704 944391584 /nfs/dbraw/zinc/39/15/84/944391584.db2.gz OZBGQUMZHSTRLD-INIZCTEOSA-N 0 0 352.818 3.717 20 5 FHBDRN COc1c(C)cc(S(=O)(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)cc1C ZINC000473768188 944394370 /nfs/dbraw/zinc/39/43/70/944394370.db2.gz WPPWTZWQHSDEDK-UHFFFAOYSA-N 0 0 364.423 3.638 20 5 FHBDRN CC(C)COC[C@@H](NC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1)c1ccco1 ZINC000518458400 944398135 /nfs/dbraw/zinc/39/81/35/944398135.db2.gz KLDXMAMSWZHUBP-RHSMWYFYSA-N 0 0 360.410 3.821 20 5 FHBDRN Cc1ccc([C@@H](C)Nc2c([N+](=O)[O-])cc(CO)c(C)c2[N+](=O)[O-])s1 ZINC000053582227 944400511 /nfs/dbraw/zinc/40/05/11/944400511.db2.gz WZNMKYYUGBKJSM-SNVBAGLBSA-N 0 0 351.384 3.847 20 5 FHBDRN O=[N+]([O-])c1ccn(CCN(Cc2ccccc2F)c2ccccc2F)n1 ZINC001167976959 944403975 /nfs/dbraw/zinc/40/39/75/944403975.db2.gz WICAQMHKQBGQCC-UHFFFAOYSA-N 0 0 358.348 3.776 20 5 FHBDRN CN(CCCOc1ccc(Cl)cc1)C(=O)c1cc(F)cc([N+](=O)[O-])c1 ZINC000517564647 944404776 /nfs/dbraw/zinc/40/47/76/944404776.db2.gz RXTAZMKDIFARIV-UHFFFAOYSA-N 0 0 366.776 3.928 20 5 FHBDRN CCc1cnc(CN(C)C(=O)c2c(C)cc(Cl)cc2[N+](=O)[O-])s1 ZINC000439169638 944407750 /nfs/dbraw/zinc/40/77/50/944407750.db2.gz REKOIZZSZCFCJZ-UHFFFAOYSA-N 0 0 353.831 3.848 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)Nc1ccc2c(c1)N(C)CCO2 ZINC000439171471 944408380 /nfs/dbraw/zinc/40/83/80/944408380.db2.gz VWKJMGPMRRMWDK-UHFFFAOYSA-N 0 0 361.785 3.638 20 5 FHBDRN CN(Cc1cccc([N+](=O)[O-])c1)[C@H]1c2cc(Cl)cc(Cl)c2C[C@H]1O ZINC000518474003 944413648 /nfs/dbraw/zinc/41/36/48/944413648.db2.gz QZVGDWRBCGVSRC-SJORKVTESA-N 0 0 367.232 3.992 20 5 FHBDRN CCOc1ccc(S(=O)(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)c(C)c1 ZINC000473771594 944419616 /nfs/dbraw/zinc/41/96/16/944419616.db2.gz DRBXGBSIFFRZGQ-UHFFFAOYSA-N 0 0 364.423 3.720 20 5 FHBDRN CO[C@@H]1Cc2ccccc2N(C(=O)c2cccc(SC)c2[N+](=O)[O-])C1 ZINC000500286685 944420621 /nfs/dbraw/zinc/42/06/21/944420621.db2.gz WFPXLQIYNIAIQU-CYBMUJFWSA-N 0 0 358.419 3.535 20 5 FHBDRN CSCc1cccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2C)c1 ZINC000517592839 944424543 /nfs/dbraw/zinc/42/45/43/944424543.db2.gz FGLBSRUKEDQAMF-UHFFFAOYSA-N 0 0 352.437 3.567 20 5 FHBDRN O=C(NCC(C1CC1)C1CC1)c1cccc([N+](=O)[O-])c1Br ZINC000159129733 944427767 /nfs/dbraw/zinc/42/77/67/944427767.db2.gz MSKFFJNJUGYKFP-UHFFFAOYSA-N 0 0 353.216 3.523 20 5 FHBDRN O=C(NCc1ccsc1Br)Nc1cccc([N+](=O)[O-])c1 ZINC000388541261 944432323 /nfs/dbraw/zinc/43/23/23/944432323.db2.gz WGGOWCCKMSXKEO-UHFFFAOYSA-N 0 0 356.201 3.741 20 5 FHBDRN CCCCOc1ccc(CCNC(=O)Cc2cccc([N+](=O)[O-])c2)cc1 ZINC000304093699 944434298 /nfs/dbraw/zinc/43/42/98/944434298.db2.gz XJSVRPXTQOSKIT-UHFFFAOYSA-N 0 0 356.422 3.675 20 5 FHBDRN Cc1ccc(S(=O)(=O)N2CC[C@@H](C)C[C@@H]2c2ccco2)c([N+](=O)[O-])c1 ZINC000439219479 944434693 /nfs/dbraw/zinc/43/46/93/944434693.db2.gz AEKVRJDLXLAMHC-ZIAGYGMSSA-N 0 0 364.423 3.658 20 5 FHBDRN C[C@H]1Sc2ccccc2N(S(=O)(=O)c2csc([N+](=O)[O-])c2)[C@H]1C ZINC000123857969 944439360 /nfs/dbraw/zinc/43/93/60/944439360.db2.gz GSXOAUUVLQUWDV-VHSXEESVSA-N 0 0 370.477 3.734 20 5 FHBDRN Cc1cc(C(=O)N[C@@H](C)c2cccc(OC(F)F)c2)ccc1[N+](=O)[O-] ZINC000046792116 944441036 /nfs/dbraw/zinc/44/10/36/944441036.db2.gz ROKGWOGTRWYMSW-NSHDSACASA-N 0 0 350.321 3.996 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NCC(=O)N(C)[C@@H]1CCCc2ccccc21 ZINC000500297764 944444599 /nfs/dbraw/zinc/44/45/99/944444599.db2.gz VGUKOZKIWSJTLG-LJQANCHMSA-N 0 0 353.422 3.851 20 5 FHBDRN Cc1cccc(-c2nnc([C@H](C)OC(=O)c3ccc([N+](=O)[O-])cc3)o2)c1 ZINC000017483993 944446763 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ZINC000516112640 944513306 /nfs/dbraw/zinc/51/33/06/944513306.db2.gz QYNQKMNCJQVEKR-UHFFFAOYSA-N 0 0 357.410 3.730 20 5 FHBDRN O=C(COc1c(Cl)cncc1[N+](=O)[O-])c1cccc(OC(F)F)c1 ZINC000506539411 944513669 /nfs/dbraw/zinc/51/36/69/944513669.db2.gz PXHZNPLZGFEJQU-UHFFFAOYSA-N 0 0 358.684 3.506 20 5 FHBDRN O=C(COc1c(Cl)cncc1[N+](=O)[O-])c1ccc(Br)cc1 ZINC000506540153 944516632 /nfs/dbraw/zinc/51/66/32/944516632.db2.gz SLBMZQMOPKGBPS-UHFFFAOYSA-N 0 0 371.574 3.667 20 5 FHBDRN CCOc1ccc(C(=O)Nc2cccc(-c3nccn3C)c2)cc1[N+](=O)[O-] ZINC000516134222 944522196 /nfs/dbraw/zinc/52/21/96/944522196.db2.gz DRTLNHQEJIROCH-UHFFFAOYSA-N 0 0 366.377 3.646 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N(C(CC)CC)C2CC2)cc1OC ZINC000516135232 944523245 /nfs/dbraw/zinc/52/32/45/944523245.db2.gz BEBJPIWQZAOESN-UHFFFAOYSA-N 0 0 350.415 3.795 20 5 FHBDRN CCOc1ccccc1CN(C)C(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000516135836 944523470 /nfs/dbraw/zinc/52/34/70/944523470.db2.gz ABSADBWCHIOGGS-UHFFFAOYSA-N 0 0 360.435 3.744 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H](n2cccn2)C1 ZINC000506209214 944526945 /nfs/dbraw/zinc/52/69/45/944526945.db2.gz UPHXYBMMKWKPQO-OAHLLOKOSA-N 0 0 374.466 3.771 20 5 FHBDRN Cc1nnc(-c2cccc(NC(=O)[C@H](C)c3ccc([N+](=O)[O-])cc3F)c2)o1 ZINC000184294104 944529950 /nfs/dbraw/zinc/52/99/50/944529950.db2.gz DXNOSMVUNPERHQ-SNVBAGLBSA-N 0 0 370.340 3.835 20 5 FHBDRN Cc1c(NC(=O)[C@@H](C)N2CC[C@@](F)(c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000516162279 944531894 /nfs/dbraw/zinc/53/18/94/944531894.db2.gz UJCVBOSOLNSBSW-QRWLVFNGSA-N 0 0 371.412 3.801 20 5 FHBDRN COc1cc(Oc2ccccc2)ccc1NC(=O)c1ccc([N+](=O)[O-])n1C ZINC000437911259 944534159 /nfs/dbraw/zinc/53/41/59/944534159.db2.gz NJPDGQINLJZFHK-UHFFFAOYSA-N 0 0 367.361 3.987 20 5 FHBDRN Cc1nc2c(s1)[C@H](N(C)C(=O)CCNc1ccccc1[N+](=O)[O-])CCC2 ZINC000110525894 944534596 /nfs/dbraw/zinc/53/45/96/944534596.db2.gz GJCYOBJBCLATKF-MRXNPFEDSA-N 0 0 374.466 3.698 20 5 FHBDRN CC(C)(C)c1cc(NC(=O)COc2ccc([N+](=O)[O-])cc2)n(C(C)(C)C)n1 ZINC000110558186 944541094 /nfs/dbraw/zinc/54/10/94/944541094.db2.gz LOHVICMEOCJTAO-UHFFFAOYSA-N 0 0 374.441 3.861 20 5 FHBDRN CCC(C)(C)[C@H]1CCCN1C(=O)c1nnn(-c2cccc([N+](=O)[O-])c2)c1C ZINC000133907055 944544810 /nfs/dbraw/zinc/54/48/10/944544810.db2.gz PMWCPLOQIHSBPH-MRXNPFEDSA-N 0 0 371.441 3.525 20 5 FHBDRN CCCN1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)CC1 ZINC000517738582 944550036 /nfs/dbraw/zinc/55/00/36/944550036.db2.gz UJNWJOOCLUKHRG-UHFFFAOYSA-N 0 0 369.421 3.555 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)COc2c(Cl)cncc2[N+](=O)[O-])cc1C ZINC000506553026 944550408 /nfs/dbraw/zinc/55/04/08/944550408.db2.gz RZLVPUDFEMKHNP-LBPRGKRZSA-N 0 0 363.801 3.516 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@@H]1CCc2sc(Cl)cc21 ZINC000518620388 944550523 /nfs/dbraw/zinc/55/05/23/944550523.db2.gz JANAZLGALSAEEN-LLVKDONJSA-N 0 0 372.855 3.584 20 5 FHBDRN CCc1ccc(CN(C(=O)c2cc(OC)ccc2[N+](=O)[O-])C2CC2)cc1 ZINC000518620091 944550585 /nfs/dbraw/zinc/55/05/85/944550585.db2.gz ZUBFPCUEONXAPP-UHFFFAOYSA-N 0 0 354.406 3.971 20 5 FHBDRN CCOc1cc(NC(=O)N(C)CCCSC)c([N+](=O)[O-])cc1OCC ZINC000439349682 944552135 /nfs/dbraw/zinc/55/21/35/944552135.db2.gz SYWOUCBPPSFPSO-UHFFFAOYSA-N 0 0 371.459 3.609 20 5 FHBDRN CCc1nn(C)c(N[C@@H](C)c2ccc(-n3nc(C)cc3C)cc2)c1[N+](=O)[O-] ZINC000092830737 944560442 /nfs/dbraw/zinc/56/04/42/944560442.db2.gz RXMQLHPQEHBZIU-AWEZNQCLSA-N 0 0 368.441 3.866 20 5 FHBDRN Cc1cc(NC(=O)c2cc([N+](=O)[O-])cn2C)ccc1Oc1cccnc1 ZINC000517753385 944565988 /nfs/dbraw/zinc/56/59/88/944565988.db2.gz TYLDZLQYYXJKCA-UHFFFAOYSA-N 0 0 352.350 3.681 20 5 FHBDRN COc1ccc(NC(=O)NCCSc2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000543891934 944570945 /nfs/dbraw/zinc/57/09/45/944570945.db2.gz BZXZJAZXBCBVAY-UHFFFAOYSA-N 0 0 361.423 3.826 20 5 FHBDRN CN(CCCOCc1ccccc1)C(=O)Nc1cc(F)cc([N+](=O)[O-])c1 ZINC000439401985 944581881 /nfs/dbraw/zinc/58/18/81/944581881.db2.gz JKISRQUTEKLLBS-UHFFFAOYSA-N 0 0 361.373 3.805 20 5 FHBDRN Cc1nc(-c2ccc(C(=O)OCc3ccc(Cl)c([N+](=O)[O-])c3)cc2)n[nH]1 ZINC000759857953 944585557 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CO[C@@H](C)CN(C(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1)C(C)C ZINC000444081344 945820055 /nfs/dbraw/zinc/82/00/55/945820055.db2.gz DKMQAQJSNDSYBT-AWEZNQCLSA-N 0 0 352.434 3.567 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)N2CCCC[C@H]2c2ccc(Cl)cc2)n1 ZINC000456376474 945822601 /nfs/dbraw/zinc/82/26/01/945822601.db2.gz KXQLLSFWWQXLNL-AWEZNQCLSA-N 0 0 362.817 3.832 20 5 FHBDRN Cn1cc(CCNC(=O)c2csc([N+](=O)[O-])c2)c2ccc(Cl)cc21 ZINC000440709952 945824826 /nfs/dbraw/zinc/82/48/26/945824826.db2.gz FEULWSBYDNCQOG-UHFFFAOYSA-N 0 0 363.826 3.774 20 5 FHBDRN CC(C)(CNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21)c1cccc(F)c1 ZINC000522793437 945827217 /nfs/dbraw/zinc/82/72/17/945827217.db2.gz LIZDZBYTEKVKSW-UHFFFAOYSA-N 0 0 369.396 3.783 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)Nc1ccccc1OC1CCCC1 ZINC000108000565 945844408 /nfs/dbraw/zinc/84/44/08/945844408.db2.gz ZUMMILLRAJQACW-UHFFFAOYSA-N 0 0 356.378 3.934 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])[nH]1)N(Cc1ccccc1)Cc1ccc(F)cc1 ZINC000519885759 945853771 /nfs/dbraw/zinc/85/37/71/945853771.db2.gz ATXQDSLIEWLLIN-UHFFFAOYSA-N 0 0 353.353 3.905 20 5 FHBDRN COCCN(C(=O)NCCc1ccc([N+](=O)[O-])cc1)[C@@H](C)c1ccccc1 ZINC000519889009 945859728 /nfs/dbraw/zinc/85/97/28/945859728.db2.gz RBPXAEFNFLZBTH-INIZCTEOSA-N 0 0 371.437 3.557 20 5 FHBDRN CC(C)[C@H]1CCC[C@@H](NC(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)CC1 ZINC000469493932 945860757 /nfs/dbraw/zinc/86/07/57/945860757.db2.gz MHVOOHJLDUCIRP-UONOGXRCSA-N 0 0 362.426 3.701 20 5 FHBDRN CC[C@H]1CN(c2cc(C(F)(F)C(F)(F)F)ncc2[N+](=O)[O-])CCCO1 ZINC000281841344 945878549 /nfs/dbraw/zinc/87/85/49/945878549.db2.gz LLWYNWOKBUXZNT-VIFPVBQESA-N 0 0 369.290 3.649 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)Nc1cc(C)ccc1Br ZINC000121223115 945882795 /nfs/dbraw/zinc/88/27/95/945882795.db2.gz OXNGVNWPTGWHJG-UHFFFAOYSA-N 0 0 365.183 3.927 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1nnc(Cc2ccccc2F)s1 ZINC000108208713 945889353 /nfs/dbraw/zinc/88/93/53/945889353.db2.gz INSVPKULIYHPOB-UHFFFAOYSA-N 0 0 372.381 3.737 20 5 FHBDRN Cc1cc(C(=O)Nc2nnc(Cc3ccccc3F)s2)ccc1[N+](=O)[O-] ZINC000108209655 945889567 /nfs/dbraw/zinc/88/95/67/945889567.db2.gz CDGRMPFSRJWWBM-UHFFFAOYSA-N 0 0 372.381 3.737 20 5 FHBDRN CC(=O)c1ccc(N2CCC[C@@H](c3ncc4n3CCCC4)C2)c([N+](=O)[O-])c1 ZINC000281864024 945892419 /nfs/dbraw/zinc/89/24/19/945892419.db2.gz KJPNNEISBUGHHF-MRXNPFEDSA-N 0 0 368.437 3.714 20 5 FHBDRN Cn1nc(CC(C)(C)C)cc1NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000108247395 945897750 /nfs/dbraw/zinc/89/77/50/945897750.db2.gz ABYAUGIRIUUYBT-UHFFFAOYSA-N 0 0 371.441 3.744 20 5 FHBDRN Cc1ccc(Cc2nnc(NC(=O)c3ccc(C)c([N+](=O)[O-])c3)s2)cc1 ZINC000108248869 945897878 /nfs/dbraw/zinc/89/78/78/945897878.db2.gz GJRAOVBFWXHOKH-UHFFFAOYSA-N 0 0 368.418 3.906 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N1CCC2(CC1)OCCc1ccsc12 ZINC000487478757 945904873 /nfs/dbraw/zinc/90/48/73/945904873.db2.gz XCNWKDUFMZMXRX-UHFFFAOYSA-N 0 0 372.446 3.669 20 5 FHBDRN CCCN(C(=O)c1ccc(N(C)C(C)=O)cc1)c1cccc([N+](=O)[O-])c1 ZINC000281892422 945905797 /nfs/dbraw/zinc/90/57/97/945905797.db2.gz RBPOVYDDXUMMCX-UHFFFAOYSA-N 0 0 355.394 3.634 20 5 FHBDRN COc1cc2c(cc1Cl)CN(Cc1ccc(OC)c([N+](=O)[O-])c1)CC2 ZINC000550112282 945907448 /nfs/dbraw/zinc/90/74/48/945907448.db2.gz DGQLUGKAUFEQFA-UHFFFAOYSA-N 0 0 362.813 3.824 20 5 FHBDRN Cc1ccccc1OCCCN(C)[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000108255921 945909278 /nfs/dbraw/zinc/90/92/78/945909278.db2.gz ASSPELJSLZOAGK-INIZCTEOSA-N 0 0 371.437 3.631 20 5 FHBDRN COc1ccc(Br)c(CNCc2cccc([N+](=O)[O-])c2)c1 ZINC000111158677 945926223 /nfs/dbraw/zinc/92/62/23/945926223.db2.gz FAWWSUWNSANATK-UHFFFAOYSA-N 0 0 351.200 3.656 20 5 FHBDRN COc1ccc(S[C@@H](C)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])cc1 ZINC000018543841 945930491 /nfs/dbraw/zinc/93/04/91/945930491.db2.gz YNGPTIYTOXONDS-NSHDSACASA-N 0 0 362.407 3.731 20 5 FHBDRN COC(=O)c1cc(COc2ccc([N+](=O)[O-])cc2C(F)(F)F)c(C)o1 ZINC000519939399 945932276 /nfs/dbraw/zinc/93/22/76/945932276.db2.gz ZALTYQJIEGCSPB-UHFFFAOYSA-N 0 0 359.256 3.881 20 5 FHBDRN Cc1c(NC(=O)N2CC(OCCCc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000473686209 945945587 /nfs/dbraw/zinc/94/55/87/945945587.db2.gz MVUAVMKUIAESQB-UHFFFAOYSA-N 0 0 369.421 3.769 20 5 FHBDRN COc1ccc([C@@H](NC(=O)NCc2ccccc2[N+](=O)[O-])C(C)C)cc1 ZINC000045148910 945946456 /nfs/dbraw/zinc/94/64/56/945946456.db2.gz LQIGZMDHAANPRO-SFHVURJKSA-N 0 0 357.410 3.800 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC(OC(C)(C)C)CC1 ZINC000281936929 945949641 /nfs/dbraw/zinc/94/96/41/945949641.db2.gz LCEJVZXMACIVRC-UHFFFAOYSA-N 0 0 365.430 3.805 20 5 FHBDRN COc1cc(CN2CCC[C@H](c3nccs3)C2)c([N+](=O)[O-])cc1F ZINC000184193546 945954310 /nfs/dbraw/zinc/95/43/10/945954310.db2.gz ZLNWSOPDRGKEGA-NSHDSACASA-N 0 0 351.403 3.579 20 5 FHBDRN C[C@H]1CCN(c2cc(-c3nc(-c4cccc([N+](=O)[O-])c4)no3)ccn2)C1 ZINC000545525510 945954473 /nfs/dbraw/zinc/95/44/73/945954473.db2.gz RLCGYVXFRRUKTG-LBPRGKRZSA-N 0 0 351.366 3.553 20 5 FHBDRN Cc1cc(NC(=O)NCCCCC(=O)OC(C)(C)C)ccc1[N+](=O)[O-] ZINC000613779218 945958732 /nfs/dbraw/zinc/95/87/32/945958732.db2.gz UZZNSOUAIVJCML-UHFFFAOYSA-N 0 0 351.403 3.537 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)Nc1ccccc1-n1ccnc1 ZINC000108411201 945959756 /nfs/dbraw/zinc/95/97/56/945959756.db2.gz QLHIHIANHYELFU-UHFFFAOYSA-N 0 0 365.393 3.611 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1N1CCC(n2ccc(C(F)(F)F)n2)CC1 ZINC000302011978 945961478 /nfs/dbraw/zinc/96/14/78/945961478.db2.gz AVZZYNAKJBJCIR-UHFFFAOYSA-N 0 0 354.332 3.960 20 5 FHBDRN COc1cc(OC)c(-c2noc(-c3cc(C)cc([N+](=O)[O-])c3)n2)cc1OC ZINC000546248975 945983290 /nfs/dbraw/zinc/98/32/90/945983290.db2.gz BMEJZRDKRQSWAO-UHFFFAOYSA-N 0 0 371.349 3.646 20 5 FHBDRN CCOc1cc(NC(=O)N[C@@H]2CC[C@H](C)C2)c([N+](=O)[O-])cc1OCC ZINC000444148679 945994212 /nfs/dbraw/zinc/99/42/12/945994212.db2.gz QIGBUOZMIGGWRV-NWDGAFQWSA-N 0 0 351.403 3.702 20 5 FHBDRN Cc1nn(C)c(C)c1C[C@@H](C)c1nc(Cc2cccc([N+](=O)[O-])c2C)no1 ZINC000546491774 946008086 /nfs/dbraw/zinc/00/80/86/946008086.db2.gz LCCNHHLDRUNBEI-LLVKDONJSA-N 0 0 369.425 3.574 20 5 FHBDRN COc1ccc([C@@H](NC(=O)N(C)Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000045317191 946008215 /nfs/dbraw/zinc/00/82/15/946008215.db2.gz XELKOHNFIJCHIF-IBGZPJMESA-N 0 0 369.421 3.896 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)NC2CC3(C2)COC(C)(C)C3)cc1[N+](=O)[O-] ZINC000893452515 946016392 /nfs/dbraw/zinc/01/63/92/946016392.db2.gz LQLDQUNVIIFCHR-XIWWETDGSA-N 0 0 361.442 3.611 20 5 FHBDRN CC(=O)c1cccc(NC(=O)[C@H](C)Oc2ccc([N+](=O)[O-])c(Cl)c2)c1 ZINC000127160314 946021462 /nfs/dbraw/zinc/02/14/62/946021462.db2.gz GDYAADNJKSVVFQ-NSHDSACASA-N 0 0 362.769 3.857 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CCn2c(C(C)C)nnc2[C@H]1C ZINC000190266305 946023704 /nfs/dbraw/zinc/02/37/04/946023704.db2.gz XTVLPZATWDGBMY-CYBMUJFWSA-N 0 0 372.429 3.535 20 5 FHBDRN CC1(C)CN(c2c3cc(Br)ccc3ncc2[N+](=O)[O-])CCO1 ZINC000408168837 946028881 /nfs/dbraw/zinc/02/88/81/946028881.db2.gz MGBNGFPWWLSGRQ-UHFFFAOYSA-N 0 0 366.215 3.521 20 5 FHBDRN COc1cccc(OCC(=O)N(c2cccc([N+](=O)[O-])c2)C2CCCC2)c1 ZINC000522873366 946038089 /nfs/dbraw/zinc/03/80/89/946038089.db2.gz YGEIPLMHZAHUCG-UHFFFAOYSA-N 0 0 370.405 3.958 20 5 FHBDRN CC[C@@H](c1ccncc1)N(C)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186004992 946039126 /nfs/dbraw/zinc/03/91/26/946039126.db2.gz XXDCHRPOPFGPLV-INIZCTEOSA-N 0 0 362.817 3.936 20 5 FHBDRN CCN(CC)[C@H](C(=O)OCc1ccc([N+](=O)[O-])c(F)c1)c1ccccc1 ZINC000783586794 946040684 /nfs/dbraw/zinc/04/06/84/946040684.db2.gz MXYYOMZVDAGOSY-SFHVURJKSA-N 0 0 360.385 3.860 20 5 FHBDRN CO[C@H](c1ccc(Cl)cc1)[C@H](C)NC(=O)c1cc(F)cc([N+](=O)[O-])c1 ZINC000522887723 946056262 /nfs/dbraw/zinc/05/62/62/946056262.db2.gz HZRCXBMQRWPZTE-QFYYESIMSA-N 0 0 366.776 3.893 20 5 FHBDRN O=[N+]([O-])c1cccc(F)c1N1CC[C@H](c2nccc(C(F)(F)F)n2)C1 ZINC000896907777 946059554 /nfs/dbraw/zinc/05/95/54/946059554.db2.gz WOQUWPXCJJQTPC-VIFPVBQESA-N 0 0 356.279 3.537 20 5 FHBDRN CCN(C(=O)c1ccc(OC)c([N+](=O)[O-])c1)[C@@H](C)c1cccc(OC)c1 ZINC000045506805 946062228 /nfs/dbraw/zinc/06/22/28/946062228.db2.gz LSADZIUZBKCXHE-ZDUSSCGKSA-N 0 0 358.394 3.835 20 5 FHBDRN CC1(C)C[C@H](NC(=O)c2cccc3c(=O)c4cccc(F)c4[nH]c23)CCO1 ZINC000444233776 946098556 /nfs/dbraw/zinc/09/85/56/946098556.db2.gz BSFIOYHKXCDDPH-GFCCVEGCSA-N 0 0 368.408 3.508 20 5 FHBDRN CCN(Cc1ccccn1)C(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000444231447 946101020 /nfs/dbraw/zinc/10/10/20/946101020.db2.gz FFQGDWPDDNONCE-UHFFFAOYSA-N 0 0 357.413 3.739 20 5 FHBDRN Cc1ncc(NC(=O)c2cc(F)cc3c(=O)c4cccc(F)c4[nH]c23)s1 ZINC000444235017 946107736 /nfs/dbraw/zinc/10/77/36/946107736.db2.gz FJEVAVARVOPPBC-UHFFFAOYSA-N 0 0 371.368 3.977 20 5 FHBDRN Cc1[nH]nc(C(=O)Nc2nc(-c3ccc(C)cc3)c(C)s2)c1[N+](=O)[O-] ZINC000522924346 946108556 /nfs/dbraw/zinc/10/85/56/946108556.db2.gz XVAMDVJTQFSYQQ-UHFFFAOYSA-N 0 0 357.395 3.619 20 5 FHBDRN Cc1nc(NC(=O)c2cccc3c(=O)c4cccc(F)c4[nH]c23)cs1 ZINC000444236231 946108581 /nfs/dbraw/zinc/10/85/81/946108581.db2.gz IIQXOOIRYPNCFP-UHFFFAOYSA-N 0 0 353.378 3.838 20 5 FHBDRN CC(C)n1cc2cc(NC(=O)c3cc4c(cc3[N+](=O)[O-])OCO4)ccc2n1 ZINC000522924552 946108667 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FHBDRN O=C(Nc1ccc(Nc2ncccn2)cc1)c1ccc(F)cc1[N+](=O)[O-] ZINC000444419460 946464767 /nfs/dbraw/zinc/46/47/67/946464767.db2.gz ONBAZGJBZYITPX-UHFFFAOYSA-N 0 0 353.313 3.520 20 5 FHBDRN CC[C@@H](C)[C@@H]1CCCCN1C(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000523094687 946467659 /nfs/dbraw/zinc/46/76/59/946467659.db2.gz WGARMUZGXRWTEA-KDOFPFPSSA-N 0 0 356.426 3.821 20 5 FHBDRN CCOCc1ccc(CNC(=O)c2cccc(SC)c2[N+](=O)[O-])cc1 ZINC000186114969 946484449 /nfs/dbraw/zinc/48/44/49/946484449.db2.gz NTOYEULFQTWUSP-UHFFFAOYSA-N 0 0 360.435 3.783 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)Nc1cnn(Cc2ccccc2)c1 ZINC000048050858 946485242 /nfs/dbraw/zinc/48/52/42/946485242.db2.gz VAZCXEAUUSEXJL-UHFFFAOYSA-N 0 0 351.366 3.792 20 5 FHBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc2c(n1)CCC2 ZINC000456637912 946500139 /nfs/dbraw/zinc/50/01/39/946500139.db2.gz IIGKTBOSTPQHHC-SNVBAGLBSA-N 0 0 361.785 3.538 20 5 FHBDRN C[C@@H](NC(=O)C[C@H]1CCc2sccc2C1=O)c1ccccc1[N+](=O)[O-] ZINC000897307073 946502062 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C[C@H](CNC(=O)N1CCC[C@@H]1c1ccccn1)c1ccccc1[N+](=O)[O-] ZINC000897072225 946570122 /nfs/dbraw/zinc/57/01/22/946570122.db2.gz XIPAKRIULDBBCL-RDTXWAMCSA-N 0 0 354.410 3.640 20 5 FHBDRN COc1c(C(=O)NCc2cc(C)cc3c(C)c(C)[nH]c32)cccc1[N+](=O)[O-] ZINC000475182810 946574058 /nfs/dbraw/zinc/57/40/58/946574058.db2.gz LVNQYZQJGDKWFW-UHFFFAOYSA-N 0 0 367.405 3.940 20 5 FHBDRN Cc1nn(Cc2ccc(-c3nc([C@H]4C[C@H]4C)no3)cc2)c(C)c1[N+](=O)[O-] ZINC000545767736 946585183 /nfs/dbraw/zinc/58/51/83/946585183.db2.gz JDRBIINEBGSRPX-BMIGLBTASA-N 0 0 353.382 3.630 20 5 FHBDRN CCc1ccc([C@@H](COC)NC(=O)c2cccc(SC)c2[N+](=O)[O-])o1 ZINC000186576666 946586075 /nfs/dbraw/zinc/58/60/75/946586075.db2.gz BUVFPUVTNSNSAQ-CYBMUJFWSA-N 0 0 364.423 3.590 20 5 FHBDRN Cc1cc(C(=O)N2CCO[C@H](c3cccc(Cl)c3)C2)cc([N+](=O)[O-])c1 ZINC000186187872 946588030 /nfs/dbraw/zinc/58/80/30/946588030.db2.gz AIQYNQBDNQKRNM-KRWDZBQOSA-N 0 0 360.797 3.770 20 5 FHBDRN COc1cc(Cc2noc(CCc3ccc(F)cc3)n2)ccc1[N+](=O)[O-] ZINC000545765872 946589103 /nfs/dbraw/zinc/58/91/03/946589103.db2.gz BIUXXIDWKUDURJ-UHFFFAOYSA-N 0 0 357.341 3.502 20 5 FHBDRN COc1c(C(=O)Nc2ccc(C)c(OCC(F)F)c2)cccc1[N+](=O)[O-] ZINC000475528160 946589825 /nfs/dbraw/zinc/58/98/25/946589825.db2.gz OONGBDJYULRBSE-UHFFFAOYSA-N 0 0 366.320 3.808 20 5 FHBDRN O=C(NCc1ccc(-n2ccnc2)c(F)c1)c1cc([N+](=O)[O-])ccc1Cl ZINC000067523209 946593171 /nfs/dbraw/zinc/59/31/71/946593171.db2.gz OWECBQSJPRALSP-UHFFFAOYSA-N 0 0 374.759 3.503 20 5 FHBDRN CC(C)[C@@H]1CN(C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CCO1 ZINC000475189819 946596859 /nfs/dbraw/zinc/59/68/59/946596859.db2.gz LGMCFINAZFPYQW-ZDUSSCGKSA-N 0 0 361.320 3.502 20 5 FHBDRN C[C@@H]1CC[C@H](NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)[C@H](C)C1 ZINC001126139348 946597352 /nfs/dbraw/zinc/59/73/52/946597352.db2.gz OUSCPGLMKCVUIT-RULNRJAQSA-N 0 0 355.232 3.912 20 5 FHBDRN CCOc1cc(CNC(=O)c2ccc([N+](=O)[O-])cc2Cl)ccc1OC ZINC000074629083 946614320 /nfs/dbraw/zinc/61/43/20/946614320.db2.gz RMAHBNZDPVXSOW-UHFFFAOYSA-N 0 0 364.785 3.586 20 5 FHBDRN O=[N+]([O-])c1ccc(Cc2noc(/C=C\c3ccc(OC(F)F)cc3)n2)nc1 ZINC000545783265 946615011 /nfs/dbraw/zinc/61/50/11/946615011.db2.gz GXTAZGCQYFNAKJ-BAQGIRSFSA-N 0 0 374.303 3.735 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@H](Oc3cccc(Cl)c3)C2)c1 ZINC000536263520 946615836 /nfs/dbraw/zinc/61/58/36/946615836.db2.gz LQQJADYGXLYHNW-HNNXBMFYSA-N 0 0 360.797 3.850 20 5 FHBDRN C[C@@H](Cc1cccc(Cl)c1)c1nc(Cc2ccc([N+](=O)[O-])cn2)no1 ZINC000545778632 946617045 /nfs/dbraw/zinc/61/70/45/946617045.db2.gz CMDKLTAJMAPGMM-NSHDSACASA-N 0 0 358.785 3.963 20 5 FHBDRN CC(C)Cn1cnnc1[C@H]1CCCN1C/C=C/c1ccccc1[N+](=O)[O-] ZINC000093477689 946629262 /nfs/dbraw/zinc/62/92/62/946629262.db2.gz SHIRZMUEKDGLDQ-KRZKXXONSA-N 0 0 355.442 3.693 20 5 FHBDRN Cc1ccc(C(=O)N2CCO[C@@H](c3cccc(Cl)c3)C2)cc1[N+](=O)[O-] ZINC000186249125 946645436 /nfs/dbraw/zinc/64/54/36/946645436.db2.gz KYDHHCOMAYNMID-QGZVFWFLSA-N 0 0 360.797 3.770 20 5 FHBDRN Cc1ccc(C)c([C@H]2CCCN2C(=O)COc2ccc([N+](=O)[O-])cc2)c1 ZINC000475559981 946648027 /nfs/dbraw/zinc/64/80/27/946648027.db2.gz MEVDMADXIIUWFG-LJQANCHMSA-N 0 0 354.406 3.954 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N(C)c1nc2ccccc2o1 ZINC000121391356 946651668 /nfs/dbraw/zinc/65/16/68/946651668.db2.gz WXOQJUOFSXBRGS-NSHDSACASA-N 0 0 357.391 3.880 20 5 FHBDRN COc1cc(Nc2ccc3ncccc3c2[N+](=O)[O-])cc(OC)c1OC ZINC000112072359 946655943 /nfs/dbraw/zinc/65/59/43/946655943.db2.gz OONMAHQZMZOICP-UHFFFAOYSA-N 0 0 355.350 3.912 20 5 FHBDRN COc1ccc2c(c1)CCC[C@@H]2c1noc(-c2cc([N+](=O)[O-])cnc2C)n1 ZINC000545838343 946656360 /nfs/dbraw/zinc/65/63/60/946656360.db2.gz ZFTPOOLOOQLERW-INIZCTEOSA-N 0 0 366.377 3.825 20 5 FHBDRN Cc1sc(C(=O)N2C[C@@H](C)O[C@@H](c3ccc(F)cc3)C2)cc1[N+](=O)[O-] ZINC000151932776 946657832 /nfs/dbraw/zinc/65/78/32/946657832.db2.gz NHVYDTKLKMHIEM-MEBBXXQBSA-N 0 0 364.398 3.706 20 5 FHBDRN Cc1nn(C)c(C(=O)Nc2ccc3c(c2)C(C)(C)CC3(C)C)c1[N+](=O)[O-] ZINC000536266868 946659102 /nfs/dbraw/zinc/65/91/02/946659102.db2.gz VVJCMNDWCIESQO-UHFFFAOYSA-N 0 0 356.426 3.848 20 5 FHBDRN Cc1ccc(NCCCNC(=O)N(C)[C@@H](C)c2ccncc2)c([N+](=O)[O-])c1 ZINC000121399090 946660430 /nfs/dbraw/zinc/66/04/30/946660430.db2.gz JCCXMTYPPOPDIC-HNNXBMFYSA-N 0 0 371.441 3.503 20 5 FHBDRN CCOC1(CNC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)CCCC1 ZINC000458863704 946664793 /nfs/dbraw/zinc/66/47/93/946664793.db2.gz YBRFZLRLLWFSLN-UHFFFAOYSA-N 0 0 361.442 3.618 20 5 FHBDRN O=C(N[C@H]1CCCc2occc21)c1ccc([N+](=O)[O-])cc1Br ZINC000151944395 946670107 /nfs/dbraw/zinc/67/01/07/946670107.db2.gz YVEVXXMFSYIIHJ-ZDUSSCGKSA-N 0 0 365.183 3.758 20 5 FHBDRN O=C(N[C@@H]1CCCc2occc21)c1ccc([N+](=O)[O-])cc1Br ZINC000151944321 946672509 /nfs/dbraw/zinc/67/25/09/946672509.db2.gz YVEVXXMFSYIIHJ-CYBMUJFWSA-N 0 0 365.183 3.758 20 5 FHBDRN CCO[C@@H]1C[C@@H](NC(=O)C2(c3ccc([N+](=O)[O-])cc3)CCC2)C12CCCC2 ZINC001126607372 946676795 /nfs/dbraw/zinc/67/67/95/946676795.db2.gz UEXZAUUDFCIIGG-QZTJIDSGSA-N 0 0 372.465 3.871 20 5 FHBDRN O=[N+]([O-])c1cnc([N-]c2cnn(-c3ccc(Cl)cc3Cl)c2)nc1 ZINC000473921035 946677725 /nfs/dbraw/zinc/67/77/25/946677725.db2.gz UKSGIORVNAASMD-UHFFFAOYSA-N 0 0 351.153 3.621 20 5 FHBDRN CN(C(=O)CN1CCCSc2ccccc21)c1ccc([N+](=O)[O-])cc1 ZINC000121420278 946680456 /nfs/dbraw/zinc/68/04/56/946680456.db2.gz VRDYLAVFMLFPBW-UHFFFAOYSA-N 0 0 357.435 3.560 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NCc1ccnc(OC2CCC2)c1 ZINC000475569864 946689591 /nfs/dbraw/zinc/68/95/91/946689591.db2.gz XKCPLGZNDGGRMP-UHFFFAOYSA-N 0 0 370.409 3.860 20 5 FHBDRN O=C(c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1)N1CCSCC1 ZINC000487497230 946690872 /nfs/dbraw/zinc/69/08/72/946690872.db2.gz ZCAOYCKULWATSP-UHFFFAOYSA-N 0 0 360.460 3.935 20 5 FHBDRN Cc1cccc(C(=O)Nc2cc(-c3cc(F)cc(F)c3)nn2C)c1[N+](=O)[O-] ZINC000487495949 946701783 /nfs/dbraw/zinc/70/17/83/946701783.db2.gz HDMDLZUGJYCJNP-UHFFFAOYSA-N 0 0 372.331 3.834 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)Nc2cccc(OC(F)(F)F)c2)c1 ZINC000067544568 946709080 /nfs/dbraw/zinc/70/90/80/946709080.db2.gz BMXJRTGYECFDNT-UHFFFAOYSA-N 0 0 356.256 3.754 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])Nc1ccc(F)cc1Br ZINC000048451392 946729546 /nfs/dbraw/zinc/72/95/46/946729546.db2.gz OZBXGNFWIRUCDL-UHFFFAOYSA-N 0 0 368.162 3.818 20 5 FHBDRN C[C@@H](c1cccc(Cl)c1)N(C)S(=O)(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000151971880 946729852 /nfs/dbraw/zinc/72/98/52/946729852.db2.gz IODYBIFRGMMJHO-LBPRGKRZSA-N 0 0 368.842 3.771 20 5 FHBDRN COc1cc(C(=O)N2CCC[C@@H](CC(C)C)C2)c([N+](=O)[O-])cc1OC ZINC000151971966 946730110 /nfs/dbraw/zinc/73/01/10/946730110.db2.gz GAWIICBWUNXNMB-ZDUSSCGKSA-N 0 0 350.415 3.510 20 5 FHBDRN COc1cc(C(=O)N2CCC[C@H](CC(C)C)C2)c([N+](=O)[O-])cc1OC ZINC000151972033 946730150 /nfs/dbraw/zinc/73/01/50/946730150.db2.gz GAWIICBWUNXNMB-CYBMUJFWSA-N 0 0 350.415 3.510 20 5 FHBDRN C[C@@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1)c1ncc(Br)cn1 ZINC000579261128 946754600 /nfs/dbraw/zinc/75/46/00/946754600.db2.gz ZQOUASLMVCGFIK-VHSXEESVSA-N 0 0 351.204 3.559 20 5 FHBDRN O=C(c1ncc(C(F)(F)F)cc1Cl)N1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001126611300 946768781 /nfs/dbraw/zinc/76/87/81/946768781.db2.gz IPBRLEKQOSYOJO-UHFFFAOYSA-N 0 0 371.702 3.818 20 5 FHBDRN COCCOc1ccc(C(=O)N(C)c2cccc([N+](=O)[O-])c2)c(Cl)c1 ZINC000186634831 946768962 /nfs/dbraw/zinc/76/89/62/946768962.db2.gz AUQKFSCJHHUNQC-UHFFFAOYSA-N 0 0 364.785 3.550 20 5 FHBDRN CCOCc1ccc(NC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)cc1 ZINC000440420994 946776234 /nfs/dbraw/zinc/77/62/34/946776234.db2.gz IQKTYINRSRSCEE-UHFFFAOYSA-N 0 0 367.361 3.637 20 5 FHBDRN CCCOc1ccc([C@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)cc1OC ZINC000048503103 946780269 /nfs/dbraw/zinc/78/02/69/946780269.db2.gz MKRIFEXFXAZEKK-ZDUSSCGKSA-N 0 0 358.394 3.883 20 5 FHBDRN C[C@@H](N[C@H](c1cnn(C)c1)c1ccc(F)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000186647518 946780946 /nfs/dbraw/zinc/78/09/46/946780946.db2.gz GZWUPFUERLATHP-YJYMSZOUSA-N 0 0 354.385 3.908 20 5 FHBDRN COc1ccc(C(=O)NCCc2ccc([N+](=O)[O-])cc2)c(OCC(C)C)c1 ZINC000475261506 946786355 /nfs/dbraw/zinc/78/63/55/946786355.db2.gz XOOUIRUOPSXVJZ-UHFFFAOYSA-N 0 0 372.421 3.611 20 5 FHBDRN CCOC(=O)c1ccnc(N(CC)Cc2ccccc2Cl)c1[N+](=O)[O-] ZINC000523114440 946798163 /nfs/dbraw/zinc/79/81/63/946798163.db2.gz IMJYFUWFBUYKMT-UHFFFAOYSA-N 0 0 363.801 3.846 20 5 FHBDRN COc1cc(C(=O)N[C@@H]2CC[C@H](C)C[C@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000112835020 946799613 /nfs/dbraw/zinc/79/96/13/946799613.db2.gz YEKDSEVZLDYRKF-HOSYDEDBSA-N 0 0 372.368 3.759 20 5 FHBDRN C[C@@H]1[C@H](C(F)(F)F)CCN1Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000475279853 946817370 /nfs/dbraw/zinc/81/73/70/946817370.db2.gz OQXSRJZHNBYDLE-LDYMZIIASA-N 0 0 354.275 3.969 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCc1ccc(-n2cccn2)cc1 ZINC000184480909 946833772 /nfs/dbraw/zinc/83/37/72/946833772.db2.gz KGEISWPRGOMPEK-UHFFFAOYSA-N 0 0 365.393 3.719 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@H]1SCCc2ccccc21 ZINC000186308702 946841351 /nfs/dbraw/zinc/84/13/51/946841351.db2.gz NTPMWIWBVBRWIO-INIZCTEOSA-N 0 0 362.838 3.895 20 5 FHBDRN CCc1ccc(CN(C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)cc1 ZINC000025916467 946843262 /nfs/dbraw/zinc/84/32/62/946843262.db2.gz KJHGMWQXQVICGY-UHFFFAOYSA-N 0 0 352.394 3.839 20 5 FHBDRN Cn1cc([N+](=O)[O-])cc1C(=O)Nc1ccc(-c2cnc(C3CC3)o2)cc1 ZINC000025934268 946904845 /nfs/dbraw/zinc/90/48/45/946904845.db2.gz LLWLGXRUEHBVQM-UHFFFAOYSA-N 0 0 352.350 3.718 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2nc(CN[C@H](CCO)c3ccco3)cs2)c1 ZINC000184500200 946908067 /nfs/dbraw/zinc/90/80/67/946908067.db2.gz ZEJZHJBMJOKPCM-OAHLLOKOSA-N 0 0 359.407 3.525 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1C[C@@]12CCc1ccccc12 ZINC000186327309 946923105 /nfs/dbraw/zinc/92/31/05/946923105.db2.gz GPECHDWADMMHBC-QFBILLFUSA-N 0 0 356.809 3.769 20 5 FHBDRN C[C@H](NC(=O)N1CCC[C@H](Nc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000458891217 946940854 /nfs/dbraw/zinc/94/08/54/946940854.db2.gz RJHFDNRPBWZNFY-YJBOKZPZSA-N 0 0 368.437 3.942 20 5 FHBDRN Cc1cc(S(=O)(=O)N2CCC(c3ccsc3)CC2)ccc1[N+](=O)[O-] ZINC000186335835 946948947 /nfs/dbraw/zinc/94/89/47/946948947.db2.gz MGAWBRMBIFGFNF-UHFFFAOYSA-N 0 0 366.464 3.533 20 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3.565 20 5 FHBDRN Cc1cccc([C@H](C)NC(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)c1C ZINC000444972802 947381609 /nfs/dbraw/zinc/38/16/09/947381609.db2.gz CZSJYPPDKYPDMO-ZDUSSCGKSA-N 0 0 367.409 3.648 20 5 FHBDRN O=C(Nc1ccc(-c2n[nH]c(C3CC3)n2)cc1)c1ccc([N+](=O)[O-])s1 ZINC000523574621 947384155 /nfs/dbraw/zinc/38/41/55/947384155.db2.gz WPQZTYYAVDEDDT-UHFFFAOYSA-N 0 0 355.379 3.571 20 5 FHBDRN C[C@@H](CC(=O)Nc1ccc2cc([N+](=O)[O-])ccc2n1)c1ccc(F)cc1 ZINC000440622819 947387918 /nfs/dbraw/zinc/38/79/18/947387918.db2.gz FLMYRUHKBQVKRN-LBPRGKRZSA-N 0 0 353.353 3.836 20 5 FHBDRN Cc1ccc([C@H]2[C@H](C)CCCN2C(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)cc1 ZINC000444997860 947392361 /nfs/dbraw/zinc/39/23/61/947392361.db2.gz QBGAEOCHRYKKEY-CXAGYDPISA-N 0 0 355.394 3.617 20 5 FHBDRN CO[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2SC(C)C)[C@H](C)C1 ZINC000441439793 947392657 /nfs/dbraw/zinc/39/26/57/947392657.db2.gz VCAZIRJNSCXSJP-OCCSQVGLSA-N 0 0 352.456 3.735 20 5 FHBDRN CC[C@H](NC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)c1nc(C)cs1 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367.405 3.674 20 5 FHBDRN CC[C@@H](CNC(=O)c1cc([N+](=O)[O-])cnc1C)Oc1cccc(Cl)c1 ZINC000440642589 947466990 /nfs/dbraw/zinc/46/69/90/947466990.db2.gz QNQMIDGBDFGFRQ-AWEZNQCLSA-N 0 0 363.801 3.539 20 5 FHBDRN O=C(CCc1cc(F)ccc1[N+](=O)[O-])N1CC[C@H](Cc2ccc(F)cc2)C1 ZINC001126205801 947472512 /nfs/dbraw/zinc/47/25/12/947472512.db2.gz FCCRGJLBXLAPAL-OAHLLOKOSA-N 0 0 374.387 3.897 20 5 FHBDRN Cc1ccccc1C[C@H](C)N(C)C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000445083757 947481052 /nfs/dbraw/zinc/48/10/52/947481052.db2.gz PFPFKUPPNMIQLB-INIZCTEOSA-N 0 0 355.438 3.718 20 5 FHBDRN O=C(CN1CCc2c1cc(F)cc2F)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000549583913 947491609 /nfs/dbraw/zinc/49/16/09/947491609.db2.gz DGINANCVOZSDFR-UHFFFAOYSA-N 0 0 367.739 3.528 20 5 FHBDRN CC1(C)CN(c2ncc([N+](=O)[O-])cc2Cl)C[C@]2(C[C@@H]3CC[C@H]2C3)O1 ZINC000440647336 947494257 /nfs/dbraw/zinc/49/42/57/947494257.db2.gz UUCFVUIECGYQJP-PEBVRCNWSA-N 0 0 351.834 3.817 20 5 FHBDRN CC(=O)c1cc(NC2CCN(c3ccc(C)cn3)CC2)ccc1[N+](=O)[O-] ZINC000367726648 947517061 /nfs/dbraw/zinc/51/70/61/947517061.db2.gz DABOOMWPHDISNR-UHFFFAOYSA-N 0 0 354.410 3.582 20 5 FHBDRN CCCN(C(=O)C[C@@H]1COc2cc(OC)ccc21)c1cccc([N+](=O)[O-])c1 ZINC000441457395 947530781 /nfs/dbraw/zinc/53/07/81/947530781.db2.gz NKCFIZIWPFTRIU-CQSZACIVSA-N 0 0 370.405 3.913 20 5 FHBDRN CCOC(=O)[C@@H](NCc1ccc([N+](=O)[O-])cc1C)c1cccc(C)c1C ZINC000428391412 947539916 /nfs/dbraw/zinc/53/99/16/947539916.db2.gz RCDBVAYGBWAIQJ-IBGZPJMESA-N 0 0 356.422 3.914 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@H](C)CCC1CCCCC1 ZINC000523734924 947555238 /nfs/dbraw/zinc/55/52/38/947555238.db2.gz PHXSLMWIVHMUER-CYBMUJFWSA-N 0 0 370.471 3.631 20 5 FHBDRN Cc1cnc(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])c(Br)c1 ZINC000162853706 947563334 /nfs/dbraw/zinc/56/33/34/947563334.db2.gz QRAFEWQZLKOOMG-UHFFFAOYSA-N 0 0 370.590 3.966 20 5 FHBDRN C[C@H]1C(=O)CC[C@H](C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)C1(C)C ZINC000440672867 947568541 /nfs/dbraw/zinc/56/85/41/947568541.db2.gz RCCUIDQXBFGRCU-GXFFZTMASA-N 0 0 352.818 3.506 20 5 FHBDRN CC(C)(C)OC(=O)[C@@H]1CCCN1C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000162865745 947569156 /nfs/dbraw/zinc/56/91/56/947569156.db2.gz XEIQGKFGJGHWIN-LBPRGKRZSA-N 0 0 369.805 3.586 20 5 FHBDRN Cc1cccc(C)c1NC(=O)[C@@H](C)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088606327 947570403 /nfs/dbraw/zinc/57/04/03/947570403.db2.gz SGOVMRIAZZNPBS-OAHLLOKOSA-N 0 0 353.422 3.597 20 5 FHBDRN COc1cc(CN(C)c2nccc(C)c2[N+](=O)[O-])ccc1OC(F)F ZINC000523755264 947572141 /nfs/dbraw/zinc/57/21/41/947572141.db2.gz FMASXMSUQJKNHZ-UHFFFAOYSA-N 0 0 353.325 3.545 20 5 FHBDRN COc1nc(C)nc(NCc2c(C)cc(Cl)cc2Cl)c1[N+](=O)[O-] ZINC001167792835 947579013 /nfs/dbraw/zinc/57/90/13/947579013.db2.gz OKGXGIHMZSHVRT-UHFFFAOYSA-N 0 0 357.197 3.929 20 5 FHBDRN O=[N+]([O-])c1cc(F)cc(-c2nc(CCn3ccc4ccccc43)no2)c1 ZINC000445190574 947580714 /nfs/dbraw/zinc/58/07/14/947580714.db2.gz JKESSFSZCLDMKH-UHFFFAOYSA-N 0 0 352.325 3.981 20 5 FHBDRN Cc1cccc([C@@H](C)NC(=O)NCCOc2ccc([N+](=O)[O-])cc2)c1C ZINC000523764309 947581875 /nfs/dbraw/zinc/58/18/75/947581875.db2.gz QVUGBVLIFBGGKC-OAHLLOKOSA-N 0 0 357.410 3.651 20 5 FHBDRN O=C(N[C@@H](C1CC1)C1CCC1)c1sc(Br)cc1[N+](=O)[O-] ZINC000457255890 947608468 /nfs/dbraw/zinc/60/84/68/947608468.db2.gz SJMWGYFLTVMTHL-LLVKDONJSA-N 0 0 359.245 3.727 20 5 FHBDRN CO[C@H]1CCN(C(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000441462829 947611412 /nfs/dbraw/zinc/61/14/12/947611412.db2.gz CNXWJOAOUZITDX-YOEHRIQHSA-N 0 0 369.421 3.978 20 5 FHBDRN C[C@@H]1CC(=O)CC[C@@H]1c1nc(Cc2c[nH]c3ccc([N+](=O)[O-])cc23)no1 ZINC000445232663 947612735 /nfs/dbraw/zinc/61/27/35/947612735.db2.gz BPGSJUKKMAHWKH-YGRLFVJLSA-N 0 0 354.366 3.523 20 5 FHBDRN CCCN(C(=O)c1ccc(Cn2cccn2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000441462494 947614239 /nfs/dbraw/zinc/61/42/39/947614239.db2.gz IJDQHVSPRSISQJ-UHFFFAOYSA-N 0 0 364.405 3.896 20 5 FHBDRN CCc1cccc2c1N(C(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-])CCC2 ZINC000120907846 947662183 /nfs/dbraw/zinc/66/21/83/947662183.db2.gz PUQDSBVCFZEGRF-UHFFFAOYSA-N 0 0 370.405 3.767 20 5 FHBDRN Cc1cccc(C)c1OCC(=O)O[C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000759936675 947674034 /nfs/dbraw/zinc/67/40/34/947674034.db2.gz FVURIXVSQWPZIJ-CVEARBPZSA-N 0 0 373.409 3.514 20 5 FHBDRN C[C@@H](CNC(=O)c1cc([N+](=O)[O-])cn1C)c1c(Cl)cccc1Cl ZINC000523857390 947688207 /nfs/dbraw/zinc/68/82/07/947688207.db2.gz LSZVQSMAPWLJLE-VIFPVBQESA-N 0 0 356.209 3.774 20 5 FHBDRN COc1ccccc1C[C@@H](C)CC(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000536355709 947689732 /nfs/dbraw/zinc/68/97/32/947689732.db2.gz SMYQCSKRRRUYEP-GFCCVEGCSA-N 0 0 368.393 3.687 20 5 FHBDRN CCCCSCCC(=O)O[C@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1 ZINC000759936167 947698103 /nfs/dbraw/zinc/69/81/03/947698103.db2.gz TURRAOUZCKLIOC-KBPBESRZSA-N 0 0 355.460 3.742 20 5 FHBDRN CO[C@](C)(CNC(=O)NC(C)(C)c1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000458990335 947700025 /nfs/dbraw/zinc/70/00/25/947700025.db2.gz SSSVDWDFCOZVSR-HXUWFJFHSA-N 0 0 371.437 3.691 20 5 FHBDRN C[S@@](=O)c1ccc(NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1 ZINC000137559827 947705088 /nfs/dbraw/zinc/70/50/88/947705088.db2.gz LZLWQVIKBDTMID-SANMLTNESA-N 0 0 373.434 3.529 20 5 FHBDRN Cc1cccc(NC(=O)Cc2noc(-c3ccc(Cl)cc3[N+](=O)[O-])n2)c1 ZINC000445313870 947718352 /nfs/dbraw/zinc/71/83/52/947718352.db2.gz VJWBLQYWDJYFML-UHFFFAOYSA-N 0 0 372.768 3.788 20 5 FHBDRN CC(C)Oc1ccc(N(C)C(=O)COc2ccc([N+](=O)[O-])c(F)c2)cc1 ZINC000759937833 947736777 /nfs/dbraw/zinc/73/67/77/947736777.db2.gz MILYFLYWKVBZKJ-UHFFFAOYSA-N 0 0 362.357 3.563 20 5 FHBDRN C[C@H](c1ccccc1)c1ccc(OC(=O)Cn2cc([N+](=O)[O-])cn2)cc1 ZINC000728850373 947737746 /nfs/dbraw/zinc/73/77/46/947737746.db2.gz OUXXWGHQUNRDGH-CQSZACIVSA-N 0 0 351.362 3.549 20 5 FHBDRN CSc1ccccc1NC(=O)[C@@H](C)OC(=O)c1c(C)cccc1[N+](=O)[O-] ZINC000026117308 947738880 /nfs/dbraw/zinc/73/88/80/947738880.db2.gz NGVGKOOVPMZNBJ-GFCCVEGCSA-N 0 0 374.418 3.809 20 5 FHBDRN Cc1ccc(C)c(CC(=O)O[C@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)c1 ZINC000759939615 947746669 /nfs/dbraw/zinc/74/66/69/947746669.db2.gz DIAZZYOAVLZELF-SJORKVTESA-N 0 0 357.410 3.678 20 5 FHBDRN Cc1nn(CCC(=O)Nc2cc(Cl)cc3cccnc32)c(C)c1[N+](=O)[O-] ZINC000523945321 947751391 /nfs/dbraw/zinc/75/13/91/947751391.db2.gz IGHHGLTWCIQSLH-UHFFFAOYSA-N 0 0 373.800 3.639 20 5 FHBDRN C[C@H]1c2ccsc2CCN1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000105034972 947775215 /nfs/dbraw/zinc/77/52/15/947775215.db2.gz AKONREIQOWPBGN-JTQLQIEISA-N 0 0 365.842 3.868 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])c(Cl)c1)N1CCOc2ccc(Cl)cc21 ZINC000159204699 947778456 /nfs/dbraw/zinc/77/84/56/947778456.db2.gz GKYOKVFAXTWIJV-UHFFFAOYSA-N 0 0 353.161 3.941 20 5 FHBDRN Nc1c(C(=O)N2CCc3ccccc3CC2)cc2ccccc2c1[N+](=O)[O-] ZINC001126231801 947785078 /nfs/dbraw/zinc/78/50/78/947785078.db2.gz NVQVQQBSSZDKAS-UHFFFAOYSA-N 0 0 361.401 3.571 20 5 FHBDRN CCOc1ccc(C(=O)NCc2ccc(C(F)F)cc2)cc1[N+](=O)[O-] ZINC000184596523 947785378 /nfs/dbraw/zinc/78/53/78/947785378.db2.gz SAVDDKSEJNGFNX-UHFFFAOYSA-N 0 0 350.321 3.861 20 5 FHBDRN COc1cccc([C@@H]2C[C@H]2NC(=O)N[C@@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000454766120 947789342 /nfs/dbraw/zinc/78/93/42/947789342.db2.gz RALPLLFTFOOWDP-AFAVFJNCSA-N 0 0 355.394 3.520 20 5 FHBDRN CCCN(C(=O)[C@H](C)Oc1ccc(OC)cc1)c1cccc([N+](=O)[O-])c1 ZINC000441475841 947814298 /nfs/dbraw/zinc/81/42/98/947814298.db2.gz JFXFJDNYLYURRW-AWEZNQCLSA-N 0 0 358.394 3.814 20 5 FHBDRN Cc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2nc[nH]n2)c(C)c1 ZINC000507757797 947832352 /nfs/dbraw/zinc/83/23/52/947832352.db2.gz KRJGIMPFOYHHPH-UHFFFAOYSA-N 0 0 369.406 3.733 20 5 FHBDRN C[C@H](NC(=O)N1CCCC[C@H]([C@@H]2CCOC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000895066839 947843533 /nfs/dbraw/zinc/84/35/33/947843533.db2.gz NUEONDNHHRJONI-BHYGNILZSA-N 0 0 361.442 3.504 20 5 FHBDRN COc1ccc(C(=O)NCc2cccc([N+](=O)[O-])c2)c(OC2CCCC2)c1 ZINC001126246587 947854963 /nfs/dbraw/zinc/85/49/63/947854963.db2.gz DJWVHBDONGPIHJ-UHFFFAOYSA-N 0 0 370.405 3.855 20 5 FHBDRN CC(=O)N(CC(=O)Nc1cc([N+](=O)[O-])c(Cl)cc1C)c1ccccc1 ZINC001126248830 947865659 /nfs/dbraw/zinc/86/56/59/947865659.db2.gz YCHPMCHADRUQHK-UHFFFAOYSA-N 0 0 361.785 3.548 20 5 FHBDRN C[C@@H](c1ccc(F)c(F)c1)N(C)C(=O)Cc1ccc([N+](=O)[O-])cc1F ZINC000125821117 947882318 /nfs/dbraw/zinc/88/23/18/947882318.db2.gz OXNWLEBNJUITBP-JTQLQIEISA-N 0 0 352.312 3.774 20 5 FHBDRN CCCN(C(=O)c1nnn(-c2ccccc2)c1C)c1cccc([N+](=O)[O-])c1 ZINC000441479156 947883192 /nfs/dbraw/zinc/88/31/92/947883192.db2.gz PWIVLIDUTGWZKQ-UHFFFAOYSA-N 0 0 365.393 3.541 20 5 FHBDRN C[C@@H](c1nccs1)N1CCN(Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000184616348 947902452 /nfs/dbraw/zinc/90/24/52/947902452.db2.gz ZXLMXBQHNCNPFJ-LBPRGKRZSA-N 0 0 366.874 3.584 20 5 FHBDRN C[C@@H](NC(=O)Cc1ccc(F)cc1[N+](=O)[O-])c1nc2ccccc2s1 ZINC001126259685 947902548 /nfs/dbraw/zinc/90/25/48/947902548.db2.gz MNEUOWYUKGACKT-SNVBAGLBSA-N 0 0 359.382 3.764 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCC[C@H]([C@@H]3CCOC3)C2)nc1-c1ccccc1 ZINC000536387302 947924190 /nfs/dbraw/zinc/92/41/90/947924190.db2.gz YLGOYUYTXWRJHP-DLBZAZTESA-N 0 0 353.422 3.910 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2nc(CN3CCc4ccc(O)cc4C3)co2)cc1 ZINC000535552619 947924776 /nfs/dbraw/zinc/92/47/76/947924776.db2.gz CIXCTAYOFBQFSN-UHFFFAOYSA-N 0 0 351.362 3.514 20 5 FHBDRN COC(=O)COc1ccc(NCc2csc([N+](=O)[O-])c2)c2ccccc12 ZINC000125825700 947939194 /nfs/dbraw/zinc/93/91/94/947939194.db2.gz SOCFQGYPWGVGJH-UHFFFAOYSA-N 0 0 372.402 3.973 20 5 FHBDRN O=C(Nc1cccc(C[NH+]2CCCCC2)c1)c1cccc([O-])c1[N+](=O)[O-] ZINC000280813133 947948995 /nfs/dbraw/zinc/94/89/95/947948995.db2.gz QVMAYQWKVYKCBU-UHFFFAOYSA-N 0 0 355.394 3.539 20 5 FHBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NC[C@@H]2CCCC[C@H]2c2ccccc2)cc1 ZINC001211864954 947950468 /nfs/dbraw/zinc/95/04/68/947950468.db2.gz CGEKDKQANRAMHO-LPHOPBHVSA-N 0 0 374.462 3.847 20 5 FHBDRN Cc1ccc(NC(=O)[C@@H]2CCCN(c3c(Cl)cccc3[N+](=O)[O-])C2)nc1 ZINC000432315254 947952997 /nfs/dbraw/zinc/95/29/97/947952997.db2.gz ZAHAFCRKHKBCDY-CYBMUJFWSA-N 0 0 374.828 3.807 20 5 FHBDRN COC(=O)CCC1CCN(c2ccc([N+](=O)[O-])c(-c3ccccc3)n2)CC1 ZINC000536389752 947955074 /nfs/dbraw/zinc/95/50/74/947955074.db2.gz DMUVGNSLCSITDZ-UHFFFAOYSA-N 0 0 369.421 3.826 20 5 FHBDRN Cc1cc(C(=O)OCc2ccc([N+](=O)[O-])cc2Br)oc1C ZINC001126271716 947960909 /nfs/dbraw/zinc/96/09/09/947960909.db2.gz WLLQKGXGGYKHPR-UHFFFAOYSA-N 0 0 354.156 3.924 20 5 FHBDRN O=C(NC[C@H]1CCCC1(F)F)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000459039608 947985770 /nfs/dbraw/zinc/98/57/70/947985770.db2.gz XQZAGXYIVRKMLM-CYBMUJFWSA-N 0 0 353.369 3.704 20 5 FHBDRN COC(=O)c1cc(NCc2ncccc2C(F)(F)F)c(C)c([N+](=O)[O-])c1 ZINC000432317904 947996255 /nfs/dbraw/zinc/99/62/55/947996255.db2.gz MYJPXJQDCWFBED-UHFFFAOYSA-N 0 0 369.299 3.716 20 5 FHBDRN CN(CCCOc1ccc(F)cc1)C(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000087104460 948019997 /nfs/dbraw/zinc/01/99/97/948019997.db2.gz OYAVFBUUBYUMCD-UHFFFAOYSA-N 0 0 360.385 3.594 20 5 FHBDRN O=C(Nc1ccc(Br)c([N+](=O)[O-])c1)c1ccnc(Cl)c1 ZINC000094188532 948043908 /nfs/dbraw/zinc/04/39/08/948043908.db2.gz WJVLIAGLBRFVDT-UHFFFAOYSA-N 0 0 356.563 3.658 20 5 FHBDRN 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CC(C)Oc1cc(O)ccc1NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000432459409 948482381 /nfs/dbraw/zinc/48/23/81/948482381.db2.gz JQFQBDKEJLCWIC-UHFFFAOYSA-N 0 0 369.377 3.750 20 5 FHBDRN COc1cc(CN(C)C(=O)c2ccc([N+](=O)[O-])cc2C)ccc1SC ZINC000512124154 948484586 /nfs/dbraw/zinc/48/45/86/948484586.db2.gz RWIAMLRCUCNNIZ-UHFFFAOYSA-N 0 0 360.435 3.906 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)NCc1c(F)cccc1Cl ZINC000512130646 948502518 /nfs/dbraw/zinc/50/25/18/948502518.db2.gz MEGZUUJWCMUBCN-UHFFFAOYSA-N 0 0 365.792 3.771 20 5 FHBDRN COCCCn1ccc(Nc2ccc([N+](=O)[O-])c(-c3ccccc3)n2)n1 ZINC000090095078 948520314 /nfs/dbraw/zinc/52/03/14/948520314.db2.gz DSOWLVDYNSWIRC-UHFFFAOYSA-N 0 0 353.382 3.633 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NCC(=O)Nc1ccnn1C1CCCC1 ZINC000574802633 948521302 /nfs/dbraw/zinc/52/13/02/948521302.db2.gz LEWJQRUBQDEGJB-UHFFFAOYSA-N 0 0 357.414 3.519 20 5 FHBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N1CCCSCC1 ZINC000136322839 948533494 /nfs/dbraw/zinc/53/34/94/948533494.db2.gz HSOWHBOKQPGJMV-UHFFFAOYSA-N 0 0 354.497 3.922 20 5 FHBDRN Cn1c(C(=O)N[C@H]2CCSc3ccc(Cl)cc32)ccc1[N+](=O)[O-] ZINC000520664224 948540344 /nfs/dbraw/zinc/54/03/44/948540344.db2.gz MFWMDZZXONGTPX-NSHDSACASA-N 0 0 351.815 3.554 20 5 FHBDRN Cc1ccc(C(=O)Nc2ccc(C(=O)NCC(C)C)cc2C)cc1[N+](=O)[O-] ZINC000050384096 948555704 /nfs/dbraw/zinc/55/57/04/948555704.db2.gz LAAIMBXVVDESHF-UHFFFAOYSA-N 0 0 369.421 3.850 20 5 FHBDRN CC(C)c1c(C(=O)OCc2cccc([N+](=O)[O-])c2)cnn1-c1ccccn1 ZINC000107538084 948565034 /nfs/dbraw/zinc/56/50/34/948565034.db2.gz PTQQGBLMTDXOOC-UHFFFAOYSA-N 0 0 366.377 3.656 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)Cc1cscc1Br ZINC000432488361 948566049 /nfs/dbraw/zinc/56/60/49/948566049.db2.gz DVGLOGFGHUILAB-UHFFFAOYSA-N 0 0 369.240 3.620 20 5 FHBDRN CCOC(=O)c1ccccc1N(C)C(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000520681085 948575262 /nfs/dbraw/zinc/57/52/62/948575262.db2.gz FAQWRLAAUIVUEV-UHFFFAOYSA-N 0 0 368.345 3.794 20 5 FHBDRN CC(C)n1c(-c2ccc([N+](=O)[O-])cc2)nnc1N1C[C@H](C)OC2(CCC2)C1 ZINC000571088783 948576849 /nfs/dbraw/zinc/57/68/49/948576849.db2.gz UAYRYJKXHYPTOC-AWEZNQCLSA-N 0 0 371.441 3.582 20 5 FHBDRN Cc1cccc(-c2nnc([C@@H](C)OC(=O)c3ccc([N+](=O)[O-])s3)o2)c1 ZINC000019296701 948599561 /nfs/dbraw/zinc/59/95/61/948599561.db2.gz TZRUBENIDHBLJO-SNVBAGLBSA-N 0 0 359.363 3.933 20 5 FHBDRN O=C(NCC1CCN(c2ccccc2)CC1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000279199467 948608123 /nfs/dbraw/zinc/60/81/23/948608123.db2.gz KUQRUQBAZJRWRH-UHFFFAOYSA-N 0 0 373.840 3.895 20 5 FHBDRN C[C@@H](NC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)[C@@H](C)c1ccccc1 ZINC000087132249 948610332 /nfs/dbraw/zinc/61/03/32/948610332.db2.gz IGPDYCPPUFAYSF-HUUCEWRRSA-N 0 0 353.422 3.855 20 5 FHBDRN CC(C)[C@@]1(CO)CCCN(Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000550433268 948614736 /nfs/dbraw/zinc/61/47/36/948614736.db2.gz HCKONCATVKHDFR-INIZCTEOSA-N 0 0 360.376 3.844 20 5 FHBDRN Cc1cc(C(=O)Nc2ccc(NC[C@H]3CCCO3)c(F)c2)ccc1[N+](=O)[O-] ZINC000129583902 948622725 /nfs/dbraw/zinc/62/27/25/948622725.db2.gz MXVDZVKPCQELNA-OAHLLOKOSA-N 0 0 373.384 3.886 20 5 FHBDRN Cc1nn(CCC(=O)N2CC[C@@H](c3ccccc3)C[C@H]2C)c(C)c1[N+](=O)[O-] ZINC000466894575 948635240 /nfs/dbraw/zinc/63/52/40/948635240.db2.gz STYVDPZEUGXRHL-RDTXWAMCSA-N 0 0 370.453 3.593 20 5 FHBDRN COc1cc(CSCC(=O)OC2CCCCC2)c([N+](=O)[O-])cc1F ZINC000783487735 948637174 /nfs/dbraw/zinc/63/71/74/948637174.db2.gz QGOIVQMTWQHZFX-UHFFFAOYSA-N 0 0 357.403 3.852 20 5 FHBDRN CCOC(=O)c1ccc(NC(=S)Nc2cc([N+](=O)[O-])ccc2F)cc1 ZINC000006630613 948702502 /nfs/dbraw/zinc/70/25/02/948702502.db2.gz PMEKERNDLWJNQF-UHFFFAOYSA-N 0 0 363.370 3.720 20 5 FHBDRN COc1cc(OC)cc(N2CC[C@H](Sc3cccc([N+](=O)[O-])c3)C2=O)c1 ZINC000509733267 948715527 /nfs/dbraw/zinc/71/55/27/948715527.db2.gz ZUSSOJPHTNGBEW-KRWDZBQOSA-N 0 0 374.418 3.510 20 5 FHBDRN CCCCOc1ncccc1CNC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000536482279 948719259 /nfs/dbraw/zinc/71/92/59/948719259.db2.gz SBSBQOVEKWINGU-UHFFFAOYSA-N 0 0 368.393 3.580 20 5 FHBDRN CCOCc1ccc(CNc2cc(C)c([N+](=O)[O-])c(C(=O)OC)c2)cc1 ZINC000440741617 948746393 /nfs/dbraw/zinc/74/63/93/948746393.db2.gz PQHWFRKFJAENPE-UHFFFAOYSA-N 0 0 358.394 3.838 20 5 FHBDRN O=[N+]([O-])c1ccc(/C=C\c2nc(-c3ccc(-c4nnco4)cc3)no2)cc1 ZINC000445402043 948770143 /nfs/dbraw/zinc/77/01/43/948770143.db2.gz JLDHXAADKPMXQG-KMKOMSMNSA-N 0 0 361.317 3.865 20 5 FHBDRN CCOCc1cccc(NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)c1 ZINC000523997408 948775238 /nfs/dbraw/zinc/77/52/38/948775238.db2.gz WZAGJZXPVMPJSO-UHFFFAOYSA-N 0 0 355.394 3.958 20 5 FHBDRN CO[C@H](C)c1cccc(NC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)c1 ZINC000524018853 948784128 /nfs/dbraw/zinc/78/41/28/948784128.db2.gz XKGKUGLUOYMMMR-CYBMUJFWSA-N 0 0 366.377 3.740 20 5 FHBDRN O=c1oc2ccc([N+](=O)[O-])cc2n1Cc1csc(-c2ccsc2)n1 ZINC000150873543 948796128 /nfs/dbraw/zinc/79/61/28/948796128.db2.gz RPOGQDKBNWFEEO-UHFFFAOYSA-N 0 0 359.388 3.736 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)CCc1ccccc1C(=O)OC ZINC000464721371 948797457 /nfs/dbraw/zinc/79/74/57/948797457.db2.gz WKVQHHLJIOTNPC-UHFFFAOYSA-N 0 0 356.378 3.515 20 5 FHBDRN CC(C)C(=O)Nc1ccc(NC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)cc1 ZINC000524006845 948797518 /nfs/dbraw/zinc/79/75/18/948797518.db2.gz RYTNHUOYZNCDBF-UHFFFAOYSA-N 0 0 366.377 3.923 20 5 FHBDRN CCCCCNC(=O)Cc1noc(-c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)n1 ZINC000445435560 948818102 /nfs/dbraw/zinc/81/81/02/948818102.db2.gz KKDVMEKTGKUQPC-UHFFFAOYSA-N 0 0 374.441 3.791 20 5 FHBDRN COc1ccc(NC(=O)COc2cc(C)ccc2[N+](=O)[O-])cc1Cl ZINC000021614125 948818633 /nfs/dbraw/zinc/81/86/33/948818633.db2.gz SYUFJAUGEVRLRY-UHFFFAOYSA-N 0 0 350.758 3.583 20 5 FHBDRN Cc1ccc([C@H](CNc2ccc([N+](=O)[O-])cc2F)N2CCOCC2)cc1 ZINC000071968900 203798053 /nfs/dbraw/zinc/79/80/53/203798053.db2.gz HKXQCEAPKAQWSO-IBGZPJMESA-N 0 0 359.401 3.528 20 5 FHBDRN COc1ccc(OCC(=O)Nc2cccc(Cl)c2Cl)c([N+](=O)[O-])c1 ZINC000005051616 203810040 /nfs/dbraw/zinc/81/00/40/203810040.db2.gz LDJPCRPQNNGTKN-UHFFFAOYSA-N 0 0 371.176 3.928 20 5 FHBDRN O=C(CSc1ccccn1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000007699963 203818076 /nfs/dbraw/zinc/81/80/76/203818076.db2.gz WITNGMVMGMFYCX-UHFFFAOYSA-N 0 0 357.313 3.739 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)Nc1ccccc1OC(F)F ZINC000007407147 204296861 /nfs/dbraw/zinc/29/68/61/204296861.db2.gz AJQDIMCAPGSURI-UHFFFAOYSA-N 0 0 354.334 3.927 20 5 FHBDRN Cc1c(NC(=O)COc2ccccc2Br)cccc1[N+](=O)[O-] ZINC000010238612 204393064 /nfs/dbraw/zinc/39/30/64/204393064.db2.gz QLLDOFYTADVHGL-UHFFFAOYSA-N 0 0 365.183 3.683 20 5 FHBDRN CCOC(=O)c1cc(C(=O)Nc2ccc(F)c(Cl)c2)cc([N+](=O)[O-])c1 ZINC000010489580 204396856 /nfs/dbraw/zinc/39/68/56/204396856.db2.gz CZNOGQWVEOXLQK-UHFFFAOYSA-N 0 0 366.732 3.816 20 5 FHBDRN O=C(NC12CC3CC(CC(C3)C1)C2)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000016021635 204630098 /nfs/dbraw/zinc/63/00/98/204630098.db2.gz BQFYOOSNDZAJLE-UHFFFAOYSA-N 0 0 355.438 3.868 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(OC(F)(F)F)cc1 ZINC000019159833 204670101 /nfs/dbraw/zinc/67/01/01/204670101.db2.gz PYMLAMZQHGCDLG-UHFFFAOYSA-N 0 0 356.256 3.754 20 5 FHBDRN COc1ccc(Cl)cc1NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000031547376 204917920 /nfs/dbraw/zinc/91/79/20/204917920.db2.gz LZSVMRBAOTZETQ-UHFFFAOYSA-N 0 0 372.768 3.695 20 5 FHBDRN Cc1ccc(NC(=O)c2cccc(NC(=O)[C@H]3C[C@H]3C)c2)cc1[N+](=O)[O-] ZINC000032644195 204933497 /nfs/dbraw/zinc/93/34/97/204933497.db2.gz JWYLLRMZDNRWKL-WBMJQRKESA-N 0 0 353.378 3.750 20 5 FHBDRN Cc1nn(-c2ccc(F)cc2)c(C)c1CC(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000042390526 205095617 /nfs/dbraw/zinc/09/56/17/205095617.db2.gz BDZZLFROBIAUHW-UHFFFAOYSA-N 0 0 368.368 3.718 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)c1sc(-c2ccccn2)nc1C ZINC000045458319 205122577 /nfs/dbraw/zinc/12/25/77/205122577.db2.gz FQBVMQPBUCVAIC-UHFFFAOYSA-N 0 0 370.390 3.683 20 5 FHBDRN Cc1ccc(C(=O)Nc2ccccc2NC(=O)NC(C)C)cc1[N+](=O)[O-] ZINC000047375533 205146898 /nfs/dbraw/zinc/14/68/98/205146898.db2.gz GOXBULUXSURWQC-UHFFFAOYSA-N 0 0 356.382 3.685 20 5 FHBDRN Cc1c(C(=O)NCc2cc(F)ccc2Br)cccc1[N+](=O)[O-] ZINC000055817534 205224875 /nfs/dbraw/zinc/22/48/75/205224875.db2.gz BDIIQSZLZVIJHP-UHFFFAOYSA-N 0 0 367.174 3.735 20 5 FHBDRN Cc1ccc(C(=O)Nc2ccc(C(=O)N(C)C)c(Cl)c2)cc1[N+](=O)[O-] ZINC000056435793 205231405 /nfs/dbraw/zinc/23/14/05/205231405.db2.gz JXBFLHVDCIRRCP-UHFFFAOYSA-N 0 0 361.785 3.511 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)Oc1cc(C)ccc1Cl ZINC000066058548 205362429 /nfs/dbraw/zinc/36/24/29/205362429.db2.gz GTGXWZMNOUQZHL-LLVKDONJSA-N 0 0 364.785 3.971 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(Br)cc2C)c1 ZINC000067538580 205375349 /nfs/dbraw/zinc/37/53/49/205375349.db2.gz ZLVSSOVGKVIVBH-UHFFFAOYSA-N 0 0 365.183 3.927 20 5 FHBDRN CC(C)[C@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)OCCO2 ZINC000071801316 205449511 /nfs/dbraw/zinc/44/95/11/205449511.db2.gz SPDXAINHQGPAJI-SFHVURJKSA-N 0 0 371.393 3.885 20 5 FHBDRN Cc1ccc(C(=O)NCc2cc(F)cc(Br)c2)cc1[N+](=O)[O-] ZINC000108401887 206031408 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O=C(C1CCN(c2ccccc2[N+](=O)[O-])CC1)N1CCC[C@H]1C1CCCC1 ZINC000056033466 136127573 /nfs/dbraw/zinc/12/75/73/136127573.db2.gz VUSWDUVXXAGJPM-SFHVURJKSA-N 0 0 371.481 3.992 20 5 FHBDRN Cc1cc(NCc2cccc(N(C)C)n2)c(Br)cc1[N+](=O)[O-] ZINC000302695841 567824058 /nfs/dbraw/zinc/82/40/58/567824058.db2.gz STODYWBFMYXKAL-UHFFFAOYSA-N 0 0 365.231 3.739 20 5 FHBDRN Cc1nc(CC(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)c(C)s1 ZINC000452867091 567829248 /nfs/dbraw/zinc/82/92/48/567829248.db2.gz YBGUODFHBCIWNZ-OAHLLOKOSA-N 0 0 359.451 3.617 20 5 FHBDRN CCC1(CC)[C@@H](OC)C[C@@H]1N(C)C(=O)Nc1ccc([N+](=O)[O-])cc1F ZINC000541786259 567833949 /nfs/dbraw/zinc/83/39/49/567833949.db2.gz IJODGARVLOVXKW-GJZGRUSLSA-N 0 0 353.394 3.791 20 5 FHBDRN CC(=O)c1ccc(Cl)c(NC(=O)CCNc2ccccc2[N+](=O)[O-])c1 ZINC000150808331 567842736 /nfs/dbraw/zinc/84/27/36/567842736.db2.gz CMHNJPNWOUBYCB-UHFFFAOYSA-N 0 0 361.785 3.892 20 5 FHBDRN CCOc1nc(C)ccc1C(=O)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452865466 567845379 /nfs/dbraw/zinc/84/53/79/567845379.db2.gz XEOJRVHJTORKRL-MRXNPFEDSA-N 0 0 369.421 3.717 20 5 FHBDRN COC(=O)[C@@H]1C[C@H]1c1ccc(NC(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000601833467 567854764 /nfs/dbraw/zinc/85/47/64/567854764.db2.gz LEOLERKVJITTLY-UYHISHBKSA-N 0 0 368.389 3.614 20 5 FHBDRN C[C@@H]1Cc2cccc(C(=O)N3CCC[C@H](c4ccc([N+](=O)[O-])cc4)C3)c2O1 ZINC000452875282 567868208 /nfs/dbraw/zinc/86/82/08/567868208.db2.gz VBIBCKNHJBKZHE-PBHICJAKSA-N 0 0 366.417 3.938 20 5 FHBDRN COc1cc(C(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)ccc1C ZINC000452878877 567873513 /nfs/dbraw/zinc/87/35/13/567873513.db2.gz MSHYZYRORVBBPH-QGZVFWFLSA-N 0 0 354.406 3.932 20 5 FHBDRN Cc1cccc(OCC(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000452884459 567884625 /nfs/dbraw/zinc/88/46/25/567884625.db2.gz QBHPEZFQSFAEQZ-KRWDZBQOSA-N 0 0 354.406 3.688 20 5 FHBDRN COc1ccc(CC(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000452888056 567886178 /nfs/dbraw/zinc/88/61/78/567886178.db2.gz SDWKIBXFWXREEX-KRWDZBQOSA-N 0 0 354.406 3.552 20 5 FHBDRN COC[C@H](NC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1)c1ccccc1 ZINC000120360799 567891300 /nfs/dbraw/zinc/89/13/00/567891300.db2.gz GIUZITXZOQNQDY-IBGZPJMESA-N 0 0 369.421 3.657 20 5 FHBDRN Cc1cc(C(=O)N[C@@H](C[C@H]2CCOC2)c2ccccc2)cc([N+](=O)[O-])c1 ZINC000159186901 567906334 /nfs/dbraw/zinc/90/63/34/567906334.db2.gz WZVMZCBEHRLHDE-BEFAXECRSA-N 0 0 354.406 3.801 20 5 FHBDRN COc1cc2c(cc1Cl)CN(C(=O)c1cc(F)cc([N+](=O)[O-])c1)CC2 ZINC000568130245 567910894 /nfs/dbraw/zinc/91/08/94/567910894.db2.gz OYJWYNYEHDOWQC-UHFFFAOYSA-N 0 0 364.760 3.594 20 5 FHBDRN Cc1ccc(C(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)c(O)c1C ZINC000436576817 567915199 /nfs/dbraw/zinc/91/51/99/567915199.db2.gz RKPMLWXYPMNLRX-UHFFFAOYSA-N 0 0 370.405 3.601 20 5 FHBDRN CSc1ccc(C(=O)NC[C@H]2CC[C@H](c3ccccc3)O2)cc1[N+](=O)[O-] ZINC000568133301 567927298 /nfs/dbraw/zinc/92/72/98/567927298.db2.gz SNONUBBFZLQQNL-NVXWUHKLSA-N 0 0 372.446 3.967 20 5 FHBDRN CCOC(=O)c1cc(C(=O)Nc2ccc(Cl)cc2F)cc([N+](=O)[O-])c1 ZINC000008078628 567931355 /nfs/dbraw/zinc/93/13/55/567931355.db2.gz QJEHBDAYDMLZQH-UHFFFAOYSA-N 0 0 366.732 3.816 20 5 FHBDRN Cc1ccnc([C@@H](C)NC(=O)c2cc([N+](=O)[O-])ccc2SC(C)C)n1 ZINC000602163211 567945877 /nfs/dbraw/zinc/94/58/77/567945877.db2.gz IIJZLYHIFDXEBC-GFCCVEGCSA-N 0 0 360.439 3.685 20 5 FHBDRN CC(C)COc1ccc(NC(=O)c2cc([N+](=O)[O-])cnc2N)cc1Cl ZINC000541841560 567951172 /nfs/dbraw/zinc/95/11/72/567951172.db2.gz ACTFQLZCRBTONH-UHFFFAOYSA-N 0 0 364.789 3.513 20 5 FHBDRN Cc1ccc(OC[C@@H](O)Cn2ccnc2-c2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000051451942 567961028 /nfs/dbraw/zinc/96/10/28/567961028.db2.gz LAIZORMMZRCTPR-SFHVURJKSA-N 0 0 367.405 3.515 20 5 FHBDRN CC(C)(CCc1noc(-c2cc(F)ccc2Br)n1)[N+](=O)[O-] ZINC000291017864 567963293 /nfs/dbraw/zinc/96/32/93/567963293.db2.gz CBDVTMCNKZLHDO-UHFFFAOYSA-N 0 0 358.167 3.626 20 5 FHBDRN Cn1cc(CNCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)c(C(F)F)n1 ZINC000291020910 567963685 /nfs/dbraw/zinc/96/36/85/567963685.db2.gz GWUBKPVTATUBAB-UHFFFAOYSA-N 0 0 364.274 3.575 20 5 FHBDRN Cc1cc(O[C@H](C)C(=O)NCc2cccc([N+](=O)[O-])c2C)ccc1Cl ZINC000481467284 567965290 /nfs/dbraw/zinc/96/52/90/567965290.db2.gz POGVGKIBZXNSRU-CYBMUJFWSA-N 0 0 362.813 3.949 20 5 FHBDRN Cc1ncc(C(=O)NCc2cccc([N+](=O)[O-])c2C)c(Cl)c1Cl ZINC000481479427 567972145 /nfs/dbraw/zinc/97/21/45/567972145.db2.gz LBGUBGXCAIFROS-UHFFFAOYSA-N 0 0 354.193 3.843 20 5 FHBDRN CC[C@@H](CNC(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F)CC(F)(F)F ZINC000412643060 567976766 /nfs/dbraw/zinc/97/67/66/567976766.db2.gz ZKJOYDQUCKKSQU-VHSXEESVSA-N 0 0 350.312 3.932 20 5 FHBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])N1CCc2ccccc2CC1 ZINC000541851523 567977625 /nfs/dbraw/zinc/97/76/25/567977625.db2.gz LMRSVWFJGNPURG-UHFFFAOYSA-N 0 0 373.840 3.601 20 5 FHBDRN COc1cc(C(=O)NCc2cccc([N+](=O)[O-])c2C)cc(OC)c1C(C)C ZINC000481479302 567980611 /nfs/dbraw/zinc/98/06/11/567980611.db2.gz PXIUYDZUTYAEEN-UHFFFAOYSA-N 0 0 372.421 3.974 20 5 FHBDRN Cc1nc2cc(F)cc(C(=O)NCc3cccc([N+](=O)[O-])c3C)c2nc1C ZINC000481477597 567980831 /nfs/dbraw/zinc/98/08/31/567980831.db2.gz HNEBOTVTTPPVFR-UHFFFAOYSA-N 0 0 368.368 3.532 20 5 FHBDRN O=C(Nc1nccn1Cc1ccccc1)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000521420956 567985071 /nfs/dbraw/zinc/98/50/71/567985071.db2.gz ZRJFEBOSMHAOLR-UHFFFAOYSA-N 0 0 362.345 3.838 20 5 FHBDRN Cc1c(CNC(=O)COc2ccc(C(F)(F)F)cc2)cccc1[N+](=O)[O-] ZINC000481487911 567987399 /nfs/dbraw/zinc/98/73/99/567987399.db2.gz DJYLOQWZSYNBGB-UHFFFAOYSA-N 0 0 368.311 3.617 20 5 FHBDRN CCn1nc(C)c(CNCc2cc(Br)c([N+](=O)[O-])s2)c1C ZINC000602531078 567988298 /nfs/dbraw/zinc/98/82/98/567988298.db2.gz HSEPIZWFRVURDL-UHFFFAOYSA-N 0 0 373.276 3.542 20 5 FHBDRN Cc1c(CNC(=O)c2cnn(CC(C)C)c2C(F)F)cccc1[N+](=O)[O-] ZINC000481489304 567991582 /nfs/dbraw/zinc/99/15/82/567991582.db2.gz HWTFOCJNSVZQBB-UHFFFAOYSA-N 0 0 366.368 3.623 20 5 FHBDRN Cc1c(CNC(=O)c2ccc([C@H]3CCCOC3)cc2)cccc1[N+](=O)[O-] ZINC000481493153 567998033 /nfs/dbraw/zinc/99/80/33/567998033.db2.gz PNKQMFYWBKWRCM-SFHVURJKSA-N 0 0 354.406 3.727 20 5 FHBDRN Cc1c(CNC(=O)COc2cccc(C(F)(F)F)c2)cccc1[N+](=O)[O-] ZINC000481497165 567998080 /nfs/dbraw/zinc/99/80/80/567998080.db2.gz XUGBRIYICQCHGC-UHFFFAOYSA-N 0 0 368.311 3.617 20 5 FHBDRN CC(C)(CCc1noc(-c2cc3c(cccc3OC(F)F)[nH]2)n1)[N+](=O)[O-] ZINC000291057723 568008708 /nfs/dbraw/zinc/00/87/08/568008708.db2.gz JIRSIHKJHJVSRW-UHFFFAOYSA-N 0 0 366.324 3.807 20 5 FHBDRN Cn1cc(NCc2cc(Br)c([N+](=O)[O-])s2)c(C2CC2)n1 ZINC000602678340 568009457 /nfs/dbraw/zinc/00/94/57/568009457.db2.gz VHOWZPKMCALBHU-UHFFFAOYSA-N 0 0 357.233 3.642 20 5 FHBDRN CN(C(=O)NCCc1ccccc1[N+](=O)[O-])[C@H]1CC[C@@H](C(F)(F)F)CC1 ZINC000291090950 568023916 /nfs/dbraw/zinc/02/39/16/568023916.db2.gz SKUKTCWNKYWKGF-OKILXGFUSA-N 0 0 373.375 3.900 20 5 FHBDRN Cc1sc(C(=O)Nc2c(-c3ccc(F)cc3)ncn2C)cc1[N+](=O)[O-] ZINC000162435855 568025601 /nfs/dbraw/zinc/02/56/01/568025601.db2.gz NDCCXZHDOYBWSY-UHFFFAOYSA-N 0 0 360.370 3.757 20 5 FHBDRN C[C@H](Nc1ccc2ncccc2c1[N+](=O)[O-])c1ncc(Br)cn1 ZINC000568347528 568028097 /nfs/dbraw/zinc/02/80/97/568028097.db2.gz JMJCQJFHJUERCW-VIFPVBQESA-N 0 0 374.198 3.869 20 5 FHBDRN O=C(CCN[C@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F)NC1CCCCC1 ZINC000568401062 568030618 /nfs/dbraw/zinc/03/06/18/568030618.db2.gz AFLVYRIJKSEMOL-MRXNPFEDSA-N 0 0 373.375 3.627 20 5 FHBDRN Cc1c(CNC(=O)c2cnn(CC(C)C)c2C2CC2)cccc1[N+](=O)[O-] ZINC000481503898 568031350 /nfs/dbraw/zinc/03/13/50/568031350.db2.gz UXHVUMWAWKJHQN-UHFFFAOYSA-N 0 0 356.426 3.563 20 5 FHBDRN CC(C)(c1ccccc1)C1(NC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)CC1 ZINC000568365703 568034446 /nfs/dbraw/zinc/03/44/46/568034446.db2.gz CXQRCQCZFOVQFM-UHFFFAOYSA-N 0 0 368.389 3.564 20 5 FHBDRN C[C@@H]1CC2(CCC2)CN1C(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000568459512 568040132 /nfs/dbraw/zinc/04/01/32/568040132.db2.gz QBICCVHRIRHZJP-CYBMUJFWSA-N 0 0 356.426 3.593 20 5 FHBDRN CC(C)[C@@H]1CN(C(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)c2ccccc21 ZINC000568463434 568040286 /nfs/dbraw/zinc/04/02/86/568040286.db2.gz XMVVYUPMIXLAKI-AWEZNQCLSA-N 0 0 354.362 3.724 20 5 FHBDRN Cc1c(Br)ccc(C(=O)NCc2cccc([N+](=O)[O-])c2)c1F ZINC000568466811 568040677 /nfs/dbraw/zinc/04/06/77/568040677.db2.gz FZOHNOJRDUKLOJ-UHFFFAOYSA-N 0 0 367.174 3.735 20 5 FHBDRN CC[C@H](NC(=O)NCc1ccc([N+](=O)[O-])cc1)c1ccc(OC)c(OC)c1 ZINC000568494690 568044634 /nfs/dbraw/zinc/04/46/34/568044634.db2.gz ZPAZXOMYCVOGCI-INIZCTEOSA-N 0 0 373.409 3.563 20 5 FHBDRN C[C@@H]1[C@H](C)SCCN1c1nnc(-c2cccc([N+](=O)[O-])c2)n1C1CC1 ZINC000568523569 568046133 /nfs/dbraw/zinc/04/61/33/568046133.db2.gz IAMGEULYRUAUKT-NEPJUHHUSA-N 0 0 359.455 3.518 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])N[C@H]1C[C@H](c2ccc(F)cc2)C1 ZINC000481556025 568047951 /nfs/dbraw/zinc/04/79/51/568047951.db2.gz OJKDKNPUWCCJRL-KOMQPUFPSA-N 0 0 358.369 3.565 20 5 FHBDRN Cc1ccc(CN(CCO)Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)o1 ZINC000568537608 568048546 /nfs/dbraw/zinc/04/85/46/568048546.db2.gz ZNMLMLOZSZRRBI-UHFFFAOYSA-N 0 0 358.316 3.510 20 5 FHBDRN CC(C)(CCc1noc([C@@H]2CCN(c3ccccc3Cl)C2)n1)[N+](=O)[O-] ZINC000291101814 568049563 /nfs/dbraw/zinc/04/95/63/568049563.db2.gz RJCGVQQSKYIYCS-GFCCVEGCSA-N 0 0 364.833 3.705 20 5 FHBDRN CC(C)Cn1ncc(-c2nc(CCC(C)(C)[N+](=O)[O-])no2)c1C(F)F ZINC000291103131 568049569 /nfs/dbraw/zinc/04/95/69/568049569.db2.gz RRAYYOSENITEBA-UHFFFAOYSA-N 0 0 357.361 3.515 20 5 FHBDRN COc1ccc(-c2ocnc2C(=O)Nc2cc([N+](=O)[O-])ccc2OC)cc1 ZINC000568552753 568050510 /nfs/dbraw/zinc/05/05/10/568050510.db2.gz CISBIZDDYBVPQJ-UHFFFAOYSA-N 0 0 369.333 3.519 20 5 FHBDRN COc1cc(F)c(F)cc1NC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000568569220 568056489 /nfs/dbraw/zinc/05/64/89/568056489.db2.gz JJEGQVSNZXEKGV-VIFPVBQESA-N 0 0 351.309 3.764 20 5 FHBDRN Cc1ccc(Cl)c(NS(=O)(=O)c2c(C)c(C)ccc2[N+](=O)[O-])c1 ZINC000481600190 568061582 /nfs/dbraw/zinc/06/15/82/568061582.db2.gz RCVRYGFQXJCDHH-UHFFFAOYSA-N 0 0 354.815 3.974 20 5 FHBDRN CN(Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)Cc1cccc(Cl)c1 ZINC000051532245 568065436 /nfs/dbraw/zinc/06/54/36/568065436.db2.gz DJDZNLDUYODRHR-UHFFFAOYSA-N 0 0 358.785 3.930 20 5 FHBDRN CSc1ccc(C(=O)N[C@H]2CCOC3(CCCC3)C2)cc1[N+](=O)[O-] ZINC000159256427 568070003 /nfs/dbraw/zinc/07/00/03/568070003.db2.gz CLTDJEUGVXBWHD-ZDUSSCGKSA-N 0 0 350.440 3.538 20 5 FHBDRN COc1cc(C(=O)NC[C@H]2CCC3(CCCCC3)O2)cc([N+](=O)[O-])c1C ZINC000481630142 568072140 /nfs/dbraw/zinc/07/21/40/568072140.db2.gz OUJUBSZSMDRRBI-OAHLLOKOSA-N 0 0 362.426 3.524 20 5 FHBDRN CC[N@@H+]1CC[C@@H](N(C)C(=O)c2cc(Cl)cc(Cl)c2[N+](=O)[O-])[C@H](C)C1 ZINC000291237316 568084906 /nfs/dbraw/zinc/08/49/06/568084906.db2.gz APLDQUXLDWCIIM-QMTHXVAHSA-N 0 0 374.268 3.704 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(NCc2ccnc(OCc3ccccc3)c2)n1 ZINC000481690285 568089239 /nfs/dbraw/zinc/08/92/39/568089239.db2.gz HIFXLVZZWQHCNR-UHFFFAOYSA-N 0 0 350.378 3.884 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(N(C)CCCc2cc(-c3ccccc3)n[nH]2)n1 ZINC000481698747 568092092 /nfs/dbraw/zinc/09/20/92/568092092.db2.gz TXAVRMFXPJCLRK-UHFFFAOYSA-N 0 0 351.410 3.757 20 5 FHBDRN O=[N+]([O-])c1cn(C[C@H](O)Cc2ccc3ccccc3c2)nc1-c1ccncc1 ZINC000481701396 568092461 /nfs/dbraw/zinc/09/24/61/568092461.db2.gz CVRIBNNNAIRCSO-LJQANCHMSA-N 0 0 374.400 3.610 20 5 FHBDRN Cc1cc(=O)n(Cc2ccc(Cl)cc2Br)cc1[N+](=O)[O-] ZINC000128624129 568092614 /nfs/dbraw/zinc/09/26/14/568092614.db2.gz GAQSGDJCHDCELJ-UHFFFAOYSA-N 0 0 357.591 3.529 20 5 FHBDRN Cc1c(CC(=O)N2CCC[C@@H]2C[C@@H](O)c2cccs2)cccc1[N+](=O)[O-] ZINC000128639266 568097303 /nfs/dbraw/zinc/09/73/03/568097303.db2.gz PZQDOIPWUKYQMI-NVXWUHKLSA-N 0 0 374.462 3.622 20 5 FHBDRN COc1ccc(Cc2nnc(SCc3ccccc3[N+](=O)[O-])o2)cc1 ZINC000024785422 568100273 /nfs/dbraw/zinc/10/02/73/568100273.db2.gz DWTXKCMNGYAUEC-UHFFFAOYSA-N 0 0 357.391 3.870 20 5 FHBDRN C[C@H](NC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F)c1nc2ccccc2[nH]1 ZINC000568691637 568123603 /nfs/dbraw/zinc/12/36/03/568123603.db2.gz NLDUBFMVCBJXBY-NSHDSACASA-N 0 0 370.384 3.765 20 5 FHBDRN Cc1csc(-c2cccc(C(=O)NCCc3ccc([N+](=O)[O-])cc3)c2)n1 ZINC000150834308 568126727 /nfs/dbraw/zinc/12/67/27/568126727.db2.gz SNBKZUDLFZCNBB-UHFFFAOYSA-N 0 0 367.430 3.999 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N[C@@H]1CCc2cc(F)ccc21 ZINC000159315702 568130313 /nfs/dbraw/zinc/13/03/13/568130313.db2.gz VMVUUJPDDXMPCT-GOSISDBHSA-N 0 0 353.353 3.561 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H](c1nc(C2CC2)no1)C(C)C ZINC000568699888 568132119 /nfs/dbraw/zinc/13/21/19/568132119.db2.gz MGMSYGFFUBHKLL-HNNXBMFYSA-N 0 0 373.413 3.936 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)COc1ccc(CCC(C)=O)cc1 ZINC000291397021 568136852 /nfs/dbraw/zinc/13/68/52/568136852.db2.gz HECCABPXDMKWAS-UHFFFAOYSA-N 0 0 370.405 3.696 20 5 FHBDRN CCOc1cc(OCc2nc(Cc3cccc(F)c3)no2)ccc1[N+](=O)[O-] ZINC000568716593 568148852 /nfs/dbraw/zinc/14/88/52/568148852.db2.gz JNADBQVJJRXQKJ-UHFFFAOYSA-N 0 0 373.340 3.685 20 5 FHBDRN C[C@@H]1CN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)c2cccc(F)c2O1 ZINC000481847469 568150671 /nfs/dbraw/zinc/15/06/71/568150671.db2.gz ZGOYYROQNMJNAS-LLVKDONJSA-N 0 0 370.340 3.571 20 5 FHBDRN CNC(=O)NCc1ccc(Oc2ccc([N+](=O)[O-])cc2Cl)c(F)c1 ZINC000522780495 568156924 /nfs/dbraw/zinc/15/69/24/568156924.db2.gz KZNRORHOADUDAV-UHFFFAOYSA-N 0 0 353.737 3.609 20 5 FHBDRN Cc1noc(C)c1[C@@H](C)CNC(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000159348155 568159445 /nfs/dbraw/zinc/15/94/45/568159445.db2.gz SQQOUWLRXQYWDS-RYUDHWBXSA-N 0 0 360.414 3.672 20 5 FHBDRN COc1cccc(C2(CNC(=O)c3c(Cl)cccc3[N+](=O)[O-])CC2)c1 ZINC000291438294 568161387 /nfs/dbraw/zinc/16/13/87/568161387.db2.gz HKUGVRUCEGDJQI-UHFFFAOYSA-N 0 0 360.797 3.718 20 5 FHBDRN C[C@@H]1CN(c2nnc(-c3cccc([N+](=O)[O-])c3)n2C2CC2)C[C@@H](C)S1 ZINC000568757817 568181889 /nfs/dbraw/zinc/18/18/89/568181889.db2.gz GXBDWUWWVHMKTQ-VXGBXAGGSA-N 0 0 359.455 3.518 20 5 FHBDRN COC(=O)c1cc(OCc2ccc(OC(F)(F)F)cc2)ccc1[N+](=O)[O-] ZINC000481921999 568187860 /nfs/dbraw/zinc/18/78/60/568187860.db2.gz LKEQRVCNYZUTSM-UHFFFAOYSA-N 0 0 371.267 3.859 20 5 FHBDRN CCCCCN(Cc1ccc(F)cc1)C(=O)Nc1ccncc1[N+](=O)[O-] ZINC000541906762 568207861 /nfs/dbraw/zinc/20/78/61/568207861.db2.gz VDLYDOREJOJPNO-UHFFFAOYSA-N 0 0 360.389 3.775 20 5 FHBDRN C[C@H](NC(=O)CCCn1cnc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000604108440 568211594 /nfs/dbraw/zinc/21/15/94/568211594.db2.gz PDQNJRRTHOWJKE-AWEZNQCLSA-N 0 0 352.394 3.602 20 5 FHBDRN CC(C)Oc1cccc(CC(=O)NC(C)(C)c2ccccc2[N+](=O)[O-])c1 ZINC000568784012 568216454 /nfs/dbraw/zinc/21/64/54/568216454.db2.gz KGMYSWZLWLMICF-UHFFFAOYSA-N 0 0 356.422 3.976 20 5 FHBDRN C[C@H](NC(=O)N1CC(C)(C)[C@@H]1c1cccnc1)c1cccc([N+](=O)[O-])c1 ZINC000291590235 568217038 /nfs/dbraw/zinc/21/70/38/568217038.db2.gz HKJBTXDDJXHHEX-GUYCJALGSA-N 0 0 354.410 3.844 20 5 FHBDRN C[C@H](C1CC1)N(Cc1ccccc1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000007213275 568227781 /nfs/dbraw/zinc/22/77/81/568227781.db2.gz PTXZYNCCBOAPOR-CQSZACIVSA-N 0 0 360.435 3.584 20 5 FHBDRN Cc1ccc(NC(=O)c2ccc(N[C@@H](C)[C@@H]3CCOC3)c([N+](=O)[O-])c2)cc1 ZINC000541921398 568229923 /nfs/dbraw/zinc/22/99/23/568229923.db2.gz GNSPQNKWDWGGNH-GOEBONIOSA-N 0 0 369.421 3.992 20 5 FHBDRN Cc1cc(Cl)ccc1O[C@@H](C)C(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000043841121 568230845 /nfs/dbraw/zinc/23/08/45/568230845.db2.gz VMQAEFUJXOGATN-ZDUSSCGKSA-N 0 0 362.813 3.983 20 5 FHBDRN CCOC1CC(CCNC(=O)c2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000291627548 568231917 /nfs/dbraw/zinc/23/19/17/568231917.db2.gz AVTINXHRROXJBQ-UHFFFAOYSA-N 0 0 361.225 3.837 20 5 FHBDRN C[C@@H](C(=O)Nc1ccc(Oc2cccnc2)nc1)c1cccc([N+](=O)[O-])c1 ZINC000568829380 568233997 /nfs/dbraw/zinc/23/39/97/568233997.db2.gz VLYZRLJTWRSNDR-CYBMUJFWSA-N 0 0 364.361 3.919 20 5 FHBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1c2ccccc2C[C@@H]1C ZINC000007470945 568234731 /nfs/dbraw/zinc/23/47/31/568234731.db2.gz IVRVZHFDYIERPY-RYUDHWBXSA-N 0 0 360.797 3.993 20 5 FHBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1c2ccccc2C[C@@H]1C ZINC000007470943 568234756 /nfs/dbraw/zinc/23/47/56/568234756.db2.gz IVRVZHFDYIERPY-NWDGAFQWSA-N 0 0 360.797 3.993 20 5 FHBDRN COC(=O)c1ccc(C)c(NC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)c1 ZINC000007471784 568234757 /nfs/dbraw/zinc/23/47/57/568234757.db2.gz WQEHTJAURQPZCY-GFCCVEGCSA-N 0 0 374.418 3.809 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CCC[C@H]2c2ccccn2)ccc1[N+](=O)[O-] ZINC000568849945 568236170 /nfs/dbraw/zinc/23/61/70/568236170.db2.gz OEKDHZXQHPOBMT-INIZCTEOSA-N 0 0 355.394 3.754 20 5 FHBDRN COc1ccc2c(c1)C[C@H](C)N(C(=O)Cc1cccc([N+](=O)[O-])c1C)[C@H]2C ZINC000541933597 568247953 /nfs/dbraw/zinc/24/79/53/568247953.db2.gz SMHUCMNMSANEBF-ZFWWWQNUSA-N 0 0 368.433 3.989 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])N[C@]1(C(F)(F)F)CCc2ccccc21 ZINC000568906208 568251753 /nfs/dbraw/zinc/25/17/53/568251753.db2.gz HDOAYOMCJOPZNO-QGZVFWFLSA-N 0 0 364.323 3.658 20 5 FHBDRN COc1cc(C(=O)NCc2ccc(C(F)F)cc2)cc([N+](=O)[O-])c1C ZINC000190296166 568252834 /nfs/dbraw/zinc/25/28/34/568252834.db2.gz HIMHSKWNIWNBAL-UHFFFAOYSA-N 0 0 350.321 3.779 20 5 FHBDRN CCn1c(Cc2ccccc2)nnc1Sc1nc(C)cc(C)c1[N+](=O)[O-] ZINC000541932895 568252981 /nfs/dbraw/zinc/25/29/81/568252981.db2.gz FSTVGCUTRLALPD-UHFFFAOYSA-N 0 0 369.450 3.960 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)Nc1cccc2ccn(C)c21 ZINC000482079201 568254885 /nfs/dbraw/zinc/25/48/85/568254885.db2.gz HEVITWPTQBSEEM-UHFFFAOYSA-N 0 0 352.394 3.793 20 5 FHBDRN O=C(Nc1ccc(-c2ccccc2)nn1)c1ccc([N+](=O)[O-])cc1Cl ZINC000150858978 568277197 /nfs/dbraw/zinc/27/71/97/568277197.db2.gz UPOGXMSHNZWZJU-UHFFFAOYSA-N 0 0 354.753 3.958 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(OCC(=O)N[C@@H](C)c2ccccc2Cl)n1 ZINC000541982963 568278317 /nfs/dbraw/zinc/27/83/17/568278317.db2.gz CZLWUSIIBOOKRE-LBPRGKRZSA-N 0 0 363.801 3.516 20 5 FHBDRN COc1ccc2c(c1NC(=O)N(C)CCc1ccccc1[N+](=O)[O-])CCC2 ZINC000482134016 568278583 /nfs/dbraw/zinc/27/85/83/568278583.db2.gz VRQOTICEHOQJOP-UHFFFAOYSA-N 0 0 369.421 3.799 20 5 FHBDRN CO[C@H](C)C(=O)Nc1cccc(N[C@H]2CCc3c2cccc3[N+](=O)[O-])c1 ZINC000569138028 568284990 /nfs/dbraw/zinc/28/49/90/568284990.db2.gz KAAHCUOBENLCTP-PXAZEXFGSA-N 0 0 355.394 3.668 20 5 FHBDRN O=[N+]([O-])c1sccc1NC[C@@H](O)COc1ccc(C(F)(F)F)cc1 ZINC000604433266 568286586 /nfs/dbraw/zinc/28/65/86/568286586.db2.gz KKTSHKHPSQHKRT-SNVBAGLBSA-N 0 0 362.329 3.527 20 5 FHBDRN Nc1c(C(=O)N[C@H]2CC=C(c3ccc(F)cc3)CC2)cccc1[N+](=O)[O-] ZINC000482155026 568292454 /nfs/dbraw/zinc/29/24/54/568292454.db2.gz AQZALHLTKDIYPB-HNNXBMFYSA-N 0 0 355.369 3.682 20 5 FHBDRN O=[N+]([O-])c1ccc(CSc2ncc([N+](=O)[O-])cc2Br)cc1 ZINC000159427589 568293579 /nfs/dbraw/zinc/29/35/79/568293579.db2.gz JPOKDSWGSSLJIZ-UHFFFAOYSA-N 0 0 370.184 3.953 20 5 FHBDRN CCOc1cc(NC(=O)NC[C@@H](C)C2CC2)c([N+](=O)[O-])cc1OCC ZINC000604401960 568294940 /nfs/dbraw/zinc/29/49/40/568294940.db2.gz GMFGTWARYRHGBB-LLVKDONJSA-N 0 0 351.403 3.560 20 5 FHBDRN COc1cccc(C2(NC(=O)N[C@@H](C)c3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000482160030 568297386 /nfs/dbraw/zinc/29/73/86/568297386.db2.gz QYADVOJPCGATDJ-ZDUSSCGKSA-N 0 0 355.394 3.653 20 5 FHBDRN C[C@H](C1CC1)N(Cc1ccccc1)C(=O)CNc1ccccc1[N+](=O)[O-] ZINC000569155348 568299826 /nfs/dbraw/zinc/29/98/26/568299826.db2.gz DORBIKPTUYUSRS-OAHLLOKOSA-N 0 0 353.422 3.834 20 5 FHBDRN O=[N+]([O-])c1ccsc1Nc1cccc(C[S@@](=O)C2CCOCC2)c1 ZINC000302001294 568301097 /nfs/dbraw/zinc/30/10/97/568301097.db2.gz JCOBCWSCSCNWOY-XMMPIXPASA-N 0 0 366.464 3.828 20 5 FHBDRN CCC(=O)Nc1ccc(C)c(NC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)c1 ZINC000120399408 568301701 /nfs/dbraw/zinc/30/17/01/568301701.db2.gz RQQYDYYWLDRWCQ-UHFFFAOYSA-N 0 0 366.377 3.985 20 5 FHBDRN CCc1ccc(C(=O)NC[C@@](C)(Cc2ccccc2)[C@@H](C)O)cc1[N+](=O)[O-] ZINC000482179437 568302051 /nfs/dbraw/zinc/30/20/51/568302051.db2.gz KDEFAMSUNSITRT-QVKFZJNVSA-N 0 0 370.449 3.517 20 5 FHBDRN CCN(C(=O)c1ccc(SC)c([N+](=O)[O-])c1)[C@@H]1CCOC(C)(C)C1 ZINC000291766248 568304328 /nfs/dbraw/zinc/30/43/28/568304328.db2.gz ZXZAOKQEVVNWRV-CYBMUJFWSA-N 0 0 352.456 3.736 20 5 FHBDRN CCOC(=O)CCc1ccc(NC(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000569187468 568306376 /nfs/dbraw/zinc/30/63/76/568306376.db2.gz DGQOVNKXJGALOD-AWEZNQCLSA-N 0 0 370.405 3.833 20 5 FHBDRN C[C@@](O)(C1CCN(c2nccc3c2cccc3[N+](=O)[O-])CC1)C(F)(F)F ZINC000569189176 568306890 /nfs/dbraw/zinc/30/68/90/568306890.db2.gz PNTRHRZXPULJRP-MRXNPFEDSA-N 0 0 369.343 3.673 20 5 FHBDRN O=C(NCc1ccc(Cl)o1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000604518793 568307718 /nfs/dbraw/zinc/30/77/18/568307718.db2.gz LCGZJBUEUMTGSV-UHFFFAOYSA-N 0 0 363.782 3.895 20 5 FHBDRN Cc1c(NC(=O)NCc2nc3ccccc3n2C2CC2)cccc1[N+](=O)[O-] ZINC000569212013 568308893 /nfs/dbraw/zinc/30/88/93/568308893.db2.gz JWOHCWDJJVCKCC-UHFFFAOYSA-N 0 0 365.393 3.910 20 5 FHBDRN CN(CC(=O)NC[C@H]1CCCC[C@@H]1C(F)(F)F)c1ccccc1[N+](=O)[O-] ZINC000482204788 568312040 /nfs/dbraw/zinc/31/20/40/568312040.db2.gz CDUHXVQACGEKMQ-OLZOCXBDSA-N 0 0 373.375 3.516 20 5 FHBDRN CNc1ccc(C(=O)Nc2cccc(OC(F)(F)F)c2)cc1[N+](=O)[O-] ZINC000031030943 568321754 /nfs/dbraw/zinc/32/17/54/568321754.db2.gz NINOXFFJNIBUDM-UHFFFAOYSA-N 0 0 355.272 3.787 20 5 FHBDRN CCOc1cc(C(=O)N(Cc2ccccc2)C2CC2)c([N+](=O)[O-])cc1OC ZINC000031097532 568323617 /nfs/dbraw/zinc/32/36/17/568323617.db2.gz AQFXDGWCKPXCGB-UHFFFAOYSA-N 0 0 370.405 3.807 20 5 FHBDRN COc1ccc(CSCC(=O)NCCCC2CCCC2)cc1[N+](=O)[O-] ZINC000031636576 568335314 /nfs/dbraw/zinc/33/53/14/568335314.db2.gz LFAYQDPQFDFYKJ-UHFFFAOYSA-N 0 0 366.483 3.923 20 5 FHBDRN O=C(Nc1cc(F)c(Br)c(F)c1)c1ccccc1[N+](=O)[O-] ZINC000181986503 568341860 /nfs/dbraw/zinc/34/18/60/568341860.db2.gz RUJCCOSEYJLURB-UHFFFAOYSA-N 0 0 357.110 3.888 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2noc(CSc3nncc4ccccc43)n2)c1 ZINC000031851589 568342130 /nfs/dbraw/zinc/34/21/30/568342130.db2.gz OXJDGWNWIICYKU-UHFFFAOYSA-N 0 0 365.374 3.880 20 5 FHBDRN CCCn1nccc1NC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 ZINC000031770423 568343109 /nfs/dbraw/zinc/34/31/09/568343109.db2.gz JLYTXBZOOUOVOU-UHFFFAOYSA-N 0 0 371.441 3.690 20 5 FHBDRN C[C@@H](Sc1ncnc2sccc21)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000003563299 568372148 /nfs/dbraw/zinc/37/21/48/568372148.db2.gz IXPMGZFEKXYDLK-SECBINFHSA-N 0 0 360.420 3.719 20 5 FHBDRN Cc1sc(C(=O)N2CCC[C@@H]2c2ccc3c(c2)OCCO3)cc1[N+](=O)[O-] ZINC000032452800 568390646 /nfs/dbraw/zinc/39/06/46/568390646.db2.gz AYVYOLLAOLZYQU-CYBMUJFWSA-N 0 0 374.418 3.713 20 5 FHBDRN C[C@H](CNC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-])CC(F)(F)F ZINC000412676633 568391565 /nfs/dbraw/zinc/39/15/65/568391565.db2.gz RUBCLTSXSYFMFH-ZETCQYMHSA-N 0 0 358.238 3.932 20 5 FHBDRN Cc1c(NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)cnn1CC(C)C ZINC000541994313 568392747 /nfs/dbraw/zinc/39/27/47/568392747.db2.gz XSHCPHGASAFBAX-UHFFFAOYSA-N 0 0 368.340 3.609 20 5 FHBDRN O=C(NCCc1ccc(Br)cc1Cl)c1ccc([N+](=O)[O-])o1 ZINC000569381867 568399877 /nfs/dbraw/zinc/39/98/77/568399877.db2.gz YBIXIFDUKVCMQE-UHFFFAOYSA-N 0 0 373.590 3.576 20 5 FHBDRN O=C(c1csc([N+](=O)[O-])c1)N(CC[NH+]1CCCCCC1)C1CCC1 ZINC000569523295 568404725 /nfs/dbraw/zinc/40/47/25/568404725.db2.gz HFASQPMEWWBETC-UHFFFAOYSA-N 0 0 351.472 3.527 20 5 FHBDRN C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])cc1Br)CC(F)(F)F ZINC000412678931 568411266 /nfs/dbraw/zinc/41/12/66/568411266.db2.gz OUFZYGLCKMJBRY-SSDOTTSWSA-N 0 0 369.137 3.676 20 5 FHBDRN COc1ccc(NC(=O)c2cnn(-c3cccc(Cl)c3)c2)cc1[N+](=O)[O-] ZINC000541998335 568411467 /nfs/dbraw/zinc/41/14/67/568411467.db2.gz CPKDMKSEOXCXLS-UHFFFAOYSA-N 0 0 372.768 3.695 20 5 FHBDRN COC(=O)c1ccccc1NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000032892047 568411858 /nfs/dbraw/zinc/41/18/58/568411858.db2.gz UZVHPLGYHYSWKW-UHFFFAOYSA-N 0 0 356.359 3.848 20 5 FHBDRN COc1cccc(Oc2ncccc2CNc2ccc([N+](=O)[O-])nc2)c1 ZINC000569773336 568422990 /nfs/dbraw/zinc/42/29/90/568422990.db2.gz QEGNQYUJEPCJFX-UHFFFAOYSA-N 0 0 352.350 3.798 20 5 FHBDRN C[C@@H](Cc1ccccc1F)C(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000569847945 568428893 /nfs/dbraw/zinc/42/88/93/568428893.db2.gz MHHWTZTVXFCGSD-ZDUSSCGKSA-N 0 0 369.396 3.753 20 5 FHBDRN COC(=O)c1cc(NCc2ccccc2[N+](=O)[O-])ccc1Br ZINC000569835309 568429279 /nfs/dbraw/zinc/42/92/79/568429279.db2.gz OFVAUJUXMKVCNT-UHFFFAOYSA-N 0 0 365.183 3.756 20 5 FHBDRN CC(C)(NS(=O)(=O)c1cc2ccccc2o1)c1ccccc1[N+](=O)[O-] ZINC000569904246 568435650 /nfs/dbraw/zinc/43/56/50/568435650.db2.gz ANDFOCRWVPJCDZ-UHFFFAOYSA-N 0 0 360.391 3.555 20 5 FHBDRN CC(C)(CNC(=O)c1cc(F)cc([N+](=O)[O-])c1)Oc1cc(F)cc(F)c1 ZINC000569914135 568436395 /nfs/dbraw/zinc/43/63/95/568436395.db2.gz QXHJTXIXVWPQFZ-UHFFFAOYSA-N 0 0 368.311 3.600 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2cc(OC)ccc2Cl)c1 ZINC000569942547 568438022 /nfs/dbraw/zinc/43/80/22/568438022.db2.gz ZAFDOSAIKBJOOW-UHFFFAOYSA-N 0 0 350.758 3.908 20 5 FHBDRN C[C@]1(c2ccccc2)CN(c2ncc([N+](=O)[O-])cc2C(F)(F)F)CCO1 ZINC000570025034 568441760 /nfs/dbraw/zinc/44/17/60/568441760.db2.gz OWTOCZQMWUPIQW-MRXNPFEDSA-N 0 0 367.327 3.761 20 5 FHBDRN CC1(C)CN(c2ccc(Br)cc2[N+](=O)[O-])[C@H]1[C@@H]1CCCO1 ZINC000569978550 568445552 /nfs/dbraw/zinc/44/55/52/568445552.db2.gz CKDXHGFPVAMBOU-KBPBESRZSA-N 0 0 355.232 3.751 20 5 FHBDRN CC(C)CCc1nc(Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)cs1 ZINC000570161087 568457646 /nfs/dbraw/zinc/45/76/46/568457646.db2.gz DPEDJUPDIBFZSV-UHFFFAOYSA-N 0 0 357.439 3.947 20 5 FHBDRN CC[C@@H](c1cccc(OC)c1)N(C)CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000570192493 568460233 /nfs/dbraw/zinc/46/02/33/568460233.db2.gz SNJLKGAGKYPSBV-KRWDZBQOSA-N 0 0 371.437 3.933 20 5 FHBDRN CC[C@H](C)Oc1cccc(NC(=O)NCCOc2ccc([N+](=O)[O-])cc2)c1 ZINC000570232657 568463908 /nfs/dbraw/zinc/46/39/08/568463908.db2.gz DEHXMGSPQMNSQL-AWEZNQCLSA-N 0 0 373.409 3.973 20 5 FHBDRN C[C@H](CNC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)CC(F)(F)F ZINC000412679879 568464692 /nfs/dbraw/zinc/46/46/92/568464692.db2.gz PPWDQCBYISBOEH-ZETCQYMHSA-N 0 0 356.247 3.515 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1cc(-c2cccc(F)c2)no1 ZINC000033168527 568466493 /nfs/dbraw/zinc/46/64/93/568466493.db2.gz MLKQLLGOGZLQRU-UHFFFAOYSA-N 0 0 355.325 3.661 20 5 FHBDRN COC(=O)c1cc(-c2nc([C@@H](C)Oc3ccccc3)no2)cc([N+](=O)[O-])c1 ZINC000570253405 568466550 /nfs/dbraw/zinc/46/65/50/568466550.db2.gz HNZOCOBGAIXVEG-LLVKDONJSA-N 0 0 369.333 3.571 20 5 FHBDRN COC(=O)c1cc(-c2nc([C@H](C)Oc3ccccc3)no2)cc([N+](=O)[O-])c1 ZINC000570253406 568466553 /nfs/dbraw/zinc/46/65/53/568466553.db2.gz HNZOCOBGAIXVEG-NSHDSACASA-N 0 0 369.333 3.571 20 5 FHBDRN COc1ccc(-c2noc(COc3ccc(C)cc3[N+](=O)[O-])n2)c(OC)c1 ZINC000007181333 568469260 /nfs/dbraw/zinc/46/92/60/568469260.db2.gz GFRVYVVDVYRBSC-UHFFFAOYSA-N 0 0 371.349 3.549 20 5 FHBDRN O=C(Nc1ccc2oc(C3CC3)nc2c1)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000033214897 568470767 /nfs/dbraw/zinc/47/07/67/568470767.db2.gz OAHXALNRIDEAHT-UHFFFAOYSA-N 0 0 367.317 3.594 20 5 FHBDRN Cc1nc2cccc(C(=O)N(Cc3ccc([N+](=O)[O-])cc3)C(C)C)c2[nH]1 ZINC000570422394 568475514 /nfs/dbraw/zinc/47/55/14/568475514.db2.gz AVSQLQJFIWDTHW-UHFFFAOYSA-N 0 0 352.394 3.830 20 5 FHBDRN COc1ccc(OC2CCN(c3c4c(ccc3[N+](=O)[O-])NCC4)CC2)cc1 ZINC000570469587 568482436 /nfs/dbraw/zinc/48/24/36/568482436.db2.gz PYSWJKUCPHEJIL-UHFFFAOYSA-N 0 0 369.421 3.619 20 5 FHBDRN Nc1nccc(C(=O)N[C@@H]2CCC[C@H](c3cccc(Cl)c3)C2)c1[N+](=O)[O-] ZINC000570410614 568483477 /nfs/dbraw/zinc/48/34/77/568483477.db2.gz IMOJVDLLHHPUPQ-GXTWGEPZSA-N 0 0 374.828 3.512 20 5 FHBDRN CCC[C@@H]1CCCN(C(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000570562167 568487230 /nfs/dbraw/zinc/48/72/30/568487230.db2.gz KDKSBZCTTIUOPL-CQSZACIVSA-N 0 0 358.442 3.840 20 5 FHBDRN COc1ccc([C@@H](C)NC(=O)C(C)(C)c2ccccc2[N+](=O)[O-])cc1F ZINC000570648666 568493585 /nfs/dbraw/zinc/49/35/85/568493585.db2.gz LCNBENOXVIVONG-GFCCVEGCSA-N 0 0 360.385 3.898 20 5 FHBDRN Cc1c(CNC(=O)NCC2CC(c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000570585199 568496199 /nfs/dbraw/zinc/49/61/99/568496199.db2.gz NMJOJCHAAPGSTM-UHFFFAOYSA-N 0 0 353.422 3.896 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NC[C@H]2SCCc3ccccc32)c1 ZINC000570699636 568500143 /nfs/dbraw/zinc/50/01/43/568500143.db2.gz MEMZWQXHYIHHQE-GOSISDBHSA-N 0 0 372.446 3.754 20 5 FHBDRN Cc1c(Cl)cc(S(=O)(=O)N2c3ccccc3C[C@@H]2C)cc1[N+](=O)[O-] ZINC000007416864 568505407 /nfs/dbraw/zinc/50/54/07/568505407.db2.gz QUGGPRMCKDTXTF-JTQLQIEISA-N 0 0 366.826 3.697 20 5 FHBDRN COc1ccc(OCc2nc(-c3ccc(Cl)cc3)no2)c([N+](=O)[O-])c1 ZINC000007441925 568511076 /nfs/dbraw/zinc/51/10/76/568511076.db2.gz LUVZAALUAWJIKK-UHFFFAOYSA-N 0 0 361.741 3.886 20 5 FHBDRN Cc1ccc([C@H]2C[C@H](C)N(C(=O)c3n[nH]c4ccc([N+](=O)[O-])cc43)C2)cc1 ZINC000570755265 568513484 /nfs/dbraw/zinc/51/34/84/568513484.db2.gz ORJLIDSRJPLOSH-ZFWWWQNUSA-N 0 0 364.405 3.798 20 5 FHBDRN Cc1ccc(-c2noc([C@@H]3CCN(c4ccccc4)C3)n2)cc1[N+](=O)[O-] ZINC000453089479 568514240 /nfs/dbraw/zinc/51/42/40/568514240.db2.gz KCZFLFIDSHSPEA-OAHLLOKOSA-N 0 0 350.378 3.947 20 5 FHBDRN COc1ccc(CN[C@@H](C)c2ncc(-c3ccccc3)n2C)cc1[N+](=O)[O-] ZINC000453084758 568515448 /nfs/dbraw/zinc/51/54/48/568515448.db2.gz NRROYIPTLSIEKF-AWEZNQCLSA-N 0 0 366.421 3.855 20 5 FHBDRN COc1cccc(N2CC[C@H]([NH2+][C@H](C)c3cccc([N+](=O)[O-])c3C)C2)c1 ZINC000482252445 568529131 /nfs/dbraw/zinc/52/91/31/568529131.db2.gz BANSREGPZVVFNY-CVEARBPZSA-N 0 0 355.438 3.841 20 5 FHBDRN O=C(COc1cccc([N+](=O)[O-])c1)N1CCCCC[C@H]1c1ccncc1 ZINC000049764120 568601960 /nfs/dbraw/zinc/60/19/60/568601960.db2.gz BIFDKNQONWUIAF-SFHVURJKSA-N 0 0 355.394 3.513 20 5 FHBDRN CC(=O)Nc1cc(Cl)ccc1NC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000570904565 568639679 /nfs/dbraw/zinc/63/96/79/568639679.db2.gz POOCPEXCIHVZRD-JTQLQIEISA-N 0 0 361.785 3.949 20 5 FHBDRN O=C(Nc1ccc2ccccc2n1)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000609490052 568686131 /nfs/dbraw/zinc/68/61/31/568686131.db2.gz NAZVBYPDXNQLFY-UHFFFAOYSA-N 0 0 360.329 3.649 20 5 FHBDRN O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1N[C@H]1C[C@@H]1c1c(F)cccc1Cl ZINC000738357120 598972105 /nfs/dbraw/zinc/97/21/05/598972105.db2.gz BYIHBWHKRYOIAL-ZANVPECISA-N 0 0 374.763 3.535 20 5 FHBDRN O=[N+]([O-])c1cnc(Sc2ccc(Cl)c(Cl)c2)c(-c2nn[nH]n2)c1 ZINC000823651437 599078151 /nfs/dbraw/zinc/07/81/51/599078151.db2.gz JQIWMZJVHMUQDG-UHFFFAOYSA-N 0 0 369.193 3.628 20 5 FHBDRN COc1ccc(C=Cc2ccc3c(cccc3[N+](=O)[O-])n2)cc1-c1nn[nH]n1 ZINC000737082750 599153259 /nfs/dbraw/zinc/15/32/59/599153259.db2.gz YXFXRZLTVXNTES-ALCCZGGFSA-N 0 0 374.360 3.502 20 5 FHBDRN CCOc1ccccc1[C@@H](CC)Nc1ccc([N+](=O)[O-])cc1-c1nn[nH]n1 ZINC000736652831 598246498 /nfs/dbraw/zinc/24/64/98/598246498.db2.gz CCPPEZMNCMAYDL-OAHLLOKOSA-N 0 0 368.397 3.737 20 5 FHBDRN Cc1c(CSCc2ccc(F)cc2-c2nn[nH]n2)cccc1[N+](=O)[O-] ZINC000737215298 598315102 /nfs/dbraw/zinc/31/51/02/598315102.db2.gz GPWSSHXHNPYSST-UHFFFAOYSA-N 0 0 359.386 3.656 20 5 FHBDRN O=[N+]([O-])c1cnc(Nc2cccc(-c3cccs3)c2)c(-c2nn[nH]n2)c1 ZINC000738374948 598501002 /nfs/dbraw/zinc/50/10/02/598501002.db2.gz UPFUHOHFBNMBRK-UHFFFAOYSA-N 0 0 365.378 3.642 20 5 FHBDRN Cc1ccccc1[C@H](Nc1ccc([N+](=O)[O-])cc1-c1nn[nH]n1)C(C)C ZINC000737419104 598756592 /nfs/dbraw/zinc/75/65/92/598756592.db2.gz CADFEECKKUMSTR-QGZVFWFLSA-N 0 0 352.398 3.893 20 5 FHBDRN COc1ccc([C@H](Nc2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])C(C)C)cc1 ZINC000821783133 599300145 /nfs/dbraw/zinc/30/01/45/599300145.db2.gz XKVMUIQBBGTQPI-QGZVFWFLSA-N 0 0 368.397 3.593 20 5 FHBDRN C[C@H](SCCOc1ccccc1[N+](=O)[O-])c1ccc(-c2nn[nH]n2)cc1 ZINC000736188165 599326007 /nfs/dbraw/zinc/32/60/07/599326007.db2.gz HXUKZTGXAFWUHQ-LBPRGKRZSA-N 0 0 371.422 3.648 20 5 FHBDRN O=C([O-])N1CCC[C@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000739926471 599860714 /nfs/dbraw/zinc/86/07/14/599860714.db2.gz JFHIIFDHQWPBCU-ZDUSSCGKSA-N 0 0 361.423 3.555 20 5 FHBDRN Cc1c(C[N@H+](CCC(=O)[O-])Cc2ccc(F)c(F)c2)cccc1[N+](=O)[O-] ZINC000593746573 600325399 /nfs/dbraw/zinc/32/53/99/600325399.db2.gz MASAWSQEWYCQJA-UHFFFAOYSA-N 0 0 364.348 3.658 20 5 FHBDRN O=C([O-])[C@H]1CCC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000263421149 604524724 /nfs/dbraw/zinc/52/47/24/604524724.db2.gz OXLVVHPHYGVNRV-CQSZACIVSA-N 0 0 350.758 3.557 20 5 FHBDRN C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)C(C)(C)C(=O)[O-] ZINC000833694265 604627768 /nfs/dbraw/zinc/62/77/68/604627768.db2.gz NKHDPTMJCUYIME-UHFFFAOYSA-N 0 0 352.774 3.803 20 5 FHBDRN Cc1c([C@H](C)[NH2+]Cc2ccc(CCNC(=O)[O-])cc2)cccc1[N+](=O)[O-] ZINC000829860371 604943293 /nfs/dbraw/zinc/94/32/93/604943293.db2.gz YBBVSNRNJJNYFY-AWEZNQCLSA-N 0 0 357.410 3.564 20 5 FHBDRN Cc1cc(N[C@@H](C)c2cccc(-c3nn[nH]n3)c2)c(Cl)cc1[N+](=O)[O-] ZINC000822209843 606137589 /nfs/dbraw/zinc/13/75/89/606137589.db2.gz ZSRAUIOCYVOMHB-JTQLQIEISA-N 0 0 358.789 3.910 20 5 FHBDRN O=[N+]([O-])c1c(-c2nn[nH]n2)ccnc1Nc1cccc(-c2cccs2)c1 ZINC000823624741 606707448 /nfs/dbraw/zinc/70/74/48/606707448.db2.gz HZCVUWXAZLXENG-UHFFFAOYSA-N 0 0 365.378 3.642 20 5 FHBDRN O=[N+]([O-])c1ccc(Oc2ncc(-c3nn[nH]n3)cc2Cl)c2ccccc21 ZINC000823645167 606802567 /nfs/dbraw/zinc/80/25/67/606802567.db2.gz OWNQHJCWFMKLKH-UHFFFAOYSA-N 0 0 368.740 3.769 20 5 FHBDRN O=[N+]([O-])c1ccc(Oc2ccc(-c3nn[nH]n3)cc2F)cc1C(F)(F)F ZINC000826499237 607934606 /nfs/dbraw/zinc/93/46/06/607934606.db2.gz ANBVJNMZFSMZDV-UHFFFAOYSA-N 0 0 369.234 3.725 20 5 FHBDRN CC[C@@H](C)n1ncc(Nc2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])c1C1CC1 ZINC000825081409 608098691 /nfs/dbraw/zinc/09/86/91/608098691.db2.gz IUEAUVOQKUIALD-SNVBAGLBSA-N 0 0 368.401 3.563 20 5 FHBDRN O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1Oc1ccc(-c2ccccc2)nc1 ZINC000826497905 608797876 /nfs/dbraw/zinc/79/78/76/608797876.db2.gz YGLLNTPFGXUGBC-UHFFFAOYSA-N 0 0 360.333 3.629 20 5 FHBDRN O=[N+]([O-])c1ccc(CNc2ccc(Cl)c(-c3nn[nH]n3)c2)c(Cl)c1 ZINC000826498377 609444883 /nfs/dbraw/zinc/44/48/83/609444883.db2.gz SEAJKEBLRGMXAS-UHFFFAOYSA-N 0 0 365.180 3.694 20 5 FHBDRN O=[N+]([O-])c1ccc(CSc2ccc(-c3nn[nH]n3)cc2F)c(Cl)c1 ZINC000826498302 609450058 /nfs/dbraw/zinc/45/00/58/609450058.db2.gz OTUQHHLIIJDKBD-UHFFFAOYSA-N 0 0 365.777 3.860 20 5 FHBDRN O=C(N[C@@H]1CCOC2(CCC2)C1)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000582949610 936320277 /nfs/dbraw/zinc/32/02/77/936320277.db2.gz DOETYJPWORLKNG-IAGOWNOFSA-N 0 0 373.453 3.586 20 5 FHBDRN COC(=O)C(C)(C)c1ccc(NC(=O)[C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000572903763 936328287 /nfs/dbraw/zinc/32/82/87/936328287.db2.gz XOWLINKMSOAFKE-CYBMUJFWSA-N 0 0 370.405 3.788 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1OS(=O)(=O)Cc1cc(Cl)ccc1F ZINC000755285190 936330541 /nfs/dbraw/zinc/33/05/41/936330541.db2.gz JTCPJAWSZNLJMA-UHFFFAOYSA-N 0 0 359.762 3.605 20 5 FHBDRN COc1cc(-c2nc(Cc3ccc4ccccc4n3)no2)ccc1[N+](=O)[O-] ZINC000612894067 936336260 /nfs/dbraw/zinc/33/62/60/936336260.db2.gz PMDUDQCLCWQYOI-UHFFFAOYSA-N 0 0 362.345 3.792 20 5 FHBDRN Cc1cc(NC(=O)N(C)Cc2nc3c(s2)CCCC3)ccc1[N+](=O)[O-] ZINC000153627971 936335715 /nfs/dbraw/zinc/33/57/15/936335715.db2.gz PGZLFYVQOJFNQC-UHFFFAOYSA-N 0 0 360.439 3.902 20 5 FHBDRN COCc1ccc([C@@H]2CCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])o1 ZINC000162017316 936339914 /nfs/dbraw/zinc/33/99/14/936339914.db2.gz JJDDRKLZXWLSBC-YRYLYKBFSA-N 0 0 356.378 3.711 20 5 FHBDRN COc1ccc(COCc2nc(-c3ccc([N+](=O)[O-])cc3C)no2)cc1 ZINC000612936588 936346504 /nfs/dbraw/zinc/34/65/04/936346504.db2.gz JDGODAXVJSWEMO-UHFFFAOYSA-N 0 0 355.350 3.679 20 5 FHBDRN COc1ccc2c(c1)OC[C@@H](c1nc(-c3ccc([N+](=O)[O-])cc3C)no1)C2 ZINC000612935445 936346777 /nfs/dbraw/zinc/34/67/77/936346777.db2.gz PFMBZPPOYVWZEE-ZDUSSCGKSA-N 0 0 367.361 3.681 20 5 FHBDRN Cc1ccc(CCc2nc(Cc3ccc([N+](=O)[O-])cn3)no2)cc1Cl ZINC000612968137 936351485 /nfs/dbraw/zinc/35/14/85/936351485.db2.gz BHCGZLACFDXCRQ-UHFFFAOYSA-N 0 0 358.785 3.711 20 5 FHBDRN Cc1nc([N+](=O)[O-])c(Br)n1Cc1cc(-c2ccccc2)no1 ZINC000102202195 936376560 /nfs/dbraw/zinc/37/65/60/936376560.db2.gz FTLKBNWRNQTJHV-UHFFFAOYSA-N 0 0 363.171 3.566 20 5 FHBDRN CN(Cc1cn(C)nc1C(F)(F)F)c1ccc2ncccc2c1[N+](=O)[O-] ZINC000178746966 936380574 /nfs/dbraw/zinc/38/05/74/936380574.db2.gz QTTFTVADAVJOIF-UHFFFAOYSA-N 0 0 365.315 3.532 20 5 FHBDRN Cc1sc2nc3n(c(=O)c2c1C)CC/C3=C/c1cccc([N+](=O)[O-])c1 ZINC000005127555 936382358 /nfs/dbraw/zinc/38/23/58/936382358.db2.gz MRFPQXHARZTBNV-JYRVWZFOSA-N 0 0 353.403 3.927 20 5 FHBDRN CCOc1cc(C(=O)N2CCc3ccc(C)cc32)c([N+](=O)[O-])cc1OC ZINC000122024071 936386600 /nfs/dbraw/zinc/38/66/00/936386600.db2.gz XJDGCNSEZLTOEH-UHFFFAOYSA-N 0 0 356.378 3.513 20 5 FHBDRN C[C@@H]1CCC[N@H+](Cc2ccc(NC(=O)c3cc([O-])ccc3[N+](=O)[O-])cc2)C1 ZINC000506709269 945065353 /nfs/dbraw/zinc/06/53/53/945065353.db2.gz XNNHYEGSFDPOAU-CQSZACIVSA-N 0 0 369.421 3.785 20 5 FHBDRN CCN(CCC1CC1)C(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000546158344 945067492 /nfs/dbraw/zinc/06/74/92/945067492.db2.gz HIQRRUXZWGUVMW-UHFFFAOYSA-N 0 0 360.332 3.798 20 5 FHBDRN CCCC[C@H]1CCC[C@@H]1NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000110722922 945068613 /nfs/dbraw/zinc/06/86/13/945068613.db2.gz MYURSQNZYDZUTA-KSSFIOAISA-N 0 0 356.426 3.869 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)Nc1cc(C)n([C@@H](C)CC)n1 ZINC000439903810 945068646 /nfs/dbraw/zinc/06/86/46/945068646.db2.gz ROSSUBSNEZSXSI-NSHDSACASA-N 0 0 361.402 3.535 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)cnc1NC[C@@H](O)c1cccc(C(F)(F)F)c1 ZINC000153738597 937079757 /nfs/dbraw/zinc/07/97/57/937079757.db2.gz UDHQKLOIVBFELN-GFCCVEGCSA-N 0 0 361.707 3.808 20 5 FHBDRN O=C(Nc1cccc2c[nH]nc21)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000079409073 937082247 /nfs/dbraw/zinc/08/22/47/937082247.db2.gz XEPXIHHFZUQQGK-UHFFFAOYSA-N 0 0 350.256 3.742 20 5 FHBDRN COc1ccc2c(c1)CC[C@@H](NC(=O)Nc1cc([N+](=O)[O-])c(C)cc1C)C2 ZINC000613300163 937086396 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929291714 /nfs/dbraw/zinc/29/17/14/929291714.db2.gz OZIANQOQWYGJAT-GFCCVEGCSA-N 0 0 364.348 3.594 20 5 FHBDRN CCS[C@H]1CCC[C@@H](NC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)C1 ZINC000134812861 929294902 /nfs/dbraw/zinc/29/49/02/929294902.db2.gz KSHCRVXOVCHJCB-KGLIPLIRSA-N 0 0 374.466 3.575 20 5 FHBDRN C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCc2ccc(Cl)cc2C1 ZINC000535628362 929304784 /nfs/dbraw/zinc/30/47/84/929304784.db2.gz ORKJHNVNPRRUJC-GFCCVEGCSA-N 0 0 359.813 3.634 20 5 FHBDRN Cc1cc(NC(=O)N2CC(Cc3ccc(F)c(F)c3)C2)ccc1[N+](=O)[O-] ZINC000547752228 929316360 /nfs/dbraw/zinc/31/63/60/929316360.db2.gz AODPCJCOQKNQQH-UHFFFAOYSA-N 0 0 361.348 3.888 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(N2CCS[C@H](c3ccccc3)C2)c1 ZINC000611762115 937322752 /nfs/dbraw/zinc/32/27/52/937322752.db2.gz NBKXMXNTNRXWKL-KRWDZBQOSA-N 0 0 358.419 3.676 20 5 FHBDRN CCN(CC)C(=O)c1ccccc1NC(=O)Cc1cccc([N+](=O)[O-])c1C ZINC000162838236 937323544 /nfs/dbraw/zinc/32/35/44/937323544.db2.gz MFYVDJAWJQQSRA-UHFFFAOYSA-N 0 0 369.421 3.566 20 5 FHBDRN CNc1ccc(C(=O)N2CC[C@H](c3ccccc3)[C@H](C)C2)cc1[N+](=O)[O-] ZINC000610243037 929360385 /nfs/dbraw/zinc/36/03/85/929360385.db2.gz MPNUAAGXGSPNOX-PBHICJAKSA-N 0 0 353.422 3.902 20 5 FHBDRN O=C(NCCc1c[nH]c2ccc(F)cc12)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000609737149 929368215 /nfs/dbraw/zinc/36/82/15/929368215.db2.gz CQOURKWPSLWPKD-UHFFFAOYSA-N 0 0 367.336 3.934 20 5 FHBDRN CC(=O)c1ccc(OCCCC(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 ZINC000015790871 929378983 /nfs/dbraw/zinc/37/89/83/929378983.db2.gz NZSUIWNSIAFMHE-UHFFFAOYSA-N 0 0 356.378 3.904 20 5 FHBDRN Cc1cc(C)c2cc(C(=O)NCCc3ccc([N+](=O)[O-])cc3)sc2n1 ZINC001125311556 929382119 /nfs/dbraw/zinc/38/21/19/929382119.db2.gz LYQZTFIMVYUFII-UHFFFAOYSA-N 0 0 355.419 3.794 20 5 FHBDRN CCc1cccc2c1N(C(=O)c1cc(=O)[nH]c3ccc([N+](=O)[O-])cc31)CC2 ZINC000609762499 929407309 /nfs/dbraw/zinc/40/73/09/929407309.db2.gz NFEDVBMEKLNZCE-UHFFFAOYSA-N 0 0 363.373 3.614 20 5 FHBDRN C[C@@H]1C[C@H](c2cccnc2)N(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000359868364 929415278 /nfs/dbraw/zinc/41/52/78/929415278.db2.gz HNWDWPJTCUOGBY-CXAGYDPISA-N 0 0 365.393 3.623 20 5 FHBDRN CCOc1ccc(C(=O)N(C)[C@H](C)c2ccc(OC)cc2)cc1[N+](=O)[O-] ZINC000248260013 937329552 /nfs/dbraw/zinc/32/95/52/937329552.db2.gz VJJUDQUAXXREIP-CYBMUJFWSA-N 0 0 358.394 3.835 20 5 FHBDRN CC1(CNC(=O)[C@H]2C[C@H]2c2cccc([N+](=O)[O-])c2)Cc2ccccc2C1 ZINC001266353902 929449223 /nfs/dbraw/zinc/44/92/23/929449223.db2.gz GVYIVCOTCAFITF-OALUTQOASA-N 0 0 350.418 3.620 20 5 FHBDRN CC(C)C[C@@H]1CCCN(C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)C1 ZINC000134867295 929450450 /nfs/dbraw/zinc/45/04/50/929450450.db2.gz VNHYLLZEFQDYRC-HNNXBMFYSA-N 0 0 356.426 3.679 20 5 FHBDRN Cc1nn(C(C)(C)C)cc1[C@@H](C)NC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000154890325 929454725 /nfs/dbraw/zinc/45/47/25/929454725.db2.gz DPYJDBODWYDFGI-SNVBAGLBSA-N 0 0 364.833 3.999 20 5 FHBDRN O=C(COC1CCCCC1)N1CCS[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000498135680 937336387 /nfs/dbraw/zinc/33/63/87/937336387.db2.gz NGEJWJDKOIUXKF-KRWDZBQOSA-N 0 0 350.440 3.518 20 5 FHBDRN O=C(c1cc2cccc([N+](=O)[O-])c2[nH]1)N(C[C@H]1CCCO1)C1CCCC1 ZINC000610243298 929530536 /nfs/dbraw/zinc/53/05/36/929530536.db2.gz XEWFWUHZBOXPRM-OAHLLOKOSA-N 0 0 357.410 3.640 20 5 FHBDRN CN(C(=O)c1cc(F)ccc1[N+](=O)[O-])[C@@H](c1ccccc1)c1ccccn1 ZINC000360024797 929603359 /nfs/dbraw/zinc/60/33/59/929603359.db2.gz WDYLYOHGMOLBBD-IBGZPJMESA-N 0 0 365.364 3.991 20 5 FHBDRN O=C(c1ccc(Cl)cc1[N+](=O)[O-])N1CC[C@H](n2cc3ccccc3n2)C1 ZINC000360022631 929603761 /nfs/dbraw/zinc/60/37/61/929603761.db2.gz PVZYPNXJTHOHJU-AWEZNQCLSA-N 0 0 370.796 3.685 20 5 FHBDRN Cc1ccc(-c2nc(NC(=O)c3cc(Cl)cc([N+](=O)[O-])c3)n[nH]2)cc1 ZINC000134908338 929611126 /nfs/dbraw/zinc/61/11/26/929611126.db2.gz ASCMVLMIOPFEOJ-UHFFFAOYSA-N 0 0 357.757 3.594 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)Nc2cccc(F)c2Cl)c1C ZINC000579883957 929616530 /nfs/dbraw/zinc/61/65/30/929616530.db2.gz GTNWLPYEDDXZCT-UHFFFAOYSA-N 0 0 358.778 3.805 20 5 FHBDRN O=C(NC[C@H]1CCCO[C@@H]1c1ccccc1)Nc1ccc([N+](=O)[O-])cc1 ZINC000146216890 937345795 /nfs/dbraw/zinc/34/57/95/937345795.db2.gz GEVUBICUHHXZBD-CRAIPNDOSA-N 0 0 355.394 3.884 20 5 FHBDRN CCc1ccc([C@H]2CCCCCN2C(=O)CCn2cc([N+](=O)[O-])nc2C)o1 ZINC000155021915 929630432 /nfs/dbraw/zinc/63/04/32/929630432.db2.gz FLGHUMXWVWDRGF-MRXNPFEDSA-N 0 0 374.441 3.789 20 5 FHBDRN O=[N+]([O-])c1ccc2oc(CNC3(c4ccccc4)CCOCC3)nc2c1 ZINC000083172559 929638302 /nfs/dbraw/zinc/63/83/02/929638302.db2.gz VSNGVMIILMBKEL-UHFFFAOYSA-N 0 0 353.378 3.532 20 5 FHBDRN CCN(C[C@@H]1CCCO1)C(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000275632209 929641622 /nfs/dbraw/zinc/64/16/22/929641622.db2.gz IMDPVCZVDPGYGS-HNNXBMFYSA-N 0 0 350.418 3.735 20 5 FHBDRN CC(C)c1ccc(C(=O)N[C@@H](C)c2ccc3c(c2)CC(=O)N3)cc1[N+](=O)[O-] ZINC000187294169 929674409 /nfs/dbraw/zinc/67/44/09/929674409.db2.gz SIHZPRHECIOZEC-LBPRGKRZSA-N 0 0 367.405 3.704 20 5 FHBDRN COc1c(O)c(-c2nc(=O)c3c4c(sc3[nH]2)CCCC4)ccc1[N+](=O)[O-] ZINC000278203455 937350803 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Cc1ccc(-c2ccc(C(=O)OCCn3ccc([N+](=O)[O-])n3)c(F)c2)cc1 ZINC000748124649 929774252 /nfs/dbraw/zinc/77/42/52/929774252.db2.gz HJVQMIKBMSVBMJ-UHFFFAOYSA-N 0 0 369.352 3.763 20 5 FHBDRN Cc1ccc(-c2nc(C(=O)N(C)c3ccc([N+](=O)[O-])cc3)cs2)n1C ZINC000121082231 929774958 /nfs/dbraw/zinc/77/49/58/929774958.db2.gz RHCHYEGGIOVFKZ-UHFFFAOYSA-N 0 0 356.407 3.642 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(CC(F)(F)F)c2ccccc21 ZINC000471470208 929831890 /nfs/dbraw/zinc/83/18/90/929831890.db2.gz HDHNNNVSWNCSHZ-UHFFFAOYSA-N 0 0 365.311 3.624 20 5 FHBDRN Cc1ccc(C)c(OC[C@H](O)COc2ccc([N+](=O)[O-])c3ncccc23)c1 ZINC000471470077 929833526 /nfs/dbraw/zinc/83/35/26/929833526.db2.gz GFVMBZFFZAHLHQ-OAHLLOKOSA-N 0 0 368.389 3.579 20 5 FHBDRN O=[N+]([O-])c1ccc(OCCSCc2nccn2CC(F)(F)F)cc1 ZINC000610315586 929864455 /nfs/dbraw/zinc/86/44/55/929864455.db2.gz LWCFGOJDIIUFPZ-UHFFFAOYSA-N 0 0 361.345 3.666 20 5 FHBDRN COc1ccc(NC(=O)c2oc(C3CC3)nc2C(F)F)cc1[N+](=O)[O-] ZINC001266541195 929917670 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O=[N+]([O-])c1cnn(C[C@H](O)CSc2ccc(C3CCCCC3)cc2)c1 ZINC000610335922 930015144 /nfs/dbraw/zinc/01/51/44/930015144.db2.gz DNWJNIBMXYTYPY-KRWDZBQOSA-N 0 0 361.467 3.992 20 5 FHBDRN O=C(Nc1c(O)cccc1F)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000610339834 930031978 /nfs/dbraw/zinc/03/19/78/930031978.db2.gz VNQRCQAXVALUQQ-UHFFFAOYSA-N 0 0 359.338 3.815 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](C)[C@H]2OCCc3sccc32)c1C ZINC000891147681 930060855 /nfs/dbraw/zinc/06/08/55/930060855.db2.gz RZEHWYOQZYASQG-YVEFUNNKSA-N 0 0 360.435 3.705 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)N[C@H](CC1CC1)c1ccccc1 ZINC000610349100 930065055 /nfs/dbraw/zinc/06/50/55/930065055.db2.gz UVEPFGCZIFNMHP-LJQANCHMSA-N 0 0 353.422 3.978 20 5 FHBDRN CO[C@@H]1C[C@@H](N(C)C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)C12CCC2 ZINC000458496611 937385973 /nfs/dbraw/zinc/38/59/73/937385973.db2.gz IHHPMFNLAAAYKI-IAOVAPTHSA-N 0 0 361.442 3.563 20 5 FHBDRN C[C@@H](c1ncc(C(C)(C)C)o1)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000177684684 930111111 /nfs/dbraw/zinc/11/11/11/930111111.db2.gz OMMDHTCJCRMVBZ-STQMWFEESA-N 0 0 359.430 3.523 20 5 FHBDRN Cc1ccc(NC(=O)N2CCN([C@H](C)c3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000543843727 930114120 /nfs/dbraw/zinc/11/41/20/930114120.db2.gz WMAZRMUEZMSMDB-MRXNPFEDSA-N 0 0 368.437 3.814 20 5 FHBDRN COc1cc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc(-n2cccn2)c1 ZINC000471521682 930133506 /nfs/dbraw/zinc/13/35/06/930133506.db2.gz HWJBAPJBQZBQRU-UHFFFAOYSA-N 0 0 372.768 3.695 20 5 FHBDRN CC(C)C(=O)Nc1ccc(C(=O)COc2cc(F)cc([N+](=O)[O-])c2)cc1 ZINC000135362219 937392626 /nfs/dbraw/zinc/39/26/26/937392626.db2.gz FSMOVJKKZNBLJP-UHFFFAOYSA-N 0 0 360.341 3.590 20 5 FHBDRN CC[C@@H](NC(=O)N[C@H]1Cc2cccc(OC)c2C1)c1cccc([N+](=O)[O-])c1 ZINC000458495579 937387748 /nfs/dbraw/zinc/38/77/48/937387748.db2.gz HQTAAQFPZGLBRO-MAUKXSAKSA-N 0 0 369.421 3.521 20 5 FHBDRN CC[C@H](NC(=O)N(C)[C@H]1C[C@@H](OC)C12CCC2)c1cccc([N+](=O)[O-])c1 ZINC000458496674 937388752 /nfs/dbraw/zinc/38/87/52/937388752.db2.gz IMFGMCAXSNALSQ-YESZJQIVSA-N 0 0 361.442 3.645 20 5 FHBDRN Cc1ccc(Br)cc1C(=O)NCc1cccc([N+](=O)[O-])c1C ZINC000319146492 930182981 /nfs/dbraw/zinc/18/29/81/930182981.db2.gz GEHRZMBIVBBFSN-UHFFFAOYSA-N 0 0 363.211 3.904 20 5 FHBDRN CC1(C)[C@H](NC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)[C@@H]2CCO[C@@H]21 ZINC000275762018 930186221 /nfs/dbraw/zinc/18/62/21/930186221.db2.gz KNCAMGZTBJHONJ-KPOBHBOGSA-N 0 0 362.429 3.637 20 5 FHBDRN C[C@@H](C(=O)O[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F)C1CC1 ZINC000748143137 930187038 /nfs/dbraw/zinc/18/70/38/930187038.db2.gz NXVWNLPGZPZWRM-BDAKNGLRSA-N 0 0 374.315 3.530 20 5 FHBDRN CC(C)COc1cccc(OCC(=O)OCc2cccc([N+](=O)[O-])c2)c1 ZINC001125418406 930217180 /nfs/dbraw/zinc/21/71/80/930217180.db2.gz FUZHQUBUDJDFKY-UHFFFAOYSA-N 0 0 359.378 3.752 20 5 FHBDRN O=C(CNc1ccc(Cl)c(Cl)c1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000560948848 930252394 /nfs/dbraw/zinc/25/23/94/930252394.db2.gz LRELDKNZMARRND-UHFFFAOYSA-N 0 0 366.204 3.903 20 5 FHBDRN CCOC(=O)c1cc(NCc2cccc(-c3ncc[nH]3)c2)ccc1[N+](=O)[O-] ZINC000580117530 930265481 /nfs/dbraw/zinc/26/54/81/930265481.db2.gz ITXMKGWHNYIQIF-UHFFFAOYSA-N 0 0 366.377 3.774 20 5 FHBDRN COc1ccc2c(c1)N(C(=O)c1cccc(Cl)c1[N+](=O)[O-])C[C@H](C)O2 ZINC000175901256 930270226 /nfs/dbraw/zinc/27/02/26/930270226.db2.gz UIZWIMOMCNVOEA-JTQLQIEISA-N 0 0 362.769 3.685 20 5 FHBDRN Cc1c(CO)cc([N+](=O)[O-])c(NC2CC(c3ccccc3)C2)c1[N+](=O)[O-] ZINC000728286926 930274418 /nfs/dbraw/zinc/27/44/18/930274418.db2.gz LKTXPCUIEDRZDX-UHFFFAOYSA-N 0 0 357.366 3.662 20 5 FHBDRN CC(C)OCCCN(C)C(=O)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000278234601 937401485 /nfs/dbraw/zinc/40/14/85/937401485.db2.gz UGVGHJTZXCZQJC-UHFFFAOYSA-N 0 0 352.434 3.981 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCC(c3c[nH]c4ncccc34)CC2)c([N+](=O)[O-])c1 ZINC000064915226 930310194 /nfs/dbraw/zinc/31/01/94/930310194.db2.gz XTBMQSYVSLQRBL-UHFFFAOYSA-N 0 0 367.365 3.763 20 5 FHBDRN NC(=O)c1ccc(NCCc2c(Cl)cccc2Cl)c([N+](=O)[O-])c1 ZINC000064915788 930313058 /nfs/dbraw/zinc/31/30/58/930313058.db2.gz QLSUQZYVSVLZKU-UHFFFAOYSA-N 0 0 354.193 3.655 20 5 FHBDRN C[C@@H]1CN(C(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)C[C@H](C(F)(F)F)O1 ZINC000610398214 930355194 /nfs/dbraw/zinc/35/51/94/930355194.db2.gz ARRFHEYDAMRGJI-QMTHXVAHSA-N 0 0 374.359 3.684 20 5 FHBDRN O=C(NCCNc1ccc([N+](=O)[O-])cc1)N[C@@H](CC1CC1)c1ccccc1 ZINC000610400626 930370565 /nfs/dbraw/zinc/37/05/65/930370565.db2.gz SVGBUNCEWPZPOA-IBGZPJMESA-N 0 0 368.437 3.847 20 5 FHBDRN COc1cccc([N+](=O)[O-])c1N1CC[C@@H](C(F)(F)F)C2(CCOCC2)C1 ZINC000579494142 930375059 /nfs/dbraw/zinc/37/50/59/930375059.db2.gz GCQRYJCSUYOKKT-CQSZACIVSA-N 0 0 374.359 3.789 20 5 FHBDRN Cc1ccc(NCCCNC(=O)N2C3CCCC2CCC3)c([N+](=O)[O-])c1 ZINC000610404121 930382006 /nfs/dbraw/zinc/38/20/06/930382006.db2.gz KTYHMYGDXRDCSP-UHFFFAOYSA-N 0 0 360.458 3.822 20 5 FHBDRN C[C@H](OC(=O)Cc1ccc([N+](=O)[O-])cc1Cl)c1nc2ccccc2n1C ZINC000175916787 930398379 /nfs/dbraw/zinc/39/83/79/930398379.db2.gz IMPAEFSITIEOTI-NSHDSACASA-N 0 0 373.796 3.982 20 5 FHBDRN O=C(NC[C@@H]1COc2ccccc21)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000580253670 930407725 /nfs/dbraw/zinc/40/77/25/930407725.db2.gz ICTCNDBZMDMASY-OAHLLOKOSA-N 0 0 370.408 3.587 20 5 FHBDRN COc1cccc(Br)c1OCc1ccc([N+](=O)[O-])c(OC)c1 ZINC000580260801 930411130 /nfs/dbraw/zinc/41/11/30/930411130.db2.gz FJHOWQOVLYNHSW-UHFFFAOYSA-N 0 0 368.183 3.954 20 5 FHBDRN C[C@@H](C(=O)Nc1cc(-c2ccsc2)nn1C)c1cccc([N+](=O)[O-])c1 ZINC000580282619 930434779 /nfs/dbraw/zinc/43/47/79/930434779.db2.gz XKMCZCZOSAZUOG-LLVKDONJSA-N 0 0 356.407 3.799 20 5 FHBDRN CO[C@@H](C)CCNC(=O)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12 ZINC000275827573 930494905 /nfs/dbraw/zinc/49/49/05/930494905.db2.gz NUVOOIXAVOURNO-JTQLQIEISA-N 0 0 360.360 3.527 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(OCCOc2cccc3ccccc32)c1 ZINC000064927877 930502804 /nfs/dbraw/zinc/50/28/04/930502804.db2.gz UUKRIXWRIHJVOU-UHFFFAOYSA-N 0 0 367.357 3.992 20 5 FHBDRN O=C(Nc1c[nH]nc1-c1ccccc1F)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000548078703 930504575 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FHBDRN Cc1ccc(C(=O)Nc2ccc(F)cc2OC2CCOCC2)cc1[N+](=O)[O-] ZINC000561132276 930720633 /nfs/dbraw/zinc/72/06/33/930720633.db2.gz SOCGCCFKIWEWIT-UHFFFAOYSA-N 0 0 374.368 3.852 20 5 FHBDRN CCc1nc(COC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)cs1 ZINC000023766493 930720795 /nfs/dbraw/zinc/72/07/95/930720795.db2.gz SUYFAAPBNSTIMY-UHFFFAOYSA-N 0 0 361.423 3.571 20 5 FHBDRN Cc1cc(NC(=O)c2scnc2C2CC2)n(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000119149493 930748582 /nfs/dbraw/zinc/74/85/82/930748582.db2.gz ASGGJRNPRSHSRA-UHFFFAOYSA-N 0 0 369.406 3.675 20 5 FHBDRN Cc1noc(C)c1[C@H](C)CNC(=O)c1c(C)cc(Cl)cc1[N+](=O)[O-] ZINC000275897833 930754511 /nfs/dbraw/zinc/75/45/11/930754511.db2.gz SWMZUMLRWDCUHO-SECBINFHSA-N 0 0 351.790 3.695 20 5 FHBDRN O=[N+]([O-])c1cc2c(ncnc2N2CCC[C@H]2Cc2cccc(F)c2)s1 ZINC000561137886 930775342 /nfs/dbraw/zinc/77/53/42/930775342.db2.gz LARXTOZPRWUKQZ-ZDUSSCGKSA-N 0 0 358.398 3.950 20 5 FHBDRN CCN(c1ccc2[nH]ccc2c1)S(=O)(=O)c1c(C)cccc1[N+](=O)[O-] ZINC000471586902 930779176 /nfs/dbraw/zinc/77/91/76/930779176.db2.gz SPXVPLLVFWYAFF-UHFFFAOYSA-N 0 0 359.407 3.600 20 5 FHBDRN CC(=O)c1ccc(OCC(=O)Nc2ccc(C)cc2Cl)c([N+](=O)[O-])c1 ZINC000119174276 930814787 /nfs/dbraw/zinc/81/47/87/930814787.db2.gz GZRLUSCHLQUSRK-UHFFFAOYSA-N 0 0 362.769 3.777 20 5 FHBDRN Cc1ccc(Br)cc1NC(=O)c1cc([N+](=O)[O-])cnc1C ZINC000046373097 930875721 /nfs/dbraw/zinc/87/57/21/930875721.db2.gz YJJGCVJKNFQFIF-UHFFFAOYSA-N 0 0 350.172 3.621 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)Nc2cc(C3CC3)nc(C)n2)cc1SC ZINC000430496854 930891884 /nfs/dbraw/zinc/89/18/84/930891884.db2.gz QJEKCMUMPOLTEJ-UHFFFAOYSA-N 0 0 374.422 3.553 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)c1c(F)cccc1[N+](=O)[O-] ZINC001266630629 930912787 /nfs/dbraw/zinc/91/27/87/930912787.db2.gz ARANBYDVYMKCFF-UHFFFAOYSA-N 0 0 373.218 3.913 20 5 FHBDRN Cc1cccc([C@H]2CCCN2C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)n1 ZINC000119235109 930929911 /nfs/dbraw/zinc/92/99/11/930929911.db2.gz TXPYTEOWSZPPEG-QGZVFWFLSA-N 0 0 359.813 3.858 20 5 FHBDRN CN(C)c1ccccc1CN(C)c1cc(C(F)(F)F)ncc1[N+](=O)[O-] ZINC000580620993 930934529 /nfs/dbraw/zinc/93/45/29/930934529.db2.gz UVZQETVIOCLITN-UHFFFAOYSA-N 0 0 354.332 3.711 20 5 FHBDRN Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)c1cccc(C)c1[N+](=O)[O-] ZINC000050384184 930978046 /nfs/dbraw/zinc/97/80/46/930978046.db2.gz PCGATJOVLZBQST-UHFFFAOYSA-N 0 0 369.421 3.850 20 5 FHBDRN Cc1ccc(C(=O)Nc2ccc([N+](=O)[O-])c(C)n2)c(Br)c1 ZINC000119277603 931018804 /nfs/dbraw/zinc/01/88/04/931018804.db2.gz RRVXJLKLUPEVIC-UHFFFAOYSA-N 0 0 350.172 3.621 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)c1nnc(-c2ccccc2F)n1C ZINC000579778474 931019181 /nfs/dbraw/zinc/01/91/81/931019181.db2.gz UOHXZFZHYMPZAK-UHFFFAOYSA-N 0 0 369.400 3.944 20 5 FHBDRN CC(=O)Nc1cc(C(=O)Nc2cc([N+](=O)[O-])ccc2NC(C)C)ccc1C ZINC000580698357 931025287 /nfs/dbraw/zinc/02/52/87/931025287.db2.gz PTWHGOKLBKFBQQ-UHFFFAOYSA-N 0 0 370.409 3.934 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])S(=O)(=O)c1cccc2ccccc21 ZINC000083981347 931063864 /nfs/dbraw/zinc/06/38/64/931063864.db2.gz MRDVTCXJJVPAAD-UHFFFAOYSA-N 0 0 356.403 3.569 20 5 FHBDRN CC(C)c1cccc(CNC(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)c1 ZINC000548132862 931074776 /nfs/dbraw/zinc/07/47/76/931074776.db2.gz XVYCSBVEDMQNPF-UHFFFAOYSA-N 0 0 353.422 3.986 20 5 FHBDRN O=C(Nc1ccc2cc([N+](=O)[O-])ccc2n1)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000160616487 931075085 /nfs/dbraw/zinc/07/50/85/931075085.db2.gz OWZQIFYZLAMKNA-UHFFFAOYSA-N 0 0 372.724 3.957 20 5 FHBDRN COC1(CNC(=O)c2cc(F)cc3c(=O)c4cc(F)ccc4[nH]c23)CCC1 ZINC000275953630 931094234 /nfs/dbraw/zinc/09/42/34/931094234.db2.gz KYXWGDQZKXUNDM-UHFFFAOYSA-N 0 0 372.371 3.671 20 5 FHBDRN CCCCCN(CCO)C(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000275945691 931094841 /nfs/dbraw/zinc/09/48/41/931094841.db2.gz JZLZPDPKKVPELI-UHFFFAOYSA-N 0 0 352.434 3.718 20 5 FHBDRN CC1(C)C[C@@H](NC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)CCO1 ZINC000275966756 931107580 /nfs/dbraw/zinc/10/75/80/931107580.db2.gz NBQLYGICUCIWFG-AWEZNQCLSA-N 0 0 350.418 3.781 20 5 FHBDRN Cc1cc(C(=O)O[C@H](c2cccnc2)c2ccccc2[N+](=O)[O-])cc(C)n1 ZINC001266649523 931133258 /nfs/dbraw/zinc/13/32/58/931133258.db2.gz NCHVZNHAIUMTQH-LJQANCHMSA-N 0 0 363.373 3.948 20 5 FHBDRN Cc1ccc(OC2CCN(C(=O)c3csc([N+](=O)[O-])c3)CC2)cc1C ZINC000046399632 931228804 /nfs/dbraw/zinc/22/88/04/931228804.db2.gz VCAKLHQUKTWVTJ-UHFFFAOYSA-N 0 0 360.435 3.957 20 5 FHBDRN O=C(Nc1ccc(F)cc1-c1nc(C2CC2)no1)c1csc([N+](=O)[O-])c1 ZINC000471623377 931236046 /nfs/dbraw/zinc/23/60/46/931236046.db2.gz AZJJMLGMQOOJCL-UHFFFAOYSA-N 0 0 374.353 3.975 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)c2cccc(OC(F)F)c2)cc1[N+](=O)[O-] ZINC000177840442 931262202 /nfs/dbraw/zinc/26/22/02/931262202.db2.gz ZZXSLZACIVHLBF-NSHDSACASA-N 0 0 350.321 3.996 20 5 FHBDRN CCc1ccc(C(=O)N[C@H](C)[C@@H](OC)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000537798505 931264678 /nfs/dbraw/zinc/26/46/78/931264678.db2.gz CYOQIHWQQVQTSD-KZULUSFZSA-N 0 0 360.385 3.802 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)c2ccc(NC(=O)C3CC3)cc2)cc1[N+](=O)[O-] ZINC000177843366 931288793 /nfs/dbraw/zinc/28/87/93/931288793.db2.gz OAINTBSNOCLKNQ-CYBMUJFWSA-N 0 0 367.405 3.743 20 5 FHBDRN Cc1cccc2cc(C(=O)NCc3nc4cc([N+](=O)[O-])ccc4[nH]3)sc21 ZINC000580886095 931298606 /nfs/dbraw/zinc/29/86/06/931298606.db2.gz WRZYGFAKHMPKRV-UHFFFAOYSA-N 0 0 366.402 3.924 20 5 FHBDRN Cn1nccc1[C@H]1CCCN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1 ZINC000610468410 931322576 /nfs/dbraw/zinc/32/25/76/931322576.db2.gz KPVSLWNPONTNCT-NSHDSACASA-N 0 0 354.332 3.731 20 5 FHBDRN COc1ccc(CCC(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1F ZINC000177860196 931327417 /nfs/dbraw/zinc/32/74/17/931327417.db2.gz SQFUWUJHQHICBP-ZDUSSCGKSA-N 0 0 360.385 3.861 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)[C@@](C)(O)[C@@H](C)c2ccccc2)cc1[N+](=O)[O-] ZINC000177858279 931328541 /nfs/dbraw/zinc/32/85/41/931328541.db2.gz CMDFJUAHSKMSOS-AVYPCKFXSA-N 0 0 356.422 3.635 20 5 FHBDRN COc1cc(C(=O)N[C@@H]2C[C@H](C)CC[C@@H]2C(C)C)cc([N+](=O)[O-])c1OC ZINC000610171220 931333216 /nfs/dbraw/zinc/33/32/16/931333216.db2.gz DXSDBLPVYTYPOO-BPLDGKMQSA-N 0 0 364.442 3.803 20 5 FHBDRN CC(C)Oc1ccccc1NC(=O)NCCNc1ccc([N+](=O)[O-])cc1 ZINC000048193276 931369159 /nfs/dbraw/zinc/36/91/59/931369159.db2.gz MCBNNCWKSCLHGJ-UHFFFAOYSA-N 0 0 358.398 3.616 20 5 FHBDRN O=C(NCCC1CC(F)(F)C1)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000580936729 931378948 /nfs/dbraw/zinc/37/89/48/931378948.db2.gz DMTAVTNUCPLERF-UHFFFAOYSA-N 0 0 356.372 3.847 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])Nc1ccc(F)cc1NC1CC1 ZINC000119353320 931379277 /nfs/dbraw/zinc/37/92/77/931379277.db2.gz ISLZWBQHSDUVDC-UHFFFAOYSA-N 0 0 359.357 3.716 20 5 FHBDRN O=[N+]([O-])c1cc2c(ncnc2NCc2cc(Cl)cc3c2OCC3)s1 ZINC000561263519 931392258 /nfs/dbraw/zinc/39/22/58/931392258.db2.gz WDYVHBHGAGILCI-UHFFFAOYSA-N 0 0 362.798 3.800 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(OCC(=O)NC[C@H](c2ccccc2)C(C)C)n1 ZINC000548149207 931416935 /nfs/dbraw/zinc/41/69/35/931416935.db2.gz KHEHBKVXTJBKNX-KRWDZBQOSA-N 0 0 371.437 3.541 20 5 FHBDRN CC(C)(CCc1nc(-c2ccc(Br)cc2F)no1)[N+](=O)[O-] ZINC000834701437 931424257 /nfs/dbraw/zinc/42/42/57/931424257.db2.gz ALIPTUMMTMNVGY-UHFFFAOYSA-N 0 0 358.167 3.626 20 5 FHBDRN CCOC(=O)c1cnc2nc(C)ccc2c1NCc1cccc([N+](=O)[O-])c1 ZINC000580976854 931437861 /nfs/dbraw/zinc/43/78/61/931437861.db2.gz LEGPEVJUHRRNBS-UHFFFAOYSA-N 0 0 366.377 3.635 20 5 FHBDRN COc1cccc(C2(CNC(=O)C(C)(C)c3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000580983880 931443936 /nfs/dbraw/zinc/44/39/36/931443936.db2.gz ARHVWPRGOYJBLY-UHFFFAOYSA-N 0 0 368.433 3.729 20 5 FHBDRN Cc1cc2ncn(C[C@@H](O)COc3cc(C)c([N+](=O)[O-])cc3C)c2cc1C ZINC000581084318 931548271 /nfs/dbraw/zinc/54/82/71/931548271.db2.gz DAFDOTNJFZFELB-MRXNPFEDSA-N 0 0 369.421 3.618 20 5 FHBDRN Cc1cc2ncn(C[C@H](O)COc3cc(C)c([N+](=O)[O-])cc3C)c2cc1C ZINC000581084317 931548378 /nfs/dbraw/zinc/54/83/78/931548378.db2.gz DAFDOTNJFZFELB-INIZCTEOSA-N 0 0 369.421 3.618 20 5 FHBDRN COc1ccc(Cl)cc1NC(=O)CCNc1ccsc1[N+](=O)[O-] ZINC000610480098 931578691 /nfs/dbraw/zinc/57/86/91/931578691.db2.gz OASPGVXQBGAFQX-UHFFFAOYSA-N 0 0 355.803 3.759 20 5 FHBDRN CC(C)Oc1ccc(C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)cn1 ZINC000121279950 931602500 /nfs/dbraw/zinc/60/25/00/931602500.db2.gz WYJKFHRBGQCTGM-UHFFFAOYSA-N 0 0 367.308 3.631 20 5 FHBDRN COCCC1(CNC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)CC1 ZINC000276033981 931610440 /nfs/dbraw/zinc/61/04/40/931610440.db2.gz WLGXJMQYQQLPTJ-UHFFFAOYSA-N 0 0 350.418 3.640 20 5 FHBDRN C[C@H](NS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1)c1cc2ccccc2o1 ZINC000126270338 931686051 /nfs/dbraw/zinc/68/60/51/931686051.db2.gz IDFZAQDRIIVELO-LBPRGKRZSA-N 0 0 360.391 3.522 20 5 FHBDRN O=[N+]([O-])c1ccccc1CCS(=O)(=O)Nc1cccc(C(F)F)c1 ZINC000156902125 931689012 /nfs/dbraw/zinc/68/90/12/931689012.db2.gz QVOINHPVUQVDCX-UHFFFAOYSA-N 0 0 356.350 3.517 20 5 FHBDRN Cc1cccc(C(=O)N2CCc3ccc([N+](=O)[O-])cc32)c1Br ZINC000156920434 931703430 /nfs/dbraw/zinc/70/34/30/931703430.db2.gz LNXFNDXDZGQVPJ-UHFFFAOYSA-N 0 0 361.195 3.869 20 5 FHBDRN COc1ccccc1Cc1noc(-c2c[nH]c3cc([N+](=O)[O-])ccc32)n1 ZINC000544929714 931741029 /nfs/dbraw/zinc/74/10/29/931741029.db2.gz NKGJUIBLWZJJHM-UHFFFAOYSA-N 0 0 350.334 3.726 20 5 FHBDRN CC(C)(NC(=O)Cc1c(F)cccc1Cl)c1ccc([N+](=O)[O-])cc1 ZINC000430543691 931749321 /nfs/dbraw/zinc/74/93/21/931749321.db2.gz DYSVEBOFDBPCQD-UHFFFAOYSA-N 0 0 350.777 3.981 20 5 FHBDRN CN(C[C@@H]1CCCO[C@H]1c1ccccc1)C(=O)Cc1ccccc1[N+](=O)[O-] ZINC000050870431 931759016 /nfs/dbraw/zinc/75/90/16/931759016.db2.gz AJMYQLNDSIUJGC-RXVVDRJESA-N 0 0 368.433 3.764 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)N(C)C[C@H]1CCCO[C@@H]1c1ccccc1 ZINC000050867229 931759056 /nfs/dbraw/zinc/75/90/56/931759056.db2.gz ZGESYOUUCDZRLB-VQIMIIECSA-N 0 0 369.421 3.538 20 5 FHBDRN COc1cc([C@H](C)NC(=O)c2cc([N+](=O)[O-])c[nH]2)ccc1OC1CCCC1 ZINC000048339944 931774752 /nfs/dbraw/zinc/77/47/52/931774752.db2.gz LVEQGEZCLNNECH-LBPRGKRZSA-N 0 0 373.409 3.744 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CCC[C@@H]1c1cccc(Cl)c1 ZINC000126397244 931797097 /nfs/dbraw/zinc/79/70/97/931797097.db2.gz VYXSXJOKUIHFJI-OAHLLOKOSA-N 0 0 362.817 3.507 20 5 FHBDRN CCS[C@@H]1CC[C@H](N(C)C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000126422508 931812719 /nfs/dbraw/zinc/81/27/19/931812719.db2.gz ZVXQBSKLNQFPKT-DUVNUKRYSA-N 0 0 351.472 3.971 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]cc(Cc3nc(Cc4ccc(F)cc4)no3)c2c1 ZINC000544930982 931814495 /nfs/dbraw/zinc/81/44/95/931814495.db2.gz OXDLAWYZCMFLSE-UHFFFAOYSA-N 0 0 352.325 3.780 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCC(=O)NC[C@@H](c2ccccc2)C(C)C)c1 ZINC000510384961 931826223 /nfs/dbraw/zinc/82/62/23/931826223.db2.gz PXGIVIBTYKGFIR-QGZVFWFLSA-N 0 0 356.422 3.838 20 5 FHBDRN Cc1nc(-c2ccccn2)nc(N(C)CCc2ccccc2[N+](=O)[O-])c1C ZINC000561340798 931854423 /nfs/dbraw/zinc/85/44/23/931854423.db2.gz VUYAFAOHOIUMRL-UHFFFAOYSA-N 0 0 363.421 3.743 20 5 FHBDRN C[C@@H]1CN(C(=O)c2c[nH]c3ccc([N+](=O)[O-])cc32)C[C@@H](c2ccsc2)O1 ZINC000156171058 931900655 /nfs/dbraw/zinc/90/06/55/931900655.db2.gz RYGSGKGZVXIFIX-DIFFPNOSSA-N 0 0 371.418 3.740 20 5 FHBDRN CCOc1ccc([C@@H]2C[C@H]2NC(=O)C(C)(C)c2ccccc2[N+](=O)[O-])cc1 ZINC000511664976 931916507 /nfs/dbraw/zinc/91/65/07/931916507.db2.gz QHBXJETYZWCBAB-FUHWJXTLSA-N 0 0 368.433 3.943 20 5 FHBDRN CCN(c1cccc(Cl)c1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1F ZINC000511739448 931932470 /nfs/dbraw/zinc/93/24/70/931932470.db2.gz RGZQCRXSCHRLDR-UHFFFAOYSA-N 0 0 358.778 3.603 20 5 FHBDRN CCCc1nc(COC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)cs1 ZINC000728328490 931934650 /nfs/dbraw/zinc/93/46/50/931934650.db2.gz VDBRERLDXFPKSL-UHFFFAOYSA-N 0 0 372.406 3.547 20 5 FHBDRN Cc1ccc([C@@H](C)N(C)C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)cc1 ZINC000135129483 931950536 /nfs/dbraw/zinc/95/05/36/931950536.db2.gz PXQWRMGQEILWGR-OAHLLOKOSA-N 0 0 364.405 3.922 20 5 FHBDRN O=C(OCCOc1cccc(Br)c1)c1ccc([N+](=O)[O-])cc1 ZINC000003383517 931966857 /nfs/dbraw/zinc/96/68/57/931966857.db2.gz KECQBRGFWULTKM-UHFFFAOYSA-N 0 0 366.167 3.593 20 5 FHBDRN CNc1ccc(C(=O)NC[C@@H]2CCCC[C@@H]2C(F)(F)F)cc1[N+](=O)[O-] ZINC000610503530 931998712 /nfs/dbraw/zinc/99/87/12/931998712.db2.gz HGODOHXMVXTPGT-RYUDHWBXSA-N 0 0 359.348 3.735 20 5 FHBDRN CCc1ccccc1CNC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000430594938 932001813 /nfs/dbraw/zinc/00/18/13/932001813.db2.gz WQQLFSDKQLHXAB-UHFFFAOYSA-N 0 0 363.211 3.850 20 5 FHBDRN C[C@@H](c1ccccc1[N+](=O)[O-])N1CCC(C(=O)c2ccc(O)cc2)CC1 ZINC000610389813 932009822 /nfs/dbraw/zinc/00/98/22/932009822.db2.gz YGWPCVCEIOJFDI-AWEZNQCLSA-N 0 0 354.406 3.956 20 5 FHBDRN Cc1c(Br)c(NCc2cc(F)ccc2F)ncc1[N+](=O)[O-] ZINC000165766120 932079037 /nfs/dbraw/zinc/07/90/37/932079037.db2.gz GCBSYQULGSYSEB-UHFFFAOYSA-N 0 0 358.142 3.951 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@H](c2ccc(F)cc2)C[C@@H]1C ZINC000135242173 932079201 /nfs/dbraw/zinc/07/92/01/932079201.db2.gz UXAZMNBJHIXVPS-GXTWGEPZSA-N 0 0 358.369 3.761 20 5 FHBDRN CCOc1cc(/C=C\C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)ccc1O ZINC000588412838 932084795 /nfs/dbraw/zinc/08/47/95/932084795.db2.gz DZJCQEZEUSWTNE-JKEYDSJLSA-N 0 0 370.405 3.898 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc2[nH]c(=O)oc21 ZINC000581460675 932093736 /nfs/dbraw/zinc/09/37/36/932093736.db2.gz AYJIJCNCJFUHDE-VIFPVBQESA-N 0 0 359.363 3.561 20 5 FHBDRN COc1ccc(OC)c([C@@H]2C[C@H]2C(=O)N[C@@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000276264414 932137353 /nfs/dbraw/zinc/13/73/53/932137353.db2.gz MORYYNAAJUHBRR-YLQAJVPDSA-N 0 0 370.405 3.593 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1OCc1ccc(OCC(F)(F)F)nc1 ZINC000134499636 932141282 /nfs/dbraw/zinc/14/12/82/932141282.db2.gz IJLLOPRHIPYARX-UHFFFAOYSA-N 0 0 358.272 3.519 20 5 FHBDRN O=[N+]([O-])c1cc(CNc2nnc(CC(F)(F)F)s2)ccc1Cl ZINC000276277929 932142623 /nfs/dbraw/zinc/14/26/23/932142623.db2.gz DRWAIYBYCIVHIR-UHFFFAOYSA-N 0 0 352.725 3.817 20 5 FHBDRN CC(C)[C@@H]1C[C@@H](CC(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)CCO1 ZINC000581511628 932189412 /nfs/dbraw/zinc/18/94/12/932189412.db2.gz UXCSUASTXSHOIC-LIRRHRJNSA-N 0 0 373.453 3.576 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)NCC(C)(C)[C@H]2CCCCO2)c1 ZINC000610719058 932230868 /nfs/dbraw/zinc/23/08/68/932230868.db2.gz UIJZMZWJEGQZHL-OAHLLOKOSA-N 0 0 352.456 3.642 20 5 FHBDRN Cc1c(C(=O)Nc2nc(CN3CCC(C)CC3)cs2)cccc1[N+](=O)[O-] ZINC000022291572 932254759 /nfs/dbraw/zinc/25/47/59/932254759.db2.gz KZIRFVRMYSGBJN-UHFFFAOYSA-N 0 0 374.466 3.844 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N1CCC[C@@H]1c1ccccc1Cl ZINC000097017426 932264327 /nfs/dbraw/zinc/26/43/27/932264327.db2.gz NDTJIQSFPBOPSQ-QGZVFWFLSA-N 0 0 360.797 3.991 20 5 FHBDRN Cc1ccc(Cl)c(S(=O)(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000126593287 932265872 /nfs/dbraw/zinc/26/58/72/932265872.db2.gz ATMYBSHIDPAQFG-NSHDSACASA-N 0 0 354.815 3.596 20 5 FHBDRN C[C@@H](CNc1cccnc1[N+](=O)[O-])Oc1ccccc1Br ZINC000610511336 932268677 /nfs/dbraw/zinc/26/86/77/932268677.db2.gz NSAMSTGYALYTON-JTQLQIEISA-N 0 0 352.188 3.632 20 5 FHBDRN Cc1nc(C)c(CNC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)s1 ZINC000074664176 932281137 /nfs/dbraw/zinc/28/11/37/932281137.db2.gz CRVQBQXDEJJRMK-UHFFFAOYSA-N 0 0 362.455 3.788 20 5 FHBDRN COc1ccc2cccc(CC(=O)Nc3ccc([N+](=O)[O-])c(C)n3)c2c1 ZINC000157271999 932285389 /nfs/dbraw/zinc/28/53/89/932285389.db2.gz XMBRAVHTEVHYER-UHFFFAOYSA-N 0 0 351.362 3.641 20 5 FHBDRN C[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000246486174 932289659 /nfs/dbraw/zinc/28/96/59/932289659.db2.gz YSXXDQAAFHXAPS-KBAYOESNSA-N 0 0 371.481 3.991 20 5 FHBDRN CCOc1cc(Cl)ccc1NC(=O)c1cc(OC)ccc1[N+](=O)[O-] ZINC000126644487 932308916 /nfs/dbraw/zinc/30/89/16/932308916.db2.gz SVPWRMHREUDKNV-UHFFFAOYSA-N 0 0 350.758 3.908 20 5 FHBDRN Cc1c(NC(=O)NCCc2nccs2)cc([N+](=O)[O-])cc1C(F)(F)F ZINC000933339578 932351759 /nfs/dbraw/zinc/35/17/59/932351759.db2.gz HCONAYIQPHYHIA-UHFFFAOYSA-N 0 0 374.344 3.743 20 5 FHBDRN O=C(NCCOc1cccc(C(F)(F)F)c1)c1cc([N+](=O)[O-])ccc1F ZINC000247351337 932356027 /nfs/dbraw/zinc/35/60/27/932356027.db2.gz VYRXPMRCPLPKDK-UHFFFAOYSA-N 0 0 372.274 3.562 20 5 FHBDRN C[C@@H]1CN(C(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)c2ccccc21 ZINC000097121843 932383330 /nfs/dbraw/zinc/38/33/30/932383330.db2.gz AEYXSDKFTZEZES-CYBMUJFWSA-N 0 0 362.389 3.759 20 5 FHBDRN Cc1c(Br)cc(C(=O)N2CCCC(C)(C)C2)cc1[N+](=O)[O-] ZINC000510443347 932392708 /nfs/dbraw/zinc/39/27/08/932392708.db2.gz MWJZMMUDKQAGJQ-UHFFFAOYSA-N 0 0 355.232 3.928 20 5 FHBDRN COc1ccc([C@H]2CCN(C(=O)Nc3cc([N+](=O)[O-])ccc3C)C2)cc1 ZINC000157852210 932413859 /nfs/dbraw/zinc/41/38/59/932413859.db2.gz QVOJLJPDBJUXJQ-HNNXBMFYSA-N 0 0 355.394 3.933 20 5 FHBDRN CCCc1nc(COC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)cs1 ZINC000781713137 932428290 /nfs/dbraw/zinc/42/82/90/932428290.db2.gz MRTHBZMWDILXOZ-UHFFFAOYSA-N 0 0 372.349 3.962 20 5 FHBDRN Cn1ccc(CNC(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)c1 ZINC000477272014 932429481 /nfs/dbraw/zinc/42/94/81/932429481.db2.gz JLGCAADSEOQWBP-UHFFFAOYSA-N 0 0 350.378 3.607 20 5 FHBDRN COc1cc(C(=O)N2c3ccccc3SC[C@H]2C)c([N+](=O)[O-])cc1OC ZINC000430634201 932444757 /nfs/dbraw/zinc/44/47/57/932444757.db2.gz CURMMIGIHIXDEJ-LLVKDONJSA-N 0 0 374.418 3.753 20 5 FHBDRN CC(C)C[C@@H]1OCCC[C@H]1NC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000477299873 932456485 /nfs/dbraw/zinc/45/64/85/932456485.db2.gz WUNVMWBPHJETKC-CABCVRRESA-N 0 0 374.359 3.937 20 5 FHBDRN COc1ccccc1C[C@@H](NC(=O)c1ccc(OC)c([N+](=O)[O-])c1)C(C)C ZINC000477300212 932456630 /nfs/dbraw/zinc/45/66/30/932456630.db2.gz SNKXUOQGRWPWTC-MRXNPFEDSA-N 0 0 372.421 3.609 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N(C)Cc1ccc2c(c1)OCO2 ZINC000477299061 932456880 /nfs/dbraw/zinc/45/68/80/932456880.db2.gz VMMWDSYIXMXDGJ-UHFFFAOYSA-N 0 0 362.769 3.558 20 5 FHBDRN COc1ccccc1C[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1F)C(C)C ZINC000477306854 932464345 /nfs/dbraw/zinc/46/43/45/932464345.db2.gz JJDIAKTVYDUOGA-QGZVFWFLSA-N 0 0 360.385 3.740 20 5 FHBDRN CCc1ccc(C(=O)Nc2cc(C(=O)OC)c(C)cc2C)cc1[N+](=O)[O-] ZINC000471681066 932471508 /nfs/dbraw/zinc/47/15/08/932471508.db2.gz XUVMPHYTNJPNOO-UHFFFAOYSA-N 0 0 356.378 3.813 20 5 FHBDRN O=C(/C=C\c1cncc(F)c1)OCc1cnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000255360309 932486579 /nfs/dbraw/zinc/48/65/79/932486579.db2.gz CKEWNSJOMBJKNH-BHQIHCQQSA-N 0 0 369.308 3.541 20 5 FHBDRN O=C(/C=C\c1cccs1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000255365179 932514337 /nfs/dbraw/zinc/51/43/37/932514337.db2.gz DFAZNSWJMJJFJM-FPLPWBNLSA-N 0 0 358.419 3.740 20 5 FHBDRN CN(C)C(=O)C[C@H]1CN(c2ccccc2[N+](=O)[O-])c2ccc(Cl)cc21 ZINC000078331810 932514726 /nfs/dbraw/zinc/51/47/26/932514726.db2.gz FVQFPHLEXJWPFG-LBPRGKRZSA-N 0 0 359.813 3.962 20 5 FHBDRN Cc1cc(C(=O)Nc2c(-c3ccncc3)nc3ccccn32)ccc1[N+](=O)[O-] ZINC000430643897 932523381 /nfs/dbraw/zinc/52/33/81/932523381.db2.gz XZTMRDWDNQZZGG-UHFFFAOYSA-N 0 0 373.372 3.865 20 5 FHBDRN Cc1cc(NC(=O)Cc2ccc([N+](=O)[O-])cc2Br)ccc1O ZINC000157422230 932524422 /nfs/dbraw/zinc/52/44/22/932524422.db2.gz XOEXUTHYHBXYRD-UHFFFAOYSA-N 0 0 365.183 3.553 20 5 FHBDRN Cc1ccc(C[C@H](C)NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)s1 ZINC000126811706 932576633 /nfs/dbraw/zinc/57/66/33/932576633.db2.gz WOHXORBMDWCXPH-LBPRGKRZSA-N 0 0 370.434 3.511 20 5 FHBDRN CC(C)[C@H](CNc1cc2nc[nH]c(=O)c2cc1[N+](=O)[O-])c1ccccc1 ZINC000097286617 932582884 /nfs/dbraw/zinc/58/28/84/932582884.db2.gz OMYDKYXAOVGDGQ-HNNXBMFYSA-N 0 0 352.394 3.683 20 5 FHBDRN O=[N+]([O-])c1ccc(Cl)c(CN2CCC[C@@](O)(C(F)(F)F)CC2)c1 ZINC000285476092 932586187 /nfs/dbraw/zinc/58/61/87/932586187.db2.gz HVWZVHMSZMWJCN-ZDUSSCGKSA-N 0 0 352.740 3.528 20 5 FHBDRN C[C@@H](OC1CCCCCC1)C(=O)Nc1ccnn1-c1ccc([N+](=O)[O-])cc1 ZINC000471699962 932646026 /nfs/dbraw/zinc/64/60/26/932646026.db2.gz FQEVYCAPTYQOJS-CQSZACIVSA-N 0 0 372.425 3.847 20 5 FHBDRN CC(C)n1nc2c(c1NC(=O)CSc1ccccc1[N+](=O)[O-])CCC2 ZINC000471704060 932652810 /nfs/dbraw/zinc/65/28/10/932652810.db2.gz BUAIQXFFPHIYEI-UHFFFAOYSA-N 0 0 360.439 3.592 20 5 FHBDRN COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)NCC2(C)CC2)cc1 ZINC000477539892 932675465 /nfs/dbraw/zinc/67/54/65/932675465.db2.gz CFQGOVIKDYWEAD-UHFFFAOYSA-N 0 0 356.378 3.926 20 5 FHBDRN CSc1ccc(NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)nc1 ZINC000121464939 932678014 /nfs/dbraw/zinc/67/80/14/932678014.db2.gz JWVFWCXDEDHKGJ-UHFFFAOYSA-N 0 0 368.212 3.727 20 5 FHBDRN Cc1ccc(-c2cccnc2)cc1NC(=O)COc1cccc([N+](=O)[O-])c1 ZINC000477551379 932681507 /nfs/dbraw/zinc/68/15/07/932681507.db2.gz QWSXLISEMUDEAY-UHFFFAOYSA-N 0 0 363.373 3.983 20 5 FHBDRN CC(C)n1cnnc1C1CCN(c2nc3ccccc3cc2[N+](=O)[O-])CC1 ZINC000276564832 932697683 /nfs/dbraw/zinc/69/76/83/932697683.db2.gz GUNVBUOWZMOBAB-UHFFFAOYSA-N 0 0 366.425 3.699 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N(C)c2cccc3cccnc32)c1 ZINC000581836663 932720548 /nfs/dbraw/zinc/72/05/48/932720548.db2.gz INOPJRFGGWIFTG-UHFFFAOYSA-N 0 0 351.362 3.818 20 5 FHBDRN Cc1cc2c(cc1C)[C@@H](C(=O)N1c3ccc([N+](=O)[O-])cc3C[C@H]1C)CO2 ZINC000471734394 932737287 /nfs/dbraw/zinc/73/72/87/932737287.db2.gz FTVMHLNALHHHPR-DYVFJYSZSA-N 0 0 352.390 3.665 20 5 FHBDRN COc1cc(C(=O)N[C@@H]2c3cccc(F)c3CC[C@H]2C)ccc1[N+](=O)[O-] ZINC000430663556 932744444 /nfs/dbraw/zinc/74/44/44/932744444.db2.gz KBMZXMFUHCUEDC-ZMZPIMSZSA-N 0 0 358.369 3.796 20 5 FHBDRN Nc1c(C(=O)N2CCC[C@@H]2Cc2ccccc2Cl)cccc1[N+](=O)[O-] ZINC000178177575 932765049 /nfs/dbraw/zinc/76/50/49/932765049.db2.gz REDMMUIIXMNVSG-CYBMUJFWSA-N 0 0 359.813 3.678 20 5 FHBDRN C[C@@H](CNC(=O)CCc1cc(F)ccc1[N+](=O)[O-])COCc1ccccc1 ZINC001125536991 932772196 /nfs/dbraw/zinc/77/21/96/932772196.db2.gz RYBWCTBTCVPMOB-HNNXBMFYSA-N 0 0 374.412 3.636 20 5 FHBDRN CC1(C)[C@H](OCc2ccccc2)C[C@@H]1NC(=O)c1ccccc1[N+](=O)[O-] ZINC000187435390 932776418 /nfs/dbraw/zinc/77/64/18/932776418.db2.gz GGDDTXFMQFTNEA-ZWKOTPCHSA-N 0 0 354.406 3.709 20 5 FHBDRN CSc1cccc(C(=O)NCCOc2ccc(C)cc2C)c1[N+](=O)[O-] ZINC000548271666 932783302 /nfs/dbraw/zinc/78/33/02/932783302.db2.gz NWIZVNRVCNXHPJ-UHFFFAOYSA-N 0 0 360.435 3.742 20 5 FHBDRN CC[C@H](OC(=O)[C@@H]1CC(c2cccc(F)c2)=NO1)c1cccc([N+](=O)[O-])c1 ZINC001266835774 932810989 /nfs/dbraw/zinc/81/09/89/932810989.db2.gz QCFSPERLTXXFFA-ROUUACIJSA-N 0 0 372.352 3.921 20 5 FHBDRN O=[N+]([O-])c1cc2ccccc2nc1N1CCC[C@H](c2nnc(C3CC3)[nH]2)C1 ZINC000276661451 932820462 /nfs/dbraw/zinc/82/04/62/932820462.db2.gz RWNJBSPRGVPSEI-AWEZNQCLSA-N 0 0 364.409 3.523 20 5 FHBDRN Cc1c(Br)cc(C(=O)N2C[C@@H](C)CC2(C)C)cc1[N+](=O)[O-] ZINC000510474926 932853429 /nfs/dbraw/zinc/85/34/29/932853429.db2.gz LXEIJHWRLIQXLY-VIFPVBQESA-N 0 0 355.232 3.926 20 5 FHBDRN C[C@H](OC(=O)Cc1ccc([N+](=O)[O-])cc1)c1nc2ccc(Cl)cc2n1C ZINC000176034762 932867632 /nfs/dbraw/zinc/86/76/32/932867632.db2.gz YILNMEUMKYTQQF-NSHDSACASA-N 0 0 373.796 3.982 20 5 FHBDRN CC(C)C(=O)c1cnccc1NC(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000187463518 932886361 /nfs/dbraw/zinc/88/63/61/932886361.db2.gz MISJVFLEJZKQFZ-GFCCVEGCSA-N 0 0 373.434 3.948 20 5 FHBDRN Cc1ccc(S(=O)(=O)N(C)[C@H](C)c2cc(F)ccc2F)c([N+](=O)[O-])c1 ZINC000101573027 932928592 /nfs/dbraw/zinc/92/85/92/932928592.db2.gz FJTYKECWQZRJGH-LLVKDONJSA-N 0 0 370.377 3.563 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)NCc1ccc(OC(F)F)cc1 ZINC000588435852 932938452 /nfs/dbraw/zinc/93/84/52/932938452.db2.gz PGZXPKILAMRCDW-BENRWUELSA-N 0 0 362.332 3.916 20 5 FHBDRN COc1cnccc1[C@@H](C)NC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000187487980 932948198 /nfs/dbraw/zinc/94/81/98/932948198.db2.gz NBUCGKCNPHFPOK-CQSZACIVSA-N 0 0 372.425 3.680 20 5 FHBDRN COCCC1(CNC(=O)c2ccc([N+](=O)[O-])cc2Cl)CCCCC1 ZINC000187488165 932949123 /nfs/dbraw/zinc/94/91/23/932949123.db2.gz URPRHYRMUFCXKL-UHFFFAOYSA-N 0 0 354.834 3.965 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000588437171 932963298 /nfs/dbraw/zinc/96/32/98/932963298.db2.gz YUYCFUZZJAYXLV-UKVQZPPCSA-N 0 0 355.350 3.784 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1CN[C@@H](c1cnn(C)c1)c1ccc(F)cc1 ZINC000187512492 932966307 /nfs/dbraw/zinc/96/63/07/932966307.db2.gz YVTVEWRNKSSPJH-LJQANCHMSA-N 0 0 354.385 3.655 20 5 FHBDRN O=c1c2cc3ccccc3cc2ncn1C[C@@H](O)c1ccc(F)c(F)c1 ZINC000051288522 932969506 /nfs/dbraw/zinc/96/95/06/932969506.db2.gz ZHSPUTWXIPGINQ-LJQANCHMSA-N 0 0 352.340 3.562 20 5 FHBDRN C[C@H](OC(=O)Cc1cccc([N+](=O)[O-])c1)c1nc2cc(Cl)ccc2n1C ZINC000176043206 932982807 /nfs/dbraw/zinc/98/28/07/932982807.db2.gz OXBXDPRSYYLOFS-NSHDSACASA-N 0 0 373.796 3.982 20 5 FHBDRN CC(C)CC(=O)N1CCC(Nc2nc3ccccc3cc2[N+](=O)[O-])CC1 ZINC000276694869 932996549 /nfs/dbraw/zinc/99/65/49/932996549.db2.gz WQTKACINWGIGLV-UHFFFAOYSA-N 0 0 356.426 3.592 20 5 FHBDRN C[C@@H](N[C@H](C)c1ncnn1C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000276709305 933009828 /nfs/dbraw/zinc/00/98/28/933009828.db2.gz WMILFGDCMQDGFB-VXGBXAGGSA-N 0 0 357.439 3.864 20 5 FHBDRN Cc1cc2c(cc1C)[C@@H](C(=O)N1CCCc3ccc([N+](=O)[O-])cc31)CO2 ZINC000471819748 933036402 /nfs/dbraw/zinc/03/64/02/933036402.db2.gz JQUYCWPWVIQPOK-KRWDZBQOSA-N 0 0 352.390 3.667 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)Oc1ccccc1-c1nnco1 ZINC000588441036 933072213 /nfs/dbraw/zinc/07/22/13/933072213.db2.gz PVZDJBNEFVAZIU-BENRWUELSA-N 0 0 351.318 3.654 20 5 FHBDRN C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)NCCCn1cnc2ccccc21 ZINC000588444899 933107658 /nfs/dbraw/zinc/10/76/58/933107658.db2.gz YJRAQHSHGRXGHJ-FYWRMAATSA-N 0 0 364.405 3.554 20 5 FHBDRN CCN(CCC(F)(F)F)C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000610570836 933126966 /nfs/dbraw/zinc/12/69/66/933126966.db2.gz VPCCZEXEPSXWNN-UHFFFAOYSA-N 0 0 369.137 3.772 20 5 FHBDRN CC1(C)CC(CNC(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC000548374016 933145172 /nfs/dbraw/zinc/14/51/72/933145172.db2.gz ZHEBHHSVAHYLGI-UHFFFAOYSA-N 0 0 361.442 3.584 20 5 FHBDRN C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N[C@H](CCCO)c1ccccc1 ZINC000588446933 933163745 /nfs/dbraw/zinc/16/37/45/933163745.db2.gz VBLTWDUTNFXDQT-JUWJPQTCSA-N 0 0 354.406 3.628 20 5 FHBDRN Cc1cc(OCC(=O)N2CCc3ccccc3C2(C)C)ccc1[N+](=O)[O-] ZINC000430799527 933237640 /nfs/dbraw/zinc/23/76/40/933237640.db2.gz XMHGMRJKKVNULE-UHFFFAOYSA-N 0 0 354.406 3.602 20 5 FHBDRN CCOc1ccc(F)c(NC(=O)COc2ccc([N+](=O)[O-])c(C)c2)c1F ZINC000430792214 933240738 /nfs/dbraw/zinc/24/07/38/933240738.db2.gz QJPCSKVJNSGDFI-UHFFFAOYSA-N 0 0 366.320 3.598 20 5 FHBDRN CCN(C(=O)COc1ccc([N+](=O)[O-])c(C)c1)[C@@H](C)Cc1ccsc1 ZINC000430793688 933242494 /nfs/dbraw/zinc/24/24/94/933242494.db2.gz MVCVMIRFFLMFGP-AWEZNQCLSA-N 0 0 362.451 3.823 20 5 FHBDRN Cc1cc(OCC(=O)Nc2c(F)cc(Cl)cc2F)ccc1[N+](=O)[O-] ZINC000430811272 933255399 /nfs/dbraw/zinc/25/53/99/933255399.db2.gz OQKUKQJBYIJZEX-UHFFFAOYSA-N 0 0 356.712 3.852 20 5 FHBDRN Cc1cc(OCC(=O)N2CCc3cc(Cl)ccc3C2)ccc1[N+](=O)[O-] ZINC000430816503 933258638 /nfs/dbraw/zinc/25/86/38/933258638.db2.gz AFDXVRXNYHBZMQ-UHFFFAOYSA-N 0 0 360.797 3.520 20 5 FHBDRN Cc1cc2cccnc2c(NC(=O)COc2ccc([N+](=O)[O-])c(C)c2)c1 ZINC000430817316 933259789 /nfs/dbraw/zinc/25/97/89/933259789.db2.gz RSEPVBQMXKKULV-UHFFFAOYSA-N 0 0 351.362 3.777 20 5 FHBDRN CCNc1ccc(C(=O)NCc2c(F)cc(F)c(F)c2F)cc1[N+](=O)[O-] ZINC000430833622 933276534 /nfs/dbraw/zinc/27/65/34/933276534.db2.gz RFSQWLBZCVULOP-UHFFFAOYSA-N 0 0 371.290 3.513 20 5 FHBDRN C[C@@H](c1ccccc1)N(C)C(=O)COc1ccc([N+](=O)[O-])c2ncccc12 ZINC000471868564 933289134 /nfs/dbraw/zinc/28/91/34/933289134.db2.gz CFFQQDXJMMBIRK-AWEZNQCLSA-N 0 0 365.389 3.741 20 5 FHBDRN CCNc1ccc(C(=O)OCC)cc1NC(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000098072636 933305325 /nfs/dbraw/zinc/30/53/25/933305325.db2.gz HEVZWBFWNDDCDP-UHFFFAOYSA-N 0 0 371.393 3.764 20 5 FHBDRN COC(=O)c1cnc(NC[C@@H]2CCC[C@H](C(F)(F)F)C2)c([N+](=O)[O-])c1 ZINC000477751181 933317355 /nfs/dbraw/zinc/31/73/55/933317355.db2.gz QKOHECQHFATWLQ-KOLCDFICSA-N 0 0 361.320 3.557 20 5 FHBDRN CCc1ccc(C(=O)N2CCC(Oc3ncccc3C)CC2)cc1[N+](=O)[O-] ZINC000548391835 933333299 /nfs/dbraw/zinc/33/32/99/933333299.db2.gz VRAPSWFKBNURDF-UHFFFAOYSA-N 0 0 369.421 3.544 20 5 FHBDRN CCC(CC)(CCO)CNC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000178340707 933333472 /nfs/dbraw/zinc/33/34/72/933333472.db2.gz APQAKJGHHFRNJN-UHFFFAOYSA-N 0 0 350.440 3.728 20 5 FHBDRN Cc1ccc([C@H]2NC(=O)N([C@@H](C)c3cccc([N+](=O)[O-])c3)C2=O)cc1C ZINC000430878237 933345110 /nfs/dbraw/zinc/34/51/10/933345110.db2.gz NFNVGJWYDSKIIP-SUMWQHHRSA-N 0 0 353.378 3.566 20 5 FHBDRN C[C@@H](CC(=O)c1ccccc1F)C(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000430882876 933369109 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3.938 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CN1CC[C@H](OCCCc2ccccc2)C1 ZINC000430942999 933455654 /nfs/dbraw/zinc/45/56/54/933455654.db2.gz NUPASIHHSGGNKI-FQEVSTJZSA-N 0 0 370.449 3.827 20 5 FHBDRN CCn1ccnc1[C@H]1CCCCN1C(=O)NCc1cccc([N+](=O)[O-])c1C ZINC000430947060 933464844 /nfs/dbraw/zinc/46/48/44/933464844.db2.gz CSQONMKFTJEAJD-QGZVFWFLSA-N 0 0 371.441 3.556 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N1C[C@@H](C(F)(F)F)[C@H](C(F)(F)F)C1 ZINC000610598054 933482667 /nfs/dbraw/zinc/48/26/67/933482667.db2.gz QFBSUHIVBCCEAY-GHMZBOCLSA-N 0 0 370.249 3.716 20 5 FHBDRN Cc1cc(C(=O)N2C[C@H](C(F)(F)F)[C@H](C(F)(F)F)C2)cc([N+](=O)[O-])c1 ZINC000610597981 933484277 /nfs/dbraw/zinc/48/42/77/933484277.db2.gz NDPKMNKVLHUGDD-PHIMTYICSA-N 0 0 370.249 3.716 20 5 FHBDRN O=[N+]([O-])c1cccc(OCCN2C[C@H](C(F)(F)F)[C@@H](C(F)(F)F)C2)c1 ZINC000610604851 933514585 /nfs/dbraw/zinc/51/45/85/933514585.db2.gz PQEMNZLUYLFBRK-RYUDHWBXSA-N 0 0 372.265 3.646 20 5 FHBDRN COc1ccc(CN(C)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)cc1O ZINC000119416817 933515261 /nfs/dbraw/zinc/51/52/61/933515261.db2.gz CTJRODJQPJMHRS-UHFFFAOYSA-N 0 0 369.377 3.596 20 5 FHBDRN CC(C)(NC(=O)C1CC(OCc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000610624184 933545255 /nfs/dbraw/zinc/54/52/55/933545255.db2.gz FNNLLYDVXCIVBF-UHFFFAOYSA-N 0 0 368.433 3.942 20 5 FHBDRN COc1cc(C)cc(CNC(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000159346247 933555334 /nfs/dbraw/zinc/55/53/34/933555334.db2.gz OWGJZDZQGVIFDI-CQSZACIVSA-N 0 0 357.410 3.781 20 5 FHBDRN C[C@@]1(c2ccccc2)CN(C(=O)Nc2cc(F)cc([N+](=O)[O-])c2)CCO1 ZINC000548416292 933559952 /nfs/dbraw/zinc/55/99/52/933559952.db2.gz AFRVOCHVPKNLRB-SFHVURJKSA-N 0 0 359.357 3.513 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)N2CC(Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000610644098 933584299 /nfs/dbraw/zinc/58/42/99/933584299.db2.gz ZCUQYJKKIAKLPY-HNNXBMFYSA-N 0 0 353.422 3.848 20 5 FHBDRN COC[C@H]1CN(c2cc(Cl)c(C(F)(F)F)cc2[N+](=O)[O-])C[C@@H](C)O1 ZINC000302514166 933593894 /nfs/dbraw/zinc/59/38/94/933593894.db2.gz AAWMHDZACOLTDU-RKDXNWHRSA-N 0 0 368.739 3.507 20 5 FHBDRN CC[C@@H](c1ccccc1)N1CC(=O)N(CCc2ccc([N+](=O)[O-])cc2)C1=O ZINC000431004617 933635189 /nfs/dbraw/zinc/63/51/89/933635189.db2.gz IBXROEPHLICMJX-SFHVURJKSA-N 0 0 367.405 3.553 20 5 FHBDRN O=c1c2ccc([N+](=O)[O-])cc2ncn1Cc1csc(C2CCCCC2)n1 ZINC000060816876 933671811 /nfs/dbraw/zinc/67/18/11/933671811.db2.gz URTWYDJFQBTOEG-UHFFFAOYSA-N 0 0 370.434 3.857 20 5 FHBDRN O=C(CCn1cc(-c2cccc([N+](=O)[O-])c2)cn1)Nc1ccccc1F ZINC000611198187 933698246 /nfs/dbraw/zinc/69/82/46/933698246.db2.gz RPRVQIOQYCUXCW-UHFFFAOYSA-N 0 0 354.341 3.626 20 5 FHBDRN O=C(N[C@@H]1CCSc2ccccc21)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000610665153 933700337 /nfs/dbraw/zinc/70/03/37/933700337.db2.gz SUFNPHUHKLKWOJ-QGZVFWFLSA-N 0 0 369.446 3.900 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(N2CCC(n3cc(Br)cn3)CC2)c1 ZINC000610677590 933752818 /nfs/dbraw/zinc/75/28/18/933752818.db2.gz UQNMHLIFTMRZES-UHFFFAOYSA-N 0 0 365.231 3.704 20 5 FHBDRN CCC(CC)[C@@H](NC(=O)c1c([N+](=O)[O-])c(C)nn1C)c1cccs1 ZINC000098102010 933795388 /nfs/dbraw/zinc/79/53/88/933795388.db2.gz UBRFUNKPWWRLOM-CYBMUJFWSA-N 0 0 350.444 3.606 20 5 FHBDRN O=C(NC[C@H]1CCC(F)(F)C1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000431078866 933809681 /nfs/dbraw/zinc/80/96/81/933809681.db2.gz HFQMGKWKVXKOLW-LBPRGKRZSA-N 0 0 353.369 3.704 20 5 FHBDRN C[C@@H](CC(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1)C1CCCCC1 ZINC000510839963 933840624 /nfs/dbraw/zinc/84/06/24/933840624.db2.gz ZPSPMDJKCBDUMS-INIZCTEOSA-N 0 0 359.470 3.850 20 5 FHBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NC[C@@H]1CCC(F)(F)C1 ZINC000431115439 933846964 /nfs/dbraw/zinc/84/69/64/933846964.db2.gz RMAOOSROHBFFRV-VHSXEESVSA-N 0 0 362.760 3.567 20 5 FHBDRN CC(C)Cc1nnc(NC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)s1 ZINC000431109196 933850049 /nfs/dbraw/zinc/85/00/49/933850049.db2.gz WIRYWNDVPODVBW-UHFFFAOYSA-N 0 0 363.443 3.702 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H]1CCC(F)(F)C1 ZINC000431111414 933851762 /nfs/dbraw/zinc/85/17/62/933851762.db2.gz LCOWFYOVYHHVMQ-AWEZNQCLSA-N 0 0 355.385 3.950 20 5 FHBDRN C[C@@H](NC(=O)N[C@H]1COc2c1cccc2Cl)c1cccc([N+](=O)[O-])c1 ZINC000610707405 933858286 /nfs/dbraw/zinc/85/82/86/933858286.db2.gz GTILGUGRUZGLHI-BMIGLBTASA-N 0 0 361.785 3.742 20 5 FHBDRN CC(C)(C(=O)N[C@H]1COc2c1cccc2Cl)c1ccc([N+](=O)[O-])cc1 ZINC000610709637 933872009 /nfs/dbraw/zinc/87/20/09/933872009.db2.gz HBLLNDKVUSHFMS-HNNXBMFYSA-N 0 0 360.797 3.776 20 5 FHBDRN O=C1CCc2cc([N+](=O)[O-])c(N[C@H]3COc4c3cccc4Cl)cc2N1 ZINC000610709854 933881037 /nfs/dbraw/zinc/88/10/37/933881037.db2.gz BBFFTVPQWOAKGV-AWEZNQCLSA-N 0 0 359.769 3.679 20 5 FHBDRN CCOC(=O)c1cc(N[C@@H](C)c2ccc3[nH]c(=O)[nH]c3c2)ccc1[N+](=O)[O-] ZINC000610715044 933899829 /nfs/dbraw/zinc/89/98/29/933899829.db2.gz GIUXWNMGVOZHRI-JTQLQIEISA-N 0 0 370.365 3.527 20 5 FHBDRN O=C(Nc1cnc2ccccc2n1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000176066983 933975265 /nfs/dbraw/zinc/97/52/65/933975265.db2.gz JAXDDQWTVTYQTA-UHFFFAOYSA-N 0 0 373.166 3.553 20 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Cc1c(NC(=O)[C@H](C)c2cccnc2)cc(Br)cc1[N+](=O)[O-] ZINC000431245749 934247265 /nfs/dbraw/zinc/24/72/65/934247265.db2.gz ABXSVYJITFNFHZ-SECBINFHSA-N 0 0 364.199 3.803 20 5 FHBDRN O=C(c1c[nH]c2cccc([N+](=O)[O-])c12)N1CCC(c2ccc(O)cc2)CC1 ZINC000535693547 934270256 /nfs/dbraw/zinc/27/02/56/934270256.db2.gz IRHWUNDUWRITNS-UHFFFAOYSA-N 0 0 365.389 3.802 20 5 FHBDRN CC(C)(CNC(=O)c1c[nH]c2cccc([N+](=O)[O-])c21)c1ccc(F)cc1 ZINC000535696257 934290507 /nfs/dbraw/zinc/29/05/07/934290507.db2.gz JBMUVINDWFXRQS-UHFFFAOYSA-N 0 0 355.369 3.923 20 5 FHBDRN Cc1nc(C(C)(C)NC(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)sc1C ZINC000535699606 934292995 /nfs/dbraw/zinc/29/29/95/934292995.db2.gz INNXLTGAOGCKEP-UHFFFAOYSA-N 0 0 358.423 3.815 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N(C)[C@@H]2CCC[C@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000458097238 934294844 /nfs/dbraw/zinc/29/48/44/934294844.db2.gz SQPNTFXGVKLBRO-LSDHHAIUSA-N 0 0 356.426 3.850 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1Cc2cccc(OC)c2C1 ZINC000458125218 934310154 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356.382 3.661 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(Cc2noc(-c3cc4ccccc4n3C)n2)c1 ZINC000582042041 935163223 /nfs/dbraw/zinc/16/32/23/935163223.db2.gz KPBBERXZVOPXFM-UHFFFAOYSA-N 0 0 364.361 3.736 20 5 FHBDRN O=[N+]([O-])c1cnc2c(Cl)cccc2c1N1CCC(n2ccnc2)CC1 ZINC000892160403 935178736 /nfs/dbraw/zinc/17/87/36/935178736.db2.gz WSLSOIZEZVXLBL-UHFFFAOYSA-N 0 0 357.801 3.834 20 5 FHBDRN O=C(NOCCC(F)(F)F)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000157764011 935187430 /nfs/dbraw/zinc/18/74/30/935187430.db2.gz SVKOOUNPCSSEIF-UHFFFAOYSA-N 0 0 361.198 3.619 20 5 FHBDRN Cn1ccnc1-c1cccc(NC(=O)C(C)(C)c2ccccc2[N+](=O)[O-])c1 ZINC000431341860 935191115 /nfs/dbraw/zinc/19/11/15/935191115.db2.gz NTYJOQYCSSTBLQ-UHFFFAOYSA-N 0 0 364.405 3.912 20 5 FHBDRN CCC[N@H+](CC(=O)[O-])Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000263407073 935199158 /nfs/dbraw/zinc/19/91/58/935199158.db2.gz KGLNVKGYWYRQCH-UHFFFAOYSA-N 0 0 352.774 3.805 20 5 FHBDRN OC1(CNc2cnc3c4ccccc4c4ccccc4c3n2)CCOCC1 ZINC001167545123 935210288 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FHBDRN O=[N+]([O-])c1cc(C(F)(F)F)ccc1NC[C@H](O)COc1ccc(F)cc1 ZINC000072027499 935225487 /nfs/dbraw/zinc/22/54/87/935225487.db2.gz VOBOBHXWTQUGRK-LBPRGKRZSA-N 0 0 374.290 3.605 20 5 FHBDRN C[C@H](CCOCc1ccccc1)NC(=O)Nc1ccc([N+](=O)[O-])cc1F ZINC000582085573 935232274 /nfs/dbraw/zinc/23/22/74/935232274.db2.gz MKUUKZCPKPFEMO-CYBMUJFWSA-N 0 0 361.373 3.851 20 5 FHBDRN COC(=O)/C=C\c1ccc(NCc2ccc(C(C)(C)O)cc2)c([N+](=O)[O-])c1 ZINC000588499244 935234492 /nfs/dbraw/zinc/23/44/92/935234492.db2.gz NVDFRLBZRWSSKM-XFFZJAGNSA-N 0 0 370.405 3.621 20 5 FHBDRN Cc1c(CC(=O)N2CCCN(C)c3ccc(Cl)cc32)cccc1[N+](=O)[O-] ZINC000438829645 945086347 /nfs/dbraw/zinc/08/63/47/945086347.db2.gz KWRXEAAYHDWEHO-UHFFFAOYSA-N 0 0 373.840 3.972 20 5 FHBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N(C)[C@@H]1CC[C@@H](C)C1 ZINC000551309805 935245842 /nfs/dbraw/zinc/24/58/42/935245842.db2.gz ZUKHMXCYXWVOQO-MWLCHTKSSA-N 0 0 355.232 3.926 20 5 FHBDRN C[C@H](c1cccc(Cl)c1)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000119807944 935248717 /nfs/dbraw/zinc/24/87/17/935248717.db2.gz BMYXIESEIHCNNH-CQSZACIVSA-N 0 0 373.840 3.767 20 5 FHBDRN CC(C)(C)OC(=O)CCC(C)(C)NC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000080840954 935248760 /nfs/dbraw/zinc/24/87/60/935248760.db2.gz BDQXOTWRPNQZLF-UHFFFAOYSA-N 0 0 370.833 3.879 20 5 FHBDRN CCO[C@@H](CC(=O)Nc1cc(Br)cc([N+](=O)[O-])c1)C(C)C ZINC000551325380 935249393 /nfs/dbraw/zinc/24/93/93/935249393.db2.gz HVXWWTITSHEFGY-ZDUSSCGKSA-N 0 0 359.220 3.747 20 5 FHBDRN COc1cccc2c1[C@H](C(=O)N1CCCc3ccc([N+](=O)[O-])cc31)CC2 ZINC000551325862 935249873 /nfs/dbraw/zinc/24/98/73/935249873.db2.gz KSXUGERCQIRKPC-MRXNPFEDSA-N 0 0 352.390 3.613 20 5 FHBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N[C@@H](C)CC(F)(F)F ZINC000551314507 935253332 /nfs/dbraw/zinc/25/33/32/935253332.db2.gz NIWIRASTIQPWNY-LURJTMIESA-N 0 0 369.137 3.736 20 5 FHBDRN COc1ncccc1-c1noc(-c2cc([N+](=O)[O-])ccc2C(F)(F)F)n1 ZINC000551337351 935258080 /nfs/dbraw/zinc/25/80/80/935258080.db2.gz GUHLATYNWDISKG-UHFFFAOYSA-N 0 0 366.255 3.734 20 5 FHBDRN CN(Cc1ccc(Br)o1)C(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000119820477 935259593 /nfs/dbraw/zinc/25/95/93/935259593.db2.gz UXLJIPRQNDMJSQ-UHFFFAOYSA-N 0 0 367.199 3.542 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)c1nc(-c2cnn(CCF)c2)no1 ZINC000924411453 935264472 /nfs/dbraw/zinc/26/44/72/935264472.db2.gz ARDQQEMLNWHFGK-SNVBAGLBSA-N 0 0 363.374 3.664 20 5 FHBDRN Cc1ccccc1[C@@H](C)NC(=O)[C@@H](C)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000511074608 935266347 /nfs/dbraw/zinc/26/63/47/935266347.db2.gz VRDXLHVVONXUPK-IAGOWNOFSA-N 0 0 369.465 3.643 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N(Cc1cccc(F)c1)C[C@H]1CCCO1 ZINC000072064520 935267088 /nfs/dbraw/zinc/26/70/88/935267088.db2.gz KPKCVLNKXDMADQ-GOSISDBHSA-N 0 0 372.396 3.864 20 5 FHBDRN CC(C)(C)c1ccc(NC(=O)C(=O)NCC2(C3CC3)CCC2)cc1[N+](=O)[O-] ZINC000551438191 935283405 /nfs/dbraw/zinc/28/34/05/935283405.db2.gz SIWPVZZMXQHTEM-UHFFFAOYSA-N 0 0 373.453 3.527 20 5 FHBDRN COC(=O)c1cccnc1SCc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000511076471 935288972 /nfs/dbraw/zinc/28/89/72/935288972.db2.gz XDNZBTYMMLJPOZ-UHFFFAOYSA-N 0 0 362.407 3.856 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N(Cc1ccccc1)c1ccccn1 ZINC000427105714 945091374 /nfs/dbraw/zinc/09/13/74/945091374.db2.gz ABODRYGPSLUGPO-UHFFFAOYSA-N 0 0 363.373 3.845 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N1CCC[C@@H]1c1ccc[nH]1 ZINC000119880968 935311428 /nfs/dbraw/zinc/31/14/28/935311428.db2.gz LGDGNAUXYQOAPV-CQSZACIVSA-N 0 0 353.300 3.919 20 5 FHBDRN CC(C)(C(=O)N[C@@H]1CCO[C@@H]1c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000551684375 935329368 /nfs/dbraw/zinc/32/93/68/935329368.db2.gz CLACEAHFCWDHDK-SJLPKXTDSA-N 0 0 354.406 3.519 20 5 FHBDRN CC(C)(C)c1ccc(NC(=O)C(=O)N[C@@H]2CC23CCCCC3)cc1[N+](=O)[O-] ZINC000551727800 935334350 /nfs/dbraw/zinc/33/43/50/935334350.db2.gz QZHMWVCFNRWMCX-MRXNPFEDSA-N 0 0 373.453 3.670 20 5 FHBDRN CN(Cc1nc(-c2ccccc2)c[nH]1)C(=O)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000161167226 935361749 /nfs/dbraw/zinc/36/17/49/935361749.db2.gz CCUAEBQNQABNFT-UHFFFAOYSA-N 0 0 370.796 3.911 20 5 FHBDRN Cc1noc(C)c1[C@@H](C)CC(=O)Nc1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000158152594 935369602 /nfs/dbraw/zinc/36/96/02/935369602.db2.gz PRMBDEKHCCHPET-JTQLQIEISA-N 0 0 354.366 3.880 20 5 FHBDRN Cc1cc(NC(=O)N(C)CCc2ccccc2[N+](=O)[O-])n(C(C)(C)C)n1 ZINC000551923207 935374824 /nfs/dbraw/zinc/37/48/24/935374824.db2.gz LHMRMFGXAZEQOB-UHFFFAOYSA-N 0 0 359.430 3.561 20 5 FHBDRN Cc1c(NC(=O)N(C[C@@H](C)c2ccccc2)[C@@H](C)CO)cccc1[N+](=O)[O-] ZINC000562024442 935382659 /nfs/dbraw/zinc/38/26/59/935382659.db2.gz JRCFGSCKKZZUNA-CABCVRRESA-N 0 0 371.437 3.922 20 5 FHBDRN O=c1c2cc([N+](=O)[O-])cc(Cl)c2ncn1CCCCC1CCOCC1 ZINC000516650450 945097042 /nfs/dbraw/zinc/09/70/42/945097042.db2.gz XRLUIVSXTGINAV-UHFFFAOYSA-N 0 0 365.817 3.555 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N1CCN(Cc2cccc(Cl)c2)CC1 ZINC000511091928 935391520 /nfs/dbraw/zinc/39/15/20/935391520.db2.gz QPCSWWIXJNWFTB-UHFFFAOYSA-N 0 0 373.840 3.515 20 5 FHBDRN CC(F)(F)c1cccc(NC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)c1 ZINC000548708562 935421270 /nfs/dbraw/zinc/42/12/70/935421270.db2.gz FZSBYZGWAARTMO-UHFFFAOYSA-N 0 0 350.277 3.688 20 5 FHBDRN Cc1ccc(C(=O)N(Cc2ccccc2[N+](=O)[O-])CC(F)(F)F)c(C)n1 ZINC000119994457 935426753 /nfs/dbraw/zinc/42/67/53/935426753.db2.gz CGIJHOBTQLNNPN-UHFFFAOYSA-N 0 0 367.327 3.811 20 5 FHBDRN CCOc1cc(C(=O)N(C)[C@H]2CCc3ccccc32)c([N+](=O)[O-])cc1OC ZINC000073718520 945100960 /nfs/dbraw/zinc/10/09/60/945100960.db2.gz INQMBLCLXMCTNV-INIZCTEOSA-N 0 0 370.405 3.762 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CC[C@H](CC(F)(F)F)C2)c(Br)c1 ZINC000277526332 935453617 /nfs/dbraw/zinc/45/36/17/935453617.db2.gz VNQOAQVJYLLCAF-SSDOTTSWSA-N 0 0 354.126 3.531 20 5 FHBDRN CCOc1cccc([C@@H](C)NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)c1 ZINC000120018028 935457445 /nfs/dbraw/zinc/45/74/45/935457445.db2.gz LJGKNFSWRAAMLA-CYBMUJFWSA-N 0 0 367.405 3.895 20 5 FHBDRN CC1(C)CC(CNC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])C1 ZINC000548713011 935457850 /nfs/dbraw/zinc/45/78/50/935457850.db2.gz PBJIDMMWKPGMAG-UHFFFAOYSA-N 0 0 360.332 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ZINC000478060968 935557563 /nfs/dbraw/zinc/55/75/63/935557563.db2.gz PHACFJUYYOWQCW-UHFFFAOYSA-N 0 0 356.313 3.512 20 5 FHBDRN Cc1ccc(OCCN(C)C(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)cc1 ZINC000024184867 935559121 /nfs/dbraw/zinc/55/91/21/935559121.db2.gz WVUKXXOMMGIOOH-HNNXBMFYSA-N 0 0 374.462 3.921 20 5 FHBDRN COc1cc(C(=O)N(Cc2cccc(F)c2)C2CC2)cc([N+](=O)[O-])c1C ZINC000478077548 935565372 /nfs/dbraw/zinc/56/53/72/935565372.db2.gz CYDIDUPDTHGVCD-UHFFFAOYSA-N 0 0 358.369 3.856 20 5 FHBDRN O=C(NCCCc1ccccc1F)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000478106717 935574128 /nfs/dbraw/zinc/57/41/28/935574128.db2.gz NHFZFCGRQVPRHX-UHFFFAOYSA-N 0 0 353.353 3.645 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N1CCO[C@@H](c2ccc(Cl)cc2)C1 ZINC000511784912 945111102 /nfs/dbraw/zinc/11/11/02/945111102.db2.gz MMKWJOZBVCKRIG-QGZVFWFLSA-N 0 0 360.797 3.770 20 5 FHBDRN CC[C@H](C)c1ncc(NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)cn1 ZINC000478305573 935612416 /nfs/dbraw/zinc/61/24/16/935612416.db2.gz BRICLJDTKORYMW-ZDUSSCGKSA-N 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369.446 3.713 20 5 FHBDRN CCOc1cc(OCC(=O)c2ccccc2OC(F)F)ccc1[N+](=O)[O-] ZINC000478729656 935687776 /nfs/dbraw/zinc/68/77/76/935687776.db2.gz BTELAFLLKCCXBQ-UHFFFAOYSA-N 0 0 367.304 3.857 20 5 FHBDRN CCc1cccc(CC)c1NC(=O)CN(C)CCc1ccccc1[N+](=O)[O-] ZINC000511122490 935689175 /nfs/dbraw/zinc/68/91/75/935689175.db2.gz NPJWDSPSECCMMF-UHFFFAOYSA-N 0 0 369.465 3.833 20 5 FHBDRN COC[C@H](NC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)c1ccccc1 ZINC000178578101 935692120 /nfs/dbraw/zinc/69/21/20/935692120.db2.gz IVRLGEZRJMTIJO-HNNXBMFYSA-N 0 0 368.311 3.731 20 5 FHBDRN Cc1cc(C(=O)N2CCC[C@@H]2CC(=O)c2ccccc2)ccc1[N+](=O)[O-] ZINC000085490651 935708421 /nfs/dbraw/zinc/70/84/21/935708421.db2.gz NWJZTLLSJRWBNV-QGZVFWFLSA-N 0 0 352.390 3.781 20 5 FHBDRN CC(C)c1ccccc1NC(=O)CN(C)CCc1ccccc1[N+](=O)[O-] ZINC000511126156 935713251 /nfs/dbraw/zinc/71/32/51/935713251.db2.gz XORHHGARPOYCID-UHFFFAOYSA-N 0 0 355.438 3.831 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2cnn(C[C@H](O)COc3ccc(Cl)cc3)c2)c1 ZINC000478797291 935725229 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Cc1cc(C(=O)Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)c(Cl)cc1F ZINC000127752851 935777599 /nfs/dbraw/zinc/77/75/99/935777599.db2.gz GDCJOCCKNRQOJF-UHFFFAOYSA-N 0 0 374.759 3.837 20 5 FHBDRN COC(=O)c1ccc(Cl)c(CN(C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000511141322 935781716 /nfs/dbraw/zinc/78/17/16/935781716.db2.gz VOEOTENHVHBOLI-UHFFFAOYSA-N 0 0 362.813 3.709 20 5 FHBDRN O=C(N[C@H](CCCc1ccccc1)c1ccccc1)c1c[nH]nc1[N+](=O)[O-] ZINC000548740579 935791148 /nfs/dbraw/zinc/79/11/48/935791148.db2.gz HGPMBDBBQKGLPR-GOSISDBHSA-N 0 0 364.405 3.812 20 5 FHBDRN COC(=O)c1cccc(CC(=O)Nc2cc([N+](=O)[O-])c(Cl)cc2C)c1 ZINC000135113554 935798411 /nfs/dbraw/zinc/79/84/11/935798411.db2.gz OKRNJQCYMBRFLU-UHFFFAOYSA-N 0 0 362.769 3.524 20 5 FHBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)c1ccnc(OCC(F)F)c1 ZINC000135113315 935798936 /nfs/dbraw/zinc/79/89/36/935798936.db2.gz UFVCLKSNILDHTB-UHFFFAOYSA-N 0 0 371.727 3.848 20 5 FHBDRN CCOC1CC(C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)c(C)s2)C1 ZINC000516678180 945124467 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O=C(c1csc(-c2ccc([N+](=O)[O-])cc2)n1)N1CCc2sccc2C1 ZINC000050297534 935827515 /nfs/dbraw/zinc/82/75/15/935827515.db2.gz RCXDHYMFVMQDIC-UHFFFAOYSA-N 0 0 371.443 3.978 20 5 FHBDRN O=C(NCCNc1ccc([N+](=O)[O-])cc1)c1ccc(F)c2ccccc12 ZINC000479351856 935828809 /nfs/dbraw/zinc/82/88/09/935828809.db2.gz UVAAOOAIFXKBCM-UHFFFAOYSA-N 0 0 353.353 3.729 20 5 FHBDRN Cc1sc2[nH]c([C@@H](C)Sc3ncccc3[N+](=O)[O-])nc(=O)c2c1C ZINC000127880302 935829155 /nfs/dbraw/zinc/82/91/55/935829155.db2.gz XXTNXDWHKHHGTH-SECBINFHSA-N 0 0 362.436 3.758 20 5 FHBDRN CCCN(C(=O)COc1ccc([N+](=O)[O-])cc1)[C@@H]1CCCc2cccnc21 ZINC000479369125 935831106 /nfs/dbraw/zinc/83/11/06/935831106.db2.gz VYKHXWHCDULTGH-GOSISDBHSA-N 0 0 369.421 3.685 20 5 FHBDRN Cc1ncc(CN(C)C(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)s1 ZINC000050333088 935833503 /nfs/dbraw/zinc/83/35/03/935833503.db2.gz SQEOWAQTUUGWCZ-UHFFFAOYSA-N 0 0 374.447 3.755 20 5 FHBDRN CCn1nc(C)c([N+](=O)[O-])c1Sc1nc2cc(Cl)ccc2n1C ZINC000479401471 935835335 /nfs/dbraw/zinc/83/53/35/935835335.db2.gz XEITVPKHFYBKLU-UHFFFAOYSA-N 0 0 351.819 3.811 20 5 FHBDRN CCC(=O)c1ccc(Sc2nnc(N3CCCC3)s2)c([N+](=O)[O-])c1 ZINC000479379025 935835740 /nfs/dbraw/zinc/83/57/40/935835740.db2.gz GKNSWZAYZHIHMA-UHFFFAOYSA-N 0 0 364.452 3.790 20 5 FHBDRN CCOc1cc(C(=O)N(C)[C@@H](CC)c2ccncc2)c([N+](=O)[O-])cc1OC ZINC000127899383 935837684 /nfs/dbraw/zinc/83/76/84/935837684.db2.gz PGULNKANEXOQNR-HNNXBMFYSA-N 0 0 373.409 3.620 20 5 FHBDRN Cc1cc(Oc2ncccn2)ccc1NC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000065565661 935846607 /nfs/dbraw/zinc/84/66/07/935846607.db2.gz MNPWJBAMGVAXFM-UHFFFAOYSA-N 0 0 350.334 3.738 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CC[C@@H](Cc3ccccc3)C2)c1 ZINC000187758219 935849912 /nfs/dbraw/zinc/84/99/12/935849912.db2.gz NRINJGBOUKTLNP-HOTGVXAUSA-N 0 0 354.406 3.745 20 5 FHBDRN CC[C@H](CNC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1)c1ccccc1 ZINC000479528697 935853086 /nfs/dbraw/zinc/85/30/86/935853086.db2.gz OGDVGLPISBFOJU-OAHLLOKOSA-N 0 0 364.405 3.704 20 5 FHBDRN Cc1c2ccccc2n(C)c1CNC(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000472233265 935865408 /nfs/dbraw/zinc/86/54/08/935865408.db2.gz WUCVVLBQLPBEIR-UHFFFAOYSA-N 0 0 366.421 3.737 20 5 FHBDRN CC(C)COCCCNC(=O)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000277736757 935868062 /nfs/dbraw/zinc/86/80/62/935868062.db2.gz HRLSGVHGJLIAST-UHFFFAOYSA-N 0 0 352.434 3.886 20 5 FHBDRN CS[C@@H]1CCC[C@H](NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000431462926 935868502 /nfs/dbraw/zinc/86/85/02/935868502.db2.gz DSAZXKSVTWSCPC-WCQYABFASA-N 0 0 373.272 3.761 20 5 FHBDRN O=C1[C@@H]2CCCCN2C(=O)N1c1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000562097554 935868786 /nfs/dbraw/zinc/86/87/86/935868786.db2.gz PFJFHPMWIHXCEP-KRWDZBQOSA-N 0 0 367.361 3.708 20 5 FHBDRN Cc1c(C(=O)N(C)C2CCC(C)(C)CC2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000152865456 935872615 /nfs/dbraw/zinc/87/26/15/935872615.db2.gz DQFJJGOQHCYIPP-UHFFFAOYSA-N 0 0 371.441 3.525 20 5 FHBDRN COCC[C@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl)c1ccc(C)o1 ZINC000479692096 935878094 /nfs/dbraw/zinc/87/80/94/935878094.db2.gz PCFAINAJJKIDGB-HNNXBMFYSA-N 0 0 366.801 3.586 20 5 FHBDRN C[C@H]1CN(C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)c2cccc(F)c2O1 ZINC000479699160 935880827 /nfs/dbraw/zinc/88/08/27/935880827.db2.gz ICFSEGPMRXLKPN-NSHDSACASA-N 0 0 371.368 3.736 20 5 FHBDRN C[C@@H]1CN(C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)c2cccc(F)c2O1 ZINC000479699159 935881021 /nfs/dbraw/zinc/88/10/21/935881021.db2.gz ICFSEGPMRXLKPN-LLVKDONJSA-N 0 0 371.368 3.736 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)NCC1(c2ccccn2)CCC1 ZINC000562111571 935881325 /nfs/dbraw/zinc/88/13/25/935881325.db2.gz VIOBWXPZNUFATB-UHFFFAOYSA-N 0 0 354.410 3.796 20 5 FHBDRN CCCCN(C(=O)CCn1cc([N+](=O)[O-])nc1C)[C@@H](C)c1ccccc1 ZINC000127999770 935882868 /nfs/dbraw/zinc/88/28/68/935882868.db2.gz WVKVVBILOPGPNC-HNNXBMFYSA-N 0 0 358.442 3.880 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)C1CCC(C(F)(F)F)CC1 ZINC000277752630 935885400 /nfs/dbraw/zinc/88/54/00/935885400.db2.gz ZJAAUOCTGXNBNL-UHFFFAOYSA-N 0 0 360.332 3.588 20 5 FHBDRN Cc1c(CNC(=O)N[C@@H]2CCCOc3c(F)cccc32)cccc1[N+](=O)[O-] ZINC000479741338 935885824 /nfs/dbraw/zinc/88/58/24/935885824.db2.gz GWBPCZDQUVUBMJ-MRXNPFEDSA-N 0 0 373.384 3.755 20 5 FHBDRN COCC1(c2noc(CCCNc3ccc([N+](=O)[O-])cc3)n2)CCCCC1 ZINC000562119085 935887606 /nfs/dbraw/zinc/88/76/06/935887606.db2.gz BKRUMCBRJNPMQA-UHFFFAOYSA-N 0 0 374.441 3.871 20 5 FHBDRN CC[C@@H](C)n1ncc(C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)c1C ZINC000479797455 935894766 /nfs/dbraw/zinc/89/47/66/935894766.db2.gz OOCFEFSCRQZLGT-CQSZACIVSA-N 0 0 358.442 3.823 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H](c1ccccc1)C(C)C ZINC000562140223 935903467 /nfs/dbraw/zinc/90/34/67/935903467.db2.gz USPBTFVGASDYQG-GOSISDBHSA-N 0 0 369.421 3.609 20 5 FHBDRN Cc1nc2ccccc2n1CCCNC(=O)c1cc(F)cc(C)c1[N+](=O)[O-] ZINC000176716509 935909569 /nfs/dbraw/zinc/90/95/69/935909569.db2.gz MSPXLAHXZVMZBS-UHFFFAOYSA-N 0 0 370.384 3.521 20 5 FHBDRN CCOc1cccc([C@@H](C)NC(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)c1 ZINC000479901559 935913482 /nfs/dbraw/zinc/91/34/82/935913482.db2.gz MHVOJAPNNOXIRL-CYBMUJFWSA-N 0 0 358.394 3.802 20 5 FHBDRN C[C@@H]1CCc2ccccc2[C@@H]1NC(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000548751627 935936875 /nfs/dbraw/zinc/93/68/75/935936875.db2.gz QFUNGUHDRKKCCY-AUUYWEPGSA-N 0 0 353.422 3.760 20 5 FHBDRN CCn1nc(C)c([N+](=O)[O-])c1N1CCc2ccc(Br)cc21 ZINC000480022352 935941522 /nfs/dbraw/zinc/94/15/22/935941522.db2.gz WSNKVSAPQAUNQD-UHFFFAOYSA-N 0 0 351.204 3.576 20 5 FHBDRN CC(C)(Cc1ccccc1F)c1nc(-c2ncc(F)cc2[N+](=O)[O-])no1 ZINC001211553719 935942018 /nfs/dbraw/zinc/94/20/18/935942018.db2.gz DQXNCCDRVSGDOL-UHFFFAOYSA-N 0 0 360.320 3.838 20 5 FHBDRN COc1cc(C(=O)Nc2c(C)cccc2SC)cc([N+](=O)[O-])c1OC ZINC000472242382 935947661 /nfs/dbraw/zinc/94/76/61/935947661.db2.gz OGMGCSGEZJQUJS-UHFFFAOYSA-N 0 0 362.407 3.895 20 5 FHBDRN Cc1c(CNC(=O)Nc2cccc(NC(=O)C(C)C)c2)cccc1[N+](=O)[O-] ZINC000480058132 935950239 /nfs/dbraw/zinc/95/02/39/935950239.db2.gz LYYDOHXJMFFLAR-UHFFFAOYSA-N 0 0 370.409 3.819 20 5 FHBDRN CCC(=O)c1ccc(N[C@H]2C[C@H](C)N(c3ccccc3)C2=O)c([N+](=O)[O-])c1 ZINC000480061054 935951483 /nfs/dbraw/zinc/95/14/83/935951483.db2.gz XAJZOZAJOVVKJB-GUYCJALGSA-N 0 0 367.405 3.793 20 5 FHBDRN CCOc1ccc(C(=O)N2CC[C@@H](c3ccccc3OC)C2)cc1[N+](=O)[O-] ZINC000153044662 935951496 /nfs/dbraw/zinc/95/14/96/935951496.db2.gz GOQZNBLSSVVYGV-OAHLLOKOSA-N 0 0 370.405 3.632 20 5 FHBDRN Cc1c(CNC(=O)Nc2ccccc2Br)cccc1[N+](=O)[O-] ZINC000480067957 935957505 /nfs/dbraw/zinc/95/75/05/935957505.db2.gz HHZQLLXJNQNLEU-UHFFFAOYSA-N 0 0 364.199 3.987 20 5 FHBDRN CCOc1cccc([C@@H]2C[C@H]2NC(=O)CSc2ccccc2[N+](=O)[O-])c1 ZINC000437213265 945136075 /nfs/dbraw/zinc/13/60/75/945136075.db2.gz AKKCVSGDVNYXEU-JKSUJKDBSA-N 0 0 372.446 3.758 20 5 FHBDRN CCOC(=O)/C=C\c1ccc(NCc2cc([N+](=O)[O-])ccc2OC)cc1 ZINC000255523283 935959197 /nfs/dbraw/zinc/95/91/97/935959197.db2.gz AGGCYMXJMPTEMN-WDZFZDKYSA-N 0 0 356.378 3.792 20 5 FHBDRN CCC(=O)c1ccc(N[C@@H](C)c2ccc(-n3ccnn3)cc2)c([N+](=O)[O-])c1 ZINC000480079159 935959308 /nfs/dbraw/zinc/95/93/08/935959308.db2.gz AFOJTLAKLUYWAN-ZDUSSCGKSA-N 0 0 365.393 3.941 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)Nc1nc2cc(C(F)(F)F)ccc2[nH]1 ZINC000178638422 935960738 /nfs/dbraw/zinc/96/07/38/935960738.db2.gz KXZGBLHUAJNKSQ-UHFFFAOYSA-N 0 0 364.283 3.671 20 5 FHBDRN O=C(CC1CCSCC1)OCc1ccc([N+](=O)[O-])cc1Br ZINC000135195110 935961058 /nfs/dbraw/zinc/96/10/58/935961058.db2.gz RWOOEJVSKLPYND-UHFFFAOYSA-N 0 0 374.256 3.934 20 5 FHBDRN C[C@H](CC1CCCCC1)C(=O)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000135528269 935967142 /nfs/dbraw/zinc/96/71/42/935967142.db2.gz KUGNMWQUURKPKK-ZBFHGGJFSA-N 0 0 360.458 3.609 20 5 FHBDRN O=[N+]([O-])c1ccc2ncnc(NC[C@H]3CCCC[C@@H]3C(F)(F)F)c2c1 ZINC000611709825 935969689 /nfs/dbraw/zinc/96/96/89/935969689.db2.gz UEIBMVQUMJAIKU-MFKMUULPSA-N 0 0 354.332 3.741 20 5 FHBDRN CCOc1ccc([C@@H]2C[C@H]2NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000437214922 945140871 /nfs/dbraw/zinc/14/08/71/945140871.db2.gz OWRAPBUTNZTLOR-RBUKOAKNSA-N 0 0 368.433 3.943 20 5 FHBDRN CC[C@@H]1CCC[C@H](C)N1C(=O)c1cc(Br)cc([N+](=O)[O-])c1N ZINC001167604299 935976054 /nfs/dbraw/zinc/97/60/54/935976054.db2.gz YDOQWHINOXOODD-GXSJLCMTSA-N 0 0 370.247 3.733 20 5 FHBDRN O=[N+]([O-])c1ccc2ncnc(N3CCO[C@@H](c4ccccc4Cl)C3)c2c1 ZINC000611711247 935981231 /nfs/dbraw/zinc/98/12/31/935981231.db2.gz UPUDHMNTFAIKPK-QGZVFWFLSA-N 0 0 370.796 3.769 20 5 FHBDRN COc1ccccc1CN(C(=O)NCCc1ccccc1[N+](=O)[O-])C1CC1 ZINC000074763939 935988453 /nfs/dbraw/zinc/98/84/53/935988453.db2.gz ITSLAMJBDJGUIS-UHFFFAOYSA-N 0 0 369.421 3.520 20 5 FHBDRN C[C@H]1CC[C@@H](C(F)(F)F)CN1C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000611560028 935989173 /nfs/dbraw/zinc/98/91/73/935989173.db2.gz BDLAFWQESLVZMF-GXSJLCMTSA-N 0 0 355.316 3.879 20 5 FHBDRN COc1cc(C)cc(CNc2ccc(C(=O)NC(C)C)cc2[N+](=O)[O-])c1 ZINC000128115850 935995949 /nfs/dbraw/zinc/99/59/49/935995949.db2.gz JKSVOMKDOFASGV-UHFFFAOYSA-N 0 0 357.410 3.662 20 5 FHBDRN COc1cc(N[C@H](C)CC(=O)Nc2cccc([N+](=O)[O-])c2)cc(OC)c1C ZINC000582730812 936014530 /nfs/dbraw/zinc/01/45/30/936014530.db2.gz UHEODWHMKHPIPJ-GFCCVEGCSA-N 0 0 373.409 3.750 20 5 FHBDRN COc1cc(N[C@@H](C)CC(=O)Nc2cccc([N+](=O)[O-])c2)cc(OC)c1C ZINC000582730813 936014652 /nfs/dbraw/zinc/01/46/52/936014652.db2.gz UHEODWHMKHPIPJ-LBPRGKRZSA-N 0 0 373.409 3.750 20 5 FHBDRN C[C@H](NC(=O)c1ccc(N)c([N+](=O)[O-])c1)c1cccc(C(F)(F)F)c1 ZINC000018016021 945139508 /nfs/dbraw/zinc/13/95/08/945139508.db2.gz JJVDZCODLBKXBO-VIFPVBQESA-N 0 0 353.300 3.687 20 5 FHBDRN CN(CCc1ccc([N+](=O)[O-])cc1)Cc1nccn1Cc1ccccc1 ZINC000075915122 936017271 /nfs/dbraw/zinc/01/72/71/936017271.db2.gz CMDMXGDDAIHKBF-UHFFFAOYSA-N 0 0 350.422 3.514 20 5 FHBDRN C[C@H]1c2ccsc2CCN1S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000146582693 936020688 /nfs/dbraw/zinc/02/06/88/936020688.db2.gz OYJUYAHGIJLKTB-VIFPVBQESA-N 0 0 372.855 3.618 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(Cc2noc(CCCC[C@@H](C)C(C)=O)n2)c1 ZINC000277853071 936040704 /nfs/dbraw/zinc/04/07/04/936040704.db2.gz GXHANAZUXCSCCP-GFCCVEGCSA-N 0 0 361.398 3.515 20 5 FHBDRN Nc1c(C(=O)Nc2nc3c(s2)CCCCCC3)cc(F)cc1[N+](=O)[O-] ZINC000110881869 945142324 /nfs/dbraw/zinc/14/23/24/945142324.db2.gz GRRHTNAGQUPHNC-UHFFFAOYSA-N 0 0 364.402 3.684 20 5 FHBDRN O=[N+]([O-])c1ccc2ncnc(N[C@@H](c3ccccc3)[C@H]3CCOC3)c2c1 ZINC000611713537 936054708 /nfs/dbraw/zinc/05/47/08/936054708.db2.gz DSBQWFDRULXGNK-KSSFIOAISA-N 0 0 350.378 3.728 20 5 FHBDRN CCc1ccc(Oc2ccc(C(=O)Nc3ccccc3)nn2)c([N+](=O)[O-])c1 ZINC000077979934 936060715 /nfs/dbraw/zinc/06/07/15/936060715.db2.gz HUQXYEKORZFXIC-UHFFFAOYSA-N 0 0 364.361 3.992 20 5 FHBDRN C[C@H]1C[C@@H](c2ccsc2)CN1C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000078194658 936062447 /nfs/dbraw/zinc/06/24/47/936062447.db2.gz ZKRJHIFOHIESQX-GXFFZTMASA-N 0 0 361.379 3.583 20 5 FHBDRN CCOc1cc(Cl)ccc1CNc1ncnc2ccc([N+](=O)[O-])cc21 ZINC000611713084 936064559 /nfs/dbraw/zinc/06/45/59/936064559.db2.gz VVJSCJAHMROMDY-UHFFFAOYSA-N 0 0 358.785 3.624 20 5 FHBDRN O=[N+]([O-])c1cc(-c2nc(Cc3cccs3)no2)ccc1OC(F)F ZINC000513640990 936069286 /nfs/dbraw/zinc/06/92/86/936069286.db2.gz VEFNTPVOUAIUCC-UHFFFAOYSA-N 0 0 353.306 3.899 20 5 FHBDRN CO[C@@H](c1ccc(F)cc1)[C@@H](C)Nc1ncnc2ccc([N+](=O)[O-])cc21 ZINC000611714383 936070006 /nfs/dbraw/zinc/07/00/06/936070006.db2.gz PTRNZHSKKDVTDC-PIGZYNQJSA-N 0 0 356.357 3.865 20 5 FHBDRN COc1cc(Cc2noc(-c3csc(Cl)c3)n2)ccc1[N+](=O)[O-] ZINC000582751165 936077303 /nfs/dbraw/zinc/07/73/03/936077303.db2.gz FLHNLXKNYFEDTN-UHFFFAOYSA-N 0 0 351.771 3.959 20 5 FHBDRN CCOc1cccc([C@@H]2C[C@H]2NC(=O)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000437217854 945144147 /nfs/dbraw/zinc/14/41/47/945144147.db2.gz KTCRDWLXRUHXEK-RBUKOAKNSA-N 0 0 354.406 3.598 20 5 FHBDRN COc1cccc(C2CCN(C(=O)Cc3cccc([N+](=O)[O-])c3C)CC2)c1 ZINC000178654224 936085604 /nfs/dbraw/zinc/08/56/04/936085604.db2.gz JZNRMBAALBBZHB-UHFFFAOYSA-N 0 0 368.433 3.861 20 5 FHBDRN COc1cc(OCc2nc(Cc3ccc(F)cc3C)no2)ccc1[N+](=O)[O-] ZINC000582764661 936093540 /nfs/dbraw/zinc/09/35/40/936093540.db2.gz XVQKMTAXCMHZJQ-UHFFFAOYSA-N 0 0 373.340 3.604 20 5 FHBDRN O=C(Nc1ccc(O[C@@H]2CCCC[C@@H]2O)cc1)c1ccc(F)cc1[N+](=O)[O-] ZINC000135676793 936097929 /nfs/dbraw/zinc/09/79/29/936097929.db2.gz XHFCGHBQKGOHKT-ZWKOTPCHSA-N 0 0 374.368 3.669 20 5 FHBDRN CCOC(=O)Cc1ccccc1NC(=O)c1c(C)c(C)ccc1[N+](=O)[O-] ZINC000888981718 936102705 /nfs/dbraw/zinc/10/27/05/936102705.db2.gz SSPKKSMCCALTRV-UHFFFAOYSA-N 0 0 356.378 3.570 20 5 FHBDRN C[C@H](NC(=O)CN(Cc1ccccc1[N+](=O)[O-])C1CC1)c1ccc(F)cc1 ZINC000135240557 936111441 /nfs/dbraw/zinc/11/14/41/936111441.db2.gz CSCSCGPTOASPBN-AWEZNQCLSA-N 0 0 371.412 3.576 20 5 FHBDRN Cc1nccn1CCCCNc1cc(C)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000078336409 936112650 /nfs/dbraw/zinc/11/26/50/936112650.db2.gz FGUMQTGXTFKMLW-UHFFFAOYSA-N 0 0 366.425 3.757 20 5 FHBDRN CC(C)(C)Oc1cc(NCc2ccc(-n3cncn3)cc2)ccc1[N+](=O)[O-] ZINC000091432186 936113160 /nfs/dbraw/zinc/11/31/60/936113160.db2.gz ODUNPUXZBLCIQR-UHFFFAOYSA-N 0 0 367.409 3.965 20 5 FHBDRN Cc1ccc(C[C@H]2CCCN(C(=O)c3[nH]nc(C(C)C)c3[N+](=O)[O-])C2)cc1 ZINC000582778661 936113381 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369.808 3.788 20 5 FHBDRN O=C(Cn1cc([N+](=O)[O-])cn1)Nc1ccc(Oc2cccc(Cl)c2)cc1 ZINC000061261347 936250972 /nfs/dbraw/zinc/25/09/72/936250972.db2.gz IIEPXOLZGPCESG-UHFFFAOYSA-N 0 0 372.768 3.876 20 5 FHBDRN Cc1ccc(CN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C2CC2)o1 ZINC000051966247 936250995 /nfs/dbraw/zinc/25/09/95/936250995.db2.gz AXMTWQCMXKPGNR-UHFFFAOYSA-N 0 0 354.366 3.711 20 5 FHBDRN COc1cc(CCNC(=O)CC2(C)CCCCC2)c([N+](=O)[O-])cc1OC ZINC000178702952 936251779 /nfs/dbraw/zinc/25/17/79/936251779.db2.gz RZEQLARRYPMQFX-UHFFFAOYSA-N 0 0 364.442 3.631 20 5 FHBDRN C[C@@H](Nc1ccc([N+](=O)[O-])c2cccnc12)c1ccc(-n2cncn2)cc1 ZINC000078716358 936252280 /nfs/dbraw/zinc/25/22/80/936252280.db2.gz DAESKAYAXYOXFN-CYBMUJFWSA-N 0 0 360.377 3.897 20 5 FHBDRN Cn1c(Sc2ncc(Cl)cc2[N+](=O)[O-])nnc1-c1cccs1 ZINC000153541080 936255539 /nfs/dbraw/zinc/25/55/39/936255539.db2.gz VXSLCIGOKNNKHX-UHFFFAOYSA-N 0 0 353.816 3.651 20 5 FHBDRN CCOc1cccc([C@@H]2C[C@H]2NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)c1 ZINC000437230365 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938282005 /nfs/dbraw/zinc/28/20/05/938282005.db2.gz UNNFRCZAIUULOW-UHFFFAOYSA-N 0 0 367.409 3.735 20 5 FHBDRN CC(=O)Nc1ccc(C(=O)Nc2cc(C)nc3ccc([N+](=O)[O-])cc32)cc1 ZINC000161754149 938290150 /nfs/dbraw/zinc/29/01/50/938290150.db2.gz ONEWWRBPXNCGDE-UHFFFAOYSA-N 0 0 364.361 3.662 20 5 FHBDRN CC(=O)c1ccc(NCc2ccc(-n3nc(C)cc3C)nc2)c([N+](=O)[O-])c1 ZINC000052409405 938291579 /nfs/dbraw/zinc/29/15/79/938291579.db2.gz YTHZCMUNJLBEIV-UHFFFAOYSA-N 0 0 365.393 3.607 20 5 FHBDRN Cc1noc(NC(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)c1C ZINC000511802330 945163072 /nfs/dbraw/zinc/16/30/72/945163072.db2.gz NRSCMOMCVZVZMG-UHFFFAOYSA-N 0 0 354.160 3.523 20 5 FHBDRN CC[C@H](Nc1c2ccccc2n(C)c(=O)c1[N+](=O)[O-])c1nc(C)cs1 ZINC000892342336 938296186 /nfs/dbraw/zinc/29/61/86/938296186.db2.gz LRDRKLKKROBHAR-LBPRGKRZSA-N 0 0 358.423 3.775 20 5 FHBDRN CC[C@@H](Nc1c2ccccc2n(C)c(=O)c1[N+](=O)[O-])c1nc(C)cs1 ZINC000892342333 938296302 /nfs/dbraw/zinc/29/63/02/938296302.db2.gz LRDRKLKKROBHAR-GFCCVEGCSA-N 0 0 358.423 3.775 20 5 FHBDRN COc1ccc2c(c1)CCC[C@H]2N(C)C(=O)COc1cccc([N+](=O)[O-])c1 ZINC000572981058 938304095 /nfs/dbraw/zinc/30/40/95/938304095.db2.gz IBJBSMNVZBSNFB-LJQANCHMSA-N 0 0 370.405 3.518 20 5 FHBDRN Cc1noc(C)c1[C@@H](C)C(=O)Nc1cc(C)nc2ccc([N+](=O)[O-])cc21 ZINC000161779347 938308353 /nfs/dbraw/zinc/30/83/53/938308353.db2.gz SSOPRIBDZHCLJL-SNVBAGLBSA-N 0 0 354.366 3.798 20 5 FHBDRN Cc1cc(F)cc(C(=O)N2C[C@@H](C)O[C@H](c3ccccc3)C2)c1[N+](=O)[O-] ZINC000176788174 938308974 /nfs/dbraw/zinc/30/89/74/938308974.db2.gz VPVLFXSNTBLADK-DYVFJYSZSA-N 0 0 358.369 3.645 20 5 FHBDRN CCCC(=O)Nc1ccc(C(=O)COc2c(C)c(C)ncc2[N+](=O)[O-])cc1 ZINC000583575502 938309080 /nfs/dbraw/zinc/30/90/80/938309080.db2.gz IFEJCNFWMVNNIS-UHFFFAOYSA-N 0 0 371.393 3.607 20 5 FHBDRN CCOCCCCNC(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000278337621 938314465 /nfs/dbraw/zinc/31/44/65/938314465.db2.gz XSTNXNRPFNCRNB-UHFFFAOYSA-N 0 0 372.421 3.720 20 5 FHBDRN CCc1nc(CC(=O)Nc2cc(C)nc3ccc([N+](=O)[O-])cc32)cs1 ZINC000161798849 938316787 /nfs/dbraw/zinc/31/67/87/938316787.db2.gz YEEKJSZKUMXJRK-UHFFFAOYSA-N 0 0 356.407 3.652 20 5 FHBDRN COCc1ccsc1C(=O)Nc1cc(C)nc2ccc([N+](=O)[O-])cc21 ZINC000161794374 938317459 /nfs/dbraw/zinc/31/74/59/938317459.db2.gz YYJHQAMNLOYUBZ-UHFFFAOYSA-N 0 0 357.391 3.912 20 5 FHBDRN CC(C)(C(=O)N1CCO[C@H](c2ccsc2)C1)c1ccccc1[N+](=O)[O-] ZINC000583634661 938330089 /nfs/dbraw/zinc/33/00/89/938330089.db2.gz CTVUXVCPAVUHGT-INIZCTEOSA-N 0 0 360.435 3.534 20 5 FHBDRN C[C@@H](NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)c1c(F)cccc1F ZINC000536091318 938333714 /nfs/dbraw/zinc/33/37/14/938333714.db2.gz YOKPUHYKTQUWNY-SNVBAGLBSA-N 0 0 359.332 3.774 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N1CCC(c2ccncc2)CC1 ZINC000278355383 938335507 /nfs/dbraw/zinc/33/55/07/938335507.db2.gz PECXXMBJEUVRDT-UHFFFAOYSA-N 0 0 359.813 3.971 20 5 FHBDRN CC(C)[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)C1(CO)CCCC1 ZINC000583640387 938335872 /nfs/dbraw/zinc/33/58/72/938335872.db2.gz JKVACQUTJAMHAZ-HNNXBMFYSA-N 0 0 354.834 3.555 20 5 FHBDRN O=[N+]([O-])c1cccc2c1CCN2Cc1nnc(-c2ccc(Cl)cc2)o1 ZINC000178948547 938338130 /nfs/dbraw/zinc/33/81/30/938338130.db2.gz ZNTCXISIIHAUFE-UHFFFAOYSA-N 0 0 356.769 3.861 20 5 FHBDRN O=c1[nH]c(N2CC[C@@H](c3cccc(Cl)c3)C2)nc2ccc([N+](=O)[O-])cc12 ZINC000432135868 945166403 /nfs/dbraw/zinc/16/64/03/945166403.db2.gz MUDWMVRYFYLAOW-GFCCVEGCSA-N 0 0 370.796 3.891 20 5 FHBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])N1C[C@H](C2CC2)[C@@H]1C1CC1 ZINC000458630770 938348610 /nfs/dbraw/zinc/34/86/10/938348610.db2.gz MOVXXBGPQMSYHJ-WBVHZDCISA-N 0 0 363.845 3.621 20 5 FHBDRN Cc1cc(NC(=O)c2ccn(-c3ccccc3)n2)c2cc([N+](=O)[O-])ccc2n1 ZINC000161826401 938355582 /nfs/dbraw/zinc/35/55/82/938355582.db2.gz AMWLCWBJGJHAFL-UHFFFAOYSA-N 0 0 373.372 3.889 20 5 FHBDRN CC(C)Oc1ccccc1CC(=O)NC(C)(C)c1ccccc1[N+](=O)[O-] ZINC000583711046 938372893 /nfs/dbraw/zinc/37/28/93/938372893.db2.gz DTNGBHFLXUAZND-UHFFFAOYSA-N 0 0 356.422 3.976 20 5 FHBDRN CNc1ccc([N+](=O)[O-])cc1C(=O)Nc1cnn(-c2cccc(C)c2)c1C ZINC001299803313 938383775 /nfs/dbraw/zinc/38/37/75/938383775.db2.gz YDKSJIFBYQHDNV-UHFFFAOYSA-N 0 0 365.393 3.691 20 5 FHBDRN CN(C(=O)OC(C)(C)C)[C@@H]1CCCN(Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000725811160 938389547 /nfs/dbraw/zinc/38/95/47/938389547.db2.gz CWMJNGXYPOQCLI-OAHLLOKOSA-N 0 0 367.421 3.565 20 5 FHBDRN Cc1ccc(CN(C2CC2)S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000056095444 938390712 /nfs/dbraw/zinc/39/07/12/938390712.db2.gz GOJKIEBKRFQICN-UHFFFAOYSA-N 0 0 370.814 3.503 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)N(Cc2ccco2)c2cccc(Cl)c2)n1 ZINC000427187048 945170450 /nfs/dbraw/zinc/17/04/50/945170450.db2.gz VLZDKIJJNFVQNB-UHFFFAOYSA-N 0 0 374.784 3.905 20 5 FHBDRN COc1cc(NCc2nccn2CCc2ccccc2)c(F)cc1[N+](=O)[O-] ZINC000509582922 945172296 /nfs/dbraw/zinc/17/22/96/945172296.db2.gz BHLLZLLXNWRCTK-UHFFFAOYSA-N 0 0 370.384 3.794 20 5 FHBDRN O=C(Cc1cccc(OC(F)F)c1)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000161889028 938416544 /nfs/dbraw/zinc/41/65/44/938416544.db2.gz FJMHDIWCRFZUBY-UHFFFAOYSA-N 0 0 362.332 3.718 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)C(F)(F)F)cc1N1CCCSCC1 ZINC000278426897 938417097 /nfs/dbraw/zinc/41/70/97/938417097.db2.gz JBCUKVPWIUHJOM-UHFFFAOYSA-N 0 0 357.304 3.587 20 5 FHBDRN C[C@@](NC(=O)COc1ccc([N+](=O)[O-])cc1)(c1ccccc1)C(F)(F)F ZINC000536137156 938434299 /nfs/dbraw/zinc/43/42/99/938434299.db2.gz YOTKVNAMKFHZQG-MRXNPFEDSA-N 0 0 368.311 3.568 20 5 FHBDRN Cc1c(NC(=O)NCc2ccccc2[N+](=O)[O-])cnn1-c1ccccc1F ZINC000178984589 938437432 /nfs/dbraw/zinc/43/74/32/938437432.db2.gz UTPWLDGCWUKVGZ-UHFFFAOYSA-N 0 0 369.356 3.550 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H]1CC[C@@H]2CCCC[C@H]2C1 ZINC000583842828 938446487 /nfs/dbraw/zinc/44/64/87/938446487.db2.gz NJIOVBNUJGSCAH-HRCADAONSA-N 0 0 373.453 3.571 20 5 FHBDRN O=c1c2cc(NCc3c(Cl)cccc3[N+](=O)[O-])ccc2nc2n1CCC2 ZINC000516725823 945175452 /nfs/dbraw/zinc/17/54/52/945175452.db2.gz ZJMRNZAZOFWXIG-UHFFFAOYSA-N 0 0 370.796 3.516 20 5 FHBDRN CC(C)C[C@]1(C)CCCN1C(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000458704855 938452780 /nfs/dbraw/zinc/45/27/80/938452780.db2.gz KEFSQMGYCIFBNQ-SFHVURJKSA-N 0 0 359.430 3.581 20 5 FHBDRN C[C@@](O)(C1CCN(c2ccc([N+](=O)[O-])c3ncccc32)CC1)C(F)(F)F ZINC000583858849 938454060 /nfs/dbraw/zinc/45/40/60/938454060.db2.gz UNNHBXVZUHNIRQ-MRXNPFEDSA-N 0 0 369.343 3.673 20 5 FHBDRN CC(=O)NCC[C@@H]1CCCN(c2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)C1 ZINC000583864073 938456887 /nfs/dbraw/zinc/45/68/87/938456887.db2.gz SGKYLDFEYQDLFY-HNNXBMFYSA-N 0 0 363.458 3.515 20 5 FHBDRN O=C(N[C@@H]1C[C@H]1c1cccc(Br)c1)c1csc([N+](=O)[O-])c1 ZINC000583906246 938477137 /nfs/dbraw/zinc/47/71/37/938477137.db2.gz SXCPDSMMNMKSQH-NWDGAFQWSA-N 0 0 367.224 3.705 20 5 FHBDRN C[C@@H]1CSC[C@@H]1NC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000583922741 938488270 /nfs/dbraw/zinc/48/82/70/938488270.db2.gz AFZLPMNXTKJDQA-DYVFJYSZSA-N 0 0 371.462 3.688 20 5 FHBDRN CS[C@@H]1CCCCN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000151235292 938503713 /nfs/dbraw/zinc/50/37/13/938503713.db2.gz IJKFQNWJMYDNRK-CYBMUJFWSA-N 0 0 373.272 3.715 20 5 FHBDRN Cc1cc(C(=O)N(C)c2cccc([N+](=O)[O-])c2)c2c(n1)onc2C(C)C ZINC000179019436 938509072 /nfs/dbraw/zinc/50/90/72/938509072.db2.gz ZXUZLTJDQPUEFB-UHFFFAOYSA-N 0 0 354.366 3.839 20 5 FHBDRN COc1ccc(OCCSCCOc2ccccc2F)c([N+](=O)[O-])c1 ZINC000437274628 945181987 /nfs/dbraw/zinc/18/19/87/945181987.db2.gz HVZVKFNYECPHNL-UHFFFAOYSA-N 0 0 367.398 3.934 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)N(C)[C@H](C)c2ccc(C(F)(F)F)cc2)n1 ZINC000427192460 945182423 /nfs/dbraw/zinc/18/24/23/945182423.db2.gz JHIXEEVXFKNFLW-SNVBAGLBSA-N 0 0 370.331 3.663 20 5 FHBDRN CCN([C@@H](C)Cc1ccsc1)S(=O)(=O)c1cc(C)sc1[N+](=O)[O-] ZINC001211606294 938536078 /nfs/dbraw/zinc/53/60/78/938536078.db2.gz SCJXQRUQNLSGND-JTQLQIEISA-N 0 0 374.509 3.668 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N(C)C[C@H]1CCCC[C@H]1O ZINC000507365698 945184573 /nfs/dbraw/zinc/18/45/73/945184573.db2.gz XNPDRCLWERDDME-CZUORRHYSA-N 0 0 366.483 3.720 20 5 FHBDRN C[C@H](NC(=O)N[C@@H]1c2ccc(F)cc2O[C@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000458769028 938544889 /nfs/dbraw/zinc/54/48/89/938544889.db2.gz PFKPVQQACCYPLF-DINDLPBHSA-N 0 0 359.357 3.616 20 5 FHBDRN C[C@@H](NC(=O)c1[nH]ncc1[N+](=O)[O-])c1ccc(-c2ccc(F)cc2)cc1 ZINC000091821016 938548198 /nfs/dbraw/zinc/54/81/98/938548198.db2.gz VGJOWJJNRQXAKM-LLVKDONJSA-N 0 0 354.341 3.615 20 5 FHBDRN Cc1noc(-c2ccccc2)c1NC(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000126686542 945184878 /nfs/dbraw/zinc/18/48/78/945184878.db2.gz HTJNTBALVUPVSV-UHFFFAOYSA-N 0 0 352.350 3.880 20 5 FHBDRN Cc1cccc(OCC(=O)N(C)Cc2c(F)cccc2Cl)c1[N+](=O)[O-] ZINC000123994208 938550198 /nfs/dbraw/zinc/55/01/98/938550198.db2.gz NNUUXHCIZMPWTM-UHFFFAOYSA-N 0 0 366.776 3.733 20 5 FHBDRN COc1cc(CN2Cc3ccccc3OC(C)(C)C2)c([N+](=O)[O-])cc1OC ZINC000584020998 938550877 /nfs/dbraw/zinc/55/08/77/938550877.db2.gz BXMRIZNRWUHDLP-UHFFFAOYSA-N 0 0 372.421 3.785 20 5 FHBDRN COc1cc(C(=O)Nc2cccc(NC(=O)C3CC3)c2)cc([N+](=O)[O-])c1C ZINC000187941096 938556940 /nfs/dbraw/zinc/55/69/40/938556940.db2.gz MURPUGIZXNCWMI-UHFFFAOYSA-N 0 0 369.377 3.513 20 5 FHBDRN CC1(C)CN(c2ncnc3sc([N+](=O)[O-])cc32)C[C@]2(C[C@@H]3CC[C@H]2C3)O1 ZINC000408109050 945185571 /nfs/dbraw/zinc/18/55/71/945185571.db2.gz VUBWQPHZGWDPES-SOZUMNATSA-N 0 0 374.466 3.774 20 5 FHBDRN Cc1ccc(C)n1-c1nc(CC(=O)N(C)c2cccc([N+](=O)[O-])c2)cs1 ZINC000179024673 938558521 /nfs/dbraw/zinc/55/85/21/938558521.db2.gz QGVSHFGKUUWZLV-UHFFFAOYSA-N 0 0 370.434 3.664 20 5 FHBDRN Cc1cc(F)cc(C(=O)N[C@@H]2CCOC3(CCCCC3)C2)c1[N+](=O)[O-] ZINC000124224051 945185610 /nfs/dbraw/zinc/18/56/10/945185610.db2.gz HBRQCLQGXZNSNU-CQSZACIVSA-N 0 0 350.390 3.654 20 5 FHBDRN CCc1cccnc1NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000506009940 945186226 /nfs/dbraw/zinc/18/62/26/945186226.db2.gz UEZYOFALIXLPER-UHFFFAOYSA-N 0 0 354.391 3.928 20 5 FHBDRN Cc1cccc(C)c1[C@H](C)NC(=O)N1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000426210824 945186913 /nfs/dbraw/zinc/18/69/13/945186913.db2.gz OQSJSSWEQOLDIC-HNNXBMFYSA-N 0 0 371.441 3.516 20 5 FHBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)N[C@H]1CCC[C@@H]1c1ccccc1 ZINC000536207678 938581279 /nfs/dbraw/zinc/58/12/79/938581279.db2.gz CLHAUGQQFGZOBJ-MOPGFXCFSA-N 0 0 353.422 3.773 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@H](C[C@H]1CCOC1)c1ccccc1 ZINC000158810339 938586316 /nfs/dbraw/zinc/58/63/16/938586316.db2.gz BHKIWLDYURPBBS-DNVCBOLYSA-N 0 0 354.406 3.801 20 5 FHBDRN CC(C)NC(=O)c1ccc(N2CC[C@@](F)(c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000584125359 938607597 /nfs/dbraw/zinc/60/75/97/938607597.db2.gz GRXBVFLEOYGHSU-FQEVSTJZSA-N 0 0 371.412 3.808 20 5 FHBDRN COc1cccc(Cl)c1Cc1nc(Cc2ccccc2[N+](=O)[O-])no1 ZINC000584120929 938608752 /nfs/dbraw/zinc/60/87/52/938608752.db2.gz PMOLMJHXQHHDRE-UHFFFAOYSA-N 0 0 359.769 3.821 20 5 FHBDRN O=C(N[C@@H]1C[C@H]1c1c(F)cccc1F)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000437266595 945189868 /nfs/dbraw/zinc/18/98/68/945189868.db2.gz FZMLVJRLJLDOPD-BDJLRTHQSA-N 0 0 357.316 3.640 20 5 FHBDRN O=C(NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)c1ccnc2ccccc21 ZINC000584136089 938614416 /nfs/dbraw/zinc/61/44/16/938614416.db2.gz KMNXPFSVDHIFQA-UHFFFAOYSA-N 0 0 360.373 3.597 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N1CCC[C@@]2(C1)OCc1ccccc12 ZINC000584148378 938617774 /nfs/dbraw/zinc/61/77/74/938617774.db2.gz QTYQESSHPXSOCN-FQEVSTJZSA-N 0 0 352.390 3.565 20 5 FHBDRN O=C(N[C@@H]1CCOC1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000179056395 938619005 /nfs/dbraw/zinc/61/90/05/938619005.db2.gz PAYYONLJGMDOLC-CYBMUJFWSA-N 0 0 362.769 3.559 20 5 FHBDRN CO[C@@H](C)c1cccc(NC(=O)N2CCOc3ccc([N+](=O)[O-])cc3C2)c1 ZINC000566885296 945190774 /nfs/dbraw/zinc/19/07/74/945190774.db2.gz XNWAROJLVUMAQA-ZDUSSCGKSA-N 0 0 371.393 3.729 20 5 FHBDRN COc1cc(Cc2noc([C@H]3Cc4cccc(C)c4O3)n2)ccc1[N+](=O)[O-] ZINC000584154660 938619973 /nfs/dbraw/zinc/61/99/73/938619973.db2.gz GKQRWARBLACXEM-MRXNPFEDSA-N 0 0 367.361 3.562 20 5 FHBDRN COC[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1SC1CCCC1)C1CC1 ZINC000162092937 938644333 /nfs/dbraw/zinc/64/43/33/938644333.db2.gz PUNHCAHVPXWBKL-MRXNPFEDSA-N 0 0 364.467 3.784 20 5 FHBDRN O=C(c1csc([N+](=O)[O-])c1)N1CC[C@H](Oc2ccccc2Cl)C1 ZINC000179065761 938649457 /nfs/dbraw/zinc/64/94/57/938649457.db2.gz JVVODRZZHSWNMB-NSHDSACASA-N 0 0 352.799 3.603 20 5 FHBDRN Cn1cc(C(=O)NCc2ccc(Cl)cc2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000052917004 938661654 /nfs/dbraw/zinc/66/16/54/938661654.db2.gz WGYPMTHLVWRJOP-UHFFFAOYSA-N 0 0 370.796 3.579 20 5 FHBDRN CC(C)(c1nc(Cc2c[nH]c3ccc([N+](=O)[O-])cc23)no1)C1CCOCC1 ZINC000584257741 938662282 /nfs/dbraw/zinc/66/22/82/938662282.db2.gz HJLOHYCIJRRHRM-UHFFFAOYSA-N 0 0 370.409 3.754 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2nc(-c3cnn(-c4cccc(Cl)c4)c3)no2)nc1 ZINC000584271137 938666663 /nfs/dbraw/zinc/66/66/63/938666663.db2.gz MZBZOHOEUNPVFI-UHFFFAOYSA-N 0 0 368.740 3.546 20 5 FHBDRN C[C@@H](CNC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000052960733 938681273 /nfs/dbraw/zinc/68/12/73/938681273.db2.gz GSEGAAPIKDGQGV-AWEZNQCLSA-N 0 0 364.405 3.529 20 5 FHBDRN CCCc1nc(-c2noc(-c3ccc(NC4CC4)c([N+](=O)[O-])c3)n2)co1 ZINC000584318074 938684316 /nfs/dbraw/zinc/68/43/16/938684316.db2.gz RKFOGKBIXVPSDM-UHFFFAOYSA-N 0 0 355.354 3.827 20 5 FHBDRN CS[C@H](CNC(=O)N(C)CCc1cccc([N+](=O)[O-])c1)C(C)(C)C ZINC000511817471 945196749 /nfs/dbraw/zinc/19/67/49/945196749.db2.gz NQPMYKZZNPEWHZ-OAHLLOKOSA-N 0 0 353.488 3.556 20 5 FHBDRN COc1ccc(NC(=O)N[C@@H]2COc3c2cccc3Cl)cc1[N+](=O)[O-] ZINC000611828191 938705857 /nfs/dbraw/zinc/70/58/57/938705857.db2.gz CXONVQJXVHSGQV-GFCCVEGCSA-N 0 0 363.757 3.512 20 5 FHBDRN Cc1ccc(C(=O)Nc2cccc(Nc3cnn(C)c3)c2)cc1[N+](=O)[O-] ZINC000080827818 938706396 /nfs/dbraw/zinc/70/63/96/938706396.db2.gz GAQRRZKXVVUFPQ-UHFFFAOYSA-N 0 0 351.366 3.633 20 5 FHBDRN CC[C@](C)(NC(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-])C(F)(F)F ZINC000080941876 938708485 /nfs/dbraw/zinc/70/84/85/938708485.db2.gz OXBQUHBLOVSBCP-ZDUSSCGKSA-N 0 0 366.361 3.786 20 5 FHBDRN Cc1cnc(NCc2nccn2CCCc2ccccc2)c([N+](=O)[O-])c1 ZINC000081033314 938716406 /nfs/dbraw/zinc/71/64/06/938716406.db2.gz ACNQKGKOYJXKJB-UHFFFAOYSA-N 0 0 351.410 3.740 20 5 FHBDRN CC(=O)c1ccc(NCc2nccn2CCc2ccccc2)c([N+](=O)[O-])c1 ZINC000081032894 938716419 /nfs/dbraw/zinc/71/64/19/938716419.db2.gz IPROUQZLLIOUGW-UHFFFAOYSA-N 0 0 364.405 3.849 20 5 FHBDRN Cc1cc(N2CCC(OC[C@H]3CCCO3)CC2)c(Cl)cc1[N+](=O)[O-] ZINC000081030966 938716470 /nfs/dbraw/zinc/71/64/70/938716470.db2.gz MQAASWVCMMKWDM-CQSZACIVSA-N 0 0 354.834 3.721 20 5 FHBDRN NC(=O)c1ccc(N2CC=C(c3ccc(Cl)cc3)CC2)c([N+](=O)[O-])c1 ZINC000081034481 938716714 /nfs/dbraw/zinc/71/67/14/938716714.db2.gz QYMVABRUQWTPLX-UHFFFAOYSA-N 0 0 357.797 3.641 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N(C)c1ccc(-c2ccccc2)cc1 ZINC000081120788 938721117 /nfs/dbraw/zinc/72/11/17/938721117.db2.gz OOOXABDFUYCMEY-UHFFFAOYSA-N 0 0 364.405 3.820 20 5 FHBDRN COCc1nc(CSCCCOc2ccc([N+](=O)[O-])cc2)cs1 ZINC000437283819 945200393 /nfs/dbraw/zinc/20/03/93/945200393.db2.gz JFMPIACXAFIHON-UHFFFAOYSA-N 0 0 354.453 3.900 20 5 FHBDRN CCCNC(=O)C1CCN(c2cc(C)c(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000519187099 945200426 /nfs/dbraw/zinc/20/04/26/945200426.db2.gz MPXOSQBKEJURIV-UHFFFAOYSA-N 0 0 373.375 3.665 20 5 FHBDRN CC(C)c1ccoc1-c1noc(-c2ccc(-n3cncn3)c([N+](=O)[O-])c2)n1 ZINC000426218606 945200629 /nfs/dbraw/zinc/20/06/29/945200629.db2.gz XRRVSUSHOUPDQM-UHFFFAOYSA-N 0 0 366.337 3.609 20 5 FHBDRN CCCc1cc(C(=O)N2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)sc1C ZINC000135530581 938776268 /nfs/dbraw/zinc/77/62/68/938776268.db2.gz FAEBBIFQLCQZHU-CQSZACIVSA-N 0 0 374.466 3.639 20 5 FHBDRN O=C(Nc1ccccc1)c1ccc(Oc2cc(F)cc([N+](=O)[O-])c2)nn1 ZINC000135530528 938782013 /nfs/dbraw/zinc/78/20/13/938782013.db2.gz ZGQSPAVJDPIZRI-UHFFFAOYSA-N 0 0 354.297 3.569 20 5 FHBDRN O=C(c1cnc([C@@H]2CCCO2)s1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000128167471 938787972 /nfs/dbraw/zinc/78/79/72/938787972.db2.gz UADQXLLMUMTTIA-HNNXBMFYSA-N 0 0 373.434 3.708 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1C(=O)NCc1ccc(Br)s1 ZINC000070211456 938802008 /nfs/dbraw/zinc/80/20/08/938802008.db2.gz XBBNVSFECQXVEM-UHFFFAOYSA-N 0 0 355.213 3.657 20 5 FHBDRN COc1ccccc1[C@H](NC(=O)c1csc([N+](=O)[O-])c1)c1ccccn1 ZINC000179092561 938805760 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FHBDRN Cn1cnc([N+](=O)[O-])c1NCc1ccc(-c2ccc3c(c2)CCO3)cc1 ZINC000141198865 938943060 /nfs/dbraw/zinc/94/30/60/938943060.db2.gz XYUKYJXERVSJIM-UHFFFAOYSA-N 0 0 350.378 3.542 20 5 FHBDRN Cc1csc(=O)n1CCOc1ccc(-c2ccccc2)cc1[N+](=O)[O-] ZINC000145250021 938952818 /nfs/dbraw/zinc/95/28/18/938952818.db2.gz SINUPZHMRIDRCW-UHFFFAOYSA-N 0 0 356.403 3.872 20 5 FHBDRN CCC[C@H](C)NC(=O)[C@@H]1CCCN(c2ccc3ncccc3c2[N+](=O)[O-])C1 ZINC000050933877 938954922 /nfs/dbraw/zinc/95/49/22/938954922.db2.gz GMPQATPZDBTXAX-LSDHHAIUSA-N 0 0 370.453 3.664 20 5 FHBDRN CCC[C@@H](NC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1)C1CCCCC1 ZINC000409571560 938965469 /nfs/dbraw/zinc/96/54/69/938965469.db2.gz AXLHWLCAXAALQJ-MRXNPFEDSA-N 0 0 371.441 3.654 20 5 FHBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)N1CC[C@@H]1c1ccc(Cl)cc1 ZINC000511261812 938967308 /nfs/dbraw/zinc/96/73/08/938967308.db2.gz QJNYAKDTESUCFF-OAHLLOKOSA-N 0 0 366.826 3.525 20 5 FHBDRN O=[N+]([O-])c1ccc(CN2CCc3c(cnn3-c3ccccc3)C2)c(Cl)c1 ZINC000543855701 938976322 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FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCCCOC1CCCC1 ZINC000128267129 938992125 /nfs/dbraw/zinc/99/21/25/938992125.db2.gz SIYJHYMETNIHKW-CYBMUJFWSA-N 0 0 352.456 3.541 20 5 FHBDRN COc1ccc(CC(=O)Nc2ccc3ccc(Cl)cc3n2)cc1[N+](=O)[O-] ZINC000548839815 938992859 /nfs/dbraw/zinc/99/28/59/938992859.db2.gz WEXJZYAXPGLFIM-UHFFFAOYSA-N 0 0 371.780 3.986 20 5 FHBDRN CC[C@@H]1CN(C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)c2ccccc2O1 ZINC000136097346 938993652 /nfs/dbraw/zinc/99/36/52/938993652.db2.gz HECUZXYPSHBUOW-OAHLLOKOSA-N 0 0 365.389 3.823 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2noc(C[C@H]3CCC[C@H](C(F)(F)F)O3)n2)c1 ZINC000923774431 938994384 /nfs/dbraw/zinc/99/43/84/938994384.db2.gz XLBNUGOGCMQGLD-VXGBXAGGSA-N 0 0 357.288 3.687 20 5 FHBDRN O=C(c1cc(F)ccc1[N+](=O)[O-])N1CCC(OCC2CCCC2)CC1 ZINC000375778520 938995582 /nfs/dbraw/zinc/99/55/82/938995582.db2.gz JKZSGXLWPAQEBC-UHFFFAOYSA-N 0 0 350.390 3.545 20 5 FHBDRN O=[N+]([O-])c1ccccc1CN(Cc1nccn1CC(F)(F)F)C1CC1 ZINC000179240087 938996437 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CC[C@H](NC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21)c1ccc(OC)cc1 ZINC000065719370 939006782 /nfs/dbraw/zinc/00/67/82/939006782.db2.gz DHEWOLNAFWWUPW-SFHVURJKSA-N 0 0 367.405 3.826 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)Nc1ccccc1N1CCCC1 ZINC000065719007 939007342 /nfs/dbraw/zinc/00/73/42/939007342.db2.gz RYIMKCNDGNKLCD-UHFFFAOYSA-N 0 0 364.405 3.788 20 5 FHBDRN Cc1ccccc1CN(C)C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000431622553 939013324 /nfs/dbraw/zinc/01/33/24/939013324.db2.gz PQSVNGODIHTQGO-UHFFFAOYSA-N 0 0 363.211 3.938 20 5 FHBDRN C[C@@H](O)C[C@@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1SC1CCCC1 ZINC000611985004 939013547 /nfs/dbraw/zinc/01/35/47/939013547.db2.gz VYJWGRCWSBKAQO-VXGBXAGGSA-N 0 0 352.456 3.519 20 5 FHBDRN CCCOc1ccc(CNC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)cc1 ZINC000065734364 939017761 /nfs/dbraw/zinc/01/77/61/939017761.db2.gz UTYBLNYPGSJTOW-UHFFFAOYSA-N 0 0 367.405 3.655 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)Nc1cccc(N2CCCC2)c1 ZINC000065735418 939018318 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O=[N+]([O-])c1ccccc1N1CCC(c2nccc(C(F)(F)F)n2)CC1 ZINC000364910507 940021398 /nfs/dbraw/zinc/02/13/98/940021398.db2.gz PPGCELZNWXGATA-UHFFFAOYSA-N 0 0 352.316 3.788 20 5 FHBDRN O=C(NCC1(CO)CCC1)c1cc([N+](=O)[O-])ccc1SC1CCCC1 ZINC000612386252 940039973 /nfs/dbraw/zinc/03/99/73/940039973.db2.gz TZIPPNASPXSDHQ-UHFFFAOYSA-N 0 0 364.467 3.522 20 5 FHBDRN CC(=O)Nc1ccc(C)c(NC(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)c1 ZINC000411412578 940040351 /nfs/dbraw/zinc/04/03/51/940040351.db2.gz FMSJNUCQCHWAEG-UHFFFAOYSA-N 0 0 371.393 3.901 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H](c1ccc(F)cc1)C(F)(F)F ZINC000427335371 945291983 /nfs/dbraw/zinc/29/19/83/945291983.db2.gz NEGJJDNHEPGYEZ-AWEZNQCLSA-N 0 0 372.274 3.776 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)C(=O)N[C@@H](C)CC1CCCCC1 ZINC000411471428 940047233 /nfs/dbraw/zinc/04/72/33/940047233.db2.gz FSUICKZHLROAKH-AWEZNQCLSA-N 0 0 361.442 3.625 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)NC1(Cc2cccc(F)c2)CCC1 ZINC000427336609 945292587 /nfs/dbraw/zinc/29/25/87/945292587.db2.gz RSVORTMQGHHWDD-UHFFFAOYSA-N 0 0 358.369 3.638 20 5 FHBDRN COc1ccc(CNC(=O)C[C@@H](c2ccc(O)cc2)C2CC2)cc1[N+](=O)[O-] ZINC000411550549 940061238 /nfs/dbraw/zinc/06/12/38/940061238.db2.gz KDPOFXGFXBTLTO-QGZVFWFLSA-N 0 0 370.405 3.509 20 5 FHBDRN Cc1sc(C(=O)N[C@@H]2CCCOc3c(F)cccc32)cc1[N+](=O)[O-] ZINC000179878433 940061574 /nfs/dbraw/zinc/06/15/74/940061574.db2.gz CLKKHCVNYVDMFH-GFCCVEGCSA-N 0 0 350.371 3.748 20 5 FHBDRN Cc1c(Br)c(=O)n(CCCc2cccc(F)c2)cc1[N+](=O)[O-] ZINC000544080831 940063720 /nfs/dbraw/zinc/06/37/20/940063720.db2.gz WMUSCNFYGNPROX-UHFFFAOYSA-N 0 0 369.190 3.599 20 5 FHBDRN CC(=O)c1ccc(NCc2cn(-c3ccccc3)nc2C)c([N+](=O)[O-])c1 ZINC000511349369 940063838 /nfs/dbraw/zinc/06/38/38/940063838.db2.gz DBEPREHTHSHKGW-UHFFFAOYSA-N 0 0 350.378 3.904 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)C(=O)Nc1ccc2c(c1)CCCC2 ZINC000411574088 940065133 /nfs/dbraw/zinc/06/51/33/940065133.db2.gz UXMCLWQZAOTVFY-UHFFFAOYSA-N 0 0 367.405 3.668 20 5 FHBDRN CS(=O)(=O)c1ccc(CNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1 ZINC000052100632 940067672 /nfs/dbraw/zinc/06/76/72/940067672.db2.gz VPVYVOJCWJNSTC-UHFFFAOYSA-N 0 0 374.340 3.629 20 5 FHBDRN CC(C)(C)Oc1ccc(CNc2ncnc3cccc([N+](=O)[O-])c32)cc1 ZINC000612440038 940070061 /nfs/dbraw/zinc/07/00/61/940070061.db2.gz KBVGHPYKHFOYGV-UHFFFAOYSA-N 0 0 352.394 3.749 20 5 FHBDRN O=C(N[C@H]1CCCOc2ccc(F)cc21)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000411588575 940071083 /nfs/dbraw/zinc/07/10/83/940071083.db2.gz GHKLAKCMPLOIFT-JZXOWHBKSA-N 0 0 370.380 3.868 20 5 FHBDRN Cc1cnn(C2CCN(C(=O)Nc3ccc(Cl)c([N+](=O)[O-])c3)CC2)c1 ZINC000365209232 940082202 /nfs/dbraw/zinc/08/22/02/940082202.db2.gz SXFLUIOGYOSRFQ-UHFFFAOYSA-N 0 0 363.805 3.622 20 5 FHBDRN O=[N+]([O-])c1cnc2c(c1)CN(Cc1cc(Cl)ccc1OC(F)F)CC2 ZINC000612468181 940083418 /nfs/dbraw/zinc/08/34/18/940083418.db2.gz GNUCOFXWFCUVSZ-UHFFFAOYSA-N 0 0 369.755 3.803 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N[C@@H]1CCCOc2c(F)cccc21 ZINC000179888111 940083897 /nfs/dbraw/zinc/08/38/97/940083897.db2.gz BHDFUZXNJVBOCB-QGZVFWFLSA-N 0 0 358.369 3.697 20 5 FHBDRN O=[N+]([O-])c1ccccc1NC[C@@H](c1ccc(Cl)cc1)N1CCOCC1 ZINC000065945895 940086232 /nfs/dbraw/zinc/08/62/32/940086232.db2.gz QATIRHGPWCFZFY-SFHVURJKSA-N 0 0 361.829 3.734 20 5 FHBDRN O=C(Cc1c[nH]c2ccc(Cl)cc12)NCCc1ccc([N+](=O)[O-])cc1 ZINC000062514700 940093270 /nfs/dbraw/zinc/09/32/70/940093270.db2.gz SOALAKOACFXLRJ-UHFFFAOYSA-N 0 0 357.797 3.631 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)CSCC(=O)c1ccccc1 ZINC000545250637 940101630 /nfs/dbraw/zinc/10/16/30/940101630.db2.gz NFOUDZGGRKHVEJ-UHFFFAOYSA-N 0 0 374.418 3.548 20 5 FHBDRN CCn1c(CCNc2ccc(C(C)=O)cc2[N+](=O)[O-])nc2ccccc21 ZINC000065947387 940106710 /nfs/dbraw/zinc/10/67/10/940106710.db2.gz VILMNIJFTPHAKR-UHFFFAOYSA-N 0 0 352.394 3.822 20 5 FHBDRN COc1cccc(F)c1[C@H](C)NC(=O)c1cccc(Cl)c1[N+](=O)[O-] ZINC000177316154 940108434 /nfs/dbraw/zinc/10/84/34/940108434.db2.gz YKGKTHDGUBFMKA-VIFPVBQESA-N 0 0 352.749 3.887 20 5 FHBDRN O=C(Cc1cccc(OCC(F)(F)F)c1)Nc1ccc(F)c([N+](=O)[O-])c1 ZINC000152794345 940109235 /nfs/dbraw/zinc/10/92/35/940109235.db2.gz NTCBRLLDLLHNQY-UHFFFAOYSA-N 0 0 372.274 3.856 20 5 FHBDRN Cc1ccc(-c2noc(CN(C)CCc3cccc([N+](=O)[O-])c3)n2)cc1 ZINC000548936378 940110046 /nfs/dbraw/zinc/11/00/46/940110046.db2.gz QPLLUDHVZKAMPT-UHFFFAOYSA-N 0 0 352.394 3.628 20 5 FHBDRN C[C@@H](NCc1nc2cc([N+](=O)[O-])ccc2o1)c1noc(-c2ccccc2)n1 ZINC000612523631 940121969 /nfs/dbraw/zinc/12/19/69/940121969.db2.gz HGXAZIDKCZWCRV-LLVKDONJSA-N 0 0 365.349 3.637 20 5 FHBDRN CCn1c(COC(=O)c2c(C)cccc2[N+](=O)[O-])nc2c1cccc2F ZINC000728617788 940123305 /nfs/dbraw/zinc/12/33/05/940123305.db2.gz PBRLXRZEAPCVRH-UHFFFAOYSA-N 0 0 357.341 3.769 20 5 FHBDRN COc1ccc([C@@H]2CCN(C(=O)[C@@H]3C[C@H]3c3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000411818486 940126662 /nfs/dbraw/zinc/12/66/62/940126662.db2.gz KQQNZBCPMUMEFB-LSTHTHJFSA-N 0 0 366.417 3.723 20 5 FHBDRN CO[C@@H](C)c1nc(COC(=O)c2ccc(Cl)cc2[N+](=O)[O-])cs1 ZINC000782620887 940135003 /nfs/dbraw/zinc/13/50/03/940135003.db2.gz QGZMKLZEXHWDGO-QMMMGPOBSA-N 0 0 356.787 3.769 20 5 FHBDRN Cc1ccn(C2CCN(C(=O)c3ccc(C(C)C)c([N+](=O)[O-])c3)CC2)n1 ZINC000365371353 940140018 /nfs/dbraw/zinc/14/00/18/940140018.db2.gz HNKQPPYPRRACGC-UHFFFAOYSA-N 0 0 356.426 3.700 20 5 FHBDRN COc1c(C)cc(CN(C)C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)cc1C ZINC000411854059 940141188 /nfs/dbraw/zinc/14/11/88/940141188.db2.gz SNQXFEFNXBYNNU-RBUKOAKNSA-N 0 0 368.433 3.982 20 5 FHBDRN C[C@@H](C(=O)N1CCC[C@@H]1c1ccc(O)cc1)c1ccc([N+](=O)[O-])cc1F ZINC000612553747 940142053 /nfs/dbraw/zinc/14/20/53/940142053.db2.gz YUNROIGOVNTBIU-KZULUSFZSA-N 0 0 358.369 3.907 20 5 FHBDRN Cn1c(C(=O)Nc2ccccc2-c2nc3ccccc3[nH]2)ccc1[N+](=O)[O-] ZINC000612566535 940148825 /nfs/dbraw/zinc/14/88/25/940148825.db2.gz XYWLZFXOOVTDHP-UHFFFAOYSA-N 0 0 361.361 3.729 20 5 FHBDRN CC(C)(C)[C@@H]1CCC[C@@H]1NC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000411885287 940154068 /nfs/dbraw/zinc/15/40/68/940154068.db2.gz COESZIDAHLSUPE-YPMHNXCESA-N 0 0 367.833 3.518 20 5 FHBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])c1csc(C2CC2)n1 ZINC000540893398 940157079 /nfs/dbraw/zinc/15/70/79/940157079.db2.gz YONYGOKZYZBYMT-UHFFFAOYSA-N 0 0 351.815 3.555 20 5 FHBDRN CC[C@H](c1cccc(OC)c1)N(C)C(=O)COc1ccccc1[N+](=O)[O-] ZINC000584489548 940157160 /nfs/dbraw/zinc/15/71/60/940157160.db2.gz KGWZJOPMOAFOLQ-MRXNPFEDSA-N 0 0 358.394 3.592 20 5 FHBDRN Cc1scc(C(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)c1C ZINC000179950707 940160825 /nfs/dbraw/zinc/16/08/25/940160825.db2.gz MOCFYCFAGVZXRD-UHFFFAOYSA-N 0 0 360.435 3.957 20 5 FHBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1CN1C[C@@H](O)C[C@@H]1c1ccccc1 ZINC000411947170 940161330 /nfs/dbraw/zinc/16/13/30/940161330.db2.gz OUZNTNHMCKIUKG-RBUKOAKNSA-N 0 0 356.422 3.690 20 5 FHBDRN C[C@@H]1CO[C@H](c2ccccc2)CN1C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000411929823 940162687 /nfs/dbraw/zinc/16/26/87/940162687.db2.gz AIJVQHAQEGKOTR-YGBSJELFSA-N 0 0 366.417 3.687 20 5 FHBDRN Cn1ccnc1[C@@H]1CCCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1 ZINC000365461142 940167601 /nfs/dbraw/zinc/16/76/01/940167601.db2.gz LNQVJZHHAIHYPJ-GFCCVEGCSA-N 0 0 370.434 3.563 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N(Cc1ccccc1)[C@H](CO)C1CC1 ZINC000179957077 940169381 /nfs/dbraw/zinc/16/93/81/940169381.db2.gz NNUOZKVGUVYKMK-LJQANCHMSA-N 0 0 369.421 3.708 20 5 FHBDRN CC(C)Oc1cc(C(=O)Nc2ncccc2OC(F)F)ccc1[N+](=O)[O-] ZINC000411978436 940170264 /nfs/dbraw/zinc/17/02/64/940170264.db2.gz LEIGRXISPUYUOM-UHFFFAOYSA-N 0 0 367.308 3.631 20 5 FHBDRN C[C@@H](COc1ccccc1)C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000540893843 940177225 /nfs/dbraw/zinc/17/72/25/940177225.db2.gz IWUFEJZHMRHQSM-ZDUSSCGKSA-N 0 0 362.813 3.622 20 5 FHBDRN COc1cc(CN(C)Cc2ccoc2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000179978633 940182994 /nfs/dbraw/zinc/18/29/94/940182994.db2.gz DFFZFERFYITAGN-UHFFFAOYSA-N 0 0 370.352 3.781 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1F)N[C@@H]1COc2c1cccc2Cl ZINC000612616075 940187008 /nfs/dbraw/zinc/18/70/08/940187008.db2.gz SOGLVDOTZWFVMH-CYBMUJFWSA-N 0 0 351.721 3.643 20 5 FHBDRN COc1cc(OCC(=O)Oc2cccc3ccccc32)ccc1[N+](=O)[O-] ZINC000066013259 940193998 /nfs/dbraw/zinc/19/39/98/940193998.db2.gz SRNKFOVDPZHFMU-UHFFFAOYSA-N 0 0 353.330 3.741 20 5 FHBDRN COc1cc(OCC(=O)N[C@@H]2C[C@@H](C)CC[C@@H]2C(C)C)ccc1[N+](=O)[O-] ZINC000066022118 940203875 /nfs/dbraw/zinc/20/38/75/940203875.db2.gz FXEJBKIOXSZTKJ-NUEKZKHPSA-N 0 0 364.442 3.559 20 5 FHBDRN CC[C@H](C)C(=O)COc1c2cc(Br)ccc2ncc1[N+](=O)[O-] ZINC000612661279 940208082 /nfs/dbraw/zinc/20/80/82/940208082.db2.gz WVYFKXUPIBBUMA-VIFPVBQESA-N 0 0 367.199 3.900 20 5 FHBDRN COc1cc(OCC(=O)Nc2cccc(COC(C)C)c2)ccc1[N+](=O)[O-] ZINC000066028315 940212765 /nfs/dbraw/zinc/21/27/65/940212765.db2.gz IILSADMEJBZZSB-UHFFFAOYSA-N 0 0 374.393 3.546 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NC[C@H]2CCCc3ccccc32)c1 ZINC000548959457 940271803 /nfs/dbraw/zinc/27/18/03/940271803.db2.gz RBZULGPQDYTYEG-OAHLLOKOSA-N 0 0 354.406 3.843 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)N1C[C@H](c2ccccc2)[C@@H]2CCC[C@H]21 ZINC000376075737 940276628 /nfs/dbraw/zinc/27/66/28/940276628.db2.gz YNOWUWOJYZMPFI-QXAKKESOSA-N 0 0 351.406 3.707 20 5 FHBDRN Cc1cc(NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)cnc1Cl ZINC000177559186 940276989 /nfs/dbraw/zinc/27/69/89/940276989.db2.gz FBVSPRWHLBNXCN-UHFFFAOYSA-N 0 0 360.801 3.804 20 5 FHBDRN C[C@@H](OCCCNC(=O)Cc1ccc([N+](=O)[O-])cc1F)c1ccccc1 ZINC000124651262 945310108 /nfs/dbraw/zinc/31/01/08/945310108.db2.gz MLIJXHYRRSHJMO-CQSZACIVSA-N 0 0 360.385 3.561 20 5 FHBDRN C[N@H+](CCCNc1ccc(/C=C/C(=O)[O-])cc1[N+](=O)[O-])Cc1ccccc1 ZINC000013212655 940305310 /nfs/dbraw/zinc/30/53/10/940305310.db2.gz RWPGLOCGXGYKFA-PKNBQFBNSA-N 0 0 369.421 3.627 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H](c1cccc(C)c1)C(F)(F)F ZINC000427378247 945310842 /nfs/dbraw/zinc/31/08/42/945310842.db2.gz VVKPMLIZNDWUTE-OAHLLOKOSA-N 0 0 368.311 3.945 20 5 FHBDRN COC(=O)c1cc(NC(=O)[C@@H]2CCCc3sccc32)cc([N+](=O)[O-])c1 ZINC000124597542 945311634 /nfs/dbraw/zinc/31/16/34/945311634.db2.gz XBAFUUOAABHNJI-CQSZACIVSA-N 0 0 360.391 3.502 20 5 FHBDRN COC(=O)c1ccc(-c2nc(-c3ccc(C)c([N+](=O)[O-])c3)no2)cc1F ZINC000612895220 940327627 /nfs/dbraw/zinc/32/76/27/940327627.db2.gz NKWAKLISAQRDDO-UHFFFAOYSA-N 0 0 357.297 3.546 20 5 FHBDRN O=C(OCc1ccccc1OC[C@H]1CCCO1)c1cccc([N+](=O)[O-])c1 ZINC000177649154 940333660 /nfs/dbraw/zinc/33/36/60/940333660.db2.gz HKWQMEUQDDDWBD-QGZVFWFLSA-N 0 0 357.362 3.510 20 5 FHBDRN COc1cccc([C@H](C)c2noc(COc3ccccc3[N+](=O)[O-])n2)c1 ZINC000612918188 940336098 /nfs/dbraw/zinc/33/60/98/940336098.db2.gz WBOAPPGNRSULCF-LBPRGKRZSA-N 0 0 355.350 3.717 20 5 FHBDRN C[C@@H](NC(=O)c1cccc(Cl)c1[N+](=O)[O-])c1ccc(-n2cccn2)cc1 ZINC000177671664 940343934 /nfs/dbraw/zinc/34/39/34/940343934.db2.gz WGCBPAUUVPCCIC-GFCCVEGCSA-N 0 0 370.796 3.925 20 5 FHBDRN Cc1cc(F)ccc1-c1noc([C@@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)n1 ZINC000612931885 940348166 /nfs/dbraw/zinc/34/81/66/940348166.db2.gz MRYZKIFIJZQPHH-LLVKDONJSA-N 0 0 370.340 3.583 20 5 FHBDRN CC(C)(C)CCCCNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-] ZINC000511398924 940349525 /nfs/dbraw/zinc/34/95/25/940349525.db2.gz NNDYWMPAIUHPMX-UHFFFAOYSA-N 0 0 363.458 3.696 20 5 FHBDRN O=[N+]([O-])c1cc(-c2nc([C@H]3CCc4ccccc4C3)no2)cc2c1OCO2 ZINC000612951736 940356119 /nfs/dbraw/zinc/35/61/19/940356119.db2.gz MKJNNGIVQJKGRQ-ZDUSSCGKSA-N 0 0 365.345 3.646 20 5 FHBDRN Cc1c(Cc2noc(C[C@@H]3CCO[C@H](C(C)C)C3)n2)cccc1[N+](=O)[O-] ZINC000612967337 940366270 /nfs/dbraw/zinc/36/62/70/940366270.db2.gz LKBIOBLUAOIDKA-PBHICJAKSA-N 0 0 359.426 3.871 20 5 FHBDRN C[C@H](CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)NC(=O)C1CCCCC1 ZINC000066274238 940377629 /nfs/dbraw/zinc/37/76/29/940377629.db2.gz LHTLSCNCJMRNEL-LLVKDONJSA-N 0 0 367.833 3.662 20 5 FHBDRN Cc1c([N+](=O)[O-])cc(C(=O)Nc2ccc(F)cc2Cl)cc1[N+](=O)[O-] ZINC000066279707 940391062 /nfs/dbraw/zinc/39/10/62/940391062.db2.gz ROZUGMYSJVBGLS-UHFFFAOYSA-N 0 0 353.693 3.856 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)N(C)[C@H]2CCC[C@@H]2c2ccc(C)cc2)n1 ZINC000427360311 945314837 /nfs/dbraw/zinc/31/48/37/945314837.db2.gz YTUNIVZJPFGFKG-CVEARBPZSA-N 0 0 356.426 3.528 20 5 FHBDRN CCOc1cc(OCC(=O)Nc2ccc(C)cc2Cl)ccc1[N+](=O)[O-] ZINC000188612286 940404306 /nfs/dbraw/zinc/40/43/06/940404306.db2.gz PNFSPVKTFUDOPE-UHFFFAOYSA-N 0 0 364.785 3.973 20 5 FHBDRN CC(C)(C(=O)N1CC(Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000613029859 940405105 /nfs/dbraw/zinc/40/51/05/940405105.db2.gz PDJUPZCUZVAGMS-UHFFFAOYSA-N 0 0 356.397 3.713 20 5 FHBDRN Cc1cnc([C@H]2CCCN(c3ncnc4sc([N+](=O)[O-])cc43)C2)s1 ZINC000376172184 940412866 /nfs/dbraw/zinc/41/28/66/940412866.db2.gz MCRCSKQFUAIFAB-JTQLQIEISA-N 0 0 361.452 3.748 20 5 FHBDRN CCSc1ccccc1C(=O)N1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000580022334 940436455 /nfs/dbraw/zinc/43/64/55/940436455.db2.gz MVNOJBWOZLJKLP-UHFFFAOYSA-N 0 0 358.419 3.742 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H]1CCCO[C@H]1c1ccc(C)cc1 ZINC000427369910 945321039 /nfs/dbraw/zinc/32/10/39/945321039.db2.gz LTPKYJTVJPGSSM-HKUYNNGSSA-N 0 0 370.405 3.562 20 5 FHBDRN COC(=O)c1ccc(OCc2cc(-c3ccc(C)cc3)no2)cc1[N+](=O)[O-] ZINC000613109288 940451866 /nfs/dbraw/zinc/45/18/66/940451866.db2.gz ABPKUWJUDVRRAD-UHFFFAOYSA-N 0 0 368.345 3.924 20 5 FHBDRN Cc1c(C(=O)N2C[C@H](c3ccccc3)[C@@H]3COCC[C@H]32)cccc1[N+](=O)[O-] ZINC000376206164 940467190 /nfs/dbraw/zinc/46/71/90/940467190.db2.gz GTTVWCUGHPTEST-WSTZPKSXSA-N 0 0 366.417 3.548 20 5 FHBDRN C[C@H](NC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1)c1nccn1-c1ccccc1 ZINC000580247354 940470458 /nfs/dbraw/zinc/47/04/58/940470458.db2.gz IFSJSLKJWKATRA-GJZGRUSLSA-N 0 0 364.405 3.761 20 5 FHBDRN O=C(/C=C/c1cccc([N+](=O)[O-])c1)Nc1nc(C2CCOCC2)cs1 ZINC000376209629 940471021 /nfs/dbraw/zinc/47/10/21/940471021.db2.gz WYAOASNDYZRSDI-SNAWJCMRSA-N 0 0 359.407 3.597 20 5 FHBDRN C[C@@H]1[C@H](CO)CCCN1C(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 ZINC000414067369 940475103 /nfs/dbraw/zinc/47/51/03/940475103.db2.gz KYFUSKSJNMFSMH-CABCVRRESA-N 0 0 370.405 3.620 20 5 FHBDRN COc1ccc(C2=N/C(=C/c3coc4ccccc34)C(=O)O2)cc1[N+](=O)[O-] ZINC000255885530 940475281 /nfs/dbraw/zinc/47/52/81/940475281.db2.gz YFKPYSCBOVZYGV-RIYZIHGNSA-N 0 0 364.313 3.694 20 5 FHBDRN Cc1ccccc1OCCCNC(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000511441942 940475447 /nfs/dbraw/zinc/47/54/47/940475447.db2.gz WHIHEGJXRSDJCQ-UHFFFAOYSA-N 0 0 371.437 3.556 20 5 FHBDRN Cc1c(Br)cccc1-c1noc(-c2cc([N+](=O)[O-])cn2C)n1 ZINC000580390303 940475670 /nfs/dbraw/zinc/47/56/70/940475670.db2.gz WALGETVMJPZIBJ-UHFFFAOYSA-N 0 0 363.171 3.721 20 5 FHBDRN Cc1c(CC(=O)N[C@H](C)c2cccc(OC(F)F)c2)cccc1[N+](=O)[O-] ZINC000161715773 940475853 /nfs/dbraw/zinc/47/58/53/940475853.db2.gz DHPTUCNIACEFRY-GFCCVEGCSA-N 0 0 364.348 3.925 20 5 FHBDRN CC[C@]1(CNC(=O)Nc2cccc([N+](=O)[O-])c2C)OCCc2ccccc21 ZINC000580499801 940477278 /nfs/dbraw/zinc/47/72/78/940477278.db2.gz MIPXFRHVTVYNGY-HXUWFJFHSA-N 0 0 369.421 3.903 20 5 FHBDRN Nc1ccc(NCc2ccc(-n3cnc4ccccc43)nc2)c([N+](=O)[O-])c1 ZINC000376214058 940477733 /nfs/dbraw/zinc/47/77/33/940477733.db2.gz UOCILDZKUUHDKN-UHFFFAOYSA-N 0 0 360.377 3.523 20 5 FHBDRN CC(C)n1cc(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)cn1 ZINC000066388530 940478102 /nfs/dbraw/zinc/47/81/02/940478102.db2.gz GNMCADVUOFMRBJ-UHFFFAOYSA-N 0 0 360.417 3.571 20 5 FHBDRN O=C(Nc1cc(-c2ccccc2)nc2ccccc21)c1ccc([N+](=O)[O-])cn1 ZINC000613175866 940478526 /nfs/dbraw/zinc/47/85/26/940478526.db2.gz OXNKKKSFBXCBGA-UHFFFAOYSA-N 0 0 370.368 3.879 20 5 FHBDRN C[C@@H]1CCN(c2sc(S(C)(=O)=O)cc2[N+](=O)[O-])CC12CCCCC2 ZINC000613188129 940478579 /nfs/dbraw/zinc/47/85/79/940478579.db2.gz KLGSDDFGJVAJNC-GFCCVEGCSA-N 0 0 372.512 3.857 20 5 FHBDRN CN(CCOC(C)(C)C)c1ccc([N+](=O)[O-])c(OCc2ccccc2)n1 ZINC000613182176 940478704 /nfs/dbraw/zinc/47/87/04/940478704.db2.gz NQECDTAKBAFLSJ-UHFFFAOYSA-N 0 0 359.426 3.820 20 5 FHBDRN CC(C)(C)OC(=O)c1cnc(NCCCCc2ccc([N+](=O)[O-])cc2)cn1 ZINC000580593504 940480077 /nfs/dbraw/zinc/48/00/77/940480077.db2.gz AKDMOZHWUQYDJH-UHFFFAOYSA-N 0 0 372.425 3.775 20 5 FHBDRN O=C(Nc1ccc(Cl)cn1)[C@@H]1CCCN(c2ccc([N+](=O)[O-])s2)C1 ZINC000066410811 940482405 /nfs/dbraw/zinc/48/24/05/940482405.db2.gz IRBCQTMGATVWHN-SNVBAGLBSA-N 0 0 366.830 3.560 20 5 FHBDRN C[C@@H](C(=O)NC1(Cc2ccccc2)CCOCC1)c1cccc([N+](=O)[O-])c1 ZINC000580698631 940484016 /nfs/dbraw/zinc/48/40/16/940484016.db2.gz IYCCZQKRIVSZMU-MRXNPFEDSA-N 0 0 368.433 3.606 20 5 FHBDRN C[C@H](C(=O)NC1(Cc2ccccc2)CCOCC1)c1cccc([N+](=O)[O-])c1 ZINC000580698630 940484065 /nfs/dbraw/zinc/48/40/65/940484065.db2.gz IYCCZQKRIVSZMU-INIZCTEOSA-N 0 0 368.433 3.606 20 5 FHBDRN Cc1cc(NC(=O)Cc2cc3ccccc3o2)c2cc([N+](=O)[O-])ccc2n1 ZINC000613198176 940484194 /nfs/dbraw/zinc/48/41/94/940484194.db2.gz YCBODDUHMANJFR-UHFFFAOYSA-N 0 0 361.357 3.801 20 5 FHBDRN CC(C)N(Cc1csc(-c2ncccn2)n1)Cc1ccc([N+](=O)[O-])cc1 ZINC000066434552 940486207 /nfs/dbraw/zinc/48/62/07/940486207.db2.gz HXSWZEZRECOBER-UHFFFAOYSA-N 0 0 369.450 3.919 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C1(CCOCc2ccccc2)CC1 ZINC000472524682 940487429 /nfs/dbraw/zinc/48/74/29/940487429.db2.gz WTKWCVHGTBSGIW-UHFFFAOYSA-N 0 0 370.405 3.929 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CCOc3ccc(Cl)cc32)c1 ZINC000549008612 940490217 /nfs/dbraw/zinc/49/02/17/940490217.db2.gz AGRHEIJZFHNDLR-UHFFFAOYSA-N 0 0 362.769 3.686 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CC(Cc2ccccc2)C1 ZINC000613241328 940490913 /nfs/dbraw/zinc/49/09/13/940490913.db2.gz NRGORCCTFNLZTI-LJQANCHMSA-N 0 0 352.434 3.865 20 5 FHBDRN CCc1ccc([C@H]2CN(C(=O)[C@@H](C)c3cccc([N+](=O)[O-])c3)CCO2)cc1 ZINC000580986436 940491571 /nfs/dbraw/zinc/49/15/71/940491571.db2.gz PHRXKUCHAHOXCR-MGPUTAFESA-N 0 0 368.433 3.861 20 5 FHBDRN COc1cccc([C@H](C)NC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000431773691 940492015 /nfs/dbraw/zinc/49/20/15/940492015.db2.gz PWBGSTOYHXKBLY-ZDUSSCGKSA-N 0 0 357.410 3.899 20 5 FHBDRN Cc1ccc2cccc(NC(=O)c3ccn(-c4cccc([N+](=O)[O-])c4)n3)c2n1 ZINC000066462232 940494935 /nfs/dbraw/zinc/49/49/35/940494935.db2.gz WDCLUGRMWJYUKC-UHFFFAOYSA-N 0 0 373.372 3.889 20 5 FHBDRN Cc1cc(C(=O)NC(C)C)ccc1NC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000581175187 940495024 /nfs/dbraw/zinc/49/50/24/940495024.db2.gz MXOCIZMXSNWQBA-AWEZNQCLSA-N 0 0 369.421 3.784 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N(C)C[C@@H](C)c2ccccc2)cc1OC ZINC000066459429 940495054 /nfs/dbraw/zinc/49/50/54/940495054.db2.gz UDTNEOXJGOOCRB-CQSZACIVSA-N 0 0 372.421 3.878 20 5 FHBDRN Cc1cc(OCc2nc(-c3ccccc3N(C)C)no2)ccc1[N+](=O)[O-] ZINC000581215464 940496789 /nfs/dbraw/zinc/49/67/89/940496789.db2.gz BFENCQGUIYCLBN-UHFFFAOYSA-N 0 0 354.366 3.598 20 5 FHBDRN Cc1cc(NCC(C)(C)C(F)(F)F)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000549011204 940497814 /nfs/dbraw/zinc/49/78/14/940497814.db2.gz USRZMASJSOEJCL-UHFFFAOYSA-N 0 0 354.332 3.783 20 5 FHBDRN CCCC(C)(C)N(Cc1cccs1)C(=O)Cn1cc([N+](=O)[O-])nc1C ZINC000549014887 940501785 /nfs/dbraw/zinc/50/17/85/940501785.db2.gz GZGZXEKVJZIIKO-UHFFFAOYSA-N 0 0 364.471 3.769 20 5 FHBDRN C[C@H](Cc1cccc(F)c1)C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000540894828 940504135 /nfs/dbraw/zinc/50/41/35/940504135.db2.gz OMGCUSOOAFRSQZ-GFCCVEGCSA-N 0 0 364.804 3.925 20 5 FHBDRN Cc1ccc(CCNC(=O)c2cc([N+](=O)[O-])cc(Br)c2C)o1 ZINC000581537129 940505976 /nfs/dbraw/zinc/50/59/76/940505976.db2.gz IXNPEQNUHHGYPI-UHFFFAOYSA-N 0 0 367.199 3.540 20 5 FHBDRN C[C@H]1Cc2ccccc2[C@H]1NC(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000511475279 940506177 /nfs/dbraw/zinc/50/61/77/940506177.db2.gz KQOUZRGZXXRPEN-LIRRHRJNSA-N 0 0 353.422 3.712 20 5 FHBDRN CC(C)(NC(=O)NCCc1cc(F)cc(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000431792813 940506225 /nfs/dbraw/zinc/50/62/25/940506225.db2.gz FJIDQTZVFOICKG-UHFFFAOYSA-N 0 0 363.364 3.650 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)Nc2ccc3c(Cl)ccc(C)c3n2)n1 ZINC000427400703 945327230 /nfs/dbraw/zinc/32/72/30/945327230.db2.gz WFYOLTHHIXRHIM-UHFFFAOYSA-N 0 0 359.773 3.574 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCc1ccc(F)cc1F ZINC000581641186 940509218 /nfs/dbraw/zinc/50/92/18/940509218.db2.gz SEPNOUHYNOEDOT-AWEZNQCLSA-N 0 0 362.376 3.801 20 5 FHBDRN CN(C(=O)c1csc([N+](=O)[O-])c1)[C@@H]1C[C@@H](Oc2ccccc2)C1(C)C ZINC000581687113 940588574 /nfs/dbraw/zinc/58/85/74/940588574.db2.gz RJERTEGRHGRRDO-HUUCEWRRSA-N 0 0 360.435 3.974 20 5 FHBDRN CCNc1ccc(C(=O)N[C@@H](CC)c2nc3ccccc3[nH]2)cc1[N+](=O)[O-] ZINC000066523817 940608004 /nfs/dbraw/zinc/60/80/04/940608004.db2.gz XAYGJGITMCKYMW-ZDUSSCGKSA-N 0 0 367.409 3.784 20 5 FHBDRN O=[N+]([O-])c1ccc(N[C@@H]2CCN(Cc3csc(C4CCCC4)n3)C2)nc1 ZINC000173466678 940619930 /nfs/dbraw/zinc/61/99/30/940619930.db2.gz ODPLFCVIOPELMF-CQSZACIVSA-N 0 0 373.482 3.790 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N1C[C@H](c2cnn(C)c2)C(C)(C)C1 ZINC000581953383 940634254 /nfs/dbraw/zinc/63/42/54/940634254.db2.gz NLZZKOGQZZCKFH-MRXNPFEDSA-N 0 0 370.453 3.519 20 5 FHBDRN CSCc1ccc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2C)cc1 ZINC000066551615 940641696 /nfs/dbraw/zinc/64/16/96/940641696.db2.gz KSTHOBOIOUHENZ-UHFFFAOYSA-N 0 0 361.379 3.927 20 5 FHBDRN COc1ccc2c(c1)C1(CC1)CN(Cc1ccc([N+](=O)[O-])cc1OC)C2 ZINC000582031969 940643478 /nfs/dbraw/zinc/64/34/78/940643478.db2.gz KJJHYJXRTHWKPG-UHFFFAOYSA-N 0 0 354.406 3.659 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2noc([C@H]3CCN(c4ccccc4F)C3)n2)s1 ZINC000582163925 940647659 /nfs/dbraw/zinc/64/76/59/940647659.db2.gz NEVSXRWXUYTMSP-JTQLQIEISA-N 0 0 360.370 3.839 20 5 FHBDRN O=C(Nc1cc2c(cc1[N+](=O)[O-])OCCCO2)[C@@H]1C[C@H]1c1ccc(F)cc1 ZINC000124887754 945337688 /nfs/dbraw/zinc/33/76/88/945337688.db2.gz RUPSEIIFBOCKSM-UONOGXRCSA-N 0 0 372.352 3.637 20 5 FHBDRN CN(Cc1ccc2c(c1)OCCO2)c1c2ccccc2ncc1[N+](=O)[O-] ZINC000582216818 940654890 /nfs/dbraw/zinc/65/48/90/940654890.db2.gz BGDDZJGYIBMKMJ-UHFFFAOYSA-N 0 0 351.362 3.551 20 5 FHBDRN CC(C)(C(=O)N1CCC=C(c2ccccn2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000582365457 940661859 /nfs/dbraw/zinc/66/18/59/940661859.db2.gz VWYMXBIIPRRHFW-UHFFFAOYSA-N 0 0 351.406 3.583 20 5 FHBDRN CCOc1ccc(S(=O)(=O)Nc2cc([N+](=O)[O-])ccc2CC)cc1C ZINC000582273876 940663516 /nfs/dbraw/zinc/66/35/16/940663516.db2.gz OIRXJVIWTKWNST-UHFFFAOYSA-N 0 0 364.423 3.665 20 5 FHBDRN CCN(C[C@@H](O)c1ccc(C)cc1)C(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000178097205 940664830 /nfs/dbraw/zinc/66/48/30/940664830.db2.gz HLQXOLOPIRUGOP-GOSISDBHSA-N 0 0 374.462 3.577 20 5 FHBDRN Cc1nc(NC(=O)c2cc([N+](=O)[O-])cc(Br)c2C)sc1C ZINC000582314568 940665308 /nfs/dbraw/zinc/66/53/08/940665308.db2.gz FBTKJZXOXZVIPO-UHFFFAOYSA-N 0 0 370.228 3.991 20 5 FHBDRN Cc1cccc(Cn2nccc2NC(=O)[C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000582463648 940667298 /nfs/dbraw/zinc/66/72/98/940667298.db2.gz WQVAGGYATQRIJJ-OAHLLOKOSA-N 0 0 364.405 3.890 20 5 FHBDRN Cc1ccc(-c2nnc(N(Cc3ccc([N+](=O)[O-])cc3)C(C)C)n2C)o1 ZINC000582388681 940669062 /nfs/dbraw/zinc/66/90/62/940669062.db2.gz XTDLNQGVYJQICQ-UHFFFAOYSA-N 0 0 355.398 3.707 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)Nc2cccc3c2OCCC3=O)c1 ZINC000376283462 940695287 /nfs/dbraw/zinc/69/52/87/940695287.db2.gz VDZSMDWIFDTUBS-UHFFFAOYSA-N 0 0 358.375 3.534 20 5 FHBDRN CC[C@@](C)(NC(=O)Nc1cc([N+](=O)[O-])ccc1OC)c1nc(C)cs1 ZINC000174124553 940703833 /nfs/dbraw/zinc/70/38/33/940703833.db2.gz GNSOCQDUXZASHA-MRXNPFEDSA-N 0 0 364.427 3.815 20 5 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CCS[C@@H]1CCC[C@H](NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)C1 ZINC000540998539 941081668 /nfs/dbraw/zinc/08/16/68/941081668.db2.gz XHYLNRNRVLUGLL-NWDGAFQWSA-N 0 0 374.409 3.990 20 5 FHBDRN COC(=O)c1cc(NC(=O)c2cc(C)c(C)cc2Cl)cc([N+](=O)[O-])c1 ZINC000180873294 941085245 /nfs/dbraw/zinc/08/52/45/941085245.db2.gz JKPAIZIAGHBPPD-UHFFFAOYSA-N 0 0 362.769 3.904 20 5 FHBDRN Cc1ccc(C)c([C@@H](C)N(C)C(=O)C(=O)Nc2cc(F)cc([N+](=O)[O-])c2)c1 ZINC000472609266 941092419 /nfs/dbraw/zinc/09/24/19/941092419.db2.gz QBVWABDLWFQQGZ-CYBMUJFWSA-N 0 0 373.384 3.509 20 5 FHBDRN C[C@@H](CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1)CC(F)F ZINC000843633495 941096346 /nfs/dbraw/zinc/09/63/46/941096346.db2.gz WPSVHOKPNBPWTN-GFCCVEGCSA-N 0 0 355.385 3.606 20 5 FHBDRN O=C(Cc1cccc([N+](=O)[O-])c1)N[C@@]1(C(F)(F)F)CCc2ccccc21 ZINC000541009838 941098350 /nfs/dbraw/zinc/09/83/50/941098350.db2.gz SLUYVSJBGIOFSK-KRWDZBQOSA-N 0 0 364.323 3.658 20 5 FHBDRN O=[N+]([O-])c1cc(Br)cnc1NCc1ccccc1-n1cccn1 ZINC000301083406 941098361 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FHBDRN Cc1c(NC(=O)c2c(N)cccc2[N+](=O)[O-])cnn1-c1cc(C)ccc1C ZINC000181238231 941116648 /nfs/dbraw/zinc/11/66/48/941116648.db2.gz YEESPBGJOCYJOI-UHFFFAOYSA-N 0 0 365.393 3.540 20 5 FHBDRN Cc1cc(C)cc(C2=CCN(C(=O)c3c(N)cccc3[N+](=O)[O-])CC2)c1 ZINC000181305428 941120992 /nfs/dbraw/zinc/12/09/92/941120992.db2.gz XNNHRAYXBRGVGQ-UHFFFAOYSA-N 0 0 351.406 3.723 20 5 FHBDRN Nc1cccc([N+](=O)[O-])c1C(=O)NCC1(Cc2ccccc2)CCCC1 ZINC000181328147 941122104 /nfs/dbraw/zinc/12/21/04/941122104.db2.gz GWBZQPRAZZOPFQ-UHFFFAOYSA-N 0 0 353.422 3.710 20 5 FHBDRN CSc1cccc(C(=O)Nc2cccc(-c3ncc[nH]3)c2)c1[N+](=O)[O-] ZINC000188881462 941127698 /nfs/dbraw/zinc/12/76/98/941127698.db2.gz DFHRIXIFLMYXHD-UHFFFAOYSA-N 0 0 354.391 3.959 20 5 FHBDRN COc1ccc(CC(C)(C)NC(=O)c2cc(F)c([N+](=O)[O-])cc2F)cc1 ZINC000782860147 941128010 /nfs/dbraw/zinc/12/80/10/941128010.db2.gz PFAINVFSQQLGJF-UHFFFAOYSA-N 0 0 364.348 3.633 20 5 FHBDRN NC(=O)c1ccc(C[NH2+][C@@H](CC2CCC2)c2ccccc2)c([N+](=O)[O-])c1 ZINC000181359184 941132699 /nfs/dbraw/zinc/13/26/99/941132699.db2.gz YUODWNPGAIMWBI-SFHVURJKSA-N 0 0 353.422 3.715 20 5 FHBDRN COc1ccc(C(=O)Nc2ccc([N+](=O)[O-])c(C)n2)c(OCC(C)C)c1 ZINC000188966846 941135309 /nfs/dbraw/zinc/13/53/09/941135309.db2.gz VEQNRMPVWIZEIE-UHFFFAOYSA-N 0 0 359.382 3.594 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1NC(=O)CN1C[C@@H](c2ccccc2)C[C@@H]1C ZINC000115554247 941137302 /nfs/dbraw/zinc/13/73/02/941137302.db2.gz SOYXAMNVLKQUHN-RDJZCZTQSA-N 0 0 353.422 3.720 20 5 FHBDRN O=C(COc1ccccc1[N+](=O)[O-])Nc1ccc(Cl)c(OC(F)F)c1 ZINC000181377601 941140929 /nfs/dbraw/zinc/14/09/29/941140929.db2.gz DOKBYOHEBSIZDE-UHFFFAOYSA-N 0 0 372.711 3.867 20 5 FHBDRN Cc1nc(CC(C)C)oc1C(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000189033392 941142557 /nfs/dbraw/zinc/14/25/57/941142557.db2.gz VGLMDIWZHBZQGM-UHFFFAOYSA-N 0 0 357.410 3.895 20 5 FHBDRN CC(C)CCSc1ccc(C(=O)N(C)CC2(CO)CC2)cc1[N+](=O)[O-] ZINC000189132439 941146931 /nfs/dbraw/zinc/14/69/31/941146931.db2.gz BYKPTCBYVMKZIC-UHFFFAOYSA-N 0 0 366.483 3.578 20 5 FHBDRN Cc1nc(CC(C)C)oc1C(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000189107082 941148425 /nfs/dbraw/zinc/14/84/25/941148425.db2.gz POBBHORQFRHBPJ-UHFFFAOYSA-N 0 0 357.410 3.895 20 5 FHBDRN COc1ccc(Cl)c(NS(=O)(=O)c2c(C)ccc(C)c2[N+](=O)[O-])c1 ZINC000189270027 941154471 /nfs/dbraw/zinc/15/44/71/941154471.db2.gz UOWAEBNRRZQGAB-UHFFFAOYSA-N 0 0 370.814 3.674 20 5 FHBDRN Cc1ccc(CC(=O)Nc2ccc([N+](=O)[O-])c(C)n2)cc1Br ZINC000189294470 941155604 /nfs/dbraw/zinc/15/56/04/941155604.db2.gz ZAXKBARCDPLTPU-UHFFFAOYSA-N 0 0 364.199 3.550 20 5 FHBDRN Cc1ncc([N+](=O)[O-])n1CCN(Cc1ccco1)Cc1cccc(C)c1 ZINC001167709188 941156001 /nfs/dbraw/zinc/15/60/01/941156001.db2.gz UMGYNNUGXHOIHW-UHFFFAOYSA-N 0 0 354.410 3.704 20 5 FHBDRN CC1=NN(c2ccc(C(=O)OCc3ccc([N+](=O)[O-])c(F)c3)cc2)CC1 ZINC000782885458 941156348 /nfs/dbraw/zinc/15/63/48/941156348.db2.gz UAKYPAGMOANJCY-UHFFFAOYSA-N 0 0 357.341 3.677 20 5 FHBDRN CCSc1cc(CNc2ccc(C(=O)NC(C)C)cc2[N+](=O)[O-])ccn1 ZINC000189340096 941156365 /nfs/dbraw/zinc/15/63/65/941156365.db2.gz KOVBMBSEMNMIKS-UHFFFAOYSA-N 0 0 374.466 3.852 20 5 FHBDRN O=C(Nc1ccc2c(c1)C(=O)CCC2)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000177982732 941156443 /nfs/dbraw/zinc/15/64/43/941156443.db2.gz PIJXZYOBKMNGQW-UHFFFAOYSA-N 0 0 365.389 3.940 20 5 FHBDRN O=C(NCc1cccc([N+](=O)[O-])c1)c1ccc(Cl)cc1Br ZINC000177985445 941156673 /nfs/dbraw/zinc/15/66/73/941156673.db2.gz WOSFAPPPIDVFEJ-UHFFFAOYSA-N 0 0 369.602 3.941 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])N1CCC[C@@H]1c1ccc(F)cc1 ZINC000055113901 941157169 /nfs/dbraw/zinc/15/71/69/941157169.db2.gz IGFNRUUQAMDVFO-MRXNPFEDSA-N 0 0 358.369 3.867 20 5 FHBDRN O=[N+]([O-])c1ccc(OCCOCC(F)(F)C(F)(F)F)c2cccnc21 ZINC000189359527 941157544 /nfs/dbraw/zinc/15/75/44/941157544.db2.gz OOTCHEAYPSNVPZ-UHFFFAOYSA-N 0 0 366.242 3.736 20 5 FHBDRN COC(=O)CC1(CC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)CCCC1 ZINC000189506904 941159316 /nfs/dbraw/zinc/15/93/16/941159316.db2.gz OAEMMGZHIRCEEG-UHFFFAOYSA-N 0 0 374.437 3.599 20 5 FHBDRN COc1cc(C(=O)N(Cc2ccc(O)cc2)CC2CC2)cc([N+](=O)[O-])c1C ZINC000189551501 941161035 /nfs/dbraw/zinc/16/10/35/941161035.db2.gz LOFFFJFSBZROEF-UHFFFAOYSA-N 0 0 370.405 3.670 20 5 FHBDRN CCN(Cc1c[nH]c2ccccc12)C(=O)c1ccc([N+](=O)[O-])c(OC)c1 ZINC000189574510 941161048 /nfs/dbraw/zinc/16/10/48/941161048.db2.gz KSEYQNXZVZNFTM-UHFFFAOYSA-N 0 0 353.378 3.747 20 5 FHBDRN Cc1cccc2c1OCC[C@H]2NC(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000189578452 941162353 /nfs/dbraw/zinc/16/23/53/941162353.db2.gz NDEQWNWGQLHQKX-MRXNPFEDSA-N 0 0 363.373 3.705 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)c1ccncc1OC ZINC000189591427 941166500 /nfs/dbraw/zinc/16/65/00/941166500.db2.gz XHWOAGDVWHCGMR-LLVKDONJSA-N 0 0 361.423 3.601 20 5 FHBDRN Cc1cccc2c1OCC[C@H]2NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000189593705 941166724 /nfs/dbraw/zinc/16/67/24/941166724.db2.gz YOCMXUWZSDUONA-MRXNPFEDSA-N 0 0 360.797 3.739 20 5 FHBDRN Cc1ccccc1OCCNC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000178324805 941225358 /nfs/dbraw/zinc/22/53/58/941225358.db2.gz KZGWGOZDSVKZQP-UHFFFAOYSA-N 0 0 369.421 3.656 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)N[C@H](c1cccs1)C1CC1 ZINC000549103396 941264223 /nfs/dbraw/zinc/26/42/23/941264223.db2.gz ARGHAYFUDUBLOF-KRWDZBQOSA-N 0 0 359.451 3.992 20 5 FHBDRN Cc1ccc(-c2cc(C(=O)N(Cc3ccccc3[N+](=O)[O-])C3CC3)[nH]n2)o1 ZINC000178676848 941294557 /nfs/dbraw/zinc/29/45/57/941294557.db2.gz RWNPQZJZJYZBRU-UHFFFAOYSA-N 0 0 366.377 3.691 20 5 FHBDRN Cc1c(NC(=O)CSc2ccc([N+](=O)[O-])cc2)cnn1CCC(C)C ZINC000122254757 941335649 /nfs/dbraw/zinc/33/56/49/941335649.db2.gz DWFPOUSFAMBQRM-UHFFFAOYSA-N 0 0 362.455 3.877 20 5 FHBDRN Cc1nc([C@H]2CCCN2C(=O)c2ccc(Cl)cc2[N+](=O)[O-])cs1 ZINC000190014755 941346617 /nfs/dbraw/zinc/34/66/17/941346617.db2.gz DGLPUPHJBSUXMX-CYBMUJFWSA-N 0 0 351.815 3.990 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@]1(C)CCCC[C@@H]1O ZINC000181497402 941355457 /nfs/dbraw/zinc/35/54/57/941355457.db2.gz RCXFJHJBMRVJJN-FUHWJXTLSA-N 0 0 366.483 3.766 20 5 FHBDRN Cc1cc(NC(=O)c2ccc(F)cc2C)n(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000120168123 941363402 /nfs/dbraw/zinc/36/34/02/941363402.db2.gz VFUWRNJPRKWTFR-UHFFFAOYSA-N 0 0 354.341 3.789 20 5 FHBDRN O=[N+]([O-])c1ccccc1Cn1nnc(-c2ccc(Cl)cc2Cl)n1 ZINC000470251035 941364762 /nfs/dbraw/zinc/36/47/62/941364762.db2.gz UVLPOJGYLRPDJS-UHFFFAOYSA-N 0 0 350.165 3.603 20 5 FHBDRN CC(=O)c1ccc(N2CCC(CCCn3ccnc3)CC2)c([N+](=O)[O-])c1 ZINC000782978033 941365304 /nfs/dbraw/zinc/36/53/04/941365304.db2.gz JJXCYGDHGLACMB-UHFFFAOYSA-N 0 0 356.426 3.691 20 5 FHBDRN CC1=NN(c2ccc(C(=O)N[C@@H](C)c3ccc([N+](=O)[O-])cc3)cc2)CC1 ZINC000452184201 941366175 /nfs/dbraw/zinc/36/61/75/941366175.db2.gz QZHCHAJMANODFL-AWEZNQCLSA-N 0 0 352.394 3.672 20 5 FHBDRN Cc1cc(NC(=O)c2ccc(Cn3cc([N+](=O)[O-])cn3)cc2)ccc1F ZINC001125851777 941366372 /nfs/dbraw/zinc/36/63/72/941366372.db2.gz JVBPFFQYBBBYAM-UHFFFAOYSA-N 0 0 354.341 3.539 20 5 FHBDRN CC(C)[C@@H]1N(Cc2cc([N+](=O)[O-])ccc2OC(F)F)CC12CCOCC2 ZINC000414521686 941371446 /nfs/dbraw/zinc/37/14/46/941371446.db2.gz FGSCNQBLCNCPDO-INIZCTEOSA-N 0 0 370.396 3.833 20 5 FHBDRN CCc1cccc(C)c1NC(=O)N1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000376653657 941372334 /nfs/dbraw/zinc/37/23/34/941372334.db2.gz WALQEGWKKXCVKG-UHFFFAOYSA-N 0 0 357.414 3.531 20 5 FHBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]2CCC[C@@H]21 ZINC000408021170 941392765 /nfs/dbraw/zinc/39/27/65/941392765.db2.gz GLBXLAHGLMERQD-HZMBPMFUSA-N 0 0 353.216 3.680 20 5 FHBDRN COC(=O)[C@H]1CC12CCN(c1cc(C)c(C(F)(F)F)cc1[N+](=O)[O-])CC2 ZINC000549117944 941394034 /nfs/dbraw/zinc/39/40/34/941394034.db2.gz ARXSLJWUIYRZNR-GFCCVEGCSA-N 0 0 372.343 3.702 20 5 FHBDRN Cc1cccc(N2CCN(C(=O)CCCc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000549122493 941408642 /nfs/dbraw/zinc/40/86/42/941408642.db2.gz SKAWGVWNALNKKY-UHFFFAOYSA-N 0 0 367.449 3.575 20 5 FHBDRN CCC[N@H+](CC(=O)[O-])Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000414687811 941439909 /nfs/dbraw/zinc/43/99/09/941439909.db2.gz XPSYEISPCYFFLE-UHFFFAOYSA-N 0 0 357.410 3.659 20 5 FHBDRN C[C@H]1c2ccc(Cl)n2CCN1C(=O)CCc1cc(F)ccc1[N+](=O)[O-] ZINC000936008851 941440429 /nfs/dbraw/zinc/44/04/29/941440429.db2.gz UGZXVUZVFGBCAU-NSHDSACASA-N 0 0 365.792 3.725 20 5 FHBDRN CC1(C)C[C@@H](C(=O)N2CCc3cc([N+](=O)[O-])ccc32)c2ccccc2O1 ZINC000414740777 941455608 /nfs/dbraw/zinc/45/56/08/941455608.db2.gz KCEXWTZOFLNDLB-MRXNPFEDSA-N 0 0 352.390 3.829 20 5 FHBDRN CCCN(C(=O)c1ccc([N+](=O)[O-])cc1F)[C@@H]1C[C@@H](OCC)C1(C)C ZINC000564449466 941457072 /nfs/dbraw/zinc/45/70/72/941457072.db2.gz IDMGKMFLDPJOIS-HZPDHXFCSA-N 0 0 352.406 3.790 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CC=C(c2cccnc2)CC1 ZINC000376950280 941475368 /nfs/dbraw/zinc/47/53/68/941475368.db2.gz RGJAVCLKGCXWDC-KRWDZBQOSA-N 0 0 365.433 3.874 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N[C@H]1C[C@@H](CO)c2ccccc21 ZINC000376956273 941477285 /nfs/dbraw/zinc/47/72/85/941477285.db2.gz FTUSOYCLRZAIMN-BBRMVZONSA-N 0 0 355.394 3.554 20 5 FHBDRN CC(=O)c1ccc(-c2nc(CCNc3ccccc3[N+](=O)[O-])no2)c(F)c1 ZINC000472652163 941487365 /nfs/dbraw/zinc/48/73/65/941487365.db2.gz SFJCXGXOGOGYAL-UHFFFAOYSA-N 0 0 370.340 3.641 20 5 FHBDRN C[C@H](NC(=O)[C@@H]1COCC[C@@H]1c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000414944380 941522845 /nfs/dbraw/zinc/52/28/45/941522845.db2.gz NWNUSPWAAQWEOC-GDIGMMSISA-N 0 0 354.406 3.592 20 5 FHBDRN Cc1cc(NCCn2cnnc2C2CC2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000549146124 941529794 /nfs/dbraw/zinc/52/97/94/941529794.db2.gz IJGXAYXXWLFMRX-UHFFFAOYSA-N 0 0 355.320 3.503 20 5 FHBDRN O=C(c1cc(F)ccc1[N+](=O)[O-])N1CCC(c2nc3ccccc3o2)CC1 ZINC000377154122 941533059 /nfs/dbraw/zinc/53/30/59/941533059.db2.gz XLLLJZUNQVSSQK-UHFFFAOYSA-N 0 0 369.352 3.895 20 5 FHBDRN CCOc1cccc(N2CC[C@H](OCc3csc(C)n3)C2)c1[N+](=O)[O-] ZINC000377180678 941538446 /nfs/dbraw/zinc/53/84/46/941538446.db2.gz WIKLTSDFLFANJO-AWEZNQCLSA-N 0 0 363.439 3.554 20 5 FHBDRN Nc1cccc([N+](=O)[O-])c1C(=O)N1CCC(=Cc2ccc(F)c(F)c2)CC1 ZINC000377184470 941539712 /nfs/dbraw/zinc/53/97/12/941539712.db2.gz MKHUNIGOOZCHAL-UHFFFAOYSA-N 0 0 373.359 3.775 20 5 FHBDRN CC(C)CC[C@@H](NC(=O)c1c[nH]nc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000549159883 941557249 /nfs/dbraw/zinc/55/72/49/941557249.db2.gz TZHCXRNQXXQPNB-CQSZACIVSA-N 0 0 350.806 3.879 20 5 FHBDRN COc1c(O)ccc(C[NH2+]Cc2cccc(COC(C)(C)C)c2)c1[N+](=O)[O-] ZINC000892794982 941562959 /nfs/dbraw/zinc/56/29/59/941562959.db2.gz YPKOCTITTPMICW-UHFFFAOYSA-N 0 0 374.437 3.914 20 5 FHBDRN Cc1c(CC(=O)Nc2ccc(Cl)cc2-n2cccn2)cccc1[N+](=O)[O-] ZINC000472684654 941569400 /nfs/dbraw/zinc/56/94/00/941569400.db2.gz QZCIQXHXWHWEJP-UHFFFAOYSA-N 0 0 370.796 3.924 20 5 FHBDRN COc1ccc(NC(=O)NCCc2csc(C(C)C)n2)cc1[N+](=O)[O-] ZINC000541104959 941585173 /nfs/dbraw/zinc/58/51/73/941585173.db2.gz UGOGPPIJWZAPCP-UHFFFAOYSA-N 0 0 364.427 3.548 20 5 FHBDRN Cc1cc(N[C@@H]2c3ccccc3C[C@H]2O)c(Br)cc1[N+](=O)[O-] ZINC000302657873 941629149 /nfs/dbraw/zinc/62/91/49/941629149.db2.gz HQVCLKCZJHCEBL-HZPDHXFCSA-N 0 0 363.211 3.736 20 5 FHBDRN O=C(C1Cc2ccccc2C1)N1CCS[C@@H]1c1ccc([N+](=O)[O-])cc1 ZINC000431840691 941640310 /nfs/dbraw/zinc/64/03/10/941640310.db2.gz BADXNHXSZSNBPD-LJQANCHMSA-N 0 0 354.431 3.584 20 5 FHBDRN CCCOCc1ccccc1CNc1cc(C(=O)OC)ccc1[N+](=O)[O-] ZINC000541114893 941645735 /nfs/dbraw/zinc/64/57/35/941645735.db2.gz NTKLUMPYCMZTQR-UHFFFAOYSA-N 0 0 358.394 3.920 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2nc(C(F)(F)F)cs2)c1 ZINC000549210937 941647075 /nfs/dbraw/zinc/64/70/75/941647075.db2.gz SCEHISRHJFFOJS-UHFFFAOYSA-N 0 0 361.301 3.721 20 5 FHBDRN C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2Cl)[C@@H](c2ccccc2)CO1 ZINC000072542716 941657858 /nfs/dbraw/zinc/65/78/58/941657858.db2.gz UQOFWHYHWPNBCA-YVEFUNNKSA-N 0 0 360.797 3.850 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N(CC1CC1)C1CCCCC1 ZINC000565846667 941661686 /nfs/dbraw/zinc/66/16/86/941661686.db2.gz YEIPPHNDOWZWHG-UHFFFAOYSA-N 0 0 352.456 3.637 20 5 FHBDRN CC1CCN(c2ccc(C(=O)NCCCC(C)(F)F)cc2[N+](=O)[O-])CC1 ZINC000452201960 941664221 /nfs/dbraw/zinc/66/42/21/941664221.db2.gz VLPQDYHPGHROLY-UHFFFAOYSA-N 0 0 369.412 3.996 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1Oc1ccccc1)N1CCOCC2(CC2)C1 ZINC000541128611 941669244 /nfs/dbraw/zinc/66/92/44/941669244.db2.gz WDKPVKPTZUBYAD-UHFFFAOYSA-N 0 0 368.389 3.640 20 5 FHBDRN COc1ccccc1[C@@H](Nc1cc(F)ccc1[N+](=O)[O-])c1nccn1C ZINC000365562250 941690130 /nfs/dbraw/zinc/69/01/30/941690130.db2.gz NIYJPNPDCNQCCD-QGZVFWFLSA-N 0 0 356.357 3.678 20 5 FHBDRN CC(C)Oc1ccccc1CNC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000122368330 941696560 /nfs/dbraw/zinc/69/65/60/941696560.db2.gz NESAHWTWEQFYFJ-UHFFFAOYSA-N 0 0 369.421 3.650 20 5 FHBDRN Cc1c(C(=O)Nc2cccc(SC(=O)N(C)C)c2)cccc1[N+](=O)[O-] ZINC000729243042 941699855 /nfs/dbraw/zinc/69/98/55/941699855.db2.gz QXTMGDBSZWJETF-UHFFFAOYSA-N 0 0 359.407 3.929 20 5 FHBDRN O=C(Nc1ccnn1-c1ccc([N+](=O)[O-])cc1)[C@H]1Cc2ccc(Cl)cc21 ZINC001125859342 941704333 /nfs/dbraw/zinc/70/43/33/941704333.db2.gz RHPSOQHADCMPJT-INIZCTEOSA-N 0 0 368.780 3.712 20 5 FHBDRN Cc1ccccc1[C@H](NC(=O)c1c([N+](=O)[O-])cnn1C)[C@@H]1CCC[C@H](C)C1 ZINC000122384995 941709582 /nfs/dbraw/zinc/70/95/82/941709582.db2.gz PTPBKAILEIMZPE-JCKWVBRZSA-N 0 0 370.453 3.934 20 5 FHBDRN COc1ccc(C(=O)Nc2cc(C)nn2-c2ccccc2C)cc1[N+](=O)[O-] ZINC000122399935 941714377 /nfs/dbraw/zinc/71/43/77/941714377.db2.gz HYWGMRMNPUPEOG-UHFFFAOYSA-N 0 0 366.377 3.658 20 5 FHBDRN Nc1ccc(C(=O)Nc2cccnc2Oc2ccccc2)cc1[N+](=O)[O-] ZINC000729315684 941715881 /nfs/dbraw/zinc/71/58/81/941715881.db2.gz DKWSBQWYHBRBRV-UHFFFAOYSA-N 0 0 350.334 3.617 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NC[C@H](CC)Oc2cccc(C)c2)c1 ZINC000549243746 941724303 /nfs/dbraw/zinc/72/43/03/941724303.db2.gz HOZTVWUMQUCGGK-HNNXBMFYSA-N 0 0 372.421 3.889 20 5 FHBDRN CSc1cccc(C(=O)N2CC(Cc3cccc(C)c3)C2)c1[N+](=O)[O-] ZINC000614445753 941735127 /nfs/dbraw/zinc/73/51/27/941735127.db2.gz OFMCQYWHQLGHHH-UHFFFAOYSA-N 0 0 356.447 3.940 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1OC(F)F)N1CCS[C@H]2CCCC[C@H]21 ZINC000182341235 941738036 /nfs/dbraw/zinc/73/80/36/941738036.db2.gz YBVXPWAVXIVJPV-OCCSQVGLSA-N 0 0 372.393 3.696 20 5 FHBDRN CC(C)Oc1cc(C(=O)N[C@@H]2CCOc3ccc(F)cc32)ccc1[N+](=O)[O-] ZINC000412099140 941739465 /nfs/dbraw/zinc/73/94/65/941739465.db2.gz ZKGKMZVDXXKHBY-OAHLLOKOSA-N 0 0 374.368 3.775 20 5 FHBDRN Cn1cc([N+](=O)[O-])cc1C(=O)Nc1ccc(NC(=O)OC(C)(C)C)cc1 ZINC000729404449 941746928 /nfs/dbraw/zinc/74/69/28/941746928.db2.gz HSNIGUMOFYUVSO-UHFFFAOYSA-N 0 0 360.370 3.533 20 5 FHBDRN Nc1ccc(-c2noc([C@H]3CC[C@@H](c4ccccc4)O3)n2)cc1[N+](=O)[O-] ZINC000377467923 941749020 /nfs/dbraw/zinc/74/90/20/941749020.db2.gz HONIRJQVJSKTQV-JKSUJKDBSA-N 0 0 352.350 3.820 20 5 FHBDRN CSc1ccc(NC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)cc1 ZINC000053146146 941751601 /nfs/dbraw/zinc/75/16/01/941751601.db2.gz RILLNNKVFBDKPX-UHFFFAOYSA-N 0 0 368.418 3.970 20 5 FHBDRN O=C(NC[C@H]1CC[C@H](c2ccccc2)O1)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000377505690 941775198 /nfs/dbraw/zinc/77/51/98/941775198.db2.gz DFRIMOQXNCTBJD-SJKOYZFVSA-N 0 0 362.332 3.523 20 5 FHBDRN C[C@@H]1COC[C@@H](c2ccccc2)N1C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000415363207 941776070 /nfs/dbraw/zinc/77/60/70/941776070.db2.gz RFYUKMKYNYORML-YGBSJELFSA-N 0 0 366.417 3.687 20 5 FHBDRN COc1c(O)ccc(CNC2(c3nc(C)cs3)CCCC2)c1[N+](=O)[O-] ZINC000892951296 941787862 /nfs/dbraw/zinc/78/78/62/941787862.db2.gz MNOOWUXGLWKKEH-UHFFFAOYSA-N 0 0 363.439 3.633 20 5 FHBDRN COc1ccc(CNC(=O)Nc2ccc(Cl)c(OC)c2)cc1[N+](=O)[O-] ZINC000433610716 941796043 /nfs/dbraw/zinc/79/60/43/941796043.db2.gz URVSMRISDPJPDR-UHFFFAOYSA-N 0 0 365.773 3.587 20 5 FHBDRN CO[C@@H](CC(C)C)C(=O)N(C)c1nc(-c2ccccc2[N+](=O)[O-])cs1 ZINC000415392445 941800602 /nfs/dbraw/zinc/80/06/02/941800602.db2.gz NSWADMMGMYYCKV-HNNXBMFYSA-N 0 0 363.439 3.742 20 5 FHBDRN Cn1cc([C@H]2OCCC[C@@H]2Nc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cn1 ZINC000433628085 941810101 /nfs/dbraw/zinc/81/01/01/941810101.db2.gz HYTCXEYDEUDYNN-DZGCQCFKSA-N 0 0 370.331 3.679 20 5 FHBDRN O=C(COc1cc(F)cc([N+](=O)[O-])c1)c1ccc(Br)cc1 ZINC000433652017 941814039 /nfs/dbraw/zinc/81/40/39/941814039.db2.gz BPAMQXMNBKJNEY-UHFFFAOYSA-N 0 0 354.131 3.758 20 5 FHBDRN CO[C@@H](C)CN(C)[C@H](C(=O)Nc1ccc(C)cc1[N+](=O)[O-])c1ccccc1 ZINC000513261805 941814786 /nfs/dbraw/zinc/81/47/86/941814786.db2.gz POCKKXRNSVBWOG-KXBFYZLASA-N 0 0 371.437 3.550 20 5 FHBDRN Cc1ccccc1CNc1ccccc1NC(=O)c1nn(C)cc1[N+](=O)[O-] ZINC000541156321 941822012 /nfs/dbraw/zinc/82/20/12/941822012.db2.gz ODUBBSVUGXUEHU-UHFFFAOYSA-N 0 0 365.393 3.501 20 5 FHBDRN O=C(Cn1ncc2ccc([N+](=O)[O-])cc21)N1CCCc2cccc(Cl)c21 ZINC000728705025 941824267 /nfs/dbraw/zinc/82/42/67/941824267.db2.gz LDUIACJNYNVAJU-UHFFFAOYSA-N 0 0 370.796 3.577 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N2CCC(C(C)(C)C)CC2)c1F ZINC000412137763 941833020 /nfs/dbraw/zinc/83/30/20/941833020.db2.gz RXSCSBRIBYTOPU-UHFFFAOYSA-N 0 0 352.406 3.570 20 5 FHBDRN COc1ccc2ccccc2c1CNC(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-] ZINC000433684900 941833425 /nfs/dbraw/zinc/83/34/25/941833425.db2.gz LEWUTEIRBGNGLV-UHFFFAOYSA-N 0 0 368.393 3.533 20 5 FHBDRN CCN(C(=O)c1ccccc1Sc1ccccc1[N+](=O)[O-])[C@@H](C)CO ZINC000513306097 941837261 /nfs/dbraw/zinc/83/72/61/941837261.db2.gz HLKXRKNTZNGLRJ-ZDUSSCGKSA-N 0 0 360.435 3.589 20 5 FHBDRN CCOc1ccccc1OS(=O)(=O)c1cc(Cl)c(C)c([N+](=O)[O-])c1 ZINC000019681288 941838218 /nfs/dbraw/zinc/83/82/18/941838218.db2.gz YKFMFUFSNIPUSQ-UHFFFAOYSA-N 0 0 371.798 3.723 20 5 FHBDRN CCO[C@@H]1C[C@H](Nc2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)[C@H]1n1cccn1 ZINC000549284840 941838412 /nfs/dbraw/zinc/83/84/12/941838412.db2.gz CNMVPUXMTSBLDV-BMGDILEWSA-N 0 0 374.441 3.799 20 5 FHBDRN O=C(c1csc(-c2ccc([N+](=O)[O-])cc2)n1)N1CC[C@@H](c2ccco2)C1 ZINC000377613392 941840252 /nfs/dbraw/zinc/84/02/52/941840252.db2.gz ZGMYRAYLYNBLKB-CYBMUJFWSA-N 0 0 369.402 3.941 20 5 FHBDRN O=C(NC[C@H]1CCO[C@H]1c1ccccc1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412142609 941840878 /nfs/dbraw/zinc/84/08/78/941840878.db2.gz YEWQZNIBTJTHRJ-MDNKFWRPSA-N 0 0 366.417 3.592 20 5 FHBDRN COc1cccc(C(=O)Nc2cc([N+](=O)[O-])c(Cl)cc2C)c1OC ZINC000118687440 941842376 /nfs/dbraw/zinc/84/23/76/941842376.db2.gz ZEXKVXOOJPIVRO-UHFFFAOYSA-N 0 0 350.758 3.826 20 5 FHBDRN C[C@@H]1CCc2onc(C(=O)Nc3ccc4cc([N+](=O)[O-])ccc4n3)c2C1 ZINC000433693995 941844302 /nfs/dbraw/zinc/84/43/02/941844302.db2.gz FXRDBTBWKASTNJ-SNVBAGLBSA-N 0 0 352.350 3.508 20 5 FHBDRN CC(=O)N1C[C@H](C)CN(C(=O)c2cc(C)cc([N+](=O)[O-])c2)c2ccccc21 ZINC000365617595 941847748 /nfs/dbraw/zinc/84/77/48/941847748.db2.gz FUAWVZUUTSLDJK-AWEZNQCLSA-N 0 0 367.405 3.553 20 5 FHBDRN CC1(C)CC(Nc2ccc(-c3cccc([N+](=O)[O-])c3)nn2)CC(C)(C)N1O ZINC001167719589 941848824 /nfs/dbraw/zinc/84/88/24/941848824.db2.gz MJMHHDRIDLIWRY-UHFFFAOYSA-N 0 0 371.441 3.875 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N[C@@H]1CCCc2cc(N)ccc21 ZINC000415479772 941849339 /nfs/dbraw/zinc/84/93/39/941849339.db2.gz GOFFPZICSXSZCT-MRXNPFEDSA-N 0 0 354.410 3.993 20 5 FHBDRN CC(C)[C@H]1CCCN(C(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC1 ZINC000513329054 941854945 /nfs/dbraw/zinc/85/49/45/941854945.db2.gz AXLDIAHULHFWJF-HNNXBMFYSA-N 0 0 370.453 3.894 20 5 FHBDRN C[C@@H](c1ccccc1[N+](=O)[O-])N1CCCN(C(=O)c2ccccc2)CC1 ZINC000433722013 941855289 /nfs/dbraw/zinc/85/52/89/941855289.db2.gz APUWUIKBBJWCLV-INIZCTEOSA-N 0 0 353.422 3.504 20 5 FHBDRN CCCOc1ccccc1N[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000433727055 941857886 /nfs/dbraw/zinc/85/78/86/941857886.db2.gz LWOFSWJJVBQVKD-KRWDZBQOSA-N 0 0 355.394 3.601 20 5 FHBDRN Cc1sc(S(=O)(=O)N2CC[C@@H](C)c3ccccc32)cc1[N+](=O)[O-] ZINC000119018560 941863330 /nfs/dbraw/zinc/86/33/30/941863330.db2.gz BUYWTGMKJQIEDF-SNVBAGLBSA-N 0 0 352.437 3.667 20 5 FHBDRN CC(C)Oc1cc(C(=O)NC[C@@H](c2cccnc2)C(C)C)ccc1[N+](=O)[O-] ZINC000412176534 941864828 /nfs/dbraw/zinc/86/48/28/941864828.db2.gz KNEOJVFGZDEDMA-QGZVFWFLSA-N 0 0 371.437 3.947 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2cccc(-c3ncco3)c2)c1 ZINC000549294595 941867458 /nfs/dbraw/zinc/86/74/58/941867458.db2.gz SAZPHCMMAVILKW-UHFFFAOYSA-N 0 0 353.334 3.901 20 5 FHBDRN C[C@@H](c1cccnc1)N1CCN(Cc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000119221542 941870523 /nfs/dbraw/zinc/87/05/23/941870523.db2.gz HYOSABLUMUJNTL-AWEZNQCLSA-N 0 0 360.845 3.522 20 5 FHBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCC[C@@H](O)C1 ZINC000119091163 941870712 /nfs/dbraw/zinc/87/07/12/941870712.db2.gz WFFRTGLUZXZEOE-DZGCQCFKSA-N 0 0 366.483 3.624 20 5 FHBDRN Cc1cn([C@@H](C)c2ccccc2)[nH]c1=NC(=O)c1cc(C)ccc1[N+](=O)[O-] ZINC000472823403 941874278 /nfs/dbraw/zinc/87/42/78/941874278.db2.gz APNUJAFUJHOVOS-HNNXBMFYSA-N 0 0 364.405 3.692 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)NCC2(c3cccc(Cl)c3)CC2)c1[N+](=O)[O-] ZINC000433750591 941874365 /nfs/dbraw/zinc/87/43/65/941874365.db2.gz UZXRWUBOWYWHRM-UHFFFAOYSA-N 0 0 362.817 3.556 20 5 FHBDRN Cc1ccc(NS(=O)(=O)c2cc([N+](=O)[O-])ccc2C)cc1OC(F)F ZINC000513381241 941876718 /nfs/dbraw/zinc/87/67/18/941876718.db2.gz AHWGNEQOSQHPKA-UHFFFAOYSA-N 0 0 372.349 3.614 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NCC(C)(C)c2ccccc2F)c1 ZINC000549299089 941878389 /nfs/dbraw/zinc/87/83/89/941878389.db2.gz AXQVGVZSJZCIHC-UHFFFAOYSA-N 0 0 360.385 3.840 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N[C@@H]2CCCC[C@@H]2Cc2ccccc2)c1[N+](=O)[O-] ZINC000433760366 941878931 /nfs/dbraw/zinc/87/89/31/941878931.db2.gz UUMYPMACVAVLFX-HZPDHXFCSA-N 0 0 370.453 3.973 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N[C@@H]2CCC[C@@H]2Cc2ccccc2)c1[N+](=O)[O-] ZINC000433763964 941881068 /nfs/dbraw/zinc/88/10/68/941881068.db2.gz FMSZYHQLNVVUGB-HUUCEWRRSA-N 0 0 356.426 3.583 20 5 FHBDRN CN(Cc1cc(F)ccc1[N+](=O)[O-])[C@H](c1ccc(F)cc1)c1cnccn1 ZINC000377669305 941884878 /nfs/dbraw/zinc/88/48/78/941884878.db2.gz KUMCLIHSVLSQSZ-LJQANCHMSA-N 0 0 370.359 3.884 20 5 FHBDRN Cc1c(NC(=O)C2CCC(OC[C@H]3CCCO3)CC2)cccc1[N+](=O)[O-] ZINC000549300371 941886235 /nfs/dbraw/zinc/88/62/35/941886235.db2.gz SRHIHQLTLAEGIA-UYSNPLJNSA-N 0 0 362.426 3.596 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(N[C@@H](CO)c2ccccc2OC(F)(F)F)c1 ZINC000480790331 941887364 /nfs/dbraw/zinc/88/73/64/941887364.db2.gz VHLHDGAIXSGVRN-ZDUSSCGKSA-N 0 0 356.300 3.947 20 5 FHBDRN CCN(Cc1ccccc1Cl)S(=O)(=O)c1csc([N+](=O)[O-])c1 ZINC000119546291 941887389 /nfs/dbraw/zinc/88/73/89/941887389.db2.gz GLWLBZISQSEAHH-UHFFFAOYSA-N 0 0 360.844 3.521 20 5 FHBDRN CC(C)N(CC(=O)N1c2ccccc2C[C@@H]1C)Cc1ccc([N+](=O)[O-])cc1 ZINC000513391482 941888039 /nfs/dbraw/zinc/88/80/39/941888039.db2.gz CLDAGPWSTUWXPD-INIZCTEOSA-N 0 0 367.449 3.783 20 5 FHBDRN CC(C)O[C@@H]1C[C@@H](NC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)C1(C)C ZINC001267677488 941890055 /nfs/dbraw/zinc/89/00/55/941890055.db2.gz VBASOLVOHBDDGQ-APHBMKBZSA-N 0 0 366.483 3.784 20 5 FHBDRN C[C@H](Cc1cccs1)Nc1ccc([N+](=O)[O-])c(N2CCOCC2)c1F ZINC000565224091 941891472 /nfs/dbraw/zinc/89/14/72/941891472.db2.gz ZWLORBWYNYKTEA-GFCCVEGCSA-N 0 0 365.430 3.675 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)NCc2ccccc2-c2ccncc2)c1 ZINC000377682661 941897358 /nfs/dbraw/zinc/89/73/58/941897358.db2.gz ZABGZDRJNXQGAX-UHFFFAOYSA-N 0 0 363.373 3.595 20 5 FHBDRN Cc1ccc(NC(=O)Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)cc1F ZINC000103463377 941899614 /nfs/dbraw/zinc/89/96/14/941899614.db2.gz MZYOZLDXACDVLL-UHFFFAOYSA-N 0 0 354.341 3.545 20 5 FHBDRN Cc1ccc([C@H]2C[C@H](C)CCN2S(=O)(=O)c2csc([N+](=O)[O-])c2)o1 ZINC000119898351 941905971 /nfs/dbraw/zinc/90/59/71/941905971.db2.gz URFJVRSNFNYTRO-ZWNOBZJWSA-N 0 0 370.452 3.720 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N[C@H](C)c1nc(-c2ccc(F)cc2)no1 ZINC000365652062 941907850 /nfs/dbraw/zinc/90/78/50/941907850.db2.gz YQTRKZBQIWCGPP-LLVKDONJSA-N 0 0 370.340 3.583 20 5 FHBDRN CC(C)Oc1cc(C(=O)N[C@H](C)[C@H]2COc3ccccc32)ccc1[N+](=O)[O-] ZINC000412210457 941909047 /nfs/dbraw/zinc/90/90/47/941909047.db2.gz HCSSBIPITBPFRC-CZUORRHYSA-N 0 0 370.405 3.677 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2cccnc2N2CCCCC2)c1 ZINC000584338911 941910936 /nfs/dbraw/zinc/91/09/36/941910936.db2.gz QMWJFMGTYPGFMI-UHFFFAOYSA-N 0 0 370.409 3.631 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NCC(C)(C)c2ccc(F)cc2)c1 ZINC000549307582 941911368 /nfs/dbraw/zinc/91/13/68/941911368.db2.gz NYNXQTWBARFBJU-UHFFFAOYSA-N 0 0 360.385 3.840 20 5 FHBDRN COc1cccc(C(C)(C)CNC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)c1 ZINC000412203092 941912055 /nfs/dbraw/zinc/91/20/55/941912055.db2.gz LMVYRFQHXAXRGI-RBUKOAKNSA-N 0 0 368.433 3.801 20 5 FHBDRN COc1cccc2c1OCC(C(=O)Nc1cc([N+](=O)[O-])c(C)cc1C)=C2 ZINC000513428128 941915906 /nfs/dbraw/zinc/91/59/06/941915906.db2.gz BIYLJHHDIHARNI-UHFFFAOYSA-N 0 0 354.362 3.635 20 5 FHBDRN Cc1ccc(C(=O)N[C@H]2CCO[C@H]2c2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000182434029 941924806 /nfs/dbraw/zinc/92/48/06/941924806.db2.gz UMPBEBXVTIWBDP-RDJZCZTQSA-N 0 0 360.797 3.817 20 5 FHBDRN Cc1cc(C(=O)N[C@@H]2CCO[C@@H]2c2ccc(Cl)cc2)cc([N+](=O)[O-])c1 ZINC000182442469 941924998 /nfs/dbraw/zinc/92/49/98/941924998.db2.gz WZQBBUFWCLSHCP-IAGOWNOFSA-N 0 0 360.797 3.817 20 5 FHBDRN O=C(N[C@H]1CCO[C@@H]1c1ccc(Cl)cc1)c1ccc([N+](=O)[O-])cc1F ZINC000182456413 941926283 /nfs/dbraw/zinc/92/62/83/941926283.db2.gz XSBFTIQPACWEMN-JKSUJKDBSA-N 0 0 364.760 3.647 20 5 FHBDRN Cc1c(C(=O)N[C@@H]2CCO[C@H]2c2ccc(Cl)cc2)cccc1[N+](=O)[O-] ZINC000182460953 941927126 /nfs/dbraw/zinc/92/71/26/941927126.db2.gz QQMABALSXXMTOF-WBVHZDCISA-N 0 0 360.797 3.817 20 5 FHBDRN COCCCN(Cc1ccncc1)c1nc2ccccc2cc1[N+](=O)[O-] ZINC000473528620 941931267 /nfs/dbraw/zinc/93/12/67/941931267.db2.gz VJFHAXAHBVNTRO-UHFFFAOYSA-N 0 0 352.394 3.581 20 5 FHBDRN Cc1sc(C(=O)N[C@@H]2CCO[C@H]2c2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000182486423 941934366 /nfs/dbraw/zinc/93/43/66/941934366.db2.gz ISZBSJPDMRXQRS-DOMZBBRYSA-N 0 0 366.826 3.878 20 5 FHBDRN CCCCOc1cccc(CNC(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])c1 ZINC000433839621 941937201 /nfs/dbraw/zinc/93/72/01/941937201.db2.gz AFJGWKCJJKJBKY-UHFFFAOYSA-N 0 0 360.414 3.550 20 5 FHBDRN O=C(N[C@H](c1ccccc1)[C@H]1CCOC1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412227226 941937600 /nfs/dbraw/zinc/93/76/00/941937600.db2.gz JFSNAOCWRFCBRD-IJXRJRJASA-N 0 0 366.417 3.592 20 5 FHBDRN CC(C)c1[nH]nc(C(=O)Nc2ccc3c4c(cccc42)CC3)c1[N+](=O)[O-] ZINC000433861320 941945810 /nfs/dbraw/zinc/94/58/10/941945810.db2.gz ACOCFVFGEWXGOW-UHFFFAOYSA-N 0 0 350.378 3.945 20 5 FHBDRN COc1ccc([C@@H](NC(=O)c2cccc([N+](=O)[O-])c2)C(F)(F)F)cc1 ZINC000182611756 941947333 /nfs/dbraw/zinc/94/73/33/941947333.db2.gz CZISNVFXZABQKI-CQSZACIVSA-N 0 0 354.284 3.637 20 5 FHBDRN NC(=O)c1ccc(CNc2ccc(Cl)c(OC(F)F)c2)c([N+](=O)[O-])c1 ZINC000182621907 941947917 /nfs/dbraw/zinc/94/79/17/941947917.db2.gz RQKPCGSEXDXLPE-UHFFFAOYSA-N 0 0 371.727 3.561 20 5 FHBDRN CC1(CNC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)Cc2ccccc2C1 ZINC000412232597 941948869 /nfs/dbraw/zinc/94/88/69/941948869.db2.gz SCPBVWWEOMABGM-RBUKOAKNSA-N 0 0 350.418 3.620 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1cccc(O)c1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000412238031 941950348 /nfs/dbraw/zinc/95/03/48/941950348.db2.gz VZKIUEOFBMCUKH-RBUKOAKNSA-N 0 0 352.390 3.595 20 5 FHBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])[C@H]1C[C@]1(F)c1ccccc1 ZINC000412242654 941953847 /nfs/dbraw/zinc/95/38/47/941953847.db2.gz MZTVGFAMSHLFEP-QAPCUYQASA-N 0 0 362.788 3.792 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N[C@H](C)c2ccc3c(c2)CCCC3)c1[N+](=O)[O-] ZINC000433864519 941953915 /nfs/dbraw/zinc/95/39/15/941953915.db2.gz XNQXDJSHQSIDOY-GFCCVEGCSA-N 0 0 356.426 3.811 20 5 FHBDRN Cc1csc([C@H](C)CNC(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)n1 ZINC000412245265 941956226 /nfs/dbraw/zinc/95/62/26/941956226.db2.gz DKVGISBATCJQPJ-LLVKDONJSA-N 0 0 363.439 3.680 20 5 FHBDRN C[C@@H](O)C[C@@H]1CCCCCN1C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000513497461 941963684 /nfs/dbraw/zinc/96/36/84/941963684.db2.gz XFMVUOOEKPPTRV-NEPJUHHUSA-N 0 0 355.822 3.796 20 5 FHBDRN O=C(N[C@H](c1c(F)cccc1F)C(F)(F)F)c1ccccc1[N+](=O)[O-] ZINC000182753234 941964685 /nfs/dbraw/zinc/96/46/85/941964685.db2.gz ZUHGLERRXLZJKX-CYBMUJFWSA-N 0 0 360.238 3.906 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCN([C@H](C)c2cccnc2)CC1 ZINC000182807582 941970132 /nfs/dbraw/zinc/97/01/32/941970132.db2.gz YOJBYJLPGUSXRF-IAGOWNOFSA-N 0 0 354.454 3.738 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)C1(c2ccccc2)CC(F)(F)C1 ZINC000377762937 941974137 /nfs/dbraw/zinc/97/41/37/941974137.db2.gz OKACYPJOCJORFI-UHFFFAOYSA-N 0 0 360.360 3.920 20 5 FHBDRN CSc1ccc(C(=O)N2C[C@H](C)C[C@H]2c2cccnc2)cc1[N+](=O)[O-] ZINC000182836247 941978544 /nfs/dbraw/zinc/97/85/44/941978544.db2.gz NQVBOVFTGOVQTN-DOMZBBRYSA-N 0 0 357.435 3.935 20 5 FHBDRN CCOCCCn1c(-c2ccc([N+](=O)[O-])cc2)nnc1N1CCC[C@H]1CC ZINC000460721272 942004677 /nfs/dbraw/zinc/00/46/77/942004677.db2.gz FKUMHYNGNVERNP-MRXNPFEDSA-N 0 0 373.457 3.659 20 5 FHBDRN CC(C)(C)OCc1cccc(CNC(=O)c2ccc([N+](=O)[O-])cc2F)c1 ZINC000101845810 942014848 /nfs/dbraw/zinc/01/48/48/942014848.db2.gz AUYVECRCBXQUOE-UHFFFAOYSA-N 0 0 360.385 3.979 20 5 FHBDRN COCC[C@@H]1CCCCN(C(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)C1 ZINC000412270572 942017326 /nfs/dbraw/zinc/01/73/26/942017326.db2.gz NFPGTCVYYPCOAI-HNNXBMFYSA-N 0 0 364.442 3.661 20 5 FHBDRN CSc1cccc(N(C)C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)c1 ZINC000101833471 942017983 /nfs/dbraw/zinc/01/79/83/942017983.db2.gz TWRZTWXMEZDQPF-UHFFFAOYSA-N 0 0 368.418 3.779 20 5 FHBDRN CSCc1cccc(CNC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)c1 ZINC000412278280 942019515 /nfs/dbraw/zinc/01/95/15/942019515.db2.gz OJSGVVXBVISGBS-ZWKOTPCHSA-N 0 0 356.447 3.878 20 5 FHBDRN COCCc1ccccc1NC(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1 ZINC000412275552 942022393 /nfs/dbraw/zinc/02/23/93/942022393.db2.gz KBQVSPYZCZMGHU-UHFFFAOYSA-N 0 0 358.394 3.823 20 5 FHBDRN Cc1ccccc1C[C@@H]1CCCN1C(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000513580944 942023398 /nfs/dbraw/zinc/02/33/98/942023398.db2.gz SOQWIUKWQJOIFT-SFHVURJKSA-N 0 0 367.449 3.939 20 5 FHBDRN O=C(NC1CCC2(CC2)CC1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000434010985 942038745 /nfs/dbraw/zinc/03/87/45/942038745.db2.gz GSGBNQXSNWJTMM-UHFFFAOYSA-N 0 0 357.454 3.650 20 5 FHBDRN CCN(Cc1cccc(-c2ccncc2)c1)C(=O)c1ccc([N+](=O)[O-])o1 ZINC000377854806 942038852 /nfs/dbraw/zinc/03/88/52/942038852.db2.gz HKTGWNMRXQHFBM-UHFFFAOYSA-N 0 0 351.362 3.912 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)NC[C@@H]2CCCC[C@@H]2C(F)(F)F)c1[N+](=O)[O-] ZINC000434012718 942039506 /nfs/dbraw/zinc/03/95/06/942039506.db2.gz QJNPBDQINQIMMD-UWVGGRQHSA-N 0 0 362.352 3.540 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C[C@H]1CCOC1)c1ccccc1 ZINC000159000113 942041129 /nfs/dbraw/zinc/04/11/29/942041129.db2.gz CMICBUURRKOPMT-DNVCBOLYSA-N 0 0 354.406 3.801 20 5 FHBDRN Cc1ccc(Cl)c(NC(=O)c2cn(-c3cccc([N+](=O)[O-])c3)nn2)c1C ZINC000434020338 942042949 /nfs/dbraw/zinc/04/29/49/942042949.db2.gz FUGRJBLOTDPTRY-UHFFFAOYSA-N 0 0 371.784 3.698 20 5 FHBDRN Cc1nn(C)c(N[C@@H](C)c2nc3ccccc3n2C(F)F)c1[N+](=O)[O-] ZINC000513623587 942043749 /nfs/dbraw/zinc/04/37/49/942043749.db2.gz FXBRJMNXXYYOJT-VIFPVBQESA-N 0 0 350.329 3.555 20 5 FHBDRN COc1ccc(CNC(=O)c2cccc(C)c2[N+](=O)[O-])c(C(F)(F)F)c1 ZINC000102281425 942049187 /nfs/dbraw/zinc/04/91/87/942049187.db2.gz POXJUQGCFTZLCT-UHFFFAOYSA-N 0 0 368.311 3.861 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])N1CCC(F)(c2ccccc2)CC1 ZINC000434027508 942054125 /nfs/dbraw/zinc/05/41/25/942054125.db2.gz LDRICUHCDKSMCK-UHFFFAOYSA-N 0 0 372.396 3.851 20 5 FHBDRN CCCC(=O)Nc1cccc(NC(=O)N(C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000047716255 942055403 /nfs/dbraw/zinc/05/54/03/942055403.db2.gz XZJNKDRNCLLVNE-UHFFFAOYSA-N 0 0 370.409 3.997 20 5 FHBDRN CNc1c(C(=O)Nc2ccc(OC(C)C)c(OC)c2)cccc1[N+](=O)[O-] ZINC000468630489 942065561 /nfs/dbraw/zinc/06/55/61/942065561.db2.gz YJRYKJZJJRHERM-UHFFFAOYSA-N 0 0 359.382 3.685 20 5 FHBDRN CC(C)Oc1ccc(NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)cn1 ZINC000513670584 942066060 /nfs/dbraw/zinc/06/60/60/942066060.db2.gz YWAKHFQJWSZNFO-UHFFFAOYSA-N 0 0 367.308 3.631 20 5 FHBDRN COc1c(F)cc(NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)cc1F ZINC000513674584 942067953 /nfs/dbraw/zinc/06/79/53/942067953.db2.gz IMACENIMIHGEEW-UHFFFAOYSA-N 0 0 374.246 3.735 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1-c1nc(=O)c2c3c(sc2[nH]1)SCCC3 ZINC000046703506 942068921 /nfs/dbraw/zinc/06/89/21/942068921.db2.gz RBUAKURSVGAMPZ-UHFFFAOYSA-N 0 0 359.432 3.907 20 5 FHBDRN CCOc1cc(NC(=O)Cc2cccc(C)c2)c([N+](=O)[O-])cc1OCC ZINC000102602344 942073452 /nfs/dbraw/zinc/07/34/52/942073452.db2.gz RBNGZXGABSNFPJ-UHFFFAOYSA-N 0 0 358.394 3.882 20 5 FHBDRN Cn1c(Sc2c3cc(F)ccc3ncc2[N+](=O)[O-])nnc1C1CCC1 ZINC000893119982 942073525 /nfs/dbraw/zinc/07/35/25/942073525.db2.gz DRGZFPOJFFMTIN-UHFFFAOYSA-N 0 0 359.386 3.829 20 5 FHBDRN CC(C)[C@@H]1C[C@@H](CC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)CCO1 ZINC000513680737 942074028 /nfs/dbraw/zinc/07/40/28/942074028.db2.gz SFJIAAPJDILQMW-NHYWBVRUSA-N 0 0 372.368 3.976 20 5 FHBDRN CCCCN(Cc1ccccc1Cl)C(=O)Cn1cc([N+](=O)[O-])nc1C ZINC000102613821 942074167 /nfs/dbraw/zinc/07/41/67/942074167.db2.gz GJCXZHKWWORLAJ-UHFFFAOYSA-N 0 0 364.833 3.582 20 5 FHBDRN C[C@H](CN[C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000513684653 942075321 /nfs/dbraw/zinc/07/53/21/942075321.db2.gz UAARNEOPDKESJI-AUUYWEPGSA-N 0 0 368.412 3.950 20 5 FHBDRN CN(CCn1cc([N+](=O)[O-])cn1)[C@H](c1ccc(Cl)cc1)c1ccccn1 ZINC000377931857 942075902 /nfs/dbraw/zinc/07/59/02/942075902.db2.gz LMTAPLBLXPXSFP-GOSISDBHSA-N 0 0 371.828 3.561 20 5 FHBDRN CCn1c(-c2ccc([N+](=O)[O-])cc2)nnc1N(C)Cc1cccc(OC)c1 ZINC000549374524 942077316 /nfs/dbraw/zinc/07/73/16/942077316.db2.gz NNKGQYRIQDFKAD-UHFFFAOYSA-N 0 0 367.409 3.518 20 5 FHBDRN O=C(/C=C/Sc1ccccc1)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000016058038 942087276 /nfs/dbraw/zinc/08/72/76/942087276.db2.gz TVCGXWIRILAOER-XNTDXEJSSA-N 0 0 369.446 3.549 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc2c1CCO2 ZINC000434124969 942091947 /nfs/dbraw/zinc/09/19/47/942091947.db2.gz QPYWQZMTRJKUNP-UHFFFAOYSA-N 0 0 355.394 3.972 20 5 FHBDRN Cc1[nH]c(-c2ccccc2)nc1C(=O)OCCc1ccc([N+](=O)[O-])cc1 ZINC000728726018 942092832 /nfs/dbraw/zinc/09/28/32/942092832.db2.gz RGIQMVPMGNUVGH-UHFFFAOYSA-N 0 0 351.362 3.693 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc3oc(C4CC4)nc3c2)c1 ZINC000146928662 942094183 /nfs/dbraw/zinc/09/41/83/942094183.db2.gz KBQFTKHSGZXFHW-UHFFFAOYSA-N 0 0 353.334 3.874 20 5 FHBDRN CO[C@@H]1CCC[C@H](CC(=O)N(C)Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000280083020 942098622 /nfs/dbraw/zinc/09/86/22/942098622.db2.gz YNEWQOHFGKBAFX-SWLSCSKDSA-N 0 0 354.834 3.802 20 5 FHBDRN Cc1ccnc(N2CCC[C@H]2c2ccc(Br)cn2)c1[N+](=O)[O-] ZINC000413363877 942098770 /nfs/dbraw/zinc/09/87/70/942098770.db2.gz BGHQKOBYLRUKBN-ZDUSSCGKSA-N 0 0 363.215 3.797 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)NCC1(c2ccc(F)cc2)CCOCC1 ZINC000501888377 942104049 /nfs/dbraw/zinc/10/40/49/942104049.db2.gz QZQQMAYVPMXLIX-UHFFFAOYSA-N 0 0 372.396 3.521 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N[C@@H](CC)c2ccccc2)cc1OC ZINC000415889657 942110554 /nfs/dbraw/zinc/11/05/54/942110554.db2.gz CAOUUQQCHLDXKR-HNNXBMFYSA-N 0 0 358.394 3.883 20 5 FHBDRN CC1(C)CN(C(=O)COc2ccc([N+](=O)[O-])cc2)C[C@H]1c1ccccc1 ZINC000434091034 942112797 /nfs/dbraw/zinc/11/27/97/942112797.db2.gz BRKUXGCLKSECAJ-SFHVURJKSA-N 0 0 354.406 3.626 20 5 FHBDRN NC(=O)c1cccc([N+](=O)[O-])c1N1CCC(c2cccc(Cl)c2)CC1 ZINC000420607954 942116459 /nfs/dbraw/zinc/11/64/59/942116459.db2.gz COSIZLGNUIBZCR-UHFFFAOYSA-N 0 0 359.813 3.731 20 5 FHBDRN Cc1cc(NC[C@H]2CC[C@H](C(N)=O)CC2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000420610919 942117716 /nfs/dbraw/zinc/11/77/16/942117716.db2.gz OXIBMHPDBOSWPL-XYPYZODXSA-N 0 0 359.348 3.626 20 5 FHBDRN Cc1ccc([C@@H]2OCCC[C@@H]2CNc2c(C(N)=O)cccc2[N+](=O)[O-])cc1 ZINC000420593521 942120591 /nfs/dbraw/zinc/12/05/91/942120591.db2.gz BUQFKEKWNHGZJE-BEFAXECRSA-N 0 0 369.421 3.582 20 5 FHBDRN CO[C@@]1(C)CCCN(C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000280165942 942121719 /nfs/dbraw/zinc/12/17/19/942121719.db2.gz FXIKUNFIKBJPIM-IBGZPJMESA-N 0 0 363.458 3.518 20 5 FHBDRN CCOc1cc(C(=O)N[C@@H](CC)c2ccccc2)c([N+](=O)[O-])cc1OC ZINC000415893414 942121722 /nfs/dbraw/zinc/12/17/22/942121722.db2.gz KPWDIRQLOPDVIG-HNNXBMFYSA-N 0 0 358.394 3.883 20 5 FHBDRN CO[C@@]1(C)CCCN(C(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CC1 ZINC000280170799 942122185 /nfs/dbraw/zinc/12/21/85/942122185.db2.gz ZANDRCINMIRKQR-HNNXBMFYSA-N 0 0 360.332 3.645 20 5 FHBDRN NC(=O)c1cccc([N+](=O)[O-])c1N[C@H]1CCCc2sc(Cl)cc21 ZINC000420627040 942125062 /nfs/dbraw/zinc/12/50/62/942125062.db2.gz KNEVUMWYIDAMDF-JTQLQIEISA-N 0 0 351.815 3.898 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)c2ncsc2C(F)(F)F)cc1[N+](=O)[O-] ZINC000280198829 942133609 /nfs/dbraw/zinc/13/36/09/942133609.db2.gz DUXYYVMRDOXFRZ-QMMMGPOBSA-N 0 0 359.329 3.870 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2noc(N3CCC[C@H](CC(F)(F)F)C3)n2)cc1 ZINC000420619578 942135104 /nfs/dbraw/zinc/13/51/04/942135104.db2.gz FTEXRNLBLPWUKQ-SNVBAGLBSA-N 0 0 356.304 3.814 20 5 FHBDRN C[C@H]1CC[C@H](CNc2cc(C(F)(F)C(F)(F)F)ncc2[N+](=O)[O-])O1 ZINC000413381476 942136938 /nfs/dbraw/zinc/13/69/38/942136938.db2.gz WHKTUFJIXBTMFY-JGVFFNPUSA-N 0 0 355.263 3.623 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)NCCOc1cccc2ccccc21 ZINC000501962380 942140895 /nfs/dbraw/zinc/14/08/95/942140895.db2.gz OXGOUNLITHEYMC-UHFFFAOYSA-N 0 0 350.374 3.865 20 5 FHBDRN CC(C)c1nn(C)cc1N[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000280230950 942140932 /nfs/dbraw/zinc/14/09/32/942140932.db2.gz HICDHXWVRJDKTM-SNVBAGLBSA-N 0 0 365.821 3.544 20 5 FHBDRN O=[N+]([O-])c1ccccc1/C=C/CN1CCC[C@@H](c2noc(C3CC3)n2)C1 ZINC000271188422 942141616 /nfs/dbraw/zinc/14/16/16/942141616.db2.gz FERUAWVFPJWYIT-WUTVXBCWSA-N 0 0 354.410 3.748 20 5 FHBDRN CC(=O)N1Cc2ccc(NC(=O)Nc3ccc(Cl)c([N+](=O)[O-])c3)cc2C1 ZINC000378002016 942141742 /nfs/dbraw/zinc/14/17/42/942141742.db2.gz LDXPVGVADRBDSE-UHFFFAOYSA-N 0 0 374.784 3.754 20 5 FHBDRN COC(=O)c1cc(C)nc(N[C@H](C)c2cc(C)ccc2OC)c1[N+](=O)[O-] ZINC000413395748 942143251 /nfs/dbraw/zinc/14/32/51/942143251.db2.gz CGCYGGIYRSNMBS-GFCCVEGCSA-N 0 0 359.382 3.575 20 5 FHBDRN C[C@@H](Nc1ncc([N+](=O)[O-])cc1Br)c1nc2c(s1)CCC2 ZINC000413396480 942143956 /nfs/dbraw/zinc/14/39/56/942143956.db2.gz OXWIQSJKFQQXEU-SSDOTTSWSA-N 0 0 369.244 3.871 20 5 FHBDRN O=C(NCC1(c2ccncc2)CCCC1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000501985310 942152992 /nfs/dbraw/zinc/15/29/92/942152992.db2.gz ONYIJIHNFGAIBG-UHFFFAOYSA-N 0 0 359.813 3.885 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)NC[C@H]2CCC[C@H](C)C2)cc1SC ZINC000102999640 942157934 /nfs/dbraw/zinc/15/79/34/942157934.db2.gz YAQVYXQBTDGLKP-RYUDHWBXSA-N 0 0 352.456 3.881 20 5 FHBDRN COc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])c(OC(C)C)c3)CC2)cc1 ZINC000413420682 942162792 /nfs/dbraw/zinc/16/27/92/942162792.db2.gz PQPZRRNFURHBGL-UHFFFAOYSA-N 0 0 370.405 3.810 20 5 FHBDRN O=[N+]([O-])c1cc2ccccc2nc1N1CCN(Cc2cccs2)CC1 ZINC000473535355 942169443 /nfs/dbraw/zinc/16/94/43/942169443.db2.gz XQZHZOYRYUENNL-UHFFFAOYSA-N 0 0 354.435 3.527 20 5 FHBDRN O=C(Nc1cnc(C2CC2)nc1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000103017274 942174569 /nfs/dbraw/zinc/17/45/69/942174569.db2.gz MPRLSGRBWCIFEI-UHFFFAOYSA-N 0 0 367.390 3.638 20 5 FHBDRN Cn1c(C(=O)Nc2nc3ccccc3n2-c2ccccc2)ccc1[N+](=O)[O-] ZINC000502060700 942192668 /nfs/dbraw/zinc/19/26/68/942192668.db2.gz IFGCRIVRKCBMCX-UHFFFAOYSA-N 0 0 361.361 3.525 20 5 FHBDRN CN(C(=O)Cc1ccc([N+](=O)[O-])cc1)[C@@H](c1ccccc1)C(F)(F)F ZINC000103050737 942193394 /nfs/dbraw/zinc/19/33/94/942193394.db2.gz XPIQDGNDQXJJGY-INIZCTEOSA-N 0 0 352.312 3.899 20 5 FHBDRN Cc1cnc(C(C)(C)NC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])s1 ZINC000280509845 942198588 /nfs/dbraw/zinc/19/85/88/942198588.db2.gz QGIYARLPVSNCGG-UHFFFAOYSA-N 0 0 371.821 3.746 20 5 FHBDRN CCC(=O)Nc1ccc(C)c(NC(=O)c2cc(F)cc(C)c2[N+](=O)[O-])c1 ZINC000122757918 942199483 /nfs/dbraw/zinc/19/94/83/942199483.db2.gz RSRGMICYRUGLRW-UHFFFAOYSA-N 0 0 359.357 3.952 20 5 FHBDRN COCCOc1ccc(NC(=O)c2c(Cl)cccc2[N+](=O)[O-])c(C)c1 ZINC000110232321 942203306 /nfs/dbraw/zinc/20/33/06/942203306.db2.gz QWTSAHMOPZBRDK-UHFFFAOYSA-N 0 0 364.785 3.834 20 5 FHBDRN Cc1cccc(OC(F)F)c1NC(=O)CNc1ccccc1[N+](=O)[O-] ZINC000103079473 942204403 /nfs/dbraw/zinc/20/44/03/942204403.db2.gz RXIHMDRLKVHIAR-UHFFFAOYSA-N 0 0 351.309 3.555 20 5 FHBDRN CN(C(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1)c1ccc2cc[nH]c2c1 ZINC000280551187 942205044 /nfs/dbraw/zinc/20/50/44/942205044.db2.gz KZTARNCNDHMXPP-UHFFFAOYSA-N 0 0 364.405 3.953 20 5 FHBDRN COc1cc(C(=O)NCc2c(Cl)cccc2OC)cc([N+](=O)[O-])c1C ZINC000480932031 942209445 /nfs/dbraw/zinc/20/94/45/942209445.db2.gz GZVBKVVPFJLPTH-UHFFFAOYSA-N 0 0 364.785 3.504 20 5 FHBDRN C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)c1ccon1 ZINC000502098526 942220038 /nfs/dbraw/zinc/22/00/38/942220038.db2.gz PATBUZGCZQUSIC-LBPRGKRZSA-N 0 0 353.334 3.866 20 5 FHBDRN CC(C)Oc1cc(C(=O)NCCc2ccc3[nH]ccc3c2)ccc1[N+](=O)[O-] ZINC000412319081 942224137 /nfs/dbraw/zinc/22/41/37/942224137.db2.gz HSVSSGBWOLMYQY-UHFFFAOYSA-N 0 0 367.405 3.836 20 5 FHBDRN CC(=O)c1cc(N2CCN(Cc3ccccc3)[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000396364359 942226206 /nfs/dbraw/zinc/22/62/06/942226206.db2.gz YFXAQQQMXBQAHR-OAHLLOKOSA-N 0 0 353.422 3.508 20 5 FHBDRN COc1ccc(CNC(=O)N[C@H](C)c2cc(C)cc(C)c2)cc1[N+](=O)[O-] ZINC000502128923 942235569 /nfs/dbraw/zinc/23/55/69/942235569.db2.gz XTGKUGIJXFOQJN-CQSZACIVSA-N 0 0 357.410 3.781 20 5 FHBDRN CCCc1ccc(Cn2cc(Br)cc([N+](=O)[O-])c2=O)cc1 ZINC000502133361 942238175 /nfs/dbraw/zinc/23/81/75/942238175.db2.gz KFLUCULVRSJQOD-UHFFFAOYSA-N 0 0 351.200 3.520 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N[C@H](c1ccc(Cl)cc1)C1CC1 ZINC000015580210 942246529 /nfs/dbraw/zinc/24/65/29/942246529.db2.gz KLVRQZOFNDIMRP-SFHVURJKSA-N 0 0 360.797 3.895 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)O[C@H](C)C(=O)N(C)c2ccccc2)c1 ZINC000016196571 942247976 /nfs/dbraw/zinc/24/79/76/942247976.db2.gz YLGXSKARVGHYSI-GFCCVEGCSA-N 0 0 374.418 3.525 20 5 FHBDRN Cc1cnn(-c2ccc(C(=O)N3c4ccc([N+](=O)[O-])cc4C[C@H]3C)cc2)c1 ZINC000103375676 942248444 /nfs/dbraw/zinc/24/84/44/942248444.db2.gz GAPMVIWTJJGKSU-CQSZACIVSA-N 0 0 362.389 3.680 20 5 FHBDRN CC(C)c1ncc(Cl)c(C(=O)N2c3ccc([N+](=O)[O-])cc3C[C@H]2C)n1 ZINC000103375372 942248662 /nfs/dbraw/zinc/24/86/62/942248662.db2.gz MARBBTKBVGLACD-SNVBAGLBSA-N 0 0 360.801 3.753 20 5 FHBDRN CCOc1ccc(C(=O)N2c3ccc([N+](=O)[O-])cc3C[C@@H]2C)cc1OC ZINC000103377776 942248994 /nfs/dbraw/zinc/24/89/94/942248994.db2.gz MTQGEAASVIZVSI-LBPRGKRZSA-N 0 0 356.378 3.594 20 5 FHBDRN Cc1c(C(=O)N2c3ccc([N+](=O)[O-])cc3C[C@@H]2C)cnn1-c1ccccc1 ZINC000103376635 942249212 /nfs/dbraw/zinc/24/92/12/942249212.db2.gz AKYLDEGYJKNOJG-ZDUSSCGKSA-N 0 0 362.389 3.680 20 5 FHBDRN CCNc1ccc(C(=O)NC[C@@H]2C[C@H]2c2cccc(OC)c2)cc1[N+](=O)[O-] ZINC000416012477 942253121 /nfs/dbraw/zinc/25/31/21/942253121.db2.gz ANBSBOHLCJYJAU-RDJZCZTQSA-N 0 0 369.421 3.569 20 5 FHBDRN O=C(COc1cccc([N+](=O)[O-])c1)NCCc1cccc(Cl)c1Cl ZINC000501008358 942255299 /nfs/dbraw/zinc/25/52/99/942255299.db2.gz RJGCPGXEQSCGEQ-UHFFFAOYSA-N 0 0 369.204 3.639 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N(C)[C@@H]1CCCC[C@H]1c1ccccc1 ZINC000416008683 942259046 /nfs/dbraw/zinc/25/90/46/942259046.db2.gz MPKAYSHIHUOPMY-ZWKOTPCHSA-N 0 0 370.453 3.675 20 5 FHBDRN O=[N+]([O-])c1ccc2ccnc(NC3CCN(CC(F)(F)F)CC3)c2c1 ZINC000413079513 942260743 /nfs/dbraw/zinc/26/07/43/942260743.db2.gz CRFDXSMWGFZTSN-UHFFFAOYSA-N 0 0 354.332 3.582 20 5 FHBDRN CC(C)(C)OC(=O)CC[C@H]1CCCCN1C(=O)c1ccccc1[N+](=O)[O-] ZINC000416024783 942268299 /nfs/dbraw/zinc/26/82/99/942268299.db2.gz FNJNQUSUQIBZBX-CQSZACIVSA-N 0 0 362.426 3.711 20 5 FHBDRN CC(C)(C)OC(=O)CC[C@@H]1CCCCN1C(=O)c1ccccc1[N+](=O)[O-] ZINC000416024777 942268368 /nfs/dbraw/zinc/26/83/68/942268368.db2.gz FNJNQUSUQIBZBX-AWEZNQCLSA-N 0 0 362.426 3.711 20 5 FHBDRN CC(C)CC(=O)N1CCC(Nc2nccc3ccc([N+](=O)[O-])cc32)CC1 ZINC000413084601 942272821 /nfs/dbraw/zinc/27/28/21/942272821.db2.gz MDKCHZTYJPPNIX-UHFFFAOYSA-N 0 0 356.426 3.592 20 5 FHBDRN COc1cc(CSCc2nn(C)cc2Br)ccc1[N+](=O)[O-] ZINC000419477928 942273354 /nfs/dbraw/zinc/27/33/54/942273354.db2.gz LXYFRTCQXPXMLS-UHFFFAOYSA-N 0 0 372.244 3.533 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)C1(OC)CCC1 ZINC000416021524 942273946 /nfs/dbraw/zinc/27/39/46/942273946.db2.gz DLPAPMKFYKEANY-GFCCVEGCSA-N 0 0 352.456 3.784 20 5 FHBDRN C[C@H](c1ccc(-n2cncn2)cc1)N(C)Cc1c(F)cccc1[N+](=O)[O-] ZINC000103465314 942273987 /nfs/dbraw/zinc/27/39/87/942273987.db2.gz NWOJCBPDHVTREU-CYBMUJFWSA-N 0 0 355.373 3.508 20 5 FHBDRN C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCC[C@H](CC(F)(F)F)C1 ZINC000420955300 942274593 /nfs/dbraw/zinc/27/45/93/942274593.db2.gz WEWXKOZEMIEEIP-VXGBXAGGSA-N 0 0 359.348 3.586 20 5 FHBDRN O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CC[C@@H](C2CC2)C1 ZINC000481022339 942280642 /nfs/dbraw/zinc/28/06/42/942280642.db2.gz YTKVRGNZYXARAF-GFCCVEGCSA-N 0 0 371.359 3.674 20 5 FHBDRN CCCN(C[C@@H]1COc2ccccc2O1)C(=O)c1cc(C)cc([N+](=O)[O-])c1 ZINC000502206298 942282044 /nfs/dbraw/zinc/28/20/44/942282044.db2.gz FNIIADPZGXLKSY-QGZVFWFLSA-N 0 0 370.405 3.595 20 5 FHBDRN O=[N+]([O-])c1cnc(NC[C@@H]2CCN(c3ccccc3)C2)c(C(F)(F)F)c1 ZINC000413091470 942283649 /nfs/dbraw/zinc/28/36/49/942283649.db2.gz KMEACIZBRYPVIJ-LBPRGKRZSA-N 0 0 366.343 3.947 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CSc1nc2cc(Cl)cnc2[nH]1 ZINC000502204185 942289131 /nfs/dbraw/zinc/28/91/31/942289131.db2.gz RCUZRQLDWXHCKU-UHFFFAOYSA-N 0 0 350.787 3.820 20 5 FHBDRN CCOc1cc(C(=O)Nc2cccc(SC)c2)c([N+](=O)[O-])cc1OC ZINC000015629928 942290215 /nfs/dbraw/zinc/29/02/15/942290215.db2.gz DQAWPTWMOCZVOL-UHFFFAOYSA-N 0 0 362.407 3.976 20 5 FHBDRN O=[N+]([O-])c1ccc(NCc2ccccc2N2CCOCC2)c2cccnc21 ZINC000413102674 942291427 /nfs/dbraw/zinc/29/14/27/942291427.db2.gz VQOBIDQQOBCCMC-UHFFFAOYSA-N 0 0 364.405 3.592 20 5 FHBDRN CC(C)c1ccccc1NC(=O)[C@H](C)OC(=O)c1cccc([N+](=O)[O-])c1 ZINC000015644385 942291940 /nfs/dbraw/zinc/29/19/40/942291940.db2.gz WACJJRRUEJLOPI-ZDUSSCGKSA-N 0 0 356.378 3.902 20 5 FHBDRN CC(C)c1nnc(CSCc2cc([N+](=O)[O-])cc3c2OCOC3)s1 ZINC000419533213 942294293 /nfs/dbraw/zinc/29/42/93/942294293.db2.gz OVTMLNGMNKAADI-UHFFFAOYSA-N 0 0 367.452 3.870 20 5 FHBDRN CC[C@@H](c1ccncc1)N(CC)C(=O)c1cc(OC)c(C)c([N+](=O)[O-])c1 ZINC000187983932 942297924 /nfs/dbraw/zinc/29/79/24/942297924.db2.gz WMMQEPVSIQRLQK-INIZCTEOSA-N 0 0 357.410 3.920 20 5 FHBDRN C[C@H]1CCN(C)c2ccccc2N1C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000413511410 942299385 /nfs/dbraw/zinc/29/93/85/942299385.db2.gz WIKKRUOQFONTFT-JCGIZDLHSA-N 0 0 365.433 3.960 20 5 FHBDRN CC(C)(C)c1ccncc1CNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-] ZINC000413511913 942299677 /nfs/dbraw/zinc/29/96/77/942299677.db2.gz JXTUHCUPOMMGLD-UHFFFAOYSA-N 0 0 368.437 3.792 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC[C@@H](CC(F)(F)F)C1 ZINC000421026201 942300739 /nfs/dbraw/zinc/30/07/39/942300739.db2.gz FHGHYARJLKQADJ-JTQLQIEISA-N 0 0 361.320 3.800 20 5 FHBDRN CC(C)(CCNc1c(Cl)cc(Cl)cc1[N+](=O)[O-])S(C)(=O)=O ZINC000413524381 942300872 /nfs/dbraw/zinc/30/08/72/942300872.db2.gz VCEHINRKTBOYHG-UHFFFAOYSA-N 0 0 355.243 3.527 20 5 FHBDRN Cc1ccc(NC(=O)[C@H](C)OC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000015655030 942306740 /nfs/dbraw/zinc/30/67/40/942306740.db2.gz UZSYJZPPXQGYQD-USYSOWRXSA-N 0 0 368.389 3.795 20 5 FHBDRN Cc1ccc(C)c(S(=O)(=O)N(C)C[C@H](C)c2ccccc2)c1[N+](=O)[O-] ZINC000481060306 942308788 /nfs/dbraw/zinc/30/87/88/942308788.db2.gz NDEZIJKOVUDJMH-HNNXBMFYSA-N 0 0 362.451 3.636 20 5 FHBDRN O=C1CC[C@@H](CSCc2cc([N+](=O)[O-])ccc2C(F)(F)F)CCN1 ZINC000419548439 942309304 /nfs/dbraw/zinc/30/93/04/942309304.db2.gz SYGZSCYXRBCMKQ-SNVBAGLBSA-N 0 0 362.373 3.763 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CC[C@@H](Nc3ccccc3)C2)c(C(F)(F)F)c1 ZINC000413115479 942311139 /nfs/dbraw/zinc/31/11/39/942311139.db2.gz NRHBEXNJPRKSGH-GFCCVEGCSA-N 0 0 352.316 3.699 20 5 FHBDRN O=C(NC[C@@H]1CC12CC2)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000416064555 942311704 /nfs/dbraw/zinc/31/17/04/942311704.db2.gz GKUOSXNRYJFAKC-INIZCTEOSA-N 0 0 351.406 3.737 20 5 FHBDRN Cc1cc(OCC(=O)Nc2ccc(O)c(COC(C)C)c2)ccc1[N+](=O)[O-] ZINC000290630418 942321649 /nfs/dbraw/zinc/32/16/49/942321649.db2.gz PHIOCWVCZNPCIO-UHFFFAOYSA-N 0 0 374.393 3.551 20 5 FHBDRN CCc1nccn1[C@H]1CCCN(c2ccc([N+](=O)[O-])c3ncccc23)C1 ZINC000413130051 942325871 /nfs/dbraw/zinc/32/58/71/942325871.db2.gz QLCUGZKWGUUAJJ-AWEZNQCLSA-N 0 0 351.410 3.743 20 5 FHBDRN CC1(C)CN(C(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)[C@H]1[C@H]1CCCO1 ZINC000290646814 942330916 /nfs/dbraw/zinc/33/09/16/942330916.db2.gz QPBYKXCPDZAJOT-KGLIPLIRSA-N 0 0 372.343 3.643 20 5 FHBDRN Cc1ccc(NC(=O)[C@@H](C)OC(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1F ZINC000015699038 942331624 /nfs/dbraw/zinc/33/16/24/942331624.db2.gz RQGIXOHEGXPOMO-GFCCVEGCSA-N 0 0 360.341 3.535 20 5 FHBDRN CCC(=O)c1ccc(NCc2cccc(-c3nc[nH]n3)c2)c([N+](=O)[O-])c1 ZINC000366435311 942336059 /nfs/dbraw/zinc/33/60/59/942336059.db2.gz WRXLXDLCYYYZGC-UHFFFAOYSA-N 0 0 351.366 3.585 20 5 FHBDRN CCC(CC)[C@H]1C[C@@H](NC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)CCO1 ZINC000183224169 942336329 /nfs/dbraw/zinc/33/63/29/942336329.db2.gz UOFDYPBPNOCREF-SCLBCKFNSA-N 0 0 359.426 3.790 20 5 FHBDRN CC(C)NC(=O)[C@H]1CCC[C@H](Nc2ccc([N+](=O)[O-])c3ncccc23)C1 ZINC000413138994 942338147 /nfs/dbraw/zinc/33/81/47/942338147.db2.gz DKINHDMOHYDZQO-KBPBESRZSA-N 0 0 356.426 3.638 20 5 FHBDRN CC(C)[C@H]1N(c2ccc([N+](=O)[O-])c(OC(F)F)c2)CC12CCOCC2 ZINC000413542514 942340598 /nfs/dbraw/zinc/34/05/98/942340598.db2.gz FBCHCJVAJGUZJL-OAHLLOKOSA-N 0 0 356.369 3.838 20 5 FHBDRN CC[C@H]1CN(C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)C[C@H](CC)O1 ZINC000421092741 942342495 /nfs/dbraw/zinc/34/24/95/942342495.db2.gz NSSDOVOUKWOITR-RYUDHWBXSA-N 0 0 373.356 3.618 20 5 FHBDRN O=C(NCC1CCC(F)(F)CC1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000501192605 942345497 /nfs/dbraw/zinc/34/54/97/942345497.db2.gz AVCBXJWMAYYXBW-UHFFFAOYSA-N 0 0 364.295 3.752 20 5 FHBDRN CC(C)(O)COc1ccc(Nc2ncc([N+](=O)[O-])cc2C(F)(F)F)cc1 ZINC000413152527 942351743 /nfs/dbraw/zinc/35/17/43/942351743.db2.gz CUGXXPFBNNMWQE-UHFFFAOYSA-N 0 0 371.315 3.902 20 5 FHBDRN Cc1ccc(C(=O)N2CCN([C@H](C)c3cccc(F)c3)CC2)cc1[N+](=O)[O-] ZINC000103975292 942358084 /nfs/dbraw/zinc/35/80/84/942358084.db2.gz GEIYGXDGHGBDMP-OAHLLOKOSA-N 0 0 371.412 3.561 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N(C)[C@H](C)C2CCCCC2)c1F ZINC000412326297 942368294 /nfs/dbraw/zinc/36/82/94/942368294.db2.gz CGJDBZDPEVCCPP-GFCCVEGCSA-N 0 0 352.406 3.712 20 5 FHBDRN Cc1cc(NC(=O)N2CCC[C@@]3(C2)OCc2ccccc23)ccc1[N+](=O)[O-] ZINC000481129493 942368741 /nfs/dbraw/zinc/36/87/41/942368741.db2.gz XDHGFCDHWCNURQ-FQEVSTJZSA-N 0 0 367.405 3.957 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)NCC2CC(c3ccccc3)C2)c1F ZINC000412327465 942368921 /nfs/dbraw/zinc/36/89/21/942368921.db2.gz CMPURQHOOFVXCU-UHFFFAOYSA-N 0 0 372.396 3.595 20 5 FHBDRN Cc1nn(Cc2cn(-c3ccc(Cl)cc3)nn2)c2ccc([N+](=O)[O-])cc12 ZINC000501263542 942369890 /nfs/dbraw/zinc/36/98/90/942369890.db2.gz SKBSNFDMIBYRBK-UHFFFAOYSA-N 0 0 368.784 3.535 20 5 FHBDRN CC(C)c1nc(Oc2ccc([N+](=O)[O-])c3ccccc23)nc(N(C)C)n1 ZINC000502341656 942370429 /nfs/dbraw/zinc/37/04/29/942370429.db2.gz OWWXEAPBTAEIMQ-UHFFFAOYSA-N 0 0 353.382 3.915 20 5 FHBDRN O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CC[C@@H](Oc2ccccc2Cl)C1 ZINC000502345122 942372195 /nfs/dbraw/zinc/37/21/95/942372195.db2.gz XSXSGQMFBAVSHO-CQSZACIVSA-N 0 0 364.760 3.681 20 5 FHBDRN CNc1ccc(C(=O)N2CC=C(c3ccc(C)cc3)CC2)cc1[N+](=O)[O-] ZINC000016275754 942372860 /nfs/dbraw/zinc/37/28/60/942372860.db2.gz MIWPGXNUZPELBB-UHFFFAOYSA-N 0 0 351.406 3.874 20 5 FHBDRN Cc1c(NC(=O)C(=O)N[C@@H](C)c2ccc(C3CC3)cc2)cccc1[N+](=O)[O-] ZINC000419793682 942381585 /nfs/dbraw/zinc/38/15/85/942381585.db2.gz JMWGEAAHIGMXHD-ZDUSSCGKSA-N 0 0 367.405 3.597 20 5 FHBDRN CC(=O)c1csc(C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)c1 ZINC000501292517 942381959 /nfs/dbraw/zinc/38/19/59/942381959.db2.gz PVZXDKALCIYRLY-UHFFFAOYSA-N 0 0 369.196 3.874 20 5 FHBDRN CCc1nc2c(s1)[C@H](N(C)C(=O)c1cccc([N+](=O)[O-])c1F)CCC2 ZINC000366801240 942383580 /nfs/dbraw/zinc/38/35/80/942383580.db2.gz DACRMEIQGBTYJF-CYBMUJFWSA-N 0 0 363.414 3.902 20 5 FHBDRN CCOc1cc(CN2CCC(c3noc(C4CC4)n3)CC2)ccc1[N+](=O)[O-] ZINC000366807219 942386046 /nfs/dbraw/zinc/38/60/46/942386046.db2.gz HLLKDPWNNGMIQY-UHFFFAOYSA-N 0 0 372.425 3.634 20 5 FHBDRN COc1ccc([C@H]2C[C@H](NC(=O)c3cccc(C)c3[N+](=O)[O-])C2)cc1F ZINC000501286618 942389437 /nfs/dbraw/zinc/38/94/37/942389437.db2.gz VFBCCJZCZIIEJF-HDJSIYSDSA-N 0 0 358.369 3.727 20 5 FHBDRN CC(C)(CNc1ncc(Br)cc1[N+](=O)[O-])c1cccnc1 ZINC000413586444 942392812 /nfs/dbraw/zinc/39/28/12/942392812.db2.gz LNXIQHOSGKTHRO-UHFFFAOYSA-N 0 0 351.204 3.537 20 5 FHBDRN Cc1cc(NC(=O)C(=O)N[C@@H](C)c2ccc(C3CC3)cc2)ccc1[N+](=O)[O-] ZINC000419822042 942398251 /nfs/dbraw/zinc/39/82/51/942398251.db2.gz WJSMDYKKITXXFG-ZDUSSCGKSA-N 0 0 367.405 3.597 20 5 FHBDRN Cc1[nH]c2ccccc2c1C(=O)O[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000016295936 942398380 /nfs/dbraw/zinc/39/83/80/942398380.db2.gz RDVLGHQWDHYEFQ-GFCCVEGCSA-N 0 0 367.361 3.569 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCC(OC[C@H]3CCCCO3)CC2)c2cccnc21 ZINC000413176055 942406980 /nfs/dbraw/zinc/40/69/80/942406980.db2.gz KJDJKJRITAVRRJ-MRXNPFEDSA-N 0 0 371.437 3.698 20 5 FHBDRN C[C@H](Nc1ccc(C(=O)NC2CC(C)(F)C2)cc1[N+](=O)[O-])c1ccccn1 ZINC000452281055 942407802 /nfs/dbraw/zinc/40/78/02/942407802.db2.gz SESPWKGWBYNANS-YXZFSOQLSA-N 0 0 372.400 3.783 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])c2ncccc12)c1cnccc1C(F)(F)F ZINC001268853877 942414948 /nfs/dbraw/zinc/41/49/48/942414948.db2.gz MJQCMEJQBQLCHQ-UHFFFAOYSA-N 0 0 362.267 3.809 20 5 FHBDRN COc1ccccc1C(F)(F)C(=O)Nc1ccc([N+](=O)[O-])c2ncccc12 ZINC001268853906 942415198 /nfs/dbraw/zinc/41/51/98/942415198.db2.gz NRGGBTWUJBPJFJ-UHFFFAOYSA-N 0 0 373.315 3.882 20 5 FHBDRN Cc1cc(NC(=O)Cc2ccc(Cl)cc2)c2cc([N+](=O)[O-])ccc2n1 ZINC001268854271 942416304 /nfs/dbraw/zinc/41/63/04/942416304.db2.gz URRFULPGFQJFRA-UHFFFAOYSA-N 0 0 355.781 3.708 20 5 FHBDRN CC(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)OCc1ccccc1[N+](=O)[O-] ZINC000202114807 942424110 /nfs/dbraw/zinc/42/41/10/942424110.db2.gz ZUHZMDRYEVJQCO-AWEZNQCLSA-N 0 0 366.414 3.577 20 5 FHBDRN C[C@@H]1CCCN(c2ccc(C(=O)NCC3(C4CC4)CC3)cc2[N+](=O)[O-])C1 ZINC000501350583 942425861 /nfs/dbraw/zinc/42/58/61/942425861.db2.gz MGEZZPMCVGFJTB-CQSZACIVSA-N 0 0 357.454 3.751 20 5 FHBDRN CC(C)(C)O[C@@H]1C[C@H](Nc2nc3ccc([N+](=O)[O-])cc3c(=O)[nH]2)C1(C)C ZINC000413616658 942441233 /nfs/dbraw/zinc/44/12/33/942441233.db2.gz SIXPWNJFWYIMKA-UONOGXRCSA-N 0 0 360.414 3.638 20 5 FHBDRN Cc1n[nH]c(C(=O)N2CCCC[C@H]2CCCc2ccccc2)c1[N+](=O)[O-] ZINC000502428173 942441621 /nfs/dbraw/zinc/44/16/21/942441621.db2.gz CNQXKGBZZQBJBI-INIZCTEOSA-N 0 0 356.426 3.644 20 5 FHBDRN CN(CC(=O)Nc1ccc2c(c1)CCC2)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000016312907 942442998 /nfs/dbraw/zinc/44/29/98/942442998.db2.gz FKKBKWVOHCBGSY-UHFFFAOYSA-N 0 0 373.840 3.807 20 5 FHBDRN CCSc1cccc(NS(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000505282339 942443284 /nfs/dbraw/zinc/44/32/84/942443284.db2.gz YLQHKBUOTFSUSO-UHFFFAOYSA-N 0 0 352.437 3.816 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1-c1nc(C[C@H]2COc3ccccc3O2)no1 ZINC000421260032 942448549 /nfs/dbraw/zinc/44/85/49/942448549.db2.gz IQLDUUNQTUSGMR-ZDUSSCGKSA-N 0 0 367.361 3.644 20 5 FHBDRN CC(=O)c1ccc2c(c1)CCN(C(=O)Nc1cccc([N+](=O)[O-])c1C)CC2 ZINC000366851588 942452039 /nfs/dbraw/zinc/45/20/39/942452039.db2.gz DPIZDIMSICXYRI-UHFFFAOYSA-N 0 0 367.405 3.739 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1-c1nc(-c2cccnc2N2CCCC2)no1 ZINC000421243726 942452985 /nfs/dbraw/zinc/45/29/85/942452985.db2.gz IIUNDANVXXGLSK-UHFFFAOYSA-N 0 0 365.393 3.924 20 5 FHBDRN Cc1cc(C(=O)NCc2ccc(OC3CCCC3)nc2)ccc1[N+](=O)[O-] ZINC000501385804 942454165 /nfs/dbraw/zinc/45/41/65/942454165.db2.gz FPVXYJZOIJZNKT-UHFFFAOYSA-N 0 0 355.394 3.550 20 5 FHBDRN O=C(NCCNc1ccc([N+](=O)[O-])cc1)c1cc(Cl)sc1Cl ZINC000015835237 942454355 /nfs/dbraw/zinc/45/43/55/942454355.db2.gz QGUNEMBRQZUCML-UHFFFAOYSA-N 0 0 360.222 3.805 20 5 FHBDRN Cc1cccc2nc(CNc3ncc([N+](=O)[O-])cc3C(F)(F)F)n(C)c21 ZINC000413192025 942459022 /nfs/dbraw/zinc/45/90/22/942459022.db2.gz MKZFJOJXYFUYCE-UHFFFAOYSA-N 0 0 365.315 3.816 20 5 FHBDRN Cc1cccc([C@@H]2NC(=O)N([C@@H](C)c3ccc([N+](=O)[O-])cc3)C2=O)c1C ZINC000419957386 942459252 /nfs/dbraw/zinc/45/92/52/942459252.db2.gz BOKRSZSUFLZNBU-GUYCJALGSA-N 0 0 353.378 3.566 20 5 FHBDRN Cc1ccc2c(C(=O)N3CCC(n4ccc([N+](=O)[O-])n4)CC3)csc2c1 ZINC000366856325 942459300 /nfs/dbraw/zinc/45/93/00/942459300.db2.gz HRJPAPYQDCSZTC-UHFFFAOYSA-N 0 0 370.434 3.792 20 5 FHBDRN CCc1cc(=O)c2cc(NC(=O)c3ccc(CC)c([N+](=O)[O-])c3)ccc2[nH]1 ZINC000180994153 942464909 /nfs/dbraw/zinc/46/49/09/942464909.db2.gz VZCHUNMZJQKJRG-UHFFFAOYSA-N 0 0 365.389 3.813 20 5 FHBDRN C[C@@H](c1ccc([N+](=O)[O-])cc1)N1C(=O)[C@H]2C[C@H](C3CCCCC3)CN2C1=O ZINC000419968463 942471716 /nfs/dbraw/zinc/47/17/16/942471716.db2.gz PZFMEINPFVIYSH-QANKJYHBSA-N 0 0 371.437 3.889 20 5 FHBDRN CCO[C@@H](C(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1)c1ccccc1 ZINC000413660640 942474085 /nfs/dbraw/zinc/47/40/85/942474085.db2.gz WHMQCQHUYCDTRU-LJQANCHMSA-N 0 0 354.406 3.864 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCO[C@@]3(CCc4ccccc43)C2)c2cccnc21 ZINC000413204264 942477256 /nfs/dbraw/zinc/47/72/56/942477256.db2.gz OQEGFAMRUWHBDO-NRFANRHFSA-N 0 0 361.401 3.821 20 5 FHBDRN CCO[C@@H](C(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1)c1ccccc1 ZINC000413667277 942493233 /nfs/dbraw/zinc/49/32/33/942493233.db2.gz HVZUBVOVXFIAQM-LJQANCHMSA-N 0 0 354.406 3.864 20 5 FHBDRN CN(CC(=O)N1CCC[C@@H]1/C=C/c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000505350421 942495325 /nfs/dbraw/zinc/49/53/25/942495325.db2.gz GOKRWCYZMRVWQE-KAUXGEHWSA-N 0 0 365.433 3.735 20 5 FHBDRN CN(CC(=O)N1CCC[C@H]1/C=C/c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000505350419 942495343 /nfs/dbraw/zinc/49/53/43/942495343.db2.gz GOKRWCYZMRVWQE-JKGDOXCYSA-N 0 0 365.433 3.735 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N1CCC[C@H]1/C=C\c1ccccc1 ZINC000505367217 942505109 /nfs/dbraw/zinc/50/51/09/942505109.db2.gz UCRAAHFRZNGJBO-JJEJIETFSA-N 0 0 352.390 3.678 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)NCCCCC(C)(C)C)cc1OC ZINC000104440206 942510702 /nfs/dbraw/zinc/51/07/02/942510702.db2.gz XGYFVHCEAYWZHG-UHFFFAOYSA-N 0 0 352.431 3.948 20 5 FHBDRN COc1ccc(Cl)cc1C(C)(C)NC(=O)c1cc([N+](=O)[O-])cnc1C ZINC000425034997 942512141 /nfs/dbraw/zinc/51/21/41/942512141.db2.gz HVABZYNEQWEXIG-UHFFFAOYSA-N 0 0 363.801 3.625 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@H]1/C=C/c1ccccc1 ZINC000505380864 942513630 /nfs/dbraw/zinc/51/36/30/942513630.db2.gz UYRPMTHCEBVTFI-SCOAYWHSSA-N 0 0 352.390 3.921 20 5 FHBDRN Cc1sc(C(=O)N2CCC[C@@H](C)[C@H]2C(=O)OC(C)(C)C)cc1[N+](=O)[O-] ZINC000425037823 942514570 /nfs/dbraw/zinc/51/45/70/942514570.db2.gz KXTJLAHBRUXBMD-YGRLFVJLSA-N 0 0 368.455 3.547 20 5 FHBDRN O=[N+]([O-])c1cnc(N[C@@H]2CCO[C@@H]2c2ccc(Cl)c(F)c2)c(F)c1 ZINC000413228781 942515914 /nfs/dbraw/zinc/51/59/14/942515914.db2.gz QHRFQIZLYLPOPC-ZIAGYGMSSA-N 0 0 355.728 3.864 20 5 FHBDRN CN(C(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)c1ccc2cc[nH]c2c1 ZINC000473545725 942529802 /nfs/dbraw/zinc/52/98/02/942529802.db2.gz QGTUGAVNAQEZJK-UHFFFAOYSA-N 0 0 362.345 3.607 20 5 FHBDRN Cn1c(Sc2ncc([N+](=O)[O-])cc2C(F)(F)F)nnc1C1CCC1 ZINC000413240627 942532346 /nfs/dbraw/zinc/53/23/46/942532346.db2.gz JUBKBLNOXSSKAT-UHFFFAOYSA-N 0 0 359.333 3.556 20 5 FHBDRN CC[C@@H](CNC(=O)N(C)CCc1cccc([N+](=O)[O-])c1)CC(F)(F)F ZINC000413740349 942541874 /nfs/dbraw/zinc/54/18/74/942541874.db2.gz NGZVCIAFLWOQIP-GFCCVEGCSA-N 0 0 361.364 3.757 20 5 FHBDRN COc1cc(CN2CCC[C@@H](CC(F)(F)F)C2)c([N+](=O)[O-])cc1OC ZINC000421395745 942546279 /nfs/dbraw/zinc/54/62/79/942546279.db2.gz VFLXIBAXECDADX-NSHDSACASA-N 0 0 362.348 3.776 20 5 FHBDRN 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942552381 /nfs/dbraw/zinc/55/23/81/942552381.db2.gz KWLQWUSGBBVOKO-OAQYLSRUSA-N 0 0 368.433 3.845 20 5 FHBDRN CS[C@@H](CNC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)C(C)(C)C ZINC000541279556 942554091 /nfs/dbraw/zinc/55/40/91/942554091.db2.gz XTOAZXFYJMGIJL-INIZCTEOSA-N 0 0 365.499 3.703 20 5 FHBDRN Cc1ccc(-c2ncc[nH]2)cc1NC(=O)Cc1cccc([N+](=O)[O-])c1C ZINC000366539302 942555167 /nfs/dbraw/zinc/55/51/67/942555167.db2.gz BYMWWQUTMOYYBE-UHFFFAOYSA-N 0 0 350.378 3.783 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)NCc1cc(F)c(Cl)cc1F ZINC000434263397 942560157 /nfs/dbraw/zinc/56/01/57/942560157.db2.gz GQHQDFQDKVQEDX-UHFFFAOYSA-N 0 0 369.755 3.568 20 5 FHBDRN COc1ccc(OCCSc2nc3nc(C)ccc3o2)c([N+](=O)[O-])c1 ZINC000541288368 942568230 /nfs/dbraw/zinc/56/82/30/942568230.db2.gz MFJLCNFBLCHQMX-UHFFFAOYSA-N 0 0 361.379 3.619 20 5 FHBDRN CC[C@H]1C[C@@]1(NC(=O)c1cc(OC)ccc1[N+](=O)[O-])c1cccc(C)c1 ZINC000501595346 942568871 /nfs/dbraw/zinc/56/88/71/942568871.db2.gz SFERKPVBPHWMMW-XOBRGWDASA-N 0 0 354.406 3.967 20 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942585064 /nfs/dbraw/zinc/58/50/64/942585064.db2.gz MOEBIQZAHAUIGY-OAHLLOKOSA-N 0 0 368.368 3.725 20 5 FHBDRN O=[N+]([O-])c1ccc2ccnc(NC[C@@]3(CO)C[C@@H]3c3ccc(F)cc3)c2c1 ZINC000413268112 942585576 /nfs/dbraw/zinc/58/55/76/942585576.db2.gz RLRGDEXREPCNMJ-UYAOXDASSA-N 0 0 367.380 3.860 20 5 FHBDRN CC(=O)Nc1c2cccc(C)c2n(C)c1OCc1ccc([N+](=O)[O-])cc1 ZINC000502624268 942589124 /nfs/dbraw/zinc/58/91/24/942589124.db2.gz WNRNDLFOZNXGOJ-UHFFFAOYSA-N 0 0 353.378 3.932 20 5 FHBDRN CCCCOc1cccc(NCC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])c1 ZINC000063462527 942592077 /nfs/dbraw/zinc/59/20/77/942592077.db2.gz RYGGJJDPXXWFLD-UHFFFAOYSA-N 0 0 373.409 3.833 20 5 FHBDRN CC1(C)[C@H](Nc2ccc(Br)cc2[N+](=O)[O-])[C@H]2CCCO[C@@H]21 ZINC000085674014 942593561 /nfs/dbraw/zinc/59/35/61/942593561.db2.gz APASAMXNJUIBRI-HONMWMINSA-N 0 0 355.232 3.973 20 5 FHBDRN COc1cc(C(=O)NC[C@]2(C)C[C@H]2c2ccccc2)cc([N+](=O)[O-])c1OC ZINC000501681322 942596847 /nfs/dbraw/zinc/59/68/47/942596847.db2.gz IETOGSKRGKHTIG-YWZLYKJASA-N 0 0 370.405 3.536 20 5 FHBDRN CCOC(=O)CN(C(=O)c1ccc([N+](=O)[O-])cc1C)[C@@H](C)c1ccccc1 ZINC000513912052 942603960 /nfs/dbraw/zinc/60/39/60/942603960.db2.gz YCHWSFJHVNCQDG-HNNXBMFYSA-N 0 0 370.405 3.670 20 5 FHBDRN CCOC(=O)CN(C(=O)c1ccc(C)c([N+](=O)[O-])c1)[C@H](C)c1ccccc1 ZINC000513917798 942606746 /nfs/dbraw/zinc/60/67/46/942606746.db2.gz BBZQZWJQRGFOEH-OAHLLOKOSA-N 0 0 370.405 3.670 20 5 FHBDRN CCOC(=O)CN(C(=O)c1cc(C)ccc1[N+](=O)[O-])[C@@H](C)c1ccccc1 ZINC000513918845 942607502 /nfs/dbraw/zinc/60/75/02/942607502.db2.gz PUCRVWOCNDJQSU-HNNXBMFYSA-N 0 0 370.405 3.670 20 5 FHBDRN C[C@@]1(CNC(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)C[C@H]1c1ccccc1 ZINC000501685635 942610193 /nfs/dbraw/zinc/61/01/93/942610193.db2.gz DFTYABFYQMSNDZ-KXBFYZLASA-N 0 0 360.360 3.726 20 5 FHBDRN O=C(NCCc1ccc(OC(F)(F)F)cc1)Nc1ccc([N+](=O)[O-])cc1 ZINC000502645170 942612552 /nfs/dbraw/zinc/61/25/52/942612552.db2.gz VMJMTVOCPIPGQJ-UHFFFAOYSA-N 0 0 369.299 3.858 20 5 FHBDRN O=[N+]([O-])c1ccc2ccnc(NCc3cccc(N4CCOCC4)c3)c2c1 ZINC000413298897 942615892 /nfs/dbraw/zinc/61/58/92/942615892.db2.gz NOHXIIXOQJGLSN-UHFFFAOYSA-N 0 0 364.405 3.592 20 5 FHBDRN COc1ccc([C@H](OC)[C@@H](C)NC(=O)c2cc([N+](=O)[O-])c(C)cc2C)cc1 ZINC000421514926 942620313 /nfs/dbraw/zinc/62/03/13/942620313.db2.gz RJQFJUXLQLBGJX-AUUYWEPGSA-N 0 0 372.421 3.726 20 5 FHBDRN Cc1nc([C@@H]2CCCCCN2C(=O)c2cc([N+](=O)[O-])c(C)cc2C)no1 ZINC000421520618 942625952 /nfs/dbraw/zinc/62/59/52/942625952.db2.gz XKPIAWWRJHXOHI-HNNXBMFYSA-N 0 0 358.398 3.661 20 5 FHBDRN O=C(NCc1ccc(Oc2cccc(F)c2)nc1)c1cccc([N+](=O)[O-])c1 ZINC000501718810 942626662 /nfs/dbraw/zinc/62/66/62/942626662.db2.gz KMXBAXMKDQSFOX-UHFFFAOYSA-N 0 0 367.336 3.851 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CC[C@@H](n2ncc3ccccc32)C1 ZINC000421521674 942626918 /nfs/dbraw/zinc/62/69/18/942626918.db2.gz YNFWIXPWOAEMQQ-MRXNPFEDSA-N 0 0 364.405 3.649 20 5 FHBDRN CCNc1ccc(C(=O)Nc2ccc(OC(F)F)cc2)cc1[N+](=O)[O-] ZINC000015993375 942629255 /nfs/dbraw/zinc/62/92/55/942629255.db2.gz MKMCMDDCSNFVMF-UHFFFAOYSA-N 0 0 351.309 3.880 20 5 FHBDRN COC(=O)c1cc(NC(=O)c2ccc(C(C)(C)C)cn2)c(C)c([N+](=O)[O-])c1 ZINC000421503125 942629686 /nfs/dbraw/zinc/62/96/86/942629686.db2.gz IGGGDVUOTQUOKZ-UHFFFAOYSA-N 0 0 371.393 3.635 20 5 FHBDRN Cc1nn(C(C)(C)C)cc1[C@H](C)NC(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC000421527835 942638579 /nfs/dbraw/zinc/63/85/79/942638579.db2.gz ZIFZPMCKVRWYGE-ZDUSSCGKSA-N 0 0 358.442 3.963 20 5 FHBDRN O=[N+]([O-])c1ccc2ccnc(N[C@H]3CCO[C@H](c4ccncc4)C3)c2c1 ZINC000413309535 942642774 /nfs/dbraw/zinc/64/27/74/942642774.db2.gz BORTWIIMIZWTIJ-YJBOKZPZSA-N 0 0 350.378 3.870 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CC2(CCC2)[C@H]1[C@H]1CCCO1 ZINC000365778544 942661108 /nfs/dbraw/zinc/66/11/08/942661108.db2.gz ANLMEKYHGRIVEL-BHIYHBOVSA-N 0 0 372.465 3.724 20 5 FHBDRN O=[N+]([O-])c1ccc(N[C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)c(Br)c1 ZINC000513983390 942662504 /nfs/dbraw/zinc/66/25/04/942662504.db2.gz OPFSKICKWVGYLM-GDLCADMTSA-N 0 0 353.216 3.727 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N[C@H](c1nccs1)C(F)(F)F ZINC000421572426 942664204 /nfs/dbraw/zinc/66/42/04/942664204.db2.gz CUVCOEGVXJTLOM-LLVKDONJSA-N 0 0 359.329 3.702 20 5 FHBDRN CC1(C)C[C@H](NC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)C(C)(C)O1 ZINC000183603846 942669544 /nfs/dbraw/zinc/66/95/44/942669544.db2.gz TYAITUNQZYBOFS-INIZCTEOSA-N 0 0 361.442 3.615 20 5 FHBDRN COc1cccc2c1CCCN2C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412367135 942671724 /nfs/dbraw/zinc/67/17/24/942671724.db2.gz SJYIGZCWPWFGAP-DLBZAZTESA-N 0 0 352.390 3.686 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H]1CC12CCSCC2 ZINC000421587209 942674960 /nfs/dbraw/zinc/67/49/60/942674960.db2.gz HIHOPGDDKUJBHE-HOTGVXAUSA-N 0 0 362.495 3.813 20 5 FHBDRN C[C@H]([C@@H]1Cc2ccccc2O1)N(C)C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000434435340 942676176 /nfs/dbraw/zinc/67/61/76/942676176.db2.gz SMKTXIHWKKVMEN-XIKOKIGWSA-N 0 0 365.389 3.540 20 5 FHBDRN O=[N+]([O-])c1cnccc1NCc1cn(-c2ccccc2)nc1-c1ccncc1 ZINC000066811331 942677037 /nfs/dbraw/zinc/67/70/37/942677037.db2.gz XOQNLNIYOZNWLR-UHFFFAOYSA-N 0 0 372.388 3.850 20 5 FHBDRN CCN(C(=O)Cc1c(F)c(OC)ccc1[N+](=O)[O-])[C@H]1CCCC[C@@H]1C ZINC000413335686 942684633 /nfs/dbraw/zinc/68/46/33/942684633.db2.gz LVRDQBQBLVIQKY-JSGCOSHPSA-N 0 0 352.406 3.712 20 5 FHBDRN O=C(NCCNc1ccccc1[N+](=O)[O-])N[C@H]1CCc2c1cccc2Cl ZINC000514029439 942685589 /nfs/dbraw/zinc/68/55/89/942685589.db2.gz RAKHZUIKPIYGCZ-HNNXBMFYSA-N 0 0 374.828 3.647 20 5 FHBDRN C[C@H]1C[C@H](c2noc(-c3ccnc(-c4ccccc4)c3[N+](=O)[O-])n2)CCO1 ZINC000420486805 942690501 /nfs/dbraw/zinc/69/05/01/942690501.db2.gz HJUASWVXTSDMPS-GXTWGEPZSA-N 0 0 366.377 3.989 20 5 FHBDRN Cc1nc([N+](=O)[O-])c(-c2noc([C@@H]3C[C@H]3c3ccc(Cl)cc3)n2)n1C ZINC000420490757 942695374 /nfs/dbraw/zinc/69/53/74/942695374.db2.gz DEACIIWLVMOFON-NWDGAFQWSA-N 0 0 359.773 3.611 20 5 FHBDRN Cc1ccc(NC(=O)c2cccc(Oc3c([N+](=O)[O-])ncn3C)c2)cc1 ZINC000066815778 942695486 /nfs/dbraw/zinc/69/54/86/942695486.db2.gz YKXPPLULXJBVLZ-UHFFFAOYSA-N 0 0 352.350 3.681 20 5 FHBDRN CC(C)(C)OCc1cc(-c2nc(-c3ccc([N+](=O)[O-])s3)no2)no1 ZINC000420491617 942696355 /nfs/dbraw/zinc/69/63/55/942696355.db2.gz GXKLXTPYVFWJTK-UHFFFAOYSA-N 0 0 350.356 3.676 20 5 FHBDRN O=C(N[C@H](c1ccccc1)[C@H]1CCOC1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000378387806 942699038 /nfs/dbraw/zinc/69/90/38/942699038.db2.gz LIXCBDCRTZRYAY-SUMWQHHRSA-N 0 0 360.797 3.756 20 5 FHBDRN CCn1c(-c2cccc([N+](=O)[O-])c2)nnc1N1CC[C@@]2(CC[C@@H](C)C2)C1 ZINC000549427709 942704359 /nfs/dbraw/zinc/70/43/59/942704359.db2.gz NRNRCWQCEUVRER-AUUYWEPGSA-N 0 0 355.442 3.890 20 5 FHBDRN O=[N+]([O-])c1ccccc1NCCc1noc([C@@H]2C[C@]2(F)c2ccccc2)n1 ZINC000420498656 942706015 /nfs/dbraw/zinc/70/60/15/942706015.db2.gz DGCAXUQYVDSWCN-LIRRHRJNSA-N 0 0 368.368 3.985 20 5 FHBDRN CN(C(=O)c1ccc(F)cc1[N+](=O)[O-])c1ccc(C(=O)NC(C)(C)C)cc1 ZINC000413876326 942706770 /nfs/dbraw/zinc/70/67/70/942706770.db2.gz DBCMPIGHOORIIL-UHFFFAOYSA-N 0 0 373.384 3.539 20 5 FHBDRN COc1ccc(NC(=O)Cc2c[nH]c3cccc(Cl)c23)c([N+](=O)[O-])c1 ZINC000501814012 942707693 /nfs/dbraw/zinc/70/76/93/942707693.db2.gz GRIXXWOPEDJSKL-UHFFFAOYSA-N 0 0 359.769 3.919 20 5 FHBDRN O=C(c1ccc(N2CCCC2)c([N+](=O)[O-])c1)N1CC[C@@H](C2CCCC2)C1 ZINC000421650391 942707807 /nfs/dbraw/zinc/70/78/07/942707807.db2.gz HCOOZENPMVHQKV-QGZVFWFLSA-N 0 0 357.454 3.847 20 5 FHBDRN COc1ccc(OCc2noc([C@@H]3C[C@H]3c3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000420478739 942707777 /nfs/dbraw/zinc/70/77/77/942707777.db2.gz DBFLBTWWKPMSNE-DLBZAZTESA-N 0 0 367.361 3.837 20 5 FHBDRN CC(C)CCOC1CCN(C(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)CC1 ZINC000501814593 942707934 /nfs/dbraw/zinc/70/79/34/942707934.db2.gz STZCXEZTQSIUFT-UHFFFAOYSA-N 0 0 373.453 3.603 20 5 FHBDRN O=[N+]([O-])c1ccccc1NCCc1noc([C@@H]2CCc3ccccc3O2)n1 ZINC000420507259 942709561 /nfs/dbraw/zinc/70/95/61/942709561.db2.gz VUQRCHSBPQOHTA-KRWDZBQOSA-N 0 0 366.377 3.699 20 5 FHBDRN Cn1nc([N+](=O)[O-])cc1-c1nc([C@H]2CCC(C)(C)c3ccccc32)no1 ZINC000420508422 942711021 /nfs/dbraw/zinc/71/10/21/942711021.db2.gz CBPJTNVTLODDFI-LBPRGKRZSA-N 0 0 353.382 3.582 20 5 FHBDRN CC[C@@H]1C[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2SC(C)C)CCO1 ZINC000421673025 942736801 /nfs/dbraw/zinc/73/68/01/942736801.db2.gz WHPMVUAFCUSIEC-TZMCWYRMSA-N 0 0 352.456 3.783 20 5 FHBDRN O=[N+]([O-])c1cc(F)c(N[C@@H](CO)c2ccc(Br)cc2)c(F)c1 ZINC000502788458 942742185 /nfs/dbraw/zinc/74/21/85/942742185.db2.gz FJOHIDLFQLRCQM-ZDUSSCGKSA-N 0 0 373.153 3.781 20 5 FHBDRN O=[N+]([O-])c1ccc(N[C@@H](CO)c2ccc(Br)cc2)c(F)c1 ZINC000502792593 942745971 /nfs/dbraw/zinc/74/59/71/942745971.db2.gz HUZTYNBIQAESKC-AWEZNQCLSA-N 0 0 355.163 3.642 20 5 FHBDRN CN(C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)C1CC(OC(C)(C)C)C1 ZINC000421694402 942750186 /nfs/dbraw/zinc/75/01/86/942750186.db2.gz QWCBGCYOBRPRRG-UHFFFAOYSA-N 0 0 361.442 3.587 20 5 FHBDRN CC(C)Oc1ccc(Br)cc1NC(=O)c1ccc([N+](=O)[O-])[nH]1 ZINC000434553138 942752125 /nfs/dbraw/zinc/75/21/25/942752125.db2.gz FCPIJQQYMLLPDL-UHFFFAOYSA-N 0 0 368.187 3.725 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CCCC[C@H]1Cc1ccccc1 ZINC000110268721 942753995 /nfs/dbraw/zinc/75/39/95/942753995.db2.gz JSNPJDWMNZCDCU-KRWDZBQOSA-N 0 0 374.462 3.689 20 5 FHBDRN COc1cccc([C@@H]2C[C@H](O)CN2Cc2c(Cl)cccc2[N+](=O)[O-])c1 ZINC000502806426 942760162 /nfs/dbraw/zinc/76/01/62/942760162.db2.gz YPDUQJJCWMZZFT-UGSOOPFHSA-N 0 0 362.813 3.565 20 5 FHBDRN COc1cccc([C@H]2C[C@@H](O)CN2Cc2c(Cl)cccc2[N+](=O)[O-])c1 ZINC000502806424 942760317 /nfs/dbraw/zinc/76/03/17/942760317.db2.gz YPDUQJJCWMZZFT-FZKQIMNGSA-N 0 0 362.813 3.565 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])N[C@@H](CC(F)F)c1ccccc1 ZINC000421700598 942772425 /nfs/dbraw/zinc/77/24/25/942772425.db2.gz QYTLROFETSYXKW-AWEZNQCLSA-N 0 0 364.348 3.876 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)Nc1ccc(NC(=O)NC(C)C)cc1 ZINC000421739849 942774570 /nfs/dbraw/zinc/77/45/70/942774570.db2.gz FLGPGTNYPBLJOV-UHFFFAOYSA-N 0 0 370.409 3.994 20 5 FHBDRN O=C(c1ccc(OC2CCCC2)nc1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000514165067 942784208 /nfs/dbraw/zinc/78/42/08/942784208.db2.gz OYKGZQJSMARAMY-UHFFFAOYSA-N 0 0 353.378 3.514 20 5 FHBDRN CCn1c(SCc2cnc(C)nc2)nc2cc3ccccc3cc2c1=O ZINC000505443117 942784485 /nfs/dbraw/zinc/78/44/85/942784485.db2.gz CHRNWHZCHFAMTI-UHFFFAOYSA-N 0 0 362.458 3.960 20 5 FHBDRN O=C(c1ccc(NC2CC2)c([N+](=O)[O-])c1)N1CCc2cc(F)c(F)cc21 ZINC000514166059 942784735 /nfs/dbraw/zinc/78/47/35/942784735.db2.gz YYCMECLOHAODQW-UHFFFAOYSA-N 0 0 359.332 3.650 20 5 FHBDRN Cc1nc2ccccc2n1CCCNC(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC000421744759 942792407 /nfs/dbraw/zinc/79/24/07/942792407.db2.gz PYCWKHXOLRWGNP-UHFFFAOYSA-N 0 0 366.421 3.690 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCN(c2ccc(F)cc2)C1 ZINC000421749207 942794565 /nfs/dbraw/zinc/79/45/65/942794565.db2.gz PGJPLSUCYIDYRJ-HNNXBMFYSA-N 0 0 371.412 3.607 20 5 FHBDRN O=C(COc1cccc([N+](=O)[O-])c1)N1CC[C@H](C(F)(F)F)C2(CCC2)C1 ZINC000514185859 942794650 /nfs/dbraw/zinc/79/46/50/942794650.db2.gz FXYLWYBZUUCVQY-AWEZNQCLSA-N 0 0 372.343 3.555 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1C[C@@H](c2ccccc2)O[C@@H](C)C1 ZINC000421749941 942795800 /nfs/dbraw/zinc/79/58/00/942795800.db2.gz SHLDMIFASLTKMZ-KXBFYZLASA-N 0 0 354.406 3.814 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)CCC(=O)c2cccc(F)c2)cc1[N+](=O)[O-] ZINC000502851357 942796539 /nfs/dbraw/zinc/79/65/39/942796539.db2.gz KOMINJBLWLFJMO-CYBMUJFWSA-N 0 0 358.369 3.883 20 5 FHBDRN COc1ccc(OC(=O)c2ccc(OC(F)(F)F)cc2)cc1[N+](=O)[O-] ZINC001269175796 942804890 /nfs/dbraw/zinc/80/48/90/942804890.db2.gz NNAHNQNQPRSOSI-UHFFFAOYSA-N 0 0 357.240 3.721 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCC[C@H]1CC(=O)c1ccco1 ZINC000421786316 942806060 /nfs/dbraw/zinc/80/60/60/942806060.db2.gz MRWWGHQMGAJCKC-AWEZNQCLSA-N 0 0 356.378 3.682 20 5 FHBDRN C[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514195697 942807112 /nfs/dbraw/zinc/80/71/12/942807112.db2.gz SJCRGTNNBORIIH-NQBHXWOUSA-N 0 0 354.353 3.989 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N[C@@H](C)CC(=O)c1ccc(F)cc1 ZINC000421782983 942807946 /nfs/dbraw/zinc/80/79/46/942807946.db2.gz FHKWWPTZKAVWTB-ZDUSSCGKSA-N 0 0 358.369 3.742 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1C[C@@H](c2ccc(F)cc2)O[C@@H](C)C1 ZINC000421774164 942816418 /nfs/dbraw/zinc/81/64/18/942816418.db2.gz LBNGDYMWVXDXPW-LIRRHRJNSA-N 0 0 372.396 3.953 20 5 FHBDRN O=C(NC1CCC2(CCOCC2)CC1)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000378482339 942817071 /nfs/dbraw/zinc/81/70/71/942817071.db2.gz FUTFGAQPHWCKGK-UHFFFAOYSA-N 0 0 368.380 3.542 20 5 FHBDRN C[C@@H](Oc1ccc(Oc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1)C(N)=O ZINC000514191912 942818050 /nfs/dbraw/zinc/81/80/50/942818050.db2.gz DMWDYDIQZGVEEP-SECBINFHSA-N 0 0 370.283 3.659 20 5 FHBDRN CNc1c(C(=O)N2CC[C@@H](C(F)(F)F)C3(CCC3)C2)cccc1[N+](=O)[O-] ZINC000514191292 942818119 /nfs/dbraw/zinc/81/81/19/942818119.db2.gz XENYYBUETKVPGJ-CYBMUJFWSA-N 0 0 371.359 3.831 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NCC1(c2ccncc2)CCCC1 ZINC000421797516 942819361 /nfs/dbraw/zinc/81/93/61/942819361.db2.gz TYIXJIKHTFQZLB-UHFFFAOYSA-N 0 0 353.422 3.848 20 5 FHBDRN CO[C@](C)([C@H](C)NC(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-])C1CC1 ZINC000413958003 942819930 /nfs/dbraw/zinc/81/99/30/942819930.db2.gz OBVXAFQVCXOIIJ-RNODOKPDSA-N 0 0 369.421 3.590 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N(Cc1ccccc1)CC(C)(C)O ZINC000421794781 942830046 /nfs/dbraw/zinc/83/00/46/942830046.db2.gz DMLKQNSMTNJCCJ-UHFFFAOYSA-N 0 0 356.422 3.625 20 5 FHBDRN COc1ccc(C(=O)NCc2ccccc2OC2CCCC2)cc1[N+](=O)[O-] ZINC000502906448 942830744 /nfs/dbraw/zinc/83/07/44/942830744.db2.gz HLPGEVRULAYKCF-UHFFFAOYSA-N 0 0 370.405 3.855 20 5 FHBDRN Cc1cc(N2CCN(C(=O)CCCc3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000514222934 942834214 /nfs/dbraw/zinc/83/42/14/942834214.db2.gz RYRKMBAZLVDNKY-UHFFFAOYSA-N 0 0 367.449 3.575 20 5 FHBDRN Cc1cc(F)cc2c1CN([C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C)CC2 ZINC000502910037 942834631 /nfs/dbraw/zinc/83/46/31/942834631.db2.gz UMEMHQUGFGJQKH-AWEZNQCLSA-N 0 0 371.412 3.736 20 5 FHBDRN Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)N1CCC[C@@H](c2nccs2)C1 ZINC000367092912 942839521 /nfs/dbraw/zinc/83/95/21/942839521.db2.gz QRFIBALWNYLSJH-LLVKDONJSA-N 0 0 364.402 3.910 20 5 FHBDRN CO[C@@](C)([C@@H](C)NC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-])C1CC1 ZINC000413965510 942839663 /nfs/dbraw/zinc/83/96/63/942839663.db2.gz XIORNNKUYFRVFS-HWPZZCPQSA-N 0 0 372.874 3.660 20 5 FHBDRN O=C(N[C@@H]1C[C@H]1c1cccc(F)c1)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000067333952 942840330 /nfs/dbraw/zinc/84/03/30/942840330.db2.gz NWSGGLWPGWZQEK-FUHWJXTLSA-N 0 0 369.396 3.620 20 5 FHBDRN CC1(C)CN(C(=O)CNc2ccccc2[N+](=O)[O-])C[C@@H]1c1ccccc1 ZINC000434661027 942844248 /nfs/dbraw/zinc/84/42/48/942844248.db2.gz CDPPCPYMMIBGDE-MRXNPFEDSA-N 0 0 353.422 3.659 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)NCC1(c2ccc(F)cc2)CCC1 ZINC000502925595 942845934 /nfs/dbraw/zinc/84/59/34/942845934.db2.gz NMJNQQHWLALVKD-UHFFFAOYSA-N 0 0 373.384 3.986 20 5 FHBDRN CSc1ccc(C(=O)N[C@@H]2CCOc3c(C)cccc32)cc1[N+](=O)[O-] ZINC000190168282 942848555 /nfs/dbraw/zinc/84/85/55/942848555.db2.gz NIWUIZFCPRSXRZ-CQSZACIVSA-N 0 0 358.419 3.879 20 5 FHBDRN COc1ccc(OCC(=O)Nc2ccccc2C(F)(F)F)cc1[N+](=O)[O-] ZINC000190197281 942853675 /nfs/dbraw/zinc/85/36/75/942853675.db2.gz KUMZODIMGNTQIR-UHFFFAOYSA-N 0 0 370.283 3.640 20 5 FHBDRN COc1ccc(OCC(=O)N[C@H](C)c2ccccc2Cl)cc1[N+](=O)[O-] ZINC000190198643 942854195 /nfs/dbraw/zinc/85/41/95/942854195.db2.gz QXAGUUUUZCAORO-LLVKDONJSA-N 0 0 364.785 3.513 20 5 FHBDRN CC(C)Cn1c(-c2cccc([N+](=O)[O-])c2)nnc1N1C[C@H]2CCC[C@@H]2C1 ZINC000549440871 942857776 /nfs/dbraw/zinc/85/77/76/942857776.db2.gz RAXVXECNEGVAJG-HZPDHXFCSA-N 0 0 355.442 3.746 20 5 FHBDRN C[C@@H]1C[C@@H](NC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)C[C@H](c2ccccc2)C1 ZINC000413977963 942857828 /nfs/dbraw/zinc/85/78/28/942857828.db2.gz HYQWCWZBAIMENT-USXIJHARSA-N 0 0 370.453 3.615 20 5 FHBDRN CC(C)Cn1c(-c2cccc([N+](=O)[O-])c2)nnc1N1C[C@@H]2CCC[C@H]2C1 ZINC000549440870 942858099 /nfs/dbraw/zinc/85/80/99/942858099.db2.gz RAXVXECNEGVAJG-HOTGVXAUSA-N 0 0 355.442 3.746 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)Nc1ncc(Cc2ccc(F)cc2)s1 ZINC000502944456 942861798 /nfs/dbraw/zinc/86/17/98/942861798.db2.gz QNVJIJGIAQYOHL-UHFFFAOYSA-N 0 0 372.381 3.737 20 5 FHBDRN CCN(Cc1occc1C)C(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000413982242 942867262 /nfs/dbraw/zinc/86/72/62/942867262.db2.gz RCOUYUVDHGNFRC-UHFFFAOYSA-N 0 0 366.801 3.967 20 5 FHBDRN COC(=O)c1cccc(Cl)c1COc1ccc(OC)cc1[N+](=O)[O-] ZINC000505472398 942868363 /nfs/dbraw/zinc/86/83/63/942868363.db2.gz AEDPYZYCWYUEMV-UHFFFAOYSA-N 0 0 351.742 3.622 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCC[C@@H]1COc1cccnc1C ZINC000421898949 942877535 /nfs/dbraw/zinc/87/75/35/942877535.db2.gz KEASQVPBYKPVJS-MRXNPFEDSA-N 0 0 369.421 3.599 20 5 FHBDRN CCc1ccc([C@@H]2CN(C(=O)c3ccc(Cl)cc3[N+](=O)[O-])CCN2)cc1 ZINC000505476900 942878436 /nfs/dbraw/zinc/87/84/36/942878436.db2.gz PHBKCWMLLFRJTO-KRWDZBQOSA-N 0 0 373.840 3.597 20 5 FHBDRN Cc1c(C(=O)NCCc2ccccc2[N+](=O)[O-])cnn1C1CCCCC1 ZINC000511561543 942881740 /nfs/dbraw/zinc/88/17/40/942881740.db2.gz RKIVEQQMPISEHX-UHFFFAOYSA-N 0 0 356.426 3.577 20 5 FHBDRN CCN(CCc1ccc(C(F)(F)F)cc1)C(=O)c1ccc([N+](=O)[O-])n1C ZINC000425156281 942885181 /nfs/dbraw/zinc/88/51/81/942885181.db2.gz FNBCACLIMGNSCI-UHFFFAOYSA-N 0 0 369.343 3.657 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2CCC[C@H](CC(F)(F)F)C2)c1 ZINC000421940420 942896696 /nfs/dbraw/zinc/89/66/96/942896696.db2.gz MTFAPUXKQHHFQT-CYBMUJFWSA-N 0 0 374.359 3.863 20 5 FHBDRN O=C(N[C@@H]1C[C@H]2C[C@H]2C1)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000425159132 942896811 /nfs/dbraw/zinc/89/68/11/942896811.db2.gz PYMKTLJUOAVVTH-MUJYYYPQSA-N 0 0 352.390 3.702 20 5 FHBDRN O=C(c1c[nH]c2ccc([N+](=O)[O-])cc12)N1CCC[C@@H](CC(F)(F)F)C1 ZINC000421946549 942900652 /nfs/dbraw/zinc/90/06/52/942900652.db2.gz SWMNJJIKONARNE-JTQLQIEISA-N 0 0 355.316 3.881 20 5 FHBDRN O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)N1CCC[C@@H](CC(F)(F)F)C1 ZINC000421966155 942922688 /nfs/dbraw/zinc/92/26/88/942922688.db2.gz OWVNVAIXQYCPEJ-VIFPVBQESA-N 0 0 366.286 3.607 20 5 FHBDRN O=C(N[C@@H](C[C@@H]1CCOC1)c1ccccc1)c1cc(F)cc([N+](=O)[O-])c1 ZINC000510009224 942922860 /nfs/dbraw/zinc/92/28/60/942922860.db2.gz FYDLVRNKZWFCDJ-UGSOOPFHSA-N 0 0 358.369 3.632 20 5 FHBDRN Cc1nn(CCC(=O)N2CCC[C@@H]2/C=C/c2ccccc2)c(C)c1[N+](=O)[O-] ZINC000378589614 942925201 /nfs/dbraw/zinc/92/52/01/942925201.db2.gz OQKHPFNNVBUVAJ-DOJUMQAQSA-N 0 0 368.437 3.503 20 5 FHBDRN Cc1nc2c(s1)[C@@H](NC(=O)c1ccc(Cl)cc1[N+](=O)[O-])CCC2 ZINC000378594082 942928022 /nfs/dbraw/zinc/92/80/22/942928022.db2.gz MPPXJFXMBDVLQC-LBPRGKRZSA-N 0 0 351.815 3.821 20 5 FHBDRN O=C(CO[C@H]1CCCc2ccccc21)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000430117255 942929830 /nfs/dbraw/zinc/92/98/30/942929830.db2.gz YRELUINPPBIURD-IBGZPJMESA-N 0 0 352.390 3.578 20 5 FHBDRN Cn1ccnc1[C@H](NCCc1cccc(Cl)c1)c1cccc([N+](=O)[O-])c1 ZINC000513761778 942934857 /nfs/dbraw/zinc/93/48/57/942934857.db2.gz OKUUZIGXGKSBRY-GOSISDBHSA-N 0 0 370.840 3.903 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)OCc1ccc(-n2cccn2)cc1 ZINC000016620211 942936083 /nfs/dbraw/zinc/93/60/83/942936083.db2.gz YSFQXUFZTQUZDW-UHFFFAOYSA-N 0 0 369.402 3.616 20 5 FHBDRN COc1ccc(CNC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)c(F)c1 ZINC000467321928 942942551 /nfs/dbraw/zinc/94/25/51/942942551.db2.gz QDRLMPGRDFVSFI-UHFFFAOYSA-N 0 0 360.366 3.887 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN(Cc1ccccc1F)C(C)C ZINC000434769196 942957466 /nfs/dbraw/zinc/95/74/66/942957466.db2.gz NENLUENIIMBTLB-UHFFFAOYSA-N 0 0 359.401 3.891 20 5 FHBDRN Cc1cc(NC(=O)C2CC2)sc1C(=O)NCc1cccc([N+](=O)[O-])c1C ZINC001269215866 942960809 /nfs/dbraw/zinc/96/08/09/942960809.db2.gz RMINDKROGFZYPW-UHFFFAOYSA-N 0 0 373.434 3.552 20 5 FHBDRN COc1cc(CN(C)c2ccccc2)c([N+](=O)[O-])cc1OCC(F)F ZINC000505521975 942964658 /nfs/dbraw/zinc/96/46/58/942964658.db2.gz SHDKMCQXBDVENB-UHFFFAOYSA-N 0 0 352.337 3.884 20 5 FHBDRN O=C(c1ccccc1Sc1ccccc1[N+](=O)[O-])N1CC[C@]12CCOC2 ZINC000422076507 942972791 /nfs/dbraw/zinc/97/27/91/942972791.db2.gz SZOSAYYIGPWKDP-LJQANCHMSA-N 0 0 370.430 3.751 20 5 FHBDRN O=C(CC[S@](=O)c1ccc2c(c1)CCCC2)Nc1ccccc1[N+](=O)[O-] ZINC000422103832 942990815 /nfs/dbraw/zinc/99/08/15/942990815.db2.gz RWKNZKCZNUVZHF-SANMLTNESA-N 0 0 372.446 3.610 20 5 FHBDRN O=C(CC[S@@](=O)c1ccc2c(c1)CCCC2)Nc1ccccc1[N+](=O)[O-] ZINC000422103831 942990881 /nfs/dbraw/zinc/99/08/81/942990881.db2.gz RWKNZKCZNUVZHF-AREMUKBSSA-N 0 0 372.446 3.610 20 5 FHBDRN Cc1cc(NC(=O)c2cnc3ccccc3n2)c2cc([N+](=O)[O-])ccc2n1 ZINC000183681080 942990890 /nfs/dbraw/zinc/99/08/90/942990890.db2.gz PNGQFKRFHHYKEY-UHFFFAOYSA-N 0 0 359.345 3.647 20 5 FHBDRN O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1C[C@@H]2CCC(=O)c3cccc1c32 ZINC000183859047 942999594 /nfs/dbraw/zinc/99/95/94/942999594.db2.gz IQFYKFZGYQXHMM-JTQLQIEISA-N 0 0 356.765 3.969 20 5 FHBDRN O=C(NCCc1cccc2cccnc21)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000514431843 943001892 /nfs/dbraw/zinc/00/18/92/943001892.db2.gz SXVCJYDRUMYVRH-UHFFFAOYSA-N 0 0 361.357 3.862 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)NCc1cc(C2CC2)no1 ZINC000894270578 943005279 /nfs/dbraw/zinc/00/52/79/943005279.db2.gz VSKSFHDWDIWASD-UHFFFAOYSA-N 0 0 361.423 3.891 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)N1CCc2c(F)cc(F)cc2C1 ZINC000122965027 943027675 /nfs/dbraw/zinc/02/76/75/943027675.db2.gz OFENHMDEVXVXNM-UHFFFAOYSA-N 0 0 364.373 3.550 20 5 FHBDRN C[C@@H](NS(=O)(=O)CCc1ccc([N+](=O)[O-])cc1)c1ccc(C2CC2)cc1 ZINC000416667299 943029366 /nfs/dbraw/zinc/02/93/66/943029366.db2.gz PSEIRTDITQHXPI-CQSZACIVSA-N 0 0 374.462 3.695 20 5 FHBDRN Cc1cccc(S(=O)(=O)CCCOc2c(Cl)cccc2[N+](=O)[O-])c1 ZINC000183863883 943042213 /nfs/dbraw/zinc/04/22/13/943042213.db2.gz UKNKXOQYXONCLJ-UHFFFAOYSA-N 0 0 369.826 3.799 20 5 FHBDRN CCOC(=O)c1cc(N[C@@H](c2cnn(C)c2)C(C)(C)C)ccc1[N+](=O)[O-] ZINC000425239823 943046457 /nfs/dbraw/zinc/04/64/57/943046457.db2.gz OKDSQFRYGYTHJE-INIZCTEOSA-N 0 0 360.414 3.704 20 5 FHBDRN COC(=O)c1cc(C(=O)N[C@@H](c2ccc(C)cc2)C2CC2)cc([N+](=O)[O-])c1 ZINC000514487240 943048055 /nfs/dbraw/zinc/04/80/55/943048055.db2.gz CRTIJGJTIPMUIS-SFHVURJKSA-N 0 0 368.389 3.571 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C1(c2ccc(C)c(OC)c2)CCC1 ZINC000503216805 943055189 /nfs/dbraw/zinc/05/51/89/943055189.db2.gz MKBCCJFHRCYQFL-UHFFFAOYSA-N 0 0 370.405 3.981 20 5 FHBDRN Cn1cnc([N+](=O)[O-])c1CSCc1ccc(C(=O)OC(C)(C)C)cc1 ZINC000434926529 943057654 /nfs/dbraw/zinc/05/76/54/943057654.db2.gz LPRPJOTZBQRYQR-UHFFFAOYSA-N 0 0 363.439 3.717 20 5 FHBDRN CC(C)CC(C)(C)CNC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000434170183 943057921 /nfs/dbraw/zinc/05/79/21/943057921.db2.gz PMWPDFQVBXVJCS-UHFFFAOYSA-N 0 0 358.442 3.797 20 5 FHBDRN Cc1c(NC(=O)N2CCC[C@H](Oc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000416724317 943064112 /nfs/dbraw/zinc/06/41/12/943064112.db2.gz CTFWGHSLCLTHRP-INIZCTEOSA-N 0 0 355.394 3.979 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N2CC[C@H](CC(C)(C)C)C2)c1F ZINC000412407496 943065545 /nfs/dbraw/zinc/06/55/45/943065545.db2.gz DWTPDPHUMYTKCS-GFCCVEGCSA-N 0 0 352.406 3.570 20 5 FHBDRN CC(C)[C@H]1CCC[C@@H](NC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)CC1 ZINC000183886693 943065986 /nfs/dbraw/zinc/06/59/86/943065986.db2.gz VOAQVYNZNCEJAY-UONOGXRCSA-N 0 0 371.437 3.771 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N1CCC(OC2CCC2)CC1 ZINC000416735133 943069252 /nfs/dbraw/zinc/06/92/52/943069252.db2.gz NPLIAMJKLDOQHM-UHFFFAOYSA-N 0 0 353.806 3.814 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)COc1cccc2cccnc21 ZINC000514517009 943077367 /nfs/dbraw/zinc/07/73/67/943077367.db2.gz BETIONATVFHKSL-UHFFFAOYSA-N 0 0 351.362 3.777 20 5 FHBDRN Cc1ccc(NC(=O)N2CC[C@@]3(C2)OCc2ccccc23)cc1[N+](=O)[O-] ZINC000183892715 943078360 /nfs/dbraw/zinc/07/83/60/943078360.db2.gz RQKLMPMQUIBHDO-IBGZPJMESA-N 0 0 353.378 3.567 20 5 FHBDRN Cc1ccc(NC(=O)N2CC[C@]3(C2)OCc2ccccc23)cc1[N+](=O)[O-] ZINC000183892696 943078604 /nfs/dbraw/zinc/07/86/04/943078604.db2.gz RQKLMPMQUIBHDO-LJQANCHMSA-N 0 0 353.378 3.567 20 5 FHBDRN COc1cc(NC(=O)Nc2cc([N+](=O)[O-])ccc2OC)c(C)c(OC)c1 ZINC000503240174 943079408 /nfs/dbraw/zinc/07/94/08/943079408.db2.gz JDNQFVIIRPONEO-UHFFFAOYSA-N 0 0 361.354 3.573 20 5 FHBDRN Cc1ccc(C(=O)CCCC(=O)NCCc2cccc([N+](=O)[O-])c2)cc1 ZINC000503234730 943085276 /nfs/dbraw/zinc/08/52/76/943085276.db2.gz QVAUEUMWNIMRLH-UHFFFAOYSA-N 0 0 354.406 3.615 20 5 FHBDRN CC(C)SCC(=O)Nc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1 ZINC000514533252 943091020 /nfs/dbraw/zinc/09/10/20/943091020.db2.gz NHWNJBFFGORJLI-UHFFFAOYSA-N 0 0 358.419 3.906 20 5 FHBDRN O=C(Cc1c[nH]c2cc(F)ccc12)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000183743483 943101233 /nfs/dbraw/zinc/10/12/33/943101233.db2.gz TWZLBWJNZOYMLA-UHFFFAOYSA-N 0 0 361.760 3.728 20 5 FHBDRN CC(C)CN(C(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)C1CCCC1 ZINC000514559509 943101564 /nfs/dbraw/zinc/10/15/64/943101564.db2.gz OZNYKRMPSXXIPY-UHFFFAOYSA-N 0 0 356.426 3.821 20 5 FHBDRN O=C(NCc1ccc(COCC(F)(F)F)cc1)c1csc([N+](=O)[O-])c1 ZINC000514569903 943103530 /nfs/dbraw/zinc/10/35/30/943103530.db2.gz BVDZJSOSNRMODG-UHFFFAOYSA-N 0 0 374.340 3.665 20 5 FHBDRN COc1cc(OCC(=O)N(C)[C@H](C)c2ccc(C)cc2C)ccc1[N+](=O)[O-] ZINC000503303567 943111993 /nfs/dbraw/zinc/11/19/93/943111993.db2.gz NWCQXPPOOSKKKT-OAHLLOKOSA-N 0 0 372.421 3.819 20 5 FHBDRN COC(=O)c1ccccc1C(=O)c1ccc(N[C@@H]2CC23CC3)c([N+](=O)[O-])c1 ZINC000425269210 943129238 /nfs/dbraw/zinc/12/92/38/943129238.db2.gz BOIVHLDLJQRSDR-QGZVFWFLSA-N 0 0 366.373 3.577 20 5 FHBDRN COC(=O)c1ccc(OC(=O)[C@@H](C)c2cc3ccccc3o2)cc1[N+](=O)[O-] ZINC001267794286 943182773 /nfs/dbraw/zinc/18/27/73/943182773.db2.gz HTGYOIMLROXOGC-NSHDSACASA-N 0 0 369.329 3.837 20 5 FHBDRN Cc1cccc(N(C(C)C)S(=O)(=O)CCc2ccc([N+](=O)[O-])cc2)c1 ZINC000503438212 943183937 /nfs/dbraw/zinc/18/39/37/943183937.db2.gz SVKYQDPXNCJEEU-UHFFFAOYSA-N 0 0 362.451 3.691 20 5 FHBDRN N#CN(Cc1c(Br)cccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC001307341871 943187964 /nfs/dbraw/zinc/18/79/64/943187964.db2.gz MVNCERHQDRJHSC-UHFFFAOYSA-N 0 0 350.147 3.984 20 5 FHBDRN Cc1ccc(NC(=O)[C@@H](C)OC(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1F ZINC000016862111 943198132 /nfs/dbraw/zinc/19/81/32/943198132.db2.gz KQPBHGBQSCZDTI-GFCCVEGCSA-N 0 0 360.341 3.535 20 5 FHBDRN CCOc1cc(NC(=O)NCCc2ccccc2)c([N+](=O)[O-])cc1OCC ZINC000503466007 943201775 /nfs/dbraw/zinc/20/17/75/943201775.db2.gz MIVUNSRGPPXCIA-UHFFFAOYSA-N 0 0 373.409 3.756 20 5 FHBDRN O=[N+]([O-])c1cccc(F)c1CN(Cc1cccs1)C[C@H]1CCCO1 ZINC000505612849 943203636 /nfs/dbraw/zinc/20/36/36/943203636.db2.gz UHEGUIIXEHTANB-CYBMUJFWSA-N 0 0 350.415 3.977 20 5 FHBDRN COc1ccc(-c2ccc(C[N@@H+]3CCC[C@H](C(=O)[O-])[C@@H]3C)o2)c([N+](=O)[O-])c1 ZINC000422637801 943216471 /nfs/dbraw/zinc/21/64/71/943216471.db2.gz RZCPQQVWXGMCKD-WFASDCNBSA-N 0 0 374.393 3.549 20 5 FHBDRN O=C(NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)c1ccc(Cl)cc1F ZINC000514688180 943223250 /nfs/dbraw/zinc/22/32/50/943223250.db2.gz GYCQKNTVQGSRFA-UHFFFAOYSA-N 0 0 361.760 3.841 20 5 FHBDRN Cc1c(Br)cc(C(=O)N2CC[C@@H](C(C)C)C2)cc1[N+](=O)[O-] ZINC000510024027 943223405 /nfs/dbraw/zinc/22/34/05/943223405.db2.gz QXGGZZUYWQFBAX-LLVKDONJSA-N 0 0 355.232 3.784 20 5 FHBDRN CCOc1cc(NC(=O)NC2(C)CCCC2)c([N+](=O)[O-])cc1OCC ZINC000503516939 943228671 /nfs/dbraw/zinc/22/86/71/943228671.db2.gz NSIFSCCVWOCDNA-UHFFFAOYSA-N 0 0 351.403 3.846 20 5 FHBDRN O=C(NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N1CC(C2CCC2)C1 ZINC000503520693 943232025 /nfs/dbraw/zinc/23/20/25/943232025.db2.gz IHDDXSAZGYZVPW-UHFFFAOYSA-N 0 0 357.332 3.555 20 5 FHBDRN O=[N+]([O-])c1ccccc1CNc1ccnc2ccc(Br)cc21 ZINC000503536720 943235846 /nfs/dbraw/zinc/23/58/46/943235846.db2.gz JDQOLRHOMJHCGV-UHFFFAOYSA-N 0 0 358.195 3.940 20 5 FHBDRN O=C(N[C@H]1CCCC(F)(F)C1)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000514708099 943236701 /nfs/dbraw/zinc/23/67/01/943236701.db2.gz PYAYDOSXXVVTEA-LBPRGKRZSA-N 0 0 356.372 3.989 20 5 FHBDRN COc1cc(Cl)ccc1CNC(=O)C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000514743035 943255199 /nfs/dbraw/zinc/25/51/99/943255199.db2.gz SKHLGEVICQYSQV-UHFFFAOYSA-N 0 0 362.813 3.851 20 5 FHBDRN CCOc1cc(C(=O)N2CCCCc3ccccc32)c([N+](=O)[O-])cc1OC ZINC000047975654 943257304 /nfs/dbraw/zinc/25/73/04/943257304.db2.gz IWBSKMGITUQNHN-UHFFFAOYSA-N 0 0 370.405 3.985 20 5 FHBDRN CC(C)(NC(=O)CCC(=O)c1cccc(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000503566184 943265086 /nfs/dbraw/zinc/26/50/86/943265086.db2.gz DWUFDAZSJZKRRD-UHFFFAOYSA-N 0 0 358.369 3.748 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCC[C@H]2OCC[C@H]21 ZINC000503571808 943268566 /nfs/dbraw/zinc/26/85/66/943268566.db2.gz BVHAQNDBVNHZBK-NUEKZKHPSA-N 0 0 364.467 3.784 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCC[C@@H]2OCC[C@@H]21 ZINC000503571805 943268669 /nfs/dbraw/zinc/26/86/69/943268669.db2.gz BVHAQNDBVNHZBK-BMFZPTHFSA-N 0 0 364.467 3.784 20 5 FHBDRN C[C@@H]1C[C@@H](CNC(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)[C@H](C)O1 ZINC000416980857 943272782 /nfs/dbraw/zinc/27/27/82/943272782.db2.gz GTFONQFITURCBS-UTLUCORTSA-N 0 0 361.320 3.549 20 5 FHBDRN CC(C)[C@H](c1ccc(F)cc1)N(C)C(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000435273714 943294939 /nfs/dbraw/zinc/29/49/39/943294939.db2.gz BUZQRHACDBBAQN-QGZVFWFLSA-N 0 0 373.384 3.528 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]([C@@H]2CCOC2)C1 ZINC000503637019 943313031 /nfs/dbraw/zinc/31/30/31/943313031.db2.gz KTNVUVJASIUQBC-ZIAGYGMSSA-N 0 0 364.467 3.596 20 5 FHBDRN Cc1c(NC(=O)N(C)[C@H]2CC2(C)C)cc(Br)cc1[N+](=O)[O-] ZINC000435324995 943325610 /nfs/dbraw/zinc/32/56/10/943325610.db2.gz YHVMWLWTVQOXME-LBPRGKRZSA-N 0 0 356.220 3.928 20 5 FHBDRN CC(C)(C)[C@H](CO)NC(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000434205697 943331438 /nfs/dbraw/zinc/33/14/38/943331438.db2.gz HAZSNIPRCMXINK-KRWDZBQOSA-N 0 0 373.409 3.916 20 5 FHBDRN O=C(Nc1nnc(C2CC2)s1)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000549464387 943339596 /nfs/dbraw/zinc/33/95/96/943339596.db2.gz YKHSLXODBCDZRR-UHFFFAOYSA-N 0 0 358.301 3.595 20 5 FHBDRN CNc1ccc(C(=O)Nc2ccccc2OC(F)(F)F)cc1[N+](=O)[O-] ZINC000053210806 943344752 /nfs/dbraw/zinc/34/47/52/943344752.db2.gz ZRSUQGIMLQWZFE-UHFFFAOYSA-N 0 0 355.272 3.787 20 5 FHBDRN O=C(Nc1nnc(-c2ccco2)s1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000053209213 943344790 /nfs/dbraw/zinc/34/47/90/943344790.db2.gz IDFBNNZDAJTAQO-UHFFFAOYSA-N 0 0 371.378 3.533 20 5 FHBDRN CCOc1cc(NC(=O)COCc2ccccc2)c([N+](=O)[O-])cc1OCC ZINC000514864473 943346913 /nfs/dbraw/zinc/34/69/13/943346913.db2.gz ITEYRPDOGPHBGT-UHFFFAOYSA-N 0 0 374.393 3.548 20 5 FHBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCCO[C@@H](CF)C1 ZINC000412450993 943353517 /nfs/dbraw/zinc/35/35/17/943353517.db2.gz NRTAZJUXKKCRBF-AWEZNQCLSA-N 0 0 370.446 3.688 20 5 FHBDRN Cc1cc(NCc2nnc3n2CCCCC3)c([N+](=O)[O-])cc1C(F)(F)F ZINC000549463646 943359653 /nfs/dbraw/zinc/35/96/53/943359653.db2.gz XYVJFNIKADUDJN-UHFFFAOYSA-N 0 0 369.347 3.852 20 5 FHBDRN O=[N+]([O-])c1cccc(CS(=O)(=O)N2CCC[C@@H]2/C=C\c2ccccc2)c1 ZINC000503828755 943377356 /nfs/dbraw/zinc/37/73/56/943377356.db2.gz OBKWVZWWANHGQQ-YUIUBULTSA-N 0 0 372.446 3.602 20 5 FHBDRN O=C(N[C@H](Cc1ccc(Cl)cc1)c1ccccn1)c1ccc([N+](=O)[O-])o1 ZINC000503840320 943381522 /nfs/dbraw/zinc/38/15/22/943381522.db2.gz MBFDBUXGXKJAHE-OAHLLOKOSA-N 0 0 371.780 3.950 20 5 FHBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1CCC[C@@H]1/C=C/c1ccccc1 ZINC000503822285 943384517 /nfs/dbraw/zinc/38/45/17/943384517.db2.gz UFEGRIWFCYUYRK-GZKZCVOOSA-N 0 0 372.446 3.770 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CCSC2(CCC2)CC1 ZINC000412461819 943392108 /nfs/dbraw/zinc/39/21/08/943392108.db2.gz JRXLZEZNDZZFGD-UHFFFAOYSA-N 0 0 359.451 3.507 20 5 FHBDRN COCC[C@H](C)CNC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000412467653 943392983 /nfs/dbraw/zinc/39/29/83/943392983.db2.gz GASFFXCJKPMEQQ-AWEZNQCLSA-N 0 0 357.410 3.741 20 5 FHBDRN O=C(NC[C@@H]1CCC[C@@H]1C1CC1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000412460072 943399705 /nfs/dbraw/zinc/39/97/05/943399705.db2.gz GKZRUMMRBCNYGD-ZWKOTPCHSA-N 0 0 371.481 3.754 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1cncc(Cl)c1Br ZINC000514970599 943436248 /nfs/dbraw/zinc/43/62/48/943436248.db2.gz ZQXAYHOZUKYANH-UHFFFAOYSA-N 0 0 370.590 3.966 20 5 FHBDRN O=[N+]([O-])c1cn(Cc2c(F)ccc(Br)c2F)nc1C1CC1 ZINC000435481791 943438426 /nfs/dbraw/zinc/43/84/26/943438426.db2.gz FSDIROCTRSEEFO-UHFFFAOYSA-N 0 0 358.142 3.758 20 5 FHBDRN Cc1cc(C(=O)NCc2c(Cl)cccc2-n2ccnc2)ccc1[N+](=O)[O-] ZINC000515008599 943454660 /nfs/dbraw/zinc/45/46/60/943454660.db2.gz IAXDKRHBLCWNGX-UHFFFAOYSA-N 0 0 370.796 3.672 20 5 FHBDRN COc1cccc(C(=O)NCCc2cccc(Cl)c2Cl)c1[N+](=O)[O-] ZINC000435561617 943485764 /nfs/dbraw/zinc/48/57/64/943485764.db2.gz WKSPBGQWJWXECF-UHFFFAOYSA-N 0 0 369.204 3.883 20 5 FHBDRN Cc1nn(Cc2ccc(C(=O)N3C[C@@H](C)C[C@H](C)C3)cc2)c(C)c1[N+](=O)[O-] ZINC000017167257 943494583 /nfs/dbraw/zinc/49/45/83/943494583.db2.gz WGVUJRGUAOYBSG-KBPBESRZSA-N 0 0 370.453 3.575 20 5 FHBDRN CCOc1cccc([C@@H]2C[C@H]2Nc2ncnc3cccc([N+](=O)[O-])c32)c1 ZINC000435575445 943495465 /nfs/dbraw/zinc/49/54/65/943495465.db2.gz RFIPONPIPJUNRV-GOEBONIOSA-N 0 0 350.378 3.905 20 5 FHBDRN CNC(=O)c1ccc(N[C@H]2C[C@H](c3cccc(Cl)c3)C2)c([N+](=O)[O-])c1 ZINC000435582515 943501260 /nfs/dbraw/zinc/50/12/60/943501260.db2.gz ATKHXQAISOULHT-CTYIDZIISA-N 0 0 359.813 3.966 20 5 FHBDRN COc1cccc(C(=O)Nc2ccc3c(c2)OC2(CCCC2)O3)c1[N+](=O)[O-] ZINC000435615516 943516194 /nfs/dbraw/zinc/51/61/94/943516194.db2.gz JKUBZLJBQQIYMS-UHFFFAOYSA-N 0 0 370.361 3.897 20 5 FHBDRN Cc1ccc2c(c1)[nH]cc2C1=CCN(C(=O)c2cc([N+](=O)[O-])c[nH]2)CC1 ZINC000515134337 943527502 /nfs/dbraw/zinc/52/75/02/943527502.db2.gz UIQAWBYKCJJLBX-UHFFFAOYSA-N 0 0 350.378 3.642 20 5 FHBDRN Cc1cc(F)cc2c1CN(C(=O)CCCNc1ccc([N+](=O)[O-])cc1)CC2 ZINC000504166098 943528201 /nfs/dbraw/zinc/52/82/01/943528201.db2.gz RILFKIKKERFKBZ-UHFFFAOYSA-N 0 0 371.412 3.819 20 5 FHBDRN O=C(Nc1cc2c(cc1F)CCC(=O)N2)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000515171557 943534774 /nfs/dbraw/zinc/53/47/74/943534774.db2.gz GYFKMYMIAMYDFP-UHFFFAOYSA-N 0 0 369.308 3.617 20 5 FHBDRN C[C@H](COc1ccc(F)cc1F)NC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000584754575 943536595 /nfs/dbraw/zinc/53/65/95/943536595.db2.gz BNVDHTNNGRNDGC-NEPJUHHUSA-N 0 0 364.348 3.560 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@](C)(CO)Cc1ccccc1 ZINC000515190493 943545762 /nfs/dbraw/zinc/54/57/62/943545762.db2.gz CRZJDIDYVORCHK-HXUWFJFHSA-N 0 0 371.437 3.520 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N[C@H]1CCCc2cc(N)ccc21 ZINC000423543728 943552753 /nfs/dbraw/zinc/55/27/53/943552753.db2.gz HPYGPMUBURLUNB-KRWDZBQOSA-N 0 0 353.422 3.910 20 5 FHBDRN CN(C(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1nccs1 ZINC000515203931 943564882 /nfs/dbraw/zinc/56/48/82/943564882.db2.gz DWWSGPFZRQKLRJ-UHFFFAOYSA-N 0 0 374.344 3.535 20 5 FHBDRN CCc1ccc(C(=O)N(Cc2ccccc2)C[C@H](O)CC)cc1[N+](=O)[O-] ZINC000435707268 943569179 /nfs/dbraw/zinc/56/91/79/943569179.db2.gz RXHRLEUMKWTUTB-GOSISDBHSA-N 0 0 356.422 3.571 20 5 FHBDRN CCN(C(=O)COc1ccc([N+](=O)[O-])c(C)c1)c1nc2ccccc2s1 ZINC000017275774 943576242 /nfs/dbraw/zinc/57/62/42/943576242.db2.gz WQIUPRJVSVZHDW-UHFFFAOYSA-N 0 0 371.418 3.945 20 5 FHBDRN C[C@H]1C[C@@H](c2ccccc2)N(C(=O)CN(C)c2ccccc2[N+](=O)[O-])C1 ZINC000515226677 943581577 /nfs/dbraw/zinc/58/15/77/943581577.db2.gz MYSJMNKUZDONOW-KXBFYZLASA-N 0 0 353.422 3.641 20 5 FHBDRN COc1ccc(CNCc2cccc([N+](=O)[O-])c2C)c(Br)c1 ZINC000318995493 943583679 /nfs/dbraw/zinc/58/36/79/943583679.db2.gz IVBIDFFOHKNUCL-UHFFFAOYSA-N 0 0 365.227 3.964 20 5 FHBDRN O=C1c2ccccc2C(=O)N1CCCSCc1ccc([N+](=O)[O-])cc1 ZINC000513813624 943585104 /nfs/dbraw/zinc/58/51/04/943585104.db2.gz IDZRJFIHRXTTCM-UHFFFAOYSA-N 0 0 356.403 3.514 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCCc1c[nH]c2ccccc12 ZINC000017295771 943589820 /nfs/dbraw/zinc/58/98/20/943589820.db2.gz JGLNUWOOIHACFZ-ZDUSSCGKSA-N 0 0 369.446 3.916 20 5 FHBDRN CCCCCn1cc(CNC(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)c(C)n1 ZINC000504323927 943591343 /nfs/dbraw/zinc/59/13/43/943591343.db2.gz GCLIUUUVOVLZAZ-UHFFFAOYSA-N 0 0 369.425 3.701 20 5 FHBDRN CCCOc1ccc(OCC(=O)N2c3ccc([N+](=O)[O-])cc3C[C@@H]2C)cc1 ZINC000504340968 943592731 /nfs/dbraw/zinc/59/27/31/943592731.db2.gz JVPMDWZEHYVOBQ-AWEZNQCLSA-N 0 0 370.405 3.740 20 5 FHBDRN CC(C)[C@H](NC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1)C(F)(F)F ZINC000417427623 943602521 /nfs/dbraw/zinc/60/25/21/943602521.db2.gz QROUEFMPFCYFGL-AWEZNQCLSA-N 0 0 359.348 3.856 20 5 FHBDRN C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1ccc(OCC2CC2)cc1 ZINC000504376973 943608414 /nfs/dbraw/zinc/60/84/14/943608414.db2.gz SFQWOJQQABQOLH-CYBMUJFWSA-N 0 0 352.390 3.975 20 5 FHBDRN CC(C)Oc1ccccc1CC(=O)N1c2ccc([N+](=O)[O-])cc2C[C@H]1C ZINC000504400920 943616452 /nfs/dbraw/zinc/61/64/52/943616452.db2.gz HQPKOYRKNMFYLM-CQSZACIVSA-N 0 0 354.406 3.902 20 5 FHBDRN Cc1noc2ncc(NC(=O)c3cc(C(F)(F)F)ccc3[N+](=O)[O-])cc12 ZINC001126417465 943618230 /nfs/dbraw/zinc/61/82/30/943618230.db2.gz NCXBODDVBXPVIB-UHFFFAOYSA-N 0 0 366.255 3.711 20 5 FHBDRN Cc1ccc([C@H](C)N2C(=O)[C@H](c3ccccc3)N(C)C2=O)cc1[N+](=O)[O-] ZINC000431950488 943657245 /nfs/dbraw/zinc/65/72/45/943657245.db2.gz LNFMGILOYLYIQO-GUYCJALGSA-N 0 0 353.378 3.600 20 5 FHBDRN COc1ccc([C@H](C)OC(=O)COc2ccccc2[N+](=O)[O-])cc1Cl ZINC000728777326 943666894 /nfs/dbraw/zinc/66/68/94/943666894.db2.gz SULBQVKVZNPUMG-NSHDSACASA-N 0 0 365.769 3.940 20 5 FHBDRN COc1cc(C(=O)N[C@H](c2ccccc2)C2CCC2)c([N+](=O)[O-])cc1OC ZINC000105374286 943682824 /nfs/dbraw/zinc/68/28/24/943682824.db2.gz KMJUTLZAMCUQDN-LJQANCHMSA-N 0 0 370.405 3.883 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@](C)(c1ccccc1)C(F)(F)F ZINC000504570764 943686797 /nfs/dbraw/zinc/68/67/97/943686797.db2.gz NULIGGMUKDRPIH-INIZCTEOSA-N 0 0 368.311 3.811 20 5 FHBDRN C[C@@H](c1ccccc1)N(C)C(=O)CN(C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000504590203 943701097 /nfs/dbraw/zinc/70/10/97/943701097.db2.gz QLAARRGQTBDYJZ-GQPJMJRUSA-N 0 0 367.449 3.759 20 5 FHBDRN Cc1ccc(NC(=O)[C@@](C)(O)CSc2cccc(F)c2)cc1[N+](=O)[O-] ZINC000504594927 943704033 /nfs/dbraw/zinc/70/40/33/943704033.db2.gz ZLIXKYBLIJNDBF-KRWDZBQOSA-N 0 0 364.398 3.524 20 5 FHBDRN COc1cc(C)c([S@@](C)=O)cc1OCc1ccc([N+](=O)[O-])cc1Cl ZINC000424098078 943731818 /nfs/dbraw/zinc/73/18/18/943731818.db2.gz BRCQLWSTKLQIDJ-XMMPIXPASA-N 0 0 369.826 3.882 20 5 FHBDRN Cc1ccccc1OC[C@H](O)COc1cc(C)c([N+](=O)[O-])cc1Cl ZINC000504672940 943739148 /nfs/dbraw/zinc/73/91/48/943739148.db2.gz HJNIKUOSLBFMDS-ZDUSSCGKSA-N 0 0 351.786 3.684 20 5 FHBDRN Cc1nnc(CSCc2ccc(Br)cc2[N+](=O)[O-])s1 ZINC000424128206 943747039 /nfs/dbraw/zinc/74/70/39/943747039.db2.gz WJLPUUBMOKJSLV-UHFFFAOYSA-N 0 0 360.258 3.951 20 5 FHBDRN C[C@H]([NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)[C@H](C)C(=O)[O-] ZINC000417618619 943754103 /nfs/dbraw/zinc/75/41/03/943754103.db2.gz XYGJNUZEHPTJEZ-RYUDHWBXSA-N 0 0 362.357 3.725 20 5 FHBDRN C[C@@H]([NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1)[C@H](C)C(=O)[O-] ZINC000417619852 943755102 /nfs/dbraw/zinc/75/51/02/943755102.db2.gz ZSEZUGSOTXSAFV-UONOGXRCSA-N 0 0 357.410 3.562 20 5 FHBDRN Cc1cnn(-c2ccc(NC(=O)[C@@H](C)c3cccc([N+](=O)[O-])c3)cc2F)c1 ZINC000516840325 943761342 /nfs/dbraw/zinc/76/13/42/943761342.db2.gz XDSBPMGDEZAHBI-ZDUSSCGKSA-N 0 0 368.368 3.970 20 5 FHBDRN O=C1c2cccc([N+](=O)[O-])c2C(=O)N1Cc1nc(-c2ccccc2)cs1 ZINC000435784920 943768935 /nfs/dbraw/zinc/76/89/35/943768935.db2.gz KMOOYHYXIVMZCS-UHFFFAOYSA-N 0 0 365.370 3.515 20 5 FHBDRN O=C(N[C@H]1C[C@H](c2ccccc2F)C1)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000437394376 943770552 /nfs/dbraw/zinc/77/05/52/943770552.db2.gz RLZUGYMGNGTMHY-HAQNSBGRSA-N 0 0 353.353 3.891 20 5 FHBDRN CCCCOCCCNC(=O)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000435819173 943774287 /nfs/dbraw/zinc/77/42/87/943774287.db2.gz SDWODZPNQOXBOZ-UHFFFAOYSA-N 0 0 370.424 3.757 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](CCSc1ccccc1)C(=O)[O-] ZINC000417623199 943774621 /nfs/dbraw/zinc/77/46/21/943774621.db2.gz PACJVZLWMZRZGT-KRWDZBQOSA-N 0 0 360.435 3.628 20 5 FHBDRN O=[N+]([O-])c1ccc(OC[C@H](O)COc2ccc(Cl)cc2)c(Cl)c1 ZINC000584851974 943775483 /nfs/dbraw/zinc/77/54/83/943775483.db2.gz GXZONUHTHRELST-GFCCVEGCSA-N 0 0 358.177 3.720 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)N[C@H]1CCCOc2ccccc21 ZINC000504748425 943780396 /nfs/dbraw/zinc/78/03/96/943780396.db2.gz MSUVXXJMAUDPRX-SFHVURJKSA-N 0 0 369.421 3.817 20 5 FHBDRN CC(C)c1ccc(C(=O)NCc2nccn2-c2ccccc2)cc1[N+](=O)[O-] ZINC000516879722 943788881 /nfs/dbraw/zinc/78/88/81/943788881.db2.gz BCDKLAQIFOQDMC-UHFFFAOYSA-N 0 0 364.405 3.834 20 5 FHBDRN Nc1c(C(=O)N[C@H]2C[C@H](c3cccc(Cl)c3)C2)cc(F)cc1[N+](=O)[O-] ZINC000437418101 943791479 /nfs/dbraw/zinc/79/14/79/943791479.db2.gz LVIHHMBBURPFSM-MJHDQNEOSA-N 0 0 363.776 3.646 20 5 FHBDRN C[C@@H](NC(=O)c1cccc2c(=O)c3cccc(F)c3[nH]c12)c1cccnc1 ZINC000435830042 943799568 /nfs/dbraw/zinc/79/95/68/943799568.db2.gz AKOFOQCBUWQTAZ-GFCCVEGCSA-N 0 0 361.376 3.706 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N[C@H]1C[C@H](c2cccc(F)c2)C1 ZINC000437444760 943803983 /nfs/dbraw/zinc/80/39/83/943803983.db2.gz CSSKMNSRQQLGSG-CTYIDZIISA-N 0 0 362.788 3.992 20 5 FHBDRN C[C@@H](NC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1)[C@@H]1Oc2ccccc2[C@H]1C ZINC000437447965 943808663 /nfs/dbraw/zinc/80/86/63/943808663.db2.gz FKJCJJWDHOLJQB-ZYKCCNLVSA-N 0 0 369.421 3.908 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N(CC1CCC1)[C@@H](C)CO ZINC000435857740 943811876 /nfs/dbraw/zinc/81/18/76/943811876.db2.gz XMTOQWIOLJBQRO-ZDUSSCGKSA-N 0 0 366.483 3.718 20 5 FHBDRN COc1cccc(C(=O)N2CC[C@H](c3ccc(Cl)cc3)C2)c1[N+](=O)[O-] ZINC000435857896 943812298 /nfs/dbraw/zinc/81/22/98/943812298.db2.gz YXXCZVHNNCMSJZ-ZDUSSCGKSA-N 0 0 360.797 3.887 20 5 FHBDRN O=C(N[C@H]1C[C@H](c2cccc(F)c2)C1)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000437435345 943813625 /nfs/dbraw/zinc/81/36/25/943813625.db2.gz PMEFJGUGXWMJRH-CTYIDZIISA-N 0 0 353.353 3.891 20 5 FHBDRN O=C(Cn1ccc2ccc(F)cc21)N1CCCc2ccc([N+](=O)[O-])cc21 ZINC001125911241 943817625 /nfs/dbraw/zinc/81/76/25/943817625.db2.gz LWDYCASOISVOIU-UHFFFAOYSA-N 0 0 353.353 3.668 20 5 FHBDRN O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)N1CCc2sc(Cl)cc2C1 ZINC000516928278 943819554 /nfs/dbraw/zinc/81/95/54/943819554.db2.gz NCDIEZOMXPVHDL-UHFFFAOYSA-N 0 0 372.780 3.715 20 5 FHBDRN COC(=O)c1ccc(OC(=O)c2c(C)ccc([N+](=O)[O-])c2C)cc1Cl ZINC001270022211 943819908 /nfs/dbraw/zinc/81/99/08/943819908.db2.gz YHHFBKQLWLKPRW-UHFFFAOYSA-N 0 0 363.753 3.871 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)NCCc1cccc2[nH]ccc21 ZINC000504837170 943824121 /nfs/dbraw/zinc/82/41/21/943824121.db2.gz ODLCZZMKSGMYKV-UHFFFAOYSA-N 0 0 368.393 3.839 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H]1CCCC[C@H]1OC(F)F ZINC000504837823 943824372 /nfs/dbraw/zinc/82/43/72/943824372.db2.gz XWYKXWQDIQGHBL-BXUZGUMPSA-N 0 0 373.356 3.665 20 5 FHBDRN COc1cc(COc2ccc3c(c2)OC(C)(C)CC3=O)ccc1[N+](=O)[O-] ZINC000516919962 943829088 /nfs/dbraw/zinc/82/90/88/943829088.db2.gz ZAOWGDLCRKCYGM-UHFFFAOYSA-N 0 0 357.362 3.926 20 5 FHBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1COc1cccc(C(=O)N(C)C)c1 ZINC000105393667 943831534 /nfs/dbraw/zinc/83/15/34/943831534.db2.gz BMSSXBZVFSQCFK-UHFFFAOYSA-N 0 0 358.394 3.663 20 5 FHBDRN CCN(Cc1cnn(C)c1)Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000092437924 943839209 /nfs/dbraw/zinc/83/92/09/943839209.db2.gz ZATWVPULAHZXHJ-UHFFFAOYSA-N 0 0 370.409 3.619 20 5 FHBDRN CC[C@@H](NS(=O)(=O)c1cccc([N+](=O)[O-])c1)c1cccc(Cl)c1 ZINC000515374778 943839661 /nfs/dbraw/zinc/83/96/61/943839661.db2.gz MLAWXRGTVZUAPK-OAHLLOKOSA-N 0 0 354.815 3.678 20 5 FHBDRN COC(=O)c1cnc([C@@H](C)N[C@H]2CCCc3ccc([N+](=O)[O-])cc32)s1 ZINC000424322182 943843918 /nfs/dbraw/zinc/84/39/18/943843918.db2.gz HZYLIXDPBXYIHA-YGRLFVJLSA-N 0 0 361.423 3.566 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)[C@H]1CCCOC1 ZINC000504853396 943845371 /nfs/dbraw/zinc/84/53/71/943845371.db2.gz PYOXJBUFMFTDAG-OLZOCXBDSA-N 0 0 352.456 3.640 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)[C@@H]1CCCOC1 ZINC000504853395 943845486 /nfs/dbraw/zinc/84/54/86/943845486.db2.gz PYOXJBUFMFTDAG-CHWSQXEVSA-N 0 0 352.456 3.640 20 5 FHBDRN O=C(N[C@H]1C[C@H](c2cccc(C(F)(F)F)c2)C1)c1ccc([N+](=O)[O-])[nH]1 ZINC000437475564 943845497 /nfs/dbraw/zinc/84/54/97/943845497.db2.gz PQPAYYQSCLZBAS-UMSPYCQHSA-N 0 0 353.300 3.618 20 5 FHBDRN CCCOc1cc(NC(=O)[C@]2(C)C[C@@H]2F)c([N+](=O)[O-])cc1OCCC ZINC000425414354 943848017 /nfs/dbraw/zinc/84/80/17/943848017.db2.gz HWSOJWPDIDANNF-DOTOQJQBSA-N 0 0 354.378 3.859 20 5 FHBDRN COc1ccccc1Oc1ccc(NC(=O)c2cc([N+](=O)[O-])c[nH]2)cc1 ZINC000053353303 943854175 /nfs/dbraw/zinc/85/41/75/943854175.db2.gz AZRCCWJZQIKLSH-UHFFFAOYSA-N 0 0 353.334 3.976 20 5 FHBDRN C[C@@H](NC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1)[C@H]1CCCOC1 ZINC000504867540 943856317 /nfs/dbraw/zinc/85/63/17/943856317.db2.gz SCUAJNGBJATDPP-ZBFHGGJFSA-N 0 0 369.421 3.883 20 5 FHBDRN O=C(Nc1ccc2oc(=O)[nH]c2c1)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000435921844 943857693 /nfs/dbraw/zinc/85/76/93/943857693.db2.gz FWOPVSOMJNORPP-UHFFFAOYSA-N 0 0 371.352 3.780 20 5 FHBDRN C[C@H]1CN(C(=O)c2ccc(N3C[C@H](C)C[C@@H](C)C3)c([N+](=O)[O-])c2)C[C@H]1C ZINC000435932249 943866747 /nfs/dbraw/zinc/86/67/47/943866747.db2.gz ASOUQHLVQLVZOX-FPCVCCKLSA-N 0 0 359.470 3.805 20 5 FHBDRN C[C@H]1CN(C(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[C@@H]1C ZINC000435935158 943869190 /nfs/dbraw/zinc/86/91/90/943869190.db2.gz BTHKMBNYXNQBLM-QWRGUYRKSA-N 0 0 359.348 3.530 20 5 FHBDRN C[C@@H]1C[C@@H]1[C@@H](Nc1nccc(C(N)=O)c1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000290761442 943873989 /nfs/dbraw/zinc/87/39/89/943873989.db2.gz KAUVKYQKWWQOJH-IIMNLJJBSA-N 0 0 360.801 3.551 20 5 FHBDRN C[C@@H](c1ccccn1)N(C)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425425475 943874083 /nfs/dbraw/zinc/87/40/83/943874083.db2.gz UMVLXVFNIOFBMI-NSHDSACASA-N 0 0 350.216 3.945 20 5 FHBDRN CCOc1cc(C(=O)Nc2cc(C3CC3)ccn2)c([N+](=O)[O-])cc1OC ZINC000515446261 943880223 /nfs/dbraw/zinc/88/02/23/943880223.db2.gz ZFVDNASWFROTCF-UHFFFAOYSA-N 0 0 357.366 3.527 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]cc(Cc3noc(/C=C\c4cccc(O)c4)n3)c2c1 ZINC000435958652 943881529 /nfs/dbraw/zinc/88/15/29/943881529.db2.gz OSLDUEVLBVBQQO-DAXSKMNVSA-N 0 0 362.345 3.926 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)N[C@@H]1[C@@H]2CCc3ccccc3[C@@H]21 ZINC000435967397 943890129 /nfs/dbraw/zinc/89/01/29/943890129.db2.gz NXSADSUCYOSYCL-HLAWJBBLSA-N 0 0 365.433 3.632 20 5 FHBDRN CNc1ccc(C(=O)NCc2ccccc2OC2CCCC2)cc1[N+](=O)[O-] ZINC000515454469 943892435 /nfs/dbraw/zinc/89/24/35/943892435.db2.gz VGJYYRZQCZWFRJ-UHFFFAOYSA-N 0 0 369.421 3.888 20 5 FHBDRN O=C(CN1CCS[C@@H]2CCCC[C@H]21)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000437531025 943892825 /nfs/dbraw/zinc/89/28/25/943892825.db2.gz ZFFNEBFILLZDJD-UKRRQHHQSA-N 0 0 369.874 3.547 20 5 FHBDRN Cc1cc(-c2csc(NC(=O)COc3cccc([N+](=O)[O-])c3)n2)c(C)o1 ZINC000515457451 943894239 /nfs/dbraw/zinc/89/42/39/943894239.db2.gz HFELXHIAGPGQJD-UHFFFAOYSA-N 0 0 373.390 3.946 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1cccc(NC(N)=O)c1 ZINC000505736336 943909377 /nfs/dbraw/zinc/90/93/77/943909377.db2.gz OMASWCWOZRGCIW-UHFFFAOYSA-N 0 0 374.422 3.840 20 5 FHBDRN Cc1cc(Cc2noc(-c3cccc4c3CC(=O)CC4)n2)ccc1[N+](=O)[O-] ZINC000584499441 943919737 /nfs/dbraw/zinc/91/97/37/943919737.db2.gz LZOQRKYEBSICSN-UHFFFAOYSA-N 0 0 363.373 3.602 20 5 FHBDRN COc1ccc(CNC(=O)c2ccc3ccc(Cl)cc3n2)cc1[N+](=O)[O-] ZINC000437569470 943926249 /nfs/dbraw/zinc/92/62/49/943926249.db2.gz PONHYRLEQQREFE-UHFFFAOYSA-N 0 0 371.780 3.735 20 5 FHBDRN CC1=C[C@H](C)CN(C(=O)c2cccc3c(=O)c4cccc(F)c4[nH]c23)C1 ZINC000436011125 943927269 /nfs/dbraw/zinc/92/72/69/943927269.db2.gz NWQWYVIEFQKZLX-LBPRGKRZSA-N 0 0 350.393 3.859 20 5 FHBDRN C[C@@H](Cc1ccc(Cl)cc1Cl)NC(=O)c1ccc([N+](=O)[O-])n1C ZINC000504947986 943929636 /nfs/dbraw/zinc/92/96/36/943929636.db2.gz HDILSQZJFWZPAT-VIFPVBQESA-N 0 0 356.209 3.601 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NCCc1cc(F)c(F)c(F)c1 ZINC000504948366 943929690 /nfs/dbraw/zinc/92/96/90/943929690.db2.gz GYWMRWDOMHSYNQ-UHFFFAOYSA-N 0 0 366.339 3.910 20 5 FHBDRN COC(=O)C[C@@H](NC(=O)Nc1cccc([N+](=O)[O-])c1C)C1CCCCC1 ZINC000437578267 943933493 /nfs/dbraw/zinc/93/34/93/943933493.db2.gz JDZCVWIHAOAJDM-OAHLLOKOSA-N 0 0 363.414 3.537 20 5 FHBDRN Cc1c(N[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)cnn1-c1ccccc1 ZINC000126486431 943935999 /nfs/dbraw/zinc/93/59/99/943935999.db2.gz DXFBKRKOGJJKCT-ZDUSSCGKSA-N 0 0 365.393 3.528 20 5 FHBDRN COc1cccc(C(=O)N[C@H](C)c2ccc3ncsc3c2)c1[N+](=O)[O-] ZINC000436004995 943937713 /nfs/dbraw/zinc/93/77/13/943937713.db2.gz KUOJDOHWIGCBJH-SNVBAGLBSA-N 0 0 357.391 3.704 20 5 FHBDRN COc1ccc2c(c1)C[C@H](C)N(C(=O)c1cccc(OC)c1[N+](=O)[O-])[C@H]2C ZINC000436020921 943940280 /nfs/dbraw/zinc/94/02/80/943940280.db2.gz MOIHZSGAGJYNHQ-STQMWFEESA-N 0 0 370.405 3.760 20 5 FHBDRN CCCN(C(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1)[C@H](C)C(=O)OCC ZINC000436325306 943944417 /nfs/dbraw/zinc/94/44/17/943944417.db2.gz NICBKLVNGRYQPN-CYBMUJFWSA-N 0 0 350.415 3.522 20 5 FHBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N[C@H](CC(F)(F)F)c2ccccc2)c1 ZINC000515518014 943949783 /nfs/dbraw/zinc/94/97/83/943949783.db2.gz OQZDYVYBJLRRBJ-CQSZACIVSA-N 0 0 374.340 3.567 20 5 FHBDRN Cc1cc(OCC(=O)Nc2ccc3cn(C(C)C)nc3c2)ccc1[N+](=O)[O-] ZINC000437587187 943949930 /nfs/dbraw/zinc/94/99/30/943949930.db2.gz FWIWDFQGWFDJDX-UHFFFAOYSA-N 0 0 368.393 3.851 20 5 FHBDRN CCc1ccc(C(=O)Nc2ccccc2N[C@H](C)COC)cc1[N+](=O)[O-] ZINC000437588596 943950457 /nfs/dbraw/zinc/95/04/57/943950457.db2.gz JNOFNKDRDBEQPZ-CYBMUJFWSA-N 0 0 357.410 3.856 20 5 FHBDRN COC(=O)C(C)(C)c1ccc(NC(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 ZINC000437590913 943952000 /nfs/dbraw/zinc/95/20/00/943952000.db2.gz NRCCHFPHUNVTRN-UHFFFAOYSA-N 0 0 371.393 3.998 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N(C)[C@H](C)c1ccc(F)c(F)c1 ZINC000515508068 943959550 /nfs/dbraw/zinc/95/95/50/943959550.db2.gz YRLKRGNQGSJWRE-LLVKDONJSA-N 0 0 370.377 3.563 20 5 FHBDRN CSC[C@@H]1CCCN(Cc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000425450872 943964559 /nfs/dbraw/zinc/96/45/59/943964559.db2.gz WFCJDDUBFLSPEL-LLVKDONJSA-N 0 0 359.289 3.932 20 5 FHBDRN CCN(CCCNC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000515530724 943966187 /nfs/dbraw/zinc/96/61/87/943966187.db2.gz RNEPUGWITQUEIR-INIZCTEOSA-N 0 0 370.453 3.872 20 5 FHBDRN Cc1cccc(F)c1CNC(=O)c1cc2ccccc2c([N+](=O)[O-])c1N ZINC001126442938 943971164 /nfs/dbraw/zinc/97/11/64/943971164.db2.gz UITDJJQQJXBAOW-UHFFFAOYSA-N 0 0 353.353 3.708 20 5 FHBDRN CCOc1cc(NC(=O)N2C[C@@H](C)[C@H](C)C2)c([N+](=O)[O-])cc1OCC ZINC000437613099 943971570 /nfs/dbraw/zinc/97/15/70/943971570.db2.gz ADLPIYPLLQBMRB-VXGBXAGGSA-N 0 0 351.403 3.512 20 5 FHBDRN CCC[C@@H]1C[C@@H]1NC(=O)c1cc(F)cc2c(=O)c3cccc(F)c3[nH]c12 ZINC000436048697 943972128 /nfs/dbraw/zinc/97/21/28/943972128.db2.gz WKODLMXYTXBWSB-HWPZZCPQSA-N 0 0 356.372 3.878 20 5 FHBDRN CC(C)NC(=O)Nc1cccc(-c2nc(-c3cccc([N+](=O)[O-])c3)no2)c1 ZINC000505024927 943976779 /nfs/dbraw/zinc/97/67/79/943976779.db2.gz PYWHXUULOOKMJX-UHFFFAOYSA-N 0 0 367.365 3.842 20 5 FHBDRN COCC[C@H](NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1)c1ccco1 ZINC000505029602 943986507 /nfs/dbraw/zinc/98/65/07/943986507.db2.gz HSSUQJQFNHSZTM-ZDUSSCGKSA-N 0 0 360.391 3.910 20 5 FHBDRN Cc1cc(CN(C)C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)ccc1F ZINC000436071013 943991815 /nfs/dbraw/zinc/99/18/15/943991815.db2.gz BDKVCZBBIBVZLR-UHFFFAOYSA-N 0 0 368.368 3.500 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)N[C@@H]1C[C@H]1c1ccc(Cl)c(F)c1 ZINC000437644232 943994425 /nfs/dbraw/zinc/99/44/25/943994425.db2.gz FGJASKZTZQXNHA-XJKSGUPXSA-N 0 0 363.776 3.743 20 5 FHBDRN CC(=O)c1ccc(OCCCc2nc(-c3cccc([N+](=O)[O-])c3)no2)cc1 ZINC000505039581 943996346 /nfs/dbraw/zinc/99/63/46/943996346.db2.gz PVYLOVXRFUUOMA-UHFFFAOYSA-N 0 0 367.361 3.859 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(OCc2noc(-c3ccc(F)cc3F)n2)n1 ZINC000436055362 943996483 /nfs/dbraw/zinc/99/64/83/943996483.db2.gz WDCMDKFIKSVIAM-UHFFFAOYSA-N 0 0 362.292 3.514 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])Nc1ccc(Oc2ccccn2)cc1 ZINC000505752139 943998517 /nfs/dbraw/zinc/99/85/17/943998517.db2.gz CEKQHOGQWWOLLM-UHFFFAOYSA-N 0 0 364.361 3.833 20 5 FHBDRN C[C@@H](CNC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N1CCc2ccccc21 ZINC000505058286 944002159 /nfs/dbraw/zinc/00/21/59/944002159.db2.gz RZFNYJNPZKYJHY-LBPRGKRZSA-N 0 0 374.828 3.821 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1-c1noc([C@@H](C)c2ccc3c(c2)OCO3)n1 ZINC000566538676 944003392 /nfs/dbraw/zinc/00/33/92/944003392.db2.gz BGXFRHBXCNKFPU-NSHDSACASA-N 0 0 353.334 3.834 20 5 FHBDRN O=C(N[C@H]1CCSc2ccc(Cl)cc21)c1cc([O-])cc([N+](=O)[O-])c1 ZINC000505752996 944005970 /nfs/dbraw/zinc/00/59/70/944005970.db2.gz MMHANPSIHNXRBN-AWEZNQCLSA-N 0 0 364.810 3.921 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@H](C)c1cc(C)cc(C)c1 ZINC000515561230 944011684 /nfs/dbraw/zinc/01/16/84/944011684.db2.gz FSLPWCJBNBEUHY-CQSZACIVSA-N 0 0 369.421 3.590 20 5 FHBDRN COc1ccc([C@H](C)N(C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)cc1 ZINC000506101274 944023781 /nfs/dbraw/zinc/02/37/81/944023781.db2.gz CNXYVOKKBPDSII-ZDUSSCGKSA-N 0 0 368.393 3.846 20 5 FHBDRN O=C(NCCNc1ccc([N+](=O)[O-])cc1)N[C@@H](c1cccs1)C1CC1 ZINC000505091397 944032723 /nfs/dbraw/zinc/03/27/23/944032723.db2.gz VZKXDXWCMBLTSK-MRXNPFEDSA-N 0 0 360.439 3.519 20 5 FHBDRN C[C@@H](c1cc(F)ccc1F)N(C)C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000126554471 944039646 /nfs/dbraw/zinc/03/96/46/944039646.db2.gz WHMWNXYGZSGFQF-LBPRGKRZSA-N 0 0 363.364 3.818 20 5 FHBDRN Cc1c(CC(=O)N[C@H](c2ccccc2)C(F)(F)F)cccc1[N+](=O)[O-] ZINC000162544231 944044529 /nfs/dbraw/zinc/04/45/29/944044529.db2.gz RLDZIWUPEHSZNY-MRXNPFEDSA-N 0 0 352.312 3.866 20 5 FHBDRN C[C@@H]1CN(C)C[C@@H](c2nc(-c3c4ccccc4nc4ccccc43)no2)O1 ZINC000924145527 944045438 /nfs/dbraw/zinc/04/54/38/944045438.db2.gz DGVCPRVIFVYJCM-ACJLOTCBSA-N 0 0 360.417 3.830 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1CN1CCOCc2ccccc21 ZINC000425473453 944046946 /nfs/dbraw/zinc/04/69/46/944046946.db2.gz JBSHVSNQHAKIPF-UHFFFAOYSA-N 0 0 363.211 3.894 20 5 FHBDRN O=C(CSc1ccccc1[N+](=O)[O-])N1CC[C@@H](c2ccccc2F)C1 ZINC000500071597 944048204 /nfs/dbraw/zinc/04/82/04/944048204.db2.gz YBZVHVUWBWICPE-CYBMUJFWSA-N 0 0 360.410 3.842 20 5 FHBDRN Cc1cn2cc(C(=O)N(Cc3ccc([N+](=O)[O-])cc3)C(C)C)sc2n1 ZINC000505121764 944051113 /nfs/dbraw/zinc/05/11/13/944051113.db2.gz YGZMOBKGIGJASE-UHFFFAOYSA-N 0 0 358.423 3.663 20 5 FHBDRN CC(C)(C)CN(CC(F)(F)F)C(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000110300622 944056548 /nfs/dbraw/zinc/05/65/48/944056548.db2.gz BPXSXWGTHRMBBC-UHFFFAOYSA-N 0 0 362.348 3.801 20 5 FHBDRN O=C(CCOc1ccc(Cl)c(Cl)c1)NCc1ccc([N+](=O)[O-])cc1 ZINC000515628055 944061188 /nfs/dbraw/zinc/06/11/88/944061188.db2.gz YRMHUIXIMUEDEC-UHFFFAOYSA-N 0 0 369.204 3.987 20 5 FHBDRN Cc1c(C(=O)N2CCO[C@H](c3ccccc3Cl)C2)cccc1[N+](=O)[O-] ZINC000505131432 944061829 /nfs/dbraw/zinc/06/18/29/944061829.db2.gz RTCRDDLGOKZZOU-KRWDZBQOSA-N 0 0 360.797 3.770 20 5 FHBDRN CC[C@@H](C)[C@@H](NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)C(F)(F)F ZINC000436166551 944069629 /nfs/dbraw/zinc/06/96/29/944069629.db2.gz CUTHLCOISMOCMS-RFAUZJTJSA-N 0 0 357.332 3.712 20 5 FHBDRN COC(=O)[C@@H](C)Sc1ccccc1C(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000515638668 944072106 /nfs/dbraw/zinc/07/21/06/944072106.db2.gz XQCQNMMDYFNAHW-GFCCVEGCSA-N 0 0 374.418 3.809 20 5 FHBDRN Cn1cc([N+](=O)[O-])cc1C(=O)N(Cc1ccccn1)c1ccc(Cl)cc1 ZINC000515626216 944077930 /nfs/dbraw/zinc/07/79/30/944077930.db2.gz SXLSMUFLCHDBQP-UHFFFAOYSA-N 0 0 370.796 3.829 20 5 FHBDRN C[C@H](c1ccccc1)[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])c(C(=O)[O-])c2)C1 ZINC000515655498 944080257 /nfs/dbraw/zinc/08/02/57/944080257.db2.gz JVXLVCOVDGTSGW-CZUORRHYSA-N 0 0 355.394 3.540 20 5 FHBDRN Cc1noc(C)c1CCCNC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000123089053 944085130 /nfs/dbraw/zinc/08/51/30/944085130.db2.gz KPDRHBQADNXUCR-UHFFFAOYSA-N 0 0 372.425 3.506 20 5 FHBDRN CCOc1cc(Sc2ccc(S(C)(=O)=O)cc2)ccc1[N+](=O)[O-] ZINC000092634606 944085260 /nfs/dbraw/zinc/08/52/60/944085260.db2.gz WOFQXGNNGGGCEQ-UHFFFAOYSA-N 0 0 353.421 3.548 20 5 FHBDRN CC[C@H](C)[C@@H](NC(=O)CSc1ccccc1[N+](=O)[O-])C(F)(F)F ZINC000436173273 944085690 /nfs/dbraw/zinc/08/56/90/944085690.db2.gz RLLKSSFIQZBBKZ-TVQRCGJNSA-N 0 0 350.362 3.780 20 5 FHBDRN O=C(CCN(Cc1ccccc1)CC(F)F)Nc1ccccc1[N+](=O)[O-] ZINC000500100783 944095816 /nfs/dbraw/zinc/09/58/16/944095816.db2.gz ZRMDPBQBGFAJGU-UHFFFAOYSA-N 0 0 363.364 3.691 20 5 FHBDRN C[C@@H](Cn1ncc2ccccc21)c1nc(-c2ccc([N+](=O)[O-])s2)no1 ZINC000517202025 944099292 /nfs/dbraw/zinc/09/92/92/944099292.db2.gz NPEOOCSQYYCOBS-JTQLQIEISA-N 0 0 355.379 3.860 20 5 FHBDRN C[C@@H](Nc1nn2cc(C3CCCC3)nc2s1)c1cccc([N+](=O)[O-])c1 ZINC000436194455 944106166 /nfs/dbraw/zinc/10/61/66/944106166.db2.gz BARZIAITMQIDBZ-LLVKDONJSA-N 0 0 357.439 3.952 20 5 FHBDRN CCNc1ccc(C(=O)Nc2ccc(C)cc2OCCOC)cc1[N+](=O)[O-] ZINC000515688109 944116224 /nfs/dbraw/zinc/11/62/24/944116224.db2.gz PHPWUUFKEOAIGG-UHFFFAOYSA-N 0 0 373.409 3.613 20 5 FHBDRN Cc1cc([N+](=O)[O-])cnc1Oc1ccc([N+](=O)[O-])cc1Br ZINC000092656160 944116541 /nfs/dbraw/zinc/11/65/41/944116541.db2.gz YRUMCALDEAYQLV-UHFFFAOYSA-N 0 0 354.116 3.761 20 5 FHBDRN CO[C@@H]1CCN(Cc2ccc(Br)cc2[N+](=O)[O-])CC1(C)C ZINC000425495792 944117786 /nfs/dbraw/zinc/11/77/86/944117786.db2.gz TWHHGBQLXDRCAQ-CQSZACIVSA-N 0 0 357.248 3.604 20 5 FHBDRN Cc1cc(Cl)nc(CNC(=O)CCc2c(Cl)cccc2[N+](=O)[O-])c1 ZINC001270065461 944118957 /nfs/dbraw/zinc/11/89/57/944118957.db2.gz RHFRLBAEKUJPIQ-UHFFFAOYSA-N 0 0 368.220 3.854 20 5 FHBDRN COC[C@H]1CCCN(Cc2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000425495242 944120082 /nfs/dbraw/zinc/12/00/82/944120082.db2.gz SEZBEUMHOLZCBD-LBPRGKRZSA-N 0 0 357.248 3.606 20 5 FHBDRN Cc1nc(COC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)no1 ZINC000184026932 944120728 /nfs/dbraw/zinc/12/07/28/944120728.db2.gz OKVPZECOZLHMNT-UHFFFAOYSA-N 0 0 371.374 3.794 20 5 FHBDRN Cn1cc(-c2cc(COc3ccc([N+](=O)[O-])cc3C(F)(F)F)on2)cn1 ZINC000183995777 944133307 /nfs/dbraw/zinc/13/33/07/944133307.db2.gz OOYFRQKJVVGYAV-UHFFFAOYSA-N 0 0 368.271 3.581 20 5 FHBDRN Cc1c(F)ccc([N+](=O)[O-])c1C(=O)OCc1nc(-c2ccccn2)cs1 ZINC001270275189 944138061 /nfs/dbraw/zinc/13/80/61/944138061.db2.gz JLBIVKIPLYYFFL-UHFFFAOYSA-N 0 0 373.365 3.918 20 5 FHBDRN CC[C@@H](N[C@H]1CCc2c1cccc2[N+](=O)[O-])c1nnc2n1CCCCC2 ZINC000517245743 944138337 /nfs/dbraw/zinc/13/83/37/944138337.db2.gz AJHVUWNNHZYEBY-CVEARBPZSA-N 0 0 355.442 3.641 20 5 FHBDRN COc1cc(C(=O)N2CC[C@H](C(C)(C)C)C[C@@H]2C)c([N+](=O)[O-])cc1OC ZINC000517260800 944141664 /nfs/dbraw/zinc/14/16/64/944141664.db2.gz ITKSLTOOKHYNAD-STQMWFEESA-N 0 0 364.442 3.899 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N[C@@H]1CCCC[C@@H]1n1cccn1 ZINC000072734858 944144484 /nfs/dbraw/zinc/14/44/84/944144484.db2.gz WXVDCEWQQZAOSL-CABCVRRESA-N 0 0 363.805 3.750 20 5 FHBDRN CCOc1cccc([C@@H]2C[C@H]2NC(=O)Nc2cc([N+](=O)[O-])ccc2C)c1 ZINC000436259155 944151386 /nfs/dbraw/zinc/15/13/86/944151386.db2.gz DLCVBMUHFROFQY-FUHWJXTLSA-N 0 0 355.394 3.980 20 5 FHBDRN Cc1ccc(C)c(S(=O)(=O)Nc2cccc(F)c2Cl)c1[N+](=O)[O-] ZINC000517257886 944152458 /nfs/dbraw/zinc/15/24/58/944152458.db2.gz IZUYREIIEYINQI-UHFFFAOYSA-N 0 0 358.778 3.805 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H]1C[C@H]1c1cccc(Cl)c1 ZINC000436265314 944156855 /nfs/dbraw/zinc/15/68/55/944156855.db2.gz WWKBVRRFDUKSTN-UONOGXRCSA-N 0 0 361.785 3.934 20 5 FHBDRN CC(=O)N(c1ccc(NC(=O)c2cc(C)cc([N+](=O)[O-])c2)cc1)[C@@H]1C[C@H]1C ZINC000566580898 944162025 /nfs/dbraw/zinc/16/20/25/944162025.db2.gz HROISIIKGUDVIX-BFUOFWGJSA-N 0 0 367.405 3.917 20 5 FHBDRN COc1ccccc1[C@@H]1CCCN1C(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000123137990 944176630 /nfs/dbraw/zinc/17/66/30/944176630.db2.gz AEJAORMVGOUQIE-INIZCTEOSA-N 0 0 371.393 3.981 20 5 FHBDRN O=C(NC[C@@H]1CC2c3ccccc3C1c1ccccc12)c1ccc([N+](=O)[O-])[nH]1 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FHBDRN COc1ccc([C@H]2Nc3ccccc3C(=O)N2CC(C)C)cc1[N+](=O)[O-] ZINC000517370680 944251006 /nfs/dbraw/zinc/25/10/06/944251006.db2.gz LLBAVCNXGXXJSN-SFHVURJKSA-N 0 0 355.394 3.826 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)F)cc1N1CCO[C@H](c2cccc(F)c2)C1 ZINC000436381636 944251021 /nfs/dbraw/zinc/25/10/21/944251021.db2.gz AFUIUDJSZLVOKB-AWEZNQCLSA-N 0 0 371.290 3.726 20 5 FHBDRN CC(C)(C(=O)N[C@@H]1CCO[C@@H](c2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000500201267 944259149 /nfs/dbraw/zinc/25/91/49/944259149.db2.gz XLDMMOVPGWXQRV-VQIMIIECSA-N 0 0 368.433 3.909 20 5 FHBDRN CC(C)(C(=O)N[C@@H]1CCO[C@H](c2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000500201264 944259270 /nfs/dbraw/zinc/25/92/70/944259270.db2.gz XLDMMOVPGWXQRV-APWZRJJASA-N 0 0 368.433 3.909 20 5 FHBDRN Cc1noc(C2CCC(Nc3cc(C(F)(F)F)ncc3[N+](=O)[O-])CC2)n1 ZINC000436390713 944259710 /nfs/dbraw/zinc/25/97/10/944259710.db2.gz PZBKXCFXMNRXAK-UHFFFAOYSA-N 0 0 371.319 3.838 20 5 FHBDRN Cn1c(-c2ccccc2)nn(CN2CCc3c2cccc3[N+](=O)[O-])c1=S ZINC000178918282 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CCCN(CC1CC1)C(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000426271609 944307030 /nfs/dbraw/zinc/30/70/30/944307030.db2.gz PMELOWUBQXPKMA-UHFFFAOYSA-N 0 0 359.348 3.945 20 5 FHBDRN Cc1cc2c(ncnc2N2CCN(c3cc(C)ccc3[N+](=O)[O-])CC2)s1 ZINC000436425366 944309715 /nfs/dbraw/zinc/30/97/15/944309715.db2.gz PURXCYPNDYFJPO-UHFFFAOYSA-N 0 0 369.450 3.543 20 5 FHBDRN COc1cccc(N2CCC(c3ncc4n3CCCC4)CC2)c1[N+](=O)[O-] ZINC000278831544 944315934 /nfs/dbraw/zinc/31/59/34/944315934.db2.gz KDRPHKUMNXZPJI-UHFFFAOYSA-N 0 0 356.426 3.520 20 5 FHBDRN O=C(NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N1C[C@H]2CCC[C@@H]2C1 ZINC000426274787 944318834 /nfs/dbraw/zinc/31/88/34/944318834.db2.gz DFVXVOKKBOTXIK-VXGBXAGGSA-N 0 0 357.332 3.555 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CSCc1cccc(C(=O)N(C)C)c1 ZINC000105633544 944320183 /nfs/dbraw/zinc/32/01/83/944320183.db2.gz GQVRKURUAQVONF-UHFFFAOYSA-N 0 0 360.435 3.739 20 5 FHBDRN CC(C)(C)c1nc(CSCc2ccc(C(N)=O)cc2[N+](=O)[O-])cs1 ZINC000105633384 944322464 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FHBDRN CNC(=O)c1ccc(Oc2ccc(C)cc2Br)c([N+](=O)[O-])c1 ZINC000053550733 944343984 /nfs/dbraw/zinc/34/39/84/944343984.db2.gz QXAMMRWXBKQNKY-UHFFFAOYSA-N 0 0 365.183 3.818 20 5 FHBDRN O=C(Nc1ccc(-c2nnc(-c3ccccc3)[nH]2)cc1)c1ccc([N+](=O)[O-])[nH]1 ZINC000438108288 944346316 /nfs/dbraw/zinc/34/63/16/944346316.db2.gz YUNPDRDKCSWUAX-UHFFFAOYSA-N 0 0 374.360 3.627 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)NCCSc1ccc(Cl)cc1 ZINC000015028661 944352035 /nfs/dbraw/zinc/35/20/35/944352035.db2.gz GSVPYCWPUBPYJE-UHFFFAOYSA-N 0 0 366.826 3.536 20 5 FHBDRN COc1cc(NC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])ccc1O ZINC000438128961 944356757 /nfs/dbraw/zinc/35/67/57/944356757.db2.gz QUUDRYKNPRKGEJ-UHFFFAOYSA-N 0 0 368.798 3.693 20 5 FHBDRN Cc1c([N+](=O)[O-])ccc(=O)n1CC(=O)c1ccc(C2CCCCC2)cc1 ZINC000436475796 944356986 /nfs/dbraw/zinc/35/69/86/944356986.db2.gz VVWQPDPWEKDBDG-UHFFFAOYSA-N 0 0 354.406 3.996 20 5 FHBDRN CC(C)c1nc(CS(=O)(=O)[C@H](C)c2cccc([N+](=O)[O-])c2)cs1 ZINC000105714636 944359841 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944448414 /nfs/dbraw/zinc/44/84/14/944448414.db2.gz LYNDYAVUJZUGJY-UHFFFAOYSA-N 0 0 356.426 3.942 20 5 FHBDRN COc1ccc([C@H](OC)[C@H](C)NC(=O)Nc2ccc([N+](=O)[O-])c(C)c2)cc1 ZINC000473783637 944457596 /nfs/dbraw/zinc/45/75/96/944457596.db2.gz FBBVBDVHLPCCOI-SCLBCKFNSA-N 0 0 373.409 3.810 20 5 FHBDRN CC[C@H]1CCCCN1C(=O)[C@H](C)OC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000011028879 944457703 /nfs/dbraw/zinc/45/77/03/944457703.db2.gz RBTGPXHNPJQECX-RYUDHWBXSA-N 0 0 368.817 3.585 20 5 FHBDRN O=C(N[C@H]1C[C@H]1c1ccccc1C(F)(F)F)c1cc([O-])cc([N+](=O)[O-])c1 ZINC000506198794 944459248 /nfs/dbraw/zinc/45/92/48/944459248.db2.gz KWTOEIXCNFNOOH-ZFWWWQNUSA-N 0 0 366.295 3.605 20 5 FHBDRN O=C(N[C@@H]1C[C@H]1c1ccccc1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000425972944 944464361 /nfs/dbraw/zinc/46/43/61/944464361.db2.gz DOZLLZSIMRPBSO-RBUKOAKNSA-N 0 0 351.406 3.825 20 5 FHBDRN Cc1ccc(NC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)c2n[nH]cc21 ZINC000437793261 944466047 /nfs/dbraw/zinc/46/60/47/944466047.db2.gz 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ZINC000425596897 944494540 /nfs/dbraw/zinc/49/45/40/944494540.db2.gz QAPXFYOFGDKYHY-ZDUSSCGKSA-N 0 0 368.315 3.562 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NCc1ccc(OC(F)F)c(OC)c1 ZINC000017524483 944496047 /nfs/dbraw/zinc/49/60/47/944496047.db2.gz NGDHQKLKTAJZCV-UHFFFAOYSA-N 0 0 354.309 3.826 20 5 FHBDRN C[C@@H](COCC(F)(F)F)Nc1ccc(Br)cc1[N+](=O)[O-] ZINC000110459688 944501634 /nfs/dbraw/zinc/50/16/34/944501634.db2.gz AUPKBKWCLLSIAU-ZETCQYMHSA-N 0 0 357.126 3.737 20 5 FHBDRN Cn1c(NC(=O)C(C)(C)c2ccccc2[N+](=O)[O-])nc2ccc(F)cc21 ZINC000500324347 944518684 /nfs/dbraw/zinc/51/86/84/944518684.db2.gz RJMSMXGKYVCVOO-UHFFFAOYSA-N 0 0 356.357 3.537 20 5 FHBDRN COc1cccc(C(=O)CCCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)c1 ZINC000426347232 944518704 /nfs/dbraw/zinc/51/87/04/944518704.db2.gz KUJPZCVMOWDDPI-UHFFFAOYSA-N 0 0 367.361 3.859 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N(C)CCCOCc1ccccc1 ZINC000439317941 944524647 /nfs/dbraw/zinc/52/46/47/944524647.db2.gz PXVPHFFFKQSOBH-UHFFFAOYSA-N 0 0 357.410 3.974 20 5 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ZINC000517725342 944539864 /nfs/dbraw/zinc/53/98/64/944539864.db2.gz RFUQBLYLMYTRQD-FPMFFAJLSA-N 0 0 371.359 3.673 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)NCCc1cccc2[nH]ccc21 ZINC000506214851 944542974 /nfs/dbraw/zinc/54/29/74/944542974.db2.gz KGAYEROJKWROAZ-UHFFFAOYSA-N 0 0 357.797 3.631 20 5 FHBDRN CCCOCc1ccccc1CNC(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000047100268 944544518 /nfs/dbraw/zinc/54/45/18/944544518.db2.gz BPFRQCDMYZWIMT-UHFFFAOYSA-N 0 0 373.409 3.852 20 5 FHBDRN Cc1c(NC(=O)[C@H](C)N(C)Cc2ccc(F)cc2F)cccc1[N+](=O)[O-] ZINC000025071526 944545279 /nfs/dbraw/zinc/54/52/79/944545279.db2.gz TWNRSKOCQXOCIV-LBPRGKRZSA-N 0 0 363.364 3.640 20 5 FHBDRN C[C@@H]1CN(C(=O)c2cc3cc([N+](=O)[O-])ccc3o2)C[C@H](c2ccccc2)O1 ZINC000518621689 944552100 /nfs/dbraw/zinc/55/21/00/944552100.db2.gz KFLLGSNVUSIPGC-BFUOFWGJSA-N 0 0 366.373 3.943 20 5 FHBDRN Cc1cc(N2CC[C@@]3(C2)c2ccccc2NC3=O)c2cccc([N+](=O)[O-])c2n1 ZINC000614524751 944554983 /nfs/dbraw/zinc/55/49/83/944554983.db2.gz UYUCYXNSBRVWSI-OAQYLSRUSA-N 0 0 374.400 3.552 20 5 FHBDRN C[C@H](C(=O)N[C@@H]1CCCN(c2cccc(F)c2)C1)c1cccc([N+](=O)[O-])c1 ZINC000518641942 944561047 /nfs/dbraw/zinc/56/10/47/944561047.db2.gz YXMAPAVWWCXQGO-WMLDXEAASA-N 0 0 371.412 3.623 20 5 FHBDRN CC[C@@H](CSC)NC(=O)c1cc([N+](=O)[O-])cc(Br)c1C ZINC000516198606 944570563 /nfs/dbraw/zinc/57/05/63/944570563.db2.gz ZDORLXDJBDDWQW-VIFPVBQESA-N 0 0 361.261 3.537 20 5 FHBDRN O=[N+]([O-])c1cc(-c2nc(Cc3ccccc3F)no2)ccc1NC1CC1 ZINC000545546661 944578974 /nfs/dbraw/zinc/57/89/74/944578974.db2.gz YETCYKOTNYDFIC-UHFFFAOYSA-N 0 0 354.341 3.949 20 5 FHBDRN COc1cc2c(cc1Cl)CN(C(=O)c1ccc(C)c([N+](=O)[O-])c1)CC2 ZINC000516207312 944587697 /nfs/dbraw/zinc/58/76/97/944587697.db2.gz NLELLQGQJVXWGJ-UHFFFAOYSA-N 0 0 360.797 3.764 20 5 FHBDRN COc1ccc(NC(=O)c2ncsc2-c2ccccc2)cc1[N+](=O)[O-] ZINC000438431188 944595280 /nfs/dbraw/zinc/59/52/80/944595280.db2.gz HSJMBEMYOGTJTQ-UHFFFAOYSA-N 0 0 355.375 3.979 20 5 FHBDRN CCNC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])c(OC)c1 ZINC000045165205 944597389 /nfs/dbraw/zinc/59/73/89/944597389.db2.gz QGELNBCYGJSCQJ-UHFFFAOYSA-N 0 0 350.758 3.799 20 5 FHBDRN CC(=O)c1cc(NCc2nc(-c3cccc([N+](=O)[O-])c3)no2)ccc1F ZINC000506233167 944597459 /nfs/dbraw/zinc/59/74/59/944597459.db2.gz NTPXMXCYTLZMLK-UHFFFAOYSA-N 0 0 356.313 3.599 20 5 FHBDRN C[C@@H](Cc1cccc(O)c1)NC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000426009596 944598109 /nfs/dbraw/zinc/59/81/09/944598109.db2.gz XVUOHDKUZQIOKS-AWEZNQCLSA-N 0 0 369.421 3.606 20 5 FHBDRN Cc1c(F)ccc([N+](=O)[O-])c1C(=O)Nc1ccc(N2CCCCC2)nc1 ZINC000843760571 944603572 /nfs/dbraw/zinc/60/35/72/944603572.db2.gz NZBSBZLFSBMHDG-UHFFFAOYSA-N 0 0 358.373 3.680 20 5 FHBDRN Cc1csc([C@@H]2CCCCN2Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)n1 ZINC000516238672 944607644 /nfs/dbraw/zinc/60/76/44/944607644.db2.gz AKVNMXXZOVASQI-HNNXBMFYSA-N 0 0 357.439 3.963 20 5 FHBDRN CC[C@@H](NC(=O)N1CCOc2ccc(F)cc2C1)c1cccc([N+](=O)[O-])c1 ZINC000426013246 944610687 /nfs/dbraw/zinc/61/06/87/944610687.db2.gz MMLXMCSYTSGYGI-QGZVFWFLSA-N 0 0 373.384 3.789 20 5 FHBDRN COC(=O)c1ccc(Cl)c(COc2c(Cl)cncc2[N+](=O)[O-])c1 ZINC000506581238 944629239 /nfs/dbraw/zinc/62/92/39/944629239.db2.gz YDYFLZJLIGOBRA-UHFFFAOYSA-N 0 0 357.149 3.662 20 5 FHBDRN COc1cc(-c2noc(/C=C\c3ccc(F)cc3[N+](=O)[O-])n2)ccc1O ZINC000436787929 944635141 /nfs/dbraw/zinc/63/51/41/944635141.db2.gz ZVMDISHHAHCTJU-DAXSKMNVSA-N 0 0 357.297 3.669 20 5 FHBDRN CC(C)OC(=O)CCNc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000015118575 944636770 /nfs/dbraw/zinc/63/67/70/944636770.db2.gz SRDHQIYVMDJGBM-UHFFFAOYSA-N 0 0 356.378 3.579 20 5 FHBDRN CC/C(=C\C(=O)NCCc1cccc([N+](=O)[O-])c1)c1ccc(OC)cc1 ZINC000759869995 944643696 /nfs/dbraw/zinc/64/36/96/944643696.db2.gz JXYIBBIHEKSLOI-JQIJEIRASA-N 0 0 354.406 3.756 20 5 FHBDRN COc1ccc(CSCC(=O)N[C@@H]2CCCCC2(C)C)cc1[N+](=O)[O-] ZINC000466882508 944644587 /nfs/dbraw/zinc/64/45/87/944644587.db2.gz BWEKXTPJADRPJW-MRXNPFEDSA-N 0 0 366.483 3.922 20 5 FHBDRN COCCOc1cccc(NC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000517804948 944653280 /nfs/dbraw/zinc/65/32/80/944653280.db2.gz RTSAGDROQJWQFT-UHFFFAOYSA-N 0 0 365.773 3.917 20 5 FHBDRN Nc1c(C(=O)N(Cc2ccccc2Cl)CC2CC2)cccc1[N+](=O)[O-] ZINC000516267367 944660584 /nfs/dbraw/zinc/66/05/84/944660584.db2.gz BWDDWEXEIILTFA-UHFFFAOYSA-N 0 0 359.813 3.883 20 5 FHBDRN Cc1ccc(C[C@H](C)NC(=O)NCCNc2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000518717074 944663663 /nfs/dbraw/zinc/66/36/63/944663663.db2.gz YBVJPYDAYIOOAI-INIZCTEOSA-N 0 0 370.453 3.554 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])o1)N(Cc1cccc(Br)c1)C1CC1 ZINC000025089589 944665338 /nfs/dbraw/zinc/66/53/38/944665338.db2.gz QLMSZIQULUOEHJ-UHFFFAOYSA-N 0 0 365.183 3.755 20 5 FHBDRN Cc1nc(NC(=O)[C@H](C)Oc2ccc3ccccc3c2)ccc1[N+](=O)[O-] ZINC000436835649 944684426 /nfs/dbraw/zinc/68/44/26/944684426.db2.gz BFSGOCKZFMOYQH-ZDUSSCGKSA-N 0 0 351.362 3.857 20 5 FHBDRN C[C@H](NC(=O)CSc1ccccc1[N+](=O)[O-])c1c(F)cccc1F ZINC000506858937 944688613 /nfs/dbraw/zinc/68/86/13/944688613.db2.gz PDPMSDVVEJMCIE-JTQLQIEISA-N 0 0 352.362 3.843 20 5 FHBDRN CCN(CCc1cccs1)C(=O)CSc1ccccc1[N+](=O)[O-] ZINC000506877488 944695232 /nfs/dbraw/zinc/69/52/32/944695232.db2.gz RQDCRJHVKNDAES-UHFFFAOYSA-N 0 0 350.465 3.840 20 5 FHBDRN COc1ccc(CNC(=O)c2cc(C(C)C)c(O)cc2C)cc1[N+](=O)[O-] ZINC000436853628 944700364 /nfs/dbraw/zinc/70/03/64/944700364.db2.gz LHYYCFIUPOSWHY-UHFFFAOYSA-N 0 0 358.394 3.671 20 5 FHBDRN CCc1ccc(-c2noc(COc3c(Cl)cncc3[N+](=O)[O-])n2)cc1 ZINC000506595601 944706652 /nfs/dbraw/zinc/70/66/52/944706652.db2.gz QPXXTKGXUVSHPY-UHFFFAOYSA-N 0 0 360.757 3.835 20 5 FHBDRN Cc1ccc(N2CCN(C(=O)c3cc(Cl)cc([N+](=O)[O-])c3)CC2)cc1C ZINC000759886381 944731465 /nfs/dbraw/zinc/73/14/65/944731465.db2.gz MMBRHJVETTZBOZ-UHFFFAOYSA-N 0 0 373.840 3.827 20 5 FHBDRN C[C@H]1Oc2cc(F)ccc2[C@@H]1Nc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 ZINC000516337711 944738790 /nfs/dbraw/zinc/73/87/90/944738790.db2.gz YHLDUFLKDJJJQW-DYBLOJMWSA-N 0 0 357.341 3.553 20 5 FHBDRN CCn1c(C)nc([N+](=O)[O-])c1N[C@@H]1CC[C@H](c2ccccc2)C[C@@H]1OC ZINC000516337408 944738935 /nfs/dbraw/zinc/73/89/35/944738935.db2.gz JIXFRSPYMNSSCA-BBWFWOEESA-N 0 0 358.442 3.883 20 5 FHBDRN CCOC(=O)c1ccnc(N[C@@H]2CCCC[C@H]2SCC)c1[N+](=O)[O-] ZINC000426421513 944742414 /nfs/dbraw/zinc/74/24/14/944742414.db2.gz RRHBQVIBQPRRGA-CHWSQXEVSA-N 0 0 353.444 3.643 20 5 FHBDRN O=C([O-])[C@@H](Cc1c[nH]c2ccc([N+](=O)[O-])cc12)[NH2+]Cc1ccc(Cl)cc1 ZINC000426736682 944748627 /nfs/dbraw/zinc/74/86/27/944748627.db2.gz KBZLXXCJMONUHM-QGZVFWFLSA-N 0 0 373.796 3.515 20 5 FHBDRN COc1ccc([C@H](CCC(=O)[O-])[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000426736767 944748863 /nfs/dbraw/zinc/74/88/63/944748863.db2.gz ZAPBLERTDDJEPT-KRWDZBQOSA-N 0 0 358.394 3.608 20 5 FHBDRN C[C@@H](c1ccc(F)cc1)S(=O)(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000506925663 944757104 /nfs/dbraw/zinc/75/71/04/944757104.db2.gz JCLCIOJATQLGJR-VIFPVBQESA-N 0 0 359.325 3.688 20 5 FHBDRN COc1c(C(=O)NCCc2cc3ccccc3s2)cccc1[N+](=O)[O-] ZINC000506610864 944762846 /nfs/dbraw/zinc/76/28/46/944762846.db2.gz OMLXTXBCXKUEMM-UHFFFAOYSA-N 0 0 356.403 3.791 20 5 FHBDRN O=C(NCCc1cc2ccccc2s1)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000506619742 944766552 /nfs/dbraw/zinc/76/65/52/944766552.db2.gz DXZDJPALLHLVPF-UHFFFAOYSA-N 0 0 370.386 3.511 20 5 FHBDRN CC(C)[C@@H](NC(=O)c1cc(F)cc([N+](=O)[O-])c1)c1ccc2c(c1)OCCO2 ZINC000518788234 944769081 /nfs/dbraw/zinc/76/90/81/944769081.db2.gz WNQRNVIQLSFVJU-GOSISDBHSA-N 0 0 374.368 3.632 20 5 FHBDRN Cc1ccc(OCCNC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000015139645 944771795 /nfs/dbraw/zinc/77/17/95/944771795.db2.gz XJBRTQHYCYZINM-OAHLLOKOSA-N 0 0 374.462 3.887 20 5 FHBDRN C[C@@H]1CN(C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000518791299 944773657 /nfs/dbraw/zinc/77/36/57/944773657.db2.gz ILJZHFSFBQAJIT-CQSZACIVSA-N 0 0 371.462 3.522 20 5 FHBDRN C[C@H]1CN(C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000518791298 944773952 /nfs/dbraw/zinc/77/39/52/944773952.db2.gz ILJZHFSFBQAJIT-AWEZNQCLSA-N 0 0 371.462 3.522 20 5 FHBDRN C[C@]1(C(=O)[O-])CCCC[C@H]1[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000426755216 944775502 /nfs/dbraw/zinc/77/55/02/944775502.db2.gz XPCCIEZBNFMJIE-MJGOQNOKSA-N 0 0 358.394 3.978 20 5 FHBDRN O=C([O-])[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1ccc(-c2ccccc2)o1 ZINC000426774173 944790792 /nfs/dbraw/zinc/79/07/92/944790792.db2.gz STLCVYXGEDFRFA-SFHVURJKSA-N 0 0 366.373 3.640 20 5 FHBDRN Cc1ncc([N+](=O)[O-])c(OCc2cccc(C(=O)N3CCCCC3)c2)c1C ZINC000518797439 944791607 /nfs/dbraw/zinc/79/16/07/944791607.db2.gz UZRDOHIHHWXBGK-UHFFFAOYSA-N 0 0 369.421 3.812 20 5 FHBDRN Cc1cc(NC[C@@H](O)CCc2ccccc2)c2cccc([N+](=O)[O-])c2n1 ZINC000543191067 944796616 /nfs/dbraw/zinc/79/66/16/944796616.db2.gz CDWCEFSNPVBHCC-INIZCTEOSA-N 0 0 351.406 3.857 20 5 FHBDRN Cn1cc(C(=O)Nc2ccsc2Cl)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000438569417 944806075 /nfs/dbraw/zinc/80/60/75/944806075.db2.gz NNOYQLMLGJQCQS-UHFFFAOYSA-N 0 0 362.798 3.963 20 5 FHBDRN COCCCOc1ccccc1NCc1c(F)cc([N+](=O)[O-])cc1F ZINC000506283582 944808225 /nfs/dbraw/zinc/80/82/25/944808225.db2.gz WVCNPLBVRDTJLI-UHFFFAOYSA-N 0 0 352.337 3.900 20 5 FHBDRN O=C([O-])[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1cc2ccccc2s1 ZINC000426797865 944819808 /nfs/dbraw/zinc/81/98/08/944819808.db2.gz HCZQKIGZJGFYSI-INIZCTEOSA-N 0 0 356.403 3.595 20 5 FHBDRN CCN(CC)c1ccc(NC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)cn1 ZINC000506290048 944824154 /nfs/dbraw/zinc/82/41/54/944824154.db2.gz OGKWNGPVUDLYID-CYBMUJFWSA-N 0 0 374.466 3.955 20 5 FHBDRN C[C@@H](c1ccccc1)n1cnnc1SCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000518822846 944828069 /nfs/dbraw/zinc/82/80/69/944828069.db2.gz PBYZXSLARSEFCB-ZDUSSCGKSA-N 0 0 368.418 3.771 20 5 FHBDRN CCCC[C@@H](CCC)CNC(=O)N1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000426077108 944837627 /nfs/dbraw/zinc/83/76/27/944837627.db2.gz NLRMOXZIDCWADO-OAHLLOKOSA-N 0 0 365.478 3.744 20 5 FHBDRN O=C(NCCOc1ccc([N+](=O)[O-])cc1)c1cc2cc(Cl)ccc2o1 ZINC000518846670 944838750 /nfs/dbraw/zinc/83/87/50/944838750.db2.gz HURPRUVCMYCIRH-UHFFFAOYSA-N 0 0 360.753 3.803 20 5 FHBDRN CCNc1ccc(C(=O)N(CCOC)[C@@H](C)c2ccccc2)cc1[N+](=O)[O-] ZINC000500421062 944848081 /nfs/dbraw/zinc/84/80/81/944848081.db2.gz FILBDKDKLMURKA-HNNXBMFYSA-N 0 0 371.437 3.876 20 5 FHBDRN COC(=O)[C@H](C)CN(Cc1ccccc1)Cc1c(F)cccc1[N+](=O)[O-] ZINC000506640479 944853673 /nfs/dbraw/zinc/85/36/73/944853673.db2.gz ZSPONMNZDDEDBA-CQSZACIVSA-N 0 0 360.385 3.545 20 5 FHBDRN CC(C)N(C)c1ccccc1CNC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000518857452 944871008 /nfs/dbraw/zinc/87/10/08/944871008.db2.gz WUKDUPFPELKLAP-HNNXBMFYSA-N 0 0 355.438 3.859 20 5 FHBDRN COc1ccc(CCNc2ccc([N+](=O)[O-])cc2F)cc1OC(F)F ZINC000507029159 944878077 /nfs/dbraw/zinc/87/80/77/944878077.db2.gz FIYLOGGDVPBCBP-UHFFFAOYSA-N 0 0 356.300 3.999 20 5 FHBDRN O=C1c2ccccc2C(=O)N1CCCSCc1ccccc1[N+](=O)[O-] ZINC000517963778 944879005 /nfs/dbraw/zinc/87/90/05/944879005.db2.gz WFCKSBOEGVLWDC-UHFFFAOYSA-N 0 0 356.403 3.514 20 5 FHBDRN CSc1cc2c(cc1NC(=O)c1cccc([N+](=O)[O-])c1C)OCCO2 ZINC000505921110 944879997 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/nfs/dbraw/zinc/92/65/34/945926534.db2.gz PQBIEWJLZALQSF-ZDUSSCGKSA-N 0 0 366.421 3.917 20 5 FHBDRN Cc1cc(C(=O)Nc2cc(-c3cc(F)cc(F)c3)nn2C)ccc1[N+](=O)[O-] ZINC000487478476 945947789 /nfs/dbraw/zinc/94/77/89/945947789.db2.gz ILDLLDFXEKKRGU-UHFFFAOYSA-N 0 0 372.331 3.834 20 5 FHBDRN CCOCCN(C(=O)c1csc([N+](=O)[O-])c1)c1ccc(Cl)cc1 ZINC000416010044 945956893 /nfs/dbraw/zinc/95/68/93/945956893.db2.gz GLYDQKBZTNJPAC-UHFFFAOYSA-N 0 0 354.815 3.993 20 5 FHBDRN COCCOCc1cccc(NC(=O)Nc2ccc([N+](=O)[O-])c(C)c2)c1 ZINC000613779236 945958124 /nfs/dbraw/zinc/95/81/24/945958124.db2.gz GUNGRBFHNJVPIB-UHFFFAOYSA-N 0 0 359.382 3.710 20 5 FHBDRN Cc1c(-c2nc(Cc3ccccc3[N+](=O)[O-])no2)cnn1CCC(C)C ZINC000545535142 945977303 /nfs/dbraw/zinc/97/73/03/945977303.db2.gz GSSGOOAVQUUVFW-UHFFFAOYSA-N 0 0 355.398 3.787 20 5 FHBDRN CCCN(C(=O)c1ccc(OC)c([N+](=O)[O-])c1)[C@@H]1C[C@H](OCC)C1(C)C ZINC000303791804 945985164 /nfs/dbraw/zinc/98/51/64/945985164.db2.gz FIXIWJZHMYRQTB-SJORKVTESA-N 0 0 364.442 3.659 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N(C)Cc1ccc(Cl)nc1 ZINC000281959148 945991566 /nfs/dbraw/zinc/99/15/66/945991566.db2.gz MYCZIFXCEDLSIP-UHFFFAOYSA-N 0 0 364.789 3.706 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)N[C@H]2CCCC23CCOCC3)cc1[N+](=O)[O-] ZINC000281960310 945993157 /nfs/dbraw/zinc/99/31/57/945993157.db2.gz QRDMBHXBUPEUMK-PBHICJAKSA-N 0 0 361.442 3.613 20 5 FHBDRN COc1cccc(C(=O)N2CCC(Cc3ccc(F)cc3)CC2)c1[N+](=O)[O-] ZINC000444159339 946000547 /nfs/dbraw/zinc/00/05/47/946000547.db2.gz VUSBRSPJDFTYNE-UHFFFAOYSA-N 0 0 372.396 3.837 20 5 FHBDRN CCc1cc(Nc2ccc3c(c2)ncn3C)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000439710936 946009615 /nfs/dbraw/zinc/00/96/15/946009615.db2.gz UXNLVKZBEGHAOR-UHFFFAOYSA-N 0 0 374.404 3.666 20 5 FHBDRN C[C@@H](OC(=O)c1cccc(F)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000020751456 946035203 /nfs/dbraw/zinc/03/52/03/946035203.db2.gz WTHIRVFDIVDZMM-SECBINFHSA-N 0 0 366.732 3.571 20 5 FHBDRN COc1ccc2c(c1)CC[C@@H](NC(=O)Nc1ccc([N+](=O)[O-])c(C)c1)C2 ZINC000613784418 946037126 /nfs/dbraw/zinc/03/71/26/946037126.db2.gz QAEHDHIEUZXCSY-MRXNPFEDSA-N 0 0 355.394 3.591 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)N[C@@H](c2ccncc2)C2CC2)cc1[N+](=O)[O-] ZINC000893454348 946038494 /nfs/dbraw/zinc/03/84/94/946038494.db2.gz UHUCXZIMHWVRFZ-SCLBCKFNSA-N 0 0 354.410 3.810 20 5 FHBDRN Cc1[nH]nc(C(=O)Nc2ccc(Oc3cccc(F)c3)cc2)c1[N+](=O)[O-] ZINC000522880657 946044186 /nfs/dbraw/zinc/04/41/86/946044186.db2.gz MPJAUVCXYWLUEZ-UHFFFAOYSA-N 0 0 356.313 3.810 20 5 FHBDRN Cc1[nH]nc(C(=O)Nc2ncc(Cc3ccc(C)c(C)c3)s2)c1[N+](=O)[O-] ZINC000522880673 946044926 /nfs/dbraw/zinc/04/49/26/946044926.db2.gz ONFXNVHNJHVJES-UHFFFAOYSA-N 0 0 371.422 3.543 20 5 FHBDRN O=[N+]([O-])c1cc(F)ccc1N1CC[C@H](c2nccc(C(F)(F)F)n2)C1 ZINC000896907181 946048481 /nfs/dbraw/zinc/04/84/81/946048481.db2.gz KAALKBGWRCRJOQ-VIFPVBQESA-N 0 0 356.279 3.537 20 5 FHBDRN Cc1cc(OCC(=O)Nc2ccccc2C(F)(F)F)ccc1[N+](=O)[O-] ZINC000001284579 946056654 /nfs/dbraw/zinc/05/66/54/946056654.db2.gz FRYFVUXSLNPDLL-UHFFFAOYSA-N 0 0 354.284 3.940 20 5 FHBDRN COc1cccc(N2CCN(Cc3ccc(Cl)s3)CC2)c1[N+](=O)[O-] ZINC000475451886 946061028 /nfs/dbraw/zinc/06/10/28/946061028.db2.gz HPIPYMSEMRICAM-UHFFFAOYSA-N 0 0 367.858 3.641 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1N1CCC[C@@H]1[C@H]1CCCC[C@@H]1O ZINC000408171139 946061188 /nfs/dbraw/zinc/06/11/88/946061188.db2.gz HLGAWELUSHTVBX-IOASZLSFSA-N 0 0 369.259 3.877 20 5 FHBDRN COc1cccc(C2CCN(C(=O)c3cccc([N+](=O)[O-])c3OC)CC2)c1 ZINC000475453365 946071690 /nfs/dbraw/zinc/07/16/90/946071690.db2.gz MVLLMZYBGICSLR-UHFFFAOYSA-N 0 0 370.405 3.632 20 5 FHBDRN O=C(NCc1cccc(OC(F)F)c1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000522894340 946074695 /nfs/dbraw/zinc/07/46/95/946074695.db2.gz AIQHOWPVGKKXRK-UHFFFAOYSA-N 0 0 356.712 3.780 20 5 FHBDRN C[C@H](NC(=O)NC[C@H]1CCOc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000108884384 946074747 /nfs/dbraw/zinc/07/47/47/946074747.db2.gz HUFYASKYQJLLNA-DZGCQCFKSA-N 0 0 355.394 3.521 20 5 FHBDRN O=C(c1cc(F)cc2c(=O)c3cccc(F)c3[nH]c12)N1CCC2(CCC2)C1 ZINC000444219214 946084965 /nfs/dbraw/zinc/08/49/65/946084965.db2.gz AFLFGYCFRHZISR-UHFFFAOYSA-N 0 0 368.383 3.976 20 5 FHBDRN COc1ccc([C@H](C)NC(=O)c2cccc(SC)c2[N+](=O)[O-])cc1F ZINC000186009110 946089424 /nfs/dbraw/zinc/08/94/24/946089424.db2.gz GYIWAHSCUBMJSM-JTQLQIEISA-N 0 0 364.398 3.955 20 5 FHBDRN CN(Cc1cccc([N+](=O)[O-])c1)[C@H](c1ccc(F)cc1)c1ncccn1 ZINC000066881068 946098372 /nfs/dbraw/zinc/09/83/72/946098372.db2.gz PDKSEKZAQAKLOA-GOSISDBHSA-N 0 0 352.369 3.745 20 5 FHBDRN CC[C@H]1CCN(C(=O)c2cc(F)cc3c(=O)c4cc(F)ccc4[nH]c23)C1 ZINC000444229084 946101245 /nfs/dbraw/zinc/10/12/45/946101245.db2.gz TZISRQHBXSXNRW-NSHDSACASA-N 0 0 356.372 3.832 20 5 FHBDRN CSc1ccc([C@@H](C)NC(=O)NCCNc2ccccc2[N+](=O)[O-])cc1 ZINC000545257121 946109752 /nfs/dbraw/zinc/10/97/52/946109752.db2.gz RKZDGRVORCFGTB-CYBMUJFWSA-N 0 0 374.466 3.789 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N2CCC(c3ccccc3F)CC2)c1 ZINC000522934115 946119547 /nfs/dbraw/zinc/11/95/47/946119547.db2.gz RQTMHKQBHFENCI-UHFFFAOYSA-N 0 0 358.369 3.762 20 5 FHBDRN O=C(c1cccc2c(=O)c3cccc(F)c3[nH]c12)N1C[C@H]2CCC[C@@H]2C1 ZINC000444250238 946124370 /nfs/dbraw/zinc/12/43/70/946124370.db2.gz UFNVENXHVJFLRQ-CHWSQXEVSA-N 0 0 350.393 3.693 20 5 FHBDRN C[C@@H](OC(=O)CCc1nc(-c2ccsc2)no1)c1ccc([N+](=O)[O-])cc1 ZINC000066877350 946130769 /nfs/dbraw/zinc/13/07/69/946130769.db2.gz AVIMBEMSRNSPEH-LLVKDONJSA-N 0 0 373.390 3.943 20 5 FHBDRN C[C@@H](OC(=O)c1ccc(CN2CCCC2=O)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000066877437 946130906 /nfs/dbraw/zinc/13/09/06/946130906.db2.gz KPOWPVMAYBGZCG-CQSZACIVSA-N 0 0 368.389 3.635 20 5 FHBDRN C[C@@H](OC(=O)CCc1nc(-c2cccs2)no1)c1ccc([N+](=O)[O-])cc1 ZINC000066877377 946130917 /nfs/dbraw/zinc/13/09/17/946130917.db2.gz QCQRKCWIUQDYDY-LLVKDONJSA-N 0 0 373.390 3.943 20 5 FHBDRN CCN(C[C@@H]1CCOC1)C(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000109050962 946142116 /nfs/dbraw/zinc/14/21/16/946142116.db2.gz KSTJPXLJFFZNCS-HNNXBMFYSA-N 0 0 369.421 3.837 20 5 FHBDRN O=C(c1cc(C(F)(F)F)ccc1[N+](=O)[O-])N1CCSc2ncccc21 ZINC001126088766 946150534 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3.597 20 5 FHBDRN O=C(c1cc(F)cc2c(=O)c3cccc(F)c3[nH]c12)N1CC[C@@H](C2CC2)C1 ZINC000444298214 946184000 /nfs/dbraw/zinc/18/40/00/946184000.db2.gz MJCNJWICCXJWMB-GFCCVEGCSA-N 0 0 368.383 3.832 20 5 FHBDRN O=C(COc1cccc([N+](=O)[O-])c1)NCCc1cc(Cl)cc(Cl)c1 ZINC000109209002 946192343 /nfs/dbraw/zinc/19/23/43/946192343.db2.gz ULKBHFJHPLRXKB-UHFFFAOYSA-N 0 0 369.204 3.639 20 5 FHBDRN COC(=O)c1cc2cc(NC(=O)c3ccc([N+](=O)[O-])cc3C)ccc2o1 ZINC000522989188 946200153 /nfs/dbraw/zinc/20/01/53/946200153.db2.gz JTDYAZTYKYTEHL-UHFFFAOYSA-N 0 0 354.318 3.688 20 5 FHBDRN COc1cc(O)cc(NC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)c1 ZINC000444304695 946205628 /nfs/dbraw/zinc/20/56/28/946205628.db2.gz QNAPQZALFIXCEJ-UHFFFAOYSA-N 0 0 360.369 3.648 20 5 FHBDRN O=C(NCc1ccc(N2CCCCCC2)nc1)Nc1cccc([N+](=O)[O-])c1 ZINC000045875354 946209450 /nfs/dbraw/zinc/20/94/50/946209450.db2.gz VENSAEMHXMIEPN-UHFFFAOYSA-N 0 0 369.425 3.692 20 5 FHBDRN COC(=O)c1ccc(OCCCOc2cccc(Cl)c2)c([N+](=O)[O-])c1 ZINC000109263152 946212890 /nfs/dbraw/zinc/21/28/90/946212890.db2.gz NTPUTXNAEPBGSQ-UHFFFAOYSA-N 0 0 365.769 3.883 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)Nc1nc(-c2ccccc2)ns1 ZINC000125482275 946212946 /nfs/dbraw/zinc/21/29/46/946212946.db2.gz OEUYHJOPSRUJJA-UHFFFAOYSA-N 0 0 354.391 3.685 20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])Nc1ccccc1OCC(F)F ZINC000151772251 946224884 /nfs/dbraw/zinc/22/48/84/946224884.db2.gz GTYQGEAIPXWRDV-UHFFFAOYSA-N 0 0 365.336 3.679 20 5 FHBDRN Cc1ccc(NC(=O)c2cc([N+](=O)[O-])cc(Br)c2C)cn1 ZINC000550319667 946232545 /nfs/dbraw/zinc/23/25/45/946232545.db2.gz QNRCLKRVOHRZKH-UHFFFAOYSA-N 0 0 350.172 3.621 20 5 FHBDRN CCOC(=O)N1CCC[C@@H]([C@H](C)Nc2ccc([N+](=O)[O-])c3cnccc23)C1 ZINC000302510002 946238928 /nfs/dbraw/zinc/23/89/28/946238928.db2.gz XAPSNCWYAJPYAN-UONOGXRCSA-N 0 0 372.425 3.812 20 5 FHBDRN CC[C@H](C)C(=O)Nc1cccc(CNC(=O)c2ccccc2[N+](=O)[O-])c1 ZINC000045940525 946255425 /nfs/dbraw/zinc/25/54/25/946255425.db2.gz JWYNRCKRZWYJJS-ZDUSSCGKSA-N 0 0 355.394 3.509 20 5 FHBDRN CCOc1ccc(/C=C/c2nc(-c3ccc(N)c([N+](=O)[O-])c3)no2)cc1 ZINC000546258799 946259723 /nfs/dbraw/zinc/25/97/23/946259723.db2.gz GAUZESONDUHEBV-BJMVGYQFSA-N 0 0 352.350 3.796 20 5 FHBDRN COc1ccc(C(=O)CCCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)cc1 ZINC000546258550 946269689 /nfs/dbraw/zinc/26/96/89/946269689.db2.gz PKXSNAREDFOOJP-UHFFFAOYSA-N 0 0 367.361 3.859 20 5 FHBDRN O=C(NCc1cc([N+](=O)[O-])ccc1Cl)C1(c2ccccc2)CCOCC1 ZINC000268229397 946270293 /nfs/dbraw/zinc/27/02/93/946270293.db2.gz LHTOKOZBWCGLMZ-UHFFFAOYSA-N 0 0 374.824 3.613 20 5 FHBDRN CCOc1nc(C(F)(F)F)ccc1C(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000428337114 946272372 /nfs/dbraw/zinc/27/23/72/946272372.db2.gz KXISWZWJMRZKIG-UHFFFAOYSA-N 0 0 369.299 3.968 20 5 FHBDRN O=C([C@@H]1CCC[C@H](C(F)(F)F)C1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088231229 946292500 /nfs/dbraw/zinc/29/25/00/946292500.db2.gz VIISDMMOHXYOMG-OCCSQVGLSA-N 0 0 356.344 3.848 20 5 FHBDRN Cc1onc(-c2ccccc2)c1C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088231254 946295681 /nfs/dbraw/zinc/29/56/81/946295681.db2.gz VTZANLRBXXPXEF-UHFFFAOYSA-N 0 0 363.373 3.757 20 5 FHBDRN COc1cc(OCc2nc(-c3cccc(Cl)c3)no2)ccc1[N+](=O)[O-] ZINC000109467977 946299918 /nfs/dbraw/zinc/29/99/18/946299918.db2.gz YMDGBECWTHYFPM-UHFFFAOYSA-N 0 0 361.741 3.886 20 5 FHBDRN C[C@H]1CN2CCCC[C@H]2CN1C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000408182668 946301601 /nfs/dbraw/zinc/30/16/01/946301601.db2.gz LIIKEDAYXZGWRK-WFASDCNBSA-N 0 0 359.451 3.508 20 5 FHBDRN Cc1nn(C)c(-c2nc(-c3c(Cl)cccc3Cl)no2)c1[N+](=O)[O-] ZINC000109487013 946304452 /nfs/dbraw/zinc/30/44/52/946304452.db2.gz IVFJPCSRJPRKGF-UHFFFAOYSA-N 0 0 354.153 3.661 20 5 FHBDRN Cc1ccc(NC(=O)COc2ccc([N+](=O)[O-])cc2C(F)(F)F)cc1 ZINC000109480727 946306347 /nfs/dbraw/zinc/30/63/47/946306347.db2.gz SMYONICCHGZGJY-UHFFFAOYSA-N 0 0 354.284 3.940 20 5 FHBDRN C[C@@H](C1CC1)N(C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)C1CC1 ZINC000046057733 946318322 /nfs/dbraw/zinc/31/83/22/946318322.db2.gz XFUMLJFZYIMXGV-AWEZNQCLSA-N 0 0 357.454 3.601 20 5 FHBDRN COc1ccc(Cc2noc(-c3cc([N+](=O)[O-])ccc3C)n2)cc1OC ZINC000109579504 946338895 /nfs/dbraw/zinc/33/88/95/946338895.db2.gz OTHSWOCCFVOEBW-UHFFFAOYSA-N 0 0 355.350 3.561 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCO[C@H](C3CCCCC3)C2)cc1OC(F)F ZINC000541622451 946340411 /nfs/dbraw/zinc/34/04/11/946340411.db2.gz QHBHQJCUURAYPT-INIZCTEOSA-N 0 0 356.369 3.982 20 5 FHBDRN O=C(N[C@H]1COc2ccc(Cl)cc21)c1c(Cl)cccc1[N+](=O)[O-] ZINC000475083735 946346084 /nfs/dbraw/zinc/34/60/84/946346084.db2.gz WUUXQHWUSNEBJR-NSHDSACASA-N 0 0 353.161 3.765 20 5 FHBDRN COc1ccc(-c2noc([C@@H](C)Sc3ccc([N+](=O)[O-])cc3)n2)cn1 ZINC000109589666 946346914 /nfs/dbraw/zinc/34/69/14/946346914.db2.gz LPHCRADDRRCBOB-SNVBAGLBSA-N 0 0 358.379 3.902 20 5 FHBDRN O=C(N[C@H](COc1ccccc1F)c1ccccc1)c1ccc([N+](=O)[O-])o1 ZINC000046119195 946347343 /nfs/dbraw/zinc/34/73/43/946347343.db2.gz MRBDTCDCHVUNTF-OAHLLOKOSA-N 0 0 370.336 3.877 20 5 FHBDRN Cc1c(-c2nc(CC3CCCCC3)no2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000545672178 946381084 /nfs/dbraw/zinc/38/10/84/946381084.db2.gz RMDAEZDENQXCTI-UHFFFAOYSA-N 0 0 368.397 3.657 20 5 FHBDRN Cc1ccc(-c2noc(COC(=O)c3cccc([N+](=O)[O-])c3C)n2)cc1 ZINC000025112679 946385808 /nfs/dbraw/zinc/38/58/08/946385808.db2.gz YZIFICJZYSDQHK-UHFFFAOYSA-N 0 0 353.334 3.619 20 5 FHBDRN CCc1c(C(=O)N2CCc3ccc([N+](=O)[O-])cc32)cnn1C1CCCC1 ZINC000475483383 946393592 /nfs/dbraw/zinc/39/35/92/946393592.db2.gz UUIZJNJTJIIKGQ-UHFFFAOYSA-N 0 0 354.410 3.672 20 5 FHBDRN CC(=O)c1ccc(OCc2nc3cc(Cl)ccc3n2C)c([N+](=O)[O-])c1 ZINC000120901135 946394150 /nfs/dbraw/zinc/39/41/50/946394150.db2.gz MKHNFXLKCVKIHF-UHFFFAOYSA-N 0 0 359.769 3.917 20 5 FHBDRN C[C@@H]1C[C@@H](CNC(=O)c2cc(F)c(Cl)c([N+](=O)[O-])c2Cl)CCO1 ZINC000897297170 946396063 /nfs/dbraw/zinc/39/60/63/946396063.db2.gz XMVBQUVUMMPOHJ-SFYZADRCSA-N 0 0 365.188 3.586 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N(C)Cc1cnn(-c2ccccc2)c1 ZINC000043149616 946397986 /nfs/dbraw/zinc/39/79/86/946397986.db2.gz GULBAHUWZLNJDE-UHFFFAOYSA-N 0 0 365.393 3.753 20 5 FHBDRN Cc1nn(C)c2sc(-c3nc(-c4ccc([N+](=O)[O-])cc4C)no3)cc12 ZINC000545692380 946405228 /nfs/dbraw/zinc/40/52/28/946405228.db2.gz IDDFHVOZHPBSQQ-UHFFFAOYSA-N 0 0 355.379 3.877 20 5 FHBDRN CC(=O)N[C@H](CC(=O)Nc1c(C)ccc([N+](=O)[O-])c1C)c1ccc(C)cc1 ZINC000129484587 946405445 /nfs/dbraw/zinc/40/54/45/946405445.db2.gz OBEHOMKAZBUAKJ-QGZVFWFLSA-N 0 0 369.421 3.726 20 5 FHBDRN COc1cc(C)c(NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])cc1OC ZINC000015948857 946405608 /nfs/dbraw/zinc/40/56/08/946405608.db2.gz ZAWMLZCHPKEOKA-UHFFFAOYSA-N 0 0 350.758 3.826 20 5 FHBDRN CCO[C@H](CCNC(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1)C1CCCC1 ZINC000475105594 946406657 /nfs/dbraw/zinc/40/66/57/946406657.db2.gz CKEMCACNLXOOKZ-RDTXWAMCSA-N 0 0 363.458 3.940 20 5 FHBDRN CN1CCC[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c2ccccc21 ZINC000456592454 946410521 /nfs/dbraw/zinc/41/05/21/946410521.db2.gz HRERLLDAPRFFEI-MRXNPFEDSA-N 0 0 359.813 3.949 20 5 FHBDRN O=C(NCC[C@H]1CCOC1)c1ccccc1Sc1ccccc1[N+](=O)[O-] ZINC000441298157 946416108 /nfs/dbraw/zinc/41/61/08/946416108.db2.gz VLPUCKHVSDZLNP-AWEZNQCLSA-N 0 0 372.446 3.902 20 5 FHBDRN Cc1ccccc1CN(C)C(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000052956712 946432213 /nfs/dbraw/zinc/43/22/13/946432213.db2.gz BSSFHPQNRJJWOB-UHFFFAOYSA-N 0 0 364.405 3.576 20 5 FHBDRN CC[C@@H](C)n1ncc(NC(=O)c2cccc(OC)c2[N+](=O)[O-])c1C1CC1 ZINC000444322460 946433259 /nfs/dbraw/zinc/43/32/59/946433259.db2.gz JIFMRCGUFKISRN-LLVKDONJSA-N 0 0 358.398 3.901 20 5 FHBDRN O=C(NCCc1ccsc1)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000047865673 946446139 /nfs/dbraw/zinc/44/61/39/946446139.db2.gz YIDIZYRFHVFGAV-UHFFFAOYSA-N 0 0 357.338 3.622 20 5 FHBDRN O=C(N[C@@H]1COc2ccc(Cl)cc21)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000475126136 946446857 /nfs/dbraw/zinc/44/68/57/946446857.db2.gz ALPJNYXODFQTMU-CYBMUJFWSA-N 0 0 357.753 3.593 20 5 FHBDRN Cc1noc(C)c1[C@@H](C)CNc1ncc(Br)cc1[N+](=O)[O-] ZINC000129500446 946448813 /nfs/dbraw/zinc/44/88/13/946448813.db2.gz AGUWSEYIEUQSCD-ZETCQYMHSA-N 0 0 355.192 3.573 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)c1ccnc(OCC(F)(F)F)c1 ZINC000129500743 946449184 /nfs/dbraw/zinc/44/91/84/946449184.db2.gz VLGAOKFFXMUGNK-UHFFFAOYSA-N 0 0 369.299 3.800 20 5 FHBDRN O=C(Nc1ccc(Nc2ncccn2)cc1)c1cc(F)cc([N+](=O)[O-])c1 ZINC000444417427 946462384 /nfs/dbraw/zinc/46/23/84/946462384.db2.gz DSBIGCQDPOYWBB-UHFFFAOYSA-N 0 0 353.313 3.520 20 5 FHBDRN COC(=O)[C@H](CC(F)F)NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000475132606 946468579 /nfs/dbraw/zinc/46/85/79/946468579.db2.gz ACJSBMSBRPHYKQ-ZDUSSCGKSA-N 0 0 370.377 3.610 20 5 FHBDRN Cc1ccc(S(=O)(=O)NCC[C@H](C)c2ccccc2)c(C)c1[N+](=O)[O-] ZINC001211671549 946470427 /nfs/dbraw/zinc/47/04/27/946470427.db2.gz MLUOMJPWKCDPKU-ZDUSSCGKSA-N 0 0 362.451 3.684 20 5 FHBDRN O=C(C1CCC(C(F)(F)F)CC1)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000444413602 946475164 /nfs/dbraw/zinc/47/51/64/946475164.db2.gz OICRJUFLNBRLNL-UHFFFAOYSA-N 0 0 372.343 3.553 20 5 FHBDRN C/C(=C/C(=O)Nc1cc(-c2nnco2)ccc1C)c1ccc([N+](=O)[O-])cc1 ZINC000785290714 946483538 /nfs/dbraw/zinc/48/35/38/946483538.db2.gz DKMOTHZQUHJYCW-LCYFTJDESA-N 0 0 364.361 3.995 20 5 FHBDRN Cc1cc([C@@H](C)NC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)c(C)s1 ZINC000111562419 946485295 /nfs/dbraw/zinc/48/52/95/946485295.db2.gz WKGFYTTUZBOWKH-SNVBAGLBSA-N 0 0 371.418 3.606 20 5 FHBDRN COCc1ccc([C@H]2CCCN2Cc2cc(OC)c(F)cc2[N+](=O)[O-])o1 ZINC000186145113 946516131 /nfs/dbraw/zinc/51/61/31/946516131.db2.gz SMNXDAMEAFIQHJ-OAHLLOKOSA-N 0 0 364.373 3.819 20 5 FHBDRN Cn1cc(CNc2cccc3c2CCO3)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000475512870 946535214 /nfs/dbraw/zinc/53/52/14/946535214.db2.gz PHLTUEUTFPOWHM-UHFFFAOYSA-N 0 0 350.378 3.542 20 5 FHBDRN Cc1cncc([C@H]2CCCN2C(=O)NC[C@@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000897050875 946549487 /nfs/dbraw/zinc/54/94/87/946549487.db2.gz VTSKZUQEIDAHSQ-CRAIPNDOSA-N 0 0 368.437 3.948 20 5 FHBDRN O=[N+]([O-])c1cccc([C@@H](N[C@@H](CCO)c2ccco2)c2ccccc2)c1 ZINC000186555386 946550945 /nfs/dbraw/zinc/55/09/45/946550945.db2.gz WLBFKOJPMWUXPS-ICSRJNTNSA-N 0 0 352.390 3.991 20 5 FHBDRN Nc1ccc2c(c1)CCC[C@H]2NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000186567894 946554301 /nfs/dbraw/zinc/55/43/01/946554301.db2.gz WZDRAJJOEKUFFJ-QGZVFWFLSA-N 0 0 366.421 3.559 20 5 FHBDRN Cc1csc(C(C)(C)NC(=O)NC[C@@H](C)c2ccccc2[N+](=O)[O-])n1 ZINC000897068424 946561734 /nfs/dbraw/zinc/56/17/34/946561734.db2.gz MWWNYQBCALBQQV-LLVKDONJSA-N 0 0 362.455 3.698 20 5 FHBDRN C[C@H](CNC(=O)N1CCC(OC(C)(C)C)CC1)c1ccccc1[N+](=O)[O-] ZINC000897068247 946562157 /nfs/dbraw/zinc/56/21/57/946562157.db2.gz SCZCFHJDAIMRFQ-CQSZACIVSA-N 0 0 363.458 3.687 20 5 FHBDRN CC[C@@H](c1ccncc1)N(C)C(=O)NC[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000897069558 946563082 /nfs/dbraw/zinc/56/30/82/946563082.db2.gz XTMQELKFHVHDBV-PBHICJAKSA-N 0 0 356.426 3.886 20 5 FHBDRN CC[C@@H](c1ccncc1)N(C)C(=O)NC[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000897069561 946565007 /nfs/dbraw/zinc/56/50/07/946565007.db2.gz XTMQELKFHVHDBV-YOEHRIQHSA-N 0 0 356.426 3.886 20 5 FHBDRN C[C@H]1N(C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CCOC1(C)C ZINC000475184625 946576278 /nfs/dbraw/zinc/57/62/78/946576278.db2.gz MYLFTSYBKHYCEM-SECBINFHSA-N 0 0 361.320 3.645 20 5 FHBDRN CSc1ccc(C(=O)N(C)Cc2cnc(C(C)C)nc2)cc1[N+](=O)[O-] ZINC000441417183 946579111 /nfs/dbraw/zinc/57/91/11/946579111.db2.gz FOHDWIVYTLGPLM-UHFFFAOYSA-N 0 0 360.439 3.502 20 5 FHBDRN CC(C)(C)Oc1cc(NCc2ccc(-c3nn[nH]n3)cc2)ccc1[N+](=O)[O-] ZINC000824120107 946595778 /nfs/dbraw/zinc/59/57/78/946595778.db2.gz YNYYNPSHFCLJSS-UHFFFAOYSA-N 0 0 368.397 3.564 20 5 FHBDRN Cc1nc2ccccc2n1CCCNC(=O)c1c(C)c(F)ccc1[N+](=O)[O-] ZINC000843765956 946603291 /nfs/dbraw/zinc/60/32/91/946603291.db2.gz NJNFCVSUPOURIG-UHFFFAOYSA-N 0 0 370.384 3.521 20 5 FHBDRN Cc1ccccc1CN(Cc1c([N+](=O)[O-])ncn1C)Cc1ccccc1 ZINC000475539722 946625114 /nfs/dbraw/zinc/62/51/14/946625114.db2.gz XNPNYYMRALVYBY-UHFFFAOYSA-N 0 0 350.422 3.839 20 5 FHBDRN Cc1ccc(C)c([C@H]2CCCN2C(=O)COc2cccc([N+](=O)[O-])c2)c1 ZINC000475543916 946627451 /nfs/dbraw/zinc/62/74/51/946627451.db2.gz AWELDVVLKOMHHI-LJQANCHMSA-N 0 0 354.406 3.954 20 5 FHBDRN Cc1c(Cc2noc([C@H](C)OC[C@@H]3CCCCO3)n2)cccc1[N+](=O)[O-] ZINC000545781819 946627469 /nfs/dbraw/zinc/62/74/69/946627469.db2.gz SJOBTXJGJGGIFC-ZFWWWQNUSA-N 0 0 361.398 3.524 20 5 FHBDRN COc1cc(CN[C@@H](C)c2nccs2)c([N+](=O)[O-])cc1OC(F)F ZINC000184439245 946628703 /nfs/dbraw/zinc/62/87/03/946628703.db2.gz RGGRWSFRWXVQKG-QMMMGPOBSA-N 0 0 359.354 3.512 20 5 FHBDRN C[C@@H](Oc1cccnc1)c1nc(Cc2c[nH]c3ccc([N+](=O)[O-])cc23)no1 ZINC000545782175 946628726 /nfs/dbraw/zinc/62/87/26/946628726.db2.gz WMCCNWITVIURPS-LLVKDONJSA-N 0 0 365.349 3.585 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N(C)c1nc2ccccc2o1 ZINC000121391495 946651505 /nfs/dbraw/zinc/65/15/05/946651505.db2.gz WXOQJUOFSXBRGS-LLVKDONJSA-N 0 0 357.391 3.880 20 5 FHBDRN CN(Cc1nc(-c2ccccc2)c[nH]1)C(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000121398942 946656210 /nfs/dbraw/zinc/65/62/10/946656210.db2.gz GNSASOPTKCQLKE-UHFFFAOYSA-N 0 0 370.796 3.911 20 5 FHBDRN C[C@H]1Oc2ccc(Nc3ccc4ncccc4c3[N+](=O)[O-])cc2NC1=O ZINC000112073141 946656234 /nfs/dbraw/zinc/65/62/34/946656234.db2.gz OLAKTVCLOMAICO-SNVBAGLBSA-N 0 0 350.334 3.606 20 5 FHBDRN Cc1cn(-c2ccccc2)nc1C(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000186259643 946664019 /nfs/dbraw/zinc/66/40/19/946664019.db2.gz LMDKNIYENZBGMX-HNNXBMFYSA-N 0 0 364.405 3.888 20 5 FHBDRN CCOc1cc(N2CCC[C@H]2c2nc3c(n2C)CCCC3)ccc1[N+](=O)[O-] ZINC000614771733 946665134 /nfs/dbraw/zinc/66/51/34/946665134.db2.gz QMGNBTFODGTSRS-SFHVURJKSA-N 0 0 370.453 3.947 20 5 FHBDRN C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1cnc(-c2cccnc2)s1 ZINC000567414135 946667069 /nfs/dbraw/zinc/66/70/69/946667069.db2.gz HKXAVLPCNGKLFR-LLVKDONJSA-N 0 0 366.402 3.705 20 5 FHBDRN O=C(NCC1CCSCC1)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000475194080 946668880 /nfs/dbraw/zinc/66/88/80/946668880.db2.gz XKBKUXOCCXWEQL-UHFFFAOYSA-N 0 0 363.361 3.878 20 5 FHBDRN CC[C@@H](CSC)NC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000475192876 946673449 /nfs/dbraw/zinc/67/34/49/946673449.db2.gz MWXLYRAUYRCMQB-QMMMGPOBSA-N 0 0 351.350 3.877 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)N[C@H]1CCCc2ccc(F)cc21 ZINC000549572322 946681009 /nfs/dbraw/zinc/68/10/09/946681009.db2.gz XVUNGQILDPKDPP-IBGZPJMESA-N 0 0 371.412 3.995 20 5 FHBDRN CCSCc1cc(C(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)no1 ZINC000186613512 946684882 /nfs/dbraw/zinc/68/48/82/946684882.db2.gz IGFAAPOVCLCYMK-UHFFFAOYSA-N 0 0 361.423 3.641 20 5 FHBDRN C[C@@H]1Cc2ccccc2N(Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000104722855 946684887 /nfs/dbraw/zinc/68/48/87/946684887.db2.gz JPOKBZVXSIAERY-CYBMUJFWSA-N 0 0 350.378 3.844 20 5 FHBDRN Cc1nc(CCNC(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)cs1 ZINC000475202915 946716223 /nfs/dbraw/zinc/71/62/23/946716223.db2.gz KOQAYPIMKCTKQA-UHFFFAOYSA-N 0 0 374.344 3.743 20 5 FHBDRN CC[C@@H](C[C@H](C)CO)NC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000475218402 946718645 /nfs/dbraw/zinc/71/86/45/946718645.db2.gz WJMHYOSSIKJPIR-UWVGGRQHSA-N 0 0 363.336 3.532 20 5 FHBDRN C[C@]1(NC(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CCO[C@@H]1C1CC1 ZINC000475206243 946721666 /nfs/dbraw/zinc/72/16/66/946721666.db2.gz BMKRWSDJLWQOMK-HIFRSBDPSA-N 0 0 373.331 3.693 20 5 FHBDRN O=C(Nc1ccc(F)c([N+](=O)[O-])c1)c1cccnc1SC(F)(F)F ZINC000067539334 946723494 /nfs/dbraw/zinc/72/34/94/946723494.db2.gz INWYOAIGIINLHY-UHFFFAOYSA-N 0 0 361.276 3.993 20 5 FHBDRN O=C(Nc1cc(F)c(F)cc1F)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088381128 946723686 /nfs/dbraw/zinc/72/36/86/946723686.db2.gz MFWLRWBRAJWIOK-UHFFFAOYSA-N 0 0 351.284 3.602 20 5 FHBDRN CO[C@H](C)c1cccc(NC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)c1 ZINC000088379020 946724053 /nfs/dbraw/zinc/72/40/53/946724053.db2.gz UTDIIGKUMCRSJQ-CYBMUJFWSA-N 0 0 355.394 3.892 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N(C)c1ccc(C(C)C)cc1 ZINC000150762868 946739456 /nfs/dbraw/zinc/73/94/56/946739456.db2.gz OJJJSMMPMHJENL-UHFFFAOYSA-N 0 0 364.423 3.552 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)N[C@H]1CCCc2c[nH]nc21 ZINC000475219891 946742646 /nfs/dbraw/zinc/74/26/46/946742646.db2.gz OGXWCGRVIMSJMG-NSHDSACASA-N 0 0 369.303 3.536 20 5 FHBDRN O=C(CC[S@@](=O)c1ccc2ccccc2c1)Nc1ccccc1[N+](=O)[O-] ZINC000507742954 946744787 /nfs/dbraw/zinc/74/47/87/946744787.db2.gz QSBJXXGAXIZPIU-AREMUKBSSA-N 0 0 368.414 3.884 20 5 FHBDRN O=C(c1cc(F)c(Cl)c([N+](=O)[O-])c1Cl)N1CC2(C1)CC(F)(F)C2 ZINC000897139861 946760371 /nfs/dbraw/zinc/76/03/71/946760371.db2.gz RUPRYGQIQUNOMJ-UHFFFAOYSA-N 0 0 369.126 3.912 20 5 FHBDRN CSc1cccc(C(=O)Nc2cccc(-c3noc(C)n3)c2)c1[N+](=O)[O-] ZINC000186288445 946769580 /nfs/dbraw/zinc/76/95/80/946769580.db2.gz TXGYQTUUJDBERF-UHFFFAOYSA-N 0 0 370.390 3.927 20 5 FHBDRN C[C@H](N[C@H](c1cnn(C)c1)c1ccc(F)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000186647500 946781165 /nfs/dbraw/zinc/78/11/65/946781165.db2.gz GZWUPFUERLATHP-DJJJIMSYSA-N 0 0 354.385 3.908 20 5 FHBDRN Cc1cc2cc[nH]c2cc1NC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000444444321 946791480 /nfs/dbraw/zinc/79/14/80/946791480.db2.gz DQWHDEOYZXKPHI-UHFFFAOYSA-N 0 0 361.361 3.823 20 5 FHBDRN O=c1c([N+](=O)[O-])cc(Cl)cn1CCOc1ccc(Cl)cc1Cl ZINC000432235592 946800603 /nfs/dbraw/zinc/80/06/03/946800603.db2.gz KGUXXDXOLAMEJS-UHFFFAOYSA-N 0 0 363.584 3.796 20 5 FHBDRN CC(C)OC(=O)C[C@@H]1CCCN(Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000184471534 946822507 /nfs/dbraw/zinc/82/25/07/946822507.db2.gz CLBAFRBYJHFFDT-ZDUSSCGKSA-N 0 0 354.834 3.802 20 5 FHBDRN CCN(C(=O)CCOc1ccccc1[N+](=O)[O-])[C@H](C)Cc1ccsc1 ZINC000186304107 946829069 /nfs/dbraw/zinc/82/90/69/946829069.db2.gz PLNVHXOTLKISRE-CQSZACIVSA-N 0 0 362.451 3.905 20 5 FHBDRN O=C(CCc1ccc2[nH]ccc2c1)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186304765 946830746 /nfs/dbraw/zinc/83/07/46/946830746.db2.gz MVKMTYSLRBTSAM-UHFFFAOYSA-N 0 0 357.797 3.979 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N[C@@H]1CCOc2ccc(F)cc21 ZINC000184480387 946832398 /nfs/dbraw/zinc/83/23/98/946832398.db2.gz YWVAGLXMQNJYHR-CQSZACIVSA-N 0 0 359.357 3.996 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)N[C@@H]1CCc2cc(F)ccc21 ZINC000184483181 946836922 /nfs/dbraw/zinc/83/69/22/946836922.db2.gz FZIOPBINRNCXID-MRXNPFEDSA-N 0 0 363.776 3.874 20 5 FHBDRN CCOc1ccc(NC(=O)c2ccc([N+](=O)[O-])o2)cc1Br ZINC000186307463 946840233 /nfs/dbraw/zinc/84/02/33/946840233.db2.gz XSPXUROCBMVNNL-UHFFFAOYSA-N 0 0 355.144 3.601 20 5 FHBDRN C[C@@H]1CCN(C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)c2c(O)cccc21 ZINC000186309329 946840783 /nfs/dbraw/zinc/84/07/83/946840783.db2.gz OJHCCFPBPCDDPJ-GFCCVEGCSA-N 0 0 365.389 3.865 20 5 FHBDRN O=C(/C=C\c1ccccc1F)O[C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000759928308 946846927 /nfs/dbraw/zinc/84/69/27/946846927.db2.gz ACUVHCQERLRTBD-SBKIPFDTSA-N 0 0 359.357 3.671 20 5 FHBDRN CC[C@@H](C)[C@H](C)N(C1CC1)S(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000729490455 946859604 /nfs/dbraw/zinc/85/96/04/946859604.db2.gz GZPMFCHIQAWFPL-MNOVXSKESA-N 0 0 360.863 3.836 20 5 FHBDRN CC[C@H](C)[C@@H](C)N(C1CC1)S(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000729490457 946860329 /nfs/dbraw/zinc/86/03/29/946860329.db2.gz GZPMFCHIQAWFPL-WDEREUQCSA-N 0 0 360.863 3.836 20 5 FHBDRN CC(C)(C(=O)N[C@@H]1CCCOc2ccccc21)c1ccccc1[N+](=O)[O-] ZINC000550379315 946862650 /nfs/dbraw/zinc/86/26/50/946862650.db2.gz KHLPSGXSRDLRCU-MRXNPFEDSA-N 0 0 354.406 3.903 20 5 FHBDRN Cc1cc(N(C(=N)N)c2ccc(F)cc2)nc(-c2cccc([N+](=O)[O-])c2)n1 ZINC001167993832 946863055 /nfs/dbraw/zinc/86/30/55/946863055.db2.gz WIDXAKVGLABBSD-UHFFFAOYSA-N 0 0 366.356 3.531 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])c1nnc(Cc2ccc(F)cc2)s1 ZINC000549579191 946864336 /nfs/dbraw/zinc/86/43/36/946864336.db2.gz OWXNZEXXMCFOTQ-UHFFFAOYSA-N 0 0 372.425 3.855 20 5 FHBDRN COc1cc(C2(C(=O)NCc3ccc([N+](=O)[O-])cc3Cl)CC2)ccc1C ZINC000186315867 946875242 /nfs/dbraw/zinc/87/52/42/946875242.db2.gz FNITZXJTJHNSCF-UHFFFAOYSA-N 0 0 374.824 3.913 20 5 FHBDRN C[C@H](NC(=O)N1CCc2[nH]c3ccccc3c2C1)c1ccc([N+](=O)[O-])cc1 ZINC000458884703 946877274 /nfs/dbraw/zinc/87/72/74/946877274.db2.gz FTRSNMUZCLMCEV-ZDUSSCGKSA-N 0 0 364.405 3.905 20 5 FHBDRN Cn1c(SCCOc2ccc([N+](=O)[O-])cc2)nnc1-c1ccc(F)cc1 ZINC000120898092 946888451 /nfs/dbraw/zinc/88/84/51/946888451.db2.gz GXIITQPCMYJAMS-UHFFFAOYSA-N 0 0 374.397 3.701 20 5 FHBDRN CCS[C@@H]1CCCC[C@@H]1Nc1nc(C)cc(C(=O)OC)c1[N+](=O)[O-] ZINC000550390271 946889978 /nfs/dbraw/zinc/88/99/78/946889978.db2.gz QFDFOUHFZZPIBB-QWHCGFSZSA-N 0 0 353.444 3.561 20 5 FHBDRN C[C@@H]1CC[C@H](NC(=O)c2cc(F)cc3c(=O)c4cccc(F)c4[nH]c23)C1 ZINC000444468760 946890295 /nfs/dbraw/zinc/89/02/95/946890295.db2.gz RIJXERGFVLKURF-PWSUYJOCSA-N 0 0 356.372 3.878 20 5 FHBDRN O=C1OC(c2cccc([N+](=O)[O-])c2)=N/C1=C\c1coc(-c2ccccc2)n1 ZINC000109043320 946894606 /nfs/dbraw/zinc/89/46/06/946894606.db2.gz WEHLTBYFVCTOPH-YBEGLDIGSA-N 0 0 361.313 3.594 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)N1CCC[C@@H]1c1ccccc1 ZINC000184506524 946901395 /nfs/dbraw/zinc/90/13/95/946901395.db2.gz VCFIPTGVZJKFNE-QGZVFWFLSA-N 0 0 367.405 3.514 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2noc(CN3CCC[C@@H]3c3ccccc3)n2)c1 ZINC000025934867 946905669 /nfs/dbraw/zinc/90/56/69/946905669.db2.gz VFQHSSKNJBFQCT-QGZVFWFLSA-N 0 0 350.378 3.982 20 5 FHBDRN COc1cc(C(=O)NCCOc2ccc(C(C)C)cc2)ccc1[N+](=O)[O-] ZINC000511905584 946911052 /nfs/dbraw/zinc/91/10/52/946911052.db2.gz ZMPPXDSDOPIEGO-UHFFFAOYSA-N 0 0 358.394 3.536 20 5 FHBDRN CCS[C@@H]1CCCCN(C(=O)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000458886787 946916666 /nfs/dbraw/zinc/91/66/66/946916666.db2.gz IQGPCZVPYQAJTE-XJKSGUPXSA-N 0 0 351.472 3.973 20 5 FHBDRN COc1ccc(Nc2ncc(Br)cc2[N+](=O)[O-])c(OC)c1 ZINC000048759851 946916775 /nfs/dbraw/zinc/91/67/75/946916775.db2.gz VBEWWRDFVPALHI-UHFFFAOYSA-N 0 0 354.160 3.513 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)N[C@@H]1CCCc2c(F)cccc21 ZINC000458890029 946940346 /nfs/dbraw/zinc/94/03/46/946940346.db2.gz TYWBGLJMAIZMLO-QGZVFWFLSA-N 0 0 357.385 3.953 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1C[C@H]1c1c(F)cccc1F ZINC000186337671 946950217 /nfs/dbraw/zinc/95/02/17/946950217.db2.gz PJCRKOUCXAOJTO-VXGBXAGGSA-N 0 0 366.751 3.946 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@H]1C[C@@H]1c1cc(F)ccc1F ZINC000186337781 946951161 /nfs/dbraw/zinc/95/11/61/946951161.db2.gz JIHUSRNIEJZJEO-OCCSQVGLSA-N 0 0 366.751 3.946 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1CCC(c2ccsc2)CC1 ZINC000186340357 946957524 /nfs/dbraw/zinc/95/75/24/946957524.db2.gz NCBNTQDTNZPCKO-UHFFFAOYSA-N 0 0 366.464 3.533 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CC[C@@H](C)C[C@@H]2C)cc1OC ZINC000112837035 946957926 /nfs/dbraw/zinc/95/79/26/946957926.db2.gz BEHZVFIXJOMGII-MBNYWOFBSA-N 0 0 350.415 3.557 20 5 FHBDRN COc1ccc([C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2)C(F)(F)F)cc1 ZINC000182625043 946959177 /nfs/dbraw/zinc/95/91/77/946959177.db2.gz FDVBJXVKLYSCMY-CQSZACIVSA-N 0 0 354.284 3.637 20 5 FHBDRN CCOC(C)(C)CNC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000444517758 946970916 /nfs/dbraw/zinc/97/09/16/946970916.db2.gz GQLSQVMMHAISAJ-UHFFFAOYSA-N 0 0 371.437 3.752 20 5 FHBDRN Cn1nc(CNCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])cc1C1CC1 ZINC000897230031 946973491 /nfs/dbraw/zinc/97/34/91/946973491.db2.gz CJVBBCQMZDLODL-UHFFFAOYSA-N 0 0 355.225 3.802 20 5 FHBDRN O=C(c1cccc2c(=O)c3cccc(F)c3[nH]c12)N1CC2(C1)CCCC2 ZINC000444342480 946980224 /nfs/dbraw/zinc/98/02/24/946980224.db2.gz XFXUZNREMFPAGA-UHFFFAOYSA-N 0 0 350.393 3.837 20 5 FHBDRN Nc1c(C(=O)N2CC3(CCC3)c3c2cccc3F)cc(F)cc1[N+](=O)[O-] ZINC000523178024 946983205 /nfs/dbraw/zinc/98/32/05/946983205.db2.gz XZCAZQVBOYELDD-UHFFFAOYSA-N 0 0 359.332 3.537 20 5 FHBDRN COc1ccc(OC)c([C@@H](C)Nc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)c1 ZINC000112963800 946998508 /nfs/dbraw/zinc/99/85/08/946998508.db2.gz YGMDJPUEZLVCPN-LLVKDONJSA-N 0 0 371.393 3.670 20 5 FHBDRN COC(=O)[C@H]1c2ccccc2CCN1Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783571491 947001309 /nfs/dbraw/zinc/00/13/09/947001309.db2.gz FCNPTIBARJVAID-QGZVFWFLSA-N 0 0 360.797 3.521 20 5 FHBDRN Cc1nn(CCC(=O)N(C)[C@@H](C)c2ccc(C)cc2C)c(C)c1[N+](=O)[O-] ZINC000523223264 947006892 /nfs/dbraw/zinc/00/68/92/947006892.db2.gz TXUWNXLEBJMSMO-HNNXBMFYSA-N 0 0 358.442 3.635 20 5 FHBDRN COc1ccc2c(c1)CCC[C@H]2N(C)C(=O)c1cccc([N+](=O)[O-])c1OC ZINC000475388466 947007002 /nfs/dbraw/zinc/00/70/02/947007002.db2.gz PGSLYOPSPYTJIC-QGZVFWFLSA-N 0 0 370.405 3.762 20 5 FHBDRN CN(Cc1ccc(F)c(Cl)c1)C(=O)Cc1ccc([N+](=O)[O-])cc1F ZINC000432262054 947008939 /nfs/dbraw/zinc/00/89/39/947008939.db2.gz KACKHSZWVGOGGS-UHFFFAOYSA-N 0 0 354.740 3.728 20 5 FHBDRN CCc1ccc([C@@H](NC(=O)CCn2nc(C)c([N+](=O)[O-])c2C)C(C)C)cc1 ZINC000523227916 947011541 /nfs/dbraw/zinc/01/15/41/947011541.db2.gz XGTPSQJVKMZGER-IBGZPJMESA-N 0 0 372.469 3.874 20 5 FHBDRN CCc1n[nH]c(C(=O)N(Cc2ccc(C(C)C)cc2)C2CC2)c1[N+](=O)[O-] ZINC000523242038 947017330 /nfs/dbraw/zinc/01/73/30/947017330.db2.gz ZOAHTAYMPMLWPS-UHFFFAOYSA-N 0 0 356.426 3.809 20 5 FHBDRN Cc1cc(Br)cc([N+](=O)[O-])c1OCC(=O)c1ccccc1 ZINC000094296648 947025117 /nfs/dbraw/zinc/02/51/17/947025117.db2.gz NNINKRGMGDUVEU-UHFFFAOYSA-N 0 0 350.168 3.927 20 5 FHBDRN CSCc1cccc(CNC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000511931259 947032524 /nfs/dbraw/zinc/03/25/24/947032524.db2.gz VNPUJCJQKSVKMU-UHFFFAOYSA-N 0 0 373.478 3.842 20 5 FHBDRN CCc1c(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)cnn1CC(C)C ZINC000186354173 947040589 /nfs/dbraw/zinc/04/05/89/947040589.db2.gz GVEJNFPRIOOPKO-UHFFFAOYSA-N 0 0 364.833 3.593 20 5 FHBDRN CC(C)(C)OC1CC(CCNC(=O)c2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000432274988 947044399 /nfs/dbraw/zinc/04/43/99/947044399.db2.gz PTTSPICGUOUSDH-UHFFFAOYSA-N 0 0 354.834 3.962 20 5 FHBDRN O=C(Nc1ccc(Nc2ncccn2)cc1)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000444624039 947055429 /nfs/dbraw/zinc/05/54/29/947055429.db2.gz VBYYBVSMPNCRGY-UHFFFAOYSA-N 0 0 374.360 3.862 20 5 FHBDRN CC[C@H](C)Oc1ccc(C(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000444628648 947059385 /nfs/dbraw/zinc/05/93/85/947059385.db2.gz DIPSCTZRJSJQEO-LBPRGKRZSA-N 0 0 368.393 3.578 20 5 FHBDRN Cc1c2cc(F)ccc2oc1C(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444629359 947060564 /nfs/dbraw/zinc/06/05/64/947060564.db2.gz DBPBFKDGQOZGJR-UHFFFAOYSA-N 0 0 368.324 3.595 20 5 FHBDRN O=C(Nc1ccc(Nc2ncccn2)cc1)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000444631253 947062858 /nfs/dbraw/zinc/06/28/58/947062858.db2.gz TUZRNAKFUOAYIN-UHFFFAOYSA-N 0 0 374.360 3.862 20 5 FHBDRN COc1cccc(NC2CCN(c3cccc(OC)c3[N+](=O)[O-])CC2)c1 ZINC000475427195 947070062 /nfs/dbraw/zinc/07/00/62/947070062.db2.gz FESPBFQOGMMSGN-UHFFFAOYSA-N 0 0 357.410 3.693 20 5 FHBDRN CCc1n[nH]c(C(=O)N2CCCC[C@H]2c2cccc(Cl)c2)c1[N+](=O)[O-] ZINC000444659446 947077592 /nfs/dbraw/zinc/07/75/92/947077592.db2.gz PPQUQCIPBZVIFD-AWEZNQCLSA-N 0 0 362.817 3.901 20 5 FHBDRN O=C(CCCCCc1cccs1)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444641316 947085255 /nfs/dbraw/zinc/08/52/55/947085255.db2.gz UIWYGPMUGIIVFZ-UHFFFAOYSA-N 0 0 372.450 3.952 20 5 FHBDRN CSc1ccccc1[C@H](C)NC(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000441425960 947087418 /nfs/dbraw/zinc/08/74/18/947087418.db2.gz SZHFYXVIVQCHSS-ZDUSSCGKSA-N 0 0 359.451 3.996 20 5 FHBDRN C[C@H](NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ncc(-c2ccccc2)o1 ZINC000444678178 947102632 /nfs/dbraw/zinc/10/26/32/947102632.db2.gz YDVOGTLGTWNNAI-LBPRGKRZSA-N 0 0 363.377 3.977 20 5 FHBDRN C[C@H](c1ccccc1F)N(C)C(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000049653515 947103155 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Cc1ccn(-c2ccc(C(=O)Nc3c(C)ccc([N+](=O)[O-])c3C)cc2)n1 ZINC000444733920 947149570 /nfs/dbraw/zinc/14/95/70/947149570.db2.gz NJPCQMPGHWZJRG-UHFFFAOYSA-N 0 0 350.378 3.958 20 5 FHBDRN COc1cccc(F)c1NC(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000184521684 947158942 /nfs/dbraw/zinc/15/89/42/947158942.db2.gz BBLGEJIVGCVQDZ-SNVBAGLBSA-N 0 0 350.371 3.862 20 5 FHBDRN CCOC(=O)[C@H]1CCN(Cc2cc([N+](=O)[O-])ccc2OC)c2ccccc21 ZINC000444718369 947159524 /nfs/dbraw/zinc/15/95/24/947159524.db2.gz VHKPEEPXLWYYEH-KRWDZBQOSA-N 0 0 370.405 3.660 20 5 FHBDRN CO[C@@](C)(CNC(=O)C(C)(C)c1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000452756862 947169101 /nfs/dbraw/zinc/16/91/01/947169101.db2.gz OQKUJNSHGGDMEZ-FQEVSTJZSA-N 0 0 356.422 3.550 20 5 FHBDRN NC(=O)c1ccc(CN2C[C@@H](c3ccccc3)c3ccccc32)c([N+](=O)[O-])c1 ZINC000444764651 947200211 /nfs/dbraw/zinc/20/02/11/947200211.db2.gz HDZGZNQLAKNVKU-IBGZPJMESA-N 0 0 373.412 3.846 20 5 FHBDRN Cc1c(NC(=O)CCc2nnc(-c3ccccc3)o2)cccc1[N+](=O)[O-] ZINC000021186918 947212283 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Cc1ccc([C@H](C)CNS(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])cc1 ZINC000523418968 947249240 /nfs/dbraw/zinc/24/92/40/947249240.db2.gz LTUZJAOERYJHPI-GFCCVEGCSA-N 0 0 368.842 3.639 20 5 FHBDRN CC(C)[C@H](CNc1ncnc2cccc([N+](=O)[O-])c21)Nc1ccccc1 ZINC000544393751 947255080 /nfs/dbraw/zinc/25/50/80/947255080.db2.gz CNAMYOMVPDQKQQ-INIZCTEOSA-N 0 0 351.410 3.509 20 5 FHBDRN CCCN(C(=O)c1ccnc(N2CC[C@H](C)C2)c1)c1cccc([N+](=O)[O-])c1 ZINC000441436698 947264760 /nfs/dbraw/zinc/26/47/60/947264760.db2.gz FYLKSGBUYIWESM-HNNXBMFYSA-N 0 0 368.437 3.893 20 5 FHBDRN O=C(c1ccccc1Cl)C1CCN(c2ncc([N+](=O)[O-])cc2F)CC1 ZINC000897331738 947287887 /nfs/dbraw/zinc/28/78/87/947287887.db2.gz WTOPFEDILXGUNL-UHFFFAOYSA-N 0 0 363.776 3.882 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NC[C@H]1Cc2ccccc2N(C)C1 ZINC000444865906 947291111 /nfs/dbraw/zinc/29/11/11/947291111.db2.gz SPZQLTBTEVAZSA-OAHLLOKOSA-N 0 0 368.437 3.642 20 5 FHBDRN CSc1cccc(NC(=O)COc2cc(Cl)ccc2[N+](=O)[O-])c1 ZINC000121293046 947292033 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FHBDRN Cc1ccc(NCCCNC(=O)[C@H]2Cc3ccccc3S2)c([N+](=O)[O-])c1 ZINC000523511415 947323375 /nfs/dbraw/zinc/32/33/75/947323375.db2.gz FSQOFNZYCUYBOQ-GOSISDBHSA-N 0 0 371.462 3.538 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@@H](C)Sc1ccccc1 ZINC000444903997 947323906 /nfs/dbraw/zinc/32/39/06/947323906.db2.gz QPBULTBCHPGABX-GFCCVEGCSA-N 0 0 361.423 3.906 20 5 FHBDRN CCO[C@@H](C(=O)NCCCNc1ccc(C)cc1[N+](=O)[O-])c1ccccc1 ZINC000523511967 947324889 /nfs/dbraw/zinc/32/48/89/947324889.db2.gz BRAJGBZHLZJDEK-LJQANCHMSA-N 0 0 371.437 3.599 20 5 FHBDRN CCc1ocnc1C(=O)N(Cc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000440595353 947332031 /nfs/dbraw/zinc/33/20/31/947332031.db2.gz DACJGINZFAHEST-UHFFFAOYSA-N 0 0 351.362 3.992 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N1CCC[C@H]1Cc1ccc(F)cc1 ZINC000444896448 947337586 /nfs/dbraw/zinc/33/75/86/947337586.db2.gz LUMFLOATVBBOEO-HNNXBMFYSA-N 0 0 373.384 3.982 20 5 FHBDRN Cn1cc(C(=O)O[C@@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)c2ccccc21 ZINC000759930332 947338834 /nfs/dbraw/zinc/33/88/34/947338834.db2.gz IUWLZRLXXORZMI-IAGOWNOFSA-N 0 0 368.393 3.624 20 5 FHBDRN COc1cc(F)c([N+](=O)[O-])c(NCc2cnn(Cc3ccccc3)c2)c1 ZINC000301432110 947340761 /nfs/dbraw/zinc/34/07/61/947340761.db2.gz HENCDRSGTDFRJW-UHFFFAOYSA-N 0 0 356.357 3.599 20 5 FHBDRN Cc1ccc(Cl)c(NC(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)c1 ZINC000444919127 947355105 /nfs/dbraw/zinc/35/51/05/947355105.db2.gz CQBFMUDZHCLVSI-UHFFFAOYSA-N 0 0 359.773 3.755 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N(CCc1ccc(F)cc1)C1CC1 ZINC000444935642 947358773 /nfs/dbraw/zinc/35/87/73/947358773.db2.gz GCQHYTCMYPPHIJ-UHFFFAOYSA-N 0 0 373.384 3.982 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[C@@H](COc2ccccc2)C1 ZINC000444938086 947360350 /nfs/dbraw/zinc/36/03/50/947360350.db2.gz VINLQYZYRJLIIS-CQSZACIVSA-N 0 0 371.393 3.536 20 5 FHBDRN CCCOc1ccc(NC(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000444943091 947363078 /nfs/dbraw/zinc/36/30/78/947363078.db2.gz NXVQCCCJIRTDEP-UHFFFAOYSA-N 0 0 369.381 3.582 20 5 FHBDRN Cc1ccc(F)c(NC(=O)NCCCNc2ccc(C)cc2[N+](=O)[O-])c1 ZINC000523553223 947365970 /nfs/dbraw/zinc/36/59/70/947365970.db2.gz SVYXXWVVZTZVCK-UHFFFAOYSA-N 0 0 360.389 3.974 20 5 FHBDRN Cc1ccc(-c2nc(Cn3cnc(-c4ccc([N+](=O)[O-])cc4)n3)cs2)o1 ZINC000508514088 947385548 /nfs/dbraw/zinc/38/55/48/947385548.db2.gz SEYRMQQGZHIYJP-UHFFFAOYSA-N 0 0 367.390 3.927 20 5 FHBDRN O=C(Nc1nc(-c2cccc3ccccc32)cs1)c1n[nH]cc1[N+](=O)[O-] ZINC000126780598 947388306 /nfs/dbraw/zinc/38/83/06/947388306.db2.gz CTEPDFBLPMKRFC-UHFFFAOYSA-N 0 0 365.374 3.847 20 5 FHBDRN CC[C@@H](CNC(=O)Cc1ccc([N+](=O)[O-])cc1)Oc1cccc(Cl)c1 ZINC000440621757 947391144 /nfs/dbraw/zinc/39/11/44/947391144.db2.gz RNHHIHIPYKRTFB-INIZCTEOSA-N 0 0 362.813 3.765 20 5 FHBDRN O=C(CCCc1cccs1)O[C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1 ZINC000759929761 947395572 /nfs/dbraw/zinc/39/55/72/947395572.db2.gz HYWFVJVKYBISDZ-LSDHHAIUSA-N 0 0 363.439 3.903 20 5 FHBDRN O=C(N[C@H]1CCc2c1cccc2O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000523581011 947396803 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366.377 3.680 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N(C)[C@H](C)Cc1ccccc1C ZINC000445061671 947463970 /nfs/dbraw/zinc/46/39/70/947463970.db2.gz CRNPQBHSGLCKPB-OAHLLOKOSA-N 0 0 371.437 3.684 20 5 FHBDRN CC(C)(NC(=O)NC[C@@H]1CCCCC1(F)F)c1ccccc1[N+](=O)[O-] ZINC000458955309 947471744 /nfs/dbraw/zinc/47/17/44/947471744.db2.gz WLBQOXWSCAWAOK-LBPRGKRZSA-N 0 0 355.385 3.955 20 5 FHBDRN COc1ccccc1[C@H]1CCCN1c1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1 ZINC000367726365 947507746 /nfs/dbraw/zinc/50/77/46/947507746.db2.gz BYHAQLPKMXPFQU-MRXNPFEDSA-N 0 0 366.377 3.594 20 5 FHBDRN Cc1cccc(C(=O)NCc2ccc(OC3CCCCC3)nc2)c1[N+](=O)[O-] ZINC000523682478 947510707 /nfs/dbraw/zinc/51/07/07/947510707.db2.gz YHMOIOSWLPBJTK-UHFFFAOYSA-N 0 0 369.421 3.940 20 5 FHBDRN CCC(=O)c1ccc(NCc2ccncc2OCC(F)F)c([N+](=O)[O-])c1 ZINC000440655795 947519285 /nfs/dbraw/zinc/51/92/85/947519285.db2.gz WZQBYHZDKCDYPG-UHFFFAOYSA-N 0 0 365.336 3.839 20 5 FHBDRN COC(=O)[C@H](C)[C@@H](NCc1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1 ZINC000152074025 947520275 /nfs/dbraw/zinc/52/02/75/947520275.db2.gz ZSZDTDUDXLLJAP-SJKOYZFVSA-N 0 0 362.813 3.888 20 5 FHBDRN C[C@@H](NC(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@@H](C)C1CCCCC1 ZINC000445108307 947521013 /nfs/dbraw/zinc/52/10/13/947521013.db2.gz JLQCEDNLIVZGKW-CHWSQXEVSA-N 0 0 373.457 3.875 20 5 FHBDRN CCC(=O)c1ccc(C(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000427571274 947523893 /nfs/dbraw/zinc/52/38/93/947523893.db2.gz BXIGHLCBUOKXDM-UHFFFAOYSA-N 0 0 352.390 3.992 20 5 FHBDRN Cc1ccc2cccc(NC(=O)NCCOc3ccc([N+](=O)[O-])cc3)c2n1 ZINC000523702908 947529450 /nfs/dbraw/zinc/52/94/50/947529450.db2.gz ZUHSOGGPVWZSJE-UHFFFAOYSA-N 0 0 366.377 3.652 20 5 FHBDRN Cc1c(OCC(=O)NCc2ccc(COC(C)C)cc2)cccc1[N+](=O)[O-] ZINC000053837961 947553859 /nfs/dbraw/zinc/55/38/59/947553859.db2.gz XXCXVXLVUBAEEV-UHFFFAOYSA-N 0 0 372.421 3.523 20 5 FHBDRN CN(C(=O)CSc1cccc2cccnc21)c1ccc([N+](=O)[O-])cc1 ZINC000053854074 947560246 /nfs/dbraw/zinc/56/02/46/947560246.db2.gz QCVPLDZXOOUDMT-UHFFFAOYSA-N 0 0 353.403 3.898 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3.814 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]cc(Cc3noc(CCc4ccc(O)cc4)n3)c2c1 ZINC000445238418 947633806 /nfs/dbraw/zinc/63/38/06/947633806.db2.gz WQFAMWMVJNRNKH-UHFFFAOYSA-N 0 0 364.361 3.541 20 5 FHBDRN CNC(=O)Nc1cccc(NC(=O)c2c(C)cc(Cl)cc2[N+](=O)[O-])c1 ZINC000445247665 947643801 /nfs/dbraw/zinc/64/38/01/947643801.db2.gz IUDMXWBRADCURE-UHFFFAOYSA-N 0 0 362.773 3.560 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N1CCSC[C@@H]1c1ccc(C)cc1 ZINC000523850083 947651363 /nfs/dbraw/zinc/65/13/63/947651363.db2.gz KPLJUCUPNVRCIF-QGZVFWFLSA-N 0 0 372.446 3.842 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1C(=O)OCC(=O)Nc1ccccc1C(C)C ZINC000026113766 947657437 /nfs/dbraw/zinc/65/74/37/947657437.db2.gz FFVBABDXPMRRSG-UHFFFAOYSA-N 0 0 356.378 3.822 20 5 FHBDRN CCCCSCCC(=O)O[C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000759936171 947693204 /nfs/dbraw/zinc/69/32/04/947693204.db2.gz TURRAOUZCKLIOC-ZIAGYGMSSA-N 0 0 355.460 3.742 20 5 FHBDRN CCCc1ncc(C(=O)O[C@@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)s1 ZINC000759936163 947698058 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COc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2C[C@H]2c2ccccc2C)cc1SC ZINC000125774795 947739651 /nfs/dbraw/zinc/73/96/51/947739651.db2.gz QCDLZYQNKQVZDO-DZGCQCFKSA-N 0 0 372.446 3.920 20 5 FHBDRN CN1CCN(Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)Cc2ccccc21 ZINC000536362379 947742485 /nfs/dbraw/zinc/74/24/85/947742485.db2.gz HMEBAQAHLSHKKK-UHFFFAOYSA-N 0 0 364.405 3.702 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N2CC[C@@H](c3ccccc3)C2)cc1OC ZINC000121558908 947748815 /nfs/dbraw/zinc/74/88/15/947748815.db2.gz XVSBKFBUSRHVII-OAHLLOKOSA-N 0 0 370.405 3.632 20 5 FHBDRN CCN(Cc1ccc(Cl)cc1)C(=O)CCn1nc(C)c([N+](=O)[O-])c1C ZINC000523946863 947751416 /nfs/dbraw/zinc/75/14/16/947751416.db2.gz SEUDQFLOUDCSGL-UHFFFAOYSA-N 0 0 364.833 3.500 20 5 FHBDRN O=C(N[C@H](c1ccco1)c1ccccc1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000105003132 947752441 /nfs/dbraw/zinc/75/24/41/947752441.db2.gz VMMCMPFOYLSLEH-KRWDZBQOSA-N 0 0 367.317 3.615 20 5 FHBDRN O=C(Cc1c[nH]c2cc(F)ccc12)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000129524876 947767106 /nfs/dbraw/zinc/76/71/06/947767106.db2.gz ARWDMYYBZWDBRJ-UHFFFAOYSA-N 0 0 367.380 3.949 20 5 FHBDRN C[C@@H](C[C@@H](O)c1cccs1)Nc1ncc([N+](=O)[O-])cc1Br ZINC000128873087 947771697 /nfs/dbraw/zinc/77/16/97/947771697.db2.gz LIGKPCMDFKDQDY-GZMMTYOYSA-N 0 0 372.244 3.738 20 5 FHBDRN Cc1c(CNC(=O)Cc2ccc(F)cc2[N+](=O)[O-])oc2ccc(F)cc12 ZINC001126231587 947784153 /nfs/dbraw/zinc/78/41/53/947784153.db2.gz RGLYGURISSOAAU-UHFFFAOYSA-N 0 0 360.316 3.787 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)[C@@H]1CC(=O)N(C2CCC(C)CC2)C1 ZINC000129496340 947822755 /nfs/dbraw/zinc/82/27/55/947822755.db2.gz DVFMSUYWRTUMFB-DSSZZKGTSA-N 0 0 373.453 3.577 20 5 FHBDRN CC[C@@H](NC(=O)N1CCCC[C@H](SC)C1)c1cccc([N+](=O)[O-])c1 ZINC000129508740 947822831 /nfs/dbraw/zinc/82/28/31/947822831.db2.gz HKHMPBNVBVZSSD-JKSUJKDBSA-N 0 0 351.472 3.973 20 5 FHBDRN CC(C)Oc1cc(C(=O)NCC2Cc3ccccc3C2)ccc1[N+](=O)[O-] ZINC001126240397 947826128 /nfs/dbraw/zinc/82/61/28/947826128.db2.gz NZMWJEGMKKPHAX-UHFFFAOYSA-N 0 0 354.406 3.527 20 5 FHBDRN O=[N+]([O-])c1cccc(Cl)c1N1CCC[C@@H](c2nnc3ccccn32)C1 ZINC000432309725 947831197 /nfs/dbraw/zinc/83/11/97/947831197.db2.gz YRRXPANLMVPHDG-GFCCVEGCSA-N 0 0 357.801 3.675 20 5 FHBDRN CCn1nc(C)c(CNC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1C ZINC000520477210 947856888 /nfs/dbraw/zinc/85/68/88/947856888.db2.gz HQCIQYTYSLZOAP-UHFFFAOYSA-N 0 0 373.457 3.548 20 5 FHBDRN Cc1sc(C(=O)N2C[C@H](C)N(Cc3ccccc3)C[C@H]2C)cc1[N+](=O)[O-] ZINC000500440476 947878672 /nfs/dbraw/zinc/87/86/72/947878672.db2.gz KQLQBHOQJHJJAA-UONOGXRCSA-N 0 0 373.478 3.700 20 5 FHBDRN C[C@@H](CNc1ncc([N+](=O)[O-])cn1)Sc1ccc(Br)cc1 ZINC000302160052 947888214 /nfs/dbraw/zinc/88/82/14/947888214.db2.gz OSFWOWUKDLFTSN-VIFPVBQESA-N 0 0 369.244 3.740 20 5 FHBDRN Cn1cc([N+](=O)[O-])cc1C(=O)Nc1ccc(Oc2ccccc2F)nc1 ZINC000520478857 947904951 /nfs/dbraw/zinc/90/49/51/947904951.db2.gz YKFKZAXAECSJKQ-UHFFFAOYSA-N 0 0 356.313 3.512 20 5 FHBDRN Cc1csc(CNC(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)n1 ZINC000184618666 947910336 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/nfs/dbraw/zinc/06/02/55/948060255.db2.gz SWRKVRKLRAWDFZ-UHFFFAOYSA-N 0 0 351.449 3.859 20 5 FHBDRN O=[N+]([O-])c1cccc(Cl)c1N1CCC(c2nnc3ccccn32)CC1 ZINC000432325324 948066290 /nfs/dbraw/zinc/06/62/90/948066290.db2.gz KGLSLMOXCJHQGX-UHFFFAOYSA-N 0 0 357.801 3.675 20 5 FHBDRN O=C(C1CCCCC1)N1CC[C@@H](Nc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000432326161 948073680 /nfs/dbraw/zinc/07/36/80/948073680.db2.gz AFZPTSHXUAZLLG-CYBMUJFWSA-N 0 0 351.834 3.841 20 5 FHBDRN CC(C)CCSCC(=O)O[C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000759945298 948081404 /nfs/dbraw/zinc/08/14/04/948081404.db2.gz UECVBEIQRILVMY-ZIAGYGMSSA-N 0 0 355.460 3.598 20 5 FHBDRN CSC1(CNc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CCOCC1 ZINC000080650805 948085113 /nfs/dbraw/zinc/08/51/13/948085113.db2.gz QLCCZZOEGUTQQZ-UHFFFAOYSA-N 0 0 350.362 3.938 20 5 FHBDRN O=[N+]([O-])c1cccc2c(N3CCO[C@]4(CCc5ccccc54)C3)ccnc21 ZINC000432331242 948112621 /nfs/dbraw/zinc/11/26/21/948112621.db2.gz KPJJHCBJONNGGL-OAQYLSRUSA-N 0 0 361.401 3.821 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@@H]1c1ccncc1 ZINC000184664043 948119095 /nfs/dbraw/zinc/11/90/95/948119095.db2.gz FZSLWWWPDNMDDP-QFBILLFUSA-N 0 0 353.422 3.922 20 5 FHBDRN CCN(CC)c1ccc(CNc2ccnc3c2cccc3[N+](=O)[O-])cn1 ZINC000432332292 948119207 /nfs/dbraw/zinc/11/92/07/948119207.db2.gz WGPRSLHULYNFJN-UHFFFAOYSA-N 0 0 351.410 3.996 20 5 FHBDRN Cc1ncc([N+](=O)[O-])n1CC(=O)NCC1(c2ccccc2)CCCCCC1 ZINC001143528248 948127807 /nfs/dbraw/zinc/12/78/07/948127807.db2.gz KKNPXEUIWLFTIL-UHFFFAOYSA-N 0 0 370.453 3.508 20 5 FHBDRN CNc1ccc(C(=O)Nc2cc(Br)ccc2C)cc1[N+](=O)[O-] ZINC000053998214 948128572 /nfs/dbraw/zinc/12/85/72/948128572.db2.gz GOQKXSNPHZWNDI-UHFFFAOYSA-N 0 0 364.199 3.960 20 5 FHBDRN CSc1ccc(C(=O)O[C@@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)cc1 ZINC000759946945 948135833 /nfs/dbraw/zinc/13/58/33/948135833.db2.gz JTEUPGBHMIMYJG-HUUCEWRRSA-N 0 0 361.423 3.854 20 5 FHBDRN O=[N+]([O-])c1cccc(Cl)c1N1CCC(OC[C@H]2CCCCO2)CC1 ZINC000432337746 948151529 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FHBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N(C)CCOC(C)(C)C ZINC000585701163 948179121 /nfs/dbraw/zinc/17/91/21/948179121.db2.gz KPFAHBJVPGCVGU-UHFFFAOYSA-N 0 0 373.247 3.553 20 5 FHBDRN CCn1nccc1C1CCN(C(=O)Nc2ccc([N+](=O)[O-])c(C)c2)CC1 ZINC000278932353 948188614 /nfs/dbraw/zinc/18/86/14/948188614.db2.gz XQTVEZIRTXJIPB-UHFFFAOYSA-N 0 0 357.414 3.531 20 5 FHBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)Nc1cnccc1-c1ccccc1 ZINC000432352403 948198028 /nfs/dbraw/zinc/19/80/28/948198028.db2.gz XOOZVPDUDZVRPD-UHFFFAOYSA-N 0 0 369.402 3.599 20 5 FHBDRN C[C@H](COc1ccccc1)Nc1ncc([N+](=O)[O-])cc1Br ZINC000749145282 948204471 /nfs/dbraw/zinc/20/44/71/948204471.db2.gz WPPSACCDNYPKRW-SNVBAGLBSA-N 0 0 352.188 3.632 20 5 FHBDRN O=C(NCc1coc(-c2ccccc2)n1)[C@H]1C[C@H]1c1cccc([N+](=O)[O-])c1 ZINC001126298612 948204871 /nfs/dbraw/zinc/20/48/71/948204871.db2.gz PFHBOJBZQLXFDJ-ROUUACIJSA-N 0 0 363.373 3.670 20 5 FHBDRN O=C(/C=C/c1cccc(F)c1)O[C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1 ZINC000759949042 948209954 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COc1ccc([N+](=O)[O-])cc1C(=O)Nc1csnc1-c1ccccc1 ZINC001126307796 948299429 /nfs/dbraw/zinc/29/94/29/948299429.db2.gz OAPMDNSDLFYJAE-UHFFFAOYSA-N 0 0 355.375 3.979 20 5 FHBDRN CCOc1ccc(C(=O)NCC(C)(C)c2cccc(OC)c2)cc1[N+](=O)[O-] ZINC000441584758 948309468 /nfs/dbraw/zinc/30/94/68/948309468.db2.gz ALXBVSMDPFWNKZ-UHFFFAOYSA-N 0 0 372.421 3.710 20 5 FHBDRN CC(C)Oc1cc(NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)ccn1 ZINC000614592702 948311543 /nfs/dbraw/zinc/31/15/43/948311543.db2.gz NXDPFFQJENIHFX-UHFFFAOYSA-N 0 0 361.373 3.832 20 5 FHBDRN Cc1ccc(Sc2ccc(C(=O)N(C)[C@H]3CCOC3)cc2[N+](=O)[O-])cc1 ZINC000106847076 948319853 /nfs/dbraw/zinc/31/98/53/948319853.db2.gz WTNNUAAFXBXPMJ-HNNXBMFYSA-N 0 0 372.446 3.915 20 5 FHBDRN CC(C)(C)c1ccc(NC(=O)N2CCC[C@H](n3ccnc3)C2)cc1[N+](=O)[O-] ZINC000585808433 948329306 /nfs/dbraw/zinc/32/93/06/948329306.db2.gz HBNIGSNLPXSOFL-HNNXBMFYSA-N 0 0 371.441 3.958 20 5 FHBDRN O=C(NCCNc1ccc2ccccc2n1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000125964203 948330605 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CCn1cc([N+](=O)[O-])c(C(=O)Nc2ccc(OC3CCCCC3)cc2)n1 ZINC000427607027 948385826 /nfs/dbraw/zinc/38/58/26/948385826.db2.gz QFKGWPFMBKFXQR-UHFFFAOYSA-N 0 0 358.398 3.775 20 5 FHBDRN CCC(O)(CC)CCNC(=O)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000279004635 948392257 /nfs/dbraw/zinc/39/22/57/948392257.db2.gz GYASATNEMZCVKI-UHFFFAOYSA-N 0 0 352.434 3.765 20 5 FHBDRN Cc1ccc(SCCNC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)cc1 ZINC000512091315 948401034 /nfs/dbraw/zinc/40/10/34/948401034.db2.gz KVSLEWVKJOXRMH-UHFFFAOYSA-N 0 0 355.419 3.907 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)Nc1c(F)cccc1Oc1ccccc1 ZINC000107167335 948414823 /nfs/dbraw/zinc/41/48/23/948414823.db2.gz USQBZHHDLXOIBO-UHFFFAOYSA-N 0 0 370.340 3.670 20 5 FHBDRN C[C@@H]1C[C@H](c2cccnc2)N(C(=O)CCCNc2ccc([N+](=O)[O-])cc2)C1 ZINC000184777418 948429108 /nfs/dbraw/zinc/42/91/08/948429108.db2.gz QACGVXIYGOJFHQ-DNVCBOLYSA-N 0 0 368.437 3.792 20 5 FHBDRN CC(C)CCSc1ccc(C(=O)N[C@@H]2CCOC[C@H]2C)cc1[N+](=O)[O-] ZINC000432446460 948440662 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FHBDRN O=C(N[C@@H]1CCC[C@@H]1F)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000568436617 568037924 /nfs/dbraw/zinc/03/79/24/568037924.db2.gz VVFCITOPRLIVQO-DLBZAZTESA-N 0 0 358.369 3.794 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N(C)Cc1ccccc1N(C)C ZINC000568442497 568038337 /nfs/dbraw/zinc/03/83/37/568038337.db2.gz PNTUSFGJUOIXPE-QGZVFWFLSA-N 0 0 369.465 3.888 20 5 FHBDRN C[C@H]1CC2(CCC2)CN1C(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000568459514 568040052 /nfs/dbraw/zinc/04/00/52/568040052.db2.gz QBICCVHRIRHZJP-ZDUSSCGKSA-N 0 0 356.426 3.593 20 5 FHBDRN CCc1cc(O)ccc1NC(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000481535664 568043431 /nfs/dbraw/zinc/04/34/31/568043431.db2.gz XMIKALPAGUMWCR-JTQLQIEISA-N 0 0 364.785 3.922 20 5 FHBDRN CCn1c(C)nc([N+](=O)[O-])c1NCc1ccc(N2CCCCCC2)nc1 ZINC000568495443 568044582 /nfs/dbraw/zinc/04/45/82/568044582.db2.gz SVFZNJOYWGAKPO-UHFFFAOYSA-N 0 0 358.446 3.507 20 5 FHBDRN CCn1nc(C)c(CN[C@@H](c2ccc([N+](=O)[O-])cc2)C(F)(F)F)c1C ZINC000568522558 568046041 /nfs/dbraw/zinc/04/60/41/568046041.db2.gz ZFFCNYLEQIIREU-HNNXBMFYSA-N 0 0 356.348 3.821 20 5 FHBDRN CC(C)(CCc1noc([C@H]2CCN(c3ccccc3Cl)C2)n1)[N+](=O)[O-] ZINC000291101816 568049325 /nfs/dbraw/zinc/04/93/25/568049325.db2.gz RJCGVQQSKYIYCS-LBPRGKRZSA-N 0 0 364.833 3.705 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(-c2nnco2)c1 ZINC000024735843 568063753 /nfs/dbraw/zinc/06/37/53/568063753.db2.gz ZQUVMZOIKNZEEE-NSHDSACASA-N 0 0 370.390 3.764 20 5 FHBDRN CSc1ccc(C(=O)N[C@@H]2CCOC3(CCCC3)C2)cc1[N+](=O)[O-] ZINC000159256311 568069570 /nfs/dbraw/zinc/06/95/70/568069570.db2.gz CLTDJEUGVXBWHD-CYBMUJFWSA-N 0 0 350.440 3.538 20 5 FHBDRN CCOc1ccc(C(=O)NCc2cc(-c3ccccc3)on2)cc1[N+](=O)[O-] ZINC000128604786 568073751 /nfs/dbraw/zinc/07/37/51/568073751.db2.gz QHPJTSUNDZFCCF-UHFFFAOYSA-N 0 0 367.361 3.579 20 5 FHBDRN C[C@@H](C(=O)NC[C@H]1CCC2(CCCCC2)O1)c1ccc([N+](=O)[O-])cc1F ZINC000481634112 568074990 /nfs/dbraw/zinc/07/49/90/568074990.db2.gz PMYKTXQMOPBPCA-UKRRQHHQSA-N 0 0 364.417 3.836 20 5 FHBDRN O=C(NC[C@@H]1CCC2(CCCCC2)O1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000481637800 568075315 /nfs/dbraw/zinc/07/53/15/568075315.db2.gz ZFSTUGZREUWEEN-ZDUSSCGKSA-N 0 0 352.818 3.860 20 5 FHBDRN Cn1nc([N+](=O)[O-])cc1C(=O)N[C@H](c1cccc(Cl)c1)C1CCCC1 ZINC000481671669 568080896 /nfs/dbraw/zinc/08/08/96/568080896.db2.gz QCMFQNGCUXPUBS-INIZCTEOSA-N 0 0 362.817 3.643 20 5 FHBDRN CN(CCOc1ccc(F)cc1)C(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000128615528 568081212 /nfs/dbraw/zinc/08/12/12/568081212.db2.gz UDGUSSVNOQIAMZ-UHFFFAOYSA-N 0 0 352.749 3.538 20 5 FHBDRN O=C(N[C@H]1C[C@H](c2ccc(F)cc2)C1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000481658650 568082280 /nfs/dbraw/zinc/08/22/80/568082280.db2.gz QAUUNWGXWXRRCY-CZIWCDLHSA-N 0 0 369.396 3.984 20 5 FHBDRN Cc1cc(OCC(=O)Nc2ccc(C(=O)C(C)C)cc2)ccc1[N+](=O)[O-] ZINC000452971211 568086285 /nfs/dbraw/zinc/08/62/85/568086285.db2.gz HJZWFECFONHNFF-UHFFFAOYSA-N 0 0 356.378 3.759 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(N(C)CCCc2cc(-c3cccc(F)c3)n[nH]2)n1 ZINC000481686574 568089278 /nfs/dbraw/zinc/08/92/78/568089278.db2.gz INOCZBKLLQBIDM-UHFFFAOYSA-N 0 0 369.400 3.896 20 5 FHBDRN Cc1ccccc1N(C(C)C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1F ZINC000068921089 568089998 /nfs/dbraw/zinc/08/99/98/568089998.db2.gz KAPWBFHMZXVIIC-UHFFFAOYSA-N 0 0 352.387 3.646 20 5 FHBDRN CC1(C)C[C@H](NC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)C(C)(C)O1 ZINC000481704075 568090436 /nfs/dbraw/zinc/09/04/36/568090436.db2.gz WDXLOMHRBGXUFU-LBPRGKRZSA-N 0 0 373.356 3.664 20 5 FHBDRN Cc1c(CC(=O)N2CCC[C@H]2CC(=O)c2cccs2)cccc1[N+](=O)[O-] ZINC000128632733 568092406 /nfs/dbraw/zinc/09/24/06/568092406.db2.gz DYPGGSDIWPVMEC-HNNXBMFYSA-N 0 0 372.446 3.771 20 5 FHBDRN COc1ccc(Nc2nc(C)ccc2[N+](=O)[O-])cc1N1CCCCC1=O ZINC000481694118 568092431 /nfs/dbraw/zinc/09/24/31/568092431.db2.gz ZYBWQRWIGSVPJL-UHFFFAOYSA-N 0 0 356.382 3.567 20 5 FHBDRN C[C@H]1CCC[N@H+](Cc2ccc(NC(=O)c3ccc([O-])c([N+](=O)[O-])c3)cc2)C1 ZINC000436629921 568096262 /nfs/dbraw/zinc/09/62/62/568096262.db2.gz YBFXCBWAXGGZIF-AWEZNQCLSA-N 0 0 369.421 3.785 20 5 FHBDRN CC(C)c1ccc(CN(C)C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)cc1 ZINC000481741900 568099585 /nfs/dbraw/zinc/09/95/85/568099585.db2.gz MUPXEZLQUAMEFF-UHFFFAOYSA-N 0 0 352.394 3.867 20 5 FHBDRN CC(=O)Nc1ccc(SCc2cc([N+](=O)[O-])cc3c2OCOC3)cc1 ZINC000006919749 568113731 /nfs/dbraw/zinc/11/37/31/568113731.db2.gz YELBMZXYRCUEJW-UHFFFAOYSA-N 0 0 360.391 3.712 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)NCc1cn2cc(Cl)ccc2n1 ZINC000568687108 568122773 /nfs/dbraw/zinc/12/27/73/568122773.db2.gz KIYXGYOIKDOMID-UHFFFAOYSA-N 0 0 373.800 3.780 20 5 FHBDRN Cc1cc(C2CC2)nc(NC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])n1 ZINC000291359519 568123663 /nfs/dbraw/zinc/12/36/63/568123663.db2.gz ASGSOZIEHQXGEK-UHFFFAOYSA-N 0 0 364.764 3.544 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N[C@H]1CCc2cc(F)ccc21 ZINC000159315824 568129483 /nfs/dbraw/zinc/12/94/83/568129483.db2.gz VMVUUJPDDXMPCT-SFHVURJKSA-N 0 0 353.353 3.561 20 5 FHBDRN CC(C)(C)N(Cc1ccccc1)C(=O)COc1ccc([N+](=O)[O-])cc1F ZINC000603676640 568136969 /nfs/dbraw/zinc/13/69/69/568136969.db2.gz QBQUQHMCAZSEQI-UHFFFAOYSA-N 0 0 360.385 3.940 20 5 FHBDRN Cc1cc(C)n(CCCNC(=O)c2cc(Cl)cc(Cl)c2[N+](=O)[O-])n1 ZINC000291420278 568141339 /nfs/dbraw/zinc/14/13/39/568141339.db2.gz HTOIHYAOGOMTDJ-UHFFFAOYSA-N 0 0 371.224 3.535 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1OCC(=O)Nc1cccc(C(F)(F)F)c1 ZINC000603727393 568143880 /nfs/dbraw/zinc/14/38/80/568143880.db2.gz ZJCUNVORSLYQEH-UHFFFAOYSA-N 0 0 354.284 3.940 20 5 FHBDRN COC(=O)c1cc(OCC(=O)c2cc(C)c(C)cc2C)ccc1[N+](=O)[O-] ZINC000481902523 568154072 /nfs/dbraw/zinc/15/40/72/568154072.db2.gz TYQOEXRVGDWMIW-UHFFFAOYSA-N 0 0 357.362 3.568 20 5 FHBDRN Cc1ccc(C(=O)N[C@@H](C[C@@H]2CCOC2)c2ccccc2)cc1[N+](=O)[O-] ZINC000159349952 568158346 /nfs/dbraw/zinc/15/83/46/568158346.db2.gz RGXANZAZLOWXMP-YJBOKZPZSA-N 0 0 354.406 3.801 20 5 FHBDRN COC(=O)c1cc(OCCOc2cccc3ccccc32)ccc1[N+](=O)[O-] ZINC000481900519 568172735 /nfs/dbraw/zinc/17/27/35/568172735.db2.gz OCTYYUJUMJGXAS-UHFFFAOYSA-N 0 0 367.357 3.992 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NCc1nc(Cc2cccc(F)c2)no1 ZINC000447405862 568194462 /nfs/dbraw/zinc/19/44/62/568194462.db2.gz REUOBXSMOAWSQC-UHFFFAOYSA-N 0 0 356.357 3.937 20 5 FHBDRN CS[C@H]1CCC[C@@H](Nc2ccc([N+](=O)[O-])c(N3CCOCC3)c2F)C1 ZINC000568768231 568195993 /nfs/dbraw/zinc/19/59/93/568195993.db2.gz JZARSXAPBLBKIC-OLZOCXBDSA-N 0 0 369.462 3.657 20 5 FHBDRN O=C(COc1ccc(Cc2ccccc2)cc1[N+](=O)[O-])NC1CCCC1 ZINC000481962997 568197061 /nfs/dbraw/zinc/19/70/61/568197061.db2.gz JGGCMAVCPXGJGH-UHFFFAOYSA-N 0 0 354.406 3.623 20 5 FHBDRN CCCN(Cc1ccccc1)C(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000481970784 568202332 /nfs/dbraw/zinc/20/23/32/568202332.db2.gz AZDMHHUUVSPIHX-UHFFFAOYSA-N 0 0 364.405 3.833 20 5 FHBDRN CCCc1[nH]nc(C(=O)Nc2cc(C)cc(C(F)(F)F)c2)c1[N+](=O)[O-] ZINC000617127168 568216807 /nfs/dbraw/zinc/21/68/07/568216807.db2.gz YIMLBNIGBVIQMK-UHFFFAOYSA-N 0 0 356.304 3.850 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H]1CCCC[C@H]1CC(F)(F)F ZINC000453008746 568218154 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20 5 FHBDRN NC(=O)c1ccnc(NCC2(Cc3ccccc3)CCCCC2)c1[N+](=O)[O-] ZINC000568812392 568229617 /nfs/dbraw/zinc/22/96/17/568229617.db2.gz XQOUXTVWSHEZCE-UHFFFAOYSA-N 0 0 368.437 3.694 20 5 FHBDRN CCN(C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F)[C@H]1CCOC(C)(C)C1 ZINC000291620010 568230274 /nfs/dbraw/zinc/23/02/74/568230274.db2.gz NAGQYXCMXPAOQE-LBPRGKRZSA-N 0 0 372.368 3.616 20 5 FHBDRN Cc1c(C(=O)N(C)Cc2ccccc2[N+](=O)[O-])cnn1-c1ccc(F)cc1 ZINC000043841065 568230848 /nfs/dbraw/zinc/23/08/48/568230848.db2.gz YKSQLPRLSDMZEH-UHFFFAOYSA-N 0 0 368.368 3.500 20 5 FHBDRN C[C@H](C(=O)Nc1ccc(Oc2cccnc2)nc1)c1cccc([N+](=O)[O-])c1 ZINC000568829381 568233995 /nfs/dbraw/zinc/23/39/95/568233995.db2.gz VLYZRLJTWRSNDR-ZDUSSCGKSA-N 0 0 364.361 3.919 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1C[C@@H](C)O[C@@H]1C ZINC000412659747 568250508 /nfs/dbraw/zinc/25/05/08/568250508.db2.gz SJGGVYHBRHMXFX-JHJVBQTASA-N 0 0 352.456 3.639 20 5 FHBDRN Cn1c(NC(=O)C(C)(C)c2ccccc2[N+](=O)[O-])nc2cc(F)ccc21 ZINC000568906472 568251761 /nfs/dbraw/zinc/25/17/61/568251761.db2.gz QVSSIQBOIRZIRB-UHFFFAOYSA-N 0 0 356.357 3.537 20 5 FHBDRN Cn1ccnc1[C@H](NCCCc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000568910298 568251915 /nfs/dbraw/zinc/25/19/15/568251915.db2.gz OZAOAUOGVUKWSU-LJQANCHMSA-N 0 0 350.422 3.640 20 5 FHBDRN Cc1cc(-c2nnc(N(Cc3ccccc3[N+](=O)[O-])C3CC3)n2C)c(C)o1 ZINC000568918455 568252105 /nfs/dbraw/zinc/25/21/05/568252105.db2.gz FWNNLTCZAYEBEQ-UHFFFAOYSA-N 0 0 367.409 3.769 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(N2CCN(Cc3ccccc3Cl)CC2)n1 ZINC000541933443 568252274 /nfs/dbraw/zinc/25/22/74/568252274.db2.gz MGHBNEFLZGBICZ-UHFFFAOYSA-N 0 0 360.845 3.582 20 5 FHBDRN CCn1c(C)nc([N+](=O)[O-])c1NCc1ccc(Br)c(F)c1 ZINC000568925208 568252699 /nfs/dbraw/zinc/25/26/99/568252699.db2.gz MQBFGMBNHGTVTC-UHFFFAOYSA-N 0 0 357.183 3.633 20 5 FHBDRN CC(=O)c1ccc([N+](=O)[O-])cc1N1CCN(c2cccc(Cl)c2)CC1 ZINC000568924891 568252710 /nfs/dbraw/zinc/25/27/10/568252710.db2.gz DDFGDIBSKBLJMW-UHFFFAOYSA-N 0 0 359.813 3.777 20 5 FHBDRN CC[C@H](Oc1ccccc1Cl)C(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000482070374 568253792 /nfs/dbraw/zinc/25/37/92/568253792.db2.gz PTTHWFCCPVPYNY-INIZCTEOSA-N 0 0 362.813 3.765 20 5 FHBDRN COc1ccccc1N1CCC(Nc2nc(C)cc(C)c2[N+](=O)[O-])CC1 ZINC000541935479 568258877 /nfs/dbraw/zinc/25/88/77/568258877.db2.gz RVCBDPJQQJRQIH-UHFFFAOYSA-N 0 0 356.426 3.696 20 5 FHBDRN CN(C(=O)c1ccc(F)cc1[N+](=O)[O-])c1nnc(-c2ccccc2)s1 ZINC000366031010 568258894 /nfs/dbraw/zinc/25/88/94/568258894.db2.gz LNAJYUAADYYYPX-UHFFFAOYSA-N 0 0 358.354 3.529 20 5 FHBDRN C[C@](NC(=O)Cc1ccc([N+](=O)[O-])cc1)(c1ccc(F)cc1)C(F)(F)F ZINC000541936850 568259334 /nfs/dbraw/zinc/25/93/34/568259334.db2.gz AGBWUJYFZDTUHL-INIZCTEOSA-N 0 0 370.302 3.870 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)NCc2nc(C(C)C)cs2)c1 ZINC000128760537 568260315 /nfs/dbraw/zinc/26/03/15/568260315.db2.gz DZFCAQDUOYGEFX-UHFFFAOYSA-N 0 0 351.453 3.827 20 5 FHBDRN CCOc1ccc(C(=O)NCc2cccc(C(F)(F)F)c2)cc1[N+](=O)[O-] ZINC000019006304 568261488 /nfs/dbraw/zinc/26/14/88/568261488.db2.gz ICIIWHGTKWQXQL-UHFFFAOYSA-N 0 0 368.311 3.942 20 5 FHBDRN COc1cc(C(=O)N(C)[C@@H](C)Cc2ccc(C)cc2)c([N+](=O)[O-])cc1OC ZINC000128758582 568266160 /nfs/dbraw/zinc/26/61/60/568266160.db2.gz INBCWMCFJBNMKG-AWEZNQCLSA-N 0 0 372.421 3.624 20 5 FHBDRN COc1ccc2c(c1)C[C@H](C)N(CC(=O)Nc1ccccc1[N+](=O)[O-])[C@H]2C ZINC000541952788 568271384 /nfs/dbraw/zinc/27/13/84/568271384.db2.gz UANVYMOOIMNJHI-KBPBESRZSA-N 0 0 369.421 3.550 20 5 FHBDRN Cc1ccccc1[C@H](NS(=O)(=O)c1ccc([N+](=O)[O-])s1)C(C)C ZINC000482104544 568274910 /nfs/dbraw/zinc/27/49/10/568274910.db2.gz OOIRPOXPVQGVAE-OAHLLOKOSA-N 0 0 354.453 3.640 20 5 FHBDRN CSc1cccc(C(=O)N[C@H]2c3ccc(F)cc3O[C@H]2C)c1[N+](=O)[O-] ZINC000569027976 568275542 /nfs/dbraw/zinc/27/55/42/568275542.db2.gz XWMJPMYUDRAMHV-BJOHPYRUSA-N 0 0 362.382 3.708 20 5 FHBDRN CC(C)C[C@H](NC(=O)C(C)(C)C)c1nc(Cc2ccccc2[N+](=O)[O-])no1 ZINC000453053663 568277573 /nfs/dbraw/zinc/27/75/73/568277573.db2.gz GDMHBJMAVGEWFH-AWEZNQCLSA-N 0 0 374.441 3.818 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCC(F)(F)C(F)F ZINC000482151461 568285817 /nfs/dbraw/zinc/28/58/17/568285817.db2.gz STHSJVWVAMNIKR-UHFFFAOYSA-N 0 0 354.325 3.727 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1)CN(Cc1ncc(-c3cccc(F)c3)o1)CCO2 ZINC000569055784 568292907 /nfs/dbraw/zinc/29/29/07/568292907.db2.gz RJLUTANSUXNQGI-UHFFFAOYSA-N 0 0 369.352 3.784 20 5 FHBDRN CCN(C(=O)c1c(C)cc(Cl)cc1[N+](=O)[O-])[C@@H]1CCOC(C)(C)C1 ZINC000291742913 568293836 /nfs/dbraw/zinc/29/38/36/568293836.db2.gz XSJPPZRAILBEIM-CYBMUJFWSA-N 0 0 354.834 3.976 20 5 FHBDRN COc1cc(OCC(=O)N(C)[C@@H](C)c2cc(C)ccc2C)ccc1[N+](=O)[O-] ZINC000604456545 568295014 /nfs/dbraw/zinc/29/50/14/568295014.db2.gz AZZKYUYZXTZPAR-HNNXBMFYSA-N 0 0 372.421 3.819 20 5 FHBDRN COC(=O)c1cc(C)nc(N2CC[C@H]2c2ccc(Cl)cc2)c1[N+](=O)[O-] ZINC000569152964 568295466 /nfs/dbraw/zinc/29/54/66/568295466.db2.gz ZAYKHMDJYWTBJD-AWEZNQCLSA-N 0 0 361.785 3.690 20 5 FHBDRN Cc1ccc([C@H](C)CNC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)cc1 ZINC000482176947 568298611 /nfs/dbraw/zinc/29/86/11/568298611.db2.gz DUVGGMWSIXGUGA-OAHLLOKOSA-N 0 0 364.405 3.622 20 5 FHBDRN Cc1ccc([C@@H](C)CNC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)cc1 ZINC000482176390 568298635 /nfs/dbraw/zinc/29/86/35/568298635.db2.gz DUVGGMWSIXGUGA-HNNXBMFYSA-N 0 0 364.405 3.622 20 5 FHBDRN CCN(C(=O)c1ccc(SC)c([N+](=O)[O-])c1)[C@H]1CCOC(C)(C)C1 ZINC000291766249 568304333 /nfs/dbraw/zinc/30/43/33/568304333.db2.gz ZXZAOKQEVVNWRV-ZDUSSCGKSA-N 0 0 352.456 3.736 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])c[nH]1)N(CC1CC1)c1cccc(C(F)(F)F)c1 ZINC000569208930 568308614 /nfs/dbraw/zinc/30/86/14/568308614.db2.gz GERQYAGRQMKBFC-UHFFFAOYSA-N 0 0 353.300 3.999 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N1CCC[C@@H]1c1ccc2c(c1)OCCO2 ZINC000604562648 568311716 /nfs/dbraw/zinc/31/17/16/568311716.db2.gz BSXKNLSXHGTQAD-QGZVFWFLSA-N 0 0 368.389 3.652 20 5 FHBDRN COc1ccc(NC(=O)c2ccn(Cc3ccccc3)c2)cc1[N+](=O)[O-] ZINC000541992188 568312026 /nfs/dbraw/zinc/31/20/26/568312026.db2.gz RLFFQMNHVVKWRP-UHFFFAOYSA-N 0 0 351.362 3.706 20 5 FHBDRN CN(CC(=O)NC[C@@H]1CCCC[C@H]1C(F)(F)F)c1ccccc1[N+](=O)[O-] ZINC000482204789 568312035 /nfs/dbraw/zinc/31/20/35/568312035.db2.gz CDUHXVQACGEKMQ-QWHCGFSZSA-N 0 0 373.375 3.516 20 5 FHBDRN CCc1ccc([C@H](CO)NCc2cc([N+](=O)[O-])ccc2OC(C)C)cc1 ZINC000541984510 568312333 /nfs/dbraw/zinc/31/23/33/568312333.db2.gz XLPQOXLSTFNJJE-IBGZPJMESA-N 0 0 358.438 3.768 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(OCC(=O)N[C@H](C)c2ccc(Cl)cc2)n1 ZINC000541985346 568312709 /nfs/dbraw/zinc/31/27/09/568312709.db2.gz XNPXUCFWTGLEDX-GFCCVEGCSA-N 0 0 363.801 3.516 20 5 FHBDRN COc1ccc(CCCC(=O)N2CCc3ccc([N+](=O)[O-])cc32)c(OC)c1 ZINC000128801164 568350958 /nfs/dbraw/zinc/35/09/58/568350958.db2.gz OVZNUUKVUAJIPW-UHFFFAOYSA-N 0 0 370.405 3.524 20 5 FHBDRN Nc1c(C(=O)N2C[C@H](c3ccccc3)C3(CCC3)C2)cccc1[N+](=O)[O-] ZINC000412673644 568362806 /nfs/dbraw/zinc/36/28/06/568362806.db2.gz MRFYPBHJLDJSPM-MRXNPFEDSA-N 0 0 351.406 3.587 20 5 FHBDRN COc1ccc(Cl)cc1NC(=O)[C@H](C)Oc1ccc([N+](=O)[O-])cc1 ZINC000003515198 568365596 /nfs/dbraw/zinc/36/55/96/568365596.db2.gz MTHMLPLZRXUICL-JTQLQIEISA-N 0 0 350.758 3.663 20 5 FHBDRN CCOCc1nc(C)c(-c2nc(-c3ccc(C)c([N+](=O)[O-])c3)no2)s1 ZINC000453079933 568391372 /nfs/dbraw/zinc/39/13/72/568391372.db2.gz DNDUIWVYGVDNES-UHFFFAOYSA-N 0 0 360.395 3.922 20 5 FHBDRN Cc1cccn(Cc2c(F)cccc2NCc2ccccc2[N+](=O)[O-])c1=O ZINC000569387601 568400150 /nfs/dbraw/zinc/40/01/50/568400150.db2.gz BTNNDBWNOUIHSR-UHFFFAOYSA-N 0 0 367.380 3.864 20 5 FHBDRN CCn1c2ccccc2nc1[C@H](C)NC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000569427062 568402028 /nfs/dbraw/zinc/40/20/28/568402028.db2.gz ZYNJZWBKAHICEG-KBPBESRZSA-N 0 0 366.421 3.945 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])N1C[C@H](c2ccccc2)[C@@H]2CCC[C@@H]21 ZINC000569484187 568403249 /nfs/dbraw/zinc/40/32/49/568403249.db2.gz CONDUDQFDHAHIE-NSHGMRRFSA-N 0 0 350.418 3.932 20 5 FHBDRN Cn1ncc2ccc(CNc3cc(C(F)(F)F)ncc3[N+](=O)[O-])cc21 ZINC000569520236 568404695 /nfs/dbraw/zinc/40/46/95/568404695.db2.gz NSMDVOVSQXXYJO-UHFFFAOYSA-N 0 0 351.288 3.507 20 5 FHBDRN CN(Cc1ccc(F)cc1)C(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000569519924 568404701 /nfs/dbraw/zinc/40/47/01/568404701.db2.gz HIFGKPJGCPBALI-UHFFFAOYSA-N 0 0 370.384 3.599 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1)N1CCN(c2ccc(Cl)cc2)CC1 ZINC000006970266 568407589 /nfs/dbraw/zinc/40/75/89/568407589.db2.gz WIWVVJDXFCKNFL-UHFFFAOYSA-N 0 0 360.801 3.602 20 5 FHBDRN O=[N+]([O-])c1cccc(Cl)c1OC[C@H](O)COc1ccc(Cl)cc1 ZINC000569712333 568413347 /nfs/dbraw/zinc/41/33/47/568413347.db2.gz DCLFFXAVDOOBJW-LLVKDONJSA-N 0 0 358.177 3.720 20 5 FHBDRN Cc1cc(Cc2noc(-c3ccc([N+](=O)[O-])[nH]3)n2)ccc1Br ZINC000569773325 568422994 /nfs/dbraw/zinc/42/29/94/568422994.db2.gz SPYUPLQBIUOKFB-UHFFFAOYSA-N 0 0 363.171 3.635 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(OCC(C)C)nc2)c1 ZINC000569829152 568427946 /nfs/dbraw/zinc/42/79/46/568427946.db2.gz SRQZFMUQLDCSGH-UHFFFAOYSA-N 0 0 359.382 3.676 20 5 FHBDRN COc1cccc([N+](=O)[O-])c1NCc1nc(C)c(Br)s1 ZINC000569942374 568437845 /nfs/dbraw/zinc/43/78/45/568437845.db2.gz ZYXZNHLDLCJALR-UHFFFAOYSA-N 0 0 358.217 3.743 20 5 FHBDRN CCCc1n[nH]c(C(=O)N[C@@H](C)c2ccc(C(F)(F)F)cc2)c1[N+](=O)[O-] ZINC000569979629 568445696 /nfs/dbraw/zinc/44/56/96/568445696.db2.gz XHAWZKUAVHMCMG-VIFPVBQESA-N 0 0 370.331 3.780 20 5 FHBDRN C[C@@H](c1ccccc1)N(C)C(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000032993089 568447694 /nfs/dbraw/zinc/44/76/94/568447694.db2.gz ZDJBPTFMGFISQQ-AWEZNQCLSA-N 0 0 350.378 3.614 20 5 FHBDRN C[C@H](N[C@@H]1CCc2c1cccc2[N+](=O)[O-])c1noc(-c2ccccc2)n1 ZINC000570105912 568451348 /nfs/dbraw/zinc/45/13/48/568451348.db2.gz FMNJKVFHOFNGOF-BLLLJJGKSA-N 0 0 350.378 3.983 20 5 FHBDRN C[C@H](c1nc(-c2ccc(OCC3CC3)nc2)no1)c1cccc([N+](=O)[O-])c1 ZINC000570126124 568453069 /nfs/dbraw/zinc/45/30/69/568453069.db2.gz CLZDKJWQCTUHTF-LBPRGKRZSA-N 0 0 366.377 3.980 20 5 FHBDRN CCCCc1ccc(C(=O)COc2ccc(C(=O)OC)cc2[N+](=O)[O-])cc1 ZINC000007129956 568453740 /nfs/dbraw/zinc/45/37/40/568453740.db2.gz QOTINUANPSNMJA-UHFFFAOYSA-N 0 0 371.389 3.986 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)NCCc1c[nH]c2ccc(F)cc12 ZINC000570076154 568457290 /nfs/dbraw/zinc/45/72/90/568457290.db2.gz VMQOEUFNUSBKAE-UHFFFAOYSA-N 0 0 372.356 3.588 20 5 FHBDRN CN(Cc1ccc(Cl)c(Cl)c1)C(=O)CNc1cccc([N+](=O)[O-])c1 ZINC000007116097 568457506 /nfs/dbraw/zinc/45/75/06/568457506.db2.gz KLXPSPICQBFRLK-UHFFFAOYSA-N 0 0 368.220 3.972 20 5 FHBDRN C[C@H](NC(=O)CNc1cccc([N+](=O)[O-])c1)c1ccc2c(c1)CCCC2 ZINC000007116110 568457515 /nfs/dbraw/zinc/45/75/15/568457515.db2.gz POQJPHZVMCSRDH-AWEZNQCLSA-N 0 0 353.422 3.763 20 5 FHBDRN O=C(N[C@H]1C[C@H](c2cccc(F)c2)C1)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000570236968 568465009 /nfs/dbraw/zinc/46/50/09/568465009.db2.gz OJSZXIFSMSBJDX-JCNLHEQBSA-N 0 0 369.396 3.748 20 5 FHBDRN Cc1noc(C)c1C[C@H](C)Nc1ncc([N+](=O)[O-])c(C)c1Br ZINC000570318088 568467791 /nfs/dbraw/zinc/46/77/91/568467791.db2.gz AZTSQAVCCKYJRL-ZETCQYMHSA-N 0 0 369.219 3.709 20 5 FHBDRN CCc1ccc(C(=O)N2CC[C@]3(C2)CCc2ccccc2O3)cc1[N+](=O)[O-] ZINC000570326371 568469827 /nfs/dbraw/zinc/46/98/27/568469827.db2.gz RUVJJBFBZQDRSC-NRFANRHFSA-N 0 0 366.417 3.767 20 5 FHBDRN CCS[C@@H]1CCC[C@H](NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)C1 ZINC000482232278 568471786 /nfs/dbraw/zinc/47/17/86/568471786.db2.gz RAMHBELZZRNTQE-LSDHHAIUSA-N 0 0 363.483 3.963 20 5 FHBDRN CC(=O)N1CCCc2cc(NC(=O)[C@@H](C)c3cccc([N+](=O)[O-])c3)ccc21 ZINC000570385154 568482327 /nfs/dbraw/zinc/48/23/27/568482327.db2.gz LNLHERNCBFDZOF-ZDUSSCGKSA-N 0 0 367.405 3.636 20 5 FHBDRN O=[N+]([O-])c1cc2c(nc1N1Cc3cnn(-c4ccccc4)c3C1)CCCC2 ZINC000570678190 568495212 /nfs/dbraw/zinc/49/52/12/568495212.db2.gz HIFFIPNFJTXGMA-UHFFFAOYSA-N 0 0 361.405 3.575 20 5 FHBDRN C[C@H](Nc1ccc(C(=O)NCC(C)(F)F)cc1[N+](=O)[O-])c1ccccn1 ZINC000570702814 568500496 /nfs/dbraw/zinc/50/04/96/568500496.db2.gz VCBMFXBMBQINOP-NSHDSACASA-N 0 0 364.352 3.548 20 5 FHBDRN COc1cc2c(cc1F)nccc2OCc1ccc([N+](=O)[O-])c(OC)c1 ZINC000570762694 568520462 /nfs/dbraw/zinc/52/04/62/568520462.db2.gz IXYMULRELVCYDP-UHFFFAOYSA-N 0 0 358.325 3.878 20 5 FHBDRN CCCCNC(=O)CSc1nc2cc3ccccc3cc2c(=O)n1CC ZINC000007577823 568533705 /nfs/dbraw/zinc/53/37/05/568533705.db2.gz LUFUGPQATLTOSP-UHFFFAOYSA-N 0 0 369.490 3.578 20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])N1CCCCC[C@@H]1c1ccncc1 ZINC000049764842 568589906 /nfs/dbraw/zinc/58/99/06/568589906.db2.gz BXRNHANEDQFDOK-GOSISDBHSA-N 0 0 368.437 3.936 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(NCCCn2c(C)nc3ccccc32)c1 ZINC000542013296 568720598 /nfs/dbraw/zinc/72/05/98/568720598.db2.gz PCEZLMZMJLISSZ-UHFFFAOYSA-N 0 0 368.393 3.542 20 5 FHBDRN C[C@@H]1C[C@H](c2cccc(F)c2)N(c2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])C1 ZINC000820669219 599060354 /nfs/dbraw/zinc/06/03/54/599060354.db2.gz ZXPMPUPJRUJVGI-BDJLRTHQSA-N 0 0 368.372 3.502 20 5 FHBDRN CC(C)N(C)c1ccc(Nc2ccc([N+](=O)[O-])cc2-c2nn[nH]n2)cc1F ZINC000735859546 598522844 /nfs/dbraw/zinc/52/28/44/598522844.db2.gz WEMTUOAKZXLXKB-UHFFFAOYSA-N 0 0 371.376 3.502 20 5 FHBDRN Cc1ccccc1[C@@H](Nc1ccc([N+](=O)[O-])cc1-c1nn[nH]n1)C(C)C ZINC000737419103 598756499 /nfs/dbraw/zinc/75/64/99/598756499.db2.gz CADFEECKKUMSTR-KRWDZBQOSA-N 0 0 352.398 3.893 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)ccc1Oc1ccc(-c2nn[nH]n2)cc1Cl ZINC000823634788 599317218 /nfs/dbraw/zinc/31/72/18/599317218.db2.gz MCOKSSHJMWAOSL-UHFFFAOYSA-N 0 0 352.137 3.874 20 5 FHBDRN C[NH+](C)Cc1cc(CNc2ccc(/C=C\C(=O)[O-])cc2[N+](=O)[O-])ccc1F ZINC000737367664 600623760 /nfs/dbraw/zinc/62/37/60/600623760.db2.gz BJOJWZMCZWRJPN-YVMONPNESA-N 0 0 373.384 3.505 20 5 FHBDRN O=C([O-])CC1([NH2+]Cc2ccc(Br)c([N+](=O)[O-])c2)CCCCC1 ZINC000833205659 601562433 /nfs/dbraw/zinc/56/24/33/601562433.db2.gz FLFPGWSHAMEJKX-UHFFFAOYSA-N 0 0 371.231 3.625 20 5 FHBDRN Cc1cc(NCc2cccc(C[NH+]3CCCC3)c2)cc(C(=O)[O-])c1[N+](=O)[O-] ZINC000579479174 602313212 /nfs/dbraw/zinc/31/32/12/602313212.db2.gz QSVIYAVLXYXXFV-UHFFFAOYSA-N 0 0 369.421 3.809 20 5 FHBDRN C[C@H](Oc1ccc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1)C(=O)[O-] ZINC000833537007 604535021 /nfs/dbraw/zinc/53/50/21/604535021.db2.gz FWQQDHXDWTWYBC-AWEZNQCLSA-N 0 0 370.405 3.611 20 5 FHBDRN O=C([O-])[C@@H]1CC12CC[NH+](Cc1ccc(-c3ccccc3[N+](=O)[O-])o1)CC2 ZINC000833771551 604650038 /nfs/dbraw/zinc/65/00/38/604650038.db2.gz ISVXSCXTMKUJBE-HNNXBMFYSA-N 0 0 356.378 3.542 20 5 FHBDRN CC(C)([NH2+]Cc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)C(=O)[O-] ZINC000833461215 605235305 /nfs/dbraw/zinc/23/53/05/605235305.db2.gz VMYKDRXONMXQGZ-UHFFFAOYSA-N 0 0 364.785 3.993 20 5 FHBDRN C[C@H](Nc1ccc(/C=C\C(=O)[O-])cc1[N+](=O)[O-])[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000833526990 605863497 /nfs/dbraw/zinc/86/34/97/605863497.db2.gz XJVJCTCVPRVGQX-SLLMGYAOSA-N 0 0 373.453 3.758 20 5 FHBDRN O=[N+]([O-])c1ccc2oc(C(Cl)=Cc3cccc(-c4nn[nH]n4)c3)nc2c1 ZINC000823645986 606339807 /nfs/dbraw/zinc/33/98/07/606339807.db2.gz YZLFQRGSBYCJLG-GHXNOFRVSA-N 0 0 368.740 3.653 20 5 FHBDRN O=[N+]([O-])c1ccc(Cl)c(CNc2ccc(Cl)cc2-c2nn[nH]n2)c1 ZINC000823639850 606801455 /nfs/dbraw/zinc/80/14/55/606801455.db2.gz JBAXRZZOEHVLBO-UHFFFAOYSA-N 0 0 365.180 3.694 20 5 FHBDRN O=[N+]([O-])c1c(-c2nn[nH]n2)ccnc1Oc1ccc2c(c1)[nH]c1ccccc12 ZINC000823629815 607164220 /nfs/dbraw/zinc/16/42/20/607164220.db2.gz IIGNEQGFJGILCQ-UHFFFAOYSA-N 0 0 373.332 3.597 20 5 FHBDRN O=[N+]([O-])c1ccc(C(=Cc2ccccc2-c2nn[nH]n2)c2ccncc2)cc1 ZINC000826498532 607884518 /nfs/dbraw/zinc/88/45/18/607884518.db2.gz ZOXNWPLLRMCPOE-CPNJWEJPSA-N 0 0 370.372 3.759 20 5 FHBDRN O=[N+]([O-])c1cccc2nc(C=Cc3ccc(F)c(-c4nn[nH]n4)c3)ccc21 ZINC000826500351 608878014 /nfs/dbraw/zinc/87/80/14/608878014.db2.gz VKDPBKZHZZKJGC-GQCTYLIASA-N 0 0 362.324 3.633 20 5 FHBDRN Cc1ccc([C@H](C)N[C@H](C)c2ccc(-c3nn[nH]n3)cc2F)cc1[N+](=O)[O-] ZINC000826283221 609342840 /nfs/dbraw/zinc/34/28/40/609342840.db2.gz MZIBYNMEWSTVMP-NWDGAFQWSA-N 0 0 370.388 3.634 20 5 FHBDRN O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1N[C@H]1CCSc2c(F)cccc21 ZINC000826497679 609601440 /nfs/dbraw/zinc/60/14/40/609601440.db2.gz PTEOLMADANYBFD-LBPRGKRZSA-N 0 0 372.385 3.563 20 5 FHBDRN O=C(CCc1nc(C2CCCC2)no1)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000161867998 936313649 /nfs/dbraw/zinc/31/36/49/936313649.db2.gz DMIZLICXOGLTSW-UHFFFAOYSA-N 0 0 370.409 3.547 20 5 FHBDRN Cc1ccccc1-c1nc(COC(=O)c2ccc(C)c([N+](=O)[O-])c2)no1 ZINC000161462037 936314931 /nfs/dbraw/zinc/31/49/31/936314931.db2.gz WNMLSDOLJAAHGQ-UHFFFAOYSA-N 0 0 353.334 3.619 20 5 FHBDRN COc1ccc(OCC(=O)N[C@@H](C)c2ccc(Cl)cc2)c([N+](=O)[O-])c1 ZINC000005051855 936315227 /nfs/dbraw/zinc/31/52/27/936315227.db2.gz GXGIPEUDHYBRFQ-NSHDSACASA-N 0 0 364.785 3.513 20 5 FHBDRN Cc1cccc(OCCN(C)C(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)c1 ZINC000024215598 936325537 /nfs/dbraw/zinc/32/55/37/936325537.db2.gz WXWCAJDIQFWXDM-OAHLLOKOSA-N 0 0 374.462 3.921 20 5 FHBDRN C[C@H](NC(=O)N1CC2(CCCC2)OC(C)(C)C1)c1cccc([N+](=O)[O-])c1 ZINC000187881512 936332522 /nfs/dbraw/zinc/33/25/22/936332522.db2.gz BEXRXYBMGGJDQB-AWEZNQCLSA-N 0 0 361.442 3.789 20 5 FHBDRN O=[N+]([O-])c1cc(F)cc(-c2nc(Cc3ccc4ccccc4n3)no2)c1 ZINC000612893723 936335594 /nfs/dbraw/zinc/33/55/94/936335594.db2.gz LHLVDZLYUZCUCT-UHFFFAOYSA-N 0 0 350.309 3.923 20 5 FHBDRN COc1ccc2c(CC(=O)OCc3cc([N+](=O)[O-])ccc3OC)coc2c1 ZINC000024221721 936337109 /nfs/dbraw/zinc/33/71/09/936337109.db2.gz NVJHFWXEIHCEQC-UHFFFAOYSA-N 0 0 371.345 3.644 20 5 FHBDRN CC(C)(C)NC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000042630854 936342460 /nfs/dbraw/zinc/34/24/60/936342460.db2.gz IMKQNHKKBDYSCS-UHFFFAOYSA-N 0 0 373.375 3.745 20 5 FHBDRN Cc1cccc(NC(=O)c2cc(Br)cc([N+](=O)[O-])c2Cl)n1 ZINC000135917477 936343909 /nfs/dbraw/zinc/34/39/09/936343909.db2.gz CCRRWRSRROUWIB-UHFFFAOYSA-N 0 0 370.590 3.966 20 5 FHBDRN CS(=O)(=O)c1cc([N+](=O)[O-])ccc1NC[C@H](c1ccccc1)C1CC1 ZINC000431512638 936347189 /nfs/dbraw/zinc/34/71/89/936347189.db2.gz PZLWPBHIFSRGMV-MRXNPFEDSA-N 0 0 360.435 3.604 20 5 FHBDRN O=C(CCc1nnc(C2CCCC2)o1)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000162124113 936350889 /nfs/dbraw/zinc/35/08/89/936350889.db2.gz QAWXTWYKNGUXEO-UHFFFAOYSA-N 0 0 370.409 3.547 20 5 FHBDRN CCC[C@@H]([NH2+]Cc1ccc(-n2cncn2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000178742824 936355636 /nfs/dbraw/zinc/35/56/36/936355636.db2.gz HJMLBUYONGTCGK-LJQANCHMSA-N 0 0 351.410 3.807 20 5 FHBDRN CNc1nnc(SCc2ccc([N+](=O)[O-])cc2C(F)(F)F)s1 ZINC000178750714 936381328 /nfs/dbraw/zinc/38/13/28/936381328.db2.gz ZJKGMDDFFPJBOH-UHFFFAOYSA-N 0 0 350.347 3.799 20 5 FHBDRN Cc1cccc(OC[C@@H](C)NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)c1 ZINC000158763126 936382080 /nfs/dbraw/zinc/38/20/80/936382080.db2.gz MGIRFSCNBQDJLD-CQSZACIVSA-N 0 0 367.405 3.511 20 5 FHBDRN C[C@H](Nc1ncnc2cccc([N+](=O)[O-])c21)c1nccn1-c1ccccc1 ZINC000583046614 936389005 /nfs/dbraw/zinc/38/90/05/936389005.db2.gz ZIXYDNQTKGTBQU-ZDUSSCGKSA-N 0 0 360.377 3.897 20 5 FHBDRN CNc1c(C(=O)N(C)[C@H]2CC[C@@H](C(F)(F)F)CC2)cccc1[N+](=O)[O-] ZINC000426520895 945063325 /nfs/dbraw/zinc/06/33/25/945063325.db2.gz GULRTXWZMRQNOG-PHIMTYICSA-N 0 0 359.348 3.830 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]cc(Cc3noc(COc4ccc(F)cc4)n3)c2c1 ZINC000519042116 945063732 /nfs/dbraw/zinc/06/37/32/945063732.db2.gz XMXIYXLGZWIPLF-UHFFFAOYSA-N 0 0 368.324 3.768 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc([C@H](C)N2CCOCC2)cc1 ZINC000110720999 945065249 /nfs/dbraw/zinc/06/52/49/945065249.db2.gz SYRXAHNSVGNYLD-HNNXBMFYSA-N 0 0 369.421 3.549 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CCc2cccc(C)c2C1 ZINC000439885926 945065880 /nfs/dbraw/zinc/06/58/80/945065880.db2.gz DIPJIAYFIMAHCK-UHFFFAOYSA-N 0 0 355.394 3.892 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H]1CCO[C@@H](C(C)(C)C)C1 ZINC000439887330 945066001 /nfs/dbraw/zinc/06/60/01/945066001.db2.gz JOROJHNXEGNRMQ-BLLLJJGKSA-N 0 0 365.430 3.709 20 5 FHBDRN C[C@H](C(=O)NCc1cccnc1OC1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000583061308 937085326 /nfs/dbraw/zinc/08/53/26/937085326.db2.gz DOLUSRNMEQGVOK-AWEZNQCLSA-N 0 0 369.421 3.731 20 5 FHBDRN C[C@@H](C(=O)NCc1cccnc1OC1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000583061309 937085399 /nfs/dbraw/zinc/08/53/99/937085399.db2.gz DOLUSRNMEQGVOK-CQSZACIVSA-N 0 0 369.421 3.731 20 5 FHBDRN CCCc1c(NC(=O)c2ccc([N+](=O)[O-])cn2)cnn1-c1cccc(C)c1 ZINC000583064035 937089290 /nfs/dbraw/zinc/08/92/90/937089290.db2.gz FNHGZHFVKNLTRN-UHFFFAOYSA-N 0 0 365.393 3.689 20 5 FHBDRN C[C@H]1CCCN(c2ccc(C(=O)N(C)c3cccnc3)cc2[N+](=O)[O-])C1 ZINC000511230514 937094094 /nfs/dbraw/zinc/09/40/94/937094094.db2.gz NAHDUFPGDIQRIS-AWEZNQCLSA-N 0 0 354.410 3.503 20 5 FHBDRN Cc1nn(C)c(NCc2ccccc2COCc2ccccc2)c1[N+](=O)[O-] ZINC000052104056 937117758 /nfs/dbraw/zinc/11/77/58/937117758.db2.gz PSXLJMBPXTUZTK-UHFFFAOYSA-N 0 0 366.421 3.966 20 5 FHBDRN Cc1cc(Br)oc1C(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000044490272 927032512 /nfs/dbraw/zinc/03/25/12/927032512.db2.gz CPVGEYGUGQZHGK-UHFFFAOYSA-N 0 0 353.172 3.531 20 5 FHBDRN Cc1nn(Cc2ccc(C(=O)N3CC[C@@H](C)C[C@H]3C)cc2)c(C)c1[N+](=O)[O-] ZINC000120067614 927036793 /nfs/dbraw/zinc/03/67/93/927036793.db2.gz MPHVQULCCOQPIZ-ZIAGYGMSSA-N 0 0 370.453 3.717 20 5 FHBDRN O=[N+]([O-])c1cc2c(ncnc2NCCc2c[nH]c3cc(F)ccc23)s1 ZINC000557533629 927042781 /nfs/dbraw/zinc/04/27/81/927042781.db2.gz GXMWVKZGLDOHHZ-UHFFFAOYSA-N 0 0 357.370 3.875 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(Nc2cccc(-c3nc(C)cs3)c2)n1 ZINC000557568481 927064564 /nfs/dbraw/zinc/06/45/64/927064564.db2.gz CRTGMIZHTXCCGB-UHFFFAOYSA-N 0 0 370.390 3.952 20 5 FHBDRN COc1ccc(C(=O)Nc2cc([N+](=O)[O-])c(F)cc2F)cc1OC(F)F ZINC000120087432 927158773 /nfs/dbraw/zinc/15/87/73/927158773.db2.gz SYLPZAOWPDJKQM-UHFFFAOYSA-N 0 0 374.246 3.735 20 5 FHBDRN O=[N+]([O-])c1cc2c(Cl)ncnc2c(N2CCC[C@H]2c2nccs2)c1 ZINC001167047231 927170962 /nfs/dbraw/zinc/17/09/62/927170962.db2.gz FLNHUTFHAPZYPI-NSHDSACASA-N 0 0 361.814 3.989 20 5 FHBDRN Cc1ccc2c(c1)N(C(=O)c1ccc(N3CCCC3)c([N+](=O)[O-])c1)CC2 ZINC000122066856 937139820 /nfs/dbraw/zinc/13/98/20/937139820.db2.gz YKDFHRTUYALWPG-UHFFFAOYSA-N 0 0 351.406 3.706 20 5 FHBDRN O=[N+]([O-])c1cc(-c2ccc(N3CCC[C@H]3c3nccs3)nn2)ccc1F ZINC001167047281 927173934 /nfs/dbraw/zinc/17/39/34/927173934.db2.gz FUFBLZZMBIODBS-AWEZNQCLSA-N 0 0 371.397 3.989 20 5 FHBDRN CC(C)(C)c1cc(NC(=O)c2cccc([N+](=O)[O-])c2N)n(C(C)(C)C)n1 ZINC000176404613 937140845 /nfs/dbraw/zinc/14/08/45/937140845.db2.gz FJUFJJWDDULSGI-UHFFFAOYSA-N 0 0 359.430 3.678 20 5 FHBDRN CN(C[C@H]1CCCC[C@H]1O)C(=O)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000278088526 937142126 /nfs/dbraw/zinc/14/21/26/937142126.db2.gz PXMYZIRQRHOFOD-AUUYWEPGSA-N 0 0 364.445 3.717 20 5 FHBDRN COc1ccc(C(=O)Nc2cc([N+](=O)[O-])ccc2F)c(Br)c1 ZINC000133642213 927210724 /nfs/dbraw/zinc/21/07/24/927210724.db2.gz IZBQLRZRCFQTPN-UHFFFAOYSA-N 0 0 369.146 3.757 20 5 FHBDRN COc1cc(C(=O)N(C)[C@H](C)Cc2ccc(C)cc2)cc([N+](=O)[O-])c1OC ZINC000610175623 927213074 /nfs/dbraw/zinc/21/30/74/927213074.db2.gz OWWRIRQWJHOTTC-CQSZACIVSA-N 0 0 372.421 3.624 20 5 FHBDRN CCc1ccc(OC[C@H](O)COCc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000579727108 927220392 /nfs/dbraw/zinc/22/03/92/927220392.db2.gz NQJYMXZOAYRDPF-OAHLLOKOSA-N 0 0 365.813 3.767 20 5 FHBDRN CC[C@H](NC(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])c1ccncc1 ZINC000610176868 927236420 /nfs/dbraw/zinc/23/64/20/927236420.db2.gz MOZJJMQUNYEQMX-FZMZJTMJSA-N 0 0 363.801 3.678 20 5 FHBDRN Cn1cncc1CCCSc1ccc(Br)cc1[N+](=O)[O-] ZINC000579734995 927242474 /nfs/dbraw/zinc/24/24/74/927242474.db2.gz QXMZXVJMTLRBHE-UHFFFAOYSA-N 0 0 356.245 3.816 20 5 FHBDRN Cc1c(C(=O)NCc2ccccc2OC(F)(F)F)cccc1[N+](=O)[O-] ZINC000247985545 937146470 /nfs/dbraw/zinc/14/64/70/937146470.db2.gz JIJDVLWDFDVAHM-UHFFFAOYSA-N 0 0 354.284 3.732 20 5 FHBDRN Cc1nn(CCC(=O)N2C[C@H](C)CC[C@@H]2c2ccccc2)c(C)c1[N+](=O)[O-] ZINC000557638914 927266371 /nfs/dbraw/zinc/26/63/71/927266371.db2.gz PERUOVSWIFFMDF-RDTXWAMCSA-N 0 0 370.453 3.798 20 5 FHBDRN CCc1cc2c(CSc3ccc([N+](=O)[O-])cn3)cc(=O)oc2cc1O ZINC000160207485 927285252 /nfs/dbraw/zinc/28/52/52/927285252.db2.gz XSNQNKOBTHWCTB-UHFFFAOYSA-N 0 0 358.375 3.657 20 5 FHBDRN COc1ccccc1C1(CNC(=O)c2ccc([N+](=O)[O-])s2)CCCC1 ZINC000064786988 927318651 /nfs/dbraw/zinc/31/86/51/927318651.db2.gz XTLKOVYXXSTVPL-UHFFFAOYSA-N 0 0 360.435 3.907 20 5 FHBDRN CC1CCC(N(C(=O)COc2ccc([N+](=O)[O-])cc2F)C2CC2)CC1 ZINC000097336328 927329268 /nfs/dbraw/zinc/32/92/68/927329268.db2.gz SYWPTJACVXBMCO-UHFFFAOYSA-N 0 0 350.390 3.682 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NCc1ccc(Br)cc1 ZINC001125277316 927333240 /nfs/dbraw/zinc/33/32/40/927333240.db2.gz FOYUQEPFFVUYNX-UHFFFAOYSA-N 0 0 363.211 3.904 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])c(Cl)c1)N1CCO[C@@H](CCc2ccccc2)C1 ZINC000120124382 927335486 /nfs/dbraw/zinc/33/54/86/927335486.db2.gz RDXZRUMYXUSVFG-INIZCTEOSA-N 0 0 374.824 3.722 20 5 FHBDRN Cc1ccc(NC(=O)[C@@H](C)N(C)CCc2cccc([N+](=O)[O-])c2)cc1C ZINC000583131498 937153139 /nfs/dbraw/zinc/15/31/39/937153139.db2.gz NPXWUJAWQNUQIM-MRXNPFEDSA-N 0 0 355.438 3.713 20 5 FHBDRN O=[N+]([O-])c1ccc(OC[C@H](O)COCc2ccc(Cl)cc2)c(Cl)c1 ZINC000579767309 927350193 /nfs/dbraw/zinc/35/01/93/927350193.db2.gz IBERVGIMQOZGKB-CQSZACIVSA-N 0 0 372.204 3.858 20 5 FHBDRN O=C(Nc1ccc(-n2ccnc2)c(F)c1)c1cccc(Cl)c1[N+](=O)[O-] ZINC000175713681 927359713 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CCOc1ccc(C(=O)N[C@@H](C)CC(=O)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000127036154 928422728 /nfs/dbraw/zinc/42/27/28/928422728.db2.gz SOXDOGLJQDASPV-LBPRGKRZSA-N 0 0 374.368 3.524 20 5 FHBDRN COC[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1)C1CC1 ZINC000178828941 937251032 /nfs/dbraw/zinc/25/10/32/937251032.db2.gz PFRUHNICDJZLSU-QGZVFWFLSA-N 0 0 372.446 3.901 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1CN(C)[C@@H](C)c1ccc([S@@](C)=O)cc1 ZINC000430244342 928461357 /nfs/dbraw/zinc/46/13/57/928461357.db2.gz PCZVCZCFKBJECQ-ZJWNCGCPSA-N 0 0 362.451 3.534 20 5 FHBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)OCC[C@H]1CCCCO1 ZINC000784942404 928463296 /nfs/dbraw/zinc/46/32/96/928463296.db2.gz OMXKTIQLRLMQHT-WCQYABFASA-N 0 0 357.790 3.518 20 5 FHBDRN COc1ccccc1C/C(C)=C\C(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000254953975 928481825 /nfs/dbraw/zinc/48/18/25/928481825.db2.gz RGIJMBCATAFQSN-BENRWUELSA-N 0 0 366.377 3.607 20 5 FHBDRN CN(c1ccccc1)c1ccc(CN2CCOCC23CC3)cc1[N+](=O)[O-] ZINC000583218874 937249552 /nfs/dbraw/zinc/24/95/52/937249552.db2.gz LNXLFFSUSBVOEY-UHFFFAOYSA-N 0 0 353.422 3.728 20 5 FHBDRN O=[N+]([O-])c1ccc(OCc2cn(-c3ccccc3)nn2)c(C(F)(F)F)c1 ZINC000608846281 928482540 /nfs/dbraw/zinc/48/25/40/928482540.db2.gz GKMJVXSCJIXLCV-UHFFFAOYSA-N 0 0 364.283 3.773 20 5 FHBDRN Cc1ccc(NC(=O)NC[C@H](C[C@@H](C)O)c2ccccc2)cc1[N+](=O)[O-] ZINC000127065500 928501567 /nfs/dbraw/zinc/50/15/67/928501567.db2.gz BTIVKJQHWXSHLM-ZBFHGGJFSA-N 0 0 357.410 3.579 20 5 FHBDRN O=C(Nc1ccc([C@@H]2CCOC2)cc1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000583223356 937254324 /nfs/dbraw/zinc/25/43/24/937254324.db2.gz BDSLPQAGTRNUFT-OAHLLOKOSA-N 0 0 367.405 3.925 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N2CCN(CC3CC3)c3ccccc32)c1 ZINC000467126105 937254874 /nfs/dbraw/zinc/25/48/74/937254874.db2.gz PDAAHLGJTQNOFN-UHFFFAOYSA-N 0 0 351.406 3.780 20 5 FHBDRN COC(=O)c1cc(C(=O)N(Cc2cccc(F)c2)C(C)C)cc([N+](=O)[O-])c1 ZINC000510120714 928596577 /nfs/dbraw/zinc/59/65/77/928596577.db2.gz NPXXSQGAWSOHHU-UHFFFAOYSA-N 0 0 374.368 3.571 20 5 FHBDRN COc1cc(C(=O)N[C@H](C)CSc2ccc(C)cc2)ccc1[N+](=O)[O-] ZINC000472283405 937260012 /nfs/dbraw/zinc/26/00/12/937260012.db2.gz IWCHEOTXDFXMBH-CYBMUJFWSA-N 0 0 360.435 3.822 20 5 FHBDRN Cc1ncc([N+](=O)[O-])n1CC(=O)N[C@H](c1ccccc1)C1CCCCC1 ZINC000120487690 928628521 /nfs/dbraw/zinc/62/85/21/928628521.db2.gz RSKWQWJJPZRLOP-LJQANCHMSA-N 0 0 356.426 3.538 20 5 FHBDRN COc1ccccc1/C(C)=C\C(=O)OCc1ncc(C)c([N+](=O)[O-])c1C ZINC000588570434 937265066 /nfs/dbraw/zinc/26/50/66/937265066.db2.gz XNTLKNUIWQEENA-XFXZXTDPSA-N 0 0 356.378 3.762 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])Nc1ccc(OC2CCCC2)nc1 ZINC000608872784 928700809 /nfs/dbraw/zinc/70/08/09/928700809.db2.gz JUQLRLBBHYUPCI-UHFFFAOYSA-N 0 0 371.393 3.719 20 5 FHBDRN CCOC[C@H]1CCCCN1C(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000458445355 937273268 /nfs/dbraw/zinc/27/32/68/937273268.db2.gz YPVZAHHXLOFDFA-GOSISDBHSA-N 0 0 363.458 3.518 20 5 FHBDRN C[C@@H]1C[C@@H]1c1ccc(CNC(=O)N(C)CCc2ccccc2[N+](=O)[O-])o1 ZINC000578215740 928788772 /nfs/dbraw/zinc/78/87/72/928788772.db2.gz IJLVWQANAXAHGW-CJNGLKHVSA-N 0 0 357.410 3.695 20 5 FHBDRN O=[N+]([O-])c1cc2nc(Cl)ccc2cc1N1CCO[C@H](C(F)(F)F)C1 ZINC001167084566 928809032 /nfs/dbraw/zinc/80/90/32/928809032.db2.gz PCSRDPMCKNQGTK-LBPRGKRZSA-N 0 0 361.707 3.564 20 5 FHBDRN CC1(C)[C@@H]2OCC[C@H]2[C@@H]1OC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000157736599 928819322 /nfs/dbraw/zinc/81/93/22/928819322.db2.gz JXNZGMIRPCWWAF-UPJWGTAASA-N 0 0 359.300 3.584 20 5 FHBDRN COc1ccc(C(=O)N2CCC[C@@](C)(c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000499908638 928832373 /nfs/dbraw/zinc/83/23/73/928832373.db2.gz TWZCMWAFNFCNCF-HXUWFJFHSA-N 0 0 354.406 3.797 20 5 FHBDRN O=[N+]([O-])c1cccc(/C=C/c2nc(-c3ccc(OCC(F)F)nc3)no2)c1 ZINC000545125860 937282783 /nfs/dbraw/zinc/28/27/83/937282783.db2.gz WCSITYAKUQXCDG-GQCTYLIASA-N 0 0 374.303 3.854 20 5 FHBDRN COCCCOc1ccccc1NC(=O)c1cccc(Cl)c1[N+](=O)[O-] ZINC000175765982 928869481 /nfs/dbraw/zinc/86/94/81/928869481.db2.gz XYJNQEUMIIXWAD-UHFFFAOYSA-N 0 0 364.785 3.916 20 5 FHBDRN CCCN(CCC)C(=O)CCCc1nc(-c2ccc([N+](=O)[O-])s2)no1 ZINC000278161693 937283541 /nfs/dbraw/zinc/28/35/41/937283541.db2.gz MXJLWGBZVXYDDQ-UHFFFAOYSA-N 0 0 366.443 3.678 20 5 FHBDRN O=[N+]([O-])c1ccc2nc(Cl)cc(N3CCO[C@@H](C(F)(F)F)C3)c2c1 ZINC001167085727 928890073 /nfs/dbraw/zinc/89/00/73/928890073.db2.gz ZPTMZBLOWHFTKQ-GFCCVEGCSA-N 0 0 361.707 3.564 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)Nc2nc3c(ccc(F)c3C)s2)c1 ZINC000164877180 928902122 /nfs/dbraw/zinc/90/21/22/928902122.db2.gz BWDZBKHDWHEPRF-UHFFFAOYSA-N 0 0 361.354 3.913 20 5 FHBDRN Cc1c(NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)cccc1-c1ncco1 ZINC000583254708 937284726 /nfs/dbraw/zinc/28/47/26/937284726.db2.gz KRWQCTWPBQGXMD-UHFFFAOYSA-N 0 0 363.333 3.687 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])Nc1ccc(OC2CCCC2)nc1 ZINC000608892640 928904583 /nfs/dbraw/zinc/90/45/83/928904583.db2.gz CABZSWMRHHOMBV-UHFFFAOYSA-N 0 0 356.382 3.633 20 5 FHBDRN O=C(N[C@H]1Cc2cccc(O)c2C1)c1cc2ccccc2c2cccnc12 ZINC000430265667 928924150 /nfs/dbraw/zinc/92/41/50/928924150.db2.gz ZUURXWIESSGYEH-INIZCTEOSA-N 0 0 354.409 3.991 20 5 FHBDRN COC(=O)C[C@@H](C)Nc1ccc(C(=O)Nc2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000608972578 928926950 /nfs/dbraw/zinc/92/69/50/928926950.db2.gz XHRUEEYGBTXLHO-CYBMUJFWSA-N 0 0 371.393 3.519 20 5 FHBDRN Cc1ccc(NC(=O)c2cccc(NC(=O)[C@H]3C[C@@H]3C)c2)cc1[N+](=O)[O-] ZINC000032644196 928955231 /nfs/dbraw/zinc/95/52/31/928955231.db2.gz JWYLLRMZDNRWKL-LRDDRELGSA-N 0 0 353.378 3.750 20 5 FHBDRN C[C@H](NC(=O)c1cc(-c2ccc(F)cc2)on1)c1cccc([N+](=O)[O-])c1 ZINC000134500212 928958418 /nfs/dbraw/zinc/95/84/18/928958418.db2.gz CECKPJACABRRJC-NSHDSACASA-N 0 0 355.325 3.880 20 5 FHBDRN O=C(NCc1ccc(OCc2ccccc2)cc1)c1ccc([N+](=O)[O-])o1 ZINC000044442476 937290136 /nfs/dbraw/zinc/29/01/36/937290136.db2.gz BZJLBTXUOOHLSJ-UHFFFAOYSA-N 0 0 352.346 3.697 20 5 FHBDRN Cc1cc(C(=O)Nc2cccc([N+](=O)[O-])c2)c(C)n1Cc1ccccn1 ZINC000032643970 928963952 /nfs/dbraw/zinc/96/39/52/928963952.db2.gz LNEHPEOENYGILF-UHFFFAOYSA-N 0 0 350.378 3.709 20 5 FHBDRN CN(C(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1ccccn1 ZINC000134522644 928974881 /nfs/dbraw/zinc/97/48/81/928974881.db2.gz AOBPWMYAKOGZNC-UHFFFAOYSA-N 0 0 371.340 3.764 20 5 FHBDRN Cc1cc(N2CCC[C@@H](c3nncn3C3CC3)C2)c(Cl)cc1[N+](=O)[O-] ZINC000091627618 937291396 /nfs/dbraw/zinc/29/13/96/937291396.db2.gz ZFACUKPMNAODED-GFCCVEGCSA-N 0 0 361.833 3.867 20 5 FHBDRN Cc1cccc(CN(C)[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)n1 ZINC000471204654 929022766 /nfs/dbraw/zinc/02/27/66/929022766.db2.gz ZVWOFHFIACAZIP-CYBMUJFWSA-N 0 0 353.382 3.541 20 5 FHBDRN COC(=O)C[C@H](C)Sc1cc(C(F)(F)C(F)(F)F)ncc1[N+](=O)[O-] ZINC000278170481 937296072 /nfs/dbraw/zinc/29/60/72/937296072.db2.gz AYTYVPFUADSGPO-LURJTMIESA-N 0 0 374.287 3.688 20 5 FHBDRN C[C@H](SCc1ccccc1)C(=O)NCc1cc([N+](=O)[O-])c(F)cc1F ZINC001143376410 929041753 /nfs/dbraw/zinc/04/17/53/929041753.db2.gz CVCGYCMHJFSNPH-NSHDSACASA-N 0 0 366.389 3.811 20 5 FHBDRN CC[C@H](Cc1ccc(C)cc1)N(C)C(=O)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000610237593 929069861 /nfs/dbraw/zinc/06/98/61/929069861.db2.gz GUQUWPJYZYSAQX-GOSISDBHSA-N 0 0 370.449 3.934 20 5 FHBDRN O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1CCC([C@H](O)c2ccccc2)CC1 ZINC000134578840 929070896 /nfs/dbraw/zinc/07/08/96/929070896.db2.gz ABBPAJFIUGUEBY-GOSISDBHSA-N 0 0 374.824 3.834 20 5 FHBDRN O=[N+]([O-])c1ccc(NCCc2cn3c(n2)CCCC3)nc1-c1ccccc1 ZINC000134595449 929093367 /nfs/dbraw/zinc/09/33/67/929093367.db2.gz ASXANYBIZUXWMI-UHFFFAOYSA-N 0 0 363.421 3.844 20 5 FHBDRN C[C@@H]1c2ccccc2OCCN1C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000598575956 929113497 /nfs/dbraw/zinc/11/34/97/929113497.db2.gz XZNDVCJSUDMFHN-JEBQAFNWSA-N 0 0 352.390 3.681 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(-c3ncc[nH]3)cc2)c1 ZINC000583275692 937304047 /nfs/dbraw/zinc/30/40/47/937304047.db2.gz RSUFPNROSLBVIM-UHFFFAOYSA-N 0 0 352.350 3.636 20 5 FHBDRN CCS[C@H]1CCCCN(C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)C1 ZINC000134671983 929125815 /nfs/dbraw/zinc/12/58/15/929125815.db2.gz QQVPCCNCWVWCDN-AWEZNQCLSA-N 0 0 374.466 3.528 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H]2CCN(c3ccc(Cl)cc3)C2)c1 ZINC000610238846 929143070 /nfs/dbraw/zinc/14/30/70/929143070.db2.gz RFUYNJYYYMLICX-AWEZNQCLSA-N 0 0 373.840 3.813 20 5 FHBDRN C[C@H](NC(=O)[C@H]1C[C@H]1c1cccc([N+](=O)[O-])c1)c1cnn(CC2CCC2)c1 ZINC000890667540 929143330 /nfs/dbraw/zinc/14/33/30/929143330.db2.gz RYNYHMGDCOSIKR-AGRHKRQWSA-N 0 0 368.437 3.572 20 5 FHBDRN C[C@H](NC(=O)[C@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1)c1cnn(CC2CCC2)c1 ZINC000890667541 929144566 /nfs/dbraw/zinc/14/45/66/929144566.db2.gz RYNYHMGDCOSIKR-BKTGTZMESA-N 0 0 368.437 3.572 20 5 FHBDRN CSc1cccc(C(=O)N[C@H](C)c2cnn(CC3CCC3)c2)c1[N+](=O)[O-] ZINC000890672768 929209179 /nfs/dbraw/zinc/20/91/79/929209179.db2.gz ZZDQZIUYPCYSTD-GFCCVEGCSA-N 0 0 374.466 3.804 20 5 FHBDRN C[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1cnn(CC2CCC2)c1 ZINC000890675977 929228404 /nfs/dbraw/zinc/22/84/04/929228404.db2.gz AMBCEZWZGUEOKZ-LLVKDONJSA-N 0 0 362.817 3.736 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)c2cnn(CC3CCC3)c2)c1 ZINC000890676934 929230049 /nfs/dbraw/zinc/23/00/49/929230049.db2.gz JMMGQPGFIXKAOA-GFCCVEGCSA-N 0 0 374.466 3.804 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCC[C@H](c3nc(-c4ccc(F)cc4)no3)C2)cn1 ZINC000583286962 937316173 /nfs/dbraw/zinc/31/61/73/937316173.db2.gz MBKHOQUMRKTDOP-ZDUSSCGKSA-N 0 0 369.356 3.563 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1CN1CCCN(C(=O)CC2CCCC2)CC1 ZINC000569626794 937318979 /nfs/dbraw/zinc/31/89/79/937318979.db2.gz UYABIVKQFQTIJH-UHFFFAOYSA-N 0 0 359.470 3.518 20 5 FHBDRN CNC(=O)c1ccc(Cl)c(NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)c1 ZINC000510152238 929300767 /nfs/dbraw/zinc/30/07/67/929300767.db2.gz NABLDIQESWBHKY-UHFFFAOYSA-N 0 0 373.752 3.606 20 5 FHBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])N(CC1CC1)CC1CC1 ZINC000609724864 929347352 /nfs/dbraw/zinc/34/73/52/929347352.db2.gz SCKCVSFHCRFZJV-UHFFFAOYSA-N 0 0 352.818 3.666 20 5 FHBDRN COc1ccc(CNC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)cc1F ZINC000178852016 937323447 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ZINC000047864516 930559733 /nfs/dbraw/zinc/55/97/33/930559733.db2.gz CFJZIBGTVNGSBB-UHFFFAOYSA-N 0 0 357.338 3.922 20 5 FHBDRN CCc1ccc(C(=O)N[C@H](Cn2cccn2)c2ccccc2)cc1[N+](=O)[O-] ZINC000610434475 930566971 /nfs/dbraw/zinc/56/69/71/930566971.db2.gz GUXUACTXPUILCA-GOSISDBHSA-N 0 0 364.405 3.525 20 5 FHBDRN CCCc1ccc([C@@H](NC(=O)c2c[nH]nc2[N+](=O)[O-])c2cccs2)cc1 ZINC000548084568 930567420 /nfs/dbraw/zinc/56/74/20/930567420.db2.gz UDWWLAKXLXBBBX-MRXNPFEDSA-N 0 0 370.434 3.851 20 5 FHBDRN Cc1nc(-c2cccc(C(=O)N(C)c3ccc([N+](=O)[O-])nc3)c2)cs1 ZINC000580358853 930569070 /nfs/dbraw/zinc/56/90/70/930569070.db2.gz ODHYQHAQURKKDG-UHFFFAOYSA-N 0 0 354.391 3.698 20 5 FHBDRN CO[C@H](c1ccc(F)cc1)[C@@H](C)NC(=O)c1cc([N+](=O)[O-])c(F)cc1C ZINC001266606643 930588200 /nfs/dbraw/zinc/58/82/00/930588200.db2.gz YXBZMTXKDDFMMV-DIFFPNOSSA-N 0 0 364.348 3.687 20 5 FHBDRN CO[C@@H](c1ccc(F)cc1)[C@H](C)NC(=O)c1cc([N+](=O)[O-])c(F)cc1C ZINC001266606642 930588498 /nfs/dbraw/zinc/58/84/98/930588498.db2.gz YXBZMTXKDDFMMV-APPDUMDISA-N 0 0 364.348 3.687 20 5 FHBDRN Cc1cc(OCC(=O)N[C@H](C)c2ccccc2OC(C)C)ccc1[N+](=O)[O-] ZINC000583418034 937426416 /nfs/dbraw/zinc/42/64/16/937426416.db2.gz LPNJKDZNHKRACF-OAHLLOKOSA-N 0 0 372.421 3.947 20 5 FHBDRN C[C@H]1c2ccccc2CN1c1ccc([N+](=O)[O-])c(N2CCOCC2)c1F ZINC000579612951 930616494 /nfs/dbraw/zinc/61/64/94/930616494.db2.gz BTTGGIJPIOJJQF-ZDUSSCGKSA-N 0 0 357.385 3.652 20 5 FHBDRN O=C(CCOc1ccccc1F)N1CCCCc2ccc([N+](=O)[O-])cc21 ZINC001167393514 930628572 /nfs/dbraw/zinc/62/85/72/930628572.db2.gz UZCYAGVAIKFAIP-UHFFFAOYSA-N 0 0 358.369 3.872 20 5 FHBDRN CCO[C@@H]1C[C@@H](N(C)C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)C12CCC2 ZINC000119103497 930677002 /nfs/dbraw/zinc/67/70/02/930677002.db2.gz SPJYYWPYSVVYGE-IAOVAPTHSA-N 0 0 361.442 3.645 20 5 FHBDRN CCO[C@@H]1C[C@H](N(C)C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)C12CCC2 ZINC000119103275 930677009 /nfs/dbraw/zinc/67/70/09/930677009.db2.gz SPJYYWPYSVVYGE-RRQGHBQHSA-N 0 0 361.442 3.645 20 5 FHBDRN Cc1ccc(CNC(=O)c2cc([N+](=O)[O-])ccc2Br)s1 ZINC000050226535 930678567 /nfs/dbraw/zinc/67/85/67/930678567.db2.gz MHNBDICKEHWTHI-UHFFFAOYSA-N 0 0 355.213 3.657 20 5 FHBDRN COc1ccc(SCCC(=O)Nc2cccc([N+](=O)[O-])c2)cc1OC ZINC000610121534 930706406 /nfs/dbraw/zinc/70/64/06/930706406.db2.gz JLOTYMDVJZJTDH-UHFFFAOYSA-N 0 0 362.407 3.733 20 5 FHBDRN CC(C)(C(=O)N1CC[C@](F)(c2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000580474443 930722214 /nfs/dbraw/zinc/72/22/14/930722214.db2.gz DBBPYZYFNWJGST-HXUWFJFHSA-N 0 0 356.397 3.970 20 5 FHBDRN Nc1ccc(-c2nc(-c3cc(Br)cs3)no2)cc1[N+](=O)[O-] ZINC000071302799 930729799 /nfs/dbraw/zinc/72/97/99/930729799.db2.gz FYNLQVCPAUVPNV-UHFFFAOYSA-N 0 0 367.184 3.718 20 5 FHBDRN CCN(c1ccc2[nH]ccc2c1)S(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1 ZINC000471589638 930818829 /nfs/dbraw/zinc/81/88/29/930818829.db2.gz RJDLFVMRJYUYHN-UHFFFAOYSA-N 0 0 359.407 3.600 20 5 FHBDRN CC[C@H]1c2ccccc2CCN1CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC001167417097 930821572 /nfs/dbraw/zinc/82/15/72/930821572.db2.gz PSVMODGREIAJBY-IBGZPJMESA-N 0 0 353.422 3.851 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])N[C@@H]1CC[C@@H](c2ccc(F)cc2)C1 ZINC000471590572 930826438 /nfs/dbraw/zinc/82/64/38/930826438.db2.gz NMZOIOPIGMWDTM-RHSMWYFYSA-N 0 0 357.385 3.869 20 5 FHBDRN O=C(N[C@@H]1[C@H]2CCO[C@H]2C12CCC2)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000275908949 930827996 /nfs/dbraw/zinc/82/79/96/930827996.db2.gz DGXKIDCFSGMEKW-IPHXSNPTSA-N 0 0 374.440 3.781 20 5 FHBDRN O=C(CCC(=O)N1CCc2cccc(Cl)c2C1)c1cccc([N+](=O)[O-])c1 ZINC000458023667 930853701 /nfs/dbraw/zinc/85/37/01/930853701.db2.gz WSRZNAVWCKIIRB-UHFFFAOYSA-N 0 0 372.808 3.796 20 5 FHBDRN CC[C@H](C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)c1ccc(OC)cc1 ZINC000537187554 930860187 /nfs/dbraw/zinc/86/01/87/930860187.db2.gz NDJCCHUXUNZZEA-IBGZPJMESA-N 0 0 354.406 3.682 20 5 FHBDRN Cc1cc2c(cc1[N+](=O)[O-])N(C(=O)c1ccc(F)c3cccnc13)CC2 ZINC001266623279 930871532 /nfs/dbraw/zinc/87/15/32/930871532.db2.gz KWQWFOGHBVPCLM-UHFFFAOYSA-N 0 0 351.337 3.793 20 5 FHBDRN 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ZINC000050354721 930932201 /nfs/dbraw/zinc/93/22/01/930932201.db2.gz DCQKIRZUIMMWGI-UHFFFAOYSA-N 0 0 374.447 3.755 20 5 FHBDRN CCc1cc(C2CC2)nc(NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)n1 ZINC000580626138 930938898 /nfs/dbraw/zinc/93/88/98/930938898.db2.gz MTAHZQSXALOJPN-UHFFFAOYSA-N 0 0 372.400 3.880 20 5 FHBDRN O=c1c2cc([N+](=O)[O-])ccc2nc2n1CC/C2=C/c1cc(F)cc(F)c1 ZINC000255668586 930967371 /nfs/dbraw/zinc/96/73/71/930967371.db2.gz BKIWITHYNYVERH-WZUFQYTHSA-N 0 0 355.300 3.527 20 5 FHBDRN CC[C@@H](CC(=O)NCCc1ccc([N+](=O)[O-])cc1)c1ccc(OC)cc1 ZINC000160587948 930973698 /nfs/dbraw/zinc/97/36/98/930973698.db2.gz OVLZPMUDAOABKE-INIZCTEOSA-N 0 0 356.422 3.846 20 5 FHBDRN Cc1cc(C(=O)N(Cc2cccc(F)c2)C[C@H]2CCCO2)ccc1[N+](=O)[O-] ZINC000050380235 930977878 /nfs/dbraw/zinc/97/78/78/930977878.db2.gz YZHZPZSWBYJUKA-GOSISDBHSA-N 0 0 372.396 3.864 20 5 FHBDRN Cc1ccc(C(=O)N(Cc2cccc(F)c2)C[C@@H]2CCCO2)cc1[N+](=O)[O-] ZINC000050380164 930978034 /nfs/dbraw/zinc/97/80/34/930978034.db2.gz OZEOPALGTDCZFM-SFHVURJKSA-N 0 0 372.396 3.864 20 5 FHBDRN Cc1ccc(C(=O)N(Cc2cccc(F)c2)C[C@H]2CCCO2)cc1[N+](=O)[O-] ZINC000050380165 930978369 /nfs/dbraw/zinc/97/83/69/930978369.db2.gz OZEOPALGTDCZFM-GOSISDBHSA-N 0 0 372.396 3.864 20 5 FHBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)NCC1(CCO)CCC1 ZINC000537485649 931000691 /nfs/dbraw/zinc/00/06/91/931000691.db2.gz WONNDQXJCBKKOB-UHFFFAOYSA-N 0 0 366.483 3.770 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N[C@H]1CCN(c2cccc(Cl)c2)C1 ZINC000119284067 931035124 /nfs/dbraw/zinc/03/51/24/931035124.db2.gz QCRBEXQKFAAKCB-INIZCTEOSA-N 0 0 373.840 3.576 20 5 FHBDRN O=C(C[C@H]1CCOc2ccccc21)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000537591695 931046365 /nfs/dbraw/zinc/04/63/65/931046365.db2.gz RWUOTUVYGXRPDO-CQSZACIVSA-N 0 0 374.824 3.863 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)N1CCC[C@@H]1c1ccc(O)cc1 ZINC000610456103 931070489 /nfs/dbraw/zinc/07/04/89/931070489.db2.gz LMKULYWJYSVVPL-LJQANCHMSA-N 0 0 369.421 3.856 20 5 FHBDRN O=C(Nc1cc([N+](=O)[O-])ccc1F)c1cnn(Cc2ccccc2Cl)c1 ZINC000247289281 931081194 /nfs/dbraw/zinc/08/11/94/931081194.db2.gz AJNKKTLORYSXIF-UHFFFAOYSA-N 0 0 374.759 3.884 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H](COC)c1ccc(F)cc1 ZINC000580744307 931091584 /nfs/dbraw/zinc/09/15/84/931091584.db2.gz LEOGQVVZYGTHBQ-QGZVFWFLSA-N 0 0 361.373 3.806 20 5 FHBDRN O=C(O[C@@H](c1cccnc1)c1ccccc1[N+](=O)[O-])c1ccc2cccnn21 ZINC001266648855 931118248 /nfs/dbraw/zinc/11/82/48/931118248.db2.gz ALCXUJJLVQOUEN-IBGZPJMESA-N 0 0 374.356 3.584 20 5 FHBDRN COc1c(C(=O)NCc2ccc(OC3CCCC3)cc2)cccc1[N+](=O)[O-] ZINC000580765014 931127102 /nfs/dbraw/zinc/12/71/02/931127102.db2.gz DIJQJQIKHTWZPP-UHFFFAOYSA-N 0 0 370.405 3.855 20 5 FHBDRN C[C@H](C(=O)N1CC(C)(C)O[C@@](C)(C(F)(F)F)C1)c1cccc([N+](=O)[O-])c1 ZINC000580793009 931151066 /nfs/dbraw/zinc/15/10/66/931151066.db2.gz RAMDORZAVNZLPT-MEDUHNTESA-N 0 0 374.359 3.657 20 5 FHBDRN COc1cc(F)c(NC(=O)C(C)(C)c2ccccc2[N+](=O)[O-])cc1F ZINC000580788656 931153834 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O=C(c1ccc([N+](=O)[O-])c(Cl)c1)N1CCCC[C@H]([C@H]2CCOC2)C1 ZINC000891338215 931304727 /nfs/dbraw/zinc/30/47/27/931304727.db2.gz YJEQGXZHEIFLMA-KBPBESRZSA-N 0 0 352.818 3.527 20 5 FHBDRN C[C@@H](NC(=O)N[C@@H](C)c1ccccc1[N+](=O)[O-])c1ccc2n[nH]cc2c1 ZINC000580897970 931313920 /nfs/dbraw/zinc/31/39/20/931313920.db2.gz DUYZULCRFAWQFV-NEPJUHHUSA-N 0 0 353.382 3.593 20 5 FHBDRN CCc1ccccc1OCCC(=O)NCc1cc([N+](=O)[O-])c(F)cc1F ZINC001143382980 931328672 /nfs/dbraw/zinc/32/86/72/931328672.db2.gz LPJQCRPBOXQGKX-UHFFFAOYSA-N 0 0 364.348 3.521 20 5 FHBDRN O=[N+]([O-])c1cc2c(ncnc2N[C@@H]2CCCN(c3ccccc3)C2)s1 ZINC000561233261 931329214 /nfs/dbraw/zinc/32/92/14/931329214.db2.gz KSLRFNFYUZBOPM-GFCCVEGCSA-N 0 0 355.423 3.680 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1Cl)N1CCCC[C@H]([C@H]2CCOC2)C1 ZINC000891343397 931355062 /nfs/dbraw/zinc/35/50/62/931355062.db2.gz WBZLZTCWWWSKNW-STQMWFEESA-N 0 0 352.818 3.527 20 5 FHBDRN COc1cccc(C[C@@H]2CCCN2C(=O)[C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000580926726 931358584 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FHBDRN CC(C)CCSc1ccc(C(=O)N(C)CC[C@@H](C)O)cc1[N+](=O)[O-] ZINC000126131657 931419950 /nfs/dbraw/zinc/41/99/50/931419950.db2.gz XQUCXCVBFBWJBE-CYBMUJFWSA-N 0 0 354.472 3.576 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)c2nc(C(C)C)ncc2Cl)cc1[N+](=O)[O-] ZINC000177874505 931430002 /nfs/dbraw/zinc/43/00/02/931430002.db2.gz VWDMIVVQRWPTGC-LLVKDONJSA-N 0 0 362.817 3.961 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)c2ccn(-c3cccc(F)c3)n2)cc1[N+](=O)[O-] ZINC000177875085 931432171 /nfs/dbraw/zinc/43/21/71/931432171.db2.gz ZUKAVJLXELCVRO-ZDUSSCGKSA-N 0 0 368.368 3.719 20 5 FHBDRN CC(C)[C@@H]1N(c2ccc(Br)cc2[N+](=O)[O-])CC12CCOCC2 ZINC000580998970 931458855 /nfs/dbraw/zinc/45/88/55/931458855.db2.gz WUWNJBUZAOHKIR-HNNXBMFYSA-N 0 0 369.259 3.999 20 5 FHBDRN Cc1ccc(-c2ocnc2C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)cc1 ZINC000581003662 931461482 /nfs/dbraw/zinc/46/14/82/931461482.db2.gz YKZXIVGMZOBAIZ-UHFFFAOYSA-N 0 0 363.333 3.687 20 5 FHBDRN COc1cc(Cc2noc(C3(CC(C)C)CC3)n2)c([N+](=O)[O-])c(OC)c1 ZINC000581038080 931514529 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3.967 20 5 FHBDRN COc1cccc(C2(CNC(=O)c3cc(Cl)cc([N+](=O)[O-])c3)CC2)c1 ZINC000581341097 931863078 /nfs/dbraw/zinc/86/30/78/931863078.db2.gz CMPJOEAYTNXFRZ-UHFFFAOYSA-N 0 0 360.797 3.718 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(O[C@H]3CCOC3)cc2)c1C ZINC000889112215 931870674 /nfs/dbraw/zinc/87/06/74/931870674.db2.gz ZWJGOJDKBJWOPO-INIZCTEOSA-N 0 0 356.378 3.632 20 5 FHBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)Nc1ccc2c(c1)CCCC(=O)N2 ZINC000255295301 931878747 /nfs/dbraw/zinc/87/87/47/931878747.db2.gz XREOYAIBKXPIQH-WDZFZDKYSA-N 0 0 351.362 3.522 20 5 FHBDRN CC(C)Oc1cncc(C(=O)N(C)Cc2cc([N+](=O)[O-])ccc2Cl)c1 ZINC000160867031 931883645 /nfs/dbraw/zinc/88/36/45/931883645.db2.gz NZIUOZXOJDCBIJ-UHFFFAOYSA-N 0 0 363.801 3.703 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])Nc1ccc(Br)c(F)c1 ZINC000088085812 931908923 /nfs/dbraw/zinc/90/89/23/931908923.db2.gz RMBZMSBISRGFSW-UHFFFAOYSA-N 0 0 353.147 3.678 20 5 FHBDRN CC(C)(C)c1ccccc1OCCNC(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000610227924 931922199 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O=C(c1csc([N+](=O)[O-])c1)N1CCC(c2cccc(F)c2F)CC1 ZINC000581404225 931970665 /nfs/dbraw/zinc/97/06/65/931970665.db2.gz UUUMRYMVRCINRQ-UHFFFAOYSA-N 0 0 352.362 3.954 20 5 FHBDRN C[C@H]1CN(c2cc(C(F)(F)C(F)(F)F)ncc2[N+](=O)[O-])CC(C)(C)O1 ZINC000581409462 931984875 /nfs/dbraw/zinc/98/48/75/931984875.db2.gz QWEPFZKGTJZXAI-QMMMGPOBSA-N 0 0 369.290 3.648 20 5 FHBDRN CCO[C@H](CCNC(=O)c1ccc(Br)cc1[N+](=O)[O-])C(C)C ZINC000430591408 931987946 /nfs/dbraw/zinc/98/79/46/931987946.db2.gz AYKCSSCZILNAMR-CQSZACIVSA-N 0 0 373.247 3.538 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)Nc1cnc(-c2ccccc2)nc1 ZINC000247333245 932002550 /nfs/dbraw/zinc/00/25/50/932002550.db2.gz PNKIHRFJGXZJLD-UHFFFAOYSA-N 0 0 366.402 3.783 20 5 FHBDRN CC(C)c1ccc(OCCC(=O)OCC(=O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000728332479 932004680 /nfs/dbraw/zinc/00/46/80/932004680.db2.gz KPLIBOMUTJCVIM-UHFFFAOYSA-N 0 0 371.389 3.913 20 5 FHBDRN COc1ccc(NC(=O)CCc2nc3ccccc3s2)c([N+](=O)[O-])c1 ZINC000060514395 932037405 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CCc1ccc([N+](=O)[O-])cc1NC(=O)NCCSCC(F)(F)F ZINC000581578176 932268513 /nfs/dbraw/zinc/26/85/13/932268513.db2.gz ODNFKQSHUFGGAO-UHFFFAOYSA-N 0 0 351.350 3.574 20 5 FHBDRN O=C(C[C@@H]1CCCN1Cc1nc2cc([N+](=O)[O-])ccc2o1)c1ccccc1 ZINC000610720135 932272192 /nfs/dbraw/zinc/27/21/92/932272192.db2.gz UFJSVWAANHCBPV-HNNXBMFYSA-N 0 0 365.389 3.973 20 5 FHBDRN O=C(N[C@@H](c1cccc(C(F)(F)F)c1)C1CC1)c1cc([N+](=O)[O-])c[nH]1 ZINC000581620174 932327909 /nfs/dbraw/zinc/32/79/09/932327909.db2.gz KEZQVDNNOOIVLI-CQSZACIVSA-N 0 0 353.300 3.823 20 5 FHBDRN CSc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(O[C@@H]2CCOC2)cc1 ZINC000933335397 932338735 /nfs/dbraw/zinc/33/87/35/932338735.db2.gz YMKJFHPYOJXESY-OAHLLOKOSA-N 0 0 374.418 3.737 20 5 FHBDRN Cc1sc(C(=O)N2C[C@@H](C)O[C@@H](c3ccsc3)C2)cc1[N+](=O)[O-] ZINC000156307881 932348776 /nfs/dbraw/zinc/34/87/76/932348776.db2.gz UBLXHFRXOAUTKF-NOZJJQNGSA-N 0 0 352.437 3.628 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(-c2nc(-c3ccc(Br)o3)no2)c1 ZINC000477149335 932353145 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CCc1ncsc1NC(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000157384935 932421454 /nfs/dbraw/zinc/42/14/54/932421454.db2.gz QAHILWLVSHQKEF-UHFFFAOYSA-N 0 0 370.228 3.557 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N[C@H](C)c1nc2ccccc2[nH]1 ZINC000477280328 932445441 /nfs/dbraw/zinc/44/54/41/932445441.db2.gz JVCUGURQELGQSE-SNVBAGLBSA-N 0 0 358.785 3.924 20 5 FHBDRN CC[C@H](O)CCNC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000178100925 932446756 /nfs/dbraw/zinc/44/67/56/932446756.db2.gz ZCDGCIZVRRTKLB-AWEZNQCLSA-N 0 0 360.435 3.637 20 5 FHBDRN Cc1cc(Cl)cc(C(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000477322016 932469880 /nfs/dbraw/zinc/46/98/80/932469880.db2.gz NHNIUGXCVCMIJY-UHFFFAOYSA-N 0 0 359.813 3.519 20 5 FHBDRN Cc1nc2ccccc2n1CCNC(=O)c1c(C)cc(Cl)cc1[N+](=O)[O-] ZINC000477317252 932470490 /nfs/dbraw/zinc/47/04/90/932470490.db2.gz KVBASAAZNUBGGB-UHFFFAOYSA-N 0 0 372.812 3.645 20 5 FHBDRN COC(=O)Nc1ccc(NC(=O)C=Cc2ccc([N+](=O)[O-])cc2)cc1F ZINC000588423965 932471300 /nfs/dbraw/zinc/47/13/00/932471300.db2.gz LIWIQBYIIMTQNE-WTKPLQERSA-N 0 0 359.313 3.564 20 5 FHBDRN CC[C@H](NC(=O)[C@@H](C)n1ccc(C(F)(F)F)n1)c1cccc([N+](=O)[O-])c1 ZINC001266794945 932477256 /nfs/dbraw/zinc/47/72/56/932477256.db2.gz WLQCTRFJOWVOIK-MFKMUULPSA-N 0 0 370.331 3.639 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC=C(c2cccc(Cl)c2)CC1 ZINC000477377970 932521696 /nfs/dbraw/zinc/52/16/96/932521696.db2.gz SUQPXNHBWQPWRT-UHFFFAOYSA-N 0 0 357.797 3.881 20 5 FHBDRN CCc1c(C)sc2[nH]c(Cc3c[nH]c4ccc([N+](=O)[O-])cc34)nc(=O)c12 ZINC000157425455 932524273 /nfs/dbraw/zinc/52/42/73/932524273.db2.gz CRLINJQYWPNSQY-UHFFFAOYSA-N 0 0 368.418 3.836 20 5 FHBDRN Cc1cc(C(C)(C)C)cc(C)c1C[S@@](=O)CCn1cc([N+](=O)[O-])cn1 ZINC000157448986 932556157 /nfs/dbraw/zinc/55/61/57/932556157.db2.gz CBBOPZKLPLWFDK-RUZDIDTESA-N 0 0 363.483 3.655 20 5 FHBDRN C[C@@H](C(=O)NCCNc1ccccc1[N+](=O)[O-])c1cc2ccccc2o1 ZINC000175927451 932568864 /nfs/dbraw/zinc/56/88/64/932568864.db2.gz FLWSYBLECZFUFK-CYBMUJFWSA-N 0 0 353.378 3.673 20 5 FHBDRN COc1ccc(CNC(=O)N(C)Cc2ccccc2[N+](=O)[O-])cc1Cl ZINC000178124225 932603785 /nfs/dbraw/zinc/60/37/85/932603785.db2.gz GMQTXPSBLOWIBF-UHFFFAOYSA-N 0 0 363.801 3.598 20 5 FHBDRN O=C(N[C@@H]1[C@H]2Cc3ccccc3[C@@H]12)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000178129474 932605244 /nfs/dbraw/zinc/60/52/44/932605244.db2.gz JPIGXRRBYXZBGU-BMGDILEWSA-N 0 0 350.399 3.878 20 5 FHBDRN CC(C)[C@H]1CC[C@@H](C)C[C@H]1CNC(=O)CN(C)c1ccccc1[N+](=O)[O-] ZINC001125532538 932607410 /nfs/dbraw/zinc/60/74/10/932607410.db2.gz QQGWNKXDVJUIKD-IXDOHACOSA-N 0 0 361.486 3.856 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N[C@H](CCCO)c1ccccc1 ZINC000477446539 932617470 /nfs/dbraw/zinc/61/74/70/932617470.db2.gz VHUSTZGNPJDAOZ-OAHLLOKOSA-N 0 0 362.813 3.800 20 5 FHBDRN O=[N+]([O-])c1cnc(NC[C@]2(O)CCC[C@@H](C(F)(F)F)C2)c(Cl)c1 ZINC000302495835 932626780 /nfs/dbraw/zinc/62/67/80/932626780.db2.gz BIIVAEKOUCMOCU-PELKAZGASA-N 0 0 353.728 3.539 20 5 FHBDRN C[C@H](C(=O)NCc1ccc(OC(F)(F)F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000581763061 932630252 /nfs/dbraw/zinc/63/02/52/932630252.db2.gz ODQCGQTWTLUUSG-NSHDSACASA-N 0 0 368.311 3.913 20 5 FHBDRN Cc1sc(S(=O)(=O)N2CC[C@H](C)C[C@H]2c2ccco2)cc1[N+](=O)[O-] ZINC000467080747 932640853 /nfs/dbraw/zinc/64/08/53/932640853.db2.gz WDHORVHUATULKJ-GWCFXTLKSA-N 0 0 370.452 3.720 20 5 FHBDRN Cc1cc(-c2ncco2)ccc1NC(=O)CN(C)c1ccccc1[N+](=O)[O-] ZINC000581781357 932665521 /nfs/dbraw/zinc/66/55/21/932665521.db2.gz FOSSGUAYPHLMAF-UHFFFAOYSA-N 0 0 366.377 3.633 20 5 FHBDRN CCCc1[nH]nc(C(=O)Nc2cnn([C@@H](C)CC)c2C2CC2)c1[N+](=O)[O-] ZINC000477538557 932677371 /nfs/dbraw/zinc/67/73/71/932677371.db2.gz FMANEQXNPIWINX-JTQLQIEISA-N 0 0 360.418 3.568 20 5 FHBDRN CC1(C)[C@H](NC(=O)c2ccc(F)cc2[N+](=O)[O-])C[C@H]1OCc1ccccc1 ZINC000471710570 932681526 /nfs/dbraw/zinc/68/15/26/932681526.db2.gz CCKZBTKKJXPRSX-QZTJIDSGSA-N 0 0 372.396 3.848 20 5 FHBDRN CC1(C)[C@H](OCc2ccccc2)C[C@@H]1NC(=O)Cc1ccccc1[N+](=O)[O-] ZINC000471713963 932689280 /nfs/dbraw/zinc/68/92/80/932689280.db2.gz OWCVFWCQXQLBOJ-RBUKOAKNSA-N 0 0 368.433 3.637 20 5 FHBDRN CC1(C)[C@@H](NC(=O)Cc2ccccc2[N+](=O)[O-])C[C@@H]1OCc1ccccc1 ZINC000471713962 932689453 /nfs/dbraw/zinc/68/94/53/932689453.db2.gz OWCVFWCQXQLBOJ-OALUTQOASA-N 0 0 368.433 3.637 20 5 FHBDRN C[C@H]1CCc2c(F)cccc2[C@H]1NC(=O)COc1ccccc1[N+](=O)[O-] ZINC000430660296 932697567 /nfs/dbraw/zinc/69/75/67/932697567.db2.gz DAELLFFTCMFXSK-BUXKBTBVSA-N 0 0 358.369 3.553 20 5 FHBDRN C[C@H](c1ccccc1[N+](=O)[O-])N1CCC[C@@H](NC(=O)c2ccccc2)C1 ZINC001167483649 932698618 /nfs/dbraw/zinc/69/86/18/932698618.db2.gz YCDOGCPFUSRFFU-NVXWUHKLSA-N 0 0 353.422 3.550 20 5 FHBDRN CCCOc1ccc(CNc2ccc([N+](=O)[O-])nc2)c(OC(F)F)c1 ZINC000471733616 932733323 /nfs/dbraw/zinc/73/33/23/932733323.db2.gz CSYQFQOVSAEBIO-UHFFFAOYSA-N 0 0 353.325 3.992 20 5 FHBDRN COc1ccc(CC(=O)N[C@H](C)c2ccc3ncsc3c2)cc1[N+](=O)[O-] ZINC000548255899 932737307 /nfs/dbraw/zinc/73/73/07/932737307.db2.gz WFZIKDAGISLMJC-LLVKDONJSA-N 0 0 371.418 3.633 20 5 FHBDRN Cc1cc2c(cc1C)[C@H](C(=O)N1c3ccc([N+](=O)[O-])cc3C[C@@H]1C)CO2 ZINC000471734396 932737446 /nfs/dbraw/zinc/73/74/46/932737446.db2.gz FTVMHLNALHHHPR-SUMWQHHRSA-N 0 0 352.390 3.665 20 5 FHBDRN CC(C)c1ccc(C(=O)N2CCS[C@@H]2c2ccc([N+](=O)[O-])cc2)c(=O)[nH]1 ZINC000933505608 932739973 /nfs/dbraw/zinc/73/99/73/932739973.db2.gz ZBUXNWJJRZAZLX-GOSISDBHSA-N 0 0 373.434 3.707 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)N1Cc2ccccc2C2(CC2)C1 ZINC000187442745 932773199 /nfs/dbraw/zinc/77/31/99/932773199.db2.gz RMCTZFCSPDHTSJ-UHFFFAOYSA-N 0 0 354.431 3.761 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)NC[C@@H](CCO)c2ccccc2)cc1[N+](=O)[O-] ZINC000178183222 932788151 /nfs/dbraw/zinc/78/81/51/932788151.db2.gz DJFNUOSIVZJHGO-QGZVFWFLSA-N 0 0 370.449 3.788 20 5 FHBDRN CC[C@H](OC(=O)[C@H](C)OC[C@@H]1CCCCO1)c1cccc([N+](=O)[O-])c1 ZINC001266835575 932811342 /nfs/dbraw/zinc/81/13/42/932811342.db2.gz IQGZKMNFNZFKER-JQFCIGGWSA-N 0 0 351.399 3.563 20 5 FHBDRN O=[N+]([O-])c1cc2ccccc2nc1N1CCC[C@@H](c2nnc3ccccn32)C1 ZINC000276628826 932812257 /nfs/dbraw/zinc/81/22/57/932812257.db2.gz NWKSZLVJLKBREE-OAHLLOKOSA-N 0 0 374.404 3.570 20 5 FHBDRN O=C(Nc1ccc(C(F)(F)F)nc1)[C@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1 ZINC001266838286 932816741 /nfs/dbraw/zinc/81/67/41/932816741.db2.gz IOYNZDQWOHNSLG-OLZOCXBDSA-N 0 0 351.284 3.751 20 5 FHBDRN CN(C)c1cc(F)c(C(=O)Oc2ccc(Cl)c(F)c2)cc1[N+](=O)[O-] ZINC001266838775 932817330 /nfs/dbraw/zinc/81/73/30/932817330.db2.gz ZAKWNQFRJZTSGC-UHFFFAOYSA-N 0 0 356.712 3.812 20 5 FHBDRN COc1cccc(OC)c1SCc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000276661429 932820006 /nfs/dbraw/zinc/82/00/06/932820006.db2.gz RWFAUQKCABEJMQ-UHFFFAOYSA-N 0 0 363.391 3.771 20 5 FHBDRN Cc1cc(C(=O)Nc2cc(C(F)(F)F)ccc2F)c(N)c([N+](=O)[O-])c1 ZINC000178190610 932823960 /nfs/dbraw/zinc/82/39/60/932823960.db2.gz SKIAQWPEMUHXKQ-UHFFFAOYSA-N 0 0 357.263 3.896 20 5 FHBDRN C[C@@H](NC(=O)CNc1ccccc1[N+](=O)[O-])c1c(F)cccc1Cl ZINC000477649877 932835509 /nfs/dbraw/zinc/83/55/09/932835509.db2.gz IHFULTXFBFQTJQ-SNVBAGLBSA-N 0 0 351.765 3.677 20 5 FHBDRN CCc1ccc(-c2nc(CC(=O)Nc3ccc(C)cc3)no2)cc1[N+](=O)[O-] ZINC000178201948 932842084 /nfs/dbraw/zinc/84/20/84/932842084.db2.gz MEEFEVNAFCBPME-UHFFFAOYSA-N 0 0 366.377 3.697 20 5 FHBDRN C[C@H](Nc1ccc(Cc2nnc3n2CCC3)cc1)c1ccccc1[N+](=O)[O-] ZINC000276672115 932880910 /nfs/dbraw/zinc/88/09/10/932880910.db2.gz ZBZMXQKGGLOYKF-AWEZNQCLSA-N 0 0 363.421 3.896 20 5 FHBDRN C[C@@H](NCC(=O)Nc1ccccc1[N+](=O)[O-])c1ccc(F)cc1Cl ZINC000178206062 932884946 /nfs/dbraw/zinc/88/49/46/932884946.db2.gz XBBZAHUQZHIEBA-SNVBAGLBSA-N 0 0 351.765 3.677 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)N[C@H](C)Cc2ccc(O)cc2)cc1[N+](=O)[O-] ZINC000175970224 932891441 /nfs/dbraw/zinc/89/14/41/932891441.db2.gz LYVYPIWPOQDYLK-ZIAGYGMSSA-N 0 0 357.410 3.600 20 5 FHBDRN Cc1nc(COC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)c(C)s1 ZINC000781717807 932893634 /nfs/dbraw/zinc/89/36/34/932893634.db2.gz FIMAUPAOJRVFQK-UHFFFAOYSA-N 0 0 358.322 3.627 20 5 FHBDRN Cc1cc(OCC(=O)N2C[C@@H](c3ccc(F)cc3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000430687607 932946092 /nfs/dbraw/zinc/94/60/92/932946092.db2.gz RMZVOTNUKHDPAX-ZBFHGGJFSA-N 0 0 372.396 3.826 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)Nc1nnc(C(F)(F)F)s1 ZINC000588436467 932949007 /nfs/dbraw/zinc/94/90/07/932949007.db2.gz YXLUHEYULKWECV-SREVYHEPSA-N 0 0 358.301 3.507 20 5 FHBDRN CC(=O)Nc1ccc(C)c(NC(=O)/C(C)=C\c2ccc([N+](=O)[O-])cc2)c1 ZINC000588436841 932954881 /nfs/dbraw/zinc/95/48/81/932954881.db2.gz UJAQXZGQEMUISO-RAXLEYEMSA-N 0 0 353.378 3.904 20 5 FHBDRN CCOCc1ccccc1CNC(=O)/C(C)=C\c1ccc([N+](=O)[O-])cc1 ZINC000588436859 932955298 /nfs/dbraw/zinc/95/52/98/932955298.db2.gz XMRUMJGKHZYBJJ-QINSGFPZSA-N 0 0 354.406 3.851 20 5 FHBDRN Cc1cccnc1OC1CCN(Cc2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC000564402836 932955585 /nfs/dbraw/zinc/95/55/85/932955585.db2.gz AEQHJKYASLYIPJ-UHFFFAOYSA-N 0 0 363.364 3.620 20 5 FHBDRN CNC(=O)c1ccc(Cl)c(NC(=O)/C(C)=C\c2ccc([N+](=O)[O-])cc2)c1 ZINC000588437079 932961459 /nfs/dbraw/zinc/96/14/59/932961459.db2.gz HSMDZFVVKBSJGC-LUAWRHEFSA-N 0 0 373.796 3.650 20 5 FHBDRN Cc1ccc(CN[C@@H](c2cnn(C)c2)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000187513771 932966410 /nfs/dbraw/zinc/96/64/10/932966410.db2.gz FNQMEYOFVFOWEE-LJQANCHMSA-N 0 0 354.385 3.655 20 5 FHBDRN COC(=O)c1cc([N+](=O)[O-])c(Cl)cc1N[C@@H](C)c1ccc(F)cn1 ZINC001167489045 932975148 /nfs/dbraw/zinc/97/51/48/932975148.db2.gz GDIHSBIIEONLND-QMMMGPOBSA-N 0 0 353.737 3.742 20 5 FHBDRN O=C1CCc2cc(NCc3ccc([N+](=O)[O-])cc3)ccc2N1CC1CC1 ZINC000187525681 932978511 /nfs/dbraw/zinc/97/85/11/932978511.db2.gz MNMMDOKWHHPSFB-UHFFFAOYSA-N 0 0 351.406 3.896 20 5 FHBDRN C[C@H]1COCCCN1C(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000610948437 932997130 /nfs/dbraw/zinc/99/71/30/932997130.db2.gz FJWRMGYCPWWOEN-AWEZNQCLSA-N 0 0 372.446 3.997 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)Nc2cc(C)cc(Br)c2)c1 ZINC000187558577 933002519 /nfs/dbraw/zinc/00/25/19/933002519.db2.gz UBFWVAQQZAGSFQ-UHFFFAOYSA-N 0 0 365.183 3.927 20 5 FHBDRN Cc1cc(-c2noc(CN(C)Cc3ccccc3[N+](=O)[O-])n2)ccc1F ZINC000178265378 933002971 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20 5 FHBDRN COc1ccccc1CCN(C)C(=O)/C(C)=C\c1ccc([N+](=O)[O-])cc1 ZINC000588438228 933055690 /nfs/dbraw/zinc/05/56/90/933055690.db2.gz BOZKEPVOPXRHLR-PFONDFGASA-N 0 0 354.406 3.708 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)NCc1coc(-c2ccccc2)n1 ZINC000588439387 933065181 /nfs/dbraw/zinc/06/51/81/933065181.db2.gz JOGSHBKYXJXAGK-KAMYIIQDSA-N 0 0 363.373 3.970 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)NCc1ccn(C2CCCC2)n1 ZINC000588440680 933071510 /nfs/dbraw/zinc/07/15/10/933071510.db2.gz KLYULXHEYJDXDF-OWBHPGMISA-N 0 0 354.410 3.626 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H](C)c1nc2ccccc2[nH]1 ZINC000439905454 945070479 /nfs/dbraw/zinc/07/04/79/945070479.db2.gz VZOXZSXXFCJEAD-LLVKDONJSA-N 0 0 369.381 3.753 20 5 FHBDRN O=C(NCc1ccc(Cl)o1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000610572027 933130324 /nfs/dbraw/zinc/13/03/24/933130324.db2.gz CSIMRGZMXLJTKH-UHFFFAOYSA-N 0 0 359.563 3.534 20 5 FHBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccnnc1OC ZINC000581969591 933140264 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3.595 20 5 FHBDRN Cc1cc(OCC(=O)NC[C@H]2CCCC[C@H]2C(F)(F)F)ccc1[N+](=O)[O-] ZINC000430804848 933249885 /nfs/dbraw/zinc/24/98/85/933249885.db2.gz BOGCDFCWFKPWSI-TZMCWYRMSA-N 0 0 374.359 3.767 20 5 FHBDRN CC(C)(COCc1ccccc1)NCc1c(F)cc([N+](=O)[O-])cc1F ZINC000510604390 933264911 /nfs/dbraw/zinc/26/49/11/933264911.db2.gz YBXLUQSNCHDREY-UHFFFAOYSA-N 0 0 350.365 3.958 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)NCc2c(F)cc(F)c(F)c2F)c1 ZINC000430826041 933271015 /nfs/dbraw/zinc/27/10/15/933271015.db2.gz UJQQKILXJIYSTB-UHFFFAOYSA-N 0 0 374.315 3.803 20 5 FHBDRN COC(=O)c1cnc(NCc2ccc(-c3ccccc3)o2)c([N+](=O)[O-])c1 ZINC000477735780 933276519 /nfs/dbraw/zinc/27/65/19/933276519.db2.gz AVRFKXBWYANBJZ-UHFFFAOYSA-N 0 0 353.334 3.649 20 5 FHBDRN CC(C)COc1cccc(NC(=O)NCCNc2ccc([N+](=O)[O-])cc2)c1 ZINC000510622044 933306800 /nfs/dbraw/zinc/30/68/00/933306800.db2.gz LQFOXAILJKQALT-UHFFFAOYSA-N 0 0 372.425 3.863 20 5 FHBDRN COC(=O)c1cnc(NC[C@H]2CCC[C@H](C(F)(F)F)C2)c([N+](=O)[O-])c1 ZINC000477751185 933316355 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FHBDRN C[C@H](NC(=O)c1c([N+](=O)[O-])cnn1C)c1ccc(Oc2ccccc2)cc1 ZINC000165953468 933467242 /nfs/dbraw/zinc/46/72/42/933467242.db2.gz NCMBLRRGMYAADL-ZDUSSCGKSA-N 0 0 366.377 3.612 20 5 FHBDRN O=[N+]([O-])c1ccc(OCCc2ccc3c(c2)OCCO3)c2cccnc21 ZINC000471885512 933482328 /nfs/dbraw/zinc/48/23/28/933482328.db2.gz KKLHMFRQNRROPR-UHFFFAOYSA-N 0 0 352.346 3.536 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CN1C[C@H](C(F)(F)F)[C@H](C(F)(F)F)C1 ZINC000610605052 933514609 /nfs/dbraw/zinc/51/46/09/933514609.db2.gz WGLPZDIKISOKGM-PHIMTYICSA-N 0 0 372.265 3.776 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1Br)N1C[C@@H]2CCCC[C@H]2C1 ZINC000176090489 933534831 /nfs/dbraw/zinc/53/48/31/933534831.db2.gz VEEFMIJYWIXJIE-QWRGUYRKSA-N 0 0 353.216 3.620 20 5 FHBDRN C[C@@H](NC(=O)NCc1c(F)c(F)cc(F)c1F)c1cccc([N+](=O)[O-])c1 ZINC000610640364 933576372 /nfs/dbraw/zinc/57/63/72/933576372.db2.gz QXTVLNDNOJKBRH-MRVPVSSYSA-N 0 0 371.290 3.712 20 5 FHBDRN CC1(C)CN(C(=O)NCCc2ccccc2[N+](=O)[O-])Cc2ccccc21 ZINC000548423075 933595722 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FHBDRN CSc1ccc(C(=O)N2CC(Cc3cccc(C)c3)C2)cc1[N+](=O)[O-] ZINC000610659762 933671732 /nfs/dbraw/zinc/67/17/32/933671732.db2.gz QYHGWFGPWASLEW-UHFFFAOYSA-N 0 0 356.447 3.940 20 5 FHBDRN Cc1cnc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)o1 ZINC000610661849 933687415 /nfs/dbraw/zinc/68/74/15/933687415.db2.gz YWZRGUJWCOTOPU-LBPRGKRZSA-N 0 0 367.365 3.712 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)N1C2CCCC1CCC2 ZINC000610668208 933693300 /nfs/dbraw/zinc/69/33/00/933693300.db2.gz PRPFQVGRLIELFR-UHFFFAOYSA-N 0 0 367.243 3.833 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])[nH]1)N1CCC[C@@H]1c1ccccc1Br ZINC000610669758 933704908 /nfs/dbraw/zinc/70/49/08/933704908.db2.gz RNNVRUXCNYUQHA-CYBMUJFWSA-N 0 0 364.199 3.663 20 5 FHBDRN CC[C@H]1CN(C)c2ccccc2CN1C(=O)c1cc(F)cc([N+](=O)[O-])c1 ZINC000610670310 933710592 /nfs/dbraw/zinc/71/05/92/933710592.db2.gz DKYLRRRAERDKPT-INIZCTEOSA-N 0 0 357.385 3.605 20 5 FHBDRN COc1cc(C(=O)N(C)[C@H](C)c2c(F)cccc2F)ccc1[N+](=O)[O-] ZINC000510783946 933726514 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COc1cc2c(cc1OC)CCN(c1ccc(Cl)cc1[N+](=O)[O-])CC2 ZINC000510812521 933781517 /nfs/dbraw/zinc/78/15/17/933781517.db2.gz RUTOYIPEAOCDSY-UHFFFAOYSA-N 0 0 362.813 3.871 20 5 FHBDRN COc1cc(OC)cc(N2CC[C@@H](CNc3ccsc3[N+](=O)[O-])C2)c1 ZINC000610686509 933783556 /nfs/dbraw/zinc/78/35/56/933783556.db2.gz HEZCIIGVUUSCTQ-LBPRGKRZSA-N 0 0 363.439 3.612 20 5 FHBDRN CCc1ccc(C(=O)N[C@@H](COCC(C)C)c2ccco2)cc1[N+](=O)[O-] ZINC000471923708 933795194 /nfs/dbraw/zinc/79/51/94/933795194.db2.gz QMAIEFAIRKOUJX-INIZCTEOSA-N 0 0 360.410 3.894 20 5 FHBDRN CCc1ccc(C(=O)N[C@H](COCC(C)C)c2ccco2)cc1[N+](=O)[O-] ZINC000471923709 933795419 /nfs/dbraw/zinc/79/54/19/933795419.db2.gz QMAIEFAIRKOUJX-MRXNPFEDSA-N 0 0 360.410 3.894 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1)N[C@@H]1CCN(c2cccc(Cl)c2)C1 ZINC000431083068 933814771 /nfs/dbraw/zinc/81/47/71/933814771.db2.gz KQMZPMKDHXGXQL-CQSZACIVSA-N 0 0 360.801 3.649 20 5 FHBDRN Cc1cc(CNC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)ccc1F ZINC000510840615 933840004 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Cc1c(NC(=O)CCc2ccoc2)cc(Br)cc1[N+](=O)[O-] ZINC000431175081 934016702 /nfs/dbraw/zinc/01/67/02/934016702.db2.gz KCWFSWBXMAJPGF-UHFFFAOYSA-N 0 0 353.172 3.830 20 5 FHBDRN Cc1cnccc1C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000431174996 934016814 /nfs/dbraw/zinc/01/68/14/934016814.db2.gz JGPZOKACGFAIKR-UHFFFAOYSA-N 0 0 350.172 3.621 20 5 FHBDRN COc1cc(-c2noc(-c3cccc([N+](=O)[O-])c3C)n2)cc(OC)c1OC ZINC000134778244 934026418 /nfs/dbraw/zinc/02/64/18/934026418.db2.gz ZAXQXHRRNPWALG-UHFFFAOYSA-N 0 0 371.349 3.646 20 5 FHBDRN Cc1nscc1C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000431181953 934042481 /nfs/dbraw/zinc/04/24/81/934042481.db2.gz MZSGKGADUCUIMJ-UHFFFAOYSA-N 0 0 356.201 3.683 20 5 FHBDRN C[C@H](c1ccccc1)n1ccc(=NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)[nH]1 ZINC000610746029 934071184 /nfs/dbraw/zinc/07/11/84/934071184.db2.gz NJSHAQLSNHINOU-GFCCVEGCSA-N 0 0 370.796 3.728 20 5 FHBDRN COC(=O)c1cc2ccc(OCc3ccc([N+](=O)[O-])c(OC)c3)cc2o1 ZINC000548475949 934075467 /nfs/dbraw/zinc/07/54/67/934075467.db2.gz 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O=C(NCc1c(F)cc(F)cc1F)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000511022676 934928950 /nfs/dbraw/zinc/92/89/50/934928950.db2.gz SGZCUUCZBDOGNN-UHFFFAOYSA-N 0 0 350.252 3.688 20 5 FHBDRN CO[C@H](c1ccc(F)cc1)[C@@H](C)NC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000538901443 934944375 /nfs/dbraw/zinc/94/43/75/934944375.db2.gz MYZZTIFCJDBWQT-HWPZZCPQSA-N 0 0 366.776 3.893 20 5 FHBDRN CO[C@@H](c1ccc(F)cc1)[C@H](C)NC(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000538902905 934945018 /nfs/dbraw/zinc/94/50/18/934945018.db2.gz LNXFTUVZSGAVLU-BBATYDOGSA-N 0 0 372.352 3.986 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(C(=O)Nc2ccccc2C(=O)N2CCCC2)c1F ZINC000277322481 934955080 /nfs/dbraw/zinc/95/50/80/934955080.db2.gz FXIJOJZXYWNRJR-UHFFFAOYSA-N 0 0 371.368 3.531 20 5 FHBDRN C[C@H]1C[C@@H](c2ccccc2)N(S(=O)(=O)c2c(F)cccc2[N+](=O)[O-])C1 ZINC000511030905 934971080 /nfs/dbraw/zinc/97/10/80/934971080.db2.gz PMRYPEWHGRSVII-LRDDRELGSA-N 0 0 364.398 3.506 20 5 FHBDRN COc1ccc(C)cc1-n1ccc(C(=O)Nc2cc([N+](=O)[O-])ccc2C)n1 ZINC000065536003 934981823 /nfs/dbraw/zinc/98/18/23/934981823.db2.gz PJNNTMIZGIWVJE-UHFFFAOYSA-N 0 0 366.377 3.658 20 5 FHBDRN Cc1ccc(NC(=O)NCCc2ccccc2OC(F)F)cc1[N+](=O)[O-] ZINC000472088010 934986558 /nfs/dbraw/zinc/98/65/58/934986558.db2.gz KYMXCUAHQOMSNF-UHFFFAOYSA-N 0 0 365.336 3.869 20 5 FHBDRN C[C@@H]1C[C@H](c2ccccc2)N(S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000511036849 935002716 /nfs/dbraw/zinc/00/27/16/935002716.db2.gz WYDBTKUSXUZUQB-MLGOLLRUSA-N 0 0 364.398 3.506 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)Nc1ccc(C(F)(F)F)nc1 ZINC000536431474 935003449 /nfs/dbraw/zinc/00/34/49/935003449.db2.gz QUDMHLOXOGFUCV-UHFFFAOYSA-N 0 0 364.283 3.671 20 5 FHBDRN Cc1cc(C(=O)NCCOc2ccc(C(F)(F)F)cc2)ccc1[N+](=O)[O-] ZINC000071933733 935019741 /nfs/dbraw/zinc/01/97/41/935019741.db2.gz JIELKPPHEHEOAE-UHFFFAOYSA-N 0 0 368.311 3.731 20 5 FHBDRN O=[N+]([O-])c1ccc(OC2CCN(Cc3ccnn3C3CCC3)CC2)cc1 ZINC000892110321 935020266 /nfs/dbraw/zinc/02/02/66/935020266.db2.gz LOHKACMFHWRTLB-UHFFFAOYSA-N 0 0 356.426 3.560 20 5 FHBDRN CCn1c(SCCCCCOC)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000157146635 935025625 /nfs/dbraw/zinc/02/56/25/935025625.db2.gz DGAVFLZFHKUAGL-UHFFFAOYSA-N 0 0 350.444 3.782 20 5 FHBDRN Cc1cc(N[C@H](C)[C@@H](c2ccccc2)[NH+](C)C)cc(C(=O)[O-])c1[N+](=O)[O-] ZINC000563206120 935041917 /nfs/dbraw/zinc/04/19/17/935041917.db2.gz ZBYZAFOYYAIUFQ-ACJLOTCBSA-N 0 0 357.410 3.705 20 5 FHBDRN Cc1cc(N[C@@H](C)[C@@H](c2ccccc2)[NH+](C)C)cc(C(=O)[O-])c1[N+](=O)[O-] ZINC000563206148 935042168 /nfs/dbraw/zinc/04/21/68/935042168.db2.gz ZBYZAFOYYAIUFQ-UGSOOPFHSA-N 0 0 357.410 3.705 20 5 FHBDRN CC(C)(C(=O)Nc1ccc(-n2ccnc2)c(F)c1)c1ccccc1[N+](=O)[O-] ZINC000431323698 935042595 /nfs/dbraw/zinc/04/25/95/935042595.db2.gz PFTBHMOZPPZYEL-UHFFFAOYSA-N 0 0 368.368 3.836 20 5 FHBDRN COc1cccc(COC(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])c1 ZINC000728455649 935060681 /nfs/dbraw/zinc/06/06/81/935060681.db2.gz XTLWFITZUTZVIT-UHFFFAOYSA-N 0 0 363.391 3.691 20 5 FHBDRN CCOc1cc(CS(=O)(=O)[C@H](C)c2cccc(C)c2)ccc1[N+](=O)[O-] ZINC000277397527 935075432 /nfs/dbraw/zinc/07/54/32/935075432.db2.gz CPUWFESKELNSTJ-CQSZACIVSA-N 0 0 363.435 3.978 20 5 FHBDRN CNC(=O)c1cc(Oc2cccc(Oc3ccc([N+](=O)[O-])cc3)c2)ccn1 ZINC000539197025 935079590 /nfs/dbraw/zinc/07/95/90/935079590.db2.gz DTNGCXGXLTWWKQ-UHFFFAOYSA-N 0 0 365.345 3.934 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)C(=O)N1CCC[C@@H]1c1ccccc1 ZINC000119709109 935080272 /nfs/dbraw/zinc/08/02/72/935080272.db2.gz VGXPPMXYHSDIKS-MRXNPFEDSA-N 0 0 373.796 3.550 20 5 FHBDRN CSc1ccccc1CN(C)C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000472122536 935085671 /nfs/dbraw/zinc/08/56/71/935085671.db2.gz PVKRHBBNPPFGFX-UHFFFAOYSA-N 0 0 359.451 3.701 20 5 FHBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)N[C@H]1CC[C@H](c2ccc(F)cc2)C1 ZINC000472126347 935095152 /nfs/dbraw/zinc/09/51/52/935095152.db2.gz OITISVKTVZFFGY-WMZOPIPTSA-N 0 0 371.412 3.912 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)Sc1ccc(Cl)cn1 ZINC000119718236 935099049 /nfs/dbraw/zinc/09/90/49/935099049.db2.gz KQYHQIZXKIVMKC-SECBINFHSA-N 0 0 367.814 3.771 20 5 FHBDRN CC(C)(C)OC(=O)NC1CCN(c2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000071968458 935129395 /nfs/dbraw/zinc/12/93/95/935129395.db2.gz CPDQPYVROKUUGU-UHFFFAOYSA-N 0 0 355.822 3.742 20 5 FHBDRN Cc1c(CC(=O)N[C@@H]2CCC[C@H]2Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000438825067 945080522 /nfs/dbraw/zinc/08/05/22/945080522.db2.gz ATJLSMXIEWHPJU-RBUKOAKNSA-N 0 0 352.434 3.973 20 5 FHBDRN COc1cccc([C@@H]2C[C@H]2C(=O)Nc2ccc3cc([N+](=O)[O-])ccc3n2)c1 ZINC000084776549 935170172 /nfs/dbraw/zinc/17/01/72/935170172.db2.gz KVUMYIFSKIGYPG-DLBZAZTESA-N 0 0 363.373 3.894 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)Nc1cc(C)ccc1Oc1ccccc1 ZINC000084786084 935178825 /nfs/dbraw/zinc/17/88/25/935178825.db2.gz LIRBNNNQLLCQSP-UHFFFAOYSA-N 0 0 366.377 3.839 20 5 FHBDRN Cc1nn(CC(C)C)c(C)c1CCC(=O)N[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000539348553 935181349 /nfs/dbraw/zinc/18/13/49/935181349.db2.gz PYKXMWGZGUAEKY-AWEZNQCLSA-N 0 0 372.469 3.874 20 5 FHBDRN CC(C)(C(=O)Nc1ccc(-n2cccn2)c(F)c1)c1ccccc1[N+](=O)[O-] ZINC000431340291 935181518 /nfs/dbraw/zinc/18/15/18/935181518.db2.gz CPLTVFCZXIROGL-UHFFFAOYSA-N 0 0 368.368 3.836 20 5 FHBDRN C[C@@H](NC(=O)Cc1ccccc1[N+](=O)[O-])c1ccc(OCC2CC2)c(F)c1 ZINC000119746203 935183654 /nfs/dbraw/zinc/18/36/54/935183654.db2.gz MSRZOQBGVPWIIR-CYBMUJFWSA-N 0 0 372.396 3.943 20 5 FHBDRN Cn1nc(-c2nc(-c3ccc4ccc5cccnc5c4n3)no2)cc1Cl ZINC001213084247 935184808 /nfs/dbraw/zinc/18/48/08/935184808.db2.gz RGQDCZDOFSVPKL-UHFFFAOYSA-N 0 0 362.780 3.887 20 5 FHBDRN CCO[C@H]1C[C@@H](NC(=O)Cc2cccc([N+](=O)[O-])c2C)C12CCCCC2 ZINC000438826988 945082359 /nfs/dbraw/zinc/08/23/59/945082359.db2.gz HHKCENFNGKQIEU-MSOLQXFVSA-N 0 0 360.454 3.690 20 5 FHBDRN C[C@H]1CCC[C@H](C)N(C(=O)Cc2ccc([N+](=O)[O-])cc2Br)C1 ZINC000446030427 935194215 /nfs/dbraw/zinc/19/42/15/935194215.db2.gz FQTMQAJLQNAMKT-RYUDHWBXSA-N 0 0 369.259 3.937 20 5 FHBDRN CCOc1cc(NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)ccc1OC ZINC000046511291 935201992 /nfs/dbraw/zinc/20/19/92/935201992.db2.gz OEARBXRIJYXFKG-UHFFFAOYSA-N 0 0 371.393 3.829 20 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ZINC000263525841 935239438 /nfs/dbraw/zinc/23/94/38/935239438.db2.gz UADXCIPGOXGCNP-OPUMOTSWSA-N 0 0 354.406 3.674 20 5 FHBDRN O=[N+]([O-])c1ccc(OCc2nn(-c3ccc(F)cc3)c3c2CCC3)cc1 ZINC000072040393 935242424 /nfs/dbraw/zinc/24/24/24/935242424.db2.gz FSPLOLFXOHAZHI-UHFFFAOYSA-N 0 0 353.353 3.987 20 5 FHBDRN CSCc1ccccc1NC(=O)N1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000582092272 935243332 /nfs/dbraw/zinc/24/33/32/935243332.db2.gz IUQRHGFCHOOOGH-UHFFFAOYSA-N 0 0 373.434 3.884 20 5 FHBDRN Cc1c(CC(=O)N(CCc2ccc(F)cc2)C2CC2)cccc1[N+](=O)[O-] ZINC000438832083 945086989 /nfs/dbraw/zinc/08/69/89/945086989.db2.gz TUPWVGGFLDTNLB-UHFFFAOYSA-N 0 0 356.397 3.819 20 5 FHBDRN Cc1noc(C)c1CCC(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000551333119 935257515 /nfs/dbraw/zinc/25/75/15/935257515.db2.gz VEDOQAQMLCHBKM-UHFFFAOYSA-N 0 0 368.187 3.533 20 5 FHBDRN COc1ccc(CCNC(=O)c2cc([N+](=O)[O-])c(C)s2)c(Cl)c1 ZINC000472165148 935262618 /nfs/dbraw/zinc/26/26/18/935262618.db2.gz WBXBZAKBCUBZDF-UHFFFAOYSA-N 0 0 354.815 3.599 20 5 FHBDRN Cn1ccnc1Sc1ccc(F)cc1NC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000072058120 935263748 /nfs/dbraw/zinc/26/37/48/935263748.db2.gz ULWPQPUWMLEORI-UHFFFAOYSA-N 0 0 372.381 3.871 20 5 FHBDRN O=[N+]([O-])c1cc(Br)cc(NCc2ncn(-c3ccccc3)n2)c1 ZINC000551360090 935265015 /nfs/dbraw/zinc/26/50/15/935265015.db2.gz HIJFFYHTMUDLDE-UHFFFAOYSA-N 0 0 374.198 3.550 20 5 FHBDRN C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCC(CC(F)(F)F)CC1 ZINC000551403750 935270447 /nfs/dbraw/zinc/27/04/47/935270447.db2.gz NBRULCRQGHADQP-NSHDSACASA-N 0 0 359.348 3.586 20 5 FHBDRN COc1ccc([C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2OC)C(C)C)cc1 ZINC000427116284 945090001 /nfs/dbraw/zinc/09/00/01/945090001.db2.gz FUIOHCDYYSNIHJ-SFHVURJKSA-N 0 0 358.394 3.739 20 5 FHBDRN C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CCc2cccc(F)c2C1 ZINC000158047259 935297613 /nfs/dbraw/zinc/29/76/13/935297613.db2.gz DGKZBWVEQHZVMI-GFCCVEGCSA-N 0 0 368.368 3.903 20 5 FHBDRN Cc1c(NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)cccc1C(F)(F)F ZINC000119860364 935298210 /nfs/dbraw/zinc/29/82/10/935298210.db2.gz NLDKAVZQSJKYAR-UHFFFAOYSA-N 0 0 357.263 3.896 20 5 FHBDRN Cc1cc(OCCn2cnc3cc([N+](=O)[O-])ccc3c2=O)ccc1C(C)C ZINC000072105667 935308777 /nfs/dbraw/zinc/30/87/77/935308777.db2.gz MNUIHNBDXQWXFE-UHFFFAOYSA-N 0 0 367.405 3.816 20 5 FHBDRN C[C@H]1CC[C@@H](CCC(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)O1 ZINC000551680069 935327894 /nfs/dbraw/zinc/32/78/94/935327894.db2.gz MQVATWHUBLPPDL-ZANVPECISA-N 0 0 357.204 3.644 20 5 FHBDRN CCN(CC)C(=O)c1ccc(C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000511779980 945093417 /nfs/dbraw/zinc/09/34/17/945093417.db2.gz WSIPJKUKFLTAOI-CQSZACIVSA-N 0 0 369.421 3.568 20 5 FHBDRN CC(C)(C)[C@@H]1OCCC[C@@H]1CNC(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000118266855 935334972 /nfs/dbraw/zinc/33/49/72/935334972.db2.gz STGSLLUYPJHFIG-CXAGYDPISA-N 0 0 368.861 3.748 20 5 FHBDRN COc1ccc(CCCNc2cc(OC)c([N+](=O)[O-])cc2F)cc1OC ZINC000551739822 935335596 /nfs/dbraw/zinc/33/55/96/935335596.db2.gz JUYPEYTYILVZEX-UHFFFAOYSA-N 0 0 364.373 3.804 20 5 FHBDRN O=C1CCc2cc([N+](=O)[O-])c(NC[C@H]3CCO[C@@H]3c3ccccc3)cc2N1 ZINC000431366072 935345107 /nfs/dbraw/zinc/34/51/07/935345107.db2.gz DQIHXLRCGVYQNT-FOIQADDNSA-N 0 0 367.405 3.669 20 5 FHBDRN Cc1ccc(C(=O)Nc2nc(CN3CCC(C)CC3)cs2)cc1[N+](=O)[O-] ZINC000014526196 935351259 /nfs/dbraw/zinc/35/12/59/935351259.db2.gz ZAVDAGWIYXTFNP-UHFFFAOYSA-N 0 0 374.466 3.844 20 5 FHBDRN Cn1c(NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)nc2cc(F)ccc21 ZINC000437176753 945095530 /nfs/dbraw/zinc/09/55/30/945095530.db2.gz QKVGASHZWWJRDZ-UHFFFAOYSA-N 0 0 354.297 3.619 20 5 FHBDRN Cc1sc(S(=O)(=O)N2C[C@@H](c3ccccc3)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000124052709 945095932 /nfs/dbraw/zinc/09/59/32/945095932.db2.gz SSZIOBPNFMFEDI-FZMZJTMJSA-N 0 0 366.464 3.531 20 5 FHBDRN C[C@@H](Oc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(Br)c1 ZINC000014553031 935373134 /nfs/dbraw/zinc/37/31/34/935373134.db2.gz JFYXLOFZYSTMBB-SNVBAGLBSA-N 0 0 365.183 3.763 20 5 FHBDRN O=C(NCCc1ccc(F)c(F)c1)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000551918627 935378948 /nfs/dbraw/zinc/37/89/48/935378948.db2.gz UAVLEBITUGECGJ-UHFFFAOYSA-N 0 0 374.265 3.864 20 5 FHBDRN CCCCN(Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)CC(F)(F)F ZINC000119967890 935379782 /nfs/dbraw/zinc/37/97/82/935379782.db2.gz FQVMKTVLKPYRMR-UHFFFAOYSA-N 0 0 358.320 3.809 20 5 FHBDRN COc1ccc(OCc2noc(/C=C/c3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000545056729 935380479 /nfs/dbraw/zinc/38/04/79/935380479.db2.gz LMRTYWUZDVICHO-NYYWCZLTSA-N 0 0 353.334 3.736 20 5 FHBDRN Cc1c(NC(=O)c2c(C)cc(Cl)cc2[N+](=O)[O-])cnn1CC(C)C ZINC000446304951 935390046 /nfs/dbraw/zinc/39/00/46/935390046.db2.gz PQMQBOBLBSZSLS-UHFFFAOYSA-N 0 0 350.806 3.970 20 5 FHBDRN C[C@@H](NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)c1ccc(F)c(F)c1 ZINC000014575164 935391125 /nfs/dbraw/zinc/39/11/25/935391125.db2.gz MXEGDMKEKOTBOU-SNVBAGLBSA-N 0 0 361.348 3.938 20 5 FHBDRN CCOC(=O)c1cnc2ccccc2c1OCc1cccc([N+](=O)[O-])c1 ZINC000582209902 935401303 /nfs/dbraw/zinc/40/13/03/935401303.db2.gz NBFCPLLOHQWMSE-UHFFFAOYSA-N 0 0 352.346 3.899 20 5 FHBDRN COc1cc(CN2CCS[C@@H](C)[C@@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000118415217 935433025 /nfs/dbraw/zinc/43/30/25/935433025.db2.gz DNCNGGLOBKGGOS-UWVGGRQHSA-N 0 0 362.398 3.531 20 5 FHBDRN CCCN1C(=O)CCc2cc(NC(=O)c3cc(C)ccc3[N+](=O)[O-])ccc21 ZINC000091161495 935439024 /nfs/dbraw/zinc/43/90/24/935439024.db2.gz VVQAGLSFEYYLIA-UHFFFAOYSA-N 0 0 367.405 3.845 20 5 FHBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1Cn1c(=O)oc2cc(Cl)ccc21 ZINC000511094580 935449944 /nfs/dbraw/zinc/44/99/44/935449944.db2.gz HRTZLRZWJVEUPD-UHFFFAOYSA-N 0 0 362.769 3.992 20 5 FHBDRN CCCc1ccccc1NC(=O)N1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000582270478 935472239 /nfs/dbraw/zinc/47/22/39/935472239.db2.gz CKDZVYDPZJDTHS-UHFFFAOYSA-N 0 0 355.394 3.974 20 5 FHBDRN O=C1CCc2cc([N+](=O)[O-])c(NCCc3cc4ccccc4[nH]3)cc2N1 ZINC000135513614 935473395 /nfs/dbraw/zinc/47/33/95/935473395.db2.gz GMFHLXZEEMPMSF-UHFFFAOYSA-N 0 0 350.378 3.615 20 5 FHBDRN CC(C)c1nc(CCNC(=O)c2ccc(Cl)cc2[N+](=O)[O-])cs1 ZINC000263950836 935503290 /nfs/dbraw/zinc/50/32/90/935503290.db2.gz ZKBSSWPYHCWJOX-UHFFFAOYSA-N 0 0 353.831 3.801 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)NCC(C)(C)Oc2ccccc2)c1 ZINC000540624922 935513134 /nfs/dbraw/zinc/51/31/34/935513134.db2.gz CWGZZTIQKFFTDQ-UHFFFAOYSA-N 0 0 372.421 3.646 20 5 FHBDRN CCc1nc(C)c([C@H](C)N(C)C(=O)COc2ccc([N+](=O)[O-])cc2)s1 ZINC000120059410 935514643 /nfs/dbraw/zinc/51/46/43/935514643.db2.gz BMBWJULGLONEBD-LBPRGKRZSA-N 0 0 363.439 3.521 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CCO[C@H](c2ccc(F)cc2)C1 ZINC000120071137 935525460 /nfs/dbraw/zinc/52/54/60/935525460.db2.gz IVLOPCNAXVKIDY-SFHVURJKSA-N 0 0 373.384 3.956 20 5 FHBDRN Cc1cc(C)c(CNC(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)c(=O)[nH]1 ZINC000263994746 935526252 /nfs/dbraw/zinc/52/62/52/935526252.db2.gz HWUDLXAUKKAGER-UHFFFAOYSA-N 0 0 357.410 3.540 20 5 FHBDRN Cc1csc([C@H](C)NC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)n1 ZINC000120078251 935544256 /nfs/dbraw/zinc/54/42/56/935544256.db2.gz OXBVITCFMPJVBI-ZDUSSCGKSA-N 0 0 362.455 3.743 20 5 FHBDRN O=C(CC1CCOCC1)Oc1ccc(Cc2ccccc2)cc1[N+](=O)[O-] ZINC000176660646 935551856 /nfs/dbraw/zinc/55/18/56/935551856.db2.gz FERBAFPMEGSCEI-UHFFFAOYSA-N 0 0 355.390 3.908 20 5 FHBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCO[C@@H](C)C1 ZINC000540750583 935554367 /nfs/dbraw/zinc/55/43/67/935554367.db2.gz LASPJLDUNPLRBS-QWHCGFSZSA-N 0 0 352.456 3.784 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)NCCCCc2ccc(F)c(F)c2)c1 ZINC000478056045 935556927 /nfs/dbraw/zinc/55/69/27/935556927.db2.gz WLSCHWWVZQDSNU-UHFFFAOYSA-N 0 0 364.348 3.634 20 5 FHBDRN CCc1c(NC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc32)onc1C(F)(F)F ZINC000431387179 935570275 /nfs/dbraw/zinc/57/02/75/935570275.db2.gz QVCQUAQDMGAGHV-UHFFFAOYSA-N 0 0 368.271 3.898 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])CC(=O)Nc1ccc(F)c(Cl)c1 ZINC000511104359 935581433 /nfs/dbraw/zinc/58/14/33/935581433.db2.gz DWZUWGGICWGPET-UHFFFAOYSA-N 0 0 365.792 3.500 20 5 FHBDRN Cc1nn(Cc2ccc(C(=O)NC[C@H]3CC[C@@H](C)C3)cc2)c(C)c1[N+](=O)[O-] ZINC000478159281 935581805 /nfs/dbraw/zinc/58/18/05/935581805.db2.gz RZFMZLNWEUCDCU-DYVFJYSZSA-N 0 0 370.453 3.622 20 5 FHBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)[C@H]1CCCO1 ZINC000135045837 935583588 /nfs/dbraw/zinc/58/35/88/935583588.db2.gz OYKAAIMGAWJIRZ-IUODEOHRSA-N 0 0 352.456 3.640 20 5 FHBDRN Cc1nc(CCNC(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)sc1C ZINC000478198898 935591342 /nfs/dbraw/zinc/59/13/42/935591342.db2.gz OHTNBAWJTFCKFJ-UHFFFAOYSA-N 0 0 361.467 3.938 20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])N[C@H]1CC[C@@H](c2cccc(F)c2)C1 ZINC000478222537 935593620 /nfs/dbraw/zinc/59/36/20/935593620.db2.gz DIRBNTXQCRYBRC-WBVHZDCISA-N 0 0 371.412 3.988 20 5 FHBDRN O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1CC2(CCOCC2)[C@@H]2CCC[C@@H]21 ZINC000519084849 945111048 /nfs/dbraw/zinc/11/10/48/945111048.db2.gz LMWKHPMYEAJANO-CVEARBPZSA-N 0 0 364.829 3.670 20 5 FHBDRN CN(C(=O)COc1ccc([N+](=O)[O-])c2cccnc12)[C@@H]1CCC(C)(C)C1 ZINC000478242445 935596168 /nfs/dbraw/zinc/59/61/68/935596168.db2.gz SPGZHQRMFPFJHS-CYBMUJFWSA-N 0 0 357.410 3.559 20 5 FHBDRN C[C@@H]1CCN(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)CC12CCC2 ZINC000467225833 945111557 /nfs/dbraw/zinc/11/15/57/945111557.db2.gz AFBAKIBXKLYOGJ-GFCCVEGCSA-N 0 0 351.834 3.970 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1-c1noc(-c2cc(Cc3ccccc3)[nH]n2)n1 ZINC000582386274 935603725 /nfs/dbraw/zinc/60/37/25/935603725.db2.gz SLOXNBLJYKCYMY-UHFFFAOYSA-N 0 0 361.361 3.934 20 5 FHBDRN COc1cccc(-c2noc([C@H](C)NCc3ccc([N+](=O)[O-])cc3F)n2)c1 ZINC000478280472 935605982 /nfs/dbraw/zinc/60/59/82/935605982.db2.gz XEVIUPNZVQBAOV-NSHDSACASA-N 0 0 372.356 3.643 20 5 FHBDRN O=C(NCc1nc2ccccc2s1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000023424421 935606474 /nfs/dbraw/zinc/60/64/74/935606474.db2.gz IXAGDJVFCLFHNW-UHFFFAOYSA-N 0 0 368.418 3.709 20 5 FHBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCO[C@@H](c2cccc(O)c2)C1 ZINC000127528405 935607147 /nfs/dbraw/zinc/60/71/47/935607147.db2.gz CCHDDCZOAIKDQC-HXUWFJFHSA-N 0 0 372.421 3.661 20 5 FHBDRN O=[N+]([O-])c1ccc(CN(C2CC2)S(=O)(=O)c2ccc(Cl)cc2)cc1 ZINC000478345871 935616265 /nfs/dbraw/zinc/61/62/65/935616265.db2.gz SUSIMZNRHAKEKM-UHFFFAOYSA-N 0 0 366.826 3.602 20 5 FHBDRN CCCn1nccc1C1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2C)CC1 ZINC000375695951 935616495 /nfs/dbraw/zinc/61/64/95/935616495.db2.gz GCLXYFCHLZLLEO-UHFFFAOYSA-N 0 0 371.441 3.921 20 5 FHBDRN CC(C)CCn1ccc(=NC(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)[nH]1 ZINC000478402814 935620884 /nfs/dbraw/zinc/62/08/84/935620884.db2.gz UELISKQFKGFATO-UHFFFAOYSA-N 0 0 370.331 3.530 20 5 FHBDRN CC[C@@H](C[C@H](C)CO)NC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000478432015 935631935 /nfs/dbraw/zinc/63/19/35/935631935.db2.gz MFHYTFTWFPBZML-HOCLYGCPSA-N 0 0 371.437 3.865 20 5 FHBDRN NC(=O)c1cccc(NC[C@@H](Cc2ccccc2)C(F)(F)F)c1[N+](=O)[O-] ZINC000582393289 935633661 /nfs/dbraw/zinc/63/36/61/935633661.db2.gz WGLCRILZPOUXDR-GFCCVEGCSA-N 0 0 367.327 3.527 20 5 FHBDRN CO[C@H](c1ccc(Cl)cc1)[C@H](C)NC(=O)Cc1ccccc1[N+](=O)[O-] ZINC000127573883 935635532 /nfs/dbraw/zinc/63/55/32/935635532.db2.gz RGRKJJIUPPYSMT-SGTLLEGYSA-N 0 0 362.813 3.683 20 5 FHBDRN CCS[C@H]1CCCC[C@H]1NC(=O)c1cc(OC)c(C)c([N+](=O)[O-])c1 ZINC000478490699 935636180 /nfs/dbraw/zinc/63/61/80/935636180.db2.gz QHRDYOIAUGGTSH-CJNGLKHVSA-N 0 0 352.456 3.706 20 5 FHBDRN CC(C)(C(=O)Nc1nccn1Cc1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000431400042 935639137 /nfs/dbraw/zinc/63/91/37/935639137.db2.gz JPTJDMRCCSVIKK-UHFFFAOYSA-N 0 0 364.405 3.756 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)N(CC1CC1)C1CCC1 ZINC000478584982 935656114 /nfs/dbraw/zinc/65/61/14/935656114.db2.gz LGMPREBWPAQQPQ-UHFFFAOYSA-N 0 0 367.243 3.691 20 5 FHBDRN CN(C(=O)CCCc1nc(-c2cccs2)no1)c1cccc([N+](=O)[O-])c1 ZINC000158251822 935662794 /nfs/dbraw/zinc/66/27/94/935662794.db2.gz HIWNDOVBYOXJPF-UHFFFAOYSA-N 0 0 372.406 3.692 20 5 FHBDRN CC[C@H](CSC)N(C)C(=O)c1cc([N+](=O)[O-])ccc1Br ZINC000091220795 935672039 /nfs/dbraw/zinc/67/20/39/935672039.db2.gz DGSQQWLWFUOVAQ-SECBINFHSA-N 0 0 361.261 3.571 20 5 FHBDRN COCCOc1ccc(Cl)cc1C(=O)N(C)c1cccc([N+](=O)[O-])c1 ZINC000158274479 935677473 /nfs/dbraw/zinc/67/74/73/935677473.db2.gz KWAHLTWWIOKYEZ-UHFFFAOYSA-N 0 0 364.785 3.550 20 5 FHBDRN CC[C@H](CSC)N(C)C(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000091220813 935677895 /nfs/dbraw/zinc/67/78/95/935677895.db2.gz ZUBLZBVKSYYPKQ-SNVBAGLBSA-N 0 0 350.362 3.827 20 5 FHBDRN O=C(Cc1cccc([N+](=O)[O-])c1)N[C@H](CCc1ccccc1)C(F)(F)F ZINC000478692276 935678805 /nfs/dbraw/zinc/67/88/05/935678805.db2.gz YLZVHEDNYNGIOH-MRXNPFEDSA-N 0 0 366.339 3.817 20 5 FHBDRN COc1ccc([C@@H](NC(=O)Cc2cccc([N+](=O)[O-])c2C)C2CC2)cc1 ZINC000178576746 935678983 /nfs/dbraw/zinc/67/89/83/935678983.db2.gz SLIBINOKXOOEEH-FQEVSTJZSA-N 0 0 354.406 3.722 20 5 FHBDRN CCC1(CC)[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)C[C@@H]1OC ZINC000478705569 935682048 /nfs/dbraw/zinc/68/20/48/935682048.db2.gz UMDJWBMFQTVHIY-KBPBESRZSA-N 0 0 374.359 3.937 20 5 FHBDRN CC(C)(NC(=O)Nc1nnc(-c2ccco2)s1)c1ccc([N+](=O)[O-])cc1 ZINC000431409540 935689136 /nfs/dbraw/zinc/68/91/36/935689136.db2.gz HCNXGCPTLUXCFU-UHFFFAOYSA-N 0 0 373.394 3.763 20 5 FHBDRN Cn1cc(C(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)c2cc(F)ccc21 ZINC000432120443 945117270 /nfs/dbraw/zinc/11/72/70/945117270.db2.gz AAWRZBSTUUMQLN-UHFFFAOYSA-N 0 0 355.369 3.891 20 5 FHBDRN CC(C)(C)c1ncc(NC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)cn1 ZINC000431411469 935694000 /nfs/dbraw/zinc/69/40/00/935694000.db2.gz ZNWBUUFXFOPEMF-UHFFFAOYSA-N 0 0 357.414 3.739 20 5 FHBDRN CCOc1ccc(OCC)c(NC(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)c1 ZINC000478739663 935694022 /nfs/dbraw/zinc/69/40/22/935694022.db2.gz LHYYXLANYPSCBK-UHFFFAOYSA-N 0 0 374.393 3.962 20 5 FHBDRN CC(C)CCSc1ccc(C(=O)N(CCO)CC2CC2)cc1[N+](=O)[O-] ZINC000582434457 935698426 /nfs/dbraw/zinc/69/84/26/935698426.db2.gz WMYKEGIDQNVZFR-UHFFFAOYSA-N 0 0 366.483 3.578 20 5 FHBDRN O=c1c2sccc2c(Br)cn1Cc1ccc([N+](=O)[O-])cc1 ZINC000562050300 935705951 /nfs/dbraw/zinc/70/59/51/935705951.db2.gz YORJIYRZXVZEHH-UHFFFAOYSA-N 0 0 365.208 3.782 20 5 FHBDRN COc1ccc(NC(=O)CCSCCC(F)(F)F)c([N+](=O)[O-])c1 ZINC000478758066 935708119 /nfs/dbraw/zinc/70/81/19/935708119.db2.gz QSOPDDYXPBHYKE-UHFFFAOYSA-N 0 0 352.334 3.618 20 5 FHBDRN CCc1ccc(-c2noc(CN(C)CCc3ccccc3[N+](=O)[O-])n2)cc1 ZINC000511125311 935708439 /nfs/dbraw/zinc/70/84/39/935708439.db2.gz VVJRBEFTEVPSQI-UHFFFAOYSA-N 0 0 366.421 3.882 20 5 FHBDRN CCOc1ccc(C(=O)N[C@@H]2CCCOc3c(F)cccc32)cc1[N+](=O)[O-] ZINC000478772427 935715625 /nfs/dbraw/zinc/71/56/25/935715625.db2.gz QRMWUEQPRJOJRU-OAHLLOKOSA-N 0 0 374.368 3.776 20 5 FHBDRN C[C@H](NC(=O)N(C)CCOCc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000158325286 935726807 /nfs/dbraw/zinc/72/68/07/935726807.db2.gz FUQFYTRILOSWJG-HNNXBMFYSA-N 0 0 357.410 3.514 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1c(F)cccc1N1CCCC1 ZINC000277617582 935735020 /nfs/dbraw/zinc/73/50/20/935735020.db2.gz QMHUKTCYFPKRIY-UHFFFAOYSA-N 0 0 359.357 3.595 20 5 FHBDRN O=C1[C@H](Oc2cccc(Cl)c2F)CCN1c1cccc([N+](=O)[O-])c1 ZINC000478827434 935736015 /nfs/dbraw/zinc/73/60/15/935736015.db2.gz SNZXUIXGRPRPNM-CQSZACIVSA-N 0 0 350.733 3.572 20 5 FHBDRN O=C(NCC1(CCO)CCCC1)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000277620642 935737454 /nfs/dbraw/zinc/73/74/54/935737454.db2.gz AETYPQRPCCEDNO-UHFFFAOYSA-N 0 0 364.445 3.766 20 5 FHBDRN O=C([C@H]1C[C@H]1c1cc(F)ccc1F)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000161283636 935737755 /nfs/dbraw/zinc/73/77/55/935737755.db2.gz WYNGEPNNTJRTOS-HOCLYGCPSA-N 0 0 358.344 3.561 20 5 FHBDRN CN(C(=O)c1ccc(Br)c([N+](=O)[O-])c1)c1ccccc1F ZINC000050008564 935741863 /nfs/dbraw/zinc/74/18/63/935741863.db2.gz DHQYVHGLWKLSAG-UHFFFAOYSA-N 0 0 353.147 3.773 20 5 FHBDRN CCCn1c(CO)nnc1Sc1c(Cl)cc([N+](=O)[O-])cc1Cl ZINC000127696931 935742962 /nfs/dbraw/zinc/74/29/62/935742962.db2.gz MYKYKINRHMPKMK-UHFFFAOYSA-N 0 0 363.226 3.547 20 5 FHBDRN CCOc1cc(CCCNC(=O)c2cccc([N+](=O)[O-])c2C)ccc1OC ZINC000127699475 935745613 /nfs/dbraw/zinc/74/56/13/935745613.db2.gz FNFQXAZGAYFSQP-UHFFFAOYSA-N 0 0 372.421 3.673 20 5 FHBDRN C[C@H](c1ccc(Cl)c(Cl)c1)[S@@](=O)CCn1cc([N+](=O)[O-])cn1 ZINC000158851686 935754352 /nfs/dbraw/zinc/75/43/52/935754352.db2.gz HSDMBRUZNDJIDP-PVBMHHQDSA-N 0 0 362.238 3.608 20 5 FHBDRN COc1cc(C(=O)N2CCC[C@H]2CCC(C)C)c([N+](=O)[O-])cc1OC ZINC000158364606 935754609 /nfs/dbraw/zinc/75/46/09/935754609.db2.gz FZYZOMBYWVWKKY-ZDUSSCGKSA-N 0 0 350.415 3.653 20 5 FHBDRN Cc1ccc(CSc2ncn(CCOc3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000478926387 935757106 /nfs/dbraw/zinc/75/71/06/935757106.db2.gz DHMBMPNCKKQBMX-UHFFFAOYSA-N 0 0 370.434 3.866 20 5 FHBDRN Cc1c(CNC(=O)NCC(C)(C)c2ccccc2F)cccc1[N+](=O)[O-] ZINC000478958879 935764135 /nfs/dbraw/zinc/76/41/35/935764135.db2.gz KVQFUYHSQSVPBW-UHFFFAOYSA-N 0 0 359.401 3.819 20 5 FHBDRN COc1ccc(CCCN(C)C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000050153206 935788111 /nfs/dbraw/zinc/78/81/11/935788111.db2.gz IWLHVJMDBRJTLM-OAHLLOKOSA-N 0 0 371.437 3.939 20 5 FHBDRN CC1(C)[C@@H](c2ccccc2)[C@@H]1NC(=O)c1cc2nsnc2c([N+](=O)[O-])c1 ZINC001167580704 935792593 /nfs/dbraw/zinc/79/25/93/935792593.db2.gz PCSUFIIGZPCGTL-HOCLYGCPSA-N 0 0 368.418 3.522 20 5 FHBDRN O=C(Nc1ccc(F)nc1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000135111655 935793843 /nfs/dbraw/zinc/79/38/43/935793843.db2.gz ZYIVQBIYDXNMRU-UHFFFAOYSA-N 0 0 366.352 3.993 20 5 FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@H]2CCC[C@H]21 ZINC000159113134 935794984 /nfs/dbraw/zinc/79/49/84/935794984.db2.gz LAEUAFUSDBUNSF-CZUORRHYSA-N 0 0 364.467 3.738 20 5 FHBDRN COC(=O)c1cccc(NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1 ZINC000127792818 935803293 /nfs/dbraw/zinc/80/32/93/935803293.db2.gz VZTDCUXBBNIIAI-UHFFFAOYSA-N 0 0 369.377 3.578 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(N2CCC(c3nc4ccccc4[nH]3)CC2)n1 ZINC000611615625 935806318 /nfs/dbraw/zinc/80/63/18/935806318.db2.gz OMOIPLXIMAAXLT-UHFFFAOYSA-N 0 0 351.410 3.867 20 5 FHBDRN Cc1cc(C(=O)N2CCN(C3CC3)c3cc(F)ccc32)ccc1[N+](=O)[O-] ZINC000479158415 935810956 /nfs/dbraw/zinc/81/09/56/935810956.db2.gz HCEZBBCGIVCCPH-UHFFFAOYSA-N 0 0 355.369 3.672 20 5 FHBDRN COCCCOC1(Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)CCCC1 ZINC000479205651 935818881 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CN(Cc1c(F)cccc1Cl)C(=O)CSc1ncccc1[N+](=O)[O-] ZINC000127881420 935829407 /nfs/dbraw/zinc/82/94/07/935829407.db2.gz WLFIFFHTJPIQTN-UHFFFAOYSA-N 0 0 369.805 3.533 20 5 FHBDRN CCCN(C(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-])[C@@H]1CCCc2cccnc21 ZINC000479357840 935830628 /nfs/dbraw/zinc/83/06/28/935830628.db2.gz ZHIDOYBALBDYMS-CQSZACIVSA-N 0 0 371.441 3.766 20 5 FHBDRN C[C@@H](Nc1ccc(Br)cc1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000023864843 935835164 /nfs/dbraw/zinc/83/51/64/935835164.db2.gz OTNLORINXLSQBD-SNVBAGLBSA-N 0 0 364.199 3.796 20 5 FHBDRN C[C@@H](Sc1ncccc1[N+](=O)[O-])C(=O)Nc1cccc2ncccc21 ZINC000127909052 935836953 /nfs/dbraw/zinc/83/69/53/935836953.db2.gz IOGMVDZDAFUHQO-LLVKDONJSA-N 0 0 354.391 3.657 20 5 FHBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)N[C@H]1C[C@H](c2ccc(F)cc2)C1 ZINC000431457544 935849322 /nfs/dbraw/zinc/84/93/22/935849322.db2.gz JHQOOWSULRJGIK-JCNLHEQBSA-N 0 0 357.385 3.522 20 5 FHBDRN COc1ccc(NC(=O)NC[C@H]2CC[C@@H](c3ccccc3)O2)cc1[N+](=O)[O-] ZINC000562088431 935858493 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O=C(NC1(c2ccc(C(F)(F)F)cc2)CCC1)c1ccc([N+](=O)[O-])[nH]1 ZINC001167588830 935872160 /nfs/dbraw/zinc/87/21/60/935872160.db2.gz FXBYGNWAFJMWON-UHFFFAOYSA-N 0 0 353.300 3.751 20 5 FHBDRN CC[C@@H](c1ccncc1)N(C)C(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C ZINC000127979687 935872948 /nfs/dbraw/zinc/87/29/48/935872948.db2.gz SOFRQPSJBIUEHC-HNNXBMFYSA-N 0 0 372.381 3.738 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CC[C@@H](C)[C@H](n2ccnc2)C1 ZINC000120097149 935873237 /nfs/dbraw/zinc/87/32/37/935873237.db2.gz ZYIGWRYQHRYUOO-SJKOYZFVSA-N 0 0 357.414 3.523 20 5 FHBDRN CC[C@H](c1ccncc1)N(C)C(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C ZINC000127979898 935873310 /nfs/dbraw/zinc/87/33/10/935873310.db2.gz SOFRQPSJBIUEHC-OAHLLOKOSA-N 0 0 372.381 3.738 20 5 FHBDRN CCCCN(C(=O)CCn1cc([N+](=O)[O-])nc1C)[C@H](C)c1ccccc1 ZINC000127999949 935882593 /nfs/dbraw/zinc/88/25/93/935882593.db2.gz WVKVVBILOPGPNC-OAHLLOKOSA-N 0 0 358.442 3.880 20 5 FHBDRN COc1cccc(C(F)(F)CN[C@H](C)CCc2ccccc2[N+](=O)[O-])n1 ZINC000582624544 935884986 /nfs/dbraw/zinc/88/49/86/935884986.db2.gz MZNZNWRRBZXAAG-CYBMUJFWSA-N 0 0 365.380 3.701 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@]1(C)CCCC[C@@H]1O ZINC000507304160 945131397 /nfs/dbraw/zinc/13/13/97/945131397.db2.gz NYCCDKQULRUXLN-FUHWJXTLSA-N 0 0 366.483 3.768 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCCc3ccccc3C2)c(F)c1N1CCOCC1 ZINC000563420266 935889101 /nfs/dbraw/zinc/88/91/01/935889101.db2.gz CSWKJVQNJZOFCQ-UHFFFAOYSA-N 0 0 371.412 3.523 20 5 FHBDRN Cc1nn(C(C)(C)C)cc1[C@H](C)NC(=O)NCc1cccc([N+](=O)[O-])c1C ZINC000479782688 935889406 /nfs/dbraw/zinc/88/94/06/935889406.db2.gz ONAZBAPUJNMOCU-ZDUSSCGKSA-N 0 0 373.457 3.724 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)NCc1nc2cccc(Cl)c2n1C ZINC000479780375 935889912 /nfs/dbraw/zinc/88/99/12/935889912.db2.gz RNUHWOOUFMAOAS-UHFFFAOYSA-N 0 0 373.800 3.765 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@H](C)C1(c2ccccc2)CCCC1 ZINC000479780824 935889916 /nfs/dbraw/zinc/88/99/16/935889916.db2.gz SYQDJZQPBJOYPY-OAHLLOKOSA-N 0 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FHBDRN CCO[C@@H]1C[C@H](NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C12CCC2 ZINC000437246611 945177262 /nfs/dbraw/zinc/17/72/62/945177262.db2.gz WBELHHRAZUVVPL-UONOGXRCSA-N 0 0 372.343 3.691 20 5 FHBDRN CC(C)(CCC(=O)NCc1cc(Cl)ccc1Br)[N+](=O)[O-] ZINC000843616650 938470023 /nfs/dbraw/zinc/47/00/23/938470023.db2.gz YEELKXXFJWHJQS-UHFFFAOYSA-N 0 0 363.639 3.554 20 5 FHBDRN COc1ccc(NC(=O)[C@@H](C)Cc2cncc3ccccc32)c([N+](=O)[O-])c1 ZINC000583893294 938470073 /nfs/dbraw/zinc/47/00/73/938470073.db2.gz RHYDVOBKPKEZDP-ZDUSSCGKSA-N 0 0 365.389 3.969 20 5 FHBDRN CCNC(=O)Nc1ccc(C)c(NC(=O)Cc2cccc([N+](=O)[O-])c2C)c1 ZINC000278505212 938489695 /nfs/dbraw/zinc/48/96/95/938489695.db2.gz OCKWYKUXBZXVNW-UHFFFAOYSA-N 0 0 370.409 3.534 20 5 FHBDRN CC(C)(C)OC(=O)N1CC2(CC(Oc3c(F)cccc3[N+](=O)[O-])C2)C1 ZINC001226008023 945179830 /nfs/dbraw/zinc/17/98/30/945179830.db2.gz WRSLEQQAUZBKRM-UHFFFAOYSA-N 0 0 352.362 3.512 20 5 FHBDRN CN(Cc1cc(Br)ccc1Cl)C(=O)c1ccc([N+](=O)[O-])[nH]1 ZINC000427191510 945181280 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CN(C(=O)c1ccc(OCc2ccccc2)nc1)c1cccc([N+](=O)[O-])c1 ZINC000179024213 938556502 /nfs/dbraw/zinc/55/65/02/938556502.db2.gz BMKCZJJQSZTIAA-UHFFFAOYSA-N 0 0 363.373 3.845 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@H](C(C)C)C1 ZINC000507366897 945185633 /nfs/dbraw/zinc/18/56/33/945185633.db2.gz DLOCYLYDJCQHRG-OAHLLOKOSA-N 0 0 352.456 3.594 20 5 FHBDRN CC[C@]1(CO)CCCN1C(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000440024664 945185724 /nfs/dbraw/zinc/18/57/24/945185724.db2.gz HRYANPAGVOLSOV-HXUWFJFHSA-N 0 0 369.421 3.716 20 5 FHBDRN Cc1cccc(C)c1[C@@H](C)NC(=O)N1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000426210825 945186624 /nfs/dbraw/zinc/18/66/24/945186624.db2.gz OQSJSSWEQOLDIC-OAHLLOKOSA-N 0 0 371.441 3.516 20 5 FHBDRN COCCN(C(=O)NCCc1cccc([N+](=O)[O-])c1)[C@@H](C)c1ccccc1 ZINC000536207056 938580601 /nfs/dbraw/zinc/58/06/01/938580601.db2.gz ILQYSAFLZNZXPW-INIZCTEOSA-N 0 0 371.437 3.557 20 5 FHBDRN C[C@@H](C(=O)N[C@H](c1nccs1)C(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000584072285 938584432 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O=C(N[C@@H]1C[C@H]1c1c(F)cccc1F)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000437264130 945189099 /nfs/dbraw/zinc/18/90/99/945189099.db2.gz CVZSQTSYOUXHSP-ZWNOBZJWSA-N 0 0 357.316 3.640 20 5 FHBDRN C/C(=C/c1cccc([N+](=O)[O-])c1)CNc1ccc(C(N)=O)c(OC(C)C)c1 ZINC000437264530 945189319 /nfs/dbraw/zinc/18/93/19/945189319.db2.gz YONSQHKSRWTLMD-ZROIWOOFSA-N 0 0 369.421 3.996 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)Cc1cccc(N2CCCC2=O)c1 ZINC000278645099 938613007 /nfs/dbraw/zinc/61/30/07/938613007.db2.gz ZNNXPTOUJGXRII-UHFFFAOYSA-N 0 0 367.405 3.520 20 5 FHBDRN O=C(NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CCC[C@@H]2CCC[C@@H]21 ZINC000584146608 938616980 /nfs/dbraw/zinc/61/69/80/938616980.db2.gz SNJJPPJVCZZWHA-UGSOOPFHSA-N 0 0 356.426 3.593 20 5 FHBDRN O=[N+]([O-])c1ccc(OS(=O)(=O)c2cc(F)ccc2Cl)cc1Cl ZINC000728586065 938621506 /nfs/dbraw/zinc/62/15/06/938621506.db2.gz HQBCHJHMINDNNO-UHFFFAOYSA-N 0 0 366.153 3.808 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N1CCC(O)(c2ccccc2)CC1 ZINC000278674313 938638120 /nfs/dbraw/zinc/63/81/20/938638120.db2.gz OULOHJQJUZQWMG-UHFFFAOYSA-N 0 0 374.824 3.680 20 5 FHBDRN COc1cccc(CCc2nc(-c3ccc(C)c([N+](=O)[O-])c3)no2)c1F ZINC000584257455 938658535 /nfs/dbraw/zinc/65/85/35/938658535.db2.gz RLWYEPZAVSIUBK-UHFFFAOYSA-N 0 0 357.341 3.886 20 5 FHBDRN CCS[C@H]1CCC[C@H](Nc2nc(C)cc(C(=O)OC)c2[N+](=O)[O-])C1 ZINC000584249106 938658641 /nfs/dbraw/zinc/65/86/41/938658641.db2.gz ULHUJKDIPGRMKT-RYUDHWBXSA-N 0 0 353.444 3.561 20 5 FHBDRN CN(C(=O)CCc1cccc(OC2CCCC2)c1)c1ccc([N+](=O)[O-])nc1 ZINC000573163466 938661745 /nfs/dbraw/zinc/66/17/45/938661745.db2.gz JTSWCMNEAUPBPK-UHFFFAOYSA-N 0 0 369.421 3.907 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H](C(=O)OC(C)(C)C)C(C)C ZINC000573170577 938667206 /nfs/dbraw/zinc/66/72/06/938667206.db2.gz AUCMJFUXRDQDRP-OAHLLOKOSA-N 0 0 365.430 3.645 20 5 FHBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC(C)(CCOC)C1 ZINC000573173873 938670343 /nfs/dbraw/zinc/67/03/43/938670343.db2.gz YVYZDJVJDUZISL-UHFFFAOYSA-N 0 0 366.483 3.986 20 5 FHBDRN Cc1ccc([C@H](C)NS(=O)(=O)c2cc(Cl)ccc2[N+](=O)[O-])cc1 ZINC000725824552 938676693 /nfs/dbraw/zinc/67/66/93/938676693.db2.gz XIIZILFMAPGKMV-NSHDSACASA-N 0 0 354.815 3.596 20 5 FHBDRN Cc1ccc(NC(=O)c2ccc(NC[C@H](CO)C3CC3)c([N+](=O)[O-])c2)cc1 ZINC000584344195 938693749 /nfs/dbraw/zinc/69/37/49/938693749.db2.gz SVMINCYOTZDYAN-MRXNPFEDSA-N 0 0 369.421 3.586 20 5 FHBDRN CCc1c(NC(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)cnn1CC(C)C ZINC000611826327 938699596 /nfs/dbraw/zinc/69/95/96/938699596.db2.gz BORIENPNFORHLM-UHFFFAOYSA-N 0 0 361.402 3.662 20 5 FHBDRN Cc1cc(Oc2ccc(C(=O)Nc3cccnc3)cc2)ncc1[N+](=O)[O-] ZINC000074743585 938706775 /nfs/dbraw/zinc/70/67/75/938706775.db2.gz YWIGLKDQDBMFFU-UHFFFAOYSA-N 0 0 350.334 3.738 20 5 FHBDRN COc1ccc(NC(=O)NCc2cccc(OC(F)F)c2)cc1[N+](=O)[O-] ZINC000584371334 938716757 /nfs/dbraw/zinc/71/67/57/938716757.db2.gz BVFDFQLVIBSDJR-UHFFFAOYSA-N 0 0 367.308 3.527 20 5 FHBDRN CCOc1ccc(C(=O)N[C@@H]2CCCC[C@@H]2SCC)cc1[N+](=O)[O-] ZINC000427225225 945200032 /nfs/dbraw/zinc/20/00/32/945200032.db2.gz FOKSMJJVUGXZFE-CJNGLKHVSA-N 0 0 352.456 3.788 20 5 FHBDRN Cn1ncc([N+](=O)[O-])c1C(=O)N[C@@H](c1cccc(Cl)c1)C1CCCC1 ZINC000128162916 938788804 /nfs/dbraw/zinc/78/88/04/938788804.db2.gz DKTUFSYTEKKMSZ-OAHLLOKOSA-N 0 0 362.817 3.643 20 5 FHBDRN CCOc1cccc(N2CCc3cc(OC)c(OC)cc3C2)c1[N+](=O)[O-] ZINC000302077681 938794917 /nfs/dbraw/zinc/79/49/17/938794917.db2.gz AMWFNCBUVBKMQL-UHFFFAOYSA-N 0 0 358.394 3.573 20 5 FHBDRN Cc1c(CC(=O)Nc2ccc(OC(F)(F)F)cc2)cccc1[N+](=O)[O-] ZINC000158819200 938807612 /nfs/dbraw/zinc/80/76/12/938807612.db2.gz XNPWAUNOHOEXFV-UHFFFAOYSA-N 0 0 354.284 3.983 20 5 FHBDRN Nc1c(C(=O)N2CC=C(c3ccc(Cl)cc3)CC2)cccc1[N+](=O)[O-] ZINC000083007562 938808235 /nfs/dbraw/zinc/80/82/35/938808235.db2.gz SHLVFTUTTRHJNU-UHFFFAOYSA-N 0 0 357.797 3.760 20 5 FHBDRN CCCCC[C@H]1CCCN1C(=O)c1nnn(-c2cccc([N+](=O)[O-])c2)c1C ZINC000427212623 945205585 /nfs/dbraw/zinc/20/55/85/945205585.db2.gz MMMJUTGPQPKUEU-HNNXBMFYSA-N 0 0 371.441 3.669 20 5 FHBDRN CC(C)[C@@H]1C[C@H](NC(=O)CCc2c(Cl)cccc2[N+](=O)[O-])CCO1 ZINC000935224988 938816960 /nfs/dbraw/zinc/81/69/60/938816960.db2.gz DKSCAIMQPCBVPI-WBMJQRKESA-N 0 0 354.834 3.501 20 5 FHBDRN CCOc1cc(CNc2cc(F)cc(C(=O)OC)c2F)ccc1[N+](=O)[O-] ZINC000480301746 938824397 /nfs/dbraw/zinc/82/43/97/938824397.db2.gz QPTQYOZWJAKKKB-UHFFFAOYSA-N 0 0 366.320 3.670 20 5 FHBDRN Cc1n[nH]c(C(=O)NC(c2cccc(C)c2)c2cccc(C)c2)c1[N+](=O)[O-] ZINC000084367485 938828324 /nfs/dbraw/zinc/82/83/24/938828324.db2.gz KRTLTZUCRHOZJI-UHFFFAOYSA-N 0 0 364.405 3.763 20 5 FHBDRN C[C@@H]1CCCCCN1C(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000087296421 938850443 /nfs/dbraw/zinc/85/04/43/938850443.db2.gz AUSNFWCAKNTJGY-LLVKDONJSA-N 0 0 355.232 3.691 20 5 FHBDRN COc1cc(NC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])c(OC)cc1Cl ZINC000065668498 938861387 /nfs/dbraw/zinc/86/13/87/938861387.db2.gz MEEFDRQLPKCHON-UHFFFAOYSA-N 0 0 372.711 3.796 20 5 FHBDRN COCCn1cc2c(n1)[C@H](Nc1c(Cl)cccc1[N+](=O)[O-])CCC2 ZINC000432155558 945210758 /nfs/dbraw/zinc/21/07/58/945210758.db2.gz GAPFDLXUMCOQPR-CYBMUJFWSA-N 0 0 350.806 3.581 20 5 FHBDRN O=C(c1ccc(Cl)nc1Cl)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000162227072 938895296 /nfs/dbraw/zinc/89/52/96/938895296.db2.gz ALNGXGIFQWZVAK-UHFFFAOYSA-N 0 0 352.177 3.890 20 5 FHBDRN CC[C@@H](OC(=O)CCNc1ccccc1[N+](=O)[O-])c1cccc([N+](=O)[O-])c1 ZINC001267374320 938897986 /nfs/dbraw/zinc/89/79/86/938897986.db2.gz JYXQRZHKPRMMAV-QGZVFWFLSA-N 0 0 373.365 4.000 20 5 FHBDRN COc1ccc(COCc2noc(/C=C\c3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000573259722 938905076 /nfs/dbraw/zinc/90/50/76/938905076.db2.gz KPWHBJOFMNNISW-WDZFZDKYSA-N 0 0 367.361 3.874 20 5 FHBDRN C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CC(C)(C)[C@H]1[C@@H]1CCCO1 ZINC000289966363 938920205 /nfs/dbraw/zinc/92/02/05/938920205.db2.gz WYTMIAZBIWFMSB-UHOFOFEASA-N 0 0 372.425 3.595 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NCc1cccc2c1OCCCO2 ZINC000092765648 938921431 /nfs/dbraw/zinc/92/14/31/938921431.db2.gz QLEGXFUOUNIWCJ-UHFFFAOYSA-N 0 0 370.405 3.611 20 5 FHBDRN Cc1ccc(CN(C)Cc2nc([C@H](C)OCC(C)C)no2)cc1[N+](=O)[O-] ZINC000093885692 938931439 /nfs/dbraw/zinc/93/14/39/938931439.db2.gz UXJHRQKASWDHAG-AWEZNQCLSA-N 0 0 362.430 3.652 20 5 FHBDRN CC(=O)Nc1ccc(F)c(NC(=O)c2c(C)cc(C)c([N+](=O)[O-])c2C)c1 ZINC000093923126 938932042 /nfs/dbraw/zinc/93/20/42/938932042.db2.gz DNMBBIMKFBUGFB-UHFFFAOYSA-N 0 0 359.357 3.870 20 5 FHBDRN Cc1c(C(=O)NC2CCC(C(=O)OC(C)(C)C)CC2)cccc1[N+](=O)[O-] ZINC000094123499 938935120 /nfs/dbraw/zinc/93/51/20/938935120.db2.gz KKLWTUWVGZFGGL-UHFFFAOYSA-N 0 0 362.426 3.534 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@H](C)c1cc2ccccc2o1 ZINC000065685173 938937145 /nfs/dbraw/zinc/93/71/45/938937145.db2.gz NPHDVFJMIBOWBW-GFCCVEGCSA-N 0 0 374.418 3.943 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC[C@H]1c1ccccc1 ZINC000065685350 938939087 /nfs/dbraw/zinc/93/90/87/938939087.db2.gz UZKWFSGZBPYRAW-KRWDZBQOSA-N 0 0 360.435 3.683 20 5 FHBDRN Cc1ncc2c(n1)CCN(Cc1ccc(-c3ccccc3[N+](=O)[O-])o1)C2 ZINC000139727975 938943543 /nfs/dbraw/zinc/94/35/43/938943543.db2.gz AGHOZETXXSMSMO-UHFFFAOYSA-N 0 0 350.378 3.512 20 5 FHBDRN CC(C)(NS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccc(F)cc1 ZINC000728591643 938957324 /nfs/dbraw/zinc/95/73/24/938957324.db2.gz HPLVYSNQCKVKOK-UHFFFAOYSA-N 0 0 372.805 3.601 20 5 FHBDRN CCc1cccnc1NC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000506020019 945218666 /nfs/dbraw/zinc/21/86/66/945218666.db2.gz ROEYQGFCXLPQBP-UHFFFAOYSA-N 0 0 350.172 3.567 20 5 FHBDRN Cc1c(NC(=O)c2cccc([N+](=O)[O-])c2)cnn1-c1cc(C)ccc1C ZINC000151915204 938964487 /nfs/dbraw/zinc/96/44/87/938964487.db2.gz BPHPYLUUIYQKII-UHFFFAOYSA-N 0 0 350.378 3.958 20 5 FHBDRN CC(C)(C)CC(C)(C)NC(=O)COc1ccc([N+](=O)[O-])c2cccnc12 ZINC000431560682 938968499 /nfs/dbraw/zinc/96/84/99/938968499.db2.gz ZTBWLLKYDCPMAN-UHFFFAOYSA-N 0 0 359.426 3.853 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1N1CCC(N3CCc4ccccc43)CC1)CCN2 ZINC000409638947 938978899 /nfs/dbraw/zinc/97/88/99/938978899.db2.gz NNHWWVZAXZCQOY-UHFFFAOYSA-N 0 0 364.449 3.594 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CC[C@@H]1c1ccc(Cl)cc1 ZINC000511277186 938979909 /nfs/dbraw/zinc/97/99/09/938979909.db2.gz QHLGGNUCZPCGHP-OAHLLOKOSA-N 0 0 366.826 3.692 20 5 FHBDRN O=[N+]([O-])c1cc(F)cc(OS(=O)(=O)c2ccccc2C(F)(F)F)c1 ZINC000135601831 938980174 /nfs/dbraw/zinc/98/01/74/938980174.db2.gz RUEOFJSVKOVBMD-UHFFFAOYSA-N 0 0 365.260 3.520 20 5 FHBDRN O=C(NCc1ccc(OC2CCCCC2)nc1)c1c(F)cccc1[N+](=O)[O-] ZINC001125736139 938987106 /nfs/dbraw/zinc/98/71/06/938987106.db2.gz CCRBEUUVEKLTLD-UHFFFAOYSA-N 0 0 373.384 3.770 20 5 FHBDRN Cn1nnc2ccc(C(=O)Oc3ccc(-c4ccccc4)cc3[N+](=O)[O-])cc21 ZINC000755636563 938987327 /nfs/dbraw/zinc/98/73/27/938987327.db2.gz FFRCUYZAHSLPRP-UHFFFAOYSA-N 0 0 374.356 3.763 20 5 FHBDRN O=C(Nc1cc2c(cc1[N+](=O)[O-])OCCCO2)C1(Cc2ccccc2)CC1 ZINC000176896793 938987630 /nfs/dbraw/zinc/98/76/30/938987630.db2.gz GMCVSZDEYAZHLE-UHFFFAOYSA-N 0 0 368.389 3.718 20 5 FHBDRN O=C(COc1cccc([N+](=O)[O-])c1)N1CCC[C@H]1Cc1ccccc1Cl ZINC000065696962 938990324 /nfs/dbraw/zinc/99/03/24/938990324.db2.gz DGZHSRNWLQBJIF-HNNXBMFYSA-N 0 0 374.824 3.861 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(F)c(C(=O)Nc2ccc(OCC(C)C)nc2)c1F ZINC000828023712 938990613 /nfs/dbraw/zinc/99/06/13/938990613.db2.gz WLZZGNYSZBQTTC-UHFFFAOYSA-N 0 0 365.336 3.864 20 5 FHBDRN O=[N+]([O-])c1cnc(NCCc2csc(-c3ccc(Cl)cc3)n2)s1 ZINC000409713501 938992396 /nfs/dbraw/zinc/99/23/96/938992396.db2.gz CYKDTPIQHHAELL-UHFFFAOYSA-N 0 0 366.855 3.905 20 5 FHBDRN O=C(Nc1ccc(O[C@H]2CCOC2)cc1)c1cccc(Cl)c1[N+](=O)[O-] ZINC000176905904 938993088 /nfs/dbraw/zinc/99/30/88/938993088.db2.gz BZJFQWNZLRPEJD-ZDUSSCGKSA-N 0 0 362.769 3.668 20 5 FHBDRN CN(Cc1ccc(OC(F)(F)F)cc1)C(=O)c1cc(F)cc([N+](=O)[O-])c1 ZINC000609441254 938993714 /nfs/dbraw/zinc/99/37/14/938993714.db2.gz BZQYSPGRXKULBJ-UHFFFAOYSA-N 0 0 372.274 3.905 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2ccc(CNc3ccc(OC(F)F)cn3)o2)cc1 ZINC000427245770 945220364 /nfs/dbraw/zinc/22/03/64/945220364.db2.gz JHJSWZPDVJXQPL-UHFFFAOYSA-N 0 0 361.304 3.885 20 5 FHBDRN Cc1c(NC(=O)[C@H](C)N2CC[C@@H](CC(F)(F)F)C2)cccc1[N+](=O)[O-] ZINC000278781154 938995091 /nfs/dbraw/zinc/99/50/91/938995091.db2.gz NOZWZAULEFEUJS-RYUDHWBXSA-N 0 0 359.348 3.505 20 5 FHBDRN O=C(CNc1ccc(F)c([N+](=O)[O-])c1)Nc1ccc(C(F)(F)F)cc1 ZINC000007972841 938995217 /nfs/dbraw/zinc/99/52/17/938995217.db2.gz QQXFOTLIIQNGBO-UHFFFAOYSA-N 0 0 357.263 3.803 20 5 FHBDRN CN(Cc1cccc(Cl)c1)C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000065716621 938996747 /nfs/dbraw/zinc/99/67/47/938996747.db2.gz CMMNNYZNQIGRGZ-UHFFFAOYSA-N 0 0 357.797 3.862 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)Nc1nc2ccccc2s1 ZINC000065712111 938997158 /nfs/dbraw/zinc/99/71/58/938997158.db2.gz YTSWHTXUJDJRTB-UHFFFAOYSA-N 0 0 352.375 3.798 20 5 FHBDRN CCCCCc1nnc(NC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)s1 ZINC000065715152 938997245 /nfs/dbraw/zinc/99/72/45/938997245.db2.gz GEQYRBKVTGTAQY-UHFFFAOYSA-N 0 0 373.438 3.772 20 5 FHBDRN O=C(c1ncoc1-c1ccc(F)cc1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000472339140 938998049 /nfs/dbraw/zinc/99/80/49/938998049.db2.gz NFVSPCULRIVCAP-UHFFFAOYSA-N 0 0 367.336 3.587 20 5 FHBDRN CCOc1ccc([C@H](C)NC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)cc1 ZINC000065721611 939006534 /nfs/dbraw/zinc/00/65/34/939006534.db2.gz QJEIPUJJBSNROC-AWEZNQCLSA-N 0 0 367.405 3.826 20 5 FHBDRN COC(=O)c1cc(NC(=O)c2cc3cc(F)ccc3o2)cc([N+](=O)[O-])c1 ZINC000136151905 939008666 /nfs/dbraw/zinc/00/86/66/939008666.db2.gz IWLDQZHIAQKDTO-UHFFFAOYSA-N 0 0 358.281 3.519 20 5 FHBDRN COc1ccc(COCC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc1 ZINC000056288653 939010627 /nfs/dbraw/zinc/01/06/27/939010627.db2.gz DWDLFPQOJLOJJZ-UHFFFAOYSA-N 0 0 372.421 3.557 20 5 FHBDRN CC(C)CN(CC(F)(F)F)C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000065733210 939017863 /nfs/dbraw/zinc/01/78/63/939017863.db2.gz SHHKUUFLPGMACP-UHFFFAOYSA-N 0 0 357.332 3.596 20 5 FHBDRN COc1ccc(F)cc1[C@H](C)NC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000065734690 939018398 /nfs/dbraw/zinc/01/83/98/939018398.db2.gz ZDBGHEUCWDKNBY-LBPRGKRZSA-N 0 0 371.368 3.575 20 5 FHBDRN O=[N+]([O-])c1ccc(Nc2cnn(Cc3ccccn3)c2)cc1C(F)(F)F ZINC000179259261 939020648 /nfs/dbraw/zinc/02/06/48/939020648.db2.gz LDVCWOHQTCLAHX-UHFFFAOYSA-N 0 0 363.299 3.997 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)N[C@H]2CCOc3c(F)cccc32)cc1[N+](=O)[O-] ZINC000188168928 939021432 /nfs/dbraw/zinc/02/14/32/939021432.db2.gz MHFADTNRMBSDFJ-WBMJQRKESA-N 0 0 373.384 3.926 20 5 FHBDRN O=C(/C=C\c1ccc2c(c1)OCO2)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000255672745 939080617 /nfs/dbraw/zinc/08/06/17/939080617.db2.gz VHCYGYMDJDUYNL-UITAMQMPSA-N 0 0 366.373 3.528 20 5 FHBDRN CN(Cc1cc([N+](=O)[O-])ccc1OC(F)F)Cc1ccccc1[N+](=O)[O-] ZINC000179316818 939080776 /nfs/dbraw/zinc/08/07/76/939080776.db2.gz NVTZKDJURATASO-UHFFFAOYSA-N 0 0 367.308 3.736 20 5 FHBDRN Cc1[nH]nc(C(=O)Nc2cccc(COc3ccccc3)c2C)c1[N+](=O)[O-] ZINC000472362690 939093588 /nfs/dbraw/zinc/09/35/88/939093588.db2.gz JBMPGKSRGJRXJA-UHFFFAOYSA-N 0 0 366.377 3.766 20 5 FHBDRN Cc1cc(C(=O)N(C)CCc2ccccc2[N+](=O)[O-])c(C(F)(F)F)o1 ZINC000518232483 945227351 /nfs/dbraw/zinc/22/73/51/945227351.db2.gz VQQAUDJAVNNBNA-UHFFFAOYSA-N 0 0 356.300 3.830 20 5 FHBDRN COc1ccc(OC(=O)/C=C\c2ccnc3ccccc23)c([N+](=O)[O-])c1 ZINC000255684517 939105968 /nfs/dbraw/zinc/10/59/68/939105968.db2.gz JORPRHPXIIKNIE-TWGQIWQCSA-N 0 0 350.330 3.770 20 5 FHBDRN COc1cc(C(=O)Nc2cnn(-c3ccc(C)cc3C)c2)ccc1[N+](=O)[O-] ZINC000188265240 939126029 /nfs/dbraw/zinc/12/60/29/939126029.db2.gz SMLOWZWAFFWIKK-UHFFFAOYSA-N 0 0 366.377 3.658 20 5 FHBDRN COC[C@H](C)N(C)Cc1cc(OC)c(OCc2ccccc2)cc1[N+](=O)[O-] ZINC000179373390 939127787 /nfs/dbraw/zinc/12/77/87/939127787.db2.gz LDNDWZXJJSEEHS-HNNXBMFYSA-N 0 0 374.437 3.649 20 5 FHBDRN Cc1ccc2oc(C(=O)N(Cc3ccc([N+](=O)[O-])cc3)C3CC3)cc2n1 ZINC000179381439 939132432 /nfs/dbraw/zinc/13/24/32/939132432.db2.gz ZCJRJKVUUNJLIH-UHFFFAOYSA-N 0 0 351.362 3.849 20 5 FHBDRN CSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H](C)c1nc(C)cs1 ZINC000935372330 939144539 /nfs/dbraw/zinc/14/45/39/939144539.db2.gz UFPTZYVWTFTQMJ-VIFPVBQESA-N 0 0 351.453 3.615 20 5 FHBDRN CC(C)(C)c1ccc([C@@H]2CCCN2C(=O)CCn2cc([N+](=O)[O-])cn2)cc1 ZINC000065787408 939152192 /nfs/dbraw/zinc/15/21/92/939152192.db2.gz SSUVYHCZIRINOC-SFHVURJKSA-N 0 0 370.453 3.843 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](c1cccc(C)c1)C(F)(F)F ZINC000511829826 945234401 /nfs/dbraw/zinc/23/44/01/945234401.db2.gz XBPUCYBRUPIPKJ-HNNXBMFYSA-N 0 0 368.311 3.945 20 5 FHBDRN O=C(C=Cc1ccc([N+](=O)[O-])cc1)N1CCC[C@H]1CC(=O)c1ccccc1 ZINC000255765096 939175944 /nfs/dbraw/zinc/17/59/44/939175944.db2.gz BALSVPSHKDKPPU-XGCMIMOYSA-N 0 0 364.401 3.872 20 5 FHBDRN COc1cc(NC(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)c(C)c(OC)c1 ZINC000548878880 939181997 /nfs/dbraw/zinc/18/19/97/939181997.db2.gz WAMPNEXLYOJPOM-UHFFFAOYSA-N 0 0 371.393 3.511 20 5 FHBDRN O=C(NCc1ccn(-c2ccccc2)n1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000124328796 945233773 /nfs/dbraw/zinc/23/37/73/945233773.db2.gz PECXFEIVCZVRFV-UHFFFAOYSA-N 0 0 371.784 3.756 20 5 FHBDRN CC(C)(CNC(=O)c1ccc([N+](=O)[O-])cc1Br)C(F)(F)F ZINC000548890768 939200197 /nfs/dbraw/zinc/20/01/97/939200197.db2.gz QCFWVIHCVHHUHS-UHFFFAOYSA-N 0 0 369.137 3.676 20 5 FHBDRN Cc1cc(NC(=O)/C=C\c2cnc(C)s2)n(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000255773660 939204101 /nfs/dbraw/zinc/20/41/01/939204101.db2.gz NPYJYEUQYCUUNC-FPLPWBNLSA-N 0 0 369.406 3.506 20 5 FHBDRN COc1ccc(C(=O)Nc2cccc([N+](=O)[O-])c2C)c(OC(F)F)c1 ZINC000188357167 939213499 /nfs/dbraw/zinc/21/34/99/939213499.db2.gz KRNUYWVHXVAKLS-UHFFFAOYSA-N 0 0 352.293 3.766 20 5 FHBDRN CCN(C(=O)Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1)c1ccccc1 ZINC000540856561 939219418 /nfs/dbraw/zinc/21/94/18/939219418.db2.gz VGXXVAVJPNANJQ-UHFFFAOYSA-N 0 0 350.378 3.511 20 5 FHBDRN C/C(=C/C(=O)NCc1ncc(-c2ccccc2)o1)c1ccc([N+](=O)[O-])cc1 ZINC000785232976 939222542 /nfs/dbraw/zinc/22/25/42/939222542.db2.gz PXZDGQIWALPNFQ-KAMYIIQDSA-N 0 0 363.373 3.970 20 5 FHBDRN O=C(c1ccc(NC2CC2)c([N+](=O)[O-])c1)N1CC2C[C@@H]3CC1C[C@H](C2)C3 ZINC000065814368 939225094 /nfs/dbraw/zinc/22/50/94/939225094.db2.gz RKCHDBQJHBOTBO-HFZWIWRYSA-N 0 0 355.438 3.820 20 5 FHBDRN Cc1ccc(NC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)c(C)c1 ZINC000110154845 939225473 /nfs/dbraw/zinc/22/54/73/939225473.db2.gz ODCRHCIYULYELG-AWEZNQCLSA-N 0 0 373.434 3.516 20 5 FHBDRN COc1ccc(C(=O)N(C)c2ccc([N+](=O)[O-])cc2)c(OCC(C)C)c1 ZINC000188396056 939225642 /nfs/dbraw/zinc/22/56/42/939225642.db2.gz IHBBQYBEFZYXDO-UHFFFAOYSA-N 0 0 358.394 3.915 20 5 FHBDRN O=C(COC(=O)c1coc2ccc(Cl)cc12)Nc1cccc([N+](=O)[O-])c1 ZINC001125790319 939228005 /nfs/dbraw/zinc/22/80/05/939228005.db2.gz BWGZHLRTZQDZTK-UHFFFAOYSA-N 0 0 374.736 3.790 20 5 FHBDRN COc1ccc(F)cc1CNC(=O)c1c(C)cc(Cl)cc1[N+](=O)[O-] ZINC000438933197 945237155 /nfs/dbraw/zinc/23/71/55/945237155.db2.gz DEWXNQXNDBSSOP-UHFFFAOYSA-N 0 0 352.749 3.634 20 5 FHBDRN CC(C)(CNC(=O)CCCNc1ccc([N+](=O)[O-])cc1)c1cccs1 ZINC000511831991 945243257 /nfs/dbraw/zinc/24/32/57/945243257.db2.gz LYDVJJHYZIFDDI-UHFFFAOYSA-N 0 0 361.467 3.942 20 5 FHBDRN CCn1ncc(C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)c1-c1ccccc1 ZINC000427274042 945244862 /nfs/dbraw/zinc/24/48/62/945244862.db2.gz OJQYSJYSGGBPNL-CQSZACIVSA-N 0 0 364.405 3.969 20 5 FHBDRN Cc1c(CC(=O)N[C@H](C)[C@@H]2Oc3ccccc3[C@H]2C)cccc1[N+](=O)[O-] ZINC000438940680 945245918 /nfs/dbraw/zinc/24/59/18/945245918.db2.gz JCNMNRDAONIHOO-ARGWCVDVSA-N 0 0 354.406 3.515 20 5 FHBDRN O=C1CCN1c1cccc(-c2noc(-c3ccc(Cl)cc3[N+](=O)[O-])n2)c1 ZINC000438927127 945246756 /nfs/dbraw/zinc/24/67/56/945246756.db2.gz PNMNFUQNYUSEHO-UHFFFAOYSA-N 0 0 370.752 3.702 20 5 FHBDRN Cc1c(CNC(=O)NC(C)(C)COCc2ccccc2)cccc1[N+](=O)[O-] ZINC000507454991 945246795 /nfs/dbraw/zinc/24/67/95/945246795.db2.gz FROJYIDSSBKBJF-UHFFFAOYSA-N 0 0 371.437 3.698 20 5 FHBDRN Cc1cc([C@@H](C)NS(=O)(=O)c2ccc(C)cc2[N+](=O)[O-])c(C)s1 ZINC000507455531 945247952 /nfs/dbraw/zinc/24/79/52/945247952.db2.gz MVFLEOBGBAXQFH-LLVKDONJSA-N 0 0 354.453 3.621 20 5 FHBDRN C[C@@](CO)(CNc1ccnc2c1cccc2[N+](=O)[O-])Cc1ccccc1 ZINC000432172088 945252746 /nfs/dbraw/zinc/25/27/46/945252746.db2.gz JWAFLETUBXSNAT-FQEVSTJZSA-N 0 0 351.406 3.796 20 5 FHBDRN CC(C)c1nn(C)cc1-c1noc(/C=C\c2ccc(F)cc2[N+](=O)[O-])n1 ZINC000426241190 945256254 /nfs/dbraw/zinc/25/62/54/945256254.db2.gz CCCMNKZSIMLLIA-ALCCZGGFSA-N 0 0 357.345 3.811 20 5 FHBDRN CC(C)c1ccc(C(=O)N[C@@H](C)c2ccc([S@@](C)=O)cc2)cc1[N+](=O)[O-] ZINC000438951876 945258780 /nfs/dbraw/zinc/25/87/80/945258780.db2.gz WKGRDIDEXBKZAV-WHDAMIPWSA-N 0 0 374.462 3.947 20 5 FHBDRN O=[N+]([O-])c1ccc2nc(NCCc3cccc(C(F)(F)F)n3)ccc2c1 ZINC000432176583 945260748 /nfs/dbraw/zinc/26/07/48/945260748.db2.gz MIMALUQIONSQJP-UHFFFAOYSA-N 0 0 362.311 3.633 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)Nc1cccc2c1OCCC2=O ZINC000438952872 945260824 /nfs/dbraw/zinc/26/08/24/945260824.db2.gz NRCIWWWAFZTLEP-UHFFFAOYSA-N 0 0 360.753 3.774 20 5 FHBDRN Cc1c(CC(=O)N2CCc3c(F)cc(F)cc3[C@@H]2C)cccc1[N+](=O)[O-] ZINC000438942827 945266453 /nfs/dbraw/zinc/26/64/53/945266453.db2.gz SCXKPVDZXZUMDQ-LBPRGKRZSA-N 0 0 360.360 3.870 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1CCN(C2CC2)c2c(C)cccc21 ZINC000427318112 945268664 /nfs/dbraw/zinc/26/86/64/945268664.db2.gz ZRJRKUOJGBDGDD-UHFFFAOYSA-N 0 0 367.405 3.541 20 5 FHBDRN COCCOc1cccc(CNC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)c1 ZINC000438960611 945268710 /nfs/dbraw/zinc/26/87/10/945268710.db2.gz CGHIXKCBURMPIL-UHFFFAOYSA-N 0 0 372.421 3.673 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)N1CCS[C@H]2CCCC[C@@H]21 ZINC000438961892 945269649 /nfs/dbraw/zinc/26/96/49/945269649.db2.gz KQZKOWGWTABILZ-IRXDYDNUSA-N 0 0 363.483 3.674 20 5 FHBDRN CCc1nn(C)cc1-c1noc([C@H](C)Sc2ccc([N+](=O)[O-])cc2)n1 ZINC000426584754 945275869 /nfs/dbraw/zinc/27/58/69/945275869.db2.gz AMFYSKMEPVTELF-JTQLQIEISA-N 0 0 359.411 3.794 20 5 FHBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N1CCC=Cc2ccccc21 ZINC000188406721 939875740 /nfs/dbraw/zinc/87/57/40/939875740.db2.gz QDYHBDHQBQWAEW-UHFFFAOYSA-N 0 0 364.810 3.860 20 5 FHBDRN C[C@@H]1CN(C(=O)/C=C\c2ccc([N+](=O)[O-])cc2)C[C@@H](c2ccc(F)cc2)O1 ZINC000255806398 939882097 /nfs/dbraw/zinc/88/20/97/939882097.db2.gz JKRUSIWRNAOWAN-DEQGRDCQSA-N 0 0 370.380 3.736 20 5 FHBDRN CCc1nccn1[C@H]1CCCN(C(=O)c2c(C)cc(C)c([N+](=O)[O-])c2C)C1 ZINC000179551844 939884315 /nfs/dbraw/zinc/88/43/15/939884315.db2.gz FGYRKUVHYYDHLV-INIZCTEOSA-N 0 0 370.453 3.756 20 5 FHBDRN CCc1ncsc1C(=O)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC000091963480 939889849 /nfs/dbraw/zinc/88/98/49/939889849.db2.gz JVVLFGYEQJHCNC-UHFFFAOYSA-N 0 0 356.201 3.629 20 5 FHBDRN CCn1c2ccccc2nc1[C@@H](C)NC(=O)/C=C/c1ccc([N+](=O)[O-])cc1 ZINC000065825623 939890433 /nfs/dbraw/zinc/89/04/33/939890433.db2.gz HIQVXFMUKOBOSH-JWAFFJSPSA-N 0 0 364.405 3.855 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(F)cc1OCC(F)F ZINC000179607503 939893842 /nfs/dbraw/zinc/89/38/42/939893842.db2.gz LUSCLZQHEUHVGH-UHFFFAOYSA-N 0 0 370.283 3.639 20 5 FHBDRN Cc1ccc(O)c(NC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000179609586 939893872 /nfs/dbraw/zinc/89/38/72/939893872.db2.gz WIHQIPNXVNHAHZ-UHFFFAOYSA-N 0 0 350.758 3.670 20 5 FHBDRN C[C@@H](C(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1)n1cnc2ccccc21 ZINC000179616870 939895992 /nfs/dbraw/zinc/89/59/92/939895992.db2.gz LKVNFHVNMOOLBD-AWEZNQCLSA-N 0 0 364.405 3.697 20 5 FHBDRN CSCc1cccc(CNc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])c1 ZINC000188480077 939904327 /nfs/dbraw/zinc/90/43/27/939904327.db2.gz ULIZPFIVNSRQEW-UHFFFAOYSA-N 0 0 371.462 3.962 20 5 FHBDRN CCc1n[nH]c(C(=O)N(Cc2cccc(Cl)c2)C(C)C)c1[N+](=O)[O-] ZINC000188483847 939905631 /nfs/dbraw/zinc/90/56/31/939905631.db2.gz VSQKXSFWHVTXMO-UHFFFAOYSA-N 0 0 350.806 3.585 20 5 FHBDRN CC(C)Oc1cccc([C@H](C)[NH2+]CC(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000179666532 939912657 /nfs/dbraw/zinc/91/26/57/939912657.db2.gz MKDZQWAXPNOBNK-AWEZNQCLSA-N 0 0 357.410 3.671 20 5 FHBDRN Cn1c(C(=O)Nc2cccc(Cl)c2Br)ccc1[N+](=O)[O-] ZINC000236081121 939916390 /nfs/dbraw/zinc/91/63/90/939916390.db2.gz HINUFOTZLSZFFV-UHFFFAOYSA-N 0 0 358.579 3.602 20 5 FHBDRN COc1ccc(-c2noc(Cc3c[nH]c4ccc([N+](=O)[O-])cc34)n2)cc1 ZINC000136351391 939923383 /nfs/dbraw/zinc/92/33/83/939923383.db2.gz HOQFQBZOUDAYHU-UHFFFAOYSA-N 0 0 350.334 3.726 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)N(C)Cc2cccc(N(C)C)c2)cc1[N+](=O)[O-] ZINC000151353501 945282564 /nfs/dbraw/zinc/28/25/64/945282564.db2.gz XFNINOSUVZEFJH-HNNXBMFYSA-N 0 0 370.453 3.872 20 5 FHBDRN Cc1nc([C@H]2CCCOC2)sc1C(=O)N(C)c1cccc([N+](=O)[O-])c1 ZINC000410612733 939937792 /nfs/dbraw/zinc/93/77/92/939937792.db2.gz ALSYZDSRSFNHKA-LBPRGKRZSA-N 0 0 361.423 3.530 20 5 FHBDRN C[C@@H](C(=O)N1CCCc2c([N+](=O)[O-])cccc21)[C@@H]1OCCc2sccc21 ZINC000410625595 939939623 /nfs/dbraw/zinc/93/96/23/939939623.db2.gz XALGEXMMFPABER-XIKOKIGWSA-N 0 0 372.446 3.886 20 5 FHBDRN CCO[C@@H]1C[C@@H](NC(=O)c2cc(F)ccc2[N+](=O)[O-])C12CCCCC2 ZINC000177133125 939949642 /nfs/dbraw/zinc/94/96/42/939949642.db2.gz VXGNJQKFGPUIPX-HZPDHXFCSA-N 0 0 350.390 3.592 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)Nc1cccc(-c2cc[nH]n2)c1 ZINC000065843295 939954230 /nfs/dbraw/zinc/95/42/30/939954230.db2.gz OOCPXHFCTVLRPF-UHFFFAOYSA-N 0 0 361.361 3.578 20 5 FHBDRN O=C(OCc1ncc(C(F)(F)F)s1)[C@H]1C[C@H]1c1cccc([N+](=O)[O-])c1 ZINC001270582416 945284778 /nfs/dbraw/zinc/28/47/78/945284778.db2.gz MONLQZVUZFSEIC-QWRGUYRKSA-N 0 0 372.324 3.917 20 5 FHBDRN CN(C(=O)c1ccc([N+](=O)[O-])o1)[C@H](c1cccnc1)c1ccc(F)c(F)c1 ZINC000364517406 939957635 /nfs/dbraw/zinc/95/76/35/939957635.db2.gz YSLMTQPJAUCBHI-KRWDZBQOSA-N 0 0 373.315 3.723 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N1CCC[C@@H](C[C@H]2CCOC2)C1 ZINC000364534196 939960341 /nfs/dbraw/zinc/96/03/41/939960341.db2.gz MELBFPYKFNNDTF-JKSUJKDBSA-N 0 0 361.442 3.882 20 5 FHBDRN COC1CCC(C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)CC1 ZINC000614829817 939962336 /nfs/dbraw/zinc/96/23/36/939962336.db2.gz JRRZXTCCEZIBIJ-UHFFFAOYSA-N 0 0 361.423 3.862 20 5 FHBDRN Cc1nc2c(s1)CCC[C@H]2CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000364570020 939965435 /nfs/dbraw/zinc/96/54/35/939965435.db2.gz OSTPZARMVCWYKR-JTQLQIEISA-N 0 0 365.842 3.863 20 5 FHBDRN CC(=O)c1ccsc1NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000410901295 939969279 /nfs/dbraw/zinc/96/92/79/939969279.db2.gz TZFCJDCLOAVNPD-UHFFFAOYSA-N 0 0 373.434 3.714 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)NC(C)(C)c2ccccc2C)cc1OC ZINC000410970526 939976489 /nfs/dbraw/zinc/97/64/89/939976489.db2.gz PNKFQDGBUNPCPB-UHFFFAOYSA-N 0 0 372.421 3.976 20 5 FHBDRN CCO[C@@H]1C[C@H](N(C)C(=O)c2cccc(OC)c2[N+](=O)[O-])C1(CC)CC ZINC000435807301 939977410 /nfs/dbraw/zinc/97/74/10/939977410.db2.gz IQVLWFTZHPETKO-JKSUJKDBSA-N 0 0 364.442 3.659 20 5 FHBDRN CC(C)c1ccc(CN[C@H](c2nc[nH]n2)c2ccccc2)cc1[N+](=O)[O-] ZINC000364680397 939981953 /nfs/dbraw/zinc/98/19/53/939981953.db2.gz XTNICYPISUXIAE-SFHVURJKSA-N 0 0 351.410 3.716 20 5 FHBDRN CCOc1ccc(C(=O)N[C@@H](CC)CNc2ccccc2)cc1[N+](=O)[O-] ZINC000411035723 939985601 /nfs/dbraw/zinc/98/56/01/939985601.db2.gz ZXOGMERLAFVMRC-HNNXBMFYSA-N 0 0 357.410 3.614 20 5 FHBDRN C[C@@H]1CCCN(c2ccc(C(=O)N(C)c3ccc(F)cn3)cc2[N+](=O)[O-])C1 ZINC000411046633 939990746 /nfs/dbraw/zinc/99/07/46/939990746.db2.gz FJQKSZWCEBHEDW-CYBMUJFWSA-N 0 0 372.400 3.642 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)N2CCc3ccc(F)cc3C2)cc1[N+](=O)[O-] ZINC000136475042 939991226 /nfs/dbraw/zinc/99/12/26/939991226.db2.gz UCTBNCHWUNONEZ-CYBMUJFWSA-N 0 0 357.385 3.871 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N[C@@H](C)C[C@H](O)c1ccc(F)cc1 ZINC000179846213 939993715 /nfs/dbraw/zinc/99/37/15/939993715.db2.gz GLPXLRCDYYNFKX-GUYCJALGSA-N 0 0 374.412 3.901 20 5 FHBDRN COc1cc(NC(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)cc(OC)c1 ZINC000411170720 940010335 /nfs/dbraw/zinc/01/03/35/940010335.db2.gz XSVAZDDLACRLLV-UHFFFAOYSA-N 0 0 360.366 3.652 20 5 FHBDRN O=C(NCCSCc1ccccc1F)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000411197440 940012866 /nfs/dbraw/zinc/01/28/66/940012866.db2.gz VSTCVVZHFVZRNF-DLBZAZTESA-N 0 0 374.437 3.887 20 5 FHBDRN O=C1[C@@H](Oc2cccc(C(F)(F)F)c2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000518284108 945289446 /nfs/dbraw/zinc/28/94/46/945289446.db2.gz RAVJGANIJAJQJA-HNNXBMFYSA-N 0 0 366.295 3.798 20 5 FHBDRN Cc1cccc([C@H]2CCCN2C(=O)CCCNc2ccc([N+](=O)[O-])cc2)n1 ZINC000167353292 940015997 /nfs/dbraw/zinc/01/59/97/940015997.db2.gz MVHJECCVKYHPEK-LJQANCHMSA-N 0 0 368.437 3.854 20 5 FHBDRN O=C(CCn1cc([N+](=O)[O-])cn1)N1CCC[C@H]1c1cccc2ccccc21 ZINC000065884790 940017506 /nfs/dbraw/zinc/01/75/06/940017506.db2.gz RADQZMZIROQXLD-IBGZPJMESA-N 0 0 364.405 3.698 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCCC[C@H]1c1noc(C)n1 ZINC000364899457 940019015 /nfs/dbraw/zinc/01/90/15/940019015.db2.gz YEERKDQLURXJGQ-RDJZCZTQSA-N 0 0 372.425 3.609 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])o1)N1CCC([C@H](F)c2ccccc2F)CC1 ZINC000375913030 940056275 /nfs/dbraw/zinc/05/62/75/940056275.db2.gz STWXODVJLXDWRQ-INIZCTEOSA-N 0 0 350.321 3.890 20 5 FHBDRN O=[N+]([O-])c1cccc2ncnc(N3CCCO[C@@H](c4ccccc4)C3)c21 ZINC000612443218 940071526 /nfs/dbraw/zinc/07/15/26/940071526.db2.gz JAKASVAZNKVMSU-QGZVFWFLSA-N 0 0 350.378 3.506 20 5 FHBDRN O=C(CCc1ccoc1)OCc1ccc([N+](=O)[O-])cc1Br ZINC000177289803 940082130 /nfs/dbraw/zinc/08/21/30/940082130.db2.gz IVICQSGCPUGVDJ-UHFFFAOYSA-N 0 0 354.156 3.626 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N[C@H]1CCc2cnn(C(C)C)c2C1 ZINC000365213333 940082210 /nfs/dbraw/zinc/08/22/10/940082210.db2.gz FXDKFBYZPUUERL-HNNXBMFYSA-N 0 0 371.441 3.668 20 5 FHBDRN C[C@H](C(=O)NCC(C)(C)[C@@H]1CCCCO1)c1ccc([N+](=O)[O-])cc1F ZINC000612478915 940090335 /nfs/dbraw/zinc/09/03/35/940090335.db2.gz SXDKJYZNPNNLAY-LRDDRELGSA-N 0 0 352.406 3.549 20 5 FHBDRN COc1cccc([C@@H]2CN(Cc3ccc(Cl)cc3[N+](=O)[O-])CCO2)c1 ZINC000167535804 940091606 /nfs/dbraw/zinc/09/16/06/940091606.db2.gz DCBALXRNZPVKTK-SFHVURJKSA-N 0 0 362.813 3.830 20 5 FHBDRN CCc1c(NC(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)cnn1CC(C)C ZINC000612485498 940095466 /nfs/dbraw/zinc/09/54/66/940095466.db2.gz UWTBFBYTCJMQPX-LBPRGKRZSA-N 0 0 362.405 3.891 20 5 FHBDRN COc1cccc2[nH]cc(CC(=O)Nc3cc([N+](=O)[O-])c(C)cc3C)c21 ZINC000179910664 940103698 /nfs/dbraw/zinc/10/36/98/940103698.db2.gz ZRXDEKLCQYHPHS-UHFFFAOYSA-N 0 0 353.378 3.883 20 5 FHBDRN Cc1nn(CCC(=O)Nc2ccc(OC(C)C)c(C)c2)c(C)c1[N+](=O)[O-] ZINC000152819554 940112355 /nfs/dbraw/zinc/11/23/55/940112355.db2.gz UCKPSOSTPAPWQE-UHFFFAOYSA-N 0 0 360.414 3.533 20 5 FHBDRN CCCOc1ccc(C(F)(F)F)cc1NC(=O)c1cc([N+](=O)[O-])cn1C ZINC000612556386 940143067 /nfs/dbraw/zinc/14/30/67/940143067.db2.gz IOUCFSVITDFLQG-UHFFFAOYSA-N 0 0 371.315 3.993 20 5 FHBDRN Cn1c(C(=O)Nc2cc(Cl)ccc2N2CCCCC2)ccc1[N+](=O)[O-] ZINC000612566031 940149387 /nfs/dbraw/zinc/14/93/87/940149387.db2.gz LJPRPWOLOJFGSJ-UHFFFAOYSA-N 0 0 362.817 3.829 20 5 FHBDRN O=C(N[C@@H](c1ccccc1)[C@H]1CCCO1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000411885995 940154682 /nfs/dbraw/zinc/15/46/82/940154682.db2.gz ZKJDGQQJSKJBAT-NMLBUPMWSA-N 0 0 366.417 3.735 20 5 FHBDRN COC(=O)c1ccc2c(c1)nc(C=Cc1ccc([N+](=O)[O-])cc1C)[nH]c2=O ZINC000612596483 940167754 /nfs/dbraw/zinc/16/77/54/940167754.db2.gz YTNAOSZAEAFDBT-YVMONPNESA-N 0 0 365.345 3.509 20 5 FHBDRN O=C(Nc1nc(-c2ccccc2)cs1)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000179969389 940175661 /nfs/dbraw/zinc/17/56/61/940175661.db2.gz DLWPHZHTKVLTNM-UHFFFAOYSA-N 0 0 369.358 3.699 20 5 FHBDRN COc1ccc2[nH]cc(CCNC(=O)Nc3ccc([N+](=O)[O-])cc3F)c2c1 ZINC000612613091 940177287 /nfs/dbraw/zinc/17/72/87/940177287.db2.gz FZDPSRBOFJULPO-UHFFFAOYSA-N 0 0 372.356 3.588 20 5 FHBDRN CO[C@@H](CNC(=O)Nc1ccc([N+](=O)[O-])cc1F)c1ccccc1Cl ZINC000612616692 940187293 /nfs/dbraw/zinc/18/72/93/940187293.db2.gz JWQHBSRLZIRECD-HNNXBMFYSA-N 0 0 367.764 3.897 20 5 FHBDRN CCCn1c(CNCc2nc3cc([N+](=O)[O-])ccc3[nH]2)nc2ccccc21 ZINC000278799697 940187494 /nfs/dbraw/zinc/18/74/94/940187494.db2.gz XJYJGSNBXSWNJW-UHFFFAOYSA-N 0 0 364.409 3.521 20 5 FHBDRN NC(=O)c1ccc(CN[C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)cc1 ZINC000179983661 940196789 /nfs/dbraw/zinc/19/67/89/940196789.db2.gz FEJOICSPVKXEOU-HXUWFJFHSA-N 0 0 361.401 3.573 20 5 FHBDRN CCOc1ccc(OC)cc1NC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000124564532 945306690 /nfs/dbraw/zinc/30/66/90/945306690.db2.gz WNELHOGCTPLNMD-UHFFFAOYSA-N 0 0 371.393 3.592 20 5 FHBDRN O=[N+]([O-])c1cnc2ccc(Br)cc2c1OC[C@@H]1CCCCO1 ZINC000612661128 940207981 /nfs/dbraw/zinc/20/79/81/940207981.db2.gz LMCWSBWLEKCIIK-NSHDSACASA-N 0 0 367.199 3.853 20 5 FHBDRN CC(C)OCCOc1c2cc(Br)ccc2ncc1[N+](=O)[O-] ZINC000612660821 940208388 /nfs/dbraw/zinc/20/83/88/940208388.db2.gz CBBGACUAQHVWMN-UHFFFAOYSA-N 0 0 355.188 3.709 20 5 FHBDRN COC(=O)[C@H](C)Cc1ccc(Nc2ncnc3ccc([N+](=O)[O-])cc32)cc1 ZINC000612666985 940209066 /nfs/dbraw/zinc/20/90/66/940209066.db2.gz OQUVEIPZCKXQRT-GFCCVEGCSA-N 0 0 366.377 3.633 20 5 FHBDRN Cn1nc(CNc2ccc([N+](=O)[O-])cc2Br)c2ccccc21 ZINC000612666629 940209813 /nfs/dbraw/zinc/20/98/13/940209813.db2.gz DGMHRJBDQBYLRF-UHFFFAOYSA-N 0 0 361.199 3.856 20 5 FHBDRN CC[C@@H](C)NC(=O)c1ccc(NC(=O)Cc2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000066034933 940212914 /nfs/dbraw/zinc/21/29/14/940212914.db2.gz MOMKTZPIJYMQJU-CQSZACIVSA-N 0 0 369.421 3.613 20 5 FHBDRN CC(C)(NC(=O)N[C@H]1CSc2ccccc21)c1ccc([N+](=O)[O-])cc1 ZINC000431665382 940216450 /nfs/dbraw/zinc/21/64/50/940216450.db2.gz OUJZZSBNMBVLDC-HNNXBMFYSA-N 0 0 357.435 3.976 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)cnc1N1CCc2c(ncn2-c2ccc(F)cc2)C1 ZINC000511858723 945305341 /nfs/dbraw/zinc/30/53/41/945305341.db2.gz KUDKHULALRFXRC-UHFFFAOYSA-N 0 0 373.775 3.531 20 5 FHBDRN COCCOc1cccc(/C=C/c2nc(-c3ccc([N+](=O)[O-])s3)no2)c1 ZINC000572644225 940274759 /nfs/dbraw/zinc/27/47/59/940274759.db2.gz AYEJEILLWOAGOT-FNORWQNLSA-N 0 0 373.390 3.902 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NCCSc2ccc(C)cc2)c1 ZINC000548960211 940287609 /nfs/dbraw/zinc/28/76/09/940287609.db2.gz FEBAXDLGAQXMQQ-UHFFFAOYSA-N 0 0 360.435 3.824 20 5 FHBDRN CCCN(C(=O)Cc1ccccc1[N+](=O)[O-])[C@@H]1CCc2ccccc2C1 ZINC000511382505 940288746 /nfs/dbraw/zinc/28/87/46/940288746.db2.gz LSRCDXPBTMGHOH-LJQANCHMSA-N 0 0 352.434 3.933 20 5 FHBDRN Cc1cccc([C@H](C)NC(=O)N2CCC(n3ccc([N+](=O)[O-])n3)CC2)c1C ZINC000376086736 940294289 /nfs/dbraw/zinc/29/42/89/940294289.db2.gz ZCYGGHZTNKAPPA-HNNXBMFYSA-N 0 0 371.441 3.516 20 5 FHBDRN CC(C)(NC(=O)NCCOC1CCCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000431689217 940297394 /nfs/dbraw/zinc/29/73/94/940297394.db2.gz GOINQWXTXDRDCH-UHFFFAOYSA-N 0 0 363.458 3.869 20 5 FHBDRN CSCC[C@@H](C)NC(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000124644628 945310125 /nfs/dbraw/zinc/31/01/25/945310125.db2.gz SRVJHKCIQUTZFD-MRVPVSSYSA-N 0 0 361.261 3.537 20 5 FHBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CC2(C1)CCCCC2 ZINC000612850029 940308587 /nfs/dbraw/zinc/30/85/87/940308587.db2.gz BXZLLSXQETYCPC-UHFFFAOYSA-N 0 0 353.216 3.764 20 5 FHBDRN COc1cccc2cc(-c3nc(-c4ccc(N)c([N+](=O)[O-])c4)no3)oc21 ZINC000612856704 940314800 /nfs/dbraw/zinc/31/48/00/940314800.db2.gz CSWBAOABQKRROR-UHFFFAOYSA-N 0 0 352.306 3.649 20 5 FHBDRN Cc1ccc(OCCCc2nc(Cc3ccccc3[N+](=O)[O-])no2)cc1 ZINC000612863133 940318439 /nfs/dbraw/zinc/31/84/39/940318439.db2.gz PULQIYNLLFYUQE-UHFFFAOYSA-N 0 0 353.378 3.889 20 5 FHBDRN O=C(NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CC2(CCC2)[C@H]1C1CC1 ZINC000584503545 940318819 /nfs/dbraw/zinc/31/88/19/940318819.db2.gz LXWUVWMBDHWZQR-GOSISDBHSA-N 0 0 368.437 3.593 20 5 FHBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)c1nc(CC2=CCCCC2)no1 ZINC000612895083 940327771 /nfs/dbraw/zinc/32/77/71/940327771.db2.gz JFFQPPRFJVASFJ-LBPRGKRZSA-N 0 0 356.382 3.512 20 5 FHBDRN O=[N+]([O-])c1cc(I)cc(-c2nc(C3CCC3)no2)c1 ZINC000612896879 940327940 /nfs/dbraw/zinc/32/79/40/940327940.db2.gz CFIFFIREPWHQGG-UHFFFAOYSA-N 0 0 371.134 3.517 20 5 FHBDRN CO[C@H](c1nc(CCC(C)(C)[N+](=O)[O-])no1)c1ccccc1C(F)(F)F ZINC000924077900 940328243 /nfs/dbraw/zinc/32/82/43/940328243.db2.gz ZVGKTDHKIPQIAY-ZDUSSCGKSA-N 0 0 373.331 3.812 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)ccc1-c1nc(Cc2ccc3c(c2)CCO3)no1 ZINC000612911834 940337075 /nfs/dbraw/zinc/33/70/75/940337075.db2.gz ILVCVFCAVWQKKO-UHFFFAOYSA-N 0 0 357.753 3.824 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccc(F)cc1OCC1CC1 ZINC000427361370 945315501 /nfs/dbraw/zinc/31/55/01/945315501.db2.gz XCPSUJYRVNBEGX-UHFFFAOYSA-N 0 0 360.341 3.784 20 5 FHBDRN COc1ccc2c(c1)N(C(=O)c1ccc([N+](=O)[O-])cc1OC)CCCC2 ZINC000427362413 945315856 /nfs/dbraw/zinc/31/58/56/945315856.db2.gz LYELSTBQIHTRHS-UHFFFAOYSA-N 0 0 356.378 3.595 20 5 FHBDRN O=[N+]([O-])c1ccccc1NCCc1nc([C@@H]2CCc3ccccc32)no1 ZINC000612933253 940344125 /nfs/dbraw/zinc/34/41/25/940344125.db2.gz PLXTUWPBOJLMOX-OAHLLOKOSA-N 0 0 350.378 3.711 20 5 FHBDRN COc1cc(OCc2nc([C@@H]3CCc4ccccc43)no2)ccc1[N+](=O)[O-] ZINC000612933247 940344138 /nfs/dbraw/zinc/34/41/38/940344138.db2.gz PCILGPLRAPGMNM-OAHLLOKOSA-N 0 0 367.361 3.644 20 5 FHBDRN Cc1ccc(CNC(=O)Cc2ccc([N+](=O)[O-])cc2Br)cc1 ZINC000086978499 945316190 /nfs/dbraw/zinc/31/61/90/945316190.db2.gz CQFPTMRVNXSNPG-UHFFFAOYSA-N 0 0 363.211 3.525 20 5 FHBDRN Cc1noc(C2CCC(Nc3ccc([N+](=O)[O-])c4cccnc34)CC2)n1 ZINC000440202720 945316409 /nfs/dbraw/zinc/31/64/09/945316409.db2.gz NODYQYGFEXTXFU-UHFFFAOYSA-N 0 0 353.382 3.973 20 5 FHBDRN CC1(C)C(=O)N(CN(Cc2ccccc2[N+](=O)[O-])CC(F)(F)F)C1(C)C ZINC000177681605 940351093 /nfs/dbraw/zinc/35/10/93/940351093.db2.gz BLNBNZJAUSUKOR-UHFFFAOYSA-N 0 0 373.375 3.564 20 5 FHBDRN CC(C)(C)N(CC(=O)Nc1ccc(F)cc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000506789658 945317889 /nfs/dbraw/zinc/31/78/89/945317889.db2.gz IYWQLPBGLHFUBE-UHFFFAOYSA-N 0 0 359.401 3.973 20 5 FHBDRN Cc1cc(C)c(OC(=O)C[C@H](C)NC(=O)C2CCCCC2)c([N+](=O)[O-])c1 ZINC000066274924 940377938 /nfs/dbraw/zinc/37/79/38/940377938.db2.gz WVNHDJIYVFQZDG-AWEZNQCLSA-N 0 0 362.426 3.592 20 5 FHBDRN Cc1ccc(S(=O)(=O)N(C)[C@H](C)c2ccc(Cl)cc2)c([N+](=O)[O-])c1 ZINC000507556738 945313335 /nfs/dbraw/zinc/31/33/35/945313335.db2.gz XGZBPDVMLQTPLF-GFCCVEGCSA-N 0 0 368.842 3.938 20 5 FHBDRN Cc1ccc([C@@H](C)N(C)C(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)cc1 ZINC000066289270 940394072 /nfs/dbraw/zinc/39/40/72/940394072.db2.gz AZQPRUOZGGZMCM-CYBMUJFWSA-N 0 0 356.378 3.508 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)N(C)[C@@H]2CCC[C@H]2c2ccc(C)cc2)n1 ZINC000427360318 945314655 /nfs/dbraw/zinc/31/46/55/945314655.db2.gz YTUNIVZJPFGFKG-JKSUJKDBSA-N 0 0 356.426 3.528 20 5 FHBDRN C[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)c2ccccc21 ZINC000066308119 940407405 /nfs/dbraw/zinc/40/74/05/940407405.db2.gz RPGXITBQNCERJL-LBPRGKRZSA-N 0 0 354.362 3.520 20 5 FHBDRN C[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)c2ccccc21 ZINC000066308117 940407462 /nfs/dbraw/zinc/40/74/62/940407462.db2.gz RPGXITBQNCERJL-GFCCVEGCSA-N 0 0 354.362 3.520 20 5 FHBDRN Cc1cc(C)c(NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1O ZINC000613032302 940408353 /nfs/dbraw/zinc/40/83/53/940408353.db2.gz BAHJLPSGHNFVGE-UHFFFAOYSA-N 0 0 369.421 3.772 20 5 FHBDRN C[C@@H]1CCc2c(F)cccc2[C@@H]1NC(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000431721845 940409482 /nfs/dbraw/zinc/40/94/82/940409482.db2.gz JJHPPVLTSFCCJY-KZULUSFZSA-N 0 0 357.385 3.857 20 5 FHBDRN O=C1CCc2cc([N+](=O)[O-])c(Nc3ccc(-c4cncnc4)cc3)cc2N1 ZINC000579886749 940411978 /nfs/dbraw/zinc/41/19/78/940411978.db2.gz YVDYMAXDGJPPNK-UHFFFAOYSA-N 0 0 361.361 3.680 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cn1)C(=O)Nc1ccc(F)cc1Cl ZINC000160322526 940416204 /nfs/dbraw/zinc/41/62/04/940416204.db2.gz HJDYIWYLJJVPGR-QMMMGPOBSA-N 0 0 355.778 3.902 20 5 FHBDRN CCN1C(=O)CCc2cc(N[C@H]3CCc4c3cccc4[N+](=O)[O-])ccc21 ZINC000579971618 940426071 /nfs/dbraw/zinc/42/60/71/940426071.db2.gz GEIJNZSTTGDHLA-KRWDZBQOSA-N 0 0 351.406 3.993 20 5 FHBDRN CCOc1cc(OCc2noc(-c3ccccc3C)n2)ccc1[N+](=O)[O-] ZINC000188616454 940426526 /nfs/dbraw/zinc/42/65/26/940426526.db2.gz FTXVZCXXRKLKJL-UHFFFAOYSA-N 0 0 355.350 3.931 20 5 FHBDRN Cc1cccc([C@@H](C)CNC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000511421264 940431192 /nfs/dbraw/zinc/43/11/92/940431192.db2.gz KHWFCCXIIVLLSQ-INIZCTEOSA-N 0 0 355.438 3.891 20 5 FHBDRN Cc1cccc([C@H](C)CNC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000511421265 940431281 /nfs/dbraw/zinc/43/12/81/940431281.db2.gz KHWFCCXIIVLLSQ-MRXNPFEDSA-N 0 0 355.438 3.891 20 5 FHBDRN Cc1c(CC(=O)NCc2ccc(F)cc2C(F)(F)F)cccc1[N+](=O)[O-] ZINC000161684388 940437338 /nfs/dbraw/zinc/43/73/38/940437338.db2.gz QASPWIXOXJZMKV-UHFFFAOYSA-N 0 0 370.302 3.920 20 5 FHBDRN CCN([C@H](C)c1ccc(F)cc1)S(=O)(=O)c1ccc([N+](=O)[O-])s1 ZINC000066333631 940439021 /nfs/dbraw/zinc/43/90/21/940439021.db2.gz YRYXVXOFUKBJHE-SNVBAGLBSA-N 0 0 358.416 3.567 20 5 FHBDRN CCc1ccc(C(=O)Nc2ccc(-c3cc(=O)[nH][nH]3)cc2)cc1[N+](=O)[O-] ZINC000472500719 940439938 /nfs/dbraw/zinc/43/99/38/940439938.db2.gz NDAKYBSLACMIGR-UHFFFAOYSA-N 0 0 352.350 3.505 20 5 FHBDRN CCc1nn(C)c(NCc2ccc3c(c2)nc(CC)n3C2CC2)c1[N+](=O)[O-] ZINC000548991323 940450517 /nfs/dbraw/zinc/45/05/17/940450517.db2.gz LQXPEJYEZYOSIV-UHFFFAOYSA-N 0 0 368.441 3.750 20 5 FHBDRN CCCc1ccc(C(=O)COc2ccc(C(=O)OC)c([N+](=O)[O-])c2)cc1 ZINC000613110106 940452390 /nfs/dbraw/zinc/45/23/90/940452390.db2.gz UAEIHWLZZHOWMD-UHFFFAOYSA-N 0 0 357.362 3.596 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2C[C@H]2c2ccc(Cl)cc2)c1 ZINC000548993479 940456668 /nfs/dbraw/zinc/45/66/68/940456668.db2.gz NNQFAEBYGDQWHC-GOEBONIOSA-N 0 0 360.797 3.933 20 5 FHBDRN CC[C@H]1CN(c2ccccc2)CCN1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000613130303 940462651 /nfs/dbraw/zinc/46/26/51/940462651.db2.gz VUXDILSBCCRPNZ-HNNXBMFYSA-N 0 0 366.421 3.837 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CCc3cc(F)cc(C)c3C2)c1 ZINC000548996449 940465001 /nfs/dbraw/zinc/46/50/01/940465001.db2.gz KPWRIGZMMRXMPI-UHFFFAOYSA-N 0 0 358.369 3.640 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])Nc1cncc(Cl)c1Cl ZINC000180095148 940468356 /nfs/dbraw/zinc/46/83/56/940468356.db2.gz BDYJMTAKVJWKPE-UHFFFAOYSA-N 0 0 356.165 3.704 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)ccc1NCCCS(=O)(=O)c1ccccc1 ZINC000066373127 940468367 /nfs/dbraw/zinc/46/83/67/940468367.db2.gz YFDUBPPANJMKSS-UHFFFAOYSA-N 0 0 354.815 3.524 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])cc1[N+](=O)[O-] ZINC000177858813 940469242 /nfs/dbraw/zinc/46/92/42/940469242.db2.gz BJPPZGOLPBKDQU-JTQLQIEISA-N 0 0 363.757 3.956 20 5 FHBDRN Cc1ccsc1CCNC(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000580238254 940470355 /nfs/dbraw/zinc/47/03/55/940470355.db2.gz DTYNMTVSFHJXJJ-UHFFFAOYSA-N 0 0 372.450 3.530 20 5 FHBDRN C[C@@H](C(=O)N1CCC[C@H](Nc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000580274187 940471589 /nfs/dbraw/zinc/47/15/89/940471589.db2.gz ZPRWXOZFNBZVOM-QAPCUYQASA-N 0 0 353.422 3.801 20 5 FHBDRN Cc1cscc1CNC(=O)c1cc([N+](=O)[O-])cc(Br)c1C ZINC000580294915 940472003 /nfs/dbraw/zinc/47/20/03/940472003.db2.gz BAFYCMFXKAYFCG-UHFFFAOYSA-N 0 0 369.240 3.966 20 5 FHBDRN O=[N+]([O-])c1cc2c(cc1CNCc1ccc(C(F)F)cc1)OCCO2 ZINC000613175714 940476037 /nfs/dbraw/zinc/47/60/37/940476037.db2.gz VJRLPNVDNVORGE-UHFFFAOYSA-N 0 0 350.321 3.593 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCc1cccnc1OC(C)C ZINC000613176315 940476934 /nfs/dbraw/zinc/47/69/34/940476934.db2.gz WZZPMRWWKIUWRJ-INIZCTEOSA-N 0 0 371.437 3.662 20 5 FHBDRN C[C@@H](CC(C)(C)c1ccccc1)Nc1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1 ZINC000580573306 940479502 /nfs/dbraw/zinc/47/95/02/940479502.db2.gz WDGFWXSIJCXJOB-ZDUSSCGKSA-N 0 0 366.421 3.834 20 5 FHBDRN Cc1ccc(C)c(OCCC(=O)N(C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000580575244 940479605 /nfs/dbraw/zinc/47/96/05/940479605.db2.gz HWOOWJHXUNMHPT-UHFFFAOYSA-N 0 0 356.422 3.682 20 5 FHBDRN COc1ccc(CC(=O)N[C@H]2CCCC[C@H]2CC(F)(F)F)cc1[N+](=O)[O-] ZINC000580620284 940480628 /nfs/dbraw/zinc/48/06/28/940480628.db2.gz WCEAHKYYHXBQCB-STQMWFEESA-N 0 0 374.359 3.773 20 5 FHBDRN NC(=O)c1ccnc(N2CCCCC[C@@H]2/C=C/c2cccs2)c1[N+](=O)[O-] ZINC000580663541 940481415 /nfs/dbraw/zinc/48/14/15/940481415.db2.gz OTCOZOHYMAAEFK-SBDDDAINSA-N 0 0 372.450 3.613 20 5 FHBDRN Cc1cccc(C)c1NC(=O)CNc1ccc([N+](=O)[O-])cc1OC(F)F ZINC000580608168 940482300 /nfs/dbraw/zinc/48/23/00/940482300.db2.gz GLWWUMORPDIXRY-UHFFFAOYSA-N 0 0 365.336 3.864 20 5 FHBDRN CCc1ccc(-c2nc(Cc3cc(OC)cc(OC)c3[N+](=O)[O-])no2)cc1 ZINC000580931716 940489268 /nfs/dbraw/zinc/48/92/68/940489268.db2.gz LSFWFRQYLSBOJG-UHFFFAOYSA-N 0 0 369.377 3.815 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N1CC[C@@H](c2cccc(F)c2)C1 ZINC000581093389 940493367 /nfs/dbraw/zinc/49/33/67/940493367.db2.gz FUDGAFAOFDCSAW-CQSZACIVSA-N 0 0 362.788 3.946 20 5 FHBDRN O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)N1CCC(c2ccsc2)CC1 ZINC000581093258 940493381 /nfs/dbraw/zinc/49/33/81/940493381.db2.gz HSIUHSONIOPKQU-UHFFFAOYSA-N 0 0 366.389 3.883 20 5 FHBDRN CC(=O)N(CCc1noc(-c2ccc(C(C)C)c([N+](=O)[O-])c2)n1)C(C)C ZINC000581157168 940494512 /nfs/dbraw/zinc/49/45/12/940494512.db2.gz BUHZINGHPPLCQJ-UHFFFAOYSA-N 0 0 360.414 3.568 20 5 FHBDRN C[C@H](CN(C)C(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1)c1ccccc1 ZINC000066458682 940494910 /nfs/dbraw/zinc/49/49/10/940494910.db2.gz RDNNQRIZRCJPCP-OAHLLOKOSA-N 0 0 364.405 3.656 20 5 FHBDRN C[C@@H](CN(C)C(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)c1ccccc1 ZINC000066458671 940494965 /nfs/dbraw/zinc/49/49/65/940494965.db2.gz VZRKNUHZYCOZGE-HNNXBMFYSA-N 0 0 364.405 3.656 20 5 FHBDRN CCn1ncc(C(=O)N(C)c2cccc([N+](=O)[O-])c2)c1-c1ccccc1 ZINC000427398888 945326116 /nfs/dbraw/zinc/32/61/16/945326116.db2.gz MJLMJXDDSOYZQE-UHFFFAOYSA-N 0 0 350.378 3.755 20 5 FHBDRN CC(C)CC1(C)CCN(c2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])CC1 ZINC000581391669 940503135 /nfs/dbraw/zinc/50/31/35/940503135.db2.gz QNNIYHYKDNHQPW-UHFFFAOYSA-N 0 0 354.472 3.651 20 5 FHBDRN C[C@H](CNC(=O)N(C)CCc1cccc([N+](=O)[O-])c1)Cc1cccs1 ZINC000511473607 940505822 /nfs/dbraw/zinc/50/58/22/940505822.db2.gz HGLUGDDDQOPDLE-AWEZNQCLSA-N 0 0 361.467 3.719 20 5 FHBDRN C[C@H]1Cc2ccccc2[C@@H]1NC(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000511475277 940506152 /nfs/dbraw/zinc/50/61/52/940506152.db2.gz KQOUZRGZXXRPEN-IFXJQAMLSA-N 0 0 353.422 3.712 20 5 FHBDRN Cc1nn(C(C)C)cc1C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000581556220 940506423 /nfs/dbraw/zinc/50/64/23/940506423.db2.gz XVKNOHXELJLYMA-UHFFFAOYSA-N 0 0 354.313 3.534 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)Nc1ccc(C2CCC2)cn1 ZINC000581568637 940506570 /nfs/dbraw/zinc/50/65/70/940506570.db2.gz UDCLJUKKVWGTEW-UHFFFAOYSA-N 0 0 350.378 3.920 20 5 FHBDRN CCc1nnc(CNC(=O)Nc2ccc(C(C)(C)C)c([N+](=O)[O-])c2)s1 ZINC000581637464 940509105 /nfs/dbraw/zinc/50/91/05/940509105.db2.gz XRHRSXXSEUKJES-UHFFFAOYSA-N 0 0 363.443 3.628 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCc1ccc(F)cc1F ZINC000581641187 940509285 /nfs/dbraw/zinc/50/92/85/940509285.db2.gz SEPNOUHYNOEDOT-CQSZACIVSA-N 0 0 362.376 3.801 20 5 FHBDRN O=[N+]([O-])c1cc2c(nc1NCc1nnc(-c3ccccc3)s1)CCCC2 ZINC000581604393 940509951 /nfs/dbraw/zinc/50/99/51/940509951.db2.gz FUQRSHPWHXSGHO-UHFFFAOYSA-N 0 0 367.434 3.999 20 5 FHBDRN O=C(Nc1cc([N+](=O)[O-])ccc1[O-])c1ccc(C[NH+]2CCCCC2)cc1 ZINC000581741955 940511088 /nfs/dbraw/zinc/51/10/88/940511088.db2.gz APMMUTMPZQYKNR-UHFFFAOYSA-N 0 0 355.394 3.539 20 5 FHBDRN CCOC(=O)c1cc(COC)cc(NCc2ccc([N+](=O)[O-])cc2OC)c1 ZINC000427400884 945327821 /nfs/dbraw/zinc/32/78/21/945327821.db2.gz XELIVGJLMQGWJA-UHFFFAOYSA-N 0 0 374.393 3.539 20 5 FHBDRN CCOc1ccc(-c2noc(CNc3ccc(F)c([N+](=O)[O-])c3)n2)cc1 ZINC000026781555 945329647 /nfs/dbraw/zinc/32/96/47/945329647.db2.gz YUCIXMOAMHMKBD-UHFFFAOYSA-N 0 0 358.329 3.795 20 5 FHBDRN CC(C)[C@@](C)(CO)NC(=O)c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1 ZINC000427385251 945330790 /nfs/dbraw/zinc/33/07/90/945330790.db2.gz UGVKXZNKJLHLHF-LJQANCHMSA-N 0 0 374.462 3.883 20 5 FHBDRN CN(C(=O)c1csc([N+](=O)[O-])c1)[C@H]1C[C@H](Oc2ccccc2)C1(C)C ZINC000581687112 940588689 /nfs/dbraw/zinc/58/86/89/940588689.db2.gz RJERTEGRHGRRDO-GJZGRUSLSA-N 0 0 360.435 3.974 20 5 FHBDRN CCn1c(NC(=O)c2ccc([N+](=O)[O-])cc2OC)nc2cc(Cl)ccc21 ZINC000427387137 945333121 /nfs/dbraw/zinc/33/31/21/945333121.db2.gz OKDXNSCIKZDBJN-UHFFFAOYSA-N 0 0 374.784 3.879 20 5 FHBDRN COc1cccc2c1N(Cc1nnc(-c3ccc([N+](=O)[O-])cc3)o1)CCC2 ZINC000173199450 940595446 /nfs/dbraw/zinc/59/54/46/940595446.db2.gz BPCRVNQPUYKRNA-UHFFFAOYSA-N 0 0 366.377 3.606 20 5 FHBDRN Cc1nn(C(C)(C)C)cc1[C@H](C)Nc1ncnc2ccc([N+](=O)[O-])cc21 ZINC000613333789 940605395 /nfs/dbraw/zinc/60/53/95/940605395.db2.gz XHXFPNRAPCQMMK-NSHDSACASA-N 0 0 354.414 3.971 20 5 FHBDRN CCOc1ccccc1CS(=O)(=O)[C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000180129769 940608592 /nfs/dbraw/zinc/60/85/92/940608592.db2.gz IWYZNTJHUIWRAO-AWEZNQCLSA-N 0 0 363.435 3.978 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCSC[C@@H]1c1ccccc1 ZINC000173411008 940617377 /nfs/dbraw/zinc/61/73/77/940617377.db2.gz SXOBFGDIDVRNKN-GOSISDBHSA-N 0 0 371.462 3.632 20 5 FHBDRN COc1cc(Cc2noc(CC3CC(C)(C)C3)n2)c([N+](=O)[O-])c(OC)c1 ZINC000426610862 945334933 /nfs/dbraw/zinc/33/49/33/945334933.db2.gz GSASHFAAXGJBGP-UHFFFAOYSA-N 0 0 361.398 3.565 20 5 FHBDRN Cc1cc(N2CCC[C@](O)(C(F)(F)F)CC2)c2cccc([N+](=O)[O-])c2n1 ZINC000376262425 940641873 /nfs/dbraw/zinc/64/18/73/940641873.db2.gz QDSXEIHBTDZDRT-MRXNPFEDSA-N 0 0 369.343 3.735 20 5 FHBDRN COc1ccc2c(c1)[C@H](C(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1)CC2 ZINC000431815568 940644430 /nfs/dbraw/zinc/64/44/30/940644430.db2.gz WKUDAPUHOWYWQA-CXAGYDPISA-N 0 0 354.406 3.819 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NC1(c2ccc3c(c2)OCO3)CC1 ZINC000431816460 940647226 /nfs/dbraw/zinc/64/72/26/940647226.db2.gz WVFHNVALHYRZAH-UHFFFAOYSA-N 0 0 369.377 3.751 20 5 FHBDRN NC(=O)c1cccc(NCCc2cccc(Cl)c2Cl)c1[N+](=O)[O-] ZINC000582128621 940648843 /nfs/dbraw/zinc/64/88/43/940648843.db2.gz YTZXSPVCAQRQAU-UHFFFAOYSA-N 0 0 354.193 3.655 20 5 FHBDRN CC[C@H](Cc1ccccc1)NC(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000511499031 940656422 /nfs/dbraw/zinc/65/64/22/940656422.db2.gz QOXVGIWSJNCALQ-GOSISDBHSA-N 0 0 355.438 3.800 20 5 FHBDRN Cc1c(CC(=O)Nc2cnn(CC(C)C)c2C2CC2)cccc1[N+](=O)[O-] ZINC000582261602 940656963 /nfs/dbraw/zinc/65/69/63/940656963.db2.gz SWXUNJGVGIIRGP-UHFFFAOYSA-N 0 0 356.426 3.814 20 5 FHBDRN COc1ccc(Cc2nc(-c3c[nH]c4ccccc43)no2)cc1[N+](=O)[O-] ZINC000582280482 940663293 /nfs/dbraw/zinc/66/32/93/940663293.db2.gz UQKUYXHOPNUZRO-UHFFFAOYSA-N 0 0 350.334 3.726 20 5 FHBDRN Cc1cc(NC(=O)c2cc(F)ccc2[N+](=O)[O-])nn1-c1cccc(F)c1 ZINC000180133440 940676440 /nfs/dbraw/zinc/67/64/40/940676440.db2.gz GIYWYHGZIRFQDK-UHFFFAOYSA-N 0 0 358.304 3.619 20 5 FHBDRN CCS[C@@H]1CCC[C@H]1NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000178109123 940678512 /nfs/dbraw/zinc/67/85/12/940678512.db2.gz KEMJAIKQRAEQTM-NVXWUHKLSA-N 0 0 363.483 3.599 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1[C@H](C)S(=O)(=O)Cc1ccc(F)c(F)c1 ZINC000180136231 940679110 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CCOc1cc(CS(=O)(=O)Cc2cc(C)ccc2F)ccc1[N+](=O)[O-] ZINC000414427631 941131334 /nfs/dbraw/zinc/13/13/34/941131334.db2.gz SCEBPGYTLPZLCQ-UHFFFAOYSA-N 0 0 367.398 3.556 20 5 FHBDRN CSc1cccc(NC(=O)COc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000014735546 941132454 /nfs/dbraw/zinc/13/24/54/941132454.db2.gz FZRYPDOVXMJDLF-UHFFFAOYSA-N 0 0 352.799 3.988 20 5 FHBDRN O=C(Nc1ccc(OCc2ccccc2)cc1[N+](=O)[O-])[C@H]1CCCOC1 ZINC000188960725 941134120 /nfs/dbraw/zinc/13/41/20/941134120.db2.gz VBUKTSGMVKFOAX-HNNXBMFYSA-N 0 0 356.378 3.539 20 5 FHBDRN O=C(Nc1ccc(OCc2ccccc2)cc1[N+](=O)[O-])C1CCOCC1 ZINC000188975550 941137576 /nfs/dbraw/zinc/13/75/76/941137576.db2.gz FMLDWSYTPIPRPB-UHFFFAOYSA-N 0 0 356.378 3.539 20 5 FHBDRN C[C@H](C(=O)N[C@H]1CCOc2c(F)cccc21)c1ccc([N+](=O)[O-])cc1F ZINC000188998722 941142920 /nfs/dbraw/zinc/14/29/20/941142920.db2.gz PGGUZTKOZCMQMF-QFYYESIMSA-N 0 0 362.332 3.617 20 5 FHBDRN CSc1cccc(C(=O)N[C@@H](CCCO)c2ccccc2)c1[N+](=O)[O-] ZINC000188998642 941142980 /nfs/dbraw/zinc/14/29/80/941142980.db2.gz GYCVCEROLBQGBK-HNNXBMFYSA-N 0 0 360.435 3.560 20 5 FHBDRN COc1cc(C(=O)N2CC[C@@H](c3ccccc3)[C@@H]2C)cc([N+](=O)[O-])c1C ZINC000189102885 941145394 /nfs/dbraw/zinc/14/53/94/941145394.db2.gz PLXGWLJIKWLSHX-WMLDXEAASA-N 0 0 354.406 3.930 20 5 FHBDRN O=C(c1ccn(-c2ccccc2[N+](=O)[O-])n1)N1CCC[C@@H]1c1ccsc1 ZINC000136050180 941146895 /nfs/dbraw/zinc/14/68/95/941146895.db2.gz WLTXGOGIIIXPSQ-OAHLLOKOSA-N 0 0 368.418 3.819 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)c1c[nH]nc1-c1ccsc1 ZINC000189154595 941148103 /nfs/dbraw/zinc/14/81/03/941148103.db2.gz GGUBXMIRXTXALX-UHFFFAOYSA-N 0 0 362.798 3.630 20 5 FHBDRN C[C@H](NCc1noc(-c2ccc(F)cc2F)n1)c1cccc([N+](=O)[O-])c1 ZINC000189159438 941148123 /nfs/dbraw/zinc/14/81/23/941148123.db2.gz AXGKPVMWNYNXIW-JTQLQIEISA-N 0 0 360.320 3.774 20 5 FHBDRN Nc1ccc(C(=O)Nc2ccc(Oc3ccccc3)cn2)cc1[N+](=O)[O-] ZINC000103125317 941150271 /nfs/dbraw/zinc/15/02/71/941150271.db2.gz BXMWVPBAMDMRSJ-UHFFFAOYSA-N 0 0 350.334 3.617 20 5 FHBDRN Cc1cc(C(F)(F)F)ccc1CNC(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000187925239 941152292 /nfs/dbraw/zinc/15/22/92/941152292.db2.gz YGSWDGPPNUFADD-UHFFFAOYSA-N 0 0 367.327 3.921 20 5 FHBDRN C[C@H](C1CC1)n1cc(NCc2cc([N+](=O)[O-])ccc2OC(F)F)cn1 ZINC000189255059 941154210 /nfs/dbraw/zinc/15/42/10/941154210.db2.gz WFRHRXGGTUYQKM-SNVBAGLBSA-N 0 0 352.341 3.976 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])Nc1ccc2c(c1)C(=O)CCC2 ZINC000177964125 941154928 /nfs/dbraw/zinc/15/49/28/941154928.db2.gz QTHDPPNIFODPPT-UHFFFAOYSA-N 0 0 354.362 3.521 20 5 FHBDRN Cc1nc(NC(=O)[C@H](C)Oc2ccc(C(F)(F)F)cc2)ccc1[N+](=O)[O-] ZINC000189293979 941155504 /nfs/dbraw/zinc/15/55/04/941155504.db2.gz HIQZUGBEUJDKRC-JTQLQIEISA-N 0 0 369.299 3.723 20 5 FHBDRN CCCOc1ccc(NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2C)c(C)c1 ZINC000189281983 941156639 /nfs/dbraw/zinc/15/66/39/941156639.db2.gz AAKXOQRYJIWEHK-UHFFFAOYSA-N 0 0 371.393 3.578 20 5 FHBDRN COc1cc(C(=O)Nc2cc(F)ccc2OC(F)F)cc([N+](=O)[O-])c1C ZINC000189355292 941157542 /nfs/dbraw/zinc/15/75/42/941157542.db2.gz ITUOOAZXWMXYIY-UHFFFAOYSA-N 0 0 370.283 3.905 20 5 FHBDRN CC[C@](C)(O)CN(Cc1ccccc1)C(=O)c1cccc([N+](=O)[O-])c1C ZINC000189492960 941159052 /nfs/dbraw/zinc/15/90/52/941159052.db2.gz NGOYPTOHDRXGOQ-FQEVSTJZSA-N 0 0 356.422 3.707 20 5 FHBDRN CC(C)CC[C@H](NC(=O)C(=O)Nc1cc(F)cc([N+](=O)[O-])c1)C(C)(C)C ZINC000472624768 941159874 /nfs/dbraw/zinc/15/98/74/941159874.db2.gz SIWCHKLLWUGQPI-HNNXBMFYSA-N 0 0 367.421 3.640 20 5 FHBDRN COC(=O)c1ccc(-c2nc(COc3ccc(C)c([N+](=O)[O-])c3)co2)cc1 ZINC000541077244 941166111 /nfs/dbraw/zinc/16/61/11/941166111.db2.gz LKPROXHDDNYSGK-UHFFFAOYSA-N 0 0 368.345 3.924 20 5 FHBDRN Cc1cccc2c1OCC[C@H]2NC(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000189594461 941212402 /nfs/dbraw/zinc/21/24/02/941212402.db2.gz GCYVLGUDBBLRBL-YVEFUNNKSA-N 0 0 358.369 3.786 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(Oc2ccc(Br)cc2[N+](=O)[O-])n1 ZINC000178239817 941220400 /nfs/dbraw/zinc/22/04/00/941220400.db2.gz LNCXPILIIUYRDF-UHFFFAOYSA-N 0 0 354.116 3.761 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N[C@H]1CCOc2c(F)cccc21 ZINC000189610179 941221443 /nfs/dbraw/zinc/22/14/43/941221443.db2.gz OFIRGCDYJOZZKL-HNNXBMFYSA-N 0 0 364.760 3.570 20 5 FHBDRN COCc1cc([N+](=O)[O-])ccc1NC[C@](C)(Cc1ccccc1)[C@@H](C)O ZINC000189648500 941240375 /nfs/dbraw/zinc/24/03/75/941240375.db2.gz YCJYPFKSNYQRJO-QRWLVFNGSA-N 0 0 358.438 3.783 20 5 FHBDRN O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCCC[C@H]1c1noc(C2CC2)n1 ZINC000376583633 941241122 /nfs/dbraw/zinc/24/11/22/941241122.db2.gz YUNPGSNSTZIGIN-OFAQMXQXSA-N 0 0 368.393 3.622 20 5 FHBDRN C[C@@H](C1CC1)n1cc(NC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)cn1 ZINC000189661300 941245228 /nfs/dbraw/zinc/24/52/28/941245228.db2.gz CUJNCSKAUNSNHO-AWEZNQCLSA-N 0 0 371.441 3.907 20 5 FHBDRN C[C@@H](C1CC1)n1cc(NC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)cn1 ZINC000189727467 941268948 /nfs/dbraw/zinc/26/89/48/941268948.db2.gz NIVPMNPQRWIXMF-LBPRGKRZSA-N 0 0 357.414 3.819 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)Nc2cnn([C@@H](C)C3CC3)c2)cc1[N+](=O)[O-] ZINC000189749255 941271010 /nfs/dbraw/zinc/27/10/10/941271010.db2.gz AGYVUIRPYUXXDP-STQMWFEESA-N 0 0 357.414 3.953 20 5 FHBDRN O=[N+]([O-])c1ccc(S(=O)(=O)Nc2ccsc2Cl)c2ncccc12 ZINC000189745970 941271244 /nfs/dbraw/zinc/27/12/44/941271244.db2.gz VKEJVHSANBRIPW-UHFFFAOYSA-N 0 0 369.811 3.659 20 5 FHBDRN O=[N+]([O-])c1cc(CN2CCO[C@@H](CF)C2)ccc1Oc1ccc(F)cc1 ZINC000414467242 941276728 /nfs/dbraw/zinc/27/67/28/941276728.db2.gz DDNWGTMSNLFDSN-INIZCTEOSA-N 0 0 364.348 3.697 20 5 FHBDRN CC(C)c1nc2c(n1C)CCN(C(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1)C2 ZINC000189791044 941281012 /nfs/dbraw/zinc/28/10/12/941281012.db2.gz HQKZCLYUJHVOQS-UHFFFAOYSA-N 0 0 370.453 3.774 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2ccc(CN3CCO[C@H](CF)C3)o2)c(Cl)c1 ZINC000414472599 941295729 /nfs/dbraw/zinc/29/57/29/941295729.db2.gz SSRXMTHDNSYDFE-CYBMUJFWSA-N 0 0 354.765 3.679 20 5 FHBDRN COC[C@H](Cc1ccccc1)N(C)C(=O)Nc1cc([N+](=O)[O-])c(C)cc1C ZINC000189896017 941296263 /nfs/dbraw/zinc/29/62/63/941296263.db2.gz KJAJWYIUMCVHMJ-KRWDZBQOSA-N 0 0 371.437 3.933 20 5 FHBDRN CCCOc1ccc2c(c1)CCN(C(=O)Nc1cccc([N+](=O)[O-])c1)C2 ZINC000178822941 941307498 /nfs/dbraw/zinc/30/74/98/941307498.db2.gz IZOKGBWGDLZFMO-UHFFFAOYSA-N 0 0 355.394 3.974 20 5 FHBDRN CCCCn1ncc(NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)c1C ZINC000122244275 941309587 /nfs/dbraw/zinc/30/95/87/941309587.db2.gz NDKBKXFELFCBLV-UHFFFAOYSA-N 0 0 357.414 3.726 20 5 FHBDRN CSc1cccc(C(=O)N2CC3(CCCC3)OC(C)(C)C2)c1[N+](=O)[O-] ZINC000189961305 941313727 /nfs/dbraw/zinc/31/37/27/941313727.db2.gz SJAVSIKYANBXKN-UHFFFAOYSA-N 0 0 364.467 3.881 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CSCc1nnc(C2CC2)n1C1CC1 ZINC000782947893 941324901 /nfs/dbraw/zinc/32/49/01/941324901.db2.gz NLHSPNOAHVHHDL-UHFFFAOYSA-N 0 0 360.439 3.841 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)N[C@@H]1CSc2ccccc21 ZINC000549110311 941328956 /nfs/dbraw/zinc/32/89/56/941328956.db2.gz GFPKFOKKKIXTFW-MRXNPFEDSA-N 0 0 357.435 3.626 20 5 FHBDRN O=C(C[C@H]1CCC[C@@H](C(F)(F)F)O1)N1CCCc2ccc([N+](=O)[O-])cc21 ZINC001125848653 941342024 /nfs/dbraw/zinc/34/20/24/941342024.db2.gz VOYADFFIQXWZQI-HIFRSBDPSA-N 0 0 372.343 3.764 20 5 FHBDRN C[C@H](NC(=O)CCc1c(Cl)cccc1[N+](=O)[O-])c1c(F)cncc1F ZINC000935967638 941379878 /nfs/dbraw/zinc/37/98/78/941379878.db2.gz FZNBWZLHDJKNML-VIFPVBQESA-N 0 0 369.755 3.731 20 5 FHBDRN O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)N1CCC([C@@H]2CCOC2)CC1 ZINC000376864185 941454599 /nfs/dbraw/zinc/45/45/99/941454599.db2.gz LEGWVBOHDOTIKM-GFCCVEGCSA-N 0 0 353.806 3.529 20 5 FHBDRN CCCN(C(=O)c1ccc([N+](=O)[O-])cc1F)[C@H]1C[C@H](OCC)C1(C)C ZINC000564449464 941457084 /nfs/dbraw/zinc/45/70/84/941457084.db2.gz IDMGKMFLDPJOIS-HOTGVXAUSA-N 0 0 352.406 3.790 20 5 FHBDRN CC(=O)Nc1cc(N[C@@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)ccc1C ZINC000472649205 941471141 /nfs/dbraw/zinc/47/11/41/941471141.db2.gz TXDKLCBDQRMWNC-NVXWUHKLSA-N 0 0 357.414 3.654 20 5 FHBDRN CC(=O)N1C[C@H](CCC(=O)Nc2ccc(F)c([N+](=O)[O-])c2)c2ccccc21 ZINC000376956372 941477408 /nfs/dbraw/zinc/47/74/08/941477408.db2.gz RKWTYZRWHHKHIB-ZDUSSCGKSA-N 0 0 371.368 3.603 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N1CCC(C2CCOCC2)CC1 ZINC000377003079 941488104 /nfs/dbraw/zinc/48/81/04/941488104.db2.gz ZEMAVQXIHKGJIC-UHFFFAOYSA-N 0 0 361.442 3.882 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NCc1ncoc1-c1ccccc1 ZINC000376993211 941489013 /nfs/dbraw/zinc/48/90/13/941489013.db2.gz MDZNZYDKAUNDQZ-UHFFFAOYSA-N 0 0 368.349 3.580 20 5 FHBDRN O=C(COc1ccccc1[N+](=O)[O-])N1CCC[C@@H](c2ccccc2)CC1 ZINC000066765469 941515570 /nfs/dbraw/zinc/51/55/70/941515570.db2.gz HMFSQHQLSBMVQX-QGZVFWFLSA-N 0 0 354.406 3.770 20 5 FHBDRN Cc1nn(CCC(=O)N2CCC[C@@H](c3ccccc3)CC2)c(C)c1[N+](=O)[O-] ZINC000066762587 941515982 /nfs/dbraw/zinc/51/59/82/941515982.db2.gz XJQYIHQRHOIJCL-GOSISDBHSA-N 0 0 370.453 3.595 20 5 FHBDRN CCNc1ccc(Cl)cc1C(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000549144831 941525367 /nfs/dbraw/zinc/52/53/67/941525367.db2.gz JHTKWSBRBWKJQP-UHFFFAOYSA-N 0 0 361.829 3.995 20 5 FHBDRN C[C@H](N[C@@H](C)c1cccc(O)c1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000181534850 941530281 /nfs/dbraw/zinc/53/02/81/941530281.db2.gz SEVMWRIXGMCKFW-RYUDHWBXSA-N 0 0 354.366 3.762 20 5 FHBDRN COc1ccccc1[C@H]1CCCN1C(=O)Nc1ccc(OC)c([N+](=O)[O-])c1 ZINC000541106282 941600054 /nfs/dbraw/zinc/60/00/54/941600054.db2.gz NTXZBATVWYYKTO-OAHLLOKOSA-N 0 0 371.393 3.981 20 5 FHBDRN Cc1cc(-c2nc(Cc3ccc(-n4cccn4)cc3)no2)cc([N+](=O)[O-])c1 ZINC000544102070 941619601 /nfs/dbraw/zinc/61/96/01/941619601.db2.gz BQGLBKFMGXJXOM-UHFFFAOYSA-N 0 0 361.361 3.730 20 5 FHBDRN O=C(c1cnc2n1CCCCC2)N1CCCCc2cc([N+](=O)[O-])ccc21 ZINC000892853011 941619932 /nfs/dbraw/zinc/61/99/32/941619932.db2.gz HCQYWIQNRGPHLT-UHFFFAOYSA-N 0 0 354.410 3.501 20 5 FHBDRN C[C@@H](NS(=O)(=O)Cc1ccccc1[N+](=O)[O-])[C@@H](C)C1CCCCC1 ZINC000545365954 941643311 /nfs/dbraw/zinc/64/33/11/941643311.db2.gz AFKIFECPLUBLLH-ZIAGYGMSSA-N 0 0 354.472 3.619 20 5 FHBDRN O=[N+]([O-])c1c(N2CC[C@@H](OCCCc3ccccc3)C2)nc2sccn21 ZINC000431842026 941670914 /nfs/dbraw/zinc/67/09/14/941670914.db2.gz SFTLGZFJAZZEHG-OAHLLOKOSA-N 0 0 372.450 3.532 20 5 FHBDRN CC(C)(CCC(=O)OCC(=O)Nc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC001125859086 941682665 /nfs/dbraw/zinc/68/26/65/941682665.db2.gz KQRUWIWSYXJDKS-UHFFFAOYSA-N 0 0 370.405 3.835 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N[C@@H]1CCCc2cc(N)ccc21 ZINC000415251735 941703326 /nfs/dbraw/zinc/70/33/26/941703326.db2.gz AAYLLPJDPAFCIL-MRXNPFEDSA-N 0 0 354.410 3.993 20 5 FHBDRN C[C@H](CC(=O)O[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)n1cccc1 ZINC000729291518 941711247 /nfs/dbraw/zinc/71/12/47/941711247.db2.gz SZIDXMLJBNUZDL-OLZOCXBDSA-N 0 0 370.365 3.702 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NCc1ccc(Cl)nc1 ZINC000171427989 941716815 /nfs/dbraw/zinc/71/68/15/941716815.db2.gz WOCXPGHJLHVUAV-UHFFFAOYSA-N 0 0 362.817 3.763 20 5 FHBDRN Cc1csc(CCC(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)n1 ZINC000436038163 941718706 /nfs/dbraw/zinc/71/87/06/941718706.db2.gz LHTPHSQEEQURQT-UHFFFAOYSA-N 0 0 359.329 3.950 20 5 FHBDRN C[C@@H]1CN(C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2N(C)C1=O ZINC000365569081 941728022 /nfs/dbraw/zinc/72/80/22/941728022.db2.gz VLIDDZDPABXMNQ-LLVKDONJSA-N 0 0 373.796 3.508 20 5 FHBDRN O=C(N[C@@H](c1ccccc1)C1CCC1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000729377650 941741915 /nfs/dbraw/zinc/74/19/15/941741915.db2.gz GGWIQNWDOMTNQT-KRWDZBQOSA-N 0 0 355.350 3.774 20 5 FHBDRN O=[N+]([O-])c1cc2ccccc2nc1N1CCO[C@@]2(CCc3ccccc32)C1 ZINC000473520997 941744220 /nfs/dbraw/zinc/74/42/20/941744220.db2.gz JGZCTPPPFVLXIX-NRFANRHFSA-N 0 0 361.401 3.821 20 5 FHBDRN C[C@H](NC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)c1cccs1 ZINC000052960476 941757524 /nfs/dbraw/zinc/75/75/24/941757524.db2.gz ASCMUXVRXDOJBH-NSHDSACASA-N 0 0 356.407 3.548 20 5 FHBDRN C[C@H]1CCC[C@H](C)N1C(=O)COc1ccc(Br)cc1[N+](=O)[O-] ZINC000151149477 941761867 /nfs/dbraw/zinc/76/18/67/941761867.db2.gz QMSKEFICTWNTCS-QWRGUYRKSA-N 0 0 371.231 3.526 20 5 FHBDRN Cc1ccc([C@@H](C)N(C)S(=O)(=O)Cc2ccccc2[N+](=O)[O-])c(C)c1 ZINC000545384515 941765711 /nfs/dbraw/zinc/76/57/11/941765711.db2.gz GDIBTWHWDSXMNQ-OAHLLOKOSA-N 0 0 362.451 3.734 20 5 FHBDRN C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CCC[C@H]1c1nccs1 ZINC000377503252 941769819 /nfs/dbraw/zinc/76/98/19/941769819.db2.gz RFQQKLFYSVRGFD-FZMZJTMJSA-N 0 0 371.422 3.999 20 5 FHBDRN COc1ccc(CNC(=O)Cc2coc3c2ccc(C)c3C)cc1[N+](=O)[O-] ZINC000513176188 941771689 /nfs/dbraw/zinc/77/16/89/941771689.db2.gz OQEOKBOOWLGEQC-UHFFFAOYSA-N 0 0 368.389 3.825 20 5 FHBDRN CN(Cc1cc(Cl)ccc1F)C(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000433566922 941771759 /nfs/dbraw/zinc/77/17/59/941771759.db2.gz YFZNZGRECROGES-UHFFFAOYSA-N 0 0 365.792 3.771 20 5 FHBDRN C[C@H](Nc1ncc([N+](=O)[O-])cc1Br)c1ccc(Cl)cn1 ZINC000549258546 941775367 /nfs/dbraw/zinc/77/53/67/941775367.db2.gz JPNKGUYPJSNUTG-ZETCQYMHSA-N 0 0 357.595 3.974 20 5 FHBDRN CC1(C)CC[C@@H](C(=O)N(CC2CC2)c2ccc(Cl)c([N+](=O)[O-])c2)O1 ZINC000783030745 941779932 /nfs/dbraw/zinc/77/99/32/941779932.db2.gz YWJUBTRYLGGOMC-HNNXBMFYSA-N 0 0 352.818 3.949 20 5 FHBDRN CCC(=O)c1cccc(NS(=O)(=O)c2c(C)cc([N+](=O)[O-])cc2C)c1 ZINC000433596687 941782864 /nfs/dbraw/zinc/78/28/64/941782864.db2.gz PJBSSQBIUJYKHD-UHFFFAOYSA-N 0 0 362.407 3.605 20 5 FHBDRN C[C@@H]1CC(CCNc2ncc(Br)cc2[N+](=O)[O-])C[C@@H](C)O1 ZINC000549261655 941785295 /nfs/dbraw/zinc/78/52/95/941785295.db2.gz UTEZYWVIVIHQBB-NXEZZACHSA-N 0 0 358.236 3.758 20 5 FHBDRN O=C(NCCNc1ccc([N+](=O)[O-])cc1)c1nc(-c2ccccc2)cs1 ZINC000513197923 941786420 /nfs/dbraw/zinc/78/64/20/941786420.db2.gz WKWOVNKGEWKAMA-UHFFFAOYSA-N 0 0 368.418 3.560 20 5 FHBDRN CS[C@H]1CCC[C@@H](NC(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)C1 ZINC000412113541 941794741 /nfs/dbraw/zinc/79/47/41/941794741.db2.gz DALKJEPVXNCUJY-KGLIPLIRSA-N 0 0 352.456 3.786 20 5 FHBDRN CC(=O)CCC(C)(C)c1nc(Cc2c[nH]c3ccc([N+](=O)[O-])cc23)no1 ZINC000472799770 941814323 /nfs/dbraw/zinc/81/43/23/941814323.db2.gz OXKYQCHNJKKNKQ-UHFFFAOYSA-N 0 0 356.382 3.697 20 5 FHBDRN COc1ccc(F)cc1NC(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-] ZINC000513254528 941820439 /nfs/dbraw/zinc/82/04/39/941820439.db2.gz ADVKVGFRQIOYTP-UHFFFAOYSA-N 0 0 366.370 3.725 20 5 FHBDRN Cc1cc(Cl)c(C(=O)Nc2ccccc2C[S@@](C)=O)cc1[N+](=O)[O-] ZINC001267661032 941820571 /nfs/dbraw/zinc/82/05/71/941820571.db2.gz WIPFVRZEIALSIH-XMMPIXPASA-N 0 0 366.826 3.687 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN1C[C@@H](C)C[C@H]1c1ccccc1 ZINC000513257435 941821288 /nfs/dbraw/zinc/82/12/88/941821288.db2.gz QTHFMJNGIHPREW-KSSFIOAISA-N 0 0 369.421 3.625 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N1CCCc2cc[nH]c(=O)c21 ZINC000892972549 941823410 /nfs/dbraw/zinc/82/34/10/941823410.db2.gz DCWLARFGPFRNHB-UHFFFAOYSA-N 0 0 373.434 3.789 20 5 FHBDRN CCC(CC)n1ccc(CSCc2ccc(C(N)=O)cc2[N+](=O)[O-])n1 ZINC000433662782 941824592 /nfs/dbraw/zinc/82/45/92/941824592.db2.gz FTIKCAAPYPYZCW-UHFFFAOYSA-N 0 0 362.455 3.685 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N[C@@H](c2ccc(Cl)cc2)C2CC2)c1[N+](=O)[O-] ZINC000433682834 941832512 /nfs/dbraw/zinc/83/25/12/941832512.db2.gz AKDUHQJYFTXENI-CQSZACIVSA-N 0 0 362.817 3.976 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N(C)[C@@H](C)Cc2ccc(C)cc2)c1F ZINC000412138344 941833539 /nfs/dbraw/zinc/83/35/39/941833539.db2.gz ZGRPBSSXNVPIBG-AWEZNQCLSA-N 0 0 374.412 3.683 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)NC2CCC(c3ccccc3)CC2)c1[N+](=O)[O-] ZINC000433692764 941843578 /nfs/dbraw/zinc/84/35/78/941843578.db2.gz FXMPPEXJNOSRPO-UHFFFAOYSA-N 0 0 356.426 3.898 20 5 FHBDRN CO[C@@H](C(=O)Nc1ccc(OCc2ccccc2)cc1[N+](=O)[O-])C1CC1 ZINC000415484701 941849991 /nfs/dbraw/zinc/84/99/91/941849991.db2.gz IEXVFJKKFCPCSJ-GOSISDBHSA-N 0 0 356.378 3.537 20 5 FHBDRN CCN(C(=O)c1ccc(SCCC(C)C)c([N+](=O)[O-])c1)[C@@H](C)CO ZINC000513317215 941850778 /nfs/dbraw/zinc/85/07/78/941850778.db2.gz RNJKGQGLZDCJIG-ZDUSSCGKSA-N 0 0 354.472 3.576 20 5 FHBDRN COc1ccc(F)c2[nH]c(C(=O)N(C)CCc3cccc([N+](=O)[O-])c3)cc21 ZINC000513340128 941853612 /nfs/dbraw/zinc/85/36/12/941853612.db2.gz ZIXDNCKVPFUTQY-UHFFFAOYSA-N 0 0 371.368 3.539 20 5 FHBDRN O=C(NC[C@H]1SCCc2ccccc21)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412171609 941861317 /nfs/dbraw/zinc/86/13/17/941861317.db2.gz UNLIROBMYQZSOM-IPMKNSEASA-N 0 0 368.458 3.845 20 5 FHBDRN CCSCC[C@H](C)N(C)C(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1 ZINC000412171880 941861652 /nfs/dbraw/zinc/86/16/52/941861652.db2.gz FHYHEZGQQRDSSV-ZDUSSCGKSA-N 0 0 354.472 3.986 20 5 FHBDRN O=C(Nc1ccc2c(c1)C(=O)CCC2)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412174191 941863073 /nfs/dbraw/zinc/86/30/73/941863073.db2.gz HZVILXFMHHNVJT-FUHWJXTLSA-N 0 0 350.374 3.856 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)c1cc(-c2cccs2)on1 ZINC000513344338 941865588 /nfs/dbraw/zinc/86/55/88/941865588.db2.gz ZKKAPYRBEDRAIG-UHFFFAOYSA-N 0 0 357.391 3.626 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CCCN(C)c3cc(F)ccc32)c1 ZINC000549296244 941867938 /nfs/dbraw/zinc/86/79/38/941867938.db2.gz UDMOJGNDCYMHDR-UHFFFAOYSA-N 0 0 373.384 3.619 20 5 FHBDRN C[C@H]([C@@H]1Cc2ccccc2O1)N(C)C(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000119216354 941870810 /nfs/dbraw/zinc/87/08/10/941870810.db2.gz BZMAMSRRSXFPDO-BLVKFPJESA-N 0 0 365.389 3.540 20 5 FHBDRN COC(=O)c1cc(NC(=O)[C@@H]2C[C@@]2(F)c2ccccc2)c(C)c([N+](=O)[O-])c1 ZINC000415519449 941873743 /nfs/dbraw/zinc/87/37/43/941873743.db2.gz PASLGPMTSNWDRT-IFXJQAMLSA-N 0 0 372.352 3.513 20 5 FHBDRN O=[N+]([O-])c1cccc(Cl)c1CN1CCC(OC[C@@H]2CCCCO2)CC1 ZINC000119300908 941877473 /nfs/dbraw/zinc/87/74/73/941877473.db2.gz MJJJXCQQZSNGHD-HNNXBMFYSA-N 0 0 368.861 3.798 20 5 FHBDRN Cc1cn([C@@H](C)c2ccccc2)[nH]c1=NC(=O)c1cccc(C)c1[N+](=O)[O-] ZINC000472824553 941880563 /nfs/dbraw/zinc/88/05/63/941880563.db2.gz LYAQNOSFSSFJFV-HNNXBMFYSA-N 0 0 364.405 3.692 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2nc3cc(Cl)ccc3n2C)c1 ZINC000549299667 941882135 /nfs/dbraw/zinc/88/21/35/941882135.db2.gz KMIJTPDTOZCPOZ-UHFFFAOYSA-N 0 0 374.784 3.786 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N2CCS[C@@H](C)[C@@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000433774001 941891834 /nfs/dbraw/zinc/89/18/34/941891834.db2.gz JQATXORCOVHWCU-BLLLJJGKSA-N 0 0 374.466 3.760 20 5 FHBDRN COc1ccc(CNC(=O)N2CCC[C@H]2C2CCCCC2)cc1[N+](=O)[O-] ZINC000517499043 941895626 /nfs/dbraw/zinc/89/56/26/941895626.db2.gz QKQYLRDFHDFVHZ-INIZCTEOSA-N 0 0 361.442 3.858 20 5 FHBDRN O=C(N[C@H]1COc2ccc(Cl)cc21)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412194664 941897373 /nfs/dbraw/zinc/89/73/73/941897373.db2.gz QEZMDZUSSFRIJN-LZWOXQAQSA-N 0 0 358.781 3.602 20 5 FHBDRN O=C([C@H]1C[C@@]1(F)c1ccccc1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000412201857 941904833 /nfs/dbraw/zinc/90/48/33/941904833.db2.gz KDGAKOUNZYDPOE-YLJYHZDGSA-N 0 0 354.381 3.971 20 5 FHBDRN CCCCn1ncc(NC(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)c1C ZINC000412209221 941908316 /nfs/dbraw/zinc/90/83/16/941908316.db2.gz XVTDWNMJFDKVPS-UHFFFAOYSA-N 0 0 360.414 3.939 20 5 FHBDRN CCNc1ccc(C(=O)NCC(C)(C)Oc2ccccc2)cc1[N+](=O)[O-] ZINC000513427161 941915615 /nfs/dbraw/zinc/91/56/15/941915615.db2.gz PQKSMTDKNUAFEY-UHFFFAOYSA-N 0 0 357.410 3.614 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CC=C(C(F)(F)F)CC2)ccc1[N+](=O)[O-] ZINC000412215780 941919485 /nfs/dbraw/zinc/91/94/85/941919485.db2.gz MUNCGPKTXGBMIS-UHFFFAOYSA-N 0 0 358.316 3.717 20 5 FHBDRN Cc1c(CC(=O)N[C@H]2CCO[C@@H]2c2ccc(Cl)cc2)cccc1[N+](=O)[O-] ZINC000182451175 941926043 /nfs/dbraw/zinc/92/60/43/941926043.db2.gz JVIKJRHQWCXVQS-QFBILLFUSA-N 0 0 374.824 3.746 20 5 FHBDRN Cc1cn([C@H](C)c2ccccc2)[nH]c1=NC(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000472843142 941926185 /nfs/dbraw/zinc/92/61/85/941926185.db2.gz ZOMRSZAUVBSGRW-OAHLLOKOSA-N 0 0 364.405 3.692 20 5 FHBDRN CC(C)Oc1cc(C(=O)N(C)[C@@H](CCO)c2ccccc2)ccc1[N+](=O)[O-] ZINC000412219177 941927159 /nfs/dbraw/zinc/92/71/59/941927159.db2.gz AQQFCULSCCFHCK-KRWDZBQOSA-N 0 0 372.421 3.578 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CCc2ccc(Cl)cc2C1 ZINC000412219048 941927163 /nfs/dbraw/zinc/92/71/63/941927163.db2.gz NPOJXZLDKQDTJJ-ZWKOTPCHSA-N 0 0 356.809 3.937 20 5 FHBDRN O=C(COc1cccc2cccnc21)N1CCCc2ccc([N+](=O)[O-])cc21 ZINC000182477981 941933776 /nfs/dbraw/zinc/93/37/76/941933776.db2.gz NWYGNGPKJDGCHZ-UHFFFAOYSA-N 0 0 363.373 3.501 20 5 FHBDRN CC(C)=CCOc1cccc(CC(=O)N(C)c2ccc([N+](=O)[O-])nc2)c1 ZINC000415595732 941934902 /nfs/dbraw/zinc/93/49/02/941934902.db2.gz RHHBGLIUVAMBSI-UHFFFAOYSA-N 0 0 355.394 3.540 20 5 FHBDRN Cc1cc(F)c2[nH]c(=O)cc(C(=O)N(C)c3ccc([N+](=O)[O-])cc3)c2c1 ZINC000182497187 941935350 /nfs/dbraw/zinc/93/53/50/941935350.db2.gz FKKLOWGUYVIZMJ-UHFFFAOYSA-N 0 0 355.325 3.573 20 5 FHBDRN COc1cccc2[nH]cc(CC(=O)Nc3c(C)ccc([N+](=O)[O-])c3C)c21 ZINC000182529381 941940024 /nfs/dbraw/zinc/94/00/24/941940024.db2.gz QLGLTXYQRJLYAG-UHFFFAOYSA-N 0 0 353.378 3.883 20 5 FHBDRN CC(C)c1[nH]nc(C(=O)Nc2nc(-c3ccccc3)cs2)c1[N+](=O)[O-] ZINC000433854534 941942909 /nfs/dbraw/zinc/94/29/09/941942909.db2.gz PAKLCKGDJQGZTE-UHFFFAOYSA-N 0 0 357.395 3.817 20 5 FHBDRN CN(C)c1ccccc1N(C)C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000182569804 941944750 /nfs/dbraw/zinc/94/47/50/941944750.db2.gz IRXYBBXHQGFRNM-UHFFFAOYSA-N 0 0 365.336 3.539 20 5 FHBDRN COc1ccc([C@H](NC(=O)c2csc([N+](=O)[O-])c2)C(F)(F)F)cc1 ZINC000182589780 941945619 /nfs/dbraw/zinc/94/56/19/941945619.db2.gz ZSTIIZJDSAEGJZ-LBPRGKRZSA-N 0 0 360.313 3.698 20 5 FHBDRN CC(C)N(Cc1cccc(Br)c1)C(=O)c1ccc([N+](=O)[O-])[nH]1 ZINC000513460280 941947989 /nfs/dbraw/zinc/94/79/89/941947989.db2.gz NGLPXZWVGUMXFE-UHFFFAOYSA-N 0 0 366.215 3.736 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N(C)Cc2cccc(C(F)(F)F)c2)c1[N+](=O)[O-] ZINC000433850958 941948765 /nfs/dbraw/zinc/94/87/65/941948765.db2.gz FSMOZFOJDZSPIK-UHFFFAOYSA-N 0 0 370.331 3.732 20 5 FHBDRN C[C@H]1COc2ccccc2CN1C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412238768 941950367 /nfs/dbraw/zinc/95/03/67/941950367.db2.gz AXCMDOFDBOWVGT-DOPJRALCSA-N 0 0 352.390 3.508 20 5 FHBDRN COc1ccccc1O[C@@H]1CCCN(C(=O)Nc2cccc([N+](=O)[O-])c2)C1 ZINC000513472598 941952815 /nfs/dbraw/zinc/95/28/15/941952815.db2.gz HXQPFBDDQBLZCR-MRXNPFEDSA-N 0 0 371.393 3.679 20 5 FHBDRN Cc1ccc(C(=O)N2CCN([C@@H](C)c3cc([N+](=O)[O-])ccc3C)CC2)s1 ZINC000182683674 941952880 /nfs/dbraw/zinc/95/28/80/941952880.db2.gz QKGFFZUAQCUFPL-HNNXBMFYSA-N 0 0 373.478 3.792 20 5 FHBDRN COC(=O)c1cc(NC(=O)c2c(Cl)cccc2[N+](=O)[O-])c(C)cc1C ZINC000472852310 941956285 /nfs/dbraw/zinc/95/62/85/941956285.db2.gz QYNKJXHBCYMGEL-UHFFFAOYSA-N 0 0 362.769 3.904 20 5 FHBDRN CSc1ccc(C(=O)Nc2ccc(OC(F)F)nc2)cc1[N+](=O)[O-] ZINC000549323819 941956428 /nfs/dbraw/zinc/95/64/28/941956428.db2.gz XVJBBDIOUKSBIH-UHFFFAOYSA-N 0 0 355.322 3.565 20 5 FHBDRN Cc1cnc([C@@H](C)CNC(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)s1 ZINC000412250228 941959830 /nfs/dbraw/zinc/95/98/30/941959830.db2.gz KKCOUNURCGVQNT-NSHDSACASA-N 0 0 363.439 3.680 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1C[C@H]1c1ccccc1OC ZINC000415626567 941963092 /nfs/dbraw/zinc/96/30/92/941963092.db2.gz RANPDJWPBSSBGZ-LSDHHAIUSA-N 0 0 356.378 3.744 20 5 FHBDRN C[C@@H](O)C[C@H]1CCCCCN1C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000513497464 941963442 /nfs/dbraw/zinc/96/34/42/941963442.db2.gz XFMVUOOEKPPTRV-VXGBXAGGSA-N 0 0 355.822 3.796 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)N2CCC(c3cn[nH]c3)CC2)cc1[N+](=O)[O-] ZINC000377753254 941963702 /nfs/dbraw/zinc/96/37/02/941963702.db2.gz DMHYLVVOQVOQKN-UHFFFAOYSA-N 0 0 356.426 3.635 20 5 FHBDRN Cc1cc(NC(=O)N2C[C@H](C)O[C@@H](c3ccsc3)C2)ccc1[N+](=O)[O-] ZINC000182763237 941965641 /nfs/dbraw/zinc/96/56/41/941965641.db2.gz NLDPJEUJCXXDIC-BLLLJJGKSA-N 0 0 361.423 3.959 20 5 FHBDRN C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412257296 941992981 /nfs/dbraw/zinc/99/29/81/941992981.db2.gz ILZNRULLXVGQGV-AQNFWKISSA-N 0 0 356.344 3.888 20 5 FHBDRN CC(C)Oc1cc(C(=O)Nc2cnn([C@H](C)C3CC3)c2)ccc1[N+](=O)[O-] ZINC000412260154 941997218 /nfs/dbraw/zinc/99/72/18/941997218.db2.gz MULRQRAXDNIJPX-GFCCVEGCSA-N 0 0 358.398 3.802 20 5 FHBDRN Cc1nc([C@H]2CCCN2C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)cs1 ZINC000412261217 941997750 /nfs/dbraw/zinc/99/77/50/941997750.db2.gz UKNDFURROMQUFS-ZMSDIMECSA-N 0 0 357.435 3.827 20 5 FHBDRN C[C@H]1C[C@@H](c2cccs2)CN1C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000377805579 942003574 /nfs/dbraw/zinc/00/35/74/942003574.db2.gz VTTRKDSVSZGUHK-WDEREUQCSA-N 0 0 356.407 3.551 20 5 FHBDRN Cc1c(CNC(=O)N2CCS[C@@H](c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000616313108 942017996 /nfs/dbraw/zinc/01/79/96/942017996.db2.gz PYVMNSCXYCPOFM-GOSISDBHSA-N 0 0 371.462 3.903 20 5 FHBDRN O=C(N[C@@H]1C[C@H]1c1cccc(F)c1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000433960996 942018875 /nfs/dbraw/zinc/01/88/75/942018875.db2.gz QOTMKRRVDWGZEN-DOTOQJQBSA-N 0 0 355.369 3.594 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N1CC=C(c2ccnc3[nH]ccc32)CC1 ZINC000365711144 942019044 /nfs/dbraw/zinc/01/90/44/942019044.db2.gz XKACIZUHYOXAPB-UHFFFAOYSA-N 0 0 362.389 3.709 20 5 FHBDRN Cc1c(NC(=O)N2CCCN3c4ccccc4C[C@@H]3C2)cccc1[N+](=O)[O-] ZINC000290344294 942020344 /nfs/dbraw/zinc/02/03/44/942020344.db2.gz ILEJJVFUZKNXIQ-MRXNPFEDSA-N 0 0 366.421 3.572 20 5 FHBDRN C[C@@H](c1cccc([N+](=O)[O-])c1)N1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1 ZINC000101921559 942025289 /nfs/dbraw/zinc/02/52/89/942025289.db2.gz KJYFOGPOLWOWSO-GUYCJALGSA-N 0 0 372.400 3.691 20 5 FHBDRN CC(C)(C)c1ncc(C(=O)Nc2cc(-c3cccc([N+](=O)[O-])c3)[nH]n2)s1 ZINC000101949719 942027727 /nfs/dbraw/zinc/02/77/27/942027727.db2.gz MQFBGEFRHVYMKF-UHFFFAOYSA-N 0 0 371.422 3.991 20 5 FHBDRN Cc1ccccc1C[C@@H]1CCCN1C(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000513575274 942029010 /nfs/dbraw/zinc/02/90/10/942029010.db2.gz VLTGFQJZGQCMSZ-SFHVURJKSA-N 0 0 354.406 3.516 20 5 FHBDRN O=C(NC[C@H]1CCCN(c2ccccc2)C1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000434005199 942029376 /nfs/dbraw/zinc/02/93/76/942029376.db2.gz FWEBQPVDKOOHTL-CQSZACIVSA-N 0 0 373.840 3.895 20 5 FHBDRN Cc1nn(C)cc1[C@@H]1CCCN1C(=O)Nc1cccc([N+](=O)[O-])c1Cl ZINC000377846670 942033764 /nfs/dbraw/zinc/03/37/64/942033764.db2.gz FDVYHNMBXFCNKW-ZDUSSCGKSA-N 0 0 363.805 3.659 20 5 FHBDRN COC(=O)C[C@H]1CN(C(=O)c2ccc(Cl)cc2[N+](=O)[O-])c2ccccc21 ZINC000377862421 942039683 /nfs/dbraw/zinc/03/96/83/942039683.db2.gz WWRGQAKCRUTMBC-NSHDSACASA-N 0 0 374.780 3.555 20 5 FHBDRN Cc1ccccc1C1(O)CCN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)CC1 ZINC000377870867 942044226 /nfs/dbraw/zinc/04/42/26/942044226.db2.gz QBGYHCBIBRSKGD-UHFFFAOYSA-N 0 0 374.824 3.680 20 5 FHBDRN Cc1ccc2c(c1)CN(C(=O)COc1ccc([N+](=O)[O-])cc1)C(C)(C)C2 ZINC000513624422 942044279 /nfs/dbraw/zinc/04/42/79/942044279.db2.gz KHZHHEIPQPZAMP-UHFFFAOYSA-N 0 0 354.406 3.646 20 5 FHBDRN CCN(C(=O)c1ccc([N+](=O)[O-])cc1C)c1ccc(Br)cn1 ZINC000102254744 942048150 /nfs/dbraw/zinc/04/81/50/942048150.db2.gz WNOOEPMPURLLOV-UHFFFAOYSA-N 0 0 364.199 3.727 20 5 FHBDRN Cc1nc(C)c(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)s1 ZINC000434053835 942056999 /nfs/dbraw/zinc/05/69/99/942056999.db2.gz QTJXYWWBUIBFEV-UHFFFAOYSA-N 0 0 363.442 3.867 20 5 FHBDRN COc1c(C(=O)N2Cc3cc(C)ccc3CC2(C)C)cccc1[N+](=O)[O-] ZINC000513653265 942057185 /nfs/dbraw/zinc/05/71/85/942057185.db2.gz QIYLXZHBQWIHAQ-UHFFFAOYSA-N 0 0 354.406 3.889 20 5 FHBDRN O=C(Nc1ccc(-n2cccn2)cc1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513657961 942059862 /nfs/dbraw/zinc/05/98/62/942059862.db2.gz NFZNGBWNUCUFSY-UHFFFAOYSA-N 0 0 374.303 3.634 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)Nc1cncc(Cl)c1Cl ZINC000480832108 942061633 /nfs/dbraw/zinc/06/16/33/942061633.db2.gz RRZKPKRHPRXVFS-UHFFFAOYSA-N 0 0 365.176 3.890 20 5 FHBDRN Cc1n[nH]c2cc(NC(=O)c3cc([N+](=O)[O-])ccc3OC(F)F)ccc12 ZINC000183013538 942064204 /nfs/dbraw/zinc/06/42/04/942064204.db2.gz IQJLDEJLUKBJBL-UHFFFAOYSA-N 0 0 362.292 3.633 20 5 FHBDRN Cn1ccnc1[C@@H](NC1CC(c2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000513673376 942067364 /nfs/dbraw/zinc/06/73/64/942067364.db2.gz QCQPHZFNAKONFE-QLOJAFMTSA-N 0 0 362.433 3.954 20 5 FHBDRN CC(C)(C(=O)Nc1ccc(Br)cn1)c1ccc([N+](=O)[O-])cc1 ZINC000026511470 942068576 /nfs/dbraw/zinc/06/85/76/942068576.db2.gz XRNYGQGTJVGWDO-UHFFFAOYSA-N 0 0 364.199 3.669 20 5 FHBDRN CCN(C(=O)COc1ccc(F)cc1[N+](=O)[O-])[C@@H](C)c1ccc(F)cc1 ZINC000102599515 942072496 /nfs/dbraw/zinc/07/24/96/942072496.db2.gz UUWCGLRCWAEVOK-LBPRGKRZSA-N 0 0 364.348 3.862 20 5 FHBDRN CCOc1ccc(-c2noc(COc3ccc(F)cc3[N+](=O)[O-])n2)cc1 ZINC000102599658 942072634 /nfs/dbraw/zinc/07/26/34/942072634.db2.gz LTYPLVXVBSSGRW-UHFFFAOYSA-N 0 0 359.313 3.762 20 5 FHBDRN C[C@H](NC(=O)Nc1cc(-c2ccccc2F)on1)c1cccc([N+](=O)[O-])c1 ZINC000434082546 942072682 /nfs/dbraw/zinc/07/26/82/942072682.db2.gz XVNGIHJZPVHRDB-NSHDSACASA-N 0 0 370.340 3.694 20 5 FHBDRN C[C@@H]1COc2ccccc2N1C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000183050958 942073196 /nfs/dbraw/zinc/07/31/96/942073196.db2.gz XYFWZSQBVOHZRI-SNVBAGLBSA-N 0 0 364.304 3.624 20 5 FHBDRN Cc1ncsc1CCc1nc(-c2ccc([N+](=O)[O-])c3c2CCCN3)no1 ZINC000420501941 942084678 /nfs/dbraw/zinc/08/46/78/942084678.db2.gz PVNLJYCHQIHCTJ-UHFFFAOYSA-N 0 0 371.422 3.553 20 5 FHBDRN CC(C)CCCCc1nc(-c2ccc(-n3cncn3)c([N+](=O)[O-])c2)no1 ZINC000420503999 942087226 /nfs/dbraw/zinc/08/72/26/942087226.db2.gz NFLYILLIVKCEJD-UHFFFAOYSA-N 0 0 356.386 3.594 20 5 FHBDRN CCC(=O)c1ccc(N[C@H]2CCO[C@@]3(CCSC3)C2)c([N+](=O)[O-])c1 ZINC000280037821 942092527 /nfs/dbraw/zinc/09/25/27/942092527.db2.gz AMCPNNAJDMVVJD-GUYCJALGSA-N 0 0 350.440 3.654 20 5 FHBDRN COc1c(O)ccc(CN[C@@H]2CC3(CCC3)Oc3ccccc32)c1[N+](=O)[O-] ZINC000893133413 942095541 /nfs/dbraw/zinc/09/55/41/942095541.db2.gz DNVDZZDXZYOOGS-OAHLLOKOSA-N 0 0 370.405 3.845 20 5 FHBDRN COc1cc(OC)cc(N(C)C(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)c1 ZINC000190095730 942098592 /nfs/dbraw/zinc/09/85/92/942098592.db2.gz DCBJJJPDLSBWIN-NSHDSACASA-N 0 0 362.357 3.518 20 5 FHBDRN CO[C@H]1CCC[C@@H](CC(=O)N(C)Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000280083005 942098757 /nfs/dbraw/zinc/09/87/57/942098757.db2.gz YNEWQOHFGKBAFX-DOMZBBRYSA-N 0 0 354.834 3.802 20 5 FHBDRN CC(C)C[C@@H]1C[C@@H](NC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])CCO1 ZINC000280068799 942101274 /nfs/dbraw/zinc/10/12/74/942101274.db2.gz HLVYXILRDZBCQP-QWHCGFSZSA-N 0 0 372.824 3.640 20 5 FHBDRN O=C(N[C@@H]1CCC[C@H]1O)c1cc([N+](=O)[O-])ccc1SCC1CCCC1 ZINC000183339976 942102106 /nfs/dbraw/zinc/10/21/06/942102106.db2.gz JEVAOZDHVFHVEC-HZPDHXFCSA-N 0 0 364.467 3.520 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1CCO[C@@H](c2ccccc2)C1 ZINC000280071496 942102206 /nfs/dbraw/zinc/10/22/06/942102206.db2.gz QKCXOSQKURBSSM-MAUKXSAKSA-N 0 0 370.405 3.644 20 5 FHBDRN CO[C@H]1CCCN(C(=O)c2ccc(Sc3ccc([N+](=O)[O-])cc3)cc2)C1 ZINC000501907660 942109407 /nfs/dbraw/zinc/10/94/07/942109407.db2.gz CFUJPAKCVIYCRW-INIZCTEOSA-N 0 0 372.446 3.997 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CCOc3c(F)cccc3C2)ccc1[N+](=O)[O-] ZINC000412306784 942110563 /nfs/dbraw/zinc/11/05/63/942110563.db2.gz PRBWGBSKLLHSTB-UHFFFAOYSA-N 0 0 374.368 3.556 20 5 FHBDRN CCCO[C@@H]1CCCN(C(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])CC1 ZINC000280142687 942114137 /nfs/dbraw/zinc/11/41/37/942114137.db2.gz MLNXTIGVMOPPKK-CYBMUJFWSA-N 0 0 372.824 3.738 20 5 FHBDRN Cc1cc(NC[C@H]2CC[C@H](C(N)=O)CC2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000420612611 942118718 /nfs/dbraw/zinc/11/87/18/942118718.db2.gz VLHBKQUCTYSMSH-XYPYZODXSA-N 0 0 359.348 3.626 20 5 FHBDRN CC[C@@H](C)c1ncc(NC(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)cn1 ZINC000412310136 942120973 /nfs/dbraw/zinc/12/09/73/942120973.db2.gz PXUHGPUQRXQJQB-GFCCVEGCSA-N 0 0 358.398 3.938 20 5 FHBDRN O=C(c1ccccc1)c1ccc(N2CC[C@@H](O)CC23CCC3)c([N+](=O)[O-])c1 ZINC000420629711 942126558 /nfs/dbraw/zinc/12/65/58/942126558.db2.gz CXTPOUWOBGFUGG-QGZVFWFLSA-N 0 0 366.417 3.710 20 5 FHBDRN CCOC(=O)c1ccnc(Nc2ccc(OC)c(SC)c2)c1[N+](=O)[O-] ZINC000413390143 942127798 /nfs/dbraw/zinc/12/77/98/942127798.db2.gz CMSJPSIMGCVYCM-UHFFFAOYSA-N 0 0 363.395 3.641 20 5 FHBDRN O=[N+]([O-])c1ccc(N[C@@H]2CCN(c3nc(C4CCCCC4)ns3)C2)nc1 ZINC000420618295 942134128 /nfs/dbraw/zinc/13/41/28/942134128.db2.gz WIBNJVDPTMTHGP-CYBMUJFWSA-N 0 0 374.470 3.580 20 5 FHBDRN O=C(c1cc(N2CC[C@@H](C3CCCC3)C2)ccc1[N+](=O)[O-])N1CCCC1 ZINC000420620057 942134187 /nfs/dbraw/zinc/13/41/87/942134187.db2.gz QBQXXYHNXGOMRR-MRXNPFEDSA-N 0 0 357.454 3.847 20 5 FHBDRN O=[N+]([O-])c1cc(S(=O)(=O)C(F)F)ccc1SCCC(F)(F)F ZINC000280233762 942141701 /nfs/dbraw/zinc/14/17/01/942141701.db2.gz LTXLNPCUKOQXLI-UHFFFAOYSA-N 0 0 365.301 3.636 20 5 FHBDRN CO[C@](C)([C@@H](C)NC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])C1CC1 ZINC000415917924 942142452 /nfs/dbraw/zinc/14/24/52/942142452.db2.gz KATXLHPWUKDUKM-RFAUZJTJSA-N 0 0 360.332 3.547 20 5 FHBDRN O=C(Cc1cc(F)c(Cl)cc1[N+](=O)[O-])N1CC[C@@H](CC(F)(F)F)C1 ZINC000280263177 942145176 /nfs/dbraw/zinc/14/51/76/942145176.db2.gz UHHLKYRLKRSYKJ-QMMMGPOBSA-N 0 0 368.714 3.731 20 5 FHBDRN Cc1c(C(=O)N(C)C2CCN(c3ccc(F)cc3)CC2)cccc1[N+](=O)[O-] ZINC000102910528 942145239 /nfs/dbraw/zinc/14/52/39/942145239.db2.gz ZHKZKOADLFOWQO-UHFFFAOYSA-N 0 0 371.412 3.783 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)Nc2ccc(-c3cc[nH]n3)cc2)c1 ZINC000063123460 942145457 /nfs/dbraw/zinc/14/54/57/942145457.db2.gz OVGNGMGNWYGXOM-UHFFFAOYSA-N 0 0 366.377 3.701 20 5 FHBDRN CCNc1ccc(C(=O)N2CC[C@@H](c3ccccc3C)C2)cc1[N+](=O)[O-] ZINC000513727502 942149850 /nfs/dbraw/zinc/14/98/50/942149850.db2.gz KTVNUXRNELZBEM-MRXNPFEDSA-N 0 0 353.422 3.965 20 5 FHBDRN CCOc1ccc2c(c1)CCN(C(=O)CSc1ccc([N+](=O)[O-])cc1)C2 ZINC000434093867 942158088 /nfs/dbraw/zinc/15/80/88/942158088.db2.gz QYAJULGAHHUMLJ-UHFFFAOYSA-N 0 0 372.446 3.671 20 5 FHBDRN CCOc1ccc([C@@H]2CCCN2C(=O)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000016141511 942162300 /nfs/dbraw/zinc/16/23/00/942162300.db2.gz IIXPMGIGKHYFAU-SFHVURJKSA-N 0 0 354.406 3.900 20 5 FHBDRN O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1cc(F)c(F)c(F)c1 ZINC000102989428 942166569 /nfs/dbraw/zinc/16/65/69/942166569.db2.gz MAMVDDAUVKTXPU-UHFFFAOYSA-N 0 0 362.210 3.866 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1)c1cscn1 ZINC000102980870 942166578 /nfs/dbraw/zinc/16/65/78/942166578.db2.gz ABAAUFFTFAWSMX-UHFFFAOYSA-N 0 0 353.359 3.535 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)NC[C@@H]2CCC[C@@H](C)C2)cc1SC ZINC000102999644 942166635 /nfs/dbraw/zinc/16/66/35/942166635.db2.gz YAQVYXQBTDGLKP-VXGBXAGGSA-N 0 0 352.456 3.881 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)N([C@H](C)C(C)C)C2CC2)cc1SC ZINC000102987697 942166659 /nfs/dbraw/zinc/16/66/59/942166659.db2.gz MCPMACUQIYLXIC-LLVKDONJSA-N 0 0 352.456 3.974 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N[C@@H](CC(F)F)c1ccccc1 ZINC000420731757 942168343 /nfs/dbraw/zinc/16/83/43/942168343.db2.gz FWUKFZORIOMYTK-AWEZNQCLSA-N 0 0 370.377 3.578 20 5 FHBDRN COc1cc(CN2CCSC[C@H]2c2ccccc2)c([N+](=O)[O-])cc1OC ZINC000128374578 942169124 /nfs/dbraw/zinc/16/91/24/942169124.db2.gz BETFUWLIHVMRNQ-KRWDZBQOSA-N 0 0 374.462 3.902 20 5 FHBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N[C@H](CC(F)F)c1ccccc1 ZINC000420728457 942177755 /nfs/dbraw/zinc/17/77/55/942177755.db2.gz AVBZZHSXGKLPOJ-CYBMUJFWSA-N 0 0 370.377 3.578 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)NCc1ccccc1N1CCCCC1 ZINC000183143823 942183776 /nfs/dbraw/zinc/18/37/76/942183776.db2.gz ZVPCNUKOWLVBOL-UHFFFAOYSA-N 0 0 367.449 3.834 20 5 FHBDRN Cc1c(NCc2noc(C3CC3)n2)cc(Br)cc1[N+](=O)[O-] ZINC000280435068 942185220 /nfs/dbraw/zinc/18/52/20/942185220.db2.gz SUAMXCUYZHDKCY-UHFFFAOYSA-N 0 0 353.176 3.538 20 5 FHBDRN CC(C)[C@H]1N(C(=O)N[C@@H](C)c2ccccc2[N+](=O)[O-])CC12CCOCC2 ZINC000413438160 942185664 /nfs/dbraw/zinc/18/56/64/942185664.db2.gz POHWNSVZJQXLLW-WMLDXEAASA-N 0 0 361.442 3.502 20 5 FHBDRN COc1cc(C(=O)Nc2ccnn2-c2cccc(Cl)c2)ccc1[N+](=O)[O-] ZINC000103034116 942187247 /nfs/dbraw/zinc/18/72/47/942187247.db2.gz TWBBSSOBIYCLAJ-UHFFFAOYSA-N 0 0 372.768 3.695 20 5 FHBDRN COC1CCC(C)(CNC(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)CC1 ZINC000412317301 942191644 /nfs/dbraw/zinc/19/16/44/942191644.db2.gz ZHFSIRJQHURFQV-UHFFFAOYSA-N 0 0 364.442 3.707 20 5 FHBDRN COc1ccc(CNc2ccc(C)c(NC(=O)N(C)C)c2)cc1[N+](=O)[O-] ZINC000280494020 942196396 /nfs/dbraw/zinc/19/63/96/942196396.db2.gz KKEOFNSZHZXZHP-UHFFFAOYSA-N 0 0 358.398 3.617 20 5 FHBDRN CCC1(C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2C)CCOCC1 ZINC000280555056 942201691 /nfs/dbraw/zinc/20/16/91/942201691.db2.gz JBLBNOJUDVPBII-UHFFFAOYSA-N 0 0 371.231 3.811 20 5 FHBDRN CS[C@@H](C)CNC(=O)c1ccc(N2C[C@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000502079408 942207197 /nfs/dbraw/zinc/20/71/97/942207197.db2.gz NOJOLNRCKVYLKW-MJBXVCDLSA-N 0 0 365.499 3.558 20 5 FHBDRN COC(=O)c1nc([C@H]2CCCN2c2ccc(F)cc2[N+](=O)[O-])sc1C ZINC000280628884 942217124 /nfs/dbraw/zinc/21/71/24/942217124.db2.gz ZRDYZBZGTGUMLX-GFCCVEGCSA-N 0 0 365.386 3.627 20 5 FHBDRN COc1cccc2[nH]cc(CC(=O)N3CCCc4c([N+](=O)[O-])cccc43)c21 ZINC000183189583 942224259 /nfs/dbraw/zinc/22/42/59/942224259.db2.gz CUOUWVAEFJGVTD-UHFFFAOYSA-N 0 0 365.389 3.607 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CCCC[C@H]2c2nc(-c3ccccc3)c[nH]2)nc1 ZINC000280661825 942225989 /nfs/dbraw/zinc/22/59/89/942225989.db2.gz BMBYHBLQTFCAEW-INIZCTEOSA-N 0 0 350.382 3.507 20 5 FHBDRN C[C@H](Cc1ccccc1Cl)C(=O)NCCNc1ccc([N+](=O)[O-])cc1 ZINC000513700024 942226187 /nfs/dbraw/zinc/22/61/87/942226187.db2.gz GABWMXUTOMRYEG-CYBMUJFWSA-N 0 0 361.829 3.655 20 5 FHBDRN Cc1cc(C(=O)N[C@H](CC(=O)OC(C)C)c2ccccc2[N+](=O)[O-])c(C)o1 ZINC000024483220 942228396 /nfs/dbraw/zinc/22/83/96/942228396.db2.gz UQQIFWXBAXPTCX-MRXNPFEDSA-N 0 0 374.393 3.617 20 5 FHBDRN CC(C)c1ccc(C(=O)Nc2ccc(F)c(C(=O)N(C)C)c2)cc1[N+](=O)[O-] ZINC000187860132 942238609 /nfs/dbraw/zinc/23/86/09/942238609.db2.gz FLBLAMDGWCDFCQ-UHFFFAOYSA-N 0 0 373.384 3.811 20 5 FHBDRN CCS(=O)(=O)Nc1ccc(Nc2nc3ccccc3cc2[N+](=O)[O-])cc1 ZINC000473536124 942240391 /nfs/dbraw/zinc/24/03/91/942240391.db2.gz ZKQIZGDIHRYGIK-UHFFFAOYSA-N 0 0 372.406 3.648 20 5 FHBDRN CCS(=O)(=O)c1cc(Cl)cc(CNc2cc(C)ccc2[N+](=O)[O-])c1 ZINC000413491081 942241345 /nfs/dbraw/zinc/24/13/45/942241345.db2.gz YAVNDRSAXRVITN-UHFFFAOYSA-N 0 0 368.842 3.962 20 5 FHBDRN CCC(=O)c1ccc(N2CCC[C@H](c3nncn3C(C)C)C2)c([N+](=O)[O-])c1 ZINC000280757858 942244075 /nfs/dbraw/zinc/24/40/75/942244075.db2.gz QIQQKGXSSBESMN-HNNXBMFYSA-N 0 0 371.441 3.744 20 5 FHBDRN Cc1cc(C(=O)N2c3ccc([N+](=O)[O-])cc3C[C@H]2C)nn1-c1ccccc1 ZINC000103375729 942249139 /nfs/dbraw/zinc/24/91/39/942249139.db2.gz FSVOQYBOESLPMS-CYBMUJFWSA-N 0 0 362.389 3.680 20 5 FHBDRN COc1cc(C(=O)N2C[C@@H]3CCCCC[C@@H]32)c([N+](=O)[O-])cc1OC(F)F ZINC000378082463 942257089 /nfs/dbraw/zinc/25/70/89/942257089.db2.gz HDARENKJRGRPHQ-JQWIXIFHSA-N 0 0 370.352 3.610 20 5 FHBDRN CCNc1ccc(C(=O)Nc2ccc([C@@H](C)C(=O)OC)cc2)cc1[N+](=O)[O-] ZINC000416014723 942263385 /nfs/dbraw/zinc/26/33/85/942263385.db2.gz OQVFWVYMOCKAHZ-GFCCVEGCSA-N 0 0 371.393 3.555 20 5 FHBDRN Cc1cc(Cl)ccc1OCCCNC(=O)c1ccc([N+](=O)[O-])s1 ZINC000501021387 942266745 /nfs/dbraw/zinc/26/67/45/942266745.db2.gz PTYATSUUQJNTHK-UHFFFAOYSA-N 0 0 354.815 3.817 20 5 FHBDRN COc1ccc(S[C@H](C)C(=O)OCc2ccc([N+](=O)[O-])c(F)c2)cc1 ZINC000783075866 942269996 /nfs/dbraw/zinc/26/99/96/942269996.db2.gz MDOBOLCFJOGJPY-LLVKDONJSA-N 0 0 365.382 3.967 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC(n2cncc2C)CC1 ZINC000366397745 942271089 /nfs/dbraw/zinc/27/10/89/942271089.db2.gz NTSMGIZKTFRBMM-UHFFFAOYSA-N 0 0 374.466 3.689 20 5 FHBDRN C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCC[C@H](CC(F)(F)F)C1 ZINC000420949644 942271747 /nfs/dbraw/zinc/27/17/47/942271747.db2.gz OWZPVLOTZLHUJE-VXGBXAGGSA-N 0 0 359.348 3.586 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)N(C)[C@H]2CCCC[C@H]2c2ccccc2)n1 ZINC000416021681 942273153 /nfs/dbraw/zinc/27/31/53/942273153.db2.gz YSHSTEVEBKMALK-HOTGVXAUSA-N 0 0 356.426 3.610 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2nnc(CN3CCC[C@@H](CC(F)(F)F)C3)o2)cc1 ZINC000420954734 942274430 /nfs/dbraw/zinc/27/44/30/942274430.db2.gz VBWYKCRJCJTYRQ-NSHDSACASA-N 0 0 370.331 3.809 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)Nc1cn(C)nc1-c1ccccc1 ZINC000502205751 942280743 /nfs/dbraw/zinc/28/07/43/942280743.db2.gz GXKMXVVXMWKYAC-UHFFFAOYSA-N 0 0 365.393 3.659 20 5 FHBDRN CC(C)[C@H](C)NC(=O)C1CCN(c2ccc([N+](=O)[O-])c3ncccc32)CC1 ZINC000413100066 942286146 /nfs/dbraw/zinc/28/61/46/942286146.db2.gz HIJLYNIVZKYOST-AWEZNQCLSA-N 0 0 370.453 3.520 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N[C@H](C)c1ccc2c(c1)OCO2 ZINC000085634114 942286353 /nfs/dbraw/zinc/28/63/53/942286353.db2.gz INXSBIJKAOAPNL-GFCCVEGCSA-N 0 0 357.366 3.823 20 5 FHBDRN O=C(NCC1(c2ccccc2)CC1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513736043 942289896 /nfs/dbraw/zinc/28/98/96/942289896.db2.gz VWMYNLBINJWOQA-UHFFFAOYSA-N 0 0 362.332 3.658 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc2c1OCCO2 ZINC000103575610 942289885 /nfs/dbraw/zinc/28/98/85/942289885.db2.gz ZDGWNAIFQCWHAQ-UHFFFAOYSA-N 0 0 371.393 3.809 20 5 FHBDRN O=[N+]([O-])c1cccc(Cl)c1CN1CC[C@](O)(Cc2ccc(F)cc2)C1 ZINC000421010450 942290413 /nfs/dbraw/zinc/29/04/13/942290413.db2.gz IDDGCHHCNKBFBS-SFHVURJKSA-N 0 0 364.804 3.567 20 5 FHBDRN CO[C@@H](C(=O)N1CCS[C@H]1c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000413521077 942291793 /nfs/dbraw/zinc/29/17/93/942291793.db2.gz QRWLPTUKPSOHFS-AEFFLSMTSA-N 0 0 358.419 3.557 20 5 FHBDRN CC(C)c1nnc(CSCCC(=O)Nc2ccccc2[N+](=O)[O-])s1 ZINC000419530917 942292299 /nfs/dbraw/zinc/29/22/99/942292299.db2.gz FACFLEJIHOKCNA-UHFFFAOYSA-N 0 0 366.468 3.832 20 5 FHBDRN COc1cccc(CCNC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1 ZINC000103602018 942297265 /nfs/dbraw/zinc/29/72/65/942297265.db2.gz ORSIYTOTKAMDDK-UHFFFAOYSA-N 0 0 371.437 3.766 20 5 FHBDRN COc1cc(CSCC[C@H]2CCOC2)c([N+](=O)[O-])cc1OC(F)F ZINC000419519508 942298512 /nfs/dbraw/zinc/29/85/12/942298512.db2.gz CZHLDHQTXOYHLV-SNVBAGLBSA-N 0 0 363.382 3.865 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1c2ccccc2SC[C@@H]1C ZINC000434137703 942299487 /nfs/dbraw/zinc/29/94/87/942299487.db2.gz UNYOSHZJNMKYLS-LBPRGKRZSA-N 0 0 364.448 3.593 20 5 FHBDRN O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1C[C@@H](O)C[C@H]1c1ccccc1 ZINC000413512913 942300411 /nfs/dbraw/zinc/30/04/11/942300411.db2.gz YABCGRCTSXWABE-ZFWWWQNUSA-N 0 0 352.312 3.926 20 5 FHBDRN CCCN(C[C@H]1COc2ccccc2O1)C(=O)c1ccc([N+](=O)[O-])cc1C ZINC000502236324 942300487 /nfs/dbraw/zinc/30/04/87/942300487.db2.gz XKGITJPLAAIJJG-INIZCTEOSA-N 0 0 370.405 3.595 20 5 FHBDRN O=C(NC[C@@H]1CC12CCSCC2)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000421038940 942312171 /nfs/dbraw/zinc/31/21/71/942312171.db2.gz JXWHLYVGMFVLLP-JTQLQIEISA-N 0 0 355.847 3.903 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)N2CCCC[C@H]2c2cn[nH]c2)cc1[N+](=O)[O-] ZINC000183214044 942314023 /nfs/dbraw/zinc/31/40/23/942314023.db2.gz WDIOJXYGPVLAJL-CJNGLKHVSA-N 0 0 357.414 3.624 20 5 FHBDRN O=[N+]([O-])c1cc(CSCCOCC2CCCC2)c2c(c1)COCO2 ZINC000419583625 942314495 /nfs/dbraw/zinc/31/44/95/942314495.db2.gz AEDDSDZKSWGGIR-UHFFFAOYSA-N 0 0 353.440 3.901 20 5 FHBDRN CC(C)(C)OC(=O)C1CCN(c2nccc3ccc([N+](=O)[O-])cc32)CC1 ZINC000413122433 942317322 /nfs/dbraw/zinc/31/73/22/942317322.db2.gz ZTEDLLWWRDKRNA-UHFFFAOYSA-N 0 0 357.410 3.701 20 5 FHBDRN Cc1nn(Cc2ccc(C(=O)N3C[C@H](C)[C@H](C)[C@@H]3C)cc2)c(C)c1[N+](=O)[O-] ZINC000416079032 942318374 /nfs/dbraw/zinc/31/83/74/942318374.db2.gz TTWHXZVPYPKGEZ-YDHLFZDLSA-N 0 0 370.453 3.573 20 5 FHBDRN O=C(N[C@H](c1cc2ccccc2o1)c1ccncc1)c1ccc([N+](=O)[O-])cn1 ZINC000378141489 942318488 /nfs/dbraw/zinc/31/84/88/942318488.db2.gz NPBUXOBWEBPKAR-IBGZPJMESA-N 0 0 374.356 3.650 20 5 FHBDRN O=[N+]([O-])c1cnc(NCc2ccc3c(c2)OCCCO3)c(C(F)(F)F)c1 ZINC000413122251 942318537 /nfs/dbraw/zinc/31/85/37/942318537.db2.gz ZCRVHOGUQQAUEO-UHFFFAOYSA-N 0 0 369.299 3.782 20 5 FHBDRN CSc1cccc(C(=O)NC[C@H](C)N(C)c2ccccc2)c1[N+](=O)[O-] ZINC000188057724 942322989 /nfs/dbraw/zinc/32/29/89/942322989.db2.gz MWYHGBWACSHFHV-ZDUSSCGKSA-N 0 0 359.451 3.571 20 5 FHBDRN CC(C)(C)C(=O)NC[C@@H]1CCCN(c2nccc3ccc([N+](=O)[O-])cc32)C1 ZINC000413131082 942326270 /nfs/dbraw/zinc/32/62/70/942326270.db2.gz DSPZZKRCQKLSTF-AWEZNQCLSA-N 0 0 370.453 3.522 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1COCc2ccccc21 ZINC000416080980 942327581 /nfs/dbraw/zinc/32/75/81/942327581.db2.gz MEXWGWANFVSMME-HNAYVOBHSA-N 0 0 354.406 3.551 20 5 FHBDRN C[C@H](CNc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1)CC(F)(F)F ZINC000413538968 942332429 /nfs/dbraw/zinc/33/24/29/942332429.db2.gz SXAKQGXBBMTNOS-NSHDSACASA-N 0 0 359.348 3.831 20 5 FHBDRN CC(C)[C@@H]1N(C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)CC12CCOCC2 ZINC000413138392 942337481 /nfs/dbraw/zinc/33/74/81/942337481.db2.gz GYGUUNNXDPIWOR-PBHICJAKSA-N 0 0 361.442 3.502 20 5 FHBDRN CC(C)NC(=O)c1ccc(N2CC[C@@H](c3ccccc3F)C2)c([N+](=O)[O-])c1 ZINC000501176343 942341872 /nfs/dbraw/zinc/34/18/72/942341872.db2.gz PTMCEWFCDOCDDJ-OAHLLOKOSA-N 0 0 371.412 3.866 20 5 FHBDRN O=[N+]([O-])c1c(N2CC3(CCOCC3)[C@@H]2c2ccccc2)nc2sccn21 ZINC000413552811 942347885 /nfs/dbraw/zinc/34/78/85/942347885.db2.gz WEMRQSSNIOMNCV-AWEZNQCLSA-N 0 0 370.434 3.662 20 5 FHBDRN CCN(C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)c1ccc(OC)c(OC)c1 ZINC000413145063 942348629 /nfs/dbraw/zinc/34/86/29/942348629.db2.gz NDRHTNHZGOFHTE-DLBZAZTESA-N 0 0 370.405 3.769 20 5 FHBDRN CCc1ccc(NC(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1F ZINC000501222133 942350640 /nfs/dbraw/zinc/35/06/40/942350640.db2.gz IWCOEGFQTCTXBV-UHFFFAOYSA-N 0 0 372.400 3.650 20 5 FHBDRN CCOc1ccc(C(=O)Nc2cccc(-c3ncc[nH]3)c2)cc1[N+](=O)[O-] ZINC000103967384 942351461 /nfs/dbraw/zinc/35/14/61/942351461.db2.gz HWTUIGXWTHLFLH-UHFFFAOYSA-N 0 0 352.350 3.636 20 5 FHBDRN COc1cc(C(=O)N2CC[C@@](F)(c3ccccc3C)C2)cc([N+](=O)[O-])c1C ZINC000501223662 942351714 /nfs/dbraw/zinc/35/17/14/942351714.db2.gz HCPLRNJABQLNMK-FQEVSTJZSA-N 0 0 372.396 3.931 20 5 FHBDRN CCC(=O)c1ccc(Nc2cccc([C@H]3CCC(=O)N3)c2)c([N+](=O)[O-])c1 ZINC000413563735 942352451 /nfs/dbraw/zinc/35/24/51/942352451.db2.gz SKDAQHYMELBMNL-OAHLLOKOSA-N 0 0 353.378 3.882 20 5 FHBDRN CO[C@H]1CCCC[C@H]1C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000513741743 942354700 /nfs/dbraw/zinc/35/47/00/942354700.db2.gz PPHFRXLQQSKDEX-OLZOCXBDSA-N 0 0 357.204 3.501 20 5 FHBDRN Cc1ccccc1[C@@]1(F)CCN(C(=O)CCOc2ccccc2[N+](=O)[O-])C1 ZINC000501242910 942357435 /nfs/dbraw/zinc/35/74/35/942357435.db2.gz FTBMMTSVNBKXDI-HXUWFJFHSA-N 0 0 372.396 3.769 20 5 FHBDRN Cc1ccc(C(=O)N2CCN([C@@H](C)c3cccc(F)c3)CC2)cc1[N+](=O)[O-] ZINC000103975287 942357573 /nfs/dbraw/zinc/35/75/73/942357573.db2.gz GEIYGXDGHGBDMP-HNNXBMFYSA-N 0 0 371.412 3.561 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N1CCC[C@H](CC(F)(F)F)C1 ZINC000421102852 942359984 /nfs/dbraw/zinc/35/99/84/942359984.db2.gz WSANTTBDCKWVFV-SNVBAGLBSA-N 0 0 361.320 3.800 20 5 FHBDRN CC(C)Oc1cc(C(=O)NCC2CCC(F)(F)CC2)ccc1[N+](=O)[O-] ZINC000412324476 942363339 /nfs/dbraw/zinc/36/33/39/942363339.db2.gz ZXTPQRLTFDJMOS-UHFFFAOYSA-N 0 0 356.369 3.937 20 5 FHBDRN O=[N+]([O-])c1cnc2ccc(N3CCC[C@]4(CCCc5ccccc54)C3)nn21 ZINC000502334978 942366618 /nfs/dbraw/zinc/36/66/18/942366618.db2.gz SSNBOHHQYXDEBR-HXUWFJFHSA-N 0 0 363.421 3.512 20 5 FHBDRN CCOc1ccc(C(=O)N2CCc3cc(F)cc(C)c3C2)cc1[N+](=O)[O-] ZINC000501276002 942377833 /nfs/dbraw/zinc/37/78/33/942377833.db2.gz UQOHTKBYVLSADP-UHFFFAOYSA-N 0 0 358.369 3.640 20 5 FHBDRN O=[N+]([O-])c1ccc(NCCc2csc(N3CCCC3)n2)c2cccnc21 ZINC000413166225 942390781 /nfs/dbraw/zinc/39/07/81/942390781.db2.gz TYTAVIUUMAMUFU-UHFFFAOYSA-N 0 0 369.450 3.854 20 5 FHBDRN Cc1c(NC(=O)C(=O)N(C)[C@H]2CCC[C@H]2C(C)(C)C)cccc1[N+](=O)[O-] ZINC000419789990 942391718 /nfs/dbraw/zinc/39/17/18/942391718.db2.gz DKLWETDANQPZED-CJNGLKHVSA-N 0 0 361.442 3.515 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N(CC2CC2)c2ccccc2)c1F ZINC000413598479 942403324 /nfs/dbraw/zinc/40/33/24/942403324.db2.gz WATLCJZIPHAXNU-UHFFFAOYSA-N 0 0 358.369 3.728 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N(CC(C)C)[C@H](C)c1ccccc1C ZINC000501306961 942403808 /nfs/dbraw/zinc/40/38/08/942403808.db2.gz WKZYVKKKOQKDGF-OAHLLOKOSA-N 0 0 358.442 3.654 20 5 FHBDRN Cc1cc(F)cc(C(=O)Nc2ccc([N+](=O)[O-])c3ncccc23)c1[N+](=O)[O-] ZINC001268850270 942407332 /nfs/dbraw/zinc/40/73/32/942407332.db2.gz VMXAYGHCBWQZDH-UHFFFAOYSA-N 0 0 370.296 3.751 20 5 FHBDRN Cc1c(NC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)cnn1CC(C)C ZINC000501339399 942410437 /nfs/dbraw/zinc/41/04/37/942410437.db2.gz CIQGRRPSEQTKMK-UHFFFAOYSA-N 0 0 350.806 3.590 20 5 FHBDRN C[C@H](OC(=O)c1cc(Cl)ccc1[N+](=O)[O-])C(=O)Nc1cccc(F)c1 ZINC000015798210 942411368 /nfs/dbraw/zinc/41/13/68/942411368.db2.gz YEQDWDHYDJVBBY-VIFPVBQESA-N 0 0 366.732 3.571 20 5 FHBDRN O=[N+]([O-])c1ccc(CN2CCC[C@@H](c3ccncn3)C2)c(C(F)(F)F)c1 ZINC000378222398 942417242 /nfs/dbraw/zinc/41/72/42/942417242.db2.gz WEMYYCAKWMZXNM-CYBMUJFWSA-N 0 0 366.343 3.783 20 5 FHBDRN C[C@H]1[C@@H](Cc2ccccc2)CCN1C(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000472944509 942431810 /nfs/dbraw/zinc/43/18/10/942431810.db2.gz ADLGOUQLJHRPOX-MAUKXSAKSA-N 0 0 353.422 3.758 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CCC[C@@H]2[C@H]2CCCCC2=O)ccc1[N+](=O)[O-] ZINC000413612018 942438779 /nfs/dbraw/zinc/43/87/79/942438779.db2.gz SXXGZFNZIKAMRQ-HZPDHXFCSA-N 0 0 374.437 3.746 20 5 FHBDRN O=C(NCCOc1ccccc1Cl)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000501375089 942440899 /nfs/dbraw/zinc/44/08/99/942440899.db2.gz CWFYNAFQHHJZLW-UHFFFAOYSA-N 0 0 359.769 3.538 20 5 FHBDRN CN(C)C(=O)[C@H]1CCC[C@@H](Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)C1 ZINC000513745414 942442707 /nfs/dbraw/zinc/44/27/07/942442707.db2.gz YOBJTZBHEPVWFJ-WDEREUQCSA-N 0 0 359.348 3.673 20 5 FHBDRN CCOC(=O)c1ccccc1NC(=O)CSc1ccccc1[N+](=O)[O-] ZINC000505261685 942445118 /nfs/dbraw/zinc/44/51/18/942445118.db2.gz YFPOPMXYFQFCSJ-UHFFFAOYSA-N 0 0 360.391 3.502 20 5 FHBDRN C[C@@H](CC(=O)c1ccc(F)cc1)NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000413638990 942454791 /nfs/dbraw/zinc/45/47/91/942454791.db2.gz NWDSPNPXQFIKOP-UYHISHBKSA-N 0 0 370.380 3.615 20 5 FHBDRN CCS[C@H]1CC[C@@H](N(C)C(=O)Nc2ccc([N+](=O)[O-])cc2OC)C1 ZINC000122896644 942457068 /nfs/dbraw/zinc/45/70/68/942457068.db2.gz HKRCXRDVYPCKQU-YPMHNXCESA-N 0 0 353.444 3.741 20 5 FHBDRN CC[C@@H](C(=O)N1CCC(Nc2ccncc2[N+](=O)[O-])CC1)c1ccccc1 ZINC000066811632 942463396 /nfs/dbraw/zinc/46/33/96/942463396.db2.gz ONIBEYALQNFKQZ-QGZVFWFLSA-N 0 0 368.437 3.587 20 5 FHBDRN Cn1cc(-c2ncc(/C=C/c3ccc4cc([N+](=O)[O-])ccc4n3)cn2)cn1 ZINC000366868720 942469265 /nfs/dbraw/zinc/46/92/65/942469265.db2.gz AJYICLLISGCVJN-DUXPYHPUSA-N 0 0 358.361 3.504 20 5 FHBDRN C[C@@H](NC(=O)COc1ccc([N+](=O)[O-])c2cccnc12)C1CCCCC1 ZINC000424988906 942476065 /nfs/dbraw/zinc/47/60/65/942476065.db2.gz BPBPNYNWURXOTN-CYBMUJFWSA-N 0 0 357.410 3.607 20 5 FHBDRN Cc1nc(N2CCN(c3nccc4ccc([N+](=O)[O-])cc43)CC2)sc1C ZINC000413211668 942486432 /nfs/dbraw/zinc/48/64/32/942486432.db2.gz XRMQPPAIOJSOFI-UHFFFAOYSA-N 0 0 369.450 3.543 20 5 FHBDRN CCCN(C(=O)c1ccc([N+](=O)[O-])c(C)c1)[C@H](C)C(=O)Nc1ccccc1 ZINC000502496404 942490378 /nfs/dbraw/zinc/49/03/78/942490378.db2.gz TYFAVORMVRKUCY-OAHLLOKOSA-N 0 0 369.421 3.783 20 5 FHBDRN O=C(COc1ccccc1[N+](=O)[O-])N1CCC[C@H]1/C=C/c1ccccc1 ZINC000505372280 942491159 /nfs/dbraw/zinc/49/11/59/942491159.db2.gz IMOHPOBOQLZCOE-UJGDBWEASA-N 0 0 352.390 3.678 20 5 FHBDRN COc1ccc(C(=O)N2CCC[C@H]2/C=C\c2ccccc2)cc1[N+](=O)[O-] ZINC000505373166 942492034 /nfs/dbraw/zinc/49/20/34/942492034.db2.gz QLFZGBGSEHIOMB-CCCPALQASA-N 0 0 352.390 3.921 20 5 FHBDRN CC(=O)C[C@H](C)NC(=O)c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1 ZINC000501459190 942494799 /nfs/dbraw/zinc/49/47/99/942494799.db2.gz RJLSLDVZCMGNBR-LBPRGKRZSA-N 0 0 358.419 3.843 20 5 FHBDRN COc1cc(NCc2ccc([N+](=O)[O-])cc2C)ccc1N1CCCC1=O ZINC000421340869 942494971 /nfs/dbraw/zinc/49/49/71/942494971.db2.gz VADHMOXPVMJFIX-UHFFFAOYSA-N 0 0 355.394 3.651 20 5 FHBDRN Cn1cc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H]1c1nc2ccccc2s1 ZINC000024583707 942501812 /nfs/dbraw/zinc/50/18/12/942501812.db2.gz FBEYHWDRQVVZGY-CYBMUJFWSA-N 0 0 356.407 3.520 20 5 FHBDRN COc1ccc([C@@H](NC(=O)c2ccc([N+](=O)[O-])c(C)c2)C(F)(F)F)cc1 ZINC000505386761 942517755 /nfs/dbraw/zinc/51/77/55/942517755.db2.gz JJDRQDLTWWDHRN-OAHLLOKOSA-N 0 0 368.311 3.945 20 5 FHBDRN O=C(c1c(Cl)cccc1[N+](=O)[O-])N1CCC[C@H](c2nccs2)C1 ZINC000137092576 942525199 /nfs/dbraw/zinc/52/51/99/942525199.db2.gz JBAJHEGZYMSDQO-JTQLQIEISA-N 0 0 351.815 3.725 20 5 FHBDRN O=C(Nc1cccc2c1CCO2)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000434150370 942529127 /nfs/dbraw/zinc/52/91/27/942529127.db2.gz AAHBMMGKRPORPY-UHFFFAOYSA-N 0 0 353.378 3.726 20 5 FHBDRN O=[N+]([O-])c1ccc2ccnc(NCC3CCN(CC(F)(F)F)CC3)c2c1 ZINC000413241235 942532480 /nfs/dbraw/zinc/53/24/80/942532480.db2.gz GRZFZQBDGWZKDO-UHFFFAOYSA-N 0 0 368.359 3.829 20 5 FHBDRN Cc1ccccc1CCNC(=O)[C@@H](C)SCc1ccc([N+](=O)[O-])cc1 ZINC000513820163 942538155 /nfs/dbraw/zinc/53/81/55/942538155.db2.gz KHNLJCVVCRMJEP-OAHLLOKOSA-N 0 0 358.463 3.884 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC=C(c2cccc3ccccc32)C1 ZINC000501567416 942542170 /nfs/dbraw/zinc/54/21/70/942542170.db2.gz NJPHPZAIPZESKR-UHFFFAOYSA-N 0 0 359.385 3.991 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NCc1ccc(NC(=O)C(C)C)cc1 ZINC000421421323 942551485 /nfs/dbraw/zinc/55/14/85/942551485.db2.gz NBMAHIDKTDAMHM-UHFFFAOYSA-N 0 0 369.421 3.736 20 5 FHBDRN O=C(CCCOCCc1ccccc1)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000513839010 942551844 /nfs/dbraw/zinc/55/18/44/942551844.db2.gz BKLHYXSKFBTROU-UHFFFAOYSA-N 0 0 368.433 3.914 20 5 FHBDRN COC(=O)c1cc(NC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)c(C)cc1C ZINC000413770463 942564256 /nfs/dbraw/zinc/56/42/56/942564256.db2.gz LJHRVAMDPOINOT-DLBZAZTESA-N 0 0 368.389 3.740 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NCC1(c2ccccc2)CCOCC1 ZINC000421428421 942565616 /nfs/dbraw/zinc/56/56/16/942565616.db2.gz LJRLLWCWJZALLD-UHFFFAOYSA-N 0 0 368.433 3.690 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CCCC[C@H]2OC(F)F)c1 ZINC000501608431 942565700 /nfs/dbraw/zinc/56/57/00/942565700.db2.gz QGBOKSDAVONXFM-DGCLKSJQSA-N 0 0 360.382 3.597 20 5 FHBDRN CC1(C)CN(c2ncc([N+](=O)[O-])cc2C(F)(F)F)CC2(CCCC2)O1 ZINC000413256429 942568746 /nfs/dbraw/zinc/56/87/46/942568746.db2.gz LZYXMFCBSWCSFD-UHFFFAOYSA-N 0 0 359.348 3.937 20 5 FHBDRN O=[N+]([O-])c1cnc(NCc2ccc3c(n2)CCCC3)c(C(F)(F)F)c1 ZINC000413260515 942571034 /nfs/dbraw/zinc/57/10/34/942571034.db2.gz HWNBAKKYRIQZAR-UHFFFAOYSA-N 0 0 352.316 3.895 20 5 FHBDRN O=C(Nc1nc2c(s1)CSCC2)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412341560 942571788 /nfs/dbraw/zinc/57/17/88/942571788.db2.gz SMCVXNZESAYDRM-NWDGAFQWSA-N 0 0 361.448 3.583 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)Nc2cc3c(cc2[N+](=O)[O-])OCCCO3)nc1 ZINC000421437564 942572110 /nfs/dbraw/zinc/57/21/10/942572110.db2.gz VHICYUMWCRWOFG-UHFFFAOYSA-N 0 0 371.393 3.701 20 5 FHBDRN CCN(CC)C(=O)c1cccc(NC(=O)c2cc([N+](=O)[O-])c(C)cc2C)c1 ZINC000421436034 942572247 /nfs/dbraw/zinc/57/22/47/942572247.db2.gz XZDYUDGVETUGPI-UHFFFAOYSA-N 0 0 369.421 3.946 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CCC(CC(F)(F)F)CC1 ZINC000412342724 942574745 /nfs/dbraw/zinc/57/47/45/942574745.db2.gz PBZJFORSOAGRPL-LSDHHAIUSA-N 0 0 356.344 3.889 20 5 FHBDRN CC1CCN(c2ccc(C(=O)N3CC[C@@H](C)[C@@H](C)C3)cc2[N+](=O)[O-])CC1 ZINC000501613223 942575039 /nfs/dbraw/zinc/57/50/39/942575039.db2.gz BZIDIEAVOBYTMY-CVEARBPZSA-N 0 0 359.470 3.949 20 5 FHBDRN COC1(C(F)(F)F)CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000416263898 942578998 /nfs/dbraw/zinc/57/89/98/942578998.db2.gz BIZXBSVOFILLDJ-UHFFFAOYSA-N 0 0 372.299 3.525 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NC1(c2ccc(F)cc2)CCOCC1 ZINC000421459337 942581609 /nfs/dbraw/zinc/58/16/09/942581609.db2.gz MYTQFGZMKHYEAM-UHFFFAOYSA-N 0 0 372.396 3.786 20 5 FHBDRN CC(C)[C@@H](CNC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)c1cccnc1 ZINC000434344924 942593950 /nfs/dbraw/zinc/59/39/50/942593950.db2.gz RWHXXOAIYIDWJG-OAHLLOKOSA-N 0 0 352.394 3.641 20 5 FHBDRN CC[C@H](C)N(C(=O)c1cc([N+](=O)[O-])c(C)cc1C)c1ccc(C(N)=O)cc1 ZINC000421454366 942594721 /nfs/dbraw/zinc/59/47/21/942594721.db2.gz QWQLJXSRQNGGIT-AWEZNQCLSA-N 0 0 369.421 3.756 20 5 FHBDRN COc1cccc2c1CCCCN2C(=O)Cc1cccc([N+](=O)[O-])c1C ZINC000513920816 942595214 /nfs/dbraw/zinc/59/52/14/942595214.db2.gz STSYFTGKFGSLLQ-UHFFFAOYSA-N 0 0 354.406 3.824 20 5 FHBDRN CC[C@@H]1CCCC[C@@H]1CNC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000452417013 942595380 /nfs/dbraw/zinc/59/53/80/942595380.db2.gz IQYMJKJVUSIUDI-CHWSQXEVSA-N 0 0 357.410 3.795 20 5 FHBDRN O=C(Cc1cc(F)c(Cl)cc1[N+](=O)[O-])NC[C@H]1C[C@@H]1c1ccccc1 ZINC000843659837 942595464 /nfs/dbraw/zinc/59/54/64/942595464.db2.gz RUYJQBYYJXTBJE-ZIAGYGMSSA-N 0 0 362.788 3.850 20 5 FHBDRN O=C(NC1CCC2(CCOCC2)CC1)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000378329520 942600973 /nfs/dbraw/zinc/60/09/73/942600973.db2.gz MYIVPNQRCQCOHW-UHFFFAOYSA-N 0 0 369.421 3.612 20 5 FHBDRN CC(C)Cn1c(-c2cccc([N+](=O)[O-])c2)nnc1N(C)Cc1ccoc1 ZINC000549418433 942602956 /nfs/dbraw/zinc/60/29/56/942602956.db2.gz CLINIOQUBNSLRM-UHFFFAOYSA-N 0 0 355.398 3.739 20 5 FHBDRN CN(Cc1ccc(OCC(F)(F)F)cc1)c1ncc([N+](=O)[O-])cc1F ZINC000413283072 942603378 /nfs/dbraw/zinc/60/33/78/942603378.db2.gz RJDZBIADSPMOGJ-UHFFFAOYSA-N 0 0 359.279 3.706 20 5 FHBDRN COc1cccc(C2=CCN(C(=O)Cc3ccc([N+](=O)[O-])cc3Cl)C2)c1 ZINC000501678841 942607620 /nfs/dbraw/zinc/60/76/20/942607620.db2.gz CIANCKFJPYJTAM-UHFFFAOYSA-N 0 0 372.808 3.725 20 5 FHBDRN C[C@H]1OCC[C@@]1(C)NC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000541329081 942612218 /nfs/dbraw/zinc/61/22/18/942612218.db2.gz VJSUAJFINAMBSB-BFUOFWGJSA-N 0 0 355.394 3.636 20 5 FHBDRN CC1(C)CN(c2ccc([N+](=O)[O-])c3ncccc32)C[C@@H](C(F)(F)F)O1 ZINC000413293611 942614089 /nfs/dbraw/zinc/61/40/89/942614089.db2.gz AQCADZKODYIIKR-ZDUSSCGKSA-N 0 0 355.316 3.689 20 5 FHBDRN C[C@@]1(CNC(=O)CSc2ccc([N+](=O)[O-])cc2)C[C@H]1c1ccccc1 ZINC000501693026 942615829 /nfs/dbraw/zinc/61/58/29/942615829.db2.gz 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COC(=O)c1cc(C(=O)N(C)[C@H]2CCC[C@H]2C(C)(C)C)cc([N+](=O)[O-])c1 ZINC000416308545 942635822 /nfs/dbraw/zinc/63/58/22/942635822.db2.gz MHLJKXZHVBTYGS-CVEARBPZSA-N 0 0 362.426 3.668 20 5 FHBDRN CC(C)Nc1ccc([N+](=O)[O-])cc1NC(=O)[C@H]1Oc2ccccc2O[C@@H]1C ZINC000413829399 942650037 /nfs/dbraw/zinc/65/00/37/942650037.db2.gz CDMAXINLRSRXHH-XIKOKIGWSA-N 0 0 371.393 3.582 20 5 FHBDRN Cc1cc(NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)cc2n[nH]cc21 ZINC000501750475 942651235 /nfs/dbraw/zinc/65/12/35/942651235.db2.gz LLFFAHVAGJOVIV-UHFFFAOYSA-N 0 0 365.393 3.632 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)C[C@@H]1OCCc2ccsc21 ZINC000366988902 942651621 /nfs/dbraw/zinc/65/16/21/942651621.db2.gz JGIKWKGEGGCSQI-HNNXBMFYSA-N 0 0 362.407 3.698 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)C1(c2c(F)cccc2F)CCC1 ZINC000421545533 942651800 /nfs/dbraw/zinc/65/18/00/942651800.db2.gz SCRWEHYMXMSYEQ-UHFFFAOYSA-N 0 0 374.387 3.996 20 5 FHBDRN CCn1ncc(NC(=O)c2cc([N+](=O)[O-])c(C)cc2C)c1C(F)(F)F ZINC000421547389 942652985 /nfs/dbraw/zinc/65/29/85/942652985.db2.gz WPMQTJOENGXINB-UHFFFAOYSA-N 0 0 356.304 3.699 20 5 FHBDRN COc1cccc2c1N(C(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1)CCC2 ZINC000413321249 942658755 /nfs/dbraw/zinc/65/87/55/942658755.db2.gz QWBCZQTZBPLJOD-UHFFFAOYSA-N 0 0 370.405 3.984 20 5 FHBDRN COc1cccc([C@@H]2C[C@H]2CNC(=O)c2cc([N+](=O)[O-])c(C)cc2C)c1 ZINC000421556092 942659545 /nfs/dbraw/zinc/65/95/45/942659545.db2.gz LFMYXEANTJLOTK-YJBOKZPZSA-N 0 0 354.406 3.754 20 5 FHBDRN CCNC(=O)Nc1ccc(C)c(NC(=O)c2cc([N+](=O)[O-])c(C)cc2C)c1 ZINC000421557523 942659777 /nfs/dbraw/zinc/65/97/77/942659777.db2.gz MSJBWNQDXXWQAT-UHFFFAOYSA-N 0 0 370.409 3.914 20 5 FHBDRN O=[N+]([O-])c1ccc(N[C@@H]2[C@H]3CCO[C@H]3C23CCC3)c(Br)c1 ZINC000513983392 942662706 /nfs/dbraw/zinc/66/27/06/942662706.db2.gz OPFSKICKWVGYLM-LERXQTSPSA-N 0 0 353.216 3.727 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N[C@@H](C)[C@@H]1OCCc2sccc21 ZINC000421574071 942666507 /nfs/dbraw/zinc/66/65/07/942666507.db2.gz KNNJZNCLKZGXBI-SJCJKPOMSA-N 0 0 360.435 3.705 20 5 FHBDRN O=C(Nc1nc(CC(F)(F)F)cs1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412364224 942670815 /nfs/dbraw/zinc/67/08/15/942670815.db2.gz JBKIIRSABPMPRY-NWDGAFQWSA-N 0 0 371.340 3.898 20 5 FHBDRN CC(=O)Nc1ccc(NC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc32)cc1Cl ZINC000502704073 942671362 /nfs/dbraw/zinc/67/13/62/942671362.db2.gz WJPJUXHWOONZPQ-UHFFFAOYSA-N 0 0 372.768 3.940 20 5 FHBDRN CC(C)(C)OC(=O)[C@@H]1[C@H](c2nc(Cc3ccccc3[N+](=O)[O-])no2)C1(C)C ZINC000420471292 942676003 /nfs/dbraw/zinc/67/60/03/942676003.db2.gz AGCJDLKJVYBUIF-CABCVRRESA-N 0 0 373.409 3.650 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NCCC1(COC)CCC1 ZINC000501808352 942676091 /nfs/dbraw/zinc/67/60/91/942676091.db2.gz OGTLHEZINNJFMJ-UHFFFAOYSA-N 0 0 352.456 3.643 20 5 FHBDRN COc1cc(N2CCC3(CC2)OCCc2ccccc23)ccc1[N+](=O)[O-] ZINC000413334179 942684061 /nfs/dbraw/zinc/68/40/61/942684061.db2.gz NPJRLWIOMLFMMH-UHFFFAOYSA-N 0 0 354.406 3.672 20 5 FHBDRN C[C@H](NC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21)[C@@H](C)c1ccccc1 ZINC000473540302 942687358 /nfs/dbraw/zinc/68/73/58/942687358.db2.gz GSUQBVOYWAJGDT-CABCVRRESA-N 0 0 351.406 3.858 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H](c1ccccc1)[C@H]1CCOC1 ZINC000378380756 942687946 /nfs/dbraw/zinc/68/79/46/942687946.db2.gz WCNOQFDWWYBDKN-MAUKXSAKSA-N 0 0 355.394 3.803 20 5 FHBDRN Cc1cnc(-c2cccc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3C)c2)o1 ZINC000066814863 942691851 /nfs/dbraw/zinc/69/18/51/942691851.db2.gz UBLBYXRBMWPOBH-UHFFFAOYSA-N 0 0 373.390 3.667 20 5 FHBDRN Cc1cnc(-c2cccc(NC(=O)CCOc3ccccc3[N+](=O)[O-])c2)o1 ZINC000066810792 942693657 /nfs/dbraw/zinc/69/36/57/942693657.db2.gz DQKMTDUZKBECKX-UHFFFAOYSA-N 0 0 367.361 3.966 20 5 FHBDRN CC(=O)c1ccc(N2CCO[C@@H](c3ccc(F)c(F)c3)C2)c([N+](=O)[O-])c1 ZINC000066815508 942693863 /nfs/dbraw/zinc/69/38/63/942693863.db2.gz WNKAVWAEHLELQI-GOSISDBHSA-N 0 0 362.332 3.654 20 5 FHBDRN CCc1cc(=O)c2cc(NC(=O)c3cc(Cl)cc([N+](=O)[O-])c3)ccc2[nH]1 ZINC000183315049 942695135 /nfs/dbraw/zinc/69/51/35/942695135.db2.gz CSBGVSCBCGFQSI-UHFFFAOYSA-N 0 0 371.780 3.904 20 5 FHBDRN Cn1cnc([N+](=O)[O-])c1-c1noc(C(C)(C)Cc2ccc(Cl)cc2)n1 ZINC000420496569 942703052 /nfs/dbraw/zinc/70/30/52/942703052.db2.gz ZWOCYGNNHUVGQD-UHFFFAOYSA-N 0 0 361.789 3.552 20 5 FHBDRN Cc1nc([N+](=O)[O-])c(-c2noc(-c3csc(C4CCCCC4)n3)n2)n1C ZINC000420496369 942703850 /nfs/dbraw/zinc/70/38/50/942703850.db2.gz YPNBTXZSNJFEIO-UHFFFAOYSA-N 0 0 374.426 3.858 20 5 FHBDRN CCn1c(-c2cccc([N+](=O)[O-])c2)nnc1N1CC[C@]2(CC[C@@H](C)C2)C1 ZINC000549427711 942704069 /nfs/dbraw/zinc/70/40/69/942704069.db2.gz NRNRCWQCEUVRER-KUHUBIRLSA-N 0 0 355.442 3.890 20 5 FHBDRN O=[N+]([O-])c1ccccc1NCCc1noc([C@@H]2C[C@@]2(F)c2ccccc2)n1 ZINC000420498654 942706379 /nfs/dbraw/zinc/70/63/79/942706379.db2.gz DGCAXUQYVDSWCN-IFXJQAMLSA-N 0 0 368.368 3.985 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2nc3c(s2)CCC3(C)C)c1 ZINC000421630323 942708380 /nfs/dbraw/zinc/70/83/80/942708380.db2.gz IOEURIQTMJZXFL-UHFFFAOYSA-N 0 0 361.423 3.926 20 5 FHBDRN O=[N+]([O-])c1ccc2nc(N3CCO[C@@H](c4ccccc4F)C3)ccc2c1 ZINC000066814279 942711395 /nfs/dbraw/zinc/71/13/95/942711395.db2.gz OIWWXJDXHDNYGF-GOSISDBHSA-N 0 0 353.353 3.860 20 5 FHBDRN Cn1ncc([N+](=O)[O-])c1-c1nc([C@H]2CCC(C)(C)c3ccccc32)no1 ZINC000420510411 942713977 /nfs/dbraw/zinc/71/39/77/942713977.db2.gz NNPKQTZZEXROEA-LBPRGKRZSA-N 0 0 353.382 3.582 20 5 FHBDRN COCCC1(c2noc(C(C)(C)c3ccc([N+](=O)[O-])cc3F)n2)CCC1 ZINC000420514085 942718907 /nfs/dbraw/zinc/71/89/07/942718907.db2.gz LVEOACUDIWSVJW-UHFFFAOYSA-N 0 0 363.389 3.901 20 5 FHBDRN Cc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)cn2ccnc12 ZINC000502764212 942723871 /nfs/dbraw/zinc/72/38/71/942723871.db2.gz VHHFEFMEJCTSOY-UHFFFAOYSA-N 0 0 364.283 3.822 20 5 FHBDRN Cc1cc(NC(=O)c2ccn(-c3c(F)cccc3F)n2)ccc1[N+](=O)[O-] ZINC000182448320 942740205 /nfs/dbraw/zinc/74/02/05/942740205.db2.gz WTCOJVZUXBBLHK-UHFFFAOYSA-N 0 0 358.304 3.619 20 5 FHBDRN Cc1ncc(CN(C)C(=O)c2c([N+](=O)[O-])cccc2C(F)(F)F)s1 ZINC000519033692 942747528 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FHBDRN Cn1cnc([N+](=O)[O-])c1N[C@H](Cc1ccc(Cl)cc1)c1ccccn1 ZINC000502802325 942771922 /nfs/dbraw/zinc/77/19/22/942771922.db2.gz KFLLZNWNJVFNHD-OAHLLOKOSA-N 0 0 357.801 3.773 20 5 FHBDRN Cc1cc(C)c(C)c(C(=O)Cn2cc(Br)c([N+](=O)[O-])n2)c1C ZINC000502839289 942773769 /nfs/dbraw/zinc/77/37/69/942773769.db2.gz HCARSDZMELTWFR-UHFFFAOYSA-N 0 0 366.215 3.670 20 5 FHBDRN Cc1cccc(CN(C)C(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)c1 ZINC000514163714 942783971 /nfs/dbraw/zinc/78/39/71/942783971.db2.gz ASBXIKAGCONIEB-UHFFFAOYSA-N 0 0 350.321 3.777 20 5 FHBDRN CN(C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)[C@@H]1CCc2ccccc21 ZINC000514164158 942784581 /nfs/dbraw/zinc/78/45/81/942784581.db2.gz FZINWTDRCQWEHL-CQSZACIVSA-N 0 0 362.332 3.956 20 5 FHBDRN CC[C@@H]1C[C@@H](CC(=O)Nc2cc(C)nn2-c2ccc([N+](=O)[O-])cc2)CCO1 ZINC000514156752 942790054 /nfs/dbraw/zinc/79/00/54/942790054.db2.gz WTSDBUBLMTVLRH-WMLDXEAASA-N 0 0 372.425 3.623 20 5 FHBDRN CN(C)C(=O)c1cccc(CNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 ZINC000514181253 942791186 /nfs/dbraw/zinc/79/11/86/942791186.db2.gz AACIUNWXMFIRKG-UHFFFAOYSA-N 0 0 367.327 3.928 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2nc(CNc3cnc4c(c3)COCC4)cs2)c1 ZINC000378474754 942804074 /nfs/dbraw/zinc/80/40/74/942804074.db2.gz NDNUPUDYKKWQIS-UHFFFAOYSA-N 0 0 368.418 3.798 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NC[C@H](c1ccccc1)C(C)(C)CO ZINC000421785892 942810351 /nfs/dbraw/zinc/81/03/51/942810351.db2.gz ONMPUUIMOGOCEX-GOSISDBHSA-N 0 0 370.449 3.744 20 5 FHBDRN CN(Cc1cc(Cl)cc(Cl)c1)C(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000502862573 942811314 /nfs/dbraw/zinc/81/13/14/942811314.db2.gz OBPJYWRNQGFIQM-UHFFFAOYSA-N 0 0 369.204 3.939 20 5 FHBDRN NC(=O)Nc1cccc(CNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 ZINC000514186978 942812982 /nfs/dbraw/zinc/81/29/82/942812982.db2.gz OFRLKLGWXOIIRN-UHFFFAOYSA-N 0 0 354.288 3.716 20 5 FHBDRN Cc1nn(CC(=O)N[C@H](c2ccccc2)C(C)C)c2ccc([N+](=O)[O-])cc12 ZINC000502889676 942818634 /nfs/dbraw/zinc/81/86/34/942818634.db2.gz SDWOGVKDNAAXFM-FQEVSTJZSA-N 0 0 366.421 3.766 20 5 FHBDRN Cc1cc(NC(=O)CCc2ccccc2C)n(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000505449940 942819241 /nfs/dbraw/zinc/81/92/41/942819241.db2.gz WXHXWNUQUMVFJT-UHFFFAOYSA-N 0 0 364.405 3.969 20 5 FHBDRN Cc1nn(CC(=O)N2c3ccccc3CC[C@@H]2C)c2ccc([N+](=O)[O-])cc12 ZINC000502896437 942824120 /nfs/dbraw/zinc/82/41/20/942824120.db2.gz OOWOOJUURSBDSM-ZDUSSCGKSA-N 0 0 364.405 3.621 20 5 FHBDRN CCSc1cccc(NC(=O)C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000190119975 942824746 /nfs/dbraw/zinc/82/47/46/942824746.db2.gz RZGCOAYFUMCWBS-UHFFFAOYSA-N 0 0 359.407 3.592 20 5 FHBDRN O=C(N[C@@H]1CC[C@H]2CCC[C@H]2C1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514227900 942837960 /nfs/dbraw/zinc/83/79/60/942837960.db2.gz WSBGEERBLSXPKB-NTZNESFSSA-N 0 0 354.353 3.895 20 5 FHBDRN O=C(Nc1ccc([C@@H]2CCOC2)cc1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412375859 942838939 /nfs/dbraw/zinc/83/89/39/942838939.db2.gz ZUJCHQQKMXEHJE-AYOQOUSVSA-N 0 0 352.390 3.841 20 5 FHBDRN CCc1cc(NC(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)ccc1C ZINC000190187452 942850071 /nfs/dbraw/zinc/85/00/71/942850071.db2.gz IOMNBHJPGOEXQX-UHFFFAOYSA-N 0 0 361.785 3.696 20 5 FHBDRN CC(C)Oc1cc(C(=O)NC[C@@H]2CCO[C@@H](C(C)C)C2)ccc1[N+](=O)[O-] ZINC000412378035 942851862 /nfs/dbraw/zinc/85/18/62/942851862.db2.gz LFJLEFPYEPKELO-RHSMWYFYSA-N 0 0 364.442 3.563 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CC3(CCC3)[C@H]2[C@@H]2CCCO2)ccc1[N+](=O)[O-] ZINC000412378354 942855832 /nfs/dbraw/zinc/85/58/32/942855832.db2.gz ZKWKLPXVNKBINR-FUHWJXTLSA-N 0 0 374.437 3.556 20 5 FHBDRN O=C(c1c(F)cc(F)cc1F)C1CCN(c2ccncc2[N+](=O)[O-])CC1 ZINC000513759926 942857400 /nfs/dbraw/zinc/85/74/00/942857400.db2.gz LVNCPXFVWZHULR-UHFFFAOYSA-N 0 0 365.311 3.506 20 5 FHBDRN CN(C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)c1cc(F)ccc1F ZINC000514242644 942857671 /nfs/dbraw/zinc/85/76/71/942857671.db2.gz OCJRGAQMLXUXMW-UHFFFAOYSA-N 0 0 358.247 3.751 20 5 FHBDRN Cc1cc(F)cc2c1CN(Cc1nc(-c3ccc([N+](=O)[O-])cc3)no1)CC2 ZINC000502951016 942865973 /nfs/dbraw/zinc/86/59/73/942865973.db2.gz FPXUAFJDLHMBOW-UHFFFAOYSA-N 0 0 368.368 3.651 20 5 FHBDRN CC(C)[C@H](NC(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1)C(F)(F)F ZINC000413992965 942874279 /nfs/dbraw/zinc/87/42/79/942874279.db2.gz PWPZZMJTXFUXTI-CABZTGNLSA-N 0 0 350.362 3.779 20 5 FHBDRN CC(C)[C@H](NC(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1)C(F)(F)F ZINC000413992967 942874252 /nfs/dbraw/zinc/87/42/52/942874252.db2.gz PWPZZMJTXFUXTI-SKDRFNHKSA-N 0 0 350.362 3.779 20 5 FHBDRN CCc1ccc([C@H]2CN(C(=O)c3ccc(Cl)cc3[N+](=O)[O-])CCN2)cc1 ZINC000505476901 942878223 /nfs/dbraw/zinc/87/82/23/942878223.db2.gz PHBKCWMLLFRJTO-QGZVFWFLSA-N 0 0 373.840 3.597 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc(C)c2nccn2c1 ZINC000502987764 942885687 /nfs/dbraw/zinc/88/56/87/942885687.db2.gz VBVHHPVNEFRJKD-OAHLLOKOSA-N 0 0 352.394 3.758 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N1CCC[C@H](CC(F)(F)F)C1 ZINC000421933785 942886097 /nfs/dbraw/zinc/88/60/97/942886097.db2.gz AZPDJMZSSHOHIS-SNVBAGLBSA-N 0 0 364.751 3.982 20 5 FHBDRN O=C(c1c[nH]c2cc([N+](=O)[O-])ccc12)N1CCC[C@H](CC(F)(F)F)C1 ZINC000421949247 942902082 /nfs/dbraw/zinc/90/20/82/942902082.db2.gz XFDRHQVBIIAGDS-SNVBAGLBSA-N 0 0 355.316 3.881 20 5 FHBDRN O=C(c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)N1CC[C@H](C2CCCC2)C1 ZINC000421954269 942905085 /nfs/dbraw/zinc/90/50/85/942905085.db2.gz VDRWIVAPPGPPFF-ZDUSSCGKSA-N 0 0 355.394 3.501 20 5 FHBDRN COc1cccc2c1ncc(C)c2NC(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000430109001 942921176 /nfs/dbraw/zinc/92/11/76/942921176.db2.gz VQZHIRBJIHKMFD-UHFFFAOYSA-N 0 0 351.362 3.641 20 5 FHBDRN O=C(Cc1cnccc1Cl)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000412381128 942925254 /nfs/dbraw/zinc/92/52/54/942925254.db2.gz STNKAKGLDZELSZ-AWEZNQCLSA-N 0 0 359.813 3.592 20 5 FHBDRN O=C(CCCc1c[nH]c2ccccc12)NCCNc1ccc([N+](=O)[O-])cc1 ZINC000008174937 942930156 /nfs/dbraw/zinc/93/01/56/942930156.db2.gz MQGGCWGKHKYVIC-UHFFFAOYSA-N 0 0 366.421 3.627 20 5 FHBDRN O=C(c1cc(Cl)ccc1[N+](=O)[O-])N1CC[C@@H](n2ncc3ccccc32)C1 ZINC000378592114 942932588 /nfs/dbraw/zinc/93/25/88/942932588.db2.gz RIZLNAQXMDZZDJ-CQSZACIVSA-N 0 0 370.796 3.685 20 5 FHBDRN COCC[C@H](NC(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)C(C)(C)C ZINC000511566451 942940920 /nfs/dbraw/zinc/94/09/20/942940920.db2.gz PGWMXJSDVPJNSK-BBRMVZONSA-N 0 0 351.447 3.715 20 5 FHBDRN O=C(c1ccccc1)N1CCC(CNc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000078021292 942941368 /nfs/dbraw/zinc/94/13/68/942941368.db2.gz SSRRZFFOZNXFHX-UHFFFAOYSA-N 0 0 357.385 3.698 20 5 FHBDRN Cn1cc([N+](=O)[O-])c(C(=O)NC2(c3ccc(Cl)cc3)CCCCC2)n1 ZINC000503054085 942953753 /nfs/dbraw/zinc/95/37/53/942953753.db2.gz MKYKGFDZQFHNCN-UHFFFAOYSA-N 0 0 362.817 3.571 20 5 FHBDRN Cc1cc(C)cc(CN(C)S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])c1 ZINC000434778074 942954125 /nfs/dbraw/zinc/95/41/25/942954125.db2.gz QSUYHOKZQKXDCK-UHFFFAOYSA-N 0 0 368.842 3.686 20 5 FHBDRN C[C@H]1CN(C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c2ccc(F)cc2O1 ZINC000173514401 942954336 /nfs/dbraw/zinc/95/43/36/942954336.db2.gz OBRWZHHAERVGPR-VIFPVBQESA-N 0 0 350.733 3.815 20 5 FHBDRN Cc1ccc(S(=O)(=O)N(C)Cc2cc(Cl)ccc2F)cc1[N+](=O)[O-] ZINC000434767671 942956586 /nfs/dbraw/zinc/95/65/86/942956586.db2.gz JBIUIDDRGRTEMA-UHFFFAOYSA-N 0 0 372.805 3.516 20 5 FHBDRN C[C@H](NC(=O)CSc1nccn1C(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000503086955 942969225 /nfs/dbraw/zinc/96/92/25/942969225.db2.gz UZOYLZILXSZGGV-LBPRGKRZSA-N 0 0 362.455 3.516 20 5 FHBDRN CCn1cc(CCSc2ccc(Br)cc2[N+](=O)[O-])cn1 ZINC000505534534 942985944 /nfs/dbraw/zinc/98/59/44/942985944.db2.gz XIVGUMYYIYIWHK-UHFFFAOYSA-N 0 0 356.245 3.909 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN(C)[C@@H](C)c1c(F)cccc1F ZINC000434831923 942990605 /nfs/dbraw/zinc/99/06/05/942990605.db2.gz PQRJQNLIPGJZHJ-LBPRGKRZSA-N 0 0 363.364 3.813 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1Sc1ccccc1)N1CC[C@@]12CCOC2 ZINC000422088882 942994755 /nfs/dbraw/zinc/99/47/55/942994755.db2.gz MFRFFGNMFVRQSK-IBGZPJMESA-N 0 0 370.430 3.751 20 5 FHBDRN O=C(c1ccc([C@H]2CCCOC2)cc1)N1CCc2c1cccc2[N+](=O)[O-] ZINC000503112381 942995067 /nfs/dbraw/zinc/99/50/67/942995067.db2.gz ZGQMTZBOBXDSDK-INIZCTEOSA-N 0 0 352.390 3.692 20 5 FHBDRN Cc1cc(NC(=O)COCc2ccccc2)c2cc([N+](=O)[O-])ccc2n1 ZINC000183686969 943013245 /nfs/dbraw/zinc/01/32/45/943013245.db2.gz OPHLCQHFJNKSGW-UHFFFAOYSA-N 0 0 351.362 3.607 20 5 FHBDRN O=C(NC1CCC(O)(c2ccccc2)CC1)c1cc([N+](=O)[O-])ccc1Cl ZINC000273703715 943015956 /nfs/dbraw/zinc/01/59/56/943015956.db2.gz JPWNNFHKSYRHGG-UHFFFAOYSA-N 0 0 374.824 3.808 20 5 FHBDRN C[C@H](NS(=O)(=O)CCc1ccccc1[N+](=O)[O-])c1ccc(C2CC2)cc1 ZINC000416672381 943034848 /nfs/dbraw/zinc/03/48/48/943034848.db2.gz YPASYZQWOSYJNE-AWEZNQCLSA-N 0 0 374.462 3.695 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)N[C@H]2COCc3ccccc32)cc1[N+](=O)[O-] ZINC000416683995 943038894 /nfs/dbraw/zinc/03/88/94/943038894.db2.gz KYGZVMTVKNRKIZ-GUYCJALGSA-N 0 0 355.394 3.535 20 5 FHBDRN C[C@H](C(=O)NC[C@H]1CCOc2ccccc21)c1ccc([N+](=O)[O-])cc1F ZINC000183866002 943043884 /nfs/dbraw/zinc/04/38/84/943043884.db2.gz NMWUBGXIZQCVJA-QWHCGFSZSA-N 0 0 358.369 3.520 20 5 FHBDRN Cc1cc(NC(=O)c2ccc([N+](=O)[O-])s2)cnc1N1CCCC[C@@H]1C ZINC000503211784 943053152 /nfs/dbraw/zinc/05/31/52/943053152.db2.gz UIOAXFXGNJMVEK-LBPRGKRZSA-N 0 0 360.439 3.991 20 5 FHBDRN CC(C)[C@H](CNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21)c1cccnc1 ZINC000434170353 943055660 /nfs/dbraw/zinc/05/56/60/943055660.db2.gz QFVQBHPNGCQLNQ-SFHVURJKSA-N 0 0 366.421 3.501 20 5 FHBDRN Cc1c(CNC(=O)NC[C@@H](c2ccccc2)C2CC2)cccc1[N+](=O)[O-] ZINC000431898120 943058848 /nfs/dbraw/zinc/05/88/48/943058848.db2.gz JYELCEZISWHHAY-SFHVURJKSA-N 0 0 353.422 3.896 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CCN(Cc2ccccc2)[C@H](C)C1 ZINC000416728347 943059823 /nfs/dbraw/zinc/05/98/23/943059823.db2.gz LPSUNSJLGPWQFG-MRXNPFEDSA-N 0 0 368.437 3.641 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC(c2cccc(C(F)(F)F)c2)C1 ZINC000412401968 943061414 /nfs/dbraw/zinc/06/14/14/943061414.db2.gz YLGWOTBHRVFBEK-UHFFFAOYSA-N 0 0 365.311 3.557 20 5 FHBDRN CCc1ccc(C(=O)NCc2ncc(-c3ccccc3)cn2)cc1[N+](=O)[O-] ZINC000183892448 943065732 /nfs/dbraw/zinc/06/57/32/943065732.db2.gz KVRGQSBEGQQRBN-UHFFFAOYSA-N 0 0 362.389 3.544 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC(C)(C)c1c(C)noc1C ZINC000574301320 943081318 /nfs/dbraw/zinc/08/13/18/943081318.db2.gz BKSQRGXKGWULAU-HNNXBMFYSA-N 0 0 359.426 3.820 20 5 FHBDRN Cc1cc(NC(=O)Cc2cccc([N+](=O)[O-])c2)cnc1N1CCCC[C@@H]1C ZINC000503253201 943087084 /nfs/dbraw/zinc/08/70/84/943087084.db2.gz SOHJSKSXBUMCBP-HNNXBMFYSA-N 0 0 368.437 3.858 20 5 FHBDRN CS(=O)(=O)c1ccc(N2CCC[C@@H]2/C=C/c2ccccc2)c([N+](=O)[O-])c1 ZINC000503277345 943096924 /nfs/dbraw/zinc/09/69/24/943096924.db2.gz XWLXWHDFADIYMK-ZNFPLGDCSA-N 0 0 372.446 3.681 20 5 FHBDRN CCOc1cc(NCc2ccc(C(=O)OC)c(C3CC3)n2)ccc1[N+](=O)[O-] ZINC000503277466 943097076 /nfs/dbraw/zinc/09/70/76/943097076.db2.gz AUQUASISWYBMMK-UHFFFAOYSA-N 0 0 371.393 3.665 20 5 FHBDRN O=C(Nc1ccc2ncccc2c1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000514576341 943109003 /nfs/dbraw/zinc/10/90/03/943109003.db2.gz FFZKASNIRGSDPJ-UHFFFAOYSA-N 0 0 362.389 3.996 20 5 FHBDRN O=C(Nc1ccnn1CCc1ccccc1)c1ccc([N+](=O)[O-])cc1Cl ZINC000503334563 943125202 /nfs/dbraw/zinc/12/52/02/943125202.db2.gz RSXLUMLCHAWDNB-UHFFFAOYSA-N 0 0 370.796 3.940 20 5 FHBDRN Cc1c(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)oc2c1C(=O)CCC2 ZINC000183762505 943129568 /nfs/dbraw/zinc/12/95/68/943129568.db2.gz BVEMXVLKEXGKBE-UHFFFAOYSA-N 0 0 362.769 3.599 20 5 FHBDRN C[C@@H](C(=O)Nc1ccc2c(c1)CCCC(=O)N2)c1ccc([N+](=O)[O-])cc1F ZINC000183765196 943136924 /nfs/dbraw/zinc/13/69/24/943136924.db2.gz BJUOOICQAXPPLH-LLVKDONJSA-N 0 0 371.368 3.751 20 5 FHBDRN COCCCCCNC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 ZINC000058753995 943145626 /nfs/dbraw/zinc/14/56/26/943145626.db2.gz GZEIRZDSFBLXTQ-UHFFFAOYSA-N 0 0 358.394 3.934 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N(C2CC2)[C@H]2CCc3ccccc32)c1[N+](=O)[O-] ZINC000434194929 943170389 /nfs/dbraw/zinc/17/03/89/943170389.db2.gz UCNXGXMVYUNWQP-HNNXBMFYSA-N 0 0 354.410 3.733 20 5 FHBDRN Cc1cccc(C(=O)NCCc2ccc(Br)s2)c1[N+](=O)[O-] ZINC000014417752 943182905 /nfs/dbraw/zinc/18/29/05/943182905.db2.gz WTKSLDCAXBZJHQ-UHFFFAOYSA-N 0 0 369.240 3.700 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1)N(CCO)Cc1ccc(Cl)c(Cl)c1 ZINC000133684546 943183251 /nfs/dbraw/zinc/18/32/51/943183251.db2.gz LEZGNQCOWDBYJN-UHFFFAOYSA-N 0 0 369.204 3.536 20 5 FHBDRN COC(=O)c1ccc(OC(=O)[C@H]2CC[C@H]2c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC001267794901 943185676 /nfs/dbraw/zinc/18/56/76/943185676.db2.gz MBOADZNUCMZNEX-GJZGRUSLSA-N 0 0 373.336 3.620 20 5 FHBDRN CCN(c1cc(C)ccc1C)S(=O)(=O)CCc1ccc([N+](=O)[O-])cc1 ZINC000503451400 943188470 /nfs/dbraw/zinc/18/84/70/943188470.db2.gz ZCYKAHAJGBBTEP-UHFFFAOYSA-N 0 0 362.451 3.610 20 5 FHBDRN Cc1c(C(=O)Nc2cccc([N+](=O)[O-])c2)cnn1-c1cc(C)ccc1C ZINC000435159507 943199911 /nfs/dbraw/zinc/19/99/11/943199911.db2.gz SBMAPKDGSVKCQQ-UHFFFAOYSA-N 0 0 350.378 3.958 20 5 FHBDRN O=C(Nc1ccccc1OCc1cscn1)c1csc([N+](=O)[O-])c1 ZINC000503477164 943210145 /nfs/dbraw/zinc/21/01/45/943210145.db2.gz LBIFCOFIVHDALO-UHFFFAOYSA-N 0 0 361.404 3.944 20 5 FHBDRN O=C(CCC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1)c1cccc(F)c1 ZINC000503475205 943210312 /nfs/dbraw/zinc/21/03/12/943210312.db2.gz SDGPZDZZZLZGRH-UHFFFAOYSA-N 0 0 370.380 3.888 20 5 FHBDRN Cc1csc(-c2cccc(C(=O)Nc3ccc([N+](=O)[O-])c(C)n3)c2)n1 ZINC000133698408 943229339 /nfs/dbraw/zinc/22/93/39/943229339.db2.gz NBGDHQAHYCZZFE-UHFFFAOYSA-N 0 0 354.391 3.982 20 5 FHBDRN CN(CC(=O)Nc1ccc(-c2ccccn2)cc1)c1ccccc1[N+](=O)[O-] ZINC000514697817 943230282 /nfs/dbraw/zinc/23/02/82/943230282.db2.gz SYDSLZNBVRCWSX-UHFFFAOYSA-N 0 0 362.389 3.732 20 5 FHBDRN CCc1cc(NC(=O)c2nc(C)c(C)nc2C)c2cc([N+](=O)[O-])ccc2n1 ZINC000183822075 943235587 /nfs/dbraw/zinc/23/55/87/943235587.db2.gz OTNDBETUQPLYRM-UHFFFAOYSA-N 0 0 365.393 3.673 20 5 FHBDRN CC(C)c1[nH]nc(C(=O)Nc2nc3cc(F)c(F)cc3s2)c1[N+](=O)[O-] ZINC000434183529 943247373 /nfs/dbraw/zinc/24/73/73/943247373.db2.gz NYXPAEBKCPYCJT-UHFFFAOYSA-N 0 0 367.337 3.582 20 5 FHBDRN O=C(c1ccc(NC2CC2)c([N+](=O)[O-])c1)N1CC[C@@](F)(c2ccccc2)C1 ZINC000514741502 943253782 /nfs/dbraw/zinc/25/37/82/943253782.db2.gz KKEYSFVJKYXSDY-FQEVSTJZSA-N 0 0 369.396 3.880 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)C1CCOCC1 ZINC000503582154 943263913 /nfs/dbraw/zinc/26/39/13/943263913.db2.gz WIRSWYHNFQMOCW-GFCCVEGCSA-N 0 0 352.456 3.642 20 5 FHBDRN C[C@@H]1C[C@@H](CNC(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)[C@@H](C)O1 ZINC000416980854 943272634 /nfs/dbraw/zinc/27/26/34/943272634.db2.gz GTFONQFITURCBS-BBBLOLIVSA-N 0 0 361.320 3.549 20 5 FHBDRN O=[N+]([O-])c1cccc(F)c1CN1CCN(Cc2ccc(Cl)s2)CC1 ZINC000505641278 943278949 /nfs/dbraw/zinc/27/89/49/943278949.db2.gz UPCOYWRXTIEUHL-UHFFFAOYSA-N 0 0 369.849 3.767 20 5 FHBDRN C[C@@H](c1ccccc1Br)N(C)C(=O)c1ccc([N+](=O)[O-])[nH]1 ZINC000503612119 943290856 /nfs/dbraw/zinc/29/08/56/943290856.db2.gz DRXBRSXNWFZZML-VIFPVBQESA-N 0 0 352.188 3.519 20 5 FHBDRN CCCCCn1cc(CNC(=O)Nc2ccc(C)c([N+](=O)[O-])c2)c(C)n1 ZINC000503626374 943297385 /nfs/dbraw/zinc/29/73/85/943297385.db2.gz IXBUSQJRUKZWRW-UHFFFAOYSA-N 0 0 359.430 3.920 20 5 FHBDRN O=C(OCc1ccc([N+](=O)[O-])cc1Br)[C@H]1CCCCS1 ZINC000783388556 943301776 /nfs/dbraw/zinc/30/17/76/943301776.db2.gz SKFFDGGMQDEOBG-GFCCVEGCSA-N 0 0 360.229 3.686 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]([C@@H]2CCOC2)C1 ZINC000503637017 943312973 /nfs/dbraw/zinc/31/29/73/943312973.db2.gz KTNVUVJASIUQBC-UONOGXRCSA-N 0 0 364.467 3.596 20 5 FHBDRN Cc1cc(NCc2ccc(C(N)=O)cc2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000549462859 943322137 /nfs/dbraw/zinc/32/21/37/943322137.db2.gz JCEQJAYKYPINKK-UHFFFAOYSA-N 0 0 353.300 3.633 20 5 FHBDRN Cc1c(NC(=O)N[C@@H]2CC[C@H](C)C2)cc(Br)cc1[N+](=O)[O-] ZINC000435322299 943323248 /nfs/dbraw/zinc/32/32/48/943323248.db2.gz BOKFFQLHUINDKC-GZMMTYOYSA-N 0 0 356.220 3.976 20 5 FHBDRN CCn1cc(NC(=O)Nc2cc(Br)cc([N+](=O)[O-])c2C)cn1 ZINC000435322189 943323260 /nfs/dbraw/zinc/32/32/60/943323260.db2.gz AVBRBOIUIZFJGU-UHFFFAOYSA-N 0 0 368.191 3.526 20 5 FHBDRN CCOCCCCNC(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000435326573 943325567 /nfs/dbraw/zinc/32/55/67/943325567.db2.gz DMGXOJUXHINABV-UHFFFAOYSA-N 0 0 374.235 3.604 20 5 FHBDRN CSC[C@H](C)NC(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000435330658 943333752 /nfs/dbraw/zinc/33/37/52/943333752.db2.gz VDLSACJLAUJPCK-ZETCQYMHSA-N 0 0 362.249 3.539 20 5 FHBDRN O=C(NCCc1cc(F)c(F)c(F)c1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000503690711 943334585 /nfs/dbraw/zinc/33/45/85/943334585.db2.gz RENYMSHJXKEGKL-UHFFFAOYSA-N 0 0 358.703 3.638 20 5 FHBDRN Cc1c(NC(=O)N2CC[C@@H](C3CC3)C2)cc(Br)cc1[N+](=O)[O-] ZINC000435334222 943336826 /nfs/dbraw/zinc/33/68/26/943336826.db2.gz XTSKNBRTCGUCQQ-LLVKDONJSA-N 0 0 368.231 3.930 20 5 FHBDRN O=C(CN1CC[C@H]1c1ccc(Cl)cc1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000511602520 943337988 /nfs/dbraw/zinc/33/79/88/943337988.db2.gz BLFCPIHIMNINGF-KRWDZBQOSA-N 0 0 371.824 3.584 20 5 FHBDRN O=C(Nc1nnc(-c2ccco2)s1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000053208165 943344665 /nfs/dbraw/zinc/34/46/65/943344665.db2.gz BJGWCLKSYMCUBS-UHFFFAOYSA-N 0 0 350.743 3.612 20 5 FHBDRN Cc1c(Cc2noc(C(=O)Nc3ccc(Cl)cc3)n2)cccc1[N+](=O)[O-] ZINC000514895643 943357730 /nfs/dbraw/zinc/35/77/30/943357730.db2.gz BSGBOBADNBPKIA-UHFFFAOYSA-N 0 0 372.768 3.783 20 5 FHBDRN Nc1c(C(=O)NCCCc2cccc(C(F)(F)F)c2)cccc1[N+](=O)[O-] ZINC000468698813 943358945 /nfs/dbraw/zinc/35/89/45/943358945.db2.gz BXFUADJXNGHUQO-UHFFFAOYSA-N 0 0 367.327 3.558 20 5 FHBDRN C[C@H](NC(=O)NCc1cccc2c1CCCN2)c1cccc([N+](=O)[O-])c1 ZINC000417127072 943361951 /nfs/dbraw/zinc/36/19/51/943361951.db2.gz FIBDSCVUWHIWFV-ZDUSSCGKSA-N 0 0 354.410 3.513 20 5 FHBDRN CCCOc1ccc2c(c1)CCN(C(=O)c1cc(OC)ccc1[N+](=O)[O-])C2 ZINC000435379000 943368982 /nfs/dbraw/zinc/36/89/82/943368982.db2.gz HHZZPHHZAAAMJQ-UHFFFAOYSA-N 0 0 370.405 3.591 20 5 FHBDRN CCCOc1ccc2c(c1)CCN(C(=O)c1cc(C)cc([N+](=O)[O-])c1)C2 ZINC000435383461 943371131 /nfs/dbraw/zinc/37/11/31/943371131.db2.gz GVYIRAIUBBUCSA-UHFFFAOYSA-N 0 0 354.406 3.891 20 5 FHBDRN COc1ccc(CNC(=O)N2CC[C@H](c3ccccc3)[C@H]2C)cc1[N+](=O)[O-] ZINC000435384567 943372428 /nfs/dbraw/zinc/37/24/28/943372428.db2.gz NEEJBKHHVSAMDV-PBHICJAKSA-N 0 0 369.421 3.691 20 5 FHBDRN O=C(N[C@H](Cc1ccc(Cl)cc1)c1ccccn1)c1ccc([N+](=O)[O-])[nH]1 ZINC000503844290 943382193 /nfs/dbraw/zinc/38/21/93/943382193.db2.gz PXUIWVIASQRLQH-MRXNPFEDSA-N 0 0 370.796 3.685 20 5 FHBDRN O=C(CSCc1ccc(Cl)cc1)NCCc1ccc([N+](=O)[O-])cc1 ZINC000053217281 943385748 /nfs/dbraw/zinc/38/57/48/943385748.db2.gz SIIACRDCXAQYKP-UHFFFAOYSA-N 0 0 364.854 3.840 20 5 FHBDRN Cc1ccc(Cl)c(O[C@H](C)C(=O)NCCc2ccc([N+](=O)[O-])cc2)c1 ZINC000053218945 943385857 /nfs/dbraw/zinc/38/58/57/943385857.db2.gz SNBJDNHRTXFWIR-CYBMUJFWSA-N 0 0 362.813 3.683 20 5 FHBDRN Cc1ccc2c(CCNC(=O)CCOc3ccccc3[N+](=O)[O-])c[nH]c2c1 ZINC000503865906 943390696 /nfs/dbraw/zinc/39/06/96/943390696.db2.gz XYHWCMMRPDZWSH-UHFFFAOYSA-N 0 0 367.405 3.512 20 5 FHBDRN CC(C)c1cc(NC(=O)c2cc([N+](=O)[O-])cn2C)n(Cc2ccccc2)n1 ZINC000566433849 943412861 /nfs/dbraw/zinc/41/28/61/943412861.db2.gz ZVBMRJIVBDNSQC-UHFFFAOYSA-N 0 0 367.409 3.554 20 5 FHBDRN Cc1cc(C)c(S(=O)(=O)N(C)c2ccc(Cl)cc2F)cc1[N+](=O)[O-] ZINC000435475785 943434177 /nfs/dbraw/zinc/43/41/77/943434177.db2.gz XQELSLDGSQDFTQ-UHFFFAOYSA-N 0 0 372.805 3.829 20 5 FHBDRN Cc1ccc(CCc2nc(CCNc3ccccc3[N+](=O)[O-])no2)s1 ZINC000515020158 943450308 /nfs/dbraw/zinc/45/03/08/943450308.db2.gz OZVXWPHKOQNYIB-UHFFFAOYSA-N 0 0 358.423 3.788 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2noc([C@@H]3COCC[C@@H]3c3ccccc3)n2)cc1 ZINC000417238639 943455362 /nfs/dbraw/zinc/45/53/62/943455362.db2.gz MHLFURMIJHKOIZ-IAGOWNOFSA-N 0 0 351.362 3.933 20 5 FHBDRN O=C(NC[C@H]1CCC[C@H]1C1CC1)c1sc(Br)cc1[N+](=O)[O-] ZINC000412473368 943466770 /nfs/dbraw/zinc/46/67/70/943466770.db2.gz KDJKUDLTQABTHX-ZJUUUORDSA-N 0 0 373.272 3.975 20 5 FHBDRN CCC1(CC)CN(C(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)C1 ZINC000504035874 943476434 /nfs/dbraw/zinc/47/64/34/943476434.db2.gz QBFZCBZBPGTCJG-UHFFFAOYSA-N 0 0 355.232 3.928 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)c2cnccc2C(F)(F)F)cc1[N+](=O)[O-] ZINC000584728276 943486704 /nfs/dbraw/zinc/48/67/04/943486704.db2.gz HEERIEDXMDMPDR-SNVBAGLBSA-N 0 0 353.300 3.808 20 5 FHBDRN O=C(c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)N1CCSC12CCCCC2 ZINC000566461908 943506392 /nfs/dbraw/zinc/50/63/92/943506392.db2.gz QPBRZIIBVWXYPJ-UHFFFAOYSA-N 0 0 372.450 3.630 20 5 FHBDRN CNC(=O)c1cc([N+](=O)[O-])ccc1N[C@H]1C[C@H](c2cc(F)cc(F)c2)C1 ZINC000435604331 943512757 /nfs/dbraw/zinc/51/27/57/943512757.db2.gz OUCMWFDONMAVOR-YEORSEQZSA-N 0 0 361.348 3.591 20 5 FHBDRN Cc1ccc([C@@H]2NC(=O)N([C@H](C)c3ccc(C)c([N+](=O)[O-])c3)C2=O)cc1C ZINC000431938544 943528495 /nfs/dbraw/zinc/52/84/95/943528495.db2.gz NFMLXNGRVHARBU-KDOFPFPSSA-N 0 0 367.405 3.874 20 5 FHBDRN CCC(=O)c1ccc(Oc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)c(F)c1 ZINC000468712906 943532113 /nfs/dbraw/zinc/53/21/13/943532113.db2.gz AVZQDVPASMCFDS-UHFFFAOYSA-N 0 0 367.354 3.522 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)N1CC[C@H](COc2ccccc2)C1 ZINC000504166449 943533094 /nfs/dbraw/zinc/53/30/94/943533094.db2.gz OMNJFWQZBRXLDJ-HNNXBMFYSA-N 0 0 372.446 3.614 20 5 FHBDRN CCN(Cc1ccc(C)cc1)C(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000515157094 943537392 /nfs/dbraw/zinc/53/73/92/943537392.db2.gz MWRJVKAWHJAGIB-UHFFFAOYSA-N 0 0 364.405 3.751 20 5 FHBDRN Cc1cc(OCC(=O)N[C@@H]2CCC[C@@H]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC001126416082 943543110 /nfs/dbraw/zinc/54/31/10/943543110.db2.gz ZYRBFAWGPAHXLD-IEBWSBKVSA-N 0 0 368.433 3.810 20 5 FHBDRN CC(C)C[C@H]1CCN(C(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000515191707 943546919 /nfs/dbraw/zinc/54/69/19/943546919.db2.gz AKIWUVOPRMXEEQ-CQSZACIVSA-N 0 0 358.442 3.696 20 5 FHBDRN C[S@@](=O)C1(CNc2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])CCC1 ZINC000435666173 943547968 /nfs/dbraw/zinc/54/79/68/943547968.db2.gz ZLQUVTZLCYQLPC-AREMUKBSSA-N 0 0 372.446 3.539 20 5 FHBDRN CN(C)[C@H](c1nc(-c2ccc([N+](=O)[O-])cc2)no1)c1cccc(Cl)c1 ZINC000504223900 943553970 /nfs/dbraw/zinc/55/39/70/943553970.db2.gz ZJLMWNRMYJLUBQ-HNNXBMFYSA-N 0 0 358.785 3.949 20 5 FHBDRN CC(C)SCC(=O)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F ZINC000515198436 943561418 /nfs/dbraw/zinc/56/14/18/943561418.db2.gz ROTRIQQLSQGBRT-UHFFFAOYSA-N 0 0 350.362 3.627 20 5 FHBDRN COc1cc(NC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)c(C)c(OC)c1 ZINC000504252592 943563701 /nfs/dbraw/zinc/56/37/01/943563701.db2.gz FMKJDIAAFJFGEQ-UHFFFAOYSA-N 0 0 355.350 3.654 20 5 FHBDRN COc1cccc(NC(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)c1OC ZINC000894309351 943575541 /nfs/dbraw/zinc/57/55/41/943575541.db2.gz ZCOSFNCQCBZFRB-UHFFFAOYSA-N 0 0 360.366 3.652 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)Nc1nn(C2CCCCC2)cc1C ZINC000434223551 943577454 /nfs/dbraw/zinc/57/74/54/943577454.db2.gz VOMPQFHCTFUSNG-UHFFFAOYSA-N 0 0 373.413 3.679 20 5 FHBDRN C[C@@H](Oc1cccc(Cl)c1)C(=O)N1c2ccc([N+](=O)[O-])cc2C[C@@H]1C ZINC000504299279 943579208 /nfs/dbraw/zinc/57/92/08/943579208.db2.gz MQPBRYCZRGFFHM-NWDGAFQWSA-N 0 0 360.797 3.993 20 5 FHBDRN Cc1cc(C)cc(OCCC(=O)N2c3ccc([N+](=O)[O-])cc3C[C@H]2C)c1 ZINC000504286672 943582082 /nfs/dbraw/zinc/58/20/82/943582082.db2.gz SAGGWDUJCUPHAV-OAHLLOKOSA-N 0 0 354.406 3.958 20 5 FHBDRN COc1ccc(CCCC(=O)N2c3ccc([N+](=O)[O-])cc3C[C@H]2C)cc1 ZINC000504286114 943582178 /nfs/dbraw/zinc/58/21/78/943582178.db2.gz JGMHQMBTQMTOJW-CQSZACIVSA-N 0 0 354.406 3.904 20 5 FHBDRN CCn1c(C)nc([N+](=O)[O-])c1N1CCn2c(cc3c2cccc3Cl)C1 ZINC000515227670 943582903 /nfs/dbraw/zinc/58/29/03/943582903.db2.gz RJPDEUOADRDOIB-UHFFFAOYSA-N 0 0 359.817 3.748 20 5 FHBDRN CCC(CC)N(CC)S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000515248514 943584546 /nfs/dbraw/zinc/58/45/46/943584546.db2.gz ZSLNFYTWJQMTTG-UHFFFAOYSA-N 0 0 368.377 3.813 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NCc1ccc2c(c1)CCCN2 ZINC000423696551 943593238 /nfs/dbraw/zinc/59/32/38/943593238.db2.gz XQRPDQQWYXTXAD-UHFFFAOYSA-N 0 0 353.422 3.808 20 5 FHBDRN O=C(NCCc1ccccc1[N+](=O)[O-])N1CCCCC[C@@H]1c1ccncc1 ZINC000074764482 943594975 /nfs/dbraw/zinc/59/49/75/943594975.db2.gz QLUKXHZYSFFXQC-GOSISDBHSA-N 0 0 368.437 3.859 20 5 FHBDRN C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)Cc1ccc2c(c1)CCCC2 ZINC000504346894 943600349 /nfs/dbraw/zinc/60/03/49/943600349.db2.gz BMDBGCXVXVFSIT-AWEZNQCLSA-N 0 0 350.418 3.994 20 5 FHBDRN COC(=O)[C@H](C)c1ccc(NC(=O)N(C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000417428654 943603298 /nfs/dbraw/zinc/60/32/98/943603298.db2.gz HSKNPSSSQLNVRT-CYBMUJFWSA-N 0 0 371.393 3.535 20 5 FHBDRN Cc1cc(OCC(=O)Nc2cc(F)ccc2NC(C)C)ccc1[N+](=O)[O-] ZINC000435756996 943606054 /nfs/dbraw/zinc/60/60/54/943606054.db2.gz WTUSUYOONOGRDX-UHFFFAOYSA-N 0 0 361.373 3.880 20 5 FHBDRN Cc1ccc(N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3Cl)CC2)cc1C ZINC000760018106 943623195 /nfs/dbraw/zinc/62/31/95/943623195.db2.gz JRMOIZPFYSNCHN-UHFFFAOYSA-N 0 0 373.840 3.827 20 5 FHBDRN Cc1cc(Sc2nnc3ccc(Br)cn32)ccc1[N+](=O)[O-] ZINC000584792561 943626310 /nfs/dbraw/zinc/62/63/10/943626310.db2.gz RNYCACWZFMGFJT-UHFFFAOYSA-N 0 0 365.212 3.860 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)Cc1ccccc1C(F)(F)F ZINC000105364905 943639479 /nfs/dbraw/zinc/63/94/79/943639479.db2.gz OWZOLJMBSHCMFR-UHFFFAOYSA-N 0 0 354.284 3.803 20 5 FHBDRN CC(C)(C)c1cccc(OCCn2c3cc([N+](=O)[O-])ccc3oc2=O)c1 ZINC000504501906 943646995 /nfs/dbraw/zinc/64/69/95/943646995.db2.gz CCGZADIHRBYRLO-UHFFFAOYSA-N 0 0 356.378 3.879 20 5 FHBDRN CCn1c(=O)c2sccc2nc1SCc1c(F)cccc1[N+](=O)[O-] ZINC000504507749 943648646 /nfs/dbraw/zinc/64/86/46/943648646.db2.gz MNSDSLQESFHMCN-UHFFFAOYSA-N 0 0 365.411 3.818 20 5 FHBDRN CCOc1cc2c(cc1[C@@H]1C[C@@H]1Nc1ccc([N+](=O)[O-])nc1)O[C@H](C)C2 ZINC000584804562 943649242 /nfs/dbraw/zinc/64/92/42/943649242.db2.gz TYNGZDVUJQQASV-WPGHFRTFSA-N 0 0 355.394 3.680 20 5 FHBDRN CCOc1cc2c(cc1[C@@H]1C[C@H]1Nc1ccc([N+](=O)[O-])nc1)O[C@@H](C)C2 ZINC000584804560 943649347 /nfs/dbraw/zinc/64/93/47/943649347.db2.gz TYNGZDVUJQQASV-HZUKXOBISA-N 0 0 355.394 3.680 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCC[C@H]1OC ZINC000504554621 943676190 /nfs/dbraw/zinc/67/61/90/943676190.db2.gz LGYAIOIIIYETTO-SWLSCSKDSA-N 0 0 352.456 3.642 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)[C@@H]1CCCCO1 ZINC000504579040 943690686 /nfs/dbraw/zinc/69/06/86/943690686.db2.gz VEKRIMNZMCGEME-DOMZBBRYSA-N 0 0 352.456 3.784 20 5 FHBDRN C[C@@H](OC(=O)Cc1ccc([N+](=O)[O-])cc1Br)c1cccnc1 ZINC000756530787 943694395 /nfs/dbraw/zinc/69/43/95/943694395.db2.gz VWXACMBMIUUWMZ-SNVBAGLBSA-N 0 0 365.183 3.599 20 5 FHBDRN C[C@H]1[C@@H](C(=O)NC(C)(C)c2ccccc2[N+](=O)[O-])CCN1c1ccccc1 ZINC000584830998 943711373 /nfs/dbraw/zinc/71/13/73/943711373.db2.gz DPKBRTMPHZIUGA-RDJZCZTQSA-N 0 0 367.449 3.861 20 5 FHBDRN COCC1(CNC(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CCC1 ZINC000504636278 943724667 /nfs/dbraw/zinc/72/46/67/943724667.db2.gz OLXMXVWRPRQUBD-UHFFFAOYSA-N 0 0 361.320 3.552 20 5 FHBDRN CCO[C@@H](C)c1nccn1Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000424089062 943725503 /nfs/dbraw/zinc/72/55/03/943725503.db2.gz IGEGLNNRXSKZQX-JTQLQIEISA-N 0 0 354.204 3.700 20 5 FHBDRN COc1cnccc1[C@@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000504665878 943735251 /nfs/dbraw/zinc/73/52/51/943735251.db2.gz NBUQDYOVDASPGX-SECBINFHSA-N 0 0 369.299 3.508 20 5 FHBDRN Cc1cc(OC[C@H](O)COc2ccc(F)cc2)c(Cl)cc1[N+](=O)[O-] ZINC000504673956 943739835 /nfs/dbraw/zinc/73/98/35/943739835.db2.gz SMCQSWMNMPZNCL-GFCCVEGCSA-N 0 0 355.749 3.514 20 5 FHBDRN C[C@@H]([NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)[C@H](C)C(=O)[O-] ZINC000417618618 943754543 /nfs/dbraw/zinc/75/45/43/943754543.db2.gz XYGJNUZEHPTJEZ-NWDGAFQWSA-N 0 0 362.357 3.725 20 5 FHBDRN Cc1cnn(CCSCc2ccc(Br)cc2[N+](=O)[O-])c1 ZINC000424128708 943756994 /nfs/dbraw/zinc/75/69/94/943756994.db2.gz WZAJGPQLSKMBOD-UHFFFAOYSA-N 0 0 356.245 3.796 20 5 FHBDRN CCC[C@@]1(C)CCCN(C(=O)c2nnn(-c3cccc([N+](=O)[O-])c3)c2C)C1 ZINC000437375962 943761516 /nfs/dbraw/zinc/76/15/16/943761516.db2.gz LCGDKFCRKUVMSF-IBGZPJMESA-N 0 0 371.441 3.526 20 5 FHBDRN O=C(N[C@@H]1CCCOc2ccccc21)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000504718089 943767652 /nfs/dbraw/zinc/76/76/52/943767652.db2.gz YKJAIEFERFUQNC-MRXNPFEDSA-N 0 0 367.405 3.813 20 5 FHBDRN CC(C)c1ccc(C(=O)N(C)CCN(C)c2ccccc2)cc1[N+](=O)[O-] ZINC000473579603 943768875 /nfs/dbraw/zinc/76/88/75/943768875.db2.gz XOINSWZZFUOIRW-UHFFFAOYSA-N 0 0 355.438 3.927 20 5 FHBDRN Cc1sc(C(=O)NCc2ccc(-c3cccnc3)cc2)cc1[N+](=O)[O-] ZINC000437394712 943771848 /nfs/dbraw/zinc/77/18/48/943771848.db2.gz SVFYDTUWMCJHKT-UHFFFAOYSA-N 0 0 353.403 3.957 20 5 FHBDRN COc1ccc(C(=O)Nc2ccc3cc([N+](=O)[O-])ccc3n2)cc1C1CC1 ZINC000435815885 943772677 /nfs/dbraw/zinc/77/26/77/943772677.db2.gz HKRXYIVEKQCSSZ-UHFFFAOYSA-N 0 0 363.373 3.703 20 5 FHBDRN COC(=O)c1ccc(OCC(=O)c2cc(C)c(C)c(C)c2C)c([N+](=O)[O-])c1 ZINC000024938114 943772737 /nfs/dbraw/zinc/77/27/37/943772737.db2.gz LQLAVJMQOMXWBH-UHFFFAOYSA-N 0 0 371.389 3.877 20 5 FHBDRN O=C(Nc1ccc2cc([N+](=O)[O-])ccc2n1)C1CCC(C(F)(F)F)CC1 ZINC000435818391 943774977 /nfs/dbraw/zinc/77/49/77/943774977.db2.gz SGIZSNSOFVPRBB-UHFFFAOYSA-N 0 0 367.327 3.872 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H]1C[C@H](c2cccc(Cl)c2)C1 ZINC000437400345 943777932 /nfs/dbraw/zinc/77/79/32/943777932.db2.gz KGXORMYADMWESH-MQMHXKEQSA-N 0 0 360.797 3.933 20 5 FHBDRN CC(=O)Nc1cc(NC(=O)c2cc(F)cc(C)c2[N+](=O)[O-])ccc1Cl ZINC000126549940 943781230 /nfs/dbraw/zinc/78/12/30/943781230.db2.gz SBHDEBVCGPUDLM-UHFFFAOYSA-N 0 0 365.748 3.906 20 5 FHBDRN O=[N+]([O-])c1c(N[C@H]2CC[C@H](Nc3ccccn3)CC2)nc2sccn21 ZINC000516892484 943785561 /nfs/dbraw/zinc/78/55/61/943785561.db2.gz OECGNFHFBRQWBZ-HAQNSBGRSA-N 0 0 358.427 3.534 20 5 FHBDRN CN(CCOc1ccccc1)C(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000435813483 943787049 /nfs/dbraw/zinc/78/70/49/943787049.db2.gz IRHXGUAMTABMBK-UHFFFAOYSA-N 0 0 372.424 3.832 20 5 FHBDRN COc1cc(NC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)cc(OC)c1 ZINC000435830321 943788544 /nfs/dbraw/zinc/78/85/44/943788544.db2.gz DTHKLSHATUJUID-UHFFFAOYSA-N 0 0 374.396 3.951 20 5 FHBDRN C[C@@H]([C@@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C(=O)[O-])C1CC1 ZINC000417639320 943788801 /nfs/dbraw/zinc/78/88/01/943788801.db2.gz LUHKNOSPKGROGF-PIGZYNQJSA-N 0 0 360.435 3.912 20 5 FHBDRN Nc1ccc(-c2noc([C@@H]3C[C@@H]3c3ccc(F)cc3F)n2)cc1[N+](=O)[O-] ZINC000515329566 943792699 /nfs/dbraw/zinc/79/26/99/943792699.db2.gz VETVPZGSQWGNQL-VXGBXAGGSA-N 0 0 358.304 3.776 20 5 FHBDRN Cc1ccccc1CC(C)(C)NC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000516889811 943798762 /nfs/dbraw/zinc/79/87/62/943798762.db2.gz RLYGAMHAJUFKDC-UHFFFAOYSA-N 0 0 362.376 3.861 20 5 FHBDRN COC[C@H](C)Nc1ccccc1NC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000516905472 943803885 /nfs/dbraw/zinc/80/38/85/943803885.db2.gz NDODSJSLKWZQJJ-UONOGXRCSA-N 0 0 357.410 3.784 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2nc(-c3ccc(OCc4cccnc4)cc3)no2)[nH]1 ZINC000504809536 943806647 /nfs/dbraw/zinc/80/66/47/943806647.db2.gz KHWNWZDUAWJZCN-UHFFFAOYSA-N 0 0 363.333 3.614 20 5 FHBDRN C[C@@H](NC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1)[C@H]1Oc2ccccc2[C@H]1C ZINC000437447959 943808715 /nfs/dbraw/zinc/80/87/15/943808715.db2.gz FKJCJJWDHOLJQB-QJNYJZHLSA-N 0 0 369.421 3.908 20 5 FHBDRN CN(C(=O)CCc1ccc([N+](=O)[O-])cc1Cl)c1ccc(Cl)cn1 ZINC001125911466 943812561 /nfs/dbraw/zinc/81/25/61/943812561.db2.gz RNXDPEWGABLYLY-UHFFFAOYSA-N 0 0 354.193 3.892 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1CN1CCCC2(CCOCC2)C1 ZINC000515348766 943813283 /nfs/dbraw/zinc/81/32/83/943813283.db2.gz KIYGBFABKGAQKZ-UHFFFAOYSA-N 0 0 369.259 3.750 20 5 FHBDRN C[C@@H]1COCC[C@H]1C(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000435872258 943825729 /nfs/dbraw/zinc/82/57/29/943825729.db2.gz NNXQINBTKUDJHA-FZKQIMNGSA-N 0 0 356.378 3.998 20 5 FHBDRN O=C(CCc1ccc([N+](=O)[O-])cc1Cl)Nc1ccc(OC(F)F)nc1 ZINC001270220804 943830127 /nfs/dbraw/zinc/83/01/27/943830127.db2.gz CJCKFMQNYCRXRX-UHFFFAOYSA-N 0 0 371.727 3.816 20 5 FHBDRN Cc1cccc(CCCNC(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)n1 ZINC000515391334 943835158 /nfs/dbraw/zinc/83/51/58/943835158.db2.gz NCLFSRPONUJPSC-UHFFFAOYSA-N 0 0 355.438 3.958 20 5 FHBDRN CCC(O)(CC)C(C)(C)CN[C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000566502004 943838799 /nfs/dbraw/zinc/83/87/99/943838799.db2.gz WHIAMSPULNDFDN-QGZVFWFLSA-N 0 0 374.485 3.585 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1CN(C)Cc1cc(OC)c(OC)cc1C ZINC000506056097 943839760 /nfs/dbraw/zinc/83/97/60/943839760.db2.gz QGBHRYCIIMUEOH-UHFFFAOYSA-N 0 0 374.437 3.951 20 5 FHBDRN Cn1ccnc1[C@H](N[C@H]1C[C@]1(F)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000424317735 943840293 /nfs/dbraw/zinc/84/02/93/943840293.db2.gz GVNAWPDNVDIKGJ-NSHGMRRFSA-N 0 0 366.396 3.645 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N(Cc1ccccc1)CC(C)(C)C ZINC000504870643 943859516 /nfs/dbraw/zinc/85/95/16/943859516.db2.gz OHJLLUPUNYQQGJ-UHFFFAOYSA-N 0 0 358.442 3.565 20 5 FHBDRN O=[N+]([O-])c1cc2c(nc1N[C@H]1CCOC3(CCSCC3)C1)CCCC2 ZINC000516967550 943869162 /nfs/dbraw/zinc/86/91/62/943869162.db2.gz LFKZEVRTZSVNCK-AWEZNQCLSA-N 0 0 363.483 3.725 20 5 FHBDRN COC1(CNC(=O)c2cc([N+](=O)[O-])ccc2SCC(C)C)CCC1 ZINC000504862754 943871800 /nfs/dbraw/zinc/87/18/00/943871800.db2.gz WIWDASDVSOCWFF-UHFFFAOYSA-N 0 0 352.456 3.642 20 5 FHBDRN C[C@H](c1ccccn1)N(C)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425425474 943874377 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20 5 FHBDRN CC(C)(C(=O)NCCc1cc(F)c(F)c(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000504901950 943901770 /nfs/dbraw/zinc/90/17/70/943901770.db2.gz HUUSPTLXYFYREP-UHFFFAOYSA-N 0 0 366.339 3.649 20 5 FHBDRN O=C(NC[C@H]1CCCOC1)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000515465994 943903609 /nfs/dbraw/zinc/90/36/09/943903609.db2.gz WZJDWOYOEUIDQJ-CQSZACIVSA-N 0 0 371.393 3.935 20 5 FHBDRN Cc1csc(Sc2ccc(C(=O)N3CC[C@H](C)C3)cc2[N+](=O)[O-])n1 ZINC000504916198 943912043 /nfs/dbraw/zinc/91/20/43/943912043.db2.gz ZCWFSTXRUNHPCM-JTQLQIEISA-N 0 0 363.464 3.993 20 5 FHBDRN Cc1c(Cl)cccc1NC(=O)COC(=O)/C=C\c1ccc([N+](=O)[O-])cc1 ZINC000215234714 943915211 /nfs/dbraw/zinc/91/52/11/943915211.db2.gz PRKRTOZOQBCLMP-YFHOEESVSA-N 0 0 374.780 3.752 20 5 FHBDRN O=C(NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CC2(CCC2)[C@@H]1C1CC1 ZINC000584503546 943917700 /nfs/dbraw/zinc/91/77/00/943917700.db2.gz LXWUVWMBDHWZQR-SFHVURJKSA-N 0 0 368.437 3.593 20 5 FHBDRN COc1ccc(CC2CCN(C(=O)Cc3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000504940140 943918961 /nfs/dbraw/zinc/91/89/61/943918961.db2.gz YIIYKSULVZJSAE-UHFFFAOYSA-N 0 0 368.433 3.627 20 5 FHBDRN COc1cccc(CCNC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)c1 ZINC000435992712 943919137 /nfs/dbraw/zinc/91/91/37/943919137.db2.gz DJHJVGODCGLWPO-UHFFFAOYSA-N 0 0 372.424 3.662 20 5 FHBDRN CCOc1ccc([C@H](C)NCc2nccn2CC(F)(F)F)cc1[N+](=O)[O-] ZINC000504927778 943924993 /nfs/dbraw/zinc/92/49/93/943924993.db2.gz UKWQNBPICMPRRO-NSHDSACASA-N 0 0 372.347 3.603 20 5 FHBDRN CC(C)Cn1ncc(NC(=O)NCCc2cccc([N+](=O)[O-])c2)c1C(C)C ZINC000500003479 943930627 /nfs/dbraw/zinc/93/06/27/943930627.db2.gz XAAQNMKHOWKAAX-UHFFFAOYSA-N 0 0 373.457 3.935 20 5 FHBDRN COC(=O)C[C@H](NC(=O)Nc1cccc([N+](=O)[O-])c1C)C1CCCCC1 ZINC000437578265 943933952 /nfs/dbraw/zinc/93/39/52/943933952.db2.gz JDZCVWIHAOAJDM-HNNXBMFYSA-N 0 0 363.414 3.537 20 5 FHBDRN O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)N1CC2(CCC2)c2ccccc21 ZINC000517054415 943938244 /nfs/dbraw/zinc/93/82/44/943938244.db2.gz IHGBJFJXVLEICN-UHFFFAOYSA-N 0 0 358.344 3.884 20 5 FHBDRN COc1cc(C(=O)N2CCC(Cc3ccc(F)cc3)CC2)ccc1[N+](=O)[O-] ZINC000504971395 943945156 /nfs/dbraw/zinc/94/51/56/943945156.db2.gz QWHJCLQRYHHMTI-UHFFFAOYSA-N 0 0 372.396 3.837 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2c(C)cnn2-c2ccccc2)c1 ZINC000517043063 943945954 /nfs/dbraw/zinc/94/59/54/943945954.db2.gz KRXJPUHSJMDLRA-UHFFFAOYSA-N 0 0 366.377 3.740 20 5 FHBDRN Cc1nn(CC(C)C)c(C)c1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000504974790 943947098 /nfs/dbraw/zinc/94/70/98/943947098.db2.gz KQBDIKCHBMIYQI-UHFFFAOYSA-N 0 0 355.398 3.705 20 5 FHBDRN O=[N+]([O-])c1cccc(N2CCN(Cc3cc4c(cccc4F)[nH]3)CC2)c1 ZINC000437585227 943947068 /nfs/dbraw/zinc/94/70/68/943947068.db2.gz ALSNXBCDPMTELN-UHFFFAOYSA-N 0 0 354.385 3.537 20 5 FHBDRN Cc1ccccc1[C@@H]1CCN(C(=O)CCOc2ccccc2[N+](=O)[O-])C1 ZINC000504976046 943947712 /nfs/dbraw/zinc/94/77/12/943947712.db2.gz ADPXITZJHQSACK-MRXNPFEDSA-N 0 0 354.406 3.688 20 5 FHBDRN CC(C)(C(=O)N1CC2(CCCC2)OC(C)(C)C1)c1ccccc1[N+](=O)[O-] ZINC000504978439 943949769 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FHBDRN O=C(Nc1ccc(-c2nc(-c3cccc([N+](=O)[O-])c3)no2)cc1)C1CC1 ZINC000505018117 943972302 /nfs/dbraw/zinc/97/23/02/943972302.db2.gz GAOPSRJHGMFHQQ-UHFFFAOYSA-N 0 0 350.334 3.660 20 5 FHBDRN C[C@@H]1CN(C(=O)CCc2cc(F)ccc2[N+](=O)[O-])c2ccc(F)cc2O1 ZINC001126456737 943977598 /nfs/dbraw/zinc/97/75/98/943977598.db2.gz AFCPEJUSLFVTSR-LLVKDONJSA-N 0 0 362.332 3.620 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])NCc1nc2cc(Cl)ccc2s1 ZINC000517085142 943979442 /nfs/dbraw/zinc/97/94/42/943979442.db2.gz PEEFSYYTKNHQOU-UHFFFAOYSA-N 0 0 361.810 3.717 20 5 FHBDRN CCOCCCCNC(=O)c1cc(F)cc2c(=O)c3cccc(F)c3[nH]c12 ZINC000436067274 943987217 /nfs/dbraw/zinc/98/72/17/943987217.db2.gz QCNSVBFFBUAQTL-UHFFFAOYSA-N 0 0 374.387 3.506 20 5 FHBDRN Cc1oc(-c2ccco2)nc1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000505030993 943987513 /nfs/dbraw/zinc/98/75/13/943987513.db2.gz RBAFXKWKOHBABC-UHFFFAOYSA-N 0 0 352.306 3.792 20 5 FHBDRN COCc1ccccc1CNC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000436087473 944004171 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Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H](C)c1ncc(Br)cn1 ZINC000559863745 944023663 /nfs/dbraw/zinc/02/36/63/944023663.db2.gz LXGYNYAFXULEND-WDEREUQCSA-N 0 0 365.231 3.868 20 5 FHBDRN CC(C)(C)c1csc(NC(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)n1 ZINC000436095480 944025794 /nfs/dbraw/zinc/02/57/94/944025794.db2.gz BAGGTAKDTGJAOV-UHFFFAOYSA-N 0 0 374.426 3.547 20 5 FHBDRN CNC(=O)c1cc([N+](=O)[O-])ccc1NCCOc1ccc2ccccc2c1 ZINC000515578866 944028643 /nfs/dbraw/zinc/02/86/43/944028643.db2.gz OMFGEUYIOUCVEV-UHFFFAOYSA-N 0 0 365.389 3.599 20 5 FHBDRN O=C(NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N[C@H]1CCC[C@@H](F)C1 ZINC000517133934 944034051 /nfs/dbraw/zinc/03/40/51/944034051.db2.gz IUJALNVVUDBGBD-NEPJUHHUSA-N 0 0 363.311 3.694 20 5 FHBDRN O=C(c1ccc(NC2CC2)nc1)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000515597857 944035765 /nfs/dbraw/zinc/03/57/65/944035765.db2.gz LLYQNSVCMULJHU-INIZCTEOSA-N 0 0 366.421 3.584 20 5 FHBDRN CC(=O)c1ccc(OCC(=O)N2CCC[C@@H]2c2ccsc2)c([N+](=O)[O-])c1 ZINC000366641325 944036356 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O=C(CCOc1ccccc1[N+](=O)[O-])N1CCC[C@H](Cc2ccccc2)C1 ZINC000517313893 944201582 /nfs/dbraw/zinc/20/15/82/944201582.db2.gz VEWHXZDISNJRCA-GOSISDBHSA-N 0 0 368.433 3.845 20 5 FHBDRN Cc1ccc([C@@H]2COCCN2c2ccc([N+](=O)[O-])c(OC(F)F)c2)o1 ZINC000092667029 944206001 /nfs/dbraw/zinc/20/60/01/944206001.db2.gz HHUBTQZXFKUVKO-ZDUSSCGKSA-N 0 0 354.309 3.676 20 5 FHBDRN Cc1cc(C(=O)NCCOc2ccccc2C(F)(F)F)cc([N+](=O)[O-])c1 ZINC000517338834 944218196 /nfs/dbraw/zinc/21/81/96/944218196.db2.gz PYFTZZJLLHLNLY-UHFFFAOYSA-N 0 0 368.311 3.731 20 5 FHBDRN COc1cc(NC(=O)CCOc2cc(C)ccc2[N+](=O)[O-])c(C)c(OC)c1 ZINC000500185926 944226311 /nfs/dbraw/zinc/22/63/11/944226311.db2.gz FLMUOLIASFRGGO-UHFFFAOYSA-N 0 0 374.393 3.636 20 5 FHBDRN CCCN(C(=O)[C@@H](C)N1CCc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC001270288670 944231781 /nfs/dbraw/zinc/23/17/81/944231781.db2.gz FIZKBJIOPHBPQL-OAHLLOKOSA-N 0 0 353.422 3.789 20 5 FHBDRN CCCN(C(=O)[C@H](C)N1CCc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC001270288669 944231826 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369.396 3.656 20 5 FHBDRN COc1cccc(C(C)=CC(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)c1 ZINC000759789246 944239291 /nfs/dbraw/zinc/23/92/91/944239291.db2.gz STOCRYNUICXOJF-DHZHZOJOSA-N 0 0 352.350 3.522 20 5 FHBDRN O=C(c1cc2c(c([N+](=O)[O-])c1)OCO2)N1CCCc2cc(Cl)ccc21 ZINC000500189237 944240762 /nfs/dbraw/zinc/24/07/62/944240762.db2.gz MFQIUGRKFICFJF-UHFFFAOYSA-N 0 0 360.753 3.570 20 5 FHBDRN CC[C@@H]1C[C@H](C)CN1C(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000426253317 944241872 /nfs/dbraw/zinc/24/18/72/944241872.db2.gz AFXQNSWADAGOLN-GXFFZTMASA-N 0 0 359.348 3.944 20 5 FHBDRN CC(C)n1ncc2c1C[C@H](Nc1cc(C(F)(F)F)ncc1[N+](=O)[O-])CC2 ZINC000436377720 944246689 /nfs/dbraw/zinc/24/66/89/944246689.db2.gz OITQQGPMHHNMHN-LLVKDONJSA-N 0 0 369.347 3.755 20 5 FHBDRN O=[N+]([O-])c1cccc(Br)c1OCc1nc(C2CCCC2)no1 ZINC000120287689 944260386 /nfs/dbraw/zinc/26/03/86/944260386.db2.gz RKBRPPNMLZJINX-UHFFFAOYSA-N 0 0 368.187 3.977 20 5 FHBDRN O=C(Nc1n[nH]c(-c2ccccn2)n1)c1cc2ccccc2c2cccnc12 ZINC000439024351 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FHBDRN O=[N+]([O-])c1cccc(-c2nc(-c3nc(-c4cccnc4)no3)cs2)c1 ZINC000518324164 944285812 /nfs/dbraw/zinc/28/58/12/944285812.db2.gz QDZHHVVNLMOVBV-UHFFFAOYSA-N 0 0 351.347 3.830 20 5 FHBDRN COc1cc(CN(C)Cc2ccc(Br)o2)c([N+](=O)[O-])cc1F ZINC000184229905 944288405 /nfs/dbraw/zinc/28/84/05/944288405.db2.gz JXICNKGDLSXASZ-UHFFFAOYSA-N 0 0 373.178 3.730 20 5 FHBDRN COc1cc(CCNc2cc3nc[nH]c(=O)c3cc2[N+](=O)[O-])ccc1Cl ZINC000515874211 944291010 /nfs/dbraw/zinc/29/10/10/944291010.db2.gz MNIIGVPTYJCWCW-UHFFFAOYSA-N 0 0 374.784 3.560 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)c2ccnc(N3CC[C@H](C)C3)c2)cc1[N+](=O)[O-] ZINC000438026561 944294746 /nfs/dbraw/zinc/29/47/46/944294746.db2.gz GTGRWBYZBOYFTO-ZFWWWQNUSA-N 0 0 368.437 3.635 20 5 FHBDRN CS(=O)(=O)c1ccc(/C=C\c2nc3cc([N+](=O)[O-])ccc3s2)cc1 ZINC000515865921 944299754 /nfs/dbraw/zinc/29/97/54/944299754.db2.gz WZXUCKUAXRZXQL-WTKPLQERSA-N 0 0 360.416 3.778 20 5 FHBDRN Cc1cc(CN(C)c2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)ccc1F ZINC000436430628 944301189 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C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CCc2c1cccc2F ZINC000184043252 944322333 /nfs/dbraw/zinc/32/23/33/944322333.db2.gz YTRSLZDJYGTWRP-NSHDSACASA-N 0 0 354.341 3.908 20 5 FHBDRN O=[N+]([O-])c1cc(F)c(CN2CC[C@@H](O)[C@H]2c2ccc(Cl)cc2)c(F)c1 ZINC000425553911 944322460 /nfs/dbraw/zinc/32/24/60/944322460.db2.gz URDXPVSWSWKTQX-IAGOWNOFSA-N 0 0 368.767 3.834 20 5 FHBDRN O=C(Nc1ccc2c(c1)OCO2)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC000500242222 944324132 /nfs/dbraw/zinc/32/41/32/944324132.db2.gz NQRZURZCMTWKNG-UHFFFAOYSA-N 0 0 363.329 3.638 20 5 FHBDRN Cc1cc(OCC(=O)NCCCO[C@H](C)c2ccccc2)ccc1[N+](=O)[O-] ZINC000053541291 944329075 /nfs/dbraw/zinc/32/90/75/944329075.db2.gz FYSPUZOYLUXTSI-MRXNPFEDSA-N 0 0 372.421 3.566 20 5 FHBDRN Cc1ccc(OCC(=O)Nc2ccc(N3CCCCC3)cc2)c([N+](=O)[O-])c1 ZINC000007047410 944332806 /nfs/dbraw/zinc/33/28/06/944332806.db2.gz OFTREESHZOPMEJ-UHFFFAOYSA-N 0 0 369.421 3.911 20 5 FHBDRN COc1cc(CN2CCC(OCCC(C)C)CC2)c([N+](=O)[O-])cc1F ZINC000184246385 944335624 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3.520 20 5 FHBDRN Cc1c(CNC(=O)[C@@H](C)[C@@H]2OCCc3sccc32)cccc1[N+](=O)[O-] ZINC000506177712 944348133 /nfs/dbraw/zinc/34/81/33/944348133.db2.gz DTUXFPHCYQGBDU-SJCJKPOMSA-N 0 0 360.435 3.531 20 5 FHBDRN Cc1c(CNC(=O)[C@H](C)[C@H]2OCCc3sccc32)cccc1[N+](=O)[O-] ZINC000506177713 944348586 /nfs/dbraw/zinc/34/85/86/944348586.db2.gz DTUXFPHCYQGBDU-SJKOYZFVSA-N 0 0 360.435 3.531 20 5 FHBDRN Cc1coc(-c2ccc(C)c(NC(=O)c3cccc([N+](=O)[O-])c3N)c2)n1 ZINC000120807735 944350059 /nfs/dbraw/zinc/35/00/59/944350059.db2.gz OTPAUDQWILICFE-UHFFFAOYSA-N 0 0 352.350 3.701 20 5 FHBDRN COc1ccc2c(c1)C1(CC1)CN(c1ncnc3sc([N+](=O)[O-])cc31)C2 ZINC000515931627 944352493 /nfs/dbraw/zinc/35/24/93/944352493.db2.gz OABRMGUFPWPDAP-UHFFFAOYSA-N 0 0 368.418 3.660 20 5 FHBDRN C[NH+](C)[C@H](CNc1ccc([N+](=O)[O-])c2cccnc12)c1cccc(F)c1 ZINC000105701091 944357195 /nfs/dbraw/zinc/35/71/95/944357195.db2.gz HTGAXHZGDUASSZ-GOSISDBHSA-N 0 0 354.385 3.997 20 5 FHBDRN C/C=C\c1ccc(OC[C@@H](O)COc2cccc(C)c2[N+](=O)[O-])c(OC)c1 ZINC000550179203 944357544 /nfs/dbraw/zinc/35/75/44/944357544.db2.gz VMLUPBDOFFTLAY-DQOPKJQZSA-N 0 0 373.405 3.764 20 5 FHBDRN Cc1cccc(CN(C)C(=O)c2cc([N+](=O)[O-])ccc2SCCO)c1C ZINC000518414494 944362343 /nfs/dbraw/zinc/36/23/43/944362343.db2.gz JPVOJTWFZBDBEW-UHFFFAOYSA-N 0 0 374.462 3.568 20 5 FHBDRN CCOc1ccc([C@H](C)Nc2ccc(C(=O)NC)cc2[N+](=O)[O-])cc1OC ZINC000053559802 944368675 /nfs/dbraw/zinc/36/86/75/944368675.db2.gz VITLGXWZTOELKJ-LBPRGKRZSA-N 0 0 373.409 3.535 20 5 FHBDRN CCOC(=O)Cc1cccc(NC(=O)Nc2ccc([N+](=O)[O-])c(C)c2)c1 ZINC000473761937 944371124 /nfs/dbraw/zinc/37/11/24/944371124.db2.gz GPOVRRKYAYWTMG-UHFFFAOYSA-N 0 0 357.366 3.653 20 5 FHBDRN Cc1ccc(-c2[nH]nc(NC(=O)Nc3cc([N+](=O)[O-])c(C)cc3C)c2C)o1 ZINC000436508880 944378802 /nfs/dbraw/zinc/37/88/02/944378802.db2.gz KAWMHATWSXWYHX-UHFFFAOYSA-N 0 0 369.381 3.877 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)c1cnc(-c2ccncc2)s1 ZINC000086624477 944381286 /nfs/dbraw/zinc/38/12/86/944381286.db2.gz FJSSJGREEPCTCP-UHFFFAOYSA-N 0 0 354.391 3.982 20 5 FHBDRN CNC(=O)c1ccc(NCCCCOc2ccc(C)cc2)c([N+](=O)[O-])c1 ZINC000053572857 944386410 /nfs/dbraw/zinc/38/64/10/944386410.db2.gz JLTFAQUORXLOEJ-UHFFFAOYSA-N 0 0 357.410 3.534 20 5 FHBDRN Cc1cc(NC(=O)N[C@@H](c2ccccc2)[C@@H]2CCOC2)ccc1[N+](=O)[O-] ZINC000473769009 944386811 /nfs/dbraw/zinc/38/68/11/944386811.db2.gz ZZDYOKHEWRQFGT-QAPCUYQASA-N 0 0 355.394 3.803 20 5 FHBDRN CC1CCN(c2ccc(C(=O)NC(C3CC3)C3CC3)cc2[N+](=O)[O-])CC1 ZINC000147415267 944387700 /nfs/dbraw/zinc/38/77/00/944387700.db2.gz WDLZMICBUAMKHR-UHFFFAOYSA-N 0 0 357.454 3.750 20 5 FHBDRN Cc1cc(NC(=O)N(C)C[C@@H]2OCCc3ccccc32)ccc1[N+](=O)[O-] ZINC000473768374 944387800 /nfs/dbraw/zinc/38/78/00/944387800.db2.gz KCWHJRDMSSYXHW-SFHVURJKSA-N 0 0 355.394 3.681 20 5 FHBDRN Cc1cc(NC(=O)NCCCCCC(=O)OC(C)(C)C)ccc1[N+](=O)[O-] ZINC000473768231 944387853 /nfs/dbraw/zinc/38/78/53/944387853.db2.gz WUOALBAENTYHNX-UHFFFAOYSA-N 0 0 365.430 3.927 20 5 FHBDRN C[C@@H]1CN(c2ccccc2NC(=O)c2cc(F)cc([N+](=O)[O-])c2)C[C@@H](C)O1 ZINC000517557827 944390261 /nfs/dbraw/zinc/39/02/61/944390261.db2.gz RIMWUNSKYDKBKK-CHWSQXEVSA-N 0 0 373.384 3.600 20 5 FHBDRN COc1ccccc1[C@@]1(C)C[C@@H]1NC(=O)Nc1ccc([N+](=O)[O-])c(C)c1 ZINC000473765631 944392640 /nfs/dbraw/zinc/39/26/40/944392640.db2.gz BKCONBWWFBXPHP-PKOBYXMFSA-N 0 0 355.394 3.764 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1C[C@H](OC)Cc2ccccc21 ZINC000500279959 944396421 /nfs/dbraw/zinc/39/64/21/944396421.db2.gz LBZINSLJUGTLFS-QFBILLFUSA-N 0 0 368.433 3.768 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@](C)(O)[C@H](C)CC ZINC000506500496 944400491 /nfs/dbraw/zinc/40/04/91/944400491.db2.gz QTISGIBQAXNRHM-PXAZEXFGSA-N 0 0 354.472 3.624 20 5 FHBDRN O=C([O-])c1ccccc1CC[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000426667971 944406227 /nfs/dbraw/zinc/40/62/27/944406227.db2.gz BMEWOSRHCNJPQX-UHFFFAOYSA-N 0 0 366.373 3.885 20 5 FHBDRN C[C@H](NC(=O)CNc1ccc(F)c([N+](=O)[O-])c1)c1ccccc1Cl ZINC000025601265 944407634 /nfs/dbraw/zinc/40/76/34/944407634.db2.gz 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ZINC000439206355 944422480 /nfs/dbraw/zinc/42/24/80/944422480.db2.gz QHIRNLJQBOTECX-UHFFFAOYSA-N 0 0 358.832 3.772 20 5 FHBDRN CCN(C(=O)CN(C)c1ccccc1[N+](=O)[O-])[C@@H](C)Cc1ccsc1 ZINC000426308553 944422549 /nfs/dbraw/zinc/42/25/49/944422549.db2.gz WMRHUUIKJQFSJA-AWEZNQCLSA-N 0 0 361.467 3.572 20 5 FHBDRN COc1ccc2c(c1OC)CCN(C(=O)Nc1ccc([N+](=O)[O-])c(C)c1)C2 ZINC000473775871 944428685 /nfs/dbraw/zinc/42/86/85/944428685.db2.gz NYCHRAXEWOPLFS-UHFFFAOYSA-N 0 0 371.393 3.511 20 5 FHBDRN Cc1ccc(S(=O)(=O)N2CC[C@H](C)C[C@@H]2c2ccco2)cc1[N+](=O)[O-] ZINC000439219581 944435090 /nfs/dbraw/zinc/43/50/90/944435090.db2.gz AROBBZZRAMJAOT-BLLLJJGKSA-N 0 0 364.423 3.658 20 5 FHBDRN Cc1ccc(S(=O)(=O)N2CC[C@H](C)C[C@H]2c2ccco2)c([N+](=O)[O-])c1 ZINC000439219476 944435158 /nfs/dbraw/zinc/43/51/58/944435158.db2.gz AEKVRJDLXLAMHC-KBPBESRZSA-N 0 0 364.423 3.658 20 5 FHBDRN CO[C@H]1Cc2ccccc2N(C(=O)c2ccc(SC)c([N+](=O)[O-])c2)C1 ZINC000500294782 944437795 /nfs/dbraw/zinc/43/77/95/944437795.db2.gz AFRACBSXKDKVLK-AWEZNQCLSA-N 0 0 358.419 3.535 20 5 FHBDRN CCCc1n[nH]c(C(=O)N(C)Cc2cc(Cl)cc(Cl)c2)c1[N+](=O)[O-] ZINC000517621368 944449296 /nfs/dbraw/zinc/44/92/96/944449296.db2.gz NITCPNWPCWTHNK-UHFFFAOYSA-N 0 0 371.224 3.849 20 5 FHBDRN CCCc1n[nH]c(C(=O)NCC2CCC(c3ccccc3)CC2)c1[N+](=O)[O-] ZINC000517621808 944450242 /nfs/dbraw/zinc/45/02/42/944450242.db2.gz ZWBZFBNMMVKFQM-UHFFFAOYSA-N 0 0 370.453 3.974 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CC[C@@H](C)C[C@@H]1c1ccco1 ZINC000439233536 944460540 /nfs/dbraw/zinc/46/05/40/944460540.db2.gz ZFZPQGMUWLVPRC-IUODEOHRSA-N 0 0 364.423 3.658 20 5 FHBDRN CN(CCOC(=O)/C=C\SCc1ccco1)c1ccc([N+](=O)[O-])cc1 ZINC000759828630 944461431 /nfs/dbraw/zinc/46/14/31/944461431.db2.gz PJSHMTLUCQNPQX-WQLSENKSSA-N 0 0 362.407 3.614 20 5 FHBDRN CC(C)c1cccc(NC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])o2)c1 ZINC000517654364 944468664 /nfs/dbraw/zinc/46/86/64/944468664.db2.gz OHBDZZAOCHDDEI-OAHLLOKOSA-N 0 0 371.393 3.555 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1CC[C@@H](C)C[C@@H]1c1ccco1 ZINC000439238979 944468911 /nfs/dbraw/zinc/46/89/11/944468911.db2.gz QKNYWKGPNVNIIE-IUODEOHRSA-N 0 0 364.423 3.658 20 5 FHBDRN Cc1cc(C(=O)NCCNc2ccc([N+](=O)[O-])cc2)c2nccc(C)c2c1 ZINC000550219867 944469047 /nfs/dbraw/zinc/46/90/47/944469047.db2.gz AZTTXZCAMKWTBG-UHFFFAOYSA-N 0 0 364.405 3.602 20 5 FHBDRN CCOc1ccc(-c2csc(NC(=O)c3ccc([N+](=O)[O-])n3C)n2)cc1 ZINC000500309661 944475192 /nfs/dbraw/zinc/47/51/92/944475192.db2.gz UDVRELXOIIWBFI-UHFFFAOYSA-N 0 0 372.406 3.708 20 5 FHBDRN CC(C)[C@H]1CCC[C@@H](NS(=O)(=O)Cc2ccccc2[N+](=O)[O-])CC1 ZINC000469387744 944475549 /nfs/dbraw/zinc/47/55/49/944475549.db2.gz DAAFLJXBCIUJTQ-GOEBONIOSA-N 0 0 354.472 3.619 20 5 FHBDRN Cc1ccccc1-c1nnc(SCCOc2cccc([N+](=O)[O-])c2)n1C ZINC000046875851 944477109 /nfs/dbraw/zinc/47/71/09/944477109.db2.gz KQFZNKAABOTLNX-UHFFFAOYSA-N 0 0 370.434 3.870 20 5 FHBDRN CC(C)c1ccc(CCNC(=O)COc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000046877857 944477397 /nfs/dbraw/zinc/47/73/97/944477397.db2.gz KTCMSJGLCLMFEJ-UHFFFAOYSA-N 0 0 360.385 3.595 20 5 FHBDRN Cc1ccc2c(c1)N(C(=O)c1cnn(-c3ccc([N+](=O)[O-])cc3)c1)CCC2 ZINC000110393846 944478061 /nfs/dbraw/zinc/47/80/61/944478061.db2.gz CAFDGOTXKAPNQK-UHFFFAOYSA-N 0 0 362.389 3.682 20 5 FHBDRN Cc1csc([C@@H](C)NC(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)n1 ZINC000550216654 944481024 /nfs/dbraw/zinc/48/10/24/944481024.db2.gz BOPLFGGHYAGDSY-MRVPVSSYSA-N 0 0 359.329 3.870 20 5 FHBDRN CCOC(=O)[C@H](Cc1ccccc1)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000438315811 944482099 /nfs/dbraw/zinc/48/20/99/944482099.db2.gz TZBSNMQVCZFDOT-YJBOKZPZSA-N 0 0 356.422 3.728 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]([C@@H]2CCCO2)C1 ZINC000894709093 944482926 /nfs/dbraw/zinc/48/29/26/944482926.db2.gz ADIHLSJUUHMDPK-BBRMVZONSA-N 0 0 364.467 3.736 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)N[C@H](C)c2ccc3n[nH]cc3c2)cc1[N+](=O)[O-] ZINC000516103572 944484988 /nfs/dbraw/zinc/48/49/88/944484988.db2.gz UGQDLGUQIMNHTE-CHWSQXEVSA-N 0 0 367.409 3.901 20 5 FHBDRN C[C@H](CCn1cc(Br)c([N+](=O)[O-])n1)OCc1ccccc1 ZINC000473787630 944485178 /nfs/dbraw/zinc/48/51/78/944485178.db2.gz NQNJDVXBRZTFPQ-LLVKDONJSA-N 0 0 354.204 3.549 20 5 FHBDRN O=C(N[C@H]1CCCc2c(O)cccc21)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000190259050 944494829 /nfs/dbraw/zinc/49/48/29/944494829.db2.gz UXEIFJLVUGSYJB-INIZCTEOSA-N 0 0 363.373 3.656 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1C(=O)NCCCc1c[nH]c2ccc(F)cc12 ZINC000506207627 944500846 /nfs/dbraw/zinc/50/08/46/944500846.db2.gz MFXQUXVTFPAHIQ-UHFFFAOYSA-N 0 0 355.369 3.886 20 5 FHBDRN O=C(N[C@H]1C[C@H](c2ccc(C(F)(F)F)cc2)C1)c1ccc([N+](=O)[O-])cn1 ZINC000566657463 944503468 /nfs/dbraw/zinc/50/34/68/944503468.db2.gz VQOQUZRUONOJHZ-AULYBMBSSA-N 0 0 365.311 3.685 20 5 FHBDRN COC(=O)c1cccc(C(=O)COc2cc(C)c([N+](=O)[O-])cc2Cl)c1 ZINC000506536728 944509229 /nfs/dbraw/zinc/50/92/29/944509229.db2.gz AEJBOFXUNMLNTG-UHFFFAOYSA-N 0 0 363.753 3.605 20 5 FHBDRN CCc1nc([C@@H](C)NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)cs1 ZINC000110506384 944514598 /nfs/dbraw/zinc/51/45/98/944514598.db2.gz KSZSZNWJXMQILB-GFCCVEGCSA-N 0 0 374.466 3.705 20 5 FHBDRN C[C@H]1CO[C@H](c2ccccc2Cl)CN1C(=O)c1ccccc1[N+](=O)[O-] ZINC000110514954 944521529 /nfs/dbraw/zinc/52/15/29/944521529.db2.gz YOFAOPUSTSVLJQ-SJCJKPOMSA-N 0 0 360.797 3.850 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N[C@H]1CCC[C@@H]1c1ccccc1 ZINC000517704134 944526759 /nfs/dbraw/zinc/52/67/59/944526759.db2.gz ZKNUDLOAWLIUEM-SJORKVTESA-N 0 0 360.435 3.518 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N[C@@H]1CCC[C@@H]1c1ccccc1 ZINC000517704131 944526891 /nfs/dbraw/zinc/52/68/91/944526891.db2.gz ZKNUDLOAWLIUEM-IAGOWNOFSA-N 0 0 360.435 3.518 20 5 FHBDRN C[C@H]1CO[C@@H](c2ccccc2Cl)CN1C(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000110515023 944528017 /nfs/dbraw/zinc/52/80/17/944528017.db2.gz NOTKESXSSYKFLF-SCLBCKFNSA-N 0 0 374.824 3.779 20 5 FHBDRN Cc1ccc2[nH]c(CNc3cc(C(F)(F)F)ncc3[N+](=O)[O-])nc2c1 ZINC000436390240 944532421 /nfs/dbraw/zinc/53/24/21/944532421.db2.gz PYKCYUGQLXAUGA-UHFFFAOYSA-N 0 0 351.288 3.805 20 5 FHBDRN CCN(CC)C(=O)c1ccc(OCc2ccc([N+](=O)[O-])cc2OC)cc1 ZINC000429801120 944540212 /nfs/dbraw/zinc/54/02/12/944540212.db2.gz KZEMNISIKGYMNE-UHFFFAOYSA-N 0 0 358.394 3.664 20 5 FHBDRN Cc1cccc2nc(CNC(=O)c3ccc(C(C)C)c([N+](=O)[O-])c3)n(C)c21 ZINC000439331079 944542597 /nfs/dbraw/zinc/54/25/97/944542597.db2.gz NLKOLIDWTBWATL-UHFFFAOYSA-N 0 0 366.421 3.843 20 5 FHBDRN Cn1ccnc1[C@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1cccc(F)c1 ZINC000017590704 944543780 /nfs/dbraw/zinc/54/37/80/944543780.db2.gz BDAFVAVDDZUHDB-MRXNPFEDSA-N 0 0 371.328 3.577 20 5 FHBDRN O=C(NC[C@@H]1COc2ccccc21)c1c([N+](=O)[O-])cccc1C(F)(F)F ZINC000518613848 944546150 /nfs/dbraw/zinc/54/61/50/944546150.db2.gz HIWSWVHGDZWUIY-SNVBAGLBSA-N 0 0 366.295 3.520 20 5 FHBDRN CSCc1cccc(CNC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)c1 ZINC000438382625 944549050 /nfs/dbraw/zinc/54/90/50/944549050.db2.gz XALCSGWAJPTJLT-UHFFFAOYSA-N 0 0 355.419 3.869 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CCCCNC(=O)OC(C)(C)C ZINC000781929559 944549294 /nfs/dbraw/zinc/54/92/94/944549294.db2.gz SCYCQPZYQQLOIZ-UHFFFAOYSA-N 0 0 351.403 3.537 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)N1CCC[C@H]1CCc1ccccc1 ZINC000516164835 944551329 /nfs/dbraw/zinc/55/13/29/944551329.db2.gz AKJLJUKOTXYJMF-IBGZPJMESA-N 0 0 367.449 3.944 20 5 FHBDRN C[C@H](c1nc2ccccc2s1)N(C)C(=O)COc1ccccc1[N+](=O)[O-] ZINC000015094167 944552835 /nfs/dbraw/zinc/55/28/35/944552835.db2.gz RQMYYXPTNYASJI-GFCCVEGCSA-N 0 0 371.418 3.803 20 5 FHBDRN CC(C)OC(=O)C[C@@H](NC(=O)CC(C)(C)C)c1ccccc1[N+](=O)[O-] ZINC000053659719 944556339 /nfs/dbraw/zinc/55/63/39/944556339.db2.gz KIQYVDXHFVOLEI-CQSZACIVSA-N 0 0 350.415 3.530 20 5 FHBDRN Cc1ccc(NC(=O)COc2c(Cl)cncc2[N+](=O)[O-])cc1Cl ZINC000506556452 944563276 /nfs/dbraw/zinc/56/32/76/944563276.db2.gz SJJLZJHIGUCKPR-UHFFFAOYSA-N 0 0 356.165 3.623 20 5 FHBDRN O=C(NCc1ccc(F)c(F)c1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000425997020 944563332 /nfs/dbraw/zinc/56/33/32/944563332.db2.gz VTRKQMASRLUFGJ-UHFFFAOYSA-N 0 0 361.348 3.747 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CNc1cccc(Br)c1 ZINC000015288448 944564530 /nfs/dbraw/zinc/56/45/30/944564530.db2.gz CVOAWAQAZGWGEZ-UHFFFAOYSA-N 0 0 364.199 3.716 20 5 FHBDRN CN(C)C(=O)Sc1ccc(CN2CCc3c2cccc3[N+](=O)[O-])cc1 ZINC000759848946 944564807 /nfs/dbraw/zinc/56/48/07/944564807.db2.gz LWTHQQLHRJDPAP-UHFFFAOYSA-N 0 0 357.435 3.931 20 5 FHBDRN COc1cc(F)c(CN(Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1OC ZINC000517748317 944575218 /nfs/dbraw/zinc/57/52/18/944575218.db2.gz HCEYDHQJJXTREG-UHFFFAOYSA-N 0 0 360.385 3.916 20 5 FHBDRN CO[C@@H]1C[C@H](c2ccccc2)CC[C@@H]1NC(=O)Cc1ccccc1[N+](=O)[O-] ZINC000517767005 944586960 /nfs/dbraw/zinc/58/69/60/944586960.db2.gz QIIHCWYRNUGUSP-IMFGXOCKSA-N 0 0 368.433 3.605 20 5 FHBDRN O=C(COc1cc(F)ccc1Br)c1ccc([N+](=O)[O-])cc1 ZINC000149668678 944601289 /nfs/dbraw/zinc/60/12/89/944601289.db2.gz VCEBKHRJUHUNJX-UHFFFAOYSA-N 0 0 354.131 3.758 20 5 FHBDRN Cc1ccc(S(=O)(=O)N(C)[C@H](C)c2c(F)cccc2F)cc1[N+](=O)[O-] ZINC000518691038 944608901 /nfs/dbraw/zinc/60/89/01/944608901.db2.gz ZFQUXBYTQJUQIH-LLVKDONJSA-N 0 0 370.377 3.563 20 5 FHBDRN O=C(Nc1ccc2c3c(cccc31)CC2)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000516240925 944609721 /nfs/dbraw/zinc/60/97/21/944609721.db2.gz HDJOKOUZTNGSFU-UHFFFAOYSA-N 0 0 362.341 3.828 20 5 FHBDRN O=C(c1cc(NC[C@@H]2CCc3ccccc32)ccc1[N+](=O)[O-])N1CCCC1 ZINC000110595755 944617292 /nfs/dbraw/zinc/61/72/92/944617292.db2.gz PAJBFJMGKUZPJJ-INIZCTEOSA-N 0 0 365.433 3.973 20 5 FHBDRN O=C(c1ccccc1)c1ccc(N[C@@H](CCO)c2ccco2)c([N+](=O)[O-])c1 ZINC000184346578 944625255 /nfs/dbraw/zinc/62/52/55/944625255.db2.gz HUALEZADUTXBFE-KRWDZBQOSA-N 0 0 366.373 3.954 20 5 FHBDRN Cn1c(C(=O)N2CCCc3c2cccc3C(F)(F)F)ccc1[N+](=O)[O-] ZINC000425629821 944626008 /nfs/dbraw/zinc/62/60/08/944626008.db2.gz FLDGOSSJBCMSFU-UHFFFAOYSA-N 0 0 353.300 3.545 20 5 FHBDRN C[C@@H]1Oc2cc(F)ccc2[C@@H]1NC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000566698749 944632530 /nfs/dbraw/zinc/63/25/30/944632530.db2.gz OCBRPCCLJIISMW-APPDUMDISA-N 0 0 358.369 3.650 20 5 FHBDRN Cc1cc(NC(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)c(Cl)cc1F ZINC000566702354 944640730 /nfs/dbraw/zinc/64/07/30/944640730.db2.gz CIBRCSJESDBKPA-UHFFFAOYSA-N 0 0 366.732 3.719 20 5 FHBDRN Cc1cc(C(=O)NCCc2cccc([N+](=O)[O-])c2)cc(C)c1OC(F)F ZINC000759870912 944644662 /nfs/dbraw/zinc/64/46/62/944644662.db2.gz QMZGQTYVUBNLHI-UHFFFAOYSA-N 0 0 364.348 3.786 20 5 FHBDRN O=C(/C=C\c1nc2ccccc2s1)NCCc1cccc([N+](=O)[O-])c1 ZINC000759869420 944647343 /nfs/dbraw/zinc/64/73/43/944647343.db2.gz FELVRBJXLUNJCY-HJWRWDBZSA-N 0 0 353.403 3.577 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H](C)Oc1ccc(F)cc1 ZINC000566708587 944659777 /nfs/dbraw/zinc/65/97/77/944659777.db2.gz VGFXAYYRCPSJKC-LBPRGKRZSA-N 0 0 361.373 3.885 20 5 FHBDRN O=C(Nc1nc(-c2ccc[nH]2)cs1)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000518716108 944663037 /nfs/dbraw/zinc/66/30/37/944663037.db2.gz YCYGDBSGAJYGHM-UHFFFAOYSA-N 0 0 353.363 3.780 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1C(F)(F)F)Nc1cccc(F)c1 ZINC000516271002 944665286 /nfs/dbraw/zinc/66/52/86/944665286.db2.gz MWUJUXNBMNGQCH-UHFFFAOYSA-N 0 0 358.247 3.770 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2ccc(CN3CCN(CC(F)(F)F)CC3)o2)c1 ZINC000506247683 944666275 /nfs/dbraw/zinc/66/62/75/944666275.db2.gz LJYRAERJMQFWIO-UHFFFAOYSA-N 0 0 369.343 3.535 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000438474285 944675263 /nfs/dbraw/zinc/67/52/63/944675263.db2.gz UYUFMCJFJFAZNU-WDEREUQCSA-N 0 0 360.332 3.702 20 5 FHBDRN Cc1c(C(=O)N(C)c2ccc([N+](=O)[O-])cc2)cnn1-c1ccccc1F ZINC000073524046 944681671 /nfs/dbraw/zinc/68/16/71/944681671.db2.gz YCBORUMWYPWMFE-UHFFFAOYSA-N 0 0 354.341 3.505 20 5 FHBDRN CC(C)c1ccc(CN2CCN(c3ccccc3O)CC2)cc1[N+](=O)[O-] ZINC000505886497 944683681 /nfs/dbraw/zinc/68/36/81/944683681.db2.gz GOTPRMCGUUSGTH-UHFFFAOYSA-N 0 0 355.438 3.746 20 5 FHBDRN Cc1sc(-c2ccco2)nc1-c1nc(-c2ccc(N)c([N+](=O)[O-])c2)no1 ZINC000545550420 944684823 /nfs/dbraw/zinc/68/48/23/944684823.db2.gz NNTMNEGKRFDUBF-UHFFFAOYSA-N 0 0 369.362 3.919 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C[NH2+]C[C@@H](CC(=O)[O-])c1ccc(Cl)cc1 ZINC000426702015 944701915 /nfs/dbraw/zinc/70/19/15/944701915.db2.gz CQTZCULYGKXUSW-OAHLLOKOSA-N 0 0 362.813 3.905 20 5 FHBDRN O=C(Nc1cccc(NC(=O)c2ccncc2)c1)c1csc([N+](=O)[O-])c1 ZINC000044491608 944709204 /nfs/dbraw/zinc/70/92/04/944709204.db2.gz QEHQPCKRADPOLF-UHFFFAOYSA-N 0 0 368.374 3.556 20 5 FHBDRN COc1ccc2c(c1)CCC[C@@H]2N(C)C(=O)c1ccc(OC)c([N+](=O)[O-])c1 ZINC000516308561 944709934 /nfs/dbraw/zinc/70/99/34/944709934.db2.gz SZJMNIXMBZYLPV-KRWDZBQOSA-N 0 0 370.405 3.762 20 5 FHBDRN COc1cc(Br)c(/C=C/c2ccc([N+](=O)[O-])cn2)cc1O ZINC000439525813 944710304 /nfs/dbraw/zinc/71/03/04/944710304.db2.gz NJJPNLLMJVPOIL-NSCUHMNNSA-N 0 0 351.156 3.637 20 5 FHBDRN CC(C)[C@@H]([NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1)C(=O)[O-] ZINC000426691245 944711275 /nfs/dbraw/zinc/71/12/75/944711275.db2.gz GQWDQCKOVSXIPN-GOSISDBHSA-N 0 0 357.410 3.562 20 5 FHBDRN COC(=O)c1cc2c(o1)c(OC)ccc2/C=C\c1ccc([N+](=O)[O-])cn1 ZINC000439527091 944712242 /nfs/dbraw/zinc/71/22/42/944712242.db2.gz OTXLUDVUWBNCAQ-HYXAFXHYSA-N 0 0 354.318 3.702 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCN(Cc2ccccc2)C(C)(C)C1 ZINC000517836304 944717048 /nfs/dbraw/zinc/71/70/48/944717048.db2.gz IOJYVZZRXPNNPA-UHFFFAOYSA-N 0 0 367.449 3.640 20 5 FHBDRN O=C([O-])C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)C12CC3CC(CC(C3)C1)C2 ZINC000426722998 944723566 /nfs/dbraw/zinc/72/35/66/944723566.db2.gz JWYGSGBUFVAXQL-LMFLDHGRSA-N 0 0 358.438 3.744 20 5 FHBDRN COc1ccccc1[C@@H]1CC[C@@H](C)CN1C(=O)c1ccc([N+](=O)[O-])cc1[O-] ZINC000436860962 944725557 /nfs/dbraw/zinc/72/55/57/944725557.db2.gz RMUDMKKZGMSBFC-DYVFJYSZSA-N 0 0 370.405 3.922 20 5 FHBDRN Cc1ccc(NC(=O)N(C)C)cc1NC(=O)c1cccc(C)c1[N+](=O)[O-] ZINC000437916253 944726397 /nfs/dbraw/zinc/72/63/97/944726397.db2.gz CZODJGJUMANOGS-UHFFFAOYSA-N 0 0 356.382 3.557 20 5 FHBDRN COCCCOc1ccccc1NC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000054170858 944733004 /nfs/dbraw/zinc/73/30/04/944733004.db2.gz DZIBNPUQECOUFQ-UHFFFAOYSA-N 0 0 369.377 3.744 20 5 FHBDRN C[C@]1(C(=O)[O-])CCCC[C@H]1[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000426729003 944736446 /nfs/dbraw/zinc/73/64/46/944736446.db2.gz ZDKNPURPEBKPFZ-MJGOQNOKSA-N 0 0 358.394 3.978 20 5 FHBDRN O=C(c1n[nH]c2ccc([N+](=O)[O-])cc21)N(CC(F)F)c1ccc(F)cc1 ZINC000436875754 944744255 /nfs/dbraw/zinc/74/42/55/944744255.db2.gz YVSZZDMXIJSMSZ-UHFFFAOYSA-N 0 0 364.283 3.522 20 5 FHBDRN CC[C@@H]1CCC[C@@H](C[NH2+][C@H](Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C(=O)[O-])C1 ZINC000426739410 944752472 /nfs/dbraw/zinc/75/24/72/944752472.db2.gz CBXMPGWDXSOLRM-PJIJBLCYSA-N 0 0 373.453 3.878 20 5 FHBDRN CC[C@@H](C)[C@H](NC(=O)Cc1ccccc1[N+](=O)[O-])c1nc2ccccc2[nH]1 ZINC000047174018 944757555 /nfs/dbraw/zinc/75/75/55/944757555.db2.gz LQUGESLYSSEOLD-YJYMSZOUSA-N 0 0 366.421 3.917 20 5 FHBDRN Cc1ccccc1OCCCN(C)C(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000517866548 944764027 /nfs/dbraw/zinc/76/40/27/944764027.db2.gz VIZRNTHLDXBAGQ-UHFFFAOYSA-N 0 0 372.421 3.600 20 5 FHBDRN COc1ccc(CC(=O)N[C@](C)(Cc2ccccc2)C2CC2)cc1[N+](=O)[O-] ZINC000519584338 944771484 /nfs/dbraw/zinc/77/14/84/944771484.db2.gz MQUZSDYDAMSMQF-OAQYLSRUSA-N 0 0 368.433 3.674 20 5 FHBDRN Cc1nc(CC(C)C)c(NC(=O)NCCc2ccc([N+](=O)[O-])cc2)s1 ZINC000473849718 944771553 /nfs/dbraw/zinc/77/15/53/944771553.db2.gz LURRXZNSOWHJGB-UHFFFAOYSA-N 0 0 362.455 3.922 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(OCCOc2ccc3ccccc3c2)c1 ZINC000506934981 944776885 /nfs/dbraw/zinc/77/68/85/944776885.db2.gz UWHDLVPDKSLZPX-UHFFFAOYSA-N 0 0 367.357 3.992 20 5 FHBDRN CC(C)c1ccc(C[NH2+][C@@H](CCc2ccccc2)C(=O)[O-])cc1[N+](=O)[O-] ZINC000426773742 944791189 /nfs/dbraw/zinc/79/11/89/944791189.db2.gz LIEHQTHADYTQTB-SFHVURJKSA-N 0 0 356.422 3.894 20 5 FHBDRN CC(C)(C(=O)N1CC[C@@](F)(c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000518798666 944792861 /nfs/dbraw/zinc/79/28/61/944792861.db2.gz NMCNQIGZNUSFHH-FQEVSTJZSA-N 0 0 356.397 3.970 20 5 FHBDRN Cc1cc(Oc2ccc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)cc2)n[nH]1 ZINC000426779934 944797376 /nfs/dbraw/zinc/79/73/76/944797376.db2.gz MPPQQXORQPDJAT-UHFFFAOYSA-N 0 0 356.313 3.810 20 5 FHBDRN COc1cccc(C[C@H]([NH2+]Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C(=O)[O-])c1 ZINC000426805861 944806709 /nfs/dbraw/zinc/80/67/09/944806709.db2.gz GMOCADIIZVQGLP-SFHVURJKSA-N 0 0 372.421 3.512 20 5 FHBDRN C[C@@H](CCc1ccc(Br)cc1)Nc1c([N+](=O)[O-])ncn1C ZINC000506965450 944811799 /nfs/dbraw/zinc/81/17/99/944811799.db2.gz WFIYLHAMDUBMTA-JTQLQIEISA-N 0 0 353.220 3.524 20 5 FHBDRN Cc1ccc(NC(=O)N(C)C)cc1NC(=O)c1c(C)cccc1[N+](=O)[O-] ZINC000437926823 944814201 /nfs/dbraw/zinc/81/42/01/944814201.db2.gz LPJAFKBPFURNJW-UHFFFAOYSA-N 0 0 356.382 3.557 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1OC(=O)COc1ccc(C(F)(F)F)cc1 ZINC000760021799 944817307 /nfs/dbraw/zinc/81/73/07/944817307.db2.gz DRCFBFWWCYEDHU-UHFFFAOYSA-N 0 0 355.268 3.906 20 5 FHBDRN CC(C)c1ccc(CCC(=O)NCCOc2ccc([N+](=O)[O-])cc2)cc1 ZINC000518829681 944818444 /nfs/dbraw/zinc/81/84/44/944818444.db2.gz VCGYAYZOLQFRBY-UHFFFAOYSA-N 0 0 356.422 3.846 20 5 FHBDRN CC(C)[C@H](CC(F)(F)F)NC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000438595205 944820257 /nfs/dbraw/zinc/82/02/57/944820257.db2.gz AFRXBCLQCGOJSX-ZDUSSCGKSA-N 0 0 357.332 3.643 20 5 FHBDRN O=C([O-])[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1cc(Cl)ccc1Cl ZINC000426798844 944821034 /nfs/dbraw/zinc/82/10/34/944821034.db2.gz GMFGLMZSLYQDLC-HNNXBMFYSA-N 0 0 369.204 3.687 20 5 FHBDRN COc1cc(-c2nc(-c3ccc(N(C)C)cc3)no2)cc([N+](=O)[O-])c1C ZINC000518831160 944821664 /nfs/dbraw/zinc/82/16/64/944821664.db2.gz GGWQIHAFJLKLSE-UHFFFAOYSA-N 0 0 354.366 3.695 20 5 FHBDRN COc1cc(NC(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)cc(OC)c1C ZINC000516403305 944822455 /nfs/dbraw/zinc/82/24/55/944822455.db2.gz ZWUYBEPCTRCFKC-UHFFFAOYSA-N 0 0 371.393 3.511 20 5 FHBDRN CCOc1ccc(C(=O)N[C@H](C2CCCC2)C(F)(F)F)cc1[N+](=O)[O-] ZINC000437927167 944826163 /nfs/dbraw/zinc/82/61/63/944826163.db2.gz DEVKUJWTOODUKS-CQSZACIVSA-N 0 0 360.332 3.844 20 5 FHBDRN C[C@H](c1ccccc1)n1cnnc1SCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000518822844 944828250 /nfs/dbraw/zinc/82/82/50/944828250.db2.gz PBYZXSLARSEFCB-CYBMUJFWSA-N 0 0 368.418 3.771 20 5 FHBDRN O=[N+]([O-])c1cc(C(F)(F)F)c(Cl)cc1Sc1nnnn1C1CC1 ZINC000015141820 944829834 /nfs/dbraw/zinc/82/98/34/944829834.db2.gz ZKKKWLKWFGFWEG-UHFFFAOYSA-N 0 0 365.724 3.740 20 5 FHBDRN C[C@H]1CCCC[N@@H+]1Cc1ccc(NC(=O)c2ccc([O-])c([N+](=O)[O-])c2)cc1 ZINC000436963548 944841895 /nfs/dbraw/zinc/84/18/95/944841895.db2.gz ZSDQRODGLJBZAN-AWEZNQCLSA-N 0 0 369.421 3.927 20 5 FHBDRN O=[N+]([O-])c1ccc(N[C@@H]2CCOc3ccc(Br)cc32)cn1 ZINC000506994810 944845413 /nfs/dbraw/zinc/84/54/13/944845413.db2.gz LPTMMWXDFAPFMD-GFCCVEGCSA-N 0 0 350.172 3.688 20 5 FHBDRN O=C(Nc1ccc(C[NH+]2CCCCCC2)cc1)c1ccc([O-])c([N+](=O)[O-])c1 ZINC000436955829 944852233 /nfs/dbraw/zinc/85/22/33/944852233.db2.gz IXNRUJXTFCVSHQ-UHFFFAOYSA-N 0 0 369.421 3.929 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)N(Cc1ccccc1)C[C@@H]1CCCO1 ZINC000053748792 944853317 /nfs/dbraw/zinc/85/33/17/944853317.db2.gz YPICDSMOOUYYGF-SFHVURJKSA-N 0 0 355.394 3.808 20 5 FHBDRN CCOc1ccc(C(=O)N[C@H]2CCOc3c(CC)cccc32)cc1[N+](=O)[O-] ZINC000507012216 944860467 /nfs/dbraw/zinc/86/04/67/944860467.db2.gz BQXWRSOOXZSGIT-INIZCTEOSA-N 0 0 370.405 3.810 20 5 FHBDRN CCOc1ccc(NC(=O)c2ccc([N+](=O)[O-])n2C)c(C(F)(F)F)c1 ZINC000518852423 944865183 /nfs/dbraw/zinc/86/51/83/944865183.db2.gz JHXRFUZYKYAVLU-UHFFFAOYSA-N 0 0 357.288 3.603 20 5 FHBDRN COc1cc(OCC(=O)O[C@@H](C)c2ccc(F)c(F)c2)ccc1[N+](=O)[O-] ZINC000123986768 944865279 /nfs/dbraw/zinc/86/52/79/944865279.db2.gz IPAQFUWQQSUYHY-JTQLQIEISA-N 0 0 367.304 3.565 20 5 FHBDRN Cc1ccc(OCCCNc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])cc1 ZINC000507016250 944865432 /nfs/dbraw/zinc/86/54/32/944865432.db2.gz WXWMJZKAGLRABF-UHFFFAOYSA-N 0 0 369.421 3.676 20 5 FHBDRN O=[N+]([O-])c1ccc([C@H](O)CN2CCc3c2cccc3C(F)(F)F)cc1 ZINC000759912358 944870347 /nfs/dbraw/zinc/87/03/47/944870347.db2.gz UGGBROVHRVPHGK-MRXNPFEDSA-N 0 0 352.312 3.710 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N1Cc2ccccc2OC(C)(C)C1 ZINC000426470314 944904018 /nfs/dbraw/zinc/90/40/18/944904018.db2.gz TUPKQSAYGKIETJ-UHFFFAOYSA-N 0 0 370.405 3.807 20 5 FHBDRN Cc1cc(NCCC[N@@H+](C)Cc2ccccc2)cc(C(=O)[O-])c1[N+](=O)[O-] ZINC000516473102 944905878 /nfs/dbraw/zinc/90/58/78/944905878.db2.gz NJUOHIQXUREGPT-UHFFFAOYSA-N 0 0 357.410 3.535 20 5 FHBDRN CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F)c1ccc2cc[nH]c2c1 ZINC000473576804 944924133 /nfs/dbraw/zinc/92/41/33/944924133.db2.gz WSPBDVNPQGYZRJ-UHFFFAOYSA-N 0 0 361.304 3.954 20 5 FHBDRN CC(=O)c1cc(N2CCC[C@@H](C(=O)Nc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000516486113 944931257 /nfs/dbraw/zinc/93/12/57/944931257.db2.gz BIFRXMNNHIRLAF-OAHLLOKOSA-N 0 0 367.405 3.653 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H](CC)O[C@@H](C)C1 ZINC000506329308 944932510 /nfs/dbraw/zinc/93/25/10/944932510.db2.gz FLBLCRXMAAABNK-GXTWGEPZSA-N 0 0 352.456 3.736 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](CC)C[C@@H](C)CO ZINC000507095621 944933131 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O=C(Cc1ccc([N+](=O)[O-])cc1F)NCCc1cc2ccccc2s1 ZINC000506681915 944977826 /nfs/dbraw/zinc/97/78/26/944977826.db2.gz LYWQFMPCNODUIF-UHFFFAOYSA-N 0 0 358.394 3.850 20 5 FHBDRN C[C@@H]1CN(c2c(Cl)cc(Cl)cc2[N+](=O)[O-])CC2(CCOCC2)O1 ZINC000408104119 944979237 /nfs/dbraw/zinc/97/92/37/944979237.db2.gz CSFXURIEOYWTGN-SNVBAGLBSA-N 0 0 361.225 3.676 20 5 FHBDRN CC1=CCCN(C(=O)c2ccc(N3C[C@@H](C)C[C@H](C)C3)c([N+](=O)[O-])c2)C1 ZINC000437959297 944981101 /nfs/dbraw/zinc/98/11/01/944981101.db2.gz GVKFSVJBUJBOAV-HOTGVXAUSA-N 0 0 357.454 3.869 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)Nc1cccc(N2CCCC2)c1 ZINC000506340168 944987765 /nfs/dbraw/zinc/98/77/65/944987765.db2.gz GJGFYFJXTYXSMF-UHFFFAOYSA-N 0 0 370.409 3.525 20 5 FHBDRN O=[N+]([O-])c1ccc2ccnc(N3CCC[C@@H](OCC(F)(F)F)C3)c2c1 ZINC000516549522 944995559 /nfs/dbraw/zinc/99/55/59/944995559.db2.gz MSOGNCKDJOYNBS-CYBMUJFWSA-N 0 0 355.316 3.691 20 5 FHBDRN C[C@@H](NC(=O)NCc1ccc([N+](=O)[O-])cc1)c1ccccc1OC(F)F ZINC000516552243 944999812 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373.840 3.990 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)N1CCC[C@]2(CC=CCC2)C1 ZINC000511761140 945032124 /nfs/dbraw/zinc/03/21/24/945032124.db2.gz WBISQSOBKQSIRP-HXUWFJFHSA-N 0 0 353.422 3.898 20 5 FHBDRN C[C@H](NC(=O)C(=O)Nc1ccc(C2CCC2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000427036955 945034505 /nfs/dbraw/zinc/03/45/05/945034505.db2.gz SRNAZAPXOVDCJR-ZDUSSCGKSA-N 0 0 367.405 3.678 20 5 FHBDRN C[C@H]1CN(C(=O)c2ccc(Sc3ccc([N+](=O)[O-])cc3)cc2)CCC1=O ZINC000506362281 945040024 /nfs/dbraw/zinc/04/00/24/945040024.db2.gz HVHKCOCBSKJHBF-ZDUSSCGKSA-N 0 0 370.430 3.797 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)NCc1nc(C2CC2)cs1 ZINC000439868970 945041635 /nfs/dbraw/zinc/04/16/35/945041635.db2.gz ZNKKITUIQNAHSH-UHFFFAOYSA-N 0 0 362.411 3.649 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)NCCc1cc(F)cc(F)c1 ZINC000439867749 945041828 /nfs/dbraw/zinc/04/18/28/945041828.db2.gz UPBVZSHLWXGWEH-UHFFFAOYSA-N 0 0 365.336 3.636 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)NCc1nc2ccccc2s1 ZINC000439875147 945048199 /nfs/dbraw/zinc/04/81/99/945048199.db2.gz YUTYKCXKQAYSHV-UHFFFAOYSA-N 0 0 372.406 3.925 20 5 FHBDRN Cc1cccc(O[C@H](C)C(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000437123996 945053693 /nfs/dbraw/zinc/05/36/93/945053693.db2.gz NEYVXDZKFYGVIF-OAHLLOKOSA-N 0 0 354.406 3.862 20 5 FHBDRN CCc1c(NC(=O)CCNc2ccccc2[N+](=O)[O-])cnn1CCC(C)C ZINC000427431168 945371242 /nfs/dbraw/zinc/37/12/42/945371242.db2.gz HAOBLYLRIZYSCB-UHFFFAOYSA-N 0 0 373.457 3.841 20 5 FHBDRN CCOc1cc(CNc2cc(COC)cc(C(=O)OC)c2)ccc1[N+](=O)[O-] ZINC000427437037 945376829 /nfs/dbraw/zinc/37/68/29/945376829.db2.gz WMZLJZRNXTZKEH-UHFFFAOYSA-N 0 0 374.393 3.539 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)N1CCCc2ccccc2C1 ZINC000106852133 945414829 /nfs/dbraw/zinc/41/48/29/945414829.db2.gz PAKWLWZHZPJLIF-UHFFFAOYSA-N 0 0 353.422 3.762 20 5 FHBDRN COc1cc(C)c(Nc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)cc1OC ZINC000506822513 945415751 /nfs/dbraw/zinc/41/57/51/945415751.db2.gz IUQXTWGQKJMOAE-UHFFFAOYSA-N 0 0 357.366 3.549 20 5 FHBDRN CCN1C(=O)c2ccc(Cl)cc2N[C@H]1c1ccc(OC)c([N+](=O)[O-])c1 ZINC000106899582 945429049 /nfs/dbraw/zinc/42/90/49/945429049.db2.gz NISGWRYKIKTQAF-MRXNPFEDSA-N 0 0 361.785 3.843 20 5 FHBDRN COc1ccccc1NC(=O)COc1ccc([N+](=O)[O-])c2ccccc12 ZINC000151736869 945430161 /nfs/dbraw/zinc/43/01/61/945430161.db2.gz QLDNELXVFCFELB-UHFFFAOYSA-N 0 0 352.346 3.774 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)N[C@@H]1CCOC2(CCCC2)C1 ZINC000186002510 945436280 /nfs/dbraw/zinc/43/62/80/945436280.db2.gz SWNUKXJKBPKCET-CYBMUJFWSA-N 0 0 367.833 3.539 20 5 FHBDRN Cc1nsc(C)c1-c1noc(-c2ccn(-c3ccccc3[N+](=O)[O-])n2)n1 ZINC000426637241 945436552 /nfs/dbraw/zinc/43/65/52/945436552.db2.gz KTNRYCAROZZOSE-UHFFFAOYSA-N 0 0 368.378 3.571 20 5 FHBDRN CCCN(C[C@@H]1CCCCO1)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186002763 945443032 /nfs/dbraw/zinc/44/30/32/945443032.db2.gz QGNXMHNEFIJRQX-HNNXBMFYSA-N 0 0 369.849 3.739 20 5 FHBDRN COc1cccc([C@@H](C)N2CCN(Cc3c(F)cccc3[N+](=O)[O-])CC2)c1 ZINC000507683819 945449714 /nfs/dbraw/zinc/44/97/14/945449714.db2.gz NDPBZKLEQIRJDS-OAHLLOKOSA-N 0 0 373.428 3.621 20 5 FHBDRN O=C(CC[S@](=O)Cc1cccc(Cl)c1)Nc1ccccc1[N+](=O)[O-] ZINC000507691640 945454114 /nfs/dbraw/zinc/45/41/14/945454114.db2.gz DZBGKFINYAZWTL-DEOSSOPVSA-N 0 0 366.826 3.526 20 5 FHBDRN C[C@H](OCCCNC(=O)CCc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000087019679 945471965 /nfs/dbraw/zinc/47/19/65/945471965.db2.gz WRWZCAWPFOUFJJ-INIZCTEOSA-N 0 0 356.422 3.812 20 5 FHBDRN C[C@H]1CCN(C(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)CC1(F)F ZINC000427542914 945473486 /nfs/dbraw/zinc/47/34/86/945473486.db2.gz IFTZMKJOLXEPOQ-JTQLQIEISA-N 0 0 367.377 3.836 20 5 FHBDRN CCOc1ccc(OCC)c(NC(=O)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000087023787 945478470 /nfs/dbraw/zinc/47/84/70/945478470.db2.gz YLETVLSWEOQHFR-UHFFFAOYSA-N 0 0 358.394 3.964 20 5 FHBDRN CC(C)c1csc(CNC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)n1 ZINC000151276715 945492557 /nfs/dbraw/zinc/49/25/57/945492557.db2.gz POABKGKLMNODNK-NSHDSACASA-N 0 0 365.480 3.972 20 5 FHBDRN COc1cccc([C@H]2CCCN2c2nc3ccc([N+](=O)[O-])cc3c(=O)[nH]2)c1 ZINC000281053032 945509420 /nfs/dbraw/zinc/50/94/20/945509420.db2.gz XOFWAHKMRHVQTM-QGZVFWFLSA-N 0 0 366.377 3.594 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N2C[C@H](C)C(=O)Nc3ccccc32)c1 ZINC000150758554 945510215 /nfs/dbraw/zinc/51/02/15/945510215.db2.gz OKFKQHFJKPIYGJ-NSHDSACASA-N 0 0 371.418 3.552 20 5 FHBDRN O=C(Nc1nc(Cc2ccccc2)ns1)c1ccc([N+](=O)[O-])cc1Cl ZINC000107197767 945517758 /nfs/dbraw/zinc/51/77/58/945517758.db2.gz CNYWIGTZIBNJKJ-UHFFFAOYSA-N 0 0 374.809 3.943 20 5 FHBDRN COc1ccccc1[C@@H](NC(=O)c1ccc([N+](=O)[O-])s1)c1ccccn1 ZINC000129396619 945522629 /nfs/dbraw/zinc/52/26/29/945522629.db2.gz MYFUCPKHEGKAEO-QGZVFWFLSA-N 0 0 369.402 3.579 20 5 FHBDRN COc1cc(CN2C[C@@H](c3ccsc3)O[C@@H](C)C2)c([N+](=O)[O-])cc1F ZINC000248610121 945523087 /nfs/dbraw/zinc/52/30/87/945523087.db2.gz FROYGDHLQZRQQV-GTNSWQLSSA-N 0 0 366.414 3.766 20 5 FHBDRN O=[N+]([O-])c1cnc(N[C@@H]2CCOC3(CCCC3)C2)c(Br)c1 ZINC000301679813 945536708 /nfs/dbraw/zinc/53/67/08/945536708.db2.gz FDKHBOITFQYMEI-SNVBAGLBSA-N 0 0 356.220 3.656 20 5 FHBDRN CC(C)[C@H]1CCC[C@@H](NC(=O)c2ccc([N+](=O)[O-])c(-n3ccnc3)c2)C1 ZINC001126001862 945548473 /nfs/dbraw/zinc/54/84/73/945548473.db2.gz XCYBFMCXHNPEQN-GOEBONIOSA-N 0 0 356.426 3.725 20 5 FHBDRN Cc1c(C(=O)Oc2c(C)cccc2[N+](=O)[O-])cnn1Cc1ccccc1 ZINC000760021888 945564188 /nfs/dbraw/zinc/56/41/88/945564188.db2.gz FYLRFTIYZQAZFU-UHFFFAOYSA-N 0 0 351.362 3.676 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1OC(=O)c1cccc(NC(=O)c2ccco2)c1 ZINC000760023742 945579222 /nfs/dbraw/zinc/57/92/22/945579222.db2.gz ZVJAMDXMCGUZAV-UHFFFAOYSA-N 0 0 366.329 3.968 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1OC(=O)c1cccc(COC2CCOCC2)c1 ZINC000760023677 945580251 /nfs/dbraw/zinc/58/02/51/945580251.db2.gz XQMQOVHLBSBWLQ-UHFFFAOYSA-N 0 0 371.389 3.818 20 5 FHBDRN Cc1ccc(NC(=O)CN(C)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1 ZINC000550309202 945580662 /nfs/dbraw/zinc/58/06/62/945580662.db2.gz RQICPMNPPWYYGS-UHFFFAOYSA-N 0 0 367.327 3.997 20 5 FHBDRN CC(C)c1ccc(C(=O)NC2CCN(c3nccs3)CC2)cc1[N+](=O)[O-] ZINC000281310550 945586166 /nfs/dbraw/zinc/58/61/66/945586166.db2.gz PJDHHRVGBDDGSP-UHFFFAOYSA-N 0 0 374.466 3.574 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NCc1nc([C@@H](C)OCC(C)C)no1 ZINC000281291609 945588665 /nfs/dbraw/zinc/58/86/65/945588665.db2.gz SPOSCZVJURYTML-GFCCVEGCSA-N 0 0 364.402 3.722 20 5 FHBDRN O=C(c1cn2c(n1)CCC2)N(Cc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC001126492850 945589444 /nfs/dbraw/zinc/58/94/44/945589444.db2.gz BRFGFMMMSWUQAF-UHFFFAOYSA-N 0 0 362.389 3.585 20 5 FHBDRN CCCn1ncc(C(=O)Nc2cc([N+](=O)[O-])ccc2OCC)c1C1CC1 ZINC000281293086 945590031 /nfs/dbraw/zinc/59/00/31/945590031.db2.gz IJYZVKXVTVBNBP-UHFFFAOYSA-N 0 0 358.398 3.730 20 5 FHBDRN C[C@H]1CCC[C@@H]1NC(=O)c1ccc(N2C[C@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC001126012676 945600594 /nfs/dbraw/zinc/60/05/94/945600594.db2.gz IRKPREPHPKXBCW-IVSAIRAKSA-N 0 0 359.470 3.996 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC[C@@H]1[C@@H]1C[C@H](C)CC[C@@H]1O ZINC000281365178 945615210 /nfs/dbraw/zinc/61/52/10/945615210.db2.gz MHEKMJDOAWKPGY-XGWTYTTDSA-N 0 0 361.442 3.697 20 5 FHBDRN Cc1cccc2c1CC[C@H]2NC(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1 ZINC001126019236 945617752 /nfs/dbraw/zinc/61/77/52/945617752.db2.gz IHZBOMBWVXWDNO-QGZVFWFLSA-N 0 0 362.389 3.506 20 5 FHBDRN CC(C)(C)N1CC[C@H](NC(=O)c2cc3ccccc3c3cccnc23)C1=O ZINC000519651371 945620965 /nfs/dbraw/zinc/62/09/65/945620965.db2.gz NGCLHMSFTOIATQ-SFHVURJKSA-N 0 0 361.445 3.517 20 5 FHBDRN CSc1ccc(-c2nc(Cn3cnc4ccccc43)no2)cc1[N+](=O)[O-] ZINC000519676067 945627053 /nfs/dbraw/zinc/62/70/53/945627053.db2.gz ISUWFWJPSGPOFL-UHFFFAOYSA-N 0 0 367.390 3.765 20 5 FHBDRN Cc1cccc(OCCCNC(=O)[C@H]2C[C@H]2c2cccc([N+](=O)[O-])c2)c1C ZINC001271275590 945628359 /nfs/dbraw/zinc/62/83/59/945628359.db2.gz WUKVFNXLAFLHLF-OALUTQOASA-N 0 0 368.433 3.900 20 5 FHBDRN CC(C)(C(=O)Nc1ccc(O[C@H]2CCOC2)cc1)c1ccccc1[N+](=O)[O-] ZINC000519664063 945636353 /nfs/dbraw/zinc/63/63/53/945636353.db2.gz YNDNDRVBRWDLSA-INIZCTEOSA-N 0 0 370.405 3.679 20 5 FHBDRN O=C(c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1)N1CCCOCC1 ZINC000487454110 945641434 /nfs/dbraw/zinc/64/14/34/945641434.db2.gz UYXSBLGPXMAGJN-UHFFFAOYSA-N 0 0 358.419 3.609 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(C(=O)Nc2cc(Br)c(F)cc2C)n1 ZINC001271282663 945643434 /nfs/dbraw/zinc/64/34/34/945643434.db2.gz DFVSIJUNKNWHLC-UHFFFAOYSA-N 0 0 368.162 3.761 20 5 FHBDRN Cc1cc(C(=O)Nc2cc(F)ccc2OC[C@H]2CCCO2)cc([N+](=O)[O-])c1 ZINC000107498493 945644820 /nfs/dbraw/zinc/64/48/20/945644820.db2.gz OVCSORIKNSTWRK-MRXNPFEDSA-N 0 0 374.368 3.852 20 5 FHBDRN CCC(=O)c1ccc(N2CCN([C@H](C)c3nccs3)CC2)c([N+](=O)[O-])c1 ZINC000281522656 945667386 /nfs/dbraw/zinc/66/73/86/945667386.db2.gz QKNQJHBJWPDCKJ-CYBMUJFWSA-N 0 0 374.466 3.527 20 5 FHBDRN O=C(c1ccncc1Oc1ccccc1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000440432977 945668529 /nfs/dbraw/zinc/66/85/29/945668529.db2.gz VHCFGGTUPBSEBP-UHFFFAOYSA-N 0 0 361.357 3.985 20 5 FHBDRN CCCOc1ccc(NC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)cc1 ZINC000125193397 945680006 /nfs/dbraw/zinc/68/00/06/945680006.db2.gz YXHTZVUJTVSQCI-UHFFFAOYSA-N 0 0 355.394 3.974 20 5 FHBDRN CS[C@@H]1CCC[C@H](NC(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000522692486 945682057 /nfs/dbraw/zinc/68/20/57/945682057.db2.gz KNBJXSBDRJTMTL-KGYLQXTDSA-N 0 0 372.874 3.806 20 5 FHBDRN COc1ccc(NC(=O)CN2CCCCC[C@H]2c2ccco2)c([N+](=O)[O-])c1 ZINC000121215515 945699993 /nfs/dbraw/zinc/69/99/93/945699993.db2.gz UOMQSQSJDBVHQJ-INIZCTEOSA-N 0 0 373.409 3.752 20 5 FHBDRN CSCC[C@H](N[C@H](C)c1ccc([N+](=O)[O-])cc1)c1nnc2ccccn21 ZINC000164294627 945708748 /nfs/dbraw/zinc/70/87/48/945708748.db2.gz YDYWOJNFQQMSRB-CJNGLKHVSA-N 0 0 371.466 3.783 20 5 FHBDRN Cc1cc(NC(=O)Nc2cccc(Oc3ccc([N+](=O)[O-])cc3)c2)no1 ZINC000522717259 945713447 /nfs/dbraw/zinc/71/34/47/945713447.db2.gz RHPVCAYIHAXUAO-UHFFFAOYSA-N 0 0 354.322 3.749 20 5 FHBDRN O=[N+]([O-])c1ccc(OC(F)F)c(CNCc2ccc3c(n2)CCCC3)c1 ZINC000444008447 945718179 /nfs/dbraw/zinc/71/81/79/945718179.db2.gz GDZKERXXQJGWGJ-UHFFFAOYSA-N 0 0 363.364 3.760 20 5 FHBDRN Cc1cc(Cl)c(C(=O)N2C[C@H](C)OC3(CCCC3)C2)cc1[N+](=O)[O-] ZINC000843745774 945769353 /nfs/dbraw/zinc/76/93/53/945769353.db2.gz QVHNSDIKTCKJBX-LBPRGKRZSA-N 0 0 352.818 3.730 20 5 FHBDRN CSc1ccccc1[C@H](C)NC(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000281571668 945772576 /nfs/dbraw/zinc/77/25/76/945772576.db2.gz AQEPIHBYQHDHRB-NSHDSACASA-N 0 0 374.418 3.579 20 5 FHBDRN COc1ccc(Cc2nc(-c3ccc(C(C)=O)cc3F)no2)c([N+](=O)[O-])c1 ZINC001211851699 945773089 /nfs/dbraw/zinc/77/30/89/945773089.db2.gz ITSMLIICMLFVCM-UHFFFAOYSA-N 0 0 371.324 3.586 20 5 FHBDRN COc1ccc2c(c1)CCN(C(=O)Nc1cc([N+](=O)[O-])c(C)cc1C)CC2 ZINC000439676236 945783459 /nfs/dbraw/zinc/78/34/59/945783459.db2.gz WNLAAPRDMLPDIX-UHFFFAOYSA-N 0 0 369.421 3.853 20 5 FHBDRN CC1(C)CO[C@@H](CCNC(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000894497177 945805073 /nfs/dbraw/zinc/80/50/73/945805073.db2.gz IHJFVAWXYMLQMU-NSHDSACASA-N 0 0 360.332 3.549 20 5 FHBDRN CC(C)c1ccc(CNC(=O)N2CCOc3ccc([N+](=O)[O-])cc3C2)cc1 ZINC000519847734 945815812 /nfs/dbraw/zinc/81/58/12/945815812.db2.gz DZHYSRGJLVFBNJ-UHFFFAOYSA-N 0 0 369.421 3.822 20 5 FHBDRN CC(C)c1ccc(CCC(=O)NCCNc2ccc([N+](=O)[O-])cc2)cc1 ZINC000107916545 945816898 /nfs/dbraw/zinc/81/68/98/945816898.db2.gz OISOFWKKTXUJTQ-UHFFFAOYSA-N 0 0 355.438 3.879 20 5 FHBDRN COc1ccc(Cc2nc(-c3ccc(C)c(OC)c3)no2)c([N+](=O)[O-])c1 ZINC001211852280 945821233 /nfs/dbraw/zinc/82/12/33/945821233.db2.gz RKSQURSKOUNKOK-UHFFFAOYSA-N 0 0 355.350 3.561 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C[S@](=O)c1ccc(Br)cc1 ZINC000107941792 945829440 /nfs/dbraw/zinc/82/94/40/945829440.db2.gz GYSAJYJAXXSPNF-OAQYLSRUSA-N 0 0 370.224 3.674 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1F)c1ccc(OC[C@@H]2CCCO2)cc1 ZINC000519879683 945832152 /nfs/dbraw/zinc/83/21/52/945832152.db2.gz DDAULUVDHHNAQK-HNNXBMFYSA-N 0 0 360.341 3.544 20 5 FHBDRN CCc1n[nH]c(C(=O)N[C@@H]2c3ccccc3CC[C@H]2C(C)C)c1[N+](=O)[O-] ZINC000444366529 945838245 /nfs/dbraw/zinc/83/82/45/945838245.db2.gz FNIGJSUNIRJYPD-BBRMVZONSA-N 0 0 356.426 3.570 20 5 FHBDRN CC(C)(C)[C@H]1OCCC[C@@H]1CNc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 ZINC000522800031 945845456 /nfs/dbraw/zinc/84/54/56/945845456.db2.gz AGLCQSIRQPOLMQ-ACJLOTCBSA-N 0 0 361.442 3.733 20 5 FHBDRN Cc1ccc([C@@H](C)N(C)S(=O)(=O)c2c(F)cccc2[N+](=O)[O-])c(C)c1 ZINC000519892219 945864235 /nfs/dbraw/zinc/86/42/35/945864235.db2.gz SJOKZTCYVFUTPT-CYBMUJFWSA-N 0 0 366.414 3.732 20 5 FHBDRN C[C@@H](NCc1ccncc1OCC(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000281817923 945876231 /nfs/dbraw/zinc/87/62/31/945876231.db2.gz ZLYMRQJHIMOEMV-LLVKDONJSA-N 0 0 355.316 3.782 20 5 FHBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CC[C@@H](C)C(F)(F)C1 ZINC000427551717 945878857 /nfs/dbraw/zinc/87/88/57/945878857.db2.gz CYIZCHVFWKMMRV-NXEZZACHSA-N 0 0 362.760 3.519 20 5 FHBDRN O=[N+]([O-])c1ccccc1OCCN1CCn2cccc2[C@@H]1c1ccccc1 ZINC000108185852 945878767 /nfs/dbraw/zinc/87/87/67/945878767.db2.gz IJDYGPULUKFLRG-NRFANRHFSA-N 0 0 363.417 3.880 20 5 FHBDRN Cc1cccc(C(=O)NCc2ccc(F)cc2C(F)(F)F)c1[N+](=O)[O-] ZINC000121225612 945880881 /nfs/dbraw/zinc/88/08/81/945880881.db2.gz AJDODXYIRJNWHD-UHFFFAOYSA-N 0 0 356.275 3.991 20 5 FHBDRN COc1ccccc1[C@@H](NC(=O)c1ccc([N+](=O)[O-])o1)c1ccccc1 ZINC000108179487 945882953 /nfs/dbraw/zinc/88/29/53/945882953.db2.gz WXAQCGLMWZOCST-SFHVURJKSA-N 0 0 352.346 3.716 20 5 FHBDRN COC(=O)c1c(C2CC2)csc1NC(=O)c1cc(C)cc([N+](=O)[O-])c1 ZINC000439686827 945883568 /nfs/dbraw/zinc/88/35/68/945883568.db2.gz UNXUEXBLKDQYJX-UHFFFAOYSA-N 0 0 360.391 3.881 20 5 FHBDRN C[C@@H](C(=O)N1CCCC[C@H]1c1cccn1C)c1ccc([N+](=O)[O-])cc1F ZINC000184410801 945890648 /nfs/dbraw/zinc/89/06/48/945890648.db2.gz DHZGIITZXSXBEY-ACJLOTCBSA-N 0 0 359.401 3.930 20 5 FHBDRN CCOc1ccc(C(=O)Nc2cc(CC(C)(C)C)nn2C)cc1[N+](=O)[O-] ZINC000108244364 945898307 /nfs/dbraw/zinc/89/83/07/945898307.db2.gz BDKPQOLWMHRDNY-UHFFFAOYSA-N 0 0 360.414 3.568 20 5 FHBDRN O=[N+]([O-])c1ccc(OCCCSc2nccc(C(F)(F)F)n2)cc1 ZINC000108280508 945915112 /nfs/dbraw/zinc/91/51/12/945915112.db2.gz YRBYMDNHEAIRDE-UHFFFAOYSA-N 0 0 359.329 3.965 20 5 FHBDRN Cn1nc(CC(C)(C)C)cc1NC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000108348102 945936078 /nfs/dbraw/zinc/93/60/78/945936078.db2.gz KGHLSYRBCAEHGA-UHFFFAOYSA-N 0 0 350.806 3.823 20 5 FHBDRN C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCN2C(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000281938651 945955367 /nfs/dbraw/zinc/95/53/67/945955367.db2.gz HRMQASUOUKRUKE-ZUFFMMDNSA-N 0 0 366.845 3.650 20 5 FHBDRN CCN(Cc1cccc(Cl)c1)S(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1 ZINC000108418095 945960253 /nfs/dbraw/zinc/96/02/53/945960253.db2.gz XDUHPXRYULUHMX-UHFFFAOYSA-N 0 0 368.842 3.767 20 5 FHBDRN Cc1nn(Cc2ccc(C(=O)NC[C@H]3CC=CCC3)cc2)c(C)c1[N+](=O)[O-] ZINC000519976137 945963988 /nfs/dbraw/zinc/96/39/88/945963988.db2.gz JANIPSORQPFAEX-INIZCTEOSA-N 0 0 368.437 3.543 20 5 FHBDRN COc1cc(C(=O)N[C@@H]2CCCC[C@H]2C(C)(C)C)c([N+](=O)[O-])cc1OC ZINC000074500518 945970960 /nfs/dbraw/zinc/97/09/60/945970960.db2.gz COVKGAHUKZIQOK-ZIAGYGMSSA-N 0 0 364.442 3.947 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)N1CCC([C@@H](O)c2ccc(F)cc2)CC1 ZINC000108431538 945971357 /nfs/dbraw/zinc/97/13/57/945971357.db2.gz XHXUHAJVAGICBS-SFHVURJKSA-N 0 0 373.384 3.711 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)N[C@H]2CCCC23CCOCC3)cc1[N+](=O)[O-] ZINC000281960321 945992905 /nfs/dbraw/zinc/99/29/05/945992905.db2.gz QRDMBHXBUPEUMK-YOEHRIQHSA-N 0 0 361.442 3.613 20 5 FHBDRN COc1ccc(C(=O)N(C)[C@@H](C)c2cc(F)ccc2F)cc1[N+](=O)[O-] ZINC000045260665 945995116 /nfs/dbraw/zinc/99/51/16/945995116.db2.gz BAWOKPKBFHOLNT-JTQLQIEISA-N 0 0 350.321 3.715 20 5 FHBDRN C[C@@H]1C[C@@H](c2cccc(F)c2)N(CC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000444169393 946015870 /nfs/dbraw/zinc/01/58/70/946015870.db2.gz RJTDYAYWRNMEPY-ACJLOTCBSA-N 0 0 357.385 3.756 20 5 FHBDRN COc1cccc(C(=O)N2CCC[C@H](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000444168025 946015998 /nfs/dbraw/zinc/01/59/98/946015998.db2.gz GMYHQSYSDUYAMH-MRXNPFEDSA-N 0 0 354.406 3.698 20 5 FHBDRN C[C@H](NC(=O)c1cccn1Cc1cccs1)c1cccc([N+](=O)[O-])c1 ZINC000108597160 946017558 /nfs/dbraw/zinc/01/75/58/946017558.db2.gz PBANMCQYCBUZBO-ZDUSSCGKSA-N 0 0 355.419 3.997 20 5 FHBDRN O=C(Nc1cc(C2CCCCCC2)[nH]n1)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000522861028 946026460 /nfs/dbraw/zinc/02/64/60/946026460.db2.gz PAYAIJDBQCDPJB-UHFFFAOYSA-N 0 0 368.397 3.884 20 5 FHBDRN Cc1cc(C)c(OCC(=O)N2CCCc3ccc([N+](=O)[O-])cc32)c(C)c1 ZINC000522874511 946038851 /nfs/dbraw/zinc/03/88/51/946038851.db2.gz YSVIGVJQYUGVFQ-UHFFFAOYSA-N 0 0 354.406 3.878 20 5 FHBDRN CCOc1cc(NC(=O)C[C@@H](C)n2cccc2)c([N+](=O)[O-])cc1OCC ZINC000522874513 946039252 /nfs/dbraw/zinc/03/92/52/946039252.db2.gz ZLISAONNBFTMLZ-CYBMUJFWSA-N 0 0 361.398 3.784 20 5 FHBDRN O=C(Nc1ccnc2ccnn21)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000108720115 946047797 /nfs/dbraw/zinc/04/77/97/946047797.db2.gz QLTCDPQELACVNR-UHFFFAOYSA-N 0 0 374.360 3.633 20 5 FHBDRN CC1(C)CN(C(=O)CCCNc2ccc([N+](=O)[O-])cc2)[C@@H]1c1cccnc1 ZINC000294000557 946050988 /nfs/dbraw/zinc/05/09/88/946050988.db2.gz YUFQENNESCTQIL-LJQANCHMSA-N 0 0 368.437 3.792 20 5 FHBDRN CC(=O)N(c1ccc(NC(=O)c2csc([N+](=O)[O-])c2)cc1)[C@@H]1C[C@@H]1C ZINC000294001959 946051264 /nfs/dbraw/zinc/05/12/64/946051264.db2.gz AQAWPORZDHTZRN-ZUZCIYMTSA-N 0 0 359.407 3.670 20 5 FHBDRN O=c1c(Cl)cc([N+](=O)[O-])cn1CCOc1c(Cl)cccc1Cl ZINC000522885718 946054265 /nfs/dbraw/zinc/05/42/65/946054265.db2.gz PAAWLFWBYDJGTR-UHFFFAOYSA-N 0 0 363.584 3.796 20 5 FHBDRN Cc1n[nH]c(C(=O)N[C@@H](C)c2sc(-c3ccccc3)nc2C)c1[N+](=O)[O-] ZINC000522881250 946057777 /nfs/dbraw/zinc/05/77/77/946057777.db2.gz UOENGTRPZHWBLJ-JTQLQIEISA-N 0 0 371.422 3.549 20 5 FHBDRN CCOc1nc(C(F)(F)F)ccc1C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000428333116 946064641 /nfs/dbraw/zinc/06/46/41/946064641.db2.gz JNPVOEMRHSLUKG-UHFFFAOYSA-N 0 0 355.272 3.660 20 5 FHBDRN O=C(NC[C@H]1CCOc2ccccc21)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000108881686 946074352 /nfs/dbraw/zinc/07/43/52/946074352.db2.gz BDUGIXJJWVVXSG-LLVKDONJSA-N 0 0 361.785 3.936 20 5 FHBDRN Cc1nnsc1[C@H](C)OC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC000909360656 946080894 /nfs/dbraw/zinc/08/08/94/946080894.db2.gz CGMWKLVQBZUTMH-ZETCQYMHSA-N 0 0 361.301 3.692 20 5 FHBDRN CN(Cc1ccccc1C(F)(F)F)C(=O)NCc1ccccc1[N+](=O)[O-] ZINC000045622092 946086609 /nfs/dbraw/zinc/08/66/09/946086609.db2.gz PEWUFNZIGCMHAS-UHFFFAOYSA-N 0 0 367.327 3.955 20 5 FHBDRN CN(Cc1nc2ccccc2s1)C(=O)NCc1ccccc1[N+](=O)[O-] ZINC000045625506 946088540 /nfs/dbraw/zinc/08/85/40/946088540.db2.gz FVUGJDRXAQUDOX-UHFFFAOYSA-N 0 0 356.407 3.546 20 5 FHBDRN O=[N+]([O-])c1cnn(CCNc2ccc3ccc(Cl)c(Cl)c3n2)c1 ZINC000302047996 946095885 /nfs/dbraw/zinc/09/58/85/946095885.db2.gz YZHDUCZSWCVZML-UHFFFAOYSA-N 0 0 352.181 3.758 20 5 FHBDRN CC1(C)C[C@@H](NC(=O)c2cccc3c(=O)c4cccc(F)c4[nH]c23)CCO1 ZINC000444233777 946098778 /nfs/dbraw/zinc/09/87/78/946098778.db2.gz BSFIOYHKXCDDPH-LBPRGKRZSA-N 0 0 368.408 3.508 20 5 FHBDRN O=C(N[C@@H]1C=CCCC1)c1cc(F)cc2c(=O)c3cccc(F)c3[nH]c12 ZINC000444232078 946103080 /nfs/dbraw/zinc/10/30/80/946103080.db2.gz MYIBDFLFEBFTRK-GFCCVEGCSA-N 0 0 354.356 3.798 20 5 FHBDRN CCC(CC)(CCO)CNC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000444239056 946104204 /nfs/dbraw/zinc/10/42/04/946104204.db2.gz GYFAIXJNNVTJTJ-UHFFFAOYSA-N 0 0 366.461 3.600 20 5 FHBDRN CC(C)CSCCNC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000444242494 946118092 /nfs/dbraw/zinc/11/80/92/946118092.db2.gz OKVMUPXKIMVVLU-UHFFFAOYSA-N 0 0 354.475 3.800 20 5 FHBDRN COc1cccc(CO[C@H](C)C(=O)O[C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000066877990 946119143 /nfs/dbraw/zinc/11/91/43/946119143.db2.gz MWNXEOWFNUZOLQ-UONOGXRCSA-N 0 0 359.378 3.813 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)OCc1ccccc1C(F)(F)F ZINC000027800321 946122083 /nfs/dbraw/zinc/12/20/83/946122083.db2.gz DPQJPZYQUPPTCT-UHFFFAOYSA-N 0 0 355.268 3.979 20 5 FHBDRN O=C(c1cc(F)cc2c(=O)c3cccc(F)c3[nH]c12)N1C[C@@H]2CCC[C@@H]2C1 ZINC000444254026 946131672 /nfs/dbraw/zinc/13/16/72/946131672.db2.gz ZHQGBYULUWLAGA-TXEJJXNPSA-N 0 0 368.383 3.832 20 5 FHBDRN CC[C@@H](NC(=O)NCCCNc1ccc(C)cc1[N+](=O)[O-])c1ccncc1 ZINC000074384741 946137290 /nfs/dbraw/zinc/13/72/90/946137290.db2.gz JBMLRQQDLCIGHV-MRXNPFEDSA-N 0 0 371.441 3.551 20 5 FHBDRN Cc1sc(S(=O)(=O)Oc2cccc3c(C)ccnc23)cc1[N+](=O)[O-] ZINC000127166040 946137873 /nfs/dbraw/zinc/13/78/73/946137873.db2.gz ZWTZHTSACSUPGI-UHFFFAOYSA-N 0 0 364.404 3.589 20 5 FHBDRN O=C(Nc1ccc(-n2cncn2)nc1)c1cc2ccccc2c2cccnc12 ZINC000045768532 946140332 /nfs/dbraw/zinc/14/03/32/946140332.db2.gz IMWXGXRAOUTPQG-UHFFFAOYSA-N 0 0 366.384 3.616 20 5 FHBDRN Cc1nc2ccccc2n1CCCOC(=O)c1cccc(C)c1[N+](=O)[O-] ZINC000109156539 946160612 /nfs/dbraw/zinc/16/06/12/946160612.db2.gz CYOARFCKWSMPHX-UHFFFAOYSA-N 0 0 353.378 3.808 20 5 FHBDRN Cc1c(C(=O)N[C@H](C)c2cccc(N3CCCC3)c2)cccc1[N+](=O)[O-] ZINC000088218089 946165726 /nfs/dbraw/zinc/16/57/26/946165726.db2.gz YLXAYIMDMZAQNA-OAHLLOKOSA-N 0 0 353.422 3.994 20 5 FHBDRN C[C@H](NC(=O)c1cccc2c(=O)c3cccc(F)c3[nH]c12)[C@H]1CCCCO1 ZINC000444284599 946173517 /nfs/dbraw/zinc/17/35/17/946173517.db2.gz HMUJAISFTGPMKZ-YVEFUNNKSA-N 0 0 368.408 3.508 20 5 FHBDRN COc1cccc([C@H]2C[C@H](NC(=O)c3c[nH]c4cc([N+](=O)[O-])ccc34)C2)c1 ZINC000456501783 946182633 /nfs/dbraw/zinc/18/26/33/946182633.db2.gz CTEJGYBCUOUQGL-HDJSIYSDSA-N 0 0 365.389 3.761 20 5 FHBDRN CCc1n[nH]c(C(=O)NC2(c3c(Cl)cccc3Cl)CC2)c1[N+](=O)[O-] ZINC000444301534 946187948 /nfs/dbraw/zinc/18/79/48/946187948.db2.gz NACAEBUKIYHDGF-UHFFFAOYSA-N 0 0 369.208 3.606 20 5 FHBDRN O=C(CSc1nnc(Cc2ccccc2F)o1)c1cccc([N+](=O)[O-])c1 ZINC000109199973 946189175 /nfs/dbraw/zinc/18/91/75/946189175.db2.gz BACHROOMXDRKGM-UHFFFAOYSA-N 0 0 373.365 3.683 20 5 FHBDRN CCc1[nH]nc(C(=O)N(CC(C)C)c2ccc(Cl)cc2)c1[N+](=O)[O-] ZINC000444305612 946197664 /nfs/dbraw/zinc/19/76/64/946197664.db2.gz UGTDRQFYKVEPFQ-UHFFFAOYSA-N 0 0 350.806 3.837 20 5 FHBDRN O=C(NC[C@H]1CCCCS1)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000444306281 946198253 /nfs/dbraw/zinc/19/82/53/946198253.db2.gz VYPLJFKJPXUVCD-GFCCVEGCSA-N 0 0 370.449 3.836 20 5 FHBDRN O=C(Nc1ccccc1-c1cn[nH]c1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000439761521 946208115 /nfs/dbraw/zinc/20/81/15/946208115.db2.gz YTKHDGBZNGOZPC-UHFFFAOYSA-N 0 0 374.303 3.839 20 5 FHBDRN Cc1ccc(CN(CCO)C(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)cc1 ZINC000439755402 946210240 /nfs/dbraw/zinc/21/02/40/946210240.db2.gz KZNRFHZTZMWHCQ-UHFFFAOYSA-N 0 0 356.422 3.661 20 5 FHBDRN CN(C(=O)CCc1cccc([N+](=O)[O-])c1)[C@@H]1CCCN(c2ccccc2)C1 ZINC000151773584 946225219 /nfs/dbraw/zinc/22/52/19/946225219.db2.gz OKIMFBYYMVMHCW-HXUWFJFHSA-N 0 0 367.449 3.655 20 5 FHBDRN C[C@H]1Cc2ccccc2CN1C(=O)c1cc2ccccc2c([N+](=O)[O-])c1N ZINC001126595178 946238919 /nfs/dbraw/zinc/23/89/19/946238919.db2.gz GMNOOYFCKIMAPY-ZDUSSCGKSA-N 0 0 361.401 3.917 20 5 FHBDRN CCOC(=O)[C@@H]1CN([C@H](C)c2cccc([N+](=O)[O-])c2)Cc2ccccc21 ZINC000441128054 946241809 /nfs/dbraw/zinc/24/18/09/946241809.db2.gz RWVWXJKMYVVVAA-AUUYWEPGSA-N 0 0 354.406 3.818 20 5 FHBDRN CCC[C@@H](C)NC(=O)[C@@H]1CCCN(Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000783555348 946252599 /nfs/dbraw/zinc/25/25/99/946252599.db2.gz PGELJIMXVZXIPT-UKRRQHHQSA-N 0 0 367.877 3.765 20 5 FHBDRN CCOc1cccc([C@H](C)NC(=O)CSc2ccc([N+](=O)[O-])cc2)c1 ZINC000109366955 946261556 /nfs/dbraw/zinc/26/15/56/946261556.db2.gz DMXPZMUGEWEHGT-ZDUSSCGKSA-N 0 0 360.435 3.963 20 5 FHBDRN Cc1ccc(NC(=O)Cc2noc(/C=C/c3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000109441334 946288464 /nfs/dbraw/zinc/28/84/64/946288464.db2.gz YDVWAZOUOKFROV-IZZDOVSWSA-N 0 0 364.361 3.638 20 5 FHBDRN COc1cc(C(=O)N[C@@H](C)c2cccc(N3CCCC3)c2)ccc1[N+](=O)[O-] ZINC000088238271 946290437 /nfs/dbraw/zinc/29/04/37/946290437.db2.gz FGRAFDDVGTZNTR-AWEZNQCLSA-N 0 0 369.421 3.695 20 5 FHBDRN CC(C)c1cccc(OCC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)c1 ZINC000088231412 946292139 /nfs/dbraw/zinc/29/21/39/946292139.db2.gz VIYALBSCIJSHAW-UHFFFAOYSA-N 0 0 354.406 3.682 20 5 FHBDRN COc1ccc(C(=O)N[C@@H](C)c2cccc(N3CCCC3)c2)cc1[N+](=O)[O-] ZINC000088238263 946293519 /nfs/dbraw/zinc/29/35/19/946293519.db2.gz GJVIOTVVLAWZDY-AWEZNQCLSA-N 0 0 369.421 3.695 20 5 FHBDRN O=C([C@H]1C[C@@H]1c1ccccc1Cl)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088231250 946295616 /nfs/dbraw/zinc/29/56/16/946295616.db2.gz MMCDHSIKUBXUPB-SJORKVTESA-N 0 0 356.809 3.937 20 5 FHBDRN Cc1ccc(-c2cc(C(=O)N3CCc4ccc([N+](=O)[O-])cc4C3)on2)cc1 ZINC000088231078 946296577 /nfs/dbraw/zinc/29/65/77/946296577.db2.gz ROKKBRYICSSXIK-UHFFFAOYSA-N 0 0 363.373 3.757 20 5 FHBDRN C[C@H](Oc1ccccc1Cl)C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088230846 946297419 /nfs/dbraw/zinc/29/74/19/946297419.db2.gz KGEYELXSCWKNRU-LBPRGKRZSA-N 0 0 360.797 3.600 20 5 FHBDRN O=C(N[C@@H]1C[C@H]1c1ccccc1Br)c1ccccc1[N+](=O)[O-] ZINC000104582272 946301769 /nfs/dbraw/zinc/30/17/69/946301769.db2.gz VLQQKDSQFWIABH-GXTWGEPZSA-N 0 0 361.195 3.643 20 5 FHBDRN O=[N+]([O-])c1ccc(NCc2cccc(O)c2)nc1OCc1ccccc1 ZINC000302153018 946317512 /nfs/dbraw/zinc/31/75/12/946317512.db2.gz CPCDAHNAOAVGKR-UHFFFAOYSA-N 0 0 351.362 3.887 20 5 FHBDRN CSc1cccc(C(=O)N(C)CCOc2ccc(F)cc2)c1[N+](=O)[O-] ZINC000186019077 946317813 /nfs/dbraw/zinc/31/78/13/946317813.db2.gz WJRPMBCCGHYMDT-UHFFFAOYSA-N 0 0 364.398 3.607 20 5 FHBDRN CSc1cccc(C(=O)N(C)CCOc2ccc(C)cc2)c1[N+](=O)[O-] ZINC000186019281 946318909 /nfs/dbraw/zinc/31/89/09/946318909.db2.gz HEMDJUAHSFQBLH-UHFFFAOYSA-N 0 0 360.435 3.776 20 5 FHBDRN CSc1cccc(C(=O)N(C)CCOc2ccccc2F)c1[N+](=O)[O-] ZINC000186019769 946321541 /nfs/dbraw/zinc/32/15/41/946321541.db2.gz YUAIWBYQQXWOIB-UHFFFAOYSA-N 0 0 364.398 3.607 20 5 FHBDRN COc1ccc(-c2noc(-c3ccn(-c4ccc([N+](=O)[O-])cc4)n3)n2)cc1 ZINC000109530940 946323725 /nfs/dbraw/zinc/32/37/25/946323725.db2.gz FXWSNWGLEIMUSS-UHFFFAOYSA-N 0 0 363.333 3.506 20 5 FHBDRN Cc1ccc(NC(=O)CN(Cc2ccccc2[N+](=O)[O-])C2CC2)cc1F ZINC000441243608 946351291 /nfs/dbraw/zinc/35/12/91/946351291.db2.gz AJJAUHYBEABGMA-UHFFFAOYSA-N 0 0 357.385 3.645 20 5 FHBDRN CC(C)(C)OC(=O)NC1(c2noc(-c3ccc([N+](=O)[O-])s3)n2)CCC1 ZINC000109615595 946352108 /nfs/dbraw/zinc/35/21/08/946352108.db2.gz AJJRCOJOTHXTDS-UHFFFAOYSA-N 0 0 366.399 3.610 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)Nc1ccc(Oc2ccncc2)cc1 ZINC000109594690 946357405 /nfs/dbraw/zinc/35/74/05/946357405.db2.gz NEGCPUOVUUKTBA-UHFFFAOYSA-N 0 0 365.345 3.800 20 5 FHBDRN CCC[C@@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)C(=O)OC ZINC000475098992 946377602 /nfs/dbraw/zinc/37/76/02/946377602.db2.gz WJPFBRCIFKFLHV-OAHLLOKOSA-N 0 0 366.801 3.940 20 5 FHBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1OC(=O)c1ccc([N+](=O)[O-])cc1C ZINC001126119824 946377848 /nfs/dbraw/zinc/37/78/48/946377848.db2.gz BMDQRWCGERLFOM-UHFFFAOYSA-N 0 0 350.714 3.992 20 5 FHBDRN CCN(CC)c1ccc(-c2noc(-c3ccc([N+](=O)[O-])c(C)c3)n2)cn1 ZINC000545671922 946384788 /nfs/dbraw/zinc/38/47/88/946384788.db2.gz LJKPCGNDJLDZCN-UHFFFAOYSA-N 0 0 353.382 3.861 20 5 FHBDRN O=C(NC1Cc2ccccc2C1)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000444321013 946387152 /nfs/dbraw/zinc/38/71/52/946387152.db2.gz FZUGEHVHUDQNIH-UHFFFAOYSA-N 0 0 354.409 3.579 20 5 FHBDRN Cc1nc2ccccc2n1CCCNC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000047697525 946399820 /nfs/dbraw/zinc/39/98/20/946399820.db2.gz DWEVBHHMWYTRMX-UHFFFAOYSA-N 0 0 367.409 3.773 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])Nc1ccccc1Br ZINC000047688494 946402301 /nfs/dbraw/zinc/40/23/01/946402301.db2.gz SSBHAMCZIMSQNZ-UHFFFAOYSA-N 0 0 350.172 3.679 20 5 FHBDRN C[C@@H](C[C@H]1CCOC1)NC(=O)c1cc(F)c(Cl)c([N+](=O)[O-])c1Cl ZINC000896974439 946405281 /nfs/dbraw/zinc/40/52/81/946405281.db2.gz AJNHUUVWTQBINT-JGVFFNPUSA-N 0 0 365.188 3.586 20 5 FHBDRN COc1cc(OC)c(NC(=O)NCc2ccccc2[N+](=O)[O-])cc1Cl ZINC000047722137 946407860 /nfs/dbraw/zinc/40/78/60/946407860.db2.gz FTBMJBNYOBZMLA-UHFFFAOYSA-N 0 0 365.773 3.587 20 5 FHBDRN CO[C@@H](C)c1nc(COC(=O)c2c(Cl)cccc2[N+](=O)[O-])cs1 ZINC000783555618 946411295 /nfs/dbraw/zinc/41/12/95/946411295.db2.gz YUWWTESVNUYUDO-QMMMGPOBSA-N 0 0 356.787 3.769 20 5 FHBDRN COc1cc(C(=O)N2C[C@@H](C)CC(C)(C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000544321842 946416993 /nfs/dbraw/zinc/41/69/93/946416993.db2.gz FOEUXEQPWYIIGO-JTQLQIEISA-N 0 0 372.368 3.713 20 5 FHBDRN CCN(Cc1ccc(C)cc1)S(=O)(=O)c1cc([N+](=O)[O-])cc(C)c1C ZINC000519891913 946423212 /nfs/dbraw/zinc/42/32/12/946423212.db2.gz ABIAPUJTTXQPOT-UHFFFAOYSA-N 0 0 362.451 3.731 20 5 FHBDRN Cc1ccc2[nH]c(CNC(=O)c3ccc(C(C)C)c([N+](=O)[O-])c3)nc2c1 ZINC000473898098 946427664 /nfs/dbraw/zinc/42/76/64/946427664.db2.gz YODFEJXDQRZRKD-UHFFFAOYSA-N 0 0 352.394 3.833 20 5 FHBDRN COc1ccc(-c2ccc(CNc3cccc(CO)c3)o2)c([N+](=O)[O-])c1 ZINC000475129294 946434878 /nfs/dbraw/zinc/43/48/78/946434878.db2.gz JDDFOVNXKZSFTO-UHFFFAOYSA-N 0 0 354.362 3.968 20 5 FHBDRN O=C(CNc1ccc(Cl)c([N+](=O)[O-])c1)N1CCSc2ccccc21 ZINC000137791226 946443132 /nfs/dbraw/zinc/44/31/32/946443132.db2.gz MURRQRVPRQJOLT-UHFFFAOYSA-N 0 0 363.826 3.799 20 5 FHBDRN COc1cc(NC(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])ccc1F ZINC000444323522 946444762 /nfs/dbraw/zinc/44/47/62/946444762.db2.gz BGWZRNDSBDKWPL-VIFPVBQESA-N 0 0 368.748 3.802 20 5 FHBDRN CSc1cccc(C(=O)Nc2cccc(NC(C)=O)c2C)c1[N+](=O)[O-] ZINC000186074722 946445642 /nfs/dbraw/zinc/44/56/42/946445642.db2.gz VRTKSKFXHFRQNQ-UHFFFAOYSA-N 0 0 359.407 3.836 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)[C@H]1CC(=O)N(C2CCC(C)CC2)C1 ZINC000129496557 946446193 /nfs/dbraw/zinc/44/61/93/946446193.db2.gz DVFMSUYWRTUMFB-NRAUKZCXSA-N 0 0 373.453 3.577 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCOc2ccc(F)cc21 ZINC000088266182 946446730 /nfs/dbraw/zinc/44/67/30/946446730.db2.gz SMFHACPEZVTPSL-LLVKDONJSA-N 0 0 362.382 3.640 20 5 FHBDRN COC[C@@H](Sc1sc(S(C)(=O)=O)cc1[N+](=O)[O-])c1ccccc1 ZINC000897003186 946449392 /nfs/dbraw/zinc/44/93/92/946449392.db2.gz NAFUMHPMFNNNIM-GFCCVEGCSA-N 0 0 373.477 3.540 20 5 FHBDRN Cc1cc(N2CCNC2=O)ccc1NCC=Cc1ccccc1[N+](=O)[O-] ZINC000441327190 946456722 /nfs/dbraw/zinc/45/67/22/946456722.db2.gz ASZZGMCAPBHTSM-XQRVVYSFSA-N 0 0 352.394 3.558 20 5 FHBDRN CC(C)[C@@H]1CCCN(C(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000444385302 946461203 /nfs/dbraw/zinc/46/12/03/946461203.db2.gz SZQSAPSSTYBAHY-CYBMUJFWSA-N 0 0 354.834 3.912 20 5 FHBDRN CC[C@H](C)[C@@H]1CCCCN1C(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000523094688 946467595 /nfs/dbraw/zinc/46/75/95/946467595.db2.gz WGARMUZGXRWTEA-KSSFIOAISA-N 0 0 356.426 3.821 20 5 FHBDRN CCCCn1ncc(NC(=O)c2cccc(OC)c2[N+](=O)[O-])c1C(C)C ZINC000444404802 946468286 /nfs/dbraw/zinc/46/82/86/946468286.db2.gz WDQBOIXCOAILMQ-UHFFFAOYSA-N 0 0 360.414 3.976 20 5 FHBDRN CCc1ccc(C(=O)Nc2ccc(Nc3ncccn3)cc2)cc1[N+](=O)[O-] ZINC000444413659 946475088 /nfs/dbraw/zinc/47/50/88/946475088.db2.gz CQFAERXITNDZID-UHFFFAOYSA-N 0 0 363.377 3.943 20 5 FHBDRN COC[C@H](C)n1ccc(NC(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)n1 ZINC000186549985 946534820 /nfs/dbraw/zinc/53/48/20/946534820.db2.gz HLNYFDDUGXDIRX-LBPRGKRZSA-N 0 0 360.414 3.549 20 5 FHBDRN COC[C@@H](C)n1ccc(NC(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)n1 ZINC000186550003 946534914 /nfs/dbraw/zinc/53/49/14/946534914.db2.gz HLNYFDDUGXDIRX-GFCCVEGCSA-N 0 0 360.414 3.549 20 5 FHBDRN Cc1c(C(F)(F)F)nn(C)c1NC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000186163157 946543189 /nfs/dbraw/zinc/54/31/89/946543189.db2.gz ISPHEZHBCGUSKE-UHFFFAOYSA-N 0 0 362.695 3.561 20 5 FHBDRN C[C@H](CNC(=O)N1CC(C)(C)[C@H]1c1ccncc1)c1ccccc1[N+](=O)[O-] ZINC000897061660 946548417 /nfs/dbraw/zinc/54/84/17/946548417.db2.gz MODXNQSCGNDPQH-RDTXWAMCSA-N 0 0 368.437 3.886 20 5 FHBDRN C[C@H](CNC(=O)N1CC(C)(C)[C@@H]1c1ccncc1)c1ccccc1[N+](=O)[O-] ZINC000897061658 946548429 /nfs/dbraw/zinc/54/84/29/946548429.db2.gz MODXNQSCGNDPQH-KDOFPFPSSA-N 0 0 368.437 3.886 20 5 FHBDRN C[C@H](NC(=O)c1c(N)cccc1[N+](=O)[O-])c1cc(Cl)ccc1Cl ZINC000186558368 946551916 /nfs/dbraw/zinc/55/19/16/946551916.db2.gz PHXJPKIGMWKWJA-QMMMGPOBSA-N 0 0 354.193 3.975 20 5 FHBDRN C[C@@H]1CN(Cc2ccccc2NCc2ccccc2[N+](=O)[O-])C[C@@H](C)O1 ZINC000475174156 946565065 /nfs/dbraw/zinc/56/50/65/946565065.db2.gz MYDXGTMIFFTKEK-HZPDHXFCSA-N 0 0 355.438 3.816 20 5 FHBDRN CC(C)c1ncc(CN(C)C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)cn1 ZINC000441414111 946573104 /nfs/dbraw/zinc/57/31/04/946573104.db2.gz JHMOBUTZLDSXKJ-UHFFFAOYSA-N 0 0 370.434 3.995 20 5 FHBDRN CSc1cccc(C(=O)NC[C@@H](C)Cc2cccs2)c1[N+](=O)[O-] ZINC000186582479 946575788 /nfs/dbraw/zinc/57/57/88/946575788.db2.gz OOFLGQJBAONGSQ-NSHDSACASA-N 0 0 350.465 3.987 20 5 FHBDRN CCN(C(=O)CCn1nc(C)c([N+](=O)[O-])c1C)c1ccc(Cl)c(F)c1 ZINC000441403293 946580962 /nfs/dbraw/zinc/58/09/62/946580962.db2.gz CIXBJXLUTSUVSG-UHFFFAOYSA-N 0 0 368.796 3.644 20 5 FHBDRN CCCN(Cc1c([N+](=O)[O-])ncn1C)Cc1ccccc1Br ZINC000475525186 946597256 /nfs/dbraw/zinc/59/72/56/946597256.db2.gz BRQBACZBDWFQTO-UHFFFAOYSA-N 0 0 367.247 3.503 20 5 FHBDRN C[C@@H]1CC[C@@H](NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)[C@@H](C)C1 ZINC001126139347 946597482 /nfs/dbraw/zinc/59/74/82/946597482.db2.gz OUSCPGLMKCVUIT-ISTVAULSSA-N 0 0 355.232 3.912 20 5 FHBDRN CCCn1c2ccccc2nc1NC(=O)c1cccc([N+](=O)[O-])c1OC ZINC000475526556 946598099 /nfs/dbraw/zinc/59/80/99/946598099.db2.gz FYRJPSNWCMPZFG-UHFFFAOYSA-N 0 0 354.366 3.615 20 5 FHBDRN Cc1cc([N+](=O)[O-])cn(CCOC(c2ccccc2)c2ccccc2)c1=O ZINC000127221481 946603180 /nfs/dbraw/zinc/60/31/80/946603180.db2.gz ZSHSBOGMLKQNEP-UHFFFAOYSA-N 0 0 364.401 3.871 20 5 FHBDRN Cc1c(Cc2noc(CSCc3ccccn3)n2)cccc1[N+](=O)[O-] ZINC000545779279 946604702 /nfs/dbraw/zinc/60/47/02/946604702.db2.gz JCUPJMNVBCOGKC-UHFFFAOYSA-N 0 0 356.407 3.705 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](c1ccccc1)C1(CO)CCCC1 ZINC001143517589 946606501 /nfs/dbraw/zinc/60/65/01/946606501.db2.gz VNVDLCBYDCQPMW-IBGZPJMESA-N 0 0 368.433 3.927 20 5 FHBDRN CSc1cccc(C(=O)N(C[C@H]2CCCO2)C2CCCC2)c1[N+](=O)[O-] ZINC000186590520 946607549 /nfs/dbraw/zinc/60/75/49/946607549.db2.gz WHLIZNXMTZDFRA-CQSZACIVSA-N 0 0 364.467 3.881 20 5 FHBDRN CSc1cccc(C(=O)NC[C@H](C)Oc2ccccc2C)c1[N+](=O)[O-] ZINC000186593621 946608394 /nfs/dbraw/zinc/60/83/94/946608394.db2.gz VPRAJXCPYVWOEA-ZDUSSCGKSA-N 0 0 360.435 3.822 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])s1)N1CCCCC[C@H]1[C@H]1CCCCC1=O ZINC000164514565 946608601 /nfs/dbraw/zinc/60/86/01/946608601.db2.gz XNCZAIMQOWWWLA-OLZOCXBDSA-N 0 0 350.440 3.800 20 5 FHBDRN C[C@@H](NC(=O)c1cc(Br)ccc1F)c1cccc([N+](=O)[O-])c1 ZINC000048383042 946634286 /nfs/dbraw/zinc/63/42/86/946634286.db2.gz CMBMPPALSBGZLW-SECBINFHSA-N 0 0 367.174 3.987 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CCCc3cc(N)ccc32)c1 ZINC000186596573 946636784 /nfs/dbraw/zinc/63/67/84/946636784.db2.gz KARAGKDCHZFKEH-MRXNPFEDSA-N 0 0 357.435 3.706 20 5 FHBDRN COc1ccc(CCCNC(=O)c2cccc(SC)c2[N+](=O)[O-])cc1 ZINC000186233266 946637587 /nfs/dbraw/zinc/63/75/87/946637587.db2.gz QZRPNIAKGALMFV-UHFFFAOYSA-N 0 0 360.435 3.688 20 5 FHBDRN CCc1c(C(=O)Nc2ccc([N+](=O)[O-])cc2)cnn1-c1ccccc1OC ZINC000186600207 946654312 /nfs/dbraw/zinc/65/43/12/946654312.db2.gz HYXHREIXBQIBFA-UHFFFAOYSA-N 0 0 366.377 3.604 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NCc1cn2cc(Cl)ccc2n1 ZINC000475562027 946655672 /nfs/dbraw/zinc/65/56/72/946655672.db2.gz SNKFLJOJDYUOCE-UHFFFAOYSA-N 0 0 373.800 3.834 20 5 FHBDRN Cc1nc(COC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)oc1C ZINC000109023037 946663535 /nfs/dbraw/zinc/66/35/35/946663535.db2.gz HSEPLVZZBCFNOT-UHFFFAOYSA-N 0 0 359.382 3.547 20 5 FHBDRN COC(=O)[C@H](C)NCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000475195343 946672001 /nfs/dbraw/zinc/67/20/01/946672001.db2.gz NDMBNULQQRQUHH-NSHDSACASA-N 0 0 364.785 3.692 20 5 FHBDRN COCCOc1cccc(NC(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)c1 ZINC000475566142 946681844 /nfs/dbraw/zinc/68/18/44/946681844.db2.gz NQSORWJOVWOQIZ-UHFFFAOYSA-N 0 0 359.382 3.881 20 5 FHBDRN O=[N+]([O-])c1ccc(C(F)(F)c2nc([C@H]3CCOC4(CCC4)C3)no2)cc1 ZINC000897105982 946692378 /nfs/dbraw/zinc/69/23/78/946692378.db2.gz DVHWKZXTSGVXON-NSHDSACASA-N 0 0 365.336 3.935 20 5 FHBDRN COCC[C@@H](Cc1ccco1)NC(=O)Nc1cc(C)c([N+](=O)[O-])cc1C ZINC000475569164 946694845 /nfs/dbraw/zinc/69/48/45/946694845.db2.gz GGDKPNBXJWJQFM-AWEZNQCLSA-N 0 0 361.398 3.574 20 5 FHBDRN COC(=O)[C@@H](NCc1cccc([N+](=O)[O-])c1)c1ccc(Cl)c(Cl)c1 ZINC000190539575 946698110 /nfs/dbraw/zinc/69/81/10/946698110.db2.gz WSTCPBSJWNNGLG-HNNXBMFYSA-N 0 0 369.204 3.906 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)N[C@H]1CCOC2(CCC2)C1 ZINC000475208851 946725772 /nfs/dbraw/zinc/72/57/72/946725772.db2.gz RVPOUCNMAQLLFQ-NSHDSACASA-N 0 0 373.331 3.837 20 5 FHBDRN CO[C@@H](C)CN(C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)C(C)C ZINC000475209881 946726217 /nfs/dbraw/zinc/72/62/17/946726217.db2.gz NSKGFPZVNUKXLC-JTQLQIEISA-N 0 0 363.336 3.891 20 5 FHBDRN Cc1cc(=O)n(Cc2nc(-c3ccccc3Cl)cs2)cc1[N+](=O)[O-] ZINC000186631679 946747137 /nfs/dbraw/zinc/74/71/37/946747137.db2.gz HGYGGCQMOCIZNB-UHFFFAOYSA-N 0 0 361.810 3.890 20 5 FHBDRN C[C@@H]1CCN(C(=O)CCNc2ccccc2[N+](=O)[O-])c2c(O)cccc21 ZINC000186278688 946749117 /nfs/dbraw/zinc/74/91/17/946749117.db2.gz UWJSYCODIIVLBY-CYBMUJFWSA-N 0 0 355.394 3.643 20 5 FHBDRN COc1cccc(CCCNC(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)c1 ZINC000475583903 946750890 /nfs/dbraw/zinc/75/08/90/946750890.db2.gz QWPDWOOLCGTZLK-UHFFFAOYSA-N 0 0 357.410 3.975 20 5 FHBDRN Cc1nn(CCC(=O)N[C@@H](c2ccccc2C)C(C)C)c(C)c1[N+](=O)[O-] ZINC000112190361 946758248 /nfs/dbraw/zinc/75/82/48/946758248.db2.gz USGSINRDKXXGOP-GOSISDBHSA-N 0 0 358.442 3.620 20 5 FHBDRN Cc1ccc(Br)c(C(=O)NCCc2ccc([N+](=O)[O-])cc2)c1 ZINC000150767761 946772410 /nfs/dbraw/zinc/77/24/10/946772410.db2.gz KSSUXUPXSALXMP-UHFFFAOYSA-N 0 0 363.211 3.638 20 5 FHBDRN CSc1cccc(C(=O)Nc2ccc(-c3cc[nH]n3)cc2)c1[N+](=O)[O-] ZINC000186299604 946796114 /nfs/dbraw/zinc/79/61/14/946796114.db2.gz SXBZTAZGNKEUIA-UHFFFAOYSA-N 0 0 354.391 3.959 20 5 FHBDRN COCc1cccc(CNc2ncc(Br)cc2[N+](=O)[O-])c1 ZINC000048552626 946821014 /nfs/dbraw/zinc/82/10/14/946821014.db2.gz XAJZOELZUISSCD-UHFFFAOYSA-N 0 0 352.188 3.511 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)N[C@H]1CCc2cc(F)ccc21 ZINC000184483202 946836902 /nfs/dbraw/zinc/83/69/02/946836902.db2.gz FZIOPBINRNCXID-INIZCTEOSA-N 0 0 363.776 3.874 20 5 FHBDRN O=C(CCc1cccc(F)c1F)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186306690 946840256 /nfs/dbraw/zinc/84/02/56/946840256.db2.gz PCBGWJVUWYRHIO-UHFFFAOYSA-N 0 0 354.740 3.775 20 5 FHBDRN O=C(C[C@@H]1OCCc2ccccc21)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186312214 946844866 /nfs/dbraw/zinc/84/48/66/946844866.db2.gz JLSJTXCMECUDPB-KRWDZBQOSA-N 0 0 360.797 3.569 20 5 FHBDRN CCOC(=O)[C@H](Cc1ccccc1)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000475598142 946845870 /nfs/dbraw/zinc/84/58/70/946845870.db2.gz ZMPDCAWIAMDFKE-KRWDZBQOSA-N 0 0 362.813 3.512 20 5 FHBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)NC(C)(C)c1cccc(Cl)c1 ZINC000610005964 946848013 /nfs/dbraw/zinc/84/80/13/946848013.db2.gz PBPQBGWBQDUDPK-UHFFFAOYSA-N 0 0 368.842 3.770 20 5 FHBDRN Cc1nc(NC(=O)COc2cc(Cl)cc(Cl)c2)ccc1[N+](=O)[O-] ZINC000475319929 946854253 /nfs/dbraw/zinc/85/42/53/946854253.db2.gz SZSGQDIQICOXKI-UHFFFAOYSA-N 0 0 356.165 3.623 20 5 FHBDRN COc1cc(C2(C(=O)Nc3ccc([N+](=O)[O-])c(C)n3)CCC2)ccc1C ZINC000475308507 946859437 /nfs/dbraw/zinc/85/94/37/946859437.db2.gz ANSQBBOOQVGEKC-UHFFFAOYSA-N 0 0 355.394 3.676 20 5 FHBDRN COc1cc(C(=O)Nc2ccc([N+](=O)[O-])c(C)n2)ccc1OCCC(C)C ZINC000475310301 946864377 /nfs/dbraw/zinc/86/43/77/946864377.db2.gz CIDNPHMAKXSINX-UHFFFAOYSA-N 0 0 373.409 3.984 20 5 FHBDRN C[C@@H]1CCN(C(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])CC1(F)F ZINC000427565866 946866076 /nfs/dbraw/zinc/86/60/76/946866076.db2.gz PKWNUHRGOHTNAW-SNVBAGLBSA-N 0 0 362.760 3.521 20 5 FHBDRN C[C@@]1(CNc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])C[C@H]1c1ccccc1 ZINC000549578735 946872425 /nfs/dbraw/zinc/87/24/25/946872425.db2.gz LRLUBJXANJTECT-YJBOKZPZSA-N 0 0 360.435 3.604 20 5 FHBDRN Cc1onc(-c2ccccn2)c1C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186317452 946878279 /nfs/dbraw/zinc/87/82/79/946878279.db2.gz FULGOLBQCRCDRK-UHFFFAOYSA-N 0 0 372.768 3.537 20 5 FHBDRN CC[C@H](CC(F)F)C(=O)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC000839310456 946881603 /nfs/dbraw/zinc/88/16/03/946881603.db2.gz NJNLCORPEDAAGI-SSDOTTSWSA-N 0 0 351.147 3.977 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)c1cnc(-c2ccncc2)s1 ZINC000186320779 946884178 /nfs/dbraw/zinc/88/41/78/946884178.db2.gz YXEDJFSFYNVIJS-UHFFFAOYSA-N 0 0 374.809 3.697 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1CNc1cc(OC)cc(-n2cccn2)c1 ZINC000475337686 946905509 /nfs/dbraw/zinc/90/55/09/946905509.db2.gz QGXGIHNKRTUATJ-UHFFFAOYSA-N 0 0 368.393 3.800 20 5 FHBDRN CCC[C@@H](NC(=O)C(=O)Nc1c(C)ccc([N+](=O)[O-])c1C)c1ccccc1 ZINC000184501722 946907744 /nfs/dbraw/zinc/90/77/44/946907744.db2.gz DRAQLBYZFBXZJQ-MRXNPFEDSA-N 0 0 369.421 3.808 20 5 FHBDRN O=C(Nc1ccncc1Br)c1cccc(Cl)c1[N+](=O)[O-] ZINC000147521896 946908795 /nfs/dbraw/zinc/90/87/95/946908795.db2.gz VLWPDNXNZNDGJX-UHFFFAOYSA-N 0 0 356.563 3.658 20 5 FHBDRN CCOc1cc(C(=O)N2C[C@H](C)CC(C)(C)C2)c([N+](=O)[O-])cc1OC ZINC000544323479 946908995 /nfs/dbraw/zinc/90/89/95/946908995.db2.gz SPOPYVXCXJCHPY-GFCCVEGCSA-N 0 0 350.415 3.510 20 5 FHBDRN O=C(CCC(=O)c1ccc(F)cc1)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186326118 946915160 /nfs/dbraw/zinc/91/51/60/946915160.db2.gz MWLKLWXLNKKYRX-UHFFFAOYSA-N 0 0 364.760 3.667 20 5 FHBDRN COc1ccc(CSCC(=O)NC/C=C/c2ccccc2)cc1[N+](=O)[O-] ZINC000112584341 946916223 /nfs/dbraw/zinc/91/62/23/946916223.db2.gz GGSUNGMPKSSQTH-VMPITWQZSA-N 0 0 372.446 3.666 20 5 FHBDRN C[C@@]1(CNc2cccc(S(C)(=O)=O)c2[N+](=O)[O-])C[C@H]1c1ccccc1 ZINC000549581134 946918825 /nfs/dbraw/zinc/91/88/25/946918825.db2.gz LNLCSHINQQPEEH-KSSFIOAISA-N 0 0 360.435 3.604 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)NCc1cccc(Br)c1 ZINC000087067035 946919603 /nfs/dbraw/zinc/91/96/03/946919603.db2.gz AOKBEWXVKRHHLQ-UHFFFAOYSA-N 0 0 363.211 3.606 20 5 FHBDRN C[C@H]1CCN(C(=O)c2c[nH]c3ccc([N+](=O)[O-])cc32)c2c(O)cccc21 ZINC000186328458 946923274 /nfs/dbraw/zinc/92/32/74/946923274.db2.gz MMZXTEJLRQQXMG-NSHDSACASA-N 0 0 351.362 3.936 20 5 FHBDRN Cc1nn(Cc2ccc(C(=O)N3CCCC(C)(C)C3)cc2)c(C)c1[N+](=O)[O-] ZINC000112684052 946929443 /nfs/dbraw/zinc/92/94/43/946929443.db2.gz KPPYZFGDJOXHGO-UHFFFAOYSA-N 0 0 370.453 3.719 20 5 FHBDRN CN(Cc1ccc(Cl)s1)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000067375069 946935154 /nfs/dbraw/zinc/93/51/54/946935154.db2.gz XXKPYWLGHCIONI-AWEZNQCLSA-N 0 0 365.842 3.547 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)Nc1cccc(OC[C@H]2CCCO2)c1 ZINC000087064749 946935182 /nfs/dbraw/zinc/93/51/82/946935182.db2.gz UWRJEXLCXMHLAF-LJQANCHMSA-N 0 0 370.405 3.724 20 5 FHBDRN C[C@@H](c1ccc(F)cc1F)N1CCN(Cc2csc([N+](=O)[O-])c2)CC1 ZINC000507747639 946936661 /nfs/dbraw/zinc/93/66/61/946936661.db2.gz MKFCSTBKYAMORE-LBPRGKRZSA-N 0 0 367.421 3.813 20 5 FHBDRN CCS[C@H]1CC[C@@H](N(C)C(=O)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000458890436 946942604 /nfs/dbraw/zinc/94/26/04/946942604.db2.gz PPHKTUYXQOWOIF-MAZHCROVSA-N 0 0 351.472 3.971 20 5 FHBDRN COc1ccc(Br)c(CNc2cccc(OC)c2[N+](=O)[O-])c1 ZINC000475360462 946944918 /nfs/dbraw/zinc/94/49/18/946944918.db2.gz JDDDQZUUMOJWQH-UHFFFAOYSA-N 0 0 367.199 3.987 20 5 FHBDRN Cc1cccc2c(CC(=O)NCc3ccc([N+](=O)[O-])cc3Cl)c[nH]c21 ZINC000186334929 946948536 /nfs/dbraw/zinc/94/85/36/946948536.db2.gz LKXCCQFTZJLJMV-UHFFFAOYSA-N 0 0 357.797 3.897 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)NCc1c(F)cccc1Cl ZINC000609784130 946950194 /nfs/dbraw/zinc/95/01/94/946950194.db2.gz AQRXIHWACLGOQE-UHFFFAOYSA-N 0 0 357.168 3.900 20 5 FHBDRN CC(C)Oc1cccc(CC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000186337245 946950489 /nfs/dbraw/zinc/95/04/89/946950489.db2.gz NTWLMRPCNGEZDV-UHFFFAOYSA-N 0 0 362.813 3.894 20 5 FHBDRN O=C(CCn1cnc(-c2cccc([N+](=O)[O-])c2)n1)Nc1ccc(Cl)cc1 ZINC000432249095 946950732 /nfs/dbraw/zinc/95/07/32/946950732.db2.gz BWDRBJTVYIAIAA-UHFFFAOYSA-N 0 0 371.784 3.536 20 5 FHBDRN O=C(NC[C@@H]1CCCO1)c1ccccc1Sc1ccccc1[N+](=O)[O-] ZINC000440436084 946955914 /nfs/dbraw/zinc/95/59/14/946955914.db2.gz FEUIJYQKRZVPAU-ZDUSSCGKSA-N 0 0 358.419 3.655 20 5 FHBDRN C[C@@H]1CC[C@H](NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)[C@H](C)C1 ZINC000112840200 946957878 /nfs/dbraw/zinc/95/78/78/946957878.db2.gz CWOJBTVWRQHPLR-INMHGKMJSA-N 0 0 359.470 3.752 20 5 FHBDRN COc1cc(C(=O)N2CCOc3c2cccc3C(C)(C)C)ccc1[N+](=O)[O-] ZINC000444495970 946960910 /nfs/dbraw/zinc/96/09/10/946960910.db2.gz SMMHGSJWLBKYRG-UHFFFAOYSA-N 0 0 370.405 3.940 20 5 FHBDRN CC(C)N(CC1CCC1)C(=O)COc1ccc([N+](=O)[O-])c2cccnc12 ZINC000444530905 946978337 /nfs/dbraw/zinc/97/83/37/946978337.db2.gz FXMZELVNGMBLJY-UHFFFAOYSA-N 0 0 357.410 3.559 20 5 FHBDRN Nc1c(C(=O)N2C[C@@H](c3ccccc3)c3ccccc32)cccc1[N+](=O)[O-] ZINC000444510946 946981969 /nfs/dbraw/zinc/98/19/69/946981969.db2.gz SBAMOOWTSCEARL-KRWDZBQOSA-N 0 0 359.385 3.969 20 5 FHBDRN COc1ccc(CNC(=O)N[C@@H]2C[C@H](C)CC[C@@H]2C(C)C)cc1[N+](=O)[O-] ZINC000523204775 946989059 /nfs/dbraw/zinc/98/90/59/946989059.db2.gz XUWDWTZDLIXSBI-FVQBIDKESA-N 0 0 363.458 3.863 20 5 FHBDRN C[C@H](CNC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)c1ccncc1 ZINC000613862195 947005920 /nfs/dbraw/zinc/00/59/20/947005920.db2.gz JKXZWXJIJVRZDX-SNVBAGLBSA-N 0 0 368.315 3.934 20 5 FHBDRN COc1cccc(N2CCC[C@@H](Nc3cccc(OC)c3[N+](=O)[O-])C2)c1 ZINC000475392427 947010049 /nfs/dbraw/zinc/01/00/49/947010049.db2.gz RQUBLQURADGKSI-CQSZACIVSA-N 0 0 357.410 3.693 20 5 FHBDRN O=C1CCCN1c1cccc(-c2noc(-c3ccc([N+](=O)[O-])s3)n2)c1 ZINC000546277959 947045947 /nfs/dbraw/zinc/04/59/47/947045947.db2.gz HINQBQHBCXFNAZ-UHFFFAOYSA-N 0 0 356.363 3.500 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N1C[C@H](C)O[C@@H](c2ccc(F)cc2)C1 ZINC000152027828 947051982 /nfs/dbraw/zinc/05/19/82/947051982.db2.gz CUGNSSBSYRNORL-SCLBCKFNSA-N 0 0 358.369 3.645 20 5 FHBDRN CNc1c(C(=O)N(C)Cc2ccc(F)c(Cl)c2)cccc1[N+](=O)[O-] ZINC000432277172 947053051 /nfs/dbraw/zinc/05/30/51/947053051.db2.gz NECOMGYMRMRFJZ-UHFFFAOYSA-N 0 0 351.765 3.701 20 5 FHBDRN CC(C)(C)c1ccc(CC(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000444634714 947064316 /nfs/dbraw/zinc/06/43/16/947064316.db2.gz BROUTZVZXCSTHY-UHFFFAOYSA-N 0 0 366.421 3.628 20 5 FHBDRN O=C(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1csc2ccccc12 ZINC000444633629 947064569 /nfs/dbraw/zinc/06/45/69/947064569.db2.gz UQROIWDCNVYFTM-UHFFFAOYSA-N 0 0 352.375 3.616 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)c1cc2cnn(C(C)C)c2nc1C ZINC000024699359 947071069 /nfs/dbraw/zinc/07/10/69/947071069.db2.gz PPZFNZQELDETMH-UHFFFAOYSA-N 0 0 353.382 3.790 20 5 FHBDRN CCCOc1cc(NC(=O)[C@@H]2CCSC2)c([N+](=O)[O-])cc1OCCC ZINC000475428461 947072700 /nfs/dbraw/zinc/07/27/00/947072700.db2.gz KSCCMPWZMHBYTK-GFCCVEGCSA-N 0 0 368.455 3.864 20 5 FHBDRN COC(=O)c1cc(NC(=O)CCCc2ccc(C)cc2)cc([N+](=O)[O-])c1 ZINC000609838990 947077401 /nfs/dbraw/zinc/07/74/01/947077401.db2.gz VGIDJAAMIPFKNY-UHFFFAOYSA-N 0 0 356.378 3.651 20 5 FHBDRN O=[N+]([O-])c1nn(Cc2csc(C3CCCC3)n2)cc1Br ZINC000049494058 947077841 /nfs/dbraw/zinc/07/78/41/947077841.db2.gz PWBNCVMTWDOBDV-UHFFFAOYSA-N 0 0 357.233 3.716 20 5 FHBDRN C[C@@H](CSc1ccccc1)C(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444638177 947080648 /nfs/dbraw/zinc/08/06/48/947080648.db2.gz UUSLLPTUJHAJHM-LBPRGKRZSA-N 0 0 370.434 3.516 20 5 FHBDRN C[C@@H]1C[C@@H](CC(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)CC(C)(C)C1 ZINC000444640285 947082691 /nfs/dbraw/zinc/08/26/91/947082691.db2.gz REKAJWVLSXPIAI-OLZOCXBDSA-N 0 0 358.442 3.940 20 5 FHBDRN C[C@@H]1CN(Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C[C@H](c2ccc(F)cc2)O1 ZINC000444641332 947084683 /nfs/dbraw/zinc/08/46/83/947084683.db2.gz DQCSZMDSJKNIHX-KZULUSFZSA-N 0 0 370.384 3.572 20 5 FHBDRN C[C@H]1CN(Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C[C@@H](c2ccc(F)cc2)O1 ZINC000444641333 947085025 /nfs/dbraw/zinc/08/50/25/947085025.db2.gz DQCSZMDSJKNIHX-SGTLLEGYSA-N 0 0 370.384 3.572 20 5 FHBDRN Cc1c2cccc(C)c2oc1C(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444643977 947086177 /nfs/dbraw/zinc/08/61/77/947086177.db2.gz LTRDYRRAOCGJAC-UHFFFAOYSA-N 0 0 364.361 3.764 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)NCc1ccc(OC2CCCCC2)nc1 ZINC000523027051 947088092 /nfs/dbraw/zinc/08/80/92/947088092.db2.gz CNSLKZPVXCVMJG-UHFFFAOYSA-N 0 0 369.421 3.940 20 5 FHBDRN CCCN(C(=O)CCc1cc(OC)ccc1OC)c1cccc([N+](=O)[O-])c1 ZINC000441429268 947089636 /nfs/dbraw/zinc/08/96/36/947089636.db2.gz OFPFWTHFYAMAER-UHFFFAOYSA-N 0 0 372.421 3.988 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]c(CN(CCCO)Cc3cccc(Cl)c3)nc2c1 ZINC000444665392 947092202 /nfs/dbraw/zinc/09/22/02/947092202.db2.gz OVKSNMSECITQPE-UHFFFAOYSA-N 0 0 374.828 3.509 20 5 FHBDRN CCC[C@H](C)c1cc(=NC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)[nH][nH]1 ZINC000444671863 947096232 /nfs/dbraw/zinc/09/62/32/947096232.db2.gz IZHXVLIHRZDQHT-ZDUSSCGKSA-N 0 0 374.444 3.982 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]c(CNC3(c4ccc(F)cc4F)CCC3)nc2c1 ZINC000444675978 947100058 /nfs/dbraw/zinc/10/00/58/947100058.db2.gz OXBZDHVARCRGBX-UHFFFAOYSA-N 0 0 358.348 3.918 20 5 FHBDRN C[C@@H](NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1cccc(OC(F)F)c1 ZINC000444683159 947109118 /nfs/dbraw/zinc/10/91/18/947109118.db2.gz DLRIXZQUTYMYQA-SNVBAGLBSA-N 0 0 362.336 3.923 20 5 FHBDRN Cc1c(Cl)cc(S(=O)(=O)N2CC3(CCC3)C[C@H]2C)cc1[N+](=O)[O-] ZINC000432291719 947120572 /nfs/dbraw/zinc/12/05/72/947120572.db2.gz NBCRGANSRQXUKU-SNVBAGLBSA-N 0 0 358.847 3.510 20 5 FHBDRN Cc1cc(C)cc(C[N@@H+](C)[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)c1 ZINC000444696647 947121536 /nfs/dbraw/zinc/12/15/36/947121536.db2.gz WEFBKVNULVPZLY-INIZCTEOSA-N 0 0 355.438 3.979 20 5 FHBDRN CC(C)(C)OC1CC(CCNC(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000432290662 947125317 /nfs/dbraw/zinc/12/53/17/947125317.db2.gz DGVNOJDPOYGEHY-UHFFFAOYSA-N 0 0 354.834 3.962 20 5 FHBDRN Cc1nn(CC(=O)N2CCC[C@H]2c2ccc(C(C)(C)C)cc2)cc1[N+](=O)[O-] ZINC000181833054 947133106 /nfs/dbraw/zinc/13/31/06/947133106.db2.gz MIHNILGCYDCIKI-KRWDZBQOSA-N 0 0 370.453 3.761 20 5 FHBDRN C[C@@H]1CCN(C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)c2ccccc21 ZINC000049733112 947136939 /nfs/dbraw/zinc/13/69/39/947136939.db2.gz RABUFOGTYDECIY-CQSZACIVSA-N 0 0 362.389 3.935 20 5 FHBDRN O=C([C@@H]1COc2ccc(Cl)cc2C1)N1CCCc2ccc([N+](=O)[O-])cc21 ZINC000609859495 947138402 /nfs/dbraw/zinc/13/84/02/947138402.db2.gz CDCKWELYZLROHS-AWEZNQCLSA-N 0 0 372.808 3.779 20 5 FHBDRN CCOC(=O)[C@@H]1CCN(Cc2ccc([N+](=O)[O-])c(OC)c2)c2ccccc21 ZINC000444712758 947142485 /nfs/dbraw/zinc/14/24/85/947142485.db2.gz WZTYCGDDSLLMSI-MRXNPFEDSA-N 0 0 370.405 3.660 20 5 FHBDRN Cc1c(Br)c(N2CC(C)(C)O[C@@H]3CCC[C@H]32)ncc1[N+](=O)[O-] ZINC000440533163 947144453 /nfs/dbraw/zinc/14/44/53/947144453.db2.gz GXEAODJCFMSBDW-ZYHUDNBSSA-N 0 0 370.247 3.597 20 5 FHBDRN CC(C)Oc1ccccc1NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000049758958 947147353 /nfs/dbraw/zinc/14/73/53/947147353.db2.gz RLQGJHQOLPJJOF-UHFFFAOYSA-N 0 0 366.377 3.820 20 5 FHBDRN CCOC(=O)[C@@H](NCc1ccc([N+](=O)[O-])cc1F)c1cccc(C)c1C ZINC000428375520 947148111 /nfs/dbraw/zinc/14/81/11/947148111.db2.gz CSNKMHULYCYBCB-SFHVURJKSA-N 0 0 360.385 3.745 20 5 FHBDRN Cc1cccc(CCNC(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000523339579 947155090 /nfs/dbraw/zinc/15/50/90/947155090.db2.gz DBJBLGWDZIJATO-CYBMUJFWSA-N 0 0 362.813 3.683 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)c1ccnc(N2CC[C@@H](C)C2)c1 ZINC000444725367 947169107 /nfs/dbraw/zinc/16/91/07/947169107.db2.gz GNGFQTVQKGIOEW-GFCCVEGCSA-N 0 0 354.410 3.705 20 5 FHBDRN Cc1ccc(-c2nc(CCNC(=O)c3ccc(C)c([N+](=O)[O-])c3)co2)cc1 ZINC000523374282 947171914 /nfs/dbraw/zinc/17/19/14/947171914.db2.gz MDZVZOOFNZYGEC-UHFFFAOYSA-N 0 0 365.389 3.839 20 5 FHBDRN Cc1ccc(F)c(CN(C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)c1 ZINC000444741655 947177335 /nfs/dbraw/zinc/17/73/35/947177335.db2.gz VMSKPIRJPYOXCC-UHFFFAOYSA-N 0 0 356.357 3.724 20 5 FHBDRN CCCCNC(=O)[C@@H](C)Sc1ccc(Br)cc1[N+](=O)[O-] ZINC000088501195 947185611 /nfs/dbraw/zinc/18/56/11/947185611.db2.gz NNIVEWGLCNHHMM-SECBINFHSA-N 0 0 361.261 3.754 20 5 FHBDRN O=C(OCc1ccccc1[N+](=O)[O-])c1cc(Br)cnc1Cl ZINC000725939556 947208706 /nfs/dbraw/zinc/20/87/06/947208706.db2.gz GOJXXAGZXDSLSU-UHFFFAOYSA-N 0 0 371.574 3.763 20 5 FHBDRN Cn1cc([N+](=O)[O-])cc1C(=O)NCc1ccc(Oc2ccccc2)cc1 ZINC000523412193 947221636 /nfs/dbraw/zinc/22/16/36/947221636.db2.gz OJMZLIXCMNIAAR-UHFFFAOYSA-N 0 0 351.362 3.656 20 5 FHBDRN O=C(Nc1ccc(OC(F)F)c2cccnc12)c1ccc([N+](=O)[O-])cc1 ZINC000186402570 947227186 /nfs/dbraw/zinc/22/71/86/947227186.db2.gz MJIGWEZKILTHMS-UHFFFAOYSA-N 0 0 359.288 3.997 20 5 FHBDRN O=C(N[C@@H]1CCc2ccccc21)c1sc(Br)cc1[N+](=O)[O-] ZINC000444824122 947237559 /nfs/dbraw/zinc/23/75/59/947237559.db2.gz HSVYSFWKNCGULI-SNVBAGLBSA-N 0 0 367.224 3.836 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(Cl)c1N[C@H]1CCN(Cc2ccccc2)C1=O ZINC000444828392 947244203 /nfs/dbraw/zinc/24/42/03/947244203.db2.gz VJODEDONVQSCLA-INIZCTEOSA-N 0 0 359.813 3.770 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H]1CCc2c1cccc2O ZINC000439883096 947247978 /nfs/dbraw/zinc/24/79/78/947247978.db2.gz MVVLFOABIYOIKP-AWEZNQCLSA-N 0 0 357.366 3.508 20 5 FHBDRN Cc1ccccc1[C@@H]1C[C@@H](C)N(S(=O)(=O)c2ccc([N+](=O)[O-])c(C)c2)C1 ZINC000523419080 947249508 /nfs/dbraw/zinc/24/95/08/947249508.db2.gz RBVJJTZGLNFDRH-HZPDHXFCSA-N 0 0 374.462 3.778 20 5 FHBDRN C[C@H]1c2c(F)cccc2CCN1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000523449449 947256102 /nfs/dbraw/zinc/25/61/02/947256102.db2.gz JMSQYBXXSDKWDS-LBPRGKRZSA-N 0 0 358.369 3.720 20 5 FHBDRN COCc1ccccc1CNC(=O)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000444848563 947259352 /nfs/dbraw/zinc/25/93/52/947259352.db2.gz LUHSZQLRKTYEFG-UHFFFAOYSA-N 0 0 372.424 3.758 20 5 FHBDRN Cc1cc(NC[C@H](O)c2cccc(Br)c2)ccc1[N+](=O)[O-] ZINC000799971785 947262218 /nfs/dbraw/zinc/26/22/18/947262218.db2.gz WKSDJTGLQBHBKC-HNNXBMFYSA-N 0 0 351.200 3.811 20 5 FHBDRN O=C(c1cccc2c(=O)c3ccccc3[nH]c12)N1CCc2sccc2C1 ZINC000444830880 947262910 /nfs/dbraw/zinc/26/29/10/947262910.db2.gz WPVINGBSHSHANR-UHFFFAOYSA-N 0 0 360.438 3.941 20 5 FHBDRN CN(Cc1cc(C(C)(C)C)n[nH]1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000444831872 947263799 /nfs/dbraw/zinc/26/37/99/947263799.db2.gz AJYNXSJWJQTCFC-UHFFFAOYSA-N 0 0 365.821 3.933 20 5 FHBDRN CCOc1cccc(CCNC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)c1 ZINC000121299624 947273177 /nfs/dbraw/zinc/27/31/77/947273177.db2.gz NQIRLRDKRVZIIL-CQSZACIVSA-N 0 0 374.462 3.833 20 5 FHBDRN O=C(Cc1cc2ccccc2o1)O[C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000759929142 947276412 /nfs/dbraw/zinc/27/64/12/947276412.db2.gz FFXJZKYYCWWGHQ-NVXWUHKLSA-N 0 0 369.377 3.807 20 5 FHBDRN O=C(NC1CC1)c1ccc(N2CCC[C@]3(CC=CCC3)C2)c([N+](=O)[O-])c1 ZINC000301307453 947277151 /nfs/dbraw/zinc/27/71/51/947277151.db2.gz ZJAUNPLFFLFYLP-HXUWFJFHSA-N 0 0 355.438 3.814 20 5 FHBDRN C[C@@H](NC(=O)NCc1cccc([N+](=O)[O-])c1)c1cccc(N2CCCC2)c1 ZINC000087069100 947296714 /nfs/dbraw/zinc/29/67/14/947296714.db2.gz ZYZBJXHIONMJGG-OAHLLOKOSA-N 0 0 368.437 3.755 20 5 FHBDRN CC(C)(C(=O)Nc1ccc2c(c1)NC(=O)CS2)c1ccc([N+](=O)[O-])cc1 ZINC000523485578 947303877 /nfs/dbraw/zinc/30/38/77/947303877.db2.gz ISPDKAYQTYJPLP-UHFFFAOYSA-N 0 0 371.418 3.555 20 5 FHBDRN C[C@@H](Cc1ccsc1)NC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000523493212 947309991 /nfs/dbraw/zinc/30/99/91/947309991.db2.gz NLTZIYPMWITESK-VIFPVBQESA-N 0 0 369.240 3.780 20 5 FHBDRN Cc1cccc(O[C@@H](C)C(=O)NCCCNc2ccc(C)cc2[N+](=O)[O-])c1 ZINC000523512058 947324668 /nfs/dbraw/zinc/32/46/68/947324668.db2.gz FSHRYCOORJIPNC-INIZCTEOSA-N 0 0 371.437 3.597 20 5 FHBDRN CN(CC1(c2ccccc2)CC1)c1nnc(-c2ccc([N+](=O)[O-])cc2)n1C ZINC000508511926 947330669 /nfs/dbraw/zinc/33/06/69/947330669.db2.gz FPODVZIBSNGNOC-UHFFFAOYSA-N 0 0 363.421 3.558 20 5 FHBDRN COCc1nc2cc(NC(=O)Nc3ccc([N+](=O)[O-])cc3OC)ccc2o1 ZINC000444892689 947332287 /nfs/dbraw/zinc/33/22/87/947332287.db2.gz CQTCDYICPVVTCN-UHFFFAOYSA-N 0 0 372.337 3.535 20 5 FHBDRN Cc1c(NC(=O)[C@@H](C)SCCC(=O)OC(C)(C)C)cccc1[N+](=O)[O-] ZINC000440590768 947334922 /nfs/dbraw/zinc/33/49/22/947334922.db2.gz LQXOWFZDUMDFEJ-GFCCVEGCSA-N 0 0 368.455 3.695 20 5 FHBDRN COC(=O)CCOc1ccc(Nc2c(F)cc([N+](=O)[O-])cc2F)cc1 ZINC000440590381 947335435 /nfs/dbraw/zinc/33/54/35/947335435.db2.gz UEAVAXWEQOLJEY-UHFFFAOYSA-N 0 0 352.293 3.559 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N1CCC[C@H](C(F)(F)F)[C@H]1C ZINC000444897055 947335824 /nfs/dbraw/zinc/33/58/24/947335824.db2.gz FANLJJTXRKTIGP-KOLCDFICSA-N 0 0 361.320 3.798 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NCCCO[C@H](C)c1ccccc1 ZINC000444920097 947338364 /nfs/dbraw/zinc/33/83/64/947338364.db2.gz KRXJUDXVZFTPEP-CQSZACIVSA-N 0 0 373.409 3.893 20 5 FHBDRN C[C@H](CNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1)N(C)c1ccccc1 ZINC000523528822 947339602 /nfs/dbraw/zinc/33/96/02/947339602.db2.gz RDWKVZCDVJOCOX-OAHLLOKOSA-N 0 0 355.438 3.514 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)Nc1ccc(OCC(F)F)cc1 ZINC000444924475 947342406 /nfs/dbraw/zinc/34/24/06/947342406.db2.gz SIWVLGVSIIXTTJ-UHFFFAOYSA-N 0 0 367.308 3.891 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cnn([C@@H](C)C2CC2)c1 ZINC000186433006 947343472 /nfs/dbraw/zinc/34/34/72/947343472.db2.gz RITHKNWTXYIZKE-NWDGAFQWSA-N 0 0 360.439 3.882 20 5 FHBDRN Cc1ccc(NC(=O)c2ccc(N(C)Cc3ccon3)c([N+](=O)[O-])c2)cc1 ZINC000523536612 947346478 /nfs/dbraw/zinc/34/64/78/947346478.db2.gz DXXYXGXBTQBBII-UHFFFAOYSA-N 0 0 366.377 3.780 20 5 FHBDRN O=C(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)Nc1cc(F)cc(Cl)c1 ZINC000444913938 947350985 /nfs/dbraw/zinc/35/09/85/947350985.db2.gz VCGLQNZIMFEPTI-UHFFFAOYSA-N 0 0 363.736 3.585 20 5 FHBDRN Cn1ccnc1[C@@H](Nc1c(F)cc([N+](=O)[O-])cc1F)c1ccccc1F ZINC000440597151 947353609 /nfs/dbraw/zinc/35/36/09/947353609.db2.gz KMFHWMWWDHXEJU-HNNXBMFYSA-N 0 0 362.311 3.947 20 5 FHBDRN O=C(CC1CCOCC1)N(Cc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000440602860 947354513 /nfs/dbraw/zinc/35/45/13/947354513.db2.gz XCZCGHJJAAOQJC-UHFFFAOYSA-N 0 0 354.406 3.945 20 5 FHBDRN CC[C@H](COC)NC(=O)c1ccccc1Sc1ccccc1[N+](=O)[O-] ZINC000440611155 947360738 /nfs/dbraw/zinc/36/07/38/947360738.db2.gz NNKAPHCIARFTHX-CYBMUJFWSA-N 0 0 360.435 3.901 20 5 FHBDRN CSc1cccc(NC(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)c1C ZINC000444939685 947362039 /nfs/dbraw/zinc/36/20/39/947362039.db2.gz DQBIUGYTTHGUMZ-UHFFFAOYSA-N 0 0 371.422 3.823 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N(CCc1cccc(F)c1)C1CC1 ZINC000444930596 947371556 /nfs/dbraw/zinc/37/15/56/947371556.db2.gz MYDDMLLNJXDXKE-UHFFFAOYSA-N 0 0 373.384 3.982 20 5 FHBDRN O=C(CCCOc1cccc(F)c1)Nc1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000440617376 947376013 /nfs/dbraw/zinc/37/60/13/947376013.db2.gz LAODPWPSCQAWAL-UHFFFAOYSA-N 0 0 369.352 3.502 20 5 FHBDRN O=C(c1ccc(N2CCCC2)c([N+](=O)[O-])c1)N1CCc2ccc(F)cc2C1 ZINC000121516675 947379361 /nfs/dbraw/zinc/37/93/61/947379361.db2.gz IMQIHXNUYXHRAN-UHFFFAOYSA-N 0 0 369.396 3.533 20 5 FHBDRN Cc1ccc(NCCCNC(=O)N[C@H](C)CCc2ccco2)c([N+](=O)[O-])c1 ZINC000523570259 947379881 /nfs/dbraw/zinc/37/98/81/947379881.db2.gz PAZSHWSHLGHTGB-OAHLLOKOSA-N 0 0 374.441 3.619 20 5 FHBDRN O=C(CCCc1cccs1)O[C@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1 ZINC000759929759 947395600 /nfs/dbraw/zinc/39/56/00/947395600.db2.gz HYWFVJVKYBISDZ-GJZGRUSLSA-N 0 0 363.439 3.903 20 5 FHBDRN CCCN(C(=O)c1cc(-c2ccccn2)no1)c1cccc([N+](=O)[O-])c1 ZINC000441441889 947416805 /nfs/dbraw/zinc/41/68/05/947416805.db2.gz BXEBCEYMNKZARY-UHFFFAOYSA-N 0 0 352.350 3.702 20 5 FHBDRN COc1c(C(=O)OCCCOc2ccccc2Cl)cccc1[N+](=O)[O-] ZINC000796656434 947418974 /nfs/dbraw/zinc/41/89/74/947418974.db2.gz BPXAXQBSJCVUOB-UHFFFAOYSA-N 0 0 365.769 3.883 20 5 FHBDRN CCCOc1cccc(C(=O)Nc2ccc3cc([N+](=O)[O-])ccc3n2)c1 ZINC000440629184 947427784 /nfs/dbraw/zinc/42/77/84/947427784.db2.gz ZUDWHOCCVBQTIU-UHFFFAOYSA-N 0 0 351.362 3.606 20 5 FHBDRN C[C@H](CCc1cccn1C)NC(=O)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000445007455 947429579 /nfs/dbraw/zinc/42/95/79/947429579.db2.gz YLXLFFYPSCPWPU-OAHLLOKOSA-N 0 0 373.456 3.771 20 5 FHBDRN O=C(Nc1ccc2cc([N+](=O)[O-])ccc2n1)[C@@H]1CCC[C@H](C(F)(F)F)C1 ZINC000440629007 947429615 /nfs/dbraw/zinc/42/96/15/947429615.db2.gz XORPUGMPNLJDFE-NEPJUHHUSA-N 0 0 367.327 3.872 20 5 FHBDRN COc1cc(NC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])ccc1F ZINC000445011441 947434129 /nfs/dbraw/zinc/43/41/29/947434129.db2.gz PMJTYCWUYRVRMB-UHFFFAOYSA-N 0 0 367.764 3.760 20 5 FHBDRN Cc1ccc(CNC(=O)COc2ccccc2[N+](=O)[O-])c(OC(C)(C)C)c1 ZINC000440640261 947445759 /nfs/dbraw/zinc/44/57/59/947445759.db2.gz SFSPJPWQQYRHEI-UHFFFAOYSA-N 0 0 372.421 3.776 20 5 FHBDRN CCCC[C@H]1CCC[C@H]1NC(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000445028031 947450245 /nfs/dbraw/zinc/45/02/45/947450245.db2.gz GUYUKJQFELPZHX-GXTWGEPZSA-N 0 0 359.430 3.629 20 5 FHBDRN COc1c(C(=O)NCCOc2cccc(C(C)(C)C)c2)cccc1[N+](=O)[O-] ZINC001126202096 947453815 /nfs/dbraw/zinc/45/38/15/947453815.db2.gz HJHFFAQRHLNPFV-UHFFFAOYSA-N 0 0 372.421 3.710 20 5 FHBDRN CC[C@H]1CN(C(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)c2ccccc2O1 ZINC000188243632 947469291 /nfs/dbraw/zinc/46/92/91/947469291.db2.gz NARWABHFBFNDEX-AWEZNQCLSA-N 0 0 356.378 3.730 20 5 FHBDRN O=[N+]([O-])c1ccc(NCc2ccncc2OCC(F)F)c2ccncc21 ZINC000440634230 947469292 /nfs/dbraw/zinc/46/92/92/947469292.db2.gz GBCMOSKVJQQFAM-UHFFFAOYSA-N 0 0 360.320 3.794 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(C(=O)N2CCS[C@@H](C)[C@H]2c2ccccc2)n1 ZINC001126203423 947476117 /nfs/dbraw/zinc/47/61/17/947476117.db2.gz LGCSWNLBOPIYQQ-GUYCJALGSA-N 0 0 357.435 3.617 20 5 FHBDRN CC[C@@H](CNC(=O)c1csc([N+](=O)[O-])c1)Oc1cccc(Cl)c1 ZINC000440649541 947477118 /nfs/dbraw/zinc/47/71/18/947477118.db2.gz SGOPFIHWOQXQIS-LBPRGKRZSA-N 0 0 354.815 3.897 20 5 FHBDRN C[C@@H](NC(=O)c1ccccc1Sc1ccccc1[N+](=O)[O-])[C@@H]1CCOC1 ZINC000440645988 947479640 /nfs/dbraw/zinc/47/96/40/947479640.db2.gz MMJSTFDUFFVAKK-ZIAGYGMSSA-N 0 0 372.446 3.901 20 5 FHBDRN O=C(CCCOc1ccccc1F)Nc1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000440648609 947480549 /nfs/dbraw/zinc/48/05/49/947480549.db2.gz QHZZRYJXFQIPSI-UHFFFAOYSA-N 0 0 369.352 3.502 20 5 FHBDRN COCc1nc(CNc2ccc([N+](=O)[O-])c(C)n2)c(-c2ccccc2)s1 ZINC000440656397 947518125 /nfs/dbraw/zinc/51/81/25/947518125.db2.gz STQJMWLTLBSBLH-UHFFFAOYSA-N 0 0 370.434 3.602 20 5 FHBDRN Cc1ncc2c(n1)CC[C@H](Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C2 ZINC000523695265 947524000 /nfs/dbraw/zinc/52/40/00/947524000.db2.gz BFLPWAJEGGJHTP-LBPRGKRZSA-N 0 0 352.316 3.681 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)Nc1ccn(-c2ccccc2)n1 ZINC000093913525 947524887 /nfs/dbraw/zinc/52/48/87/947524887.db2.gz VZNQZGFLUINOIA-UHFFFAOYSA-N 0 0 350.378 3.958 20 5 FHBDRN CCc1cc(N2CC[C@@H](OC)C[C@@H]2C)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000440669942 947533525 /nfs/dbraw/zinc/53/35/25/947533525.db2.gz FUVDEQWIJHVOBH-SUMWQHHRSA-N 0 0 356.426 3.618 20 5 FHBDRN Cc1cccc([C@H](C)NS(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])c1C ZINC000523734406 947554624 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FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(NCc2ccc(OC(F)F)c(F)c2)c1 ZINC000549604850 947902018 /nfs/dbraw/zinc/90/20/18/947902018.db2.gz JGAOQKVJVCDNEA-UHFFFAOYSA-N 0 0 370.283 3.734 20 5 FHBDRN C[C@H](c1nccs1)N1CCN(Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000184616365 947902095 /nfs/dbraw/zinc/90/20/95/947902095.db2.gz ZXLMXBQHNCNPFJ-GFCCVEGCSA-N 0 0 366.874 3.584 20 5 FHBDRN COc1ccc2c(c1)[C@@H](NC(=O)C(C)(C)c1ccccc1[N+](=O)[O-])CCO2 ZINC000500443197 947939321 /nfs/dbraw/zinc/93/93/21/947939321.db2.gz VEKQUAREKPHPEG-INIZCTEOSA-N 0 0 370.405 3.521 20 5 FHBDRN Cc1cc(Cl)ccc1O[C@@H](C)C(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000105267768 947964034 /nfs/dbraw/zinc/96/40/34/947964034.db2.gz VHPNGFGSLDFSGJ-LBPRGKRZSA-N 0 0 360.797 3.913 20 5 FHBDRN O=[N+]([O-])c1cccc(Cl)c1N1CCN(c2ccc(Cl)cn2)CC1 ZINC000432317650 947973120 /nfs/dbraw/zinc/97/31/20/947973120.db2.gz LIIHKKDZGHRZON-UHFFFAOYSA-N 0 0 353.209 3.623 20 5 FHBDRN O=C(/C=C/c1ccc([N+](=O)[O-])cc1)N1CCO[C@H](c2ccccc2Cl)C1 ZINC000728875988 947989520 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FHBDRN CCOc1cc(-c2noc(/C=C\c3ccc([N+](=O)[O-])cc3)n2)ccc1O ZINC000445430720 948792455 /nfs/dbraw/zinc/79/24/55/948792455.db2.gz KOTIWJIYWRZEIR-YHYXMXQVSA-N 0 0 353.334 3.920 20 5 FHBDRN COC(=O)c1cc(NC(=O)CCc2ccc(Cl)s2)cc([N+](=O)[O-])c1 ZINC000524043049 948805517 /nfs/dbraw/zinc/80/55/17/948805517.db2.gz KQAOQGVLNXYSST-UHFFFAOYSA-N 0 0 368.798 3.668 20 5 FHBDRN COc1cc(-c2nc(-c3c[nH]c4ccccc43)no2)cc([N+](=O)[O-])c1OC ZINC000445449952 948810148 /nfs/dbraw/zinc/81/01/48/948810148.db2.gz YFYVUQAFFQXEAA-UHFFFAOYSA-N 0 0 366.333 3.810 20 5 FHBDRN Cc1ccccc1[C@@H]1CN(C(=O)NCc2cccc([N+](=O)[O-])c2)[C@@H](C)CO1 ZINC000073900259 948815888 /nfs/dbraw/zinc/81/58/88/948815888.db2.gz TYEQBXBNIHFUAB-KXBFYZLASA-N 0 0 369.421 3.575 20 5 FHBDRN Cc1cccc(N(C)S(=O)(=O)c2ccc([N+](=O)[O-])c3cccnc32)c1C ZINC000184816943 948817793 /nfs/dbraw/zinc/81/77/93/948817793.db2.gz PSEUYHPEYGVQPS-UHFFFAOYSA-N 0 0 371.418 3.585 20 5 FHBDRN CCc1ccc(C(=O)[C@H](C)OC(=O)C=Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000107701805 948819595 /nfs/dbraw/zinc/81/95/95/948819595.db2.gz SVOHQSGPICBZFL-MQJVFOOVSA-N 0 0 353.374 3.985 20 5 FHBDRN COc1cc(CCNC(=O)Nc2cc(C)cc(C)c2)c([N+](=O)[O-])cc1OC ZINC000009959756 204387579 /nfs/dbraw/zinc/38/75/79/204387579.db2.gz KPJNKWBRJFKJJT-UHFFFAOYSA-N 0 0 373.409 3.593 20 5 FHBDRN CC(C)c1ccccc1NC(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000014909445 204590911 /nfs/dbraw/zinc/59/09/11/204590911.db2.gz VWUDHYOETIYMQX-UHFFFAOYSA-N 0 0 373.434 3.548 20 5 FHBDRN CC(C)[C@@H](Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000015142442 204605322 /nfs/dbraw/zinc/60/53/22/204605322.db2.gz JQXFFZAUAIDSDK-QGZVFWFLSA-N 0 0 366.414 3.947 20 5 FHBDRN Cc1ccsc1CNC(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000025721165 204842829 /nfs/dbraw/zinc/84/28/29/204842829.db2.gz KHWUJSDWWUOFDB-UHFFFAOYSA-N 0 0 362.454 3.841 20 5 FHBDRN Cc1cc(Cl)ccc1NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000045762717 205124616 /nfs/dbraw/zinc/12/46/16/205124616.db2.gz XWAWVHDMSFZQFH-UHFFFAOYSA-N 0 0 356.769 3.995 20 5 FHBDRN COc1ccc(NC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)cc1Cl ZINC000046762394 205138637 /nfs/dbraw/zinc/13/86/37/205138637.db2.gz SAEPIPCMCGDWDH-UHFFFAOYSA-N 0 0 372.768 3.695 20 5 FHBDRN Cc1ccc(C(=O)Nc2cccc(C)c2C(=O)N2CCCC2)cc1[N+](=O)[O-] ZINC000046909513 205140393 /nfs/dbraw/zinc/14/03/93/205140393.db2.gz RUBMQWLGXVLQSD-UHFFFAOYSA-N 0 0 367.405 3.700 20 5 FHBDRN O=C(c1occc1COc1ccccc1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000054758783 205203130 /nfs/dbraw/zinc/20/31/30/205203130.db2.gz MMWVAHVRSYNAFA-UHFFFAOYSA-N 0 0 364.357 3.970 20 5 FHBDRN Cc1c(NC(=O)c2cnn(-c3cccc(Cl)c3)c2)cccc1[N+](=O)[O-] ZINC000055013158 205205398 /nfs/dbraw/zinc/20/53/98/205205398.db2.gz VGMHWTOFJYFCLC-UHFFFAOYSA-N 0 0 356.769 3.995 20 5 FHBDRN NC(=O)c1ccc(CN2CCC[C@H]2c2cccc(Cl)c2)c([N+](=O)[O-])c1 ZINC000053157938 205190936 /nfs/dbraw/zinc/19/09/36/205190936.db2.gz FZXICKDDCQBNNA-INIZCTEOSA-N 0 0 359.813 3.684 20 5 FHBDRN COc1ccc2[nH]cc(C3CCN(C(=O)c4ccc([N+](=O)[O-])o4)CC3)c2c1 ZINC000056321873 205229488 /nfs/dbraw/zinc/22/94/88/205229488.db2.gz WVCYKPGRFMAQEQ-UHFFFAOYSA-N 0 0 369.377 3.698 20 5 FHBDRN Cc1cccc(NC(=O)CN(C)c2ccc([N+](=O)[O-])c3cnccc32)c1C ZINC000068838465 205245038 /nfs/dbraw/zinc/24/50/38/205245038.db2.gz AOTHXZLDRSGFDQ-UHFFFAOYSA-N 0 0 364.405 3.835 20 5 FHBDRN CCN(CC)C(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2C)cc1 ZINC000067025128 205367729 /nfs/dbraw/zinc/36/77/29/205367729.db2.gz BLELWCACSVNUAP-UHFFFAOYSA-N 0 0 355.394 3.638 20 5 FHBDRN Cc1ccc([C@@H](NS(=O)(=O)c2cccc([N+](=O)[O-])c2C)C2CC2)cc1 ZINC000105809367 206010685 /nfs/dbraw/zinc/01/06/85/206010685.db2.gz XWUAXLWGNWMFSG-GOSISDBHSA-N 0 0 360.435 3.641 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000104797707 206001889 /nfs/dbraw/zinc/00/18/89/206001889.db2.gz PIDLOFHJFMYMOZ-UHFFFAOYSA-N 0 0 367.770 3.887 20 5 FHBDRN Cn1ccc2c1cccc2NC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000110491525 206075365 /nfs/dbraw/zinc/07/53/65/206075365.db2.gz JECWQQMZWZOCGM-UHFFFAOYSA-N 0 0 361.361 3.525 20 5 FHBDRN O=Cc1cc([N+](=O)[O-])ccc1OCc1ccc(Br)cc1F ZINC000007438759 206244922 /nfs/dbraw/zinc/24/49/22/206244922.db2.gz GIFSEYSCGAHVRI-UHFFFAOYSA-N 0 0 354.131 3.888 20 5 FHBDRN O=C(COc1cc(F)ccc1[N+](=O)[O-])c1ccc(Br)s1 ZINC000007758078 206245345 /nfs/dbraw/zinc/24/53/45/206245345.db2.gz GQKMDERNIJRNLG-UHFFFAOYSA-N 0 0 360.160 3.820 20 5 FHBDRN Cc1noc([C@H]2CCCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])C2)n1 ZINC000054676160 132303192 /nfs/dbraw/zinc/30/31/92/132303192.db2.gz MVTQAPDCOPZYOG-JTQLQIEISA-N 0 0 356.304 3.689 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCC(COc3ccccc3)CC2)c([N+](=O)[O-])c1 ZINC000065586943 132305764 /nfs/dbraw/zinc/30/57/64/132305764.db2.gz MGAXSGWRJUFKPK-UHFFFAOYSA-N 0 0 357.366 3.798 20 5 FHBDRN Cc1cc(C(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)c(C)n1C(C)C ZINC000015382076 132373685 /nfs/dbraw/zinc/37/36/85/132373685.db2.gz BNDZVFYWWQQASG-UHFFFAOYSA-N 0 0 370.453 3.556 20 5 FHBDRN O=C(c1cc2ccccc2s1)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000018078240 132885564 /nfs/dbraw/zinc/88/55/64/132885564.db2.gz FGFLUXQQFUJRNG-UHFFFAOYSA-N 0 0 367.430 3.772 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N(C)c1ccc2ccccc2n1 ZINC000481367029 567823829 /nfs/dbraw/zinc/82/38/29/567823829.db2.gz GNZQXEBFGHICPZ-UHFFFAOYSA-N 0 0 371.418 3.585 20 5 FHBDRN CC(=O)Nc1ccc(C(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000452863177 567829830 /nfs/dbraw/zinc/82/98/30/567829830.db2.gz DPYBYRLKOMJSGD-QGZVFWFLSA-N 0 0 367.405 3.573 20 5 FHBDRN O=C(c1ccnn1C1CCCC1)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452866043 567831562 /nfs/dbraw/zinc/83/15/62/567831562.db2.gz XHNFMPQBUHZOJD-MRXNPFEDSA-N 0 0 368.437 3.926 20 5 FHBDRN C[C@@H](Oc1ccccc1F)C(=O)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452866904 567836259 /nfs/dbraw/zinc/83/62/59/567836259.db2.gz HACPXLMPIYRWBR-GDBMZVCRSA-N 0 0 372.396 3.907 20 5 FHBDRN CO[C@H]1CCN(C(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)C[C@H]1C ZINC000452863223 567838848 /nfs/dbraw/zinc/83/88/48/567838848.db2.gz DVWRARPUNSRONS-KUHUBIRLSA-N 0 0 369.421 3.835 20 5 FHBDRN O=C(NCc1ccco1)c1ccccc1NCCc1ccc([N+](=O)[O-])cc1 ZINC000541802145 567856986 /nfs/dbraw/zinc/85/69/86/567856986.db2.gz WVGYMGJQNDMTFZ-UHFFFAOYSA-N 0 0 365.389 3.772 20 5 FHBDRN CCS[C@@H]1CC[C@H](N(C)S(=O)(=O)c2c(C)cc([N+](=O)[O-])cc2C)C1 ZINC000481379301 567863286 /nfs/dbraw/zinc/86/32/86/567863286.db2.gz VYNFVDAJZPTVIF-DZGCQCFKSA-N 0 0 372.512 3.506 20 5 FHBDRN CCS[C@@H]1CC[C@@H](N(C)S(=O)(=O)c2c(C)cc([N+](=O)[O-])cc2C)C1 ZINC000481379310 567863507 /nfs/dbraw/zinc/86/35/07/567863507.db2.gz VYNFVDAJZPTVIF-UKRRQHHQSA-N 0 0 372.512 3.506 20 5 FHBDRN CCS[C@H]1CC[C@H](N(C)S(=O)(=O)c2c(C)cc([N+](=O)[O-])cc2C)C1 ZINC000481379313 567863816 /nfs/dbraw/zinc/86/38/16/567863816.db2.gz VYNFVDAJZPTVIF-ZFWWWQNUSA-N 0 0 372.512 3.506 20 5 FHBDRN CCCO[C@@H]1CCCN(c2nnc(-c3ccc([N+](=O)[O-])cc3)n2CC)CC1 ZINC000290940123 567864401 /nfs/dbraw/zinc/86/44/01/567864401.db2.gz FNAMULODNXHDIU-QGZVFWFLSA-N 0 0 373.457 3.659 20 5 FHBDRN O=[N+]([O-])c1ccc(CCNc2cc(F)ccc2OC[C@@H]2CCCO2)cc1 ZINC000541801189 567867562 /nfs/dbraw/zinc/86/75/62/567867562.db2.gz YOVMWRBIVYMFBF-KRWDZBQOSA-N 0 0 360.385 3.946 20 5 FHBDRN COc1ccc(CC(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cc1F ZINC000452876818 567874350 /nfs/dbraw/zinc/87/43/50/567874350.db2.gz LZUDZKLNRQSQAA-MRXNPFEDSA-N 0 0 372.396 3.691 20 5 FHBDRN CCCN1CCN(C(=O)Cc2ccccc2[N+](=O)[O-])c2ccc(F)cc21 ZINC000481389934 567882219 /nfs/dbraw/zinc/88/22/19/567882219.db2.gz XLZAYTDCJZYJHK-UHFFFAOYSA-N 0 0 357.385 3.540 20 5 FHBDRN CN(C)c1ccc(C(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000452889791 567885808 /nfs/dbraw/zinc/88/58/08/567885808.db2.gz UDELEOJCSGYFRB-KRWDZBQOSA-N 0 0 353.422 3.681 20 5 FHBDRN Nc1ccc2c(c1)CC[C@H]2NC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000568110008 567888317 /nfs/dbraw/zinc/88/83/17/567888317.db2.gz CLTLTQBPVYYQRP-LJQANCHMSA-N 0 0 366.421 3.539 20 5 FHBDRN COc1ccccc1CC(=O)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452888909 567896955 /nfs/dbraw/zinc/89/69/55/567896955.db2.gz SWBYETDTZZYFFD-QGZVFWFLSA-N 0 0 354.406 3.552 20 5 FHBDRN Cc1ccn2cc(C(=O)N3CCC[C@H](c4ccc([N+](=O)[O-])cc4)C3)nc2c1 ZINC000452892442 567903888 /nfs/dbraw/zinc/90/38/88/567903888.db2.gz WCYUWXCHQILKSN-INIZCTEOSA-N 0 0 364.405 3.571 20 5 FHBDRN C[C@@H](OCc1ccccc1)C(=O)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452892405 567904363 /nfs/dbraw/zinc/90/43/63/567904363.db2.gz VZIRPTFVTAQSJZ-APWZRJJASA-N 0 0 368.433 3.906 20 5 FHBDRN COCc1ccccc1C(=O)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452892368 567904776 /nfs/dbraw/zinc/90/47/76/567904776.db2.gz VZCAGQKKNCMYLA-INIZCTEOSA-N 0 0 354.406 3.761 20 5 FHBDRN O=C(CCC(=O)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1)c1ccccc1 ZINC000452894406 567909694 /nfs/dbraw/zinc/90/96/94/567909694.db2.gz XVIUROQYKRZQSS-GOSISDBHSA-N 0 0 366.417 3.964 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)N(C)[C@@H]2CCc3ccccc32)c1 ZINC000541821487 567910738 /nfs/dbraw/zinc/91/07/38/567910738.db2.gz PIODXAFNNWCZKY-MRXNPFEDSA-N 0 0 360.435 3.520 20 5 FHBDRN Cc1cc(CNC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)no1 ZINC000517907786 567912768 /nfs/dbraw/zinc/91/27/68/567912768.db2.gz SVMUJDVCNFHYSM-UHFFFAOYSA-N 0 0 369.402 3.972 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])N1CC2(CCC2)c2ccccc21 ZINC000481426440 567925226 /nfs/dbraw/zinc/92/52/26/567925226.db2.gz UPKDBOKKLREQCT-UHFFFAOYSA-N 0 0 352.390 3.832 20 5 FHBDRN Cc1c(CNC(=O)CSc2ccc(F)c(F)c2)cccc1[N+](=O)[O-] ZINC000481465916 567967745 /nfs/dbraw/zinc/96/77/45/567967745.db2.gz NZDFCDNSVNWHFC-UHFFFAOYSA-N 0 0 352.362 3.590 20 5 FHBDRN Cc1c(CNC(=O)c2cc(C(C)C)n(C(C)(C)C)n2)cccc1[N+](=O)[O-] ZINC000481483032 567972254 /nfs/dbraw/zinc/97/22/54/567972254.db2.gz YEYNTZZGJMSFKK-UHFFFAOYSA-N 0 0 358.442 3.908 20 5 FHBDRN O=C(Nc1ccc2[nH]c(-c3ccc(F)cc3)nc2c1)c1cc([N+](=O)[O-])c[nH]1 ZINC000481483033 567972384 /nfs/dbraw/zinc/97/23/84/567972384.db2.gz RJBLPZZSFXGCOI-UHFFFAOYSA-N 0 0 365.324 3.858 20 5 FHBDRN Cc1nc(-c2ccccc2)ncc1C(=O)NCc1cccc([N+](=O)[O-])c1C ZINC000481480352 567974690 /nfs/dbraw/zinc/97/46/90/567974690.db2.gz MLPNXLDVEIDGCB-UHFFFAOYSA-N 0 0 362.389 3.599 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)N2CCCSc3cc(Cl)ccc32)n1 ZINC000602406282 567976473 /nfs/dbraw/zinc/97/64/73/567976473.db2.gz MVVPWCXQYMBHSO-UHFFFAOYSA-N 0 0 366.830 3.607 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)Nc1ccccc1NCC(F)(F)F ZINC000063497926 567979773 /nfs/dbraw/zinc/97/97/73/567979773.db2.gz AQMPLSDGFRFIFS-UHFFFAOYSA-N 0 0 353.300 3.750 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)NCc1c(F)cccc1N1CCCC1 ZINC000481480867 567980509 /nfs/dbraw/zinc/98/05/09/567980509.db2.gz FSWGTTLVCBZKLH-UHFFFAOYSA-N 0 0 372.400 3.964 20 5 FHBDRN C[C@H](CNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F)CC(F)(F)F ZINC000412647761 567981717 /nfs/dbraw/zinc/98/17/17/567981717.db2.gz AJGFSMMIZKBURA-VIFPVBQESA-N 0 0 350.312 3.716 20 5 FHBDRN CC(C)(CCc1noc(-c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)n1)[N+](=O)[O-] ZINC000291036029 567984948 /nfs/dbraw/zinc/98/49/48/567984948.db2.gz FSHOLTSVIWEIMS-UHFFFAOYSA-N 0 0 374.275 3.652 20 5 FHBDRN COc1cc(CCC(=O)NCc2cccc([N+](=O)[O-])c2C)ccc1Cl ZINC000481492375 567992049 /nfs/dbraw/zinc/99/20/49/567992049.db2.gz NMDYBAIXYXUFKD-UHFFFAOYSA-N 0 0 362.813 3.814 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)c(N2CCC(O)(C(F)(F)F)CC2)c(Cl)c1 ZINC000128569313 568010092 /nfs/dbraw/zinc/01/00/92/568010092.db2.gz VKVCOGGSQUEJSD-UHFFFAOYSA-N 0 0 359.131 3.795 20 5 FHBDRN CC[C@@H](c1ccccc1OC)N(C)C(=O)COc1ccc([N+](=O)[O-])c(C)c1 ZINC000568314040 568021083 /nfs/dbraw/zinc/02/10/83/568021083.db2.gz LROIHUBRUONNHS-KRWDZBQOSA-N 0 0 372.421 3.900 20 5 FHBDRN C[C@H](O)C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000159229196 568023743 /nfs/dbraw/zinc/02/37/43/568023743.db2.gz FWRUFHYSKAEMCP-JSGCOSHPSA-N 0 0 362.813 3.533 20 5 FHBDRN Cc1ccc(C[C@@H]2CCCN(C(=O)c3c(N)cccc3[N+](=O)[O-])C2)cc1 ZINC000568430020 568030549 /nfs/dbraw/zinc/03/05/49/568030549.db2.gz UZQXCEOBPDVCRC-INIZCTEOSA-N 0 0 353.422 3.580 20 5 FHBDRN CSc1cccc(NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)n1 ZINC000568432114 568031200 /nfs/dbraw/zinc/03/12/00/568031200.db2.gz ITKCIELHYGMWKX-UHFFFAOYSA-N 0 0 357.313 3.983 20 5 FHBDRN COc1cc(CN(c2ccc([N+](=O)[O-])nc2)C2CC2)ccc1OC(F)F ZINC000568525238 568047035 /nfs/dbraw/zinc/04/70/35/568047035.db2.gz JRGPBCFRCOUBAY-UHFFFAOYSA-N 0 0 365.336 3.769 20 5 FHBDRN C[C@@H](Sc1ncccc1[N+](=O)[O-])C(=O)Nc1ccc(F)cc1Cl ZINC000065693203 568055221 /nfs/dbraw/zinc/05/52/21/568055221.db2.gz VYQQTMJOAMXBRR-MRVPVSSYSA-N 0 0 355.778 3.902 20 5 FHBDRN Cn1cnc([N+](=O)[O-])c1N1CCC[C@@H]1c1ccc(Br)c(F)c1 ZINC000568581108 568063278 /nfs/dbraw/zinc/06/32/78/568063278.db2.gz JODPUOPWSIOKNG-GFCCVEGCSA-N 0 0 369.194 3.571 20 5 FHBDRN Cn1cnc([N+](=O)[O-])c1N1CCC[C@H]1c1ccc(Br)c(F)c1 ZINC000568581111 568063303 /nfs/dbraw/zinc/06/33/03/568063303.db2.gz JODPUOPWSIOKNG-LBPRGKRZSA-N 0 0 369.194 3.571 20 5 FHBDRN CCn1c(C)nc([N+](=O)[O-])c1N1CCC(c2noc3cc(F)ccc32)CC1 ZINC000291147002 568063997 /nfs/dbraw/zinc/06/39/97/568063997.db2.gz ORGASJNXZCMSQT-UHFFFAOYSA-N 0 0 373.388 3.784 20 5 FHBDRN CCOc1cc(NC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)ccc1C ZINC000066525300 568064559 /nfs/dbraw/zinc/06/45/59/568064559.db2.gz IRIDMQICESDSRS-UHFFFAOYSA-N 0 0 366.377 3.740 20 5 FHBDRN O=C(NCc1ccc(C2CC2)cc1)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000481638239 568075281 /nfs/dbraw/zinc/07/52/81/568075281.db2.gz FVIWDXQTMZHGLX-UHFFFAOYSA-N 0 0 362.389 3.588 20 5 FHBDRN O=C(Nc1cccc(Cl)c1)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000051559826 568080005 /nfs/dbraw/zinc/08/00/05/568080005.db2.gz UFCABGGNSFGZFK-UHFFFAOYSA-N 0 0 360.801 3.602 20 5 FHBDRN CC[C@@H](C)n1c(SCc2cn(C)nc2[N+](=O)[O-])nnc1-c1ccccc1 ZINC000603316691 568085229 /nfs/dbraw/zinc/08/52/29/568085229.db2.gz GSXMNDZPFWHAFJ-GFCCVEGCSA-N 0 0 372.454 3.850 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1cc(CCOC)ccn1 ZINC000568612292 568087585 /nfs/dbraw/zinc/08/75/85/568087585.db2.gz DREHRJIQFVYJDX-UHFFFAOYSA-N 0 0 361.423 3.543 20 5 FHBDRN Cn1nc([N+](=O)[O-])cc1C(=O)Nc1ccccc1Nc1c(F)cccc1F ZINC000481689385 568089066 /nfs/dbraw/zinc/08/90/66/568089066.db2.gz SQOXXBDBEJMHOT-UHFFFAOYSA-N 0 0 373.319 3.602 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N(c1ccccc1C)C(C)C ZINC000068920959 568090005 /nfs/dbraw/zinc/09/00/05/568090005.db2.gz SZKVXGPEIAGGEB-UHFFFAOYSA-N 0 0 364.423 3.516 20 5 FHBDRN COc1cc(OC[C@@H](O)Cc2ccc(C(F)(F)F)cc2)ccc1[N+](=O)[O-] ZINC000481708054 568090746 /nfs/dbraw/zinc/09/07/46/568090746.db2.gz RHRRIJJQVYLSBI-ZDUSSCGKSA-N 0 0 371.311 3.605 20 5 FHBDRN CC1(C)C[C@@H](NC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)C(C)(C)O1 ZINC000481704074 568090752 /nfs/dbraw/zinc/09/07/52/568090752.db2.gz WDXLOMHRBGXUFU-GFCCVEGCSA-N 0 0 373.356 3.664 20 5 FHBDRN COc1cc(OC[C@H](O)Cc2ccc(C(F)(F)F)cc2)ccc1[N+](=O)[O-] ZINC000481708053 568091052 /nfs/dbraw/zinc/09/10/52/568091052.db2.gz RHRRIJJQVYLSBI-CYBMUJFWSA-N 0 0 371.311 3.605 20 5 FHBDRN COCCCCc1cccnc1NC(=O)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000291259124 568092929 /nfs/dbraw/zinc/09/29/29/568092929.db2.gz MVDXQPJUUQUETG-UHFFFAOYSA-N 0 0 363.801 3.865 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)Nc1ccc(OC2CCCC2)cc1 ZINC000603487730 568106534 /nfs/dbraw/zinc/10/65/34/568106534.db2.gz XQNJXJCXRALFBQ-UHFFFAOYSA-N 0 0 356.378 3.934 20 5 FHBDRN CC(C)Oc1nc(N[C@H]2CCO[C@@H](c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000568647622 568106912 /nfs/dbraw/zinc/10/69/12/568106912.db2.gz USVGLXQOAIKQFC-DOTOQJQBSA-N 0 0 357.410 3.531 20 5 FHBDRN O=c1[nH]c(N[C@H]2C[C@H](c3ccccc3Cl)C2)nc2ccc([N+](=O)[O-])cc12 ZINC000568657480 568112843 /nfs/dbraw/zinc/11/28/43/568112843.db2.gz UROIKCABSBUINV-XYPYZODXSA-N 0 0 370.796 3.677 20 5 FHBDRN CN(CCCOc1ccccc1)C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000056991117 568115001 /nfs/dbraw/zinc/11/50/01/568115001.db2.gz KSZJZKXXSAGIMT-UHFFFAOYSA-N 0 0 353.378 3.617 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1-c1noc(-c2cc3nccnc3cc2F)n1 ZINC000568679954 568120310 /nfs/dbraw/zinc/12/03/10/568120310.db2.gz AVZQYVDZBCIUGA-UHFFFAOYSA-N 0 0 351.297 3.703 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(O[C@@H]2CCOC2)cc1 ZINC000291359669 568123669 /nfs/dbraw/zinc/12/36/69/568123669.db2.gz BFMSKVGXNBAHCH-QGZVFWFLSA-N 0 0 356.378 3.577 20 5 FHBDRN C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1c(F)c(F)cc(F)c1F ZINC000481786640 568125850 /nfs/dbraw/zinc/12/58/50/568125850.db2.gz YUJZPYMEKQTYKL-SSDOTTSWSA-N 0 0 354.259 3.743 20 5 FHBDRN O=C(N[C@@H]1CCOC2(CCC2)C1)c1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000291365864 568126779 /nfs/dbraw/zinc/12/67/79/568126779.db2.gz PYBULDKYUKRIIW-SNVBAGLBSA-N 0 0 359.209 3.733 20 5 FHBDRN COc1c(-c2nc(-c3ccccc3OC(F)F)no2)cccc1[N+](=O)[O-] ZINC000568694107 568127142 /nfs/dbraw/zinc/12/71/42/568127142.db2.gz VPXCVPRSYUIDRF-UHFFFAOYSA-N 0 0 363.276 3.922 20 5 FHBDRN CCOc1ccc(NC(=O)COc2c(F)cccc2Cl)c([N+](=O)[O-])c1 ZINC000159312027 568129372 /nfs/dbraw/zinc/12/93/72/568129372.db2.gz INROLSUCGDZIAO-UHFFFAOYSA-N 0 0 368.748 3.804 20 5 FHBDRN Cc1noc(C)c1C[C@H](C)NC(=O)c1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000291402502 568136827 /nfs/dbraw/zinc/13/68/27/568136827.db2.gz DRZCTZHFVREHOT-ZETCQYMHSA-N 0 0 372.208 3.867 20 5 FHBDRN CCC(=O)Nc1cccc(CNC(=O)Nc2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000603809364 568143028 /nfs/dbraw/zinc/14/30/28/568143028.db2.gz REAWMSZEGPIXOL-UHFFFAOYSA-N 0 0 356.382 3.573 20 5 FHBDRN COc1ccc([C@H](NC(=O)COc2cc([N+](=O)[O-])ccc2C)C(C)C)cc1 ZINC000603725943 568143210 /nfs/dbraw/zinc/14/32/10/568143210.db2.gz OBRZAKVGUVTFLO-HXUWFJFHSA-N 0 0 372.421 3.804 20 5 FHBDRN O=C(Nc1ccc(CC[NH+]2CCCCC2)cc1)c1ccc([O-])c([N+](=O)[O-])c1 ZINC000436633801 568158090 /nfs/dbraw/zinc/15/80/90/568158090.db2.gz MKJJODBNRLWQKK-UHFFFAOYSA-N 0 0 369.421 3.581 20 5 FHBDRN CC(C)(C)n1cnc(NCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)n1 ZINC000463250861 568160293 /nfs/dbraw/zinc/16/02/93/568160293.db2.gz RMYJUELCKXCZJO-UHFFFAOYSA-N 0 0 357.439 3.704 20 5 FHBDRN Cc1ccc(-n2ncc(NC(=O)c3ccc([N+](=O)[O-])n3C)c2C(C)C)cc1 ZINC000481866512 568164908 /nfs/dbraw/zinc/16/49/08/568164908.db2.gz NUTYATQURHQSSX-UHFFFAOYSA-N 0 0 367.409 3.803 20 5 FHBDRN O=C(NC[C@H]1CCC2(CCCCC2)O1)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000481863215 568166548 /nfs/dbraw/zinc/16/65/48/568166548.db2.gz RAJJPDJYMVRXQM-CQSZACIVSA-N 0 0 357.410 3.688 20 5 FHBDRN COCCOc1cccc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)c1 ZINC000603972755 568188709 /nfs/dbraw/zinc/18/87/09/568188709.db2.gz JQXUZAGLVYQBRL-UHFFFAOYSA-N 0 0 356.334 3.619 20 5 FHBDRN Cc1cccc([C@H]2CCCN2S(=O)(=O)c2c(C)cccc2[N+](=O)[O-])c1 ZINC000604042479 568203251 /nfs/dbraw/zinc/20/32/51/568203251.db2.gz CRBGWNXMKDSPKV-MRXNPFEDSA-N 0 0 360.435 3.737 20 5 FHBDRN Cc1ccc(NC(=O)c2ccc(N3CCO[C@@H](C)[C@@H]3C)c([N+](=O)[O-])c2)cc1 ZINC000481980947 568213316 /nfs/dbraw/zinc/21/33/16/568213316.db2.gz ZDFLKFUYNHUMBC-GJZGRUSLSA-N 0 0 369.421 3.769 20 5 FHBDRN COc1cc(OC)c(NC(=O)Cc2cccc([N+](=O)[O-])c2C)cc1Cl ZINC000159379708 568215729 /nfs/dbraw/zinc/21/57/29/568215729.db2.gz PBSQOLMMAJGYBP-UHFFFAOYSA-N 0 0 364.785 3.755 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N(C)[C@H]1CCCC[C@H]1C(F)(F)F ZINC000291596466 568220828 /nfs/dbraw/zinc/22/08/28/568220828.db2.gz FUOSIOODCPUJCV-OLZOCXBDSA-N 0 0 360.332 3.797 20 5 FHBDRN C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1c[nH]c2cc([N+](=O)[O-])ccc21 ZINC000482021628 568228614 /nfs/dbraw/zinc/22/86/14/568228614.db2.gz NOMVZCIQPJSQST-ZANVPECISA-N 0 0 355.316 3.879 20 5 FHBDRN COc1ccc2c(c1NC(=O)c1cc3cccc([N+](=O)[O-])c3[nH]1)CCC2 ZINC000482028309 568232585 /nfs/dbraw/zinc/23/25/85/568232585.db2.gz FVDKHTRRYKUPSH-UHFFFAOYSA-N 0 0 351.362 3.826 20 5 FHBDRN CC1(C)CN(C(=O)CCOc2ccccc2[N+](=O)[O-])CC[C@@H]1C(F)(F)F ZINC000482028816 568232608 /nfs/dbraw/zinc/23/26/08/568232608.db2.gz APTHQUMCBIQEBZ-AWEZNQCLSA-N 0 0 374.359 3.801 20 5 FHBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1c2ccccc2C[C@H]1C ZINC000007470942 568234748 /nfs/dbraw/zinc/23/47/48/568234748.db2.gz IVRVZHFDYIERPY-VXGBXAGGSA-N 0 0 360.797 3.993 20 5 FHBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1c2ccccc2C[C@H]1C ZINC000007470944 568234755 /nfs/dbraw/zinc/23/47/55/568234755.db2.gz IVRVZHFDYIERPY-NEPJUHHUSA-N 0 0 360.797 3.993 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(N[C@H](CO)c2cccc(Br)c2)c1 ZINC000482035054 568235085 /nfs/dbraw/zinc/23/50/85/568235085.db2.gz LQENPMSAXBCQTE-CQSZACIVSA-N 0 0 351.200 3.811 20 5 FHBDRN C[C@@H]1C[C@@H](c2ccccc2)N(C(=O)NCCc2cccc([N+](=O)[O-])c2)C1 ZINC000568851524 568236426 /nfs/dbraw/zinc/23/64/26/568236426.db2.gz VMFPGCQGTFKBSQ-BEFAXECRSA-N 0 0 353.422 3.930 20 5 FHBDRN O=C(Nc1ccc(N2CCCC2=O)cc1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000007639787 568249122 /nfs/dbraw/zinc/24/91/22/568249122.db2.gz KOFRNZWWSIUQHW-UHFFFAOYSA-N 0 0 359.769 3.627 20 5 FHBDRN CCS[C@@H]1CCCC[C@@H]1NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000541927813 568250176 /nfs/dbraw/zinc/25/01/76/568250176.db2.gz NONGCDKUKIPDFE-SMDDNHRTSA-N 0 0 374.409 3.990 20 5 FHBDRN O=C(Nc1ccncc1[N+](=O)[O-])N1CCCC[C@H]1CCCc1ccccc1 ZINC000541924515 568252755 /nfs/dbraw/zinc/25/27/55/568252755.db2.gz UJXJEKZASTYMAG-KRWDZBQOSA-N 0 0 368.437 3.821 20 5 FHBDRN C[C@@H](Cc1ccccc1)c1nc(CCNc2ccccc2[N+](=O)[O-])no1 ZINC000568932211 568253510 /nfs/dbraw/zinc/25/35/10/568253510.db2.gz ZIASEOPTKIMZAL-AWEZNQCLSA-N 0 0 352.394 3.979 20 5 FHBDRN O=C(N[C@]1(C(F)(F)F)CCc2ccccc21)c1csc([N+](=O)[O-])c1 ZINC000541939601 568258273 /nfs/dbraw/zinc/25/82/73/568258273.db2.gz TUNAUOPFUZMKNR-CQSZACIVSA-N 0 0 356.325 3.790 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)N2CC[C@@]3(CC[C@@H](C)C3)C2)cc1SC ZINC000541937144 568259060 /nfs/dbraw/zinc/25/90/60/568259060.db2.gz JWYNBDFPAJYTBE-KZULUSFZSA-N 0 0 364.467 3.978 20 5 FHBDRN Cn1nc(C2CC2)nc1COc1ccc(-c2ccccc2)cc1[N+](=O)[O-] ZINC000568983648 568260981 /nfs/dbraw/zinc/26/09/81/568260981.db2.gz ALEXTAKHJYCVQI-UHFFFAOYSA-N 0 0 350.378 3.847 20 5 FHBDRN CCOC(=O)c1ccnc(N2C[C@H](c3ccc(F)cc3)C[C@@H]2C)c1[N+](=O)[O-] ZINC000150846931 568263522 /nfs/dbraw/zinc/26/35/22/568263522.db2.gz KJJGVIFUQWRIJQ-GXTWGEPZSA-N 0 0 373.384 3.688 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)Nc2cccc(C(C)=O)c2)cc1SC ZINC000482128881 568268973 /nfs/dbraw/zinc/26/89/73/568268973.db2.gz YLBLPMPAWFAPRV-UHFFFAOYSA-N 0 0 360.391 3.780 20 5 FHBDRN Cc1cccc([C@H](C)CNC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)c1 ZINC000482109352 568275528 /nfs/dbraw/zinc/27/55/28/568275528.db2.gz XXQKORLFHYEJOO-OAHLLOKOSA-N 0 0 364.405 3.622 20 5 FHBDRN COc1cc(Cl)c(NC(=O)c2cccc(OC)c2[N+](=O)[O-])cc1C ZINC000569036185 568277179 /nfs/dbraw/zinc/27/71/79/568277179.db2.gz URZHWIKVPFGMKP-UHFFFAOYSA-N 0 0 350.758 3.826 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CCOC3(CCCC3)C2)c1 ZINC000159411413 568277588 /nfs/dbraw/zinc/27/75/88/568277588.db2.gz URPXSEUXNRSYGW-LBPRGKRZSA-N 0 0 350.440 3.538 20 5 FHBDRN O=C(NCC(F)(F)C(F)F)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000482146669 568285317 /nfs/dbraw/zinc/28/53/17/568285317.db2.gz VZJGNRFAVLHXCT-UHFFFAOYSA-N 0 0 371.290 3.969 20 5 FHBDRN COc1ccc(-c2nc(-c3ccc(C)c([N+](=O)[O-])c3)no2)c(C)c1OC ZINC000569050091 568289649 /nfs/dbraw/zinc/28/96/49/568289649.db2.gz PKOFUBFEFLCQIM-UHFFFAOYSA-N 0 0 355.350 3.946 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)c1ccc(C(F)(F)F)cc1O ZINC000436674069 568291023 /nfs/dbraw/zinc/29/10/23/568291023.db2.gz GSZVMNWRHDMXQC-UHFFFAOYSA-N 0 0 368.311 3.634 20 5 FHBDRN COc1ccc(CN2CCO[C@H](c3ccc(F)c(C)c3)C2)cc1[N+](=O)[O-] ZINC000128763826 568296037 /nfs/dbraw/zinc/29/60/37/568296037.db2.gz RCIZNFHNTOPGHG-IBGZPJMESA-N 0 0 360.385 3.624 20 5 FHBDRN CC(C)(O)CCNC(=O)c1cc([N+](=O)[O-])ccc1SCC1CCCC1 ZINC000482162780 568297906 /nfs/dbraw/zinc/29/79/06/568297906.db2.gz JDXOQSUUMHZDEO-UHFFFAOYSA-N 0 0 366.483 3.768 20 5 FHBDRN COc1cc(Br)ccc1OCCOc1ccccc1[N+](=O)[O-] ZINC000569164543 568298504 /nfs/dbraw/zinc/29/85/04/568298504.db2.gz HLLCTAFPFOLDRD-UHFFFAOYSA-N 0 0 368.183 3.824 20 5 FHBDRN O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)N1CCc2cc(Cl)ccc2C1 ZINC000569168690 568299311 /nfs/dbraw/zinc/29/93/11/568299311.db2.gz WAYSWILGYDNDMF-UHFFFAOYSA-N 0 0 366.751 3.654 20 5 FHBDRN O=C(N[C@@H]1[C@H]2CCO[C@@H]2C12CCC2)c1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000291784646 568309448 /nfs/dbraw/zinc/30/94/48/568309448.db2.gz QGYGJWSBDXYAHH-FZQKWOKYSA-N 0 0 371.220 3.589 20 5 FHBDRN CCCc1nc(C)c(CNC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000291795214 568316285 /nfs/dbraw/zinc/31/62/85/568316285.db2.gz PFRFPJPOZFTVMO-UHFFFAOYSA-N 0 0 352.778 3.819 20 5 FHBDRN Nc1ccc2c(c1)CC[C@H]2NC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000569236813 568317261 /nfs/dbraw/zinc/31/72/61/568317261.db2.gz DBZTWYFKZUZOHW-LJQANCHMSA-N 0 0 366.421 3.539 20 5 FHBDRN NC(=O)c1cccc(NC2CC(F)(c3cccc(Cl)c3)C2)c1[N+](=O)[O-] ZINC000569252483 568320043 /nfs/dbraw/zinc/32/00/43/568320043.db2.gz HLZXEHJPKLHZAZ-UHFFFAOYSA-N 0 0 363.776 3.786 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@H](C)c2ccc(F)c(F)c2)c1 ZINC000031487646 568330322 /nfs/dbraw/zinc/33/03/22/568330322.db2.gz KVGXSBGGJZPPHP-GFCCVEGCSA-N 0 0 364.348 3.828 20 5 FHBDRN CNc1ccc(C(=O)Nc2cccc(OCC(F)(F)F)c2)cc1[N+](=O)[O-] ZINC000031608525 568334588 /nfs/dbraw/zinc/33/45/88/568334588.db2.gz RSRUYSHJMVBXEX-UHFFFAOYSA-N 0 0 369.299 3.830 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N[C@@H]1CCc2cnn(C(C)C)c2C1 ZINC000365225579 568334866 /nfs/dbraw/zinc/33/48/66/568334866.db2.gz GCOOQZKGRRRKCX-OAHLLOKOSA-N 0 0 371.441 3.668 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/nfs/dbraw/zinc/39/13/42/568391342.db2.gz HQUWEZPXXCYCDI-UHFFFAOYSA-N 0 0 362.407 3.895 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1cc(-c2ccc(Cl)cc2)n[nH]1 ZINC000032370941 568391891 /nfs/dbraw/zinc/39/18/91/568391891.db2.gz GXFZBTJJHYPPAU-UHFFFAOYSA-N 0 0 370.796 3.911 20 5 FHBDRN Cc1c(C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)sc2nccn12 ZINC000541996134 568392221 /nfs/dbraw/zinc/39/22/21/568392221.db2.gz KBKSVPRDAYAAQP-UHFFFAOYSA-N 0 0 370.312 3.884 20 5 FHBDRN Cc1cccc(CN2CCN(C(=O)c3ccc(Cl)cc3[N+](=O)[O-])CC2)c1 ZINC000032499435 568393461 /nfs/dbraw/zinc/39/34/61/568393461.db2.gz QOQMMHACOIGEFK-UHFFFAOYSA-N 0 0 373.840 3.515 20 5 FHBDRN CC(C)Oc1nc(Oc2ccc(NC(=O)C3CC3)cc2)ccc1[N+](=O)[O-] ZINC000569472831 568399557 /nfs/dbraw/zinc/39/95/57/568399557.db2.gz RMUUTRXSGUUVRJ-UHFFFAOYSA-N 0 0 357.366 3.918 20 5 FHBDRN C[C@H]1c2c(F)cccc2CCN1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000569392272 568400333 /nfs/dbraw/zinc/40/03/33/568400333.db2.gz BYKQNTYMOBHLMU-LBPRGKRZSA-N 0 0 368.368 3.903 20 5 FHBDRN COc1ccc2c(c1)[C@H](c1nc(Cc3ccc([N+](=O)[O-])c(C)c3)no1)CC2 ZINC000569409270 568401193 /nfs/dbraw/zinc/40/11/93/568401193.db2.gz WKSBYBISXOGELP-MRXNPFEDSA-N 0 0 365.389 3.964 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)ccc1-c1nc(Cn2cnc3ccccc32)no1 ZINC000569446432 568402745 /nfs/dbraw/zinc/40/27/45/568402745.db2.gz KGHNGVVXTZMGSV-UHFFFAOYSA-N 0 0 355.741 3.696 20 5 FHBDRN Cc1ccc2c(c1)CN(C(=O)c1cc3cc([N+](=O)[O-])ccc3o1)CCO2 ZINC000569602049 568409186 /nfs/dbraw/zinc/40/91/86/568409186.db2.gz AKPQFIXLZFFLSK-UHFFFAOYSA-N 0 0 352.346 3.684 20 5 FHBDRN CCOC(=O)C1CCC(N(CC)c2ccc([N+](=O)[O-])c(C(C)=O)c2)CC1 ZINC000569637408 568411533 /nfs/dbraw/zinc/41/15/33/568411533.db2.gz NYNHIMQCGIWTTQ-UHFFFAOYSA-N 0 0 362.426 3.746 20 5 FHBDRN O=C(NCCCOC1CCCCC1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000006989082 568411810 /nfs/dbraw/zinc/41/18/10/568411810.db2.gz KSTMNCRCNVVYPR-UHFFFAOYSA-N 0 0 361.442 3.638 20 5 FHBDRN COC(=O)c1ccccc1NC(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000032892034 568411853 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FHBDRN CNC(=O)COc1ccc(Oc2c(Cl)cc(Cl)cc2[N+](=O)[O-])cc1 ZINC000569951698 568444292 /nfs/dbraw/zinc/44/42/92/568444292.db2.gz LHVLEKGPZMHKSD-UHFFFAOYSA-N 0 0 371.176 3.819 20 5 FHBDRN COc1cc(OC)c(OC)cc1CNc1ccc(Cl)cc1[N+](=O)[O-] ZINC000007120823 568451475 /nfs/dbraw/zinc/45/14/75/568451475.db2.gz CYJNZZSCYIFTCC-UHFFFAOYSA-N 0 0 352.774 3.886 20 5 FHBDRN C[C@H]1CCC[C@H](N(C)C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C1 ZINC000033099174 568455102 /nfs/dbraw/zinc/45/51/02/568455102.db2.gz GMSLWJSQUSPHQS-RDJZCZTQSA-N 0 0 359.470 3.848 20 5 FHBDRN COc1ccc(CSCC(=O)N(C)[C@@H]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000033101949 568458517 /nfs/dbraw/zinc/45/85/17/568458517.db2.gz BHBHFTRJHHPLKM-DZGCQCFKSA-N 0 0 366.483 3.874 20 5 FHBDRN CCc1ccc(-c2nc(Cc3ccc([N+](=O)[O-])c(OC)c3)no2)c(O)c1 ZINC000570244524 568466045 /nfs/dbraw/zinc/46/60/45/568466045.db2.gz BBYGAECEZBFICW-UHFFFAOYSA-N 0 0 355.350 3.512 20 5 FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC(CCF)CC1 ZINC000601747311 568468778 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ZINC000061431666 936349305 /nfs/dbraw/zinc/34/93/05/936349305.db2.gz YVYMXTOVIQLHQF-UHFFFAOYSA-N 0 0 372.768 3.870 20 5 FHBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)c1nc([C@@H](C)c2cccs2)no1 ZINC000612947393 936347938 /nfs/dbraw/zinc/34/79/38/936347938.db2.gz RFZICZWSZAZDSJ-WDEREUQCSA-N 0 0 372.406 3.682 20 5 FHBDRN CCN(C[C@H]1CCCO1)C(=O)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000278003997 936348365 /nfs/dbraw/zinc/34/83/65/936348365.db2.gz XWYDAGUOYFCVRM-CQSZACIVSA-N 0 0 350.418 3.735 20 5 FHBDRN C[C@@]1(c2nc(Cc3ccc([N+](=O)[O-])cn3)no2)CCCc2ccccc21 ZINC000612969711 936351291 /nfs/dbraw/zinc/35/12/91/936351291.db2.gz BAFCHANHVIEMRB-LJQANCHMSA-N 0 0 350.378 3.606 20 5 FHBDRN COc1ccccc1N1CC[C@@H](CNc2ncc(Cl)cc2[N+](=O)[O-])C1 ZINC000153660785 936364622 /nfs/dbraw/zinc/36/46/22/936364622.db2.gz JKYURWKVTTUAAP-LBPRGKRZSA-N 0 0 362.817 3.590 20 5 FHBDRN O=C(Nc1cc(Br)cc([N+](=O)[O-])c1)c1ccnc(C2CC2)c1 ZINC000583015395 936368805 /nfs/dbraw/zinc/36/88/05/936368805.db2.gz FEBIXDQODIJVOE-UHFFFAOYSA-N 0 0 362.183 3.882 20 5 FHBDRN COC(=O)c1ccc(OCc2cc(-c3ccccc3)no2)cc1[N+](=O)[O-] ZINC000613110023 936374301 /nfs/dbraw/zinc/37/43/01/936374301.db2.gz FSVYJLVDOZJZLK-UHFFFAOYSA-N 0 0 354.318 3.615 20 5 FHBDRN C[C@H](Cc1ccccc1F)NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000158769424 936379067 /nfs/dbraw/zinc/37/90/67/936379067.db2.gz YLRWDFQKFIHVOG-GFCCVEGCSA-N 0 0 355.369 3.505 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H]1OCCc2ccccc21 ZINC000613183881 936384282 /nfs/dbraw/zinc/38/42/82/936384282.db2.gz ARVULONOYOEKCC-JXFKEZNVSA-N 0 0 368.433 3.594 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCC(C)(C)[C@H]1CCCCO1 ZINC000613188841 936384768 /nfs/dbraw/zinc/38/47/68/936384768.db2.gz HZGJUIWMGAFDRT-FUHWJXTLSA-N 0 0 362.470 3.875 20 5 FHBDRN CCC[C@H]1C[C@@H](c2nc(Cc3cc(OC)ccc3[N+](=O)[O-])no2)CCO1 ZINC000278035022 936386777 /nfs/dbraw/zinc/38/67/77/936386777.db2.gz ZWBSMBKFDRKRDA-WFASDCNBSA-N 0 0 361.398 3.640 20 5 FHBDRN O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)N(Cc1cccc(F)c1)C1CC1 ZINC000583046236 936389496 /nfs/dbraw/zinc/38/94/96/936389496.db2.gz IQRSKWMREYVVAZ-UHFFFAOYSA-N 0 0 364.323 3.746 20 5 FHBDRN CCN(Cc1cc([N+](=O)[O-])cc2c1OCOC2)Cc1c(F)cccc1F ZINC000507240987 945066498 /nfs/dbraw/zinc/06/64/98/945066498.db2.gz FGQBSCKLECXZTP-UHFFFAOYSA-N 0 0 364.348 3.762 20 5 FHBDRN Cc1ccc(CNC(=O)c2ccc(Br)cc2[N+](=O)[O-])s1 ZINC000079408852 937082312 /nfs/dbraw/zinc/08/23/12/937082312.db2.gz NMMYLTDJLOEPSY-UHFFFAOYSA-N 0 0 355.213 3.657 20 5 FHBDRN CCCCCNC(=O)C1CCN(c2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000052077530 937088189 /nfs/dbraw/zinc/08/81/89/937088189.db2.gz BQOKDQSRJHAELW-UHFFFAOYSA-N 0 0 353.850 3.771 20 5 FHBDRN Cc1ccc(Nc2ccc(Br)cc2C(N)=O)cc1[N+](=O)[O-] ZINC001213667682 937105901 /nfs/dbraw/zinc/10/59/01/937105901.db2.gz VHYVYQSVAIIZAE-UHFFFAOYSA-N 0 0 350.172 3.508 20 5 FHBDRN CCCCOC(=O)c1ccc(OC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000755315428 937105924 /nfs/dbraw/zinc/10/59/24/937105924.db2.gz NAFRIKFXTXBXID-SFHVURJKSA-N 0 0 359.378 3.664 20 5 FHBDRN Cc1ccc(NC(=O)[C@H](C)OC(=O)c2ccc([N+](=O)[O-])s2)c(Cl)c1 ZINC000023344309 927038401 /nfs/dbraw/zinc/03/84/01/927038401.db2.gz HLCRPVUZFQUFIJ-VIFPVBQESA-N 0 0 368.798 3.802 20 5 FHBDRN C[C@@H](OC(=O)c1ccc([N+](=O)[O-])s1)C(=O)N1c2ccccc2CC[C@H]1C ZINC000023344956 927038637 /nfs/dbraw/zinc/03/86/37/927038637.db2.gz YRGPEFJXAOKXNI-VXGBXAGGSA-N 0 0 374.418 3.570 20 5 FHBDRN COC(=O)[C@@H](CNc1ccc([N+](=O)[O-])nc1)Cc1ccc2ccccc2c1 ZINC000583107636 937130134 /nfs/dbraw/zinc/13/01/34/937130134.db2.gz BCACNHQOVYAXMR-QGZVFWFLSA-N 0 0 365.389 3.587 20 5 FHBDRN Cc1c(NC(=O)[C@@H](C)N(C)Cc2nc3ccccc3o2)cccc1[N+](=O)[O-] ZINC000153852024 927083475 /nfs/dbraw/zinc/08/34/75/927083475.db2.gz AWZFMXVYEFLLAC-CYBMUJFWSA-N 0 0 368.393 3.503 20 5 FHBDRN Cc1nc2ccccc2c(SCC(=O)N(C)c2ccc([N+](=O)[O-])cc2)n1 ZINC000247966794 937135629 /nfs/dbraw/zinc/13/56/29/937135629.db2.gz QPLQJIPTDHJKEF-UHFFFAOYSA-N 0 0 368.418 3.602 20 5 FHBDRN COc1ccc(Br)cc1NC(=O)c1cc(F)cc([N+](=O)[O-])c1 ZINC000317124544 927110498 /nfs/dbraw/zinc/11/04/98/927110498.db2.gz CWPFZGNEJASMIX-UHFFFAOYSA-N 0 0 369.146 3.757 20 5 FHBDRN Cc1ccc(C(=O)N(CC(=O)Nc2ccc(F)cc2)C(C)C)cc1[N+](=O)[O-] ZINC000247979431 937138018 /nfs/dbraw/zinc/13/80/18/937138018.db2.gz FVJUMADETAAPDJ-UHFFFAOYSA-N 0 0 373.384 3.532 20 5 FHBDRN COc1cc(C(=O)N2CCCc3ccc(C)cc32)cc([N+](=O)[O-])c1OC ZINC000610175196 927228249 /nfs/dbraw/zinc/22/82/49/927228249.db2.gz JJAMQSSWTMNCJO-UHFFFAOYSA-N 0 0 356.378 3.513 20 5 FHBDRN CC(=O)c1cc(N2CCC[C@@H](CC(=O)OC(C)(C)C)C2)ccc1[N+](=O)[O-] ZINC000557624299 927237836 /nfs/dbraw/zinc/23/78/36/927237836.db2.gz CBGZHWGWJKHPJF-AWEZNQCLSA-N 0 0 362.426 3.746 20 5 FHBDRN CCCn1c(CO)nnc1Sc1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000557626763 927242674 /nfs/dbraw/zinc/24/26/74/927242674.db2.gz IKGTYZKLEUDTSY-UHFFFAOYSA-N 0 0 363.226 3.547 20 5 FHBDRN COc1ccc(OCCSCc2nc(C)c(C)s2)c([N+](=O)[O-])c1 ZINC000176415447 937149201 /nfs/dbraw/zinc/14/92/01/937149201.db2.gz ZGFFJAJDGNBFJW-UHFFFAOYSA-N 0 0 354.453 3.989 20 5 FHBDRN O=C(N[C@H]1CCCN(c2ccccc2Cl)C1)c1ccc([N+](=O)[O-])cc1 ZINC000610178479 927320756 /nfs/dbraw/zinc/32/07/56/927320756.db2.gz CHHQVIPUKXVUEX-AWEZNQCLSA-N 0 0 359.813 3.647 20 5 FHBDRN COc1ccc([C@@H](C)N(C)C(=O)COc2ccc([N+](=O)[O-])c(C)c2)cc1 ZINC000430152222 927363779 /nfs/dbraw/zinc/36/37/79/927363779.db2.gz DJAOAKLXTSSEQI-CQSZACIVSA-N 0 0 358.394 3.510 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N(C)[C@@H]2CCCc3ccccc32)c1F ZINC000577707446 927409777 /nfs/dbraw/zinc/40/97/77/927409777.db2.gz NECPOSSWIOSHPN-MRXNPFEDSA-N 0 0 372.396 3.821 20 5 FHBDRN Cc1ccccc1CC(C)(C)NC(=O)COc1ccc([N+](=O)[O-])c(F)c1 ZINC000728187023 927427701 /nfs/dbraw/zinc/42/77/01/927427701.db2.gz PQVRWRDUNUNCMK-UHFFFAOYSA-N 0 0 360.385 3.559 20 5 FHBDRN Cc1cc(C(=O)Nc2cccc(OC[C@@H]3CCCO3)c2)ccc1[N+](=O)[O-] ZINC000248002717 937165986 /nfs/dbraw/zinc/16/59/86/937165986.db2.gz UHSWIMYHTDKUHP-KRWDZBQOSA-N 0 0 356.378 3.713 20 5 FHBDRN COC[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)C(C)C ZINC000610184694 927524782 /nfs/dbraw/zinc/52/47/82/927524782.db2.gz HQALSISXQZOIRY-QGZVFWFLSA-N 0 0 358.394 3.788 20 5 FHBDRN Cn1cc([N+](=O)[O-])cc1C(=O)N1CC[C@@H](C(F)(F)F)c2ccccc21 ZINC000558481709 927526895 /nfs/dbraw/zinc/52/68/95/927526895.db2.gz XULVLFMZDURIPL-GFCCVEGCSA-N 0 0 353.300 3.630 20 5 FHBDRN CN(Cc1ccccc1Br)C(=O)c1csc([N+](=O)[O-])c1 ZINC000044291401 937172855 /nfs/dbraw/zinc/17/28/55/937172855.db2.gz CAWIPSZUKQFICN-UHFFFAOYSA-N 0 0 355.213 3.691 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N(C)CC1(O)CCCCCC1 ZINC000186923694 927576522 /nfs/dbraw/zinc/57/65/22/927576522.db2.gz HVHJPPHDFCLUAQ-UHFFFAOYSA-N 0 0 366.483 3.864 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CC[C@]2(C1)OCc1ccccc12 ZINC000186972856 927686611 /nfs/dbraw/zinc/68/66/11/927686611.db2.gz BSTZPLCBWKGGIG-GOSISDBHSA-N 0 0 358.781 3.520 20 5 FHBDRN Cc1cc(=O)c2cc(NC(=O)c3c(Cl)cccc3[N+](=O)[O-])ccc2[nH]1 ZINC000430188225 927687907 /nfs/dbraw/zinc/68/79/07/927687907.db2.gz AJBCDWCHHQOECY-UHFFFAOYSA-N 0 0 357.753 3.650 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N(CCO)[C@@H]1CCc2ccccc21 ZINC000120212331 927766591 /nfs/dbraw/zinc/76/65/91/927766591.db2.gz KSOFWUYOSSACPI-GOSISDBHSA-N 0 0 369.421 3.725 20 5 FHBDRN Cc1sc(C(=O)NC[C@H](O)c2ccc3ccccc3c2)cc1[N+](=O)[O-] ZINC000109691315 927767684 /nfs/dbraw/zinc/76/76/84/927767684.db2.gz CHLQNPHSYTVJBQ-INIZCTEOSA-N 0 0 356.403 3.581 20 5 FHBDRN Cc1cccc(C(=O)NC[C@H](O)c2ccc3ccccc3c2)c1[N+](=O)[O-] ZINC000109692132 927771899 /nfs/dbraw/zinc/77/18/99/927771899.db2.gz MNOSTPNKLKFJPF-SFHVURJKSA-N 0 0 350.374 3.520 20 5 FHBDRN C[C@@]1(c2ccccc2)C[C@@H]1NC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000610190285 927783112 /nfs/dbraw/zinc/78/31/12/927783112.db2.gz IWRLZFVXDKXPMK-HKUYNNGSSA-N 0 0 374.824 3.864 20 5 FHBDRN CCc1onc(C)c1NC(=O)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC000120226490 927805568 /nfs/dbraw/zinc/80/55/68/927805568.db2.gz JRYVWXOIJAFOKB-UHFFFAOYSA-N 0 0 369.175 3.860 20 5 FHBDRN C[C@@H](NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)c1ccc(Cl)cn1 ZINC000471139922 927812019 /nfs/dbraw/zinc/81/20/19/927812019.db2.gz MEGOEJIVFWFIJI-SNVBAGLBSA-N 0 0 360.801 3.709 20 5 FHBDRN CCOC[C@@H]1CCN(C(=O)c2cccc3c(=O)c4ccccc4[nH]c23)C1 ZINC000278110034 937195784 /nfs/dbraw/zinc/19/57/84/937195784.db2.gz KLRSMRGGJNCWBA-CQSZACIVSA-N 0 0 350.418 3.592 20 5 FHBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)N1C[C@H](C2CC2)[C@H]1C1CC1 ZINC000458411785 937200597 /nfs/dbraw/zinc/20/05/97/937200597.db2.gz DPOHHDOCBBBSET-RTBURBONSA-N 0 0 357.454 3.748 20 5 FHBDRN C[C@H]1CO[C@@H](c2cccc(Cl)c2)CN1C(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000187024360 927851987 /nfs/dbraw/zinc/85/19/87/927851987.db2.gz XNRUGJQGXFTPFL-SCLBCKFNSA-N 0 0 374.824 3.779 20 5 FHBDRN C[C@@H](Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C(=O)N1CCCC[C@H]1C ZINC000248047955 937199097 /nfs/dbraw/zinc/19/90/97/937199097.db2.gz AEMNZQAYDPZTEY-GHMZBOCLSA-N 0 0 359.348 3.815 20 5 FHBDRN C[C@@H]1CO[C@@H](c2cccc(Cl)c2)CN1C(=O)c1ccc([N+](=O)[O-])cc1 ZINC000187061013 927877011 /nfs/dbraw/zinc/87/70/11/927877011.db2.gz XSRYTYRRKZWSSB-SJKOYZFVSA-N 0 0 360.797 3.850 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N(C)c1nc2ccccc2n1C ZINC000120255848 927892154 /nfs/dbraw/zinc/89/21/54/927892154.db2.gz MMBDCMWMKUGNNL-GFCCVEGCSA-N 0 0 370.434 3.625 20 5 FHBDRN CSc1cccc(C(=O)N2C[C@H](C)C[C@H]2c2cccnc2)c1[N+](=O)[O-] ZINC000187069247 927895766 /nfs/dbraw/zinc/89/57/66/927895766.db2.gz QKRCKOOINMKLQS-DOMZBBRYSA-N 0 0 357.435 3.935 20 5 FHBDRN CSc1cccc(C(=O)N[C@H]2CCO[C@H](c3ccccc3)C2)c1[N+](=O)[O-] ZINC000187083219 927902291 /nfs/dbraw/zinc/90/22/91/927902291.db2.gz JJQZPSRHFXHLEP-HOCLYGCPSA-N 0 0 372.446 3.967 20 5 FHBDRN COC1(C(=O)N(C)c2nc(-c3ccccc3[N+](=O)[O-])cs2)CCCC1 ZINC000559043531 927902350 /nfs/dbraw/zinc/90/23/50/927902350.db2.gz AJAPWAXZUUEWCM-UHFFFAOYSA-N 0 0 361.423 3.640 20 5 FHBDRN CSc1cccc(C(=O)N2CC[C@@]3(C2)OCc2ccccc23)c1[N+](=O)[O-] ZINC000187092779 927907800 /nfs/dbraw/zinc/90/78/00/927907800.db2.gz CPBLAKKLFNVAND-IBGZPJMESA-N 0 0 370.430 3.588 20 5 FHBDRN COc1cc(C(=O)N2CCC[C@@H]2c2cccc(C)c2)cc([N+](=O)[O-])c1OC ZINC000610196397 927916439 /nfs/dbraw/zinc/91/64/39/927916439.db2.gz WKZWCIGDLRVUPG-MRXNPFEDSA-N 0 0 370.405 3.898 20 5 FHBDRN C[C@@H](C(=O)NCCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1ccco1 ZINC000610196387 927916829 /nfs/dbraw/zinc/91/68/29/927916829.db2.gz YTCYTLOWUHAJTP-SNVBAGLBSA-N 0 0 371.315 3.538 20 5 FHBDRN C[C@H](C(=O)NCCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1ccco1 ZINC000610196385 927916911 /nfs/dbraw/zinc/91/69/11/927916911.db2.gz YTCYTLOWUHAJTP-JTQLQIEISA-N 0 0 371.315 3.538 20 5 FHBDRN COc1cc(C(=O)N2CCC[C@H]2c2cccc(F)c2)cc([N+](=O)[O-])c1OC ZINC000610196269 927918397 /nfs/dbraw/zinc/91/83/97/927918397.db2.gz OCQGHBXDKQYAHG-HNNXBMFYSA-N 0 0 374.368 3.728 20 5 FHBDRN CCCN(CC(=O)Nc1ccccc1C)Cc1ccc([N+](=O)[O-])cc1OC ZINC000430199176 927925090 /nfs/dbraw/zinc/92/50/90/927925090.db2.gz BETOBPZTKBYSRV-UHFFFAOYSA-N 0 0 371.437 3.763 20 5 FHBDRN O=C(OCCCC(F)(F)F)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000157512590 927987628 /nfs/dbraw/zinc/98/76/28/927987628.db2.gz WMODKUWWKUMHTG-UHFFFAOYSA-N 0 0 356.094 3.857 20 5 FHBDRN Cc1nc(CNC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)sc1C ZINC000175316866 927989167 /nfs/dbraw/zinc/98/91/67/927989167.db2.gz NTTIFFDJQLODNF-UHFFFAOYSA-N 0 0 374.447 3.722 20 5 FHBDRN CC(C)C(=O)Nc1ccc(CNC(=O)[C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000583180636 937210348 /nfs/dbraw/zinc/21/03/48/937210348.db2.gz INNUQEOTGFYZAP-CQSZACIVSA-N 0 0 369.421 3.609 20 5 FHBDRN CC(C)C(=O)Nc1ccc(CNC(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000583180635 937210399 /nfs/dbraw/zinc/21/03/99/937210399.db2.gz INNUQEOTGFYZAP-AWEZNQCLSA-N 0 0 369.421 3.609 20 5 FHBDRN O=C(Cc1ccc(F)cc1F)OCCSc1ccc([N+](=O)[O-])cc1 ZINC000784934009 928017131 /nfs/dbraw/zinc/01/71/31/928017131.db2.gz GDYFPJGLGYBCDX-UHFFFAOYSA-N 0 0 353.346 3.751 20 5 FHBDRN CNc1ccc(C(=O)NCC[C@@H](C)c2ccc(OC)cc2)cc1[N+](=O)[O-] ZINC000610203277 928030391 /nfs/dbraw/zinc/03/03/91/928030391.db2.gz IQNDKPICUSNIKU-CYBMUJFWSA-N 0 0 357.410 3.569 20 5 FHBDRN CC[C@H](c1ccccc1)N1CC(=O)N(c2ccc(OC)c([N+](=O)[O-])c2)C1=O ZINC000278121439 937219972 /nfs/dbraw/zinc/21/99/72/937219972.db2.gz MECJRNUEHOAVDX-OAHLLOKOSA-N 0 0 369.377 3.523 20 5 FHBDRN O=C(CCc1ccccc1F)N1CCS[C@@H]1c1ccc([N+](=O)[O-])cc1 ZINC000610209960 928073993 /nfs/dbraw/zinc/07/39/93/928073993.db2.gz PNHXYLQXDRRUCX-GOSISDBHSA-N 0 0 360.410 3.941 20 5 FHBDRN Cc1noc(C)c1[C@H](C)C(=O)N1CCS[C@@H]1c1ccc([N+](=O)[O-])cc1 ZINC000610209984 928074012 /nfs/dbraw/zinc/07/40/12/928074012.db2.gz QEXVNRXDDNEGEK-DYZYQPBXSA-N 0 0 361.423 3.577 20 5 FHBDRN COCc1cc([N+](=O)[O-])ccc1NC[C@@H]1CCN(c2ccccc2OC)C1 ZINC000610210960 928081471 /nfs/dbraw/zinc/08/14/71/928081471.db2.gz IYJONONVNOGOIG-HNNXBMFYSA-N 0 0 371.437 3.688 20 5 FHBDRN CN(Cc1cc(Br)ccc1F)C(=O)c1ccc([N+](=O)[O-])cc1 ZINC000248074185 937217646 /nfs/dbraw/zinc/21/76/46/937217646.db2.gz TVUDWIBZAVOANI-UHFFFAOYSA-N 0 0 367.174 3.769 20 5 FHBDRN CCO[C@H]1C[C@H](Nc2cc(C)nc(-c3ccc([N+](=O)[O-])cc3)n2)C12CCC2 ZINC000610210878 928083248 /nfs/dbraw/zinc/08/32/48/928083248.db2.gz GOILKMRNPUNXMD-IRXDYDNUSA-N 0 0 368.437 3.542 20 5 FHBDRN Cc1ccc(OCC(=O)N2CCS[C@H]2c2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000610210294 928095371 /nfs/dbraw/zinc/09/53/71/928095371.db2.gz HAFTTWLPMYVCKO-IBGZPJMESA-N 0 0 372.446 3.865 20 5 FHBDRN Cc1cccc(OC[C@H](O)CNc2cc(C)nc3c2cccc3[N+](=O)[O-])c1 ZINC000302004466 928101238 /nfs/dbraw/zinc/10/12/38/928101238.db2.gz KFNGVIWDQMAPQN-OAHLLOKOSA-N 0 0 367.405 3.612 20 5 FHBDRN Cc1cc2cc(NC(=O)N3CCOc4ccc([N+](=O)[O-])cc4C3)ccc2[nH]1 ZINC000564411911 937220323 /nfs/dbraw/zinc/22/03/23/937220323.db2.gz LZQKBIKNFYORLO-UHFFFAOYSA-N 0 0 366.377 3.811 20 5 FHBDRN CCOc1ccccc1CN(C)C(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000064834456 928113539 /nfs/dbraw/zinc/11/35/39/928113539.db2.gz MRTGEGKJXYXFJU-UHFFFAOYSA-N 0 0 353.378 3.747 20 5 FHBDRN CCCC1(CNC(=O)c2cc(OC)c(OCC)cc2[N+](=O)[O-])CCC1 ZINC000157524461 928113586 /nfs/dbraw/zinc/11/35/86/928113586.db2.gz JFXVSMUERDIXJW-UHFFFAOYSA-N 0 0 350.415 3.702 20 5 FHBDRN O=C(Cc1cccc(F)c1F)OCCSc1ccc([N+](=O)[O-])cc1 ZINC000784938676 928118313 /nfs/dbraw/zinc/11/83/13/928118313.db2.gz PJQGSASXXXRYMO-UHFFFAOYSA-N 0 0 353.346 3.751 20 5 FHBDRN Cc1cc(Cl)ccc1NC(=O)CN1c2ccc([N+](=O)[O-])cc2C[C@@H]1C ZINC000728202058 928169792 /nfs/dbraw/zinc/16/97/92/928169792.db2.gz SGMDVRWBIVFZPJ-LBPRGKRZSA-N 0 0 359.813 3.946 20 5 FHBDRN CCOc1ccc([C@@H](C)NCc2ccc([N+](=O)[O-])cc2OC)cc1OC ZINC000430215427 928189173 /nfs/dbraw/zinc/18/91/73/928189173.db2.gz GZGXUBCLKGIVAE-CYBMUJFWSA-N 0 0 360.410 3.862 20 5 FHBDRN Cc1ccccc1[C@H]1CN(CCCOc2ccc([N+](=O)[O-])cc2)CCO1 ZINC000610217920 928218429 /nfs/dbraw/zinc/21/84/29/928218429.db2.gz XXDQAGFSLULXGG-HXUWFJFHSA-N 0 0 356.422 3.746 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)NCc1cnc2n1CCCC2 ZINC000375593544 928228484 /nfs/dbraw/zinc/22/84/84/928228484.db2.gz WYKVLZNKOZZYDZ-UHFFFAOYSA-N 0 0 374.466 3.558 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1CN1CCO[C@H](c2ccc(Cl)cc2)C1 ZINC000430221388 928260848 /nfs/dbraw/zinc/26/08/48/928260848.db2.gz RGLPMUJUXSLFRY-SFHVURJKSA-N 0 0 362.813 3.830 20 5 FHBDRN Cc1ccc2oc(C(=O)OCCSc3ccc([N+](=O)[O-])cc3)cc2n1 ZINC000784939204 928299633 /nfs/dbraw/zinc/29/96/33/928299633.db2.gz SFQRNQIWMJMZMS-UHFFFAOYSA-N 0 0 358.375 3.994 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)Nc2ccnn2Cc2ccc(F)cc2)c1 ZINC000610223748 928300931 /nfs/dbraw/zinc/30/09/31/928300931.db2.gz IQYSGJJOEYYTPD-UHFFFAOYSA-N 0 0 354.341 3.539 20 5 FHBDRN COc1cc(NC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)cc(OC)c1 ZINC000157624177 928344784 /nfs/dbraw/zinc/34/47/84/928344784.db2.gz AFXWSDLZOVEKFG-UHFFFAOYSA-N 0 0 373.409 3.756 20 5 FHBDRN O=C(N[C@H]1CC12CCCC2)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000430230908 928346252 /nfs/dbraw/zinc/34/62/52/928346252.db2.gz ZXFWQZQYSPADKI-INIZCTEOSA-N 0 0 350.393 3.883 20 5 FHBDRN COc1cc(OC)c(OC)cc1CN(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000126979902 928361158 /nfs/dbraw/zinc/36/11/58/928361158.db2.gz UXXUSLKEPSQMRS-UHFFFAOYSA-N 0 0 372.421 3.785 20 5 FHBDRN CN(Cc1cccc(OC(F)(F)F)c1)C(=O)c1ccc([N+](=O)[O-])cc1 ZINC000126989005 928364228 /nfs/dbraw/zinc/36/42/28/928364228.db2.gz VLEXLWIVRSXXMA-UHFFFAOYSA-N 0 0 354.284 3.766 20 5 FHBDRN O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccnc(Sc2ccccn2)c1 ZINC000610230078 928395473 /nfs/dbraw/zinc/39/54/73/928395473.db2.gz VHTNXPPHWJHVTP-UHFFFAOYSA-N 0 0 366.402 3.717 20 5 FHBDRN Cc1c(C(=O)OCCSc2ccc([N+](=O)[O-])cc2)cnn1C(C)(C)C ZINC000784941345 928397174 /nfs/dbraw/zinc/39/71/74/928397174.db2.gz ZBRUVSCUZHGFCI-UHFFFAOYSA-N 0 0 363.439 3.804 20 5 FHBDRN CCc1nc(-c2ccccc2NC(=O)C=Cc2ccc([N+](=O)[O-])cc2)n[nH]1 ZINC000254941108 928421147 /nfs/dbraw/zinc/42/11/47/928421147.db2.gz LCFADWFIHPYOKV-XFXZXTDPSA-N 0 0 363.377 3.594 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)Nc2nnc(C(F)F)s2)cc1[N+](=O)[O-] ZINC000127037389 928422846 /nfs/dbraw/zinc/42/28/46/928422846.db2.gz ITJUZDCSRVGBCG-UHFFFAOYSA-N 0 0 356.354 3.934 20 5 FHBDRN C[C@H](NC(=O)NCCCCc1ccc([N+](=O)[O-])cc1)c1cncc(F)c1 ZINC000458435084 937248096 /nfs/dbraw/zinc/24/80/96/937248096.db2.gz SEQRGVVQKIDWDT-ZDUSSCGKSA-N 0 0 360.389 3.512 20 5 FHBDRN Cc1ccc(-c2csc(NC(=O)C3(C)CCOCC3)n2)cc1[N+](=O)[O-] ZINC000608846919 928477711 /nfs/dbraw/zinc/47/77/11/928477711.db2.gz NVFQLMPENDAIRA-UHFFFAOYSA-N 0 0 361.423 3.782 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1OC[C@H](O)CO[C@@H]1CCCc2ccccc21 ZINC000583218766 937249671 /nfs/dbraw/zinc/24/96/71/937249671.db2.gz JFWQJZRGABPSCV-IEBWSBKVSA-N 0 0 357.406 3.737 20 5 FHBDRN CN(CCCc1nc2ccccc2[nH]1)C(=O)/C=C\c1ccc([N+](=O)[O-])cc1 ZINC000254955121 928498581 /nfs/dbraw/zinc/49/85/81/928498581.db2.gz PVYIGXRWYUYIQA-RAXLEYEMSA-N 0 0 364.405 3.576 20 5 FHBDRN CCn1c(C)nc([N+](=O)[O-])c1N[C@@H](c1ccn(C)n1)c1ccc(Cl)cc1 ZINC000583224462 937255106 /nfs/dbraw/zinc/25/51/06/937255106.db2.gz QEOSADGYMYXNJT-OAHLLOKOSA-N 0 0 374.832 3.708 20 5 FHBDRN Cc1noc(C)c1[C@H](C)NC(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000120480018 928560562 /nfs/dbraw/zinc/56/05/62/928560562.db2.gz JVTCNXYQDAWTMI-LBPRGKRZSA-N 0 0 360.414 3.583 20 5 FHBDRN Cc1nnc(Sc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])n1-c1ccccc1C ZINC000248134584 937256093 /nfs/dbraw/zinc/25/60/93/937256093.db2.gz YWPYKPMKWXPSGV-UHFFFAOYSA-N 0 0 371.378 3.852 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)NCCCO[C@H](C)c1ccccc1 ZINC000248137240 937256306 /nfs/dbraw/zinc/25/63/06/937256306.db2.gz NNBVYLGYXLKWHY-CQSZACIVSA-N 0 0 358.394 3.501 20 5 FHBDRN Cc1ccc(SC[C@@H](C)NC(=O)CCOc2ccccc2[N+](=O)[O-])cc1 ZINC000472283323 937259716 /nfs/dbraw/zinc/25/97/16/937259716.db2.gz IKTDMDNYTYUXQB-OAHLLOKOSA-N 0 0 374.462 3.969 20 5 FHBDRN COc1ccc(CSCC(=O)NC[C@@H](C)c2ccccc2)cc1[N+](=O)[O-] ZINC000046588916 928616555 /nfs/dbraw/zinc/61/65/55/928616555.db2.gz UFLBPCCFXUBAFR-CQSZACIVSA-N 0 0 374.462 3.757 20 5 FHBDRN C[C@H](OC(=O)c1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1cccc(F)c1 ZINC000023445108 928637340 /nfs/dbraw/zinc/63/73/40/928637340.db2.gz JOVNXAKMVLKVMP-VIFPVBQESA-N 0 0 366.732 3.571 20 5 FHBDRN CCNC(=O)c1ccc(CNc2ccc([N+](=O)[O-])c3cccnc23)cc1 ZINC000052206442 937267563 /nfs/dbraw/zinc/26/75/63/937267563.db2.gz ZATAPYIVFHDWJE-UHFFFAOYSA-N 0 0 350.378 3.505 20 5 FHBDRN CCN(C(=O)c1cc(C(=O)OC)cc([N+](=O)[O-])c1)c1cccc(C)c1C ZINC000510125027 928741519 /nfs/dbraw/zinc/74/15/19/928741519.db2.gz VKNAMWXXKPTEGA-UHFFFAOYSA-N 0 0 356.378 3.665 20 5 FHBDRN CCOc1ccc(Cl)cc1CCNC(=O)c1ccc([N+](=O)[O-])s1 ZINC000535973198 937275175 /nfs/dbraw/zinc/27/51/75/937275175.db2.gz AIZPHBNQQGAJIB-UHFFFAOYSA-N 0 0 354.815 3.681 20 5 FHBDRN Cc1ccc(NC(=O)N[C@H](C)c2noc(-c3ccccc3)n2)cc1[N+](=O)[O-] ZINC000134426500 928895449 /nfs/dbraw/zinc/89/54/49/928895449.db2.gz NSHIJTKPZMSSRB-GFCCVEGCSA-N 0 0 367.365 3.836 20 5 FHBDRN CC(C)(C)C(=O)N1CCC(Nc2ccc([N+](=O)[O-])c3cnccc23)CC1 ZINC000052218341 937285822 /nfs/dbraw/zinc/28/58/22/937285822.db2.gz RMNBCDDSYVVORC-UHFFFAOYSA-N 0 0 356.426 3.592 20 5 FHBDRN O=C(CC[C@H]1CCOC1)Nc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1 ZINC000176600482 937286144 /nfs/dbraw/zinc/28/61/44/937286144.db2.gz DFBWZYTXNXGUJD-AWEZNQCLSA-N 0 0 368.389 3.581 20 5 FHBDRN Cc1cc(C(=O)NCc2sccc2Br)cc([N+](=O)[O-])c1 ZINC000134465423 928933579 /nfs/dbraw/zinc/93/35/79/928933579.db2.gz RCLBFRIVKNYMQZ-UHFFFAOYSA-N 0 0 355.213 3.657 20 5 FHBDRN Cc1nc(C2(NC(=O)Nc3cc([N+](=O)[O-])ccc3C)CCCCC2)no1 ZINC000274880684 928946574 /nfs/dbraw/zinc/94/65/74/928946574.db2.gz FZUSDDNLTCCBRT-UHFFFAOYSA-N 0 0 359.386 3.576 20 5 FHBDRN COc1ccc([C@H](C)N(C)C(=O)CCNc2ccccc2[N+](=O)[O-])cc1 ZINC000248180334 937289504 /nfs/dbraw/zinc/28/95/04/937289504.db2.gz CWHKDGOVBLWDFF-AWEZNQCLSA-N 0 0 357.410 3.625 20 5 FHBDRN O=C(N[C@H]1CCCc2cn(C3CCCC3)nc21)c1cc(F)cc([N+](=O)[O-])c1 ZINC000509688310 928967489 /nfs/dbraw/zinc/96/74/89/928967489.db2.gz SVLLRWWDEGCARN-KRWDZBQOSA-N 0 0 372.400 3.853 20 5 FHBDRN C[C@H]1c2ccccc2OCCN1C(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000598567359 928972564 /nfs/dbraw/zinc/97/25/64/928972564.db2.gz DBDOXFITIRENKA-ZDUSSCGKSA-N 0 0 358.419 3.669 20 5 FHBDRN COCCOc1ccccc1NC(=O)c1cccc(Cl)c1[N+](=O)[O-] ZINC000175769579 928974003 /nfs/dbraw/zinc/97/40/03/928974003.db2.gz KBNYBQJENVWNSQ-UHFFFAOYSA-N 0 0 350.758 3.526 20 5 FHBDRN O=C(NCCc1ccccc1[N+](=O)[O-])c1ccc(OC2CCCC2)cc1 ZINC000610237075 928977086 /nfs/dbraw/zinc/97/70/86/928977086.db2.gz BAPIBFCQRDOPHE-UHFFFAOYSA-N 0 0 354.406 3.889 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N(C)Cc1nc2c(s1)CCCC2 ZINC000162793661 937291786 /nfs/dbraw/zinc/29/17/86/937291786.db2.gz HIKZZXLUKBSOTE-UHFFFAOYSA-N 0 0 360.439 3.902 20 5 FHBDRN Nc1c(C(=O)Nc2cccc(C3SCCS3)c2)cccc1[N+](=O)[O-] ZINC000175770236 928983713 /nfs/dbraw/zinc/98/37/13/928983713.db2.gz NACPTCZTCDUQEI-UHFFFAOYSA-N 0 0 361.448 3.908 20 5 FHBDRN COC(=O)c1cc(C(=O)N[C@H](CC2CC2)c2ccccc2)cc([N+](=O)[O-])c1 ZINC000610236369 929024912 /nfs/dbraw/zinc/02/49/12/929024912.db2.gz SAAJPQYNWGGEKI-GOSISDBHSA-N 0 0 368.389 3.653 20 5 FHBDRN Cc1cc(C(=O)Nc2cccc([C@@H](C)N3CCOCC3)c2)cc([N+](=O)[O-])c1 ZINC000609182558 929038459 /nfs/dbraw/zinc/03/84/59/929038459.db2.gz AMRRXFSPTIVLOY-OAHLLOKOSA-N 0 0 369.421 3.549 20 5 FHBDRN COc1cccc([C@H](C)CC(=O)NCc2cc([N+](=O)[O-])c(F)cc2F)c1 ZINC001143376428 929045704 /nfs/dbraw/zinc/04/57/04/929045704.db2.gz DUHLKENCDXSRRF-LLVKDONJSA-N 0 0 364.348 3.692 20 5 FHBDRN CS[C@@H]1CCCCN(c2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)C1 ZINC000154633551 929057861 /nfs/dbraw/zinc/05/78/61/929057861.db2.gz KILUJJDRVNKFOF-OAHLLOKOSA-N 0 0 363.483 3.553 20 5 FHBDRN CC[C@@H](C)[C@@H](C)N(C(=O)c1nnn(-c2cccc([N+](=O)[O-])c2)c1C)C1CC1 ZINC000609189987 929060329 /nfs/dbraw/zinc/06/03/29/929060329.db2.gz IOBKIKQQDOHELW-CHWSQXEVSA-N 0 0 371.441 3.523 20 5 FHBDRN Cc1ccc(C(C)(C)CN(C)C(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)cc1 ZINC000610237545 929062009 /nfs/dbraw/zinc/06/20/09/929062009.db2.gz BYTDMANOSOIERD-UHFFFAOYSA-N 0 0 370.405 3.682 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])N1CC2(CCC2)[C@@H]1c1ccncc1 ZINC000598572873 929065671 /nfs/dbraw/zinc/06/56/71/929065671.db2.gz MYRBXQBVRVLPKN-IBGZPJMESA-N 0 0 367.405 3.513 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N(Cc1ccccc1)[C@H](C)C1CC1 ZINC000059822991 929072404 /nfs/dbraw/zinc/07/24/04/929072404.db2.gz HVIAJUJFFSNJIJ-OAHLLOKOSA-N 0 0 374.462 3.893 20 5 FHBDRN COc1ccccc1[C@H]1CCCCN1C(=O)c1cc([N+](=O)[O-])cnc1C ZINC000609262938 929085453 /nfs/dbraw/zinc/08/54/53/929085453.db2.gz BCEVNSMFQRGCOU-QGZVFWFLSA-N 0 0 355.394 3.674 20 5 FHBDRN COC(=O)Cc1ccc(OCc2coc(-c3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000134619517 929095911 /nfs/dbraw/zinc/09/59/11/929095911.db2.gz VRYCCVHVVTZBSD-UHFFFAOYSA-N 0 0 368.345 3.544 20 5 FHBDRN Cc1ccc(CNC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])nc1C ZINC000458000975 929109677 /nfs/dbraw/zinc/10/96/77/929109677.db2.gz FNBNNXKYVUVTAX-UHFFFAOYSA-N 0 0 353.300 3.555 20 5 FHBDRN Cc1ccc(NC(=O)c2cc(N3CCCC3=O)ccc2Cl)cc1[N+](=O)[O-] ZINC000134708857 929162282 /nfs/dbraw/zinc/16/22/82/929162282.db2.gz MDELQIJSAXIXLE-UHFFFAOYSA-N 0 0 373.796 3.936 20 5 FHBDRN Cc1c(-c2nc(-c3ccc([N+](=O)[O-])cc3)no2)cnn1-c1ccc(F)cc1 ZINC000609474249 929178504 /nfs/dbraw/zinc/17/85/04/929178504.db2.gz JIBLBEXCCJVDRJ-UHFFFAOYSA-N 0 0 365.324 3.945 20 5 FHBDRN C[C@@H](NC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1)c1cnn(CC2CCC2)c1 ZINC000890670335 929180701 /nfs/dbraw/zinc/18/07/01/929180701.db2.gz KWWOVDVYWNTYMN-UONOGXRCSA-N 0 0 356.426 3.572 20 5 FHBDRN C[C@@H](NC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1)c1cnn(CC2CCC2)c1 ZINC000890670336 929180898 /nfs/dbraw/zinc/18/08/98/929180898.db2.gz KWWOVDVYWNTYMN-ZIAGYGMSSA-N 0 0 356.426 3.572 20 5 FHBDRN C[C@@H](NC(=O)c1c(Cl)cccc1[N+](=O)[O-])c1cnn(CC2CCC2)c1 ZINC000890671352 929197520 /nfs/dbraw/zinc/19/75/20/929197520.db2.gz IMJCJMDQGPKECX-LLVKDONJSA-N 0 0 362.817 3.736 20 5 FHBDRN CCc1cccc2c(CCNC(=O)c3cc(C)cc([N+](=O)[O-])c3)c[nH]c21 ZINC000609530517 929198968 /nfs/dbraw/zinc/19/89/68/929198968.db2.gz FXUMDDSEIGNMST-UHFFFAOYSA-N 0 0 351.406 3.919 20 5 FHBDRN Cc1nn(CCc2nc(C(C)(C)Cc3ccccc3)no2)c(C)c1[N+](=O)[O-] ZINC000278181374 937311041 /nfs/dbraw/zinc/31/10/41/937311041.db2.gz LQKLCECEVOGHGG-UHFFFAOYSA-N 0 0 369.425 3.554 20 5 FHBDRN CC(=O)c1ccc(NCc2cnn(Cc3ccccc3)c2)c([N+](=O)[O-])c1 ZINC000052243895 937311316 /nfs/dbraw/zinc/31/13/16/937311316.db2.gz USZMBDBMYBDWKD-UHFFFAOYSA-N 0 0 350.378 3.654 20 5 FHBDRN CSc1ccc(C(=O)N[C@@H](C)CC(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000165263579 929303584 /nfs/dbraw/zinc/30/35/84/929303584.db2.gz JRMBTUXTVYIQTR-LBPRGKRZSA-N 0 0 358.419 3.708 20 5 FHBDRN Cc1cc(Cl)c(S(=O)(=O)N(C)Cc2cccc(F)c2)cc1[N+](=O)[O-] ZINC000176634759 937322324 /nfs/dbraw/zinc/32/23/24/937322324.db2.gz TZTYYCQSZJDHKS-UHFFFAOYSA-N 0 0 372.805 3.516 20 5 FHBDRN COc1cc(N2CC[C@@H](COCc3ccccc3)C2)c(F)cc1[N+](=O)[O-] ZINC000535629127 929355378 /nfs/dbraw/zinc/35/53/78/929355378.db2.gz QNAVWCHNKKTGQC-OAHLLOKOSA-N 0 0 360.385 3.786 20 5 FHBDRN Cc1cc([C@H]2CN(C(=O)c3ccc([N+](=O)[O-])c(C)c3)CCO2)ccc1F ZINC000134853299 929379333 /nfs/dbraw/zinc/37/93/33/929379333.db2.gz JIRPIODUOBDDRF-GOSISDBHSA-N 0 0 358.369 3.564 20 5 FHBDRN C[C@H](C(=O)N1C[C@H]2CCCN2c2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000583299833 937331228 /nfs/dbraw/zinc/33/12/28/937331228.db2.gz BJEFCLXOAYSHSZ-WMLDXEAASA-N 0 0 351.406 3.714 20 5 FHBDRN CNc1ccc(C(=O)Nc2cc(-c3cccc(Cl)c3)on2)cc1[N+](=O)[O-] ZINC000583299440 937331457 /nfs/dbraw/zinc/33/14/57/937331457.db2.gz BCBOIZMWAXLTNG-UHFFFAOYSA-N 0 0 372.768 3.619 20 5 FHBDRN Cc1nn(C(C)(C)C)cc1[C@H](C)NC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000154890432 929454259 /nfs/dbraw/zinc/45/42/59/929454259.db2.gz DPYJDBODWYDFGI-JTQLQIEISA-N 0 0 364.833 3.999 20 5 FHBDRN Cc1nc(C(=O)NCCc2ccccc2[N+](=O)[O-])c(-c2ccccc2)o1 ZINC000547761993 929537555 /nfs/dbraw/zinc/53/75/55/929537555.db2.gz BXSSAIWHAMTNFD-UHFFFAOYSA-N 0 0 351.362 3.531 20 5 FHBDRN CC(=O)Nc1cccc(CNC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)c1 ZINC000187213809 929556367 /nfs/dbraw/zinc/55/63/67/929556367.db2.gz KWOFWIDYKOSYTE-UHFFFAOYSA-N 0 0 355.394 3.607 20 5 FHBDRN COCCN1C(=O)CCc2cc(N[C@H](C)c3cccc([N+](=O)[O-])c3)ccc21 ZINC000275100814 929568995 /nfs/dbraw/zinc/56/89/95/929568995.db2.gz DBTAKBMRNWLSJR-CQSZACIVSA-N 0 0 369.421 3.694 20 5 FHBDRN CC(C)(C)C(=O)Nc1ccc(C(=O)COc2cc(F)cc([N+](=O)[O-])c2)cc1 ZINC000135346979 937341107 /nfs/dbraw/zinc/34/11/07/937341107.db2.gz XCVLHXKCUBYKLB-UHFFFAOYSA-N 0 0 374.368 3.980 20 5 FHBDRN O=C(NC1CCC(F)(F)CC1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000535633524 929587784 /nfs/dbraw/zinc/58/77/84/929587784.db2.gz JPBFDBOUQCTRDS-UHFFFAOYSA-N 0 0 353.369 3.503 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)NCc1nc2ccccc2n1C(C)C ZINC000609851950 929596128 /nfs/dbraw/zinc/59/61/28/929596128.db2.gz QAFJRPDAWUNFOC-UHFFFAOYSA-N 0 0 352.394 3.764 20 5 FHBDRN Cc1ccc(-c2cc(C(=O)NCc3cc([N+](=O)[O-])c(F)cc3F)[nH]n2)cc1 ZINC001143377258 929625082 /nfs/dbraw/zinc/62/50/82/929625082.db2.gz URYCLVFGLIOFIQ-UHFFFAOYSA-N 0 0 372.331 3.502 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N(CC(F)(F)F)c1ccccc1 ZINC000109722550 929626322 /nfs/dbraw/zinc/62/63/22/929626322.db2.gz MTWQWOCVDLIUAV-UHFFFAOYSA-N 0 0 354.284 3.569 20 5 FHBDRN CC(C)Cc1ncc(NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)cn1 ZINC000471445200 929644935 /nfs/dbraw/zinc/64/49/35/929644935.db2.gz VOWUHMTYNZPVGI-UHFFFAOYSA-N 0 0 368.315 3.854 20 5 FHBDRN CCOC[C@@H]1CCCN(C(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)C1 ZINC000275636371 929662572 /nfs/dbraw/zinc/66/25/72/929662572.db2.gz WHOWDGKGBUHVRA-OAHLLOKOSA-N 0 0 364.445 3.982 20 5 FHBDRN CC1(C)[C@H](NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])[C@H]2CCCO[C@@H]21 ZINC000610294737 929705089 /nfs/dbraw/zinc/70/50/89/929705089.db2.gz ULNVZUZVAYWNHI-BNOWGMLFSA-N 0 0 372.343 3.547 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)NCC1(c2ccccc2)CCCC1 ZINC000012101220 929725879 /nfs/dbraw/zinc/72/58/79/929725879.db2.gz MUJRXUZNSYFJCO-UHFFFAOYSA-N 0 0 354.406 3.602 20 5 FHBDRN Cc1nnc(NC(=O)c2cc([N+](=O)[O-])ccc2SCC(C)C)s1 ZINC000134035373 929730215 /nfs/dbraw/zinc/73/02/15/929730215.db2.gz AOQIMPFADHSQMR-UHFFFAOYSA-N 0 0 352.441 3.755 20 5 FHBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)Nc1ccc2nn(C(C)C)cc2c1 ZINC000134047802 929749126 /nfs/dbraw/zinc/74/91/26/929749126.db2.gz KUKAVFAUUQQJPQ-UHFFFAOYSA-N 0 0 374.422 3.635 20 5 FHBDRN CCc1cccc2c1OCC[C@@H]2NC(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000510304166 929765101 /nfs/dbraw/zinc/76/51/01/929765101.db2.gz AOIAEGMBRLXMPB-KRWDZBQOSA-N 0 0 369.421 3.822 20 5 FHBDRN CCCCOc1ncccc1CNC(=O)c1cccc(Cl)c1[N+](=O)[O-] ZINC000175823817 929769473 /nfs/dbraw/zinc/76/94/73/929769473.db2.gz HACXCBWWLKGFAT-UHFFFAOYSA-N 0 0 363.801 3.752 20 5 FHBDRN O=C(c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)N1CC[C@H]1c1cccc(F)c1 ZINC000610304919 929779104 /nfs/dbraw/zinc/77/91/04/929779104.db2.gz ZZKDJVLYSYCOEN-INIZCTEOSA-N 0 0 366.352 3.507 20 5 FHBDRN O=C([O-])c1cc(NC[C@H](c2ccccc2)[NH+]2CCCC2)ccc1[N+](=O)[O-] ZINC000560373931 929785823 /nfs/dbraw/zinc/78/58/23/929785823.db2.gz OYTTZQJZATYNCN-GOSISDBHSA-N 0 0 355.394 3.542 20 5 FHBDRN CC[C@H](NC(=O)N1CCOC[C@@H]1CC1CCC1)c1cccc([N+](=O)[O-])c1 ZINC000458485396 937359523 /nfs/dbraw/zinc/35/95/23/937359523.db2.gz CDZGLPZKKZVIGC-ROUUACIJSA-N 0 0 361.442 3.647 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1Nc1ccccc1-c1nc(CO)cs1 ZINC001210449730 929806734 /nfs/dbraw/zinc/80/67/34/929806734.db2.gz MIOBHTUEZBXSHP-UHFFFAOYSA-N 0 0 357.391 3.963 20 5 FHBDRN C[C@@H](N[C@@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1)c1ncn(C)n1 ZINC000275671813 929820697 /nfs/dbraw/zinc/82/06/97/929820697.db2.gz HHYOACDLTTUROR-NWDGAFQWSA-N 0 0 357.439 3.864 20 5 FHBDRN C[C@@H](N[C@@H](C)c1ncn(C)n1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000275671806 929820999 /nfs/dbraw/zinc/82/09/99/929820999.db2.gz HHYOACDLTTUROR-NEPJUHHUSA-N 0 0 357.439 3.864 20 5 FHBDRN COc1cccc2c1CC[C@H]2NC(=O)C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000583337261 937362688 /nfs/dbraw/zinc/36/26/88/937362688.db2.gz DGVYSQOCGUEFRT-MRXNPFEDSA-N 0 0 354.406 3.685 20 5 FHBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1NS(=O)(=O)c1ccc(F)c(F)c1 ZINC000134066329 929832901 /nfs/dbraw/zinc/83/29/01/929832901.db2.gz BKWQPWOUDFWNOU-UHFFFAOYSA-N 0 0 362.741 3.636 20 5 FHBDRN CC[C@@H]1CCC[C@H]1NC(=O)c1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000155526110 929893966 /nfs/dbraw/zinc/89/39/66/929893966.db2.gz ZDNQNCFJEZSOGC-MWLCHTKSSA-N 0 0 358.341 3.513 20 5 FHBDRN CC(C)=CCSc1ccccc1C(=O)OCCn1ccc([N+](=O)[O-])n1 ZINC000748128285 929919971 /nfs/dbraw/zinc/91/99/71/929919971.db2.gz CSQVYIDVOIMXAE-UHFFFAOYSA-N 0 0 361.423 3.707 20 5 FHBDRN C[C@H]1CN(C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)C[C@H](C)S1 ZINC000610321955 929928253 /nfs/dbraw/zinc/92/82/53/929928253.db2.gz BWJWYZKVRXBWFT-IUCAKERBSA-N 0 0 361.370 3.554 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)OCc1ccc(SC(F)F)cc1 ZINC000044542603 937373401 /nfs/dbraw/zinc/37/34/01/937373401.db2.gz CABNSWKBRMZBNE-UHFFFAOYSA-N 0 0 354.334 3.970 20 5 FHBDRN O=C1OC(c2cccs2)=N/C1=C/c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000255142256 929959353 /nfs/dbraw/zinc/95/93/53/929959353.db2.gz SMCUABNIYNFZQN-JXMROGBWSA-N 0 0 366.301 3.602 20 5 FHBDRN Cc1cc(F)cc(C(=O)OCc2nc(-c3ccsc3)no2)c1[N+](=O)[O-] ZINC000175850206 929965406 /nfs/dbraw/zinc/96/54/06/929965406.db2.gz LBUIDQAHIJTDJR-UHFFFAOYSA-N 0 0 363.326 3.511 20 5 FHBDRN COc1ccccc1CN(CC(=O)Nc1cc([N+](=O)[O-])ccc1C)C1CC1 ZINC000053238173 930036365 /nfs/dbraw/zinc/03/63/65/930036365.db2.gz JXWCNNNKFXXVNP-UHFFFAOYSA-N 0 0 369.421 3.515 20 5 FHBDRN COc1ccccc1C(C)(C)CNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000610042977 930036434 /nfs/dbraw/zinc/03/64/34/930036434.db2.gz RBDKEIWIGPIUQH-UHFFFAOYSA-N 0 0 370.449 3.975 20 5 FHBDRN Cc1ccc(NCCCNC(=O)c2cccc3ncccc32)c([N+](=O)[O-])c1 ZINC000610052622 930042165 /nfs/dbraw/zinc/04/21/65/930042165.db2.gz OOSFMVSNKYXLCT-UHFFFAOYSA-N 0 0 364.405 3.683 20 5 FHBDRN C[C@H](SC1=N[C@H](C)CS1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000155568288 930045104 /nfs/dbraw/zinc/04/51/04/930045104.db2.gz QPRQXGVJDACXQL-SFYZADRCSA-N 0 0 359.860 3.800 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@H](C)Sc1ccc(F)cc1 ZINC001266555112 930058710 /nfs/dbraw/zinc/05/87/10/930058710.db2.gz JRBPQJARORDEID-NSHDSACASA-N 0 0 364.398 3.540 20 5 FHBDRN COc1ccc(CNC(=O)N[C@H](CC2CC2)c2ccccc2)cc1[N+](=O)[O-] ZINC000610348183 930061547 /nfs/dbraw/zinc/06/15/47/930061547.db2.gz BVOUFTQXWILHAI-QGZVFWFLSA-N 0 0 369.421 3.944 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)c1ccnc2cc(Cl)ccc21 ZINC001266555770 930064575 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FHBDRN Cc1ccn(Cc2ccc(OCc3ccccc3)cc2)c(=O)c1[N+](=O)[O-] ZINC000471523507 930146084 /nfs/dbraw/zinc/14/60/84/930146084.db2.gz UEYGOFDLXVMWIP-UHFFFAOYSA-N 0 0 350.374 3.692 20 5 FHBDRN COc1cccc(C2CCN(C(=O)c3cc(C)ccc3[N+](=O)[O-])CC2)c1 ZINC000548050959 930155779 /nfs/dbraw/zinc/15/57/79/930155779.db2.gz VTGWALRZCOSVEM-UHFFFAOYSA-N 0 0 354.406 3.932 20 5 FHBDRN COc1ccc(OCC[N@@H+]2CCS[C@@H](c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000610369721 930173168 /nfs/dbraw/zinc/17/31/68/930173168.db2.gz FOHLBZVCQVLOMA-LJQANCHMSA-N 0 0 374.462 3.772 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])Nc1ccc(F)cc1OCC(F)(F)F ZINC000070867004 930186116 /nfs/dbraw/zinc/18/61/16/930186116.db2.gz BKQBHEDAZGWAGG-UHFFFAOYSA-N 0 0 372.274 3.856 20 5 FHBDRN O=C(Nc1cccc2c[nH]nc21)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000064906338 930193274 /nfs/dbraw/zinc/19/32/74/930193274.db2.gz YOAGIWRIMDPZBW-UHFFFAOYSA-N 0 0 365.374 3.847 20 5 FHBDRN Cc1nc(Cn2c(C)ccc([N+](=O)[O-])c2=O)oc1-c1ccc(Cl)cc1 ZINC000471532668 930198930 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FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)c1cc(-c2ccccc2)no1 ZINC000561011709 930281926 /nfs/dbraw/zinc/28/19/26/930281926.db2.gz ZRBISYBEERKFOV-UHFFFAOYSA-N 0 0 351.362 3.565 20 5 FHBDRN CCCN(C[C@H]1COc2ccccc2O1)C(=O)c1cccc([N+](=O)[O-])c1C ZINC000049958100 930286677 /nfs/dbraw/zinc/28/66/77/930286677.db2.gz POBIWKIKECOHCC-HNNXBMFYSA-N 0 0 370.405 3.595 20 5 FHBDRN Cc1ccc2c(c1)CC[C@H]2NC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000536010880 937402240 /nfs/dbraw/zinc/40/22/40/937402240.db2.gz DBPKWOGFPAYGLZ-GOSISDBHSA-N 0 0 351.406 3.658 20 5 FHBDRN COc1cccc([C@H](C)N2CCN(Cc3ccc(F)cc3[N+](=O)[O-])CC2)c1 ZINC001167360843 930313972 /nfs/dbraw/zinc/31/39/72/930313972.db2.gz SIKSDTZTCGKZBK-HNNXBMFYSA-N 0 0 373.428 3.621 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])N[C@H]1CC[C@@H](c2ccc(F)cc2)C1 ZINC000471545792 930344555 /nfs/dbraw/zinc/34/45/55/930344555.db2.gz CTXPHVROLZYGMZ-WBVHZDCISA-N 0 0 372.396 3.955 20 5 FHBDRN C[C@@H]1C[C@H]1c1ccc(CNC(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)o1 ZINC000536011138 937408615 /nfs/dbraw/zinc/40/86/15/937408615.db2.gz IOTBTIVPWRDOMB-MLGOLLRUSA-N 0 0 355.394 3.579 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cn1)N1CCc2ccccc2[C@H]1c1ccccc1 ZINC000583400336 937410286 /nfs/dbraw/zinc/41/02/86/937410286.db2.gz NHYQGWWNFZETAQ-HXUWFJFHSA-N 0 0 359.385 3.778 20 5 FHBDRN COc1ccc(NC(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)c2cccnc12 ZINC000580239873 930392986 /nfs/dbraw/zinc/39/29/86/930392986.db2.gz RTLMIVWMKRUFQU-UHFFFAOYSA-N 0 0 373.315 3.611 20 5 FHBDRN O=C(NCCc1csc2ccccc12)NCCc1cccc([N+](=O)[O-])c1 ZINC000536173616 930405535 /nfs/dbraw/zinc/40/55/35/930405535.db2.gz RQJWJZFKCWAPKZ-UHFFFAOYSA-N 0 0 369.446 3.894 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccc(F)cc1Br ZINC000317356990 930415010 /nfs/dbraw/zinc/41/50/10/930415010.db2.gz ACKVAWRCWBQZNN-UHFFFAOYSA-N 0 0 369.146 3.757 20 5 FHBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)NC/C=C\c1ccccc1 ZINC000255291043 930416311 /nfs/dbraw/zinc/41/63/11/930416311.db2.gz YUVBVAJOGUCUDO-FLIBITNWSA-N 0 0 368.436 3.984 20 5 FHBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)c1cccc(-c2cscn2)c1 ZINC000536240620 930441278 /nfs/dbraw/zinc/44/12/78/930441278.db2.gz TXEKSHCMGNTHJO-UHFFFAOYSA-N 0 0 353.403 3.691 20 5 FHBDRN CCOc1ccc(C(=O)Nc2cnn(-c3ccccc3F)c2)cc1[N+](=O)[O-] ZINC000118941425 930447900 /nfs/dbraw/zinc/44/79/00/930447900.db2.gz GYFCXPAVYFCWEZ-UHFFFAOYSA-N 0 0 370.340 3.571 20 5 FHBDRN COc1cc(C(=O)NC2(c3ccccc3)CCCC2)c([N+](=O)[O-])cc1OC ZINC000070956088 930449578 /nfs/dbraw/zinc/44/95/78/930449578.db2.gz ZKVNDUOXNGJWRM-UHFFFAOYSA-N 0 0 370.405 3.811 20 5 FHBDRN C[C@H](NC(=O)Nc1nnc(-c2ccco2)s1)c1cccc([N+](=O)[O-])c1 ZINC000047785895 930456168 /nfs/dbraw/zinc/45/61/68/930456168.db2.gz LGCHPSMJVPDLQV-VIFPVBQESA-N 0 0 359.367 3.589 20 5 FHBDRN C[C@@H]1C[C@@H](Nc2cc(C(=O)[O-])ccc2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1 ZINC000379603565 930473392 /nfs/dbraw/zinc/47/33/92/930473392.db2.gz FXIKZYQYUMFVRW-PBHICJAKSA-N 0 0 369.421 3.758 20 5 FHBDRN Cc1sc(NC(=O)CCCn2cccn2)nc1-c1cccc([N+](=O)[O-])c1 ZINC000064933465 930503505 /nfs/dbraw/zinc/50/35/05/930503505.db2.gz GKKOMNBKNQAGLM-UHFFFAOYSA-N 0 0 371.422 3.642 20 5 FHBDRN O=[N+]([O-])c1nn(CCOc2cccc3ccccc32)cc1Br ZINC000064927931 930504067 /nfs/dbraw/zinc/50/40/67/930504067.db2.gz CUSCQCXLIODFBZ-UHFFFAOYSA-N 0 0 362.183 3.786 20 5 FHBDRN Cn1c(CCNc2ccc3ncccc3c2[N+](=O)[O-])nc2ccc(F)cc21 ZINC000119001837 930508246 /nfs/dbraw/zinc/50/82/46/930508246.db2.gz ARRIYSBGCULMMQ-UHFFFAOYSA-N 0 0 365.368 3.823 20 5 FHBDRN C[C@H](NC(=O)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12)[C@H]1CCOC1 ZINC000275844389 930524760 /nfs/dbraw/zinc/52/47/60/930524760.db2.gz WFIQILKCQYPXHH-QWRGUYRKSA-N 0 0 372.371 3.527 20 5 FHBDRN Cc1cnc([C@H](C)CNC(=O)c2c(C)cc(Cl)cc2[N+](=O)[O-])s1 ZINC000275861861 930553115 /nfs/dbraw/zinc/55/31/15/930553115.db2.gz ZNEBZFZINAJLPP-SECBINFHSA-N 0 0 353.831 3.855 20 5 FHBDRN CN(Cc1cc(Cl)cn1C)Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000091931502 930564092 /nfs/dbraw/zinc/56/40/92/930564092.db2.gz WIYIJYHCPSFQLT-UHFFFAOYSA-N 0 0 359.760 3.820 20 5 FHBDRN O=C(N[C@@H]1CCC[C@@H]1F)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12 ZINC000580354840 930564338 /nfs/dbraw/zinc/56/43/38/930564338.db2.gz WDUUPAFDCDBAGT-GOEBONIOSA-N 0 0 360.335 3.580 20 5 FHBDRN CCc1ccc(C(=O)NCc2ccccc2N2CCCC2)cc1[N+](=O)[O-] ZINC000610436062 930570863 /nfs/dbraw/zinc/57/08/63/930570863.db2.gz JFZNXQULDKYAAH-UHFFFAOYSA-N 0 0 353.422 3.687 20 5 FHBDRN COc1ccc2c(c1)[C@@H](c1nc(Cc3cccc([N+](=O)[O-])c3C)no1)CC2 ZINC000580362132 930574136 /nfs/dbraw/zinc/57/41/36/930574136.db2.gz BBROTZHQPRPUEA-INIZCTEOSA-N 0 0 365.389 3.964 20 5 FHBDRN CCc1ccc(C(=O)NCc2ccccc2-n2ccnc2C)cc1[N+](=O)[O-] ZINC000610436463 930575779 /nfs/dbraw/zinc/57/57/79/930575779.db2.gz DBPMSXXKEXDAMQ-UHFFFAOYSA-N 0 0 364.405 3.581 20 5 FHBDRN O=C(NCC1(O)CCCCC1)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000610112992 930578837 /nfs/dbraw/zinc/57/88/37/930578837.db2.gz QAHNNGWQYRHRDQ-UHFFFAOYSA-N 0 0 369.421 3.763 20 5 FHBDRN CCc1ccc(C(=O)NCCc2c[nH]c3ccc(OC)cc23)cc1[N+](=O)[O-] ZINC000610437061 930579892 /nfs/dbraw/zinc/57/98/92/930579892.db2.gz NSOCHBIHCSNBMV-UHFFFAOYSA-N 0 0 367.405 3.620 20 5 FHBDRN Cn1cccc1[C@@H]1CCCCN1C(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000610438301 930593902 /nfs/dbraw/zinc/59/39/02/930593902.db2.gz SKNFCQBUTLEUSM-SFHVURJKSA-N 0 0 352.394 3.782 20 5 FHBDRN Cn1cccc1[C@H]1CCCCN1C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000610438309 930594367 /nfs/dbraw/zinc/59/43/67/930594367.db2.gz VIOVZBSYUTUPJI-MRXNPFEDSA-N 0 0 352.394 3.782 20 5 FHBDRN COc1cccc([N+](=O)[O-])c1NCC1CCN(C(=O)c2ccccc2)CC1 ZINC000579613529 930614580 /nfs/dbraw/zinc/61/45/80/930614580.db2.gz SFYPTLNYLFXLKT-UHFFFAOYSA-N 0 0 369.421 3.568 20 5 FHBDRN Cc1ccc(OC[C@@H](C)NC(=O)CCc2cc(F)ccc2[N+](=O)[O-])cc1 ZINC001125449794 930713784 /nfs/dbraw/zinc/71/37/84/930713784.db2.gz DHJJWPNIDZRHIB-CQSZACIVSA-N 0 0 360.385 3.559 20 5 FHBDRN Cc1c2ccccc2n(C)c1CNC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000548100463 930719436 /nfs/dbraw/zinc/71/94/36/930719436.db2.gz AEQMPSPAOQYMFD-CYBMUJFWSA-N 0 0 351.406 3.815 20 5 FHBDRN O=C(Nc1cc2c(cc1[N+](=O)[O-])OCCCO2)c1ccnc2ccccc21 ZINC000119125077 930719860 /nfs/dbraw/zinc/71/98/60/930719860.db2.gz NRSHMDIYEHQAIV-UHFFFAOYSA-N 0 0 365.345 3.557 20 5 FHBDRN CCOc1ccccc1CNC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000119141229 930728923 /nfs/dbraw/zinc/72/89/23/930728923.db2.gz LVRTWHUZNPESEP-UHFFFAOYSA-N 0 0 369.421 3.868 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(N[C@@H]2CCc3sc(Cl)cc32)n1 ZINC000580505004 930778039 /nfs/dbraw/zinc/77/80/39/930778039.db2.gz YSNCQGDFXCMQBO-MRVPVSSYSA-N 0 0 353.787 3.591 20 5 FHBDRN C[C@H](CNC(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)CC(F)(F)F ZINC000579686125 930779032 /nfs/dbraw/zinc/77/90/32/930779032.db2.gz PZTDGALWHMSLRB-JTQLQIEISA-N 0 0 372.347 3.506 20 5 FHBDRN COc1cccc(CNC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)c1 ZINC000050288117 930819534 /nfs/dbraw/zinc/81/95/34/930819534.db2.gz VPEYEEMRKIDMHP-UHFFFAOYSA-N 0 0 369.402 3.657 20 5 FHBDRN O=C(Nc1nc2c(s1)CCC2)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000050294243 930823483 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FHBDRN CC(C)[C@H]1C[C@@H](NC(=O)c2ccnc(-c3ccccc3)c2[N+](=O)[O-])CCO1 ZINC001266623282 930871284 /nfs/dbraw/zinc/87/12/84/930871284.db2.gz LBFBDYBUNYTNRT-DOTOQJQBSA-N 0 0 369.421 3.590 20 5 FHBDRN O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)NCCCSc1ccccc1 ZINC000580595562 930903138 /nfs/dbraw/zinc/90/31/38/930903138.db2.gz LVCSEJZPFDSZKE-UHFFFAOYSA-N 0 0 366.389 3.714 20 5 FHBDRN CCSCc1noc(-c2cc([N+](=O)[O-])cc(Br)c2C)n1 ZINC000564608922 930904902 /nfs/dbraw/zinc/90/49/02/930904902.db2.gz DGMZJSNUESGXNY-UHFFFAOYSA-N 0 0 358.217 3.969 20 5 FHBDRN CCCC[C@@H](NC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1)C(=O)OC ZINC000275925875 930941575 /nfs/dbraw/zinc/94/15/75/930941575.db2.gz HENSKBIAAJSFGR-GOSISDBHSA-N 0 0 366.417 3.555 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)NCc2cccc(OC(F)F)c2)c1 ZINC000050367622 930961732 /nfs/dbraw/zinc/96/17/32/930961732.db2.gz HHDRXKCMGXKYSY-UHFFFAOYSA-N 0 0 368.361 3.848 20 5 FHBDRN O=C(Nc1ccc(F)cc1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000047977597 930963599 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FHBDRN CN(C(=O)c1ccc([N+](=O)[O-])c(Cl)c1)c1ccc(-c2ccccc2)nn1 ZINC000160620163 931080261 /nfs/dbraw/zinc/08/02/61/931080261.db2.gz UCAHXCCVFXMBNS-UHFFFAOYSA-N 0 0 368.780 3.982 20 5 FHBDRN Cc1nn(CCC(=O)N2[C@H](C)C[C@H](c3ccccc3)[C@H]2C)c(C)c1[N+](=O)[O-] ZINC000247285017 931081346 /nfs/dbraw/zinc/08/13/46/931081346.db2.gz GCMWLMMFJNUFKY-SIIHOXLZSA-N 0 0 370.453 3.591 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1Nc1ccc(-n2cnc(Br)n2)cc1 ZINC001211290231 931083504 /nfs/dbraw/zinc/08/35/04/931083504.db2.gz ULQGRKZISONHFN-UHFFFAOYSA-N 0 0 374.198 3.990 20 5 FHBDRN O=C(O[C@@H](c1cccnc1)c1ccccc1[N+](=O)[O-])c1cnc(C2CC2)o1 ZINC001266649912 931136275 /nfs/dbraw/zinc/13/62/75/931136275.db2.gz ZRIJLPXGQQERJY-KRWDZBQOSA-N 0 0 365.345 3.802 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)ccc1N1CCC[C@@H](c2nnc3ccccn32)C1 ZINC000247306700 931148725 /nfs/dbraw/zinc/14/87/25/931148725.db2.gz GZYYXNCSBKRWRH-GFCCVEGCSA-N 0 0 357.801 3.675 20 5 FHBDRN CC(C)(C)c1ccccc1NCC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000579871785 931170329 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Cc1ccc([C@@H](C)NC(=O)C[C@H]2OCCc3ccccc32)cc1[N+](=O)[O-] ZINC000177862378 931331639 /nfs/dbraw/zinc/33/16/39/931331639.db2.gz JIEZKNXCOKKLOT-AUUYWEPGSA-N 0 0 354.406 3.785 20 5 FHBDRN COc1cc(C(=O)NC(C)(C)CCc2ccccc2)cc([N+](=O)[O-])c1OC ZINC000610173996 931340099 /nfs/dbraw/zinc/34/00/99/931340099.db2.gz DWJNEZDRURXHQV-UHFFFAOYSA-N 0 0 372.421 3.753 20 5 FHBDRN Cc1ccc(CN(C(=O)COc2cc(Cl)ccc2[N+](=O)[O-])C2CC2)o1 ZINC000121252996 931345296 /nfs/dbraw/zinc/34/52/96/931345296.db2.gz CBHLJEXEVDPHCG-UHFFFAOYSA-N 0 0 364.785 3.720 20 5 FHBDRN CN1C(=O)c2cc(Br)ccc2N[C@H]1c1cccc([N+](=O)[O-])c1 ZINC000135078618 931367207 /nfs/dbraw/zinc/36/72/07/931367207.db2.gz GMQPHSAZWWFCEU-CQSZACIVSA-N 0 0 362.183 3.554 20 5 FHBDRN CC1=NN(c2ccc(C(=O)N[C@H](C)c3ccc(C)c([N+](=O)[O-])c3)cc2)CC1 ZINC000177866711 931390060 /nfs/dbraw/zinc/39/00/60/931390060.db2.gz PTDDBFPKCXYQGO-OAHLLOKOSA-N 0 0 366.421 3.980 20 5 FHBDRN COCc1cccc(CNC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)c1 ZINC000126112938 931398542 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3.883 20 5 FHBDRN C[C@@]1(c2ccccc2)CN(C(=O)c2ccc(Cl)cc2[N+](=O)[O-])CCO1 ZINC000156815973 931559348 /nfs/dbraw/zinc/55/93/48/931559348.db2.gz NAOBEBMRKKPEHJ-SFHVURJKSA-N 0 0 360.797 3.636 20 5 FHBDRN C[C@H]1CCN(C(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)C[C@@H]1n1ccnc1 ZINC000126190607 931560073 /nfs/dbraw/zinc/56/00/73/931560073.db2.gz ZBSQIJVZYJTEEM-KSSFIOAISA-N 0 0 370.453 3.812 20 5 FHBDRN Cc1cc(NC[C@@H](CO)Cc2ccco2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000581104460 931570421 /nfs/dbraw/zinc/57/04/21/931570421.db2.gz SFCSWUUWMJXIRV-NSHDSACASA-N 0 0 358.316 3.778 20 5 FHBDRN O=C(Cc1ccc(Br)cc1F)OCc1cccc([N+](=O)[O-])c1 ZINC001125485386 931571247 /nfs/dbraw/zinc/57/12/47/931571247.db2.gz KKVSSDCEPVHIAJ-UHFFFAOYSA-N 0 0 368.158 3.782 20 5 FHBDRN Cc1coc(-c2cc(NC(=O)c3cc([N+](=O)[O-])ccc3N)ccc2C)n1 ZINC000187380112 931587657 /nfs/dbraw/zinc/58/76/57/931587657.db2.gz MCFBEVSXGMHLMF-UHFFFAOYSA-N 0 0 352.350 3.701 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CCCO[C@H]2CC(C)C)c1 ZINC000187383436 931589017 /nfs/dbraw/zinc/58/90/17/931589017.db2.gz CZZKBWBGWMCQAP-HOCLYGCPSA-N 0 0 352.456 3.640 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)c1cc(C(F)(F)F)ccc1F ZINC000177927106 931597996 /nfs/dbraw/zinc/59/79/96/931597996.db2.gz KLBVDSDEHVVOMF-UHFFFAOYSA-N 0 0 372.274 3.691 20 5 FHBDRN Cc1noc(C)c1N(C)C(=O)c1ccc(N2CCC[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000610483348 931603920 /nfs/dbraw/zinc/60/39/20/931603920.db2.gz QALRIPOWZBUULW-GFCCVEGCSA-N 0 0 372.425 3.713 20 5 FHBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])c1ccc2cccnc2c1 ZINC001266677986 931610593 /nfs/dbraw/zinc/61/05/93/931610593.db2.gz UHGOEXMPCNWYSR-UHFFFAOYSA-N 0 0 355.781 3.769 20 5 FHBDRN Cc1nc(COC(=O)c2ccc(Br)c([N+](=O)[O-])c2)c(C)s1 ZINC000157793019 931648958 /nfs/dbraw/zinc/64/89/58/931648958.db2.gz QBHFONCXRVXMKE-UHFFFAOYSA-N 0 0 371.212 3.788 20 5 FHBDRN Cn1ccnc1[C@@H](NCCc1ccc(F)c(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000561314290 931668488 /nfs/dbraw/zinc/66/84/88/931668488.db2.gz FJCMEPHZBMPDMK-SFHVURJKSA-N 0 0 372.375 3.528 20 5 FHBDRN C[C@@]1(NC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)CCO[C@H]1C1CC1 ZINC000276049920 931685585 /nfs/dbraw/zinc/68/55/85/931685585.db2.gz YTTJXMDSZYWCFV-RBBKRZOGSA-N 0 0 362.429 3.781 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N1CCCN(c2ccccc2)CC1 ZINC000581221316 931695946 /nfs/dbraw/zinc/69/59/46/931695946.db2.gz QZJPGCFGCIUGDV-UHFFFAOYSA-N 0 0 368.437 3.901 20 5 FHBDRN O=C(NCc1nc2ccccc2s1)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000048297228 931712827 /nfs/dbraw/zinc/71/28/27/931712827.db2.gz YHJCLHGLWKMOOK-UHFFFAOYSA-N 0 0 352.375 3.616 20 5 FHBDRN Cc1cc(S(=O)(=O)N(C)c2ccc(OC(C)C)cc2)c([N+](=O)[O-])s1 ZINC001211510441 931714385 /nfs/dbraw/zinc/71/43/85/931714385.db2.gz UIZLDEDUKXNMGA-UHFFFAOYSA-N 0 0 370.452 3.577 20 5 FHBDRN COc1ccc(-n2c(C)nnc2SCc2c(F)cccc2[N+](=O)[O-])cc1 ZINC000477040364 931725282 /nfs/dbraw/zinc/72/52/82/931725282.db2.gz BCMJOJZJQHEABI-UHFFFAOYSA-N 0 0 374.397 3.924 20 5 FHBDRN NC(=O)c1ccc(N[C@H]2CC=C(c3ccc(F)cc3)CC2)c([N+](=O)[O-])c1 ZINC000477050892 931744092 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3.984 20 5 FHBDRN CC(C)(CCC(=O)Nc1n[nH]c(C(F)(F)F)c1-c1ccccc1)[N+](=O)[O-] ZINC001167454597 931833596 /nfs/dbraw/zinc/83/35/96/931833596.db2.gz AFMRGSIOOWOCPN-UHFFFAOYSA-N 0 0 370.331 3.870 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CC[C@@H](c2ccccc2)[C@@H](C)C1 ZINC000581343103 931861074 /nfs/dbraw/zinc/86/10/74/931861074.db2.gz YWZIZDPBHDKXGM-FUHWJXTLSA-N 0 0 367.449 3.967 20 5 FHBDRN Cc1cc(OCC(=O)Nc2nc(CC(C)(C)C)cs2)ccc1[N+](=O)[O-] ZINC001266705110 931863016 /nfs/dbraw/zinc/86/30/16/931863016.db2.gz XMGPBIGMNUBYNS-UHFFFAOYSA-N 0 0 363.439 3.966 20 5 FHBDRN Cc1nn(C(C)(C)C)cc1[C@@H](C)NC(=O)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000156162523 931888087 /nfs/dbraw/zinc/88/80/87/931888087.db2.gz GKGPXYFGNBHPPR-SECBINFHSA-N 0 0 366.368 3.624 20 5 FHBDRN CSCCc1ccc(NC(=O)COc2ccc([N+](=O)[O-])c(C)c2)cc1 ZINC000430567747 931893436 /nfs/dbraw/zinc/89/34/36/931893436.db2.gz JNDOPRKJYFCIGX-UHFFFAOYSA-N 0 0 360.435 3.826 20 5 FHBDRN Cc1ccc(Sc2ccc(C(=O)N(C)C[C@@H](C)O)cc2[N+](=O)[O-])cc1 ZINC000126503995 931904823 /nfs/dbraw/zinc/90/48/23/931904823.db2.gz ICPNPSMJHFCUMA-CYBMUJFWSA-N 0 0 360.435 3.507 20 5 FHBDRN C[C@@H](CNC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12)Sc1ccccc1 ZINC000610296249 931948933 /nfs/dbraw/zinc/94/89/33/931948933.db2.gz BDMMKNJNADHZEQ-LBPRGKRZSA-N 0 0 355.419 3.987 20 5 FHBDRN COc1ccc(CC(=O)NC[C@@H]2CCCC[C@@H]2C(F)(F)F)cc1[N+](=O)[O-] ZINC000610503513 931998948 /nfs/dbraw/zinc/99/89/48/931998948.db2.gz CPKPVLPMMNGTMX-STQMWFEESA-N 0 0 374.359 3.631 20 5 FHBDRN Cc1ccc(-c2cc(C(=O)N(C)Cc3ccccc3[N+](=O)[O-])on2)cc1 ZINC000033168528 932025219 /nfs/dbraw/zinc/02/52/19/932025219.db2.gz SFIMYTSKPZQDAV-UHFFFAOYSA-N 0 0 351.362 3.830 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)C1CC(OCc2ccccc2)C1 ZINC000610465886 932039077 /nfs/dbraw/zinc/03/90/77/932039077.db2.gz HXDABPWITSYSNO-UHFFFAOYSA-N 0 0 354.406 3.549 20 5 FHBDRN COc1ccccc1[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2SC)C1 ZINC000933284795 932039786 /nfs/dbraw/zinc/03/97/86/932039786.db2.gz 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Cc1csc([C@@H]2CCCN(Cc3nc4cc([N+](=O)[O-])ccc4[nH]3)C2)n1 ZINC000581467716 932104371 /nfs/dbraw/zinc/10/43/71/932104371.db2.gz CQGNWNLIGVZCII-GFCCVEGCSA-N 0 0 357.439 3.616 20 5 FHBDRN Cc1cc(C)c(NC(=O)CN(C)Cc2ccc([N+](=O)[O-])c(F)c2)c(C)c1 ZINC000276289462 932146665 /nfs/dbraw/zinc/14/66/65/932146665.db2.gz HJLPXJREDUXVJQ-UHFFFAOYSA-N 0 0 359.401 3.730 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(F)cc1Br ZINC000125099922 932153041 /nfs/dbraw/zinc/15/30/41/932153041.db2.gz ARSCIDVAOWWPLS-UHFFFAOYSA-N 0 0 369.146 3.757 20 5 FHBDRN Cc1ccc(NCCCNC(=O)N2CCC[C@@H]2c2ccc[nH]2)c([N+](=O)[O-])c1 ZINC000121396849 932167721 /nfs/dbraw/zinc/16/77/21/932167721.db2.gz PYSNFUHFISFRJM-QGZVFWFLSA-N 0 0 371.441 3.580 20 5 FHBDRN O=C(N[C@H]1CCc2cc(F)ccc21)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000126602328 932265691 /nfs/dbraw/zinc/26/56/91/932265691.db2.gz BNGAWNCEPDCZAB-INIZCTEOSA-N 0 0 351.337 3.699 20 5 FHBDRN CCC1(CC)[C@H](NC(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)[C@H](C)[C@@H]1OC ZINC001266763088 932273453 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359.348 3.510 20 5 FHBDRN CO[C@@H]1CC[C@H]1N(C)C(=O)Nc1cc([N+](=O)[O-])cc(C(F)(F)F)c1C ZINC000933345654 932375522 /nfs/dbraw/zinc/37/55/22/932375522.db2.gz MJZNGDOGTCWETC-CHWSQXEVSA-N 0 0 361.320 3.563 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCCO[C@@H]1c1ccccc1 ZINC000145331243 932383054 /nfs/dbraw/zinc/38/30/54/932383054.db2.gz QGORNPZKQFSRHT-HNAYVOBHSA-N 0 0 370.405 3.501 20 5 FHBDRN C/C(=C\C(=O)NCCCn1cnc2ccccc21)c1ccc([N+](=O)[O-])cc1 ZINC000785056566 932386609 /nfs/dbraw/zinc/38/66/09/932386609.db2.gz AGCQHEOXFDGSPT-FYWRMAATSA-N 0 0 364.405 3.554 20 5 FHBDRN C[C@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1)c1cccc(N2CCCC2=O)c1 ZINC000126726767 932399364 /nfs/dbraw/zinc/39/93/64/932399364.db2.gz AYTNUZJHNKBKHD-ZDUSSCGKSA-N 0 0 368.393 3.604 20 5 FHBDRN COC(=O)c1ccc(C(C)C)c(NC(=O)Cc2cccc([N+](=O)[O-])c2C)c1 ZINC000467081051 932459190 /nfs/dbraw/zinc/45/91/90/932459190.db2.gz XOGHCRRPGGQLMG-UHFFFAOYSA-N 0 0 370.405 3.994 20 5 FHBDRN COc1cc(N[C@@H]2CCCN(c3ccc([N+](=O)[O-])s3)C2)cc(OC)c1 ZINC000610735624 932479891 /nfs/dbraw/zinc/47/98/91/932479891.db2.gz QTUIGIPMRQUSJV-GFCCVEGCSA-N 0 0 363.439 3.754 20 5 FHBDRN CCCC1(CNC(=O)c2cc(OCC)c(OC)cc2[N+](=O)[O-])CCC1 ZINC000157392542 932490629 /nfs/dbraw/zinc/49/06/29/932490629.db2.gz OGMZOCRIGWRCRZ-UHFFFAOYSA-N 0 0 350.415 3.702 20 5 FHBDRN CC[C@@H](C)Oc1ccccc1/C=C\C(=O)OCCn1c(C)ncc1[N+](=O)[O-] ZINC000255363752 932504719 /nfs/dbraw/zinc/50/47/19/932504719.db2.gz DBQJQFVDOJLAHL-CFYYFVFUSA-N 0 0 373.409 3.534 20 5 FHBDRN C[C@@H](SCC(=O)NCc1ccc([N+](=O)[O-])cc1)c1nc2ccccc2[nH]1 ZINC000097207011 932511248 /nfs/dbraw/zinc/51/12/48/932511248.db2.gz WGLIIAAAHPDXON-GFCCVEGCSA-N 0 0 370.434 3.582 20 5 FHBDRN CCOc1cc(COc2ccc3c(c2)CCCC(=O)N3)ccc1[N+](=O)[O-] ZINC000581695528 932513209 /nfs/dbraw/zinc/51/32/09/932513209.db2.gz OBVNOTDKMLHCAI-UHFFFAOYSA-N 0 0 356.378 3.847 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)NC[C@@H](C)Oc1cccc(F)c1 ZINC000477372506 932522872 /nfs/dbraw/zinc/52/28/72/932522872.db2.gz LWQDUXSICMLFLN-LLVKDONJSA-N 0 0 366.776 3.893 20 5 FHBDRN C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000477397084 932542613 /nfs/dbraw/zinc/54/26/13/932542613.db2.gz HNYUHRFRWSVRCL-KOLCDFICSA-N 0 0 355.316 3.879 20 5 FHBDRN C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000477401201 932543166 /nfs/dbraw/zinc/54/31/66/932543166.db2.gz SBHSNWVEZLBQAB-FZMZJTMJSA-N 0 0 369.343 3.739 20 5 FHBDRN CCOc1cc(CNc2cccc3c2CCN3C(C)=O)ccc1[N+](=O)[O-] ZINC000581719355 932553411 /nfs/dbraw/zinc/55/34/11/932553411.db2.gz HSJQZPXETJDORR-UHFFFAOYSA-N 0 0 355.394 3.515 20 5 FHBDRN CCN(Cc1ccc(OC)cc1)C(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000130036783 932568536 /nfs/dbraw/zinc/56/85/36/932568536.db2.gz PMGQHQGVQDLVFD-UHFFFAOYSA-N 0 0 353.378 3.747 20 5 FHBDRN O=C(N[C@@H]1[C@@H]2Cc3ccccc3[C@@H]21)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000178129486 932605399 /nfs/dbraw/zinc/60/53/99/932605399.db2.gz JPIGXRRBYXZBGU-FHLIZLRMSA-N 0 0 350.399 3.878 20 5 FHBDRN 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COc1cc(CNc2nc(C)ccc2[N+](=O)[O-])ccc1OCC(F)(F)F ZINC000178175154 932757661 /nfs/dbraw/zinc/75/76/61/932757661.db2.gz GYDHXAFYMVFIDJ-UHFFFAOYSA-N 0 0 371.315 3.860 20 5 FHBDRN CCS[C@@H]1CCCC[C@@H]1NC(=O)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000561583638 932764332 /nfs/dbraw/zinc/76/43/32/932764332.db2.gz HMAFYVAZLZOKGJ-DOTOQJQBSA-N 0 0 365.499 3.843 20 5 FHBDRN O=[N+]([O-])c1ccc(NCCOc2ncccc2Cl)cc1OC(F)F ZINC000471743590 932770551 /nfs/dbraw/zinc/77/05/51/932770551.db2.gz HAWQABKYNRULJX-UHFFFAOYSA-N 0 0 359.716 3.736 20 5 FHBDRN CSc1ccncc1NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000610545235 932777848 /nfs/dbraw/zinc/77/78/48/932777848.db2.gz HFAFXSOJGHTEOP-UHFFFAOYSA-N 0 0 372.450 3.567 20 5 FHBDRN Cc1nc(N[C@@H]2CCc3nc(-c4ccccc4)ncc3C2)ccc1[N+](=O)[O-] ZINC000610754880 932790502 /nfs/dbraw/zinc/79/05/02/932790502.db2.gz HCUDWSSTSBSETL-MRXNPFEDSA-N 0 0 361.405 3.725 20 5 FHBDRN COc1ccc(N(C)C(=O)c2cc([N+](=O)[O-])ccc2SC)cc1OC ZINC001125537421 932801414 /nfs/dbraw/zinc/80/14/14/932801414.db2.gz WQRCHXFUQBCSCI-UHFFFAOYSA-N 0 0 362.407 3.611 20 5 FHBDRN CC[C@H](OC(=O)[C@@H](C)OC[C@H]1CCCCO1)c1cccc([N+](=O)[O-])c1 ZINC001266835577 932811096 /nfs/dbraw/zinc/81/10/96/932811096.db2.gz IQGZKMNFNZFKER-XYPHTWIQSA-N 0 0 351.399 3.563 20 5 FHBDRN O=C(Oc1ccc(Cl)c(F)c1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC001266838238 932816536 /nfs/dbraw/zinc/81/65/36/932816536.db2.gz HHQUMOPLQPZCAC-UHFFFAOYSA-N 0 0 361.716 3.792 20 5 FHBDRN O=C(Nc1ccc(F)c(Br)c1)c1cc(F)cc([N+](=O)[O-])c1 ZINC000135314372 932849984 /nfs/dbraw/zinc/84/99/84/932849984.db2.gz HGYROCCMLLVQEN-UHFFFAOYSA-N 0 0 357.110 3.888 20 5 FHBDRN CCOc1ccccc1CNC(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000175957375 932850554 /nfs/dbraw/zinc/85/05/54/932850554.db2.gz MQPJMZTTZVCNCF-AWEZNQCLSA-N 0 0 357.410 3.862 20 5 FHBDRN O=C(NCCCCCc1ccc(F)cc1)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000548296936 932873121 /nfs/dbraw/zinc/87/31/21/932873121.db2.gz JNJCWTZCQYBOGZ-UHFFFAOYSA-N 0 0 374.368 3.605 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)N[C@@H](C)Cc2ccc(O)cc2)cc1[N+](=O)[O-] ZINC000175970193 932891204 /nfs/dbraw/zinc/89/12/04/932891204.db2.gz LYVYPIWPOQDYLK-UONOGXRCSA-N 0 0 357.410 3.600 20 5 FHBDRN COCCOCCCCNc1cc(C)c([N+](=O)[O-])cc1Br ZINC000234651464 932894769 /nfs/dbraw/zinc/89/47/69/932894769.db2.gz AADUOBAHDMNVPA-UHFFFAOYSA-N 0 0 361.236 3.521 20 5 FHBDRN C[C@@H]1C[C@H](NC(=O)OC(C)(C)C)CCN1Cc1ccc([N+](=O)[O-])cc1F ZINC000134664328 932896958 /nfs/dbraw/zinc/89/69/58/932896958.db2.gz GRKIKEOHDTUWGB-TZMCWYRMSA-N 0 0 367.421 3.612 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)/C(C)=C\c1ccc([N+](=O)[O-])cc1 ZINC000588435844 932938396 /nfs/dbraw/zinc/93/83/96/932938396.db2.gz LIKJESFFZHSXAE-LUAWRHEFSA-N 0 0 357.322 3.554 20 5 FHBDRN O=C(NCCc1c[nH]c2ccc(Cl)cc12)NCc1cccc([N+](=O)[O-])c1 ZINC000175976198 932948443 /nfs/dbraw/zinc/94/84/43/932948443.db2.gz KTXKBYOBEOHIQF-UHFFFAOYSA-N 0 0 372.812 3.771 20 5 FHBDRN CC(=O)Nc1cccc([C@H](C)NC(=O)/C(C)=C\c2ccc([N+](=O)[O-])cc2)c1 ZINC000588436538 932953242 /nfs/dbraw/zinc/95/32/42/932953242.db2.gz ZJBIDONBTXRMNM-FZDNWWAKSA-N 0 0 367.405 3.834 20 5 FHBDRN Cc1ccc(-c2ncco2)cc1NS(=O)(=O)c1cccc([N+](=O)[O-])c1C ZINC000134683535 932959926 /nfs/dbraw/zinc/95/99/26/932959926.db2.gz ZHGRPCLPMYFCFD-UHFFFAOYSA-N 0 0 373.390 3.667 20 5 FHBDRN Cn1cc([C@@H](NC/C=C/c2ccccc2[N+](=O)[O-])c2ccc(F)cc2)cn1 ZINC000187512111 932966053 /nfs/dbraw/zinc/96/60/53/932966053.db2.gz BSZVXHOASMXZIO-XXIDSNJLSA-N 0 0 366.396 3.860 20 5 FHBDRN Cc1ccc(CN[C@H](c2cnn(C)c2)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000187513749 932966395 /nfs/dbraw/zinc/96/63/95/932966395.db2.gz FNQMEYOFVFOWEE-IBGZPJMESA-N 0 0 354.385 3.655 20 5 FHBDRN O=c1c2cc3ccccc3cc2ncn1C[C@H](O)c1ccc(F)cc1F ZINC000051288505 932968602 /nfs/dbraw/zinc/96/86/02/932968602.db2.gz BIWFAJSIDNTTEQ-IBGZPJMESA-N 0 0 352.340 3.562 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC([C@@H]2CCCO2)CC1 ZINC000187514121 932970758 /nfs/dbraw/zinc/97/07/58/932970758.db2.gz ZFLRZJDLIWAAPK-INIZCTEOSA-N 0 0 364.467 3.738 20 5 FHBDRN CCN(C[C@@H]1CCOC1)c1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000610946530 932984085 /nfs/dbraw/zinc/98/40/85/932984085.db2.gz VBJRGVASEIVZPK-HNNXBMFYSA-N 0 0 354.406 3.689 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)c1cnc(Cc2ccccc2)s1 ZINC000175984090 933014635 /nfs/dbraw/zinc/01/46/35/933014635.db2.gz NEAWNKWGDPJQFG-UHFFFAOYSA-N 0 0 353.403 3.572 20 5 FHBDRN Cc1cc2c(cc1C)[C@H](C(=O)NCCCCc1ccc([N+](=O)[O-])cc1)CO2 ZINC000471822623 933050451 /nfs/dbraw/zinc/05/04/51/933050451.db2.gz ONIOKKYCAYNCLP-LJQANCHMSA-N 0 0 368.433 3.827 20 5 FHBDRN COCCOc1ccccc1NC(=O)/C(C)=C\c1ccc([N+](=O)[O-])cc1 ZINC000588437691 933053398 /nfs/dbraw/zinc/05/33/98/933053398.db2.gz IJYDXNVZJWNYNX-YPKPFQOOSA-N 0 0 356.378 3.662 20 5 FHBDRN COCc1cc(CNC(=O)/C(C)=C\c2ccc([N+](=O)[O-])cc2)ccc1F ZINC000588438397 933058429 /nfs/dbraw/zinc/05/84/29/933058429.db2.gz UWOJZIWBWZLNQC-LCYFTJDESA-N 0 0 358.369 3.600 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H]1CCCO[C@@H]1C(C)(C)C ZINC000588438993 933061112 /nfs/dbraw/zinc/06/11/12/933061112.db2.gz IBPAVFIQWXZVGD-JZJXTHMUSA-N 0 0 360.454 3.956 20 5 FHBDRN CC(C)c1ccc(C(=O)N2CCN(C)Cc3ccccc32)cc1[N+](=O)[O-] ZINC000187620493 933066478 /nfs/dbraw/zinc/06/64/78/933066478.db2.gz BVQGOGADUPKIOX-UHFFFAOYSA-N 0 0 353.422 3.810 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccnn1Cc1ccc(C)o1 ZINC000588440622 933070501 /nfs/dbraw/zinc/07/05/01/933070501.db2.gz USWHSQSSIMVZPN-QBFSEMIESA-N 0 0 366.377 3.783 20 5 FHBDRN C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)NCCc1nc2c(s1)CCCC2 ZINC000588441561 933072711 /nfs/dbraw/zinc/07/27/11/933072711.db2.gz ATJHBZAIDKWQLH-OUKQBFOZSA-N 0 0 371.462 3.692 20 5 FHBDRN COC(=O)c1cc(NC(=O)c2cc(C)oc2C(F)(F)F)cc([N+](=O)[O-])c1 ZINC000471835244 933085083 /nfs/dbraw/zinc/08/50/83/933085083.db2.gz GPCIVHVNLDEZEC-UHFFFAOYSA-N 0 0 372.255 3.554 20 5 FHBDRN C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)NCCCc1nc2ccccc2[nH]1 ZINC000588443918 933089288 /nfs/dbraw/zinc/08/92/88/933089288.db2.gz NXZDLQATGKFULE-BUHFOSPRSA-N 0 0 364.405 3.623 20 5 FHBDRN Cc1ccc(Br)c(C(=O)N2CCc3c2cccc3[N+](=O)[O-])c1 ZINC000178303092 933093789 /nfs/dbraw/zinc/09/37/89/933093789.db2.gz DUZOVHPQTJPPLK-UHFFFAOYSA-N 0 0 361.195 3.869 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N(C)Cc1nc2ccccc2n1C ZINC000588445626 933131755 /nfs/dbraw/zinc/13/17/55/933131755.db2.gz SSQUJYFSPPVROO-OWBHPGMISA-N 0 0 364.405 3.543 20 5 FHBDRN CC[C@H](c1ccccc1OC)N(C)C(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000581969038 933142419 /nfs/dbraw/zinc/14/24/19/933142419.db2.gz OHLKSLKNWZKLQV-MRXNPFEDSA-N 0 0 372.421 3.982 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N[C@H](C)C[C@H](O)c1cccs1 ZINC000588447294 933169886 /nfs/dbraw/zinc/16/98/86/933169886.db2.gz MRQPLWGFIZJXBQ-CEXFEBICSA-N 0 0 360.435 3.688 20 5 FHBDRN COC(=O)c1cc(NC(=O)c2cnc(C(C)C)s2)c(C)c([N+](=O)[O-])c1 ZINC000276759147 933177215 /nfs/dbraw/zinc/17/72/15/933177215.db2.gz HMMLSJMTIZYKBY-UHFFFAOYSA-N 0 0 363.395 3.522 20 5 FHBDRN Cc1nn(C)c(C)c1C[C@H](C)c1nc(-c2ccc(C)c([N+](=O)[O-])c2)no1 ZINC000544953090 933185775 /nfs/dbraw/zinc/18/57/75/933185775.db2.gz LPKVMCBYUHUWNX-NSHDSACASA-N 0 0 355.398 3.650 20 5 FHBDRN COC(=O)c1cc(NC(=O)N(C)Cc2ccccc2[N+](=O)[O-])c(C)cc1C ZINC000471858417 933195115 /nfs/dbraw/zinc/19/51/15/933195115.db2.gz SMBUFLKHZMYUBB-UHFFFAOYSA-N 0 0 371.393 3.662 20 5 FHBDRN C[C@@H](c1ccccc1)N(C1CC1)S(=O)(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000510539654 933203053 /nfs/dbraw/zinc/20/30/53/933203053.db2.gz RMFCPKBCUMHJEU-AWEZNQCLSA-N 0 0 360.435 3.650 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N([C@H](C)c1ccccc1)C1CC1 ZINC000510560728 933226905 /nfs/dbraw/zinc/22/69/05/933226905.db2.gz SMGFAHBDQNTLMQ-CQSZACIVSA-N 0 0 360.435 3.818 20 5 FHBDRN COc1cccc2c1CCCCN2C(=O)COc1ccc([N+](=O)[O-])c(C)c1 ZINC000430783948 933228368 /nfs/dbraw/zinc/22/83/68/933228368.db2.gz FYZHVNSSPUTKAP-UHFFFAOYSA-N 0 0 370.405 3.660 20 5 FHBDRN Cc1nc(CC(C)C)c(NC(=O)COc2ccc([N+](=O)[O-])c(C)c2)s1 ZINC000430783423 933236382 /nfs/dbraw/zinc/23/63/82/933236382.db2.gz ZLXXKRQUQKIRCJ-UHFFFAOYSA-N 0 0 363.439 3.884 20 5 FHBDRN Cc1sc(C(=O)N2CC(c3nc4ccccc4s3)C2)cc1[N+](=O)[O-] ZINC000477717848 933238438 /nfs/dbraw/zinc/23/84/38/933238438.db2.gz ONHCOXBPIDOVRF-UHFFFAOYSA-N 0 0 359.432 3.814 20 5 FHBDRN CC(=O)c1ccc([N+](=O)[O-])cc1N1C[C@@H](C)O[C@@H](c2ccc(F)cc2)C1 ZINC000561682319 933239166 /nfs/dbraw/zinc/23/91/66/933239166.db2.gz IJPLNMRLIVNZHM-CWTRNNRKSA-N 0 0 358.369 3.903 20 5 FHBDRN Cc1cc(OCC(=O)N2CC[C@](C)(c3ccc(F)cc3)C2)ccc1[N+](=O)[O-] ZINC000430824846 933267985 /nfs/dbraw/zinc/26/79/85/933267985.db2.gz XLWCZNPXGAKVBF-FQEVSTJZSA-N 0 0 372.396 3.611 20 5 FHBDRN O=C(NCc1c(F)cc(F)c(F)c1F)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000430828054 933273298 /nfs/dbraw/zinc/27/32/98/933273298.db2.gz RDNUVLFWUMFQMX-UHFFFAOYSA-N 0 0 362.666 3.735 20 5 FHBDRN COC(=O)c1cccc(Cl)c1CN(C)CCc1cccc([N+](=O)[O-])c1 ZINC000510610357 933279734 /nfs/dbraw/zinc/27/97/34/933279734.db2.gz XBYOIGAHSRQEPM-UHFFFAOYSA-N 0 0 362.813 3.709 20 5 FHBDRN CC(C)c1cccc(CNC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)c1 ZINC000477738570 933281672 /nfs/dbraw/zinc/28/16/72/933281672.db2.gz DWAYITUIVXPILW-UHFFFAOYSA-N 0 0 353.422 3.986 20 5 FHBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])Nc1cccc2c1CCO2 ZINC000477739685 933285019 /nfs/dbraw/zinc/28/50/19/933285019.db2.gz KDHBZSXFTOPHNG-UHFFFAOYSA-N 0 0 364.810 3.914 20 5 FHBDRN Cc1cc(OCC(=O)N2CC[C@H](c3ccccc3)[C@@H]2C)ccc1[N+](=O)[O-] ZINC000430832779 933285075 /nfs/dbraw/zinc/28/50/75/933285075.db2.gz JFOQSHHGUPGIMV-YJBOKZPZSA-N 0 0 354.406 3.687 20 5 FHBDRN CCOc1ccc(NC(=O)COc2ccc([N+](=O)[O-])c3ncccc23)cc1 ZINC000471869843 933303749 /nfs/dbraw/zinc/30/37/49/933303749.db2.gz CLBUTIRDJANSHD-UHFFFAOYSA-N 0 0 367.361 3.559 20 5 FHBDRN O=C(c1csc(-c2ccc([N+](=O)[O-])cc2)n1)N1C[C@@H]2CCCC[C@@H]2C1 ZINC000178337503 933330275 /nfs/dbraw/zinc/33/02/75/933330275.db2.gz DODFKLNYMAILLL-OKILXGFUSA-N 0 0 357.435 3.981 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(N2CCC(C(=O)Nc3cccc(F)c3)CC2)c1 ZINC000088717739 933350773 /nfs/dbraw/zinc/35/07/73/933350773.db2.gz WWRLNOBFKINDPS-UHFFFAOYSA-N 0 0 357.385 3.897 20 5 FHBDRN C[C@@H]1[C@H](C)SCCN1C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000158003274 933359546 /nfs/dbraw/zinc/35/95/46/933359546.db2.gz LZPWXLXLOYASNY-BDAKNGLRSA-N 0 0 361.370 3.554 20 5 FHBDRN O=C(NCc1ccncc1C(F)(F)F)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000548395020 933364825 /nfs/dbraw/zinc/36/48/25/933364825.db2.gz NIPREFRRONTTPC-UHFFFAOYSA-N 0 0 359.691 3.592 20 5 FHBDRN CCOC(=O)c1ccc(CNc2ccc([N+](=O)[O-])cc2Br)o1 ZINC000610588798 933442878 /nfs/dbraw/zinc/44/28/78/933442878.db2.gz OZQWQYNSMHIVBI-UHFFFAOYSA-N 0 0 369.171 3.739 20 5 FHBDRN Cc1ccc(C[C@@H](C)NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)s1 ZINC000135388901 933444916 /nfs/dbraw/zinc/44/49/16/933444916.db2.gz DVDXPMZXBKBDAR-LLVKDONJSA-N 0 0 357.435 3.736 20 5 FHBDRN Cc1ccc(C(=O)N2C[C@H](C(F)(F)F)[C@H](C(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000610597808 933484268 /nfs/dbraw/zinc/48/42/68/933484268.db2.gz FENCMWVAGVBRCE-AOOOYVTPSA-N 0 0 370.249 3.716 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)C[C@@H](C)C(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000610599103 933492715 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353.422 3.848 20 5 FHBDRN CCc1ccc([C@H]2COCCN2C(=O)c2ccc(CC)c([N+](=O)[O-])c2)o1 ZINC000471903318 933590508 /nfs/dbraw/zinc/59/05/08/933590508.db2.gz RCNCEYMNHXRWPK-QGZVFWFLSA-N 0 0 358.394 3.526 20 5 FHBDRN COc1ccc(C(=O)Nc2cc(F)cc([N+](=O)[O-])c2)c(Br)c1 ZINC000548421458 933592868 /nfs/dbraw/zinc/59/28/68/933592868.db2.gz FXBZJVQHMVRKPK-UHFFFAOYSA-N 0 0 369.146 3.757 20 5 FHBDRN COc1cc(C(=O)OCc2ccc([N+](=O)[O-])cc2)ccc1OC(F)F ZINC000003489776 933598949 /nfs/dbraw/zinc/59/89/49/933598949.db2.gz PZHYAWHVJXFUPF-UHFFFAOYSA-N 0 0 353.277 3.562 20 5 FHBDRN Cn1ncc(NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1C(F)F ZINC000611158658 933606076 /nfs/dbraw/zinc/60/60/76/933606076.db2.gz XJOAXSINIPURNC-UHFFFAOYSA-N 0 0 364.230 3.537 20 5 FHBDRN Cc1nn(C)c(C(=O)N[C@@H](CC(C)(C)C)c2ccc(F)cc2)c1[N+](=O)[O-] ZINC000098099099 933639392 /nfs/dbraw/zinc/63/93/92/933639392.db2.gz SQVMLHVXMHBTRQ-AWEZNQCLSA-N 0 0 362.405 3.683 20 5 FHBDRN Cc1nn(C)c(C(=O)N2CCCCC[C@H]2/C=C\c2ccccc2)c1[N+](=O)[O-] ZINC000610655085 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FHBDRN Cc1ccc([C@H](NS(=O)(=O)CCc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000431096790 933829296 /nfs/dbraw/zinc/82/92/96/933829296.db2.gz KYVIMTWQNBIYNX-IBGZPJMESA-N 0 0 374.462 3.516 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H]1CCC(F)(F)C1 ZINC000431111415 933851935 /nfs/dbraw/zinc/85/19/35/933851935.db2.gz LCOWFYOVYHHVMQ-CQSZACIVSA-N 0 0 355.385 3.950 20 5 FHBDRN CC(C)(C(=O)N[C@@H]1COc2c1cccc2Cl)c1ccc([N+](=O)[O-])cc1 ZINC000610709639 933871900 /nfs/dbraw/zinc/87/19/00/933871900.db2.gz HBLLNDKVUSHFMS-OAHLLOKOSA-N 0 0 360.797 3.776 20 5 FHBDRN CSc1ccc(C(=O)N[C@@H]2COc3c2cccc3Cl)cc1[N+](=O)[O-] ZINC000610709631 933872581 /nfs/dbraw/zinc/87/25/81/933872581.db2.gz GHBFUCJMUMAMGV-GFCCVEGCSA-N 0 0 364.810 3.834 20 5 FHBDRN CC(C)(C)Oc1ccccc1NCC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000178401579 933887146 /nfs/dbraw/zinc/88/71/46/933887146.db2.gz RQRLMDLUPAPMEX-UHFFFAOYSA-N 0 0 369.421 3.773 20 5 FHBDRN CCOC(=O)c1ccnc(N2CCCC[C@@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000544009020 934018626 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FHBDRN COC(=O)/C=C/c1ccc(Oc2ccc3ccc(=O)oc3c2)c([N+](=O)[O-])c1 ZINC000043929728 934111200 /nfs/dbraw/zinc/11/12/00/934111200.db2.gz WEHUOGXTKATQRX-FPYGCLRLSA-N 0 0 367.313 3.680 20 5 FHBDRN O=C(c1csc([N+](=O)[O-])c1)N(Cc1ccccc1)C[C@@H](O)c1ccco1 ZINC000176174485 934135460 /nfs/dbraw/zinc/13/54/60/934135460.db2.gz WNNZELCWWNBEGI-OAHLLOKOSA-N 0 0 372.402 3.625 20 5 FHBDRN O=[N+]([O-])c1cccc2ncnc(N3CCC[C@]4(C3)OCc3ccccc34)c21 ZINC000548485106 934136621 /nfs/dbraw/zinc/13/66/21/934136621.db2.gz LJBQFGSEQYEOBT-HXUWFJFHSA-N 0 0 362.389 3.564 20 5 FHBDRN COc1cc(N2CCC[C@]3(C2)OCc2ccccc23)c(F)cc1[N+](=O)[O-] ZINC000548484974 934137534 /nfs/dbraw/zinc/13/75/34/934137534.db2.gz SQOCASDZSLNRMW-LJQANCHMSA-N 0 0 358.369 3.768 20 5 FHBDRN CCOc1cc(CNc2cc(OC)ccc2NC(C)=O)ccc1[N+](=O)[O-] ZINC000276972740 934177922 /nfs/dbraw/zinc/17/79/22/934177922.db2.gz XEPCRSUIXPOLSC-UHFFFAOYSA-N 0 0 359.382 3.573 20 5 FHBDRN CO[C@@H](CNC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc21)c1ccccc1Cl ZINC000610791585 934205484 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Cc1noc(C)c1C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000431230519 934233782 /nfs/dbraw/zinc/23/37/82/934233782.db2.gz BHBWIYLSBYMYIN-UHFFFAOYSA-N 0 0 354.160 3.523 20 5 FHBDRN CCc1cccnc1C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000431230154 934234528 /nfs/dbraw/zinc/23/45/28/934234528.db2.gz AEJSYBPPSPDKBJ-UHFFFAOYSA-N 0 0 364.199 3.875 20 5 FHBDRN Cc1c(NC(=O)CCc2nccs2)cc(Br)cc1[N+](=O)[O-] ZINC000431238697 934241493 /nfs/dbraw/zinc/24/14/93/934241493.db2.gz PAXDNMHGBDPYCQ-UHFFFAOYSA-N 0 0 370.228 3.694 20 5 FHBDRN COc1cc(C)c(NC(=O)C(C)(C)c2ccccc2[N+](=O)[O-])cc1OC ZINC000431245846 934247236 /nfs/dbraw/zinc/24/72/36/934247236.db2.gz GYWWXARLBJNMCB-UHFFFAOYSA-N 0 0 358.394 3.837 20 5 FHBDRN COc1cccc(C(=O)CCCC(=O)Nc2cc([N+](=O)[O-])ccc2C)c1 ZINC000431252433 934250742 /nfs/dbraw/zinc/25/07/42/934250742.db2.gz KJKFGFDEAFOPOA-UHFFFAOYSA-N 0 0 356.378 3.904 20 5 FHBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])N1CC(C2CCCC2)C1 ZINC000477911964 934264573 /nfs/dbraw/zinc/26/45/73/934264573.db2.gz IODXNANGDOHSCA-UHFFFAOYSA-N 0 0 352.818 3.666 20 5 FHBDRN CC(C)c1nc(CCNC(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)cs1 ZINC000535671948 934266502 /nfs/dbraw/zinc/26/65/02/934266502.db2.gz MMJKIJSKNQQDHW-UHFFFAOYSA-N 0 0 358.423 3.629 20 5 FHBDRN COc1ccc(C2(NC(=O)c3c[nH]c4cccc([N+](=O)[O-])c34)CC2)cc1 ZINC000535702767 934298029 /nfs/dbraw/zinc/29/80/29/934298029.db2.gz WEWADLDVJOZWHR-UHFFFAOYSA-N 0 0 351.362 3.504 20 5 FHBDRN O=C(CCn1cc([N+](=O)[O-])cn1)N1CC2(CCCCC2)[C@@H]1c1ccccc1 ZINC000458102175 934298919 /nfs/dbraw/zinc/29/89/19/934298919.db2.gz ADMVFJDLLNXPSM-IBGZPJMESA-N 0 0 368.437 3.715 20 5 FHBDRN CC(C)[C@@]1(C)C[C@@H]1NC(=O)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000458108161 934306384 /nfs/dbraw/zinc/30/63/84/934306384.db2.gz FDRAJWYIWHUNCR-HRAATJIYSA-N 0 0 352.409 3.985 20 5 FHBDRN C[C@@H](NC(=O)c1cc([N+](=O)[O-])cn1C)[C@H](C)c1ccccc1C(F)(F)F ZINC000535748579 934338178 /nfs/dbraw/zinc/33/81/78/934338178.db2.gz REBFFCCJRCHMNF-WDEREUQCSA-N 0 0 369.343 3.874 20 5 FHBDRN 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FHBDRN O=[N+]([O-])c1cncc(Br)c1N1CCC(c2ccncc2)CC1 ZINC000277224585 934817159 /nfs/dbraw/zinc/81/71/59/934817159.db2.gz SDJZZNNCSSXAJU-UHFFFAOYSA-N 0 0 363.215 3.531 20 5 FHBDRN Cc1nc(-c2ccccc2)sc1[C@@H](C)[N@H+](C)CCn1ccc([N+](=O)[O-])n1 ZINC000119460935 934817635 /nfs/dbraw/zinc/81/76/35/934817635.db2.gz PGYYHNGMHGWJPP-CQSZACIVSA-N 0 0 371.466 3.916 20 5 FHBDRN COc1ccc(C)cc1CN[C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000611560376 934822485 /nfs/dbraw/zinc/82/24/85/934822485.db2.gz HYECFIYDXZNBJD-LJQANCHMSA-N 0 0 366.421 3.525 20 5 FHBDRN COc1ccc(C)cc1CN[C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000611560392 934824454 /nfs/dbraw/zinc/82/44/54/934824454.db2.gz QNBCUUOXYJNXKL-LJQANCHMSA-N 0 0 366.421 3.525 20 5 FHBDRN COc1cccc2c1CC[C@H]2NC(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000119466643 934826272 /nfs/dbraw/zinc/82/62/72/934826272.db2.gz NMWJMSHZVQLULA-SJKOYZFVSA-N 0 0 355.394 3.651 20 5 FHBDRN O=Cc1ccc(OCC(=O)N2CCCCC[C@@H]2c2ccco2)c([N+](=O)[O-])c1 ZINC000119499037 934834983 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CC(C)C[C@@H]1C[C@H](NC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CCO1 ZINC000538523551 934864360 /nfs/dbraw/zinc/86/43/60/934864360.db2.gz COXMOYSWYLWYSK-DGCLKSJQSA-N 0 0 355.822 3.963 20 5 FHBDRN C[C@H]1CC[C@H](C(F)(F)F)CN1C(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000611561829 934866686 /nfs/dbraw/zinc/86/66/86/934866686.db2.gz UTEUZCMKNSNCAY-STQMWFEESA-N 0 0 373.375 3.976 20 5 FHBDRN CCOc1ccc(OCC)c(N[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)c1 ZINC000071808402 934874909 /nfs/dbraw/zinc/87/49/09/934874909.db2.gz SLPDLIGHUWYEPV-ZDUSSCGKSA-N 0 0 373.409 3.831 20 5 FHBDRN O=C(NC[C@@H](c1ccccc1)C(F)(F)F)c1ccc([N+](=O)[O-])cc1F ZINC000187713817 934877867 /nfs/dbraw/zinc/87/78/67/934877867.db2.gz JFCMHDKTGRJICZ-ZDUSSCGKSA-N 0 0 356.275 3.810 20 5 FHBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N1CCCCc2ccccc21 ZINC000119553374 934882471 /nfs/dbraw/zinc/88/24/71/934882471.db2.gz BWBGQBUHRWQCBL-UHFFFAOYSA-N 0 0 366.826 3.780 20 5 FHBDRN CC(C)c1cccc(S(=O)(=O)n2cc(-c3cccc([N+](=O)[O-])c3)cn2)c1 ZINC000538666638 934883484 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FHBDRN C[C@H]1C[C@@H](c2ccccc2)N(S(=O)(=O)CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000511026300 934953425 /nfs/dbraw/zinc/95/34/25/934953425.db2.gz HHQXMITZAVKDQQ-KXBFYZLASA-N 0 0 374.462 3.550 20 5 FHBDRN Cc1cnc(C2CCN(c3cc4c(cc3[N+](=O)[O-])CCC(=O)N4)CC2)s1 ZINC000277325308 934957669 /nfs/dbraw/zinc/95/76/69/934957669.db2.gz CEGDJIASNZBWTF-UHFFFAOYSA-N 0 0 372.450 3.628 20 5 FHBDRN Cc1cc(NCc2nc3cc(Br)cnc3[nH]2)ccc1[N+](=O)[O-] ZINC000538936434 934960472 /nfs/dbraw/zinc/96/04/72/934960472.db2.gz CEXUKTAVBFVMHH-UHFFFAOYSA-N 0 0 362.187 3.549 20 5 FHBDRN Cc1ccc(F)c(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2nc[nH]n2)c1 ZINC000538966374 934969174 /nfs/dbraw/zinc/96/91/74/934969174.db2.gz FPRPBWPTYBGTNB-UHFFFAOYSA-N 0 0 373.369 3.564 20 5 FHBDRN CSc1cccc(C(=O)NC2(c3ccccc3)CCOCC2)c1[N+](=O)[O-] ZINC000548600149 934971152 /nfs/dbraw/zinc/97/11/52/934971152.db2.gz QHWZRXSHEKZCDQ-UHFFFAOYSA-N 0 0 372.446 3.752 20 5 FHBDRN COc1ccc2c(c1)CCCN(C(=S)Nc1ccc([N+](=O)[O-])cc1)C2 ZINC000728448594 934984686 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3.536 20 5 FHBDRN COc1ccc([C@H]2CCCN2C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)nc1 ZINC000892111098 935016743 /nfs/dbraw/zinc/01/67/43/935016743.db2.gz IYBNJTRMSWIARM-SCLBCKFNSA-N 0 0 370.409 3.606 20 5 FHBDRN CCCC[C@@H]1CCC[C@@H]1NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000110726046 945071126 /nfs/dbraw/zinc/07/11/26/945071126.db2.gz MIFSVCTXOWUVDE-PBHICJAKSA-N 0 0 356.426 3.869 20 5 FHBDRN O=[N+]([O-])c1cc(CN2CCC[C@@H]2c2ccc(F)cc2)c2c(c1)COCO2 ZINC000025360079 935071173 /nfs/dbraw/zinc/07/11/73/935071173.db2.gz SKHUVJMGKWPWSZ-GOSISDBHSA-N 0 0 358.369 3.938 20 5 FHBDRN Cc1ccccc1C1(C(=O)NCCNc2ccc([N+](=O)[O-])cc2)CCC1 ZINC000472119848 935082160 /nfs/dbraw/zinc/08/21/60/935082160.db2.gz JMXVOKRWKYOPKJ-UHFFFAOYSA-N 0 0 353.422 3.553 20 5 FHBDRN CC[C@@H](c1ccncc1)N(CC)C(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000157481515 935082713 /nfs/dbraw/zinc/08/27/13/935082713.db2.gz OFRGIFKRXGXURC-HNNXBMFYSA-N 0 0 373.409 3.620 20 5 FHBDRN CCCCOc1cccc(CNC(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)c1 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O=C(CCOc1ccccc1[N+](=O)[O-])N[C@@H]1CC[C@H](c2cccc(F)c2)C1 ZINC000478229511 935589445 /nfs/dbraw/zinc/58/94/45/935589445.db2.gz NHXAGORQYXBOMM-DOTOQJQBSA-N 0 0 372.396 3.955 20 5 FHBDRN CN(C(=O)c1cnn(-c2cccc(Cl)c2)c1)c1cccc([N+](=O)[O-])c1 ZINC000158149877 935593599 /nfs/dbraw/zinc/59/35/99/935593599.db2.gz MBNWNLRKCMLNHM-UHFFFAOYSA-N 0 0 356.769 3.711 20 5 FHBDRN COc1cc(C(=O)Nc2ccc(Br)cc2)cc([N+](=O)[O-])c1C ZINC000478267463 935594786 /nfs/dbraw/zinc/59/47/86/935594786.db2.gz UIQJZTJAFSMXIZ-UHFFFAOYSA-N 0 0 365.183 3.927 20 5 FHBDRN COc1cccc(-c2noc([C@@H](C)NCc3ccc([N+](=O)[O-])cc3F)n2)c1 ZINC000478280470 935605420 /nfs/dbraw/zinc/60/54/20/935605420.db2.gz XEVIUPNZVQBAOV-LLVKDONJSA-N 0 0 372.356 3.643 20 5 FHBDRN O=[N+]([O-])c1cnc(Oc2cncc(Br)c2)c(Br)c1 ZINC000118720574 935611953 /nfs/dbraw/zinc/61/19/53/935611953.db2.gz KJTUVYZASIQECG-UHFFFAOYSA-N 0 0 374.976 3.702 20 5 FHBDRN Cc1c(CNC(=O)NCc2cccc(C(F)(F)F)c2)cccc1[N+](=O)[O-] ZINC000478442004 935626308 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FHBDRN O=C(NCCc1cccc(OCC(F)(F)F)c1)c1ccccc1[N+](=O)[O-] ZINC000478499925 935643552 /nfs/dbraw/zinc/64/35/52/935643552.db2.gz MBRFCZPKUGRRPU-UHFFFAOYSA-N 0 0 368.311 3.508 20 5 FHBDRN O=C(C1CCN(c2ccccc2[N+](=O)[O-])CC1)N(CC1CC1)C1CCC1 ZINC000478590923 935656076 /nfs/dbraw/zinc/65/60/76/935656076.db2.gz WRPSYZBTTRIYFG-UHFFFAOYSA-N 0 0 357.454 3.602 20 5 FHBDRN COc1ccc(NC(=O)c2ccc(Br)cc2C)c([N+](=O)[O-])c1 ZINC000127613072 935660468 /nfs/dbraw/zinc/66/04/68/935660468.db2.gz SGSQKZFJGNEAIC-UHFFFAOYSA-N 0 0 365.183 3.927 20 5 FHBDRN CC(C)(C)CC[C@@H](CO)NC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000478599890 935662597 /nfs/dbraw/zinc/66/25/97/935662597.db2.gz HPUDUQGITYWKJQ-LBPRGKRZSA-N 0 0 374.890 3.644 20 5 FHBDRN CS[C@@H]1CCC[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2Br)C1 ZINC000152473791 935665040 /nfs/dbraw/zinc/66/50/40/935665040.db2.gz CWRFGMDKOGIUII-GXSJLCMTSA-N 0 0 373.272 3.761 20 5 FHBDRN CC(C)c1ncc(NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)cn1 ZINC000478669155 935672040 /nfs/dbraw/zinc/67/20/40/935672040.db2.gz PKCUKBOJODTHIM-UHFFFAOYSA-N 0 0 369.406 3.884 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)c1cc(Cl)c(Cl)n1C ZINC000288224934 935674541 /nfs/dbraw/zinc/67/45/41/935674541.db2.gz IGTICXKXILOPRH-UHFFFAOYSA-N 0 0 356.209 3.555 20 5 FHBDRN Cc1cccc2c1N(C1CC1)CCN2C(=O)c1cccc([N+](=O)[O-])c1C ZINC000478681189 935674834 /nfs/dbraw/zinc/67/48/34/935674834.db2.gz NDPLSHLYGFOJON-UHFFFAOYSA-N 0 0 351.406 3.841 20 5 FHBDRN COc1cc(C(=O)NCCc2ccc(Cl)s2)cc([N+](=O)[O-])c1C ZINC000478700222 935681032 /nfs/dbraw/zinc/68/10/32/935681032.db2.gz XVFLLZWVQDEEMX-UHFFFAOYSA-N 0 0 354.815 3.599 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N(CC(F)(F)F)C1CCCC1 ZINC000127647427 935682292 /nfs/dbraw/zinc/68/22/92/935682292.db2.gz USHGZOOUEPITQT-UHFFFAOYSA-N 0 0 369.343 3.952 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)S(=O)(=O)Cc1ncc(Cl)s1 ZINC000478710232 935682355 /nfs/dbraw/zinc/68/23/55/935682355.db2.gz LFFCWLNFCSBKFI-SECBINFHSA-N 0 0 360.844 3.689 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1[C@H](C)S(=O)(=O)Cc1ncc(Cl)s1 ZINC000478710233 935682997 /nfs/dbraw/zinc/68/29/97/935682997.db2.gz LFFCWLNFCSBKFI-VIFPVBQESA-N 0 0 360.844 3.689 20 5 FHBDRN CCOc1cc(OCC(=O)N[C@@H](c2ccccc2)C(C)C)ccc1[N+](=O)[O-] ZINC000478731509 935687837 /nfs/dbraw/zinc/68/78/37/935687837.db2.gz IAWJACIBZYCVGL-HXUWFJFHSA-N 0 0 372.421 3.886 20 5 FHBDRN CCOc1cc(OCC(=O)N[C@@H](C)c2ccc(C)c(C)c2)ccc1[N+](=O)[O-] ZINC000478729562 935687911 /nfs/dbraw/zinc/68/79/11/935687911.db2.gz ALZOIODUCNDXCU-HNNXBMFYSA-N 0 0 372.421 3.867 20 5 FHBDRN COc1cc(C(=O)NCCCCOc2ccc(C)cc2)cc([N+](=O)[O-])c1C ZINC000478708637 935690361 /nfs/dbraw/zinc/69/03/61/935690361.db2.gz DQPYHMRIARGYEF-UHFFFAOYSA-N 0 0 372.421 3.809 20 5 FHBDRN COc1ccc(OCCSCc2ccc3c(c2)OCO3)c([N+](=O)[O-])c1 ZINC000478761163 935707805 /nfs/dbraw/zinc/70/78/05/935707805.db2.gz RIDQOSCAHPMZSB-UHFFFAOYSA-N 0 0 363.391 3.644 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])Cc1nc2cc(Cl)ccc2n1C ZINC000511127770 935717915 /nfs/dbraw/zinc/71/79/15/935717915.db2.gz VOLLWYUEQMJJRI-UHFFFAOYSA-N 0 0 358.829 3.809 20 5 FHBDRN CC(C)[C@H]1C[C@@H](NC(=O)c2c([N+](=O)[O-])cccc2C(F)(F)F)CCO1 ZINC000582447918 935720370 /nfs/dbraw/zinc/72/03/70/935720370.db2.gz JSPZTXQWRFIHEC-GXFFZTMASA-N 0 0 360.332 3.547 20 5 FHBDRN CCC(CC)[C@@H]1C[C@H](NC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)CCO1 ZINC000478807663 935729102 /nfs/dbraw/zinc/72/91/02/935729102.db2.gz RJNABCFIEZQEMX-APWZRJJASA-N 0 0 373.453 3.650 20 5 FHBDRN CCOc1cc2c(cc1NC(=O)/C=C/c1ccc([N+](=O)[O-])cc1)O[C@@H](C)C2 ZINC000018238106 945119184 /nfs/dbraw/zinc/11/91/84/945119184.db2.gz CCBOPQALWCYDCC-PPGNKHEKSA-N 0 0 368.389 3.969 20 5 FHBDRN C[C@H](NC(=O)C1(c2cccc(Cl)c2)CC(=O)C1)c1cccc([N+](=O)[O-])c1 ZINC000582455972 935732255 /nfs/dbraw/zinc/73/22/55/935732255.db2.gz UZKVNKJTVRQIFD-LBPRGKRZSA-N 0 0 372.808 3.726 20 5 FHBDRN C[S@@](=O)c1ccc(CNc2ccc([N+](=O)[O-])cc2OC(F)F)cc1 ZINC000302066562 935735217 /nfs/dbraw/zinc/73/52/17/935735217.db2.gz WGMVCXZFBJCKSJ-XMMPIXPASA-N 0 0 356.350 3.546 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N(C)[C@H]1CCCc2nc(C)sc21 ZINC000277617769 935735433 /nfs/dbraw/zinc/73/54/33/935735433.db2.gz QPTFDRRCWGHBIN-AWEZNQCLSA-N 0 0 361.423 3.518 20 5 FHBDRN CC[C@H](C)NC(=O)c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1 ZINC000127701125 935746039 /nfs/dbraw/zinc/74/60/39/935746039.db2.gz JRLUWCNHNVVPCA-QMMMGPOBSA-N 0 0 357.197 3.616 20 5 FHBDRN Cc1cc(OCC(=O)Nc2ccc(F)c(Cl)c2)c(F)cc1[N+](=O)[O-] ZINC000478888859 935752156 /nfs/dbraw/zinc/75/21/56/935752156.db2.gz NKIXWOBKVFMCBH-UHFFFAOYSA-N 0 0 356.712 3.852 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)N[C@@H](CO)c1c(Cl)cccc1Cl ZINC000478898835 935753028 /nfs/dbraw/zinc/75/30/28/935753028.db2.gz FNYUWJQTLYYSBZ-ZDUSSCGKSA-N 0 0 370.192 3.757 20 5 FHBDRN Cc1c(OC(=O)CCc2nc(-c3ccsc3)no2)cccc1[N+](=O)[O-] ZINC000051705127 935757629 /nfs/dbraw/zinc/75/76/29/935757629.db2.gz OEEAQDIRFHLJBI-UHFFFAOYSA-N 0 0 359.363 3.553 20 5 FHBDRN CC[C@@H](C)c1ccc(S(=O)(=O)NCCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000507309278 945121560 /nfs/dbraw/zinc/12/15/60/945121560.db2.gz BEUYUPBCKRPCSW-CQSZACIVSA-N 0 0 362.451 3.629 20 5 FHBDRN CN(C(=O)c1cc(F)ccc1Br)c1cccc([N+](=O)[O-])c1 ZINC000158373286 935759736 /nfs/dbraw/zinc/75/97/36/935759736.db2.gz PEHXEUYAMQNBIM-UHFFFAOYSA-N 0 0 353.147 3.773 20 5 FHBDRN CN(C(=O)c1cc([N+](=O)[O-])ccc1SC1CCCC1)c1cnn(C)c1 ZINC000158380505 935762727 /nfs/dbraw/zinc/76/27/27/935762727.db2.gz XCTAKOIZEQMJNI-UHFFFAOYSA-N 0 0 360.439 3.640 20 5 FHBDRN Cc1nc(N[C@@H]2CCC[C@@H](NC(=O)OC(C)(C)C)C2)ccc1[N+](=O)[O-] ZINC000127742315 935765464 /nfs/dbraw/zinc/76/54/64/935765464.db2.gz IJFDHSIANIBCAO-CHWSQXEVSA-N 0 0 350.419 3.546 20 5 FHBDRN CC[C@]1(c2ccc(C)cc2)CC(=O)N(Cc2ccccc2[N+](=O)[O-])C1=O ZINC000158382018 935765821 /nfs/dbraw/zinc/76/58/21/935765821.db2.gz LNUBSRNDSNYHSM-HXUWFJFHSA-N 0 0 352.390 3.510 20 5 FHBDRN Cc1nn(C)c(C(=O)Nc2ccc(OCC(C)C)c(Cl)c2)c1[N+](=O)[O-] ZINC000127750740 935767531 /nfs/dbraw/zinc/76/75/31/935767531.db2.gz UDJXSUGDXFPKQT-UHFFFAOYSA-N 0 0 366.805 3.577 20 5 FHBDRN Cc1c(CNC(=O)NCCCCN(C)c2ccccc2)cccc1[N+](=O)[O-] ZINC000479001683 935767534 /nfs/dbraw/zinc/76/75/34/935767534.db2.gz PBWDXUITCFDSLT-UHFFFAOYSA-N 0 0 370.453 3.619 20 5 FHBDRN CN(C(=O)CCc1ncc(-c2ccccc2F)o1)c1cccc([N+](=O)[O-])c1 ZINC000158400550 935768099 /nfs/dbraw/zinc/76/80/99/935768099.db2.gz ITYQULXNSAZNAW-UHFFFAOYSA-N 0 0 369.352 3.985 20 5 FHBDRN Cc1nc(COC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)c(C)s1 ZINC000158389374 935770020 /nfs/dbraw/zinc/77/00/20/935770020.db2.gz MMBBDEUZWHPDJK-SNVBAGLBSA-N 0 0 352.437 3.892 20 5 FHBDRN Cc1c(Br)cc(C(=O)N(C)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000509570953 945122256 /nfs/dbraw/zinc/12/22/56/945122256.db2.gz LGPNUTOYOWZJBS-UHFFFAOYSA-N 0 0 363.211 3.938 20 5 FHBDRN CCCC(=O)Nc1cccc(NC(=O)c2ccc([N+](=O)[O-])cc2OC)c1C ZINC000277638799 935771165 /nfs/dbraw/zinc/77/11/65/935771165.db2.gz TVBROFAOJVGJBB-UHFFFAOYSA-N 0 0 371.393 3.903 20 5 FHBDRN CC(C)CCSc1ccc(C(=O)NCCC(C)(C)O)cc1[N+](=O)[O-] ZINC000479035460 935775732 /nfs/dbraw/zinc/77/57/32/935775732.db2.gz RSCBHSVOYLKPCD-UHFFFAOYSA-N 0 0 354.472 3.624 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(N2CCC(OCc3ccc(F)cc3)CC2)n1 ZINC000611617267 935812779 /nfs/dbraw/zinc/81/27/79/935812779.db2.gz AHYDWMRXJYNBFY-UHFFFAOYSA-N 0 0 359.401 3.931 20 5 FHBDRN CN(C(=O)c1cccc(-c2noc(C3CC3)n2)c1)c1cccc([N+](=O)[O-])c1 ZINC000158451087 935813860 /nfs/dbraw/zinc/81/38/60/935813860.db2.gz IXPKNQFRCYGSDW-UHFFFAOYSA-N 0 0 364.361 3.799 20 5 FHBDRN C[C@H](CNC(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1)N(C)c1ccccc1 ZINC000479170854 935814245 /nfs/dbraw/zinc/81/42/45/935814245.db2.gz PSGIUGGXUZYUIN-CABCVRRESA-N 0 0 373.478 3.717 20 5 FHBDRN C[C@H](Oc1cccnc1[N+](=O)[O-])C(=O)Nc1ccc(Cl)c(Cl)c1 ZINC000023753706 935818743 /nfs/dbraw/zinc/81/87/43/935818743.db2.gz OHBLGZWCFDXYHW-QMMMGPOBSA-N 0 0 356.165 3.703 20 5 FHBDRN CCCCc1ccc(N(C)S(=O)(=O)c2ccc([N+](=O)[O-])s2)cc1 ZINC000479219759 935819424 /nfs/dbraw/zinc/81/94/24/935819424.db2.gz IMPSGOLRCHKPBG-UHFFFAOYSA-N 0 0 354.453 3.824 20 5 FHBDRN O=C(Nc1ccc(OCc2cccnc2)cc1)c1csc([N+](=O)[O-])c1 ZINC000728496060 935819468 /nfs/dbraw/zinc/81/94/68/935819468.db2.gz NYWCAOAZBSZYAG-UHFFFAOYSA-N 0 0 355.375 3.883 20 5 FHBDRN COc1ccc(C(=O)Nc2cnn(-c3ccc(Cl)cc3)c2)cc1[N+](=O)[O-] ZINC000479281859 935825161 /nfs/dbraw/zinc/82/51/61/935825161.db2.gz JYYDMAQDXNEYRR-UHFFFAOYSA-N 0 0 372.768 3.695 20 5 FHBDRN C[C@@H](O)C[C@@H]1CCCN1C(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000155859715 935826508 /nfs/dbraw/zinc/82/65/08/935826508.db2.gz ZJXVMOKYDCLAAW-PBHICJAKSA-N 0 0 369.421 3.714 20 5 FHBDRN Cc1c(CNC(=O)NCC2(c3cccc(F)c3)CC2)cccc1[N+](=O)[O-] ZINC000479332803 935827506 /nfs/dbraw/zinc/82/75/06/935827506.db2.gz DAYNWFBNPHZKMO-UHFFFAOYSA-N 0 0 357.385 3.573 20 5 FHBDRN CCC(=O)c1ccc(Nc2ccc(CC(=O)N(C)C)cc2)c([N+](=O)[O-])c1 ZINC000479362258 935830686 /nfs/dbraw/zinc/83/06/86/935830686.db2.gz DHSFAMZRYFWARM-UHFFFAOYSA-N 0 0 355.394 3.562 20 5 FHBDRN C[C@H](C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-])n1cnc2ccccc21 ZINC000479380193 935835707 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C[C@H](Nc1ccc([N+](=O)[O-])c2cccnc12)c1ccc(-n2cncn2)cc1 ZINC000078716352 936252296 /nfs/dbraw/zinc/25/22/96/936252296.db2.gz DAESKAYAXYOXFN-ZDUSSCGKSA-N 0 0 360.377 3.897 20 5 FHBDRN Cc1nc(Cc2nnc(Sc3ncc(Cl)cc3[N+](=O)[O-])o2)cs1 ZINC000153546322 936254443 /nfs/dbraw/zinc/25/44/43/936254443.db2.gz AOEAJQHMLWURPK-UHFFFAOYSA-N 0 0 369.815 3.533 20 5 FHBDRN CCC[C@@H](C)C(=O)NCCNc1ccc([N+](=O)[O-])c(OC(C)(C)C)c1 ZINC000431503734 936255097 /nfs/dbraw/zinc/25/50/97/936255097.db2.gz XQIFQGFOXWJUMI-CYBMUJFWSA-N 0 0 351.447 3.736 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC(C)(OC)CC1 ZINC000507334064 945152134 /nfs/dbraw/zinc/15/21/34/945152134.db2.gz GAOHQJLWPVIQRJ-UHFFFAOYSA-N 0 0 352.456 3.738 20 5 FHBDRN Cc1nc(-c2cccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)c2)n[nH]1 ZINC000363015023 936278567 /nfs/dbraw/zinc/27/85/67/936278567.db2.gz SWFQREVSYRJCFL-UHFFFAOYSA-N 0 0 357.757 3.594 20 5 FHBDRN CC(C)c1cccc(N(C)S(=O)(=O)c2c(F)cccc2[N+](=O)[O-])c1 ZINC000121984228 936286285 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CCC[C@@H]1C[C@H](C(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CCO1 ZINC000278362919 938343480 /nfs/dbraw/zinc/34/34/80/938343480.db2.gz JOQJEIBWQXKFDT-IUODEOHRSA-N 0 0 374.359 3.825 20 5 FHBDRN Cc1noc(C)c1CCC(=O)Nc1cc(C)nc2ccc([N+](=O)[O-])cc21 ZINC000161814447 938345822 /nfs/dbraw/zinc/34/58/22/938345822.db2.gz OSBDNFAZVKVGSV-UHFFFAOYSA-N 0 0 354.366 3.628 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCC[C@H](c3nc(-c4cccc(F)c4)no3)C2)cn1 ZINC000583657358 938345886 /nfs/dbraw/zinc/34/58/86/938345886.db2.gz JOQWQLVEKXMOIY-ZDUSSCGKSA-N 0 0 369.356 3.563 20 5 FHBDRN CC(C)Oc1cc(NC/C=C\c2ccccc2[N+](=O)[O-])ccc1C(N)=O ZINC000437262198 945167201 /nfs/dbraw/zinc/16/72/01/945167201.db2.gz YVSDTXSZGAFZDK-ALCCZGGFSA-N 0 0 355.394 3.606 20 5 FHBDRN O=[N+]([O-])c1ccc2ccnc(N3C[C@H]4CN(c5ccccc5)C[C@@H]4C3)c2c1 ZINC000583680198 938358245 /nfs/dbraw/zinc/35/82/45/938358245.db2.gz KHOOWZXXAFSXGA-IAGOWNOFSA-N 0 0 360.417 3.716 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)N[C@@H]2CCC[C@@H](C(C)C)CC2)cc1F ZINC001211593933 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C[C@H](Nc1ccc(C(=O)OCC(F)(F)F)cc1[N+](=O)[O-])c1ccccn1 ZINC000052930684 938668080 /nfs/dbraw/zinc/66/80/80/938668080.db2.gz YUMIVPTYVSDRIL-JTQLQIEISA-N 0 0 369.299 3.882 20 5 FHBDRN CC(C)Oc1ccccc1CC(=O)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000584307283 938679918 /nfs/dbraw/zinc/67/99/18/938679918.db2.gz AKYGDTVOVAPDOF-UHFFFAOYSA-N 0 0 356.422 3.626 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CC[C@@H](C)[C@H](C)C2)cc1SC ZINC000248632987 938680501 /nfs/dbraw/zinc/68/05/01/938680501.db2.gz WZOJYYSVEACKQT-IJLUTSLNSA-N 0 0 352.456 3.880 20 5 FHBDRN CC[C@H](c1cccc(OC)c1)N(C)CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000584315395 938683599 /nfs/dbraw/zinc/68/35/99/938683599.db2.gz WQGRWKRZCIYFOV-LJQANCHMSA-N 0 0 371.437 3.933 20 5 FHBDRN CC(=O)c1c(C)[nH]c(C(=O)N(C)Cc2cc([N+](=O)[O-])ccc2Cl)c1C ZINC000052991186 938692845 /nfs/dbraw/zinc/69/28/45/938692845.db2.gz BCSWYVGWJHDCOA-UHFFFAOYSA-N 0 0 363.801 3.668 20 5 FHBDRN CCOCc1ccc(-c2noc(-c3cccc([N+](=O)[O-])c3OC)n2)cc1 ZINC000518199961 945196703 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3.746 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2nc(Cc3ccccc3Br)no2)c1 ZINC000545589031 945198791 /nfs/dbraw/zinc/19/87/91/945198791.db2.gz UZXKZOZFRPJTBF-UHFFFAOYSA-N 0 0 360.167 3.998 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CC[C@@](F)(c2ccccc2)C1 ZINC000519187202 945201415 /nfs/dbraw/zinc/20/14/15/945201415.db2.gz QXZIFONLAJOIPG-FQEVSTJZSA-N 0 0 367.380 3.716 20 5 FHBDRN COc1cc(C(=O)N[C@H](c2cccc(C)c2)C(F)(F)F)ccc1[N+](=O)[O-] ZINC000511819458 945202731 /nfs/dbraw/zinc/20/27/31/945202731.db2.gz ADEWTAPIYDCVGW-OAHLLOKOSA-N 0 0 368.311 3.945 20 5 FHBDRN O=C(NCc1ccccc1Br)c1ccc([N+](=O)[O-])cc1Cl ZINC000070194123 938778542 /nfs/dbraw/zinc/77/85/42/938778542.db2.gz CBCOBVMLZJVSJQ-UHFFFAOYSA-N 0 0 369.602 3.941 20 5 FHBDRN Cc1nn(CCC(=O)N2CCCC[C@H]2CCC(C)C)c(C)c1[N+](=O)[O-] ZINC000128170126 938787910 /nfs/dbraw/zinc/78/79/10/938787910.db2.gz WFPGKRAOVQBLCH-INIZCTEOSA-N 0 0 350.463 3.616 20 5 FHBDRN C[C@@H](C(=O)NCc1nc2cccc(Cl)c2n1C)c1cccc([N+](=O)[O-])c1 ZINC000584385181 938793689 /nfs/dbraw/zinc/79/36/89/938793689.db2.gz AQFNPGUQQABSKQ-LLVKDONJSA-N 0 0 372.812 3.555 20 5 FHBDRN Cc1cn2c(nc(C)c2CN(C)C(=O)/C=C\c2ccc([N+](=O)[O-])cc2)s1 ZINC000255589579 938802997 /nfs/dbraw/zinc/80/29/97/938802997.db2.gz WREBADWDPXPJSI-TWGQIWQCSA-N 0 0 370.434 3.593 20 5 FHBDRN O=[N+]([O-])c1cccc(Cl)c1N1CCC(O)(Cc2ccc(F)cc2)CC1 ZINC000432149374 945205767 /nfs/dbraw/zinc/20/57/67/945205767.db2.gz UXNSRBUFWIHKKE-UHFFFAOYSA-N 0 0 364.804 3.961 20 5 FHBDRN CCS[C@@H]1CCCC[C@H]1NC(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000427212921 945206621 /nfs/dbraw/zinc/20/66/21/945206621.db2.gz OFIRKTABLPFSRP-GDBMZVCRSA-N 0 0 351.472 3.577 20 5 FHBDRN C[C@H]1[C@H](C(F)(F)F)CCCN1c1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000480298981 938824565 /nfs/dbraw/zinc/82/45/65/938824565.db2.gz AAMGKJGEMBBUKW-JOYOIKCWSA-N 0 0 356.304 3.812 20 5 FHBDRN Cc1cccc([C@@H]2CCN(C(=O)Cc3c(F)cc([N+](=O)[O-])cc3F)C2)c1 ZINC000573242145 938856829 /nfs/dbraw/zinc/85/68/29/938856829.db2.gz CBCSCNTVVQVZFB-CQSZACIVSA-N 0 0 360.360 3.740 20 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FHBDRN O=C(NCCc1ccccc1[N+](=O)[O-])N1CC[C@@H]1c1ccc(Cl)cc1 ZINC000519203360 945215367 /nfs/dbraw/zinc/21/53/67/945215367.db2.gz ZSTCQIGWXQNMHE-MRXNPFEDSA-N 0 0 359.813 3.947 20 5 FHBDRN Cc1nc(NCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)nn1C ZINC000427239989 945216312 /nfs/dbraw/zinc/21/63/12/945216312.db2.gz VSYDIULAEGEVNQ-UHFFFAOYSA-N 0 0 373.800 3.511 20 5 FHBDRN CCCC1CCC(NC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)CC1 ZINC000065680989 938942116 /nfs/dbraw/zinc/94/21/16/938942116.db2.gz KMUUJBUPYFXJMH-UHFFFAOYSA-N 0 0 356.426 3.869 20 5 FHBDRN CC(C)(C)OC1CCN(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000467233214 945218008 /nfs/dbraw/zinc/21/80/08/945218008.db2.gz QQTIRFOARQEGDF-UHFFFAOYSA-N 0 0 369.849 3.737 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)C[C@@H]2OCCc3ccsc32)cc1[N+](=O)[O-] ZINC000363598192 938973143 /nfs/dbraw/zinc/97/31/43/938973143.db2.gz WNZWFWWTBVOZRA-LRDDRELGSA-N 0 0 360.435 3.846 20 5 FHBDRN CC(C)Oc1c(F)cc(NC(=O)COc2ccccc2[N+](=O)[O-])cc1F ZINC000544064443 938977025 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Cc1cc(F)cc(C(=O)N2CCC(OCc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000176907299 938993190 /nfs/dbraw/zinc/99/31/90/938993190.db2.gz RDVOXMUYXGEORE-UHFFFAOYSA-N 0 0 372.396 3.864 20 5 FHBDRN C[C@@H](NC(=O)NCCc1cc2ccccc2[nH]1)c1cccc([N+](=O)[O-])c1 ZINC000136107628 938993882 /nfs/dbraw/zinc/99/38/82/938993882.db2.gz QZTCKZGUMDKTKP-CYBMUJFWSA-N 0 0 352.394 3.679 20 5 FHBDRN Cc1cc(C(=O)Nc2cccc(C(=O)NC(C)(C)C)c2)ccc1[N+](=O)[O-] ZINC000046604919 938994381 /nfs/dbraw/zinc/99/43/81/938994381.db2.gz BGSGCWOFEWBETC-UHFFFAOYSA-N 0 0 355.394 3.684 20 5 FHBDRN COc1cc(CN2CCO[C@H](c3ccccc3C)C2)c([N+](=O)[O-])cc1F ZINC000545223208 938995043 /nfs/dbraw/zinc/99/50/43/938995043.db2.gz MCHFUODPRKXWQY-IBGZPJMESA-N 0 0 360.385 3.624 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(Oc2cccc(Oc3cnccn3)c2)c1 ZINC000480578607 938996243 /nfs/dbraw/zinc/99/62/43/938996243.db2.gz KQVMQQLTMDPENN-UHFFFAOYSA-N 0 0 367.317 3.756 20 5 FHBDRN COC(=O)c1cccc(CSCCC(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000409846279 938996491 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CC(C)Oc1ccc(CNC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)cc1 ZINC000065725254 939007207 /nfs/dbraw/zinc/00/72/07/939007207.db2.gz TVINUSNJEJGCIM-UHFFFAOYSA-N 0 0 367.405 3.653 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H](OC)CC1 ZINC000611976060 939008838 /nfs/dbraw/zinc/00/88/38/939008838.db2.gz RWLNKCVRCCZJOU-CQSZACIVSA-N 0 0 352.456 3.738 20 5 FHBDRN CC1(C)CN(C(=O)c2cc([N+](=O)[O-])ccc2SC2CCCC2)CCO1 ZINC000135836822 939010084 /nfs/dbraw/zinc/01/00/84/939010084.db2.gz KKRWCNKRHHDLHM-UHFFFAOYSA-N 0 0 364.467 3.881 20 5 FHBDRN CC(C)[C@H](NC(=O)c1cc([N+](=O)[O-])cc2c1OCCO2)c1ccc(F)cc1 ZINC000548855114 939015143 /nfs/dbraw/zinc/01/51/43/939015143.db2.gz FPOVZAIWYVUIHI-KRWDZBQOSA-N 0 0 374.368 3.632 20 5 FHBDRN Cc1ccccc1C[C@H](C)NC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000065735546 939017348 /nfs/dbraw/zinc/01/73/48/939017348.db2.gz KXWSQCKDUAGWOX-HNNXBMFYSA-N 0 0 351.406 3.605 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)Nc1ccc2scnc2c1 ZINC000179259543 939017854 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FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1CCOC ZINC000188213273 939046688 /nfs/dbraw/zinc/04/66/88/939046688.db2.gz NANMYQUOPXMRDQ-MRXNPFEDSA-N 0 0 356.422 3.991 20 5 FHBDRN Cc1cccc([C@@H](NC(=O)c2csc([N+](=O)[O-])c2)c2ccccn2)c1 ZINC000179277731 939056281 /nfs/dbraw/zinc/05/62/81/939056281.db2.gz WHWROCWOGXGQQN-QGZVFWFLSA-N 0 0 353.403 3.879 20 5 FHBDRN O=[N+]([O-])c1cccc(Cl)c1N1CCc2c(ncn2-c2ccccc2)C1 ZINC000432159423 945225350 /nfs/dbraw/zinc/22/53/50/945225350.db2.gz TZVOUQJHVVVGHW-UHFFFAOYSA-N 0 0 354.797 3.997 20 5 FHBDRN C[C@H](NC(=O)c1cc(F)cc([N+](=O)[O-])c1)c1nc(C(C)(C)C)cs1 ZINC000609444287 939080657 /nfs/dbraw/zinc/08/06/57/939080657.db2.gz UEJSPEOCVKSMEI-VIFPVBQESA-N 0 0 351.403 3.979 20 5 FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)NC1C[C@@H](C)C[C@H](C)C1 ZINC000179328138 939085642 /nfs/dbraw/zinc/08/56/42/939085642.db2.gz DZYNKMDPFXCGBV-STQMWFEESA-N 0 0 366.483 3.888 20 5 FHBDRN Cc1cc(C(=O)N2CCc3c2cccc3[N+](=O)[O-])ccc1Br ZINC000179341953 939089005 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20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)Nc1nnc(-c2ccccn2)s1 ZINC000179459024 939162909 /nfs/dbraw/zinc/16/29/09/939162909.db2.gz AKMGRSZFFGKLNA-UHFFFAOYSA-N 0 0 369.406 3.686 20 5 FHBDRN CCN(CCc1ccccc1)C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000179467383 939169790 /nfs/dbraw/zinc/16/97/90/939169790.db2.gz PGYJAILIWIQIKJ-UHFFFAOYSA-N 0 0 351.406 3.710 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](c1cccc(C)c1)C(F)(F)F ZINC000511829828 945234489 /nfs/dbraw/zinc/23/44/89/945234489.db2.gz XBPUCYBRUPIPKJ-OAHLLOKOSA-N 0 0 368.311 3.945 20 5 FHBDRN COc1cc(CNCc2ccc(Cl)cc2[N+](=O)[O-])cc(OC)c1OC ZINC000892451699 939189571 /nfs/dbraw/zinc/18/95/71/939189571.db2.gz BXRZGIVXBYQLHQ-UHFFFAOYSA-N 0 0 366.801 3.564 20 5 FHBDRN Cc1cc(C(=O)Nc2ccc([N+](=O)[O-])cc2F)nn1-c1cccc(F)c1 ZINC000540853167 939195698 /nfs/dbraw/zinc/19/56/98/939195698.db2.gz ACBYFGDAMSDRCA-UHFFFAOYSA-N 0 0 358.304 3.619 20 5 FHBDRN CC(C)c1ccccc1OCC(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000548900737 939219372 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FHBDRN CCN([C@@H](C)c1ccc(F)cc1)S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-] ZINC000507479517 945263914 /nfs/dbraw/zinc/26/39/14/945263914.db2.gz SPVFHMVEJQONHN-ZDUSSCGKSA-N 0 0 366.414 3.814 20 5 FHBDRN C[C@H](Nc1ccnc2c1cccc2[N+](=O)[O-])c1ncc(Br)cn1 ZINC000432174555 945264248 /nfs/dbraw/zinc/26/42/48/945264248.db2.gz FAQOHEJLMMEFEZ-VIFPVBQESA-N 0 0 374.198 3.869 20 5 FHBDRN CC(C)(C)Oc1ccc(-c2noc(COc3ccccc3[N+](=O)[O-])n2)nc1 ZINC000426576190 945268121 /nfs/dbraw/zinc/26/81/21/945268121.db2.gz BDVWCTCLIGXCON-UHFFFAOYSA-N 0 0 370.365 3.796 20 5 FHBDRN CCC[C@]1(C)CCCN(C(=O)COc2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000432178668 945269255 /nfs/dbraw/zinc/26/92/55/945269255.db2.gz NAWWBAWRDHZFGX-HXUWFJFHSA-N 0 0 371.437 3.951 20 5 FHBDRN C[C@@H](c1cccc(C(F)(F)F)c1)N(C(=O)c1cc([N+](=O)[O-])n[nH]1)C1CC1 ZINC000506765206 945270651 /nfs/dbraw/zinc/27/06/51/945270651.db2.gz BCVMHCVNXLOVMI-VIFPVBQESA-N 0 0 368.315 3.703 20 5 FHBDRN CC(=O)c1ccc(OCCCC(=O)Nc2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000015409813 945273878 /nfs/dbraw/zinc/27/38/78/945273878.db2.gz HMUQDLUVZMPWQC-UHFFFAOYSA-N 0 0 356.378 3.904 20 5 FHBDRN Cc1cn(-c2c(F)cccc2F)nc1C(=O)Nc1ccc(C)c([N+](=O)[O-])c1 ZINC000188415155 939874041 /nfs/dbraw/zinc/87/40/41/939874041.db2.gz HEECIGQSYWWMQU-UHFFFAOYSA-N 0 0 372.331 3.928 20 5 FHBDRN O=C(N[C@@H]1C[C@H]1c1cc(F)c(F)c(F)c1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000437370661 945278752 /nfs/dbraw/zinc/27/87/52/945278752.db2.gz IETHVNWCAKJNKS-GXFFZTMASA-N 0 0 370.714 3.951 20 5 FHBDRN Cc1nn(C)c(C)c1[C@H]1CCCN1C(=O)c1c(C)cc(C)c([N+](=O)[O-])c1C ZINC000179551749 939884082 /nfs/dbraw/zinc/88/40/82/939884082.db2.gz XDBUKMVLWMPWHI-MRXNPFEDSA-N 0 0 370.453 3.848 20 5 FHBDRN Cc1ccc2c(c1)[C@@H](Nc1sc(S(C)(=O)=O)cc1[N+](=O)[O-])CCC2 ZINC000179618778 939895845 /nfs/dbraw/zinc/89/58/45/939895845.db2.gz ZYXDVHGFBMBEGN-ZDUSSCGKSA-N 0 0 366.464 3.858 20 5 FHBDRN Cn1ccc2ccc(NC(=O)c3ccn(-c4ccccc4[N+](=O)[O-])n3)cc21 ZINC000179599082 939896093 /nfs/dbraw/zinc/89/60/93/939896093.db2.gz MSQOEOWYSXTPOU-UHFFFAOYSA-N 0 0 361.361 3.525 20 5 FHBDRN O=C(Nc1ccc2nncn2c1)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000179625946 939897668 /nfs/dbraw/zinc/89/76/68/939897668.db2.gz YROUAVSGQJHDRC-UHFFFAOYSA-N 0 0 374.360 3.633 20 5 FHBDRN Cc1noc(C2(C)CCN(c3cc(C)nc4c3cccc4[N+](=O)[O-])CC2)n1 ZINC000511328247 939905889 /nfs/dbraw/zinc/90/58/89/939905889.db2.gz UHLZXXYRVNTGEV-UHFFFAOYSA-N 0 0 367.409 3.701 20 5 FHBDRN O=C(N[C@H]1C[C@H]1c1cccc(F)c1)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000179670565 939913146 /nfs/dbraw/zinc/91/31/46/939913146.db2.gz FHOCICXJJGMCCY-HOTGVXAUSA-N 0 0 351.337 3.568 20 5 FHBDRN CCOC[C@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1SC1CCCC1 ZINC000614567751 939916941 /nfs/dbraw/zinc/91/69/41/939916941.db2.gz NSAZTDLGRMBRRE-LBPRGKRZSA-N 0 0 352.456 3.784 20 5 FHBDRN COc1ccc(C(=O)N[C@@H]2C[C@H]2c2ccc(Cl)c(F)c2)cc1[N+](=O)[O-] ZINC000437373499 945281407 /nfs/dbraw/zinc/28/14/07/945281407.db2.gz ZWBLZTDBGQYDKH-SMDDNHRTSA-N 0 0 364.760 3.682 20 5 FHBDRN CSCC[C@H](C)N(C)C(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC000410491005 939917992 /nfs/dbraw/zinc/91/79/92/939917992.db2.gz FBIAJFPZISMMBD-VIFPVBQESA-N 0 0 350.362 3.827 20 5 FHBDRN COc1cc(C(=O)N2C[C@H](C)OC[C@@H]2c2ccccc2)cc([N+](=O)[O-])c1C ZINC000188493478 939928401 /nfs/dbraw/zinc/92/84/01/939928401.db2.gz TUBFJZFOWGSXPW-SCLBCKFNSA-N 0 0 370.405 3.514 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])c2cccnc12)N1CCCc2ccc(F)cc21 ZINC000179724619 939929347 /nfs/dbraw/zinc/92/93/47/939929347.db2.gz MPXFUFGWEYACHC-UHFFFAOYSA-N 0 0 351.337 3.875 20 5 FHBDRN Cc1sc(C(=O)N[C@H](C)c2cccc(N3CCCC3=O)c2)cc1[N+](=O)[O-] ZINC000065831303 939935706 /nfs/dbraw/zinc/93/57/06/939935706.db2.gz NQQOCCCMQGFHOP-LLVKDONJSA-N 0 0 373.434 3.583 20 5 FHBDRN O=C(N[C@@H](c1cccnc1)C1CC1)c1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC000410622827 939939572 /nfs/dbraw/zinc/93/95/72/939939572.db2.gz IXYVQWNNGPGODN-OAHLLOKOSA-N 0 0 365.311 3.890 20 5 FHBDRN O=C(N[C@H](c1cccnc1)C1CC1)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000410627170 939939703 /nfs/dbraw/zinc/93/97/03/939939703.db2.gz TUINZKBTHVEJDN-HNNXBMFYSA-N 0 0 365.311 3.890 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NCC1(O)CCCCCC1 ZINC000120855336 945283436 /nfs/dbraw/zinc/28/34/36/945283436.db2.gz QISPMIOCEQVMTE-UHFFFAOYSA-N 0 0 352.456 3.522 20 5 FHBDRN CCc1ccc(-c2noc([C@H](C)NC(=O)c3csc([N+](=O)[O-])c3)n2)cc1 ZINC000472409335 939953882 /nfs/dbraw/zinc/95/38/82/939953882.db2.gz YCNQNCVNUKZSHB-JTQLQIEISA-N 0 0 372.406 3.760 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)N1CCC(c2ccc(F)c(F)c2)CC1 ZINC000364517074 939957608 /nfs/dbraw/zinc/95/76/08/939957608.db2.gz RKLDMWTXLMPYKG-UHFFFAOYSA-N 0 0 361.348 3.596 20 5 FHBDRN CN(Cc1ccc(Br)o1)C(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000136406339 939958510 /nfs/dbraw/zinc/95/85/10/939958510.db2.gz KAJKIASEVSIEOA-UHFFFAOYSA-N 0 0 373.590 3.876 20 5 FHBDRN O=C(N[C@H]1CCCC12CCOCC2)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000410827380 939962760 /nfs/dbraw/zinc/96/27/60/939962760.db2.gz UBDRJBHTSLBBNC-AWEZNQCLSA-N 0 0 372.343 3.693 20 5 FHBDRN CC1(C)CN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])[C@@H]1[C@H]1CCCO1 ZINC000410871354 939964219 /nfs/dbraw/zinc/96/42/19/939964219.db2.gz HKNREFMQURECPS-ZIAGYGMSSA-N 0 0 372.343 3.643 20 5 FHBDRN O=C(Nc1ccc2[nH]c(C(F)F)nc2c1)c1ccc([N+](=O)[O-])cc1F ZINC000179823350 939966351 /nfs/dbraw/zinc/96/63/51/939966351.db2.gz GEACRGRBTLWFPK-UHFFFAOYSA-N 0 0 350.256 3.800 20 5 FHBDRN CCC[C@H]1CCCC[C@@H]1NC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000077558055 939968197 /nfs/dbraw/zinc/96/81/97/939968197.db2.gz NGVWJIPZLKBCEW-FZMZJTMJSA-N 0 0 367.833 3.662 20 5 FHBDRN COc1cc(C(=O)NC(C)(C)C(C)(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000410958684 939978647 /nfs/dbraw/zinc/97/86/47/939978647.db2.gz XPFILDMGMMMNBD-UHFFFAOYSA-N 0 0 360.357 3.759 20 5 FHBDRN Cc1ccc([C@H]2CCN(c3nnc(-c4ccc([N+](=O)[O-])cc4)n3C)C2)cc1 ZINC000548912995 939980524 /nfs/dbraw/zinc/98/05/24/939980524.db2.gz ANEVKEITNQQKGR-KRWDZBQOSA-N 0 0 363.421 3.693 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)[C@@H]1Cc2cc(Cl)ccc2O1 ZINC000065864902 939985208 /nfs/dbraw/zinc/98/52/08/939985208.db2.gz RNLJCADEKGGYRJ-SFHVURJKSA-N 0 0 374.824 3.989 20 5 FHBDRN CCCCOc1ccc(OC)cc1NC(=O)CNc1ccccc1[N+](=O)[O-] ZINC000065866725 939988937 /nfs/dbraw/zinc/98/89/37/939988937.db2.gz OMVQKMCBXDNCTE-UHFFFAOYSA-N 0 0 373.409 3.833 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)C1=Cc2ccccc2OC1 ZINC000065864810 939989165 /nfs/dbraw/zinc/98/91/65/939989165.db2.gz UFMTYAJOTRFIQF-UHFFFAOYSA-N 0 0 352.390 3.808 20 5 FHBDRN COc1ccc(N(CC2CC2)C(=O)c2cc([N+](=O)[O-])ccc2OC)cc1 ZINC000411044472 939990099 /nfs/dbraw/zinc/99/00/99/939990099.db2.gz QEOGWWSEGGJGBN-UHFFFAOYSA-N 0 0 356.378 3.669 20 5 FHBDRN Cc1cc(C=C2CCN(C(=O)Nc3ccc([N+](=O)[O-])cc3C)CC2)no1 ZINC000364739320 939991930 /nfs/dbraw/zinc/99/19/30/939991930.db2.gz ZBOOIQCNPLSUCW-UHFFFAOYSA-N 0 0 356.382 3.911 20 5 FHBDRN CCNc1ccc(C(=O)N[C@@H](C)CCCc2cccnc2)cc1[N+](=O)[O-] ZINC000411112338 939999735 /nfs/dbraw/zinc/99/97/35/939999735.db2.gz SNOBHARBWQIEJP-AWEZNQCLSA-N 0 0 356.426 3.563 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1NCc1ccccc1)N1C[C@@H]2C[C@H]1CS2 ZINC000411118905 939999738 /nfs/dbraw/zinc/99/97/38/939999738.db2.gz VKTOYBHKWHRIEA-HOTGVXAUSA-N 0 0 369.446 3.537 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H]1CC[C@@H]2CCCC[C@H]2C1 ZINC000411133953 940002333 /nfs/dbraw/zinc/00/23/33/940002333.db2.gz ISDXCEFRICDMER-HRCADAONSA-N 0 0 373.453 3.625 20 5 FHBDRN CC[C@H](NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)c1ccc(OC)cc1 ZINC000411179083 940007297 /nfs/dbraw/zinc/00/72/97/940007297.db2.gz KFBBWDGSFLRNSI-OTWHNJEPSA-N 0 0 354.406 3.974 20 5 FHBDRN Cc1cnn(-c2ccc(C(=O)Nc3c(C)ccc([N+](=O)[O-])c3C)cc2)c1 ZINC000086613824 945289179 /nfs/dbraw/zinc/28/91/79/945289179.db2.gz FQFBLVFNWHLQJM-UHFFFAOYSA-N 0 0 350.378 3.958 20 5 FHBDRN Cc1ccc([C@H](C)N(C)C(=O)C(=O)Nc2ccc([N+](=O)[O-])c(C)c2)c(C)c1 ZINC000411199194 940012944 /nfs/dbraw/zinc/01/29/44/940012944.db2.gz XZQQEVCBRDVPAR-HNNXBMFYSA-N 0 0 369.421 3.678 20 5 FHBDRN Cc1cc(NC(=O)C(=O)N(C)[C@H](c2ccccc2)C(C)C)ccc1[N+](=O)[O-] ZINC000411221541 940015184 /nfs/dbraw/zinc/01/51/84/940015184.db2.gz HGTRWLJDCATFQE-SFHVURJKSA-N 0 0 369.421 3.697 20 5 FHBDRN CCCC[C@H](NC(=O)C(=O)Nc1cc([N+](=O)[O-])c(C)cc1C)C1CCC1 ZINC000411304542 940025336 /nfs/dbraw/zinc/02/53/36/940025336.db2.gz SLMBCHVNOHFZQW-HNNXBMFYSA-N 0 0 361.442 3.625 20 5 FHBDRN COc1cc(-c2noc(CNc3cccc([N+](=O)[O-])c3C)n2)ccc1C ZINC000136549246 940025897 /nfs/dbraw/zinc/02/58/97/940025897.db2.gz AXJHBUZVMFPYGV-UHFFFAOYSA-N 0 0 354.366 3.882 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N(C)[C@@H](C)c2ccccc2F)c1F ZINC000411331286 940028421 /nfs/dbraw/zinc/02/84/21/940028421.db2.gz WSOXWURCTMQEJY-NSHDSACASA-N 0 0 364.348 3.644 20 5 FHBDRN O=C(OCc1coc(-c2ccc(F)c(F)c2)n1)c1ccc([N+](=O)[O-])s1 ZINC000728613023 940029309 /nfs/dbraw/zinc/02/93/09/940029309.db2.gz XYVFASXJHKXDKZ-UHFFFAOYSA-N 0 0 366.301 3.947 20 5 FHBDRN CCN(Cc1ccccc1C)C(=O)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC000411343157 940030013 /nfs/dbraw/zinc/03/00/13/940030013.db2.gz BEBVVGLHDFUNJT-UHFFFAOYSA-N 0 0 360.385 3.642 20 5 FHBDRN C[C@@H](NC(=O)CNc1ccccc1[N+](=O)[O-])c1ccccc1C(F)(F)F ZINC000065892630 940030133 /nfs/dbraw/zinc/03/01/33/940030133.db2.gz MBPMYOLCQMXMTA-LLVKDONJSA-N 0 0 367.327 3.903 20 5 FHBDRN COc1ccc(C(=O)N(C)Cc2ccccc2[N+](=O)[O-])c(OC(C)C)c1 ZINC000188526029 940031224 /nfs/dbraw/zinc/03/12/24/940031224.db2.gz KMOBFERPCIRAPF-UHFFFAOYSA-N 0 0 358.394 3.663 20 5 FHBDRN O=C(CCc1cnc2ccccc2c1)Nc1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000472424743 940034995 /nfs/dbraw/zinc/03/49/95/940034995.db2.gz JUVBWTJHSRPHFU-UHFFFAOYSA-N 0 0 361.361 3.591 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)Nc1ccc(-c2cc[nH]n2)cc1 ZINC000065897315 940039426 /nfs/dbraw/zinc/03/94/26/940039426.db2.gz SGMDTLOSFZJZMY-UHFFFAOYSA-N 0 0 361.361 3.578 20 5 FHBDRN Cc1cc(-c2nnc(CN(C)CCc3cccc([N+](=O)[O-])c3)o2)c(C)o1 ZINC000548927954 940052130 /nfs/dbraw/zinc/05/21/30/940052130.db2.gz JEWJUDMNGNGOSW-UHFFFAOYSA-N 0 0 356.382 3.529 20 5 FHBDRN CSc1ccccc1NC(=O)[C@H](C)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000548928349 940053017 /nfs/dbraw/zinc/05/30/17/940053017.db2.gz OWCSDINCXLJILW-AWEZNQCLSA-N 0 0 373.478 3.818 20 5 FHBDRN Cc1cc(C(=O)NCc2ccc([N+](=O)[O-])cc2)nn1-c1ccc(Cl)cc1 ZINC000540877716 940060127 /nfs/dbraw/zinc/06/01/27/940060127.db2.gz JVQPYLJPWQGMQH-UHFFFAOYSA-N 0 0 370.796 3.672 20 5 FHBDRN CC[C@H](NC(=O)Cc1c(F)c(OC)ccc1[N+](=O)[O-])c1cccs1 ZINC000411545588 940061175 /nfs/dbraw/zinc/06/11/75/940061175.db2.gz QHKCECCZYKIDIU-NSHDSACASA-N 0 0 352.387 3.614 20 5 FHBDRN COCCCOc1ccccc1NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000411578135 940065062 /nfs/dbraw/zinc/06/50/62/940065062.db2.gz BGNWKYOIGCANLA-DLBZAZTESA-N 0 0 370.405 3.752 20 5 FHBDRN CCc1c(NC(=O)c2ccc([N+](=O)[O-])cn2)cnn1-c1ccccc1Cl ZINC000365134461 940066313 /nfs/dbraw/zinc/06/63/13/940066313.db2.gz IOGBZVPFWLLMLX-UHFFFAOYSA-N 0 0 371.784 3.644 20 5 FHBDRN O=C(c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])N1C[C@@H]2CCCC[C@H]2C1 ZINC000427352925 945293663 /nfs/dbraw/zinc/29/36/63/945293663.db2.gz UJDSWYQJBDEUGH-RYUDHWBXSA-N 0 0 372.343 3.798 20 5 FHBDRN O=C(NCCCc1ccccc1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000431655426 940068594 /nfs/dbraw/zinc/06/85/94/940068594.db2.gz YBZRXVRWBRVZOQ-UHFFFAOYSA-N 0 0 363.211 3.720 20 5 FHBDRN O=[N+]([O-])c1cccc2ncnc(NCc3ccnc(Oc4ccccc4)c3)c21 ZINC000612438455 940069163 /nfs/dbraw/zinc/06/91/63/940069163.db2.gz MWJVYDHUCOGZGB-UHFFFAOYSA-N 0 0 373.372 3.759 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1CN1CCO[C@@H](c2cccc(OC)c2)C1 ZINC000167509078 940073181 /nfs/dbraw/zinc/07/31/81/940073181.db2.gz RSCOUDRFCRGHCD-HXUWFJFHSA-N 0 0 372.421 3.576 20 5 FHBDRN O=C(N[C@@H](c1ccncc1)c1cc(F)ccc1F)c1ccccc1[N+](=O)[O-] ZINC000365185271 940074481 /nfs/dbraw/zinc/07/44/81/940074481.db2.gz IKXWLWJWGMDBHH-SFHVURJKSA-N 0 0 369.327 3.787 20 5 FHBDRN O=C(N[C@H](c1ccc(F)cc1)c1cccnc1)c1ccccc1[N+](=O)[O-] ZINC000365191153 940079769 /nfs/dbraw/zinc/07/97/69/940079769.db2.gz ZWQNXGSHDHIIQI-GOSISDBHSA-N 0 0 351.337 3.648 20 5 FHBDRN O=C(Nc1ccccc1N1CCCCC1)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000179901872 940089308 /nfs/dbraw/zinc/08/93/08/940089308.db2.gz MTBPAMNUDYAMJR-UHFFFAOYSA-N 0 0 369.377 3.566 20 5 FHBDRN COc1ccc2c(c1)CC[C@@H](NC(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F)C2 ZINC000612489191 940097066 /nfs/dbraw/zinc/09/70/66/940097066.db2.gz HFJKTZIESHFWSJ-SWLSCSKDSA-N 0 0 372.396 3.520 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCc1ccn(C(C)C)n1 ZINC000570071443 940121769 /nfs/dbraw/zinc/12/17/69/940121769.db2.gz SNCAMWUQYBWYHP-UHFFFAOYSA-N 0 0 362.455 3.804 20 5 FHBDRN Cc1cc(NC(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)c2ccccc2n1 ZINC000612530856 940127244 /nfs/dbraw/zinc/12/72/44/940127244.db2.gz WGMBYAMBAIFBGI-LBPRGKRZSA-N 0 0 353.353 3.755 20 5 FHBDRN Cc1ccc(OCCCNC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)cc1 ZINC000411830185 940129260 /nfs/dbraw/zinc/12/92/60/940129260.db2.gz XGBDPSDJHPZHIA-RBUKOAKNSA-N 0 0 354.406 3.592 20 5 FHBDRN C[C@H](CNC(=O)c1cccc(Cl)c1[N+](=O)[O-])Oc1ccc(F)cc1 ZINC000177346156 940132758 /nfs/dbraw/zinc/13/27/58/940132758.db2.gz LTRWGJOMJFVPFX-SNVBAGLBSA-N 0 0 352.749 3.585 20 5 FHBDRN CC(C)c1ccc(C(=O)NC[C@@H](c2ccnn2C)C(C)C)cc1[N+](=O)[O-] ZINC000615955164 940149722 /nfs/dbraw/zinc/14/97/22/940149722.db2.gz WZIWIJAHNJRXMO-MRXNPFEDSA-N 0 0 358.442 3.621 20 5 FHBDRN COc1ccc(CN(C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)cn1 ZINC000612586758 940164186 /nfs/dbraw/zinc/16/41/86/940164186.db2.gz KQEMLBCGXMRRQF-UHFFFAOYSA-N 0 0 353.378 3.890 20 5 FHBDRN Cc1ccccc1[C@H](NC(=O)c1c[nH]nc1[N+](=O)[O-])[C@@H]1CCC[C@@H](C)C1 ZINC000548942946 940168105 /nfs/dbraw/zinc/16/81/05/940168105.db2.gz GBIVDQXFRDNBPA-SUYBPPKGSA-N 0 0 356.426 3.924 20 5 FHBDRN Cc1oc(C(C)C)nc1C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000573346925 940169061 /nfs/dbraw/zinc/16/90/61/940169061.db2.gz DUZOLQWVKQQIKG-UHFFFAOYSA-N 0 0 351.790 3.641 20 5 FHBDRN O=C(Nc1ncccc1Cl)c1ccc(Br)cc1[N+](=O)[O-] ZINC000179961950 940169960 /nfs/dbraw/zinc/16/99/60/940169960.db2.gz WOFUAZDUTJQISM-UHFFFAOYSA-N 0 0 356.563 3.658 20 5 FHBDRN CCOc1cccc2cc([C@@H](C)NC(=O)c3ccc([N+](=O)[O-])n3C)oc21 ZINC000612605136 940175624 /nfs/dbraw/zinc/17/56/24/940175624.db2.gz WXAPMLAFGUZKIA-LLVKDONJSA-N 0 0 357.366 3.569 20 5 FHBDRN CCNC(=O)N1CCc2ccc(N[C@H](C)c3ccc([N+](=O)[O-])cc3)cc21 ZINC000179969984 940175634 /nfs/dbraw/zinc/17/56/34/940175634.db2.gz ZPHLYCFGVZOLIL-CYBMUJFWSA-N 0 0 354.410 3.860 20 5 FHBDRN CCCOCc1ccccc1CNC(=O)Nc1ccc([N+](=O)[O-])cc1F ZINC000612610862 940182384 /nfs/dbraw/zinc/18/23/84/940182384.db2.gz OAPARSWHTMSQHF-UHFFFAOYSA-N 0 0 361.373 3.982 20 5 FHBDRN C[C@H](NC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2)c1cc2ccccc2o1 ZINC000179986990 940192987 /nfs/dbraw/zinc/19/29/87/940192987.db2.gz IPUGMBYVJHLBQT-JTQLQIEISA-N 0 0 354.318 3.561 20 5 FHBDRN COc1cc(OCC(=O)Oc2cccc(C(F)(F)F)c2)ccc1[N+](=O)[O-] ZINC000066013672 940194405 /nfs/dbraw/zinc/19/44/05/940194405.db2.gz UHZDSCUTIHPOLY-UHFFFAOYSA-N 0 0 371.267 3.607 20 5 FHBDRN COC(=O)[C@H](Cc1ccc(Cl)cc1)Sc1ccc([N+](=O)[O-])cn1 ZINC000612656997 940205965 /nfs/dbraw/zinc/20/59/65/940205965.db2.gz LCFKXBDPNIQGDT-ZDUSSCGKSA-N 0 0 352.799 3.520 20 5 FHBDRN O=C(NCCCOC1CCCCC1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000180001864 940211059 /nfs/dbraw/zinc/21/10/59/940211059.db2.gz NECCLJXMCATFKR-UHFFFAOYSA-N 0 0 372.368 3.665 20 5 FHBDRN CC[C@@H](C)NC(=O)c1ccc(NC(=O)c2ccc(C)c([N+](=O)[O-])c2)c(C)c1 ZINC000066035263 940212837 /nfs/dbraw/zinc/21/28/37/940212837.db2.gz QCWHVXGLAFUMHZ-CQSZACIVSA-N 0 0 369.421 3.992 20 5 FHBDRN C[C@H](c1ncc(-c2ccccc2)o1)N1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000376036099 940224129 /nfs/dbraw/zinc/22/41/29/940224129.db2.gz WOEODGMPXZRRBN-CQSZACIVSA-N 0 0 367.409 3.844 20 5 FHBDRN CC(C)(C)CN(Cc1ccccc1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000507528084 945304494 /nfs/dbraw/zinc/30/44/94/945304494.db2.gz HYIJCDIKFWXVHJ-UHFFFAOYSA-N 0 0 362.451 3.832 20 5 FHBDRN O=[N+]([O-])c1ccccc1/C=C/CN1CCC(c2noc(C(F)F)n2)CC1 ZINC000376048381 940240094 /nfs/dbraw/zinc/24/00/94/940240094.db2.gz YIHRIKYCWLFOCC-HWKANZROSA-N 0 0 364.352 3.808 20 5 FHBDRN O=[N+]([O-])c1cccc([C@@H]([NH2+]CCCOC[C@H]2CCCO2)c2ccccc2)c1 ZINC000180022257 940249982 /nfs/dbraw/zinc/24/99/82/940249982.db2.gz QTOJHNMSDJAKQO-RTWAWAEBSA-N 0 0 370.449 3.860 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2nc(CN[C@H](CCO)c3ccccc3)cs2)c1 ZINC000124452757 945307748 /nfs/dbraw/zinc/30/77/48/945307748.db2.gz IBMVXIQTMIYMEZ-GOSISDBHSA-N 0 0 369.446 3.932 20 5 FHBDRN O=[N+]([O-])c1cnc(NC2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)nc1 ZINC000612778520 940271956 /nfs/dbraw/zinc/27/19/56/940271956.db2.gz SCDITIKWSAPRKV-BQBZGAKWSA-N 0 0 358.242 3.706 20 5 FHBDRN Cc1cc(NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)cnc1Cl ZINC000177560411 940276877 /nfs/dbraw/zinc/27/68/77/940276877.db2.gz RTCPTNCXBMGBSO-UHFFFAOYSA-N 0 0 374.828 3.807 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2nc(C3CCC3)no2)c(I)c1 ZINC000612897609 940328295 /nfs/dbraw/zinc/32/82/95/940328295.db2.gz QHMIAQPBKCOUTG-UHFFFAOYSA-N 0 0 371.134 3.517 20 5 FHBDRN CO[C@@H](c1nc(CCC(C)(C)[N+](=O)[O-])no1)c1ccccc1C(F)(F)F ZINC000924077899 940328333 /nfs/dbraw/zinc/32/83/33/940328333.db2.gz ZVGKTDHKIPQIAY-CYBMUJFWSA-N 0 0 373.331 3.812 20 5 FHBDRN O=C(Nc1nccs1)C1CCN(c2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000376119895 940332321 /nfs/dbraw/zinc/33/23/21/940332321.db2.gz XEBJWYGGHZUMOH-UHFFFAOYSA-N 0 0 366.830 3.560 20 5 FHBDRN CC(C)(C)c1ccc(-c2nc(-c3cccc(C(N)=O)c3)no2)cc1[N+](=O)[O-] ZINC000612900905 940335264 /nfs/dbraw/zinc/33/52/64/940335264.db2.gz YXRIJZZGNXVKBJ-UHFFFAOYSA-N 0 0 366.377 3.708 20 5 FHBDRN COc1cccc([C@@H](C)c2noc(-c3ccc(OC)c([N+](=O)[O-])c3)n2)c1 ZINC000612917886 940335761 /nfs/dbraw/zinc/33/57/61/940335761.db2.gz RQHLCVIFHSHYHJ-LLVKDONJSA-N 0 0 355.350 3.814 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)O[C@H](CCc1ccccc1)C(C)C ZINC000066232508 940341091 /nfs/dbraw/zinc/34/10/91/940341091.db2.gz SKGWWIRNJRTRBI-QGZVFWFLSA-N 0 0 359.426 3.690 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1-c1noc(-c2csc(-c3ncccn3)n2)n1 ZINC000612936628 940345417 /nfs/dbraw/zinc/34/54/17/940345417.db2.gz QYQJESOWROISFF-UHFFFAOYSA-N 0 0 366.362 3.534 20 5 FHBDRN COc1ccc2c(c1)C[C@@H](c1nc(-c3ccc([N+](=O)[O-])cc3C)no1)CO2 ZINC000612936104 940345737 /nfs/dbraw/zinc/34/57/37/940345737.db2.gz AMTNFJXNBAHFOZ-CYBMUJFWSA-N 0 0 367.361 3.681 20 5 FHBDRN O=[N+]([O-])c1ccc(OCc2nc([C@@H]3CCc4ccccc4C3)no2)cc1 ZINC000612951582 940356166 /nfs/dbraw/zinc/35/61/66/940356166.db2.gz JMDIESMOKDOXER-OAHLLOKOSA-N 0 0 351.362 3.829 20 5 FHBDRN Cc1c(Cc2noc(C[C@@H]3CCO[C@@H](C(C)C)C3)n2)cccc1[N+](=O)[O-] ZINC000612967340 940366268 /nfs/dbraw/zinc/36/62/68/940366268.db2.gz LKBIOBLUAOIDKA-RHSMWYFYSA-N 0 0 359.426 3.871 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)Nc1cc(C2(C)CCCC2)on1 ZINC000548968346 940367050 /nfs/dbraw/zinc/36/70/50/940367050.db2.gz VJWABNVDNHQHMF-UHFFFAOYSA-N 0 0 372.425 3.543 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](C)c2ccc(F)cc2F)c1 ZINC000548971756 940377748 /nfs/dbraw/zinc/37/77/48/940377748.db2.gz VGGXVPXSZKFJLU-JTQLQIEISA-N 0 0 350.321 3.763 20 5 FHBDRN O=C(Nc1ccc(Cl)cc1Cl)c1cc([N+](=O)[O-])cc2c1OCCO2 ZINC000066266818 940380462 /nfs/dbraw/zinc/38/04/62/940380462.db2.gz KXOLKDCHONPOJH-UHFFFAOYSA-N 0 0 369.160 3.925 20 5 FHBDRN CCC[C@@H]1CCCC[C@H]1NC(=O)c1ccc2c(c1[N+](=O)[O-])OCCCO2 ZINC001125803234 940391557 /nfs/dbraw/zinc/39/15/57/940391557.db2.gz VQWHEPASYDPOSG-UKRRQHHQSA-N 0 0 362.426 3.845 20 5 FHBDRN Cc1ccccc1[C@H]1CCCN1C(=O)COc1ccc([N+](=O)[O-])c(C)c1 ZINC000431720073 940399488 /nfs/dbraw/zinc/39/94/88/940399488.db2.gz UTUFWSBMTORSLG-LJQANCHMSA-N 0 0 354.406 3.954 20 5 FHBDRN CCOc1cc(OCC(=O)N2CCC[C@H]3CCCC[C@@H]32)ccc1[N+](=O)[O-] ZINC000188618161 940421890 /nfs/dbraw/zinc/42/18/90/940421890.db2.gz IOSBORZYUDZAFP-ZBFHGGJFSA-N 0 0 362.426 3.554 20 5 FHBDRN CCOc1cc(OCc2nc([C@H](C)OCC(C)C)no2)ccc1[N+](=O)[O-] ZINC000188616367 940426509 /nfs/dbraw/zinc/42/65/09/940426509.db2.gz MBAQEQDVDULYRC-LBPRGKRZSA-N 0 0 365.386 3.689 20 5 FHBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CCC[C@@H]1C1CCC1 ZINC000102869710 940432184 /nfs/dbraw/zinc/43/21/84/940432184.db2.gz YPRNBIQJCANGFC-BXUZGUMPSA-N 0 0 352.818 3.807 20 5 FHBDRN CC(C)(C(=O)N1CCc2[nH]c3ccccc3c2C1)c1ccccc1[N+](=O)[O-] ZINC000431733446 940437419 /nfs/dbraw/zinc/43/74/19/940437419.db2.gz RCHJYWLFEZRWJU-UHFFFAOYSA-N 0 0 363.417 3.939 20 5 FHBDRN Cc1cc(OC(C)C)ccc1NC(=O)c1cc([N+](=O)[O-])cc2c1OCCO2 ZINC000066330124 940439015 /nfs/dbraw/zinc/43/90/15/940439015.db2.gz IHWNMOUBPULJTC-UHFFFAOYSA-N 0 0 372.377 3.714 20 5 FHBDRN C[C@H](CC(=O)OCCn1cc([N+](=O)[O-])cn1)c1ccccc1C(F)(F)F ZINC000177794719 940443047 /nfs/dbraw/zinc/44/30/47/940443047.db2.gz DRCTTWLCORQHQY-LLVKDONJSA-N 0 0 371.315 3.547 20 5 FHBDRN O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CC[C@H](C2CCOCC2)C1 ZINC000376192875 940445964 /nfs/dbraw/zinc/44/59/64/940445964.db2.gz CMXAMICYPUQMQD-ZDUSSCGKSA-N 0 0 360.435 3.698 20 5 FHBDRN CC(C)NC(=O)c1ccc(NCCC2C[C@H](C)O[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000548988175 940446754 /nfs/dbraw/zinc/44/67/54/940446754.db2.gz VGWOEWNTYSFGOS-KBPBESRZSA-N 0 0 363.458 3.739 20 5 FHBDRN COC(=O)c1ccc(OCc2ncc(-c3cccc(F)c3)o2)cc1[N+](=O)[O-] ZINC000613108984 940451715 /nfs/dbraw/zinc/45/17/15/940451715.db2.gz BOSPEMIJWRFVSK-UHFFFAOYSA-N 0 0 372.308 3.755 20 5 FHBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCC[C@H](F)C1 ZINC000580077543 940451972 /nfs/dbraw/zinc/45/19/72/940451972.db2.gz UVWAFFAHUKHNEC-VHSXEESVSA-N 0 0 359.195 3.676 20 5 FHBDRN COC(=O)c1ccc(OCc2ncc(Cl)cc2Cl)cc1[N+](=O)[O-] ZINC000613110646 940452655 /nfs/dbraw/zinc/45/26/55/940452655.db2.gz SLOKLTKLUURXRD-UHFFFAOYSA-N 0 0 357.149 3.662 20 5 FHBDRN COC(=O)c1ccc(OCC(=O)c2cc(C)c(C)cc2C)cc1[N+](=O)[O-] ZINC000613110315 940452684 /nfs/dbraw/zinc/45/26/84/940452684.db2.gz WOQARPDQSHBIMT-UHFFFAOYSA-N 0 0 357.362 3.568 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccc2[nH]c(C(F)F)nc2c1 ZINC000427393785 945321930 /nfs/dbraw/zinc/32/19/30/945321930.db2.gz CLWFEVHLAJARFW-UHFFFAOYSA-N 0 0 362.292 3.670 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])cc1[N+](=O)[O-] ZINC000177833954 940459027 /nfs/dbraw/zinc/45/90/27/940459027.db2.gz UTIKEIFODFWSHH-JTQLQIEISA-N 0 0 363.757 3.956 20 5 FHBDRN CC(C)(C)CC[C@@H]1NC(=O)N(CCc2ccc(Cl)cc2[N+](=O)[O-])C1=O ZINC000431750738 940467983 /nfs/dbraw/zinc/46/79/83/940467983.db2.gz BRSZAJMPTCNOTC-ZDUSSCGKSA-N 0 0 367.833 3.537 20 5 FHBDRN COc1ccc2c(Cc3nc(Cc4ccccc4[N+](=O)[O-])no3)coc2c1 ZINC000580253649 940470623 /nfs/dbraw/zinc/47/06/23/940470623.db2.gz GVGNTSMWUGPWLS-UHFFFAOYSA-N 0 0 365.345 3.914 20 5 FHBDRN CC(C)N(Cc1cccs1)c1nnc(-c2cccc([N+](=O)[O-])c2)n1C ZINC000580260359 940471081 /nfs/dbraw/zinc/47/10/81/940471081.db2.gz QMFNOFRIPYFAHV-UHFFFAOYSA-N 0 0 357.439 3.867 20 5 FHBDRN COC(=O)c1cc(NCC2(c3ccccn3)CCC2)cc(C)c1[N+](=O)[O-] ZINC000580344555 940473364 /nfs/dbraw/zinc/47/33/64/940473364.db2.gz LAQSNFJUSATQNR-UHFFFAOYSA-N 0 0 355.394 3.619 20 5 FHBDRN CC(C)(C)O[C@@H]1C[C@H](NC(=O)c2c(Cl)cccc2[N+](=O)[O-])C1(C)C ZINC000414064928 940473384 /nfs/dbraw/zinc/47/33/84/940473384.db2.gz ZALIWDXJIQSPLO-QWHCGFSZSA-N 0 0 354.834 3.960 20 5 FHBDRN O=C(NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)C(C1CCC1)C1CCC1 ZINC000580481351 940476572 /nfs/dbraw/zinc/47/65/72/940476572.db2.gz ZZDLDODJSNBQRE-UHFFFAOYSA-N 0 0 355.438 3.951 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H]1OCCc2ccccc21 ZINC000613183889 940479033 /nfs/dbraw/zinc/47/90/33/940479033.db2.gz ARVULONOYOEKCC-UZLBHIALSA-N 0 0 368.433 3.594 20 5 FHBDRN CCOC1CCN(c2ccc([N+](=O)[O-])c(OCc3ccccc3)n2)CC1 ZINC000613179845 940479991 /nfs/dbraw/zinc/47/99/91/940479991.db2.gz IYVUWWDAUGUFAI-UHFFFAOYSA-N 0 0 357.410 3.574 20 5 FHBDRN CN(CCCCCO)c1c2cc(Br)ccc2ncc1[N+](=O)[O-] ZINC000580683379 940483712 /nfs/dbraw/zinc/48/37/12/940483712.db2.gz NNMBDRXVXNJXRV-UHFFFAOYSA-N 0 0 368.231 3.504 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCCOc2ccccc21 ZINC000613191286 940481419 /nfs/dbraw/zinc/48/14/19/940481419.db2.gz BTODRHBNWWCMLW-INIZCTEOSA-N 0 0 354.406 3.979 20 5 FHBDRN O=c1[nH]c(N2CCC[C@H]2Cc2ccc(F)cc2)nc2ccc([N+](=O)[O-])cc12 ZINC000580666954 940481712 /nfs/dbraw/zinc/48/17/12/940481712.db2.gz KDMHTEOOVNKJBW-AWEZNQCLSA-N 0 0 368.368 3.594 20 5 FHBDRN CC(C)Oc1ccc(F)cc1NC(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000066433323 940486230 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CCOc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H]2CCO[C@@H]2c2ccccc2)c1 ZINC000549010544 940493891 /nfs/dbraw/zinc/49/38/91/940493891.db2.gz VFRKHODYCCETLL-HNAYVOBHSA-N 0 0 370.405 3.501 20 5 FHBDRN COc1cc(C(=O)N(C)Cc2cc([N+](=O)[O-])ccc2Cl)ccc1F ZINC000177967532 940493894 /nfs/dbraw/zinc/49/38/94/940493894.db2.gz OKGXJQLVWGLFAF-UHFFFAOYSA-N 0 0 352.749 3.668 20 5 FHBDRN Cc1cccc(O[C@@H](C)CNC(=O)C(C)(C)c2ccccc2[N+](=O)[O-])c1 ZINC000581181798 940495036 /nfs/dbraw/zinc/49/50/36/940495036.db2.gz ODIZQIJZQJPLMV-HNNXBMFYSA-N 0 0 356.422 3.765 20 5 FHBDRN O=[N+]([O-])c1ccc(NCCCS(=O)(=O)c2ccc(Cl)cc2)cc1 ZINC000581203768 940496585 /nfs/dbraw/zinc/49/65/85/940496585.db2.gz FGGDDOVOVIKEEY-UHFFFAOYSA-N 0 0 354.815 3.524 20 5 FHBDRN CCc1ccc(S(=O)(=O)N(C)[C@H](C)c2cccs2)cc1[N+](=O)[O-] ZINC000581248126 940497584 /nfs/dbraw/zinc/49/75/84/940497584.db2.gz NIEYLCXTOGDXHH-LLVKDONJSA-N 0 0 354.453 3.600 20 5 FHBDRN O=C(c1ncccc1C(F)(F)F)N1CCCc2ccc([N+](=O)[O-])cc21 ZINC000180118432 940497803 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FHBDRN CO[C@@H]1C[C@H](c2ccccc2)CC[C@H]1NC(=O)c1cc([N+](=O)[O-])ccc1C ZINC000581480586 940504581 /nfs/dbraw/zinc/50/45/81/940504581.db2.gz ZTQQTIUYJCBJBP-NSISKUIASA-N 0 0 368.433 3.984 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@](C)(c1ccccc1)C(F)(F)F ZINC000427399679 945326810 /nfs/dbraw/zinc/32/68/10/945326810.db2.gz PWOJKMGRTTUEDQ-INIZCTEOSA-N 0 0 368.311 3.811 20 5 FHBDRN CCOC(=O)CCc1ccc(NC(=O)Cc2cccc([N+](=O)[O-])c2C)cc1 ZINC000124762137 945326846 /nfs/dbraw/zinc/32/68/46/945326846.db2.gz YDJFNGVBFAWZSW-UHFFFAOYSA-N 0 0 370.405 3.580 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)NC1CC(c2ccccc2)C1 ZINC000511473635 940505813 /nfs/dbraw/zinc/50/58/13/940505813.db2.gz JANSZGPRXGTNFQ-UHFFFAOYSA-N 0 0 353.422 3.725 20 5 FHBDRN COc1cccc2c1OCC[C@H]2NC(=O)Nc1cc([N+](=O)[O-])c(C)cc1C ZINC000613295537 940505984 /nfs/dbraw/zinc/50/59/84/940505984.db2.gz SUYUQICQPMBDRC-CQSZACIVSA-N 0 0 371.393 3.866 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCCCCC(=O)OC(C)(C)C ZINC000613297171 940506066 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FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N1C[C@H](c2ccccc2)OCC1(C)C ZINC000066512008 940593078 /nfs/dbraw/zinc/59/30/78/940593078.db2.gz ICLOUUCICUTYQR-GOSISDBHSA-N 0 0 354.406 3.896 20 5 FHBDRN Cc1cccc([C@H](O)CNC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)c1 ZINC000178059878 940617572 /nfs/dbraw/zinc/61/75/72/940617572.db2.gz XIIBMNWQBMPXGV-OAHLLOKOSA-N 0 0 356.403 3.581 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H](c1ccc(F)c(C)c1)C1CC1 ZINC000427391357 945335338 /nfs/dbraw/zinc/33/53/38/945335338.db2.gz NGEHCBKMKHTUMO-SFHVURJKSA-N 0 0 358.369 3.932 20 5 FHBDRN CCOC(=O)C(C)(C)C1CCN(c2ccc([N+](=O)[O-])c(OCC)c2)CC1 ZINC000581875943 940629284 /nfs/dbraw/zinc/62/92/84/940629284.db2.gz QTIJGXXFKJMCBP-UHFFFAOYSA-N 0 0 364.442 3.799 20 5 FHBDRN O=C(COc1cccc([N+](=O)[O-])c1)Nc1cccc(Oc2ccccn2)c1 ZINC000173599289 940643597 /nfs/dbraw/zinc/64/35/97/940643597.db2.gz BXFGMSCRPZZGAP-UHFFFAOYSA-N 0 0 365.345 3.800 20 5 FHBDRN COc1cc(F)c(CNCc2ccc([N+](=O)[O-])cc2Cl)cc1OC ZINC000582067002 940645481 /nfs/dbraw/zinc/64/54/81/940645481.db2.gz AUHLQICSNGDTKC-UHFFFAOYSA-N 0 0 354.765 3.694 20 5 FHBDRN COc1cc(-c2nc(-c3ccc(F)cc3F)no2)cc([N+](=O)[O-])c1OC ZINC000582077570 940646211 /nfs/dbraw/zinc/64/62/11/940646211.db2.gz PDAJSLRAQDCZTQ-UHFFFAOYSA-N 0 0 363.276 3.607 20 5 FHBDRN CC1(C)CN(c2ncc([N+](=O)[O-])cc2Cl)CCN1Cc1ccccc1 ZINC000582087895 940652563 /nfs/dbraw/zinc/65/25/63/940652563.db2.gz GQKSNUZILVZLAE-UHFFFAOYSA-N 0 0 360.845 3.744 20 5 FHBDRN Cc1c(CC(=O)N[C@H](C)c2nccn2-c2ccccc2)cccc1[N+](=O)[O-] ZINC000582202190 940653304 /nfs/dbraw/zinc/65/33/04/940653304.db2.gz XTNPLHLDQWILDP-OAHLLOKOSA-N 0 0 364.405 3.509 20 5 FHBDRN Cn1c(CN[C@@H]2CCc3c2cccc3[N+](=O)[O-])nc2cc(Cl)ccc21 ZINC000582370446 940661779 /nfs/dbraw/zinc/66/17/79/940661779.db2.gz PXASZUCEXGXBHI-CQSZACIVSA-N 0 0 356.813 3.912 20 5 FHBDRN CCn1cc(N(CC(C)C)C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cn1 ZINC000892542953 940683022 /nfs/dbraw/zinc/68/30/22/940683022.db2.gz UTMKHVHDIALNAM-UHFFFAOYSA-N 0 0 350.806 3.767 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)N1CCCc2c(F)ccc(F)c21 ZINC000472539694 940687525 /nfs/dbraw/zinc/68/75/25/940687525.db2.gz KYWYDPUUFNRJIA-UHFFFAOYSA-N 0 0 371.343 3.807 20 5 FHBDRN C[C@@H]1C[C@@H](CCNC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)C[C@H](C)O1 ZINC000549019676 940690558 /nfs/dbraw/zinc/69/05/58/940690558.db2.gz UYYPBNYJJNIFJO-ZSBIGDGJSA-N 0 0 372.368 3.520 20 5 FHBDRN COc1cc(C(=O)Nc2ccc(F)c(Br)c2)ccc1[N+](=O)[O-] ZINC000174108518 940703142 /nfs/dbraw/zinc/70/31/42/940703142.db2.gz CXGBKOOOFXXMFE-UHFFFAOYSA-N 0 0 369.146 3.757 20 5 FHBDRN Cc1ccc([C@H](C)N[C@H]2c3sccc3OC(C)(C)[C@@H]2O)cc1[N+](=O)[O-] ZINC000414184976 940726573 /nfs/dbraw/zinc/72/65/73/940726573.db2.gz PARBAFIMTNFXLV-XNJJOIOASA-N 0 0 362.451 3.889 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)NCCC1C[C@H](C)O[C@@H](C)C1 ZINC000549023746 940727503 /nfs/dbraw/zinc/72/75/03/940727503.db2.gz XBEKARBQRAYLQO-STQMWFEESA-N 0 0 365.430 3.709 20 5 FHBDRN Cc1nc2c(s1)[C@@H](N(C)c1ncnc3sc([N+](=O)[O-])cc31)CCC2 ZINC000582611363 940750615 /nfs/dbraw/zinc/75/06/15/940750615.db2.gz AXQBKAGFONFVCH-NSHDSACASA-N 0 0 361.452 3.878 20 5 FHBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])NCC(C1CC1)C1CC1 ZINC000540909293 940758500 /nfs/dbraw/zinc/75/85/00/940758500.db2.gz ZUMNYZJJKAILLN-UHFFFAOYSA-N 0 0 351.834 3.526 20 5 FHBDRN Cc1ccc(F)c(NC(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)c1 ZINC000582629393 940761976 /nfs/dbraw/zinc/76/19/76/940761976.db2.gz GJWZUFPTZKKPAB-UHFFFAOYSA-N 0 0 356.357 3.888 20 5 FHBDRN Cc1ccc(NC(=O)CCOc2ccccc2[N+](=O)[O-])c2cccnc12 ZINC000047624197 945346660 /nfs/dbraw/zinc/34/66/60/945346660.db2.gz SDYTXSGTLCYMFG-UHFFFAOYSA-N 0 0 351.362 3.859 20 5 FHBDRN CC1=C(c2ccco2)CN(c2nnc(-c3ccc([N+](=O)[O-])cc3)n2C)CC1 ZINC000582632265 940767810 /nfs/dbraw/zinc/76/78/10/940767810.db2.gz BQWIIZWSOYGKCP-UHFFFAOYSA-N 0 0 365.393 3.667 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)NC1CCC(c2ccccc2)CC1 ZINC000025098347 945347796 /nfs/dbraw/zinc/34/77/96/945347796.db2.gz FIMXGPNQUNFWCG-UHFFFAOYSA-N 0 0 354.406 3.816 20 5 FHBDRN C[C@@H]1CN(C(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)c2ccccc21 ZINC000582639662 940780832 /nfs/dbraw/zinc/78/08/32/940780832.db2.gz OURODMTXUACQOF-CYBMUJFWSA-N 0 0 364.405 3.952 20 5 FHBDRN O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccnn1-c1ccc(Cl)cc1 ZINC000174823500 940782224 /nfs/dbraw/zinc/78/22/24/940782224.db2.gz CXXZHLUKNMEKQZ-UHFFFAOYSA-N 0 0 356.769 3.615 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN[C@H](C(C)(C)C)C(F)(F)F ZINC000540917117 940794410 /nfs/dbraw/zinc/79/44/10/940794410.db2.gz CPXBQJVFSINWPB-CQSZACIVSA-N 0 0 361.364 3.798 20 5 FHBDRN COc1ccc(OC)c(NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 ZINC000175037330 940803651 /nfs/dbraw/zinc/80/36/51/940803651.db2.gz FDUXKRSNYTURFE-UHFFFAOYSA-N 0 0 370.283 3.883 20 5 FHBDRN O=C(C[C@H](O)c1ccc(Cl)cc1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000180197509 940806158 /nfs/dbraw/zinc/80/61/58/940806158.db2.gz UBLAHAAWNGCEBU-SFHVURJKSA-N 0 0 374.824 3.863 20 5 FHBDRN Cc1cnccc1OC1CCN(c2ccc([N+](=O)[O-])c(OC(C)C)n2)CC1 ZINC000582677012 940807194 /nfs/dbraw/zinc/80/71/94/940807194.db2.gz MGSFTZCBNYDNGX-UHFFFAOYSA-N 0 0 372.425 3.528 20 5 FHBDRN CCn1c(C)nc([N+](=O)[O-])c1N1CCC[C@H](Oc2ccccc2Cl)C1 ZINC000582686687 940812210 /nfs/dbraw/zinc/81/22/10/940812210.db2.gz CEOKYOUODQIKIM-ZDUSSCGKSA-N 0 0 364.833 3.821 20 5 FHBDRN CCS[C@H]1CCCC[C@H]1NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000175258224 940832566 /nfs/dbraw/zinc/83/25/66/940832566.db2.gz UZKQRHXJSFVIPJ-WBVHZDCISA-N 0 0 374.466 3.575 20 5 FHBDRN O=C(NCc1cccc([N+](=O)[O-])c1)N[C@@H](c1nccs1)c1ccccc1 ZINC000170879651 940878082 /nfs/dbraw/zinc/87/80/82/940878082.db2.gz ZTSBFRWEVROVBP-MRXNPFEDSA-N 0 0 368.418 3.640 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)Nc2c(F)cccc2Br)c1 ZINC000175517639 940882655 /nfs/dbraw/zinc/88/26/55/940882655.db2.gz LHLCBPBLKDPCNT-UHFFFAOYSA-N 0 0 369.146 3.757 20 5 FHBDRN C[C@H](c1cccc(F)c1)N1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2)CC1 ZINC000170893231 940884609 /nfs/dbraw/zinc/88/46/09/940884609.db2.gz WDLHBZBADLCHLL-CQSZACIVSA-N 0 0 372.400 3.645 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CC=C(c3ccccc3C)C2)c1 ZINC000549053990 940887289 /nfs/dbraw/zinc/88/72/89/940887289.db2.gz WVWODLIQHSCALW-UHFFFAOYSA-N 0 0 352.390 3.841 20 5 FHBDRN O=C(Nc1ccc(-c2cc[nH]n2)cc1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000180262050 940891282 /nfs/dbraw/zinc/89/12/82/940891282.db2.gz VMROKPWYWYHBOR-UHFFFAOYSA-N 0 0 374.303 3.839 20 5 FHBDRN CC(C)(NC(=O)N[C@@H]1CCCC[C@@H]1n1cccn1)c1ccc([N+](=O)[O-])cc1 ZINC000175611130 940898974 /nfs/dbraw/zinc/89/89/74/940898974.db2.gz ACSSBRCPNRRZJF-SJORKVTESA-N 0 0 371.441 3.510 20 5 FHBDRN C[C@H]1CC(=O)Oc2cc(Oc3ncnc4sc([N+](=O)[O-])cc43)ccc21 ZINC000376392883 940905284 /nfs/dbraw/zinc/90/52/84/940905284.db2.gz XYYSJBMKSULGNG-QMMMGPOBSA-N 0 0 357.347 3.804 20 5 FHBDRN Cc1nc(NC(=O)COc2ccc(Cl)c3cccnc23)ccc1[N+](=O)[O-] ZINC000175672756 940907205 /nfs/dbraw/zinc/90/72/05/940907205.db2.gz VWPAKBIQAVPWPV-UHFFFAOYSA-N 0 0 372.768 3.517 20 5 FHBDRN C[C@H](c1ccccc1Cl)N(C)C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000180274043 940909653 /nfs/dbraw/zinc/90/96/53/940909653.db2.gz PZYMAXMIOOOWDU-SNVBAGLBSA-N 0 0 362.769 3.810 20 5 FHBDRN C[C@H](c1cccnc1)N(C)C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000175699408 940914474 /nfs/dbraw/zinc/91/44/74/940914474.db2.gz CQOCXXHOKLZUAR-SNVBAGLBSA-N 0 0 364.199 3.586 20 5 FHBDRN C[C@@H](Nc1ccc(C(N)=O)cc1[N+](=O)[O-])c1cccc(OC(F)(F)F)c1 ZINC000175730886 940915712 /nfs/dbraw/zinc/91/57/12/940915712.db2.gz ALARDKUCJUVIKO-SECBINFHSA-N 0 0 369.299 3.765 20 5 FHBDRN CCCN1C(=O)CCc2cc(NC(=O)c3cc([N+](=O)[O-])c(C)s3)ccc21 ZINC000180284112 940919574 /nfs/dbraw/zinc/91/95/74/940919574.db2.gz IVNYTJORYPWUGG-UHFFFAOYSA-N 0 0 373.434 3.906 20 5 FHBDRN C[C@H]1[C@@H](c2ccccc2)CCN1C(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000175758718 940921577 /nfs/dbraw/zinc/92/15/77/940921577.db2.gz BAUPSRLROMGWGS-RDJZCZTQSA-N 0 0 354.406 3.768 20 5 FHBDRN Cc1nccn1-c1ccc([C@@H](C)NC(=O)c2cccc(C)c2[N+](=O)[O-])cc1 ZINC000175792228 940930012 /nfs/dbraw/zinc/93/00/12/940930012.db2.gz KIMQABSMRCWTNH-CQSZACIVSA-N 0 0 364.405 3.888 20 5 FHBDRN Cc1nccn1-c1ccc([C@H](C)NC(=O)c2cccc(C)c2[N+](=O)[O-])cc1 ZINC000175792213 940930160 /nfs/dbraw/zinc/93/01/60/940930160.db2.gz KIMQABSMRCWTNH-AWEZNQCLSA-N 0 0 364.405 3.888 20 5 FHBDRN O=c1[nH]c(N2CCS[C@@H](c3ccccc3)C2)nc2ccc([N+](=O)[O-])cc12 ZINC000376405374 940931641 /nfs/dbraw/zinc/93/16/41/940931641.db2.gz FAVLBRPUWBSMIK-MRXNPFEDSA-N 0 0 368.418 3.538 20 5 FHBDRN C[C@H]1c2ccccc2CCN1C(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000106682185 945361204 /nfs/dbraw/zinc/36/12/04/945361204.db2.gz RDEAHQXYVQKWDX-AWEZNQCLSA-N 0 0 362.389 3.540 20 5 FHBDRN CSCc1ccccc1NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000186081451 940941404 /nfs/dbraw/zinc/94/14/04/940941404.db2.gz HKWTXTMHMUCHMV-UHFFFAOYSA-N 0 0 368.418 3.896 20 5 FHBDRN Cc1cc(CCNC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)cc(C)c1O ZINC000188674139 940959311 /nfs/dbraw/zinc/95/93/11/940959311.db2.gz UMQNSQMJHPTECD-AWEZNQCLSA-N 0 0 374.462 3.757 20 5 FHBDRN CC1=C(c2ccco2)CN(c2nc3ccc([N+](=O)[O-])cc3c(=O)[nH]2)CC1 ZINC000376419848 940963695 /nfs/dbraw/zinc/96/36/95/940963695.db2.gz IMDFAPZCUMZDQM-UHFFFAOYSA-N 0 0 352.350 3.520 20 5 FHBDRN C[C@H](NC(=O)CCc1cn(C)c2ccccc12)c1cccc([N+](=O)[O-])c1 ZINC000175961966 940964972 /nfs/dbraw/zinc/96/49/72/940964972.db2.gz OGXPJTVYEGLUQW-AWEZNQCLSA-N 0 0 351.406 3.897 20 5 FHBDRN COc1ccc(C[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1OC ZINC000180328931 940973141 /nfs/dbraw/zinc/97/31/41/940973141.db2.gz INUJTTOKEPNLTI-GFCCVEGCSA-N 0 0 358.394 3.738 20 5 FHBDRN CCCN(C[C@H]1CCCCO1)C(=O)c1ccc(SC)c([N+](=O)[O-])c1 ZINC000106695232 945364825 /nfs/dbraw/zinc/36/48/25/945364825.db2.gz NVWZKQSHUKXZPT-CQSZACIVSA-N 0 0 352.456 3.738 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CCO[C@@H](CCc2ccccc2)C1 ZINC000186387113 940989073 /nfs/dbraw/zinc/98/90/73/940989073.db2.gz SGJSTXZJSKLKEW-SFHVURJKSA-N 0 0 369.421 3.769 20 5 FHBDRN CCc1ccc(CCSc2ccc([N+](=O)[O-])c(S(C)(=O)=O)c2)cc1 ZINC000507598429 945359910 /nfs/dbraw/zinc/35/99/10/945359910.db2.gz JZHMCBYDZKDCFC-UHFFFAOYSA-N 0 0 365.476 3.896 20 5 FHBDRN CCOc1ccc(-c2noc(CN[C@H](C)c3cccc([N+](=O)[O-])c3)n2)cc1 ZINC000180402174 940999390 /nfs/dbraw/zinc/99/93/90/940999390.db2.gz OUFWUTLKEWZYJK-CYBMUJFWSA-N 0 0 368.393 3.894 20 5 FHBDRN Cc1ccc(C(=O)N2CCC[C@@H]2CC(=O)c2cccs2)cc1[N+](=O)[O-] ZINC000176211897 941004139 /nfs/dbraw/zinc/00/41/39/941004139.db2.gz RGRWWSBBYDGUKX-CQSZACIVSA-N 0 0 358.419 3.842 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccc(Nc2ccccc2)nc1 ZINC000427445160 945367643 /nfs/dbraw/zinc/36/76/43/945367643.db2.gz YLUXCXPWYPMWHX-UHFFFAOYSA-N 0 0 364.361 3.994 20 5 FHBDRN CCc1cc(NC(=O)[C@@H](C)n2nc(C)cc2C)c2cc([N+](=O)[O-])ccc2n1 ZINC000180504356 941035110 /nfs/dbraw/zinc/03/51/10/941035110.db2.gz LMRBYJPYDNSEHV-CYBMUJFWSA-N 0 0 367.409 3.718 20 5 FHBDRN CN(Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)Cc1cc(Cl)cn1C ZINC000180570858 941044132 /nfs/dbraw/zinc/04/41/32/941044132.db2.gz NANJDAGALIGFON-UHFFFAOYSA-N 0 0 373.844 3.619 20 5 FHBDRN O=[N+]([O-])c1ccccc1-c1nnc(CN2CCCCc3ccccc32)o1 ZINC001167700136 941045027 /nfs/dbraw/zinc/04/50/27/941045027.db2.gz NEMIWYMYYXGLCF-UHFFFAOYSA-N 0 0 350.378 3.988 20 5 FHBDRN Cc1nc(CC(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)c(C)s1 ZINC000180621986 941056293 /nfs/dbraw/zinc/05/62/93/941056293.db2.gz UNWMEKIKPNHBKN-UHFFFAOYSA-N 0 0 370.228 3.612 20 5 FHBDRN Nc1cccc([N+](=O)[O-])c1C(=O)NCC1(c2ccc(F)cc2)CCCC1 ZINC000180662575 941060371 /nfs/dbraw/zinc/06/03/71/941060371.db2.gz XCUYXDXVJMZBOD-UHFFFAOYSA-N 0 0 357.385 3.558 20 5 FHBDRN COc1ccccc1[C@H](C)CC(=O)OCCOc1cccc([N+](=O)[O-])c1 ZINC000728664036 941061489 /nfs/dbraw/zinc/06/14/89/941061489.db2.gz WKZQBURZAHZDGV-CQSZACIVSA-N 0 0 359.378 3.719 20 5 FHBDRN Cn1ncc([N+](=O)[O-])c1C(=O)Nc1ccccc1Nc1ccc(F)cc1F ZINC000180674230 941063174 /nfs/dbraw/zinc/06/31/74/941063174.db2.gz KAKTUTLNXYEHKB-UHFFFAOYSA-N 0 0 373.319 3.602 20 5 FHBDRN CCC(O)(CC)COc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000180677920 941063591 /nfs/dbraw/zinc/06/35/91/941063591.db2.gz YVPOWCZOHOUDLR-UHFFFAOYSA-N 0 0 358.394 3.777 20 5 FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CC12CCCCC2 ZINC000180685742 941064023 /nfs/dbraw/zinc/06/40/23/941064023.db2.gz HYAPQHIDMYCMBA-INIZCTEOSA-N 0 0 364.467 3.786 20 5 FHBDRN CC(=O)c1cc(N[C@H](c2cnn(C)c2)c2ccccc2)ccc1[N+](=O)[O-] ZINC000376473882 941064657 /nfs/dbraw/zinc/06/46/57/941064657.db2.gz JHDQFAYUYLUFCO-IBGZPJMESA-N 0 0 350.378 3.732 20 5 FHBDRN O=C(COc1ccccc1[N+](=O)[O-])Nc1ccc2nc(C3CC3)oc2c1 ZINC000176623864 941064717 /nfs/dbraw/zinc/06/47/17/941064717.db2.gz KXYFPGYEHPBNBX-UHFFFAOYSA-N 0 0 353.334 3.631 20 5 FHBDRN O=C(NCC1(c2cc(F)cc(C(F)(F)F)c2)CC1)c1ccc([N+](=O)[O-])o1 ZINC000188742225 941072846 /nfs/dbraw/zinc/07/28/46/941072846.db2.gz GUAWBVRVLVOMBV-UHFFFAOYSA-N 0 0 372.274 3.807 20 5 FHBDRN Cc1cc(C(=O)Nc2ccccc2C(=O)NC(C)(C)C)cc([N+](=O)[O-])c1 ZINC000122135777 941074524 /nfs/dbraw/zinc/07/45/24/941074524.db2.gz WRWGLTWLKGUQEA-UHFFFAOYSA-N 0 0 355.394 3.684 20 5 FHBDRN COc1c(F)cc(NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)cc1F ZINC000180827600 941082021 /nfs/dbraw/zinc/08/20/21/941082021.db2.gz XQWPZVUTGSJJRS-UHFFFAOYSA-N 0 0 374.246 3.735 20 5 FHBDRN CCC(CC)[C@@H]1C[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2Cl)CCO1 ZINC000180842195 941084688 /nfs/dbraw/zinc/08/46/88/941084688.db2.gz XAUPYGVQJWZKNC-LRDDRELGSA-N 0 0 354.834 3.962 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)N(CC(F)F)c1cccc(Cl)c1 ZINC000176931532 941085525 /nfs/dbraw/zinc/08/55/25/941085525.db2.gz VUPCLAGCTWOEJT-UHFFFAOYSA-N 0 0 355.728 3.864 20 5 FHBDRN Cn1cc(CNc2ccccc2-n2cccn2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000180867339 941086999 /nfs/dbraw/zinc/08/69/99/941086999.db2.gz SVPDCQDVVNSNEL-UHFFFAOYSA-N 0 0 374.404 3.793 20 5 FHBDRN COc1cc(C(=O)N2CCC[C@H]2c2ccc(F)cc2)c([N+](=O)[O-])cc1OC ZINC000122151372 941087654 /nfs/dbraw/zinc/08/76/54/941087654.db2.gz GRXNOHJERSAAML-HNNXBMFYSA-N 0 0 374.368 3.728 20 5 FHBDRN COc1ccc([C@H](CCO)Nc2ccc([N+](=O)[O-])c3cnccc23)cc1 ZINC000176960197 941088749 /nfs/dbraw/zinc/08/87/49/941088749.db2.gz VIIMPXQYRGJDIO-KRWDZBQOSA-N 0 0 353.378 3.687 20 5 FHBDRN COCCOc1ccccc1CNCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000892659955 941095082 /nfs/dbraw/zinc/09/50/82/941095082.db2.gz ODHMOZOZWWVKIE-UHFFFAOYSA-N 0 0 350.802 3.563 20 5 FHBDRN O=C(N[C@@H]1CCSc2ccc(F)cc21)c1ccc(F)cc1[N+](=O)[O-] ZINC000177063421 941097188 /nfs/dbraw/zinc/09/71/88/941097188.db2.gz IWTZHUNBCJUJAV-CYBMUJFWSA-N 0 0 350.346 3.840 20 5 FHBDRN CCN(CC1CCN(c2ccccn2)CC1)c1nc(C)cc(C)c1[N+](=O)[O-] ZINC000541006651 941098691 /nfs/dbraw/zinc/09/86/91/941098691.db2.gz QZXPPNGJBSFEFQ-UHFFFAOYSA-N 0 0 369.469 3.745 20 5 FHBDRN COc1ccc2c(c1)OCC[C@H]2NC(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000365524017 941100043 /nfs/dbraw/zinc/10/00/43/941100043.db2.gz BXSWYXWTCDIEML-CQSZACIVSA-N 0 0 362.769 3.510 20 5 FHBDRN CCOc1ccc2c(c1)[C@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1C)CCO2 ZINC000188829886 941101617 /nfs/dbraw/zinc/10/16/17/941101617.db2.gz BZNBDEGQJNMOHZ-QGZVFWFLSA-N 0 0 371.393 3.947 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H](c3ccccc3)C(C)(C)C2)c1 ZINC000122170484 941107071 /nfs/dbraw/zinc/10/70/71/941107071.db2.gz IBRIURPPQQRLEE-KRWDZBQOSA-N 0 0 354.406 3.869 20 5 FHBDRN COc1cc(COC(=O)c2cc(F)c(Cl)cc2F)ccc1[N+](=O)[O-] ZINC000782844730 941108909 /nfs/dbraw/zinc/10/89/09/941108909.db2.gz WIPKWXOSEWKXPA-UHFFFAOYSA-N 0 0 357.696 3.892 20 5 FHBDRN CC[C@@H](NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)c1c(C)noc1C ZINC000541032142 941112994 /nfs/dbraw/zinc/11/29/94/941112994.db2.gz PGKOUFNBYOVIJM-LLVKDONJSA-N 0 0 369.324 3.682 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)N[C@H](CCO)C2CCCCC2)cc1[N+](=O)[O-] ZINC000120142787 941114915 /nfs/dbraw/zinc/11/49/15/941114915.db2.gz KNQNPQDHLSSEKA-WMLDXEAASA-N 0 0 363.458 3.595 20 5 FHBDRN C[C@@]1(c2ccccc2)CCCN(C(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)C1 ZINC000181239181 941115449 /nfs/dbraw/zinc/11/54/49/941115449.db2.gz BBTCZLJMEXMJQH-HXUWFJFHSA-N 0 0 368.389 3.517 20 5 FHBDRN O=C(Nc1ccc(CC(F)(F)F)cc1)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000181267290 941119013 /nfs/dbraw/zinc/11/90/13/941119013.db2.gz HGROPVWEKLKYQW-UHFFFAOYSA-N 0 0 368.267 3.681 20 5 FHBDRN Cc1cc(COC(=O)CCc2nnc(-c3ccsc3)o2)ccc1[N+](=O)[O-] ZINC000181276748 941119614 /nfs/dbraw/zinc/11/96/14/941119614.db2.gz MZTRQHWTAMZFNU-UHFFFAOYSA-N 0 0 373.390 3.691 20 5 FHBDRN Cc1cc(NC(=O)c2c(N)cccc2[N+](=O)[O-])nn1-c1cccc(Cl)c1 ZINC000181323257 941121432 /nfs/dbraw/zinc/12/14/32/941121432.db2.gz BSCAMQGEWCOGDE-UHFFFAOYSA-N 0 0 371.784 3.577 20 5 FHBDRN Cc1c(NC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)cccc1C(F)(F)F ZINC000181328267 941121945 /nfs/dbraw/zinc/12/19/45/941121945.db2.gz XOWAPGPRCKCNOE-UHFFFAOYSA-N 0 0 368.267 3.903 20 5 FHBDRN C[C@@H]1CCCN(c2ccc(C(=O)Nc3ccc(O)cc3F)cc2[N+](=O)[O-])C1 ZINC000782854940 941122307 /nfs/dbraw/zinc/12/23/07/941122307.db2.gz JUTWJVIAVACWSL-GFCCVEGCSA-N 0 0 373.384 3.928 20 5 FHBDRN COc1ccc2c(c1)CCN2C(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000128312420 941126021 /nfs/dbraw/zinc/12/60/21/941126021.db2.gz NUUSZPZQAJVERW-UHFFFAOYSA-N 0 0 366.295 3.825 20 5 FHBDRN CCOc1cccc2[nH]cc(CC(=O)N3CCc4c3cccc4[N+](=O)[O-])c21 ZINC000188931107 941131505 /nfs/dbraw/zinc/13/15/05/941131505.db2.gz VZZJSVNNAXENSQ-UHFFFAOYSA-N 0 0 365.389 3.607 20 5 FHBDRN Cc1ocnc1C(=O)Nc1ccc(OCc2ccccc2)cc1[N+](=O)[O-] ZINC000188977457 941137621 /nfs/dbraw/zinc/13/76/21/941137621.db2.gz QYJYOEUZVUNSDZ-UHFFFAOYSA-N 0 0 353.334 3.723 20 5 FHBDRN O=C(CC1CCOCC1)Nc1ccc(OCc2ccccc2)cc1[N+](=O)[O-] ZINC000188976694 941137705 /nfs/dbraw/zinc/13/77/05/941137705.db2.gz PIOUWHPVGZXMLV-UHFFFAOYSA-N 0 0 370.405 3.929 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CCOc2c(F)cccc21 ZINC000188986280 941140638 /nfs/dbraw/zinc/14/06/38/941140638.db2.gz MNHRRDRNNOMMMT-KSSFIOAISA-N 0 0 372.396 3.943 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])Nc1cc(F)cc(F)c1Br ZINC000189058271 941145949 /nfs/dbraw/zinc/14/59/49/941145949.db2.gz AVQIIJGVJSWJTB-UHFFFAOYSA-N 0 0 371.137 3.817 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@H](C)Oc2ncccc21 ZINC000189070907 941146199 /nfs/dbraw/zinc/14/61/99/941146199.db2.gz IRTQIJOVCUUIFL-LBPRGKRZSA-N 0 0 373.434 3.918 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)N1CCc2cc(Cl)cc(Cl)c2C1 ZINC000177680877 941146315 /nfs/dbraw/zinc/14/63/15/941146315.db2.gz BEQCDLXGXOHPFP-UHFFFAOYSA-N 0 0 366.204 3.804 20 5 FHBDRN Cc1csc([C@@H]2COCCN2c2ccc([N+](=O)[O-])c(OC(F)F)c2)n1 ZINC000189136048 941147318 /nfs/dbraw/zinc/14/73/18/941147318.db2.gz WKDHSZLSMMDWBL-LBPRGKRZSA-N 0 0 371.365 3.539 20 5 FHBDRN O=[N+]([O-])c1cnc(N[C@H]2CCCC23CCOCC3)c(Br)c1 ZINC000407952595 941152433 /nfs/dbraw/zinc/15/24/33/941152433.db2.gz INZVTBNGSIHVAL-LBPRGKRZSA-N 0 0 356.220 3.514 20 5 FHBDRN O=C(NCc1cccc([N+](=O)[O-])c1)Nc1ccc(F)cc1OCC(F)F ZINC000181411787 941154682 /nfs/dbraw/zinc/15/46/82/941154682.db2.gz IMQIVFGAMXUXFV-UHFFFAOYSA-N 0 0 369.299 3.700 20 5 FHBDRN C[C@H](C(=O)NCc1ccc(Cl)cc1F)c1ccc([N+](=O)[O-])cc1F ZINC000189291552 941155325 /nfs/dbraw/zinc/15/53/25/941155325.db2.gz KGGOKXOSWMUHNY-VIFPVBQESA-N 0 0 354.740 3.946 20 5 FHBDRN Cc1nc(NC(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)ccc1[N+](=O)[O-] ZINC000189294174 941155508 /nfs/dbraw/zinc/15/55/08/941155508.db2.gz GCBWLQDYIMCISM-UHFFFAOYSA-N 0 0 365.311 3.987 20 5 FHBDRN CSCc1cccc(CNC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)c1 ZINC000189299793 941155788 /nfs/dbraw/zinc/15/57/88/941155788.db2.gz URWPTNMVDAPKKY-UHFFFAOYSA-N 0 0 355.419 3.869 20 5 FHBDRN Cn1cc(CCNC(=O)Cc2cccc([N+](=O)[O-])c2)c2ccc(Cl)cc21 ZINC000189358708 941157531 /nfs/dbraw/zinc/15/75/31/941157531.db2.gz XRTOFZIWBCWWAC-UHFFFAOYSA-N 0 0 371.824 3.641 20 5 FHBDRN Cc1c(CS(=O)(=O)c2cccc(C(F)(F)F)c2)cccc1[N+](=O)[O-] ZINC000189365970 941157680 /nfs/dbraw/zinc/15/76/80/941157680.db2.gz BABNRBDVILDUKY-UHFFFAOYSA-N 0 0 359.325 3.896 20 5 FHBDRN COC[C@H](Cc1ccccc1)N(C)C(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000189482396 941158916 /nfs/dbraw/zinc/15/89/16/941158916.db2.gz WIAGWBQEPIFYPP-HNNXBMFYSA-N 0 0 362.813 3.578 20 5 FHBDRN C[C@@H](CCNC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)CC(C)(C)C ZINC000189480213 941158940 /nfs/dbraw/zinc/15/89/40/941158940.db2.gz YWUXYRNMPRBDAZ-LBPRGKRZSA-N 0 0 359.426 3.629 20 5 FHBDRN CCN(Cc1c[nH]c2ccccc12)C(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000189562883 941161270 /nfs/dbraw/zinc/16/12/70/941161270.db2.gz YIYXHLSSGSQOBV-UHFFFAOYSA-N 0 0 353.378 3.504 20 5 FHBDRN CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)OCc2cncs2)CC1 ZINC000122219680 941164094 /nfs/dbraw/zinc/16/40/94/941164094.db2.gz MTOPSGQXCMIXQL-UHFFFAOYSA-N 0 0 361.423 3.645 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)Nc2cc(Br)ccc2O)c1 ZINC000085590275 941164687 /nfs/dbraw/zinc/16/46/87/941164687.db2.gz MONIJMVSCIJLII-UHFFFAOYSA-N 0 0 351.156 3.624 20 5 FHBDRN COC(=O)[C@H](NCc1ccc([N+](=O)[O-])cc1Cl)c1ccc(C)c(C)c1 ZINC000189645648 941240111 /nfs/dbraw/zinc/24/01/11/941240111.db2.gz FGMYRJABLJJPCG-QGZVFWFLSA-N 0 0 362.813 3.869 20 5 FHBDRN Cn1cc(CN2CCc3cc(F)ccc3C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000181440718 941255171 /nfs/dbraw/zinc/25/51/71/941255171.db2.gz WRFHSLKVKZIDAO-UHFFFAOYSA-N 0 0 366.396 3.693 20 5 FHBDRN O=C(Cn1ccc([N+](=O)[O-])n1)Nc1ccc(Cl)cc1-c1ccccc1 ZINC000189739413 941267254 /nfs/dbraw/zinc/26/72/54/941267254.db2.gz KWABMFITLFFGGG-UHFFFAOYSA-N 0 0 356.769 3.750 20 5 FHBDRN O=[N+]([O-])c1cc(CN2CCO[C@H](CF)C2)ccc1Oc1ccc(F)cc1 ZINC000414467243 941276898 /nfs/dbraw/zinc/27/68/98/941276898.db2.gz DDNWGTMSNLFDSN-MRXNPFEDSA-N 0 0 364.348 3.697 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CC2(CCOCC2)c2ccccc21 ZINC000189792106 941281053 /nfs/dbraw/zinc/28/10/53/941281053.db2.gz JRMHKNKFXIAUQA-UHFFFAOYSA-N 0 0 372.808 3.957 20 5 FHBDRN Cc1ccc(-n2cccn2)cc1NC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000189811857 941285119 /nfs/dbraw/zinc/28/51/19/941285119.db2.gz HUGOCDKMLOBGHS-UHFFFAOYSA-N 0 0 356.769 3.995 20 5 FHBDRN Cc1cc(C(F)(F)F)ccc1CNC(=O)Cc1ccccc1[N+](=O)[O-] ZINC000189849595 941289135 /nfs/dbraw/zinc/28/91/35/941289135.db2.gz OHUQRYFHKMJUAE-UHFFFAOYSA-N 0 0 352.312 3.781 20 5 FHBDRN Cc1cc(N2CCN(c3ccccn3)CC2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000549107426 941294275 /nfs/dbraw/zinc/29/42/75/941294275.db2.gz LXTYVFPHXAKJRX-UHFFFAOYSA-N 0 0 366.343 3.644 20 5 FHBDRN Cc1sc(S(=O)(=O)N(c2ccccc2)[C@@H]2C[C@H]2C)cc1[N+](=O)[O-] ZINC000414475098 941305644 /nfs/dbraw/zinc/30/56/44/941305644.db2.gz UEPCWFJQSKGGRT-ZWNOBZJWSA-N 0 0 352.437 3.568 20 5 FHBDRN CC(C)c1ccc(C(=O)NCc2nc3cc(F)ccc3[nH]2)cc1[N+](=O)[O-] ZINC000189962088 941313816 /nfs/dbraw/zinc/31/38/16/941313816.db2.gz XLBMTGGAFBPRKB-UHFFFAOYSA-N 0 0 356.357 3.664 20 5 FHBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2CCCC[C@@H]2C1 ZINC000408001760 941332726 /nfs/dbraw/zinc/33/27/26/941332726.db2.gz ACPLGUYRBAOTJM-TXEJJXNPSA-N 0 0 367.243 3.928 20 5 FHBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CCS[C@H](C)[C@@H]1C ZINC000408004563 941338369 /nfs/dbraw/zinc/33/83/69/941338369.db2.gz YEWHIIMXGIMKHH-VHSXEESVSA-N 0 0 373.272 3.632 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H](C)Oc2ccc(Cl)cc21 ZINC000072530986 941367733 /nfs/dbraw/zinc/36/77/33/941367733.db2.gz AZYUZVVMSABAFJ-SNVBAGLBSA-N 0 0 362.769 3.685 20 5 FHBDRN COc1ccc(CN[C@H](C)c2nccn2-c2ccccc2)cc1[N+](=O)[O-] ZINC000376622046 941368125 /nfs/dbraw/zinc/36/81/25/941368125.db2.gz MNYICWOXICGXHY-CQSZACIVSA-N 0 0 352.394 3.640 20 5 FHBDRN COc1ccc(-c2ccc(CN[C@H](C)c3csnn3)o2)c([N+](=O)[O-])c1 ZINC000414549680 941377647 /nfs/dbraw/zinc/37/76/47/941377647.db2.gz LTWDIJKKGIBLHG-SNVBAGLBSA-N 0 0 360.395 3.566 20 5 FHBDRN C[C@@H]1COc2ccccc2N1C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000072533239 941378628 /nfs/dbraw/zinc/37/86/28/941378628.db2.gz IUYNORQPIVYWRO-CQSZACIVSA-N 0 0 367.405 3.623 20 5 FHBDRN C[C@H](NC(=O)c1csc([N+](=O)[O-])c1)c1nc(C(F)(F)F)cs1 ZINC000278809400 941384971 /nfs/dbraw/zinc/38/49/71/941384971.db2.gz SHSOWFJSHTYFPU-YFKPBYRVSA-N 0 0 351.331 3.623 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])c2cccnc12)N1CC[C@H](c2ccc(F)cc2)C1 ZINC000376821645 941438662 /nfs/dbraw/zinc/43/86/62/941438662.db2.gz FXVBCTVEXMUSJH-AWEZNQCLSA-N 0 0 365.364 3.912 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@H](C[C@H]2CCOC2)C1 ZINC000376948890 941475044 /nfs/dbraw/zinc/47/50/44/941475044.db2.gz MPFJRTSXVUEWBK-GUDVDZBRSA-N 0 0 374.481 3.829 20 5 FHBDRN CCC(=O)c1ccc(N[C@@H](c2nc[nH]n2)c2ccccc2)c([N+](=O)[O-])c1 ZINC000377087062 941511739 /nfs/dbraw/zinc/51/17/39/941511739.db2.gz SDOHRPQQQHPRGO-QGZVFWFLSA-N 0 0 351.366 3.507 20 5 FHBDRN Nc1c(C(=O)N2CCC[C@@H](c3ccccc3)CC2)cc(F)cc1[N+](=O)[O-] ZINC000066763065 941515593 /nfs/dbraw/zinc/51/55/93/941515593.db2.gz OFGCWDFVKMWPJQ-CQSZACIVSA-N 0 0 357.385 3.726 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)Nc2c[nH]nc2Br)cc1[N+](=O)[O-] ZINC001143487312 941524667 /nfs/dbraw/zinc/52/46/67/941524667.db2.gz KHTQVEPEJZBGSL-UHFFFAOYSA-N 0 0 367.203 3.630 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CCc3nc(-c4ccccc4Cl)sc3C2)nc1 ZINC000377135861 941527072 /nfs/dbraw/zinc/52/70/72/941527072.db2.gz HULOMLNEIOEDCN-UHFFFAOYSA-N 0 0 373.825 3.724 20 5 FHBDRN O=C(CSc1ccccc1[N+](=O)[O-])Nc1nccn1Cc1ccccc1 ZINC000549149659 941537089 /nfs/dbraw/zinc/53/70/89/941537089.db2.gz VBZMUKPONFUSIZ-UHFFFAOYSA-N 0 0 368.418 3.570 20 5 FHBDRN Cc1ncsc1-c1nc(COc2ccc(Cl)c([N+](=O)[O-])c2)no1 ZINC000377177037 941538185 /nfs/dbraw/zinc/53/81/85/941538185.db2.gz UAMREZGRIZPMES-UHFFFAOYSA-N 0 0 352.759 3.642 20 5 FHBDRN Cc1cc(C(=O)N2CCC[C@H]2c2cccc3c2OCCO3)ccc1[N+](=O)[O-] ZINC000066771182 941539520 /nfs/dbraw/zinc/53/95/20/941539520.db2.gz CENAPNKGHXPUCC-KRWDZBQOSA-N 0 0 368.389 3.652 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Cc1noc2ccc(F)cc21 ZINC000415004375 941541168 /nfs/dbraw/zinc/54/11/68/941541168.db2.gz QFVNFHIZCGBJMW-UHFFFAOYSA-N 0 0 371.368 3.855 20 5 FHBDRN Cn1c(COc2ccccc2)nnc1SCc1cc(F)ccc1[N+](=O)[O-] ZINC000178306026 941559056 /nfs/dbraw/zinc/55/90/56/941559056.db2.gz OMJRRGMGMROJBS-UHFFFAOYSA-N 0 0 374.397 3.734 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)cnc1NCCC1CCN(CC(F)(F)F)CC1 ZINC000153901090 941586166 /nfs/dbraw/zinc/58/61/66/941586166.db2.gz JYUMSWVNZWQVBE-UHFFFAOYSA-N 0 0 366.771 3.720 20 5 FHBDRN Cc1cc(N2CCC[C@H](c3nccn3C)C2)c2cccc([N+](=O)[O-])c2n1 ZINC000365547155 941587404 /nfs/dbraw/zinc/58/74/04/941587404.db2.gz ODISLKAOMAVDPP-AWEZNQCLSA-N 0 0 351.410 3.569 20 5 FHBDRN O=C(Nc1cccc(F)c1F)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000040230860 941591722 /nfs/dbraw/zinc/59/17/22/941591722.db2.gz YKXJHIQRHQWIRK-UHFFFAOYSA-N 0 0 357.110 3.888 20 5 FHBDRN CC(C)CC[C@H]1CCCCN1C(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000472700965 941596338 /nfs/dbraw/zinc/59/63/38/941596338.db2.gz RSKPVPOJYXRACS-OAHLLOKOSA-N 0 0 371.441 3.606 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N2CC3(CCOCC3)[C@@H]2c2ccco2)c1C ZINC000892842104 941609662 /nfs/dbraw/zinc/60/96/62/941609662.db2.gz ABZKZHBDVPBONH-SFHVURJKSA-N 0 0 370.405 3.799 20 5 FHBDRN C[C@@H]1CCCc2ncc(C(=O)N3CCCCc4cc([N+](=O)[O-])ccc43)n21 ZINC000892853864 941615483 /nfs/dbraw/zinc/61/54/83/941615483.db2.gz IEJAXGYSJRYAQI-CYBMUJFWSA-N 0 0 354.410 3.672 20 5 FHBDRN Cc1cc(NC(=O)NCc2nc3ccccc3n2C2CC2)ccc1[N+](=O)[O-] ZINC000549194033 941621800 /nfs/dbraw/zinc/62/18/00/941621800.db2.gz MARDWQPTBNFJPN-UHFFFAOYSA-N 0 0 365.393 3.910 20 5 FHBDRN Cc1ccc(-c2nnc(N(Cc3ccc([N+](=O)[O-])cc3)C3CC3)n2C)s1 ZINC000565626408 941631614 /nfs/dbraw/zinc/63/16/14/941631614.db2.gz MCKKZBKDBVDZNI-UHFFFAOYSA-N 0 0 369.450 3.929 20 5 FHBDRN O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCCC2(CC2)C1 ZINC000472742958 941661604 /nfs/dbraw/zinc/66/16/04/941661604.db2.gz AMYIEAKUSCYTMG-UHFFFAOYSA-N 0 0 371.359 3.818 20 5 FHBDRN COc1cc(N2CCC(c3ncc4n3CCCC4)CC2)c([N+](=O)[O-])cc1F ZINC000278813221 941670512 /nfs/dbraw/zinc/67/05/12/941670512.db2.gz INFYHRQMRTWAPK-UHFFFAOYSA-N 0 0 374.416 3.659 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)Nc2cc3c(cc2C(C)=O)OCO3)c1 ZINC000024478550 941690403 /nfs/dbraw/zinc/69/04/03/941690403.db2.gz ISASPFFKDFFPFO-UHFFFAOYSA-N 0 0 374.374 3.500 20 5 FHBDRN Cc1sc(NC(=O)c2cc([N+](=O)[O-])cn2C)nc1-c1ccc(F)cc1 ZINC000024478836 941690447 /nfs/dbraw/zinc/69/04/47/941690447.db2.gz HEUFRZSLOXWLRB-UHFFFAOYSA-N 0 0 360.370 3.757 20 5 FHBDRN Cc1nc(CNc2ccc([N+](=O)[O-])cc2C(F)(F)F)ccc1[C@@H](C)O ZINC000275492973 941695929 /nfs/dbraw/zinc/69/59/29/941695929.db2.gz RKXWZHDTFNJAKC-SNVBAGLBSA-N 0 0 355.316 3.982 20 5 FHBDRN C[C@@H](OC(=O)COc1cccc2cccnc21)c1cccc([N+](=O)[O-])c1 ZINC000729245742 941700797 /nfs/dbraw/zinc/70/07/97/941700797.db2.gz GYUUOSQTFSGXFN-CYBMUJFWSA-N 0 0 352.346 3.826 20 5 FHBDRN O=C(Cc1cscc1Br)OCc1ccc([N+](=O)[O-])cc1F ZINC000814563703 941703452 /nfs/dbraw/zinc/70/34/52/941703452.db2.gz ASJLBDADJQKWAM-UHFFFAOYSA-N 0 0 374.187 3.844 20 5 FHBDRN Nc1c(C(=O)NCCc2cccc(Cl)c2Cl)cc(F)cc1[N+](=O)[O-] ZINC000517395620 941711178 /nfs/dbraw/zinc/71/11/78/941711178.db2.gz XNBZGMFLVSARNP-UHFFFAOYSA-N 0 0 372.183 3.595 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2c3ccccc3OC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000415260630 941712256 /nfs/dbraw/zinc/71/22/56/941712256.db2.gz FXZMQFRDWYMSKL-ZDUSSCGKSA-N 0 0 356.378 3.810 20 5 FHBDRN CC/C=C(\C)C(=O)N1CCCC[C@@H]1CCOC(=O)c1cccc([N+](=O)[O-])c1 ZINC000729324829 941719049 /nfs/dbraw/zinc/71/90/49/941719049.db2.gz IJSGIPPXCUFENM-SXKJYUOZSA-N 0 0 374.437 3.879 20 5 FHBDRN CC/C=C(/C)C(=O)N1CCCC[C@@H]1CCOC(=O)c1cccc([N+](=O)[O-])c1 ZINC000729324799 941719109 /nfs/dbraw/zinc/71/91/09/941719109.db2.gz IJSGIPPXCUFENM-IJZIWBRISA-N 0 0 374.437 3.879 20 5 FHBDRN CN(C[C@@H]1CCN(c2c(F)cc([N+](=O)[O-])cc2F)C1)C(=O)OC(C)(C)C ZINC000178870756 941733669 /nfs/dbraw/zinc/73/36/69/941733669.db2.gz WLLISWWDELXOBH-NSHDSACASA-N 0 0 371.384 3.566 20 5 FHBDRN CCOc1ccc2nc(NC(=O)c3cc(OC)ccc3[N+](=O)[O-])sc2c1 ZINC000067295913 941735136 /nfs/dbraw/zinc/73/51/36/941735136.db2.gz HZWHWOFQDOZYNS-UHFFFAOYSA-N 0 0 373.390 3.864 20 5 FHBDRN COc1cc(CCNc2ncnc3sc([N+](=O)[O-])cc32)ccc1Cl ZINC000549246330 941736273 /nfs/dbraw/zinc/73/62/73/941736273.db2.gz HAXWHKSFRANOJH-UHFFFAOYSA-N 0 0 364.814 3.916 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)NCCc2ccc(C(F)(F)F)cc2)c1 ZINC000067298878 941738505 /nfs/dbraw/zinc/73/85/05/941738505.db2.gz OSNMCVZURJWYHA-UHFFFAOYSA-N 0 0 368.311 3.595 20 5 FHBDRN CNC(=O)c1ccc(N(Cc2ccccc2)CC2CCC2)c([N+](=O)[O-])c1 ZINC000513166528 941738532 /nfs/dbraw/zinc/73/85/32/941738532.db2.gz MHQYCSBHOLQEDU-UHFFFAOYSA-N 0 0 353.422 3.761 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)Nc1ccc(Oc2ccc(F)cc2)cn1 ZINC000729382412 941743841 /nfs/dbraw/zinc/74/38/41/941743841.db2.gz USFDURFTSBKBPM-UHFFFAOYSA-N 0 0 368.324 3.877 20 5 FHBDRN Cc1nc(NC(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)cc(C2CC2)n1 ZINC000415320221 941751110 /nfs/dbraw/zinc/75/11/10/941751110.db2.gz VIFZGIOATRTYMT-UHFFFAOYSA-N 0 0 356.382 3.610 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N[C@@H]2CCC[C@@H]2c2ccccc2)c1F ZINC000412106946 941764668 /nfs/dbraw/zinc/76/46/68/941764668.db2.gz JFJHPZNAQLYRAI-GDBMZVCRSA-N 0 0 372.396 3.738 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)Nc2ccc(OCC3CC3)cc2)c1F ZINC000412109963 941767210 /nfs/dbraw/zinc/76/72/10/941767210.db2.gz CSRUFMMSUKFCBQ-UHFFFAOYSA-N 0 0 374.368 3.713 20 5 FHBDRN CC(=O)c1ccc(-c2nc(Cc3cccc([N+](=O)[O-])c3C)no2)c(F)c1 ZINC000472782048 941768450 /nfs/dbraw/zinc/76/84/50/941768450.db2.gz BVTTXFJBXRJZMJ-UHFFFAOYSA-N 0 0 355.325 3.886 20 5 FHBDRN Cc1c(NC(=O)[C@H](C)N2CCC[C@@H]2c2nccs2)cccc1[N+](=O)[O-] ZINC000377502478 941769063 /nfs/dbraw/zinc/76/90/63/941769063.db2.gz MGZHRCZLXSJSFD-SWLSCSKDSA-N 0 0 360.439 3.524 20 5 FHBDRN CCOc1cc(N[C@H]2CC(=O)N(Cc3ccccc3)[C@H]2C)ccc1[N+](=O)[O-] ZINC000542138538 941792558 /nfs/dbraw/zinc/79/25/58/941792558.db2.gz KJIYCWPYHVYTGZ-YOEHRIQHSA-N 0 0 369.421 3.595 20 5 FHBDRN Cn1ccnc1[C@H]1OCCC[C@@H]1Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000433606578 941793627 /nfs/dbraw/zinc/79/36/27/941793627.db2.gz GXZVLVDNOPQBPP-JSGCOSHPSA-N 0 0 370.331 3.679 20 5 FHBDRN CC(C)N(Cc1cnnn1Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000430014164 941800459 /nfs/dbraw/zinc/80/04/59/941800459.db2.gz UFCNNUTYGAELIM-UHFFFAOYSA-N 0 0 365.437 3.645 20 5 FHBDRN O=C(c1cc(-c2ccc(F)cc2)on1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000128333520 941813187 /nfs/dbraw/zinc/81/31/87/941813187.db2.gz OOAFJGMQJVCRET-UHFFFAOYSA-N 0 0 353.309 3.592 20 5 FHBDRN CC1CCC(OC2CCN(C(=O)c3cc(F)ccc3[N+](=O)[O-])CC2)CC1 ZINC000377583750 941827940 /nfs/dbraw/zinc/82/79/40/941827940.db2.gz OVLZDIRWEAPGCO-UHFFFAOYSA-N 0 0 364.417 3.934 20 5 FHBDRN CC(C)(C)[C@@H]1OCCC[C@@H]1CNC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412133883 941831162 /nfs/dbraw/zinc/83/11/62/941831162.db2.gz ZFBHDRBUQPHADU-BZZMCLGOSA-N 0 0 360.454 3.656 20 5 FHBDRN COc1ccc(C(=O)Nc2cc(-c3ccccc3)ns2)cc1[N+](=O)[O-] ZINC000118616984 941832215 /nfs/dbraw/zinc/83/22/15/941832215.db2.gz IALVQPZERFQCQF-UHFFFAOYSA-N 0 0 355.375 3.979 20 5 FHBDRN CCC(CC)c1cc(CNC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)on1 ZINC000412137986 941833123 /nfs/dbraw/zinc/83/31/23/941833123.db2.gz PULLSNSULJKGDN-DLBZAZTESA-N 0 0 357.410 3.906 20 5 FHBDRN Nc1ccc(S[C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)c(Cl)c1 ZINC000513296928 941834579 /nfs/dbraw/zinc/83/45/79/941834579.db2.gz MGDHHVLFMQUKBV-HNNXBMFYSA-N 0 0 363.826 3.728 20 5 FHBDRN COc1ccc(C(=O)Nc2cc([N+](=O)[O-])ccc2OC)c(OCC2CC2)c1 ZINC000472809902 941835622 /nfs/dbraw/zinc/83/56/22/941835622.db2.gz NMBCWOZTEUPTAX-UHFFFAOYSA-N 0 0 372.377 3.653 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CCS[C@@H](C(C)C)C2)ccc1[N+](=O)[O-] ZINC000412150079 941845688 /nfs/dbraw/zinc/84/56/88/941845688.db2.gz KGWDJHQGPNPLPJ-MRXNPFEDSA-N 0 0 352.456 3.596 20 5 FHBDRN CC(C)Oc1cc(C(=O)NC[C@@H]2CCCO[C@@H]2C(C)C)ccc1[N+](=O)[O-] ZINC000412159511 941853621 /nfs/dbraw/zinc/85/36/21/941853621.db2.gz JFDWCZFPOVPROC-MAUKXSAKSA-N 0 0 364.442 3.563 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@H](CC(F)(F)F)C1 ZINC000433741473 941860524 /nfs/dbraw/zinc/86/05/24/941860524.db2.gz IBWFYOKIMDGLIK-KGLIPLIRSA-N 0 0 358.360 3.964 20 5 FHBDRN Cc1ccc(C(=O)CCC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000513353055 941863199 /nfs/dbraw/zinc/86/31/99/941863199.db2.gz HAGMIPAAGSEVDL-UHFFFAOYSA-N 0 0 354.406 3.567 20 5 FHBDRN CCN(C(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1)[C@@H](C)CO ZINC000513340424 941863653 /nfs/dbraw/zinc/86/36/53/941863653.db2.gz JWLKSUNOCBXMOS-ZDUSSCGKSA-N 0 0 360.435 3.589 20 5 FHBDRN C[C@@H]([C@H]1Cc2ccccc2O1)N(C)C(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000119216443 941870556 /nfs/dbraw/zinc/87/05/56/941870556.db2.gz BZMAMSRRSXFPDO-HXPMCKFVSA-N 0 0 365.389 3.540 20 5 FHBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCC[C@H](O)C1 ZINC000119090824 941870574 /nfs/dbraw/zinc/87/05/74/941870574.db2.gz WFFRTGLUZXZEOE-HIFRSBDPSA-N 0 0 366.483 3.624 20 5 FHBDRN COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1ccc(F)cc1[N+](=O)[O-] ZINC000119085509 941870582 /nfs/dbraw/zinc/87/05/82/941870582.db2.gz RESPAWKNXPVZOJ-ZDUSSCGKSA-N 0 0 358.369 3.592 20 5 FHBDRN CC[C@@H](NCc1ccc(O)c(OC)c1[N+](=O)[O-])c1ccc(F)cc1F ZINC000893001257 941870671 /nfs/dbraw/zinc/87/06/71/941870671.db2.gz KYERXRFXFSPLJI-CQSZACIVSA-N 0 0 352.337 3.828 20 5 FHBDRN CCOc1cc(N2CC[NH+](Cc3ccsc3C)CC2)ccc1[N+](=O)[O-] ZINC000513365487 941870964 /nfs/dbraw/zinc/87/09/64/941870964.db2.gz FQLLPFRKJZCYGN-UHFFFAOYSA-N 0 0 361.467 3.686 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](c2ccccc2)[C@H]2CCCO2)c1 ZINC000549295638 941873283 /nfs/dbraw/zinc/87/32/83/941873283.db2.gz XCGGSQAHVUYYSB-MOPGFXCFSA-N 0 0 370.405 3.644 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N(C)[C@@H](C)Cc2ccc(Cl)cc2)c1[N+](=O)[O-] ZINC000433770109 941876353 /nfs/dbraw/zinc/87/63/53/941876353.db2.gz BIPTVEWLNBGSTE-NSHDSACASA-N 0 0 364.833 3.798 20 5 FHBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[C@H](OC)C1 ZINC000472826048 941876829 /nfs/dbraw/zinc/87/68/29/941876829.db2.gz BBXAOWBQHUMZKS-OCCSQVGLSA-N 0 0 352.456 3.784 20 5 FHBDRN COC(=O)c1cc(NC(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)c(C)cc1C ZINC000472826079 941876936 /nfs/dbraw/zinc/87/69/36/941876936.db2.gz GDVVSKCWFLZYFO-LBPRGKRZSA-N 0 0 374.368 3.880 20 5 FHBDRN Cc1cn([C@@H](C)c2ccccc2)[nH]c1=NC(=O)c1ccc([N+](=O)[O-])cc1F ZINC000472828531 941887329 /nfs/dbraw/zinc/88/73/29/941887329.db2.gz UGWJXXFBPBCZRD-ZDUSSCGKSA-N 0 0 368.368 3.522 20 5 FHBDRN Cc1cn([C@@H](C)c2ccccc2)[nH]c1=NC(=O)c1cc(C)cc([N+](=O)[O-])c1 ZINC000472830325 941894221 /nfs/dbraw/zinc/89/42/21/941894221.db2.gz NCTORAYPCDCAOV-HNNXBMFYSA-N 0 0 364.405 3.692 20 5 FHBDRN Cc1ccc(-c2nnc(Cn3cc(-c4ccc([N+](=O)[O-])cc4)cn3)o2)cc1 ZINC000103463229 941898029 /nfs/dbraw/zinc/89/80/29/941898029.db2.gz GXCWYSJOOOSTQO-UHFFFAOYSA-N 0 0 361.361 3.865 20 5 FHBDRN Cc1nn(C(C)(C)C)cc1[C@H](C)NC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000274395909 941906387 /nfs/dbraw/zinc/90/63/87/941906387.db2.gz JGCVCVHQBXKDJU-NSHDSACASA-N 0 0 369.425 3.827 20 5 FHBDRN CCOC(=O)c1cc(NC2CC(C)(C)N(O)C(C)(C)C2)ccc1[N+](=O)[O-] ZINC001167720912 941908150 /nfs/dbraw/zinc/90/81/50/941908150.db2.gz DMBLVCNEYAZGDI-UHFFFAOYSA-N 0 0 365.430 3.594 20 5 FHBDRN Cc1ccc(F)c2c1N(C(=O)CCOc1ccccc1[N+](=O)[O-])CCC2 ZINC000517511774 941914870 /nfs/dbraw/zinc/91/48/70/941914870.db2.gz QWODXDGZOORIBF-UHFFFAOYSA-N 0 0 358.369 3.791 20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])N1CCc2cc(Cl)ccc2C1 ZINC000480802644 941919350 /nfs/dbraw/zinc/91/93/50/941919350.db2.gz YUZVUEHGGOUCMI-UHFFFAOYSA-N 0 0 359.813 3.635 20 5 FHBDRN O=C([C@@H]1C[C@@]1(F)c1ccccc1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000412212837 941920976 /nfs/dbraw/zinc/92/09/76/941920976.db2.gz SZRABDZVVCDZPT-AZUAARDMSA-N 0 0 354.381 3.971 20 5 FHBDRN O=C(N[C@@H]1CCO[C@H]1c1ccc(Cl)cc1)c1ccc([N+](=O)[O-])cc1F ZINC000182456393 941926519 /nfs/dbraw/zinc/92/65/19/941926519.db2.gz XSBFTIQPACWEMN-CVEARBPZSA-N 0 0 364.760 3.647 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)c1noc2c1C[C@@H](C)CC2 ZINC000433830791 941926922 /nfs/dbraw/zinc/92/69/22/941926922.db2.gz YZWAHQAPQNXPQJ-ZDUSSCGKSA-N 0 0 357.410 3.758 20 5 FHBDRN CC(=O)Nc1cccc([C@H](C)NCc2nc3cc([N+](=O)[O-])ccc3o2)c1 ZINC000182537275 941931316 /nfs/dbraw/zinc/93/13/16/941931316.db2.gz FHOFRCBAWBGMKU-NSHDSACASA-N 0 0 354.366 3.545 20 5 FHBDRN Cc1sc(C(=O)N[C@@H]2CCO[C@@H]2c2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000182486382 941934137 /nfs/dbraw/zinc/93/41/37/941934137.db2.gz ISZBSJPDMRXQRS-IUODEOHRSA-N 0 0 366.826 3.878 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1OC(F)F)N1CCC[C@@H]2CCCC[C@@H]21 ZINC000182491610 941934304 /nfs/dbraw/zinc/93/43/04/941934304.db2.gz HNLPTRLVUXZPSM-FZMZJTMJSA-N 0 0 354.353 3.991 20 5 FHBDRN O=C(NC[C@H]1[C@@H]2c3ccccc3C[C@H]12)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000182489830 941934321 /nfs/dbraw/zinc/93/43/21/941934321.db2.gz HFLNBRNRFRSUCL-FRFSOERESA-N 0 0 374.343 3.512 20 5 FHBDRN Cc1cc(C)c(NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)c(C)n1 ZINC000182509366 941936748 /nfs/dbraw/zinc/93/67/48/941936748.db2.gz HDAVVTJBMHMOSF-UHFFFAOYSA-N 0 0 351.309 3.769 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N2CCc3ccccc3C2(C)C)c1F ZINC000412227366 941938044 /nfs/dbraw/zinc/93/80/44/941938044.db2.gz DKRQQZPWNPNNIG-UHFFFAOYSA-N 0 0 372.396 3.605 20 5 FHBDRN CCCCCn1cc(CNC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)c(C)n1 ZINC000412222238 941938958 /nfs/dbraw/zinc/93/89/58/941938958.db2.gz GANIAFZIGCCMDP-RBUKOAKNSA-N 0 0 370.453 3.710 20 5 FHBDRN Cc1nn(-c2ccccc2)cc1NC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000182625883 941940163 /nfs/dbraw/zinc/94/01/63/941940163.db2.gz ZGCZMSCRROEQDO-UHFFFAOYSA-N 0 0 361.361 3.823 20 5 FHBDRN COc1ccc([C@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2)C(F)(F)F)cc1 ZINC000182632856 941940807 /nfs/dbraw/zinc/94/08/07/941940807.db2.gz JUZPFHPAWUGFCP-INIZCTEOSA-N 0 0 368.311 3.566 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)NCCc2cccc(Cl)c2Cl)c1[N+](=O)[O-] ZINC000433851753 941940897 /nfs/dbraw/zinc/94/08/97/941940897.db2.gz JQHRHLNXWFLIFZ-UHFFFAOYSA-N 0 0 371.224 3.721 20 5 FHBDRN CC(C)(NC(=O)COc1cccc2cccnc21)c1ccc([N+](=O)[O-])cc1 ZINC000182572094 941944410 /nfs/dbraw/zinc/94/44/10/941944410.db2.gz VUAVVKVUWUXBJM-UHFFFAOYSA-N 0 0 365.389 3.573 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)NCCSc2ccc(Cl)cc2)c1[N+](=O)[O-] ZINC000433863130 941950901 /nfs/dbraw/zinc/95/09/01/941950901.db2.gz DIGADDUFCGSAEX-UHFFFAOYSA-N 0 0 368.846 3.617 20 5 FHBDRN O=C(N[C@H]1CCCOc2c(F)cccc21)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412258709 941988317 /nfs/dbraw/zinc/98/83/17/941988317.db2.gz SZXIQSXWXFETHZ-JZXOWHBKSA-N 0 0 370.380 3.868 20 5 FHBDRN CSc1cccc(C(=O)NCCC2C[C@@H](C)O[C@H](C)C2)c1[N+](=O)[O-] ZINC000549334979 941995291 /nfs/dbraw/zinc/99/52/91/941995291.db2.gz KOWJOIUJXZUULL-VXGBXAGGSA-N 0 0 352.456 3.640 20 5 FHBDRN CC(C)COC[C@@H](NC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc21)c1ccco1 ZINC000101671267 941999467 /nfs/dbraw/zinc/99/94/67/941999467.db2.gz ZNTQILCNARLRID-QGZVFWFLSA-N 0 0 371.393 3.813 20 5 FHBDRN CN(C(=O)Nc1cccc([N+](=O)[O-])c1Cl)[C@H]1CCCc2c1cnn2C ZINC000377827412 942018194 /nfs/dbraw/zinc/01/81/94/942018194.db2.gz WIELQHOYJMXTHX-LBPRGKRZSA-N 0 0 363.805 3.523 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])c[nH]1)N(Cc1ccccc1C(F)(F)F)CC1CC1 ZINC000513583979 942024565 /nfs/dbraw/zinc/02/45/65/942024565.db2.gz NZTHHZFYGJCVGK-UHFFFAOYSA-N 0 0 367.327 3.994 20 5 FHBDRN CC(=O)c1ccc(C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)cc1 ZINC000110216459 942024711 /nfs/dbraw/zinc/02/47/11/942024711.db2.gz JRBDYWBWGQAHQY-UHFFFAOYSA-N 0 0 350.277 3.651 20 5 FHBDRN O=C(NC[C@@H]1CCCN(c2ccccc2)C1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000434005198 942029466 /nfs/dbraw/zinc/02/94/66/942029466.db2.gz FWEBQPVDKOOHTL-AWEZNQCLSA-N 0 0 373.840 3.895 20 5 FHBDRN COc1cc(C)c(NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)cc1OC 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20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])N1CCC(F)(c2ccccc2)CC1 ZINC000434032450 942046959 /nfs/dbraw/zinc/04/69/59/942046959.db2.gz QYHSTNPWARFDNA-UHFFFAOYSA-N 0 0 371.412 3.884 20 5 FHBDRN CCc1ccc(C(C)(C)CNC(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])cc1 ZINC000434025660 942052945 /nfs/dbraw/zinc/05/29/45/942052945.db2.gz AGTJDMFAVTXJHP-UHFFFAOYSA-N 0 0 358.442 3.711 20 5 FHBDRN COc1ccc(CSCC(=O)Nc2sc(C)nc2C)cc1[N+](=O)[O-] ZINC000434053411 942056386 /nfs/dbraw/zinc/05/63/86/942056386.db2.gz OKXFNVMWCCWYLO-UHFFFAOYSA-N 0 0 367.452 3.549 20 5 FHBDRN Cc1cccc(CCN[C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000513655073 942057952 /nfs/dbraw/zinc/05/79/52/942057952.db2.gz KVCSALYZQQXOGA-LJQANCHMSA-N 0 0 350.422 3.558 20 5 FHBDRN O=C(NCc1cccc(OCC(F)F)c1)Nc1ccc([N+](=O)[O-])cc1 ZINC000102436597 942059654 /nfs/dbraw/zinc/05/96/54/942059654.db2.gz KZDMOGIXNOFXEL-UHFFFAOYSA-N 0 0 351.309 3.560 20 5 FHBDRN Cc1c(CNC(=O)[C@@H]2CC(C)(C)Oc3ccccc32)cccc1[N+](=O)[O-] ZINC000412284220 942063339 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O=C(NCc1ccc2ccccc2n1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513681059 942073514 /nfs/dbraw/zinc/07/35/14/942073514.db2.gz XECAKDVNBUWJEC-UHFFFAOYSA-N 0 0 373.315 3.674 20 5 FHBDRN C[C@H](C(=O)N1CCC[C@H]1[C@@H]1CCCCC1=O)c1ccc([N+](=O)[O-])cc1F ZINC000183074460 942084117 /nfs/dbraw/zinc/08/41/17/942084117.db2.gz BJXGRXJHKJWOTN-NUTKFTJISA-N 0 0 362.401 3.588 20 5 FHBDRN COCCCCc1noc(-c2ccnc(-c3ccccc3)c2[N+](=O)[O-])n1 ZINC000420504198 942087054 /nfs/dbraw/zinc/08/70/54/942087054.db2.gz NJQFZHDJEZTPRF-UHFFFAOYSA-N 0 0 354.366 3.676 20 5 FHBDRN O=C(Nc1cc([C@@H]2CCCOC2)[nH]n1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000280031058 942090798 /nfs/dbraw/zinc/09/07/98/942090798.db2.gz LADIVCYLAZIAFD-SECBINFHSA-N 0 0 365.777 3.509 20 5 FHBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)[N-]c1cc(F)ccc1Cl ZINC000102748619 942096784 /nfs/dbraw/zinc/09/67/84/942096784.db2.gz URSGNRYFKVZPJJ-UHFFFAOYSA-N 0 0 365.169 3.842 20 5 FHBDRN Cc1ccc(CN(C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)s1 ZINC000102774588 942097963 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FHBDRN CO[C@@](C)([C@@H](C)NC(=O)c1c([N+](=O)[O-])cccc1C(F)(F)F)C1CC1 ZINC000415914546 942139289 /nfs/dbraw/zinc/13/92/89/942139289.db2.gz AXXQLCGQDNXJSK-PSLIRLAXSA-N 0 0 360.332 3.547 20 5 FHBDRN CO[C@](C)([C@@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F)C1CC1 ZINC000415916342 942139712 /nfs/dbraw/zinc/13/97/12/942139712.db2.gz HCIBTNGJROCPOA-RFAUZJTJSA-N 0 0 360.332 3.547 20 5 FHBDRN CCc1cc(N2CCC[C@@H](CCO)CC2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000420648360 942141807 /nfs/dbraw/zinc/14/18/07/942141807.db2.gz YSDUJQIHMJJNKD-OAHLLOKOSA-N 0 0 370.453 3.603 20 5 FHBDRN CCOc1cccc(CNC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)c1 ZINC000513690415 942142311 /nfs/dbraw/zinc/14/23/11/942142311.db2.gz YAEVAJWTMMQKQI-UHFFFAOYSA-N 0 0 366.320 3.525 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)N1CC=C(c2c(F)cccc2F)CC1 ZINC000472928897 942147752 /nfs/dbraw/zinc/14/77/52/942147752.db2.gz NWJGASCBKFOMGJ-UHFFFAOYSA-N 0 0 373.359 3.872 20 5 FHBDRN CC(C)CC[C@@H](C)Nc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCCC1 ZINC000513690734 942152034 /nfs/dbraw/zinc/15/20/34/942152034.db2.gz LNGJADMVWBIAAS-CQSZACIVSA-N 0 0 369.487 3.616 20 5 FHBDRN C[C@@H](Nc1ccc([N+](=O)[O-])cc1Br)[C@@H](O)Cc1ccccc1 ZINC000501982435 942152128 /nfs/dbraw/zinc/15/21/28/942152128.db2.gz KOORHONBRBJSRH-BZNIZROVSA-N 0 0 365.227 3.761 20 5 FHBDRN Cc1c(NCc2nc(C3CC3)no2)cc(Br)cc1[N+](=O)[O-] ZINC000280298708 942155070 /nfs/dbraw/zinc/15/50/70/942155070.db2.gz BAAYMVDBTWJNDQ-UHFFFAOYSA-N 0 0 353.176 3.538 20 5 FHBDRN O=C(NCCCc1c[nH]c2ccc(F)cc12)c1ccc([N+](=O)[O-])cc1F ZINC000501973957 942155485 /nfs/dbraw/zinc/15/54/85/942155485.db2.gz HMIBSZIPSPNBTP-UHFFFAOYSA-N 0 0 359.332 3.717 20 5 FHBDRN Cc1nc2ccccc2n1C1CCN(c2nc(C)ccc2[N+](=O)[O-])CC1 ZINC000280278642 942156478 /nfs/dbraw/zinc/15/64/78/942156478.db2.gz POCOPDFUCMMCJE-UHFFFAOYSA-N 0 0 351.410 3.798 20 5 FHBDRN O=C(Cc1cccc([N+](=O)[O-])c1)NCCCc1c[nH]c2ccc(F)cc12 ZINC000501997723 942160650 /nfs/dbraw/zinc/16/06/50/942160650.db2.gz CERSSJQOUAPFGN-UHFFFAOYSA-N 0 0 355.369 3.507 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)NCC2(c3ccncc3)CCCC2)c1 ZINC000502009554 942166990 /nfs/dbraw/zinc/16/69/90/942166990.db2.gz XAVDGQGTOAQUMM-UHFFFAOYSA-N 0 0 371.462 3.954 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N[C@H](CC(F)F)c1ccccc1 ZINC000420731758 942168299 /nfs/dbraw/zinc/16/82/99/942168299.db2.gz FWUKFZORIOMYTK-CQSZACIVSA-N 0 0 370.377 3.578 20 5 FHBDRN CC(=O)c1ccc(N[C@H]2c3sccc3OC(C)(C)[C@@H]2O)c([N+](=O)[O-])c1 ZINC000413424738 942169206 /nfs/dbraw/zinc/16/92/06/942169206.db2.gz XRIUSKGPDKMZDN-GOEBONIOSA-N 0 0 362.407 3.544 20 5 FHBDRN O=C(NC[C@@H]1CCC(F)(F)C1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000280426902 942176510 /nfs/dbraw/zinc/17/65/10/942176510.db2.gz AWUAUGRBDIJLAA-CYBMUJFWSA-N 0 0 353.369 3.704 20 5 FHBDRN Cc1cc(S(=O)(=O)N[C@@H](CC(F)F)c2ccccc2)ccc1[N+](=O)[O-] ZINC000420741227 942180102 /nfs/dbraw/zinc/18/01/02/942180102.db2.gz SQJYPJQJLSXADV-AWEZNQCLSA-N 0 0 370.377 3.578 20 5 FHBDRN O=C(NC1CC1)c1ccc(N2Cc3ccc(Cl)cc3C2)c([N+](=O)[O-])c1 ZINC000413440341 942181403 /nfs/dbraw/zinc/18/14/03/942181403.db2.gz BZYHWRHGVCQLRA-UHFFFAOYSA-N 0 0 357.797 3.661 20 5 FHBDRN O=C(Nc1ccnn1-c1cccc(Cl)c1)c1ccc([N+](=O)[O-])cc1F ZINC000103034058 942186997 /nfs/dbraw/zinc/18/69/97/942186997.db2.gz UQFXKZUJVUHEPR-UHFFFAOYSA-N 0 0 360.732 3.825 20 5 FHBDRN COc1cc(C(=O)NCc2ccccc2N2CCCCC2)ccc1[N+](=O)[O-] ZINC000183156928 942192224 /nfs/dbraw/zinc/19/22/24/942192224.db2.gz UBNASQJMLXSDIO-UHFFFAOYSA-N 0 0 369.421 3.524 20 5 FHBDRN Cn1ccc([C@@H](NCc2cccc([N+](=O)[O-])c2)c2ccc(Cl)cc2)n1 ZINC000366678258 942195348 /nfs/dbraw/zinc/19/53/48/942195348.db2.gz LXJVVQJNUYRDJV-SFHVURJKSA-N 0 0 356.813 3.861 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N(C)[C@@H](c2ccccc2)C(F)(F)F)c1 ZINC000103049074 942197624 /nfs/dbraw/zinc/19/76/24/942197624.db2.gz LBXKCVOSLUBKOS-HNNXBMFYSA-N 0 0 368.311 3.979 20 5 FHBDRN CCOc1ccc2c(c1)CCN(C(=O)c1ccc(SC)c([N+](=O)[O-])c1)C2 ZINC000434098619 942203182 /nfs/dbraw/zinc/20/31/82/942203182.db2.gz SCEGHQZFGULRAI-UHFFFAOYSA-N 0 0 372.446 3.914 20 5 FHBDRN O=C(NC1CCC2(CCOCC2)CC1)c1ccc([N+](=O)[O-])cc1Cl ZINC000378042765 942206076 /nfs/dbraw/zinc/20/60/76/942206076.db2.gz WPGALTFBBFVZEN-UHFFFAOYSA-N 0 0 352.818 3.717 20 5 FHBDRN C[C@H](CNC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000513698436 942207494 /nfs/dbraw/zinc/20/74/94/942207494.db2.gz APUHORQQPOKFMM-SNVBAGLBSA-N 0 0 368.311 3.869 20 5 FHBDRN O=[N+]([O-])c1ccc(CN2CCOCC2)cc1NC1CCC(C(F)F)CC1 ZINC000413454279 942207547 /nfs/dbraw/zinc/20/75/47/942207547.db2.gz VQUCJBSNSQGCPC-UHFFFAOYSA-N 0 0 369.412 3.663 20 5 FHBDRN COc1cc(C(=O)NC(C)(C)c2nc(C)c(C)s2)cc([N+](=O)[O-])c1C ZINC000187830222 942225156 /nfs/dbraw/zinc/22/51/56/942225156.db2.gz MXARQBCVDWVRTQ-UHFFFAOYSA-N 0 0 363.439 3.650 20 5 FHBDRN COc1ccc(CN[C@@H](C(=O)OC(C)(C)C)c2ccccc2)cc1[N+](=O)[O-] ZINC000159040530 942226381 /nfs/dbraw/zinc/22/63/81/942226381.db2.gz JAMFNNXEYHJBIY-GOSISDBHSA-N 0 0 372.421 3.776 20 5 FHBDRN COc1cc(C(=O)N2CC[C@@H](c3ccccc3F)C2)cc([N+](=O)[O-])c1C ZINC000502105081 942227938 /nfs/dbraw/zinc/22/79/38/942227938.db2.gz MIDWVUXPLZWQJY-CYBMUJFWSA-N 0 0 358.369 3.681 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCO[C@@H](C3CCC3)C2)nc1OCc1ccccc1 ZINC000413472508 942231298 /nfs/dbraw/zinc/23/12/98/942231298.db2.gz HFWDRPHDSCJLFM-GOSISDBHSA-N 0 0 369.421 3.574 20 5 FHBDRN O=C(c1cccc(C[NH+]2CCCCC2)c1)N1CCc2c1cccc2[N+](=O)[O-] ZINC000413486708 942239105 /nfs/dbraw/zinc/23/91/05/942239105.db2.gz YOFAMKUABBYWGW-UHFFFAOYSA-N 0 0 365.433 3.784 20 5 FHBDRN CC[C@](C)(NC(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1)c1nccs1 ZINC000413488796 942240477 /nfs/dbraw/zinc/24/04/77/942240477.db2.gz QJEQASNDGRNJFI-KRWDZBQOSA-N 0 0 363.439 3.894 20 5 FHBDRN O=C(NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N[C@@H]1C[C@H]1c1ccco1 ZINC000413491683 942242374 /nfs/dbraw/zinc/24/23/74/942242374.db2.gz BIRWCTBGZTWRCR-CHWSQXEVSA-N 0 0 369.299 3.562 20 5 FHBDRN O=C(NC[C@H]1CCC(F)(F)C1)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000280750739 942244655 /nfs/dbraw/zinc/24/46/55/942244655.db2.gz PUUPWRORVWIWLU-QMMMGPOBSA-N 0 0 352.259 3.779 20 5 FHBDRN COc1cc(CCC(=O)N2c3ccc([N+](=O)[O-])cc3C[C@@H]2C)cc(OC)c1 ZINC000103376812 942247803 /nfs/dbraw/zinc/24/78/03/942247803.db2.gz UTXOGQYPXDDWSN-ZDUSSCGKSA-N 0 0 370.405 3.522 20 5 FHBDRN CCN(C(=O)COC(=O)c1cc(SC)ccc1[N+](=O)[O-])c1ccccc1 ZINC000016196099 942247829 /nfs/dbraw/zinc/24/78/29/942247829.db2.gz UKBSCHOIXFCUNH-UHFFFAOYSA-N 0 0 374.418 3.527 20 5 FHBDRN C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1ccc(C(F)(F)F)nc1 ZINC000103377623 942248165 /nfs/dbraw/zinc/24/81/65/942248165.db2.gz JFVQFHWMOXQAKV-SECBINFHSA-N 0 0 351.284 3.600 20 5 FHBDRN Cc1oc(-c2ccco2)nc1CC(=O)N1c2ccc([N+](=O)[O-])cc2C[C@H]1C ZINC000103375317 942248456 /nfs/dbraw/zinc/24/84/56/942248456.db2.gz YMPRDXFIMKQZPB-LLVKDONJSA-N 0 0 367.361 3.672 20 5 FHBDRN C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1cc2c(c(Cl)c1)OCO2 ZINC000103377143 942248699 /nfs/dbraw/zinc/24/86/99/942248699.db2.gz VCWVWTCGRIVZAU-VIFPVBQESA-N 0 0 360.753 3.568 20 5 FHBDRN CC(C)[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F)C(F)(F)F ZINC000416011867 942252801 /nfs/dbraw/zinc/25/28/01/942252801.db2.gz KEFHGQODWXSVOF-JTQLQIEISA-N 0 0 356.247 3.513 20 5 FHBDRN Cc1cc(C(=O)N2CCO[C@H](c3ccccc3Cl)C2)cc([N+](=O)[O-])c1 ZINC000103444937 942260054 /nfs/dbraw/zinc/26/00/54/942260054.db2.gz JEGYTOOKKPWJAI-KRWDZBQOSA-N 0 0 360.797 3.770 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N(CC)C2CC(C)(C)C2)cc1OC ZINC000416016549 942265467 /nfs/dbraw/zinc/26/54/67/942265467.db2.gz RULDXVHPQBDQRL-UHFFFAOYSA-N 0 0 350.415 3.653 20 5 FHBDRN C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCC[C@@H](CC(F)(F)F)C1 ZINC000420949642 942271473 /nfs/dbraw/zinc/27/14/73/942271473.db2.gz OWZPVLOTZLHUJE-RYUDHWBXSA-N 0 0 359.348 3.586 20 5 FHBDRN CCOC(=O)c1csc(CSCc2ccc(OC)c([N+](=O)[O-])c2)n1 ZINC000419472179 942271610 /nfs/dbraw/zinc/27/16/10/942271610.db2.gz ABVSELKXDZYBHK-UHFFFAOYSA-N 0 0 368.436 3.670 20 5 FHBDRN Cc1ccc(NC(=O)[C@H](c2ccccc2)N2CCSCC2)c([N+](=O)[O-])c1 ZINC000103468535 942273440 /nfs/dbraw/zinc/27/34/40/942273440.db2.gz KDMGYPPKOMYPJI-SFHVURJKSA-N 0 0 371.462 3.632 20 5 FHBDRN C[C@@H]1CC[C@H](C)N(C(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])C1 ZINC000072545992 942278638 /nfs/dbraw/zinc/27/86/38/942278638.db2.gz BWQRMNMANPQCMN-MNOVXSKESA-N 0 0 360.332 3.797 20 5 FHBDRN CCC[C@@H](C)NC(=O)[C@@H]1CCCN(c2ccc([N+](=O)[O-])c3ncccc23)C1 ZINC000413096383 942285176 /nfs/dbraw/zinc/28/51/76/942285176.db2.gz BCJIZKVBTONSQC-HUUCEWRRSA-N 0 0 370.453 3.664 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N(Cc2ccccc2)C(C)C)c1F ZINC000413097820 942285669 /nfs/dbraw/zinc/28/56/69/942285669.db2.gz BXNNMPZGQHWBLZ-UHFFFAOYSA-N 0 0 360.385 3.722 20 5 FHBDRN Cc1ccc(NC(=O)Cc2csc(-c3ccccn3)n2)cc1[N+](=O)[O-] ZINC000015629545 942290117 /nfs/dbraw/zinc/29/01/17/942290117.db2.gz LMATUEWVOUFRTE-UHFFFAOYSA-N 0 0 354.391 3.603 20 5 FHBDRN COc1ccc(CSCC(=O)N2CC[C@H](C)C[C@H](C)C2)cc1[N+](=O)[O-] ZINC000502217564 942295725 /nfs/dbraw/zinc/29/57/25/942295725.db2.gz DEVKFNZUNKTTPN-KBPBESRZSA-N 0 0 366.483 3.731 20 5 FHBDRN COCc1cccc(CNC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1 ZINC000103603023 942297331 /nfs/dbraw/zinc/29/73/31/942297331.db2.gz XBRABGWDNJMLEO-UHFFFAOYSA-N 0 0 371.437 3.861 20 5 FHBDRN O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)N1CCCC[C@H]1C(F)F ZINC000502220237 942297729 /nfs/dbraw/zinc/29/77/29/942297729.db2.gz OZLPUKGQHHWMEU-JTQLQIEISA-N 0 0 365.283 3.848 20 5 FHBDRN C[C@@H](SCc1cccc(S(C)(=O)=O)c1)c1cccc([N+](=O)[O-])c1 ZINC000419518367 942298140 /nfs/dbraw/zinc/29/81/40/942298140.db2.gz NMHVPUGUAXVAIQ-GFCCVEGCSA-N 0 0 351.449 3.993 20 5 FHBDRN COc1cccc(N(CC(C)C)C[C@H](O)COc2ccccc2[N+](=O)[O-])c1 ZINC001167727855 942298310 /nfs/dbraw/zinc/29/83/10/942298310.db2.gz HCVVKRLVTHRSMW-KRWDZBQOSA-N 0 0 374.437 3.506 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])N1CCC[C@H]1Cc1cc(F)ccc1F ZINC000416054409 942298924 /nfs/dbraw/zinc/29/89/24/942298924.db2.gz WFGRIEXJCZGAIV-INIZCTEOSA-N 0 0 360.360 3.649 20 5 FHBDRN CC(C)OCCCCNC(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000501081094 942300614 /nfs/dbraw/zinc/30/06/14/942300614.db2.gz FTJQPYMHCOEAMC-UHFFFAOYSA-N 0 0 374.235 3.684 20 5 FHBDRN Cc1noc(C)c1NC(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000501097789 942305980 /nfs/dbraw/zinc/30/59/80/942305980.db2.gz BZTVACXXRAAZLR-UHFFFAOYSA-N 0 0 355.148 3.606 20 5 FHBDRN Cc1ccc(Cl)cc1NC(=O)[C@@H](C)OC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000015653023 942306671 /nfs/dbraw/zinc/30/66/71/942306671.db2.gz FRSMBBKUCLNNIZ-LLVKDONJSA-N 0 0 362.769 3.741 20 5 FHBDRN O=[N+]([O-])c1cnc(NCc2cc(F)cc3c2OCOC3)c(C(F)(F)F)c1 ZINC000413116634 942311636 /nfs/dbraw/zinc/31/16/36/942311636.db2.gz PWQVFYXMDHNIMQ-UHFFFAOYSA-N 0 0 373.262 3.626 20 5 FHBDRN CSc1cccc(C(=O)NCCCc2nc3ccccc3[nH]2)c1[N+](=O)[O-] ZINC000188029475 942314129 /nfs/dbraw/zinc/31/41/29/942314129.db2.gz JSXXSBCCWVKVBK-UHFFFAOYSA-N 0 0 370.434 3.556 20 5 FHBDRN CCOc1ccc(NC(=O)c2cc(SC)ccc2[N+](=O)[O-])cc1OC ZINC000016233316 942314587 /nfs/dbraw/zinc/31/45/87/942314587.db2.gz UNYRBPXTSUTDRA-UHFFFAOYSA-N 0 0 362.407 3.976 20 5 FHBDRN C[C@@H]1[C@@H](C)[C@H](C)CN1C(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000416070318 942316423 /nfs/dbraw/zinc/31/64/23/942316423.db2.gz KVHDDVZIUFJCIE-OUAUKWLOSA-N 0 0 360.332 3.652 20 5 FHBDRN CSc1cccc(C(=O)NCCO[C@H]2CCCC[C@@H]2C)c1[N+](=O)[O-] ZINC000188060306 942317978 /nfs/dbraw/zinc/31/79/78/942317978.db2.gz JFAIREACWBQTAU-JSGCOSHPSA-N 0 0 352.456 3.642 20 5 FHBDRN COc1cccc(N2CC[C@@H](Nc3nccc4ccc([N+](=O)[O-])cc43)C2)c1 ZINC000413121816 942317899 /nfs/dbraw/zinc/31/78/99/942317899.db2.gz XCOQICYMJLKKES-OAHLLOKOSA-N 0 0 364.405 3.842 20 5 FHBDRN Cc1cc(N2CC[C@@]3(C2)CC(=O)c2ccccc2O3)c(F)cc1[N+](=O)[O-] ZINC000413531255 942319789 /nfs/dbraw/zinc/31/97/89/942319789.db2.gz LZJPXMYGHKVUSD-IBGZPJMESA-N 0 0 356.353 3.657 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(N2CC3(CCOCC3)[C@H]2c2ccccc2)n1 ZINC000413535548 942325466 /nfs/dbraw/zinc/32/54/66/942325466.db2.gz DSPCXJDKHJQVEG-GOSISDBHSA-N 0 0 353.422 3.965 20 5 FHBDRN CCOc1cc(Cl)ccc1CNC(=O)c1cc([N+](=O)[O-])c(C)s1 ZINC000501139212 942326104 /nfs/dbraw/zinc/32/61/04/942326104.db2.gz AFGYZPKYUUZDAS-UHFFFAOYSA-N 0 0 354.815 3.947 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)NCCc1cc(Cl)cc(Cl)c1 ZINC000502281205 942330249 /nfs/dbraw/zinc/33/02/49/942330249.db2.gz OQDMNRWMLBWALL-UHFFFAOYSA-N 0 0 369.204 3.883 20 5 FHBDRN Cc1cc(F)cc2c1CN(C(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F)CC2 ZINC000501163308 942332756 /nfs/dbraw/zinc/33/27/56/942332756.db2.gz JLQLSAFKUSTQOF-LBPRGKRZSA-N 0 0 360.360 3.870 20 5 FHBDRN CC[C@@H](NC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)[C@H]1CC1(C)C ZINC000416085725 942333002 /nfs/dbraw/zinc/33/30/02/942333002.db2.gz SBDLXACYSNBKBD-HZPDHXFCSA-N 0 0 356.426 3.550 20 5 FHBDRN Cc1cccc(S(=O)(=O)CCCSc2ccc([N+](=O)[O-])cc2)c1 ZINC000419615102 942336016 /nfs/dbraw/zinc/33/60/16/942336016.db2.gz OYGFHVBRZKPRBO-UHFFFAOYSA-N 0 0 351.449 3.859 20 5 FHBDRN COc1cc(C(=O)N[C@@H](c2nc(C)cs2)C2CC2)cc([N+](=O)[O-])c1C ZINC000188127915 942336501 /nfs/dbraw/zinc/33/65/01/942336501.db2.gz ZQIQBWFWEGRONR-OAHLLOKOSA-N 0 0 361.423 3.558 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc3c(c2)CCC3)cc1OC ZINC000015720844 942336821 /nfs/dbraw/zinc/33/68/21/942336821.db2.gz CQOHQWLHHFLWCQ-UHFFFAOYSA-N 0 0 356.378 3.743 20 5 FHBDRN O=[N+]([O-])c1cnc(Nc2cnn(CC(F)(F)F)c2)c(C(F)(F)F)c1 ZINC000413137584 942337299 /nfs/dbraw/zinc/33/72/99/942337299.db2.gz AXZBIUVGTPGJOZ-UHFFFAOYSA-N 0 0 355.198 3.511 20 5 FHBDRN CC(=O)c1ccc2c(c1)CN(C(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1)C2 ZINC000413138896 942337888 /nfs/dbraw/zinc/33/78/88/942337888.db2.gz NBIVRUAVHFZXQS-LBPRGKRZSA-N 0 0 353.378 3.584 20 5 FHBDRN CC[C@H](Oc1ccccc1C)c1nc(Cc2ccc([N+](=O)[O-])cn2)no1 ZINC000274074990 942338375 /nfs/dbraw/zinc/33/83/75/942338375.db2.gz WUTOFYQBLFVWPT-HNNXBMFYSA-N 0 0 354.366 3.802 20 5 FHBDRN CC(=O)c1cc(C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)cs1 ZINC000513741023 942341019 /nfs/dbraw/zinc/34/10/19/942341019.db2.gz CZMBKFZBBFADEI-UHFFFAOYSA-N 0 0 369.196 3.874 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)cc(Cl)c1N1CC(CO)(c2ccccc2)C1 ZINC000413548564 942344253 /nfs/dbraw/zinc/34/42/53/942344253.db2.gz HYNDLIXRWDSMRF-UHFFFAOYSA-N 0 0 353.205 3.652 20 5 FHBDRN Cc1ccccc1[C@]1(F)CCN(C(=O)CCNc2ccccc2[N+](=O)[O-])C1 ZINC000501189782 942344315 /nfs/dbraw/zinc/34/43/15/942344315.db2.gz VXLMYFAACPRXSN-FQEVSTJZSA-N 0 0 371.412 3.803 20 5 FHBDRN CSc1cccc(C(=O)NCCCOc2ccccc2C)c1[N+](=O)[O-] ZINC000188138565 942345297 /nfs/dbraw/zinc/34/52/97/942345297.db2.gz BEENNECUOKMWJE-UHFFFAOYSA-N 0 0 360.435 3.824 20 5 FHBDRN COc1ccc(CCCNC(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)cc1 ZINC000085638338 942347421 /nfs/dbraw/zinc/34/74/21/942347421.db2.gz JWRSGPBKBKMGLW-UHFFFAOYSA-N 0 0 357.410 3.975 20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])N1CCC[C@@H]1Cc1cccc(F)c1 ZINC000502317145 942349008 /nfs/dbraw/zinc/34/90/08/942349008.db2.gz FIPDEEJKVBLZNW-QGZVFWFLSA-N 0 0 371.412 3.770 20 5 FHBDRN O=[N+]([O-])c1cnc(Nc2ccc(O[C@H]3CCOC3)cc2)c(C(F)(F)F)c1 ZINC000413155059 942352177 /nfs/dbraw/zinc/35/21/77/942352177.db2.gz PBTBGGSCLVBTBX-ZDUSSCGKSA-N 0 0 369.299 3.920 20 5 FHBDRN CC(C)(C(=O)NCC1CCC(F)(F)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000501238414 942356560 /nfs/dbraw/zinc/35/65/60/942356560.db2.gz ZGQWIAZWJIIJPW-UHFFFAOYSA-N 0 0 358.360 3.953 20 5 FHBDRN Cc1cccc(C(=O)NCCCOc2cccc3cccnc32)c1[N+](=O)[O-] ZINC000103978878 942358050 /nfs/dbraw/zinc/35/80/50/942358050.db2.gz ITJALULPTWZQRN-UHFFFAOYSA-N 0 0 365.389 3.650 20 5 FHBDRN Cc1cccc(C(=O)N2CCN([C@@H](C)c3cccc(F)c3)CC2)c1[N+](=O)[O-] ZINC000103974679 942358145 /nfs/dbraw/zinc/35/81/45/942358145.db2.gz BBGNSLOYVVUXDX-HNNXBMFYSA-N 0 0 371.412 3.561 20 5 FHBDRN O=C(Nc1cc(F)ccc1OC[C@@H]1CCCO1)c1cccc([N+](=O)[O-])c1 ZINC000502315148 942362212 /nfs/dbraw/zinc/36/22/12/942362212.db2.gz WXEOLZNTOPLAAZ-HNNXBMFYSA-N 0 0 360.341 3.544 20 5 FHBDRN O=C(c1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCSC[C@H]1C1CCC1 ZINC000416119711 942365288 /nfs/dbraw/zinc/36/52/88/942365288.db2.gz YXPTXCZVIGPJQI-AWEZNQCLSA-N 0 0 374.384 3.971 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1Oc1ccc(C(F)(F)F)nn1 ZINC000502342315 942370350 /nfs/dbraw/zinc/37/03/50/942370350.db2.gz TYQLQAYIQADIOV-UHFFFAOYSA-N 0 0 364.077 3.958 20 5 FHBDRN CCOc1ccccc1[C@@H](CC(C)C)Nc1ccc2ncc([N+](=O)[O-])n2n1 ZINC000502341690 942370615 /nfs/dbraw/zinc/37/06/15/942370615.db2.gz PNPFVMDKXXZLJO-OAHLLOKOSA-N 0 0 369.425 3.657 20 5 FHBDRN COc1cc(N[C@H](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2)c(C)c(OC)c1 ZINC000502342562 942371240 /nfs/dbraw/zinc/37/12/40/942371240.db2.gz BRINJPFSUNPJQQ-GFCCVEGCSA-N 0 0 373.409 3.750 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@H](C)c1ccc(C2CC2)cc1 ZINC000419797785 942383822 /nfs/dbraw/zinc/38/38/22/942383822.db2.gz SWDBCAKZXRZUTF-CYBMUJFWSA-N 0 0 367.405 3.597 20 5 FHBDRN CCC[C@@H]1C[C@H](C(=O)Nc2cc(-c3cccc([N+](=O)[O-])c3)[nH]n2)CCO1 ZINC000183527733 942383824 /nfs/dbraw/zinc/38/38/24/942383824.db2.gz UTNNKAJNNGOHIA-UKRRQHHQSA-N 0 0 358.398 3.519 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2C[C@@H](C)C[C@@H]2c2cccnc2)c1 ZINC000366812457 942400472 /nfs/dbraw/zinc/40/04/72/942400472.db2.gz XGSFUQASHFPZKW-MAUKXSAKSA-N 0 0 369.421 3.677 20 5 FHBDRN COc1ccc2c(c1)[C@H](OC(=O)[C@H]1C[C@H]1c1cccc([N+](=O)[O-])c1)CCO2 ZINC001268850274 942406033 /nfs/dbraw/zinc/40/60/33/942406033.db2.gz VPHWHNNXHVMKBN-TXPKVOOTSA-N 0 0 369.373 3.774 20 5 FHBDRN COc1ccccc1C1(C(=O)Nc2ccc([N+](=O)[O-])c3ncccc23)CC1 ZINC001268849478 942406139 /nfs/dbraw/zinc/40/61/39/942406139.db2.gz JLAILPYCCPPYRP-UHFFFAOYSA-N 0 0 363.373 3.822 20 5 FHBDRN CC(C)c1nc2n(n1)CCC[C@@H]2Nc1ccc([N+](=O)[O-])c2ncccc12 ZINC000413179980 942409592 /nfs/dbraw/zinc/40/95/92/942409592.db2.gz DCUUUJJUFUDUAB-AWEZNQCLSA-N 0 0 352.398 3.805 20 5 FHBDRN CC1CN(C(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)C1 ZINC000513712368 942412402 /nfs/dbraw/zinc/41/24/02/942412402.db2.gz XHKCEENXGGPNNP-UHFFFAOYSA-N 0 0 359.813 3.952 20 5 FHBDRN Cc1nn(C)c(Nc2ccc(Oc3ccc(CO)cc3)cc2)c1[N+](=O)[O-] ZINC000513744095 942413839 /nfs/dbraw/zinc/41/38/39/942413839.db2.gz GSAZCMFZDDFABD-UHFFFAOYSA-N 0 0 354.366 3.665 20 5 FHBDRN C[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2Br)C[C@@H](C)C1 ZINC000502395807 942420996 /nfs/dbraw/zinc/42/09/96/942420996.db2.gz YGPSFFDCLUDEFZ-QWRGUYRKSA-N 0 0 355.232 3.866 20 5 FHBDRN Cc1ccc(C(=O)N[C@H](C)c2ccc(-n3cccn3)c(F)c2)cc1[N+](=O)[O-] ZINC000505240383 942432444 /nfs/dbraw/zinc/43/24/44/942432444.db2.gz UNMIBEXKTNZARO-CYBMUJFWSA-N 0 0 368.368 3.719 20 5 FHBDRN O=C(NC[C@@H]1C[C@H]1C1CCC1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000424896876 942438115 /nfs/dbraw/zinc/43/81/15/942438115.db2.gz PGSVQKMUSRFQRJ-AAEUAGOBSA-N 0 0 372.343 3.702 20 5 FHBDRN O=C(NC[C@@H]1C[C@H]1C1CCC1)c1ccc([N+](=O)[O-])cc1Br ZINC000424910697 942441316 /nfs/dbraw/zinc/44/13/16/942441316.db2.gz UTBNXICYZIMVKG-GWCFXTLKSA-N 0 0 353.216 3.523 20 5 FHBDRN Cc1c(Cc2noc(C3(Oc4ccccc4)CC3)n2)cccc1[N+](=O)[O-] ZINC000421251230 942443613 /nfs/dbraw/zinc/44/36/13/942443613.db2.gz MGRVRRHDCYNMSD-UHFFFAOYSA-N 0 0 351.362 3.945 20 5 FHBDRN CCS[C@H]1CCCCN(C(=O)Nc2ccc([N+](=O)[O-])cc2OC)C1 ZINC000122902035 942455538 /nfs/dbraw/zinc/45/55/38/942455538.db2.gz KGRGLNSGZXJUCR-ZDUSSCGKSA-N 0 0 353.444 3.743 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1-c1nc(-c2ccc(N3CCCC3)nc2)no1 ZINC000421249119 942455779 /nfs/dbraw/zinc/45/57/79/942455779.db2.gz SZUNPHRIXUTHCS-UHFFFAOYSA-N 0 0 365.393 3.924 20 5 FHBDRN C[C@H](Nc1ncc([N+](=O)[O-])cc1C(F)(F)F)[C@H]1COc2ccccc21 ZINC000413199671 942459791 /nfs/dbraw/zinc/45/97/91/942459791.db2.gz ISTLQXLPYKUEGJ-JOYOIKCWSA-N 0 0 353.300 3.985 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CCC(CC(F)(F)F)CC2)c1 ZINC000501419542 942467563 /nfs/dbraw/zinc/46/75/63/942467563.db2.gz RGHIBMNTROWNIY-UHFFFAOYSA-N 0 0 360.332 3.798 20 5 FHBDRN CC(C)(C)OC(=O)C(C)(C)CCNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000424953512 942468048 /nfs/dbraw/zinc/46/80/48/942468048.db2.gz UHOBQRQHBXMNQH-UHFFFAOYSA-N 0 0 370.833 3.736 20 5 FHBDRN CC(C)n1cc2c(n1)C[C@H](Nc1ccc([N+](=O)[O-])c3ncccc13)CC2 ZINC000413213696 942487944 /nfs/dbraw/zinc/48/79/44/942487944.db2.gz YMQZDYJWIODOEB-CQSZACIVSA-N 0 0 351.410 3.890 20 5 FHBDRN Cc1nnc(Sc2ncc([N+](=O)[O-])cc2F)n1[C@@H]1CCC[C@H](C)C1 ZINC000413214793 942489214 /nfs/dbraw/zinc/48/92/14/942489214.db2.gz WQAHINATVBUSTG-GXSJLCMTSA-N 0 0 351.407 3.931 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CC[C@@](F)(c2ccccc2F)C1 ZINC000412331914 942493028 /nfs/dbraw/zinc/49/30/28/942493028.db2.gz OTLLSSWDSIKRCW-YRNRMSPPSA-N 0 0 372.371 3.935 20 5 FHBDRN Cc1nc([C@@H]2CCCCN2Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)no1 ZINC000366890107 942493993 /nfs/dbraw/zinc/49/39/93/942493993.db2.gz XIONJGCNVIWJNH-INIZCTEOSA-N 0 0 369.381 3.668 20 5 FHBDRN Cc1ccc(NCc2nnc3n2CCC[C@H]3C(F)(F)F)c([N+](=O)[O-])c1 ZINC000366894815 942494609 /nfs/dbraw/zinc/49/46/09/942494609.db2.gz HERLVVZVVILKEK-SNVBAGLBSA-N 0 0 355.320 3.547 20 5 FHBDRN COc1cc(C(=O)N2CCC[C@@H]2/C=C/c2ccccc2)ccc1[N+](=O)[O-] ZINC000505354090 942497136 /nfs/dbraw/zinc/49/71/36/942497136.db2.gz UIALUPRBIGCEQN-QXLXQBSBSA-N 0 0 352.390 3.921 20 5 FHBDRN CC(C)n1cnnc1C1CCN(c2ccc([N+](=O)[O-])c3ncccc23)CC1 ZINC000413224505 942502602 /nfs/dbraw/zinc/50/26/02/942502602.db2.gz YMDLCRYNWXKVTP-UHFFFAOYSA-N 0 0 366.425 3.699 20 5 FHBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N1CCCc2n[nH]cc21 ZINC000505362450 942503080 /nfs/dbraw/zinc/50/30/80/942503080.db2.gz PARDQYPHENETBJ-UHFFFAOYSA-N 0 0 360.439 3.659 20 5 FHBDRN CCc1cc(NCc2c(C)noc2C)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000063255286 942505065 /nfs/dbraw/zinc/50/50/65/942505065.db2.gz KYHOEEFWFRFQOU-UHFFFAOYSA-N 0 0 353.382 3.831 20 5 FHBDRN CCCS(=O)(=O)Nc1cccc(NCc2ccc([N+](=O)[O-])cc2C)c1 ZINC000421336709 942508480 /nfs/dbraw/zinc/50/84/80/942508480.db2.gz NGQSUBZSHODVOP-UHFFFAOYSA-N 0 0 363.439 3.667 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC[C@H]1c1nccs1 ZINC000366903048 942509798 /nfs/dbraw/zinc/50/97/98/942509798.db2.gz MXGCVJFEYKYRJH-ZDUSSCGKSA-N 0 0 362.411 3.819 20 5 FHBDRN C[C@H](CC(=O)c1ccc(F)cc1)NC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000501508847 942517620 /nfs/dbraw/zinc/51/76/20/942517620.db2.gz YHBONBQTAHQMOP-LLVKDONJSA-N 0 0 369.352 3.607 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CCCCC[C@@H]2c2ncon2)ccc1[N+](=O)[O-] ZINC000413723662 942535396 /nfs/dbraw/zinc/53/53/96/942535396.db2.gz UNYTUDCUIQSFAS-OAHLLOKOSA-N 0 0 374.397 3.523 20 5 FHBDRN Cc1ccc(CN(C(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])C2CC2)cc1C ZINC000434240225 942541798 /nfs/dbraw/zinc/54/17/98/942541798.db2.gz QRCACHWLBYSABX-UHFFFAOYSA-N 0 0 356.426 3.863 20 5 FHBDRN CC[C@@H](CNC(=O)N(C)CCc1ccccc1[N+](=O)[O-])CC(F)(F)F ZINC000413737257 942541996 /nfs/dbraw/zinc/54/19/96/942541996.db2.gz KTKIHZTVQWOKCP-GFCCVEGCSA-N 0 0 361.364 3.757 20 5 FHBDRN O=[N+]([O-])c1cc(CN2CC[C@@]23CCOC3)ccc1Oc1ccc(F)cc1 ZINC000421398015 942548671 /nfs/dbraw/zinc/54/86/71/942548671.db2.gz NCNBBAGBJGVBLU-IBGZPJMESA-N 0 0 358.369 3.891 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[C@@](C)(CCc2ccccc2)C1 ZINC000434252221 942550102 /nfs/dbraw/zinc/55/01/02/942550102.db2.gz ZBEAARBKZLKYQE-HXUWFJFHSA-N 0 0 353.422 3.783 20 5 FHBDRN Cc1ccccc1C1=CCN(C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000501563543 942550311 /nfs/dbraw/zinc/55/03/11/942550311.db2.gz BGSSWPRGUYRDQU-UHFFFAOYSA-N 0 0 374.400 3.628 20 5 FHBDRN CCOc1ccc(C(=O)N=c2[nH]n(C3CCCCC3)cc2C)cc1[N+](=O)[O-] ZINC000541276661 942554904 /nfs/dbraw/zinc/55/49/04/942554904.db2.gz PCJZHPZPIBBVAP-UHFFFAOYSA-N 0 0 372.425 3.678 20 5 FHBDRN O=[N+]([O-])c1ccc(NCC2CCN(CC(F)(F)F)CC2)c2cccnc21 ZINC000413242004 942558175 /nfs/dbraw/zinc/55/81/75/942558175.db2.gz HLZMWDDWVZONEN-UHFFFAOYSA-N 0 0 368.359 3.829 20 5 FHBDRN Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)Nc1ncc([N+](=O)[O-])cc1F ZINC000413246430 942560940 /nfs/dbraw/zinc/56/09/40/942560940.db2.gz ZPIHKBFEDUSLIW-ZETCQYMHSA-N 0 0 361.299 3.678 20 5 FHBDRN O=C(Nc1ccc(F)c(C2CC2)c1)N1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1 ZINC000366931305 942563464 /nfs/dbraw/zinc/56/34/64/942563464.db2.gz ZMWGYXFNDBYCLC-AWEZNQCLSA-N 0 0 373.388 3.677 20 5 FHBDRN Cc1c(Br)c(=O)n(CCSc2ccccc2)cc1[N+](=O)[O-] ZINC000541289078 942564888 /nfs/dbraw/zinc/56/48/88/942564888.db2.gz FAJLNOKBYPSXQJ-UHFFFAOYSA-N 0 0 369.240 3.620 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1C[C@@H](c2ccccc2)OC[C@@H]1C ZINC000421452693 942565024 /nfs/dbraw/zinc/56/50/24/942565024.db2.gz BKHUNONXRRHYCY-KXBFYZLASA-N 0 0 354.406 3.814 20 5 FHBDRN O=[N+]([O-])c1cc(C(F)(F)F)ccc1OCc1nc(CC(F)(F)F)no1 ZINC000541285667 942566715 /nfs/dbraw/zinc/56/67/15/942566715.db2.gz BBTNQRRUGUKHPU-UHFFFAOYSA-N 0 0 371.193 3.680 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N[C@@H](C)c1ccc2c(c1)CCC(=O)N2 ZINC000421430769 942567045 /nfs/dbraw/zinc/56/70/45/942567045.db2.gz JFUHXUSHLIYFJL-ZDUSSCGKSA-N 0 0 367.405 3.587 20 5 FHBDRN CCOc1ccc(CNC(=O)c2cc([N+](=O)[O-])c(C)cc2C)cc1OC ZINC000421431546 942567678 /nfs/dbraw/zinc/56/76/78/942567678.db2.gz PNUVLVUNTSKMKZ-UHFFFAOYSA-N 0 0 358.394 3.549 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCC[C@H](Oc3ncccc3F)C2)c2cccnc21 ZINC000413257028 942568369 /nfs/dbraw/zinc/56/83/69/942568369.db2.gz ADZNESPVQMXJKN-ZDUSSCGKSA-N 0 0 368.368 3.725 20 5 FHBDRN Cc1ccc([C@@]2(C)CCN(C(=O)NCCc3cccc([N+](=O)[O-])c3)C2)cc1 ZINC000434296850 942570912 /nfs/dbraw/zinc/57/09/12/942570912.db2.gz CWOCUJVUGBGJQV-NRFANRHFSA-N 0 0 367.449 3.819 20 5 FHBDRN CN(C)c1ccc(COC(=O)C2(Cc3ccccc3F)CC2)cc1[N+](=O)[O-] ZINC001268940870 942574139 /nfs/dbraw/zinc/57/41/39/942574139.db2.gz AWTZWLXDHZMSER-UHFFFAOYSA-N 0 0 372.396 3.866 20 5 FHBDRN CC(C)Cn1ncc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)c1C(C)C ZINC000501613426 942575084 /nfs/dbraw/zinc/57/50/84/942575084.db2.gz ANJLYEVPLBDPOY-UHFFFAOYSA-N 0 0 363.393 3.544 20 5 FHBDRN COCCOc1ccc(NC(=O)c2cc([N+](=O)[O-])c(C)cc2C)c(C)c1 ZINC000421447381 942578831 /nfs/dbraw/zinc/57/88/31/942578831.db2.gz NAJPWJJJQFNGOK-UHFFFAOYSA-N 0 0 358.394 3.798 20 5 FHBDRN CCN(CC)C(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])c(C)cc2C)cc1 ZINC000421448912 942579333 /nfs/dbraw/zinc/57/93/33/942579333.db2.gz IHHUBELNOVGOLG-UHFFFAOYSA-N 0 0 369.421 3.946 20 5 FHBDRN O=C(Cc1cc2c(cc1[N+](=O)[O-])OCCO2)Nc1cccc2ccsc21 ZINC000501629241 942579963 /nfs/dbraw/zinc/57/99/63/942579963.db2.gz SALXCFWKJUAHKD-UHFFFAOYSA-N 0 0 370.386 3.762 20 5 FHBDRN COC[C@@H](C)Nc1ccccc1NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000413766922 942580878 /nfs/dbraw/zinc/58/08/78/942580878.db2.gz MBMAQKPFHGTARA-XOKHGSTOSA-N 0 0 369.421 3.784 20 5 FHBDRN COc1cc(C(=O)N2CCC[C@@H](Oc3ccccc3)C2)cc([N+](=O)[O-])c1C ZINC000416270129 942584173 /nfs/dbraw/zinc/58/41/73/942584173.db2.gz KFMKUEISOCWFEU-QGZVFWFLSA-N 0 0 370.405 3.595 20 5 FHBDRN CN(Cc1ccc(Cl)cc1Cl)C(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000015965894 942584716 /nfs/dbraw/zinc/58/47/16/942584716.db2.gz IVEREHLGYXTVIE-UHFFFAOYSA-N 0 0 369.204 3.939 20 5 FHBDRN O=[N+]([O-])c1ccc2ccnc(N3CCC[C@H](Oc4ncccc4F)C3)c2c1 ZINC000413266673 942584976 /nfs/dbraw/zinc/58/49/76/942584976.db2.gz MOEBIQZAHAUIGY-HNNXBMFYSA-N 0 0 368.368 3.725 20 5 FHBDRN CCOc1ccc(C(=O)N2CCC[C@@H](Oc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000416272313 942586486 /nfs/dbraw/zinc/58/64/86/942586486.db2.gz VOJMSYXHSPCNHJ-QGZVFWFLSA-N 0 0 370.405 3.677 20 5 FHBDRN CCOC(=O)C(C)(C)C1CCN(c2ccc([N+](=O)[O-])c3ncccc23)CC1 ZINC000413279684 942587183 /nfs/dbraw/zinc/58/71/83/942587183.db2.gz IRYXVWXWLJGKSO-UHFFFAOYSA-N 0 0 371.437 3.949 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N1CCC[C@@H](Oc2ccccc2)C1 ZINC000416271887 942587316 /nfs/dbraw/zinc/58/73/16/942587316.db2.gz TULBZIXAMPFRTD-MRXNPFEDSA-N 0 0 370.405 3.677 20 5 FHBDRN COc1cccc(C2=CCN(C(=O)c3ccc([N+](=O)[O-])cc3Cl)C2)c1 ZINC000501659995 942592230 /nfs/dbraw/zinc/59/22/30/942592230.db2.gz WGGOYEYOXCHCNR-UHFFFAOYSA-N 0 0 358.781 3.796 20 5 FHBDRN CC[C@H](NC(=O)N1CCOc2c(F)cccc2C1)c1cccc([N+](=O)[O-])c1 ZINC000434310276 942593440 /nfs/dbraw/zinc/59/34/40/942593440.db2.gz YBCBTQCYSXXXFE-KRWDZBQOSA-N 0 0 373.384 3.789 20 5 FHBDRN Cc1nc(-c2ccccc2)sc1[C@H](C)NC(=O)c1ccc([N+](=O)[O-])[nH]1 ZINC000501648392 942595043 /nfs/dbraw/zinc/59/50/43/942595043.db2.gz UKXUXTSKIKAGEK-JTQLQIEISA-N 0 0 356.407 3.846 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)Nc1ccc(N2CCCC2=O)c(F)c1 ZINC000421456915 942595437 /nfs/dbraw/zinc/59/54/37/942595437.db2.gz IXYXXNDLDYAKFL-UHFFFAOYSA-N 0 0 371.368 3.730 20 5 FHBDRN CCOC(=O)C(C)(C)C1CCN(c2nccc3ccc([N+](=O)[O-])cc32)CC1 ZINC000413277244 942596766 /nfs/dbraw/zinc/59/67/66/942596766.db2.gz DLODLFBCEXQPIE-UHFFFAOYSA-N 0 0 371.437 3.949 20 5 FHBDRN COc1cccc(C2=CCN(C(=O)c3cc(SC)ccc3[N+](=O)[O-])C2)c1 ZINC000501669797 942601662 /nfs/dbraw/zinc/60/16/62/942601662.db2.gz NKQCGLJPSLBKCN-UHFFFAOYSA-N 0 0 370.430 3.865 20 5 FHBDRN O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCOc2cccc(F)c2C1 ZINC000513910286 942603224 /nfs/dbraw/zinc/60/32/24/942603224.db2.gz ZACJQODMWYHVJX-UHFFFAOYSA-N 0 0 372.377 3.983 20 5 FHBDRN CC(C)Oc1cc(C(=O)NCC2(C(F)(F)F)CCC2)ccc1[N+](=O)[O-] ZINC000412345836 942607156 /nfs/dbraw/zinc/60/71/56/942607156.db2.gz ZLGBJACQCZXDGY-UHFFFAOYSA-N 0 0 360.332 3.844 20 5 FHBDRN Cc1cc(C(=O)N2CCC(c3ccnc(C(C)C)n3)CC2)ccc1[N+](=O)[O-] ZINC000366576291 942607877 /nfs/dbraw/zinc/60/78/77/942607877.db2.gz ADPHWMXCTBCFOU-UHFFFAOYSA-N 0 0 368.437 3.836 20 5 FHBDRN O=C(NCCc1ccc(OC(F)(F)F)cc1)Nc1cccc([N+](=O)[O-])c1 ZINC000502644637 942610930 /nfs/dbraw/zinc/61/09/30/942610930.db2.gz QWHUJGWJNZVIRV-UHFFFAOYSA-N 0 0 369.299 3.858 20 5 FHBDRN COc1ccc(CNC(=O)CCOc2ccccc2C(C)C)cc1[N+](=O)[O-] ZINC000501721506 942627897 /nfs/dbraw/zinc/62/78/97/942627897.db2.gz SFAXARZVSUBDCB-UHFFFAOYSA-N 0 0 372.421 3.812 20 5 FHBDRN CN(C(=O)[C@@]1(C)CC1(F)F)c1nc(-c2ccccc2[N+](=O)[O-])cs1 ZINC000421504326 942630202 /nfs/dbraw/zinc/63/02/02/942630202.db2.gz HISNVYPQWVOTSR-CQSZACIVSA-N 0 0 353.350 3.726 20 5 FHBDRN Cc1c2ccccc2oc1[C@@H](C)NCc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000183578469 942634091 /nfs/dbraw/zinc/63/40/91/942634091.db2.gz OCWFYCMKNGAHJA-GFCCVEGCSA-N 0 0 353.378 3.599 20 5 FHBDRN CCNC(=O)Nc1cccc(NC(=O)c2cc([N+](=O)[O-])c(C)cc2C)c1C ZINC000421540723 942634785 /nfs/dbraw/zinc/63/47/85/942634785.db2.gz AQNBGUBCRYYDGV-UHFFFAOYSA-N 0 0 370.409 3.914 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CCC=C(c3ccncc3)C2)c(C(F)(F)F)c1 ZINC000413302126 942637565 /nfs/dbraw/zinc/63/75/65/942637565.db2.gz YMRSQWZCWXLGJV-UHFFFAOYSA-N 0 0 350.300 3.697 20 5 FHBDRN CC(C)Nc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1Oc2ccccc2O[C@@H]1C ZINC000413829394 942650133 /nfs/dbraw/zinc/65/01/33/942650133.db2.gz CDMAXINLRSRXHH-KZULUSFZSA-N 0 0 371.393 3.582 20 5 FHBDRN Cc1ccc(NC(=O)c2cc([N+](=O)[O-])c(C)cc2C)cc1NC(=O)N(C)C ZINC000421545039 942650917 /nfs/dbraw/zinc/65/09/17/942650917.db2.gz ZTDIUZUHNGWHER-UHFFFAOYSA-N 0 0 370.409 3.866 20 5 FHBDRN CC(C)c1nc([C@H]2COCCN2Cc2ccc(C(C)C)c([N+](=O)[O-])c2)no1 ZINC000501753658 942652951 /nfs/dbraw/zinc/65/29/51/942652951.db2.gz QMGCLFDNIFGMJZ-QGZVFWFLSA-N 0 0 374.441 3.798 20 5 FHBDRN Cc1c(Nc2nccc3ccc([N+](=O)[O-])cc32)cnn1C1CCOCC1 ZINC000413321036 942658193 /nfs/dbraw/zinc/65/81/93/942658193.db2.gz FSSZVFLHVCZJRM-UHFFFAOYSA-N 0 0 353.382 3.743 20 5 FHBDRN O=C(Nc1ccnc(OCc2ccccc2)c1)c1csc([N+](=O)[O-])c1 ZINC000501760214 942662793 /nfs/dbraw/zinc/66/27/93/942662793.db2.gz SEWCWBKYYBGYCN-UHFFFAOYSA-N 0 0 355.375 3.883 20 5 FHBDRN COc1cc(C(=O)Nc2nc3ccccc3n2C2CC2)cc([N+](=O)[O-])c1C ZINC000616404947 942662946 /nfs/dbraw/zinc/66/29/46/942662946.db2.gz BBHKKDFASCWUKL-UHFFFAOYSA-N 0 0 366.377 3.849 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CCC3(CCC(O)CC3)CC2)c(C(F)(F)F)c1 ZINC000413321511 942663500 /nfs/dbraw/zinc/66/35/00/942663500.db2.gz GDVXVCGNFUIJAK-UHFFFAOYSA-N 0 0 359.348 3.530 20 5 FHBDRN CN(C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)[C@H](CO)c1ccc(Cl)cc1 ZINC000413832358 942668339 /nfs/dbraw/zinc/66/83/39/942668339.db2.gz LYZKUUYMONCNHU-RCCFBDPRSA-N 0 0 374.824 3.544 20 5 FHBDRN Cc1cc(CNC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)cc(C)n1 ZINC000421578748 942669027 /nfs/dbraw/zinc/66/90/27/942669027.db2.gz RSTQHQCBTZQQRK-UHFFFAOYSA-N 0 0 353.300 3.555 20 5 FHBDRN CC(C)Oc1cc(C(=O)N[C@@H]2c3ccccc3O[C@@H]2C)ccc1[N+](=O)[O-] ZINC000412363758 942669775 /nfs/dbraw/zinc/66/97/75/942669775.db2.gz RRNLRRRDGPGSIK-XIKOKIGWSA-N 0 0 356.378 3.634 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H]1CC12CCSCC2 ZINC000421587211 942675133 /nfs/dbraw/zinc/67/51/33/942675133.db2.gz HIHOPGDDKUJBHE-HZPDHXFCSA-N 0 0 362.495 3.813 20 5 FHBDRN CC(C)[C@H](C)NC(=O)COc1ccc([N+](=O)[O-])cc1Cc1ccccc1 ZINC000016458873 942675509 /nfs/dbraw/zinc/67/55/09/942675509.db2.gz LSLKDBPFKVIHHV-HNNXBMFYSA-N 0 0 356.422 3.725 20 5 FHBDRN CC(C)Oc1cc(C(=O)NC[C@H]2CC23CCSCC3)ccc1[N+](=O)[O-] ZINC000421596165 942678369 /nfs/dbraw/zinc/67/83/69/942678369.db2.gz OXHBLZNNAXHEBW-CQSZACIVSA-N 0 0 364.467 3.645 20 5 FHBDRN O=[N+]([O-])c1ccccc1C[C@H](Nc1cnn(Cc2ccccn2)c1)C1CC1 ZINC000182143217 942680315 /nfs/dbraw/zinc/68/03/15/942680315.db2.gz QDNRNLBIGVLPGP-IBGZPJMESA-N 0 0 363.421 3.668 20 5 FHBDRN CSc1ccc(C(=O)NC[C@H]2CC23CCSCC3)cc1[N+](=O)[O-] ZINC000421588594 942684741 /nfs/dbraw/zinc/68/47/41/942684741.db2.gz IYWMABNUWJIPJT-GFCCVEGCSA-N 0 0 352.481 3.580 20 5 FHBDRN C[C@H]1C[C@@H](c2noc(-c3ccnc(-c4ccccc4)c3[N+](=O)[O-])n2)CCO1 ZINC000420486806 942690412 /nfs/dbraw/zinc/69/04/12/942690412.db2.gz HJUASWVXTSDMPS-JSGCOSHPSA-N 0 0 366.377 3.989 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)NCCC[C@H]2CCCC[C@H]2O)cc1[N+](=O)[O-] ZINC000434469977 942690962 /nfs/dbraw/zinc/69/09/62/942690962.db2.gz LTLKNLVFZUVBBX-RDTXWAMCSA-N 0 0 362.470 3.953 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H](C)c1ncc(C)s1 ZINC000183617786 942696312 /nfs/dbraw/zinc/69/63/12/942696312.db2.gz BPSASWNTBVDNTR-SWLSCSKDSA-N 0 0 361.467 3.848 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2noc(-c3[nH]ccc3C3CC3)n2)c2c1NCCC2 ZINC000420497999 942706204 /nfs/dbraw/zinc/70/62/04/942706204.db2.gz DVTSJJHLQSFBEV-UHFFFAOYSA-N 0 0 351.366 3.875 20 5 FHBDRN Cc1ncccc1Cc1noc(-c2ccc(N3CCCC3)c([N+](=O)[O-])c2)n1 ZINC000420499899 942706400 /nfs/dbraw/zinc/70/64/00/942706400.db2.gz CKRRZLFGPPAKHB-UHFFFAOYSA-N 0 0 365.393 3.539 20 5 FHBDRN O=[N+]([O-])c1ccccc1NCCc1noc([C@H]2CCc3ccccc3O2)n1 ZINC000420507260 942709327 /nfs/dbraw/zinc/70/93/27/942709327.db2.gz VUQRCHSBPQOHTA-QGZVFWFLSA-N 0 0 366.377 3.699 20 5 FHBDRN CC(C)C[C@@H](NC(=O)CN(C)Cc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000501842392 942711094 /nfs/dbraw/zinc/71/10/94/942711094.db2.gz LUAKDGRGEPWFJC-LJQANCHMSA-N 0 0 369.465 3.930 20 5 FHBDRN Cc1sc(C(=O)N2C[C@@H](C(=O)OC(C)(C)C)CC[C@H]2C)cc1[N+](=O)[O-] ZINC000421634373 942712263 /nfs/dbraw/zinc/71/22/63/942712263.db2.gz PKTXUAHRYWIIIO-PWSUYJOCSA-N 0 0 368.455 3.547 20 5 FHBDRN Cc1ncccc1Cc1noc(-c2ccc([N+](=O)[O-])c(OC(C)C)c2)n1 ZINC000420510721 942713027 /nfs/dbraw/zinc/71/30/27/942713027.db2.gz KOVHSNMPJCQLEQ-UHFFFAOYSA-N 0 0 354.366 3.726 20 5 FHBDRN CC[C@H](C)Oc1cccc(NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)c1 ZINC000502748675 942714718 /nfs/dbraw/zinc/71/47/18/942714718.db2.gz AVSCNRCUARLNTL-NSHDSACASA-N 0 0 354.366 3.901 20 5 FHBDRN Cc1ccc(-c2noc(CCCNc3ccc([N+](=O)[O-])cc3)n2)nc1C ZINC000420513764 942717059 /nfs/dbraw/zinc/71/70/59/942717059.db2.gz XDVCRBXRSAHGCB-UHFFFAOYSA-N 0 0 353.382 3.701 20 5 FHBDRN Cn1cc(C(=O)N2CC[C@@H](C3CCCC3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000421647604 942720093 /nfs/dbraw/zinc/72/00/93/942720093.db2.gz WAUKOZFTDJGQFK-MRXNPFEDSA-N 0 0 368.437 3.648 20 5 FHBDRN CC[C@@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2SC(C)C)CCO1 ZINC000421673022 942736912 /nfs/dbraw/zinc/73/69/12/942736912.db2.gz WHPMVUAFCUSIEC-GXTWGEPZSA-N 0 0 352.456 3.783 20 5 FHBDRN C[C@H](C(=O)N(C)C1CC(OC(C)(C)C)C1)c1ccc([N+](=O)[O-])cc1F ZINC000421691767 942747863 /nfs/dbraw/zinc/74/78/63/942747863.db2.gz CYKXXAUWOQOHFA-XGNXJENSSA-N 0 0 352.406 3.642 20 5 FHBDRN C[C@@H](NC(=O)NCc1nc(C(C)(C)C)cs1)c1cccc([N+](=O)[O-])c1 ZINC000104790972 942748391 /nfs/dbraw/zinc/74/83/91/942748391.db2.gz OPFXFBHBGVQFHA-LLVKDONJSA-N 0 0 362.455 3.909 20 5 FHBDRN CC(C)N(C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2)[C@H](C)c1ccsc1 ZINC000421694150 942748574 /nfs/dbraw/zinc/74/85/74/942748574.db2.gz UIUQZZWKFMRTHC-LLVKDONJSA-N 0 0 362.407 3.997 20 5 FHBDRN CCOC(=O)c1ccc(F)c(C)c1NC(=O)c1ccc([N+](=O)[O-])cc1C ZINC000505429944 942756635 /nfs/dbraw/zinc/75/66/35/942756635.db2.gz VTEIUIOUGMYTQD-UHFFFAOYSA-N 0 0 360.341 3.780 20 5 FHBDRN CCc1ccc(CN2CCN(Cc3csc([N+](=O)[O-])c3)CC2)s1 ZINC000514098471 942758308 /nfs/dbraw/zinc/75/83/08/942758308.db2.gz HGMGTLOPADGOEB-UHFFFAOYSA-N 0 0 351.497 3.598 20 5 FHBDRN CN(Cc1ccc([S@@](C)=O)cc1)c1ccc([N+](=O)[O-])cc1OC(F)F ZINC000780910794 942765655 /nfs/dbraw/zinc/76/56/55/942765655.db2.gz DARFUOLVKOJSNW-RUZDIDTESA-N 0 0 370.377 3.570 20 5 FHBDRN O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)Nc1ccc2c(c1)C(=O)CCCC2 ZINC000421714123 942766044 /nfs/dbraw/zinc/76/60/44/942766044.db2.gz ISBSZQZUFOLKDC-UHFFFAOYSA-N 0 0 374.343 3.963 20 5 FHBDRN Cc1c(CC(=O)Nc2ccc3c(c2)C(=O)CCCC3)cccc1[N+](=O)[O-] ZINC000421716747 942768601 /nfs/dbraw/zinc/76/86/01/942768601.db2.gz SSGUEGQPTGFJIU-UHFFFAOYSA-N 0 0 352.390 3.994 20 5 FHBDRN C[C@@H](C1CC1)n1nccc1NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514146764 942771702 /nfs/dbraw/zinc/77/17/02/942771702.db2.gz CRYGXXALFMIFMY-VIFPVBQESA-N 0 0 366.324 3.616 20 5 FHBDRN O=c1[nH]c(CSc2ncccc2[N+](=O)[O-])nc2c3ccccc3oc21 ZINC000502820368 942775513 /nfs/dbraw/zinc/77/55/13/942775513.db2.gz XPHMNJFNBNTWDA-UHFFFAOYSA-N 0 0 354.347 3.677 20 5 FHBDRN Cc1nn(CCC(=O)N2CC[C@H](c3ccccc3)C2(C)C)c(C)c1[N+](=O)[O-] ZINC000421722026 942776141 /nfs/dbraw/zinc/77/61/41/942776141.db2.gz LPJXCGBNIVCFDZ-QGZVFWFLSA-N 0 0 370.453 3.593 20 5 FHBDRN CCOC(=O)c1ccc(F)c(C)c1NC(=O)c1ccc(C)c([N+](=O)[O-])c1 ZINC000505435359 942776563 /nfs/dbraw/zinc/77/65/63/942776563.db2.gz VBFDRKGRYIXBPV-UHFFFAOYSA-N 0 0 360.341 3.780 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCC(c2ccc(O)cc2)CC1 ZINC000421740770 942781645 /nfs/dbraw/zinc/78/16/45/942781645.db2.gz LVMMISRDVZOEDR-UHFFFAOYSA-N 0 0 354.406 3.937 20 5 FHBDRN CC[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F)c1nc(C)cs1 ZINC000181599377 942788967 /nfs/dbraw/zinc/78/89/67/942788967.db2.gz UIZVJBMUIMOVLO-LLVKDONJSA-N 0 0 371.365 3.842 20 5 FHBDRN CC[C@@H]1C[C@H](CC(=O)Nc2cc(C)nn2-c2ccc([N+](=O)[O-])cc2)CCO1 ZINC000514156751 942789956 /nfs/dbraw/zinc/78/99/56/942789956.db2.gz WTSDBUBLMTVLRH-RHSMWYFYSA-N 0 0 372.425 3.623 20 5 FHBDRN O=[N+]([O-])c1nn(CCSc2ccc(Cl)cc2)cc1Br ZINC000502852053 942797932 /nfs/dbraw/zinc/79/79/32/942797932.db2.gz ZGCNAUSFUHMCHV-UHFFFAOYSA-N 0 0 362.636 4.000 20 5 FHBDRN COc1ccc(NC(=O)c2ccc(OC3CCCC3)nc2)c([N+](=O)[O-])c1 ZINC000514170284 942798216 /nfs/dbraw/zinc/79/82/16/942798216.db2.gz PNOSLRZIVMVOCR-UHFFFAOYSA-N 0 0 357.366 3.572 20 5 FHBDRN CC[C@@H](CNC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)CC(F)(F)F ZINC000413924777 942799169 /nfs/dbraw/zinc/79/91/69/942799169.db2.gz ZGXBQYKOURABBE-LLVKDONJSA-N 0 0 359.348 3.641 20 5 FHBDRN CCOC1CC(CSc2nc3cc4ccccc4cc3c(=O)n2C)C1 ZINC000505443928 942799407 /nfs/dbraw/zinc/79/94/07/942799407.db2.gz NOQQMFILAXOUTJ-UHFFFAOYSA-N 0 0 354.475 3.994 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)N2C[C@H](O)C[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000413930049 942800141 /nfs/dbraw/zinc/80/01/41/942800141.db2.gz BMBJAVGNNYVKOH-AEFFLSMTSA-N 0 0 368.433 3.840 20 5 FHBDRN C[C@H](c1ccccc1Br)N(C)C(=O)c1cc([N+](=O)[O-])c[nH]1 ZINC000502861602 942804108 /nfs/dbraw/zinc/80/41/08/942804108.db2.gz MCMBJVQBFXVOBK-SECBINFHSA-N 0 0 352.188 3.519 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N(Cc1cccc(O)c1)CC1CC1 ZINC000421783536 942808631 /nfs/dbraw/zinc/80/86/31/942808631.db2.gz GDFWOETZIFCCIX-UHFFFAOYSA-N 0 0 354.406 3.970 20 5 FHBDRN CC(C)(C)OC(=O)[C@@H]1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000514201121 942810296 /nfs/dbraw/zinc/81/02/96/942810296.db2.gz BILHLXTYUPHWIJ-SNVBAGLBSA-N 0 0 360.332 3.782 20 5 FHBDRN CC(C)(C)Oc1cccc(CNC(=O)c2ccc(Cl)cc2[N+](=O)[O-])n1 ZINC000502880029 942810809 /nfs/dbraw/zinc/81/08/09/942810809.db2.gz AQAUFVCFLQPKNK-UHFFFAOYSA-N 0 0 363.801 3.751 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)Nc1cccc([C@@H](C)C(=O)OC)c1 ZINC000413942106 942812479 /nfs/dbraw/zinc/81/24/79/942812479.db2.gz VZYBZGUJKHZPKP-GFCCVEGCSA-N 0 0 372.377 3.522 20 5 FHBDRN CCOC(=O)CC1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000514192850 942818507 /nfs/dbraw/zinc/81/85/07/942818507.db2.gz LJPIQRISOUJSRB-UHFFFAOYSA-N 0 0 360.332 3.783 20 5 FHBDRN CO[C@](C)([C@@H](C)NC(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-])C1CC1 ZINC000413958005 942819615 /nfs/dbraw/zinc/81/96/15/942819615.db2.gz OBVXAFQVCXOIIJ-ZUOKHONESA-N 0 0 369.421 3.590 20 5 FHBDRN CCO[C@@H](C(=O)Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1)c1ccccc1 ZINC000104874603 942820276 /nfs/dbraw/zinc/82/02/76/942820276.db2.gz GTOBYTUJLHVHQP-GOSISDBHSA-N 0 0 366.377 3.701 20 5 FHBDRN O=C(c1ccc(OC(F)F)c([N+](=O)[O-])c1)N1CCC2(CCCC2)CC1 ZINC000514209300 942820620 /nfs/dbraw/zinc/82/06/20/942820620.db2.gz TUERIYNVMLKVRU-UHFFFAOYSA-N 0 0 354.353 3.993 20 5 FHBDRN CCOc1ccc(C(=O)N2CCC[C@H](Oc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000413960972 942821293 /nfs/dbraw/zinc/82/12/93/942821293.db2.gz VOJMSYXHSPCNHJ-KRWDZBQOSA-N 0 0 370.405 3.677 20 5 FHBDRN Cc1ccccc1[C@]1(F)CCN(Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000502893363 942822169 /nfs/dbraw/zinc/82/21/69/942822169.db2.gz PSFVXADRKPFARQ-FQEVSTJZSA-N 0 0 372.396 3.840 20 5 FHBDRN CC1(C)C[C@@H](c2ccccc2)N(C(=O)COc2ccccc2[N+](=O)[O-])C1 ZINC000425120996 942822657 /nfs/dbraw/zinc/82/26/57/942822657.db2.gz PBDLDEJZLWALND-KRWDZBQOSA-N 0 0 354.406 3.973 20 5 FHBDRN O=C1C[C@H](c2cccc(Nc3ccc(C(F)(F)F)cc3[N+](=O)[O-])c2)CN1 ZINC000514214993 942823029 /nfs/dbraw/zinc/82/30/29/942823029.db2.gz QBLSGADNQUOHCS-NSHDSACASA-N 0 0 365.311 3.961 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1C[C@@H](C)O[C@H](c2ccsc2)C1 ZINC000421788806 942827141 /nfs/dbraw/zinc/82/71/41/942827141.db2.gz TUWIITYPHLOOIQ-DYVFJYSZSA-N 0 0 360.435 3.875 20 5 FHBDRN COc1cc(CSc2ccncc2)c([N+](=O)[O-])cc1OCC(F)F ZINC000502884512 942827988 /nfs/dbraw/zinc/82/79/88/942827988.db2.gz GGDBENPZBKIZOK-UHFFFAOYSA-N 0 0 356.350 3.935 20 5 FHBDRN CCOc1cc(CS(=O)(=O)C/C=C\c2ccccc2)ccc1[N+](=O)[O-] ZINC000434639052 942830090 /nfs/dbraw/zinc/83/00/90/942830090.db2.gz WPKZMUMDNIGNFM-TWGQIWQCSA-N 0 0 361.419 3.622 20 5 FHBDRN COc1cccc(COCCNc2ccc([N+](=O)[O-])c3cccnc23)c1 ZINC000514206822 942830319 /nfs/dbraw/zinc/83/03/19/942830319.db2.gz VFWPIZWMWIEWRI-UHFFFAOYSA-N 0 0 353.378 3.780 20 5 FHBDRN O=C(N[C@@H]1CC[C@@H]2CCC[C@H]2C1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514227898 942838172 /nfs/dbraw/zinc/83/81/72/942838172.db2.gz WSBGEERBLSXPKB-GMXVVIOVSA-N 0 0 354.353 3.895 20 5 FHBDRN CCCCCn1cc(CNC(=O)c2cc([N+](=O)[O-])c(C)s2)c(C)n1 ZINC000502915086 942838888 /nfs/dbraw/zinc/83/88/88/942838888.db2.gz UWTVAMADFXNSAK-UHFFFAOYSA-N 0 0 350.444 3.590 20 5 FHBDRN O=C(N[C@@H]1C[C@@H]1c1cccc(F)c1)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000067333954 942841028 /nfs/dbraw/zinc/84/10/28/942841028.db2.gz NWSGGLWPGWZQEK-SJLPKXTDSA-N 0 0 369.396 3.620 20 5 FHBDRN Cc1ccc(CC[C@@H](C)NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)o1 ZINC000514220321 942848533 /nfs/dbraw/zinc/84/85/33/942848533.db2.gz ZIZQYZRWPWBIRW-SNVBAGLBSA-N 0 0 368.336 3.849 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CC[C@H](C(F)(F)F)C(C)(C)C1 ZINC000190175752 942854057 /nfs/dbraw/zinc/85/40/57/942854057.db2.gz LNMLRBJIGREIJD-AWEZNQCLSA-N 0 0 373.375 3.752 20 5 FHBDRN CCN(CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-])c1cccc(C)c1C ZINC000513759908 942857504 /nfs/dbraw/zinc/85/75/04/942857504.db2.gz HSBCYCSGJDQJFD-UHFFFAOYSA-N 0 0 357.410 3.685 20 5 FHBDRN C[C@@H]1C[C@@H](NC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)C[C@@H](c2ccccc2)C1 ZINC000413977956 942857891 /nfs/dbraw/zinc/85/78/91/942857891.db2.gz HYQWCWZBAIMENT-BHYGNILZSA-N 0 0 370.453 3.615 20 5 FHBDRN CC(C)[C@H](NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)C(F)(F)F ZINC000413978047 942857932 /nfs/dbraw/zinc/85/79/32/942857932.db2.gz BLKSKHULSGIWFW-AWEZNQCLSA-N 0 0 359.348 3.512 20 5 FHBDRN O=[N+]([O-])c1cccc(CN[C@@H](CCO)c2ccccc2Br)c1 ZINC000514246010 942860808 /nfs/dbraw/zinc/86/08/08/942860808.db2.gz GIMGOEVZCCSDHR-INIZCTEOSA-N 0 0 365.227 3.571 20 5 FHBDRN CSc1ccc(C(=O)N2CC=C(c3cncc(F)c3)CC2)cc1[N+](=O)[O-] ZINC000378533526 942868662 /nfs/dbraw/zinc/86/86/62/942868662.db2.gz NZKYTBGMLHKDFS-UHFFFAOYSA-N 0 0 373.409 3.780 20 5 FHBDRN C[C@@H](Cc1ccccc1Br)NC(=O)c1ccccc1[N+](=O)[O-] ZINC000133619420 942885991 /nfs/dbraw/zinc/88/59/91/942885991.db2.gz LJULUOCJOSNCPT-NSHDSACASA-N 0 0 363.211 3.718 20 5 FHBDRN Cc1cc(NC(=O)c2c(Cl)cccc2[N+](=O)[O-])ccc1C(=O)N(C)C ZINC000133616252 942890147 /nfs/dbraw/zinc/89/01/47/942890147.db2.gz IPDPXZOFQYGLAZ-UHFFFAOYSA-N 0 0 361.785 3.511 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N1CCC[C@@H](CC(F)(F)F)C1 ZINC000421940882 942897431 /nfs/dbraw/zinc/89/74/31/942897431.db2.gz BTFDBSDWLDZDRF-NSHDSACASA-N 0 0 360.332 3.798 20 5 FHBDRN O=C(c1cc2cccc([N+](=O)[O-])c2[nH]1)N1CCC[C@@H](CC(F)(F)F)C1 ZINC000421945139 942899406 /nfs/dbraw/zinc/89/94/06/942899406.db2.gz QUCMEKMCGIHQTB-JTQLQIEISA-N 0 0 355.316 3.881 20 5 FHBDRN Cc1ccc(NC(=O)c2csc(-c3ncccc3F)n2)cc1[N+](=O)[O-] ZINC000510003174 942902176 /nfs/dbraw/zinc/90/21/76/942902176.db2.gz RVNOTFVRLNHBDM-UHFFFAOYSA-N 0 0 358.354 3.813 20 5 FHBDRN COc1cccc2c1ncc(C)c2NC(=O)Cc1ccccc1[N+](=O)[O-] ZINC000430105169 942902958 /nfs/dbraw/zinc/90/29/58/942902958.db2.gz TVBXASJVDWTWMH-UHFFFAOYSA-N 0 0 351.362 3.641 20 5 FHBDRN COc1cc(C(=O)N2CCC[C@H](CC(F)(F)F)C2)cc([N+](=O)[O-])c1C ZINC000421952536 942904876 /nfs/dbraw/zinc/90/48/76/942904876.db2.gz DTALXWJHASAAHY-LLVKDONJSA-N 0 0 360.332 3.716 20 5 FHBDRN O=C(CCC(=O)N1CCC[C@@H](CC(F)(F)F)C1)c1cccc([N+](=O)[O-])c1 ZINC000421953810 942905801 /nfs/dbraw/zinc/90/58/01/942905801.db2.gz GALHEHKZOVXXNZ-LBPRGKRZSA-N 0 0 372.343 3.749 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CCC[C@H](CC(F)(F)F)C1 ZINC000421958984 942908356 /nfs/dbraw/zinc/90/83/56/942908356.db2.gz JPRLDNFXAZOGTN-LLVKDONJSA-N 0 0 369.343 3.810 20 5 FHBDRN CC[C@@H]1CN(C(=O)c2cccc3c(=O)c4ccccc4[nH]c23)C[C@@H](CC)O1 ZINC000421961168 942909130 /nfs/dbraw/zinc/90/91/30/942909130.db2.gz FTUIANXIGGGYMW-HUUCEWRRSA-N 0 0 364.445 3.711 20 5 FHBDRN O=C(c1cc2cccn2cn1)N(c1cccc([N+](=O)[O-])c1)C1CCCC1 ZINC001125886028 942916101 /nfs/dbraw/zinc/91/61/01/942916101.db2.gz WWBQXRCDUYSHPS-UHFFFAOYSA-N 0 0 350.378 3.832 20 5 FHBDRN Cc1cncc(NC(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)c1 ZINC000510009340 942922829 /nfs/dbraw/zinc/92/28/29/942922829.db2.gz HLODXZLLRNEDJZ-UHFFFAOYSA-N 0 0 350.172 3.621 20 5 FHBDRN COc1ccc(C[C@H](C)CNC(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 ZINC000536254844 942923146 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Cc1ccc(C2CCN(C(=O)c3cc(F)c(F)cc3[N+](=O)[O-])CC2)cn1 ZINC000378620264 942967962 /nfs/dbraw/zinc/96/79/62/942967962.db2.gz GFFDOZCSCUOLEQ-UHFFFAOYSA-N 0 0 361.348 3.596 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])NCCc1ccc(Cl)cc1Cl ZINC000016636229 942968881 /nfs/dbraw/zinc/96/88/81/942968881.db2.gz VPHPTOBWETYXJQ-UHFFFAOYSA-N 0 0 353.205 3.803 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)N[C@@H]1CCCc2c(O)cccc21 ZINC000503100683 942973471 /nfs/dbraw/zinc/97/34/71/942973471.db2.gz DHYYWLHDZVKYGW-QGZVFWFLSA-N 0 0 369.421 3.562 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@@H](c2ccc(C)cc2)C1 ZINC000544231517 942977214 /nfs/dbraw/zinc/97/72/14/942977214.db2.gz WZVUWJNMFAMEDQ-OAHLLOKOSA-N 0 0 355.394 3.933 20 5 FHBDRN COc1ccc(NC(=O)Cc2cccc([N+](=O)[O-])c2)c(C(F)(F)F)c1 ZINC000503127504 943000602 /nfs/dbraw/zinc/00/06/02/943000602.db2.gz VVXVQZMVYSHUHR-UHFFFAOYSA-N 0 0 354.284 3.803 20 5 FHBDRN Cc1ccc(Cn2nccc2NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)o1 ZINC000503128926 943000665 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CC[C@H](c1ccccc1)N(CC)C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000514535292 943091727 /nfs/dbraw/zinc/09/17/27/943091727.db2.gz PZRMNEGLTPNPHO-OAHLLOKOSA-N 0 0 356.378 3.937 20 5 FHBDRN CC(C)OC(=O)C[C@@H](NC(=O)c1ccc(F)cc1)c1ccccc1[N+](=O)[O-] ZINC000014375866 943110542 /nfs/dbraw/zinc/11/05/42/943110542.db2.gz ZLQBCHZVHCCMSE-MRXNPFEDSA-N 0 0 374.368 3.547 20 5 FHBDRN Cc1nc(NC(=O)c2cnn(-c3ccccc3)c2C2CC2)ccc1[N+](=O)[O-] ZINC000133664980 943120181 /nfs/dbraw/zinc/12/01/81/943120181.db2.gz OSAZAMOTDCORHQ-UHFFFAOYSA-N 0 0 363.377 3.614 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)NCCCc1ccc(Cl)cc1 ZINC000503331786 943122927 /nfs/dbraw/zinc/12/29/27/943122927.db2.gz XQRASVNDPPQJSG-UHFFFAOYSA-N 0 0 371.824 3.952 20 5 FHBDRN Cc1cc(C)cc([C@@H]2CCN(C(=O)c3cc4c(c([N+](=O)[O-])c3)OCO4)C2)c1 ZINC000183759608 943132326 /nfs/dbraw/zinc/13/23/26/943132326.db2.gz IXEPTFIGPNVYQR-CQSZACIVSA-N 0 0 368.389 3.570 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N1CCC[C@@H]1[C@H]1CCCOC1 ZINC000514600977 943140037 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368.418 3.714 20 5 FHBDRN Cc1ccccc1[C@@H](NS(=O)(=O)CCc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000503432500 943181878 /nfs/dbraw/zinc/18/18/78/943181878.db2.gz VTHMYZYXALUCFF-IBGZPJMESA-N 0 0 374.462 3.516 20 5 FHBDRN CC[C@](C)(CO)NC(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000435128104 943182097 /nfs/dbraw/zinc/18/20/97/943182097.db2.gz BYXPIWOLIMMELQ-GOSISDBHSA-N 0 0 359.382 3.670 20 5 FHBDRN O=C(Nc1cc(Cl)cc(Cl)c1)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000514659423 943187216 /nfs/dbraw/zinc/18/72/16/943187216.db2.gz WFVGUUWKLKJZHK-UHFFFAOYSA-N 0 0 355.133 3.883 20 5 FHBDRN COc1ccc2oc(CN3CCN(c4ccccc4[N+](=O)[O-])CC3)cc2c1 ZINC000505611913 943190899 /nfs/dbraw/zinc/19/08/99/943190899.db2.gz RWXHZEKYJJWNHH-UHFFFAOYSA-N 0 0 367.405 3.672 20 5 FHBDRN CCCOc1cc(NC(=O)[C@@H]2CCCCO2)c([N+](=O)[O-])cc1OCCC ZINC000435150653 943193472 /nfs/dbraw/zinc/19/34/72/943193472.db2.gz CNWIWPZDDSNBAO-HNNXBMFYSA-N 0 0 366.414 3.680 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CC[C@@H](O)[C@H]2c2ccc(Cl)cc2)c(Cl)c1 ZINC000425288301 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FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N(C)[C@@H](C)C(=O)OC(C)C ZINC000503550522 943253486 /nfs/dbraw/zinc/25/34/86/943253486.db2.gz GOFRIDGXPIMIEG-LBPRGKRZSA-N 0 0 368.455 3.509 20 5 FHBDRN O=C(Nc1ccc(OCc2ccccc2)cc1[N+](=O)[O-])c1csc(=O)[nH]1 ZINC001269394917 943272249 /nfs/dbraw/zinc/27/22/49/943272249.db2.gz XQGVLOJBWOJJHZ-UHFFFAOYSA-N 0 0 371.374 3.588 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1C[C@@H](O)C[C@@H]1c1ccccc1 ZINC000416996167 943280146 /nfs/dbraw/zinc/28/01/46/943280146.db2.gz IXIARAYEDNXGEB-MAUKXSAKSA-N 0 0 355.394 3.551 20 5 FHBDRN O=C(Cc1cccc([N+](=O)[O-])c1)Nc1cc(F)c(F)cc1Br ZINC000435252937 943282599 /nfs/dbraw/zinc/28/25/99/943282599.db2.gz YSRRDPRCKXFSSN-UHFFFAOYSA-N 0 0 371.137 3.817 20 5 FHBDRN COc1ccc(NC(=O)c2cnn(-c3ccc(C)cc3)c2C)c([N+](=O)[O-])c1 ZINC000514777497 943283957 /nfs/dbraw/zinc/28/39/57/943283957.db2.gz WONBDYAXMVUCIK-UHFFFAOYSA-N 0 0 366.377 3.658 20 5 FHBDRN Cc1c(NC(=O)NCc2cccc(OC(C)(C)C)n2)cccc1[N+](=O)[O-] ZINC000503606701 943288620 /nfs/dbraw/zinc/28/86/20/943288620.db2.gz CKRJMUOVTUDYHA-UHFFFAOYSA-N 0 0 358.398 3.797 20 5 FHBDRN O=C(NCCc1ccccc1[N+](=O)[O-])NC[C@@H](c1ccccc1)C1CC1 ZINC000431917747 943313172 /nfs/dbraw/zinc/31/31/72/943313172.db2.gz ZTEGMFOGNUNSMW-SFHVURJKSA-N 0 0 353.422 3.630 20 5 FHBDRN O=C(NCCc1cc(F)c(F)c(F)c1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000503651928 943320600 /nfs/dbraw/zinc/32/06/00/943320600.db2.gz WMUQJATUVGWSNL-UHFFFAOYSA-N 0 0 358.703 3.638 20 5 FHBDRN Cc1c(NC(=O)N2CC[C@H](C)[C@@H]2C)cc(Br)cc1[N+](=O)[O-] ZINC000435322830 943323814 /nfs/dbraw/zinc/32/38/14/943323814.db2.gz HDMASLZEMWBKRX-WPRPVWTQSA-N 0 0 356.220 3.928 20 5 FHBDRN Cc1c(NC(=O)NC[C@@H]2CCCS2)cc(Br)cc1[N+](=O)[O-] ZINC000435325329 943325121 /nfs/dbraw/zinc/32/51/21/943325121.db2.gz ZOEWNYUGFRQJOO-JTQLQIEISA-N 0 0 374.260 3.683 20 5 FHBDRN O=C(Nc1cc(F)cc([N+](=O)[O-])c1)C1(Oc2ccc(Cl)cc2)CC1 ZINC000514850827 943335753 /nfs/dbraw/zinc/33/57/53/943335753.db2.gz KHOFKGWBFSGNHO-UHFFFAOYSA-N 0 0 350.733 3.937 20 5 FHBDRN O=C1c2ccccc2C(=O)N1Cc1cnc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000503735782 943358609 /nfs/dbraw/zinc/35/86/09/943358609.db2.gz OXPBNNWUHZUUBL-UHFFFAOYSA-N 0 0 365.370 3.515 20 5 FHBDRN CC[C@H](OC1CCCCC1)C(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000514888690 943363191 /nfs/dbraw/zinc/36/31/91/943363191.db2.gz VXDVYFFLOXZGAY-IBGZPJMESA-N 0 0 373.453 3.863 20 5 FHBDRN Cc1cc(S(=O)(=O)N2CCC[C@@H]2/C=C\c2ccccc2)ccc1[N+](=O)[O-] ZINC000503855794 943386381 /nfs/dbraw/zinc/38/63/81/943386381.db2.gz NTJWIWDAPIWYAK-DOOKAGJSSA-N 0 0 372.446 3.770 20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])NCC1(c2ccc(F)cc2)CCC1 ZINC000503857828 943387323 /nfs/dbraw/zinc/38/73/23/943387323.db2.gz IUXZUYUIMYZKFS-UHFFFAOYSA-N 0 0 371.412 3.774 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)NC[C@H]2CCC[C@@H]2C2CC2)cc1SC ZINC000412460164 943399406 /nfs/dbraw/zinc/39/94/06/943399406.db2.gz FINJEXFUUNRPHN-CHWSQXEVSA-N 0 0 364.467 3.881 20 5 FHBDRN CCC[C@H](NC(=O)N1CCC(n2ccc([N+](=O)[O-])n2)CC1)c1ccccc1 ZINC000365872941 943399607 /nfs/dbraw/zinc/39/96/07/943399607.db2.gz BZZXSXCBWUTIBE-KRWDZBQOSA-N 0 0 371.441 3.679 20 5 FHBDRN COc1ccncc1NC(=O)c1cc([N+](=O)[O-])ccc1SCC(C)C ZINC000162357729 943409500 /nfs/dbraw/zinc/40/95/00/943409500.db2.gz OPIFHGIYQHGKCY-UHFFFAOYSA-N 0 0 361.423 3.999 20 5 FHBDRN COc1ccc(-c2nc(SCCOc3cccc([N+](=O)[O-])c3)n[nH]2)cc1 ZINC000042152432 943413769 /nfs/dbraw/zinc/41/37/69/943413769.db2.gz BVMBOWXWCCYRLV-UHFFFAOYSA-N 0 0 372.406 3.560 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)NCCc1ccccc1C(F)(F)F ZINC000053233876 943417299 /nfs/dbraw/zinc/41/72/99/943417299.db2.gz WQVPJDWHCKTNLT-UHFFFAOYSA-N 0 0 368.311 3.595 20 5 FHBDRN COc1ccccc1[C@H](C)CC(=O)OCCN(C)c1ccc([N+](=O)[O-])cc1 ZINC000728770058 943429341 /nfs/dbraw/zinc/42/93/41/943429341.db2.gz XLIJMWSXZPWYQO-OAHLLOKOSA-N 0 0 372.421 3.777 20 5 FHBDRN COc1cc(CCNc2ccnc3nc(C)ccc23)c([N+](=O)[O-])cc1OC ZINC000435476305 943447424 /nfs/dbraw/zinc/44/74/24/943447424.db2.gz DDNMRQXRNWSYLR-UHFFFAOYSA-N 0 0 368.393 3.518 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(C)c1ccc(Cl)cc1F ZINC000435477918 943448376 /nfs/dbraw/zinc/44/83/76/943448376.db2.gz DEVMPCGYQOWABE-UHFFFAOYSA-N 0 0 358.778 3.521 20 5 FHBDRN Cc1ccc(NC(=O)N(C)[C@H](C)[C@H]2Cc3ccccc3O2)cc1[N+](=O)[O-] ZINC000434213271 943450722 /nfs/dbraw/zinc/45/07/22/943450722.db2.gz FYKKXAMTTKWNCB-FZKQIMNGSA-N 0 0 355.394 3.759 20 5 FHBDRN C[C@@H](Oc1cccc2ccccc21)C(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000435510378 943451877 /nfs/dbraw/zinc/45/18/77/943451877.db2.gz GXZLUQQOHFZOMQ-OAHLLOKOSA-N 0 0 364.401 3.874 20 5 FHBDRN CC(=O)Nc1ccccc1CC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000435512267 943453587 /nfs/dbraw/zinc/45/35/87/943453587.db2.gz VTPDDRJHMYDEGM-UHFFFAOYSA-N 0 0 369.421 3.533 20 5 FHBDRN CCc1nc2cc(NC(=O)COc3ccc([N+](=O)[O-])c(C)c3)ccc2o1 ZINC000435541577 943476331 /nfs/dbraw/zinc/47/63/31/943476331.db2.gz ZRJHTEGWCUHYHC-UHFFFAOYSA-N 0 0 355.350 3.624 20 5 FHBDRN CS(=O)(=O)c1cccc(N[C@@H]2C[C@H]2c2cccc(Cl)c2)c1[N+](=O)[O-] ZINC000435570345 943491820 /nfs/dbraw/zinc/49/18/20/943491820.db2.gz WPOPWRQSBUMRDH-GXTWGEPZSA-N 0 0 366.826 3.620 20 5 FHBDRN Nc1nccc(C(=O)N[C@H]2CCC[C@@H](c3ccc(Cl)cc3)C2)c1[N+](=O)[O-] ZINC000515071262 943497783 /nfs/dbraw/zinc/49/77/83/943497783.db2.gz COPYXRQPWZQIHM-OCCSQVGLSA-N 0 0 374.828 3.512 20 5 FHBDRN Cn1cc([N+](=O)[O-])c(C(=O)N(Cc2ccc(Cl)cc2)c2ccccc2)n1 ZINC000504097058 943498755 /nfs/dbraw/zinc/49/87/55/943498755.db2.gz UGMLFDBYVVBRGT-UHFFFAOYSA-N 0 0 370.796 3.829 20 5 FHBDRN CCOC(=O)[C@@H]1CC[C@H](Nc2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)C1 ZINC000435584512 943503475 /nfs/dbraw/zinc/50/34/75/943503475.db2.gz MDHSYEDOHSCGJW-OLZOCXBDSA-N 0 0 350.415 3.916 20 5 FHBDRN O=C(c1cc2cc([N+](=O)[O-])ccc2o1)N1CC[C@H](COc2ccccc2)C1 ZINC000504126873 943506633 /nfs/dbraw/zinc/50/66/33/943506633.db2.gz DFLTWTYQPZTKER-AWEZNQCLSA-N 0 0 366.373 3.882 20 5 FHBDRN O=C(Nc1ccnn1-c1cccc(F)c1)[C@@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1 ZINC001269499001 943507077 /nfs/dbraw/zinc/50/70/77/943507077.db2.gz NBPGYVMSQYUHPO-IAGOWNOFSA-N 0 0 366.352 3.662 20 5 FHBDRN CCOC(=O)c1ccnc(N[C@@H]2C[C@H]2c2ccc(OCC)cc2)c1[N+](=O)[O-] ZINC000435578361 943511165 /nfs/dbraw/zinc/51/11/65/943511165.db2.gz XNNLTLRZOGWACJ-JKSUJKDBSA-N 0 0 371.393 3.533 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1)[C@H](NCc1nncn1-c1ccccc1)CCCC2 ZINC000417326101 943518260 /nfs/dbraw/zinc/51/82/60/943518260.db2.gz QZEIFXOOUWEMEF-LJQANCHMSA-N 0 0 363.421 3.733 20 5 FHBDRN CCOc1ccc(C(=O)Nc2cc(OC)c(C)c(OC)c2)cc1[N+](=O)[O-] ZINC000515147991 943524042 /nfs/dbraw/zinc/52/40/42/943524042.db2.gz QFNOHFOPKNHHIU-UHFFFAOYSA-N 0 0 360.366 3.571 20 5 FHBDRN O=C(Nc1cccc2c1CCO2)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000431938773 943527707 /nfs/dbraw/zinc/52/77/07/943527707.db2.gz NLMKDHKCVZDVDE-UHFFFAOYSA-N 0 0 365.292 3.775 20 5 FHBDRN O=C(Nc1cccc(F)c1Cl)N1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000515162252 943530300 /nfs/dbraw/zinc/53/03/00/943530300.db2.gz DFESZWDQNLRMTA-UHFFFAOYSA-N 0 0 365.748 3.814 20 5 FHBDRN CC(C)(C)Oc1cccc(CNC(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)n1 ZINC000504175339 943537030 /nfs/dbraw/zinc/53/70/30/943537030.db2.gz GBDIFONGICKKRT-UHFFFAOYSA-N 0 0 368.393 3.578 20 5 FHBDRN O=C1C[C@@H](Oc2cccc(N[C@@H]3CCCCc4ccc([N+](=O)[O-])cc43)c2)N1 ZINC000417358717 943538745 /nfs/dbraw/zinc/53/87/45/943538745.db2.gz IAJQRIFCYNGPCT-UYAOXDASSA-N 0 0 367.405 3.699 20 5 FHBDRN C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)CSc1ccc(F)c(F)c1 ZINC000504293144 943576649 /nfs/dbraw/zinc/57/66/49/943576649.db2.gz KMTKXRMQUHWDJY-SNVBAGLBSA-N 0 0 364.373 3.943 20 5 FHBDRN Cc1sc(C(=O)Nc2ccc3c(c2)C(=O)CC(C)(C)O3)cc1[N+](=O)[O-] ZINC000515226316 943582192 /nfs/dbraw/zinc/58/21/92/943582192.db2.gz QWEJGVYVOGBESP-UHFFFAOYSA-N 0 0 360.391 3.961 20 5 FHBDRN CCOc1ccccc1CCC(=O)N1c2ccc([N+](=O)[O-])cc2C[C@H]1C ZINC000504318421 943588753 /nfs/dbraw/zinc/58/87/53/943588753.db2.gz MJQRXVQUFWTIGT-CQSZACIVSA-N 0 0 354.406 3.904 20 5 FHBDRN CC[C@H](NC(=O)c1ccccc1)c1nc(-c2cc([N+](=O)[O-])c[nH]2)cs1 ZINC000434223930 943589912 /nfs/dbraw/zinc/58/99/12/943589912.db2.gz ZWYLHSYEELHQKM-ZDUSSCGKSA-N 0 0 356.407 3.928 20 5 FHBDRN CC(C)[C@H](NC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1)C(F)(F)F ZINC000417422043 943592730 /nfs/dbraw/zinc/59/27/30/943592730.db2.gz KCRVXASPNSVGJD-AWEZNQCLSA-N 0 0 359.348 3.856 20 5 FHBDRN Cc1cc(N[C@H]2CCCN(c3ccccc3Cl)C2=O)ncc1[N+](=O)[O-] ZINC000074766134 943594258 /nfs/dbraw/zinc/59/42/58/943594258.db2.gz JPSAHZLHLSAPCU-ZDUSSCGKSA-N 0 0 360.801 3.559 20 5 FHBDRN C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)CCCOc1ccccc1F ZINC000504387013 943617930 /nfs/dbraw/zinc/61/79/30/943617930.db2.gz FSKCUGKJXGCCQU-ZDUSSCGKSA-N 0 0 358.369 3.871 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCO[C@@H](C)C1 ZINC000504534363 943650028 /nfs/dbraw/zinc/65/00/28/943650028.db2.gz RGCPAZVSRMXJLB-QWHCGFSZSA-N 0 0 352.456 3.642 20 5 FHBDRN CCCCN(CCCC)C(=O)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000504538097 943661337 /nfs/dbraw/zinc/66/13/37/943661337.db2.gz GEAHRZLZAOUBMG-UHFFFAOYSA-N 0 0 358.442 3.887 20 5 FHBDRN CC(C)CC(CC(C)C)NC(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000504565891 943683251 /nfs/dbraw/zinc/68/32/51/943683251.db2.gz LODZSFVRQLYIER-UHFFFAOYSA-N 0 0 350.415 3.557 20 5 FHBDRN CCc1ccc2c(c1)[C@H](NC(=O)[C@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1)CCO2 ZINC001267861794 943697098 /nfs/dbraw/zinc/69/70/98/943697098.db2.gz PEKNDOWNKQHMLE-ZIFCJYIRSA-N 0 0 366.417 3.901 20 5 FHBDRN Cc1ccc(Sc2ccc(C[NH2+]C[C@H](C)C(=O)[O-])cc2[N+](=O)[O-])cc1 ZINC000417581578 943727752 /nfs/dbraw/zinc/72/77/52/943727752.db2.gz GOILCSIOTFKPOC-ZDUSSCGKSA-N 0 0 360.435 3.865 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1CO[C@H]1CCCc2c[nH]nc21 ZINC000424093945 943728575 /nfs/dbraw/zinc/72/85/75/943728575.db2.gz SNHRVRMMVFIQMH-ZDUSSCGKSA-N 0 0 352.188 3.675 20 5 FHBDRN CC(C)=CCSC[C@H]([NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1)C(=O)[O-] ZINC000417621858 943757156 /nfs/dbraw/zinc/75/71/56/943757156.db2.gz GNKBHSVNSBVTEX-INIZCTEOSA-N 0 0 366.483 3.960 20 5 FHBDRN COCCSc1ccc([C@H](C)NC(=O)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000504694568 943759336 /nfs/dbraw/zinc/75/93/36/943759336.db2.gz JGRORIKRFVKORT-AWEZNQCLSA-N 0 0 374.462 3.753 20 5 FHBDRN C[C@H](CCC(=O)[O-])[NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000417611983 943760074 /nfs/dbraw/zinc/76/00/74/943760074.db2.gz OQBWBUTWYASLGP-GFCCVEGCSA-N 0 0 362.357 3.869 20 5 FHBDRN C[C@@H](CCC(=O)[O-])[NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000417611984 943760168 /nfs/dbraw/zinc/76/01/68/943760168.db2.gz OQBWBUTWYASLGP-LBPRGKRZSA-N 0 0 362.357 3.869 20 5 FHBDRN CCC[C@@]1(C)CCCN(C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000437377672 943761279 /nfs/dbraw/zinc/76/12/79/943761279.db2.gz VNABHWURDSXONP-IBGZPJMESA-N 0 0 356.426 3.823 20 5 FHBDRN CCOC[C@H]1CCCN(Cc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000425409488 943761987 /nfs/dbraw/zinc/76/19/87/943761987.db2.gz WDVJVHXBTQPKSE-LBPRGKRZSA-N 0 0 357.248 3.606 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CC(C(F)(F)F)C2)nc1OCc1ccccc1 ZINC000516847966 943769230 /nfs/dbraw/zinc/76/92/30/943769230.db2.gz CAICRRMWBLWHDH-UHFFFAOYSA-N 0 0 353.300 3.567 20 5 FHBDRN O=C(NCCc1ccco1)c1cc(F)cc2c(=O)c3cccc(F)c3[nH]c12 ZINC000435818023 943774033 /nfs/dbraw/zinc/77/40/33/943774033.db2.gz QIXCFNGFPGIXAS-UHFFFAOYSA-N 0 0 368.339 3.525 20 5 FHBDRN COc1cccc(C(=O)NC[C@@H]2CCC[C@@H](C(F)(F)F)C2)c1[N+](=O)[O-] ZINC000435818625 943774037 /nfs/dbraw/zinc/77/40/37/943774037.db2.gz SVFMLGOQOOQYCU-GHMZBOCLSA-N 0 0 360.332 3.702 20 5 FHBDRN CC(=O)Nc1ccc(NC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)cc1 ZINC000435818867 943774516 /nfs/dbraw/zinc/77/45/16/943774516.db2.gz ONUKQVUVLTUWIY-UHFFFAOYSA-N 0 0 371.396 3.892 20 5 FHBDRN Cn1c2ccc([N+](=O)[O-])cc2nc1-c1cnn(Cc2ccc(F)cc2)c1 ZINC000435798864 943776145 /nfs/dbraw/zinc/77/61/45/943776145.db2.gz OFNXGTAWOLMXEX-UHFFFAOYSA-N 0 0 351.341 3.532 20 5 FHBDRN CC[C@@H](CSc1ccccc1)NC(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-] ZINC000504753528 943782905 /nfs/dbraw/zinc/78/29/05/943782905.db2.gz FOVYFGVNRVFIBK-LBPRGKRZSA-N 0 0 362.455 3.742 20 5 FHBDRN COc1ccc(C(=O)N[C@H]2C[C@H](c3cccc(Cl)c3)C2)cc1[N+](=O)[O-] ZINC000437414470 943787397 /nfs/dbraw/zinc/78/73/97/943787397.db2.gz VTXYAWSLQCRBAU-CTYIDZIISA-N 0 0 360.797 3.933 20 5 FHBDRN O=C(N[C@H]1CCc2ccccc2C1)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000435822922 943795879 /nfs/dbraw/zinc/79/58/79/943795879.db2.gz WLRFZIOKWQWLRF-SFHVURJKSA-N 0 0 368.436 3.969 20 5 FHBDRN Cc1c([N+](=O)[O-])cc(C(=O)N(Cc2ccccn2)C(C)(C)C)cc1[N+](=O)[O-] ZINC001269612166 943802429 /nfs/dbraw/zinc/80/24/29/943802429.db2.gz PLQAEGWPYIIVMF-UHFFFAOYSA-N 0 0 372.381 3.647 20 5 FHBDRN COc1cccc(C(=O)Nc2ccc3nn(C(C)C)cc3c2)c1[N+](=O)[O-] ZINC000435857768 943811993 /nfs/dbraw/zinc/81/19/93/943811993.db2.gz XTOYSGNQMOXMNA-UHFFFAOYSA-N 0 0 354.366 3.786 20 5 FHBDRN O=C([O-])CC[C@@H]1CCCC[N@@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000424266181 943814666 /nfs/dbraw/zinc/81/46/66/943814666.db2.gz WOUKSZQOGJSENU-HNNXBMFYSA-N 0 0 373.409 3.512 20 5 FHBDRN COCCN(C(=O)CSc1ccc([N+](=O)[O-])cc1)[C@@H](C)c1ccccc1 ZINC000515370566 943816374 /nfs/dbraw/zinc/81/63/74/943816374.db2.gz USWXLVIDXXLRHV-HNNXBMFYSA-N 0 0 374.462 3.923 20 5 FHBDRN CCOC(=O)c1sc([C@H](C)NCc2ccc([N+](=O)[O-])cc2F)nc1C ZINC000584866656 943828460 /nfs/dbraw/zinc/82/84/60/943828460.db2.gz SQSYCIHLLKECLH-JTQLQIEISA-N 0 0 367.402 3.526 20 5 FHBDRN COC1(CNC(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)CCC1 ZINC000504827412 943833432 /nfs/dbraw/zinc/83/34/32/943833432.db2.gz CSTBYPQLUUOXHH-UHFFFAOYSA-N 0 0 355.394 3.637 20 5 FHBDRN COC(=O)c1ccc(NCc2c(Cl)cccc2[N+](=O)[O-])c(OC)c1 ZINC000435895335 943845087 /nfs/dbraw/zinc/84/50/87/943845087.db2.gz YHGKCAWARDTXOQ-UHFFFAOYSA-N 0 0 350.758 3.656 20 5 FHBDRN COc1ccccc1SCC(=O)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000162465796 943846074 /nfs/dbraw/zinc/84/60/74/943846074.db2.gz WXKPAKFNXFBYNF-UHFFFAOYSA-N 0 0 358.419 3.675 20 5 FHBDRN O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1Nc1ccc(COCCO)cc1 ZINC000424311479 943855132 /nfs/dbraw/zinc/85/51/32/943855132.db2.gz FJSVWVFPAJOXFO-PXNSSMCTSA-N 0 0 370.449 3.927 20 5 FHBDRN C[C@H](NC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1)[C@@H]1CCCOC1 ZINC000504867538 943855845 /nfs/dbraw/zinc/85/58/45/943855845.db2.gz SCUAJNGBJATDPP-GOEBONIOSA-N 0 0 369.421 3.883 20 5 FHBDRN COc1cc(Cc2noc([C@H]3CCC[C@@H](F)C3)n2)c([N+](=O)[O-])c(OC)c1 ZINC000424355003 943861334 /nfs/dbraw/zinc/86/13/34/943861334.db2.gz IOURPLOOSZZYHL-CMPLNLGQSA-N 0 0 365.361 3.582 20 5 FHBDRN COc1cc(C(=O)NCCc2ccc(SC)cc2)cc([N+](=O)[O-])c1C ZINC000437500865 943864169 /nfs/dbraw/zinc/86/41/69/943864169.db2.gz WFDHSWLOVFUKPQ-UHFFFAOYSA-N 0 0 360.435 3.606 20 5 FHBDRN CC(C)N(CCc1nccs1)C(=O)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000162476011 943869903 /nfs/dbraw/zinc/86/99/03/943869903.db2.gz DTNGTTUKUKDFBK-UHFFFAOYSA-N 0 0 353.831 3.798 20 5 FHBDRN Cc1cc(Cc2noc(-c3ccc4c(c3)N(C)CC4)n2)ccc1[N+](=O)[O-] ZINC000435954058 943876443 /nfs/dbraw/zinc/87/64/43/943876443.db2.gz BQRSZMWXFJWUQR-UHFFFAOYSA-N 0 0 350.378 3.536 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN(C)CCCOc1ccccc1C ZINC000515437647 943888649 /nfs/dbraw/zinc/88/86/49/943888649.db2.gz KZDQWIHASRWEBX-UHFFFAOYSA-N 0 0 371.437 3.551 20 5 FHBDRN C[C@@H](c1ccc(Cl)cc1)N(C)C(=O)COc1cc(F)ccc1[N+](=O)[O-] ZINC000053367113 943889851 /nfs/dbraw/zinc/88/98/51/943889851.db2.gz YQFLLAJJDRFMCA-NSHDSACASA-N 0 0 366.776 3.986 20 5 FHBDRN CC(C)(C)[C@@H](Nc1nccc(C(N)=O)c1[N+](=O)[O-])c1ccc(F)cc1F ZINC000290757577 943893470 /nfs/dbraw/zinc/89/34/70/943893470.db2.gz JOTKGQNBBTWHMV-AWEZNQCLSA-N 0 0 364.352 3.566 20 5 FHBDRN C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)[C@H]1CCCOC1 ZINC000504919774 943897901 /nfs/dbraw/zinc/89/79/01/943897901.db2.gz QSUJUBCHGPXRBN-GJZGRUSLSA-N 0 0 370.405 3.932 20 5 FHBDRN C[C@H](Oc1ccc(Br)cc1)C(=O)Oc1cccc([N+](=O)[O-])c1 ZINC000014825289 943902834 /nfs/dbraw/zinc/90/28/34/943902834.db2.gz YJXAOXOZMISRBS-JTQLQIEISA-N 0 0 366.167 3.730 20 5 FHBDRN C[C@H](C(=O)NCCc1nc(C(C)(C)C)cs1)c1cccc([N+](=O)[O-])c1 ZINC000515450895 943906061 /nfs/dbraw/zinc/90/60/61/943906061.db2.gz IIPMGCMWXFQCPS-LBPRGKRZSA-N 0 0 361.467 3.811 20 5 FHBDRN O=C(NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)Nc1ccc2[nH]ccc2c1 ZINC000515477153 943916432 /nfs/dbraw/zinc/91/64/32/943916432.db2.gz SNTPWTZIFXTJNP-UHFFFAOYSA-N 0 0 363.377 3.922 20 5 FHBDRN CCOc1ccc([C@@H](C)NCc2nccn2CC(F)(F)F)cc1[N+](=O)[O-] ZINC000504927777 943924913 /nfs/dbraw/zinc/92/49/13/943924913.db2.gz UKWQNBPICMPRRO-LLVKDONJSA-N 0 0 372.347 3.603 20 5 FHBDRN C[C@@]12CCN(Cc3ccc(Br)cc3[N+](=O)[O-])C[C@@H]1C2(F)F ZINC000425443358 943932279 /nfs/dbraw/zinc/93/22/79/943932279.db2.gz JXHHOOYQKQPAIA-QWHCGFSZSA-N 0 0 361.186 3.834 20 5 FHBDRN Cn1c2ccccc2nc1[C@H]1CCCN1CCOc1ccc([N+](=O)[O-])cc1 ZINC000437592484 943935696 /nfs/dbraw/zinc/93/56/96/943935696.db2.gz LUEZZZFKMIHKBK-LJQANCHMSA-N 0 0 366.421 3.697 20 5 FHBDRN COc1cc(CNCC(F)(F)F)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000500002425 943936724 /nfs/dbraw/zinc/93/67/24/943936724.db2.gz MOLFAUMUAUSQER-UHFFFAOYSA-N 0 0 370.327 3.834 20 5 FHBDRN COc1cccc(C(=O)N[C@@H](C)c2ccc3ncsc3c2)c1[N+](=O)[O-] ZINC000436004993 943937454 /nfs/dbraw/zinc/93/74/54/943937454.db2.gz KUOJDOHWIGCBJH-JTQLQIEISA-N 0 0 357.391 3.704 20 5 FHBDRN CCN(Cc1cccc(Cl)c1)S(=O)(=O)c1cc([N+](=O)[O-])ccc1C ZINC000515514419 943946304 /nfs/dbraw/zinc/94/63/04/943946304.db2.gz YMXKWGACSWUCMH-UHFFFAOYSA-N 0 0 368.842 3.767 20 5 FHBDRN Cc1ccc(S(=O)(=O)N2CCC[C@H]2CCc2ccccc2)cc1[N+](=O)[O-] ZINC000515516444 943948933 /nfs/dbraw/zinc/94/89/33/943948933.db2.gz AXWVODIKVZWEKT-KRWDZBQOSA-N 0 0 374.462 3.689 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1CN1CCC[C@H]1[C@@H]1CCCO1 ZINC000425444419 943953366 /nfs/dbraw/zinc/95/33/66/943953366.db2.gz NOUKWSQAGZTQKY-ZFWWWQNUSA-N 0 0 355.232 3.501 20 5 FHBDRN CC(C)NC(=O)Nc1ccc(-c2nc(-c3cccc([N+](=O)[O-])c3)no2)cc1 ZINC000504995971 943963008 /nfs/dbraw/zinc/96/30/08/943963008.db2.gz IOPFEBQLUGVWJP-UHFFFAOYSA-N 0 0 367.365 3.842 20 5 FHBDRN CC(C)Cn1ncc2cc(-c3nc(-c4cccc([N+](=O)[O-])c4)no3)cnc21 ZINC000505008603 943965745 /nfs/dbraw/zinc/96/57/45/943965745.db2.gz IURRYIXVEXBDNC-UHFFFAOYSA-N 0 0 364.365 3.713 20 5 FHBDRN O=C(N[C@H]1C[C@@H]1c1ccccc1)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000436044033 943967862 /nfs/dbraw/zinc/96/78/62/943967862.db2.gz AWKGWVWQMUVAPY-QUCCMNQESA-N 0 0 354.409 3.967 20 5 FHBDRN Cc1nn(CC(=O)Nc2ccc([N+](=O)[O-])c(C)c2)cc1-c1ccccc1 ZINC000436045295 943969008 /nfs/dbraw/zinc/96/90/08/943969008.db2.gz YUUXNIBPUGORML-UHFFFAOYSA-N 0 0 350.378 3.714 20 5 FHBDRN COc1cc(NC(=O)c2cccc(OC)c2[N+](=O)[O-])ccc1OC(C)C ZINC000436046379 943969741 /nfs/dbraw/zinc/96/97/41/943969741.db2.gz YZRBIJKMGHNLCT-UHFFFAOYSA-N 0 0 360.366 3.652 20 5 FHBDRN Cc1ccc(NC(=O)c2c(C)ccc([N+](=O)[O-])c2C)cc1NC(=O)N(C)C ZINC001270048632 943973280 /nfs/dbraw/zinc/97/32/80/943973280.db2.gz XNGXFLVNWSAXNW-UHFFFAOYSA-N 0 0 370.409 3.866 20 5 FHBDRN CC(C)[C@@H](C)N(C)C(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000517083362 943978345 /nfs/dbraw/zinc/97/83/45/943978345.db2.gz QMMDFAGLXRZDOL-LLVKDONJSA-N 0 0 361.364 3.919 20 5 FHBDRN O=C(Nc1cccc(-c2nc(-c3cccc([N+](=O)[O-])c3)no2)c1)C1CC1 ZINC000505043465 943979292 /nfs/dbraw/zinc/97/92/92/943979292.db2.gz CUWRYZWLAPCHDT-UHFFFAOYSA-N 0 0 350.334 3.660 20 5 FHBDRN COc1ccc(-c2nc(-c3cccc([N+](=O)[O-])c3)no2)cc1OC(F)F ZINC000505037467 943994310 /nfs/dbraw/zinc/99/43/10/943994310.db2.gz CTYKEYVVNCBLBG-UHFFFAOYSA-N 0 0 363.276 3.922 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)NC1(c2ccc(Cl)cc2)CCOCC1 ZINC000505066727 944007987 /nfs/dbraw/zinc/00/79/87/944007987.db2.gz QGCWHXZZEJEKIQ-UHFFFAOYSA-N 0 0 374.824 3.992 20 5 FHBDRN Cc1ccc(F)c(CN(C)C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)c1 ZINC000436076265 944009983 /nfs/dbraw/zinc/00/99/83/944009983.db2.gz JETAJKSDQUKXJC-UHFFFAOYSA-N 0 0 368.368 3.500 20 5 FHBDRN C[N@H+](CCc1ccccc1O)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425457027 944013923 /nfs/dbraw/zinc/01/39/23/944013923.db2.gz KLQYGFOXOKLNCA-UHFFFAOYSA-N 0 0 365.227 3.737 20 5 FHBDRN O=[N+]([O-])c1cc(F)cc(-c2nc(Cc3cccc4cccnc43)no2)c1 ZINC000505071960 944014576 /nfs/dbraw/zinc/01/45/76/944014576.db2.gz YBPSVTTYCDAERF-UHFFFAOYSA-N 0 0 350.309 3.923 20 5 FHBDRN O=C(NCc1cc(F)ccc1F)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000517115703 944021832 /nfs/dbraw/zinc/02/18/32/944021832.db2.gz YCPYRKQYRYDTBI-UHFFFAOYSA-N 0 0 373.262 3.796 20 5 FHBDRN CC(C)Oc1ccccc1[C@@H](C)NC(=O)COc1ccccc1[N+](=O)[O-] ZINC000048463729 944024088 /nfs/dbraw/zinc/02/40/88/944024088.db2.gz DGLWTZLIASOMNH-CQSZACIVSA-N 0 0 358.394 3.638 20 5 FHBDRN CC(C)[C@H]1CCC[C@@H](NC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)C1 ZINC000505067580 944026835 /nfs/dbraw/zinc/02/68/35/944026835.db2.gz DCOPNVDURFBKMP-GOEBONIOSA-N 0 0 356.426 3.725 20 5 FHBDRN CCOc1ncccc1NC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000436095781 944027393 /nfs/dbraw/zinc/02/73/93/944027393.db2.gz CBMJSVLOOHCQEC-UHFFFAOYSA-N 0 0 359.385 3.727 20 5 FHBDRN O=C(NCc1ccsc1)c1cc(F)cc2c(=O)c3cccc(F)c3[nH]c12 ZINC000436097259 944028068 /nfs/dbraw/zinc/02/80/68/944028068.db2.gz IDVLIZFNKUBIEX-UHFFFAOYSA-N 0 0 370.380 3.951 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2noc(-c3cccc(OC[C@H]4CCCO4)c3)n2)cc1 ZINC000505088686 944029684 /nfs/dbraw/zinc/02/96/84/944029684.db2.gz BUXARVUWQYECCF-QGZVFWFLSA-N 0 0 367.361 3.870 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CCC[C@@H](Cc2ccccc2)C1 ZINC000436126753 944040136 /nfs/dbraw/zinc/04/01/36/944040136.db2.gz KDJSPFNCVMFDFX-SFHVURJKSA-N 0 0 367.449 3.796 20 5 FHBDRN CCc1cccc2c(C3CCN(c4c([N+](=O)[O-])ncn4C)CC3)c[nH]c21 ZINC000515607488 944042536 /nfs/dbraw/zinc/04/25/36/944042536.db2.gz QCWAMVVXRMERBP-UHFFFAOYSA-N 0 0 353.426 3.756 20 5 FHBDRN COc1ccc(C(=O)N(C)Cc2cc(C)c(OC)c(C)c2)cc1[N+](=O)[O-] ZINC000506106212 944043433 /nfs/dbraw/zinc/04/34/33/944043433.db2.gz MRBXSXUUTRRJFE-UHFFFAOYSA-N 0 0 358.394 3.501 20 5 FHBDRN O=C(NCCc1ccccc1[N+](=O)[O-])[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F ZINC000424692599 944050274 /nfs/dbraw/zinc/05/02/74/944050274.db2.gz NYDUFYZVIDUIMT-BGHVQYPCSA-N 0 0 370.371 3.868 20 5 FHBDRN CCCN(C(=O)c1cc2cc([N+](=O)[O-])ccc2s1)[C@H](C)C(=O)OCC ZINC000436338106 944051117 /nfs/dbraw/zinc/05/11/17/944051117.db2.gz FXPISSFJUVMUNR-LLVKDONJSA-N 0 0 364.423 3.613 20 5 FHBDRN C[C@H](NC(=O)N(C)Cc1ccccc1[N+](=O)[O-])[C@@H]1Oc2ccccc2[C@@H]1C ZINC000437720546 944052784 /nfs/dbraw/zinc/05/27/84/944052784.db2.gz BXLDANNSSIJBDS-CKFHNAJUSA-N 0 0 369.421 3.689 20 5 FHBDRN CCNc1ccc(C(=O)N(Cc2ccccc2OC)C2CC2)cc1[N+](=O)[O-] ZINC000515618584 944053432 /nfs/dbraw/zinc/05/34/32/944053432.db2.gz UPNITTCYDZJZCF-UHFFFAOYSA-N 0 0 369.421 3.840 20 5 FHBDRN CN(CC(F)(F)F)C(=O)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12 ZINC000436155326 944060243 /nfs/dbraw/zinc/06/02/43/944060243.db2.gz RVWDYNLDBYNDOG-UHFFFAOYSA-N 0 0 370.277 3.594 20 5 FHBDRN CC[C@H](C)[C@H](NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)C(F)(F)F ZINC000436166552 944069779 /nfs/dbraw/zinc/06/97/79/944069779.db2.gz CUTHLCOISMOCMS-VFZGTOFNSA-N 0 0 357.332 3.712 20 5 FHBDRN Cc1ccc(CNc2nc(C)cc(C)c2[N+](=O)[O-])c(-n2cc(Cl)cn2)n1 ZINC000468743367 944072808 /nfs/dbraw/zinc/07/28/08/944072808.db2.gz MAZGCOAKGXADIZ-UHFFFAOYSA-N 0 0 372.816 3.761 20 5 FHBDRN CCc1csc([C@H](C)Nc2c3ccccc3n(C)c(=O)c2[N+](=O)[O-])n1 ZINC000894341058 944073556 /nfs/dbraw/zinc/07/35/56/944073556.db2.gz LBFLDLRWECESAX-JTQLQIEISA-N 0 0 358.423 3.639 20 5 FHBDRN CCOc1cc(N2CC[C@](CO)(Cc3ccc(F)cc3)C2)ccc1[N+](=O)[O-] ZINC000517197571 944080500 /nfs/dbraw/zinc/08/05/00/944080500.db2.gz QPWGJBFQBMZWEC-FQEVSTJZSA-N 0 0 374.412 3.564 20 5 FHBDRN Cc1ccccc1OCCCN(C)C(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000515654924 944081037 /nfs/dbraw/zinc/08/10/37/944081037.db2.gz HAPCFKPYBCIPQH-UHFFFAOYSA-N 0 0 374.462 3.923 20 5 FHBDRN Cc1cc(N2CCCc3occc3C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000517197518 944081394 /nfs/dbraw/zinc/08/13/94/944081394.db2.gz OSRNJZQVYGLSJW-UHFFFAOYSA-N 0 0 350.378 3.906 20 5 FHBDRN CCN(C(=O)C(=O)Nc1cccc([N+](=O)[O-])c1C)[C@H](C)c1ccc(F)cc1 ZINC000517184838 944082487 /nfs/dbraw/zinc/08/24/87/944082487.db2.gz SFMPSZYIRUVQHP-CYBMUJFWSA-N 0 0 373.384 3.591 20 5 FHBDRN CO[C@]1(C)C[C@H](N(C)C(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1(C)C ZINC000437756624 944087606 /nfs/dbraw/zinc/08/76/06/944087606.db2.gz VGMQBCWFRZECPQ-XJKSGUPXSA-N 0 0 374.359 3.889 20 5 FHBDRN CO[C@H]1c2ccccc2C[C@H]1NC(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000412492525 944096236 /nfs/dbraw/zinc/09/62/36/944096236.db2.gz AQVVQLDPKJJDIZ-RZAIGCCYSA-N 0 0 372.446 3.504 20 5 FHBDRN Nc1cccc([N+](=O)[O-])c1C(=O)N1CCC(=Cc2ccccc2F)CC1 ZINC000500102961 944099573 /nfs/dbraw/zinc/09/95/73/944099573.db2.gz PYQGBZPAGJMERS-UHFFFAOYSA-N 0 0 355.369 3.636 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1C(=O)O[C@H](C)c1cn(-c2ccccc2)nn1 ZINC001269709655 944100895 /nfs/dbraw/zinc/10/08/95/944100895.db2.gz GUZMALUSLBHJPP-CQSZACIVSA-N 0 0 366.377 3.710 20 5 FHBDRN Cc1cc([N+](=O)[O-])cnc1Oc1ccc(Br)cc1[N+](=O)[O-] ZINC000092657642 944112322 /nfs/dbraw/zinc/11/23/22/944112322.db2.gz KAUITVGIHRDNFG-UHFFFAOYSA-N 0 0 354.116 3.761 20 5 FHBDRN CCCCCOc1cc(C)ccc1CNC(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000500118009 944124490 /nfs/dbraw/zinc/12/44/90/944124490.db2.gz YBNWNOYPOCHVOX-UHFFFAOYSA-N 0 0 371.437 3.984 20 5 FHBDRN CC[C@H](Cc1ccccc1C)C(=O)N1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000424803824 944127883 /nfs/dbraw/zinc/12/78/83/944127883.db2.gz DABKNFJDOISHDW-MRXNPFEDSA-N 0 0 370.453 3.532 20 5 FHBDRN CCCOc1ccc(NS(=O)(=O)c2cc([N+](=O)[O-])ccc2C)c(C)c1 ZINC000515695451 944137271 /nfs/dbraw/zinc/13/72/71/944137271.db2.gz BIPFJCBBNHTAHJ-UHFFFAOYSA-N 0 0 364.423 3.801 20 5 FHBDRN CCCN(Cc1c(F)cccc1[N+](=O)[O-])C[C@H]1COc2ccccc2O1 ZINC000505777579 944139718 /nfs/dbraw/zinc/13/97/18/944139718.db2.gz PVYRFWJYLWNACL-AWEZNQCLSA-N 0 0 360.385 3.786 20 5 FHBDRN Cc1c(CNC(=O)N2CCC(c3cccc(N)c3)CC2)cccc1[N+](=O)[O-] ZINC000418085681 944140361 /nfs/dbraw/zinc/14/03/61/944140361.db2.gz YKUOGYJIENRQNC-UHFFFAOYSA-N 0 0 368.437 3.575 20 5 FHBDRN Cc1ccccc1[C@@H](C)N(CC(C)C)C(=O)NCCn1cc([N+](=O)[O-])cn1 ZINC000500138053 944157134 /nfs/dbraw/zinc/15/71/34/944157134.db2.gz BRWYGSFPCJGCNY-MRXNPFEDSA-N 0 0 373.457 3.529 20 5 FHBDRN CCOc1cc(N2CCC[C@@H](c3nncn3C(C)C)C2)ccc1[N+](=O)[O-] ZINC000092655521 944166103 /nfs/dbraw/zinc/16/61/03/944166103.db2.gz VLEBENHKNHPPCB-CQSZACIVSA-N 0 0 359.430 3.550 20 5 FHBDRN CN(CCOc1ccccc1F)c1cc(C(F)(F)F)ncc1[N+](=O)[O-] ZINC000436270938 944170073 /nfs/dbraw/zinc/17/00/73/944170073.db2.gz CPMHWLOMSOBGLL-UHFFFAOYSA-N 0 0 359.279 3.663 20 5 FHBDRN Cc1ccccc1[C@H]1CCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1C ZINC000515756399 944184769 /nfs/dbraw/zinc/18/47/69/944184769.db2.gz BIWKJFXGWHZDKD-QGZVFWFLSA-N 0 0 360.435 3.737 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)F)cc1NCc1ccc(-n2cccn2)cc1 ZINC000436305293 944188505 /nfs/dbraw/zinc/18/85/05/944188505.db2.gz GDEPRKMOEAWEOW-UHFFFAOYSA-N 0 0 363.299 3.806 20 5 FHBDRN CCOc1cc(N(C)[C@H](C)c2ccc([S@](C)=O)cc2)ccc1[N+](=O)[O-] ZINC000092664053 944198887 /nfs/dbraw/zinc/19/88/87/944198887.db2.gz VBWRXZQQKXGFSB-YMXBGEKHSA-N 0 0 362.451 3.928 20 5 FHBDRN CC(C)[C@@H]1CCC[C@@H](NC(=O)c2cc3c(cc2[N+](=O)[O-])OCCCO3)C1 ZINC001125929076 944198928 /nfs/dbraw/zinc/19/89/28/944198928.db2.gz KAAFQZARYBKUKX-ZIAGYGMSSA-N 0 0 362.426 3.701 20 5 FHBDRN Cc1ccc(NC(=O)c2ccc(N3CCC(=O)[C@H](C)C3)c([N+](=O)[O-])c2)cc1 ZINC000436342084 944219317 /nfs/dbraw/zinc/21/93/17/944219317.db2.gz WNQLDMZEAZWKOY-CQSZACIVSA-N 0 0 367.405 3.571 20 5 FHBDRN COC[C@@H](NC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1)c1ccccc1 ZINC000436343781 944219688 /nfs/dbraw/zinc/21/96/88/944219688.db2.gz YRCFKNZFBQNWMZ-OAQYLSRUSA-N 0 0 372.424 3.799 20 5 FHBDRN CCCN(C(=O)C1=Cc2ccc(OC)cc2OC1)c1cccc([N+](=O)[O-])c1 ZINC001270288812 944232398 /nfs/dbraw/zinc/23/23/98/944232398.db2.gz LCHRWDZDCDLDAL-UHFFFAOYSA-N 0 0 368.389 3.822 20 5 FHBDRN Cc1ccc(-c2noc(-c3cc4nccnc4cc3F)n2)cc1[N+](=O)[O-] ZINC000517347721 944234900 /nfs/dbraw/zinc/23/49/00/944234900.db2.gz DADJDXWCQIDXCI-UHFFFAOYSA-N 0 0 351.297 3.703 20 5 FHBDRN CC(C)OC(=O)C[C@H]1CCCN(c2ccc([N+](=O)[O-])c(OC(F)F)c2)C1 ZINC000184194448 944235033 /nfs/dbraw/zinc/23/50/33/944235033.db2.gz GAMNBRGLTPRXER-GFCCVEGCSA-N 0 0 372.368 3.754 20 5 FHBDRN COC(=O)c1cc(NC(=O)[C@H]2C[C@H]2c2ccc(F)cc2)c(C)c([N+](=O)[O-])c1 ZINC000515817582 944237906 /nfs/dbraw/zinc/23/79/06/944237906.db2.gz ZPHPOCOGCUFXMW-GJZGRUSLSA-N 0 0 372.352 3.571 20 5 FHBDRN CN(Cc1ccoc1)C(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000518297600 944244541 /nfs/dbraw/zinc/24/45/41/944244541.db2.gz BOKFXNKEVNJMPV-UHFFFAOYSA-N 0 0 374.340 3.957 20 5 FHBDRN CCCc1ccc(-c2cc(NC(=O)c3ccc([N+](=O)[O-])n3C)n[nH]2)cc1 ZINC000515829670 944247470 /nfs/dbraw/zinc/24/74/70/944247470.db2.gz JMCJBYLDDCLLPJ-UHFFFAOYSA-N 0 0 353.382 3.528 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)F)cc1N1CCc2c(F)cc(F)cc2C1 ZINC000436381821 944250659 /nfs/dbraw/zinc/25/06/59/944250659.db2.gz ITVROAJWVQRMEP-UHFFFAOYSA-N 0 0 359.254 3.850 20 5 FHBDRN CCC[N@H+](CCc1cccc(F)c1)CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000500202037 944256994 /nfs/dbraw/zinc/25/69/94/944256994.db2.gz MVPZHISVBAUTLM-UHFFFAOYSA-N 0 0 373.428 3.936 20 5 FHBDRN C[S@@](=O)Cc1cccc(Nc2cc(C(F)(F)F)ncc2[N+](=O)[O-])c1 ZINC000436389789 944258477 /nfs/dbraw/zinc/25/84/77/944258477.db2.gz OGUCPKCLTUYMOX-XMMPIXPASA-N 0 0 359.329 3.631 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)F)cc1NCc1ccnc(OC2CCC2)c1 ZINC000436390832 944259190 /nfs/dbraw/zinc/25/91/90/944259190.db2.gz QLXGWFGJGWDJPB-UHFFFAOYSA-N 0 0 368.315 3.947 20 5 FHBDRN C[C@@H]1CC[C@H](C)N(C(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C1 ZINC000426261179 944259206 /nfs/dbraw/zinc/25/92/06/944259206.db2.gz OSCVCOZMJWVKDN-MNOVXSKESA-N 0 0 359.348 3.944 20 5 FHBDRN C[C@@H](Nc1cc(C(F)(F)F)ncc1[N+](=O)[O-])[C@H]1COc2ccccc21 ZINC000436392035 944263200 /nfs/dbraw/zinc/26/32/00/944263200.db2.gz PUVSOOHLENCDTD-MWLCHTKSSA-N 0 0 353.300 3.985 20 5 FHBDRN CC(C)(NC(=O)Cc1ccccc1[N+](=O)[O-])c1cccc(Cl)c1F ZINC000184207277 944272606 /nfs/dbraw/zinc/27/26/06/944272606.db2.gz QWSPHUKVDAUXQZ-UHFFFAOYSA-N 0 0 350.777 3.981 20 5 FHBDRN Cn1cnc2cc(NC(=O)c3cccc4c(=O)c5ccccc5[nH]c34)ccc21 ZINC000473708823 944274104 /nfs/dbraw/zinc/27/41/04/944274104.db2.gz CEKCLFDRYHHKHF-UHFFFAOYSA-N 0 0 368.396 3.820 20 5 FHBDRN CC(C)n1cc2c(n1)C[C@H](Nc1cc(C(F)(F)F)ncc1[N+](=O)[O-])CC2 ZINC000436400417 944277283 /nfs/dbraw/zinc/27/72/83/944277283.db2.gz JYWSVWUBELJZTC-LLVKDONJSA-N 0 0 369.347 3.755 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)F)cc1NCc1cccc2c1OCCCO2 ZINC000436401296 944278549 /nfs/dbraw/zinc/27/85/49/944278549.db2.gz UZECDOZURRVOTN-UHFFFAOYSA-N 0 0 369.299 3.782 20 5 FHBDRN CC(C)CCC1CCN(S(=O)(=O)c2cccc(F)c2[N+](=O)[O-])CC1 ZINC000759796121 944281046 /nfs/dbraw/zinc/28/10/46/944281046.db2.gz HDDXQJNFBRIBMC-UHFFFAOYSA-N 0 0 358.435 3.571 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)F)cc1Nc1ccc(O[C@H]2CCOC2)cc1 ZINC000436413742 944285301 /nfs/dbraw/zinc/28/53/01/944285301.db2.gz URLQDALROJRRCV-LBPRGKRZSA-N 0 0 369.299 3.920 20 5 FHBDRN C[C@H]1CC[C@@H](Oc2ncc(I)cc2[N+](=O)[O-])CC1 ZINC001226126402 944285366 /nfs/dbraw/zinc/28/53/66/944285366.db2.gz YPAVOBUFIAZHSF-WAAGHKOSSA-N 0 0 362.167 3.552 20 5 FHBDRN CC[C@@H]1[C@H](C)CCN1C(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000426265046 944285787 /nfs/dbraw/zinc/28/57/87/944285787.db2.gz SQTPNDWSDAVJCV-QMTHXVAHSA-N 0 0 359.348 3.944 20 5 FHBDRN C[C@]1(O)CCCC[C@H]1[C@H]1CCCN1C(=O)Nc1cc(F)cc([N+](=O)[O-])c1 ZINC000500224420 944290659 /nfs/dbraw/zinc/29/06/59/944290659.db2.gz RIEGOIGJVVBVFC-JZXOWHBKSA-N 0 0 365.405 3.671 20 5 FHBDRN C[C@H](c1ccccc1[N+](=O)[O-])N(C)[C@@H]1CCN(c2ccccc2F)C1=O ZINC000436423829 944296525 /nfs/dbraw/zinc/29/65/25/944296525.db2.gz AWKXFHNJLKFFNQ-FZKQIMNGSA-N 0 0 357.385 3.532 20 5 FHBDRN O=[N+]([O-])c1ccc(NCCc2cc(-c3ccncc3)n[nH]2)c2ncccc12 ZINC000436425356 944309887 /nfs/dbraw/zinc/30/98/87/944309887.db2.gz PRKLWQBJRTXTDZ-UHFFFAOYSA-N 0 0 360.377 3.583 20 5 FHBDRN O=C(NCC1CCCCCCC1)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000123250618 944312323 /nfs/dbraw/zinc/31/23/23/944312323.db2.gz LGJHEBFVXCNMAL-UHFFFAOYSA-N 0 0 367.833 3.663 20 5 FHBDRN CCCC(=O)Nc1cccc(CNC(=O)Nc2ccc([N+](=O)[O-])cc2C)c1 ZINC000162614537 944318475 /nfs/dbraw/zinc/31/84/75/944318475.db2.gz LVCUKCWAGXOUDW-UHFFFAOYSA-N 0 0 370.409 3.964 20 5 FHBDRN COc1cc(CN2CC[C@@H](O)[C@H]2c2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000425551080 944319035 /nfs/dbraw/zinc/31/90/35/944319035.db2.gz OGEUFRYUNDVXTC-SJLPKXTDSA-N 0 0 362.813 3.565 20 5 FHBDRN Cc1ccc([C@H]2CCN(C(=O)NCc3cccc([N+](=O)[O-])c3C)C2)cc1 ZINC000517461660 944320904 /nfs/dbraw/zinc/32/09/04/944320904.db2.gz FUWVLQSYXPJAJJ-SFHVURJKSA-N 0 0 353.422 3.911 20 5 FHBDRN Cc1cc(N2CCO[C@]3(CCSC3)C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000518367714 944321476 /nfs/dbraw/zinc/32/14/76/944321476.db2.gz LBZLXEZGDVHJFT-CQSZACIVSA-N 0 0 362.373 3.634 20 5 FHBDRN COc1ccc(CC(=O)N[C@@H](C)Cc2ccc(C)cc2C)cc1[N+](=O)[O-] ZINC000517485832 944329940 /nfs/dbraw/zinc/32/99/40/944329940.db2.gz ZGHDQGCAACMTAV-HNNXBMFYSA-N 0 0 356.422 3.510 20 5 FHBDRN O=[N+]([O-])c1ccc(OC[C@H](O)COc2cccc3ccccc32)c(F)c1 ZINC000550174774 944342930 /nfs/dbraw/zinc/34/29/30/944342930.db2.gz HJESAMVXWIQLGT-OAHLLOKOSA-N 0 0 357.337 3.706 20 5 FHBDRN O=C(Nc1nccc2sccc21)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000162626996 944343525 /nfs/dbraw/zinc/34/35/25/944343525.db2.gz GXBUOEURXITUCS-UHFFFAOYSA-N 0 0 365.374 3.643 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@@H](Cc1ccccc1)C(C)C ZINC000544125770 944346460 /nfs/dbraw/zinc/34/64/60/944346460.db2.gz RQBKBLUKGMXENI-SFHVURJKSA-N 0 0 356.422 3.735 20 5 FHBDRN COc1cc(CSCc2ncn(-c3ccccc3)n2)c([N+](=O)[O-])cc1F ZINC000184050731 944349779 /nfs/dbraw/zinc/34/97/79/944349779.db2.gz VHDVPQQUGBABHG-UHFFFAOYSA-N 0 0 374.397 3.757 20 5 FHBDRN O=C(CNC(=O)c1cc2ccccc2c2cccnc12)Nc1ccccc1 ZINC000515930417 944351617 /nfs/dbraw/zinc/35/16/17/944351617.db2.gz KMSSUBZKAUUBHH-UHFFFAOYSA-N 0 0 355.397 3.757 20 5 FHBDRN Cc1c([N+](=O)[O-])ccc(=O)n1Cc1ccc(OCc2ccc(F)cc2)cc1 ZINC000436475273 944356146 /nfs/dbraw/zinc/35/61/46/944356146.db2.gz UBEVDMOOHBGTIN-UHFFFAOYSA-N 0 0 368.364 3.831 20 5 FHBDRN CN(CCCCNC(=O)c1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1 ZINC000054167460 944356504 /nfs/dbraw/zinc/35/65/04/944356504.db2.gz JJGAVLKUVQTSBL-UHFFFAOYSA-N 0 0 361.829 3.895 20 5 FHBDRN CCO[C@@H](C)c1noc(CSCc2cc(OC)c(F)cc2[N+](=O)[O-])n1 ZINC000184048526 944357854 /nfs/dbraw/zinc/35/78/54/944357854.db2.gz XTIYZNWWAUCLID-VIFPVBQESA-N 0 0 371.390 3.656 20 5 FHBDRN C[C@]1(CNC(=O)C2(c3ccc([N+](=O)[O-])cc3)CCC2)CCOC2(CCC2)C1 ZINC000894652139 944363689 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944569992 /nfs/dbraw/zinc/56/99/92/944569992.db2.gz SSUBURQHHSPTLF-ZDUSSCGKSA-N 0 0 367.764 3.551 20 5 FHBDRN Cn1cc([N+](=O)[O-])cc1C(=O)NC(c1ccc(F)cc1)c1ccc(F)cc1 ZINC000516201256 944573221 /nfs/dbraw/zinc/57/32/21/944573221.db2.gz KHBFAGPGCKVPBU-UHFFFAOYSA-N 0 0 371.343 3.731 20 5 FHBDRN Cc1ccccc1OCCCNc1ccc([N+](=O)[O-])cc1C(=O)NC1CC1 ZINC000729470657 944578199 /nfs/dbraw/zinc/57/81/99/944578199.db2.gz PSIBZKQMXBULOX-UHFFFAOYSA-N 0 0 369.421 3.676 20 5 FHBDRN COc1ccc2c(c1)CCN(C(=O)c1cccc(SC)c1[N+](=O)[O-])CC2 ZINC000439387286 944578958 /nfs/dbraw/zinc/57/89/58/944578958.db2.gz YTGYKENCWQEOGF-UHFFFAOYSA-N 0 0 372.446 3.566 20 5 FHBDRN C[C@H](N(C)C(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])C1(C)CC1 ZINC000438435092 944601453 /nfs/dbraw/zinc/60/14/53/944601453.db2.gz DNTKYHGHCHZURT-JTQLQIEISA-N 0 0 360.332 3.797 20 5 FHBDRN CCOc1ccc(C(=O)Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)cc1 ZINC000103921005 944607671 /nfs/dbraw/zinc/60/76/71/944607671.db2.gz LIGMHFZNGULTDR-UHFFFAOYSA-N 0 0 351.362 3.740 20 5 FHBDRN Cc1ccccc1C(C)(C)NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000550262699 944621045 /nfs/dbraw/zinc/62/10/45/944621045.db2.gz OJKQZSOCFHPQLQ-UHFFFAOYSA-N 0 0 352.394 3.978 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N(C)[C@H]2CCC[C@@H](C)C2)cc1OC ZINC000031998952 944627674 /nfs/dbraw/zinc/62/76/74/944627674.db2.gz VAEUHSDTJTXKNU-OLZOCXBDSA-N 0 0 350.415 3.653 20 5 FHBDRN COc1cc(-c2noc(/C=C/c3ccc(F)cc3[N+](=O)[O-])n2)ccc1O ZINC000436787931 944634901 /nfs/dbraw/zinc/63/49/01/944634901.db2.gz ZVMDISHHAHCTJU-QPJJXVBHSA-N 0 0 357.297 3.669 20 5 FHBDRN COc1cc(-c2noc(-c3ccc(SC)c([N+](=O)[O-])c3)n2)ccc1O ZINC000436789572 944639987 /nfs/dbraw/zinc/63/99/87/944639987.db2.gz KYXKJAXMRILPPD-UHFFFAOYSA-N 0 0 359.363 3.748 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)N[C@@H]1CCCc2c(O)cccc21 ZINC000190262831 944658435 /nfs/dbraw/zinc/65/84/35/944658435.db2.gz ZUUPZZANNHJKRW-GOSISDBHSA-N 0 0 369.421 3.686 20 5 FHBDRN CN(C(=O)COc1ccc([N+](=O)[O-])cc1C(F)(F)F)C1CCCCC1 ZINC000516272435 944667560 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362.813 3.590 20 5 FHBDRN Cc1ccc(C[NH2+][C@H](C(=O)[O-])c2ccc(Cl)c(F)c2)cc1[N+](=O)[O-] ZINC000426729063 944736672 /nfs/dbraw/zinc/73/66/72/944736672.db2.gz ZPKZWUDEWVFGJW-HNNXBMFYSA-N 0 0 352.749 3.611 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)Nc1ccccc1O[C@@H](C)C(F)(F)F ZINC000516343279 944744302 /nfs/dbraw/zinc/74/43/02/944744302.db2.gz UVCDFBFZDFUADQ-JTQLQIEISA-N 0 0 369.299 3.880 20 5 FHBDRN C[C@@H](CCc1ccccc1)NS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000516341912 944744456 /nfs/dbraw/zinc/74/44/56/944744456.db2.gz DQRFQOMSTSFNEV-LBPRGKRZSA-N 0 0 368.842 3.548 20 5 FHBDRN COc1ccc(OC)c(/C=C/c2nc(-c3ccc([N+](=O)[O-])cc3)no2)c1 ZINC000545552913 944745272 /nfs/dbraw/zinc/74/52/72/944745272.db2.gz FGCOPWBJXLCAIP-BJMVGYQFSA-N 0 0 353.334 3.832 20 5 FHBDRN CC[C@@H]1CCC[C@@H](C[NH2+][C@@H](Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C(=O)[O-])C1 ZINC000426739409 944752395 /nfs/dbraw/zinc/75/23/95/944752395.db2.gz CBXMPGWDXSOLRM-LPMFXHHGSA-N 0 0 373.453 3.878 20 5 FHBDRN CC(C)c1ccc(C[NH2+][C@H](Cc2ccc(F)cc2)C(=O)[O-])cc1[N+](=O)[O-] ZINC000426743796 944757283 /nfs/dbraw/zinc/75/72/83/944757283.db2.gz BJDCHKOJNDUNQT-QGZVFWFLSA-N 0 0 360.385 3.643 20 5 FHBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1COc1ccc2c(c1)CN(C)C2=O ZINC000506925411 944757439 /nfs/dbraw/zinc/75/74/39/944757439.db2.gz IJYPTWGGJPEAAH-UHFFFAOYSA-N 0 0 356.378 3.547 20 5 FHBDRN Cc1ccc(C(=O)NC2CC2)cc1NCc1c(F)cc([N+](=O)[O-])cc1F ZINC000506271699 944761230 /nfs/dbraw/zinc/76/12/30/944761230.db2.gz XXRVGXCGDCKPCQ-UHFFFAOYSA-N 0 0 361.348 3.686 20 5 FHBDRN COc1ccc(-c2ccc(C[NH2+][C@H]3CCC[C@]3(C)C(=O)[O-])o2)c([N+](=O)[O-])c1 ZINC000426748954 944767719 /nfs/dbraw/zinc/76/77/19/944767719.db2.gz BJYDKJPDUZGBMN-HKUYNNGSSA-N 0 0 374.393 3.596 20 5 FHBDRN CSc1ccc(C(=O)NCCOc2ccc(C)cc2C)cc1[N+](=O)[O-] ZINC000015139595 944771979 /nfs/dbraw/zinc/77/19/79/944771979.db2.gz FCTHSLLZUWSWKD-UHFFFAOYSA-N 0 0 360.435 3.742 20 5 FHBDRN CC(C)Cn1cc(NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)cn1 ZINC000438562386 944773723 /nfs/dbraw/zinc/77/37/23/944773723.db2.gz HSSZBDFRGFUMME-UHFFFAOYSA-N 0 0 359.430 3.890 20 5 FHBDRN CC(C)[C@H](NC(=O)c1cc(F)cc([N+](=O)[O-])c1)c1nc2ccccc2[nH]1 ZINC000518799353 944793462 /nfs/dbraw/zinc/79/34/62/944793462.db2.gz XAAVPDHNGGPYOW-INIZCTEOSA-N 0 0 356.357 3.737 20 5 FHBDRN COc1ccccc1[C@H]([NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1)C(=O)[O-] ZINC000426784216 944801280 /nfs/dbraw/zinc/80/12/80/944801280.db2.gz PVISZWZCHVDNSH-SFHVURJKSA-N 0 0 358.394 3.642 20 5 FHBDRN COc1ccc(C2(NC(=O)[C@@H](C)Sc3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000518808082 944801842 /nfs/dbraw/zinc/80/18/42/944801842.db2.gz YLDXYKDUGARHQC-CYBMUJFWSA-N 0 0 372.446 3.890 20 5 FHBDRN CCCc1ccc(C(=O)Nc2ccnn2-c2ccc([N+](=O)[O-])cc2)cc1 ZINC000518815181 944809078 /nfs/dbraw/zinc/80/90/78/944809078.db2.gz ALKVSCRDEDOBBB-UHFFFAOYSA-N 0 0 350.378 3.985 20 5 FHBDRN COc1ccc(CC(=O)N(C)Cc2ccc(F)cc2Cl)cc1[N+](=O)[O-] ZINC000516391514 944811148 /nfs/dbraw/zinc/81/11/48/944811148.db2.gz FTLOJGKHOGXAOJ-UHFFFAOYSA-N 0 0 366.776 3.597 20 5 FHBDRN CCc1nc(Cc2noc(C(C)(C)c3ccccc3[N+](=O)[O-])n2)cs1 ZINC000426439597 944812871 /nfs/dbraw/zinc/81/28/71/944812871.db2.gz YSXUOEYAPLXWKG-UHFFFAOYSA-N 0 0 358.423 3.913 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)c1ccc2c(c1)CCCC2=O ZINC000500410604 944814323 /nfs/dbraw/zinc/81/43/23/944814323.db2.gz MZQGFLPLAIFUFA-UHFFFAOYSA-N 0 0 358.781 3.697 20 5 FHBDRN O=C(NCCOc1ccc([N+](=O)[O-])cc1)N1CCC[C@@H]1c1ccccc1 ZINC000518829088 944818239 /nfs/dbraw/zinc/81/82/39/944818239.db2.gz ZGKMHWQTRRELGA-GOSISDBHSA-N 0 0 355.394 3.520 20 5 FHBDRN O=C(COc1ccccc1[N+](=O)[O-])N1CCCc2cc(Cl)cc(F)c21 ZINC000518833354 944824649 /nfs/dbraw/zinc/82/46/49/944824649.db2.gz OELKZVUZINXRBA-UHFFFAOYSA-N 0 0 364.760 3.746 20 5 FHBDRN O=C([O-])[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1ccc(Cl)c(Cl)c1 ZINC000426808512 944829307 /nfs/dbraw/zinc/82/93/07/944829307.db2.gz MWDACGGGAOFWIK-AWEZNQCLSA-N 0 0 369.204 3.687 20 5 FHBDRN CCCC[C@H](CCC)CNC(=O)N1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000426077107 944837825 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Cc1csc(Sc2ccc(C(=O)NCC[C@@H](C)F)cc2[N+](=O)[O-])n1 ZINC000507031496 944879394 /nfs/dbraw/zinc/87/93/94/944879394.db2.gz KLKHRXKDZMDXGO-SECBINFHSA-N 0 0 369.443 3.989 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])Nc1cc(Br)ccc1F ZINC000110648808 944881362 /nfs/dbraw/zinc/88/13/62/944881362.db2.gz MHXHDIITAPPXFS-UHFFFAOYSA-N 0 0 353.147 3.678 20 5 FHBDRN CN(C)C(=O)c1cc(NCc2c(F)cc([N+](=O)[O-])cc2F)ccc1Cl ZINC000506311135 944881478 /nfs/dbraw/zinc/88/14/78/944881478.db2.gz RBUXTVJDAADFGB-UHFFFAOYSA-N 0 0 369.755 3.840 20 5 FHBDRN CC(C)COC[C@@H](Nc1nc2sccn2c1[N+](=O)[O-])c1ccco1 ZINC000507024030 944891397 /nfs/dbraw/zinc/89/13/97/944891397.db2.gz ZQARYRZQALMFGT-LLVKDONJSA-N 0 0 350.400 3.723 20 5 FHBDRN CC(C)(C)OC(=O)[C@H]1CCN(c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000426881086 944899946 /nfs/dbraw/zinc/89/99/46/944899946.db2.gz CJBKQVHMRRQDQQ-JTQLQIEISA-N 0 0 371.231 3.525 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCc1cccc(CO)c1 ZINC000506313733 944901273 /nfs/dbraw/zinc/90/12/73/944901273.db2.gz GKHASUYTTRDYGD-UHFFFAOYSA-N 0 0 360.435 3.519 20 5 FHBDRN COc1cccc(CCCNC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000431992640 944901898 /nfs/dbraw/zinc/90/18/98/944901898.db2.gz OSARSWMCQCOSDD-UHFFFAOYSA-N 0 0 371.437 3.771 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2[C@@H]3CCc4ccccc4[C@@H]32)c1 ZINC000120747219 944905060 /nfs/dbraw/zinc/90/50/60/944905060.db2.gz SVTODTDDDZMUTK-FHLIZLRMSA-N 0 0 354.431 3.775 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H](C)c1cccc(OC(F)F)c1 ZINC000426886130 944905642 /nfs/dbraw/zinc/90/56/42/944905642.db2.gz ITIOUWKUIXDUQS-SNVBAGLBSA-N 0 0 366.320 3.696 20 5 FHBDRN CC(C)(NC(=O)c1ccc([N+](=O)[O-])cc1)c1nc(C(F)(F)F)cs1 ZINC000073195435 944906452 /nfs/dbraw/zinc/90/64/52/944906452.db2.gz GHGIGQQVRRVZHI-UHFFFAOYSA-N 0 0 359.329 3.735 20 5 FHBDRN CC[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1OC)c1ccc(F)cc1F ZINC000426900230 944909870 /nfs/dbraw/zinc/90/98/70/944909870.db2.gz FANUXCJDMXHELI-OAHLLOKOSA-N 0 0 350.321 3.763 20 5 FHBDRN 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O=[N+]([O-])c1cc(F)c(CSCc2cn(-c3ccccc3)nn2)c(F)c1 ZINC000507086758 944944050 /nfs/dbraw/zinc/94/40/50/944944050.db2.gz OLBLYOUXFJEBHM-UHFFFAOYSA-N 0 0 362.361 3.887 20 5 FHBDRN CN(Cc1csc2ccccc12)C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000516495110 944944149 /nfs/dbraw/zinc/94/41/49/944944149.db2.gz GTXYVCBXGKMXPK-UHFFFAOYSA-N 0 0 370.386 3.810 20 5 FHBDRN Cc1cccc([C@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2)C(F)(F)F)c1 ZINC000511722447 944946234 /nfs/dbraw/zinc/94/62/34/944946234.db2.gz QBXCKOMAJQFKCG-INIZCTEOSA-N 0 0 352.312 3.866 20 5 FHBDRN COc1ccc(CN(C)Cc2csc([N+](=O)[O-])c2)cc1OC(F)F ZINC000054174659 944947173 /nfs/dbraw/zinc/94/71/73/944947173.db2.gz MJLCGVXXRGHGFP-UHFFFAOYSA-N 0 0 358.366 3.898 20 5 FHBDRN Cc1ccc(-c2nc(CC(=O)NCCc3ccc([N+](=O)[O-])cc3)cs2)o1 ZINC000054167736 944950736 /nfs/dbraw/zinc/95/07/36/944950736.db2.gz OQIVVRPSMCROLP-UHFFFAOYSA-N 0 0 371.418 3.521 20 5 FHBDRN CCO[C@@H]1C[C@H](N(C)C(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)C1(C)C ZINC001126450578 944951207 /nfs/dbraw/zinc/95/12/07/944951207.db2.gz DAPSFVJGXLMMIA-DLBZAZTESA-N 0 0 364.442 3.658 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)N1CCc2c1cc(F)cc2F ZINC000516502197 944952078 /nfs/dbraw/zinc/95/20/78/944952078.db2.gz XWLCKRJRRWPGBD-UHFFFAOYSA-N 0 0 361.348 3.654 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)NCC1CCC(F)(F)CC1 ZINC000506334207 944956576 /nfs/dbraw/zinc/95/65/76/944956576.db2.gz HNYHZPWFGIWBTQ-UHFFFAOYSA-N 0 0 355.385 3.729 20 5 FHBDRN CC(C)[C@@H]1OCCC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000437046995 944964445 /nfs/dbraw/zinc/96/44/45/944964445.db2.gz PFYYMTRIIFIBFU-ABAIWWIYSA-N 0 0 374.359 3.795 20 5 FHBDRN Cc1cc2c(cc1NC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])OCO2 ZINC000511734514 944966526 /nfs/dbraw/zinc/96/65/26/944966526.db2.gz HTWWLFHYNVSHML-UHFFFAOYSA-N 0 0 368.267 3.903 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)c1cc2ccc(Br)cc2[nH]1 ZINC000516529123 944980582 /nfs/dbraw/zinc/98/05/82/944980582.db2.gz OGMLVNFQSDZKIS-UHFFFAOYSA-N 0 0 374.194 3.769 20 5 FHBDRN O=[N+]([O-])c1cccc(CN(Cc2csc(-c3ncccn3)n2)C2CC2)c1 ZINC000507153815 945003007 /nfs/dbraw/zinc/00/30/07/945003007.db2.gz FHTYHHCIQKQKPZ-UHFFFAOYSA-N 0 0 367.434 3.673 20 5 FHBDRN C[C@H](C(=O)N[C@@]1(CO)C[C@H](C)CC(C)(C)C1)c1ccc([N+](=O)[O-])cc1F ZINC000546215070 945009731 /nfs/dbraw/zinc/00/97/31/945009731.db2.gz SULZDOVJUCXGAL-NQCMUKECSA-N 0 0 366.433 3.531 20 5 FHBDRN CCSc1nccnc1-c1noc(-c2cc3cc([N+](=O)[O-])ccc3o2)n1 ZINC000519007181 945024229 /nfs/dbraw/zinc/02/42/29/945024229.db2.gz JGJZJGUWGWRPIP-UHFFFAOYSA-N 0 0 369.362 3.960 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H](C)c1cc2cccc(F)c2o1 ZINC000427053929 945036378 /nfs/dbraw/zinc/03/63/78/945036378.db2.gz LWYJHVUQCGCCRY-JTQLQIEISA-N 0 0 358.325 3.980 20 5 FHBDRN O=C(NC[C@H](c1cccc(Cl)c1)N1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000106167705 945039956 /nfs/dbraw/zinc/03/99/56/945039956.db2.gz MRPAHOXMQYUTPK-GOSISDBHSA-N 0 0 373.840 3.815 20 5 FHBDRN COc1ccc(NC(=O)c2ccc([N+](=O)[O-])[nH]2)c(OCc2ccccc2)c1 ZINC000439868474 945042442 /nfs/dbraw/zinc/04/24/42/945042442.db2.gz FTUIISDRJWYKSA-UHFFFAOYSA-N 0 0 367.361 3.763 20 5 FHBDRN C[C@H](C(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)c1c(F)cccc1F ZINC000516598987 945042590 /nfs/dbraw/zinc/04/25/90/945042590.db2.gz QRFSHWXUOAPQOU-NSHDSACASA-N 0 0 373.359 3.817 20 5 FHBDRN CCc1c(C(=O)NCc2cccc([N+](=O)[O-])c2C)cnn1CCC(C)C ZINC000427058099 945044823 /nfs/dbraw/zinc/04/48/23/945044823.db2.gz XYTCPZQMTURIRS-UHFFFAOYSA-N 0 0 358.442 3.638 20 5 FHBDRN Cc1cc2c(cc1C)O[C@H](C(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1)C2 ZINC000437124206 945053528 /nfs/dbraw/zinc/05/35/28/945053528.db2.gz HGAIFLGHNUBLAN-FQEVSTJZSA-N 0 0 366.417 3.706 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1cnn(-c2ccc(Cl)cc2)c1 ZINC000427068593 945056155 /nfs/dbraw/zinc/05/61/55/945056155.db2.gz BDIYQBNZKYGTDS-UHFFFAOYSA-N 0 0 372.768 3.695 20 5 FHBDRN COC(=O)c1oc(CN(C)Cc2cc([N+](=O)[O-])ccc2Cl)cc1C ZINC000025946132 945058804 /nfs/dbraw/zinc/05/88/04/945058804.db2.gz CZJIGWBMJKIWTO-UHFFFAOYSA-N 0 0 352.774 3.568 20 5 FHBDRN O=C(Nc1ccnc(-c2ccccc2)n1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000126600495 945059954 /nfs/dbraw/zinc/05/99/54/945059954.db2.gz WAMKWYSARKJACB-UHFFFAOYSA-N 0 0 354.753 3.958 20 5 FHBDRN Cc1cccc(C(=O)Nc2nnc(Cc3ccc(F)cc3)s2)c1[N+](=O)[O-] ZINC000106703417 945370074 /nfs/dbraw/zinc/37/00/74/945370074.db2.gz CAXRFHAVDUURBU-UHFFFAOYSA-N 0 0 372.381 3.737 20 5 FHBDRN CN(Cc1ccc(OC(F)F)cc1)C(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000086991785 945373814 /nfs/dbraw/zinc/37/38/14/945373814.db2.gz YHYAMLZROQTLIM-UHFFFAOYSA-N 0 0 364.348 3.787 20 5 FHBDRN Cc1cn2c(nc(C)c2-c2noc(Cc3cccc([N+](=O)[O-])c3)n2)s1 ZINC000426626362 945377084 /nfs/dbraw/zinc/37/70/84/945377084.db2.gz VIGKBAMZNUWGMD-UHFFFAOYSA-N 0 0 355.379 3.562 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)Nc2ccc3oc(CC(C)(C)C)nc3c2)n1 ZINC000427449789 945388606 /nfs/dbraw/zinc/38/86/06/945388606.db2.gz QBUZRDJAYUWZGB-UHFFFAOYSA-N 0 0 371.397 3.793 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H]1CCCN(c2ccc(F)cc2C)C1 ZINC000522681034 945390705 /nfs/dbraw/zinc/39/07/05/945390705.db2.gz HLCJXCQLDLJTAF-MRXNPFEDSA-N 0 0 371.412 3.750 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1c(C)cccc1OC(F)F ZINC000427457492 945395989 /nfs/dbraw/zinc/39/59/89/945395989.db2.gz DRXPLEVVXAOPAL-UHFFFAOYSA-N 0 0 352.293 3.766 20 5 FHBDRN O=C(NCC[C@@H](O)c1ccccc1)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000198957988 945396846 /nfs/dbraw/zinc/39/68/46/945396846.db2.gz ZITSNTUFBGPHIH-HXUWFJFHSA-N 0 0 372.424 3.535 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NS(=O)(=O)CCc1cccc(Cl)c1 ZINC000506818808 945397521 /nfs/dbraw/zinc/39/75/21/945397521.db2.gz YKRMIGCLKFHCBN-UHFFFAOYSA-N 0 0 354.815 3.541 20 5 FHBDRN C[C@@H](c1ccc(F)cc1F)N1CCN(Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000507670825 945423907 /nfs/dbraw/zinc/42/39/07/945423907.db2.gz BJGILJUCNPOLDC-AWEZNQCLSA-N 0 0 361.392 3.752 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N(C)C[C@@H]1OCCc2ccccc21 ZINC000443974522 945441235 /nfs/dbraw/zinc/44/12/35/945441235.db2.gz VEBRAXQVXXSMME-SFHVURJKSA-N 0 0 369.421 3.989 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1OC(=O)Cc1coc(-c2ccc(F)cc2)n1 ZINC000760022522 945445409 /nfs/dbraw/zinc/44/54/09/945445409.db2.gz MIMAMOBSCLUMGZ-UHFFFAOYSA-N 0 0 356.309 3.845 20 5 FHBDRN C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000728810670 945447373 /nfs/dbraw/zinc/44/73/73/945447373.db2.gz BGPCIIXFMKVUTO-VIFPVBQESA-N 0 0 361.741 3.748 20 5 FHBDRN C[C@@H](N[C@H](CO)c1ccccc1OC(F)(F)F)c1ccccc1[N+](=O)[O-] ZINC000280894603 945453365 /nfs/dbraw/zinc/45/33/65/945453365.db2.gz FHIIFXDUZSKBGO-BXUZGUMPSA-N 0 0 370.327 3.878 20 5 FHBDRN C[C@@H](Cc1cccs1)NC(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000184386489 945454003 /nfs/dbraw/zinc/45/40/03/945454003.db2.gz QBYNRZTWXASWOL-JTQLQIEISA-N 0 0 353.831 3.740 20 5 FHBDRN C[C@H](CCC[NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1)C(=O)[O-] ZINC000426643839 945456299 /nfs/dbraw/zinc/45/62/99/945456299.db2.gz SUOWVGKKJJZFKO-OAHLLOKOSA-N 0 0 371.437 3.953 20 5 FHBDRN COc1ccc(CNC2(c3noc(C)n3)CCCCCC2)cc1[N+](=O)[O-] ZINC000507700564 945463493 /nfs/dbraw/zinc/46/34/93/945463493.db2.gz XPKLSVJWVCHESD-UHFFFAOYSA-N 0 0 360.414 3.634 20 5 FHBDRN CC(C)(C(=O)Nc1ccc2cc([N+](=O)[O-])ccc2n1)c1ccc(F)cc1 ZINC000426646779 945473281 /nfs/dbraw/zinc/47/32/81/945473281.db2.gz KYNIBHVVIOGTEB-UHFFFAOYSA-N 0 0 353.353 3.620 20 5 FHBDRN CN(Cc1ccc(F)cc1)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186003292 945483856 /nfs/dbraw/zinc/48/38/56/945483856.db2.gz LHCPPBJIPVTSRD-UHFFFAOYSA-N 0 0 351.765 3.729 20 5 FHBDRN C[C@H](c1ccccc1F)[S@@](=O)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000507714429 945488551 /nfs/dbraw/zinc/48/85/51/945488551.db2.gz PLCXHCKKCBDFJB-YDBLSZJJSA-N 0 0 364.398 3.572 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)c1ncsc1-c1ccccc1 ZINC000438058437 945489903 /nfs/dbraw/zinc/48/99/03/945489903.db2.gz XERDCPKJCWPDSC-UHFFFAOYSA-N 0 0 369.402 3.657 20 5 FHBDRN COc1ccc(-c2noc(-c3c[nH]c4cc([N+](=O)[O-])ccc43)n2)cc1OC ZINC000546232594 945489995 /nfs/dbraw/zinc/48/99/95/945489995.db2.gz GFEFKILJWBZVQJ-UHFFFAOYSA-N 0 0 366.333 3.810 20 5 FHBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)NC[C@H]1CCC(F)(F)C1 ZINC000280787515 945504245 /nfs/dbraw/zinc/50/42/45/945504245.db2.gz SWCGURCKVYTNCN-AWEZNQCLSA-N 0 0 370.399 3.706 20 5 FHBDRN COc1ccc(/C=C/C(=O)N2c3ccc([N+](=O)[O-])cc3C[C@H]2C)cc1OC ZINC000728811220 945510805 /nfs/dbraw/zinc/51/08/05/945510805.db2.gz JJDCLFDJRGZSRS-OMDQHUAHSA-N 0 0 368.389 3.603 20 5 FHBDRN Cc1ccc(C(=O)NCc2ccnc(N3CCCCCC3)c2)cc1[N+](=O)[O-] ZINC000107178532 945511107 /nfs/dbraw/zinc/51/11/07/945511107.db2.gz BRAWWAUPBOZKOO-UHFFFAOYSA-N 0 0 368.437 3.609 20 5 FHBDRN Cc1ccc(O[C@@H](C)CNC(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)cc1 ZINC001126486384 945514202 /nfs/dbraw/zinc/51/42/02/945514202.db2.gz XPMOPTXWNVPVPE-HNNXBMFYSA-N 0 0 372.421 3.888 20 5 FHBDRN CC(C)CN(C)c1nnc(-c2cccc([N+](=O)[O-])c2)n1C[C@H]1CCCCO1 ZINC000550034697 945521361 /nfs/dbraw/zinc/52/13/61/945521361.db2.gz UYHXMRVRZGNFLI-QGZVFWFLSA-N 0 0 373.457 3.515 20 5 FHBDRN Cc1cn([C@@H](C)c2nc(-c3cccc(C(F)(F)F)c3)no2)nc1[N+](=O)[O-] ZINC000281162113 945546154 /nfs/dbraw/zinc/54/61/54/945546154.db2.gz LNURGBKETPJQFB-VIFPVBQESA-N 0 0 367.287 3.778 20 5 FHBDRN Cc1cn([C@H](C)c2nc(-c3cccc(C(F)(F)F)c3)no2)nc1[N+](=O)[O-] ZINC000281162107 945546291 /nfs/dbraw/zinc/54/62/91/945546291.db2.gz LNURGBKETPJQFB-SECBINFHSA-N 0 0 367.287 3.778 20 5 FHBDRN COc1cc(Cc2noc(CCC3CCCC3)n2)c([N+](=O)[O-])c(OC)c1 ZINC000519520221 945549800 /nfs/dbraw/zinc/54/98/00/945549800.db2.gz WKXWXNSVHQTMAW-UHFFFAOYSA-N 0 0 361.398 3.709 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CCCC[C@@H]1c1ccnn1C ZINC000281220385 945558187 /nfs/dbraw/zinc/55/81/87/945558187.db2.gz BKVNWCGSUSUAKN-MRXNPFEDSA-N 0 0 357.414 3.704 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)c1cccc(NC(=O)C2CC2)c1 ZINC000281240190 945573670 /nfs/dbraw/zinc/57/36/70/945573670.db2.gz FNLKMTOEDLCPHW-UHFFFAOYSA-N 0 0 369.377 3.594 20 5 FHBDRN O=[N+]([O-])c1cncc(Br)c1N[C@@H]1CCOC2(CCCC2)C1 ZINC000301911107 945579280 /nfs/dbraw/zinc/57/92/80/945579280.db2.gz GJGLJQOZCAAXFC-SNVBAGLBSA-N 0 0 356.220 3.656 20 5 FHBDRN C[C@H](SCC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C(=O)OC(C)(C)C ZINC000281310273 945586366 /nfs/dbraw/zinc/58/63/66/945586366.db2.gz ZCWFTSRVHQWDDC-VIFPVBQESA-N 0 0 374.846 3.650 20 5 FHBDRN O=C(CCc1ccc([N+](=O)[O-])cc1Cl)NC[C@H]1OCCc2ccccc21 ZINC001126015136 945613146 /nfs/dbraw/zinc/61/31/46/945613146.db2.gz FRZIVPSIGZMWBW-GOSISDBHSA-N 0 0 374.824 3.611 20 5 FHBDRN CCCCc1ccc(N(C)C[C@H](O)COc2ccccc2[N+](=O)[O-])cc1 ZINC001167968544 945613226 /nfs/dbraw/zinc/61/32/26/945613226.db2.gz WNAQWSQPCHJQRD-SFHVURJKSA-N 0 0 358.438 3.814 20 5 FHBDRN C[C@@H]1CC[C@H](O)[C@@H]([C@H]2CCCN2C(=O)c2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000281391751 945620589 /nfs/dbraw/zinc/62/05/89/945620589.db2.gz MXWQWFQIYWXVRN-PREXVCJDSA-N 0 0 366.845 3.650 20 5 FHBDRN CCC(=O)c1ccc(N[C@H]2CCCO[C@@H]2c2nccn2CC)c([N+](=O)[O-])c1 ZINC000281407508 945625242 /nfs/dbraw/zinc/62/52/42/945625242.db2.gz HLVPQRJXJXRCHH-YJBOKZPZSA-N 0 0 372.425 3.736 20 5 FHBDRN CC(C)(C(=O)Nc1ccc(O[C@@H]2CCOC2)cc1)c1ccccc1[N+](=O)[O-] ZINC000519664065 945636125 /nfs/dbraw/zinc/63/61/25/945636125.db2.gz YNDNDRVBRWDLSA-MRXNPFEDSA-N 0 0 370.405 3.679 20 5 FHBDRN C[C@H]1Sc2ccccc2N(S(=O)(=O)c2ccc([N+](=O)[O-])s2)[C@H]1C ZINC000123879268 945641033 /nfs/dbraw/zinc/64/10/33/945641033.db2.gz LEYVMWINSPBGHY-VHSXEESVSA-N 0 0 370.477 3.734 20 5 FHBDRN CCn1ccnc1[C@@H]1CCCCN1C(=O)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000281446428 945644600 /nfs/dbraw/zinc/64/46/00/945644600.db2.gz BCQJVEJEKMEGGH-HNNXBMFYSA-N 0 0 362.817 3.832 20 5 FHBDRN O=C(Nc1cc(F)ccc1OC[C@@H]1CCCO1)c1ccccc1[N+](=O)[O-] ZINC000107499081 945644914 /nfs/dbraw/zinc/64/49/14/945644914.db2.gz IRDOJZVQFLQDSJ-ZDUSSCGKSA-N 0 0 360.341 3.544 20 5 FHBDRN COC[C@H](C)Nc1ccccc1NC(=O)Cc1cccc([N+](=O)[O-])c1C ZINC000281498894 945665053 /nfs/dbraw/zinc/66/50/53/945665053.db2.gz QMYBYEAJXHPDEN-ZDUSSCGKSA-N 0 0 357.410 3.531 20 5 FHBDRN COc1cc(-c2noc(CSc3ccc([N+](=O)[O-])cc3)n2)cc(C)n1 ZINC000550064479 945670652 /nfs/dbraw/zinc/67/06/52/945670652.db2.gz MGEPCFKTNQDJMK-UHFFFAOYSA-N 0 0 358.379 3.649 20 5 FHBDRN Cc1c(C(=O)N2CCCC[C@@H]2C2CCC2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000843743314 945682361 /nfs/dbraw/zinc/68/23/61/945682361.db2.gz LTBRDZVQCWDPHV-OAHLLOKOSA-N 0 0 361.398 3.915 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(Cc2noc(CCc3ccc(C)s3)n2)c1 ZINC000519728715 945683626 /nfs/dbraw/zinc/68/36/26/945683626.db2.gz DGGCRVIBXJWSEH-UHFFFAOYSA-N 0 0 359.407 3.732 20 5 FHBDRN COCC[C@@H](C)NC(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000522708841 945702505 /nfs/dbraw/zinc/70/25/05/945702505.db2.gz LTXVYPAXEKRTLB-CYBMUJFWSA-N 0 0 359.382 3.934 20 5 FHBDRN C[C@H](C(=O)Nc1ccc(-n2ccnc2)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000519739726 945704549 /nfs/dbraw/zinc/70/45/49/945704549.db2.gz AJTUEENXNWKGBB-LBPRGKRZSA-N 0 0 354.341 3.662 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])o1)N1CCC[C@H]1c1ccccc1Br ZINC000133828268 945712196 /nfs/dbraw/zinc/71/21/96/945712196.db2.gz MGOBGBMDVDLJOL-LBPRGKRZSA-N 0 0 365.183 3.928 20 5 FHBDRN Cc1cc([C@@H]2CCCN2c2cc(C)nc(-c3ccc([N+](=O)[O-])cc3)n2)no1 ZINC000140916935 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FHBDRN COc1ccc(Cc2nc(-c3cccc4occc43)no2)c([N+](=O)[O-])c1 ZINC001211851571 945764711 /nfs/dbraw/zinc/76/47/11/945764711.db2.gz GFROALLWZAWUOY-UHFFFAOYSA-N 0 0 351.318 3.990 20 5 FHBDRN COc1ccc(OC)c(-c2noc([C@H](C)c3cccc([N+](=O)[O-])c3)n2)c1 ZINC000519788426 945766045 /nfs/dbraw/zinc/76/60/45/945766045.db2.gz XOFKUWAZOZLUQP-LLVKDONJSA-N 0 0 355.350 3.814 20 5 FHBDRN CCOC1CN(C(=O)c2cc([N+](=O)[O-])ccc2SCC2CCCC2)C1 ZINC000519812218 945777427 /nfs/dbraw/zinc/77/74/27/945777427.db2.gz CBLRUNVNZVICAL-UHFFFAOYSA-N 0 0 364.467 3.738 20 5 FHBDRN CC(C)C[C@H](NC(=O)COc1ccc(C=O)cc1[N+](=O)[O-])c1ccccc1 ZINC000007434940 945785606 /nfs/dbraw/zinc/78/56/06/945785606.db2.gz WAUUEPKTKAZYAB-KRWDZBQOSA-N 0 0 370.405 3.690 20 5 FHBDRN O=C(NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)N[C@@H]1CCCc2occc21 ZINC000519841546 945809806 /nfs/dbraw/zinc/80/98/06/945809806.db2.gz JPIQYOKTDSXECD-QGZVFWFLSA-N 0 0 368.393 3.588 20 5 FHBDRN CCCOc1ccc([C@H](C)NC(=O)c2ccccc2[N+](=O)[O-])cc1OC ZINC000044739286 945810439 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CCn1nc(C)c(NC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)c1C ZINC000444095654 945855994 /nfs/dbraw/zinc/85/59/94/945855994.db2.gz MLCYQLNAQFVDJN-UHFFFAOYSA-N 0 0 360.417 3.767 20 5 FHBDRN CCCN([C@H]1CCc2ccccc21)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000519891778 945862286 /nfs/dbraw/zinc/86/22/86/945862286.db2.gz RZLBAXLXAJRVNK-SFHVURJKSA-N 0 0 360.435 3.683 20 5 FHBDRN COCCC1(C(=O)Nc2cc(-c3cccc([N+](=O)[O-])c3)[nH]n2)CCCC1 ZINC000129429713 945866742 /nfs/dbraw/zinc/86/67/42/945866742.db2.gz IFWMQYYCSKBRJD-UHFFFAOYSA-N 0 0 358.398 3.520 20 5 FHBDRN Cc1cc(F)cc(C(=O)N2CCC3(CC2)OCc2ccccc23)c1[N+](=O)[O-] ZINC000760097597 945867707 /nfs/dbraw/zinc/86/77/07/945867707.db2.gz RHRXOOQMEMZZBE-UHFFFAOYSA-N 0 0 370.380 3.704 20 5 FHBDRN CCc1cccc2c1N(S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-])CC2 ZINC000519910438 945878131 /nfs/dbraw/zinc/87/81/31/945878131.db2.gz YVMNLLGYZBRRSS-UHFFFAOYSA-N 0 0 360.435 3.525 20 5 FHBDRN COc1ccccc1[C@H](C)Sc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000463066969 945881769 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C[C@@H](NC(=O)NCc1ccccc1[N+](=O)[O-])c1cccc(OC(F)F)c1 ZINC000045624162 946089108 /nfs/dbraw/zinc/08/91/08/946089108.db2.gz JVRZMPXKDZMUQE-LLVKDONJSA-N 0 0 365.336 3.757 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCN(Cc3ccccc3)CC2)c(OC(F)F)c1 ZINC000302044120 946093321 /nfs/dbraw/zinc/09/33/21/946093321.db2.gz JOEYNXUHMJOTLV-UHFFFAOYSA-N 0 0 363.364 3.518 20 5 FHBDRN CC(C)[C@H](Sc1ncccc1[N+](=O)[O-])C(=O)N1CCc2ccccc2C1 ZINC000520085918 946098873 /nfs/dbraw/zinc/09/88/73/946098873.db2.gz KMUGYMHRXWIKBL-KRWDZBQOSA-N 0 0 371.462 3.691 20 5 FHBDRN COC(=O)c1cc(NC(=O)c2cc3cccc(C)c3o2)cc([N+](=O)[O-])c1 ZINC000522918857 946101171 /nfs/dbraw/zinc/10/11/71/946101171.db2.gz ZHIMBIKMDFHIKH-UHFFFAOYSA-N 0 0 354.318 3.688 20 5 FHBDRN C[C@@H](C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2)c1ccccc1F ZINC000108959599 946107389 /nfs/dbraw/zinc/10/73/89/946107389.db2.gz PGYQVPGQMZZAMI-LLVKDONJSA-N 0 0 360.341 3.637 20 5 FHBDRN COc1ccc(/C=C\C(=O)O[C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1OC ZINC000066877950 946119619 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363.414 3.561 20 5 FHBDRN COc1cccc(C(=O)N2CC(Cc3ccccc3Cl)C2)c1[N+](=O)[O-] ZINC000444292659 946171184 /nfs/dbraw/zinc/17/11/84/946171184.db2.gz KPFNLGDQUXNKAX-UHFFFAOYSA-N 0 0 360.797 3.572 20 5 FHBDRN O=C(NCc1ccc(Cl)cn1)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000444284886 946175011 /nfs/dbraw/zinc/17/50/11/946175011.db2.gz GJQMOCAHHVPULH-UHFFFAOYSA-N 0 0 363.804 3.660 20 5 FHBDRN COc1cc(F)ccc1N[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000045821264 946176767 /nfs/dbraw/zinc/17/67/67/946176767.db2.gz VSIWOMSMTPEFDN-SNVBAGLBSA-N 0 0 358.329 3.966 20 5 FHBDRN C[C@]1(F)CCN(C(=O)c2cc(F)cc3c(=O)c4cccc(F)c4[nH]c23)C1 ZINC000444287326 946178149 /nfs/dbraw/zinc/17/81/49/946178149.db2.gz JSXULWCCJVQFLC-IBGZPJMESA-N 0 0 360.335 3.534 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCCCC[C@@H]1c1ccco1 ZINC000121244653 946178868 /nfs/dbraw/zinc/17/88/68/946178868.db2.gz NPXUTJYQQQNTQU-MRXNPFEDSA-N 0 0 373.409 3.752 20 5 FHBDRN CCC1(CC)[C@H](NC(=O)c2cc(SC)ccc2[N+](=O)[O-])C[C@@H]1OC ZINC000151877803 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CCOc1cc(C(=O)N(C)c2cccc(C)c2C)c([N+](=O)[O-])cc1OC ZINC000079184091 946414014 /nfs/dbraw/zinc/41/40/14/946414014.db2.gz AWPPFYNXEYUECQ-UHFFFAOYSA-N 0 0 358.394 3.896 20 5 FHBDRN C[C@](CO)(NC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)C1CCCCC1 ZINC000444320877 946424437 /nfs/dbraw/zinc/42/44/37/946424437.db2.gz USTZUDJOICCEQG-MRXNPFEDSA-N 0 0 374.359 3.675 20 5 FHBDRN CCc1n[nH]c(C(=O)N2CCC[C@H]2c2ccc(C(C)C)cc2)c1[N+](=O)[O-] ZINC000444322839 946436921 /nfs/dbraw/zinc/43/69/21/946436921.db2.gz VUIJBPNCNDDTSF-INIZCTEOSA-N 0 0 356.426 3.981 20 5 FHBDRN COC1(C)CCN(C(=O)c2cc(F)c(Cl)c([N+](=O)[O-])c2Cl)CC1 ZINC000897305966 946437810 /nfs/dbraw/zinc/43/78/10/946437810.db2.gz KFUXONKSIXPYEZ-UHFFFAOYSA-N 0 0 365.188 3.682 20 5 FHBDRN CCc1cccc2c(CCNC(=O)NCc3ccccc3[N+](=O)[O-])c[nH]c21 ZINC000111458567 946466633 /nfs/dbraw/zinc/46/66/33/946466633.db2.gz XIYMNNAHUNFDSB-UHFFFAOYSA-N 0 0 366.421 3.680 20 5 FHBDRN CCN(Cc1ccc(OC)cc1)C(=O)c1cccc(SC)c1[N+](=O)[O-] ZINC000186100333 946468544 /nfs/dbraw/zinc/46/85/44/946468544.db2.gz MPKVHDAHHJATSY-UHFFFAOYSA-N 0 0 360.435 3.988 20 5 FHBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)N[C@H]1C[C@@H]1c1ccccc1 ZINC000067513801 946502032 /nfs/dbraw/zinc/50/20/32/946502032.db2.gz LPHYGECHCRCGCL-UXHICEINSA-N 0 0 368.436 3.827 20 5 FHBDRN COCCOc1ccc(-c2noc(-c3ccc([N+](=O)[O-])s3)n2)cc1F ZINC000545744313 946502860 /nfs/dbraw/zinc/50/28/60/946502860.db2.gz GUKCYUGGTLKBHN-UHFFFAOYSA-N 0 0 365.342 3.538 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCC(n3cc(Cl)cn3)CC2)c2ncccc12 ZINC000302016695 946505071 /nfs/dbraw/zinc/50/50/71/946505071.db2.gz FVYUJMDGTXOFEA-UHFFFAOYSA-N 0 0 357.801 3.834 20 5 FHBDRN CCOC(=O)c1cc(C(=O)NCC[C@@H]2CCCC[C@H]2C)cc([N+](=O)[O-])c1 ZINC001126127449 946507482 /nfs/dbraw/zinc/50/74/82/946507482.db2.gz RQDXDQKWEVUWCT-KGLIPLIRSA-N 0 0 362.426 3.718 20 5 FHBDRN CC[C@@H](C)[C@H](O)CNC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 ZINC000475151810 946509392 /nfs/dbraw/zinc/50/93/92/946509392.db2.gz ZXYRRUURUIDCCJ-CXAGYDPISA-N 0 0 358.394 3.524 20 5 FHBDRN CSc1cccc(C(=O)N(CC(C)C)CC(F)(F)F)c1[N+](=O)[O-] ZINC000186145108 946516771 /nfs/dbraw/zinc/51/67/71/946516771.db2.gz PYRXWYWFZRHQMA-UHFFFAOYSA-N 0 0 350.362 3.977 20 5 FHBDRN CCN(CC)c1ccc(NC(=O)c2cccc(SC)c2[N+](=O)[O-])cn1 ZINC000186150786 946517594 /nfs/dbraw/zinc/51/75/94/946517594.db2.gz OKLWIBWONQKMHZ-UHFFFAOYSA-N 0 0 360.439 3.810 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N2CCSC[C@@H]2c2ccc(C)cc2)c1 ZINC000609700321 946523971 /nfs/dbraw/zinc/52/39/71/946523971.db2.gz VRFQLTHJZODDOZ-GOSISDBHSA-N 0 0 372.446 3.842 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)C(=O)N1CCCC12CCCCC2 ZINC000441380839 946535541 /nfs/dbraw/zinc/53/55/41/946535541.db2.gz GMJHOTLLXMRNLI-UHFFFAOYSA-N 0 0 365.817 3.512 20 5 FHBDRN C[C@@H](CNC(=O)N1CCC[C@]2(CC2(F)F)C1)c1ccccc1[N+](=O)[O-] ZINC000897052147 946537756 /nfs/dbraw/zinc/53/77/56/946537756.db2.gz IZZMNCYLLUTUEP-LRDDRELGSA-N 0 0 353.369 3.529 20 5 FHBDRN Cc1csc([C@H]2CCN(C(=O)NC[C@@H](C)c3ccccc3[N+](=O)[O-])C2)n1 ZINC000897049989 946549525 /nfs/dbraw/zinc/54/95/25/946549525.db2.gz LWYYEILBGDATGB-OCCSQVGLSA-N 0 0 374.466 3.662 20 5 FHBDRN C[C@H](CNC(=O)N1CCC[C@H]1c1cccn1C)c1ccccc1[N+](=O)[O-] ZINC000897074265 946553049 /nfs/dbraw/zinc/55/30/49/946553049.db2.gz CJSJTBUMPHCLBO-KDOFPFPSSA-N 0 0 356.426 3.584 20 5 FHBDRN COc1cc(F)ccc1NC(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000025796906 946558346 /nfs/dbraw/zinc/55/83/46/946558346.db2.gz CRQKEASGFFSJIY-JTQLQIEISA-N 0 0 350.371 3.862 20 5 FHBDRN Cc1cccc([C@H]2CCCN2C(=O)NC[C@H](C)c2ccccc2[N+](=O)[O-])n1 ZINC000897068300 946561891 /nfs/dbraw/zinc/56/18/91/946561891.db2.gz UPYOCEGWTGHQCE-IFXJQAMLSA-N 0 0 368.437 3.948 20 5 FHBDRN CCc1cnc(CN(C)C(=O)NC[C@@H](C)c2ccccc2[N+](=O)[O-])s1 ZINC000897068728 946563215 /nfs/dbraw/zinc/56/32/15/946563215.db2.gz YLBRITDRDWYKIJ-GFCCVEGCSA-N 0 0 362.455 3.559 20 5 FHBDRN COc1cccc(NC[C@H](CO)Cc2c(F)cccc2Cl)c1[N+](=O)[O-] ZINC000475517169 946568199 /nfs/dbraw/zinc/56/81/99/946568199.db2.gz RJZGDPWJNMFNQZ-LLVKDONJSA-N 0 0 368.792 3.659 20 5 FHBDRN COc1cc(CNC(C)(C)c2nc3ccccc3n2C)c([N+](=O)[O-])cc1F ZINC000186579565 946574753 /nfs/dbraw/zinc/57/47/53/946574753.db2.gz LJDZNETVBTVYHQ-UHFFFAOYSA-N 0 0 372.400 3.654 20 5 FHBDRN COc1cc(OCC(=O)N(CC(C)C)CC(C)(C)C)ccc1[N+](=O)[O-] ZINC000475177855 946582770 /nfs/dbraw/zinc/58/27/70/946582770.db2.gz RBGBKKWTHSAYOV-UHFFFAOYSA-N 0 0 352.431 3.513 20 5 FHBDRN O=[N+]([O-])c1ccc(Cc2noc(/C=C/c3ccc(OC(F)F)cc3)n2)nc1 ZINC000545783266 946592663 /nfs/dbraw/zinc/59/26/63/946592663.db2.gz GXTAZGCQYFNAKJ-FPYGCLRLSA-N 0 0 374.303 3.735 20 5 FHBDRN CO[C@H]1CCC[C@H](CC(=O)Nc2cc(C)nn2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000475536010 946606657 /nfs/dbraw/zinc/60/66/57/946606657.db2.gz ZZVYSMXHQOOUDJ-YOEHRIQHSA-N 0 0 372.425 3.623 20 5 FHBDRN CSc1cccc(C(=O)NC[C@H](C)Oc2cccc(F)c2)c1[N+](=O)[O-] ZINC000186592226 946607504 /nfs/dbraw/zinc/60/75/04/946607504.db2.gz BJLKZCPFNYBWEX-NSHDSACASA-N 0 0 364.398 3.653 20 5 FHBDRN COc1cccc(F)c1[C@H](C)NC(=O)c1cccc(SC)c1[N+](=O)[O-] ZINC000186590411 946607955 /nfs/dbraw/zinc/60/79/55/946607955.db2.gz MHYAGJOGGCTOEL-JTQLQIEISA-N 0 0 364.398 3.955 20 5 FHBDRN CSc1cccc(C(=O)NC[C@@H](C)Oc2cccc(F)c2)c1[N+](=O)[O-] ZINC000186592246 946608114 /nfs/dbraw/zinc/60/81/14/946608114.db2.gz BJLKZCPFNYBWEX-LLVKDONJSA-N 0 0 364.398 3.653 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)c1ccc2c(c1)NC(=O)CS2 ZINC000129505814 946617365 /nfs/dbraw/zinc/61/73/65/946617365.db2.gz FYVNCDLRIWPHCX-UHFFFAOYSA-N 0 0 357.391 3.508 20 5 FHBDRN COCCOc1cccc(CNC(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)c1 ZINC000475550795 946619591 /nfs/dbraw/zinc/61/95/91/946619591.db2.gz RMAOLLIFVSYETK-UHFFFAOYSA-N 0 0 373.409 3.559 20 5 FHBDRN Cc1cc(CNC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)ccc1F ZINC000026054809 946623446 /nfs/dbraw/zinc/62/34/46/946623446.db2.gz LFKIHMCGDKZALM-UHFFFAOYSA-N 0 0 357.385 3.573 20 5 FHBDRN CCOc1ccc(CCC2CCN(Cc3c([N+](=O)[O-])ncn3C)CC2)cc1 ZINC000475538261 946623865 /nfs/dbraw/zinc/62/38/65/946623865.db2.gz RSFVXEMMSDNVCW-UHFFFAOYSA-N 0 0 372.469 3.572 20 5 FHBDRN C[C@@]1(CO)CCC[C@@H]1NC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000473906630 946628956 /nfs/dbraw/zinc/62/89/56/946628956.db2.gz UDAOUDYIRMJLTF-ICSRJNTNSA-N 0 0 369.421 3.619 20 5 FHBDRN O=C1[C@@H](Nc2ccc([N+](=O)[O-])cn2)CCN1c1ccc(Cl)cc1Cl ZINC000473909233 946633247 /nfs/dbraw/zinc/63/32/47/946633247.db2.gz BAQJPGAUBNCKHS-LBPRGKRZSA-N 0 0 367.192 3.514 20 5 FHBDRN CSc1cccc(C(=O)N[C@H](C)COc2cccc(C)c2)c1[N+](=O)[O-] ZINC000186242630 946648994 /nfs/dbraw/zinc/64/89/94/946648994.db2.gz YLZPJOKLBQKZAW-CYBMUJFWSA-N 0 0 360.435 3.822 20 5 FHBDRN CCC(=O)Nc1ccc(NC(=O)N(C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000048393206 946651423 /nfs/dbraw/zinc/65/14/23/946651423.db2.gz NIWABVFJIOVDOI-UHFFFAOYSA-N 0 0 356.382 3.607 20 5 FHBDRN Cc1ccc(C)c(S(=O)(=O)N(CC(F)F)c2ccccc2)c1[N+](=O)[O-] ZINC000549571447 946657555 /nfs/dbraw/zinc/65/75/55/946657555.db2.gz JPIRZJXUMOFKHA-UHFFFAOYSA-N 0 0 370.377 3.672 20 5 FHBDRN COc1c(C(=O)NCc2cccc(OCC(C)C)c2)cccc1[N+](=O)[O-] ZINC000475192946 946673595 /nfs/dbraw/zinc/67/35/95/946673595.db2.gz UKAUGDJVNZMROS-UHFFFAOYSA-N 0 0 358.394 3.568 20 5 FHBDRN Cc1[nH]c2ccccc2c1C(=O)O[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000027812517 946678216 /nfs/dbraw/zinc/67/82/16/946678216.db2.gz KNASDUZXYZKEJW-GFCCVEGCSA-N 0 0 367.361 3.569 20 5 FHBDRN CC(C)(CCCO)CNC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000475194490 946678135 /nfs/dbraw/zinc/67/81/35/946678135.db2.gz FMBVURBMJQLSFQ-UHFFFAOYSA-N 0 0 363.336 3.534 20 5 FHBDRN CO[C@@H]1CCCC[C@H]1NC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000475195951 946682702 /nfs/dbraw/zinc/68/27/02/946682702.db2.gz ORTUJJGAWIVBJB-DGCLKSJQSA-N 0 0 361.320 3.693 20 5 FHBDRN C[C@@H]1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2Br)C[C@@H]1C ZINC000541636265 946692094 /nfs/dbraw/zinc/69/20/94/946692094.db2.gz QXXISCUFBYKIIS-OUAUKWLOSA-N 0 0 355.232 3.912 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])NC[C@H](c1ccccc1)C(F)(F)F ZINC000186607200 946692211 /nfs/dbraw/zinc/69/22/11/946692211.db2.gz WHDAUKSHAMAYAT-CQSZACIVSA-N 0 0 367.327 3.740 20 5 FHBDRN COc1c([N+](=O)[O-])cc(Cl)c(C)c1N(C(=N)N)c1ccc(F)cc1 ZINC001167991006 946699038 /nfs/dbraw/zinc/69/90/38/946699038.db2.gz DBAAOCFZDUUCAS-UHFFFAOYSA-N 0 0 352.753 3.736 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NCCCNc1ccccc1F ZINC000475572830 946713822 /nfs/dbraw/zinc/71/38/22/946713822.db2.gz ZQCUXMWJTSOPPY-UHFFFAOYSA-N 0 0 360.389 3.974 20 5 FHBDRN CCOCc1cccc(NC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)c1 ZINC000088378443 946715060 /nfs/dbraw/zinc/71/50/60/946715060.db2.gz MKTUIFDKTGJWHR-UHFFFAOYSA-N 0 0 355.394 3.722 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2nnc(N3CCCCC3)n2Cc2cccs2)cc1 ZINC000549575011 946722077 /nfs/dbraw/zinc/72/20/77/946722077.db2.gz BTOSIGBWONZPID-UHFFFAOYSA-N 0 0 369.450 3.953 20 5 FHBDRN CS[C@@H]1CC[C@@H](NC(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)C1 ZINC000125573808 946726513 /nfs/dbraw/zinc/72/65/13/946726513.db2.gz ZTWVSICKBYGIIG-GHMZBOCLSA-N 0 0 373.272 3.680 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)c2coc(=O)c3ccccc23)cc1[N+](=O)[O-] ZINC001126610675 946749950 /nfs/dbraw/zinc/74/99/50/946749950.db2.gz GXUMGRFPBLZPHU-GFCCVEGCSA-N 0 0 352.346 3.501 20 5 FHBDRN Cc1cnc(OCc2ccc(OCc3ccccc3F)nc2)c([N+](=O)[O-])c1 ZINC000186627593 946753815 /nfs/dbraw/zinc/75/38/15/946753815.db2.gz IACFNLVQKSEOAE-UHFFFAOYSA-N 0 0 369.352 3.990 20 5 FHBDRN CCSCC[C@H](C)N(C)C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000183058987 946754276 /nfs/dbraw/zinc/75/42/76/946754276.db2.gz BLGFXTOEDGWEKQ-JTQLQIEISA-N 0 0 362.398 3.800 20 5 FHBDRN CCN(CC1CC1)C(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000112181468 946757001 /nfs/dbraw/zinc/75/70/01/946757001.db2.gz BSAJWNADSWLCRL-UHFFFAOYSA-N 0 0 362.373 3.964 20 5 FHBDRN COc1ccc(NC(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)cc1NC(C)=O ZINC000475586627 946760912 /nfs/dbraw/zinc/76/09/12/946760912.db2.gz XHHSYCWEEMNYBJ-UHFFFAOYSA-N 0 0 372.381 3.823 20 5 FHBDRN COc1ccc(C(=O)Nc2ccc([N+](=O)[O-])cc2F)c(OC(F)F)c1 ZINC000475258578 946768458 /nfs/dbraw/zinc/76/84/58/946768458.db2.gz WHITWORVMXQYMI-UHFFFAOYSA-N 0 0 356.256 3.596 20 5 FHBDRN CCc1ccc([C@H](N[C@@H](C)CC[S@](C)=O)c2ccc([N+](=O)[O-])cc2)o1 ZINC000544380948 946770723 /nfs/dbraw/zinc/77/07/23/946770723.db2.gz VLKCSGKFLQBVIO-XZFRQNIJSA-N 0 0 364.467 3.586 20 5 FHBDRN Cc1cccc(C(=O)N2C[C@@H](C)O[C@H](c3ccc(F)cc3)C2)c1[N+](=O)[O-] ZINC000151993899 946770818 /nfs/dbraw/zinc/77/08/18/946770818.db2.gz ZTFYUHSKODAQNE-DYVFJYSZSA-N 0 0 358.369 3.645 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)NC[C@H](c2ccccc2)C(C)(C)CO)c1C ZINC000897145569 946773685 /nfs/dbraw/zinc/77/36/85/946773685.db2.gz IDGLLQUHDWFFQY-QGZVFWFLSA-N 0 0 370.449 3.744 20 5 FHBDRN C[C@@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccc(Br)cn1 ZINC000475248379 946776097 /nfs/dbraw/zinc/77/60/97/946776097.db2.gz SIWHJDLTNSXYRO-SECBINFHSA-N 0 0 365.187 3.635 20 5 FHBDRN O=C(Nc1nccnc1-c1ccccc1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC001271732114 946798054 /nfs/dbraw/zinc/79/80/54/946798054.db2.gz QXBOJFKHAWOKQC-DLBZAZTESA-N 0 0 360.373 3.794 20 5 FHBDRN O=C(c1cnc(-c2ccsc2)s1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000112231478 946810131 /nfs/dbraw/zinc/81/01/31/946810131.db2.gz DALFSHSMCJADLK-UHFFFAOYSA-N 0 0 357.416 3.983 20 5 FHBDRN CCCCn1cc(C(=O)Nc2cc(-c3cccc([N+](=O)[O-])c3)[nH]n2)c(C)n1 ZINC000184468182 946815726 /nfs/dbraw/zinc/81/57/26/946815726.db2.gz ZBYACOJKHLIYAI-UHFFFAOYSA-N 0 0 368.397 3.542 20 5 FHBDRN Cc1ccc(CN2CC(c3nc(-c4ccccc4)no3)C2)cc1[N+](=O)[O-] ZINC000897320151 946829126 /nfs/dbraw/zinc/82/91/26/946829126.db2.gz MFRJXSZXHIWDRZ-UHFFFAOYSA-N 0 0 350.378 3.553 20 5 FHBDRN Cc1cccc(C(=O)N2CCc3ccc(Br)cc32)c1[N+](=O)[O-] ZINC000112265844 946835193 /nfs/dbraw/zinc/83/51/93/946835193.db2.gz UMGNWCHNBQKRND-UHFFFAOYSA-N 0 0 361.195 3.869 20 5 FHBDRN O=[N+]([O-])c1ccccc1N1CCN(Cc2ccccc2OC(F)F)CC1 ZINC000025916493 946843543 /nfs/dbraw/zinc/84/35/43/946843543.db2.gz YFHQEIKHOUDWRQ-UHFFFAOYSA-N 0 0 363.364 3.518 20 5 FHBDRN CCCCC[C@@H](NC(=O)c1ccnc(-n2ccc([N+](=O)[O-])n2)c1)C(C)(C)C ZINC001126162623 946867776 /nfs/dbraw/zinc/86/77/76/946867776.db2.gz TZFOCAVBORSBSS-OAHLLOKOSA-N 0 0 373.457 3.900 20 5 FHBDRN O=[N+]([O-])c1sccc1NCc1cc2c(c(Br)c1)OCO2 ZINC000049100038 946868535 /nfs/dbraw/zinc/86/85/35/946868535.db2.gz HOQMZAZWVQAWLW-UHFFFAOYSA-N 0 0 357.185 3.760 20 5 FHBDRN CC(C)c1cc(NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)n[nH]1 ZINC000051380734 946871580 /nfs/dbraw/zinc/87/15/80/946871580.db2.gz BANBGYMFQGDWLX-UHFFFAOYSA-N 0 0 357.395 3.817 20 5 FHBDRN CSCCCCCNC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000186320447 946884317 /nfs/dbraw/zinc/88/43/17/946884317.db2.gz CKHKEFOKYPPHAJ-UHFFFAOYSA-N 0 0 363.386 3.851 20 5 FHBDRN O=C(c1ccc2[nH]c(C(F)F)nc2c1)N1CCc2c1cccc2[N+](=O)[O-] ZINC000523132582 946899705 /nfs/dbraw/zinc/89/97/05/946899705.db2.gz JNQSLEOFDHGERT-UHFFFAOYSA-N 0 0 358.304 3.612 20 5 FHBDRN CC(C)OC(=O)C[C@@H](NC(=O)CCC(C)(C)C)c1ccccc1[N+](=O)[O-] ZINC000523132594 946899987 /nfs/dbraw/zinc/89/99/87/946899987.db2.gz KGIDGICYTUKHIE-OAHLLOKOSA-N 0 0 364.442 3.920 20 5 FHBDRN COc1cccc([C@H]2C[C@@H](C)CN2C(=O)Cc2ccccc2[N+](=O)[O-])c1 ZINC000544323611 946908953 /nfs/dbraw/zinc/90/89/53/946908953.db2.gz XFZZUFMIYBPAMT-AUUYWEPGSA-N 0 0 354.406 3.756 20 5 FHBDRN Cc1nn(CCC(=O)N(C)[C@H](c2ccccc2)C(C)C)c(C)c1[N+](=O)[O-] ZINC000112588504 946916168 /nfs/dbraw/zinc/91/61/68/946916168.db2.gz UZSDCRHSGJRYTH-SFHVURJKSA-N 0 0 358.442 3.654 20 5 FHBDRN CS(=O)(=O)c1cccc(Oc2ccc(Br)cc2[N+](=O)[O-])c1 ZINC000048760135 946916587 /nfs/dbraw/zinc/91/65/87/946916587.db2.gz BBZGNVYHMGVKDZ-UHFFFAOYSA-N 0 0 372.196 3.553 20 5 FHBDRN CC(C)c1noc2ncc(C(=O)NCc3ccc([N+](=O)[O-])cc3Cl)cc21 ZINC000186328373 946923673 /nfs/dbraw/zinc/92/36/73/946923673.db2.gz PBRXBOPTWNUXOH-UHFFFAOYSA-N 0 0 374.784 3.838 20 5 FHBDRN COc1cccc(Cl)c1C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186330013 946928182 /nfs/dbraw/zinc/92/81/82/946928182.db2.gz DDMPVICYTYLTQX-UHFFFAOYSA-N 0 0 355.177 3.840 20 5 FHBDRN O=[N+]([O-])c1c(NC[C@@H](O)c2ccc3ccccc3c2)nc2sccn21 ZINC000067373015 946936791 /nfs/dbraw/zinc/93/67/91/946936791.db2.gz UHBUPQWZAYPZEE-CQSZACIVSA-N 0 0 354.391 3.603 20 5 FHBDRN C[C@H](NC(=O)N1CCOC[C@@H]1c1ccc(F)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000458891954 946943864 /nfs/dbraw/zinc/94/38/64/946943864.db2.gz SRWGYXHDVXRSPC-SCLBCKFNSA-N 0 0 373.384 3.578 20 5 FHBDRN Cc1ccc(C)c(S(=O)(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1 ZINC000511911509 946946077 /nfs/dbraw/zinc/94/60/77/946946077.db2.gz QAHYDFYGYQAWPT-UHFFFAOYSA-N 0 0 362.451 3.811 20 5 FHBDRN CCOC(=O)c1cc(C(=O)Nc2ccc(C(C)=O)c(C)c2)cc([N+](=O)[O-])c1 ZINC000536289639 946952715 /nfs/dbraw/zinc/95/27/15/946952715.db2.gz DHXLEPDKECTMAW-UHFFFAOYSA-N 0 0 370.361 3.535 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N(Cc1ccco1)Cc1ccco1 ZINC000087066766 946954889 /nfs/dbraw/zinc/95/48/89/946954889.db2.gz RBDRIPFPIJIUFP-UHFFFAOYSA-N 0 0 354.362 3.942 20 5 FHBDRN COc1ccc([C@H](C)CCNC(=O)c2cc(OC)ccc2[N+](=O)[O-])cc1 ZINC000152002345 946955026 /nfs/dbraw/zinc/95/50/26/946955026.db2.gz XTHNFMVWWQAKCE-CYBMUJFWSA-N 0 0 358.394 3.536 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@H]1C[C@H]1c1cc(F)ccc1F ZINC000186337813 946955769 /nfs/dbraw/zinc/95/57/69/946955769.db2.gz JIHUSRNIEJZJEO-JSGCOSHPSA-N 0 0 366.751 3.946 20 5 FHBDRN COc1ccc2c(CC(=O)NCc3ccc([N+](=O)[O-])cc3Cl)coc2c1 ZINC000186340300 946958030 /nfs/dbraw/zinc/95/80/30/946958030.db2.gz IIWQOWPUIMJYCY-UHFFFAOYSA-N 0 0 374.780 3.862 20 5 FHBDRN C[C@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1)c1ccc(Br)s1 ZINC000444519566 946972020 /nfs/dbraw/zinc/97/20/20/946972020.db2.gz OIIGVUIUHXMCGC-VIFPVBQESA-N 0 0 369.240 3.839 20 5 FHBDRN Cc1cc(Cl)c(OC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1F ZINC000567575472 946974417 /nfs/dbraw/zinc/97/44/17/946974417.db2.gz KNHIGDWBKVXODL-LBPRGKRZSA-N 0 0 355.749 3.514 20 5 FHBDRN CCC(=O)c1ccc(NCc2cc(C(F)(F)F)n(C)n2)c([N+](=O)[O-])c1 ZINC000897238009 946998070 /nfs/dbraw/zinc/99/80/70/946998070.db2.gz HXKUQEQPRHAACL-UHFFFAOYSA-N 0 0 356.304 3.552 20 5 FHBDRN CC(C)Oc1ccccc1CC(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186350124 947018579 /nfs/dbraw/zinc/01/85/79/947018579.db2.gz NDSTWXXIOFGGHP-UHFFFAOYSA-N 0 0 362.813 3.894 20 5 FHBDRN COc1ccc([C@@H](C)CCNC(=O)c2cc([N+](=O)[O-])ccc2OC)cc1 ZINC000152011426 947025914 /nfs/dbraw/zinc/02/59/14/947025914.db2.gz AWEGFJAMEUWJMZ-ZDUSSCGKSA-N 0 0 358.394 3.536 20 5 FHBDRN O=C(Nc1ccc(Nc2ncccn2)cc1)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000444606489 947032548 /nfs/dbraw/zinc/03/25/48/947032548.db2.gz DGDAEKXDOWJZSM-UHFFFAOYSA-N 0 0 374.360 3.862 20 5 FHBDRN O=C(Cn1cc([N+](=O)[O-])cn1)Nc1ccc(CCCc2ccccc2)cc1 ZINC000523258887 947036605 /nfs/dbraw/zinc/03/66/05/947036605.db2.gz DVXGFRZRGAXODL-UHFFFAOYSA-N 0 0 364.405 3.605 20 5 FHBDRN CCc1ccc(O)c(NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)c1 ZINC000074826849 947038192 /nfs/dbraw/zinc/03/81/92/947038192.db2.gz CNLBTRQLANTOCB-UHFFFAOYSA-N 0 0 355.394 3.715 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])N1CCCC[C@H]1Cc1ccccc1 ZINC000523282842 947050511 /nfs/dbraw/zinc/05/05/11/947050511.db2.gz FZBCMUFAPCBJAM-KRWDZBQOSA-N 0 0 353.422 3.631 20 5 FHBDRN C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)N(C)CC(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000124416325 947056657 /nfs/dbraw/zinc/05/66/57/947056657.db2.gz OKFVJDHGUHKINN-TXEJJXNPSA-N 0 0 373.375 3.711 20 5 FHBDRN CCOCc1cccc(NC(=O)c2cc(OCC)c(OC)cc2[N+](=O)[O-])c1 ZINC000523270123 947057717 /nfs/dbraw/zinc/05/77/17/947057717.db2.gz IAEKAHNCUNQJDY-UHFFFAOYSA-N 0 0 374.393 3.791 20 5 FHBDRN O=[N+]([O-])c1ccc(OC(F)F)c(CN2CCC[C@H](OCC3CC3)C2)c1 ZINC000428372264 947063544 /nfs/dbraw/zinc/06/35/44/947063544.db2.gz KYQDKVBSFWPTOT-HNNXBMFYSA-N 0 0 356.369 3.587 20 5 FHBDRN C[C@@H](CCCc1ccccc1)C(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444645902 947067268 /nfs/dbraw/zinc/06/72/68/947067268.db2.gz QRRJFQCKEVSPIR-AWEZNQCLSA-N 0 0 366.421 3.746 20 5 FHBDRN CCCOc1cc(NC(=O)c2ccc(C)nn2)c([N+](=O)[O-])cc1OCCC ZINC000414748900 947073619 /nfs/dbraw/zinc/07/36/19/947073619.db2.gz XNTHHRYQPCXXQQ-UHFFFAOYSA-N 0 0 374.397 3.523 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C[S@@](=O)c1cccc(Br)c1 ZINC000108098258 947074138 /nfs/dbraw/zinc/07/41/38/947074138.db2.gz QQBQGCAYVZXEOU-NRFANRHFSA-N 0 0 370.224 3.674 20 5 FHBDRN Cc1ccccc1[C@H]1CN(Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)[C@H](C)CO1 ZINC000444655252 947074941 /nfs/dbraw/zinc/07/49/41/947074941.db2.gz SMUWFTLHBRPZKT-AUUYWEPGSA-N 0 0 366.421 3.742 20 5 FHBDRN CCc1n[nH]c(C(=O)N2CCCC[C@@H]2c2cccc(Cl)c2)c1[N+](=O)[O-] ZINC000444659449 947076906 /nfs/dbraw/zinc/07/69/06/947076906.db2.gz PPQUQCIPBZVIFD-CQSZACIVSA-N 0 0 362.817 3.901 20 5 FHBDRN CNc1ccc(C(=O)N2CCCC[C@H]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000523282440 947079950 /nfs/dbraw/zinc/07/99/50/947079950.db2.gz MQXXXMSTCHSSTB-KRWDZBQOSA-N 0 0 353.422 3.874 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H](C)c1ncc(C)s1 ZINC000439855208 947088353 /nfs/dbraw/zinc/08/83/53/947088353.db2.gz BQSWPFQMLCKBEL-JTQLQIEISA-N 0 0 364.427 3.684 20 5 FHBDRN COc1cc(C)c([C@H](C)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1OC ZINC000444673587 947098005 /nfs/dbraw/zinc/09/80/05/947098005.db2.gz NFQKADJIWWHJNZ-LBPRGKRZSA-N 0 0 370.409 3.648 20 5 FHBDRN COC(=O)c1cc(NC(=O)c2ccccc2C2(C)CC2)c(C)c([N+](=O)[O-])c1 ZINC001271456145 947099058 /nfs/dbraw/zinc/09/90/58/947099058.db2.gz KLURSSGHLDRJSY-UHFFFAOYSA-N 0 0 368.389 3.994 20 5 FHBDRN C[C@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@H]1Oc2ccccc2[C@@H]1C ZINC000444678591 947103149 /nfs/dbraw/zinc/10/31/49/947103149.db2.gz ZLAZOJUVXMMVRJ-ZKTNFTSUSA-N 0 0 352.394 3.514 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(N[C@@H](C)[C@@H](O)c2c(F)cccc2Cl)n1 ZINC000781662916 947122311 /nfs/dbraw/zinc/12/23/11/947122311.db2.gz HFECCPWJEYBFNH-ZUZCIYMTSA-N 0 0 353.781 3.933 20 5 FHBDRN Cc1nn(CC(=O)Nc2ccc(Oc3ccccc3)cc2)cc1[N+](=O)[O-] ZINC000181827156 947123771 /nfs/dbraw/zinc/12/37/71/947123771.db2.gz CIUICKIQYAHROO-UHFFFAOYSA-N 0 0 352.350 3.531 20 5 FHBDRN COC(=O)c1cc(NC(=O)/C=C/c2ccc(Cl)cc2)c(C)c([N+](=O)[O-])c1 ZINC001271456485 947125177 /nfs/dbraw/zinc/12/51/77/947125177.db2.gz MSXBHUATIBPZRW-VMPITWQZSA-N 0 0 374.780 3.995 20 5 FHBDRN COc1ccc(CCC(=O)N(C)Cc2cc([N+](=O)[O-])ccc2Cl)cc1 ZINC000054260020 947126721 /nfs/dbraw/zinc/12/67/21/947126721.db2.gz BGQOXDMQEBUUIO-UHFFFAOYSA-N 0 0 362.813 3.848 20 5 FHBDRN COc1cc(C(=O)N2CCCCc3ccccc32)c([N+](=O)[O-])cc1OC ZINC000049726925 947136292 /nfs/dbraw/zinc/13/62/92/947136292.db2.gz OAROCHAQTUMPHK-UHFFFAOYSA-N 0 0 356.378 3.595 20 5 FHBDRN Cc1cc(CN(C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)ccc1F ZINC000444732344 947147872 /nfs/dbraw/zinc/14/78/72/947147872.db2.gz KKKMIVDJMISVIC-UHFFFAOYSA-N 0 0 356.357 3.724 20 5 FHBDRN CC(=O)N1CC[C@@H]([NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c2ccc(F)cc2C1 ZINC000184521782 947159174 /nfs/dbraw/zinc/15/91/74/947159174.db2.gz WQOJEWGUXFSGBB-ZUOKHONESA-N 0 0 371.412 3.878 20 5 FHBDRN C[C@@H](N[C@H](c1ccco1)c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000049974349 947179218 /nfs/dbraw/zinc/17/92/18/947179218.db2.gz JHCZQPZJDCFABY-KUHUBIRLSA-N 0 0 365.389 3.894 20 5 FHBDRN CN(Cc1ccc(C(F)(F)F)cc1)C(=O)Cc1ccccc1[N+](=O)[O-] ZINC000049940767 947182377 /nfs/dbraw/zinc/18/23/77/947182377.db2.gz WTYZUULUPDAYOE-UHFFFAOYSA-N 0 0 352.312 3.815 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H](C)[C@H]1COc2ccccc21 ZINC000439867738 947184558 /nfs/dbraw/zinc/18/45/58/947184558.db2.gz BYBAGAQHADXBMQ-IUODEOHRSA-N 0 0 371.393 3.680 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)NCCc1ccc(Cl)cc1 ZINC000021184300 947212699 /nfs/dbraw/zinc/21/26/99/947212699.db2.gz RWJVNJUDPKIWPF-UHFFFAOYSA-N 0 0 361.829 3.799 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc2c(c1)ncn2C ZINC000440546388 947213586 /nfs/dbraw/zinc/21/35/86/947213586.db2.gz MWSSWUGMSVYBDV-LLVKDONJSA-N 0 0 356.407 3.601 20 5 FHBDRN CS[C@@H]1CCCCN(c2ncc([N+](=O)[O-])c(C)c2Br)C1 ZINC000544394109 947222425 /nfs/dbraw/zinc/22/24/25/947222425.db2.gz JMOZLQKTHRBAFZ-SNVBAGLBSA-N 0 0 360.277 3.783 20 5 FHBDRN Cc1ccc(-n2cc(NC(=O)Cc3ccccc3[N+](=O)[O-])cn2)c(C)c1 ZINC000190275879 947224637 /nfs/dbraw/zinc/22/46/37/947224637.db2.gz RAOJMNCESXWUOX-UHFFFAOYSA-N 0 0 350.378 3.579 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)Nc2n[nH]c(-c3ccc(C)cc3)n2)c1 ZINC000121495927 947225261 /nfs/dbraw/zinc/22/52/61/947225261.db2.gz VLYAXBBQQOJXIV-UHFFFAOYSA-N 0 0 369.406 3.663 20 5 FHBDRN Cn1c2ccccc2nc1C(C)(C)NC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000186399569 947226519 /nfs/dbraw/zinc/22/65/19/947226519.db2.gz PUVSSVFHRGVASM-UHFFFAOYSA-N 0 0 372.812 3.800 20 5 FHBDRN O=C(N[C@H]1CCc2ccccc21)c1sc(Br)cc1[N+](=O)[O-] ZINC000444824121 947237844 /nfs/dbraw/zinc/23/78/44/947237844.db2.gz HSVYSFWKNCGULI-JTQLQIEISA-N 0 0 367.224 3.836 20 5 FHBDRN CC(C)(CNC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1)c1ccccn1 ZINC000458921649 947241971 /nfs/dbraw/zinc/24/19/71/947241971.db2.gz NSEQCLCYDYHLKO-UHFFFAOYSA-N 0 0 368.437 3.642 20 5 FHBDRN CC[C@@H](NS(=O)(=O)c1ccc(C)cc1[N+](=O)[O-])c1ccc(F)cc1F ZINC000523415927 947245024 /nfs/dbraw/zinc/24/50/24/947245024.db2.gz UZLQNJIHDCNPGC-CQSZACIVSA-N 0 0 370.377 3.611 20 5 FHBDRN Cc1ccccc1[C@H]1C[C@H](C)N(S(=O)(=O)c2ccc([N+](=O)[O-])c(C)c2)C1 ZINC000523419079 947249676 /nfs/dbraw/zinc/24/96/76/947249676.db2.gz RBVJJTZGLNFDRH-HOTGVXAUSA-N 0 0 374.462 3.778 20 5 FHBDRN CCOC(=O)c1cc(C(=O)Nc2cccc3cnccc32)cc([N+](=O)[O-])c1 ZINC000021217623 947263886 /nfs/dbraw/zinc/26/38/86/947263886.db2.gz TVFRQIJDFDIJMD-UHFFFAOYSA-N 0 0 365.345 3.572 20 5 FHBDRN Cn1cc([N+](=O)[O-])cc1C(=O)Nc1c(-c2cccs2)nc2ccccn21 ZINC000523445805 947274357 /nfs/dbraw/zinc/27/43/57/947274357.db2.gz HFPVMOFSEPYFGY-UHFFFAOYSA-N 0 0 367.390 3.562 20 5 FHBDRN O=C(c1cccc2c(=O)c3ccccc3[nH]c12)N1CCc2ccc(O)cc2C1 ZINC000444860265 947285944 /nfs/dbraw/zinc/28/59/44/947285944.db2.gz PCWTUXHEZABGCY-UHFFFAOYSA-N 0 0 370.408 3.585 20 5 FHBDRN CC(C)(C)OC(=O)CCSCC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000440581690 947286639 /nfs/dbraw/zinc/28/66/39/947286639.db2.gz FSUIYVXXIWDMKD-UHFFFAOYSA-N 0 0 374.846 3.652 20 5 FHBDRN CCO[C@H](CNc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-])c1ccccc1 ZINC000444869493 947296501 /nfs/dbraw/zinc/29/65/01/947296501.db2.gz INZZKCDKAMWIHU-LJQANCHMSA-N 0 0 371.437 3.923 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@@H](C)c1ccc(F)cc1F ZINC000444902668 947322805 /nfs/dbraw/zinc/32/28/05/947322805.db2.gz WHGBEUBDWFXHIO-SNVBAGLBSA-N 0 0 365.336 3.807 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NCCc1ccc(Cl)s1 ZINC000444907146 947326576 /nfs/dbraw/zinc/32/65/76/947326576.db2.gz OKMGXEZQJWLJPK-UHFFFAOYSA-N 0 0 355.803 3.683 20 5 FHBDRN NC(=O)C1CCN(c2cccc(Nc3ccc([N+](=O)[O-])cc3Cl)c2)CC1 ZINC000523514545 947328225 /nfs/dbraw/zinc/32/82/25/947328225.db2.gz NGGNTNXTIXLRJL-UHFFFAOYSA-N 0 0 374.828 3.694 20 5 FHBDRN C[C@@H]1COCCN1C(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000444896316 947333812 /nfs/dbraw/zinc/33/38/12/947333812.db2.gz CYLLJSOMYKXHQO-CYBMUJFWSA-N 0 0 357.366 3.640 20 5 FHBDRN C[C@@H]1CCC[C@H](C)[C@H]1NC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000523504164 947334992 /nfs/dbraw/zinc/33/49/92/947334992.db2.gz ICNWOHUWFNXDHU-MSRIBSCDSA-N 0 0 355.232 3.912 20 5 FHBDRN O=[N+]([O-])c1cc(F)c(NCc2nnc3ccc(C(F)(F)F)cn32)c(F)c1 ZINC000440594024 947336804 /nfs/dbraw/zinc/33/68/04/947336804.db2.gz BIVFFWMDQBEVGK-UHFFFAOYSA-N 0 0 373.241 3.547 20 5 FHBDRN COc1ccc([C@H]2CCN(C(=O)c3cccc(SC)c3[N+](=O)[O-])C2)cc1 ZINC000186432305 947338157 /nfs/dbraw/zinc/33/81/57/947338157.db2.gz RIRUBGXJQIVKJR-AWEZNQCLSA-N 0 0 372.446 3.955 20 5 FHBDRN CC(C)(C(=O)N1CCO[C@@H](c2ccc(F)cc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000523528712 947338466 /nfs/dbraw/zinc/33/84/66/947338466.db2.gz MFZBUKJMAOOAKJ-GOSISDBHSA-N 0 0 372.396 3.612 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@@H](C)Oc1ccc(C)cc1 ZINC000444912381 947350439 /nfs/dbraw/zinc/35/04/39/947350439.db2.gz KYKDPUBNXOPDOO-CYBMUJFWSA-N 0 0 359.382 3.501 20 5 FHBDRN O=C(Nc1ccc2cc([N+](=O)[O-])ccc2n1)[C@@H]1C[C@@H]1c1c(F)cccc1F ZINC000440607100 947362073 /nfs/dbraw/zinc/36/20/73/947362073.db2.gz APXXUOGWTQFROZ-QWHCGFSZSA-N 0 0 369.327 3.585 20 5 FHBDRN CCN(C[C@@H](O)COc1ccccc1[N+](=O)[O-])c1ccccc1Cl ZINC000440623969 947375979 /nfs/dbraw/zinc/37/59/79/947375979.db2.gz LAVSZKFVCLRCDV-CYBMUJFWSA-N 0 0 350.802 3.514 20 5 FHBDRN CC[C@@H]1CN(c2cc(C)c(C(F)(F)F)cc2[N+](=O)[O-])C[C@H](C)[S@]1=O ZINC000549582651 947377704 /nfs/dbraw/zinc/37/77/04/947377704.db2.gz MXUZKQZRLVUVKS-AWPAMXJSSA-N 0 0 364.389 3.658 20 5 FHBDRN Cn1cccc1CNC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 ZINC000440619697 947387649 /nfs/dbraw/zinc/38/76/49/947387649.db2.gz XWUZONGMKVQEMW-UHFFFAOYSA-N 0 0 351.362 3.656 20 5 FHBDRN CCCC(O)(CCC)CNC(=O)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000444994195 947407435 /nfs/dbraw/zinc/40/74/35/947407435.db2.gz VAFXHDDMAFYRBL-UHFFFAOYSA-N 0 0 366.461 3.742 20 5 FHBDRN C[C@H]1CCN(C(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)C[C@H]1n1ccnc1 ZINC000126191013 947409983 /nfs/dbraw/zinc/40/99/83/947409983.db2.gz ZBSQIJVZYJTEEM-KBXCAEBGSA-N 0 0 370.453 3.812 20 5 FHBDRN Cc1cc(C)c(/C=C\C(=O)N2CCC(n3ccc([N+](=O)[O-])n3)CC2)cc1C ZINC000785325845 947412868 /nfs/dbraw/zinc/41/28/68/947412868.db2.gz GUEVJHAZRJNMPO-PLNGDYQASA-N 0 0 368.437 3.593 20 5 FHBDRN CC(C)(C)c1nc2ccc(NC(=O)c3c[nH]c(=O)c([N+](=O)[O-])c3)cc2s1 ZINC000445004367 947426801 /nfs/dbraw/zinc/42/68/01/947426801.db2.gz GLTBGGBJGZOWGK-UHFFFAOYSA-N 0 0 372.406 3.855 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)Nc2nc3c(s2)CSCC3)c1 ZINC000367722122 947483457 /nfs/dbraw/zinc/48/34/57/947483457.db2.gz TZTFZNXUSDFCSG-UHFFFAOYSA-N 0 0 367.477 3.815 20 5 FHBDRN CC(C)NC(=O)c1ccc(N[C@@H](C)c2cnn(C(C)C)c2)c([N+](=O)[O-])c1 ZINC000523656912 947484843 /nfs/dbraw/zinc/48/48/43/947484843.db2.gz QWFQWNPKKGNGRO-ZDUSSCGKSA-N 0 0 359.430 3.684 20 5 FHBDRN Cc1ccccc1[C@H]1CN(CCOc2cccc([N+](=O)[O-])c2)[C@H](C)CO1 ZINC000441447942 947486579 /nfs/dbraw/zinc/48/65/79/947486579.db2.gz FIPLZFSSYGSQPV-OXQOHEQNSA-N 0 0 356.422 3.744 20 5 FHBDRN C[C@H](NC(=O)c1ccccc1Sc1ccccc1[N+](=O)[O-])[C@H]1CCOC1 ZINC000440645985 947493136 /nfs/dbraw/zinc/49/31/36/947493136.db2.gz MMJSTFDUFFVAKK-KBPBESRZSA-N 0 0 372.446 3.901 20 5 FHBDRN O=C(N[C@@H]1CCCOc2ccccc21)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000523681377 947510073 /nfs/dbraw/zinc/51/00/73/947510073.db2.gz KTTOQDVXWWVXFU-MRXNPFEDSA-N 0 0 351.362 3.720 20 5 FHBDRN COc1ccccc1C1CC(NC(=O)CCc2cccc([N+](=O)[O-])c2)C1 ZINC000365987068 947539703 /nfs/dbraw/zinc/53/97/03/947539703.db2.gz NMSDYNYJWBZURY-UHFFFAOYSA-N 0 0 354.406 3.598 20 5 FHBDRN C[C@H](Cc1ccsc1)Nc1ccc(C(=O)c2nccn2C)cc1[N+](=O)[O-] ZINC000067383041 947548462 /nfs/dbraw/zinc/54/84/62/947548462.db2.gz SLUISCZNFYIHJA-GFCCVEGCSA-N 0 0 370.434 3.664 20 5 FHBDRN CCO[C@H]1C[C@@H](N(C)C(=O)c2cc([N+](=O)[O-])c(C)s2)C12CCCC2 ZINC000150787152 947549944 /nfs/dbraw/zinc/54/99/44/947549944.db2.gz LLBMGTKNPLNFFC-CABCVRRESA-N 0 0 352.456 3.775 20 5 FHBDRN CCO[C@@H]1C[C@H](N(C)C(=O)c2cc([N+](=O)[O-])c(C)s2)C12CCCC2 ZINC000150787081 947550271 /nfs/dbraw/zinc/55/02/71/947550271.db2.gz LLBMGTKNPLNFFC-LSDHHAIUSA-N 0 0 352.456 3.775 20 5 FHBDRN COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N2CCSCC2)cc1 ZINC000053818927 947550404 /nfs/dbraw/zinc/55/04/04/947550404.db2.gz CKZZRMSCPBPSBJ-UHFFFAOYSA-N 0 0 374.418 3.585 20 5 FHBDRN CN(CCc1ccccc1O)C(=O)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000445160500 947555621 /nfs/dbraw/zinc/55/56/21/947555621.db2.gz OHSPGEYWDRKJGZ-UHFFFAOYSA-N 0 0 372.424 3.702 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NCC(=O)N[C@@H](c1ccccc1)C(C)C ZINC000053834579 947556568 /nfs/dbraw/zinc/55/65/68/947556568.db2.gz YKTBBKVQOPVNGL-LJQANCHMSA-N 0 0 357.410 3.529 20 5 FHBDRN CCCc1nc(C)c(NC(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)s1 ZINC000445167462 947563133 /nfs/dbraw/zinc/56/31/33/947563133.db2.gz YXXSIHKJXPWWFE-UHFFFAOYSA-N 0 0 374.426 3.510 20 5 FHBDRN CCCN(C(=O)c1ccc(OC(F)F)cn1)c1cccc([N+](=O)[O-])c1 ZINC000441459829 947565045 /nfs/dbraw/zinc/56/50/45/947565045.db2.gz SQAOPUXBMRJVQU-UHFFFAOYSA-N 0 0 351.309 3.648 20 5 FHBDRN C[C@@H]1C[C@@H]1c1ccc(CNc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])o1 ZINC000523745679 947565265 /nfs/dbraw/zinc/56/52/65/947565265.db2.gz HHWJLCUBTPPASK-ABAIWWIYSA-N 0 0 355.394 3.816 20 5 FHBDRN CCOc1cc2c(cc1[C@@H]1C[C@@H]1Nc1nccc(C)c1[N+](=O)[O-])O[C@H](C)C2 ZINC000523755357 947571496 /nfs/dbraw/zinc/57/14/96/947571496.db2.gz SUORVKXYKOVBLP-INWMFGNUSA-N 0 0 369.421 3.988 20 5 FHBDRN O=C(CCN1CCc2ccc([N+](=O)[O-])cc2C1)Nc1ccccc1Cl ZINC000088606346 947576629 /nfs/dbraw/zinc/57/66/29/947576629.db2.gz CMEDXYKPAWRYJD-UHFFFAOYSA-N 0 0 359.813 3.635 20 5 FHBDRN CCc1c(C(=O)Nc2cccc([N+](=O)[O-])c2C)cnn1-c1ccccc1 ZINC000121540245 947581644 /nfs/dbraw/zinc/58/16/44/947581644.db2.gz WGWYBDAWACMURE-UHFFFAOYSA-N 0 0 350.378 3.904 20 5 FHBDRN C[C@H](c1nnc(-c2ccccc2)o1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088606563 947588060 /nfs/dbraw/zinc/58/80/60/947588060.db2.gz ZEXMGFAVWKKHEL-CYBMUJFWSA-N 0 0 350.378 3.764 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)NCc1ccc(C(F)F)cc1 ZINC000184561701 947607231 /nfs/dbraw/zinc/60/72/31/947607231.db2.gz JMZXFQATOPSZGP-UHFFFAOYSA-N 0 0 359.332 3.873 20 5 FHBDRN CC1(CNC(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)CCCCCC1 ZINC000445215851 947616543 /nfs/dbraw/zinc/61/65/43/947616543.db2.gz DLSBQMFKCDGKOI-UHFFFAOYSA-N 0 0 359.430 3.631 20 5 FHBDRN CC(C)c1ccc(C[C@@H]2CCN(C(=O)c3c[nH]c(=O)c([N+](=O)[O-])c3)C2)cc1 ZINC000445218642 947618618 /nfs/dbraw/zinc/61/86/18/947618618.db2.gz RDAHOPCVPSVGDO-HNNXBMFYSA-N 0 0 369.421 3.524 20 5 FHBDRN C[C@@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1cccc(C(F)(F)F)c1 ZINC000016088006 947643984 /nfs/dbraw/zinc/64/39/84/947643984.db2.gz FYERUJMIONIUGT-SNVBAGLBSA-N 0 0 374.340 3.653 20 5 FHBDRN Cc1cc(C)c(NC(=O)COC(=O)c2c(C)cccc2[N+](=O)[O-])c(C)c1 ZINC000026113907 947649780 /nfs/dbraw/zinc/64/97/80/947649780.db2.gz FHRVTKZZJIZMDV-UHFFFAOYSA-N 0 0 356.378 3.624 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1C(=O)OCC(=O)Nc1cccc2ccccc21 ZINC000026113413 947651905 /nfs/dbraw/zinc/65/19/05/947651905.db2.gz FRXRQEIVTYDQDG-UHFFFAOYSA-N 0 0 364.357 3.852 20 5 FHBDRN CSCC[C@H](C)N(C)C(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000074954692 947662812 /nfs/dbraw/zinc/66/28/12/947662812.db2.gz VYMMXTUQCKCTOZ-VIFPVBQESA-N 0 0 350.362 3.827 20 5 FHBDRN C[C@@H](NS(=O)(=O)c1ccccc1[N+](=O)[O-])c1cccc2ccccc21 ZINC000016090618 947665377 /nfs/dbraw/zinc/66/53/77/947665377.db2.gz IOOBIHBLDGTTEG-CYBMUJFWSA-N 0 0 356.403 3.788 20 5 FHBDRN O=C(c1ccccc1Sc1ccccc1[N+](=O)[O-])N1CCCOCC1 ZINC000440712582 947667356 /nfs/dbraw/zinc/66/73/56/947667356.db2.gz AGPJXKLSMNXYPF-UHFFFAOYSA-N 0 0 358.419 3.609 20 5 FHBDRN COc1nc(C)c(NCc2ccc(-n3nc(C)cc3C)cc2)cc1[N+](=O)[O-] ZINC001167794619 947672471 /nfs/dbraw/zinc/67/24/71/947672471.db2.gz NNVAESURMBBMGD-UHFFFAOYSA-N 0 0 367.409 3.721 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1N[C@@H](CO)c1cccc(F)c1 ZINC000523875242 947686160 /nfs/dbraw/zinc/68/61/60/947686160.db2.gz OWTSCROMOIUCCT-ZDUSSCGKSA-N 0 0 355.163 3.642 20 5 FHBDRN CCCCSCCC(=O)O[C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000759936168 947693191 /nfs/dbraw/zinc/69/31/91/947693191.db2.gz TURRAOUZCKLIOC-KGLIPLIRSA-N 0 0 355.460 3.742 20 5 FHBDRN Cn1nc(-c2cc(F)cc(F)c2)cc1NC(=O)c1ccccc1[N+](=O)[O-] ZINC000487511794 947693631 /nfs/dbraw/zinc/69/36/31/947693631.db2.gz IGCYLEWSOYLDAD-UHFFFAOYSA-N 0 0 358.304 3.526 20 5 FHBDRN Cc1cccc([C@H](C)C(=O)O[C@@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)c1 ZINC000759936797 947710097 /nfs/dbraw/zinc/71/00/97/947710097.db2.gz VQPQGGJXAPXWHJ-USXIJHARSA-N 0 0 357.410 3.930 20 5 FHBDRN Cc1cccc(NC(=O)Cc2noc(/C=C/c3ccccc3[N+](=O)[O-])n2)c1 ZINC000445324298 947728389 /nfs/dbraw/zinc/72/83/89/947728389.db2.gz UNUDOLBCLYSEAV-MDZDMXLPSA-N 0 0 364.361 3.638 20 5 FHBDRN O=C(NC[C@@H]1CCOC2(CCC2)C1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000458996685 947730890 /nfs/dbraw/zinc/73/08/90/947730890.db2.gz HCMZPHWKBOKTRS-MRXNPFEDSA-N 0 0 373.453 3.618 20 5 FHBDRN Cc1nc(-c2ccc(C(=O)NCc3ccccc3[N+](=O)[O-])cc2)cs1 ZINC000440727617 947739073 /nfs/dbraw/zinc/73/90/73/947739073.db2.gz CZEGUDGQMPFCSK-UHFFFAOYSA-N 0 0 353.403 3.957 20 5 FHBDRN Cc1c2ccccc2oc1C(=O)COC(=O)c1c(C)cccc1[N+](=O)[O-] ZINC000026118604 947745583 /nfs/dbraw/zinc/74/55/83/947745583.db2.gz NJURYDQLSPURAQ-UHFFFAOYSA-N 0 0 353.330 3.998 20 5 FHBDRN Cc1ccc(NC(=O)Cc2noc(-c3cc([N+](=O)[O-])ccc3C)n2)c(C)c1 ZINC000445361871 947754710 /nfs/dbraw/zinc/75/47/10/947754710.db2.gz BWGNGPBJXZGXSA-UHFFFAOYSA-N 0 0 366.377 3.751 20 5 FHBDRN CCCN(C(=O)[C@@H]1Cc2cc(Cl)ccc2O1)c1cccc([N+](=O)[O-])c1 ZINC000441470709 947771642 /nfs/dbraw/zinc/77/16/42/947771642.db2.gz JSHZPBQJOUEHDR-KRWDZBQOSA-N 0 0 360.797 3.995 20 5 FHBDRN CCNc1ccc(C(=O)N2CC[C@H](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000125787554 947797464 /nfs/dbraw/zinc/79/74/64/947797464.db2.gz ZEBYMRMEPMTWQU-MRXNPFEDSA-N 0 0 353.422 3.731 20 5 FHBDRN Cc1cc(C(=O)N2C[C@H](C)N(Cc3ccccc3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000500441176 947803788 /nfs/dbraw/zinc/80/37/88/947803788.db2.gz XOQSSTCLYBLGGQ-IRXDYDNUSA-N 0 0 367.449 3.638 20 5 FHBDRN Cc1cc(NC(=O)N2CCO[C@@H](c3cccc(F)c3)C2)ccc1[N+](=O)[O-] ZINC000184601294 947804463 /nfs/dbraw/zinc/80/44/63/947804463.db2.gz RQYLFKSNWODJLE-QGZVFWFLSA-N 0 0 359.357 3.648 20 5 FHBDRN Cc1cc(NC(=O)N[C@@H](c2ccccc2)[C@@H]2CCCO2)ccc1[N+](=O)[O-] ZINC000184608175 947843839 /nfs/dbraw/zinc/84/38/39/947843839.db2.gz VISWCFCEGIULLW-ROUUACIJSA-N 0 0 355.394 3.945 20 5 FHBDRN CC(=O)N(c1ccc(NC(=O)c2cc(C)ccc2[N+](=O)[O-])cc1)[C@@H]1C[C@H]1C ZINC000294305433 947869248 /nfs/dbraw/zinc/86/92/48/947869248.db2.gz XEAFFTDHQFEFEG-BFUOFWGJSA-N 0 0 367.405 3.917 20 5 FHBDRN CC(C)c1nc2n(n1)CCC[C@H]2Nc1ccnc2c1cccc2[N+](=O)[O-] ZINC000432311416 947872075 /nfs/dbraw/zinc/87/20/75/947872075.db2.gz LAZJDQHJCBPYJU-CQSZACIVSA-N 0 0 352.398 3.805 20 5 FHBDRN CCN(CC(=O)Nc1c(F)cccc1F)c1ccc([N+](=O)[O-])cc1Cl ZINC000015167130 947877941 /nfs/dbraw/zinc/87/79/41/947877941.db2.gz VZROVHXFJCDIOV-UHFFFAOYSA-N 0 0 369.755 3.991 20 5 FHBDRN CC(C)[C@@H](C)NC(=O)C1CCN(c2ccnc3c2cccc3[N+](=O)[O-])CC1 ZINC000432314357 947934579 /nfs/dbraw/zinc/93/45/79/947934579.db2.gz NWWRODNSEOWLMP-CQSZACIVSA-N 0 0 370.453 3.520 20 5 FHBDRN CC(C)CO[C@H](C)c1noc(CN2c3ccc([N+](=O)[O-])cc3C[C@H]2C)n1 ZINC000072911533 947952841 /nfs/dbraw/zinc/95/28/41/947952841.db2.gz FNBHZZIZSMIQDA-CHWSQXEVSA-N 0 0 360.414 3.663 20 5 FHBDRN Cc1ccc([C@@H](C)NCc2nc(Cc3cccc(F)c3)no2)cc1[N+](=O)[O-] ZINC000278882663 947966785 /nfs/dbraw/zinc/96/67/85/947966785.db2.gz PKUOYHFWEQQDDG-CYBMUJFWSA-N 0 0 370.384 3.867 20 5 FHBDRN CCc1nn(C)c(N2CCC(Oc3ccc(C)c(C)c3)CC2)c1[N+](=O)[O-] ZINC000094138583 947969510 /nfs/dbraw/zinc/96/95/10/947969510.db2.gz GWLBJHFKMXKUPT-UHFFFAOYSA-N 0 0 358.442 3.555 20 5 FHBDRN CN(Cc1ccc([S@@](C)=O)cc1)c1ccnc2c1cccc2[N+](=O)[O-] ZINC000432319755 948002718 /nfs/dbraw/zinc/00/27/18/948002718.db2.gz IJMPIYHGCWTMAZ-RUZDIDTESA-N 0 0 355.419 3.517 20 5 FHBDRN CCS[C@H](C(=O)O[C@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)C(C)C ZINC000759944423 948004775 /nfs/dbraw/zinc/00/47/75/948004775.db2.gz GKXNUEPNOHUVOJ-YDHLFZDLSA-N 0 0 355.460 3.596 20 5 FHBDRN CC(C)c1ccc(CN(C)CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000105323550 948004948 /nfs/dbraw/zinc/00/49/48/948004948.db2.gz IMHLDGOIUMTMLA-UHFFFAOYSA-N 0 0 355.438 3.813 20 5 FHBDRN CCc1nn(C)c(N[C@@H]2CCc3c2cccc3Br)c1[N+](=O)[O-] ZINC000094154836 948019212 /nfs/dbraw/zinc/01/92/12/948019212.db2.gz BMWPPZFRIAGBOI-CYBMUJFWSA-N 0 0 365.231 3.753 20 5 FHBDRN O=C(CSc1ncc2ccccn21)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000024715518 948027827 /nfs/dbraw/zinc/02/78/27/948027827.db2.gz ZFLFGMHIFMDVDC-UHFFFAOYSA-N 0 0 362.798 3.627 20 5 FHBDRN CC(C)[C@H]1C[C@@H](CNC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)CCO1 ZINC000459079255 948035893 /nfs/dbraw/zinc/03/58/93/948035893.db2.gz UIAFGYCSHBYCNH-WMLDXEAASA-N 0 0 363.458 3.580 20 5 FHBDRN COc1cccc(CN(C)C(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)c1 ZINC000025171000 948064658 /nfs/dbraw/zinc/06/46/58/948064658.db2.gz NRMATCSRCMFFMN-CYBMUJFWSA-N 0 0 360.435 3.743 20 5 FHBDRN Cc1cc(N2CCC(Nc3c(Cl)cccc3[N+](=O)[O-])CC2)nc(C)n1 ZINC000432326747 948071678 /nfs/dbraw/zinc/07/16/78/948071678.db2.gz PZCGJSNMUPMVNZ-UHFFFAOYSA-N 0 0 361.833 3.736 20 5 FHBDRN CCOc1cccc(C(=O)O[C@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)c1 ZINC000759945474 948071811 /nfs/dbraw/zinc/07/18/11/948071811.db2.gz GOSOXCCPSCJKBE-HOTGVXAUSA-N 0 0 359.382 3.531 20 5 FHBDRN O=[N+]([O-])c1cccc2c(N3CCc4c(cnn4-c4ccccc4)C3)ccnc21 ZINC000432326703 948072490 /nfs/dbraw/zinc/07/24/90/948072490.db2.gz CUDLMJDFZYFFTK-UHFFFAOYSA-N 0 0 371.400 3.891 20 5 FHBDRN O=[N+]([O-])c1cccc2c(NCc3ccc(OCC4CC4)nc3)ccnc21 ZINC000432325802 948074585 /nfs/dbraw/zinc/07/45/85/948074585.db2.gz NGQJGKXHIFTQAI-UHFFFAOYSA-N 0 0 350.378 3.939 20 5 FHBDRN O=[N+]([O-])c1cccc2c(N3CCO[C@@H](c4ccc(F)c(F)c4)C3)ccnc21 ZINC000432328222 948082030 /nfs/dbraw/zinc/08/20/30/948082030.db2.gz VXKUJQWZYICWTR-GOSISDBHSA-N 0 0 371.343 3.999 20 5 FHBDRN CCC[C@H](C)NC(=O)[C@@H]1CCCN(c2ccnc3c2cccc3[N+](=O)[O-])C1 ZINC000432330671 948092424 /nfs/dbraw/zinc/09/24/24/948092424.db2.gz DJGPRBJAKCMNFX-LSDHHAIUSA-N 0 0 370.453 3.664 20 5 FHBDRN COc1ccc(N[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1F ZINC000120393113 948107934 /nfs/dbraw/zinc/10/79/34/948107934.db2.gz YKUTVWYKJGXEAU-SECBINFHSA-N 0 0 367.764 3.835 20 5 FHBDRN C[C@H](Oc1ccc([N+](=O)[O-])c(CO)c1)C(=O)Nc1ccc(C(C)(C)C)cc1 ZINC000432331806 948113878 /nfs/dbraw/zinc/11/38/78/948113878.db2.gz QOGHTVHUCDEMHK-ZDUSSCGKSA-N 0 0 372.421 3.791 20 5 FHBDRN CC(C)N(CC(=O)Nc1ccc(F)cc1)Cc1c(F)cccc1[N+](=O)[O-] ZINC000507767813 948119186 /nfs/dbraw/zinc/11/91/86/948119186.db2.gz DYDORVCUBPMCIN-UHFFFAOYSA-N 0 0 363.364 3.722 20 5 FHBDRN CCn1cnnc1-c1ccccc1NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000129565140 948161735 /nfs/dbraw/zinc/16/17/35/948161735.db2.gz STIYJQSSRISNNH-UHFFFAOYSA-N 0 0 371.784 3.779 20 5 FHBDRN O=[N+]([O-])c1cccc(Cl)c1NCCc1csc(N2CCCC2)n1 ZINC000432341139 948166597 /nfs/dbraw/zinc/16/65/97/948166597.db2.gz UCRYMBDWLZTGCO-UHFFFAOYSA-N 0 0 352.847 3.960 20 5 FHBDRN COC(=O)c1cc(-c2nc([C@@H]3C[C@H]3c3ccccc3)no2)cc([N+](=O)[O-])c1 ZINC000512009628 948177182 /nfs/dbraw/zinc/17/71/82/948177182.db2.gz PMLLWYFOCIWONQ-JKSUJKDBSA-N 0 0 365.345 3.703 20 5 FHBDRN Cc1ccc(NCCCNC(=O)c2cccc(Cl)c2F)c([N+](=O)[O-])c1 ZINC001126296038 948181355 /nfs/dbraw/zinc/18/13/55/948181355.db2.gz YZTDSFUBDRAWSD-UHFFFAOYSA-N 0 0 365.792 3.928 20 5 FHBDRN COc1cc(C(=O)NCC(C)(C)c2cccc(Cl)c2)ccc1[N+](=O)[O-] ZINC000512014170 948193355 /nfs/dbraw/zinc/19/33/55/948193355.db2.gz CUUZDCDNFFPKLZ-UHFFFAOYSA-N 0 0 362.813 3.964 20 5 FHBDRN Cn1cc([N+](=O)[O-])cc1C(=O)N1CCC[C@H]1Cc1c(F)cccc1Cl ZINC000520517220 948219212 /nfs/dbraw/zinc/21/92/12/948219212.db2.gz RHPFTKOEQCEVDE-NSHDSACASA-N 0 0 365.792 3.573 20 5 FHBDRN Cc1ccccc1OCCCNC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000520521289 948225435 /nfs/dbraw/zinc/22/54/35/948225435.db2.gz FQNZZCZGSHJFRU-UHFFFAOYSA-N 0 0 353.378 3.583 20 5 FHBDRN O=C(Nc1ccc(OCc2ccncc2)cc1)c1ccc([N+](=O)[O-])s1 ZINC000520530635 948238230 /nfs/dbraw/zinc/23/82/30/948238230.db2.gz IYOVCDBSUQQUSS-UHFFFAOYSA-N 0 0 355.375 3.883 20 5 FHBDRN COc1cccc(CC(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)c1 ZINC000585750555 948257885 /nfs/dbraw/zinc/25/78/85/948257885.db2.gz WOVCSSRCMWMWNL-UHFFFAOYSA-N 0 0 365.183 3.547 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])N1CCCC[C@H]1Cc1ccc(F)cc1 ZINC000520542553 948259057 /nfs/dbraw/zinc/25/90/57/948259057.db2.gz HZDSRGNJRJUWRM-KRWDZBQOSA-N 0 0 371.412 3.770 20 5 FHBDRN O=C(CSc1ccccc1[N+](=O)[O-])OCc1cc(-c2ccco2)on1 ZINC000019184247 948263227 /nfs/dbraw/zinc/26/32/27/948263227.db2.gz GAKOYWBZCWUJKP-UHFFFAOYSA-N 0 0 360.347 3.678 20 5 FHBDRN CC(C)c1ccc(C(=O)NCCc2ccc3c[nH]nc3c2)cc1[N+](=O)[O-] ZINC000585763948 948274349 /nfs/dbraw/zinc/27/43/49/948274349.db2.gz LDQTUCDAOHVRJP-UHFFFAOYSA-N 0 0 352.394 3.567 20 5 FHBDRN O=C(Nc1cccc(N2CCCC2)c1)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000054087412 948296722 /nfs/dbraw/zinc/29/67/22/948296722.db2.gz OVCNEFMLSBXQIB-UHFFFAOYSA-N 0 0 350.378 3.929 20 5 FHBDRN O=C(Oc1ccc(N2CCCC2=O)cc1)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000019210093 948297258 /nfs/dbraw/zinc/29/72/58/948297258.db2.gz WBUQOBJASNQBGP-UHFFFAOYSA-N 0 0 360.753 3.594 20 5 FHBDRN C/C(=C/c1cccnc1)C(=O)N1CCS[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC001126307944 948304146 /nfs/dbraw/zinc/30/41/46/948304146.db2.gz PRAQPAMZGCIQRS-LVWOJMJRSA-N 0 0 355.419 3.667 20 5 FHBDRN CC(C)Oc1cc(NC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)ccn1 ZINC000614592713 948312071 /nfs/dbraw/zinc/31/20/71/948312071.db2.gz QQIAROAYFDUBOA-GFCCVEGCSA-N 0 0 361.423 3.896 20 5 FHBDRN COc1cccc([N+](=O)[O-])c1NCc1ccc(C)cc1OC[C@H]1CCOC1 ZINC000574703164 948355675 /nfs/dbraw/zinc/35/56/75/948355675.db2.gz GJZNLNABNHCNNC-HNNXBMFYSA-N 0 0 372.421 3.939 20 5 FHBDRN COc1cc(C)c(NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1OC ZINC000006259100 948360002 /nfs/dbraw/zinc/36/00/02/948360002.db2.gz MTFTXYRAKJRCST-UHFFFAOYSA-N 0 0 350.758 3.826 20 5 FHBDRN C[C@@H]1CSCCN(C(=O)c2cccc3c(=O)c4ccccc4[nH]c23)C1 ZINC000278982433 948363756 /nfs/dbraw/zinc/36/37/56/948363756.db2.gz DCNLTFUQMDLUEQ-ZDUSSCGKSA-N 0 0 352.459 3.919 20 5 FHBDRN Cc1c(C(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)cnn1C(C)C ZINC000427605266 948385484 /nfs/dbraw/zinc/38/54/84/948385484.db2.gz XTUKSYNQIXZWIR-UHFFFAOYSA-N 0 0 370.331 3.629 20 5 FHBDRN COc1cc2c(cc1F)CC[C@@H]2NC(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000512087884 948391477 /nfs/dbraw/zinc/39/14/77/948391477.db2.gz HCTCNFYVYCEITI-DIFFPNOSSA-N 0 0 373.384 3.790 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)c1sccc1SC(F)F ZINC000107127542 948403363 /nfs/dbraw/zinc/40/33/63/948403363.db2.gz FVSMTBSYRSTYKK-UHFFFAOYSA-N 0 0 358.391 3.944 20 5 FHBDRN CCc1nocc1CN(C)C(=O)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000512095170 948412073 /nfs/dbraw/zinc/41/20/73/948412073.db2.gz FGLOMLFNWQJOIG-UHFFFAOYSA-N 0 0 361.401 3.504 20 5 FHBDRN C[C@H](OC[C@@H](O)COc1c(F)cccc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000184775692 948427243 /nfs/dbraw/zinc/42/72/43/948427243.db2.gz DXRNFTKQTKYIDL-SMDDNHRTSA-N 0 0 369.776 3.905 20 5 FHBDRN C[C@H]1C[C@@H](c2cccnc2)N(C(=O)CCCNc2ccc([N+](=O)[O-])cc2)C1 ZINC000184777470 948428799 /nfs/dbraw/zinc/42/87/99/948428799.db2.gz QACGVXIYGOJFHQ-KXBFYZLASA-N 0 0 368.437 3.792 20 5 FHBDRN Cc1ccc(N2CCOC2=O)cc1N[C@@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000294475688 948442079 /nfs/dbraw/zinc/44/20/79/948442079.db2.gz WWMVZOAVTCXFIX-LBPRGKRZSA-N 0 0 356.382 3.615 20 5 FHBDRN C[C@@H](C1CC1)N(C)C(=O)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12 ZINC000630640813 948453445 /nfs/dbraw/zinc/45/34/45/948453445.db2.gz RYFQKFYWBGIRAU-JTQLQIEISA-N 0 0 356.372 3.830 20 5 FHBDRN O=C(Cc1cc(F)c(Cl)cc1[N+](=O)[O-])N(Cc1ccncc1)C1CC1 ZINC000279062269 948455183 /nfs/dbraw/zinc/45/51/83/948455183.db2.gz ASOAYAXHCZCLNM-UHFFFAOYSA-N 0 0 363.776 3.516 20 5 FHBDRN CC1(C)C[C@H](Nc2cccc(N3CCNC3=O)c2)c2cc([N+](=O)[O-])ccc21 ZINC000279062222 948455204 /nfs/dbraw/zinc/45/52/04/948455204.db2.gz KYIWYFGRKKMJOT-SFHVURJKSA-N 0 0 366.421 3.959 20 5 FHBDRN O=[N+]([O-])c1cnc(N[C@H]2CCN(c3ccc(Cl)cc3)C2)c(Cl)c1 ZINC000302013554 948459247 /nfs/dbraw/zinc/45/92/47/948459247.db2.gz KXJYYDQEXJEUDE-NSHDSACASA-N 0 0 353.209 3.987 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)N[C@H]2CCc3c2ccc(Cl)c3Cl)n1 ZINC000427611250 948477346 /nfs/dbraw/zinc/47/73/46/948477346.db2.gz YPFKJZXXHYXKMX-NSHDSACASA-N 0 0 369.208 3.535 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NCC(=O)N[C@H](C)c1ccccc1Cl ZINC000025908647 948497136 /nfs/dbraw/zinc/49/71/36/948497136.db2.gz BBGAKZLZHZKVPF-LLVKDONJSA-N 0 0 363.801 3.546 20 5 FHBDRN CCOc1ccc(OC(C)(C)C(=O)NCc2cccc([N+](=O)[O-])c2C)cc1 ZINC000570992374 948510138 /nfs/dbraw/zinc/51/01/38/948510138.db2.gz YOJGGPWUFOXWJP-UHFFFAOYSA-N 0 0 372.421 3.776 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)NCCC[C@H]2CCCC[C@H]2O)cc1[N+](=O)[O-] ZINC000432468653 948510525 /nfs/dbraw/zinc/51/05/25/948510525.db2.gz KNZRGEFQITWQCU-HDMKZQKVSA-N 0 0 363.458 3.595 20 5 FHBDRN COc1cccc([C@H](O)CNc2ccc([N+](=O)[O-])c(-c3ccccc3)n2)c1 ZINC000090092384 948515059 /nfs/dbraw/zinc/51/50/59/948515059.db2.gz HMVOBFFWIMWFNB-GOSISDBHSA-N 0 0 365.389 3.811 20 5 FHBDRN Cc1nn(CCC(=O)Nc2c(C)c(F)ccc2Cl)c(C)c1[N+](=O)[O-] ZINC000279111086 948516169 /nfs/dbraw/zinc/51/61/69/948516169.db2.gz DYVAQTXXBQCVGU-UHFFFAOYSA-N 0 0 354.769 3.538 20 5 FHBDRN C[C@@H](CNC(=O)Cc1ccc(F)cc1[N+](=O)[O-])Oc1ccccc1Cl ZINC001126515653 948521516 /nfs/dbraw/zinc/52/15/16/948521516.db2.gz JMFZUZQRBPKXTJ-NSHDSACASA-N 0 0 366.776 3.514 20 5 FHBDRN COc1ccc(CSCC(=O)N([C@H](C)C2CC2)C2CC2)cc1[N+](=O)[O-] ZINC000520664220 948540004 /nfs/dbraw/zinc/54/00/04/948540004.db2.gz LPPRQCADNLRTNP-GFCCVEGCSA-N 0 0 364.467 3.626 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)N2CCc3ccc(O)cc3C2)cc1[N+](=O)[O-] ZINC000427617169 948558170 /nfs/dbraw/zinc/55/81/70/948558170.db2.gz DHWUHUVJOJUAGU-UHFFFAOYSA-N 0 0 354.406 3.796 20 5 FHBDRN CCOC(=O)c1cccc(NC(=O)c2ccc([N+](=O)[O-])c3cccnc23)c1 ZINC000120930813 948566692 /nfs/dbraw/zinc/56/66/92/948566692.db2.gz DLJBUUVEDPEBOK-UHFFFAOYSA-N 0 0 365.345 3.572 20 5 FHBDRN O=C(c1ccccc1[N+](=O)[O-])N1CCCN(Cc2ccc(Cl)cc2)CC1 ZINC000054122481 948591449 /nfs/dbraw/zinc/59/14/49/948591449.db2.gz GXKJADWMDLMPHW-UHFFFAOYSA-N 0 0 373.840 3.596 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N1CCC[C@@H]1Cc1cccc(F)c1 ZINC000087136838 948607756 /nfs/dbraw/zinc/60/77/56/948607756.db2.gz XQEGAXZHRHZMFP-GOSISDBHSA-N 0 0 356.397 3.900 20 5 FHBDRN COc1cc(C(=O)NCc2ccc3[nH]c(C)c(C)c3c2)ccc1[N+](=O)[O-] ZINC000512168201 948617286 /nfs/dbraw/zinc/61/72/86/948617286.db2.gz UGGNIPMKMITWDL-UHFFFAOYSA-N 0 0 353.378 3.632 20 5 FHBDRN COC(=O)[C@@H](N[C@@H](C)CCc1ccccc1[N+](=O)[O-])c1ccccc1F ZINC000614655188 948625818 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355.438 3.951 20 5 FHBDRN CC[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)C[C@@H]1O ZINC000536468085 948687064 /nfs/dbraw/zinc/68/70/64/948687064.db2.gz MIUOGGBVSRNIAI-GUYCJALGSA-N 0 0 372.446 3.589 20 5 FHBDRN C[C@H](Oc1cnccc1I)c1ccccc1[N+](=O)[O-] ZINC001226634360 948695852 /nfs/dbraw/zinc/69/58/52/948695852.db2.gz LSXJKSMCBHQRFM-VIFPVBQESA-N 0 0 370.146 3.734 20 5 FHBDRN O=[N+]([O-])c1cc(C(F)(F)F)ccc1OCc1nnc(C2CC2)n1C1CC1 ZINC000182107701 948700406 /nfs/dbraw/zinc/70/04/06/948700406.db2.gz RGIBXDUCQPMWAX-UHFFFAOYSA-N 0 0 368.315 3.996 20 5 FHBDRN Cc1c(NCCOCC(F)(F)F)cc(Br)cc1[N+](=O)[O-] ZINC000429807913 948711491 /nfs/dbraw/zinc/71/14/91/948711491.db2.gz OTQCKOHSKNYREF-UHFFFAOYSA-N 0 0 357.126 3.657 20 5 FHBDRN O=C(c1c[nH]c2cccc([N+](=O)[O-])c12)N1CCOC2(C1)CCCCCC2 ZINC000536480802 948718221 /nfs/dbraw/zinc/71/82/21/948718221.db2.gz LACLTWPGJTZMIM-UHFFFAOYSA-N 0 0 357.410 3.642 20 5 FHBDRN Cc1ccc(NC(=O)Cc2noc(-c3cccc([N+](=O)[O-])c3C)n2)c(C)c1 ZINC000445365581 948731030 /nfs/dbraw/zinc/73/10/30/948731030.db2.gz NKVKZYZHKVQVIL-UHFFFAOYSA-N 0 0 366.377 3.751 20 5 FHBDRN CCc1ccc(OCc2nc(Cc3cccc(F)c3)no2)c([N+](=O)[O-])c1 ZINC000447307616 948732333 /nfs/dbraw/zinc/73/23/33/948732333.db2.gz WDJUGOMUSIASEO-UHFFFAOYSA-N 0 0 357.341 3.849 20 5 FHBDRN C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N(C)Cc1ccc(Cl)c(F)c1 ZINC000536488137 948737898 /nfs/dbraw/zinc/73/78/98/948737898.db2.gz MBTIRJKRROIEFE-NSHDSACASA-N 0 0 365.792 3.846 20 5 FHBDRN CC(C)Cn1nccc1-c1nc(Cc2c[nH]c3ccc([N+](=O)[O-])cc23)no1 ZINC000574876329 948751873 /nfs/dbraw/zinc/75/18/73/948751873.db2.gz DPJMGRAXNHRWMQ-UHFFFAOYSA-N 0 0 366.381 3.569 20 5 FHBDRN Cc1nc2ccccc2n1CCc1noc(-c2ccc([N+](=O)[O-])s2)n1 ZINC000445383985 948753215 /nfs/dbraw/zinc/75/32/15/948753215.db2.gz KJSSZEGWMNQWQJ-UHFFFAOYSA-N 0 0 355.379 3.607 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]nc(-c3nc(Cc4ccc5c(c4)CCC5)no3)c2c1 ZINC000445397593 948765312 /nfs/dbraw/zinc/76/53/12/948765312.db2.gz JTVJXZVRNVZLQH-UHFFFAOYSA-N 0 0 361.361 3.601 20 5 FHBDRN O=[N+]([O-])c1cccc(/C=C\c2nc(-c3ccc(-c4nnco4)cc3)no2)c1 ZINC000445400662 948766218 /nfs/dbraw/zinc/76/62/18/948766218.db2.gz FRFWALICGXZPMV-WTKPLQERSA-N 0 0 361.317 3.865 20 5 FHBDRN O=C(O[C@@H]([C@H]1CCCOC1)C(F)(F)F)c1ccc([N+](=O)[O-])cc1Cl ZINC000279303680 948779437 /nfs/dbraw/zinc/77/94/37/948779437.db2.gz XZBLNJNCYBWUOJ-UFBFGSQYSA-N 0 0 367.707 3.763 20 5 FHBDRN O=C(c1n[nH]c2ccc([N+](=O)[O-])cc21)N1CCCCC[C@H]1c1ccncc1 ZINC000130456378 209371051 /nfs/dbraw/zinc/37/10/51/209371051.db2.gz MESISXMYXDZDRG-KRWDZBQOSA-N 0 0 365.393 3.624 20 5 FHBDRN O=C(Nc1ccc2[nH]c([C@@H]3CCCO3)nc2c1)c1csc([N+](=O)[O-])c1 ZINC000115848011 209344098 /nfs/dbraw/zinc/34/40/98/209344098.db2.gz ZCUGMJYDTGQUPP-ZDUSSCGKSA-N 0 0 358.379 3.636 20 5 FHBDRN Cc1cccc(-c2noc(CN3c4ccc([N+](=O)[O-])cc4C[C@@H]3C)n2)c1 ZINC000110887414 209326108 /nfs/dbraw/zinc/32/61/08/209326108.db2.gz LGHHQWDERIZHLG-ZDUSSCGKSA-N 0 0 350.378 3.904 20 5 FHBDRN Cc1c(NC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cccc1[N+](=O)[O-] ZINC000097089920 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COc1ccc([N+](=O)[O-])cc1NCC(=O)Nc1cccc2ccccc21 ZINC000007952663 207213681 /nfs/dbraw/zinc/21/36/81/207213681.db2.gz LRSGFFQIUZEQAA-UHFFFAOYSA-N 0 0 351.362 3.807 20 5 FHBDRN CCOC(=O)c1cc(C(=O)N2CCC[C@H]2c2ccccc2)cc([N+](=O)[O-])c1 ZINC000009956899 207290255 /nfs/dbraw/zinc/29/02/55/207290255.db2.gz CKNCZHSTNLNPDP-SFHVURJKSA-N 0 0 368.389 3.749 20 5 FHBDRN O=C(c1ccc(NC2CC2)c([N+](=O)[O-])c1)N1CCC[C@@H](C(F)(F)F)C1 ZINC000009932012 207290569 /nfs/dbraw/zinc/29/05/69/207290569.db2.gz QTMOYATYVABPNH-LLVKDONJSA-N 0 0 357.332 3.584 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)Nc1ccc(OC(F)F)c(Cl)c1 ZINC000011034976 207309052 /nfs/dbraw/zinc/30/90/52/207309052.db2.gz KSNODDGOKSWDPS-UHFFFAOYSA-N 0 0 372.711 3.867 20 5 FHBDRN CCOC(=O)c1c(C2CC2)csc1NC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000014687347 207524589 /nfs/dbraw/zinc/52/45/89/207524589.db2.gz BULIBJBLNHHEFE-UHFFFAOYSA-N 0 0 360.391 3.963 20 5 FHBDRN O=C(c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)N1CCOCC1 ZINC000015420543 207553998 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O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N1CCC[C@@H]1c1cccs1 ZINC000044761769 208317877 /nfs/dbraw/zinc/31/78/77/208317877.db2.gz RJDRWZOTQSACQR-LLVKDONJSA-N 0 0 372.855 3.836 20 5 FHBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)NC2CCC(c3ccccc3)CC2)cc1 ZINC000046801504 208369730 /nfs/dbraw/zinc/36/97/30/208369730.db2.gz LSWUYIKTWSHOER-UHFFFAOYSA-N 0 0 374.462 3.741 20 5 FHBDRN CC(C)c1nc2cc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3N)ccc2o1 ZINC000048250472 208394282 /nfs/dbraw/zinc/39/42/82/208394282.db2.gz MDZITGXVSBMVDM-UHFFFAOYSA-N 0 0 358.329 3.833 20 5 FHBDRN O=C(c1ccc(Br)s1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000054451493 208455770 /nfs/dbraw/zinc/45/57/70/208455770.db2.gz XQHJSJZHYAMPJW-UHFFFAOYSA-N 0 0 353.197 3.622 20 5 FHBDRN Cc1cc(NC(=O)c2cc(F)cc(F)c2)n(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000069526191 208754099 /nfs/dbraw/zinc/75/40/99/208754099.db2.gz AJMRUGXKGXZBDF-UHFFFAOYSA-N 0 0 358.304 3.619 20 5 FHBDRN C[C@H](NS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1)c1cccc2ccccc21 ZINC000058723711 221122597 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20 5 FHBDRN C[C@H](CC(=O)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1)c1cccnc1 ZINC000452866244 567834776 /nfs/dbraw/zinc/83/47/76/567834776.db2.gz XTCMYYOMNVDDFN-CRAIPNDOSA-N 0 0 353.422 3.890 20 5 FHBDRN CC[C@@H](c1ccccc1OC)N(C)C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000568071985 567835560 /nfs/dbraw/zinc/83/55/60/567835560.db2.gz HCTNOKFXYWJMEN-INIZCTEOSA-N 0 0 368.393 3.703 20 5 FHBDRN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNCc1nnc2n1CCCCC2 ZINC000290937366 567868265 /nfs/dbraw/zinc/86/82/65/567868265.db2.gz SSINHCKAKNUJCC-UHFFFAOYSA-N 0 0 370.240 3.509 20 5 FHBDRN COc1ccc(CC(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cc1F ZINC000452876817 567874248 /nfs/dbraw/zinc/87/42/48/567874248.db2.gz LZUDZKLNRQSQAA-INIZCTEOSA-N 0 0 372.396 3.691 20 5 FHBDRN COc1cc(CNc2ccc3ncccc3c2[N+](=O)[O-])cc(OC)c1OC ZINC000051423016 567878960 /nfs/dbraw/zinc/87/89/60/567878960.db2.gz FQSRBEAEBUZWIS-UHFFFAOYSA-N 0 0 369.377 3.781 20 5 FHBDRN CC(C)Oc1cccc([C@@H](C)NC(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)c1 ZINC000481388530 567881632 /nfs/dbraw/zinc/88/16/32/567881632.db2.gz YDBKFFYHMDCKPP-GFCCVEGCSA-N 0 0 368.393 3.749 20 5 FHBDRN Cc1noc(C)c1CCC(=O)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452884409 567885547 /nfs/dbraw/zinc/88/55/47/567885547.db2.gz PWLLDULCRUMRSV-INIZCTEOSA-N 0 0 357.410 3.538 20 5 FHBDRN COc1cccc(C(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)c1OC ZINC000452884468 567886150 /nfs/dbraw/zinc/88/61/50/567886150.db2.gz QCBICNSVPYHHHG-HNNXBMFYSA-N 0 0 370.405 3.632 20 5 FHBDRN COc1cc(OC)cc(C(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000452882029 567886763 /nfs/dbraw/zinc/88/67/63/567886763.db2.gz OXXYBXXMVCSJHD-HNNXBMFYSA-N 0 0 370.405 3.632 20 5 FHBDRN CC(C)[C@H]1C[C@@H](CNC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)CCO1 ZINC000452898196 567908928 /nfs/dbraw/zinc/90/89/28/567908928.db2.gz SBSLMRFIHMNQCR-GRDNDAEWSA-N 0 0 366.483 3.643 20 5 FHBDRN Cc1ccc(OCC(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000452893655 567909146 /nfs/dbraw/zinc/90/91/46/567909146.db2.gz XGFYHZKTOCRTKV-QGZVFWFLSA-N 0 0 354.406 3.688 20 5 FHBDRN CC(C)[C@H]1C[C@@H](CNC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CCO1 ZINC000452891675 567911045 /nfs/dbraw/zinc/91/10/45/567911045.db2.gz OOOLWEYNMMHXEY-SWLSCSKDSA-N 0 0 362.451 3.991 20 5 FHBDRN COC(=O)c1ccc([C@@H](NCc2ccccc2[N+](=O)[O-])C(F)(F)F)cc1 ZINC000481432511 567922693 /nfs/dbraw/zinc/92/26/93/567922693.db2.gz GLZRYSOQBACGRN-OAHLLOKOSA-N 0 0 368.311 3.775 20 5 FHBDRN O=C(NC[C@@H]1CCN(c2ccccc2)C1)c1cc([N+](=O)[O-])ccc1Cl ZINC000264971940 567946490 /nfs/dbraw/zinc/94/64/90/567946490.db2.gz ZDGRIMNLFJVLDE-ZDUSSCGKSA-N 0 0 359.813 3.505 20 5 FHBDRN CC(C)CCOc1ccccc1CNC(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-] ZINC000481461937 567955341 /nfs/dbraw/zinc/95/53/41/567955341.db2.gz BDAWLGHBVBHUPH-UHFFFAOYSA-N 0 0 374.441 3.796 20 5 FHBDRN Cc1c(CNC(=O)c2ccc(F)cc2OC(F)F)cccc1[N+](=O)[O-] ZINC000481461138 567956490 /nfs/dbraw/zinc/95/64/90/567956490.db2.gz ADOFZFSQFOVGFL-UHFFFAOYSA-N 0 0 354.284 3.574 20 5 FHBDRN Cc1c(CNC(=O)COc2ccc(Cl)cc2Cl)cccc1[N+](=O)[O-] ZINC000481466042 567965109 /nfs/dbraw/zinc/96/51/09/567965109.db2.gz OOIRNXIWOYOLLG-UHFFFAOYSA-N 0 0 369.204 3.905 20 5 FHBDRN CSc1cc(C(=O)NCc2cccc([N+](=O)[O-])c2C)ccc1NC(C)=O ZINC000481466290 567970443 /nfs/dbraw/zinc/97/04/43/567970443.db2.gz MWJRYIRELIEKCT-UHFFFAOYSA-N 0 0 373.434 3.514 20 5 FHBDRN Cc1ccc(Cl)c(O[C@@H](C)C(=O)NCc2cccc([N+](=O)[O-])c2C)c1 ZINC000481477622 567979191 /nfs/dbraw/zinc/97/91/91/567979191.db2.gz HVTBFBSJHRCUST-ZDUSSCGKSA-N 0 0 362.813 3.949 20 5 FHBDRN Cc1ccc(Cl)c(O[C@H](C)C(=O)NCc2cccc([N+](=O)[O-])c2C)c1 ZINC000481477621 567980722 /nfs/dbraw/zinc/98/07/22/567980722.db2.gz HVTBFBSJHRCUST-CYBMUJFWSA-N 0 0 362.813 3.949 20 5 FHBDRN CCc1c(C(=O)NCc2cccc([N+](=O)[O-])c2C)cnn1C(CC)CC ZINC000481501666 568007064 /nfs/dbraw/zinc/00/70/64/568007064.db2.gz KYPXMCJYMHUKFM-UHFFFAOYSA-N 0 0 358.442 3.953 20 5 FHBDRN CCCc1nc(C)c(CNCc2cc(Br)c([N+](=O)[O-])s2)o1 ZINC000602671799 568008039 /nfs/dbraw/zinc/00/80/39/568008039.db2.gz IZPZIZGPMVMHGG-UHFFFAOYSA-N 0 0 374.260 3.958 20 5 FHBDRN O=C(C1CC1)[C@H]1CN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CCO1 ZINC000568338200 568026292 /nfs/dbraw/zinc/02/62/92/568026292.db2.gz WCIVBMPPZFKAQT-QGZVFWFLSA-N 0 0 372.446 3.503 20 5 FHBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+](CCc1ccccc1)CC(=O)[O-] ZINC000568404468 568030920 /nfs/dbraw/zinc/03/09/20/568030920.db2.gz SZHLJCDWAQWVQX-UHFFFAOYSA-N 0 0 372.421 3.511 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCN(Cc3ccsc3)CC2)cc1OC(F)F ZINC000568459880 568040121 /nfs/dbraw/zinc/04/01/21/568040121.db2.gz DTRKKAHXVQBVLA-UHFFFAOYSA-N 0 0 369.393 3.580 20 5 FHBDRN CC(C)[C@H]1CN(C(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)c2ccccc21 ZINC000568463435 568040207 /nfs/dbraw/zinc/04/02/07/568040207.db2.gz XMVVYUPMIXLAKI-CQSZACIVSA-N 0 0 354.362 3.724 20 5 FHBDRN O=C(c1csc(-c2cccc([N+](=O)[O-])c2)n1)N1CCCc2ncccc21 ZINC000065095440 568042414 /nfs/dbraw/zinc/04/24/14/568042414.db2.gz AUAKNTZKLXSZAD-UHFFFAOYSA-N 0 0 366.402 3.706 20 5 FHBDRN C[C@@H]([NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1)c1cccc(N2CCCC2)c1 ZINC000181873103 568049577 /nfs/dbraw/zinc/04/95/77/568049577.db2.gz HVEWWEXITLBLRI-QRWLVFNGSA-N 0 0 355.438 3.579 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1N1CC2(CCC2)[C@@H]1[C@H]1CCCO1 ZINC000408223948 568050059 /nfs/dbraw/zinc/05/00/59/568050059.db2.gz FUZOOPSLGHXUQB-CABCVRRESA-N 0 0 367.243 3.895 20 5 FHBDRN CC1(C)CCN(S(=O)(=O)CCc2ccccc2[N+](=O)[O-])c2ccccc21 ZINC000568554142 568050818 /nfs/dbraw/zinc/05/08/18/568050818.db2.gz NSLOSPHLIXSQOT-UHFFFAOYSA-N 0 0 374.462 3.655 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N[C@H]1C[C@H](c2ccc(F)cc2)C1 ZINC000481603132 568061536 /nfs/dbraw/zinc/06/15/36/568061536.db2.gz ZYRBHSGMBZOOFE-CTYIDZIISA-N 0 0 362.788 3.992 20 5 FHBDRN CCN(C(=O)NCc1cc([N+](=O)[O-])ccc1Cl)[C@@H]1CCOC(C)(C)C1 ZINC000291149495 568063901 /nfs/dbraw/zinc/06/39/01/568063901.db2.gz XRTVSVHSIXPJQM-CQSZACIVSA-N 0 0 369.849 3.737 20 5 FHBDRN CSc1ccc(C(=O)NC[C@H]2CCC3(CCCCC3)O2)cc1[N+](=O)[O-] ZINC000481620293 568068433 /nfs/dbraw/zinc/06/84/33/568068433.db2.gz BEBLEOPVWQXRDA-CQSZACIVSA-N 0 0 364.467 3.928 20 5 FHBDRN O=C(Nc1c2c(ccc1F)OCO2)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000603155505 568068619 /nfs/dbraw/zinc/06/86/19/568068619.db2.gz OMIGCPBNWBPMGH-UHFFFAOYSA-N 0 0 373.340 3.659 20 5 FHBDRN CCNc1ccc(C(=O)NC[C@H]2CCC3(CCCCC3)O2)cc1[N+](=O)[O-] ZINC000481636423 568074844 /nfs/dbraw/zinc/07/48/44/568074844.db2.gz WRGUSLVOXDZOSD-OAHLLOKOSA-N 0 0 361.442 3.638 20 5 FHBDRN O=C(NCc1cccc([N+](=O)[O-])c1)Nc1ccc2oc(C3CC3)nc2c1 ZINC000067664481 568080376 /nfs/dbraw/zinc/08/03/76/568080376.db2.gz NCCCJKZGNDNDNL-UHFFFAOYSA-N 0 0 352.350 3.935 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(Oc2ccc(C(=O)Nc3cccnc3)cc2)n1 ZINC000481677634 568085713 /nfs/dbraw/zinc/08/57/13/568085713.db2.gz PSNSGHJYSUWBNQ-UHFFFAOYSA-N 0 0 350.334 3.738 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)NCCCCOCc1ccccc1 ZINC000051582229 568090007 /nfs/dbraw/zinc/09/00/07/568090007.db2.gz PUMJEQTZUOXKKZ-UHFFFAOYSA-N 0 0 373.409 3.722 20 5 FHBDRN CN(Cc1ccc(F)cc1Br)C(=O)c1ccc([N+](=O)[O-])s1 ZINC000481697030 568092312 /nfs/dbraw/zinc/09/23/12/568092312.db2.gz QMJVSOXUSWKNAG-UHFFFAOYSA-N 0 0 373.203 3.830 20 5 FHBDRN O=C(N[C@@H]1CCC[C@H]2OCC[C@H]21)c1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000291284540 568095873 /nfs/dbraw/zinc/09/58/73/568095873.db2.gz GJXZIJNJJMHMGE-ZWKOPEQDSA-N 0 0 359.209 3.589 20 5 FHBDRN O=[N+]([O-])c1cccc(CNc2ccnc3cc(Br)cnc32)c1 ZINC000128633913 568096778 /nfs/dbraw/zinc/09/67/78/568096778.db2.gz NNIHLPHUMUSEKG-UHFFFAOYSA-N 0 0 359.183 3.913 20 5 FHBDRN CCO[C@@H]1C[C@H](N(C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1(C)C ZINC000481724937 568098276 /nfs/dbraw/zinc/09/82/76/568098276.db2.gz CUTSDFSECJQLFF-UONOGXRCSA-N 0 0 355.822 3.916 20 5 FHBDRN Cc1cnc(OCC(=O)N[C@H](C)c2ccc(CC(C)C)cc2)c([N+](=O)[O-])c1 ZINC000481737510 568099785 /nfs/dbraw/zinc/09/97/85/568099785.db2.gz OZEPQVXIHVIMEX-OAHLLOKOSA-N 0 0 371.437 3.753 20 5 FHBDRN C[C@H]1[C@H](C(F)(F)F)CCCN1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000481738697 568100098 /nfs/dbraw/zinc/10/00/98/568100098.db2.gz FGOMTDQPCFBJCX-IINYFYTJSA-N 0 0 360.332 3.624 20 5 FHBDRN C[C@]1(CN[C@@H](c2ccc([N+](=O)[O-])cc2)C(F)(F)F)CCO[C@@H]1C1CC1 ZINC000568641002 568103588 /nfs/dbraw/zinc/10/35/88/568103588.db2.gz BTIGFMVHUYAJOP-ARFHVFGLSA-N 0 0 358.360 3.993 20 5 FHBDRN CC(C)Cc1ccc([C@@H](NC(=O)Cn2cc([N+](=O)[O-])cn2)C(C)C)cc1 ZINC000603484817 568105989 /nfs/dbraw/zinc/10/59/89/568105989.db2.gz BPMRREVQOWHWPV-IBGZPJMESA-N 0 0 358.442 3.503 20 5 FHBDRN C[C@@]1(NC(=O)c2cc(Cl)cc(Cl)c2[N+](=O)[O-])CCO[C@H]1C1CC1 ZINC000291344403 568118532 /nfs/dbraw/zinc/11/85/32/568118532.db2.gz ABDFOPKFYKPHDJ-DZGCQCFKSA-N 0 0 359.209 3.589 20 5 FHBDRN Cc1nc(NC(=O)COc2ccc([N+](=O)[O-])cc2)ccc1-c1ccccc1 ZINC000568691512 568123579 /nfs/dbraw/zinc/12/35/79/568123579.db2.gz OIXPSPFEBVRRAL-UHFFFAOYSA-N 0 0 363.373 3.983 20 5 FHBDRN Cc1cc(NC(=O)C[C@@H](C)c2ccncc2)n(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000159301478 568123647 /nfs/dbraw/zinc/12/36/47/568123647.db2.gz OJPCORSYTWYUQF-CYBMUJFWSA-N 0 0 365.393 3.616 20 5 FHBDRN COC(=O)c1cccc(-c2noc(/C(C)=C\c3ccc([N+](=O)[O-])cc3)n2)c1 ZINC000568697842 568127423 /nfs/dbraw/zinc/12/74/23/568127423.db2.gz CMWDAGODTIXNBO-BENRWUELSA-N 0 0 365.345 3.992 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)N[C@H](c1ccccc1)C(F)F ZINC000481874131 568140721 /nfs/dbraw/zinc/14/07/21/568140721.db2.gz SFTAXVVJRFONJX-QGZVFWFLSA-N 0 0 363.364 3.910 20 5 FHBDRN CC(=O)c1cc(N2CCN(c3cccc(Cl)c3)CC2)ccc1[N+](=O)[O-] ZINC000328326048 568141920 /nfs/dbraw/zinc/14/19/20/568141920.db2.gz RNNJYIFLDMAEPY-UHFFFAOYSA-N 0 0 359.813 3.777 20 5 FHBDRN COc1ccc(Cl)cc1NC(=O)COc1ccc(Cl)cc1[N+](=O)[O-] ZINC000024845916 568143123 /nfs/dbraw/zinc/14/31/23/568143123.db2.gz FAXGZZUQODNLHG-UHFFFAOYSA-N 0 0 371.176 3.928 20 5 FHBDRN CCOc1ccc(-c2noc(COc3cc([N+](=O)[O-])ccc3C)n2)cc1 ZINC000603725940 568143202 /nfs/dbraw/zinc/14/32/02/568143202.db2.gz NYMAPFOJPWWXJA-UHFFFAOYSA-N 0 0 355.350 3.931 20 5 FHBDRN CCC(=O)Nc1ccc(C)c(NC(=O)CSc2ccccc2[N+](=O)[O-])c1 ZINC000481833497 568147922 /nfs/dbraw/zinc/14/79/22/568147922.db2.gz ZPIPZPCKRAYHIS-UHFFFAOYSA-N 0 0 373.434 3.983 20 5 FHBDRN COCCCCc1cccnc1NC(=O)/C=C/c1ccccc1[N+](=O)[O-] ZINC000291475444 568150751 /nfs/dbraw/zinc/15/07/51/568150751.db2.gz PWGCOUJOSDEAFZ-VAWYXSNFSA-N 0 0 355.394 3.611 20 5 FHBDRN CN(C(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)c1cccc2ncccc21 ZINC000128680424 568153647 /nfs/dbraw/zinc/15/36/47/568153647.db2.gz RNNDZVMHYNBKNE-UHFFFAOYSA-N 0 0 373.372 3.605 20 5 FHBDRN COC(=O)c1cc(OCC(=O)c2c(C)cc(C)cc2C)ccc1[N+](=O)[O-] ZINC000481895444 568167922 /nfs/dbraw/zinc/16/79/22/568167922.db2.gz CTCFOQJBLHZGFB-UHFFFAOYSA-N 0 0 357.362 3.568 20 5 FHBDRN CC(C)(C)c1ccc(-c2csc(NC(=O)c3n[nH]cc3[N+](=O)[O-])n2)cc1 ZINC000159354024 568184326 /nfs/dbraw/zinc/18/43/26/568184326.db2.gz IHPGECFEYNYNMM-UHFFFAOYSA-N 0 0 371.422 3.991 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)Nc1cccc(C(F)F)c1 ZINC000481949143 568195312 /nfs/dbraw/zinc/19/53/12/568195312.db2.gz BCRLNFGHNRPAPD-UHFFFAOYSA-N 0 0 356.350 3.950 20 5 FHBDRN Cc1cccc(-c2nnc(N(C)Cc3ccccc3[N+](=O)[O-])n2C2CC2)n1 ZINC000568774023 568201112 /nfs/dbraw/zinc/20/11/12/568201112.db2.gz MYENGNVNQZTWAP-UHFFFAOYSA-N 0 0 364.409 3.528 20 5 FHBDRN CC(C)n1cc2c(n1)C[C@@H](Nc1ccc([N+](=O)[O-])c(OC(F)F)c1)CC2 ZINC000481979650 568214788 /nfs/dbraw/zinc/21/47/88/568214788.db2.gz HSZBHQGPFPYJIE-LBPRGKRZSA-N 0 0 366.368 3.943 20 5 FHBDRN C[C@@H](NC(=O)N1CC(C)(C)[C@@H]1c1cccnc1)c1cccc([N+](=O)[O-])c1 ZINC000291590233 568217010 /nfs/dbraw/zinc/21/70/10/568217010.db2.gz HKJBTXDDJXHHEX-DYVFJYSZSA-N 0 0 354.410 3.844 20 5 FHBDRN CC(C)(C)OC(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])o2)c2ccccc21 ZINC000291599013 568220950 /nfs/dbraw/zinc/22/09/50/568220950.db2.gz LRGRGRRXUBOARL-UHFFFAOYSA-N 0 0 373.365 3.590 20 5 FHBDRN C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000482004097 568226246 /nfs/dbraw/zinc/22/62/46/568226246.db2.gz BLIBJGDEGKNRPJ-SWLSCSKDSA-N 0 0 373.375 3.976 20 5 FHBDRN C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1c[nH]c2ccc([N+](=O)[O-])cc21 ZINC000482005298 568226282 /nfs/dbraw/zinc/22/62/82/568226282.db2.gz KIZVOKOGOSDZPZ-TVQRCGJNSA-N 0 0 355.316 3.879 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@]2(C1)OCc1ccccc12 ZINC000568807463 568229288 /nfs/dbraw/zinc/22/92/88/568229288.db2.gz SAZMTPBKTXYMDB-HXUWFJFHSA-N 0 0 367.405 3.821 20 5 FHBDRN O=C(CSc1ccccc1[N+](=O)[O-])NCC(F)(F)c1ccccc1 ZINC000568810750 568229420 /nfs/dbraw/zinc/22/94/20/568229420.db2.gz YOCGGURJBWMHDO-UHFFFAOYSA-N 0 0 352.362 3.595 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)Cc1csc(-c2ccccc2)n1 ZINC000043841236 568230920 /nfs/dbraw/zinc/23/09/20/568230920.db2.gz DPYYRUKTZYQCIK-UHFFFAOYSA-N 0 0 367.430 3.919 20 5 FHBDRN Cc1ccc(NC(=O)c2ccc(N[C@H](C)[C@@H]3CCOC3)c([N+](=O)[O-])c2)cc1 ZINC000541921397 568231126 /nfs/dbraw/zinc/23/11/26/568231126.db2.gz GNSPQNKWDWGGNH-GDBMZVCRSA-N 0 0 369.421 3.992 20 5 FHBDRN O=[N+]([O-])c1cc(CNCc2ccc3c(n2)CCC3)cc(C(F)(F)F)c1 ZINC000568848543 568236080 /nfs/dbraw/zinc/23/60/80/568236080.db2.gz BINDHRCAENBVQX-UHFFFAOYSA-N 0 0 351.328 3.787 20 5 FHBDRN COc1ccc(-c2nc(COc3cccnc3[N+](=O)[O-])cs2)cc1OC ZINC000007549826 568240685 /nfs/dbraw/zinc/24/06/85/568240685.db2.gz PUHBFJRCQSZNSZ-UHFFFAOYSA-N 0 0 373.390 3.710 20 5 FHBDRN CC(C)[C@@H]1C[C@H](NC(=O)c2cc(Cl)cc(Cl)c2[N+](=O)[O-])CCO1 ZINC000291650837 568241819 /nfs/dbraw/zinc/24/18/19/568241819.db2.gz GXQBBVUGDJQFSI-MFKMUULPSA-N 0 0 361.225 3.835 20 5 FHBDRN CC(C)[C@@H]1C[C@H](CC(=O)Nc2ccnn2-c2ccc([N+](=O)[O-])cc2)CCO1 ZINC000541930234 568245312 /nfs/dbraw/zinc/24/53/12/568245312.db2.gz HJCOOXVFSCWLBP-PBHICJAKSA-N 0 0 372.425 3.560 20 5 FHBDRN CC(=O)c1cc(NCCOc2ncccc2C(F)(F)F)ccc1[N+](=O)[O-] ZINC000568896712 568249491 /nfs/dbraw/zinc/24/94/91/568249491.db2.gz MGSGSSYHVVBFAA-UHFFFAOYSA-N 0 0 369.299 3.702 20 5 FHBDRN CC(=O)N(Cc1ccc(Nc2nc(C)cc(C)c2[N+](=O)[O-])cc1)C1CC1 ZINC000541932913 568250641 /nfs/dbraw/zinc/25/06/41/568250641.db2.gz GAPSNZGSPDGXFM-UHFFFAOYSA-N 0 0 354.410 3.861 20 5 FHBDRN CCc1n[nH]c(C(=O)N[C@@H](C)c2ccc(F)c3ccccc32)c1[N+](=O)[O-] ZINC000568908659 568251859 /nfs/dbraw/zinc/25/18/59/568251859.db2.gz UCYQGVWWQDKHLY-JTQLQIEISA-N 0 0 356.357 3.664 20 5 FHBDRN O=C(Nc1ccncc1[N+](=O)[O-])N(Cc1ccccc1)C1CCCCC1 ZINC000541925275 568252333 /nfs/dbraw/zinc/25/23/33/568252333.db2.gz YQBOYUDTZDYAHI-UHFFFAOYSA-N 0 0 354.410 3.779 20 5 FHBDRN Cc1nnc([C@H](C)NC(=O)c2cc(Cl)cc(Cl)c2[N+](=O)[O-])s1 ZINC000291670759 568252548 /nfs/dbraw/zinc/25/25/48/568252548.db2.gz IGTXHGUYJORDSH-YFKPBYRVSA-N 0 0 361.210 3.553 20 5 FHBDRN COc1cc([C@@H](C)Nc2nc(C)cc(C)c2[N+](=O)[O-])cc(OC)c1OC ZINC000541931839 568252828 /nfs/dbraw/zinc/25/28/28/568252828.db2.gz CQOVVOOABIXPEK-GFCCVEGCSA-N 0 0 361.398 3.806 20 5 FHBDRN Cc1ccc(-c2nnc(Sc3nc(C)cc(C)c3[N+](=O)[O-])n2C)cc1 ZINC000541933599 568252895 /nfs/dbraw/zinc/25/28/95/568252895.db2.gz VVVRWRLYQGPARH-UHFFFAOYSA-N 0 0 355.423 3.862 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(Cc2noc([C@@H](C)Cc3ccccc3)n2)c1 ZINC000568914627 568254260 /nfs/dbraw/zinc/25/42/60/568254260.db2.gz KVVBDMWSYOGSPB-ZDUSSCGKSA-N 0 0 353.378 3.923 20 5 FHBDRN CC(C)Oc1cncc(C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)c1 ZINC000482075783 568254416 /nfs/dbraw/zinc/25/44/16/568254416.db2.gz KLNXQTYBBRLCGN-UHFFFAOYSA-N 0 0 357.410 3.530 20 5 FHBDRN O=C(N[C@@H]1CCc2ccccc21)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000016472160 568256580 /nfs/dbraw/zinc/25/65/80/568256580.db2.gz NKPGEKYTTYRYAC-GOSISDBHSA-N 0 0 365.433 3.615 20 5 FHBDRN CC[C@](C)(NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)C(F)(F)F ZINC000541935600 568257173 /nfs/dbraw/zinc/25/71/73/568257173.db2.gz BDVOZWHDWMTBDB-LBPRGKRZSA-N 0 0 356.247 3.657 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N2CC[C@]3(CC[C@H](C)C3)C2)cc1OC ZINC000541937548 568258558 /nfs/dbraw/zinc/25/85/58/568258558.db2.gz SPCAJCPENSVQJU-DJJJIMSYSA-N 0 0 362.426 3.654 20 5 FHBDRN NC(=O)c1ccc(N2CCc3c(Cl)cc(Cl)cc3C2)c([N+](=O)[O-])c1 ZINC000482094152 568263379 /nfs/dbraw/zinc/26/33/79/568263379.db2.gz LMPWCFPEVTWGMV-UHFFFAOYSA-N 0 0 366.204 3.563 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)[C@H]1CCCc2ccccc21 ZINC000008126889 568268671 /nfs/dbraw/zinc/26/86/71/568268671.db2.gz AFXFDGPJCCPRKJ-SFHVURJKSA-N 0 0 369.421 3.551 20 5 FHBDRN COc1ccc(CNC(=O)N2CC(C)(C)[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000604363858 568271241 /nfs/dbraw/zinc/27/12/41/568271241.db2.gz IIFSRJJZRQRUHA-GOSISDBHSA-N 0 0 369.421 3.896 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N1CC(C)(C)[C@@H]1c1ccccc1 ZINC000604363870 568271257 /nfs/dbraw/zinc/27/12/57/568271257.db2.gz RRDUUFTZKFYLRC-SFHVURJKSA-N 0 0 369.421 3.896 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCc1noc2ccccc21 ZINC000569017867 568271520 /nfs/dbraw/zinc/27/15/20/568271520.db2.gz WNWINFFCAVRLSB-CQSZACIVSA-N 0 0 353.378 3.621 20 5 FHBDRN C[C@H]1CC[C@@]2(CCN(CC(=O)Nc3ccc([N+](=O)[O-])cc3Cl)C2)C1 ZINC000541949701 568272527 /nfs/dbraw/zinc/27/25/27/568272527.db2.gz VBOZPAFPNUHIDU-YVEFUNNKSA-N 0 0 351.834 3.699 20 5 FHBDRN CCOC(=O)C[C@@](C)(NC(=O)Nc1cc(C)c([N+](=O)[O-])cc1C)C(C)C ZINC000482112026 568275666 /nfs/dbraw/zinc/27/56/66/568275666.db2.gz GOCNUKUXULMVSF-GOSISDBHSA-N 0 0 365.430 3.701 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1[O-])N1[C@@H]2CC[C@H]1C[C@@H](c1ccccc1)C2 ZINC000436676838 568276696 /nfs/dbraw/zinc/27/66/96/568276696.db2.gz UPQLLBIFOYXGAL-MUJYYYPQSA-N 0 0 352.390 3.851 20 5 FHBDRN CCOCc1nc(C)c(-c2nc(Cc3ccccc3[N+](=O)[O-])no2)s1 ZINC000453052789 568277340 /nfs/dbraw/zinc/27/73/40/568277340.db2.gz DESYBCQWILIELM-UHFFFAOYSA-N 0 0 360.395 3.537 20 5 FHBDRN CC(=O)[C@@H](C)CCCCC(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000569046630 568280207 /nfs/dbraw/zinc/28/02/07/568280207.db2.gz XPDWHPANSYULJA-ZDUSSCGKSA-N 0 0 359.426 3.520 20 5 FHBDRN Cc1ccc([C@@H](C)CNS(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000303745546 568280942 /nfs/dbraw/zinc/28/09/42/568280942.db2.gz AKDXVXYGUPNLNM-LBPRGKRZSA-N 0 0 368.842 3.639 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)Nc1nc(-c2ccccc2F)co1 ZINC000482144642 568285003 /nfs/dbraw/zinc/28/50/03/568285003.db2.gz QYPFJVRMCXKAPF-UHFFFAOYSA-N 0 0 357.297 3.650 20 5 FHBDRN CCCCOc1ccc(C(=O)N(C)CCc2cccc([N+](=O)[O-])c2)c(O)c1 ZINC000436675283 568286438 /nfs/dbraw/zinc/28/64/38/568286438.db2.gz KLOINSFATJRIMY-UHFFFAOYSA-N 0 0 372.421 3.794 20 5 FHBDRN O=[N+]([O-])c1sccc1NC[C@@H](O)COc1cccc(C(F)(F)F)c1 ZINC000604433240 568286589 /nfs/dbraw/zinc/28/65/89/568286589.db2.gz FCDOIPIMLYLIHC-SNVBAGLBSA-N 0 0 362.329 3.527 20 5 FHBDRN Cc1cc(C)c(-c2csc(NC(=O)c3c[nH]nc3[N+](=O)[O-])n2)c(C)c1 ZINC000569141538 568290563 /nfs/dbraw/zinc/29/05/63/568290563.db2.gz JVTGAVVMOIZZMT-UHFFFAOYSA-N 0 0 357.395 3.619 20 5 FHBDRN Cc1ccc(CN(CCO)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000181971659 568299200 /nfs/dbraw/zinc/29/92/00/568299200.db2.gz BQGHSTYOIPYFHD-UHFFFAOYSA-N 0 0 367.405 3.553 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N1CCCn2c(cc3ccccc32)C1 ZINC000569155939 568300108 /nfs/dbraw/zinc/30/01/08/568300108.db2.gz OCRBZQCYKOPEEC-UHFFFAOYSA-N 0 0 365.389 3.604 20 5 FHBDRN O=C(NCc1noc2ccccc21)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000569190211 568306940 /nfs/dbraw/zinc/30/69/40/568306940.db2.gz LQJSRLVWPYHEHL-UHFFFAOYSA-N 0 0 353.359 3.881 20 5 FHBDRN COc1cc2c(cc1F)CC[C@@H]2NC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000569211135 568308802 /nfs/dbraw/zinc/30/88/02/568308802.db2.gz GLKWTUMTBHYLTN-AWEZNQCLSA-N 0 0 364.760 3.813 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])NC[C@@H]1CCCC[C@@H]1C(F)(F)F ZINC000482199176 568311216 /nfs/dbraw/zinc/31/12/16/568311216.db2.gz OOHGHABIQGJSTB-STQMWFEESA-N 0 0 374.359 3.849 20 5 FHBDRN CCc1nn(C)c(N[C@@H]2CCC[C@H](c3nc4ccccc4[nH]3)C2)c1[N+](=O)[O-] ZINC000569217567 568313331 /nfs/dbraw/zinc/31/33/31/568313331.db2.gz QULOYSIBPLWFMB-QWHCGFSZSA-N 0 0 368.441 3.905 20 5 FHBDRN Cc1ncsc1CSCCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000569230591 568315875 /nfs/dbraw/zinc/31/58/75/568315875.db2.gz TUIGGIYDEBQZOB-UHFFFAOYSA-N 0 0 365.436 3.591 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)Nc1nc(-c2ccccc2)cs1 ZINC000005775859 568320288 /nfs/dbraw/zinc/32/02/88/568320288.db2.gz PDSIKTIVYZAAGF-UHFFFAOYSA-N 0 0 355.375 3.736 20 5 FHBDRN CCOc1ccc([C@@H](C)NC(=O)CCOc2cc(C)ccc2[N+](=O)[O-])cc1 ZINC000031535310 568332679 /nfs/dbraw/zinc/33/26/79/568332679.db2.gz QDBRTFGXNJBNQD-OAHLLOKOSA-N 0 0 372.421 3.948 20 5 FHBDRN COc1cc(Cl)c(NC(=O)c2cc([N+](=O)[O-])ccc2OC)cc1C ZINC000569288716 568335238 /nfs/dbraw/zinc/33/52/38/568335238.db2.gz YETJLONGISHTOM-UHFFFAOYSA-N 0 0 350.758 3.826 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CCCc1nc(-c2cccs2)no1 ZINC000031702027 568335955 /nfs/dbraw/zinc/33/59/55/568335955.db2.gz BRCNNCWJAOHLGP-UHFFFAOYSA-N 0 0 372.406 3.976 20 5 FHBDRN C[C@@]1(F)CCCN(c2nc(N3CCC[C@](C)(F)C3)c([N+](=O)[O-])s2)C1 ZINC000569315502 568375946 /nfs/dbraw/zinc/37/59/46/568375946.db2.gz QJJJQSHTIWESKF-LSDHHAIUSA-N 0 0 360.430 3.708 20 5 FHBDRN Cc1ccc(S(=O)(=O)Nc2ccc([N+](=O)[O-])cc2)cc1C(F)(F)F ZINC000541998332 568382055 /nfs/dbraw/zinc/38/20/55/568382055.db2.gz CNGULUHNJLAELK-UHFFFAOYSA-N 0 0 360.313 3.723 20 5 FHBDRN Cc1ccc(C(=O)N2CCN(Cc3cccc(Cl)c3)CC2)cc1[N+](=O)[O-] ZINC000032483802 568393028 /nfs/dbraw/zinc/39/30/28/568393028.db2.gz XJKLCMBPFHDYFF-UHFFFAOYSA-N 0 0 373.840 3.515 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NC1(c2ccccc2)CCOCC1 ZINC000569469648 568399457 /nfs/dbraw/zinc/39/94/57/568399457.db2.gz GUCKDMBJGUEFMD-UHFFFAOYSA-N 0 0 354.406 3.647 20 5 FHBDRN COc1cc(C(=O)NCC(F)(F)c2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000569392045 568400239 /nfs/dbraw/zinc/40/02/39/568400239.db2.gz RONUZELXLRAEAG-UHFFFAOYSA-N 0 0 370.739 3.779 20 5 FHBDRN Cc1c(Br)cc([N+](=O)[O-])cc1-c1nc(CC(F)(F)F)no1 ZINC000569620434 568410384 /nfs/dbraw/zinc/41/03/84/568410384.db2.gz QJMPGGSDQKHFTJ-UHFFFAOYSA-N 0 0 366.093 3.821 20 5 FHBDRN C[C@H](CCc1ccco1)NC(=O)c1c([N+](=O)[O-])cccc1C(F)(F)F ZINC000569649359 568407119 /nfs/dbraw/zinc/40/71/19/568407119.db2.gz LIEGMNIZLLTHHB-SNVBAGLBSA-N 0 0 356.300 3.958 20 5 FHBDRN COc1cc(Nc2cc(C)n(C3CCCCC3)n2)c([N+](=O)[O-])cc1OC ZINC000569752412 568420211 /nfs/dbraw/zinc/42/02/11/568420211.db2.gz ZFPPSDONFIMCNB-UHFFFAOYSA-N 0 0 360.414 3.788 20 5 FHBDRN O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)N1CCCc2c(F)cc(F)cc21 ZINC000569844602 568427113 /nfs/dbraw/zinc/42/71/13/568427113.db2.gz DGNTYEBJPZTHTM-UHFFFAOYSA-N 0 0 368.286 3.673 20 5 FHBDRN C[C@H]1C[C@@H](CCNC(=O)c2c([N+](=O)[O-])cccc2C(F)(F)F)CCO1 ZINC000569859501 568431001 /nfs/dbraw/zinc/43/10/01/568431001.db2.gz VAPDDDLQDIQLFW-QWRGUYRKSA-N 0 0 360.332 3.549 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H](CC(=O)N(C)C)c1ccccc1 ZINC000569877028 568433006 /nfs/dbraw/zinc/43/30/06/568433006.db2.gz IZRFKUCKYUENAB-DNVCBOLYSA-N 0 0 355.438 3.773 20 5 FHBDRN Cc1cc(NC[C@H](C)[N@H+](C)Cc2ccccc2)cc(C(=O)[O-])c1[N+](=O)[O-] ZINC000569930077 568437881 /nfs/dbraw/zinc/43/78/81/568437881.db2.gz BRHWMRNKYDCJMA-AWEZNQCLSA-N 0 0 357.410 3.534 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)Nc1cccnc1C(F)(F)F ZINC000570033527 568442022 /nfs/dbraw/zinc/44/20/22/568442022.db2.gz YLTIOAHDVLHTOZ-UHFFFAOYSA-N 0 0 354.288 3.673 20 5 FHBDRN O=C(Nc1c(O)cccc1Cl)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000569951214 568444110 /nfs/dbraw/zinc/44/41/10/568444110.db2.gz YLZMKMAFCNKGJK-UHFFFAOYSA-N 0 0 361.785 3.806 20 5 FHBDRN CC(C)(C(=O)Nc1ccc(OC(F)F)nc1)c1ccc([N+](=O)[O-])cc1 ZINC000570109461 568451537 /nfs/dbraw/zinc/45/15/37/568451537.db2.gz RNKUWJJVECPXSY-UHFFFAOYSA-N 0 0 351.309 3.508 20 5 FHBDRN CCOc1c(Cl)cccc1Cc1nc(-c2ccc(N)c([N+](=O)[O-])c2)no1 ZINC000570125249 568452904 /nfs/dbraw/zinc/45/29/04/568452904.db2.gz IDWFBQOZOBLEFI-UHFFFAOYSA-N 0 0 374.784 3.870 20 5 FHBDRN O=[N+]([O-])c1cc(F)c(CSc2nncn2-c2ccccc2F)c(F)c1 ZINC000570066095 568456149 /nfs/dbraw/zinc/45/61/49/568456149.db2.gz YNVVJOZOFQMXOC-UHFFFAOYSA-N 0 0 366.324 3.885 20 5 FHBDRN C[C@H](SC(=S)N1CCCC1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000007113235 568456432 /nfs/dbraw/zinc/45/64/32/568456432.db2.gz VYECPURPJRGPFF-JTQLQIEISA-N 0 0 364.452 3.820 20 5 FHBDRN O=C(NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)[C@H]1C[C@]1(F)c1ccccc1 ZINC000570179867 568459524 /nfs/dbraw/zinc/45/95/24/568459524.db2.gz CEDWRYFBGPIVTN-XLIONFOSSA-N 0 0 367.380 3.620 20 5 FHBDRN Cc1ccc(C(=O)N2CC[C@H](Oc3ccc(Cl)cc3)C2)cc1[N+](=O)[O-] ZINC000570191663 568460203 /nfs/dbraw/zinc/46/02/03/568460203.db2.gz SBUFHIIVYQFQKW-INIZCTEOSA-N 0 0 360.797 3.850 20 5 FHBDRN COc1ccc([C@H](C)NCc2nc(-c3cccc([N+](=O)[O-])c3)no2)cc1F ZINC000182018373 568462413 /nfs/dbraw/zinc/46/24/13/568462413.db2.gz QIZZWJZGMNZFJI-NSHDSACASA-N 0 0 372.356 3.643 20 5 FHBDRN CC(C)c1nc2cc(NC(=O)c3n[nH]c4ccc([N+](=O)[O-])cc43)ccc2o1 ZINC000033217489 568470925 /nfs/dbraw/zinc/47/09/25/568470925.db2.gz QVHNPXPKJHGUME-UHFFFAOYSA-N 0 0 365.349 3.988 20 5 FHBDRN COc1cc(C(=O)N[C@@H]2CCC(C)(C)C[C@H]2C)cc([N+](=O)[O-])c1OC ZINC000482233951 568487378 /nfs/dbraw/zinc/48/73/78/568487378.db2.gz IPKDEQYQCKMGQQ-DGCLKSJQSA-N 0 0 350.415 3.557 20 5 FHBDRN O=[N+]([O-])c1ccc(NCc2nccc(C(F)F)n2)c(Br)c1 ZINC000570596232 568490120 /nfs/dbraw/zinc/49/01/20/568490120.db2.gz ATAJQQCUAWYOST-UHFFFAOYSA-N 0 0 359.130 3.697 20 5 FHBDRN C[C@@H]1CCN(C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)[C@H]2CCCC[C@H]12 ZINC000049704684 568570831 /nfs/dbraw/zinc/57/08/31/568570831.db2.gz CSORMHJYAWEUES-ZMYBRWDISA-N 0 0 368.437 3.821 20 5 FHBDRN CC1(C)CN(Cc2c(Br)cccc2[N+](=O)[O-])CC(C)(C)O1 ZINC000725263760 570538164 /nfs/dbraw/zinc/53/81/64/570538164.db2.gz GALLHBKHAXSIPP-UHFFFAOYSA-N 0 0 357.248 3.747 20 5 FHBDRN O=[N+]([O-])c1ccc(N[C@@H]2C[C@H]2c2c(F)cccc2Cl)c(-c2nn[nH]n2)c1 ZINC000738371913 598972176 /nfs/dbraw/zinc/97/21/76/598972176.db2.gz YTYLWSKEPFOQHZ-YMTOWFKASA-N 0 0 374.763 3.535 20 5 FHBDRN O=[N+]([O-])c1ccc(N[C@H]2C[C@@H]2c2c(F)cccc2Cl)c(-c2nn[nH]n2)c1 ZINC000738371909 598972316 /nfs/dbraw/zinc/97/23/16/598972316.db2.gz YTYLWSKEPFOQHZ-XPTSAGLGSA-N 0 0 374.763 3.535 20 5 FHBDRN CC[C@@H](Nc1ccc([N+](=O)[O-])cc1-c1nn[nH]n1)c1cccc(Cl)c1 ZINC000820925809 599095526 /nfs/dbraw/zinc/09/55/26/599095526.db2.gz MYAOBCVNIBMWLX-CQSZACIVSA-N 0 0 358.789 3.992 20 5 FHBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1CSc1ccccc1-c1nn[nH]n1 ZINC000735914339 599109152 /nfs/dbraw/zinc/10/91/52/599109152.db2.gz WYCQPGQSQADIMM-UHFFFAOYSA-N 0 0 371.422 3.854 20 5 FHBDRN O=[N+]([O-])c1ccc(N[C@@H](c2ccc(F)cc2)C2CCC2)c(-c2nn[nH]n2)c1 ZINC000738368348 598796882 /nfs/dbraw/zinc/79/68/82/598796882.db2.gz COSPBWQXXUWLTO-QGZVFWFLSA-N 0 0 368.372 3.867 20 5 FHBDRN C[C@@H](SCCOc1cccc([N+](=O)[O-])c1)c1ccc(-c2nn[nH]n2)cc1 ZINC000736188610 599325858 /nfs/dbraw/zinc/32/58/58/599325858.db2.gz LQUMKNKMSWRKGK-GFCCVEGCSA-N 0 0 371.422 3.648 20 5 FHBDRN O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1Nc1cccc(NC2CCCC2)c1 ZINC000738358483 599351380 /nfs/dbraw/zinc/35/13/80/599351380.db2.gz MLDDODXBKIWAJE-UHFFFAOYSA-N 0 0 365.397 3.873 20 5 FHBDRN CC[C@@H](Nc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-])c1ccc(F)cc1F ZINC000736367313 599528161 /nfs/dbraw/zinc/52/81/61/599528161.db2.gz AIBLYVYKAXGFIT-CYBMUJFWSA-N 0 0 360.324 3.616 20 5 FHBDRN Cc1c(C[NH2+][C@@H](C(=O)[O-])c2ccccc2C(F)(F)F)cccc1[N+](=O)[O-] ZINC000738289732 599791603 /nfs/dbraw/zinc/79/16/03/599791603.db2.gz SYMZQYLKWMGAHB-OAHLLOKOSA-N 0 0 368.311 3.838 20 5 FHBDRN C[C@H]1C[N@H+](Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)C[C@H]1C(=O)[O-] ZINC000833629292 604668912 /nfs/dbraw/zinc/66/89/12/604668912.db2.gz HEIJXEDDJZKFBE-BLLLJJGKSA-N 0 0 374.368 3.679 20 5 FHBDRN Cc1ccc([C@@H](C)[NH2+]Cc2ccc(CCNC(=O)[O-])cc2)cc1[N+](=O)[O-] ZINC000830256912 604943424 /nfs/dbraw/zinc/94/34/24/604943424.db2.gz NPJMHTTZKPIQQA-CQSZACIVSA-N 0 0 357.410 3.564 20 5 FHBDRN O=C([O-])NC1CCC([NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC1 ZINC000834164144 605617848 /nfs/dbraw/zinc/61/78/48/605617848.db2.gz GDRPAHZVJUAVCA-FAFZWHIHSA-N 0 0 369.421 3.853 20 5 FHBDRN Cc1cc(N[C@H](C)c2cccc(-c3nn[nH]n3)c2)c(Cl)cc1[N+](=O)[O-] ZINC000822209844 606137421 /nfs/dbraw/zinc/13/74/21/606137421.db2.gz ZSRAUIOCYVOMHB-SNVBAGLBSA-N 0 0 358.789 3.910 20 5 FHBDRN O=[N+]([O-])c1cccc2nc(C=Cc3cc(-c4nn[nH]n4)cs3)ccc21 ZINC000823646829 606305330 /nfs/dbraw/zinc/30/53/30/606305330.db2.gz AZRKWKMTTRBBAV-GQCTYLIASA-N 0 0 350.363 3.555 20 5 FHBDRN CC[C@H](Nc1ccc(-c2nn[nH]n2)c(Cl)c1)c1cccc([N+](=O)[O-])c1 ZINC000820926631 606479372 /nfs/dbraw/zinc/47/93/72/606479372.db2.gz UIYHHOZRNRXTGP-HNNXBMFYSA-N 0 0 358.789 3.992 20 5 FHBDRN O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1NC[C@@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000823629910 606596186 /nfs/dbraw/zinc/59/61/86/606596186.db2.gz LOVBGPLVEBZNLL-MWLCHTKSSA-N 0 0 370.335 3.556 20 5 FHBDRN O=[N+]([O-])c1c(-c2nn[nH]n2)ccnc1Nc1ccc(Nc2ccccc2)cc1 ZINC000823624501 607161898 /nfs/dbraw/zinc/16/18/98/607161898.db2.gz ANAFNZBKGAFDAW-UHFFFAOYSA-N 0 0 374.364 3.657 20 5 FHBDRN CC(C)(C)CCCC(=O)Nc1cc(-c2nn[nH]n2)cc([N+](=O)[O-])c1Cl ZINC000824087589 608162480 /nfs/dbraw/zinc/16/24/80/608162480.db2.gz YHOKCDIGKBGXLF-UHFFFAOYSA-N 0 0 366.809 3.583 20 5 FHBDRN O=[N+]([O-])c1cnc(Cl)c(C(F)(F)N2CC[C@H](c3ccncc3)C2)c1 ZINC001165043097 721927563 /nfs/dbraw/zinc/92/75/63/721927563.db2.gz GNXBWMBPVOGUFP-NSHDSACASA-N 0 0 354.744 3.577 20 5 FHBDRN O=[N+]([O-])c1cnc(Cl)c(C(F)(F)N2CC[C@@H](c3ccncc3)C2)c1 ZINC001165043093 721927632 /nfs/dbraw/zinc/92/76/32/721927632.db2.gz GNXBWMBPVOGUFP-LLVKDONJSA-N 0 0 354.744 3.577 20 5 FHBDRN O=C(Nc1ccc(F)c(F)c1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000431507323 936311413 /nfs/dbraw/zinc/31/14/13/936311413.db2.gz SFTBFEHDGPYXOU-UHFFFAOYSA-N 0 0 357.110 3.888 20 5 FHBDRN Cc1cnc([C@@H](NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C2CC2)s1 ZINC000135903521 936327438 /nfs/dbraw/zinc/32/74/38/936327438.db2.gz UBLHXNZUOJBKMB-KRWDZBQOSA-N 0 0 370.434 3.651 20 5 FHBDRN COCc1ccc([C@H]2CCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)o1 ZINC000162025627 936334794 /nfs/dbraw/zinc/33/47/94/936334794.db2.gz CGZWJIPTQGBHGQ-SCBHQAGPSA-N 0 0 356.378 3.711 20 5 FHBDRN CC(C)(C(=O)N[C@H]1CCOc2ccc(F)cc21)c1ccccc1[N+](=O)[O-] ZINC000582970854 936335204 /nfs/dbraw/zinc/33/52/04/936335204.db2.gz QAFUACFOFWJHAZ-HNNXBMFYSA-N 0 0 358.369 3.652 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N(C)CCOc2ccccc2C)c1 ZINC000024221698 936337241 /nfs/dbraw/zinc/33/72/41/936337241.db2.gz KBARKUOORHISHD-UHFFFAOYSA-N 0 0 360.435 3.776 20 5 FHBDRN O=C(Nc1ccc(C(=O)N2CCCc3c([N+](=O)[O-])cccc32)cc1)C1CC1 ZINC000162043125 936337521 /nfs/dbraw/zinc/33/75/21/936337521.db2.gz LWAAIRAZPLHCET-UHFFFAOYSA-N 0 0 365.389 3.536 20 5 FHBDRN COc1cccc([C@H](C)c2noc(-c3ccc(OC)c([N+](=O)[O-])c3)n2)c1 ZINC000612917887 936342582 /nfs/dbraw/zinc/34/25/82/936342582.db2.gz RQHLCVIFHSHYHJ-NSHDSACASA-N 0 0 355.350 3.814 20 5 FHBDRN COc1ccc(-c2nc([C@@H]3CCc4ccccc4C3)no2)cc1[N+](=O)[O-] ZINC000612952144 936345029 /nfs/dbraw/zinc/34/50/29/936345029.db2.gz WAROHZWLHYPKPW-CQSZACIVSA-N 0 0 351.362 3.926 20 5 FHBDRN Cc1sc(NC(=O)COC2CCCC2)nc1-c1cccc([N+](=O)[O-])c1 ZINC000079141069 936360421 /nfs/dbraw/zinc/36/04/21/936360421.db2.gz IBDRZYSKHUBBSI-UHFFFAOYSA-N 0 0 361.423 3.924 20 5 FHBDRN CCO[C@H]1CCCN(c2ccc([N+](=O)[O-])c(OCc3ccccc3)n2)C1 ZINC000613179885 936379045 /nfs/dbraw/zinc/37/90/45/936379045.db2.gz VLPQHBDMDMWQTQ-INIZCTEOSA-N 0 0 357.410 3.574 20 5 FHBDRN O=[N+]([O-])c1ccc([C@@H](NC[C@@H](CO)c2ccccc2)C(F)(F)F)cc1 ZINC000583029541 936381204 /nfs/dbraw/zinc/38/12/04/936381204.db2.gz UMZLXIZQRZUGRN-GOEBONIOSA-N 0 0 354.328 3.564 20 5 FHBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])Nc1n[nH]c2ccccc21 ZINC000785158989 936388267 /nfs/dbraw/zinc/38/82/67/936388267.db2.gz NXRHYNMJICTONG-UHFFFAOYSA-N 0 0 362.798 3.855 20 5 FHBDRN C[C@H]1CCC[N@H+](Cc2ccc(NC(=O)c3cc([O-])ccc3[N+](=O)[O-])cc2)C1 ZINC000506709268 945064876 /nfs/dbraw/zinc/06/48/76/945064876.db2.gz XNNHYEGSFDPOAU-AWEZNQCLSA-N 0 0 369.421 3.785 20 5 FHBDRN C[C@H](c1c(F)cccc1F)N(C)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000507242066 945068131 /nfs/dbraw/zinc/06/81/31/945068131.db2.gz CHGKJZDHKVPSNP-LLVKDONJSA-N 0 0 364.348 3.933 20 5 FHBDRN CC(C)(C)[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)CCO1 ZINC000509554388 945068379 /nfs/dbraw/zinc/06/83/79/945068379.db2.gz GPWBCAUMWNLTSG-CYBMUJFWSA-N 0 0 360.332 3.501 20 5 FHBDRN COc1cccc(NC2CCN(c3ncc(Cl)cc3[N+](=O)[O-])CC2)c1 ZINC000153748172 937082869 /nfs/dbraw/zinc/08/28/69/937082869.db2.gz FCPUNIHEDNDVCB-UHFFFAOYSA-N 0 0 362.817 3.733 20 5 FHBDRN Cc1cc(OCC(=O)N2CC(Cc3ccccc3Cl)C2)ccc1[N+](=O)[O-] ZINC000435756967 937088126 /nfs/dbraw/zinc/08/81/26/937088126.db2.gz WNNKLNCOEMMSMH-UHFFFAOYSA-N 0 0 374.824 3.637 20 5 FHBDRN CC(C)Oc1cccc([C@@H](O)CNc2ncc(Cl)cc2[N+](=O)[O-])c1 ZINC000153792799 937097159 /nfs/dbraw/zinc/09/71/59/937097159.db2.gz PJCKLLHBSVOXCL-HNNXBMFYSA-N 0 0 351.790 3.576 20 5 FHBDRN O=C(c1ccc(Br)cc1[N+](=O)[O-])N(CC1CC1)CC1CC1 ZINC000079506521 937109979 /nfs/dbraw/zinc/10/99/79/937109979.db2.gz ZQWLFBCTMHTREG-UHFFFAOYSA-N 0 0 353.216 3.620 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2nnc(N3Cc4cccc(F)c4C3)n2C2CC2)c1 ZINC000583090214 937111821 /nfs/dbraw/zinc/11/18/21/937111821.db2.gz GWXLHYVSWWSVCW-UHFFFAOYSA-N 0 0 365.368 3.848 20 5 FHBDRN CC(=O)Nc1cccc(NC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)c1C ZINC000247944225 937114173 /nfs/dbraw/zinc/11/41/73/937114173.db2.gz OKWBODNEWKFNMV-LBPRGKRZSA-N 0 0 373.434 3.981 20 5 FHBDRN Cc1ccc(NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)c(C)c1O ZINC000178776147 937121322 /nfs/dbraw/zinc/12/13/22/937121322.db2.gz FIDGLANDIGRLBM-UHFFFAOYSA-N 0 0 365.183 3.932 20 5 FHBDRN COc1ccc2c(c1)CCCN(C(=O)/C=C\c1ccc([N+](=O)[O-])cc1)C2 ZINC000728543935 937125028 /nfs/dbraw/zinc/12/50/28/937125028.db2.gz OODXLNLAGZAYQH-WDZFZDKYSA-N 0 0 352.390 3.592 20 5 FHBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)c1noc(-c2ccc(Cl)cc2)n1 ZINC000176397642 937127025 /nfs/dbraw/zinc/12/70/25/937127025.db2.gz JEBLAHLPWIMHHG-SNVBAGLBSA-N 0 0 372.768 3.789 20 5 FHBDRN COC[C@H](NC(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1)c1ccc(C)o1 ZINC000176401182 937127411 /nfs/dbraw/zinc/12/74/11/937127411.db2.gz SLORDICUNRMQAR-HIFRSBDPSA-N 0 0 361.398 3.553 20 5 FHBDRN CN(CCCCNc1ncnc2sc([N+](=O)[O-])cc21)c1ccccc1 ZINC000557537220 927038861 /nfs/dbraw/zinc/03/88/61/927038861.db2.gz NJWRTSNRIWGAQI-UHFFFAOYSA-N 0 0 357.439 3.928 20 5 FHBDRN O=[N+]([O-])c1cc(S(=O)(=O)Nc2c(Cl)cccc2Cl)cs1 ZINC000120085352 927136879 /nfs/dbraw/zinc/13/68/79/927136879.db2.gz WLGYSRCTVZXCGK-UHFFFAOYSA-N 0 0 353.208 3.764 20 5 FHBDRN CCc1ccc(C(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)c(O)c1 ZINC000187904673 937137537 /nfs/dbraw/zinc/13/75/37/937137537.db2.gz IOWFGQFHAAGRBH-UHFFFAOYSA-N 0 0 370.405 3.546 20 5 FHBDRN NC(=O)c1cccc(N2CCc3c(Cl)c(Cl)ccc3C2)c1[N+](=O)[O-] ZINC000561185924 937139339 /nfs/dbraw/zinc/13/93/39/937139339.db2.gz NUNDDRVNJQAIDS-UHFFFAOYSA-N 0 0 366.204 3.563 20 5 FHBDRN Cc1ccc(OC(F)F)c(CNC(=O)NCc2ccccc2[N+](=O)[O-])c1 ZINC000157488894 927172194 /nfs/dbraw/zinc/17/21/94/927172194.db2.gz TWRUSMYSPXQVAX-UHFFFAOYSA-N 0 0 365.336 3.504 20 5 FHBDRN Cc1c(C(=O)Nc2cccc([N+](=O)[O-])c2C)cnn1-c1ccccc1C ZINC000046162477 927215715 /nfs/dbraw/zinc/21/57/15/927215715.db2.gz MVRLVBGMWWSQLE-UHFFFAOYSA-N 0 0 350.378 3.958 20 5 FHBDRN COc1cc(C(=O)NCC[C@H]2CCC[C@H](C)C2)cc([N+](=O)[O-])c1OC ZINC000610176521 927242296 /nfs/dbraw/zinc/24/22/96/927242296.db2.gz QRUAXANXVXLVLF-QWHCGFSZSA-N 0 0 350.415 3.558 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N(CCO)[C@@H]1CCCc2ccccc21 ZINC000175280389 927254914 /nfs/dbraw/zinc/25/49/14/927254914.db2.gz CQNDYIQJWQSJKY-LJQANCHMSA-N 0 0 369.421 3.807 20 5 FHBDRN COC(=O)c1cc([N+](=O)[O-])c(C)cc1N1C[C@@H](C)C[C@H]1c1cccnc1 ZINC000557634513 927260709 /nfs/dbraw/zinc/26/07/09/927260709.db2.gz HTAFJVYHFBMDPK-SJCJKPOMSA-N 0 0 355.394 3.672 20 5 FHBDRN COc1c(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)cccc1[N+](=O)[O-] ZINC000579751568 927281362 /nfs/dbraw/zinc/28/13/62/927281362.db2.gz VQAXOJMZKSVECO-AWEZNQCLSA-N 0 0 367.405 3.623 20 5 FHBDRN Cc1ccc(NC(=O)COc2ccc([N+](=O)[O-])c(C)c2)c2cccnc12 ZINC000430146311 927307840 /nfs/dbraw/zinc/30/78/40/927307840.db2.gz IOUVANDMOVRYQQ-UHFFFAOYSA-N 0 0 351.362 3.777 20 5 FHBDRN C[C@@H]1CCCN(C(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])[C@@H]1C ZINC000610178765 927317240 /nfs/dbraw/zinc/31/72/40/927317240.db2.gz WXYLKHCKQVNDKQ-GHMZBOCLSA-N 0 0 360.332 3.797 20 5 FHBDRN Cc1c(C(=O)N[C@@H]2CCCN(c3ccccc3Cl)C2)cccc1[N+](=O)[O-] ZINC000610178509 927320771 /nfs/dbraw/zinc/32/07/71/927320771.db2.gz DTAFPYVENNXQGD-CQSZACIVSA-N 0 0 373.840 3.955 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(N[C@H]2CC[C@@H](c3ccc(F)cc3)C2)n1 ZINC000557673356 927323257 /nfs/dbraw/zinc/32/32/57/927323257.db2.gz GBMDVJSNTUGFNS-OCCSQVGLSA-N 0 0 359.357 3.664 20 5 FHBDRN CSc1cccc(F)c1CNc1c(Br)cncc1[N+](=O)[O-] ZINC000557683067 927324957 /nfs/dbraw/zinc/32/49/57/927324957.db2.gz VGPHSFLDEJNDDO-UHFFFAOYSA-N 0 0 372.219 3.647 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N[C@@H](C)[C@@H](O)c1ccc(F)cc1 ZINC000120122487 927334226 /nfs/dbraw/zinc/33/42/26/927334226.db2.gz WMIOMQXBCYDKLP-YVEFUNNKSA-N 0 0 361.373 3.594 20 5 FHBDRN CCSCc1cccc(NC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)c1 ZINC000610180188 927345538 /nfs/dbraw/zinc/34/55/38/927345538.db2.gz DMZYOEHMFSMTEP-UHFFFAOYSA-N 0 0 360.391 3.829 20 5 FHBDRN CO[C@H](CNC(=O)Nc1cc([N+](=O)[O-])c(C)cc1C)c1ccc(F)cc1 ZINC000120175279 927534479 /nfs/dbraw/zinc/53/44/79/927534479.db2.gz OTNXCPNMWIXGNB-QGZVFWFLSA-N 0 0 361.373 3.860 20 5 FHBDRN Cc1cc(C)cc(C2=CCN(C(=O)COc3cccc([N+](=O)[O-])c3)CC2)c1 ZINC001266276265 927558534 /nfs/dbraw/zinc/55/85/34/927558534.db2.gz DTJDMUICHKAVMC-UHFFFAOYSA-N 0 0 366.417 3.906 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@H](c2cc(C)ccn2)C1 ZINC000583153193 937179485 /nfs/dbraw/zinc/17/94/85/937179485.db2.gz IXJVOGZAQGWQLE-MSOLQXFVSA-N 0 0 367.449 3.883 20 5 FHBDRN C[C@@H](NC(=O)c1ccc([N+](=O)[O-])c2cccnc12)c1ccc(Cl)cn1 ZINC000471133590 927692825 /nfs/dbraw/zinc/69/28/25/927692825.db2.gz MEQFGIDJJFKYMF-SNVBAGLBSA-N 0 0 356.769 3.682 20 5 FHBDRN Cc1cc(N2CCCC[C@@H]2C)ccc1NC(=O)CCn1cc([N+](=O)[O-])cn1 ZINC000153964775 927710820 /nfs/dbraw/zinc/71/08/20/927710820.db2.gz FYPGQZVDLVIQRM-HNNXBMFYSA-N 0 0 371.441 3.507 20 5 FHBDRN Cc1nn(C(C)(C)C)cc1C(=O)OCc1ccc([N+](=O)[O-])cc1Cl ZINC000784926046 927730198 /nfs/dbraw/zinc/73/01/98/927730198.db2.gz OTJXJLBMYKMBRT-UHFFFAOYSA-N 0 0 351.790 3.865 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1OC(=O)COc1ccc(C(F)(F)F)cc1 ZINC000044314933 937189701 /nfs/dbraw/zinc/18/97/01/937189701.db2.gz ZCHUDFCNQGSHGX-UHFFFAOYSA-N 0 0 371.267 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ZINC000187072106 927897017 /nfs/dbraw/zinc/89/70/17/927897017.db2.gz PNETZFAPTMKFJM-HZMBPMFUSA-N 0 0 366.826 3.912 20 5 FHBDRN Cc1csc(C2(NC(=O)CSc3ccccc3[N+](=O)[O-])CCC2)n1 ZINC000583164650 937200798 /nfs/dbraw/zinc/20/07/98/937200798.db2.gz GWAPFVUMFOZVGF-UHFFFAOYSA-N 0 0 363.464 3.647 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N[C@H](C)c1ccc(NC(N)=O)cc1 ZINC000120263529 927926674 /nfs/dbraw/zinc/92/66/74/927926674.db2.gz OYDKKDFVEWDSEV-GFCCVEGCSA-N 0 0 371.397 3.585 20 5 FHBDRN COc1ccc(NC(=O)c2csc(-c3ccc(C)n3C)n2)c([N+](=O)[O-])c1 ZINC000120262973 927926712 /nfs/dbraw/zinc/92/67/12/927926712.db2.gz FALHVXMSEXGJAR-UHFFFAOYSA-N 0 0 372.406 3.626 20 5 FHBDRN Cc1n[nH]c(C(=O)N[C@H](CC(C)C)c2ccc(Cl)cc2)c1[N+](=O)[O-] ZINC000610199691 927937606 /nfs/dbraw/zinc/93/76/06/927937606.db2.gz GOLRSWCZCWMEQK-CYBMUJFWSA-N 0 0 350.806 3.797 20 5 FHBDRN O=C(Nc1ccc(COCc2ccccc2)cc1)c1cc([N+](=O)[O-])c[nH]1 ZINC000610201176 927942949 /nfs/dbraw/zinc/94/29/49/927942949.db2.gz IWYUHRHLBWTKNV-UHFFFAOYSA-N 0 0 351.362 3.892 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1CN1CCC(C(F)(F)F)(C(F)(F)F)C1 ZINC000430200759 927957057 /nfs/dbraw/zinc/95/70/57/927957057.db2.gz HQQYBVMDWILLLT-UHFFFAOYSA-N 0 0 372.265 3.920 20 5 FHBDRN COC(=O)[C@H](CNC(=O)c1cc2ccccc2c2cccnc12)CC(C)C ZINC000610201509 927963427 /nfs/dbraw/zinc/96/34/27/927963427.db2.gz ODUAANYWCHRXQR-INIZCTEOSA-N 0 0 364.445 3.953 20 5 FHBDRN O=C(OCCSc1ccc([N+](=O)[O-])cc1)c1cnc(C2CC2)s1 ZINC000784934478 928013702 /nfs/dbraw/zinc/01/37/02/928013702.db2.gz BKTYFYLPRIAEAR-UHFFFAOYSA-N 0 0 350.421 3.878 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCc1ccc(OC(C)C)nc1 ZINC000120309990 928049501 /nfs/dbraw/zinc/04/95/01/928049501.db2.gz WHRSQDKOUNXYLT-UHFFFAOYSA-N 0 0 358.398 3.716 20 5 FHBDRN C[C@H](NC(=O)NC[C@@H]1[C@@H]2Cc3ccccc3[C@H]12)c1cccc([N+](=O)[O-])c1 ZINC000246882913 928049994 /nfs/dbraw/zinc/04/99/94/928049994.db2.gz LVXKOILYNHNRKE-RCUQFMMVSA-N 0 0 351.406 3.541 20 5 FHBDRN CN(C)c1cccc(C(=O)N2CCS[C@H]2c2ccc([N+](=O)[O-])cc2)c1 ZINC000610209854 928075728 /nfs/dbraw/zinc/07/57/28/928075728.db2.gz JGOPQLGTZCSATN-SFHVURJKSA-N 0 0 357.435 3.549 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1CN1CCc2[nH]c3ccc(F)cc3c2C1 ZINC000430209036 928095119 /nfs/dbraw/zinc/09/51/19/928095119.db2.gz WKJVMFOMFUWCGG-UHFFFAOYSA-N 0 0 355.369 3.782 20 5 FHBDRN O=C(Cc1c(F)cccc1F)OCCSc1ccc([N+](=O)[O-])cc1 ZINC000784937075 928110486 /nfs/dbraw/zinc/11/04/86/928110486.db2.gz XQPURKAGCVPPSL-UHFFFAOYSA-N 0 0 353.346 3.751 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)NCc1ccc(Cl)cc1F ZINC000471153629 928123711 /nfs/dbraw/zinc/12/37/11/928123711.db2.gz HSZWPSCIMYMHTI-UHFFFAOYSA-N 0 0 352.749 3.716 20 5 FHBDRN Cc1ccc(-c2noc(CN3c4ccc([N+](=O)[O-])cc4C[C@@H]3C)n2)cc1 ZINC000728201510 928142054 /nfs/dbraw/zinc/14/20/54/928142054.db2.gz KSVHAWGWXMIOMY-ZDUSSCGKSA-N 0 0 350.378 3.904 20 5 FHBDRN CCOC(=O)[C@@]1(NCc2ccc(Cl)cc2[N+](=O)[O-])CCc2ccccc21 ZINC000610214935 928155406 /nfs/dbraw/zinc/15/54/06/928155406.db2.gz YRDTVVYRBNPNOA-LJQANCHMSA-N 0 0 374.824 3.743 20 5 FHBDRN Cc1c(Br)cc(C(=O)N2C[C@@H]3CCCC[C@H]3C2)cc1[N+](=O)[O-] ZINC000126874454 928173528 /nfs/dbraw/zinc/17/35/28/928173528.db2.gz ISNVFULFDGTRBD-RYUDHWBXSA-N 0 0 367.243 3.928 20 5 FHBDRN COc1ccc(OC)c(CN(Cc2ccc([N+](=O)[O-])cc2OC)C2CC2)c1 ZINC000430215666 928186970 /nfs/dbraw/zinc/18/69/70/928186970.db2.gz FKMSTLGWZRFNKJ-UHFFFAOYSA-N 0 0 372.421 3.785 20 5 FHBDRN COc1ccc(OCCSc2ccc3c(c2)OCCO3)c([N+](=O)[O-])c1 ZINC000610217056 928205722 /nfs/dbraw/zinc/20/57/22/928205722.db2.gz JIGIRUNXFJQAFN-UHFFFAOYSA-N 0 0 363.391 3.546 20 5 FHBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N[C@H](C)c1cccc(O)c1 ZINC000430216538 928210917 /nfs/dbraw/zinc/21/09/17/928210917.db2.gz FITUBOIFFHHFAF-GHMZBOCLSA-N 0 0 364.785 3.599 20 5 FHBDRN O=C(Cc1ccc(F)c(F)c1)OCCSc1ccc([N+](=O)[O-])cc1 ZINC000784938559 928228001 /nfs/dbraw/zinc/22/80/01/928228001.db2.gz PATZHMJGMUQWCP-UHFFFAOYSA-N 0 0 353.346 3.751 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(OCc2ccc(Cl)cc2OC)c1 ZINC000475988149 928241266 /nfs/dbraw/zinc/24/12/66/928241266.db2.gz OUICHKNRHKOCJA-UHFFFAOYSA-N 0 0 351.742 3.622 20 5 FHBDRN COc1c(F)cc(S(=O)(=O)Nc2ccc(Cl)cc2C)cc1[N+](=O)[O-] ZINC000187166243 928243779 /nfs/dbraw/zinc/24/37/79/928243779.db2.gz QAPDQNKYIYPCDN-UHFFFAOYSA-N 0 0 374.777 3.505 20 5 FHBDRN O=C(c1ccn(-c2cccc([N+](=O)[O-])c2)n1)N1CCc2c1cccc2Cl ZINC000157569331 928266766 /nfs/dbraw/zinc/26/67/66/928266766.db2.gz RRZJJLXCKUMRMB-UHFFFAOYSA-N 0 0 368.780 3.637 20 5 FHBDRN CC1CCN(c2ccc(C(=O)NCCc3ccsc3)cc2[N+](=O)[O-])CC1 ZINC000510099517 928272529 /nfs/dbraw/zinc/27/25/29/928272529.db2.gz BZFDDBKRDLSPMW-UHFFFAOYSA-N 0 0 373.478 3.865 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1CN1C[C@H](c2ccccc2C)OC[C@@H]1C ZINC000430221812 928283907 /nfs/dbraw/zinc/28/39/07/928283907.db2.gz UGGZXFDERZBUBB-MGPUTAFESA-N 0 0 356.422 3.874 20 5 FHBDRN COc1cccc(C(=O)OCCSc2ccc([N+](=O)[O-])cc2)c1OC ZINC000784938974 928308941 /nfs/dbraw/zinc/30/89/41/928308941.db2.gz OGAOPCLBTVKUGR-UHFFFAOYSA-N 0 0 363.391 3.561 20 5 FHBDRN O=C(OCCSc1ccc([N+](=O)[O-])cc1)c1ccc(C(F)(F)F)cn1 ZINC000784939028 928309318 /nfs/dbraw/zinc/30/93/18/928309318.db2.gz PYLZUOHVEODWJU-UHFFFAOYSA-N 0 0 372.324 3.958 20 5 FHBDRN Cc1nn(CCC(=O)N2CCCC[C@@H]2c2ccc(C)cc2)c(C)c1[N+](=O)[O-] ZINC000126935976 928315721 /nfs/dbraw/zinc/31/57/21/928315721.db2.gz ZZKTZYGKFLZSFE-GOSISDBHSA-N 0 0 370.453 3.860 20 5 FHBDRN O=C(/C=C\c1ccnc(Cl)c1)OCCSc1ccc([N+](=O)[O-])cc1 ZINC000784939754 928319458 /nfs/dbraw/zinc/31/94/58/928319458.db2.gz SPARFGWOUZAJSS-BHQIHCQQSA-N 0 0 364.810 3.992 20 5 FHBDRN CCOC(=O)c1cccc(N(CC)C(=O)c2cc(C)ccc2[N+](=O)[O-])c1 ZINC000610225383 928323278 /nfs/dbraw/zinc/32/32/78/928323278.db2.gz RSYUEQRKFJXDRW-UHFFFAOYSA-N 0 0 356.378 3.747 20 5 FHBDRN Cc1cc(N[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C)cc(C(=O)[O-])c1[N+](=O)[O-] ZINC000583207845 937237635 /nfs/dbraw/zinc/23/76/35/937237635.db2.gz VOZKPPAWKCQDJT-KDOFPFPSSA-N 0 0 369.421 3.534 20 5 FHBDRN Cc1cc(N[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C)cc(C(=O)[O-])c1[N+](=O)[O-] ZINC000583207847 937237839 /nfs/dbraw/zinc/23/78/39/937237839.db2.gz VOZKPPAWKCQDJT-KSSFIOAISA-N 0 0 369.421 3.534 20 5 FHBDRN CC(C)[C@@H](CNC(=O)c1ccc([N+](=O)[O-])c2cccnc12)c1cccnc1 ZINC000157625062 928341695 /nfs/dbraw/zinc/34/16/95/928341695.db2.gz XCAYTPBWIAWZAA-QGZVFWFLSA-N 0 0 364.405 3.708 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1)c(F)cnc2NCc1ccc(-c2ncon2)cc1 ZINC001167077468 928387428 /nfs/dbraw/zinc/38/74/28/928387428.db2.gz OHKCXYVSWFDPPG-UHFFFAOYSA-N 0 0 365.324 3.944 20 5 FHBDRN COc1ccc(CCCN(C)C(=O)c2c(C)c(C)ccc2[N+](=O)[O-])cc1 ZINC001125299140 928445612 /nfs/dbraw/zinc/44/56/12/928445612.db2.gz UVCBZHJHARIOSU-UHFFFAOYSA-N 0 0 356.422 3.925 20 5 FHBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)OCC[C@@H]1CCCCO1 ZINC000784942406 928462759 /nfs/dbraw/zinc/46/27/59/928462759.db2.gz OMXKTIQLRLMQHT-YPMHNXCESA-N 0 0 357.790 3.518 20 5 FHBDRN Cc1c(Br)cc(C(=O)N(C)[C@H](C)C2(C)CC2)cc1[N+](=O)[O-] ZINC000127067193 928500579 /nfs/dbraw/zinc/50/05/79/928500579.db2.gz LSCCZJWSTOXRQG-SNVBAGLBSA-N 0 0 355.232 3.926 20 5 FHBDRN COc1ccccc1C[C@H]1CCCN1C(=O)c1cc(F)ccc1[N+](=O)[O-] ZINC000161600946 937255136 /nfs/dbraw/zinc/25/51/36/937255136.db2.gz SOKZVEHVDRBFHQ-OAHLLOKOSA-N 0 0 358.369 3.590 20 5 FHBDRN COc1cc(C(=O)N[C@@H](C)CSc2ccc(C)cc2)ccc1[N+](=O)[O-] ZINC000472283406 937260067 /nfs/dbraw/zinc/26/00/67/937260067.db2.gz IWCHEOTXDFXMBH-ZDUSSCGKSA-N 0 0 360.435 3.822 20 5 FHBDRN CNC(=O)c1cccc(OC(=O)c2cc3ccccc3c3cccnc23)c1 ZINC000049697525 928640149 /nfs/dbraw/zinc/64/01/49/928640149.db2.gz KIJAXOZBVDPTJS-UHFFFAOYSA-N 0 0 356.381 3.967 20 5 FHBDRN CC[C@@](C)(NC(=O)c1cc(SC)ccc1[N+](=O)[O-])c1nccs1 ZINC000154258588 928643190 /nfs/dbraw/zinc/64/31/90/928643190.db2.gz RSUJOVTXKQPBLC-OAHLLOKOSA-N 0 0 351.453 3.828 20 5 FHBDRN CC(C)(c1nc(Cn2cnc3ccccc32)no1)c1ccc([N+](=O)[O-])cc1 ZINC000583235609 937266026 /nfs/dbraw/zinc/26/60/26/937266026.db2.gz GCFCICXYBZJKQM-UHFFFAOYSA-N 0 0 363.377 3.702 20 5 FHBDRN CC(C)CCOC1CCN(C(=O)c2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000154302276 928701550 /nfs/dbraw/zinc/70/15/50/928701550.db2.gz HPPGAVCHWPOYIZ-UHFFFAOYSA-N 0 0 354.834 3.916 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CSc1ccc(C(=O)N2CCCC2)cn1 ZINC000248156544 937272385 /nfs/dbraw/zinc/27/23/85/937272385.db2.gz ZDJFBUQRXYEYOP-UHFFFAOYSA-N 0 0 373.434 3.527 20 5 FHBDRN CCCN(C(=O)NCCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C1CC1 ZINC000509405988 928762800 /nfs/dbraw/zinc/76/28/00/928762800.db2.gz FOJPUCZWFMRCLG-UHFFFAOYSA-N 0 0 374.363 3.610 20 5 FHBDRN CC(C)n1cc([C@H](C)NC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)cn1 ZINC000547709212 928765873 /nfs/dbraw/zinc/76/58/73/928765873.db2.gz MQISFILDFQIBGD-AWEZNQCLSA-N 0 0 374.444 3.950 20 5 FHBDRN CC[C@H](Cc1ccccc1)N(C)C(=O)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000610234650 928820726 /nfs/dbraw/zinc/82/07/26/928820726.db2.gz AGJFSQNNHLPVDX-QGZVFWFLSA-N 0 0 356.422 3.626 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CCNC1(C(F)F)CCCCC1 ZINC000510128327 928855672 /nfs/dbraw/zinc/85/56/72/928855672.db2.gz RCGFMZBBRYPHQP-UHFFFAOYSA-N 0 0 355.385 3.789 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)NCc1ccc(CCO)cc1 ZINC000890637604 928879608 /nfs/dbraw/zinc/87/96/08/928879608.db2.gz RWQBOFUISBSFOW-UHFFFAOYSA-N 0 0 374.462 3.560 20 5 FHBDRN CSc1nc(C(C)(C)C)nc(C)c1C(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000471195767 928895567 /nfs/dbraw/zinc/89/55/67/928895567.db2.gz RDXGLDOMTMLPTF-UHFFFAOYSA-N 0 0 374.466 3.643 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cn1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000160263992 928912980 /nfs/dbraw/zinc/91/29/80/928912980.db2.gz IOIYKPPTIUJZHA-VIFPVBQESA-N 0 0 373.350 3.801 20 5 FHBDRN O=c1c2sccc2c(Br)cn1Cc1ccccc1[N+](=O)[O-] ZINC000583256003 937287453 /nfs/dbraw/zinc/28/74/53/937287453.db2.gz NUEQHPVRHRQSPF-UHFFFAOYSA-N 0 0 365.208 3.782 20 5 FHBDRN COc1ccc(CC(=O)NCc2c(Cl)cccc2Cl)cc1[N+](=O)[O-] ZINC000609010574 928953983 /nfs/dbraw/zinc/95/39/83/928953983.db2.gz JAUSGMQZAYBFCH-UHFFFAOYSA-N 0 0 369.204 3.769 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NCc1cccc(N(C)C)c1 ZINC000509673441 928964236 /nfs/dbraw/zinc/96/42/36/928964236.db2.gz OMZODUYYLOBMSM-UHFFFAOYSA-N 0 0 370.453 3.781 20 5 FHBDRN CC[C@@H](Cc1ccccc1)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000609042227 928971333 /nfs/dbraw/zinc/97/13/33/928971333.db2.gz RFHLXISTPBTCEQ-ZDUSSCGKSA-N 0 0 368.842 3.548 20 5 FHBDRN Cc1c(Br)cc(C(=O)OCC[C@@H]2CCCCO2)cc1[N+](=O)[O-] ZINC000784947980 928976602 /nfs/dbraw/zinc/97/66/02/928976602.db2.gz KKIOPRKUELCUEV-LBPRGKRZSA-N 0 0 372.215 3.782 20 5 FHBDRN CC(C)(C(=O)N[C@H]1CCOc2ccc(F)cc21)c1ccc([N+](=O)[O-])cc1 ZINC000547723901 928976710 /nfs/dbraw/zinc/97/67/10/928976710.db2.gz XGSFUKNBDPPHKC-INIZCTEOSA-N 0 0 358.369 3.652 20 5 FHBDRN C[C@@H](c1cccc(Br)c1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000134530618 928977133 /nfs/dbraw/zinc/97/71/33/928977133.db2.gz NAQFCVQTYKRUOR-JTQLQIEISA-N 0 0 370.224 3.892 20 5 FHBDRN Cc1cc(S(=O)(=O)N(CC(F)(F)F)[C@H](C)C(C)C)ccc1[N+](=O)[O-] ZINC000578270256 928983828 /nfs/dbraw/zinc/98/38/28/928983828.db2.gz SIZMHJHDOBIRGB-LLVKDONJSA-N 0 0 368.377 3.501 20 5 FHBDRN CC(C)(NC(=O)[C@H]1C[C@]12CCc1ccccc12)c1ccccc1[N+](=O)[O-] ZINC000579872155 929002889 /nfs/dbraw/zinc/00/28/89/929002889.db2.gz NUWXHTNVKWEHNL-UTKZUKDTSA-N 0 0 350.418 3.850 20 5 FHBDRN C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)N(C)c3ccccn3)cc2[N+](=O)[O-])C1 ZINC000134545949 929007667 /nfs/dbraw/zinc/00/76/67/929007667.db2.gz LEDHBACOHCSRLG-HUUCEWRRSA-N 0 0 368.437 3.749 20 5 FHBDRN CCc1ccc(C(=O)NCc2cnccc2C(F)(F)F)cc1[N+](=O)[O-] ZINC000598569444 929026709 /nfs/dbraw/zinc/02/67/09/929026709.db2.gz NONKOWSHEFWHJH-UHFFFAOYSA-N 0 0 353.300 3.501 20 5 FHBDRN COc1ccc(C(=O)NCC(C)(C)c2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000059827349 929080395 /nfs/dbraw/zinc/08/03/95/929080395.db2.gz JDVOCQYIRHXVOU-UHFFFAOYSA-N 0 0 362.813 3.964 20 5 FHBDRN Cc1noc(C)c1[C@H](C)CNC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000154660666 929126137 /nfs/dbraw/zinc/12/61/37/929126137.db2.gz GZRULPGSQWLYGP-MRVPVSSYSA-N 0 0 352.778 3.778 20 5 FHBDRN Cc1cccc(N(C)S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])c1C ZINC000146163617 937309919 /nfs/dbraw/zinc/30/99/19/937309919.db2.gz CKCQSZTZHUVZHE-UHFFFAOYSA-N 0 0 354.815 3.690 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1C[C@H]1c1ccccc1F ZINC000458006153 929200432 /nfs/dbraw/zinc/20/04/32/929200432.db2.gz POGNUFMPFFAOQV-DKSSEZFCSA-N 0 0 356.397 3.975 20 5 FHBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CC[C@H](c2ccco2)C1 ZINC000609528808 929204156 /nfs/dbraw/zinc/20/41/56/929204156.db2.gz BWQMLWFBNXIJDS-RYUDHWBXSA-N 0 0 364.785 3.625 20 5 FHBDRN CCC1(c2ccccc2)CN(C(=O)NCCc2ccccc2[N+](=O)[O-])C1 ZINC000458463407 937312093 /nfs/dbraw/zinc/31/20/93/937312093.db2.gz SODXDLRYPUSYCP-UHFFFAOYSA-N 0 0 353.422 3.511 20 5 FHBDRN CC(=O)c1ccc(NCCNc2ccc3ccccc3n2)c([N+](=O)[O-])c1 ZINC000060061436 929267972 /nfs/dbraw/zinc/26/79/72/929267972.db2.gz CVRRLLPYHKMRJU-UHFFFAOYSA-N 0 0 350.378 3.870 20 5 FHBDRN O=C(N[C@H]1CCOC2(CCCCC2)C1)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000154762158 929274294 /nfs/dbraw/zinc/27/42/94/929274294.db2.gz UWILLUUNJQIGSO-AWEZNQCLSA-N 0 0 369.421 3.755 20 5 FHBDRN COC(=O)CCCOc1ccc(CNc2ccsc2[N+](=O)[O-])cc1 ZINC000609631156 929280292 /nfs/dbraw/zinc/28/02/92/929280292.db2.gz QJQHWQIFQLVCMJ-UHFFFAOYSA-N 0 0 350.396 3.600 20 5 FHBDRN Cc1nn(C)c(C)c1Nc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000015113534 929293849 /nfs/dbraw/zinc/29/38/49/929293849.db2.gz UTLNWWJCHDLSML-UHFFFAOYSA-N 0 0 350.378 3.920 20 5 FHBDRN CCc1ccc(OCC(=O)N(C)[C@@H](C)c2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000609651055 929294671 /nfs/dbraw/zinc/29/46/71/929294671.db2.gz UYIWJFBJQDXMDB-ZDUSSCGKSA-N 0 0 360.385 3.895 20 5 FHBDRN CSc1ccc(C(=O)N[C@H](C)CC(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000165263693 929303571 /nfs/dbraw/zinc/30/35/71/929303571.db2.gz JRMBTUXTVYIQTR-GFCCVEGCSA-N 0 0 358.419 3.708 20 5 FHBDRN CNc1ccc(C(=O)N2CC[C@@H](c3ccccc3)[C@H](C)C2)cc1[N+](=O)[O-] ZINC000610243041 929359422 /nfs/dbraw/zinc/35/94/22/929359422.db2.gz MPNUAAGXGSPNOX-RHSMWYFYSA-N 0 0 353.422 3.902 20 5 FHBDRN C[C@H](NC(=O)c1c[nH]nc1[N+](=O)[O-])c1ccc(Oc2ccccc2)cc1 ZINC000547758247 929405129 /nfs/dbraw/zinc/40/51/29/929405129.db2.gz XNYMFKQGPYMNGW-LBPRGKRZSA-N 0 0 352.350 3.601 20 5 FHBDRN C[C@@H]1C[C@H](c2cccnc2)N(CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000359875654 929421210 /nfs/dbraw/zinc/42/12/10/929421210.db2.gz NSYBOFRJRZKDCF-SJKOYZFVSA-N 0 0 374.828 3.665 20 5 FHBDRN Cc1cnn(Cc2ccccc2F)c1NC(=O)c1csc([N+](=O)[O-])c1 ZINC000187198196 929422716 /nfs/dbraw/zinc/42/27/16/929422716.db2.gz CMBQSRMJLUDUIW-UHFFFAOYSA-N 0 0 360.370 3.601 20 5 FHBDRN CC(=O)Nc1ccc(C)c(C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)c1 ZINC000187199484 929424096 /nfs/dbraw/zinc/42/40/96/929424096.db2.gz NFMRVXKALFYANA-UHFFFAOYSA-N 0 0 369.421 3.614 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1cnn(-c2ccc(Cl)cc2)c1 ZINC000044490270 937331143 /nfs/dbraw/zinc/33/11/43/937331143.db2.gz JSCGRWAPAQSTKA-UHFFFAOYSA-N 0 0 370.796 3.706 20 5 FHBDRN C[C@H](NC(=O)NC[C@@H]1CCc2ccccc2C1)c1cccc([N+](=O)[O-])c1 ZINC000609771595 929450579 /nfs/dbraw/zinc/45/05/79/929450579.db2.gz PVORUSBILIPOQX-LSDHHAIUSA-N 0 0 353.422 3.760 20 5 FHBDRN COc1ccc(CC(=O)N2C[C@H](C)C[C@@H]2c2cccc(F)c2)cc1[N+](=O)[O-] ZINC000610244129 929471062 /nfs/dbraw/zinc/47/10/62/929471062.db2.gz ANIBUYZDHMQZID-CXAGYDPISA-N 0 0 372.396 3.895 20 5 FHBDRN O=[N+]([O-])c1ncccc1N1CCO[C@@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000611763811 937338701 /nfs/dbraw/zinc/33/87/01/937338701.db2.gz OECNXNDOIHAMPS-CQSZACIVSA-N 0 0 353.300 3.587 20 5 FHBDRN CCN(C(=O)c1cc(C)ccc1[N+](=O)[O-])[C@@H](COC)Cc1ccccc1 ZINC000471446044 929656312 /nfs/dbraw/zinc/65/63/12/929656312.db2.gz ZISPEOZYPCGQNK-QGZVFWFLSA-N 0 0 356.422 3.623 20 5 FHBDRN CC(C)CCN(C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)C1CC1 ZINC000248294904 937349740 /nfs/dbraw/zinc/34/97/40/937349740.db2.gz WJIYORUHWJFIPB-UHFFFAOYSA-N 0 0 359.470 3.848 20 5 FHBDRN CCn1ccnc1S[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000011889841 929688224 /nfs/dbraw/zinc/68/82/24/929688224.db2.gz LVGCPYGBEDUBGW-VIFPVBQESA-N 0 0 354.819 3.584 20 5 FHBDRN CCCOc1cc(O)ccc1NC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc21 ZINC000430459632 929689302 /nfs/dbraw/zinc/68/93/02/929689302.db2.gz KGJRCIHHBFRPSY-UHFFFAOYSA-N 0 0 355.350 3.823 20 5 FHBDRN CC(C)(C)c1coc(NC(=O)c2ccc(Br)cc2[N+](=O)[O-])n1 ZINC000583330181 937352287 /nfs/dbraw/zinc/35/22/87/937352287.db2.gz PDNAOBBEYJYGLV-UHFFFAOYSA-N 0 0 368.187 3.895 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1CN(C)CC(=O)Nc1c(C)cccc1C ZINC000177636175 929722873 /nfs/dbraw/zinc/72/28/73/929722873.db2.gz CXTCIVBHXWTHGI-UHFFFAOYSA-N 0 0 371.437 3.681 20 5 FHBDRN O=C(c1c[nH]c2cccc([N+](=O)[O-])c12)N1CC[C@H](c2cccc(F)c2)C1 ZINC000560298691 929726580 /nfs/dbraw/zinc/72/65/80/929726580.db2.gz SENPLAUDFAIJSI-ZDUSSCGKSA-N 0 0 353.353 3.845 20 5 FHBDRN CCCCO[C@@H]1C[C@H](NC(=O)c2c(Cl)cccc2[N+](=O)[O-])C1(C)C ZINC000177642427 929727737 /nfs/dbraw/zinc/72/77/37/929727737.db2.gz FQRHQKDLSQIQKN-UONOGXRCSA-N 0 0 354.834 3.962 20 5 FHBDRN O=C(COc1ccc(Cl)c(Cl)c1)N1CCc2c1cccc2[N+](=O)[O-] ZINC000609972700 929747040 /nfs/dbraw/zinc/74/70/40/929747040.db2.gz PWCVLBUCVDZSKP-UHFFFAOYSA-N 0 0 367.188 3.870 20 5 FHBDRN Cc1c(C(=O)NCc2ccc(OC3CCCC3)nc2)cccc1[N+](=O)[O-] ZINC000046302706 929747288 /nfs/dbraw/zinc/74/72/88/929747288.db2.gz QVEZUGFKWNIHCN-UHFFFAOYSA-N 0 0 355.394 3.550 20 5 FHBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCC(=O)Nc2ccccc21 ZINC000118845728 929762104 /nfs/dbraw/zinc/76/21/04/929762104.db2.gz FPZHWGIBLMZXME-UHFFFAOYSA-N 0 0 355.394 3.731 20 5 FHBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)c1nc(-c2ccncc2)cs1 ZINC000109906297 929768841 /nfs/dbraw/zinc/76/88/41/929768841.db2.gz VEIREJKOSYTSFR-LLVKDONJSA-N 0 0 354.391 3.604 20 5 FHBDRN Cc1cc(NCc2ccc(Cn3cncn3)cc2)c2cccc([N+](=O)[O-])c2n1 ZINC000579987745 929774119 /nfs/dbraw/zinc/77/41/19/929774119.db2.gz CQJDWESPNSLBLA-UHFFFAOYSA-N 0 0 374.404 3.703 20 5 FHBDRN Cc1ccccc1[C@@H]1C[C@H](C)N(S(=O)(=O)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000610005826 929774924 /nfs/dbraw/zinc/77/49/24/929774924.db2.gz FGEHYIVHLUZNGG-JKSUJKDBSA-N 0 0 374.462 3.778 20 5 FHBDRN O=C(c1ccn(-c2cccc([N+](=O)[O-])c2)n1)N1CC[C@H]1c1cccc(F)c1 ZINC000610305263 929779087 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357.410 3.544 20 5 FHBDRN CCO[C@H]1C[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2Cl)C12CCCC2 ZINC000610309548 929807186 /nfs/dbraw/zinc/80/71/86/929807186.db2.gz JXINKKWHCYDGDG-GJZGRUSLSA-N 0 0 352.818 3.716 20 5 FHBDRN CNc1ccc(C(=O)N[C@@H](Cc2ccc(F)cc2)C(C)C)cc1[N+](=O)[O-] ZINC000610311055 929811250 /nfs/dbraw/zinc/81/12/50/929811250.db2.gz CPAXUHIATSEQEG-KRWDZBQOSA-N 0 0 359.401 3.773 20 5 FHBDRN O=[N+]([O-])c1ccc(Sc2nc(Cl)ncc2NCc2cccnn2)cc1 ZINC001167324307 929821885 /nfs/dbraw/zinc/82/18/85/929821885.db2.gz CLUSBZNWLSEGBE-UHFFFAOYSA-N 0 0 374.813 3.592 20 5 FHBDRN O=C(CCc1c(Cl)cccc1[N+](=O)[O-])N(CC(F)(F)F)C1CC1 ZINC001125397565 929866647 /nfs/dbraw/zinc/86/66/47/929866647.db2.gz OYRINVDJNFUAPX-UHFFFAOYSA-N 0 0 350.724 3.734 20 5 FHBDRN COc1ccc2c(c1)OCC[C@@H]2NC(=O)Nc1ccc(C)c([N+](=O)[O-])c1 ZINC000610316921 929872785 /nfs/dbraw/zinc/87/27/85/929872785.db2.gz KQHYWBZHAUOUHG-HNNXBMFYSA-N 0 0 357.366 3.557 20 5 FHBDRN Cc1cccc(C)c1OCCNC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000109873352 929891818 /nfs/dbraw/zinc/89/18/18/929891818.db2.gz CDJLZBITUQDIIY-UHFFFAOYSA-N 0 0 353.378 3.502 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)N(C)[C@@H](C)c1ccccc1F ZINC000121101951 929892100 /nfs/dbraw/zinc/89/21/00/929892100.db2.gz OMHPGYSBYIAJBW-ZDUSSCGKSA-N 0 0 373.384 3.509 20 5 FHBDRN O=[N+]([O-])c1cccc(OC[C@H](O)COc2ccc(Cl)cc2Cl)c1 ZINC000579135451 929912115 /nfs/dbraw/zinc/91/21/15/929912115.db2.gz QFSJYAWHCKFLSS-LBPRGKRZSA-N 0 0 358.177 3.720 20 5 FHBDRN O=C(Nc1ccc2cc([N+](=O)[O-])ccc2n1)c1cc2c(s1)CCOC2 ZINC000176698592 937379284 /nfs/dbraw/zinc/37/92/84/937379284.db2.gz YGDNISMCNWHTGP-UHFFFAOYSA-N 0 0 355.375 3.530 20 5 FHBDRN COc1ccc(CC(=O)N(C)[C@@H](C)Cc2ccccc2C)cc1[N+](=O)[O-] ZINC000583357378 937375103 /nfs/dbraw/zinc/37/51/03/937375103.db2.gz ICUODUUKTGNGSP-HNNXBMFYSA-N 0 0 356.422 3.544 20 5 FHBDRN C[C@@H](COc1ccc(F)cc1F)NC(=O)c1cccc(Cl)c1[N+](=O)[O-] ZINC000175790045 929995974 /nfs/dbraw/zinc/99/59/74/929995974.db2.gz LORSXYWPGRKHCD-VIFPVBQESA-N 0 0 370.739 3.724 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FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[C@@H](c2ccc(F)cc2)C1 ZINC000471522602 930147705 /nfs/dbraw/zinc/14/77/05/930147705.db2.gz XXXBBSOYMRNBFN-UKRRQHHQSA-N 0 0 358.369 3.809 20 5 FHBDRN O=C(COCC(F)(F)F)N(Cc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000610365337 930148530 /nfs/dbraw/zinc/14/85/30/930148530.db2.gz VDVCMDXAEFEABK-UHFFFAOYSA-N 0 0 368.311 3.707 20 5 FHBDRN COc1ccc(C)cc1CN1CCN([C@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000610367434 930163551 /nfs/dbraw/zinc/16/35/51/930163551.db2.gz HWDBVUIHCUPSQT-QGZVFWFLSA-N 0 0 369.465 3.791 20 5 FHBDRN O=C(N[C@H]1CCOc2ccc(F)cc21)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000548052136 930167996 /nfs/dbraw/zinc/16/79/96/930167996.db2.gz KUKRRUBBJRDVFW-AWEZNQCLSA-N 0 0 356.309 3.734 20 5 FHBDRN CCN(C(=O)c1cccc(Cl)c1[N+](=O)[O-])c1ccccc1C(=O)OC ZINC000175885464 930184115 /nfs/dbraw/zinc/18/41/15/930184115.db2.gz WTIHHVXSCDGURJ-UHFFFAOYSA-N 0 0 362.769 3.702 20 5 FHBDRN CC(=O)Nc1ccc(C)c2c1CCCN2C(=O)c1cc(C)ccc1[N+](=O)[O-] ZINC000275759663 930188318 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CCCCCn1nc(C)cc1NC(=O)c1cc(OCC)ccc1[N+](=O)[O-] ZINC000580084119 930229932 /nfs/dbraw/zinc/22/99/32/930229932.db2.gz JYGSTSRMTHCBFU-UHFFFAOYSA-N 0 0 360.414 3.941 20 5 FHBDRN CCn1c(-c2sccc2C)nnc1N(C)Cc1ccccc1[N+](=O)[O-] ZINC000580099024 930248512 /nfs/dbraw/zinc/24/85/12/930248512.db2.gz MUHNPKPBWBHHIJ-UHFFFAOYSA-N 0 0 357.439 3.880 20 5 FHBDRN COc1cccc([N+](=O)[O-])c1NCc1ccc(OCC(F)(F)F)nc1 ZINC000583391994 937399245 /nfs/dbraw/zinc/39/92/45/937399245.db2.gz PNGJEZYHMUKGDI-UHFFFAOYSA-N 0 0 357.288 3.552 20 5 FHBDRN CC(=O)Nc1nnc(Sc2c(Cl)cc(Cl)cc2[N+](=O)[O-])s1 ZINC000580109796 930253514 /nfs/dbraw/zinc/25/35/14/930253514.db2.gz RDKAJCAJANFRSS-UHFFFAOYSA-N 0 0 365.223 3.863 20 5 FHBDRN C[C@@H](C(=O)Nc1nc(-c2cccnc2)cs1)c1cccc([N+](=O)[O-])c1 ZINC000560979587 930259938 /nfs/dbraw/zinc/25/99/38/930259938.db2.gz GUJLCMURWUWYEZ-LLVKDONJSA-N 0 0 354.391 3.856 20 5 FHBDRN O=C1OCCN1CCCNc1cc(Cl)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000728287133 930276499 /nfs/dbraw/zinc/27/64/99/930276499.db2.gz SNKQWURCSDVNHS-UHFFFAOYSA-N 0 0 367.711 3.521 20 5 FHBDRN CC1(C)CN(C(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C(C)(C)CO1 ZINC000610388278 930293255 /nfs/dbraw/zinc/29/32/55/930293255.db2.gz RNNYWAWHWFNJCF-UHFFFAOYSA-N 0 0 360.332 3.643 20 5 FHBDRN COCC1(CN[C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)CCCCC1 ZINC000564426663 930300207 /nfs/dbraw/zinc/30/02/07/930300207.db2.gz CGKPODGUKBVBRB-SFHVURJKSA-N 0 0 372.469 3.604 20 5 FHBDRN Cc1nc(NC(=O)c2ccc([N+](=O)[O-])o2)sc1Cc1cccc(F)c1 ZINC000055582603 930306152 /nfs/dbraw/zinc/30/61/52/930306152.db2.gz RQKOXBQLMSDKSF-UHFFFAOYSA-N 0 0 361.354 3.935 20 5 FHBDRN C[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)[C@H](c2ccco2)C1 ZINC000610389639 930306710 /nfs/dbraw/zinc/30/67/10/930306710.db2.gz SXMMQGKGBZVHPO-DOMZBBRYSA-N 0 0 372.377 3.572 20 5 FHBDRN CCSc1ccccc1C(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000580151839 930310939 /nfs/dbraw/zinc/31/09/39/930310939.db2.gz SOORBWMHLHSKFH-UHFFFAOYSA-N 0 0 356.407 3.513 20 5 FHBDRN O=[N+]([O-])c1cc(F)cnc1-c1noc(-c2cncc(-c3cccs3)c2)n1 ZINC001213059934 937406716 /nfs/dbraw/zinc/40/67/16/937406716.db2.gz VXDHUWVPRCQVIT-UHFFFAOYSA-N 0 0 369.337 3.969 20 5 FHBDRN O=Cc1ccc([N+](=O)[O-])c(OCc2cc(Cl)c3c(c2)OCCCO3)c1 ZINC000748154257 930342364 /nfs/dbraw/zinc/34/23/64/930342364.db2.gz NGXUAGJRPZARLJ-UHFFFAOYSA-N 0 0 363.753 3.801 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1)c1cc(Br)cnc1Cl ZINC000050044581 930370181 /nfs/dbraw/zinc/37/01/81/930370181.db2.gz UMATVQVEFIHQLH-UHFFFAOYSA-N 0 0 356.563 3.658 20 5 FHBDRN O=C(c1sc(Br)cc1[N+](=O)[O-])N1Cc2ccccc2CO1 ZINC000583401209 937410776 /nfs/dbraw/zinc/41/07/76/937410776.db2.gz GCVGKNAWWDBQFF-UHFFFAOYSA-N 0 0 369.196 3.506 20 5 FHBDRN CO[C@@H](CNC(=O)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12)C(C)C ZINC000275809011 930387952 /nfs/dbraw/zinc/38/79/52/930387952.db2.gz QJGYCZZSBGJGHV-KRWDZBQOSA-N 0 0 374.387 3.773 20 5 FHBDRN CCCC[C@H](C)N(CCCC)C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000580233359 930390822 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FHBDRN NC(=O)C[C@@H](Nc1ccc(Cl)cc1[N+](=O)[O-])c1cccc(Cl)c1 ZINC000471558792 930508719 /nfs/dbraw/zinc/50/87/19/930508719.db2.gz LLUZJROEDMYMPU-CYBMUJFWSA-N 0 0 354.193 3.930 20 5 FHBDRN C[C@@H]1C(=O)CC[C@@H](C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)C1(C)C ZINC000275844073 930522757 /nfs/dbraw/zinc/52/27/57/930522757.db2.gz WCOLHTNALVSLGU-PBHICJAKSA-N 0 0 360.454 3.675 20 5 FHBDRN Cc1ccc(Sc2ccc(C(=O)N[C@@H](C)C(C)(C)O)cc2[N+](=O)[O-])cc1 ZINC000610430565 930523727 /nfs/dbraw/zinc/52/37/27/930523727.db2.gz XRBANUMAYCEUJI-ZDUSSCGKSA-N 0 0 374.462 3.944 20 5 FHBDRN CC1CCN(c2ccc(C(=O)OCC[C@@H]3CCCC3=O)cc2[N+](=O)[O-])CC1 ZINC000748161727 930526332 /nfs/dbraw/zinc/52/63/32/930526332.db2.gz MPTPVDNPGRRUAS-HNNXBMFYSA-N 0 0 374.437 3.747 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1)N[C@@H]1CCCN(c2ccccc2F)C1 ZINC000536486594 930529645 /nfs/dbraw/zinc/52/96/45/930529645.db2.gz XUNBRXBJQJMYFY-CQSZACIVSA-N 0 0 358.373 3.524 20 5 FHBDRN COCCC1(CNC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)CCCC1 ZINC000119040989 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O=C(NC1CC1)c1cccc(CNc2ccc([N+](=O)[O-])c3cccnc23)c1 ZINC000052335976 937427199 /nfs/dbraw/zinc/42/71/99/937427199.db2.gz HJHUUSHVZKPHEQ-UHFFFAOYSA-N 0 0 362.389 3.647 20 5 FHBDRN Cc1cc(F)c([N+](=O)[O-])cc1C(=O)Nc1ccc2[nH]c(=O)cc(C)c2c1 ZINC001167389526 930608725 /nfs/dbraw/zinc/60/87/25/930608725.db2.gz VJHISKKWWVXABZ-UHFFFAOYSA-N 0 0 355.325 3.857 20 5 FHBDRN CCN(CCCNC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000580389585 930613771 /nfs/dbraw/zinc/61/37/71/930613771.db2.gz PNJZVCLTEIEZKW-MRXNPFEDSA-N 0 0 355.438 3.731 20 5 FHBDRN C[C@H](C(=O)NCCc1ccc(OC(F)F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000580389540 930613814 /nfs/dbraw/zinc/61/38/14/930613814.db2.gz IQVBTCVNTAQDDM-LBPRGKRZSA-N 0 0 364.348 3.659 20 5 FHBDRN CCOC(=O)CN(C(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1)C(C)C ZINC000275876870 930623135 /nfs/dbraw/zinc/62/31/35/930623135.db2.gz WGIFFIMUAKHBCZ-UHFFFAOYSA-N 0 0 366.417 3.507 20 5 FHBDRN Cc1ccc([C@H](C)[C@@H](O)C(=O)N2CCCCc3ccc([N+](=O)[O-])cc32)cc1 ZINC001167393748 930628751 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CCOc1ccc([N+](=O)[O-])c(C(=O)NCCOc2ccccc2C(C)C)c1 ZINC000579687809 930773882 /nfs/dbraw/zinc/77/38/82/930773882.db2.gz FTWREVNVKAHXGY-UHFFFAOYSA-N 0 0 372.421 3.926 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N[C@@H]1CCO[C@H](C(C)(C)C)C1 ZINC000275900728 930785583 /nfs/dbraw/zinc/78/55/83/930785583.db2.gz UDGDXUJTTPYAGU-OCCSQVGLSA-N 0 0 354.834 3.880 20 5 FHBDRN C[C@H](NC(=O)N1Cc2ccccc2N(C)C[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000083711964 930793142 /nfs/dbraw/zinc/79/31/42/930793142.db2.gz VCQCNWASQOFTPH-GJZGRUSLSA-N 0 0 368.437 3.706 20 5 FHBDRN CC[C@@H]1c2ccsc2CCN1CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000050276501 930794088 /nfs/dbraw/zinc/79/40/88/930794088.db2.gz OBVCBCKVEGGCPY-CQSZACIVSA-N 0 0 359.451 3.913 20 5 FHBDRN CC(=O)c1ccc(OCc2nc(-c3cccc(C)c3)no2)c([N+](=O)[O-])c1 ZINC000119165374 930796636 /nfs/dbraw/zinc/79/66/36/930796636.db2.gz PRAQADFYHHQYMJ-UHFFFAOYSA-N 0 0 353.334 3.735 20 5 FHBDRN O=C(Nc1ccc(F)c([N+](=O)[O-])c1)c1ccn(-c2ccccc2Cl)n1 ZINC000050292805 930826403 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354.366 3.963 20 5 FHBDRN C[C@@H](NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)[C@H](C)c1ccccc1 ZINC000119244305 930951777 /nfs/dbraw/zinc/95/17/77/930951777.db2.gz OLXKZNKKFVPLGZ-UONOGXRCSA-N 0 0 351.406 3.927 20 5 FHBDRN CC(C)n1ncc2c1C[C@H](Nc1nc3c(cc1[N+](=O)[O-])CCCC3)CC2 ZINC000580642756 930965052 /nfs/dbraw/zinc/96/50/52/930965052.db2.gz IQRDRJWHNQMJJT-OAHLLOKOSA-N 0 0 355.442 3.615 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N1CCC[C@@H]1c1ccc2c(c1)OCO2 ZINC000077328694 930974967 /nfs/dbraw/zinc/97/49/67/930974967.db2.gz SJKHYJJDFYQMGP-MRXNPFEDSA-N 0 0 354.362 3.609 20 5 FHBDRN Cc1c(C(=O)N(Cc2cccc(F)c2)C[C@H]2CCCO2)cccc1[N+](=O)[O-] ZINC000050379933 930977900 /nfs/dbraw/zinc/97/79/00/930977900.db2.gz UZLOFIDKKAAEOY-QGZVFWFLSA-N 0 0 372.396 3.864 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N(C)Cc1ccc(OC)cc1 ZINC000119268031 930992282 /nfs/dbraw/zinc/99/22/82/930992282.db2.gz GHFAGXQOQGUYPX-UHFFFAOYSA-N 0 0 360.435 3.988 20 5 FHBDRN O=[N+]([O-])c1cc(CNC2(c3ccc(Cl)cc3)CC2)c2c(c1)COCO2 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FHBDRN Cc1cc(CCC(=O)O[C@H](c2cccnc2)c2ccccc2[N+](=O)[O-])no1 ZINC001266649806 931136315 /nfs/dbraw/zinc/13/63/15/931136315.db2.gz WCCMVWJIDAOLKJ-LJQANCHMSA-N 0 0 367.361 3.552 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[C@@](F)(c2ccccc2)C1 ZINC000579862864 931148853 /nfs/dbraw/zinc/14/88/53/931148853.db2.gz PWJMELLNGYPPOC-SFHVURJKSA-N 0 0 359.357 3.706 20 5 FHBDRN CC(C)(NC(=O)[C@@H]1C[C@]12CCc1ccccc12)c1ccccc1[N+](=O)[O-] ZINC000579872156 931170280 /nfs/dbraw/zinc/17/02/80/931170280.db2.gz NUWXHTNVKWEHNL-UWJYYQICSA-N 0 0 350.418 3.850 20 5 FHBDRN COc1cc(CN(C)C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)cc(OC)c1 ZINC000510352537 931190523 /nfs/dbraw/zinc/19/05/23/931190523.db2.gz UHDAZXIMCJLILJ-UHFFFAOYSA-N 0 0 359.382 3.584 20 5 FHBDRN CCOc1ccc(C(=O)N2CCCc3c(F)ccc(F)c32)cc1[N+](=O)[O-] ZINC000119336194 931216260 /nfs/dbraw/zinc/21/62/60/931216260.db2.gz HJOUEOATCCNIOC-UHFFFAOYSA-N 0 0 362.332 3.865 20 5 FHBDRN C[C@@H]1CN(c2nc3ccc([N+](=O)[O-])cc3c(=O)[nH]2)CC[C@@H]1c1ccccc1 ZINC000561213708 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O=[N+]([O-])c1cc(Cl)cc(Cl)c1NCCc1cn2c(n1)SCC2 ZINC000561275470 931406139 /nfs/dbraw/zinc/40/61/39/931406139.db2.gz NAHNOVNNMRPMOH-UHFFFAOYSA-N 0 0 359.238 3.858 20 5 FHBDRN COCc1cc([N+](=O)[O-])ccc1NCCc1nccn1Cc1ccccc1 ZINC000156752600 931428928 /nfs/dbraw/zinc/42/89/28/931428928.db2.gz SDCXZWSYXGTVBV-UHFFFAOYSA-N 0 0 366.421 3.641 20 5 FHBDRN Cc1nn(-c2ccccc2)cc1C(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000177875252 931430022 /nfs/dbraw/zinc/43/00/22/931430022.db2.gz RIWQATDVFCETFM-CQSZACIVSA-N 0 0 364.405 3.888 20 5 FHBDRN O=C(NCCCCOCc1ccccc1)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000050690382 931521987 /nfs/dbraw/zinc/52/19/87/931521987.db2.gz UTCKLDXDASWKDA-UHFFFAOYSA-N 0 0 367.405 3.803 20 5 FHBDRN CO[C@@](C)(c1noc(-c2cc(Br)cc([N+](=O)[O-])c2)n1)C1CC1 ZINC000564442335 931529816 /nfs/dbraw/zinc/52/98/16/931529816.db2.gz DBQDYHZIOLDAER-CQSZACIVSA-N 0 0 368.187 3.679 20 5 FHBDRN CC(C)CN(CC(=O)OCc1cccc([N+](=O)[O-])c1)C(=O)OC(C)(C)C ZINC001125485346 931571684 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COc1ccc(C(=O)N[C@H](C)c2ncc(-c3ccccc3)o2)cc1[N+](=O)[O-] ZINC000126329935 931721770 /nfs/dbraw/zinc/72/17/70/931721770.db2.gz ANKWHFJECNBOMG-GFCCVEGCSA-N 0 0 367.361 3.749 20 5 FHBDRN CCCCOc1cccc(NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2C)c1 ZINC000121284802 931733701 /nfs/dbraw/zinc/73/37/01/931733701.db2.gz CFCGEXPOOZBKAP-UHFFFAOYSA-N 0 0 371.393 3.659 20 5 FHBDRN CN(Cc1ccc2ccccc2c1)C(=O)c1cc(F)cc([N+](=O)[O-])c1N ZINC000048314227 931734144 /nfs/dbraw/zinc/73/41/44/931734144.db2.gz VBIPPXUJCOHOJW-UHFFFAOYSA-N 0 0 353.353 3.742 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NCc1nc(C2CC2)cs1 ZINC000157805436 931738134 /nfs/dbraw/zinc/73/81/34/931738134.db2.gz WIJRAGUTLNCXGT-UHFFFAOYSA-N 0 0 363.464 3.971 20 5 FHBDRN COC(=O)c1cc(C)nc(N2CC[C@H](c3ccccc3)C[C@H]2C)c1[N+](=O)[O-] ZINC000581256470 931745529 /nfs/dbraw/zinc/74/55/29/931745529.db2.gz AWMBLPRIWJSHQJ-ZBFHGGJFSA-N 0 0 369.421 3.857 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NCCCOC1CCCC1 ZINC000126361408 931763228 /nfs/dbraw/zinc/76/32/28/931763228.db2.gz CPYCPFKTWLXOOX-UHFFFAOYSA-N 0 0 352.456 3.786 20 5 FHBDRN CC[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2SCC(C)C)CCO1 ZINC000134422225 931764566 /nfs/dbraw/zinc/76/45/66/931764566.db2.gz SHWSZYXSJBCJTD-AWEZNQCLSA-N 0 0 352.456 3.594 20 5 FHBDRN CCOc1ccccc1NC(=O)COc1cc(Cl)ccc1[N+](=O)[O-] ZINC000121286627 931765251 /nfs/dbraw/zinc/76/52/51/931765251.db2.gz DWVSXIMBMPNQLK-UHFFFAOYSA-N 0 0 350.758 3.664 20 5 FHBDRN CN(C[C@H]1CCCO[C@H]1c1ccccc1)C(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000050894055 931792980 /nfs/dbraw/zinc/79/29/80/931792980.db2.gz NOSKYSNMXRGVNS-NQIIRXRSSA-N 0 0 368.433 3.764 20 5 FHBDRN O=C(Nc1ncc(Cl)s1)c1ccc([N+](=O)[O-])cc1Br ZINC000610492641 931810403 /nfs/dbraw/zinc/81/04/03/931810403.db2.gz KXLWMINQFRIKFE-UHFFFAOYSA-N 0 0 362.592 3.720 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1C(F)(F)F)N1CC[C@H](c2cccnc2)C1 ZINC000581312211 931814829 /nfs/dbraw/zinc/81/48/29/931814829.db2.gz MYYOWHDPMLTMBQ-LBPRGKRZSA-N 0 0 365.311 3.638 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCC(=O)NC[C@H](c2ccccc2)C(C)C)c1 ZINC000510384960 931826358 /nfs/dbraw/zinc/82/63/58/931826358.db2.gz PXGIVIBTYKGFIR-KRWDZBQOSA-N 0 0 356.422 3.838 20 5 FHBDRN Cc1cccc(CN(C)Cc2ccc(Br)c([N+](=O)[O-])c2)n1 ZINC000157820580 931865845 /nfs/dbraw/zinc/86/58/45/931865845.db2.gz WHNIXCITDVQSBO-UHFFFAOYSA-N 0 0 350.216 3.693 20 5 FHBDRN CCC[C@@H](C)NC(=O)[C@@H]1CCCN(c2ccc([N+](=O)[O-])c3cccnc32)C1 ZINC000050933949 931869718 /nfs/dbraw/zinc/86/97/18/931869718.db2.gz VGZZEIDFNLYXIO-HUUCEWRRSA-N 0 0 370.453 3.664 20 5 FHBDRN O=C1OC(c2c(Cl)cccc2[N+](=O)[O-])=N/C1=C/c1cccnc1Cl ZINC000255293805 931869763 /nfs/dbraw/zinc/86/97/63/931869763.db2.gz WCFFCLWPGCWEMI-JXMROGBWSA-N 0 0 364.144 3.641 20 5 FHBDRN COCCCOc1ccc(CNc2ccc(C(C)=O)cc2[N+](=O)[O-])cc1 ZINC000561340531 931872884 /nfs/dbraw/zinc/87/28/84/931872884.db2.gz RWIVIRDHYLTXMX-UHFFFAOYSA-N 0 0 358.394 3.825 20 5 FHBDRN C[C@H](NC(=O)c1cc(F)ccc1Br)c1cccc([N+](=O)[O-])c1 ZINC000048383039 931878718 /nfs/dbraw/zinc/87/87/18/931878718.db2.gz LODSHWDZFROKLY-VIFPVBQESA-N 0 0 367.174 3.987 20 5 FHBDRN Cc1cc(Br)oc1C(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000430572801 931913760 /nfs/dbraw/zinc/91/37/60/931913760.db2.gz OYOFFUOEJVAAOJ-UHFFFAOYSA-N 0 0 367.199 3.924 20 5 FHBDRN Cc1noc(C)c1[C@@H](C)C(=O)N1CCS[C@@H]1c1ccc([N+](=O)[O-])cc1 ZINC000610209982 931918883 /nfs/dbraw/zinc/91/88/83/931918883.db2.gz QEXVNRXDDNEGEK-BMLIUANNSA-N 0 0 361.423 3.577 20 5 FHBDRN O=C([C@H]1CCc2ccccc21)N1CCS[C@@H]1c1ccc([N+](=O)[O-])cc1 ZINC000610235060 931929232 /nfs/dbraw/zinc/92/92/32/931929232.db2.gz PVHORIZJCBBHCL-PKOBYXMFSA-N 0 0 354.431 3.899 20 5 FHBDRN CC(C)Oc1ccccc1CNC(=O)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000581387429 931936328 /nfs/dbraw/zinc/93/63/28/931936328.db2.gz UMNPVBMVRKNLPT-UHFFFAOYSA-N 0 0 371.437 3.766 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N[C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2 ZINC000165606492 931939959 /nfs/dbraw/zinc/93/99/59/931939959.db2.gz PEMCANCZNXLEMY-GLQYFDAESA-N 0 0 365.817 3.717 20 5 FHBDRN Cc1ocnc1CNC(=O)c1cc([N+](=O)[O-])ccc1SC1CCCC1 ZINC000134451952 931949903 /nfs/dbraw/zinc/94/99/03/931949903.db2.gz PXKLZCZOSKZUAT-UHFFFAOYSA-N 0 0 361.423 3.856 20 5 FHBDRN COc1cc(C(=O)NCC(C)(C)c2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000511853257 931958202 /nfs/dbraw/zinc/95/82/02/931958202.db2.gz JLWVLJNVPAXSJH-UHFFFAOYSA-N 0 0 362.813 3.964 20 5 FHBDRN C[C@H](NC(=O)NCC[C@H]1CNc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000891380523 931969343 /nfs/dbraw/zinc/96/93/43/931969343.db2.gz CHLDIMSRAKVBRL-ZFWWWQNUSA-N 0 0 354.410 3.554 20 5 FHBDRN CNc1ccc(C(=O)NC[C@H]2CCCC[C@@H]2C(F)(F)F)cc1[N+](=O)[O-] ZINC000610503528 931999072 /nfs/dbraw/zinc/99/90/72/931999072.db2.gz HGODOHXMVXTPGT-NEPJUHHUSA-N 0 0 359.348 3.735 20 5 FHBDRN CC(C)(C)[C@@H]1OCCC[C@@H]1CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000135169111 932021201 /nfs/dbraw/zinc/02/12/01/932021201.db2.gz CACNMAMQXTWPPK-BFUOFWGJSA-N 0 0 373.453 3.576 20 5 FHBDRN Cc1cccc(NC(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])c1O ZINC000610506044 932029953 /nfs/dbraw/zinc/02/99/53/932029953.db2.gz WRXXIASQVVSSRH-SNVBAGLBSA-N 0 0 350.758 3.668 20 5 FHBDRN Cc1cc([C@H](C)NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3F)n2)c(C)o1 ZINC001125501053 932041024 /nfs/dbraw/zinc/04/10/24/932041024.db2.gz AXULMLHZUAPDAB-NSHDSACASA-N 0 0 372.356 3.620 20 5 FHBDRN Cc1oc2nc(CN(Cc3ccc([N+](=O)[O-])cc3)C(C)C)nc(N)c2c1C ZINC000178007666 932068088 /nfs/dbraw/zinc/06/80/88/932068088.db2.gz MBSOJGNEZYYNDB-UHFFFAOYSA-N 0 0 369.425 3.741 20 5 FHBDRN CC[C@H](c1ccccc1)[N@H+](CCOc1ccc([N+](=O)[O-])cc1)CC(=O)[O-] ZINC000581440328 932076004 /nfs/dbraw/zinc/07/60/04/932076004.db2.gz DEOHMFBSHPTRJN-GOSISDBHSA-N 0 0 358.394 3.512 20 5 FHBDRN O=C(c1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCC([C@@H]2CCCO2)CC1 ZINC000276296973 932147732 /nfs/dbraw/zinc/14/77/32/932147732.db2.gz QSAWCNHWENZHSC-HNNXBMFYSA-N 0 0 372.343 3.645 20 5 FHBDRN CCc1nn(C)c(N[C@H](Cc2ccc(C)cc2)c2ccccn2)c1[N+](=O)[O-] ZINC000581495119 932165420 /nfs/dbraw/zinc/16/54/20/932165420.db2.gz SFWXUKPAHXJSRN-GOSISDBHSA-N 0 0 365.437 3.990 20 5 FHBDRN Cc1nn(C(C)(C)C)cc1[C@H](C)NC(=O)c1cc(F)c([N+](=O)[O-])cc1F ZINC000156237041 932166636 /nfs/dbraw/zinc/16/66/36/932166636.db2.gz MTIMHZDSBRZXTL-VIFPVBQESA-N 0 0 366.368 3.624 20 5 FHBDRN O=C(Nc1nc2cc3c(cc2s1)OCCCO3)c1cccc([N+](=O)[O-])c1 ZINC000060612135 932185239 /nfs/dbraw/zinc/18/52/39/932185239.db2.gz SKDNGGCEQRPGSA-UHFFFAOYSA-N 0 0 371.374 3.618 20 5 FHBDRN CC(=O)c1cc(N[C@@H]2C[C@H]2c2cnn(-c3ccccc3)c2)ccc1[N+](=O)[O-] ZINC000581540382 932227914 /nfs/dbraw/zinc/22/79/14/932227914.db2.gz YZZOSTHHZHQZSG-RBUKOAKNSA-N 0 0 362.389 3.951 20 5 FHBDRN COc1ccccc1C(C)(C)CNC(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC001125515769 932251920 /nfs/dbraw/zinc/25/19/20/932251920.db2.gz COGWGTXFCJFNMU-UHFFFAOYSA-N 0 0 356.422 3.928 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)NCc1ccc(C2CCC2)cc1 ZINC001211516160 932341352 /nfs/dbraw/zinc/34/13/52/932341352.db2.gz ZHROQABKIJLOEE-UHFFFAOYSA-N 0 0 374.462 3.958 20 5 FHBDRN COc1c(C(=O)N[C@@H](c2cc(F)ccc2F)C(F)F)cccc1[N+](=O)[O-] ZINC000477131068 932345830 /nfs/dbraw/zinc/34/58/30/932345830.db2.gz ZQYWPLAEOGXWCJ-ZDUSSCGKSA-N 0 0 372.274 3.618 20 5 FHBDRN CC(=O)Nc1ccc(NC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000157834751 932349861 /nfs/dbraw/zinc/34/98/61/932349861.db2.gz WUYPPILHBUSRBT-UHFFFAOYSA-N 0 0 370.409 3.698 20 5 FHBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2C[C@H](c3ccccc3)[C@H]3CCC[C@@H]32)cc1 ZINC000510440196 932358486 /nfs/dbraw/zinc/35/84/86/932358486.db2.gz BQYLCYFJZAHADY-QRVBRYPASA-N 0 0 372.446 3.552 20 5 FHBDRN CC[C@H](O)CCNc1ccc(C(=O)Nc2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000477160178 932360610 /nfs/dbraw/zinc/36/06/10/932360610.db2.gz FMXDIELSPDGAQN-INIZCTEOSA-N 0 0 357.410 3.728 20 5 FHBDRN O=[N+]([O-])c1cc(F)cc(-c2nc(-c3ccc(Br)o3)no2)c1 ZINC000477162399 932360910 /nfs/dbraw/zinc/36/09/10/932360910.db2.gz KTVCIEKLNRNBFP-UHFFFAOYSA-N 0 0 354.091 3.806 20 5 FHBDRN CCc1cc(NC(=O)Cc2ccc(Cl)cc2)c2cc([N+](=O)[O-])ccc2n1 ZINC001266777071 932362036 /nfs/dbraw/zinc/36/20/36/932362036.db2.gz KBCUSGODWPLKLL-UHFFFAOYSA-N 0 0 369.808 3.962 20 5 FHBDRN CCc1cc(NC(=O)c2cc3ccccc3n2C)c2cc([N+](=O)[O-])ccc2n1 ZINC001266777272 932362884 /nfs/dbraw/zinc/36/28/84/932362884.db2.gz MNZNNSULVXSUPU-UHFFFAOYSA-N 0 0 374.400 3.871 20 5 FHBDRN O=C(COc1ccc(Oc2ccccn2)cc1)Nc1ccc([N+](=O)[O-])cc1 ZINC000023056026 932367174 /nfs/dbraw/zinc/36/71/74/932367174.db2.gz NXODGXVHAWKTSX-UHFFFAOYSA-N 0 0 365.345 3.800 20 5 FHBDRN CSCCCCCNC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000477189052 932379659 /nfs/dbraw/zinc/37/96/59/932379659.db2.gz QJTYANBXAYJHOI-UHFFFAOYSA-N 0 0 359.879 3.623 20 5 FHBDRN Cc1c(CC(=O)N[C@@H](C)c2ccc(-n3cccn3)cc2)cccc1[N+](=O)[O-] ZINC000126706917 932384127 /nfs/dbraw/zinc/38/41/27/932384127.db2.gz ZDDOSPXKKBEGQE-HNNXBMFYSA-N 0 0 364.405 3.509 20 5 FHBDRN COc1cccc(CNC(=O)c2c(C)cc(Cl)cc2[N+](=O)[O-])c1OC ZINC000477196677 932391025 /nfs/dbraw/zinc/39/10/25/932391025.db2.gz SGAIYDIIPASJKE-UHFFFAOYSA-N 0 0 364.785 3.504 20 5 FHBDRN CCC(CC)N(CCOC)C(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000127219872 932409679 /nfs/dbraw/zinc/40/96/79/932409679.db2.gz LSDFAAZXDYSGQS-UHFFFAOYSA-N 0 0 362.348 3.891 20 5 FHBDRN COc1ccc([C@@H]2CCN(C(=O)Nc3cc([N+](=O)[O-])ccc3C)C2)cc1 ZINC000157852369 932413761 /nfs/dbraw/zinc/41/37/61/932413761.db2.gz QVOJLJPDBJUXJQ-OAHLLOKOSA-N 0 0 355.394 3.933 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc2c(=O)cc[nH]c2c1 ZINC000477227893 932423839 /nfs/dbraw/zinc/42/38/39/932423839.db2.gz LMNUTYJATWTENP-NSHDSACASA-N 0 0 369.402 3.556 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)NC[C@@H](C)N(C)c1ccccc1 ZINC000477280594 932444569 /nfs/dbraw/zinc/44/45/69/932444569.db2.gz RLDZRHBOUFOKEB-CYBMUJFWSA-N 0 0 361.829 3.811 20 5 FHBDRN CC(C)C[C@H]1OCCC[C@@H]1NC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000477299876 932456887 /nfs/dbraw/zinc/45/68/87/932456887.db2.gz WUNVMWBPHJETKC-LSDHHAIUSA-N 0 0 374.359 3.937 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCO[C@@]3(CCc4ccccc43)C2)c2ccncc21 ZINC000157884725 932467835 /nfs/dbraw/zinc/46/78/35/932467835.db2.gz XBMSXDQTZOGDIY-NRFANRHFSA-N 0 0 361.401 3.821 20 5 FHBDRN CNc1ccc(C(=O)NCCn2ccc3cc(Cl)ccc32)cc1[N+](=O)[O-] ZINC000581682971 932489924 /nfs/dbraw/zinc/48/99/24/932489924.db2.gz UWDPXQFCWKLVIR-UHFFFAOYSA-N 0 0 372.812 3.675 20 5 FHBDRN O=C(NCc1ccnc(Oc2ccc(F)cc2)c1)c1ccc([N+](=O)[O-])cc1 ZINC000109990834 932493157 /nfs/dbraw/zinc/49/31/57/932493157.db2.gz RSUHKBDZJOZFIA-UHFFFAOYSA-N 0 0 367.336 3.851 20 5 FHBDRN Cc1sc(NC(=O)Cc2ccc(C)nc2)nc1-c1cccc([N+](=O)[O-])c1 ZINC000097206963 932511539 /nfs/dbraw/zinc/51/15/39/932511539.db2.gz ZPJZIURBKDXZMP-UHFFFAOYSA-N 0 0 368.418 3.911 20 5 FHBDRN C[C@@H](OC(=O)/C=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2n1C ZINC000255366244 932518079 /nfs/dbraw/zinc/51/80/79/932518079.db2.gz NAEMPWUXHUHDFM-KIWPFMIBSA-N 0 0 351.362 3.799 20 5 FHBDRN CC(=O)c1ccc(N2CC[C@H](COCc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000078464976 932522192 /nfs/dbraw/zinc/52/21/92/932522192.db2.gz MNKCJMSLNDMZBQ-KRWDZBQOSA-N 0 0 354.406 3.841 20 5 FHBDRN COc1cc(CNc2ccccn2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000157421091 932524327 /nfs/dbraw/zinc/52/43/27/932524327.db2.gz MLXAGYLUZKKOLE-UHFFFAOYSA-N 0 0 357.288 3.552 20 5 FHBDRN Cc1nc(NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)ccc1Br ZINC000098003090 932540934 /nfs/dbraw/zinc/54/09/34/932540934.db2.gz ZRVVBRITZDQQOK-UHFFFAOYSA-N 0 0 370.590 3.966 20 5 FHBDRN Cc1ccc(CNC(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])nc1C ZINC000458026551 932548855 /nfs/dbraw/zinc/54/88/55/932548855.db2.gz ZCSDQEHFQTWMSE-UHFFFAOYSA-N 0 0 353.300 3.555 20 5 FHBDRN C[C@H](NC(=O)N1CCO[C@H](c2cccs2)C1)c1cccc([N+](=O)[O-])c1 ZINC000156365508 932552450 /nfs/dbraw/zinc/55/24/50/932552450.db2.gz SCLDHLXOKWOJFO-WFASDCNBSA-N 0 0 361.423 3.500 20 5 FHBDRN Cc1ccc(OCCNC(=O)c2c([N+](=O)[O-])cccc2C(F)(F)F)cc1 ZINC000581753310 932601766 /nfs/dbraw/zinc/60/17/66/932601766.db2.gz RZASGLKKDDGLLT-UHFFFAOYSA-N 0 0 368.311 3.731 20 5 FHBDRN Cc1c2ccccc2n(C)c1CNC(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000471686006 932605232 /nfs/dbraw/zinc/60/52/32/932605232.db2.gz CTAULHDMQJSRPN-CQSZACIVSA-N 0 0 366.421 3.955 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1F)NCCc1ccccc1C(F)(F)F ZINC000477438257 932607318 /nfs/dbraw/zinc/60/73/18/932607318.db2.gz IJAOVFOWMCCTNR-UHFFFAOYSA-N 0 0 370.302 3.654 20 5 FHBDRN CC(C)[C@@H]1CC[C@@H](C)C[C@@H]1CNC(=O)CN(C)c1ccccc1[N+](=O)[O-] ZINC001125532539 932607754 /nfs/dbraw/zinc/60/77/54/932607754.db2.gz QQGWNKXDVJUIKD-ZACQAIPSSA-N 0 0 361.486 3.856 20 5 FHBDRN COC(=O)c1cc(NC(=O)CCc2cccc([N+](=O)[O-])c2)c(C)cc1C ZINC000471687989 932609410 /nfs/dbraw/zinc/60/94/10/932609410.db2.gz ZNIQQQFNLVYCJQ-UHFFFAOYSA-N 0 0 356.378 3.570 20 5 FHBDRN C[C@@H]1C[C@H](NC(=O)OC(C)(C)C)CCN1Cc1csc([N+](=O)[O-])c1 ZINC000134630931 932612519 /nfs/dbraw/zinc/61/25/19/932612519.db2.gz OQLUXANVNLSTAZ-DGCLKSJQSA-N 0 0 355.460 3.534 20 5 FHBDRN CN(C)c1c(Cl)cccc1NC(=O)Cc1ccc([N+](=O)[O-])cc1F ZINC000477469313 932631920 /nfs/dbraw/zinc/63/19/20/932631920.db2.gz OPAJRMQHQZAFNW-UHFFFAOYSA-N 0 0 351.765 3.635 20 5 FHBDRN C[C@H](OC1CCCCCC1)C(=O)Nc1ccnn1-c1ccc([N+](=O)[O-])cc1 ZINC000471699961 932646137 /nfs/dbraw/zinc/64/61/37/932646137.db2.gz FQEVYCAPTYQOJS-AWEZNQCLSA-N 0 0 372.425 3.847 20 5 FHBDRN Cc1cnc(OCc2ccc(OCc3ccccn3)cc2)c([N+](=O)[O-])c1 ZINC000157934172 932661520 /nfs/dbraw/zinc/66/15/20/932661520.db2.gz SYZLRBKTTXXOCI-UHFFFAOYSA-N 0 0 351.362 3.851 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)c1ccc2nccnc2c1 ZINC000098036185 932686568 /nfs/dbraw/zinc/68/65/68/932686568.db2.gz QAJOGKXQWIRHJD-UHFFFAOYSA-N 0 0 350.378 3.589 20 5 FHBDRN CC(C)n1nc2c(c1NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl)CCC2 ZINC000471716837 932697658 /nfs/dbraw/zinc/69/76/58/932697658.db2.gz XQNSHGKGGQFLPO-UHFFFAOYSA-N 0 0 362.817 3.696 20 5 FHBDRN Nc1c(C(=O)N(Cc2ccco2)Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000178160770 932707381 /nfs/dbraw/zinc/70/73/81/932707381.db2.gz YWAARTOJSLOVCF-UHFFFAOYSA-N 0 0 351.362 3.613 20 5 FHBDRN O=C(NCc1nc(CNc2ccsc2[N+](=O)[O-])cs1)c1ccccc1 ZINC000610542297 932729443 /nfs/dbraw/zinc/72/94/43/932729443.db2.gz QURYSUDHBKAGDT-UHFFFAOYSA-N 0 0 374.447 3.655 20 5 FHBDRN CCOC(=O)c1sc(CNc2ccc([N+](=O)[O-])c(OCC)c2)nc1C ZINC000610542344 932729819 /nfs/dbraw/zinc/72/98/19/932729819.db2.gz WZIDBAHMTKDWQW-UHFFFAOYSA-N 0 0 365.411 3.547 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC[C@@H](Nc2ccccc2)C1 ZINC000178168055 932737970 /nfs/dbraw/zinc/73/79/70/932737970.db2.gz PLWKNVVNSXNODA-OAHLLOKOSA-N 0 0 370.409 3.712 20 5 FHBDRN Cc1nc(-c2cccc(NC(=O)c3cccc([N+](=O)[O-])c3N)c2)oc1C ZINC000178173491 932756152 /nfs/dbraw/zinc/75/61/52/932756152.db2.gz RGPYLZGHTIAHSG-UHFFFAOYSA-N 0 0 352.350 3.701 20 5 FHBDRN COc1ccc([C@@H]2CCCN2Cc2ccc(OC)c([N+](=O)[O-])c2)c(OC)c1 ZINC000051260305 932757534 /nfs/dbraw/zinc/75/75/34/932757534.db2.gz FSRWMAXGKIKVOZ-KRWDZBQOSA-N 0 0 372.421 3.958 20 5 FHBDRN Cc1cc(C(=O)COC(=O)c2cccc([N+](=O)[O-])c2C)c(C)n1C1CC1 ZINC000003444711 932763193 /nfs/dbraw/zinc/76/31/93/932763193.db2.gz SRVZYFPHECVQMP-UHFFFAOYSA-N 0 0 356.378 3.696 20 5 FHBDRN CN1C(=O)CN(C(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)c2ccccc21 ZINC000178190886 932796745 /nfs/dbraw/zinc/79/67/45/932796745.db2.gz VOSWLZSWCMOISG-UHFFFAOYSA-N 0 0 367.405 3.516 20 5 FHBDRN Cc1cncc(/C=C\C(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)c1 ZINC000255372129 932849662 /nfs/dbraw/zinc/84/96/62/932849662.db2.gz QUOVQAAJTGXKKU-DJWKRKHSSA-N 0 0 362.183 3.713 20 5 FHBDRN O=C(NCCCCOCc1ccccc1)c1cccc(Cl)c1[N+](=O)[O-] ZINC000175956627 932850826 /nfs/dbraw/zinc/85/08/26/932850826.db2.gz ZTHBDAUECDTMMU-UHFFFAOYSA-N 0 0 362.813 3.975 20 5 FHBDRN C[C@@H]1CCc2c(F)cccc2[C@H]1NC(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000430671095 932851817 /nfs/dbraw/zinc/85/18/17/932851817.db2.gz WAZDWNGKPRRZMN-XCLFUZPHSA-N 0 0 372.396 3.943 20 5 FHBDRN COc1ccc(C(=O)N[C@H]2c3cccc(F)c3CC[C@@H]2C)cc1[N+](=O)[O-] ZINC000430672112 932853352 /nfs/dbraw/zinc/85/33/52/932853352.db2.gz YMRMQSSLTUIMQU-BBATYDOGSA-N 0 0 358.369 3.796 20 5 FHBDRN Cc1cc(OCC(=O)N2C[C@H](c3ccccc3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000430673967 932856241 /nfs/dbraw/zinc/85/62/41/932856241.db2.gz AOPWJPAEJJDSIL-NVXWUHKLSA-N 0 0 354.406 3.687 20 5 FHBDRN COC(=O)c1cc(NC(=O)CSc2ccc([N+](=O)[O-])cc2)cc(C)c1C ZINC000109987093 932860743 /nfs/dbraw/zinc/86/07/43/932860743.db2.gz YZGSNCICZJXCTD-UHFFFAOYSA-N 0 0 374.418 3.729 20 5 FHBDRN C[C@H](NCC(=O)Nc1ccccc1[N+](=O)[O-])c1ccc(F)cc1Cl ZINC000178206055 932884633 /nfs/dbraw/zinc/88/46/33/932884633.db2.gz XBBZAHUQZHIEBA-JTQLQIEISA-N 0 0 351.765 3.677 20 5 FHBDRN Cc1ccc(S(=O)(=O)N[C@@H](c2ccco2)c2ccccc2)c([N+](=O)[O-])c1 ZINC000101569547 932906531 /nfs/dbraw/zinc/90/65/31/932906531.db2.gz FRMYDMNJNVSSBF-GOSISDBHSA-N 0 0 372.402 3.564 20 5 FHBDRN COCCOc1ccc(C(=O)Nc2ccc([N+](=O)[O-])cc2F)c(Cl)c1 ZINC000471787665 932911993 /nfs/dbraw/zinc/91/19/93/932911993.db2.gz NKBDDISFJUSJNL-UHFFFAOYSA-N 0 0 368.748 3.665 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)NCCc1cn(C)c2cc(F)ccc12 ZINC000187482103 932915733 /nfs/dbraw/zinc/91/57/33/932915733.db2.gz TZHBNHKILXBLHT-UHFFFAOYSA-N 0 0 355.369 3.507 20 5 FHBDRN Cc1cc(OCC(=O)Nc2ccc(F)cc2OC(F)F)ccc1[N+](=O)[O-] ZINC000430687088 932934886 /nfs/dbraw/zinc/93/48/86/932934886.db2.gz OWAZELLSSLLCKA-UHFFFAOYSA-N 0 0 370.283 3.661 20 5 FHBDRN O=c1c2cc3ccccc3cc2ncn1C[C@@H](O)c1cc(F)ccc1F ZINC000051288511 932969171 /nfs/dbraw/zinc/96/91/71/932969171.db2.gz HGEPKAJXNUFZQG-LJQANCHMSA-N 0 0 352.340 3.562 20 5 FHBDRN Cc1cc(OCC(=O)Nc2ccc(OCC(F)F)cc2)ccc1[N+](=O)[O-] ZINC000430690506 932984715 /nfs/dbraw/zinc/98/47/15/932984715.db2.gz HDZUBUXYIGBLTH-UHFFFAOYSA-N 0 0 366.320 3.565 20 5 FHBDRN COCC(C)(C)N(Cc1ccccc1)C(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000187531064 932985621 /nfs/dbraw/zinc/98/56/21/932985621.db2.gz JTJXFZIEWJSHAA-UHFFFAOYSA-N 0 0 356.422 3.591 20 5 FHBDRN COCC(C)(C)N(Cc1ccccc1)C(=O)Cc1ccccc1[N+](=O)[O-] ZINC000187536849 932998019 /nfs/dbraw/zinc/99/80/19/932998019.db2.gz XDWMRRCLBMDLSD-UHFFFAOYSA-N 0 0 356.422 3.591 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)N2C[C@@H]3CCCC[C@H]3C2)cc1SC ZINC000178276069 933020731 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20 5 FHBDRN CC(=Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(-c2n[nH]c(C)n2)c1 ZINC000588438036 933056997 /nfs/dbraw/zinc/05/69/97/933056997.db2.gz JKLWAOYLEGKULR-BENRWUELSA-N 0 0 363.377 3.730 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N1C[C@H](C)C(=O)Nc2ccccc21 ZINC000588439715 933063652 /nfs/dbraw/zinc/06/36/52/933063652.db2.gz WDCZRRAJOALBTP-FZDNWWAKSA-N 0 0 365.389 3.620 20 5 FHBDRN Cc1c(CN2CCC[C@@H]2c2nc3c(n2C)CCCC3)cccc1[N+](=O)[O-] ZINC000548349966 933066537 /nfs/dbraw/zinc/06/65/37/933066537.db2.gz FVXUOVDEUPHLNO-LJQANCHMSA-N 0 0 354.454 3.853 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N1CCO[C@H](c2ccccc2)C1 ZINC000588443868 933086420 /nfs/dbraw/zinc/08/64/20/933086420.db2.gz OKINDVHYVUBEIG-ZDRDQBANSA-N 0 0 352.390 3.598 20 5 FHBDRN COc1ccccc1N(C)C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000610570740 933127035 /nfs/dbraw/zinc/12/70/35/933127035.db2.gz FGEBUFPJSZWHTR-UHFFFAOYSA-N 0 0 365.183 3.643 20 5 FHBDRN Cc1c([N+](=O)[O-])cc(C(=O)Nc2ccc3c(c2)C(=O)CCC3)cc1[N+](=O)[O-] 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FHBDRN CN(C[C@@H]1CCCO[C@@H]1c1ccccc1)C(=O)c1ccc(F)cc1[N+](=O)[O-] ZINC000610712015 933893311 /nfs/dbraw/zinc/89/33/11/933893311.db2.gz KXKLDDCUQDNYLX-HNAYVOBHSA-N 0 0 372.396 3.974 20 5 FHBDRN CC(C)Cn1cc(NC(=O)c2ccc(F)cc2[N+](=O)[O-])c(C(F)F)n1 ZINC000535663516 933902057 /nfs/dbraw/zinc/90/20/57/933902057.db2.gz DXLUVIKFIFOSKC-UHFFFAOYSA-N 0 0 356.304 3.776 20 5 FHBDRN CCOC(=O)c1ccccc1N(C)C(=O)c1ccc(CC)c([N+](=O)[O-])c1 ZINC000471934575 933929290 /nfs/dbraw/zinc/92/92/90/933929290.db2.gz XPQZYOZUDRZGIY-UHFFFAOYSA-N 0 0 356.378 3.611 20 5 FHBDRN Cc1cc(NC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)n(-c2ccccn2)n1 ZINC000187655626 933965429 /nfs/dbraw/zinc/96/54/29/933965429.db2.gz MMCLWKREBKGPNC-UHFFFAOYSA-N 0 0 365.393 3.860 20 5 FHBDRN COc1cccc([C@@H](C)NC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000510892605 933968339 /nfs/dbraw/zinc/96/83/39/933968339.db2.gz JKQRXKSRNOHSDC-CQSZACIVSA-N 0 0 357.410 3.549 20 5 FHBDRN Cc1nn(C)cc1[C@H]1CCCN1c1ccc(Br)cc1[N+](=O)[O-] ZINC000610726393 933992547 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O=C(NCc1ccccc1[N+](=O)[O-])c1cc(Cl)ccc1OC(F)F ZINC000176094771 934079731 /nfs/dbraw/zinc/07/97/31/934079731.db2.gz STTSVZWQJQNIBK-UHFFFAOYSA-N 0 0 356.712 3.780 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(OCC(=O)Nc2ccccc2C(C)(C)C)n1 ZINC000548476651 934081243 /nfs/dbraw/zinc/08/12/43/934081243.db2.gz IXBWQMZCHCLKMA-UHFFFAOYSA-N 0 0 357.410 3.922 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)NCc1sccc1Br ZINC000176106670 934114919 /nfs/dbraw/zinc/11/49/19/934114919.db2.gz XHBOEKIXYOFAQN-UHFFFAOYSA-N 0 0 369.240 3.668 20 5 FHBDRN COC(=O)c1cc(NCC(C)(C)[C@@H]2CCCCO2)cc(C)c1[N+](=O)[O-] ZINC000610770324 934135513 /nfs/dbraw/zinc/13/55/13/934135513.db2.gz XCQBPCUZOONEAI-HNNXBMFYSA-N 0 0 350.415 3.697 20 5 FHBDRN COc1cc(N2CCC[C@@]3(C2)OCc2ccccc23)c([N+](=O)[O-])cc1F ZINC000548485079 934136825 /nfs/dbraw/zinc/13/68/25/934136825.db2.gz UZXJTEOWYWWYRP-IBGZPJMESA-N 0 0 358.369 3.768 20 5 FHBDRN COC(=O)c1cc(N[C@H]2CCOc3cc(OC)ccc32)cc(C)c1[N+](=O)[O-] ZINC000610770063 934144354 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Cc1cncc(C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2C)c1 ZINC000431236800 934241384 /nfs/dbraw/zinc/24/13/84/934241384.db2.gz JRLDQQOAEALORV-UHFFFAOYSA-N 0 0 350.172 3.621 20 5 FHBDRN CCc1ncsc1C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000431248316 934247684 /nfs/dbraw/zinc/24/76/84/934247684.db2.gz HZUZWCFUFSYXEI-UHFFFAOYSA-N 0 0 370.228 3.937 20 5 FHBDRN Cc1c(NC(=O)[C@H](C)C(F)(F)F)cc(Br)cc1[N+](=O)[O-] ZINC000431247816 934248669 /nfs/dbraw/zinc/24/86/69/934248669.db2.gz PCIDBKSXHYORPQ-LURJTMIESA-N 0 0 355.110 3.803 20 5 FHBDRN COc1ccc(C[C@@H](C)CNC(=O)c2cc(C)cc([N+](=O)[O-])c2)cc1OC ZINC000535682259 934274331 /nfs/dbraw/zinc/27/43/31/934274331.db2.gz ZHPYNWTXUZUILB-CQSZACIVSA-N 0 0 372.421 3.529 20 5 FHBDRN O=C(c1c[nH]c2cccc([N+](=O)[O-])c12)N1CCc2c(F)ccc(F)c2C1 ZINC000535694708 934288226 /nfs/dbraw/zinc/28/82/26/934288226.db2.gz GDJTUQNDKXTOAO-UHFFFAOYSA-N 0 0 357.316 3.553 20 5 FHBDRN CCCOCc1ccccc1CNC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000535696509 934289409 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O=[N+]([O-])c1ccccc1N1CCN(Cc2cccc(OC(F)F)c2)CC1 ZINC000065234197 934751243 /nfs/dbraw/zinc/75/12/43/934751243.db2.gz LBSNMKPQNULPMS-UHFFFAOYSA-N 0 0 363.364 3.518 20 5 FHBDRN CCOc1ccc(CNC(=O)c2cccc(Cl)c2[N+](=O)[O-])cc1F ZINC000176284951 934754922 /nfs/dbraw/zinc/75/49/22/934754922.db2.gz CXJCQESZJLIIFZ-UHFFFAOYSA-N 0 0 352.749 3.716 20 5 FHBDRN O=C(c1csc([N+](=O)[O-])c1)N(Cc1ccc(F)cc1)C1CCOCC1 ZINC000277192292 934789682 /nfs/dbraw/zinc/78/96/82/934789682.db2.gz TVZJWHHCKOGWAP-UHFFFAOYSA-N 0 0 364.398 3.617 20 5 FHBDRN O=[N+]([O-])c1cc(NCc2cc(Br)no2)cc(C(F)(F)F)c1 ZINC001167498613 934803611 /nfs/dbraw/zinc/80/36/11/934803611.db2.gz FEBZBFUCCDVWHW-UHFFFAOYSA-N 0 0 366.093 3.976 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(C1)CC(F)(F)C2 ZINC000611559061 934820198 /nfs/dbraw/zinc/82/01/98/934820198.db2.gz BJDVZSZYBOANRA-UHFFFAOYSA-N 0 0 356.394 3.968 20 5 FHBDRN COc1ccc(C)cc1CN[C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000611560375 934822445 /nfs/dbraw/zinc/82/24/45/934822445.db2.gz HYECFIYDXZNBJD-IBGZPJMESA-N 0 0 366.421 3.525 20 5 FHBDRN COc1cccc2c1CC[C@H]2NC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000119466496 934826284 /nfs/dbraw/zinc/82/62/84/934826284.db2.gz NMWJMSHZVQLULA-YVEFUNNKSA-N 0 0 355.394 3.651 20 5 FHBDRN O=C(NCCc1ccccc1OC(F)F)Nc1ccc([N+](=O)[O-])cc1F ZINC000472011699 934826610 /nfs/dbraw/zinc/82/66/10/934826610.db2.gz VHUPAZMZLCOMGI-UHFFFAOYSA-N 0 0 369.299 3.700 20 5 FHBDRN CO[C@H](c1ccccc1F)[C@@H](C)NC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000538334814 934830040 /nfs/dbraw/zinc/83/00/40/934830040.db2.gz XJSHOYAMCZDZQO-HWPZZCPQSA-N 0 0 366.776 3.893 20 5 FHBDRN COc1cc(C(=O)N2CC=C(c3c(F)cccc3F)CC2)ccc1[N+](=O)[O-] ZINC000472017973 934835123 /nfs/dbraw/zinc/83/51/23/934835123.db2.gz LSRJTZWXVHFAJZ-UHFFFAOYSA-N 0 0 374.343 3.811 20 5 FHBDRN Cc1cc(N(C)C)cc(C)c1NC(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000156661451 934839532 /nfs/dbraw/zinc/83/95/32/934839532.db2.gz UAKDMLOAQBLEQR-UHFFFAOYSA-N 0 0 356.426 3.642 20 5 FHBDRN O=[N+]([O-])c1ccc(CN2CCOCC2)cc1NCc1cccc(Cl)c1 ZINC000472023478 934847701 /nfs/dbraw/zinc/84/77/01/934847701.db2.gz XPFXPZFRENHPEL-UHFFFAOYSA-N 0 0 361.829 3.693 20 5 FHBDRN Cc1cc(NCc2cccc(-n3cncn3)c2)c2cccc([N+](=O)[O-])c2n1 ZINC000538447371 934850578 /nfs/dbraw/zinc/85/05/78/934850578.db2.gz QIQNOBPWNDXXNZ-UHFFFAOYSA-N 0 0 360.377 3.644 20 5 FHBDRN CCCCn1ncc(NCc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)c1C ZINC000538444845 934852354 /nfs/dbraw/zinc/85/23/54/934852354.db2.gz SEVQVHKEDSIURK-UHFFFAOYSA-N 0 0 368.441 3.912 20 5 FHBDRN Cc1c(C(=O)NC[C@@H](c2ccccc2)C(F)(F)F)cccc1[N+](=O)[O-] ZINC000187710514 934856711 /nfs/dbraw/zinc/85/67/11/934856711.db2.gz JPLFPAUBQPVCAY-AWEZNQCLSA-N 0 0 352.312 3.979 20 5 FHBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)OCc1csc(-c2ccccn2)n1 ZINC000255439924 934859992 /nfs/dbraw/zinc/85/99/92/934859992.db2.gz DPJHXWBEDUPOFQ-TWGQIWQCSA-N 0 0 367.386 3.870 20 5 FHBDRN CCN(CCc1nccs1)C(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000119528892 934864959 /nfs/dbraw/zinc/86/49/59/934864959.db2.gz KVHTXBYYFUGTQM-CYBMUJFWSA-N 0 0 362.455 3.695 20 5 FHBDRN CC(C)(Oc1ccc(Cl)cc1)C(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000071818337 934886519 /nfs/dbraw/zinc/88/65/19/934886519.db2.gz XCPBQHLJVXTSAV-UHFFFAOYSA-N 0 0 360.797 3.995 20 5 FHBDRN COc1ccc(CNC(=O)N[C@H](c2ccccc2)C2CCC2)cc1[N+](=O)[O-] ZINC000511014337 934889478 /nfs/dbraw/zinc/88/94/78/934889478.db2.gz MMFFILIUKQUXEK-LJQANCHMSA-N 0 0 369.421 3.944 20 5 FHBDRN COC(=O)c1cc([N+](=O)[O-])cn(Cc2c(C)cc(C(C)(C)C)cc2C)c1=O ZINC000071844740 934893758 /nfs/dbraw/zinc/89/37/58/934893758.db2.gz ZFRRILWVAJCMOY-UHFFFAOYSA-N 0 0 372.421 3.506 20 5 FHBDRN Cc1cc(C(=O)N2CCc3[nH]c4ccc(F)cc4c3C2)cc([N+](=O)[O-])c1 ZINC000150182416 934894150 /nfs/dbraw/zinc/89/41/50/934894150.db2.gz SFWZFNLGUOYYQN-UHFFFAOYSA-N 0 0 353.353 3.722 20 5 FHBDRN COc1cc(C(=O)N[C@H](C)c2cccc(C)c2C)c([N+](=O)[O-])cc1OC ZINC000115287287 934926402 /nfs/dbraw/zinc/92/64/02/934926402.db2.gz ZVOYATYEJAIARU-CYBMUJFWSA-N 0 0 358.394 3.720 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@@H]1[C@H]1CCCOC1 ZINC000563187402 934955266 /nfs/dbraw/zinc/95/52/66/934955266.db2.gz WHPILAFGBHKUIL-ZIFCJYIRSA-N 0 0 360.454 3.581 20 5 FHBDRN C[C@H](c1cccnc1)N(C)C(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000178508163 934972559 /nfs/dbraw/zinc/97/25/59/934972559.db2.gz FOKXRDIAFIJNGT-SNVBAGLBSA-N 0 0 353.300 3.842 20 5 FHBDRN C[C@@H](NC(=O)c1ccc(N2C[C@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1)c1ccon1 ZINC000539031174 934991294 /nfs/dbraw/zinc/99/12/94/934991294.db2.gz GYBVDODMTSHUMT-HZSPNIEDSA-N 0 0 372.425 3.556 20 5 FHBDRN COCCOCc1ccc(CNc2nccc3c2cccc3[N+](=O)[O-])cc1 ZINC000450542623 934993075 /nfs/dbraw/zinc/99/30/75/934993075.db2.gz WBPUZMGZQGUVDH-UHFFFAOYSA-N 0 0 367.405 3.918 20 5 FHBDRN O=C(N[C@H]1CCCc2cn(C3CCCC3)nc21)c1ccc([N+](=O)[O-])s1 ZINC000611567153 934997190 /nfs/dbraw/zinc/99/71/90/934997190.db2.gz PEFWJIRKGUETCI-ZDUSSCGKSA-N 0 0 360.439 3.775 20 5 FHBDRN CCn1c(SCc2cnc(C)s2)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000157033490 935005930 /nfs/dbraw/zinc/00/59/30/935005930.db2.gz IXNBNAQNNVSRMA-UHFFFAOYSA-N 0 0 361.452 3.930 20 5 FHBDRN COc1ccc([C@@H]2CCCN2C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)nc1 ZINC000892111099 935016933 /nfs/dbraw/zinc/01/69/33/935016933.db2.gz IYBNJTRMSWIARM-UGSOOPFHSA-N 0 0 370.409 3.606 20 5 FHBDRN CC1CCN(c2ccc(CNC(=O)Nc3cccc([N+](=O)[O-])c3)cn2)CC1 ZINC000071927820 935017949 /nfs/dbraw/zinc/01/79/49/935017949.db2.gz LQCSPDSMDLEYBY-UHFFFAOYSA-N 0 0 369.425 3.548 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H](CC)c1nccs1 ZINC000439908052 945070912 /nfs/dbraw/zinc/07/09/12/945070912.db2.gz CIONVMAKTVQWNV-LLVKDONJSA-N 0 0 350.400 3.723 20 5 FHBDRN CC1(C)OCC[C@H]1CNC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC001167518005 935111555 /nfs/dbraw/zinc/11/15/55/935111555.db2.gz NIYONVXECHIHMB-HNNXBMFYSA-N 0 0 369.421 3.883 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)NCc1ccc2ncccc2c1 ZINC000439896195 945078004 /nfs/dbraw/zinc/07/80/04/945078004.db2.gz GMNNMYXLXBNQNC-UHFFFAOYSA-N 0 0 366.377 3.863 20 5 FHBDRN CC(C)Oc1ccc(CC[C@@H](C)Nc2ccc(C(N)=O)cc2[N+](=O)[O-])cc1 ZINC000071968755 935129981 /nfs/dbraw/zinc/12/99/81/935129981.db2.gz ZMBQXFGGTNDNIT-CQSZACIVSA-N 0 0 371.437 3.914 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])c2cccnc12)N1CCS[C@@H]2CCCC[C@@H]21 ZINC000157674890 935135769 /nfs/dbraw/zinc/13/57/69/935135769.db2.gz MVDLGJOFLRJKQP-JKSUJKDBSA-N 0 0 357.435 3.643 20 5 FHBDRN C[C@@H](C(=O)NCCc1csc(C(C)(C)C)n1)c1cccc([N+](=O)[O-])c1 ZINC000582037299 935156975 /nfs/dbraw/zinc/15/69/75/935156975.db2.gz TWKSKESSRQOEGO-GFCCVEGCSA-N 0 0 361.467 3.811 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N(C)[C@@H](C)c2cccs2)c1C ZINC000119733384 935163749 /nfs/dbraw/zinc/16/37/49/935163749.db2.gz ZWPNZQSFCIJGGP-LBPRGKRZSA-N 0 0 354.453 3.655 20 5 FHBDRN C[C@H]1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[S@]1=O ZINC000277439384 935175414 /nfs/dbraw/zinc/17/54/14/935175414.db2.gz JEJLOLYFMRRDDY-RKNYENMMSA-N 0 0 364.492 3.666 20 5 FHBDRN CCC[C@@H](C)c1cc(=NC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)[nH][nH]1 ZINC000439898725 945081773 /nfs/dbraw/zinc/08/17/73/945081773.db2.gz GJVWRFVJSVOQJV-NEPJUHHUSA-N 0 0 362.455 3.763 20 5 FHBDRN Cc1ccccc1CN(Cc1cccnc1)C(=O)c1ccc([N+](=O)[O-])o1 ZINC000072012325 935199105 /nfs/dbraw/zinc/19/91/05/935199105.db2.gz LSGDNCPSGHKEQI-UHFFFAOYSA-N 0 0 351.362 3.734 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H]1CCC[C@@H]1SCC ZINC000439927682 945083530 /nfs/dbraw/zinc/08/35/30/945083530.db2.gz IXPATTSJHXXOQP-DOMZBBRYSA-N 0 0 353.444 3.789 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H]1CCC[C@H]1SCC ZINC000439927684 945083729 /nfs/dbraw/zinc/08/37/29/945083729.db2.gz IXPATTSJHXXOQP-SWLSCSKDSA-N 0 0 353.444 3.789 20 5 FHBDRN Cc1cccc(OC(F)F)c1NC(=O)COc1cccc([N+](=O)[O-])c1 ZINC000119776642 935214115 /nfs/dbraw/zinc/21/41/15/935214115.db2.gz AJPWYMSLTWHAIJ-UHFFFAOYSA-N 0 0 352.293 3.522 20 5 FHBDRN O=C(NC[C@H]1CSCCS1)c1cc2ccccc2c2cccnc12 ZINC000176648058 935215434 /nfs/dbraw/zinc/21/54/34/935215434.db2.gz ZDDQILPMRYMOJH-AWEZNQCLSA-N 0 0 354.500 3.966 20 5 FHBDRN CC(C)(C)c1cccc(OC(=O)CCNC(=O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000892172089 935218329 /nfs/dbraw/zinc/21/83/29/935218329.db2.gz FALMREPQKKGAOV-UHFFFAOYSA-N 0 0 370.405 3.618 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2CCCc3cc(F)ccc32)c1 ZINC000539503453 935220751 /nfs/dbraw/zinc/22/07/51/935220751.db2.gz ANVFGONWRDFWII-UHFFFAOYSA-N 0 0 358.369 3.791 20 5 FHBDRN CCc1ccc(C(=O)NCCc2c[nH]c3ccc(F)cc23)cc1[N+](=O)[O-] ZINC000472155994 935228118 /nfs/dbraw/zinc/22/81/18/935228118.db2.gz KGYGWNGDEOYSBN-UHFFFAOYSA-N 0 0 355.369 3.750 20 5 FHBDRN Cc1ccsc1[C@@H]1C[C@@H]1C(=O)NCCCNc1ccc(C)cc1[N+](=O)[O-] ZINC000438829057 945085453 /nfs/dbraw/zinc/08/54/53/945085453.db2.gz OSUCKRAAXSVUMY-CABCVRRESA-N 0 0 373.478 3.995 20 5 FHBDRN C[C@@H](c1nc(Cc2ccccc2)no1)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000511071763 935234561 /nfs/dbraw/zinc/23/45/61/935234561.db2.gz HJHSESBCLZGXHL-HNNXBMFYSA-N 0 0 366.421 3.804 20 5 FHBDRN CCc1nc(C)c([C@@H](C)N(C)C(=O)c2ccc(OC)c([N+](=O)[O-])c2)s1 ZINC000119798313 935235901 /nfs/dbraw/zinc/23/59/01/935235901.db2.gz BLENDSLNHGSUAX-LLVKDONJSA-N 0 0 363.439 3.764 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N(C)Cc1ccccc1N(C)C ZINC000582086049 935237696 /nfs/dbraw/zinc/23/76/96/935237696.db2.gz GWGCHWVFBDRCJI-UHFFFAOYSA-N 0 0 356.426 3.942 20 5 FHBDRN CNC(=O)c1ccc(N[C@H](C[C@H]2CCOC2)c2ccccc2)c([N+](=O)[O-])c1 ZINC000157958136 935244275 /nfs/dbraw/zinc/24/42/75/935244275.db2.gz NBDIKXAZNVSINH-RDTXWAMCSA-N 0 0 369.421 3.534 20 5 FHBDRN COCc1cccc(OCC2(COc3cc([N+](=O)[O-])ccc3OC)CC2)c1 ZINC000478039811 935245532 /nfs/dbraw/zinc/24/55/32/935245532.db2.gz IDKBVSBXUUSAMA-UHFFFAOYSA-N 0 0 373.405 3.988 20 5 FHBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N(C)[C@@H]1CC[C@H](C)C1 ZINC000551309803 935245954 /nfs/dbraw/zinc/24/59/54/935245954.db2.gz ZUKHMXCYXWVOQO-GXSJLCMTSA-N 0 0 355.232 3.926 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1ncc(Cc2ccccc2)s1 ZINC000427104800 945088255 /nfs/dbraw/zinc/08/82/55/945088255.db2.gz RENAEFAMYKOLFY-UHFFFAOYSA-N 0 0 369.402 3.903 20 5 FHBDRN CC(C)(C(=O)N1CCC(F)(c2cccnc2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000551346063 935261416 /nfs/dbraw/zinc/26/14/16/935261416.db2.gz QHDQXPDVKFUGSQ-UHFFFAOYSA-N 0 0 371.412 3.755 20 5 FHBDRN O=C(N[C@@H]1C[C@H]1c1ccccc1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000431356766 935264299 /nfs/dbraw/zinc/26/42/99/935264299.db2.gz CZMBCDKHBPSQPD-LSDHHAIUSA-N 0 0 361.195 3.643 20 5 FHBDRN O=[N+]([O-])c1cc(I)ccc1OCCCCCF ZINC000551365396 935267265 /nfs/dbraw/zinc/26/72/65/935267265.db2.gz LUEIJRDRERBEIJ-UHFFFAOYSA-N 0 0 353.131 3.718 20 5 FHBDRN C[C@H](SCc1ccc(S(C)(=O)=O)cc1)c1cccc([N+](=O)[O-])c1 ZINC000551373695 935271800 /nfs/dbraw/zinc/27/18/00/935271800.db2.gz VMHWDXYBLRJDGR-LBPRGKRZSA-N 0 0 351.449 3.993 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)NCc2ccccc2OCCC(C)C)c1 ZINC000072069834 935279699 /nfs/dbraw/zinc/27/96/99/935279699.db2.gz RHZYEGATOQSOMR-UHFFFAOYSA-N 0 0 372.421 3.958 20 5 FHBDRN O=[N+]([O-])c1ccc(CN(Cc2ccccc2)C[C@@H](O)C(F)(F)F)c(F)c1 ZINC000611576695 935282788 /nfs/dbraw/zinc/28/27/88/935282788.db2.gz QJDMVJJNBNRNCM-MRXNPFEDSA-N 0 0 372.318 3.659 20 5 FHBDRN Cc1nc2ccc(S(=O)(=O)Nc3cccc([N+](=O)[O-])c3C)cc2s1 ZINC000427106269 945090137 /nfs/dbraw/zinc/09/01/37/945090137.db2.gz DICHCYBSILKMKX-UHFFFAOYSA-N 0 0 363.420 3.622 20 5 FHBDRN Cc1cc(C(=O)Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)c(C)c(C)c1C ZINC000072086022 935290364 /nfs/dbraw/zinc/29/03/64/935290364.db2.gz ZFARZVFMZOXEEK-UHFFFAOYSA-N 0 0 364.405 3.970 20 5 FHBDRN COCC[C@@H]1CCCCN(C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000468213922 935301273 /nfs/dbraw/zinc/30/12/73/935301273.db2.gz CRMSAOTZSGLZGS-HOTGVXAUSA-N 0 0 363.458 3.812 20 5 FHBDRN Cc1cc(C(=O)Nc2nc(-c3ccc(C)c([N+](=O)[O-])c3)cs2)nc(C)n1 ZINC000563261714 935321092 /nfs/dbraw/zinc/32/10/92/935321092.db2.gz KDDJQGMGDNABDK-UHFFFAOYSA-N 0 0 369.406 3.686 20 5 FHBDRN COc1cccc2c1ncc(C)c2NC(=O)c1cccc(OC)c1[N+](=O)[O-] ZINC000551656504 935324859 /nfs/dbraw/zinc/32/48/59/935324859.db2.gz OKMTTYCFZLEPPE-UHFFFAOYSA-N 0 0 367.361 3.721 20 5 FHBDRN CCOc1ccc(CNC(=O)c2cc(OC)ccc2[N+](=O)[O-])cc1Cl ZINC000551673127 935327473 /nfs/dbraw/zinc/32/74/73/935327473.db2.gz KIWJESQGZPOLIP-UHFFFAOYSA-N 0 0 364.785 3.586 20 5 FHBDRN O=[N+]([O-])c1ccc([C@@H](NCc2cn3c(n2)CCCC3)C(F)(F)F)cc1 ZINC000563263674 935329100 /nfs/dbraw/zinc/32/91/00/935329100.db2.gz IUVNYFMCKYILBQ-OAHLLOKOSA-N 0 0 354.332 3.521 20 5 FHBDRN COc1ccccc1C[C@H](C)N(C)C(=O)Cc1cccc([N+](=O)[O-])c1C ZINC000438832524 945093003 /nfs/dbraw/zinc/09/30/03/945093003.db2.gz MQRNIYTUEITHHP-AWEZNQCLSA-N 0 0 356.422 3.544 20 5 FHBDRN Cc1cnc([C@@H](C)[S@@](=O)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)o1 ZINC000539978665 935333247 /nfs/dbraw/zinc/33/32/47/935333247.db2.gz SLFURZHBLQDIGX-NDHGSNPTSA-N 0 0 361.379 3.556 20 5 FHBDRN CC(C)(C)[C@H]1OCCC[C@H]1CNC(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000118266849 935334185 /nfs/dbraw/zinc/33/41/85/935334185.db2.gz STGSLLUYPJHFIG-GUYCJALGSA-N 0 0 368.861 3.748 20 5 FHBDRN Cc1cc(C(=O)OCc2c(Cl)nc3sccn32)ccc1[N+](=O)[O-] ZINC000018232511 945093911 /nfs/dbraw/zinc/09/39/11/945093911.db2.gz ZXNTVFFOLHXPCA-UHFFFAOYSA-N 0 0 351.771 3.623 20 5 FHBDRN CSc1cccc(NC(=O)[C@H](C)N(C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000511083385 935340964 /nfs/dbraw/zinc/34/09/64/935340964.db2.gz YUURSOGMJAOZLP-AWEZNQCLSA-N 0 0 373.478 3.818 20 5 FHBDRN COc1ccc(C)cc1[C@H](C)NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000124070786 945099146 /nfs/dbraw/zinc/09/91/46/945099146.db2.gz FFTHSISSNYTFCZ-ZDUSSCGKSA-N 0 0 367.405 3.813 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CCO[C@H](c2cccs2)C1 ZINC000119949389 935357956 /nfs/dbraw/zinc/35/79/56/935357956.db2.gz LSMBPNRTLXYWCW-HNNXBMFYSA-N 0 0 361.423 3.879 20 5 FHBDRN CCn1ncc(C(=O)Nc2cc([N+](=O)[O-])ccc2OC)c1-c1ccccc1 ZINC000427110370 945095905 /nfs/dbraw/zinc/09/59/05/945095905.db2.gz YUVPUUVGTYLBIZ-UHFFFAOYSA-N 0 0 366.377 3.739 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)Nc2cccc(N3CCCC3=O)c2)c1 ZINC000018232636 945095963 /nfs/dbraw/zinc/09/59/63/945095963.db2.gz NMJJFPXGFWKTJM-UHFFFAOYSA-N 0 0 371.418 3.696 20 5 FHBDRN COc1cccc([C@H](Nc2ccc([N+](=O)[O-])c(C)c2)c2nccn2C)c1 ZINC000051500563 935388453 /nfs/dbraw/zinc/38/84/53/935388453.db2.gz FSAXMDSGFDBLRP-SFHVURJKSA-N 0 0 352.394 3.847 20 5 FHBDRN CC(C)(C)[C@@H]1OCCC[C@H]1CNC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000118368952 935392179 /nfs/dbraw/zinc/39/21/79/935392179.db2.gz IRQMNMRJGXZVLR-XHDPSFHLSA-N 0 0 354.834 3.819 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H](c1nc2ccccc2[nH]1)C(C)C ZINC000427111799 945097616 /nfs/dbraw/zinc/09/76/16/945097616.db2.gz VWIJQQKSKCVBOP-KRWDZBQOSA-N 0 0 368.393 3.607 20 5 FHBDRN CCOc1cc(C(=O)N(C)C)ccc1NCc1cccc([N+](=O)[O-])c1C ZINC000178551349 935394747 /nfs/dbraw/zinc/39/47/47/935394747.db2.gz YGWVJPBCWHEQSL-UHFFFAOYSA-N 0 0 357.410 3.616 20 5 FHBDRN Cn1cc(NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])c(-c2ccccc2)n1 ZINC000091144438 935395219 /nfs/dbraw/zinc/39/52/19/935395219.db2.gz VNLAWADVFFAGAT-UHFFFAOYSA-N 0 0 356.769 3.901 20 5 FHBDRN CC(C)(C(=O)N1CCO[C@H](C2CCCCC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000543628370 945098584 /nfs/dbraw/zinc/09/85/84/945098584.db2.gz QLTBOOVIRALEQH-SFHVURJKSA-N 0 0 360.454 3.680 20 5 FHBDRN O=C(NCc1cccc([N+](=O)[O-])c1)N[C@@H](c1cc(F)ccc1F)C(F)F ZINC000582218867 935420665 /nfs/dbraw/zinc/42/06/65/935420665.db2.gz QORBLKVRQOHLIB-AWEZNQCLSA-N 0 0 371.290 3.679 20 5 FHBDRN CC(=O)N1C=Cc2ccccc2[C@H]1CC(=O)Oc1ccc(C)cc1[N+](=O)[O-] ZINC000051528448 935423443 /nfs/dbraw/zinc/42/34/43/935423443.db2.gz REOSYKKVEAZRTR-QGZVFWFLSA-N 0 0 366.373 3.773 20 5 FHBDRN CC1(C)C[C@H](CNC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)CCO1 ZINC000582225760 935424655 /nfs/dbraw/zinc/42/46/55/935424655.db2.gz ZGECMPQGLKOAME-CQSZACIVSA-N 0 0 364.445 3.616 20 5 FHBDRN CC[C@@H](NC(=O)c1cc(C(=O)OC)cc([N+](=O)[O-])c1)c1ccc(C)cc1 ZINC000014602614 935436653 /nfs/dbraw/zinc/43/66/53/935436653.db2.gz RYANBUIXLDVGML-QGZVFWFLSA-N 0 0 356.378 3.571 20 5 FHBDRN CC[C@H](NC(=O)c1cc(C(=O)OC)cc([N+](=O)[O-])c1)c1ccc(C)cc1 ZINC000014602615 935436862 /nfs/dbraw/zinc/43/68/62/935436862.db2.gz RYANBUIXLDVGML-KRWDZBQOSA-N 0 0 356.378 3.571 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CC[C@@H](CC(F)(F)F)C2)c(Br)c1 ZINC000277526335 935453643 /nfs/dbraw/zinc/45/36/43/935453643.db2.gz VNQOAQVJYLLCAF-ZETCQYMHSA-N 0 0 354.126 3.531 20 5 FHBDRN CCCC(=O)Nc1cccc(CNC(=O)c2cc([N+](=O)[O-])c(C)s2)c1 ZINC000044663098 945102236 /nfs/dbraw/zinc/10/22/36/945102236.db2.gz OCWSLXFHPBDKRW-UHFFFAOYSA-N 0 0 361.423 3.633 20 5 FHBDRN CC(C)[C@H](NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1)c1nc(C2CC2)no1 ZINC000120052817 935510503 /nfs/dbraw/zinc/51/05/03/935510503.db2.gz NOAMWRJYJYHDGV-ZDUSSCGKSA-N 0 0 364.789 3.636 20 5 FHBDRN COc1ccc(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)c(C)c1OC ZINC000582318556 935520701 /nfs/dbraw/zinc/52/07/01/935520701.db2.gz ZACYMWRVWRALLC-UHFFFAOYSA-N 0 0 364.785 3.504 20 5 FHBDRN O=C(NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)Nc1nc(C2CC2)cs1 ZINC000582323518 935523549 /nfs/dbraw/zinc/52/35/49/935523549.db2.gz DHUMXUNEJYIIPQ-UHFFFAOYSA-N 0 0 371.422 3.774 20 5 FHBDRN O=[N+]([O-])c1ccc(NC2CCN(CC(F)(F)F)CC2)c(OC(F)F)c1 ZINC000582325406 935524694 /nfs/dbraw/zinc/52/46/94/935524694.db2.gz IAIYAZNLYHRMBH-UHFFFAOYSA-N 0 0 369.290 3.635 20 5 FHBDRN CCCCc1nnc(NC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)s1 ZINC000023362738 935575591 /nfs/dbraw/zinc/57/55/91/935575591.db2.gz OAPLXMKUOBIQOQ-SNVBAGLBSA-N 0 0 366.468 3.908 20 5 FHBDRN Cn1nc([N+](=O)[O-])cc1C(=O)Nc1cccc(CSC2CCCC2)c1 ZINC000478148278 935579580 /nfs/dbraw/zinc/57/95/80/935579580.db2.gz YCWVXDJOLLNVHD-UHFFFAOYSA-N 0 0 360.439 3.756 20 5 FHBDRN O=C([C@@H]1CCOc2ccccc21)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000152416932 935586008 /nfs/dbraw/zinc/58/60/08/935586008.db2.gz USHYJHZAKUKQBR-QGZVFWFLSA-N 0 0 352.390 3.652 20 5 FHBDRN CN(C(=O)Cc1ccc([N+](=O)[O-])cc1Br)[C@H]1CCC(C)(C)C1 ZINC000478199321 935591121 /nfs/dbraw/zinc/59/11/21/935591121.db2.gz ZLNLCMCYOJEQTQ-ZDUSSCGKSA-N 0 0 369.259 3.937 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])[C@@H]1CCN(c2ccc(Cl)cc2)C1=O ZINC000511106212 935591321 /nfs/dbraw/zinc/59/13/21/935591321.db2.gz LPVHBYZQYBTDQS-GOSISDBHSA-N 0 0 373.840 3.528 20 5 FHBDRN CN(C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)[C@@H]1CCC(C)(C)C1 ZINC000478210619 935592279 /nfs/dbraw/zinc/59/22/79/935592279.db2.gz KJXHFIURZMYOAV-MRXNPFEDSA-N 0 0 359.470 3.848 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)N2CCC[C@@H]([C@@H]3CCOC3)C2)cc1[N+](=O)[O-] ZINC000439937803 945111205 /nfs/dbraw/zinc/11/12/05/945111205.db2.gz YTFQXNHLTNVXLC-HZPDHXFCSA-N 0 0 360.454 3.781 20 5 FHBDRN COc1cnccc1-c1noc(-c2ccc3[nH]c4ccccc4c(=O)c3c2)n1 ZINC000582386937 935605986 /nfs/dbraw/zinc/60/59/86/935605986.db2.gz ZVMNWEUTWUVKKR-UHFFFAOYSA-N 0 0 370.368 3.802 20 5 FHBDRN CC[C@@H](C)n1ncc(C(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)c1C ZINC000478326303 935611205 /nfs/dbraw/zinc/61/12/05/935611205.db2.gz AXSZKSNRZXHOAF-CYBMUJFWSA-N 0 0 356.426 3.876 20 5 FHBDRN CC[C@@H](c1ccccc1)N1CC(=O)N(CCc2cccc([N+](=O)[O-])c2)C1=O ZINC000431395138 935614619 /nfs/dbraw/zinc/61/46/19/935614619.db2.gz AAZUGQNDAGWYLG-SFHVURJKSA-N 0 0 367.405 3.553 20 5 FHBDRN Cc1c(C(=O)N(C)c2cccc([N+](=O)[O-])c2)cnn1-c1ccccc1C ZINC000158196455 935620261 /nfs/dbraw/zinc/62/02/61/935620261.db2.gz TXXUYKXNWTUIDF-UHFFFAOYSA-N 0 0 350.378 3.674 20 5 FHBDRN Cc1c(CNC(=O)N[C@H]2CCSc3ccccc32)cccc1[N+](=O)[O-] ZINC000478458908 935629776 /nfs/dbraw/zinc/62/97/76/935629776.db2.gz GHMPVHONGINIPE-HNNXBMFYSA-N 0 0 357.435 3.940 20 5 FHBDRN Cc1ccc([C@@H]2COCCN2C(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)o1 ZINC000187743609 935630352 /nfs/dbraw/zinc/63/03/52/935630352.db2.gz GIOXBEVXQOTVJO-KRWDZBQOSA-N 0 0 358.394 3.833 20 5 FHBDRN Cc1cc(F)cc2c1CN(C(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1)CC2 ZINC000507296985 945113987 /nfs/dbraw/zinc/11/39/87/945113987.db2.gz OBQDMCPMQFHKOS-ZDUSSCGKSA-N 0 0 357.385 3.871 20 5 FHBDRN Cc1cc(NC(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])sn1 ZINC000478559217 935646952 /nfs/dbraw/zinc/64/69/52/935646952.db2.gz MFLRKXSUEXLYOM-UHFFFAOYSA-N 0 0 374.344 3.819 20 5 FHBDRN CCOc1cc(C(=O)Nc2cc(OC)c(C)cc2C)c([N+](=O)[O-])cc1OC ZINC000478542213 935648971 /nfs/dbraw/zinc/64/89/71/935648971.db2.gz YGQRTZZWMSLUBA-UHFFFAOYSA-N 0 0 374.393 3.880 20 5 FHBDRN C[C@H](c1nc2ccccc2s1)N(C)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000178569798 935651163 /nfs/dbraw/zinc/65/11/63/935651163.db2.gz XVDVHVIUGSSYLH-WBMJQRKESA-N 0 0 357.435 3.931 20 5 FHBDRN COc1ccc(CNC(=O)c2ccc(Cl)c3ncccc23)cc1[N+](=O)[O-] ZINC000509564320 945116513 /nfs/dbraw/zinc/11/65/13/945116513.db2.gz QORBQNRJNXZYPF-UHFFFAOYSA-N 0 0 371.780 3.735 20 5 FHBDRN COC(=O)[C@H](c1ccccc1Cl)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000511120259 935679781 /nfs/dbraw/zinc/67/97/81/935679781.db2.gz CPVZAYIJIMZZQH-KRWDZBQOSA-N 0 0 362.813 3.637 20 5 FHBDRN O=[N+]([O-])c1cccc(CN2CCO[C@H](c3cccc(OC(F)F)c3)C2)c1 ZINC000127651751 935682125 /nfs/dbraw/zinc/68/21/25/935682125.db2.gz UXNDXHWTPFTQBQ-KRWDZBQOSA-N 0 0 364.348 3.770 20 5 FHBDRN Cc1c(CC(=O)NCc2ccc(Br)s2)cccc1[N+](=O)[O-] ZINC000178580216 935689894 /nfs/dbraw/zinc/68/98/94/935689894.db2.gz OJPJACQPNOCGOT-UHFFFAOYSA-N 0 0 369.240 3.586 20 5 FHBDRN CCc1c(C(=O)NCCNc2ccc([N+](=O)[O-])cc2)cnn1C(CC)CC ZINC000478739214 935690393 /nfs/dbraw/zinc/69/03/93/935690393.db2.gz KUNXMRHRFSCTPH-UHFFFAOYSA-N 0 0 373.457 3.557 20 5 FHBDRN CCCc1[nH]nc(C(=O)Nc2ccc3c(ccn3CCC)c2)c1[N+](=O)[O-] ZINC000110065297 935719191 /nfs/dbraw/zinc/71/91/91/935719191.db2.gz IJRRCMSSCRIWIN-UHFFFAOYSA-N 0 0 355.398 3.887 20 5 FHBDRN Cc1cc2cc[nH]c2cc1NC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000548737229 935722147 /nfs/dbraw/zinc/72/21/47/935722147.db2.gz OFWAFFXLIGJVFQ-UHFFFAOYSA-N 0 0 350.378 3.975 20 5 FHBDRN COc1ccc(Cl)cc1CNC(=O)NCc1cccc([N+](=O)[O-])c1C ZINC000478801056 935725311 /nfs/dbraw/zinc/72/53/11/935725311.db2.gz WTWQNRRHFJUPKS-UHFFFAOYSA-N 0 0 363.801 3.565 20 5 FHBDRN CC1(C)C[C@@H](Nc2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)C(C)(C)O1 ZINC000302061492 935735141 /nfs/dbraw/zinc/73/51/41/935735141.db2.gz RGKQEUBUZLDSTD-MRXNPFEDSA-N 0 0 361.442 3.589 20 5 FHBDRN O=C(N[C@@H](c1ccccc1)c1cccnc1)c1cc([N+](=O)[O-])ccc1F ZINC000728491560 935741227 /nfs/dbraw/zinc/74/12/27/935741227.db2.gz MRGDOJRINHUSCI-SFHVURJKSA-N 0 0 351.337 3.648 20 5 FHBDRN CN(C(=O)Cc1csc(Cc2ccccc2)n1)c1cccc([N+](=O)[O-])c1 ZINC000158344355 935745214 /nfs/dbraw/zinc/74/52/14/935745214.db2.gz DDIFOEHVRKSSBB-UHFFFAOYSA-N 0 0 367.430 3.848 20 5 FHBDRN CC(C)(C(=O)NCc1csc(-c2ccco2)n1)c1ccc([N+](=O)[O-])cc1 ZINC000478862265 935745558 /nfs/dbraw/zinc/74/55/58/935745558.db2.gz ZUQPNRBPAOSNTF-UHFFFAOYSA-N 0 0 371.418 3.905 20 5 FHBDRN COCCN(C)c1ccc(/C=C\c2ccc3cc([N+](=O)[O-])ccc3n2)cn1 ZINC000478921789 935750858 /nfs/dbraw/zinc/75/08/58/935750858.db2.gz KKKYRMZVXBSLEX-UTCJRWHESA-N 0 0 364.405 3.791 20 5 FHBDRN CCO[C@H]1C[C@@H](N(C)C(=O)c2ccc([N+](=O)[O-])c3cccnc23)C12CCC2 ZINC000158377904 935759675 /nfs/dbraw/zinc/75/96/75/935759675.db2.gz MPAWDUFUURHLSA-SJORKVTESA-N 0 0 369.421 3.563 20 5 FHBDRN COc1cc(C)c([C@@H](C)NC(=O)Cc2cccc([N+](=O)[O-])c2C)cc1OC ZINC000178589765 935773739 /nfs/dbraw/zinc/77/37/39/935773739.db2.gz WMARXDUIJGYHAR-CQSZACIVSA-N 0 0 372.421 3.649 20 5 FHBDRN CCOc1ccc(CN(C)C(=O)CSc2ccc([N+](=O)[O-])cc2)cc1 ZINC000015380038 945122619 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CC[C@@H](c1cccc(OC)c1)N(C)C(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000582930159 936301889 /nfs/dbraw/zinc/30/18/89/936301889.db2.gz VNFKZCNICKHVBW-KRWDZBQOSA-N 0 0 372.421 3.982 20 5 FHBDRN CCOc1cccc([C@@H]2C[C@H]2NC(=O)c2c(Cl)cccc2[N+](=O)[O-])c1 ZINC000437233925 945158377 /nfs/dbraw/zinc/15/83/77/945158377.db2.gz QGIKTVNEABDKKP-DZGCQCFKSA-N 0 0 360.797 3.933 20 5 FHBDRN COc1cccc(N(CC(C)C)C(=O)c2ccc([N+](=O)[O-])cc2OC)c1 ZINC000427172376 945156584 /nfs/dbraw/zinc/15/65/84/945156584.db2.gz WKNXCGQJBXUYRW-UHFFFAOYSA-N 0 0 358.394 3.915 20 5 FHBDRN Cc1cscc1CNC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000426207787 945157630 /nfs/dbraw/zinc/15/76/30/945157630.db2.gz XWSKBLTYEDFTDP-UHFFFAOYSA-N 0 0 353.831 3.660 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)[C@H]1Cc2cc(F)ccc2O1 ZINC000611768829 938253164 /nfs/dbraw/zinc/25/31/64/938253164.db2.gz GWWICJLCJNRSMD-CQSZACIVSA-N 0 0 370.258 3.695 20 5 FHBDRN CCOc1cc(C(=O)OCc2ccc(C)s2)c([N+](=O)[O-])cc1OC ZINC000755401233 938261811 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362.430 3.997 20 5 FHBDRN CC(C)c1ccccc1OCC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000536063100 938295870 /nfs/dbraw/zinc/29/58/70/938295870.db2.gz JMOLQIOBMVLDAD-UHFFFAOYSA-N 0 0 354.406 3.682 20 5 FHBDRN O=C(c1cc(-c2cccc(F)c2)no1)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000536064576 938297523 /nfs/dbraw/zinc/29/75/23/938297523.db2.gz FNWMAAMVJMHOMR-UHFFFAOYSA-N 0 0 367.336 3.587 20 5 FHBDRN Cc1cc(NC(=O)Cc2noc3ccccc23)c2cc([N+](=O)[O-])ccc2n1 ZINC000161771147 938299847 /nfs/dbraw/zinc/29/98/47/938299847.db2.gz NYHPQJVGSRUQAC-UHFFFAOYSA-N 0 0 362.345 3.774 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N(Cc1cccs1)[C@@H]1C=C[C@H](CO)C1 ZINC000561757786 938301656 /nfs/dbraw/zinc/30/16/56/938301656.db2.gz JFFXBOYZLLXXFJ-LSDHHAIUSA-N 0 0 372.446 3.544 20 5 FHBDRN CCc1nn(C)c(NC[C@@H]2CCCO[C@H]2c2ccc(C)cc2)c1[N+](=O)[O-] ZINC000091729237 938304194 /nfs/dbraw/zinc/30/41/94/938304194.db2.gz LWRAGQVSKKUGGY-YJBOKZPZSA-N 0 0 358.442 3.779 20 5 FHBDRN Cc1noc(C(C)C)c1C(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000278328475 938308921 /nfs/dbraw/zinc/30/89/21/938308921.db2.gz DGGAZSFCYXGWGC-UHFFFAOYSA-N 0 0 371.315 3.963 20 5 FHBDRN C[C@@]1(C(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)CCc2ccccc2C1 ZINC000536077114 938309552 /nfs/dbraw/zinc/30/95/52/938309552.db2.gz YOOAWIVZERVWJM-OAQYLSRUSA-N 0 0 350.418 3.675 20 5 FHBDRN C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)N3CC(C4CCC4)C3)cc2[N+](=O)[O-])C1 ZINC000583581491 938309735 /nfs/dbraw/zinc/30/97/35/938309735.db2.gz QFUOBLOVSOORCU-HUUCEWRRSA-N 0 0 371.481 3.949 20 5 FHBDRN CCn1c(C)nc([N+](=O)[O-])c1NCc1cccc(OCC(F)(F)F)c1 ZINC000583585911 938310341 /nfs/dbraw/zinc/31/03/41/938310341.db2.gz UQEGPEFYANYNDT-UHFFFAOYSA-N 0 0 358.320 3.673 20 5 FHBDRN O=C(Nc1ccc(OC(F)F)cc1)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000536077417 938310384 /nfs/dbraw/zinc/31/03/84/938310384.db2.gz QMFXZUYSQDJPIS-UHFFFAOYSA-N 0 0 363.320 3.786 20 5 FHBDRN Cc1nnc(-c2ccccc2C(=O)OCc2ccc(Cl)c([N+](=O)[O-])c2)o1 ZINC000780379644 938311008 /nfs/dbraw/zinc/31/10/08/938311008.db2.gz 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O=C(c1ccc([N+](=O)[O-])o1)N(Cc1ccccc1)C[C@@H](O)c1ccsc1 ZINC000162214634 938863754 /nfs/dbraw/zinc/86/37/54/938863754.db2.gz PSLUCTHOZRFYAY-OAHLLOKOSA-N 0 0 372.402 3.625 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CSc1nnc(C)n1-c1ccccc1 ZINC000024217402 938870400 /nfs/dbraw/zinc/87/04/00/938870400.db2.gz UEVKYYIGQLOHDH-UHFFFAOYSA-N 0 0 356.407 3.785 20 5 FHBDRN CCN(Cc1ccc(OC)cc1)C(=O)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000065669687 938874665 /nfs/dbraw/zinc/87/46/65/938874665.db2.gz OJJNPAPFYISLCE-UHFFFAOYSA-N 0 0 350.321 3.544 20 5 FHBDRN Cc1nn(CCC(=O)Nc2cc(C)c(F)cc2Cl)c(C)c1[N+](=O)[O-] ZINC000584434489 938874687 /nfs/dbraw/zinc/87/46/87/938874687.db2.gz SPBYRKHVEJAZAO-UHFFFAOYSA-N 0 0 354.769 3.538 20 5 FHBDRN C[C@H](Nc1ccc(C(=O)Nc2cccnc2)cc1[N+](=O)[O-])c1ccccn1 ZINC000053060745 938878139 /nfs/dbraw/zinc/87/81/39/938878139.db2.gz XICRWTPQBBNXFB-ZDUSSCGKSA-N 0 0 363.377 3.810 20 5 FHBDRN CCc1ccc(CNC(=O)COc2cc(C)c([N+](=O)[O-])cc2Cl)s1 ZINC000506433974 945212243 /nfs/dbraw/zinc/21/22/43/945212243.db2.gz SLFCSTCMXSOSIS-UHFFFAOYSA-N 0 0 368.842 3.876 20 5 FHBDRN COCc1cc([N+](=O)[O-])ccc1NCc1cc(OC)ccc1OC(F)F ZINC000128206268 938901047 /nfs/dbraw/zinc/90/10/47/938901047.db2.gz VSYWBLJASLZULN-UHFFFAOYSA-N 0 0 368.336 3.963 20 5 FHBDRN COc1ccc(CSCc2ncn(-c3ccccc3)n2)cc1[N+](=O)[O-] ZINC000092336864 938916295 /nfs/dbraw/zinc/91/62/95/938916295.db2.gz WRCWMVLZUDZUFD-UHFFFAOYSA-N 0 0 356.407 3.618 20 5 FHBDRN CC(C)CO[C@@H](C)c1noc(CN(C)C/C=C/c2ccccc2[N+](=O)[O-])n1 ZINC000093885635 938931513 /nfs/dbraw/zinc/93/15/13/938931513.db2.gz PPXVOBZOPCBFPV-HEWZJLJBSA-N 0 0 374.441 3.857 20 5 FHBDRN CCc1nn(C)c(NCc2cccc(OC)c2OC2CCCC2)c1[N+](=O)[O-] ZINC000094158898 938935935 /nfs/dbraw/zinc/93/59/35/938935935.db2.gz CZAISNLRWAZQEI-UHFFFAOYSA-N 0 0 374.441 3.833 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(CC)Cc1cccc(F)c1 ZINC000065685120 938937018 /nfs/dbraw/zinc/93/70/18/938937018.db2.gz ZTMGQQAOEFSRTF-UHFFFAOYSA-N 0 0 366.414 3.507 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCc2sccc2[C@@H]1C ZINC000065685224 938941885 /nfs/dbraw/zinc/94/18/85/938941885.db2.gz XWTKXKVRFPXUGY-NSHDSACASA-N 0 0 366.464 3.527 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CNc1cc(F)ccc1OC(F)F ZINC000128235355 938963635 /nfs/dbraw/zinc/96/36/35/938963635.db2.gz GBFWEFHKSGKPHP-UHFFFAOYSA-N 0 0 369.299 3.694 20 5 FHBDRN Cn1cnc([N+](=O)[O-])c1N[C@@H](c1cc(F)cc(Br)c1)C1CC1 ZINC000480511967 938965741 /nfs/dbraw/zinc/96/57/41/938965741.db2.gz UUXZMGXTMNCVDZ-GFCCVEGCSA-N 0 0 369.194 3.793 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)c1ccnc(C2CC2)n1 ZINC000543854438 938966012 /nfs/dbraw/zinc/96/60/12/938966012.db2.gz ZNTLLCRBZPNFQM-UHFFFAOYSA-N 0 0 352.272 3.533 20 5 FHBDRN COc1ccc([C@H]2C[C@H](Nc3nc4sccn4c3[N+](=O)[O-])C2)cc1F ZINC000409575651 938967787 /nfs/dbraw/zinc/96/77/87/938967787.db2.gz LOJVEFJVSRZZGY-XYPYZODXSA-N 0 0 362.386 3.810 20 5 FHBDRN C[C@@H](CCc1ccc(O)cc1)NC(=O)C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000480540395 938970091 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COc1ccc(CCCC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c(OC)c1 ZINC000179158746 938980842 /nfs/dbraw/zinc/98/08/42/938980842.db2.gz UFDWSJJBDDYPMV-AWEZNQCLSA-N 0 0 372.421 3.812 20 5 FHBDRN O=[N+]([O-])c1ccc(CN2CCOCC2)cc1NC[C@@H]1CCCC(F)(F)C1 ZINC000409668708 938990001 /nfs/dbraw/zinc/99/00/01/938990001.db2.gz KGNOVQDJYBIGJH-OAHLLOKOSA-N 0 0 369.412 3.664 20 5 FHBDRN Cc1cc(Br)cc2c1CN(c1ncc([N+](=O)[O-])s1)CC2 ZINC000409731640 938993683 /nfs/dbraw/zinc/99/36/83/938993683.db2.gz KDUNQZVYEGSADG-UHFFFAOYSA-N 0 0 354.229 3.685 20 5 FHBDRN C[C@]1(O)CCCN(c2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])CC1 ZINC000480572724 938994537 /nfs/dbraw/zinc/99/45/37/938994537.db2.gz BTMFTJJGEMBQNP-FQEVSTJZSA-N 0 0 354.406 3.567 20 5 FHBDRN CC[C@H](O[C@@H]1CCC[C@H](C)C1)C(=O)Nc1ccc(OC)c([N+](=O)[O-])c1 ZINC000543857766 938996278 /nfs/dbraw/zinc/99/62/78/938996278.db2.gz AKTXDMFVVNTISG-BJJXKVORSA-N 0 0 350.415 3.916 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)NC12CC3CC(CC(C3)C1)C2 ZINC000065711481 938996780 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FHBDRN CC[C@@H](CNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21)c1ccccc1 ZINC000065719532 939007105 /nfs/dbraw/zinc/00/71/05/939007105.db2.gz YXZJMFKNIYHUMN-HNNXBMFYSA-N 0 0 351.406 3.860 20 5 FHBDRN C[C@@H](c1ccc(F)cc1)N(C)C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000065721014 939007132 /nfs/dbraw/zinc/00/71/32/939007132.db2.gz FTENLWZKMFPJJL-ZDUSSCGKSA-N 0 0 355.369 3.908 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])c(Cl)c1)n1ccccc1=Nc1ccccc1 ZINC000255625341 939013314 /nfs/dbraw/zinc/01/33/14/939013314.db2.gz AJXZWRKOEFPZOW-UHFFFAOYSA-N 0 0 353.765 3.971 20 5 FHBDRN CCOc1cccc2[nH]cc(CC(=O)Nc3cc([N+](=O)[O-])ccc3OC)c21 ZINC000188007244 939014386 /nfs/dbraw/zinc/01/43/86/939014386.db2.gz AGXFONIDPJYSNM-UHFFFAOYSA-N 0 0 369.377 3.665 20 5 FHBDRN CCC[C@@H](Cc1ccccc1)N(CCC)C(=O)Cn1c(C)ncc1[N+](=O)[O-] ZINC001125779700 939015099 /nfs/dbraw/zinc/01/50/99/939015099.db2.gz DGXBBCMBXSBLAM-SFHVURJKSA-N 0 0 372.469 3.750 20 5 FHBDRN Cc1n[nH]c(C(=O)N2CCCCC[C@@H]2/C=C\c2cccs2)c1[N+](=O)[O-] ZINC000611988604 939015265 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CC(C)COc1ccccc1CNC(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000065730340 939017823 /nfs/dbraw/zinc/01/78/23/939017823.db2.gz AJULMSZMAGHGKT-UHFFFAOYSA-N 0 0 372.421 3.715 20 5 FHBDRN CSc1cccc(C(=O)NCCc2csc(C(C)C)n2)c1[N+](=O)[O-] ZINC000188114402 939019114 /nfs/dbraw/zinc/01/91/14/939019114.db2.gz FMBGTHKQRASSEH-UHFFFAOYSA-N 0 0 365.480 3.869 20 5 FHBDRN COc1ccc(Cl)c(NC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)c1 ZINC000065744894 939021713 /nfs/dbraw/zinc/02/17/13/939021713.db2.gz DFRQHQOYMWYFSZ-UHFFFAOYSA-N 0 0 359.769 3.850 20 5 FHBDRN COc1cc(OC)cc(N(C)C(=O)c2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000188233850 939062926 /nfs/dbraw/zinc/06/29/26/939062926.db2.gz OXGXPOAEPLFJMM-UHFFFAOYSA-N 0 0 350.758 3.542 20 5 FHBDRN COC(=O)/C(=C/c1ccc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccncc1 ZINC000255668184 939074097 /nfs/dbraw/zinc/07/40/97/939074097.db2.gz NRKFKWHXQWCMHB-SFQUDFHCSA-N 0 0 350.330 3.963 20 5 FHBDRN O=C(N[C@H](c1ccccc1)[C@H]1CCCO1)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000179286735 939074800 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FHBDRN Cc1csc([C@@H]2COCCN2Cc2c(Cl)cccc2[N+](=O)[O-])n1 ZINC000432163049 945238401 /nfs/dbraw/zinc/23/84/01/945238401.db2.gz MYMGXMVYNZQLOT-AWEZNQCLSA-N 0 0 353.831 3.587 20 5 FHBDRN CC(C)[C@@H](NS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-])c1ccccc1 ZINC000516787859 945241207 /nfs/dbraw/zinc/24/12/07/945241207.db2.gz SNNYLVUPPGIULD-OAHLLOKOSA-N 0 0 368.842 3.924 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CC[C@H](Cc3ccc(Br)cc3)C2)s1 ZINC000432168016 945245548 /nfs/dbraw/zinc/24/55/48/945245548.db2.gz SVJPODXUDGVKSL-LLVKDONJSA-N 0 0 368.256 3.883 20 5 FHBDRN CCn1ncc(C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c1-c1ccccc1 ZINC000427274041 945244974 /nfs/dbraw/zinc/24/49/74/945244974.db2.gz OJQYSJYSGGBPNL-AWEZNQCLSA-N 0 0 364.405 3.969 20 5 FHBDRN C[C@H](CCC1CC1)NC(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000426238255 945245812 /nfs/dbraw/zinc/24/58/12/945245812.db2.gz NURQJDLWITXSDX-SNVBAGLBSA-N 0 0 359.348 3.992 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](CO)[C@H](C)CCC ZINC000516777799 945246191 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20 5 FHBDRN CC(C)(C)OC(=O)NCCCNc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000310595598 939952885 /nfs/dbraw/zinc/95/28/85/939952885.db2.gz AYHGSPCVQROLGP-UHFFFAOYSA-N 0 0 363.336 3.940 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N1CCC(Nc2cccnc2)CC1 ZINC000364523800 939955871 /nfs/dbraw/zinc/95/58/71/939955871.db2.gz BDEAIOWVAISCPS-UHFFFAOYSA-N 0 0 369.425 3.715 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1)c1cnc2ncc(Br)cc2c1 ZINC000614785348 939959503 /nfs/dbraw/zinc/95/95/03/939959503.db2.gz JKNOMPSKHWDMNI-UHFFFAOYSA-N 0 0 373.166 3.553 20 5 FHBDRN CCN(C(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F)c1ncccc1C ZINC000410818394 939961487 /nfs/dbraw/zinc/96/14/87/939961487.db2.gz MTRJWEGCFPWMCX-UHFFFAOYSA-N 0 0 353.300 3.984 20 5 FHBDRN C/C(=C\C(=O)NCc1ccccc1[N+](=O)[O-])c1ccccc1OC(F)F ZINC000177145258 939961608 /nfs/dbraw/zinc/96/16/08/939961608.db2.gz VNCMYYOYYNNCLR-ZRDIBKRKSA-N 0 0 362.332 3.916 20 5 FHBDRN CN(C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F)c1ccc([N+](=O)[O-])nc1 ZINC000410811537 939961618 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FHBDRN Cc1nn(CCC(=O)N2CC[C@@H](C)c3cccc(C)c32)c(C)c1[N+](=O)[O-] ZINC000410986147 939981100 /nfs/dbraw/zinc/98/11/00/939981100.db2.gz VYIXNDDPZAMZAJ-GFCCVEGCSA-N 0 0 356.426 3.647 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])cc(F)c1F)N1CC2(CCOCC2)c2ccccc21 ZINC000364670479 939984707 /nfs/dbraw/zinc/98/47/07/939984707.db2.gz ZVNAJEKFMQTIMU-UHFFFAOYSA-N 0 0 374.343 3.582 20 5 FHBDRN Cc1occc1CN(C)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000128486925 945287121 /nfs/dbraw/zinc/28/71/21/945287121.db2.gz BAGIKDOVUZGRBY-SNVBAGLBSA-N 0 0 351.790 3.609 20 5 FHBDRN COc1cc(C(=O)N2CCC[C@]2(C)CC(C)C)c([N+](=O)[O-])cc1OC ZINC000411028216 939987856 /nfs/dbraw/zinc/98/78/56/939987856.db2.gz FDKATMGXYODNLQ-GOSISDBHSA-N 0 0 350.415 3.653 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])Nc1ccc(-c2nccs2)cc1 ZINC000065858800 939988550 /nfs/dbraw/zinc/98/85/50/939988550.db2.gz PGMXAHSWNSZWQD-UHFFFAOYSA-N 0 0 354.391 3.769 20 5 FHBDRN CCNc1ccc(C(=O)NC[C@H]2CSc3ccccc32)cc1[N+](=O)[O-] ZINC000411009087 939989239 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C[C@@H](NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1)c1nc2ccccc2n1C ZINC000136542081 940020315 /nfs/dbraw/zinc/02/03/15/940020315.db2.gz JVAQIPYBKLKIGY-SNVBAGLBSA-N 0 0 358.785 3.626 20 5 FHBDRN Cc1cc(NC(=O)C(=O)N[C@H](C)[C@H](C)C2CCCCC2)ccc1[N+](=O)[O-] ZINC000411278249 940021274 /nfs/dbraw/zinc/02/12/74/940021274.db2.gz PQAFSLXPHLVRJX-UONOGXRCSA-N 0 0 361.442 3.563 20 5 FHBDRN CCCC[C@@H](NC(=O)C(=O)Nc1cc([N+](=O)[O-])c(C)cc1C)C1CCC1 ZINC000411304544 940025609 /nfs/dbraw/zinc/02/56/09/940025609.db2.gz SLMBCHVNOHFZQW-OAHLLOKOSA-N 0 0 361.442 3.625 20 5 FHBDRN COc1ccc([C@@H](C)N(C)C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)cc1 ZINC000411303013 940025662 /nfs/dbraw/zinc/02/56/62/940025662.db2.gz BMOIDDWTXLLZTE-ZNZDAUKMSA-N 0 0 354.406 3.927 20 5 FHBDRN C[C@@H]1N(C(=O)/C=C/c2ccc(Cl)c([N+](=O)[O-])c2)CCC12CCOCC2 ZINC000364967948 940029586 /nfs/dbraw/zinc/02/95/86/940029586.db2.gz WNKSJAYCSBJQGB-LQPUYASZSA-N 0 0 364.829 3.679 20 5 FHBDRN COCCOc1ccc(NC(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)cc1 ZINC000411400108 940037688 /nfs/dbraw/zinc/03/76/88/940037688.db2.gz NFMXWMGFIZSOGD-UHFFFAOYSA-N 0 0 374.393 3.660 20 5 FHBDRN CC[C@@H](C)[C@H](C)N(C(=O)C(=O)Nc1cc(C)c([N+](=O)[O-])cc1C)C1CC1 ZINC000411400687 940037702 /nfs/dbraw/zinc/03/77/02/940037702.db2.gz KQLKZQKPTQTHCV-RISCZKNCSA-N 0 0 361.442 3.576 20 5 FHBDRN CC(C)(C)n1cc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)cn1 ZINC000065923884 940069138 /nfs/dbraw/zinc/06/91/38/940069138.db2.gz RHOCDLZQLXGXSZ-UHFFFAOYSA-N 0 0 371.441 3.789 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCCC[C@@H]1c1cc[nH]n1 ZINC000375925191 940069580 /nfs/dbraw/zinc/06/95/80/940069580.db2.gz RVKUHQIJMWAKSI-CRAIPNDOSA-N 0 0 356.426 3.640 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])N[C@H](c1ccc(F)cc1)c1cccnc1 ZINC000365187958 940075118 /nfs/dbraw/zinc/07/51/18/940075118.db2.gz PLZVUEQDNDUUHY-HXUWFJFHSA-N 0 0 365.364 3.577 20 5 FHBDRN Cc1ccncc1[C@@H](C)Nc1ncc([N+](=O)[O-])c(C)c1Br ZINC000612449553 940075279 /nfs/dbraw/zinc/07/52/79/940075279.db2.gz 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O=[N+]([O-])c1c(Sc2nc(-c3ccc(F)cc3)c[nH]2)nc2sccn21 ZINC000024340607 940106186 /nfs/dbraw/zinc/10/61/86/940106186.db2.gz YBXKRJFRUOJKAB-UHFFFAOYSA-N 0 0 361.383 3.984 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])c2cccnc12)N1CCO[C@@H](C2CCCCC2)C1 ZINC000612505894 940110014 /nfs/dbraw/zinc/11/00/14/940110014.db2.gz FOBOXJBRLMERKG-GOSISDBHSA-N 0 0 369.421 3.564 20 5 FHBDRN COc1c(-c2nc(-c3c(C)nc4sc(C)cn43)no2)cccc1[N+](=O)[O-] ZINC000426589527 945297373 /nfs/dbraw/zinc/29/73/73/945297373.db2.gz YDRNTNJOVBVOAM-UHFFFAOYSA-N 0 0 371.378 3.646 20 5 FHBDRN CC(C)CO[C@@H](C)c1noc(COc2cc([N+](=O)[O-])ccc2Cl)n1 ZINC000177334958 940120248 /nfs/dbraw/zinc/12/02/48/940120248.db2.gz UXQCPUMVPHAFDS-JTQLQIEISA-N 0 0 355.778 3.944 20 5 FHBDRN O=C(N[C@H]1CCCC(F)(F)C1)c1c([N+](=O)[O-])cccc1C(F)(F)F ZINC000612556009 940143154 /nfs/dbraw/zinc/14/31/54/940143154.db2.gz QEGUJENSQWNEOO-QMMMGPOBSA-N 0 0 352.259 3.921 20 5 FHBDRN COc1ccc(N(Cc2cccs2)C(=O)c2ccc([N+](=O)[O-])n2C)cc1 ZINC000612566764 940145707 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357.391 3.714 20 5 FHBDRN CC(C)(C)[C@@H](NS(=O)(=O)c1ccc([N+](=O)[O-])s1)c1ccccc1 ZINC000066000277 940176162 /nfs/dbraw/zinc/17/61/62/940176162.db2.gz QKPQRYOEGNYFJA-AWEZNQCLSA-N 0 0 354.453 3.722 20 5 FHBDRN Cc1cc(Br)ccc1CN(C)C(=O)c1ccc([N+](=O)[O-])s1 ZINC000470077008 940176838 /nfs/dbraw/zinc/17/68/38/940176838.db2.gz UIKZBMRYYXZFQR-UHFFFAOYSA-N 0 0 369.240 3.999 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1F)N1CCc2[nH]c3ccc(F)cc3c2C1 ZINC000612610991 940181971 /nfs/dbraw/zinc/18/19/71/940181971.db2.gz ATRBUNSPUZKALE-UHFFFAOYSA-N 0 0 372.331 3.945 20 5 FHBDRN COc1ccc(OC)c([C@H](C)NC(=O)Nc2ccc([N+](=O)[O-])cc2F)c1 ZINC000612610807 940182292 /nfs/dbraw/zinc/18/22/92/940182292.db2.gz VETWUSLORKZBSS-JTQLQIEISA-N 0 0 363.345 3.634 20 5 FHBDRN COc1ccc(OC)c([C@@H](C)NC(=O)Nc2ccc([N+](=O)[O-])cc2F)c1 ZINC000612610809 940182305 /nfs/dbraw/zinc/18/23/05/940182305.db2.gz VETWUSLORKZBSS-SNVBAGLBSA-N 0 0 363.345 3.634 20 5 FHBDRN CCCN(c1nnc(-c2ccc([N+](=O)[O-])cc2)n1C[C@H]1CCOC1)C(C)C ZINC000570177086 940185920 /nfs/dbraw/zinc/18/59/20/940185920.db2.gz YQGPOHDYXXGFKN-OAHLLOKOSA-N 0 0 373.457 3.515 20 5 FHBDRN CCc1ccc(C(=O)OCc2nc(-c3ccsc3)no2)cc1[N+](=O)[O-] ZINC000177439549 940200828 /nfs/dbraw/zinc/20/08/28/940200828.db2.gz WLZVZOAXAOWJMZ-UHFFFAOYSA-N 0 0 359.363 3.626 20 5 FHBDRN COc1cc(OCC(=O)N[C@@H](c2ccc(C)cc2)C2CC2)ccc1[N+](=O)[O-] ZINC000066018767 940204303 /nfs/dbraw/zinc/20/43/03/940204303.db2.gz BXWVCHXZSLIEEY-FQEVSTJZSA-N 0 0 370.405 3.558 20 5 FHBDRN CCCOc1ccc(NC(=O)COc2ccc([N+](=O)[O-])c(OC)c2)c(C)c1 ZINC000066026614 940205131 /nfs/dbraw/zinc/20/51/31/940205131.db2.gz HOFBMXMKBNEQFY-UHFFFAOYSA-N 0 0 374.393 3.718 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NCc1nn(C)c2ccccc12 ZINC000612711395 940231251 /nfs/dbraw/zinc/23/12/51/940231251.db2.gz ZSKNGIUKNIHZTG-UHFFFAOYSA-N 0 0 370.434 3.524 20 5 FHBDRN CCCOc1ccc(CNC(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1OC ZINC000506783326 945305977 /nfs/dbraw/zinc/30/59/77/945305977.db2.gz XLHFNHPHFVQBPY-UHFFFAOYSA-N 0 0 358.394 3.631 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N(Cc2ccco2)CC(F)(F)F)c1 ZINC000548957858 940250774 /nfs/dbraw/zinc/25/07/74/940250774.db2.gz VXOONOKMMJWLAH-UHFFFAOYSA-N 0 0 372.299 3.791 20 5 FHBDRN COC(=O)c1scc(C)c1NC(=O)/C=C(/C)c1ccc([N+](=O)[O-])cc1 ZINC000782639891 940252394 /nfs/dbraw/zinc/25/23/94/940252394.db2.gz VFFMDFVXMKJQGC-NTMALXAHSA-N 0 0 360.391 3.793 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NCCSCc2ccc(C)cc2)c1 ZINC000548959497 940273269 /nfs/dbraw/zinc/27/32/69/940273269.db2.gz SOOULGPDEKSICT-UHFFFAOYSA-N 0 0 374.462 3.965 20 5 FHBDRN CCCN(CCC)C(=O)c1ccc(NC(=O)c2ccc([N+](=O)[O-])o2)cc1 ZINC000046652311 940283267 /nfs/dbraw/zinc/28/32/67/940283267.db2.gz LNEWSOFCZBHIIK-UHFFFAOYSA-N 0 0 359.382 3.702 20 5 FHBDRN Nc1ccc(-c2noc([C@@H]3CCc4c3cccc4Cl)n2)cc1[N+](=O)[O-] ZINC000612856141 940315338 /nfs/dbraw/zinc/31/53/38/940315338.db2.gz SOFLGJYJNAEPFH-GFCCVEGCSA-N 0 0 356.769 3.959 20 5 FHBDRN CNc1ccc(-c2nc(Cc3ccc4ccccc4n3)no2)cc1[N+](=O)[O-] ZINC000612893726 940331010 /nfs/dbraw/zinc/33/10/10/940331010.db2.gz LLYLYRXHSOTWNB-UHFFFAOYSA-N 0 0 361.361 3.826 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)ccc1-c1nc(Cc2ccc3c(c2)OCCO3)no1 ZINC000612893977 940332144 /nfs/dbraw/zinc/33/21/44/940332144.db2.gz LNWRFIWNLUDFGW-UHFFFAOYSA-N 0 0 373.752 3.660 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]cc(-c3nc(Cc4ccc5c(c4)CCO5)no3)c2c1 ZINC000612911997 940337396 /nfs/dbraw/zinc/33/73/96/940337396.db2.gz LEKKBOHRSXELFJ-UHFFFAOYSA-N 0 0 362.345 3.652 20 5 FHBDRN COc1cccc([C@H](C)c2noc(-c3n[nH]c(C(C)C)c3[N+](=O)[O-])n2)c1 ZINC000612917181 940338990 /nfs/dbraw/zinc/33/89/90/940338990.db2.gz GUEFAPCKZIGIDK-JTQLQIEISA-N 0 0 357.370 3.652 20 5 FHBDRN COc1ccc(Cc2nc([C@@H]3CCc4ccccc43)no2)cc1[N+](=O)[O-] ZINC000612933150 940344735 /nfs/dbraw/zinc/34/47/35/940344735.db2.gz NKGBRDFLLKYJGU-OAHLLOKOSA-N 0 0 351.362 3.655 20 5 FHBDRN COC(=O)c1ccc(-c2nc(-c3ccc([N+](=O)[O-])cc3C)no2)cc1F ZINC000612935247 940344868 /nfs/dbraw/zinc/34/48/68/940344868.db2.gz VEHOUOZWAUBIKZ-UHFFFAOYSA-N 0 0 357.297 3.546 20 5 FHBDRN Cc1cc(C)nc(-c2noc(-c3cc(=O)[nH]c4ccc([N+](=O)[O-])cc43)n2)c1 ZINC000612942263 940349222 /nfs/dbraw/zinc/34/92/22/940349222.db2.gz WJNFTZUOMONQSC-UHFFFAOYSA-N 0 0 363.333 3.577 20 5 FHBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)c1nc([C@H](C)c2cccs2)no1 ZINC000612947391 940352651 /nfs/dbraw/zinc/35/26/51/940352651.db2.gz RFZICZWSZAZDSJ-MNOVXSKESA-N 0 0 372.406 3.682 20 5 FHBDRN CNc1ccc(-c2nc([C@H]3CCc4ccccc4C3)no2)cc1[N+](=O)[O-] ZINC000612951854 940356037 /nfs/dbraw/zinc/35/60/37/940356037.db2.gz OUGYDVJZRGCLNH-AWEZNQCLSA-N 0 0 350.378 3.959 20 5 FHBDRN Cc1cc(Cc2noc([C@H]3Cc4cc(F)ccc4O3)n2)ccc1[N+](=O)[O-] ZINC000612958005 940360535 /nfs/dbraw/zinc/36/05/35/940360535.db2.gz JSXMANKPGVOBHB-MRXNPFEDSA-N 0 0 355.325 3.692 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]cc(Cc3noc(CCc4ccccc4F)n3)c2c1 ZINC000612960202 940362340 /nfs/dbraw/zinc/36/23/40/940362340.db2.gz ZHGXOXMKTOVFHP-UHFFFAOYSA-N 0 0 366.352 3.974 20 5 FHBDRN Cc1ccccc1[C@@H]1C[C@H]1NC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000124671567 945317367 /nfs/dbraw/zinc/31/73/67/945317367.db2.gz DEBTVUIONCYPIK-ZWKOTPCHSA-N 0 0 351.406 3.527 20 5 FHBDRN O=[N+]([O-])c1ccccc1OCCSc1nnc(Cc2cccs2)o1 ZINC000066261323 940370414 /nfs/dbraw/zinc/37/04/14/940370414.db2.gz ISOLGSLYJROGDJ-UHFFFAOYSA-N 0 0 363.420 3.801 20 5 FHBDRN C[C@@H](CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)NC(=O)C1CCCCC1 ZINC000066274237 940377909 /nfs/dbraw/zinc/37/79/09/940377909.db2.gz LHTLSCNCJMRNEL-NSHDSACASA-N 0 0 367.833 3.662 20 5 FHBDRN Cc1ccc(CC[C@H](C)NC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)o1 ZINC000511406543 940383656 /nfs/dbraw/zinc/38/36/56/940383656.db2.gz XCPLAMFPIAUNKK-AWEZNQCLSA-N 0 0 359.426 3.701 20 5 FHBDRN Cc1ccccc1[C@@H]1CCCN1C(=O)COc1ccc([N+](=O)[O-])c(C)c1 ZINC000431720072 940399608 /nfs/dbraw/zinc/39/96/08/940399608.db2.gz UTUFWSBMTORSLG-IBGZPJMESA-N 0 0 354.406 3.954 20 5 FHBDRN COC(=O)c1ccccc1C(=O)c1ccc(NC[C@@H]2C[C@@H]2C)c([N+](=O)[O-])c1 ZINC000579896565 940412996 /nfs/dbraw/zinc/41/29/96/940412996.db2.gz NJMASMMUYZYIIA-JSGCOSHPSA-N 0 0 368.389 3.680 20 5 FHBDRN COc1cccc(Oc2ccc(CNc3ccc([N+](=O)[O-])nc3)cn2)c1 ZINC000579977616 940421270 /nfs/dbraw/zinc/42/12/70/940421270.db2.gz KFFKQCAWLNGSKV-UHFFFAOYSA-N 0 0 352.350 3.798 20 5 FHBDRN CO[C@H](CNC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)C1CC1 ZINC000511418318 940421926 /nfs/dbraw/zinc/42/19/26/940421926.db2.gz NQLSWBIVHBNQOK-GOSISDBHSA-N 0 0 356.378 3.542 20 5 FHBDRN C[C@@H]1CCc2c(F)cccc2[C@H]1NC(=O)NCc1ccccc1[N+](=O)[O-] ZINC000431731934 940430848 /nfs/dbraw/zinc/43/08/48/940430848.db2.gz KNUWZZZNYDMEQI-XIKOKIGWSA-N 0 0 357.385 3.857 20 5 FHBDRN Cn1cnc([N+](=O)[O-])c1Oc1cc(F)c(Br)cc1Cl ZINC000548986436 940443026 /nfs/dbraw/zinc/44/30/26/940443026.db2.gz DWWGPOIYNOJCEI-UHFFFAOYSA-N 0 0 350.531 3.676 20 5 FHBDRN CCN(Cc1ccccc1Cl)S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1 ZINC000467397380 945321218 /nfs/dbraw/zinc/32/12/18/945321218.db2.gz VMBOSNMUXCWXLN-UHFFFAOYSA-N 0 0 374.871 3.829 20 5 FHBDRN CC(C)NC(=O)c1ccc(NCC[C@@H]2C[C@@H](C)O[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000548988176 940446803 /nfs/dbraw/zinc/44/68/03/940446803.db2.gz VGWOEWNTYSFGOS-QDMKHBRRSA-N 0 0 363.458 3.739 20 5 FHBDRN C[C@@H](Cc1cn(C)c2ccc(F)cc12)NC(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000414045620 940449215 /nfs/dbraw/zinc/44/92/15/940449215.db2.gz UGOMPVKDDSTHKI-ZDUSSCGKSA-N 0 0 369.396 3.516 20 5 FHBDRN COC(=O)CCc1ccc(Nc2ccc([N+](=O)[O-])c3cnccc23)cc1 ZINC000511427776 940453052 /nfs/dbraw/zinc/45/30/52/940453052.db2.gz UWXRYHCOESMSFM-UHFFFAOYSA-N 0 0 351.362 3.992 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)N1CC[C@](F)(c2ccccc2)C1 ZINC000580098616 940455253 /nfs/dbraw/zinc/45/52/53/940455253.db2.gz PMSMROYDDLIYHO-HXUWFJFHSA-N 0 0 371.412 3.884 20 5 FHBDRN COC(=O)c1ccc(OCc2ncc(-c3ccc(F)cc3)o2)cc1[N+](=O)[O-] ZINC000613113092 940455974 /nfs/dbraw/zinc/45/59/74/940455974.db2.gz VFKXMRJDRPMHCP-UHFFFAOYSA-N 0 0 372.308 3.755 20 5 FHBDRN Cc1cc(C)c(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2C)c(Cl)c1 ZINC000613112198 940456364 /nfs/dbraw/zinc/45/63/64/940456364.db2.gz YROCSLVRTRARMV-UHFFFAOYSA-N 0 0 354.815 3.974 20 5 FHBDRN O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)Nc1c(F)cc(Cl)cc1F ZINC000580240276 940470282 /nfs/dbraw/zinc/47/02/82/940470282.db2.gz JKJQIAUQXQHAGM-UHFFFAOYSA-N 0 0 362.666 3.986 20 5 FHBDRN Cc1ccc(COC(=O)c2cc3c(cc2[N+](=O)[O-])OCCCO3)cc1F ZINC001267544362 940472958 /nfs/dbraw/zinc/47/29/58/940472958.db2.gz XNKYYDSKYIZTFE-UHFFFAOYSA-N 0 0 361.325 3.561 20 5 FHBDRN C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N1CC[C@H](CC2CC2)C1 ZINC000580336089 940473280 /nfs/dbraw/zinc/47/32/80/940473280.db2.gz XPBFGMJTPFNYLR-DGCLKSJQSA-N 0 0 351.834 3.697 20 5 FHBDRN CC(C)(C(=O)NCc1nc2ccccc2s1)c1ccccc1[N+](=O)[O-] ZINC000431757594 940474482 /nfs/dbraw/zinc/47/44/82/940474482.db2.gz JVIPSDYWBQBSLH-UHFFFAOYSA-N 0 0 355.419 3.799 20 5 FHBDRN CSc1ccc(C(=O)N(C)Cc2ccccc2N(C)C)cc1[N+](=O)[O-] ZINC000580476883 940476417 /nfs/dbraw/zinc/47/64/17/940476417.db2.gz NJARBIPMEYWYHD-UHFFFAOYSA-N 0 0 359.451 3.655 20 5 FHBDRN CCn1c(C)nc([N+](=O)[O-])c1N[C@@H]1C[C@H]1c1ccc(OC(F)F)cc1 ZINC000580489147 940476625 /nfs/dbraw/zinc/47/66/25/940476625.db2.gz XDCJDIYVWYSANZ-QWHCGFSZSA-N 0 0 352.341 3.689 20 5 FHBDRN O=[N+]([O-])c1ccc(NCc2ccc(Cl)o2)nc1OCc1ccccc1 ZINC000613176495 940476734 /nfs/dbraw/zinc/47/67/34/940476734.db2.gz TYSILJJNDKUVPD-UHFFFAOYSA-N 0 0 359.769 3.849 20 5 FHBDRN CC(C)n1cc(NC(=O)c2ccc(N3CCC[C@@H](C)C3)c([N+](=O)[O-])c2)cn1 ZINC000066389859 940477862 /nfs/dbraw/zinc/47/78/62/940477862.db2.gz FPINFYWTEGECET-CQSZACIVSA-N 0 0 371.441 3.861 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1NC1CCN(C(=O)c2cc(Cl)c[nH]2)CC1 ZINC000376214467 940478286 /nfs/dbraw/zinc/47/82/86/940478286.db2.gz XJHBJJCNKXLELC-UHFFFAOYSA-N 0 0 362.817 3.601 20 5 FHBDRN CC(C)(C(=O)N1CCC(c2cccc(N)c2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000580542572 940478872 /nfs/dbraw/zinc/47/88/72/940478872.db2.gz CNNZCFUQMYETPT-UHFFFAOYSA-N 0 0 367.449 3.861 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N1CCCCC[C@@H]1c1noc(C)n1 ZINC000580545782 940479037 /nfs/dbraw/zinc/47/90/37/940479037.db2.gz QUOUWCNYSOGTJR-MRXNPFEDSA-N 0 0 373.413 3.998 20 5 FHBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)N1CCC[C@@H](C2CC2)C1 ZINC000685857376 940479361 /nfs/dbraw/zinc/47/93/61/940479361.db2.gz FYMOFPKUNWPLKS-QGZVFWFLSA-N 0 0 360.457 3.803 20 5 FHBDRN CCO[C@@H]1CCCN(c2ccc([N+](=O)[O-])c(OCc3ccccc3)n2)C1 ZINC000613179886 940479918 /nfs/dbraw/zinc/47/99/18/940479918.db2.gz VLPQHBDMDMWQTQ-MRXNPFEDSA-N 0 0 357.410 3.574 20 5 FHBDRN CNc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc([C@H]2CCCOC2)cc1 ZINC000580716566 940482735 /nfs/dbraw/zinc/48/27/35/940482735.db2.gz IVUDTDMFVCDIKS-HNNXBMFYSA-N 0 0 355.394 3.783 20 5 FHBDRN COc1cc(-c2nc(-c3ccc4c(c3)ncn4C)no2)cc([N+](=O)[O-])c1C ZINC000580742387 940483457 /nfs/dbraw/zinc/48/34/57/940483457.db2.gz UYJBYOPQQCHBNH-UHFFFAOYSA-N 0 0 365.349 3.516 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CCO[C@H](c3ccccc3)C2)c1 ZINC000549005326 940484077 /nfs/dbraw/zinc/48/40/77/940484077.db2.gz BBMNPHHWNKJEGA-BEFAXECRSA-N 0 0 370.405 3.644 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CCCOc3c(F)cccc32)c1 ZINC000549006937 940484749 /nfs/dbraw/zinc/48/47/49/940484749.db2.gz LXLBZGXQGZVBRL-MRXNPFEDSA-N 0 0 374.368 3.776 20 5 FHBDRN CC(C)[C@H]1N(C(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)CC12CCC2 ZINC000580750407 940484813 /nfs/dbraw/zinc/48/48/13/940484813.db2.gz HQHFZCCQRWFUDL-GOSISDBHSA-N 0 0 370.453 3.839 20 5 FHBDRN Cc1cc(-c2nnc(COC(=O)c3cc([N+](=O)[O-])c(C)s3)o2)c(C)o1 ZINC000782696245 940487217 /nfs/dbraw/zinc/48/72/17/940487217.db2.gz HDKVAKLTFSTHOJ-UHFFFAOYSA-N 0 0 363.351 3.582 20 5 FHBDRN CNc1c(C(=O)NCCc2c[nH]c3cc(Cl)ccc23)cccc1[N+](=O)[O-] ZINC000613228690 940487434 /nfs/dbraw/zinc/48/74/34/940487434.db2.gz NPDSFQJIITYEBQ-UHFFFAOYSA-N 0 0 372.812 3.744 20 5 FHBDRN CCn1c(C)nc([N+](=O)[O-])c1N[C@@H]1CCc2c1cccc2Br ZINC000580973358 940491189 /nfs/dbraw/zinc/49/11/89/940491189.db2.gz BYSBRRPUEOJGCR-CYBMUJFWSA-N 0 0 365.231 3.982 20 5 FHBDRN CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@@H]3CN2c1ccc([N+](=O)[O-])c(-c2ccccc2)n1 ZINC000581074224 940492813 /nfs/dbraw/zinc/49/28/13/940492813.db2.gz MFDUIEDRHRSIFU-YRYMLKIGSA-N 0 0 351.406 3.516 20 5 FHBDRN C[C@H](CN(C)C(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)c1ccccc1 ZINC000066458372 940495143 /nfs/dbraw/zinc/49/51/43/940495143.db2.gz UWBWVWKBJROVDQ-OAHLLOKOSA-N 0 0 364.405 3.656 20 5 FHBDRN C[C@@H](NC(=O)NCCCCc1ccc([N+](=O)[O-])cc1)c1ccncc1F ZINC000511463113 940496104 /nfs/dbraw/zinc/49/61/04/940496104.db2.gz ZJISIQDWKJSCLD-CYBMUJFWSA-N 0 0 360.389 3.512 20 5 FHBDRN COCCOc1cccc(/C=C/c2nc(-c3cccc([N+](=O)[O-])c3)no2)c1 ZINC000581214823 940496731 /nfs/dbraw/zinc/49/67/31/940496731.db2.gz LFQYUZSJOFCPGA-CMDGGOBGSA-N 0 0 367.361 3.840 20 5 FHBDRN CC(C)c1ccc(C(=O)N2CC(C)(C)[C@@H]2c2cnn(C)c2)cc1[N+](=O)[O-] ZINC000581271464 940498193 /nfs/dbraw/zinc/49/81/93/940498193.db2.gz GPNQOACUAJMBDF-KRWDZBQOSA-N 0 0 356.426 3.675 20 5 FHBDRN C[C@@H](c1nc2ccccc2s1)[C@H](C)OC(=O)CCn1cc([N+](=O)[O-])cn1 ZINC000177990824 940499704 /nfs/dbraw/zinc/49/97/04/940499704.db2.gz VOFLDUWCCFWELT-NEPJUHHUSA-N 0 0 374.422 3.527 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@](C)(c1ccccc1)C(F)(F)F 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3.805 20 5 FHBDRN O=[N+]([O-])c1cc(F)c(CN2CCCN3c4ccccc4C[C@@H]3C2)c(F)c1 ZINC000582091558 940652586 /nfs/dbraw/zinc/65/25/86/940652586.db2.gz XWUNOCBXWJBDOO-OAHLLOKOSA-N 0 0 359.376 3.510 20 5 FHBDRN CN(CCc1cccs1)C(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000582096109 940653264 /nfs/dbraw/zinc/65/32/64/940653264.db2.gz AUYSOGGNCSYQJD-UHFFFAOYSA-N 0 0 372.450 3.564 20 5 FHBDRN Cc1cc(N2CCOCC2)ccc1N[C@@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000582497536 940675280 /nfs/dbraw/zinc/67/52/80/940675280.db2.gz VOFCMQWINVZDDD-LJQANCHMSA-N 0 0 353.422 3.839 20 5 FHBDRN Cc1ccc(NC(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000174205110 940710092 /nfs/dbraw/zinc/71/00/92/940710092.db2.gz LUSXGDRAZMHRCU-UHFFFAOYSA-N 0 0 355.394 3.979 20 5 FHBDRN Cc1sc2nc(S/C=C/c3ccc([N+](=O)[O-])o3)n(C)c(=O)c2c1C ZINC000066610112 940717811 /nfs/dbraw/zinc/71/78/11/940717811.db2.gz BFXBFURHXBVNBJ-VOTSOKGWSA-N 0 0 363.420 3.876 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2noc(-c3ccn(-c4ccc(F)cc4F)n3)n2)c1 ZINC000613451530 940720274 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C[C@H](CC(=O)Nc1ccnn1-c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000609453392 940802022 /nfs/dbraw/zinc/80/20/22/940802022.db2.gz FZXPCOOTXKRMCP-CQSZACIVSA-N 0 0 350.378 3.913 20 5 FHBDRN O=C(Nc1ccc2c(c1)NC(=O)CS2)c1cccc(Cl)c1[N+](=O)[O-] ZINC000175077911 940807836 /nfs/dbraw/zinc/80/78/36/940807836.db2.gz FIZRULDYHWAZBX-UHFFFAOYSA-N 0 0 363.782 3.545 20 5 FHBDRN COCc1nc(C)c(C(=O)OCc2cc(Cl)ccc2[N+](=O)[O-])s1 ZINC000758847270 945353420 /nfs/dbraw/zinc/35/34/20/945353420.db2.gz UKCVVDXJQICLFZ-UHFFFAOYSA-N 0 0 356.787 3.517 20 5 FHBDRN O=[N+]([O-])c1cc(I)ccc1N[C@H]1CCC(F)(F)C1 ZINC000310804031 940862192 /nfs/dbraw/zinc/86/21/92/940862192.db2.gz HINXNKFYQYOIBQ-QMMMGPOBSA-N 0 0 368.121 3.799 20 5 FHBDRN C[C@@H](NC(=O)c1ccc(Cl)cc1[N+](=O)[O-])c1ccc(-n2cccn2)cc1 ZINC000175431751 940863839 /nfs/dbraw/zinc/86/38/39/940863839.db2.gz XTWTXUYXYSVTJG-GFCCVEGCSA-N 0 0 370.796 3.925 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)N2CCc3cccc(C)c32)cc1SC ZINC000170869573 940869779 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3.630 20 5 FHBDRN O=C(N[C@@H]1C[C@@H]2OCCC[C@H]12)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000188669773 940916749 /nfs/dbraw/zinc/91/67/49/940916749.db2.gz QAUJLNRYQTYAGQ-SUMDDJOVSA-N 0 0 367.405 3.636 20 5 FHBDRN CCC(=O)c1cccc(NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)c1 ZINC000120865482 945360207 /nfs/dbraw/zinc/36/02/07/945360207.db2.gz ZDJMWBWHNQUTAI-UHFFFAOYSA-N 0 0 364.361 3.626 20 5 FHBDRN COc1cc(C(=O)N[C@H](C)c2nc(C(C)(C)C)cs2)ccc1[N+](=O)[O-] ZINC000106677522 945360396 /nfs/dbraw/zinc/36/03/96/945360396.db2.gz IWCCDLROEZYCGC-SNVBAGLBSA-N 0 0 363.439 3.848 20 5 FHBDRN CN(Cc1nnc(-c2cccc(Cl)c2)o1)Cc1ccccc1[N+](=O)[O-] ZINC000170953276 940930002 /nfs/dbraw/zinc/93/00/02/940930002.db2.gz OZNZUDUBOJVSME-UHFFFAOYSA-N 0 0 358.785 3.930 20 5 FHBDRN CN(CCc1ccc(Br)cc1)C(=O)c1csc([N+](=O)[O-])c1 ZINC000170956474 940934430 /nfs/dbraw/zinc/93/44/30/940934430.db2.gz KDMFNJLSIWAVPN-UHFFFAOYSA-N 0 0 369.240 3.734 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N(CC1CCC1)CC(F)(F)F ZINC000175945108 940956147 /nfs/dbraw/zinc/95/61/47/940956147.db2.gz RXLGSVZFONKVEL-UHFFFAOYSA-N 0 0 364.751 3.982 20 5 FHBDRN O=C1OC(c2ccc(F)cc2F)=N/C1=C\c1cc([N+](=O)[O-])ccc1Cl ZINC000018137316 945365807 /nfs/dbraw/zinc/36/58/07/945365807.db2.gz HOOAYLKUAPVLCJ-NSIKDUERSA-N 0 0 364.691 3.871 20 5 FHBDRN CCCN(C[C@@H]1CCCCO1)C(=O)c1ccc(SC)c([N+](=O)[O-])c1 ZINC000106695231 945365107 /nfs/dbraw/zinc/36/51/07/945365107.db2.gz NVWZKQSHUKXZPT-AWEZNQCLSA-N 0 0 352.456 3.738 20 5 FHBDRN O=C(Nc1ccc(-n2cccn2)cc1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000180359152 940983393 /nfs/dbraw/zinc/98/33/93/940983393.db2.gz SBOTYRRHZSJEAS-UHFFFAOYSA-N 0 0 374.303 3.634 20 5 FHBDRN C[C@H](O)CC(C)(C)CNC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 ZINC000176088483 940988394 /nfs/dbraw/zinc/98/83/94/940988394.db2.gz XMKZFPHRDBLDND-AWEZNQCLSA-N 0 0 372.421 3.914 20 5 FHBDRN Cc1nc(CCCC(=O)Nc2cc(-c3cccc([N+](=O)[O-])c3)[nH]n2)cs1 ZINC000176145498 940991283 /nfs/dbraw/zinc/99/12/83/940991283.db2.gz LXECWPBVSLXHPW-UHFFFAOYSA-N 0 0 371.422 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CC(C)[C@@H](CNc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2)c1cccnc1 ZINC000176746940 941072898 /nfs/dbraw/zinc/07/28/98/941072898.db2.gz AMIJDAUGCZTHCR-OAHLLOKOSA-N 0 0 354.410 3.726 20 5 FHBDRN Nc1cccc([N+](=O)[O-])c1C(=O)Nc1cccc(Oc2ccccn2)c1 ZINC000180831269 941081971 /nfs/dbraw/zinc/08/19/71/941081971.db2.gz OXHPKSHPXOTTFD-UHFFFAOYSA-N 0 0 350.334 3.617 20 5 FHBDRN O=C(c1cc2c(c([N+](=O)[O-])c1)OCO2)N(Cc1ccco1)C1CCCC1 ZINC000180877317 941085249 /nfs/dbraw/zinc/08/52/49/941085249.db2.gz QWUONXXYXWIJGU-UHFFFAOYSA-N 0 0 358.350 3.502 20 5 FHBDRN Cn1c(SCc2nc3cc([N+](=O)[O-])ccc3o2)nnc1-c1ccccc1 ZINC000176931630 941085458 /nfs/dbraw/zinc/08/54/58/941085458.db2.gz GXDXAWCZXPAXPA-UHFFFAOYSA-N 0 0 367.390 3.824 20 5 FHBDRN O=[N+]([O-])c1ccc(Cl)c(CN2CCC[C@@H](c3nncn3C3CC3)C2)c1 ZINC000180855093 941085954 /nfs/dbraw/zinc/08/59/54/941085954.db2.gz DEYJIALGTZYRDW-GFCCVEGCSA-N 0 0 361.833 3.554 20 5 FHBDRN CC(C)[C@@H](NC(=O)c1ccc([N+](=O)[O-])cn1)c1ccc(Cl)cc1F ZINC000541001786 941086047 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O=C(c1ccc(Cl)cc1[N+](=O)[O-])N1CCO[C@@H](c2cccc(F)c2)C1 ZINC000066694997 941144856 /nfs/dbraw/zinc/14/48/56/941144856.db2.gz SCWRZPQYKPHKND-MRXNPFEDSA-N 0 0 364.760 3.601 20 5 FHBDRN CCSc1cc(CNC(=O)c2ccc([N+](=O)[O-])c3cccnc23)ccn1 ZINC000189072035 941146134 /nfs/dbraw/zinc/14/61/34/941146134.db2.gz MJADIZVORBIFMB-UHFFFAOYSA-N 0 0 368.418 3.580 20 5 FHBDRN COc1ccc(CC(C)(C)NC(=O)CCOc2ccccc2[N+](=O)[O-])cc1 ZINC000189139996 941147313 /nfs/dbraw/zinc/14/73/13/941147313.db2.gz ZONZNCBLAAZNRO-UHFFFAOYSA-N 0 0 372.421 3.510 20 5 FHBDRN C[C@@H](C1CC1)n1cc(NCc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000189256419 941154184 /nfs/dbraw/zinc/15/41/84/941154184.db2.gz DNUCMBNGJDBTPQ-ZDUSSCGKSA-N 0 0 366.425 3.775 20 5 FHBDRN Cc1cc(C)c(NC(=O)c2cccc([N+](=O)[O-])c2N)cc1Br ZINC000189216813 941154649 /nfs/dbraw/zinc/15/46/49/941154649.db2.gz UIWLSOAEAUAESE-UHFFFAOYSA-N 0 0 364.199 3.809 20 5 FHBDRN Cc1ccc(C(C)(C)C(=O)OCC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 ZINC000728668738 941154819 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FHBDRN C[C@@H](CC(=O)c1ccco1)NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000178454570 941256559 /nfs/dbraw/zinc/25/65/59/941256559.db2.gz GUHUUPDSRRIROE-JTQLQIEISA-N 0 0 358.375 3.794 20 5 FHBDRN COCCNc1ccccc1CNC(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000189756061 941273473 /nfs/dbraw/zinc/27/34/73/941273473.db2.gz CCLQHOIVJYSIQD-UHFFFAOYSA-N 0 0 371.437 3.707 20 5 FHBDRN Cc1ccc(C)c(S(=O)(=O)N2CCC[C@@H]2c2cccs2)c1[N+](=O)[O-] ZINC000189803136 941279479 /nfs/dbraw/zinc/27/94/79/941279479.db2.gz UNSZTQNUIXDRKH-CYBMUJFWSA-N 0 0 366.464 3.799 20 5 FHBDRN COc1cc(C(=O)N2C[C@H](C)Oc3c(Cl)cccc32)ccc1[N+](=O)[O-] ZINC000189836366 941287092 /nfs/dbraw/zinc/28/70/92/941287092.db2.gz UZNIPLBRYMJTMI-JTQLQIEISA-N 0 0 362.769 3.685 20 5 FHBDRN CCN(Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C[C@H](O)C(F)(F)F ZINC000189865243 941294508 /nfs/dbraw/zinc/29/45/08/941294508.db2.gz NROKPTXSLKGVEP-HNNXBMFYSA-N 0 0 358.316 3.600 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2ccc(CN3CCO[C@@H](CF)C3)o2)c(Cl)c1 ZINC000414472600 941295816 /nfs/dbraw/zinc/29/58/16/941295816.db2.gz SSRXMTHDNSYDFE-ZDUSSCGKSA-N 0 0 354.765 3.679 20 5 FHBDRN Cc1ccc([C@H]2CCCCN2C(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000189908824 941299249 /nfs/dbraw/zinc/29/92/49/941299249.db2.gz JIMYIORJDLFNDM-GOSISDBHSA-N 0 0 367.405 3.596 20 5 FHBDRN CC1(C)CN(C(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)CC2(CCCC2)O1 ZINC000189933758 941306748 /nfs/dbraw/zinc/30/67/48/941306748.db2.gz CWSHYBWDQKGXOU-UHFFFAOYSA-N 0 0 357.410 3.640 20 5 FHBDRN Cc1nn(CCC(=O)N2CCc3c(cccc3C(C)C)C2)c(C)c1[N+](=O)[O-] ZINC000189978968 941324854 /nfs/dbraw/zinc/32/48/54/941324854.db2.gz BSQASOVYSCKZDU-UHFFFAOYSA-N 0 0 370.453 3.507 20 5 FHBDRN O=C(CCc1cc(F)ccc1[N+](=O)[O-])N1CCCc2ccc([N+](=O)[O-])cc21 ZINC001125847974 941330071 /nfs/dbraw/zinc/33/00/71/941330071.db2.gz DJKCOKRCWJNGDE-UHFFFAOYSA-N 0 0 373.340 3.554 20 5 FHBDRN COc1cc(NCc2ccc(OC)c([N+](=O)[O-])c2)c(Cl)c(OC)c1 ZINC000414480844 941332313 /nfs/dbraw/zinc/33/23/13/941332313.db2.gz DCHFQXLBBCOLNR-UHFFFAOYSA-N 0 0 352.774 3.886 20 5 FHBDRN O=C(Nc1ccc2c(c1)OCCO2)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000179037713 941332496 /nfs/dbraw/zinc/33/24/96/941332496.db2.gz BNZIRUUWFNVHGQ-UHFFFAOYSA-N 0 0 369.377 3.563 20 5 FHBDRN O=C(Nc1cc(C(F)(F)F)ccc1F)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000181488107 941335856 /nfs/dbraw/zinc/33/58/56/941335856.db2.gz KIQZIJQVSKVYRZ-UHFFFAOYSA-N 0 0 372.230 3.734 20 5 FHBDRN O=[N+]([O-])c1ccccc1CN(Cc1nc(-c2cccs2)no1)C1CC1 ZINC000179239923 941341797 /nfs/dbraw/zinc/34/17/97/941341797.db2.gz XEKQSSPNAUNJGX-UHFFFAOYSA-N 0 0 356.407 3.871 20 5 FHBDRN C[C@@H]1C[C@H]2CCCC[C@@H]2N1S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000180287548 941353849 /nfs/dbraw/zinc/35/38/49/941353849.db2.gz HCKNYCRRWJUXAT-WZRBSPASSA-N 0 0 358.847 3.590 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@]1(C)CCCC[C@H]1O ZINC000181497443 941355417 /nfs/dbraw/zinc/35/54/17/941355417.db2.gz RCXFJHJBMRVJJN-SJLPKXTDSA-N 0 0 366.483 3.766 20 5 FHBDRN Cc1ccc(C(=O)OCc2cc([N+](=O)[O-])cc3c2OCOC3)cc1Cl ZINC000728675598 941365225 /nfs/dbraw/zinc/36/52/25/941365225.db2.gz MPWZTSRNFBWOOS-UHFFFAOYSA-N 0 0 363.753 3.780 20 5 FHBDRN CCOC(=O)[C@@H](NCc1ccc(C(C)C)c([N+](=O)[O-])c1)c1cccc(O)c1 ZINC000190026930 941368315 /nfs/dbraw/zinc/36/83/15/941368315.db2.gz QHINNSVVGSIZEM-IBGZPJMESA-N 0 0 372.421 3.818 20 5 FHBDRN COc1ccc(CN[C@@H](C)c2nccn2-c2ccccc2)cc1[N+](=O)[O-] ZINC000376622044 941368359 /nfs/dbraw/zinc/36/83/59/941368359.db2.gz MNYICWOXICGXHY-AWEZNQCLSA-N 0 0 352.394 3.640 20 5 FHBDRN O=[N+]([O-])c1ccn(C2CC[NH+](Cc3cccn3Cc3cccs3)CC2)n1 ZINC000376650182 941371996 /nfs/dbraw/zinc/37/19/96/941371996.db2.gz DBFPDJMTFXZGPE-UHFFFAOYSA-N 0 0 371.466 3.540 20 5 FHBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CCC[C@H]21 ZINC000408021174 941392619 /nfs/dbraw/zinc/39/26/19/941392619.db2.gz GLBXLAHGLMERQD-QMTHXVAHSA-N 0 0 353.216 3.680 20 5 FHBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CCCC12CCC2 ZINC000408022238 941392694 /nfs/dbraw/zinc/39/26/94/941392694.db2.gz LZTOPAOPBFORSJ-UHFFFAOYSA-N 0 0 353.216 3.824 20 5 FHBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CCCC2(CC2)C1 ZINC000408021123 941392795 /nfs/dbraw/zinc/39/27/95/941392795.db2.gz HGJOZKQRYURFKB-UHFFFAOYSA-N 0 0 353.216 3.682 20 5 FHBDRN COC(=O)CCSCCNc1cc(C)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000549120694 941399392 /nfs/dbraw/zinc/39/93/92/941399392.db2.gz NZMDQQFDDKQKDK-UHFFFAOYSA-N 0 0 366.361 3.630 20 5 FHBDRN O=C(CCc1c(Cl)cccc1[N+](=O)[O-])N1CCC=C(c2cccnc2)C1 ZINC000935981262 941399437 /nfs/dbraw/zinc/39/94/37/941399437.db2.gz ONRNKHSDCJSVNE-UHFFFAOYSA-N 0 0 371.824 3.892 20 5 FHBDRN O=C(NCc1coc(-c2cccs2)n1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000110189679 941407354 /nfs/dbraw/zinc/40/73/54/941407354.db2.gz RWVGJJZTJXWFKZ-UHFFFAOYSA-N 0 0 363.782 3.895 20 5 FHBDRN C[C@H](C(=O)N1CC=C(c2cccnc2)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000376892134 941460809 /nfs/dbraw/zinc/46/08/09/941460809.db2.gz HXYAXUJZPYGZNE-ZDUSSCGKSA-N 0 0 355.369 3.548 20 5 FHBDRN Cc1nc2c(s1)[C@H](NC(=O)N(C)CCc1ccccc1[N+](=O)[O-])CCC2 ZINC000376922211 941466862 /nfs/dbraw/zinc/46/68/62/941466862.db2.gz WWNQYSDUDSOIMC-OAHLLOKOSA-N 0 0 374.466 3.621 20 5 FHBDRN Cc1cc(N2CCCC[C@@H]2c2nnc([C@H]3CCCO3)o2)ccc1[N+](=O)[O-] ZINC000377159340 941536554 /nfs/dbraw/zinc/53/65/54/941536554.db2.gz QTURTXRQILWDRZ-HZPDHXFCSA-N 0 0 358.398 3.869 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCCC[C@@H]1c1cc[nH]n1 ZINC000377163353 941537675 /nfs/dbraw/zinc/53/76/75/941537675.db2.gz ADVMQHOGZBPYFT-MLGOLLRUSA-N 0 0 360.439 3.552 20 5 FHBDRN CC(=O)c1ccc([N+](=O)[O-])cc1N1CCC(O)(c2ccccc2C)CC1 ZINC000377196030 941548882 /nfs/dbraw/zinc/54/88/82/941548882.db2.gz WICQNIULJCTIAV-UHFFFAOYSA-N 0 0 354.406 3.594 20 5 FHBDRN CC(C)CC[C@H](NC(=O)c1c[nH]nc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000549159882 941557293 /nfs/dbraw/zinc/55/72/93/941557293.db2.gz TZHCXRNQXXQPNB-AWEZNQCLSA-N 0 0 350.806 3.879 20 5 FHBDRN CC[C@H]1c2ccsc2CCN1C(=O)CNc1cc([N+](=O)[O-])ccc1F ZINC000178306222 941559656 /nfs/dbraw/zinc/55/96/56/941559656.db2.gz XLQWVPISMSJLHM-HNNXBMFYSA-N 0 0 363.414 3.743 20 5 FHBDRN CC[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)CCO1 ZINC000051083353 941563842 /nfs/dbraw/zinc/56/38/42/941563842.db2.gz APQCVOVMUMRKQK-OAHLLOKOSA-N 0 0 356.378 3.638 20 5 FHBDRN COc1ccc(NC(=O)N2CC[C@@H](c3ccccc3C)C2)cc1[N+](=O)[O-] ZINC000541107347 941594004 /nfs/dbraw/zinc/59/40/04/941594004.db2.gz PBZYOSOBFFKVPV-CQSZACIVSA-N 0 0 355.394 3.933 20 5 FHBDRN COc1ccc(NC(=O)Nc2cc(OC)c(OC)cc2C)cc1[N+](=O)[O-] ZINC000541106767 941594217 /nfs/dbraw/zinc/59/42/17/941594217.db2.gz SVYWWQVCQREUQO-UHFFFAOYSA-N 0 0 361.354 3.573 20 5 FHBDRN COc1ccc(NC(=O)N2CCc3c(Cl)cccc3C2)cc1[N+](=O)[O-] ZINC000541105676 941598117 /nfs/dbraw/zinc/59/81/17/941598117.db2.gz LMTFLJCPMBKXQT-UHFFFAOYSA-N 0 0 361.785 3.847 20 5 FHBDRN COc1ccc(NC(=O)N[C@H](c2ccccc2)[C@@H]2CCCO2)cc1[N+](=O)[O-] ZINC000541105822 941598864 /nfs/dbraw/zinc/59/88/64/941598864.db2.gz LUAPIJUDAYNNIG-ZWKOTPCHSA-N 0 0 371.393 3.645 20 5 FHBDRN CC(C)(C)c1ccc(-c2cc(NC(=O)c3c[nH]nc3[N+](=O)[O-])on2)cc1 ZINC000549185602 941608295 /nfs/dbraw/zinc/60/82/95/941608295.db2.gz YMJGVKFVRSIKMA-UHFFFAOYSA-N 0 0 355.354 3.523 20 5 FHBDRN Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)N[C@H]1CCOC2(CCCC2)C1 ZINC000377283263 941617658 /nfs/dbraw/zinc/61/76/58/941617658.db2.gz ODVAUVCROXHDGX-LBPRGKRZSA-N 0 0 351.378 3.656 20 5 FHBDRN CC(C)Oc1cc(C(=O)NC[C@H]2CCOc3ccccc32)ccc1[N+](=O)[O-] ZINC000412065494 941619489 /nfs/dbraw/zinc/61/94/89/941619489.db2.gz FTDXDLLRDLRAFE-OAHLLOKOSA-N 0 0 370.405 3.678 20 5 FHBDRN O=C(c1ccc(OC(F)F)c(F)c1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000549192730 941620112 /nfs/dbraw/zinc/62/01/12/941620112.db2.gz CHOYNCCDYKXMRJ-UHFFFAOYSA-N 0 0 352.268 3.538 20 5 FHBDRN O=[N+]([O-])c1cc(I)ccc1N[C@H]1CC[C@H](F)C1 ZINC000549196132 941620984 /nfs/dbraw/zinc/62/09/84/941620984.db2.gz FWTXLIMONURYHR-CBAPKCEASA-N 0 0 350.131 3.502 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(Sc2ccc(C(C)=O)cc2OC)c1 ZINC000541115219 941621465 /nfs/dbraw/zinc/62/14/65/941621465.db2.gz WHQJLOLDKQBCAN-UHFFFAOYSA-N 0 0 361.375 3.744 20 5 FHBDRN O=C(c1ccc(C2OCCO2)cc1)N1CCCCc2cc([N+](=O)[O-])ccc21 ZINC000892855441 941622653 /nfs/dbraw/zinc/62/26/53/941622653.db2.gz SPSTYUKIGPIKKL-UHFFFAOYSA-N 0 0 368.389 3.623 20 5 FHBDRN Cc1cc(F)cc2c1N(C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)CCC2 ZINC000066786078 941637974 /nfs/dbraw/zinc/63/79/74/941637974.db2.gz WOMMTAIAUREKQS-UHFFFAOYSA-N 0 0 359.313 3.544 20 5 FHBDRN CCOCc1ccc(NC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000549210984 941646720 /nfs/dbraw/zinc/64/67/20/941646720.db2.gz UXJOSBIGZJFOEV-UHFFFAOYSA-N 0 0 357.410 3.838 20 5 FHBDRN CN(Cc1c(F)cccc1F)c1ncc(Br)cc1[N+](=O)[O-] ZINC000549223594 941674606 /nfs/dbraw/zinc/67/46/06/941674606.db2.gz ZQMGYQBTEZPWMG-UHFFFAOYSA-N 0 0 358.142 3.667 20 5 FHBDRN COc1ccc(C(=O)Nc2ccc(OC(F)(F)F)cc2)cc1[N+](=O)[O-] ZINC000005671856 941683254 /nfs/dbraw/zinc/68/32/54/941683254.db2.gz CATPLMYKAWRFAK-UHFFFAOYSA-N 0 0 356.256 3.754 20 5 FHBDRN Cc1c(CN2CCN(c3cncc4ccccc43)CC2)cccc1[N+](=O)[O-] ZINC000472752662 941683634 /nfs/dbraw/zinc/68/36/34/941683634.db2.gz PWDYYXKTQLDHGV-UHFFFAOYSA-N 0 0 362.433 3.774 20 5 FHBDRN COc1nc(C)ccc1C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000541129710 941684201 /nfs/dbraw/zinc/68/42/01/941684201.db2.gz RQCYXJQWFBQOBC-UHFFFAOYSA-N 0 0 355.272 3.578 20 5 FHBDRN COC(=O)c1ccccc1C(=O)c1ccc(NCC[C@H](C)F)c([N+](=O)[O-])c1 ZINC000549233175 941686449 /nfs/dbraw/zinc/68/64/49/941686449.db2.gz UQCCVHGZOSYEAS-LBPRGKRZSA-N 0 0 374.368 3.772 20 5 FHBDRN CN(C)C(=O)Sc1ccc(NC(=O)c2ccc([N+](=O)[O-])s2)cc1 ZINC000729271794 941704184 /nfs/dbraw/zinc/70/41/84/941704184.db2.gz YPFNDCWSANOUNH-UHFFFAOYSA-N 0 0 351.409 3.682 20 5 FHBDRN Cc1cc(NC(=O)Cc2ccccc2[N+](=O)[O-])n(-c2ccccc2C)n1 ZINC000122401025 941713562 /nfs/dbraw/zinc/71/35/62/941713562.db2.gz PLEOOSFRYPLNLF-UHFFFAOYSA-N 0 0 350.378 3.579 20 5 FHBDRN C[C@H]1CCc2ccccc2N1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000072553836 941716862 /nfs/dbraw/zinc/71/68/62/941716862.db2.gz SMALFMMFNZMMLW-ZDUSSCGKSA-N 0 0 350.378 3.986 20 5 FHBDRN Cc1cc(C(=O)N2CCC(c3c[nH]c4ncccc34)CC2)ccc1[N+](=O)[O-] ZINC000377433342 941720639 /nfs/dbraw/zinc/72/06/39/941720639.db2.gz SGFSQGFPVGOORB-UHFFFAOYSA-N 0 0 364.405 3.799 20 5 FHBDRN Cc1cccc(C)c1CNC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000122407616 941721624 /nfs/dbraw/zinc/72/16/24/941721624.db2.gz WZVPXEFQQMLFKN-UHFFFAOYSA-N 0 0 364.405 3.542 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1-c1noc([C@@H]2Cc3ccc(F)cc3C(=O)O2)n1 ZINC000377436737 941722550 /nfs/dbraw/zinc/72/25/50/941722550.db2.gz SACZEROEAFCDIN-HNNXBMFYSA-N 0 0 369.308 3.547 20 5 FHBDRN O=C(Nc1cccc2[nH]cnc21)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000123330090 941728996 /nfs/dbraw/zinc/72/89/96/941728996.db2.gz GHRAPWDBCRARAD-UHFFFAOYSA-N 0 0 350.256 3.742 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1OC(F)F)N1CCS[C@@H]2CCCC[C@H]21 ZINC000182341255 941737994 /nfs/dbraw/zinc/73/79/94/941737994.db2.gz YBVXPWAVXIVJPV-TZMCWYRMSA-N 0 0 372.393 3.696 20 5 FHBDRN COc1cc(Cl)ccc1CNC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412099961 941740532 /nfs/dbraw/zinc/74/05/32/941740532.db2.gz IBWIRBUWSSORSQ-JKSUJKDBSA-N 0 0 360.797 3.677 20 5 FHBDRN CC(C)(C)OC(=O)Nc1ccc(NC(=O)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000729401352 941746209 /nfs/dbraw/zinc/74/62/09/941746209.db2.gz ORUALHALNZJDMS-UHFFFAOYSA-N 0 0 372.381 3.776 20 5 FHBDRN COc1cccc(C2(NC(=O)[C@H](C)Sc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000122445945 941748627 /nfs/dbraw/zinc/74/86/27/941748627.db2.gz WKAKYIDGYBVHRO-ZDUSSCGKSA-N 0 0 372.446 3.890 20 5 FHBDRN Cn1c(=O)c2ccsc2nc1Sc1nc2ccccc2cc1[N+](=O)[O-] ZINC000473522271 941756422 /nfs/dbraw/zinc/75/64/22/941756422.db2.gz QFRZQYIGTKFIRP-UHFFFAOYSA-N 0 0 370.415 3.603 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NCc1cc(F)c(Cl)cc1F ZINC000433559884 941758403 /nfs/dbraw/zinc/75/84/03/941758403.db2.gz VETQNWYWUJFHDP-UHFFFAOYSA-N 0 0 371.727 3.857 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(NC(=O)OC(C)(C)C)nc2)c1 ZINC000266014193 941759645 /nfs/dbraw/zinc/75/96/45/941759645.db2.gz IPAQYDKRSPZQTE-UHFFFAOYSA-N 0 0 372.381 3.898 20 5 FHBDRN C[C@H]1COC[C@H](c2ccccc2)N1C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000415363205 941776014 /nfs/dbraw/zinc/77/60/14/941776014.db2.gz RFYUKMKYNYORML-VVHHDAOASA-N 0 0 366.417 3.687 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)NCc2cccc(C)c2Br)c1 ZINC000470313189 941784241 /nfs/dbraw/zinc/78/42/41/941784241.db2.gz LJEZMLLFORQFLO-UHFFFAOYSA-N 0 0 363.211 3.904 20 5 FHBDRN C[C@H]1CCSCCN1C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000190064206 941803106 /nfs/dbraw/zinc/80/31/06/941803106.db2.gz YKHXBTHMCVUJCJ-JTQLQIEISA-N 0 0 360.888 3.694 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)Nc1nc2ccc(F)cc2n1C ZINC000464434353 941804245 /nfs/dbraw/zinc/80/42/45/941804245.db2.gz SWNIFJKLFPYDIP-UHFFFAOYSA-N 0 0 356.357 3.798 20 5 FHBDRN C/C(=C\c1cccc([N+](=O)[O-])c1)CNc1ccc2c(c1)C(=O)N(C)CC2 ZINC000468602721 941811119 /nfs/dbraw/zinc/81/11/19/941811119.db2.gz YXDOPNQTIFIPGD-GXDHUFHOSA-N 0 0 351.406 3.738 20 5 FHBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)NCc1ccc(Cl)o1 ZINC000644488046 941811813 /nfs/dbraw/zinc/81/18/13/941811813.db2.gz OOVFYPLRKJVDGW-UHFFFAOYSA-N 0 0 366.804 3.718 20 5 FHBDRN C[C@H](Sc1ccc(N)cc1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000513260041 941814243 /nfs/dbraw/zinc/81/42/43/941814243.db2.gz CXCUCFQLUYNLCX-VIFPVBQESA-N 0 0 351.815 3.950 20 5 FHBDRN CN(C[C@H]1CCC[C@@H]1O)C(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 ZINC000129332067 941816508 /nfs/dbraw/zinc/81/65/08/941816508.db2.gz CVDKRCAXAXULDA-KDOFPFPSSA-N 0 0 370.405 3.620 20 5 FHBDRN CCOc1ccc(SCC(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)cc1 ZINC000122588763 941823454 /nfs/dbraw/zinc/82/34/54/941823454.db2.gz PSPGAZBTAJPMMT-UHFFFAOYSA-N 0 0 372.406 3.601 20 5 FHBDRN COc1ccc(NC(=O)CN2C[C@H](C)C[C@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000513277450 941826910 /nfs/dbraw/zinc/82/69/10/941826910.db2.gz YCHKSOCQJOHJCD-KDOFPFPSSA-N 0 0 369.421 3.625 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N(C)[C@@H](C)c2c(F)cccc2F)c1[N+](=O)[O-] ZINC000433675250 941829468 /nfs/dbraw/zinc/82/94/68/941829468.db2.gz PERRUXOHZWJLAW-VIFPVBQESA-N 0 0 352.341 3.553 20 5 FHBDRN O=[N+]([O-])c1cc(CNCc2c(F)ccc(O)c2F)cc(C(F)(F)F)c1 ZINC000513290573 941831713 /nfs/dbraw/zinc/83/17/13/941831713.db2.gz ATUDOZIQUQHJGT-UHFFFAOYSA-N 0 0 362.254 3.887 20 5 FHBDRN C[C@H](C(=O)N(C)CCc1cccc([N+](=O)[O-])c1)[C@H]1OCCc2sccc21 ZINC000513304351 941836851 /nfs/dbraw/zinc/83/68/51/941836851.db2.gz XGHKETZHTNOPBR-SCLBCKFNSA-N 0 0 374.462 3.607 20 5 FHBDRN O=C(NC[C@@H]1CCO[C@H]1c1ccccc1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412142602 941840737 /nfs/dbraw/zinc/84/07/37/941840737.db2.gz YEWQZNIBTJTHRJ-FFGOWVMKSA-N 0 0 366.417 3.592 20 5 FHBDRN CC1(C)C[C@@H](C(=O)NCCc2ccccc2[N+](=O)[O-])c2ccccc2O1 ZINC000412144687 941841215 /nfs/dbraw/zinc/84/12/15/941841215.db2.gz LPXNQCDNSMZBKN-MRXNPFEDSA-N 0 0 354.406 3.598 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N[C@@H](C)c2ccc(C(F)(F)F)cc2)c1[N+](=O)[O-] ZINC000433688752 941841941 /nfs/dbraw/zinc/84/19/41/941841941.db2.gz LRTHUNUCDMLBEN-VIFPVBQESA-N 0 0 370.331 3.951 20 5 FHBDRN Cc1oc(C2CC2)nc1C(=O)N1CCS[C@@H]1c1ccc([N+](=O)[O-])cc1 ZINC000513317829 941851841 /nfs/dbraw/zinc/85/18/41/941851841.db2.gz PEYGWLQDTPIOBM-QGZVFWFLSA-N 0 0 359.407 3.656 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)Nc2ncc(C(C)C)s2)c1F ZINC000412151582 941852062 /nfs/dbraw/zinc/85/20/62/941852062.db2.gz YZKYDRPRTDYPDU-UHFFFAOYSA-N 0 0 353.375 3.504 20 5 FHBDRN COC(=O)c1cc(NC(=O)c2ccc3nc(C)sc3c2)cc([N+](=O)[O-])c1 ZINC000431846816 941852562 /nfs/dbraw/zinc/85/25/62/941852562.db2.gz JXMFKYAKANBFKW-UHFFFAOYSA-N 0 0 371.374 3.552 20 5 FHBDRN C[C@H](CNC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)Oc1ccccc1Cl ZINC000412156615 941852978 /nfs/dbraw/zinc/85/29/78/941852978.db2.gz ZWTVVWBVPMMXOU-UHOFOFEASA-N 0 0 374.824 3.935 20 5 FHBDRN COc1ccc(-c2ccc(C)c(NC(=O)c3ccc([N+](=O)[O-])[nH]3)c2)cn1 ZINC000513339949 941853521 /nfs/dbraw/zinc/85/35/21/941853521.db2.gz XGJLOMZIFMYRAT-UHFFFAOYSA-N 0 0 352.350 3.554 20 5 FHBDRN Cc1nc2ccc(C(=O)Nc3ccc4cc([N+](=O)[O-])ccc4n3)cc2s1 ZINC000431846603 941855477 /nfs/dbraw/zinc/85/54/77/941855477.db2.gz SMEUEERLRJFIKX-UHFFFAOYSA-N 0 0 364.386 3.735 20 5 FHBDRN CN(Cc1cscc1Br)C(=O)c1csc([N+](=O)[O-])c1 ZINC000710008332 941861136 /nfs/dbraw/zinc/86/11/36/941861136.db2.gz RZICRHHCWVJSHU-UHFFFAOYSA-N 0 0 361.242 3.753 20 5 FHBDRN Cc1ccccc1C[C@@H]1CCCN1C(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-] ZINC000433745580 941862400 /nfs/dbraw/zinc/86/24/00/941862400.db2.gz SCXTXKGCNKWVJE-HNNXBMFYSA-N 0 0 356.426 3.597 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(C(F)(F)F)nc2)c1 ZINC000549294693 941867205 /nfs/dbraw/zinc/86/72/05/941867205.db2.gz GPTODYAWNXDYIX-UHFFFAOYSA-N 0 0 355.272 3.660 20 5 FHBDRN CC[C@H](NCc1ccc(O)c(OC)c1[N+](=O)[O-])c1ccc(F)cc1F ZINC000893001255 941870720 /nfs/dbraw/zinc/87/07/20/941870720.db2.gz KYERXRFXFSPLJI-AWEZNQCLSA-N 0 0 352.337 3.828 20 5 FHBDRN COc1c(C)cnc(CN(C)c2ccc3cc([N+](=O)[O-])ccc3n2)c1C ZINC000433770024 941876247 /nfs/dbraw/zinc/87/62/47/941876247.db2.gz AJQRAYGOMDDZFD-UHFFFAOYSA-N 0 0 352.394 3.800 20 5 FHBDRN O=C1[C@H](Nc2cc([N+](=O)[O-])ccc2Nc2ccccc2)CCN1C1CC1 ZINC000433761433 941880187 /nfs/dbraw/zinc/88/01/87/941880187.db2.gz BEJQICUJVYHBIZ-QGZVFWFLSA-N 0 0 352.394 3.514 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N[C@H]2CCC[C@H]2Cc2ccccc2)c1[N+](=O)[O-] ZINC000433763962 941881342 /nfs/dbraw/zinc/88/13/42/941881342.db2.gz FMSZYHQLNVVUGB-GJZGRUSLSA-N 0 0 356.426 3.583 20 5 FHBDRN COc1cccc2c1CC[C@H]2NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412183586 941882366 /nfs/dbraw/zinc/88/23/66/941882366.db2.gz ICODMQMZJQFULD-RCCFBDPRSA-N 0 0 352.390 3.511 20 5 FHBDRN CC(C)Oc1cc(C(=O)NCc2nc(C3CC3)cs2)ccc1[N+](=O)[O-] ZINC000412187811 941887499 /nfs/dbraw/zinc/88/74/99/941887499.db2.gz ASCDVKFYZJDRPO-UHFFFAOYSA-N 0 0 361.423 3.646 20 5 FHBDRN CC[C@@H]1CCC[C@H]1c1nc(-c2ccc(-n3cncn3)c([N+](=O)[O-])c2)no1 ZINC000453204701 941890961 /nfs/dbraw/zinc/89/09/61/941890961.db2.gz WGUHFCDSZSIPDX-DGCLKSJQSA-N 0 0 354.370 3.519 20 5 FHBDRN Cc1c(C(=O)N[C@@H]2CCC[C@@H]2OCc2ccccc2)cccc1[N+](=O)[O-] ZINC000119637954 941892117 /nfs/dbraw/zinc/89/21/17/941892117.db2.gz BWKMBBMTAHGUNA-MJGOQNOKSA-N 0 0 354.406 3.771 20 5 FHBDRN CO[C@@H]1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2NCc2ccccc2)C1 ZINC000472832160 941895044 /nfs/dbraw/zinc/89/50/44/941895044.db2.gz ZVGVDDZMRHALRJ-NVXWUHKLSA-N 0 0 369.421 3.504 20 5 FHBDRN O=[N+]([O-])c1cc(-c2noc(CCCC3CCCC3)n2)ccc1-n1cncn1 ZINC000453202866 941896183 /nfs/dbraw/zinc/89/61/83/941896183.db2.gz UNKRMVAWMFJMLT-UHFFFAOYSA-N 0 0 368.397 3.738 20 5 FHBDRN CCc1cccc(C)c1NC(=O)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000103463361 941898024 /nfs/dbraw/zinc/89/80/24/941898024.db2.gz JQXBAAFOQPTXCS-UHFFFAOYSA-N 0 0 364.405 3.968 20 5 FHBDRN Cc1ccc([C@H]2C[C@@H](C)CCN2S(=O)(=O)c2csc([N+](=O)[O-])c2)o1 ZINC000119898670 941905860 /nfs/dbraw/zinc/90/58/60/941905860.db2.gz URFJVRSNFNYTRO-GXFFZTMASA-N 0 0 370.452 3.720 20 5 FHBDRN COC(=O)c1cc(NC(=O)CSc2ccccc2[N+](=O)[O-])c(C)cc1C ZINC000472838951 941914158 /nfs/dbraw/zinc/91/41/58/941914158.db2.gz XHJIIYHUGNNQIA-UHFFFAOYSA-N 0 0 374.418 3.729 20 5 FHBDRN CC(C)c1[nH]nc(C(=O)Nc2ncc(-c3ccccc3)s2)c1[N+](=O)[O-] ZINC000433826381 941923200 /nfs/dbraw/zinc/92/32/00/941923200.db2.gz OBNAXMADKVLGLM-UHFFFAOYSA-N 0 0 357.395 3.817 20 5 FHBDRN O=C(N[C@H]1CCO[C@@H]1c1ccc(Cl)cc1)c1csc([N+](=O)[O-])c1 ZINC000182443847 941925367 /nfs/dbraw/zinc/92/53/67/941925367.db2.gz FCGADUHUNPIHNH-GXTWGEPZSA-N 0 0 352.799 3.570 20 5 FHBDRN O=C(N[C@H]1CCO[C@H]1c1ccc(Cl)cc1)c1ccc([N+](=O)[O-])cc1F ZINC000182456431 941926420 /nfs/dbraw/zinc/92/64/20/941926420.db2.gz XSBFTIQPACWEMN-HOTGVXAUSA-N 0 0 364.760 3.647 20 5 FHBDRN CC(C)Oc1cc(C(=O)N(C)[C@H](CCO)c2ccccc2)ccc1[N+](=O)[O-] ZINC000412219179 941927186 /nfs/dbraw/zinc/92/71/86/941927186.db2.gz AQQFCULSCCFHCK-QGZVFWFLSA-N 0 0 372.421 3.578 20 5 FHBDRN O=C(c1ccccc1)N1CCC(Nc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000182412854 941931125 /nfs/dbraw/zinc/93/11/25/941931125.db2.gz JXLFARJSSONHRO-UHFFFAOYSA-N 0 0 359.813 3.965 20 5 FHBDRN CCc1cc(N[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)ccc1C ZINC000182482789 941933842 /nfs/dbraw/zinc/93/38/42/941933842.db2.gz MLQYJEVHEXHKBE-CYBMUJFWSA-N 0 0 357.410 3.913 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H]1CCO[C@@H]1c1ccc(Cl)cc1 ZINC000182485207 941934413 /nfs/dbraw/zinc/93/44/13/941934413.db2.gz RUEROVZOWQDWNQ-IAGOWNOFSA-N 0 0 360.797 3.817 20 5 FHBDRN C[C@H]1CC(CCNC(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)C[C@H](C)O1 ZINC000513457219 941934935 /nfs/dbraw/zinc/93/49/35/941934935.db2.gz VOMMIQRAYXNXHT-QWRGUYRKSA-N 0 0 374.359 3.937 20 5 FHBDRN CCOc1ccc([C@@H]2CCCN2C(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])cc1 ZINC000433840141 941937170 /nfs/dbraw/zinc/93/71/70/941937170.db2.gz CGYJFUBYCPWCDD-HNNXBMFYSA-N 0 0 372.425 3.817 20 5 FHBDRN Cc1c(NC(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)cnn1CC(C)C ZINC000412221521 941938025 /nfs/dbraw/zinc/93/80/25/941938025.db2.gz DVZJGJYQZGFSKM-UHFFFAOYSA-N 0 0 360.414 3.795 20 5 FHBDRN CO[C@H](c1ccccc1F)[C@H](C)NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412229618 941942531 /nfs/dbraw/zinc/94/25/31/941942531.db2.gz HVAHYXJTFVCDJL-CTSOBWNQSA-N 0 0 372.396 3.730 20 5 FHBDRN CN(C)c1ccccc1NC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000182586564 941945790 /nfs/dbraw/zinc/94/57/90/941945790.db2.gz FJYSIFCOVWLZIF-UHFFFAOYSA-N 0 0 351.309 3.515 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N2CCC(=Cc3cccc(F)c3)CC2)c1[N+](=O)[O-] ZINC000433847847 941947366 /nfs/dbraw/zinc/94/73/66/941947366.db2.gz TYUOUNXHXWKSPU-UHFFFAOYSA-N 0 0 372.400 3.900 20 5 FHBDRN Cc1nc(CN2CCN([C@@H](C)c3cc([N+](=O)[O-])ccc3C)CC2)cs1 ZINC000182616348 941947599 /nfs/dbraw/zinc/94/75/99/941947599.db2.gz GFVOILKVDIXALB-AWEZNQCLSA-N 0 0 360.483 3.547 20 5 FHBDRN CO[C@H](CC(C)C)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000415618663 941954830 /nfs/dbraw/zinc/95/48/30/941954830.db2.gz XDJUYYRXBOQRMX-CYBMUJFWSA-N 0 0 359.220 3.665 20 5 FHBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)NCCSCc1ccccc1F ZINC000101348806 941957453 /nfs/dbraw/zinc/95/74/53/941957453.db2.gz CAEZANOWSYQSMY-YFHOEESVSA-N 0 0 360.410 3.797 20 5 FHBDRN CCC[C@@H]1C[C@H](C(=O)Nc2cc(C)nn2-c2ccc([N+](=O)[O-])cc2)CCO1 ZINC000182773887 941959396 /nfs/dbraw/zinc/95/93/96/941959396.db2.gz IVCBMERWXGBDCS-RHSMWYFYSA-N 0 0 372.425 3.623 20 5 FHBDRN Cc1cc(NC(=O)N2C[C@H](C)O[C@@H](c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000182765083 941966230 /nfs/dbraw/zinc/96/62/30/941966230.db2.gz IJECKKOFEAGIML-KBXCAEBGSA-N 0 0 355.394 3.897 20 5 FHBDRN COc1cc(CN(C(=O)Nc2ccc([N+](=O)[O-])c(C)c2)C2CC2)ccc1O ZINC000182768842 941966942 /nfs/dbraw/zinc/96/69/42/941966942.db2.gz OIFYUMRAKKIXAR-UHFFFAOYSA-N 0 0 371.393 3.814 20 5 FHBDRN CC[C@H](NC(=O)Nc1cccc([N+](=O)[O-])c1)c1ccc(OC)c(OC)c1 ZINC000513516203 941976584 /nfs/dbraw/zinc/97/65/84/941976584.db2.gz UCATZVCBDBYLDY-HNNXBMFYSA-N 0 0 359.382 3.885 20 5 FHBDRN Cc1ccc(C(=O)N2CCCC[C@@H]2c2noc(C3CC3)n2)cc1[N+](=O)[O-] ZINC000377792367 941992259 /nfs/dbraw/zinc/99/22/59/941992259.db2.gz XQZGVISXAJLWFU-CQSZACIVSA-N 0 0 356.382 3.531 20 5 FHBDRN COc1cc(C(=O)Nc2cc(-c3ccc(C)s3)[nH]n2)ccc1[N+](=O)[O-] ZINC000101668667 942003684 /nfs/dbraw/zinc/00/36/84/942003684.db2.gz HKHWJNMQPOBLNT-UHFFFAOYSA-N 0 0 358.379 3.616 20 5 FHBDRN O=C(NCc1nccn1-c1ccccc1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000513554171 942009657 /nfs/dbraw/zinc/00/96/57/942009657.db2.gz NTICINVFLAIXLC-UHFFFAOYSA-N 0 0 371.784 3.756 20 5 FHBDRN CSc1cccc(N(C)S(=O)(=O)c2cc(C)c(C)cc2[N+](=O)[O-])c1 ZINC000101849639 942014652 /nfs/dbraw/zinc/01/46/52/942014652.db2.gz UVISNZKXSBEBAU-UHFFFAOYSA-N 0 0 366.464 3.759 20 5 FHBDRN COc1cccc(C2(NC(=O)CCCNc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000122656636 942015843 /nfs/dbraw/zinc/01/58/43/942015843.db2.gz DHKFORBFEUOFFF-UHFFFAOYSA-N 0 0 369.421 3.601 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCC(=O)N(C)[C@H]2CCCc3ccccc32)c1 ZINC000024542755 942017677 /nfs/dbraw/zinc/01/76/77/942017677.db2.gz KAQUBVFACSZANS-KRWDZBQOSA-N 0 0 354.406 3.818 20 5 FHBDRN Cc1c(NC(=O)N2CCCN3c4ccccc4C[C@H]3C2)cccc1[N+](=O)[O-] ZINC000290344276 942019841 /nfs/dbraw/zinc/01/98/41/942019841.db2.gz ILEJJVFUZKNXIQ-INIZCTEOSA-N 0 0 366.421 3.572 20 5 FHBDRN C[C@H](c1cccc([N+](=O)[O-])c1)N1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1 ZINC000101921562 942020356 /nfs/dbraw/zinc/02/03/56/942020356.db2.gz KJYFOGPOLWOWSO-DYVFJYSZSA-N 0 0 372.400 3.691 20 5 FHBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NC1CCC2(CC2)CC1 ZINC000434007782 942037107 /nfs/dbraw/zinc/03/71/07/942037107.db2.gz JDWKSNSTEOTFEB-LLVKDONJSA-N 0 0 352.818 3.855 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)NC[C@@H]2CCC[C@@H](C(F)(F)F)C2)c1[N+](=O)[O-] ZINC000434012386 942039021 /nfs/dbraw/zinc/03/90/21/942039021.db2.gz OMXMHEXHROYXMH-NXEZZACHSA-N 0 0 362.352 3.540 20 5 FHBDRN Cc1cc(C)cc(CN(C)C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)c1 ZINC000434014442 942040169 /nfs/dbraw/zinc/04/01/69/942040169.db2.gz XFSIZLDEQNETGI-UHFFFAOYSA-N 0 0 364.405 3.670 20 5 FHBDRN CCCCOc1cccc(NC(=O)CCn2nc(C)c([N+](=O)[O-])c2C)c1 ZINC000102237840 942047281 /nfs/dbraw/zinc/04/72/81/942047281.db2.gz QRWGKZCTPQIPFP-UHFFFAOYSA-N 0 0 360.414 3.616 20 5 FHBDRN CCCCc1cnc(NC(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)nc1 ZINC000415789613 942049659 /nfs/dbraw/zinc/04/96/59/942049659.db2.gz SNLPUOMPWBFDTK-UHFFFAOYSA-N 0 0 358.398 3.767 20 5 FHBDRN O=C(COc1ccccc1[N+](=O)[O-])N1CC2(CCCC2)c2ccccc21 ZINC000434025152 942052354 /nfs/dbraw/zinc/05/23/54/942052354.db2.gz KTFVNWORLJWEEF-UHFFFAOYSA-N 0 0 352.390 3.832 20 5 FHBDRN O=C(c1cc2c(s1)CCOC2)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000163807412 942054422 /nfs/dbraw/zinc/05/44/22/942054422.db2.gz HQYLARINCAMXAH-UHFFFAOYSA-N 0 0 358.419 3.534 20 5 FHBDRN Cc1ncc(C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc23)c(Cl)c1Cl ZINC000122684174 942055131 /nfs/dbraw/zinc/05/51/31/942055131.db2.gz ICUCHHADVJCJDS-UHFFFAOYSA-N 0 0 366.164 3.734 20 5 FHBDRN COc1ccccc1CC1CCN(C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 ZINC000102379127 942056991 /nfs/dbraw/zinc/05/69/91/942056991.db2.gz OMVBZOCSBPEPRJ-UHFFFAOYSA-N 0 0 372.396 3.837 20 5 FHBDRN CSc1ccc(CNC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)cc1 ZINC000513654673 942058239 /nfs/dbraw/zinc/05/82/39/942058239.db2.gz XAGKFPFPBOUUJX-UHFFFAOYSA-N 0 0 368.361 3.848 20 5 FHBDRN Cn1ccnc1[C@@H](NCc1cccc(Cl)c1)c1cccc([N+](=O)[O-])c1 ZINC000513656825 942059372 /nfs/dbraw/zinc/05/93/72/942059372.db2.gz XXGKOTZVBWRKES-KRWDZBQOSA-N 0 0 356.813 3.861 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)NCCOCc1ccc(Cl)cc1 ZINC000513659975 942060802 /nfs/dbraw/zinc/06/08/02/942060802.db2.gz ISSDJFUPKURMKJ-UHFFFAOYSA-N 0 0 363.801 3.895 20 5 FHBDRN CC(C)(C(=O)N1CCC(F)(c2cccnc2)CC1)c1ccccc1[N+](=O)[O-] ZINC000513647085 942063460 /nfs/dbraw/zinc/06/34/60/942063460.db2.gz FRKKIXWDYORMTA-UHFFFAOYSA-N 0 0 371.412 3.755 20 5 FHBDRN COc1cccc(C(C)(C)CNC(=O)CSc2ccccc2[N+](=O)[O-])c1 ZINC000122693533 942065999 /nfs/dbraw/zinc/06/59/99/942065999.db2.gz FDYZPQSXPYHSJK-UHFFFAOYSA-N 0 0 374.462 3.790 20 5 FHBDRN Cc1ccc2c(c1)CN(C(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-])C(C)(C)C2 ZINC000513674928 942068607 /nfs/dbraw/zinc/06/86/07/942068607.db2.gz MGNHVTRPYNHBAE-UHFFFAOYSA-N 0 0 356.426 3.727 20 5 FHBDRN CCN(C(=O)COc1ccc(F)cc1[N+](=O)[O-])[C@H](C)c1ccc(F)cc1 ZINC000102599517 942072755 /nfs/dbraw/zinc/07/27/55/942072755.db2.gz UUWCGLRCWAEVOK-GFCCVEGCSA-N 0 0 364.348 3.862 20 5 FHBDRN Cc1cccc(O)c1NC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000183051453 942073201 /nfs/dbraw/zinc/07/32/01/942073201.db2.gz BJMBPOIRDNGVBS-UHFFFAOYSA-N 0 0 350.758 3.670 20 5 FHBDRN Cc1ccc2c(c1)CN(C(=O)Cc1ccc([N+](=O)[O-])cc1F)C(C)(C)C2 ZINC000513683779 942075538 /nfs/dbraw/zinc/07/55/38/942075538.db2.gz CFDVKCQBCAYNLJ-UHFFFAOYSA-N 0 0 356.397 3.948 20 5 FHBDRN O=C(N[C@@H]1CCCc2c(O)cccc21)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412294093 942077137 /nfs/dbraw/zinc/07/71/37/942077137.db2.gz UABPGADYZRSYAY-RCCFBDPRSA-N 0 0 352.390 3.598 20 5 FHBDRN CCC1(O)CCN(C(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)CC1 ZINC000266100805 942082059 /nfs/dbraw/zinc/08/20/59/942082059.db2.gz FSQUFQWTAMCBIF-UHFFFAOYSA-N 0 0 370.405 3.764 20 5 FHBDRN CC(C)(C)OC(=O)[C@]1(C)CCN(c2ccc3ncccc3c2[N+](=O)[O-])C1 ZINC000413352353 942083610 /nfs/dbraw/zinc/08/36/10/942083610.db2.gz CNFHNSKBNBVVPW-LJQANCHMSA-N 0 0 357.410 3.701 20 5 FHBDRN CC(C)(C)OC(=O)[C@@]1(C)CCN(c2nccc3cc([N+](=O)[O-])ccc32)C1 ZINC000413352622 942083726 /nfs/dbraw/zinc/08/37/26/942083726.db2.gz CYAYBIAEVDXPTE-IBGZPJMESA-N 0 0 357.410 3.701 20 5 FHBDRN O=C(N[C@H]1C[C@H]1c1cccc(F)c1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513723566 942083943 /nfs/dbraw/zinc/08/39/43/942083943.db2.gz FSWPOVPSSTXTRI-STQMWFEESA-N 0 0 366.295 3.621 20 5 FHBDRN O=C(NCCCOC1CCCC1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000128369921 942093073 /nfs/dbraw/zinc/09/30/73/942093073.db2.gz IYFSKIDWCAYJKJ-UHFFFAOYSA-N 0 0 360.332 3.693 20 5 FHBDRN CN(Cc1nc(C2(c3ccccc3F)CC2)no1)c1ccccc1[N+](=O)[O-] ZINC000420531480 942094909 /nfs/dbraw/zinc/09/49/09/942094909.db2.gz SLEBJHLVYHKEBD-UHFFFAOYSA-N 0 0 368.368 3.833 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)Nc1ccc2c(c1)CCCN2 ZINC000415874434 942097486 /nfs/dbraw/zinc/09/74/86/942097486.db2.gz XAFMLQNQONBZEM-UHFFFAOYSA-N 0 0 354.410 3.659 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)NC(C)(C)Cc2ccccc2C)c1F ZINC000413364065 942099043 /nfs/dbraw/zinc/09/90/43/942099043.db2.gz QPAFMDRIXBRTLW-UHFFFAOYSA-N 0 0 374.412 3.731 20 5 FHBDRN Cc1cc(C)n(-c2ccc(CC(=O)Oc3c(C)cccc3[N+](=O)[O-])cc2)n1 ZINC000760015660 942102676 /nfs/dbraw/zinc/10/26/76/942102676.db2.gz GOBPWITUBNMTOW-UHFFFAOYSA-N 0 0 365.389 3.854 20 5 FHBDRN Cc1nc(N2CCCC[C@H]2c2nc3cc(Cl)ccc3[nH]2)ncc1[N+](=O)[O-] ZINC000413370363 942109340 /nfs/dbraw/zinc/10/93/40/942109340.db2.gz CLWDZZKLXYRMDD-AWEZNQCLSA-N 0 0 372.816 3.955 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CCC(c3ccncc3)CC2)ccc1[N+](=O)[O-] ZINC000412308420 942112946 /nfs/dbraw/zinc/11/29/46/942112946.db2.gz UDFJPCZTTYHVBM-UHFFFAOYSA-N 0 0 369.421 3.797 20 5 FHBDRN Cc1ccc(C(=O)NCCOc2ccc(C(F)(F)F)cc2)cc1[N+](=O)[O-] ZINC000501931936 942116575 /nfs/dbraw/zinc/11/65/75/942116575.db2.gz XVTSGIUOKHNSTC-UHFFFAOYSA-N 0 0 368.311 3.731 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCO[C@@H](C2CC2)C1 ZINC000122728422 942117464 /nfs/dbraw/zinc/11/74/64/942117464.db2.gz VZZWFMBBGWGRPS-CZUORRHYSA-N 0 0 364.467 3.784 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N(c2ccccc2)[C@@H]2C[C@@H]2C)c1F ZINC000415893465 942121459 /nfs/dbraw/zinc/12/14/59/942121459.db2.gz PIZAREXRKHWEPA-BLLLJJGKSA-N 0 0 358.369 3.727 20 5 FHBDRN COc1cc(C(=O)N[C@@H](C)[C@@H](C)c2ccccc2)cc([N+](=O)[O-])c1OC ZINC000473541651 942129962 /nfs/dbraw/zinc/12/99/62/942129962.db2.gz PQQDNORRNXHZDY-OLZOCXBDSA-N 0 0 358.394 3.534 20 5 FHBDRN CC(C)n1ncc2cc(NC(=O)/C=C/c3ccc([N+](=O)[O-])cc3)cnc21 ZINC000016106400 942134164 /nfs/dbraw/zinc/13/41/64/942134164.db2.gz OJPXHQFMBPAOLX-VMPITWQZSA-N 0 0 351.366 3.572 20 5 FHBDRN CO[C@](C)([C@H](C)NC(=O)c1c([N+](=O)[O-])cccc1C(F)(F)F)C1CC1 ZINC000415914545 942139395 /nfs/dbraw/zinc/13/93/95/942139395.db2.gz AXXQLCGQDNXJSK-BJOHPYRUSA-N 0 0 360.332 3.547 20 5 FHBDRN O=[N+]([O-])c1cnc(NC[C@H]2CC23CCSCC3)c(Br)c1 ZINC000420651281 942143068 /nfs/dbraw/zinc/14/30/68/942143068.db2.gz JIRYHOBNPIFJFF-SECBINFHSA-N 0 0 358.261 3.698 20 5 FHBDRN COc1ccc(Cl)cc1CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000110222141 942147210 /nfs/dbraw/zinc/14/72/10/942147210.db2.gz WQSKGXRCRTZCTI-UHFFFAOYSA-N 0 0 355.177 3.840 20 5 FHBDRN C[C@H](Nc1ccc([N+](=O)[O-])cc1Br)[C@@H](O)Cc1ccccc1 ZINC000501982438 942151928 /nfs/dbraw/zinc/15/19/28/942151928.db2.gz KOORHONBRBJSRH-ZBEGNZNMSA-N 0 0 365.227 3.761 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)Nc2cccc(N3CCC3=O)c2)cc1[N+](=O)[O-] ZINC000280300257 942155048 /nfs/dbraw/zinc/15/50/48/942155048.db2.gz XAMSWMCAHGOTCN-ZDUSSCGKSA-N 0 0 368.393 3.523 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)NCCCc1c[nH]c2ccc(F)cc12 ZINC000501973265 942156506 /nfs/dbraw/zinc/15/65/06/942156506.db2.gz FIHVSLVXBHUWGB-UHFFFAOYSA-N 0 0 355.369 3.886 20 5 FHBDRN C[C@H](NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)c1ccc(F)c(F)c1 ZINC000513725938 942156518 /nfs/dbraw/zinc/15/65/18/942156518.db2.gz SWJGLOUNLRWBED-QMMMGPOBSA-N 0 0 372.274 3.965 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(F)c(F)c2F)cc1SC ZINC000102974509 942163090 /nfs/dbraw/zinc/16/30/90/942163090.db2.gz NEIJUXYTKTTZOB-UHFFFAOYSA-N 0 0 372.324 3.995 20 5 FHBDRN COc1cc(OCC(=O)Nc2ccc(C(C)(C)C)cc2O)ccc1[N+](=O)[O-] ZINC000502010788 942170287 /nfs/dbraw/zinc/17/02/87/942170287.db2.gz UMPWGQQDHVUUNB-UHFFFAOYSA-N 0 0 374.393 3.624 20 5 FHBDRN Cc1nc(C)c(CNC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)s1 ZINC000122747736 942174237 /nfs/dbraw/zinc/17/42/37/942174237.db2.gz FVOZOCNBKRLSDF-UHFFFAOYSA-N 0 0 360.439 3.542 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H](C)c1cccc(F)c1F ZINC000122750393 942177086 /nfs/dbraw/zinc/17/70/86/942177086.db2.gz OSCKXVVXLRITOU-VIFPVBQESA-N 0 0 351.309 3.764 20 5 FHBDRN CCn1ccnc1[C@H]1CCCCN1C(=O)Nc1ccc(C)c([N+](=O)[O-])c1 ZINC000280412461 942178933 /nfs/dbraw/zinc/17/89/33/942178933.db2.gz AYKGRDQBCJKDBP-OAHLLOKOSA-N 0 0 357.414 3.879 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CC[C@@H](O)[C@H](C3CCCC3)C2)cc1OC(F)F ZINC000413440614 942185141 /nfs/dbraw/zinc/18/51/41/942185141.db2.gz AYRWCHYBRQDOTP-DZGCQCFKSA-N 0 0 356.369 3.574 20 5 FHBDRN CN(C(=O)COc1ccc([N+](=O)[O-])cc1)[C@H](c1ccccc1)C(F)(F)F ZINC000103051246 942192257 /nfs/dbraw/zinc/19/22/57/942192257.db2.gz LETFZPYYBMVLNL-MRXNPFEDSA-N 0 0 368.311 3.736 20 5 FHBDRN Cn1ccnc1[C@H]1CCCN1Cc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000366693230 942204937 /nfs/dbraw/zinc/20/49/37/942204937.db2.gz FNIGKTYYYISCPP-CQSZACIVSA-N 0 0 354.332 3.684 20 5 FHBDRN O=[N+]([O-])c1ccc(CN2CCOCC2)cc1N1Cc2ccc(Cl)cc2C1 ZINC000413459899 942214686 /nfs/dbraw/zinc/21/46/86/942214686.db2.gz STTKZTIBPMOOMT-UHFFFAOYSA-N 0 0 373.840 3.601 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(SC)cc2)cc1OC ZINC000016176093 942219358 /nfs/dbraw/zinc/21/93/58/942219358.db2.gz LLKFUGVMTLXIBF-UHFFFAOYSA-N 0 0 362.407 3.976 20 5 FHBDRN COc1cccc([C@@H]2C[C@H]2CNC(=O)NCc2cccc([N+](=O)[O-])c2C)c1 ZINC000413477534 942223374 /nfs/dbraw/zinc/22/33/74/942223374.db2.gz GOXDLEDMCKOGOD-WMZOPIPTSA-N 0 0 369.421 3.515 20 5 FHBDRN Cc1sc(NC(=O)[C@@H]2CCC(=O)C[C@H]2C)nc1-c1cccc([N+](=O)[O-])c1 ZINC000183188466 942223978 /nfs/dbraw/zinc/22/39/78/942223978.db2.gz AOGLGZCLTWMTJQ-MEBBXXQBSA-N 0 0 373.434 3.971 20 5 FHBDRN Cc1cc(C(=O)COc2c(Br)cccc2[N+](=O)[O-])c(C)[nH]1 ZINC000122766486 942225972 /nfs/dbraw/zinc/22/59/72/942225972.db2.gz UKXLUSKZCBKMOZ-UHFFFAOYSA-N 0 0 353.172 3.564 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N2CCc3sccc3[C@H]2C)c1C ZINC000480948459 942227242 /nfs/dbraw/zinc/22/72/42/942227242.db2.gz GHJOKFQCVMTGBD-GFCCVEGCSA-N 0 0 366.464 3.581 20 5 FHBDRN COc1ccccc1[C@@H](NC(=O)c1ccc([N+](=O)[O-])s1)c1ccco1 ZINC000129367365 942229802 /nfs/dbraw/zinc/22/98/02/942229802.db2.gz YFDAFBAHLKLZST-MRXNPFEDSA-N 0 0 358.375 3.777 20 5 FHBDRN Cc1cc(N2CCCc3c(cnn3C)C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000413481646 942236613 /nfs/dbraw/zinc/23/66/13/942236613.db2.gz MNNFYNJQYYIJKY-UHFFFAOYSA-N 0 0 354.332 3.608 20 5 FHBDRN Cc1sc(S(=O)(=O)Oc2cccc3ccc(C)nc32)cc1[N+](=O)[O-] ZINC000122805489 942236940 /nfs/dbraw/zinc/23/69/40/942236940.db2.gz REFWAAUAUCZNOA-UHFFFAOYSA-N 0 0 364.404 3.589 20 5 FHBDRN Cc1c(Br)c(N2CCSC3(CCC3)CC2)ncc1[N+](=O)[O-] ZINC000413483490 942237776 /nfs/dbraw/zinc/23/77/76/942237776.db2.gz RLRCFXOQGVXMSI-UHFFFAOYSA-N 0 0 372.288 3.927 20 5 FHBDRN C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1ccccc1Br ZINC000103376667 942249300 /nfs/dbraw/zinc/24/93/00/942249300.db2.gz ONEYNIPGLVTLDO-SNVBAGLBSA-N 0 0 361.195 3.949 20 5 FHBDRN Cc1sc(S(=O)(=O)N2CCC[C@H]2c2cccs2)cc1[N+](=O)[O-] ZINC000122841869 942251453 /nfs/dbraw/zinc/25/14/53/942251453.db2.gz DVQLOQQCMJLSAV-JTQLQIEISA-N 0 0 358.466 3.552 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@H](c1cccnc1)C(C)C ZINC000122837638 942251694 /nfs/dbraw/zinc/25/16/94/942251694.db2.gz VKESELVTWUVTNN-HNNXBMFYSA-N 0 0 358.398 3.560 20 5 FHBDRN Nc1c(C(=O)Nc2ccc(Cl)c(OC(F)F)c2)cccc1[N+](=O)[O-] ZINC000183202539 942252013 /nfs/dbraw/zinc/25/20/13/942252013.db2.gz RLQXLALHFLLBIJ-UHFFFAOYSA-N 0 0 357.700 3.684 20 5 FHBDRN O=c1oc2ccc([N+](=O)[O-])cc2n1CCCSCC1CC(F)(F)C1 ZINC000419413599 942259220 /nfs/dbraw/zinc/25/92/20/942259220.db2.gz SELBHOFHPHSZCF-UHFFFAOYSA-N 0 0 358.366 3.671 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CCCN(c3ccccc3)CC2)c(C(F)(F)F)c1 ZINC000413071794 942259322 /nfs/dbraw/zinc/25/93/22/942259322.db2.gz OEIQDAZKHXRNBL-UHFFFAOYSA-N 0 0 366.343 3.725 20 5 FHBDRN CCCCNC(=O)[C@H]1CC[C@@H](C)N(c2ccc([N+](=O)[O-])c3ncccc23)C1 ZINC000413073586 942259928 /nfs/dbraw/zinc/25/99/28/942259928.db2.gz OOZCSTRYQQJVBU-CABCVRRESA-N 0 0 370.453 3.664 20 5 FHBDRN Cc1sc(C(=O)N2CCO[C@@H](c3ccccc3Cl)C2)cc1[N+](=O)[O-] ZINC000103445383 942260206 /nfs/dbraw/zinc/26/02/06/942260206.db2.gz ZAEXMODIFIQCFA-CQSZACIVSA-N 0 0 366.826 3.832 20 5 FHBDRN O=[N+]([O-])c1ccc(NC2CCN(CC(F)(F)F)CC2)c2cccnc21 ZINC000413078636 942260717 /nfs/dbraw/zinc/26/07/17/942260717.db2.gz BMXUYGFIPGBDMH-UHFFFAOYSA-N 0 0 354.332 3.582 20 5 FHBDRN COc1ccccc1SC[C@@H](C)CNC(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000103422274 942262611 /nfs/dbraw/zinc/26/26/11/942262611.db2.gz GJXCIUIIOPBBFW-AWEZNQCLSA-N 0 0 374.462 3.691 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CCC[C@@H](CC(F)(F)F)C1 ZINC000420938455 942264730 /nfs/dbraw/zinc/26/47/30/942264730.db2.gz AUQMKTKCVNEDAF-LBPRGKRZSA-N 0 0 359.348 3.506 20 5 FHBDRN Cc1cc(NC(=O)c2ccc(F)c(C)c2)n(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000103435064 942264804 /nfs/dbraw/zinc/26/48/04/942264804.db2.gz CINGPMAFVCFPPL-UHFFFAOYSA-N 0 0 354.341 3.789 20 5 FHBDRN Cc1c(CSCc2nn(C)cc2Br)cccc1[N+](=O)[O-] ZINC000419475457 942272481 /nfs/dbraw/zinc/27/24/81/942272481.db2.gz IAUDEUJNIBBJRJ-UHFFFAOYSA-N 0 0 356.245 3.833 20 5 FHBDRN CC(C)Oc1cc(CNC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)ccn1 ZINC000502186587 942275398 /nfs/dbraw/zinc/27/53/98/942275398.db2.gz IJWSRHQFBNNVHQ-UHFFFAOYSA-N 0 0 371.418 3.922 20 5 FHBDRN COc1cc2c(c(OC)c1)N(C(=O)c1cc(C)ccc1[N+](=O)[O-])CCC2 ZINC000416038714 942284627 /nfs/dbraw/zinc/28/46/27/942284627.db2.gz FGKJTROOVSGOQT-UHFFFAOYSA-N 0 0 356.378 3.513 20 5 FHBDRN Cc1cnc([C@@H](C)CNC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)s1 ZINC000183209785 942285773 /nfs/dbraw/zinc/28/57/73/942285773.db2.gz HLRONUAHHCTURS-LBPRGKRZSA-N 0 0 374.466 3.837 20 5 FHBDRN CNc1ccc(C(=O)N2CCC[C@@H]2c2ccc(OC)cc2)cc1[N+](=O)[O-] ZINC000015626635 942289697 /nfs/dbraw/zinc/28/96/97/942289697.db2.gz GTMYGQDMGRQNJE-QGZVFWFLSA-N 0 0 355.394 3.622 20 5 FHBDRN Cc1ccc(Cl)cc1NC(=O)[C@H](C)OC(=O)c1cccc([N+](=O)[O-])c1 ZINC000015644491 942291730 /nfs/dbraw/zinc/29/17/30/942291730.db2.gz WOXUYSNGRIQJNH-NSHDSACASA-N 0 0 362.769 3.741 20 5 FHBDRN CO[C@H](CSCCC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000419534483 942292385 /nfs/dbraw/zinc/29/23/85/942292385.db2.gz PZYZSXFOBPRWGF-INIZCTEOSA-N 0 0 374.462 3.914 20 5 FHBDRN O=C(CC1CCCCC1)NCCNc1ncc([N+](=O)[O-])cc1C(F)(F)F ZINC000413118015 942303235 /nfs/dbraw/zinc/30/32/35/942303235.db2.gz YMWHTTBKSAZRES-UHFFFAOYSA-N 0 0 374.363 3.507 20 5 FHBDRN COc1cc(C(=O)NC(C)(C)Cc2ccc(C)cc2)c([N+](=O)[O-])cc1F ZINC000416060724 942305335 /nfs/dbraw/zinc/30/53/35/942305335.db2.gz LKANJKBOSURTJP-UHFFFAOYSA-N 0 0 360.385 3.802 20 5 FHBDRN Cc1ccc(NC(=O)[C@@H](C)OC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)cc1F ZINC000015655143 942306643 /nfs/dbraw/zinc/30/66/43/942306643.db2.gz NKKRYDCLECMTTF-BCRSCGJKSA-N 0 0 372.352 3.626 20 5 FHBDRN Cc1ccc(Br)cc1CSCc1c([N+](=O)[O-])ncn1C ZINC000419553109 942311000 /nfs/dbraw/zinc/31/10/00/942311000.db2.gz YBJXFLKBUUQUJC-UHFFFAOYSA-N 0 0 356.245 3.833 20 5 FHBDRN O=C(NC[C@H]1CC12CC2)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000416064556 942311848 /nfs/dbraw/zinc/31/18/48/942311848.db2.gz GKUOSXNRYJFAKC-MRXNPFEDSA-N 0 0 351.406 3.737 20 5 FHBDRN CC(C)(C)c1ccc(NC(=O)NCc2ncnn2C(C)(C)C)cc1[N+](=O)[O-] ZINC000501113853 942316049 /nfs/dbraw/zinc/31/60/49/942316049.db2.gz VBMGLFWTARFNQR-UHFFFAOYSA-N 0 0 374.445 3.561 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)N2CC3(CCC3)[C@H]2[C@@H]2CCCO2)cc1[N+](=O)[O-] ZINC000290632180 942316907 /nfs/dbraw/zinc/31/69/07/942316907.db2.gz DAAAGFOBZAXZJF-JCGIZDLHSA-N 0 0 373.453 3.707 20 5 FHBDRN O=C(CCSCc1nnc(C2CC2)s1)Nc1ccccc1[N+](=O)[O-] ZINC000419570965 942318810 /nfs/dbraw/zinc/31/88/10/942318810.db2.gz FDOBAIVNEQWZSF-UHFFFAOYSA-N 0 0 364.452 3.586 20 5 FHBDRN CC(C)c1nc2c(n1C)CCN(c1ccc([N+](=O)[O-])c3ncccc13)C2 ZINC000413126094 942323824 /nfs/dbraw/zinc/32/38/24/942323824.db2.gz JRLHDWPBRLQRGZ-UHFFFAOYSA-N 0 0 351.410 3.563 20 5 FHBDRN CO[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2SC(C)C)CC[C@@H]1C ZINC000188071660 942325961 /nfs/dbraw/zinc/32/59/61/942325961.db2.gz JEFDQQUHALUTGF-SWLSCSKDSA-N 0 0 352.456 3.592 20 5 FHBDRN Cc1cc(F)cc2c1CN(C(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F)CC2 ZINC000501163307 942332473 /nfs/dbraw/zinc/33/24/73/942332473.db2.gz JLQLSAFKUSTQOF-GFCCVEGCSA-N 0 0 360.360 3.870 20 5 FHBDRN O=C(Nc1cc(F)cc(F)c1Br)c1ccc([N+](=O)[O-])cc1 ZINC000188096996 942334774 /nfs/dbraw/zinc/33/47/74/942334774.db2.gz SOIODVPETLZHQP-UHFFFAOYSA-N 0 0 357.110 3.888 20 5 FHBDRN Cc1cc(F)ccc1N(Cc1ccco1)C(=O)c1ccc([N+](=O)[O-])n1C ZINC000501152169 942335495 /nfs/dbraw/zinc/33/54/95/942335495.db2.gz RAACWGKRFYIAQM-UHFFFAOYSA-N 0 0 357.341 3.821 20 5 FHBDRN Cc1cc(S(=O)(=O)N2c3ccccc3SC[C@H]2C)ccc1[N+](=O)[O-] ZINC000434109839 942337543 /nfs/dbraw/zinc/33/75/43/942337543.db2.gz VRNHECQSPHHXPP-GFCCVEGCSA-N 0 0 364.448 3.593 20 5 FHBDRN CC[C@H]1C[C@H](NC(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CCO1 ZINC000421085765 942338124 /nfs/dbraw/zinc/33/81/24/942338124.db2.gz IPRFBRJXDMSLNT-MNOVXSKESA-N 0 0 361.320 3.693 20 5 FHBDRN Cc1cc(C=C2CCN(C(=O)/C=C/c3ccccc3[N+](=O)[O-])CC2)no1 ZINC000378163603 942339748 /nfs/dbraw/zinc/33/97/48/942339748.db2.gz DKRUOKCEACYLFJ-VOTSOKGWSA-N 0 0 353.378 3.610 20 5 FHBDRN Cc1cc(F)cc([C@]2(F)CCN(C(=O)Cc3cccc([N+](=O)[O-])c3C)C2)c1 ZINC000501177511 942342422 /nfs/dbraw/zinc/34/24/22/942342422.db2.gz SCTLFNBMPBZROZ-FQEVSTJZSA-N 0 0 374.387 3.991 20 5 FHBDRN CC(C)n1cnnc1[C@@H]1CCCN(c2nccc3ccc([N+](=O)[O-])cc32)C1 ZINC000413147485 942349154 /nfs/dbraw/zinc/34/91/54/942349154.db2.gz OQXIKEIMPJKHTQ-OAHLLOKOSA-N 0 0 366.425 3.699 20 5 FHBDRN Cc1nc([C@@H]2CCCN(Cc3ccc([N+](=O)[O-])cc3C(F)(F)F)C2)no1 ZINC000366455662 942350139 /nfs/dbraw/zinc/35/01/39/942350139.db2.gz YZQHZFGCUKBDBD-GFCCVEGCSA-N 0 0 370.331 3.685 20 5 FHBDRN CC(C)[C@@H]1N(C(=O)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)CC12CCOCC2 ZINC000413566109 942353260 /nfs/dbraw/zinc/35/32/60/942353260.db2.gz IHQOLDCRFDPAMZ-YOEHRIQHSA-N 0 0 361.442 3.502 20 5 FHBDRN Cc1cc(F)cc([C@@]2(F)CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)C2)c1 ZINC000501241495 942357556 /nfs/dbraw/zinc/35/75/56/942357556.db2.gz BSKIXWLKQYKSTL-GOSISDBHSA-N 0 0 364.323 3.892 20 5 FHBDRN Cc1c(C(=O)N2CCN([C@H](C)c3cccc(F)c3)CC2)cccc1[N+](=O)[O-] ZINC000103975223 942358185 /nfs/dbraw/zinc/35/81/85/942358185.db2.gz YYFARSQVEJXMAA-OAHLLOKOSA-N 0 0 371.412 3.561 20 5 FHBDRN O=C(CCn1cc([N+](=O)[O-])cn1)Nc1ccccc1NCC1CCCCC1 ZINC000180441074 942368794 /nfs/dbraw/zinc/36/87/94/942368794.db2.gz FGZROBIKZKXLIA-UHFFFAOYSA-N 0 0 371.441 3.812 20 5 FHBDRN Cc1nn(CCOc2ccc(Cl)cc2Br)cc1[N+](=O)[O-] ZINC000501261626 942368901 /nfs/dbraw/zinc/36/89/01/942368901.db2.gz ITEHIFNXURGDRD-UHFFFAOYSA-N 0 0 360.595 3.595 20 5 FHBDRN COCC[C@@H](NC(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1)C(C)(C)C ZINC000412328178 942368940 /nfs/dbraw/zinc/36/89/40/942368940.db2.gz OIXWDMLCNOGTGD-MRXNPFEDSA-N 0 0 352.431 3.563 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N1CC=C(c2ccc(C)cc2)CC1 ZINC000016276145 942372753 /nfs/dbraw/zinc/37/27/53/942372753.db2.gz RFKQHDWBNFFYSH-UHFFFAOYSA-N 0 0 352.390 3.841 20 5 FHBDRN O=[N+]([O-])c1ccsc1NC[C@@H](c1ccc(Cl)cc1)N1CCOCC1 ZINC000302007315 942376581 /nfs/dbraw/zinc/37/65/81/942376581.db2.gz WJHIBWYUKOEUNY-HNNXBMFYSA-N 0 0 367.858 3.795 20 5 FHBDRN O=C(c1ccccc1)N1CCC[C@H]1c1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000366461401 942377478 /nfs/dbraw/zinc/37/74/78/942377478.db2.gz KGEWCPVSTSFHTO-INIZCTEOSA-N 0 0 364.361 3.622 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N2Cc3cccc(Br)c3C2)c1 ZINC000613689193 942381030 /nfs/dbraw/zinc/38/10/30/942381030.db2.gz AQLJMVLKICMUBF-UHFFFAOYSA-N 0 0 361.195 3.822 20 5 FHBDRN O=C(O[C@H](C1CC1)C(F)(F)F)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000122887444 942384314 /nfs/dbraw/zinc/38/43/14/942384314.db2.gz WPWHWQSPLUBKAB-CQSZACIVSA-N 0 0 358.316 3.693 20 5 FHBDRN O=[N+]([O-])c1cnc2ccc(N3Cc4ccccc4[C@@H](c4ccccc4)C3)nn21 ZINC000502382686 942392904 /nfs/dbraw/zinc/39/29/04/942392904.db2.gz JVJVOYCBMCJGNU-GOSISDBHSA-N 0 0 371.400 3.790 20 5 FHBDRN COc1ccccc1O[C@H](C)CNc1ncc([N+](=O)[O-])cc1C(F)(F)F ZINC000413170429 942393209 /nfs/dbraw/zinc/39/32/09/942393209.db2.gz PCGATBIUSYUTEQ-SNVBAGLBSA-N 0 0 371.315 3.897 20 5 FHBDRN Cc1[nH]c2ccccc2c1C(=O)O[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000016296141 942398157 /nfs/dbraw/zinc/39/81/57/942398157.db2.gz YUQWFYGALQNKII-GFCCVEGCSA-N 0 0 367.361 3.569 20 5 FHBDRN Cc1[nH]c2ccccc2c1C(=O)O[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000016296142 942398340 /nfs/dbraw/zinc/39/83/40/942398340.db2.gz YUQWFYGALQNKII-LBPRGKRZSA-N 0 0 367.361 3.569 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)Nc1cc(F)ccc1OC[C@@H]1CCCO1 ZINC000502369925 942401623 /nfs/dbraw/zinc/40/16/23/942401623.db2.gz UYCMLLGNEFXEAJ-HNNXBMFYSA-N 0 0 374.368 3.852 20 5 FHBDRN O=[N+]([O-])c1ccc2ccnc(N3CCC(Oc4ccccn4)CC3)c2c1 ZINC000413178323 942408247 /nfs/dbraw/zinc/40/82/47/942408247.db2.gz MSXMDXIKRMZOFU-UHFFFAOYSA-N 0 0 350.378 3.586 20 5 FHBDRN CC(C)N(c1ccccc1)S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000104101935 942408327 /nfs/dbraw/zinc/40/83/27/942408327.db2.gz MSBOLZRLUIAVNO-UHFFFAOYSA-N 0 0 354.815 3.852 20 5 FHBDRN Cc1c(C(=O)N[C@H](C)c2ccc(-n3cccn3)c(F)c2)cccc1[N+](=O)[O-] ZINC000505243913 942414839 /nfs/dbraw/zinc/41/48/39/942414839.db2.gz DSYDHDVTRARHCG-CYBMUJFWSA-N 0 0 368.368 3.719 20 5 FHBDRN CCc1ccc(F)cc1C(=O)Nc1cc(C)nc2ccc([N+](=O)[O-])cc21 ZINC001268854584 942419228 /nfs/dbraw/zinc/41/92/28/942419228.db2.gz ZELPJXIDOIQKKY-UHFFFAOYSA-N 0 0 353.353 3.827 20 5 FHBDRN C[C@@H](CCc1ccco1)NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513744599 942426127 /nfs/dbraw/zinc/42/61/27/942426127.db2.gz NAAJDYBNHFICMR-JTQLQIEISA-N 0 0 354.309 3.540 20 5 FHBDRN CC(C)Oc1cc(C(=O)N[C@@H](C)CC(=O)c2ccccc2)ccc1[N+](=O)[O-] ZINC000413621683 942431612 /nfs/dbraw/zinc/43/16/12/942431612.db2.gz RIDBAWWTYWLEPW-AWEZNQCLSA-N 0 0 370.405 3.773 20 5 FHBDRN Cc1cc(C(=O)Nc2cc(F)ccc2OC[C@@H]2CCCO2)ccc1[N+](=O)[O-] ZINC000502419955 942435889 /nfs/dbraw/zinc/43/58/89/942435889.db2.gz WGHNSROFFCYDLJ-HNNXBMFYSA-N 0 0 374.368 3.852 20 5 FHBDRN Cc1ccc(CNc2ncc([N+](=O)[O-])cc2F)c(OC[C@H]2CCCO2)c1 ZINC000413182847 942437638 /nfs/dbraw/zinc/43/76/38/942437638.db2.gz HMGLMXCHWQDIBB-OAHLLOKOSA-N 0 0 361.373 3.607 20 5 FHBDRN Cc1noc(C2CCC(Nc3ccc([N+](=O)[O-])c4ncccc34)CC2)n1 ZINC000413185270 942438332 /nfs/dbraw/zinc/43/83/32/942438332.db2.gz LXUWSRQNVUYOCE-UHFFFAOYSA-N 0 0 353.382 3.973 20 5 FHBDRN COCCSCCCOc1cc(F)c(Br)cc1[N+](=O)[O-] ZINC000783095403 942439237 /nfs/dbraw/zinc/43/92/37/942439237.db2.gz LSDGNAOJYWKBND-UHFFFAOYSA-N 0 0 368.224 3.645 20 5 FHBDRN C[C@@H](Nc1ncc([N+](=O)[O-])cc1C(F)(F)F)c1ccc([S@](C)=O)cc1 ZINC000413199048 942455342 /nfs/dbraw/zinc/45/53/42/942455342.db2.gz IIBSIESGNDWIJQ-IJRMKIOGSA-N 0 0 373.356 3.919 20 5 FHBDRN C[C@@H](Nc1ncc([N+](=O)[O-])cc1C(F)(F)F)c1ccc([S@@](C)=O)cc1 ZINC000413199052 942455643 /nfs/dbraw/zinc/45/56/43/942455643.db2.gz IIBSIESGNDWIJQ-UVJXUPGXSA-N 0 0 373.356 3.919 20 5 FHBDRN CCOc1ccc(C(=O)NCc2ccc(Cl)cc2OC)cc1[N+](=O)[O-] ZINC000502460427 942461198 /nfs/dbraw/zinc/46/11/98/942461198.db2.gz HQCXRYFYXZRQHH-UHFFFAOYSA-N 0 0 364.785 3.586 20 5 FHBDRN O=C(N[C@@H]1C[C@H]1C1CCC1)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000424973863 942462941 /nfs/dbraw/zinc/46/29/41/942462941.db2.gz ZLDZQEYOIRAKPM-DOTOQJQBSA-N 0 0 350.393 3.739 20 5 FHBDRN Cc1cccc(C(=O)NC[C@H](CC(C)C)C(=O)OC(C)(C)C)c1[N+](=O)[O-] ZINC000424952452 942467404 /nfs/dbraw/zinc/46/74/04/942467404.db2.gz LEDXJLZEQLCUGL-AWEZNQCLSA-N 0 0 364.442 3.637 20 5 FHBDRN O=C(C1CCCCC1)N1CC[C@@H](Nc2nccc3ccc([N+](=O)[O-])cc32)C1 ZINC000413206950 942478130 /nfs/dbraw/zinc/47/81/30/942478130.db2.gz ZIHQQUABZQNJNS-MRXNPFEDSA-N 0 0 368.437 3.736 20 5 FHBDRN O=[N+]([O-])c1ccc(N[C@@H]2CCOC3(CCSCC3)C2)c2cccnc21 ZINC000413208103 942478895 /nfs/dbraw/zinc/47/88/95/942478895.db2.gz SEQZUUGGUSIDFQ-CYBMUJFWSA-N 0 0 359.451 4.000 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1C[C@@]1(F)c1ccccc1 ZINC000424979094 942485320 /nfs/dbraw/zinc/48/53/20/942485320.db2.gz XPAURIHTYCSTFE-BJOOFOGMSA-N 0 0 360.410 3.829 20 5 FHBDRN CC(C)(C)c1nnc(CNc2ncc([N+](=O)[O-])cc2C(F)(F)F)s1 ZINC000413202647 942485435 /nfs/dbraw/zinc/48/54/35/942485435.db2.gz WRZYPSXHGRCNMA-UHFFFAOYSA-N 0 0 361.349 3.770 20 5 FHBDRN CC(C)n1nc(-c2ccccc2)cc1NC(=O)c1ccc([N+](=O)[O-])n1C ZINC000505328894 942486393 /nfs/dbraw/zinc/48/63/93/942486393.db2.gz KMMVOXSCGAVWOO-UHFFFAOYSA-N 0 0 353.382 3.630 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N2CCC[C@@H]2/C=C\c2ccccc2)c1 ZINC000505359246 942500267 /nfs/dbraw/zinc/50/02/67/942500267.db2.gz IFIJYSSXPMHABA-ZBTGYSDGSA-N 0 0 352.390 3.921 20 5 FHBDRN COc1cc(Cl)ccc1CNC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000502530471 942503673 /nfs/dbraw/zinc/50/36/73/942503673.db2.gz PSTLJQGJKCYCEU-UHFFFAOYSA-N 0 0 355.177 3.840 20 5 FHBDRN Cc1c(CC(=O)N2CCc3c(Cl)cc(F)cc3C2)cccc1[N+](=O)[O-] ZINC000452320933 942513205 /nfs/dbraw/zinc/51/32/05/942513205.db2.gz XMMQLVZTZNPDFH-UHFFFAOYSA-N 0 0 362.788 3.823 20 5 FHBDRN C[C@@H](CC(=O)c1ccc(F)cc1)NC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000501508849 942517525 /nfs/dbraw/zinc/51/75/25/942517525.db2.gz YHBONBQTAHQMOP-NSHDSACASA-N 0 0 369.352 3.607 20 5 FHBDRN Cc1cnc(-c2cccc(NS(=O)(=O)c3cc([N+](=O)[O-])ccc3C)c2)o1 ZINC000066814687 942526791 /nfs/dbraw/zinc/52/67/91/942526791.db2.gz IZFQRSONRVGUQU-UHFFFAOYSA-N 0 0 373.390 3.667 20 5 FHBDRN COc1ccc([C@@H](NC(=O)c2ccc(C)c([N+](=O)[O-])c2)C(F)(F)F)cc1 ZINC000505402174 942527935 /nfs/dbraw/zinc/52/79/35/942527935.db2.gz ICXNIBYFNRHCET-OAHLLOKOSA-N 0 0 368.311 3.945 20 5 FHBDRN C[C@@H](SCc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc2c(c1)OCO2 ZINC000513814027 942532407 /nfs/dbraw/zinc/53/24/07/942532407.db2.gz PVWFNKRKIQTRPQ-LLVKDONJSA-N 0 0 360.391 3.584 20 5 FHBDRN O=[N+]([O-])c1cccc2c1CCCN2S(=O)(=O)c1ccc(F)cc1Cl ZINC000513815634 942533624 /nfs/dbraw/zinc/53/36/24/942533624.db2.gz YEEOGLCOFAVBIM-UHFFFAOYSA-N 0 0 370.789 3.529 20 5 FHBDRN CCCCc1nnc(NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)s1 ZINC000545876052 942539652 /nfs/dbraw/zinc/53/96/52/942539652.db2.gz WESWCQITUFXZKP-UHFFFAOYSA-N 0 0 366.418 3.844 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N2CC[C@@H](CSc3ccccc3)C2)c1[N+](=O)[O-] ZINC000434244329 942543967 /nfs/dbraw/zinc/54/39/67/942543967.db2.gz HBISBIDVSHQNDV-CYBMUJFWSA-N 0 0 374.466 3.696 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N2CC=C(c3ccccc3F)C2)c1 ZINC000501571351 942543925 /nfs/dbraw/zinc/54/39/25/942543925.db2.gz XDRNZMHRBHQVIS-UHFFFAOYSA-N 0 0 358.394 3.995 20 5 FHBDRN Cc1cc2c(cc1NC(=O)CCc1ccc([N+](=O)[O-])cc1Cl)OCO2 ZINC001268910981 942548954 /nfs/dbraw/zinc/54/89/54/942548954.db2.gz UUDPFRJGHIZCAX-UHFFFAOYSA-N 0 0 362.769 3.857 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CC[C@H]1c1ccccc1F ZINC000366937818 942550211 /nfs/dbraw/zinc/55/02/11/942550211.db2.gz IEZNGXWNGZYKNJ-SFHVURJKSA-N 0 0 353.353 3.731 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CC[C@@H]1c1ccccc1F ZINC000366937817 942550260 /nfs/dbraw/zinc/55/02/60/942550260.db2.gz IEZNGXWNGZYKNJ-GOSISDBHSA-N 0 0 353.353 3.731 20 5 FHBDRN O=C(CSc1ccc(F)c(F)c1)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000513839045 942551943 /nfs/dbraw/zinc/55/19/43/942551943.db2.gz CDEOKHWKDJVOPS-UHFFFAOYSA-N 0 0 364.373 3.945 20 5 FHBDRN C[C@H](Oc1ccc(F)c(F)c1)C(=O)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000513842731 942553012 /nfs/dbraw/zinc/55/30/12/942553012.db2.gz NQQSQDMSLYBAED-NSHDSACASA-N 0 0 362.332 3.620 20 5 FHBDRN CCNc1cc(C)ccc1NC(=O)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC000413749767 942554443 /nfs/dbraw/zinc/55/44/43/942554443.db2.gz QEBSXSMYZSCDPC-UHFFFAOYSA-N 0 0 361.373 3.664 20 5 FHBDRN Cc1cc(Br)ccc1NC(=O)Cc1ccc([N+](=O)[O-])cc1F ZINC000122908899 942555457 /nfs/dbraw/zinc/55/54/57/942555457.db2.gz IDNIIWKPLWENTE-UHFFFAOYSA-N 0 0 367.174 3.986 20 5 FHBDRN C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)[C@@H](C)CO1 ZINC000501597640 942569960 /nfs/dbraw/zinc/56/99/60/942569960.db2.gz NMRHWNGCYMUYOF-UONOGXRCSA-N 0 0 372.446 3.995 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H](Cc1ccccc1)OC ZINC000452392276 942570876 /nfs/dbraw/zinc/57/08/76/942570876.db2.gz DPNONTYXXGLCGH-AZUAARDMSA-N 0 0 370.449 3.537 20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])NCCc1csc2ccccc12 ZINC000501622902 942571504 /nfs/dbraw/zinc/57/15/04/942571504.db2.gz XXMBSEJNFOZEPI-UHFFFAOYSA-N 0 0 369.446 3.970 20 5 FHBDRN O=[N+]([O-])c1cc(CNc2cc(NC3CC3)ncn2)cc(C(F)(F)F)c1 ZINC000413262474 942574274 /nfs/dbraw/zinc/57/42/74/942574274.db2.gz HHZKTIDWHYIPQZ-UHFFFAOYSA-N 0 0 353.304 3.590 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)Nc1ccc(CN2CCCC2=O)cc1 ZINC000421440247 942574647 /nfs/dbraw/zinc/57/46/47/942574647.db2.gz YXVYDTUZATVVSN-UHFFFAOYSA-N 0 0 367.405 3.586 20 5 FHBDRN CC1CCN(c2ccc(C(=O)N3CC[C@@H](C)[C@H](C)C3)cc2[N+](=O)[O-])CC1 ZINC000501613225 942575225 /nfs/dbraw/zinc/57/52/25/942575225.db2.gz BZIDIEAVOBYTMY-HZPDHXFCSA-N 0 0 359.470 3.949 20 5 FHBDRN CN(C)c1ccc(COC(=O)C(C)(C)Cc2ccccc2)cc1[N+](=O)[O-] ZINC001268941189 942575325 /nfs/dbraw/zinc/57/53/25/942575325.db2.gz KMZBXTCNAQZCLC-UHFFFAOYSA-N 0 0 356.422 3.973 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N(Cc1ccco1)C[C@@H]1CCCO1 ZINC000421447658 942579600 /nfs/dbraw/zinc/57/96/00/942579600.db2.gz SJUVXZOKNLDAQG-INIZCTEOSA-N 0 0 358.394 3.626 20 5 FHBDRN COc1cc(O)cc(NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)c1 ZINC000509539747 942580143 /nfs/dbraw/zinc/58/01/43/942580143.db2.gz QRDCGQCAEFMVFG-UHFFFAOYSA-N 0 0 356.256 3.580 20 5 FHBDRN COc1cc(C(=O)NC[C@]2(C)C[C@H]2c2ccccc2)cc([N+](=O)[O-])c1C ZINC000501629668 942580733 /nfs/dbraw/zinc/58/07/33/942580733.db2.gz WHYDTOPEQCFENK-JXFKEZNVSA-N 0 0 354.406 3.835 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NC[C@@H](c1ccco1)N1CCCCC1 ZINC000421462865 942582962 /nfs/dbraw/zinc/58/29/62/942582962.db2.gz YWPDLHZRLZJTPQ-SFHVURJKSA-N 0 0 371.437 3.762 20 5 FHBDRN CCN(C(=O)c1cc([N+](=O)[O-])c(C)cc1C)c1ccccc1C(=O)OC ZINC000421462778 942583814 /nfs/dbraw/zinc/58/38/14/942583814.db2.gz DDAGPMRCQCLPBB-UHFFFAOYSA-N 0 0 356.378 3.665 20 5 FHBDRN C[C@@]1(CNC(=O)CCOc2ccccc2[N+](=O)[O-])C[C@H]1c1ccccc1 ZINC000501661678 942593080 /nfs/dbraw/zinc/59/30/80/942593080.db2.gz CKXCXWNLZUNLHS-JXFKEZNVSA-N 0 0 354.406 3.674 20 5 FHBDRN CC(C)Oc1cc(C(=O)NCC2(c3ccccn3)CCC2)ccc1[N+](=O)[O-] ZINC000412344939 942594370 /nfs/dbraw/zinc/59/43/70/942594370.db2.gz YIZWUOJMWAVJTA-UHFFFAOYSA-N 0 0 369.421 3.629 20 5 FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H](C(C)(C)C)C1 ZINC000541319557 942595641 /nfs/dbraw/zinc/59/56/41/942595641.db2.gz LKVNGMIUMNGQKT-ZDUSSCGKSA-N 0 0 366.483 3.842 20 5 FHBDRN COc1ccccc1[C@@H](NC(=O)Nc1ccncc1[N+](=O)[O-])c1ccco1 ZINC000183573143 942596215 /nfs/dbraw/zinc/59/62/15/942596215.db2.gz FCAIJPYINMADBH-QGZVFWFLSA-N 0 0 368.349 3.503 20 5 FHBDRN COCc1cccc(NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)c1 ZINC000513719305 942596554 /nfs/dbraw/zinc/59/65/54/942596554.db2.gz AZLZTYJPDDXIRJ-UHFFFAOYSA-N 0 0 352.293 3.595 20 5 FHBDRN COc1ccc([C@@H]2CCN(C(=O)c3cc([N+](=O)[O-])c(C)cc3C)C2)cc1 ZINC000421457429 942596977 /nfs/dbraw/zinc/59/69/77/942596977.db2.gz AVYAEWOBOBJSHG-MRXNPFEDSA-N 0 0 354.406 3.850 20 5 FHBDRN C[C@@H](CNC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)c1ccccc1 ZINC000513749684 942599138 /nfs/dbraw/zinc/59/91/38/942599138.db2.gz VMRIXHIULSPCOQ-NSHDSACASA-N 0 0 350.321 3.730 20 5 FHBDRN COc1ccc2c(c1)N(C(=O)c1cc([N+](=O)[O-])c(C)cc1C)C[C@@H](C)O2 ZINC000421483966 942600700 /nfs/dbraw/zinc/60/07/00/942600700.db2.gz TZSPAHMNDDJJTC-CYBMUJFWSA-N 0 0 356.378 3.648 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCO[C@H]1c1ccccc1 ZINC000421486273 942602201 /nfs/dbraw/zinc/60/22/01/942602201.db2.gz XEOOEHPCWLRHNI-LPHOPBHVSA-N 0 0 354.406 3.719 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N(C)[C@H](C)c1ccc([S@@](C)=O)cc1 ZINC000421489436 942603269 /nfs/dbraw/zinc/60/32/69/942603269.db2.gz WAILLUAJGCCTFH-IYJVBRSBSA-N 0 0 374.462 3.782 20 5 FHBDRN CCOC(=O)CN(C(=O)c1ccc([N+](=O)[O-])cc1C)[C@H](C)c1ccccc1 ZINC000513912053 942604111 /nfs/dbraw/zinc/60/41/11/942604111.db2.gz YCHWSFJHVNCQDG-OAHLLOKOSA-N 0 0 370.405 3.670 20 5 FHBDRN Cc1cc(C)cc(CN(C)C(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)c1 ZINC000434341418 942605508 /nfs/dbraw/zinc/60/55/08/942605508.db2.gz LTLSYFTUENZMGD-UHFFFAOYSA-N 0 0 365.389 3.738 20 5 FHBDRN Cc1nc(-c2ccccc2)ncc1C(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000120239674 942606711 /nfs/dbraw/zinc/60/67/11/942606711.db2.gz OBDHCFHOOZDTMZ-UHFFFAOYSA-N 0 0 360.373 3.563 20 5 FHBDRN Cc1cccc(-c2noc(Cn3cc(-c4cccc([N+](=O)[O-])c4)cn3)n2)c1 ZINC000501679613 942608056 /nfs/dbraw/zinc/60/80/56/942608056.db2.gz ZHTGQXPESMTLNU-UHFFFAOYSA-N 0 0 361.361 3.865 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N[C@@H](c1ccccc1)[C@H]1CCOC1 ZINC000421499841 942611043 /nfs/dbraw/zinc/61/10/43/942611043.db2.gz BHDKCDXVKJRSHI-LPHOPBHVSA-N 0 0 354.406 3.719 20 5 FHBDRN CC(C)(C)Oc1cccc(CNC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)n1 ZINC000502654574 942618752 /nfs/dbraw/zinc/61/87/52/942618752.db2.gz CLTPNFJELAHTJF-UHFFFAOYSA-N 0 0 363.801 3.751 20 5 FHBDRN CO[C@@H](C)c1nsc(Oc2ccc(Br)cc2[N+](=O)[O-])n1 ZINC000509537991 942622095 /nfs/dbraw/zinc/62/20/95/942622095.db2.gz CGFVYLCVWUOXEU-LURJTMIESA-N 0 0 360.189 3.709 20 5 FHBDRN COC(=O)c1cc(NC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)c(C)cc1C ZINC000472966429 942623322 /nfs/dbraw/zinc/62/33/22/942623322.db2.gz KZZKOTQBIDOXHW-UHFFFAOYSA-N 0 0 367.361 3.732 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCC(N(C)c2ccccc2)CC1 ZINC000421519076 942625163 /nfs/dbraw/zinc/62/51/63/942625163.db2.gz JVJZLTNQALBZSX-UHFFFAOYSA-N 0 0 367.449 3.953 20 5 FHBDRN COc1ccc(CNC(=O)C[C@H](C)c2ccc(F)cc2F)cc1[N+](=O)[O-] ZINC000501718867 942626672 /nfs/dbraw/zinc/62/66/72/942626672.db2.gz PHEUZPDADDGTGL-NSHDSACASA-N 0 0 364.348 3.692 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N[C@H]1CCO[C@@H](c2ccccc2)C1 ZINC000421523284 942628138 /nfs/dbraw/zinc/62/81/38/942628138.db2.gz SSHZQPXMXHOCBQ-QFBILLFUSA-N 0 0 354.406 3.862 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N(CCc1ccccc1)[C@@H]1CCOC1 ZINC000421523444 942628275 /nfs/dbraw/zinc/62/82/75/942628275.db2.gz NUVUEWADSDAWTA-GOSISDBHSA-N 0 0 368.433 3.685 20 5 FHBDRN COc1ccc(CNC(=O)CCCCc2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000501704042 942629335 /nfs/dbraw/zinc/62/93/35/942629335.db2.gz OLLSOYZEJWTJFQ-UHFFFAOYSA-N 0 0 356.422 3.941 20 5 FHBDRN CO[C@H](c1ccc(F)cc1)[C@H](C)NC(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC000421505370 942631133 /nfs/dbraw/zinc/63/11/33/942631133.db2.gz IPJRCHADXWKPQA-UGSOOPFHSA-N 0 0 360.385 3.857 20 5 FHBDRN CC1(C)C[C@@H](NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)C(C)(C)O1 ZINC000183576771 942631819 /nfs/dbraw/zinc/63/18/19/942631819.db2.gz DDLXCEJSZIKMHL-MRXNPFEDSA-N 0 0 361.442 3.615 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CC(C)(C)OC1(C)C ZINC000183578775 942634347 /nfs/dbraw/zinc/63/43/47/942634347.db2.gz FNPKVMCQOVNKJH-MRXNPFEDSA-N 0 0 363.458 3.861 20 5 FHBDRN CC1(C)CN(c2nccc3ccc([N+](=O)[O-])cc32)C[C@@H](C(F)(F)F)O1 ZINC000413303335 942638856 /nfs/dbraw/zinc/63/88/56/942638856.db2.gz NYKDHNNVKRQJQT-ZDUSSCGKSA-N 0 0 355.316 3.689 20 5 FHBDRN COC(=O)CCN(C(=O)c1cc([N+](=O)[O-])c(C)cc1C)c1ccccc1C ZINC000421528582 942640174 /nfs/dbraw/zinc/64/01/74/942640174.db2.gz ZUIVFAQDLPOJCO-UHFFFAOYSA-N 0 0 370.405 3.730 20 5 FHBDRN COc1ccccc1-c1noc([C@@H](C)NCc2ccc([N+](=O)[O-])c(F)c2)n1 ZINC000366984695 942643793 /nfs/dbraw/zinc/64/37/93/942643793.db2.gz XSKQWROTXFYDSL-LLVKDONJSA-N 0 0 372.356 3.643 20 5 FHBDRN COC(=O)c1c(C)c(NC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)ccc1F ZINC000413813636 942644460 /nfs/dbraw/zinc/64/44/60/942644460.db2.gz DIBPRZXJMMBBIC-UONOGXRCSA-N 0 0 372.352 3.571 20 5 FHBDRN C[C@@H](CNC(=O)NCCCCc1ccc([N+](=O)[O-])cc1)CC(F)(F)F ZINC000413313953 942648298 /nfs/dbraw/zinc/64/82/98/942648298.db2.gz SMSIDNSYDJYSAS-GFCCVEGCSA-N 0 0 361.364 3.805 20 5 FHBDRN COc1cc2c(cc1F)CC[C@H]2NC(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC000421547631 942652581 /nfs/dbraw/zinc/65/25/81/942652581.db2.gz WWUITSKAZBHOFH-MRXNPFEDSA-N 0 0 358.369 3.777 20 5 FHBDRN CC(C)OCCOC1CCN(c2ccc([N+](=O)[O-])c3ncccc23)CC1 ZINC000413317034 942657576 /nfs/dbraw/zinc/65/75/76/942657576.db2.gz LXZNKDYTJHYUET-UHFFFAOYSA-N 0 0 359.426 3.553 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)cc1 ZINC000513721359 942661049 /nfs/dbraw/zinc/66/10/49/942661049.db2.gz VZNHFPSDQNINKG-LLVKDONJSA-N 0 0 350.321 3.996 20 5 FHBDRN O=[N+]([O-])c1ccc(N[C@@H]2[C@@H]3CCO[C@H]3C23CCC3)c(Br)c1 ZINC000513983393 942662605 /nfs/dbraw/zinc/66/26/05/942662605.db2.gz OPFSKICKWVGYLM-ZLKJLUDKSA-N 0 0 353.216 3.727 20 5 FHBDRN CCOc1ncc(C)cc1NC(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1 ZINC000413833371 942667975 /nfs/dbraw/zinc/66/79/75/942667975.db2.gz IMPWVAUFAQIFOU-UHFFFAOYSA-N 0 0 359.382 3.736 20 5 FHBDRN Cc1cc(CNC(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)cc(C)n1 ZINC000421578743 942668770 /nfs/dbraw/zinc/66/87/70/942668770.db2.gz RSKUKKARNKMOPC-UHFFFAOYSA-N 0 0 353.300 3.555 20 5 FHBDRN COc1ccc(NC(=O)Nc2cccc([N+](=O)[O-])c2C)cc1NC(C)=O ZINC000502704108 942671608 /nfs/dbraw/zinc/67/16/08/942671608.db2.gz WYMINUXHOMXNAL-UHFFFAOYSA-N 0 0 358.354 3.514 20 5 FHBDRN Cc1ccc(-c2noc(-c3cc(COC(C)(C)C)on3)n2)cc1[N+](=O)[O-] ZINC000420480002 942684759 /nfs/dbraw/zinc/68/47/59/942684759.db2.gz IEUYOMNKCLRJTQ-UHFFFAOYSA-N 0 0 358.354 3.923 20 5 FHBDRN CCc1ccc([C@@H]2CCN(C(=O)NCCc3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000431865174 942697388 /nfs/dbraw/zinc/69/73/88/942697388.db2.gz NUEZWUXAQIGNCJ-LJQANCHMSA-N 0 0 367.449 3.899 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N(C)c1nc2ccccc2n1C ZINC000183620113 942698672 /nfs/dbraw/zinc/69/86/72/942698672.db2.gz KLBCLMVBQRJRSY-OAHLLOKOSA-N 0 0 366.421 3.713 20 5 FHBDRN O=[N+]([O-])c1ccc([C@@H]2C[C@H]2c2nc([C@H]3COc4ccccc4O3)no2)cc1 ZINC000420494416 942701070 /nfs/dbraw/zinc/70/10/70/942701070.db2.gz RFCBHBCQDXZRBU-JJRVBVJISA-N 0 0 365.345 3.761 20 5 FHBDRN O=C(Nc1cccc(CNc2ccncc2[N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000066809992 942701388 /nfs/dbraw/zinc/70/13/88/942701388.db2.gz MRFVOFBTYYRJAZ-UHFFFAOYSA-N 0 0 366.352 3.993 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CCC[C@H](C[C@H]2CCOC2)C1 ZINC000378398025 942703215 /nfs/dbraw/zinc/70/32/15/942703215.db2.gz GPDOHNUYQLFIPR-CHWSQXEVSA-N 0 0 352.818 3.527 20 5 FHBDRN Cc1cc(-c2noc(-c3cc(COC(C)(C)C)on3)n2)cc([N+](=O)[O-])c1 ZINC000420499250 942707078 /nfs/dbraw/zinc/70/70/78/942707078.db2.gz IPTPRKFGSIXLOF-UHFFFAOYSA-N 0 0 358.354 3.923 20 5 FHBDRN COc1ccccc1Cc1noc([C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)n1 ZINC000420478919 942707270 /nfs/dbraw/zinc/70/72/70/942707270.db2.gz YDAFFJCJYAKGAW-JKSUJKDBSA-N 0 0 351.362 3.848 20 5 FHBDRN C[C@@H](c1ccccc1)N(C(=O)Cn1ccc([N+](=O)[O-])n1)c1ccccc1 ZINC000502744655 942709662 /nfs/dbraw/zinc/70/96/62/942709662.db2.gz SNOWTFZVZQFCNJ-HNNXBMFYSA-N 0 0 350.378 3.586 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)Nc1ccc2ccn(C)c(=O)c2c1 ZINC000501842485 942710122 /nfs/dbraw/zinc/71/01/22/942710122.db2.gz OMERHPQVZHLZMA-UHFFFAOYSA-N 0 0 371.780 3.661 20 5 FHBDRN O=[N+]([O-])c1cnccc1N1CCc2[nH]c3c(cccc3Br)c2C1 ZINC000066810438 942711691 /nfs/dbraw/zinc/71/16/91/942711691.db2.gz MUNYCEPAJAQIDP-UHFFFAOYSA-N 0 0 373.210 3.796 20 5 FHBDRN CC1(C)CC[C@H](c2noc(CCn3cc([N+](=O)[O-])cn3)n2)c2ccccc21 ZINC000420512331 942716821 /nfs/dbraw/zinc/71/68/21/942716821.db2.gz WJHGYWHOSLJYLM-HNNXBMFYSA-N 0 0 367.409 3.620 20 5 FHBDRN O=C(c1cc2cc([N+](=O)[O-])ccc2o1)N1CCO[C@H](c2ccccc2)C1 ZINC000514074794 942719718 /nfs/dbraw/zinc/71/97/18/942719718.db2.gz UVRYIJPBVQUCHK-SFHVURJKSA-N 0 0 352.346 3.555 20 5 FHBDRN C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCC(F)(c2ccccc2)CC1 ZINC000434496372 942722722 /nfs/dbraw/zinc/72/27/22/942722722.db2.gz HTYLCVBOCJMGJT-OAHLLOKOSA-N 0 0 371.412 3.883 20 5 FHBDRN O=C(c1cc(F)cc([N+](=O)[O-])c1)N(Cc1c(F)cccc1F)C1CC1 ZINC000481148142 942724757 /nfs/dbraw/zinc/72/47/57/942724757.db2.gz YHVALTHLLYTGOO-UHFFFAOYSA-N 0 0 350.296 3.817 20 5 FHBDRN Cn1ccnc1[C@@H](NCCCOC1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000514081035 942731454 /nfs/dbraw/zinc/73/14/54/942731454.db2.gz AFOXQOZLBKSGNQ-IBGZPJMESA-N 0 0 372.469 3.747 20 5 FHBDRN CC[C@H]1C[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2SC(C)C)CCO1 ZINC000421673024 942736714 /nfs/dbraw/zinc/73/67/14/942736714.db2.gz WHPMVUAFCUSIEC-OCCSQVGLSA-N 0 0 352.456 3.783 20 5 FHBDRN CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1NCc1ccc(Cl)cn1 ZINC000302037898 942738459 /nfs/dbraw/zinc/73/84/59/942738459.db2.gz VKPODIDQVGPSGU-UHFFFAOYSA-N 0 0 353.737 3.571 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N(C(C)C)[C@H](C)c1ccsc1 ZINC000421689801 942746004 /nfs/dbraw/zinc/74/60/04/942746004.db2.gz KVKHDGGPGRRJHU-GFCCVEGCSA-N 0 0 350.444 3.550 20 5 FHBDRN CCN(C1CCCC1)S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000416378115 942750192 /nfs/dbraw/zinc/75/01/92/942750192.db2.gz WXPZVIYBZCLJSO-UHFFFAOYSA-N 0 0 366.361 3.567 20 5 FHBDRN O=[N+]([O-])c1cc(F)ccc1N[C@H](CO)c1ccc(Br)cc1 ZINC000502800577 942752693 /nfs/dbraw/zinc/75/26/93/942752693.db2.gz ZPWSLJHCOLMZHJ-CYBMUJFWSA-N 0 0 355.163 3.642 20 5 FHBDRN COc1cccc([C@H]2C[C@H](O)CN2Cc2c(Cl)cccc2[N+](=O)[O-])c1 ZINC000502806425 942760057 /nfs/dbraw/zinc/76/00/57/942760057.db2.gz YPDUQJJCWMZZFT-SCLBCKFNSA-N 0 0 362.813 3.565 20 5 FHBDRN Cc1c(C(=O)N2c3ccc([N+](=O)[O-])cc3C[C@@H]2C)cnn1CCC(C)C ZINC000137256395 942760818 /nfs/dbraw/zinc/76/08/18/942760818.db2.gz KLCZIEZLEMURPF-ZDUSSCGKSA-N 0 0 356.426 3.737 20 5 FHBDRN COc1ccc(NC(=O)[C@H](C)N2C[C@H](C)c3ccccc32)c([N+](=O)[O-])c1 ZINC000434569265 942761949 /nfs/dbraw/zinc/76/19/49/942761949.db2.gz FLEWQXOYXBRVLI-STQMWFEESA-N 0 0 355.394 3.554 20 5 FHBDRN CCCc1n[nH]c(C(=O)N2CC[C@@](C)(CCc3ccccc3)C2)c1[N+](=O)[O-] ZINC000434572189 942765289 /nfs/dbraw/zinc/76/52/89/942765289.db2.gz YXAJJKXMFQZOMU-HXUWFJFHSA-N 0 0 370.453 3.755 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)Nc1ccc2c(c1)C(=O)CCCC2 ZINC000421716489 942768459 /nfs/dbraw/zinc/76/84/59/942768459.db2.gz QXBMQXGFGIOYAZ-UHFFFAOYSA-N 0 0 354.362 3.521 20 5 FHBDRN CC1(C)[C@@H](c2ccccc2)CCN1C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000421720301 942776223 /nfs/dbraw/zinc/77/62/23/942776223.db2.gz BFYKVPBLJRWHFZ-MRXNPFEDSA-N 0 0 364.405 3.879 20 5 FHBDRN O=C(c1ccc(OC(F)F)c([N+](=O)[O-])c1)N1CCC[C@@H]2CCCC[C@@H]21 ZINC000514139447 942777559 /nfs/dbraw/zinc/77/75/59/942777559.db2.gz ALFHKRPRMQKHSG-AAEUAGOBSA-N 0 0 354.353 3.991 20 5 FHBDRN CC(C)(C)Oc1ccc(CNC(=O)c2ccc(Cl)cc2[N+](=O)[O-])cn1 ZINC000181597073 942788350 /nfs/dbraw/zinc/78/83/50/942788350.db2.gz NZKZTYIGWMWZDT-UHFFFAOYSA-N 0 0 363.801 3.751 20 5 FHBDRN CCO[C@H](C)c1noc(CN(C)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])n1 ZINC000514183746 942792566 /nfs/dbraw/zinc/79/25/66/942792566.db2.gz XPPCEEBPXXTUGN-SECBINFHSA-N 0 0 374.319 3.731 20 5 FHBDRN CCc1ccc([C@H](C)NC(=O)Cn2nc(C)c3cc([N+](=O)[O-])ccc32)cc1 ZINC000502848863 942795359 /nfs/dbraw/zinc/79/53/59/942795359.db2.gz VNHUIBPZLAWONJ-ZDUSSCGKSA-N 0 0 366.421 3.693 20 5 FHBDRN CCOc1ccc(C(C)=O)cc1Cn1nc(C)c2cc([N+](=O)[O-])ccc21 ZINC000502850478 942795790 /nfs/dbraw/zinc/79/57/90/942795790.db2.gz SZWRVAVNKASZHV-UHFFFAOYSA-N 0 0 353.378 3.903 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NCc1ccc(N2CCCCC2)nc1 ZINC000421753088 942796999 /nfs/dbraw/zinc/79/69/99/942796999.db2.gz XSPBSBFTEWBVQC-UHFFFAOYSA-N 0 0 368.437 3.527 20 5 FHBDRN Cc1nc(-c2ccc(NC(=O)c3c(Cl)cccc3[N+](=O)[O-])cc2)n[nH]1 ZINC000110261673 942804656 /nfs/dbraw/zinc/80/46/56/942804656.db2.gz HZZUSQCRBAPZOA-UHFFFAOYSA-N 0 0 357.757 3.594 20 5 FHBDRN Cc1cccc(C(=O)N(C)c2ccc(C(=O)NC(C)(C)C)cc2)c1[N+](=O)[O-] ZINC000413931592 942804949 /nfs/dbraw/zinc/80/49/49/942804949.db2.gz WMDQLTDJGGOMOS-UHFFFAOYSA-N 0 0 369.421 3.708 20 5 FHBDRN CC(C)c1ccc(C(=O)N2C[C@@H](O)C[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000413936200 942805333 /nfs/dbraw/zinc/80/53/33/942805333.db2.gz HKEWJYJCCSPNJP-WMZOPIPTSA-N 0 0 354.406 3.666 20 5 FHBDRN CC(C)(C)c1ccncc1CNC(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000413938270 942805513 /nfs/dbraw/zinc/80/55/13/942805513.db2.gz KVLQMRKMQDZIRG-UHFFFAOYSA-N 0 0 361.829 3.800 20 5 FHBDRN COC1([C@H](C)NC(=O)c2cc3ccccc3c3cccnc23)CCOCC1 ZINC000421764804 942811160 /nfs/dbraw/zinc/81/11/60/942811160.db2.gz YCIOBILLSGURGE-HNNXBMFYSA-N 0 0 364.445 3.702 20 5 FHBDRN CN(C)C(=O)[C@H]1CCC[C@H](Nc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000514187150 942812347 /nfs/dbraw/zinc/81/23/47/942812347.db2.gz OWGLGVLEYHVRPT-JQWIXIFHSA-N 0 0 359.348 3.673 20 5 FHBDRN CCCc1[nH]ccc1C(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000421770288 942815124 /nfs/dbraw/zinc/81/51/24/942815124.db2.gz BHLXKHJWIUIWBO-UHFFFAOYSA-N 0 0 357.410 3.559 20 5 FHBDRN CC(C)[C@@H]1C[C@H](CC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)CCO1 ZINC000514188329 942815506 /nfs/dbraw/zinc/81/55/06/942815506.db2.gz CXAMUQDRYMMNFJ-MJGOQNOKSA-N 0 0 362.470 3.875 20 5 FHBDRN O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CCC[C@](O)(C(F)(F)F)C1 ZINC000514212762 942822625 /nfs/dbraw/zinc/82/26/25/942822625.db2.gz AHQVQOUYBWSQMY-LLVKDONJSA-N 0 0 358.238 3.507 20 5 FHBDRN COc1cc(CN(C(=O)c2cc([N+](=O)[O-])c(C)cc2C)C2CC2)ccc1O ZINC000421787761 942825936 /nfs/dbraw/zinc/82/59/36/942825936.db2.gz VFJQDNQSRBYQTG-UHFFFAOYSA-N 0 0 370.405 3.731 20 5 FHBDRN C[C@@H](CNC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)Cc1cccs1 ZINC000514217249 942826388 /nfs/dbraw/zinc/82/63/88/942826388.db2.gz CVGNIBJAKNIORR-SNVBAGLBSA-N 0 0 370.377 3.866 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1C[C@H](C)O[C@@H](c2ccsc2)C1 ZINC000421788808 942827046 /nfs/dbraw/zinc/82/70/46/942827046.db2.gz TUWIITYPHLOOIQ-SUMWQHHRSA-N 0 0 360.435 3.875 20 5 FHBDRN CC[C@H](O)CN(Cc1ccccc1)C(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC000421788850 942827089 /nfs/dbraw/zinc/82/70/89/942827089.db2.gz YQTARCYDFLUKJL-KRWDZBQOSA-N 0 0 356.422 3.625 20 5 FHBDRN CCCN(C[C@H]1CCCCO1)C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514222240 942833674 /nfs/dbraw/zinc/83/36/74/942833674.db2.gz JDNPFJJQUNTOPQ-CYBMUJFWSA-N 0 0 372.368 3.618 20 5 FHBDRN Cc1nn(CCC(=O)N2CC(C)(C)C[C@H]2c2ccccc2)c(C)c1[N+](=O)[O-] ZINC000425127564 942833689 /nfs/dbraw/zinc/83/36/89/942833689.db2.gz ZIQOCMORRVGZMJ-KRWDZBQOSA-N 0 0 370.453 3.798 20 5 FHBDRN CC(C)Cn1c(-c2cccc([N+](=O)[O-])c2)nnc1N(C)Cc1ccccn1 ZINC000549439961 942833659 /nfs/dbraw/zinc/83/36/59/942833659.db2.gz HGTIKBOYSBEMPS-UHFFFAOYSA-N 0 0 366.425 3.541 20 5 FHBDRN COCC1CCC(NC(=O)c2c([N+](=O)[O-])cccc2C(F)(F)F)CC1 ZINC000413963550 942838018 /nfs/dbraw/zinc/83/80/18/942838018.db2.gz ZPTOZFCCNLJAHZ-UHFFFAOYSA-N 0 0 360.332 3.549 20 5 FHBDRN O=C(Nc1ccccc1CC(F)(F)F)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000182198157 942838129 /nfs/dbraw/zinc/83/81/29/942838129.db2.gz ZAWRUVOFJTYKMN-UHFFFAOYSA-N 0 0 368.267 3.681 20 5 FHBDRN Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)N[C@@H]1CCCC[C@H]1n1cccn1 ZINC000367093075 942839472 /nfs/dbraw/zinc/83/94/72/942839472.db2.gz RFRZTKJDTOPXKW-UKRRQHHQSA-N 0 0 361.377 3.544 20 5 FHBDRN CCc1cccc(CC)c1NC(=O)COc1ccc(OC)c([N+](=O)[O-])c1 ZINC000190194326 942853345 /nfs/dbraw/zinc/85/33/45/942853345.db2.gz HBZVHFWYMXNBNH-UHFFFAOYSA-N 0 0 358.394 3.746 20 5 FHBDRN COc1ccc(OCC(=O)Nc2sc(C)c(C)c2C)cc1[N+](=O)[O-] ZINC000190196600 942853704 /nfs/dbraw/zinc/85/37/04/942853704.db2.gz MGUINPSHLYZHJU-UHFFFAOYSA-N 0 0 350.396 3.608 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@H](O)c2ccccc2C1 ZINC000378525500 942861601 /nfs/dbraw/zinc/86/16/01/942861601.db2.gz FTMTZVDVIDCLCI-UGSOOPFHSA-N 0 0 372.446 3.541 20 5 FHBDRN Cc1ccc(-c2noc([C@H](C)Oc3ccc([N+](=O)[O-])c(CO)c3)n2)cc1F ZINC000431879232 942862564 /nfs/dbraw/zinc/86/25/64/942862564.db2.gz CLTOAYCRSHTYAY-NSHDSACASA-N 0 0 373.340 3.725 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1cccc(O)c1)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000412378835 942863096 /nfs/dbraw/zinc/86/30/96/942863096.db2.gz MYAOJMPLRPQVHT-LSTHTHJFSA-N 0 0 366.417 3.810 20 5 FHBDRN C[C@@H](Nc1ccc(C(=O)N[C@@H]2C[C@H]3C[C@H]3C2)cc1[N+](=O)[O-])c1ccccn1 ZINC000425133935 942865123 /nfs/dbraw/zinc/86/51/23/942865123.db2.gz FHPNGDJHTSKMLI-DMRZNYOFSA-N 0 0 366.421 3.691 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])c1csc(Cc2cccc(F)c2)n1 ZINC000502950087 942865328 /nfs/dbraw/zinc/86/53/28/942865328.db2.gz PFBAHEJBMPKBJA-UHFFFAOYSA-N 0 0 371.393 3.711 20 5 FHBDRN C[C@@H]1C[C@H](NC(=O)c2c(N)cccc2[N+](=O)[O-])C[C@@H](c2ccccc2)C1 ZINC000413995307 942874953 /nfs/dbraw/zinc/87/49/53/942874953.db2.gz STXXGWMMUGVSSW-BPUTZDHNSA-N 0 0 353.422 3.879 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])c2cccnc12)N[C@@H]1CCC[C@H](C2CC2)C1 ZINC000425145241 942879779 /nfs/dbraw/zinc/87/97/79/942879779.db2.gz GDVLIZQONPITKG-LSDHHAIUSA-N 0 0 369.421 3.607 20 5 FHBDRN O=[N+]([O-])c1ccccc1CNc1ccc(Cl)c(CN2CCOCC2)c1 ZINC000430091559 942885210 /nfs/dbraw/zinc/88/52/10/942885210.db2.gz XWMBMCKFOQXOEA-UHFFFAOYSA-N 0 0 361.829 3.693 20 5 FHBDRN CC[C@@H]1CCc2nc(NC(=O)c3cc([N+](=O)[O-])ccc3OC)sc2C1 ZINC000502987467 942885714 /nfs/dbraw/zinc/88/57/14/942885714.db2.gz HHCVTDLOMBARED-SNVBAGLBSA-N 0 0 361.423 3.827 20 5 FHBDRN C[C@H](Cc1ccccc1Br)NC(=O)c1ccccc1[N+](=O)[O-] ZINC000133619645 942886310 /nfs/dbraw/zinc/88/63/10/942886310.db2.gz LJULUOCJOSNCPT-LLVKDONJSA-N 0 0 363.211 3.718 20 5 FHBDRN CC(C)CCOc1ccccc1CNC(=O)c1cc([O-])ccc1[N+](=O)[O-] ZINC000509977926 942886524 /nfs/dbraw/zinc/88/65/24/942886524.db2.gz XIEFGBWCKWEYQJ-UHFFFAOYSA-N 0 0 358.394 3.655 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)N1CCC[C@@H](CC(F)(F)F)C1 ZINC000421937902 942888751 /nfs/dbraw/zinc/88/87/51/942888751.db2.gz JCJSRHAGDWHFFH-ZDUSSCGKSA-N 0 0 373.375 3.978 20 5 FHBDRN COc1cc(C(=O)N[C@@H](C)c2ccc(F)c(C)c2)cc([N+](=O)[O-])c1OC ZINC000434164069 942890637 /nfs/dbraw/zinc/89/06/37/942890637.db2.gz POFSAHSAEBRMAS-NSHDSACASA-N 0 0 362.357 3.551 20 5 FHBDRN C[C@@H](NC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)[C@@H](C)c1ccccc1 ZINC000473550753 942897597 /nfs/dbraw/zinc/89/75/97/942897597.db2.gz LWDUNBBFQFWVOD-HUUCEWRRSA-N 0 0 364.405 3.703 20 5 FHBDRN C[C@@H](NC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)[C@H](C)c1ccccc1 ZINC000473550755 942898594 /nfs/dbraw/zinc/89/85/94/942898594.db2.gz LWDUNBBFQFWVOD-LSDHHAIUSA-N 0 0 364.405 3.703 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)N1CCC[C@@H](CC(F)(F)F)C1 ZINC000421948229 942901358 /nfs/dbraw/zinc/90/13/58/942901358.db2.gz VUAQKASMYSGNFA-LBPRGKRZSA-N 0 0 369.343 3.741 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CCC[C@@H](CC(F)(F)F)C2)c1 ZINC000421973894 942911792 /nfs/dbraw/zinc/91/17/92/942911792.db2.gz VZIZBMKJTBGRHI-NSHDSACASA-N 0 0 360.332 3.798 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H](CC)O[C@@H](CC)C1 ZINC000421987786 942921375 /nfs/dbraw/zinc/92/13/75/942921375.db2.gz ULBJVLACBFAPNE-OKILXGFUSA-N 0 0 352.456 3.736 20 5 FHBDRN O=[N+]([O-])c1ccc(NCc2ccc3c(c2)OCCCO3)c2ncccc12 ZINC000066818877 942923259 /nfs/dbraw/zinc/92/32/59/942923259.db2.gz UBGHQAVYTCDPCC-UHFFFAOYSA-N 0 0 351.362 3.916 20 5 FHBDRN CC[C@@H]1C[C@@H](NC(=O)c2cccc3c(=O)c4cccc(F)c4[nH]c23)CCO1 ZINC000421993431 942927463 /nfs/dbraw/zinc/92/74/63/942927463.db2.gz RULAASGYZDMZFE-QWHCGFSZSA-N 0 0 368.408 3.508 20 5 FHBDRN CN([C@H]1CCC[C@@H]1c1ccccc1)S(=O)(=O)c1ccc([N+](=O)[O-])s1 ZINC000416539555 942929867 /nfs/dbraw/zinc/92/98/67/942929867.db2.gz DMWUGGLWPNIOKO-KGLIPLIRSA-N 0 0 366.464 3.613 20 5 FHBDRN CN([C@@H]1CCC[C@H]1c1ccccc1)S(=O)(=O)c1ccc([N+](=O)[O-])s1 ZINC000416539556 942929949 /nfs/dbraw/zinc/92/99/49/942929949.db2.gz DMWUGGLWPNIOKO-UONOGXRCSA-N 0 0 366.464 3.613 20 5 FHBDRN COCC[C@H](NC(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1)C(C)(C)C ZINC000511566452 942940651 /nfs/dbraw/zinc/94/06/51/942940651.db2.gz PGWMXJSDVPJNSK-CJNGLKHVSA-N 0 0 351.447 3.715 20 5 FHBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])NCc1cc(C2CC2)no1 ZINC000894269167 942941594 /nfs/dbraw/zinc/94/15/94/942941594.db2.gz PMGIQNAGDYGSSQ-UHFFFAOYSA-N 0 0 367.814 3.522 20 5 FHBDRN Cc1ccc([C@@]2(C)CCN(CC(=O)Nc3c(C)cccc3[N+](=O)[O-])C2)cc1 ZINC000434751847 942943510 /nfs/dbraw/zinc/94/35/10/942943510.db2.gz JDRUIZQVYQUTHA-NRFANRHFSA-N 0 0 367.449 3.814 20 5 FHBDRN COc1ccc2c(c1)C[C@H](C(C)C)CN2C(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000422031277 942946944 /nfs/dbraw/zinc/94/69/44/942946944.db2.gz BXRXAABXYDULMQ-AWEZNQCLSA-N 0 0 369.421 3.661 20 5 FHBDRN CCOc1ccc(C(=O)N2CC=C(c3cccc(OC)c3)C2)cc1[N+](=O)[O-] ZINC000378609393 942949505 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CCc1ccc(C(=O)NCCc2cn(C)c3cc(F)ccc23)cc1[N+](=O)[O-] ZINC001269866702 942996979 /nfs/dbraw/zinc/99/69/79/942996979.db2.gz USHNTLYFRDQHDI-UHFFFAOYSA-N 0 0 369.396 3.761 20 5 FHBDRN CCCN(CC)c1ccc(C(=O)NCCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000503140945 942997680 /nfs/dbraw/zinc/99/76/80/942997680.db2.gz NKCLXVNGXPQGDM-UHFFFAOYSA-N 0 0 355.438 3.804 20 5 FHBDRN O=C(Nc1ccc(C(=O)N2CCCCCC2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000014836115 943000007 /nfs/dbraw/zinc/00/00/07/943000007.db2.gz XKDYRIUQZJNMFX-UHFFFAOYSA-N 0 0 367.405 3.863 20 5 FHBDRN CSc1c(F)cc(NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)cc1F ZINC000184348194 943002294 /nfs/dbraw/zinc/00/22/94/943002294.db2.gz GEELZJBSLCPBGO-UHFFFAOYSA-N 0 0 364.333 3.724 20 5 FHBDRN O=C(NCCCO[C@@H]1CCCc2ccccc21)c1ccc([N+](=O)[O-])cc1 ZINC000505545017 943002597 /nfs/dbraw/zinc/00/25/97/943002597.db2.gz MQKZLEWUBBONMZ-LJQANCHMSA-N 0 0 354.406 3.809 20 5 FHBDRN O=C(NCCCO[C@H]1CCCc2ccccc21)c1ccc([N+](=O)[O-])cc1 ZINC000505545016 943003000 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C[C@H]1c2c(Cl)cc(Cl)cc2CCN1CCn1cc([N+](=O)[O-])cn1 ZINC000434894268 943025125 /nfs/dbraw/zinc/02/51/25/943025125.db2.gz FCDZXRPQLRSEKD-JTQLQIEISA-N 0 0 355.225 3.717 20 5 FHBDRN Nn1c(S/C=C\c2ccc([N+](=O)[O-])o2)nnc1-c1cccc(Cl)c1 ZINC000205676524 943031415 /nfs/dbraw/zinc/03/14/15/943031415.db2.gz QEPHMBGTOJCQFJ-SREVYHEPSA-N 0 0 363.786 3.577 20 5 FHBDRN O=C(COc1cccc([N+](=O)[O-])c1)NCC1(c2ccc(F)cc2)CCCC1 ZINC000514465396 943035048 /nfs/dbraw/zinc/03/50/48/943035048.db2.gz FPVPNSZWCABNOY-UHFFFAOYSA-N 0 0 372.396 3.741 20 5 FHBDRN O=C(c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)N1CCc2ccc(Cl)cc21 ZINC000058725003 943055311 /nfs/dbraw/zinc/05/53/11/943055311.db2.gz PWTIZJKCPALURV-UHFFFAOYSA-N 0 0 368.780 3.637 20 5 FHBDRN CC[C@@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1cccc(Cl)c1 ZINC000514502456 943066048 /nfs/dbraw/zinc/06/60/48/943066048.db2.gz HEUCNIDPUYGMSJ-OAHLLOKOSA-N 0 0 354.815 3.678 20 5 FHBDRN C[C@H](c1ccco1)N(C)C(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000120255181 943067386 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FHBDRN Cc1ccc(C(C)C)c(OCC(=O)NCCNc2ccc([N+](=O)[O-])cc2)c1 ZINC000008175118 943087789 /nfs/dbraw/zinc/08/77/89/943087789.db2.gz FRNUJAIMSMIMAK-UHFFFAOYSA-N 0 0 371.437 3.634 20 5 FHBDRN COCC[C@H](Nc1ccc([N+](=O)[O-])c(-c2ccccc2)n1)c1ccco1 ZINC000503257458 943089069 /nfs/dbraw/zinc/08/90/69/943089069.db2.gz SFKZSYCQNIAKTA-HNNXBMFYSA-N 0 0 353.378 3.861 20 5 FHBDRN CCc1ccc(CN(C(=O)COc2ccc([N+](=O)[O-])cc2)C2CC2)cc1 ZINC000514531539 943089325 /nfs/dbraw/zinc/08/93/25/943089325.db2.gz IWODSEFXMMIWJU-UHFFFAOYSA-N 0 0 354.406 3.727 20 5 FHBDRN CCN(Cc1ccc(OC)cc1OC)C(=O)c1cc([N+](=O)[O-])c(C)s1 ZINC000514534772 943092327 /nfs/dbraw/zinc/09/23/27/943092327.db2.gz XZTANJBRULUHDQ-UHFFFAOYSA-N 0 0 364.423 3.644 20 5 FHBDRN C[C@@H](NC(=O)N(C)CCc1cccc([N+](=O)[O-])c1)[C@@H](C)c1ccccc1 ZINC000511581731 943093268 /nfs/dbraw/zinc/09/32/68/943093268.db2.gz RAGDXIQCNGOPEG-HZPDHXFCSA-N 0 0 355.438 3.971 20 5 FHBDRN C[C@H](CCNC(=O)[C@H]1CC(c2ccccc2[N+](=O)[O-])=NO1)CC(C)(C)C ZINC001269251914 943098221 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O=C(Nc1ncsc1C1CC1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000893274405 943122788 /nfs/dbraw/zinc/12/27/88/943122788.db2.gz KERASQVDPYSCBG-UHFFFAOYSA-N 0 0 355.322 3.782 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1C[NH2+]C[C@H](c1ccc(C)o1)N1CCCC1 ZINC000236847961 943123712 /nfs/dbraw/zinc/12/37/12/943123712.db2.gz QACKTULCPDNPOR-GOSISDBHSA-N 0 0 373.453 3.822 20 5 FHBDRN Cc1ccc([C@@H](CC(=O)OC(C)C)NC(=O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000014383047 943128241 /nfs/dbraw/zinc/12/82/41/943128241.db2.gz NZIIWKWNOVWYNW-GOSISDBHSA-N 0 0 370.405 3.716 20 5 FHBDRN COc1cc(CCC(=O)Nc2ccc([N+](=O)[O-])cc2F)ccc1Cl ZINC000435063741 943137664 /nfs/dbraw/zinc/13/76/64/943137664.db2.gz LEEXVABOVIVAJF-UHFFFAOYSA-N 0 0 352.749 3.967 20 5 FHBDRN Cc1c(NC(=O)CN[C@H](c2ccccc2)C(F)(F)F)cccc1[N+](=O)[O-] ZINC000126382597 943139592 /nfs/dbraw/zinc/13/95/92/943139592.db2.gz GKAGDSLHEVZNFA-MRXNPFEDSA-N 0 0 367.327 3.735 20 5 FHBDRN Cc1c(C(=O)N[C@H](CC(=O)OC(C)C)c2ccccc2)cccc1[N+](=O)[O-] ZINC000014398579 943156876 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COc1ccc([N+](=O)[O-])cc1NC(=O)NCCCSc1ccccc1 ZINC000503691238 943334610 /nfs/dbraw/zinc/33/46/10/943334610.db2.gz ABMXEGVEBATCBE-UHFFFAOYSA-N 0 0 361.423 3.907 20 5 FHBDRN COC(=O)c1cc([N+](=O)[O-])c(=O)n(Cc2ccc(C3CCCCC3)cc2)c1 ZINC000505665952 943339740 /nfs/dbraw/zinc/33/97/40/943339740.db2.gz SSRYHKSJLKKTKH-UHFFFAOYSA-N 0 0 370.405 3.639 20 5 FHBDRN O=[N+]([O-])c1ccc(NCc2nnc3ccc(C(F)(F)F)cn32)c(Cl)c1 ZINC000053215443 943344725 /nfs/dbraw/zinc/34/47/25/943344725.db2.gz BROOKVFKTCKCRE-UHFFFAOYSA-N 0 0 371.706 3.922 20 5 FHBDRN Cc1c(NC(=O)c2cc(C)ccc2[N+](=O)[O-])cnn1-c1ccccc1F ZINC000435381240 943369958 /nfs/dbraw/zinc/36/99/58/943369958.db2.gz VRGNXGASWYJZOJ-UHFFFAOYSA-N 0 0 354.341 3.789 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1CCC[C@@H]1/C=C\c1ccccc1 ZINC000503801596 943374687 /nfs/dbraw/zinc/37/46/87/943374687.db2.gz VQQJYMKREBXMNX-MUSGIIIZSA-N 0 0 372.446 3.770 20 5 FHBDRN O=C(Nc1ncc(C(F)(F)F)s1)[C@@H]1C[C@H]1c1cccc([N+](=O)[O-])c1 ZINC001269446138 943376280 /nfs/dbraw/zinc/37/62/80/943376280.db2.gz WZFODTJSHVRSEP-VHSXEESVSA-N 0 0 357.313 3.812 20 5 FHBDRN O=C(N[C@@H](Cc1ccc(Cl)cc1)c1ccccn1)c1ccc([N+](=O)[O-])o1 ZINC000503840319 943381171 /nfs/dbraw/zinc/38/11/71/943381171.db2.gz MBFDBUXGXKJAHE-HNNXBMFYSA-N 0 0 371.780 3.950 20 5 FHBDRN Cc1cccc(O[C@@H]2CCCC[C@H]2NC(=O)Cc2ccccc2[N+](=O)[O-])c1 ZINC000435407663 943383399 /nfs/dbraw/zinc/38/33/99/943383399.db2.gz MCVQGEIQCDEINS-UYAOXDASSA-N 0 0 368.433 3.952 20 5 FHBDRN CC(C)[C@@H](C(=O)NCCCCc1ccc([N+](=O)[O-])cc1)c1cccnc1 ZINC000435449632 943410389 /nfs/dbraw/zinc/41/03/89/943410389.db2.gz UFRSMOYYBLJHNM-LJQANCHMSA-N 0 0 355.438 3.869 20 5 FHBDRN C[C@@H](N[C@@H](Cn1ccccc1=O)c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000503926904 943412518 /nfs/dbraw/zinc/41/25/18/943412518.db2.gz IAHQFCOQDAWMSL-APWZRJJASA-N 0 0 363.417 3.849 20 5 FHBDRN CCc1occc1C(=O)NCCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000435468398 943430604 /nfs/dbraw/zinc/43/06/04/943430604.db2.gz OXOFZFJAWGWPAW-UHFFFAOYSA-N 0 0 371.315 3.611 20 5 FHBDRN COCCN(Cc1ccco1)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425386653 943448888 /nfs/dbraw/zinc/44/88/88/943448888.db2.gz SFLJEZYFJJUSHG-UHFFFAOYSA-N 0 0 369.215 3.599 20 5 FHBDRN C[C@H](NC(=O)N1CC[C@H](COc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000503981348 943451303 /nfs/dbraw/zinc/45/13/03/943451303.db2.gz IRQQRUMPNAORPC-HOTGVXAUSA-N 0 0 369.421 3.766 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)N1CCC[C@H]1/C=C/c1ccccc1 ZINC000504007600 943454839 /nfs/dbraw/zinc/45/48/39/943454839.db2.gz GFKBXNZIZAOTLD-MZEUMTGBSA-N 0 0 351.406 3.982 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2noc(CNc3ccc(F)c(F)c3F)n2)cc1 ZINC000055830607 943456075 /nfs/dbraw/zinc/45/60/75/943456075.db2.gz KOWCEUWVZGWVQB-UHFFFAOYSA-N 0 0 350.256 3.674 20 5 FHBDRN Cc1nc(Cc2noc(-c3ccc([N+](=O)[O-])c(OC(C)C)c3)n2)cs1 ZINC000417265518 943469023 /nfs/dbraw/zinc/46/90/23/943469023.db2.gz YVVBVUPAFBFADP-UHFFFAOYSA-N 0 0 360.395 3.788 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)OCc2ccc(C)cc2C)cc1OC ZINC001269480803 943473183 /nfs/dbraw/zinc/47/31/83/943473183.db2.gz FFBJNQXKJHZUOB-UHFFFAOYSA-N 0 0 359.378 3.976 20 5 FHBDRN CN(C)c1ccc(-c2noc([C@@H]3C[C@H]3c3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000417262045 943476131 /nfs/dbraw/zinc/47/61/31/943476131.db2.gz QTNGSGWWYAFESG-DLBZAZTESA-N 0 0 350.378 3.982 20 5 FHBDRN Cn1cc([N+](=O)[O-])c(C(=O)N(Cc2ccccc2)c2ccc(Cl)cc2)n1 ZINC000504094879 943498277 /nfs/dbraw/zinc/49/82/77/943498277.db2.gz VOFSULZVUWHVJE-UHFFFAOYSA-N 0 0 370.796 3.829 20 5 FHBDRN COc1ccc(CCCC(=O)Nc2ccc(C)c([N+](=O)[O-])c2)c(OC)c1 ZINC000513808771 943509948 /nfs/dbraw/zinc/50/99/48/943509948.db2.gz YSYGKKMDKQNVED-UHFFFAOYSA-N 0 0 358.394 3.882 20 5 FHBDRN CNC(=O)c1ccc(N[C@@H]2CCCC[C@H]2OCCC(C)C)c([N+](=O)[O-])c1 ZINC000435603081 943512448 /nfs/dbraw/zinc/51/24/48/943512448.db2.gz YSIGKBAHXQTJFI-SJLPKXTDSA-N 0 0 363.458 3.740 20 5 FHBDRN COc1cccc(NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)c1OC ZINC000894308529 943515271 /nfs/dbraw/zinc/51/52/71/943515271.db2.gz PXMAASPSUSTGDH-UHFFFAOYSA-N 0 0 362.357 3.667 20 5 FHBDRN CC(C)(C)O[C@H](C(=O)NCCNc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000513810257 943524371 /nfs/dbraw/zinc/52/43/71/943524371.db2.gz YATAWVHNBHYGKC-SFHVURJKSA-N 0 0 371.437 3.679 20 5 FHBDRN Cc1c(N[C@H]2CCCCc3ccc([N+](=O)[O-])cc32)cnn1[C@@H]1CCOC1 ZINC000417348096 943527729 /nfs/dbraw/zinc/52/77/29/943527729.db2.gz IKKNVZDEHOSYMW-AEFFLSMTSA-N 0 0 356.426 3.941 20 5 FHBDRN Cc1nc2ccccc2c2c(NC(=O)Cc3ccnn3C)c3ccccc3n21 ZINC000435647045 943535590 /nfs/dbraw/zinc/53/55/90/943535590.db2.gz QHFQJNAWOYRDPP-UHFFFAOYSA-N 0 0 369.428 3.864 20 5 FHBDRN Cc1cc(N2C[C@H](C)O[C@@]3(CCO[C@@H]3C)C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000515156629 943537466 /nfs/dbraw/zinc/53/74/66/943537466.db2.gz YYUMWPCWSISHFJ-OZVIIMIRSA-N 0 0 374.359 3.695 20 5 FHBDRN Cc1cc(OCC(=O)N[C@H]2CCC[C@H]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC001126416080 943543536 /nfs/dbraw/zinc/54/35/36/943543536.db2.gz ZYRBFAWGPAHXLD-HKUYNNGSSA-N 0 0 368.433 3.810 20 5 FHBDRN CCCC[C@@H](SCc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc(C)on1 ZINC000513812597 943552762 /nfs/dbraw/zinc/55/27/62/943552762.db2.gz NWKDKWDEASUIIH-OAHLLOKOSA-N 0 0 363.439 3.744 20 5 FHBDRN CC(C)COC1CCN(Cc2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000425400236 943556456 /nfs/dbraw/zinc/55/64/56/943556456.db2.gz CRKIOUPRYJWCMV-UHFFFAOYSA-N 0 0 371.275 3.994 20 5 FHBDRN CSc1cnn(-c2ccccc2)c1NC(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000150717113 943559073 /nfs/dbraw/zinc/55/90/73/943559073.db2.gz IERGXSUFOHHARS-UHFFFAOYSA-N 0 0 368.418 3.684 20 5 FHBDRN CC(C)(C)c1ccc(CCNC(=O)COc2ccc([N+](=O)[O-])cc2)cc1 ZINC000515197506 943560903 /nfs/dbraw/zinc/56/09/03/943560903.db2.gz MVSOETBNNZQFRF-UHFFFAOYSA-N 0 0 356.422 3.630 20 5 FHBDRN Cc1cc(OCC(=O)Nc2ccc(F)cc2NC(C)C)ccc1[N+](=O)[O-] ZINC000435702722 943566018 /nfs/dbraw/zinc/56/60/18/943566018.db2.gz BZEQXPQLXWJFCO-UHFFFAOYSA-N 0 0 361.373 3.880 20 5 FHBDRN C[C@@H](Oc1ccc(F)c(F)c1)C(=O)N1c2ccc([N+](=O)[O-])cc2C[C@H]1C ZINC000504274677 943568213 /nfs/dbraw/zinc/56/82/13/943568213.db2.gz MGJXJZKLPDMGAP-GHMZBOCLSA-N 0 0 362.332 3.618 20 5 FHBDRN C[C@@H](Oc1ccccc1Cl)C(=O)N1c2ccc([N+](=O)[O-])cc2C[C@H]1C ZINC000504278471 943570213 /nfs/dbraw/zinc/57/02/13/943570213.db2.gz CHNMVVMIRRNDRK-VXGBXAGGSA-N 0 0 360.797 3.993 20 5 FHBDRN CCOc1ccc([C@@H]2C[C@H]2NC(=O)Nc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000435728174 943571282 /nfs/dbraw/zinc/57/12/82/943571282.db2.gz IVLYTOLPQWLYHB-WMLDXEAASA-N 0 0 359.357 3.810 20 5 FHBDRN C[C@@H]1CCCN(c2ccc(C(=O)NCc3ccsc3)cc2[N+](=O)[O-])C1 ZINC000515213438 943575210 /nfs/dbraw/zinc/57/52/10/943575210.db2.gz FSVPNYLTXBTUPB-CYBMUJFWSA-N 0 0 359.451 3.823 20 5 FHBDRN Cc1cccc(OCCC(=O)N2c3ccc([N+](=O)[O-])cc3C[C@H]2C)c1C ZINC000504312059 943586373 /nfs/dbraw/zinc/58/63/73/943586373.db2.gz XSBVEKPUFJDTHN-CQSZACIVSA-N 0 0 354.406 3.958 20 5 FHBDRN O=C(NCCc1ccccc1[N+](=O)[O-])N(Cc1ccc(F)cc1)C1CC1 ZINC000074763659 943591181 /nfs/dbraw/zinc/59/11/81/943591181.db2.gz GVHADFNIGFACHU-UHFFFAOYSA-N 0 0 357.385 3.651 20 5 FHBDRN O=C(Nc1c2c(cc3c1CCC3)CCC2)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000515264810 943600353 /nfs/dbraw/zinc/60/03/53/943600353.db2.gz YNYSAKVBRLWSQY-UHFFFAOYSA-N 0 0 366.373 3.553 20 5 FHBDRN C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1ccccc1OCC1CC1 ZINC000504352710 943602896 /nfs/dbraw/zinc/60/28/96/943602896.db2.gz DOCQSCJMXNQUMX-CYBMUJFWSA-N 0 0 352.390 3.975 20 5 FHBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1nc(C(C)(C)C)co1 ZINC000584787325 943613786 /nfs/dbraw/zinc/61/37/86/943613786.db2.gz BYMXFCSQRHVDLR-VIFPVBQESA-N 0 0 367.789 3.940 20 5 FHBDRN CC[C@@H](CC(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1)c1ccccc1 ZINC000504389250 943618354 /nfs/dbraw/zinc/61/83/54/943618354.db2.gz VRZWXXRSTXDKQH-KRWDZBQOSA-N 0 0 367.449 3.827 20 5 FHBDRN COC(=O)COc1ccc([C@H](C)Nc2c(F)cc([N+](=O)[O-])cc2F)cc1 ZINC000183978474 943681829 /nfs/dbraw/zinc/68/18/29/943681829.db2.gz FSTMGZRHMUARHB-JTQLQIEISA-N 0 0 366.320 3.598 20 5 FHBDRN C[C@H](c1ccccc1)N(C)C(=O)CN(C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000504590205 943701365 /nfs/dbraw/zinc/70/13/65/943701365.db2.gz QLAARRGQTBDYJZ-JZUUQJBKSA-N 0 0 367.449 3.759 20 5 FHBDRN CC(C)(C)Oc1ccncc1NC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000504618571 943708727 /nfs/dbraw/zinc/70/87/27/943708727.db2.gz ASSCYEHMZIXOGT-UHFFFAOYSA-N 0 0 354.366 3.901 20 5 FHBDRN O=C([O-])[C@H](CC[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1)c1ccccc1 ZINC000584474893 943741537 /nfs/dbraw/zinc/74/15/37/943741537.db2.gz MAWPAWKNTSWWKU-LJQANCHMSA-N 0 0 354.406 3.818 20 5 FHBDRN CCSc1ccc([C@H](C)NC(=O)COc2ccc([N+](=O)[O-])cc2)cc1 ZINC000504704651 943749542 /nfs/dbraw/zinc/74/95/42/943749542.db2.gz YPQRGJMSLQFLCC-ZDUSSCGKSA-N 0 0 360.435 3.963 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N[C@@H]1C[C@H]1c1ccc(Cl)c(F)c1 ZINC000437383895 943768032 /nfs/dbraw/zinc/76/80/32/943768032.db2.gz JONFIKPHCOTCQK-WMLDXEAASA-N 0 0 362.788 3.992 20 5 FHBDRN CC(C)Oc1nc(N2CC=C(c3ccc(O)cc3)CC2)ccc1[N+](=O)[O-] ZINC000516877721 943787237 /nfs/dbraw/zinc/78/72/37/943787237.db2.gz KRJBNPKBIAKWQP-UHFFFAOYSA-N 0 0 355.394 3.776 20 5 FHBDRN Cc1ccc(CN(C)C(=O)c2cccc3c(=O)c4cccc(F)c4[nH]c23)o1 ZINC000435819549 943793533 /nfs/dbraw/zinc/79/35/33/943793533.db2.gz SRFBRSYNANVHSJ-UHFFFAOYSA-N 0 0 364.376 3.994 20 5 FHBDRN O=C(NCc1cccs1)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12 ZINC000435825460 943797991 /nfs/dbraw/zinc/79/79/91/943797991.db2.gz IBJSHTSPZHUALR-UHFFFAOYSA-N 0 0 370.380 3.951 20 5 FHBDRN COc1cc(CNc2ccc(-n3cc(C)cn3)c(F)c2)c([N+](=O)[O-])cc1F ZINC000184014178 943798905 /nfs/dbraw/zinc/79/89/05/943798905.db2.gz WBFLPRIPSYNUFN-UHFFFAOYSA-N 0 0 374.347 3.988 20 5 FHBDRN CNc1c(C(=O)N[C@H]2C[C@H](c3cccc(Cl)c3)C2)cccc1[N+](=O)[O-] ZINC000437428338 943799431 /nfs/dbraw/zinc/79/94/31/943799431.db2.gz ROUBEERUJMGQCF-MQMHXKEQSA-N 0 0 359.813 3.966 20 5 FHBDRN CC(C)[C@@H](NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1)C1(CO)CCC1 ZINC000516895474 943811047 /nfs/dbraw/zinc/81/10/47/943811047.db2.gz VHSXKOXDHLQEHJ-MRXNPFEDSA-N 0 0 362.451 3.727 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1ccnc(N2CC[C@H](C)C2)c1 ZINC000437437403 943815090 /nfs/dbraw/zinc/81/50/90/943815090.db2.gz VYISHWIGAXMHAX-LBPRGKRZSA-N 0 0 354.410 3.705 20 5 FHBDRN O=C(NCCCOc1ccccc1)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000435871896 943825490 /nfs/dbraw/zinc/82/54/90/943825490.db2.gz MFSOIVQKNWQYQK-UHFFFAOYSA-N 0 0 372.424 3.880 20 5 FHBDRN COc1cccc(C(=O)NCc2ccc(-c3ccncc3)cc2)c1[N+](=O)[O-] ZINC000435872963 943826586 /nfs/dbraw/zinc/82/65/86/943826586.db2.gz AGIXODGMDCIPBP-UHFFFAOYSA-N 0 0 363.373 3.595 20 5 FHBDRN CCCC1CCC(N(C(=O)CCn2cc([N+](=O)[O-])cn2)C(C)C)CC1 ZINC000504840050 943828061 /nfs/dbraw/zinc/82/80/61/943828061.db2.gz KUOBONFUUMFZGL-UHFFFAOYSA-N 0 0 350.463 3.777 20 5 FHBDRN Cn1c(-c2nc(-c3ccc(Oc4ccccc4)nc3)no2)ccc1[N+](=O)[O-] ZINC000504820843 943828140 /nfs/dbraw/zinc/82/81/40/943828140.db2.gz OUIHEOQWNQPJSD-UHFFFAOYSA-N 0 0 363.333 3.838 20 5 FHBDRN CCOC(=O)c1sc([C@@H](C)NCc2ccc([N+](=O)[O-])cc2F)nc1C ZINC000584866660 943828565 /nfs/dbraw/zinc/82/85/65/943828565.db2.gz SQSYCIHLLKECLH-SNVBAGLBSA-N 0 0 367.402 3.526 20 5 FHBDRN O=C(Nc1ncn(-c2cccnc2)n1)c1cc2ccccc2c2cccnc12 ZINC000366638824 943832222 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KNMHUMCWSOLWAL-KBPBESRZSA-N 0 0 373.375 3.805 20 5 FHBDRN C[C@@H](NC(=O)N1CC2(CCC2)[C@H]1C1CCOCC1)c1cccc([N+](=O)[O-])c1 ZINC000425420401 943866525 /nfs/dbraw/zinc/86/65/25/943866525.db2.gz SCUZDQKQPZZBHL-RDTXWAMCSA-N 0 0 373.453 3.647 20 5 FHBDRN C[C@@H]1CN(C(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[C@H]1C ZINC000435935156 943868898 /nfs/dbraw/zinc/86/88/98/943868898.db2.gz BTHKMBNYXNQBLM-GHMZBOCLSA-N 0 0 359.348 3.530 20 5 FHBDRN COC(=O)CCSCc1cccc(NC(=O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000504884314 943883440 /nfs/dbraw/zinc/88/34/40/943883440.db2.gz YZEQMWMZIINQCT-UHFFFAOYSA-N 0 0 374.418 3.643 20 5 FHBDRN O=C(NC(C1CC1)C1CC1)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000435950196 943888302 /nfs/dbraw/zinc/88/83/02/943888302.db2.gz QBXGHCHEFXSPNT-UHFFFAOYSA-N 0 0 350.393 3.739 20 5 FHBDRN Cc1c(NC(=O)N[C@@H]2CCC[C@@H]2C)cc(Br)cc1[N+](=O)[O-] ZINC000504895150 943893451 /nfs/dbraw/zinc/89/34/51/943893451.db2.gz MWXUVPKQCFTQNT-GZMMTYOYSA-N 0 0 356.220 3.976 20 5 FHBDRN 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ZINC000426259625 944265800 /nfs/dbraw/zinc/26/58/00/944265800.db2.gz ZKCKVFKGVFEKNU-WDEREUQCSA-N 0 0 359.348 3.944 20 5 FHBDRN COc1ccccc1OC[C@H](C)CNc1c2c(ccc1[N+](=O)[O-])NCC2 ZINC000436406564 944266448 /nfs/dbraw/zinc/26/64/48/944266448.db2.gz IHKTWCSJBCLBST-CYBMUJFWSA-N 0 0 357.410 3.698 20 5 FHBDRN CCN(C[C@@H](O)COc1ccccc1[N+](=O)[O-])c1cccc(Cl)c1 ZINC000543133218 944266516 /nfs/dbraw/zinc/26/65/16/944266516.db2.gz DBIIWSWZHZAFNY-OAHLLOKOSA-N 0 0 350.802 3.514 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)NCCCc1c[nH]c2ccccc12 ZINC000517417477 944270657 /nfs/dbraw/zinc/27/06/57/944270657.db2.gz XDPZZHQXUSYDCO-UHFFFAOYSA-N 0 0 368.393 3.839 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCC(Oc2ncccc2C)CC1 ZINC000515851714 944273419 /nfs/dbraw/zinc/27/34/19/944273419.db2.gz QPTUQGXWFSKVGQ-UHFFFAOYSA-N 0 0 369.421 3.599 20 5 FHBDRN CC(=O)N(C)c1cccc(Nc2cc(C(F)(F)F)ncc2[N+](=O)[O-])c1 ZINC000436399718 944275154 /nfs/dbraw/zinc/27/51/54/944275154.db2.gz ZTTTTYGRENNVKP-UHFFFAOYSA-N 0 0 354.288 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944337986 /nfs/dbraw/zinc/33/79/86/944337986.db2.gz QDGOCWMZVNZTPZ-INIZCTEOSA-N 0 0 362.407 3.555 20 5 FHBDRN Cc1cc(OC[C@H](O)CO[C@@H]2CCCc3ccccc32)ccc1[N+](=O)[O-] ZINC000550175739 944346756 /nfs/dbraw/zinc/34/67/56/944346756.db2.gz KDJVFTRHIOXRLJ-OXJNMPFZSA-N 0 0 357.406 3.737 20 5 FHBDRN O=C(NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N1CC[C@H](C2CC2)C1 ZINC000426280147 944346936 /nfs/dbraw/zinc/34/69/36/944346936.db2.gz SMRJNFJLWRSSKA-LBPRGKRZSA-N 0 0 357.332 3.555 20 5 FHBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@](C)(O)CC1 ZINC000473586968 944347458 /nfs/dbraw/zinc/34/74/58/944347458.db2.gz KATJQUVSLWBPHE-SFHVURJKSA-N 0 0 366.483 3.720 20 5 FHBDRN Cc1c(CNC(=O)[C@@H](C)[C@H]2OCCc3sccc32)cccc1[N+](=O)[O-] ZINC000506177714 944348574 /nfs/dbraw/zinc/34/85/74/944348574.db2.gz DTUXFPHCYQGBDU-YVEFUNNKSA-N 0 0 360.435 3.531 20 5 FHBDRN COc1cc(C(=O)NCc2cccc(OCC(C)C)c2)ccc1[N+](=O)[O-] ZINC000511657570 944351896 /nfs/dbraw/zinc/35/18/96/944351896.db2.gz YCCHXUQOGDRQPN-UHFFFAOYSA-N 0 0 358.394 3.568 20 5 FHBDRN Cc1nn([C@H](C)C(=O)N[C@H](C)c2ccc(Cl)cc2Cl)cc1[N+](=O)[O-] ZINC000436472843 944352324 /nfs/dbraw/zinc/35/23/24/944352324.db2.gz ARGRJKDXGJBTBI-PSASIEDQSA-N 0 0 371.224 3.845 20 5 FHBDRN C/C=C\c1ccc(OC[C@H](O)COc2cccc(C)c2[N+](=O)[O-])c(OC)c1 ZINC000550179205 944357193 /nfs/dbraw/zinc/35/71/93/944357193.db2.gz VMLUPBDOFFTLAY-LEXSJLIMSA-N 0 0 373.405 3.764 20 5 FHBDRN C/C=C/c1ccc(OC[C@H](O)COc2cccc(C)c2[N+](=O)[O-])c(OC)c1 ZINC000550179208 944357223 /nfs/dbraw/zinc/35/72/23/944357223.db2.gz VMLUPBDOFFTLAY-NBUZRDOWSA-N 0 0 373.405 3.764 20 5 FHBDRN O=C(c1ccc(NC2CC2)c([N+](=O)[O-])c1)N1CCc2c(F)ccc(F)c2C1 ZINC000438138663 944363444 /nfs/dbraw/zinc/36/34/44/944363444.db2.gz JZDJOSXAKNCUDC-UHFFFAOYSA-N 0 0 373.359 3.646 20 5 FHBDRN CO[C@@H]1Cc2ccccc2N(C(=O)c2cc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000500264464 944366257 /nfs/dbraw/zinc/36/62/57/944366257.db2.gz UIBMCVYZBKBQGK-OAHLLOKOSA-N 0 0 352.346 3.559 20 5 FHBDRN C[C@@]1(CNC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)CCOC2(CCC2)C1 ZINC000894662402 944367805 /nfs/dbraw/zinc/36/78/05/944367805.db2.gz HHPVLUBVDVYPNK-QGZVFWFLSA-N 0 0 366.845 3.646 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H]1CCCCS1 ZINC000544284378 944370461 /nfs/dbraw/zinc/37/04/61/944370461.db2.gz LUODAUBPMAGQAK-INIZCTEOSA-N 0 0 351.472 3.801 20 5 FHBDRN C[C@H](NC(=O)CSc1ccc([N+](=O)[O-])cc1)[C@H]1Oc2ccccc2[C@H]1C ZINC000438158167 944371294 /nfs/dbraw/zinc/37/12/94/944371294.db2.gz WFHTWARFKUCOHA-NQCMUKECSA-N 0 0 372.446 3.756 20 5 FHBDRN CC[C@H](O)CN(Cc1ccccc1)Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000184267216 944371486 /nfs/dbraw/zinc/37/14/86/944371486.db2.gz XKEQRKLAQALTPB-INIZCTEOSA-N 0 0 362.401 3.516 20 5 FHBDRN C[C@H](NC(=O)CSc1ccc([N+](=O)[O-])cc1)[C@H]1Oc2ccccc2[C@@H]1C ZINC000438158166 944371698 /nfs/dbraw/zinc/37/16/98/944371698.db2.gz WFHTWARFKUCOHA-JMERFSKESA-N 0 0 372.446 3.756 20 5 FHBDRN C[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)[C@@H]1Oc2ccccc2[C@H]1C ZINC000438141603 944374235 /nfs/dbraw/zinc/37/42/35/944374235.db2.gz PYVHCNLONVGVPT-VGTOOOLASA-N 0 0 360.797 3.931 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)c1c(Cl)nccc1C(F)(F)F ZINC000123544939 944377370 /nfs/dbraw/zinc/37/73/70/944377370.db2.gz VBYYXZDXWXUKML-UHFFFAOYSA-N 0 0 359.691 3.592 20 5 FHBDRN Cc1ccccc1-n1cc(C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)cn1 ZINC000086624696 944379275 /nfs/dbraw/zinc/37/92/75/944379275.db2.gz VNWSLHCYHKGIQZ-UHFFFAOYSA-N 0 0 350.378 3.958 20 5 FHBDRN COCc1cccc2sc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)nc21 ZINC000517553396 944386085 /nfs/dbraw/zinc/38/60/85/944386085.db2.gz WYSNJGXIAZUTCD-UHFFFAOYSA-N 0 0 361.354 3.742 20 5 FHBDRN COc1ccc2[nH]c(-c3nc(Cc4ccccc4[N+](=O)[O-])no3)cc2c1 ZINC000519564307 944390132 /nfs/dbraw/zinc/39/01/32/944390132.db2.gz SUJQKGLYVUELQW-UHFFFAOYSA-N 0 0 350.334 3.726 20 5 FHBDRN Cc1cccc(Cn2nccc2NC(=O)c2cc(F)cc([N+](=O)[O-])c2)c1 ZINC000517559877 944391473 /nfs/dbraw/zinc/39/14/73/944391473.db2.gz SAHOXROTVXFOPD-UHFFFAOYSA-N 0 0 354.341 3.539 20 5 FHBDRN C[C@]1(CNC(=O)CSc2ccc([N+](=O)[O-])cc2)CCOC2(CCC2)C1 ZINC000894673708 944391897 /nfs/dbraw/zinc/39/18/97/944391897.db2.gz PCXXNKXWRNDDGU-KRWDZBQOSA-N 0 0 364.467 3.543 20 5 FHBDRN COc1ccc(COCCCNC(=O)Nc2ccc([N+](=O)[O-])c(C)c2)cc1 ZINC000473770883 944394791 /nfs/dbraw/zinc/39/47/91/944394791.db2.gz NSELWPWGCQYDPG-UHFFFAOYSA-N 0 0 373.409 3.640 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1C[C@@H](OC)Cc2ccccc21 ZINC000500279957 944396631 /nfs/dbraw/zinc/39/66/31/944396631.db2.gz LBZINSLJUGTLFS-APWZRJJASA-N 0 0 368.433 3.768 20 5 FHBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC(=O)[C@@H](C)C1 ZINC000505844441 944399198 /nfs/dbraw/zinc/39/91/98/944399198.db2.gz GNAYURQXLMZUKP-LBPRGKRZSA-N 0 0 350.440 3.538 20 5 FHBDRN CC[C@H](C)NC(=O)c1ccc(Nc2nc3sccn3c2[N+](=O)[O-])cc1 ZINC000053578648 944399920 /nfs/dbraw/zinc/39/99/20/944399920.db2.gz QEWLLHTVXIUZAV-JTQLQIEISA-N 0 0 359.411 3.576 20 5 FHBDRN CCOc1ccc(CNC(=O)c2ccc(F)cc2[N+](=O)[O-])cc1Cl ZINC000517578302 944401247 /nfs/dbraw/zinc/40/12/47/944401247.db2.gz PNWBRDFPGJSUSI-UHFFFAOYSA-N 0 0 352.749 3.716 20 5 FHBDRN CCn1c(SCC(=O)CCC(C)C)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000123666375 944402626 /nfs/dbraw/zinc/40/26/26/944402626.db2.gz ALVNORMKULFYQF-UHFFFAOYSA-N 0 0 362.455 3.971 20 5 FHBDRN COC(=O)c1cc(NC(=O)C[C@@H](C)c2ccc(OC)cc2)cc([N+](=O)[O-])c1 ZINC000426299579 944406073 /nfs/dbraw/zinc/40/60/73/944406073.db2.gz XMSZKYYGLMRBBV-GFCCVEGCSA-N 0 0 372.377 3.522 20 5 FHBDRN O=C(N[C@H]1CCC[C@H]1c1ccccc1)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000518454905 944407845 /nfs/dbraw/zinc/40/78/45/944407845.db2.gz ARZBVSIKCASTOC-HOCLYGCPSA-N 0 0 350.378 3.537 20 5 FHBDRN Cc1cc(NC(=O)NCc2ccc(OC3CCCC3)nc2)ccc1[N+](=O)[O-] ZINC000473773024 944410170 /nfs/dbraw/zinc/41/01/70/944410170.db2.gz NEKHHHVSAAZGRF-UHFFFAOYSA-N 0 0 370.409 3.941 20 5 FHBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)N[C@@H]1C[C@H]1c1cccc(Cl)c1 ZINC000437775896 944411709 /nfs/dbraw/zinc/41/17/09/944411709.db2.gz PUPILCYTVNWGNA-DLBZAZTESA-N 0 0 359.813 3.646 20 5 FHBDRN Cc1cc(NC(=O)N[C@H]2CCCN(c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000473774132 944413117 /nfs/dbraw/zinc/41/31/17/944413117.db2.gz GFGIUJVLMINCRY-INIZCTEOSA-N 0 0 354.410 3.694 20 5 FHBDRN CC1(C)CC(=O)c2c(OCCOc3ccccc3[N+](=O)[O-])cccc2O1 ZINC000439190929 944415517 /nfs/dbraw/zinc/41/55/17/944415517.db2.gz WSHDSOAWVAOMOR-UHFFFAOYSA-N 0 0 357.362 3.796 20 5 FHBDRN COc1ccc(C(C)(C)CNC(=O)c2cccc(C)c2[N+](=O)[O-])cc1OC ZINC000105990072 944417035 /nfs/dbraw/zinc/41/70/35/944417035.db2.gz UXLGAJHDAAQOOF-UHFFFAOYSA-N 0 0 372.421 3.628 20 5 FHBDRN Cc1cc(NC(=O)NCCCc2nc3c(s2)CCCC3)ccc1[N+](=O)[O-] ZINC000473776422 944423687 /nfs/dbraw/zinc/42/36/87/944423687.db2.gz CHNXAQJEDHSVIM-UHFFFAOYSA-N 0 0 374.466 3.993 20 5 FHBDRN CC(C)Oc1ccc([C@@H](C)Nc2nc3ccc([N+](=O)[O-])cc3c(=O)[nH]2)cc1 ZINC000517592620 944423750 /nfs/dbraw/zinc/42/37/50/944423750.db2.gz ZDQMNPZCYNLVHT-GFCCVEGCSA-N 0 0 368.393 3.626 20 5 FHBDRN COCCCCCNC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000059012110 944425403 /nfs/dbraw/zinc/42/54/03/944425403.db2.gz KRNGXKIDLAJQLG-UHFFFAOYSA-N 0 0 357.410 3.885 20 5 FHBDRN CC(C)c1ccccc1OC[C@@H](O)COc1cc(N(C)C)ccc1[N+](=O)[O-] ZINC000550205374 944431419 /nfs/dbraw/zinc/43/14/19/944431419.db2.gz JENAAKLQNJYIIX-MRXNPFEDSA-N 0 0 374.437 3.603 20 5 FHBDRN COc1ccc(C(=O)Nc2cccc(Cl)c2-n2cccn2)cc1[N+](=O)[O-] ZINC000046777428 944436359 /nfs/dbraw/zinc/43/63/59/944436359.db2.gz NKMXKNZLVGVIHX-UHFFFAOYSA-N 0 0 372.768 3.695 20 5 FHBDRN CC(=O)c1ccc(OCc2nc(-c3cccc([N+](=O)[O-])c3)no2)cc1F ZINC000518492940 944438586 /nfs/dbraw/zinc/43/85/86/944438586.db2.gz YCODRYQOXWWJMY-UHFFFAOYSA-N 0 0 357.297 3.566 20 5 FHBDRN O=C(Nc1ccc(N2CCCCC2)cn1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000110309221 944439308 /nfs/dbraw/zinc/43/93/08/944439308.db2.gz UQVYXXXMNZHEPB-UHFFFAOYSA-N 0 0 360.801 3.886 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H](c3ccccc3)OC[C@@H]2C)c1 ZINC000110315557 944443966 /nfs/dbraw/zinc/44/39/66/944443966.db2.gz CDRXXKZREVLGPD-UGSOOPFHSA-N 0 0 372.446 3.919 20 5 FHBDRN CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)O[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000759827331 944448675 /nfs/dbraw/zinc/44/86/75/944448675.db2.gz KEJAQKOUYASZSA-WFASDCNBSA-N 0 0 366.414 3.748 20 5 FHBDRN CSC[C@@H]1CCCN(Cc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000312695644 944449720 /nfs/dbraw/zinc/44/97/20/944449720.db2.gz NCNYFWHGPCPTHK-GFCCVEGCSA-N 0 0 359.289 3.932 20 5 FHBDRN Cc1occc1-c1noc(-c2cc(Br)cc([N+](=O)[O-])c2)n1 ZINC000518508754 944454144 /nfs/dbraw/zinc/45/41/44/944454144.db2.gz LYIBPNGVUBOANU-UHFFFAOYSA-N 0 0 350.128 3.976 20 5 FHBDRN COc1ccc([C@@H](OC)[C@@H](C)NC(=O)Nc2ccc([N+](=O)[O-])c(C)c2)cc1 ZINC000473783634 944457737 /nfs/dbraw/zinc/45/77/37/944457737.db2.gz FBBVBDVHLPCCOI-ACJLOTCBSA-N 0 0 373.409 3.810 20 5 FHBDRN C[C@H](OC(=O)c1cc(F)ccc1[N+](=O)[O-])C(=O)c1cccc(Cl)c1 ZINC000783248706 944464842 /nfs/dbraw/zinc/46/48/42/944464842.db2.gz GRXSMPYONCJJLP-VIFPVBQESA-N 0 0 351.717 3.816 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)Nc1nc(-c2ccccc2Cl)ns1 ZINC000110380709 944467501 /nfs/dbraw/zinc/46/75/01/944467501.db2.gz FWBZIKQSHKHERW-UHFFFAOYSA-N 0 0 374.809 3.948 20 5 FHBDRN O=[N+]([O-])c1cc2c(nc1N1CC[C@@]3(C1)OCc1ccccc13)CCCC2 ZINC000518523210 944469936 /nfs/dbraw/zinc/46/99/36/944469936.db2.gz DPOLZODWQATSEG-FQEVSTJZSA-N 0 0 351.406 3.504 20 5 FHBDRN O=C(NCCc1nsc2ccccc21)c1cccc([N+](=O)[O-])c1Cl ZINC001167980373 944470664 /nfs/dbraw/zinc/47/06/64/944470664.db2.gz NZUQGLIUFJQABA-UHFFFAOYSA-N 0 0 361.810 3.830 20 5 FHBDRN C[C@@H](COc1cccc(F)c1)NC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000518525282 944471182 /nfs/dbraw/zinc/47/11/82/944471182.db2.gz OPUWDPFNUFTFHP-JTQLQIEISA-N 0 0 367.764 3.976 20 5 FHBDRN Cc1ccccc1OS(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000162671845 944475311 /nfs/dbraw/zinc/47/53/11/944475311.db2.gz FGEMNSRRCGUMBO-UHFFFAOYSA-N 0 0 361.297 3.690 20 5 FHBDRN O=C([C@H]1COc2ccccc2O1)N(c1cccc([N+](=O)[O-])c1)C1CCCC1 ZINC000517645207 944476222 /nfs/dbraw/zinc/47/62/22/944476222.db2.gz AVKPYEHIOQJQFR-LJQANCHMSA-N 0 0 368.389 3.710 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)c1ccccc1C(=O)c1ccccc1 ZINC000054167891 944479400 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3.904 20 5 FHBDRN CO[C@H]1Cc2ccccc2N(C(=O)c2c(C)cc(Cl)cc2[N+](=O)[O-])C1 ZINC000500319964 944497332 /nfs/dbraw/zinc/49/73/32/944497332.db2.gz XNWBMZSTHVLUKC-AWEZNQCLSA-N 0 0 360.797 3.775 20 5 FHBDRN Cc1c(Cc2noc(CCc3cccc(N(C)C)c3)n2)cccc1[N+](=O)[O-] ZINC000519568743 944499486 /nfs/dbraw/zinc/49/94/86/944499486.db2.gz RDZQKADXISIGPO-UHFFFAOYSA-N 0 0 366.421 3.728 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(-c2nc([C@H](c3ccc(C)cc3)C(C)C)no2)n1 ZINC000516115818 944499581 /nfs/dbraw/zinc/49/95/81/944499581.db2.gz DDPGQAAVUGTBEV-HNNXBMFYSA-N 0 0 355.398 3.958 20 5 FHBDRN COc1ccc(F)cc1[C@@H](C)NC(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000046985259 944506057 /nfs/dbraw/zinc/50/60/57/944506057.db2.gz UVNXILJRPRPLAM-GFCCVEGCSA-N 0 0 361.373 3.645 20 5 FHBDRN COC(=O)c1ccc(C(=O)COc2cc(C)c([N+](=O)[O-])cc2Cl)cc1 ZINC000506541129 944507695 /nfs/dbraw/zinc/50/76/95/944507695.db2.gz PMJUDPDXFBHQNH-UHFFFAOYSA-N 0 0 363.753 3.605 20 5 FHBDRN O=C(COc1c(Cl)cncc1[N+](=O)[O-])c1ccc(OC(F)F)cc1 ZINC000506540570 944508578 /nfs/dbraw/zinc/50/85/78/944508578.db2.gz NRERAVZKELPFSL-UHFFFAOYSA-N 0 0 358.684 3.506 20 5 FHBDRN CCOc1cc(C(=O)Nc2ccc(C)c(O)c2C)c([N+](=O)[O-])cc1OC ZINC000439293284 944511997 /nfs/dbraw/zinc/51/19/97/944511997.db2.gz CPFMMKSUNLPLRX-UHFFFAOYSA-N 0 0 360.366 3.577 20 5 FHBDRN COc1ccc(C(=O)Nc2cc(C)nc(-c3ccccc3)n2)cc1[N+](=O)[O-] ZINC000439296330 944514477 /nfs/dbraw/zinc/51/44/77/944514477.db2.gz KDLRVOUSSJNBLF-UHFFFAOYSA-N 0 0 364.361 3.621 20 5 FHBDRN C[C@H](Cn1ncc2ccccc21)C(=O)NC(C)(C)c1ccccc1[N+](=O)[O-] ZINC000518587661 944518435 /nfs/dbraw/zinc/51/84/35/944518435.db2.gz XOMFSNSSYBUJTH-CQSZACIVSA-N 0 0 366.421 3.632 20 5 FHBDRN CCOc1cc(C(=O)Nc2nccc3sccc32)c([N+](=O)[O-])cc1OC ZINC000162697960 944519816 /nfs/dbraw/zinc/51/98/16/944519816.db2.gz IIXMMFLSWBMUFF-UHFFFAOYSA-N 0 0 373.390 3.864 20 5 FHBDRN Cc1c(C(=O)Nc2c(C)cc(C)cc2C)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000073562800 944520859 /nfs/dbraw/zinc/52/08/59/944520859.db2.gz RMKORSGNCPWMJH-UHFFFAOYSA-N 0 0 365.393 3.661 20 5 FHBDRN Cc1c(OC(=O)c2cnn(CC(C)C)c2C(F)F)cccc1[N+](=O)[O-] ZINC000759841214 944521283 /nfs/dbraw/zinc/52/12/83/944521283.db2.gz WSNKZBYWXNSRHH-UHFFFAOYSA-N 0 0 353.325 3.913 20 5 FHBDRN O=[N+]([O-])c1cncc(Cl)c1OCCOc1ccccc1Br ZINC000506543443 944521773 /nfs/dbraw/zinc/52/17/73/944521773.db2.gz ZHKVJUXVKAQOQQ-UHFFFAOYSA-N 0 0 373.590 3.864 20 5 FHBDRN COc1cc(CN(Cc2ccco2)Cc2cccnc2)c([N+](=O)[O-])cc1F ZINC000184295476 944532864 /nfs/dbraw/zinc/53/28/64/944532864.db2.gz XGIXSKHIZPHVGP-UHFFFAOYSA-N 0 0 371.368 3.933 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)N1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC000517711301 944541785 /nfs/dbraw/zinc/54/17/85/944541785.db2.gz JGXJNTXLBKHASP-OAHLLOKOSA-N 0 0 359.813 3.947 20 5 FHBDRN CC(C)c1ccc(C(=O)N(CCCO)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000439331292 944543013 /nfs/dbraw/zinc/54/30/13/944543013.db2.gz SBZUJMSIZMQLKI-UHFFFAOYSA-N 0 0 356.422 3.743 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@H](COc2ccccc2)C1 ZINC000506214539 944543584 /nfs/dbraw/zinc/54/35/84/944543584.db2.gz 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C[C@H](Nc1ccc(C(N)=O)cc1[N+](=O)[O-])c1cccc(C(F)(F)F)c1 ZINC000015128951 944710822 /nfs/dbraw/zinc/71/08/22/944710822.db2.gz QSTCNADHPSCYAI-VIFPVBQESA-N 0 0 353.300 3.886 20 5 FHBDRN C[C@@H](F)CCNC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000506899300 944715922 /nfs/dbraw/zinc/71/59/22/944715922.db2.gz OCDZTIVOGDSZDJ-MRVPVSSYSA-N 0 0 354.325 3.570 20 5 FHBDRN C[C@H](C(=O)Nc1ccc(Cl)cc1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000438522055 944726780 /nfs/dbraw/zinc/72/67/80/944726780.db2.gz GFRUVXSYGXLZBN-GFCCVEGCSA-N 0 0 359.813 3.634 20 5 FHBDRN Cc1ccc(NC(=O)[C@@H](C)N2CCc3ccc([N+](=O)[O-])cc3C2)c(Cl)c1 ZINC000438523545 944727512 /nfs/dbraw/zinc/72/75/12/944727512.db2.gz NKZRNJLZERNJPP-CYBMUJFWSA-N 0 0 373.840 3.942 20 5 FHBDRN CC(C)Cc1ccc([C@H](NC(=O)CCn2cc([N+](=O)[O-])cn2)C2CC2)cc1 ZINC000506264812 944734888 /nfs/dbraw/zinc/73/48/88/944734888.db2.gz SRRTZBVMWKZQCN-FQEVSTJZSA-N 0 0 370.453 3.647 20 5 FHBDRN Cn1c(C(=O)N(Cc2ccccc2F)c2ccccc2)ccc1[N+](=O)[O-] ZINC000500391428 944735314 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FHBDRN CCCc1n[nH]c(C(=O)NCc2ccccc2OC2CCCC2)c1[N+](=O)[O-] ZINC000518866747 944862174 /nfs/dbraw/zinc/86/21/74/944862174.db2.gz MHFWHPSMGWTCHO-UHFFFAOYSA-N 0 0 372.425 3.522 20 5 FHBDRN CSc1ccc(C(=O)NCCCN(C)c2ccccc2)cc1[N+](=O)[O-] ZINC000017826557 944864216 /nfs/dbraw/zinc/86/42/16/944864216.db2.gz UEUZMWJOYZTJMJ-UHFFFAOYSA-N 0 0 359.451 3.573 20 5 FHBDRN CCn1c2ccccc2nc1[C@@H](C)NC(=O)c1cc(F)cc([N+](=O)[O-])c1 ZINC000518851111 944864513 /nfs/dbraw/zinc/86/45/13/944864513.db2.gz JDLPPVYPAVCQIN-LLVKDONJSA-N 0 0 356.357 3.595 20 5 FHBDRN COc1cccc([C@@H]2C[C@H]2CNC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000414007468 944864529 /nfs/dbraw/zinc/86/45/29/944864529.db2.gz IJBHHJFAJYLTNF-YOEHRIQHSA-N 0 0 374.824 3.719 20 5 FHBDRN Cc1ccccc1[C@@H]1CCN(c2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])C1 ZINC000507020693 944867649 /nfs/dbraw/zinc/86/76/49/944867649.db2.gz FYHVACKWMLFLTR-MRXNPFEDSA-N 0 0 365.433 3.789 20 5 FHBDRN O=[N+]([O-])c1cc(-c2nc(Cc3cccs3)no2)ccc1N1CCCC1 ZINC000518859592 944871747 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COc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H]1CCO[C@@H]1c1ccccc1 ZINC000431982314 944893331 /nfs/dbraw/zinc/89/33/31/944893331.db2.gz QCBAKFFEYBGVOY-RDTXWAMCSA-N 0 0 371.393 3.503 20 5 FHBDRN C[C@@H](CSc1ccccc1)C(=O)NCCOc1ccc([N+](=O)[O-])cc1 ZINC000518894754 944897982 /nfs/dbraw/zinc/89/79/82/944897982.db2.gz XCNADRQONUBDOD-AWEZNQCLSA-N 0 0 360.435 3.518 20 5 FHBDRN Cc1c(CC(=O)N2CC[C@H](Oc3ccc(Cl)cc3)C2)cccc1[N+](=O)[O-] ZINC000517992280 944902167 /nfs/dbraw/zinc/90/21/67/944902167.db2.gz GUMVNQVGVQXBOY-KRWDZBQOSA-N 0 0 374.824 3.779 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H](c1ccco1)c1ccccc1 ZINC000426886140 944905767 /nfs/dbraw/zinc/90/57/67/944905767.db2.gz IWMZDIWKKJPLGY-SFHVURJKSA-N 0 0 352.346 3.716 20 5 FHBDRN O=[N+]([O-])c1ccc(NCc2ccc3c(c2)OCCO3)c(C(F)(F)F)c1 ZINC000511683075 944915297 /nfs/dbraw/zinc/91/52/97/944915297.db2.gz QJGOBCLKZOPXNM-UHFFFAOYSA-N 0 0 354.284 3.997 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N[C@H]1CC[C@@H](Cc2ccccc2)C1 ZINC000438677044 944917783 /nfs/dbraw/zinc/91/77/83/944917783.db2.gz HNAMJCKMWMPPGM-IRXDYDNUSA-N 0 0 354.406 3.501 20 5 FHBDRN CC(C)(C(=O)NCCOc1cccc(Cl)c1)c1ccccc1[N+](=O)[O-] ZINC000432020806 944926805 /nfs/dbraw/zinc/92/68/05/944926805.db2.gz SVTJFCKWDNXXNI-UHFFFAOYSA-N 0 0 362.813 3.721 20 5 FHBDRN CNc1ccc(C(=O)N2CCCCC[C@@H]2c2ccncc2)cc1[N+](=O)[O-] ZINC000516489502 944936757 /nfs/dbraw/zinc/93/67/57/944936757.db2.gz OJZGHPNGRGHYEK-QGZVFWFLSA-N 0 0 354.410 3.789 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCC(C)(C)[C@H](O)C(C)C ZINC000507086369 944943623 /nfs/dbraw/zinc/94/36/23/944943623.db2.gz HDDOLCJBIJXBGB-MRXNPFEDSA-N 0 0 368.499 3.870 20 5 FHBDRN CC[C@H]1CN(c2c(Cl)cc(Cl)cc2[N+](=O)[O-])C[C@]2(CCOC2)O1 ZINC000408103393 944945344 /nfs/dbraw/zinc/94/53/44/944945344.db2.gz ALAQDOMMDFDMCY-NHYWBVRUSA-N 0 0 361.225 3.676 20 5 FHBDRN Cc1cccc([C@H]2NC(=O)N(Cc3ccc([N+](=O)[O-])cc3Cl)C2=O)c1C ZINC000432046340 944947601 /nfs/dbraw/zinc/94/76/01/944947601.db2.gz LFHNRPCVJSOCKD-MRXNPFEDSA-N 0 0 373.796 3.658 20 5 FHBDRN CCO[C@H]1C[C@@H](N(C)C(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)C1(C)C ZINC001126450581 944951296 /nfs/dbraw/zinc/95/12/96/944951296.db2.gz DAPSFVJGXLMMIA-SJORKVTESA-N 0 0 364.442 3.658 20 5 FHBDRN CNC(=O)c1cc([N+](=O)[O-])ccc1NCc1cccc(OCC(C)C)c1 ZINC000511727271 944953302 /nfs/dbraw/zinc/95/33/02/944953302.db2.gz ORDJCNYVFDAYNL-UHFFFAOYSA-N 0 0 357.410 3.601 20 5 FHBDRN O=[N+]([O-])c1cc(F)c(CSCc2ncnn2-c2ccccc2)c(F)c1 ZINC000507101223 944953997 /nfs/dbraw/zinc/95/39/97/944953997.db2.gz HHQXLXVUZVMTTI-UHFFFAOYSA-N 0 0 362.361 3.887 20 5 FHBDRN Cc1ccc(Oc2ccc(NC(=O)c3ccc([N+](=O)[O-])n3C)cn2)cc1C ZINC000516512038 944960272 /nfs/dbraw/zinc/96/02/72/944960272.db2.gz QNUAGFSXIPSIAW-UHFFFAOYSA-N 0 0 366.377 3.990 20 5 FHBDRN CC(C)[C@H]1OCCC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000437046996 944964324 /nfs/dbraw/zinc/96/43/24/944964324.db2.gz PFYYMTRIIFIBFU-IAQYHMDHSA-N 0 0 374.359 3.795 20 5 FHBDRN C[C@H](NC(=O)c1ccc([N+](=O)[O-])o1)c1ccc(Br)cc1F ZINC000518953502 944965903 /nfs/dbraw/zinc/96/59/03/944965903.db2.gz WKGIPRXROMDFKV-ZETCQYMHSA-N 0 0 357.135 3.580 20 5 FHBDRN CC(C)(C)c1ccc(NC(=O)Cc2cn3ccsc3n2)cc1[N+](=O)[O-] ZINC000519590808 944981997 /nfs/dbraw/zinc/98/19/97/944981997.db2.gz HAJMWYQMNSOPFS-UHFFFAOYSA-N 0 0 358.423 3.783 20 5 FHBDRN COc1ccc(CNC(=O)Nc2ccc(F)c(C3CC3)c2)cc1[N+](=O)[O-] ZINC000439801616 944987734 /nfs/dbraw/zinc/98/77/34/944987734.db2.gz PZJZZARUEZOFFT-UHFFFAOYSA-N 0 0 359.357 3.942 20 5 FHBDRN O=C(NCc1ccc(F)c(Cl)c1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000507138105 944989580 /nfs/dbraw/zinc/98/95/80/944989580.db2.gz FZZIBIIKOBCASH-UHFFFAOYSA-N 0 0 374.759 3.503 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)C(F)(F)c1cccc(OC)c1 ZINC001270535963 944997030 /nfs/dbraw/zinc/99/70/30/944997030.db2.gz CYAJQANKNMOKPG-UHFFFAOYSA-N 0 0 366.320 3.733 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H](CCO)C1CCCCC1 ZINC000151201315 945004888 /nfs/dbraw/zinc/00/48/88/945004888.db2.gz VHLCQQHWTSCITL-CXAGYDPISA-N 0 0 366.483 3.523 20 5 FHBDRN O=C(COc1cccc([N+](=O)[O-])c1)N[C@@H](C1CCCCC1)C(F)(F)F ZINC000439820135 945007678 /nfs/dbraw/zinc/00/76/78/945007678.db2.gz BGKBXALGWLBJOP-HNNXBMFYSA-N 0 0 360.332 3.601 20 5 FHBDRN CC(=O)N1C[C@@H]2CCC[C@@H](Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)[C@@H]2C1 ZINC000516558180 945008088 /nfs/dbraw/zinc/00/80/88/945008088.db2.gz ORWTYRDKKNKBCF-NJZAAPMLSA-N 0 0 371.359 3.673 20 5 FHBDRN Cc1c([C@H](C)NCc2ncn(Cc3cccc(F)c3)n2)cccc1[N+](=O)[O-] ZINC000437087697 945008585 /nfs/dbraw/zinc/00/85/85/945008585.db2.gz JWEVFSKXZRVRGR-AWEZNQCLSA-N 0 0 369.400 3.533 20 5 FHBDRN CC(C)N(Cc1ccc(Cl)c(Cl)c1)C(=O)c1cc([N+](=O)[O-])n[nH]1 ZINC000507174935 945023507 /nfs/dbraw/zinc/02/35/07/945023507.db2.gz TZKIUQZRMIIFOX-UHFFFAOYSA-N 0 0 357.197 3.676 20 5 FHBDRN CC(C)OCc1ccccc1CNC(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000519008884 945024483 /nfs/dbraw/zinc/02/44/83/945024483.db2.gz VOUPWSKRKHWCFF-UHFFFAOYSA-N 0 0 371.437 3.861 20 5 FHBDRN O=C(c1cc(-c2ccccc2)ns1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000437107014 945028353 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CCCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H](O)C(CC)CC ZINC000506372177 945049707 /nfs/dbraw/zinc/04/97/07/945049707.db2.gz NTZSZHSUVYJXSP-HNNXBMFYSA-N 0 0 354.472 3.624 20 5 FHBDRN C[C@]1(CNC(=O)c2c([N+](=O)[O-])cccc2C(F)(F)F)CCO[C@@H]1C1CC1 ZINC000469339264 945051236 /nfs/dbraw/zinc/05/12/36/945051236.db2.gz WUKQFOUOBYGTOF-GDBMZVCRSA-N 0 0 372.343 3.549 20 5 FHBDRN O=[N+]([O-])c1ccc(/C=C\c2nc(-c3ccc4c(c3)OCCO4)no2)cc1 ZINC000545567905 945052109 /nfs/dbraw/zinc/05/21/09/945052109.db2.gz OJAHKUUNNWXPEO-BAQGIRSFSA-N 0 0 351.318 3.586 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)NCC[C@@H](OCC)C(C)C ZINC000439891008 945053149 /nfs/dbraw/zinc/05/31/49/945053149.db2.gz OGEKPMCRVBZILM-OAHLLOKOSA-N 0 0 353.419 3.566 20 5 FHBDRN Cc1ccc(OCC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)cc1C ZINC000437125843 945055705 /nfs/dbraw/zinc/05/57/05/945055705.db2.gz QPLPNVCXACVVGH-UHFFFAOYSA-N 0 0 354.406 3.782 20 5 FHBDRN Cn1ccc(NCc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)n1 ZINC000151314134 945055966 /nfs/dbraw/zinc/05/59/66/945055966.db2.gz IQLRBKJPIAZVNY-UHFFFAOYSA-N 0 0 374.404 3.793 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H](C)CNc1ccccc1 ZINC000439882067 945060451 /nfs/dbraw/zinc/06/04/51/945060451.db2.gz ZSJWTKOQFOVALL-CYBMUJFWSA-N 0 0 358.398 3.616 20 5 FHBDRN CC(C)CN(c1ccccc1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1F ZINC000507616593 945378762 /nfs/dbraw/zinc/37/87/62/945378762.db2.gz LSFGMKUDWCMAJX-UHFFFAOYSA-N 0 0 352.387 3.585 20 5 FHBDRN CCn1[nH]c(=NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)cc1C1CC1 ZINC000427442706 945381786 /nfs/dbraw/zinc/38/17/86/945381786.db2.gz QUYYNYUDFIBESR-UHFFFAOYSA-N 0 0 356.407 3.578 20 5 FHBDRN O=C(N[C@@H](c1nccs1)C(F)(F)F)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000507639483 945385169 /nfs/dbraw/zinc/38/51/69/945385169.db2.gz FTMGRRPKLPMJCE-NSHDSACASA-N 0 0 370.312 3.566 20 5 FHBDRN C[C@H](OC(=O)c1cc2ccccc2o1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 ZINC000004332385 945386679 /nfs/dbraw/zinc/38/66/79/945386679.db2.gz AQHZZLJPXYCSKQ-JTQLQIEISA-N 0 0 372.308 3.664 20 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C[C@@H](OC(=O)c1ccc(NC(=O)C2CC2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000137423740 945565328 /nfs/dbraw/zinc/56/53/28/945565328.db2.gz BUTJMCAIIWIGNU-GFCCVEGCSA-N 0 0 354.362 3.861 20 5 FHBDRN COc1ccc(C(=O)O[C@H](C)c2cccc([N+](=O)[O-])c2)c(OC)c1OC ZINC000137349944 945585149 /nfs/dbraw/zinc/58/51/49/945585149.db2.gz QMUSTQLZTYOUDT-LLVKDONJSA-N 0 0 361.350 3.539 20 5 FHBDRN CSc1cccc(C(=O)Nc2nn(C(C)C)cc2Cl)c1[N+](=O)[O-] ZINC000894879757 945586963 /nfs/dbraw/zinc/58/69/63/945586963.db2.gz BIKOXURFDHDPDA-UHFFFAOYSA-N 0 0 354.819 4.000 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)c1cc(COC(C)(C)C)on1 ZINC000281295610 945590566 /nfs/dbraw/zinc/59/05/66/945590566.db2.gz IOJLNIRXHMMIQW-UHFFFAOYSA-N 0 0 363.370 3.549 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)OC[C@H](C)C(F)(F)F)cc1SC ZINC000748274134 945594319 /nfs/dbraw/zinc/59/43/19/945594319.db2.gz CVERHCOHGJALKK-ZETCQYMHSA-N 0 0 353.318 3.681 20 5 FHBDRN C[C@@H]1CCCC[C@@H]1Cc1nc(-c2ccc(-n3cncn3)c([N+](=O)[O-])c2)no1 ZINC000519625549 945595374 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3.864 20 5 FHBDRN CC[C@H](NC(=O)c1cccc2c(=O)c3cccc(F)c3[nH]c12)[C@H]1CCCO1 ZINC000444244607 946119423 /nfs/dbraw/zinc/11/94/23/946119423.db2.gz WPFLPSYGKIDVBN-DLBZAZTESA-N 0 0 368.408 3.508 20 5 FHBDRN C[C@H](C(=O)Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1)c1ccccc1F ZINC000109020212 946124238 /nfs/dbraw/zinc/12/42/38/946124238.db2.gz XPMVWPIURSZRJK-NSHDSACASA-N 0 0 354.341 3.866 20 5 FHBDRN C[C@@H]1C[C@@H](c2cccnc2)N(c2c(Br)cncc2[N+](=O)[O-])C1 ZINC000302113758 946127083 /nfs/dbraw/zinc/12/70/83/946127083.db2.gz BPKGUTARBUZQKV-MFKMUULPSA-N 0 0 363.215 3.735 20 5 FHBDRN CCc1n[nH]c(C(=O)N2CCC[C@@H](C)[C@H]2c2ccc(C)cc2)c1[N+](=O)[O-] ZINC000444257019 946141256 /nfs/dbraw/zinc/14/12/56/946141256.db2.gz OCJCSSNHWWRGJP-DYVFJYSZSA-N 0 0 356.426 3.802 20 5 FHBDRN COc1cc(C(=O)N2CCCc3c(Cl)ccc(F)c32)ccc1[N+](=O)[O-] ZINC000109106229 946148945 /nfs/dbraw/zinc/14/89/45/946148945.db2.gz DNEBSRWZLASYIE-UHFFFAOYSA-N 0 0 364.760 3.989 20 5 FHBDRN O=C(c1cccc2c(=O)c3cccc(F)c3[nH]c12)N1CC[C@H](C2CC2)C1 ZINC000444281469 946159595 /nfs/dbraw/zinc/15/95/95/946159595.db2.gz ABYLXHRQPUXBDD-ZDUSSCGKSA-N 0 0 350.393 3.693 20 5 FHBDRN C[C@@H](OC(=O)[C@H](C)NC(=O)CC1CCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000159942066 946176479 /nfs/dbraw/zinc/17/64/79/946176479.db2.gz PKLYNNAXFDCVSW-UONOGXRCSA-N 0 0 362.426 3.674 20 5 FHBDRN CCO[C@@H](C)c1nc(COc2ccc([N+](=O)[O-])c(C(=O)OC)c2)cs1 ZINC000522979399 946182855 /nfs/dbraw/zinc/18/28/55/946182855.db2.gz OWJDSJGLVZEXHT-JTQLQIEISA-N 0 0 366.395 3.514 20 5 FHBDRN Cc1ccc(S(=O)(=O)N2CCCCC[C@@H]2c2ccco2)c([N+](=O)[O-])c1 ZINC000522981556 946185574 /nfs/dbraw/zinc/18/55/74/946185574.db2.gz YGAXWIJCUWJNRY-CQSZACIVSA-N 0 0 364.423 3.802 20 5 FHBDRN CCC1(CC)[C@H](OC)C[C@@H]1NC(=O)c1cc(SC)ccc1[N+](=O)[O-] ZINC000151878030 946187917 /nfs/dbraw/zinc/18/79/17/946187917.db2.gz OWXONQBKHWEDGZ-LSDHHAIUSA-N 0 0 352.456 3.640 20 5 FHBDRN O=C(COc1nc(-c2ccccc2Cl)no1)c1cccc([N+](=O)[O-])c1 ZINC000109199153 946188909 /nfs/dbraw/zinc/18/89/09/946188909.db2.gz SMXGMMNLHZHBIV-UHFFFAOYSA-N 0 0 359.725 3.560 20 5 FHBDRN CC(C)OCCCCNC(=O)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000444302003 946191320 /nfs/dbraw/zinc/19/13/20/946191320.db2.gz HTCJCWMGBXAXHT-UHFFFAOYSA-N 0 0 370.424 3.755 20 5 FHBDRN COC(=O)c1cc(NCc2ccc(C(C)(C)O)cc2)cc(C)c1[N+](=O)[O-] ZINC000302366266 946211888 /nfs/dbraw/zinc/21/18/88/946211888.db2.gz GCUBNTWTPICMNF-UHFFFAOYSA-N 0 0 358.394 3.529 20 5 FHBDRN Cc1ccc(Cc2cnc(NC(=O)c3cc([N+](=O)[O-])c[nH]3)s2)cc1C ZINC000487482314 946216183 /nfs/dbraw/zinc/21/61/83/946216183.db2.gz XIVYUTZYWZMXKJ-UHFFFAOYSA-N 0 0 356.407 3.839 20 5 FHBDRN CNC(=O)c1cccc(CNc2c(Cl)cc([N+](=O)[O-])cc2Cl)c1 ZINC000121349057 946263983 /nfs/dbraw/zinc/26/39/83/946263983.db2.gz AYTKAHQAPVSDAM-UHFFFAOYSA-N 0 0 354.193 3.873 20 5 FHBDRN CC1(C)CC[C@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2Br)C1 ZINC000508483134 946277303 /nfs/dbraw/zinc/27/73/03/946277303.db2.gz ILDBMIYVKAIUAU-NSHDSACASA-N 0 0 355.232 3.595 20 5 FHBDRN CC(C)Oc1ccc(OC(=O)c2cc([N+](=O)[O-])c(N(C)C)cc2F)cc1 ZINC001126106373 946278312 /nfs/dbraw/zinc/27/83/12/946278312.db2.gz VILNZONHBKHCGQ-UHFFFAOYSA-N 0 0 362.357 3.806 20 5 FHBDRN CCCc1[nH]nc(C(=O)Nc2cccc(-c3csc(C)n3)c2)c1[N+](=O)[O-] ZINC000109426544 946284282 /nfs/dbraw/zinc/28/42/82/946284282.db2.gz NXIPJUVEBACUAS-UHFFFAOYSA-N 0 0 371.422 3.955 20 5 FHBDRN COc1ccc(CCCC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)cc1 ZINC000088230808 946291364 /nfs/dbraw/zinc/29/13/64/946291364.db2.gz XQYRFKPRIBZGGO-UHFFFAOYSA-N 0 0 354.406 3.511 20 5 FHBDRN CCc1ccc(C(=O)CCC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)cc1 ZINC000088232059 946297579 /nfs/dbraw/zinc/29/75/79/946297579.db2.gz HHYSLIQJHMNOOC-UHFFFAOYSA-N 0 0 366.417 3.705 20 5 FHBDRN C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N(C)Cc1ccc(Cl)s1 ZINC000018939196 946300119 /nfs/dbraw/zinc/30/01/19/946300119.db2.gz PWDSTEVPUQDTJX-JTQLQIEISA-N 0 0 353.831 3.769 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1cccc(F)c1F)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088230732 946319331 /nfs/dbraw/zinc/31/93/31/946319331.db2.gz YZPOSQDRJIEJGL-JKSUJKDBSA-N 0 0 358.344 3.561 20 5 FHBDRN O=C(Nc1cccc(F)c1Cl)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1 ZINC001271700288 946321585 /nfs/dbraw/zinc/32/15/85/946321585.db2.gz KGUKSYVXLFAYQR-UHFFFAOYSA-N 0 0 360.732 3.825 20 5 FHBDRN CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)Cc1cc(F)c(F)cc1F ZINC000178436871 946332893 /nfs/dbraw/zinc/33/28/93/946332893.db2.gz GCVQLMDZXKVGMJ-UHFFFAOYSA-N 0 0 372.730 3.867 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N(C)Cc2c(F)cccc2F)c1 ZINC000511892972 946338110 /nfs/dbraw/zinc/33/81/10/946338110.db2.gz VUCCUUQUELZVEX-UHFFFAOYSA-N 0 0 350.321 3.544 20 5 FHBDRN COc1ccc(Cc2noc(-c3cccc([N+](=O)[O-])c3C)n2)cc1OC ZINC000109578118 946338859 /nfs/dbraw/zinc/33/88/59/946338859.db2.gz SFOSUAQNAHKIJB-UHFFFAOYSA-N 0 0 355.350 3.561 20 5 FHBDRN COc1ccc(Cc2noc(/C=C/c3ccccc3[N+](=O)[O-])n2)cc1OC ZINC000109579382 946338908 /nfs/dbraw/zinc/33/89/08/946338908.db2.gz CPNXFIINCIDQKU-CSKARUKUSA-N 0 0 367.361 3.756 20 5 FHBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@H]1C[C@@H](C)O ZINC000125505767 946350074 /nfs/dbraw/zinc/35/00/74/946350074.db2.gz YLUUQPYRDZIDPN-KGLIPLIRSA-N 0 0 366.483 3.718 20 5 FHBDRN CC1(C)CCCCN(C(=O)COc2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000438501938 946359147 /nfs/dbraw/zinc/35/91/47/946359147.db2.gz NTYMSBYXPWITOU-UHFFFAOYSA-N 0 0 357.410 3.561 20 5 FHBDRN O=C(COc1c(Cl)cccc1Cl)NCc1ccccc1[N+](=O)[O-] ZINC000046135563 946362647 /nfs/dbraw/zinc/36/26/47/946362647.db2.gz VXUURPJRANMJOT-UHFFFAOYSA-N 0 0 355.177 3.597 20 5 FHBDRN Cc1nn(C)c(C(=O)N2CCC[C@H](C)[C@@H]2c2ccc(C)cc2)c1[N+](=O)[O-] ZINC000151397322 946363100 /nfs/dbraw/zinc/36/31/00/946363100.db2.gz WPPFWDIGQQHCPU-XJKSGUPXSA-N 0 0 356.426 3.559 20 5 FHBDRN Cc1ccc(CNCc2ccc(Cl)cc2[N+](=O)[O-])c(N2CCCC2)n1 ZINC000893480007 946365059 /nfs/dbraw/zinc/36/50/59/946365059.db2.gz HETVNHHALLBULP-UHFFFAOYSA-N 0 0 360.845 3.842 20 5 FHBDRN O=C(Cc1csc(-c2cccs2)n1)NCc1ccccc1[N+](=O)[O-] ZINC000046147362 946373474 /nfs/dbraw/zinc/37/34/74/946373474.db2.gz ABURVDCOCBHZFK-UHFFFAOYSA-N 0 0 359.432 3.639 20 5 FHBDRN O=C(CCCc1nc2ccccc2s1)NCc1ccccc1[N+](=O)[O-] ZINC000046148489 946374416 /nfs/dbraw/zinc/37/44/16/946374416.db2.gz RALHCTQRSJPNDE-UHFFFAOYSA-N 0 0 355.419 3.844 20 5 FHBDRN COc1ccc(C(=O)Nc2cccc([N+](=O)[O-])c2)c(OCCOC(C)C)c1 ZINC000475478843 946376432 /nfs/dbraw/zinc/37/64/32/946376432.db2.gz LZIVEVHWQLOXPF-UHFFFAOYSA-N 0 0 374.393 3.660 20 5 FHBDRN CCC(CC)n1nccc1-c1nc(CCNc2ccccc2[N+](=O)[O-])no1 ZINC000545669328 946383289 /nfs/dbraw/zinc/38/32/89/946383289.db2.gz NOBDEXGCQZUVOV-UHFFFAOYSA-N 0 0 370.413 3.857 20 5 FHBDRN CC(C)(CO)CCCNC(=O)c1cc(F)c(Cl)c([N+](=O)[O-])c1Cl ZINC000896978260 946388778 /nfs/dbraw/zinc/38/87/78/946388778.db2.gz ZYZCGVWIGZRSAB-UHFFFAOYSA-N 0 0 367.204 3.569 20 5 FHBDRN CSc1cccc(C(=O)Nc2ccc(N3CCCCC3)cn2)c1[N+](=O)[O-] ZINC000186474765 946391618 /nfs/dbraw/zinc/39/16/18/946391618.db2.gz NXOKCWCUCGBQDY-UHFFFAOYSA-N 0 0 372.450 3.954 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1-c1noc(CCC(=O)c2cccc(F)c2)n1 ZINC000545691092 946391855 /nfs/dbraw/zinc/39/18/55/946391855.db2.gz LIUPDEBYRDKQFW-UHFFFAOYSA-N 0 0 355.325 3.908 20 5 FHBDRN C[C@H](NC(=O)COc1ccc([N+](=O)[O-])cc1)c1cc2cccc(F)c2o1 ZINC000475103070 946396907 /nfs/dbraw/zinc/39/69/07/946396907.db2.gz XDMKXFOMMMNKRG-NSHDSACASA-N 0 0 358.325 3.736 20 5 FHBDRN CCc1ccc(NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)cc1OC ZINC000456587014 946401655 /nfs/dbraw/zinc/40/16/55/946401655.db2.gz UOEXBAHNTJULTL-UHFFFAOYSA-N 0 0 356.378 3.767 20 5 FHBDRN CCCOc1cc(OC)ccc1C(=O)Nc1ccc(OC)cc1[N+](=O)[O-] ZINC000475481464 946406511 /nfs/dbraw/zinc/40/65/11/946406511.db2.gz UOYONFRNAGRIDP-UHFFFAOYSA-N 0 0 360.366 3.653 20 5 FHBDRN CN1CCC[C@H](NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)c2ccccc21 ZINC000456595065 946411486 /nfs/dbraw/zinc/41/14/86/946411486.db2.gz LRUHIOZRYAMWQM-SFHVURJKSA-N 0 0 367.449 3.960 20 5 FHBDRN O=C(COc1ccc2ccccc2c1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088252068 946412928 /nfs/dbraw/zinc/41/29/28/946412928.db2.gz RZXQVJZJHREOET-UHFFFAOYSA-N 0 0 362.385 3.712 20 5 FHBDRN Cc1ccc(CC(=O)Nc2n[nH]c(-c3cccc([N+](=O)[O-])c3)n2)c(Cl)c1 ZINC000475488995 946423252 /nfs/dbraw/zinc/42/32/52/946423252.db2.gz SLKKARYJYVWLCC-UHFFFAOYSA-N 0 0 371.784 3.523 20 5 FHBDRN C[C@@H](Nc1ccc(C(=O)N2CCC[C@H]2CF)cc1[N+](=O)[O-])c1ccccn1 ZINC000294171018 946433749 /nfs/dbraw/zinc/43/37/49/946433749.db2.gz SNRWSZYYOLTRIX-HIFRSBDPSA-N 0 0 372.400 3.737 20 5 FHBDRN O=C(N[C@@H]1COc2ccc(F)cc21)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000444322886 946434762 /nfs/dbraw/zinc/43/47/62/946434762.db2.gz WANJWKKKCLLFGJ-LJQANCHMSA-N 0 0 374.371 3.684 20 5 FHBDRN CSc1cccc(NC(=O)C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)c1C ZINC000441322149 946437352 /nfs/dbraw/zinc/43/73/52/946437352.db2.gz JAEULPVBDQYOMQ-UHFFFAOYSA-N 0 0 373.434 3.819 20 5 FHBDRN CSc1cccc(C(=O)N(C)Cc2ccc(F)c(F)c2)c1[N+](=O)[O-] ZINC000186075104 946446123 /nfs/dbraw/zinc/44/61/23/946446123.db2.gz CARCBCLQPNDAHV-UHFFFAOYSA-N 0 0 352.362 3.867 20 5 FHBDRN CCOc1ccc(C(=O)N(Cc2ccco2)c2ccccn2)cc1[N+](=O)[O-] ZINC000129501085 946448723 /nfs/dbraw/zinc/44/87/23/946448723.db2.gz IYZGFJRXVQBSDY-UHFFFAOYSA-N 0 0 367.361 3.829 20 5 FHBDRN C[C@@H](C(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1)n1cnc2ccccc21 ZINC000129502666 946449945 /nfs/dbraw/zinc/44/99/45/946449945.db2.gz CGAPQKKXWPMWGD-AWEZNQCLSA-N 0 0 364.405 3.697 20 5 FHBDRN Cc1cc(N2CCNC2=O)ccc1NCC=Cc1ccccc1[N+](=O)[O-] ZINC000441327187 946456957 /nfs/dbraw/zinc/45/69/57/946456957.db2.gz ASZZGMCAPBHTSM-GQCTYLIASA-N 0 0 352.394 3.558 20 5 FHBDRN O=C(OCc1csc([N+](=O)[O-])c1)[C@@H](O)c1cc(Cl)cc(Cl)c1 ZINC000756755430 946463659 /nfs/dbraw/zinc/46/36/59/946463659.db2.gz ZHLIWCUUFQIIQM-LBPRGKRZSA-N 0 0 362.190 3.740 20 5 FHBDRN Cc1cc(Cl)ccc1O[C@@H](C)C(=O)N1CCc2c1cccc2[N+](=O)[O-] ZINC000523093294 946467279 /nfs/dbraw/zinc/46/72/79/946467279.db2.gz SRPQPFLWKKGPNW-LBPRGKRZSA-N 0 0 360.797 3.913 20 5 FHBDRN O=[N+]([O-])c1ccc(OC2CCN(Cc3ncc(Cl)s3)CC2)cc1 ZINC000473139033 946483730 /nfs/dbraw/zinc/48/37/30/946483730.db2.gz OCDHHHMLUFVXQZ-UHFFFAOYSA-N 0 0 353.831 3.748 20 5 FHBDRN O=C(NCCCC1CCCCC1)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000111565472 946484913 /nfs/dbraw/zinc/48/49/13/946484913.db2.gz XYYOPLKDGFJMBX-UHFFFAOYSA-N 0 0 357.410 3.527 20 5 FHBDRN CCO[C@@H](C)c1nc(CN(C)c2cccc(OC)c2[N+](=O)[O-])cs1 ZINC000475502809 946488443 /nfs/dbraw/zinc/48/84/43/946488443.db2.gz LNRNDSIKDKQIOG-NSHDSACASA-N 0 0 351.428 3.794 20 5 FHBDRN O=[N+]([O-])c1ccc(OCCOc2ccc(Br)cc2)c(F)c1 ZINC000048022691 946492862 /nfs/dbraw/zinc/49/28/62/946492862.db2.gz QNJSLXOQEGSMQJ-UHFFFAOYSA-N 0 0 356.147 3.954 20 5 FHBDRN CC(C)NC(=O)c1ccc(NC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000048108266 946500154 /nfs/dbraw/zinc/50/01/54/946500154.db2.gz FAPQZXOPXTVAES-ZDUSSCGKSA-N 0 0 370.409 3.616 20 5 FHBDRN COc1ccc(CSCC(=O)N[C@H]2C[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000067514714 946500630 /nfs/dbraw/zinc/50/06/30/946500630.db2.gz ANFIELZWYJMIIV-CVEARBPZSA-N 0 0 372.446 3.509 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)C[C@H](O)c2ccc(F)cc2)c1C ZINC000897035215 946504564 /nfs/dbraw/zinc/50/45/64/946504564.db2.gz SCJJFDAJMCVGMU-PXAZEXFGSA-N 0 0 360.385 3.593 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N(C)[C@@H](C)[C@@H]1Cc2ccccc2O1 ZINC000127196515 946522714 /nfs/dbraw/zinc/52/27/14/946522714.db2.gz YUUBOWYZIVGWCI-UGSOOPFHSA-N 0 0 355.394 3.759 20 5 FHBDRN Cc1ccc2c(CCNC(=O)c3ccc([N+](=O)[O-])cc3F)cn(C)c2c1 ZINC000186546764 946531232 /nfs/dbraw/zinc/53/12/32/946531232.db2.gz DIPMQPHRXURTHL-UHFFFAOYSA-N 0 0 355.369 3.507 20 5 FHBDRN CCOc1nc(C(F)(F)F)ccc1C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000428338093 946540317 /nfs/dbraw/zinc/54/03/17/946540317.db2.gz PBHXTDPHRYRXDJ-UHFFFAOYSA-N 0 0 355.272 3.660 20 5 FHBDRN COc1cccc([C@@H]2C[C@H](C)CN2C(=O)COc2cccc([N+](=O)[O-])c2)c1 ZINC000544323083 946548603 /nfs/dbraw/zinc/54/86/03/946548603.db2.gz POWQDCSNMQURPN-LIRRHRJNSA-N 0 0 370.405 3.592 20 5 FHBDRN C[C@@H](CNC(=O)N1CCC[C@H]1c1cccn1C)c1ccccc1[N+](=O)[O-] ZINC000897074266 946553222 /nfs/dbraw/zinc/55/32/22/946553222.db2.gz CJSJTBUMPHCLBO-KSSFIOAISA-N 0 0 356.426 3.584 20 5 FHBDRN C[C@@H](CNC(=O)N1CCC[C@@H]1c1cccn1C)c1ccccc1[N+](=O)[O-] ZINC000897074264 946553256 /nfs/dbraw/zinc/55/32/56/946553256.db2.gz CJSJTBUMPHCLBO-KBXCAEBGSA-N 0 0 356.426 3.584 20 5 FHBDRN C[C@@H](CNC(=O)N1CCC[C@@H]1c1cccnc1)c1ccccc1[N+](=O)[O-] ZINC000897075618 946555193 /nfs/dbraw/zinc/55/51/93/946555193.db2.gz OQMJNPRUMGBMAZ-WMLDXEAASA-N 0 0 354.410 3.640 20 5 FHBDRN CC(C)N(Cc1ccccn1)C(=O)NC[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000897062436 946555627 /nfs/dbraw/zinc/55/56/27/946555627.db2.gz VKXMGLYWJISSNS-HNNXBMFYSA-N 0 0 356.426 3.714 20 5 FHBDRN C[C@@H](CNC(=O)N1CCC[C@H]1c1ccccn1)c1ccccc1[N+](=O)[O-] ZINC000897072224 946569811 /nfs/dbraw/zinc/56/98/11/946569811.db2.gz XIPAKRIULDBBCL-KSSFIOAISA-N 0 0 354.410 3.640 20 5 FHBDRN O=C(CCc1ccccc1Cl)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000048306106 946570641 /nfs/dbraw/zinc/57/06/41/946570641.db2.gz RIRVTXLGEXDXHY-UHFFFAOYSA-N 0 0 373.840 3.530 20 5 FHBDRN CS(=O)(=O)c1cccc(NCc2ccc(C(F)F)cc2)c1[N+](=O)[O-] ZINC000302159183 946579503 /nfs/dbraw/zinc/57/95/03/946579503.db2.gz GGDVMRQNWNBEEP-UHFFFAOYSA-N 0 0 356.350 3.548 20 5 FHBDRN CCc1ccc(NC(=O)CSc2ccccc2[N+](=O)[O-])c(C(=O)OC)c1 ZINC001126139210 946583673 /nfs/dbraw/zinc/58/36/73/946583673.db2.gz LZISNBPPPHKLQQ-UHFFFAOYSA-N 0 0 374.418 3.675 20 5 FHBDRN C[C@H]1CC[C@H](CCc2nc(Cc3c[nH]c4ccc([N+](=O)[O-])cc34)no2)O1 ZINC000545782330 946601988 /nfs/dbraw/zinc/60/19/88/946601988.db2.gz ABHKODDZRZIGIQ-SMDDNHRTSA-N 0 0 356.382 3.550 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N1CCO[C@@H](c2cccc(Cl)c2)C1 ZINC000186209890 946609704 /nfs/dbraw/zinc/60/97/04/946609704.db2.gz OIIOIOLRERMOQO-QGZVFWFLSA-N 0 0 360.797 3.770 20 5 FHBDRN CSc1ncc(C(=O)Nc2ccc([N+](=O)[O-])cc2)n1-c1ccccc1 ZINC000023258514 946616978 /nfs/dbraw/zinc/61/69/78/946616978.db2.gz FNQKMYROUWTCAR-UHFFFAOYSA-N 0 0 354.391 3.755 20 5 FHBDRN Cc1nn(Cc2ncc(-c3ccc(Br)cc3)o2)cc1[N+](=O)[O-] ZINC000181812128 946622799 /nfs/dbraw/zinc/62/27/99/946622799.db2.gz UQZKKZNWCXOBOW-UHFFFAOYSA-N 0 0 363.171 3.566 20 5 FHBDRN Cc1nc(CCCc2nc(Cc3ccc([N+](=O)[O-])c(C)c3)no2)cs1 ZINC000545782616 946623438 /nfs/dbraw/zinc/62/34/38/946623438.db2.gz TZGDMAYEOWCWMQ-UHFFFAOYSA-N 0 0 358.423 3.817 20 5 FHBDRN COc1c(C(=O)NCc2cccc(COC(C)(C)C)c2)cccc1[N+](=O)[O-] ZINC000475537013 946623914 /nfs/dbraw/zinc/62/39/14/946623914.db2.gz DIWOIAZQWRWABE-UHFFFAOYSA-N 0 0 372.421 3.849 20 5 FHBDRN C[C@H]1C[C@@H](c2noc(-c3ccc(OC(F)F)c([N+](=O)[O-])c3)n2)CCO1 ZINC000545798593 946647155 /nfs/dbraw/zinc/64/71/55/946647155.db2.gz JHKPBHUQEOGBDU-IUCAKERBSA-N 0 0 355.297 3.529 20 5 FHBDRN COc1cccc(F)c1NC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000186250362 946647166 /nfs/dbraw/zinc/64/71/66/946647166.db2.gz FPIDXEXKPCAKNE-UHFFFAOYSA-N 0 0 359.357 3.939 20 5 FHBDRN CCO[C@@H]1C[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2SC)C12CCCC2 ZINC001126606229 946651497 /nfs/dbraw/zinc/65/14/97/946651497.db2.gz BSISSHUJIWXRFX-JKSUJKDBSA-N 0 0 364.467 3.784 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(N2CCC[C@@H]2c2nc3c(n2C)CCCC3)n1 ZINC000614771802 946655779 /nfs/dbraw/zinc/65/57/79/946655779.db2.gz SOXQPOQKVVLQIW-MRXNPFEDSA-N 0 0 355.442 3.560 20 5 FHBDRN COc1cc(N2CC(C)(C)O[C@@](C)(C(F)(F)F)C2)c(F)cc1[N+](=O)[O-] ZINC000549571171 946664296 /nfs/dbraw/zinc/66/42/96/946664296.db2.gz BITDKRPHORIBCJ-CQSZACIVSA-N 0 0 366.311 3.679 20 5 FHBDRN COc1cccc(F)c1NC(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000186261993 946668690 /nfs/dbraw/zinc/66/86/90/946668690.db2.gz YSTVFIKCBNGAAI-UHFFFAOYSA-N 0 0 361.373 3.887 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)N[C@H]2C[C@@H]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000428360096 946673964 /nfs/dbraw/zinc/67/39/64/946673964.db2.gz IENQCFQCBLKILJ-WBAXXEDZSA-N 0 0 353.422 3.895 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)CC(=O)c1ccco1 ZINC000121420528 946681943 /nfs/dbraw/zinc/68/19/43/946681943.db2.gz BKPCGWMOYMDQQP-LLVKDONJSA-N 0 0 362.407 3.691 20 5 FHBDRN O=C(Nc1ccc(OC(F)F)cc1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000015993231 946689842 /nfs/dbraw/zinc/68/98/42/946689842.db2.gz UIHJKXKDGQGIAN-UHFFFAOYSA-N 0 0 374.303 3.634 20 5 FHBDRN CC(C)(C)OC(=O)c1ccc(N(C(=N)N)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC001167990875 946691490 /nfs/dbraw/zinc/69/14/90/946691490.db2.gz ATDDTKUCGPHHOZ-UHFFFAOYSA-N 0 0 374.372 3.721 20 5 FHBDRN Cc1c(NC(=O)NC[C@@H](O)c2ccc3ccccc3c2)cccc1[N+](=O)[O-] ZINC000067536925 946692070 /nfs/dbraw/zinc/69/20/70/946692070.db2.gz YFHCAGMWDLZYHE-LJQANCHMSA-N 0 0 365.389 3.912 20 5 FHBDRN COC(C)(C)C[C@H](C)NC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000074735642 946717409 /nfs/dbraw/zinc/71/74/09/946717409.db2.gz HZYUOWJAYHFJNB-AWEZNQCLSA-N 0 0 351.447 3.718 20 5 FHBDRN Cn1cnc2cc(NC(=O)C3(c4ccc([N+](=O)[O-])cc4)CCC3)ccc21 ZINC001126610002 946727318 /nfs/dbraw/zinc/72/73/18/946727318.db2.gz JWSRPDDZWGRMJR-UHFFFAOYSA-N 0 0 350.378 3.542 20 5 FHBDRN CO[C@H](CNC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)C(C)(C)C ZINC000475213378 946728808 /nfs/dbraw/zinc/72/88/08/946728808.db2.gz NEBYOJVGWQTHGA-GFCCVEGCSA-N 0 0 363.336 3.796 20 5 FHBDRN C[C@H](CNC(=O)c1cccc2c(=O)c3cccc(F)c3[nH]c12)C(F)(F)F ZINC000444332763 946729998 /nfs/dbraw/zinc/72/99/98/946729998.db2.gz UQHLPKFSZYPVIM-SECBINFHSA-N 0 0 366.314 3.749 20 5 FHBDRN CCC(CC)[C@H](O)CNC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000475220651 946744091 /nfs/dbraw/zinc/74/40/91/946744091.db2.gz PUQPXFMVVVYJDS-CYBMUJFWSA-N 0 0 363.336 3.532 20 5 FHBDRN COC(=O)Cc1cccc(NC(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)c1 ZINC000475580461 946745890 /nfs/dbraw/zinc/74/58/90/946745890.db2.gz YMLFMWUPGAITIO-UHFFFAOYSA-N 0 0 357.366 3.571 20 5 FHBDRN COc1ccc2c(c1)OCC(C(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)=C2 ZINC001126610803 946754393 /nfs/dbraw/zinc/75/43/93/946754393.db2.gz KLFRSZVBATTWAJ-ZDUSSCGKSA-N 0 0 368.389 3.565 20 5 FHBDRN O=[N+]([O-])C[C@H](Oc1ccc(Br)c(OC(F)(F)F)c1)C1CC1 ZINC001227853111 946768691 /nfs/dbraw/zinc/76/86/91/946768691.db2.gz JOUOZHVTLZDPCF-NSHDSACASA-N 0 0 370.121 3.782 20 5 FHBDRN Cc1csc(N(C)C(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)n1 ZINC000124937199 946769541 /nfs/dbraw/zinc/76/95/41/946769541.db2.gz PMTCBBRCYAJVCQ-UHFFFAOYSA-N 0 0 370.228 3.707 20 5 FHBDRN COc1cccc2c1nc(NC(=O)c1c(C)cc(C)c([N+](=O)[O-])c1C)n2C ZINC000184461838 946771167 /nfs/dbraw/zinc/77/11/67/946771167.db2.gz JMWLTKKUYGOVNI-UHFFFAOYSA-N 0 0 368.393 3.668 20 5 FHBDRN CCOC(=O)c1ccnc(N[C@H](c2ccc(OC)cc2)C(C)C)c1[N+](=O)[O-] ZINC000523111766 946775019 /nfs/dbraw/zinc/77/50/19/946775019.db2.gz QQANLNZCTZPHIP-INIZCTEOSA-N 0 0 373.409 3.984 20 5 FHBDRN CCOC(=O)c1ccnc(N[C@H]2CCOc3c(CC)cccc32)c1[N+](=O)[O-] ZINC000523111341 946775288 /nfs/dbraw/zinc/77/52/88/946775288.db2.gz NIBUOPMTVDHGMY-HNNXBMFYSA-N 0 0 371.393 3.665 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N(C)Cc1nc(-c2ccccc2)c[nH]1 ZINC000121455245 946776050 /nfs/dbraw/zinc/77/60/50/946776050.db2.gz UBWSGFGPOFULDP-UHFFFAOYSA-N 0 0 350.378 3.566 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)NCCc1c[nH]c2cc(F)ccc12 ZINC000050767276 946776412 /nfs/dbraw/zinc/77/64/12/946776412.db2.gz GOJAVXJVLLNKHX-UHFFFAOYSA-N 0 0 373.409 3.666 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(OCCCOc2cccc(Cl)c2)c1 ZINC000523109484 946778455 /nfs/dbraw/zinc/77/84/55/946778455.db2.gz IUFNZSLBLYGZFD-UHFFFAOYSA-N 0 0 365.769 3.883 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC(OCC(C)C)CC1 ZINC000282011637 946797877 /nfs/dbraw/zinc/79/78/77/946797877.db2.gz RJNXORPMVSSIKG-UHFFFAOYSA-N 0 0 365.430 3.662 20 5 FHBDRN Cc1cc2cc[nH]c2cc1NC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000444445503 946801992 /nfs/dbraw/zinc/80/19/92/946801992.db2.gz HKLZBCMRLOSTDR-UHFFFAOYSA-N 0 0 362.345 3.891 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)c1cccnc1N1CCCCC1 ZINC000186303470 946805689 /nfs/dbraw/zinc/80/56/89/946805689.db2.gz MAUKNOZRWXODFS-UHFFFAOYSA-N 0 0 374.828 3.564 20 5 FHBDRN Cc1nc(NC(=O)CCc2ccc(OC(F)(F)F)cc2)ccc1[N+](=O)[O-] ZINC000475292954 946811299 /nfs/dbraw/zinc/81/12/99/946811299.db2.gz ILKNQZMSILNTPE-UHFFFAOYSA-N 0 0 369.299 3.768 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1C(=O)Nc1nc2cc3c(cc2s1)OCCO3 ZINC000184471034 946820948 /nfs/dbraw/zinc/82/09/48/946820948.db2.gz GKBZZFGSAAWHDL-UHFFFAOYSA-N 0 0 371.374 3.536 20 5 FHBDRN CC(C)[C@H](c1ccccc1Cl)N(C)C(=O)CCn1cc([N+](=O)[O-])cn1 ZINC000113076599 946827099 /nfs/dbraw/zinc/82/70/99/946827099.db2.gz FSUKXYVVYITBKJ-QGZVFWFLSA-N 0 0 364.833 3.691 20 5 FHBDRN CCOc1ccccc1CCC(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186305386 946831440 /nfs/dbraw/zinc/83/14/40/946831440.db2.gz JPHWPQQFSRMWIJ-UHFFFAOYSA-N 0 0 362.813 3.896 20 5 FHBDRN Cc1ccccc1N1C(=O)C(=CC=Cc2ccccc2[N+](=O)[O-])NC1=S ZINC000208924196 946833721 /nfs/dbraw/zinc/83/37/21/946833721.db2.gz SIVBOTWXNCWWPK-IAGWCDOLSA-N 0 0 365.414 3.722 20 5 FHBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)Nc1c(F)cc(Cl)cc1Cl ZINC000186671534 946835773 /nfs/dbraw/zinc/83/57/73/946835773.db2.gz MIOSPMDXHPIRIG-UHFFFAOYSA-N 0 0 365.169 3.842 20 5 FHBDRN CCCC[C@H](CC)CNC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000048570971 946836905 /nfs/dbraw/zinc/83/69/05/946836905.db2.gz NADDUXQPGSOZTR-NSHDSACASA-N 0 0 355.822 3.519 20 5 FHBDRN Cc1noc(C)c1[C@H](C)CC(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186313252 946845806 /nfs/dbraw/zinc/84/58/06/946845806.db2.gz DWCOHJUUCJSICS-SECBINFHSA-N 0 0 351.790 3.663 20 5 FHBDRN CSc1cccc(C(=O)N[C@@H]2CCO[C@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000186676864 946849697 /nfs/dbraw/zinc/84/96/97/946849697.db2.gz PCSLAYDRRYTZDZ-PBHICJAKSA-N 0 0 358.419 3.577 20 5 FHBDRN COCCN(Cc1ccc(C)o1)C(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000473950776 946857488 /nfs/dbraw/zinc/85/74/88/946857488.db2.gz YZXBIRVUQDJRJG-UHFFFAOYSA-N 0 0 360.410 3.908 20 5 FHBDRN CCS[C@@H]1CCCC[C@H]1Nc1nc(C)cc(C(=O)OC)c1[N+](=O)[O-] ZINC000550390269 946889339 /nfs/dbraw/zinc/88/93/39/946889339.db2.gz QFDFOUHFZZPIBB-CHWSQXEVSA-N 0 0 353.444 3.561 20 5 FHBDRN CCS[C@H]1CCCC[C@H]1Nc1nc(C)cc(C(=O)OC)c1[N+](=O)[O-] ZINC000550390270 946889399 /nfs/dbraw/zinc/88/93/99/946889399.db2.gz QFDFOUHFZZPIBB-OLZOCXBDSA-N 0 0 353.444 3.561 20 5 FHBDRN CC(C)(C)c1noc2ncc(C(=O)N3CCc4c3cccc4[N+](=O)[O-])cc21 ZINC000523131841 946896330 /nfs/dbraw/zinc/89/63/30/946896330.db2.gz DBCSXJRSGMZWMD-UHFFFAOYSA-N 0 0 366.377 3.631 20 5 FHBDRN CC1CCN(C(=O)c2ccc(NCCc3ccc([N+](=O)[O-])cc3)nc2)CC1 ZINC000112553454 946902761 /nfs/dbraw/zinc/90/27/61/946902761.db2.gz AMSJODPRJUVVLM-UHFFFAOYSA-N 0 0 368.437 3.517 20 5 FHBDRN CCC[C@H](NC(=O)C(=O)Nc1c(C)ccc([N+](=O)[O-])c1C)c1ccccc1 ZINC000184501709 946907714 /nfs/dbraw/zinc/90/77/14/946907714.db2.gz DRAQLBYZFBXZJQ-INIZCTEOSA-N 0 0 369.421 3.808 20 5 FHBDRN CO[C@@H](C(=O)NCc1cccc([N+](=O)[O-])c1)c1ccccc1C(F)(F)F ZINC001126173029 946909525 /nfs/dbraw/zinc/90/95/25/946909525.db2.gz RLBKJJFORWHYQG-OAHLLOKOSA-N 0 0 368.311 3.618 20 5 FHBDRN C[C@H](NC(=O)N[C@@H](C)c1ccc([N+](=O)[O-])cc1)c1nc2c(s1)CCC2 ZINC000458885642 946915867 /nfs/dbraw/zinc/91/58/67/946915867.db2.gz GTNPDFDRDOTZDY-QWRGUYRKSA-N 0 0 360.439 3.661 20 5 FHBDRN CC(C)(C)OC(=O)N1CC[C@H](Nc2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000112594218 946917925 /nfs/dbraw/zinc/91/79/25/946917925.db2.gz DXGFJZWULQOGMT-LBPRGKRZSA-N 0 0 358.398 3.564 20 5 FHBDRN CC(C)[C@@H](c1ccccc1)N(C)S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000112706420 946932157 /nfs/dbraw/zinc/93/21/57/946932157.db2.gz BLVCBAKMQVESJH-SFHVURJKSA-N 0 0 362.451 3.754 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)c1ccc(C(F)(F)F)nc1 ZINC000186333466 946936228 /nfs/dbraw/zinc/93/62/28/946936228.db2.gz MXUZLIPKZRLUFB-UHFFFAOYSA-N 0 0 359.691 3.592 20 5 FHBDRN C[C@H](NC(=O)N1CCOC[C@H]1c1ccc(F)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000458891956 946943777 /nfs/dbraw/zinc/94/37/77/946943777.db2.gz SRWGYXHDVXRSPC-UGSOOPFHSA-N 0 0 373.384 3.578 20 5 FHBDRN C[C@H](NC(=O)N1CCCC[C@H]1c1cccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000458892934 946947814 /nfs/dbraw/zinc/94/78/14/946947814.db2.gz VZVRVJRMBLBBHW-KSSFIOAISA-N 0 0 356.426 3.931 20 5 FHBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1CCC(c2ccsc2)CC1 ZINC000186337020 946950013 /nfs/dbraw/zinc/95/00/13/946950013.db2.gz NLSIGCOTESJAEH-UHFFFAOYSA-N 0 0 366.464 3.533 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@H]1C[C@@H]1c1c(F)cccc1F ZINC000186337652 946950140 /nfs/dbraw/zinc/95/01/40/946950140.db2.gz PJCRKOUCXAOJTO-RYUDHWBXSA-N 0 0 366.751 3.946 20 5 FHBDRN Cc1ccc(S(=O)(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)c(C)c1 ZINC000511911398 946950580 /nfs/dbraw/zinc/95/05/80/946950580.db2.gz OXXYYAFIMUPPSU-UHFFFAOYSA-N 0 0 362.451 3.811 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CCC(c2ccsc2)CC1 ZINC000186338327 946961116 /nfs/dbraw/zinc/96/11/16/946961116.db2.gz KCFTUWXLYZLEFF-UHFFFAOYSA-N 0 0 366.464 3.533 20 5 FHBDRN COc1ccc([C@@H](C)CCNC(=O)c2cc(OC)ccc2[N+](=O)[O-])cc1 ZINC000152002267 946968418 /nfs/dbraw/zinc/96/84/18/946968418.db2.gz XTHNFMVWWQAKCE-ZDUSSCGKSA-N 0 0 358.394 3.536 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NC[C@H]1Cc2ccccc2N(C)C1 ZINC000444543255 946985625 /nfs/dbraw/zinc/98/56/25/946985625.db2.gz JRBBUEWNORRBRW-MRXNPFEDSA-N 0 0 367.449 3.559 20 5 FHBDRN CSc1ccc(C(=O)NCc2ccc3c(n2)CCCC3)cc1[N+](=O)[O-] ZINC000444549214 946990398 /nfs/dbraw/zinc/99/03/98/946990398.db2.gz PGNDZQKKZQSAKV-UHFFFAOYSA-N 0 0 357.435 3.521 20 5 FHBDRN CC[C@H](C)[C@@H](NC(=O)CCCNc1ccc([N+](=O)[O-])cc1)C(F)(F)F ZINC000444560409 947001178 /nfs/dbraw/zinc/00/11/78/947001178.db2.gz VMKPVUVYPRBWFR-XHDPSFHLSA-N 0 0 361.364 3.880 20 5 FHBDRN COc1cccc(NCCc2nc(-c3cccc(Cl)c3)no2)c1[N+](=O)[O-] ZINC000475391036 947002209 /nfs/dbraw/zinc/00/22/09/947002209.db2.gz NYOPUQONGGIFOI-UHFFFAOYSA-N 0 0 374.784 3.961 20 5 FHBDRN CC(C)c1nc(Cc2noc(-c3n[nH]c(C(C)C)c3[N+](=O)[O-])n2)cs1 ZINC000545681190 947004007 /nfs/dbraw/zinc/00/40/07/947004007.db2.gz MUVZXWPUPIRJQQ-UHFFFAOYSA-N 0 0 362.415 3.662 20 5 FHBDRN Cc1nn(CCC(=O)N(C)[C@H](C)c2ccc(C)cc2C)c(C)c1[N+](=O)[O-] ZINC000523223265 947006629 /nfs/dbraw/zinc/00/66/29/947006629.db2.gz TXUWNXLEBJMSMO-OAHLLOKOSA-N 0 0 358.442 3.635 20 5 FHBDRN Cc1nn(CCC(=O)N(C)Cc2ccc(C(C)(C)C)cc2)c(C)c1[N+](=O)[O-] ZINC000523228983 947012128 /nfs/dbraw/zinc/01/21/28/947012128.db2.gz LQHLHPRISOMMOY-UHFFFAOYSA-N 0 0 372.469 3.754 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])o1)N(Cc1ccccc1)C[C@H](O)c1cccs1 ZINC000129740975 947018709 /nfs/dbraw/zinc/01/87/09/947018709.db2.gz GEMMMJHVBVTGCR-AWEZNQCLSA-N 0 0 372.402 3.625 20 5 FHBDRN COc1ccc(C2CCN(Cc3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)cc1 ZINC000444635487 947047557 /nfs/dbraw/zinc/04/75/57/947047557.db2.gz DFQIJKKQZXAMLL-UHFFFAOYSA-N 0 0 366.421 3.859 20 5 FHBDRN Cc1ccc(NC(=O)C(=O)Nc2csc3ccccc23)cc1[N+](=O)[O-] ZINC000440495456 947047990 /nfs/dbraw/zinc/04/79/90/947047990.db2.gz BUFFHGVWOPHMCG-UHFFFAOYSA-N 0 0 355.375 3.695 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NCC[N@@H+]1CCCC(C)(C)C1 ZINC000444618591 947050811 /nfs/dbraw/zinc/05/08/11/947050811.db2.gz KOCDPSWDWUWMMF-UHFFFAOYSA-N 0 0 365.499 3.559 20 5 FHBDRN CC(C)CCSc1ccc(C(=O)N2CCCn3nccc32)cc1[N+](=O)[O-] ZINC000523025761 947054334 /nfs/dbraw/zinc/05/43/34/947054334.db2.gz HKDXCNILFZOPCE-UHFFFAOYSA-N 0 0 374.466 3.980 20 5 FHBDRN CC(C)Cc1ccc(CC(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000444645155 947066672 /nfs/dbraw/zinc/06/66/72/947066672.db2.gz OQWZRVCQRPNVPF-UHFFFAOYSA-N 0 0 366.421 3.529 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)Nc2cccc3c2OCCO3)cc1[N+](=O)[O-] ZINC000536292164 947073813 /nfs/dbraw/zinc/07/38/13/947073813.db2.gz HXYXAJDVFDCSOW-UHFFFAOYSA-N 0 0 356.378 3.916 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]c(CN3CC[C@@H](Oc4ccccc4Cl)C3)nc2c1 ZINC000444657850 947075801 /nfs/dbraw/zinc/07/58/01/947075801.db2.gz ACTIDXQKXASYKI-CYBMUJFWSA-N 0 0 372.812 3.778 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]c(CN3CC[C@H](Oc4cccc(Cl)c4)C3)nc2c1 ZINC000444657998 947075864 /nfs/dbraw/zinc/07/58/64/947075864.db2.gz AJIHFGMICMFSQG-HNNXBMFYSA-N 0 0 372.812 3.778 20 5 FHBDRN O=C(Nc1nccs1)c1ccc(NCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000428342684 947088380 /nfs/dbraw/zinc/08/83/80/947088380.db2.gz CBZPJAODCGUNJN-UHFFFAOYSA-N 0 0 354.391 3.916 20 5 FHBDRN O=C(c1cnc(-c2ccccc2)s1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000049624267 947091849 /nfs/dbraw/zinc/09/18/49/947091849.db2.gz BXLDJQLAUQNBOX-UHFFFAOYSA-N 0 0 351.387 3.921 20 5 FHBDRN CC(C)(C)[C@@H]1OCCC[C@H]1CNC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000522808418 947099390 /nfs/dbraw/zinc/09/93/90/947099390.db2.gz NYROAYURBBWRAB-SUMWQHHRSA-N 0 0 359.426 3.647 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC[C@H]1c1c(C)n[nH]c1C ZINC000282001688 947100245 /nfs/dbraw/zinc/10/02/45/947100245.db2.gz QMDKTUWTOBBLKH-HNNXBMFYSA-N 0 0 373.413 3.702 20 5 FHBDRN COCc1ccc([C@H]2CCCN2Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)o1 ZINC000444683941 947108363 /nfs/dbraw/zinc/10/83/63/947108363.db2.gz GWUVXSKKVXEUER-MRXNPFEDSA-N 0 0 356.382 3.548 20 5 FHBDRN CC(C)OC(=O)C[C@@H](NC(=O)C[C@@H]1C=CCCC1)c1ccccc1[N+](=O)[O-] ZINC000186375295 947111991 /nfs/dbraw/zinc/11/19/91/947111991.db2.gz FWCYUVQXVZBEPY-NVXWUHKLSA-N 0 0 374.437 3.840 20 5 FHBDRN Cc1nn(C(C)(C)C)cc1[C@H](C)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444688360 947113474 /nfs/dbraw/zinc/11/34/74/947113474.db2.gz JFEKJKYEMOWJQL-NSHDSACASA-N 0 0 356.430 3.582 20 5 FHBDRN CCOc1ccc(OCC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1 ZINC000129749009 947113616 /nfs/dbraw/zinc/11/36/16/947113616.db2.gz IXUPRAUAGUJQQP-UHFFFAOYSA-N 0 0 370.405 3.564 20 5 FHBDRN C[C@@H](OC(=O)c1ccc([N+](=O)[O-])s1)C(=O)Nc1cccc2ccccc21 ZINC000021139893 947115250 /nfs/dbraw/zinc/11/52/50/947115250.db2.gz VQQMSAFUYQFUIF-LLVKDONJSA-N 0 0 370.386 3.994 20 5 FHBDRN CN(CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])Cc1cc(F)cc(F)c1 ZINC000444692816 947116443 /nfs/dbraw/zinc/11/64/43/947116443.db2.gz NKJMFJJQBNLQTA-UHFFFAOYSA-N 0 0 369.755 3.597 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1-n1cccn1 ZINC000049703789 947118723 /nfs/dbraw/zinc/11/87/23/947118723.db2.gz JISKGMIUMWMDJU-ZDUSSCGKSA-N 0 0 368.418 3.900 20 5 FHBDRN CCc1n[nH]c(C(=O)N2C[C@H](c3ccccc3)[C@@H]3CCCC[C@@H]32)c1[N+](=O)[O-] ZINC000444356823 947123734 /nfs/dbraw/zinc/12/37/34/947123734.db2.gz FMIBOJFZVOKIQU-UXLLHSPISA-N 0 0 368.437 3.679 20 5 FHBDRN C[C@H](NCc1c([N+](=O)[O-])ncn1C)c1cccc(OCc2ccccc2)c1 ZINC000444705557 947133444 /nfs/dbraw/zinc/13/34/44/947133444.db2.gz NFSYLLKHRLZCNR-HNNXBMFYSA-N 0 0 366.421 3.758 20 5 FHBDRN Cc1c(NC(=O)c2ccc(-c3cncnc3)cc2F)cccc1[N+](=O)[O-] ZINC000186392080 947135435 /nfs/dbraw/zinc/13/54/35/947135435.db2.gz OQMVTIHLLKYEQF-UHFFFAOYSA-N 0 0 352.325 3.752 20 5 FHBDRN O=c1onc(-c2cccnc2)n1Cc1nc2ccccc2c2ccccc12 ZINC000523350717 947144460 /nfs/dbraw/zinc/14/44/60/947144460.db2.gz CIWLQOADCXFLBU-UHFFFAOYSA-N 0 0 354.369 3.648 20 5 FHBDRN Cc1ccc(F)cc1S(=O)(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000511956780 947144743 /nfs/dbraw/zinc/14/47/43/947144743.db2.gz UKEHFQQRMHKEHC-UHFFFAOYSA-N 0 0 366.414 3.642 20 5 FHBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)c1noc2c1CCCCC2 ZINC000440530570 947145023 /nfs/dbraw/zinc/14/50/23/947145023.db2.gz HYVFYEAGUXTZCF-UHFFFAOYSA-N 0 0 357.410 3.604 20 5 FHBDRN CC(C)[C@@H]1CN(C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)[C@@H]1C(C)C ZINC000456284041 947145251 /nfs/dbraw/zinc/14/52/51/947145251.db2.gz IOVHOIAGYDFNRR-MAUKXSAKSA-N 0 0 356.426 3.533 20 5 FHBDRN O=C(c1ccc(NC2CC2)c([N+](=O)[O-])c1)N1CCC[C@@H]1c1ccncc1 ZINC000026001028 947145350 /nfs/dbraw/zinc/14/53/50/947145350.db2.gz HZRPLBRTARTYGH-QGZVFWFLSA-N 0 0 352.394 3.541 20 5 FHBDRN CC(=O)N1CC[C@@H]([NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c2ccc(F)cc2C1 ZINC000184521763 947158786 /nfs/dbraw/zinc/15/87/86/947158786.db2.gz WQOJEWGUXFSGBB-RNODOKPDSA-N 0 0 371.412 3.878 20 5 FHBDRN C[C@@H](NCc1c([N+](=O)[O-])ncn1C)c1cccc(OCc2ccccc2)c1 ZINC000444725481 947168875 /nfs/dbraw/zinc/16/88/75/947168875.db2.gz NFSYLLKHRLZCNR-OAHLLOKOSA-N 0 0 366.421 3.758 20 5 FHBDRN C[C@H](N[C@H](c1ccco1)c1ccccc1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000049974185 947179369 /nfs/dbraw/zinc/17/93/69/947179369.db2.gz IADOAGCYFBJMHG-LIRRHRJNSA-N 0 0 365.389 3.894 20 5 FHBDRN Cc1cc(NC(=O)c2cc(F)cc3c(=O)c4cc(F)ccc4[nH]c23)sn1 ZINC000444744319 947182659 /nfs/dbraw/zinc/18/26/59/947182659.db2.gz MASYXHRHILOYGH-UHFFFAOYSA-N 0 0 371.368 3.977 20 5 FHBDRN COc1ccc(-c2nc3ccc(Br)cc3n2C)cc1[N+](=O)[O-] ZINC000536302391 947200823 /nfs/dbraw/zinc/20/08/23/947200823.db2.gz BTNDARSFMVQEAV-UHFFFAOYSA-N 0 0 362.183 3.920 20 5 FHBDRN CCCN(C(=O)Cc1ccc(NC(C)=O)cc1)c1cccc([N+](=O)[O-])c1 ZINC000441432967 947201991 /nfs/dbraw/zinc/20/19/91/947201991.db2.gz YUPCAYFLGRCCJT-UHFFFAOYSA-N 0 0 355.394 3.539 20 5 FHBDRN COc1cc(C(=O)NCc2cccc(Cl)c2Cl)ccc1[N+](=O)[O-] ZINC000523380574 947203925 /nfs/dbraw/zinc/20/39/25/947203925.db2.gz YBVLWRNBXJTYOK-UHFFFAOYSA-N 0 0 355.177 3.840 20 5 FHBDRN CCC(=O)c1ccc(OCC(=O)O[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000021227149 947261677 /nfs/dbraw/zinc/26/16/77/947261677.db2.gz AYQWSYZEBDZBHZ-ZDUSSCGKSA-N 0 0 357.362 3.871 20 5 FHBDRN COc1ccc(NC(=O)c2sc(Br)cc2[N+](=O)[O-])cc1 ZINC000444834766 947267468 /nfs/dbraw/zinc/26/74/68/947267468.db2.gz LEGIZGRSJURZDB-UHFFFAOYSA-N 0 0 357.185 3.680 20 5 FHBDRN Cc1cc([C@H](C)NC(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)c(C)s1 ZINC000444855372 947281837 /nfs/dbraw/zinc/28/18/37/947281837.db2.gz YBQNBULCNVSYNV-JTQLQIEISA-N 0 0 373.438 3.710 20 5 FHBDRN O=C(Nc1ccc2oc(=O)[nH]c2c1)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000444856947 947283515 /nfs/dbraw/zinc/28/35/15/947283515.db2.gz KLLWAQCYBCRTKV-UHFFFAOYSA-N 0 0 371.352 3.780 20 5 FHBDRN O=C(Nc1ccc2n[nH]cc2c1)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000444858280 947284219 /nfs/dbraw/zinc/28/42/19/947284219.db2.gz MCJBQUJWHYCQNB-UHFFFAOYSA-N 0 0 354.369 3.810 20 5 FHBDRN CN(C(=O)c1cnc(Cc2ccccc2)s1)c1ccc([N+](=O)[O-])cc1 ZINC000087069748 947294063 /nfs/dbraw/zinc/29/40/63/947294063.db2.gz UXVAQYOBJMTXEW-UHFFFAOYSA-N 0 0 353.403 3.919 20 5 FHBDRN CC(C)(C)[C@H]1CCCC[C@H]1NC(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444885139 947310489 /nfs/dbraw/zinc/31/04/89/947310489.db2.gz MXVXUSLYVXLEHV-UONOGXRCSA-N 0 0 373.457 3.875 20 5 FHBDRN Cc1nc(-c2ccc(NC(=O)C(C)(C)c3ccc([N+](=O)[O-])cc3)cc2)n[nH]1 ZINC000523508124 947319683 /nfs/dbraw/zinc/31/96/83/947319683.db2.gz JEHWPHMNUBTITH-UHFFFAOYSA-N 0 0 365.393 3.605 20 5 FHBDRN CC(C)(C(=O)NCCCOCCc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000523509134 947322221 /nfs/dbraw/zinc/32/22/21/947322221.db2.gz KKJYVQFLCVUGBZ-UHFFFAOYSA-N 0 0 370.449 3.638 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[C@H](c2ccccc2F)C1 ZINC000444901567 947322234 /nfs/dbraw/zinc/32/22/34/947322234.db2.gz MMFNSGBNRJQCLT-LBPRGKRZSA-N 0 0 359.357 3.764 20 5 FHBDRN Cc1ccc(NCCCNC(=O)C(C)(C)c2cccs2)c([N+](=O)[O-])c1 ZINC000523510889 947324404 /nfs/dbraw/zinc/32/44/04/947324404.db2.gz HWUHFSOKJHCFKT-UHFFFAOYSA-N 0 0 361.467 3.861 20 5 FHBDRN Cc1c(F)ccc([N+](=O)[O-])c1C(=O)Nc1ccc(N2CCCCC2)cn1 ZINC000843772157 947331417 /nfs/dbraw/zinc/33/14/17/947331417.db2.gz UFWMFCWUPDGYQD-UHFFFAOYSA-N 0 0 358.373 3.680 20 5 FHBDRN Cc1noc2nc(C)cc(C(=O)NCCCCc3ccc([N+](=O)[O-])cc3)c12 ZINC000523500335 947332152 /nfs/dbraw/zinc/33/21/52/947332152.db2.gz RGTQEKYIRPPRKC-UHFFFAOYSA-N 0 0 368.393 3.501 20 5 FHBDRN CCCOc1ccc(CNC(=O)Nc2ccc([N+](=O)[O-])cc2OC)cc1 ZINC000444893570 947332218 /nfs/dbraw/zinc/33/22/18/947332218.db2.gz GKMSCVRHCVMVOS-UHFFFAOYSA-N 0 0 359.382 3.714 20 5 FHBDRN COc1ccc(CCNc2c(F)cc([N+](=O)[O-])cc2F)c(OC)c1OC ZINC000440600097 947333570 /nfs/dbraw/zinc/33/35/70/947333570.db2.gz ZYAGMCUBLRXSNM-UHFFFAOYSA-N 0 0 368.336 3.553 20 5 FHBDRN Cc1ccc(/C=C/CC(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000440584404 947336778 /nfs/dbraw/zinc/33/67/78/947336778.db2.gz ZYRYEUCAEVUFQQ-DUXPYHPUSA-N 0 0 365.433 3.655 20 5 FHBDRN Cn1cccc1CNC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000440600717 947353888 /nfs/dbraw/zinc/35/38/88/947353888.db2.gz JAOGWNIVBCVCAW-UHFFFAOYSA-N 0 0 350.378 3.607 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NCCc1c(C)[nH]c2ccccc21 ZINC000444937577 947360494 /nfs/dbraw/zinc/36/04/94/947360494.db2.gz QWHLMEFIUJSVIS-UHFFFAOYSA-N 0 0 368.393 3.757 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@H]1SCCc2ccccc21 ZINC000444937480 947360640 /nfs/dbraw/zinc/36/06/40/947360640.db2.gz QUCIBAUKOUAPLY-QGZVFWFLSA-N 0 0 373.434 3.756 20 5 FHBDRN Cc1ccccc1[C@H](CC(F)(F)F)NC(=O)Nc1ccncc1[N+](=O)[O-] ZINC000444939544 947362113 /nfs/dbraw/zinc/36/21/13/947362113.db2.gz BIWSWUOSBRXZBX-ZDUSSCGKSA-N 0 0 368.315 3.535 20 5 FHBDRN O=C(Nc1ccncc1[N+](=O)[O-])N1CCCC[C@H]1c1cccc(Cl)c1 ZINC000444944766 947365388 /nfs/dbraw/zinc/36/53/88/947365388.db2.gz STUSNXYJEIGXDF-HNNXBMFYSA-N 0 0 360.801 3.824 20 5 FHBDRN Cc1cccc([C@@H](C)NC(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)c1C ZINC000444972801 947381847 /nfs/dbraw/zinc/38/18/47/947381847.db2.gz CZSJYPPDKYPDMO-CYBMUJFWSA-N 0 0 367.409 3.648 20 5 FHBDRN O=C(CCCc1cccs1)O[C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000759929758 947395244 /nfs/dbraw/zinc/39/52/44/947395244.db2.gz HYWFVJVKYBISDZ-CABCVRRESA-N 0 0 363.439 3.903 20 5 FHBDRN COc1ccc(CNC(=O)Nc2ncc(C(C)(C)C)s2)cc1[N+](=O)[O-] ZINC000438542460 947397421 /nfs/dbraw/zinc/39/74/21/947397421.db2.gz BWVZARPQDAVFOK-UHFFFAOYSA-N 0 0 364.427 3.679 20 5 FHBDRN Cc1c(CC(=O)N[C@@H](C)c2cccc(N3CCCC3)c2)cccc1[N+](=O)[O-] ZINC000129519302 947398178 /nfs/dbraw/zinc/39/81/78/947398178.db2.gz AINQYIYVKBMGLO-INIZCTEOSA-N 0 0 367.449 3.923 20 5 FHBDRN C[C@@H](CNc1ccccc1)NC(=O)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000444986312 947398561 /nfs/dbraw/zinc/39/85/61/947398561.db2.gz ASDPHTMHMPTVJK-HNNXBMFYSA-N 0 0 371.440 3.912 20 5 FHBDRN CCC[C@@H](C)c1cc(=NC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)[nH][nH]1 ZINC000444987741 947401902 /nfs/dbraw/zinc/40/19/02/947401902.db2.gz DSJLNJQWIOAATJ-CYBMUJFWSA-N 0 0 374.444 3.982 20 5 FHBDRN O=C(Nc1nc2c(s1)CSCC2)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000367718518 947403272 /nfs/dbraw/zinc/40/32/72/947403272.db2.gz DFGRGHBECUHKFQ-UHFFFAOYSA-N 0 0 355.828 3.746 20 5 FHBDRN O=[N+]([O-])c1cc(F)ccc1NC[C@H](O)c1cccc(Br)c1 ZINC000799972380 947408059 /nfs/dbraw/zinc/40/80/59/947408059.db2.gz JJAUOMMQFRCHSS-AWEZNQCLSA-N 0 0 355.163 3.642 20 5 FHBDRN O=C(Nc1ccc2cc([N+](=O)[O-])ccc2n1)[C@H]1CCC[C@H](C(F)(F)F)C1 ZINC000440629009 947414236 /nfs/dbraw/zinc/41/42/36/947414236.db2.gz XORPUGMPNLJDFE-RYUDHWBXSA-N 0 0 367.327 3.872 20 5 FHBDRN CC[C@H](CNC(=O)Cc1cccc([N+](=O)[O-])c1)Oc1cccc(Cl)c1 ZINC000440629327 947431898 /nfs/dbraw/zinc/43/18/98/947431898.db2.gz SYNAPFMGSXWUOJ-MRXNPFEDSA-N 0 0 362.813 3.765 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N[C@H]1CCOc2c(F)cccc21 ZINC000190293197 947435991 /nfs/dbraw/zinc/43/59/91/947435991.db2.gz OVIQZEDKBPYWQI-AWEZNQCLSA-N 0 0 359.357 3.996 20 5 FHBDRN CC(C)(C(=O)Nc1cc(C(F)(F)F)ccn1)c1ccc([N+](=O)[O-])cc1 ZINC000507750898 947436709 /nfs/dbraw/zinc/43/67/09/947436709.db2.gz BILJWKNZEPTIKC-UHFFFAOYSA-N 0 0 353.300 3.925 20 5 FHBDRN Cc1ccc(CNC(=O)Cc2cccc([N+](=O)[O-])c2)c(OC(C)(C)C)c1 ZINC000440634366 947447802 /nfs/dbraw/zinc/44/78/02/947447802.db2.gz HNPHRTXYVFPRHX-UHFFFAOYSA-N 0 0 356.422 3.939 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(C(=O)N2CCS[C@H](C)[C@H]2c2ccccc2)n1 ZINC001126203422 947476433 /nfs/dbraw/zinc/47/64/33/947476433.db2.gz LGCSWNLBOPIYQQ-DYVFJYSZSA-N 0 0 357.435 3.617 20 5 FHBDRN C[C@H](NC(=O)c1ccccc1Sc1ccccc1[N+](=O)[O-])[C@@H]1CCOC1 ZINC000440645987 947478202 /nfs/dbraw/zinc/47/82/02/947478202.db2.gz MMJSTFDUFFVAKK-UONOGXRCSA-N 0 0 372.446 3.901 20 5 FHBDRN CCCN(C(=O)CCc1cc(OC)cc(OC)c1)c1cccc([N+](=O)[O-])c1 ZINC000441447108 947484738 /nfs/dbraw/zinc/48/47/38/947484738.db2.gz MKKAVBKYBSGNNV-UHFFFAOYSA-N 0 0 372.421 3.988 20 5 FHBDRN COc1ccc(C(C)=O)c(O[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)c1 ZINC000021372981 947499697 /nfs/dbraw/zinc/49/96/97/947499697.db2.gz JHROYXHAPWPNOM-CYBMUJFWSA-N 0 0 372.377 3.520 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)Nc1ccc2c(c1)OCCCO2 ZINC000093904989 947518954 /nfs/dbraw/zinc/51/89/54/947518954.db2.gz HMFOZFJAKZEZAW-UHFFFAOYSA-N 0 0 356.378 3.934 20 5 FHBDRN C[C@@H]([C@H](C)NC(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)C1CCCCC1 ZINC000445108313 947520931 /nfs/dbraw/zinc/52/09/31/947520931.db2.gz JLQCEDNLIVZGKW-STQMWFEESA-N 0 0 373.457 3.875 20 5 FHBDRN COc1ccc(CSCC(=O)N[C@@H](C)CC(C)(C)C)cc1[N+](=O)[O-] ZINC000457232124 947534443 /nfs/dbraw/zinc/53/44/43/947534443.db2.gz RLLPXZXBJXHFMS-LBPRGKRZSA-N 0 0 354.472 3.778 20 5 FHBDRN O=C(Nc1ccc(O[C@H]2CCCC[C@H]2O)cc1)c1ccc([N+](=O)[O-])cc1F ZINC000125728942 947545175 /nfs/dbraw/zinc/54/51/75/947545175.db2.gz COSAZHWDHGLLBB-MSOLQXFVSA-N 0 0 374.368 3.669 20 5 FHBDRN COc1ccccc1[C@H](C)N(C)C(=O)COc1cccc([N+](=O)[O-])c1C ZINC000053837867 947554473 /nfs/dbraw/zinc/55/44/73/947554473.db2.gz UNWZUEKOAIQWBF-AWEZNQCLSA-N 0 0 358.394 3.510 20 5 FHBDRN C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)[C@@H](C)CO1 ZINC000120340094 947562983 /nfs/dbraw/zinc/56/29/83/947562983.db2.gz BQYSVHQBUBXPBF-KBPBESRZSA-N 0 0 356.378 3.637 20 5 FHBDRN Cc1coc2ccc(NC(=O)NCc3nc4cc([N+](=O)[O-])ccc4[nH]3)cc12 ZINC000445167496 947563275 /nfs/dbraw/zinc/56/32/75/947563275.db2.gz UVBMEEMLSXIYDV-UHFFFAOYSA-N 0 0 365.349 3.847 20 5 FHBDRN Cc1ccc(C)c(NC(=O)[C@@H](C)N2CCc3ccc([N+](=O)[O-])cc3C2)c1 ZINC000088605601 947569026 /nfs/dbraw/zinc/56/90/26/947569026.db2.gz TXFIPGKFKUYMKE-OAHLLOKOSA-N 0 0 353.422 3.597 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1)CN(Cc1nc3ccccc3n1C(F)F)CC2 ZINC000088607471 947576720 /nfs/dbraw/zinc/57/67/20/947576720.db2.gz KSRASSGAEOXQKQ-UHFFFAOYSA-N 0 0 358.348 3.898 20 5 FHBDRN CCc1csc(NC(=O)c2sc(Br)cc2[N+](=O)[O-])n1 ZINC000445187442 947578591 /nfs/dbraw/zinc/57/85/91/947578591.db2.gz NBWDQFYKNOHBKI-UHFFFAOYSA-N 0 0 362.230 3.690 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1)CN(Cc1coc(-c3cccc(F)c3)n1)CC2 ZINC000088606030 947586171 /nfs/dbraw/zinc/58/61/71/947586171.db2.gz ADWFMWBLIMRCNG-UHFFFAOYSA-N 0 0 353.353 3.947 20 5 FHBDRN Cc1cc(NCCC(=O)N2CCCCCC2)c2cccc([N+](=O)[O-])c2n1 ZINC000302036820 947586832 /nfs/dbraw/zinc/58/68/32/947586832.db2.gz VBTOTIQQEBHAEN-UHFFFAOYSA-N 0 0 356.426 3.656 20 5 FHBDRN O=C(O[C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1)c1cc(F)cc(Cl)c1 ZINC000759934194 947587079 /nfs/dbraw/zinc/58/70/79/947587079.db2.gz PNLNRMGLBLTKDX-ZIAGYGMSSA-N 0 0 367.764 3.925 20 5 FHBDRN Cn1c(-c2ccc([N+](=O)[O-])cc2)nnc1N1CC[C@@H](c2ccc(F)cc2)C1 ZINC000508523305 947617342 /nfs/dbraw/zinc/61/73/42/947617342.db2.gz DEQNKQOCPMERIJ-OAHLLOKOSA-N 0 0 367.384 3.523 20 5 FHBDRN Cc1cccc(CCC(=O)O[C@@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)c1 ZINC000759935698 947620893 /nfs/dbraw/zinc/62/08/93/947620893.db2.gz ZAIKPIRXQONNNQ-IAGOWNOFSA-N 0 0 357.410 3.759 20 5 FHBDRN COC(=O)c1cccc(NC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)c1 ZINC000445251278 947626009 /nfs/dbraw/zinc/62/60/09/947626009.db2.gz SCZJCTMVFXBNBA-UHFFFAOYSA-N 0 0 372.380 3.720 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)c1ccncc1Oc1ccccc1 ZINC000440700165 947630011 /nfs/dbraw/zinc/63/00/11/947630011.db2.gz ZLCBOIPWFOGNAE-UHFFFAOYSA-N 0 0 363.373 3.755 20 5 FHBDRN CC(C)(C)[C@H]1CCCN(C(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)CC1 ZINC000523822474 947640329 /nfs/dbraw/zinc/64/03/29/947640329.db2.gz WIATZESCKDUVIR-ZDUSSCGKSA-N 0 0 362.426 3.654 20 5 FHBDRN CCOc1ccc(C(=O)N[C@@H]2C[C@@H]2c2c(F)cccc2F)cc1[N+](=O)[O-] ZINC000523828645 947646730 /nfs/dbraw/zinc/64/67/30/947646730.db2.gz ZDXHTIJUVFKSGU-SMDDNHRTSA-N 0 0 362.332 3.558 20 5 FHBDRN Cc1onc(C2CC2)c1C(=O)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452852674 947653368 /nfs/dbraw/zinc/65/33/68/947653368.db2.gz NIKKRCPFMYSYIY-HNNXBMFYSA-N 0 0 355.394 3.788 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccc(O[C@H]2CCCC[C@H]2O)cc1 ZINC000125742856 947653601 /nfs/dbraw/zinc/65/36/01/947653601.db2.gz ZWLPPKWMFYPMMY-MOPGFXCFSA-N 0 0 370.405 3.838 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2nc(CN[C@H](CO)c3cccc(F)c3)cs2)c1 ZINC000523840047 947660880 /nfs/dbraw/zinc/66/08/80/947660880.db2.gz OUMJUMGAFHOJPL-QGZVFWFLSA-N 0 0 373.409 3.681 20 5 FHBDRN C[C@H](NS(=O)(=O)c1ccccc1[N+](=O)[O-])c1cccc2ccccc21 ZINC000016090619 947665058 /nfs/dbraw/zinc/66/50/58/947665058.db2.gz IOOBIHBLDGTTEG-ZDUSSCGKSA-N 0 0 356.403 3.788 20 5 FHBDRN Cc1ccc(C(=O)N2CCC(OCCc3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000523867725 947678181 /nfs/dbraw/zinc/67/81/81/947678181.db2.gz VAPFCWCIBCIPKD-UHFFFAOYSA-N 0 0 368.433 3.767 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1N[C@H](CO)c1cccc(F)c1 ZINC000523875241 947686047 /nfs/dbraw/zinc/68/60/47/947686047.db2.gz OWTSCROMOIUCCT-CYBMUJFWSA-N 0 0 355.163 3.642 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CC2(CCC2)[C@@H]1c1ccccc1 ZINC000432305728 947689852 /nfs/dbraw/zinc/68/98/52/947689852.db2.gz JQIODHCKFGNLAX-SFHVURJKSA-N 0 0 372.446 3.819 20 5 FHBDRN COc1ccc(C(=O)N(CCc2ccc(F)cc2)C2CC2)cc1[N+](=O)[O-] ZINC000523888569 947690064 /nfs/dbraw/zinc/69/00/64/947690064.db2.gz NIJCBQDTILXOAW-UHFFFAOYSA-N 0 0 358.369 3.590 20 5 FHBDRN CC(C)c1[nH]nc(-c2nc(Cc3ccc4c(c3)CCC4)no2)c1[N+](=O)[O-] ZINC000445302601 947709686 /nfs/dbraw/zinc/70/96/86/947709686.db2.gz WINJAGNSMFNYLY-UHFFFAOYSA-N 0 0 353.382 3.571 20 5 FHBDRN COCCCN(C)C(=O)c1ccccc1Sc1ccccc1[N+](=O)[O-] ZINC000440724954 947737922 /nfs/dbraw/zinc/73/79/22/947737922.db2.gz LJIQOPWMDHMPQG-UHFFFAOYSA-N 0 0 360.435 3.855 20 5 FHBDRN Cc1ccc(OCC(=O)O[C@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)cc1C ZINC000759937800 947742270 /nfs/dbraw/zinc/74/22/70/947742270.db2.gz IXLWWHXJQQGZBE-SJORKVTESA-N 0 0 373.409 3.514 20 5 FHBDRN CCn1c2ccccc2nc1[C@@H](C)NC(=O)Cc1cccc([N+](=O)[O-])c1C ZINC000121561145 947747539 /nfs/dbraw/zinc/74/75/39/947747539.db2.gz BSPIEJDDSKRXSW-CQSZACIVSA-N 0 0 366.421 3.693 20 5 FHBDRN CC(=O)CCc1ccc(O[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 ZINC000021557273 947748608 /nfs/dbraw/zinc/74/86/08/947748608.db2.gz ZQZGBULISAEDDI-HNNXBMFYSA-N 0 0 370.405 3.831 20 5 FHBDRN Cc1cc(Cl)cc(NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)c1O ZINC000523943794 947749982 /nfs/dbraw/zinc/74/99/82/947749982.db2.gz HTAYQGITAUMDJV-UHFFFAOYSA-N 0 0 372.768 3.700 20 5 FHBDRN Cc1sc(Br)c(C(=O)NCc2ccccc2[N+](=O)[O-])c1C ZINC000440731494 947754602 /nfs/dbraw/zinc/75/46/02/947754602.db2.gz KPEURVJJQQYKMM-UHFFFAOYSA-N 0 0 369.240 3.966 20 5 FHBDRN Cc1ccc(CC(=O)O[C@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)cc1C ZINC000759943558 947831801 /nfs/dbraw/zinc/83/18/01/947831801.db2.gz RYZYUZPKMJDXOI-SJORKVTESA-N 0 0 357.410 3.678 20 5 FHBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)N1CC2(CCC2)[C@@H]1c1ccccc1 ZINC000432309017 947846420 /nfs/dbraw/zinc/84/64/20/947846420.db2.gz WCYNWCGSAXICSH-SFHVURJKSA-N 0 0 372.446 3.652 20 5 FHBDRN CO[C@@](C)(CNC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000459018310 947849949 /nfs/dbraw/zinc/84/99/49/947849949.db2.gz LLLRPBAJBGJNPR-FQEVSTJZSA-N 0 0 371.437 3.691 20 5 FHBDRN Cc1nn(C)c(C(=O)Nc2cc(Cl)cc(C(F)(F)F)c2)c1[N+](=O)[O-] ZINC000184612328 947860778 /nfs/dbraw/zinc/86/07/78/947860778.db2.gz WYNLQYZWEYFDBL-UHFFFAOYSA-N 0 0 362.695 3.561 20 5 FHBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)c1c(Cl)nn(C)c1Cl ZINC001126248269 947863392 /nfs/dbraw/zinc/86/33/92/947863392.db2.gz NSSZMOAILZKWOV-UHFFFAOYSA-N 0 0 363.588 3.849 20 5 FHBDRN Cc1cc(C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)nn1C(F)F ZINC000536381749 947878967 /nfs/dbraw/zinc/87/89/67/947878967.db2.gz HTXMQLYXFDCPOI-UHFFFAOYSA-N 0 0 352.341 3.546 20 5 FHBDRN CO[C@@H](CNc1ccc(C(=O)Nc2ccc(C)cc2)cc1[N+](=O)[O-])C1CC1 ZINC000549605451 947881877 /nfs/dbraw/zinc/88/18/77/947881877.db2.gz LBQRWEGICJUPHL-IBGZPJMESA-N 0 0 369.421 3.992 20 5 FHBDRN CC(C)c1ncc(Cl)c(C(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)n1 ZINC000129534293 947903337 /nfs/dbraw/zinc/90/33/37/947903337.db2.gz LPIIXUMMVJMEKY-UHFFFAOYSA-N 0 0 374.828 3.966 20 5 FHBDRN Cc1ccc(NC(=O)C2CCN(c3c(Cl)cccc3[N+](=O)[O-])CC2)nc1 ZINC000432313256 947910293 /nfs/dbraw/zinc/91/02/93/947910293.db2.gz RKIMWKJUWRUVRO-UHFFFAOYSA-N 0 0 374.828 3.807 20 5 FHBDRN O=C(NC[C@H]1CCOC2(CCC2)C1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000459030427 947922145 /nfs/dbraw/zinc/92/21/45/947922145.db2.gz VGQBYKNGFBXKSL-INIZCTEOSA-N 0 0 373.453 3.618 20 5 FHBDRN CN(c1ccccc1)c1cc(N2CCc3ccc([N+](=O)[O-])cc3C2)ncn1 ZINC000432316329 947969169 /nfs/dbraw/zinc/96/91/69/947969169.db2.gz WDIGJOJDKBCWRK-UHFFFAOYSA-N 0 0 361.405 3.715 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)Nc1cccc(-c2nc[nH]n2)c1 ZINC000094137847 947970109 /nfs/dbraw/zinc/97/01/09/947970109.db2.gz WTEIWOFAXXWREX-UHFFFAOYSA-N 0 0 351.366 3.557 20 5 FHBDRN O=C(c1cccc([C@@H]2CCOC2)c1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000536396930 947995289 /nfs/dbraw/zinc/99/52/89/947995289.db2.gz ZXOLXKHZGFEOAP-GOSISDBHSA-N 0 0 366.417 3.904 20 5 FHBDRN CC[C@@H](c1ccccc1)N(CC(=O)OC)C(=O)c1cc(C)cc([N+](=O)[O-])c1 ZINC000536403992 948006549 /nfs/dbraw/zinc/00/65/49/948006549.db2.gz YETCJGIDIOSNGL-SFHVURJKSA-N 0 0 370.405 3.670 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CC[C@@]2(C1)OCc1ccccc12 ZINC000184640365 948013433 /nfs/dbraw/zinc/01/34/33/948013433.db2.gz RRSLLJRHYSLSJK-FQEVSTJZSA-N 0 0 367.405 3.875 20 5 FHBDRN CCC[C@H](NC(=O)COC(=O)c1ccc([N+](=O)[O-])c(C)c1)c1ccccc1 ZINC000005135946 948015205 /nfs/dbraw/zinc/01/52/05/948015205.db2.gz DRQATVCLGVUHGU-KRWDZBQOSA-N 0 0 370.405 3.718 20 5 FHBDRN Cc1nc(NCc2cccc([N+](=O)[O-])c2)ccc1I ZINC000094151038 948016321 /nfs/dbraw/zinc/01/63/21/948016321.db2.gz GLYNJXJGBICJGD-UHFFFAOYSA-N 0 0 369.162 3.515 20 5 FHBDRN CC(=O)N1C=Cc2ccccc2[C@@H]1CC(=O)Oc1cccc([N+](=O)[O-])c1C ZINC000051705129 948017330 /nfs/dbraw/zinc/01/73/30/948017330.db2.gz DGBYHOGAQBKFFP-SFHVURJKSA-N 0 0 366.373 3.773 20 5 FHBDRN Cc1c([N+](=O)[O-])cc(C(=O)N2C[C@@H](C)Cc3ccccc32)cc1[N+](=O)[O-] ZINC000105378717 948022065 /nfs/dbraw/zinc/02/20/65/948022065.db2.gz FGFVAUJKCZPCHC-NSHDSACASA-N 0 0 355.350 3.650 20 5 FHBDRN Cc1ccc(Cl)cc1NC(=O)[C@@H](C)OC(=O)c1ccccc1[N+](=O)[O-] ZINC000105549291 948062097 /nfs/dbraw/zinc/06/20/97/948062097.db2.gz ASXWJXWYWXVCSB-LLVKDONJSA-N 0 0 362.769 3.741 20 5 FHBDRN O=C(C1CCCCC1)N1CC[C@H](Nc2ccnc3c2cccc3[N+](=O)[O-])C1 ZINC000432327945 948083713 /nfs/dbraw/zinc/08/37/13/948083713.db2.gz IJFISSBHRVBWEG-HNNXBMFYSA-N 0 0 368.437 3.736 20 5 FHBDRN O=C(Cc1cccc([N+](=O)[O-])c1)N1CCCCC[C@H]1[C@H]1CCCCC1=O ZINC000164529131 948084165 /nfs/dbraw/zinc/08/41/65/948084165.db2.gz NGTMCPMAZRDHHP-MSOLQXFVSA-N 0 0 358.438 3.668 20 5 FHBDRN COc1ccc(OC(=O)Cc2ccc(-n3cccc3)cc2)c([N+](=O)[O-])c1 ZINC000106196681 948094472 /nfs/dbraw/zinc/09/44/72/948094472.db2.gz RUXRCLMHKTVVOJ-UHFFFAOYSA-N 0 0 352.346 3.542 20 5 FHBDRN O=C(CCc1c(Cl)cccc1[N+](=O)[O-])N[C@@H]1C[C@@H]1Cc1ccccc1 ZINC001126288664 948105647 /nfs/dbraw/zinc/10/56/47/948105647.db2.gz HEJLGQZQBNQGSD-WMLDXEAASA-N 0 0 358.825 3.928 20 5 FHBDRN Cc1cc(Cl)ccc1N1C(=O)C(=Cc2ccc([N+](=O)[O-])cc2)NC1=S ZINC000008207872 948108192 /nfs/dbraw/zinc/10/81/92/948108192.db2.gz YLOYCMWAERKZGH-NTEUORMPSA-N 0 0 373.821 3.819 20 5 FHBDRN Cc1cnc(-c2cccc(NC(=O)NCCc3ccc([N+](=O)[O-])cc3)c2)o1 ZINC000066975243 948108271 /nfs/dbraw/zinc/10/82/71/948108271.db2.gz UAUVCJIQJOPJJG-UHFFFAOYSA-N 0 0 366.377 3.922 20 5 FHBDRN CSc1ccc(C(=O)Oc2ccc3c(c2)OC(=O)C[C@@H]3C)cc1[N+](=O)[O-] ZINC000785362350 948126398 /nfs/dbraw/zinc/12/63/98/948126398.db2.gz LPIUYESNGWLKED-JTQLQIEISA-N 0 0 373.386 3.949 20 5 FHBDRN CC(C)n1cc2c(n1)C[C@@H](Nc1ccnc3c1cccc3[N+](=O)[O-])CC2 ZINC000432333450 948133850 /nfs/dbraw/zinc/13/38/50/948133850.db2.gz GVDIFWJACUJUIA-AWEZNQCLSA-N 0 0 351.410 3.890 20 5 FHBDRN C[C@H](Nc1ccnc2c1cccc2[N+](=O)[O-])c1cn(-c2ccccc2)nn1 ZINC000432334986 948143172 /nfs/dbraw/zinc/14/31/72/948143172.db2.gz ICSGKFHGDPFWKJ-ZDUSSCGKSA-N 0 0 360.377 3.897 20 5 FHBDRN C[C@@H](O)C[C@H]1CCCN1c1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000133365188 948156837 /nfs/dbraw/zinc/15/68/37/948156837.db2.gz VMUWBCYPKLPOBM-RHSMWYFYSA-N 0 0 354.406 3.566 20 5 FHBDRN CCCCNC(=O)[C@@H]1CC[C@H](C)N(c2ccnc3c2cccc3[N+](=O)[O-])C1 ZINC000432340771 948158796 /nfs/dbraw/zinc/15/87/96/948158796.db2.gz PDJHZWHDHYTPRR-LSDHHAIUSA-N 0 0 370.453 3.664 20 5 FHBDRN Cc1cc(C)cc(N2CC[C@H](C(=O)Nc3cccc([N+](=O)[O-])c3C)C2=O)c1 ZINC000053085087 948174519 /nfs/dbraw/zinc/17/45/19/948174519.db2.gz VRAMSRGETGCMPY-MRXNPFEDSA-N 0 0 367.405 3.512 20 5 FHBDRN CC(=O)N1CCN(c2c(Cl)cccc2[N+](=O)[O-])CC12CCCCC2 ZINC000432345676 948177242 /nfs/dbraw/zinc/17/72/42/948177242.db2.gz HYOWDRCTZIFHDS-UHFFFAOYSA-N 0 0 351.834 3.620 20 5 FHBDRN Cc1[nH]nc(C(=O)N(C)c2ccc(Oc3ccccc3)cc2)c1[N+](=O)[O-] ZINC000520508630 948191113 /nfs/dbraw/zinc/19/11/13/948191113.db2.gz KXEKQSBMNPHHTJ-UHFFFAOYSA-N 0 0 352.350 3.695 20 5 FHBDRN O=C(O[C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)c1cc2ccsc2[nH]1 ZINC000759948883 948213052 /nfs/dbraw/zinc/21/30/52/948213052.db2.gz ZRGJGSURIBKRAK-QWHCGFSZSA-N 0 0 360.395 3.675 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)N1CCC(=Cc2cccc(F)c2)CC1 ZINC000054022691 948215261 /nfs/dbraw/zinc/21/52/61/948215261.db2.gz KCFMEBKOBOMSHV-UHFFFAOYSA-N 0 0 355.369 3.757 20 5 FHBDRN COc1ccc(C)cc1NC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000182477304 948238844 /nfs/dbraw/zinc/23/88/44/948238844.db2.gz NCQTZOUVMGAGNN-UHFFFAOYSA-N 0 0 352.293 3.766 20 5 FHBDRN CCOc1ccc(NC(=O)c2cc(OC)c(OCC)cc2[N+](=O)[O-])cc1 ZINC000019179771 948240976 /nfs/dbraw/zinc/24/09/76/948240976.db2.gz ROUBMXOTGDDNIM-UHFFFAOYSA-N 0 0 360.366 3.653 20 5 FHBDRN C[S@@](=O)c1ccc(C(=O)Nc2ccc(C(C)(C)C)c([N+](=O)[O-])c2)cc1 ZINC000585750699 948256787 /nfs/dbraw/zinc/25/67/87/948256787.db2.gz ADOQJKAWMHKSMC-RUZDIDTESA-N 0 0 360.435 3.882 20 5 FHBDRN CC(C)(C)c1ccc(NC(=O)C[C@H]2C(=O)Nc3ccccc32)cc1[N+](=O)[O-] ZINC000585753321 948259796 /nfs/dbraw/zinc/25/97/96/948259796.db2.gz CVADTDAEPXQIKR-CQSZACIVSA-N 0 0 367.405 3.957 20 5 FHBDRN Cc1ccn(-c2ccc(NC(=O)[C@H](C)c3ccc([N+](=O)[O-])cc3F)cc2)n1 ZINC000585753499 948260204 /nfs/dbraw/zinc/26/02/04/948260204.db2.gz SNULABSHBGPHAM-CYBMUJFWSA-N 0 0 368.368 3.970 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N1CC(C)(C)O[C@@H]2CCC[C@H]21 ZINC000441564254 948274108 /nfs/dbraw/zinc/27/41/08/948274108.db2.gz IFMTXLMCYHKYFM-TZMCWYRMSA-N 0 0 352.818 3.729 20 5 FHBDRN COc1ccc2nc(NC(=O)c3cc4cccc([N+](=O)[O-])c4[nH]3)sc2c1 ZINC000512042517 948275767 /nfs/dbraw/zinc/27/57/67/948275767.db2.gz ULMWPZFSZLVBAL-UHFFFAOYSA-N 0 0 368.374 3.947 20 5 FHBDRN Cc1ccc(S(=O)(=O)N[C@@H](c2ccccc2)C2CCC2)cc1[N+](=O)[O-] ZINC000520558319 948279296 /nfs/dbraw/zinc/27/92/96/948279296.db2.gz WTURBEMEFZICMS-SFHVURJKSA-N 0 0 360.435 3.723 20 5 FHBDRN Cc1ccc(S(=O)(=O)N[C@H](c2ccccc2)C2CCC2)cc1[N+](=O)[O-] ZINC000520558318 948279719 /nfs/dbraw/zinc/27/97/19/948279719.db2.gz WTURBEMEFZICMS-GOSISDBHSA-N 0 0 360.435 3.723 20 5 FHBDRN O=C(O[C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)c1cc(Cl)ccc1F ZINC000759956263 948282225 /nfs/dbraw/zinc/28/22/25/948282225.db2.gz YAYSVKSMRJSOFA-UONOGXRCSA-N 0 0 367.764 3.925 20 5 FHBDRN CCN(C(=O)Cc1ccc([N+](=O)[O-])cc1Br)C1CCCC1 ZINC000087113616 948295810 /nfs/dbraw/zinc/29/58/10/948295810.db2.gz FEYIBSJTSMUQDS-UHFFFAOYSA-N 0 0 355.232 3.691 20 5 FHBDRN CCn1nccc1C1CCN(C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000278938953 948298513 /nfs/dbraw/zinc/29/85/13/948298513.db2.gz VZWYRKMRIRHICE-UHFFFAOYSA-N 0 0 357.414 3.531 20 5 FHBDRN CCc1nc(CCNC(=O)[C@H](CC)Cc2ccc([N+](=O)[O-])cc2)cs1 ZINC000184724060 948300459 /nfs/dbraw/zinc/30/04/59/948300459.db2.gz YRWWRUWADPGJFD-CQSZACIVSA-N 0 0 361.467 3.541 20 5 FHBDRN Cc1ccc([C@@H]2C[C@@H](C)N(S(=O)(=O)c3ccc(C)c([N+](=O)[O-])c3)C2)cc1 ZINC001211699413 948303327 /nfs/dbraw/zinc/30/33/27/948303327.db2.gz IPQFNSQRUVKTNI-NVXWUHKLSA-N 0 0 374.462 3.778 20 5 FHBDRN O=C(NC[C@H](O)c1ccc2ccccc2c1)Nc1cccc([N+](=O)[O-])c1 ZINC000067407840 948326342 /nfs/dbraw/zinc/32/63/42/948326342.db2.gz CRQULYQMWXTZHY-SFHVURJKSA-N 0 0 351.362 3.603 20 5 FHBDRN Cc1cncc(C)c1C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000585810423 948338617 /nfs/dbraw/zinc/33/86/17/948338617.db2.gz XASZSDSAOOWDTB-UHFFFAOYSA-N 0 0 350.172 3.621 20 5 FHBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])N1CC2(CCC2(F)F)C1 ZINC000427600885 948354252 /nfs/dbraw/zinc/35/42/52/948354252.db2.gz WBWOUNQPJUWESF-UHFFFAOYSA-N 0 0 362.785 3.598 20 5 FHBDRN COCCCCN(Cc1ccccc1)C(=O)c1ccc([N+](=O)[O-])cc1OC ZINC000427600649 948361298 /nfs/dbraw/zinc/36/12/98/948361298.db2.gz UWZKKXMHBVLSDB-UHFFFAOYSA-N 0 0 372.421 3.672 20 5 FHBDRN CO[C@H]1CN(C(=O)c2cccc3c(=O)c4ccccc4[nH]c23)CC[C@H]1C ZINC000278980487 948366455 /nfs/dbraw/zinc/36/64/55/948366455.db2.gz CTUIFRYJZIPCSF-ACJLOTCBSA-N 0 0 350.418 3.591 20 5 FHBDRN COc1cc(C(=O)N(CC(F)F)c2ccccc2)cc([N+](=O)[O-])c1C ZINC000520602770 948375842 /nfs/dbraw/zinc/37/58/42/948375842.db2.gz LQFZZYWKMCXZFP-UHFFFAOYSA-N 0 0 350.321 3.824 20 5 FHBDRN C[C@H](C(=O)NCc1ccnc(OC2CCCC2)c1)c1cccc([N+](=O)[O-])c1 ZINC000617698777 948383305 /nfs/dbraw/zinc/38/33/05/948383305.db2.gz JKYLOKOUQPQHNA-AWEZNQCLSA-N 0 0 369.421 3.731 20 5 FHBDRN CC(=O)c1ccccc1C(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000427605795 948384635 /nfs/dbraw/zinc/38/46/35/948384635.db2.gz DDCIUCVQZUCEBP-UHFFFAOYSA-N 0 0 366.295 3.746 20 5 FHBDRN COc1ccc(Cl)cc1N(C)C(=O)c1ccc([N+](=O)[O-])cc1OC ZINC000427605338 948385048 /nfs/dbraw/zinc/38/50/48/948385048.db2.gz YITSWTRVBOYUIG-UHFFFAOYSA-N 0 0 350.758 3.542 20 5 FHBDRN COc1ccc(OCCN2C[C@@H]3CCC(=O)c4cccc2c43)c([N+](=O)[O-])c1 ZINC000184772490 948395230 /nfs/dbraw/zinc/39/52/30/948395230.db2.gz XZINXKCSMSRYAS-ZDUSSCGKSA-N 0 0 368.389 3.563 20 5 FHBDRN Cc1cc(C)c(CNC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000512092584 948402114 /nfs/dbraw/zinc/40/21/14/948402114.db2.gz YPXCBMDABRGIME-UHFFFAOYSA-N 0 0 355.438 3.904 20 5 FHBDRN COc1ccc(NC(=O)N2CC[C@](C)(c3ccc(F)cc3)C2)cc1[N+](=O)[O-] ZINC000432432627 948404191 /nfs/dbraw/zinc/40/41/91/948404191.db2.gz SLASDVVBKGTBBL-IBGZPJMESA-N 0 0 373.384 3.938 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[C@@H](c2ccc(F)cc2)C1 ZINC000432431551 948406576 /nfs/dbraw/zinc/40/65/76/948406576.db2.gz WRVKLFHWLKTGTN-CYBMUJFWSA-N 0 0 359.357 3.764 20 5 FHBDRN COc1ccc(CSCC(=O)NCCC2CCCC2)cc1[N+](=O)[O-] ZINC000046198657 948408556 /nfs/dbraw/zinc/40/85/56/948408556.db2.gz IJRXMMGRJBANBG-UHFFFAOYSA-N 0 0 352.456 3.533 20 5 FHBDRN CC(C)CCSc1ccc(C(=O)N[C@@H]2CCOC[C@@H]2C)cc1[N+](=O)[O-] ZINC000432446458 948440628 /nfs/dbraw/zinc/44/06/28/948440628.db2.gz JRRQPEQOJVFHJO-DZGCQCFKSA-N 0 0 366.483 3.888 20 5 FHBDRN CCCC(=O)Nc1cccc(CNC(=O)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000087127517 948455203 /nfs/dbraw/zinc/45/52/03/948455203.db2.gz QXHSDLRDIKBELP-UHFFFAOYSA-N 0 0 369.421 3.582 20 5 FHBDRN Cc1cc(C(=O)N[C@H](C)c2cccc(OC(C)C)c2)c(N)c([N+](=O)[O-])c1 ZINC000729520199 948456227 /nfs/dbraw/zinc/45/62/27/948456227.db2.gz GZHGUVVHLDWVHY-CYBMUJFWSA-N 0 0 357.410 3.764 20 5 FHBDRN Cc1cccc(OC[C@@H](C)NC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000512123117 948486447 /nfs/dbraw/zinc/48/64/47/948486447.db2.gz PAZBYODMENBIIU-MRXNPFEDSA-N 0 0 371.437 3.555 20 5 FHBDRN Cc1ccc(NC(=O)N(C)[C@H](c2ncc[nH]2)c2ccccc2)cc1[N+](=O)[O-] ZINC000432474788 948528744 /nfs/dbraw/zinc/52/87/44/948528744.db2.gz FCYRJAIGVWKUGM-KRWDZBQOSA-N 0 0 365.393 3.880 20 5 FHBDRN CC[C@@H](C)[C@H](C)N(C(=O)COc1ccc([N+](=O)[O-])c2cccnc12)C1CC1 ZINC000432488409 948563164 /nfs/dbraw/zinc/56/31/64/948563164.db2.gz FJEKZLARVTYKQL-KGLIPLIRSA-N 0 0 371.437 3.947 20 5 FHBDRN C[C@H](CSc1ccccc1)C(=O)NCCNc1ccccc1[N+](=O)[O-] ZINC000261417484 948569325 /nfs/dbraw/zinc/56/93/25/948569325.db2.gz AGAYDFWZIYPVES-CQSZACIVSA-N 0 0 359.451 3.551 20 5 FHBDRN Cc1cnc(C2CCN(C(=O)c3c[nH]c4cccc([N+](=O)[O-])c34)CC2)s1 ZINC000432492659 948575891 /nfs/dbraw/zinc/57/58/91/948575891.db2.gz YZTDXVBUYXLRDT-UHFFFAOYSA-N 0 0 370.434 3.861 20 5 FHBDRN C[N@H+](CCCOc1ccccc1)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000728896732 948588298 /nfs/dbraw/zinc/58/82/98/948588298.db2.gz KIYLZMXEHJWBMM-UHFFFAOYSA-N 0 0 366.421 3.817 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)O[C@@H]([C@@H]1CCCOC1)C(F)(F)F ZINC000279195115 948600049 /nfs/dbraw/zinc/60/00/49/948600049.db2.gz KAGIGDYKYQFPGI-XBCPYKQNSA-N 0 0 373.327 3.899 20 5 FHBDRN COC(=O)[C@@H](NCc1ccc(C(C)C)c([N+](=O)[O-])c1)c1ccccc1F ZINC000614652565 948604001 /nfs/dbraw/zinc/60/40/01/948604001.db2.gz JXVRHLMHOYMYCB-SFHVURJKSA-N 0 0 360.385 3.861 20 5 FHBDRN Cc1cc(C(=O)N(C)Cc2cccc(C(F)(F)F)c2)c(N)c([N+](=O)[O-])c1 ZINC000729522994 948621285 /nfs/dbraw/zinc/62/12/85/948621285.db2.gz BUGZDDJHTSPTFW-UHFFFAOYSA-N 0 0 367.327 3.776 20 5 FHBDRN Cc1cc(C(=O)Nc2ccc(NC[C@@H]3CCCO3)c(F)c2)ccc1[N+](=O)[O-] ZINC000129583692 948622506 /nfs/dbraw/zinc/62/25/06/948622506.db2.gz MXVDZVKPCQELNA-HNNXBMFYSA-N 0 0 373.384 3.886 20 5 FHBDRN Cc1c(NC(=O)[C@@H]2CCC(=O)C[C@H]2C)cc(Br)cc1[N+](=O)[O-] ZINC000280840652 948648997 /nfs/dbraw/zinc/64/89/97/948648997.db2.gz YSOCLWXSDJPTQG-PRHODGIISA-N 0 0 369.215 3.610 20 5 FHBDRN O=C(NCCC1CC(F)(F)C1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000459136957 948656925 /nfs/dbraw/zinc/65/69/25/948656925.db2.gz MFLSZQVNKQTTFZ-UHFFFAOYSA-N 0 0 353.369 3.704 20 5 FHBDRN O=C(NCCC1CC(F)(F)C1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000459141125 948662572 /nfs/dbraw/zinc/66/25/72/948662572.db2.gz QEOZMQGZKOORQR-UHFFFAOYSA-N 0 0 353.369 3.704 20 5 FHBDRN C[C@]1(NC(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)CCCc2ccccc21 ZINC000571715780 948670617 /nfs/dbraw/zinc/67/06/17/948670617.db2.gz NHUADYLLBJTHKK-IBGZPJMESA-N 0 0 360.360 3.783 20 5 FHBDRN Cc1c(F)ccc([N+](=O)[O-])c1C(=O)N[C@@H]1CCCOc2ccc(F)cc21 ZINC000843776140 948673637 /nfs/dbraw/zinc/67/36/37/948673637.db2.gz XFJKNDTWMKLBJP-CQSZACIVSA-N 0 0 362.332 3.825 20 5 FHBDRN CC[C@@H](C)c1ccc(C(=O)COC(=O)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000005709735 948699188 /nfs/dbraw/zinc/69/91/88/948699188.db2.gz PNSXOSKQKMWMGK-GFCCVEGCSA-N 0 0 356.378 3.730 20 5 FHBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])N1CCc2ccccc2CC1 ZINC000523954026 948732021 /nfs/dbraw/zinc/73/20/21/948732021.db2.gz KLXMZTJZHAWXTB-UHFFFAOYSA-N 0 0 374.824 3.645 20 5 FHBDRN COc1ccc(C[C@H](C)C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1 ZINC000129786293 948737789 /nfs/dbraw/zinc/73/77/89/948737789.db2.gz XUHHJYISSZXXQZ-HNNXBMFYSA-N 0 0 368.433 3.973 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[C@H](C)[C@@H]1c1cccc(F)c1 ZINC000427632817 948746954 /nfs/dbraw/zinc/74/69/54/948746954.db2.gz GEKXHARAHGXCPN-KPZWWZAWSA-N 0 0 358.369 3.966 20 5 FHBDRN CC(C)[C@H](C)N(C(=O)Cc1ccc([N+](=O)[O-])cc1Br)C1CC1 ZINC000087142429 948756953 /nfs/dbraw/zinc/75/69/53/948756953.db2.gz HQVNUMQGZHQQQI-NSHDSACASA-N 0 0 369.259 3.935 20 5 FHBDRN C[C@@H](C(=O)N[C@H](C(C)(C)C)C(F)(F)F)c1ccc([N+](=O)[O-])cc1F ZINC000544400631 948764639 /nfs/dbraw/zinc/76/46/39/948764639.db2.gz YFWMXSUYYFZFMO-AMIZOPFISA-N 0 0 350.312 3.931 20 5 FHBDRN O=C(O[C@@H]([C@@H]1CCCOC1)C(F)(F)F)c1ccc([N+](=O)[O-])cc1Cl ZINC000279302575 948773559 /nfs/dbraw/zinc/77/35/59/948773559.db2.gz XZBLNJNCYBWUOJ-PELKAZGASA-N 0 0 367.707 3.763 20 5 FHBDRN O=C(O[C@H]([C@H]1CCCOC1)C(F)(F)F)c1ccc([N+](=O)[O-])cc1Cl ZINC000279303678 948780431 /nfs/dbraw/zinc/78/04/31/948780431.db2.gz XZBLNJNCYBWUOJ-QPUJVOFHSA-N 0 0 367.707 3.763 20 5 FHBDRN CC(C)(C)n1cc(NC(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cn1 ZINC000454870931 948809787 /nfs/dbraw/zinc/80/97/87/948809787.db2.gz JZMJSCCEOBKCLT-OAHLLOKOSA-N 0 0 371.441 3.958 20 5 FHBDRN CN(Cc1nc(-c2ccc(O)cc2Cl)no1)c1ccccc1[N+](=O)[O-] ZINC000445450380 948811245 /nfs/dbraw/zinc/81/12/45/948811245.db2.gz YGGFFUIAOAYAEC-UHFFFAOYSA-N 0 0 360.757 3.640 20 5 FHBDRN COCCOc1ccc(C(=O)Nc2cccc([N+](=O)[O-])c2C)c(Cl)c1 ZINC000184820773 948821758 /nfs/dbraw/zinc/82/17/58/948821758.db2.gz XZZVWXWBJUDNFR-UHFFFAOYSA-N 0 0 364.785 3.834 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)c1cccnc1SC(F)(F)F ZINC000109032802 209297088 /nfs/dbraw/zinc/29/70/88/209297088.db2.gz DEMAXHBVTXVUFS-UHFFFAOYSA-N 0 0 357.313 3.532 20 5 FHBDRN Cc1c(C(=O)Nc2ccc3[nH]c([C@H]4CCCO4)nc3c2)cccc1[N+](=O)[O-] ZINC000109021486 209295984 /nfs/dbraw/zinc/29/59/84/209295984.db2.gz MVMYKCXUEJGDSK-QGZVFWFLSA-N 0 0 366.377 3.883 20 5 FHBDRN Cc1c(C(=O)Nc2ccc3[nH]c([C@@H]4CCCO4)nc3c2)cccc1[N+](=O)[O-] ZINC000109021482 209295343 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Cc1c(C(=O)N[C@@H](C)c2nc(-c3ccc(F)cc3)no2)cccc1[N+](=O)[O-] ZINC000109554096 206764769 /nfs/dbraw/zinc/76/47/69/206764769.db2.gz IAMSTMGVGHPEPZ-NSHDSACASA-N 0 0 370.340 3.583 20 5 FHBDRN CCN(Cc1nc2ccccc2c(=O)[nH]1)c1ccc([N+](=O)[O-])cc1Cl ZINC000030576917 206753943 /nfs/dbraw/zinc/75/39/43/206753943.db2.gz GHFZOHCZGDTGLR-UHFFFAOYSA-N 0 0 358.785 3.511 20 5 FHBDRN Cc1cc(OCC(=O)Nc2cccc(Br)c2)ccc1[N+](=O)[O-] ZINC000001284545 206872293 /nfs/dbraw/zinc/87/22/93/206872293.db2.gz GHWPPGFXQKQEGU-UHFFFAOYSA-N 0 0 365.183 3.683 20 5 FHBDRN Cc1ccc(NC(=O)COc2ccccc2[N+](=O)[O-])cc1Br ZINC000005109450 207081735 /nfs/dbraw/zinc/08/17/35/207081735.db2.gz CAOBWNGXHJOLAN-UHFFFAOYSA-N 0 0 365.183 3.683 20 5 FHBDRN CCOC(=O)c1cc(C(=O)N2CCC[C@@H]2c2ccccc2)cc([N+](=O)[O-])c1 ZINC000009956895 207290440 /nfs/dbraw/zinc/29/04/40/207290440.db2.gz CKNCZHSTNLNPDP-GOSISDBHSA-N 0 0 368.389 3.749 20 5 FHBDRN COc1ccc(C)cc1NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000015082342 207545471 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COc1ccc([N+](=O)[O-])cc1CN1CCC[C@@]2(C1)OCc1ccccc12 ZINC000481715162 568094012 /nfs/dbraw/zinc/09/40/12/568094012.db2.gz XITUVHLDDSZNJR-FQEVSTJZSA-N 0 0 354.406 3.625 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1OC[C@H](O)Cc1ccc2ccccc2c1 ZINC000481719689 568094221 /nfs/dbraw/zinc/09/42/21/568094221.db2.gz UCNPYQSMSXUGRS-GOSISDBHSA-N 0 0 353.374 3.739 20 5 FHBDRN CCCCOc1ccc(NC(=O)N(C)CCc2ccccc2[N+](=O)[O-])cn1 ZINC000481726322 568098309 /nfs/dbraw/zinc/09/83/09/568098309.db2.gz QIXASGYICDBPIQ-UHFFFAOYSA-N 0 0 372.425 3.875 20 5 FHBDRN O=C(CN1Cc2ccccc2C2(CC2)C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000481741343 568099862 /nfs/dbraw/zinc/09/98/62/568099862.db2.gz JUMHGHSOVHGHOI-UHFFFAOYSA-N 0 0 371.824 3.734 20 5 FHBDRN O=C(C1CCN(c2ccccc2[N+](=O)[O-])CC1)N1CCC2(C1)CCCCC2 ZINC000408231767 568101636 /nfs/dbraw/zinc/10/16/36/568101636.db2.gz PLYGOWAZTYLEED-UHFFFAOYSA-N 0 0 371.481 3.994 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)c1ccc2ccccc2c1O ZINC000436629884 568107821 /nfs/dbraw/zinc/10/78/21/568107821.db2.gz LPEWWXIBGVFGAZ-UHFFFAOYSA-N 0 0 350.374 3.768 20 5 FHBDRN C[C@H](c1cn(C)c2ccccc12)c1nc(Cc2ccc([N+](=O)[O-])cn2)no1 ZINC000568679713 568120276 /nfs/dbraw/zinc/12/02/76/568120276.db2.gz NWEMTDXYYTXYOW-GFCCVEGCSA-N 0 0 363.377 3.607 20 5 FHBDRN CC[C@@H](Oc1ccccc1F)C(=O)N1c2ccc([N+](=O)[O-])cc2C[C@H]1C ZINC000481773984 568123365 /nfs/dbraw/zinc/12/33/65/568123365.db2.gz CMYQYDKFOMNXFE-SJKOYZFVSA-N 0 0 358.369 3.869 20 5 FHBDRN C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1c(F)c(F)cc(F)c1F ZINC000481786664 568124022 /nfs/dbraw/zinc/12/40/22/568124022.db2.gz YUJZPYMEKQTYKL-ZETCQYMHSA-N 0 0 354.259 3.743 20 5 FHBDRN CO[C@@](C)(C(=O)Nc1nc(-c2ccc(C)c([N+](=O)[O-])c2)cs1)C1CC1 ZINC000463247709 568124326 /nfs/dbraw/zinc/12/43/26/568124326.db2.gz XUCSGXNIZISQFP-QGZVFWFLSA-N 0 0 361.423 3.780 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1)N1CCc2c(Br)cccc2C1 ZINC000128688389 568139850 /nfs/dbraw/zinc/13/98/50/568139850.db2.gz OTFZTOSOPWQALY-UHFFFAOYSA-N 0 0 361.195 3.556 20 5 FHBDRN O=C(NC[C@H]1CCC2(CCCCC2)O1)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000481866335 568144733 /nfs/dbraw/zinc/14/47/33/568144733.db2.gz XFCZJAOVFXSDEH-CQSZACIVSA-N 0 0 357.410 3.688 20 5 FHBDRN Cc1noc(C)c1[C@H](C)CNC(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000159347750 568158052 /nfs/dbraw/zinc/15/80/52/568158052.db2.gz SQQOUWLRXQYWDS-VXGBXAGGSA-N 0 0 360.414 3.672 20 5 FHBDRN COc1ccc(N(C)C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)cc1F ZINC000159349891 568159367 /nfs/dbraw/zinc/15/93/67/568159367.db2.gz NBCXYGBNXDKXPP-UHFFFAOYSA-N 0 0 373.384 3.619 20 5 FHBDRN CN(Cc1ccc(Cl)s1)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000051679470 568163674 /nfs/dbraw/zinc/16/36/74/568163674.db2.gz CABJAVICLXDOOC-UHFFFAOYSA-N 0 0 364.814 3.992 20 5 FHBDRN COC(=O)c1ccc(OCc2csc([N+](=O)[O-])c2)c(Br)c1 ZINC000603938031 568184391 /nfs/dbraw/zinc/18/43/91/568184391.db2.gz HVQUZODUDYRKJP-UHFFFAOYSA-N 0 0 372.196 3.784 20 5 FHBDRN COC(=O)c1cc(OCc2nc(-c3ccccc3)oc2C)ccc1[N+](=O)[O-] ZINC000481945787 568195196 /nfs/dbraw/zinc/19/51/96/568195196.db2.gz USIZTGQQGFNRRQ-UHFFFAOYSA-N 0 0 368.345 3.924 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)c1csc(-c2ccc(F)cc2)n1 ZINC000603999268 568197438 /nfs/dbraw/zinc/19/74/38/568197438.db2.gz BCUFICSWVBJXTG-UHFFFAOYSA-N 0 0 357.366 3.787 20 5 FHBDRN COC(=O)c1cc(OCc2csc(-c3ccc(C)o3)n2)ccc1[N+](=O)[O-] ZINC000481966523 568200456 /nfs/dbraw/zinc/20/04/56/568200456.db2.gz UWAYYZPNSVTISB-UHFFFAOYSA-N 0 0 374.374 3.985 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])N1CCc2ccc(Cl)cc2C1 ZINC000128713080 568203386 /nfs/dbraw/zinc/20/33/86/568203386.db2.gz YSFBEEHGCOPJFW-UHFFFAOYSA-N 0 0 360.797 3.602 20 5 FHBDRN O=C(Nc1ccncc1[N+](=O)[O-])N[C@H](Cc1ccccc1)c1ccccc1 ZINC000541906796 568211748 /nfs/dbraw/zinc/21/17/48/568211748.db2.gz WPFWXCXIQDJZDZ-GOSISDBHSA-N 0 0 362.389 3.517 20 5 FHBDRN CCCc1[nH]nc(C(=O)Nc2nc(-c3ccccc3)c(C)s2)c1[N+](=O)[O-] ZINC000609473305 568220734 /nfs/dbraw/zinc/22/07/34/568220734.db2.gz VEVMKMOZMJVIOY-UHFFFAOYSA-N 0 0 371.422 3.955 20 5 FHBDRN C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1c[nH]c2ccc([N+](=O)[O-])cc21 ZINC000482005297 568226279 /nfs/dbraw/zinc/22/62/79/568226279.db2.gz KIZVOKOGOSDZPZ-RNCFNFMXSA-N 0 0 355.316 3.879 20 5 FHBDRN CN(Cc1ccc2ccccc2c1)c1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000007270700 568230701 /nfs/dbraw/zinc/23/07/01/568230701.db2.gz GTGSNVWSWMDNDP-UHFFFAOYSA-N 0 0 370.430 3.788 20 5 FHBDRN O=C(N[C@H]1CCO[C@H](C2CC2)C1)c1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000291631039 568232504 /nfs/dbraw/zinc/23/25/04/568232504.db2.gz FOSULOLKQUKVRX-GWCFXTLKSA-N 0 0 359.209 3.589 20 5 FHBDRN CCn1c(SC[C@@H]2CCC[C@@H](O)C2)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000291639659 568236450 /nfs/dbraw/zinc/23/64/50/568236450.db2.gz MJTKREIGKXARER-IUODEOHRSA-N 0 0 362.455 3.516 20 5 FHBDRN COc1cc(Cc2noc([C@H]3CCc4ccccc4O3)n2)ccc1[N+](=O)[O-] ZINC000568858763 568237288 /nfs/dbraw/zinc/23/72/88/568237288.db2.gz RFXFMHVZGFGRTD-MRXNPFEDSA-N 0 0 367.361 3.644 20 5 FHBDRN C[C@H]1[C@H](Cc2ccccc2)CCN1c1cc2nc[nH]c(=O)c2cc1[N+](=O)[O-] ZINC000568864395 568238649 /nfs/dbraw/zinc/23/86/49/568238649.db2.gz JIOBEAQGDCFCKI-ZFWWWQNUSA-N 0 0 364.405 3.701 20 5 FHBDRN COc1ccc(CNC(=O)[C@@H](C)c2cc3ccccc3o2)cc1[N+](=O)[O-] ZINC000482048814 568238701 /nfs/dbraw/zinc/23/87/01/568238701.db2.gz ZAFGGHBCJXSADI-LBPRGKRZSA-N 0 0 354.362 3.770 20 5 FHBDRN CCS[C@@H]1CCC[C@@H]1NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000541926090 568245709 /nfs/dbraw/zinc/24/57/09/568245709.db2.gz UYWMDBAGHRTNSX-GXFFZTMASA-N 0 0 360.382 3.600 20 5 FHBDRN Cc1noc([C@H](C)NCc2ccc(N(C)c3ccccc3)c([N+](=O)[O-])c2)n1 ZINC000568895617 568246278 /nfs/dbraw/zinc/24/62/78/568246278.db2.gz KGRZNNXOOOYTLB-ZDUSSCGKSA-N 0 0 367.409 3.905 20 5 FHBDRN CCOc1ccc(CNC(=O)C(C)(C)c2ccccc2[N+](=O)[O-])cc1F ZINC000568890306 568248301 /nfs/dbraw/zinc/24/83/01/568248301.db2.gz DBGKEBLUEXJCMD-UHFFFAOYSA-N 0 0 360.385 3.727 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(NCc2nc(-c3cccc(Cl)c3)no2)n1 ZINC000541933292 568250628 /nfs/dbraw/zinc/25/06/28/568250628.db2.gz KRJZLFRKWLNGNG-UHFFFAOYSA-N 0 0 359.773 3.922 20 5 FHBDRN Cc1cc(C2CC2)nc(NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])n1 ZINC000291659835 568251551 /nfs/dbraw/zinc/25/15/51/568251551.db2.gz QEMCIKDDMPSXJR-UHFFFAOYSA-N 0 0 366.299 3.842 20 5 FHBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)c1ccnn1C1CCCC1 ZINC000482078660 568254875 /nfs/dbraw/zinc/25/48/75/568254875.db2.gz GPLLDQQEEUWVOH-UHFFFAOYSA-N 0 0 356.426 3.659 20 5 FHBDRN CCOc1ccccc1N(C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000159407421 568256651 /nfs/dbraw/zinc/25/66/51/568256651.db2.gz VJSVURGLTNTAIL-UHFFFAOYSA-N 0 0 354.366 3.680 20 5 FHBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1C[C@H](C)O[C@@H]1C ZINC000412665663 568258633 /nfs/dbraw/zinc/25/86/33/568258633.db2.gz XWZMFIJYJCKFKC-MJBXVCDLSA-N 0 0 366.483 3.886 20 5 FHBDRN O=C(NCc1cccc([N+](=O)[O-])c1)N[C@H]1C[C@H](c2cc(F)cc(F)c2)C1 ZINC000568984043 568262274 /nfs/dbraw/zinc/26/22/74/568262274.db2.gz ZNJQURAFGDTOFW-SAZUREKKSA-N 0 0 361.348 3.618 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)N[C@H]1CCCOc2ccccc21 ZINC000568995915 568265489 /nfs/dbraw/zinc/26/54/89/568265489.db2.gz FSQJGJJDPXCVEP-KRWDZBQOSA-N 0 0 369.421 3.693 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N[C@@H]1c2ccc(F)cc2O[C@@H]1C ZINC000482131599 568269953 /nfs/dbraw/zinc/26/99/53/568269953.db2.gz PAWLVPFXZDNKCD-DIFFPNOSSA-N 0 0 359.357 3.994 20 5 FHBDRN Cc1ccc(S(=O)(=O)N(CC(F)(F)F)[C@@H](C)C(C)C)c([N+](=O)[O-])c1 ZINC000569103671 568275952 /nfs/dbraw/zinc/27/59/52/568275952.db2.gz PXOMYJBLOBBBIQ-NSHDSACASA-N 0 0 368.377 3.501 20 5 FHBDRN O=C(NCCCc1cccs1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000541959877 568284255 /nfs/dbraw/zinc/28/42/55/568284255.db2.gz HAMOQZWEIYBLQK-UHFFFAOYSA-N 0 0 356.350 3.620 20 5 FHBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)NCC(F)(F)C(F)F ZINC000482151512 568285743 /nfs/dbraw/zinc/28/57/43/568285743.db2.gz TWWDLXOZMBUJKB-UHFFFAOYSA-N 0 0 368.352 3.973 20 5 FHBDRN CC1(C)CN(C(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])[C@H]1[C@@H]1CCCO1 ZINC000291736505 568286595 /nfs/dbraw/zinc/28/65/95/568286595.db2.gz XGTMMHOYQHCTPS-KBPBESRZSA-N 0 0 372.343 3.643 20 5 FHBDRN O=[N+]([O-])c1ncccc1NCc1ccc(-n2ccc(C(F)(F)F)n2)cc1 ZINC000604447867 568290739 /nfs/dbraw/zinc/29/07/39/568290739.db2.gz MDCQYZAWEVDTAZ-UHFFFAOYSA-N 0 0 363.299 3.806 20 5 FHBDRN CCOC(=O)c1cc(C(=O)Nc2cccc(Cl)c2C)cc([N+](=O)[O-])c1 ZINC000008289395 568291871 /nfs/dbraw/zinc/29/18/71/568291871.db2.gz PVFYGXLNTACPEB-UHFFFAOYSA-N 0 0 362.769 3.986 20 5 FHBDRN CCN(CC)S(=O)(=O)c1ccc(Oc2ccccc2C)c([N+](=O)[O-])c1 ZINC000008080480 568292078 /nfs/dbraw/zinc/29/20/78/568292078.db2.gz MVQPNHVFLFJJOE-UHFFFAOYSA-N 0 0 364.423 3.726 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)NCc1ccn(C2CCCC2)n1 ZINC000569056074 568292831 /nfs/dbraw/zinc/29/28/31/568292831.db2.gz SNLGFIOPCURUCO-UHFFFAOYSA-N 0 0 357.414 3.791 20 5 FHBDRN Cc1ccc([C@H]2CCCN2C(=O)COc2cccc([N+](=O)[O-])c2)cc1C ZINC000604439335 568294043 /nfs/dbraw/zinc/29/40/43/568294043.db2.gz WYUUYJKLUMDVTG-LJQANCHMSA-N 0 0 354.406 3.954 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])o1)N1CCC[C@@H](c2nc3ccccc3s2)C1 ZINC000008104239 568294368 /nfs/dbraw/zinc/29/43/68/568294368.db2.gz NOSYDEGXJCVTMF-LLVKDONJSA-N 0 0 357.391 3.817 20 5 FHBDRN COC(=O)c1cc(C)nc(N2CC[C@@H]2c2ccc(Cl)cc2)c1[N+](=O)[O-] ZINC000569152965 568295407 /nfs/dbraw/zinc/29/54/07/568295407.db2.gz ZAYKHMDJYWTBJD-CQSZACIVSA-N 0 0 361.785 3.690 20 5 FHBDRN C[C@H](C(=O)Nc1ncc2c(n1)CCC(C)(C)C2)c1cccc([N+](=O)[O-])c1 ZINC000569060621 568295613 /nfs/dbraw/zinc/29/56/13/568295613.db2.gz ZHKPTIOEHQRZTP-LBPRGKRZSA-N 0 0 354.410 3.642 20 5 FHBDRN COc1cc(C)c(NC(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)c(C)c1C ZINC000569169699 568299407 /nfs/dbraw/zinc/29/94/07/568299407.db2.gz ZMYOHAWVJRGEGB-UHFFFAOYSA-N 0 0 364.348 3.988 20 5 FHBDRN COc1ccc(OCCOc2cccc3c2CCCC3=O)c([N+](=O)[O-])c1 ZINC000541992060 568301609 /nfs/dbraw/zinc/30/16/09/568301609.db2.gz JQCPKYRQAAPIPD-UHFFFAOYSA-N 0 0 357.362 3.580 20 5 FHBDRN Cc1ccc(Sc2ccc(C(=O)NC(C)(C)[C@@H](C)O)cc2[N+](=O)[O-])cc1 ZINC000541993588 568301635 /nfs/dbraw/zinc/30/16/35/568301635.db2.gz LWJUCGXFYVXBFO-CYBMUJFWSA-N 0 0 374.462 3.944 20 5 FHBDRN O=C(NCc1ccc(C(F)(F)F)cc1)NCc1cccc([N+](=O)[O-])c1 ZINC000063069842 568305925 /nfs/dbraw/zinc/30/59/25/568305925.db2.gz FMKLRVYGDKZCNF-UHFFFAOYSA-N 0 0 353.300 3.613 20 5 FHBDRN COc1cccc2c1OCC[C@H]2NC(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000604571163 568314910 /nfs/dbraw/zinc/31/49/10/568314910.db2.gz ZOXVYHFGIFOQJN-CQSZACIVSA-N 0 0 368.345 3.603 20 5 FHBDRN COC(=O)c1cnc(N(C)Cc2ccc3ccccc3c2)c([N+](=O)[O-])c1 ZINC000569295123 568343740 /nfs/dbraw/zinc/34/37/40/568343740.db2.gz ZMMJXFRKJAHWBW-UHFFFAOYSA-N 0 0 351.362 3.566 20 5 FHBDRN Cc1cccnc1C(C)(C)CNC(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000569295940 568343926 /nfs/dbraw/zinc/34/39/26/568343926.db2.gz DYIYDPQCTJPBKP-UHFFFAOYSA-N 0 0 364.405 3.554 20 5 FHBDRN O=C(Nc1cccc(Cl)c1F)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000032046482 568345424 /nfs/dbraw/zinc/34/54/24/568345424.db2.gz GDRGXQCKBNPGFM-UHFFFAOYSA-N 0 0 360.732 3.825 20 5 FHBDRN CCNC(=O)Nc1c(C)cccc1NC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000584704566 568350849 /nfs/dbraw/zinc/35/08/49/568350849.db2.gz ICLAJAGIVCBBRF-ZDUSSCGKSA-N 0 0 370.409 3.787 20 5 FHBDRN COc1ccc(NC(=O)Cc2csc(-c3ccoc3)n2)cc1[N+](=O)[O-] ZINC000542001735 568378066 /nfs/dbraw/zinc/37/80/66/568378066.db2.gz REJCUNSUOZTOJK-UHFFFAOYSA-N 0 0 359.363 3.501 20 5 FHBDRN COc1ccc([C@H]2CCCN2C(=O)c2ccccc2[N+](=O)[O-])c(OC)c1 ZINC000072960949 568381285 /nfs/dbraw/zinc/38/12/85/568381285.db2.gz ROSQOCFWLWOLHY-MRXNPFEDSA-N 0 0 356.378 3.589 20 5 FHBDRN Cc1cc(NC(=O)c2cc(-c3cnn(C)c3)ccc2F)ccc1[N+](=O)[O-] ZINC000541998310 568383151 /nfs/dbraw/zinc/38/31/51/568383151.db2.gz NFXFGQJNVSSLPD-UHFFFAOYSA-N 0 0 354.341 3.695 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)N1CCN(c2ccc(Cl)cc2)CC1 ZINC000005331380 568386398 /nfs/dbraw/zinc/38/63/98/568386398.db2.gz JLNNSJOLIMOQFA-UHFFFAOYSA-N 0 0 360.801 3.602 20 5 FHBDRN Cc1csc(Sc2ccc(C(=O)NC[C@H]3C[C@@H]3C)cc2[N+](=O)[O-])n1 ZINC000032382053 568388369 /nfs/dbraw/zinc/38/83/69/568388369.db2.gz GAUJVUBUWADVSE-JOYOIKCWSA-N 0 0 363.464 3.897 20 5 FHBDRN COc1ccc(NC(=O)c2ccc(C(F)(F)F)nc2C)cc1[N+](=O)[O-] ZINC000542000395 568389236 /nfs/dbraw/zinc/38/92/36/568389236.db2.gz HCPLGURQUFZYPU-UHFFFAOYSA-N 0 0 355.272 3.578 20 5 FHBDRN COc1ccc(NC(=O)c2oc(-c3ccccc3)nc2C)cc1[N+](=O)[O-] ZINC000541996707 568389821 /nfs/dbraw/zinc/38/98/21/568389821.db2.gz NOTGDTZFFXGKOB-UHFFFAOYSA-N 0 0 353.334 3.819 20 5 FHBDRN C[C@H]1CCN(S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])c2ccccc21 ZINC000032444335 568390575 /nfs/dbraw/zinc/39/05/75/568390575.db2.gz IYHWFVHSFGKYIK-NSHDSACASA-N 0 0 366.826 3.951 20 5 FHBDRN COc1ccc(NC(=O)c2cc(C(C)C)nc3onc(C)c32)cc1[N+](=O)[O-] ZINC000542001921 568394109 /nfs/dbraw/zinc/39/41/09/568394109.db2.gz VSLGQMNFYRRACQ-UHFFFAOYSA-N 0 0 370.365 3.824 20 5 FHBDRN O=[N+]([O-])c1ccccc1OCc1cc2c(cc1Br)OCCO2 ZINC000005869589 568394516 /nfs/dbraw/zinc/39/45/16/568394516.db2.gz NHGVUDKGYJJBNQ-UHFFFAOYSA-N 0 0 366.167 3.708 20 5 FHBDRN COc1ccc(OC)c(-c2noc(-c3cc(OC)c(C)c([N+](=O)[O-])c3)n2)c1 ZINC000569407873 568401093 /nfs/dbraw/zinc/40/10/93/568401093.db2.gz RZGNVCXYKOXCOU-UHFFFAOYSA-N 0 0 371.349 3.646 20 5 FHBDRN CN(c1ccc([N+](=O)[O-])c(N2CCOCC2)c1F)[C@H]1CCc2ccccc21 ZINC000569408354 568401152 /nfs/dbraw/zinc/40/11/52/568401152.db2.gz JAOXMFKIHFUJNG-INIZCTEOSA-N 0 0 371.412 3.694 20 5 FHBDRN C[C@@H](CN(C(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1)[C@@H](C)CO)c1ccccc1 ZINC000569423640 568401778 /nfs/dbraw/zinc/40/17/78/568401778.db2.gz KAXORHGCIUMXAW-ULQDDVLXSA-N 0 0 370.449 3.711 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)F)cc1N1CC(COc2ccccc2)C1 ZINC000569497015 568403721 /nfs/dbraw/zinc/40/37/21/568403721.db2.gz VUGLBMQELDFAQG-UHFFFAOYSA-N 0 0 353.300 3.524 20 5 FHBDRN O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)NCC1(Cc2ccccc2)CC1 ZINC000569617815 568410253 /nfs/dbraw/zinc/41/02/53/568410253.db2.gz RDWCZPUZGABYAE-UHFFFAOYSA-N 0 0 360.360 3.555 20 5 FHBDRN CC[NH+](CC)[C@@H](CNc1ccc(CC(=O)[O-])cc1[N+](=O)[O-])c1ccccc1 ZINC000569697492 568412847 /nfs/dbraw/zinc/41/28/47/568412847.db2.gz PPWCJPQYPWQLFL-IBGZPJMESA-N 0 0 371.437 3.717 20 5 FHBDRN O=C(NCCc1ccc(F)cc1F)c1c([N+](=O)[O-])cccc1C(F)(F)F ZINC000569768621 568422892 /nfs/dbraw/zinc/42/28/92/568422892.db2.gz LWLZLLFVLWUIJC-UHFFFAOYSA-N 0 0 374.265 3.864 20 5 FHBDRN O=C(c1cc2cc(Cl)sc2[nH]1)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000569776598 568423817 /nfs/dbraw/zinc/42/38/17/568423817.db2.gz RWIFPNVVZVUWNV-UHFFFAOYSA-N 0 0 361.810 3.990 20 5 FHBDRN CCOc1ccc(C(=O)N[C@@H](C)c2ccc(OC)c(F)c2)cc1[N+](=O)[O-] ZINC000007077325 568442265 /nfs/dbraw/zinc/44/22/65/568442265.db2.gz DUKPNOHGHLIGMJ-NSHDSACASA-N 0 0 362.357 3.632 20 5 FHBDRN CC1(C)CN(c2ccc(Br)cc2[N+](=O)[O-])[C@@H]1[C@@H]1CCCO1 ZINC000569978552 568445502 /nfs/dbraw/zinc/44/55/02/568445502.db2.gz CKDXHGFPVAMBOU-UONOGXRCSA-N 0 0 355.232 3.751 20 5 FHBDRN C[C@@H](c1ccco1)N(C)c1nnc(-c2ccc([N+](=O)[O-])cc2)n1C1CC1 ZINC000569983292 568445692 /nfs/dbraw/zinc/44/56/92/568445692.db2.gz QDKDCTLSZAIFIY-LBPRGKRZSA-N 0 0 353.382 3.979 20 5 FHBDRN C[C@H](c1ccccc1)N(C)C(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000032993088 568447691 /nfs/dbraw/zinc/44/76/91/568447691.db2.gz ZDJBPTFMGFISQQ-CQSZACIVSA-N 0 0 350.378 3.614 20 5 FHBDRN Cn1c(CNc2ccc(Br)cc2[N+](=O)[O-])nc2ccccc21 ZINC000007129268 568453492 /nfs/dbraw/zinc/45/34/92/568453492.db2.gz VXYXWZJPBUZBAW-UHFFFAOYSA-N 0 0 361.199 3.856 20 5 FHBDRN Cc1cccnc1OC1CCN(c2nccc3ccc([N+](=O)[O-])cc32)CC1 ZINC000570143588 568454410 /nfs/dbraw/zinc/45/44/10/568454410.db2.gz PMZVKRGXWIQLLO-UHFFFAOYSA-N 0 0 364.405 3.894 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(-c2nc(-c3ccccc3OCC(C)C)no2)n1 ZINC000570152163 568455209 /nfs/dbraw/zinc/45/52/09/568455209.db2.gz MZFXDVMMIWCGBO-UHFFFAOYSA-N 0 0 357.370 3.563 20 5 FHBDRN CC(C)Nc1ccc([N+](=O)[O-])cc1NC(=O)[C@H]1CCc2cccc(O)c21 ZINC000570170489 568455480 /nfs/dbraw/zinc/45/54/80/568455480.db2.gz UJLSIELQRCPHGT-AWEZNQCLSA-N 0 0 355.394 3.789 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@H](c3ccccc3C)C2)c1 ZINC000570178462 568459422 /nfs/dbraw/zinc/45/94/22/568459422.db2.gz GMPWTCNKYDQHLM-HNNXBMFYSA-N 0 0 354.406 3.932 20 5 FHBDRN CC[C@H](CSc1ccc(C)c(C)c1)Nc1nccc(C(N)=O)c1[N+](=O)[O-] ZINC000570213883 568461829 /nfs/dbraw/zinc/46/18/29/568461829.db2.gz UGOYQYZYGYCWFD-CYBMUJFWSA-N 0 0 374.466 3.688 20 5 FHBDRN Cc1ccc2c(c1)CC[C@H](c1nc(Cc3ccccc3[N+](=O)[O-])no1)O2 ZINC000570317282 568467793 /nfs/dbraw/zinc/46/77/93/568467793.db2.gz WQRCXUVRQLHGCS-QGZVFWFLSA-N 0 0 351.362 3.943 20 5 FHBDRN CCS[C@H]1CCC[C@@H](NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)C1 ZINC000482232273 568471673 /nfs/dbraw/zinc/47/16/73/568471673.db2.gz RAMHBELZZRNTQE-CABCVRRESA-N 0 0 363.483 3.963 20 5 FHBDRN C[C@H](C(=O)N1CC[C@](F)(c2ccccc2F)C1)c1cccc([N+](=O)[O-])c1 ZINC000570297023 568473534 /nfs/dbraw/zinc/47/35/34/568473534.db2.gz QBRGSCHOVXBXJW-ORAYPTAESA-N 0 0 360.360 3.935 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)c1nc(-c2ccc3n[nH]nc3c2)no1 ZINC000570454148 568478165 /nfs/dbraw/zinc/47/81/65/568478165.db2.gz UKULERMXRBHBRO-LBPRGKRZSA-N 0 0 364.365 3.652 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)NC[C@@H]([NH3+])c1ccc(C(C)C)cc1 ZINC000570515907 568483919 /nfs/dbraw/zinc/48/39/19/568483919.db2.gz YBKKZGQHTIJESL-MRXNPFEDSA-N 0 0 371.437 3.547 20 5 FHBDRN O=C(NCc1ccc(Br)s1)Nc1cccc([N+](=O)[O-])c1 ZINC000024744686 568484937 /nfs/dbraw/zinc/48/49/37/568484937.db2.gz LLFFCNKLFUABQZ-UHFFFAOYSA-N 0 0 356.201 3.741 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)N[C@H]1CC[C@H](Nc2ccccn2)CC1 ZINC000570577998 568487702 /nfs/dbraw/zinc/48/77/02/568487702.db2.gz GGRFRCBPGSCVGR-HDJSIYSDSA-N 0 0 355.398 3.535 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CC[C@H](n3cc(Cl)cn3)C2)cc1C(F)(F)F ZINC000570505195 568489480 /nfs/dbraw/zinc/48/94/80/568489480.db2.gz INUCRMSRWSRQHA-NSHDSACASA-N 0 0 360.723 3.915 20 5 FHBDRN Cn1cc(-c2ccc(F)c(C(=O)Nc3ccc([N+](=O)[O-])cc3F)c2)cn1 ZINC000542007289 568506172 /nfs/dbraw/zinc/50/61/72/568506172.db2.gz HHDUQLKOIZEFOB-UHFFFAOYSA-N 0 0 358.304 3.526 20 5 FHBDRN Cc1ccc(-c2noc([C@H]3CCN(c4ccccc4)C3)n2)cc1[N+](=O)[O-] ZINC000453089472 568513473 /nfs/dbraw/zinc/51/34/73/568513473.db2.gz KCZFLFIDSHSPEA-HNNXBMFYSA-N 0 0 350.378 3.947 20 5 FHBDRN C[C@@H]1CC[C@H](O)[C@@H]([C@H]2CCCN2c2nc3ccccc3cc2[N+](=O)[O-])C1 ZINC000542006782 568515700 /nfs/dbraw/zinc/51/57/00/568515700.db2.gz DHVRPACAPHPZTM-VWMOJTHMSA-N 0 0 355.438 3.909 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CCOc3c(CC)cccc32)c1 ZINC000570809248 568530968 /nfs/dbraw/zinc/53/09/68/568530968.db2.gz QMQLHCHGSVFTAD-KRWDZBQOSA-N 0 0 370.405 3.810 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)NC1(C(F)F)CCCCC1 ZINC000570874330 568589809 /nfs/dbraw/zinc/58/98/09/568589809.db2.gz YQYFQJXFNJCHJI-UHFFFAOYSA-N 0 0 355.385 3.871 20 5 FHBDRN CCc1cc(=O)c2cc(NC(=O)[C@@H](C)c3cccc([N+](=O)[O-])c3)ccc2[nH]1 ZINC000570904144 568634668 /nfs/dbraw/zinc/63/46/68/568634668.db2.gz SCXJLLJYAQTXRE-LBPRGKRZSA-N 0 0 365.389 3.741 20 5 FHBDRN O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1N[C@@H]1C[C@H]1c1c(F)cccc1Cl ZINC000738357117 598972024 /nfs/dbraw/zinc/97/20/24/598972024.db2.gz BYIHBWHKRYOIAL-NOZJJQNGSA-N 0 0 374.763 3.535 20 5 FHBDRN O=[N+]([O-])c1ccc2nc(Sc3ccc(-c4nn[nH]n4)cc3F)sc2c1 ZINC000823643783 599058946 /nfs/dbraw/zinc/05/89/46/599058946.db2.gz ASMOXMMYIHMCTQ-UHFFFAOYSA-N 0 0 374.382 3.675 20 5 FHBDRN O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1Nc1cccc(CC(F)(F)F)c1 ZINC000823629914 599085991 /nfs/dbraw/zinc/08/59/91/599085991.db2.gz LRHATYKYWZLIOG-UHFFFAOYSA-N 0 0 364.287 3.623 20 5 FHBDRN O=C([O-])c1ccc(C[NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)cc1 ZINC000426690855 597134860 /nfs/dbraw/zinc/13/48/60/597134860.db2.gz CYNSUPQEFYACEM-UHFFFAOYSA-N 0 0 352.346 3.843 20 5 FHBDRN O=[N+]([O-])c1cnc(SCc2cccc3ccccc32)c(-c2nn[nH]n2)c1 ZINC000738374981 598501448 /nfs/dbraw/zinc/50/14/48/598501448.db2.gz WNWSFVPMRLLEJS-UHFFFAOYSA-N 0 0 364.390 3.615 20 5 FHBDRN C[C@H](SCCOc1ccc([N+](=O)[O-])cc1)c1ccc(-c2nn[nH]n2)cc1 ZINC000736191001 599328610 /nfs/dbraw/zinc/32/86/10/599328610.db2.gz VCSUQICBNRXXRU-LBPRGKRZSA-N 0 0 371.422 3.648 20 5 FHBDRN C[C@H](CNc1ccc(/C=C/C(=O)[O-])cc1[N+](=O)[O-])[N@H+](C)Cc1ccccc1 ZINC000736606911 600239703 /nfs/dbraw/zinc/23/97/03/600239703.db2.gz NDBDJUCVJZUXOF-SLZMIMFISA-N 0 0 369.421 3.625 20 5 FHBDRN O=C([O-])[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1cc(Cl)cc(Cl)c1 ZINC000833169881 601973912 /nfs/dbraw/zinc/97/39/12/601973912.db2.gz MQCQCLQCKWPLEF-AWEZNQCLSA-N 0 0 355.177 3.817 20 5 FHBDRN Cc1cc(NC2CC[NH+](CC3CCCC3)CC2)cc(C(=O)[O-])c1[N+](=O)[O-] ZINC000592970975 602315622 /nfs/dbraw/zinc/31/56/22/602315622.db2.gz YNXYCXAXWGQQLB-UHFFFAOYSA-N 0 0 361.442 3.668 20 5 FHBDRN C[C@@H]1C[N@H+](Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)C[C@@H]1C(=O)[O-] ZINC000833629295 604669191 /nfs/dbraw/zinc/66/91/91/604669191.db2.gz HEIJXEDDJZKFBE-WBMJQRKESA-N 0 0 374.368 3.679 20 5 FHBDRN O=C([O-])C[N@H+](Cc1ccc(F)c(F)c1)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000833249189 604789888 /nfs/dbraw/zinc/78/98/88/604789888.db2.gz JZAHGTYDWXBEFN-UHFFFAOYSA-N 0 0 370.739 3.613 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1ccc(CCNC(=O)[O-])cc1 ZINC000830427463 604943117 /nfs/dbraw/zinc/94/31/17/604943117.db2.gz ILJHWVPYPGEUBW-AWEZNQCLSA-N 0 0 357.410 3.564 20 5 FHBDRN O=[N+]([O-])c1ccc2sc(C=Cc3ccccc3-c3nn[nH]n3)nc2c1 ZINC000826499613 607884049 /nfs/dbraw/zinc/88/40/49/607884049.db2.gz PUUHCXLVUKYAQS-YVMONPNESA-N 0 0 350.363 3.555 20 5 FHBDRN O=[N+]([O-])c1ccc(Sc2ccc(-c3nn[nH]n3)cc2)cc1OC(F)F ZINC000826499480 608180289 /nfs/dbraw/zinc/18/02/89/608180289.db2.gz KCRZNXOWBPFKLP-UHFFFAOYSA-N 0 0 365.321 3.528 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2ccc(CNc3cccc(-c4nn[nH]n4)c3)o2)cc1 ZINC000826498135 608872267 /nfs/dbraw/zinc/87/22/67/608872267.db2.gz IKOCQDNIFORGEQ-UHFFFAOYSA-N 0 0 362.349 3.647 20 5 FHBDRN C[C@@H](Sc1nncn1CCc1ccccn1)c1ccccc1[N+](=O)[O-] ZINC000078970692 936321893 /nfs/dbraw/zinc/32/18/93/936321893.db2.gz LAYRPXQMVLPCKY-CYBMUJFWSA-N 0 0 355.423 3.677 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)c1ccc(OCC(F)(F)F)cn1 ZINC000277991523 936325174 /nfs/dbraw/zinc/32/51/74/936325174.db2.gz CZJLJOPCSZPFKV-UHFFFAOYSA-N 0 0 369.299 3.800 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CN[C@@H](C)c1ccc2c(c1)OCCCO2 ZINC000178729222 936326686 /nfs/dbraw/zinc/32/66/86/936326686.db2.gz ATPIESMBVINKEM-ZDUSSCGKSA-N 0 0 358.394 3.616 20 5 FHBDRN CN(Cc1nc([C@@H]2CCc3ccccc32)no1)c1ccccc1[N+](=O)[O-] ZINC000612933433 936346275 /nfs/dbraw/zinc/34/62/75/936346275.db2.gz VEDOJKMGKMIRNQ-OAHLLOKOSA-N 0 0 350.378 3.692 20 5 FHBDRN CC(C)OCc1cc(NC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)ccc1O ZINC000519041254 945063120 /nfs/dbraw/zinc/06/31/20/945063120.db2.gz IFESXADGNPNEPZ-UHFFFAOYSA-N 0 0 369.377 3.959 20 5 FHBDRN Cc1nc(COC(=O)c2ccc([N+](=O)[O-])cc2Br)c(C)s1 ZINC000161487981 936358758 /nfs/dbraw/zinc/35/87/58/936358758.db2.gz GYYDAKPKDSEDFT-UHFFFAOYSA-N 0 0 371.212 3.788 20 5 FHBDRN COC(=O)c1ccc(OCc2ncc(-c3ccc(C)cc3)o2)cc1[N+](=O)[O-] ZINC000613110066 936374287 /nfs/dbraw/zinc/37/42/87/936374287.db2.gz TVNYEVTXKVYYLJ-UHFFFAOYSA-N 0 0 368.345 3.924 20 5 FHBDRN O=[N+]([O-])c1ccc2ncnc(N[C@H]3CCO[C@H](c4ccccc4)C3)c2c1 ZINC000613188211 936384960 /nfs/dbraw/zinc/38/49/60/936384960.db2.gz UWMBRQQFYKBDMC-KSSFIOAISA-N 0 0 350.378 3.870 20 5 FHBDRN CCCC[C@H]1CCC[C@H]1NC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000110719708 945065272 /nfs/dbraw/zinc/06/52/72/945065272.db2.gz OCZQVBMYVTUHFN-WMLDXEAASA-N 0 0 356.426 3.869 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)Nc1cc(C)n([C@H](C)CC)n1 ZINC000439903809 945068566 /nfs/dbraw/zinc/06/85/66/945068566.db2.gz ROSSUBSNEZSXSI-LLVKDONJSA-N 0 0 361.402 3.535 20 5 FHBDRN O=C(Nc1ccc2c(c1)CCO2)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000178766268 937098083 /nfs/dbraw/zinc/09/80/83/937098083.db2.gz DNNFWPLPXKLQTB-UHFFFAOYSA-N 0 0 353.378 3.726 20 5 FHBDRN Cc1nc(COC(C)(C)C)oc1C(=O)N1c2ccc([N+](=O)[O-])cc2C[C@H]1C ZINC000583088268 937109873 /nfs/dbraw/zinc/10/98/73/937109873.db2.gz ZEUYWSYZPQNSOK-LLVKDONJSA-N 0 0 373.409 3.798 20 5 FHBDRN CCc1cnc(CCNC(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)s1 ZINC000176375166 937113710 /nfs/dbraw/zinc/11/37/10/937113710.db2.gz WNNUGNGCODPDSO-LBPRGKRZSA-N 0 0 362.455 3.525 20 5 FHBDRN C[C@H](NC(=O)c1cccc2c(=O)c3ccccc3[nH]c12)[C@H]1CCCCO1 ZINC000278077606 937118697 /nfs/dbraw/zinc/11/86/97/937118697.db2.gz OTDUCZYEMSLIEP-SCLBCKFNSA-N 0 0 350.418 3.781 20 5 FHBDRN COC[C@@H](NC(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1)c1ccc(C)o1 ZINC000176401220 937127422 /nfs/dbraw/zinc/12/74/22/937127422.db2.gz SLORDICUNRMQAR-UKRRQHHQSA-N 0 0 361.398 3.553 20 5 FHBDRN CC(=O)c1ccc(NCc2ccnc(OCC(F)(F)F)c2)c([N+](=O)[O-])c1 ZINC000052105737 937129390 /nfs/dbraw/zinc/12/93/90/937129390.db2.gz HTPNODXWVYUXQD-UHFFFAOYSA-N 0 0 369.299 3.746 20 5 FHBDRN COc1ccc(C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c(C)c1OC ZINC000557566051 927065264 /nfs/dbraw/zinc/06/52/64/927065264.db2.gz ZAVVTGOWPKVVAZ-ZDUSSCGKSA-N 0 0 358.394 3.720 20 5 FHBDRN CO[C@@](C)([C@@H](C)NC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1)C1CC1 ZINC000579684959 927078510 /nfs/dbraw/zinc/07/85/10/927078510.db2.gz VNZAYFOXCKZUPW-DMZKTXOQSA-N 0 0 364.445 3.615 20 5 FHBDRN C[C@H](NC(=O)Cc1ccccc1[N+](=O)[O-])c1ccc(OC(F)F)cc1 ZINC000044616929 927092487 /nfs/dbraw/zinc/09/24/87/927092487.db2.gz IHVNXSNHLJXLOM-NSHDSACASA-N 0 0 350.321 3.616 20 5 FHBDRN CCN1CCc2ccc(NC(=O)c3cc(SC)ccc3[N+](=O)[O-])cc21 ZINC000076181867 927135378 /nfs/dbraw/zinc/13/53/78/927135378.db2.gz DWTYTIGIRZZFNB-UHFFFAOYSA-N 0 0 357.435 3.951 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)NCc1cc(Cl)ccc1OC(F)F ZINC000175268636 927145479 /nfs/dbraw/zinc/14/54/79/927145479.db2.gz YYKCZUXQPRPMLS-UHFFFAOYSA-N 0 0 370.739 3.709 20 5 FHBDRN COc1ccc(NC(=O)[C@@H](C)Nc2ccc(C)c(C(C)=O)c2)c([N+](=O)[O-])c1 ZINC000577526429 927169453 /nfs/dbraw/zinc/16/94/53/927169453.db2.gz BJIBVQJCLXSOFV-GFCCVEGCSA-N 0 0 371.393 3.554 20 5 FHBDRN COc1cccc(C2(NC(=O)Cc3ccc([N+](=O)[O-])cc3Cl)CCC2)c1 ZINC000598427937 927187847 /nfs/dbraw/zinc/18/78/47/927187847.db2.gz ZVJXBNDFCMOVBD-UHFFFAOYSA-N 0 0 374.824 3.995 20 5 FHBDRN Cc1c(OC[C@@H](O)c2ccccc2Br)cccc1[N+](=O)[O-] ZINC000755325714 937142681 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FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N2CCC(Cc3cccc(F)c3)CC2)c1 ZINC000062264733 927292903 /nfs/dbraw/zinc/29/29/03/927292903.db2.gz MHLPODIBQCUNTE-UHFFFAOYSA-N 0 0 372.396 3.837 20 5 FHBDRN COc1ccc(C(=O)OCc2ccc([N+](=O)[O-])c(F)c2)c(OC(C)C)c1 ZINC000784906419 927295368 /nfs/dbraw/zinc/29/53/68/927295368.db2.gz UWNUQWNDVVFENW-UHFFFAOYSA-N 0 0 363.341 3.887 20 5 FHBDRN CO[C@H](CNC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])C1CCCCC1 ZINC000598438225 927310720 /nfs/dbraw/zinc/31/07/20/927310720.db2.gz SHASDEFJXVFYFS-OAHLLOKOSA-N 0 0 374.359 3.939 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NC[C@@]1(O)CCCc2ccccc21 ZINC000120119658 927310951 /nfs/dbraw/zinc/31/09/51/927310951.db2.gz ZUBOPLKCHHIHBA-FQEVSTJZSA-N 0 0 369.421 3.557 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N[C@@H](C)[C@H](O)c1ccc(F)cc1 ZINC000120122168 927311225 /nfs/dbraw/zinc/31/12/25/927311225.db2.gz WMIOMQXBCYDKLP-SJCJKPOMSA-N 0 0 361.373 3.594 20 5 FHBDRN COC(=O)c1scc(C)c1NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000186880159 927317156 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CCC[C@H]1[C@@H](C)CCCN1C(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000175289868 927457257 /nfs/dbraw/zinc/45/72/57/927457257.db2.gz CZWNHOHALLHLGW-JSGCOSHPSA-N 0 0 350.415 3.653 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)Nc1cc(Br)ccc1O ZINC000176433589 937166466 /nfs/dbraw/zinc/16/64/66/937166466.db2.gz MJWBMIYDSZABLQ-UHFFFAOYSA-N 0 0 351.156 3.624 20 5 FHBDRN CC(C)(NCC(=O)Nc1ccccc1[N+](=O)[O-])c1cccc(Cl)c1F ZINC000186891233 927481798 /nfs/dbraw/zinc/48/17/98/927481798.db2.gz ZZABARZADAQQJK-UHFFFAOYSA-N 0 0 365.792 3.851 20 5 FHBDRN CSc1cccc(C(=O)N2CCN(C3CC3)c3ccccc32)c1[N+](=O)[O-] ZINC000186900786 927517282 /nfs/dbraw/zinc/51/72/82/927517282.db2.gz HYIWWEIJXLXZSK-UHFFFAOYSA-N 0 0 369.446 3.946 20 5 FHBDRN O=C(NCc1ccc(O)c(F)c1)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000458403733 937173619 /nfs/dbraw/zinc/17/36/19/937173619.db2.gz CCOCDIPOKZGJQP-OAHLLOKOSA-N 0 0 373.384 3.529 20 5 FHBDRN O=C(c1cncc(C(F)(F)F)c1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000577795479 927567764 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0 0 371.384 3.997 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1CN1CCO[C@@H](c2cccc(Cl)c2)C1 ZINC000430192828 927797687 /nfs/dbraw/zinc/79/76/87/927797687.db2.gz DGLWODNOFQLLLP-GOSISDBHSA-N 0 0 362.813 3.830 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1CN(C)Cc1ccc(Br)o1 ZINC000430194175 927819438 /nfs/dbraw/zinc/81/94/38/927819438.db2.gz HLTLOUSOVJTXKT-UHFFFAOYSA-N 0 0 355.188 3.591 20 5 FHBDRN O=[N+]([O-])c1cc(CN2CCC[C@@](O)(C(F)(F)F)CC2)ccc1Cl ZINC000285605729 927847259 /nfs/dbraw/zinc/84/72/59/927847259.db2.gz PVMDYLKPKXVMDP-ZDUSSCGKSA-N 0 0 352.740 3.528 20 5 FHBDRN C/C(=C\C(=O)OCc1nnc(C2CC2)n1C1CC1)c1ccc([N+](=O)[O-])cc1 ZINC000784930155 927848801 /nfs/dbraw/zinc/84/88/01/927848801.db2.gz CZVAFKAHBHALDB-ZRDIBKRKSA-N 0 0 368.393 3.545 20 5 FHBDRN C[C@H](CNC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)Cc1cccs1 ZINC000610191427 927853848 /nfs/dbraw/zinc/85/38/48/927853848.db2.gz NJDKWUNYXCWBAU-LBPRGKRZSA-N 0 0 359.451 3.839 20 5 FHBDRN C[C@H](Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C(=O)N1CCCC[C@H]1C ZINC000248047958 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3.966 20 5 FHBDRN C[C@H](NC(=O)[C@@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1)c1cnn(CC2CCC2)c1 ZINC000890667543 929144189 /nfs/dbraw/zinc/14/41/89/929144189.db2.gz RYNYHMGDCOSIKR-MJXNMMHHSA-N 0 0 368.437 3.572 20 5 FHBDRN Cc1nc([C@H]2CCCN2c2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])cs1 ZINC000275004849 929158907 /nfs/dbraw/zinc/15/89/07/929158907.db2.gz HPBJHEXAEPUBNQ-OAHLLOKOSA-N 0 0 372.450 3.593 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)c1cc(N2CCCC2=O)ccc1Cl ZINC000134708998 929162411 /nfs/dbraw/zinc/16/24/11/929162411.db2.gz IQZPJOSGHZEYRW-UHFFFAOYSA-N 0 0 373.796 3.936 20 5 FHBDRN CSc1cccc(C(=O)N[C@@H](C)c2cnn(CC3CCC3)c2)c1[N+](=O)[O-] ZINC000890672769 929209881 /nfs/dbraw/zinc/20/98/81/929209881.db2.gz ZZDQZIUYPCYSTD-LBPRGKRZSA-N 0 0 374.466 3.804 20 5 FHBDRN COc1cccc(C(=O)N2CCS[C@@H]2c2ccc([N+](=O)[O-])cc2)c1F ZINC000535626394 929252401 /nfs/dbraw/zinc/25/24/01/929252401.db2.gz OHIWFCARZBUSJL-QGZVFWFLSA-N 0 0 362.382 3.630 20 5 FHBDRN COC(=O)c1cc(NC(=O)c2cc3cccc(F)c3o2)cc([N+](=O)[O-])c1 ZINC000610240809 929253493 /nfs/dbraw/zinc/25/34/93/929253493.db2.gz KUCCYYGAZCLQLG-UHFFFAOYSA-N 0 0 358.281 3.519 20 5 FHBDRN Cc1ccc2c(CC(=O)NCc3cc([N+](=O)[O-])c(F)cc3F)coc2c1 ZINC001143377076 929307087 /nfs/dbraw/zinc/30/70/87/929307087.db2.gz QJKJUSTWVVXMAR-UHFFFAOYSA-N 0 0 360.316 3.787 20 5 FHBDRN CSCCCCNc1ccc(I)cc1[N+](=O)[O-] ZINC000134827536 929313554 /nfs/dbraw/zinc/31/35/54/929313554.db2.gz XHEBXGPDTXBXDD-UHFFFAOYSA-N 0 0 366.224 3.755 20 5 FHBDRN CCc1cc(NC(=O)Cc2ccsc2C)c2cc([N+](=O)[O-])ccc2n1 ZINC000471228467 929320711 /nfs/dbraw/zinc/32/07/11/929320711.db2.gz XJPHQPLKXWZDDX-UHFFFAOYSA-N 0 0 355.419 3.678 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N(C)Cc2ccc(C)s2)cc1OC ZINC000076175018 929332944 /nfs/dbraw/zinc/33/29/44/929332944.db2.gz GLXRXMALDLCWGW-UHFFFAOYSA-N 0 0 364.423 3.644 20 5 FHBDRN Cc1cc(Cl)c(S(=O)(=O)Nc2ccc(F)cc2F)cc1[N+](=O)[O-] ZINC000176635720 937323282 /nfs/dbraw/zinc/32/32/82/937323282.db2.gz LXLQWFSRMASAQN-UHFFFAOYSA-N 0 0 362.741 3.636 20 5 FHBDRN CCO[C@@H](C)c1noc(CN(C)c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)n1 ZINC000535988846 937323653 /nfs/dbraw/zinc/32/36/53/937323653.db2.gz LASIIFBYTSKDDS-VIFPVBQESA-N 0 0 374.319 3.731 20 5 FHBDRN CNc1ccc(C(=O)N2CC[C@@H](c3ccccc3)[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000610243042 929356738 /nfs/dbraw/zinc/35/67/38/929356738.db2.gz MPNUAAGXGSPNOX-WMLDXEAASA-N 0 0 353.422 3.902 20 5 FHBDRN O=[N+]([O-])c1cnc(N(Cc2ccccn2)C2CCCCC2)c([N+](=O)[O-])c1 ZINC001167099609 929374015 /nfs/dbraw/zinc/37/40/15/929374015.db2.gz FLLAKQRLTKVGEA-UHFFFAOYSA-N 0 0 357.370 3.632 20 5 FHBDRN O=C(N[C@@H](c1ccsc1)c1ccc(Cl)cc1)c1c[nH]nc1[N+](=O)[O-] ZINC000547758365 929397938 /nfs/dbraw/zinc/39/79/38/929397938.db2.gz RVWQVYFAUOVHDP-CYBMUJFWSA-N 0 0 362.798 3.552 20 5 FHBDRN Nc1nccc(C(=O)Nc2cccc(COC3CCCCC3)c2)c1[N+](=O)[O-] ZINC000547757824 929400096 /nfs/dbraw/zinc/40/00/96/929400096.db2.gz HHPDRBFYGDMWOD-UHFFFAOYSA-N 0 0 370.409 3.504 20 5 FHBDRN Cc1cc(C(=O)N[C@H]2CCCN(c3ccc(F)cc3C)C2)cc([N+](=O)[O-])c1 ZINC000609757483 929403131 /nfs/dbraw/zinc/40/31/31/929403131.db2.gz GOKFYKCSPYXVON-KRWDZBQOSA-N 0 0 371.412 3.750 20 5 FHBDRN Cc1ccccc1[C@@H](O)CNc1ncc([N+](=O)[O-])c(C)c1Br ZINC000754038815 929436033 /nfs/dbraw/zinc/43/60/33/929436033.db2.gz XHCHRQYWSDHHEI-ZDUSSCGKSA-N 0 0 366.215 3.515 20 5 FHBDRN Cc1ccc(N2C(=O)C(=Cc3csc([N+](=O)[O-])c3)NC2=S)c(C)c1 ZINC000120707254 929448382 /nfs/dbraw/zinc/44/83/82/929448382.db2.gz SLNFQOTUWSQWGC-SDQBBNPISA-N 0 0 359.432 3.535 20 5 FHBDRN C[C@H](NC(=O)c1c[nH]nc1-c1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000057282355 929500250 /nfs/dbraw/zinc/50/02/50/929500250.db2.gz KSQBOUXNNUDSKJ-NSHDSACASA-N 0 0 354.341 3.615 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2noc(CNC3(C(F)F)CCCCC3)n2)c1 ZINC000510161844 929500827 /nfs/dbraw/zinc/50/08/27/929500827.db2.gz WTRZJEBFPFQCRS-UHFFFAOYSA-N 0 0 352.341 3.702 20 5 FHBDRN O=C(c1cccc(COc2cc(F)cc([N+](=O)[O-])c2)c1)N1CCCCC1 ZINC000135348453 937337360 /nfs/dbraw/zinc/33/73/60/937337360.db2.gz GKQZXKCZJHWAFC-UHFFFAOYSA-N 0 0 358.369 3.939 20 5 FHBDRN COc1cc(C(=O)Nc2cccc3c2OC(C)(C)C3)c([N+](=O)[O-])cc1F ZINC000583308357 937338027 /nfs/dbraw/zinc/33/80/27/937338027.db2.gz NKYBSZOHULHFBQ-UHFFFAOYSA-N 0 0 360.341 3.708 20 5 FHBDRN O=C1CN(c2ccc3ccc4cccnc4c3n2)CCN1Cc1ccccc1 ZINC001167104231 929533237 /nfs/dbraw/zinc/53/32/37/929533237.db2.gz PRWYYTQBKFYMBO-UHFFFAOYSA-N 0 0 368.440 3.632 20 5 FHBDRN COc1ccc(C(=O)Nc2ccc(CC(F)(F)F)cc2)cc1[N+](=O)[O-] ZINC000127119261 929546813 /nfs/dbraw/zinc/54/68/13/929546813.db2.gz RHXBUAJDVMDTMO-UHFFFAOYSA-N 0 0 354.284 3.961 20 5 FHBDRN COCc1nc2ccccc2c(C)c1C(=O)OCc1cccc([N+](=O)[O-])c1 ZINC000023509899 929559931 /nfs/dbraw/zinc/55/99/31/929559931.db2.gz OOTAIWVHPAEPMP-UHFFFAOYSA-N 0 0 366.373 3.955 20 5 FHBDRN O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)N1CCC[C@H]2CCC[C@H]21 ZINC000175346179 929621051 /nfs/dbraw/zinc/62/10/51/929621051.db2.gz YJPPTBKYXLLDOI-ZWNOBZJWSA-N 0 0 355.341 3.993 20 5 FHBDRN O=C(NC1CCSCC1)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12 ZINC000275635139 929657584 /nfs/dbraw/zinc/65/75/84/929657584.db2.gz UKCMYHFKZWUKBH-UHFFFAOYSA-N 0 0 374.412 3.997 20 5 FHBDRN O=C(Nc1cccc(Cn2cccn2)c1)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000161654509 937352021 /nfs/dbraw/zinc/35/20/21/937352021.db2.gz RVBAFQZMXIIPHV-UHFFFAOYSA-N 0 0 361.361 3.573 20 5 FHBDRN C[C@H](CNC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12)Sc1ccccc1 ZINC000610296248 929705037 /nfs/dbraw/zinc/70/50/37/929705037.db2.gz BDMMKNJNADHZEQ-GFCCVEGCSA-N 0 0 355.419 3.987 20 5 FHBDRN C[C@H](O)CCN(C)C(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000176678395 937353251 /nfs/dbraw/zinc/35/32/51/937353251.db2.gz DTULMRAHNFRSFB-ZDUSSCGKSA-N 0 0 360.435 3.589 20 5 FHBDRN Cc1cc(F)cc(C(=O)Nc2ccc(OC[C@H]3CCCO3)cc2)c1[N+](=O)[O-] ZINC000176776571 937353887 /nfs/dbraw/zinc/35/38/87/937353887.db2.gz PADOTHROEWWVKX-MRXNPFEDSA-N 0 0 374.368 3.852 20 5 FHBDRN Cc1cc(F)cc(C(=O)Nc2ccc(OC[C@@H]3CCCO3)cc2)c1[N+](=O)[O-] ZINC000176776561 937353945 /nfs/dbraw/zinc/35/39/45/937353945.db2.gz PADOTHROEWWVKX-INIZCTEOSA-N 0 0 374.368 3.852 20 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/nfs/dbraw/zinc/77/20/76/929772076.db2.gz QYKRERDIYYSMDC-UHFFFAOYSA-N 0 0 362.769 3.970 20 5 FHBDRN CCS[C@H]1CCC[C@H]1NC(=O)c1cc([N+](=O)[O-])ccc1Br ZINC000175823285 929773155 /nfs/dbraw/zinc/77/31/55/929773155.db2.gz MCDAVIJCHFKXCZ-OLZOCXBDSA-N 0 0 373.272 3.761 20 5 FHBDRN Cc1ccc2c(Cl)c(C(=O)OCCn3cc([N+](=O)[O-])cn3)sc2c1 ZINC000748125583 929790503 /nfs/dbraw/zinc/79/05/03/929790503.db2.gz SQEPYZFEASJDII-UHFFFAOYSA-N 0 0 365.798 3.825 20 5 FHBDRN CO[C@@H](CNC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1)C(C)(C)C ZINC000275676203 929833600 /nfs/dbraw/zinc/83/36/00/929833600.db2.gz BRTVAYQCDHPWSF-SFHVURJKSA-N 0 0 352.434 3.885 20 5 FHBDRN C[C@H](Cc1ccc(Cl)cc1Cl)C(=O)OCCn1ccc([N+](=O)[O-])n1 ZINC000748126028 929843950 /nfs/dbraw/zinc/84/39/50/929843950.db2.gz VYLLHPOOLCPDBL-SNVBAGLBSA-N 0 0 372.208 3.520 20 5 FHBDRN Cc1ccc2c(c1)O[C@@H](C)CN2C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1C ZINC000175841189 929872671 /nfs/dbraw/zinc/87/26/71/929872671.db2.gz QXBDGACCKQPEOX-NSHDSACASA-N 0 0 371.349 3.548 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)N2CCC[C@@H]2[C@H]2CCCOC2)cc1[N+](=O)[O-] ZINC000572956315 937367672 /nfs/dbraw/zinc/36/76/72/937367672.db2.gz URPKVIKIWIJDFL-BHYGNILZSA-N 0 0 361.442 3.565 20 5 FHBDRN CC[C@H]1CCC[C@H]1NC(=O)c1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000155526212 929894258 /nfs/dbraw/zinc/89/42/58/929894258.db2.gz ZDNQNCFJEZSOGC-GXSJLCMTSA-N 0 0 358.341 3.513 20 5 FHBDRN CN(C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2)[C@@H]1CCC[C@@H]1c1ccccc1 ZINC000458022639 929934151 /nfs/dbraw/zinc/93/41/51/929934151.db2.gz IFFGTWFDTAERCS-HZPDHXFCSA-N 0 0 368.389 3.732 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)[C@@H]1C[C@@H]1c1ccc(F)cc1F ZINC000560723685 929962188 /nfs/dbraw/zinc/96/21/88/929962188.db2.gz XBDLVBOEDMTHRC-HZPDHXFCSA-N 0 0 360.360 3.678 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1-c1nc(-c2ccc(N3CCCC3=O)cc2)no1 ZINC000544905547 929966455 /nfs/dbraw/zinc/96/64/55/929966455.db2.gz DBSXEQOXMSBYDR-UHFFFAOYSA-N 0 0 364.361 3.747 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1N1CCC(n2ccc(C(F)(F)F)n2)CC1 ZINC000155946153 937379266 /nfs/dbraw/zinc/37/92/66/937379266.db2.gz KKGJLFVFDLWCHR-UHFFFAOYSA-N 0 0 354.332 3.960 20 5 FHBDRN CC(C)CCOc1cccc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)c1 ZINC000064879886 929992816 /nfs/dbraw/zinc/99/28/16/929992816.db2.gz SKKKKJQPSUWDFG-UHFFFAOYSA-N 0 0 361.373 3.993 20 5 FHBDRN COC[C@@H](NC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc21)c1cccc(Cl)c1 ZINC000583353751 937376530 /nfs/dbraw/zinc/37/65/30/937376530.db2.gz GURRNJLTXCTAKM-QGZVFWFLSA-N 0 0 373.796 3.847 20 5 FHBDRN O=C(NCc1ccc(Cl)o1)c1ccc([N+](=O)[O-])cc1Br ZINC000610060186 930047286 /nfs/dbraw/zinc/04/72/86/930047286.db2.gz HLDGABPABPTCBM-UHFFFAOYSA-N 0 0 359.563 3.534 20 5 FHBDRN COC(=O)[C@@H](NCCCCc1ccc([N+](=O)[O-])cc1)c1ccccc1F ZINC000610347873 930058251 /nfs/dbraw/zinc/05/82/51/930058251.db2.gz NBLDBRGZDVKLAI-SFHVURJKSA-N 0 0 360.385 3.561 20 5 FHBDRN O=C(NCCOc1ccc([N+](=O)[O-])cc1)N[C@@H](CC1CC1)c1ccccc1 ZINC000610351088 930077399 /nfs/dbraw/zinc/07/73/99/930077399.db2.gz MZENSAZNRMJBLL-IBGZPJMESA-N 0 0 369.421 3.814 20 5 FHBDRN O=C(N[C@H]1CCCSC1)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12 ZINC000275744279 930099515 /nfs/dbraw/zinc/09/95/15/930099515.db2.gz IBAJRVAYLWXBEO-LBPRGKRZSA-N 0 0 374.412 3.997 20 5 FHBDRN CCCC(=O)Nc1ccc(CNc2nc3sccn3c2[N+](=O)[O-])cc1 ZINC000052309090 937389123 /nfs/dbraw/zinc/38/91/23/937389123.db2.gz SBKQOLDZAMBTMZ-UHFFFAOYSA-N 0 0 359.411 3.655 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N1CCC(Oc2ccccc2)CC1 ZINC001125410528 930106801 /nfs/dbraw/zinc/10/68/01/930106801.db2.gz BOVKLPSOCVKUDO-UHFFFAOYSA-N 0 0 354.406 3.895 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N1C[C@@H](C)O[C@H](c2ccsc2)C1 ZINC000156021209 937389825 /nfs/dbraw/zinc/38/98/25/937389825.db2.gz HHDZRUXDCCFXLW-WBMJQRKESA-N 0 0 361.423 3.959 20 5 FHBDRN CCN(C[C@@H]1CCN(c2ccc(Cl)cc2[N+](=O)[O-])C1)CC(F)(F)F ZINC000471519518 930128198 /nfs/dbraw/zinc/12/81/98/930128198.db2.gz HZJNEKRSEKZZNE-NSHDSACASA-N 0 0 365.783 3.959 20 5 FHBDRN COC(=O)[C@@H](Cc1c[nH]c2ccccc12)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000471521277 930137530 /nfs/dbraw/zinc/13/75/30/930137530.db2.gz IMVKYHKOJIRUQV-MRXNPFEDSA-N 0 0 373.796 3.926 20 5 FHBDRN CC(C)c1cccc(N(C)CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)c1 ZINC000063590004 930140331 /nfs/dbraw/zinc/14/03/31/930140331.db2.gz GVYLNIUSTLMFKA-UHFFFAOYSA-N 0 0 371.393 3.522 20 5 FHBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1CN(C)Cc1nc2ccccc2n1C ZINC000083219541 930183162 /nfs/dbraw/zinc/18/31/62/930183162.db2.gz NIOAFPIHLITJRT-UHFFFAOYSA-N 0 0 368.437 3.901 20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])N[C@@H]1CC[C@H](c2ccc(F)cc2)C1 ZINC000471530653 930185761 /nfs/dbraw/zinc/18/57/61/930185761.db2.gz RQDSDVCOCBDIJR-DOTOQJQBSA-N 0 0 371.412 3.988 20 5 FHBDRN COc1ccc(C(=O)NCc2ccc3[nH]c(C)c(C)c3c2)cc1[N+](=O)[O-] ZINC000064901474 930188500 /nfs/dbraw/zinc/18/85/00/930188500.db2.gz IJPTUUZRBSHHID-UHFFFAOYSA-N 0 0 353.378 3.632 20 5 FHBDRN Nc1ccc(C(=O)N[C@@H]2CCCC[C@@H]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000728283326 930190965 /nfs/dbraw/zinc/19/09/65/930190965.db2.gz JKSWPJVGWWAQQP-CRAIPNDOSA-N 0 0 353.422 3.708 20 5 FHBDRN O=C(c1ccn(-c2ccccc2Cl)n1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000064898112 930215205 /nfs/dbraw/zinc/21/52/05/930215205.db2.gz OIUAVTCWNJXURC-UHFFFAOYSA-N 0 0 368.780 3.637 20 5 FHBDRN CO[C@@H]1CCCC[C@@H]1NC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000275785502 930218033 /nfs/dbraw/zinc/21/80/33/930218033.db2.gz NNJHXPQQWRDECF-RBUKOAKNSA-N 0 0 350.418 3.781 20 5 FHBDRN CO[C@@H]1CCCN(C(=O)c2cc(F)cc3c(=O)c4cc(F)ccc4[nH]c23)C1 ZINC000275789113 930222182 /nfs/dbraw/zinc/22/21/82/930222182.db2.gz ITQBZVFTJBBNFA-CYBMUJFWSA-N 0 0 372.371 3.623 20 5 FHBDRN C[S@@](=O)c1ccc(CNc2ccc([N+](=O)[O-])c(OC(F)F)c2)cc1 ZINC000080246906 937397849 /nfs/dbraw/zinc/39/78/49/937397849.db2.gz JXRXOXWYAQDBRL-DEOSSOPVSA-N 0 0 356.350 3.546 20 5 FHBDRN COc1cc(C(=O)N(C)Cc2cccc(C)c2C)cc([N+](=O)[O-])c1OC ZINC000560954792 930253876 /nfs/dbraw/zinc/25/38/76/930253876.db2.gz MZNXWLUSFKENOM-UHFFFAOYSA-N 0 0 358.394 3.501 20 5 FHBDRN C[C@@H]([C@@H]1Cc2ccccc2O1)N(C)C(=O)CSc1ccccc1[N+](=O)[O-] ZINC000580120152 930269531 /nfs/dbraw/zinc/26/95/31/930269531.db2.gz WGQQAHGBQSAHQN-GUYCJALGSA-N 0 0 372.446 3.538 20 5 FHBDRN O=C(c1c(F)cc(F)cc1F)C1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000580121060 930271710 /nfs/dbraw/zinc/27/17/10/930271710.db2.gz ISPOEZFEFMELIH-UHFFFAOYSA-N 0 0 365.311 3.506 20 5 FHBDRN CC(C)(C)OC(=O)CCCCOC(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000785006333 930282396 /nfs/dbraw/zinc/28/23/96/930282396.db2.gz CVFLJJOVBBRKMP-UHFFFAOYSA-N 0 0 357.790 3.917 20 5 FHBDRN Cc1cccc2c1[C@H](C)C[C@@H]2Cc1nc(-c2c([N+](=O)[O-])ncn2C)no1 ZINC000580127152 930287806 /nfs/dbraw/zinc/28/78/06/930287806.db2.gz YTEWOVJWDVSCSH-VXGBXAGGSA-N 0 0 353.382 3.520 20 5 FHBDRN Cc1csc2nc(C)nc(N3CCOc4ccc([N+](=O)[O-])cc4C3)c12 ZINC000580138208 930294344 /nfs/dbraw/zinc/29/43/44/930294344.db2.gz JCSLWLCRCJDVGL-UHFFFAOYSA-N 0 0 356.407 3.615 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H]1CC[C@@H](c2ccc(F)cc2)C1 ZINC000471543110 930300452 /nfs/dbraw/zinc/30/04/52/930300452.db2.gz XANQJJVZPWHWBH-HIFRSBDPSA-N 0 0 358.369 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FHBDRN CCCN(C(=O)Cn1c(C)ncc1[N+](=O)[O-])[C@@H](C)c1cc2ccccc2o1 ZINC001125441160 930515995 /nfs/dbraw/zinc/51/59/95/930515995.db2.gz HPGLWTVNHDWLPX-ZDUSSCGKSA-N 0 0 370.409 3.846 20 5 FHBDRN CN(C[C@@H]1CCCO1)C(=O)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12 ZINC000275844173 930524004 /nfs/dbraw/zinc/52/40/04/930524004.db2.gz QNEKTVLDQCVUDS-ZDUSSCGKSA-N 0 0 372.371 3.623 20 5 FHBDRN C[C@@H](NC(=O)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12)[C@H]1CCOC1 ZINC000275844384 930524852 /nfs/dbraw/zinc/52/48/52/930524852.db2.gz WFIQILKCQYPXHH-MNOVXSKESA-N 0 0 372.371 3.527 20 5 FHBDRN Cc1cc(N2CCC(N3c4ccccc4C[C@H]3C)CC2)ncc1[N+](=O)[O-] ZINC000610430844 930526492 /nfs/dbraw/zinc/52/64/92/930526492.db2.gz UCIGAJTYCXDKIA-OAHLLOKOSA-N 0 0 352.438 3.718 20 5 FHBDRN CCc1ccc(C(=O)Nc2cccc(CN3CCCC3=O)c2)cc1[N+](=O)[O-] ZINC000610433998 930534532 /nfs/dbraw/zinc/53/45/32/930534532.db2.gz HOCQGKJDTLKGNF-UHFFFAOYSA-N 0 0 367.405 3.532 20 5 FHBDRN O=C(C[C@H]1COCCN1Cc1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1 ZINC000134194165 930540113 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O=C(c1ccc([N+](=O)[O-])cc1F)N1CCCCc2ccc([N+](=O)[O-])cc21 ZINC001167393501 930628310 /nfs/dbraw/zinc/62/83/10/930628310.db2.gz UVFGDIBTNHCYMJ-UHFFFAOYSA-N 0 0 359.313 3.625 20 5 FHBDRN CC(=O)c1ccc(OCC(=O)N[C@@H](C)CCCC(C)C)c([N+](=O)[O-])c1 ZINC000119084241 930633317 /nfs/dbraw/zinc/63/33/17/930633317.db2.gz MRPPPSWAUREPBF-ZDUSSCGKSA-N 0 0 350.415 3.507 20 5 FHBDRN COc1ccc([C@H](OC)[C@@H](C)Nc2ccc3cc([N+](=O)[O-])ccc3n2)cc1 ZINC000536766179 930639218 /nfs/dbraw/zinc/63/92/18/930639218.db2.gz DIYPIWQGSYHAHI-ZUOKHONESA-N 0 0 367.405 3.762 20 5 FHBDRN O=C(Nc1ccc(Nc2ncnc3sc([N+](=O)[O-])cc32)cc1)C1CC1 ZINC000561106120 930657593 /nfs/dbraw/zinc/65/75/93/930657593.db2.gz RMEYMZHLBZGRBZ-UHFFFAOYSA-N 0 0 355.379 3.692 20 5 FHBDRN Cc1cccc(COCC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1 ZINC001125448178 930659712 /nfs/dbraw/zinc/65/97/12/930659712.db2.gz POIPUUNANVQESD-UHFFFAOYSA-N 0 0 356.422 3.857 20 5 FHBDRN CCC(CC)[C@H]1C[C@@H](NC(=O)c2cc(F)c([N+](=O)[O-])cc2F)CCO1 ZINC000155741340 930665030 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COc1ccc([N+](=O)[O-])cc1C(=O)Oc1ccc(F)c(Br)c1 ZINC001266613069 930702508 /nfs/dbraw/zinc/70/25/08/930702508.db2.gz LRFJHYPAGDTPND-UHFFFAOYSA-N 0 0 370.130 3.724 20 5 FHBDRN CC(=O)c1ccc(OCC(=O)Nc2cccc(C(C)C)c2)c([N+](=O)[O-])c1 ZINC000119129512 930718208 /nfs/dbraw/zinc/71/82/08/930718208.db2.gz GBPJDQLWDIEODS-UHFFFAOYSA-N 0 0 356.378 3.938 20 5 FHBDRN COc1ccccc1[C@H]1CCN(C(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000579666569 930733837 /nfs/dbraw/zinc/73/38/37/930733837.db2.gz CUOOAIUOGIVDOQ-HOCLYGCPSA-N 0 0 354.406 3.723 20 5 FHBDRN COc1ccccc1OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000050256374 930752400 /nfs/dbraw/zinc/75/24/00/930752400.db2.gz UCPHFCUFQRILDB-UHFFFAOYSA-N 0 0 356.359 3.946 20 5 FHBDRN Cc1ccnc(-c2n[nH]c([C@@H](C)N[C@@H](C)c3cc([N+](=O)[O-])ccc3C)n2)c1 ZINC000580511418 930785641 /nfs/dbraw/zinc/78/56/41/930785641.db2.gz FHNNORMDPQEDDD-UONOGXRCSA-N 0 0 366.425 3.804 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)c1ccc(-c2noc(C(F)F)n2)cc1 ZINC000537212899 930868281 /nfs/dbraw/zinc/86/82/81/930868281.db2.gz WKDYVKJMQFZMSL-UHFFFAOYSA-N 0 0 374.303 3.512 20 5 FHBDRN Cc1cc2c(cc1[N+](=O)[O-])N(C(=O)c1cc(-c3ccc(F)cc3)no1)CC2 ZINC001266623239 930871428 /nfs/dbraw/zinc/87/14/28/930871428.db2.gz JAUNSOYVRBDWDQ-UHFFFAOYSA-N 0 0 367.336 3.900 20 5 FHBDRN CCn1c(C)nc([N+](=O)[O-])c1N(C)Cc1ccc(OCC(F)(F)F)cc1 ZINC000580595438 930902791 /nfs/dbraw/zinc/90/27/91/930902791.db2.gz HILXSLCLEVJWFC-UHFFFAOYSA-N 0 0 372.347 3.697 20 5 FHBDRN Cc1ncsc1/C=C/c1nc(Cc2c[nH]c3ccc([N+](=O)[O-])cc23)no1 ZINC000580601990 930910890 /nfs/dbraw/zinc/91/08/90/930910890.db2.gz YQIIVXFTICHVTM-SNAWJCMRSA-N 0 0 367.390 3.985 20 5 FHBDRN O=C(CCCOc1ccccc1Cl)NCCc1ccc([N+](=O)[O-])cc1 ZINC000050340058 930914484 /nfs/dbraw/zinc/91/44/84/930914484.db2.gz WSYAQIBHQYMJQE-UHFFFAOYSA-N 0 0 362.813 3.766 20 5 FHBDRN O=C(C[C@@H]1Cc2ccccc2O1)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC001266631450 930925296 /nfs/dbraw/zinc/92/52/96/930925296.db2.gz XEGQXNLLTWXZOC-LBPRGKRZSA-N 0 0 366.295 3.946 20 5 FHBDRN Cc1ccc(Br)c(C(=O)Nc2ccc([N+](=O)[O-])c(C)c2)n1 ZINC001266633453 930963612 /nfs/dbraw/zinc/96/36/12/930963612.db2.gz LEGSHJYHIKJZKX-UHFFFAOYSA-N 0 0 350.172 3.621 20 5 FHBDRN O=C(c1cccc([N+](=O)[O-])c1)N(Cc1cccc(F)c1)C[C@@H]1CCCO1 ZINC000050379622 930977774 /nfs/dbraw/zinc/97/77/74/930977774.db2.gz HBALJYBLTRBAAH-SFHVURJKSA-N 0 0 358.369 3.555 20 5 FHBDRN O=C(N[C@H]1CCO[C@@H](C2CC2)C1)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000275929601 930983943 /nfs/dbraw/zinc/98/39/43/930983943.db2.gz HVWXDWYWWVMLKY-MGPUTAFESA-N 0 0 362.429 3.781 20 5 FHBDRN COCc1cccc(CNC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)c1 ZINC000119265952 930991968 /nfs/dbraw/zinc/99/19/68/930991968.db2.gz QADFBMQDACFRIA-UHFFFAOYSA-N 0 0 371.437 3.563 20 5 FHBDRN Cc1cc(F)cc(C(=O)N2CCc3c(F)cc(F)cc3C2)c1[N+](=O)[O-] ZINC000134291085 930992902 /nfs/dbraw/zinc/99/29/02/930992902.db2.gz USEGQLAOVGDWSO-UHFFFAOYSA-N 0 0 350.296 3.519 20 5 FHBDRN CCOc1ccc(C(=O)N2CC(C)(C)Oc3ccccc32)cc1[N+](=O)[O-] ZINC000071499340 931004128 /nfs/dbraw/zinc/00/41/28/931004128.db2.gz GXVDTSWFZFULEI-UHFFFAOYSA-N 0 0 356.378 3.811 20 5 FHBDRN O=C(c1cccc(Cl)c1[N+](=O)[O-])N1CCc2c(F)cc(F)cc2C1 ZINC000134303106 931031187 /nfs/dbraw/zinc/03/11/87/931031187.db2.gz XOWLMENWDDJMQY-UHFFFAOYSA-N 0 0 352.724 3.725 20 5 FHBDRN C[C@@H]1CC[C@@H](C)N1C(=O)c1ccc(C(=O)N2[C@H](C)CC[C@@H]2C)c([N+](=O)[O-])c1 ZINC000119287153 931035649 /nfs/dbraw/zinc/03/56/49/931035649.db2.gz YDZKLPZXJCNLLU-TUVASFSCSA-N 0 0 373.453 3.621 20 5 FHBDRN Cc1nc(Sc2nnc(C(C)C)n2Cc2ccco2)ccc1[N+](=O)[O-] ZINC000471611687 931036789 /nfs/dbraw/zinc/03/67/89/931036789.db2.gz CUYMTEUOGKICID-UHFFFAOYSA-N 0 0 359.411 3.806 20 5 FHBDRN COc1cccc(-c2cc(NC(=O)c3cccc([N+](=O)[O-])c3C)n(C)n2)c1 ZINC000119292297 931052233 /nfs/dbraw/zinc/05/22/33/931052233.db2.gz DGAGPNXTXGSGBZ-UHFFFAOYSA-N 0 0 366.377 3.565 20 5 FHBDRN O=C(NC/C=C/c1ccccc1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000537584315 931053650 /nfs/dbraw/zinc/05/36/50/931053650.db2.gz HDQDOMOOGRTTRT-QPJJXVBHSA-N 0 0 361.195 3.801 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)N1CCC[C@H]1c1ccc(O)cc1 ZINC000610456101 931070662 /nfs/dbraw/zinc/07/06/62/931070662.db2.gz LMKULYWJYSVVPL-IBGZPJMESA-N 0 0 369.421 3.856 20 5 FHBDRN O=C(Nc1ccc2nc(-c3ccc(F)cc3)oc2c1)c1c[nH]nc1[N+](=O)[O-] ZINC000579862758 931148629 /nfs/dbraw/zinc/14/86/29/931148629.db2.gz GEVIWSSSLIVCTK-UHFFFAOYSA-N 0 0 367.296 3.518 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[C@](F)(c2ccccc2)C1 ZINC000579862863 931148873 /nfs/dbraw/zinc/14/88/73/931148873.db2.gz PWJMELLNGYPPOC-GOSISDBHSA-N 0 0 359.357 3.706 20 5 FHBDRN COCCOc1ccc(Cl)cc1C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000175860651 931166146 /nfs/dbraw/zinc/16/61/46/931166146.db2.gz SEZVFUHRDLWSAW-UHFFFAOYSA-N 0 0 350.758 3.526 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N(C1CC1)[C@H]1CCc2ccccc21 ZINC000064949306 931192932 /nfs/dbraw/zinc/19/29/32/931192932.db2.gz NOVWFABOSPTDGS-SFHVURJKSA-N 0 0 372.446 3.744 20 5 FHBDRN C[C@H](C(=O)N1CCc2c(cccc2[N+](=O)[O-])C1)c1cn(C)c2ccccc12 ZINC000548135847 931195830 /nfs/dbraw/zinc/19/58/30/931195830.db2.gz LURBYYDLBCJJLI-AWEZNQCLSA-N 0 0 363.417 3.775 20 5 FHBDRN COc1ccc2oc([C@H](C)Nc3cccc(C(N)=O)c3[N+](=O)[O-])c(C)c2c1 ZINC000561200898 931233278 /nfs/dbraw/zinc/23/32/78/931233278.db2.gz OIQZGNPJDHMONW-NSHDSACASA-N 0 0 369.377 3.930 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)c2cnc(-c3ccccn3)s2)cc1[N+](=O)[O-] ZINC000177841904 931262828 /nfs/dbraw/zinc/26/28/28/931262828.db2.gz HAYRDADEFOVTAE-GFCCVEGCSA-N 0 0 368.418 3.913 20 5 FHBDRN COc1ccc(NC(=S)NCCCCCCSC)cc1[N+](=O)[O-] ZINC000782207593 931282217 /nfs/dbraw/zinc/28/22/17/931282217.db2.gz NXAJNFCLFSSTJD-UHFFFAOYSA-N 0 0 357.501 3.813 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)c2ccn(-c3ccccc3F)n2)cc1[N+](=O)[O-] ZINC000177851032 931295277 /nfs/dbraw/zinc/29/52/77/931295277.db2.gz LBKHDHVICLPFIW-ZDUSSCGKSA-N 0 0 368.368 3.719 20 5 FHBDRN COC(=O)c1cc([N+](=O)[O-])c(C)cc1Oc1ccc2c(c1)CCCC(=O)N2 ZINC000561241548 931326091 /nfs/dbraw/zinc/32/60/91/931326091.db2.gz XDXGOPZJMDVOKM-UHFFFAOYSA-N 0 0 370.361 3.757 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)[C@](C)(O)[C@@H](C)c2ccccc2)cc1[N+](=O)[O-] ZINC000177858257 931328682 /nfs/dbraw/zinc/32/86/82/931328682.db2.gz CMDFJUAHSKMSOS-AUSJPIAWSA-N 0 0 356.422 3.635 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)C[C@@H]2OCCc3ccccc32)cc1[N+](=O)[O-] ZINC000177862402 931331312 /nfs/dbraw/zinc/33/13/12/931331312.db2.gz JIEZKNXCOKKLOT-KUHUBIRLSA-N 0 0 354.406 3.785 20 5 FHBDRN Cc1nc(N[C@@H](c2nccn2C)c2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000471628394 931338400 /nfs/dbraw/zinc/33/84/00/931338400.db2.gz MHMJRJKUGUAVST-MRXNPFEDSA-N 0 0 357.801 3.887 20 5 FHBDRN O=C(NCc1ccccc1OCC1CC1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000155917846 931354450 /nfs/dbraw/zinc/35/44/50/931354450.db2.gz MMNCVYMZQIWHQX-UHFFFAOYSA-N 0 0 360.797 3.967 20 5 FHBDRN COc1cccc(C[C@H]2CCCN2C(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000580926725 931358430 /nfs/dbraw/zinc/35/84/30/931358430.db2.gz MGBZRZGBPNUHFL-MAUKXSAKSA-N 0 0 368.433 3.941 20 5 FHBDRN Cc1cc(F)c([N+](=O)[O-])cc1C(=O)NCc1coc(-c2cccs2)n1 ZINC001125479110 931360465 /nfs/dbraw/zinc/36/04/65/931360465.db2.gz MCUCQKHIEHILKR-UHFFFAOYSA-N 0 0 361.354 3.689 20 5 FHBDRN Cc1sc(C(=O)OCc2ncc(Br)s2)cc1[N+](=O)[O-] ZINC000785029358 931372148 /nfs/dbraw/zinc/37/21/48/931372148.db2.gz FCZNFFJZJJUYIN-UHFFFAOYSA-N 0 0 363.214 3.541 20 5 FHBDRN C[C@@H]1CN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C[C@H](C(F)(F)F)O1 ZINC000610468679 931380041 /nfs/dbraw/zinc/38/00/41/931380041.db2.gz BDBGWDGGXYCJCC-RDDDGLTNSA-N 0 0 358.238 3.770 20 5 FHBDRN CC(C)(C)Cc1cc(=NC(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)[nH][nH]1 ZINC000580942786 931382776 /nfs/dbraw/zinc/38/27/76/931382776.db2.gz BXMLKALWUMOFKU-UHFFFAOYSA-N 0 0 370.331 3.600 20 5 FHBDRN O=C(Nc1cccc2cnncc21)c1cc([N+](=O)[O-])ccc1Br ZINC000754586956 931386978 /nfs/dbraw/zinc/38/69/78/931386978.db2.gz YWBNPSSNXWBORA-UHFFFAOYSA-N 0 0 373.166 3.553 20 5 FHBDRN CCOC(=O)/C=C\c1ccc(NC(=O)c2cc(C)ccc2[N+](=O)[O-])cc1 ZINC000255238138 931387311 /nfs/dbraw/zinc/38/73/11/931387311.db2.gz LWDPJSFIQFQTKR-XFFZJAGNSA-N 0 0 354.362 3.732 20 5 FHBDRN C[C@H]1C[C@@H](COC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)CCO1 ZINC000785031521 931399538 /nfs/dbraw/zinc/39/95/38/931399538.db2.gz KYSKSGHVOLQDOL-KBPBESRZSA-N 0 0 351.402 3.653 20 5 FHBDRN CCO[C@@H]1C[C@@H](N(C)C(=O)Cc2ccccc2[N+](=O)[O-])C12CCCCC2 ZINC000610192014 931427144 /nfs/dbraw/zinc/42/71/44/931427144.db2.gz PNCFKWXTHAUUEO-QZTJIDSGSA-N 0 0 360.454 3.724 20 5 FHBDRN O=C(NCc1cccc(OC(F)F)c1)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000050640113 931447811 /nfs/dbraw/zinc/44/78/11/931447811.db2.gz ZLCHRRQQCHJNBN-UHFFFAOYSA-N 0 0 361.304 3.608 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N2CCO[C@@](C)(c3ccccc3)C2)c1 ZINC000156817566 931560224 /nfs/dbraw/zinc/56/02/24/931560224.db2.gz QOSHDYUKQKPBGC-LJQANCHMSA-N 0 0 372.446 3.705 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)NCC1(CCOCc2ccccc2)CC1 ZINC000187372270 931571528 /nfs/dbraw/zinc/57/15/28/931571528.db2.gz SKARKMHNAIFYIN-UHFFFAOYSA-N 0 0 368.433 3.641 20 5 FHBDRN Cc1ccc(Br)cc1CC(=O)OCc1cccc([N+](=O)[O-])c1 ZINC001125485384 931571612 /nfs/dbraw/zinc/57/16/12/931571612.db2.gz KHMVJGFBVDYISL-UHFFFAOYSA-N 0 0 364.195 3.952 20 5 FHBDRN COCCCOc1cccc(C(=O)OCc2cccc([N+](=O)[O-])c2)c1C ZINC001125486036 931588285 /nfs/dbraw/zinc/58/82/85/931588285.db2.gz YCEJDPRUZQYPAB-UHFFFAOYSA-N 0 0 359.378 3.676 20 5 FHBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])C1([C@H]2CCCCO2)CCC1 ZINC001266677577 931606918 /nfs/dbraw/zinc/60/69/18/931606918.db2.gz LBQABWVFPSKGKV-MRXNPFEDSA-N 0 0 366.845 3.646 20 5 FHBDRN Cc1c(C(=O)NCCc2csc(-c3ccccc3)n2)cccc1[N+](=O)[O-] ZINC000096620543 931666488 /nfs/dbraw/zinc/66/64/88/931666488.db2.gz MHAAGWMQJRWOKR-UHFFFAOYSA-N 0 0 367.430 3.999 20 5 FHBDRN Cc1ccc(NCCCNC(=O)Cc2c[nH]c3ccccc23)c([N+](=O)[O-])c1 ZINC000156902731 931689825 /nfs/dbraw/zinc/68/98/25/931689825.db2.gz SCKPXIWXVLHFQS-UHFFFAOYSA-N 0 0 366.421 3.545 20 5 FHBDRN C[C@@H](CCSc1ccccc1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000477029034 931710350 /nfs/dbraw/zinc/71/03/50/931710350.db2.gz HLBBYVXSWNESFF-ZDUSSCGKSA-N 0 0 351.449 3.939 20 5 FHBDRN Cc1ocnc1CNC(=O)c1ccc(SCCC(C)C)c([N+](=O)[O-])c1 ZINC000134411496 931711704 /nfs/dbraw/zinc/71/17/04/931711704.db2.gz LCQRKYLRFNAAEJ-UHFFFAOYSA-N 0 0 363.439 3.959 20 5 FHBDRN COc1cc(OCC(=O)N(C)c2cc(Cl)ccc2C)ccc1[N+](=O)[O-] ZINC000581241819 931727857 /nfs/dbraw/zinc/72/78/57/931727857.db2.gz DVINADMKSFGKSJ-UHFFFAOYSA-N 0 0 364.785 3.607 20 5 FHBDRN O=C(c1ccc(CNc2c(F)cccc2[N+](=O)[O-])cc1)N1CCCCC1 ZINC000581244313 931730932 /nfs/dbraw/zinc/73/09/32/931730932.db2.gz VCUDONHQDHNARU-UHFFFAOYSA-N 0 0 357.385 3.972 20 5 FHBDRN CN(Cc1cccc(Cl)c1Cl)C(=O)c1cc(F)cc([N+](=O)[O-])c1N ZINC000048312932 931733546 /nfs/dbraw/zinc/73/35/46/931733546.db2.gz XUNLUHAIJKRFDB-UHFFFAOYSA-N 0 0 372.183 3.895 20 5 FHBDRN CN(C[C@@H]1CCCO[C@@H]1c1ccccc1)C(=O)c1ccccc1[N+](=O)[O-] ZINC000050867627 931758815 /nfs/dbraw/zinc/75/88/15/931758815.db2.gz YQLDWJLLEHORIS-QFBILLFUSA-N 0 0 354.406 3.835 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NC[C@@H]1[C@@H]2Cc3ccccc3[C@H]12 ZINC000126389882 931784352 /nfs/dbraw/zinc/78/43/52/931784352.db2.gz AYYPEIMSKHDFBL-JZXOWHBKSA-N 0 0 351.406 3.919 20 5 FHBDRN Cc1nc(NC(=O)c2ccc(Br)c(Cl)c2)ccc1[N+](=O)[O-] ZINC000157032795 931801547 /nfs/dbraw/zinc/80/15/47/931801547.db2.gz JJLSJCNOMLWPPI-UHFFFAOYSA-N 0 0 370.590 3.966 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)N1CCCCC[C@@H]1[C@@H]1CCCCC1=O ZINC000126401378 931803324 /nfs/dbraw/zinc/80/33/24/931803324.db2.gz CRVWHPZNSNCROX-ZWKOTPCHSA-N 0 0 358.438 3.668 20 5 FHBDRN CC[C@](C)(NC(=O)Nc1ccc([N+](=O)[O-])cc1OC)c1nccs1 ZINC000156130532 931819334 /nfs/dbraw/zinc/81/93/34/931819334.db2.gz IMXXIDQSPCXWBI-HNNXBMFYSA-N 0 0 350.400 3.507 20 5 FHBDRN COc1ccc(F)c(NC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)c1 ZINC000126448959 931831750 /nfs/dbraw/zinc/83/17/50/931831750.db2.gz QTOKZHGFKLRFHU-UHFFFAOYSA-N 0 0 359.357 3.939 20 5 FHBDRN CC(=O)c1cc(N2C[C@@H](c3ccc(F)cc3)O[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000561334901 931861822 /nfs/dbraw/zinc/86/18/22/931861822.db2.gz IMOBEIWAXIAPHL-BUXKBTBVSA-N 0 0 358.369 3.903 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)NCC(F)(F)c2ccccc2)c1 ZINC000581341249 931862836 /nfs/dbraw/zinc/86/28/36/931862836.db2.gz KCAMXJJNYPSBPS-UHFFFAOYSA-N 0 0 352.362 3.839 20 5 FHBDRN O=c1[nH]c(N[C@@H]2CCC[C@H](c3ccccc3)C2)nc2ccc([N+](=O)[O-])cc21 ZINC000561341470 931883055 /nfs/dbraw/zinc/88/30/55/931883055.db2.gz VBZDVEMNHAHVBV-LSDHHAIUSA-N 0 0 364.405 3.804 20 5 FHBDRN C[C@@H](Nc1ncc(Br)cc1[N+](=O)[O-])c1ccc(Cl)cn1 ZINC000561338247 931890875 /nfs/dbraw/zinc/89/08/75/931890875.db2.gz MVKYLVLNPOEOGZ-SSDOTTSWSA-N 0 0 357.595 3.974 20 5 FHBDRN O=C(c1ccc2cccnn21)N(CC1CC1)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC001125489545 931897105 /nfs/dbraw/zinc/89/71/05/931897105.db2.gz VOAYLKIAVPLYIV-UHFFFAOYSA-N 0 0 370.796 3.953 20 5 FHBDRN CCc1noc([C@@H](C)Sc2nnc(-c3ccc([N+](=O)[O-])cc3)n2CC)n1 ZINC000157146140 931903165 /nfs/dbraw/zinc/90/31/65/931903165.db2.gz RFMOPJSSQYNVPP-SNVBAGLBSA-N 0 0 374.426 3.672 20 5 FHBDRN C[C@@H]1[C@@H](C(=O)Nc2ccnn2-c2ccc([N+](=O)[O-])cc2)[C@H]1c1ccccc1 ZINC000430570074 931904397 /nfs/dbraw/zinc/90/43/97/931904397.db2.gz IEBPTWMGJRAFCP-MJXNMMHHSA-N 0 0 362.389 3.769 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)Nc1ccc(Br)c(F)c1 ZINC000088085822 931909410 /nfs/dbraw/zinc/90/94/10/931909410.db2.gz QVXSLHGNSYHJAJ-UHFFFAOYSA-N 0 0 353.147 3.678 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N[C@H]1c2ccc(F)cc2O[C@@H]1C ZINC000477091418 931909857 /nfs/dbraw/zinc/90/98/57/931909857.db2.gz YQQCLTQXEQDQIT-PIGZYNQJSA-N 0 0 359.357 3.994 20 5 FHBDRN Cc1ccc(C(=O)NC2CCN(c3ccc([N+](=O)[O-])c(C)c3)CC2)s1 ZINC000050954710 931923680 /nfs/dbraw/zinc/92/36/80/931923680.db2.gz UHIHNXUDRWLTOU-UHFFFAOYSA-N 0 0 359.451 3.672 20 5 FHBDRN CCOc1ccc(C(=O)NC(C)(C)c2ccc(F)c(F)c2)cc1[N+](=O)[O-] ZINC000430575122 931927660 /nfs/dbraw/zinc/92/76/60/931927660.db2.gz JWYKFBVFUGPZHA-UHFFFAOYSA-N 0 0 364.348 3.937 20 5 FHBDRN Cc1cccc(F)c1NC(=O)c1ccc(Cn2cc([N+](=O)[O-])cn2)cc1 ZINC001266712662 931944059 /nfs/dbraw/zinc/94/40/59/931944059.db2.gz YFTGMXXABJOVCI-UHFFFAOYSA-N 0 0 354.341 3.539 20 5 FHBDRN Cc1ccc(Cn2nccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000060441190 931945458 /nfs/dbraw/zinc/94/54/58/931945458.db2.gz SGADZVLDJVFWEF-UHFFFAOYSA-N 0 0 360.757 3.647 20 5 FHBDRN Cc1c([N+](=O)[O-])cc(C(=O)Nc2ccccc2OC(C)C)cc1[N+](=O)[O-] ZINC000121315893 931971464 /nfs/dbraw/zinc/97/14/64/931971464.db2.gz DDQXCAHWLFVTTK-UHFFFAOYSA-N 0 0 359.338 3.851 20 5 FHBDRN Cc1cc(OCC(=O)N2CC[C@H](c3ccc(Cl)cc3)C2)ccc1[N+](=O)[O-] ZINC000430587156 931971807 /nfs/dbraw/zinc/97/18/07/931971807.db2.gz UVLMVQVKCGSCAG-HNNXBMFYSA-N 0 0 374.824 3.952 20 5 FHBDRN CCc1ccc([C@@H]2CCCN(C(=O)c3cc([O-])ccc3[N+](=O)[O-])C2)cc1 ZINC000561351159 931972159 /nfs/dbraw/zinc/97/21/59/931972159.db2.gz GNTAHUYYYLGPTB-MRXNPFEDSA-N 0 0 354.406 3.883 20 5 FHBDRN O=C(N[C@@H](c1ccccc1)C1CC1)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000033163414 932025486 /nfs/dbraw/zinc/02/54/86/932025486.db2.gz FNSSNWDGLKDKJY-IBGZPJMESA-N 0 0 362.389 3.662 20 5 FHBDRN C[C@@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1COc2ccccc21 ZINC000165691618 932038172 /nfs/dbraw/zinc/03/81/72/932038172.db2.gz ILZFFKVMTOIILD-MFKMUULPSA-N 0 0 361.785 3.934 20 5 FHBDRN O=C(CN1CC[C@H]1c1cccc(F)c1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000610505744 932040258 /nfs/dbraw/zinc/04/02/58/932040258.db2.gz VRXAQFAHRXPYBC-INIZCTEOSA-N 0 0 363.776 3.773 20 5 FHBDRN O=C(CCn1cnc2ccccc21)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000135187140 932041830 /nfs/dbraw/zinc/04/18/30/932041830.db2.gz BDJIEHMYHRUNKZ-UHFFFAOYSA-N 0 0 364.405 3.526 20 5 FHBDRN Cc1cccc(NC(=O)CN(Cc2ccccc2[N+](=O)[O-])C2CC2)c1C ZINC000135234646 932085906 /nfs/dbraw/zinc/08/59/06/932085906.db2.gz DLMUCCOJGDUQDL-UHFFFAOYSA-N 0 0 353.422 3.815 20 5 FHBDRN Cc1csc([C@H](C)Nc2ncc([N+](=O)[O-])c(C)c2Br)n1 ZINC000165773970 932093551 /nfs/dbraw/zinc/09/35/51/932093551.db2.gz PHJXKFCEMTYCTR-QMMMGPOBSA-N 0 0 357.233 3.999 20 5 FHBDRN CC(C)(NC(=O)COc1ccccc1[N+](=O)[O-])c1cccc(Cl)c1F ZINC000471667002 932157930 /nfs/dbraw/zinc/15/79/30/932157930.db2.gz YOJKWRZMPTVLJU-UHFFFAOYSA-N 0 0 366.776 3.818 20 5 FHBDRN Cc1nn(CCO)c(NCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)c1C ZINC000121396961 932169348 /nfs/dbraw/zinc/16/93/48/932169348.db2.gz MGLIZAOSNVNFIU-UHFFFAOYSA-N 0 0 372.450 3.741 20 5 FHBDRN O=C1[C@H](Sc2ncccc2[N+](=O)[O-])CCCN1c1ccccc1Cl ZINC000126539253 932217172 /nfs/dbraw/zinc/21/71/72/932217172.db2.gz IBCINHANFZQMCL-CQSZACIVSA-N 0 0 363.826 3.931 20 5 FHBDRN COc1c(F)cc(NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)cc1F ZINC000157222859 932261398 /nfs/dbraw/zinc/26/13/98/932261398.db2.gz AZNRTDHOLMTSNN-UHFFFAOYSA-N 0 0 361.304 3.544 20 5 FHBDRN CC(C)c1ccc(C(=O)Nc2c[nH]nc2-c2nccs2)cc1[N+](=O)[O-] ZINC000581615212 932315774 /nfs/dbraw/zinc/31/57/74/932315774.db2.gz GPIWGRSBEWCBGA-UHFFFAOYSA-N 0 0 357.395 3.817 20 5 FHBDRN C[C@@H](NC(=O)N(C[C@H]1CCCO1)C1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000175902674 932320531 /nfs/dbraw/zinc/32/05/31/932320531.db2.gz JARGNJUURLICHO-RDTXWAMCSA-N 0 0 361.442 3.789 20 5 FHBDRN CCn1c2ccccc2nc1[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])o1 ZINC000157320256 932326522 /nfs/dbraw/zinc/32/65/22/932326522.db2.gz PDEHGRVTNDLNMQ-AWEZNQCLSA-N 0 0 354.366 3.535 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1N1CCOC[C@@H]1c1ccco1 ZINC000610516461 932330040 /nfs/dbraw/zinc/33/00/40/932330040.db2.gz REYYRNHMUOMHNJ-CYBMUJFWSA-N 0 0 353.172 3.528 20 5 FHBDRN Cc1ccccc1[C@H]1CN(c2nc3sccn3c2[N+](=O)[O-])[C@@H](C)CO1 ZINC000610516249 932330884 /nfs/dbraw/zinc/33/08/84/932330884.db2.gz MMLODHMFRSNNNW-GXTWGEPZSA-N 0 0 358.423 3.579 20 5 FHBDRN Cc1c([N+](=O)[O-])cc(C(=O)N2CC[C@H](C)c3ccccc32)cc1[N+](=O)[O-] ZINC000075617938 932334335 /nfs/dbraw/zinc/33/43/35/932334335.db2.gz MJYCBUXDIDZZIP-NSHDSACASA-N 0 0 355.350 3.965 20 5 FHBDRN CCc1ccc(CN2CCN(c3cc([N+](=O)[O-])ccc3C(C)=O)CC2)s1 ZINC000581628990 932343687 /nfs/dbraw/zinc/34/36/87/932343687.db2.gz ZDEGUWAYPYAUBK-UHFFFAOYSA-N 0 0 373.478 3.744 20 5 FHBDRN Cc1noc(C2(C)CCN(Cc3cc([N+](=O)[O-])ccc3OC(C)C)CC2)n1 ZINC000510437884 932343821 /nfs/dbraw/zinc/34/38/21/932343821.db2.gz KBGAVDYLFJJZRR-UHFFFAOYSA-N 0 0 374.441 3.627 20 5 FHBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2C[C@H](c3ccccc3)[C@@H]3CCC[C@@H]32)cc1 ZINC000510440195 932358675 /nfs/dbraw/zinc/35/86/75/932358675.db2.gz BQYLCYFJZAHADY-OTWHNJEPSA-N 0 0 372.446 3.552 20 5 FHBDRN CCc1cc(NC(=O)c2ccc3cccnc3c2)c2cc([N+](=O)[O-])ccc2n1 ZINC001266777412 932363213 /nfs/dbraw/zinc/36/32/13/932363213.db2.gz PBWDTMBFNJYGBN-UHFFFAOYSA-N 0 0 372.384 3.928 20 5 FHBDRN CCn1c(CCNC(=O)c2cccc(Cl)c2[N+](=O)[O-])nc2ccccc21 ZINC000175910822 932368616 /nfs/dbraw/zinc/36/86/16/932368616.db2.gz OWCVJQWNXRRHEC-UHFFFAOYSA-N 0 0 372.812 3.590 20 5 FHBDRN CO[C@H]1CC[C@H]1N(C)C(=O)Nc1cc([N+](=O)[O-])cc(C(F)(F)F)c1C ZINC000933345656 932375711 /nfs/dbraw/zinc/37/57/11/932375711.db2.gz MJZNGDOGTCWETC-OLZOCXBDSA-N 0 0 361.320 3.563 20 5 FHBDRN CO[C@H]1CC[C@@H]1N(C)C(=O)Nc1cc([N+](=O)[O-])cc(C(F)(F)F)c1C ZINC000933345660 932375760 /nfs/dbraw/zinc/37/57/60/932375760.db2.gz MJZNGDOGTCWETC-STQMWFEESA-N 0 0 361.320 3.563 20 5 FHBDRN Cc1nc(NC(=O)c2cccc([N+](=O)[O-])c2N)sc1Cc1ccccc1 ZINC000610520397 932377643 /nfs/dbraw/zinc/37/76/43/932377643.db2.gz YUECCGGVKXQZKU-UHFFFAOYSA-N 0 0 368.418 3.785 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)Nc1ccc(C(=O)N(C)C)cc1 ZINC000477188791 932380770 /nfs/dbraw/zinc/38/07/70/932380770.db2.gz FLEMVQGLZXQMKX-UHFFFAOYSA-N 0 0 361.785 3.511 20 5 FHBDRN Cc1cccc([C@H](NC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)C(C)(C)C)c1 ZINC000178094948 932446220 /nfs/dbraw/zinc/44/62/20/932446220.db2.gz WBXBKCWDTCOOKX-KRWDZBQOSA-N 0 0 369.421 3.745 20 5 FHBDRN CCC[C@@H](C)[C@H]1CCCN1C(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000178110107 932514210 /nfs/dbraw/zinc/51/42/10/932514210.db2.gz WTNACHJGKXAPDK-GDBMZVCRSA-N 0 0 356.426 3.821 20 5 FHBDRN CCOc1ccc(C(=O)N2CCC[C@@H](C(F)(F)F)[C@H]2C)cc1[N+](=O)[O-] ZINC000477421717 932574593 /nfs/dbraw/zinc/57/45/93/932574593.db2.gz SLEZQQVIKDPCCC-ZYHUDNBSSA-N 0 0 360.332 3.797 20 5 FHBDRN Cc1ccc(C[C@@H](C)NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)s1 ZINC000126811450 932576734 /nfs/dbraw/zinc/57/67/34/932576734.db2.gz WOHXORBMDWCXPH-GFCCVEGCSA-N 0 0 370.434 3.511 20 5 FHBDRN COc1cccc(Cc2noc(CCCNc3ccc([N+](=O)[O-])cc3)n2)c1 ZINC000544943398 932624479 /nfs/dbraw/zinc/62/44/79/932624479.db2.gz AGKMYJHPDJQLAD-UHFFFAOYSA-N 0 0 368.393 3.622 20 5 FHBDRN CSc1ccc(C(=O)Nc2c3c(nn2C(C)C)CCC3)cc1[N+](=O)[O-] ZINC000471706027 932660328 /nfs/dbraw/zinc/66/03/28/932660328.db2.gz NWYFBTMSKIOWDQ-UHFFFAOYSA-N 0 0 360.439 3.835 20 5 FHBDRN CC1(C)[C@H](OCc2ccccc2)C[C@@H]1NC(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000471705713 932663117 /nfs/dbraw/zinc/66/31/17/932663117.db2.gz LYCMVDYHKBMFQI-RBUKOAKNSA-N 0 0 368.433 3.637 20 5 FHBDRN Cc1ccc2c(c1)N(C(=O)Cc1ccc([N+](=O)[O-])cc1Cl)C[C@@H](C)O2 ZINC000477525001 932670652 /nfs/dbraw/zinc/67/06/52/932670652.db2.gz IMDXRCPLJCCMEO-GFCCVEGCSA-N 0 0 360.797 3.913 20 5 FHBDRN Cc1cc([N+](=O)[O-])cn(CC(=O)c2ccc3c(c2)Cc2ccccc2-3)c1=O ZINC000127311038 932683433 /nfs/dbraw/zinc/68/34/33/932683433.db2.gz QPWYYBAGSBDPLX-UHFFFAOYSA-N 0 0 360.369 3.519 20 5 FHBDRN CCn1nc(C(C)C)cc1C(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000098036197 932686738 /nfs/dbraw/zinc/68/67/38/932686738.db2.gz KTTHLLHMXHVJAY-UHFFFAOYSA-N 0 0 358.442 3.985 20 5 FHBDRN C[C@@H]1CCc2c(F)cccc2[C@@H]1NC(=O)COc1ccccc1[N+](=O)[O-] ZINC000430660297 932697758 /nfs/dbraw/zinc/69/77/58/932697758.db2.gz DAELLFFTCMFXSK-CWTRNNRKSA-N 0 0 358.369 3.553 20 5 FHBDRN COCc1cc([N+](=O)[O-])ccc1NCCOc1ccc(C(F)(F)F)cn1 ZINC000471724535 932714222 /nfs/dbraw/zinc/71/42/22/932714222.db2.gz HVLDICJNRXWKIE-UHFFFAOYSA-N 0 0 371.315 3.646 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)Nc1ncc(C(F)(F)F)s1 ZINC000287155053 932734740 /nfs/dbraw/zinc/73/47/40/932734740.db2.gz MJMGYCOCKGFMGA-UHFFFAOYSA-N 0 0 374.344 3.777 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(Nc2ccc(NC(=O)C(C)C)cc2)c1 ZINC000302058163 932746852 /nfs/dbraw/zinc/74/68/52/932746852.db2.gz ATVOOINCYTVMQY-UHFFFAOYSA-N 0 0 357.366 3.720 20 5 FHBDRN CCOc1c(Cl)cc(CNc2nc(C)ccc2[N+](=O)[O-])cc1OC ZINC000178179167 932762546 /nfs/dbraw/zinc/76/25/46/932762546.db2.gz NFEGAVBURIARHQ-UHFFFAOYSA-N 0 0 351.790 3.971 20 5 FHBDRN CSc1ccncc1NC(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000610544178 932765000 /nfs/dbraw/zinc/76/50/00/932765000.db2.gz UMDYWWRUHSCPFK-VIFPVBQESA-N 0 0 367.814 3.771 20 5 FHBDRN Cc1c(Br)cc(C(=O)Nc2cnn(C(C)C)c2)cc1[N+](=O)[O-] ZINC000121475898 932777151 /nfs/dbraw/zinc/77/71/51/932777151.db2.gz UILHVLWIAYIEQF-UHFFFAOYSA-N 0 0 367.203 3.695 20 5 FHBDRN CC[C@H](OC(=O)C[C@@H]1C(=O)Nc2c1cccc2F)c1cccc([N+](=O)[O-])c1 ZINC001266835745 932811106 /nfs/dbraw/zinc/81/11/06/932811106.db2.gz PAJSYOCWUNJZSI-HOCLYGCPSA-N 0 0 372.352 3.854 20 5 FHBDRN CC[C@H](OC(=O)c1c(Cl)nn(C)c1Cl)c1cccc([N+](=O)[O-])c1 ZINC001266835819 932811273 /nfs/dbraw/zinc/81/12/73/932811273.db2.gz RIVBNQPDGBZSKN-JTQLQIEISA-N 0 0 358.181 3.943 20 5 FHBDRN COc1cc(C(=O)N2CC[C@H](c3ccccc3OC)C2)cc([N+](=O)[O-])c1C ZINC000276644433 932816809 /nfs/dbraw/zinc/81/68/09/932816809.db2.gz MYKOROKFALQPJY-AWEZNQCLSA-N 0 0 370.405 3.550 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 ZINC000022593786 932843220 /nfs/dbraw/zinc/84/32/20/932843220.db2.gz HHTRDYYRIJICRT-SECBINFHSA-N 0 0 365.342 3.761 20 5 FHBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)NCc1csc(-c2ccco2)n1 ZINC000255371828 932848310 /nfs/dbraw/zinc/84/83/10/932848310.db2.gz XVPHCXGNRZFJDD-YVMONPNESA-N 0 0 355.375 3.641 20 5 FHBDRN C[C@H]1CSc2ccccc2N1C(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000430672411 932855392 /nfs/dbraw/zinc/85/53/92/932855392.db2.gz ZUCGANBJOTZGKS-ZDUSSCGKSA-N 0 0 358.419 3.891 20 5 FHBDRN COc1ccc(COc2cccc(Oc3ncccn3)c2)cc1[N+](=O)[O-] ZINC000101541585 932865979 /nfs/dbraw/zinc/86/59/79/932865979.db2.gz IVAXRQSWSOHOCU-UHFFFAOYSA-N 0 0 353.334 3.765 20 5 FHBDRN CCc1ccc(-c2nc(Cc3ccc(OC)c(OC)c3)no2)cc1[N+](=O)[O-] ZINC000178211939 932877391 /nfs/dbraw/zinc/87/73/91/932877391.db2.gz JZNYGRLDHFXNOL-UHFFFAOYSA-N 0 0 369.377 3.815 20 5 FHBDRN Cc1noc(C)c1[C@@H](C)CC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000156422258 932920905 /nfs/dbraw/zinc/92/09/05/932920905.db2.gz DILYXAFYJAXSMB-QMMMGPOBSA-N 0 0 369.324 3.933 20 5 FHBDRN COc1cc(C(C)=O)ccc1OC(=O)C(C)=Cc1ccc([N+](=O)[O-])cc1 ZINC000588435445 932929971 /nfs/dbraw/zinc/92/99/71/932929971.db2.gz NPVWYGUSGSLVAL-BENRWUELSA-N 0 0 355.346 3.815 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1OC(=O)/C(C)=C\c1ccc([N+](=O)[O-])cc1 ZINC000588435709 932934794 /nfs/dbraw/zinc/93/47/94/932934794.db2.gz MQBPHOVQPKKQKP-LUAWRHEFSA-N 0 0 358.306 3.521 20 5 FHBDRN CC(=O)N1CCc2cc(NC(=O)/C(C)=C\c3ccc([N+](=O)[O-])cc3)ccc21 ZINC000588436018 932943174 /nfs/dbraw/zinc/94/31/74/932943174.db2.gz NZSGFKDEYMCDSP-QBFSEMIESA-N 0 0 365.389 3.546 20 5 FHBDRN Cc1ccc(-c2c[nH]cc2C(=O)NCCNc2ccccc2[N+](=O)[O-])s1 ZINC000187486597 932948539 /nfs/dbraw/zinc/94/85/39/932948539.db2.gz AQZNQVHIEAAJPP-UHFFFAOYSA-N 0 0 370.434 3.802 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N2CCCC[C@H]2c2ccc(F)cc2)c1[N+](=O)[O-] ZINC000610923948 932948894 /nfs/dbraw/zinc/94/88/94/932948894.db2.gz WIJTXDGQPUWNRP-AWEZNQCLSA-N 0 0 360.389 3.948 20 5 FHBDRN O=C(c1ccccc1[N+](=O)[O-])N1CCc2sc(Br)cc2C1 ZINC000610935066 932962386 /nfs/dbraw/zinc/96/23/86/932962386.db2.gz HLNKTRIFWQFOIY-UHFFFAOYSA-N 0 0 367.224 3.617 20 5 FHBDRN COc1cc(NC(=O)/C(C)=C\c2ccc([N+](=O)[O-])cc2)ccc1NC(C)=O ZINC000588437002 932966426 /nfs/dbraw/zinc/96/64/26/932966426.db2.gz GKLQKJDVJHEPLK-BENRWUELSA-N 0 0 369.377 3.604 20 5 FHBDRN Cc1ccc(Cl)c(NC(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)c1 ZINC000178244325 932967011 /nfs/dbraw/zinc/96/70/11/932967011.db2.gz HDVYAVCDUXXMQF-UHFFFAOYSA-N 0 0 374.828 3.911 20 5 FHBDRN O=c1c2cc3ccccc3cc2ncn1C[C@@H](O)c1c(F)cccc1F ZINC000051288526 932969513 /nfs/dbraw/zinc/96/95/13/932969513.db2.gz XPUHFUPOEIYRKJ-GOSISDBHSA-N 0 0 352.340 3.562 20 5 FHBDRN COc1ccccc1[C@@H]1CCCCN1CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000610944767 932980059 /nfs/dbraw/zinc/98/00/59/932980059.db2.gz YSDNIPRRHIMKKK-KRWDZBQOSA-N 0 0 369.421 3.769 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)NC2(c3cccc(F)c3)CC2)cc1OC ZINC000156460207 932982840 /nfs/dbraw/zinc/98/28/40/932982840.db2.gz DTBIMWICEBWFCO-UHFFFAOYSA-N 0 0 374.368 3.560 20 5 FHBDRN C[C@@H]1COCCCN1C(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000610948438 932983086 /nfs/dbraw/zinc/98/30/86/932983086.db2.gz FJWRMGYCPWWOEN-CQSZACIVSA-N 0 0 372.446 3.997 20 5 FHBDRN O=C(Nc1ccccc1SC1CCCC1)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC000187553930 933000781 /nfs/dbraw/zinc/00/07/81/933000781.db2.gz MOGDEUJTCRXSDU-UHFFFAOYSA-N 0 0 359.407 3.982 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N1CCCN(c2ccccc2)CC1 ZINC000588437607 933053150 /nfs/dbraw/zinc/05/31/50/933053150.db2.gz JFPGOHJXZPZHOE-MSUUIHNZSA-N 0 0 365.433 3.737 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)NCc1ccc(-n2ccnc2)cc1 ZINC000588437703 933053228 /nfs/dbraw/zinc/05/32/28/933053228.db2.gz YOPTXVPHRIOUDD-QINSGFPZSA-N 0 0 362.389 3.500 20 5 FHBDRN O=C1C[C@H](Nc2ccc(Cl)cc2[N+](=O)[O-])CN1[C@H]1C[C@H]1c1ccccc1 ZINC000463017228 933062723 /nfs/dbraw/zinc/06/27/23/933062723.db2.gz XWSMXIGTNXQULF-ZOBUZTSGSA-N 0 0 371.824 3.817 20 5 FHBDRN C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)O[C@H]([C@H]1CCCO1)C(F)(F)F ZINC000588441093 933071958 /nfs/dbraw/zinc/07/19/58/933071958.db2.gz UBYKEBIRKLKEKO-NPUYYSGSSA-N 0 0 359.300 3.651 20 5 FHBDRN CCN(C(=O)c1ccc(Br)cc1[N+](=O)[O-])c1nc(C)cs1 ZINC000175995740 933075294 /nfs/dbraw/zinc/07/52/94/933075294.db2.gz MBPSNZLLXSWRJY-UHFFFAOYSA-N 0 0 370.228 3.789 20 5 FHBDRN O=C(c1sc(Br)cc1[N+](=O)[O-])N1CC[C@@H]2CCCC[C@@H]21 ZINC000581945001 933095266 /nfs/dbraw/zinc/09/52/66/933095266.db2.gz PZTKWEHAFQATQM-IUCAKERBSA-N 0 0 359.245 3.824 20 5 FHBDRN CN(Cc1ccsc1)C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000610570002 933113126 /nfs/dbraw/zinc/11/31/26/933113126.db2.gz BUIPRIJHKCQCHG-UHFFFAOYSA-N 0 0 355.213 3.691 20 5 FHBDRN O=C(NCCc1ccccc1C(F)(F)F)Nc1cccc([N+](=O)[O-])c1 ZINC000065028943 933151263 /nfs/dbraw/zinc/15/12/63/933151263.db2.gz PBEMMRBSHBQUOX-UHFFFAOYSA-N 0 0 353.300 3.978 20 5 FHBDRN Cc1ccc2c(c1)[C@@H](NC(=O)c1ccc3[nH]c4ccccc4c(=O)c3c1)CO2 ZINC000548378069 933160329 /nfs/dbraw/zinc/16/03/29/933160329.db2.gz LOBHNATUJGUDLO-FQEVSTJZSA-N 0 0 370.408 3.853 20 5 FHBDRN CN(C)c1cccc(CCC(=O)Nc2ccc([N+](=O)[O-])c3ncccc23)c1 ZINC000430710499 933164493 /nfs/dbraw/zinc/16/44/93/933164493.db2.gz SGQVTGMJEGFEHM-UHFFFAOYSA-N 0 0 364.405 3.780 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])c2ncccc12)c1cc2ccccc2c(=O)o1 ZINC000430708357 933168125 /nfs/dbraw/zinc/16/81/25/933168125.db2.gz JDRWEKNADQOVJM-UHFFFAOYSA-N 0 0 361.313 3.502 20 5 FHBDRN CCOC(=O)CC[C@@H]1CCCN(C(=O)/C(C)=C\c2ccc([N+](=O)[O-])cc2)C1 ZINC000588447289 933170076 /nfs/dbraw/zinc/17/00/76/933170076.db2.gz LEAZZOJLTCNTQM-REZBVGGZSA-N 0 0 374.437 3.580 20 5 FHBDRN CCOc1ccc(-c2nc(Cc3ccc(F)cc3F)no2)cc1[N+](=O)[O-] ZINC000544952965 933181096 /nfs/dbraw/zinc/18/10/96/933181096.db2.gz VJTKCSMJXSMWAY-UHFFFAOYSA-N 0 0 361.304 3.913 20 5 FHBDRN CC[C@H](CNC(=O)c1cc([N+](=O)[O-])c[nH]1)Oc1cccc(C(F)(F)F)c1 ZINC000430741109 933192358 /nfs/dbraw/zinc/19/23/58/933192358.db2.gz CZRVSOXLVZGHTG-GFCCVEGCSA-N 0 0 371.315 3.529 20 5 FHBDRN CC(C)c1ccc(CN2C[C@@H](C)O[C@]3(CCO[C@H](C)C3)C2)cc1[N+](=O)[O-] ZINC000430761510 933215290 /nfs/dbraw/zinc/21/52/90/933215290.db2.gz MAVCPGMXDUAKCJ-QINHECLXSA-N 0 0 362.470 3.877 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CCSC2(CCCCC2)C1 ZINC000430771056 933224270 /nfs/dbraw/zinc/22/42/70/933224270.db2.gz AXRCQXWJWSMAHF-UHFFFAOYSA-N 0 0 363.483 3.593 20 5 FHBDRN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1C[C@H](C)O[C@]2(CCO[C@H](C)C2)C1 ZINC000430780863 933233473 /nfs/dbraw/zinc/23/34/73/933233473.db2.gz PPTJTRAFSDEPFE-JTQVLOKQSA-N 0 0 360.454 3.657 20 5 FHBDRN Cc1cc(OCC(=O)N[C@@H](CC(C)(C)C)C(F)(F)F)ccc1[N+](=O)[O-] ZINC000430798441 933237084 /nfs/dbraw/zinc/23/70/84/933237084.db2.gz IICYLCCHRBBYHQ-ZDUSSCGKSA-N 0 0 362.348 3.765 20 5 FHBDRN Cc1cc(OCC(=O)N2[C@H](C)Cc3cc(F)ccc3[C@@H]2C)ccc1[N+](=O)[O-] ZINC000430802217 933238550 /nfs/dbraw/zinc/23/85/50/933238550.db2.gz KKRCOCFWWUBANC-KGLIPLIRSA-N 0 0 372.396 3.956 20 5 FHBDRN Cc1cc(OCC(=O)Nc2cncc(Cl)c2Cl)ccc1[N+](=O)[O-] ZINC000430789804 933239692 /nfs/dbraw/zinc/23/96/92/933239692.db2.gz XTFXJQFRPWXYBL-UHFFFAOYSA-N 0 0 356.165 3.623 20 5 FHBDRN CSc1c(F)cc(NC(=O)COc2ccc([N+](=O)[O-])c(C)c2)cc1F ZINC000430793488 933242508 /nfs/dbraw/zinc/24/25/08/933242508.db2.gz XCTAICWAOMNWFG-UHFFFAOYSA-N 0 0 368.361 3.921 20 5 FHBDRN Cc1ncsc1-c1nc(COc2ccc([N+](=O)[O-])c3ncccc23)no1 ZINC000471863961 933246486 /nfs/dbraw/zinc/24/64/86/933246486.db2.gz GVGLHMRUNHDYJM-UHFFFAOYSA-N 0 0 369.362 3.537 20 5 FHBDRN C[C@H](NS(=O)(=O)c1cccc([N+](=O)[O-])c1)c1ccc(C(F)(F)F)cc1 ZINC000220345067 933249081 /nfs/dbraw/zinc/24/90/81/933249081.db2.gz QUCWMHOKTPEBHL-JTQLQIEISA-N 0 0 374.340 3.653 20 5 FHBDRN CCO[C@H]1C[C@@H](N(C)C(=O)c2ccc(SC)c([N+](=O)[O-])c2)C1(C)C ZINC000127357440 933250904 /nfs/dbraw/zinc/25/09/04/933250904.db2.gz HMCYTRHMSUULGF-CABCVRRESA-N 0 0 352.456 3.592 20 5 FHBDRN Cc1cc(OCC(=O)N(C)c2ccc(F)c(Cl)c2)ccc1[N+](=O)[O-] ZINC000430817282 933258004 /nfs/dbraw/zinc/25/80/04/933258004.db2.gz RKOYJXIHDXJJNQ-UHFFFAOYSA-N 0 0 352.749 3.738 20 5 FHBDRN C/C(=C/c1ccccc1)CN(C)C(=O)COc1ccc([N+](=O)[O-])c(C)c1 ZINC000430826732 933272798 /nfs/dbraw/zinc/27/27/98/933272798.db2.gz XHQVVAOJBOJWDH-PTNGSMBKSA-N 0 0 354.406 3.844 20 5 FHBDRN Cc1c(CNC(=O)CO[C@@H]2CCCc3ccccc32)cccc1[N+](=O)[O-] ZINC000430830106 933276018 /nfs/dbraw/zinc/27/60/18/933276018.db2.gz KTWWAOIJZNDPCY-LJQANCHMSA-N 0 0 354.406 3.614 20 5 FHBDRN Cc1cc(OCC(=O)Nc2cnccc2-c2ccccc2)ccc1[N+](=O)[O-] ZINC000430833396 933276696 /nfs/dbraw/zinc/27/66/96/933276696.db2.gz OTXQSLBBOSPKSI-UHFFFAOYSA-N 0 0 363.373 3.983 20 5 FHBDRN CC(C)(C(=O)NCc1c(F)cc(F)c(F)c1F)c1ccc([N+](=O)[O-])cc1 ZINC000430833810 933276797 /nfs/dbraw/zinc/27/67/97/933276797.db2.gz TYTKYXXLSANLRC-UHFFFAOYSA-N 0 0 370.302 3.745 20 5 FHBDRN O=[N+]([O-])c1ccc(N[C@H](CO)c2ccc(F)cc2)c(Br)c1 ZINC000494047037 933285801 /nfs/dbraw/zinc/28/58/01/933285801.db2.gz GAPDOCXPWRWSDN-CQSZACIVSA-N 0 0 355.163 3.642 20 5 FHBDRN COc1ccc(Cl)c(NC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)c1 ZINC000088375392 933289085 /nfs/dbraw/zinc/28/90/85/933289085.db2.gz RUPGFBQJMKQQLR-UHFFFAOYSA-N 0 0 361.785 3.847 20 5 FHBDRN Cc1cc(OCC(=O)Nc2nc(-c3ccccc3F)co2)ccc1[N+](=O)[O-] ZINC000430836722 933296889 /nfs/dbraw/zinc/29/68/89/933296889.db2.gz FUHVMBKCUUSMLK-UHFFFAOYSA-N 0 0 371.324 3.715 20 5 FHBDRN Cc1cc(OCC(=O)N2C[C@@H](C)Sc3ccccc32)ccc1[N+](=O)[O-] ZINC000430838218 933298128 /nfs/dbraw/zinc/29/81/28/933298128.db2.gz JRROYAHMEFZPFG-CYBMUJFWSA-N 0 0 358.419 3.809 20 5 FHBDRN O=[N+]([O-])c1ccc2oc(CN3CCC[C@@H]3c3ccc4c(c3)OCO4)nc2c1 ZINC000610581420 933319226 /nfs/dbraw/zinc/31/92/26/933319226.db2.gz ZUMLKBJGWKGZJI-OAHLLOKOSA-N 0 0 367.361 3.802 20 5 FHBDRN C[C@@H]1CN(C)c2ccccc2N(Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000610582694 933358802 /nfs/dbraw/zinc/35/88/02/933358802.db2.gz NCPMMHGGFVTFBH-CYBMUJFWSA-N 0 0 352.394 3.829 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1CN1CCO[C@@]2(CCc3ccccc32)C1 ZINC000510660062 933376405 /nfs/dbraw/zinc/37/64/05/933376405.db2.gz CGTIDUFTPHVHRT-NRFANRHFSA-N 0 0 368.433 3.667 20 5 FHBDRN CC[C@H](C)n1ncc(C(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)c1C ZINC000477780650 933390181 /nfs/dbraw/zinc/39/01/81/933390181.db2.gz AEXGTJMXUVEFKW-ZDUSSCGKSA-N 0 0 356.426 3.876 20 5 FHBDRN CC1(c2ccccc2)CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000510703554 933461895 /nfs/dbraw/zinc/46/18/95/933461895.db2.gz OLXZKLBZPMUNRX-UHFFFAOYSA-N 0 0 356.397 3.857 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)Nc1cccc(OC[C@@H]2CCCO2)c1 ZINC000510712216 933487742 /nfs/dbraw/zinc/48/77/42/933487742.db2.gz GVZPRKCEKMQJTO-KRWDZBQOSA-N 0 0 356.378 3.713 20 5 FHBDRN Cc1csc(Oc2ccc(NC(=O)c3cc([N+](=O)[O-])c[nH]3)cc2F)n1 ZINC000548408377 933503454 /nfs/dbraw/zinc/50/34/54/933503454.db2.gz KNLFSQOBUCBHNE-UHFFFAOYSA-N 0 0 362.342 3.872 20 5 FHBDRN Cc1cc(OCc2cccc(F)c2)ccc1NC(=O)c1c[nH]nc1[N+](=O)[O-] ZINC000548414321 933538433 /nfs/dbraw/zinc/53/84/33/933538433.db2.gz KYWJMMLLPQELON-UHFFFAOYSA-N 0 0 370.340 3.597 20 5 FHBDRN COc1ccc(C)cc1[C@H](C)NC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000121598928 933548868 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FHBDRN Cc1ccc(-c2noc(-c3cnc([C@@H]4CCCO4)s3)n2)cc1[N+](=O)[O-] ZINC000545574732 945096287 /nfs/dbraw/zinc/09/62/87/945096287.db2.gz DRIDKMVPBHMAOM-LBPRGKRZSA-N 0 0 358.379 3.928 20 5 FHBDRN Cc1ccsc1CCNC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000540197282 935380215 /nfs/dbraw/zinc/38/02/15/935380215.db2.gz FYCGWLXFLAFSAQ-UHFFFAOYSA-N 0 0 369.240 3.700 20 5 FHBDRN CN(CC1(c2ccccc2)CC1)C(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000187725380 935391783 /nfs/dbraw/zinc/39/17/83/935391783.db2.gz MTTUSBITDGLJTD-UHFFFAOYSA-N 0 0 353.422 3.511 20 5 FHBDRN O=[N+]([O-])c1ccccc1CN1CCCC[C@H]1c1nnc([C@H]2CCCO2)o1 ZINC000287595525 935394560 /nfs/dbraw/zinc/39/45/60/935394560.db2.gz YNLLIXUMUQAXKK-JKSUJKDBSA-N 0 0 358.398 3.557 20 5 FHBDRN Cc1ccc(CNC(=O)Nc2ccc(C)c([N+](=O)[O-])c2)c(N2CCCC2)n1 ZINC000611582622 935419798 /nfs/dbraw/zinc/41/97/98/935419798.db2.gz KQNIRLFYFGMMNI-UHFFFAOYSA-N 0 0 369.425 3.529 20 5 FHBDRN Cc1cc(N(Cc2ccccc2[N+](=O)[O-])C2CC2)nc(-c2cccnc2)n1 ZINC000119993362 935425946 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O=C(OCCOc1ccccc1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000051552367 935465224 /nfs/dbraw/zinc/46/52/24/935465224.db2.gz ZFLPDWMKCMEOMY-UHFFFAOYSA-N 0 0 370.386 3.954 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)c1nc(-c2ccncc2OC)no1 ZINC000582267447 935468751 /nfs/dbraw/zinc/46/87/51/935468751.db2.gz SPJSEELNSVGLEB-CYBMUJFWSA-N 0 0 354.366 3.785 20 5 FHBDRN C/C(=C/C(=O)N1CCO[C@H](c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000785123714 935486577 /nfs/dbraw/zinc/48/65/77/935486577.db2.gz IUPLIASTJLSUJK-ZDRDQBANSA-N 0 0 352.390 3.598 20 5 FHBDRN Cc1c(CO)cc([N+](=O)[O-])c(N(C)Cc2cccc(Cl)c2)c1[N+](=O)[O-] ZINC000072294642 935487773 /nfs/dbraw/zinc/48/77/73/935487773.db2.gz CGENZEHRYLLAHH-UHFFFAOYSA-N 0 0 365.773 3.594 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H](OC(F)F)C1 ZINC000611586026 935521002 /nfs/dbraw/zinc/52/10/02/935521002.db2.gz KZBCLTUXXWCWBT-LLVKDONJSA-N 0 0 360.382 3.551 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000120071285 935525996 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Cc1ccc(Cl)cc1NC(=O)CN(C)CCc1ccccc1[N+](=O)[O-] ZINC000511105635 935582543 /nfs/dbraw/zinc/58/25/43/935582543.db2.gz FHIZUBFMFBWHHZ-UHFFFAOYSA-N 0 0 361.829 3.670 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N(C)[C@H](C)Cc1ccc(O)cc1 ZINC000120084864 935582571 /nfs/dbraw/zinc/58/25/71/935582571.db2.gz FLLTUOHFABZHDZ-ZIAGYGMSSA-N 0 0 374.462 3.871 20 5 FHBDRN O=C(c1cc2cccc([N+](=O)[O-])c2[nH]1)N1CC[C@@H](c2ccc(F)cc2)C1 ZINC000478207777 935592241 /nfs/dbraw/zinc/59/22/41/935592241.db2.gz KZMGKWMRJIJGPX-CQSZACIVSA-N 0 0 353.353 3.845 20 5 FHBDRN O=[N+]([O-])c1cnc(Nc2cnn(-c3cnc4ccccc4n3)c2)c(Cl)c1 ZINC000516669042 945111041 /nfs/dbraw/zinc/11/10/41/945111041.db2.gz KQMWKADWYCAPIP-UHFFFAOYSA-N 0 0 367.756 3.516 20 5 FHBDRN COc1cc(C(=O)N[C@H](C)c2ccc(F)cc2F)cc([N+](=O)[O-])c1C ZINC000478281584 935605827 /nfs/dbraw/zinc/60/58/27/935605827.db2.gz MHCPILWRAIZGRR-SNVBAGLBSA-N 0 0 350.321 3.681 20 5 FHBDRN O=[N+]([O-])c1ccc(OCCSc2nc3cc(Cl)cnc3[nH]2)cc1 ZINC000519106804 945111951 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ZINC000472239508 935915610 /nfs/dbraw/zinc/91/56/10/935915610.db2.gz KUWVAOJMICZMNU-MRXNPFEDSA-N 0 0 356.422 3.749 20 5 FHBDRN Cc1c2cc(C)ccc2[nH]c1C(=O)NCCNc1ccccc1[N+](=O)[O-] ZINC000479927501 935918669 /nfs/dbraw/zinc/91/86/69/935918669.db2.gz DJULXNRDABZMSE-UHFFFAOYSA-N 0 0 352.394 3.535 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)N[C@H](C)CCc2cccn2C)cc1[N+](=O)[O-] ZINC000176352046 935921120 /nfs/dbraw/zinc/92/11/20/935921120.db2.gz GXTUKEMTHPKZOS-CABCVRRESA-N 0 0 358.442 3.623 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)N[C@H](C)CCc2cccn2C)cc1[N+](=O)[O-] ZINC000176352032 935921139 /nfs/dbraw/zinc/92/11/39/935921139.db2.gz GXTUKEMTHPKZOS-HUUCEWRRSA-N 0 0 358.442 3.623 20 5 FHBDRN O=C(CCn1ccc2cc(Cl)ccc21)NCCc1ccccc1[N+](=O)[O-] ZINC000548751382 935938787 /nfs/dbraw/zinc/93/87/87/935938787.db2.gz HSZWLMFSNITKTN-UHFFFAOYSA-N 0 0 371.824 3.952 20 5 FHBDRN CCOCCOCc1cccc(Nc2ncnc3ccc([N+](=O)[O-])cc32)c1 ZINC000611700277 935939639 /nfs/dbraw/zinc/93/96/39/935939639.db2.gz FYLBPOCJFNCMDJ-UHFFFAOYSA-N 0 0 368.393 3.835 20 5 FHBDRN C[C@@]1(CCc2ccccc2)CCN(CC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC001167599248 935945875 /nfs/dbraw/zinc/94/58/75/935945875.db2.gz RGPWVSPRXQBQDW-OAQYLSRUSA-N 0 0 367.449 3.878 20 5 FHBDRN COc1cc(C(=O)N2CCCc3c(F)cc(F)cc32)cc([N+](=O)[O-])c1C ZINC000480029037 935946645 /nfs/dbraw/zinc/94/66/45/935946645.db2.gz JOFPYWIWKYDAKZ-UHFFFAOYSA-N 0 0 362.332 3.783 20 5 FHBDRN Cc1ccc(-c2csc(NC(=O)[C@@H]3CCCOCC3)n2)cc1[N+](=O)[O-] ZINC000375729558 935948620 /nfs/dbraw/zinc/94/86/20/935948620.db2.gz GSRSAXYIEGRPKI-GFCCVEGCSA-N 0 0 361.423 3.782 20 5 FHBDRN O=[N+]([O-])c1ccc2ncnc(N3CCC[C@H]3Cc3ccc(F)cc3)c2c1 ZINC000611706953 935949515 /nfs/dbraw/zinc/94/95/15/935949515.db2.gz CQEVBPIQDAFFBI-HNNXBMFYSA-N 0 0 352.369 3.889 20 5 FHBDRN C[C@H](Nc1ncnc2ccc([N+](=O)[O-])cc21)[C@H]1Oc2ccccc2[C@H]1C ZINC000611708297 935950113 /nfs/dbraw/zinc/95/01/13/935950113.db2.gz NANIMVBYADTYBA-SOZUMNATSA-N 0 0 350.378 3.903 20 5 FHBDRN O=[N+]([O-])c1ccc2ncnc(NCc3ccc(Oc4ccccc4)nc3)c2c1 ZINC000611709307 935957472 /nfs/dbraw/zinc/95/74/72/935957472.db2.gz HIOGIXMNRGSFTB-UHFFFAOYSA-N 0 0 373.372 3.759 20 5 FHBDRN COC(=O)c1cc(NC[C@@H](C[C@H](C)O)c2ccccc2)cc(C)c1[N+](=O)[O-] ZINC000582698581 935958182 /nfs/dbraw/zinc/95/81/82/935958182.db2.gz QYZICOSSCUQNNF-GOEBONIOSA-N 0 0 372.421 3.656 20 5 FHBDRN COCCCCN(Cc1ccccc1)c1ncnc2ccc([N+](=O)[O-])cc21 ZINC000611710417 935965532 /nfs/dbraw/zinc/96/55/32/935965532.db2.gz ACKVMYZJBVPNCZ-UHFFFAOYSA-N 0 0 366.421 3.971 20 5 FHBDRN O=[N+]([O-])c1ccccc1CN(Cc1noc(Cc2ccccc2)n1)C1CC1 ZINC000135219534 935982478 /nfs/dbraw/zinc/98/24/78/935982478.db2.gz QZBSISJXJCDAGG-UHFFFAOYSA-N 0 0 364.405 3.733 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)Nc1cccc(-n2cccn2)c1 ZINC000480120386 935983281 /nfs/dbraw/zinc/98/32/81/935983281.db2.gz FYRHNTSYNKJPGR-UHFFFAOYSA-N 0 0 365.393 3.611 20 5 FHBDRN Cc1cc(Sc2nnc(-c3ccco3)n2CC(C)C)ncc1[N+](=O)[O-] ZINC000074738515 935987343 /nfs/dbraw/zinc/98/73/43/935987343.db2.gz FLQXTNRYVBFIGD-UHFFFAOYSA-N 0 0 359.411 3.957 20 5 FHBDRN CC[C@@H]1c2ccsc2CCN1C(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000074763964 935988393 /nfs/dbraw/zinc/98/83/93/935988393.db2.gz XHXXKSPCHUAEEE-OAHLLOKOSA-N 0 0 359.451 3.918 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H](n2ccnc2)C1 ZINC000611555923 935988655 /nfs/dbraw/zinc/98/86/55/935988655.db2.gz LAVITBFWKJJBFJ-OAHLLOKOSA-N 0 0 374.466 3.771 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)N1CCOC[C@H]1C1CCC1 ZINC000582723948 935990188 /nfs/dbraw/zinc/99/01/88/935990188.db2.gz SSXDNUSNCLQHAP-AWEZNQCLSA-N 0 0 373.331 3.646 20 5 FHBDRN O=[N+]([O-])c1ccc2ncnc(N3CCCC[C@H]3c3noc(C4CC4)n3)c2c1 ZINC000611710738 935998300 /nfs/dbraw/zinc/99/83/00/935998300.db2.gz VEIVNVJQYMGSEC-HNNXBMFYSA-N 0 0 366.381 3.530 20 5 FHBDRN Cc1nc(-c2ccccc2NC(=O)/C=C/c2ccccc2[N+](=O)[O-])no1 ZINC000076162832 936023952 /nfs/dbraw/zinc/02/39/52/936023952.db2.gz CJAWXYULDHJBND-ZHACJKMWSA-N 0 0 350.334 3.605 20 5 FHBDRN CC(C)COC[C@H](Nc1ncnc2ccc([N+](=O)[O-])cc21)c1ccco1 ZINC000611711641 936031505 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COc1cc(NC[C@H](c2c(F)cccc2F)N(C)C)ccc1[N+](=O)[O-] ZINC000078262161 936078094 /nfs/dbraw/zinc/07/80/94/936078094.db2.gz MGAAFGSDCZKGLZ-OAHLLOKOSA-N 0 0 351.353 3.596 20 5 FHBDRN CCc1cc(N2CCC[C@H](OC)CC2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000611930997 936092765 /nfs/dbraw/zinc/09/27/65/936092765.db2.gz AGHZQSUNOKDJIW-KRWDZBQOSA-N 0 0 356.426 3.620 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NCc1ccc(COC)cc1 ZINC000135674322 936097772 /nfs/dbraw/zinc/09/77/72/936097772.db2.gz ZCAZTZXUWIXSLI-UHFFFAOYSA-N 0 0 360.435 3.783 20 5 FHBDRN CCc1c(NC(=O)c2ccc([N+](=O)[O-])c(OC)c2)cnn1CCC(C)C ZINC000277889243 936101852 /nfs/dbraw/zinc/10/18/52/936101852.db2.gz QJPPZFGBFHHHJN-UHFFFAOYSA-N 0 0 360.414 3.661 20 5 FHBDRN O=[N+]([O-])c1ccc(OCc2noc(-c3ccc(F)cc3F)n2)c(F)c1 ZINC000187818817 936107551 /nfs/dbraw/zinc/10/75/51/936107551.db2.gz VNHYCWXURPALGZ-UHFFFAOYSA-N 0 0 351.240 3.641 20 5 FHBDRN CCc1ccc(C(=O)NCCc2ccccc2OC(F)F)cc1[N+](=O)[O-] ZINC000472260478 936123568 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CCc1ccc([C@@H]2CCN(c3nc4ccc([N+](=O)[O-])cc4c(=O)[nH]3)C2)cc1 ZINC000431491352 936162288 /nfs/dbraw/zinc/16/22/88/936162288.db2.gz UKKOZKAFQWZZJM-OAHLLOKOSA-N 0 0 364.405 3.800 20 5 FHBDRN Cc1c(CC(=O)N[C@H](c2ccccc2)c2ccncc2)cccc1[N+](=O)[O-] ZINC000178675954 936166309 /nfs/dbraw/zinc/16/63/09/936166309.db2.gz OUDAEOJVAHIHDO-OAQYLSRUSA-N 0 0 361.401 3.747 20 5 FHBDRN CC(C)n1cc2cc(NC(=O)CNc3ccccc3[N+](=O)[O-])ccc2n1 ZINC000135250736 936181759 /nfs/dbraw/zinc/18/17/59/936181759.db2.gz FVGPOOPHPJLCAV-UHFFFAOYSA-N 0 0 353.382 3.576 20 5 FHBDRN COc1cc(Cc2noc([C@@H](c3cccnc3)C(C)C)n2)ccc1[N+](=O)[O-] ZINC000582837786 936202329 /nfs/dbraw/zinc/20/23/29/936202329.db2.gz DUSUDVLWBUEXFS-GOSISDBHSA-N 0 0 368.393 3.760 20 5 FHBDRN Cc1cc(F)cc(C(=O)NCC2(c3ccccc3)CCOCC2)c1[N+](=O)[O-] ZINC000176750622 936202486 /nfs/dbraw/zinc/20/24/86/936202486.db2.gz UWFBNXATSARNDG-UHFFFAOYSA-N 0 0 372.396 3.521 20 5 FHBDRN CSc1ccc(C(=O)NCCCSc2ccccn2)cc1[N+](=O)[O-] ZINC000511207796 936216019 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CCOc1ccc([C@@H]2C[C@H]2NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000437237237 945161451 /nfs/dbraw/zinc/16/14/51/945161451.db2.gz YTJYSXQBZPOOKY-JKSUJKDBSA-N 0 0 360.797 3.933 20 5 FHBDRN O=C(c1cccc([N+](=O)[O-])c1)N1CCn2c(cc3cc(Cl)ccc32)C1 ZINC000427177062 945161770 /nfs/dbraw/zinc/16/17/70/945161770.db2.gz GAFVOYWLEUBCPX-UHFFFAOYSA-N 0 0 355.781 3.859 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)N(C)[C@@H](C)c2cccc(C(F)(F)F)c2)n1 ZINC000427176930 945161811 /nfs/dbraw/zinc/16/18/11/945161811.db2.gz WSARVRWGGBRNOP-JTQLQIEISA-N 0 0 370.331 3.663 20 5 FHBDRN Cc1ccc(C(=O)N(C)Cc2ccccc2N2CCCC2)cc1[N+](=O)[O-] ZINC000052398317 938280521 /nfs/dbraw/zinc/28/05/21/938280521.db2.gz IBNBROXFZZTLMY-UHFFFAOYSA-N 0 0 353.422 3.776 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCOC(C)(C)C1 ZINC000161753168 938290125 /nfs/dbraw/zinc/29/01/25/938290125.db2.gz OOTSVZBZOOREHU-LBPRGKRZSA-N 0 0 352.456 3.784 20 5 FHBDRN COc1cccc(OC)c1OCCCCN1CCc2c1cccc2[N+](=O)[O-] ZINC000583528567 938293087 /nfs/dbraw/zinc/29/30/87/938293087.db2.gz AJMBGGLCPQLMSJ-UHFFFAOYSA-N 0 0 372.421 3.834 20 5 FHBDRN CCCOc1ccc(Cl)cc1NC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 ZINC000102234667 938298473 /nfs/dbraw/zinc/29/84/73/938298473.db2.gz UKAVBWQFPLLSJQ-UHFFFAOYSA-N 0 0 366.805 3.607 20 5 FHBDRN CN(Cc1cccc2ccccc21)c1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000052427149 938301802 /nfs/dbraw/zinc/30/18/02/938301802.db2.gz QEXKQZINXBMRNW-UHFFFAOYSA-N 0 0 370.430 3.788 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N1CC(C)(C)[C@H]1c1cccnc1 ZINC000583566482 938307004 /nfs/dbraw/zinc/30/70/04/938307004.db2.gz MTCWWPHCSJAZMU-QGZVFWFLSA-N 0 0 355.394 3.612 20 5 FHBDRN CC(C)Oc1nc(N2CC[C@@H](COCc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000583575011 938308080 /nfs/dbraw/zinc/30/80/80/938308080.db2.gz PRSBEZHSGRSDQP-QGZVFWFLSA-N 0 0 371.437 3.820 20 5 FHBDRN C[C@]1(C(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)CCc2ccccc2C1 ZINC000536077113 938309566 /nfs/dbraw/zinc/30/95/66/938309566.db2.gz YOOAWIVZERVWJM-NRFANRHFSA-N 0 0 350.418 3.675 20 5 FHBDRN Cc1nc(C2CC2)oc1C(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000278330682 938310014 /nfs/dbraw/zinc/31/00/14/938310014.db2.gz DMNWYIJXXVEPCR-UHFFFAOYSA-N 0 0 369.299 3.717 20 5 FHBDRN CSc1cccc(-c2nc(-c3ccc4nccnc4c3)no2)c1[N+](=O)[O-] ZINC000583590510 938311133 /nfs/dbraw/zinc/31/11/33/938311133.db2.gz SXGGIPXJRXEHPP-UHFFFAOYSA-N 0 0 365.374 3.977 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(Cc2noc(-c3cnc(C4CC4)s3)n2)c1 ZINC000583603921 938318191 /nfs/dbraw/zinc/31/81/91/938318191.db2.gz LAVHPLKGPMNXEK-UHFFFAOYSA-N 0 0 358.379 3.578 20 5 FHBDRN COc1ccc2c(c1)nc(CNc1ccnc3c1cccc3[N+](=O)[O-])n2C ZINC000432132876 945164500 /nfs/dbraw/zinc/16/45/00/945164500.db2.gz ILCLQEROHHTGAO-UHFFFAOYSA-N 0 0 363.377 3.650 20 5 FHBDRN CCCCN(C)C(=O)C1CCN(c2ccc([N+](=O)[O-])c3cccnc32)CC1 ZINC000052473089 938322322 /nfs/dbraw/zinc/32/23/22/938322322.db2.gz RZLWVOOQCBUQPD-UHFFFAOYSA-N 0 0 370.453 3.618 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)NCCCSc2ccccn2)c1 ZINC000511241361 938322767 /nfs/dbraw/zinc/32/27/67/938322767.db2.gz KCHUDWGPNLYVFA-UHFFFAOYSA-N 0 0 363.464 3.624 20 5 FHBDRN C[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000245957800 938326812 /nfs/dbraw/zinc/32/68/12/938326812.db2.gz MDOLVNTWPFCWTO-JTNHKYCSSA-N 0 0 354.353 3.989 20 5 FHBDRN COc1ccccc1CC(=O)Nc1cc(C)nc2ccc([N+](=O)[O-])cc21 ZINC000161804931 938330882 /nfs/dbraw/zinc/33/08/82/938330882.db2.gz BVSCJUVJRSFDLU-UHFFFAOYSA-N 0 0 351.362 3.641 20 5 FHBDRN COc1cccc(CC(=O)Nc2cc(C)nc3ccc([N+](=O)[O-])cc32)c1 ZINC000161803372 938330943 /nfs/dbraw/zinc/33/09/43/938330943.db2.gz WCRMMADUDVJRHJ-UHFFFAOYSA-N 0 0 351.362 3.641 20 5 FHBDRN C[C@@H]1CCN(C(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)C[C@@H](C)C1 ZINC000583667425 938352132 /nfs/dbraw/zinc/35/21/32/938352132.db2.gz FBUBCIXAFFBWHH-KGLIPLIRSA-N 0 0 358.442 3.696 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)c1ccc(OC(F)(F)F)cc1 ZINC000572994048 938355859 /nfs/dbraw/zinc/35/58/59/938355859.db2.gz KSUCTROZGVIOKU-UHFFFAOYSA-N 0 0 368.311 3.808 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1Cl)N1CCO[C@@H](c2ccsc2)C1 ZINC000163391838 938362280 /nfs/dbraw/zinc/36/22/80/938362280.db2.gz QDWPZSCFVRUXFS-CQSZACIVSA-N 0 0 352.799 3.523 20 5 FHBDRN CCOc1cc(C(=O)N(C)c2ccc3cc[nH]c3c2)c([N+](=O)[O-])cc1OC ZINC000473578864 945168480 /nfs/dbraw/zinc/16/84/80/945168480.db2.gz SNDZXSXRBSKYMA-UHFFFAOYSA-N 0 0 369.377 3.760 20 5 FHBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@@H](c2ccccc2)C2CCCC2)cc1 ZINC000519162273 945168972 /nfs/dbraw/zinc/16/89/72/945168972.db2.gz YWGJQTHMLVKEPI-SFHVURJKSA-N 0 0 360.435 3.805 20 5 FHBDRN CS(=O)(=O)c1ccc(N2CC3(CCC3)[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000432135064 945169234 /nfs/dbraw/zinc/16/92/34/945169234.db2.gz XLIGRTAYRGGUFG-SFHVURJKSA-N 0 0 372.446 3.730 20 5 FHBDRN C[C@H]1CO[C@@H](c2ccccc2Cl)CN1c1ncc([N+](=O)[O-])cc1F ZINC000583739484 938386232 /nfs/dbraw/zinc/38/62/32/938386232.db2.gz KKOBLFFYDXPPOY-ZUZCIYMTSA-N 0 0 351.765 3.749 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(OCC(=O)N[C@@H](c2ccc(C)cc2)C2CC2)c1 ZINC000583752002 938390735 /nfs/dbraw/zinc/39/07/35/938390735.db2.gz MCCRJBTWMSAJCW-FQEVSTJZSA-N 0 0 370.405 3.558 20 5 FHBDRN CSc1ccc(NC(=O)[C@@H](C)N(C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000046599477 938396111 /nfs/dbraw/zinc/39/61/11/938396111.db2.gz NENJRSNOYLWRTC-CYBMUJFWSA-N 0 0 359.451 3.776 20 5 FHBDRN COc1cccc2c1N(Cc1nc(-c3ccc([N+](=O)[O-])cc3)no1)CCC2 ZINC000052584494 938407619 /nfs/dbraw/zinc/40/76/19/938407619.db2.gz ADVCADXBGPQDSF-UHFFFAOYSA-N 0 0 366.377 3.606 20 5 FHBDRN CS[C@@H]1CCCCN([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000246979506 938424981 /nfs/dbraw/zinc/42/49/81/938424981.db2.gz VVIFPAPWOLEHKK-DGCLKSJQSA-N 0 0 371.890 3.793 20 5 FHBDRN CCCCCc1nnc(NC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)s1 ZINC000052605511 938433456 /nfs/dbraw/zinc/43/34/56/938433456.db2.gz FWPPKHJQCXSCQP-UHFFFAOYSA-N 0 0 359.411 3.913 20 5 FHBDRN CC(=O)N1CCN(c2c3ccccc3ncc2[N+](=O)[O-])CC12CCCCC2 ZINC000583847977 938447815 /nfs/dbraw/zinc/44/78/15/938447815.db2.gz QCQCPUFJDLGSEL-UHFFFAOYSA-N 0 0 368.437 3.514 20 5 FHBDRN Cc1cc(N[C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])ccc1C(N)=O ZINC000437259857 945175763 /nfs/dbraw/zinc/17/57/63/945175763.db2.gz OZUIESGZNUGJEO-KSSFIOAISA-N 0 0 353.422 3.825 20 5 FHBDRN COc1c(-c2nc(-c3cccnc3OC(C)C)no2)cccc1[N+](=O)[O-] ZINC000583863746 938457085 /nfs/dbraw/zinc/45/70/85/938457085.db2.gz BFGWYZMQUVBIQY-UHFFFAOYSA-N 0 0 356.338 3.503 20 5 FHBDRN COC(=O)CCCSc1cc(C(F)(F)C(F)(F)F)ncc1[N+](=O)[O-] ZINC000278472672 938458976 /nfs/dbraw/zinc/45/89/76/938458976.db2.gz NYRBXJCNNLXHAU-UHFFFAOYSA-N 0 0 374.287 3.689 20 5 FHBDRN C[C@H]1C[C@@H](CNC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)CCO1 ZINC000536149603 938459624 /nfs/dbraw/zinc/45/96/24/938459624.db2.gz HMBXPVPVOHICNX-GJZGRUSLSA-N 0 0 370.405 3.932 20 5 FHBDRN Cc1ccccc1C(C)(C)NC(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000458707256 938459842 /nfs/dbraw/zinc/45/98/42/938459842.db2.gz OTQKOXWVKFBTIO-UHFFFAOYSA-N 0 0 367.409 3.514 20 5 FHBDRN CC1(C)CC[C@@H](NC(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C1 ZINC000426214652 945176817 /nfs/dbraw/zinc/17/68/17/945176817.db2.gz ITSWDGJYHSHQLT-GFCCVEGCSA-N 0 0 359.348 3.992 20 5 FHBDRN CSc1ccc(C(=O)N2CCCc3c([N+](=O)[O-])cccc32)cc1[N+](=O)[O-] ZINC000161929071 938464258 /nfs/dbraw/zinc/46/42/58/938464258.db2.gz ZZZOVDVREHIPTF-UHFFFAOYSA-N 0 0 373.390 3.818 20 5 FHBDRN Cc1cc(OCC(=O)Nc2c(F)cccc2F)c(Cl)cc1[N+](=O)[O-] ZINC000506421810 945177951 /nfs/dbraw/zinc/17/79/51/945177951.db2.gz LVFISLPZAAFOFI-UHFFFAOYSA-N 0 0 356.712 3.852 20 5 FHBDRN CCS[C@@H]1CCCC[C@H]1NC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000427208124 945177431 /nfs/dbraw/zinc/17/74/31/945177431.db2.gz BBYKXGHCQPFPRN-RHSMWYFYSA-N 0 0 374.466 3.575 20 5 FHBDRN CN(C[C@@H]1CCCOC1)c1cc(C(F)(F)C(F)(F)F)ncc1[N+](=O)[O-] ZINC000278510041 938492595 /nfs/dbraw/zinc/49/25/95/938492595.db2.gz RGUWPDXPUMAQOZ-VIFPVBQESA-N 0 0 369.290 3.507 20 5 FHBDRN CC(C)(CNC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F)c1ccccc1F ZINC000583957247 938500977 /nfs/dbraw/zinc/50/09/77/938500977.db2.gz QSYMFWNSVUITMY-UHFFFAOYSA-N 0 0 366.339 3.649 20 5 FHBDRN O=C(CCc1c(Cl)cccc1[N+](=O)[O-])N1CCC[C@H]1[C@@H]1CCCC1=O ZINC000935142650 938501372 /nfs/dbraw/zinc/50/13/72/938501372.db2.gz MPJMRMGOTMPRSM-ZFWWWQNUSA-N 0 0 364.829 3.541 20 5 FHBDRN Cc1cnccc1OC1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000278525537 938503367 /nfs/dbraw/zinc/50/33/67/938503367.db2.gz GWTOBFWIYPWGIZ-UHFFFAOYSA-N 0 0 374.372 3.513 20 5 FHBDRN COC(=O)C(C)(C)c1ccc(NCc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1 ZINC000278542539 938519271 /nfs/dbraw/zinc/51/92/71/938519271.db2.gz XNAJMVHQWWIYSD-UHFFFAOYSA-N 0 0 373.365 3.566 20 5 FHBDRN COc1ccc(CN(C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1O ZINC000128159293 938519906 /nfs/dbraw/zinc/51/99/06/938519906.db2.gz CAARZTOJSOSRHC-UHFFFAOYSA-N 0 0 365.773 3.626 20 5 FHBDRN CCOC(=O)C(C)(C)C1CCN(c2ccnc3c2cccc3[N+](=O)[O-])CC1 ZINC000432142086 945184377 /nfs/dbraw/zinc/18/43/77/945184377.db2.gz XYGIXGOLMTYOEP-UHFFFAOYSA-N 0 0 371.437 3.949 20 5 FHBDRN CCOc1cc(Nc2ccc(OCCOC)c(F)c2)ccc1[N+](=O)[O-] ZINC000536183561 938527821 /nfs/dbraw/zinc/52/78/21/938527821.db2.gz LNKWQUNMVABYAE-UHFFFAOYSA-N 0 0 350.346 3.901 20 5 FHBDRN Cc1cnc(C2CCN(C(=O)c3cc4cccc([N+](=O)[O-])c4[nH]3)CC2)s1 ZINC000278555356 938530599 /nfs/dbraw/zinc/53/05/99/938530599.db2.gz OUYAPEZKHFILMO-UHFFFAOYSA-N 0 0 370.434 3.861 20 5 FHBDRN O=C(C[C@H]1CC[C@H](C(F)(F)F)O1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000935157315 938531061 /nfs/dbraw/zinc/53/10/61/938531061.db2.gz GISIHBRDSXODQY-HUUCEWRRSA-N 0 0 372.343 3.586 20 5 FHBDRN O=[N+]([O-])c1ccc(NCc2nccn2CC(F)(F)F)c2ncccc12 ZINC000536187983 938533754 /nfs/dbraw/zinc/53/37/54/938533754.db2.gz MZHMGKLORFDHKS-UHFFFAOYSA-N 0 0 351.288 3.514 20 5 FHBDRN CCSCC[C@@H](C)NC(=O)c1cccc([N+](=O)[O-])c1Br ZINC000168555607 938546282 /nfs/dbraw/zinc/54/62/82/938546282.db2.gz SMBGTEATENISEG-SECBINFHSA-N 0 0 361.261 3.619 20 5 FHBDRN COC(=O)c1cc(CNCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)oc1C ZINC000278574430 938546890 /nfs/dbraw/zinc/54/68/90/938546890.db2.gz GQRBSCVWRVJTPB-UHFFFAOYSA-N 0 0 372.299 3.591 20 5 FHBDRN CN(Cc1cc(Cl)ccc1F)c1cc2nc[nH]c(=O)c2cc1[N+](=O)[O-] ZINC000584031131 938558377 /nfs/dbraw/zinc/55/83/77/938558377.db2.gz OGFJIZZHMWXSPE-UHFFFAOYSA-N 0 0 362.748 3.673 20 5 FHBDRN O=[N+]([O-])c1cnc(NC2(Cc3ccc(F)cc3)CCOCC2)c(Cl)c1 ZINC000432143457 945186425 /nfs/dbraw/zinc/18/64/25/945186425.db2.gz NYAPOHMCXIFEIC-UHFFFAOYSA-N 0 0 365.792 3.986 20 5 FHBDRN CC(C)[C@@H]1C[C@@H](Cc2nc(-c3c([N+](=O)[O-])ncn3C)no2)c2ccccc21 ZINC000584079337 938585879 /nfs/dbraw/zinc/58/58/79/938585879.db2.gz BFYGUACMOJDLGF-WFASDCNBSA-N 0 0 367.409 3.848 20 5 FHBDRN O=C(Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cc([N+](=O)[O-])n[nH]1 ZINC000506009258 945188365 /nfs/dbraw/zinc/18/83/65/945188365.db2.gz IZYUBNJLJWHHCB-UHFFFAOYSA-N 0 0 368.193 3.608 20 5 FHBDRN CCCN(C(=O)[C@@H]1CC(=O)N(C2CCCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000584092193 938594097 /nfs/dbraw/zinc/59/40/97/938594097.db2.gz OPGDGPAXARRXBU-OAHLLOKOSA-N 0 0 373.453 3.519 20 5 FHBDRN COc1ccccc1-c1nnc(Sc2c(F)cccc2[N+](=O)[O-])n1C ZINC000573033024 938596905 /nfs/dbraw/zinc/59/69/05/938596905.db2.gz NWJUQOYMGNDULQ-UHFFFAOYSA-N 0 0 360.370 3.689 20 5 FHBDRN COc1ccc(OC(=O)/C(C)=C\c2ccc([N+](=O)[O-])cc2)cc1[N+](=O)[O-] ZINC000588587419 938597686 /nfs/dbraw/zinc/59/76/86/938597686.db2.gz UNUNDGQLWKNWAE-LUAWRHEFSA-N 0 0 358.306 3.521 20 5 FHBDRN Cc1cn2cc(NC(=O)c3cc([N+](=O)[O-])cc(C(F)(F)F)c3)ccc2n1 ZINC000437264569 945188978 /nfs/dbraw/zinc/18/89/78/945188978.db2.gz YXLDFROGQDYSIH-UHFFFAOYSA-N 0 0 364.283 3.822 20 5 FHBDRN COc1ccc(COCCNc2ccc([N+](=O)[O-])c3cccnc23)cc1 ZINC000092958805 945188991 /nfs/dbraw/zinc/18/89/91/945188991.db2.gz KKECYKUCPVRYEI-UHFFFAOYSA-N 0 0 353.378 3.780 20 5 FHBDRN CCCc1coc(NC(=O)c2sc(Br)cc2[N+](=O)[O-])n1 ZINC000584121109 938608798 /nfs/dbraw/zinc/60/87/98/938608798.db2.gz ALDJRTKYGWNNJD-UHFFFAOYSA-N 0 0 360.189 3.612 20 5 FHBDRN O=[N+]([O-])c1ccc(Cl)cc1OS(=O)(=O)c1cc(F)ccc1Cl ZINC000728586354 938615084 /nfs/dbraw/zinc/61/50/84/938615084.db2.gz MYSGPGPECXIXRP-UHFFFAOYSA-N 0 0 366.153 3.808 20 5 FHBDRN Cc1ccccc1-c1nc(COC(=O)c2cccc([N+](=O)[O-])c2C)no1 ZINC000162058722 938618899 /nfs/dbraw/zinc/61/88/99/938618899.db2.gz PUFPTICAYUDWQB-UHFFFAOYSA-N 0 0 353.334 3.619 20 5 FHBDRN O=C(c1ncsc1C(F)(F)F)N1CCCc2ccc([N+](=O)[O-])cc21 ZINC000278653096 938619912 /nfs/dbraw/zinc/61/99/12/938619912.db2.gz OUGSHDDRWWBBQT-UHFFFAOYSA-N 0 0 357.313 3.663 20 5 FHBDRN CC(=O)c1cc(F)c(NC(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)c(F)c1F ZINC000584150449 938622009 /nfs/dbraw/zinc/62/20/09/938622009.db2.gz ZZBWBGXIMYRNAR-QMMMGPOBSA-N 0 0 366.295 3.957 20 5 FHBDRN O=C(NCCNc1ccc([N+](=O)[O-])cc1)c1cc2cc(Cl)sc2[nH]1 ZINC000584205140 938640427 /nfs/dbraw/zinc/64/04/27/938640427.db2.gz VMLYSPPEWWAZOK-UHFFFAOYSA-N 0 0 364.814 3.633 20 5 FHBDRN COc1c(F)ccc(F)c1C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000124234370 945193296 /nfs/dbraw/zinc/19/32/96/945193296.db2.gz UYMCCWXZZNGGPP-UHFFFAOYSA-N 0 0 374.246 3.735 20 5 FHBDRN C[C@H]1C[C@@H](c2ccccc2)N(C(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)C1 ZINC000573154549 938654297 /nfs/dbraw/zinc/65/42/97/938654297.db2.gz BPNFBUPGELZXRK-WFASDCNBSA-N 0 0 354.362 3.547 20 5 FHBDRN C[C@@H]1C[C@H](c2ccccc2)N(C(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)C1 ZINC000573154547 938654308 /nfs/dbraw/zinc/65/43/08/938654308.db2.gz BPNFBUPGELZXRK-IUODEOHRSA-N 0 0 354.362 3.547 20 5 FHBDRN COc1cc(CN2CCCC[C@@H]2c2nnc(C3CCC3)o2)ccc1[N+](=O)[O-] ZINC000584249980 938656048 /nfs/dbraw/zinc/65/60/48/938656048.db2.gz LIDQPAZPKNTEOJ-MRXNPFEDSA-N 0 0 372.425 3.981 20 5 FHBDRN O=C(Nc1ccc(F)c(C(F)(F)F)c1)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000519194989 945193856 /nfs/dbraw/zinc/19/38/56/945193856.db2.gz BDDZSAHBCDCASU-UHFFFAOYSA-N 0 0 372.230 3.734 20 5 FHBDRN CCNC(=O)Nc1cccc(NC(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)c1C ZINC000584266166 938665388 /nfs/dbraw/zinc/66/53/88/938665388.db2.gz NURQAIFKKYOQKB-LBPRGKRZSA-N 0 0 370.409 3.787 20 5 FHBDRN Cn1nc(NCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)cc1C1CC1 ZINC000584320730 938684617 /nfs/dbraw/zinc/68/46/17/938684617.db2.gz JNDCWVLYQPNDDQ-UHFFFAOYSA-N 0 0 354.435 3.968 20 5 FHBDRN COC(=O)c1cc(Cl)ccc1OCc1ccc([N+](=O)[O-])c(OC)c1 ZINC000584320144 938685155 /nfs/dbraw/zinc/68/51/55/938685155.db2.gz FCIKTBCDARMDMQ-UHFFFAOYSA-N 0 0 351.742 3.622 20 5 FHBDRN CCOCCOc1ccccc1C(=O)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000162166654 938692098 /nfs/dbraw/zinc/69/20/98/938692098.db2.gz PWCMSDUXVVYHDX-UHFFFAOYSA-N 0 0 370.405 3.603 20 5 FHBDRN Cc1ccc(NC(=O)c2ccc(NC[C@@H](CO)C3CC3)c([N+](=O)[O-])c2)cc1 ZINC000584344194 938693837 /nfs/dbraw/zinc/69/38/37/938693837.db2.gz SVMINCYOTZDYAN-INIZCTEOSA-N 0 0 369.421 3.586 20 5 FHBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@@H](CC(F)(F)F)c2ccccc2)cc1 ZINC000056128016 938698869 /nfs/dbraw/zinc/69/88/69/938698869.db2.gz OOLCELUTEFYMIQ-AWEZNQCLSA-N 0 0 374.340 3.567 20 5 FHBDRN Cc1cc(Nc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)nn1C1CCCCC1 ZINC000573194884 938699112 /nfs/dbraw/zinc/69/91/12/938699112.db2.gz LAUKHYFGLUPETP-UHFFFAOYSA-N 0 0 369.425 3.655 20 5 FHBDRN O=C(COc1cccc([N+](=O)[O-])c1)N[C@@H]1C[C@H]1c1ccc2ccccc2c1 ZINC000437272067 945196984 /nfs/dbraw/zinc/19/69/84/945196984.db2.gz ICGBPVMTJQMMHC-VQTJNVASSA-N 0 0 362.385 3.799 20 5 FHBDRN COc1ccc(NC(=O)N2C[C@H](C(F)(F)F)CC[C@@H]2C)cc1[N+](=O)[O-] ZINC000611825134 938703416 /nfs/dbraw/zinc/70/34/16/938703416.db2.gz MFWLFARNEKOPNS-VHSXEESVSA-N 0 0 361.320 3.798 20 5 FHBDRN Cc1cc(Sc2nnc(C(C)C)n2Cc2ccco2)ncc1[N+](=O)[O-] ZINC000074738681 938705845 /nfs/dbraw/zinc/70/58/45/938705845.db2.gz YDMAHIIGVCPGNE-UHFFFAOYSA-N 0 0 359.411 3.806 20 5 FHBDRN COc1ccc(NC(=O)N[C@H]2COc3c2cccc3Cl)cc1[N+](=O)[O-] ZINC000611828192 938705921 /nfs/dbraw/zinc/70/59/21/938705921.db2.gz CXONVQJXVHSGQV-LBPRGKRZSA-N 0 0 363.757 3.512 20 5 FHBDRN CC[C@H](Nc1cccc(C(=O)NCCOC)c1)c1cccc([N+](=O)[O-])c1 ZINC000584366841 938711965 /nfs/dbraw/zinc/71/19/65/938711965.db2.gz PBGAEINKCUSNLO-SFHVURJKSA-N 0 0 357.410 3.534 20 5 FHBDRN CC(F)(F)c1ccc(CNc2c(Br)cncc2[N+](=O)[O-])cc1 ZINC000432148174 945198935 /nfs/dbraw/zinc/19/89/35/945198935.db2.gz KFOCQIBZXXUETM-UHFFFAOYSA-N 0 0 372.169 3.898 20 5 FHBDRN Cn1ncc([N+](=O)[O-])c1C(=O)N[C@H](c1cccc(Cl)c1)C1CCCC1 ZINC000128163156 938789120 /nfs/dbraw/zinc/78/91/20/938789120.db2.gz DKTUFSYTEKKMSZ-HNNXBMFYSA-N 0 0 362.817 3.643 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)cc(Cl)c1N1CCC(O[C@@H]2CCOC2)CC1 ZINC000584427617 938857461 /nfs/dbraw/zinc/85/74/61/938857461.db2.gz FCLLGJUHKFERCA-GFCCVEGCSA-N 0 0 361.225 3.676 20 5 FHBDRN COc1ccc(C)cc1NC(=O)COc1cc(C)c([N+](=O)[O-])cc1Cl ZINC000506432945 945210112 /nfs/dbraw/zinc/21/01/12/945210112.db2.gz LBQKAXQRFRJCEX-UHFFFAOYSA-N 0 0 364.785 3.891 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@@H]2CCCc3sccc32)c1 ZINC000162216555 938859509 /nfs/dbraw/zinc/85/95/09/938859509.db2.gz BOQOPIDJNVXPHQ-CQSZACIVSA-N 0 0 360.435 3.927 20 5 FHBDRN CC(C)COC[C@H](NC(=O)[C@@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1)c1ccco1 ZINC001125707720 938868760 /nfs/dbraw/zinc/86/87/60/938868760.db2.gz DRLWGJDVFDRPKA-KURKYZTESA-N 0 0 372.421 3.821 20 5 FHBDRN Cc1ccc(Nc2ccc(C(=O)c3nccn3C)cc2[N+](=O)[O-])cc1F ZINC000480350672 938877895 /nfs/dbraw/zinc/87/78/95/938877895.db2.gz VLESNTLWCKJPTR-UHFFFAOYSA-N 0 0 354.341 3.750 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)[C@H]2COc3cc(C)c(C)cc32)cc1[N+](=O)[O-] ZINC000472322042 938883886 /nfs/dbraw/zinc/88/38/86/938883886.db2.gz RFIBFUUQYJWGGU-PBHICJAKSA-N 0 0 354.406 3.873 20 5 FHBDRN CCS[C@H]1CCCC[C@H]1NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000427236809 945213269 /nfs/dbraw/zinc/21/32/69/945213269.db2.gz ANDXVDDPKFQUEJ-WBVHZDCISA-N 0 0 363.483 3.963 20 5 FHBDRN COc1cc(OC)cc(OCCCNc2ccc([N+](=O)[O-])c(C(C)=O)c2)c1 ZINC000573259448 938904870 /nfs/dbraw/zinc/90/48/70/938904870.db2.gz XNSAFMOLOMMICM-UHFFFAOYSA-N 0 0 374.393 3.696 20 5 FHBDRN O=C(NCc1ccccc1OC1CCC1)NCc1ccccc1[N+](=O)[O-] ZINC000118468879 938908773 /nfs/dbraw/zinc/90/87/73/938908773.db2.gz NYXYPUSOTNJHQH-UHFFFAOYSA-N 0 0 355.394 3.526 20 5 FHBDRN CC(C)[C@H]1N(C(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])CC1(C)C ZINC000480399609 938909584 /nfs/dbraw/zinc/90/95/84/938909584.db2.gz YPXPORJTKTZGNV-XHDPSFHLSA-N 0 0 354.834 3.909 20 5 FHBDRN Cc1cc(C(=O)NC2CCC(C(=O)OC(C)(C)C)CC2)ccc1[N+](=O)[O-] ZINC000094124090 938935245 /nfs/dbraw/zinc/93/52/45/938935245.db2.gz PUHXRYKLFFAJCO-UHFFFAOYSA-N 0 0 362.426 3.534 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N(CC2CC2)c2ccccc2)c1C ZINC000437299147 945217874 /nfs/dbraw/zinc/21/78/74/945217874.db2.gz QVEVLSNWCRKARS-UHFFFAOYSA-N 0 0 360.435 3.817 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])Nc1ccccc1NCC(F)(F)F ZINC000142257418 938948661 /nfs/dbraw/zinc/94/86/61/938948661.db2.gz XEGVRZSFLDAXDF-UHFFFAOYSA-N 0 0 353.300 3.750 20 5 FHBDRN COc1ccc(C)cc1CSCC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000158873401 938959454 /nfs/dbraw/zinc/95/94/54/938959454.db2.gz AFQCMBGZZMUWSK-UHFFFAOYSA-N 0 0 360.435 3.808 20 5 FHBDRN CC(C)[C@@H]1N(C(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])CC1(C)C ZINC000480491038 938964508 /nfs/dbraw/zinc/96/45/08/938964508.db2.gz NRJJOJZOXBGXNV-INIZCTEOSA-N 0 0 354.834 3.910 20 5 FHBDRN Cc1noc(C)c1C(C)(C)c1nc(Cc2ccc([N+](=O)[O-])c(C)c2)no1 ZINC000290025043 938964781 /nfs/dbraw/zinc/96/47/81/938964781.db2.gz HQXXCIMKQPLOIZ-UHFFFAOYSA-N 0 0 356.382 3.808 20 5 FHBDRN Cc1c(C(=O)N2CCCc3c([N+](=O)[O-])cccc32)cnn1CCC(C)C ZINC000162240990 938964849 /nfs/dbraw/zinc/96/48/49/938964849.db2.gz BFMJZVIUTKLEAM-UHFFFAOYSA-N 0 0 356.426 3.739 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2nnc(CN3CCc4cc(Cl)ccc43)o2)cc1 ZINC000511823880 945218942 /nfs/dbraw/zinc/21/89/42/945218942.db2.gz KSQXVXFNYFNCIL-UHFFFAOYSA-N 0 0 356.769 3.861 20 5 FHBDRN COc1cc(C(=O)NCCc2ccc3ccccc3c2)ccc1[N+](=O)[O-] ZINC000511260008 938966171 /nfs/dbraw/zinc/96/61/71/938966171.db2.gz LNIFRDRGTBLUIL-UHFFFAOYSA-N 0 0 350.374 3.729 20 5 FHBDRN Cc1cc(NC(=O)CNc2cc([N+](=O)[O-])ccc2Nc2ccccc2)on1 ZINC000024243776 938968034 /nfs/dbraw/zinc/96/80/34/938968034.db2.gz FFHDXSPVXIJJMM-UHFFFAOYSA-N 0 0 367.365 3.685 20 5 FHBDRN C[C@H]1[C@@H](C(F)(F)F)CCN1c1c(Br)cncc1[N+](=O)[O-] ZINC000480550241 938971325 /nfs/dbraw/zinc/97/13/25/938971325.db2.gz GRCHCEAKXXJKIW-BQBZGAKWSA-N 0 0 354.126 3.529 20 5 FHBDRN COc1ccc2cccc(CC(=O)NCc3ccc([N+](=O)[O-])cc3)c2c1 ZINC000179163267 938981627 /nfs/dbraw/zinc/98/16/27/938981627.db2.gz ILBGLGZRPZAHFG-UHFFFAOYSA-N 0 0 350.374 3.616 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@@H](OC(C)(C)C)c1ccccc1 ZINC000179164944 938981661 /nfs/dbraw/zinc/98/16/61/938981661.db2.gz NSXBWRPAPKNECJ-SFHVURJKSA-N 0 0 372.421 3.776 20 5 FHBDRN Cc1cccc(C(=O)N(C)Cc2ccccc2[N+](=O)[O-])c1Br ZINC000179172998 938981808 /nfs/dbraw/zinc/98/18/08/938981808.db2.gz FCMTZNGDDUJQKU-UHFFFAOYSA-N 0 0 363.211 3.938 20 5 FHBDRN Cc1ccc([C@H]2CCN(c3ccc(S(C)(=O)=O)cc3[N+](=O)[O-])C2)c(C)c1 ZINC000480559773 938991242 /nfs/dbraw/zinc/99/12/42/938991242.db2.gz TWSCDLKPMCUMTQ-HNNXBMFYSA-N 0 0 374.462 3.609 20 5 FHBDRN Cc1ccncc1[C@@H](C)N[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000611938874 938993515 /nfs/dbraw/zinc/99/35/15/938993515.db2.gz ASWMUDSAUAIFSL-OLZOCXBDSA-N 0 0 353.382 3.760 20 5 FHBDRN COc1ccc(NC(=O)CNc2cc(Cl)cc(Cl)c2)c([N+](=O)[O-])c1 ZINC000007972357 938994971 /nfs/dbraw/zinc/99/49/71/938994971.db2.gz PCPJJWGGAANJBO-UHFFFAOYSA-N 0 0 370.192 3.961 20 5 FHBDRN COc1ccc2c(c1)CCCCN2C(=O)c1cc(OC)c(C)c([N+](=O)[O-])c1 ZINC000480590586 938997556 /nfs/dbraw/zinc/99/75/56/938997556.db2.gz YWOBZVFFEFHNTM-UHFFFAOYSA-N 0 0 370.405 3.904 20 5 FHBDRN Cc1cc2c(cc1C)[C@@H](C(=O)N1CCCc3c([N+](=O)[O-])cccc31)CO2 ZINC000472343498 939001267 /nfs/dbraw/zinc/00/12/67/939001267.db2.gz ATEOSVMOAFZBML-INIZCTEOSA-N 0 0 352.390 3.667 20 5 FHBDRN Cc1c(CC(=O)NC(C)(C)COCc2ccccc2)cccc1[N+](=O)[O-] ZINC000409884021 939001298 /nfs/dbraw/zinc/00/12/98/939001298.db2.gz DIKMGTBHUKJVRZ-UHFFFAOYSA-N 0 0 356.422 3.557 20 5 FHBDRN Cc1cc(C(=O)Nc2ccc3cc([N+](=O)[O-])ccc3n2)c(C(F)(F)F)o1 ZINC000472344402 939003173 /nfs/dbraw/zinc/00/31/73/939003173.db2.gz VTLKOCNMZGXGKU-UHFFFAOYSA-N 0 0 365.267 3.737 20 5 FHBDRN C[C@@H]1C[C@@H](c2ccccc2)CCN1C(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000466887087 939004089 /nfs/dbraw/zinc/00/40/89/939004089.db2.gz IQBDPKZBCPDWAF-WBVHZDCISA-N 0 0 354.406 3.768 20 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CC1(NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)CCC(F)(F)CC1 ZINC000612064822 939034122 /nfs/dbraw/zinc/03/41/22/939034122.db2.gz YGEKCAIAPLBVIL-UHFFFAOYSA-N 0 0 353.369 3.867 20 5 FHBDRN COc1ccc2c(c1)CC[C@H](NC(=O)c1cc(SC)ccc1[N+](=O)[O-])C2 ZINC000612085929 939047426 /nfs/dbraw/zinc/04/74/26/939047426.db2.gz UWKMIYPYHYETOZ-AWEZNQCLSA-N 0 0 372.446 3.613 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1COC(=O)C[C@@H]1CCO[C@@H](C(C)C)C1 ZINC000781788548 939078331 /nfs/dbraw/zinc/07/83/31/939078331.db2.gz XUVHHHRIYWZXRY-RDTXWAMCSA-N 0 0 365.426 3.878 20 5 FHBDRN Cn1c2ccccc2nc1N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000179303858 939082091 /nfs/dbraw/zinc/08/20/91/939082091.db2.gz XNHGRKNWCZZKSH-UHFFFAOYSA-N 0 0 352.394 3.529 20 5 FHBDRN CCc1nn(C)c(Cl)c1CN(Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000179320181 939084966 /nfs/dbraw/zinc/08/49/66/939084966.db2.gz XMQBEFANXHORKA-UHFFFAOYSA-N 0 0 350.850 3.955 20 5 FHBDRN CC[C@@H](CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)c1ccccc1 ZINC000179372545 939098182 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3.738 20 5 FHBDRN O=[N+]([O-])c1ccc(OS(=O)(=O)c2ccccc2C(F)(F)F)cc1F ZINC000065795114 939153015 /nfs/dbraw/zinc/15/30/15/939153015.db2.gz ZZTJNONUFDOVGH-UHFFFAOYSA-N 0 0 365.260 3.520 20 5 FHBDRN C[C@H](NC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)c1cccc(F)c1F ZINC000179426765 939155568 /nfs/dbraw/zinc/15/55/68/939155568.db2.gz FYMZCPHPHPTUNK-NSHDSACASA-N 0 0 372.331 3.550 20 5 FHBDRN CN(Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@@H]1CCc2ccccc21 ZINC000073741557 945231389 /nfs/dbraw/zinc/23/13/89/945231389.db2.gz ADOGSPXZKBENHJ-QGZVFWFLSA-N 0 0 350.378 3.764 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)Nc1n[nH]c2c1cccc2Cl ZINC000179442137 939159623 /nfs/dbraw/zinc/15/96/23/939159623.db2.gz KHXAODFDTCZDBR-UHFFFAOYSA-N 0 0 369.768 3.787 20 5 FHBDRN C[C@@H](NC(=O)COc1ccc(Cl)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000179492684 939173716 /nfs/dbraw/zinc/17/37/16/939173716.db2.gz FBMXOENTIZKXCM-SNVBAGLBSA-N 0 0 352.749 3.644 20 5 FHBDRN COc1ccc(OC(F)F)c(NC(=O)c2cc(F)cc([N+](=O)[O-])c2)c1 ZINC000609448536 939188921 /nfs/dbraw/zinc/18/89/21/939188921.db2.gz GSVJDEQKUKNKGI-UHFFFAOYSA-N 0 0 356.256 3.596 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)NCCN(C)c1ccccc1 ZINC000540849739 939204510 /nfs/dbraw/zinc/20/45/10/939204510.db2.gz JONOGVLXLHIFGG-UHFFFAOYSA-N 0 0 373.478 3.962 20 5 FHBDRN Cc1cc2c(cc1C)[C@@H](C(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1)CO2 ZINC000472395033 939214938 /nfs/dbraw/zinc/21/49/38/939214938.db2.gz MQXYJKCOWBTWKS-IBGZPJMESA-N 0 0 366.417 3.879 20 5 FHBDRN CC(C)(C(=O)OCC/C=C\Br)c1ccc([N+](=O)[O-])cc1F ZINC000835795509 939215877 /nfs/dbraw/zinc/21/58/77/939215877.db2.gz LXCXEKKECCROPJ-CLTKARDFSA-N 0 0 360.179 3.853 20 5 FHBDRN CCOc1cc(NC(=O)N2Cc3ccccc3C2)c([N+](=O)[O-])cc1OCC ZINC000106318207 945235777 /nfs/dbraw/zinc/23/57/77/945235777.db2.gz BVCBGHYHZZKRMG-UHFFFAOYSA-N 0 0 371.393 3.940 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])c(F)c1)Nc1scnc1-c1ccccc1 ZINC000102724823 939218910 /nfs/dbraw/zinc/21/89/10/939218910.db2.gz QWIIBQWRTAXKOD-UHFFFAOYSA-N 0 0 373.365 3.875 20 5 FHBDRN 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3.563 20 5 FHBDRN C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCN2c2ccnc3c2cccc3[N+](=O)[O-])C1 ZINC000432172872 945262541 /nfs/dbraw/zinc/26/25/41/945262541.db2.gz QQRQJOBPUAKDQL-UEABVUSTSA-N 0 0 355.438 3.909 20 5 FHBDRN COCCOc1ccc(NC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)cc1 ZINC000438966937 945274723 /nfs/dbraw/zinc/27/47/23/945274723.db2.gz NJBXSVBCERGBQB-UHFFFAOYSA-N 0 0 358.394 3.996 20 5 FHBDRN CCCOc1ccc(CNC(=O)c2cccc(C)c2[N+](=O)[O-])cc1OC ZINC000506771908 945275117 /nfs/dbraw/zinc/27/51/17/945275117.db2.gz AYCTWUJSPWTPLQ-UHFFFAOYSA-N 0 0 358.394 3.631 20 5 FHBDRN Cc1c(CC(=O)N[C@@H]2C[C@H]2c2ccc(Cl)c(F)c2)cccc1[N+](=O)[O-] ZINC000437368585 945277166 /nfs/dbraw/zinc/27/71/66/945277166.db2.gz BVYIQXUYULJTEC-XJKSGUPXSA-N 0 0 362.788 3.911 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NCCSC(F)(F)F ZINC000179515480 939876487 /nfs/dbraw/zinc/87/64/87/939876487.db2.gz NOEOSVPQVKQBGL-UHFFFAOYSA-N 0 0 354.375 3.690 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccc(Cl)cc1-n1cccn1 ZINC000427312992 945277944 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Cc1nc(CO[C@H]2CCN(c3ccc([N+](=O)[O-])c4cccnc43)C2)cs1 ZINC000364381511 939936478 /nfs/dbraw/zinc/93/64/78/939936478.db2.gz HAFCEOZOKWDNSQ-AWEZNQCLSA-N 0 0 370.434 3.703 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2C[C@H]2c2ccc(Cl)c(F)c2)c1 ZINC000437357237 945283842 /nfs/dbraw/zinc/28/38/42/945283842.db2.gz UFWDWMHSICCROJ-XHDPSFHLSA-N 0 0 364.760 3.682 20 5 FHBDRN CCC[C@H](OC)C(=O)Nc1ccc(OCc2ccccc2)cc1[N+](=O)[O-] ZINC000410738268 939950860 /nfs/dbraw/zinc/95/08/60/939950860.db2.gz DLCFCVULBSTJJN-SFHVURJKSA-N 0 0 358.394 3.927 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N2CC=C(c3ccc(C)nc3)CC2)c1 ZINC000540872587 939961597 /nfs/dbraw/zinc/96/15/97/939961597.db2.gz VRMKLGDTKKRBLE-UHFFFAOYSA-N 0 0 369.446 3.950 20 5 FHBDRN CCCN(C(=O)[C@H](C)c1ccc2c(c1)OCO2)c1cccc([N+](=O)[O-])c1 ZINC000410822739 939962733 /nfs/dbraw/zinc/96/27/33/939962733.db2.gz OVQDLTSRHLMCKM-CYBMUJFWSA-N 0 0 356.378 3.870 20 5 FHBDRN CCOc1cc(C(=O)Nc2sccc2C(C)=O)c([N+](=O)[O-])cc1OC ZINC000410896577 939967225 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O=C(Cc1cccnc1)Nc1ccc(OCc2ccccc2)cc1[N+](=O)[O-] ZINC000615039939 939990089 /nfs/dbraw/zinc/99/00/89/939990089.db2.gz WMMBFOPFYCYNNQ-UHFFFAOYSA-N 0 0 363.373 3.750 20 5 FHBDRN COc1ccc2c(c1)CC[C@@H](NC(=O)Nc1c(C)ccc([N+](=O)[O-])c1C)C2 ZINC000612313877 939991632 /nfs/dbraw/zinc/99/16/32/939991632.db2.gz AOUGEKXMNQKVHH-MRXNPFEDSA-N 0 0 369.421 3.899 20 5 FHBDRN Cc1cccc(-n2ncc(NCc3c([N+](=O)[O-])ncn3C)c2C(C)C)c1 ZINC000364781948 939999037 /nfs/dbraw/zinc/99/90/37/939999037.db2.gz XAKKJKCDKDMIBZ-UHFFFAOYSA-N 0 0 354.414 3.558 20 5 FHBDRN CCOC[C@@H]1CCCCN1C(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000411114469 939999838 /nfs/dbraw/zinc/99/98/38/939999838.db2.gz OUCCSLQVOQGCBQ-LBPRGKRZSA-N 0 0 360.332 3.645 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N[C@]2(C)CCCC[C@@H]2C)cc1OC ZINC000411093565 940001064 /nfs/dbraw/zinc/00/10/64/940001064.db2.gz KQRBUILBCOFRPG-KPZWWZAWSA-N 0 0 350.415 3.701 20 5 FHBDRN CCC[C@@H](NC(=O)C(=O)Nc1cc([N+](=O)[O-])c(C)cc1C)c1ccccc1 ZINC000411135516 940002421 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COc1ccc([N+](=O)[O-])c(CC(=O)NCC2(c3ccccc3)CCC2)c1F ZINC000411222805 940015752 /nfs/dbraw/zinc/01/57/52/940015752.db2.gz XEAFOHVCZDYFDN-UHFFFAOYSA-N 0 0 372.396 3.523 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])NCCc1c(Cl)cccc1Cl ZINC000065881451 940017977 /nfs/dbraw/zinc/01/79/77/940017977.db2.gz NIZLLJNCMSPKBC-UHFFFAOYSA-N 0 0 368.220 3.672 20 5 FHBDRN Cc1cc(C)cc([C@H](C)NC(=O)C(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)c1 ZINC000411218683 940018561 /nfs/dbraw/zinc/01/85/61/940018561.db2.gz ZMQZALVKMURHGB-HNNXBMFYSA-N 0 0 369.421 3.644 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N[C@@H](c2ccc(C)cc2)C2CC2)c1F ZINC000411218712 940018763 /nfs/dbraw/zinc/01/87/63/940018763.db2.gz CFQVTASSTQPZML-FQEVSTJZSA-N 0 0 372.396 3.861 20 5 FHBDRN COc1ccc2c(c1)CC[C@@H](NC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1)C2 ZINC000612360215 940021795 /nfs/dbraw/zinc/02/17/95/940021795.db2.gz JGXRVFUGHOWHJP-SUMWQHHRSA-N 0 0 369.421 3.521 20 5 FHBDRN CC(=O)Nc1cccc(NC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)c1C ZINC000411305653 940025669 /nfs/dbraw/zinc/02/56/69/940025669.db2.gz DWGIFBIEPOAYDN-JKSUJKDBSA-N 0 0 353.378 3.604 20 5 FHBDRN COc1cc(-c2noc(CNc3cc([N+](=O)[O-])ccc3C)n2)ccc1C ZINC000136546787 940025902 /nfs/dbraw/zinc/02/59/02/940025902.db2.gz WVOIWPATXXHHCZ-UHFFFAOYSA-N 0 0 354.366 3.882 20 5 FHBDRN CC[C@@H](NC(=O)N1CCC(n2ccc(C)n2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000364996218 940032979 /nfs/dbraw/zinc/03/29/79/940032979.db2.gz HEYSKXQZIKUZMF-GOSISDBHSA-N 0 0 371.441 3.598 20 5 FHBDRN COC(=O)c1cc([N+](=O)[O-])c(C)cc1Sc1nnc(C2CC2)n1C1CC1 ZINC000278794736 940039950 /nfs/dbraw/zinc/03/99/50/940039950.db2.gz XMSSIEJIYWGGOG-UHFFFAOYSA-N 0 0 374.422 3.645 20 5 FHBDRN Cc1cc([C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)on1 ZINC000411441284 940043614 /nfs/dbraw/zinc/04/36/14/940043614.db2.gz PLXSALYDUZDXFF-CQSZACIVSA-N 0 0 359.382 3.656 20 5 FHBDRN CCC[C@@]1(C)CCCN(C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)C1 ZINC000437387838 945291921 /nfs/dbraw/zinc/29/19/21/945291921.db2.gz RVTVTAPGAHMWSB-IBGZPJMESA-N 0 0 356.426 3.823 20 5 FHBDRN CCSc1ccc(CC(=O)Nc2cc(C(=O)OC)cc([N+](=O)[O-])c2)cc1 ZINC000507514559 945293022 /nfs/dbraw/zinc/29/30/22/945293022.db2.gz BLPXJCNCYJONOY-UHFFFAOYSA-N 0 0 374.418 3.675 20 5 FHBDRN COc1ccc(CNC(=O)[C@H]2CC(C)(C)Oc3ccccc32)cc1[N+](=O)[O-] ZINC000411548155 940061126 /nfs/dbraw/zinc/06/11/26/940061126.db2.gz FDMUNONQWVDVAR-HNNXBMFYSA-N 0 0 370.405 3.565 20 5 FHBDRN CCCN(CCc1ccccn1)C(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1 ZINC000411629701 940075261 /nfs/dbraw/zinc/07/52/61/940075261.db2.gz CLYUAJFJCGWNLW-UHFFFAOYSA-N 0 0 371.437 3.872 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)[C@@H]1CCN(c2ccccc2Cl)C1=O ZINC000548934539 940094867 /nfs/dbraw/zinc/09/48/67/940094867.db2.gz JALYXQDSMMGYQP-GOSISDBHSA-N 0 0 373.840 3.528 20 5 FHBDRN CCC[C@]1(C)CCCN(C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000437390067 945296033 /nfs/dbraw/zinc/29/60/33/945296033.db2.gz YCFFWFOKGYPVDW-LJQANCHMSA-N 0 0 356.426 3.823 20 5 FHBDRN Cc1cc(Cl)ccc1NC(=O)CN(C)CCc1cccc([N+](=O)[O-])c1 ZINC000548935761 940101027 /nfs/dbraw/zinc/10/10/27/940101027.db2.gz WTGPWKXWXBBQFD-UHFFFAOYSA-N 0 0 361.829 3.670 20 5 FHBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)c1ccoc1C(F)(F)F ZINC000290158410 940103104 /nfs/dbraw/zinc/10/31/04/940103104.db2.gz WMTDNSPOGYWWDH-UHFFFAOYSA-N 0 0 356.300 3.959 20 5 FHBDRN O=C(Nc1ccncc1)c1ccc(CNc2ccsc2[N+](=O)[O-])cc1 ZINC000065946975 940106443 /nfs/dbraw/zinc/10/64/43/940106443.db2.gz XYXUJNVQGNKQSE-UHFFFAOYSA-N 0 0 354.391 3.916 20 5 FHBDRN CCn1c2ccccc2nc1CCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000065947386 940106859 /nfs/dbraw/zinc/10/68/59/940106859.db2.gz QUNUNBZNKDYDHA-UHFFFAOYSA-N 0 0 355.354 3.527 20 5 FHBDRN CSc1ccc(C(=O)Nc2ccc3nc(N(C)C)oc3c2)cc1[N+](=O)[O-] ZINC000158935149 940114113 /nfs/dbraw/zinc/11/41/13/940114113.db2.gz JBVSYOZQJXLEJJ-UHFFFAOYSA-N 0 0 372.406 3.776 20 5 FHBDRN O=C(COc1cc([N+](=O)[O-])ccc1Cl)Nc1ccnn1C1CCCC1 ZINC000177334168 940119744 /nfs/dbraw/zinc/11/97/44/940119744.db2.gz MRUDYNWKRYXTSF-UHFFFAOYSA-N 0 0 364.789 3.577 20 5 FHBDRN O=C(Nc1ccc(OC(=O)c2ccc([N+](=O)[O-])cc2)cc1)c1ccco1 ZINC000051035689 940123262 /nfs/dbraw/zinc/12/32/62/940123262.db2.gz YGAGWSFXVOORIO-UHFFFAOYSA-N 0 0 352.302 3.659 20 5 FHBDRN Cc1cc(C(=O)OCc2ccc([N+](=O)[O-])c(F)c2)c2cnn(C(C)C)c2n1 ZINC000782621397 940134259 /nfs/dbraw/zinc/13/42/59/940134259.db2.gz VGKNWWIKLBRGOP-UHFFFAOYSA-N 0 0 372.356 3.725 20 5 FHBDRN CCN(Cc1ccc(Cl)s1)C(=O)c1ccc(OC)c([N+](=O)[O-])c1 ZINC000007974821 940139592 /nfs/dbraw/zinc/13/95/92/940139592.db2.gz GDSWWMTVDKHYFY-UHFFFAOYSA-N 0 0 354.815 3.981 20 5 FHBDRN O=C(N[C@H](c1ccccc1)c1cccc2ccccc21)c1c[nH]nc1[N+](=O)[O-] ZINC000548941998 940157700 /nfs/dbraw/zinc/15/77/00/940157700.db2.gz SNYGEYYPDMFYPE-LJQANCHMSA-N 0 0 372.384 3.991 20 5 FHBDRN Cn1c(C(=O)N[C@H](c2cccs2)c2ccc(F)cc2)ccc1[N+](=O)[O-] ZINC000612596387 940167599 /nfs/dbraw/zinc/16/75/99/940167599.db2.gz RDZCLABIVUYAEX-INIZCTEOSA-N 0 0 359.382 3.653 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1OCC(=O)Nc1cccc(C(F)(F)F)c1 ZINC000506778594 945300677 /nfs/dbraw/zinc/30/06/77/945300677.db2.gz LXOUNLHPBCPHJS-UHFFFAOYSA-N 0 0 370.283 3.640 20 5 FHBDRN COC(=O)c1sc(NC(=O)c2cc(SC)ccc2[N+](=O)[O-])cc1C ZINC000612605501 940175230 /nfs/dbraw/zinc/17/52/30/940175230.db2.gz QUCWKRWVFCKUOI-UHFFFAOYSA-N 0 0 366.420 3.726 20 5 FHBDRN Cc1ccc(CN(C(C)C)S(=O)(=O)c2cc([N+](=O)[O-])ccc2C)s1 ZINC000066001946 940175604 /nfs/dbraw/zinc/17/56/04/940175604.db2.gz YCVRZVJFUVYEBE-UHFFFAOYSA-N 0 0 368.480 3.872 20 5 FHBDRN CCOCc1cccc(NC(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)c1 ZINC000124468745 945301753 /nfs/dbraw/zinc/30/17/53/945301753.db2.gz RTYWYEDBFKIDAZ-UHFFFAOYSA-N 0 0 355.394 3.722 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1F)N[C@H]1COc2c1cccc2Cl ZINC000612616077 940186969 /nfs/dbraw/zinc/18/69/69/940186969.db2.gz SOGLVDOTZWFVMH-ZDUSSCGKSA-N 0 0 351.721 3.643 20 5 FHBDRN Cc1c(NC(=O)NCc2ccc(OC(C)(C)C)nc2)cccc1[N+](=O)[O-] ZINC000179988246 940198223 /nfs/dbraw/zinc/19/82/23/940198223.db2.gz DVISKUJVMHWHEU-UHFFFAOYSA-N 0 0 358.398 3.797 20 5 FHBDRN COc1cc(C(=O)N2CCCC[C@H]2c2ccccc2)c([N+](=O)[O-])cc1OC ZINC000545262158 940224134 /nfs/dbraw/zinc/22/41/34/940224134.db2.gz CEFQEMRMIWBVDJ-INIZCTEOSA-N 0 0 370.405 3.979 20 5 FHBDRN Cc1cccc(NC(=O)Cc2ccc([N+](=O)[O-])cc2Br)c1O ZINC000151356900 945307112 /nfs/dbraw/zinc/30/71/12/945307112.db2.gz DALLSNDNFPDYFN-UHFFFAOYSA-N 0 0 365.183 3.553 20 5 FHBDRN C[C@@H](CNC(=O)c1cc2cc([N+](=O)[O-])ccc2o1)COCc1ccccc1 ZINC000507532425 945307358 /nfs/dbraw/zinc/30/73/58/945307358.db2.gz MFNLMRLHDICQEL-AWEZNQCLSA-N 0 0 368.389 3.924 20 5 FHBDRN Cc1ccc(S(=O)(=O)N(Cc2ccccc2)[C@H](C)C2CC2)c([N+](=O)[O-])c1 ZINC000507550583 945309167 /nfs/dbraw/zinc/30/91/67/945309167.db2.gz JGXIQCSQDWTYRP-OAHLLOKOSA-N 0 0 374.462 3.893 20 5 FHBDRN CC(=O)c1cc([N+](=O)[O-])ccc1N1CCC([C@H](O)c2ccccc2)CC1 ZINC000376089318 940293065 /nfs/dbraw/zinc/29/30/65/940293065.db2.gz RYQGGAUWGTTZQX-HXUWFJFHSA-N 0 0 354.406 3.747 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)NC(C)(C)c2ccc(C(C)(C)C)cc2)n1 ZINC000427376690 945309694 /nfs/dbraw/zinc/30/96/94/945309694.db2.gz NKMBBJXILZAAJR-UHFFFAOYSA-N 0 0 358.442 3.774 20 5 FHBDRN O=c1ccc(-c2cccc([N+](=O)[O-])c2)nn1CCCc1cccc(F)c1 ZINC000180042206 940302735 /nfs/dbraw/zinc/30/27/35/940302735.db2.gz OMFOZLQKZHLKFT-UHFFFAOYSA-N 0 0 353.353 3.590 20 5 FHBDRN Nc1ccc(-c2noc(CSCc3ccc(F)cc3)n2)cc1[N+](=O)[O-] ZINC000612855510 940314493 /nfs/dbraw/zinc/31/44/93/940314493.db2.gz AODQPLUEGJZLBN-UHFFFAOYSA-N 0 0 360.370 3.800 20 5 FHBDRN O=C(Nc1cncc(Cl)c1Br)c1ccc([N+](=O)[O-])cc1 ZINC000589015685 940330709 /nfs/dbraw/zinc/33/07/09/940330709.db2.gz SOGVXFMMGRQCJE-UHFFFAOYSA-N 0 0 356.563 3.658 20 5 FHBDRN O=[N+]([O-])c1ccccc1NCc1nc(Cc2ccc3ccccc3n2)no1 ZINC000612893701 940331113 /nfs/dbraw/zinc/33/11/13/940331113.db2.gz JSBVBWIXPISAEQ-UHFFFAOYSA-N 0 0 361.361 3.729 20 5 FHBDRN O=[N+]([O-])c1cc(F)ccc1-c1nc(Cc2ccc3ccccc3n2)no1 ZINC000612893720 940331125 /nfs/dbraw/zinc/33/11/25/940331125.db2.gz LFFJTZUJDYONDF-UHFFFAOYSA-N 0 0 350.309 3.923 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)c1nc(-c2cccc(C(N)=O)c2)no1 ZINC000612900488 940334716 /nfs/dbraw/zinc/33/47/16/940334716.db2.gz APZPMPZDOHUKSJ-JTQLQIEISA-N 0 0 370.390 3.597 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1)[nH]cc2-c1nc(Cc2ccc3c(c2)CCO3)no1 ZINC000612912114 940337826 /nfs/dbraw/zinc/33/78/26/940337826.db2.gz QQOMXOVXOYMZQE-UHFFFAOYSA-N 0 0 362.345 3.652 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)O[C@@H](CCc1ccccc1)C(C)C ZINC000066232507 940341185 /nfs/dbraw/zinc/34/11/85/940341185.db2.gz SKGWWIRNJRTRBI-KRWDZBQOSA-N 0 0 359.426 3.690 20 5 FHBDRN O=[N+]([O-])c1ccccc1-n1ccc(-c2nc([C@@H]3CCc4ccccc43)no2)n1 ZINC000612933035 940343759 /nfs/dbraw/zinc/34/37/59/940343759.db2.gz KHRARIAPYREMMP-OAHLLOKOSA-N 0 0 373.372 3.909 20 5 FHBDRN O=[N+]([O-])c1cccc(-n2ccc(-c3nc([C@@H]4CCc5ccccc54)no3)n2)c1 ZINC000612933090 940344369 /nfs/dbraw/zinc/34/43/69/940344369.db2.gz LNYNPVZVINRRNL-QGZVFWFLSA-N 0 0 373.372 3.909 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1-c1noc(-c2ccn(-c3cccc(F)c3)n2)n1 ZINC000612936632 940345509 /nfs/dbraw/zinc/34/55/09/940345509.db2.gz USBJBDLNUGMAIC-UHFFFAOYSA-N 0 0 365.324 3.945 20 5 FHBDRN O=[N+]([O-])c1ccc(Cc2noc([C@@H]3CC34CCC4)n2)c(Br)c1 ZINC000612956146 940353990 /nfs/dbraw/zinc/35/39/90/940353990.db2.gz DMCUWCHPZKPNFW-NSHDSACASA-N 0 0 364.199 3.989 20 5 FHBDRN CCn1c(=O)c2cc3ccccc3cc2nc1SCCc1ccnn1C ZINC000548966481 940354312 /nfs/dbraw/zinc/35/43/12/940354312.db2.gz UIQLCUFZPBHDND-UHFFFAOYSA-N 0 0 364.474 3.638 20 5 FHBDRN O=[N+]([O-])c1cc(Br)cc(-c2nc([C@H]3CCCS3)no2)c1 ZINC000612948870 940354990 /nfs/dbraw/zinc/35/49/90/940354990.db2.gz ADJIAJIDIOXWOQ-SNVBAGLBSA-N 0 0 356.201 3.975 20 5 FHBDRN CC(C)c1[nH]nc(-c2nc([C@@H]3CCc4ccccc4C3)no2)c1[N+](=O)[O-] ZINC000612951374 940356206 /nfs/dbraw/zinc/35/62/06/940356206.db2.gz FUGFNCNTVSJMIQ-CYBMUJFWSA-N 0 0 353.382 3.764 20 5 FHBDRN COc1ccc(Cc2nc([C@H]3CCc4ccccc4C3)no2)cc1[N+](=O)[O-] ZINC000612952161 940356802 /nfs/dbraw/zinc/35/68/02/940356802.db2.gz WUKPRIZAHXSQPD-INIZCTEOSA-N 0 0 365.389 3.850 20 5 FHBDRN O=[N+]([O-])c1cccc(Oc2ccc(-c3noc(-c4ccnnc4)n3)cc2)c1 ZINC000612966529 940360046 /nfs/dbraw/zinc/36/00/46/940360046.db2.gz MXRPONLEEISWQW-UHFFFAOYSA-N 0 0 361.317 3.894 20 5 FHBDRN O=C(Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)[C@H]1Cc2ccccc2O1 ZINC000511859571 945317304 /nfs/dbraw/zinc/31/73/04/945317304.db2.gz MSEAFPGZDSVZOQ-MRXNPFEDSA-N 0 0 367.386 3.661 20 5 FHBDRN O=C(Nc1ccc2c(c1)CCCC(=O)N2)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412007245 940374675 /nfs/dbraw/zinc/37/46/75/940374675.db2.gz XIEMAAUJZPARDT-DLBZAZTESA-N 0 0 365.389 3.612 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1CN(C)Cc1ccc(OC)cc1OC ZINC000506787495 945312673 /nfs/dbraw/zinc/31/26/73/945312673.db2.gz FTJQMWFZJMIZDT-UHFFFAOYSA-N 0 0 360.410 3.643 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N2CC=C(c3ccc(Cl)nc3)CC2)c1 ZINC000376151991 940377431 /nfs/dbraw/zinc/37/74/31/940377431.db2.gz STIKMWUQDSUPQI-UHFFFAOYSA-N 0 0 373.796 3.581 20 5 FHBDRN Cc1nc2ccc(NC(=O)c3cc([N+](=O)[O-])cc4c3OCCO4)cc2s1 ZINC000066269727 940380900 /nfs/dbraw/zinc/38/09/00/940380900.db2.gz AQXRGJLUPOPOQZ-UHFFFAOYSA-N 0 0 371.374 3.536 20 5 FHBDRN CCc1cccc(CC)c1NC(=O)c1cc([N+](=O)[O-])cc2c1OCCO2 ZINC000066268939 940381015 /nfs/dbraw/zinc/38/10/15/940381015.db2.gz ZCOCFNFRVJRIIT-UHFFFAOYSA-N 0 0 356.378 3.743 20 5 FHBDRN Cc1ccc(S(=O)(=O)N(C)[C@@H](C)c2ccc(Cl)cc2)c([N+](=O)[O-])c1 ZINC000507556739 945313655 /nfs/dbraw/zinc/31/36/55/945313655.db2.gz XGZBPDVMLQTPLF-LBPRGKRZSA-N 0 0 368.842 3.938 20 5 FHBDRN O=C(Nc1nc2c(s1)CSCC2)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000376158182 940389756 /nfs/dbraw/zinc/38/97/56/940389756.db2.gz OEJNZLPSOZGUPI-UHFFFAOYSA-N 0 0 355.828 3.746 20 5 FHBDRN Cc1cc(C)c(NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)cc1O ZINC000613032361 940408346 /nfs/dbraw/zinc/40/83/46/940408346.db2.gz DWSSXKDLYIBAMP-UHFFFAOYSA-N 0 0 355.394 3.770 20 5 FHBDRN CC(=O)c1cc(N2CCC[C@@H](n3ccnc3C(C)C)C2)ccc1[N+](=O)[O-] ZINC000376172090 940412891 /nfs/dbraw/zinc/41/28/91/940412891.db2.gz KCEQQNORRZNRTI-MRXNPFEDSA-N 0 0 356.426 3.959 20 5 FHBDRN O=C(Nc1cncc(Cl)c1Br)c1ccc([N+](=O)[O-])s1 ZINC000579936925 940422362 /nfs/dbraw/zinc/42/23/62/940422362.db2.gz ALSWGEZKPVDBMO-UHFFFAOYSA-N 0 0 362.592 3.720 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1CCc2c(F)cc(F)cc2[C@H]1C ZINC000427369011 945319983 /nfs/dbraw/zinc/31/99/83/945319983.db2.gz ZNXLCZWQNFOODE-SNVBAGLBSA-N 0 0 362.332 3.641 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)N[C@@H](Cc1ccccc1)C1CC1 ZINC000511420857 940433786 /nfs/dbraw/zinc/43/37/86/940433786.db2.gz HTPZRGSYKNUTBD-FQEVSTJZSA-N 0 0 367.449 3.800 20 5 FHBDRN O=C(Oc1cc(Cl)ccc1[N+](=O)[O-])c1c(Cl)nc2ccccn21 ZINC000124812484 945320711 /nfs/dbraw/zinc/32/07/11/945320711.db2.gz WIFZLAQBRRUFRX-UHFFFAOYSA-N 0 0 352.133 3.769 20 5 FHBDRN O=C(CC[C@@H]1Cc2ccccc2NC1=O)Oc1cc(Cl)ccc1[N+](=O)[O-] ZINC000124809154 945320849 /nfs/dbraw/zinc/32/08/49/945320849.db2.gz XOICPBYPSVPARK-GFCCVEGCSA-N 0 0 374.780 3.745 20 5 FHBDRN Cc1c(NC(=O)NCCc2ccc([N+](=O)[O-])cc2)cnn1CCC(C)C ZINC000161687768 940442903 /nfs/dbraw/zinc/44/29/03/940442903.db2.gz WLHYZASIEYOBQZ-UHFFFAOYSA-N 0 0 359.430 3.510 20 5 FHBDRN C[C@@H](CC(=O)OCCn1cc([N+](=O)[O-])cn1)c1ccccc1C(F)(F)F ZINC000177794701 940443124 /nfs/dbraw/zinc/44/31/24/940443124.db2.gz DRCTTWLCORQHQY-NSHDSACASA-N 0 0 371.315 3.547 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N[C@H]1CCN(c2ccc(F)cc2)C1 ZINC000414042636 940444891 /nfs/dbraw/zinc/44/48/91/940444891.db2.gz OJGYRIZHGRKZDR-INIZCTEOSA-N 0 0 371.412 3.668 20 5 FHBDRN COC(=O)c1ccc(OCc2coc(-c3ccc(C)cc3)n2)cc1[N+](=O)[O-] ZINC000613112986 940456045 /nfs/dbraw/zinc/45/60/45/940456045.db2.gz MVDFIMBQAGUKDY-UHFFFAOYSA-N 0 0 368.345 3.924 20 5 FHBDRN COC(=O)c1ccc(Oc2ncnc3sc4c(c32)CCC4)cc1[N+](=O)[O-] ZINC000613114069 940456618 /nfs/dbraw/zinc/45/66/18/940456618.db2.gz AVPXMPQVYGHXLQ-UHFFFAOYSA-N 0 0 371.374 3.667 20 5 FHBDRN CC[C@@H]1CN(c2ccccc2)CCN1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000613130304 940462661 /nfs/dbraw/zinc/46/26/61/940462661.db2.gz VUXDILSBCCRPNZ-OAHLLOKOSA-N 0 0 366.421 3.837 20 5 FHBDRN COc1cc(Br)ccc1C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000111073904 945322788 /nfs/dbraw/zinc/32/27/88/945322788.db2.gz SVNVMKLVXOLBAC-UHFFFAOYSA-N 0 0 351.156 3.618 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)N[C@@H]1CCN(c2cccc(Cl)c2)C1 ZINC000431749321 940469551 /nfs/dbraw/zinc/46/95/51/940469551.db2.gz KLZXZIDGFDQEHY-CQSZACIVSA-N 0 0 360.801 3.649 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)N[C@H]1CCN(c2cccc(Cl)c2)C1 ZINC000431749320 940469587 /nfs/dbraw/zinc/46/95/87/940469587.db2.gz KLZXZIDGFDQEHY-AWEZNQCLSA-N 0 0 360.801 3.649 20 5 FHBDRN CC(C)[C@H](CC(=O)OCc1ccc(C(N)=O)cc1[N+](=O)[O-])c1ccccc1 ZINC000728640635 940470252 /nfs/dbraw/zinc/47/02/52/940470252.db2.gz XDDGHKHJZXVHCY-KRWDZBQOSA-N 0 0 370.405 3.567 20 5 FHBDRN Cc1cccc(Oc2ccc(NC(=O)c3cc([N+](=O)[O-])c[nH]3)cn2)c1C ZINC000580247676 940470562 /nfs/dbraw/zinc/47/05/62/940470562.db2.gz OFBGDLAFBKVVMA-UHFFFAOYSA-N 0 0 352.350 3.979 20 5 FHBDRN C[C@@H](C(=O)N[C@@H](C)c1nccn1-c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000580247351 940470581 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FHBDRN CC[C@H]1c2ccsc2CCN1C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000180404235 941006585 /nfs/dbraw/zinc/00/65/85/941006585.db2.gz OMWMABMWWFZCRV-LBPRGKRZSA-N 0 0 360.391 3.535 20 5 FHBDRN O=[N+]([O-])c1cc(F)c(CN[C@H](c2cccs2)C2(CO)CCC2)c(F)c1 ZINC000452058173 941012855 /nfs/dbraw/zinc/01/28/55/941012855.db2.gz HSFQOYXNAUOGHP-MRXNPFEDSA-N 0 0 368.405 3.928 20 5 FHBDRN O=C(Cc1noc2ccccc21)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000180466619 941023920 /nfs/dbraw/zinc/02/39/20/941023920.db2.gz MMSXNLBQXSDNEL-UHFFFAOYSA-N 0 0 365.267 3.936 20 5 FHBDRN CCc1nc(CC(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)cs1 ZINC000180468712 941023950 /nfs/dbraw/zinc/02/39/50/941023950.db2.gz CUQKZEZUTUAYJD-UHFFFAOYSA-N 0 0 359.329 3.814 20 5 FHBDRN COc1ccc(C[C@@H](C)C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1OC ZINC000180503809 941034613 /nfs/dbraw/zinc/03/46/13/941034613.db2.gz RMSZPYLCKAMIBP-KGLIPLIRSA-N 0 0 372.421 3.668 20 5 FHBDRN CC(=O)c1cc(N[C@H](c2ccn(C)n2)c2ccc(F)cc2)ccc1[N+](=O)[O-] ZINC000376452200 941037168 /nfs/dbraw/zinc/03/71/68/941037168.db2.gz YDSOPGCEXKOTAA-IBGZPJMESA-N 0 0 368.368 3.872 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CC(C)(C)OC1(C)C ZINC000180529170 941037398 /nfs/dbraw/zinc/03/73/98/941037398.db2.gz YSDUJAKEDAUWNW-SMDDNHRTSA-N 0 0 352.456 3.538 20 5 FHBDRN CCn1c(-c2cccc([N+](=O)[O-])c2)nnc1N(C)Cc1cccc(OC)c1 ZINC000549074225 941048637 /nfs/dbraw/zinc/04/86/37/941048637.db2.gz XFXCKPOMUZCKIZ-UHFFFAOYSA-N 0 0 367.409 3.518 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CNc1c(F)cc(Cl)cc1F ZINC000180594492 941049530 /nfs/dbraw/zinc/04/95/30/941049530.db2.gz KVUVSCQWDUOAJU-UHFFFAOYSA-N 0 0 371.727 3.586 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1[C@H](C)SCc1cc(=O)n2ccsc2n1 ZINC000180682708 941063415 /nfs/dbraw/zinc/06/34/15/941063415.db2.gz GRFSSQZZZXLHOM-NSHDSACASA-N 0 0 361.448 3.967 20 5 FHBDRN Cc1csc(-c2ccc(NC(=O)c3c(N)cccc3[N+](=O)[O-])cc2)n1 ZINC000180735848 941070524 /nfs/dbraw/zinc/07/05/24/941070524.db2.gz PULAFGTWAXTGEL-UHFFFAOYSA-N 0 0 354.391 3.861 20 5 FHBDRN CS(=O)(=O)c1cc(SCCCc2cccc(F)c2)ccc1[N+](=O)[O-] ZINC000180750699 941071805 /nfs/dbraw/zinc/07/18/05/941071805.db2.gz GHZBWORFVJAFSY-UHFFFAOYSA-N 0 0 369.439 3.862 20 5 FHBDRN Cc1c(CC(=O)Nc2ccc(F)cc2OCC(F)F)cccc1[N+](=O)[O-] ZINC000180769479 941073388 /nfs/dbraw/zinc/07/33/88/941073388.db2.gz MLGWNRFGJNUQHK-UHFFFAOYSA-N 0 0 368.311 3.867 20 5 FHBDRN CO[C@@H]1CC[C@H]2OCCN(Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)[C@@H]2C1 ZINC000180815566 941080674 /nfs/dbraw/zinc/08/06/74/941080674.db2.gz AVLSDNCWZODHQZ-YVWKXTFCSA-N 0 0 372.421 3.623 20 5 FHBDRN CCN(Cc1ccoc1)C(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-] ZINC000103009200 941086142 /nfs/dbraw/zinc/08/61/42/941086142.db2.gz OCRPNRGLTDADPJ-UHFFFAOYSA-N 0 0 350.396 3.581 20 5 FHBDRN Cc1ccccc1C1(NC(=O)CCc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC1 ZINC000843631721 941088694 /nfs/dbraw/zinc/08/86/94/941088694.db2.gz WSHWBEHOEZTEDY-UHFFFAOYSA-N 0 0 369.377 3.550 20 5 FHBDRN CC1CCN(c2ccc(C(=O)N(C)Cc3cscn3)cc2[N+](=O)[O-])CC1 ZINC000149152826 941090193 /nfs/dbraw/zinc/09/01/93/941090193.db2.gz GWBSUXINTPZBPD-UHFFFAOYSA-N 0 0 374.466 3.560 20 5 FHBDRN Cc1ccc(NC(=O)c2c(N)cccc2[N+](=O)[O-])cc1Br ZINC000180903888 941091811 /nfs/dbraw/zinc/09/18/11/941091811.db2.gz MOIWLANNASRZSU-UHFFFAOYSA-N 0 0 350.172 3.500 20 5 FHBDRN CCS[C@@H]1CCCC[C@@H]1NC(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000511512471 941094150 /nfs/dbraw/zinc/09/41/50/941094150.db2.gz LBTVUELSEKZKKS-DLBZAZTESA-N 0 0 365.499 3.843 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2cnn(CN3CCO[C@H](c4ccsc4)C3)c2)cc1 ZINC000122155775 941094398 /nfs/dbraw/zinc/09/43/98/941094398.db2.gz CFYGUJIUBYHPGN-SFHVURJKSA-N 0 0 370.434 3.551 20 5 FHBDRN Nc1cccc([N+](=O)[O-])c1C(=O)Nc1cccc(COCc2ccco2)c1 ZINC000180944674 941095105 /nfs/dbraw/zinc/09/51/05/941095105.db2.gz VDLJNVWREOTZPZ-UHFFFAOYSA-N 0 0 367.361 3.739 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])c2ncccc12)c1cnc(-c2ccccc2)nc1 ZINC000187418104 941095972 /nfs/dbraw/zinc/09/59/72/941095972.db2.gz AJETYRKREVTPCD-UHFFFAOYSA-N 0 0 371.356 3.852 20 5 FHBDRN O=[N+]([O-])c1ccccc1N[C@@H](CCO)c1ccccc1Br ZINC000541005513 941096027 /nfs/dbraw/zinc/09/60/27/941096027.db2.gz VMBIOKJMOUXHSV-ZDUSSCGKSA-N 0 0 351.200 3.893 20 5 FHBDRN CCOc1cc(NC2CCN(C(=O)c3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000180967585 941098102 /nfs/dbraw/zinc/09/81/02/941098102.db2.gz WUYRNHPOXDEDJN-UHFFFAOYSA-N 0 0 369.421 3.710 20 5 FHBDRN C[C@@H](CCc1ccccc1[N+](=O)[O-])Nc1cn(C)nc1-c1ccccn1 ZINC000613540201 941099327 /nfs/dbraw/zinc/09/93/27/941099327.db2.gz DZCLKRIALHPVFH-AWEZNQCLSA-N 0 0 351.410 3.824 20 5 FHBDRN CN(Cc1nc2cc([N+](=O)[O-])ccc2o1)Cc1nc(C(F)(F)F)cs1 ZINC000177177951 941106064 /nfs/dbraw/zinc/10/60/64/941106064.db2.gz OESCQPLAUSDCLM-UHFFFAOYSA-N 0 0 372.328 3.843 20 5 FHBDRN C[C@@H](NC(=O)N1Cc2ccccc2C2(CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000187581684 941106919 /nfs/dbraw/zinc/10/69/19/941106919.db2.gz ZQQDRWAEHQGZON-CQSZACIVSA-N 0 0 351.406 3.913 20 5 FHBDRN C[C@H](Cc1ccc(C(F)(F)F)cc1)NC(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000181071345 941106949 /nfs/dbraw/zinc/10/69/49/941106949.db2.gz DKTQVMLMCNZAHD-SNVBAGLBSA-N 0 0 367.327 3.557 20 5 FHBDRN CC(C)c1ccc(C(=O)Nc2ccc3c(c2)CCC(=O)N3C)cc1[N+](=O)[O-] ZINC000187628539 941110170 /nfs/dbraw/zinc/11/01/70/941110170.db2.gz QHBNRDWJTYIBLH-UHFFFAOYSA-N 0 0 367.405 3.880 20 5 FHBDRN Cc1nn(-c2ccccc2)cc1NC(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000181212882 941111021 /nfs/dbraw/zinc/11/10/21/941111021.db2.gz DSOBBRNDSLWOJW-UHFFFAOYSA-N 0 0 373.372 3.889 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1OC(F)F)N1CCc2ccc(F)cc21 ZINC000181153851 941111290 /nfs/dbraw/zinc/11/12/90/941111290.db2.gz GOYLHXCTMRJSCK-UHFFFAOYSA-N 0 0 352.268 3.538 20 5 FHBDRN Nc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(CCC(F)(F)F)cc1 ZINC000181175787 941112033 /nfs/dbraw/zinc/11/20/33/941112033.db2.gz WQZRDTILJQWRHG-UHFFFAOYSA-N 0 0 353.300 3.924 20 5 FHBDRN O=C(NCc1cccc([N+](=O)[O-])c1)Nc1ccccc1OCC(F)F ZINC000120148235 941114608 /nfs/dbraw/zinc/11/46/08/941114608.db2.gz IUCJOVFXAKKVRE-UHFFFAOYSA-N 0 0 351.309 3.560 20 5 FHBDRN CCOc1cc(C(=O)N[C@H]2CCCC[C@H]2C(C)C)c([N+](=O)[O-])cc1OC ZINC000103056310 941115074 /nfs/dbraw/zinc/11/50/74/941115074.db2.gz RRSUDIDXNPFEQT-ZFWWWQNUSA-N 0 0 364.442 3.947 20 5 FHBDRN C[C@H](NC(=O)Cc1cccc([N+](=O)[O-])c1)c1cccc(OC(F)(F)F)c1 ZINC000177304180 941115084 /nfs/dbraw/zinc/11/50/84/941115084.db2.gz CCZBQOSOLAQOEB-NSHDSACASA-N 0 0 368.311 3.913 20 5 FHBDRN COc1cc(C(=O)N[C@H]2CCCC[C@@H]2C(C)C)c([N+](=O)[O-])cc1OC ZINC000103057359 941115117 /nfs/dbraw/zinc/11/51/17/941115117.db2.gz LHDWQKDPVYDFOW-OCCSQVGLSA-N 0 0 350.415 3.557 20 5 FHBDRN Nc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(Br)c(Cl)c1 ZINC000181237738 941116647 /nfs/dbraw/zinc/11/66/47/941116647.db2.gz KJTOFYPXWPGXSO-UHFFFAOYSA-N 0 0 370.590 3.845 20 5 FHBDRN C[C@@H](NCc1cc(F)ccc1[N+](=O)[O-])c1cccc(N2CCOC2=O)c1 ZINC000181308026 941119988 /nfs/dbraw/zinc/11/99/88/941119988.db2.gz ADLGSWKECXHIKR-GFCCVEGCSA-N 0 0 359.357 3.541 20 5 FHBDRN COC(=O)COc1ccc(CNc2ccc(C3CC3)cc2)cc1[N+](=O)[O-] ZINC000616092892 941120269 /nfs/dbraw/zinc/12/02/69/941120269.db2.gz OGTAACKVHHFZIL-UHFFFAOYSA-N 0 0 356.378 3.636 20 5 FHBDRN Cc1c(NC(=O)CCCNc2ccc([N+](=O)[O-])cc2)cnn1CCC(C)C ZINC000122191638 941128535 /nfs/dbraw/zinc/12/85/35/941128535.db2.gz OBFXHZFGXFGZJT-UHFFFAOYSA-N 0 0 373.457 3.977 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)NC(C)(C)CC1CCCCCC1 ZINC000188902757 941128856 /nfs/dbraw/zinc/12/88/56/941128856.db2.gz JFIGJQHSHNRXCY-UHFFFAOYSA-N 0 0 350.463 3.745 20 5 FHBDRN O=C(C[C@@H]1CCCO1)Nc1ccc(OCc2ccccc2)cc1[N+](=O)[O-] ZINC000188953990 941131558 /nfs/dbraw/zinc/13/15/58/941131558.db2.gz GOZHBPMALLEOER-HNNXBMFYSA-N 0 0 356.378 3.681 20 5 FHBDRN NC(=O)c1ccc(C[NH2+][C@H](CC2CCC2)c2ccccc2)c([N+](=O)[O-])c1 ZINC000181359162 941132502 /nfs/dbraw/zinc/13/25/02/941132502.db2.gz YUODWNPGAIMWBI-GOSISDBHSA-N 0 0 353.422 3.715 20 5 FHBDRN COc1cc(CN[C@H]2CCOc3c(C)cccc32)c([N+](=O)[O-])cc1OC ZINC000188951136 941133049 /nfs/dbraw/zinc/13/30/49/941133049.db2.gz LKPPNKUGFTYGKN-HNNXBMFYSA-N 0 0 358.394 3.534 20 5 FHBDRN O=C(Cc1cnc2ccccc2c1)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000189028712 941142392 /nfs/dbraw/zinc/14/23/92/941142392.db2.gz UBIMFMFHIXODQG-UHFFFAOYSA-N 0 0 373.315 3.926 20 5 FHBDRN CSc1cccc(C(=O)N[C@@H](C)CCc2ccc(O)cc2)c1[N+](=O)[O-] ZINC000189004625 941143132 /nfs/dbraw/zinc/14/31/32/941143132.db2.gz MIKPECAYQYOSNG-LBPRGKRZSA-N 0 0 360.435 3.773 20 5 FHBDRN COc1cc(C(=O)N2CC[C@@H](c3ccccc3)[C@H]2C)cc([N+](=O)[O-])c1C ZINC000189102927 941145389 /nfs/dbraw/zinc/14/53/89/941145389.db2.gz PLXGWLJIKWLSHX-RHSMWYFYSA-N 0 0 354.406 3.930 20 5 FHBDRN O=c1c([N+](=O)[O-])cc(Br)cn1C/C=C/c1ccc(Cl)cc1 ZINC000189080747 941146500 /nfs/dbraw/zinc/14/65/00/941146500.db2.gz SNCNJKZDRLOPBQ-OWOJBTEDSA-N 0 0 369.602 3.886 20 5 FHBDRN CCSc1cc(CNC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)ccn1 ZINC000189115355 941146781 /nfs/dbraw/zinc/14/67/81/941146781.db2.gz WZCPKYJPNFCWBK-UHFFFAOYSA-N 0 0 351.815 3.685 20 5 FHBDRN Cc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2SCCO)c(Cl)c1 ZINC000136048971 941147537 /nfs/dbraw/zinc/14/75/37/941147537.db2.gz UYJIHBCBKLMQFP-UHFFFAOYSA-N 0 0 366.826 3.893 20 5 FHBDRN CCc1ccc(C(=O)Nc2ccc3nnc(C(C)C)n3c2)cc1[N+](=O)[O-] ZINC000189236054 941155079 /nfs/dbraw/zinc/15/50/79/941155079.db2.gz RZUYDFWSDYHZGA-UHFFFAOYSA-N 0 0 353.382 3.576 20 5 FHBDRN CC[C@@H](c1ccccc1)N(CC)C(=O)C(=O)Nc1cc(F)cc([N+](=O)[O-])c1 ZINC000472623291 941155610 /nfs/dbraw/zinc/15/56/10/941155610.db2.gz BCAPGQGCRNYJFA-KRWDZBQOSA-N 0 0 373.384 3.672 20 5 FHBDRN CC[C@]1(C)CN(C(=O)c2cc([N+](=O)[O-])ccc2SC(C)C)CCO1 ZINC000189330286 941156356 /nfs/dbraw/zinc/15/63/56/941156356.db2.gz HPGGMZASQOMSLL-QGZVFWFLSA-N 0 0 352.456 3.736 20 5 FHBDRN COC(=O)c1cnc(NC[C@H](c2ccccc2)C(F)(F)F)c([N+](=O)[O-])c1 ZINC000189393793 941156930 /nfs/dbraw/zinc/15/69/30/941156930.db2.gz YATWIWCXRUTNHS-GFCCVEGCSA-N 0 0 369.299 3.534 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCc1cc(F)ccc1OC ZINC000189416354 941157346 /nfs/dbraw/zinc/15/73/46/941157346.db2.gz XFSCWMGEVOYIST-CQSZACIVSA-N 0 0 360.385 3.628 20 5 FHBDRN CC[C@](C)(O)CN(Cc1ccccc1)C(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000189459034 941158371 /nfs/dbraw/zinc/15/83/71/941158371.db2.gz NJMODVODHYFAPR-NRFANRHFSA-N 0 0 370.449 3.717 20 5 FHBDRN COc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)c(C)c1 ZINC000181414012 941158720 /nfs/dbraw/zinc/15/87/20/941158720.db2.gz FMDMURYYXOQABR-UHFFFAOYSA-N 0 0 352.293 3.766 20 5 FHBDRN COC[C@H](Cc1ccccc1)N(C)C(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000189499775 941159369 /nfs/dbraw/zinc/15/93/69/941159369.db2.gz LTBLTUGOZOZLCV-YOEHRIQHSA-N 0 0 374.412 3.554 20 5 FHBDRN Cc1c([C@@H]2CCCN2C(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)cnn1C ZINC000120155507 941160439 /nfs/dbraw/zinc/16/04/39/941160439.db2.gz HZONBPVXNUATAV-INIZCTEOSA-N 0 0 357.414 3.623 20 5 FHBDRN COc1cc(C(=O)N2CCC[C@H](Nc3ccccc3)C2)cc([N+](=O)[O-])c1C ZINC000189558283 941161252 /nfs/dbraw/zinc/16/12/52/941161252.db2.gz KNYCEROCGALQHA-KRWDZBQOSA-N 0 0 369.421 3.629 20 5 FHBDRN COc1cnccc1[C@H](C)NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000189576172 941161540 /nfs/dbraw/zinc/16/15/40/941161540.db2.gz MTUWRQMSAMYEGZ-JTQLQIEISA-N 0 0 357.391 3.704 20 5 FHBDRN Cc1ccc(CC(=O)N(C)c2cccc([N+](=O)[O-])c2)cc1Br ZINC000189596265 941214000 /nfs/dbraw/zinc/21/40/00/941214000.db2.gz YISHHWLPRXTMRL-UHFFFAOYSA-N 0 0 363.211 3.871 20 5 FHBDRN CC[C@H](CNC(=O)N(C)CCc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000549101729 941214615 /nfs/dbraw/zinc/21/46/15/941214615.db2.gz UJLIOHPFGGMHRV-QGZVFWFLSA-N 0 0 355.438 3.973 20 5 FHBDRN C[C@@H](Oc1cccc(Br)c1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000014738080 941232369 /nfs/dbraw/zinc/23/23/69/941232369.db2.gz SVLJDOVFQDVBJU-SNVBAGLBSA-N 0 0 365.183 3.763 20 5 FHBDRN C[C@H]1CO[C@H](c2ccccc2)CN1C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000066710088 941265251 /nfs/dbraw/zinc/26/52/51/941265251.db2.gz FMSFDZQLHLAITD-UGSOOPFHSA-N 0 0 365.389 3.678 20 5 FHBDRN O=C(Nc1c[nH]nc1-c1ccccc1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000178507993 941268156 /nfs/dbraw/zinc/26/81/56/941268156.db2.gz MFIKBFLNWHEWNO-UHFFFAOYSA-N 0 0 363.377 3.812 20 5 FHBDRN C[C@H](C1CC1)n1cc(NC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)cn1 ZINC000189777869 941276522 /nfs/dbraw/zinc/27/65/22/941276522.db2.gz GZDXHAMRIVCCAG-CYBMUJFWSA-N 0 0 369.425 3.959 20 5 FHBDRN Cc1ccc(C(=O)N2CC3(CCOCC3)c3ccccc32)cc1[N+](=O)[O-] ZINC000189781925 941276876 /nfs/dbraw/zinc/27/68/76/941276876.db2.gz OUYNIVNKMUOSKS-UHFFFAOYSA-N 0 0 352.390 3.612 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N2C[C@H](C)Oc3c(Cl)cccc32)c1 ZINC000189840655 941287645 /nfs/dbraw/zinc/28/76/45/941287645.db2.gz XEMULDXXVNGKHB-JTQLQIEISA-N 0 0 362.769 3.685 20 5 FHBDRN COc1cc(C(=O)Nc2ccc(C(F)(F)F)nc2)cc([N+](=O)[O-])c1C ZINC000189861923 941290249 /nfs/dbraw/zinc/29/02/49/941290249.db2.gz OTVJLBIURBIGIK-UHFFFAOYSA-N 0 0 355.272 3.578 20 5 FHBDRN Cc1cc(C(F)(F)F)ccc1CNC(=O)COc1ccccc1[N+](=O)[O-] ZINC000189853052 941290572 /nfs/dbraw/zinc/29/05/72/941290572.db2.gz OBJDLWYDUISYKA-UHFFFAOYSA-N 0 0 368.311 3.617 20 5 FHBDRN Cc1ccc([C@@H]2CCCCN2C(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000189908806 941299184 /nfs/dbraw/zinc/29/91/84/941299184.db2.gz JIMYIORJDLFNDM-SFHVURJKSA-N 0 0 367.405 3.596 20 5 FHBDRN Cc1c(C(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)oc2c1C(=O)CCC2 ZINC000178833506 941311359 /nfs/dbraw/zinc/31/13/59/941311359.db2.gz OLQPKJWOPKWXRM-UHFFFAOYSA-N 0 0 368.389 3.820 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H](n3cccn3)Cc3ccccc32)c1 ZINC000072527092 941325905 /nfs/dbraw/zinc/32/59/05/941325905.db2.gz WUMCSWGBVJEGMN-INIZCTEOSA-N 0 0 362.389 3.544 20 5 FHBDRN Cc1ccc(C(=O)OCC(=O)Nc2ccc([N+](=O)[O-])cc2C)cc1Cl ZINC000728675420 941332821 /nfs/dbraw/zinc/33/28/21/941332821.db2.gz GPKUMTQGVQJBHC-UHFFFAOYSA-N 0 0 362.769 3.661 20 5 FHBDRN COc1ccc(NC(=O)NCCc2c[nH]c3c2cccc3C)cc1[N+](=O)[O-] ZINC000541097853 941359935 /nfs/dbraw/zinc/35/99/35/941359935.db2.gz DAXLMTODRCQRAS-UHFFFAOYSA-N 0 0 368.393 3.757 20 5 FHBDRN CCOC(=O)[C@H](N[C@@H](C)CCc1ccccc1[N+](=O)[O-])c1cccc(O)c1 ZINC000190027734 941368163 /nfs/dbraw/zinc/36/81/63/941368163.db2.gz BOLISHGWVCEDLH-IFXJQAMLSA-N 0 0 372.421 3.516 20 5 FHBDRN CCOC(=O)[C@H](NCc1ccc(C(C)C)c([N+](=O)[O-])c1)c1cccc(O)c1 ZINC000190026913 941368245 /nfs/dbraw/zinc/36/82/45/941368245.db2.gz QHINNSVVGSIZEM-LJQANCHMSA-N 0 0 372.421 3.818 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ccnn2-c2ccccc2)c1 ZINC000072534948 941374788 /nfs/dbraw/zinc/37/47/88/941374788.db2.gz MHRUTDQBRGNBCJ-UHFFFAOYSA-N 0 0 354.391 3.755 20 5 FHBDRN Cc1c(NC(=O)CCNc2ccccc2[N+](=O)[O-])cnn1CCC(C)C ZINC000122281059 941394527 /nfs/dbraw/zinc/39/45/27/941394527.db2.gz MIHYATKBDJJBPJ-UHFFFAOYSA-N 0 0 359.430 3.587 20 5 FHBDRN CC(=O)c1ccc(-c2nc(CCNc3ccccc3[N+](=O)[O-])no2)cc1 ZINC000472646587 941405904 /nfs/dbraw/zinc/40/59/04/941405904.db2.gz AQAVHKMACRASGI-UHFFFAOYSA-N 0 0 352.350 3.502 20 5 FHBDRN CC(C)[N@H+](CC(=O)[O-])Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000414654719 941432472 /nfs/dbraw/zinc/43/24/72/941432472.db2.gz ITMGZGOKYIZFLQ-UHFFFAOYSA-N 0 0 362.357 3.821 20 5 FHBDRN CC1(C)CN(c2cc(C(F)(F)C(F)(F)F)ncc2[N+](=O)[O-])CCCO1 ZINC000377075614 941512608 /nfs/dbraw/zinc/51/26/08/941512608.db2.gz CFYPLPGKAXPCIG-UHFFFAOYSA-N 0 0 369.290 3.649 20 5 FHBDRN CCC(=O)c1ccc(N[C@H](C)c2nnc3n2CCCCC3)c([N+](=O)[O-])c1 ZINC000377094468 941514224 /nfs/dbraw/zinc/51/42/24/941514224.db2.gz VQKHGFUGGXGEBQ-GFCCVEGCSA-N 0 0 357.414 3.679 20 5 FHBDRN CC[C@@H](NC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)c1nc2ccccc2[nH]1 ZINC000066766574 941516024 /nfs/dbraw/zinc/51/60/24/941516024.db2.gz BDFJKZLREVUSCJ-GFCCVEGCSA-N 0 0 363.377 3.834 20 5 FHBDRN COc1cc(NC2CCN(c3sccc3[N+](=O)[O-])CC2)cc(OC)c1 ZINC000302033691 941523871 /nfs/dbraw/zinc/52/38/71/941523871.db2.gz SZUUTYBDKVDJNR-UHFFFAOYSA-N 0 0 363.439 3.754 20 5 FHBDRN CCCCN1CCc2ccc(NC(=O)Cc3ccc([N+](=O)[O-])cc3)cc21 ZINC000472665218 941526089 /nfs/dbraw/zinc/52/60/89/941526089.db2.gz WBWOLTUBSQZTIJ-UHFFFAOYSA-N 0 0 353.422 3.939 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CCC=C(c2ccco2)C1 ZINC000377169266 941535105 /nfs/dbraw/zinc/53/51/05/941535105.db2.gz VLAGEWDGTPREHW-UHFFFAOYSA-N 0 0 351.362 3.528 20 5 FHBDRN Cc1nc(CO[C@H]2CCN(c3ccc4cc([N+](=O)[O-])ccc4n3)C2)cs1 ZINC000377179356 941538612 /nfs/dbraw/zinc/53/86/12/941538612.db2.gz NAFSISFPLNBGNT-INIZCTEOSA-N 0 0 370.434 3.703 20 5 FHBDRN CC[C@@H](c1cccc(OC)c1)N(C)C(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-] ZINC000564750680 941541773 /nfs/dbraw/zinc/54/17/73/941541773.db2.gz RSXWFJQVNJADCP-AWEZNQCLSA-N 0 0 360.414 3.673 20 5 FHBDRN Cc1nc2c(o1)CCC[C@@H]2NCc1ccc(Br)cc1[N+](=O)[O-] ZINC000926848664 941573277 /nfs/dbraw/zinc/57/32/77/941573277.db2.gz CLMULXLJNIEHAG-LBPRGKRZSA-N 0 0 366.215 3.821 20 5 FHBDRN C[C@@H](CSC(F)(F)F)C(=O)Nc1ccnn1-c1ccc([N+](=O)[O-])cc1 ZINC001125857036 941575638 /nfs/dbraw/zinc/57/56/38/941575638.db2.gz FVGOYIYVXBXJNM-VIFPVBQESA-N 0 0 374.344 3.608 20 5 FHBDRN CC(=O)N1CCN(c2ccc([N+](=O)[O-])c3cnccc32)CC12CCCCC2 ZINC000408037923 941575874 /nfs/dbraw/zinc/57/58/74/941575874.db2.gz GOMNJPYZAPACBJ-UHFFFAOYSA-N 0 0 368.437 3.514 20 5 FHBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)N1CC2(CCCC2)c2ccccc21 ZINC000545357314 941580156 /nfs/dbraw/zinc/58/01/56/941580156.db2.gz ZMCIJZGLAQXWEN-UHFFFAOYSA-N 0 0 372.446 3.757 20 5 FHBDRN CC(=O)N[C@@H](C)C1CCN(c2cc(C)c(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000549173725 941585768 /nfs/dbraw/zinc/58/57/68/941585768.db2.gz PWQDRUMDOQNJGL-NSHDSACASA-N 0 0 373.375 3.663 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(N[C@H](C)c2cc(OC)c(OC)cc2C)c1 ZINC000541113164 941596756 /nfs/dbraw/zinc/59/67/56/941596756.db2.gz MPLPJFQMQWSQOC-GFCCVEGCSA-N 0 0 374.393 3.880 20 5 FHBDRN O=C(Nc1cnc2c(c1)CCCC2)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000541107890 941597630 /nfs/dbraw/zinc/59/76/30/941597630.db2.gz HRJOUNMDVAYHDE-UHFFFAOYSA-N 0 0 363.320 3.722 20 5 FHBDRN C[C@@H]1COc2ccccc2CN1C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000541111253 941597797 /nfs/dbraw/zinc/59/77/97/941597797.db2.gz CLEXAGICJSPACC-CYBMUJFWSA-N 0 0 367.405 3.592 20 5 FHBDRN CN(C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1)[C@H]1CCCc2cccnc21 ZINC000377257950 941598552 /nfs/dbraw/zinc/59/85/52/941598552.db2.gz QCXYDMWSGSWSCO-HNNXBMFYSA-N 0 0 361.348 3.618 20 5 FHBDRN Cc1cccc(NC[C@@H](CO)Cc2cc(F)c(F)c(F)c2)c1[N+](=O)[O-] ZINC000549183423 941603585 /nfs/dbraw/zinc/60/35/85/941603585.db2.gz NJQASNDNOJAQPO-LBPRGKRZSA-N 0 0 354.328 3.584 20 5 FHBDRN CC(=O)c1cc(N2CC(C)(C)O[C@@](C)(C(F)(F)F)C2)ccc1[N+](=O)[O-] ZINC000549194708 941621005 /nfs/dbraw/zinc/62/10/05/941621005.db2.gz BIUBDVWJCWSAEV-OAHLLOKOSA-N 0 0 360.332 3.734 20 5 FHBDRN CC(C)(C)OC(=O)CC[C@@H]1CCCN(Cc2csc([N+](=O)[O-])c2)C1 ZINC000412069198 941621392 /nfs/dbraw/zinc/62/13/92/941621392.db2.gz NGXJZYKQRQFAJR-ZDUSSCGKSA-N 0 0 354.472 3.990 20 5 FHBDRN CC(=O)Nc1cc(C(=O)N2CCCCc3cc([N+](=O)[O-])ccc32)ccc1F ZINC000892858269 941628219 /nfs/dbraw/zinc/62/82/19/941628219.db2.gz IYOJRPBDYHAAKY-UHFFFAOYSA-N 0 0 371.368 3.675 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(NC[C@@H](c2ccccc2)C(C)(C)CO)c1 ZINC000541114514 941631711 /nfs/dbraw/zinc/63/17/11/941631711.db2.gz RKKJBDSOJHYTGJ-INIZCTEOSA-N 0 0 372.421 3.596 20 5 FHBDRN Cc1ccccc1-c1csc(=O)n1CCOc1cccc([N+](=O)[O-])c1 ZINC000541123395 941643828 /nfs/dbraw/zinc/64/38/28/941643828.db2.gz RIRBJIMVNIYQIM-UHFFFAOYSA-N 0 0 356.403 3.872 20 5 FHBDRN C[C@@H](CC(=O)N(c1cccc([N+](=O)[O-])c1)C1CCCC1)c1cnn(C)c1 ZINC000415164982 941647055 /nfs/dbraw/zinc/64/70/55/941647055.db2.gz YXXDPHUYHYHGPS-AWEZNQCLSA-N 0 0 356.426 3.798 20 5 FHBDRN Cc1cc([C@H]2CCCN2C(=O)Nc2cccc([N+](=O)[O-])c2Cl)no1 ZINC000377329873 941652410 /nfs/dbraw/zinc/65/24/10/941652410.db2.gz JTNAUBOGCMLTQD-GFCCVEGCSA-N 0 0 350.762 3.914 20 5 FHBDRN COC(=O)c1cnc(NCCc2cc3ccccc3s2)c([N+](=O)[O-])c1 ZINC000549230985 941681786 /nfs/dbraw/zinc/68/17/86/941681786.db2.gz WTPTWOLGPLIJJF-UHFFFAOYSA-N 0 0 357.391 3.646 20 5 FHBDRN O=[N+]([O-])c1cccc(F)c1CN1CCN(c2cncc3ccccc32)CC1 ZINC000472755182 941681838 /nfs/dbraw/zinc/68/18/38/941681838.db2.gz UKJXCLOXHJOIOG-UHFFFAOYSA-N 0 0 366.396 3.604 20 5 FHBDRN CCNc1ccc(C(=O)Nc2nc3c(cccc3Cl)[nH]2)cc1[N+](=O)[O-] ZINC000583346467 941697418 /nfs/dbraw/zinc/69/74/18/941697418.db2.gz SRTJWYUAUKUAMG-UHFFFAOYSA-N 0 0 359.773 3.809 20 5 FHBDRN COc1ccc(C(=O)Nc2cc(-c3ccccc3F)no2)cc1[N+](=O)[O-] ZINC000729271052 941703675 /nfs/dbraw/zinc/70/36/75/941703675.db2.gz SORLCTBEGNWOHV-UHFFFAOYSA-N 0 0 357.297 3.650 20 5 FHBDRN COc1ccc(OC)c(CC(=O)Nc2cc3cccnc3c3ncccc23)c1 ZINC001143495335 941716904 /nfs/dbraw/zinc/71/69/04/941716904.db2.gz XNBBIKNPAGUVIT-UHFFFAOYSA-N 0 0 373.412 3.981 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2cc(Cl)c(Cl)cn2)c1 ZINC000549243664 941724769 /nfs/dbraw/zinc/72/47/69/941724769.db2.gz DHIPVVHBMBXJMD-UHFFFAOYSA-N 0 0 356.165 3.948 20 5 FHBDRN Cc1onc(-c2cccnc2)c1-c1nc(Cc2ccc([N+](=O)[O-])cc2)no1 ZINC000377442269 941727877 /nfs/dbraw/zinc/72/78/77/941727877.db2.gz LRFJQPOZZKLKPE-UHFFFAOYSA-N 0 0 363.333 3.594 20 5 FHBDRN C[C@H]1C[C@H](CC(=O)OCC(=O)Nc2cccc([N+](=O)[O-])c2)CC(C)(C)C1 ZINC001125859768 941735041 /nfs/dbraw/zinc/73/50/41/941735041.db2.gz YCQVLIGZZZRXJT-UONOGXRCSA-N 0 0 362.426 3.929 20 5 FHBDRN O=C(c1ccccc1)N1CCC[C@@H]1c1nc(-c2ccc([N+](=O)[O-])s2)no1 ZINC000377460565 941741080 /nfs/dbraw/zinc/74/10/80/941741080.db2.gz RRAFYHVBOFSZFQ-GFCCVEGCSA-N 0 0 370.390 3.684 20 5 FHBDRN O=[N+]([O-])c1ccc(-n2ccc(-c3nc(-c4ncsc4Cl)no3)n2)cc1 ZINC000463183672 941751619 /nfs/dbraw/zinc/75/16/19/941751619.db2.gz KZNWWTSSBANZQH-UHFFFAOYSA-N 0 0 374.769 3.607 20 5 FHBDRN Cc1ccc(C(=O)NCC2CC2)cc1NCc1ccc(C)c([N+](=O)[O-])c1 ZINC000190358782 941754255 /nfs/dbraw/zinc/75/42/55/941754255.db2.gz HAHHCFLIZYASGQ-UHFFFAOYSA-N 0 0 353.422 3.964 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N[C@@H](C)c1nccn1-c1ccccc1 ZINC000377483864 941756619 /nfs/dbraw/zinc/75/66/19/941756619.db2.gz YSTYDYUOPVRDJN-AWEZNQCLSA-N 0 0 350.378 3.580 20 5 FHBDRN O=C(N[C@H]1COc2cccc(Cl)c21)c1c(Cl)cccc1[N+](=O)[O-] ZINC000377479565 941759412 /nfs/dbraw/zinc/75/94/12/941759412.db2.gz VGTASODLMJILPI-JTQLQIEISA-N 0 0 353.161 3.765 20 5 FHBDRN O=C(COc1ccc(Br)cc1[N+](=O)[O-])Nc1cccc(F)c1 ZINC000151149632 941760598 /nfs/dbraw/zinc/76/05/98/941760598.db2.gz GOEFZBNREYPBPS-UHFFFAOYSA-N 0 0 369.146 3.514 20 5 FHBDRN CN1CCN(C(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)c2ccccc21 ZINC000151146206 941761644 /nfs/dbraw/zinc/76/16/44/941761644.db2.gz GHIANNLBZNGSSY-UHFFFAOYSA-N 0 0 365.311 3.710 20 5 FHBDRN CSCCN(C)[C@H](C(=O)Nc1ccc(C)cc1[N+](=O)[O-])c1ccccc1 ZINC000151142792 941761874 /nfs/dbraw/zinc/76/18/74/941761874.db2.gz QLBGNJLUTBYTIG-SFHVURJKSA-N 0 0 373.478 3.878 20 5 FHBDRN O=[N+]([O-])c1cc2ccccc2nc1N1CCC(Oc2ccccn2)CC1 ZINC000473524735 941763556 /nfs/dbraw/zinc/76/35/56/941763556.db2.gz IDDTYJLCMHNFQO-UHFFFAOYSA-N 0 0 350.378 3.586 20 5 FHBDRN CC[C@H]1CCCCN1C(=O)COc1ccc(Br)cc1[N+](=O)[O-] ZINC000151154023 941763593 /nfs/dbraw/zinc/76/35/93/941763593.db2.gz VEGZOVNDUVAOIE-LBPRGKRZSA-N 0 0 371.231 3.527 20 5 FHBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CCC[C@@H]1C1CCC1 ZINC000120675167 941765376 /nfs/dbraw/zinc/76/53/76/941765376.db2.gz QOAMLUQYODNAEA-CQSZACIVSA-N 0 0 353.216 3.762 20 5 FHBDRN O=[N+]([O-])c1ccc(NC[C@H](O)COc2ccc(C(F)(F)F)cc2)c(F)c1 ZINC000513173408 941766306 /nfs/dbraw/zinc/76/63/06/941766306.db2.gz JHSJYOAAFVNXAS-LBPRGKRZSA-N 0 0 374.290 3.605 20 5 FHBDRN O=C([C@@H]1COCC[C@@H]1c1ccccc1)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000415343393 941771476 /nfs/dbraw/zinc/77/14/76/941771476.db2.gz LKUQTIFJUAKGHV-SJLPKXTDSA-N 0 0 366.417 3.694 20 5 FHBDRN CCC(=O)c1ccc(N2CCC(Nc3nccs3)CC2)c([N+](=O)[O-])c1 ZINC000365580249 941772592 /nfs/dbraw/zinc/77/25/92/941772592.db2.gz FVSDVRLPAKSECI-UHFFFAOYSA-N 0 0 360.439 3.725 20 5 FHBDRN C[C@@H]([C@@H]1Cc2ccccc2O1)N(C)C(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000433569743 941773738 /nfs/dbraw/zinc/77/37/38/941773738.db2.gz ISFOKLZYVWPCEE-SGTLLEGYSA-N 0 0 374.824 3.641 20 5 FHBDRN C[C@H]([C@H]1Cc2ccccc2O1)N(C)C(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000433569742 941773979 /nfs/dbraw/zinc/77/39/79/941773979.db2.gz ISFOKLZYVWPCEE-KZULUSFZSA-N 0 0 374.824 3.641 20 5 FHBDRN CC1(C)CC[C@H](C(=O)N(CC2CC2)c2ccc(Cl)c([N+](=O)[O-])c2)O1 ZINC000783030746 941779985 /nfs/dbraw/zinc/77/99/85/941779985.db2.gz YWJUBTRYLGGOMC-OAHLLOKOSA-N 0 0 352.818 3.949 20 5 FHBDRN CCC(=O)c1cccc(NS(=O)(=O)c2cc([N+](=O)[O-])cc(C)c2C)c1 ZINC000433592112 941780932 /nfs/dbraw/zinc/78/09/32/941780932.db2.gz FHYAPHSRKIBKGL-UHFFFAOYSA-N 0 0 362.407 3.605 20 5 FHBDRN O=[N+]([O-])c1ccn(CCN(Cc2c(Cl)cccc2Cl)C2CC2)n1 ZINC000513230914 941788382 /nfs/dbraw/zinc/78/83/82/941788382.db2.gz GEVQDZPCERDLQN-UHFFFAOYSA-N 0 0 355.225 3.763 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@@H](c3cccc(F)c3)C2)c1 ZINC000549267230 941795228 /nfs/dbraw/zinc/79/52/28/941795228.db2.gz JNPDHQRZVUIIGL-CQSZACIVSA-N 0 0 358.369 3.762 20 5 FHBDRN COc1ccccc1-c1ncc(CN(C)Cc2ccccc2[N+](=O)[O-])cn1 ZINC000430002314 941802604 /nfs/dbraw/zinc/80/26/04/941802604.db2.gz AOIBUUHRBUXPJG-UHFFFAOYSA-N 0 0 364.405 3.692 20 5 FHBDRN O=C(N[C@@H](Cc1ccccc1)C1CC1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412130394 941813285 /nfs/dbraw/zinc/81/32/85/941813285.db2.gz PMYJEXOEDCLGOM-ZCNNSNEGSA-N 0 0 350.418 3.836 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN1C[C@@H](C)C[C@@H]1c1ccccc1 ZINC000513257432 941821307 /nfs/dbraw/zinc/82/13/07/941821307.db2.gz QTHFMJNGIHPREW-KBXCAEBGSA-N 0 0 369.421 3.625 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N(C)[C@H](C)c2ccccc2Cl)c1[N+](=O)[O-] ZINC000433669812 941827438 /nfs/dbraw/zinc/82/74/38/941827438.db2.gz MSTCPYCUDGDJHV-SNVBAGLBSA-N 0 0 350.806 3.928 20 5 FHBDRN COCC(C)(C)CCCNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F ZINC000290306846 941827831 /nfs/dbraw/zinc/82/78/31/941827831.db2.gz COXUYLLEVAMAMD-UHFFFAOYSA-N 0 0 354.422 3.581 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N(C)[C@H](C)c2c(F)cccc2F)c1[N+](=O)[O-] ZINC000433675249 941829378 /nfs/dbraw/zinc/82/93/78/941829378.db2.gz PERRUXOHZWJLAW-SECBINFHSA-N 0 0 352.341 3.553 20 5 FHBDRN CC(C)O[C@@H](C(=O)N(C)CCc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000513298083 941834962 /nfs/dbraw/zinc/83/49/62/941834962.db2.gz DGCHAZZJCRSANC-LJQANCHMSA-N 0 0 356.422 3.762 20 5 FHBDRN CC(C)O[C@H](C(=O)N(C)CCc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000513298082 941835158 /nfs/dbraw/zinc/83/51/58/941835158.db2.gz DGCHAZZJCRSANC-IBGZPJMESA-N 0 0 356.422 3.762 20 5 FHBDRN COc1cc([C@H](C)NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)ccn1 ZINC000513284485 941836990 /nfs/dbraw/zinc/83/69/90/941836990.db2.gz NXJHWTIBSGHHHN-AWEZNQCLSA-N 0 0 372.425 3.680 20 5 FHBDRN O=c1c(F)cc([N+](=O)[O-])cn1CCCCOc1cccc(C(F)(F)F)c1 ZINC000576703401 941837951 /nfs/dbraw/zinc/83/79/51/941837951.db2.gz RETWTBXYOXGTCE-UHFFFAOYSA-N 0 0 374.290 3.774 20 5 FHBDRN Cc1cccc(O[C@H](C)CNC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)c1 ZINC000412143025 941840759 /nfs/dbraw/zinc/84/07/59/941840759.db2.gz IJSNURKSOHQCNG-MDASCCDHSA-N 0 0 354.406 3.590 20 5 FHBDRN Cn1ccnc1[C@@H]1CCN(c2c3cccc(Cl)c3ncc2[N+](=O)[O-])C1 ZINC000892986006 941841994 /nfs/dbraw/zinc/84/19/94/941841994.db2.gz SPNLOEIYCURRGX-LLVKDONJSA-N 0 0 357.801 3.524 20 5 FHBDRN Cc1cc(C2CCN(C(=O)c3c(C)cc(Cl)cc3[N+](=O)[O-])CC2)[nH]n1 ZINC000278817862 941842700 /nfs/dbraw/zinc/84/27/00/941842700.db2.gz UHCQSTKNKUAQEW-UHFFFAOYSA-N 0 0 362.817 3.608 20 5 FHBDRN Cc1c(CNC(=O)NCc2ccccc2N2CCCC2)cccc1[N+](=O)[O-] ZINC000616204176 941849537 /nfs/dbraw/zinc/84/95/37/941849537.db2.gz VNLXVTWMWYAGNW-UHFFFAOYSA-N 0 0 368.437 3.503 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N(C)[C@H](C)c2cccc(Cl)c2)c1[N+](=O)[O-] ZINC000433707226 941851918 /nfs/dbraw/zinc/85/19/18/941851918.db2.gz BJZXJQMUGLOUMH-SNVBAGLBSA-N 0 0 350.806 3.928 20 5 FHBDRN O=C(C[C@H](c1ccc(O)cc1)C1CC1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000412160877 941853491 /nfs/dbraw/zinc/85/34/91/941853491.db2.gz AGCQDEPSSVRRTR-FQEVSTJZSA-N 0 0 366.417 3.769 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])NCC1(c2ccccc2)CCC1 ZINC000047624049 941854621 /nfs/dbraw/zinc/85/46/21/941854621.db2.gz NBSHKVKVUZWVSA-UHFFFAOYSA-N 0 0 354.406 3.602 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N2CCC(Cc3ccccc3F)CC2)c1[N+](=O)[O-] ZINC000433742353 941860961 /nfs/dbraw/zinc/86/09/61/941860961.db2.gz NEFHDYVEEOAUNZ-UHFFFAOYSA-N 0 0 374.416 3.675 20 5 FHBDRN O=C1[C@H](Nc2ccc(C(F)(F)F)cc2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000433743026 941861169 /nfs/dbraw/zinc/86/11/69/941861169.db2.gz ULOOFRGSDSXGFI-OAHLLOKOSA-N 0 0 365.311 3.831 20 5 FHBDRN Cc1sc(S(=O)(=O)N2CC[C@H](C)c3ccccc32)cc1[N+](=O)[O-] ZINC000119018397 941863518 /nfs/dbraw/zinc/86/35/18/941863518.db2.gz BUYWTGMKJQIEDF-JTQLQIEISA-N 0 0 352.437 3.667 20 5 FHBDRN O=C(c1ccc(N2CCCC2)c([N+](=O)[O-])c1)N1CC[C@H](CC(F)(F)F)C1 ZINC000433736239 941864202 /nfs/dbraw/zinc/86/42/02/941864202.db2.gz QWINUJXSUAQFQG-GFCCVEGCSA-N 0 0 371.359 3.610 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CCS[C@@H]3CCCC[C@H]32)ccc1[N+](=O)[O-] ZINC000412175801 941864421 /nfs/dbraw/zinc/86/44/21/941864421.db2.gz PBIKQQWBZVOGMO-NVXWUHKLSA-N 0 0 364.467 3.882 20 5 FHBDRN O=C(Nc1ncc(C(F)(F)F)s1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000415509889 941867631 /nfs/dbraw/zinc/86/76/31/941867631.db2.gz ISQXHDXNUQDGSR-VHSXEESVSA-N 0 0 357.313 3.812 20 5 FHBDRN CNC(=O)c1cc([N+](=O)[O-])ccc1N[C@H]1CC[C@H](c2cccc(F)c2)C1 ZINC000480779402 941867655 /nfs/dbraw/zinc/86/76/55/941867655.db2.gz KGXKYWLYOLPSSS-ZFWWWQNUSA-N 0 0 357.385 3.842 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N(C)[C@H](C)Cc2ccc(Cl)cc2)c1[N+](=O)[O-] ZINC000433770108 941876178 /nfs/dbraw/zinc/87/61/78/941876178.db2.gz BIPTVEWLNBGSTE-LLVKDONJSA-N 0 0 364.833 3.798 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1CN(Cc1cc[nH]n1)Cc1ccccc1 ZINC000513380966 941876900 /nfs/dbraw/zinc/87/69/00/941876900.db2.gz NSLMLWJSYJBTCX-UHFFFAOYSA-N 0 0 366.421 3.919 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N(Cc2ccccc2)[C@H](C)C2CC2)c1[N+](=O)[O-] ZINC000433771412 941877876 /nfs/dbraw/zinc/87/78/76/941877876.db2.gz PSZMIGMBQFEBDP-CYBMUJFWSA-N 0 0 356.426 3.882 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)NCCOc2cccc(C(C)(C)C)c2)c1[N+](=O)[O-] ZINC000433764079 941881180 /nfs/dbraw/zinc/88/11/80/941881180.db2.gz GBHUWXXDYZJUOS-UHFFFAOYSA-N 0 0 374.441 3.548 20 5 FHBDRN CCOCCC1(CNC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)CCCC1 ZINC000412191266 941890510 /nfs/dbraw/zinc/89/05/10/941890510.db2.gz YFLDUDBEQVMYOY-ZWKOTPCHSA-N 0 0 360.454 3.802 20 5 FHBDRN CC(C)Oc1cc(C(=O)N(c2ccccc2)[C@@H]2CCOC2)ccc1[N+](=O)[O-] ZINC000415543302 941892728 /nfs/dbraw/zinc/89/27/28/941892728.db2.gz RQVRSAYVAIJKND-QGZVFWFLSA-N 0 0 370.405 3.818 20 5 FHBDRN CCC[C@@H]1CCC[C@H]1c1nc(-c2ccc(-n3cncn3)c([N+](=O)[O-])c2)no1 ZINC000453207169 941895458 /nfs/dbraw/zinc/89/54/58/941895458.db2.gz ZCXRYOXRUUHVMU-TZMCWYRMSA-N 0 0 368.397 3.909 20 5 FHBDRN CO[C@H]1CC[C@H](NC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)C1 ZINC000472833268 941897337 /nfs/dbraw/zinc/89/73/37/941897337.db2.gz NDTCZZZJLGYPNE-IRXDYDNUSA-N 0 0 369.421 3.504 20 5 FHBDRN Cc1cccc(NC(=O)Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)c1C ZINC000103463433 941899898 /nfs/dbraw/zinc/89/98/98/941899898.db2.gz BKEHCZWGUSBZEV-UHFFFAOYSA-N 0 0 350.378 3.714 20 5 FHBDRN C[C@@H]1CC[C@H](c2nc(-c3ccc(-n4cncn4)c([N+](=O)[O-])c3)no2)C[C@@H]1C ZINC000453204076 941911196 /nfs/dbraw/zinc/91/11/96/941911196.db2.gz VIHXZVZTDCELNL-DYEKYZERSA-N 0 0 368.397 3.765 20 5 FHBDRN O=C(NCC1(Cc2ccccc2)CC1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412203376 941912006 /nfs/dbraw/zinc/91/20/06/941912006.db2.gz UWYUBNVQZATTKQ-RBUKOAKNSA-N 0 0 350.418 3.837 20 5 FHBDRN CC(C)(CNC(=O)c1cc2cc([N+](=O)[O-])ccc2o1)Oc1ccccc1 ZINC000513426674 941915580 /nfs/dbraw/zinc/91/55/80/941915580.db2.gz KQOKSDPWFGZILI-UHFFFAOYSA-N 0 0 354.362 3.928 20 5 FHBDRN CC(C)Oc1cc(C(=O)N[C@H]2CCOC3(CCCC3)C2)ccc1[N+](=O)[O-] ZINC000412212909 941921167 /nfs/dbraw/zinc/92/11/67/941921167.db2.gz TVXOOPDSCMSECV-HNNXBMFYSA-N 0 0 362.426 3.604 20 5 FHBDRN O=C(NCCOCc1ccc(Cl)cc1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412213684 941921799 /nfs/dbraw/zinc/92/17/99/941921799.db2.gz KZXLIBPIAFJLFD-ZWKOTPCHSA-N 0 0 374.824 3.685 20 5 FHBDRN CCC[C@]1(CO)CCN(C(=O)c2cc([N+](=O)[O-])ccc2SC(C)C)C1 ZINC000365662353 941922145 /nfs/dbraw/zinc/92/21/45/941922145.db2.gz NOWPJQCMTMHBTK-SFHVURJKSA-N 0 0 366.483 3.720 20 5 FHBDRN CC(C)(C)Oc1cccc(CNC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)n1 ZINC000412225202 941940053 /nfs/dbraw/zinc/94/00/53/941940053.db2.gz JXTBLCXDJLVPCO-DLBZAZTESA-N 0 0 369.421 3.587 20 5 FHBDRN Cc1cc(=NC(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)[nH]n1[C@H](C)C1CC1 ZINC000412238427 941950306 /nfs/dbraw/zinc/95/03/06/941950306.db2.gz ABVDWQXQFCOCDX-CYBMUJFWSA-N 0 0 372.425 3.532 20 5 FHBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1C[C@@]1(F)c1ccccc1 ZINC000412242653 941953794 /nfs/dbraw/zinc/95/37/94/941953794.db2.gz MZTVGFAMSHLFEP-MAUKXSAKSA-N 0 0 362.788 3.792 20 5 FHBDRN C[C@H]1CCc2onc(C(=O)Nc3ccc([N+](=O)[O-])c4ncccc34)c2C1 ZINC000433864396 941953855 /nfs/dbraw/zinc/95/38/55/941953855.db2.gz XJMIGJWUQSDNCZ-JTQLQIEISA-N 0 0 352.350 3.508 20 5 FHBDRN CC[C@H](C)Oc1cc(CNC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)ccn1 ZINC000412244654 941955870 /nfs/dbraw/zinc/95/58/70/941955870.db2.gz PBKXNMNJXSZSBZ-DOPJRALCSA-N 0 0 369.421 3.587 20 5 FHBDRN CCc1ccc(O)c(NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)c1 ZINC000182766795 941966877 /nfs/dbraw/zinc/96/68/77/941966877.db2.gz WRRVZOHDOFOAMV-UHFFFAOYSA-N 0 0 352.293 3.717 20 5 FHBDRN Cc1nn(-c2ccccc2)cc1Nc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 ZINC000182804892 941970197 /nfs/dbraw/zinc/97/01/97/941970197.db2.gz BMJNMRUVGLZPFD-UHFFFAOYSA-N 0 0 363.377 3.717 20 5 FHBDRN COc1cc(CSCc2cc(C)on2)c([N+](=O)[O-])cc1OCC(F)F ZINC000182810092 941970306 /nfs/dbraw/zinc/97/03/06/941970306.db2.gz YZRDWFBYKRDGAQ-UHFFFAOYSA-N 0 0 374.365 3.977 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)Nc1ccc(-c2ncn(C)n2)cc1 ZINC000182815604 941971850 /nfs/dbraw/zinc/97/18/50/941971850.db2.gz WBCANCJIBVRLCA-UHFFFAOYSA-N 0 0 365.393 3.568 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCn2c(nnc2-c2ccccc2)C1 ZINC000182818615 941971932 /nfs/dbraw/zinc/97/19/32/941971932.db2.gz MMCMHAAMTBVAFF-HNNXBMFYSA-N 0 0 363.421 3.739 20 5 FHBDRN CS(=O)(=O)c1cccc(N[C@@H]2CCC[C@@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000122634049 941974285 /nfs/dbraw/zinc/97/42/85/941974285.db2.gz OCJXYWRKDDDYLM-HUUCEWRRSA-N 0 0 360.435 3.747 20 5 FHBDRN CC[C@@H](NC(=O)Nc1cccc([N+](=O)[O-])c1)c1ccc(OC)c(OC)c1 ZINC000513516205 941976428 /nfs/dbraw/zinc/97/64/28/941976428.db2.gz UCATZVCBDBYLDY-OAHLLOKOSA-N 0 0 359.382 3.885 20 5 FHBDRN O=C(Nc1cc(Cl)ccc1-n1cccn1)c1cc(F)cc([N+](=O)[O-])c1 ZINC000517559367 941986092 /nfs/dbraw/zinc/98/60/92/941986092.db2.gz ZTIGIIKDSSEBLK-UHFFFAOYSA-N 0 0 360.732 3.825 20 5 FHBDRN COc1cccc(C2(NC(=O)c3ccc(NC4CC4)c([N+](=O)[O-])c3)CC2)c1 ZINC000122645281 941994805 /nfs/dbraw/zinc/99/48/05/941994805.db2.gz GSDTWKMEUGPKNB-UHFFFAOYSA-N 0 0 367.405 3.597 20 5 FHBDRN C[C@H]1C[C@H](c2cccs2)CN1C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000377805578 942003801 /nfs/dbraw/zinc/00/38/01/942003801.db2.gz VTTRKDSVSZGUHK-QWRGUYRKSA-N 0 0 356.407 3.551 20 5 FHBDRN Cc1cc(Br)c(O)c(NC(=O)c2cccc([N+](=O)[O-])c2C)c1 ZINC000182932110 942010475 /nfs/dbraw/zinc/01/04/75/942010475.db2.gz JZKKLUMUKJHQOL-UHFFFAOYSA-N 0 0 365.183 3.932 20 5 FHBDRN CC(C)(C)OC(=O)C1(C(=O)Nc2ccc([N+](=O)[O-])c(Cl)c2)CC=CC1 ZINC001125863206 942011935 /nfs/dbraw/zinc/01/19/35/942011935.db2.gz SDNLEDMZKIUWFH-UHFFFAOYSA-N 0 0 366.801 3.865 20 5 FHBDRN CC1(c2nc3ccccc3s2)CCN(C(=O)c2cc([N+](=O)[O-])c[nH]2)CC1 ZINC000513563866 942019307 /nfs/dbraw/zinc/01/93/07/942019307.db2.gz OJMDTTOQRUDYJF-UHFFFAOYSA-N 0 0 370.434 3.727 20 5 FHBDRN NC(=O)c1ccc(CN2Cc3ccccc3-c3ccccc3C2)c([N+](=O)[O-])c1 ZINC000101919714 942019780 /nfs/dbraw/zinc/01/97/80/942019780.db2.gz GAMCTQSOBMOFDP-UHFFFAOYSA-N 0 0 373.412 3.877 20 5 FHBDRN CN(Cc1cc(Cl)ccc1F)C(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000433990444 942022011 /nfs/dbraw/zinc/02/20/11/942022011.db2.gz OLLNQLHNZOSOIX-UHFFFAOYSA-N 0 0 365.792 3.848 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)NCc2ccccc2OC2CCCC2)c1[N+](=O)[O-] ZINC000433988157 942026444 /nfs/dbraw/zinc/02/64/44/942026444.db2.gz NMYSTYSKYCCIOU-UHFFFAOYSA-N 0 0 372.425 3.693 20 5 FHBDRN CCN(C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F)[C@@H](C)c1cccnc1 ZINC000182955141 942029693 /nfs/dbraw/zinc/02/96/93/942029693.db2.gz RQOTUVHQUCYGQV-NSHDSACASA-N 0 0 365.336 3.815 20 5 FHBDRN CCOc1ccccc1[C@@H](CC)NC(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000102006710 942031601 /nfs/dbraw/zinc/03/16/01/942031601.db2.gz DLOOCWSFNDVXDS-QGZVFWFLSA-N 0 0 357.410 3.944 20 5 FHBDRN CCOc1ccccc1[C@H](CC)NC(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000102006707 942031645 /nfs/dbraw/zinc/03/16/45/942031645.db2.gz DLOOCWSFNDVXDS-KRWDZBQOSA-N 0 0 357.410 3.944 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N[C@H](CC(F)(F)F)c2ccccc2)c1[N+](=O)[O-] ZINC000433995246 942032733 /nfs/dbraw/zinc/03/27/33/942032733.db2.gz TUQUNOIXLVHHOU-LLVKDONJSA-N 0 0 370.331 3.865 20 5 FHBDRN CC1(F)CC(NC(=O)c2cc([N+](=O)[O-])ccc2NCc2ccccc2)C1 ZINC000452279222 942038867 /nfs/dbraw/zinc/03/88/67/942038867.db2.gz WQVRTGCLPQINQG-UHFFFAOYSA-N 0 0 357.385 3.827 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000158999848 942041575 /nfs/dbraw/zinc/04/15/75/942041575.db2.gz CMICBUURRKOPMT-HNAYVOBHSA-N 0 0 354.406 3.801 20 5 FHBDRN Cc1ccc(CNC(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])c(OC(C)(C)C)c1 ZINC000434022205 942043787 /nfs/dbraw/zinc/04/37/87/942043787.db2.gz PNKHIRAKCPGACN-UHFFFAOYSA-N 0 0 374.441 3.857 20 5 FHBDRN O=C(NCc1cc(F)c(Cl)cc1F)NCc1ccccc1[N+](=O)[O-] ZINC000434004894 942044596 /nfs/dbraw/zinc/04/45/96/942044596.db2.gz ZGPKFIPTRKLOKA-UHFFFAOYSA-N 0 0 355.728 3.526 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CC3CC2(C(F)(F)F)C3)ccc1[N+](=O)[O-] ZINC000415795394 942054002 /nfs/dbraw/zinc/05/40/02/942054002.db2.gz XLCAOGPSLBWZRN-UHFFFAOYSA-N 0 0 358.316 3.549 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N1CCC(F)(c2ccccc2)CC1 ZINC000434050492 942054666 /nfs/dbraw/zinc/05/46/66/942054666.db2.gz XJAAACXAYNFIMF-UHFFFAOYSA-N 0 0 358.369 3.704 20 5 FHBDRN CCCCc1nc(-c2ccc(Oc3c([N+](=O)[O-])c(C)nn3C)cc2)no1 ZINC000513651646 942056625 /nfs/dbraw/zinc/05/66/25/942056625.db2.gz CKUTXMCLTBDRNW-UHFFFAOYSA-N 0 0 357.370 3.822 20 5 FHBDRN O=C(NCCc1ccccc1[N+](=O)[O-])C1(c2ccccc2)CC(F)(F)C1 ZINC000377893462 942057511 /nfs/dbraw/zinc/05/75/11/942057511.db2.gz JPDUTGBKAVQIRA-UHFFFAOYSA-N 0 0 360.360 3.621 20 5 FHBDRN CCn1c(-c2ccc([N+](=O)[O-])cc2)nnc1N1CC[C@]2(CC[C@@H](C)C2)C1 ZINC000549367583 942063754 /nfs/dbraw/zinc/06/37/54/942063754.db2.gz BUROUIUUFYKOLS-KUHUBIRLSA-N 0 0 355.442 3.890 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N(C)Cc2cc(C)cc(C)c2)c1F ZINC000412295898 942075057 /nfs/dbraw/zinc/07/50/57/942075057.db2.gz VBVBEVWODXJDNH-UHFFFAOYSA-N 0 0 360.385 3.560 20 5 FHBDRN O=C(N[C@H]1CCCc2c(O)cccc21)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412294091 942077621 /nfs/dbraw/zinc/07/76/21/942077621.db2.gz UABPGADYZRSYAY-KSZLIROESA-N 0 0 352.390 3.598 20 5 FHBDRN C[C@H](NC(=O)c1ccc(OC2CCCC2)nc1)c1cccc([N+](=O)[O-])c1 ZINC000513685962 942079892 /nfs/dbraw/zinc/07/98/92/942079892.db2.gz UPVHGYPQTFTOMP-ZDUSSCGKSA-N 0 0 355.394 3.802 20 5 FHBDRN Cn1ccc2cccc(NC(=O)CCCNc3ccc([N+](=O)[O-])cc3)c21 ZINC000472914870 942089069 /nfs/dbraw/zinc/08/90/69/942089069.db2.gz MAULOORJDHISNQ-UHFFFAOYSA-N 0 0 352.394 3.917 20 5 FHBDRN O=[N+]([O-])c1ccccc1NCCc1nc(C2(c3ccccc3F)CC2)no1 ZINC000420534211 942096576 /nfs/dbraw/zinc/09/65/76/942096576.db2.gz YBHPIZTYQBMPAT-UHFFFAOYSA-N 0 0 368.368 3.851 20 5 FHBDRN COc1cc(OC)cc(N(C)C(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)c1 ZINC000190095745 942099186 /nfs/dbraw/zinc/09/91/86/942099186.db2.gz DCBJJJPDLSBWIN-LLVKDONJSA-N 0 0 362.357 3.518 20 5 FHBDRN COc1ccc([C@@H](C)NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)cc1 ZINC000513724469 942101727 /nfs/dbraw/zinc/10/17/27/942101727.db2.gz KENFALCELRUHHP-SNVBAGLBSA-N 0 0 366.320 3.696 20 5 FHBDRN O=C(Nc1cnc2c(c1)CCCC2)C1(c2ccc([N+](=O)[O-])cc2)CCC1 ZINC001269006344 942102205 /nfs/dbraw/zinc/10/22/05/942102205.db2.gz LBPLUSSJEQUODL-UHFFFAOYSA-N 0 0 351.406 3.929 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CCCC[C@H]2c2nc3cc(Cl)ccc3[nH]2)nc1 ZINC000413380775 942114724 /nfs/dbraw/zinc/11/47/24/942114724.db2.gz VHGRHSULMCWXHV-AWEZNQCLSA-N 0 0 358.789 3.646 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N(c2ccccc2)[C@H]2C[C@@H]2C)c1F ZINC000415893466 942121624 /nfs/dbraw/zinc/12/16/24/942121624.db2.gz PIZAREXRKHWEPA-LRDDRELGSA-N 0 0 358.369 3.727 20 5 FHBDRN CC[C@@H](C)[C@H](C)N(C(=O)Cc1c(F)c(OC)ccc1[N+](=O)[O-])C1CC1 ZINC000413372522 942121999 /nfs/dbraw/zinc/12/19/99/942121999.db2.gz OPDJJVITKROLIF-NEPJUHHUSA-N 0 0 352.406 3.711 20 5 FHBDRN CC(C)(CC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-])C(F)(F)F ZINC000280187841 942122890 /nfs/dbraw/zinc/12/28/90/942122890.db2.gz INRYIISLBUCFET-UHFFFAOYSA-N 0 0 352.740 3.886 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CCC[C@H](CC(F)(F)F)C2)c(Br)c1 ZINC000420617230 942134035 /nfs/dbraw/zinc/13/40/35/942134035.db2.gz AWUJSAHORCYVNM-MRVPVSSYSA-N 0 0 368.153 3.921 20 5 FHBDRN CCNc1ccc(C(=O)Nc2ccc3c(c2)OC(F)(F)O3)cc1[N+](=O)[O-] ZINC000016103807 942134429 /nfs/dbraw/zinc/13/44/29/942134429.db2.gz NMNQOXGZDGKDHJ-UHFFFAOYSA-N 0 0 365.292 3.600 20 5 FHBDRN CC(C)NC(=O)c1ccc(NC[C@@H]2CC23CCSCC3)c([N+](=O)[O-])c1 ZINC000420649817 942141788 /nfs/dbraw/zinc/14/17/88/942141788.db2.gz GUCKZSRZWPKHSZ-AWEZNQCLSA-N 0 0 363.483 3.678 20 5 FHBDRN O=[N+]([O-])c1ccccc1/C=C/CN1CCC[C@H](c2noc(C3CC3)n2)C1 ZINC000271188421 942141732 /nfs/dbraw/zinc/14/17/32/942141732.db2.gz FERUAWVFPJWYIT-GIZXNFQBSA-N 0 0 354.410 3.748 20 5 FHBDRN C[C@H](Nc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1)c1cncc(F)c1 ZINC000413398219 942144396 /nfs/dbraw/zinc/14/43/96/942144396.db2.gz RFSJMEOMEVNCQS-LBPRGKRZSA-N 0 0 358.373 3.538 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H]1c1ccc2c(c1)OCO2 ZINC000102915029 942145202 /nfs/dbraw/zinc/14/52/02/942145202.db2.gz FSAWGHUGUGHUQT-MRXNPFEDSA-N 0 0 354.362 3.609 20 5 FHBDRN CC(C)c1nnc([C@H](C)Nc2ccc([N+](=O)[O-])cc2Br)[nH]1 ZINC000501986295 942154299 /nfs/dbraw/zinc/15/42/99/942154299.db2.gz HYIXNPOKWTXASP-QMMMGPOBSA-N 0 0 354.208 3.772 20 5 FHBDRN Cc1c(CC(=O)NCCCc2c[nH]c3ccc(F)cc23)cccc1[N+](=O)[O-] ZINC000501977284 942158587 /nfs/dbraw/zinc/15/85/87/942158587.db2.gz RHKBCJCQPJXBHQ-UHFFFAOYSA-N 0 0 369.396 3.815 20 5 FHBDRN COc1ccc(C(=O)NCCCc2c[nH]c3ccc(F)cc23)cc1[N+](=O)[O-] ZINC000501998426 942161386 /nfs/dbraw/zinc/16/13/86/942161386.db2.gz YGOJZZVRXFHNHD-UHFFFAOYSA-N 0 0 371.368 3.586 20 5 FHBDRN CC1(C)Oc2ccsc2[C@@H](Nc2ccc([N+](=O)[O-])c3cnccc23)[C@@H]1O ZINC000413419977 942162173 /nfs/dbraw/zinc/16/21/73/942162173.db2.gz OCWBEQVEWGGPBK-WBVHZDCISA-N 0 0 371.418 3.890 20 5 FHBDRN C[C@@H](NC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1)c1ccon1 ZINC000501999193 942162362 /nfs/dbraw/zinc/16/23/62/942162362.db2.gz QPSXWKCTSWFEKR-GFCCVEGCSA-N 0 0 352.350 3.817 20 5 FHBDRN CCCOc1cc(NC(=O)c2cscn2)c([N+](=O)[O-])cc1OCCC ZINC000102980127 942162917 /nfs/dbraw/zinc/16/29/17/942162917.db2.gz URGZDRLKFANGQL-UHFFFAOYSA-N 0 0 365.411 3.881 20 5 FHBDRN CCOc1cn(-c2ccccc2)nc1C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000102978163 942162954 /nfs/dbraw/zinc/16/29/54/942162954.db2.gz IVAYSOXARNYTBF-UHFFFAOYSA-N 0 0 366.377 3.740 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)N(C)[C@H]2CCCC[C@H]2C)cc1SC ZINC000102984888 942166751 /nfs/dbraw/zinc/16/67/51/942166751.db2.gz INIJSZJSNPBFQH-YPMHNXCESA-N 0 0 352.456 3.976 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)[C@H](C)Oc1ccccc1F ZINC000502016351 942173225 /nfs/dbraw/zinc/17/32/25/942173225.db2.gz ZBTPEHZSFBFTKY-AWEZNQCLSA-N 0 0 360.385 3.938 20 5 FHBDRN C[C@@H](Nc1ccc(NC(=O)c2nn(C)cc2[N+](=O)[O-])cc1)c1ccccc1 ZINC000502020198 942175523 /nfs/dbraw/zinc/17/55/23/942175523.db2.gz UJOMLVZTOPLERC-CYBMUJFWSA-N 0 0 365.393 3.754 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)NCCCc1c[nH]c2ccc(F)cc12 ZINC000502029556 942187464 /nfs/dbraw/zinc/18/74/64/942187464.db2.gz YUOGTIBRLTWADF-UHFFFAOYSA-N 0 0 355.369 3.886 20 5 FHBDRN CC(=O)Nc1cc(NC(=O)c2cc([N+](=O)[O-])c(C)s2)ccc1Cl ZINC000063336782 942193879 /nfs/dbraw/zinc/19/38/79/942193879.db2.gz YVYOVJSECROVLV-UHFFFAOYSA-N 0 0 353.787 3.829 20 5 FHBDRN COC[C@@H](C)N(C)C(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(OC)cc1 ZINC000502067233 942210427 /nfs/dbraw/zinc/21/04/27/942210427.db2.gz DFZABPJAXVOTTE-CYBMUJFWSA-N 0 0 374.393 3.503 20 5 FHBDRN C[C@@]1(O)CCCN(C(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)CC1 ZINC000280605821 942213737 /nfs/dbraw/zinc/21/37/37/942213737.db2.gz PAKYMOVSGUKGGD-HXUWFJFHSA-N 0 0 370.405 3.764 20 5 FHBDRN C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)N3CC[C@H](C4CC4)C3)cc2[N+](=O)[O-])C1 ZINC000480943073 942217051 /nfs/dbraw/zinc/21/70/51/942217051.db2.gz BLTQRUAIJLHXOR-RKVPGOIHSA-N 0 0 371.481 3.949 20 5 FHBDRN O=C(Nc1cnc2ccccc2c1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513730536 942221659 /nfs/dbraw/zinc/22/16/59/942221659.db2.gz LGKWKXMQINVGQG-UHFFFAOYSA-N 0 0 359.288 3.997 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CCOc3cc(F)ccc32)ccc1[N+](=O)[O-] ZINC000413476778 942222879 /nfs/dbraw/zinc/22/28/79/942222879.db2.gz PLPQSSQMHBHKFI-UHFFFAOYSA-N 0 0 360.341 3.560 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N(C)[C@@H]1CCc2ccccc2C1 ZINC000122780800 942223046 /nfs/dbraw/zinc/22/30/46/942223046.db2.gz SECYLLNHPZEFMI-OAHLLOKOSA-N 0 0 355.394 3.625 20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])N1CCC(c2ccsc2)CC1 ZINC000187827781 942224431 /nfs/dbraw/zinc/22/44/31/942224431.db2.gz SLTOOOUNGBPAJA-UHFFFAOYSA-N 0 0 359.451 3.865 20 5 FHBDRN CCC(CC)[C@@H]1C[C@@H](NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)CCO1 ZINC000183438265 942226335 /nfs/dbraw/zinc/22/63/35/942226335.db2.gz DVLYUQLOPFEFET-HOCLYGCPSA-N 0 0 354.834 3.962 20 5 FHBDRN CC(=O)c1cc(N2CCN(Cc3ccccc3)[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000396364358 942226389 /nfs/dbraw/zinc/22/63/89/942226389.db2.gz YFXAQQQMXBQAHR-HNNXBMFYSA-N 0 0 353.422 3.508 20 5 FHBDRN CN([C@H](c1ccccc1)C(F)(F)F)S(=O)(=O)c1ccccc1[N+](=O)[O-] ZINC000103163074 942228711 /nfs/dbraw/zinc/22/87/11/942228711.db2.gz ADSOQBWWBQPSEF-CQSZACIVSA-N 0 0 374.340 3.519 20 5 FHBDRN CCOC(=O)c1cc(N2CCSC3(CCC3)CC2)ccc1[N+](=O)[O-] ZINC000413474857 942232198 /nfs/dbraw/zinc/23/21/98/942232198.db2.gz BTWSLTOPHWGBGA-UHFFFAOYSA-N 0 0 350.440 3.638 20 5 FHBDRN CN1CCCN(C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)c2ccccc21 ZINC000413487387 942239528 /nfs/dbraw/zinc/23/95/28/942239528.db2.gz ZUAIIEVWHCZROI-DLBZAZTESA-N 0 0 351.406 3.571 20 5 FHBDRN C[C@H](CCc1ccccc1)NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513731038 942240934 /nfs/dbraw/zinc/24/09/34/942240934.db2.gz QQMNGWFTYSMOHQ-GFCCVEGCSA-N 0 0 364.348 3.947 20 5 FHBDRN COCC[C@@H](C)CNc1cc(C(F)(F)C(F)(F)F)ncc1[N+](=O)[O-] ZINC000413489817 942241115 /nfs/dbraw/zinc/24/11/15/942241115.db2.gz HQWFPHBCBYDFAM-MRVPVSSYSA-N 0 0 357.279 3.728 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)OCC(=O)c2ccc(C)cc2C)c1 ZINC000016196583 942247526 /nfs/dbraw/zinc/24/75/26/942247526.db2.gz YPHUXTIXNBEAJR-UHFFFAOYSA-N 0 0 359.403 3.973 20 5 FHBDRN Cc1nn(CC(C)C)c(C)c1CC(=O)N1c2ccc([N+](=O)[O-])cc2C[C@H]1C ZINC000103376782 942249055 /nfs/dbraw/zinc/24/90/55/942249055.db2.gz RBCCOURVNUZKDI-CYBMUJFWSA-N 0 0 370.453 3.584 20 5 FHBDRN Cc1nn(CC(C)C)c(C)c1CC(=O)N1c2ccc([N+](=O)[O-])cc2C[C@@H]1C ZINC000103376780 942249250 /nfs/dbraw/zinc/24/92/50/942249250.db2.gz RBCCOURVNUZKDI-ZDUSSCGKSA-N 0 0 370.453 3.584 20 5 FHBDRN C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1ccccc1Br ZINC000103376669 942249287 /nfs/dbraw/zinc/24/92/87/942249287.db2.gz ONEYNIPGLVTLDO-JTQLQIEISA-N 0 0 361.195 3.949 20 5 FHBDRN Cc1nn(C)c(C(=O)N[C@H](C)c2ccc(SC(C)C)cc2)c1[N+](=O)[O-] ZINC000103403944 942252223 /nfs/dbraw/zinc/25/22/23/942252223.db2.gz UDJOZENVTFQKQB-LLVKDONJSA-N 0 0 362.455 3.628 20 5 FHBDRN CCC(CC)C(=O)N1CCC(Nc2nccc3ccc([N+](=O)[O-])cc32)CC1 ZINC000413075755 942260208 /nfs/dbraw/zinc/26/02/08/942260208.db2.gz UMNVIDPUANJIPQ-UHFFFAOYSA-N 0 0 370.453 3.982 20 5 FHBDRN Cc1c(CNC(=O)c2nc(-c3ccccc3)cs2)cccc1[N+](=O)[O-] ZINC000513733116 942268286 /nfs/dbraw/zinc/26/82/86/942268286.db2.gz MVFQCDZDGHTVFS-UHFFFAOYSA-N 0 0 353.403 3.957 20 5 FHBDRN CCOc1cc(C(=O)N[C@@H]2CC[C@H](C)[C@H](C)C2)c([N+](=O)[O-])cc1OC ZINC000183459083 942278389 /nfs/dbraw/zinc/27/83/89/942278389.db2.gz FQCATFONDSEDPU-YNEHKIRRSA-N 0 0 350.415 3.557 20 5 FHBDRN Cc1ccc(F)cc1C(=O)C(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000513705870 942283189 /nfs/dbraw/zinc/28/31/89/942283189.db2.gz NAODSHXASDTGFH-UHFFFAOYSA-N 0 0 358.369 3.662 20 5 FHBDRN O=[N+]([O-])c1cnc(NC[C@H]2CCN(c3ccccc3)C2)c(C(F)(F)F)c1 ZINC000413091468 942283333 /nfs/dbraw/zinc/28/33/33/942283333.db2.gz KMEACIZBRYPVIJ-GFCCVEGCSA-N 0 0 366.343 3.947 20 5 FHBDRN CC(C)c1nc([C@H]2CCCN2c2ccc([N+](=O)[O-])c3ncccc23)no1 ZINC000413096516 942285159 /nfs/dbraw/zinc/28/51/59/942285159.db2.gz AKPWSFXXCJLTOY-OAHLLOKOSA-N 0 0 353.382 3.991 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)NCCCSc1ccccc1 ZINC000122855934 942287448 /nfs/dbraw/zinc/28/74/48/942287448.db2.gz SZUPAGXQLNPZKA-UHFFFAOYSA-N 0 0 369.446 3.917 20 5 FHBDRN O=C(NCCCc1ccccc1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513736113 942289513 /nfs/dbraw/zinc/28/95/13/942289513.db2.gz WOXVQYHAWCUUKK-UHFFFAOYSA-N 0 0 350.321 3.559 20 5 FHBDRN Cc1c(CC(=O)Nc2ccc(O)c(COC(C)C)c2)cccc1[N+](=O)[O-] ZINC000290593713 942290806 /nfs/dbraw/zinc/29/08/06/942290806.db2.gz MPXCUQZYNNXNDZ-UHFFFAOYSA-N 0 0 358.394 3.715 20 5 FHBDRN O=C([C@H]1C[C@@H]1c1ccccc1)N1CCS[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000413520478 942291725 /nfs/dbraw/zinc/29/17/25/942291725.db2.gz PSUGCELRPLTODH-AOIWGVFYSA-N 0 0 354.431 3.973 20 5 FHBDRN COCCOc1ccc(Nc2ncc([N+](=O)[O-])cc2C(F)(F)F)cc1 ZINC000413106129 942292404 /nfs/dbraw/zinc/29/24/04/942292404.db2.gz YOWJFULEFNGVFO-UHFFFAOYSA-N 0 0 357.288 3.777 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N(C)C[C@@H]1CCCC[C@H]1O ZINC000183471245 942293668 /nfs/dbraw/zinc/29/36/68/942293668.db2.gz VUOYIVAYVKBUMM-XJKSGUPXSA-N 0 0 366.483 3.718 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cnc(C2CC2)nc1 ZINC000103587580 942293819 /nfs/dbraw/zinc/29/38/19/942293819.db2.gz FERVPRPPKXLTSR-UHFFFAOYSA-N 0 0 355.398 3.705 20 5 FHBDRN CCn1cc([C@@H]2OCC[C@H]2CNc2ccnc3c2cccc3[N+](=O)[O-])cn1 ZINC000413512991 942299979 /nfs/dbraw/zinc/29/99/79/942299979.db2.gz KDNJCNZGQGBLOG-ORAYPTAESA-N 0 0 367.409 3.549 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H](CC(C)C)OC ZINC000416055117 942300127 /nfs/dbraw/zinc/30/01/27/942300127.db2.gz GGSUGJZKMLFXLD-AWEZNQCLSA-N 0 0 354.472 3.888 20 5 FHBDRN COc1ccc(CSCc2ccn(CC(F)(F)F)n2)cc1[N+](=O)[O-] ZINC000419524588 942300769 /nfs/dbraw/zinc/30/07/69/942300769.db2.gz BYKFPGNQXQYSIF-UHFFFAOYSA-N 0 0 361.345 3.796 20 5 FHBDRN CO[C@@](C)([C@H](C)Nc1ncc([N+](=O)[O-])c(C)c1Br)C1CC1 ZINC000413524906 942300934 /nfs/dbraw/zinc/30/09/34/942300934.db2.gz XGLJNGACFLFUTL-XPTSAGLGSA-N 0 0 358.236 3.676 20 5 FHBDRN CCc1ccc(C(=O)N2CCCc3cc(OC)cc(OC)c32)cc1[N+](=O)[O-] ZINC000416057521 942301207 /nfs/dbraw/zinc/30/12/07/942301207.db2.gz ZIIANQBVOAWVME-UHFFFAOYSA-N 0 0 370.405 3.767 20 5 FHBDRN CSCCCN(C)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000501084589 942301820 /nfs/dbraw/zinc/30/18/20/942301820.db2.gz KYMQIFGKKJPGMN-UHFFFAOYSA-N 0 0 362.249 3.574 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2noc(CNc3cccc4c3OCCC4)n2)cc1 ZINC000378133442 942306959 /nfs/dbraw/zinc/30/69/59/942306959.db2.gz LBPLOAQCBRTDGD-UHFFFAOYSA-N 0 0 352.350 3.582 20 5 FHBDRN O=C(Cc1cccc([N+](=O)[O-])c1)N1CCC[C@@H]1Cc1cc(F)ccc1F ZINC000416057370 942308473 /nfs/dbraw/zinc/30/84/73/942308473.db2.gz ZWNJNCFHZVOEFK-MRXNPFEDSA-N 0 0 360.360 3.649 20 5 FHBDRN COc1cc(C(=O)N[C@H](C)c2ccc(C3CC3)cc2)c([N+](=O)[O-])cc1OC ZINC000416064880 942312610 /nfs/dbraw/zinc/31/26/10/942312610.db2.gz PQUHCZFNKPVDPA-GFCCVEGCSA-N 0 0 370.405 3.980 20 5 FHBDRN Cc1ccc([C@H](c2ccccn2)N(C)C(=O)c2ccc([N+](=O)[O-])cn2)cc1 ZINC000378137467 942314902 /nfs/dbraw/zinc/31/49/02/942314902.db2.gz GVJQZXUQXIIZAF-LJQANCHMSA-N 0 0 362.389 3.555 20 5 FHBDRN CNC(=O)C[C@@H](Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1ccccc1 ZINC000481092790 942323475 /nfs/dbraw/zinc/32/34/75/942323475.db2.gz NYVWMMIAHCTEGY-CQSZACIVSA-N 0 0 367.327 3.903 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)NCc1ncoc1-c1ccccc1 ZINC000378151173 942326305 /nfs/dbraw/zinc/32/63/05/942326305.db2.gz OJHZAPHMLSFCGS-UHFFFAOYSA-N 0 0 352.350 3.880 20 5 FHBDRN O=C(COc1ccccc1[N+](=O)[O-])Nc1ccc2c(c1)OC1(CCCC1)O2 ZINC000015699868 942331725 /nfs/dbraw/zinc/33/17/25/942331725.db2.gz MMYUZFJEHJTKLF-UHFFFAOYSA-N 0 0 370.361 3.654 20 5 FHBDRN CC[C@H](NC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)[C@H]1CC1(C)C ZINC000416085723 942333161 /nfs/dbraw/zinc/33/31/61/942333161.db2.gz SBDLXACYSNBKBD-CVEARBPZSA-N 0 0 356.426 3.550 20 5 FHBDRN O=C(COc1ccc(F)c(Br)c1)c1ccc([N+](=O)[O-])cc1 ZINC000137051745 942334737 /nfs/dbraw/zinc/33/47/37/942334737.db2.gz JWMIZGCDVZTUNS-UHFFFAOYSA-N 0 0 354.131 3.758 20 5 FHBDRN CC(C)NC(=O)c1ccc(N2CC[C@H](c3ccccc3F)C2)c([N+](=O)[O-])c1 ZINC000501176342 942341647 /nfs/dbraw/zinc/34/16/47/942341647.db2.gz PTMCEWFCDOCDDJ-HNNXBMFYSA-N 0 0 371.412 3.866 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc3c(c2)OC(F)(F)O3)c1 ZINC000016261376 942344202 /nfs/dbraw/zinc/34/42/02/942344202.db2.gz PZALXHVVPPZIFQ-UHFFFAOYSA-N 0 0 368.317 3.891 20 5 FHBDRN COC(=O)c1ccccc1C(=O)c1ccc(NC2CCC2)c([N+](=O)[O-])c1 ZINC000501201184 942347672 /nfs/dbraw/zinc/34/76/72/942347672.db2.gz XKMGKWQICBACNR-UHFFFAOYSA-N 0 0 354.362 3.577 20 5 FHBDRN Cc1nc([C@H]2CCCOC2)sc1-c1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000366455476 942350181 /nfs/dbraw/zinc/35/01/81/942350181.db2.gz DSCXQGUXFOJNGI-LBPRGKRZSA-N 0 0 372.406 3.971 20 5 FHBDRN CC(C)(C)n1ncnc1CNC(=O)c1cc2ccccc2c2cccnc12 ZINC000501221533 942350517 /nfs/dbraw/zinc/35/05/17/942350517.db2.gz DDSNUCKHIBWEMB-UHFFFAOYSA-N 0 0 359.433 3.665 20 5 FHBDRN CN(Cc1nc2ccccc2n1C)c1ncc([N+](=O)[O-])cc1C(F)(F)F ZINC000413152997 942351624 /nfs/dbraw/zinc/35/16/24/942351624.db2.gz FDGGHGSLYGRAKE-UHFFFAOYSA-N 0 0 365.315 3.532 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[C@](F)(c2ccccc2C)C1 ZINC000501241864 942357484 /nfs/dbraw/zinc/35/74/84/942357484.db2.gz DJAXRCIQDGIFBM-LJQANCHMSA-N 0 0 358.369 3.623 20 5 FHBDRN Cc1nn(Cc2cccc(Br)c2OC(F)F)cc1[N+](=O)[O-] ZINC000501253016 942365238 /nfs/dbraw/zinc/36/52/38/942365238.db2.gz YADQQOBQQAHOKU-UHFFFAOYSA-N 0 0 362.130 3.512 20 5 FHBDRN O=[N+]([O-])c1cnc2ccc(N3CCC[C@@]4(CCCc5ccccc54)C3)nn21 ZINC000502334976 942366581 /nfs/dbraw/zinc/36/65/81/942366581.db2.gz SSNBOHHQYXDEBR-FQEVSTJZSA-N 0 0 363.421 3.512 20 5 FHBDRN COCC[C@H](NC(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1)C(C)(C)C ZINC000412328177 942368788 /nfs/dbraw/zinc/36/87/88/942368788.db2.gz OIXWDMLCNOGTGD-INIZCTEOSA-N 0 0 352.431 3.563 20 5 FHBDRN Cc1cccc(OCCCNC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)c1 ZINC000016278301 942372912 /nfs/dbraw/zinc/37/29/12/942372912.db2.gz OZFVUKUQYNUGNO-OAHLLOKOSA-N 0 0 374.462 3.969 20 5 FHBDRN COc1cccc(C=C2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000472941269 942382793 /nfs/dbraw/zinc/38/27/93/942382793.db2.gz FYSPIFXDSOTHOK-UHFFFAOYSA-N 0 0 352.390 3.923 20 5 FHBDRN O=[N+]([O-])c1cnc2ccc(NCCc3cc(Cl)cc(Cl)c3)nn21 ZINC000302006936 942385139 /nfs/dbraw/zinc/38/51/39/942385139.db2.gz ULMFIVGRSWKVQQ-UHFFFAOYSA-N 0 0 352.181 3.599 20 5 FHBDRN Cc1csc2ncnc(N3CCC(Oc4ccc([N+](=O)[O-])cc4)CC3)c12 ZINC000413166932 942391763 /nfs/dbraw/zinc/39/17/63/942391763.db2.gz JMKNXSVGBNSBKU-UHFFFAOYSA-N 0 0 370.434 3.956 20 5 FHBDRN Cc1c(NC(=O)C(=O)N(C)[C@@H]2CCC[C@@H]2C(C)(C)C)cccc1[N+](=O)[O-] ZINC000419789993 942392379 /nfs/dbraw/zinc/39/23/79/942392379.db2.gz DKLWETDANQPZED-XJKSGUPXSA-N 0 0 361.442 3.515 20 5 FHBDRN Cc1ncsc1CCC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000413169552 942393188 /nfs/dbraw/zinc/39/31/88/942393188.db2.gz XZJDAIDIAZWLPS-UHFFFAOYSA-N 0 0 357.338 3.532 20 5 FHBDRN Cc1oc(Br)cc1C(=O)NC(C)(C)c1ccccc1[N+](=O)[O-] ZINC000424845922 942401502 /nfs/dbraw/zinc/40/15/02/942401502.db2.gz MAWPXQAERKQCDA-UHFFFAOYSA-N 0 0 367.199 3.924 20 5 FHBDRN Cc1ccc(O[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])c3ncccc23)cc1 ZINC001268850508 942417709 /nfs/dbraw/zinc/41/77/09/942417709.db2.gz ZWLDEXXTNRBDLI-CYBMUJFWSA-N 0 0 351.362 3.857 20 5 FHBDRN C[C@@H](NC(=O)Nc1cn(C)nc1-c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000501347253 942422750 /nfs/dbraw/zinc/42/27/50/942422750.db2.gz AMUGJOWOAUEHLX-CYBMUJFWSA-N 0 0 365.393 3.878 20 5 FHBDRN C[C@H]1CCCN(c2ccc(C(=O)NCC3(C4CC4)CC3)cc2[N+](=O)[O-])C1 ZINC000501350582 942426183 /nfs/dbraw/zinc/42/61/83/942426183.db2.gz MGEZZPMCVGFJTB-AWEZNQCLSA-N 0 0 357.454 3.751 20 5 FHBDRN C[C@@H](NS(=O)(=O)Cc1ccc(C(F)F)cc1)c1ccccc1[N+](=O)[O-] ZINC000549403650 942431814 /nfs/dbraw/zinc/43/18/14/942431814.db2.gz DOAFIBIFKUCWHO-LLVKDONJSA-N 0 0 370.377 3.713 20 5 FHBDRN O=[N+]([O-])c1ccccc1NCCc1noc(C2(Oc3ccccc3)CC2)n1 ZINC000421244654 942453200 /nfs/dbraw/zinc/45/32/00/942453200.db2.gz JSPNYXVZOUVBDE-UHFFFAOYSA-N 0 0 366.377 3.701 20 5 FHBDRN CCC(CC)(CNC(=O)c1cccc(C)c1[N+](=O)[O-])C(=O)OC(C)(C)C ZINC000424942579 942456025 /nfs/dbraw/zinc/45/60/25/942456025.db2.gz ANJWPHNRDQUZEB-UHFFFAOYSA-N 0 0 364.442 3.781 20 5 FHBDRN Cc1nc(N2CCN(c3ccc([N+](=O)[O-])c4ncccc34)CC2)sc1C ZINC000413197277 942460689 /nfs/dbraw/zinc/46/06/89/942460689.db2.gz FWIAWALHKUIILY-UHFFFAOYSA-N 0 0 369.450 3.543 20 5 FHBDRN C[C@H](O)C[C@@H](CNc1ncc([N+](=O)[O-])cc1C(F)(F)F)c1ccccc1 ZINC000413197609 942460798 /nfs/dbraw/zinc/46/07/98/942460798.db2.gz SABMBQQQIHEASN-AAEUAGOBSA-N 0 0 369.343 3.975 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1C(=O)NC[C@@H](CC(C)C)C(=O)OC(C)(C)C ZINC000424959032 942471825 /nfs/dbraw/zinc/47/18/25/942471825.db2.gz XXMGFHPENAOPCF-CQSZACIVSA-N 0 0 364.442 3.637 20 5 FHBDRN CN(C(=O)OC(C)(C)C)[C@@H]1CCN(Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000749808465 942474127 /nfs/dbraw/zinc/47/41/27/942474127.db2.gz DHKKPQUMMRTAKE-CQSZACIVSA-N 0 0 369.849 3.689 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCO[C@]3(CCc4ccccc43)C2)c2cccnc21 ZINC000413204269 942477153 /nfs/dbraw/zinc/47/71/53/942477153.db2.gz OQEGFAMRUWHBDO-OAQYLSRUSA-N 0 0 361.401 3.821 20 5 FHBDRN O=C(Nc1ccncc1[N+](=O)[O-])N1CCC[C@@H]1c1nc2ccccc2s1 ZINC000183548099 942477976 /nfs/dbraw/zinc/47/79/76/942477976.db2.gz RHIBGNDITVONMH-CYBMUJFWSA-N 0 0 369.406 3.969 20 5 FHBDRN O=C(Nc1cccnc1N1CCCCC1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000413217048 942490976 /nfs/dbraw/zinc/49/09/76/942490976.db2.gz XCQPKNPTCIMFEW-DLBZAZTESA-N 0 0 366.421 3.722 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)NCc1cnccc1C(C)(C)C ZINC000413675072 942491240 /nfs/dbraw/zinc/49/12/40/942491240.db2.gz DHPXBXVAONMHQW-UHFFFAOYSA-N 0 0 356.426 3.629 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)NCc1cnccc1C(C)(C)C ZINC000413673014 942491483 /nfs/dbraw/zinc/49/14/83/942491483.db2.gz XOUCKHFEANMBDH-UHFFFAOYSA-N 0 0 370.453 3.671 20 5 FHBDRN COc1ccc(NC(=O)c2ccc([C@@H]3CCCOC3)cc2)c([N+](=O)[O-])c1 ZINC000502498039 942492311 /nfs/dbraw/zinc/49/23/11/942492311.db2.gz MOYYWIQUOKVTBW-OAHLLOKOSA-N 0 0 356.378 3.750 20 5 FHBDRN CC(=O)C[C@@H](C)NC(=O)c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1 ZINC000501459189 942494716 /nfs/dbraw/zinc/49/47/16/942494716.db2.gz RJLSLDVZCMGNBR-GFCCVEGCSA-N 0 0 358.419 3.843 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1F)N1CCC[C@@H]1/C=C/c1ccccc1 ZINC000505354062 942496867 /nfs/dbraw/zinc/49/68/67/942496867.db2.gz UCRIEWDKOGAKQS-SYJIQKIWSA-N 0 0 354.381 3.981 20 5 FHBDRN COc1ccc(NC(=O)[C@@H]2CC(C)(C)Oc3ccccc32)cc1[N+](=O)[O-] ZINC000413683162 942498660 /nfs/dbraw/zinc/49/86/60/942498660.db2.gz GUGLWRNRILZDLJ-CQSZACIVSA-N 0 0 356.378 3.887 20 5 FHBDRN O=C(c1cc2c(c([N+](=O)[O-])c1)OCO2)N1CCC[C@@H]1/C=C/c1ccccc1 ZINC000505366542 942506099 /nfs/dbraw/zinc/50/60/99/942506099.db2.gz NHUFNXHRLFJJEV-ROJDOSBLSA-N 0 0 366.373 3.642 20 5 FHBDRN O=C(CC1CC(c2ccccc2)C1)N1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1 ZINC000366898406 942506228 /nfs/dbraw/zinc/50/62/28/942506228.db2.gz VVQMIVVPWPXXOP-VMWRSERWSA-N 0 0 368.437 3.539 20 5 FHBDRN C[C@H](CC(=O)c1ccc(F)cc1)NC(=O)c1c[nH]c2cccc([N+](=O)[O-])c21 ZINC000501506236 942515028 /nfs/dbraw/zinc/51/50/28/942515028.db2.gz AZDOQINHINKKRX-LLVKDONJSA-N 0 0 369.352 3.607 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(C(=O)NC)cc1 ZINC000502538629 942516141 /nfs/dbraw/zinc/51/61/41/942516141.db2.gz QHMKSLMUSMWEHR-UHFFFAOYSA-N 0 0 373.434 3.709 20 5 FHBDRN CC(C)(C)c1ccncc1CNC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000413699256 942523863 /nfs/dbraw/zinc/52/38/63/942523863.db2.gz QUARLOFLYFMTPT-UHFFFAOYSA-N 0 0 368.437 3.555 20 5 FHBDRN CC(C)c1[nH]nc(C(=O)Nc2ccc(Oc3ccccc3)nc2)c1[N+](=O)[O-] ZINC000434224811 942532879 /nfs/dbraw/zinc/53/28/79/942532879.db2.gz HTCJOYUHKMQBPN-UHFFFAOYSA-N 0 0 367.365 3.881 20 5 FHBDRN C[C@H](SCc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc2c(c1)OCO2 ZINC000513814028 942532924 /nfs/dbraw/zinc/53/29/24/942532924.db2.gz PVWFNKRKIQTRPQ-NSHDSACASA-N 0 0 360.391 3.584 20 5 FHBDRN COc1ccc(NC(=O)Nc2ccc(C)c([N+](=O)[O-])c2)cc1NC(C)=O ZINC000502571235 942533372 /nfs/dbraw/zinc/53/33/72/942533372.db2.gz SKRZNODBVQUUGZ-UHFFFAOYSA-N 0 0 358.354 3.514 20 5 FHBDRN C[C@H]1[C@H](c2ccccc2)CCN1C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000434240282 942541987 /nfs/dbraw/zinc/54/19/87/942541987.db2.gz RGXRBKACACGDRZ-HNAYVOBHSA-N 0 0 363.417 3.954 20 5 FHBDRN C[C@H](NC(=O)N[C@H]1c2ccc(F)cc2O[C@@H]1C)c1ccccc1[N+](=O)[O-] ZINC000501568278 942543223 /nfs/dbraw/zinc/54/32/23/942543223.db2.gz QBAHDZBQYDHVEG-WVQJBOLRSA-N 0 0 359.357 3.616 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NCC(C)(C)OCC1CC1 ZINC000413713483 942544668 /nfs/dbraw/zinc/54/46/68/942544668.db2.gz MGLYIQODPRKOPQ-UHFFFAOYSA-N 0 0 363.458 3.720 20 5 FHBDRN CS[C@H](CNC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])C(C)(C)C ZINC000541271482 942548190 /nfs/dbraw/zinc/54/81/90/942548190.db2.gz FYSHTUMVJYMUME-QMTHXVAHSA-N 0 0 374.890 3.909 20 5 FHBDRN COc1ccc(Cl)cc1CC(=O)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000513839761 942551211 /nfs/dbraw/zinc/55/12/11/942551211.db2.gz PWJKCZGRGRNASF-UHFFFAOYSA-N 0 0 360.797 3.779 20 5 FHBDRN C[C@H]1[C@@H](c2ccccc2)CCN1C(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000434258032 942553148 /nfs/dbraw/zinc/55/31/48/942553148.db2.gz WOZACBDHGWLVOW-RDJZCZTQSA-N 0 0 353.422 3.801 20 5 FHBDRN COc1ccc(F)cc1NC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000183277360 942553452 /nfs/dbraw/zinc/55/34/52/942553452.db2.gz GMDDAINXQKKRFY-UHFFFAOYSA-N 0 0 356.256 3.596 20 5 FHBDRN Cc1ccn(-c2ccc(C(=O)N3CCCc4c([N+](=O)[O-])cccc43)cc2)n1 ZINC000513842038 942553864 /nfs/dbraw/zinc/55/38/64/942553864.db2.gz ZRVGDOONHZLZTR-UHFFFAOYSA-N 0 0 362.389 3.682 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)Nc1ccc(C(=O)N2CCCC2)cc1 ZINC000421417608 942562206 /nfs/dbraw/zinc/56/22/06/942562206.db2.gz HMYYJLBLQYIKSX-UHFFFAOYSA-N 0 0 367.405 3.700 20 5 FHBDRN O=C(OCc1ccc([N+](=O)[O-])c(F)c1)c1ccc(Br)s1 ZINC000781830426 942570410 /nfs/dbraw/zinc/57/04/10/942570410.db2.gz PMTZYIJQRHXOMB-UHFFFAOYSA-N 0 0 360.160 3.915 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CCO[C@@H](c2cccc(O)c2)C1 ZINC000120223106 942572644 /nfs/dbraw/zinc/57/26/44/942572644.db2.gz CPQBOIQVNJGPDP-GOSISDBHSA-N 0 0 371.393 3.523 20 5 FHBDRN CN(C)c1ccc(COC(=O)CC[C@H]2CC2(Cl)Cl)cc1[N+](=O)[O-] ZINC001268940867 942574049 /nfs/dbraw/zinc/57/40/49/942574049.db2.gz AVICMGZPNSDPLE-NSHDSACASA-N 0 0 361.225 3.678 20 5 FHBDRN Cc1ccccc1CO[C@H](C)C(=O)OCc1ccc(N(C)C)c([N+](=O)[O-])c1 ZINC001268940920 942574580 /nfs/dbraw/zinc/57/45/80/942574580.db2.gz CFADYYJMSBFCMM-OAHLLOKOSA-N 0 0 372.421 3.618 20 5 FHBDRN CC[C@@H](C)Oc1cc(C(=O)OCc2ccc(N(C)C)c([N+](=O)[O-])c2)ccn1 ZINC001268941487 942575937 /nfs/dbraw/zinc/57/59/37/942575937.db2.gz RAEGGGYQORFJSY-CYBMUJFWSA-N 0 0 373.409 3.590 20 5 FHBDRN O=[N+]([O-])c1ccc(NC[C@]2(CO)C[C@H]2c2ccc(F)cc2)c2cccnc21 ZINC000413263741 942578459 /nfs/dbraw/zinc/57/84/59/942578459.db2.gz MZBXZWRXCGFHKU-JXFKEZNVSA-N 0 0 367.380 3.860 20 5 FHBDRN Cc1cc(C(=O)NC(C)C)ccc1NC(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC000421448281 942580191 /nfs/dbraw/zinc/58/01/91/942580191.db2.gz UAXDHBLBMGRTLX-UHFFFAOYSA-N 0 0 369.421 3.911 20 5 FHBDRN CC[C@@H]1C[C@]1(NC(=O)COc1ccccc1[N+](=O)[O-])c1cccc(C)c1 ZINC000501632156 942581673 /nfs/dbraw/zinc/58/16/73/942581673.db2.gz RUOZJGHCPDEWMC-FOIQADDNSA-N 0 0 354.406 3.724 20 5 FHBDRN C[C@H](NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)c1c(F)cccc1F ZINC000513719549 942585015 /nfs/dbraw/zinc/58/50/15/942585015.db2.gz CLOWQHLURQUGAJ-QMMMGPOBSA-N 0 0 372.274 3.965 20 5 FHBDRN CSc1cc2c(cc1NC(=O)c1cc([N+](=O)[O-])c(C)cc1C)OCCO2 ZINC000421466949 942587784 /nfs/dbraw/zinc/58/77/84/942587784.db2.gz NVOPODYQKOXNKG-UHFFFAOYSA-N 0 0 374.418 3.957 20 5 FHBDRN CCNc1ccc(C(=O)N[C@@H](C)c2cc(F)ccc2OC)cc1[N+](=O)[O-] ZINC000501658585 942589979 /nfs/dbraw/zinc/58/99/79/942589979.db2.gz NCUUARUKOKFYDE-NSHDSACASA-N 0 0 361.373 3.665 20 5 FHBDRN CCn1nccc1C1CCN(c2nccc3ccc([N+](=O)[O-])cc32)CC1 ZINC000413272464 942595141 /nfs/dbraw/zinc/59/51/41/942595141.db2.gz UFZIAYPZPHELOS-UHFFFAOYSA-N 0 0 351.410 3.743 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N(C)C[C@H]1OCCc2ccccc21 ZINC000421456765 942595365 /nfs/dbraw/zinc/59/53/65/942595365.db2.gz ABCYUJZDXSDDDZ-LJQANCHMSA-N 0 0 354.406 3.598 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCC[C@@](CO)(c3ccccc3)C2)c2cccnc21 ZINC000413277114 942596581 /nfs/dbraw/zinc/59/65/81/942596581.db2.gz CTLOWERIDOIFPB-OAQYLSRUSA-N 0 0 363.417 3.674 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)Nc1ccc2nnc(C(C)C)n2c1 ZINC000421501114 942598342 /nfs/dbraw/zinc/59/83/42/942598342.db2.gz FGGMLJZCGGGBPN-UHFFFAOYSA-N 0 0 353.382 3.630 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CC[C@@H](COCc2ccccc2)C1 ZINC000421487304 942602288 /nfs/dbraw/zinc/60/22/88/942602288.db2.gz YOQTUGRYDQMFSB-GOSISDBHSA-N 0 0 368.433 3.891 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(NCCCc2nc(-c3ccc(F)cc3)no2)c1 ZINC000541331470 942603509 /nfs/dbraw/zinc/60/35/09/942603509.db2.gz NEVLSBHZXGTGCW-UHFFFAOYSA-N 0 0 372.356 3.837 20 5 FHBDRN COc1ccc(CCCCC(=O)NCc2ccc(OC)c([N+](=O)[O-])c2)cc1 ZINC000501674666 942604556 /nfs/dbraw/zinc/60/45/56/942604556.db2.gz JQBXSGRWTCRJEK-UHFFFAOYSA-N 0 0 372.421 3.641 20 5 FHBDRN CCc1cccc(C)c1NC(=O)Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1 ZINC000501675440 942605195 /nfs/dbraw/zinc/60/51/95/942605195.db2.gz BESISPJKJPOEHP-UHFFFAOYSA-N 0 0 364.405 3.968 20 5 FHBDRN Cn1nccc1C1=C[C@H]2CC[C@@H](C1)N2c1ccc([N+](=O)[O-])c2ncccc12 ZINC000413288660 942606067 /nfs/dbraw/zinc/60/60/67/942606067.db2.gz IDSUWZPRTNBQJO-CABCVRRESA-N 0 0 361.405 3.701 20 5 FHBDRN CCOC(=O)CN(C(=O)c1cc(C)ccc1[N+](=O)[O-])[C@H](C)c1ccccc1 ZINC000513918846 942607590 /nfs/dbraw/zinc/60/75/90/942607590.db2.gz PUCRVWOCNDJQSU-OAHLLOKOSA-N 0 0 370.405 3.670 20 5 FHBDRN COc1cc(C(=O)NC2(Cc3ccccc3)CCC2)c([N+](=O)[O-])cc1OC ZINC000472964878 942612285 /nfs/dbraw/zinc/61/22/85/942612285.db2.gz SLZWFQFRRAEYQZ-UHFFFAOYSA-N 0 0 370.405 3.507 20 5 FHBDRN CCOC(=O)Cc1ccccc1NC(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC000421480746 942613156 /nfs/dbraw/zinc/61/31/56/942613156.db2.gz WGRWBMQASMLBKM-UHFFFAOYSA-N 0 0 356.378 3.570 20 5 FHBDRN CCN(Cc1ccc(Cl)cc1[N+](=O)[O-])[C@H]1CCN(c2ccccc2)C1=O ZINC000522711087 942614265 /nfs/dbraw/zinc/61/42/65/942614265.db2.gz KMTVGTXXDAIGRK-KRWDZBQOSA-N 0 0 373.840 3.876 20 5 FHBDRN CC[C@H](CSc1ccccc1)NC(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000501690897 942615138 /nfs/dbraw/zinc/61/51/38/942615138.db2.gz FAYLLKIRZYGXSK-CQSZACIVSA-N 0 0 360.435 3.661 20 5 FHBDRN O=[N+]([O-])c1cnc(Nc2ccc(OCCCO)cc2)c(C(F)(F)F)c1 ZINC000413299998 942616479 /nfs/dbraw/zinc/61/64/79/942616479.db2.gz VLUMTIFUDLVVRN-UHFFFAOYSA-N 0 0 357.288 3.513 20 5 FHBDRN O=[N+]([O-])c1cnc(NCCCNc2ccccc2F)c(Br)c1 ZINC000541338522 942618367 /nfs/dbraw/zinc/61/83/67/942618367.db2.gz ODNWAOVHUYONQM-UHFFFAOYSA-N 0 0 369.194 3.806 20 5 FHBDRN CO[C@H](c1ccccc1F)[C@@H](C)NC(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC000421513403 942619260 /nfs/dbraw/zinc/61/92/60/942619260.db2.gz QADSCMCBWUOUJF-ACJLOTCBSA-N 0 0 360.385 3.857 20 5 FHBDRN CCCCc1ccc(NC(=O)[C@@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000104712962 942622315 /nfs/dbraw/zinc/62/23/15/942622315.db2.gz FIHBUYJXCLTIHF-CQSZACIVSA-N 0 0 369.421 3.694 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CCCCC[C@H]2C[C@H](C)O)ccc1[N+](=O)[O-] ZINC000413802400 942625260 /nfs/dbraw/zinc/62/52/60/942625260.db2.gz HICYAVLNNOFQMM-HOCLYGCPSA-N 0 0 364.442 3.538 20 5 FHBDRN CCSc1ccc(CC(=O)NCc2ccc(OC)c([N+](=O)[O-])c2)cc1 ZINC000501717097 942625558 /nfs/dbraw/zinc/62/55/58/942625558.db2.gz LEEAKKJBLKOSEX-UHFFFAOYSA-N 0 0 360.435 3.574 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CC2(CCOCC2)c2ccccc21 ZINC000421502450 942629189 /nfs/dbraw/zinc/62/91/89/942629189.db2.gz HGJSUQBYQZAHEU-UHFFFAOYSA-N 0 0 366.417 3.920 20 5 FHBDRN CO[C@H](c1ccc(F)cc1)[C@@H](C)NC(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC000421505363 942631162 /nfs/dbraw/zinc/63/11/62/942631162.db2.gz IPJRCHADXWKPQA-ACJLOTCBSA-N 0 0 360.385 3.857 20 5 FHBDRN COc1ccc(CCCC(=O)Nc2ccc([N+](=O)[O-])cc2F)c(OC)c1 ZINC000513953858 942632009 /nfs/dbraw/zinc/63/20/09/942632009.db2.gz UTWLVXHZNHMODV-UHFFFAOYSA-N 0 0 362.357 3.713 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CC(COc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000412348509 942632175 /nfs/dbraw/zinc/63/21/75/942632175.db2.gz NTVNWKBXIXMAFQ-UHFFFAOYSA-N 0 0 370.405 3.533 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NC[C@H]1CCN(c2ccccc2F)C1 ZINC000421537887 942632572 /nfs/dbraw/zinc/63/25/72/942632572.db2.gz BPIOBNSMFPXNAY-OAHLLOKOSA-N 0 0 371.412 3.607 20 5 FHBDRN CN(CCCc1cc(-c2cccc(F)c2)n[nH]1)c1ccncc1[N+](=O)[O-] ZINC000066810120 942633011 /nfs/dbraw/zinc/63/30/11/942633011.db2.gz UAHVLLPAYWTHTD-UHFFFAOYSA-N 0 0 355.373 3.588 20 5 FHBDRN O=C(Nc1ccnn1Cc1ccc(Cl)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000066813083 942645582 /nfs/dbraw/zinc/64/55/82/942645582.db2.gz QXACXBKHBPVAQJ-UHFFFAOYSA-N 0 0 374.759 3.884 20 5 FHBDRN O=C(NCc1ccc(Oc2cccc(F)c2)nc1)c1ccc([N+](=O)[O-])cc1 ZINC000501745220 942648155 /nfs/dbraw/zinc/64/81/55/942648155.db2.gz VHHBJOSWAVCKIN-UHFFFAOYSA-N 0 0 367.336 3.851 20 5 FHBDRN COc1cccc(C=C2CCN(C(=O)Cc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000472969671 942648606 /nfs/dbraw/zinc/64/86/06/942648606.db2.gz JOSWNVUWKZTBFR-UHFFFAOYSA-N 0 0 366.417 3.852 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NC1(Cc2ccccc2)CCOCC1 ZINC000421551364 942655378 /nfs/dbraw/zinc/65/53/78/942655378.db2.gz JEAVJLPASIAGAL-UHFFFAOYSA-N 0 0 368.433 3.733 20 5 FHBDRN CCc1ccc(C(=O)N2CCN[C@@H](c3cccc(Cl)c3)C2)cc1[N+](=O)[O-] ZINC000513995692 942656047 /nfs/dbraw/zinc/65/60/47/942656047.db2.gz ZOJJEAQTOVDJGI-QGZVFWFLSA-N 0 0 373.840 3.597 20 5 FHBDRN O=[N+]([O-])c1ccc(N[C@H]2CCO[C@@H](c3ccncc3)C2)c2cccnc21 ZINC000413319168 942658827 /nfs/dbraw/zinc/65/88/27/942658827.db2.gz OFKCRQLUIHQZKY-KBXCAEBGSA-N 0 0 350.378 3.870 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CCC3(CC2)OCCc2ccccc23)c(Cl)c1 ZINC000413325331 942665285 /nfs/dbraw/zinc/66/52/85/942665285.db2.gz FTLJNAOEGZLTMZ-UHFFFAOYSA-N 0 0 359.813 3.712 20 5 FHBDRN COc1cc(CCNC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)ccc1Cl ZINC000412367231 942671710 /nfs/dbraw/zinc/67/17/10/942671710.db2.gz MHVQTLVHTBSFAC-JKSUJKDBSA-N 0 0 374.824 3.719 20 5 FHBDRN CCCN(C(=O)c1cccc([N+](=O)[O-])c1C)[C@@H](C)C(=O)Nc1ccccc1 ZINC000502714411 942678381 /nfs/dbraw/zinc/67/83/81/942678381.db2.gz FJYBTZDTKLAEGV-HNNXBMFYSA-N 0 0 369.421 3.783 20 5 FHBDRN O=C(NC[C@H]1CC12CCSCC2)c1c([N+](=O)[O-])cccc1C(F)(F)F ZINC000421589217 942685958 /nfs/dbraw/zinc/68/59/58/942685958.db2.gz KTPAFHSBJZRACF-SNVBAGLBSA-N 0 0 374.384 3.877 20 5 FHBDRN Cc1c(Cc2noc([C@H]3CCc4ccccc4O3)n2)cccc1[N+](=O)[O-] ZINC000420489542 942693912 /nfs/dbraw/zinc/69/39/12/942693912.db2.gz XHKQEJQYDDANMQ-QGZVFWFLSA-N 0 0 351.362 3.943 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2C[C@H](c3ccccc3F)C2)c1 ZINC000549427707 942704368 /nfs/dbraw/zinc/70/43/68/942704368.db2.gz NIXUAQWNNNJKGX-JOCQHMNTSA-N 0 0 358.369 3.809 20 5 FHBDRN CCc1nc(Cc2noc([C@@H]3C[C@H]3c3ccc([N+](=O)[O-])cc3)n2)cs1 ZINC000420498636 942706254 /nfs/dbraw/zinc/70/62/54/942706254.db2.gz DAPITVHTAUIRPI-UONOGXRCSA-N 0 0 356.407 3.859 20 5 FHBDRN Cc1nn(C)c(-c2nc([C@@H]3CCC(C)(C)c4ccccc43)no2)c1[N+](=O)[O-] ZINC000420508758 942710313 /nfs/dbraw/zinc/71/03/13/942710313.db2.gz DZPPXBJGKZGXJP-CYBMUJFWSA-N 0 0 367.409 3.890 20 5 FHBDRN Cc1sc(C(=O)N2C[C@H](C(=O)OC(C)(C)C)CC[C@H]2C)cc1[N+](=O)[O-] ZINC000421634374 942712187 /nfs/dbraw/zinc/71/21/87/942712187.db2.gz PKTXUAHRYWIIIO-ZYHUDNBSSA-N 0 0 368.455 3.547 20 5 FHBDRN Cc1occc1-c1nnc(SCc2c(F)cc([N+](=O)[O-])cc2F)n1C ZINC000505425655 942723405 /nfs/dbraw/zinc/72/34/05/942723405.db2.gz CCIFLMJEBAZGEB-UHFFFAOYSA-N 0 0 366.349 3.862 20 5 FHBDRN CC[C@@H](C)[C@H]1CCCCN1C(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F ZINC001126425558 942723473 /nfs/dbraw/zinc/72/34/73/942723473.db2.gz NDNJQCJADMOHEY-IUODEOHRSA-N 0 0 351.422 3.841 20 5 FHBDRN CC[C@@H](C)[C@@H]1CCCCN1C(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F ZINC001126425557 942723559 /nfs/dbraw/zinc/72/35/59/942723559.db2.gz NDNJQCJADMOHEY-DOMZBBRYSA-N 0 0 351.422 3.841 20 5 FHBDRN CC(C)(CNC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1)c1cccnc1 ZINC000413891224 942726007 /nfs/dbraw/zinc/72/60/07/942726007.db2.gz VFPXUTZIWUSKBO-UHFFFAOYSA-N 0 0 368.437 3.642 20 5 FHBDRN COc1ccc2c(c1)OC[C@H](Nc1ccc3ncccc3c1[N+](=O)[O-])C2 ZINC000502788891 942743246 /nfs/dbraw/zinc/74/32/46/942743246.db2.gz IGUQEVSCKNWVML-CYBMUJFWSA-N 0 0 351.362 3.567 20 5 FHBDRN Cc1cccc([C@@H](NC(=O)Nc2ccncc2[N+](=O)[O-])c2ccccn2)c1 ZINC000183625635 942744019 /nfs/dbraw/zinc/74/40/19/942744019.db2.gz FJCPYQGWARQGJN-GOSISDBHSA-N 0 0 363.377 3.604 20 5 FHBDRN CCCCCn1cc(CNc2ccc3cc([N+](=O)[O-])ccc3n2)c(C)n1 ZINC000502791493 942744600 /nfs/dbraw/zinc/74/46/00/942744600.db2.gz BZVGMZQGYQQKOE-UHFFFAOYSA-N 0 0 353.426 3.872 20 5 FHBDRN O=[N+]([O-])c1cc(CN2CCOC[C@H]2c2nc3ccccc3s2)cs1 ZINC000502791200 942745128 /nfs/dbraw/zinc/74/51/28/942745128.db2.gz SCOLDQWSCSRCJQ-ZDUSSCGKSA-N 0 0 361.448 3.840 20 5 FHBDRN CCOC(=O)c1ccc(F)c(C)c1NC(=O)c1cc([N+](=O)[O-])ccc1C ZINC000505428926 942750067 /nfs/dbraw/zinc/75/00/67/942750067.db2.gz OUTBMILRVWFJKJ-UHFFFAOYSA-N 0 0 360.341 3.780 20 5 FHBDRN CC[C@H](C)COc1cc([N+](=O)[O-])c(Cn2nnc3ccccc32)cc1OC ZINC000514099950 942759100 /nfs/dbraw/zinc/75/91/00/942759100.db2.gz OZWXNGKKHBKARL-ZDUSSCGKSA-N 0 0 370.409 3.821 20 5 FHBDRN COc1ccccc1OCCN(C)c1ccc([N+](=O)[O-])cc1OC(F)F ZINC000780910788 942770444 /nfs/dbraw/zinc/77/04/44/942770444.db2.gz CZQBJAWRYQYUOH-UHFFFAOYSA-N 0 0 368.336 3.720 20 5 FHBDRN Cc1cnc(C2CCN(C(=O)c3cc([N+](=O)[O-])cc(C)c3F)CC2)s1 ZINC000367056493 942774542 /nfs/dbraw/zinc/77/45/42/942774542.db2.gz ZGILBTHKKGQQMM-UHFFFAOYSA-N 0 0 363.414 3.827 20 5 FHBDRN COc1ccc(C)cc1CCNC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000431869390 942779768 /nfs/dbraw/zinc/77/97/68/942779768.db2.gz JFRUGLSERSXVTN-UHFFFAOYSA-N 0 0 371.437 3.689 20 5 FHBDRN CCn1c(-c2ccc([N+](=O)[O-])cc2)nnc1N1CC[C@H](C)C2(CCC2)C1 ZINC000549437227 942794861 /nfs/dbraw/zinc/79/48/61/942794861.db2.gz KUUUHUNYEQORHK-AWEZNQCLSA-N 0 0 355.442 3.890 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N1CCC(c2cn[nH]c2)CC1 ZINC000378461829 942796017 /nfs/dbraw/zinc/79/60/17/942796017.db2.gz KSZCFUJBBWHKHO-UHFFFAOYSA-N 0 0 374.466 3.838 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N(C)c1ccc(C(=O)NC(C)(C)C)cc1 ZINC000413922725 942798496 /nfs/dbraw/zinc/79/84/96/942798496.db2.gz LDBKLOQSKDUJSS-UHFFFAOYSA-N 0 0 369.421 3.708 20 5 FHBDRN CC(C)N(Cc1ccccc1)S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000505443967 942799374 /nfs/dbraw/zinc/79/93/74/942799374.db2.gz BNZXFDVVVXRIHO-UHFFFAOYSA-N 0 0 368.842 3.848 20 5 FHBDRN C[C@H]1CCCC[C@H]1OCCNC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000431871691 942804796 /nfs/dbraw/zinc/80/47/96/942804796.db2.gz MPJUTFLZAVAVCD-WMLDXEAASA-N 0 0 363.458 3.724 20 5 FHBDRN C[C@H](Oc1ccc(Oc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1)C(N)=O ZINC000514191913 942817869 /nfs/dbraw/zinc/81/78/69/942817869.db2.gz DMWDYDIQZGVEEP-VIFPVBQESA-N 0 0 370.283 3.659 20 5 FHBDRN CS[C@@H]1CCC[C@H](NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)C1 ZINC000514194802 942819803 /nfs/dbraw/zinc/81/98/03/942819803.db2.gz LZSYPCOWGKEATK-WDEREUQCSA-N 0 0 360.382 3.600 20 5 FHBDRN COc1cccc(C(=O)N2CC[C@H](C(F)(F)F)C3(CCC3)C2)c1[N+](=O)[O-] ZINC000514211216 942821970 /nfs/dbraw/zinc/82/19/70/942821970.db2.gz PEBJILQJHAOEAI-ZDUSSCGKSA-N 0 0 372.343 3.798 20 5 FHBDRN COC(=O)c1cc2cc(Cn3nc(C)c4cc([N+](=O)[O-])ccc43)ccc2o1 ZINC000502897875 942823874 /nfs/dbraw/zinc/82/38/74/942823874.db2.gz BBOWXBSBKACPEB-UHFFFAOYSA-N 0 0 365.345 3.834 20 5 FHBDRN Cc1cc([C@H]2CN(C(=O)c3cc([N+](=O)[O-])c(C)cc3C)CCO2)ccc1F ZINC000421794455 942829673 /nfs/dbraw/zinc/82/96/73/942829673.db2.gz BSYLXQYTSLOADS-LJQANCHMSA-N 0 0 372.396 3.873 20 5 FHBDRN C[C@@H]1Cc2ccccc2[C@@H]1NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514221267 942832757 /nfs/dbraw/zinc/83/27/57/942832757.db2.gz BUWKKBKOLKBEEC-QLJPJBMISA-N 0 0 362.332 3.860 20 5 FHBDRN Cc1cc(F)cc2c1CN([C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C)CC2 ZINC000502910038 942835000 /nfs/dbraw/zinc/83/50/00/942835000.db2.gz UMEMHQUGFGJQKH-CQSZACIVSA-N 0 0 371.412 3.736 20 5 FHBDRN CCCNc1ccc(CNC(=O)N(C)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000502912254 942835956 /nfs/dbraw/zinc/83/59/56/942835956.db2.gz LWSVIRLCOJRZQV-UHFFFAOYSA-N 0 0 370.453 3.801 20 5 FHBDRN Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)N1CCC(c2nccs2)CC1 ZINC000367091517 942837623 /nfs/dbraw/zinc/83/76/23/942837623.db2.gz KVDCEQJPYGWGHZ-UHFFFAOYSA-N 0 0 364.402 3.910 20 5 FHBDRN Cc1ccncc1C1=CCN(C(=O)CCc2cccc([N+](=O)[O-])c2)CC1 ZINC000378504783 942839209 /nfs/dbraw/zinc/83/92/09/942839209.db2.gz ADYPYWNOUJZUIY-UHFFFAOYSA-N 0 0 351.406 3.547 20 5 FHBDRN C[C@H](CNC(=O)Nc1ccncc1[N+](=O)[O-])c1ccc(C(F)(F)F)cc1 ZINC000190172195 942848984 /nfs/dbraw/zinc/84/89/84/942848984.db2.gz KPLBAGQQEVGVOP-SNVBAGLBSA-N 0 0 368.315 3.934 20 5 FHBDRN C[C@@H](CNC(=O)Nc1ccncc1[N+](=O)[O-])c1ccc(C(F)(F)F)cc1 ZINC000190172175 942849070 /nfs/dbraw/zinc/84/90/70/942849070.db2.gz KPLBAGQQEVGVOP-JTQLQIEISA-N 0 0 368.315 3.934 20 5 FHBDRN COc1ccc(OCc2nnc(-c3ccccc3Cl)o2)cc1[N+](=O)[O-] ZINC000190188941 942850092 /nfs/dbraw/zinc/85/00/92/942850092.db2.gz ORAVKOVDGFNEBO-UHFFFAOYSA-N 0 0 361.741 3.886 20 5 FHBDRN CCc1ccc([C@@H]2CN(C(=O)c3cc(Cl)cc([N+](=O)[O-])c3)CCN2)cc1 ZINC000505469209 942863051 /nfs/dbraw/zinc/86/30/51/942863051.db2.gz NTRUPXYRKWCEHP-SFHVURJKSA-N 0 0 373.840 3.597 20 5 FHBDRN O=C(Nc1cccc2c1C[N@@H+](C1CC1)C2)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000378527547 942863916 /nfs/dbraw/zinc/86/39/16/942863916.db2.gz VMHBXTSHERBVJS-UHFFFAOYSA-N 0 0 357.797 3.979 20 5 FHBDRN CCCc1[nH]ccc1C(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000421870144 942869236 /nfs/dbraw/zinc/86/92/36/942869236.db2.gz ANBIYJRTVWICKU-UHFFFAOYSA-N 0 0 355.316 3.824 20 5 FHBDRN CCc1ccc(NC(=O)COc2ccc([N+](=O)[O-])c3cccnc23)cc1F ZINC000502956972 942875875 /nfs/dbraw/zinc/87/58/75/942875875.db2.gz OKJMPQUKXBYVDV-UHFFFAOYSA-N 0 0 369.352 3.862 20 5 FHBDRN C[C@@H]1C[C@H](C(F)(F)F)CCN1C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412379351 942877626 /nfs/dbraw/zinc/87/76/26/942877626.db2.gz GMYCVDAUDRARAT-WAZAZEMKSA-N 0 0 356.344 3.888 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])c2ccncc12)c1ccc(Br)cn1 ZINC001280074985 942879651 /nfs/dbraw/zinc/87/96/51/942879651.db2.gz ABEGXPAAZPKJBK-UHFFFAOYSA-N 0 0 373.166 3.553 20 5 FHBDRN O=C(OCc1cc(F)cc2c1OCOC2)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000016582981 942880491 /nfs/dbraw/zinc/88/04/91/942880491.db2.gz LAODCPVNPUJVPP-UHFFFAOYSA-N 0 0 367.716 3.611 20 5 FHBDRN O=[N+]([O-])c1cccc(CNc2ccc(Cl)c(CN3CCOCC3)c2)c1 ZINC000430085802 942881483 /nfs/dbraw/zinc/88/14/83/942881483.db2.gz BQZVJJOFXVDEOR-UHFFFAOYSA-N 0 0 361.829 3.693 20 5 FHBDRN C[C@]1(Cc2ccc(F)cc2)CCCN1C(=O)c1cccc([N+](=O)[O-])c1N ZINC000421928026 942882969 /nfs/dbraw/zinc/88/29/69/942882969.db2.gz VGNMCYBGHYGJIZ-LJQANCHMSA-N 0 0 357.385 3.554 20 5 FHBDRN C[C@H](NC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)[C@@H](C)c1ccccc1 ZINC000473550749 942897509 /nfs/dbraw/zinc/89/75/09/942897509.db2.gz LWDUNBBFQFWVOD-CABCVRRESA-N 0 0 364.405 3.703 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])c2cccnc12)N1CC[C@H](C2CCCC2)C1 ZINC000421942150 942897946 /nfs/dbraw/zinc/89/79/46/942897946.db2.gz CFHPSRRSJPDPRL-HNNXBMFYSA-N 0 0 369.421 3.561 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N(Cc1ccccc1)c1ccccn1 ZINC000514326057 942899859 /nfs/dbraw/zinc/89/98/59/942899859.db2.gz JQSZCQSPDIUQQN-UHFFFAOYSA-N 0 0 363.373 3.845 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])c2cccnc12)N1CCC[C@@H](CC(F)(F)F)C1 ZINC000421956385 942906303 /nfs/dbraw/zinc/90/63/03/942906303.db2.gz HYHCBTUTQAVCFH-NSHDSACASA-N 0 0 367.327 3.948 20 5 FHBDRN CC(=O)c1ccc(N2CCC[C@H]2c2cccc3c2OCCO3)c([N+](=O)[O-])c1 ZINC000066818770 942909539 /nfs/dbraw/zinc/90/95/39/942909539.db2.gz MNIBXVDWPZIWOO-INIZCTEOSA-N 0 0 368.389 3.910 20 5 FHBDRN CC[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)C[C@H](CC)O1 ZINC000421973983 942911936 /nfs/dbraw/zinc/91/19/36/942911936.db2.gz LDKJSMGMVBCXEO-RYUDHWBXSA-N 0 0 360.332 3.643 20 5 FHBDRN O=C(Cc1cnccc1Cl)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000412381129 942925050 /nfs/dbraw/zinc/92/50/50/942925050.db2.gz STNKAKGLDZELSZ-CQSZACIVSA-N 0 0 359.813 3.592 20 5 FHBDRN CN([C@H]1CCC[C@H]1c1ccccc1)S(=O)(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000416538776 942928057 /nfs/dbraw/zinc/92/80/57/942928057.db2.gz BVDSOXLOIXLDRH-OALUTQOASA-N 0 0 374.462 3.693 20 5 FHBDRN Cc1nc2c(s1)[C@H](NC(=O)c1ccc(Cl)cc1[N+](=O)[O-])CCC2 ZINC000378594079 942928264 /nfs/dbraw/zinc/92/82/64/942928264.db2.gz MPPXJFXMBDVLQC-GFCCVEGCSA-N 0 0 351.815 3.821 20 5 FHBDRN CN([C@@H]1CCC[C@H]1c1ccccc1)S(=O)(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000416538777 942928277 /nfs/dbraw/zinc/92/82/77/942928277.db2.gz BVDSOXLOIXLDRH-RBUKOAKNSA-N 0 0 374.462 3.693 20 5 FHBDRN O=C(CCc1cc(F)ccc1[N+](=O)[O-])NCc1ccc(Cl)cc1F ZINC001269853879 942934474 /nfs/dbraw/zinc/93/44/74/942934474.db2.gz MIIZVRZSTJQLLA-UHFFFAOYSA-N 0 0 354.740 3.775 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)C(=O)OC(C)(C)C ZINC000503062987 942944578 /nfs/dbraw/zinc/94/45/78/942944578.db2.gz XHKSFLAKNCMHDV-NSHDSACASA-N 0 0 368.455 3.557 20 5 FHBDRN CSc1ccc(C(=O)N[C@H]2CCCc3c(O)cccc32)cc1[N+](=O)[O-] ZINC000190218543 942948585 /nfs/dbraw/zinc/94/85/85/942948585.db2.gz LTJJPLQQDCXSBT-AWEZNQCLSA-N 0 0 358.419 3.830 20 5 FHBDRN O=c1cc(C(F)(F)F)nc(SCc2nc3cc([N+](=O)[O-])ccc3o2)[nH]1 ZINC000434791547 942969896 /nfs/dbraw/zinc/96/98/96/942969896.db2.gz AKVBHSGCOOOSPH-UHFFFAOYSA-N 0 0 372.284 3.543 20 5 FHBDRN Cc1c(N[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)cnn1-c1ccccc1 ZINC000126444615 942972677 /nfs/dbraw/zinc/97/26/77/942972677.db2.gz ZODUJZBYXQSNPT-CYBMUJFWSA-N 0 0 365.393 3.528 20 5 FHBDRN CC1(C)CN(C(=O)CSc2ccc([N+](=O)[O-])cc2)[C@@H]1c1cccnc1 ZINC000293746838 943005732 /nfs/dbraw/zinc/00/57/32/943005732.db2.gz LWBHCVWWHNHPTE-QGZVFWFLSA-N 0 0 357.435 3.692 20 5 FHBDRN O=C(NCCCO[C@@H]1CCCc2ccccc21)c1csc([N+](=O)[O-])c1 ZINC000505556423 943014132 /nfs/dbraw/zinc/01/41/32/943014132.db2.gz YTCYYFRCPJGKRK-MRXNPFEDSA-N 0 0 360.435 3.870 20 5 FHBDRN COc1ccc(C(=O)C2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000014324977 943026333 /nfs/dbraw/zinc/02/63/33/943026333.db2.gz JCELNHYXMPGOCV-UHFFFAOYSA-N 0 0 354.406 3.698 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)N[C@@H]1C[C@@H]1c1ccccc1C(F)(F)F ZINC000505559312 943028052 /nfs/dbraw/zinc/02/80/52/943028052.db2.gz VFVNVVVMDQCJFS-GDBMZVCRSA-N 0 0 364.323 3.828 20 5 FHBDRN C[C@H]1c2c(Cl)cc(Cl)cc2CCN1CCn1ccc([N+](=O)[O-])n1 ZINC000434895379 943032979 /nfs/dbraw/zinc/03/29/79/943032979.db2.gz JUJQYCXOVCMZTP-JTQLQIEISA-N 0 0 355.225 3.717 20 5 FHBDRN Cc1ccc(Oc2ccc(NC(=O)c3ccc([N+](=O)[O-])n3C)cn2)cc1 ZINC000514463506 943033044 /nfs/dbraw/zinc/03/30/44/943033044.db2.gz RWFGVGORBBNYCC-UHFFFAOYSA-N 0 0 352.350 3.681 20 5 FHBDRN C[C@@H](NC(=O)N1CCC[C@@H](Oc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000416675228 943036231 /nfs/dbraw/zinc/03/62/31/943036231.db2.gz DHTDQBLQAPSZPR-DNVCBOLYSA-N 0 0 369.421 3.909 20 5 FHBDRN COc1cc(C(=O)N(C)Cc2c(F)cccc2Cl)ccc1[N+](=O)[O-] ZINC000511576171 943038845 /nfs/dbraw/zinc/03/88/45/943038845.db2.gz BCXXGFGMALGORM-UHFFFAOYSA-N 0 0 352.749 3.668 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)N[C@@H]2COCc3ccccc32)cc1[N+](=O)[O-] ZINC000416683998 943038935 /nfs/dbraw/zinc/03/89/35/943038935.db2.gz KYGZVMTVKNRKIZ-SUMWQHHRSA-N 0 0 355.394 3.535 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)N(CCCO)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000434903844 943041169 /nfs/dbraw/zinc/04/11/69/943041169.db2.gz KXNHKMWTRPCPEE-UHFFFAOYSA-N 0 0 370.449 3.917 20 5 FHBDRN COc1cc(C(=O)N2CC(C)(C)[C@H]2c2ccncc2)cc([N+](=O)[O-])c1C ZINC000293757839 943042810 /nfs/dbraw/zinc/04/28/10/943042810.db2.gz CMEJADCIDOMEBU-QGZVFWFLSA-N 0 0 355.394 3.530 20 5 FHBDRN C[C@@H](C(=O)NC[C@@H]1CCOc2ccccc21)c1ccc([N+](=O)[O-])cc1F ZINC000183865985 943044022 /nfs/dbraw/zinc/04/40/22/943044022.db2.gz NMWUBGXIZQCVJA-OLZOCXBDSA-N 0 0 358.369 3.520 20 5 FHBDRN CN(C(=O)c1cc2cc([N+](=O)[O-])ccc2s1)c1nc2ccccc2n1C ZINC000183702106 943051901 /nfs/dbraw/zinc/05/19/01/943051901.db2.gz DLMJFUQZZWVHPS-UHFFFAOYSA-N 0 0 366.402 3.973 20 5 FHBDRN CCOc1ccc(OC)cc1NCc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000184011520 943058427 /nfs/dbraw/zinc/05/84/27/943058427.db2.gz KMJGYEVCTGWKTR-UHFFFAOYSA-N 0 0 350.346 3.762 20 5 FHBDRN Cn1c(C(=O)NCc2cccc(Oc3ccccc3)c2)ccc1[N+](=O)[O-] ZINC000514500841 943059152 /nfs/dbraw/zinc/05/91/52/943059152.db2.gz PNEMMTBFSCLHPP-UHFFFAOYSA-N 0 0 351.362 3.656 20 5 FHBDRN CCO[C@@H]1C[C@H](N(C)C(=O)c2ccc(OC)c([N+](=O)[O-])c2)C1(CC)CC ZINC000434171455 943065879 /nfs/dbraw/zinc/06/58/79/943065879.db2.gz CRBTYJAPBALMFG-DLBZAZTESA-N 0 0 364.442 3.659 20 5 FHBDRN Cc1ncccc1OC[C@@H]1CCCN1C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000416732688 943067628 /nfs/dbraw/zinc/06/76/28/943067628.db2.gz KWTBZYKRJXNRIY-HNNXBMFYSA-N 0 0 370.409 3.682 20 5 FHBDRN CCCOc1cc(NC(=O)NCC(C)C)c([N+](=O)[O-])cc1OCCC ZINC000514504119 943068311 /nfs/dbraw/zinc/06/83/11/943068311.db2.gz MYAYGCCBVXLAML-UHFFFAOYSA-N 0 0 353.419 3.950 20 5 FHBDRN O=C1CCc2ccc(OCc3coc(-c4ccc([N+](=O)[O-])cc4)n3)cc2N1 ZINC000505582600 943082720 /nfs/dbraw/zinc/08/27/20/943082720.db2.gz TZQQBMDPGKZWKQ-UHFFFAOYSA-N 0 0 365.345 3.714 20 5 FHBDRN CCc1ccc(CN(C2CC2)S(=O)(=O)c2ccc([N+](=O)[O-])cc2C)cc1 ZINC000514542216 943084887 /nfs/dbraw/zinc/08/48/87/943084887.db2.gz IQUUAMZSVGXDGM-UHFFFAOYSA-N 0 0 374.462 3.819 20 5 FHBDRN COCC[C@H](NC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(C)o1 ZINC000272146891 943101185 /nfs/dbraw/zinc/10/11/85/943101185.db2.gz CKWIHOSGYYROJQ-BBRMVZONSA-N 0 0 361.398 3.634 20 5 FHBDRN C[C@@H](C[N@H+](C)Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)C(=O)[O-] ZINC000414652225 943103243 /nfs/dbraw/zinc/10/32/43/943103243.db2.gz GQPMFXYICHOTQT-LBPRGKRZSA-N 0 0 362.357 3.679 20 5 FHBDRN O=C(NCCc1ccco1)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 ZINC000514561782 943111136 /nfs/dbraw/zinc/11/11/36/943111136.db2.gz FRRUZXJCPWATPZ-UHFFFAOYSA-N 0 0 352.346 3.953 20 5 FHBDRN C[C@H](CCc1ccccc1[N+](=O)[O-])NCc1noc(-c2ccccc2F)n1 ZINC000435031246 943114002 /nfs/dbraw/zinc/11/40/02/943114002.db2.gz ZFSHAZDLPRWHIU-CYBMUJFWSA-N 0 0 370.384 3.895 20 5 FHBDRN COC(=O)[C@@H]1CC[C@@H](c2ccccc2)N1Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000435032528 943115962 /nfs/dbraw/zinc/11/59/62/943115962.db2.gz GIMBTVBLGKMCPI-ROUUACIJSA-N 0 0 354.406 3.782 20 5 FHBDRN C[C@@H](Oc1ccc2c(c1)CCC2)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000545925972 943119134 /nfs/dbraw/zinc/11/91/34/943119134.db2.gz AFMBYSUKNWVWPX-GFCCVEGCSA-N 0 0 374.824 3.821 20 5 FHBDRN CCOC(=O)c1ccnc(N2CCC[C@@H]2/C=C\c2ccccc2)c1[N+](=O)[O-] ZINC000503316554 943121253 /nfs/dbraw/zinc/12/12/53/943121253.db2.gz MKUMVEJQYJTGNL-BLIJAFNYSA-N 0 0 367.405 3.849 20 5 FHBDRN Cc1ccc([C@@H](CC(=O)OC(C)C)NC(=O)c2ccccc2[N+](=O)[O-])cc1 ZINC000014383011 943128352 /nfs/dbraw/zinc/12/83/52/943128352.db2.gz VGZYPHLMLJJIKR-QGZVFWFLSA-N 0 0 370.405 3.716 20 5 FHBDRN Cc1ccc(C[S@@](=O)Cc2cc([N+](=O)[O-])cc3c2OCOC3)c(C)c1 ZINC000514602866 943141633 /nfs/dbraw/zinc/14/16/33/943141633.db2.gz GQJIRBBNBCFVPH-RUZDIDTESA-N 0 0 361.419 3.527 20 5 FHBDRN Cc1cccc2c1OC[C@H](NC(=O)Nc1cc([N+](=O)[O-])c(C)cc1C)C2 ZINC000514609779 943146099 /nfs/dbraw/zinc/14/60/99/943146099.db2.gz LXGVMQKKYSBYRD-OAHLLOKOSA-N 0 0 355.394 3.645 20 5 FHBDRN COc1ccc2c(c1)CCC[C@H]2N(C)C(=O)c1cc([N+](=O)[O-])ccc1OC ZINC000505597465 943146934 /nfs/dbraw/zinc/14/69/34/943146934.db2.gz RDENGRJVQDRNEX-GOSISDBHSA-N 0 0 370.405 3.762 20 5 FHBDRN CCN(Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)Cc1ccccc1C ZINC000048059139 943154961 /nfs/dbraw/zinc/15/49/61/943154961.db2.gz VSHLLJQZMGBCOM-UHFFFAOYSA-N 0 0 352.394 3.975 20 5 FHBDRN Nc1ccc([N+](=O)[O-])cc1C(=O)OCc1csc(-c2cccs2)n1 ZINC000016814325 943158954 /nfs/dbraw/zinc/15/89/54/943158954.db2.gz WSYCFMULKUCLHZ-UHFFFAOYSA-N 0 0 361.404 3.719 20 5 FHBDRN Cc1cccc(NC(=O)COc2ccc([N+](=O)[O-])cc2Br)c1 ZINC000133682853 943172430 /nfs/dbraw/zinc/17/24/30/943172430.db2.gz HKQKIXBYCYVWIG-UHFFFAOYSA-N 0 0 365.183 3.683 20 5 FHBDRN Cc1ccccc1[C@H](NS(=O)(=O)CCc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000503432501 943181554 /nfs/dbraw/zinc/18/15/54/943181554.db2.gz VTHMYZYXALUCFF-LJQANCHMSA-N 0 0 374.462 3.516 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CCC(c3nc4c(s3)CCCC4)CC2)c(F)c1 ZINC000425282992 943186396 /nfs/dbraw/zinc/18/63/96/943186396.db2.gz SGHXEKLWTFNSAH-UHFFFAOYSA-N 0 0 362.430 3.848 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N[C@@H]1CCN(c2ccc(F)cc2)C1 ZINC000416923002 943220108 /nfs/dbraw/zinc/22/01/08/943220108.db2.gz PYMDUYSZAANSSM-OAHLLOKOSA-N 0 0 372.400 3.751 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)c1nc(C)oc1-c1ccccc1 ZINC000183823084 943236203 /nfs/dbraw/zinc/23/62/03/943236203.db2.gz AZLFSONMZIJXIT-UHFFFAOYSA-N 0 0 353.334 3.819 20 5 FHBDRN C[C@H]1C[C@@H](C(C)(C)C)CCN1C(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000503542536 943238382 /nfs/dbraw/zinc/23/83/82/943238382.db2.gz XQNPKGVTRXLHCO-STQMWFEESA-N 0 0 373.457 3.827 20 5 FHBDRN O=[N+]([O-])c1ccc(NC[C@@H](O)CCc2ccccc2)c(Br)c1 ZINC000503562457 943248399 /nfs/dbraw/zinc/24/83/99/943248399.db2.gz KOINJHLEMMNIQG-AWEZNQCLSA-N 0 0 365.227 3.763 20 5 FHBDRN CCc1ccc([C@H]2CCN(C(=O)NCCc3ccccc3[N+](=O)[O-])C2)cc1 ZINC000431912149 943253815 /nfs/dbraw/zinc/25/38/15/943253815.db2.gz LMNZBQGRXXQBLA-IBGZPJMESA-N 0 0 367.449 3.899 20 5 FHBDRN CSc1cccc(C(=O)Nc2ccc3c(c2)C(=O)CCO3)c1[N+](=O)[O-] ZINC000365856881 943259822 /nfs/dbraw/zinc/25/98/22/943259822.db2.gz JYRJEWKLQQTRMA-UHFFFAOYSA-N 0 0 358.375 3.534 20 5 FHBDRN CCn1c(SCc2cccc([N+](=O)[O-])c2C)nnc1-c1ccncc1 ZINC000042110601 943281702 /nfs/dbraw/zinc/28/17/02/943281702.db2.gz QIKGPWOOBFIOHT-UHFFFAOYSA-N 0 0 355.423 3.869 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N1CCC[C@@H](Oc2ccccc2)C1 ZINC000417000281 943282402 /nfs/dbraw/zinc/28/24/02/943282402.db2.gz REIQACVHBFELLI-MRXNPFEDSA-N 0 0 371.393 3.679 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N1CCC[C@H](Oc2ccccc2)C1 ZINC000417000278 943282575 /nfs/dbraw/zinc/28/25/75/943282575.db2.gz REIQACVHBFELLI-INIZCTEOSA-N 0 0 371.393 3.679 20 5 FHBDRN COc1cccc([C@@H]2C[C@H]2CNC(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)c1 ZINC000416999679 943282746 /nfs/dbraw/zinc/28/27/46/943282746.db2.gz IBACTBZRLBHRAX-BBRMVZONSA-N 0 0 371.393 3.537 20 5 FHBDRN CN(C(=O)c1cc2cc([N+](=O)[O-])ccc2o1)[C@@H](CCO)c1ccccc1 ZINC000503609421 943289259 /nfs/dbraw/zinc/28/92/59/943289259.db2.gz NBVSPLGJDWHMBF-INIZCTEOSA-N 0 0 354.362 3.537 20 5 FHBDRN O=C(COc1ccsc1)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F ZINC000503633127 943301399 /nfs/dbraw/zinc/30/13/99/943301399.db2.gz LFKFZYJYUACQHV-UHFFFAOYSA-N 0 0 374.340 3.626 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](CC)[C@@H]1CCCO1 ZINC000503616788 943302750 /nfs/dbraw/zinc/30/27/50/943302750.db2.gz IXUAFLUWUIPEEG-GJZGRUSLSA-N 0 0 352.456 3.784 20 5 FHBDRN O=C(NCCc1ccccc1[N+](=O)[O-])NC[C@H](c1ccccc1)C1CC1 ZINC000431917746 943313456 /nfs/dbraw/zinc/31/34/56/943313456.db2.gz ZTEGMFOGNUNSMW-GOSISDBHSA-N 0 0 353.422 3.630 20 5 FHBDRN CCCn1c(-c2nc(-c3c([N+](=O)[O-])nc(C)n3C)no2)cc2ccccc21 ZINC000514819358 943320754 /nfs/dbraw/zinc/32/07/54/943320754.db2.gz YMWGZCUMIHZHEC-UHFFFAOYSA-N 0 0 366.381 3.718 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCc1nc2cc(F)ccc2o1 ZINC000425335494 943322696 /nfs/dbraw/zinc/32/26/96/943322696.db2.gz ZZZNBLNLDBCKPG-CYBMUJFWSA-N 0 0 371.368 3.760 20 5 FHBDRN Cc1c(NC(=O)N[C@@H]2C=CCCC2)cc(Br)cc1[N+](=O)[O-] ZINC000435322970 943323724 /nfs/dbraw/zinc/32/37/24/943323724.db2.gz INZJVTVZKHMKCP-LLVKDONJSA-N 0 0 354.204 3.896 20 5 FHBDRN CS[C@@H](C)CNC(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000435327032 943326836 /nfs/dbraw/zinc/32/68/36/943326836.db2.gz FTZVCTSVQWXJOP-ZETCQYMHSA-N 0 0 362.249 3.539 20 5 FHBDRN Cc1c(NC(=O)N[C@H]2CS[C@@H](C)C2)cc(Br)cc1[N+](=O)[O-] ZINC000417075074 943329056 /nfs/dbraw/zinc/32/90/56/943329056.db2.gz LPBSUDIXTLQCIZ-OIBJUYFYSA-N 0 0 374.260 3.681 20 5 FHBDRN Cc1c(Br)c(N2CCCCC[C@H]2C[C@@H](C)O)ncc1[N+](=O)[O-] ZINC000318891580 943337981 /nfs/dbraw/zinc/33/79/81/943337981.db2.gz OFWNUKMCHFPGAT-PWSUYJOCSA-N 0 0 372.263 3.581 20 5 FHBDRN O=C(Cc1ccc(C(F)(F)F)cc1)NCCc1ccc([N+](=O)[O-])cc1 ZINC000053215037 943344877 /nfs/dbraw/zinc/34/48/77/943344877.db2.gz IRAUNQAKNQPLOU-UHFFFAOYSA-N 0 0 352.312 3.515 20 5 FHBDRN COc1ccc(-c2ccc(CN(C)[C@@H](C)c3nc(C)no3)o2)c([N+](=O)[O-])c1 ZINC000514871788 943351174 /nfs/dbraw/zinc/35/11/74/943351174.db2.gz DENOGOQOMNTXLN-NSHDSACASA-N 0 0 372.381 3.748 20 5 FHBDRN CCOc1cc(NC(=O)N[C@H]2CCC[C@H]2C)c([N+](=O)[O-])cc1OCC ZINC000503783907 943369397 /nfs/dbraw/zinc/36/93/97/943369397.db2.gz RMVCWAXQVQBIED-NEPJUHHUSA-N 0 0 351.403 3.702 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1CCC[C@H]1/C=C/c1ccccc1 ZINC000503801598 943374699 /nfs/dbraw/zinc/37/46/99/943374699.db2.gz VQQJYMKREBXMNX-UJGDBWEASA-N 0 0 372.446 3.770 20 5 FHBDRN CCCOc1ccc2c(c1)CCN(C(=O)c1cccc([N+](=O)[O-])c1C)C2 ZINC000435389040 943376749 /nfs/dbraw/zinc/37/67/49/943376749.db2.gz KKPBIKGCIVEKIW-UHFFFAOYSA-N 0 0 354.406 3.891 20 5 FHBDRN NC(=O)c1ccc(CSc2nc3cc(Cl)ccc3o2)c([N+](=O)[O-])c1 ZINC000053222313 943382486 /nfs/dbraw/zinc/38/24/86/943382486.db2.gz DHTBPRKQQGSCGB-UHFFFAOYSA-N 0 0 363.782 3.781 20 5 FHBDRN O=C(c1cc2cc([N+](=O)[O-])ccc2o1)N(Cc1ccco1)C[C@@H]1CCCO1 ZINC000511608008 943399008 /nfs/dbraw/zinc/39/90/08/943399008.db2.gz ASBNZUIJPLIVPT-INIZCTEOSA-N 0 0 370.361 3.755 20 5 FHBDRN CC(C)c1ccc(N(C)S(=O)(=O)CCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000503883169 943402187 /nfs/dbraw/zinc/40/21/87/943402187.db2.gz ILSRRICNKIDZCS-UHFFFAOYSA-N 0 0 362.451 3.727 20 5 FHBDRN O=C(c1c([N+](=O)[O-])cccc1C(F)(F)F)N1CC[C@@H](c2cccnc2)C1 ZINC000514941141 943408968 /nfs/dbraw/zinc/40/89/68/943408968.db2.gz WWVZQINHJNQHDW-GFCCVEGCSA-N 0 0 365.311 3.638 20 5 FHBDRN COc1ccccc1[C@@H](C)CC(=O)OCCN(C)c1ccc([N+](=O)[O-])cc1 ZINC000728770057 943429375 /nfs/dbraw/zinc/42/93/75/943429375.db2.gz XLIJMWSXZPWYQO-HNNXBMFYSA-N 0 0 372.421 3.777 20 5 FHBDRN C[C@@H](CC(F)(F)F)NC(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC001267824899 943432585 /nfs/dbraw/zinc/43/25/85/943432585.db2.gz JMNMOIDBVWKVLH-JTQLQIEISA-N 0 0 353.300 3.728 20 5 FHBDRN C[C@H](CC(F)(F)F)NC(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC001267824900 943432589 /nfs/dbraw/zinc/43/25/89/943432589.db2.gz JMNMOIDBVWKVLH-SNVBAGLBSA-N 0 0 353.300 3.728 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)N(C)c2ccc(Cl)cc2F)cc1C ZINC000435486801 943442842 /nfs/dbraw/zinc/44/28/42/943442842.db2.gz KWZNYSPLHKLIIH-UHFFFAOYSA-N 0 0 372.805 3.829 20 5 FHBDRN Cc1cnc(OCc2c(F)ccc(Br)c2F)c([N+](=O)[O-])c1 ZINC000435499016 943457139 /nfs/dbraw/zinc/45/71/39/943457139.db2.gz BPEOTAQKBJAYMH-UHFFFAOYSA-N 0 0 359.126 3.918 20 5 FHBDRN CSc1ccc(F)cc1CNC(=O)Nc1ccc([N+](=O)[O-])cc1F ZINC000515017658 943459305 /nfs/dbraw/zinc/45/93/05/943459305.db2.gz CDUUVJYNVWVPFY-UHFFFAOYSA-N 0 0 353.350 3.917 20 5 FHBDRN COc1ccc([C@H](NC(=O)Nc2cc([N+](=O)[O-])ccc2OC)C2CC2)cc1 ZINC000504002727 943461530 /nfs/dbraw/zinc/46/15/30/943461530.db2.gz OSNDUJXPCNVMEF-GOSISDBHSA-N 0 0 371.393 3.885 20 5 FHBDRN C[C@H](CCc1ccccc1)NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000017155654 943484669 /nfs/dbraw/zinc/48/46/69/943484669.db2.gz DRWVZSKTVJCPMS-CQSZACIVSA-N 0 0 353.422 3.920 20 5 FHBDRN COc1ccc(Cl)cc1NC(=O)COc1cc([N+](=O)[O-])ccc1C ZINC000042180171 943491774 /nfs/dbraw/zinc/49/17/74/943491774.db2.gz WJAWNMUDFYZKGT-UHFFFAOYSA-N 0 0 350.758 3.583 20 5 FHBDRN O=C1CCc2cc([N+](=O)[O-])c(N[C@H]3C[C@H](c4cccc(F)c4)C3)cc2N1 ZINC000435586829 943504099 /nfs/dbraw/zinc/50/40/99/943504099.db2.gz CNWWKYBADBXKRR-CTYIDZIISA-N 0 0 355.369 3.977 20 5 FHBDRN COc1ccc([C@H](C)OC(=O)COc2cccc([N+](=O)[O-])c2)cc1Cl ZINC000728771920 943510438 /nfs/dbraw/zinc/51/04/38/943510438.db2.gz ACJIVBQHBDRZMM-NSHDSACASA-N 0 0 365.769 3.940 20 5 FHBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc(Cl)nc1 ZINC000103744467 943518213 /nfs/dbraw/zinc/51/82/13/943518213.db2.gz NCURMXSGAJNUKW-QMMMGPOBSA-N 0 0 356.165 3.703 20 5 FHBDRN CCOc1ccc(C(=O)N2CC[C@@H](COc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000504154653 943523438 /nfs/dbraw/zinc/52/34/38/943523438.db2.gz BPHRCHGWUKEOJM-OAHLLOKOSA-N 0 0 370.405 3.535 20 5 FHBDRN O=C(c1c[nH]c2ccc([N+](=O)[O-])cc12)N1CC[C@@H](c2cccc(F)c2)C1 ZINC000515147321 943524080 /nfs/dbraw/zinc/52/40/80/943524080.db2.gz GRXFHXGGKBJSII-CYBMUJFWSA-N 0 0 353.353 3.845 20 5 FHBDRN COc1cccc(N(CC(C)C)C(=O)c2cccc(OC)c2[N+](=O)[O-])c1 ZINC000435627813 943526814 /nfs/dbraw/zinc/52/68/14/943526814.db2.gz SNKYFHFTVWLWIT-UHFFFAOYSA-N 0 0 358.394 3.915 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NC[C@@H]1OCCc2ccccc21 ZINC000364090440 943530661 /nfs/dbraw/zinc/53/06/61/943530661.db2.gz MTXPDUBRUNTVFI-KRWDZBQOSA-N 0 0 355.394 3.647 20 5 FHBDRN C[C@@H]1CCN(C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)[C@H]2CCCC[C@@H]12 ZINC000515171376 943535463 /nfs/dbraw/zinc/53/54/63/943535463.db2.gz CSORMHJYAWEUES-CCKFTAQKSA-N 0 0 368.437 3.821 20 5 FHBDRN COc1ccccc1[C@@H]1C[C@H]1C(=O)N1c2ccc([N+](=O)[O-])cc2C[C@H]1C ZINC000414872276 943540374 /nfs/dbraw/zinc/54/03/74/943540374.db2.gz PHKJATSYKWPBFP-OAUYIBNBSA-N 0 0 352.390 3.685 20 5 FHBDRN CC(C)c1cccc(CNC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)c1 ZINC001269532956 943570561 /nfs/dbraw/zinc/57/05/61/943570561.db2.gz LUGSRXCOWWOTQT-UHFFFAOYSA-N 0 0 364.405 3.834 20 5 FHBDRN Nc1c(C(=O)Nc2ccc3ccc(Cl)cc3n2)cc(F)cc1[N+](=O)[O-] ZINC000504283680 943581682 /nfs/dbraw/zinc/58/16/82/943581682.db2.gz HHDGNJFGJIETEN-UHFFFAOYSA-N 0 0 360.732 3.770 20 5 FHBDRN Cc1ccc(OCCC(=O)N2c3ccc([N+](=O)[O-])cc3C[C@@H]2C)cc1C ZINC000504286468 943582810 /nfs/dbraw/zinc/58/28/10/943582810.db2.gz OULKHVQBSAZWSM-HNNXBMFYSA-N 0 0 354.406 3.958 20 5 FHBDRN Cc1cn(C2CCCCC2)nc1NC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000434221892 943583310 /nfs/dbraw/zinc/58/33/10/943583310.db2.gz ZLVXOKKZPJEZEH-UHFFFAOYSA-N 0 0 357.414 3.979 20 5 FHBDRN O=C(N[C@H]1C[C@H](c2cccc(C(F)(F)F)c2)C1)c1cc([N+](=O)[O-])c[nH]1 ZINC000435734037 943586581 /nfs/dbraw/zinc/58/65/81/943586581.db2.gz XPMLPFZUQBGMKB-UMSPYCQHSA-N 0 0 353.300 3.618 20 5 FHBDRN Cc1ccc(S(=O)(=O)N(C)c2cccc([N+](=O)[O-])c2)cc1C(F)(F)F ZINC000513813272 943589207 /nfs/dbraw/zinc/58/92/07/943589207.db2.gz AMIBTVAWWJPPKG-UHFFFAOYSA-N 0 0 374.340 3.747 20 5 FHBDRN Cc1cc(N[C@@H]2CCCN(c3ccccc3Cl)C2=O)ncc1[N+](=O)[O-] ZINC000074766131 943595031 /nfs/dbraw/zinc/59/50/31/943595031.db2.gz JPSAHZLHLSAPCU-CYBMUJFWSA-N 0 0 360.801 3.559 20 5 FHBDRN Nc1cccc(C2CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4o3)CC2)c1 ZINC000584776050 943595612 /nfs/dbraw/zinc/59/56/12/943595612.db2.gz DUNSDFLPVTZLCR-UHFFFAOYSA-N 0 0 365.389 3.943 20 5 FHBDRN CSc1ccccc1[C@@H](C)NC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000504332302 943597373 /nfs/dbraw/zinc/59/73/73/943597373.db2.gz QCPLTWXIQOVHGF-SNVBAGLBSA-N 0 0 356.407 3.684 20 5 FHBDRN Cc1cc(OCC(=O)N2c3ccc([N+](=O)[O-])cc3C[C@H]2C)ccc1Cl ZINC000504334148 943597802 /nfs/dbraw/zinc/59/78/02/943597802.db2.gz IPRBACIVRMCUDR-GFCCVEGCSA-N 0 0 360.797 3.913 20 5 FHBDRN Cc1ccc(C)n1C1CCN(C(=O)COc2ccc([N+](=O)[O-])c(C)c2)CC1 ZINC000431947540 943609739 /nfs/dbraw/zinc/60/97/39/943609739.db2.gz AFQQOZJFAJQKQY-UHFFFAOYSA-N 0 0 371.437 3.564 20 5 FHBDRN Cc1cccc([C@@H]2NC(=O)N([C@H](C)c3ccc(C)c([N+](=O)[O-])c3)C2=O)c1C ZINC000431948114 943626001 /nfs/dbraw/zinc/62/60/01/943626001.db2.gz CYQVXARNJRFIJI-KDOFPFPSSA-N 0 0 367.405 3.874 20 5 FHBDRN COc1cc([C@@H](C)NC(=O)c2cc([N+](=O)[O-])cnc2C)ccc1OC(C)C ZINC000048192249 943664017 /nfs/dbraw/zinc/66/40/17/943664017.db2.gz GJGQXWKMOYDHCB-GFCCVEGCSA-N 0 0 373.409 3.585 20 5 FHBDRN CCN(C)C(=O)c1cccc(C(=O)Nc2ccc([N+](=O)[O-])c(Cl)c2)c1 ZINC000103790060 943682882 /nfs/dbraw/zinc/68/28/82/943682882.db2.gz RXLVYVAUQXUZMK-UHFFFAOYSA-N 0 0 361.785 3.592 20 5 FHBDRN CN(CC(=O)Nc1ncccc1-c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000504591152 943701931 /nfs/dbraw/zinc/70/19/31/943701931.db2.gz HFYRZMXNVFAXMM-UHFFFAOYSA-N 0 0 362.389 3.732 20 5 FHBDRN CC(C)(C)Oc1ccncc1NC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000504618532 943708340 /nfs/dbraw/zinc/70/83/40/943708340.db2.gz ANKJWHQZIRKNBL-UHFFFAOYSA-N 0 0 368.393 3.761 20 5 FHBDRN COc1cc(OCC(=O)NC(CC(C)C)CC(C)C)ccc1[N+](=O)[O-] ZINC000504627280 943713690 /nfs/dbraw/zinc/71/36/90/943713690.db2.gz OTIZTERDVKMKKH-UHFFFAOYSA-N 0 0 352.431 3.559 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])Nc1ccccc1OCC1CC1 ZINC000133749125 943717255 /nfs/dbraw/zinc/71/72/55/943717255.db2.gz VBGVTSKNHXVSEV-UHFFFAOYSA-N 0 0 356.378 3.791 20 5 FHBDRN CC(C)CC(CC(C)C)NC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000504638101 943725488 /nfs/dbraw/zinc/72/54/88/943725488.db2.gz ZLUPRWVDZITMOH-UHFFFAOYSA-N 0 0 358.442 3.971 20 5 FHBDRN Cc1cc(OC[C@H](O)COCc2ccccc2)c(Cl)cc1[N+](=O)[O-] ZINC000504672771 943738927 /nfs/dbraw/zinc/73/89/27/943738927.db2.gz DSYGWOJRINEYLI-CQSZACIVSA-N 0 0 351.786 3.513 20 5 FHBDRN CC(C)Sc1ccc([C@H](C)NC(=O)CCn2cc([N+](=O)[O-])cn2)cc1 ZINC000504701683 943748887 /nfs/dbraw/zinc/74/88/87/943748887.db2.gz BBMRGDPZLAHAME-ZDUSSCGKSA-N 0 0 362.455 3.559 20 5 FHBDRN CCOc1cccc(N[C@H]2CC[C@@H](C(=O)N3CCCCC3)C2)c1[N+](=O)[O-] ZINC000516842234 943763230 /nfs/dbraw/zinc/76/32/30/943763230.db2.gz OZYNRMFTTYWFCR-CABCVRRESA-N 0 0 361.442 3.587 20 5 FHBDRN C[C@@H](Nc1ccc2ncc([N+](=O)[O-])n2n1)c1ccc(Br)cc1 ZINC000302007778 943766463 /nfs/dbraw/zinc/76/64/63/943766463.db2.gz UXKWFGQPDSPZLX-SECBINFHSA-N 0 0 362.187 3.573 20 5 FHBDRN Cc1ccc(-n2cnnc2SCC(=O)c2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000515306452 943773599 /nfs/dbraw/zinc/77/35/99/943773599.db2.gz JXNONJKTPAXCQC-UHFFFAOYSA-N 0 0 368.418 3.767 20 5 FHBDRN CC(C)(C)CC[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1OC(F)F)C(=O)[O-] ZINC000417635952 943773774 /nfs/dbraw/zinc/77/37/74/943773774.db2.gz KOUVRZXCYDEPGI-GFCCVEGCSA-N 0 0 360.357 3.565 20 5 FHBDRN COc1cccc(C(=O)NC[C@H]2CCC[C@@H](C(F)(F)F)C2)c1[N+](=O)[O-] ZINC000435818629 943774350 /nfs/dbraw/zinc/77/43/50/943774350.db2.gz SVFMLGOQOOQYCU-WDEREUQCSA-N 0 0 360.332 3.702 20 5 FHBDRN COc1cccc(C(=O)N2CC[C@@H](Cc3ccccc3)[C@H]2C)c1[N+](=O)[O-] ZINC000435818463 943775017 /nfs/dbraw/zinc/77/50/17/943775017.db2.gz MPBGCNWPQLZAJZ-ZBFHGGJFSA-N 0 0 354.406 3.697 20 5 FHBDRN O=C(CO[C@H]1CCCc2ccccc21)Nc1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000435799625 943776826 /nfs/dbraw/zinc/77/68/26/943776826.db2.gz MJIPTIOVYARKDP-KRWDZBQOSA-N 0 0 366.377 3.504 20 5 FHBDRN CC[C@@H](CSc1ccccc1)NC(=O)Cc1ccc([N+](=O)[O-])cc1F ZINC000504745990 943779187 /nfs/dbraw/zinc/77/91/87/943779187.db2.gz RRHSZVHBLSLSGI-AWEZNQCLSA-N 0 0 362.426 3.964 20 5 FHBDRN CC(C)(C)C1CC(NC(=O)Cc2ccc([N+](=O)[O-])cc2Br)C1 ZINC000504755384 943783590 /nfs/dbraw/zinc/78/35/90/943783590.db2.gz IIGKJGQYWPWQAG-UHFFFAOYSA-N 0 0 369.259 3.841 20 5 FHBDRN Cn1cc(CN[C@@H]2C[C@]2(F)c2ccccc2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000424203738 943787153 /nfs/dbraw/zinc/78/71/53/943787153.db2.gz UTJNCOJBPHFRBU-QUCCMNQESA-N 0 0 366.396 3.722 20 5 FHBDRN C[C@@H](NC(=O)c1cccc2c(=O)c3cccc(F)c3[nH]c12)c1ccccn1 ZINC000435837450 943791373 /nfs/dbraw/zinc/79/13/73/943791373.db2.gz SYSMYZPZOAWKEK-GFCCVEGCSA-N 0 0 361.376 3.706 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(-c2nc(Cc3ccccc3OC)no2)c1 ZINC000515329393 943792540 /nfs/dbraw/zinc/79/25/40/943792540.db2.gz MIRUMWOMLZKWRI-UHFFFAOYSA-N 0 0 355.350 3.643 20 5 FHBDRN O=C(Nc1ccc2c(c1)OCO2)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000435820438 943794330 /nfs/dbraw/zinc/79/43/30/943794330.db2.gz XBNXTLBHYUPBGA-UHFFFAOYSA-N 0 0 358.353 3.662 20 5 FHBDRN CCCN(C(=O)c1cccc(OC)c1[N+](=O)[O-])[C@@H]1C[C@@H](OCC)C1(C)C ZINC000435862212 943801411 /nfs/dbraw/zinc/80/14/11/943801411.db2.gz MRMVTDLSOXIEEP-HZPDHXFCSA-N 0 0 364.442 3.659 20 5 FHBDRN CC(C)c1ccc(C[NH2+]CC[C@H](CC(=O)[O-])C(F)(F)F)cc1[N+](=O)[O-] ZINC000417655830 943803646 /nfs/dbraw/zinc/80/36/46/943803646.db2.gz KELARVDMMMGQFO-GFCCVEGCSA-N 0 0 362.348 3.851 20 5 FHBDRN CN(CC(=O)N[C@H]1C[C@H](c2cccc(Cl)c2)C1)c1ccccc1[N+](=O)[O-] ZINC000437444603 943803928 /nfs/dbraw/zinc/80/39/28/943803928.db2.gz YWFAEOIPZGKIKL-KOMQPUFPSA-N 0 0 373.840 3.747 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)N[C@H]1C[C@H](c2cccc(F)c2)C1 ZINC000437446156 943806374 /nfs/dbraw/zinc/80/63/74/943806374.db2.gz LEMNQCVBXIHONN-JCNLHEQBSA-N 0 0 367.380 3.751 20 5 FHBDRN COc1cccc(C(=O)N2CC[C@@H](c3ccc(Cl)cc3)C2)c1[N+](=O)[O-] ZINC000435857895 943812158 /nfs/dbraw/zinc/81/21/58/943812158.db2.gz YXXCZVHNNCMSJZ-CYBMUJFWSA-N 0 0 360.797 3.887 20 5 FHBDRN COCCN(C(=O)CSc1ccc([N+](=O)[O-])cc1)[C@H](C)c1ccccc1 ZINC000515370567 943816537 /nfs/dbraw/zinc/81/65/37/943816537.db2.gz USWXLVIDXXLRHV-OAHLLOKOSA-N 0 0 374.462 3.923 20 5 FHBDRN CC[N@H+](Cc1cc([N+](=O)[O-])ccc1OC(C)C)C1CCC(C(=O)[O-])CC1 ZINC000515356717 943822861 /nfs/dbraw/zinc/82/28/61/943822861.db2.gz FOMCJQWZBRZFHQ-UHFFFAOYSA-N 0 0 364.442 3.847 20 5 FHBDRN COc1cccc(C(=O)N(CCc2ccc(F)cc2)C2CC2)c1[N+](=O)[O-] ZINC000435871762 943825785 /nfs/dbraw/zinc/82/57/85/943825785.db2.gz UVRALYPWALZQON-UHFFFAOYSA-N 0 0 358.369 3.590 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCc1cccc2c1CCCN2 ZINC000516921951 943830694 /nfs/dbraw/zinc/83/06/94/943830694.db2.gz ZAYGISMQAMGYLG-CYBMUJFWSA-N 0 0 371.462 3.750 20 5 FHBDRN NC(=O)c1cccc(NCCCCc2ccc(Cl)s2)c1[N+](=O)[O-] ZINC000515392264 943836759 /nfs/dbraw/zinc/83/67/59/943836759.db2.gz OJMMPWLGTIQOII-UHFFFAOYSA-N 0 0 353.831 3.843 20 5 FHBDRN Cn1ccnc1[C@H](N[C@@H]1C[C@@]1(F)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000424317740 943840072 /nfs/dbraw/zinc/84/00/72/943840072.db2.gz GVNAWPDNVDIKGJ-QWFCFKBJSA-N 0 0 366.396 3.645 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)[C@@H]1CCCOC1 ZINC000504853397 943845133 /nfs/dbraw/zinc/84/51/33/943845133.db2.gz PYOXJBUFMFTDAG-QWHCGFSZSA-N 0 0 352.456 3.640 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@@H](Nc2ccccc2)C1 ZINC000516940041 943848925 /nfs/dbraw/zinc/84/89/25/943848925.db2.gz NJORPOULNFQHHP-MRXNPFEDSA-N 0 0 354.410 3.876 20 5 FHBDRN COc1cc(Cc2noc([C@H]3CCC[C@H](F)C3)n2)c([N+](=O)[O-])c(OC)c1 ZINC000424355005 943861629 /nfs/dbraw/zinc/86/16/29/943861629.db2.gz IOURPLOOSZZYHL-JQWIXIFHSA-N 0 0 365.361 3.582 20 5 FHBDRN C[C@H]1CN(C(=O)c2ccc(N3C[C@H](C)C[C@H](C)C3)c([N+](=O)[O-])c2)C[C@H]1C ZINC000435932255 943866889 /nfs/dbraw/zinc/86/68/89/943866889.db2.gz ASOUQHLVQLVZOX-GEEKYZPCSA-N 0 0 359.470 3.805 20 5 FHBDRN Cn1cccc1[C@@H]1CCCN1C(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000435936283 943868985 /nfs/dbraw/zinc/86/89/85/943868985.db2.gz OKPFURRNBHPEQH-NRFANRHFSA-N 0 0 371.440 3.997 20 5 FHBDRN O=[N+]([O-])c1ccccc1NCCc1noc(/C=C/c2cccc(O)c2)n1 ZINC000435950072 943888199 /nfs/dbraw/zinc/88/81/99/943888199.db2.gz UXHWERWJNDCJMS-CMDGGOBGSA-N 0 0 352.350 3.508 20 5 FHBDRN O=C(COc1cc(F)ccc1[N+](=O)[O-])N1CCC[C@@H]1c1ccsc1 ZINC000053367298 943895260 /nfs/dbraw/zinc/89/52/60/943895260.db2.gz CRKCWMRRHKNFJY-CYBMUJFWSA-N 0 0 350.371 3.538 20 5 FHBDRN CCc1ccc(CC)c(NS(=O)(=O)c2ccc(OC)c([N+](=O)[O-])c2)c1 ZINC000435972507 943896788 /nfs/dbraw/zinc/89/67/88/943896788.db2.gz LSJLZBZNRHYEFG-UHFFFAOYSA-N 0 0 364.423 3.529 20 5 FHBDRN CC(=O)CC(C)(C)CC(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000435980235 943903488 /nfs/dbraw/zinc/90/34/88/943903488.db2.gz GGOOHZDTEOFFKB-UHFFFAOYSA-N 0 0 371.231 4.000 20 5 FHBDRN CC(C)NC(=O)c1ccc(NCC2(c3ccccc3)CC2)c([N+](=O)[O-])c1 ZINC000105425442 943910957 /nfs/dbraw/zinc/91/09/57/943910957.db2.gz PWMQUAATFMNLBI-UHFFFAOYSA-N 0 0 353.422 3.877 20 5 FHBDRN COc1ccc(-c2ccc(C[N@@H+]3CCC[C@H](C)[C@@H]3C(=O)[O-])o2)c([N+](=O)[O-])c1 ZINC000424414093 943911111 /nfs/dbraw/zinc/91/11/11/943911111.db2.gz GXPZNNWWPMFHHY-KPZWWZAWSA-N 0 0 374.393 3.549 20 5 FHBDRN O=C(NC1(c2ccccc2)CCOCC1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000517017008 943913876 /nfs/dbraw/zinc/91/38/76/943913876.db2.gz VFVOUFFQDQOWKV-RBUKOAKNSA-N 0 0 366.417 3.520 20 5 FHBDRN C[C@H](C(=O)NCC1(c2ccc(F)cc2F)CC1)c1cccc([N+](=O)[O-])c1 ZINC000517004478 943919534 /nfs/dbraw/zinc/91/95/34/943919534.db2.gz VTXZVQUTNKYYNK-LBPRGKRZSA-N 0 0 360.360 3.825 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])N1CCC(Cc2ccc(F)cc2)CC1 ZINC000504930248 943927252 /nfs/dbraw/zinc/92/72/52/943927252.db2.gz NRKKGYDNUJRUKJ-UHFFFAOYSA-N 0 0 371.412 3.627 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1COc1ccc(Br)cc1OC ZINC000517036036 943933036 /nfs/dbraw/zinc/93/30/36/943933036.db2.gz XZECRLAYRBMRNV-UHFFFAOYSA-N 0 0 368.183 3.954 20 5 FHBDRN Cc1csc(Nc2ccc(NC(=O)c3c(N)cccc3[N+](=O)[O-])cc2)n1 ZINC000500006016 943934766 /nfs/dbraw/zinc/93/47/66/943934766.db2.gz LBXBKRFJKGLQNU-UHFFFAOYSA-N 0 0 369.406 3.938 20 5 FHBDRN Cc1ccc(OCCCNC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)cc1 ZINC000504959106 943936891 /nfs/dbraw/zinc/93/68/91/943936891.db2.gz HETMEEKCZFAMTI-HNNXBMFYSA-N 0 0 374.462 3.969 20 5 FHBDRN Cc1ccccc1[C@@H]1CCN(C(=O)CCNc2ccccc2[N+](=O)[O-])C1 ZINC000504960505 943937117 /nfs/dbraw/zinc/93/71/17/943937117.db2.gz YUDPBLLKOZBPMW-MRXNPFEDSA-N 0 0 353.422 3.721 20 5 FHBDRN Cc1c(NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)cnn1CC(C)C ZINC000500007048 943942308 /nfs/dbraw/zinc/94/23/08/943942308.db2.gz UOZSYLPSCJWGMH-UHFFFAOYSA-N 0 0 371.441 3.952 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N(C)CCCCc1ccccc1 ZINC000515514489 943946227 /nfs/dbraw/zinc/94/62/27/943946227.db2.gz XGMPEEPRSMYEFO-UHFFFAOYSA-N 0 0 362.451 3.547 20 5 FHBDRN COC[C@@H](C)Nc1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000437585434 943946655 /nfs/dbraw/zinc/94/66/55/943946655.db2.gz AHKIKWMHWXINPT-LLVKDONJSA-N 0 0 363.801 3.947 20 5 FHBDRN COc1ccc(OC)c(/C=C\c2nc(-c3cccc([N+](=O)[O-])c3)no2)c1 ZINC000504975763 943947002 /nfs/dbraw/zinc/94/70/02/943947002.db2.gz WPMNQIJUKAKCLU-TWGQIWQCSA-N 0 0 353.334 3.832 20 5 FHBDRN COC(=O)c1ccc(/C=C/c2nc(-c3cccc([N+](=O)[O-])c3)no2)cc1 ZINC000504975395 943947192 /nfs/dbraw/zinc/94/71/92/943947192.db2.gz RKVJEHICYRTIEM-JXMROGBWSA-N 0 0 351.318 3.602 20 5 FHBDRN CCc1ccc(C(=O)Nc2ccccc2N[C@@H](C)COC)cc1[N+](=O)[O-] ZINC000437588597 943950710 /nfs/dbraw/zinc/95/07/10/943950710.db2.gz JNOFNKDRDBEQPZ-ZDUSSCGKSA-N 0 0 357.410 3.856 20 5 FHBDRN COC(=O)c1cc(NC(=O)C(C)(C)c2ccccc2[N+](=O)[O-])c(C)cc1C ZINC000505746395 943951373 /nfs/dbraw/zinc/95/13/73/943951373.db2.gz VUGIYDPCGXIVLI-UHFFFAOYSA-N 0 0 370.405 3.915 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1CN1CCC[C@H]1[C@H]1CCCO1 ZINC000425444416 943952990 /nfs/dbraw/zinc/95/29/90/943952990.db2.gz NOUKWSQAGZTQKY-DZGCQCFKSA-N 0 0 355.232 3.501 20 5 FHBDRN C[C@H]1Sc2ccc(-c3nc(-c4cccc([N+](=O)[O-])c4)no3)cc2NC1=O ZINC000505002483 943955155 /nfs/dbraw/zinc/95/51/55/943955155.db2.gz HZOFXIWAMDKXRQ-SECBINFHSA-N 0 0 368.374 3.745 20 5 FHBDRN CC1(C)C[C@H](c2ccccc2)N(C(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)C1 ZINC000425832799 943957856 /nfs/dbraw/zinc/95/78/56/943957856.db2.gz MILUWYCAMLYNOE-QGZVFWFLSA-N 0 0 367.405 3.533 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2noc(Cc3csc(-c4cccnc4)n3)n2)c1 ZINC000505008002 943964966 /nfs/dbraw/zinc/96/49/66/943964966.db2.gz FFIBAMKKISAKLA-UHFFFAOYSA-N 0 0 365.374 3.754 20 5 FHBDRN CC[C@@H]1CCCC[C@@H]1NC(=O)CSCc1ccc(OC)c([N+](=O)[O-])c1 ZINC000027705651 943967557 /nfs/dbraw/zinc/96/75/57/943967557.db2.gz BQMGSNLBYLXHOW-CABCVRRESA-N 0 0 366.483 3.922 20 5 FHBDRN C[C@@H]1C[C@H]1C(=O)Nc1cccc(-c2nc(-c3cccc([N+](=O)[O-])c3)no2)c1 ZINC000505012789 943968193 /nfs/dbraw/zinc/96/81/93/943968193.db2.gz GTPABHOQWATRSX-BDJLRTHQSA-N 0 0 364.361 3.906 20 5 FHBDRN CC(C)CCO[C@@H]1CCCC[C@H]1NC(=O)NCc1ccccc1[N+](=O)[O-] ZINC000437628335 943975586 /nfs/dbraw/zinc/97/55/86/943975586.db2.gz ISVOZIUHEOVQNV-SJLPKXTDSA-N 0 0 363.458 3.768 20 5 FHBDRN Cc1cc(NC(=O)c2ccc([N+](=O)[O-])cn2)cc(C)c1Br ZINC000515545595 943979445 /nfs/dbraw/zinc/97/94/45/943979445.db2.gz AGEWCKZYFKNXMG-UHFFFAOYSA-N 0 0 350.172 3.621 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC=C(c2c(F)cccc2F)CC1 ZINC000364178909 943988908 /nfs/dbraw/zinc/98/89/08/943988908.db2.gz GTBPRXJLGZXFKM-UHFFFAOYSA-N 0 0 359.332 3.506 20 5 FHBDRN Cc1cc(CN(C)C(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)ccc1F ZINC000436071070 943991570 /nfs/dbraw/zinc/99/15/70/943991570.db2.gz BWXVDGFJJRVAFL-UHFFFAOYSA-N 0 0 368.311 3.916 20 5 FHBDRN Cc1cccc(NC(=O)c2cc(F)cc3c(=O)c4cccc(F)c4[nH]c23)n1 ZINC000436070346 943991821 /nfs/dbraw/zinc/99/18/21/943991821.db2.gz AKZCGIXEFRTHSF-UHFFFAOYSA-N 0 0 365.339 3.915 20 5 FHBDRN COc1ccccc1C1CC(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000364180307 943992583 /nfs/dbraw/zinc/99/25/83/943992583.db2.gz MXVGLBUFOBVOBV-UHFFFAOYSA-N 0 0 360.797 3.933 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F ZINC000424600637 944000006 /nfs/dbraw/zinc/00/00/06/944000006.db2.gz KJOKYZODWMCOFW-HBGGEXNNSA-N 0 0 356.344 3.826 20 5 FHBDRN O=C(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)Nc1cccc2ccccc21 ZINC000436091576 944007584 /nfs/dbraw/zinc/00/75/84/944007584.db2.gz JPRXZJBXKLARGJ-UHFFFAOYSA-N 0 0 361.361 3.946 20 5 FHBDRN O=C(Nc1ccc(Nc2ncccn2)cc1)Nc1cccc([N+](=O)[O-])c1 ZINC000436107737 944021876 /nfs/dbraw/zinc/02/18/76/944021876.db2.gz YYIOHACOQMCRBZ-UHFFFAOYSA-N 0 0 350.338 3.772 20 5 FHBDRN CC(C)[C@H]1CCC[C@@H](NC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000505080207 944023187 /nfs/dbraw/zinc/02/31/87/944023187.db2.gz CVONGARHHYPUQE-JKSUJKDBSA-N 0 0 370.453 3.940 20 5 FHBDRN C[C@H](C(=O)Oc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2)cc1)C1CC1 ZINC000178377452 944023760 /nfs/dbraw/zinc/02/37/60/944023760.db2.gz DOJFLQJODKKLDK-LBPRGKRZSA-N 0 0 354.362 3.799 20 5 FHBDRN C[C@@H]1CN(C(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC(C)(C)C1 ZINC000541511882 944024621 /nfs/dbraw/zinc/02/46/21/944024621.db2.gz UZYTYXDUSXTENQ-ZDUSSCGKSA-N 0 0 356.426 3.504 20 5 FHBDRN COc1cc(F)c([N+](=O)[O-])c(Sc2nnc(-c3ccccc3)n2C)c1 ZINC000092584132 944024802 /nfs/dbraw/zinc/02/48/02/944024802.db2.gz OWJYAPFIJNATQQ-UHFFFAOYSA-N 0 0 360.370 3.689 20 5 FHBDRN O=C(NCc1ccc(F)c(F)c1)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000436095195 944025963 /nfs/dbraw/zinc/02/59/63/944025963.db2.gz AEUNXOKGPAGIFI-UHFFFAOYSA-N 0 0 364.351 3.890 20 5 FHBDRN CC(C)[C@@H]1CCC[C@H](NC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)C1 ZINC000505067582 944026689 /nfs/dbraw/zinc/02/66/89/944026689.db2.gz DCOPNVDURFBKMP-ZBFHGGJFSA-N 0 0 356.426 3.725 20 5 FHBDRN CC(C)[C@@H]1CCC[C@H](NC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)C1 ZINC000505067446 944027095 /nfs/dbraw/zinc/02/70/95/944027095.db2.gz CBBLBNGMMDRQNM-ZBFHGGJFSA-N 0 0 356.426 3.725 20 5 FHBDRN COCC[C@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(OC)cc1 ZINC000505090485 944031335 /nfs/dbraw/zinc/03/13/35/944031335.db2.gz FMYRVGOARPIOJQ-ZDUSSCGKSA-N 0 0 374.393 3.551 20 5 FHBDRN CCN(CC)C(=O)c1ccc(Nc2cc(OC)cc(F)c2[N+](=O)[O-])cc1 ZINC000092582982 944032708 /nfs/dbraw/zinc/03/27/08/944032708.db2.gz RMLHNGZQKVCWKY-UHFFFAOYSA-N 0 0 361.373 3.968 20 5 FHBDRN Cc1sc(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)cc1[N+](=O)[O-] ZINC000566553350 944033776 /nfs/dbraw/zinc/03/37/76/944033776.db2.gz MWVVCCNGENWRFO-ZDUSSCGKSA-N 0 0 357.435 3.984 20 5 FHBDRN CN1CC(=O)N[C@H]1c1ccc(Oc2ccc(C(C)(C)C)cc2)c([N+](=O)[O-])c1 ZINC000515597324 944033978 /nfs/dbraw/zinc/03/39/78/944033978.db2.gz RMJQUMZHADNHTE-LJQANCHMSA-N 0 0 369.421 3.745 20 5 FHBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)N1CCC[C@@H]1Cc1ccccc1 ZINC000126552979 944038320 /nfs/dbraw/zinc/03/83/20/944038320.db2.gz FBLIWFSXFDKHRM-GOSISDBHSA-N 0 0 353.422 3.554 20 5 FHBDRN Cc1ccccc1OCCNc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1 ZINC000515607307 944042458 /nfs/dbraw/zinc/04/24/58/944042458.db2.gz HHGCOSDRGGUKIR-UHFFFAOYSA-N 0 0 369.421 3.630 20 5 FHBDRN O=C(CCc1cccc(OC(F)F)c1)N1CCc2c1cccc2[N+](=O)[O-] ZINC000424684986 944046075 /nfs/dbraw/zinc/04/60/75/944046075.db2.gz SIGNISWVYNDRHT-UHFFFAOYSA-N 0 0 362.332 3.718 20 5 FHBDRN Cc1c(CC(=O)N[C@@H](c2ccccc2)C(F)(F)F)cccc1[N+](=O)[O-] ZINC000162544102 944046005 /nfs/dbraw/zinc/04/60/05/944046005.db2.gz RLDZIWUPEHSZNY-INIZCTEOSA-N 0 0 352.312 3.866 20 5 FHBDRN Cc1cccc(C)c1NC(=O)CNc1ccc([N+](=O)[O-])c(OC(F)F)c1 ZINC000092585240 944046289 /nfs/dbraw/zinc/04/62/89/944046289.db2.gz DGJGZXLVEKAJEN-UHFFFAOYSA-N 0 0 365.336 3.864 20 5 FHBDRN O=[N+]([O-])c1cccnc1N[C@@H]1CCN(c2cccc(OC(F)(F)F)c2)C1 ZINC000511652477 944049917 /nfs/dbraw/zinc/04/99/17/944049917.db2.gz DIWOSCBNOKJNTO-LLVKDONJSA-N 0 0 368.315 3.579 20 5 FHBDRN CC[C@@H]1CCN(C(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)[C@H]1C ZINC001269694689 944056607 /nfs/dbraw/zinc/05/66/07/944056607.db2.gz KVCFHRUPTRUMRH-WDEREUQCSA-N 0 0 355.232 3.926 20 5 FHBDRN CC(C)N(Cc1ccccn1)C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000515626049 944058351 /nfs/dbraw/zinc/05/83/51/944058351.db2.gz NACMPSBOUWIOTJ-UHFFFAOYSA-N 0 0 354.410 3.615 20 5 FHBDRN C[C@]1(CCc2ccccc2)CCN(C(=O)c2c(N)cccc2[N+](=O)[O-])C1 ZINC000500080441 944061253 /nfs/dbraw/zinc/06/12/53/944061253.db2.gz DUEBVGIWWPGBTD-FQEVSTJZSA-N 0 0 353.422 3.662 20 5 FHBDRN Cn1c(NC(=O)c2cc3ccccc3c3cccnc23)nc2cccnc21 ZINC000505136076 944063943 /nfs/dbraw/zinc/06/39/43/944063943.db2.gz PVTQFORRXNUPDI-UHFFFAOYSA-N 0 0 353.385 3.922 20 5 FHBDRN COCCOc1ccc(Nc2cc(OC)cc(F)c2[N+](=O)[O-])cc1F ZINC000092622128 944066646 /nfs/dbraw/zinc/06/66/46/944066646.db2.gz OYFVLXBDQTYZRG-UHFFFAOYSA-N 0 0 354.309 3.650 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)cc1 ZINC000053455932 944069407 /nfs/dbraw/zinc/06/94/07/944069407.db2.gz HIHTYKOHSWRGFF-CQSZACIVSA-N 0 0 364.405 3.795 20 5 FHBDRN C[C@@H](Nc1cccc(C(N)=O)c1[N+](=O)[O-])c1ccc(Br)s1 ZINC000515625525 944075525 /nfs/dbraw/zinc/07/55/25/944075525.db2.gz VKFLMVYBSMFZIZ-SSDOTTSWSA-N 0 0 370.228 3.691 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])NC1(c2ccc(Cl)cc2)CCOCC1 ZINC000505128567 944078588 /nfs/dbraw/zinc/07/85/88/944078588.db2.gz HWENFBGSYYIXQN-UHFFFAOYSA-N 0 0 374.824 3.613 20 5 FHBDRN CC[C@@H](C)[C@@H](NC(=O)CSc1ccc([N+](=O)[O-])cc1)C(F)(F)F ZINC000436185141 944079636 /nfs/dbraw/zinc/07/96/36/944079636.db2.gz VYPULCZLBIYZED-NOZJJQNGSA-N 0 0 350.362 3.780 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NCc1ccsc1Br ZINC001270262483 944079675 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3.717 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)N1CC[C@H](c2ccccc2F)C1 ZINC000500093237 944085632 /nfs/dbraw/zinc/08/56/32/944085632.db2.gz YUOWCBNCPOIGMV-HNNXBMFYSA-N 0 0 371.412 3.942 20 5 FHBDRN Cc1cc(O[C@@H](C)C(=O)N(C)Cc2ccccc2[N+](=O)[O-])ccc1Cl ZINC000515644008 944087323 /nfs/dbraw/zinc/08/73/23/944087323.db2.gz RZRPUPRVDNLDGO-ZDUSSCGKSA-N 0 0 362.813 3.983 20 5 FHBDRN COc1ccc(OC)c(-c2noc(/C=C\c3ccc(F)cc3[N+](=O)[O-])n2)c1 ZINC000545523365 944088162 /nfs/dbraw/zinc/08/81/62/944088162.db2.gz IWDZDEDMCLLLQR-YWEYNIOJSA-N 0 0 371.324 3.972 20 5 FHBDRN COC(=O)c1cc(NCCCn2cnc3ccccc32)cc(C)c1[N+](=O)[O-] ZINC000436194107 944105881 /nfs/dbraw/zinc/10/58/81/944105881.db2.gz MYQVCNGNIVLQGV-UHFFFAOYSA-N 0 0 368.393 3.542 20 5 FHBDRN COCC[C@@H](C)CNC(=O)c1cc([N+](=O)[O-])ccc1SCC(C)C ZINC000412493793 944110501 /nfs/dbraw/zinc/11/05/01/944110501.db2.gz ZLXJYPAKRORCKB-CYBMUJFWSA-N 0 0 354.472 3.745 20 5 FHBDRN CCSc1ccc(CC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)cc1 ZINC000505179566 944111567 /nfs/dbraw/zinc/11/15/67/944111567.db2.gz OQGAEGHFYUSUSH-UHFFFAOYSA-N 0 0 356.447 3.834 20 5 FHBDRN COc1cccc(C)c1NC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000436213847 944122541 /nfs/dbraw/zinc/12/25/41/944122541.db2.gz BPTOBNRQWDAXGD-LLVKDONJSA-N 0 0 364.785 3.971 20 5 FHBDRN COC(=O)NCc1ccc(Nc2ccc([N+](=O)[O-])c3cccnc23)cc1 ZINC000092655436 944123304 /nfs/dbraw/zinc/12/33/04/944123304.db2.gz OTVKQRBBDQTZMW-UHFFFAOYSA-N 0 0 352.350 3.743 20 5 FHBDRN CN(C(=O)CCc1ccc(Cl)c(Cl)c1)c1ccc([N+](=O)[O-])nc1 ZINC000515703893 944129645 /nfs/dbraw/zinc/12/96/45/944129645.db2.gz DITITJPDVRGCIG-UHFFFAOYSA-N 0 0 354.193 3.892 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N(C)Cc2cc(C)c(OC)c(C)c2)c1 ZINC000506138452 944130614 /nfs/dbraw/zinc/13/06/14/944130614.db2.gz JLISNLIQQHQEND-UHFFFAOYSA-N 0 0 358.394 3.501 20 5 FHBDRN CCCN(Cc1c(F)cccc1[N+](=O)[O-])C[C@@H]1COc2ccccc2O1 ZINC000505777580 944139788 /nfs/dbraw/zinc/13/97/88/944139788.db2.gz PVYRFWJYLWNACL-CQSZACIVSA-N 0 0 360.385 3.786 20 5 FHBDRN Cc1sc(C(=O)N[C@@H](COCC(C)C)c2ccco2)cc1[N+](=O)[O-] ZINC000505211647 944139925 /nfs/dbraw/zinc/13/99/25/944139925.db2.gz UBICOAFUQHRICW-LBPRGKRZSA-N 0 0 352.412 3.701 20 5 FHBDRN COc1cc(CN(C)C[C@@H](C)OC)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000517263108 944142336 /nfs/dbraw/zinc/14/23/36/944142336.db2.gz VINSKJOFYOEGSZ-OAHLLOKOSA-N 0 0 374.437 3.649 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N[C@@H]1CCCC[C@H]1n1cccn1 ZINC000072734857 944144380 /nfs/dbraw/zinc/14/43/80/944144380.db2.gz WXVDCEWQQZAOSL-HUUCEWRRSA-N 0 0 363.805 3.750 20 5 FHBDRN CC(C)(C)CCCCNC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000105540753 944147317 /nfs/dbraw/zinc/14/73/17/944147317.db2.gz NHNCUYGFKCHXOV-UHFFFAOYSA-N 0 0 355.822 3.519 20 5 FHBDRN CCn1c2ccccc2nc1[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])cc1 ZINC000506141869 944150247 /nfs/dbraw/zinc/15/02/47/944150247.db2.gz CDMOXFHSGVVNLR-SFHVURJKSA-N 0 0 364.405 3.942 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC[C@@](C)(c2ccccc2)C1 ZINC000500142835 944156218 /nfs/dbraw/zinc/15/62/18/944156218.db2.gz JUOAWPKRGOUDJR-LJQANCHMSA-N 0 0 374.462 3.646 20 5 FHBDRN CCOc1cc(N[C@@H](CN2CCCC2=O)c2ccccc2)ccc1[N+](=O)[O-] ZINC000092657020 944170976 /nfs/dbraw/zinc/17/09/76/944170976.db2.gz GLCAJRFLGITWHP-KRWDZBQOSA-N 0 0 369.421 3.769 20 5 FHBDRN COc1ccc(CN(C)c2cc(C(F)(F)F)ncc2[N+](=O)[O-])c(OC)c1 ZINC000436275419 944172564 /nfs/dbraw/zinc/17/25/64/944172564.db2.gz OULAVABXHCHSNR-UHFFFAOYSA-N 0 0 371.315 3.662 20 5 FHBDRN C[C@H](Nc1cc(C(F)(F)F)ncc1[N+](=O)[O-])c1ccc2c(c1)OCO2 ZINC000436276589 944173097 /nfs/dbraw/zinc/17/30/97/944173097.db2.gz UCIJIGGGWWNHOS-QMMMGPOBSA-N 0 0 355.272 3.910 20 5 FHBDRN Cc1cc(C)nc(Sc2ccc(NC(=O)c3ccc([N+](=O)[O-])[nH]3)cc2)n1 ZINC000515763548 944175020 /nfs/dbraw/zinc/17/50/20/944175020.db2.gz ANKBCZKMHQEQIT-UHFFFAOYSA-N 0 0 369.406 3.733 20 5 FHBDRN CCCOCc1ccccc1CNC(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000123132541 944176704 /nfs/dbraw/zinc/17/67/04/944176704.db2.gz OXXSEWGDNKEANB-UHFFFAOYSA-N 0 0 373.409 3.852 20 5 FHBDRN CN(C)C(=O)c1ccc(Oc2cc(C(F)(F)F)ncc2[N+](=O)[O-])cc1 ZINC000436313003 944192212 /nfs/dbraw/zinc/19/22/12/944192212.db2.gz BEJRIPHUYLTJBX-UHFFFAOYSA-N 0 0 355.272 3.503 20 5 FHBDRN CCOc1c(OC)cc(CNc2c3c(ccc2[N+](=O)[O-])NCC3)cc1OC ZINC000436314833 944194500 /nfs/dbraw/zinc/19/45/00/944194500.db2.gz ZPNMBVDNVUAQJZ-UHFFFAOYSA-N 0 0 373.409 3.591 20 5 FHBDRN CC(C)c1[nH]nc(C(=O)Nc2cccc(NCC(F)(F)F)c2)c1[N+](=O)[O-] ZINC000505791917 944195754 /nfs/dbraw/zinc/19/57/54/944195754.db2.gz ZLUYMWOXFPDVDC-UHFFFAOYSA-N 0 0 371.319 3.668 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)F)cc1N1CCO[C@H](C2CCCCC2)C1 ZINC000436322308 944200504 /nfs/dbraw/zinc/20/05/04/944200504.db2.gz BVURQNGAZKVYKS-AWEZNQCLSA-N 0 0 359.348 3.794 20 5 FHBDRN CO[C@]1(C)C[C@H](N(C)C(=O)c2ccc(SC)c([N+](=O)[O-])c2)C1(C)C ZINC000436331815 944210754 /nfs/dbraw/zinc/21/07/54/944210754.db2.gz GESVNWYUDYJEQN-WMLDXEAASA-N 0 0 352.456 3.592 20 5 FHBDRN COc1ccc2c(c1)CCN(c1cc(C(F)(F)F)ncc1[N+](=O)[O-])CC2 ZINC000436338421 944214891 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3.858 20 5 FHBDRN COc1ccc(OCCOc2ccc(Br)cc2[N+](=O)[O-])cc1 ZINC000303934434 944341988 /nfs/dbraw/zinc/34/19/88/944341988.db2.gz RHJYQDKUEZYJIT-UHFFFAOYSA-N 0 0 368.183 3.824 20 5 FHBDRN CCN(CCC1CC1)C(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000426279432 944342746 /nfs/dbraw/zinc/34/27/46/944342746.db2.gz VFSTZZKUZNSABW-UHFFFAOYSA-N 0 0 359.348 3.945 20 5 FHBDRN C[C@H]1CCc2[nH]c3ccc(C(=O)N(C)c4ccc([N+](=O)[O-])nc4)cc3c2C1 ZINC001270303849 944343879 /nfs/dbraw/zinc/34/38/79/944343879.db2.gz SFQFROVHAMZAPS-LBPRGKRZSA-N 0 0 364.405 3.873 20 5 FHBDRN O=C(N[C@H]1CCCOc2ccccc21)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000123344297 944346872 /nfs/dbraw/zinc/34/68/72/944346872.db2.gz UPNPVHIDGIPSTG-KRWDZBQOSA-N 0 0 367.405 3.576 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1OCc1nc(-c2ccc(F)c(F)c2)no1 ZINC000133880011 944348472 /nfs/dbraw/zinc/34/84/72/944348472.db2.gz IIMFZVPCTXMWPX-UHFFFAOYSA-N 0 0 363.276 3.511 20 5 FHBDRN COC(=O)c1c(C)cccc1NC(=O)c1c(C)cc(Cl)cc1[N+](=O)[O-] ZINC000439130706 944351250 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Cc1cc(Cc2noc(-c3cccnc3OC(C)C)n2)ccc1[N+](=O)[O-] ZINC000518437995 944366223 /nfs/dbraw/zinc/36/62/23/944366223.db2.gz MHZMKBWWWOQRPN-UHFFFAOYSA-N 0 0 354.366 3.726 20 5 FHBDRN CCOC(=O)c1ccccc1NC(=O)c1c(C)cc(Cl)cc1[N+](=O)[O-] ZINC000439132657 944367886 /nfs/dbraw/zinc/36/78/86/944367886.db2.gz HRHGTNWUHRLZDW-UHFFFAOYSA-N 0 0 362.769 3.986 20 5 FHBDRN C[C@]1(CNC(=O)c2cccc(Cl)c2[N+](=O)[O-])CCOC2(CCC2)C1 ZINC000894664511 944369985 /nfs/dbraw/zinc/36/99/85/944369985.db2.gz WUMNVELEHOVQFU-INIZCTEOSA-N 0 0 352.818 3.717 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC(COc2ccccc2)C1 ZINC000518425681 944371378 /nfs/dbraw/zinc/37/13/78/944371378.db2.gz NNSZUWWMACIWTQ-UHFFFAOYSA-N 0 0 372.446 3.858 20 5 FHBDRN Cc1ccnc(OC2CCN(C(=O)Nc3ccc([N+](=O)[O-])c(C)c3)CC2)c1 ZINC000473763008 944374883 /nfs/dbraw/zinc/37/48/83/944374883.db2.gz IWLQNVAFMJLNOK-UHFFFAOYSA-N 0 0 370.409 3.682 20 5 FHBDRN COC[C@@H](NCc1cc([N+](=O)[O-])ccc1OC)c1cccc(Cl)c1 ZINC000566624516 944374835 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WNXONLJGCVGJIA-QWRGUYRKSA-N 0 0 356.372 3.830 20 5 FHBDRN CC[C@H](NC(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1)c1c(C)nn(C)c1C ZINC000473887742 945894214 /nfs/dbraw/zinc/89/42/14/945894214.db2.gz QIPRDEIQFBFBSL-INIZCTEOSA-N 0 0 358.442 3.950 20 5 FHBDRN COc1ccc(C)nc1NC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000444110424 945895527 /nfs/dbraw/zinc/89/55/27/945895527.db2.gz JZAHYGYLGMNHRE-UHFFFAOYSA-N 0 0 359.385 3.646 20 5 FHBDRN Cc1ccc(Cc2nnc(NC(=O)c3ccc([N+](=O)[O-])cc3F)s2)cc1 ZINC000108248636 945897190 /nfs/dbraw/zinc/89/71/90/945897190.db2.gz CFRQSIGHSVPFPL-UHFFFAOYSA-N 0 0 372.381 3.737 20 5 FHBDRN CCNc1ccc(C(=O)N(C)CC2(c3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000444367361 945922447 /nfs/dbraw/zinc/92/24/47/945922447.db2.gz UFNRWAMFILKDMG-UHFFFAOYSA-N 0 0 353.422 3.830 20 5 FHBDRN O=C(c1ccnc(Oc2ccccc2)c1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000522832758 945952678 /nfs/dbraw/zinc/95/26/78/945952678.db2.gz HWYIBNLDFZXCQN-UHFFFAOYSA-N 0 0 361.357 3.985 20 5 FHBDRN C[C@@H]1CC[C@H](O)[C@@H]([C@@H]2CCCN2C(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000281938641 945955074 /nfs/dbraw/zinc/95/50/74/945955074.db2.gz HRMQASUOUKRUKE-LCSDZXHASA-N 0 0 366.845 3.650 20 5 FHBDRN CN(Cc1cccs1)C(=O)COc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000133978535 945971929 /nfs/dbraw/zinc/97/19/29/945971929.db2.gz BDVGQKYAUMFTNY-UHFFFAOYSA-N 0 0 374.340 3.713 20 5 FHBDRN C[C@H](NC(=O)COc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1cccs1 ZINC000133978976 945972979 /nfs/dbraw/zinc/97/29/79/945972979.db2.gz FULKRDXURVPDEQ-VIFPVBQESA-N 0 0 374.340 3.931 20 5 FHBDRN C[C@@H](NC(=O)NCc1ccc(OC(F)F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000108446490 945974144 /nfs/dbraw/zinc/97/41/44/945974144.db2.gz QETYTHYCDGHTLC-LLVKDONJSA-N 0 0 365.336 3.757 20 5 FHBDRN CCCN(C(=O)c1cc(OC)c(OC)c(OC)c1)c1cccc([N+](=O)[O-])c1 ZINC000281949241 945977215 /nfs/dbraw/zinc/97/72/15/945977215.db2.gz UYQUFAYZCXXDIQ-UHFFFAOYSA-N 0 0 374.393 3.677 20 5 FHBDRN O=C(c1csc(Br)c1)N1CCc2c1cccc2[N+](=O)[O-] ZINC000078149636 946001109 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O=C(OCc1noc(-c2ccc(Cl)cc2)n1)c1ccccc1[N+](=O)[O-] ZINC000029295944 946021652 /nfs/dbraw/zinc/02/16/52/946021652.db2.gz NEFHIAOXIHCHNY-UHFFFAOYSA-N 0 0 359.725 3.655 20 5 FHBDRN COC(=O)c1cc(NC(=O)CSCc2cccc(C)c2)cc([N+](=O)[O-])c1 ZINC000522869981 946026287 /nfs/dbraw/zinc/02/62/87/946026287.db2.gz RNUWYHCOZFVAHS-UHFFFAOYSA-N 0 0 374.418 3.562 20 5 FHBDRN COC(=O)c1cc(NC(=O)c2cc3c(s2)CC[C@H](C)C3)cc([N+](=O)[O-])c1 ZINC000522867169 946031643 /nfs/dbraw/zinc/03/16/43/946031643.db2.gz OICZVYBDHJGDOT-JTQLQIEISA-N 0 0 374.418 3.820 20 5 FHBDRN COC(=O)c1cc(NC(=O)C23CC4CC(CC(C4)C2)C3)cc([N+](=O)[O-])c1 ZINC000522867868 946031891 /nfs/dbraw/zinc/03/18/91/946031891.db2.gz WGJZWCFSNGHPBV-UHFFFAOYSA-N 0 0 358.394 3.536 20 5 FHBDRN Cn1cc(C(=O)Nc2ccc([N+](=O)[O-])cc2)c(-c2ccccc2Cl)n1 ZINC000108678885 946033523 /nfs/dbraw/zinc/03/35/23/946033523.db2.gz WUOOFHJZSRXICB-UHFFFAOYSA-N 0 0 356.769 3.901 20 5 FHBDRN Cc1ncsc1CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCC(C)CC1 ZINC000104466858 946034926 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FHBDRN COc1ccc(Cl)cc1CN(C)c1nc2sccn2c1[N+](=O)[O-] ZINC000008376195 946130247 /nfs/dbraw/zinc/13/02/47/946130247.db2.gz PCOHZJZYVMFOAG-UHFFFAOYSA-N 0 0 352.803 3.602 20 5 FHBDRN O=C(NCCCc1ccc(O)cc1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000487385706 946137348 /nfs/dbraw/zinc/13/73/48/946137348.db2.gz LVMBBJTUEIWESA-UHFFFAOYSA-N 0 0 369.421 3.607 20 5 FHBDRN COc1ccc(O)c(NC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)c1 ZINC000444262999 946138647 /nfs/dbraw/zinc/13/86/47/946138647.db2.gz WSQVYSXRKMWRMU-UHFFFAOYSA-N 0 0 360.369 3.648 20 5 FHBDRN CCc1[nH]nc(C(=O)N(Cc2ccco2)c2cccc(Cl)c2)c1[N+](=O)[O-] ZINC000444261395 946144227 /nfs/dbraw/zinc/14/42/27/946144227.db2.gz FWKQGWYMGLXOOL-UHFFFAOYSA-N 0 0 374.784 3.974 20 5 FHBDRN CC(C)OCc1cccc(N[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)c1 ZINC000109108845 946146850 /nfs/dbraw/zinc/14/68/50/946146850.db2.gz UNMGGAVJDUMZOX-AWEZNQCLSA-N 0 0 357.410 3.959 20 5 FHBDRN C[C@@H](OC(=O)/C=C/Sc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000018804140 946155239 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CO[C@H](c1noc(Cc2cccc([N+](=O)[O-])c2)n1)c1ccccc1Cl ZINC000546522218 946301989 /nfs/dbraw/zinc/30/19/89/946301989.db2.gz DMGIFQLZUPQTDU-INIZCTEOSA-N 0 0 359.769 3.958 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1-c1nc(-c2cccc(Br)c2)no1 ZINC000109474547 946306499 /nfs/dbraw/zinc/30/64/99/946306499.db2.gz PPRZAKQVEVWKHG-UHFFFAOYSA-N 0 0 361.155 3.778 20 5 FHBDRN CC[C@@H]1CN(C(=O)[C@H]2C[C@H]2c2cccc([N+](=O)[O-])c2)c2ccccc2O1 ZINC001126595917 946311639 /nfs/dbraw/zinc/31/16/39/946311639.db2.gz XZUXXRQQZSHKNT-IKGGRYGDSA-N 0 0 352.390 3.903 20 5 FHBDRN O=C(CCCOCCc1ccccc1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088231102 946314062 /nfs/dbraw/zinc/31/40/62/946314062.db2.gz RPYLYCCDSKLISF-UHFFFAOYSA-N 0 0 368.433 3.519 20 5 FHBDRN C[C@H](C1CC1)N(C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)C1CC1 ZINC000046057736 946317443 /nfs/dbraw/zinc/31/74/43/946317443.db2.gz XFUMLJFZYIMXGV-CQSZACIVSA-N 0 0 357.454 3.601 20 5 FHBDRN COc1cc(C(=O)N[C@H](C)c2cc3cccc(F)c3o2)ccc1[N+](=O)[O-] ZINC000475077695 946324925 /nfs/dbraw/zinc/32/49/25/946324925.db2.gz UAMFMRUCDZAFNV-SNVBAGLBSA-N 0 0 358.325 3.980 20 5 FHBDRN COc1cc(OCc2nc(-c3ccc(F)c(F)c3)no2)ccc1[N+](=O)[O-] ZINC000109535474 946324823 /nfs/dbraw/zinc/32/48/23/946324823.db2.gz JFXMYYAOROOUMF-UHFFFAOYSA-N 0 0 363.276 3.511 20 5 FHBDRN COc1cc(OCc2nc(CCCc3ccccc3)no2)ccc1[N+](=O)[O-] ZINC000109573389 946338667 /nfs/dbraw/zinc/33/86/67/946338667.db2.gz VTPWIEAOPOJDBP-UHFFFAOYSA-N 0 0 369.377 3.741 20 5 FHBDRN CC(C)(NCc1ccc(Br)cc1[N+](=O)[O-])c1nccs1 ZINC000232577206 946345338 /nfs/dbraw/zinc/34/53/38/946345338.db2.gz ZHRWYYCVGNWJGK-UHFFFAOYSA-N 0 0 356.245 3.839 20 5 FHBDRN CC(C)c1csc(NC(=O)c2ccc([N+](=O)[O-])c(-n3ccnc3)c2)n1 ZINC001126115760 946345544 /nfs/dbraw/zinc/34/55/44/946345544.db2.gz XLQTZRITSCGRFR-UHFFFAOYSA-N 0 0 357.395 3.613 20 5 FHBDRN CC(C)c1ccc(C(=O)N2CCOC[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000473896886 946357484 /nfs/dbraw/zinc/35/74/84/946357484.db2.gz UCCOUMWUNUMDQX-IBGZPJMESA-N 0 0 354.406 3.932 20 5 FHBDRN O=C(NCC1(c2ccc(F)cc2)CC1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000087049535 946359305 /nfs/dbraw/zinc/35/93/05/946359305.db2.gz PQWWRKNNRRMSQW-UHFFFAOYSA-N 0 0 369.396 3.533 20 5 FHBDRN O=C(CCc1ncc(-c2ccc(F)cc2)o1)NCc1ccccc1[N+](=O)[O-] ZINC000046149751 946374488 /nfs/dbraw/zinc/37/44/88/946374488.db2.gz NOWXNUFEIHJGDP-UHFFFAOYSA-N 0 0 369.352 3.638 20 5 FHBDRN CCN(Cc1ccc(Cl)cc1)S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000519891237 946376791 /nfs/dbraw/zinc/37/67/91/946376791.db2.gz NYTBUMTWNFEBBF-UHFFFAOYSA-N 0 0 368.842 3.600 20 5 FHBDRN CCN(CC)c1ccc(-c2noc(-c3ccc(OC)c([N+](=O)[O-])c3)n2)cn1 ZINC000545675323 946377628 /nfs/dbraw/zinc/37/76/28/946377628.db2.gz YEXKGHPNSGNXIY-UHFFFAOYSA-N 0 0 369.381 3.562 20 5 FHBDRN COCc1ccsc1-c1nc(CCNc2ccccc2[N+](=O)[O-])no1 ZINC000545668578 946379836 /nfs/dbraw/zinc/37/98/36/946379836.db2.gz CAIYBJNHFOMQAY-UHFFFAOYSA-N 0 0 360.395 3.507 20 5 FHBDRN O=C(NCc1cccc([N+](=O)[O-])c1)Nc1cc(F)ccc1OC(F)F ZINC000121353147 946380058 /nfs/dbraw/zinc/38/00/58/946380058.db2.gz WELPQJDVIYLMIP-UHFFFAOYSA-N 0 0 355.272 3.657 20 5 FHBDRN CSc1cccc(C(=O)NC[C@H]2CCOc3ccccc32)c1[N+](=O)[O-] ZINC000186475351 946391328 /nfs/dbraw/zinc/39/13/28/946391328.db2.gz UJGCKUOCSLYMFE-GFCCVEGCSA-N 0 0 358.419 3.613 20 5 FHBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1OC(=O)[C@H](C(=O)OC(C)(C)C)C1CC1 ZINC001126121051 946398216 /nfs/dbraw/zinc/39/82/16/946398216.db2.gz PFJFUXQFAHAZLK-CQSZACIVSA-N 0 0 369.801 3.830 20 5 FHBDRN Cc1cc(C(=O)Oc2cc([N+](=O)[O-])c(Cl)cc2C)cc([N+](=O)[O-])c1 ZINC001126120970 946398339 /nfs/dbraw/zinc/39/83/39/946398339.db2.gz NLYGVFDNJZKWRY-UHFFFAOYSA-N 0 0 350.714 3.992 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)NCc1c(C)oc2ccccc21 ZINC000184428619 946401357 /nfs/dbraw/zinc/40/13/57/946401357.db2.gz QXUFFKYLZAJYAO-UHFFFAOYSA-N 0 0 369.377 3.657 20 5 FHBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1OC(=O)c1ccc(N(C)C)c(F)c1 ZINC001126120643 946405540 /nfs/dbraw/zinc/40/55/40/946405540.db2.gz HSZHJVCFLWCTJP-UHFFFAOYSA-N 0 0 352.749 3.981 20 5 FHBDRN CCO[C@H](CCNC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1)C1CCCC1 ZINC000475105591 946406500 /nfs/dbraw/zinc/40/65/00/946406500.db2.gz CKEMCACNLXOOKZ-KBXCAEBGSA-N 0 0 363.458 3.940 20 5 FHBDRN CCO[C@@H](CCNC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1)C1CCCC1 ZINC000475105593 946406598 /nfs/dbraw/zinc/40/65/98/946406598.db2.gz CKEMCACNLXOOKZ-KSSFIOAISA-N 0 0 363.458 3.940 20 5 FHBDRN CSc1cccc(C(=O)N2C[C@@H](c3ccccc3)OC[C@@H]2C)c1[N+](=O)[O-] ZINC000186483095 946408138 /nfs/dbraw/zinc/40/81/38/946408138.db2.gz AOHDQMWVXNSCTL-BBRMVZONSA-N 0 0 372.446 3.919 20 5 FHBDRN CSc1cccc(C(=O)N2C[C@@H](c3ccccc3)OC[C@H]2C)c1[N+](=O)[O-] ZINC000186483076 946408147 /nfs/dbraw/zinc/40/81/47/946408147.db2.gz AOHDQMWVXNSCTL-CJNGLKHVSA-N 0 0 372.446 3.919 20 5 FHBDRN O=[N+]([O-])c1cccc(F)c1CN1CCC(c2nc3ccccc3[nH]2)CC1 ZINC000111234031 946410683 /nfs/dbraw/zinc/41/06/83/946410683.db2.gz UFGHIJNDBZGEQF-UHFFFAOYSA-N 0 0 354.385 3.990 20 5 FHBDRN Cc1sc(C(=O)NCCc2cn(C)c3cc(C)ccc23)cc1[N+](=O)[O-] ZINC000444378467 946415376 /nfs/dbraw/zinc/41/53/76/946415376.db2.gz IJWHQRTXSKLNCP-UHFFFAOYSA-N 0 0 357.435 3.737 20 5 FHBDRN CCCN([C@@H]1CCc2ccccc21)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000519891777 946420843 /nfs/dbraw/zinc/42/08/43/946420843.db2.gz RZLBAXLXAJRVNK-GOSISDBHSA-N 0 0 360.435 3.683 20 5 FHBDRN CCc1[nH]nc(C(=O)Nc2cc(Cl)cc(C(F)(F)F)c2)c1[N+](=O)[O-] ZINC000186056536 946420774 /nfs/dbraw/zinc/42/07/74/946420774.db2.gz UHNLWJZSADAPIY-UHFFFAOYSA-N 0 0 362.695 3.805 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)Nc1cc(F)ccc1OC(F)F ZINC000121371234 946424710 /nfs/dbraw/zinc/42/47/10/946424710.db2.gz FYZMYNFKZBAABZ-UHFFFAOYSA-N 0 0 369.299 3.700 20 5 FHBDRN Cc1cc(C(=O)N(Cc2ccccc2)CC2(O)CCCC2)ccc1[N+](=O)[O-] ZINC000475491456 946427631 /nfs/dbraw/zinc/42/76/31/946427631.db2.gz HQZBQEMTLNIRFW-UHFFFAOYSA-N 0 0 368.433 3.851 20 5 FHBDRN COc1c(C(=O)NCc2ccccc2OCC(C)C)cccc1[N+](=O)[O-] ZINC000475116491 946430532 /nfs/dbraw/zinc/43/05/32/946430532.db2.gz XLCLQPBMZIFTSX-UHFFFAOYSA-N 0 0 358.394 3.568 20 5 FHBDRN CCc1n[nH]c(C(=O)N2CCC[C@@H]2c2ccc(C(C)C)cc2)c1[N+](=O)[O-] ZINC000444322841 946437547 /nfs/dbraw/zinc/43/75/47/946437547.db2.gz VUIJBPNCNDDTSF-MRXNPFEDSA-N 0 0 356.426 3.981 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])Nc1ccccc1OC(F)(F)F ZINC000047823150 946439013 /nfs/dbraw/zinc/43/90/13/946439013.db2.gz WUARCMDDDIEKGM-UHFFFAOYSA-N 0 0 355.272 3.815 20 5 FHBDRN CN(Cc1ccccc1F)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000047864523 946445479 /nfs/dbraw/zinc/44/54/79/946445479.db2.gz HIDNOZSPBHIXDD-UHFFFAOYSA-N 0 0 369.299 3.999 20 5 FHBDRN CSc1cccc(C(=O)Nc2cccc(-c3nnco3)c2)c1[N+](=O)[O-] ZINC000186078108 946446783 /nfs/dbraw/zinc/44/67/83/946446783.db2.gz HXNHHWCYVGJOOS-UHFFFAOYSA-N 0 0 356.363 3.619 20 5 FHBDRN Cc1ccc(C[C@@H](C)N(C)C(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)cc1 ZINC000523089262 946462905 /nfs/dbraw/zinc/46/29/05/946462905.db2.gz QBNSXVSCYQELOF-MRXNPFEDSA-N 0 0 365.433 3.948 20 5 FHBDRN O=C(NCc1cccc2ccccc21)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000111560442 946483788 /nfs/dbraw/zinc/48/37/88/946483788.db2.gz LRJKCMPBGSBCRU-UHFFFAOYSA-N 0 0 373.368 3.520 20 5 FHBDRN CCCc1ccccc1NC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000111563278 946485171 /nfs/dbraw/zinc/48/51/71/946485171.db2.gz JARKMLAJBNNZKX-UHFFFAOYSA-N 0 0 351.362 3.641 20 5 FHBDRN CSc1cccc(C(=O)NC(C)(C)c2nc(C)cs2)c1[N+](=O)[O-] ZINC000186516879 946490000 /nfs/dbraw/zinc/49/00/00/946490000.db2.gz DVWYBNBRPFDTHW-UHFFFAOYSA-N 0 0 351.453 3.747 20 5 FHBDRN CSc1cccc(C(=O)N(C)CCCOc2ccccc2)c1[N+](=O)[O-] ZINC000186134315 946523447 /nfs/dbraw/zinc/52/34/47/946523447.db2.gz YEWBPISHHRMDHL-UHFFFAOYSA-N 0 0 360.435 3.858 20 5 FHBDRN CC[C@H](C)[C@@H]1CCCCN1C(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000523097307 946543750 /nfs/dbraw/zinc/54/37/50/946543750.db2.gz WLUWCNQLDBXRAG-KSSFIOAISA-N 0 0 356.426 3.821 20 5 FHBDRN C[C@@H](CNC(=O)N1CCC=C(c2ccncc2)C1)c1ccccc1[N+](=O)[O-] ZINC000897057562 946544702 /nfs/dbraw/zinc/54/47/02/946544702.db2.gz GFPJFGFXKXLFEP-HNNXBMFYSA-N 0 0 366.421 3.592 20 5 FHBDRN O=[N+]([O-])c1ccc(Cl)cc1NNC(=S)NCCCCC(F)(F)F ZINC000840789961 946545896 /nfs/dbraw/zinc/54/58/96/946545896.db2.gz RGMWWHHOOXLZSL-UHFFFAOYSA-N 0 0 370.784 3.772 20 5 FHBDRN CCN(C(=O)NC[C@H](C)c1ccccc1[N+](=O)[O-])[C@@H]1CCOC(C)(C)C1 ZINC000897058769 946546192 /nfs/dbraw/zinc/54/61/92/946546192.db2.gz RZZGDZUARGUPJP-LSDHHAIUSA-N 0 0 363.458 3.687 20 5 FHBDRN C[C@H](CNC(=O)N1CCC[C@@H](C(F)(F)F)C1)c1ccccc1[N+](=O)[O-] ZINC000897049732 946549888 /nfs/dbraw/zinc/54/98/88/946549888.db2.gz IXUZMMUEESGETC-VXGBXAGGSA-N 0 0 359.348 3.682 20 5 FHBDRN COc1ccc(-c2ccc(CNCc3ccnc(OC)c3)o2)c([N+](=O)[O-])c1 ZINC000237436143 946551777 /nfs/dbraw/zinc/55/17/77/946551777.db2.gz NWPDSTYCODFGOC-UHFFFAOYSA-N 0 0 369.377 3.557 20 5 FHBDRN C[C@@H](CNC(=O)N1CCC(c2ccccn2)CC1)c1ccccc1[N+](=O)[O-] ZINC000897062385 946555606 /nfs/dbraw/zinc/55/56/06/946555606.db2.gz UJHHJVNICUOFDX-HNNXBMFYSA-N 0 0 368.437 3.683 20 5 FHBDRN CC(C)COC1CCN(C(=O)NC[C@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000897070112 946565142 /nfs/dbraw/zinc/56/51/42/946565142.db2.gz CCEJRJUQJJAVGD-HNNXBMFYSA-N 0 0 363.458 3.545 20 5 FHBDRN O=[N+]([O-])c1sc(CN[C@@H]2CCCc3cccnc32)cc1Br ZINC000897070890 946566283 /nfs/dbraw/zinc/56/62/83/946566283.db2.gz QPZOGVKXDRWGIM-GFCCVEGCSA-N 0 0 368.256 3.981 20 5 FHBDRN O=C(NCc1ccc(Br)cc1)Nc1ccc([N+](=O)[O-])cc1 ZINC000048334094 946578470 /nfs/dbraw/zinc/57/84/70/946578470.db2.gz DVWYOJGZYUWTPC-UHFFFAOYSA-N 0 0 350.172 3.679 20 5 FHBDRN CCOc1ccccc1N(C)C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000121256691 946585622 /nfs/dbraw/zinc/58/56/22/946585622.db2.gz ICBVZWNCIWOCAL-UHFFFAOYSA-N 0 0 369.421 3.870 20 5 FHBDRN Cc1cc(-c2noc(/C=C/c3cccc([N+](=O)[O-])c3)n2)ccc1-n1cncn1 ZINC000545765198 946587684 /nfs/dbraw/zinc/58/76/84/946587684.db2.gz WMIXLAIFEBUTJC-VMPITWQZSA-N 0 0 374.360 3.704 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2nc(Cc3c[nH]c4ncccc34)no2)c(Cl)c1 ZINC000545773555 946587673 /nfs/dbraw/zinc/58/76/73/946587673.db2.gz KQYKEPSMQQCTBF-UHFFFAOYSA-N 0 0 355.741 3.765 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])s1)N1CCCCC[C@@H]1[C@@H]1CCCCC1=O ZINC000164514238 946601753 /nfs/dbraw/zinc/60/17/53/946601753.db2.gz XNCZAIMQOWWWLA-QWHCGFSZSA-N 0 0 350.440 3.800 20 5 FHBDRN C[C@@H](Cc1ccccc1)C(=O)Nc1ccnn1-c1ccc([N+](=O)[O-])cc1 ZINC000112013380 946603527 /nfs/dbraw/zinc/60/35/27/946603527.db2.gz ZZDJMIADFUWZFP-AWEZNQCLSA-N 0 0 350.378 3.598 20 5 FHBDRN C[C@@H]1CCN2[C@@H](C1)C(=O)N[C@@H]2c1ccc(-c2cccc([N+](=O)[O-])c2)s1 ZINC000186590983 946608082 /nfs/dbraw/zinc/60/80/82/946608082.db2.gz DCSGIOPTCGLMGT-WHCBVINPSA-N 0 0 357.435 3.552 20 5 FHBDRN COc1ccc(/C=C\C(=O)N2c3ccc([N+](=O)[O-])cc3C[C@@H]2C)cc1OC ZINC000728811221 946612616 /nfs/dbraw/zinc/61/26/16/946612616.db2.gz JJDCLFDJRGZSRS-QGOGUYACSA-N 0 0 368.389 3.603 20 5 FHBDRN COc1cccc(O[C@H](C)CNC(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)c1 ZINC000475548529 946618281 /nfs/dbraw/zinc/61/82/81/946618281.db2.gz BQYGRABKXIAFHB-CQSZACIVSA-N 0 0 373.409 3.809 20 5 FHBDRN COCCOc1cccc(-c2nc(Cc3cccc([N+](=O)[O-])c3C)no2)c1 ZINC000545781512 946621802 /nfs/dbraw/zinc/62/18/02/946621802.db2.gz JOCZJSQHDJXNBE-UHFFFAOYSA-N 0 0 369.377 3.569 20 5 FHBDRN COc1cc(Cc2noc([C@@H](C)Oc3ccccc3)n2)ccc1[N+](=O)[O-] ZINC000545779155 946622438 /nfs/dbraw/zinc/62/24/38/946622438.db2.gz GPPWVWNZGDECIF-GFCCVEGCSA-N 0 0 355.350 3.717 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)N[C@@H]1CCOc2ccccc21 ZINC000184434253 946624094 /nfs/dbraw/zinc/62/40/94/946624094.db2.gz ICVKFFJXVLXCCV-OAHLLOKOSA-N 0 0 361.785 3.571 20 5 FHBDRN Cc1ccc(C)c(SCc2nc(Cc3ccc([N+](=O)[O-])cn3)no2)c1 ZINC000545779557 946629605 /nfs/dbraw/zinc/62/96/05/946629605.db2.gz VCQVARLVBBIKEP-UHFFFAOYSA-N 0 0 356.407 3.873 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2noc(CN3Cc4ccccc4C4(CC4)C3)n2)cc1 ZINC000186220950 946631570 /nfs/dbraw/zinc/63/15/70/946631570.db2.gz OLIMJDHPOSWPQU-UHFFFAOYSA-N 0 0 362.389 3.692 20 5 FHBDRN CSc1cccc(C(=O)N2CCN(C)c3ccc(F)cc32)c1[N+](=O)[O-] ZINC000186596068 946636850 /nfs/dbraw/zinc/63/68/50/946636850.db2.gz YOCUMBGQRUJWDT-UHFFFAOYSA-N 0 0 361.398 3.552 20 5 FHBDRN CSc1cccc(C(=O)N[C@@H](C)COc2cccc(C)c2)c1[N+](=O)[O-] ZINC000186242649 946648784 /nfs/dbraw/zinc/64/87/84/946648784.db2.gz YLZPJOKLBQKZAW-ZDUSSCGKSA-N 0 0 360.435 3.822 20 5 FHBDRN C[C@@H]1Oc2ccc(Nc3ccc4ncccc4c3[N+](=O)[O-])cc2NC1=O ZINC000112073144 946655983 /nfs/dbraw/zinc/65/59/83/946655983.db2.gz OLAKTVCLOMAICO-JTQLQIEISA-N 0 0 350.334 3.606 20 5 FHBDRN Cc1occc1-c1nnc(Sc2ccc3ncccc3c2[N+](=O)[O-])n1C ZINC000112073314 946656116 /nfs/dbraw/zinc/65/61/16/946656116.db2.gz PGIOJYLJWUVCSG-UHFFFAOYSA-N 0 0 367.390 3.991 20 5 FHBDRN COc1cc(N2CC(C)(C)O[C@](C)(C(F)(F)F)C2)c(F)cc1[N+](=O)[O-] ZINC000549571170 946664063 /nfs/dbraw/zinc/66/40/63/946664063.db2.gz BITDKRPHORIBCJ-AWEZNQCLSA-N 0 0 366.311 3.679 20 5 FHBDRN CC(=O)c1cc(N(C)Cc2cnn(-c3ccccc3)c2)ccc1[N+](=O)[O-] ZINC000550341108 946670605 /nfs/dbraw/zinc/67/06/05/946670605.db2.gz OKWDWXCWMXEXLD-UHFFFAOYSA-N 0 0 350.378 3.620 20 5 FHBDRN Cc1c(NC(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)cnn1C1CCCC1 ZINC000487497404 946690858 /nfs/dbraw/zinc/69/08/58/946690858.db2.gz JCIDJLQGGQAOSP-UHFFFAOYSA-N 0 0 364.352 3.674 20 5 FHBDRN CCOC1(CNc2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)CCCC1 ZINC000549571589 946695493 /nfs/dbraw/zinc/69/54/93/946695493.db2.gz IFEFXOLIXPLRSQ-UHFFFAOYSA-N 0 0 361.442 3.592 20 5 FHBDRN COc1cc(NC(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)ccc1NC(C)=O ZINC000475571518 946711411 /nfs/dbraw/zinc/71/14/11/946711411.db2.gz VOTRSTBTWJIKNS-UHFFFAOYSA-N 0 0 372.381 3.823 20 5 FHBDRN COc1cc(CN2CCCC3(CC3)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000186622739 946725171 /nfs/dbraw/zinc/72/51/71/946725171.db2.gz GMLNCVNEFDAQAY-UHFFFAOYSA-N 0 0 356.369 3.623 20 5 FHBDRN Cc1c(C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)cnn1C(C)(C)C ZINC000129728476 946725807 /nfs/dbraw/zinc/72/58/07/946725807.db2.gz DACRFZCGYBRMCL-UHFFFAOYSA-N 0 0 356.426 3.660 20 5 FHBDRN CS[C@H]1CC[C@H](NC(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)C1 ZINC000125573649 946725993 /nfs/dbraw/zinc/72/59/93/946725993.db2.gz ZTWVSICKBYGIIG-QWRGUYRKSA-N 0 0 373.272 3.680 20 5 FHBDRN CO[C@@H](CNC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)C(C)(C)C ZINC000475213379 946729227 /nfs/dbraw/zinc/72/92/27/946729227.db2.gz NEBYOJVGWQTHGA-LBPRGKRZSA-N 0 0 363.336 3.796 20 5 FHBDRN C[C@H](c1ccccc1Cl)N(C)S(=O)(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000151972723 946731933 /nfs/dbraw/zinc/73/19/33/946731933.db2.gz IEODISIUGBLFBO-GFCCVEGCSA-N 0 0 368.842 3.771 20 5 FHBDRN C[C@H](C[C@H]1CCCO1)NC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000475217520 946732715 /nfs/dbraw/zinc/73/27/15/946732715.db2.gz WYISLUXBJPEVME-MWLCHTKSSA-N 0 0 361.320 3.693 20 5 FHBDRN COc1cccc(C[C@@H](C)NC(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)c1 ZINC000475578982 946736145 /nfs/dbraw/zinc/73/61/45/946736145.db2.gz FJTMZUFLESOGHR-CQSZACIVSA-N 0 0 357.410 3.973 20 5 FHBDRN C[C@H]1CCN(C(=O)CCNc2ccccc2[N+](=O)[O-])c2c(O)cccc21 ZINC000186278707 946749010 /nfs/dbraw/zinc/74/90/10/946749010.db2.gz UWJSYCODIIVLBY-ZDUSSCGKSA-N 0 0 355.394 3.643 20 5 FHBDRN CC(C)(C)OCc1cc(C(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)no1 ZINC000186278696 946749197 /nfs/dbraw/zinc/74/91/97/946749197.db2.gz NVFUXJHAKIUZRY-UHFFFAOYSA-N 0 0 361.398 3.563 20 5 FHBDRN O=[N+]([O-])c1ccccc1NCc1nc(-c2cc(OC3CCC3)ccn2)no1 ZINC000546508448 946753160 /nfs/dbraw/zinc/75/31/60/946753160.db2.gz YWTQRDWTRPZECU-UHFFFAOYSA-N 0 0 367.365 3.583 20 5 FHBDRN Cc1cn(-c2ccccc2)nc1C(=O)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000186636052 946766706 /nfs/dbraw/zinc/76/67/06/946766706.db2.gz BLWLAKLSLGWEOS-UHFFFAOYSA-N 0 0 362.389 3.682 20 5 FHBDRN COc1ccc(NC(=O)[C@H](C)c2cn(C)c3ccccc23)c([N+](=O)[O-])c1 ZINC000186642045 946769766 /nfs/dbraw/zinc/76/97/66/946769766.db2.gz XDZISQCFNUHVIG-GFCCVEGCSA-N 0 0 353.378 3.837 20 5 FHBDRN O=C(CCc1cc(F)ccc1[N+](=O)[O-])N1CCSC[C@H]1c1ccccc1 ZINC001126152681 946773871 /nfs/dbraw/zinc/77/38/71/946773871.db2.gz HQYYWBMFBBDXRA-SFHVURJKSA-N 0 0 374.437 3.983 20 5 FHBDRN CCOC(=O)c1ccnc(N2CCC[C@@H]2CCc2ccccc2)c1[N+](=O)[O-] ZINC000523113088 946774658 /nfs/dbraw/zinc/77/46/58/946774658.db2.gz YKGGXYQUHUBOFI-MRXNPFEDSA-N 0 0 369.421 3.768 20 5 FHBDRN CCOC(=O)c1ccnc(N[C@H](Cc2ccccc2)C2CC2)c1[N+](=O)[O-] ZINC000523111217 946775171 /nfs/dbraw/zinc/77/51/71/946775171.db2.gz FVADHIBCOCAPHN-MRXNPFEDSA-N 0 0 355.394 3.600 20 5 FHBDRN CCOC(=O)c1ccnc(NCc2csc3ccccc23)c1[N+](=O)[O-] ZINC000523110925 946778512 /nfs/dbraw/zinc/77/85/12/946778512.db2.gz NNNLUDMBWRVPLC-UHFFFAOYSA-N 0 0 357.391 3.993 20 5 FHBDRN C[C@H](N[C@@H](c1cnn(C)c1)c1ccc(F)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000186647534 946780835 /nfs/dbraw/zinc/78/08/35/946780835.db2.gz GZWUPFUERLATHP-ORAYPTAESA-N 0 0 354.385 3.908 20 5 FHBDRN CCOc1ccc(CCNC(=O)c2cc(C)ccc2[N+](=O)[O-])cc1OCC ZINC000151998765 946781022 /nfs/dbraw/zinc/78/10/22/946781022.db2.gz NOQHPCNNQGPOBN-UHFFFAOYSA-N 0 0 372.421 3.673 20 5 FHBDRN C[C@@H]1CN(Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C[C@@H](C2CC2)O1 ZINC000475276689 946793422 /nfs/dbraw/zinc/79/34/22/946793422.db2.gz BLWWOKZEPNDUMW-PXAZEXFGSA-N 0 0 359.451 3.718 20 5 FHBDRN C[C@H]1CN(Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C[C@H](C2CC2)O1 ZINC000475276706 946795923 /nfs/dbraw/zinc/79/59/23/946795923.db2.gz BLWWOKZEPNDUMW-YVEFUNNKSA-N 0 0 359.451 3.718 20 5 FHBDRN C[C@@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000475278422 946796956 /nfs/dbraw/zinc/79/69/56/946796956.db2.gz WARHBNODKHYXQT-IAQYHMDHSA-N 0 0 368.359 3.768 20 5 FHBDRN COc1cc(CN(C)Cc2ccccc2SC)c([N+](=O)[O-])cc1OC ZINC000475278239 946798164 /nfs/dbraw/zinc/79/81/64/946798164.db2.gz KGZBFMGCOUMEJJ-UHFFFAOYSA-N 0 0 362.451 3.966 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1COC(=O)[C@@H](C)Oc1cccc(Cl)c1 ZINC000026100974 946823506 /nfs/dbraw/zinc/82/35/06/946823506.db2.gz UNEUNGYBHXIDRP-LLVKDONJSA-N 0 0 365.769 3.768 20 5 FHBDRN Cc1nc(NC(=O)COc2c(Cl)cccc2Cl)ccc1[N+](=O)[O-] ZINC000475294917 946833209 /nfs/dbraw/zinc/83/32/09/946833209.db2.gz CGYYFCHUHLLYBI-UHFFFAOYSA-N 0 0 356.165 3.623 20 5 FHBDRN Cc1nc(NC(=O)CCc2ccccc2OC(F)(F)F)ccc1[N+](=O)[O-] ZINC000475304190 946845575 /nfs/dbraw/zinc/84/55/75/946845575.db2.gz QFTSPBQREKCWAT-UHFFFAOYSA-N 0 0 369.299 3.768 20 5 FHBDRN O=[N+]([O-])c1cccc(N2CCN(Cc3cc(Cl)nc(Cl)c3)CC2)c1 ZINC000108975495 946846616 /nfs/dbraw/zinc/84/66/16/946846616.db2.gz ZKJKXJILXDLJJN-UHFFFAOYSA-N 0 0 367.236 3.619 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CC[C@]2(C1)OCc1ccccc12 ZINC000184484636 946873135 /nfs/dbraw/zinc/87/31/35/946873135.db2.gz WJAXDBDZQCFKFW-HXUWFJFHSA-N 0 0 367.405 3.875 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)c1c2ccccc2nn1C ZINC000475318496 946880780 /nfs/dbraw/zinc/88/07/80/946880780.db2.gz JJLMMIGGCKWHAJ-UHFFFAOYSA-N 0 0 352.394 3.532 20 5 FHBDRN CC[C@@H](CC(F)F)C(=O)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC000839310457 946883115 /nfs/dbraw/zinc/88/31/15/946883115.db2.gz NJNLCORPEDAAGI-ZETCQYMHSA-N 0 0 351.147 3.977 20 5 FHBDRN CCC[C@H](NC(=O)CCn1nc(C)c([N+](=O)[O-])c1C)C1CCCCC1 ZINC000112527249 946893932 /nfs/dbraw/zinc/89/39/32/946893932.db2.gz PUKBOTFDBFCWJL-INIZCTEOSA-N 0 0 350.463 3.663 20 5 FHBDRN CC(C)OC(=O)C[C@H](NC(=O)CCC(C)(C)C)c1ccccc1[N+](=O)[O-] ZINC000523132593 946899758 /nfs/dbraw/zinc/89/97/58/946899758.db2.gz KGIDGICYTUKHIE-HNNXBMFYSA-N 0 0 364.442 3.920 20 5 FHBDRN COc1ccc2c(CC(=O)NCc3cccc([N+](=O)[O-])c3)coc2c1C ZINC001126173244 946901419 /nfs/dbraw/zinc/90/14/19/946901419.db2.gz WBKHMBZRZDMBJH-UHFFFAOYSA-N 0 0 354.362 3.517 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2ncn(Cc3ncc(-c4ccc(F)cc4)o3)n2)c1 ZINC000112521986 946905245 /nfs/dbraw/zinc/90/52/45/946905245.db2.gz DJASNEBRXFLWHB-UHFFFAOYSA-N 0 0 365.324 3.696 20 5 FHBDRN CC(C)(C(=O)NCc1nc2ccccc2s1)c1ccc([N+](=O)[O-])cc1F ZINC000546537745 946909182 /nfs/dbraw/zinc/90/91/82/946909182.db2.gz UFULZVLQQHQSFF-UHFFFAOYSA-N 0 0 373.409 3.938 20 5 FHBDRN COc1cc(NC/C=C\c2ccccc2[N+](=O)[O-])cc(-n2cccn2)c1 ZINC000475340989 946911435 /nfs/dbraw/zinc/91/14/35/946911435.db2.gz BOLJSNDLUMTTDY-DAXSKMNVSA-N 0 0 350.378 3.914 20 5 FHBDRN C[C@H]1c2c(F)cccc2CCN1C(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000523145017 946913062 /nfs/dbraw/zinc/91/30/62/946913062.db2.gz KPUXASWLHPESQQ-ZDUSSCGKSA-N 0 0 357.385 3.682 20 5 FHBDRN CSc1cccc(C(=O)NCCc2ccccc2Cl)c1[N+](=O)[O-] ZINC000186325963 946913543 /nfs/dbraw/zinc/91/35/43/946913543.db2.gz ZALSIYLAQNRCSA-UHFFFAOYSA-N 0 0 350.827 3.943 20 5 FHBDRN C[C@@H](NC(=O)N[C@@H](C)c1ccc([N+](=O)[O-])cc1)c1nc2c(s1)CCC2 ZINC000458885643 946915475 /nfs/dbraw/zinc/91/54/75/946915475.db2.gz GTNPDFDRDOTZDY-WDEREUQCSA-N 0 0 360.439 3.661 20 5 FHBDRN COc1ccc(CCNc2ncc([N+](=O)[O-])cc2Cl)c(Cl)c1OC ZINC000549581127 946918868 /nfs/dbraw/zinc/91/88/68/946918868.db2.gz KTQSUGMNVGMXEF-UHFFFAOYSA-N 0 0 372.208 3.968 20 5 FHBDRN O=[N+]([O-])c1ccc(N[C@H]2CCN(Cc3ccc(Cl)cc3Cl)C2)nc1 ZINC000112656696 946919880 /nfs/dbraw/zinc/91/98/80/946919880.db2.gz YJLPHBXSAJLANO-ZDUSSCGKSA-N 0 0 367.236 3.983 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@H]1C[C@]12CCc1ccccc12 ZINC000186327294 946922980 /nfs/dbraw/zinc/92/29/80/946922980.db2.gz GPECHDWADMMHBC-APWZRJJASA-N 0 0 356.809 3.769 20 5 FHBDRN CCN(CC)Cc1csc(NC(=O)c2c(C)c(F)ccc2[N+](=O)[O-])n1 ZINC000843771372 946927624 /nfs/dbraw/zinc/92/76/24/946927624.db2.gz IZJVSQJLEQAZPL-UHFFFAOYSA-N 0 0 366.418 3.593 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNCc1cccc(Br)c1 ZINC000048818880 946929335 /nfs/dbraw/zinc/92/93/35/946929335.db2.gz DVCKBZKXPPTWOR-UHFFFAOYSA-N 0 0 351.200 3.656 20 5 FHBDRN CC(C)[C@H](c1ccccc1)N(C)S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000112706421 946931671 /nfs/dbraw/zinc/93/16/71/946931671.db2.gz BLVCBAKMQVESJH-GOSISDBHSA-N 0 0 362.451 3.754 20 5 FHBDRN O=[N+]([O-])c1c(NC[C@H](O)c2ccc3ccccc3c2)nc2sccn21 ZINC000067373017 946933829 /nfs/dbraw/zinc/93/38/29/946933829.db2.gz UHBUPQWZAYPZEE-AWEZNQCLSA-N 0 0 354.391 3.603 20 5 FHBDRN CCOc1cc(NC(=O)CCCc2ccccn2)c([N+](=O)[O-])cc1OCC ZINC000112781482 946942050 /nfs/dbraw/zinc/94/20/50/946942050.db2.gz LSGJQMMPGTYWNK-UHFFFAOYSA-N 0 0 373.409 3.749 20 5 FHBDRN CC[C@H](OC1CCCC1)C(=O)Nc1cc(C)nn1-c1ccc([N+](=O)[O-])cc1 ZINC000112782612 946942111 /nfs/dbraw/zinc/94/21/11/946942111.db2.gz KFLJAVCWUZSRSC-KRWDZBQOSA-N 0 0 372.425 3.765 20 5 FHBDRN C[C@H](NC(=O)N(C[C@@H]1CCCO1)C1CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000458892942 946947522 /nfs/dbraw/zinc/94/75/22/946947522.db2.gz WBBPEVDEPPLGHQ-KSSFIOAISA-N 0 0 361.442 3.789 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)S(=O)(=O)c1ccc2c(c1)CCC2 ZINC000511910750 946947467 /nfs/dbraw/zinc/94/74/67/946947467.db2.gz JMIHYYYTEMVLKT-UHFFFAOYSA-N 0 0 374.462 3.683 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1C[C@@H]1c1cc(F)ccc1F ZINC000186337764 946950916 /nfs/dbraw/zinc/95/09/16/946950916.db2.gz JIHUSRNIEJZJEO-TZMCWYRMSA-N 0 0 366.751 3.946 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1C[C@H]1c1cc(F)ccc1F ZINC000186337796 946953017 /nfs/dbraw/zinc/95/30/17/946953017.db2.gz JIHUSRNIEJZJEO-GXTWGEPZSA-N 0 0 366.751 3.946 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N(Cc1ccc(F)cc1F)C1CC1 ZINC000087067473 946953909 /nfs/dbraw/zinc/95/39/09/946953909.db2.gz ABXQGSHDTIFESQ-UHFFFAOYSA-N 0 0 360.360 3.997 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])s1)N1CCC(OCc2ccccc2F)CC1 ZINC000121462151 946967342 /nfs/dbraw/zinc/96/73/42/946967342.db2.gz NBLARKATMOMUQA-UHFFFAOYSA-N 0 0 364.398 3.617 20 5 FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H](C(C)C)C1 ZINC000444524103 946973940 /nfs/dbraw/zinc/97/39/40/946973940.db2.gz PHFNQEVJZQDHLM-CQSZACIVSA-N 0 0 366.483 3.842 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(OC2COC2)cc1 ZINC000444527208 946976256 /nfs/dbraw/zinc/97/62/56/946976256.db2.gz NORMAIUDRUEXPB-UHFFFAOYSA-N 0 0 374.418 3.737 20 5 FHBDRN Cc1ccc(NC(=O)C(=O)N[C@@H](CC(C)C)c2ccccc2)cc1[N+](=O)[O-] ZINC000048975694 946989828 /nfs/dbraw/zinc/98/98/28/946989828.db2.gz WFCKXCUMTBMIAH-KRWDZBQOSA-N 0 0 369.421 3.745 20 5 FHBDRN Cc1nn(CCC(=O)N(CCC(C)C)C2CCCC2)c(C)c1[N+](=O)[O-] ZINC000523223144 947005256 /nfs/dbraw/zinc/00/52/56/947005256.db2.gz MGZQTNCQDAESDF-UHFFFAOYSA-N 0 0 350.463 3.616 20 5 FHBDRN CCCOc1ccc(NC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)cc1 ZINC000508501627 947044277 /nfs/dbraw/zinc/04/42/77/947044277.db2.gz DEQADBWAZATJLU-UHFFFAOYSA-N 0 0 353.378 3.977 20 5 FHBDRN CC(C)(C(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccccc1Cl ZINC000444637845 947049901 /nfs/dbraw/zinc/04/99/01/947049901.db2.gz SHDQDHPVZBVIDT-UHFFFAOYSA-N 0 0 372.812 3.719 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N1C[C@@H](C)O[C@H](c2ccc(F)cc2)C1 ZINC000152027748 947051317 /nfs/dbraw/zinc/05/13/17/947051317.db2.gz CUGNSSBSYRNORL-ACJLOTCBSA-N 0 0 358.369 3.645 20 5 FHBDRN CCCCOc1ccc(C(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000444630798 947061766 /nfs/dbraw/zinc/06/17/66/947061766.db2.gz IZCRWOPUNVSGMG-UHFFFAOYSA-N 0 0 368.393 3.580 20 5 FHBDRN CCCCC1CCC(CNC(=O)CCn2nc(C)c([N+](=O)[O-])c2C)CC1 ZINC000523274987 947061864 /nfs/dbraw/zinc/06/18/64/947061864.db2.gz FDWZQQLVOJJVLW-UHFFFAOYSA-N 0 0 364.490 3.911 20 5 FHBDRN C[C@@H](C(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1cc2ccccc2o1 ZINC000444634018 947063488 /nfs/dbraw/zinc/06/34/88/947063488.db2.gz WVZDZQSKUBHTJI-LLVKDONJSA-N 0 0 364.361 3.637 20 5 FHBDRN O=C(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@H]1C[C@@H]1c1cccc(Cl)c1 ZINC000444632432 947063494 /nfs/dbraw/zinc/06/34/94/947063494.db2.gz FYRHWINAZRHFLX-KGLIPLIRSA-N 0 0 370.796 3.544 20 5 FHBDRN CCOC(=O)CCCCCOc1ccc(Br)cc1[N+](=O)[O-] ZINC000088086165 947063758 /nfs/dbraw/zinc/06/37/58/947063758.db2.gz WLZNJIQQEBYEPX-UHFFFAOYSA-N 0 0 360.204 3.860 20 5 FHBDRN CC(C)[C@H](Cc1ccccc1)C(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444633363 947064579 /nfs/dbraw/zinc/06/45/79/947064579.db2.gz BXKFZYUWJSIEIJ-INIZCTEOSA-N 0 0 366.421 3.602 20 5 FHBDRN Cc1ccc(C(=O)N(C)[C@@H]2CCC[N@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000074445746 947068334 /nfs/dbraw/zinc/06/83/34/947068334.db2.gz HUJHRCNQSSTSPJ-LJQANCHMSA-N 0 0 367.449 3.640 20 5 FHBDRN CCCOc1cc(NC(=O)[C@H]2CCSC2)c([N+](=O)[O-])cc1OCCC ZINC000475428463 947072919 /nfs/dbraw/zinc/07/29/19/947072919.db2.gz KSCCMPWZMHBYTK-LBPRGKRZSA-N 0 0 368.455 3.864 20 5 FHBDRN COC(=O)[C@@H](NC/C=C/c1ccccc1[N+](=O)[O-])c1ccc(C)c(C)c1 ZINC000428373224 947079784 /nfs/dbraw/zinc/07/97/84/947079784.db2.gz NOPLHWFEFNMMPT-FNQPIQQGSA-N 0 0 354.406 3.729 20 5 FHBDRN CCCN(C(=O)c1csc(-c2cnn(C)c2)n1)c1cccc([N+](=O)[O-])c1 ZINC000441429623 947089999 /nfs/dbraw/zinc/08/99/99/947089999.db2.gz PNZIMKRRKBCJCB-UHFFFAOYSA-N 0 0 371.422 3.509 20 5 FHBDRN C[C@@H](NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccccc1OC(F)F ZINC000444673650 947097707 /nfs/dbraw/zinc/09/77/07/947097707.db2.gz IHGFVJGDISDFED-SNVBAGLBSA-N 0 0 362.336 3.923 20 5 FHBDRN COC(=O)c1cc(NC(=O)c2cscc2Cl)c(C)c([N+](=O)[O-])c1 ZINC001271456000 947099134 /nfs/dbraw/zinc/09/91/34/947099134.db2.gz GRQJSEQHTAQWLJ-UHFFFAOYSA-N 0 0 354.771 3.657 20 5 FHBDRN C[C@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@@H]1Oc2ccccc2[C@H]1C ZINC000444678590 947102707 /nfs/dbraw/zinc/10/27/07/947102707.db2.gz ZLAZOJUVXMMVRJ-UYSIFFEZSA-N 0 0 352.394 3.514 20 5 FHBDRN C[C@@H](NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccc(OC(F)F)cc1 ZINC000444682498 947107110 /nfs/dbraw/zinc/10/71/10/947107110.db2.gz ACDORVYTUDJCMV-SNVBAGLBSA-N 0 0 362.336 3.923 20 5 FHBDRN C[C@H](NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1cccc(OC(F)F)c1 ZINC000444683158 947108397 /nfs/dbraw/zinc/10/83/97/947108397.db2.gz DLRIXZQUTYMYQA-JTQLQIEISA-N 0 0 362.336 3.923 20 5 FHBDRN CCOc1ccc(NC(=O)CN(C)Cc2cc(C)cc(C)c2)c([N+](=O)[O-])c1 ZINC000444689136 947113416 /nfs/dbraw/zinc/11/34/16/947113416.db2.gz FIABEAVZXJTJFK-UHFFFAOYSA-N 0 0 371.437 3.681 20 5 FHBDRN Cc1nn(Cc2coc(-c3ccc(Br)cc3)n2)cc1[N+](=O)[O-] ZINC000181825139 947120365 /nfs/dbraw/zinc/12/03/65/947120365.db2.gz PKFJUFJOOBVDQZ-UHFFFAOYSA-N 0 0 363.171 3.566 20 5 FHBDRN Cc1nn(CC(=O)N[C@H](c2ccccc2)C2CCCCC2)cc1[N+](=O)[O-] ZINC000181826117 947122415 /nfs/dbraw/zinc/12/24/15/947122415.db2.gz BBNALCFQGISSKZ-LJQANCHMSA-N 0 0 356.426 3.538 20 5 FHBDRN CN(Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)Cc1cc(F)cc(F)c1 ZINC000444699065 947122729 /nfs/dbraw/zinc/12/27/29/947122729.db2.gz DEEWXSVIFXRJQU-UHFFFAOYSA-N 0 0 360.320 3.555 20 5 FHBDRN C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N(C)Cc1cc(Cl)ccc1F ZINC000444697598 947122858 /nfs/dbraw/zinc/12/28/58/947122858.db2.gz QTCILIDOHVWSSC-LLVKDONJSA-N 0 0 365.792 3.846 20 5 FHBDRN COc1ccccc1-c1nnc(CN[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)o1 ZINC000181823447 947127076 /nfs/dbraw/zinc/12/70/76/947127076.db2.gz YSZPSURHDNENGH-CYBMUJFWSA-N 0 0 368.393 3.813 20 5 FHBDRN Cc1nn(-c2ccccc2)c(C)c1C(=O)Nc1ccc(C)c([N+](=O)[O-])c1 ZINC000020893540 947128475 /nfs/dbraw/zinc/12/84/75/947128475.db2.gz VGWUGPOHSYPEAZ-UHFFFAOYSA-N 0 0 350.378 3.958 20 5 FHBDRN Cc1nn(CC(=O)N2CCC[C@@H]2c2ccc(C(C)(C)C)cc2)cc1[N+](=O)[O-] ZINC000181833037 947133007 /nfs/dbraw/zinc/13/30/07/947133007.db2.gz MIHNILGCYDCIKI-QGZVFWFLSA-N 0 0 370.453 3.761 20 5 FHBDRN COc1ccc(C[C@@H](C)Nc2ncnc3cccc([N+](=O)[O-])c32)cc1OC ZINC000544392961 947141328 /nfs/dbraw/zinc/14/13/28/947141328.db2.gz KVTPLHOJDJEVLH-GFCCVEGCSA-N 0 0 368.393 3.598 20 5 FHBDRN CNc1ccc(C(=O)NCC2(c3ccc(F)cc3)CCC2)cc1[N+](=O)[O-] ZINC000523358097 947155431 /nfs/dbraw/zinc/15/54/31/947155431.db2.gz SYUYAVUIZNMVAW-UHFFFAOYSA-N 0 0 357.385 3.627 20 5 FHBDRN CCCN(C(=O)Cc1ccc(OC)c(OC)c1)c1cccc([N+](=O)[O-])c1 ZINC000441431057 947155659 /nfs/dbraw/zinc/15/56/59/947155659.db2.gz UKXNPLMAMZHVAW-UHFFFAOYSA-N 0 0 358.394 3.598 20 5 FHBDRN CCOC(=O)[C@@H]1CCN(CCOc2ccc([N+](=O)[O-])cc2)c2ccccc21 ZINC000444718199 947160781 /nfs/dbraw/zinc/16/07/81/947160781.db2.gz KDVPJTRKJPXOON-GOSISDBHSA-N 0 0 370.405 3.531 20 5 FHBDRN O=C(COc1ccc(Br)cc1F)c1cccc([N+](=O)[O-])c1 ZINC000049900929 947167409 /nfs/dbraw/zinc/16/74/09/947167409.db2.gz RNDISIJUWLLQPR-UHFFFAOYSA-N 0 0 354.131 3.758 20 5 FHBDRN Cc1cc(NC(=O)c2cc(F)cc3c(=O)c4cccc(F)c4[nH]c23)sn1 ZINC000444739535 947175534 /nfs/dbraw/zinc/17/55/34/947175534.db2.gz ATMRLAGZPGHMCL-UHFFFAOYSA-N 0 0 371.368 3.977 20 5 FHBDRN C[C@@H](CNc1ccccc1)NC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000444744606 947181430 /nfs/dbraw/zinc/18/14/30/947181430.db2.gz PXMDWHLBMJTWBR-HNNXBMFYSA-N 0 0 371.440 3.912 20 5 FHBDRN O=C(N[C@@H](c1ccc(F)c(Cl)c1)C(F)(F)F)c1ccc([N+](=O)[O-])[nH]1 ZINC000444755922 947191941 /nfs/dbraw/zinc/19/19/41/947191941.db2.gz GVGYRAGHPHAGHG-NSHDSACASA-N 0 0 365.670 3.749 20 5 FHBDRN CC(C)[C@H]1CCCN([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000444771298 947207545 /nfs/dbraw/zinc/20/75/45/947207545.db2.gz OQVJZXFIXSFPAG-STQMWFEESA-N 0 0 353.850 3.943 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N(Cc1cccc(F)c1)C(C)C ZINC000511961526 947214050 /nfs/dbraw/zinc/21/40/50/947214050.db2.gz RZEZHSKLPKBUDN-UHFFFAOYSA-N 0 0 366.414 3.642 20 5 FHBDRN Cc1ccccc1[C@H]1C[C@H](C)N(S(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000523415339 947223355 /nfs/dbraw/zinc/22/33/55/947223355.db2.gz URCISTONJHUUKN-HOTGVXAUSA-N 0 0 374.462 3.778 20 5 FHBDRN Cc1ccccc1[C@@H]1C[C@H](C)N(S(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000523415341 947224181 /nfs/dbraw/zinc/22/41/81/947224181.db2.gz URCISTONJHUUKN-JKSUJKDBSA-N 0 0 374.462 3.778 20 5 FHBDRN COc1cccc(NC(=O)c2sc(Br)cc2[N+](=O)[O-])c1 ZINC000444825603 947240673 /nfs/dbraw/zinc/24/06/73/947240673.db2.gz LEBVOIBALCDBLQ-UHFFFAOYSA-N 0 0 357.185 3.680 20 5 FHBDRN C[C@@H](Cc1ccc(Cl)cc1Cl)NC(=O)c1cc([N+](=O)[O-])cn1C ZINC000523430487 947242980 /nfs/dbraw/zinc/24/29/80/947242980.db2.gz ZTOZSNZCTLAEJV-VIFPVBQESA-N 0 0 356.209 3.601 20 5 FHBDRN O=C(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)Nc1cccc(Cl)c1F ZINC000444814270 947247372 /nfs/dbraw/zinc/24/73/72/947247372.db2.gz BSTNKGMWKPACCL-UHFFFAOYSA-N 0 0 363.736 3.585 20 5 FHBDRN Cc1ccccc1[C@@H]1C[C@H](C)N(S(=O)(=O)c2ccc([N+](=O)[O-])c(C)c2)C1 ZINC000523419081 947249166 /nfs/dbraw/zinc/24/91/66/947249166.db2.gz RBVJJTZGLNFDRH-JKSUJKDBSA-N 0 0 374.462 3.778 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2ncn(Cc3csc(-c4ccco4)n3)n2)cc1 ZINC000508509836 947262879 /nfs/dbraw/zinc/26/28/79/947262879.db2.gz BZFISTFQTBMDRW-UHFFFAOYSA-N 0 0 353.363 3.618 20 5 FHBDRN COc1ccccc1CCNC(=O)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000444830504 947263057 /nfs/dbraw/zinc/26/30/57/947263057.db2.gz WNBZAZQTVIFXIK-UHFFFAOYSA-N 0 0 372.424 3.662 20 5 FHBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1OC(=O)CCCC(=O)OC(C)(C)C ZINC001126195979 947274796 /nfs/dbraw/zinc/27/47/96/947274796.db2.gz PBVBMHPTOIZOQD-UHFFFAOYSA-N 0 0 357.790 3.974 20 5 FHBDRN COc1ccc(OC(=O)COc2ccccc2C(C)(C)C)c([N+](=O)[O-])c1 ZINC000104875881 947282073 /nfs/dbraw/zinc/28/20/73/947282073.db2.gz QWYJJUZSELVZGL-UHFFFAOYSA-N 0 0 359.378 3.885 20 5 FHBDRN COc1cc(OC)cc(-c2nc(Cc3ccc([N+](=O)[O-])c(C)c3)no2)c1 ZINC000546558943 947282432 /nfs/dbraw/zinc/28/24/32/947282432.db2.gz JMKRCDOJUHTFSL-UHFFFAOYSA-N 0 0 355.350 3.561 20 5 FHBDRN O=C(O[C@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)c1cc2occc2s1 ZINC000759928880 947283075 /nfs/dbraw/zinc/28/30/75/947283075.db2.gz HQKUJYZZDJMWDR-QWRGUYRKSA-N 0 0 361.379 3.940 20 5 FHBDRN C[C@H](NC(=O)NCc1cccc([N+](=O)[O-])c1)c1cccc(N2CCCC2)c1 ZINC000087069098 947287160 /nfs/dbraw/zinc/28/71/60/947287160.db2.gz ZYZBJXHIONMJGG-HNNXBMFYSA-N 0 0 368.437 3.755 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(NCc2cccc(OCC(F)F)c2)c1 ZINC000543899200 947294290 /nfs/dbraw/zinc/29/42/90/947294290.db2.gz RRWYYOKRMDNDNP-UHFFFAOYSA-N 0 0 366.320 3.637 20 5 FHBDRN Cc1ccc(NC(=O)C(=O)Nc2cccc(OCC(C)C)c2)cc1[N+](=O)[O-] ZINC000125676968 947301884 /nfs/dbraw/zinc/30/18/84/947301884.db2.gz ABZHBESWYJQIFY-UHFFFAOYSA-N 0 0 371.393 3.515 20 5 FHBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)c1cc(F)c(F)c(F)c1 ZINC000523498949 947304938 /nfs/dbraw/zinc/30/49/38/947304938.db2.gz NFXWREVMNCJQGJ-UHFFFAOYSA-N 0 0 352.312 3.765 20 5 FHBDRN Cc1cccc(O[C@H](C)C(=O)NCCCNc2ccc(C)cc2[N+](=O)[O-])c1 ZINC000523512059 947325277 /nfs/dbraw/zinc/32/52/77/947325277.db2.gz FSHRYCOORJIPNC-MRXNPFEDSA-N 0 0 371.437 3.597 20 5 FHBDRN Cc1cccc([C@@H](C)C(=O)NCCCNc2ccc(C)cc2[N+](=O)[O-])c1 ZINC000523511930 947325347 /nfs/dbraw/zinc/32/53/47/947325347.db2.gz ADFZIGKYAUEZOI-MRXNPFEDSA-N 0 0 355.438 3.934 20 5 FHBDRN CCOCCO[C@@H](C)C(=O)N(Cc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000440594288 947329051 /nfs/dbraw/zinc/32/90/51/947329051.db2.gz BQDLCIAUTRLBOS-INIZCTEOSA-N 0 0 372.421 3.570 20 5 FHBDRN CC(C)(C)OC(=O)CCSCc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000440598937 947332465 /nfs/dbraw/zinc/33/24/65/947332465.db2.gz NTVWPSFHGCGZGF-UHFFFAOYSA-N 0 0 365.411 3.610 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N1CCC[C@@H](C(F)(F)F)[C@H]1C ZINC000444897056 947336007 /nfs/dbraw/zinc/33/60/07/947336007.db2.gz FANLJJTXRKTIGP-MWLCHTKSSA-N 0 0 361.320 3.798 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NCc1ccc(Cl)cc1F ZINC000444897006 947336483 /nfs/dbraw/zinc/33/64/83/947336483.db2.gz DWXXSTGOTCVMCY-UHFFFAOYSA-N 0 0 353.737 3.718 20 5 FHBDRN CC[C@@H](c1ccncc1)N(CC)C(=O)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000523530333 947339418 /nfs/dbraw/zinc/33/94/18/947339418.db2.gz NFYLPZCDZGKXHS-INIZCTEOSA-N 0 0 357.410 3.541 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[C@@](C)(c2ccccc2)C1 ZINC000444924857 947342571 /nfs/dbraw/zinc/34/25/71/947342571.db2.gz RIBQYYVTZMVTLI-LJQANCHMSA-N 0 0 355.394 3.799 20 5 FHBDRN COC(=O)c1cc(NC(=O)[C@H](C)c2cccc([N+](=O)[O-])c2)ccc1Cl ZINC000617696653 947343510 /nfs/dbraw/zinc/34/35/10/947343510.db2.gz KRKAARCAXYHVJZ-SNVBAGLBSA-N 0 0 362.769 3.777 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NCc1c(C)oc2ccccc21 ZINC000444927281 947344427 /nfs/dbraw/zinc/34/44/27/947344427.db2.gz CYKICGKNSYWPIW-UHFFFAOYSA-N 0 0 355.350 3.980 20 5 FHBDRN COc1ccc(C(=O)N(Cc2ccc([N+](=O)[O-])cc2)c2ccccc2)cn1 ZINC000440595193 947351887 /nfs/dbraw/zinc/35/18/87/947351887.db2.gz HBZDXQNMRJJHBH-UHFFFAOYSA-N 0 0 363.373 3.845 20 5 FHBDRN CCc1nnc(-c2cccc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)c2)o1 ZINC000440599913 947354637 /nfs/dbraw/zinc/35/46/37/947354637.db2.gz WEEFPMCIOVHUTI-UHFFFAOYSA-N 0 0 356.313 3.599 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1C[C@H](C)Sc2ccccc21 ZINC000088546853 947356396 /nfs/dbraw/zinc/35/63/96/947356396.db2.gz PVXKOPGLZQUBTL-LBPRGKRZSA-N 0 0 364.448 3.593 20 5 FHBDRN CCC(CC)[C@@H](CCNC(=O)Nc1ccc([N+](=O)[O-])cc1OC)OC ZINC000444931174 947371218 /nfs/dbraw/zinc/37/12/18/947371218.db2.gz OWFQQYIITICNKT-OAHLLOKOSA-N 0 0 353.419 3.566 20 5 FHBDRN O=C(CCCc1cccs1)O[C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000759929760 947395226 /nfs/dbraw/zinc/39/52/26/947395226.db2.gz HYWFVJVKYBISDZ-HUUCEWRRSA-N 0 0 363.439 3.903 20 5 FHBDRN CN(C(=O)c1ccccc1Sc1ccccc1[N+](=O)[O-])c1cnn(C)c1 ZINC000440626485 947401857 /nfs/dbraw/zinc/40/18/57/947401857.db2.gz NZHIVRZPFWBASC-UHFFFAOYSA-N 0 0 368.418 3.756 20 5 FHBDRN Cc1ccc(CCCOC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)cc1 ZINC000785326098 947411282 /nfs/dbraw/zinc/41/12/82/947411282.db2.gz BTLMQYRZPQQFHO-UHFFFAOYSA-N 0 0 366.373 3.947 20 5 FHBDRN COC(C)(C)C[C@@H](C)NC(=O)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000445008668 947433315 /nfs/dbraw/zinc/43/33/15/947433315.db2.gz LIKBVIHZTQHDNW-CYBMUJFWSA-N 0 0 352.434 3.615 20 5 FHBDRN CC(C)[C@H](c1ccccc1)N(C)C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000523650206 947461771 /nfs/dbraw/zinc/46/17/71/947461771.db2.gz VAGVAXUICIPQHC-GOSISDBHSA-N 0 0 356.378 3.793 20 5 FHBDRN Cc1sc(S(=O)(=O)N(C)[C@@H](C)Cc2ccccc2C)cc1[N+](=O)[O-] ZINC000445080492 947477450 /nfs/dbraw/zinc/47/74/50/947477450.db2.gz MVDSOCQWYRPTTB-LBPRGKRZSA-N 0 0 368.480 3.525 20 5 FHBDRN Cc1cc(C)cc([C@@H](C)NC(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)c1 ZINC000445102698 947497246 /nfs/dbraw/zinc/49/72/46/947497246.db2.gz NMOAOOTYYPWOSO-CYBMUJFWSA-N 0 0 367.409 3.648 20 5 FHBDRN Cc1c2cc(Cl)ccc2sc1CNc1ccc2ncc([N+](=O)[O-])n2n1 ZINC000440647805 947503434 /nfs/dbraw/zinc/50/34/34/947503434.db2.gz VOWPMUZOSWBGNO-UHFFFAOYSA-N 0 0 373.825 3.848 20 5 FHBDRN CCn1c(C)cc(C(=O)O[C@@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)c1C ZINC000759932134 947522311 /nfs/dbraw/zinc/52/23/11/947522311.db2.gz MRKHGDYHBUPQCD-HZPDHXFCSA-N 0 0 360.414 3.570 20 5 FHBDRN CCn1c(C)cc(C(=O)O[C@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)c1C ZINC000759932128 947522606 /nfs/dbraw/zinc/52/26/06/947522606.db2.gz MRKHGDYHBUPQCD-CVEARBPZSA-N 0 0 360.414 3.570 20 5 FHBDRN COCC1(C)CCN(C(=O)c2cccc3c(=O)c4ccccc4[nH]c23)CC1 ZINC000445132852 947544434 /nfs/dbraw/zinc/54/44/34/947544434.db2.gz HXAVBBYQFQZEGX-UHFFFAOYSA-N 0 0 364.445 3.570 20 5 FHBDRN O=C(Nc1ccc(O[C@@H]2CCCC[C@H]2O)cc1)c1ccc([N+](=O)[O-])cc1F ZINC000125728715 947545284 /nfs/dbraw/zinc/54/52/84/947545284.db2.gz COSAZHWDHGLLBB-QZTJIDSGSA-N 0 0 374.368 3.669 20 5 FHBDRN CCn1nccc1C1CCN(C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)CC1 ZINC000278857785 947546456 /nfs/dbraw/zinc/54/64/56/947546456.db2.gz QWDQGEMJXYOOOK-UHFFFAOYSA-N 0 0 371.441 3.840 20 5 FHBDRN O=C1[C@H](N2CCC[C@@H]2c2ccsc2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000067377193 947559516 /nfs/dbraw/zinc/55/95/16/947559516.db2.gz IFKCNGGIWUXQIZ-IAGOWNOFSA-N 0 0 357.435 3.599 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)Nc1cc(-c2ccc(Cl)s2)[nH]n1 ZINC000162861737 947568161 /nfs/dbraw/zinc/56/81/61/947568161.db2.gz GBIZPXJNLCYLJA-UHFFFAOYSA-N 0 0 363.786 3.656 20 5 FHBDRN Cc1cc(C)c(NC(=O)CN2CCc3ccc([N+](=O)[O-])cc3C2)c(C)c1 ZINC000088606512 947574485 /nfs/dbraw/zinc/57/44/85/947574485.db2.gz FLFKFSHQUPQKSC-UHFFFAOYSA-N 0 0 353.422 3.517 20 5 FHBDRN C[C@@H](NC(=O)c1cccc2c(=O)c3ccccc3[nH]c12)c1cccc(O)c1 ZINC000445182632 947574665 /nfs/dbraw/zinc/57/46/65/947574665.db2.gz MBNQHVMBQQBOMA-CYBMUJFWSA-N 0 0 358.397 3.878 20 5 FHBDRN Cc1ccc(-c2nnc(CN3CCc4ccc([N+](=O)[O-])cc4C3)o2)cc1 ZINC000088607502 947576548 /nfs/dbraw/zinc/57/65/48/947576548.db2.gz VPCGZPUPBPIQND-UHFFFAOYSA-N 0 0 350.378 3.512 20 5 FHBDRN CSc1ccccc1[C@H](C)Nc1sc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000440674316 947577286 /nfs/dbraw/zinc/57/72/86/947577286.db2.gz QRSIPNVENSPNDH-VIFPVBQESA-N 0 0 372.493 3.955 20 5 FHBDRN O=C(NCc1cc(F)ccc1F)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000445191536 947582886 /nfs/dbraw/zinc/58/28/86/947582886.db2.gz XNZMBJYEEXGPOC-UHFFFAOYSA-N 0 0 364.351 3.890 20 5 FHBDRN O=C(O[C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)c1cc(F)cc(Cl)c1 ZINC000759934192 947586620 /nfs/dbraw/zinc/58/66/20/947586620.db2.gz PNLNRMGLBLTKDX-UONOGXRCSA-N 0 0 367.764 3.925 20 5 FHBDRN CC(C)(C)n1cc(NC(=O)c2sc(Br)cc2[N+](=O)[O-])cn1 ZINC000445194486 947592479 /nfs/dbraw/zinc/59/24/79/947592479.db2.gz OMHFPRWTLUXXCJ-UHFFFAOYSA-N 0 0 373.232 3.623 20 5 FHBDRN O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)c1csc([C@H]2CCCO2)n1 ZINC000165079104 947593616 /nfs/dbraw/zinc/59/36/16/947593616.db2.gz IQNDRFJCUXTTJS-GFCCVEGCSA-N 0 0 353.787 3.809 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000445251042 947627031 /nfs/dbraw/zinc/62/70/31/947627031.db2.gz QABYKNVJLYZSFK-UHFFFAOYSA-N 0 0 359.341 3.842 20 5 FHBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CCc2ccccc2CC1 ZINC000523811023 947630439 /nfs/dbraw/zinc/63/04/39/947630439.db2.gz NFGJXXGXCJVSAN-ZDUSSCGKSA-N 0 0 374.824 3.643 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CN1C[C@H](c2ccccc2C)OC[C@@H]1C ZINC000441463593 947633590 /nfs/dbraw/zinc/63/35/90/947633590.db2.gz KTHYWUQMYJAGJJ-MGPUTAFESA-N 0 0 356.422 3.874 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CN1C[C@H](c2ccccc2C)OC[C@H]1C ZINC000441463591 947634116 /nfs/dbraw/zinc/63/41/16/947634116.db2.gz KTHYWUQMYJAGJJ-FOIQADDNSA-N 0 0 356.422 3.874 20 5 FHBDRN C[C@H](NC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-])c1cccc(O)c1 ZINC000445255525 947657805 /nfs/dbraw/zinc/65/78/05/947657805.db2.gz YUHWPZYAJNJAIQ-NSHDSACASA-N 0 0 363.801 3.557 20 5 FHBDRN Cc1cccc(C)c1OCC(=O)O[C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000759936677 947675540 /nfs/dbraw/zinc/67/55/40/947675540.db2.gz FVURIXVSQWPZIJ-HZPDHXFCSA-N 0 0 373.409 3.514 20 5 FHBDRN Cc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2Br)c(C)n1 ZINC000121551793 947676271 /nfs/dbraw/zinc/67/62/71/947676271.db2.gz LWQOSDUGSVFAPF-UHFFFAOYSA-N 0 0 350.172 3.621 20 5 FHBDRN CC(C)(C)OCc1cccc(CNC(=O)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC000523872198 947684253 /nfs/dbraw/zinc/68/42/53/947684253.db2.gz FKVISPZDGVVRGN-UHFFFAOYSA-N 0 0 356.422 3.769 20 5 FHBDRN Cc1cc(C)cc(OCC(=O)O[C@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)c1 ZINC000759936062 947691824 /nfs/dbraw/zinc/69/18/24/947691824.db2.gz DRSOCCYDPZQCID-SJORKVTESA-N 0 0 373.409 3.514 20 5 FHBDRN Cn1ccc2c1cccc2C(=O)O[C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1 ZINC000759936031 947695481 /nfs/dbraw/zinc/69/54/81/947695481.db2.gz DHGQZTNMPATUJX-DLBZAZTESA-N 0 0 368.393 3.624 20 5 FHBDRN CC(C)c1ccccc1OCCNC(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000609546346 947696910 /nfs/dbraw/zinc/69/69/10/947696910.db2.gz GUTOOIVVRUMHPW-UHFFFAOYSA-N 0 0 357.410 3.596 20 5 FHBDRN CCc1ccc(NC(=O)Cc2noc(-c3ccc([N+](=O)[O-])cc3C)n2)cc1 ZINC000445312687 947699835 /nfs/dbraw/zinc/69/98/35/947699835.db2.gz FAVILSJZCKKBBK-UHFFFAOYSA-N 0 0 366.377 3.697 20 5 FHBDRN O=[N+]([O-])c1ccccc1NCc1nc(Cc2ccc3c(c2)CCC3)no1 ZINC000445301790 947710429 /nfs/dbraw/zinc/71/04/29/947710429.db2.gz UWGZYFKVCLRRCA-UHFFFAOYSA-N 0 0 350.378 3.669 20 5 FHBDRN CC(C)c1ccc(CCCNC(=O)COc2ccc([N+](=O)[O-])cc2)cc1 ZINC000523886392 947711970 /nfs/dbraw/zinc/71/19/70/947711970.db2.gz OUKXWRJXOSAUSJ-UHFFFAOYSA-N 0 0 356.422 3.846 20 5 FHBDRN O=C(Cc1noc(-c2ccc([N+](=O)[O-])cc2)n1)Nc1cccc2ccccc21 ZINC000445341746 947738715 /nfs/dbraw/zinc/73/87/15/947738715.db2.gz LNRNPLGHHRYUTQ-UHFFFAOYSA-N 0 0 374.356 3.979 20 5 FHBDRN CSc1ccccc1NC(=O)[C@H](C)OC(=O)c1c(C)cccc1[N+](=O)[O-] ZINC000026117316 947738838 /nfs/dbraw/zinc/73/88/38/947738838.db2.gz NGVGKOOVPMZNBJ-LBPRGKRZSA-N 0 0 374.418 3.809 20 5 FHBDRN Cc1ccc(OCC(=O)O[C@@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)cc1C ZINC000759937795 947742438 /nfs/dbraw/zinc/74/24/38/947742438.db2.gz IXLWWHXJQQGZBE-IAGOWNOFSA-N 0 0 373.409 3.514 20 5 FHBDRN O=C(N[C@@H](c1ccco1)c1ccccc1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000105003134 947751925 /nfs/dbraw/zinc/75/19/25/947751925.db2.gz VMMCMPFOYLSLEH-QGZVFWFLSA-N 0 0 367.317 3.615 20 5 FHBDRN Cc1ccc(NC(=O)Cc2noc(-c3ccc(F)cc3[N+](=O)[O-])n2)c(C)c1 ZINC000445362047 947754676 /nfs/dbraw/zinc/75/46/76/947754676.db2.gz YWBTYPGEDLKHGG-UHFFFAOYSA-N 0 0 370.340 3.582 20 5 FHBDRN O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@H]1Cc2cc(Cl)ccc2O1 ZINC000105044238 947783147 /nfs/dbraw/zinc/78/31/47/947783147.db2.gz SEOAMVXNHSVRFP-CQSZACIVSA-N 0 0 353.161 3.844 20 5 FHBDRN C[C@H](C[C@H](O)c1cccs1)Nc1ncc(Br)cc1[N+](=O)[O-] ZINC000128980882 947790755 /nfs/dbraw/zinc/79/07/55/947790755.db2.gz KFKJKESRAFZKDX-KCJUWKMLSA-N 0 0 372.244 3.738 20 5 FHBDRN COc1cccc2c1OCC(C(=O)O[C@H](C)c1cccc([N+](=O)[O-])c1)=C2 ZINC000725976401 947801874 /nfs/dbraw/zinc/80/18/74/947801874.db2.gz JCQZMGTVSOULHU-GFCCVEGCSA-N 0 0 355.346 3.684 20 5 FHBDRN C/C(=C\C(=O)O[C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1)c1ccccc1 ZINC000759942306 947805475 /nfs/dbraw/zinc/80/54/75/947805475.db2.gz QVKKORSUXNUUSU-UEWLMQCVSA-N 0 0 355.394 3.922 20 5 FHBDRN O=C(Nc1cc2c(cn1)CCC2)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000579393555 947823865 /nfs/dbraw/zinc/82/38/65/947823865.db2.gz MNHAYLMGFQUSMQ-UHFFFAOYSA-N 0 0 355.397 3.817 20 5 FHBDRN Cc1nn(-c2ccccc2)cc1CNC(=O)Nc1ccc([N+](=O)[O-])c(C)c1 ZINC000184603825 947856006 /nfs/dbraw/zinc/85/60/06/947856006.db2.gz XGRHSGAOESUPEY-UHFFFAOYSA-N 0 0 365.393 3.719 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)NCc1ccc(C(F)F)cc1 ZINC000184611625 947860272 /nfs/dbraw/zinc/86/02/72/947860272.db2.gz WROSAZAFMQYWKT-UHFFFAOYSA-N 0 0 352.362 3.941 20 5 FHBDRN C[C@@H](CNC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-])Oc1ccccc1 ZINC001126253720 947886124 /nfs/dbraw/zinc/88/61/24/947886124.db2.gz OYTRAORGCQNQGS-NSHDSACASA-N 0 0 368.311 3.811 20 5 FHBDRN Cc1ccc(C(=O)N2CCN(c3c(Cl)cccc3[N+](=O)[O-])CC2)s1 ZINC000432314277 947936969 /nfs/dbraw/zinc/93/69/69/947936969.db2.gz NGIOGIAPYKNZDL-UHFFFAOYSA-N 0 0 365.842 3.581 20 5 FHBDRN O=[N+]([O-])c1cccc(Cl)c1NC[C@H](c1cccs1)N1CCOCC1 ZINC000432316584 947966023 /nfs/dbraw/zinc/96/60/23/947966023.db2.gz YGDSNGFCBOPWLL-CQSZACIVSA-N 0 0 367.858 3.795 20 5 FHBDRN Cc1ccc(-c2nnc([C@H](C)Oc3ccc([N+](=O)[O-])c(CO)c3)o2)cc1 ZINC000432316126 947968775 /nfs/dbraw/zinc/96/87/75/947968775.db2.gz UXSRJVYODXMWQL-LBPRGKRZSA-N 0 0 355.350 3.586 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)cnc1N1CCC(c2ncc3n2CCCC3)CC1 ZINC000278886897 947993069 /nfs/dbraw/zinc/99/30/69/947993069.db2.gz PEJDMXSULZCTRY-UHFFFAOYSA-N 0 0 361.833 3.560 20 5 FHBDRN C[C@H]1CC(=O)Oc2cc(OC(=O)c3cc(Cl)ccc3[N+](=O)[O-])ccc21 ZINC000785352077 948010758 /nfs/dbraw/zinc/01/07/58/948010758.db2.gz WMXZXHADGBMLGV-VIFPVBQESA-N 0 0 361.737 3.880 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1OC(=O)c1ccc(CSc2nccn2C)o1 ZINC000051706583 948017163 /nfs/dbraw/zinc/01/71/63/948017163.db2.gz SANAYRGPVINIGS-UHFFFAOYSA-N 0 0 373.390 3.741 20 5 FHBDRN Cc1ccc([C@H](Cn2ccnc2)NC(=O)c2ccccc2[N+](=O)[O-])c(C)c1 ZINC000441490721 948019225 /nfs/dbraw/zinc/01/92/25/948019225.db2.gz RBDQHCFKOJBRCP-SFHVURJKSA-N 0 0 364.405 3.579 20 5 FHBDRN Cc1cccc(NC(=O)[C@@H]2CCCN(c3c(Cl)cccc3[N+](=O)[O-])C2)n1 ZINC000432321502 948026350 /nfs/dbraw/zinc/02/63/50/948026350.db2.gz VEZPUAWDPVMFIW-CYBMUJFWSA-N 0 0 374.828 3.807 20 5 FHBDRN O=[N+]([O-])c1cccc2c(NC[C@H](c3ccco3)[NH+]3CCCC3)ccnc21 ZINC000432320913 948029503 /nfs/dbraw/zinc/02/95/03/948029503.db2.gz CHSPSDIVHVEOCT-QGZVFWFLSA-N 0 0 352.394 3.985 20 5 FHBDRN CC(C)[C@@H]1C[C@H](CNC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)CCO1 ZINC000459078205 948033882 /nfs/dbraw/zinc/03/38/82/948033882.db2.gz UIAFGYCSHBYCNH-PBHICJAKSA-N 0 0 363.458 3.580 20 5 FHBDRN CC(C)[C@H]1C[C@H](CNC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)CCO1 ZINC000459079254 948036248 /nfs/dbraw/zinc/03/62/48/948036248.db2.gz UIAFGYCSHBYCNH-RHSMWYFYSA-N 0 0 363.458 3.580 20 5 FHBDRN COc1ccc(OCCCC(=O)Nc2cc([N+](=O)[O-])c(F)cc2F)cc1 ZINC000066960845 948040292 /nfs/dbraw/zinc/04/02/92/948040292.db2.gz QQHQJMZBXMKYOA-UHFFFAOYSA-N 0 0 366.320 3.679 20 5 FHBDRN CCCC(=O)Nc1ccc(C(=O)COc2cc(F)ccc2[N+](=O)[O-])cc1 ZINC000005216249 948043131 /nfs/dbraw/zinc/04/31/31/948043131.db2.gz MVCLWSHCUDMXHD-UHFFFAOYSA-N 0 0 360.341 3.734 20 5 FHBDRN O=[N+]([O-])c1ccccc1NCCc1nc([C@@H]2C[C@H]2c2ccccc2)no1 ZINC000511985788 948049048 /nfs/dbraw/zinc/04/90/48/948049048.db2.gz CSXQABPBIHQSBX-LSDHHAIUSA-N 0 0 350.378 3.904 20 5 FHBDRN Cc1ccc2cccc(OS(=O)(=O)c3cccc([N+](=O)[O-])c3C)c2n1 ZINC000027946726 948076284 /nfs/dbraw/zinc/07/62/84/948076284.db2.gz HVDFZBSNHVNOJL-UHFFFAOYSA-N 0 0 358.375 3.528 20 5 FHBDRN O=C(c1ccncc1F)N(Cc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000075352133 948078351 /nfs/dbraw/zinc/07/83/51/948078351.db2.gz JWVFFGXRAXSLGX-UHFFFAOYSA-N 0 0 351.337 3.976 20 5 FHBDRN O=C(Nc1ccccc1NC(=O)c1ccccc1)c1ccc([N+](=O)[O-])o1 ZINC000025879689 948080362 /nfs/dbraw/zinc/08/03/62/948080362.db2.gz LSEWMWFHBDPLGY-UHFFFAOYSA-N 0 0 351.318 3.692 20 5 FHBDRN COc1cccc([C@H](CNc2ccnc3c2cccc3[N+](=O)[O-])[NH+](C)C)c1 ZINC000432332532 948122881 /nfs/dbraw/zinc/12/28/81/948122881.db2.gz ZBUZAORTHIEVHJ-IBGZPJMESA-N 0 0 366.421 3.866 20 5 FHBDRN Cc1ccc(CCC(=O)O[C@@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)cc1 ZINC000759945963 948130173 /nfs/dbraw/zinc/13/01/73/948130173.db2.gz ULYTYCMJJYJALY-IAGOWNOFSA-N 0 0 357.410 3.759 20 5 FHBDRN COc1cc(C(=O)N[C@@H]2CCC[C@@H](C)[C@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000585690207 948138987 /nfs/dbraw/zinc/13/89/87/948138987.db2.gz RTXGCTULSSTJJM-CKYFFXLPSA-N 0 0 372.368 3.759 20 5 FHBDRN O=[N+]([O-])c1cccc(Cl)c1N1CCN(c2ncccc2Cl)CC1 ZINC000432333947 948145309 /nfs/dbraw/zinc/14/53/09/948145309.db2.gz DXIUYPZQOHZWEQ-UHFFFAOYSA-N 0 0 353.209 3.623 20 5 FHBDRN O=[N+]([O-])c1cccc2c(NCc3cccnc3OCC(F)F)ccnc21 ZINC000432337049 948155217 /nfs/dbraw/zinc/15/52/17/948155217.db2.gz QNNDWTRHNUWHTR-UHFFFAOYSA-N 0 0 360.320 3.794 20 5 FHBDRN Cc1ccc(NCCCNC(=O)c2ccc(C(C)(C)C)cn2)c([N+](=O)[O-])c1 ZINC001126295729 948182925 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CCNc1ccc(C(=O)Nc2cc(C)nn2-c2ccccc2)cc1[N+](=O)[O-] ZINC000585712066 948228845 /nfs/dbraw/zinc/22/88/45/948228845.db2.gz CHPYWRDBPJJXAA-UHFFFAOYSA-N 0 0 365.393 3.773 20 5 FHBDRN CCN(CCOc1ccc(OC)cc1[N+](=O)[O-])Cc1c(F)cccc1F ZINC000441545490 948242729 /nfs/dbraw/zinc/24/27/29/948242729.db2.gz LEWDPKZHGNYNCZ-UHFFFAOYSA-N 0 0 366.364 3.783 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)NC[C@@](C)(O)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000759953482 948247999 /nfs/dbraw/zinc/24/79/99/948247999.db2.gz DKJSPCWCRCGYBS-HXUWFJFHSA-N 0 0 374.412 3.669 20 5 FHBDRN CN(C[C@H]1OCCc2ccccc21)C(=O)C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000550420423 948248234 /nfs/dbraw/zinc/24/82/34/948248234.db2.gz SZRVMTJESFICSN-LJQANCHMSA-N 0 0 368.433 3.645 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N(Cc1ccncc1)C1CC1 ZINC000184704572 948254515 /nfs/dbraw/zinc/25/45/15/948254515.db2.gz WKRLOWNUKWVVNI-KRWDZBQOSA-N 0 0 353.422 3.750 20 5 FHBDRN Cc1ccccc1OCC(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000585750446 948257810 /nfs/dbraw/zinc/25/78/10/948257810.db2.gz XVIUPXCRXXTVGL-UHFFFAOYSA-N 0 0 365.183 3.683 20 5 FHBDRN CC(C)C[C@H](C)OCCC(=O)O[C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000759954167 948270345 /nfs/dbraw/zinc/27/03/45/948270345.db2.gz YEANKCPULJEJOA-XHSDSOJGSA-N 0 0 367.446 3.660 20 5 FHBDRN CCCN(CC1CCCCC1)C(=O)COc1ccc([N+](=O)[O-])c(OC)c1 ZINC000520552303 948274055 /nfs/dbraw/zinc/27/40/55/948274055.db2.gz JBZVLGHCAZWFRI-UHFFFAOYSA-N 0 0 364.442 3.801 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC(C)(C)O[C@@H]2CCC[C@H]21 ZINC000441566018 948274131 /nfs/dbraw/zinc/27/41/31/948274131.db2.gz BLXZWXXFJMGZEL-HUUCEWRRSA-N 0 0 364.467 3.879 20 5 FHBDRN CCC(CC)[C@@H](NC(=O)c1nn(CC)cc1[N+](=O)[O-])c1cccs1 ZINC000427596824 948279224 /nfs/dbraw/zinc/27/92/24/948279224.db2.gz NZQDKZVERQWWHE-CQSZACIVSA-N 0 0 350.444 3.780 20 5 FHBDRN COc1cc(N2CCC[C@@H]2[C@@H]2CCCC[C@]2(C)O)c(F)cc1[N+](=O)[O-] ZINC000585788730 948295338 /nfs/dbraw/zinc/29/53/38/948295338.db2.gz KEWUPOGHHDMELK-WRSAYESZSA-N 0 0 352.406 3.653 20 5 FHBDRN C[C@H](OCc1ccccc1)C(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000184733692 948314137 /nfs/dbraw/zinc/31/41/37/948314137.db2.gz UGVYFXXFHKNDLI-INIZCTEOSA-N 0 0 356.422 3.639 20 5 FHBDRN Cc1cc(NC(=O)CCC(C)(C)[N+](=O)[O-])ccc1NC(=O)c1ccco1 ZINC000294460179 948316241 /nfs/dbraw/zinc/31/62/41/948316241.db2.gz HZYJFKQVLOSTTK-UHFFFAOYSA-N 0 0 359.382 3.614 20 5 FHBDRN CC1(C)CN(C(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])[C@@H]2CCC[C@H]2O1 ZINC000441593799 948319175 /nfs/dbraw/zinc/31/91/75/948319175.db2.gz CNLKZZZOOQDLNB-TZMCWYRMSA-N 0 0 372.343 3.786 20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])Nc1cc(Cl)cc(F)c1F ZINC000441602730 948345372 /nfs/dbraw/zinc/34/53/72/948345372.db2.gz XBLCIUJOMBEENW-UHFFFAOYSA-N 0 0 355.728 3.967 20 5 FHBDRN COc1cc2c(cc1F)CC[C@H]2NC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000512087883 948391563 /nfs/dbraw/zinc/39/15/63/948391563.db2.gz HCTCNFYVYCEITI-APPDUMDISA-N 0 0 373.384 3.790 20 5 FHBDRN COc1ccc(OCCN2C[C@H]3CCC(=O)c4cccc2c43)c([N+](=O)[O-])c1 ZINC000184772513 948395443 /nfs/dbraw/zinc/39/54/43/948395443.db2.gz XZINXKCSMSRYAS-CYBMUJFWSA-N 0 0 368.389 3.563 20 5 FHBDRN COC(=O)[C@H](NCc1cccc([N+](=O)[O-])c1)c1ccc2ccccc2c1 ZINC000125981522 948395809 /nfs/dbraw/zinc/39/58/09/948395809.db2.gz CVNMMDNHJKEEBS-LJQANCHMSA-N 0 0 350.374 3.752 20 5 FHBDRN CCn1ccnc1[C@H]1CCCCN1C(=O)Nc1ccc(OC)c([N+](=O)[O-])c1 ZINC000432430949 948403458 /nfs/dbraw/zinc/40/34/58/948403458.db2.gz UYAPDOSMUCZZQW-CQSZACIVSA-N 0 0 373.413 3.579 20 5 FHBDRN COCc1ccc([C@@H]2CCCN2C(=O)c2c[nH]c3ccc([N+](=O)[O-])cc32)o1 ZINC000137512908 948405000 /nfs/dbraw/zinc/40/50/00/948405000.db2.gz JTVOOTYSDHUTSD-KRWDZBQOSA-N 0 0 369.377 3.793 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[C@H](c2ccc(F)cc2)C1 ZINC000432431552 948406457 /nfs/dbraw/zinc/40/64/57/948406457.db2.gz WRVKLFHWLKTGTN-ZDUSSCGKSA-N 0 0 359.357 3.764 20 5 FHBDRN O=[N+]([O-])c1ccc(CSc2cccc(Cl)c2-c2nn[nH]n2)c(F)c1 ZINC000826497981 948413258 /nfs/dbraw/zinc/41/32/58/948413258.db2.gz BNPAVOJVJDURQT-UHFFFAOYSA-N 0 0 365.777 3.860 20 5 FHBDRN C[C@H](NC(=O)[C@@H]1C[C@@H]1c1cc(F)c(F)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000184774302 948426242 /nfs/dbraw/zinc/42/62/42/948426242.db2.gz NUJYVILWAHAFAT-CUOATXAZSA-N 0 0 364.323 3.993 20 5 FHBDRN CC[C@H](c1ccccc1)N(CC(=O)OC)Cc1c(F)cccc1[N+](=O)[O-] ZINC000432443991 948436847 /nfs/dbraw/zinc/43/68/47/948436847.db2.gz MSOYYNBSYMIKIN-QGZVFWFLSA-N 0 0 360.385 3.860 20 5 FHBDRN COC(=O)[C@H](NCc1csc([N+](=O)[O-])c1)c1ccc2ccccc2c1 ZINC000125985539 948454297 /nfs/dbraw/zinc/45/42/97/948454297.db2.gz MMWXDVVLXURTPA-QGZVFWFLSA-N 0 0 356.403 3.813 20 5 FHBDRN CC(C)(C(=O)N[C@@H]1CCCc2cc(N)ccc21)c1ccc([N+](=O)[O-])cc1 ZINC000427611276 948477365 /nfs/dbraw/zinc/47/73/65/948477365.db2.gz FGYGPWCLSFBSLG-GOSISDBHSA-N 0 0 353.422 3.648 20 5 FHBDRN COCc1cc([N+](=O)[O-])ccc1N[C@H](C)Cc1ccc(OC)c(OC)c1 ZINC000570982494 948505404 /nfs/dbraw/zinc/50/54/04/948505404.db2.gz WFXQPVZXLUOYQS-CYBMUJFWSA-N 0 0 360.410 3.802 20 5 FHBDRN C[C@H](CNC(=O)Cc1ccc(F)cc1[N+](=O)[O-])Oc1ccccc1Cl 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O=[N+]([O-])c1cc(CSc2nccc(C(F)(F)F)n2)c2c(c1)COCO2 ZINC000105591363 209267440 /nfs/dbraw/zinc/26/74/40/209267440.db2.gz ALRWMIXXSUUXAE-UHFFFAOYSA-N 0 0 373.312 3.562 20 5 FHBDRN Cc1cc(C(=O)N2CCc3ccc([N+](=O)[O-])cc32)c(C)n1-c1nccs1 ZINC000097285982 209177026 /nfs/dbraw/zinc/17/70/26/209177026.db2.gz SOFXXANVXRHXAT-UHFFFAOYSA-N 0 0 368.418 3.662 20 5 FHBDRN COc1ccc(OCC(=O)Nc2c(Cl)cccc2Cl)c([N+](=O)[O-])c1 ZINC000005051644 206688842 /nfs/dbraw/zinc/68/88/42/206688842.db2.gz JWASHICUIJIPMF-UHFFFAOYSA-N 0 0 371.176 3.928 20 5 FHBDRN COc1ccc(NC(=O)COc2cc(Cl)cc(Cl)c2)c([N+](=O)[O-])c1 ZINC000005038449 206688876 /nfs/dbraw/zinc/68/88/76/206688876.db2.gz PAILBVPLJOBDAL-UHFFFAOYSA-N 0 0 371.176 3.928 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CSc1ccccc1Cl ZINC000005638072 206692071 /nfs/dbraw/zinc/69/20/71/206692071.db2.gz UGRBWOFJTVATNK-UHFFFAOYSA-N 0 0 352.799 3.988 20 5 FHBDRN COc1ccc(OCC(=O)Nc2ccc(Cl)cc2C)c([N+](=O)[O-])c1 ZINC000005050654 207076858 /nfs/dbraw/zinc/07/68/58/207076858.db2.gz 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ZINC000022494545 207810599 /nfs/dbraw/zinc/81/05/99/207810599.db2.gz OIIPENVWHVSGKA-HXUWFJFHSA-N 0 0 367.405 3.685 20 5 FHBDRN Cc1sc2nc(SCc3cccc([N+](=O)[O-])c3)n(C)c(=O)c2c1C ZINC000025023952 207882732 /nfs/dbraw/zinc/88/27/32/207882732.db2.gz BTBXFLGBVIFHPD-UHFFFAOYSA-N 0 0 361.448 3.812 20 5 FHBDRN Cc1c(C(=O)Nc2ccc(C(=O)NC(C)(C)C)cc2)cccc1[N+](=O)[O-] ZINC000031070672 208010824 /nfs/dbraw/zinc/01/08/24/208010824.db2.gz CMKQCMUUBZZFQM-UHFFFAOYSA-N 0 0 355.394 3.684 20 5 FHBDRN Cc1cccc(C(=O)N[C@@H](C)c2ccc(NC(=O)C3CC3)cc2)c1[N+](=O)[O-] ZINC000031393117 208012882 /nfs/dbraw/zinc/01/28/82/208012882.db2.gz PJBNPPURXGYFTA-ZDUSSCGKSA-N 0 0 367.405 3.743 20 5 FHBDRN O=C(Nc1ccc(F)cc1Cl)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000033147506 208074336 /nfs/dbraw/zinc/07/43/36/208074336.db2.gz MTZMADSNESETNT-UHFFFAOYSA-N 0 0 360.732 3.825 20 5 FHBDRN C[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000078794781 208203609 /nfs/dbraw/zinc/20/36/09/208203609.db2.gz 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COC(=O)c1ccc(COc2ccc([N+](=O)[O-])cc2C(F)(F)F)cc1 ZINC000072033645 208793956 /nfs/dbraw/zinc/79/39/56/208793956.db2.gz VPVHHWGNPKFKAY-UHFFFAOYSA-N 0 0 355.268 3.979 20 5 FHBDRN Cc1cc(Oc2ncccn2)ccc1NC(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000072039809 208794457 /nfs/dbraw/zinc/79/44/57/208794457.db2.gz RXNOVKCGTVYEIU-UHFFFAOYSA-N 0 0 364.361 3.667 20 5 FHBDRN O=C(Nc1cc(F)c(F)cc1F)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000078508592 208927257 /nfs/dbraw/zinc/92/72/57/208927257.db2.gz XENJFXOYPQHZFG-UHFFFAOYSA-N 0 0 365.311 3.865 20 5 FHBDRN Cc1ccc2oc(C(=O)N3CCN(c4ccc([N+](=O)[O-])cc4)CC3)cc2c1 ZINC000108469726 132243373 /nfs/dbraw/zinc/24/33/73/132243373.db2.gz VWHOYFWFJDJWET-UHFFFAOYSA-N 0 0 365.389 3.612 20 5 FHBDRN Cc1cc(C(=O)N2CCN(c3ccccc3Cl)CC2)ccc1[N+](=O)[O-] ZINC000007955704 132305137 /nfs/dbraw/zinc/30/51/37/132305137.db2.gz FQCHMPLDKOMTMZ-UHFFFAOYSA-N 0 0 359.813 3.519 20 5 FHBDRN CCC[C@H](C(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1)c1ccccc1 ZINC000068761877 535577285 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FHBDRN O=C(COc1ccc(F)cc1)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452876789 567853133 /nfs/dbraw/zinc/85/31/33/567853133.db2.gz LURDMWUGKKPYSD-HNNXBMFYSA-N 0 0 358.369 3.519 20 5 FHBDRN CC(C)c1nc(CSc2ccc([N+](=O)[O-])c(S(C)(=O)=O)c2)cs1 ZINC000155553520 567873277 /nfs/dbraw/zinc/87/32/77/567873277.db2.gz ZOPQHGWVAYJGIK-UHFFFAOYSA-N 0 0 372.493 3.871 20 5 FHBDRN CCO[C@@H]1CCN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])C[C@@H]1C ZINC000452875743 567874205 /nfs/dbraw/zinc/87/42/05/567874205.db2.gz SNMIQPQPNVKVTN-IINYFYTJSA-N 0 0 360.332 3.501 20 5 FHBDRN COc1ccc(CN(Cc2cccs2)C[C@@H]2CCCO2)cc1[N+](=O)[O-] ZINC000051429686 567879054 /nfs/dbraw/zinc/87/90/54/567879054.db2.gz ZTKXMZHFEFJQIK-HNNXBMFYSA-N 0 0 362.451 3.846 20 5 FHBDRN CC[C@@H](CNC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)CC(F)(F)F ZINC000412639241 567881929 /nfs/dbraw/zinc/88/19/29/567881929.db2.gz RXRAOUDTAPTRMH-MRVPVSSYSA-N 0 0 370.274 3.905 20 5 FHBDRN CN(C)c1ccc(C(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000452889793 567886187 /nfs/dbraw/zinc/88/61/87/567886187.db2.gz UDELEOJCSGYFRB-QGZVFWFLSA-N 0 0 353.422 3.681 20 5 FHBDRN CCCN1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)c2ccc(F)cc21 ZINC000481407340 567904869 /nfs/dbraw/zinc/90/48/69/567904869.db2.gz TVKAPWBOGIDODM-UHFFFAOYSA-N 0 0 357.385 3.540 20 5 FHBDRN O=[N+]([O-])c1ccc(SC[C@H](O)CO[C@H]2CCCc3ccccc32)nc1 ZINC000159187665 567906399 /nfs/dbraw/zinc/90/63/99/567906399.db2.gz ZYIXJZABAWCNMO-WBVHZDCISA-N 0 0 360.435 3.537 20 5 FHBDRN CC(C)[C@@H]1C[C@H](CNC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)CCO1 ZINC000452898208 567910887 /nfs/dbraw/zinc/91/08/87/567910887.db2.gz SBSLMRFIHMNQCR-VBQJREDUSA-N 0 0 366.483 3.643 20 5 FHBDRN COC(=O)c1ccc([C@H](NCc2cccc([N+](=O)[O-])c2)C(F)(F)F)cc1 ZINC000481419322 567914280 /nfs/dbraw/zinc/91/42/80/567914280.db2.gz VYOLHUDEVQLWGY-HNNXBMFYSA-N 0 0 368.311 3.775 20 5 FHBDRN O=C(c1ccc(Cl)cc1O)N1CCS[C@@H]1c1ccc([N+](=O)[O-])cc1 ZINC000436586618 567946656 /nfs/dbraw/zinc/94/66/56/567946656.db2.gz BVSSHKJWWKZCAO-MRXNPFEDSA-N 0 0 364.810 3.842 20 5 FHBDRN COC(=O)[C@H](Cc1ccc(Cl)cc1)Sc1ncccc1[N+](=O)[O-] ZINC000541835491 567954526 /nfs/dbraw/zinc/95/45/26/567954526.db2.gz VCTFFCGEZXBPAJ-ZDUSSCGKSA-N 0 0 352.799 3.520 20 5 FHBDRN Cc1cnn([C@H]2CCN(Cc3csc(-c4cccc([N+](=O)[O-])c4)n3)C2)c1 ZINC000291013578 567955756 /nfs/dbraw/zinc/95/57/56/567955756.db2.gz XBZPVKQVARZTCZ-KRWDZBQOSA-N 0 0 369.450 3.670 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)N(Cc1cccs1)[C@@H]1C=C[C@H](CO)C1 ZINC000481458851 567957910 /nfs/dbraw/zinc/95/79/10/567957910.db2.gz JQLHTEXTYQZQCT-XJKSGUPXSA-N 0 0 373.434 3.627 20 5 FHBDRN CC(=O)c1ccc(OCCCC(=O)NCc2cccc([N+](=O)[O-])c2C)cc1 ZINC000481472442 567964259 /nfs/dbraw/zinc/96/42/59/567964259.db2.gz KEXHREKPOKGBNB-UHFFFAOYSA-N 0 0 370.405 3.581 20 5 FHBDRN Cc1noc([C@@H]2CCCN(c3cc(C)nc4c3cccc4[N+](=O)[O-])C2)n1 ZINC000302031611 567964615 /nfs/dbraw/zinc/96/46/15/567964615.db2.gz SFSOIPFUHMAMPM-CYBMUJFWSA-N 0 0 353.382 3.527 20 5 FHBDRN Cc1c(CNC(=O)[C@H](C)Oc2ccc(F)cc2Cl)cccc1[N+](=O)[O-] ZINC000481465437 567965787 /nfs/dbraw/zinc/96/57/87/567965787.db2.gz JYFUXTQZYVLILF-NSHDSACASA-N 0 0 366.776 3.779 20 5 FHBDRN COc1ccc(SCCC(=O)NCc2cccc([N+](=O)[O-])c2C)cc1 ZINC000481467537 567970241 /nfs/dbraw/zinc/97/02/41/567970241.db2.gz PIMUWIGONHQLCZ-UHFFFAOYSA-N 0 0 360.435 3.710 20 5 FHBDRN Cc1c(CNC(=O)COc2c(Cl)cccc2Cl)cccc1[N+](=O)[O-] ZINC000481466177 567970270 /nfs/dbraw/zinc/97/02/70/567970270.db2.gz MGGZHDOTGBESRO-UHFFFAOYSA-N 0 0 369.204 3.905 20 5 FHBDRN CCOc1ccccc1OCCCC(=O)NCc1cccc([N+](=O)[O-])c1C ZINC000481466159 567970316 /nfs/dbraw/zinc/97/03/16/567970316.db2.gz QIPMIPGABRWPLV-UHFFFAOYSA-N 0 0 372.421 3.777 20 5 FHBDRN CC(C)(CCc1noc([C@@H]2C[C@H]2c2cc(F)c(F)c(F)c2)n1)[N+](=O)[O-] ZINC000291030666 567971158 /nfs/dbraw/zinc/97/11/58/567971158.db2.gz DYIGPUYNHFISJR-VHSXEESVSA-N 0 0 355.316 3.746 20 5 FHBDRN Cc1cc(C(=O)CCC(=O)NCc2cccc([N+](=O)[O-])c2C)c(C)s1 ZINC000481474694 567971894 /nfs/dbraw/zinc/97/18/94/567971894.db2.gz QXLJUSUJGNRMMV-UHFFFAOYSA-N 0 0 360.435 3.861 20 5 FHBDRN CSCCCN(C(=O)Cc1cccc([N+](=O)[O-])c1C)c1cccnc1 ZINC000602370554 567973537 /nfs/dbraw/zinc/97/35/37/567973537.db2.gz QFBOTFBQGUWORT-UHFFFAOYSA-N 0 0 359.451 3.627 20 5 FHBDRN Cc1ccc(-c2nc(C(=O)NCc3cccc([N+](=O)[O-])c3C)cs2)n1C ZINC000481481751 567980992 /nfs/dbraw/zinc/98/09/92/567980992.db2.gz PMRIANKXAMPFLO-UHFFFAOYSA-N 0 0 370.434 3.604 20 5 FHBDRN Cc1c(CNC(=O)c2ccc(N3CCCCCC3)nc2)cccc1[N+](=O)[O-] ZINC000481485596 567988390 /nfs/dbraw/zinc/98/83/90/567988390.db2.gz VXHGQIPPLFDNKZ-UHFFFAOYSA-N 0 0 368.437 3.609 20 5 FHBDRN CCOc1cccc2[nH]cc(CC(=O)NCc3cccc([N+](=O)[O-])c3C)c21 ZINC000481488774 567989509 /nfs/dbraw/zinc/98/95/09/567989509.db2.gz GCKMNOWNGFNTTC-UHFFFAOYSA-N 0 0 367.405 3.642 20 5 FHBDRN CCOc1ccc(OCCCC(=O)NCc2cccc([N+](=O)[O-])c2C)cc1 ZINC000481493752 567998347 /nfs/dbraw/zinc/99/83/47/567998347.db2.gz PXNDXXQJFUKGKW-UHFFFAOYSA-N 0 0 372.421 3.777 20 5 FHBDRN Cc1ccc(CN(C)Cc2cc(Br)c([N+](=O)[O-])s2)nc1 ZINC000602641429 568002946 /nfs/dbraw/zinc/00/29/46/568002946.db2.gz FESQVNPUDMHXSA-UHFFFAOYSA-N 0 0 356.245 3.754 20 5 FHBDRN O=[N+]([O-])c1ccc2oc(CNCc3c(F)cccc3N3CCCC3)nc2c1 ZINC000602649427 568004805 /nfs/dbraw/zinc/00/48/05/568004805.db2.gz HOPIUUAQEUPNSW-UHFFFAOYSA-N 0 0 370.384 3.765 20 5 FHBDRN CCc1cc(NC(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)ccc1C ZINC000481497370 568006256 /nfs/dbraw/zinc/00/62/56/568006256.db2.gz QHUOMAOCOOMDAW-UHFFFAOYSA-N 0 0 368.437 3.820 20 5 FHBDRN Cc1oc(-c2ccsc2)nc1Cc1nc(CCC(C)(C)[N+](=O)[O-])no1 ZINC000291074913 568012264 /nfs/dbraw/zinc/01/22/64/568012264.db2.gz MKKPYYLSIMQYOI-UHFFFAOYSA-N 0 0 362.411 3.673 20 5 FHBDRN Cc1ccc([C@H]2C[C@@H](C)CCN2Cc2ccc(C(N)=O)cc2[N+](=O)[O-])o1 ZINC000072895890 568015005 /nfs/dbraw/zinc/01/50/05/568015005.db2.gz DAZMOFQMXMNIRV-YVEFUNNKSA-N 0 0 357.410 3.568 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(Cl)c1N1CCCN(CC(F)(F)F)CC1 ZINC000302703447 568022394 /nfs/dbraw/zinc/02/23/94/568022394.db2.gz VMRAGLQCGRPTQR-UHFFFAOYSA-N 0 0 351.756 3.631 20 5 FHBDRN CN(C(=O)c1cc(-c2ccccn2)ccc1Cl)c1ccc([N+](=O)[O-])nc1 ZINC000568322137 568024172 /nfs/dbraw/zinc/02/41/72/568024172.db2.gz POIHOTNZFSPRTP-UHFFFAOYSA-N 0 0 368.780 3.982 20 5 FHBDRN COc1cc(CN[C@H](C)c2cnc(C)s2)c([N+](=O)[O-])cc1OC(F)F ZINC000602958360 568029552 /nfs/dbraw/zinc/02/95/52/568029552.db2.gz XGCGXSDSYBLOAP-MRVPVSSYSA-N 0 0 373.381 3.821 20 5 FHBDRN COc1cc(CN[C@@H](C)c2cnc(C)s2)c([N+](=O)[O-])cc1OC(F)F ZINC000602958370 568029556 /nfs/dbraw/zinc/02/95/56/568029556.db2.gz XGCGXSDSYBLOAP-QMMMGPOBSA-N 0 0 373.381 3.821 20 5 FHBDRN Cc1cc(Cc2noc(-c3ccccc3-n3cccn3)n2)ccc1[N+](=O)[O-] ZINC000568445579 568038664 /nfs/dbraw/zinc/03/86/64/568038664.db2.gz PRQNTVZZTZHHRR-UHFFFAOYSA-N 0 0 361.361 3.730 20 5 FHBDRN Cc1[nH]c2ccc(CNC(=O)NCc3ccccc3[N+](=O)[O-])cc2c1C ZINC000065031261 568041894 /nfs/dbraw/zinc/04/18/94/568041894.db2.gz WTJDGWGHRFJPEV-UHFFFAOYSA-N 0 0 352.394 3.692 20 5 FHBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])Nc1cc(F)cc(F)c1 ZINC000481556977 568047105 /nfs/dbraw/zinc/04/71/05/568047105.db2.gz UMLQNYHUOLAKTD-UHFFFAOYSA-N 0 0 355.728 3.891 20 5 FHBDRN C[C@H](c1ccc2ccccc2c1)N(C(=O)c1cc([N+](=O)[O-])nn1C)C1CC1 ZINC000481561801 568047215 /nfs/dbraw/zinc/04/72/15/568047215.db2.gz ZHASTKJZWCBFEL-CYBMUJFWSA-N 0 0 364.405 3.847 20 5 FHBDRN Cc1ccccc1OCCCNC(=O)C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000568538302 568048576 /nfs/dbraw/zinc/04/85/76/568048576.db2.gz IPMFCCNQGGLKHG-UHFFFAOYSA-N 0 0 356.422 3.766 20 5 FHBDRN CCOC(=O)c1ccc(NC(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)cn1 ZINC000128578490 568049406 /nfs/dbraw/zinc/04/94/06/568049406.db2.gz FVMJYHZARSDKOC-UHFFFAOYSA-N 0 0 371.393 3.716 20 5 FHBDRN O=[N+]([O-])c1ccc(CNCc2c(F)ccc(C3OCCO3)c2Cl)cc1 ZINC000291095300 568049717 /nfs/dbraw/zinc/04/97/17/568049717.db2.gz IKPSACZEKMHSKZ-UHFFFAOYSA-N 0 0 366.776 3.723 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1N1CC2(CCC2)[C@@H]1[C@@H]1CCCO1 ZINC000408223954 568050260 /nfs/dbraw/zinc/05/02/60/568050260.db2.gz FUZOOPSLGHXUQB-GJZGRUSLSA-N 0 0 367.243 3.895 20 5 FHBDRN CCc1ccc([C@@H](CO)NCc2coc(-c3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000568552012 568050498 /nfs/dbraw/zinc/05/04/98/568050498.db2.gz RECQEIVQRVHMJZ-LJQANCHMSA-N 0 0 367.405 3.635 20 5 FHBDRN C[C@H](C(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1)c1ccc2c(c1)OCO2 ZINC000481545633 568050756 /nfs/dbraw/zinc/05/07/56/568050756.db2.gz PMTSIJOVFSKAAM-ZDUSSCGKSA-N 0 0 368.389 3.618 20 5 FHBDRN COc1c(-c2nc(Cc3c[nH]c4cc(F)ccc34)no2)cccc1[N+](=O)[O-] ZINC000568562672 568051638 /nfs/dbraw/zinc/05/16/38/568051638.db2.gz UDTQSZWLHFQOIJ-UHFFFAOYSA-N 0 0 368.324 3.865 20 5 FHBDRN COC(=O)c1cc(NC(=O)c2cccc([N+](=O)[O-])c2C)cc(Cl)c1F ZINC000481588113 568063484 /nfs/dbraw/zinc/06/34/84/568063484.db2.gz SLNWBRZVDIMEOJ-UHFFFAOYSA-N 0 0 366.732 3.735 20 5 FHBDRN C[C@H](C(=O)NC[C@H]1CCC2(CCCCC2)O1)c1ccc([N+](=O)[O-])cc1F ZINC000481634110 568075242 /nfs/dbraw/zinc/07/52/42/568075242.db2.gz PMYKTXQMOPBPCA-DZGCQCFKSA-N 0 0 364.417 3.836 20 5 FHBDRN C[C@@H]1CCC[N@H+](Cc2ccc(NC(=O)c3ccc([N+](=O)[O-])c([O-])c3)cc2)C1 ZINC000541891794 568076158 /nfs/dbraw/zinc/07/61/58/568076158.db2.gz VSKLPYHERGCJEH-CQSZACIVSA-N 0 0 369.421 3.785 20 5 FHBDRN CC(C)C[C@@H](NC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)c1ccccc1 ZINC000481654731 568082082 /nfs/dbraw/zinc/08/20/82/568082082.db2.gz HUWGYBNHVMCLMS-QGZVFWFLSA-N 0 0 352.394 3.988 20 5 FHBDRN O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1cc(F)c(F)cc1F ZINC000128628913 568092617 /nfs/dbraw/zinc/09/26/17/568092617.db2.gz IANXBSAMUMCFLN-UHFFFAOYSA-N 0 0 362.210 3.866 20 5 FHBDRN C[C@H](NC(=O)N[C@@H]1CCOc2ccc(F)cc21)c1cccc([N+](=O)[O-])c1 ZINC000069080979 568093757 /nfs/dbraw/zinc/09/37/57/568093757.db2.gz PYYPFAUDMPYSPM-MEDUHNTESA-N 0 0 359.357 3.618 20 5 FHBDRN Cc1c(CC(=O)N2CCC[C@H]2C[C@H](O)c2cccs2)cccc1[N+](=O)[O-] ZINC000128639024 568097190 /nfs/dbraw/zinc/09/71/90/568097190.db2.gz PZQDOIPWUKYQMI-RDJZCZTQSA-N 0 0 374.462 3.622 20 5 FHBDRN Cc1cc([C@@H]2CCCN2C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)no1 ZINC000043331170 568114958 /nfs/dbraw/zinc/11/49/58/568114958.db2.gz TWWWMRXJASZULR-ZDUSSCGKSA-N 0 0 350.762 3.914 20 5 FHBDRN CCc1nn(C)c(Sc2cc(Br)ccc2OC)c1[N+](=O)[O-] ZINC000568686981 568122749 /nfs/dbraw/zinc/12/27/49/568122749.db2.gz KCOZWTAKMGWCRC-UHFFFAOYSA-N 0 0 372.244 3.813 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)NC[C@H]1CCO[C@H]1c1ccccc1 ZINC000568692208 568123760 /nfs/dbraw/zinc/12/37/60/568123760.db2.gz XUHRBMCXIITIAO-BEFAXECRSA-N 0 0 372.446 3.581 20 5 FHBDRN C[C@H](CCc1ccccc1)NC(=O)N1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000568692560 568123828 /nfs/dbraw/zinc/12/38/28/568123828.db2.gz YZOFGRADPSIJNC-OAHLLOKOSA-N 0 0 369.421 3.520 20 5 FHBDRN COCCCCc1cccnc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000291373605 568126786 /nfs/dbraw/zinc/12/67/86/568126786.db2.gz ZMUFGGJBODZYHW-UHFFFAOYSA-N 0 0 363.801 3.865 20 5 FHBDRN CCc1ccc([C@@H]2CCN(C(=O)c3cccc(OC)c3[N+](=O)[O-])C2)cc1 ZINC000584672948 568131213 /nfs/dbraw/zinc/13/12/13/568131213.db2.gz SMGBDNNKHSWSRE-MRXNPFEDSA-N 0 0 354.406 3.796 20 5 FHBDRN O=C1COc2c(N[C@@H]3CCC[C@@H]3Cc3ccccc3[N+](=O)[O-])cccc2N1 ZINC000568699675 568131876 /nfs/dbraw/zinc/13/18/76/568131876.db2.gz CAIUBZJVNBIEMT-UKRRQHHQSA-N 0 0 367.405 3.749 20 5 FHBDRN CC1(C)C[C@H](Nc2ccc(C(N)=O)cc2[N+](=O)[O-])c2ccc(F)cc2O1 ZINC000481810717 568131923 /nfs/dbraw/zinc/13/19/23/568131923.db2.gz AFOFIEIGYIXRTL-AWEZNQCLSA-N 0 0 359.357 3.547 20 5 FHBDRN CC[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)CCO1 ZINC000481831713 568138708 /nfs/dbraw/zinc/13/87/08/568138708.db2.gz VZOOAEGGLWHODB-HNNXBMFYSA-N 0 0 372.446 3.997 20 5 FHBDRN Cn1nc([N+](=O)[O-])cc1C(=O)N(Cc1ccc(Cl)cc1)c1ccccc1 ZINC000481876399 568140654 /nfs/dbraw/zinc/14/06/54/568140654.db2.gz UIVCGMLMBOVYMR-UHFFFAOYSA-N 0 0 370.796 3.829 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(COCCOC)cc1 ZINC000291420390 568141751 /nfs/dbraw/zinc/14/17/51/568141751.db2.gz KJTKQQWARLUYLW-UHFFFAOYSA-N 0 0 358.394 3.573 20 5 FHBDRN CC[C@@H]1c2ccsc2CCN1C(=O)COc1cc([N+](=O)[O-])ccc1C ZINC000603725914 568143198 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O=[N+]([O-])c1ccc(N2CCOC[C@H]2C2CCC2)nc1OCc1ccccc1 ZINC000568756063 568181398 /nfs/dbraw/zinc/18/13/98/568181398.db2.gz ICMGZORPOVTJPN-SFHVURJKSA-N 0 0 369.421 3.574 20 5 FHBDRN Cc1ccc2nc(NC(=O)CCOc3ccccc3[N+](=O)[O-])sc2c1 ZINC000603945436 568186168 /nfs/dbraw/zinc/18/61/68/568186168.db2.gz YOLUPNWASJUOBB-UHFFFAOYSA-N 0 0 357.391 3.921 20 5 FHBDRN C[S@@](=O)c1ccc(NC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000159357671 568186457 /nfs/dbraw/zinc/18/64/57/568186457.db2.gz UJSXJZKIBGXUGC-SANMLTNESA-N 0 0 373.434 3.529 20 5 FHBDRN COC(=O)c1cc(OCC(=O)Nc2cccc(C(C)C)c2)ccc1[N+](=O)[O-] ZINC000481939265 568193948 /nfs/dbraw/zinc/19/39/48/568193948.db2.gz ASCVYJSTUFDXIP-UHFFFAOYSA-N 0 0 372.377 3.522 20 5 FHBDRN Cc1ccc(C(=O)CCCC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000568770682 568196298 /nfs/dbraw/zinc/19/62/98/568196298.db2.gz LFDNJKWFQUQZQX-UHFFFAOYSA-N 0 0 368.433 3.957 20 5 FHBDRN CCN(c1cccc(F)c1)S(=O)(=O)c1c(C)cc([N+](=O)[O-])cc1C ZINC000481957640 568196954 /nfs/dbraw/zinc/19/69/54/568196954.db2.gz GTCSOXBIXCCLPF-UHFFFAOYSA-N 0 0 352.387 3.566 20 5 FHBDRN CC(C)n1cc2c(n1)C[C@@H](Nc1ccc([N+](=O)[O-])c3cnccc13)CC2 ZINC000481966196 568200331 /nfs/dbraw/zinc/20/03/31/568200331.db2.gz GRSLLCDBTWUHJD-AWEZNQCLSA-N 0 0 351.410 3.890 20 5 FHBDRN CCCCN(CC(F)(F)F)S(=O)(=O)c1c(C)cc([N+](=O)[O-])cc1C ZINC000481978273 568210924 /nfs/dbraw/zinc/21/09/24/568210924.db2.gz CQEQTXPWQKURIZ-UHFFFAOYSA-N 0 0 368.377 3.565 20 5 FHBDRN CCOC(=O)c1cc(CC)sc1NC(=O)c1cc(F)cc([N+](=O)[O-])c1 ZINC000327538836 568216203 /nfs/dbraw/zinc/21/62/03/568216203.db2.gz VAFQWDFTFJXYAV-UHFFFAOYSA-N 0 0 366.370 3.787 20 5 FHBDRN CC[C@@H](Cc1ccccc1)[N@H+](C)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000128722958 568220039 /nfs/dbraw/zinc/22/00/39/568220039.db2.gz UKOJBHLLZIDETK-SFHVURJKSA-N 0 0 356.422 3.914 20 5 FHBDRN Cc1ccc(CNc2nc(C)ccc2[N+](=O)[O-])c(OC[C@@H]2CCCO2)c1 ZINC000482007831 568226515 /nfs/dbraw/zinc/22/65/15/568226515.db2.gz PWFFLWAEPNZHPU-INIZCTEOSA-N 0 0 357.410 3.777 20 5 FHBDRN O=C(N[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1)c1ccc([N+](=O)[O-])cn1 ZINC000568832188 568231117 /nfs/dbraw/zinc/23/11/17/568231117.db2.gz TYQWRDWTYSYGIV-IINYFYTJSA-N 0 0 352.177 3.583 20 5 FHBDRN Cc1ccc(NC(=O)c2ccc(N[C@@H](C)[C@H]3CCOC3)c([N+](=O)[O-])c2)cc1 ZINC000541921399 568233777 /nfs/dbraw/zinc/23/37/77/568233777.db2.gz GNSPQNKWDWGGNH-HOCLYGCPSA-N 0 0 369.421 3.992 20 5 FHBDRN Cc1ccc(S(=O)(=O)NC2(c3ccc(Cl)cc3)CC2)c([N+](=O)[O-])c1 ZINC000482047067 568238337 /nfs/dbraw/zinc/23/83/37/568238337.db2.gz VVEIBOFVYLYYJC-UHFFFAOYSA-N 0 0 366.826 3.524 20 5 FHBDRN Cc1cnc([C@H](C)NC(=O)c2c([N+](=O)[O-])cccc2C(F)(F)F)s1 ZINC000568897052 568249619 /nfs/dbraw/zinc/24/96/19/568249619.db2.gz RTYKGAACICRELB-QMMMGPOBSA-N 0 0 359.329 3.870 20 5 FHBDRN COc1ccc(-c2nnc(Sc3nc(C)cc(C)c3[N+](=O)[O-])o2)cc1 ZINC000541932883 568250752 /nfs/dbraw/zinc/25/07/52/568250752.db2.gz DXOHULUCEMEONR-UHFFFAOYSA-N 0 0 358.379 3.816 20 5 FHBDRN Cc1ccc(CNc2nc(C)cc(C)c2[N+](=O)[O-])c(OC[C@@H]2CCOC2)c1 ZINC000541932689 568252722 /nfs/dbraw/zinc/25/27/22/568252722.db2.gz UQNKKEPRHUTBTQ-MRXNPFEDSA-N 0 0 371.437 3.942 20 5 FHBDRN Cc1ccc(C)c(N2CCN(C(=O)c3ccc(Cl)cc3[N+](=O)[O-])CC2)c1 ZINC000482065353 568253470 /nfs/dbraw/zinc/25/34/70/568253470.db2.gz KBMBPCOIHRBWHR-UHFFFAOYSA-N 0 0 373.840 3.827 20 5 FHBDRN Cc1ccc(SCC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)c(C)c1 ZINC000026468409 568253549 /nfs/dbraw/zinc/25/35/49/568253549.db2.gz QAYYFNIBUJEWSY-UHFFFAOYSA-N 0 0 360.391 3.671 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)c1cc(Cl)ccc1OC(F)F ZINC000482067189 568253550 /nfs/dbraw/zinc/25/35/50/568253550.db2.gz JCAQXPKENRZGJK-UHFFFAOYSA-N 0 0 370.739 3.822 20 5 FHBDRN O=C(NC1(c2ccccc2)CCC1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000049618076 568254339 /nfs/dbraw/zinc/25/43/39/568254339.db2.gz BQVYCTKLSISSJX-UHFFFAOYSA-N 0 0 362.389 3.590 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N2C[C@H](c3ccccc3)C3(CCC3)C2)c1[N+](=O)[O-] ZINC000412667114 568258075 /nfs/dbraw/zinc/25/80/75/568258075.db2.gz HGPKYPFETMWEBA-OAHLLOKOSA-N 0 0 368.437 3.851 20 5 FHBDRN CC(C)C[C@H]1C[C@H](NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)CCO1 ZINC000541938523 568258292 /nfs/dbraw/zinc/25/82/92/568258292.db2.gz FQFZVPBVWPHDDN-OLZOCXBDSA-N 0 0 372.368 3.520 20 5 FHBDRN C[C@@](NC(=O)Cc1ccc([N+](=O)[O-])cc1)(c1ccc(F)cc1)C(F)(F)F ZINC000541936851 568261712 /nfs/dbraw/zinc/26/17/12/568261712.db2.gz AGBWUJYFZDTUHL-MRXNPFEDSA-N 0 0 370.302 3.870 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(OCC(=O)N[C@@H](CC(C)C)c2ccccc2)n1 ZINC000541981556 568274620 /nfs/dbraw/zinc/27/46/20/568274620.db2.gz ROVYZTMUBNWKQY-KRWDZBQOSA-N 0 0 371.437 3.889 20 5 FHBDRN CC(C)(C)CCC1(O)CC(c2nc(-c3ccc(N)c([N+](=O)[O-])c3)no2)C1 ZINC000453052730 568274901 /nfs/dbraw/zinc/27/49/01/568274901.db2.gz MXGWAIFTIDTMPL-UHFFFAOYSA-N 0 0 360.414 3.662 20 5 FHBDRN CCOC1CC(C(=O)N(Cc2ccc([N+](=O)[O-])cc2)c2ccccc2)C1 ZINC000569029655 568275773 /nfs/dbraw/zinc/27/57/73/568275773.db2.gz APDNQKHPZBJSGH-UHFFFAOYSA-N 0 0 354.406 3.943 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N2CC(C)(C)[C@H]2c2ccccc2)c1C ZINC000604374182 568276866 /nfs/dbraw/zinc/27/68/66/568276866.db2.gz MTSYEZSUQIBJQR-GOSISDBHSA-N 0 0 374.462 3.983 20 5 FHBDRN COc1cc(-c2nc(Cc3ccc(F)cc3C)no2)cc([N+](=O)[O-])c1OC ZINC000569105386 568277176 /nfs/dbraw/zinc/27/71/76/568277176.db2.gz CXMYJZBOQPVERE-UHFFFAOYSA-N 0 0 373.340 3.700 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N1CCO[C@](C)(c2ccccc2)C1 ZINC000569041316 568278255 /nfs/dbraw/zinc/27/82/55/568278255.db2.gz RLHZUVGWELRKJT-FQEVSTJZSA-N 0 0 369.421 3.937 20 5 FHBDRN COc1cc(C(=O)Nc2nc(-c3ccccc3F)co2)cc([N+](=O)[O-])c1C ZINC000482119327 568280542 /nfs/dbraw/zinc/28/05/42/568280542.db2.gz LCIQMWABMOPXKC-UHFFFAOYSA-N 0 0 371.324 3.958 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1N[C@H]1CCN([C@@H](C)c2ccc(F)cc2)C1=O ZINC000453059194 568280567 /nfs/dbraw/zinc/28/05/67/568280567.db2.gz LYKYKUSBKRGZNG-LRDDRELGSA-N 0 0 373.384 3.517 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N[C@H](C)c1ccc2n[nH]cc2c1 ZINC000482145436 568285114 /nfs/dbraw/zinc/28/51/14/568285114.db2.gz YOBPVHMBTXCHEM-GFCCVEGCSA-N 0 0 353.382 3.971 20 5 FHBDRN O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCCC[C@H]1c1cc[nH]n1 ZINC000569133369 568285861 /nfs/dbraw/zinc/28/58/61/568285861.db2.gz OWUYJEYZNAZAJH-AWEZNQCLSA-N 0 0 356.407 3.900 20 5 FHBDRN CCN(C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)[C@H]1CCOC(C)(C)C1 ZINC000291736546 568286727 /nfs/dbraw/zinc/28/67/27/568286727.db2.gz XHRGNDVCZHQLQO-HNNXBMFYSA-N 0 0 361.442 3.589 20 5 FHBDRN Cc1ccc(OCCN(C)C(=O)CCCNc2ccc([N+](=O)[O-])cc2)cc1 ZINC000024389311 568291753 /nfs/dbraw/zinc/29/17/53/568291753.db2.gz UPYMULHRZUHIBN-UHFFFAOYSA-N 0 0 371.437 3.633 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)NCCC(C)(C)c1ccccc1 ZINC000604400737 568293992 /nfs/dbraw/zinc/29/39/92/568293992.db2.gz FNVWUSSMGGOSLG-UHFFFAOYSA-N 0 0 371.437 3.771 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])o1)N1CCC[C@H](c2nc3ccccc3s2)C1 ZINC000008104251 568294310 /nfs/dbraw/zinc/29/43/10/568294310.db2.gz NOSYDEGXJCVTMF-NSHDSACASA-N 0 0 357.391 3.817 20 5 FHBDRN CC[C@H](c1cccc(OC)c1)N(C)C(=O)c1cc([N+](=O)[O-])c(F)cc1N ZINC000291774988 568305496 /nfs/dbraw/zinc/30/54/96/568305496.db2.gz OCBXOBZVAQWBGW-MRXNPFEDSA-N 0 0 361.373 3.548 20 5 FHBDRN CN(CC(=O)NC[C@@H]1CCCC[C@@H]1C(F)(F)F)c1ccccc1[N+](=O)[O-] ZINC000482204791 568312060 /nfs/dbraw/zinc/31/20/60/568312060.db2.gz CDUHXVQACGEKMQ-STQMWFEESA-N 0 0 373.375 3.516 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)N2CC(C)(C)[C@@H]2C2CC2)cc1SC ZINC000291796200 568316441 /nfs/dbraw/zinc/31/64/41/568316441.db2.gz AHTPTPCKTIZKDK-HNNXBMFYSA-N 0 0 350.440 3.586 20 5 FHBDRN Cc1c(N[C@H]2CCN([C@@H](C)c3ccc(F)cc3)C2=O)cccc1[N+](=O)[O-] ZINC000453064192 568322363 /nfs/dbraw/zinc/32/23/63/568322363.db2.gz ONKWOAKAYOIUEH-GUYCJALGSA-N 0 0 357.385 3.816 20 5 FHBDRN C[C@H]1CCCN(c2ccc(C(=O)N3CCCC4(CC4)C3)cc2[N+](=O)[O-])C1 ZINC000408289343 568329308 /nfs/dbraw/zinc/32/93/08/568329308.db2.gz FMNFKWLWXAVEPH-HNNXBMFYSA-N 0 0 357.454 3.847 20 5 FHBDRN Cc1nn(CC(=O)N[C@H](c2ccccc2)C2CCCCC2)c(C)c1[N+](=O)[O-] ZINC000031799269 568340154 /nfs/dbraw/zinc/34/01/54/568340154.db2.gz ODAYOWZBEVQTFZ-LJQANCHMSA-N 0 0 370.453 3.846 20 5 FHBDRN COC(=O)c1ccc(OCCCOc2ccc(C)c(C)c2)c([N+](=O)[O-])c1 ZINC000031845665 568342064 /nfs/dbraw/zinc/34/20/64/568342064.db2.gz LADXLAUGVPONOA-UHFFFAOYSA-N 0 0 359.378 3.846 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)Nc2cccc(Cn3cccn3)c2)c1 ZINC000031968511 568344185 /nfs/dbraw/zinc/34/41/85/568344185.db2.gz SEFNFXZGFIMWON-UHFFFAOYSA-N 0 0 368.418 3.814 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])c2cccnc12)Nc1cccc(Cl)c1 ZINC000003257271 568362180 /nfs/dbraw/zinc/36/21/80/568362180.db2.gz PIRDFBGYQFUWCD-UHFFFAOYSA-N 0 0 357.753 3.814 20 5 FHBDRN COc1ccccc1N1CCN(Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000542001813 568377750 /nfs/dbraw/zinc/37/77/50/568377750.db2.gz XQBIGTZZQKUZKV-UHFFFAOYSA-N 0 0 361.829 3.579 20 5 FHBDRN C/C=C\c1ccc(OCC(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)c(OC)c1 ZINC000542003288 568391856 /nfs/dbraw/zinc/39/18/56/568391856.db2.gz ZQHFDALRFCRQSC-PLNGDYQASA-N 0 0 372.377 3.663 20 5 FHBDRN COc1ccc(NC(=O)c2cc(C(C)C)n(C(C)(C)C)n2)cc1[N+](=O)[O-] ZINC000542002417 568397341 /nfs/dbraw/zinc/39/73/41/568397341.db2.gz GQULCRAARLVKBA-UHFFFAOYSA-N 0 0 360.414 3.931 20 5 FHBDRN CCn1c(C)nc([N+](=O)[O-])c1N1CCc2c(Cl)cc(Cl)cc2C1 ZINC000569403705 568400897 /nfs/dbraw/zinc/40/08/97/568400897.db2.gz PMADPKLGNGNAMI-UHFFFAOYSA-N 0 0 355.225 3.989 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1OCC(=O)Nc1ccc(Cl)c(Cl)c1 ZINC000006290692 568401333 /nfs/dbraw/zinc/40/13/33/568401333.db2.gz RVYLPMPMOVHWPG-UHFFFAOYSA-N 0 0 371.176 3.928 20 5 FHBDRN Cc1ccccc1[C@@H](NC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F)C1CC1 ZINC000569499043 568403780 /nfs/dbraw/zinc/40/37/80/568403780.db2.gz NXAISSLAAQSWBQ-IBGZPJMESA-N 0 0 360.360 3.991 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)NCCC(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000006406072 568406422 /nfs/dbraw/zinc/40/64/22/568406422.db2.gz RCMMPRLLMOQSEF-UHFFFAOYSA-N 0 0 369.421 3.651 20 5 FHBDRN Cc1ccc(SC[C@H](C)Nc2nc3ccc([N+](=O)[O-])cc3c(=O)[nH]2)cc1 ZINC000569637838 568407151 /nfs/dbraw/zinc/40/71/51/568407151.db2.gz ZBNFEZAIUPRPOH-LBPRGKRZSA-N 0 0 370.434 3.567 20 5 FHBDRN COc1ccc(C(=O)N[C@@H](c2ccccc2)c2ccncc2)cc1[N+](=O)[O-] ZINC000006978162 568408583 /nfs/dbraw/zinc/40/85/83/568408583.db2.gz SGVZFSJNQARZEF-IBGZPJMESA-N 0 0 363.373 3.518 20 5 FHBDRN COc1cc(Br)ccc1OCc1ccc([N+](=O)[O-])c(OC)c1 ZINC000569585196 568408670 /nfs/dbraw/zinc/40/86/70/568408670.db2.gz CPFYCCRMXHLNKR-UHFFFAOYSA-N 0 0 368.183 3.954 20 5 FHBDRN CC(C)(NC(=O)Nc1nccn1-c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000569593973 568409057 /nfs/dbraw/zinc/40/90/57/568409057.db2.gz SWYAPECACJPOHH-UHFFFAOYSA-N 0 0 365.393 3.837 20 5 FHBDRN COc1ccccc1C[C@H](C)CC(=O)Nc1ccc(OC)c([N+](=O)[O-])c1 ZINC000541994598 568412843 /nfs/dbraw/zinc/41/28/43/568412843.db2.gz YFGLSZJQQHTNBX-ZDUSSCGKSA-N 0 0 358.394 3.819 20 5 FHBDRN COc1ccc([C@@H](C)NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)cc1F ZINC000007031239 568419981 /nfs/dbraw/zinc/41/99/81/568419981.db2.gz HVIBJVMYAMTSDF-LLVKDONJSA-N 0 0 373.384 3.808 20 5 FHBDRN COc1ccc([C@@H]2CCN(C(=O)[C@@H](C)c3cccc([N+](=O)[O-])c3)C2)cc1 ZINC000569898820 568434841 /nfs/dbraw/zinc/43/48/41/568434841.db2.gz PNVTXKLBDFRSJR-WMLDXEAASA-N 0 0 354.406 3.723 20 5 FHBDRN Cc1cc(N[C@H]2CCN(CC(F)(F)F)C2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000570098074 568450793 /nfs/dbraw/zinc/45/07/93/568450793.db2.gz CIMSWUBQBUDCKE-VIFPVBQESA-N 0 0 371.281 3.971 20 5 FHBDRN C[C@H](N[C@H]1CCc2c1cccc2[N+](=O)[O-])c1noc(-c2ccccc2)n1 ZINC000570105915 568451365 /nfs/dbraw/zinc/45/13/65/568451365.db2.gz FMNJKVFHOFNGOF-LRDDRELGSA-N 0 0 350.378 3.983 20 5 FHBDRN COc1cc(OC)c(OC)cc1CNc1ccc([N+](=O)[O-])cc1Cl ZINC000007120871 568451522 /nfs/dbraw/zinc/45/15/22/568451522.db2.gz TUSCCQLISXDWAO-UHFFFAOYSA-N 0 0 352.774 3.886 20 5 FHBDRN Cc1cc(OCC(=O)c2ccc(C(F)(F)F)cn2)c(F)cc1[N+](=O)[O-] ZINC000570116098 568452137 /nfs/dbraw/zinc/45/21/37/568452137.db2.gz UNZGFGZOFHGMBJ-UHFFFAOYSA-N 0 0 358.247 3.718 20 5 FHBDRN Cc1csc(NC2CCN(C(=O)[C@@H](C)c3cccc([N+](=O)[O-])c3)CC2)n1 ZINC000570147593 568454916 /nfs/dbraw/zinc/45/49/16/568454916.db2.gz WQKSELGDFBRXFU-ZDUSSCGKSA-N 0 0 374.466 3.566 20 5 FHBDRN COc1cccc(CCc2nc(Cc3ccc([N+](=O)[O-])c(C)c3)no2)c1F ZINC000570082855 568457508 /nfs/dbraw/zinc/45/75/08/568457508.db2.gz CAENAPRKCQUEIP-UHFFFAOYSA-N 0 0 371.368 3.810 20 5 FHBDRN O=C(CSc1ccccc1[N+](=O)[O-])Nc1nc(-c2ccccn2)cs1 ZINC000007182660 568469372 /nfs/dbraw/zinc/46/93/72/568469372.db2.gz MIZFOHYNKOSSQZ-UHFFFAOYSA-N 0 0 372.431 3.844 20 5 FHBDRN COc1ccc([C@@H](C)NCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)cc1F ZINC000182023162 568469378 /nfs/dbraw/zinc/46/93/78/568469378.db2.gz NEVFPYYCXVYQAY-LLVKDONJSA-N 0 0 372.356 3.643 20 5 FHBDRN Cc1nn(Cc2ccc(C(=O)N[C@H]3CCC[C@@H](C)C3)cc2)c(C)c1[N+](=O)[O-] ZINC000033183294 568469980 /nfs/dbraw/zinc/46/99/80/568469980.db2.gz VXLYWQQRCALRJJ-ACJLOTCBSA-N 0 0 370.453 3.765 20 5 FHBDRN Cc1cccc(C2(C(=O)NCCNc3ccc([N+](=O)[O-])cc3)CCC2)c1 ZINC000033180511 568470043 /nfs/dbraw/zinc/47/00/43/568470043.db2.gz SKAAYBKWPLECCN-UHFFFAOYSA-N 0 0 353.422 3.553 20 5 FHBDRN CCS[C@@H]1CCC[C@@H](NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)C1 ZINC000482232276 568471686 /nfs/dbraw/zinc/47/16/86/568471686.db2.gz RAMHBELZZRNTQE-HUUCEWRRSA-N 0 0 363.483 3.963 20 5 FHBDRN O=[N+]([O-])c1cccc(N2CCN(Cc3ccc(F)c4cccnc34)CC2)c1 ZINC000051855713 568477376 /nfs/dbraw/zinc/47/73/76/568477376.db2.gz YSNDSPGGBBXROL-UHFFFAOYSA-N 0 0 366.396 3.604 20 5 FHBDRN Nc1nccc(C(=O)N[C@H]2CCC[C@H](c3cccc(Cl)c3)C2)c1[N+](=O)[O-] ZINC000570410615 568483414 /nfs/dbraw/zinc/48/34/14/568483414.db2.gz IMOJVDLLHHPUPQ-JSGCOSHPSA-N 0 0 374.828 3.512 20 5 FHBDRN CCN(Cc1ccc2c(c1)OCO2)C(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000007272583 568484281 /nfs/dbraw/zinc/48/42/81/568484281.db2.gz VUADEWVACKXHHQ-UHFFFAOYSA-N 0 0 362.769 3.639 20 5 FHBDRN Cc1nc2ccccc2n1CCc1nc(-c2ccc([N+](=O)[O-])s2)no1 ZINC000570602967 568490251 /nfs/dbraw/zinc/49/02/51/568490251.db2.gz JRCUQJGMIAZCJH-UHFFFAOYSA-N 0 0 355.379 3.607 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CC[N@@H+](C2CCC2)C[C@H](C)C1 ZINC000570673638 568494508 /nfs/dbraw/zinc/49/45/08/568494508.db2.gz DGVCNYOJRNEQIR-ZDUSSCGKSA-N 0 0 360.458 3.550 20 5 FHBDRN CCOc1c(OC)cc(CNc2c(OC)cccc2[N+](=O)[O-])cc1OC ZINC000570582026 568495508 /nfs/dbraw/zinc/49/55/08/568495508.db2.gz WIHRSSNUSCYGJD-UHFFFAOYSA-N 0 0 362.382 3.631 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1Cl)N1CCC[C@@H]2CCCC[C@H]21 ZINC000007489824 568521678 /nfs/dbraw/zinc/52/16/78/568521678.db2.gz BFBOBSNWEVCVHH-SWLSCSKDSA-N 0 0 352.818 3.808 20 5 FHBDRN Cc1cc(OCC(=O)N(Cc2ccccc2F)C2CC2)ccc1[N+](=O)[O-] ZINC000007549236 568530411 /nfs/dbraw/zinc/53/04/11/568530411.db2.gz AAHFRQIJCYIZGY-UHFFFAOYSA-N 0 0 358.369 3.612 20 5 FHBDRN CCCCOc1ccc(CNC(=O)Cc2ccc([N+](=O)[O-])cc2)cc1OC ZINC000049761224 568587108 /nfs/dbraw/zinc/58/71/08/568587108.db2.gz ZEMAERLQPQJWIU-UHFFFAOYSA-N 0 0 372.421 3.641 20 5 FHBDRN CCc1ccc(C(=O)NC[C@H]2CC[C@@H](c3ccccc3)O2)cc1[N+](=O)[O-] ZINC000570915937 568668043 /nfs/dbraw/zinc/66/80/43/568668043.db2.gz DMTBJHCPFUEDIS-MJGOQNOKSA-N 0 0 354.406 3.807 20 5 FHBDRN COc1cccc2[nH]cc(CC(=O)N3CCCc4ccc([N+](=O)[O-])cc43)c21 ZINC000182061886 568708140 /nfs/dbraw/zinc/70/81/40/568708140.db2.gz PTGBHKLPWBNSHS-UHFFFAOYSA-N 0 0 365.389 3.607 20 5 FHBDRN O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1N[C@@H](c1ccc(F)cc1)C1CCC1 ZINC000738360823 598796973 /nfs/dbraw/zinc/79/69/73/598796973.db2.gz ZJAAPHVQADWECU-QGZVFWFLSA-N 0 0 368.372 3.867 20 5 FHBDRN Cc1cc(-c2nn[nH]n2)cc(C)c1OCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000822130463 599387252 /nfs/dbraw/zinc/38/72/52/599387252.db2.gz TYVGJKODGCYAAM-UHFFFAOYSA-N 0 0 359.773 3.624 20 5 FHBDRN C[C@@H](Nc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-])c1ccc(F)cc1Cl ZINC000736140004 599440590 /nfs/dbraw/zinc/44/05/90/599440590.db2.gz SVTFVUUKDUYNTE-MRVPVSSYSA-N 0 0 362.752 3.741 20 5 FHBDRN CC[C@@H](Nc1ccc([N+](=O)[O-])cc1-c1nn[nH]n1)c1ccc(F)cc1F ZINC000736369347 599528431 /nfs/dbraw/zinc/52/84/31/599528431.db2.gz KSYNJKZFDQTFAQ-CQSZACIVSA-N 0 0 360.324 3.616 20 5 FHBDRN O=[N+]([O-])c1cccc2nc(C=Cc3ccc(-c4nn[nH]n4)cc3F)ccc21 ZINC000823647981 607457527 /nfs/dbraw/zinc/45/75/27/607457527.db2.gz RGQFPHIGLKZBIN-VOTSOKGWSA-N 0 0 362.324 3.633 20 5 FHBDRN Cc1ccc([C@@H](C)[NH2+]Cc2cc(C)c(OCC(=O)[O-])c(C)c2)cc1[N+](=O)[O-] ZINC000832920788 601267710 /nfs/dbraw/zinc/26/77/10/601267710.db2.gz GWNVZRWXUVJQCH-OAHLLOKOSA-N 0 0 372.421 3.834 20 5 FHBDRN C[N@H+](CC(=O)[O-])Cc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000833691864 604540646 /nfs/dbraw/zinc/54/06/46/604540646.db2.gz RWWBNGQQJNDCBU-UHFFFAOYSA-N 0 0 350.758 3.557 20 5 FHBDRN O=[N+]([O-])c1ccc(Cl)cc1CSc1ccc(-c2nn[nH]n2)cc1F ZINC000823640117 606046494 /nfs/dbraw/zinc/04/64/94/606046494.db2.gz UAAFLWJKCJYJNA-UHFFFAOYSA-N 0 0 365.777 3.860 20 5 FHBDRN C[C@@H](Nc1ccc([N+](=O)[O-])cc1-c1nn[nH]n1)c1c(F)cccc1Cl ZINC000820460955 606422288 /nfs/dbraw/zinc/42/22/88/606422288.db2.gz CURHMQORDVMNOY-MRVPVSSYSA-N 0 0 362.752 3.741 20 5 FHBDRN CC[C@H](Nc1ccc(-c2nn[nH]n2)c([N+](=O)[O-])c1)c1ccc(Cl)cc1 ZINC000820925127 606644733 /nfs/dbraw/zinc/64/47/33/606644733.db2.gz DSGGHZSRCGOBSO-AWEZNQCLSA-N 0 0 358.789 3.992 20 5 FHBDRN O=[N+]([O-])c1cc(CSc2ccc(-c3nn[nH]n3)cc2Cl)cs1 ZINC000823635184 606852391 /nfs/dbraw/zinc/85/23/91/606852391.db2.gz RQUIEUBXQRETHZ-UHFFFAOYSA-N 0 0 353.816 3.782 20 5 FHBDRN O=[N+]([O-])c1ccc2sc(C=Cc3ccccc3-c3nn[nH]n3)nc2c1 ZINC000826499612 607883862 /nfs/dbraw/zinc/88/38/62/607883862.db2.gz PUUHCXLVUKYAQS-VMPITWQZSA-N 0 0 350.363 3.555 20 5 FHBDRN O=[N+]([O-])c1ccc2sc(C=Cc3ccc(F)c(-c4nn[nH]n4)c3)nc2c1 ZINC000826499375 607916420 /nfs/dbraw/zinc/91/64/20/607916420.db2.gz GNMAZUOUBPOWRB-QHHAFSJGSA-N 0 0 368.353 3.694 20 5 FHBDRN Cc1ccc([C@@H](C)Nc2ncc(Cl)c(C)c2-c2nn[nH]n2)cc1[N+](=O)[O-] ZINC000826284572 609570485 /nfs/dbraw/zinc/57/04/85/609570485.db2.gz YCWIFRBXASOYMY-SNVBAGLBSA-N 0 0 373.804 3.613 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CCC[C@]3(CCN3Cc3cccc(F)c3)C2)c(F)c1 ZINC001164995851 722197032 /nfs/dbraw/zinc/19/70/32/722197032.db2.gz YSNMZDJYNMNUQH-IBGZPJMESA-N 0 0 374.391 3.513 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CCC[C@@]3(CCN3Cc3cccc(F)c3)C2)c(F)c1 ZINC001164995853 722197354 /nfs/dbraw/zinc/19/73/54/722197354.db2.gz YSNMZDJYNMNUQH-LJQANCHMSA-N 0 0 374.391 3.513 20 5 FHBDRN COc1ccc(OCc2cc(=O)oc3cc4c(cc23)CCC4)c([N+](=O)[O-])c1 ZINC000005051089 936315346 /nfs/dbraw/zinc/31/53/46/936315346.db2.gz CBPQLLSWFWVYOK-UHFFFAOYSA-N 0 0 367.357 3.778 20 5 FHBDRN Cc1ccnc([C@@H]2CCN(C(=O)[C@H](C)c3ccc([N+](=O)[O-])cc3F)C2)c1 ZINC000572899028 936324764 /nfs/dbraw/zinc/32/47/64/936324764.db2.gz QIWLZLSFPKPMNU-ZIAGYGMSSA-N 0 0 357.385 3.557 20 5 FHBDRN COc1ccc2c(c1)[C@@H](NCc1cc([N+](=O)[O-])ccc1OC)CCCO2 ZINC000178728336 936326393 /nfs/dbraw/zinc/32/63/93/936326393.db2.gz WYIYYAAEWORMNO-KRWDZBQOSA-N 0 0 358.394 3.616 20 5 FHBDRN COC(=O)/C=C\c1ccc(OCc2ccc([N+](=O)[O-])c(F)c2)c(OC)c1 ZINC000588561795 936330265 /nfs/dbraw/zinc/33/02/65/936330265.db2.gz OQIJVSHVEFPANH-YVMONPNESA-N 0 0 361.325 3.508 20 5 FHBDRN C[C@@H](NC(=O)N1CC2(CCCC2)OC(C)(C)C1)c1cccc([N+](=O)[O-])c1 ZINC000187881542 936332652 /nfs/dbraw/zinc/33/26/52/936332652.db2.gz BEXRXYBMGGJDQB-CQSZACIVSA-N 0 0 361.442 3.789 20 5 FHBDRN CCc1ncsc1NC(=O)c1cc([N+](=O)[O-])ccc1SCCOC ZINC000162021811 936334457 /nfs/dbraw/zinc/33/44/57/936334457.db2.gz WBCDBKZXQRCIMX-UHFFFAOYSA-N 0 0 367.452 3.605 20 5 FHBDRN O=C(CNc1cc([N+](=O)[O-])ccc1Nc1ccccc1)NCc1ccco1 ZINC000024221607 936336567 /nfs/dbraw/zinc/33/65/67/936336567.db2.gz FLTNJZXOBSFVGH-UHFFFAOYSA-N 0 0 366.377 3.660 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1COC(=O)Cc1coc2cc(C)ccc12 ZINC000024221684 936337085 /nfs/dbraw/zinc/33/70/85/936337085.db2.gz WKBLLRIRVVHNCF-UHFFFAOYSA-N 0 0 355.346 3.944 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1)N[C@@H]1c2ccccc2CC12CCOCC2 ZINC000582993144 936351053 /nfs/dbraw/zinc/35/10/53/936351053.db2.gz MMLKEKXFYMJGIS-GOSISDBHSA-N 0 0 367.405 3.811 20 5 FHBDRN O=C(Nc1ccccc1O)c1cc(Br)cc([N+](=O)[O-])c1Cl ZINC000135928806 936351922 /nfs/dbraw/zinc/35/19/22/936351922.db2.gz JRUSLPFFRQBVBO-UHFFFAOYSA-N 0 0 371.574 3.969 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H]1CCO[C@H](C(C)(C)C)C1 ZINC000439887335 945065769 /nfs/dbraw/zinc/06/57/69/945065769.db2.gz JOROJHNXEGNRMQ-LRDDRELGSA-N 0 0 365.430 3.709 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)NCCc1cc(C)c(O)c(C)c1 ZINC000439901958 945067051 /nfs/dbraw/zinc/06/70/51/945067051.db2.gz ODIMIIGZKAKCLI-UHFFFAOYSA-N 0 0 373.409 3.680 20 5 FHBDRN C[C@@H](CNC(=O)c1ccc(Br)cc1[N+](=O)[O-])c1ccccc1 ZINC000079386658 937080829 /nfs/dbraw/zinc/08/08/29/937080829.db2.gz JKOLGRLGFJMUMJ-NSHDSACASA-N 0 0 363.211 3.891 20 5 FHBDRN CC(C)(C)CCCS(=O)(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000572922393 937084441 /nfs/dbraw/zinc/08/44/41/937084441.db2.gz MBAAVEREKJTGDH-UHFFFAOYSA-N 0 0 354.472 3.715 20 5 FHBDRN Cc1ccccc1-c1noc([C@@H](C)SCCn2cc([N+](=O)[O-])cn2)n1 ZINC000162378889 937085012 /nfs/dbraw/zinc/08/50/12/937085012.db2.gz CKOHNNYRGWLUOK-GFCCVEGCSA-N 0 0 359.411 3.644 20 5 FHBDRN COc1cccc(F)c1[C@@H](C)NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000136024518 937093644 /nfs/dbraw/zinc/09/36/44/937093644.db2.gz DLZSWKBNWMDOGX-LLVKDONJSA-N 0 0 371.368 3.644 20 5 FHBDRN O=C(Nc1cccc2c1OCCO2)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000178770573 937099325 /nfs/dbraw/zinc/09/93/25/937099325.db2.gz FQXXNGFIXPMJPS-UHFFFAOYSA-N 0 0 369.377 3.563 20 5 FHBDRN Cc1cc(C(=O)N(C)Cc2cc(Br)cs2)cc([N+](=O)[O-])c1 ZINC000122048684 937105296 /nfs/dbraw/zinc/10/52/96/937105296.db2.gz JCLMEGMHDLVSGX-UHFFFAOYSA-N 0 0 369.240 3.999 20 5 FHBDRN C[C@H](NC(=O)c1cccc2c(=O)c3ccccc3[nH]c12)[C@@H]1CCCCO1 ZINC000278077609 937118924 /nfs/dbraw/zinc/11/89/24/937118924.db2.gz OTDUCZYEMSLIEP-UGSOOPFHSA-N 0 0 350.418 3.781 20 5 FHBDRN Cc1cc(C)cc([C@@H](C)NC(=O)N2CCOc3ccc([N+](=O)[O-])cc3C2)c1 ZINC000557548643 927049314 /nfs/dbraw/zinc/04/93/14/927049314.db2.gz PSDNAVIFGWSLEA-OAHLLOKOSA-N 0 0 369.421 3.877 20 5 FHBDRN C[C@@H](c1ccc(F)c(F)c1)N(C)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000023355442 927054849 /nfs/dbraw/zinc/05/48/49/927054849.db2.gz MCKLRLMFKMVCBL-NSHDSACASA-N 0 0 364.348 3.933 20 5 FHBDRN O=C(NCc1cc(Cl)ccc1OC(F)F)c1csc([N+](=O)[O-])c1 ZINC000175266037 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CCc1ccc([C@@H]2CN(Cc3ccc([N+](=O)[O-])cc3OC)CCO2)cc1 ZINC000430241105 928414340 /nfs/dbraw/zinc/41/43/40/928414340.db2.gz NHVMDNYDJJDZDY-FQEVSTJZSA-N 0 0 356.422 3.739 20 5 FHBDRN Cc1cc(F)c([N+](=O)[O-])cc1C(=O)N[C@@H](C[C@@H]1CCOC1)c1ccccc1 ZINC001266296150 928436610 /nfs/dbraw/zinc/43/66/10/928436610.db2.gz IKOIYBILYGVVQI-KSSFIOAISA-N 0 0 372.396 3.940 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1OC[C@@H](O)CO[C@H]1CCCc2ccccc21 ZINC000583218765 937249609 /nfs/dbraw/zinc/24/96/09/937249609.db2.gz JFWQJZRGABPSCV-HKUYNNGSSA-N 0 0 357.406 3.737 20 5 FHBDRN CCOC(=O)c1cc(N[C@@H](CCCO)c2ccccc2)ccc1[N+](=O)[O-] ZINC000127071186 928507011 /nfs/dbraw/zinc/50/70/11/928507011.db2.gz LRVWEQHRXVRPGH-KRWDZBQOSA-N 0 0 358.394 3.697 20 5 FHBDRN CCc1csc(NC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])n1 ZINC000583226652 937256659 /nfs/dbraw/zinc/25/66/59/937256659.db2.gz PCOSZWQWJNULPG-UHFFFAOYSA-N 0 0 357.844 3.998 20 5 FHBDRN Cc1ccc(CNC(=O)c2csc([N+](=O)[O-])c2)c(OCC(F)(F)F)c1 ZINC000176552986 937264682 /nfs/dbraw/zinc/26/46/82/937264682.db2.gz YSBADCNPAKWXQQ-UHFFFAOYSA-N 0 0 374.340 3.836 20 5 FHBDRN COc1cc(CCC(=O)NCCc2ccc([N+](=O)[O-])cc2)ccc1Cl ZINC000120500344 928657181 /nfs/dbraw/zinc/65/71/81/928657181.db2.gz IXTXSZYIMVMCMM-UHFFFAOYSA-N 0 0 362.813 3.548 20 5 FHBDRN CC(C)c1cc(CNC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)on1 ZINC000120496681 928657788 /nfs/dbraw/zinc/65/77/88/928657788.db2.gz BRFWAWUEUWZXBF-UHFFFAOYSA-N 0 0 360.414 3.528 20 5 FHBDRN Cc1nnc([C@@H](C)OC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)s1 ZINC000782059706 928662502 /nfs/dbraw/zinc/66/25/02/928662502.db2.gz WMCDNZDRDSBGEC-RKDXNWHRSA-N 0 0 353.425 3.540 20 5 FHBDRN CC(=O)[C@H](C)CCCCC(=O)N(C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000154278076 928673878 /nfs/dbraw/zinc/67/38/78/928673878.db2.gz IOSNQBFWKUMCSL-GFCCVEGCSA-N 0 0 354.834 3.992 20 5 FHBDRN COc1cc(C)ccc1C(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000547711559 928781981 /nfs/dbraw/zinc/78/19/81/928781981.db2.gz PRRXXZCHFMPCNL-UHFFFAOYSA-N 0 0 370.405 3.595 20 5 FHBDRN O=C([C@H]1CCc2ccccc21)N1CCS[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000610235057 928793930 /nfs/dbraw/zinc/79/39/30/928793930.db2.gz PVHORIZJCBBHCL-HKUYNNGSSA-N 0 0 354.431 3.899 20 5 FHBDRN O=C([C@@H]1CCc2ccccc21)N1CCS[C@@H]1c1ccc([N+](=O)[O-])cc1 ZINC000610235058 928794582 /nfs/dbraw/zinc/79/45/82/928794582.db2.gz PVHORIZJCBBHCL-IEBWSBKVSA-N 0 0 354.431 3.899 20 5 FHBDRN COc1ccc([C@@H](C)N(C)C(=O)CSc2ccc([N+](=O)[O-])cc2)cc1 ZINC000248181136 937289331 /nfs/dbraw/zinc/28/93/31/937289331.db2.gz DNANEWKUSOYQIN-CYBMUJFWSA-N 0 0 360.435 3.915 20 5 FHBDRN COCc1nc2cc(NC(=O)CSc3ccc([N+](=O)[O-])cc3)ccc2o1 ZINC000176597861 937285835 /nfs/dbraw/zinc/28/58/35/937285835.db2.gz LGCHRDXNFBDQRG-UHFFFAOYSA-N 0 0 373.390 3.613 20 5 FHBDRN O=C(c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)N(Cc1cccs1)C1CC1 ZINC000032638956 928950376 /nfs/dbraw/zinc/95/03/76/928950376.db2.gz RIORXLDYRFBGPH-UHFFFAOYSA-N 0 0 368.418 3.647 20 5 FHBDRN O=C(NCCc1ccccc1[N+](=O)[O-])c1cccc(Oc2nccs2)c1 ZINC000610237094 928952646 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3.889 20 5 FHBDRN Cc1c(C(=O)N[C@@H](c2ccc3c(c2)OCCO3)C2CC2)cccc1[N+](=O)[O-] ZINC000059852332 929101674 /nfs/dbraw/zinc/10/16/74/929101674.db2.gz ZVHAIXHUIJPRLE-LJQANCHMSA-N 0 0 368.389 3.556 20 5 FHBDRN COc1cc(OCC(=O)N[C@@H](CC2CC2)c2ccccc2)ccc1[N+](=O)[O-] ZINC000610237253 929103581 /nfs/dbraw/zinc/10/35/81/929103581.db2.gz BGNTVGWCLDGROM-KRWDZBQOSA-N 0 0 370.405 3.640 20 5 FHBDRN Cc1c(CCC(=O)Oc2ccc(-c3ccccc3)cc2[N+](=O)[O-])cnn1C ZINC000120619756 929107573 /nfs/dbraw/zinc/10/75/73/929107573.db2.gz AJNCMKOMPNHLFC-UHFFFAOYSA-N 0 0 365.389 3.842 20 5 FHBDRN C[C@@H](NC(=O)CCc1cc(F)ccc1[N+](=O)[O-])c1cnn(CC2CCC2)c1 ZINC000890666228 929136088 /nfs/dbraw/zinc/13/60/88/929136088.db2.gz BMSSDSWVGJYQNA-CYBMUJFWSA-N 0 0 374.416 3.541 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)N(C)c2ccc(Cl)cn2)cc1SC ZINC000134720331 929169711 /nfs/dbraw/zinc/16/97/11/929169711.db2.gz MWZVRJXPNFQBRM-UHFFFAOYSA-N 0 0 367.814 3.650 20 5 FHBDRN CC(=O)N1CCCCC[C@H]1C1CCN(c2ccsc2[N+](=O)[O-])CC1 ZINC000609511608 929203188 /nfs/dbraw/zinc/20/31/88/929203188.db2.gz FQNJJBPBMNPXNU-HNNXBMFYSA-N 0 0 351.472 3.664 20 5 FHBDRN Cc1c(Br)cc(-c2nc(C3CCOCC3)no2)cc1[N+](=O)[O-] ZINC000154722829 929240700 /nfs/dbraw/zinc/24/07/00/929240700.db2.gz DBZKPQCHJZXMNB-UHFFFAOYSA-N 0 0 368.187 3.610 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)F)cc1N1CCO[C@H](c2cccs2)C1 ZINC000278182716 937315544 /nfs/dbraw/zinc/31/55/44/937315544.db2.gz DFNJSCVDWYMYPH-NSHDSACASA-N 0 0 359.329 3.648 20 5 FHBDRN O=C(c1cc(F)c([N+](=O)[O-])cc1F)N1CCC(Oc2ccccc2)CC1 ZINC000154760078 929273422 /nfs/dbraw/zinc/27/34/22/929273422.db2.gz DGLPTDDSRNXSFQ-UHFFFAOYSA-N 0 0 362.332 3.557 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1O[C@@H](C)c1nc(Cc2ccc(F)cc2)no1 ZINC000120668444 929280313 /nfs/dbraw/zinc/28/03/13/929280313.db2.gz VPNANMTZNRIQFO-NSHDSACASA-N 0 0 373.340 3.856 20 5 FHBDRN C[C@@H]1CCC[C@@H](OCc2cccc(NC(=O)c3c[nH]nc3[N+](=O)[O-])c2)C1 ZINC000547757636 929373557 /nfs/dbraw/zinc/37/35/57/929373557.db2.gz CMGQSVAEPPDALO-IUODEOHRSA-N 0 0 358.398 3.666 20 5 FHBDRN COC(=O)c1cnc(N(Cc2ccccn2)C2CCCCC2)c([N+](=O)[O-])c1 ZINC001167099747 929374548 /nfs/dbraw/zinc/37/45/48/929374548.db2.gz HJVYIGXRFXZZNF-UHFFFAOYSA-N 0 0 370.409 3.511 20 5 FHBDRN CCN(c1ccccc1F)S(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1C ZINC000598598892 929405688 /nfs/dbraw/zinc/40/56/88/929405688.db2.gz FSEAPQYKYGFYGN-UHFFFAOYSA-N 0 0 352.387 3.566 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1c2ccccc2N(C)CC[C@@H]1C ZINC000471235729 929435329 /nfs/dbraw/zinc/43/53/29/929435329.db2.gz UGENQPGDZBUGMK-HNNXBMFYSA-N 0 0 368.437 3.577 20 5 FHBDRN O=C(NCc1cccc([N+](=O)[O-])c1)c1csc(Cc2ccccc2F)n1 ZINC000609784839 929468188 /nfs/dbraw/zinc/46/81/88/929468188.db2.gz HGXYGXNDROGHRB-UHFFFAOYSA-N 0 0 371.393 3.711 20 5 FHBDRN CC(C)NC(=O)Nc1cccc(C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000057282516 929503897 /nfs/dbraw/zinc/50/38/97/929503897.db2.gz NQRHJCSAFOMHEI-CYBMUJFWSA-N 0 0 370.409 3.616 20 5 FHBDRN CCC[C@]1(CO)CCCN1C(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000278194581 937336325 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20 5 FHBDRN Cc1ccc(-c2cc(C(=O)NCc3cccc([N+](=O)[O-])c3)[nH]n2)c(C)c1 ZINC000547979204 929701549 /nfs/dbraw/zinc/70/15/49/929701549.db2.gz NXLJRHSNTPSDDA-UHFFFAOYSA-N 0 0 350.378 3.532 20 5 FHBDRN COc1cc(C(=O)N[C@H]2CCC(C)(C)C[C@H]2C)c([N+](=O)[O-])cc1OC ZINC000177636661 929724032 /nfs/dbraw/zinc/72/40/32/929724032.db2.gz VFOJPUZMKFICSA-YPMHNXCESA-N 0 0 350.415 3.557 20 5 FHBDRN CNc1ccc(C(=O)NCC2(c3ccccc3)CCCC2)cc1[N+](=O)[O-] ZINC000012101223 929725729 /nfs/dbraw/zinc/72/57/29/929725729.db2.gz UNGMOOKDDCFCQZ-UHFFFAOYSA-N 0 0 353.422 3.878 20 5 FHBDRN CC[C@@H](NC(=O)NCC(C)(C)C1(O)CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000458484377 937356395 /nfs/dbraw/zinc/35/63/95/937356395.db2.gz BOXNCBNMGKMEFK-MRXNPFEDSA-N 0 0 363.458 3.676 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1Nc1cnc(Cl)c(Br)n1 ZINC001210444422 929795816 /nfs/dbraw/zinc/79/58/16/929795816.db2.gz IQMDACFJNIVPNL-UHFFFAOYSA-N 0 0 359.567 3.553 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1Nc1cc(Br)c2nccn2c1 ZINC001210445135 929798462 /nfs/dbraw/zinc/79/84/62/929798462.db2.gz YILHFECZUZYUSA-UHFFFAOYSA-N 0 0 363.171 3.757 20 5 FHBDRN CCOC(=O)c1ncc(Cl)cc1Nc1cc([N+](=O)[O-])ccc1OC ZINC001210445082 929798685 /nfs/dbraw/zinc/79/86/85/929798685.db2.gz XDAHELSFILXQFW-UHFFFAOYSA-N 0 0 351.746 3.572 20 5 FHBDRN NC(=O)c1coc(CNc2cc(Cl)c(C(F)(F)F)cc2[N+](=O)[O-])c1 ZINC000302442145 929801028 /nfs/dbraw/zinc/80/10/28/929801028.db2.gz QQDLCALLIWUHAB-UHFFFAOYSA-N 0 0 363.679 3.571 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])c2ncccc12)c1cncc(C(F)(F)F)c1 ZINC000580004049 929801760 /nfs/dbraw/zinc/80/17/60/929801760.db2.gz ARVVOBAGACJIDH-UHFFFAOYSA-N 0 0 362.267 3.809 20 5 FHBDRN C[C@@H](N[C@H](C)c1ncn(C)n1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000275671824 929821091 /nfs/dbraw/zinc/82/10/91/929821091.db2.gz HHYOACDLTTUROR-VXGBXAGGSA-N 0 0 357.439 3.864 20 5 FHBDRN Cc1c(Cc2noc(-c3c[nH]c(=O)c4ccccc34)n2)cccc1[N+](=O)[O-] ZINC000583347705 937364157 /nfs/dbraw/zinc/36/41/57/937364157.db2.gz CFCFEPMMWURIEP-UHFFFAOYSA-N 0 0 362.345 3.798 20 5 FHBDRN Cn1ccnc1[C@@H](NCCOC1CCCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000560528038 929853944 /nfs/dbraw/zinc/85/39/44/929853944.db2.gz KJVTZICYMYVOMP-IBGZPJMESA-N 0 0 372.469 3.747 20 5 FHBDRN COc1cccc(C(=O)N2CCCn3c(cc4ccccc43)C2)c1[N+](=O)[O-] ZINC000583342343 937365501 /nfs/dbraw/zinc/36/55/01/937365501.db2.gz AELJEOSXKMDJQL-UHFFFAOYSA-N 0 0 365.389 3.604 20 5 FHBDRN CCCOc1cc(O)ccc1NC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc21 ZINC000430468762 929870337 /nfs/dbraw/zinc/87/03/37/929870337.db2.gz AOUWSGLKPLPJFO-UHFFFAOYSA-N 0 0 355.350 3.823 20 5 FHBDRN CCc1cccc(OC[C@H](O)COc2ccc([N+](=O)[O-])c3ncccc23)c1 ZINC000471476236 929876039 /nfs/dbraw/zinc/87/60/39/929876039.db2.gz NXFAWJRYJAKRCL-HNNXBMFYSA-N 0 0 368.389 3.524 20 5 FHBDRN CC[C@@H]1CCC[C@@H]1NC(=O)c1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000155525958 929893939 /nfs/dbraw/zinc/89/39/39/929893939.db2.gz ZDNQNCFJEZSOGC-KOLCDFICSA-N 0 0 358.341 3.513 20 5 FHBDRN COCCCOc1cccc(C(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)c1C ZINC001266541426 929919007 /nfs/dbraw/zinc/91/90/07/929919007.db2.gz IKBMGEGOSXSOCQ-UHFFFAOYSA-N 0 0 374.393 3.579 20 5 FHBDRN C[C@@H](CC(=O)OCCn1ccc([N+](=O)[O-])n1)c1cccc(C(F)(F)F)c1 ZINC000748131898 929952575 /nfs/dbraw/zinc/95/25/75/929952575.db2.gz PCMRUHOEJSVKQS-NSHDSACASA-N 0 0 371.315 3.547 20 5 FHBDRN Cn1ccnc1[C@H]1OCCC[C@@H]1Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000275713345 929955762 /nfs/dbraw/zinc/95/57/62/929955762.db2.gz YOBRBPOUMAJKJT-JSGCOSHPSA-N 0 0 370.331 3.679 20 5 FHBDRN O=c1ccc(-c2cccc([N+](=O)[O-])c2)nn1CCc1ccccc1Cl ZINC000177672430 930003735 /nfs/dbraw/zinc/00/37/35/930003735.db2.gz VNNIQYDHPNLMIM-UHFFFAOYSA-N 0 0 355.781 3.715 20 5 FHBDRN Cc1ccc([C@H](CN2CCOCC2)Nc2ccc(F)cc2[N+](=O)[O-])cc1 ZINC000610341160 930036227 /nfs/dbraw/zinc/03/62/27/930036227.db2.gz HYJGCOATBUIORR-SFHVURJKSA-N 0 0 359.401 3.528 20 5 FHBDRN COc1cccc(C(=O)N[C@@H]2CC[C@@H](c3ccc(F)cc3)C2)c1[N+](=O)[O-] ZINC000471501402 930048724 /nfs/dbraw/zinc/04/87/24/930048724.db2.gz XYZOYIWHNAGVCE-UKRRQHHQSA-N 0 0 358.369 3.809 20 5 FHBDRN CCc1ccccc1NC(=O)[C@@H](C)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000536003346 937384649 /nfs/dbraw/zinc/38/46/49/937384649.db2.gz MSSUEHRDDGALPJ-CQSZACIVSA-N 0 0 353.422 3.543 20 5 FHBDRN C[C@H]1C(=O)CC[C@@H](C(=O)NCc2cc([N+](=O)[O-])ccc2Cl)C1(C)C ZINC000275726082 930051796 /nfs/dbraw/zinc/05/17/96/930051796.db2.gz WTKGXOKJPSMWPX-GWCFXTLKSA-N 0 0 352.818 3.506 20 5 FHBDRN CS(=O)(=O)c1ccc(N[C@@H]2CC[C@@H]3CCCC[C@@H]3C2)c([N+](=O)[O-])c1 ZINC000610350209 930069852 /nfs/dbraw/zinc/06/98/52/930069852.db2.gz JRCDRRSNRUHWPQ-BFHYXJOUSA-N 0 0 352.456 3.769 20 5 FHBDRN COc1cc(C(=O)O[C@H]2c3ccccc3OC[C@H]2C)cc([N+](=O)[O-])c1C ZINC001266558154 930085237 /nfs/dbraw/zinc/08/52/37/930085237.db2.gz LVZIEGSBLHPACV-ADLMAVQZSA-N 0 0 357.362 3.838 20 5 FHBDRN COc1cc(C(=O)O[C@@H]2c3ccccc3OC[C@H]2C)c([N+](=O)[O-])cc1F ZINC001266558366 930088096 /nfs/dbraw/zinc/08/80/96/930088096.db2.gz NQTBLHWOKSBALF-QGHHPUGFSA-N 0 0 361.325 3.669 20 5 FHBDRN COc1cc(C(=O)O[C@@H]2c3ccccc3OC[C@@H]2C)c([N+](=O)[O-])cc1F ZINC001266558364 930088475 /nfs/dbraw/zinc/08/84/75/930088475.db2.gz NQTBLHWOKSBALF-BTDLBPIBSA-N 0 0 361.325 3.669 20 5 FHBDRN Cc1noc(C)c1C[C@H](C)NC(=O)c1c(C)cc(Cl)cc1[N+](=O)[O-] ZINC000275743042 930095500 /nfs/dbraw/zinc/09/55/00/930095500.db2.gz CEWLGNOLHDUPAH-VIFPVBQESA-N 0 0 351.790 3.522 20 5 FHBDRN CN(c1ccc(Cl)cc1[N+](=O)[O-])C1CCN(C(=O)c2ccccc2)CC1 ZINC000471519165 930127627 /nfs/dbraw/zinc/12/76/27/930127627.db2.gz DVWQZYYLPKCMKX-UHFFFAOYSA-N 0 0 373.840 3.989 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N[C@@H]1CC[C@@H](c2ccc(F)cc2)C1 ZINC000471519868 930129536 /nfs/dbraw/zinc/12/95/36/930129536.db2.gz AERBXEKFQWHEJX-GDBMZVCRSA-N 0 0 358.369 3.565 20 5 FHBDRN CN(CC(=O)N[C@H]1CC[C@@H](c2ccc(F)cc2)C1)c1ccccc1[N+](=O)[O-] ZINC000471522014 930138186 /nfs/dbraw/zinc/13/81/86/930138186.db2.gz LPWMSMKXBGGLBT-WBVHZDCISA-N 0 0 371.412 3.623 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@H]2C[C@]2(C)c2ccccc2)c1 ZINC000610367340 930162644 /nfs/dbraw/zinc/16/26/44/930162644.db2.gz MQRHDSFRTOUZPA-AZUAARDMSA-N 0 0 354.406 3.519 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)CSc2nc3ccccc3[nH]2)cc1[N+](=O)[O-] ZINC000121156159 930179681 /nfs/dbraw/zinc/17/96/81/930179681.db2.gz NUOPCFXLHGKSBO-GFCCVEGCSA-N 0 0 370.434 3.749 20 5 FHBDRN O=C(Nc1ccc(F)cc1OCC(F)(F)F)c1ccccc1[N+](=O)[O-] ZINC000070867709 930189818 /nfs/dbraw/zinc/18/98/18/930189818.db2.gz VYWXCCDIBRWGNN-UHFFFAOYSA-N 0 0 358.247 3.927 20 5 FHBDRN CNC(=O)c1ccc(NCCSCc2ccc(C)cc2)c([N+](=O)[O-])c1 ZINC000064905056 930191446 /nfs/dbraw/zinc/19/14/46/930191446.db2.gz SYMZKSVPPQYPDS-UHFFFAOYSA-N 0 0 359.451 3.608 20 5 FHBDRN CCOC(=O)c1cc(N2CCC[C@H]2c2ccc(COC)o2)ccc1[N+](=O)[O-] ZINC000161689645 937395906 /nfs/dbraw/zinc/39/59/06/937395906.db2.gz BGXKTZFGYIQXKF-KRWDZBQOSA-N 0 0 374.393 3.852 20 5 FHBDRN Cc1cccc(C[C@@H](CO)N[C@H](c2ccc([N+](=O)[O-])cc2)C(F)(F)F)c1 ZINC000580084677 930229448 /nfs/dbraw/zinc/22/94/48/930229448.db2.gz YSJVYZSFGXMRFJ-DOTOQJQBSA-N 0 0 368.355 3.700 20 5 FHBDRN C[C@H]1CN(C(=O)c2cccc(Cl)c2[N+](=O)[O-])c2ccc(F)cc2O1 ZINC000175899623 930262705 /nfs/dbraw/zinc/26/27/05/930262705.db2.gz JGQVPXNRAIVLGI-VIFPVBQESA-N 0 0 350.733 3.815 20 5 FHBDRN CCOc1ccc2c(c1)CCN(C(=O)c1cc(OCC)ccc1[N+](=O)[O-])C2 ZINC000560984240 930263509 /nfs/dbraw/zinc/26/35/09/930263509.db2.gz GKRYHNGMCAYCFK-UHFFFAOYSA-N 0 0 370.405 3.591 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)c1ccc(N2CCCCC2)cc1 ZINC000560994471 930268850 /nfs/dbraw/zinc/26/88/50/930268850.db2.gz RXYWPRWRPWNDDW-UHFFFAOYSA-N 0 0 367.449 3.900 20 5 FHBDRN CCCOc1ccc(NC(=O)N2CCOc3ccc([N+](=O)[O-])cc3C2)cc1 ZINC000580132243 930291153 /nfs/dbraw/zinc/29/11/53/930291153.db2.gz VPUNOLBKLWBOJR-UHFFFAOYSA-N 0 0 371.393 3.810 20 5 FHBDRN O=C(c1ccc(Oc2ccccc2)cn1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000580151256 930310702 /nfs/dbraw/zinc/31/07/02/930310702.db2.gz XYMJEZRTICFZSD-UHFFFAOYSA-N 0 0 361.357 3.985 20 5 FHBDRN COc1cc(CNc2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)ccc1C ZINC000064916344 930311651 /nfs/dbraw/zinc/31/16/51/930311651.db2.gz ATPAHFKACDFBIX-UHFFFAOYSA-N 0 0 369.421 3.760 20 5 FHBDRN Cc1nn(C)c(N[C@H](C)CCc2ccc(Br)cc2)c1[N+](=O)[O-] ZINC000064915585 930312389 /nfs/dbraw/zinc/31/23/89/930312389.db2.gz KVXJEIUHZMTJLP-SNVBAGLBSA-N 0 0 367.247 3.832 20 5 FHBDRN O=[N+]([O-])c1c(N2CCC(c3c[nH]c4ncccc34)CC2)nc2sccn21 ZINC000064915223 930312587 /nfs/dbraw/zinc/31/25/87/930312587.db2.gz JHTKZDTWEPTHPT-UHFFFAOYSA-N 0 0 368.422 3.564 20 5 FHBDRN CNC(=O)c1ccc(NCCc2c(Cl)cccc2Cl)c([N+](=O)[O-])c1 ZINC000064915764 930316580 /nfs/dbraw/zinc/31/65/80/930316580.db2.gz IVIYAJRGMGDMKM-UHFFFAOYSA-N 0 0 368.220 3.916 20 5 FHBDRN O=C(NCc1ccccc1N1CCCC1)c1ccc([N+](=O)[O-])cc1Cl ZINC000050001319 930328007 /nfs/dbraw/zinc/32/80/07/930328007.db2.gz SBLKJTCMRDDHOH-UHFFFAOYSA-N 0 0 359.813 3.778 20 5 FHBDRN COc1cc(CN2CCC(CC(F)(F)F)CC2)c([N+](=O)[O-])cc1OC ZINC000583396278 937406829 /nfs/dbraw/zinc/40/68/29/937406829.db2.gz KJBNITWISAMMEZ-UHFFFAOYSA-N 0 0 362.348 3.776 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)Nc1ccc(-n2cccn2)c(F)c1 ZINC000047780921 930401540 /nfs/dbraw/zinc/40/15/40/930401540.db2.gz HGQKBSFFZVGUPP-UHFFFAOYSA-N 0 0 369.356 3.584 20 5 FHBDRN CCOC1CN(C(=O)c2ccc(Sc3ccc([N+](=O)[O-])cc3)cc2)C1 ZINC000580249634 930406284 /nfs/dbraw/zinc/40/62/84/930406284.db2.gz IFVYYYNKGXPPOL-UHFFFAOYSA-N 0 0 358.419 3.607 20 5 FHBDRN O=C(CCC(F)F)OCCOc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000796662594 937416480 /nfs/dbraw/zinc/41/64/80/937416480.db2.gz RHBFSHWGNWSXKW-UHFFFAOYSA-N 0 0 357.231 3.581 20 5 FHBDRN COc1ccccc1[C@H](CNC(=O)c1cc(C)cc([N+](=O)[O-])c1)OC(C)C ZINC000471551430 930452534 /nfs/dbraw/zinc/45/25/34/930452534.db2.gz MHYFJVGARJJEQF-IBGZPJMESA-N 0 0 372.421 3.808 20 5 FHBDRN Cc1c(CC(=O)N[C@H](COCC(C)C)c2ccco2)cccc1[N+](=O)[O-] ZINC000118960146 930459965 /nfs/dbraw/zinc/45/99/65/930459965.db2.gz DHWKGZHYKLNVRG-MRXNPFEDSA-N 0 0 360.410 3.569 20 5 FHBDRN COCCCCCNC(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000278241315 937417659 /nfs/dbraw/zinc/41/76/59/937417659.db2.gz LBKSMFWLRXYNTN-UHFFFAOYSA-N 0 0 372.421 3.720 20 5 FHBDRN C[C@@H](CC(=O)c1ccccc1)NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000118975949 930484404 /nfs/dbraw/zinc/48/44/04/930484404.db2.gz UCWJEBLVYMVQTB-LBPRGKRZSA-N 0 0 360.797 3.568 20 5 FHBDRN CCOc1ccc(C(=O)O[C@@H](C)c2nc3ccccc3n2C)cc1[N+](=O)[O-] ZINC000175930453 930487747 /nfs/dbraw/zinc/48/77/47/930487747.db2.gz SILKLVUIGMFMIV-LBPRGKRZSA-N 0 0 369.377 3.798 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CSCc1c(F)cccc1F ZINC000579531312 930490295 /nfs/dbraw/zinc/49/02/95/930490295.db2.gz TXERAOIVBDNBRK-UHFFFAOYSA-N 0 0 368.361 3.754 20 5 FHBDRN CCCc1noc(CSc2nc3cc4ccccc4cc3c(=O)n2C)n1 ZINC000029602739 930507748 /nfs/dbraw/zinc/50/77/48/930507748.db2.gz YRJGIYZXMXSNDF-UHFFFAOYSA-N 0 0 366.446 3.715 20 5 FHBDRN COc1cc(Br)cc(OC)c1OCc1ccc([N+](=O)[O-])cc1 ZINC000118996333 930508161 /nfs/dbraw/zinc/50/81/61/930508161.db2.gz FQNTZQWOCDCFOU-UHFFFAOYSA-N 0 0 368.183 3.954 20 5 FHBDRN C[C@H](COc1cccc(F)c1)NC(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000050153182 930511455 /nfs/dbraw/zinc/51/14/55/930511455.db2.gz PGIDFEHYIUYSFA-CHWSQXEVSA-N 0 0 361.373 3.562 20 5 FHBDRN Cc1ccncc1NC(=O)c1cc([N+](=O)[O-])cc(Br)c1C ZINC000580336833 930521127 /nfs/dbraw/zinc/52/11/27/930521127.db2.gz CFYLWPZEFSWQCL-UHFFFAOYSA-N 0 0 350.172 3.621 20 5 FHBDRN CCn1c(SCc2cccc(OC)n2)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000177749771 930521379 /nfs/dbraw/zinc/52/13/79/930521379.db2.gz XWCZYQVOXPAGQE-UHFFFAOYSA-N 0 0 371.422 3.569 20 5 FHBDRN Cc1cc(NCCCc2cccc(Br)c2)ncc1[N+](=O)[O-] ZINC000610430922 930526003 /nfs/dbraw/zinc/52/60/03/930526003.db2.gz DGKFOIZRYNBAEA-UHFFFAOYSA-N 0 0 350.216 3.527 20 5 FHBDRN Cn1ccnc1-c1cccc(NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)c1 ZINC000119014525 930536165 /nfs/dbraw/zinc/53/61/65/930536165.db2.gz FQTOGPJNBKYLSR-UHFFFAOYSA-N 0 0 356.769 3.901 20 5 FHBDRN CCc1ccc(C(=O)Nc2ccc(C)c(NC(C)=O)c2C)cc1[N+](=O)[O-] ZINC000610434122 930536799 /nfs/dbraw/zinc/53/67/99/930536799.db2.gz LUPWZELBUFXRSP-UHFFFAOYSA-N 0 0 355.394 3.985 20 5 FHBDRN Cc1cnc(Nc2ccc(F)cc2[N+](=O)[O-])cc1I ZINC001210950203 930544337 /nfs/dbraw/zinc/54/43/37/930544337.db2.gz UNICLZZIYVLPKI-UHFFFAOYSA-N 0 0 373.125 3.786 20 5 FHBDRN CCOc1cc(NC(=O)N2C[C@H]3CCC[C@@H]3C2)c([N+](=O)[O-])cc1OCC ZINC000119041419 930557913 /nfs/dbraw/zinc/55/79/13/930557913.db2.gz GTQISEQACRFLHM-CHWSQXEVSA-N 0 0 363.414 3.656 20 5 FHBDRN O=C(N[C@@H](c1cc2ccccc2o1)c1ccccc1)c1c[nH]nc1[N+](=O)[O-] ZINC000548084334 930569974 /nfs/dbraw/zinc/56/99/74/930569974.db2.gz MACVYLQLVNPIGP-QGZVFWFLSA-N 0 0 362.345 3.584 20 5 FHBDRN CCc1ccc(C(=O)NCc2nc3cc(Cl)ccc3[nH]2)cc1[N+](=O)[O-] ZINC000610436909 930580960 /nfs/dbraw/zinc/58/09/60/930580960.db2.gz YJVQHEHETKRAKN-UHFFFAOYSA-N 0 0 358.785 3.617 20 5 FHBDRN COc1cc(CNc2cc(OC)c([N+](=O)[O-])cc2F)ccc1OC(F)F ZINC000536634909 930589096 /nfs/dbraw/zinc/58/90/96/930589096.db2.gz FUTHOLSXJTZMDM-UHFFFAOYSA-N 0 0 372.299 3.965 20 5 FHBDRN CCN(Cc1ccoc1)C(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000121203528 930608593 /nfs/dbraw/zinc/60/85/93/930608593.db2.gz PPAHKLXZBPCLJI-UHFFFAOYSA-N 0 0 367.199 3.921 20 5 FHBDRN CC(=O)c1ccc(OCc2nc(-c3ccc(F)c(C)c3)no2)c([N+](=O)[O-])c1 ZINC000119076770 930617406 /nfs/dbraw/zinc/61/74/06/930617406.db2.gz OHEZAYYLMQMTQY-UHFFFAOYSA-N 0 0 371.324 3.874 20 5 FHBDRN O=C(c1ccc(Oc2ccccc2)cn1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000580392443 930620356 /nfs/dbraw/zinc/62/03/56/930620356.db2.gz IDLDHDDVSDFSCH-UHFFFAOYSA-N 0 0 361.357 3.985 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])N(C1CC1)[C@H]1CCc2ccccc21 ZINC000109897417 930621629 /nfs/dbraw/zinc/62/16/29/930621629.db2.gz QCTVAHSZGRUKLW-SFHVURJKSA-N 0 0 351.406 3.685 20 5 FHBDRN C[C@](O)(CC(=O)N1CCCCc2ccc([N+](=O)[O-])cc21)c1ccccc1 ZINC001167392975 930625827 /nfs/dbraw/zinc/62/58/27/930625827.db2.gz KRMPXNSSZAUEQX-FQEVSTJZSA-N 0 0 354.406 3.562 20 5 FHBDRN Cc1ccccc1C1=CCN(C(=O)NCCc2ccccc2[N+](=O)[O-])C1 ZINC000548094962 930657912 /nfs/dbraw/zinc/65/79/12/930657912.db2.gz OODJZUKZWYIPDP-UHFFFAOYSA-N 0 0 351.406 3.555 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])s1)N1CCN(C2CC2)c2ccc(Cl)cc21 ZINC000187351798 930683504 /nfs/dbraw/zinc/68/35/04/930683504.db2.gz WHIXXHZYHMRSPI-UHFFFAOYSA-N 0 0 363.826 3.939 20 5 FHBDRN CCN(c1ccc2[nH]ccc2c1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1C ZINC000471578896 930687239 /nfs/dbraw/zinc/68/72/39/930687239.db2.gz VIPUGPSIGCBGLY-UHFFFAOYSA-N 0 0 359.407 3.600 20 5 FHBDRN O=C(N[C@@H](COCc1ccccc1)c1ccccc1)c1cc([N+](=O)[O-])c[nH]1 ZINC000077137082 930693006 /nfs/dbraw/zinc/69/30/06/930693006.db2.gz INSLSKAKHUGVPL-IBGZPJMESA-N 0 0 365.389 3.611 20 5 FHBDRN Cn1c2ccccc2n2c(SCc3cc(F)ccc3[N+](=O)[O-])nnc12 ZINC000175948337 930700840 /nfs/dbraw/zinc/70/08/40/930700840.db2.gz FDJFGXCCCOFCNW-UHFFFAOYSA-N 0 0 357.370 3.561 20 5 FHBDRN Cc1cc(N2CCC3(C2)Oc2ccccc2O3)c2cccc([N+](=O)[O-])c2n1 ZINC000580474966 930722096 /nfs/dbraw/zinc/72/20/96/930722096.db2.gz VSKLGKIPNACRLG-UHFFFAOYSA-N 0 0 363.373 3.829 20 5 FHBDRN CC(C)Cn1ncc(C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c1C(F)F ZINC000155758955 930740226 /nfs/dbraw/zinc/74/02/26/930740226.db2.gz BEVQVOPRUPQHJB-NSHDSACASA-N 0 0 366.368 3.876 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(OCC2CCOCC2)cc1 ZINC000135062851 930756272 /nfs/dbraw/zinc/75/62/72/930756272.db2.gz XAWFNSKJYYKNOU-UHFFFAOYSA-N 0 0 370.405 3.961 20 5 FHBDRN C[C@H](c1cc(F)ccc1F)N(C)C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000046358279 930775441 /nfs/dbraw/zinc/77/54/41/930775441.db2.gz RCRYJHLRIMJDIA-SECBINFHSA-N 0 0 360.320 3.583 20 5 FHBDRN CC[C@H](NS(=O)(=O)c1c(C)cccc1[N+](=O)[O-])c1cc(F)ccc1F ZINC000610136051 930776598 /nfs/dbraw/zinc/77/65/98/930776598.db2.gz JCNMOXBODIHERQ-AWEZNQCLSA-N 0 0 370.377 3.611 20 5 FHBDRN Cc1cc([C@@H](C)NS(=O)(=O)c2cc([N+](=O)[O-])cc(C)c2C)c(C)s1 ZINC000026833830 930787876 /nfs/dbraw/zinc/78/78/76/930787876.db2.gz RVECNRMVKLZKBG-GFCCVEGCSA-N 0 0 368.480 3.929 20 5 FHBDRN CNc1ccc(C(=O)N2CC=C(c3c(F)cccc3F)CC2)cc1[N+](=O)[O-] ZINC000548106967 930794413 /nfs/dbraw/zinc/79/44/13/930794413.db2.gz WEMHOIMXCUJJRL-UHFFFAOYSA-N 0 0 373.359 3.844 20 5 FHBDRN CC(=O)c1ccc(OCC(=O)N[C@@H](c2ccccc2)C(C)C)c([N+](=O)[O-])c1 ZINC000119165765 930796596 /nfs/dbraw/zinc/79/65/96/930796596.db2.gz HRJWFMDZENJCPE-HXUWFJFHSA-N 0 0 370.405 3.690 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)c1ccn(-c2ccccc2Cl)n1 ZINC000050292753 930824548 /nfs/dbraw/zinc/82/45/48/930824548.db2.gz IQUKEJLEKKHHJS-UHFFFAOYSA-N 0 0 372.768 3.695 20 5 FHBDRN O=C(N[C@H](c1ccsc1)c1ccc(Cl)cc1)c1[nH]ncc1[N+](=O)[O-] ZINC000119191290 930831368 /nfs/dbraw/zinc/83/13/68/930831368.db2.gz IHUNKPNGDCKZCD-ZDUSSCGKSA-N 0 0 362.798 3.552 20 5 FHBDRN CC1CCC(CNC(=O)c2cc(Br)cc([N+](=O)[O-])c2)CC1 ZINC001125456866 930836613 /nfs/dbraw/zinc/83/66/13/930836613.db2.gz PPEPENVDSNHEQO-UHFFFAOYSA-N 0 0 355.232 3.913 20 5 FHBDRN O=C1[C@H](Sc2ncccc2[N+](=O)[O-])CCN1c1ccc(Cl)c(F)c1 ZINC000119213716 930893145 /nfs/dbraw/zinc/89/31/45/930893145.db2.gz MLXUZBNDTRPUPX-CYBMUJFWSA-N 0 0 367.789 3.680 20 5 FHBDRN C[C@H]1CCc2ccccc2[C@H]1NC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC001266629196 930907524 /nfs/dbraw/zinc/90/75/24/930907524.db2.gz WAYKOGKQJPISML-QKKBWIMNSA-N 0 0 363.417 3.989 20 5 FHBDRN CC(=O)Nc1ccccc1C(F)(F)C(=O)Nc1ccc([N+](=O)[O-])c(C)c1 ZINC001266631088 930923606 /nfs/dbraw/zinc/92/36/06/930923606.db2.gz MCWGBYCOQMJARK-UHFFFAOYSA-N 0 0 363.320 3.592 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)[C@@]12CCO[C@@H]1CCCC2 ZINC001266631301 930925577 /nfs/dbraw/zinc/92/55/77/930925577.db2.gz RDOLVHYTUJBQLE-HIFRSBDPSA-N 0 0 358.316 3.901 20 5 FHBDRN C[C@@H]1Oc2cc(F)ccc2[C@H]1NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000579749764 930934761 /nfs/dbraw/zinc/93/47/61/930934761.db2.gz UNODTPYBOMLESV-AYVTZFPOSA-N 0 0 350.733 3.639 20 5 FHBDRN C[C@H](NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)[C@@H](C)c1ccccc1 ZINC000119244409 930951839 /nfs/dbraw/zinc/95/18/39/930951839.db2.gz OLXKZNKKFVPLGZ-KGLIPLIRSA-N 0 0 351.406 3.927 20 5 FHBDRN CC[C@]1(C)C[C@@H]1C(=O)N[C@@H](CC(=O)OC(C)C)c1ccccc1[N+](=O)[O-] ZINC000160582831 930974799 /nfs/dbraw/zinc/97/47/99/930974799.db2.gz DCWUTPTVISJTGH-ZRGWGRIASA-N 0 0 362.426 3.530 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CCSc2ccccc21 ZINC000119261400 930975004 /nfs/dbraw/zinc/97/50/04/930975004.db2.gz MPLHZPJAOPNBSG-UHFFFAOYSA-N 0 0 353.403 3.758 20 5 FHBDRN O=[N+]([O-])c1ccc2ncnc(NCc3cc(Br)cs3)c2c1 ZINC000083927669 930997034 /nfs/dbraw/zinc/99/70/34/930997034.db2.gz MFOYJEBZEBVFCG-UHFFFAOYSA-N 0 0 365.212 3.974 20 5 FHBDRN Cc1c(CC(=O)Nc2cc(Br)ccc2O)cccc1[N+](=O)[O-] ZINC000119278106 931019140 /nfs/dbraw/zinc/01/91/40/931019140.db2.gz FIBHKQNSGTXGLM-UHFFFAOYSA-N 0 0 365.183 3.553 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(N2CCC(n3ccc(C(F)(F)F)n3)CC2)c1 ZINC000537604855 931054551 /nfs/dbraw/zinc/05/45/51/931054551.db2.gz DZRIDGGSVJVVRP-UHFFFAOYSA-N 0 0 370.331 3.660 20 5 FHBDRN O=C(N[C@H]1CCCOCC1)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12 ZINC000275933741 931061238 /nfs/dbraw/zinc/06/12/38/931061238.db2.gz IFQQGOIQJAKCIS-ZDUSSCGKSA-N 0 0 372.371 3.671 20 5 FHBDRN O=C(NCCCCCCO)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12 ZINC000275939421 931088529 /nfs/dbraw/zinc/08/85/29/931088529.db2.gz IZWOQJIAKBXRQO-UHFFFAOYSA-N 0 0 374.387 3.654 20 5 FHBDRN C[C@@H]1C[C@H](c2ccccc2)CN1C(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000580766575 931129868 /nfs/dbraw/zinc/12/98/68/931129868.db2.gz LDRKEXRKOXIKTP-OCCSQVGLSA-N 0 0 360.360 3.820 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1NCc1ccc(N3CCCCC3)nc1)CCN2 ZINC000430512654 931135532 /nfs/dbraw/zinc/13/55/32/931135532.db2.gz UUZXVRBTJSIMMO-UHFFFAOYSA-N 0 0 353.426 3.560 20 5 FHBDRN C[C@@H]1C[C@@H]1[C@@H]1C[C@H]1C(=O)O[C@H](c1cccnc1)c1ccccc1[N+](=O)[O-] ZINC001266649740 931136524 /nfs/dbraw/zinc/13/65/24/931136524.db2.gz SWYLVYWQQXBMDN-WCARXYILSA-N 0 0 352.390 3.915 20 5 FHBDRN O=C(O[C@H](c1cccnc1)c1ccccc1[N+](=O)[O-])c1cnc(C2CC2)o1 ZINC001266649913 931136654 /nfs/dbraw/zinc/13/66/54/931136654.db2.gz ZRIJLPXGQQERJY-QGZVFWFLSA-N 0 0 365.345 3.802 20 5 FHBDRN COc1ccc(CNC(=O)c2cc(-c3ccccc3)ns2)cc1[N+](=O)[O-] ZINC000468068499 931140689 /nfs/dbraw/zinc/14/06/89/931140689.db2.gz KTLPDAMBQNUALZ-UHFFFAOYSA-N 0 0 369.402 3.657 20 5 FHBDRN COC(=O)c1cc(NCc2nc(-c3cccs3)c[nH]2)cc(C)c1[N+](=O)[O-] ZINC000580795238 931152744 /nfs/dbraw/zinc/15/27/44/931152744.db2.gz ANDJNLVWKIHUCZ-UHFFFAOYSA-N 0 0 372.406 3.754 20 5 FHBDRN CCOC(=O)C1(C(=O)Nc2cc([N+](=O)[O-])c(Cl)cc2C)CCCC1 ZINC000843550690 931156567 /nfs/dbraw/zinc/15/65/67/931156567.db2.gz GSFPBBXYIFRJMO-UHFFFAOYSA-N 0 0 354.790 3.619 20 5 FHBDRN COc1ccc(Br)cc1CN(C)c1ccc([N+](=O)[O-])c(C)n1 ZINC000471618771 931167152 /nfs/dbraw/zinc/16/71/52/931167152.db2.gz CXILAZVFGBCTCM-UHFFFAOYSA-N 0 0 366.215 3.706 20 5 FHBDRN Nc1c(C(=O)Nc2ccc3c(c2)nc2n3CCCCC2)cccc1[N+](=O)[O-] ZINC000175858230 931170118 /nfs/dbraw/zinc/17/01/18/931170118.db2.gz HZPKIGZDAPADTK-UHFFFAOYSA-N 0 0 365.393 3.505 20 5 FHBDRN C[C@@H](c1ccncc1)N(C)C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000119331691 931217194 /nfs/dbraw/zinc/21/71/94/931217194.db2.gz GNAOJAVZUAKXNZ-JTQLQIEISA-N 0 0 364.199 3.586 20 5 FHBDRN CCOCCCNC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(OC)cc1 ZINC000048119061 931224512 /nfs/dbraw/zinc/22/45/12/931224512.db2.gz UIZKMSKLNXGYKV-UHFFFAOYSA-N 0 0 374.393 3.552 20 5 FHBDRN CCOc1ccc(NC(=O)CN2C[C@H](C)[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000177828860 931234461 /nfs/dbraw/zinc/23/44/61/931234461.db2.gz GYRNYZAJOCARJG-VBKZILBWSA-N 0 0 369.421 3.625 20 5 FHBDRN COc1ccc2[nH]cc(CC(=O)N[C@H](C)c3ccc(C)c([N+](=O)[O-])c3)c2c1 ZINC000177837668 931267241 /nfs/dbraw/zinc/26/72/41/931267241.db2.gz GQFLTPFWYWEQDH-CYBMUJFWSA-N 0 0 367.405 3.813 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)Cc2ccc(OC(F)F)cc2)cc1[N+](=O)[O-] ZINC000177839265 931267553 /nfs/dbraw/zinc/26/75/53/931267553.db2.gz JRHDLCFWLAACRS-GFCCVEGCSA-N 0 0 364.348 3.925 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)c2coc(Br)c2)cc1[N+](=O)[O-] ZINC000177840499 931283800 /nfs/dbraw/zinc/28/38/00/931283800.db2.gz QCOQSFKIESLDFK-VIFPVBQESA-N 0 0 353.172 3.750 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)c2ccc(-n3cccn3)cc2)cc1[N+](=O)[O-] ZINC000177845330 931285464 /nfs/dbraw/zinc/28/54/64/931285464.db2.gz LGWGXARNTLQRTG-CQSZACIVSA-N 0 0 350.378 3.580 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)c2ccn(-c3ccc(F)cc3)n2)cc1[N+](=O)[O-] ZINC000177846363 931286154 /nfs/dbraw/zinc/28/61/54/931286154.db2.gz QCFZFIQLWWPDMW-ZDUSSCGKSA-N 0 0 368.368 3.719 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1cc(-c2ccc(F)cc2)on1 ZINC000177847294 931288332 /nfs/dbraw/zinc/28/83/32/931288332.db2.gz VFSXYRAEWDQNHY-UHFFFAOYSA-N 0 0 355.325 3.661 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)c2ccc(C(F)(F)F)nc2)cc1[N+](=O)[O-] ZINC000177844904 931289624 /nfs/dbraw/zinc/28/96/24/931289624.db2.gz AQFSFUSXIOASBJ-SNVBAGLBSA-N 0 0 353.300 3.808 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)[C@@H](C)n2cnc3ccccc32)cc1[N+](=O)[O-] ZINC000177850069 931291119 /nfs/dbraw/zinc/29/11/19/931291119.db2.gz GVWSGLMDCSWFTC-UONOGXRCSA-N 0 0 352.394 3.691 20 5 FHBDRN O=C(c1ccc(Cl)cc1[N+](=O)[O-])N1CCCC[C@@H]([C@@H]2CCOC2)C1 ZINC000891340530 931318133 /nfs/dbraw/zinc/31/81/33/931318133.db2.gz GYDYAHVNMACVFS-CHWSQXEVSA-N 0 0 352.818 3.527 20 5 FHBDRN C[C@@H](NC(=O)N1CCC[C@H](Nc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000177853384 931323551 /nfs/dbraw/zinc/32/35/51/931323551.db2.gz GPKGFPOBZFBQPR-QAPCUYQASA-N 0 0 368.437 3.942 20 5 FHBDRN CCOc1ccc(C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1OC ZINC000177858475 931329701 /nfs/dbraw/zinc/32/97/01/931329701.db2.gz PUCJXIYVOFFVIH-ZDUSSCGKSA-N 0 0 358.394 3.802 20 5 FHBDRN Cc1nc(-c2cccc(NC(=O)c3cc(Cl)cc([N+](=O)[O-])c3)c2)no1 ZINC000119354235 931404510 /nfs/dbraw/zinc/40/45/10/931404510.db2.gz LCHVSNRTZAXNES-UHFFFAOYSA-N 0 0 358.741 3.859 20 5 FHBDRN C[C@@H](CNC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)Cc1cccs1 ZINC000610191426 931424848 /nfs/dbraw/zinc/42/48/48/931424848.db2.gz NJDKWUNYXCWBAU-GFCCVEGCSA-N 0 0 359.451 3.839 20 5 FHBDRN CCn1c(C)nc([N+](=O)[O-])c1Sc1n[nH]c(CCC2CCCC2)n1 ZINC000580973847 931435550 /nfs/dbraw/zinc/43/55/50/931435550.db2.gz TVSIIASMYBLXRK-UHFFFAOYSA-N 0 0 350.448 3.512 20 5 FHBDRN Cc1cnc([C@@H](NC(=O)N(C)Cc2ccccc2[N+](=O)[O-])C2CC2)s1 ZINC000175875488 931439983 /nfs/dbraw/zinc/43/99/83/931439983.db2.gz BDILTNWBUGXFAA-HNNXBMFYSA-N 0 0 360.439 3.652 20 5 FHBDRN CC(C)C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1N)c1nc2ccccc2[nH]1 ZINC000175880335 931455981 /nfs/dbraw/zinc/45/59/81/931455981.db2.gz IYWAVHBVGSCUHC-OAHLLOKOSA-N 0 0 367.409 3.571 20 5 FHBDRN CN(CC(=O)N1CC(C)(C)[C@@H]1c1cccs1)c1ccccc1[N+](=O)[O-] ZINC000581032589 931478344 /nfs/dbraw/zinc/47/83/44/931478344.db2.gz YUNJVWLXVLNMHF-KRWDZBQOSA-N 0 0 359.451 3.702 20 5 FHBDRN O=C(COc1cc(Cl)ccc1[N+](=O)[O-])NCc1ccc(Cl)cc1 ZINC000121268644 931520531 /nfs/dbraw/zinc/52/05/31/931520531.db2.gz VMWZBCWLNJARSC-UHFFFAOYSA-N 0 0 355.177 3.597 20 5 FHBDRN CC[C@@H](C)[C@@H](O)CNC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000177902124 931524482 /nfs/dbraw/zinc/52/44/82/931524482.db2.gz UUMLFEXWKVVOKF-DYVFJYSZSA-N 0 0 374.462 3.883 20 5 FHBDRN O=C([C@@H]1CC[C@H](Nc2ccc3ncccc3c2[N+](=O)[O-])C1)N1CCCCC1 ZINC000581049796 931526264 /nfs/dbraw/zinc/52/62/64/931526264.db2.gz PXUVBKYVVOJODY-CABCVRRESA-N 0 0 368.437 3.736 20 5 FHBDRN Cc1cnc([C@H](C)NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)s1 ZINC000177912023 931553108 /nfs/dbraw/zinc/55/31/08/931553108.db2.gz MVSAXHCAHDGRQH-JTQLQIEISA-N 0 0 374.447 3.974 20 5 FHBDRN Cc1cc(NC[C@H](CO)Cc2ccco2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000581104454 931570701 /nfs/dbraw/zinc/57/07/01/931570701.db2.gz SFCSWUUWMJXIRV-LLVKDONJSA-N 0 0 358.316 3.778 20 5 FHBDRN COCc1ccc(SCCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)cc1 ZINC000610480420 931578086 /nfs/dbraw/zinc/57/80/86/931578086.db2.gz DMDHYZBMRIYCQI-UHFFFAOYSA-N 0 0 374.418 3.832 20 5 FHBDRN COc1cc(C(=O)Nc2cc(Cl)c(N)c(Cl)c2)ccc1[N+](=O)[O-] ZINC000160771131 931585375 /nfs/dbraw/zinc/58/53/75/931585375.db2.gz QMZSVNSNMPXYCL-UHFFFAOYSA-N 0 0 356.165 3.745 20 5 FHBDRN O=[N+]([O-])c1cc(Br)cnc1NCCc1c[nH]c2ccccc12 ZINC000096581281 931620838 /nfs/dbraw/zinc/62/08/38/931620838.db2.gz HJPUZZPDBYPTIN-UHFFFAOYSA-N 0 0 361.199 3.888 20 5 FHBDRN Cc1cc(OCC(=O)N[C@H]2CCC[C@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000430539412 931704872 /nfs/dbraw/zinc/70/48/72/931704872.db2.gz DVGIIMBQZDHISU-ROUUACIJSA-N 0 0 354.406 3.735 20 5 FHBDRN O=c1[nH]c(N2CCC(F)(c3ccccc3)CC2)nc2ccc([N+](=O)[O-])cc12 ZINC000561324052 931736758 /nfs/dbraw/zinc/73/67/58/931736758.db2.gz BDIPFPQHHHOMDR-UHFFFAOYSA-N 0 0 368.368 3.709 20 5 FHBDRN CN(C[C@H]1CCCO[C@@H]1c1ccccc1)C(=O)c1ccc([N+](=O)[O-])cc1F ZINC000050861877 931742563 /nfs/dbraw/zinc/74/25/63/931742563.db2.gz WBBRPLSAPRKZRC-DNVCBOLYSA-N 0 0 372.396 3.974 20 5 FHBDRN C[C@@H]1C[C@@H](CCNC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C[C@H](C)O1 ZINC000581256587 931744169 /nfs/dbraw/zinc/74/41/69/931744169.db2.gz DYUZFJBAJMNQEI-ZSBIGDGJSA-N 0 0 355.822 3.963 20 5 FHBDRN CNc1ccc(C(=O)N2CC[C@@](F)(c3ccccc3C)C2)cc1[N+](=O)[O-] ZINC000581263026 931754896 /nfs/dbraw/zinc/75/48/96/931754896.db2.gz VOLBUYYSYDXJTN-IBGZPJMESA-N 0 0 357.385 3.656 20 5 FHBDRN CN(C[C@H]1CCCO[C@@H]1c1ccccc1)C(=O)c1cccc([N+](=O)[O-])c1 ZINC000050866434 931758887 /nfs/dbraw/zinc/75/88/87/931758887.db2.gz VCNWUDAZYQIXSH-IEBWSBKVSA-N 0 0 354.406 3.835 20 5 FHBDRN COc1ccc(OCCN2CCc3c4ccccc4[nH]c3C2)c([N+](=O)[O-])c1 ZINC000126368122 931772242 /nfs/dbraw/zinc/77/22/42/931772242.db2.gz HNQKPEQDSHEALR-UHFFFAOYSA-N 0 0 367.405 3.522 20 5 FHBDRN O=C(N[C@@H]1CCCN(c2ccccc2Cl)C1)c1ccccc1[N+](=O)[O-] ZINC000126389450 931781204 /nfs/dbraw/zinc/78/12/04/931781204.db2.gz YXULGUMJFNCJRU-CYBMUJFWSA-N 0 0 359.813 3.647 20 5 FHBDRN CC(C)(NC(=O)[C@H]1COc2ccc(Cl)cc2C1)c1ccc([N+](=O)[O-])cc1 ZINC000430550745 931799347 /nfs/dbraw/zinc/79/93/47/931799347.db2.gz ZQGUWZQCGNVGNG-CYBMUJFWSA-N 0 0 374.824 3.851 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@@H](C)COc1c(C)cccc1C ZINC000561334611 931832318 /nfs/dbraw/zinc/83/23/18/931832318.db2.gz PQHHNDCBKOKIHK-HNNXBMFYSA-N 0 0 372.421 3.808 20 5 FHBDRN O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)C(=O)N1CCCC12CCCCC2 ZINC000785039615 931835348 /nfs/dbraw/zinc/83/53/48/931835348.db2.gz OUIHTKUTLNGGPY-UHFFFAOYSA-N 0 0 365.817 3.512 20 5 FHBDRN O=C(/C=C\c1ccccc1Cl)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000255290364 931851754 /nfs/dbraw/zinc/85/17/54/931851754.db2.gz PHEVRFBKOVYUHB-HJWRWDBZSA-N 0 0 371.824 3.610 20 5 FHBDRN CCCc1nc(COC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2C)cs1 ZINC000728327348 931887934 /nfs/dbraw/zinc/88/79/34/931887934.db2.gz IIZWECMOCUGBNM-UHFFFAOYSA-N 0 0 365.367 3.577 20 5 FHBDRN COc1ccc(C)c2c1N(C(=O)COc1ccc([N+](=O)[O-])c(C)c1)CCC2 ZINC000430565569 931888187 /nfs/dbraw/zinc/88/81/87/931888187.db2.gz AISOGSCHEHHNLZ-UHFFFAOYSA-N 0 0 370.405 3.578 20 5 FHBDRN Cc1c(-c2nc(-c3ccc([N+](=O)[O-])cc3)no2)cnn1-c1ccccc1F ZINC000544934680 931902413 /nfs/dbraw/zinc/90/24/13/931902413.db2.gz FLXBVPYEQHCEIC-UHFFFAOYSA-N 0 0 365.324 3.945 20 5 FHBDRN C[C@@H]1[C@@H](C(=O)Nc2ccnn2-c2ccc([N+](=O)[O-])cc2)[C@@H]1c1ccccc1 ZINC000430570073 931904471 /nfs/dbraw/zinc/90/44/71/931904471.db2.gz IEBPTWMGJRAFCP-FASAQXTFSA-N 0 0 362.389 3.769 20 5 FHBDRN Cc1nn(C(C)(C)C)cc1[C@@H](C)NC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000156178087 931923826 /nfs/dbraw/zinc/92/38/26/931923826.db2.gz NJEKMFDUCZHYGL-SNVBAGLBSA-N 0 0 364.833 3.999 20 5 FHBDRN O=C(Nc1ccnn1-c1ccc([N+](=O)[O-])cc1)c1cc2cccc(F)c2o1 ZINC000610231069 931928590 /nfs/dbraw/zinc/92/85/90/931928590.db2.gz LJGQILZRBSZTKJ-UHFFFAOYSA-N 0 0 366.308 3.918 20 5 FHBDRN COc1ccc(NC(=O)N2Cc3ccccc3C3(CC3)C2)cc1[N+](=O)[O-] ZINC000548162197 931944102 /nfs/dbraw/zinc/94/41/02/931944102.db2.gz ZBMGOAGSNGVOCS-UHFFFAOYSA-N 0 0 353.378 3.683 20 5 FHBDRN COC(=O)[C@H](NCc1cccc([N+](=O)[O-])c1)c1ccc(Cl)cc1Cl ZINC000610341581 931967576 /nfs/dbraw/zinc/96/75/76/931967576.db2.gz ADPABIJSSRHWLD-OAHLLOKOSA-N 0 0 369.204 3.906 20 5 FHBDRN CC[C@@H]1CC[C@H](C)N1C(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000537885448 931984554 /nfs/dbraw/zinc/98/45/54/931984554.db2.gz FQUJXCBPOVOHTB-WDEREUQCSA-N 0 0 360.332 3.939 20 5 FHBDRN COc1ccc(CC(=O)NC[C@@H]2CCCC[C@H]2C(F)(F)F)cc1[N+](=O)[O-] ZINC000610503512 931998446 /nfs/dbraw/zinc/99/84/46/931998446.db2.gz CPKPVLPMMNGTMX-QWHCGFSZSA-N 0 0 374.359 3.631 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)N(C)[C@H](C)c2cccs2)cc1C ZINC000060498234 932015005 /nfs/dbraw/zinc/01/50/05/932015005.db2.gz XXOPQEUMLLBBIS-GFCCVEGCSA-N 0 0 354.453 3.655 20 5 FHBDRN Cc1cccc(NC(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])c1O ZINC000610506043 932033018 /nfs/dbraw/zinc/03/30/18/932033018.db2.gz WRXXIASQVVSSRH-JTQLQIEISA-N 0 0 350.758 3.668 20 5 FHBDRN Cc1cccc(N(C)C(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)n1 ZINC000135237361 932078928 /nfs/dbraw/zinc/07/89/28/932078928.db2.gz ZWYTVVUSRMHGOE-UHFFFAOYSA-N 0 0 354.391 3.698 20 5 FHBDRN CC(=O)c1cc(NCc2ccc(C)cc2O[C@@H]2CCOC2)ccc1[N+](=O)[O-] ZINC000581446274 932095059 /nfs/dbraw/zinc/09/50/59/932095059.db2.gz MNZGQJFXQBEDOJ-QGZVFWFLSA-N 0 0 370.405 3.886 20 5 FHBDRN C[C@@H](OC(=O)CCn1cc([N+](=O)[O-])cn1)c1ccc(C(F)(F)F)cc1 ZINC000728339122 932108710 /nfs/dbraw/zinc/10/87/10/932108710.db2.gz QQQZKTOIBWVAFD-SNVBAGLBSA-N 0 0 357.288 3.505 20 5 FHBDRN O=C(COC(=O)[C@@H]1C[C@H]1c1cccc(Cl)c1)c1ccc([N+](=O)[O-])cc1 ZINC000728338661 932117000 /nfs/dbraw/zinc/11/70/00/932117000.db2.gz GFEAEVIYWJSDTP-JKSUJKDBSA-N 0 0 359.765 3.778 20 5 FHBDRN O=C(Nc1ccccc1)C1CCN(Cc2ccc([N+](=O)[O-])c(F)c2)CC1 ZINC000276307150 932159594 /nfs/dbraw/zinc/15/95/94/932159594.db2.gz LEAYDKGBPVTVGA-UHFFFAOYSA-N 0 0 357.385 3.585 20 5 FHBDRN CCN(Cc1ccoc1)C(=O)NCCCNc1ccc(C)cc1[N+](=O)[O-] ZINC000121398270 932167738 /nfs/dbraw/zinc/16/77/38/932167738.db2.gz KXEVGUTVDZKTAK-UHFFFAOYSA-N 0 0 360.414 3.530 20 5 FHBDRN Cn1ccc2cccc(NC(=O)c3ccc(NC4CC4)c([N+](=O)[O-])c3)c21 ZINC000471669569 932205596 /nfs/dbraw/zinc/20/55/96/932205596.db2.gz XKOIZFKJQBEDOU-UHFFFAOYSA-N 0 0 350.378 3.913 20 5 FHBDRN C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)Nc3ccncc3)cc2[N+](=O)[O-])C1 ZINC000022260344 932231595 /nfs/dbraw/zinc/23/15/95/932231595.db2.gz YQRVKPIPSOQQPL-OKILXGFUSA-N 0 0 354.410 3.724 20 5 FHBDRN Cc1cc2c(s1)N(c1cnc([N+](=O)[O-])cn1)c1ccccc1NC2=N ZINC001167469756 932240634 /nfs/dbraw/zinc/24/06/34/932240634.db2.gz XKWPGAHDWBPNBO-UHFFFAOYSA-N 0 0 352.379 3.575 20 5 FHBDRN Cc1ccc(-c2nc(CC(=O)OCCc3ccc([N+](=O)[O-])cc3)cs2)o1 ZINC000051078079 932259610 /nfs/dbraw/zinc/25/96/10/932259610.db2.gz DSNWFCMJERLWSX-UHFFFAOYSA-N 0 0 372.402 3.948 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)NCc1cccc(-n2ccnc2)c1 ZINC000581577909 932269495 /nfs/dbraw/zinc/26/94/95/932269495.db2.gz AVMRDFMOVQAWAP-UHFFFAOYSA-N 0 0 365.393 3.665 20 5 FHBDRN Cn1cc(C(=O)N[C@@H]2CCC[C@H](C3CC3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000157253274 932269751 /nfs/dbraw/zinc/26/97/51/932269751.db2.gz SBLLXEMPUCDBCR-JKSUJKDBSA-N 0 0 368.437 3.694 20 5 FHBDRN CCc1cccc(C)c1NC(=O)C(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000178067687 932271466 /nfs/dbraw/zinc/27/14/66/932271466.db2.gz HVFAXFHQPSAHEO-CQSZACIVSA-N 0 0 369.421 3.590 20 5 FHBDRN CC(C)n1nc2c(c1NC(=O)c1ccc(NC3CC3)c([N+](=O)[O-])c1)CCC2 ZINC000471672664 932280966 /nfs/dbraw/zinc/28/09/66/932280966.db2.gz ZUXXHXQZWLSTRF-UHFFFAOYSA-N 0 0 369.425 3.688 20 5 FHBDRN C[C@H]1c2ccccc2OCCN1c1ncc([N+](=O)[O-])cc1Br ZINC000610512464 932283966 /nfs/dbraw/zinc/28/39/66/932283966.db2.gz FDTPUXTXQLGUER-JTQLQIEISA-N 0 0 364.199 3.712 20 5 FHBDRN C[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000246486150 932289735 /nfs/dbraw/zinc/28/97/35/932289735.db2.gz YSXXDQAAFHXAPS-BPQIPLTHSA-N 0 0 371.481 3.991 20 5 FHBDRN C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)Nc3ccccc3N)cc2[N+](=O)[O-])C1 ZINC000119404429 932297683 /nfs/dbraw/zinc/29/76/83/932297683.db2.gz UMQPHARGPRGJQY-OKILXGFUSA-N 0 0 368.437 3.912 20 5 FHBDRN O=C(Nc1ccc(O[C@@H]2CCOC2)cc1)[C@H]1C[C@H]1c1cccc([N+](=O)[O-])c1 ZINC000933334342 932333732 /nfs/dbraw/zinc/33/37/32/932333732.db2.gz HBLVKAAZPDPBJE-QYZOEREBSA-N 0 0 368.389 3.505 20 5 FHBDRN Cc1cnc([C@@H](C)NC(=O)c2ccc(Br)cc2[N+](=O)[O-])s1 ZINC000430619310 932341199 /nfs/dbraw/zinc/34/11/99/932341199.db2.gz AKTWSSCONXRICS-MRVPVSSYSA-N 0 0 370.228 3.613 20 5 FHBDRN C[C@@H](NC(=O)/C=C\c1ccc([N+](=O)[O-])cc1)c1cccc(-n2cccn2)c1 ZINC000255330845 932347895 /nfs/dbraw/zinc/34/78/95/932347895.db2.gz OALWLTVUBYPFJE-MEODZPNASA-N 0 0 362.389 3.671 20 5 FHBDRN COc1c(C(=O)N[C@@H]2CC[C@H](c3ccc(F)cc3)C2)cccc1[N+](=O)[O-] ZINC000477149615 932353110 /nfs/dbraw/zinc/35/31/10/932353110.db2.gz GGADJHUOAYNFNR-DZGCQCFKSA-N 0 0 358.369 3.809 20 5 FHBDRN CC[C@H](c1ccccc1)[C@H]1CCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000477159188 932360642 /nfs/dbraw/zinc/36/06/42/932360642.db2.gz JBSRENOZFRFBRB-RTBURBONSA-N 0 0 374.462 3.942 20 5 FHBDRN Cc1c(NC(=O)N2CCOCC[C@H]2C)cc([N+](=O)[O-])cc1C(F)(F)F ZINC000933344094 932361817 /nfs/dbraw/zinc/36/18/17/932361817.db2.gz WXOBWLCFONUVEZ-SECBINFHSA-N 0 0 361.320 3.565 20 5 FHBDRN C[C@H](NC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-])c1cncs1 ZINC000477177395 932371698 /nfs/dbraw/zinc/37/16/98/932371698.db2.gz RXBXDJOGDYPWLP-QMMMGPOBSA-N 0 0 357.844 3.674 20 5 FHBDRN CC(C)(C)c1ccc(CCNC(=O)Cc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000477312688 932463405 /nfs/dbraw/zinc/46/34/05/932463405.db2.gz WLEDCEPLMYYLEZ-UHFFFAOYSA-N 0 0 358.413 3.933 20 5 FHBDRN C[C@@H](CNC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)c1ccncc1 ZINC000610526589 932483631 /nfs/dbraw/zinc/48/36/31/932483631.db2.gz PKEPKTIIQYQBPR-LBPRGKRZSA-N 0 0 368.418 3.647 20 5 FHBDRN CO[C@H](c1ccc(Cl)cc1)[C@@H](C)NC(=O)c1ccc([N+](=O)[O-])cc1F ZINC000127257886 932503973 /nfs/dbraw/zinc/50/39/73/932503973.db2.gz LJRHAEFDQCECAL-HWPZZCPQSA-N 0 0 366.776 3.893 20 5 FHBDRN O=C(c1ccc(Cl)c2cccnc12)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000121445101 932544073 /nfs/dbraw/zinc/54/40/73/932544073.db2.gz ZRHVJPVEIRCOJE-UHFFFAOYSA-N 0 0 367.792 3.995 20 5 FHBDRN Cc1onc(-c2ccncc2)c1C(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000127282022 932575569 /nfs/dbraw/zinc/57/55/69/932575569.db2.gz JUSOTBAQSQSMSJ-GFCCVEGCSA-N 0 0 366.377 3.753 20 5 FHBDRN Cc1ccccc1SCC(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000581749304 932600969 /nfs/dbraw/zinc/60/09/69/932600969.db2.gz NRAXRXQRQKIPRT-UHFFFAOYSA-N 0 0 369.446 3.836 20 5 FHBDRN C[C@H]1C[C@H](NC(=O)OC(C)(C)C)CCN1Cc1csc([N+](=O)[O-])c1 ZINC000134630955 932612492 /nfs/dbraw/zinc/61/24/92/932612492.db2.gz OQLUXANVNLSTAZ-WCQYABFASA-N 0 0 355.460 3.534 20 5 FHBDRN COc1ccc(N(C)C(=O)c2ccc([N+](=O)[O-])c3cccnc23)cc1F ZINC000157935093 932655825 /nfs/dbraw/zinc/65/58/25/932655825.db2.gz UWYYSRRXXPNPLV-UHFFFAOYSA-N 0 0 355.325 3.567 20 5 FHBDRN CCC[C@H]1[C@H](C)CCCN1C(=O)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000785068843 932657043 /nfs/dbraw/zinc/65/70/43/932657043.db2.gz ZPNDHCCTBISJAR-RISCZKNCSA-N 0 0 367.833 3.614 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)O[C@@H](C)c1nc2ccc(Cl)cc2n1C ZINC000176026695 932675461 /nfs/dbraw/zinc/67/54/61/932675461.db2.gz ZBJJQPFRKXYKAY-JTQLQIEISA-N 0 0 374.784 3.756 20 5 FHBDRN C[C@H](C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)N1C2CCC1CC2 ZINC000610538542 932682815 /nfs/dbraw/zinc/68/28/15/932682815.db2.gz QWWFATQHOGTVGX-LMWSTFAQSA-N 0 0 372.450 3.672 20 5 FHBDRN COc1ccc2c(c1)[C@H](NC(=O)c1cc(F)c(F)cc1[N+](=O)[O-])CCC2 ZINC001266821497 932698700 /nfs/dbraw/zinc/69/87/00/932698700.db2.gz NISXTYVSTLHJGZ-MRXNPFEDSA-N 0 0 362.332 3.689 20 5 FHBDRN CCOc1ccc([C@H]2CCCN2C(=O)c2cccc([N+](=O)[O-])c2N)cc1 ZINC000178153655 932701170 /nfs/dbraw/zinc/70/11/70/932701170.db2.gz ULTHHQCYQGOYTG-MRXNPFEDSA-N 0 0 355.394 3.553 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(NCc2ccc(NC(=O)c3ccco3)cc2)n1 ZINC000178161610 932704794 /nfs/dbraw/zinc/70/47/94/932704794.db2.gz JEYNMTKXKIBCAJ-UHFFFAOYSA-N 0 0 352.350 3.756 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N(C)Cc1ccc(Cl)nc1 ZINC000023891417 932706833 /nfs/dbraw/zinc/70/68/33/932706833.db2.gz APEMSNCHDOLELE-LLVKDONJSA-N 0 0 365.842 3.782 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)C1(CCOCc2ccccc2)CC1 ZINC000471726677 932718570 /nfs/dbraw/zinc/71/85/70/932718570.db2.gz LGOAHCUYUUIOGC-UHFFFAOYSA-N 0 0 368.433 3.940 20 5 FHBDRN C[C@H]1C[C@H]1c1ccc(CN(C(=O)c2cccc([N+](=O)[O-])c2N)C2CC2)o1 ZINC000178164835 932727266 /nfs/dbraw/zinc/72/72/66/932727266.db2.gz ICTDREBMSNIBBP-XHDPSFHLSA-N 0 0 355.394 3.698 20 5 FHBDRN CCCc1cc(C(=O)N2CCS[C@@H]2c2ccc([N+](=O)[O-])cc2)cc(=O)[nH]1 ZINC000933505121 932739786 /nfs/dbraw/zinc/73/97/86/932739786.db2.gz WIFKVJPEPKOHCE-GOSISDBHSA-N 0 0 373.434 3.536 20 5 FHBDRN CCOC(=O)C[C@H](C)Nc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000471740063 932755551 /nfs/dbraw/zinc/75/55/51/932755551.db2.gz WVPYZZQJXIEMNZ-ZDUSSCGKSA-N 0 0 356.378 3.579 20 5 FHBDRN Cc1nn(C)c(N2CCC[C@@H](c3nc4ccccc4s3)C2)c1[N+](=O)[O-] ZINC000051261830 932757570 /nfs/dbraw/zinc/75/75/70/932757570.db2.gz MDTLKAPNEZKHRC-GFCCVEGCSA-N 0 0 357.439 3.630 20 5 FHBDRN Nc1c(C(=O)Nc2ccc(Oc3ccncc3)cc2)cccc1[N+](=O)[O-] ZINC000178183283 932789928 /nfs/dbraw/zinc/78/99/28/932789928.db2.gz NKWLTXABKJTJIN-UHFFFAOYSA-N 0 0 350.334 3.617 20 5 FHBDRN O=C(c1cc(Cl)c(F)c([N+](=O)[O-])c1)N1Cc2cc(F)c(F)cc2C1 ZINC001143400254 932792968 /nfs/dbraw/zinc/79/29/68/932792968.db2.gz BWSQEMGDYZTOHY-UHFFFAOYSA-N 0 0 356.687 3.822 20 5 FHBDRN COc1cccc(C(=O)Nc2ccc(C(F)(F)F)nc2C)c1[N+](=O)[O-] ZINC000512406617 932820958 /nfs/dbraw/zinc/82/09/58/932820958.db2.gz QSSNAQYDVMABLK-UHFFFAOYSA-N 0 0 355.272 3.578 20 5 FHBDRN Cc1cc(F)cc(C(=O)NCCc2nc3ccccc3s2)c1[N+](=O)[O-] ZINC000121491948 932826696 /nfs/dbraw/zinc/82/66/96/932826696.db2.gz UILFCKFJWWWUEO-UHFFFAOYSA-N 0 0 359.382 3.625 20 5 FHBDRN COC[C@@H](Nc1ccc(/C=C\C(=O)OC)cc1[N+](=O)[O-])c1ccccc1 ZINC000255369429 932828434 /nfs/dbraw/zinc/82/84/34/932828434.db2.gz VWIAHIBEFXEVQT-FPISAVPCSA-N 0 0 356.378 3.581 20 5 FHBDRN COc1cc(Cc2noc(CCCC[C@@H](C)C(C)=O)n2)ccc1[N+](=O)[O-] ZINC000548288608 932840230 /nfs/dbraw/zinc/84/02/30/932840230.db2.gz RHHWRAOQACJOPR-GFCCVEGCSA-N 0 0 361.398 3.515 20 5 FHBDRN CCOc1ccc(C(=O)N(CC2CCC2)CC(F)(F)F)cc1[N+](=O)[O-] ZINC000175951847 932855399 /nfs/dbraw/zinc/85/53/99/932855399.db2.gz WQZHDLSQBRIVHB-UHFFFAOYSA-N 0 0 360.332 3.798 20 5 FHBDRN CC(C)n1cnnc1SCc1ccc(Br)cc1[N+](=O)[O-] ZINC000424090518 932860263 /nfs/dbraw/zinc/86/02/63/932860263.db2.gz XWMLOVXOCMWYRF-UHFFFAOYSA-N 0 0 357.233 3.822 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ccncc2C(=O)C(C)C)c1 ZINC000187457941 932878275 /nfs/dbraw/zinc/87/82/75/932878275.db2.gz YFBWPWSNLBYNIS-UHFFFAOYSA-N 0 0 359.407 3.803 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(N2CCO[C@@H](c3ccc(F)c(Cl)c3)C2)n1 ZINC000178208697 932881070 /nfs/dbraw/zinc/88/10/70/932881070.db2.gz WEEURIJSLQRQFD-OAHLLOKOSA-N 0 0 351.765 3.669 20 5 FHBDRN COCCC1(CNC(=O)CCNc2ccccc2[N+](=O)[O-])CCCCC1 ZINC000187468679 932893272 /nfs/dbraw/zinc/89/32/72/932893272.db2.gz ZHBBYTCUNIZZHA-UHFFFAOYSA-N 0 0 363.458 3.500 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)NCc1nc2ccccc2s1 ZINC000588435730 932935004 /nfs/dbraw/zinc/93/50/04/932935004.db2.gz SLGMHGKPIQHFOU-BENRWUELSA-N 0 0 353.403 3.924 20 5 FHBDRN CC(C)C(NC(=O)Cc1ccc([N+](=O)[O-])cc1Br)C(C)C ZINC000610911894 932937069 /nfs/dbraw/zinc/93/70/69/932937069.db2.gz BNHOMFCDEQJGCY-UHFFFAOYSA-N 0 0 357.248 3.697 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])Nc1ccccc1OCC(F)F ZINC000178240148 932947125 /nfs/dbraw/zinc/94/71/25/932947125.db2.gz ZNAPDNUAWVPMBB-UHFFFAOYSA-N 0 0 351.309 3.560 20 5 FHBDRN O=C(NC[C@@H]1CCC2(CCCCC2)O1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000276688763 932976224 /nfs/dbraw/zinc/97/62/24/932976224.db2.gz GRMFWDUUDJTUSZ-LBPRGKRZSA-N 0 0 352.818 3.860 20 5 FHBDRN COc1ccc(Br)cc1COc1ncc(C)cc1[N+](=O)[O-] ZINC000178279863 933021829 /nfs/dbraw/zinc/02/18/29/933021829.db2.gz OFOPVRRCAMZOKA-UHFFFAOYSA-N 0 0 353.172 3.648 20 5 FHBDRN CCc1ccc(C(=O)NCc2cc(-c3ccccc3)no2)cc1[N+](=O)[O-] ZINC000471816745 933024016 /nfs/dbraw/zinc/02/40/16/933024016.db2.gz PWSODMSPRNJGOW-UHFFFAOYSA-N 0 0 351.362 3.742 20 5 FHBDRN CC[C@@H](NC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1)c1ccc2c(c1)OCCO2 ZINC000581918597 933033237 /nfs/dbraw/zinc/03/32/37/933033237.db2.gz SSXJWZGAQJIWFH-CXAGYDPISA-N 0 0 370.405 3.737 20 5 FHBDRN COc1ccc2cc(C(=O)NCCc3cccc([N+](=O)[O-])c3)sc2c1 ZINC001266864113 933042312 /nfs/dbraw/zinc/04/23/12/933042312.db2.gz VLBWFQNKZRVPDU-UHFFFAOYSA-N 0 0 356.403 3.791 20 5 FHBDRN COCCOc1ccc(F)cc1NC(=O)/C(C)=C\c1ccc([N+](=O)[O-])cc1 ZINC000588438316 933055428 /nfs/dbraw/zinc/05/54/28/933055428.db2.gz AZSLZAMWIQISTL-QBFSEMIESA-N 0 0 374.368 3.801 20 5 FHBDRN CCn1c(SCc2cccnc2OC)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000178294871 933068179 /nfs/dbraw/zinc/06/81/79/933068179.db2.gz MFSBLWIXOVISPI-UHFFFAOYSA-N 0 0 371.422 3.569 20 5 FHBDRN CC(C)[C@H]1CCCN1Cc1cc(I)cc([N+](=O)[O-])c1 ZINC001167490542 933076056 /nfs/dbraw/zinc/07/60/56/933076056.db2.gz CZRYHBHEVXWOIU-CQSZACIVSA-N 0 0 374.222 3.820 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N1C[C@@H](c2ccccc2)O[C@@H](C)C1 ZINC000588444565 933102221 /nfs/dbraw/zinc/10/22/21/933102221.db2.gz URADWNNYEZOMJE-ZNGRDIDMSA-N 0 0 366.417 3.987 20 5 FHBDRN Cc1cc(S(=O)(=O)NCc2cccc(C(F)F)c2)c(C)cc1[N+](=O)[O-] ZINC001211523881 933104402 /nfs/dbraw/zinc/10/44/02/933104402.db2.gz OQMUCDQURGURHG-UHFFFAOYSA-N 0 0 370.377 3.628 20 5 FHBDRN COc1c(C)cnc(CN(C)C(=O)/C(C)=C\c2ccc([N+](=O)[O-])cc2)c1C ZINC000588444934 933108251 /nfs/dbraw/zinc/10/82/51/933108251.db2.gz TVGKSUGESFFZTE-RAXLEYEMSA-N 0 0 369.421 3.677 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)OCc1nccn1CC(F)(F)F ZINC000588445279 933110196 /nfs/dbraw/zinc/11/01/96/933110196.db2.gz YVWIJHDUENKQDS-FLIBITNWSA-N 0 0 369.299 3.500 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N1CCO[C@H](c2ccccc2F)C1 ZINC000588445134 933111173 /nfs/dbraw/zinc/11/11/73/933111173.db2.gz NAFDWEJKSMSIHR-IFMUVIIVSA-N 0 0 370.380 3.737 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@@H](Nc2ccccc2)C1 ZINC000588445324 933112474 /nfs/dbraw/zinc/11/24/74/933112474.db2.gz XSCCDTWILHXXSU-XXTMNZORSA-N 0 0 351.406 3.711 20 5 FHBDRN CCn1cc(CC(=O)Nc2cccc(Oc3ccc([N+](=O)[O-])cc3)c2)cn1 ZINC000548368224 933119947 /nfs/dbraw/zinc/11/99/47/933119947.db2.gz AVUOEPOCPCZQSU-UHFFFAOYSA-N 0 0 366.377 3.785 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])c2ncccc12)c1ncsc1C(F)(F)F ZINC000430709165 933167646 /nfs/dbraw/zinc/16/76/46/933167646.db2.gz MNDXTIHAVRXKGI-UHFFFAOYSA-N 0 0 368.296 3.871 20 5 FHBDRN COc1cc(CN2CCN(c3cccc([N+](=O)[O-])c3)CC2)ccc1SC ZINC000510507068 933168187 /nfs/dbraw/zinc/16/81/87/933168187.db2.gz WUHJWHBWLMKOQJ-UHFFFAOYSA-N 0 0 373.478 3.648 20 5 FHBDRN COC(=O)c1cc(NC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c(C)cc1C ZINC000471858494 933179050 /nfs/dbraw/zinc/17/90/50/933179050.db2.gz RYWXPRGFMDWYEU-ZDUSSCGKSA-N 0 0 371.393 3.881 20 5 FHBDRN CC[C@@H](NC(=O)NCc1cc([N+](=O)[O-])ccc1OC)c1ccc(C)cc1 ZINC000510530261 933189973 /nfs/dbraw/zinc/18/99/73/933189973.db2.gz AKYPVWJBSOXONB-QGZVFWFLSA-N 0 0 357.410 3.862 20 5 FHBDRN CC[C@H](C)n1ncc(Nc2ncc([N+](=O)[O-])cc2Br)c1C ZINC000477701618 933190500 /nfs/dbraw/zinc/19/05/00/933190500.db2.gz ZDRZXZNNZPCISR-QMMMGPOBSA-N 0 0 354.208 3.972 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)NCC[C@H]2CCCC[C@@H]2C)cc1OC ZINC000510547246 933211293 /nfs/dbraw/zinc/21/12/93/933211293.db2.gz OKAYIQAWFHCHSB-UONOGXRCSA-N 0 0 364.442 3.948 20 5 FHBDRN COC(=O)c1cc(NC(=O)[C@@H]2[C@H](C)[C@H]2c2ccccc2)c(C)c([N+](=O)[O-])c1 ZINC000430800795 933237632 /nfs/dbraw/zinc/23/76/32/933237632.db2.gz UYDCEXZDYWFBCP-OCBCSQNSSA-N 0 0 368.389 3.678 20 5 FHBDRN C[C@@H]1CCCC[C@H]1CCNC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000510574229 933238900 /nfs/dbraw/zinc/23/89/00/933238900.db2.gz RYHNXSOBYVJYCI-CABCVRRESA-N 0 0 356.426 3.727 20 5 FHBDRN Cc1cc(OCC(=O)N(C)Cc2ccc(Cl)c(F)c2)ccc1[N+](=O)[O-] ZINC000430790581 933240406 /nfs/dbraw/zinc/24/04/06/933240406.db2.gz AFTSRHVQAICEBO-UHFFFAOYSA-N 0 0 366.776 3.733 20 5 FHBDRN Cc1cc(OCC(=O)NC2(Cc3ccccc3)CCC2)ccc1[N+](=O)[O-] ZINC000430797925 933245104 /nfs/dbraw/zinc/24/51/04/933245104.db2.gz QTZAMEMMTSIAGP-UHFFFAOYSA-N 0 0 354.406 3.564 20 5 FHBDRN C/C=C/c1ccc(NC(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000510581012 933245131 /nfs/dbraw/zinc/24/51/31/933245131.db2.gz QUGBNLMJILXVAS-NSCUHMNNSA-N 0 0 359.769 3.859 20 5 FHBDRN C[C@@H]1[C@@H](C(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000430801448 933248047 /nfs/dbraw/zinc/24/80/47/933248047.db2.gz CHVYLCPAOKHWQI-JBBXEZCESA-N 0 0 358.825 3.957 20 5 FHBDRN Cc1cc(OCC(=O)NCc2ccc(C(F)F)cc2)ccc1[N+](=O)[O-] ZINC000430822786 933264230 /nfs/dbraw/zinc/26/42/30/933264230.db2.gz QHVXYQMIIKGWRV-UHFFFAOYSA-N 0 0 350.321 3.536 20 5 FHBDRN Cc1cc(OCC(=O)N2CC[C@@H](c3ccccc3)[C@@H]2C)ccc1[N+](=O)[O-] ZINC000430832777 933284992 /nfs/dbraw/zinc/28/49/92/933284992.db2.gz JFOQSHHGUPGIMV-MAUKXSAKSA-N 0 0 354.406 3.687 20 5 FHBDRN Cc1cc(OCC(=O)N2CC3(CCC3)c3ccccc32)ccc1[N+](=O)[O-] ZINC000430838534 933287925 /nfs/dbraw/zinc/28/79/25/933287925.db2.gz LADYSBYHUBOJDP-UHFFFAOYSA-N 0 0 352.390 3.751 20 5 FHBDRN O=[N+]([O-])c1ccc2oc(CN(Cc3cccs3)C[C@H]3CCCO3)nc2c1 ZINC000610580900 933312323 /nfs/dbraw/zinc/31/23/23/933312323.db2.gz WRDSUBXVRQHQNT-CQSZACIVSA-N 0 0 373.434 3.979 20 5 FHBDRN Cc1ccc([C@@H]2NC(=O)N([C@@H](C)c3cccc([N+](=O)[O-])c3)C2=O)cc1C ZINC000430878236 933345700 /nfs/dbraw/zinc/34/57/00/933345700.db2.gz NFNVGJWYDSKIIP-GUYCJALGSA-N 0 0 353.378 3.566 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)ccc1CN[C@H](Cn1cccn1)c1ccccc1 ZINC000610582745 933358853 /nfs/dbraw/zinc/35/88/53/933358853.db2.gz UMGJUULGTQOXPP-QGZVFWFLSA-N 0 0 356.813 3.976 20 5 FHBDRN C[C@H]1CN(C)c2ccccc2N(Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000610582695 933359168 /nfs/dbraw/zinc/35/91/68/933359168.db2.gz NCPMMHGGFVTFBH-ZDUSSCGKSA-N 0 0 352.394 3.829 20 5 FHBDRN O=C1N[C@H](c2ccc(Cl)cc2Cl)C(=O)N1c1cccc([N+](=O)[O-])c1 ZINC000430910462 933395787 /nfs/dbraw/zinc/39/57/87/933395787.db2.gz ULXDBXBJMUDRKR-CYBMUJFWSA-N 0 0 366.160 3.699 20 5 FHBDRN O=C1N[C@H](C[C@@H]2CCCc3ccccc32)C(=O)N1c1cccc([N+](=O)[O-])c1 ZINC000430911448 933396687 /nfs/dbraw/zinc/39/66/87/933396687.db2.gz CFWHUQLIRLTZKL-KBXCAEBGSA-N 0 0 365.389 3.530 20 5 FHBDRN O=C1N[C@@H](C[C@H]2CCCc3ccccc32)C(=O)N1c1cccc([N+](=O)[O-])c1 ZINC000430911450 933397244 /nfs/dbraw/zinc/39/72/44/933397244.db2.gz CFWHUQLIRLTZKL-KDOFPFPSSA-N 0 0 365.389 3.530 20 5 FHBDRN CCc1ccc(C(=O)Nc2ccnn2Cc2ccccc2F)cc1[N+](=O)[O-] ZINC000471878196 933403080 /nfs/dbraw/zinc/40/30/80/933403080.db2.gz RMCFJYFIKXCKGU-UHFFFAOYSA-N 0 0 368.368 3.793 20 5 FHBDRN C[C@@H](c1ccc(-n2cncn2)cc1)N(C)c1ccc([N+](=O)[O-])c2cnccc21 ZINC000098081122 933420411 /nfs/dbraw/zinc/42/04/11/933420411.db2.gz IBMPXAWKZWWQEW-AWEZNQCLSA-N 0 0 374.404 3.921 20 5 FHBDRN Cc1cccc(C(=O)N[C@@H](C)c2ccc(Br)cn2)c1[N+](=O)[O-] ZINC000477785546 933431225 /nfs/dbraw/zinc/43/12/25/933431225.db2.gz BDEQPGNDTVOBDC-JTQLQIEISA-N 0 0 364.199 3.552 20 5 FHBDRN CNC(=O)c1cccc(NCc2csc(-c3cccc([N+](=O)[O-])c3)n2)c1 ZINC000158014648 933472684 /nfs/dbraw/zinc/47/26/84/933472684.db2.gz KOUFSMQHGZUWKK-UHFFFAOYSA-N 0 0 368.418 3.690 20 5 FHBDRN O=C(NCc1c(F)c(F)cc(F)c1F)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000610602415 933500889 /nfs/dbraw/zinc/50/08/89/933500889.db2.gz FTLKSPCZAVJSJO-UHFFFAOYSA-N 0 0 368.242 3.827 20 5 FHBDRN CCCNc1ccccc1NC(=O)c1cc(OC)c(OC)c([N+](=O)[O-])c1 ZINC000276801022 933508405 /nfs/dbraw/zinc/50/84/05/933508405.db2.gz KQUHKARYFVVIMT-UHFFFAOYSA-N 0 0 359.382 3.686 20 5 FHBDRN C[C@H]1CN(C(=O)c2ccccc2Sc2ccccc2[N+](=O)[O-])CCO1 ZINC000510726361 933570428 /nfs/dbraw/zinc/57/04/28/933570428.db2.gz XILFKKNWNGARFC-ZDUSSCGKSA-N 0 0 358.419 3.607 20 5 FHBDRN CC(C)(NC(=O)N[C@H]1C[C@]1(C)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000610643670 933584141 /nfs/dbraw/zinc/58/41/41/933584141.db2.gz VRZYABLUWXKSNP-FXAWDEMLSA-N 0 0 353.422 3.859 20 5 FHBDRN Cc1c(C(=O)Nc2cc(F)cc([N+](=O)[O-])c2)cnn1-c1ccc(C)cc1 ZINC000548422064 933591374 /nfs/dbraw/zinc/59/13/74/933591374.db2.gz GFZUPGVZGCQHRH-UHFFFAOYSA-N 0 0 354.341 3.789 20 5 FHBDRN Cc1nn(C)c(C(=O)N[C@@H](c2ccc(CC(C)C)cc2)C(C)C)c1[N+](=O)[O-] ZINC000098097645 933626820 /nfs/dbraw/zinc/62/68/20/933626820.db2.gz LYSPZUITRGQEMS-QGZVFWFLSA-N 0 0 372.469 3.962 20 5 FHBDRN C[C@H]1Sc2ccccc2N(Cc2ccc(C(N)=O)cc2[N+](=O)[O-])[C@@H]1C ZINC000430999021 933640716 /nfs/dbraw/zinc/64/07/16/933640716.db2.gz HZKZTRCXFLQTLK-VXGBXAGGSA-N 0 0 357.435 3.583 20 5 FHBDRN Cn1ccnc1-c1cccc(NC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)c1 ZINC000065074071 933654547 /nfs/dbraw/zinc/65/45/47/933654547.db2.gz CHSDDLZDJVGTKB-UHFFFAOYSA-N 0 0 361.361 3.729 20 5 FHBDRN C[C@H](C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)N1CCC[C@H](C)C1 ZINC000610655868 933659506 /nfs/dbraw/zinc/65/95/06/933659506.db2.gz VWUAOZQHJJUGGR-QWHCGFSZSA-N 0 0 374.466 3.777 20 5 FHBDRN CCc1ccc(C(=O)Nc2ccc(N3CCCC3=O)c(F)c2)cc1[N+](=O)[O-] ZINC000471908850 933665295 /nfs/dbraw/zinc/66/52/95/933665295.db2.gz XZEXYQLCOITLHJ-UHFFFAOYSA-N 0 0 371.368 3.675 20 5 FHBDRN COc1ccc2[nH]cc(CCNc3cc(OC)c([N+](=O)[O-])cc3F)c2c1 ZINC000611190323 933671837 /nfs/dbraw/zinc/67/18/37/933671837.db2.gz RPQPBNBZCJRBFM-UHFFFAOYSA-N 0 0 359.357 3.887 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CCc2ccc(O)cc2CC1 ZINC000610661213 933671850 /nfs/dbraw/zinc/67/18/50/933671850.db2.gz FQZAEOZPIBZGFE-UHFFFAOYSA-N 0 0 355.394 3.550 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N1CCCO[C@@H](c2ccccc2)C1 ZINC000610667056 933693241 /nfs/dbraw/zinc/69/32/41/933693241.db2.gz UXUYPTRJDTVYLH-LJQANCHMSA-N 0 0 354.406 3.518 20 5 FHBDRN C[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)c1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000276844889 933776104 /nfs/dbraw/zinc/77/61/04/933776104.db2.gz CTNPPNNPSWRZAL-GHMZBOCLSA-N 0 0 362.386 3.662 20 5 FHBDRN Cc1cc(OCC(=O)N(C)[C@@H](C)c2c(F)cccc2F)ccc1[N+](=O)[O-] ZINC000510813384 933783930 /nfs/dbraw/zinc/78/39/30/933783930.db2.gz OHVNIOIKRZBWDY-LBPRGKRZSA-N 0 0 364.348 3.780 20 5 FHBDRN C[C@@H](c1ccccc1Cl)N(C(=O)CCn1cc([N+](=O)[O-])cn1)C1CC1 ZINC000098101726 933804050 /nfs/dbraw/zinc/80/40/50/933804050.db2.gz XWIZWIGCRDJAGG-LBPRGKRZSA-N 0 0 362.817 3.587 20 5 FHBDRN O=C(NC[C@@H]1CCC(F)(F)C1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000431078865 933809845 /nfs/dbraw/zinc/80/98/45/933809845.db2.gz HFQMGKWKVXKOLW-GFCCVEGCSA-N 0 0 353.369 3.704 20 5 FHBDRN O=C(NC[C@@H]1CCC(F)(F)C1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000431093500 933823864 /nfs/dbraw/zinc/82/38/64/933823864.db2.gz LBHXIXNGJVWADL-MRVPVSSYSA-N 0 0 363.158 3.523 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H]1CCN(c2cccc(Cl)c2)C1 ZINC000431109496 933847965 /nfs/dbraw/zinc/84/79/65/933847965.db2.gz XBPXKMNGKWBSDP-AWEZNQCLSA-N 0 0 374.828 3.957 20 5 FHBDRN CCOC(=O)c1cc(NCc2cccnc2OC(C)C)ccc1[N+](=O)[O-] ZINC000610714996 933899949 /nfs/dbraw/zinc/89/99/49/933899949.db2.gz VOOSPENEESWQSC-UHFFFAOYSA-N 0 0 359.382 3.566 20 5 FHBDRN Cc1ccccc1CC1CN(c2ncc([N+](=O)[O-])cc2Br)C1 ZINC000610716340 933922672 /nfs/dbraw/zinc/92/26/72/933922672.db2.gz XHYUUGBGVPDUCW-UHFFFAOYSA-N 0 0 362.227 3.740 20 5 FHBDRN C/C(=C\c1nc(-c2ccc3c(c2)OCO3)no1)c1ccc([N+](=O)[O-])cc1 ZINC000544982400 933950151 /nfs/dbraw/zinc/95/01/51/933950151.db2.gz ADNBRXUDYHHNES-DHZHZOJOSA-N 0 0 351.318 3.934 20 5 FHBDRN COc1ccc(OC)c([C@@H](C)NC(=O)N(C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000043878147 933974700 /nfs/dbraw/zinc/97/47/00/933974700.db2.gz RIJNSNRTUUNOPO-CYBMUJFWSA-N 0 0 373.409 3.515 20 5 FHBDRN Cc1nn(C)cc1[C@@H]1CCCN1c1ccc(Br)cc1[N+](=O)[O-] ZINC000610726394 933992526 /nfs/dbraw/zinc/99/25/26/933992526.db2.gz AOVOINMITZLFOP-ZDUSSCGKSA-N 0 0 365.231 3.741 20 5 FHBDRN COc1ccc(NC(=O)[C@H](C)Nc2cccc3cc[nH]c32)c([N+](=O)[O-])c1 ZINC000548461983 933994225 /nfs/dbraw/zinc/99/42/25/933994225.db2.gz XPGRLKWOVLOWSN-NSHDSACASA-N 0 0 354.366 3.524 20 5 FHBDRN CCC(O)(CC)CCNC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000471948030 934026653 /nfs/dbraw/zinc/02/66/53/934026653.db2.gz VIIXWPVONXUNLE-UHFFFAOYSA-N 0 0 363.336 3.676 20 5 FHBDRN C[C@@H]1CN(CCCOc2ccc([N+](=O)[O-])cc2)C[C@@H](c2ccsc2)O1 ZINC000610737398 934028795 /nfs/dbraw/zinc/02/87/95/934028795.db2.gz WMZWEJDDNDBNID-KDOFPFPSSA-N 0 0 362.451 3.887 20 5 FHBDRN O=C(c1csc(-c2cccc([N+](=O)[O-])c2)n1)N1CC(CC(F)(F)F)C1 ZINC000610745022 934066768 /nfs/dbraw/zinc/06/67/68/934066768.db2.gz QHXPPDGNBDWRCZ-UHFFFAOYSA-N 0 0 371.340 3.743 20 5 FHBDRN Cc1cc(N2CCC(n3ccnc3)CC2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000581991006 934078499 /nfs/dbraw/zinc/07/84/99/934078499.db2.gz LUTDJZSTLVXYSG-UHFFFAOYSA-N 0 0 354.332 3.960 20 5 FHBDRN C[C@H](Cc1nc2ccccc2s1)NC(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000176100762 934080107 /nfs/dbraw/zinc/08/01/07/934080107.db2.gz UGDWPIMCLYCVIG-CYBMUJFWSA-N 0 0 369.446 3.885 20 5 FHBDRN COC(=O)c1cc(NCC(C)(C)[C@H]2CCCCO2)cc(C)c1[N+](=O)[O-] ZINC000610770325 934135094 /nfs/dbraw/zinc/13/50/94/934135094.db2.gz XCQBPCUZOONEAI-OAHLLOKOSA-N 0 0 350.415 3.697 20 5 FHBDRN CCOc1cc(CNc2ccccc2N2CCC(O)CC2)ccc1[N+](=O)[O-] ZINC000276962093 934136893 /nfs/dbraw/zinc/13/68/93/934136893.db2.gz VQDVAGHJGNEJOT-UHFFFAOYSA-N 0 0 371.437 3.567 20 5 FHBDRN CC(C)[C@@H]1c2ccccc2CCN1S(=O)(=O)c1ccc([N+](=O)[O-])s1 ZINC000610785404 934186182 /nfs/dbraw/zinc/18/61/82/934186182.db2.gz QPBALEMIULZHMC-MRXNPFEDSA-N 0 0 366.464 3.600 20 5 FHBDRN O=C(c1cc2cc([N+](=O)[O-])ccc2o1)N1CCOC2(C1)CCCCCC2 ZINC000610790074 934205668 /nfs/dbraw/zinc/20/56/68/934205668.db2.gz UGXVKVDNMTWEJJ-UHFFFAOYSA-N 0 0 358.394 3.906 20 5 FHBDRN CCOc1cc(NC(=O)N[C@H]2CCC(F)(F)C2)c([N+](=O)[O-])cc1OCC ZINC000610792438 934209031 /nfs/dbraw/zinc/20/90/31/934209031.db2.gz SLHVMQXGYKXPCD-JTQLQIEISA-N 0 0 373.356 3.702 20 5 FHBDRN O=C(COc1c(Br)cccc1[N+](=O)[O-])NC1CCCCCC1 ZINC000431229572 934221693 /nfs/dbraw/zinc/22/16/93/934221693.db2.gz NRSIIBKMPVQVIE-UHFFFAOYSA-N 0 0 371.231 3.575 20 5 FHBDRN COc1ccc2c(c1)CN(C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)CC2 ZINC000098124093 934241970 /nfs/dbraw/zinc/24/19/70/934241970.db2.gz GLGKRFOVMKJVDP-UHFFFAOYSA-N 0 0 361.785 3.847 20 5 FHBDRN Cc1c(NC(=O)[C@@H](C)c2cccnc2)cc(Br)cc1[N+](=O)[O-] ZINC000431245750 934247225 /nfs/dbraw/zinc/24/72/25/934247225.db2.gz ABXSVYJITFNFHZ-VIFPVBQESA-N 0 0 364.199 3.803 20 5 FHBDRN CCc1ccnc(C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2C)c1 ZINC000431247973 934247726 /nfs/dbraw/zinc/24/77/26/934247726.db2.gz NOSIQAQKESKSDX-UHFFFAOYSA-N 0 0 364.199 3.875 20 5 FHBDRN Cc1c(NC(=O)C[C@@H]2CCCCO2)cc(Br)cc1[N+](=O)[O-] ZINC000431249063 934248733 /nfs/dbraw/zinc/24/87/33/934248733.db2.gz SHYPJPJKPSKHGO-NSHDSACASA-N 0 0 357.204 3.563 20 5 FHBDRN Cc1c(NC(=O)COc2ccccc2)cc(Br)cc1[N+](=O)[O-] ZINC000431254581 934252420 /nfs/dbraw/zinc/25/24/20/934252420.db2.gz HZOIEWJXVZDASM-UHFFFAOYSA-N 0 0 365.183 3.683 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)NCc1c(F)cc(F)cc1F ZINC000510973159 934255051 /nfs/dbraw/zinc/25/50/51/934255051.db2.gz BUSQVENVYIDVSL-UHFFFAOYSA-N 0 0 367.327 3.521 20 5 FHBDRN O=C(c1c[nH]c2cccc([N+](=O)[O-])c12)N1CC[C@@H](Cc2ccc(F)cc2)C1 ZINC000535694380 934271334 /nfs/dbraw/zinc/27/13/34/934271334.db2.gz CXUFWDACIKCNJS-AWEZNQCLSA-N 0 0 367.380 3.920 20 5 FHBDRN Cn1ccnc1-c1cccc(NC(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)c1 ZINC000535695451 934288070 /nfs/dbraw/zinc/28/80/70/934288070.db2.gz BWWYIPSCUYLVLS-UHFFFAOYSA-N 0 0 361.361 3.729 20 5 FHBDRN Cc1nn(CCC(=O)N(C)[C@@H]2CCC[C@@H]2c2ccccc2)c(C)c1[N+](=O)[O-] ZINC000458093856 934293212 /nfs/dbraw/zinc/29/32/12/934293212.db2.gz QPUGJLKIAYSKEK-QZTJIDSGSA-N 0 0 370.453 3.593 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N(C)[C@H]2CCC[C@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000458097236 934294984 /nfs/dbraw/zinc/29/49/84/934294984.db2.gz SQPNTFXGVKLBRO-GJZGRUSLSA-N 0 0 356.426 3.850 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@@H](C)c1cc2ccccc2o1 ZINC000176133326 934303966 /nfs/dbraw/zinc/30/39/66/934303966.db2.gz RKJIPYJIZHUDRZ-LBPRGKRZSA-N 0 0 354.362 3.770 20 5 FHBDRN C[C@H](NC(=O)c1ccc([N+](=O)[O-])cn1)[C@@H](C)c1ccccc1C(F)(F)F ZINC000535748446 934337538 /nfs/dbraw/zinc/33/75/38/934337538.db2.gz HMIANUQOFFMXAT-MNOVXSKESA-N 0 0 367.327 3.931 20 5 FHBDRN CO[C@@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2SC(C)C)C12CCC2 ZINC000458189866 934363429 /nfs/dbraw/zinc/36/34/29/934363429.db2.gz MGFKOOKVACJKAX-HZPDHXFCSA-N 0 0 364.467 3.783 20 5 FHBDRN CO[C@@H]1C[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2SC(C)C)C12CCC2 ZINC000458189868 934363710 /nfs/dbraw/zinc/36/37/10/934363710.db2.gz MGFKOOKVACJKAX-JKSUJKDBSA-N 0 0 364.467 3.783 20 5 FHBDRN C[C@H](NC(=O)N[C@H](c1ccccc1)[C@H]1CCCO1)c1ccc([N+](=O)[O-])cc1 ZINC000458193579 934365515 /nfs/dbraw/zinc/36/55/15/934365515.db2.gz CUNHKOHNHDLAGF-GDIGMMSISA-N 0 0 369.421 3.875 20 5 FHBDRN CCc1nn(C)c(N[C@H]2C[C@H]2c2ccccc2C(F)(F)F)c1[N+](=O)[O-] ZINC000535795895 934390129 /nfs/dbraw/zinc/39/01/29/934390129.db2.gz CTDSQPLIWPSUFO-GWCFXTLKSA-N 0 0 354.332 3.878 20 5 FHBDRN COc1cc(N[C@H](CO)c2ccc(C(F)(F)F)cc2)c(F)cc1[N+](=O)[O-] ZINC000535796196 934390162 /nfs/dbraw/zinc/39/01/62/934390162.db2.gz YQKUGADXTDDIJA-CYBMUJFWSA-N 0 0 374.290 3.907 20 5 FHBDRN Cc1cc2cccnc2c(NC(=O)NCCOc2ccc([N+](=O)[O-])cc2)c1 ZINC000535813215 934406326 /nfs/dbraw/zinc/40/63/26/934406326.db2.gz SPIBRVMXGUDSSY-UHFFFAOYSA-N 0 0 366.377 3.652 20 5 FHBDRN O=C(Nc1cccc(-c2noc(C3CC3)n2)c1)c1cc(F)ccc1[N+](=O)[O-] ZINC000176198689 934447791 /nfs/dbraw/zinc/44/77/91/934447791.db2.gz HSMGDTAMVASTTD-UHFFFAOYSA-N 0 0 368.324 3.914 20 5 FHBDRN CCc1c(NC(=O)c2ccc(OC)c([N+](=O)[O-])c2)cnn1CCC(C)C ZINC000277032374 934460381 /nfs/dbraw/zinc/46/03/81/934460381.db2.gz GPYWUPIUUHZVJW-UHFFFAOYSA-N 0 0 360.414 3.661 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N(Cc1ccc(F)cc1)C1CCOCC1 ZINC000277036826 934462715 /nfs/dbraw/zinc/46/27/15/934462715.db2.gz GVOZOYIHAZEPDG-UHFFFAOYSA-N 0 0 372.396 3.864 20 5 FHBDRN Cc1nc(-c2cccc(NC(=O)N[C@H](C)c3cccc([N+](=O)[O-])c3)c2)no1 ZINC000144465526 934472165 /nfs/dbraw/zinc/47/21/65/934472165.db2.gz XFRLYOQTEGURPT-LLVKDONJSA-N 0 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ZINC000439907638 945070705 /nfs/dbraw/zinc/07/07/05/945070705.db2.gz FUSABGOKCVYOER-NEPJUHHUSA-N 0 0 372.343 3.502 20 5 FHBDRN CCn1c(S[C@@H]2CCCCCC2=O)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000610863346 934539285 /nfs/dbraw/zinc/53/92/85/934539285.db2.gz QPTARYIVNZOCQF-OAHLLOKOSA-N 0 0 360.439 3.867 20 5 FHBDRN CCOc1ccc(C(=O)N2CCC[C@H]2c2ccc(O)cc2)cc1[N+](=O)[O-] ZINC000610887369 934565084 /nfs/dbraw/zinc/56/50/84/934565084.db2.gz XNZKPKVCERMPLQ-INIZCTEOSA-N 0 0 356.378 3.676 20 5 FHBDRN C[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)COc1ccc([N+](=O)[O-])c2cccnc12 ZINC000610891508 934571229 /nfs/dbraw/zinc/57/12/29/934571229.db2.gz HYSPZSFGYBLQON-IIAWOOMASA-N 0 0 369.421 3.701 20 5 FHBDRN CC(C)c1[nH]nc(C(=O)Nc2ccc(Cl)c3ncccc23)c1[N+](=O)[O-] ZINC000610917265 934624513 /nfs/dbraw/zinc/62/45/13/934624513.db2.gz SGTSRSHYTZTMCW-UHFFFAOYSA-N 0 0 359.773 3.895 20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])N1Cc2ccccc2C(F)(F)C1 ZINC000610918865 934624660 /nfs/dbraw/zinc/62/46/60/934624660.db2.gz MJDKEEWRXBULMB-UHFFFAOYSA-N 0 0 361.348 3.531 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)cnc1N1C[C@H](C(F)(F)F)[C@@H](C(F)(F)F)C1 ZINC000610929424 934626416 /nfs/dbraw/zinc/62/64/16/934626416.db2.gz KAMYLRRTBDWAFO-BQBZGAKWSA-N 0 0 363.645 3.820 20 5 FHBDRN COc1cc(N2CCc3sc(Br)cc3C2)ccc1[N+](=O)[O-] ZINC000610930031 934627184 /nfs/dbraw/zinc/62/71/84/934627184.db2.gz ZLGUKDREIMXMRB-UHFFFAOYSA-N 0 0 369.240 3.990 20 5 FHBDRN O=C(NCc1cccc([N+](=O)[O-])c1)Nc1ccc2c(cnn2C(F)F)c1 ZINC000610963275 934651726 /nfs/dbraw/zinc/65/17/26/934651726.db2.gz COAPOEXXXHEDBB-UHFFFAOYSA-N 0 0 361.308 3.661 20 5 FHBDRN Cc1c(NS(=O)(=O)/C=C\c2cccc(Cl)c2)cccc1[N+](=O)[O-] ZINC000588481687 934657592 /nfs/dbraw/zinc/65/75/92/934657592.db2.gz YISZMTJCKKZBSC-HJWRWDBZSA-N 0 0 352.799 3.969 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N1CC[C@H](c2ccco2)C1 ZINC000610960237 934658189 /nfs/dbraw/zinc/65/81/89/934658189.db2.gz HTQBCVROVYEYBB-JTQLQIEISA-N 0 0 354.284 3.836 20 5 FHBDRN CC(C)N(C(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])C1CCC1 ZINC000121681083 934679792 /nfs/dbraw/zinc/67/97/92/934679792.db2.gz OUEKAAIKZCIEKY-UHFFFAOYSA-N 0 0 360.332 3.939 20 5 FHBDRN CO[C@@H]1C[C@H](c2ccccc2)CC[C@@H]1NC(=O)c1cc(C)ccc1[N+](=O)[O-] ZINC000561841532 934695504 /nfs/dbraw/zinc/69/55/04/934695504.db2.gz YPTOIIVOVBNOMU-IMFGXOCKSA-N 0 0 368.433 3.984 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2noc(CN3Cc4ccccc4C(F)(F)C3)n2)c1 ZINC000610989768 934712196 /nfs/dbraw/zinc/71/21/96/934712196.db2.gz HTEPPIODKYJJPM-UHFFFAOYSA-N 0 0 372.331 3.752 20 5 FHBDRN O=[N+]([O-])c1cc(CN2Cc3ccccc3C(F)(F)C2)c2c(c1)COCO2 ZINC000610989858 934716305 /nfs/dbraw/zinc/71/63/05/934716305.db2.gz OVSDTAXXICSWSM-UHFFFAOYSA-N 0 0 362.332 3.569 20 5 FHBDRN COc1ccc(Br)c(C(=O)N(C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000060848121 934733495 /nfs/dbraw/zinc/73/34/95/934733495.db2.gz ARBLTTLBLBNEIY-UHFFFAOYSA-N 0 0 365.183 3.643 20 5 FHBDRN CCc1ccc(C(=O)NCCc2c[nH]c3cc(F)ccc23)cc1[N+](=O)[O-] ZINC000471995431 934762919 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20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)NC[C@H](c1ccccc1)C(F)(F)F ZINC000187699068 934812728 /nfs/dbraw/zinc/81/27/28/934812728.db2.gz XXWPDQNFPOLCFQ-MRXNPFEDSA-N 0 0 366.339 3.990 20 5 FHBDRN CC(C)SCC(=O)N(C)c1nc(-c2ccccc2[N+](=O)[O-])cs1 ZINC000538254303 934819635 /nfs/dbraw/zinc/81/96/35/934819635.db2.gz WEPBHSIHCKZKLK-UHFFFAOYSA-N 0 0 351.453 3.823 20 5 FHBDRN CCc1ccc(C(=O)NC(C)(C)c2nc3ccccc3n2C)cc1[N+](=O)[O-] ZINC000472009611 934823730 /nfs/dbraw/zinc/82/37/30/934823730.db2.gz NFXBOBYCFHUXNO-UHFFFAOYSA-N 0 0 366.421 3.709 20 5 FHBDRN Cc1ccc(N2C[C@H](C(=O)O[C@@H](C)c3cccc([N+](=O)[O-])c3)CC2=O)cc1 ZINC000024077134 934827049 /nfs/dbraw/zinc/82/70/49/934827049.db2.gz ZKGVKARDMSGSGX-GOEBONIOSA-N 0 0 368.389 3.561 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NC1CCC(O)(CC)CC1 ZINC000611559701 934828352 /nfs/dbraw/zinc/82/83/52/934828352.db2.gz IWMXRTXWIYNCBI-UHFFFAOYSA-N 0 0 366.483 3.910 20 5 FHBDRN CCc1ccc(C(=O)NC[C@H]2CCN(c3ccc(F)cc3)C2)cc1[N+](=O)[O-] ZINC000472014933 934830666 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COc1c(O)ccc(CN(C)[C@@H]2CCCc3nc(C)sc32)c1[N+](=O)[O-] ZINC000892035775 934865399 /nfs/dbraw/zinc/86/53/99/934865399.db2.gz NUYUJSYQWCPDRE-CYBMUJFWSA-N 0 0 363.439 3.583 20 5 FHBDRN CCNc1nc(Sc2nc3sccn3c2[N+](=O)[O-])nc2ccccc21 ZINC000071836359 934887572 /nfs/dbraw/zinc/88/75/72/934887572.db2.gz VGZXVPWLXQHWKS-UHFFFAOYSA-N 0 0 372.435 3.830 20 5 FHBDRN CCc1ccc(C(=O)Nc2c(C)cnn2-c2ccccc2)cc1[N+](=O)[O-] ZINC000084564082 934918939 /nfs/dbraw/zinc/91/89/39/934918939.db2.gz YDBGCWFBCKESBR-UHFFFAOYSA-N 0 0 350.378 3.904 20 5 FHBDRN O=c1c2cc([N+](=O)[O-])ccc2nc2n1CC/C2=C/c1ccc(Cl)s1 ZINC000014179206 934939245 /nfs/dbraw/zinc/93/92/45/934939245.db2.gz HWZRJERPGUISNK-CLFYSBASSA-N 0 0 359.794 3.964 20 5 FHBDRN CCCc1ccc(OC)c(Oc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)c1 ZINC000450488910 934958361 /nfs/dbraw/zinc/95/83/61/934958361.db2.gz POLDKRUWKZEPNI-UHFFFAOYSA-N 0 0 365.407 3.752 20 5 FHBDRN C[C@H]1C[C@H](c2ccccc2)N(S(=O)(=O)c2c(F)cccc2[N+](=O)[O-])C1 ZINC000511030904 934970999 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FHBDRN O=C(c1cc(N2CCc3ccc(F)cc3C2)ccc1[N+](=O)[O-])N1CCCC1 ZINC000135551690 935974031 /nfs/dbraw/zinc/97/40/31/935974031.db2.gz VJVXNOQWISLCEX-UHFFFAOYSA-N 0 0 369.396 3.533 20 5 FHBDRN CCOC(=O)c1ccnc(N2CCC[C@H](c3ccccc3)C2)c1[N+](=O)[O-] ZINC000431477780 935976766 /nfs/dbraw/zinc/97/67/66/935976766.db2.gz OJGIQMDYPCZQPM-HNNXBMFYSA-N 0 0 355.394 3.551 20 5 FHBDRN CC(C)c1nc(C(=O)Nc2ccc([N+](=O)[O-])cc2)nn1-c1cccc(F)c1 ZINC000117578718 935977128 /nfs/dbraw/zinc/97/71/28/935977128.db2.gz FTEJOHCULQTJKE-UHFFFAOYSA-N 0 0 369.356 3.690 20 5 FHBDRN Cc1cc(F)cc(C(=O)Nc2cccc(Oc3cnccn3)c2)c1[N+](=O)[O-] ZINC000176738540 935978700 /nfs/dbraw/zinc/97/87/00/935978700.db2.gz LXJNMPAYKAQJBU-UHFFFAOYSA-N 0 0 368.324 3.877 20 5 FHBDRN COc1ccc(C(=O)N[C@@H]2CCCO[C@@H]2c2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000074521989 935985124 /nfs/dbraw/zinc/98/51/24/935985124.db2.gz NRIZSFODZLJSRH-VQIMIIECSA-N 0 0 370.405 3.562 20 5 FHBDRN CC(C)(CNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21)c1cccs1 ZINC000074648565 935989624 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C[C@@H](Nc1ncnc2ccc([N+](=O)[O-])cc21)c1ccc(-n2cccn2)cc1 ZINC000611707235 936032332 /nfs/dbraw/zinc/03/23/32/936032332.db2.gz LXAZULRXHRXFDR-CYBMUJFWSA-N 0 0 360.377 3.897 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)NC1CC(c2ccccc2)C1 ZINC000077340045 936045382 /nfs/dbraw/zinc/04/53/82/936045382.db2.gz NYSFFRXBMGQBOH-UHFFFAOYSA-N 0 0 353.422 3.849 20 5 FHBDRN CCCC[C@H](NC(=O)C(=O)Nc1c(C)ccc([N+](=O)[O-])c1C)C1CCC1 ZINC000121894015 936052220 /nfs/dbraw/zinc/05/22/20/936052220.db2.gz KOSOCALPURHIMV-HNNXBMFYSA-N 0 0 361.442 3.625 20 5 FHBDRN O=[N+]([O-])c1ccc2ncnc(N[C@@H]3CCCN(c4ccccc4F)C3)c2c1 ZINC000611713211 936058529 /nfs/dbraw/zinc/05/85/29/936058529.db2.gz ZZHLUDNABMVMTM-CYBMUJFWSA-N 0 0 367.384 3.758 20 5 FHBDRN CCOc1cccc([C@@H]2C[C@H]2NC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000437217945 945144002 /nfs/dbraw/zinc/14/40/02/945144002.db2.gz RMDIDEHWPXOIIP-FUHWJXTLSA-N 0 0 374.824 3.862 20 5 FHBDRN CN(CCc1cccc2ccccc21)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000507323456 945144584 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371.162 3.670 20 5 FHBDRN CC(C)(C(=O)N1CC[C@H](Oc2cccc(F)c2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000612182570 936189112 /nfs/dbraw/zinc/18/91/12/936189112.db2.gz BGQAGVKGNIOJLV-SFHVURJKSA-N 0 0 372.396 3.691 20 5 FHBDRN CCn1cnnc1-c1cccc(NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c1 ZINC000121957831 936203851 /nfs/dbraw/zinc/20/38/51/936203851.db2.gz HSNUTBZAHYYLDP-UHFFFAOYSA-N 0 0 371.784 3.779 20 5 FHBDRN C[C@H](c1ccccc1[N+](=O)[O-])N1C(=O)CN([C@@H](C)c2ccccc2)C1=O ZINC000277931258 936206340 /nfs/dbraw/zinc/20/63/40/936206340.db2.gz QSSWDGPQDCRZBD-UONOGXRCSA-N 0 0 353.378 3.681 20 5 FHBDRN O=C(N[C@H]1CCC[C@@H]1CCO)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000187850708 936215811 /nfs/dbraw/zinc/21/58/11/936215811.db2.gz LPNJMXCMANWRRY-PBHICJAKSA-N 0 0 369.421 3.619 20 5 FHBDRN O=C(c1cc(N[C@H]2CCc3c2cccc3O)ccc1[N+](=O)[O-])N1CCCC1 ZINC000091485180 936222949 /nfs/dbraw/zinc/22/29/49/936222949.db2.gz JSLXTSJWHNHLMK-KRWDZBQOSA-N 0 0 367.405 3.636 20 5 FHBDRN 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CC[C@H](CNc1ccccc1)NC(=O)N[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000458619122 938333510 /nfs/dbraw/zinc/33/35/10/938333510.db2.gz MCPFQDAKDICXOY-LSDHHAIUSA-N 0 0 356.426 3.846 20 5 FHBDRN CC[C@H](CNc1ccccc1)NC(=O)N[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000458619120 938333545 /nfs/dbraw/zinc/33/35/45/938333545.db2.gz MCPFQDAKDICXOY-HUUCEWRRSA-N 0 0 356.426 3.846 20 5 FHBDRN Cc1nn(C(C)(C)C)cc1[C@@H](C)Nc1ccc([N+](=O)[O-])c(OC(C)C)n1 ZINC000583641064 938335944 /nfs/dbraw/zinc/33/59/44/938335944.db2.gz CSPZIGLISFGNMZ-GFCCVEGCSA-N 0 0 361.446 3.632 20 5 FHBDRN C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)Cc1ccccc1OC(F)F ZINC000118207555 938345833 /nfs/dbraw/zinc/34/58/33/938345833.db2.gz GYDDOXFHWCABQE-LLVKDONJSA-N 0 0 362.332 3.717 20 5 FHBDRN Cc1cc(F)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1Sc1nc[nH]n1 ZINC000536097570 938348206 /nfs/dbraw/zinc/34/82/06/938348206.db2.gz CBPUBJJSZMCJOH-UHFFFAOYSA-N 0 0 373.369 3.564 20 5 FHBDRN CCOc1cc(C(=O)N2[C@H](C)C[C@@H]3CCCC[C@H]32)c([N+](=O)[O-])cc1OC ZINC000246354330 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20 5 FHBDRN CC[C@H](CNc1ccccc1)NC(=O)NCc1cccc([N+](=O)[O-])c1C ZINC000458691182 938436887 /nfs/dbraw/zinc/43/68/87/938436887.db2.gz LTEBFNLFZBDYAU-MRXNPFEDSA-N 0 0 356.426 3.593 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H]1CC[C@H]2CCCC[C@H]2C1 ZINC000583842829 938446626 /nfs/dbraw/zinc/44/66/26/938446626.db2.gz NJIOVBNUJGSCAH-OWCLPIDISA-N 0 0 373.453 3.571 20 5 FHBDRN O=C(CCc1c(Cl)cccc1[N+](=O)[O-])OCc1cc(Cl)ccn1 ZINC001125692330 938452635 /nfs/dbraw/zinc/45/26/35/938452635.db2.gz IXXZUCJFZVQMQM-UHFFFAOYSA-N 0 0 355.177 3.973 20 5 FHBDRN CC(=O)NCC[C@H]1CCCN(c2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)C1 ZINC000583864074 938456931 /nfs/dbraw/zinc/45/69/31/938456931.db2.gz SGKYLDFEYQDLFY-OAHLLOKOSA-N 0 0 363.458 3.515 20 5 FHBDRN C[C@@]1(NC(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CC=CCC1 ZINC000458709672 938459585 /nfs/dbraw/zinc/45/95/85/938459585.db2.gz UBXDLUAMKSNKPE-OAHLLOKOSA-N 0 0 357.332 3.912 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])[C@H]1c2cc(Cl)cc(Cl)c2C[C@@H]1O ZINC000052638623 938460361 /nfs/dbraw/zinc/46/03/61/938460361.db2.gz DIXXVTUYCGMBIX-IRXDYDNUSA-N 0 0 367.232 3.992 20 5 FHBDRN O=C(N[C@@H]1[C@@H]2CCc3ccccc3[C@@H]21)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000158797203 938463403 /nfs/dbraw/zinc/46/34/03/938463403.db2.gz KNIMVFOHMLCULQ-MOXGXCLJSA-N 0 0 359.385 3.601 20 5 FHBDRN C[C@@H](NC(=O)c1ccc(F)cc1[N+](=O)[O-])c1nc(-c2ccncc2)cs1 ZINC000135446742 938464189 /nfs/dbraw/zinc/46/41/89/938464189.db2.gz GLZBVXZAZDWGKJ-SNVBAGLBSA-N 0 0 372.381 3.743 20 5 FHBDRN CCc1ccnc(CNC(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000458719233 938475926 /nfs/dbraw/zinc/47/59/26/938475926.db2.gz AUHWRDWRIHETTH-KRWDZBQOSA-N 0 0 368.437 3.641 20 5 FHBDRN C[C@@H](C(=O)N1CCC[C@@H]1c1cccs1)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000046599760 938480883 /nfs/dbraw/zinc/48/08/83/938480883.db2.gz CPYHZCGTOBVIBO-WMLDXEAASA-N 0 0 373.478 3.840 20 5 FHBDRN Cc1cc(OCC(=O)N(C)Cc2cccs2)c(Cl)cc1[N+](=O)[O-] ZINC000506423200 945179698 /nfs/dbraw/zinc/17/96/98/945179698.db2.gz QSKJCLDCNIINJX-UHFFFAOYSA-N 0 0 354.815 3.656 20 5 FHBDRN CC(F)(F)c1ccc(CNc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])cc1 ZINC000432139876 945179907 /nfs/dbraw/zinc/17/99/07/945179907.db2.gz NSMXQJIJWVBGGZ-UHFFFAOYSA-N 0 0 370.377 3.722 20 5 FHBDRN O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)Nc1ccccc1OCC(F)F ZINC000583957977 938503904 /nfs/dbraw/zinc/50/39/04/938503904.db2.gz VRGZNBVEGGLSSW-UHFFFAOYSA-N 0 0 372.274 3.698 20 5 FHBDRN O=C(c1ccc(CNc2ccc(F)cc2[N+](=O)[O-])cc1)N1CCCCC1 ZINC000052721194 938514400 /nfs/dbraw/zinc/51/44/00/938514400.db2.gz VPAAPKWPMRPYBW-UHFFFAOYSA-N 0 0 357.385 3.972 20 5 FHBDRN CC(C)(CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)Oc1ccccc1 ZINC000536187541 938531238 /nfs/dbraw/zinc/53/12/38/938531238.db2.gz XXGYZEFRNXWRJD-UHFFFAOYSA-N 0 0 367.405 3.592 20 5 FHBDRN Cn1c(-c2ccc([N+](=O)[O-])cc2)nnc1N(Cc1cccc(F)c1)C1CC1 ZINC000584021886 938551778 /nfs/dbraw/zinc/55/17/78/938551778.db2.gz OGSJISRHRSHMHO-UHFFFAOYSA-N 0 0 367.384 3.698 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)N[C@@H]1C[C@H]1c1c(F)cccc1F ZINC000437276053 945185454 /nfs/dbraw/zinc/18/54/54/945185454.db2.gz SDERSBKPUFCXMO-CZUORRHYSA-N 0 0 371.343 3.500 20 5 FHBDRN CN(Cc1nccs1)c1cc(C(F)(F)C(F)(F)F)ncc1[N+](=O)[O-] ZINC000278590827 938565677 /nfs/dbraw/zinc/56/56/77/938565677.db2.gz YWXQHNMVABHJJM-UHFFFAOYSA-N 0 0 368.287 3.737 20 5 FHBDRN Cc1cccc([C@@H](C)C(=O)Nc2ccnn2-c2ccc([N+](=O)[O-])cc2)c1 ZINC000151545484 938570925 /nfs/dbraw/zinc/57/09/25/938570925.db2.gz JGJJBLYXMZGKJJ-CQSZACIVSA-N 0 0 350.378 3.831 20 5 FHBDRN CCn1ccnc1[C@H]1OCCC[C@@H]1Nc1ccnc2c1cccc2[N+](=O)[O-] ZINC000432143396 945187004 /nfs/dbraw/zinc/18/70/04/945187004.db2.gz NKFFGYLHWAPVGS-YJBOKZPZSA-N 0 0 367.409 3.692 20 5 FHBDRN Cc1cc(Cl)cc(NC(=O)CSc2ccc([N+](=O)[O-])cc2)c1O ZINC000536212540 938591736 /nfs/dbraw/zinc/59/17/36/938591736.db2.gz CCHYFTSOCPLGHG-UHFFFAOYSA-N 0 0 352.799 3.993 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N(CCc1ccccc1)CC(C)C ZINC000427198274 945188519 /nfs/dbraw/zinc/18/85/19/945188519.db2.gz UAPAYZDBXSOQDX-UHFFFAOYSA-N 0 0 356.422 3.944 20 5 FHBDRN COc1cc2c(cc1F)CN(c1ccnc3c1cccc3[N+](=O)[O-])CC2 ZINC000432145512 945188779 /nfs/dbraw/zinc/18/87/79/945188779.db2.gz SZCKFRLPDZPWHI-UHFFFAOYSA-N 0 0 353.353 3.853 20 5 FHBDRN COc1ccc(CC(=O)Nc2cc([N+](=O)[O-])c(Cl)cc2C)cc1F ZINC000135499453 938600122 /nfs/dbraw/zinc/60/01/22/938600122.db2.gz XVHOXLYBELNTGD-UHFFFAOYSA-N 0 0 352.749 3.886 20 5 FHBDRN Cc1ccnc([C@H]2CCN(C(=O)C(C)(C)c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000584122838 938609128 /nfs/dbraw/zinc/60/91/28/938609128.db2.gz DDPKQJKHASVUNN-HNNXBMFYSA-N 0 0 353.422 3.592 20 5 FHBDRN Cc1cccc([C@H]2CCN(c3nc4ccc([N+](=O)[O-])cc4c(=O)[nH]3)C2)c1 ZINC000584130155 938609708 /nfs/dbraw/zinc/60/97/08/938609708.db2.gz KRYYANFJKZORDE-AWEZNQCLSA-N 0 0 350.378 3.546 20 5 FHBDRN O=C(NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CCC[C@H]2CCC[C@H]21 ZINC000584146606 938616896 /nfs/dbraw/zinc/61/68/96/938616896.db2.gz SNJJPPJVCZZWHA-FZKQIMNGSA-N 0 0 356.426 3.593 20 5 FHBDRN CCC[C@H](NC(=O)COc1cccc([N+](=O)[O-])c1)c1ccc(F)cc1F ZINC000468369564 938620301 /nfs/dbraw/zinc/62/03/01/938620301.db2.gz YLRUFKRVBQQAEY-KRWDZBQOSA-N 0 0 364.348 3.909 20 5 FHBDRN O=C(NCCc1c[nH]c2ccc(F)cc12)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000584164989 938623859 /nfs/dbraw/zinc/62/38/59/938623859.db2.gz MARFDOAPEGFGSC-UHFFFAOYSA-N 0 0 361.760 3.841 20 5 FHBDRN Cc1sc(C(=O)Nc2ncc(C3(O)CCCCC3)s2)cc1[N+](=O)[O-] ZINC000274648860 938631495 /nfs/dbraw/zinc/63/14/95/938631495.db2.gz BRWHZCBAZTYHJG-UHFFFAOYSA-N 0 0 367.452 3.825 20 5 FHBDRN NC(=O)c1ccc(-c2nc(COc3ccc([N+](=O)[O-])cc3F)cs2)cc1 ZINC000052892402 938646098 /nfs/dbraw/zinc/64/60/98/938646098.db2.gz AVIZKZGUZBBMTP-UHFFFAOYSA-N 0 0 373.365 3.535 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N(CCc1nccs1)C(C)C ZINC000179072218 938651810 /nfs/dbraw/zinc/65/18/10/938651810.db2.gz HBHBMFSVZHASQJ-UHFFFAOYSA-N 0 0 364.427 3.545 20 5 FHBDRN Cc1cc(F)cc(C(=O)NC[C@H](O)c2ccc(C(C)(C)C)cc2)c1[N+](=O)[O-] ZINC000176813456 938666326 /nfs/dbraw/zinc/66/63/26/938666326.db2.gz DQMUBGSGLLLMSU-KRWDZBQOSA-N 0 0 374.412 3.803 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)c1nc(C(F)(F)F)cs1 ZINC000278702204 938669689 /nfs/dbraw/zinc/66/96/89/938669689.db2.gz JUIWACCLBNOXST-QMMMGPOBSA-N 0 0 359.329 3.870 20 5 FHBDRN CC(C)(C)n1cc(CNCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)cn1 ZINC000278701992 938669884 /nfs/dbraw/zinc/66/98/84/938669884.db2.gz JTJJNTOLKUXZQT-UHFFFAOYSA-N 0 0 356.348 3.855 20 5 FHBDRN Cc1ccc(F)c(NC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)c1 ZINC000052937159 938670788 /nfs/dbraw/zinc/67/07/88/938670788.db2.gz PVBCGBXBOIIGCX-UHFFFAOYSA-N 0 0 354.341 3.695 20 5 FHBDRN O=[N+]([O-])c1ccc([C@@H](NC[C@H](CO)Cc2ccccc2)C(F)(F)F)cc1 ZINC000584296323 938675705 /nfs/dbraw/zinc/67/57/05/938675705.db2.gz MQAQJBPXHQOKQP-RHSMWYFYSA-N 0 0 368.355 3.639 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)Nc1cc(-c2ccccc2)on1 ZINC000467392906 945195022 /nfs/dbraw/zinc/19/50/22/945195022.db2.gz JGYWZUARWHNCJA-UHFFFAOYSA-N 0 0 372.768 3.647 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)NCC[C@](C)(O)c1ccccc1 ZINC000278716077 938680171 /nfs/dbraw/zinc/68/01/71/938680171.db2.gz QZJCLXZGOOEXAO-SFHVURJKSA-N 0 0 362.813 3.584 20 5 FHBDRN Cc1ccoc1CN(C)C(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000584308973 938680229 /nfs/dbraw/zinc/68/02/29/938680229.db2.gz JWMWGGBHCWCSOL-UHFFFAOYSA-N 0 0 352.774 3.577 20 5 FHBDRN O=C(Cn1cc(Br)c([N+](=O)[O-])n1)c1ccc2ccccc2c1 ZINC000054919616 938681059 /nfs/dbraw/zinc/68/10/59/938681059.db2.gz WQROUQYVDJTFLA-UHFFFAOYSA-N 0 0 360.167 3.590 20 5 FHBDRN CCOc1cc(Cl)ccc1CNC(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000179082169 938683017 /nfs/dbraw/zinc/68/30/17/938683017.db2.gz QOYGIKPICVIAFR-UHFFFAOYSA-N 0 0 363.801 3.646 20 5 FHBDRN NC(=O)c1cccc(NCC[C@@H](c2ccccc2)C(F)(F)F)c1[N+](=O)[O-] ZINC000432144016 945195514 /nfs/dbraw/zinc/19/55/14/945195514.db2.gz UFCHMFXSRSILKJ-ZDUSSCGKSA-N 0 0 367.327 3.842 20 5 FHBDRN COc1ccc(NC(=O)N2CCc3cc(F)ccc3[C@@H]2C)cc1[N+](=O)[O-] ZINC000611823405 938692743 /nfs/dbraw/zinc/69/27/43/938692743.db2.gz BFWIGLVCXPTTSL-NSHDSACASA-N 0 0 359.357 3.894 20 5 FHBDRN O=[N+]([O-])c1cccc(Cl)c1N1CC[C@](CO)(Cc2ccc(F)cc2)C1 ZINC000432147976 945196609 /nfs/dbraw/zinc/19/66/09/945196609.db2.gz JAMRXRXDRNVMMQ-SFHVURJKSA-N 0 0 364.804 3.819 20 5 FHBDRN Cc1nn(C(C)(C)C)cc1[C@@H](C)NC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000584344190 938693949 /nfs/dbraw/zinc/69/39/49/938693949.db2.gz SBTOOWUZMDXWKN-QWHCGFSZSA-N 0 0 358.442 3.836 20 5 FHBDRN CCc1ccc([C@H](CNc2cc(C(=O)[O-])ccc2[N+](=O)[O-])[NH+](C)C)cc1 ZINC000584353966 938696984 /nfs/dbraw/zinc/69/69/84/938696984.db2.gz WJLOAZSSIZJDDR-SFHVURJKSA-N 0 0 357.410 3.570 20 5 FHBDRN COc1ccc(Nc2cc(C)c([N+](=O)[O-])cn2)cc1N1CCCCC1=O ZINC000074740545 938707640 /nfs/dbraw/zinc/70/76/40/938707640.db2.gz ZCSYZQLDDCXFHJ-UHFFFAOYSA-N 0 0 356.382 3.567 20 5 FHBDRN O=C(Cc1ccccc1)N1CC[C@H](Nc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000432145918 945199962 /nfs/dbraw/zinc/19/99/62/945199962.db2.gz XTJIJQGXYNVFHM-AWEZNQCLSA-N 0 0 359.813 3.504 20 5 FHBDRN O=C(NCCCSc1ccccn1)c1ccc([N+](=O)[O-])cc1Cl ZINC000511251248 938793634 /nfs/dbraw/zinc/79/36/34/938793634.db2.gz LYAQGWVBEWLLND-UHFFFAOYSA-N 0 0 351.815 3.555 20 5 FHBDRN C[C@@H](Cc1cccs1)Nc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1 ZINC000077524020 938801888 /nfs/dbraw/zinc/80/18/88/938801888.db2.gz CLZMDJIEBGJIIS-ZDUSSCGKSA-N 0 0 359.451 3.935 20 5 FHBDRN CCc1ccc(C(=O)Nc2nnc(-c3ccccc3)s2)cc1[N+](=O)[O-] ZINC000081822060 938803911 /nfs/dbraw/zinc/80/39/11/938803911.db2.gz OODGUMVQXAFIJA-UHFFFAOYSA-N 0 0 354.391 3.928 20 5 FHBDRN CCOC(=O)c1cc(N2CCC[C@@H](C(F)(F)F)[C@@H]2C)ccc1[N+](=O)[O-] ZINC000480296993 938826790 /nfs/dbraw/zinc/82/67/90/938826790.db2.gz YSEPVODXBQSRBF-GXFFZTMASA-N 0 0 360.332 3.939 20 5 FHBDRN CC(C)NC(=O)c1ccc(N2CCC[C@@H](C(F)(F)F)[C@H]2C)c([N+](=O)[O-])c1 ZINC000480312854 938831005 /nfs/dbraw/zinc/83/10/05/938831005.db2.gz YKOJCCOXDROJHY-DGCLKSJQSA-N 0 0 373.375 3.900 20 5 FHBDRN COc1cc(NC[C@H](C)c2nc(-c3ccccc3)no2)ccc1[N+](=O)[O-] ZINC000089641224 938861941 /nfs/dbraw/zinc/86/19/41/938861941.db2.gz MACTULGMNWTOQF-LBPRGKRZSA-N 0 0 354.366 3.869 20 5 FHBDRN O=C(Nc1cncc2ccccc21)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000089762321 938863742 /nfs/dbraw/zinc/86/37/42/938863742.db2.gz DOIRELJTTZCVFE-UHFFFAOYSA-N 0 0 362.389 3.996 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(-c2nc(-c3ccc4cc[nH]c4n3)no2)c1 ZINC000584436588 938878247 /nfs/dbraw/zinc/87/82/47/938878247.db2.gz QMGJUQAYYBUBMV-UHFFFAOYSA-N 0 0 351.322 3.587 20 5 FHBDRN Cn1cc(NC(=O)CCc2cccc([N+](=O)[O-])c2)c(-c2ccccc2)n1 ZINC000091144917 938890743 /nfs/dbraw/zinc/89/07/43/938890743.db2.gz BWCQGKWMIIUYPJ-UHFFFAOYSA-N 0 0 350.378 3.567 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N1CCOC[C@H]1c1ccc(C)o1 ZINC000289957629 938912336 /nfs/dbraw/zinc/91/23/36/938912336.db2.gz YETLCCGPKOLMLV-INIZCTEOSA-N 0 0 359.382 3.664 20 5 FHBDRN O=C(NCCc1ccccc1[N+](=O)[O-])N1CC[C@H]1c1ccc(Cl)cc1 ZINC000519203359 945215132 /nfs/dbraw/zinc/21/51/32/945215132.db2.gz ZSTCQIGWXQNMHE-INIZCTEOSA-N 0 0 359.813 3.947 20 5 FHBDRN CCOc1ccc(NC(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)c(C)c1 ZINC000124273239 945215996 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374.871 3.662 20 5 FHBDRN CC(C)c1nnc(N(C)Cc2ccccc2[N+](=O)[O-])n1C[C@@H]1CCCCO1 ZINC000550026743 945255125 /nfs/dbraw/zinc/25/51/25/945255125.db2.gz AJDLKZCUPXTYCY-INIZCTEOSA-N 0 0 373.457 3.515 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)NC1(c2ccc3c(c2)OCO3)CC1 ZINC000438948174 945255523 /nfs/dbraw/zinc/25/55/23/945255523.db2.gz MJEFPDMBURCNAS-UHFFFAOYSA-N 0 0 374.780 3.704 20 5 FHBDRN COC[C@@H](NC(=O)c1cc2ccccc2c2cccnc12)[C@@H]1CCCOC1 ZINC000894842418 945258536 /nfs/dbraw/zinc/25/85/36/945258536.db2.gz SCCVQABHGRZARO-OXQOHEQNSA-N 0 0 364.445 3.559 20 5 FHBDRN O=C(Nc1cccc2nccn21)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000437333505 945256282 /nfs/dbraw/zinc/25/62/82/945256282.db2.gz RNFQEHKRQVNSCA-UHFFFAOYSA-N 0 0 350.256 3.514 20 5 FHBDRN CN(Cc1ccc2c(c1)OCO2)Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000506035724 945260659 /nfs/dbraw/zinc/26/06/59/945260659.db2.gz RYQFLCFZDZPRQF-UHFFFAOYSA-N 0 0 366.320 3.557 20 5 FHBDRN CC[C@@H](NS(=O)(=O)c1ccc(C)cc1[N+](=O)[O-])c1cccc(Cl)c1 ZINC000507479424 945262807 /nfs/dbraw/zinc/26/28/07/945262807.db2.gz GGQSOZMFQSWREZ-CQSZACIVSA-N 0 0 368.842 3.986 20 5 FHBDRN COCC[C@@H](Cc1ccco1)NC(=O)c1c(C)cc(Cl)cc1[N+](=O)[O-] ZINC000438959637 945267886 /nfs/dbraw/zinc/26/78/86/945267886.db2.gz OTAROZNXZXYGCX-ZDUSSCGKSA-N 0 0 366.801 3.527 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)N1CCS[C@@H]2CCCC[C@H]21 ZINC000438961891 945269505 /nfs/dbraw/zinc/26/95/05/945269505.db2.gz KQZKOWGWTABILZ-IAGOWNOFSA-N 0 0 363.483 3.674 20 5 FHBDRN Cc1ccc(NC(=O)C(=O)N[C@@H](CCC(C)C)C(C)(C)C)cc1[N+](=O)[O-] ZINC000516805991 945270512 /nfs/dbraw/zinc/27/05/12/945270512.db2.gz IJEPENRATBJDGN-INIZCTEOSA-N 0 0 363.458 3.809 20 5 FHBDRN CC(C)c1ccc(C(=O)Nc2nnc(CC(F)(F)F)s2)cc1[N+](=O)[O-] ZINC000438963430 945271646 /nfs/dbraw/zinc/27/16/46/945271646.db2.gz OIZDDQUTEMWVAR-UHFFFAOYSA-N 0 0 374.344 3.927 20 5 FHBDRN Cc1sc(C(=O)N[C@H]2C[C@@H]2c2ccccc2OC(F)F)cc1[N+](=O)[O-] ZINC000437366878 945277142 /nfs/dbraw/zinc/27/71/42/945277142.db2.gz XYIKLLVYBWQTKI-MNOVXSKESA-N 0 0 368.361 3.852 20 5 FHBDRN CCc1n[nH]c(C(=O)NC(C)(c2ccccc2)c2ccccc2)c1[N+](=O)[O-] ZINC000188414806 939874072 /nfs/dbraw/zinc/87/40/72/939874072.db2.gz WHAGOWNRGFBWOG-UHFFFAOYSA-N 0 0 364.405 3.574 20 5 FHBDRN O=C(Nc1ccc2cc([N+](=O)[O-])ccc2n1)c1cccnc1C(F)(F)F ZINC000188405718 939875629 /nfs/dbraw/zinc/87/56/29/939875629.db2.gz CPNQRFMQOVHENX-UHFFFAOYSA-N 0 0 362.267 3.809 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1cccc(-c2ncco2)c1C ZINC000427312984 945278138 /nfs/dbraw/zinc/27/81/38/945278138.db2.gz LBNLXGWZHBYFPH-UHFFFAOYSA-N 0 0 373.390 3.667 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NCc1ccc(Cl)nc1 ZINC000179554133 939888405 /nfs/dbraw/zinc/88/84/05/939888405.db2.gz MTPIIYQROOOMJJ-UHFFFAOYSA-N 0 0 351.815 3.685 20 5 FHBDRN O=C(N[C@H](Cc1ccc(Cl)cc1)c1ccccc1)c1[nH]ncc1[N+](=O)[O-] ZINC000179588384 939892401 /nfs/dbraw/zinc/89/24/01/939892401.db2.gz MHMVPBLZVHAGPU-OAHLLOKOSA-N 0 0 370.796 3.685 20 5 FHBDRN O=C(CNC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)C1CC1 ZINC000179608443 939893924 /nfs/dbraw/zinc/89/39/24/939893924.db2.gz LEGKGNNRMUUIRY-UHFFFAOYSA-N 0 0 374.780 3.749 20 5 FHBDRN CCCn1ccnc1CCCN(C)c1ccnc2c1cccc2[N+](=O)[O-] ZINC000432180087 945280276 /nfs/dbraw/zinc/28/02/76/945280276.db2.gz SYXZSIFHBMCPHY-UHFFFAOYSA-N 0 0 353.426 3.819 20 5 FHBDRN CCOC(=O)c1ccnc(NCc2cccc(CSC)c2)c1[N+](=O)[O-] ZINC000188480675 939904217 /nfs/dbraw/zinc/90/42/17/939904217.db2.gz YCECFKWOFRYAHK-UHFFFAOYSA-N 0 0 361.423 3.642 20 5 FHBDRN O=C(Nc1cccc2[nH]cnc21)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000136249277 939908205 /nfs/dbraw/zinc/90/82/05/939908205.db2.gz JTDZNVLUGMQHRL-UHFFFAOYSA-N 0 0 365.374 3.847 20 5 FHBDRN CC(C)Oc1cccc([C@@H](C)[NH2+]CC(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000179666521 939912592 /nfs/dbraw/zinc/91/25/92/939912592.db2.gz MKDZQWAXPNOBNK-CQSZACIVSA-N 0 0 357.410 3.671 20 5 FHBDRN COc1ccccc1OC[C@H](C)CNC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000136302841 939914888 /nfs/dbraw/zinc/91/48/88/939914888.db2.gz JBWBVYIWYBLTMY-CYBMUJFWSA-N 0 0 373.409 3.748 20 5 FHBDRN CC[C@@H](CC(F)(F)F)C(=O)Nc1ccnn1-c1ccc([N+](=O)[O-])cc1 ZINC000410454355 939916907 /nfs/dbraw/zinc/91/69/07/939916907.db2.gz XFGPYXSBJPPDAQ-JTQLQIEISA-N 0 0 356.304 3.698 20 5 FHBDRN COc1ccc(-c2nnc(NC(=O)c3cc(C)cc([N+](=O)[O-])c3)s2)cc1 ZINC000136318161 939917636 /nfs/dbraw/zinc/91/76/36/939917636.db2.gz YSSHDMJKTBSBAH-UHFFFAOYSA-N 0 0 370.390 3.683 20 5 FHBDRN COc1ccc(NC(=O)c2ccc(Br)s2)cc1[N+](=O)[O-] ZINC000136330781 939922479 /nfs/dbraw/zinc/92/24/79/939922479.db2.gz PVOGAIKIWXFRPD-UHFFFAOYSA-N 0 0 357.185 3.680 20 5 FHBDRN CCOc1cc(NC(=O)N2CC[C@H]3CCC[C@H]32)c([N+](=O)[O-])cc1OCC ZINC000614678836 939924135 /nfs/dbraw/zinc/92/41/35/939924135.db2.gz OZJSKCSJCFBRLE-TZMCWYRMSA-N 0 0 363.414 3.799 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)OCc1ncc(Cl)n1C ZINC000179748844 939931146 /nfs/dbraw/zinc/93/11/46/939931146.db2.gz DKGQHXIZKACCMF-UHFFFAOYSA-N 0 0 369.830 3.839 20 5 FHBDRN COc1ccccc1COC1CCN(Cc2c(F)cccc2[N+](=O)[O-])CC1 ZINC000179752893 939931359 /nfs/dbraw/zinc/93/13/59/939931359.db2.gz CHLZQSMPLFYJEP-UHFFFAOYSA-N 0 0 374.412 3.924 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)NCc2ccn(C3CCCC3)n2)cc1[N+](=O)[O-] ZINC000151352763 945282876 /nfs/dbraw/zinc/28/28/76/945282876.db2.gz NMRIGNHLFDZBFR-CQSZACIVSA-N 0 0 371.441 3.775 20 5 FHBDRN Cc1cc(C(=O)N[C@H]2C[C@@H]2c2ccccc2OC(F)F)cc([N+](=O)[O-])c1 ZINC000437374146 945282939 /nfs/dbraw/zinc/28/29/39/945282939.db2.gz GAKSHLCIZUMACI-CABCVRRESA-N 0 0 362.332 3.791 20 5 FHBDRN CC(C)CCSc1ccc(C(=O)N(CCO)C2CCC2)cc1[N+](=O)[O-] ZINC000440155037 945283042 /nfs/dbraw/zinc/28/30/42/945283042.db2.gz GSEJIGBEXHJOHL-UHFFFAOYSA-N 0 0 366.483 3.720 20 5 FHBDRN COc1cc(CN2CC=C(c3ccc(O)cc3)CC2)c([N+](=O)[O-])cc1OC ZINC000179803946 939947715 /nfs/dbraw/zinc/94/77/15/939947715.db2.gz BNIXUVOSOKPLET-UHFFFAOYSA-N 0 0 370.405 3.607 20 5 FHBDRN Cc1nc(C(C)C)oc1C(=O)Nc1cc(C)nc2ccc([N+](=O)[O-])cc21 ZINC000410706857 939947791 /nfs/dbraw/zinc/94/77/91/939947791.db2.gz WKPDSIFWTVXQIY-UHFFFAOYSA-N 0 0 354.366 3.545 20 5 FHBDRN CC(C)C[C@H]1OCCC[C@H]1NC(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000410735923 939950921 /nfs/dbraw/zinc/95/09/21/939950921.db2.gz KMFVCNDYPMQKPH-HUUCEWRRSA-N 0 0 374.359 3.937 20 5 FHBDRN COCCN(C(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F)[C@@H]1CCC[C@H]1C ZINC000410761975 939954896 /nfs/dbraw/zinc/95/48/96/939954896.db2.gz NQTJLUBVDYMASR-IAQYHMDHSA-N 0 0 374.359 3.891 20 5 FHBDRN CO[C@]1(C(F)(F)F)CCCN(c2ccc3cc([N+](=O)[O-])ccc3n2)C1 ZINC000614830310 939962443 /nfs/dbraw/zinc/96/24/43/939962443.db2.gz VSZBWSJOTGGUAS-OAHLLOKOSA-N 0 0 355.316 3.691 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H]1C[C@H]1c1ccc(Cl)c(F)c1 ZINC000437360513 945286178 /nfs/dbraw/zinc/28/61/78/945286178.db2.gz VRXYCLRXYOYTBU-SWLSCSKDSA-N 0 0 364.760 3.682 20 5 FHBDRN Cc1c(C(=O)Nc2cccc(N3CCCCC3=O)c2)cccc1[N+](=O)[O-] ZINC000005441613 939982962 /nfs/dbraw/zinc/98/29/62/939982962.db2.gz XQZCKNWUOPSAJM-UHFFFAOYSA-N 0 0 353.378 3.672 20 5 FHBDRN CCN(C(=O)c1ccc2c(c1[N+](=O)[O-])OCCCO2)[C@@H]1CCCC[C@H]1C ZINC001125794265 939983755 /nfs/dbraw/zinc/98/37/55/939983755.db2.gz MWKZBBOWNCPOAV-UKRRQHHQSA-N 0 0 362.426 3.797 20 5 FHBDRN COc1cc(C(=O)NC(C)(C)C2CCC2)c([N+](=O)[O-])cc1OC(F)F ZINC000411047482 939990756 /nfs/dbraw/zinc/99/07/56/939990756.db2.gz VUAPWUDGRUABNB-UHFFFAOYSA-N 0 0 358.341 3.513 20 5 FHBDRN COc1cc(N2CC[C@@H](n3ncc4ccccc43)C2)c([N+](=O)[O-])cc1F ZINC000511339481 939991467 /nfs/dbraw/zinc/99/14/67/939991467.db2.gz AAVHTNUZPPYWDH-CYBMUJFWSA-N 0 0 356.357 3.544 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@H](n2cc3ccccc3n2)C1 ZINC000364719889 939992760 /nfs/dbraw/zinc/99/27/60/939992760.db2.gz DFYKSNKUJHJNIP-INIZCTEOSA-N 0 0 365.393 3.732 20 5 FHBDRN C[C@H](c1ccc(-n2cncn2)cc1)N(C)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000047540894 945287848 /nfs/dbraw/zinc/28/78/48/945287848.db2.gz VCJAQEGICVPTAQ-CYBMUJFWSA-N 0 0 355.373 3.508 20 5 FHBDRN Cc1nc2sccn2c1-c1noc(C(C)(C)c2ccccc2[N+](=O)[O-])n1 ZINC000426583896 945288257 /nfs/dbraw/zinc/28/82/57/945288257.db2.gz MOVNGMVGSPLGRU-UHFFFAOYSA-N 0 0 369.406 3.988 20 5 FHBDRN C[C@@H](c1ccc(-n2cncn2)cc1)N(C)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000047540891 945288350 /nfs/dbraw/zinc/28/83/50/945288350.db2.gz VCJAQEGICVPTAQ-ZDUSSCGKSA-N 0 0 355.373 3.508 20 5 FHBDRN Cc1sc(S(=O)(=O)NCc2csc3ccccc23)cc1[N+](=O)[O-] ZINC000467396427 945288370 /nfs/dbraw/zinc/28/83/70/945288370.db2.gz YVDGHMMHWYAVAZ-UHFFFAOYSA-N 0 0 368.461 3.658 20 5 FHBDRN COc1ccc(Cl)c2c1N(C(=O)c1cc(F)cc([N+](=O)[O-])c1)CCC2 ZINC000518281505 945288562 /nfs/dbraw/zinc/28/85/62/945288562.db2.gz LTHFNDXVAPXLSI-UHFFFAOYSA-N 0 0 364.760 3.989 20 5 FHBDRN CC(C)c1nnc(/C=C/C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)o1 ZINC000179854986 940009293 /nfs/dbraw/zinc/00/92/93/940009293.db2.gz ZLEMYWBUCLEIEU-MDZDMXLPSA-N 0 0 358.398 3.552 20 5 FHBDRN O=C1[C@@H](Sc2ccc3c(c2)CCC3)CCN1c1cccc([N+](=O)[O-])c1 ZINC000518282674 945289238 /nfs/dbraw/zinc/28/92/38/945289238.db2.gz JRBABYOHOGUWHS-SFHVURJKSA-N 0 0 354.431 3.981 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CCC[C@H](C(F)(F)F)C2)ccc1[N+](=O)[O-] ZINC000411191182 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COc1cccc(Cc2noc(-c3ccc(C(C)(C)C)c([N+](=O)[O-])c3)n2)n1 ZINC000612979974 940375588 /nfs/dbraw/zinc/37/55/88/940375588.db2.gz OYEIMPFZOXMGFZ-UHFFFAOYSA-N 0 0 368.393 3.937 20 5 FHBDRN O=C(Nc1cc(Br)ccn1)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000236038323 940383097 /nfs/dbraw/zinc/38/30/97/940383097.db2.gz NJDQADCDCLUIMT-UHFFFAOYSA-N 0 0 356.563 3.658 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H](C)c1c(F)cccc1Cl ZINC000427382785 945313432 /nfs/dbraw/zinc/31/34/32/945313432.db2.gz OLERUDAEVMQCTP-VIFPVBQESA-N 0 0 352.749 3.887 20 5 FHBDRN CC(C)(C(=O)NC[C@H]1CCc2ccccc2C1)c1ccc([N+](=O)[O-])cc1F ZINC000612997898 940386271 /nfs/dbraw/zinc/38/62/71/940386271.db2.gz RGFVWEBHITZXON-AWEZNQCLSA-N 0 0 370.424 3.933 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)c2cccc(Cl)c2[N+](=O)[O-])cc1[N+](=O)[O-] ZINC000177728254 940388457 /nfs/dbraw/zinc/38/84/57/940388457.db2.gz MNWLLEMYLPEILO-SNVBAGLBSA-N 0 0 363.757 3.956 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)c2cccc(Cl)c2[N+](=O)[O-])cc1[N+](=O)[O-] ZINC000177728268 940388558 /nfs/dbraw/zinc/38/85/58/940388558.db2.gz MNWLLEMYLPEILO-JTQLQIEISA-N 0 0 363.757 3.956 20 5 FHBDRN CC[C@@H](CNC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F)CC(F)(F)F ZINC000414012241 940400959 /nfs/dbraw/zinc/40/09/59/940400959.db2.gz VCTSBZQYMHKNPM-MRVPVSSYSA-N 0 0 354.275 3.510 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)Nc2cc(O)c(C)cc2C)cc1OC ZINC000613032377 940408510 /nfs/dbraw/zinc/40/85/10/940408510.db2.gz GIZLLSOQWFXGLY-UHFFFAOYSA-N 0 0 360.366 3.577 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccnn1-c1ccc(Cl)cc1 ZINC000427367243 945318559 /nfs/dbraw/zinc/31/85/59/945318559.db2.gz RJEYXYPPDRHNKP-UHFFFAOYSA-N 0 0 372.768 3.695 20 5 FHBDRN COc1c(F)cc(F)cc1NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000472494200 940421456 /nfs/dbraw/zinc/42/14/56/940421456.db2.gz FZNPTJWREHKNPV-UHFFFAOYSA-N 0 0 356.712 3.716 20 5 FHBDRN CCN1C(=O)CCc2cc(N[C@@H]3CCc4c3cccc4[N+](=O)[O-])ccc21 ZINC000579971623 940426056 /nfs/dbraw/zinc/42/60/56/940426056.db2.gz GEIJNZSTTGDHLA-QGZVFWFLSA-N 0 0 351.406 3.993 20 5 FHBDRN CC[C@H](c1ccccc1)N1CC(=O)N(Cc2cccc([N+](=O)[O-])c2C)C1=O ZINC000431731804 940431549 /nfs/dbraw/zinc/43/15/49/940431549.db2.gz BXRRKFIBQCFVKB-QGZVFWFLSA-N 0 0 367.405 3.819 20 5 FHBDRN COc1cc(OC)c(NC(=O)c2ccc([N+](=O)[O-])c(OC)c2)cc1Cl ZINC000511422944 940438353 /nfs/dbraw/zinc/43/83/53/940438353.db2.gz WMBFJTQCBVRXSX-UHFFFAOYSA-N 0 0 366.757 3.526 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H]1CCCO[C@H]1c1ccc(C)cc1 ZINC000427369912 945320660 /nfs/dbraw/zinc/32/06/60/945320660.db2.gz LTPKYJTVJPGSSM-MJGOQNOKSA-N 0 0 370.405 3.562 20 5 FHBDRN CCCOc1ccc(NC(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)c(C)c1 ZINC000066331877 940439084 /nfs/dbraw/zinc/43/90/84/940439084.db2.gz BMEVXXGTYFNNHI-UHFFFAOYSA-N 0 0 372.377 3.716 20 5 FHBDRN O=C(NCCc1ccc(Cl)nc1)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000177801049 940440960 /nfs/dbraw/zinc/44/09/60/940440960.db2.gz ISWQCZSHZIOMPV-UHFFFAOYSA-N 0 0 361.810 3.830 20 5 FHBDRN COC(=O)c1ccc(OCC(=O)c2ccc3ccccc3c2)cc1[N+](=O)[O-] ZINC000613110028 940452209 /nfs/dbraw/zinc/45/22/09/940452209.db2.gz SGAXBMNXXGKSOU-UHFFFAOYSA-N 0 0 365.341 3.796 20 5 FHBDRN CCc1nc2sccc2c(Oc2ccc(C(=O)OC)c([N+](=O)[O-])c2)n1 ZINC000613114208 940457175 /nfs/dbraw/zinc/45/71/75/940457175.db2.gz NODHDTVOFANDIB-UHFFFAOYSA-N 0 0 359.363 3.741 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)c2csc(-c3ccccn3)n2)cc1[N+](=O)[O-] ZINC000177861574 940469403 /nfs/dbraw/zinc/46/94/03/940469403.db2.gz ATGYNLYWCJGFKW-LBPRGKRZSA-N 0 0 368.418 3.913 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CCCc3ccc(F)cc32)c1 ZINC000548997288 940469711 /nfs/dbraw/zinc/46/97/11/940469711.db2.gz XZILUXBJUKNFOD-KRWDZBQOSA-N 0 0 358.369 3.940 20 5 FHBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)Nc1ccc(-c2ccccn2)cc1 ZINC000580265787 940471340 /nfs/dbraw/zinc/47/13/40/940471340.db2.gz JAMUMOQZFNGUHU-UHFFFAOYSA-N 0 0 369.402 3.599 20 5 FHBDRN O=c1c2cccc([N+](=O)[O-])c2ccn1CCCOCCc1ccccc1 ZINC000580326130 940472915 /nfs/dbraw/zinc/47/29/15/940472915.db2.gz IYCAMUYHZGDRBY-UHFFFAOYSA-N 0 0 352.390 3.559 20 5 FHBDRN C[C@H](C(=O)N1CCN(c2cccc(F)c2)C[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000580360565 940473844 /nfs/dbraw/zinc/47/38/44/940473844.db2.gz ZWOVMPRUBSGBSQ-GJZGRUSLSA-N 0 0 371.412 3.575 20 5 FHBDRN COc1ccc(/C=C2\N=C(c3c(Cl)cccc3[N+](=O)[O-])OC2=O)s1 ZINC000177888406 940474591 /nfs/dbraw/zinc/47/45/91/940474591.db2.gz ZHHRUKWDIAWIQH-YFHOEESVSA-N 0 0 364.766 3.663 20 5 FHBDRN CCOc1cccc(-c2cccc(NC(=O)c3cc([N+](=O)[O-])cn3C)n2)c1 ZINC000580391580 940475770 /nfs/dbraw/zinc/47/57/70/940475770.db2.gz ZLOGDDBOKUCYMI-UHFFFAOYSA-N 0 0 366.377 3.646 20 5 FHBDRN Cc1cccc2c(CCNC(=O)[C@H](C)c3cccc([N+](=O)[O-])c3)c[nH]c21 ZINC000580500775 940477269 /nfs/dbraw/zinc/47/72/69/940477269.db2.gz HTDXPRMVHHCCPX-CQSZACIVSA-N 0 0 351.406 3.847 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1OC[C@H](O)COc1ccccc1C(F)(F)F ZINC000580622081 940480593 /nfs/dbraw/zinc/48/05/93/940480593.db2.gz NKUXVELDGLSYBL-GFCCVEGCSA-N 0 0 371.311 3.741 20 5 FHBDRN C[C@H]1C[C@H](C)CN(c2ccc(C(=O)N[C@H]3CCC[C@H]3F)cc2[N+](=O)[O-])C1 ZINC000580595464 940481884 /nfs/dbraw/zinc/48/18/84/940481884.db2.gz ICMXDZJDAQVHOW-UGQVUOCMSA-N 0 0 363.433 3.698 20 5 FHBDRN CC[C@H](c1ccccc1OC)N(C)C(=O)c1ccc(OC)c([N+](=O)[O-])c1 ZINC000580595242 940481957 /nfs/dbraw/zinc/48/19/57/940481957.db2.gz XKJKNOJXIWIOEC-OAHLLOKOSA-N 0 0 358.394 3.835 20 5 FHBDRN O=C(c1c(Cl)cccc1[N+](=O)[O-])N1CCC(F)(c2ccccn2)CC1 ZINC000580595809 940481977 /nfs/dbraw/zinc/48/19/77/940481977.db2.gz YBLPJNFRJCCUFA-UHFFFAOYSA-N 0 0 363.776 3.744 20 5 FHBDRN Cc1cc(NC(=O)c2ncoc2-c2ccccc2)c2cc([N+](=O)[O-])ccc2n1 ZINC000613195513 940482268 /nfs/dbraw/zinc/48/22/68/940482268.db2.gz VVPLLKJPGQRMTM-UHFFFAOYSA-N 0 0 374.356 3.781 20 5 FHBDRN Cc1ccc(-c2noc([C@H](C)NC(=O)c3ccccc3[N+](=O)[O-])n2)cc1F ZINC000472522996 940484272 /nfs/dbraw/zinc/48/42/72/940484272.db2.gz RPGGCACSDFMRBL-NSHDSACASA-N 0 0 370.340 3.583 20 5 FHBDRN Cc1cc(NC(=O)c2ccc3nccc(C)c3c2)c2cc([N+](=O)[O-])ccc2n1 ZINC000580839237 940486851 /nfs/dbraw/zinc/48/68/51/940486851.db2.gz OLKGMRHNERBPLR-UHFFFAOYSA-N 0 0 372.384 3.982 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H](C)C[C@H]2c2cccnc2)c1 ZINC000549008706 940488196 /nfs/dbraw/zinc/48/81/96/940488196.db2.gz GHKHZSJXZIQACK-UGSOOPFHSA-N 0 0 355.394 3.612 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N(C)c2cccc3ncccc32)c1 ZINC000549007242 940489317 /nfs/dbraw/zinc/48/93/17/940489317.db2.gz RIKKHTUTICOUBN-UHFFFAOYSA-N 0 0 351.362 3.818 20 5 FHBDRN CCn1c(C)nc([N+](=O)[O-])c1N[C@H]1CCc2c1cccc2Br ZINC000580973359 940491282 /nfs/dbraw/zinc/49/12/82/940491282.db2.gz BYSBRRPUEOJGCR-ZDUSSCGKSA-N 0 0 365.231 3.982 20 5 FHBDRN CC(C)c1ccc(C(=O)N2CCC(C3CCOCC3)CC2)cc1[N+](=O)[O-] ZINC000580986523 940491470 /nfs/dbraw/zinc/49/14/70/940491470.db2.gz MLMYKXOQVPKVRC-UHFFFAOYSA-N 0 0 360.454 3.997 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NCCc2ccc3ccccc3n2)c1 ZINC000549009826 940491676 /nfs/dbraw/zinc/49/16/76/940491676.db2.gz IYYBFSPCJRFBER-UHFFFAOYSA-N 0 0 365.389 3.514 20 5 FHBDRN O=C(NCc1cccc([N+](=O)[O-])c1)Nc1ccc(OC(F)F)cc1F ZINC000549009820 940491745 /nfs/dbraw/zinc/49/17/45/940491745.db2.gz RIZLDAYNWUSADE-UHFFFAOYSA-N 0 0 355.272 3.657 20 5 FHBDRN CCOc1ccc(CNC(=O)c2cc([N+](=O)[O-])c(C)s2)cc1Cl ZINC000581077529 940493003 /nfs/dbraw/zinc/49/30/03/940493003.db2.gz MGMQRMXUVCPXBP-UHFFFAOYSA-N 0 0 354.815 3.947 20 5 FHBDRN CC(C)(CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2)C(F)(F)F ZINC000280322018 940494809 /nfs/dbraw/zinc/49/48/09/940494809.db2.gz HCDZRQSJUUPONP-UHFFFAOYSA-N 0 0 362.304 3.673 20 5 FHBDRN C[C@@H](CN(C)C(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)c1ccccc1 ZINC000066458371 940494858 /nfs/dbraw/zinc/49/48/58/940494858.db2.gz UWBWVWKBJROVDQ-HNNXBMFYSA-N 0 0 364.405 3.656 20 5 FHBDRN Cc1ccc2cccc(NC(=O)c3cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c3)c2n1 ZINC000066462662 940495543 /nfs/dbraw/zinc/49/55/43/940495543.db2.gz JEASJWIIEBSXPN-UHFFFAOYSA-N 0 0 366.333 3.920 20 5 FHBDRN Cn1c(Cc2ccsc2)nnc1N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000581219059 940496919 /nfs/dbraw/zinc/49/69/19/940496919.db2.gz DJDMECAHUWCLTE-UHFFFAOYSA-N 0 0 369.450 3.545 20 5 FHBDRN O=C(Nc1cccc(F)c1Cl)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000581242404 940497434 /nfs/dbraw/zinc/49/74/34/940497434.db2.gz LEQZLTHGNPGWDF-UHFFFAOYSA-N 0 0 360.732 3.825 20 5 FHBDRN Cc1cc(C)c2c(c1)N(C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)CCC2 ZINC000066476688 940498718 /nfs/dbraw/zinc/49/87/18/940498718.db2.gz PXSWMQOLMFKKCS-UHFFFAOYSA-N 0 0 355.350 3.713 20 5 FHBDRN C[C@H](OC(=O)CCn1cc([N+](=O)[O-])cn1)[C@H](C)c1nc2ccccc2s1 ZINC000177990834 940499738 /nfs/dbraw/zinc/49/97/38/940499738.db2.gz VOFLDUWCCFWELT-RYUDHWBXSA-N 0 0 374.422 3.527 20 5 FHBDRN COc1cccc(CCNc2cc(C(F)(F)F)ncc2[N+](=O)[O-])c1OC ZINC000581407807 940501794 /nfs/dbraw/zinc/50/17/94/940501794.db2.gz FOJSIHWCCKYLTO-UHFFFAOYSA-N 0 0 371.315 3.680 20 5 FHBDRN CSc1ccc(F)cc1CNC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000581421550 940501977 /nfs/dbraw/zinc/50/19/77/940501977.db2.gz RQOMAWGJMDNUEP-UHFFFAOYSA-N 0 0 370.352 3.593 20 5 FHBDRN Cc1nnc(-c2cccc(NCc3ccc([N+](=O)[O-])cc3Cl)c2)n1C ZINC000543862384 940508104 /nfs/dbraw/zinc/50/81/04/940508104.db2.gz WYAGTAWTGQTNHG-UHFFFAOYSA-N 0 0 357.801 3.964 20 5 FHBDRN C[C@H](c1nc(Cn2cnc3ccccc32)no1)c1ccc([N+](=O)[O-])cc1F ZINC000581639958 940509097 /nfs/dbraw/zinc/50/90/97/940509097.db2.gz QEHUYJNMGNMSTO-NSHDSACASA-N 0 0 367.340 3.667 20 5 FHBDRN CC[C@@H](NC(=O)CSc1ccc([N+](=O)[O-])cc1)c1nc2ccccc2[nH]1 ZINC000066524508 940599839 /nfs/dbraw/zinc/59/98/39/940599839.db2.gz XGQOENOBEHUKDW-CQSZACIVSA-N 0 0 370.434 3.831 20 5 FHBDRN CC[C@@H](NC(=O)CCNc1ccccc1[N+](=O)[O-])c1nc2ccccc2[nH]1 ZINC000066523640 940600832 /nfs/dbraw/zinc/60/08/32/940600832.db2.gz MVJGRJUJEQUSPP-CYBMUJFWSA-N 0 0 367.409 3.541 20 5 FHBDRN CC[C@H](NC(=O)CCNc1ccccc1[N+](=O)[O-])c1nc2ccccc2[nH]1 ZINC000066523639 940600883 /nfs/dbraw/zinc/60/08/83/940600883.db2.gz MVJGRJUJEQUSPP-ZDUSSCGKSA-N 0 0 367.409 3.541 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)N[C@H]2C[C@H]3CCC(C)(C)c4cccc2c43)n1 ZINC000427388865 945334448 /nfs/dbraw/zinc/33/44/48/945334448.db2.gz CHBSHFPZGLIPIV-DOMZBBRYSA-N 0 0 368.437 3.841 20 5 FHBDRN CCC[C@@H](Cc1ccccc1)N(CCC)C(=O)Cn1cc([N+](=O)[O-])nc1C ZINC000066545966 940632139 /nfs/dbraw/zinc/63/21/39/940632139.db2.gz MBYSYYAXCYLLIS-SFHVURJKSA-N 0 0 372.469 3.750 20 5 FHBDRN COc1cccc(C(=O)N[C@@H](c2ccccc2)C(F)(F)F)c1[N+](=O)[O-] ZINC000581981350 940637474 /nfs/dbraw/zinc/63/74/74/940637474.db2.gz DGHARILGILOLGJ-AWEZNQCLSA-N 0 0 354.284 3.637 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)c2ccc(-c3cc[nH]n3)s2)cc1[N+](=O)[O-] ZINC000431816022 940643289 /nfs/dbraw/zinc/64/32/89/940643289.db2.gz YJNRUUDXZNZLBP-NSHDSACASA-N 0 0 356.407 3.846 20 5 FHBDRN C[C@H](C(=O)NCCc1c[nH]c2cc(F)ccc12)c1cccc([N+](=O)[O-])c1 ZINC000582156257 940651263 /nfs/dbraw/zinc/65/12/63/940651263.db2.gz XTXHYZFFLNPXGA-LBPRGKRZSA-N 0 0 355.369 3.678 20 5 FHBDRN C[C@@H](c1nc(-c2ccc3c(c2)CCC(=O)N3)no1)c1cccc([N+](=O)[O-])c1 ZINC000582088482 940652581 /nfs/dbraw/zinc/65/25/81/940652581.db2.gz LOLSNFGAVGNZIW-LLVKDONJSA-N 0 0 364.361 3.681 20 5 FHBDRN C[C@@H]1CN(C(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)[C@@H](c2ccccc2)CO1 ZINC000173724488 940664430 /nfs/dbraw/zinc/66/44/30/940664430.db2.gz PENGFPNWZLQRHP-BFUOFWGJSA-N 0 0 365.389 3.678 20 5 FHBDRN C[C@H](c1ccco1)N(C)c1nnc(-c2cccc([N+](=O)[O-])c2)n1C1CC1 ZINC000582307560 940664909 /nfs/dbraw/zinc/66/49/09/940664909.db2.gz QXTHFPKYZXAVFY-GFCCVEGCSA-N 0 0 353.382 3.979 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(Cc2noc(/C=C/c3scnc3C)n2)c1 ZINC000582326958 940665742 /nfs/dbraw/zinc/66/57/42/940665742.db2.gz DRYWEBAZKBBSAK-AATRIKPKSA-N 0 0 358.379 3.513 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)Nc2nc(-c3cccc(O)c3)cs2)c1 ZINC000173875378 940680855 /nfs/dbraw/zinc/68/08/55/940680855.db2.gz FWCSKZNSUCQCMG-UHFFFAOYSA-N 0 0 355.375 3.985 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@@H](Cc2ccccc2)C1 ZINC000174124501 940704030 /nfs/dbraw/zinc/70/40/30/940704030.db2.gz PVGMROWTGQUWJO-HNNXBMFYSA-N 0 0 355.394 3.700 20 5 FHBDRN CCOc1ccc(S(=O)(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)c(C)c1 ZINC000180160380 940721092 /nfs/dbraw/zinc/72/10/92/940721092.db2.gz BRGJZFBEZUHZFD-UHFFFAOYSA-N 0 0 364.423 3.720 20 5 FHBDRN C[C@@H](NC(=O)CCOc1ccccc1[N+](=O)[O-])c1cc2ccccc2o1 ZINC000047609806 945344928 /nfs/dbraw/zinc/34/49/28/945344928.db2.gz PJRXVIDGRUOJRM-CYBMUJFWSA-N 0 0 354.362 3.987 20 5 FHBDRN CCOc1ccc(C(=O)N(Cc2ccccc2)CC(F)F)cc1[N+](=O)[O-] ZINC000174619555 940751012 /nfs/dbraw/zinc/75/10/12/940751012.db2.gz QDVQCQLUCTXPHG-UHFFFAOYSA-N 0 0 364.348 3.901 20 5 FHBDRN O=C(Nc1cccc(Nc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)c1)C1CC1 ZINC000170639473 940754986 /nfs/dbraw/zinc/75/49/86/940754986.db2.gz IZMIUAWYLYNORE-UHFFFAOYSA-N 0 0 366.377 3.572 20 5 FHBDRN O=C1CCc2cc([N+](=O)[O-])c(Sc3nnc(-c4cccs4)o3)cc2N1 ZINC000170639297 940755112 /nfs/dbraw/zinc/75/51/12/940755112.db2.gz OUPJAKZZNFIOFM-UHFFFAOYSA-N 0 0 374.403 3.742 20 5 FHBDRN Cc1cc(C)cc([C@H](C)NC(=O)N2CCC(n3ccc([N+](=O)[O-])n3)CC2)c1 ZINC000365511332 940755616 /nfs/dbraw/zinc/75/56/16/940755616.db2.gz NAJPHHDWNNNCNQ-HNNXBMFYSA-N 0 0 371.441 3.516 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)NCc1ccc(F)cc1CSC ZINC000124912256 945346880 /nfs/dbraw/zinc/34/68/80/945346880.db2.gz YLYRVYITPPVRON-UHFFFAOYSA-N 0 0 364.398 3.536 20 5 FHBDRN O=C(Nc1cccc2cc[nH]c21)N1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000582634637 940769644 /nfs/dbraw/zinc/76/96/44/940769644.db2.gz CTVMCOXMXHUWCN-UHFFFAOYSA-N 0 0 352.350 3.503 20 5 FHBDRN CN(C[C@H]1CCCO1)C(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000170679104 940779269 /nfs/dbraw/zinc/77/92/69/940779269.db2.gz BRAHAJKAHBFFPE-MRXNPFEDSA-N 0 0 355.394 3.589 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])Nc1ccnn1-c1ccc(Cl)cc1 ZINC000174818681 940780032 /nfs/dbraw/zinc/78/00/32/940780032.db2.gz NIRPIUVMGZBUQZ-UHFFFAOYSA-N 0 0 356.769 3.615 20 5 FHBDRN Cc1ccc([C@H](C)N(C)C(=O)C(=O)Nc2cc(F)cc([N+](=O)[O-])c2)c(C)c1 ZINC000472556784 940782117 /nfs/dbraw/zinc/78/21/17/940782117.db2.gz PJOLYQPPUPKAAG-ZDUSSCGKSA-N 0 0 373.384 3.509 20 5 FHBDRN Cc1cc(S(=O)(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)sc1Cl ZINC000473862002 945348476 /nfs/dbraw/zinc/34/84/76/945348476.db2.gz YCFGVWQMJCZIRQ-SNVBAGLBSA-N 0 0 374.871 3.966 20 5 FHBDRN CSc1ccccc1N(C)S(=O)(=O)c1c(C)cc([N+](=O)[O-])cc1C ZINC000174971978 940792734 /nfs/dbraw/zinc/79/27/34/940792734.db2.gz SMIAPAHWSULEGZ-UHFFFAOYSA-N 0 0 366.464 3.759 20 5 FHBDRN Cc1c(CC(=O)N2C[C@H](C(C)C)Nc3ccccc32)cccc1[N+](=O)[O-] ZINC000440258303 945349444 /nfs/dbraw/zinc/34/94/44/945349444.db2.gz HZTKVGAWZKGSIV-QGZVFWFLSA-N 0 0 353.422 3.929 20 5 FHBDRN Cc1ccc(OC[C@H](O)COc2ccccc2C(F)(F)F)c([N+](=O)[O-])c1 ZINC000582689447 940814023 /nfs/dbraw/zinc/81/40/23/940814023.db2.gz RWTNTDJTKLLRLN-GFCCVEGCSA-N 0 0 371.311 3.741 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)Nc1cc(CCc2ccccc2)ccn1 ZINC000175229146 940830054 /nfs/dbraw/zinc/83/00/54/940830054.db2.gz MKKBWHPMKKUAQZ-UHFFFAOYSA-N 0 0 362.389 3.731 20 5 FHBDRN Nc1c(C(=O)Nc2ccc(N3CCCC3)c(Cl)c2)cccc1[N+](=O)[O-] ZINC000178195863 940835608 /nfs/dbraw/zinc/83/56/08/940835608.db2.gz AURALDPIWHYOPK-UHFFFAOYSA-N 0 0 360.801 3.683 20 5 FHBDRN CCS[C@@H]1CCCC[C@H]1NC(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000175246682 940835959 /nfs/dbraw/zinc/83/59/59/940835959.db2.gz BCEBJWPWOCDHNK-CZUORRHYSA-N 0 0 352.456 3.544 20 5 FHBDRN COc1ccc2oc([C@H](C)NC(=O)c3cc([N+](=O)[O-])cnc3C)c(C)c2c1 ZINC000106665751 945352663 /nfs/dbraw/zinc/35/26/63/945352663.db2.gz BQNCFYHATNLOFX-LBPRGKRZSA-N 0 0 369.377 3.852 20 5 FHBDRN O=C(N[C@H]1CCO[C@@H]1c1ccc(Cl)c(F)c1)c1ccc([N+](=O)[O-])s1 ZINC000180223642 940847891 /nfs/dbraw/zinc/84/78/91/940847891.db2.gz REULIZCTPBOSDK-SMDDNHRTSA-N 0 0 370.789 3.709 20 5 FHBDRN O=C(c1ccc(C2CCCC2)cc1)N1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000582757123 940864173 /nfs/dbraw/zinc/86/41/73/940864173.db2.gz XWGKALYBKKRFBB-UHFFFAOYSA-N 0 0 368.437 3.926 20 5 FHBDRN COc1ccc(C)cc1NC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000175503275 940873555 /nfs/dbraw/zinc/87/35/55/940873555.db2.gz DAXVKCBMZCVDLM-UHFFFAOYSA-N 0 0 365.183 3.927 20 5 FHBDRN O=C(N[C@H]1CCO[C@@H]1c1ccc(Cl)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000180257493 940884838 /nfs/dbraw/zinc/88/48/38/940884838.db2.gz PJWXNVDBNLUPOV-JKSUJKDBSA-N 0 0 364.760 3.647 20 5 FHBDRN O=C(Nc1cc(F)cc(F)c1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000175550106 940888575 /nfs/dbraw/zinc/88/85/75/940888575.db2.gz QBERGCFADJDEGH-UHFFFAOYSA-N 0 0 357.110 3.888 20 5 FHBDRN CN(C)c1ccccc1NC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000175590365 940893007 /nfs/dbraw/zinc/89/30/07/940893007.db2.gz ZZXKGQKFMHMPQW-UHFFFAOYSA-N 0 0 364.199 3.676 20 5 FHBDRN O=C1CC[C@H](c2cccc(N[C@@H](Cc3ccccc3[N+](=O)[O-])C3CC3)c2)N1 ZINC000414313136 940945594 /nfs/dbraw/zinc/94/55/94/940945594.db2.gz KBHUIDMYQNLWOF-MOPGFXCFSA-N 0 0 365.433 3.979 20 5 FHBDRN C[C@H]1C[C@@H]1C(=O)Nc1ccc(C(=O)OCc2ccc([N+](=O)[O-])c(F)c2)cc1 ZINC000782782905 940955614 /nfs/dbraw/zinc/95/56/14/940955614.db2.gz ITPRHIKUHJUKSW-NHYWBVRUSA-N 0 0 372.352 3.685 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N1CC(C)(C)[C@@H]1c1cnn(C)c1 ZINC000582970122 940960476 /nfs/dbraw/zinc/96/04/76/940960476.db2.gz LVPDPMIGBWFDKZ-HNNXBMFYSA-N 0 0 362.817 3.513 20 5 FHBDRN Cc1ccc(OC2CCN(C(=O)/C=C\c3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000255905708 940960777 /nfs/dbraw/zinc/96/07/77/940960777.db2.gz UHMLAJXUQYDZKR-WDZFZDKYSA-N 0 0 366.417 3.986 20 5 FHBDRN C[C@@H](Nc1cnn(C(C)(C)C)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000186269239 940969123 /nfs/dbraw/zinc/96/91/23/940969123.db2.gz KWHGZFNGWMEKPT-SNVBAGLBSA-N 0 0 365.821 3.639 20 5 FHBDRN COc1ccc(C[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1OC ZINC000180328454 940973132 /nfs/dbraw/zinc/97/31/32/940973132.db2.gz GNXLBKFXAMBWCF-ZDUSSCGKSA-N 0 0 358.394 3.738 20 5 FHBDRN CC(C)[C@@H](NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000018135955 945366415 /nfs/dbraw/zinc/36/64/15/945366415.db2.gz FJYZIUNMJKXIMP-MRXNPFEDSA-N 0 0 361.329 3.769 20 5 FHBDRN CC(C)[C@H](NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000018135956 945366512 /nfs/dbraw/zinc/36/65/12/945366512.db2.gz FJYZIUNMJKXIMP-INIZCTEOSA-N 0 0 361.329 3.769 20 5 FHBDRN O=[N+]([O-])c1sc(NCc2cccc(O)c2)nc1NCc1cccc(O)c1 ZINC000180417433 941004591 /nfs/dbraw/zinc/00/45/91/941004591.db2.gz WDLMLIOVKPWIMQ-UHFFFAOYSA-N 0 0 372.406 3.687 20 5 FHBDRN C[C@@H](NCc1cn(-c2ccc(Cl)cc2)nn1)c1cccc([N+](=O)[O-])c1 ZINC000180407092 941005671 /nfs/dbraw/zinc/00/56/71/941005671.db2.gz BNCKEVPEMIFNBR-GFCCVEGCSA-N 0 0 357.801 3.680 20 5 FHBDRN Cc1c([C@H](C)NCc2ccccc2[N+](=O)[O-])nnn1-c1ccc(Cl)cc1 ZINC000180413250 941008645 /nfs/dbraw/zinc/00/86/45/941008645.db2.gz UYNHZYXHRIWSFP-LBPRGKRZSA-N 0 0 371.828 3.988 20 5 FHBDRN Cn1ncc([N+](=O)[O-])c1C(=O)Nc1ccccc1NCC1CCCCC1 ZINC000180427085 941012869 /nfs/dbraw/zinc/01/28/69/941012869.db2.gz QQQDEUXFZIDNAG-UHFFFAOYSA-N 0 0 357.414 3.573 20 5 FHBDRN COC(=O)c1cccc(C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)c1 ZINC000180468688 941024020 /nfs/dbraw/zinc/02/40/20/941024020.db2.gz AKERVNJPWGSLKF-UHFFFAOYSA-N 0 0 368.267 3.653 20 5 FHBDRN CO[C@H](C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)c1ccccc1 ZINC000180467976 941024026 /nfs/dbraw/zinc/02/40/26/941024026.db2.gz ABDGTYVAFRIOFE-AWEZNQCLSA-N 0 0 354.284 3.940 20 5 FHBDRN O=C(CSCc1cccnc1)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000180468939 941024508 /nfs/dbraw/zinc/02/45/08/941024508.db2.gz GKAGXGUKRRIGHL-UHFFFAOYSA-N 0 0 371.340 3.881 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1)c1cc2c([nH]c(=O)cc2C(F)(F)F)o1 ZINC000024371183 941026533 /nfs/dbraw/zinc/02/65/33/941026533.db2.gz BNYYBAJFUZMJGR-UHFFFAOYSA-N 0 0 367.239 3.713 20 5 FHBDRN CC(C)(C)c1csc(CCNC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)n1 ZINC000412028482 941042568 /nfs/dbraw/zinc/04/25/68/941042568.db2.gz BHFWYHMLXAIADG-LSDHHAIUSA-N 0 0 373.478 3.811 20 5 FHBDRN O=C(C[C@@H]1CCC2(CCOCC2)CO1)Oc1cc(Cl)ccc1[N+](=O)[O-] ZINC000892635428 941048991 /nfs/dbraw/zinc/04/89/91/941048991.db2.gz FSVSVEZILZFGBM-ZDUSSCGKSA-N 0 0 369.801 3.520 20 5 FHBDRN Nc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(-c2nc3ccccc3[nH]2)cc1 ZINC000180620205 941055717 /nfs/dbraw/zinc/05/57/17/941055717.db2.gz FOGREHVYGYZNRQ-UHFFFAOYSA-N 0 0 373.372 3.973 20 5 FHBDRN Cc1csc([C@H](C)CNC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)n1 ZINC000186801662 941056886 /nfs/dbraw/zinc/05/68/86/941056886.db2.gz VGLAXVYRWLQVNU-LLVKDONJSA-N 0 0 362.455 3.698 20 5 FHBDRN CCC(=O)c1ccc(NC2CCN(Cc3cccnc3)CC2)c([N+](=O)[O-])c1 ZINC000376466865 941058763 /nfs/dbraw/zinc/05/87/63/941058763.db2.gz KUQYGRPMBSWJIK-UHFFFAOYSA-N 0 0 368.437 3.659 20 5 FHBDRN O=C(Nc1cccc(-n2ccnc2)c1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000180687725 941064077 /nfs/dbraw/zinc/06/40/77/941064077.db2.gz UMOCYKHFTONJKA-UHFFFAOYSA-N 0 0 374.303 3.634 20 5 FHBDRN CC(=O)c1cc(N2CCC[C@@H](c3ncc4n3CCCC4)C2)ccc1[N+](=O)[O-] ZINC000376474983 941067102 /nfs/dbraw/zinc/06/71/02/941067102.db2.gz QIBIQEOTUKJFDP-OAHLLOKOSA-N 0 0 368.437 3.714 20 5 FHBDRN CCSc1cc(C(=O)Nc2ccc3cc([N+](=O)[O-])ccc3n2)ccn1 ZINC000176707922 941070679 /nfs/dbraw/zinc/07/06/79/941070679.db2.gz QTCYRAADKBRXPZ-UHFFFAOYSA-N 0 0 354.391 3.902 20 5 FHBDRN CCOc1ccc(C(=O)Nc2ccc3cc([N+](=O)[O-])ccc3n2)cc1OC ZINC000176708528 941070720 /nfs/dbraw/zinc/07/07/20/941070720.db2.gz FRBSFWXIQIVWMD-UHFFFAOYSA-N 0 0 367.361 3.803 20 5 FHBDRN CN(C)c1ncccc1N(C)C(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000176777867 941074047 /nfs/dbraw/zinc/07/40/47/941074047.db2.gz YTYKXAVDJONXNX-UHFFFAOYSA-N 0 0 356.426 3.630 20 5 FHBDRN CCN([C@H](C)Cc1ccsc1)S(=O)(=O)c1c(C)cccc1[N+](=O)[O-] ZINC000188763618 941077251 /nfs/dbraw/zinc/07/72/51/941077251.db2.gz PRCCTTQJCSDBHT-CYBMUJFWSA-N 0 0 368.480 3.607 20 5 FHBDRN CCOC(=O)c1ccnc(N2CC[C@@H](c3ccccc3)[C@@H]2C)c1[N+](=O)[O-] ZINC000176807371 941078597 /nfs/dbraw/zinc/07/85/97/941078597.db2.gz MZOGETJIIKTGNG-DZGCQCFKSA-N 0 0 355.394 3.549 20 5 FHBDRN Cc1cc(Br)ccc1CC(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000180810597 941079948 /nfs/dbraw/zinc/07/99/48/941079948.db2.gz FBAZQFUNYJQLJP-UHFFFAOYSA-N 0 0 363.211 3.525 20 5 FHBDRN Cc1cnc(C(C)(C)NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)s1 ZINC000176865084 941081606 /nfs/dbraw/zinc/08/16/06/941081606.db2.gz AOWLVABFFYFPOW-UHFFFAOYSA-N 0 0 374.466 3.625 20 5 FHBDRN O=[N+]([O-])c1ccc2oc(CSc3n[nH]c(Cc4cccs4)n3)nc2c1 ZINC000176937259 941086473 /nfs/dbraw/zinc/08/64/73/941086473.db2.gz NMLQVNBGYSIHCO-UHFFFAOYSA-N 0 0 373.419 3.799 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NCCCCN(C)c2ccccc2)c1 ZINC000549086418 941093239 /nfs/dbraw/zinc/09/32/39/941093239.db2.gz RJTWGAYQQCGFCT-UHFFFAOYSA-N 0 0 371.437 3.640 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(N2CC[C@H](C)[N@@H+](Cc3ccccc3)CC2)n1 ZINC000541006387 941098268 /nfs/dbraw/zinc/09/82/68/941098268.db2.gz PREBHFRWWWHEBT-KRWDZBQOSA-N 0 0 354.454 3.707 20 5 FHBDRN CC(C)CCSc1ccc(C(=O)N2CC[C@H]([C@H](C)O)C2)cc1[N+](=O)[O-] ZINC000180994947 941101548 /nfs/dbraw/zinc/10/15/48/941101548.db2.gz SBTJGVJFZZACJT-ZFWWWQNUSA-N 0 0 366.483 3.576 20 5 FHBDRN CCc1nc2ccccc2n1CC(=O)Nc1cc([N+](=O)[O-])c(C)cc1C ZINC000181021182 941104084 /nfs/dbraw/zinc/10/40/84/941104084.db2.gz BTDBOWNBTBFFPR-UHFFFAOYSA-N 0 0 352.394 3.762 20 5 FHBDRN O=C(Cn1ccc([N+](=O)[O-])n1)Nc1ccc(F)cc1-c1ccc(Cl)cc1 ZINC000103038618 941105513 /nfs/dbraw/zinc/10/55/13/941105513.db2.gz TZNICJWYNXTRLS-UHFFFAOYSA-N 0 0 374.759 3.890 20 5 FHBDRN C[C@H](O)[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)C1 ZINC000181056451 941106188 /nfs/dbraw/zinc/10/61/88/941106188.db2.gz JOFNSZKQBHIWML-UONOGXRCSA-N 0 0 372.446 3.589 20 5 FHBDRN Nc1cccc([N+](=O)[O-])c1C(=O)N(CCc1ccc(Cl)cc1)CC1CC1 ZINC000181094442 941108697 /nfs/dbraw/zinc/10/86/97/941108697.db2.gz PEFDMVGJQDBKGG-UHFFFAOYSA-N 0 0 373.840 3.925 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1)N1CC2(CCOCC2)[C@@H]1c1ccccc1 ZINC000414408539 941110000 /nfs/dbraw/zinc/11/00/00/941110000.db2.gz MQDLTRBASQNFMX-SFHVURJKSA-N 0 0 367.405 3.980 20 5 FHBDRN CC(C)(C)C(=O)C(=O)Nc1ccc(OCc2ccccc2)cc1[N+](=O)[O-] ZINC000782848549 941111359 /nfs/dbraw/zinc/11/13/59/941111359.db2.gz DVYLWYRXIGTAJH-UHFFFAOYSA-N 0 0 356.378 3.728 20 5 FHBDRN CCCCN1CCc2ccc(NC(=O)COc3ccccc3[N+](=O)[O-])cc21 ZINC000472615581 941113265 /nfs/dbraw/zinc/11/32/65/941113265.db2.gz ZHDBVKYRCYYQCU-UHFFFAOYSA-N 0 0 369.421 3.775 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CCCC[C@@H]2C(C)C)cc1OC ZINC000103056133 941115111 /nfs/dbraw/zinc/11/51/11/941115111.db2.gz YXXIQFYPYJTBMS-UKRRQHHQSA-N 0 0 364.442 3.947 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1c2ccccc2SC[C@@H]1C ZINC000177394378 941120893 /nfs/dbraw/zinc/12/08/93/941120893.db2.gz IVNPFJGEWUNLGT-LBPRGKRZSA-N 0 0 364.448 3.593 20 5 FHBDRN CC(C)n1cnnc1-c1ccccc1NC(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000177483416 941129033 /nfs/dbraw/zinc/12/90/33/941129033.db2.gz MENADZCOYVVGEA-UHFFFAOYSA-N 0 0 365.393 3.615 20 5 FHBDRN Cc1nc(C)c([C@@H](C)N(C)C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)s1 ZINC000412038366 941132138 /nfs/dbraw/zinc/13/21/38/941132138.db2.gz OOWBJUHNSYJXPY-XFBWCDHKSA-N 0 0 359.451 3.991 20 5 FHBDRN CCn1cc(C(=O)Nc2ccc(OCc3ccccc3)cc2[N+](=O)[O-])cn1 ZINC000188974117 941137575 /nfs/dbraw/zinc/13/75/75/941137575.db2.gz DJTGIPQYMPBPAZ-UHFFFAOYSA-N 0 0 366.377 3.643 20 5 FHBDRN CCc1nc2cc(NC(=O)c3cc(OC)c(C)c([N+](=O)[O-])c3)ccc2o1 ZINC000189025639 941142035 /nfs/dbraw/zinc/14/20/35/941142035.db2.gz OIJFBLMHEUVMLP-UHFFFAOYSA-N 0 0 355.350 3.868 20 5 FHBDRN CC(C)c1ccc(C(=O)N[C@@H](C)c2ccc(NC(N)=O)cc2)cc1[N+](=O)[O-] ZINC000189027543 941142250 /nfs/dbraw/zinc/14/22/50/941142250.db2.gz NEHQGVZWOBNCGA-LBPRGKRZSA-N 0 0 370.409 3.700 20 5 FHBDRN CCN(Cc1ccccn1)C(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000177662047 941144489 /nfs/dbraw/zinc/14/44/89/941144489.db2.gz NZXWTVYREXBHLW-UHFFFAOYSA-N 0 0 371.440 3.598 20 5 FHBDRN COc1ccc(CC(C)(C)NC(=O)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000189137018 941147277 /nfs/dbraw/zinc/14/72/77/941147277.db2.gz RVOLKJKNJZDXJV-UHFFFAOYSA-N 0 0 356.422 3.674 20 5 FHBDRN O=C(COc1cccc([N+](=O)[O-])c1)Nc1ccc(Cl)c(OC(F)F)c1 ZINC000181401632 941151890 /nfs/dbraw/zinc/15/18/90/941151890.db2.gz WLDDVDLOBZWJCI-UHFFFAOYSA-N 0 0 372.711 3.867 20 5 FHBDRN Cc1cnc([C@@H](C)NC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)s1 ZINC000177918470 941152989 /nfs/dbraw/zinc/15/29/89/941152989.db2.gz BEKPRQSJRNXBGI-GHMZBOCLSA-N 0 0 351.453 3.718 20 5 FHBDRN Cc1nn(CCC(=O)N[C@@H]2CCc3ccc(C(C)C)cc32)c(C)c1[N+](=O)[O-] ZINC000189224208 941154967 /nfs/dbraw/zinc/15/49/67/941154967.db2.gz DKZRKCKBSKHEQN-GOSISDBHSA-N 0 0 370.453 3.725 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1F)Nc1ccccc1N1CCCCC1 ZINC000122211436 941156758 /nfs/dbraw/zinc/15/67/58/941156758.db2.gz BSKBOMLRVPUPHS-UHFFFAOYSA-N 0 0 357.385 3.905 20 5 FHBDRN COc1cc(OCC(=O)Nc2cccc(C(C)(F)F)c2)ccc1[N+](=O)[O-] ZINC000189397164 941157136 /nfs/dbraw/zinc/15/71/36/941157136.db2.gz DKDHOEPFRURYEU-UHFFFAOYSA-N 0 0 366.320 3.733 20 5 FHBDRN COC(=O)CC1(CC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)CCCC1 ZINC000189522093 941159513 /nfs/dbraw/zinc/15/95/13/941159513.db2.gz HNAKAZUQTUMOKQ-UHFFFAOYSA-N 0 0 374.437 3.599 20 5 FHBDRN COCCc1ccccc1NC(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000189441497 941159895 /nfs/dbraw/zinc/15/98/95/941159895.db2.gz FKAYGLJHSOJZEW-UHFFFAOYSA-N 0 0 371.437 3.928 20 5 FHBDRN O=[N+]([O-])c1ccc(NC(=S)N2CCC(CCCn3ccnc3)CC2)cc1 ZINC000782891172 941163807 /nfs/dbraw/zinc/16/38/07/941163807.db2.gz QXWUYUHZVYVVCW-UHFFFAOYSA-N 0 0 373.482 3.681 20 5 FHBDRN C[C@@H](NC(=O)c1cccc(OC[C@@H]2CCCO2)c1)c1cccc([N+](=O)[O-])c1 ZINC000077661743 941211045 /nfs/dbraw/zinc/21/10/45/941211045.db2.gz AATQSBBSOJTUNR-KUHUBIRLSA-N 0 0 370.405 3.644 20 5 FHBDRN O=C(Nc1ccc(OC2COC2)cc1)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000189606043 941221413 /nfs/dbraw/zinc/22/14/13/941221413.db2.gz DALJMJPSMALRMS-UHFFFAOYSA-N 0 0 370.386 3.839 20 5 FHBDRN CSc1cccc(C(=O)N[C@H]2CCOc3c(F)cccc32)c1[N+](=O)[O-] ZINC000189631454 941232079 /nfs/dbraw/zinc/23/20/79/941232079.db2.gz UZAKUJMLIOFMJG-ZDUSSCGKSA-N 0 0 362.382 3.709 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN(Cc1ccco1)C1CCCC1 ZINC000053139581 941247306 /nfs/dbraw/zinc/24/73/06/941247306.db2.gz HWGFYFCCEZNTKH-UHFFFAOYSA-N 0 0 373.409 3.580 20 5 FHBDRN CSCc1cccc(CNC(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)c1 ZINC000782914533 941257876 /nfs/dbraw/zinc/25/78/76/941257876.db2.gz ODIWCZKHCFDGGL-UHFFFAOYSA-N 0 0 366.389 3.866 20 5 FHBDRN O=C(NCC1(c2ccc(F)cc2)CC1)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000122237401 941282443 /nfs/dbraw/zinc/28/24/43/941282443.db2.gz SDQJQTOMWXNLKJ-UHFFFAOYSA-N 0 0 369.396 3.533 20 5 FHBDRN Cc1ccc(C)c(S(=O)(=O)N(C)[C@H]2CCc3ccccc32)c1[N+](=O)[O-] ZINC000189820415 941283867 /nfs/dbraw/zinc/28/38/67/941283867.db2.gz XDJSDBGVFRABOI-INIZCTEOSA-N 0 0 360.435 3.520 20 5 FHBDRN Cc1cc(C(=O)N2CC3(CCOCC3)c3ccccc32)ccc1[N+](=O)[O-] ZINC000189833551 941284419 /nfs/dbraw/zinc/28/44/19/941284419.db2.gz GOHCBYXGXOPWIX-UHFFFAOYSA-N 0 0 352.390 3.612 20 5 FHBDRN CCCN(c1cccc([N+](=O)[O-])c1)S(=O)(=O)c1cc(C)c(C)s1 ZINC001211645727 941285912 /nfs/dbraw/zinc/28/59/12/941285912.db2.gz BSDXWNODWWMNRU-UHFFFAOYSA-N 0 0 354.453 3.878 20 5 FHBDRN CCCN(c1cccc([N+](=O)[O-])c1)S(=O)(=O)c1cccc2ccoc21 ZINC001211645796 941286126 /nfs/dbraw/zinc/28/61/26/941286126.db2.gz DMPUXLJVEUUOKN-UHFFFAOYSA-N 0 0 360.391 3.946 20 5 FHBDRN Cc1c(CC(=O)N2CC3(CCOCC3)c3ccccc32)cccc1[N+](=O)[O-] ZINC000189841400 941287678 /nfs/dbraw/zinc/28/76/78/941287678.db2.gz HZQUACNFEIGLPE-UHFFFAOYSA-N 0 0 366.417 3.541 20 5 FHBDRN Cc1cccc(C(=O)N2CC3(CCOCC3)c3ccccc32)c1[N+](=O)[O-] ZINC000189855180 941290258 /nfs/dbraw/zinc/29/02/58/941290258.db2.gz AJLPNSKMKGNUGT-UHFFFAOYSA-N 0 0 352.390 3.612 20 5 FHBDRN COc1cc(CN(C)C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)ccc1O ZINC000178704727 941295306 /nfs/dbraw/zinc/29/53/06/941295306.db2.gz LFVOJKZZTKSJTN-UHFFFAOYSA-N 0 0 372.402 3.796 20 5 FHBDRN CC(C)c1ccc(C(=O)N[C@H](C[S@](C)=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000189918629 941303304 /nfs/dbraw/zinc/30/33/04/941303304.db2.gz FIVMKZZBMMCMRH-QUGAMOGWSA-N 0 0 374.462 3.568 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])Nc1ccc(Cl)cc1-n1cccn1 ZINC000189923072 941303945 /nfs/dbraw/zinc/30/39/45/941303945.db2.gz JQCINHCTUGOYKL-UHFFFAOYSA-N 0 0 371.784 3.756 20 5 FHBDRN Cc1ccc(C(=O)O[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1Cl ZINC000728673342 941306084 /nfs/dbraw/zinc/30/60/84/941306084.db2.gz MKCMFHQWUQYWGF-NSHDSACASA-N 0 0 362.769 3.741 20 5 FHBDRN CC(C)CN(C(C)C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000179025826 941334587 /nfs/dbraw/zinc/33/45/87/941334587.db2.gz VVMDDNAAWWVWPL-UHFFFAOYSA-N 0 0 368.377 3.669 20 5 FHBDRN COc1ccc(F)cc1[C@@H](C)NC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000122254305 941335898 /nfs/dbraw/zinc/33/58/98/941335898.db2.gz XXTPPPVRFDMSAT-GFCCVEGCSA-N 0 0 373.384 3.571 20 5 FHBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2CCC[C@H]2C1 ZINC000408006188 941342839 /nfs/dbraw/zinc/34/28/39/941342839.db2.gz WOAATBWOYBTLJI-QWRGUYRKSA-N 0 0 353.216 3.538 20 5 FHBDRN CCCCn1ncc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)c1C ZINC000122267412 941362149 /nfs/dbraw/zinc/36/21/49/941362149.db2.gz HANVNYJEBHXKBA-UHFFFAOYSA-N 0 0 371.441 3.752 20 5 FHBDRN CC(=O)Nc1ccc(NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)cc1C ZINC000892712650 941399900 /nfs/dbraw/zinc/39/99/00/941399900.db2.gz WCOKSUZXDFIUJT-UHFFFAOYSA-N 0 0 368.393 3.688 20 5 FHBDRN COc1ccc(C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)c(OCC2CC2)c1 ZINC000472647781 941408026 /nfs/dbraw/zinc/40/80/26/941408026.db2.gz GMMOMONYNYIEPM-UHFFFAOYSA-N 0 0 356.378 3.953 20 5 FHBDRN C[C@@H](C[N@H+](C)Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1)C(=O)[O-] ZINC000414658021 941429191 /nfs/dbraw/zinc/42/91/91/941429191.db2.gz PPTWLGDXOQOWMB-AWEZNQCLSA-N 0 0 357.410 3.515 20 5 FHBDRN C[C@@H]1c2ccc(Cl)n2CCN1C(=O)CCc1cc(F)ccc1[N+](=O)[O-] ZINC000936008850 941440303 /nfs/dbraw/zinc/44/03/03/941440303.db2.gz UGZXVUZVFGBCAU-LLVKDONJSA-N 0 0 365.792 3.725 20 5 FHBDRN CC(=O)c1ccc(C(=O)Nc2cc(C)nn2-c2ccc([N+](=O)[O-])cc2)cc1 ZINC000110190151 941446618 /nfs/dbraw/zinc/44/66/18/941446618.db2.gz DTVVQHWXADDRDA-UHFFFAOYSA-N 0 0 364.361 3.544 20 5 FHBDRN CC1(C)C[C@H](C(=O)N2CCc3cc([N+](=O)[O-])ccc32)c2ccccc2O1 ZINC000414740775 941455200 /nfs/dbraw/zinc/45/52/00/941455200.db2.gz KCEXWTZOFLNDLB-INIZCTEOSA-N 0 0 352.390 3.829 20 5 FHBDRN CCCN(C(=O)c1ccc([N+](=O)[O-])cc1F)[C@H]1C[C@@H](OCC)C1(C)C ZINC000564449468 941457016 /nfs/dbraw/zinc/45/70/16/941457016.db2.gz IDMGKMFLDPJOIS-JKSUJKDBSA-N 0 0 352.406 3.790 20 5 FHBDRN C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N1CC=C(c2cncc(F)c2)CC1 ZINC000376895638 941461389 /nfs/dbraw/zinc/46/13/89/941461389.db2.gz XLXCVFXCFNSCCT-GXDHUFHOSA-N 0 0 367.380 3.848 20 5 FHBDRN CCCCn1cc(C(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])c(C)n1 ZINC000472648556 941465544 /nfs/dbraw/zinc/46/55/44/941465544.db2.gz JBPXYPNGACAOBF-UHFFFAOYSA-N 0 0 364.833 3.526 20 5 FHBDRN O=C(c1cc(Cl)cc(Cl)c1[N+](=O)[O-])N1CC[C@@H](c2cccnc2)C1 ZINC000843635804 941471170 /nfs/dbraw/zinc/47/11/70/941471170.db2.gz GMZDOXDGSHCLHH-LLVKDONJSA-N 0 0 366.204 3.926 20 5 FHBDRN C/C=C\C[C@@H](CO)Nc1ccc(C(=O)Nc2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000472652110 941487190 /nfs/dbraw/zinc/48/71/90/941487190.db2.gz SIEXCLARLFONPO-LIMHQNJXSA-N 0 0 369.421 3.895 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)ccc1NCc1nnc(-c2ccncc2F)s1 ZINC000377086450 941511707 /nfs/dbraw/zinc/51/17/07/941511707.db2.gz LQOHYVSGFBKGMT-UHFFFAOYSA-N 0 0 365.777 3.913 20 5 FHBDRN CC[C@@H](NC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12)c1nc2ccccc2[nH]1 ZINC000066766490 941515654 /nfs/dbraw/zinc/51/56/54/941515654.db2.gz YVSQVXCPBPOYTH-CQSZACIVSA-N 0 0 363.377 3.834 20 5 FHBDRN COC(=O)c1cc(NC(=O)[C@@H]2CCC[C@@H](C(F)(F)F)C2)cc([N+](=O)[O-])c1 ZINC000136148134 941528443 /nfs/dbraw/zinc/52/84/43/941528443.db2.gz LHAKSKDKPULANL-MWLCHTKSSA-N 0 0 374.315 3.689 20 5 FHBDRN Cc1onc(-c2cccnc2)c1C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000377140657 941528537 /nfs/dbraw/zinc/52/85/37/941528537.db2.gz LTLKPSHSIHQAEY-UHFFFAOYSA-N 0 0 358.741 3.859 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(N[C@H](C)[C@H](OC)c2ccc(F)cc2)c1 ZINC000541113102 941537550 /nfs/dbraw/zinc/53/75/50/941537550.db2.gz HLBRGWBEIXCARA-DIFFPNOSSA-N 0 0 362.357 3.709 20 5 FHBDRN Cc1cc(C(=O)Nc2ccc(Cl)cc2-n2cccn2)ccc1[N+](=O)[O-] ZINC000472675814 941544594 /nfs/dbraw/zinc/54/45/94/941544594.db2.gz GAQMKVCQAGCAKU-UHFFFAOYSA-N 0 0 356.769 3.995 20 5 FHBDRN O=C(c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)N1CCC[C@H]1c1ccsc1 ZINC000040110523 941550910 /nfs/dbraw/zinc/55/09/10/941550910.db2.gz ZTLXOACAHIJQJR-HNNXBMFYSA-N 0 0 368.418 3.819 20 5 FHBDRN Cc1nc(C(F)(F)F)ccc1C(=O)OCCc1ccccc1[N+](=O)[O-] ZINC000178307926 941564368 /nfs/dbraw/zinc/56/43/68/941564368.db2.gz WBOAIWCJAFJBOS-UHFFFAOYSA-N 0 0 354.284 3.717 20 5 FHBDRN C[C@H](C1CCCCC1)N(C)C(=O)COc1ccc([N+](=O)[O-])c2cccnc12 ZINC000549166200 941573384 /nfs/dbraw/zinc/57/33/84/941573384.db2.gz RKMFEQYDGBINJC-CQSZACIVSA-N 0 0 371.437 3.949 20 5 FHBDRN Cc1ccc(C(C)(C)NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)cn1 ZINC000545358880 941591053 /nfs/dbraw/zinc/59/10/53/941591053.db2.gz QUFZYRAWZNZXLP-UHFFFAOYSA-N 0 0 354.410 3.538 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N(c2ccc(F)cc2)C(C)C)c1F ZINC000415095425 941599532 /nfs/dbraw/zinc/59/95/32/941599532.db2.gz ZMPCZMMDYGBMNF-UHFFFAOYSA-N 0 0 364.348 3.866 20 5 FHBDRN O=C(Nc1cccc(OCc2ccc(Cl)cc2)c1)c1c[nH]nc1[N+](=O)[O-] ZINC000549185574 941608146 /nfs/dbraw/zinc/60/81/46/941608146.db2.gz YEHCXGYVMZVLLW-UHFFFAOYSA-N 0 0 372.768 3.803 20 5 FHBDRN O=C(N[C@H](Cc1ccccc1Cl)c1ccccc1)c1c[nH]nc1[N+](=O)[O-] ZINC000549193717 941623018 /nfs/dbraw/zinc/62/30/18/941623018.db2.gz PWYSDCPFVFSOOS-MRXNPFEDSA-N 0 0 370.796 3.685 20 5 FHBDRN O=[N+]([O-])c1ccccc1OCCOc1ccccc1OCC(F)(F)F ZINC000541122899 941629080 /nfs/dbraw/zinc/62/90/80/941629080.db2.gz FJRJEFJSXAFRAD-UHFFFAOYSA-N 0 0 357.284 3.994 20 5 FHBDRN O=C(C1Cc2ccccc2C1)N1CCS[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000431840689 941644696 /nfs/dbraw/zinc/64/46/96/941644696.db2.gz BADXNHXSZSNBPD-IBGZPJMESA-N 0 0 354.431 3.584 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)c2ccc(OC)c(F)c2)c1 ZINC000549211204 941652753 /nfs/dbraw/zinc/65/27/53/941652753.db2.gz OOFHOMLPNVDQQL-LLVKDONJSA-N 0 0 362.357 3.632 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N(Cc2ccc(F)cc2)C2CC2)c1 ZINC000549213797 941655634 /nfs/dbraw/zinc/65/56/34/941655634.db2.gz NFPYCJMMSWQHNB-UHFFFAOYSA-N 0 0 358.369 3.937 20 5 FHBDRN CCCOc1cc(NC(=O)N2CCCCO2)c([N+](=O)[O-])cc1OCCC ZINC000549224402 941672826 /nfs/dbraw/zinc/67/28/26/941672826.db2.gz URDXAPDILMHVFQ-UHFFFAOYSA-N 0 0 367.402 3.732 20 5 FHBDRN COc1cc2c(cc1F)CC[C@H]2NC(=O)Nc1cc(F)cc([N+](=O)[O-])c1 ZINC000549230171 941684403 /nfs/dbraw/zinc/68/44/03/941684403.db2.gz KZPMVMWSXVQZTF-OAHLLOKOSA-N 0 0 363.320 3.691 20 5 FHBDRN O=C(Cn1ncc2ccc([N+](=O)[O-])cc21)OC[C@H]1CCCc2ccccc21 ZINC000729220480 941694714 /nfs/dbraw/zinc/69/47/14/941694714.db2.gz XBLIJLZFRQRUOU-MRXNPFEDSA-N 0 0 365.389 3.608 20 5 FHBDRN CCOc1cccc(CCNC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)c1 ZINC000433550412 941695983 /nfs/dbraw/zinc/69/59/83/941695983.db2.gz WXBXHPLBLGBGMY-UHFFFAOYSA-N 0 0 354.362 3.712 20 5 FHBDRN Cc1nc(C(C)C)ccc1Cn1cnc2c(Cl)cc([N+](=O)[O-])cc2c1=O ZINC000564953559 941710573 /nfs/dbraw/zinc/71/05/73/941710573.db2.gz ITROKKXNNVXKKK-UHFFFAOYSA-N 0 0 372.812 3.833 20 5 FHBDRN C[C@@H]1Oc2cc(F)ccc2[C@H]1NC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000377418173 941711494 /nfs/dbraw/zinc/71/14/94/941711494.db2.gz GQUMPLWLZUYBGJ-AYVTZFPOSA-N 0 0 350.733 3.639 20 5 FHBDRN Cc1cc(C(=O)N(C)Cc2cc([N+](=O)[O-])ccc2Cl)cc([N+](=O)[O-])c1 ZINC000122419746 941725287 /nfs/dbraw/zinc/72/52/87/941725287.db2.gz BQIKWMNLCCUTLE-UHFFFAOYSA-N 0 0 363.757 3.737 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1F)N1CCCC[C@@H]1c1nnc(C2CCC2)o1 ZINC000377445887 941725879 /nfs/dbraw/zinc/72/58/79/941725879.db2.gz CUTFTTHVICGUHG-OAHLLOKOSA-N 0 0 374.372 3.752 20 5 FHBDRN CC(=O)c1ccc(OCc2cccc(C(=O)NCC(C)C)c2)c([N+](=O)[O-])c1 ZINC000120661137 941726652 /nfs/dbraw/zinc/72/66/52/941726652.db2.gz LQTQHUVYYNJQAJ-UHFFFAOYSA-N 0 0 370.405 3.762 20 5 FHBDRN C[C@@H]1CCSCCN1C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000190064190 941726905 /nfs/dbraw/zinc/72/69/05/941726905.db2.gz YKHXBTHMCVUJCJ-SNVBAGLBSA-N 0 0 360.888 3.694 20 5 FHBDRN Cc1cccnc1NC(=O)C1CCN(c2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000377443165 941728156 /nfs/dbraw/zinc/72/81/56/941728156.db2.gz MDFCPMNMSKTSHN-UHFFFAOYSA-N 0 0 374.828 3.807 20 5 FHBDRN CCc1ccc(C(=O)N(C)[C@@H](C)[C@H]2Cc3ccccc3O2)cc1[N+](=O)[O-] ZINC000433555231 941737869 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FHBDRN O=C(Nc1cc(Br)ccc1NC1CC1)c1ccc([N+](=O)[O-])[nH]1 ZINC000469088734 941802658 /nfs/dbraw/zinc/80/26/58/941802658.db2.gz VUCMZZMAJRVPDX-UHFFFAOYSA-N 0 0 365.187 3.512 20 5 FHBDRN CO[C@H](C)CN(C)[C@H](C(=O)Nc1ccc(C)cc1[N+](=O)[O-])c1ccccc1 ZINC000513261802 941814755 /nfs/dbraw/zinc/81/47/55/941814755.db2.gz POCKKXRNSVBWOG-BEFAXECRSA-N 0 0 371.437 3.550 20 5 FHBDRN C[C@]1(CNC(=O)Nc2cccc([N+](=O)[O-])c2Cl)CC1(Cl)Cl ZINC000836600706 941816188 /nfs/dbraw/zinc/81/61/88/941816188.db2.gz YRECWGRAUDQGDR-LLVKDONJSA-N 0 0 352.605 3.954 20 5 FHBDRN C[C@H](NC(=O)Nc1ncc(C(F)(F)F)s1)c1cccc([N+](=O)[O-])c1 ZINC000549274655 941819767 /nfs/dbraw/zinc/81/97/67/941819767.db2.gz HTMJEIOQVWQCRG-ZETCQYMHSA-N 0 0 360.317 3.953 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCCc2cc[nH]c(=O)c21 ZINC000892974754 941825232 /nfs/dbraw/zinc/82/52/32/941825232.db2.gz PJUQLGBRFAHOLX-UHFFFAOYSA-N 0 0 373.434 3.791 20 5 FHBDRN Cc1cc(N2CCCC2)ccc1NC(=O)c1n[nH]c(C(C)C)c1[N+](=O)[O-] ZINC000433687243 941834100 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CCc1nc([C@H]2CCCN(c3ccc([N+](=O)[O-])c(OC(F)F)c3)C2)no1 ZINC000365609218 941846079 /nfs/dbraw/zinc/84/60/79/941846079.db2.gz CZCALUDCGORLCG-JTQLQIEISA-N 0 0 368.340 3.526 20 5 FHBDRN CC(=O)N1C[C@@H](C)CN(C(=O)c2cc(C)cc([N+](=O)[O-])c2)c2ccccc21 ZINC000365617596 941847639 /nfs/dbraw/zinc/84/76/39/941847639.db2.gz FUAWVZUUTSLDJK-CQSZACIVSA-N 0 0 367.405 3.553 20 5 FHBDRN C[C@@H](NC(=O)NC[C@@H]1CCO[C@H]1c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000190080526 941849633 /nfs/dbraw/zinc/84/96/33/941849633.db2.gz VOAJAINQTSZYKB-LJHODMEESA-N 0 0 369.421 3.733 20 5 FHBDRN CC(C)Oc1cc(C(=O)NC[C@@H]2CCCO[C@H]2C(C)C)ccc1[N+](=O)[O-] ZINC000412159518 941853502 /nfs/dbraw/zinc/85/35/02/941853502.db2.gz JFDWCZFPOVPROC-YJBOKZPZSA-N 0 0 364.442 3.563 20 5 FHBDRN CC(C)Oc1cc(C(=O)NC[C@H]2CCCO[C@@H]2C(C)C)ccc1[N+](=O)[O-] ZINC000412159508 941853582 /nfs/dbraw/zinc/85/35/82/941853582.db2.gz JFDWCZFPOVPROC-CRAIPNDOSA-N 0 0 364.442 3.563 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CC[C@@H]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000412162664 941857013 /nfs/dbraw/zinc/85/70/13/941857013.db2.gz KXOQDARQLJIKQO-QGZVFWFLSA-N 0 0 354.406 3.839 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N(C)C2CCC(C)(C)CC2)c1F ZINC000412164315 941857025 /nfs/dbraw/zinc/85/70/25/941857025.db2.gz DMOJNJAXIPVUOJ-UHFFFAOYSA-N 0 0 352.406 3.712 20 5 FHBDRN Cc1ccc(NC(=O)Cc2cc(Br)ccc2F)cc1[N+](=O)[O-] ZINC000433729549 941859690 /nfs/dbraw/zinc/85/96/90/941859690.db2.gz GZANMVURHZZSLO-UHFFFAOYSA-N 0 0 367.174 3.986 20 5 FHBDRN C[C@@H]1CN(C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)[C@H](c2ccccc2)CO1 ZINC000412178386 941860690 /nfs/dbraw/zinc/86/06/90/941860690.db2.gz WIEYJOFIFSPALI-YGBSJELFSA-N 0 0 366.417 3.687 20 5 FHBDRN Cc1cc(C(=O)CCC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)c(C)s1 ZINC000513349280 941860918 /nfs/dbraw/zinc/86/09/18/941860918.db2.gz VUTCZTGKGBJYPV-UHFFFAOYSA-N 0 0 374.462 3.937 20 5 FHBDRN Cc1nc(-c2c[nH]c(C(=O)N(C)CCc3cccc([N+](=O)[O-])c3)c2)cs1 ZINC000513349193 941860988 /nfs/dbraw/zinc/86/09/88/941860988.db2.gz 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O=C(NC1Cc2ccccc2C1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000545831778 941882471 /nfs/dbraw/zinc/88/24/71/941882471.db2.gz BRFWSLZPMIAYSR-UHFFFAOYSA-N 0 0 350.296 3.511 20 5 FHBDRN Cc1sc(S(=O)(=O)N(C)c2ccc(F)c(Cl)c2)cc1[N+](=O)[O-] ZINC000119422953 941884544 /nfs/dbraw/zinc/88/45/44/941884544.db2.gz OFKVVPNXQKWFID-UHFFFAOYSA-N 0 0 364.807 3.582 20 5 FHBDRN CCOc1ccc(NC(=O)CN(Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc1 ZINC000513386760 941884774 /nfs/dbraw/zinc/88/47/74/941884774.db2.gz PYMRKZWJHXABKB-UHFFFAOYSA-N 0 0 371.437 3.843 20 5 FHBDRN Cc1ccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2C)cc1OC(F)F ZINC000513394083 941888959 /nfs/dbraw/zinc/88/89/59/941888959.db2.gz FZTUKNXGJMOEDA-UHFFFAOYSA-N 0 0 372.349 3.614 20 5 FHBDRN Cc1c(C(=O)N[C@H]2CCC[C@H]2OCc2ccccc2)cccc1[N+](=O)[O-] ZINC000119638376 941891917 /nfs/dbraw/zinc/89/19/17/941891917.db2.gz BWKMBBMTAHGUNA-PKOBYXMFSA-N 0 0 354.406 3.771 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N2CCS[C@@H](C)[C@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000433774002 941891937 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358.781 3.602 20 5 FHBDRN Cc1cn([C@@H](C)c2ccccc2)[nH]c1=NC(=O)c1cc([N+](=O)[O-])ccc1C ZINC000472834476 941902401 /nfs/dbraw/zinc/90/24/01/941902401.db2.gz QBXWQLZCSZNSKJ-HNNXBMFYSA-N 0 0 364.405 3.692 20 5 FHBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)C1(c2ccccc2)CC(F)(F)C1 ZINC000365653069 941902427 /nfs/dbraw/zinc/90/24/27/941902427.db2.gz YWVPTVFCKJJJGI-UHFFFAOYSA-N 0 0 360.360 3.621 20 5 FHBDRN O=c1c(Cl)c(NC2CCC3(CC3)CC2)cnn1-c1ccc([N+](=O)[O-])cc1 ZINC000433819035 941917379 /nfs/dbraw/zinc/91/73/79/941917379.db2.gz IKQJNIYNYYOCQW-UHFFFAOYSA-N 0 0 374.828 3.929 20 5 FHBDRN CCCOc1ccc(CNC(=O)c2cc(OC)ccc2[N+](=O)[O-])c(C)c1 ZINC000190086973 941919579 /nfs/dbraw/zinc/91/95/79/941919579.db2.gz HGBUUTKIDCRJAM-UHFFFAOYSA-N 0 0 358.394 3.631 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CCc2c3ccccc3[nH]c2C1 ZINC000412212057 941920018 /nfs/dbraw/zinc/92/00/18/941920018.db2.gz CGESUCRCCQWGBJ-ZWKOTPCHSA-N 0 0 361.401 3.765 20 5 FHBDRN COc1cc(C(=O)Nc2cc(-c3cc(C)ccc3F)[nH]n2)ccc1[N+](=O)[O-] ZINC000190092242 941923344 /nfs/dbraw/zinc/92/33/44/941923344.db2.gz KXBLUUROBDFFNU-UHFFFAOYSA-N 0 0 370.340 3.693 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N[C@@H]1CCO[C@@H]1c1ccc(Cl)cc1 ZINC000182427190 941923396 /nfs/dbraw/zinc/92/33/96/941923396.db2.gz KXNYZMWNYJSKIF-IEBWSBKVSA-N 0 0 374.824 3.827 20 5 FHBDRN CC1(C)C[C@@H](C(=O)NCCc2cccc([N+](=O)[O-])c2)c2ccccc2O1 ZINC000412217843 941926006 /nfs/dbraw/zinc/92/60/06/941926006.db2.gz MAHLZOQKLKQPSP-QGZVFWFLSA-N 0 0 354.406 3.598 20 5 FHBDRN CC[C@H](NC(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000433830872 941927221 /nfs/dbraw/zinc/92/72/21/941927221.db2.gz KJKBROREGVBAOU-LBPRGKRZSA-N 0 0 350.806 3.976 20 5 FHBDRN C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1)c1ncon1 ZINC000182537646 941931386 /nfs/dbraw/zinc/93/13/86/941931386.db2.gz FMVDCBZPIZVQIG-NSHDSACASA-N 0 0 370.390 3.620 20 5 FHBDRN C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)N3C[C@@H]4[C@H](C3)C4(C)C)cc2[N+](=O)[O-])C1 ZINC000460653596 941931456 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CC(C)c1n[nH]c(C(=O)NCc2ccc(Cl)cc2Cl)c1[N+](=O)[O-] ZINC000433871898 941949521 /nfs/dbraw/zinc/94/95/21/941949521.db2.gz FWKHNFJRHHDBCX-UHFFFAOYSA-N 0 0 357.197 3.678 20 5 FHBDRN CC[C@H](O)CN(Cc1ccccc1)c1nc2ccccc2cc1[N+](=O)[O-] ZINC000473529732 941949889 /nfs/dbraw/zinc/94/98/89/941949889.db2.gz JGWPEDJGQLILCP-KRWDZBQOSA-N 0 0 351.406 3.921 20 5 FHBDRN C[C@@H]1CCc2onc(C(=O)N3CCS[C@H]3c3ccc([N+](=O)[O-])cc3)c2C1 ZINC000433865106 941953366 /nfs/dbraw/zinc/95/33/66/941953366.db2.gz NQIFJZBJSQJDLK-ZMZPIMSZSA-N 0 0 373.434 3.595 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N(C)[C@H](C)c2nc3ccccc3s2)c1[N+](=O)[O-] ZINC000433869183 941956590 /nfs/dbraw/zinc/95/65/90/941956590.db2.gz QLZASXJOGJCAHR-SNVBAGLBSA-N 0 0 373.438 3.884 20 5 FHBDRN Cn1nc(C2CCCC2)cc1NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412247134 941957502 /nfs/dbraw/zinc/95/75/02/941957502.db2.gz PXWWKWGGNOYWSW-JKSUJKDBSA-N 0 0 354.410 3.728 20 5 FHBDRN CC(C)c1nccn1CC(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000182824028 941973770 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3.885 20 5 FHBDRN CC(C)Oc1cc(C(=O)Nc2cnn([C@@H](C)C3CC3)c2)ccc1[N+](=O)[O-] ZINC000412260157 941997122 /nfs/dbraw/zinc/99/71/22/941997122.db2.gz MULRQRAXDNIJPX-LBPRGKRZSA-N 0 0 358.398 3.802 20 5 FHBDRN COc1ccccc1CN(C)C(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000549336887 941999603 /nfs/dbraw/zinc/99/96/03/941999603.db2.gz NKTIFVWFCAOLJE-UHFFFAOYSA-N 0 0 368.311 3.894 20 5 FHBDRN O=c1c2ccsc2ccn1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000182926034 941999733 /nfs/dbraw/zinc/99/97/33/941999733.db2.gz ALPKPVPZZFANDB-UHFFFAOYSA-N 0 0 353.359 3.675 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)NCC2(c3ccc(Cl)cc3)CC2)c1[N+](=O)[O-] ZINC000433936819 942011542 /nfs/dbraw/zinc/01/15/42/942011542.db2.gz NIPLNCOJULZNOO-UHFFFAOYSA-N 0 0 362.817 3.556 20 5 FHBDRN CCN(Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)Cc1c(F)cccc1F ZINC000101732577 942011901 /nfs/dbraw/zinc/01/19/01/942011901.db2.gz PYRTXUVATXZYMI-UHFFFAOYSA-N 0 0 374.347 3.945 20 5 FHBDRN Cc1cc(C2CC2)nc(NC(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)n1 ZINC000415709819 942013533 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361.785 3.591 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N[C@H](C)CCCC(F)(F)F)c1F ZINC000412279739 942020705 /nfs/dbraw/zinc/02/07/05/942020705.db2.gz BNBKXNIBWHZXFY-SECBINFHSA-N 0 0 366.311 3.522 20 5 FHBDRN CC(C)c1[nH]nc(C(=O)Nc2cc(CC3CCCCC3)[nH]n2)c1[N+](=O)[O-] ZINC000433981859 942023167 /nfs/dbraw/zinc/02/31/67/942023167.db2.gz UBTXGRCCYALYGO-UHFFFAOYSA-N 0 0 360.418 3.540 20 5 FHBDRN Cc1ccc(C(=O)N(C)C)cc1NC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000110219913 942025226 /nfs/dbraw/zinc/02/52/26/942025226.db2.gz ARMPHXRULRGVKK-UHFFFAOYSA-N 0 0 361.785 3.511 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N[C@H](C2CCCCC2)C(F)(F)F)c1[N+](=O)[O-] ZINC000434013176 942039687 /nfs/dbraw/zinc/03/96/87/942039687.db2.gz RWNLXBUMTZWULV-CYBMUJFWSA-N 0 0 362.352 3.682 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1Cl)N1CCC([C@@H]2CCCOC2)CC1 ZINC000377873179 942044983 /nfs/dbraw/zinc/04/49/83/942044983.db2.gz IEVWNCCGGNZKCG-CYBMUJFWSA-N 0 0 367.833 3.919 20 5 FHBDRN CN(Cc1cc(Cl)ccc1F)C(=O)Cc1ccc([N+](=O)[O-])cc1F ZINC000434008047 942045548 /nfs/dbraw/zinc/04/55/48/942045548.db2.gz YJAGSPQEQQAZSW-UHFFFAOYSA-N 0 0 354.740 3.728 20 5 FHBDRN COc1ccccc1[C@H](CC(C)C)NC(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-] ZINC000434028696 942046226 /nfs/dbraw/zinc/04/62/26/942046226.db2.gz WTKGWFDGGVQMIW-AWEZNQCLSA-N 0 0 374.441 3.967 20 5 FHBDRN Cc1ccc2c(c1)CN(C(=O)COc1cccc([N+](=O)[O-])c1)C(C)(C)C2 ZINC000513635349 942048187 /nfs/dbraw/zinc/04/81/87/942048187.db2.gz MHPRHGHJEGHBRW-UHFFFAOYSA-N 0 0 354.406 3.646 20 5 FHBDRN COc1cccc(-c2noc(-c3ccc(OC(F)F)c([N+](=O)[O-])c3)n2)c1 ZINC000513650366 942055412 /nfs/dbraw/zinc/05/54/12/942055412.db2.gz MNJKBAUTXHXPJH-UHFFFAOYSA-N 0 0 363.276 3.922 20 5 FHBDRN Cn1ccnc1[C@H](NCc1ccc(Cl)s1)c1ccc([N+](=O)[O-])cc1 ZINC000513655341 942058016 /nfs/dbraw/zinc/05/80/16/942058016.db2.gz LWHRLSBIDFPYIW-OAHLLOKOSA-N 0 0 362.842 3.922 20 5 FHBDRN O=[N+]([O-])c1ccc(N[C@@H](CO)c2ccccc2OC(F)(F)F)c(F)c1 ZINC000480836440 942065186 /nfs/dbraw/zinc/06/51/86/942065186.db2.gz HAQFZTDVDUPWOY-ZDUSSCGKSA-N 0 0 360.263 3.778 20 5 FHBDRN COCCN(C(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1)[C@@H]1CC[C@H](C)C1 ZINC000412286699 942065686 /nfs/dbraw/zinc/06/56/86/942065686.db2.gz HUIWCIDSFXAHER-GOEBONIOSA-N 0 0 364.442 3.659 20 5 FHBDRN COC[C@@H](NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)c1ccc(Cl)cc1 ZINC000412287393 942066131 /nfs/dbraw/zinc/06/61/31/942066131.db2.gz KAIRRLVYHFXKLI-RCCFBDPRSA-N 0 0 374.824 3.856 20 5 FHBDRN O=C(Nc1ccc(CCO)cc1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000102499130 942066156 /nfs/dbraw/zinc/06/61/56/942066156.db2.gz XUUPYHDEOXXSJR-UHFFFAOYSA-N 0 0 369.402 3.505 20 5 FHBDRN C[C@@H](CCOCc1ccccc1)NC(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000513674265 942067772 /nfs/dbraw/zinc/06/77/72/942067772.db2.gz DUUDKHCBSWOHAS-INIZCTEOSA-N 0 0 371.437 3.732 20 5 FHBDRN C[C@@H](c1ccc(F)c(F)c1)N(C)C(=O)COc1ccc(F)cc1[N+](=O)[O-] ZINC000102599613 942072124 /nfs/dbraw/zinc/07/21/24/942072124.db2.gz FJBMONBUUMCTLI-JTQLQIEISA-N 0 0 368.311 3.611 20 5 FHBDRN C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1ccc(OC2CCCC2)nc1 ZINC000513681014 942073715 /nfs/dbraw/zinc/07/37/15/942073715.db2.gz WNQZVDYKHMSCMZ-ZDUSSCGKSA-N 0 0 367.405 3.903 20 5 FHBDRN CC(C)[C@H]1C[C@@H](CC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)CCO1 ZINC000513680738 942074097 /nfs/dbraw/zinc/07/40/97/942074097.db2.gz SFJIAAPJDILQMW-XHDPSFHLSA-N 0 0 372.368 3.976 20 5 FHBDRN Cc1cccc(O)c1NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000183067835 942074134 /nfs/dbraw/zinc/07/41/34/942074134.db2.gz JVPWGOCYHLPICS-UHFFFAOYSA-N 0 0 355.375 3.985 20 5 FHBDRN C[C@H](c1ccccc1)[C@H](C)NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000473533564 942076201 /nfs/dbraw/zinc/07/62/01/942076201.db2.gz SYIDHNPEGZRJRX-GJZGRUSLSA-N 0 0 364.405 3.703 20 5 FHBDRN Cc1ccccc1-c1nc(CNc2nc3ccccc3cc2[N+](=O)[O-])no1 ZINC000473533445 942076902 /nfs/dbraw/zinc/07/69/02/942076902.db2.gz ODGJRUOKIZQIOL-UHFFFAOYSA-N 0 0 361.361 3.535 20 5 FHBDRN CCO[C@@H](CNC(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1)c1ccccc1 ZINC000412294306 942077560 /nfs/dbraw/zinc/07/75/60/942077560.db2.gz RAOFONQVAZUAKE-IBGZPJMESA-N 0 0 372.421 3.890 20 5 FHBDRN CON1CCC(c2noc([C@H](C)Sc3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000420517073 942078061 /nfs/dbraw/zinc/07/80/61/942078061.db2.gz NLBDXDSNGAVJDH-NSHDSACASA-N 0 0 364.427 3.572 20 5 FHBDRN CC(C)Oc1cc(C(=O)N[C@H]2CCCc3c(O)cccc32)ccc1[N+](=O)[O-] ZINC000412296693 942080227 /nfs/dbraw/zinc/08/02/27/942080227.db2.gz ZMZHCFHZBYPVCD-INIZCTEOSA-N 0 0 370.405 3.895 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CC[C@H](C(F)(F)F)[C@H]2C)ccc1[N+](=O)[O-] ZINC000412297262 942080660 /nfs/dbraw/zinc/08/06/60/942080660.db2.gz HQCOPOUHBNCFAY-PWSUYJOCSA-N 0 0 360.332 3.795 20 5 FHBDRN COc1cccc(C(C)(C)CNC(=O)c2cc(F)c([N+](=O)[O-])cc2F)c1 ZINC000122706844 942080752 /nfs/dbraw/zinc/08/07/52/942080752.db2.gz SRJJSAIBZGBZBE-UHFFFAOYSA-N 0 0 364.348 3.589 20 5 FHBDRN CC(=O)N1CCN(c2nc3ccccc3cc2[N+](=O)[O-])CC12CCCCC2 ZINC000473534101 942082561 /nfs/dbraw/zinc/08/25/61/942082561.db2.gz UQYGCLQNUQVSSI-UHFFFAOYSA-N 0 0 368.437 3.514 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CN[C@@H](C)c1ccc(Br)cn1 ZINC000280038723 942092712 /nfs/dbraw/zinc/09/27/12/942092712.db2.gz ISXNCZJQZOGSLA-JTQLQIEISA-N 0 0 366.215 3.612 20 5 FHBDRN O=C(Cc1cc(F)c(Cl)cc1[N+](=O)[O-])N[C@@H]1CCOC2(CCCC2)C1 ZINC000280060530 942095040 /nfs/dbraw/zinc/09/50/40/942095040.db2.gz GVSVXEGBRDQKAQ-GFCCVEGCSA-N 0 0 370.808 3.538 20 5 FHBDRN C[C@@H](CSc1ccc([N+](=O)[O-])c(S(C)(=O)=O)c1)c1ccccc1 ZINC000183333565 942098270 /nfs/dbraw/zinc/09/82/70/942098270.db2.gz ZDBWDYSUBWKDMN-LBPRGKRZSA-N 0 0 351.449 3.894 20 5 FHBDRN Cc1ccn(-c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3Cl)cc2)n1 ZINC000501883699 942102211 /nfs/dbraw/zinc/10/22/11/942102211.db2.gz CXEQBEQDAFHGSU-UHFFFAOYSA-N 0 0 356.769 3.995 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(-n2ccc(C)n2)cc1 ZINC000501885115 942102861 /nfs/dbraw/zinc/10/28/61/942102861.db2.gz HLPOAKWNYAUKJK-UHFFFAOYSA-N 0 0 366.377 3.740 20 5 FHBDRN CCn1ccnc1[C@@H]1CCCCN1C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412309354 942111947 /nfs/dbraw/zinc/11/19/47/942111947.db2.gz KXBIFKKRHGLYPU-KSZLIROESA-N 0 0 368.437 3.669 20 5 FHBDRN O=C(Nc1ccncc1F)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 ZINC000122732279 942117526 /nfs/dbraw/zinc/11/75/26/942117526.db2.gz CSDNXARXCPEGSX-UHFFFAOYSA-N 0 0 366.352 3.993 20 5 FHBDRN CCC(CC)[C@@H]1C[C@@H](NC(=O)c2ccc([N+](=O)[O-])c3cccnc23)CCO1 ZINC000183357503 942118005 /nfs/dbraw/zinc/11/80/05/942118005.db2.gz IWAVJNXYEAFFSI-KSSFIOAISA-N 0 0 371.437 3.857 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1OC(=O)c1cccc(NC(=O)[C@H]2C[C@@H]2C)c1 ZINC000760015699 942119526 /nfs/dbraw/zinc/11/95/26/942119526.db2.gz HFTVVQIRBZQXRK-WFASDCNBSA-N 0 0 354.362 3.717 20 5 FHBDRN NC(=O)c1cccc([N+](=O)[O-])c1N1CCC[C@H](c2ccc(F)cc2)CC1 ZINC000420615197 942133378 /nfs/dbraw/zinc/13/33/78/942133378.db2.gz PLBVVKAHAQSJHH-ZDUSSCGKSA-N 0 0 357.385 3.607 20 5 FHBDRN O=C(c1cc(N2CC[C@H](C3CCCC3)C2)ccc1[N+](=O)[O-])N1CCCC1 ZINC000420620056 942133997 /nfs/dbraw/zinc/13/39/97/942133997.db2.gz QBQXXYHNXGOMRR-INIZCTEOSA-N 0 0 357.454 3.847 20 5 FHBDRN O=C(NCc1ccccc1N1CCCCC1)c1ccc([N+](=O)[O-])cc1F ZINC000183123509 942136985 /nfs/dbraw/zinc/13/69/85/942136985.db2.gz IPICSXRVJCSLND-UHFFFAOYSA-N 0 0 357.385 3.654 20 5 FHBDRN COc1ccc(F)cc1[C@@H](C)NC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000110226825 942139278 /nfs/dbraw/zinc/13/92/78/942139278.db2.gz YCRURHGCMGFWDP-SECBINFHSA-N 0 0 352.749 3.887 20 5 FHBDRN CO[C@@](C)([C@@H](C)NC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-])C1CC1 ZINC000415914760 942139387 /nfs/dbraw/zinc/13/93/87/942139387.db2.gz BSVHCLJOSSGVLX-PSLIRLAXSA-N 0 0 360.332 3.547 20 5 FHBDRN CC(C)NC(=O)c1ccc(N[C@@H](C)c2nc3c(s2)CCC3)c([N+](=O)[O-])c1 ZINC000413397766 942143825 /nfs/dbraw/zinc/14/38/25/942143825.db2.gz QRLAJAAMKPZANQ-NSHDSACASA-N 0 0 374.466 3.851 20 5 FHBDRN O=C(NCCCc1c[nH]c2ccc(F)cc12)c1cc(F)cc([N+](=O)[O-])c1 ZINC000501972664 942146264 /nfs/dbraw/zinc/14/62/64/942146264.db2.gz CCNUBWIVHLWCTG-UHFFFAOYSA-N 0 0 359.332 3.717 20 5 FHBDRN CC(C)(C)[C@@H]1C[C@H](NC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])CCO1 ZINC000280272094 942147649 /nfs/dbraw/zinc/14/76/49/942147649.db2.gz VCKZDBIGKFNZKZ-ABAIWWIYSA-N 0 0 372.824 3.640 20 5 FHBDRN C[C@@H](CN(C)C(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-])c1nccs1 ZINC000280286412 942150994 /nfs/dbraw/zinc/15/09/94/942150994.db2.gz WAABOUXZBLBJDD-VIFPVBQESA-N 0 0 371.821 3.648 20 5 FHBDRN CO[C@@H]1CCC[C@@H](CC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000280298546 942154804 /nfs/dbraw/zinc/15/48/04/942154804.db2.gz NXBKKKXCQWOBGC-ZYHUDNBSSA-N 0 0 358.341 3.730 20 5 FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC(C)=C(C)C1 ZINC000280300981 942155020 /nfs/dbraw/zinc/15/50/20/942155020.db2.gz VVGQUJVRNHUADN-UHFFFAOYSA-N 0 0 350.440 3.516 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)NCC1(c2ccncc2)CCCC1 ZINC000501995390 942160264 /nfs/dbraw/zinc/16/02/64/942160264.db2.gz CGVKSMRJHOTKDO-UHFFFAOYSA-N 0 0 371.462 3.710 20 5 FHBDRN CC1(C)CCN(S(=O)(=O)c2c(Cl)cc(Cl)cc2[N+](=O)[O-])CC1 ZINC000502006787 942165621 /nfs/dbraw/zinc/16/56/21/942165621.db2.gz UTMJDCILELGDOW-UHFFFAOYSA-N 0 0 367.254 3.712 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)N(C)[C@H]2CCCC[C@@H]2C)cc1SC ZINC000102984889 942166556 /nfs/dbraw/zinc/16/65/56/942166556.db2.gz INIJSZJSNPBFQH-AAEUAGOBSA-N 0 0 352.456 3.976 20 5 FHBDRN Cc1cc(N[C@H]2c3sccc3OC(C)(C)[C@@H]2O)c(F)cc1[N+](=O)[O-] ZINC000413424038 942168331 /nfs/dbraw/zinc/16/83/31/942168331.db2.gz OYDXCESXJCFJJX-DZGCQCFKSA-N 0 0 352.387 3.789 20 5 FHBDRN C[C@H](Cc1ccccc1C(F)(F)F)NC(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000183141624 942168829 /nfs/dbraw/zinc/16/88/29/942168829.db2.gz FEUIUGSHPZYUFY-SNVBAGLBSA-N 0 0 367.327 3.557 20 5 FHBDRN Cc1cc(S(=O)(=O)N[C@H](CC(F)F)c2ccccc2)ccc1[N+](=O)[O-] ZINC000420741228 942179711 /nfs/dbraw/zinc/17/97/11/942179711.db2.gz SQJYPJQJLSXADV-CQSZACIVSA-N 0 0 370.377 3.578 20 5 FHBDRN Cc1nc2c(s1)[C@H](N(C)C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)CCC2 ZINC000413438808 942186852 /nfs/dbraw/zinc/18/68/52/942186852.db2.gz QDOHUDFWROQRKC-ZMSDIMECSA-N 0 0 371.462 3.999 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1C(=O)NC[C@@H]1CCO[C@H]1c1ccc(F)cc1 ZINC000502056717 942189504 /nfs/dbraw/zinc/18/95/04/942189504.db2.gz KYEYFDFZWHSENO-KSSFIOAISA-N 0 0 358.369 3.550 20 5 FHBDRN CCn1cc(C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c(C(F)(F)F)n1 ZINC000280521899 942196314 /nfs/dbraw/zinc/19/63/14/942196314.db2.gz BDTFCCZLINOKRJ-JTQLQIEISA-N 0 0 370.331 3.629 20 5 FHBDRN Cc1nc2ccccn2c1COc1c(Br)cccc1[N+](=O)[O-] ZINC000122760817 942199605 /nfs/dbraw/zinc/19/96/05/942199605.db2.gz POHVRZOYPHNGDQ-UHFFFAOYSA-N 0 0 362.183 3.892 20 5 FHBDRN O=C(NC1(c2cccc(F)c2)CC1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000183014962 942201716 /nfs/dbraw/zinc/20/17/16/942201716.db2.gz ABQIEHYCMFQUFB-UHFFFAOYSA-N 0 0 366.295 3.754 20 5 FHBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)N[C@H](CC(F)F)c1ccccc1 ZINC000420825779 942214244 /nfs/dbraw/zinc/21/42/44/942214244.db2.gz ZQZMQCGHTAMENH-MRXNPFEDSA-N 0 0 363.364 3.833 20 5 FHBDRN Cc1cc(NCc2ccnc(-n3ccnc3)c2)c2cccc([N+](=O)[O-])c2n1 ZINC000378055119 942221168 /nfs/dbraw/zinc/22/11/68/942221168.db2.gz ONHYTOCPKTUYFM-UHFFFAOYSA-N 0 0 360.377 3.644 20 5 FHBDRN CC(C)CCC[C@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1SCCO ZINC000136279291 942221832 /nfs/dbraw/zinc/22/18/32/942221832.db2.gz SMNWFMRXJBCBDY-ZDUSSCGKSA-N 0 0 354.472 3.624 20 5 FHBDRN CC(C)(C)O[C@@H](C(=O)NCCNc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000513701649 942229142 /nfs/dbraw/zinc/22/91/42/942229142.db2.gz XSRSCZUSUVJZMK-GOSISDBHSA-N 0 0 371.437 3.679 20 5 FHBDRN Cc1ccc(NC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)cc1C(=O)N(C)C ZINC000187852228 942231131 /nfs/dbraw/zinc/23/11/31/942231131.db2.gz GZQHJYGTSLJCRY-UHFFFAOYSA-N 0 0 369.421 3.981 20 5 FHBDRN CCn1cc(OC(=O)c2ccc(N3C[C@H](C)C[C@@H](C)C3)c([N+](=O)[O-])c2)cn1 ZINC001269054910 942232040 /nfs/dbraw/zinc/23/20/40/942232040.db2.gz IOILWQYYCYBTHO-ZIAGYGMSSA-N 0 0 372.425 3.513 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N[C@H](C)c1cc(C)cc(C)c1 ZINC000502127262 942235806 /nfs/dbraw/zinc/23/58/06/942235806.db2.gz NECVVIFUYCBNBA-CQSZACIVSA-N 0 0 357.410 3.781 20 5 FHBDRN CC(C)NC(=O)c1ccc(N2CCSC3(CCC3)CC2)c([N+](=O)[O-])c1 ZINC000413481682 942236835 /nfs/dbraw/zinc/23/68/35/942236835.db2.gz MSNQERFMDXEQJO-UHFFFAOYSA-N 0 0 363.483 3.599 20 5 FHBDRN CC(=O)c1cccc(NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)c1 ZINC000513731209 942238562 /nfs/dbraw/zinc/23/85/62/942238562.db2.gz SUWGHUHQAMDYEO-UHFFFAOYSA-N 0 0 350.277 3.651 20 5 FHBDRN COc1ccc(CSCC(=O)N2[C@H](C)CCC[C@H]2C)cc1[N+](=O)[O-] ZINC000103367142 942246767 /nfs/dbraw/zinc/24/67/67/942246767.db2.gz HWMZWHNCIYVAIH-CHWSQXEVSA-N 0 0 352.456 3.626 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)OCCOc2ccc(F)cc2)c1 ZINC000016196413 942248263 /nfs/dbraw/zinc/24/82/63/942248263.db2.gz AJBWUAOXSZOCNP-UHFFFAOYSA-N 0 0 351.355 3.692 20 5 FHBDRN C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1cnc(-c2ccccc2)nc1 ZINC000103374750 942248215 /nfs/dbraw/zinc/24/82/15/942248215.db2.gz KHWSOTYRALGAGY-ZDUSSCGKSA-N 0 0 360.373 3.643 20 5 FHBDRN C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1ccn(-c2cccc(F)c2)n1 ZINC000103374846 942248991 /nfs/dbraw/zinc/24/89/91/942248991.db2.gz MZAAWNQZVYGXOJ-LBPRGKRZSA-N 0 0 366.352 3.511 20 5 FHBDRN COc1cccc(SCC(=O)N2c3ccc([N+](=O)[O-])cc3C[C@H]2C)c1 ZINC000103375706 942249000 /nfs/dbraw/zinc/24/90/00/942249000.db2.gz VITBMQKJYGHZHO-GFCCVEGCSA-N 0 0 358.419 3.673 20 5 FHBDRN Cc1cc(C(=O)N2c3ccc([N+](=O)[O-])cc3C[C@@H]2C)nn1-c1ccccc1 ZINC000103375727 942249017 /nfs/dbraw/zinc/24/90/17/942249017.db2.gz FSVOQYBOESLPMS-ZDUSSCGKSA-N 0 0 362.389 3.680 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N(C(C)C)C2CCCC2)cc1OC ZINC000103371678 942249626 /nfs/dbraw/zinc/24/96/26/942249626.db2.gz WQOXSLHXPDFWQD-UHFFFAOYSA-N 0 0 350.415 3.795 20 5 FHBDRN CO[C@@H](CSCCCn1c(=O)oc2ccc([N+](=O)[O-])cc21)CC(C)C ZINC000419417909 942252187 /nfs/dbraw/zinc/25/21/87/942252187.db2.gz XTEIBXGBCLYBTK-CQSZACIVSA-N 0 0 368.455 3.687 20 5 FHBDRN O=[N+]([O-])c1ccc2c(ccn2Cc2nc(COc3ccccc3)no2)c1 ZINC000518323502 942255739 /nfs/dbraw/zinc/25/57/39/942255739.db2.gz VWCBVGOIYNMYOX-UHFFFAOYSA-N 0 0 350.334 3.560 20 5 FHBDRN Cn1c(=O)c([N+](=O)[O-])c(N2CCC[C@@H](CC(F)(F)F)C2)c2ccccc21 ZINC000894243058 942258708 /nfs/dbraw/zinc/25/87/08/942258708.db2.gz CLSZNWIYENKNMS-NSHDSACASA-N 0 0 369.343 3.616 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N(C)[C@@H]1CCCC[C@@H]1c1ccccc1 ZINC000416008681 942258763 /nfs/dbraw/zinc/25/87/63/942258763.db2.gz MPKAYSHIHUOPMY-QZTJIDSGSA-N 0 0 370.453 3.675 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1N1C[C@H](O)C[C@H]1c1ccccc1 ZINC000413498643 942258946 /nfs/dbraw/zinc/25/89/46/942258946.db2.gz HMPYAHQFBKBSGF-HIFRSBDPSA-N 0 0 363.211 3.670 20 5 FHBDRN CCCCNC(=O)[C@H]1CC[C@H](C)N(c2ccc([N+](=O)[O-])c3ncccc23)C1 ZINC000413073587 942259718 /nfs/dbraw/zinc/25/97/18/942259718.db2.gz OOZCSTRYQQJVBU-GJZGRUSLSA-N 0 0 370.453 3.664 20 5 FHBDRN O=[N+]([O-])c1ccc2ccnc(Sc3nnc(N4CCCC4)s3)c2c1 ZINC000413072684 942259768 /nfs/dbraw/zinc/25/97/68/942259768.db2.gz NCNWXJDMTHTXKN-UHFFFAOYSA-N 0 0 359.436 3.746 20 5 FHBDRN COc1cc(F)cc2sc(NC(=O)c3ccc([N+](=O)[O-])cc3F)nc21 ZINC000103422648 942262422 /nfs/dbraw/zinc/26/24/22/942262422.db2.gz RLWKPLJTYNPKLN-UHFFFAOYSA-N 0 0 365.317 3.744 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)NCC1(c2ccccc2Cl)CC1 ZINC000481001460 942269522 /nfs/dbraw/zinc/26/95/22/942269522.db2.gz NJCWMHPRSIVDSA-UHFFFAOYSA-N 0 0 360.797 3.718 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)C1(OC)CCC1 ZINC000416021525 942274065 /nfs/dbraw/zinc/27/40/65/942274065.db2.gz DLPAPMKFYKEANY-LBPRGKRZSA-N 0 0 352.456 3.784 20 5 FHBDRN Cc1ccc2c(c1)CCN(C(=O)CCCNc1ccc([N+](=O)[O-])cc1)C2 ZINC000481010012 942275263 /nfs/dbraw/zinc/27/52/63/942275263.db2.gz GYFCWTSETHJDLV-UHFFFAOYSA-N 0 0 353.422 3.680 20 5 FHBDRN CCOC(=O)c1csc(CSCCOc2ccc([N+](=O)[O-])cc2)n1 ZINC000419483349 942276419 /nfs/dbraw/zinc/27/64/19/942276419.db2.gz VCXJWOHIRAIBLQ-UHFFFAOYSA-N 0 0 368.436 3.540 20 5 FHBDRN CS(=O)(=O)CC1(CSCc2c(Cl)cccc2[N+](=O)[O-])CCC1 ZINC000162309739 942276765 /nfs/dbraw/zinc/27/67/65/942276765.db2.gz SODWOQQTAXGMLJ-UHFFFAOYSA-N 0 0 363.888 3.696 20 5 FHBDRN O=[N+]([O-])c1cc(CN2CCC[C@@H](CC(F)(F)F)C2)c2c(c1)COCO2 ZINC000420941511 942279573 /nfs/dbraw/zinc/27/95/73/942279573.db2.gz FSSISQUOFOYXHJ-NSHDSACASA-N 0 0 360.332 3.626 20 5 FHBDRN C[C@H]1C[C@@H](Nc2cc(C(F)(F)C(F)(F)F)ncc2[N+](=O)[O-])CS1 ZINC000413506371 942280578 /nfs/dbraw/zinc/28/05/78/942280578.db2.gz AZZJNDUWUQIUOW-NKWVEPMBSA-N 0 0 357.304 3.950 20 5 FHBDRN O=C(c1ccc(OC(F)F)c([N+](=O)[O-])c1)N1CCCc2ccccc2C1 ZINC000513735049 942283263 /nfs/dbraw/zinc/28/32/63/942283263.db2.gz IUXAZNURXYIKIY-UHFFFAOYSA-N 0 0 362.332 3.785 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N[C@H](c2cccs2)C2CC2)c1F ZINC000413094017 942284088 /nfs/dbraw/zinc/28/40/88/942284088.db2.gz KDQRLWUNALGTMX-KRWDZBQOSA-N 0 0 364.398 3.614 20 5 FHBDRN COC(=O)[C@H](C)c1cccc(Nc2cc(OC)c(OC)cc2[N+](=O)[O-])c1 ZINC000413511334 942284874 /nfs/dbraw/zinc/28/48/74/942284874.db2.gz WCHZNXMJUWISFZ-LLVKDONJSA-N 0 0 360.366 3.632 20 5 FHBDRN CCn1cc([C@@H]2OCC[C@H]2CNc2nccc3c2cccc3[N+](=O)[O-])cn1 ZINC000413504534 942288957 /nfs/dbraw/zinc/28/89/57/942288957.db2.gz AUTDWQPQOWGUFF-SCLBCKFNSA-N 0 0 367.409 3.549 20 5 FHBDRN CNc1ccc(C(=O)N2CCC[C@H]2c2ccc(OC)cc2)cc1[N+](=O)[O-] ZINC000015626637 942289586 /nfs/dbraw/zinc/28/95/86/942289586.db2.gz GTMYGQDMGRQNJE-KRWDZBQOSA-N 0 0 355.394 3.622 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2C[C@H](C)Oc3cc(F)ccc32)ccc1[N+](=O)[O-] ZINC000413513746 942289901 /nfs/dbraw/zinc/28/99/01/942289901.db2.gz IPSKWKJTPPVGOZ-LBPRGKRZSA-N 0 0 374.368 3.949 20 5 FHBDRN Cc1ccccc1-n1ccnc1SCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000024525461 942291992 /nfs/dbraw/zinc/29/19/92/942291992.db2.gz QZKAKLCPPZWZKB-UHFFFAOYSA-N 0 0 368.418 3.820 20 5 FHBDRN C[C@H]1CCN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)C[C@@H](C)C1 ZINC000502217214 942295600 /nfs/dbraw/zinc/29/56/00/942295600.db2.gz CPOOSSJJWPWBSQ-QWRGUYRKSA-N 0 0 355.232 3.866 20 5 FHBDRN Cc1c(CSCc2cccc(S(C)(=O)=O)c2)cccc1[N+](=O)[O-] ZINC000419517953 942297511 /nfs/dbraw/zinc/29/75/11/942297511.db2.gz MZLNDQPCLZIOSY-UHFFFAOYSA-N 0 0 351.449 3.740 20 5 FHBDRN CC[C@H](CNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-])CC(F)(F)F ZINC000413522075 942308825 /nfs/dbraw/zinc/30/88/25/942308825.db2.gz PKQHAJBWKWANQC-JTQLQIEISA-N 0 0 359.348 3.878 20 5 FHBDRN CCOc1cc(Cl)ccc1CNC(=O)c1ccc([N+](=O)[O-])cc1F ZINC000501126763 942313221 /nfs/dbraw/zinc/31/32/21/942313221.db2.gz CKIVGJGNPRGNSJ-UHFFFAOYSA-N 0 0 352.749 3.716 20 5 FHBDRN C[C@H]1[C@@H](C)N(C(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])C[C@H]1C ZINC000416070316 942316440 /nfs/dbraw/zinc/31/64/40/942316440.db2.gz KVHDDVZIUFJCIE-GMTAPVOTSA-N 0 0 360.332 3.652 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N[C@@H](CC)[C@@H]2CC2(C)C)cc1OC ZINC000416084208 942324449 /nfs/dbraw/zinc/32/44/49/942324449.db2.gz OSGGXFHBBMIYAP-STQMWFEESA-N 0 0 350.415 3.557 20 5 FHBDRN CC[C@H](NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)[C@@H]1CC1(C)C ZINC000416079956 942326845 /nfs/dbraw/zinc/32/68/45/942326845.db2.gz LDECWQAAPAPUAQ-HOTGVXAUSA-N 0 0 359.470 3.752 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1COCc2ccccc21 ZINC000416080983 942327664 /nfs/dbraw/zinc/32/76/64/942327664.db2.gz MEXWGWANFVSMME-KXBFYZLASA-N 0 0 354.406 3.551 20 5 FHBDRN COC(=O)CCCOc1ccc(CNc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000513739957 942333722 /nfs/dbraw/zinc/33/37/22/942333722.db2.gz OTHPWLDLGGHOHT-UHFFFAOYSA-N 0 0 362.357 3.678 20 5 FHBDRN CC(C)c1ccc(C(=O)N2CC[C@H](C(=O)OC(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000188125666 942336036 /nfs/dbraw/zinc/33/60/36/942336036.db2.gz CPVTVPXCBXVRTE-AWEZNQCLSA-N 0 0 362.426 3.522 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N[C@H](C)c2cccc(F)c2F)c1C ZINC000501153859 942336115 /nfs/dbraw/zinc/33/61/15/942336115.db2.gz ITUZHEICYFOWKZ-LLVKDONJSA-N 0 0 370.377 3.529 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)Nc2nc3c(s2)CC(C)(C)CC3)c1 ZINC000416095152 942337568 /nfs/dbraw/zinc/33/75/68/942337568.db2.gz CFTSOAJHANZPBR-UHFFFAOYSA-N 0 0 361.423 3.827 20 5 FHBDRN Cc1ccccc1[C@]1(F)CCN(C(=O)CCc2cccc([N+](=O)[O-])c2)C1 ZINC000501171068 942338843 /nfs/dbraw/zinc/33/88/43/942338843.db2.gz CZNTYJZLKYDXAS-FQEVSTJZSA-N 0 0 356.397 3.933 20 5 FHBDRN Cc1cc(C=C2CCN(C(=O)/C=C/c3ccc([N+](=O)[O-])cc3)CC2)no1 ZINC000378164038 942343139 /nfs/dbraw/zinc/34/31/39/942343139.db2.gz JJTBXAXNWMMRDG-QPJJXVBHSA-N 0 0 353.378 3.610 20 5 FHBDRN O=C(c1ccc(F)c2ccccc12)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000481112097 942346165 /nfs/dbraw/zinc/34/61/65/942346165.db2.gz OWDJPAUPJYQNRU-UHFFFAOYSA-N 0 0 366.348 3.791 20 5 FHBDRN O=C(CCCOc1ccccc1)Nc1ccnn1-c1ccc([N+](=O)[O-])cc1 ZINC000103931160 942347233 /nfs/dbraw/zinc/34/72/33/942347233.db2.gz QDGTXGNPNMVQFX-UHFFFAOYSA-N 0 0 366.377 3.578 20 5 FHBDRN O=C(Nc1cc(Br)cc([N+](=O)[O-])c1)c1cc(O)ccc1Cl ZINC000513741444 942347896 /nfs/dbraw/zinc/34/78/96/942347896.db2.gz NGKYOVLWRPCPOU-UHFFFAOYSA-N 0 0 371.574 3.969 20 5 FHBDRN Cn1ccnc1[C@H](NCCc1cccc(F)c1F)c1cccc([N+](=O)[O-])c1 ZINC000513708732 942347934 /nfs/dbraw/zinc/34/79/34/942347934.db2.gz WOEDNNRAZFOGBU-GOSISDBHSA-N 0 0 372.375 3.528 20 5 FHBDRN C[C@H](COc1ccc(F)cc1F)NC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000110246123 942348046 /nfs/dbraw/zinc/34/80/46/942348046.db2.gz OOQABWKEYPMKSQ-SECBINFHSA-N 0 0 370.739 3.724 20 5 FHBDRN O=C(NCC1CCC(F)(F)CC1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000501222941 942350857 /nfs/dbraw/zinc/35/08/57/942350857.db2.gz PZHNYWLSIAMGSK-UHFFFAOYSA-N 0 0 364.295 3.752 20 5 FHBDRN COc1cc(C(=O)N2CC[C@](F)(c3ccccc3C)C2)cc([N+](=O)[O-])c1C ZINC000501223663 942351565 /nfs/dbraw/zinc/35/15/65/942351565.db2.gz HCPLRNJABQLNMK-HXUWFJFHSA-N 0 0 372.396 3.931 20 5 FHBDRN Cc1cc(F)cc([C@]2(F)CCN(C(=O)c3csc([N+](=O)[O-])c3)C2)c1 ZINC000501248326 942364154 /nfs/dbraw/zinc/36/41/54/942364154.db2.gz XHRMYECZIXYJKP-INIZCTEOSA-N 0 0 352.362 3.815 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)Nc1cc(OC)c(OC)cc1C ZINC000502335457 942366946 /nfs/dbraw/zinc/36/69/46/942366946.db2.gz GKELOOCOJWBPEP-UHFFFAOYSA-N 0 0 361.354 3.573 20 5 FHBDRN CSc1ccc(C(=O)N2CCSC[C@@H]2C2CCC2)cc1[N+](=O)[O-] ZINC000416117746 942370264 /nfs/dbraw/zinc/37/02/64/942370264.db2.gz UXPFWEBMEYGIKB-CQSZACIVSA-N 0 0 352.481 3.674 20 5 FHBDRN Cc1ccc([C@@H]2CCC[C@@H]2N(C)c2ccc3ncc([N+](=O)[O-])n3n2)cc1 ZINC000502341736 942370593 /nfs/dbraw/zinc/37/05/93/942370593.db2.gz QXDSEWRRNNZMSP-HOTGVXAUSA-N 0 0 351.410 3.718 20 5 FHBDRN Cc1nc(C2CC2)oc1C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000501272214 942375490 /nfs/dbraw/zinc/37/54/90/942375490.db2.gz SBMPLZVNDJHNTF-UHFFFAOYSA-N 0 0 366.171 3.783 20 5 FHBDRN O=C(NCCNc1ccc([N+](=O)[O-])cc1)c1occc1-c1ccc(F)cc1 ZINC000502347579 942383536 /nfs/dbraw/zinc/38/35/36/942383536.db2.gz VYLNJBIYNIBLCR-UHFFFAOYSA-N 0 0 369.352 3.836 20 5 FHBDRN O=C(Nc1cc(Br)cc([N+](=O)[O-])c1)c1c(F)cccc1F ZINC000501286526 942388820 /nfs/dbraw/zinc/38/88/20/942388820.db2.gz RHWLHYLLIKBYOB-UHFFFAOYSA-N 0 0 357.110 3.888 20 5 FHBDRN CC(C)(C)OC(=O)CC[C@H]1CCCN(c2ncc([N+](=O)[O-])cc2Cl)C1 ZINC000413586830 942393758 /nfs/dbraw/zinc/39/37/58/942393758.db2.gz DVGOCNVBHDENQA-GFCCVEGCSA-N 0 0 369.849 3.982 20 5 FHBDRN COc1ccc([C@H](C)Nc2ccncc2[N+](=O)[O-])cc1Br ZINC000066797032 942395775 /nfs/dbraw/zinc/39/57/75/942395775.db2.gz UCXDKMYQHKCHRB-VIFPVBQESA-N 0 0 352.188 3.934 20 5 FHBDRN CC(C)CN(C(=O)c1nn(C)cc1[N+](=O)[O-])[C@H](C)c1ccccc1Cl ZINC000501317252 942396718 /nfs/dbraw/zinc/39/67/18/942396718.db2.gz OWECNLIBRLSOKI-GFCCVEGCSA-N 0 0 364.833 3.841 20 5 FHBDRN COC[C@@H](C)NC(=O)c1ccc(Sc2ccc(C)cc2)c([N+](=O)[O-])c1 ZINC000015791220 942402393 /nfs/dbraw/zinc/40/23/93/942402393.db2.gz LSSXEPRHPJBAGU-CYBMUJFWSA-N 0 0 360.435 3.819 20 5 FHBDRN CC[C@H](CO)N(C)C(=O)c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1 ZINC000452284718 942403334 /nfs/dbraw/zinc/40/33/34/942403334.db2.gz LUQLKSJXKKJWIB-CQSZACIVSA-N 0 0 360.435 3.589 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCC(OC[C@@H]3CCCCO3)CC2)c2cccnc21 ZINC000413176047 942407555 /nfs/dbraw/zinc/40/75/55/942407555.db2.gz KJDJKJRITAVRRJ-INIZCTEOSA-N 0 0 371.437 3.698 20 5 FHBDRN Cn1ccnc1Sc1ccc(F)cc1NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000502409555 942413883 /nfs/dbraw/zinc/41/38/83/942413883.db2.gz ILBHWMBZCQDRDT-UHFFFAOYSA-N 0 0 372.381 3.871 20 5 FHBDRN O=C(Cc1ccc2c(c1)CCCO2)Nc1ccc([N+](=O)[O-])c2ncccc12 ZINC001268853943 942415203 /nfs/dbraw/zinc/41/52/03/942415203.db2.gz OTUAKFLCFGBGDM-UHFFFAOYSA-N 0 0 363.373 3.649 20 5 FHBDRN C[C@@]1(F)CCN(C(=O)c2cc([N+](=O)[O-])ccc2NCc2ccccc2)C1 ZINC000501360866 942421275 /nfs/dbraw/zinc/42/12/75/942421275.db2.gz FMHWNMZGXTWAGN-LJQANCHMSA-N 0 0 357.385 3.781 20 5 FHBDRN C[C@H]1[C@H](Cc2ccccc2)CCN1C(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000472944513 942432375 /nfs/dbraw/zinc/43/23/75/942432375.db2.gz ADLGOUQLJHRPOX-YJBOKZPZSA-N 0 0 353.422 3.758 20 5 FHBDRN CC(C)OCc1nc([C@@H](C)Nc2ccc([N+](=O)[O-])c(OC(F)F)c2)no1 ZINC000290699542 942432508 /nfs/dbraw/zinc/43/25/08/942432508.db2.gz KMQXUHDALNRMAE-SECBINFHSA-N 0 0 372.328 3.677 20 5 FHBDRN O=C(Nc1ccc(O[C@H]2CCCC[C@@H]2O)cc1)c1csc([N+](=O)[O-])c1 ZINC000505241249 942432847 /nfs/dbraw/zinc/43/28/47/942432847.db2.gz XDZZJWWMBTYFIP-GJZGRUSLSA-N 0 0 362.407 3.591 20 5 FHBDRN Cc1cc(NC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])cc2n[nH]cc21 ZINC000501363016 942433952 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3.719 20 5 FHBDRN CN1CC[C@@H](Nc2ncc([N+](=O)[O-])cc2F)[C@H]1c1ccc(Cl)cc1 ZINC000413200737 942472984 /nfs/dbraw/zinc/47/29/84/942472984.db2.gz FICWALRATIJNFV-HUUCEWRRSA-N 0 0 350.781 3.640 20 5 FHBDRN Cc1cc(CNC(=O)c2cc([N+](=O)[O-])ccc2SCC(C)C)nc(C)n1 ZINC000501432493 942475620 /nfs/dbraw/zinc/47/56/20/942475620.db2.gz DDHCFNSNJZWEDG-UHFFFAOYSA-N 0 0 374.466 3.680 20 5 FHBDRN CC[C@H](Nc1ncc([N+](=O)[O-])cc1F)[C@@H](c1ccc(C)cc1)n1cncn1 ZINC000413205279 942477319 /nfs/dbraw/zinc/47/73/19/942477319.db2.gz JQZXSNYVIXAQSQ-DLBZAZTESA-N 0 0 370.388 3.509 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNCc1cc(Br)ccc1F ZINC000237193782 942478641 /nfs/dbraw/zinc/47/86/41/942478641.db2.gz HVFRJKLLFPEORR-UHFFFAOYSA-N 0 0 369.190 3.795 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CCC(Oc3ccccc3Cl)CC2)c(F)c1 ZINC000413208411 942478828 /nfs/dbraw/zinc/47/88/28/942478828.db2.gz SNIYYJKTKLALNL-UHFFFAOYSA-N 0 0 351.765 3.830 20 5 FHBDRN C[C@@H]1[C@H](Cc2ccccc2)CCN1C(=O)NCc1ccccc1[N+](=O)[O-] ZINC000472949585 942481666 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O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CC=C(c2ccccc2F)C1 ZINC000501564081 942551302 /nfs/dbraw/zinc/55/13/02/942551302.db2.gz CODRYNSMDJMUBN-UHFFFAOYSA-N 0 0 365.364 3.684 20 5 FHBDRN Cc1cc(Oc2ccc(NC(=O)c3n[nH]c(C(C)C)c3[N+](=O)[O-])cc2)n[nH]1 ZINC000434256318 942552393 /nfs/dbraw/zinc/55/23/93/942552393.db2.gz ZBLIUUVKEQLNLQ-UHFFFAOYSA-N 0 0 370.369 3.517 20 5 FHBDRN O=[N+]([O-])c1cccc(CN2CCN(Cc3ccc(Cl)s3)CC2)c1 ZINC000016394573 942556497 /nfs/dbraw/zinc/55/64/97/942556497.db2.gz CFDBGLWKWVCWHO-UHFFFAOYSA-N 0 0 351.859 3.628 20 5 FHBDRN COCC[C@@H](Cc1ccco1)Nc1ncc([N+](=O)[O-])cc1C(F)(F)F ZINC000413247868 942561513 /nfs/dbraw/zinc/56/15/13/942561513.db2.gz QQPMJZMAIHCKNP-JTQLQIEISA-N 0 0 359.304 3.661 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)Nc1ccc(N2CCCC2=O)cc1 ZINC000421414112 942561856 /nfs/dbraw/zinc/56/18/56/942561856.db2.gz AAXNROHHLWIXHQ-UHFFFAOYSA-N 0 0 353.378 3.591 20 5 FHBDRN COc1ccc(CNC(=O)[C@@H](C)Cc2ccccc2Cl)cc1[N+](=O)[O-] ZINC000513852706 942563214 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Cc1cc(NC(=O)COc2ccccc2[N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000616958234 942571827 /nfs/dbraw/zinc/57/18/27/942571827.db2.gz AEPMBKAONWHJCX-UHFFFAOYSA-N 0 0 354.284 3.940 20 5 FHBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)N1CCC(F)(c2ccccc2)CC1 ZINC000434300078 942572976 /nfs/dbraw/zinc/57/29/76/942572976.db2.gz LYLBEHDWOOGTGK-UHFFFAOYSA-N 0 0 371.412 3.808 20 5 FHBDRN CC(C)(CNC(=O)c1ccc([N+](=O)[O-])[nH]1)c1ccc(Cl)c(Cl)c1 ZINC000502601702 942574275 /nfs/dbraw/zinc/57/42/75/942574275.db2.gz QFMRCMXSZBIDAP-UHFFFAOYSA-N 0 0 356.209 3.937 20 5 FHBDRN CCC(CC)n1nc(C(=O)OCc2ccc(N(C)C)c([N+](=O)[O-])c2)cc1C ZINC001268941274 942575235 /nfs/dbraw/zinc/57/52/35/942575235.db2.gz MVVKUMZRBVJXHC-UHFFFAOYSA-N 0 0 374.441 3.884 20 5 FHBDRN CC(C)(C(=O)N1CC=C(c2ccccc2F)C1)c1ccc([N+](=O)[O-])cc1 ZINC000501617058 942577606 /nfs/dbraw/zinc/57/76/06/942577606.db2.gz YFVIFSVBPHJAKT-UHFFFAOYSA-N 0 0 354.381 3.937 20 5 FHBDRN COc1ccc(CN(C)C(=O)c2cc([N+](=O)[O-])c(C)cc2C)c(OC)c1 ZINC000421448904 942579645 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369.347 3.755 20 5 FHBDRN Cc1cc(OCC(=O)N2CCCc3ccc([N+](=O)[O-])cc32)ccc1Cl ZINC000509953112 942596956 /nfs/dbraw/zinc/59/69/56/942596956.db2.gz QFEAGSXOVNETNA-UHFFFAOYSA-N 0 0 360.797 3.915 20 5 FHBDRN CCOC(=O)CN(C(=O)c1cc([N+](=O)[O-])ccc1C)[C@@H](C)c1ccccc1 ZINC000513921952 942597097 /nfs/dbraw/zinc/59/70/97/942597097.db2.gz KCEUTXNOPHGKCI-HNNXBMFYSA-N 0 0 370.405 3.670 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)Nc1cccc(C[S@](C)=O)c1C ZINC000421481091 942598422 /nfs/dbraw/zinc/59/84/22/942598422.db2.gz RTNPQWXLNGJMBO-VWLOTQADSA-N 0 0 360.435 3.651 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCO[C@@H]1c1ccccc1 ZINC000421486274 942602261 /nfs/dbraw/zinc/60/22/61/942602261.db2.gz XEOOEHPCWLRHNI-QFBILLFUSA-N 0 0 354.406 3.719 20 5 FHBDRN COc1ccccc1C[C@H](C)N(C)C(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC000421488116 942603454 /nfs/dbraw/zinc/60/34/54/942603454.db2.gz ZTBCPOSCFREZKP-HNNXBMFYSA-N 0 0 356.422 3.923 20 5 FHBDRN O=C(Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1)Nc1ccccc1Cl ZINC000501674075 942604370 /nfs/dbraw/zinc/60/43/70/942604370.db2.gz LLSBGSUBSWRKAO-UHFFFAOYSA-N 0 0 356.769 3.750 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)Nc1cccnc1OCC(F)F ZINC000421495662 942607930 /nfs/dbraw/zinc/60/79/30/942607930.db2.gz KEXVFDUWFMUDON-UHFFFAOYSA-N 0 0 351.309 3.503 20 5 FHBDRN O=[N+]([O-])c1ccc(NC[C@]2(Cc3ccc(F)cc3)CCC[C@H]2O)s1 ZINC000617482900 942608560 /nfs/dbraw/zinc/60/85/60/942608560.db2.gz NQYNAQNUGAJSHT-RHSMWYFYSA-N 0 0 350.415 3.981 20 5 FHBDRN COc1cc(C(=O)N(C)[C@H]2CCC[C@@H]2C(C)(C)C)cc([N+](=O)[O-])c1OC ZINC000416292907 942616969 /nfs/dbraw/zinc/61/69/69/942616969.db2.gz QEWIDYKDDOCYII-KBPBESRZSA-N 0 0 364.442 3.899 20 5 FHBDRN Cc1cc(NC(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])cc2n[nH]cc21 ZINC000501720537 942626790 /nfs/dbraw/zinc/62/67/90/942626790.db2.gz JHLXDLHLYUVDQZ-SNVBAGLBSA-N 0 0 374.784 3.839 20 5 FHBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])C1(Oc2ccccc2)CC1 ZINC000421505652 942631047 /nfs/dbraw/zinc/63/10/47/942631047.db2.gz IRTICCZRUDGGRZ-UHFFFAOYSA-N 0 0 360.797 3.519 20 5 FHBDRN CO[C@@H](c1ccc(F)cc1)[C@@H](C)NC(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC000421505368 942631065 /nfs/dbraw/zinc/63/10/65/942631065.db2.gz IPJRCHADXWKPQA-FZKQIMNGSA-N 0 0 360.385 3.857 20 5 FHBDRN CC[C@H](CSc1ccccc1)NC(=O)c1ccc(OC)c([N+](=O)[O-])c1 ZINC000501708755 942632436 /nfs/dbraw/zinc/63/24/36/942632436.db2.gz MYLZFLXSSDSVMC-CQSZACIVSA-N 0 0 360.435 3.904 20 5 FHBDRN CCc1cccc2c1OCC[C@@H]2NC(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000513955221 942633418 /nfs/dbraw/zinc/63/34/18/942633418.db2.gz XEXBBJPIESRXHV-HNNXBMFYSA-N 0 0 371.393 3.811 20 5 FHBDRN CNC(=O)c1ccc(NCc2ccc(-c3cccnc3)cc2)c([N+](=O)[O-])c1 ZINC000078690368 942639930 /nfs/dbraw/zinc/63/99/30/942639930.db2.gz MMLJBECUNQSBAZ-UHFFFAOYSA-N 0 0 362.389 3.629 20 5 FHBDRN CCN(CC)C(=O)c1ccccc1NCc1cc([N+](=O)[O-])ccc1OC ZINC000063471636 942640857 /nfs/dbraw/zinc/64/08/57/942640857.db2.gz CWQNHSUISQWHPE-UHFFFAOYSA-N 0 0 357.410 3.698 20 5 FHBDRN COC(=O)[C@H](C)c1ccc(NC(=O)c2cc([N+](=O)[O-])c(C)cc2C)cc1 ZINC000421562005 942647335 /nfs/dbraw/zinc/64/73/35/942647335.db2.gz SFNCXXCBAWGCAU-CYBMUJFWSA-N 0 0 356.378 3.740 20 5 FHBDRN CC(C)Nc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1Oc2ccccc2O[C@H]1C ZINC000413829392 942650381 /nfs/dbraw/zinc/65/03/81/942650381.db2.gz CDMAXINLRSRXHH-KPZWWZAWSA-N 0 0 371.393 3.582 20 5 FHBDRN COCCCOc1ccc(CNC(=O)c2cc([N+](=O)[O-])c(C)cc2C)cc1 ZINC000421547582 942652135 /nfs/dbraw/zinc/65/21/35/942652135.db2.gz YUPGBVMKYGABSR-UHFFFAOYSA-N 0 0 372.421 3.557 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N[C@@H]1CCOc2c(F)ccc(F)c21 ZINC000421549521 942654641 /nfs/dbraw/zinc/65/46/41/942654641.db2.gz FDOLXXFYURLIKT-CQSZACIVSA-N 0 0 362.332 3.743 20 5 FHBDRN CN(CCOc1ccc(Br)cc1)Cc1ccccc1[N+](=O)[O-] ZINC000501756519 942655803 /nfs/dbraw/zinc/65/58/03/942655803.db2.gz OFTMPZLJOAQPOO-UHFFFAOYSA-N 0 0 365.227 3.868 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCO[C@H](c3ccc(Cl)c(Cl)c3)C2)nc1 ZINC000066815553 942659555 /nfs/dbraw/zinc/65/95/55/942659555.db2.gz DFBBDBSZRDOTLB-AWEZNQCLSA-N 0 0 354.193 3.875 20 5 FHBDRN Cc1ccccc1C[C@@H](C)NC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000501773736 942660185 /nfs/dbraw/zinc/66/01/85/942660185.db2.gz KXWSQCKDUAGWOX-OAHLLOKOSA-N 0 0 351.406 3.605 20 5 FHBDRN O=C(N[C@H](CO)CC1CCCCC1)c1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC000416329552 942661042 /nfs/dbraw/zinc/66/10/42/942661042.db2.gz XXRSIURUPUQSPP-ZDUSSCGKSA-N 0 0 374.359 3.675 20 5 FHBDRN O=[N+]([O-])c1ccc(N[C@H]2CCO[C@@H](c3cccnc3)C2)c2cccnc21 ZINC000413322957 942664450 /nfs/dbraw/zinc/66/44/50/942664450.db2.gz SGSMINMOODZERM-KBXCAEBGSA-N 0 0 350.378 3.870 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N[C@@H](C)[C@H]1OCCc2sccc21 ZINC000421574073 942666459 /nfs/dbraw/zinc/66/64/59/942666459.db2.gz KNNJZNCLKZGXBI-YVEFUNNKSA-N 0 0 360.435 3.705 20 5 FHBDRN CC(C)Oc1cc(C(=O)N[C@H]2c3ccccc3O[C@@H]2C)ccc1[N+](=O)[O-] ZINC000412363754 942669460 /nfs/dbraw/zinc/66/94/60/942669460.db2.gz RRNLRRRDGPGSIK-KZULUSFZSA-N 0 0 356.378 3.634 20 5 FHBDRN Cc1c(C(=O)Nc2nc3ccccc3s2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000005921506 942673641 /nfs/dbraw/zinc/67/36/41/942673641.db2.gz UCWYGZWPCOLDCT-UHFFFAOYSA-N 0 0 358.335 3.673 20 5 FHBDRN C[C@@H]([C@H]1Cc2ccccc2O1)N(C)C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000434435337 942676174 /nfs/dbraw/zinc/67/61/74/942676174.db2.gz SMKTXIHWKKVMEN-KPZWWZAWSA-N 0 0 365.389 3.540 20 5 FHBDRN CCCN(CCO)C(=O)c1ccc(SCCC(C)C)c([N+](=O)[O-])c1 ZINC000501797599 942681449 /nfs/dbraw/zinc/68/14/49/942681449.db2.gz LRAKVEJEABFSKN-UHFFFAOYSA-N 0 0 354.472 3.578 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)Cc1ccc(C(F)(F)F)cc1 ZINC000016470175 942685168 /nfs/dbraw/zinc/68/51/68/942685168.db2.gz FDGDILLPZHRVLY-UHFFFAOYSA-N 0 0 354.284 3.803 20 5 FHBDRN CC1(C)C[C@H](c2nc(Cc3ccc([N+](=O)[O-])cn3)no2)c2ccccc2O1 ZINC000420486215 942691675 /nfs/dbraw/zinc/69/16/75/942691675.db2.gz DLXKVQCGOFNCMP-HNNXBMFYSA-N 0 0 366.377 3.657 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H](C)c1ncc(C)s1 ZINC000183617744 942696209 /nfs/dbraw/zinc/69/62/09/942696209.db2.gz BPSASWNTBVDNTR-IUODEOHRSA-N 0 0 361.467 3.848 20 5 FHBDRN COc1cc(N2CCC3(CC2)OCCc2ccccc23)c([N+](=O)[O-])cc1F ZINC000413342798 942697181 /nfs/dbraw/zinc/69/71/81/942697181.db2.gz ZLHAKKLPWVZBTO-UHFFFAOYSA-N 0 0 372.396 3.811 20 5 FHBDRN CC(=O)c1cc(N2CCC3(CC2)OCCc2ccccc23)ccc1[N+](=O)[O-] ZINC000413342423 942697190 /nfs/dbraw/zinc/69/71/90/942697190.db2.gz ZBDRNRNKMJFVEX-UHFFFAOYSA-N 0 0 366.417 3.866 20 5 FHBDRN O=C(N[C@@H](c1c(F)cccc1F)C(F)(F)F)c1ccc([N+](=O)[O-])cc1 ZINC000505424392 942697999 /nfs/dbraw/zinc/69/79/99/942697999.db2.gz ZDBAJHZCHPCSIT-ZDUSSCGKSA-N 0 0 360.238 3.906 20 5 FHBDRN O=C(NCCOCc1ccc(Cl)cc1)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000514040931 942699080 /nfs/dbraw/zinc/69/90/80/942699080.db2.gz HVGHRTHVUJXBLW-UHFFFAOYSA-N 0 0 373.796 3.676 20 5 FHBDRN Cn1cnc([N+](=O)[O-])c1-c1noc(-c2csc(C3CCCCC3)n2)n1 ZINC000420495851 942700855 /nfs/dbraw/zinc/70/08/55/942700855.db2.gz WNKJNHKTLHBQPE-UHFFFAOYSA-N 0 0 360.399 3.550 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(Cc2noc([C@@H]3CCc4ccccc4O3)n2)c1 ZINC000420495060 942701844 /nfs/dbraw/zinc/70/18/44/942701844.db2.gz SVWUUGNFXSOUDK-KRWDZBQOSA-N 0 0 367.361 3.644 20 5 FHBDRN Cc1nc([C@@H]2CCCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3o2)no1 ZINC000501833251 942705457 /nfs/dbraw/zinc/70/54/57/942705457.db2.gz YLSKDLPCVIAORB-AWEZNQCLSA-N 0 0 370.365 3.790 20 5 FHBDRN COc1cc(C(=O)N2CCC[C@]2(C)Cc2ccc(F)cc2)ccc1[N+](=O)[O-] ZINC000421620769 942705525 /nfs/dbraw/zinc/70/55/25/942705525.db2.gz QOWXTTZPIISRKQ-HXUWFJFHSA-N 0 0 372.396 3.980 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)CCc1cccc(OC)c1OC ZINC000545958987 942706744 /nfs/dbraw/zinc/70/67/44/942706744.db2.gz NWGNKZRCXYYWHZ-UHFFFAOYSA-N 0 0 374.393 3.582 20 5 FHBDRN COC(=O)c1cc(C(=O)N[C@@H]2CCC[C@@H](C(C)C)CC2)cc([N+](=O)[O-])c1 ZINC001269795204 942712297 /nfs/dbraw/zinc/71/22/97/942712297.db2.gz MIDDQOLPPAHLAR-CZUORRHYSA-N 0 0 362.426 3.716 20 5 FHBDRN Cn1ncc([N+](=O)[O-])c1-c1nc([C@@H]2CCC(C)(C)c3ccccc32)no1 ZINC000420510410 942713800 /nfs/dbraw/zinc/71/38/00/942713800.db2.gz NNPKQTZZEXROEA-GFCCVEGCSA-N 0 0 353.382 3.582 20 5 FHBDRN Cc1c(CC(=O)Nc2c[nH]nc2-c2ccccc2F)cccc1[N+](=O)[O-] ZINC000514068339 942713951 /nfs/dbraw/zinc/71/39/51/942713951.db2.gz HJNUXWUYOOWGCR-UHFFFAOYSA-N 0 0 354.341 3.614 20 5 FHBDRN Cc1ccc(C(=O)Nc2cc(Cl)ccc2-n2cccn2)cc1[N+](=O)[O-] ZINC000502761466 942714673 /nfs/dbraw/zinc/71/46/73/942714673.db2.gz YXWWUTAGORPXAS-UHFFFAOYSA-N 0 0 356.769 3.995 20 5 FHBDRN CC[C@H](C)c1ncc(NC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)cn1 ZINC000434525378 942735814 /nfs/dbraw/zinc/73/58/14/942735814.db2.gz JTFGEKLQFAOROO-JTQLQIEISA-N 0 0 363.805 3.873 20 5 FHBDRN Cc1ccccc1CCN[C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000513755357 942748525 /nfs/dbraw/zinc/74/85/25/942748525.db2.gz RRVGXJFQFANYTO-LJQANCHMSA-N 0 0 350.422 3.558 20 5 FHBDRN Cc1cccc2nc(COc3ccc([N+](=O)[O-])cc3Br)cn21 ZINC000514105193 942748874 /nfs/dbraw/zinc/74/88/74/942748874.db2.gz OXQGVRMRQSZXQL-UHFFFAOYSA-N 0 0 362.183 3.892 20 5 FHBDRN CCc1ccc(OCc2ccc(S(=O)(=O)C(C)C)cc2)c([N+](=O)[O-])c1 ZINC000514105622 942748982 /nfs/dbraw/zinc/74/89/82/942748982.db2.gz RTMMEKSTGXTWRF-UHFFFAOYSA-N 0 0 363.435 3.918 20 5 FHBDRN Cc1cc(OCC(=O)N[C@H](CC(F)F)c2ccccc2)ccc1[N+](=O)[O-] ZINC000421696692 942751763 /nfs/dbraw/zinc/75/17/63/942751763.db2.gz BRIOBSHTRVRNGM-OAHLLOKOSA-N 0 0 364.348 3.795 20 5 FHBDRN O=C(N[C@H](c1c(F)cccc1F)C(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000505432469 942763883 /nfs/dbraw/zinc/76/38/83/942763883.db2.gz BAOMFFIQAPTMCH-CYBMUJFWSA-N 0 0 360.238 3.906 20 5 FHBDRN COc1c(C(=O)Nc2ccc3c(c2)C(=O)CCCC3)cccc1[N+](=O)[O-] ZINC000421713158 942764656 /nfs/dbraw/zinc/76/46/56/942764656.db2.gz GNUKKYXQIFQGJW-UHFFFAOYSA-N 0 0 354.362 3.765 20 5 FHBDRN COc1cc(CS[C@@H]2CCCOC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000502814113 942766078 /nfs/dbraw/zinc/76/60/78/942766078.db2.gz PZTCGNFBHNGLCK-LLVKDONJSA-N 0 0 363.382 3.660 20 5 FHBDRN Cc1cc(C(=O)NCCc2ccccc2C(F)(F)F)cc([N+](=O)[O-])c1 ZINC000502802390 942771990 /nfs/dbraw/zinc/77/19/90/942771990.db2.gz LOKOHHMVMWUEEE-UHFFFAOYSA-N 0 0 352.312 3.895 20 5 FHBDRN O=C(Nc1ccc(-n2ccnc2)cc1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514161010 942782162 /nfs/dbraw/zinc/78/21/62/942782162.db2.gz VRXYVSCUYOCWDF-UHFFFAOYSA-N 0 0 374.303 3.634 20 5 FHBDRN O=C(c1ccc(OC(F)F)c([N+](=O)[O-])c1)N1CCC[C@H](C(F)(F)F)C1 ZINC000514161232 942782778 /nfs/dbraw/zinc/78/27/78/942782778.db2.gz YKIQLZSDHFIIMH-VIFPVBQESA-N 0 0 368.258 3.611 20 5 FHBDRN Cc1nn(CC(=O)Nc2sc(C)c(C)c2C)c2ccc([N+](=O)[O-])cc12 ZINC000502845813 942792548 /nfs/dbraw/zinc/79/25/48/942792548.db2.gz OFQJKFKORQHRPK-UHFFFAOYSA-N 0 0 358.423 3.878 20 5 FHBDRN CC[C@H](NCc1nc(-c2cccc(OC)c2)no1)c1cccc([N+](=O)[O-])c1 ZINC000378465475 942796717 /nfs/dbraw/zinc/79/67/17/942796717.db2.gz WNMBUKMEJLXIKA-KRWDZBQOSA-N 0 0 368.393 3.894 20 5 FHBDRN COc1ccc(NC(=O)c2ccn(Cc3ccccc3)c2)c([N+](=O)[O-])c1 ZINC000514171289 942799111 /nfs/dbraw/zinc/79/91/11/942799111.db2.gz ZSEAQIOCONPRDY-UHFFFAOYSA-N 0 0 351.362 3.706 20 5 FHBDRN O=C(N[C@@H]1CSc2ccccc21)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514177293 942803102 /nfs/dbraw/zinc/80/31/02/942803102.db2.gz BZDIKXSUXFENEO-LLVKDONJSA-N 0 0 366.345 3.773 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N1CC[C@@H](C(F)(F)F)C2(CCC2)C1 ZINC000514201622 942810529 /nfs/dbraw/zinc/81/05/29/942810529.db2.gz JRUKFGQQFTWWNG-CQSZACIVSA-N 0 0 372.343 3.555 20 5 FHBDRN Nc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1CC[C@H](c2ccc(Cl)cc2)C1 ZINC000413941444 942812552 /nfs/dbraw/zinc/81/25/52/942812552.db2.gz APJHPXLCQFYMTB-JSGCOSHPSA-N 0 0 359.813 3.897 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCOCC2)[C@@H]1c1ccccc1 ZINC000413950044 942813690 /nfs/dbraw/zinc/81/36/90/942813690.db2.gz DPOFOTWDFKBHIA-IBGZPJMESA-N 0 0 366.417 3.897 20 5 FHBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)N[C@@H](c2ccccc2)C2CCC2)cc1 ZINC000183647655 942819022 /nfs/dbraw/zinc/81/90/22/942819022.db2.gz AZZNXDVVNIZNEI-IBGZPJMESA-N 0 0 374.462 3.598 20 5 FHBDRN O=C(NC[C@@H]1CSc2ccccc21)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412374461 942820218 /nfs/dbraw/zinc/82/02/18/942820218.db2.gz XKNWMORXVGALQP-XOKHGSTOSA-N 0 0 354.431 3.704 20 5 FHBDRN Cc1nn(CC(=O)COc2ccc(Cl)cc2)c2ccc([N+](=O)[O-])cc12 ZINC000502894453 942822740 /nfs/dbraw/zinc/82/27/40/942822740.db2.gz BUOXNQGZWOSPCE-UHFFFAOYSA-N 0 0 359.769 3.554 20 5 FHBDRN Cc1cn2c(nc(C)c2CN(C)C(=O)c2cc([N+](=O)[O-])c(C)cc2C)s1 ZINC000421792975 942828741 /nfs/dbraw/zinc/82/87/41/942828741.db2.gz SFFAUHONHGYUPK-UHFFFAOYSA-N 0 0 372.450 3.810 20 5 FHBDRN O=[N+]([O-])c1cc(F)c(CSc2nnnn2C2CCCCC2)c(F)c1 ZINC000505455238 942829220 /nfs/dbraw/zinc/82/92/20/942829220.db2.gz IPPQMUQLJLVQAO-UHFFFAOYSA-N 0 0 355.370 3.657 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(CCc3ccccc32)C1 ZINC000421792337 942829254 /nfs/dbraw/zinc/82/92/54/942829254.db2.gz OAFVMKYRCFHNNP-OAQYLSRUSA-N 0 0 366.417 3.526 20 5 FHBDRN CNc1nc(C(=O)N2CC(C)(C)C[C@@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000425120211 942832266 /nfs/dbraw/zinc/83/22/66/942832266.db2.gz NYWHIBKGSLSXCB-MRXNPFEDSA-N 0 0 354.410 3.645 20 5 FHBDRN CC(C)c1ccc(C(=O)N2CCO[C@H](c3cccc(O)c3)C2)cc1[N+](=O)[O-] ZINC000190183695 942854798 /nfs/dbraw/zinc/85/47/98/942854798.db2.gz XTACSKGYOCZIKB-IBGZPJMESA-N 0 0 370.405 3.638 20 5 FHBDRN COc1ccc(OCC(=O)Nc2ccc(C(F)(F)F)cc2)cc1[N+](=O)[O-] ZINC000190181337 942855008 /nfs/dbraw/zinc/85/50/08/942855008.db2.gz HFTQOLVPEZTVKW-UHFFFAOYSA-N 0 0 370.283 3.640 20 5 FHBDRN O=C(c1cc(Cl)ccc1[N+](=O)[O-])N1CC=C(c2cncc(F)c2)CC1 ZINC000378529684 942858263 /nfs/dbraw/zinc/85/82/63/942858263.db2.gz BYFFRZINGFYHFQ-UHFFFAOYSA-N 0 0 361.760 3.712 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1C(=O)NC1CC(OCc2ccccc2)C1 ZINC001267765827 942862517 /nfs/dbraw/zinc/86/25/17/942862517.db2.gz RUCPDRXEZZZABX-UHFFFAOYSA-N 0 0 354.406 3.689 20 5 FHBDRN C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N1CCSC(C)(C)CC1 ZINC000434686013 942864317 /nfs/dbraw/zinc/86/43/17/942864317.db2.gz SRWUQXVTNRSHKN-NSHDSACASA-N 0 0 371.890 3.793 20 5 FHBDRN CC(C)[C@H]1N(C(=O)c2c(Cl)cccc2[N+](=O)[O-])CC12CCOCC2 ZINC000413985527 942867757 /nfs/dbraw/zinc/86/77/57/942867757.db2.gz VLUWYDDWSDBMTQ-OAHLLOKOSA-N 0 0 352.818 3.525 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NC[C@@](C)(Cc1ccccc1)[C@@H](C)O ZINC000421900100 942878050 /nfs/dbraw/zinc/87/80/50/942878050.db2.gz XAVILWSYBADJJL-IIBYNOLFSA-N 0 0 370.449 3.571 20 5 FHBDRN O=C(N[C@@H]1CCCc2cn(C3CCCC3)nc21)c1ccccc1[N+](=O)[O-] ZINC000378550216 942881107 /nfs/dbraw/zinc/88/11/07/942881107.db2.gz YNXBEUSNINXOKN-MRXNPFEDSA-N 0 0 354.410 3.714 20 5 FHBDRN COc1ccc(OCC(=O)Nc2sc(C)c(C)c2C)c([N+](=O)[O-])c1 ZINC000133617132 942885352 /nfs/dbraw/zinc/88/53/52/942885352.db2.gz AKMYFRRLXUDIJM-UHFFFAOYSA-N 0 0 350.396 3.608 20 5 FHBDRN COc1ccc(OC(F)F)c(CNC(=O)c2cc([N+](=O)[O-])c(C)s2)c1 ZINC000133617580 942885661 /nfs/dbraw/zinc/88/56/61/942885661.db2.gz PEQFKKWQWXTUOZ-UHFFFAOYSA-N 0 0 372.349 3.505 20 5 FHBDRN CC[C@@H]1CCc2nc(NC(=O)COc3cccc([N+](=O)[O-])c3)sc2C1 ZINC000502983953 942894172 /nfs/dbraw/zinc/89/41/72/942894172.db2.gz QUIRRIZCQVXRQI-LLVKDONJSA-N 0 0 361.423 3.584 20 5 FHBDRN CC[C@H]1Cc2ccccc2CN1C(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000183836203 942901709 /nfs/dbraw/zinc/90/17/09/942901709.db2.gz XARMTILJJGZAIL-HNNXBMFYSA-N 0 0 370.405 3.589 20 5 FHBDRN CC(C)c1ccc(CN2CCCC[C@H]2CCS(C)(=O)=O)cc1[N+](=O)[O-] ZINC000430105471 942902081 /nfs/dbraw/zinc/90/20/81/942902081.db2.gz WHNAMUJAKICAGD-INIZCTEOSA-N 0 0 368.499 3.507 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])o1)N(CC(F)(F)F)[C@H]1CCCc2cccnc21 ZINC000378586127 942911322 /nfs/dbraw/zinc/91/13/22/942911322.db2.gz WRKJUKQVOKGFFD-NSHDSACASA-N 0 0 369.299 3.665 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CCC[C@H](CC(F)(F)F)C2)c1 ZINC000421973891 942911634 /nfs/dbraw/zinc/91/16/34/942911634.db2.gz VZIZBMKJTBGRHI-LLVKDONJSA-N 0 0 360.332 3.798 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CC[C@H](n2ncc3ccccc32)C1 ZINC000378586708 942919356 /nfs/dbraw/zinc/91/93/56/942919356.db2.gz FPBQVGOSYZTHFB-AWEZNQCLSA-N 0 0 370.796 3.685 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CC[C@@H](n2ncc3ccccc32)C1 ZINC000378586710 942920250 /nfs/dbraw/zinc/92/02/50/942920250.db2.gz FPBQVGOSYZTHFB-CQSZACIVSA-N 0 0 370.796 3.685 20 5 FHBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)NCCCC1(O)CCC1 ZINC000421988348 942920567 /nfs/dbraw/zinc/92/05/67/942920567.db2.gz BHOTYZSEMRFAPJ-UHFFFAOYSA-N 0 0 366.483 3.912 20 5 FHBDRN COC(=O)C1(NCc2cc([N+](=O)[O-])ccc2C(F)(F)F)CCCCC1 ZINC000549445775 942924165 /nfs/dbraw/zinc/92/41/65/942924165.db2.gz BFBDXMBTFMKYJY-UHFFFAOYSA-N 0 0 360.332 3.579 20 5 FHBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H](C)C[C@H](CO)C1 ZINC000421990894 942926597 /nfs/dbraw/zinc/92/65/97/942926597.db2.gz WBUQHJKORCLNAM-KBPBESRZSA-N 0 0 366.483 3.578 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CC[C@H]1c1ccc(Cl)cc1 ZINC000511564807 942929996 /nfs/dbraw/zinc/92/99/96/942929996.db2.gz HMOOPSGHCOFNFS-KRWDZBQOSA-N 0 0 359.813 3.942 20 5 FHBDRN CSc1ccc(C(=O)N[C@@H]2CCCc3c(O)cccc32)cc1[N+](=O)[O-] ZINC000190218523 942948560 /nfs/dbraw/zinc/94/85/60/942948560.db2.gz LTJJPLQQDCXSBT-CQSZACIVSA-N 0 0 358.419 3.830 20 5 FHBDRN Cc1nc(NC(=O)c2ccc(Oc3cccnc3)cc2)ccc1[N+](=O)[O-] ZINC000133631661 942954712 /nfs/dbraw/zinc/95/47/12/942954712.db2.gz VZSXCWZIGUYHLB-UHFFFAOYSA-N 0 0 350.334 3.738 20 5 FHBDRN COC(=O)[C@@H]1CC[C@@H](c2ccccc2)N1Cc1ccc([N+](=O)[O-])cc1F ZINC000434787122 942966096 /nfs/dbraw/zinc/96/60/96/942966096.db2.gz UAAKRYNZKUKJAH-ROUUACIJSA-N 0 0 358.369 3.613 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(C(N)=O)c(C)c1 ZINC000503082434 942966277 /nfs/dbraw/zinc/96/62/77/942966277.db2.gz IZNGJRVDKPBKSG-UHFFFAOYSA-N 0 0 373.434 3.757 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)ccc1NC[C@H](c1ccccc1)N1CCOCC1 ZINC000514391889 942980356 /nfs/dbraw/zinc/98/03/56/942980356.db2.gz QGBLHONEJABMPU-GOSISDBHSA-N 0 0 361.829 3.734 20 5 FHBDRN COc1cc(CSc2nccn2Cc2ccccn2)c([N+](=O)[O-])cc1F ZINC000183857405 942991680 /nfs/dbraw/zinc/99/16/80/942991680.db2.gz NPJVEFKAXOOSBF-UHFFFAOYSA-N 0 0 374.397 3.675 20 5 FHBDRN O=C1c2cccc([N+](=O)[O-])c2C(=O)N1Cc1csc(-c2cccs2)n1 ZINC000016657141 943000677 /nfs/dbraw/zinc/00/06/77/943000677.db2.gz LELABZNGARAVLC-UHFFFAOYSA-N 0 0 371.399 3.576 20 5 FHBDRN CC1(C)CN(C(=O)CSc2ccc([N+](=O)[O-])cc2)[C@H]1c1cccnc1 ZINC000293746837 943005894 /nfs/dbraw/zinc/00/58/94/943005894.db2.gz LWBHCVWWHNHPTE-KRWDZBQOSA-N 0 0 357.435 3.692 20 5 FHBDRN O=C(c1ccc(Cl)cc1[N+](=O)[O-])N1CCOC2(C1)CCCCCC2 ZINC000120252528 943006790 /nfs/dbraw/zinc/00/67/90/943006790.db2.gz DAWAGPIFAAMTBB-UHFFFAOYSA-N 0 0 352.818 3.814 20 5 FHBDRN COc1cccc(C(=O)Nc2cc(C)nc3ccc([N+](=O)[O-])cc32)c1OC ZINC000183686213 943008620 /nfs/dbraw/zinc/00/86/20/943008620.db2.gz VCZAQVIUDDTPRD-UHFFFAOYSA-N 0 0 367.361 3.721 20 5 FHBDRN CCn1nccc1NC(=O)c1ccc(N2C[C@H](C)C[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000514472005 943043077 /nfs/dbraw/zinc/04/30/77/943043077.db2.gz OVDADQMXXZJLRK-ZIAGYGMSSA-N 0 0 371.441 3.546 20 5 FHBDRN CO[C@]1(C)CCCN(c2nnc(-c3cccc([N+](=O)[O-])c3)n2CC(C)C)C1 ZINC000549451582 943050692 /nfs/dbraw/zinc/05/06/92/943050692.db2.gz CSHIFXRRWIGACW-LJQANCHMSA-N 0 0 373.457 3.515 20 5 FHBDRN O=C(c1cc2cc([N+](=O)[O-])ccc2o1)N1CCC(n2cc(Cl)cn2)CC1 ZINC000503213142 943052954 /nfs/dbraw/zinc/05/29/54/943052954.db2.gz ZNWGGHIWHMAQOJ-UHFFFAOYSA-N 0 0 374.784 3.668 20 5 FHBDRN CO[C@@]1(C)CCCN(c2nnc(-c3cccc([N+](=O)[O-])c3)n2CC(C)C)C1 ZINC000549451581 943057204 /nfs/dbraw/zinc/05/72/04/943057204.db2.gz CSHIFXRRWIGACW-IBGZPJMESA-N 0 0 373.457 3.515 20 5 FHBDRN COc1cc(C(=O)N2CC(c3ccc(Cl)cc3)C2)cc([N+](=O)[O-])c1C ZINC000412392748 943057261 /nfs/dbraw/zinc/05/72/61/943057261.db2.gz CKBLQQPNDDMAQF-UHFFFAOYSA-N 0 0 360.797 3.805 20 5 FHBDRN CC(C)Oc1cc(C(=O)N[C@@H](C)CCCc2cccnc2)ccc1[N+](=O)[O-] ZINC000412411135 943066857 /nfs/dbraw/zinc/06/68/57/943066857.db2.gz BEGBEHQOUYRXFU-HNNXBMFYSA-N 0 0 371.437 3.918 20 5 FHBDRN O=C(Nc1ccnn1-c1cccc(F)c1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000183887251 943066984 /nfs/dbraw/zinc/06/69/84/943066984.db2.gz BFCKKKOBUITKMK-UHFFFAOYSA-N 0 0 360.732 3.825 20 5 FHBDRN CCOc1ccc(CC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)cc1 ZINC000514501872 943067034 /nfs/dbraw/zinc/06/70/34/943067034.db2.gz BYLALQYKRWGIIH-UHFFFAOYSA-N 0 0 366.320 3.776 20 5 FHBDRN Cc1ncccc1OC[C@H]1CCCN1C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000416732690 943067345 /nfs/dbraw/zinc/06/73/45/943067345.db2.gz KWTBZYKRJXNRIY-OAHLLOKOSA-N 0 0 370.409 3.682 20 5 FHBDRN C[C@H]1[C@H](c2ccccc2)c2ccccc2CCN1c1c([N+](=O)[O-])ncn1C ZINC000434947339 943067288 /nfs/dbraw/zinc/06/72/88/943067288.db2.gz PIZBDSTYJBPTGX-HNAYVOBHSA-N 0 0 362.433 3.911 20 5 FHBDRN COC(=O)c1cc(Cl)ccc1OCc1ccc(OC)c([N+](=O)[O-])c1 ZINC000505586460 943094064 /nfs/dbraw/zinc/09/40/64/943094064.db2.gz UHULTSMNFUYCDV-UHFFFAOYSA-N 0 0 351.742 3.622 20 5 FHBDRN O=[N+]([O-])c1ccccc1-c1ccc(CN2C[C@H](O)Cc3ccccc32)o1 ZINC000435046648 943118364 /nfs/dbraw/zinc/11/83/64/943118364.db2.gz VJEISRROPBKLTA-OAHLLOKOSA-N 0 0 350.374 3.778 20 5 FHBDRN COc1cc(C)c(CN(C)C(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1OC ZINC000514595221 943136394 /nfs/dbraw/zinc/13/63/94/943136394.db2.gz MWSWQFPMBVAXSC-AWEZNQCLSA-N 0 0 372.421 3.683 20 5 FHBDRN CC[C@H](NC(=O)NCCc1cccc([N+](=O)[O-])c1)c1ccc(OC)cc1 ZINC000126380410 943141318 /nfs/dbraw/zinc/14/13/18/943141318.db2.gz HTXNXZSCNWRPMA-SFHVURJKSA-N 0 0 357.410 3.596 20 5 FHBDRN Cc1ccc(C[S@](=O)Cc2cc([N+](=O)[O-])cc3c2OCOC3)c(C)c1 ZINC000514602867 943141799 /nfs/dbraw/zinc/14/17/99/943141799.db2.gz GQJIRBBNBCFVPH-VWLOTQADSA-N 0 0 361.419 3.527 20 5 FHBDRN Cc1cccc2c1OC[C@@H](NC(=O)Nc1cc([N+](=O)[O-])c(C)cc1C)C2 ZINC000514609778 943146281 /nfs/dbraw/zinc/14/62/81/943146281.db2.gz LXGVMQKKYSBYRD-HNNXBMFYSA-N 0 0 355.394 3.645 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1Br)c1ccc(F)cc1 ZINC000133680338 943154502 /nfs/dbraw/zinc/15/45/02/943154502.db2.gz RLXZCDHNHNAXBO-UHFFFAOYSA-N 0 0 354.131 3.758 20 5 FHBDRN Cc1sc(C(=O)NCc2sccc2Br)cc1[N+](=O)[O-] ZINC000058767961 943156203 /nfs/dbraw/zinc/15/62/03/943156203.db2.gz UUBJQAPYGNJNQI-UHFFFAOYSA-N 0 0 361.242 3.719 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@H](OC)C1(C)C ZINC000503406912 943165969 /nfs/dbraw/zinc/16/59/69/943165969.db2.gz OVFWDZZILLQQOM-CABCVRRESA-N 0 0 352.456 3.640 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1C[C@H](OC)C1(C)C ZINC000503406913 943166352 /nfs/dbraw/zinc/16/63/52/943166352.db2.gz OVFWDZZILLQQOM-GJZGRUSLSA-N 0 0 352.456 3.640 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](CO)c1ccsc1 ZINC000505609396 943167114 /nfs/dbraw/zinc/16/71/14/943167114.db2.gz PBLUFIZRXAPUPQ-AWEZNQCLSA-N 0 0 366.464 3.622 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N(Cc1cccc(F)c1)C1CC1 ZINC000122974828 943170927 /nfs/dbraw/zinc/17/09/27/943170927.db2.gz SXHDMEFDDQJFLK-UHFFFAOYSA-N 0 0 359.357 3.939 20 5 FHBDRN C[C@@H](Nc1nccc(C(N)=O)c1[N+](=O)[O-])c1cccc(Cl)c1Cl ZINC000514639034 943170984 /nfs/dbraw/zinc/17/09/84/943170984.db2.gz SDIQXTUNJKSUTG-SSDOTTSWSA-N 0 0 355.181 3.569 20 5 FHBDRN CCCN(C(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-])[C@H]1CCc2ccccc21 ZINC000434176909 943175847 /nfs/dbraw/zinc/17/58/47/943175847.db2.gz IUYZWDDSTPIZPF-HNNXBMFYSA-N 0 0 356.426 3.981 20 5 FHBDRN Cn1c(C(=O)Nc2ccc(SCc3cccnc3)cc2)ccc1[N+](=O)[O-] ZINC000514653023 943182246 /nfs/dbraw/zinc/18/22/46/943182246.db2.gz ZDHMEYIZJVTFTD-UHFFFAOYSA-N 0 0 368.418 3.873 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@@H](Oc3ccccc3Cl)C2)c1 ZINC000503509552 943217283 /nfs/dbraw/zinc/21/72/83/943217283.db2.gz OHSZFMSIAGWIQY-CYBMUJFWSA-N 0 0 360.797 3.850 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])Nc1ccccc1OCc1cscn1 ZINC000503508807 943224357 /nfs/dbraw/zinc/22/43/57/943224357.db2.gz TUKREUDTWXGJSW-UHFFFAOYSA-N 0 0 369.402 3.812 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)C1CCOCC1 ZINC000503582155 943264092 /nfs/dbraw/zinc/26/40/92/943264092.db2.gz WIRSWYHNFQMOCW-LBPRGKRZSA-N 0 0 352.456 3.642 20 5 FHBDRN O=C(CNc1cc(Cl)ccc1Cl)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000514771217 943280520 /nfs/dbraw/zinc/28/05/20/943280520.db2.gz XWZSMHWTPAYTQU-UHFFFAOYSA-N 0 0 366.204 3.903 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])c(Br)c1)c1csc(Cl)n1 ZINC000692661663 943295771 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Cc1n[nH]c(C)c1NC(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000435324092 943323837 /nfs/dbraw/zinc/32/38/37/943323837.db2.gz SFKFNEGZHBJHQF-UHFFFAOYSA-N 0 0 368.191 3.650 20 5 FHBDRN CC(C)(C)[C@@H](CO)NC(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000434205698 943331337 /nfs/dbraw/zinc/33/13/37/943331337.db2.gz HAZSNIPRCMXINK-QGZVFWFLSA-N 0 0 373.409 3.916 20 5 FHBDRN Cc1c(NC(=O)N[C@H](C)c2ccon2)cc(Br)cc1[N+](=O)[O-] ZINC000435328484 943332666 /nfs/dbraw/zinc/33/26/66/943332666.db2.gz LGPSDDCSMWMPJN-MRVPVSSYSA-N 0 0 369.175 3.536 20 5 FHBDRN Cc1cc(=NC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)[nH]n1[C@H](C)C1CC1 ZINC000541463024 943344818 /nfs/dbraw/zinc/34/48/18/943344818.db2.gz OZMIHWGUCYTFRU-CYBMUJFWSA-N 0 0 371.441 3.549 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)NCC1(c2ccc(F)cc2)CC1 ZINC000503747968 943353408 /nfs/dbraw/zinc/35/34/08/943353408.db2.gz NIQAZDSMGANFOW-UHFFFAOYSA-N 0 0 359.357 3.596 20 5 FHBDRN COc1cc(C)c(Br)cc1NC(=O)c1ccc([N+](=O)[O-])o1 ZINC000183948972 943360759 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COc1ccc(-c2ccc(C[N@@H+]3CCC[C@H](CC(=O)[O-])C3)o2)c([N+](=O)[O-])c1 ZINC000515045028 943470737 /nfs/dbraw/zinc/47/07/37/943470737.db2.gz ZZBMGZAMQSAPHV-CYBMUJFWSA-N 0 0 374.393 3.550 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(=O)n(CC)c1 ZINC000504067556 943478597 /nfs/dbraw/zinc/47/85/97/943478597.db2.gz AYXZUGNFJHNICV-UHFFFAOYSA-N 0 0 361.423 3.531 20 5 FHBDRN O=[N+]([O-])c1c(N[C@@H]2C[C@H]2c2cc(F)c(F)c(F)c2)nc2sccn21 ZINC000435571128 943492488 /nfs/dbraw/zinc/49/24/88/943492488.db2.gz RLIDIHQLGQRXRH-OIBJUYFYSA-N 0 0 354.313 3.689 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)N1CC[C@@H](CC2CC2)C1 ZINC000515084176 943493027 /nfs/dbraw/zinc/49/30/27/943493027.db2.gz FCJOWFSMBDKEAJ-LBPRGKRZSA-N 0 0 367.243 3.548 20 5 FHBDRN O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)N1CCC[C@]2(CC=CCC2)C1 ZINC000515087490 943494791 /nfs/dbraw/zinc/49/47/91/943494791.db2.gz OTCZIPRHZVFDSO-GOSISDBHSA-N 0 0 350.365 3.764 20 5 FHBDRN CCn1c(SCCOC2CCCC2)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000431935347 943495209 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FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)NCCCO[C@@H](C)c1ccccc1 ZINC000515113375 943512206 /nfs/dbraw/zinc/51/22/06/943512206.db2.gz AEDZMULHLSIMQX-AWEZNQCLSA-N 0 0 373.409 3.893 20 5 FHBDRN CCc1ccc(CN(C(=O)c2cccc(OC)c2[N+](=O)[O-])C2CC2)cc1 ZINC000435611035 943514470 /nfs/dbraw/zinc/51/44/70/943514470.db2.gz OZMNMAVFEDHTLA-UHFFFAOYSA-N 0 0 354.406 3.971 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])o1)N1CC[C@H](Cc2ccc(C(F)F)cc2)C1 ZINC000364083553 943523964 /nfs/dbraw/zinc/52/39/64/943523964.db2.gz WBKAVUPHJHPNGC-GFCCVEGCSA-N 0 0 350.321 3.830 20 5 FHBDRN Cc1ccc([C@@H]2NC(=O)N([C@@H](C)c3ccc(C)c([N+](=O)[O-])c3)C2=O)cc1C ZINC000431938545 943528158 /nfs/dbraw/zinc/52/81/58/943528158.db2.gz NFMLXNGRVHARBU-KSSFIOAISA-N 0 0 367.405 3.874 20 5 FHBDRN CSc1cccc(-c2nc(Cc3c[nH]c4ncccc34)no2)c1[N+](=O)[O-] ZINC000584746526 943533433 /nfs/dbraw/zinc/53/34/33/943533433.db2.gz CDCXQUNHOUURED-UHFFFAOYSA-N 0 0 367.390 3.834 20 5 FHBDRN CC(C)c1ccc(CCNC(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)cc1 ZINC000515184873 943540461 /nfs/dbraw/zinc/54/04/61/943540461.db2.gz PGUCOQMIWBMLPW-UHFFFAOYSA-N 0 0 352.394 3.567 20 5 FHBDRN CC(C)C[C@@H]1CCN(C(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000515191703 943546975 /nfs/dbraw/zinc/54/69/75/943546975.db2.gz AKIWUVOPRMXEEQ-AWEZNQCLSA-N 0 0 358.442 3.696 20 5 FHBDRN COc1ccc(C(=O)OCc2cccc([N+](=O)[O-])c2)cc1Br ZINC000017265561 943567359 /nfs/dbraw/zinc/56/73/59/943567359.db2.gz ZEYBDAANNJGKNX-UHFFFAOYSA-N 0 0 366.167 3.723 20 5 FHBDRN Cc1ccc(OCCC(=O)N2c3ccc([N+](=O)[O-])cc3C[C@H]2C)c(C)c1 ZINC000504279677 943570999 /nfs/dbraw/zinc/57/09/99/943570999.db2.gz MVQHKHUKLFTVET-OAHLLOKOSA-N 0 0 354.406 3.958 20 5 FHBDRN Cc1conc1NC(=O)c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1 ZINC000435724125 943580940 /nfs/dbraw/zinc/58/09/40/943580940.db2.gz WGHYAFCAOZEKDT-UHFFFAOYSA-N 0 0 355.375 3.717 20 5 FHBDRN Cc1c2cc(F)ccc2oc1S(=O)(=O)N(C)c1cccc([N+](=O)[O-])c1 ZINC000513813641 943585727 /nfs/dbraw/zinc/58/57/27/943585727.db2.gz IMGUQZUQNYIMJQ-UHFFFAOYSA-N 0 0 364.354 3.614 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)C(C)(C)c1ccccc1Cl ZINC000504319043 943588816 /nfs/dbraw/zinc/58/88/16/943588816.db2.gz TVGSRRFODXIEHL-UHFFFAOYSA-N 0 0 362.813 3.851 20 5 FHBDRN Cc1ccc(C(=O)CCC(=O)N2c3ccc([N+](=O)[O-])cc3C[C@H]2C)s1 ZINC000504319127 943588848 /nfs/dbraw/zinc/58/88/48/943588848.db2.gz VPSUHIHZOFWHLJ-LLVKDONJSA-N 0 0 358.419 3.905 20 5 FHBDRN CCC(=O)c1ccc(OCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)cc1 ZINC000515244521 943594058 /nfs/dbraw/zinc/59/40/58/943594058.db2.gz SSUABQZDHUPRAK-UHFFFAOYSA-N 0 0 353.334 3.817 20 5 FHBDRN C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)Cc1ccc2c(c1)CCCC2 ZINC000504346895 943600509 /nfs/dbraw/zinc/60/05/09/943600509.db2.gz BMDBGCXVXVFSIT-CQSZACIVSA-N 0 0 350.418 3.994 20 5 FHBDRN C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)CCCOCc1ccccc1 ZINC000504353887 943602759 /nfs/dbraw/zinc/60/27/59/943602759.db2.gz PWNKIMNPLBNJCN-HNNXBMFYSA-N 0 0 354.406 3.869 20 5 FHBDRN NC(=O)c1ccnc(N2CCCCC[C@@H]2/C=C\c2ccccc2)c1[N+](=O)[O-] ZINC000584788866 943618067 /nfs/dbraw/zinc/61/80/67/943618067.db2.gz NYAJRGRODRCQLX-BLIJAFNYSA-N 0 0 366.421 3.551 20 5 FHBDRN CC(C)(COCc1ccccc1)NC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000504486394 943642970 /nfs/dbraw/zinc/64/29/70/943642970.db2.gz IGLSDFGEGZPVIY-UHFFFAOYSA-N 0 0 367.405 3.801 20 5 FHBDRN O=C(NCCNc1ccccc1[N+](=O)[O-])[C@H]1C[C@H]1c1ccccc1Cl ZINC000105376303 943685410 /nfs/dbraw/zinc/68/54/10/943685410.db2.gz WWAGGWNNNXXVMP-KBPBESRZSA-N 0 0 359.813 3.580 20 5 FHBDRN O=C(CCn1cc([N+](=O)[O-])cn1)N(Cc1ccccc1F)C1CCCCC1 ZINC000105375588 943685413 /nfs/dbraw/zinc/68/54/13/943685413.db2.gz ARLWVNVRFXKFOD-UHFFFAOYSA-N 0 0 374.416 3.682 20 5 FHBDRN CCCn1nccc1C1CCN(C(=O)Nc2ccc([N+](=O)[O-])c(C)c2)CC1 ZINC000504663817 943734785 /nfs/dbraw/zinc/73/47/85/943734785.db2.gz XCECJAOFOIQHSM-UHFFFAOYSA-N 0 0 371.441 3.921 20 5 FHBDRN Cc1cc(OC[C@@H](O)COCc2ccccc2F)c(Cl)cc1[N+](=O)[O-] ZINC000504674044 943739632 /nfs/dbraw/zinc/73/96/32/943739632.db2.gz UOTBAJVEOYKAGD-ZDUSSCGKSA-N 0 0 369.776 3.652 20 5 FHBDRN CCn1c([C@@H]2CCCS2)nnc1N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000424152302 943753749 /nfs/dbraw/zinc/75/37/49/943753749.db2.gz GWIGNPQLNWPVPS-INIZCTEOSA-N 0 0 373.482 3.943 20 5 FHBDRN C[C@@H]1C[C@H](c2ccccc2)N(c2ccc([N+](=O)[O-])cc2S(C)(=O)=O)C1 ZINC000828194704 943757765 /nfs/dbraw/zinc/75/77/65/943757765.db2.gz SACPFOHFKJDRJJ-CXAGYDPISA-N 0 0 360.435 3.586 20 5 FHBDRN O=C([O-])C[C@H](C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C(F)(F)F ZINC000417622370 943759187 /nfs/dbraw/zinc/75/91/87/943759187.db2.gz IKLJMSHDEWKLJR-SNVBAGLBSA-N 0 0 372.299 3.598 20 5 FHBDRN COc1cc(C(=O)NCc2ccc(-c3cccnc3)cc2)ccc1[N+](=O)[O-] ZINC000437384282 943768090 /nfs/dbraw/zinc/76/80/90/943768090.db2.gz ZMDORAPIYRQWRI-UHFFFAOYSA-N 0 0 363.373 3.595 20 5 FHBDRN COc1ccc(C(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)cc1C1CC1 ZINC000435815155 943771357 /nfs/dbraw/zinc/77/13/57/943771357.db2.gz CVDOCEJKCQZLDA-UHFFFAOYSA-N 0 0 352.390 3.679 20 5 FHBDRN CC(C)Oc1ccc(C(=O)N2CCS[C@@H]2c2ccc([N+](=O)[O-])cc2)nc1 ZINC000435817484 943774500 /nfs/dbraw/zinc/77/45/00/943774500.db2.gz LIKRTBMAPCYCIJ-GOSISDBHSA-N 0 0 373.434 3.665 20 5 FHBDRN O=C([O-])C[C@@H](C[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C(F)(F)F ZINC000417628347 943778971 /nfs/dbraw/zinc/77/89/71/943778971.db2.gz PGJCVBHDYQCZJA-NSHDSACASA-N 0 0 372.299 3.598 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2csc(-c3ccncc3)n2)c1 ZINC000516874814 943784051 /nfs/dbraw/zinc/78/40/51/943784051.db2.gz LHVGKPQZUBCGLP-UHFFFAOYSA-N 0 0 370.390 3.764 20 5 FHBDRN CN(Cc1ccco1)C(=O)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000435833020 943789059 /nfs/dbraw/zinc/78/90/59/943789059.db2.gz DDCMHFKHXHGTKJ-UHFFFAOYSA-N 0 0 350.349 3.686 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N1CCO[C@@H](c2cccc(F)c2)C1 ZINC001143507602 943794894 /nfs/dbraw/zinc/79/48/94/943794894.db2.gz SSTPKXLABLDYPP-QGZVFWFLSA-N 0 0 358.369 3.564 20 5 FHBDRN CSc1ccc(OCC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)cc1 ZINC000014736398 943799139 /nfs/dbraw/zinc/79/91/39/943799139.db2.gz DFMIIFJDQPCDRT-UHFFFAOYSA-N 0 0 352.799 3.988 20 5 FHBDRN O=C(Nc1cc(F)c(F)cc1N1CCCCC1)c1ccc([N+](=O)[O-])cn1 ZINC000515345300 943810042 /nfs/dbraw/zinc/81/00/42/943810042.db2.gz QCESTXQIBKKJIG-UHFFFAOYSA-N 0 0 362.336 3.511 20 5 FHBDRN O=C([O-])C[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000417671036 943813345 /nfs/dbraw/zinc/81/33/45/943813345.db2.gz PVXZLTPKJKXUQN-BBRMVZONSA-N 0 0 358.394 3.978 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H]1CCCC(F)(F)C1 ZINC000504837869 943826386 /nfs/dbraw/zinc/82/63/86/943826386.db2.gz YHCUWBBOUYKORV-NSHDSACASA-N 0 0 357.357 3.941 20 5 FHBDRN CC(C)c1cccnc1NC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000504824898 943830490 /nfs/dbraw/zinc/83/04/90/943830490.db2.gz KUMITWOKFNGDKC-UHFFFAOYSA-N 0 0 352.350 3.619 20 5 FHBDRN COC(=O)c1ccc(NCc2cc([N+](=O)[O-])ccc2OC(C)C)c(OC)c1 ZINC000435900495 943835110 /nfs/dbraw/zinc/83/51/10/943835110.db2.gz DVXKLCMQNUOERJ-UHFFFAOYSA-N 0 0 374.393 3.789 20 5 FHBDRN Cn1ccnc1[C@H](N[C@@H]1C[C@@]1(F)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000424325594 943845207 /nfs/dbraw/zinc/84/52/07/943845207.db2.gz NYSAGPYVRYHBMP-QWFCFKBJSA-N 0 0 366.396 3.645 20 5 FHBDRN COc1ccc2c(c1)CCN(C(=O)C(C)(C)c1ccccc1[N+](=O)[O-])CC2 ZINC000504853140 943845416 /nfs/dbraw/zinc/84/54/16/943845416.db2.gz PCDCINSJBIGQJA-UHFFFAOYSA-N 0 0 368.433 3.508 20 5 FHBDRN C[C@H](NC(=O)COc1cccc(C(F)(F)F)c1)c1cccc([N+](=O)[O-])c1 ZINC000053337037 943845551 /nfs/dbraw/zinc/84/55/51/943845551.db2.gz SWFUWYCYCXHGGM-NSHDSACASA-N 0 0 368.311 3.870 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1OC(=O)c1cnc2c(cnn2CC(C)C)c1 ZINC000760020493 943845851 /nfs/dbraw/zinc/84/58/51/943845851.db2.gz ZXSFKRJBGKJKIV-UHFFFAOYSA-N 0 0 354.366 3.523 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@H](Nc2ccccc2)C1 ZINC000516940040 943848781 /nfs/dbraw/zinc/84/87/81/943848781.db2.gz NJORPOULNFQHHP-INIZCTEOSA-N 0 0 354.410 3.876 20 5 FHBDRN CC(C)c1cccnc1NC(=O)COc1ccc([N+](=O)[O-])c2cccnc12 ZINC000504859560 943851271 /nfs/dbraw/zinc/85/12/71/943851271.db2.gz VCZXYRBFFVLFMO-UHFFFAOYSA-N 0 0 366.377 3.679 20 5 FHBDRN Cn1nccc1CC(=O)Nc1cc([N+](=O)[O-])ccc1Sc1cccs1 ZINC000435919383 943855254 /nfs/dbraw/zinc/85/52/54/943855254.db2.gz XGUMRYUOEXJYHV-UHFFFAOYSA-N 0 0 374.447 3.722 20 5 FHBDRN O=C(Nc1ccc2c(c1)CCO2)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000435923807 943859659 /nfs/dbraw/zinc/85/96/59/943859659.db2.gz RKAPFXSQHCCFIK-UHFFFAOYSA-N 0 0 356.381 3.869 20 5 FHBDRN O=C(Nc1ccc2n[nH]cc2c1)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000435936198 943869900 /nfs/dbraw/zinc/86/99/00/943869900.db2.gz NRVSOVFCRCXFKK-UHFFFAOYSA-N 0 0 372.359 3.949 20 5 FHBDRN O=C(c1ccc2[nH]c3ccccc3c(=O)c2c1)N(Cc1cccnc1)C1CC1 ZINC000435937118 943871063 /nfs/dbraw/zinc/87/10/63/943871063.db2.gz BDOFBMIWXWOIAC-UHFFFAOYSA-N 0 0 369.424 3.881 20 5 FHBDRN CO[C@@H](CNC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1)c1ccccc1 ZINC000435940349 943872539 /nfs/dbraw/zinc/87/25/39/943872539.db2.gz XYVXICBLVBMQBS-NRFANRHFSA-N 0 0 372.424 3.799 20 5 FHBDRN O=C(c1cc2cc([N+](=O)[O-])ccc2o1)N1CCC[C@@H](OCC(F)(F)F)C1 ZINC000515438919 943874054 /nfs/dbraw/zinc/87/40/54/943874054.db2.gz YFFXTDSCGQEZKE-GFCCVEGCSA-N 0 0 372.299 3.525 20 5 FHBDRN CSc1ccc(CCNC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)cc1 ZINC000437515504 943875285 /nfs/dbraw/zinc/87/52/85/943875285.db2.gz PWLCWJFQQWWBLO-UHFFFAOYSA-N 0 0 350.827 3.943 20 5 FHBDRN O=C(Nc1ccccn1)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12 ZINC000435945626 943884845 /nfs/dbraw/zinc/88/48/45/943884845.db2.gz VRMZKAFHKRQIOT-UHFFFAOYSA-N 0 0 351.312 3.607 20 5 FHBDRN O=C(N[C@@H]1C[C@H]1c1cccc2ccccc21)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000435967611 943892377 /nfs/dbraw/zinc/89/23/77/943892377.db2.gz OWJTZARMORBQNK-QFBILLFUSA-N 0 0 372.384 3.910 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccc2c(c1)C(=O)CC(C)(C)O2 ZINC000584486134 943899636 /nfs/dbraw/zinc/89/96/36/943899636.db2.gz QRNXHEWFQOHNBE-UHFFFAOYSA-N 0 0 354.362 3.899 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)N(C)c1nc2cc(Cl)ccc2s1 ZINC000435964579 943906877 /nfs/dbraw/zinc/90/68/77/943906877.db2.gz HKNVVGIQBXTNOH-UHFFFAOYSA-N 0 0 362.798 3.838 20 5 FHBDRN CO[C@@H](C)c1nc(COC(=O)c2ccc(SC)c([N+](=O)[O-])c2)cs1 ZINC000781898126 943918861 /nfs/dbraw/zinc/91/88/61/943918861.db2.gz MOPXYMWYZNBFDI-VIFPVBQESA-N 0 0 368.436 3.838 20 5 FHBDRN O=[N+]([O-])c1ccc(C(F)(F)c2nc(COc3cccc(F)c3)no2)cc1 ZINC000435994459 943919731 /nfs/dbraw/zinc/91/97/31/943919731.db2.gz LPGFOTVECSIXBC-UHFFFAOYSA-N 0 0 365.267 3.836 20 5 FHBDRN CC(C)CCSc1ccc(C(=O)N2CC(OC(F)F)C2)cc1[N+](=O)[O-] ZINC000437572720 943927993 /nfs/dbraw/zinc/92/79/93/943927993.db2.gz YREGUPZXZTXWKN-UHFFFAOYSA-N 0 0 374.409 3.797 20 5 FHBDRN CCOc1ccc(CN(C)c2ccc(C(=O)NC(C)C)cc2[N+](=O)[O-])cc1 ZINC000105431859 943938934 /nfs/dbraw/zinc/93/89/34/943938934.db2.gz PWOYDQHDDDPGQB-UHFFFAOYSA-N 0 0 371.437 3.768 20 5 FHBDRN COc1cc(NC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)c(C)c(OC)c1 ZINC000504946520 943941072 /nfs/dbraw/zinc/94/10/72/943941072.db2.gz ADPFGEKTXZRHLS-GFCCVEGCSA-N 0 0 359.382 3.803 20 5 FHBDRN COc1cccc(C(=O)N2CCC[C@@H]2/C=C/c2ccccc2)c1[N+](=O)[O-] ZINC000436023402 943942591 /nfs/dbraw/zinc/94/25/91/943942591.db2.gz WEDFMHOCYSSAGO-CJTWTEFWSA-N 0 0 352.390 3.921 20 5 FHBDRN O=C(Nc1cccc(-c2nc(-c3cccc([N+](=O)[O-])c3)no2)c1)NC1CC1 ZINC000504968295 943943452 /nfs/dbraw/zinc/94/34/52/943943452.db2.gz DMMWKFQQVRFGAG-UHFFFAOYSA-N 0 0 365.349 3.596 20 5 FHBDRN COc1ccccc1CC(C)(C)NC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000515504059 943953892 /nfs/dbraw/zinc/95/38/92/943953892.db2.gz HVBPHPWFYFVCFW-CQSZACIVSA-N 0 0 356.422 3.844 20 5 FHBDRN CCOC(=O)c1cc(C(=O)N(CC2CCCCC2)C2CC2)cc([N+](=O)[O-])c1 ZINC000515506011 943956670 /nfs/dbraw/zinc/95/66/70/943956670.db2.gz DFNCVMYIOFSEOV-UHFFFAOYSA-N 0 0 374.437 3.956 20 5 FHBDRN COc1cccc(C(=O)NCc2cc(Cl)sc2Cl)c1[N+](=O)[O-] ZINC000436038484 943962698 /nfs/dbraw/zinc/96/26/98/943962698.db2.gz MDTYCIRJDMKMRN-UHFFFAOYSA-N 0 0 361.206 3.902 20 5 FHBDRN O=C(CCc1cccc(OC(F)F)c1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000424562740 943975820 /nfs/dbraw/zinc/97/58/20/943975820.db2.gz KMFLPSBZPNDBDM-UHFFFAOYSA-N 0 0 362.332 3.718 20 5 FHBDRN Cc1cc(Br)cc(C)c1CNC(=O)c1cccc([N+](=O)[O-])c1 ZINC000500036463 943988590 /nfs/dbraw/zinc/98/85/90/943988590.db2.gz IAEWISXBQTZYSK-UHFFFAOYSA-N 0 0 363.211 3.904 20 5 FHBDRN COc1ccc(OCCN(C)Cc2cc([N+](=O)[O-])ccc2OC(C)C)cc1 ZINC000517094496 943994540 /nfs/dbraw/zinc/99/45/40/943994540.db2.gz XUIQOZPKDJDWQU-UHFFFAOYSA-N 0 0 374.437 3.901 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N[C@]2(c3ccc(Cl)cc3)C[C@H]2C)c1[N+](=O)[O-] ZINC000505750091 943996477 /nfs/dbraw/zinc/99/64/77/943996477.db2.gz OJROSGLIOFDWBP-BMLIUANNSA-N 0 0 362.817 3.760 20 5 FHBDRN Cc1ccc(C[C@H](C)NC(=O)CCOc2cc(C)ccc2[N+](=O)[O-])s1 ZINC000150720850 943998486 /nfs/dbraw/zinc/99/84/86/943998486.db2.gz YONGSBXADDLIOC-ZDUSSCGKSA-N 0 0 362.451 3.789 20 5 FHBDRN Cc1cccc2c(C(=O)N3CCN(c4cccc([N+](=O)[O-])c4)CC3)coc21 ZINC000424599951 943998999 /nfs/dbraw/zinc/99/89/99/943998999.db2.gz WRYWLZUNEMAPQM-UHFFFAOYSA-N 0 0 365.389 3.612 20 5 FHBDRN Cc1nc(Cc2noc(-c3ccc(NC4CC4)c([N+](=O)[O-])c3)n2)cs1 ZINC000505059358 944002816 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3.725 20 5 FHBDRN CCCCO[C@H]1C[C@@H](N(C)C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1(C)C ZINC000500058846 944029106 /nfs/dbraw/zinc/02/91/06/944029106.db2.gz WTACEMISHBKJFQ-CVEARBPZSA-N 0 0 374.441 3.527 20 5 FHBDRN C[C@H](c1cc(F)ccc1F)N(C)C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000126554723 944035871 /nfs/dbraw/zinc/03/58/71/944035871.db2.gz WHMWNXYGZSGFQF-GFCCVEGCSA-N 0 0 363.364 3.818 20 5 FHBDRN O=C([O-])c1ccc([N+](=O)[O-])c(NC[C@@H](c2cccs2)[NH+]2CCCC2)c1 ZINC000517152850 944050772 /nfs/dbraw/zinc/05/07/72/944050772.db2.gz TZFMVVYCECZKKZ-HNNXBMFYSA-N 0 0 361.423 3.604 20 5 FHBDRN Nc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1CC=C(c2ccc(F)cc2)CC1 ZINC000500067500 944051494 /nfs/dbraw/zinc/05/14/94/944051494.db2.gz QCMRMNQUPOKCOV-OAHLLOKOSA-N 0 0 355.369 3.682 20 5 FHBDRN C[C@@H]1COCCN1C(=O)c1cc([N+](=O)[O-])ccc1SCC1CCCC1 ZINC000436141814 944052294 /nfs/dbraw/zinc/05/22/94/944052294.db2.gz BPIUITPTAPVSKF-CYBMUJFWSA-N 0 0 364.467 3.738 20 5 FHBDRN CN(C(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1)C1Cc2ccccc2C1 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O=C(NCCOc1ccc([N+](=O)[O-])cc1)c1ccc(Cl)c2cccnc12 ZINC000518308913 944270464 /nfs/dbraw/zinc/27/04/64/944270464.db2.gz DHLROOPFUHSJLY-UHFFFAOYSA-N 0 0 371.780 3.605 20 5 FHBDRN CCOCCOc1cc(C)ccc1CNc1c2c(ccc1[N+](=O)[O-])NCC2 ZINC000436395513 944270727 /nfs/dbraw/zinc/27/07/27/944270727.db2.gz VQWRLWSKPWAUGK-UHFFFAOYSA-N 0 0 371.437 3.899 20 5 FHBDRN CC(C)NC(=O)[C@@H]1CCC[C@H](Nc2cc(C(F)(F)F)ncc2[N+](=O)[O-])C1 ZINC000436398498 944274695 /nfs/dbraw/zinc/27/46/95/944274695.db2.gz VEIYMTYVTVDVKG-MNOVXSKESA-N 0 0 374.363 3.504 20 5 FHBDRN CCOc1ccc([C@@H]2C[C@H]2NC(=O)Nc2cc(F)cc([N+](=O)[O-])c2)cc1 ZINC000436401101 944278342 /nfs/dbraw/zinc/27/83/42/944278342.db2.gz NKGJVNPXMYRKSX-DLBZAZTESA-N 0 0 359.357 3.810 20 5 FHBDRN CCCc1n[nH]c(C(=O)N[C@@H](C)CC(C)(C)c2ccccc2)c1[N+](=O)[O-] ZINC000518332412 944281129 /nfs/dbraw/zinc/28/11/29/944281129.db2.gz YNEOSAHRLGHCJL-ZDUSSCGKSA-N 0 0 358.442 3.757 20 5 FHBDRN CCOC1CC(CCNc2cc(CC)nc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000473719441 944281348 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Cc1ccc(CNc2ccc([N+](=O)[O-])cc2Cl)cc1S(C)(=O)=O ZINC000436427299 944311625 /nfs/dbraw/zinc/31/16/25/944311625.db2.gz HABVUOYJKFYYSG-UHFFFAOYSA-N 0 0 354.815 3.572 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(NC[C@H](CO)Cc2cc(F)c(F)c(F)c2)c1 ZINC000436428456 944312236 /nfs/dbraw/zinc/31/22/36/944312236.db2.gz CXNDAWXFTLCZMZ-GFCCVEGCSA-N 0 0 354.328 3.584 20 5 FHBDRN CCN1C(=O)CCc2cc(Nc3ccc(C(C)=O)cc3[N+](=O)[O-])ccc21 ZINC000302149019 944316814 /nfs/dbraw/zinc/31/68/14/944316814.db2.gz JIPQNCYVRFVXRM-UHFFFAOYSA-N 0 0 353.378 3.840 20 5 FHBDRN COc1cc(CSCCCOCC(F)(F)F)c([N+](=O)[O-])cc1F ZINC000184039998 944317129 /nfs/dbraw/zinc/31/71/29/944317129.db2.gz WRTDCEMCFGWDMG-UHFFFAOYSA-N 0 0 357.325 3.945 20 5 FHBDRN C[C@H](SCc1ccc(C(N)=O)cc1[N+](=O)[O-])c1cc(F)ccc1F ZINC000105633279 944317341 /nfs/dbraw/zinc/31/73/41/944317341.db2.gz BUPRVBYQCDQAQX-VIFPVBQESA-N 0 0 352.362 3.966 20 5 FHBDRN C[C@@H](SCc1ccc(C(N)=O)cc1[N+](=O)[O-])c1ccc(F)c(F)c1 ZINC000105633683 944318963 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359.348 3.945 20 5 FHBDRN CCOC(=O)[C@@H](Cc1ccccc1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC001167975540 944331253 /nfs/dbraw/zinc/33/12/53/944331253.db2.gz GFXSGDXKIKDGNW-HXUWFJFHSA-N 0 0 368.433 3.734 20 5 FHBDRN O=C(NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N1CC[C@H]2CCC[C@@H]21 ZINC000426277004 944335366 /nfs/dbraw/zinc/33/53/66/944335366.db2.gz IQLSCBCRAOEKDI-RISCZKNCSA-N 0 0 357.332 3.698 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N[C@H]1CCCN(c2ccccc2)C1 ZINC000439113079 944340666 /nfs/dbraw/zinc/34/06/66/944340666.db2.gz QDAQHBGHFCJOQX-HNNXBMFYSA-N 0 0 373.840 3.955 20 5 FHBDRN CNc1ccc(C(=O)N[C@H](C)c2ccccc2OC(C)C)cc1[N+](=O)[O-] ZINC000053546920 944342610 /nfs/dbraw/zinc/34/26/10/944342610.db2.gz YLHLNJJRHISGEK-CYBMUJFWSA-N 0 0 357.410 3.915 20 5 FHBDRN CNC(=O)c1ccc(NCCNc2cccc3ccccc32)c([N+](=O)[O-])c1 ZINC000053551893 944343914 /nfs/dbraw/zinc/34/39/14/944343914.db2.gz XUTHFLCDNRFVPJ-UHFFFAOYSA-N 0 0 364.405 3.632 20 5 FHBDRN Cc1cc(OC[C@@H](O)CO[C@H]2CCCc3ccccc32)ccc1[N+](=O)[O-] ZINC000550175741 944346587 /nfs/dbraw/zinc/34/65/87/944346587.db2.gz KDJVFTRHIOXRLJ-UZLBHIALSA-N 0 0 357.406 3.737 20 5 FHBDRN COc1cccc(C(=O)CCCC(=O)NCc2cccc([N+](=O)[O-])c2C)c1 ZINC000506179105 944352210 /nfs/dbraw/zinc/35/22/10/944352210.db2.gz NFQGESYFXXAYDJ-UHFFFAOYSA-N 0 0 370.405 3.581 20 5 FHBDRN CCN(Cc1ccc2c(c1)OCO2)c1ccc([N+](=O)[O-])c2cccnc21 ZINC000105699144 944353389 /nfs/dbraw/zinc/35/33/89/944353389.db2.gz WSNORBSSBUUQJO-UHFFFAOYSA-N 0 0 351.362 3.898 20 5 FHBDRN CCc1ccc(-c2nc(Cn3c(C)c([N+](=O)[O-])ccc3=O)cs2)cc1 ZINC000436474036 944355068 /nfs/dbraw/zinc/35/50/68/944355068.db2.gz MWJPUFZQXDNITB-UHFFFAOYSA-N 0 0 355.419 3.799 20 5 FHBDRN Cc1nn([C@H](C)c2nc(=O)c3c(-c4ccco4)csc3[nH]2)cc1[N+](=O)[O-] ZINC000436475131 944355773 /nfs/dbraw/zinc/35/57/73/944355773.db2.gz RTXINGRGVAXXJE-SECBINFHSA-N 0 0 371.378 3.679 20 5 FHBDRN O=C(NCc1ccc(-c2ccccc2)o1)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000515937989 944358523 /nfs/dbraw/zinc/35/85/23/944358523.db2.gz UVYXUKJCRANYRG-UHFFFAOYSA-N 0 0 362.345 3.661 20 5 FHBDRN Cc1ccccc1-c1nc(CNC(=O)Nc2ccc(C)c([N+](=O)[O-])c2)no1 ZINC000436492261 944360757 /nfs/dbraw/zinc/36/07/57/944360757.db2.gz YWGIOIKLBBVKKQ-UHFFFAOYSA-N 0 0 367.365 3.583 20 5 FHBDRN CSc1ccc(C(=O)N2CCc3c(F)ccc(F)c3C2)cc1[N+](=O)[O-] ZINC000438136214 944360944 /nfs/dbraw/zinc/36/09/44/944360944.db2.gz MHSSFWXXEWGVMA-UHFFFAOYSA-N 0 0 364.373 3.793 20 5 FHBDRN Cc1ccccc1-c1cc(NC(=O)Nc2cccc([N+](=O)[O-])c2C)n[nH]1 ZINC000436494723 944362657 /nfs/dbraw/zinc/36/26/57/944362657.db2.gz IHQFOFHOTFWRLD-UHFFFAOYSA-N 0 0 351.366 3.668 20 5 FHBDRN Cc1c(CNC(=O)c2ccc(OC(F)F)c(F)c2)cccc1[N+](=O)[O-] ZINC000506180724 944366858 /nfs/dbraw/zinc/36/68/58/944366858.db2.gz WHHOVVSDFOXGMW-UHFFFAOYSA-N 0 0 354.284 3.574 20 5 FHBDRN Cc1cc(S(=O)(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)cc(C)c1F ZINC000473761420 944371990 /nfs/dbraw/zinc/37/19/90/944371990.db2.gz DUOKXTRGMCJADI-UHFFFAOYSA-N 0 0 352.387 3.768 20 5 FHBDRN Cc1ncsc1COC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000123529354 944374222 /nfs/dbraw/zinc/37/42/22/944374222.db2.gz TWHGZOOVTWUDDA-UHFFFAOYSA-N 0 0 358.828 3.849 20 5 FHBDRN C[C@@H](C(=O)NC[C@@]1(C)CCOC2(CCC2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000894660098 944380291 /nfs/dbraw/zinc/38/02/91/944380291.db2.gz IUXWFLBCVLRPEE-ACJLOTCBSA-N 0 0 364.417 3.693 20 5 FHBDRN CCO[C@@H](CC)C(=O)Nc1ccc(OCc2ccccc2)cc1[N+](=O)[O-] ZINC000517535864 944382630 /nfs/dbraw/zinc/38/26/30/944382630.db2.gz OLXJNOCAYWZQDB-SFHVURJKSA-N 0 0 358.394 3.927 20 5 FHBDRN CO[C@H](c1ccc(F)cc1)[C@@H](C)NC(=O)Nc1ccc([N+](=O)[O-])c(C)c1 ZINC000473768983 944386648 /nfs/dbraw/zinc/38/66/48/944386648.db2.gz ZPYJHFZKTLQZQC-PXAZEXFGSA-N 0 0 361.373 3.940 20 5 FHBDRN Cc1cc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2)n(Cc2ccccc2)n1 ZINC000517557471 944388746 /nfs/dbraw/zinc/38/87/46/944388746.db2.gz HRSCIZLGEIVURC-UHFFFAOYSA-N 0 0 354.341 3.539 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)c2cccc3ccc(=O)[nH]c32)cc1[N+](=O)[O-] ZINC000519567120 944399053 /nfs/dbraw/zinc/39/90/53/944399053.db2.gz YTZZBEKYXAYQOB-LBPRGKRZSA-N 0 0 351.362 3.648 20 5 FHBDRN Cn1c(C(=O)N2CCC[C@H](CCCc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000439175319 944399557 /nfs/dbraw/zinc/39/95/57/944399557.db2.gz AULQNPVORMEKPN-KRWDZBQOSA-N 0 0 355.438 3.808 20 5 FHBDRN O=[N+]([O-])c1cncc(Br)c1N1CCc2c(Cl)cccc2C1 ZINC000500285196 944406384 /nfs/dbraw/zinc/40/63/84/944406384.db2.gz XFXKRYVVFUCGPU-UHFFFAOYSA-N 0 0 368.618 3.968 20 5 FHBDRN O=C(Nc1cc(Br)ccn1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000123709523 944412076 /nfs/dbraw/zinc/41/20/76/944412076.db2.gz BHYCFINRDLHWGL-UHFFFAOYSA-N 0 0 356.563 3.658 20 5 FHBDRN COC[C@@H]1CCCN(c2cc(C(F)(F)C(F)(F)F)ncc2[N+](=O)[O-])C1 ZINC000518475462 944414419 /nfs/dbraw/zinc/41/44/19/944414419.db2.gz CFXSZINHFXXPPW-SECBINFHSA-N 0 0 369.290 3.507 20 5 FHBDRN CO[C@H]1Cc2ccccc2N(C(=O)c2cccc(SC)c2[N+](=O)[O-])C1 ZINC000500286686 944420462 /nfs/dbraw/zinc/42/04/62/944420462.db2.gz WFPXLQIYNIAIQU-ZDUSSCGKSA-N 0 0 358.419 3.535 20 5 FHBDRN COc1cccc(C[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])c(C)c2)c1 ZINC000516000190 944421736 /nfs/dbraw/zinc/42/17/36/944421736.db2.gz CWMBTKVLRXESBL-QGZVFWFLSA-N 0 0 354.406 3.759 20 5 FHBDRN CO[C@H](c1ccccc1F)[C@@H](C)NC(=O)Nc1ccc([N+](=O)[O-])c(C)c1 ZINC000473776320 944422467 /nfs/dbraw/zinc/42/24/67/944422467.db2.gz NAPXZGXNPPTOIK-PXAZEXFGSA-N 0 0 361.373 3.940 20 5 FHBDRN CCCCCn1cc(CNC(=O)Nc2ccc([N+](=O)[O-])c(C)c2)c(C)n1 ZINC000473777335 944424117 /nfs/dbraw/zinc/42/41/17/944424117.db2.gz QEUIWERYIQLIRA-UHFFFAOYSA-N 0 0 359.430 3.920 20 5 FHBDRN CCCOc1ccc(S(=O)(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)cc1 ZINC000473778220 944425589 /nfs/dbraw/zinc/42/55/89/944425589.db2.gz UDDJEVSWSKNIFY-UHFFFAOYSA-N 0 0 364.423 3.801 20 5 FHBDRN CC(=O)c1cc(NCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)ccc1F ZINC000506190568 944428424 /nfs/dbraw/zinc/42/84/24/944428424.db2.gz HUKJQTQEXRMYMD-UHFFFAOYSA-N 0 0 356.313 3.599 20 5 FHBDRN O=[N+]([O-])c1ccc(NC(=S)N2CC=C(c3ccc(O)cc3)CC2)cc1 ZINC000017457065 944430574 /nfs/dbraw/zinc/43/05/74/944430574.db2.gz CRFSOGWNOMHDHH-UHFFFAOYSA-N 0 0 355.419 3.787 20 5 FHBDRN Cc1cc(NC(=O)N[C@H](C)c2ccc(-n3cccn3)cc2)ccc1[N+](=O)[O-] ZINC000473777032 944433948 /nfs/dbraw/zinc/43/39/48/944433948.db2.gz FWICAOQIEBKDGX-CQSZACIVSA-N 0 0 365.393 3.972 20 5 FHBDRN Cc1ccc(S(=O)(=O)N2CC[C@@H](C)C[C@H]2c2ccco2)cc1[N+](=O)[O-] ZINC000439219587 944434748 /nfs/dbraw/zinc/43/47/48/944434748.db2.gz AROBBZZRAMJAOT-WBMJQRKESA-N 0 0 364.423 3.658 20 5 FHBDRN COc1ccc2c(c1)CCCCN2C(=O)c1cc([N+](=O)[O-])ccc1OC ZINC000500295452 944442465 /nfs/dbraw/zinc/44/24/65/944442465.db2.gz DYGPOLRPWFASCZ-UHFFFAOYSA-N 0 0 356.378 3.595 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC(n2ccnc2)CC1 ZINC000506196010 944446721 /nfs/dbraw/zinc/44/67/21/944446721.db2.gz VJVMANXGLDCENM-UHFFFAOYSA-N 0 0 374.466 3.771 20 5 FHBDRN CCC[C@H](NCc1cc(C)nc(N2CCCC2)n1)c1cccc([N+](=O)[O-])c1 ZINC000426325302 944447983 /nfs/dbraw/zinc/44/79/83/944447983.db2.gz IHLXPMJXTIWXFC-IBGZPJMESA-N 0 0 369.469 3.924 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CCC[C@H](Cc2ccccc2)C1 ZINC000518509544 944454177 /nfs/dbraw/zinc/45/41/77/944454177.db2.gz DBFZOIYBDLRRNN-QGZVFWFLSA-N 0 0 374.462 3.547 20 5 FHBDRN Cc1cnccc1OC1CCN(Cc2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC000584558964 944455802 /nfs/dbraw/zinc/45/58/02/944455802.db2.gz UOKGANDVGYHNEA-UHFFFAOYSA-N 0 0 363.364 3.620 20 5 FHBDRN O=C(N[C@@H]1C[C@@H]1c1ccccc1C(F)(F)F)c1cc([O-])cc([N+](=O)[O-])c1 ZINC000506198793 944459230 /nfs/dbraw/zinc/45/92/30/944459230.db2.gz KWTOEIXCNFNOOH-UKRRQHHQSA-N 0 0 366.295 3.605 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CC[C@@H](C)C[C@H]1c1ccco1 ZINC000439233534 944460129 /nfs/dbraw/zinc/46/01/29/944460129.db2.gz ZFZPQGMUWLVPRC-DOMZBBRYSA-N 0 0 364.423 3.658 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1CC[C@@H](C)C[C@H]1c1ccco1 ZINC000439238978 944468697 /nfs/dbraw/zinc/46/86/97/944468697.db2.gz QKNYWKGPNVNIIE-DOMZBBRYSA-N 0 0 364.423 3.658 20 5 FHBDRN CN(C(=O)c1ccc(-c2noc(C(F)F)n2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000439258332 944475039 /nfs/dbraw/zinc/47/50/39/944475039.db2.gz KWCCGBPUJKDZFO-UHFFFAOYSA-N 0 0 374.303 3.859 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1OC(=O)CCCc1nnc(-c2ccccc2)o1 ZINC000760020120 944487475 /nfs/dbraw/zinc/48/74/75/944487475.db2.gz XKINUQHXZVCQFE-UHFFFAOYSA-N 0 0 367.361 3.882 20 5 FHBDRN Cc1ccccc1Oc1ccccc1CNC(=O)c1cc([N+](=O)[O-])cn1C ZINC001125937842 944488183 /nfs/dbraw/zinc/48/81/83/944488183.db2.gz XRXHZMYSFPVRRF-UHFFFAOYSA-N 0 0 365.389 3.964 20 5 FHBDRN CO[C@@H]1Cc2ccccc2N(C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000500316893 944490274 /nfs/dbraw/zinc/49/02/74/944490274.db2.gz OHIDBQBLPLDEOX-OAHLLOKOSA-N 0 0 372.396 3.616 20 5 FHBDRN COc1ccc(C(=O)O[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1 ZINC000017526884 944497087 /nfs/dbraw/zinc/49/70/87/944497087.db2.gz DJTBOJYEKAAPGO-LLVKDONJSA-N 0 0 369.333 3.571 20 5 FHBDRN CCOC(=O)c1ccc(NCc2ccc3oc(C)nc3c2)c([N+](=O)[O-])c1 ZINC001167758367 944497239 /nfs/dbraw/zinc/49/72/39/944497239.db2.gz LWRMVCBCXBEHOU-UHFFFAOYSA-N 0 0 355.350 3.833 20 5 FHBDRN CCOc1ccc(C(=O)N(C)[C@@H](C)c2sc(C)nc2C)cc1[N+](=O)[O-] ZINC000518562872 944504421 /nfs/dbraw/zinc/50/44/21/944504421.db2.gz NNSDTQRXIOGUHO-NSHDSACASA-N 0 0 363.439 3.900 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1SC1CCCC1)N1CCSCC1 ZINC000136415116 944506243 /nfs/dbraw/zinc/50/62/43/944506243.db2.gz BAAMXFZMAQVTCL-UHFFFAOYSA-N 0 0 352.481 3.819 20 5 FHBDRN COc1ccc(C(=O)COc2cc(C)c([N+](=O)[O-])cc2Cl)c(OC)c1 ZINC000506540565 944508272 /nfs/dbraw/zinc/50/82/72/944508272.db2.gz NPZAXLBFDVEHES-UHFFFAOYSA-N 0 0 365.769 3.836 20 5 FHBDRN Cc1ccoc1C(=O)Nc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1 ZINC000073516631 944510214 /nfs/dbraw/zinc/51/02/14/944510214.db2.gz HSNGEADMZRWAAF-UHFFFAOYSA-N 0 0 350.330 3.980 20 5 FHBDRN Cc1ccc(S(=O)(=O)Nc2cccc([N+](=O)[O-])c2)cc1C(F)(F)F ZINC000500320575 944511126 /nfs/dbraw/zinc/51/11/26/944511126.db2.gz ZPKFZFDNRRUFMJ-UHFFFAOYSA-N 0 0 360.313 3.723 20 5 FHBDRN Cn1c(=O)c2ccc([N+](=O)[O-])cc2nc1SCCCCOC(C)(C)C ZINC000473797332 944518757 /nfs/dbraw/zinc/51/87/57/944518757.db2.gz RZDVSBFFOYTOLT-UHFFFAOYSA-N 0 0 365.455 3.529 20 5 FHBDRN C[C@H](NC(=O)CCn1cc([N+](=O)[O-])cn1)c1ccc(Cl)c2ccccc21 ZINC000184287470 944521169 /nfs/dbraw/zinc/52/11/69/944521169.db2.gz VYQKKTYYRBMRHY-LBPRGKRZSA-N 0 0 372.812 3.865 20 5 FHBDRN COc1ccc(NC(=O)N[C@@H](c2ccccc2)[C@H]2CCOC2)cc1[N+](=O)[O-] ZINC000543892060 944522797 /nfs/dbraw/zinc/52/27/97/944522797.db2.gz LJFKGJJRHXROKB-KSSFIOAISA-N 0 0 371.393 3.503 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]c(CSc3nc4cc(F)c(F)cc4[nH]3)nc2c1 ZINC000473793938 944524303 /nfs/dbraw/zinc/52/43/03/944524303.db2.gz ZAJCJSLSTWUCLY-UHFFFAOYSA-N 0 0 361.333 3.918 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)Nc1ccc(OCCCO)cc1 ZINC000518586000 944529980 /nfs/dbraw/zinc/52/99/80/944529980.db2.gz ZNJOVBCSZCSCJH-UHFFFAOYSA-N 0 0 358.394 3.534 20 5 FHBDRN Cc1c(Cl)cccc1NC(=O)COc1c(Cl)cncc1[N+](=O)[O-] ZINC000506548809 944530909 /nfs/dbraw/zinc/53/09/09/944530909.db2.gz WUGPETDXEWTISI-UHFFFAOYSA-N 0 0 356.165 3.623 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(OCCCOc2ccc(Cl)cc2)c1 ZINC000516145133 944532916 /nfs/dbraw/zinc/53/29/16/944532916.db2.gz NLHSXCPVIMKKGD-UHFFFAOYSA-N 0 0 365.769 3.883 20 5 FHBDRN O=C(Nc1ccc(OCc2ccncc2)cc1)c1cc([O-])cc([N+](=O)[O-])c1 ZINC000506212355 944536780 /nfs/dbraw/zinc/53/67/80/944536780.db2.gz YFZYXRGOZIMURA-UHFFFAOYSA-N 0 0 365.345 3.527 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@H](C)Cc1ccc(C(F)(F)F)cc1 ZINC000110557295 944540868 /nfs/dbraw/zinc/54/08/68/944540868.db2.gz MBWHJLSINRNAKO-SNVBAGLBSA-N 0 0 367.327 3.678 20 5 FHBDRN Cc1ccc(NC(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)cc1OC(F)F ZINC000518606276 944542542 /nfs/dbraw/zinc/54/25/42/944542542.db2.gz IOTSDVGKDIMQDV-UHFFFAOYSA-N 0 0 372.274 3.964 20 5 FHBDRN Cc1c(NC(=O)[C@@H](C)N(C)Cc2ccc(F)cc2F)cccc1[N+](=O)[O-] ZINC000025071520 944545598 /nfs/dbraw/zinc/54/55/98/944545598.db2.gz TWNRSKOCQXOCIV-GFCCVEGCSA-N 0 0 363.364 3.640 20 5 FHBDRN C[C@H]1CN(C(=O)c2cc3cc([N+](=O)[O-])ccc3o2)C[C@@H](c2ccccc2)O1 ZINC000518621690 944552129 /nfs/dbraw/zinc/55/21/29/944552129.db2.gz KFLLGSNVUSIPGC-DJJJIMSYSA-N 0 0 366.373 3.943 20 5 FHBDRN C[C@H](NC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)[C@@H]1Oc2ccccc2[C@@H]1C ZINC000438389414 944555724 /nfs/dbraw/zinc/55/57/24/944555724.db2.gz FOEXIHZDKXFDEX-SYTFOFBDSA-N 0 0 365.389 3.759 20 5 FHBDRN Cn1cc(C(=O)N2CCCCC(C)(C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000438398235 944562690 /nfs/dbraw/zinc/56/26/90/944562690.db2.gz JXYFNRHVPVOHEN-UHFFFAOYSA-N 0 0 356.426 3.648 20 5 FHBDRN CCc1nn(C)c(N[C@H](C)c2ccc(-n3nc(C)cc3C)cc2)c1[N+](=O)[O-] ZINC000092830738 944566579 /nfs/dbraw/zinc/56/65/79/944566579.db2.gz RXMQLHPQEHBZIU-CQSZACIVSA-N 0 0 368.441 3.866 20 5 FHBDRN O=[N+]([O-])c1ccccc1/C=C/CN1CCC[C@@H](Oc2ncccc2F)C1 ZINC000425999922 944577573 /nfs/dbraw/zinc/57/75/73/944577573.db2.gz QPSDDDHOXVKAEB-IEXSPKMKSA-N 0 0 357.385 3.686 20 5 FHBDRN O=C(NCCOc1cccc(Cl)c1Cl)c1ccc([N+](=O)[O-])s1 ZINC000516189406 944578897 /nfs/dbraw/zinc/57/88/97/944578897.db2.gz WXCRUNRDEPDLLB-UHFFFAOYSA-N 0 0 361.206 3.772 20 5 FHBDRN C[C@H](Oc1ccc2c(c1)CCC2)C(=O)N1c2ccc([N+](=O)[O-])cc2C[C@H]1C ZINC000517760477 944580617 /nfs/dbraw/zinc/58/06/17/944580617.db2.gz VLEWHCQGHXRPLY-KGLIPLIRSA-N 0 0 366.417 3.829 20 5 FHBDRN Cc1c(C(=O)N[C@]2(Cc3ccc(Cl)cc3)CCOC2)cccc1[N+](=O)[O-] ZINC000500349435 944588827 /nfs/dbraw/zinc/58/88/27/944588827.db2.gz RCRXOHUFPRIWHE-IBGZPJMESA-N 0 0 374.824 3.688 20 5 FHBDRN O=C1CCc2cc([N+](=O)[O-])c(N3CC[C@@H](c4cccc(F)c4)C3)cc2N1 ZINC000729471169 944588962 /nfs/dbraw/zinc/58/89/62/944588962.db2.gz SMVADJVYKKEMMA-CQSZACIVSA-N 0 0 355.369 3.613 20 5 FHBDRN Cc1cccc([C@H]2CCCN2C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)n1 ZINC000518688994 944606512 /nfs/dbraw/zinc/60/65/12/944606512.db2.gz CCDXAVCQQKKBHZ-GOSISDBHSA-N 0 0 367.405 3.625 20 5 FHBDRN CCn1c(COc2c(Cl)cncc2[N+](=O)[O-])nc2cc(F)ccc21 ZINC000506576481 944610091 /nfs/dbraw/zinc/61/00/91/944610091.db2.gz FHQFTWSBCUODFT-UHFFFAOYSA-N 0 0 350.737 3.731 20 5 FHBDRN O=C(c1cc(F)cc2c(=O)c3cccc(F)c3[nH]c12)N1CCCCCO1 ZINC000473058473 944613518 /nfs/dbraw/zinc/61/35/18/944613518.db2.gz OQNCHRAXIUXLAJ-UHFFFAOYSA-N 0 0 358.344 3.517 20 5 FHBDRN O=C(NCCOc1cccc(C(F)(F)F)c1)Nc1ccc([N+](=O)[O-])cc1 ZINC000506237600 944620402 /nfs/dbraw/zinc/62/04/02/944620402.db2.gz FQHWOUWWNVCJQD-UHFFFAOYSA-N 0 0 369.299 3.814 20 5 FHBDRN Cc1cc(C)cc(OCCNC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000516228500 944620680 /nfs/dbraw/zinc/62/06/80/944620680.db2.gz YJIDIOLDQSGNKU-HNNXBMFYSA-N 0 0 357.410 3.651 20 5 FHBDRN COc1cc(CN(Cc2ccccc2)CC(C)(C)O)c([N+](=O)[O-])cc1F ZINC000184328441 944621620 /nfs/dbraw/zinc/62/16/20/944621620.db2.gz YWANUZUDUGBUJN-UHFFFAOYSA-N 0 0 362.401 3.516 20 5 FHBDRN C[C@H]1C[C@@H](C(F)(F)F)CCN1C(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000452650544 944623548 /nfs/dbraw/zinc/62/35/48/944623548.db2.gz LDMXTKYTZZZOLL-STQMWFEESA-N 0 0 373.375 3.976 20 5 FHBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)[C@H](OC1CCCC1)c1ccccc1 ZINC000759869441 944632723 /nfs/dbraw/zinc/63/27/23/944632723.db2.gz FJARVZIIVCAQIE-HXUWFJFHSA-N 0 0 368.433 3.954 20 5 FHBDRN O=[N+]([O-])c1cncc(Cl)c1OCc1noc(-c2ccc(F)cc2F)n1 ZINC000506585421 944643739 /nfs/dbraw/zinc/64/37/39/944643739.db2.gz YFBRXXCLTFDOHJ-UHFFFAOYSA-N 0 0 368.683 3.550 20 5 FHBDRN Cc1ccc(NC(=O)c2ccc(N[C@H](CO)C(C)C)c([N+](=O)[O-])c2)cc1 ZINC000426393145 944646680 /nfs/dbraw/zinc/64/66/80/944646680.db2.gz ZFXUAPPGZZQYCD-QGZVFWFLSA-N 0 0 357.410 3.584 20 5 FHBDRN CC(C)(C)c1ccc(NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)c(O)c1 ZINC000506243438 944647755 /nfs/dbraw/zinc/64/77/55/944647755.db2.gz LCJWAQYCXBYFOH-UHFFFAOYSA-N 0 0 354.366 3.727 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CCCc2c(O)cccc21 ZINC000190262459 944648162 /nfs/dbraw/zinc/64/81/62/944648162.db2.gz GYTXFOBTXISSJP-SJCJKPOMSA-N 0 0 372.446 3.975 20 5 FHBDRN C[C@@H](NC(=O)c1cc(Br)ccc1O)c1cccc([N+](=O)[O-])c1 ZINC000436795487 944648395 /nfs/dbraw/zinc/64/83/95/944648395.db2.gz FVLZIVDYSWEWHH-SECBINFHSA-N 0 0 365.183 3.554 20 5 FHBDRN CCN(CCCO)C(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000438480007 944660776 /nfs/dbraw/zinc/66/07/76/944660776.db2.gz DEQDXGRPVXRVNF-UHFFFAOYSA-N 0 0 359.382 3.623 20 5 FHBDRN CN(C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2)[C@@H]1CCC[C@H]1c1ccccc1 ZINC000566724409 944672226 /nfs/dbraw/zinc/67/22/26/944672226.db2.gz AHVLVLBFPLRBPC-GOEBONIOSA-N 0 0 368.389 3.732 20 5 FHBDRN COc1cc(C(=O)N2CCC[C@@H](c3ccccc3)C2)cc([N+](=O)[O-])c1OC ZINC000566730384 944673560 /nfs/dbraw/zinc/67/35/60/944673560.db2.gz CMVUHHSXGHABGH-OAHLLOKOSA-N 0 0 370.405 3.632 20 5 FHBDRN CO[C@](C)(CNC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000454363383 944675120 /nfs/dbraw/zinc/67/51/20/944675120.db2.gz OBDAMCJWCSJROP-IFXJQAMLSA-N 0 0 357.410 3.517 20 5 FHBDRN Cc1c(NC(=O)N[C@H](C)[C@@H]2Oc3ccccc3[C@@H]2C)cccc1[N+](=O)[O-] ZINC000438492378 944685705 /nfs/dbraw/zinc/68/57/05/944685705.db2.gz MQSHFADABSKMJR-WHWRDJHUSA-N 0 0 355.394 3.978 20 5 FHBDRN CC(C)C[C@@H]([NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1)C(=O)[O-] ZINC000426675843 944689864 /nfs/dbraw/zinc/68/98/64/944689864.db2.gz WNVDNZCOPMBPPK-QGZVFWFLSA-N 0 0 371.437 3.952 20 5 FHBDRN O=C([O-])c1cccc(CC[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)c1 ZINC000426678780 944692472 /nfs/dbraw/zinc/69/24/72/944692472.db2.gz RVWKQKUFIIKBBS-UHFFFAOYSA-N 0 0 366.373 3.885 20 5 FHBDRN Cn1ccc(CCC(=O)Nc2cccc(Oc3ccc([N+](=O)[O-])cc3)c2)n1 ZINC000516321830 944701755 /nfs/dbraw/zinc/70/17/55/944701755.db2.gz KUHXWXOPDYNHEF-UHFFFAOYSA-N 0 0 366.377 3.692 20 5 FHBDRN COc1ccccc1[C@@]1(C)C[C@@H]1NC(=O)c1c(C)c(C)ccc1[N+](=O)[O-] ZINC001126467339 944703196 /nfs/dbraw/zinc/70/31/96/944703196.db2.gz WIKFRJHSSHXWKM-FXAWDEMLSA-N 0 0 354.406 3.680 20 5 FHBDRN COC(=O)[C@H](c1ccccc1Cl)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000438513661 944703519 /nfs/dbraw/zinc/70/35/19/944703519.db2.gz CDSCAEORBKOREL-KRWDZBQOSA-N 0 0 360.797 3.521 20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])NC[C@H]1CCC[C@H](C(F)(F)F)C1 ZINC000438515594 944707712 /nfs/dbraw/zinc/70/77/12/944707712.db2.gz IBZSLWZRDFWELU-STQMWFEESA-N 0 0 373.375 3.882 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@]1(O)CCCC(C)(C)C1 ZINC000438508025 944718362 /nfs/dbraw/zinc/71/83/62/944718362.db2.gz XIXKTHXSDXDJMH-JXFKEZNVSA-N 0 0 362.470 3.611 20 5 FHBDRN CC(C)c1nnc2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4o3)cn21 ZINC000438508244 944720841 /nfs/dbraw/zinc/72/08/41/944720841.db2.gz LQJYBFWFLOUQJQ-UHFFFAOYSA-N 0 0 365.349 3.759 20 5 FHBDRN CC(C)(C)c1csc(CNC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)n1 ZINC000517839317 944722740 /nfs/dbraw/zinc/72/27/40/944722740.db2.gz XTXLNZQSNMOTRQ-UHFFFAOYSA-N 0 0 372.450 3.620 20 5 FHBDRN O=C([O-])[C@@H](Cc1c[nH]c2ccc([N+](=O)[O-])cc12)[NH2+]CC1CCCCCC1 ZINC000426722846 944723398 /nfs/dbraw/zinc/72/33/98/944723398.db2.gz JCPXSMMLCOUXHS-GOSISDBHSA-N 0 0 359.426 3.632 20 5 FHBDRN Cc1cccc(OC[C@@H](C)NC(=O)C(C)(C)c2ccccc2[N+](=O)[O-])c1 ZINC000429801893 944723752 /nfs/dbraw/zinc/72/37/52/944723752.db2.gz IRDQHRPSOAGNHQ-OAHLLOKOSA-N 0 0 356.422 3.765 20 5 FHBDRN O=C(CN1CCc2ccc([N+](=O)[O-])cc2C1)Nc1cccc2ccccc21 ZINC000438521477 944723958 /nfs/dbraw/zinc/72/39/58/944723958.db2.gz BFMBFVJDDYXSEA-UHFFFAOYSA-N 0 0 361.401 3.745 20 5 FHBDRN CCCN(CCc1cccc(F)c1)c1ccc(C(=O)NC)cc1[N+](=O)[O-] ZINC000500387885 944726081 /nfs/dbraw/zinc/72/60/81/944726081.db2.gz SAFNIBBKRLAESJ-UHFFFAOYSA-N 0 0 359.401 3.553 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C[NH2+]C[C@@H](Cc1ccccc1Cl)C(=O)[O-] ZINC000426708837 944731434 /nfs/dbraw/zinc/73/14/34/944731434.db2.gz NOWVNJWJBYFMPJ-OAHLLOKOSA-N 0 0 362.813 3.590 20 5 FHBDRN Cc1noc(C)c1-c1ccc(OC(=O)COc2ccccc2[N+](=O)[O-])cc1 ZINC000759883931 944734059 /nfs/dbraw/zinc/73/40/59/944734059.db2.gz VIEDPOLZJCAVPM-UHFFFAOYSA-N 0 0 368.345 3.851 20 5 FHBDRN Cc1ccc(C[NH2+][C@@H](C(=O)[O-])c2ccc(Cl)c(F)c2)cc1[N+](=O)[O-] ZINC000426729064 944736606 /nfs/dbraw/zinc/73/66/06/944736606.db2.gz ZPKZWUDEWVFGJW-OAHLLOKOSA-N 0 0 352.749 3.611 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CCC[C@H]1c1cccc(F)c1 ZINC000053717791 944746087 /nfs/dbraw/zinc/74/60/87/944746087.db2.gz OEBIOZIPCLLGRY-SFHVURJKSA-N 0 0 357.385 3.818 20 5 FHBDRN CC(C)(NC(=O)NC[C@H]1CCc2ccccc21)c1ccc([N+](=O)[O-])cc1 ZINC000431978237 944752444 /nfs/dbraw/zinc/75/24/44/944752444.db2.gz VHVVJTDVWKGJSZ-OAHLLOKOSA-N 0 0 353.422 3.859 20 5 FHBDRN CN(Cc1ccccc1N1CCOCC1)c1ccc([N+](=O)[O-])cc1Cl ZINC000015140853 944764966 /nfs/dbraw/zinc/76/49/66/944764966.db2.gz KWCGPWQRGNHQFH-UHFFFAOYSA-N 0 0 361.829 3.721 20 5 FHBDRN CCOCc1ccc(N[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 ZINC000439569741 944771711 /nfs/dbraw/zinc/77/17/11/944771711.db2.gz LQLKIMSWHWPXDH-CQSZACIVSA-N 0 0 357.410 3.879 20 5 FHBDRN COc1cc(C(=O)Nc2ccc(-c3ncco3)cc2)cc([N+](=O)[O-])c1OC ZINC000500405077 944783456 /nfs/dbraw/zinc/78/34/56/944783456.db2.gz KTJRSNUHXUAWPA-UHFFFAOYSA-N 0 0 369.333 3.519 20 5 FHBDRN O=C(Nc1ccc(F)cc1OCCC(F)(F)F)c1ccc([N+](=O)[O-])[nH]1 ZINC000506627534 944783745 /nfs/dbraw/zinc/78/37/45/944783745.db2.gz XIHMCZCVZFSVGP-UHFFFAOYSA-N 0 0 361.251 3.646 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)c1cnc(-c2ccccc2)[nH]1 ZINC000500407781 944796112 /nfs/dbraw/zinc/79/61/12/944796112.db2.gz BCDWRMJGHXYBOY-UHFFFAOYSA-N 0 0 356.769 3.568 20 5 FHBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1C[C@@H](C)S[C@H](C)C1 ZINC000550278939 944798392 /nfs/dbraw/zinc/79/83/92/944798392.db2.gz SUOHAXHPQPMIGK-RKDXNWHRSA-N 0 0 373.272 3.632 20 5 FHBDRN CCc1cccc2c1OCC[C@H]2NC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000506962711 944801301 /nfs/dbraw/zinc/80/13/01/944801301.db2.gz CJWDAJHQJFORCU-QGZVFWFLSA-N 0 0 365.389 3.892 20 5 FHBDRN CCc1cccc2c1OCC[C@@H]2NC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000506962700 944801368 /nfs/dbraw/zinc/80/13/68/944801368.db2.gz CJWDAJHQJFORCU-KRWDZBQOSA-N 0 0 365.389 3.892 20 5 FHBDRN C[C@@H]1CCCN(c2ccc(C(=O)N(C)Cc3ccco3)cc2[N+](=O)[O-])C1 ZINC000017790681 944806712 /nfs/dbraw/zinc/80/67/12/944806712.db2.gz FVDPWOCRCRBQOG-CQSZACIVSA-N 0 0 357.410 3.696 20 5 FHBDRN COC(=O)c1sc(NC(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)cc1C ZINC000541584924 944809467 /nfs/dbraw/zinc/80/94/67/944809467.db2.gz FCOIGRMREUJMIJ-VIFPVBQESA-N 0 0 366.370 3.633 20 5 FHBDRN O=C(Nc1cc(Cl)cnc1Br)c1ccccc1[N+](=O)[O-] 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FHBDRN CC(C)c1csc(CNC(=O)CCCNc2ccc([N+](=O)[O-])cc2)n1 ZINC000151260754 945484029 /nfs/dbraw/zinc/48/40/29/945484029.db2.gz WPHFQNVZUISVAV-UHFFFAOYSA-N 0 0 362.455 3.683 20 5 FHBDRN CC(C)(C)OC(=O)CCCCOC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000785266181 945486688 /nfs/dbraw/zinc/48/66/88/945486688.db2.gz KPDFJVHQKWDOPH-UHFFFAOYSA-N 0 0 362.382 3.745 20 5 FHBDRN CCCOCc1ccccc1CNc1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1 ZINC000281006046 945490595 /nfs/dbraw/zinc/49/05/95/945490595.db2.gz QGKCTUCKJIDWCN-UHFFFAOYSA-N 0 0 368.393 3.782 20 5 FHBDRN C[C@H](NS(=O)(=O)CC12CCC(CC1)CC2)c1cccc([N+](=O)[O-])c1 ZINC000432210438 945494334 /nfs/dbraw/zinc/49/43/34/945494334.db2.gz MVLIWQLLYUKJDJ-CBCUQQMYSA-N 0 0 352.456 3.546 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)Nc1nc(-c2cccnc2)cs1 ZINC000087036300 945501427 /nfs/dbraw/zinc/50/14/27/945501427.db2.gz XDXMEADEJTXJGR-UHFFFAOYSA-N 0 0 354.391 3.685 20 5 FHBDRN C[C@@H]1CCN(CCn2cc([N+](=O)[O-])cn2)c2cc(Cl)ccc2S1 ZINC000440397063 945505107 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FHBDRN O=[N+]([O-])c1ccc(OC2CCN(c3ccnc4ccncc43)CC2)cc1 ZINC000444070273 945784957 /nfs/dbraw/zinc/78/49/57/945784957.db2.gz JDMNFOKWADDEAW-UHFFFAOYSA-N 0 0 350.378 3.586 20 5 FHBDRN COc1ccc(Cc2nc(-c3cc(F)c(C)cc3F)no2)c([N+](=O)[O-])c1 ZINC001211851833 945791926 /nfs/dbraw/zinc/79/19/26/945791926.db2.gz KWMUGLLSJBNAOJ-UHFFFAOYSA-N 0 0 361.304 3.831 20 5 FHBDRN Cc1cc(NC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)nc(C(C)C)n1 ZINC000519877405 945830190 /nfs/dbraw/zinc/83/01/90/945830190.db2.gz RTHJTORGSVOREY-LBPRGKRZSA-N 0 0 360.439 3.936 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CCC[C@@H](c3ncc4n3CCCC4)C2)c(Cl)c1 ZINC000281732999 945832052 /nfs/dbraw/zinc/83/20/52/945832052.db2.gz AXBHVSARVWMNCF-GFCCVEGCSA-N 0 0 361.833 3.560 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)NCCc1cccc(Cl)c1Cl ZINC000107961434 945835746 /nfs/dbraw/zinc/83/57/46/945835746.db2.gz KLTJWXZEAFMLEI-UHFFFAOYSA-N 0 0 369.204 3.639 20 5 FHBDRN O=C(N[C@H]1CC=CCC1)c1cc(F)cc2c(=O)c3cccc(F)c3[nH]c12 ZINC000444090401 945841062 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/nfs/dbraw/zinc/92/49/16/945924916.db2.gz SKHIDPHDUFWTPI-GFCCVEGCSA-N 0 0 372.343 3.693 20 5 FHBDRN Cc1ccc([C@@H]2C[C@H](C)N(C(=O)CNc3ccccc3[N+](=O)[O-])C2)cc1 ZINC000428328636 945937706 /nfs/dbraw/zinc/93/77/06/945937706.db2.gz ZRZRCNDBWMSICV-DOTOQJQBSA-N 0 0 353.422 3.720 20 5 FHBDRN CCCO[C@@H]1CCCN(C(=O)CCCNc2ccc([N+](=O)[O-])cc2)CC1 ZINC000108323938 945940874 /nfs/dbraw/zinc/94/08/74/945940874.db2.gz JFKBLFHCTVEXDH-GOSISDBHSA-N 0 0 363.458 3.595 20 5 FHBDRN COc1ccc([C@@H](C)NC(=O)N(C)Cc2ccccc2[N+](=O)[O-])cc1F ZINC000045103223 945941044 /nfs/dbraw/zinc/94/10/44/945941044.db2.gz PFNGBEPPYBMQLB-GFCCVEGCSA-N 0 0 361.373 3.645 20 5 FHBDRN CC(C)(C)OC(=O)Nc1ncc(CNCc2ccc([N+](=O)[O-])cc2)s1 ZINC000281928891 945941842 /nfs/dbraw/zinc/94/18/42/945941842.db2.gz HHADTJUBWYLRLJ-UHFFFAOYSA-N 0 0 364.427 3.688 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC(C(F)(F)F)CC1 ZINC000281932314 945949067 /nfs/dbraw/zinc/94/90/67/945949067.db2.gz KQHQPGQHYLOGIY-UHFFFAOYSA-N 0 0 361.320 3.800 20 5 FHBDRN COc1ccc(NC(=O)[C@H](C)Oc2ccc([N+](=O)[O-])c(Cl)c2)cc1 ZINC000127154546 945966629 /nfs/dbraw/zinc/96/66/29/945966629.db2.gz KONUJLNENFXINO-JTQLQIEISA-N 0 0 350.758 3.663 20 5 FHBDRN Cc1nc2ccccc2n1C[C@@H]1CCCN1c1ncc(C)cc1[N+](=O)[O-] ZINC000550122192 945971090 /nfs/dbraw/zinc/97/10/90/945971090.db2.gz GPSHHOQEEWJXJV-HNNXBMFYSA-N 0 0 351.410 3.625 20 5 FHBDRN COc1ccc([C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)c(OC)c1 ZINC000015829590 945971893 /nfs/dbraw/zinc/97/18/93/945971893.db2.gz NFIGSZLUOWBSSC-ZDUSSCGKSA-N 0 0 362.407 3.651 20 5 FHBDRN Cc1ccc(C)c(NC(=O)COc2ccc([N+](=O)[O-])c3cccnc23)c1 ZINC000143184573 945977810 /nfs/dbraw/zinc/97/78/10/945977810.db2.gz UTIWEPQSUOOTBF-UHFFFAOYSA-N 0 0 351.362 3.777 20 5 FHBDRN Cc1ccc(Cl)cc1N(C)S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000549544203 946011988 /nfs/dbraw/zinc/01/19/88/946011988.db2.gz AZGSILKIULFIQY-UHFFFAOYSA-N 0 0 354.815 3.523 20 5 FHBDRN COC(=O)c1cc([N+](=O)[O-])c(NC[C@H](C)c2c(C)noc2C)cc1Cl ZINC000129437393 946014602 /nfs/dbraw/zinc/01/46/02/946014602.db2.gz UHMLUTIJZHUZHR-QMMMGPOBSA-N 0 0 367.789 3.855 20 5 FHBDRN COc1ccc(-c2noc(COc3ccc([N+](=O)[O-])cc3Cl)n2)cc1 ZINC000045361212 946026612 /nfs/dbraw/zinc/02/66/12/946026612.db2.gz UPMKXRGEOACOOH-UHFFFAOYSA-N 0 0 361.741 3.886 20 5 FHBDRN CC(=O)c1ccc(NC(=O)[C@@H](C)Oc2ccc([N+](=O)[O-])c(Cl)c2)cc1 ZINC000127161031 946027452 /nfs/dbraw/zinc/02/74/52/946027452.db2.gz DWNQOWSIOYYVAI-LLVKDONJSA-N 0 0 362.769 3.857 20 5 FHBDRN O=C(c1cn2ccccc2n1)N(c1cccc([N+](=O)[O-])c1)C1CCCC1 ZINC000522875075 946041445 /nfs/dbraw/zinc/04/14/45/946041445.db2.gz XHUQQNDKTFLFLO-UHFFFAOYSA-N 0 0 350.378 3.832 20 5 FHBDRN O=C(N[C@@H](C[NH+]1CCCC1)c1ccccc1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000522877443 946047856 /nfs/dbraw/zinc/04/78/56/946047856.db2.gz IOHYYPDNZQBDGD-SFHVURJKSA-N 0 0 373.840 3.815 20 5 FHBDRN CCOc1ccc(C(=O)Nc2nnc(-c3ccccc3)s2)cc1[N+](=O)[O-] ZINC000018703499 946076574 /nfs/dbraw/zinc/07/65/74/946076574.db2.gz NKLDKSFBJPUQOY-UHFFFAOYSA-N 0 0 370.390 3.764 20 5 FHBDRN CN(C)c1cc(CNc2nc3sccn3c2[N+](=O)[O-])c2ccccc2n1 ZINC000439715319 946089545 /nfs/dbraw/zinc/08/95/45/946089545.db2.gz OKHGOVGUAXKTOD-UHFFFAOYSA-N 0 0 368.422 3.530 20 5 FHBDRN COC(=O)c1cc(NC(=O)[C@H](C)CSc2ccccc2)cc([N+](=O)[O-])c1 ZINC000522918550 946100876 /nfs/dbraw/zinc/10/08/76/946100876.db2.gz LMLGIQRVSVTYGZ-GFCCVEGCSA-N 0 0 374.418 3.748 20 5 FHBDRN O=[N+]([O-])c1cccnc1SCCOc1cccc(Br)c1 ZINC000520088011 946101886 /nfs/dbraw/zinc/10/18/86/946101886.db2.gz QVNMOGOOGHRLAK-UHFFFAOYSA-N 0 0 355.213 3.923 20 5 FHBDRN Cc1c(C(=O)NCc2ccc(OC3CCCCC3)nc2)cccc1[N+](=O)[O-] ZINC000522920120 946103421 /nfs/dbraw/zinc/10/34/21/946103421.db2.gz AQLNNAJYRDPURH-UHFFFAOYSA-N 0 0 369.421 3.940 20 5 FHBDRN Cc1[nH]nc(C(=O)Nc2ccc(OCc3ccccc3F)cc2)c1[N+](=O)[O-] ZINC000522927648 946105897 /nfs/dbraw/zinc/10/58/97/946105897.db2.gz PQFSGKRMMOABSH-UHFFFAOYSA-N 0 0 370.340 3.597 20 5 FHBDRN O=[N+]([O-])c1ccc(OCc2cn3cc(Cl)cc(Cl)c3n2)cc1CO ZINC000574507225 946125896 /nfs/dbraw/zinc/12/58/96/946125896.db2.gz SBHNMKKEABUWBK-UHFFFAOYSA-N 0 0 368.176 3.621 20 5 FHBDRN C[C@H](OC(=O)c1cccc(N2CCCC2=O)c1)c1ccc([N+](=O)[O-])cc1 ZINC000066878983 946140572 /nfs/dbraw/zinc/14/05/72/946140572.db2.gz MKOHVGYGICXAHL-ZDUSSCGKSA-N 0 0 354.362 3.640 20 5 FHBDRN CCn1cc(Cl)c(NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)n1 ZINC000894898309 946145199 /nfs/dbraw/zinc/14/51/99/946145199.db2.gz DYBCDLMBEJAAAJ-UHFFFAOYSA-N 0 0 354.769 3.520 20 5 FHBDRN CCNc1ccc(C(=O)NCCc2ccc(Cl)s2)cc1[N+](=O)[O-] ZINC000323594532 946148460 /nfs/dbraw/zinc/14/84/60/946148460.db2.gz PTBJEVKGGIHKIN-UHFFFAOYSA-N 0 0 353.831 3.714 20 5 FHBDRN COC(=O)Nc1cccc(NC(=O)c2c(C)c(F)ccc2[N+](=O)[O-])c1C ZINC001270828613 946159658 /nfs/dbraw/zinc/15/96/58/946159658.db2.gz RPWNNGVFCGYCOQ-UHFFFAOYSA-N 0 0 361.329 3.781 20 5 FHBDRN O=[N+]([O-])c1ccc(N2Cc3ccc(Br)cc3C2)c([N+](=O)[O-])c1 ZINC000302187643 946167084 /nfs/dbraw/zinc/16/70/84/946167084.db2.gz WMUCWEWFYJUTSN-UHFFFAOYSA-N 0 0 364.155 3.786 20 5 FHBDRN Cc1ccc(C(=O)CCCC(=O)NCc2cccc([N+](=O)[O-])c2C)cc1 ZINC000508469744 946167246 /nfs/dbraw/zinc/16/72/46/946167246.db2.gz QRPJSRMLFUZAGA-UHFFFAOYSA-N 0 0 354.406 3.881 20 5 FHBDRN C[C@H](OC(=O)c1cc(Cl)ccc1F)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000018799203 946168361 /nfs/dbraw/zinc/16/83/61/946168361.db2.gz FDCUDNBVTZEJEV-VIFPVBQESA-N 0 0 366.732 3.571 20 5 FHBDRN CCOc1ccc(NC(=O)c2cc([N+](=O)[O-])cnc2C)c(C(F)(F)F)c1 ZINC000121245055 946176043 /nfs/dbraw/zinc/17/60/43/946176043.db2.gz OJYGPTUXOVYKGI-UHFFFAOYSA-N 0 0 369.299 3.968 20 5 FHBDRN Cc1ccc(S(=O)(=O)N2CCCCC[C@H]2c2ccco2)c([N+](=O)[O-])c1 ZINC000522981555 946185683 /nfs/dbraw/zinc/18/56/83/946185683.db2.gz YGAXWIJCUWJNRY-AWEZNQCLSA-N 0 0 364.423 3.802 20 5 FHBDRN CC(=O)N(c1ccc(NC(=O)c2cccc([N+](=O)[O-])c2C)cc1)[C@H]1C[C@@H]1C ZINC000294050652 946189082 /nfs/dbraw/zinc/18/90/82/946189082.db2.gz FRKQEYUGNSDBBG-BUXKBTBVSA-N 0 0 367.405 3.917 20 5 FHBDRN COc1cccc([C@H](C)C(=O)Nc2ccnn2-c2ccc([N+](=O)[O-])cc2)c1 ZINC000109210753 946192236 /nfs/dbraw/zinc/19/22/36/946192236.db2.gz SRANEONEMGDLPY-ZDUSSCGKSA-N 0 0 366.377 3.531 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)c1cc(Br)cn1C ZINC000129459018 946193740 /nfs/dbraw/zinc/19/37/40/946193740.db2.gz KNHVMWNPVRCHOC-UHFFFAOYSA-N 0 0 352.188 3.565 20 5 FHBDRN CCN(C(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-])[C@H](C)C(F)(F)F ZINC000484638713 946200406 /nfs/dbraw/zinc/20/04/06/946200406.db2.gz FEPZGSSUEVABPC-MRVPVSSYSA-N 0 0 366.361 3.738 20 5 FHBDRN COc1cc(F)c([N+](=O)[O-])c(Sc2nnc(C(F)(F)F)s2)c1 ZINC000302483869 946233411 /nfs/dbraw/zinc/23/34/11/946233411.db2.gz HJGGTQYBOZDASJ-UHFFFAOYSA-N 0 0 355.294 3.764 20 5 FHBDRN CC[C@H](C)C(=O)Nc1cccc(CNC(=O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000045939806 946255042 /nfs/dbraw/zinc/25/50/42/946255042.db2.gz FVGLWXDAQCUVJX-ZDUSSCGKSA-N 0 0 355.394 3.509 20 5 FHBDRN CCCN(C[C@@H]1CCCCO1)C(=O)c1cccc(SC)c1[N+](=O)[O-] ZINC000186463021 946281653 /nfs/dbraw/zinc/28/16/53/946281653.db2.gz WMRDRIATTVVNQI-ZDUSSCGKSA-N 0 0 352.456 3.738 20 5 FHBDRN CC(C)Oc1ccccc1CC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088231679 946292309 /nfs/dbraw/zinc/29/23/09/946292309.db2.gz PVYNEIPYKVKELX-UHFFFAOYSA-N 0 0 354.406 3.509 20 5 FHBDRN O=[N+]([O-])c1ccc(CN2CCN(Cc3c(F)cccc3Cl)CC2)cc1 ZINC000018934302 946299381 /nfs/dbraw/zinc/29/93/81/946299381.db2.gz MGBPYHFYZOVMLV-UHFFFAOYSA-N 0 0 363.820 3.705 20 5 FHBDRN C[C@H]1CN2CCCC[C@@H]2CN1C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000408182667 946301846 /nfs/dbraw/zinc/30/18/46/946301846.db2.gz LIIKEDAYXZGWRK-SWLSCSKDSA-N 0 0 359.451 3.508 20 5 FHBDRN Cc1nn(CCc2nc(C34CC5CC(CC(C5)C3)C4)no2)c(C)c1[N+](=O)[O-] ZINC000109485437 946304531 /nfs/dbraw/zinc/30/45/31/946304531.db2.gz GKMGRZOLUNYIMM-UHFFFAOYSA-N 0 0 371.441 3.502 20 5 FHBDRN C[C@H](CCc1cccn1C)NC(=O)CCc1ccc([N+](=O)[O-])cc1Cl ZINC001126114523 946337188 /nfs/dbraw/zinc/33/71/88/946337188.db2.gz PSZBGNBAHYLYMP-CYBMUJFWSA-N 0 0 363.845 3.657 20 5 FHBDRN COc1ccc(Cc2noc(-c3ccc([N+](=O)[O-])cc3C)n2)cc1OC ZINC000109579110 946338284 /nfs/dbraw/zinc/33/82/84/946338284.db2.gz QBKMPCOCRXCJHW-UHFFFAOYSA-N 0 0 355.350 3.561 20 5 FHBDRN COc1ccc(Cc2noc(-c3ccc([N+](=O)[O-])c(C)c3)n2)cc1OC ZINC000109577402 946339058 /nfs/dbraw/zinc/33/90/58/946339058.db2.gz LDGCTXVKFZWQJP-UHFFFAOYSA-N 0 0 355.350 3.561 20 5 FHBDRN CCC[C@@H](C)NC(=O)[C@@H]1CCCN(c2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000109599391 946357588 /nfs/dbraw/zinc/35/75/88/946357588.db2.gz JNOODCRPQYLFEE-CHWSQXEVSA-N 0 0 353.850 3.769 20 5 FHBDRN CC(C)[C@H](NC(=O)CCc1cccc([N+](=O)[O-])c1)c1nc2ccccc2[nH]1 ZINC000087052125 946358207 /nfs/dbraw/zinc/35/82/07/946358207.db2.gz RKIPRQWDPUFAEJ-IBGZPJMESA-N 0 0 366.421 3.917 20 5 FHBDRN COc1ccc(Br)cc1NC(=O)c1ccc([N+](=O)[O-])s1 ZINC000226371412 946362638 /nfs/dbraw/zinc/36/26/38/946362638.db2.gz CBEBYBJKTGJTJF-UHFFFAOYSA-N 0 0 357.185 3.680 20 5 FHBDRN C[C@@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)c1nnc2n1CCC2 ZINC000237419828 946362584 /nfs/dbraw/zinc/36/25/84/946362584.db2.gz GYBYKROPKBEYRK-GFCCVEGCSA-N 0 0 369.450 3.712 20 5 FHBDRN C[C@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1)c1ccccc1OC(F)F ZINC000025789025 946364768 /nfs/dbraw/zinc/36/47/68/946364768.db2.gz YQVZEKVQHWPQAK-NSHDSACASA-N 0 0 350.321 3.616 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)Nc1nc(C(C)(C)C)cs1 ZINC000549558479 946376718 /nfs/dbraw/zinc/37/67/18/946376718.db2.gz HBDUOJBJIXCJHV-UHFFFAOYSA-N 0 0 364.427 3.679 20 5 FHBDRN Cc1nn([C@H](C)C(=O)N[C@@H](C)c2ccc3c(c2)CCCC3)c(C)c1[N+](=O)[O-] ZINC000111175319 946378424 /nfs/dbraw/zinc/37/84/24/946378424.db2.gz VNGHVUOICOZBHJ-SWLSCSKDSA-N 0 0 370.453 3.725 20 5 FHBDRN CCc1ccc(C(=O)N(C)Cc2nc(-c3ccccc3)c[nH]2)cc1[N+](=O)[O-] ZINC000121355911 946380163 /nfs/dbraw/zinc/38/01/63/946380163.db2.gz COMVOZOEFXSECR-UHFFFAOYSA-N 0 0 364.405 3.820 20 5 FHBDRN COc1cc(C(=O)Nc2cccc(C(C)(F)F)c2)cc([N+](=O)[O-])c1OC ZINC000444320203 946383325 /nfs/dbraw/zinc/38/33/25/946383325.db2.gz QOZMLVIIZYGMAZ-UHFFFAOYSA-N 0 0 366.320 3.976 20 5 FHBDRN CSc1cccc(C(=O)NC[C@@H]2CCOc3ccccc32)c1[N+](=O)[O-] ZINC000186475334 946391826 /nfs/dbraw/zinc/39/18/26/946391826.db2.gz UJGCKUOCSLYMFE-LBPRGKRZSA-N 0 0 358.419 3.613 20 5 FHBDRN COc1ccc(CN(C)C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000120893244 946394676 /nfs/dbraw/zinc/39/46/76/946394676.db2.gz VRWWVVINXWJRPZ-UHFFFAOYSA-N 0 0 371.437 3.768 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])c2ncccc12)C1(Oc2ccccc2F)CC1 ZINC000441301645 946396737 /nfs/dbraw/zinc/39/67/37/946396737.db2.gz KIUDRNAGZHBDME-UHFFFAOYSA-N 0 0 367.336 3.832 20 5 FHBDRN CC(C)(NC(=O)NCCCc1ccccc1F)c1ccc([N+](=O)[O-])cc1 ZINC000475478137 946399243 /nfs/dbraw/zinc/39/92/43/946399243.db2.gz BHFCFLBVVYLFKW-UHFFFAOYSA-N 0 0 359.401 3.901 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])o1)N1CCC[C@H](C(F)(F)F)[C@@H]1C(F)(F)F ZINC000456581138 946401534 /nfs/dbraw/zinc/40/15/34/946401534.db2.gz RUORYIGWSHKZCG-IMTBSYHQSA-N 0 0 360.210 3.533 20 5 FHBDRN CSc1cccc(C(=O)Nc2ncnc3oc(C)c(C)c32)c1[N+](=O)[O-] ZINC000186047822 946402876 /nfs/dbraw/zinc/40/28/76/946402876.db2.gz JCVZJPYJKFVQCF-UHFFFAOYSA-N 0 0 358.379 3.722 20 5 FHBDRN CSc1cccc(C(=O)N2C[C@H](c3ccccc3)OC[C@H]2C)c1[N+](=O)[O-] ZINC000186483113 946407882 /nfs/dbraw/zinc/40/78/82/946407882.db2.gz AOHDQMWVXNSCTL-CZUORRHYSA-N 0 0 372.446 3.919 20 5 FHBDRN CCN(C)C(=O)c1cccc(-c2nc(-c3ccc([N+](=O)[O-])cc3C)no2)c1 ZINC000545694632 946410188 /nfs/dbraw/zinc/41/01/88/946410188.db2.gz BSFIICPIKFHVHY-UHFFFAOYSA-N 0 0 366.377 3.712 20 5 FHBDRN Cc1cc(Br)ccc1NC(=O)NCc1ccccc1[N+](=O)[O-] ZINC000047742713 946426115 /nfs/dbraw/zinc/42/61/15/946426115.db2.gz DQWDQCINZNTAKT-UHFFFAOYSA-N 0 0 364.199 3.987 20 5 FHBDRN Cc1cccc(OCCCc2noc(-c3cc([N+](=O)[O-])cn3C)n2)c1C ZINC000545695578 946430114 /nfs/dbraw/zinc/43/01/14/946430114.db2.gz UOUYIXRNZNZMCA-UHFFFAOYSA-N 0 0 356.382 3.612 20 5 FHBDRN Cc1cc(C)cc(C[C@H](C)NC(=O)c2cc([N+](=O)[O-])c(N(C)C)cc2F)c1 ZINC001126600546 946438793 /nfs/dbraw/zinc/43/87/93/946438793.db2.gz PMGLEUYGHLFNMY-AWEZNQCLSA-N 0 0 373.428 3.778 20 5 FHBDRN COC(=O)[C@H](Cc1ccccc1)NCc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000475136210 946453727 /nfs/dbraw/zinc/45/37/27/946453727.db2.gz HMWSATIZSGJMNV-SFHVURJKSA-N 0 0 356.422 3.592 20 5 FHBDRN COC(=O)[C@H](C[C@@H]1CCCc2ccccc21)NCc1csc([N+](=O)[O-])c1 ZINC000475146825 946472911 /nfs/dbraw/zinc/47/29/11/946472911.db2.gz ZDRBRUVADUGIMC-RDJZCZTQSA-N 0 0 374.462 3.798 20 5 FHBDRN C/C(=C\C(=O)Nc1cc(-c2nnco2)ccc1C)c1ccc([N+](=O)[O-])cc1 ZINC000785290715 946483825 /nfs/dbraw/zinc/48/38/25/946483825.db2.gz DKMOTHZQUHJYCW-UKTHLTGXSA-N 0 0 364.361 3.995 20 5 FHBDRN CNc1ccc(C(=O)N(C)Cc2cc(C)c(OC)c(C)c2)cc1[N+](=O)[O-] ZINC000523087332 946484918 /nfs/dbraw/zinc/48/49/18/946484918.db2.gz AETPLFMTKDMQDX-UHFFFAOYSA-N 0 0 357.410 3.534 20 5 FHBDRN CCCN(CC1CCCCC1)C(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000111577083 946487569 /nfs/dbraw/zinc/48/75/69/946487569.db2.gz SKYIZMZCBSXKPX-UHFFFAOYSA-N 0 0 371.437 3.869 20 5 FHBDRN C[C@@H]1[C@@H](C(=O)N2CCCc3ccc([N+](=O)[O-])cc32)CCN1c1ccccc1 ZINC000475502830 946488934 /nfs/dbraw/zinc/48/89/34/946488934.db2.gz OZPPLHOJEHEXQE-BEFAXECRSA-N 0 0 365.433 3.789 20 5 FHBDRN O=C(CN(Cc1ccccc1)C1CC1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000025120894 946502879 /nfs/dbraw/zinc/50/28/79/946502879.db2.gz XXEWRVAJODMWFR-UHFFFAOYSA-N 0 0 359.813 3.851 20 5 FHBDRN CCOC(=O)c1cc(C(=O)NCC[C@@H]2CCCC[C@@H]2C)cc([N+](=O)[O-])c1 ZINC001126127448 946508022 /nfs/dbraw/zinc/50/80/22/946508022.db2.gz RQDXDQKWEVUWCT-KBPBESRZSA-N 0 0 362.426 3.718 20 5 FHBDRN CCOC(=O)c1cc(C(=O)NCC[C@H]2CCCC[C@H]2C)cc([N+](=O)[O-])c1 ZINC001126127452 946508328 /nfs/dbraw/zinc/50/83/28/946508328.db2.gz RQDXDQKWEVUWCT-ZIAGYGMSSA-N 0 0 362.426 3.718 20 5 FHBDRN CSc1cccc(C(=O)N2CCc3c2cc(F)cc3F)c1[N+](=O)[O-] ZINC000186153715 946517763 /nfs/dbraw/zinc/51/77/63/946517763.db2.gz AVUVDFSFHWCGET-UHFFFAOYSA-N 0 0 350.346 3.798 20 5 FHBDRN CC(C)[C@@H](CNC(=O)CCc1cccc([N+](=O)[O-])c1)Nc1ccccc1 ZINC000088281982 946546501 /nfs/dbraw/zinc/54/65/01/946546501.db2.gz IHOXPZDBGADMGC-LJQANCHMSA-N 0 0 355.438 3.780 20 5 FHBDRN Cc1csc([C@@H]2CCN(C(=O)NC[C@@H](C)c3ccccc3[N+](=O)[O-])C2)n1 ZINC000897049991 946549787 /nfs/dbraw/zinc/54/97/87/946549787.db2.gz LWYYEILBGDATGB-TZMCWYRMSA-N 0 0 374.466 3.662 20 5 FHBDRN Cc1ccc(NC(=O)C(C)C)cc1NC(=O)NCc1ccccc1[N+](=O)[O-] ZINC000048255017 946555288 /nfs/dbraw/zinc/55/52/88/946555288.db2.gz PKLANMOBPFZLNP-UHFFFAOYSA-N 0 0 370.409 3.819 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N(C)Cc1cnc(C(C)C)nc1 ZINC000441409131 946563949 /nfs/dbraw/zinc/56/39/49/946563949.db2.gz NNUPXGYGHHOVLQ-UHFFFAOYSA-N 0 0 362.817 3.742 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@H](c2cccc(Cl)c2)C1 ZINC000186184595 946588639 /nfs/dbraw/zinc/58/86/39/946588639.db2.gz YHQHSHXYGIANIG-QGZVFWFLSA-N 0 0 360.797 3.770 20 5 FHBDRN O=C(NCc1ccc(-n2ccnc2)c(F)c1)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000067523199 946593140 /nfs/dbraw/zinc/59/31/40/946593140.db2.gz ZFVWUEDCDWRHPB-UHFFFAOYSA-N 0 0 374.759 3.503 20 5 FHBDRN COc1ccc(/C=C\C(=O)N2c3ccc([N+](=O)[O-])cc3C[C@H]2C)cc1OC ZINC000728811222 946612847 /nfs/dbraw/zinc/61/28/47/946612847.db2.gz JJDCLFDJRGZSRS-WYOARUQKSA-N 0 0 368.389 3.603 20 5 FHBDRN CSc1cccc(C(=O)N2C[C@H](C)Oc3cc(F)ccc32)c1[N+](=O)[O-] ZINC000186584981 946614992 /nfs/dbraw/zinc/61/49/92/946614992.db2.gz PRYRHVICBAGHCC-JTQLQIEISA-N 0 0 362.382 3.884 20 5 FHBDRN Cc1cc(Cc2noc(/C=C/c3cnc4ccccc4n3)n2)ccc1[N+](=O)[O-] ZINC000545782598 946615399 /nfs/dbraw/zinc/61/53/99/946615399.db2.gz SJWSSPQUOUOJMV-VQHVLOKHSA-N 0 0 373.372 3.991 20 5 FHBDRN COc1cc(C(=O)N2CCC[C@]2(C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000186225123 946629701 /nfs/dbraw/zinc/62/97/01/946629701.db2.gz PSXIFYQMAYGOOW-HXUWFJFHSA-N 0 0 354.406 3.841 20 5 FHBDRN CC1(c2ccccc2)CCN(C(=O)COc2ccccc2[N+](=O)[O-])CC1 ZINC000151784344 946632505 /nfs/dbraw/zinc/63/25/05/946632505.db2.gz JOBDHQSQOZEUGT-UHFFFAOYSA-N 0 0 354.406 3.554 20 5 FHBDRN C[C@H](NC(=O)c1cc(Br)ccc1F)c1cccc([N+](=O)[O-])c1 ZINC000048383041 946634068 /nfs/dbraw/zinc/63/40/68/946634068.db2.gz CMBMPPALSBGZLW-VIFPVBQESA-N 0 0 367.174 3.987 20 5 FHBDRN CCO[C@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2SC)C12CCCC2 ZINC001126606225 946651879 /nfs/dbraw/zinc/65/18/79/946651879.db2.gz BSISSHUJIWXRFX-CVEARBPZSA-N 0 0 364.467 3.784 20 5 FHBDRN CC(C)OCc1ccccc1CNC(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000067536163 946674189 /nfs/dbraw/zinc/67/41/89/946674189.db2.gz AUYSEEIOILIIGS-UHFFFAOYSA-N 0 0 357.410 3.519 20 5 FHBDRN CCCOc1ccccc1NC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088341418 946676671 /nfs/dbraw/zinc/67/66/71/946676671.db2.gz VTHFORODYDOSRL-UHFFFAOYSA-N 0 0 355.394 3.974 20 5 FHBDRN C[C@@H](NC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2)c1cc2ccccc2o1 ZINC000027806264 946676826 /nfs/dbraw/zinc/67/68/26/946676826.db2.gz HBAADLSZLWMKTB-SNVBAGLBSA-N 0 0 354.318 3.561 20 5 FHBDRN CCO[C@H]1C[C@H](NC(=O)C2(c3ccc([N+](=O)[O-])cc3)CCC2)C12CCCC2 ZINC001126607373 946677990 /nfs/dbraw/zinc/67/79/90/946677990.db2.gz UEXZAUUDFCIIGG-ROUUACIJSA-N 0 0 372.465 3.871 20 5 FHBDRN Cc1nn(CC(=O)N[C@@H](C)c2ccc(Cl)cc2Cl)c(C)c1[N+](=O)[O-] ZINC000015997043 946682195 /nfs/dbraw/zinc/68/21/95/946682195.db2.gz IQXIFKJBZYKJDH-QMMMGPOBSA-N 0 0 371.224 3.592 20 5 FHBDRN CC(C)OC(=O)C[C@@H]1CCCN(Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000184452054 946697514 /nfs/dbraw/zinc/69/75/14/946697514.db2.gz GHJDVQYSRRMUFQ-ZDUSSCGKSA-N 0 0 354.834 3.802 20 5 FHBDRN COc1cc(OCC(=O)N[C@@H](C)c2cc(C)sc2C)ccc1[N+](=O)[O-] ZINC000121432602 946717762 /nfs/dbraw/zinc/71/77/62/946717762.db2.gz CIVFNUFWHOJXMR-NSHDSACASA-N 0 0 364.423 3.538 20 5 FHBDRN O=C(NCCOc1ccc([N+](=O)[O-])cc1)N[C@@H]1CCSc2ccccc21 ZINC000523106097 946766830 /nfs/dbraw/zinc/76/68/30/946766830.db2.gz PRZGCRAGGIUCPU-MRXNPFEDSA-N 0 0 373.434 3.510 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)N[C@H]1CCCc2c(F)cccc21 ZINC000458875286 946768161 /nfs/dbraw/zinc/76/81/61/946768161.db2.gz DYIBQYMIJSQZQQ-SFHVURJKSA-N 0 0 371.412 3.995 20 5 FHBDRN O=C(C1CCN(c2ccccc2[N+](=O)[O-])CC1)N1CCCc2ccccc21 ZINC000016023012 946778467 /nfs/dbraw/zinc/77/84/67/946778467.db2.gz DEVIHWJZZIJHHJ-UHFFFAOYSA-N 0 0 365.433 3.791 20 5 FHBDRN C[C@@H]1Cc2ccccc2N1C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000016022740 946778609 /nfs/dbraw/zinc/77/86/09/946778609.db2.gz IPHQRAVTKYUADI-OAHLLOKOSA-N 0 0 365.433 3.789 20 5 FHBDRN CC(C)CCc1noc(COc2ccc([N+](=O)[O-])cc2Br)n1 ZINC000523110064 946778546 /nfs/dbraw/zinc/77/85/46/946778546.db2.gz NCLQFGUNAHMFNW-UHFFFAOYSA-N 0 0 370.203 3.908 20 5 FHBDRN O=c1oc2ccc([N+](=O)[O-])cc2n1CCOc1cccc2ccccc21 ZINC000121456281 946786685 /nfs/dbraw/zinc/78/66/85/946786685.db2.gz CYAMWRJMGUGTQN-UHFFFAOYSA-N 0 0 350.330 3.735 20 5 FHBDRN CCOC(=O)c1ccnc(N(C)[C@H](C)c2c(F)cccc2F)c1[N+](=O)[O-] ZINC000523114964 946789987 /nfs/dbraw/zinc/78/99/87/946789987.db2.gz HKKYVPWXBAKUHY-SNVBAGLBSA-N 0 0 365.336 3.642 20 5 FHBDRN C[C@@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000475278421 946797098 /nfs/dbraw/zinc/79/70/98/946797098.db2.gz WARHBNODKHYXQT-ABAIWWIYSA-N 0 0 368.359 3.768 20 5 FHBDRN Cc1ccccc1[C@@H](NC(=O)C(=O)Nc1ccc(C)c([N+](=O)[O-])c1)C(C)C ZINC000112221722 946803155 /nfs/dbraw/zinc/80/31/55/946803155.db2.gz COWLWBQRWIGAJK-SFHVURJKSA-N 0 0 369.421 3.664 20 5 FHBDRN Cc1cc(=O)n(Cc2cc(Br)ccc2Cl)cc1[N+](=O)[O-] ZINC000128505969 946806730 /nfs/dbraw/zinc/80/67/30/946806730.db2.gz IEDXCMYMKGGYQT-UHFFFAOYSA-N 0 0 357.591 3.529 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N[C@H]1CCOc2ccc(F)cc21 ZINC000184480401 946832286 /nfs/dbraw/zinc/83/22/86/946832286.db2.gz YWVAGLXMQNJYHR-AWEZNQCLSA-N 0 0 359.357 3.996 20 5 FHBDRN O=C(/C=C/c1ccccc1F)O[C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000759928318 946850022 /nfs/dbraw/zinc/85/00/22/946850022.db2.gz ACUVHCQERLRTBD-UETGSQEOSA-N 0 0 359.357 3.671 20 5 FHBDRN CC[C@@H](C)[C@@H](C)N(C1CC1)S(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000729490454 946860164 /nfs/dbraw/zinc/86/01/64/946860164.db2.gz GZPMFCHIQAWFPL-GHMZBOCLSA-N 0 0 360.863 3.836 20 5 FHBDRN C[C@@H](c1cccc([N+](=O)[O-])c1)N(C)[C@@H]1CCN(c2ccccc2F)C1=O ZINC000112360105 946861966 /nfs/dbraw/zinc/86/19/66/946861966.db2.gz GQMDPXGIZDQCIT-SCLBCKFNSA-N 0 0 357.385 3.532 20 5 FHBDRN Cc1n[nH]cc1CNC(=O)c1ccc(SCCC(C)C)c([N+](=O)[O-])c1 ZINC000051382684 946872386 /nfs/dbraw/zinc/87/23/86/946872386.db2.gz YOMHIJNLVVIHDR-UHFFFAOYSA-N 0 0 362.455 3.695 20 5 FHBDRN CCOC(=O)c1cc(C(=O)Nc2cc3[nH]ccc3cc2C)cc([N+](=O)[O-])c1 ZINC000444458846 946894323 /nfs/dbraw/zinc/89/43/23/946894323.db2.gz WFZQORYNBQITCW-UHFFFAOYSA-N 0 0 367.361 3.814 20 5 FHBDRN CCC[C@@H](NC(=O)CCn1nc(C)c([N+](=O)[O-])c1C)C1CCCCC1 ZINC000112527252 946897328 /nfs/dbraw/zinc/89/73/28/946897328.db2.gz PUKBOTFDBFCWJL-MRXNPFEDSA-N 0 0 350.463 3.663 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](CC1CCCCC1)C1CC1 ZINC000053359862 946909150 /nfs/dbraw/zinc/90/91/50/946909150.db2.gz RCBCZDOWFULLCC-UHFFFAOYSA-N 0 0 361.442 3.587 20 5 FHBDRN O=C(c1cccc(Oc2ccncc2)c1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000112628380 946911101 /nfs/dbraw/zinc/91/11/01/946911101.db2.gz IEODGWILKWPXSM-UHFFFAOYSA-N 0 0 361.357 3.985 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1Oc1ncc(Br)cc1[N+](=O)[O-] ZINC000048760171 946917448 /nfs/dbraw/zinc/91/74/48/946917448.db2.gz SXMZRCWWECZRNY-UHFFFAOYSA-N 0 0 354.116 3.761 20 5 FHBDRN Cc1nn(CCC(=O)O[C@@H](C)c2ccc(Cl)s2)c(C)c1[N+](=O)[O-] ZINC000092489009 946919819 /nfs/dbraw/zinc/91/98/19/946919819.db2.gz KZHDYPHMUKJVIA-JTQLQIEISA-N 0 0 357.819 3.818 20 5 FHBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CC[C@H](C)[C@@H](C)C1 ZINC000550396385 946923910 /nfs/dbraw/zinc/92/39/10/946923910.db2.gz IAIZRRZRSKKPLW-UWVGGRQHSA-N 0 0 355.232 3.784 20 5 FHBDRN O=C(Cc1cc(F)c(F)cc1F)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186330041 946928485 /nfs/dbraw/zinc/92/84/85/946928485.db2.gz WSBLTDADAGTARE-UHFFFAOYSA-N 0 0 358.703 3.524 20 5 FHBDRN COC(=O)c1cc([N+](=O)[O-])c(NC[C@@H](C)c2nccs2)cc1Cl ZINC000302159556 946938586 /nfs/dbraw/zinc/93/85/86/946938586.db2.gz XQNLFLPUTBBOJC-MRVPVSSYSA-N 0 0 355.803 3.707 20 5 FHBDRN Cn1nc(-c2cc(F)cc(F)c2)cc1NC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000487467905 946942840 /nfs/dbraw/zinc/94/28/40/946942840.db2.gz WHHCQBOTNQYKID-UHFFFAOYSA-N 0 0 358.304 3.526 20 5 FHBDRN CC[C@@H](OC1CCCC1)C(=O)Nc1cc(C)nn1-c1ccc([N+](=O)[O-])cc1 ZINC000112782613 946952851 /nfs/dbraw/zinc/95/28/51/946952851.db2.gz KFLJAVCWUZSRSC-QGZVFWFLSA-N 0 0 372.425 3.765 20 5 FHBDRN CCOc1cc(C(=O)N[C@@H]2CC[C@H](C)C[C@@H]2C)c([N+](=O)[O-])cc1OC ZINC000112839007 946958391 /nfs/dbraw/zinc/95/83/91/946958391.db2.gz XRBAEJZUAWHREQ-SGMGOOAPSA-N 0 0 350.415 3.557 20 5 FHBDRN O=C(CSc1ccccc1[N+](=O)[O-])NCc1ccccc1OCC1CC1 ZINC000126762111 946959811 /nfs/dbraw/zinc/95/98/11/946959811.db2.gz LCTGGUSSXQWOET-UHFFFAOYSA-N 0 0 372.446 3.792 20 5 FHBDRN C[C@H](CNC(=O)c1ccc([N+](=O)[O-])n1C)c1c(Cl)cccc1Cl ZINC000523179996 946969578 /nfs/dbraw/zinc/96/95/78/946969578.db2.gz UJLZWDHVPYQHTB-SECBINFHSA-N 0 0 356.209 3.774 20 5 FHBDRN CCOC(C)(C)CNC(=O)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12 ZINC000444515672 946970477 /nfs/dbraw/zinc/97/04/77/946970477.db2.gz OZMILZFQAJEWNZ-UHFFFAOYSA-N 0 0 374.387 3.504 20 5 FHBDRN CCOc1cc(C(=O)Nc2cccc3[nH]ccc32)c([N+](=O)[O-])cc1OC ZINC000508498971 946983591 /nfs/dbraw/zinc/98/35/91/946983591.db2.gz SPSJESZQRLCWRB-UHFFFAOYSA-N 0 0 355.350 3.736 20 5 FHBDRN O=C(c1cc(Cl)c(F)c([N+](=O)[O-])c1)N1CCC[C@]2(CCSC2)C1 ZINC000909389165 946986855 /nfs/dbraw/zinc/98/68/55/946986855.db2.gz NCBHJPYRVLINIP-HNNXBMFYSA-N 0 0 358.822 3.747 20 5 FHBDRN Cc1c(NC(=O)C(=O)N[C@@H](CC(C)C)c2ccccc2)cccc1[N+](=O)[O-] ZINC000048976078 946989638 /nfs/dbraw/zinc/98/96/38/946989638.db2.gz YSGATYZJHNGJAW-KRWDZBQOSA-N 0 0 369.421 3.745 20 5 FHBDRN CC(C)n1cc2cc(NC(=O)NCc3ccccc3[N+](=O)[O-])ccc2n1 ZINC000475384707 946994003 /nfs/dbraw/zinc/99/40/03/946994003.db2.gz ZTYKTMIISXGXTQ-UHFFFAOYSA-N 0 0 353.382 3.847 20 5 FHBDRN O=[N+]([O-])c1c2cccnc2ccc1N1CC[C@@H](n2cnc3c2CCCC3)C1 ZINC000614735172 946996767 /nfs/dbraw/zinc/99/67/67/946996767.db2.gz JQFPGLLFUMCROM-CQSZACIVSA-N 0 0 363.421 3.670 20 5 FHBDRN COc1ccc(CNC(=O)[C@@H](C)c2cn(C)c3ccccc23)cc1[N+](=O)[O-] ZINC000475386417 947004402 /nfs/dbraw/zinc/00/44/02/947004402.db2.gz HNPCXDJWKBLTEG-ZDUSSCGKSA-N 0 0 367.405 3.515 20 5 FHBDRN Cc1nn(CCC(=O)N[C@H](c2ccccc2)C(C)(C)C)c(C)c1[N+](=O)[O-] ZINC000523224028 947006764 /nfs/dbraw/zinc/00/67/64/947006764.db2.gz HZZJJUQENNXFKW-GOSISDBHSA-N 0 0 358.442 3.702 20 5 FHBDRN CN(Cc1ncc[nH]1)C(=O)c1cc([N+](=O)[O-])ccc1SCC1CCCC1 ZINC000541662563 947008025 /nfs/dbraw/zinc/00/80/25/947008025.db2.gz FNMZCCKKBLPNSK-UHFFFAOYSA-N 0 0 374.466 3.872 20 5 FHBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CC3(CCC3)[C@H]2c2ccccc2)cc1 ZINC000432263631 947011380 /nfs/dbraw/zinc/01/13/80/947011380.db2.gz IDUIKVYJWCRBAM-QGZVFWFLSA-N 0 0 358.419 3.511 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)NCCc1ccc(Br)s1 ZINC000121476663 947019556 /nfs/dbraw/zinc/01/95/56/947019556.db2.gz DZXPXGZDOWVXGH-UHFFFAOYSA-N 0 0 369.240 3.700 20 5 FHBDRN Cc1ccc(S(=O)(=O)N2CC3(CCC3)[C@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000432268523 947022537 /nfs/dbraw/zinc/02/25/37/947022537.db2.gz OTLARAFBUHSHJN-GOSISDBHSA-N 0 0 372.446 3.819 20 5 FHBDRN CC(C)CCSc1ccc(C(=O)N2CC(C(C)(C)O)C2)cc1[N+](=O)[O-] ZINC000444584505 947026497 /nfs/dbraw/zinc/02/64/97/947026497.db2.gz WTIRGJRMXZNPNC-UHFFFAOYSA-N 0 0 366.483 3.576 20 5 FHBDRN CC(C)(C)c1nc2cc(NC(=O)C(C)(C)n3cc([N+](=O)[O-])cn3)ccc2o1 ZINC000523253271 947031853 /nfs/dbraw/zinc/03/18/53/947031853.db2.gz XWAJQMWPYKGWFR-UHFFFAOYSA-N 0 0 371.397 3.604 20 5 FHBDRN CNc1ccc(C(=O)N2CCS[C@@H](C)[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000609822748 947048069 /nfs/dbraw/zinc/04/80/69/947048069.db2.gz YJAGOAGFLKCKOJ-UGSOOPFHSA-N 0 0 371.462 3.955 20 5 FHBDRN CCOCc1cccc(NC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)c1 ZINC000523265119 947050408 /nfs/dbraw/zinc/05/04/08/947050408.db2.gz DBKZQKHOIYVISR-UHFFFAOYSA-N 0 0 366.377 3.569 20 5 FHBDRN Cc1nn(C)c(NCc2ccc(Br)cc2Cl)c1[N+](=O)[O-] ZINC000049320578 947051648 /nfs/dbraw/zinc/05/16/48/947051648.db2.gz HXZYHYHUPMVPLZ-UHFFFAOYSA-N 0 0 359.611 3.665 20 5 FHBDRN CCC[C@]1(C(=O)OCC)CCCN1C(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000444621859 947053212 /nfs/dbraw/zinc/05/32/12/947053212.db2.gz NIHDOMJZYNRZRB-QGZVFWFLSA-N 0 0 368.817 3.586 20 5 FHBDRN CC(C)(C(=O)N1CCc2c3ccccc3[nH]c2C1)c1ccc([N+](=O)[O-])cc1 ZINC000536291622 947058009 /nfs/dbraw/zinc/05/80/09/947058009.db2.gz UTWGCQDKQDJGOG-UHFFFAOYSA-N 0 0 363.417 3.939 20 5 FHBDRN O=C(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1cc2cc(Cl)ccc2[nH]1 ZINC000618265110 947060688 /nfs/dbraw/zinc/06/06/88/947060688.db2.gz MZNAZWKPYCKILK-UHFFFAOYSA-N 0 0 369.768 3.536 20 5 FHBDRN Cc1cc(C(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)c(Cl)cc1F ZINC000444630574 947061455 /nfs/dbraw/zinc/06/14/55/947061455.db2.gz HSSYCBXYAJTZBA-UHFFFAOYSA-N 0 0 362.748 3.502 20 5 FHBDRN COCCOc1cccc(/C=C2/C(=O)Nc3cc(Cl)c([N+](=O)[O-])cc32)c1 ZINC000125624561 947062930 /nfs/dbraw/zinc/06/29/30/947062930.db2.gz YMEOSNORAFZXCP-RIYZIHGNSA-N 0 0 374.780 3.766 20 5 FHBDRN Cc1ccc(S(=O)(=O)N(Cc2cccc(F)c2)C(C)C)cc1[N+](=O)[O-] ZINC000511939660 947063739 /nfs/dbraw/zinc/06/37/39/947063739.db2.gz PXQRYDPDELSPAQ-UHFFFAOYSA-N 0 0 366.414 3.642 20 5 FHBDRN O=C(COc1ccc(Br)cc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000088086711 947065995 /nfs/dbraw/zinc/06/59/95/947065995.db2.gz SEYYJNCCZLKGPY-UHFFFAOYSA-N 0 0 354.131 3.758 20 5 FHBDRN Cc1ccccc1[C@@H](C)CC(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444639760 947081629 /nfs/dbraw/zinc/08/16/29/947081629.db2.gz QFJHUPFRTIYPIW-ZDUSSCGKSA-N 0 0 352.394 3.590 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]c(CN(Cc3ccco3)Cc3cccnc3)nc2c1 ZINC000444673463 947098838 /nfs/dbraw/zinc/09/88/38/947098838.db2.gz MSQVRMRLJPKUSI-UHFFFAOYSA-N 0 0 363.377 3.662 20 5 FHBDRN CC[C@@H]1CN(c2ccccc2)CCN1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444677957 947100925 /nfs/dbraw/zinc/10/09/25/947100925.db2.gz XMMQGCFXASZCLK-OAHLLOKOSA-N 0 0 365.437 3.572 20 5 FHBDRN O=[N+]([O-])c1ccc(CSc2nnc(N3CCCCC3)n2C2CC2)cc1 ZINC000014897625 947115103 /nfs/dbraw/zinc/11/51/03/947115103.db2.gz JABYMNQWXNEHGI-UHFFFAOYSA-N 0 0 359.455 3.804 20 5 FHBDRN CC(C)(C)OC(=O)CCCCOC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000785314303 947129870 /nfs/dbraw/zinc/12/98/70/947129870.db2.gz JOESRUPQKGIMBI-UHFFFAOYSA-N 0 0 357.790 3.917 20 5 FHBDRN C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N(C)Cc1cc(Cl)ccc1F ZINC000444706757 947133572 /nfs/dbraw/zinc/13/35/72/947133572.db2.gz MVADTJWVLAPEHE-LLVKDONJSA-N 0 0 365.792 3.846 20 5 FHBDRN C[C@H]1CCN(C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)c2ccccc21 ZINC000049733113 947136367 /nfs/dbraw/zinc/13/63/67/947136367.db2.gz RABUFOGTYDECIY-AWEZNQCLSA-N 0 0 362.389 3.935 20 5 FHBDRN C[C@H]1CCCN(c2ccc(C(=O)NCCCC(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000440530409 947145201 /nfs/dbraw/zinc/14/52/01/947145201.db2.gz ACWZRROTHURGSK-LBPRGKRZSA-N 0 0 373.375 3.903 20 5 FHBDRN CCc1ccc([C@@H]2CN(Cc3nc4cc([N+](=O)[O-])ccc4[nH]3)CCO2)cc1 ZINC000444718948 947159535 /nfs/dbraw/zinc/15/95/35/947159535.db2.gz XFPRBLJCFYEXDS-IBGZPJMESA-N 0 0 366.421 3.607 20 5 FHBDRN CCc1ccc([C@H]2CN(Cc3nc4cc([N+](=O)[O-])ccc4[nH]3)CCO2)cc1 ZINC000444718949 947159773 /nfs/dbraw/zinc/15/97/73/947159773.db2.gz XFPRBLJCFYEXDS-LJQANCHMSA-N 0 0 366.421 3.607 20 5 FHBDRN CN(Cc1ccccc1C(F)(F)F)c1nc2sccn2c1[N+](=O)[O-] ZINC000301073882 947161918 /nfs/dbraw/zinc/16/19/18/947161918.db2.gz MTDIWANNTVBSDP-UHFFFAOYSA-N 0 0 356.329 3.959 20 5 FHBDRN O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1cccc2ncccc21 ZINC000121284309 947162405 /nfs/dbraw/zinc/16/24/05/947162405.db2.gz DIITWSVTBPSHJM-UHFFFAOYSA-N 0 0 359.288 3.997 20 5 FHBDRN CCCCNC(=O)[C@H](C)Sc1ccc(Br)cc1[N+](=O)[O-] ZINC000088501196 947179593 /nfs/dbraw/zinc/17/95/93/947179593.db2.gz NNIVEWGLCNHHMM-VIFPVBQESA-N 0 0 361.261 3.754 20 5 FHBDRN CC[C@H](C)NC(=O)[C@H](C)Sc1ccc(Br)cc1[N+](=O)[O-] ZINC000088501627 947181642 /nfs/dbraw/zinc/18/16/42/947181642.db2.gz LQZUBAVRFBGKSS-IUCAKERBSA-N 0 0 361.261 3.753 20 5 FHBDRN Cc1ccc(F)c(CN(C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)c1 ZINC000444744239 947182249 /nfs/dbraw/zinc/18/22/49/947182249.db2.gz ONIUCZMDPTUBHO-UHFFFAOYSA-N 0 0 356.357 3.724 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N(Cc1ccco1)Cc1cccnc1 ZINC000523385802 947208680 /nfs/dbraw/zinc/20/86/80/947208680.db2.gz OMYWMQBTAXBVKI-UHFFFAOYSA-N 0 0 351.362 3.734 20 5 FHBDRN Cc1nn(C)c(C(=O)N[C@@H](CC(C)C)c2ccc(Cl)cc2)c1[N+](=O)[O-] ZINC000121286338 947213582 /nfs/dbraw/zinc/21/35/82/947213582.db2.gz PNEBOPIHEPAHIC-AWEZNQCLSA-N 0 0 364.833 3.807 20 5 FHBDRN Cc1ccccc1[C@H]1C[C@@H](C)N(C(=O)NCc2ccccc2[N+](=O)[O-])C1 ZINC000523413353 947222354 /nfs/dbraw/zinc/22/23/54/947222354.db2.gz IDASKZJQQHKTGJ-WBVHZDCISA-N 0 0 353.422 3.991 20 5 FHBDRN CCCN(CC1CC1)C(=O)c1ccc(Cn2nc(C)c([N+](=O)[O-])c2C)cc1 ZINC000021197755 947234547 /nfs/dbraw/zinc/23/45/47/947234547.db2.gz RWLHLAIHDQGRTA-UHFFFAOYSA-N 0 0 370.453 3.719 20 5 FHBDRN O=C(Cc1cc2ccccc2o1)O[C@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1 ZINC000759929159 947237106 /nfs/dbraw/zinc/23/71/06/947237106.db2.gz FFXJZKYYCWWGHQ-RDJZCZTQSA-N 0 0 369.377 3.807 20 5 FHBDRN O=C(C1CC(F)(F)C1)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F ZINC000440567890 947239996 /nfs/dbraw/zinc/23/99/96/947239996.db2.gz IOCLSHPPKGORCP-UHFFFAOYSA-N 0 0 352.259 3.531 20 5 FHBDRN CC(C)(C)OC(=O)[C@H]1CCCCN1C(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000125389340 947241497 /nfs/dbraw/zinc/24/14/97/947241497.db2.gz WVFNKKNJLZEEGN-CQSZACIVSA-N 0 0 368.817 3.585 20 5 FHBDRN O=C(NCCc1cccc(F)c1)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000444826621 947242455 /nfs/dbraw/zinc/24/24/55/947242455.db2.gz GRWJKJHNFQUSLL-UHFFFAOYSA-N 0 0 360.388 3.793 20 5 FHBDRN CC[C@H](NS(=O)(=O)c1c(C)cccc1[N+](=O)[O-])c1ccc(F)cc1F ZINC000523416843 947247452 /nfs/dbraw/zinc/24/74/52/947247452.db2.gz FTZUZGFFXRXXBW-AWEZNQCLSA-N 0 0 370.377 3.611 20 5 FHBDRN Cc1ccc(C)c([C@@H](C)N(C)S(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC000523417614 947247988 /nfs/dbraw/zinc/24/79/88/947247988.db2.gz KEWFZVKPPJVVGL-OAHLLOKOSA-N 0 0 362.451 3.734 20 5 FHBDRN CC[C@H](C)[C@@H]1CCCCN1S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000523418421 947248634 /nfs/dbraw/zinc/24/86/34/947248634.db2.gz RJNGSUYJOXBZKI-AAEUAGOBSA-N 0 0 360.863 3.838 20 5 FHBDRN O=C(NCCCOc1ccccc1)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000444830860 947262516 /nfs/dbraw/zinc/26/25/16/947262516.db2.gz WJRSHSZBMYGROF-UHFFFAOYSA-N 0 0 372.424 3.880 20 5 FHBDRN O=C(NCCc1cccc(F)c1)c1sc(Br)cc1[N+](=O)[O-] ZINC000444830483 947263031 /nfs/dbraw/zinc/26/30/31/947263031.db2.gz SYAYKBJOQHIHRR-UHFFFAOYSA-N 0 0 373.203 3.530 20 5 FHBDRN CCOc1cccc(CCNC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)c1 ZINC000121299789 947271917 /nfs/dbraw/zinc/27/19/17/947271917.db2.gz NQIRLRDKRVZIIL-AWEZNQCLSA-N 0 0 374.462 3.833 20 5 FHBDRN Cc1cc(N2CCC[C@H](Nc3c(C)cc([N+](=O)[O-])cc3Cl)C2)n(C)n1 ZINC000444842058 947275790 /nfs/dbraw/zinc/27/57/90/947275790.db2.gz XMSQFQRTHOLYCD-ZDUSSCGKSA-N 0 0 363.849 3.679 20 5 FHBDRN CO[C@@H](CNC(=O)c1cccc2c(=O)c3ccccc3[nH]c12)c1ccccc1 ZINC000444843612 947277425 /nfs/dbraw/zinc/27/74/25/947277425.db2.gz BAEVNNHIBDDTHE-FQEVSTJZSA-N 0 0 372.424 3.799 20 5 FHBDRN CC[C@@](C)(O)CNC(=O)c1ccc(Sc2ccc(C)cc2)c([N+](=O)[O-])c1 ZINC000440581564 947288017 /nfs/dbraw/zinc/28/80/17/947288017.db2.gz WFCKNMNRSIWJMO-LJQANCHMSA-N 0 0 374.462 3.945 20 5 FHBDRN O=C(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)N[C@@H]1CC[C@H]2CCCC[C@H]2C1 ZINC000444873088 947298286 /nfs/dbraw/zinc/29/82/86/947298286.db2.gz JGMQTGDGMHQSCO-HZSPNIEDSA-N 0 0 371.441 3.629 20 5 FHBDRN CC(C)[C@@H]1CCCN(C(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000444364365 947299909 /nfs/dbraw/zinc/29/99/09/947299909.db2.gz MONHUOAXUHDCRG-CHWSQXEVSA-N 0 0 354.834 3.910 20 5 FHBDRN CCN(Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)Cc1ccc(C)cc1 ZINC000519918450 947300099 /nfs/dbraw/zinc/30/00/99/947300099.db2.gz RVAODPNASIYXSE-UHFFFAOYSA-N 0 0 352.394 3.975 20 5 FHBDRN C[C@H](C(=O)O[C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1)c1ccccc1F ZINC000759930622 947315385 /nfs/dbraw/zinc/31/53/85/947315385.db2.gz KBUHAQVZPQCNDY-MAZHCROVSA-N 0 0 361.373 3.761 20 5 FHBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)c1ccc(C(F)(F)F)cn1 ZINC000523497432 947315477 /nfs/dbraw/zinc/31/54/77/947315477.db2.gz DMMMZXKUHMBJHQ-UHFFFAOYSA-N 0 0 367.327 3.761 20 5 FHBDRN CC[C@@H](NC(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccc(C)cc1 ZINC000444888431 947315673 /nfs/dbraw/zinc/31/56/73/947315673.db2.gz QASXPLLQWWREKT-OAHLLOKOSA-N 0 0 367.409 3.730 20 5 FHBDRN C[C@H](NC(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccccc1Cl ZINC000444890127 947316006 /nfs/dbraw/zinc/31/60/06/947316006.db2.gz POAXBEVIXHDRGH-JTQLQIEISA-N 0 0 373.800 3.685 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NCc1ccccc1OC(C)C ZINC000444892088 947318020 /nfs/dbraw/zinc/31/80/20/947318020.db2.gz APOZCNIYADSKRP-UHFFFAOYSA-N 0 0 359.382 3.712 20 5 FHBDRN COc1cc(C)c(NC(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)cc1F ZINC000186423955 947320573 /nfs/dbraw/zinc/32/05/73/947320573.db2.gz NQQHBJYGUKBEJS-SNVBAGLBSA-N 0 0 350.321 3.932 20 5 FHBDRN Cc1ccc(NCCCNC(=O)[C@@H]2Cc3ccccc3S2)c([N+](=O)[O-])c1 ZINC000523511416 947323182 /nfs/dbraw/zinc/32/31/82/947323182.db2.gz FSQOFNZYCUYBOQ-SFHVURJKSA-N 0 0 371.462 3.538 20 5 FHBDRN COc1cc(C)sc1C(=O)NCCCNc1ccc(C)cc1[N+](=O)[O-] ZINC000523515770 947329140 /nfs/dbraw/zinc/32/91/40/947329140.db2.gz ZMPJGOMNVIQQEY-UHFFFAOYSA-N 0 0 363.439 3.514 20 5 FHBDRN CCOc1cccc([C@H]2C[C@H]2NC(=O)Nc2ccc([N+](=O)[O-])cc2OC)c1 ZINC000444919491 947338421 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351.775 3.508 20 5 FHBDRN CCc1cc(N2CC[C@H](OC)C[C@@H]2C)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000440669940 947560682 /nfs/dbraw/zinc/56/06/82/947560682.db2.gz FUVDEQWIJHVOBH-GUYCJALGSA-N 0 0 356.426 3.618 20 5 FHBDRN O=C(NC1CC1)c1cc(NCc2cccc([N+](=O)[O-])c2)nc2ccccc21 ZINC000067383844 947566619 /nfs/dbraw/zinc/56/66/19/947566619.db2.gz LUKRNEHDQJLMDT-UHFFFAOYSA-N 0 0 362.389 3.647 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])c1cc2ccc(Br)cc2[nH]1 ZINC000053866994 947570696 /nfs/dbraw/zinc/57/06/96/947570696.db2.gz KGDOMQSGNBSTEK-UHFFFAOYSA-N 0 0 374.194 3.769 20 5 FHBDRN Cc1c2ccccc2oc1[C@@H](C)NS(=O)(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000523757524 947574682 /nfs/dbraw/zinc/57/46/82/947574682.db2.gz NVXUGALIWAUIBF-CYBMUJFWSA-N 0 0 374.418 3.997 20 5 FHBDRN Cc1cc(S(=O)(=O)N2CCC[C@@H]2c2ccc(F)cc2)ccc1[N+](=O)[O-] ZINC000523757855 947576494 /nfs/dbraw/zinc/57/64/94/947576494.db2.gz AZTFZUXWHKXCIN-QGZVFWFLSA-N 0 0 364.398 3.568 20 5 FHBDRN COC(=O)c1cc(-c2nc(Cc3cc(C)cc(C)c3)no2)cc([N+](=O)[O-])c1 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360.435 3.853 20 5 FHBDRN Cc1cccc2c(CCC(=O)NCCc3ccc([N+](=O)[O-])cc3)c[nH]c21 ZINC000152083484 947621809 /nfs/dbraw/zinc/62/18/09/947621809.db2.gz ZAJXLABURHABOO-UHFFFAOYSA-N 0 0 351.406 3.676 20 5 FHBDRN O=C(Nc1ccc(F)cc1F)c1sc(Br)cc1[N+](=O)[O-] ZINC000445251446 947626035 /nfs/dbraw/zinc/62/60/35/947626035.db2.gz SHPCNXVCUFLFDP-UHFFFAOYSA-N 0 0 363.139 3.949 20 5 FHBDRN O=C(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)Nc1cccc(C(F)F)c1 ZINC000445242222 947638118 /nfs/dbraw/zinc/63/81/18/947638118.db2.gz JSCQEAAZJJVSMK-UHFFFAOYSA-N 0 0 361.308 3.730 20 5 FHBDRN C[C@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1cccc(C(F)(F)F)c1 ZINC000016088007 947643856 /nfs/dbraw/zinc/64/38/56/947643856.db2.gz FYERUJMIONIUGT-JTQLQIEISA-N 0 0 374.340 3.653 20 5 FHBDRN C[C@@H]1CCC[C@H](NC(=O)c2sc(Br)cc2[N+](=O)[O-])[C@H]1C ZINC000445248176 947644984 /nfs/dbraw/zinc/64/49/84/947644984.db2.gz IZEPGWCCWOLWLT-VGMNWLOBSA-N 0 0 361.261 3.973 20 5 FHBDRN Cc1ccc([C@H]2CSCCN2C(=O)COc2ccc([N+](=O)[O-])cc2)cc1 ZINC000523849033 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370.405 3.819 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2nc(-c3ccnc(OCC(F)(F)F)c3)no2)cc1 ZINC000546379772 947692702 /nfs/dbraw/zinc/69/27/02/947692702.db2.gz WWULZBPVTBRNLW-UHFFFAOYSA-N 0 0 366.255 3.648 20 5 FHBDRN O=C(NCCc1c[nH]c2cc(F)ccc12)c1c(Cl)cccc1[N+](=O)[O-] ZINC000136745050 947696515 /nfs/dbraw/zinc/69/65/15/947696515.db2.gz BRWITCXODOWUSI-UHFFFAOYSA-N 0 0 361.760 3.841 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1[C@@H]2CCO[C@H]2C12CCCC2 ZINC000248392351 947698474 /nfs/dbraw/zinc/69/84/74/947698474.db2.gz KIMJCHNZDBAWRB-QXCFHYIPSA-N 0 0 372.465 3.627 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CSc1ccc2c(c1)CCC2 ZINC000021515309 947703861 /nfs/dbraw/zinc/70/38/61/947703861.db2.gz BIUHIFIMILALJQ-UHFFFAOYSA-N 0 0 358.419 3.823 20 5 FHBDRN C[S@](=O)c1ccc(NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1 ZINC000137559882 947706056 /nfs/dbraw/zinc/70/60/56/947706056.db2.gz LZLWQVIKBDTMID-AREMUKBSSA-N 0 0 373.434 3.529 20 5 FHBDRN Cc1sc(NC(=O)c2ccc(C)cn2)nc1-c1cccc([N+](=O)[O-])c1 ZINC000125767633 947708938 /nfs/dbraw/zinc/70/89/38/947708938.db2.gz XAJMWGNIELWSQI-UHFFFAOYSA-N 0 0 354.391 3.982 20 5 FHBDRN CCOc1ccccc1[C@@H](CC)NC(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000523905709 947721315 /nfs/dbraw/zinc/72/13/15/947721315.db2.gz UPODQLVXJJNOEA-GOSISDBHSA-N 0 0 371.437 3.987 20 5 FHBDRN CC(C)(NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)c1cccs1 ZINC000523961009 947745703 /nfs/dbraw/zinc/74/57/03/947745703.db2.gz VCZVNDDNXWEHGF-UHFFFAOYSA-N 0 0 373.478 3.924 20 5 FHBDRN Cc1nn(CCC(=O)NC(C)(C)c2cccc(Cl)c2)c(C)c1[N+](=O)[O-] ZINC000121552301 947751986 /nfs/dbraw/zinc/75/19/86/947751986.db2.gz FEKIWFAZSQMMEW-UHFFFAOYSA-N 0 0 364.833 3.503 20 5 FHBDRN CCO[C@H]1C[C@@H](NC(=O)CCc2ccc([N+](=O)[O-])cc2Cl)C12CCC2 ZINC001126229279 947779488 /nfs/dbraw/zinc/77/94/88/947779488.db2.gz MFZHZOZMLIJQEF-CVEARBPZSA-N 0 0 366.845 3.645 20 5 FHBDRN C/C(=C\c1ccccn1)C(=O)N1CCS[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC001126234352 947793859 /nfs/dbraw/zinc/79/38/59/947793859.db2.gz LUHOKQNOKIOYNY-HHNLSAEISA-N 0 0 355.419 3.667 20 5 FHBDRN COc1ccc(CN(C)c2ccc([N+](=O)[O-])c3cnccc32)c(OC)c1 ZINC000015169405 947793935 /nfs/dbraw/zinc/79/39/35/947793935.db2.gz XHMWLVBVWLQLLL-UHFFFAOYSA-N 0 0 353.378 3.797 20 5 FHBDRN CC(C)(C)OC(=O)CCCCOC(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000785337447 947795339 /nfs/dbraw/zinc/79/53/39/947795339.db2.gz SNXZWRPNXRIKBV-UHFFFAOYSA-N 0 0 357.790 3.917 20 5 FHBDRN CC1(C)CO[C@H](CCC(=O)N2CCS[C@@H]2c2ccc([N+](=O)[O-])cc2)C1 ZINC001126235055 947800494 /nfs/dbraw/zinc/80/04/94/947800494.db2.gz UPIVSQKBYOIRTL-NVXWUHKLSA-N 0 0 364.467 3.764 20 5 FHBDRN O=C(O[C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)c1cc2c(s1)CCC2 ZINC000759942248 947811955 /nfs/dbraw/zinc/81/19/55/947811955.db2.gz QQZPEVPLJJDXDG-QWHCGFSZSA-N 0 0 361.423 3.682 20 5 FHBDRN CCCN(C(=O)c1cnn(-c2ccccc2)c1)c1cccc([N+](=O)[O-])c1 ZINC000441475301 947820054 /nfs/dbraw/zinc/82/00/54/947820054.db2.gz HQGYSUOQRHMSIR-UHFFFAOYSA-N 0 0 350.378 3.837 20 5 FHBDRN O=C(NC[C@@H]1CCCC1(F)F)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000459013478 947822990 /nfs/dbraw/zinc/82/29/90/947822990.db2.gz DNZSFKACWYKDLR-ZDUSSCGKSA-N 0 0 353.369 3.704 20 5 FHBDRN Cc1cccc(C)c1NC(=O)[C@H](C)OC(=O)/C=C\c1ccc([N+](=O)[O-])cc1 ZINC000728868508 947829530 /nfs/dbraw/zinc/82/95/30/947829530.db2.gz VETDRHDZOUWJNZ-LMRWQKIVSA-N 0 0 368.389 3.795 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)OCC(=O)Nc1cccc(C(C)C)c1 ZINC000725987760 947831738 /nfs/dbraw/zinc/83/17/38/947831738.db2.gz PDYOCXQYZVMCSB-UHFFFAOYSA-N 0 0 356.378 3.822 20 5 FHBDRN Cc1cc(C(=O)O[C@@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)c(F)cc1F ZINC000759943290 947843372 /nfs/dbraw/zinc/84/33/72/947843372.db2.gz QYQMGLWDERUCGQ-LSDHHAIUSA-N 0 0 365.336 3.719 20 5 FHBDRN COc1ccc([C@H]2CCCN2C(=O)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)nc1 ZINC000895067796 947864512 /nfs/dbraw/zinc/86/45/12/947864512.db2.gz VQSWFRWIGDPPRT-SCLBCKFNSA-N 0 0 370.409 3.606 20 5 FHBDRN Cc1ccc2[nH]c(CNc3ccc(C(=O)NC(C)C)cc3[N+](=O)[O-])nc2c1 ZINC000467007612 947865007 /nfs/dbraw/zinc/86/50/07/947865007.db2.gz RFBGYOWNRPNKKV-UHFFFAOYSA-N 0 0 367.409 3.530 20 5 FHBDRN COc1cc(CNc2c(Cl)cccc2[N+](=O)[O-])cc(OC)c1OC ZINC000432312441 947881762 /nfs/dbraw/zinc/88/17/62/947881762.db2.gz JKORIEPRLQQKSB-UHFFFAOYSA-N 0 0 352.774 3.886 20 5 FHBDRN COc1ccc(Br)c(OCc2ccc(OC)c([N+](=O)[O-])c2)c1 ZINC000432312145 947884002 /nfs/dbraw/zinc/88/40/02/947884002.db2.gz IJSRZWXTHCJZCG-UHFFFAOYSA-N 0 0 368.183 3.954 20 5 FHBDRN CCc1cc(N2CCC(Nc3c(Cl)cccc3[N+](=O)[O-])CC2)ncn1 ZINC000432313281 947909424 /nfs/dbraw/zinc/90/94/24/947909424.db2.gz MKPYJWFKIUPGLK-UHFFFAOYSA-N 0 0 361.833 3.682 20 5 FHBDRN C[C@@H](Nc1ccc([N+](=O)[O-])c(N)c1F)c1nc(C(F)(F)F)cs1 ZINC000278875783 947937711 /nfs/dbraw/zinc/93/77/11/947937711.db2.gz VSOFYQBWNOHQCY-RXMQYKEDSA-N 0 0 350.297 3.965 20 5 FHBDRN Cc1cc(C(=O)NC2CCC(C(=O)OC(C)(C)C)CC2)cc([N+](=O)[O-])c1 ZINC000094124309 947958660 /nfs/dbraw/zinc/95/86/60/947958660.db2.gz SBLVTROUHWJBSF-UHFFFAOYSA-N 0 0 362.426 3.534 20 5 FHBDRN Cc1cc(Cl)ccc1O[C@H](C)C(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000105267770 947963735 /nfs/dbraw/zinc/96/37/35/947963735.db2.gz VHPNGFGSLDFSGJ-GFCCVEGCSA-N 0 0 360.797 3.913 20 5 FHBDRN Cc1ccc([C@H](C)NCc2nc(Cc3cccc(F)c3)no2)cc1[N+](=O)[O-] ZINC000278882666 947967195 /nfs/dbraw/zinc/96/71/95/947967195.db2.gz PKUOYHFWEQQDDG-ZDUSSCGKSA-N 0 0 370.384 3.867 20 5 FHBDRN O=C(Nc1ccc2c(c1)CCO2)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000549609395 947969735 /nfs/dbraw/zinc/96/97/35/947969735.db2.gz OHECJZUGVXAZGJ-UHFFFAOYSA-N 0 0 352.268 3.801 20 5 FHBDRN CCc1nn(C)c(N2CCc3[nH]c4ccc(Cl)cc4c3C2)c1[N+](=O)[O-] ZINC000094139229 947977338 /nfs/dbraw/zinc/97/73/38/947977338.db2.gz QNKGDCKHPXMHSR-UHFFFAOYSA-N 0 0 359.817 3.588 20 5 FHBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N(C)Cc1ccc(F)c(Cl)c1 ZINC000432317852 947995104 /nfs/dbraw/zinc/99/51/04/947995104.db2.gz MMPWYOZTHXCKEY-UHFFFAOYSA-N 0 0 372.805 3.516 20 5 FHBDRN CCc1nn(C)c(NCc2sc(-c3ccccc3)nc2C)c1[N+](=O)[O-] ZINC000094154697 948018712 /nfs/dbraw/zinc/01/87/12/948018712.db2.gz RYGCNYAYGJXWRT-UHFFFAOYSA-N 0 0 357.439 3.935 20 5 FHBDRN CC[C@@H]1CCCN(C(=O)Cc2ccc([N+](=O)[O-])cc2Br)C1 ZINC000087101773 948026670 /nfs/dbraw/zinc/02/66/70/948026670.db2.gz LOGZFTBNUIGQAH-LLVKDONJSA-N 0 0 355.232 3.548 20 5 FHBDRN CC(C)CO[C@H](C)c1noc(COc2cc(Cl)ccc2[N+](=O)[O-])n1 ZINC000072920292 948040219 /nfs/dbraw/zinc/04/02/19/948040219.db2.gz MYXALTXUJCYGIX-SNVBAGLBSA-N 0 0 355.778 3.944 20 5 FHBDRN O=C(Nc1ccc(Br)c([N+](=O)[O-])c1)c1ccc(Cl)nc1 ZINC000094188522 948044049 /nfs/dbraw/zinc/04/40/49/948044049.db2.gz UUYNFXMYIPNOEW-UHFFFAOYSA-N 0 0 356.563 3.658 20 5 FHBDRN CN(CCC1CCCCC1)C(=O)c1cc([N+](=O)[O-])ccc1SCCO ZINC000136811076 948053163 /nfs/dbraw/zinc/05/31/63/948053163.db2.gz JJSRDTMMQSPDGT-UHFFFAOYSA-N 0 0 366.483 3.722 20 5 FHBDRN O=C1CCCN1Cc1cccc(CNc2c(Cl)cccc2[N+](=O)[O-])c1 ZINC000432326262 948073755 /nfs/dbraw/zinc/07/37/55/948073755.db2.gz BDPXWJYOZMZPPK-UHFFFAOYSA-N 0 0 359.813 3.983 20 5 FHBDRN O=C(Cc1cccc([N+](=O)[O-])c1)N1CCCCC[C@@H]1[C@H]1CCCCC1=O ZINC000164529010 948084223 /nfs/dbraw/zinc/08/42/23/948084223.db2.gz NGTMCPMAZRDHHP-QZTJIDSGSA-N 0 0 358.438 3.668 20 5 FHBDRN CCO[C@@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2Cl)C12CCCC2 ZINC000075357045 948089494 /nfs/dbraw/zinc/08/94/94/948089494.db2.gz FDWBAONFJNTMBY-HUUCEWRRSA-N 0 0 352.818 3.716 20 5 FHBDRN CCC[C@H](C)NC(=O)[C@H]1CCCN(c2ccnc3c2cccc3[N+](=O)[O-])C1 ZINC000432330669 948092816 /nfs/dbraw/zinc/09/28/16/948092816.db2.gz DJGPRBJAKCMNFX-GJZGRUSLSA-N 0 0 370.453 3.664 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(NC(=O)NC)c1 ZINC000184661761 948103593 /nfs/dbraw/zinc/10/35/93/948103593.db2.gz FLYJNWWVZQCZDK-CQSZACIVSA-N 0 0 370.409 3.554 20 5 FHBDRN O=[N+]([O-])c1cccc2c(NCc3ccc(Cn4cccn4)cc3)ccnc21 ZINC000432330986 948111388 /nfs/dbraw/zinc/11/13/88/948111388.db2.gz HVSCZYIXNVKWKN-UHFFFAOYSA-N 0 0 359.389 4.000 20 5 FHBDRN C[C@H]1COCCN1C(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000454802606 948119106 /nfs/dbraw/zinc/11/91/06/948119106.db2.gz CYLLJSOMYKXHQO-ZDUSSCGKSA-N 0 0 357.366 3.640 20 5 FHBDRN O=C(CCc1ccccc1F)O[C@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1 ZINC000759947804 948135513 /nfs/dbraw/zinc/13/55/13/948135513.db2.gz XBLMPXLDHSYYMF-HOTGVXAUSA-N 0 0 361.373 3.590 20 5 FHBDRN O=[N+]([O-])c1cccc2c(NCc3ccccc3Cn3cccn3)ccnc21 ZINC000432335153 948144472 /nfs/dbraw/zinc/14/44/72/948144472.db2.gz IYGNZYOJVKZHCO-UHFFFAOYSA-N 0 0 359.389 4.000 20 5 FHBDRN CC(C)(C)OC(=O)CCCCOC(=O)c1cccc(Cl)c1[N+](=O)[O-] ZINC000785365393 948150428 /nfs/dbraw/zinc/15/04/28/948150428.db2.gz XCCASVPNQGFTSR-UHFFFAOYSA-N 0 0 357.790 3.917 20 5 FHBDRN O=[N+]([O-])c1cccc2c(N[C@@H]3CCOC4(CCSCC4)C3)ccnc21 ZINC000432340746 948158865 /nfs/dbraw/zinc/15/88/65/948158865.db2.gz OVIWHBMHFBEYKR-CYBMUJFWSA-N 0 0 359.451 4.000 20 5 FHBDRN CCO[C@@H]1CCCC[C@H]1NC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000459104005 948160294 /nfs/dbraw/zinc/16/02/94/948160294.db2.gz UWPLWXBBZDKHMA-QZTJIDSGSA-N 0 0 361.442 3.617 20 5 FHBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N[C@H](C)c1cccnc1 ZINC000585695657 948160797 /nfs/dbraw/zinc/16/07/97/948160797.db2.gz OONDOFOIEFZMRX-SNVBAGLBSA-N 0 0 364.199 3.552 20 5 FHBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)NCc1ccc(Cl)o1 ZINC000585696913 948164401 /nfs/dbraw/zinc/16/44/01/948164401.db2.gz SBXIIDNZHXLFSB-UHFFFAOYSA-N 0 0 373.590 3.842 20 5 FHBDRN CCOc1ccccc1OCCCC(=O)Nc1ccc(OC)cc1[N+](=O)[O-] ZINC000019160099 948164637 /nfs/dbraw/zinc/16/46/37/948164637.db2.gz ZJLQDCLVWGBQMK-UHFFFAOYSA-N 0 0 374.393 3.800 20 5 FHBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CCC[C@H]1C1CC1 ZINC000585698451 948170671 /nfs/dbraw/zinc/17/06/71/948170671.db2.gz FXINJLAQAAMBEI-AWEZNQCLSA-N 0 0 353.216 3.680 20 5 FHBDRN C[C@@H](NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)C1CC1 ZINC000053084451 948173170 /nfs/dbraw/zinc/17/31/70/948173170.db2.gz PNSOVRJETMVQIH-OLZOCXBDSA-N 0 0 354.410 3.691 20 5 FHBDRN O=C(NCc1coc(-c2ccccc2)n1)[C@@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1 ZINC001126298610 948205077 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3.594 20 5 FHBDRN C[C@H]1C[C@H](C)CN(c2ccc(C(=O)Nc3cccnc3F)cc2[N+](=O)[O-])C1 ZINC000843691469 948283024 /nfs/dbraw/zinc/28/30/24/948283024.db2.gz LKWLVWFPQXVIBL-STQMWFEESA-N 0 0 372.400 3.864 20 5 FHBDRN Cc1ccc(-c2nc(C(=O)Oc3ccc(C)cc3[N+](=O)[O-])cs2)n1C ZINC000136844740 948286514 /nfs/dbraw/zinc/28/65/14/948286514.db2.gz IXLRHGVDYBKWTP-UHFFFAOYSA-N 0 0 357.391 3.893 20 5 FHBDRN O=C(OCc1cn2ccccc2n1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000178532872 948292588 /nfs/dbraw/zinc/29/25/88/948292588.db2.gz DXGMDMVXVUZEGF-UHFFFAOYSA-N 0 0 365.267 3.618 20 5 FHBDRN O=C(N[C@H](Cc1ccccc1)C1CC1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000087117932 948295868 /nfs/dbraw/zinc/29/58/68/948295868.db2.gz HMEGSRAVUUXKIS-HXUWFJFHSA-N 0 0 365.433 3.684 20 5 FHBDRN CC(C)[C@@H](CC(F)(F)F)NC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000438597343 948296136 /nfs/dbraw/zinc/29/61/36/948296136.db2.gz MTZOQHAOWIBJEZ-CYBMUJFWSA-N 0 0 371.315 3.555 20 5 FHBDRN COc1ccc(C2=N/C(=C/c3ccc(Cl)cc3)C(=O)O2)cc1[N+](=O)[O-] ZINC000006174594 948301333 /nfs/dbraw/zinc/30/13/33/948301333.db2.gz PJUQWLHIXICAOU-MDWZMJQESA-N 0 0 358.737 3.601 20 5 FHBDRN CCc1ccc([C@@H]([NH2+][C@H]2CC[C@@H](CO)CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000585794110 948301686 /nfs/dbraw/zinc/30/16/86/948301686.db2.gz FFCNUAFNQRRGMP-NBQZKYEYSA-N 0 0 358.438 3.980 20 5 FHBDRN CNc1ccc(C(=O)Nc2ccc3nc(N(C)C)ccc3c2)cc1[N+](=O)[O-] ZINC000520565195 948302127 /nfs/dbraw/zinc/30/21/27/948302127.db2.gz QWODDXMAKRXJSX-UHFFFAOYSA-N 0 0 365.393 3.503 20 5 FHBDRN C[C@H](Nc1ccc(C(=O)N(C)CC2CC2)cc1[N+](=O)[O-])c1ccccn1 ZINC000054097068 948323267 /nfs/dbraw/zinc/32/32/67/948323267.db2.gz JASKYNNMGHFWTP-ZDUSSCGKSA-N 0 0 354.410 3.645 20 5 FHBDRN Cc1cc(C(=O)N[C@H](C)c2cccc(C(F)(F)F)c2)c(N)c([N+](=O)[O-])c1 ZINC000729511386 948330194 /nfs/dbraw/zinc/33/01/94/948330194.db2.gz NUESONGGHAXHGQ-SNVBAGLBSA-N 0 0 367.327 3.995 20 5 FHBDRN COc1ccc2c(c1)C(=O)N(C1CC1)[C@H](/C=C/c1ccccc1[N+](=O)[O-])N2 ZINC000106899981 948341342 /nfs/dbraw/zinc/34/13/42/948341342.db2.gz SHLPAQGBIIAXKQ-SSGOSMAHSA-N 0 0 365.389 3.673 20 5 FHBDRN Cc1cc(NCc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)nnc1C ZINC000432411144 948356891 /nfs/dbraw/zinc/35/68/91/948356891.db2.gz VWMYGBPODQIIDQ-UHFFFAOYSA-N 0 0 368.368 3.967 20 5 FHBDRN O=C(NCC[C@@H]1CCCS1(=O)=O)c1c2ccccc2cc2ccccc21 ZINC000893634742 948359205 /nfs/dbraw/zinc/35/92/05/948359205.db2.gz APJAWNQTJDNTAF-KRWDZBQOSA-N 0 0 367.470 3.690 20 5 FHBDRN CCOC(=O)c1cc(NC[C@@H]2CCCO[C@H]2C(C)C)ccc1[N+](=O)[O-] ZINC000467787754 948362891 /nfs/dbraw/zinc/36/28/91/948362891.db2.gz LJFFNIMKZWZHJV-GUYCJALGSA-N 0 0 350.415 3.635 20 5 FHBDRN CC(C)CC(=O)Nc1ccc(NC(=O)Cc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000126836777 948375390 /nfs/dbraw/zinc/37/53/90/948375390.db2.gz ADCCIWKCTCDIRQ-UHFFFAOYSA-N 0 0 373.384 3.900 20 5 FHBDRN CC(C)(C(=O)Nc1ccc(N2CCCCC2)cn1)c1ccccc1[N+](=O)[O-] ZINC000432418124 948378056 /nfs/dbraw/zinc/37/80/56/948378056.db2.gz QCRUCVZTLJSYRC-UHFFFAOYSA-N 0 0 368.437 3.896 20 5 FHBDRN C[C@H](CC(C)(C)c1ccccc1)NC(=O)COc1cccc([N+](=O)[O-])c1 ZINC000520614434 948397076 /nfs/dbraw/zinc/39/70/76/948397076.db2.gz LYYITEFXYVIPNV-OAHLLOKOSA-N 0 0 356.422 3.846 20 5 FHBDRN CC(C)Oc1cc(O)ccc1NC(=O)c1c[nH]c2cccc([N+](=O)[O-])c21 ZINC000432439819 948423774 /nfs/dbraw/zinc/42/37/74/948423774.db2.gz CHGKEHHZPMVJNS-UHFFFAOYSA-N 0 0 355.350 3.821 20 5 FHBDRN Cc1ccc(CCNC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000512106200 948438713 /nfs/dbraw/zinc/43/87/13/948438713.db2.gz ONAGQVRSNPOJGE-UHFFFAOYSA-N 0 0 355.438 3.638 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)N(C)[C@@H](c2ccccc2Cl)C(C)C)n1 ZINC000427610926 948442037 /nfs/dbraw/zinc/44/20/37/948442037.db2.gz WZEPNXBYASEEDM-MRXNPFEDSA-N 0 0 364.833 3.934 20 5 FHBDRN CCS(=O)(=O)Cc1ccc(N[C@H]2CCc3c2cccc3[N+](=O)[O-])cc1 ZINC000574772049 948447559 /nfs/dbraw/zinc/44/75/59/948447559.db2.gz XGMMBVISXSAGQQ-KRWDZBQOSA-N 0 0 360.435 3.629 20 5 FHBDRN Cc1oc(-c2ccccc2F)nc1C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000125986297 948456087 /nfs/dbraw/zinc/45/60/87/948456087.db2.gz LXDYBFWQUHATQZ-UHFFFAOYSA-N 0 0 369.352 3.670 20 5 FHBDRN O=C(Nc1ccc(Br)cc1O)c1ccc([N+](=O)[O-])cc1Cl ZINC000125985363 948457186 /nfs/dbraw/zinc/45/71/86/948457186.db2.gz PQYUBKGOEZRMPG-UHFFFAOYSA-N 0 0 371.574 3.969 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)cc(Cl)c1N1CCN(c2ccc(F)cn2)CC1 ZINC000520630980 948460929 /nfs/dbraw/zinc/46/09/29/948460929.db2.gz ISKDGBOISSVXKM-UHFFFAOYSA-N 0 0 371.199 3.762 20 5 FHBDRN COc1ccc([C@@H](C)NC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000512122997 948483206 /nfs/dbraw/zinc/48/32/06/948483206.db2.gz NRTZFRLRBAIHTJ-CQSZACIVSA-N 0 0 357.410 3.549 20 5 FHBDRN Cc1cccc(OC[C@H](C)NC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000512123115 948486320 /nfs/dbraw/zinc/48/63/20/948486320.db2.gz PAZBYODMENBIIU-INIZCTEOSA-N 0 0 371.437 3.555 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)c1nnc([C@@H]2CCCO2)n1C1CC1 ZINC000570976699 948495913 /nfs/dbraw/zinc/49/59/13/948495913.db2.gz GIBSSRXCIISWBC-KRWDZBQOSA-N 0 0 371.441 3.788 20 5 FHBDRN C[C@@H](Cc1ccccc1F)NC(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000512131075 948506361 /nfs/dbraw/zinc/50/63/61/948506361.db2.gz NEHLPBWCHGDLQE-AWEZNQCLSA-N 0 0 359.401 3.549 20 5 FHBDRN O=[N+]([O-])c1ccc(NCCCOC2CCOCC2)nc1-c1ccccc1 ZINC000090095143 948520405 /nfs/dbraw/zinc/52/04/05/948520405.db2.gz RQLCRKPGECLDDM-UHFFFAOYSA-N 0 0 357.410 3.654 20 5 FHBDRN CC(C)Oc1cc(O)ccc1NC(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000432471333 948521514 /nfs/dbraw/zinc/52/15/14/948521514.db2.gz ALMDFEJYJRQUQT-UHFFFAOYSA-N 0 0 362.407 3.818 20 5 FHBDRN COC(=O)COc1ccc(CNc2cccc(C(F)F)c2)cc1[N+](=O)[O-] ZINC000474002785 948537045 /nfs/dbraw/zinc/53/70/45/948537045.db2.gz YGEGQDYRLWVKGQ-UHFFFAOYSA-N 0 0 366.320 3.696 20 5 FHBDRN COc1cc(NS(=O)(=O)c2cc(C)cc([N+](=O)[O-])c2C)ccc1Cl ZINC000432479115 948545033 /nfs/dbraw/zinc/54/50/33/948545033.db2.gz RDCUVOCDITZWRG-UHFFFAOYSA-N 0 0 370.814 3.674 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCC[C@@H]2C2CCCC2)c(F)c1N1CCOCC1 ZINC000574842689 948566662 /nfs/dbraw/zinc/56/66/62/948566662.db2.gz HZHOSQJNXDVSKU-OAHLLOKOSA-N 0 0 363.433 3.730 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)O[C@@H]([C@H]1CCCOC1)C(F)(F)F ZINC000279195113 948599578 /nfs/dbraw/zinc/59/95/78/948599578.db2.gz KAGIGDYKYQFPGI-QLYMSINSSA-N 0 0 373.327 3.899 20 5 FHBDRN O=c1[nH]c2cccc(NCc3cc([N+](=O)[O-])ccc3OC(F)F)c2o1 ZINC000571334132 948609108 /nfs/dbraw/zinc/60/91/08/948609108.db2.gz KGUHENRBGKNCGJ-UHFFFAOYSA-N 0 0 351.265 3.655 20 5 FHBDRN C[C@]12CCN(Cc3cccc([N+](=O)[O-])c3Br)C[C@H]1C2(F)F ZINC000839604659 948647994 /nfs/dbraw/zinc/64/79/94/948647994.db2.gz OLIAAAYULRAMAW-YPMHNXCESA-N 0 0 361.186 3.834 20 5 FHBDRN Cc1c(NC(=O)[C@@H]2CCC(=O)C[C@@H]2C)cc(Br)cc1[N+](=O)[O-] ZINC000280840653 948652013 /nfs/dbraw/zinc/65/20/13/948652013.db2.gz YSOCLWXSDJPTQG-QPUJVOFHSA-N 0 0 369.215 3.610 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N[C@@]1(CO)CCCc2ccccc21 ZINC000441754817 948732024 /nfs/dbraw/zinc/73/20/24/948732024.db2.gz BJAJWMRHLQIKAD-HXUWFJFHSA-N 0 0 369.421 3.557 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1Cc1ccccc1)c1nccs1 ZINC000447307650 948732519 /nfs/dbraw/zinc/73/25/19/948732519.db2.gz WJICPOFKMPRVAG-UHFFFAOYSA-N 0 0 354.387 3.904 20 5 FHBDRN C[C@H](Cc1cccc(O)c1)NC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000427631751 948733623 /nfs/dbraw/zinc/73/36/23/948733623.db2.gz SMHMDKXGOVMYQA-SNVBAGLBSA-N 0 0 368.311 3.680 20 5 FHBDRN CCc1nc(CCNc2cc(C)c([N+](=O)[O-])c(C(=O)OC)c2)sc1C ZINC000440737214 948743784 /nfs/dbraw/zinc/74/37/84/948743784.db2.gz BPLCLJJFUTWUQO-UHFFFAOYSA-N 0 0 363.439 3.672 20 5 FHBDRN C[C@@H](C(=O)N[C@@H](C(C)(C)C)C(F)(F)F)c1ccc([N+](=O)[O-])cc1F ZINC000544400642 948762610 /nfs/dbraw/zinc/76/26/10/948762610.db2.gz YFWMXSUYYFZFMO-OQPBUACISA-N 0 0 350.312 3.931 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)c1c(C)onc1-c1cccnc1 ZINC000464718586 948790448 /nfs/dbraw/zinc/79/04/48/948790448.db2.gz DGSAUCBFBAYGNE-UHFFFAOYSA-N 0 0 352.350 3.768 20 5 FHBDRN CC[C@@H]1CCCCN1C(=O)[C@@H](C)OC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000021612211 948819080 /nfs/dbraw/zinc/81/90/80/948819080.db2.gz WDSPBDFGHIHMLT-DGCLKSJQSA-N 0 0 368.817 3.585 20 5 FHBDRN Cc1cn(-c2ccccc2)nc1C(=O)Nc1cc([N+](=O)[O-])c(C)cc1C ZINC000184820976 948823418 /nfs/dbraw/zinc/82/34/18/948823418.db2.gz AOICKDCHQOURDE-UHFFFAOYSA-N 0 0 350.378 3.958 20 5 FHBDRN Cc1cccc(C(=O)NCc2cc(Br)cs2)c1[N+](=O)[O-] ZINC000046255424 209328018 /nfs/dbraw/zinc/32/80/18/209328018.db2.gz BYUHMZLJJCJOKY-UHFFFAOYSA-N 0 0 355.213 3.657 20 5 FHBDRN COc1ccccc1SCC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000109263676 209301604 /nfs/dbraw/zinc/30/16/04/209301604.db2.gz AXGMTTNHYASUDZ-UHFFFAOYSA-N 0 0 352.799 3.988 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@@H](C)c1ccc(Cl)cc1Cl ZINC000109188915 209300233 /nfs/dbraw/zinc/30/02/33/209300233.db2.gz NKBVVOLAVIUJRX-VIFPVBQESA-N 0 0 371.224 3.674 20 5 FHBDRN O=C(COc1cccc([N+](=O)[O-])c1)Nc1ccccc1NCC(F)(F)F ZINC000109018036 209295411 /nfs/dbraw/zinc/29/54/11/209295411.db2.gz KSPLKRNSKMQPRK-UHFFFAOYSA-N 0 0 369.299 3.587 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N[C@H](C)c1cccc(Cl)c1 ZINC000108404248 209287548 /nfs/dbraw/zinc/28/75/48/209287548.db2.gz CTQNZFUFVGUDDO-LLVKDONJSA-N 0 0 354.815 3.596 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)Oc1ccc(F)cc1Cl ZINC000011028152 207308539 /nfs/dbraw/zinc/30/85/39/207308539.db2.gz SKCHRCILOVBMLA-VIFPVBQESA-N 0 0 368.748 3.802 20 5 FHBDRN C[C@@H](Oc1cccnc1[N+](=O)[O-])C(=O)Nc1cc(Cl)ccc1Cl ZINC000020982097 207757672 /nfs/dbraw/zinc/75/76/72/207757672.db2.gz QAOGCYFLWHGDGV-MRVPVSSYSA-N 0 0 356.165 3.703 20 5 FHBDRN C[C@H](Cc1cccs1)NC(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000037985729 207795407 /nfs/dbraw/zinc/79/54/07/207795407.db2.gz SBYQGEOOUODPOL-SECBINFHSA-N 0 0 369.240 3.780 20 5 FHBDRN Cc1cccc(C(=O)Nc2nc(CN3CCC(C)CC3)cs2)c1[N+](=O)[O-] ZINC000036652200 208169651 /nfs/dbraw/zinc/16/96/51/208169651.db2.gz YDEHEPIOMKXWBK-UHFFFAOYSA-N 0 0 374.466 3.844 20 5 FHBDRN CCOc1cccc2c1OCC(C(=O)Nc1cc([N+](=O)[O-])ccc1C)=C2 ZINC000042390978 208290816 /nfs/dbraw/zinc/29/08/16/208290816.db2.gz LJDFOHXGWWYNPP-UHFFFAOYSA-N 0 0 354.362 3.716 20 5 FHBDRN CC(=O)Nc1cccc([C@H](C)NC(=O)Nc2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000043147832 208303504 /nfs/dbraw/zinc/30/35/04/208303504.db2.gz KYUDUIFNXPTWQQ-LBPRGKRZSA-N 0 0 356.382 3.744 20 5 FHBDRN CCC(=O)Nc1ccc(NC(=O)c2cc(SC)ccc2[N+](=O)[O-])cc1 ZINC000044794721 208318130 /nfs/dbraw/zinc/31/81/30/208318130.db2.gz HHKZDTLMCKVSPX-UHFFFAOYSA-N 0 0 359.407 3.918 20 5 FHBDRN O=c1oc2ccc([N+](=O)[O-])cc2n1CCOc1ccc2ccccc2c1 ZINC000047439071 208378120 /nfs/dbraw/zinc/37/81/20/208378120.db2.gz OOGYMARLZVIASS-UHFFFAOYSA-N 0 0 350.330 3.735 20 5 FHBDRN O=C(c1cc(-c2ccccc2F)on1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000047587478 208383645 /nfs/dbraw/zinc/38/36/45/208383645.db2.gz HMKKUJZRORJLRL-UHFFFAOYSA-N 0 0 353.309 3.592 20 5 FHBDRN CC(C)C(=O)Nc1cccc(NC(=O)CCOc2ccccc2[N+](=O)[O-])c1 ZINC000055281057 208472001 /nfs/dbraw/zinc/47/20/01/208472001.db2.gz YEHJQYCQHDBJGN-UHFFFAOYSA-N 0 0 371.393 3.597 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])c1[nH]c2ccccc2c1Br ZINC000058388162 208582256 /nfs/dbraw/zinc/58/22/56/208582256.db2.gz WMEBNOHKHDNYAX-UHFFFAOYSA-N 0 0 374.194 3.769 20 5 FHBDRN CCOc1ccc(CN2CCN(c3ccc([N+](=O)[O-])c(C)c3)CC2)cc1 ZINC000108100648 132242784 /nfs/dbraw/zinc/24/27/84/132242784.db2.gz VINOCVLXXJVHRH-UHFFFAOYSA-N 0 0 355.438 3.624 20 5 FHBDRN CCCN(C)C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000109401562 132245148 /nfs/dbraw/zinc/24/51/48/132245148.db2.gz BXPYOKFQOZDDEI-UHFFFAOYSA-N 0 0 373.375 3.698 20 5 FHBDRN Cc1ccc(C(=O)N2CCN(c3ccc([N+](=O)[O-])cc3Cl)CC2)s1 ZINC000054838639 132303283 /nfs/dbraw/zinc/30/32/83/132303283.db2.gz INOGEYUURHNFRW-UHFFFAOYSA-N 0 0 365.842 3.581 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCN(c3ccc(O)cc3)CC2)c(C(F)(F)F)c1 ZINC000059949824 132304176 /nfs/dbraw/zinc/30/41/76/132304176.db2.gz NEDQCNIFEKUQTL-UHFFFAOYSA-N 0 0 367.327 3.646 20 5 FHBDRN Cc1c(C(=O)N2CCN(c3ccc(Cl)cc3)CC2)cccc1[N+](=O)[O-] ZINC000005394163 132304479 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CCC[C@@H](C(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1)c1ccccc1 ZINC000068761884 136137797 /nfs/dbraw/zinc/13/77/97/136137797.db2.gz POASHNJDLQZFHC-GOSISDBHSA-N 0 0 367.449 3.827 20 5 FHBDRN CCOc1cc(C(=O)N2CCCc3ccccc32)c([N+](=O)[O-])cc1OC ZINC000026765199 136153256 /nfs/dbraw/zinc/15/32/56/136153256.db2.gz DDZUDQKLHNRCQH-UHFFFAOYSA-N 0 0 356.378 3.595 20 5 FHBDRN Cc1ccc(NC(=O)NCCc2cccc3cccnc32)cc1[N+](=O)[O-] ZINC000043147257 567819139 /nfs/dbraw/zinc/81/91/39/567819139.db2.gz QVDNGTHIIZJNEQ-UHFFFAOYSA-N 0 0 350.378 3.816 20 5 FHBDRN CN(CCCNC(=O)Nc1ccc([N+](=O)[O-])cc1F)c1ccccc1F ZINC000541786212 567821730 /nfs/dbraw/zinc/82/17/30/567821730.db2.gz FKTIOPPLFDZTBX-UHFFFAOYSA-N 0 0 364.352 3.521 20 5 FHBDRN Cc1ccc(C(C)C)c(OCCC(=O)N(C)c2ccc([N+](=O)[O-])nc2)c1 ZINC000568055881 567822586 /nfs/dbraw/zinc/82/25/86/567822586.db2.gz WFLXPMKBJLWOLE-UHFFFAOYSA-N 0 0 357.410 3.854 20 5 FHBDRN C[C@@H](N(C)S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])C(C)(C)C ZINC000568056426 567822630 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372.400 3.787 20 5 FHBDRN O=C(Nc1cc(Cl)ccc1F)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000602246494 567959336 /nfs/dbraw/zinc/95/93/36/567959336.db2.gz DSYRPYROAQIBLI-UHFFFAOYSA-N 0 0 360.732 3.825 20 5 FHBDRN Cc1cccc(C)c1OC[C@@H](O)Cn1ccnc1-c1ccc([N+](=O)[O-])cc1 ZINC000051451856 567961281 /nfs/dbraw/zinc/96/12/81/567961281.db2.gz NWWOCOIBAWUKMO-SFHVURJKSA-N 0 0 367.405 3.515 20 5 FHBDRN Cc1c(CNC(=O)CSc2ccc3c(c2)CCC3)cccc1[N+](=O)[O-] ZINC000481470740 567963973 /nfs/dbraw/zinc/96/39/73/567963973.db2.gz YOPVGVLWIYWOLQ-UHFFFAOYSA-N 0 0 356.447 3.800 20 5 FHBDRN CC(C)C[C@@H](C)n1nccc1NC(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000481466934 567965383 /nfs/dbraw/zinc/96/53/83/567965383.db2.gz SLOGWRYUVLXDPN-CQSZACIVSA-N 0 0 359.430 3.763 20 5 FHBDRN Cc1cc(C(=O)NCc2cccc([N+](=O)[O-])c2C)c2c(n1)onc2C(C)C ZINC000481465613 567966223 /nfs/dbraw/zinc/96/62/23/567966223.db2.gz KLYFFVCCLNDSIN-UHFFFAOYSA-N 0 0 368.393 3.801 20 5 FHBDRN Cc1nc(-c2ccccn2)sc1C(=O)NCc1cccc([N+](=O)[O-])c1C ZINC000481474749 567976918 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FHBDRN CCCn1ncc(NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)c1C1CC1 ZINC000452982831 568123057 /nfs/dbraw/zinc/12/30/57/568123057.db2.gz JWJQLFVKSBKYLY-UHFFFAOYSA-N 0 0 356.426 3.995 20 5 FHBDRN O=C(CSc1ccccc1Cl)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000026420462 568128152 /nfs/dbraw/zinc/12/81/52/568128152.db2.gz JKQLHTCNTHQMHZ-UHFFFAOYSA-N 0 0 366.782 3.708 20 5 FHBDRN O=C(N[C@H]1C[C@H](c2ccc(F)cc2)C1)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000481805280 568130644 /nfs/dbraw/zinc/13/06/44/568130644.db2.gz KBVUWGVRIQMTBC-CTYIDZIISA-N 0 0 353.353 3.891 20 5 FHBDRN CNC(=O)c1ccc(N[C@H]2CC(C)(C)Oc3cc(F)ccc32)c([N+](=O)[O-])c1 ZINC000481816598 568136526 /nfs/dbraw/zinc/13/65/26/568136526.db2.gz ROAWJILTCGUUCY-HNNXBMFYSA-N 0 0 373.384 3.808 20 5 FHBDRN CN(C(=O)NCCc1ccc([N+](=O)[O-])cc1)[C@H]1CC[C@@H](C(F)(F)F)CC1 ZINC000291397407 568136881 /nfs/dbraw/zinc/13/68/81/568136881.db2.gz XBUYYZHYTAYFMI-OKILXGFUSA-N 0 0 373.375 3.900 20 5 FHBDRN O=C(NC[C@H]1CCC2(CCCCC2)O1)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000481876975 568140554 /nfs/dbraw/zinc/14/05/54/568140554.db2.gz VNWAFWCBUDINCY-CQSZACIVSA-N 0 0 357.410 3.688 20 5 FHBDRN CC[C@H]1c2ccsc2CCN1C(=O)COc1cc([N+](=O)[O-])ccc1C ZINC000603725913 568143144 /nfs/dbraw/zinc/14/31/44/568143144.db2.gz KUHUVPVSVZXRCQ-HNNXBMFYSA-N 0 0 360.435 3.880 20 5 FHBDRN COc1ccc(S(=O)(=O)Nc2cccc(C(C)C)c2)cc1[N+](=O)[O-] ZINC000007055735 568145051 /nfs/dbraw/zinc/14/50/51/568145051.db2.gz MRWXCMOMMQOUFP-UHFFFAOYSA-N 0 0 350.396 3.528 20 5 FHBDRN Cc1cc(C2CC2)nc(NC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)n1 ZINC000291432205 568148419 /nfs/dbraw/zinc/14/84/19/568148419.db2.gz GZSRGFAAADEXGK-LLVKDONJSA-N 0 0 358.423 3.690 20 5 FHBDRN Cc1cc(OCC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)cc(C)c1Cl ZINC000481862460 568163256 /nfs/dbraw/zinc/16/32/56/568163256.db2.gz DJMYSBGYAZEEDR-UHFFFAOYSA-N 0 0 374.824 3.829 20 5 FHBDRN CO[C@@H]1CCN(c2nnc(-c3ccc([N+](=O)[O-])cc3)n2CC(C)C)[C@@H](C)C1 ZINC000291449825 568163385 /nfs/dbraw/zinc/16/33/85/568163385.db2.gz FNNJQPFLIMXKLV-WMLDXEAASA-N 0 0 373.457 3.513 20 5 FHBDRN COC(=O)c1cc(N[C@H]2CCCc3nc(C)sc32)cc(C)c1[N+](=O)[O-] ZINC000302040151 568163780 /nfs/dbraw/zinc/16/37/80/568163780.db2.gz RDBFMIOSYJBUHU-AWEZNQCLSA-N 0 0 361.423 3.944 20 5 FHBDRN Cc1cc(NC(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)ccn1 ZINC000128694612 568174723 /nfs/dbraw/zinc/17/47/23/568174723.db2.gz MRTRNGOKPYQJPN-UHFFFAOYSA-N 0 0 350.172 3.621 20 5 FHBDRN COCCCCc1cccnc1NC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000291499784 568176591 /nfs/dbraw/zinc/17/65/91/568176591.db2.gz VAHCVJIOIUZKTE-UHFFFAOYSA-N 0 0 363.801 3.865 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1NCc1ccccc1)N1CC[C@H]1C1CC1 ZINC000452994717 568178783 /nfs/dbraw/zinc/17/87/83/568178783.db2.gz RAFDQHBSOIKKTJ-IBGZPJMESA-N 0 0 351.406 3.831 20 5 FHBDRN Cc1ccc(-n2cnnc2SCCOc2ccccc2[N+](=O)[O-])c(C)c1 ZINC000603904343 568180669 /nfs/dbraw/zinc/18/06/69/568180669.db2.gz GEEIXASFQFGDOW-UHFFFAOYSA-N 0 0 370.434 3.963 20 5 FHBDRN COCCCCc1cccnc1NC(=O)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000291516202 568188147 /nfs/dbraw/zinc/18/81/47/568188147.db2.gz YFQYSAHPMZUNCN-UHFFFAOYSA-N 0 0 363.801 3.865 20 5 FHBDRN CCOc1cn(-c2ccccc2)nc1C(=O)Nc1ccc(C)c([N+](=O)[O-])c1 ZINC000481963274 568199728 /nfs/dbraw/zinc/19/97/28/568199728.db2.gz ANJAPNKADSOGPX-UHFFFAOYSA-N 0 0 366.377 3.740 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)Nc1cccc(Cl)c1F ZINC000481968554 568201708 /nfs/dbraw/zinc/20/17/08/568201708.db2.gz AIJDSWVBADBQPD-UHFFFAOYSA-N 0 0 358.778 3.805 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N1CCC[C@@H]1c1ccsc1 ZINC000481978767 568211444 /nfs/dbraw/zinc/21/14/44/568211444.db2.gz FUUGWUDIVYDUDR-OAHLLOKOSA-N 0 0 366.464 3.799 20 5 FHBDRN Cc1cc(C)c(NC(=O)CN(C)C(=O)Nc2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000043728370 568214940 /nfs/dbraw/zinc/21/49/40/568214940.db2.gz LKGFQCPPYVSTIY-UHFFFAOYSA-N 0 0 370.409 3.622 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)N[C@H](c1ccccc1)C(F)F ZINC000481989781 568215869 /nfs/dbraw/zinc/21/58/69/568215869.db2.gz OGHINGHXMKMXBY-OAHLLOKOSA-N 0 0 352.362 3.810 20 5 FHBDRN Cc1ccc(S(=O)(=O)N2CC(C)(C)[C@H]2c2cccs2)c([N+](=O)[O-])c1 ZINC000568784350 568216496 /nfs/dbraw/zinc/21/64/96/568216496.db2.gz POVMGABWPBBFNA-OAHLLOKOSA-N 0 0 366.464 3.737 20 5 FHBDRN O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1cccc2cccnc21 ZINC000075908270 568219805 /nfs/dbraw/zinc/21/98/05/568219805.db2.gz YQJLAVMQWLVDEI-UHFFFAOYSA-N 0 0 359.288 3.997 20 5 FHBDRN COC1CCN(C(=O)c2cc([N+](=O)[O-])ccc2SCC(C)C)CC1 ZINC000481994532 568221547 /nfs/dbraw/zinc/22/15/47/568221547.db2.gz WGALOVBSTWJEIP-UHFFFAOYSA-N 0 0 352.456 3.594 20 5 FHBDRN C[C@@H](COc1cccc(F)c1)NC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000604200097 568221841 /nfs/dbraw/zinc/22/18/41/568221841.db2.gz ALDSGWNVBOHILQ-JTQLQIEISA-N 0 0 352.749 3.585 20 5 FHBDRN CCN(Cc1ccc(OC)cc1OC)C(=O)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000568823704 568230402 /nfs/dbraw/zinc/23/04/02/568230402.db2.gz UUMHHCUUTOABRF-CQSZACIVSA-N 0 0 372.421 3.764 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NC1(c2ccc(Cl)cc2)CC1 ZINC000482016867 568230865 /nfs/dbraw/zinc/23/08/65/568230865.db2.gz UPZIDZUOVAUEAI-UHFFFAOYSA-N 0 0 366.826 3.524 20 5 FHBDRN C[C@H]1C[C@@H](c2ccccc2)N(C(=O)NCCc2cccc([N+](=O)[O-])c2)C1 ZINC000568851527 568236412 /nfs/dbraw/zinc/23/64/12/568236412.db2.gz VMFPGCQGTFKBSQ-KXBFYZLASA-N 0 0 353.422 3.930 20 5 FHBDRN Cc1cc(C(=O)Cn2cc([N+](=O)[O-])c(=O)c3ccccc32)c(C)n1C1CC1 ZINC000291653708 568241910 /nfs/dbraw/zinc/24/19/10/568241910.db2.gz NYPPMGAOOGYWKN-UHFFFAOYSA-N 0 0 365.389 3.546 20 5 FHBDRN Cc1cc(C)cc([C@@H]2CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3N)C2)c1 ZINC000181944604 568243074 /nfs/dbraw/zinc/24/30/74/568243074.db2.gz USLJDZWFTUCQRF-CYBMUJFWSA-N 0 0 357.385 3.563 20 5 FHBDRN O=C(Nc1ccncc1[N+](=O)[O-])N1CCC[C@@H](CCCc2ccccc2)C1 ZINC000541924830 568249281 /nfs/dbraw/zinc/24/92/81/568249281.db2.gz MZXTWNBVGHGJAL-QGZVFWFLSA-N 0 0 368.437 3.679 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(N[C@H](c2nc(-c3ccncc3)no2)C(C)C)n1 ZINC000541932256 568249951 /nfs/dbraw/zinc/24/99/51/568249951.db2.gz KMSRMIMGXMFHJY-AWEZNQCLSA-N 0 0 368.397 3.861 20 5 FHBDRN O=[N+]([O-])c1ccc(NC[C@@H](CO)c2ccccc2Cl)c2ccncc21 ZINC000568908894 568251879 /nfs/dbraw/zinc/25/18/79/568251879.db2.gz GAVXTNKRHHVKHF-LBPRGKRZSA-N 0 0 357.797 3.984 20 5 FHBDRN COc1cc(C(=O)N[C@H]2CCO[C@@H](c3ccccc3)C2)cc([N+](=O)[O-])c1C ZINC000190294633 568252807 /nfs/dbraw/zinc/25/28/07/568252807.db2.gz WHVVBDLLGDEMQI-QFBILLFUSA-N 0 0 370.405 3.562 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(NCc2cccc(NC(=O)C3CCC3)c2)n1 ZINC000541933758 568253223 /nfs/dbraw/zinc/25/32/23/568253223.db2.gz UCJANFDNWCQLAW-UHFFFAOYSA-N 0 0 354.410 3.957 20 5 FHBDRN Cc1ccc(C)c(SCC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)c1 ZINC000026468381 568253521 /nfs/dbraw/zinc/25/35/21/568253521.db2.gz YYEMTUQKOXAFHR-UHFFFAOYSA-N 0 0 360.391 3.671 20 5 FHBDRN Cc1cc(NC(=O)[C@H](C)c2cccc([N+](=O)[O-])c2)n(-c2ccccc2)n1 ZINC000568944046 568254358 /nfs/dbraw/zinc/25/43/58/568254358.db2.gz MVFZDRVARSACNI-CQSZACIVSA-N 0 0 350.378 3.831 20 5 FHBDRN CCc1n[nH]c(C(=O)N(CC)Cc2ccc(Cl)c(Cl)c2)c1[N+](=O)[O-] ZINC000517927605 568255578 /nfs/dbraw/zinc/25/55/78/568255578.db2.gz TUXSKRMVONPYKX-UHFFFAOYSA-N 0 0 371.224 3.849 20 5 FHBDRN CCOc1ccc(Oc2ccc(NC(=O)c3n[nH]cc3[N+](=O)[O-])cc2)cc1 ZINC000159404509 568256539 /nfs/dbraw/zinc/25/65/39/568256539.db2.gz VBYVRVWYSVVMSZ-UHFFFAOYSA-N 0 0 368.349 3.761 20 5 FHBDRN Cc1cccc(-c2nnc(Sc3nc(C)cc(C)c3[N+](=O)[O-])n2C)c1 ZINC000541935376 568257392 /nfs/dbraw/zinc/25/73/92/568257392.db2.gz SVTGKIZKAADWEP-UHFFFAOYSA-N 0 0 355.423 3.862 20 5 FHBDRN O=C(Nc1ccc(NC(=O)C2CC2)cc1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000128757312 568258942 /nfs/dbraw/zinc/25/89/42/568258942.db2.gz PKVSQPJRPDJRJK-UHFFFAOYSA-N 0 0 359.769 3.849 20 5 FHBDRN COc1ccc([C@@H]2CCCN2c2nc(C)cc(C)c2[N+](=O)[O-])c(OC)c1 ZINC000541935293 568259300 /nfs/dbraw/zinc/25/93/00/568259300.db2.gz LWLMIJSXMNMXRJ-INIZCTEOSA-N 0 0 357.410 3.965 20 5 FHBDRN C[C@@H]1C[C@@H](CNC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)[C@H](C)O1 ZINC000412670851 568262654 /nfs/dbraw/zinc/26/26/54/568262654.db2.gz BMFPMSKCSVZXEZ-ILXRZTDVSA-N 0 0 370.405 3.930 20 5 FHBDRN CCS[C@@H](C)c1noc(CN(C)c2ccc([N+](=O)[O-])c3cnccc32)n1 ZINC000482094851 568263914 /nfs/dbraw/zinc/26/39/14/568263914.db2.gz NUQQBTMQVRZLPE-NSHDSACASA-N 0 0 373.438 3.977 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2noc(C3(Cc4ccccc4)CCOCC3)n2)cc1 ZINC000453030997 568265738 /nfs/dbraw/zinc/26/57/38/568265738.db2.gz XIEGDKPWZGHITE-UHFFFAOYSA-N 0 0 365.389 3.936 20 5 FHBDRN CN(C(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1)[C@@H]1CCCOC1 ZINC000569015088 568268550 /nfs/dbraw/zinc/26/85/50/568268550.db2.gz ADVZVJWNZYANQY-OAHLLOKOSA-N 0 0 372.446 3.997 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)NCC1CC(c2ccccc2)C1 ZINC000569090559 568269686 /nfs/dbraw/zinc/26/96/86/568269686.db2.gz ANUIWYBXTWTYDK-UHFFFAOYSA-N 0 0 363.417 3.929 20 5 FHBDRN CSc1cccc(C(=O)N[C@@H]2c3ccc(F)cc3O[C@H]2C)c1[N+](=O)[O-] ZINC000569027979 568275668 /nfs/dbraw/zinc/27/56/68/568275668.db2.gz XWMJPMYUDRAMHV-VFZGTOFNSA-N 0 0 362.382 3.708 20 5 FHBDRN C[C@@H]1CCN(C(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)CC12CCC2 ZINC000541974370 568278322 /nfs/dbraw/zinc/27/83/22/568278322.db2.gz FQJKFTMCDPFWTE-LLVKDONJSA-N 0 0 354.353 3.849 20 5 FHBDRN C[C@H]1CCN(C(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)CC12CCC2 ZINC000541974371 568278420 /nfs/dbraw/zinc/27/84/20/568278420.db2.gz FQJKFTMCDPFWTE-NSHDSACASA-N 0 0 354.353 3.849 20 5 FHBDRN CNc1nc(-c2nc([C@H]3CCCc4ccccc43)no2)ccc1[N+](=O)[O-] ZINC000453059293 568280639 /nfs/dbraw/zinc/28/06/39/568280639.db2.gz IMWKOHSQCZRPFG-ZDUSSCGKSA-N 0 0 351.366 3.550 20 5 FHBDRN CNc1nc(-c2nc([C@@H]3CCCc4ccccc43)no2)ccc1[N+](=O)[O-] ZINC000453059164 568281394 /nfs/dbraw/zinc/28/13/94/568281394.db2.gz IMWKOHSQCZRPFG-CYBMUJFWSA-N 0 0 351.366 3.550 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)NCc2ccccc2Cl)cc1SC ZINC000482154098 568292164 /nfs/dbraw/zinc/29/21/64/568292164.db2.gz PQJFHTXXBJMVTD-UHFFFAOYSA-N 0 0 366.826 3.909 20 5 FHBDRN CC(C)(C)Oc1ccc(CNC(=O)NCCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000604435453 568292686 /nfs/dbraw/zinc/29/26/86/568292686.db2.gz CNSNWTYYGGQFFN-UHFFFAOYSA-N 0 0 371.437 3.814 20 5 FHBDRN CN(Cc1ccc(Cl)c(Cl)c1)c1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000008052536 568295611 /nfs/dbraw/zinc/29/56/11/568295611.db2.gz CRDMFLJCPGEOOC-UHFFFAOYSA-N 0 0 354.193 3.637 20 5 FHBDRN COc1ccc([C@H](O)C2CCN(Cc3ccc([N+](=O)[O-])c(F)c3)CC2)cc1 ZINC000291749740 568296443 /nfs/dbraw/zinc/29/64/43/568296443.db2.gz KLYUNLBLQVUBSV-FQEVSTJZSA-N 0 0 374.412 3.688 20 5 FHBDRN COc1cc(N2CCc3cc(Br)ccc3C2)ccc1[N+](=O)[O-] ZINC000302732406 568300328 /nfs/dbraw/zinc/30/03/28/568300328.db2.gz UJAVJYXFFUSSEV-UHFFFAOYSA-N 0 0 363.211 3.929 20 5 FHBDRN Cc1cc(N2CC[C@H](C)[C@H](n3ccnc3)C2)c2cccc([N+](=O)[O-])c2n1 ZINC000302004851 568301279 /nfs/dbraw/zinc/30/12/79/568301279.db2.gz KPQPTYCMYOONCE-SCLBCKFNSA-N 0 0 351.410 3.735 20 5 FHBDRN O=C(N[C@@H]1[C@H]2CCO[C@H]2C12CCC2)c1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000291784655 568309555 /nfs/dbraw/zinc/30/95/55/568309555.db2.gz QGYGJWSBDXYAHH-OWYVNGRQSA-N 0 0 371.220 3.589 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCCC[C@H]1C(F)(F)F ZINC000482213675 568317334 /nfs/dbraw/zinc/31/73/34/568317334.db2.gz MHUVFUJQNUBDDI-GXFFZTMASA-N 0 0 360.332 3.702 20 5 FHBDRN COc1cc(N[C@H]2CCO[C@@H]2c2ccc(F)c(F)c2)c(F)cc1[N+](=O)[O-] ZINC000302034737 568317898 /nfs/dbraw/zinc/31/78/98/568317898.db2.gz UEASJYSKDUUIMX-SUMWQHHRSA-N 0 0 368.311 3.963 20 5 FHBDRN C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000482215816 568320644 /nfs/dbraw/zinc/32/06/44/568320644.db2.gz WZPPZOJLOWEDMV-NEPJUHHUSA-N 0 0 359.348 3.586 20 5 FHBDRN CNc1ccc(C(=O)NCc2c(OC)ccc3ccccc32)cc1[N+](=O)[O-] ZINC000031187368 568326249 /nfs/dbraw/zinc/32/62/49/568326249.db2.gz JPWZYJCVIFZBNS-UHFFFAOYSA-N 0 0 365.389 3.728 20 5 FHBDRN CC(C)Oc1ccccc1NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000031774953 568339370 /nfs/dbraw/zinc/33/93/70/568339370.db2.gz YGNTYPUGVGJKNZ-UHFFFAOYSA-N 0 0 366.377 3.820 20 5 FHBDRN COc1ccc(CSCC(=O)Nc2cc(F)ccc2F)cc1[N+](=O)[O-] ZINC000031873791 568342619 /nfs/dbraw/zinc/34/26/19/568342619.db2.gz NPIWTBLTHWSMNB-UHFFFAOYSA-N 0 0 368.361 3.754 20 5 FHBDRN Cc1ccc(Cn2nccc2NC(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000569306234 568357277 /nfs/dbraw/zinc/35/72/77/568357277.db2.gz GTRRDPBYCPXTQP-HNNXBMFYSA-N 0 0 364.405 3.890 20 5 FHBDRN Cc1cc(N2CC[C@H]([C@@H]3CCOC3)C2)c(Br)cc1[N+](=O)[O-] ZINC000408297860 568367664 /nfs/dbraw/zinc/36/76/64/568367664.db2.gz MBJARZBHYZCYAD-NWDGAFQWSA-N 0 0 355.232 3.529 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)N2CCC[C@@]3(CCCOC3)C2)cc1[N+](=O)[O-] ZINC000408298649 568368797 /nfs/dbraw/zinc/36/87/97/568368797.db2.gz PZOJRKQTDXDMIT-HXUWFJFHSA-N 0 0 360.454 3.925 20 5 FHBDRN CN(Cc1ccccc1)C(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000003904221 568370065 /nfs/dbraw/zinc/37/00/65/568370065.db2.gz KJVBEPPPUCLLRG-UHFFFAOYSA-N 0 0 356.425 3.813 20 5 FHBDRN CS[C@H]1CCC[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000181995509 568371771 /nfs/dbraw/zinc/37/17/71/568371771.db2.gz BZQJGAITJZLUJY-ONGXEEELSA-N 0 0 360.382 3.600 20 5 FHBDRN COc1ccc(NC(=O)c2ccc(-n3cccc3)c(F)c2)cc1[N+](=O)[O-] ZINC000542001815 568378061 /nfs/dbraw/zinc/37/80/61/568378061.db2.gz XUHZWSFPOOBTFN-UHFFFAOYSA-N 0 0 355.325 3.786 20 5 FHBDRN CCOc1ccc(C(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)cc1OCC ZINC000542001598 568378482 /nfs/dbraw/zinc/37/84/82/568378482.db2.gz SCCJAFDUCUSAFS-UHFFFAOYSA-N 0 0 360.366 3.653 20 5 FHBDRN CCSc1nnc(SCC(=O)Nc2cc([N+](=O)[O-])ccc2C)s1 ZINC000005450286 568385619 /nfs/dbraw/zinc/38/56/19/568385619.db2.gz HWRZPVJEVUXUJG-UHFFFAOYSA-N 0 0 370.481 3.598 20 5 FHBDRN COc1ccccc1C[C@@H](C)CC(=O)Nc1ccc(OC)c([N+](=O)[O-])c1 ZINC000541994596 568389460 /nfs/dbraw/zinc/38/94/60/568389460.db2.gz YFGLSZJQQHTNBX-CYBMUJFWSA-N 0 0 358.394 3.819 20 5 FHBDRN COc1ccc(NC(=O)[C@@H](C)Oc2cccc(Cl)c2)cc1[N+](=O)[O-] ZINC000541999054 568392865 /nfs/dbraw/zinc/39/28/65/568392865.db2.gz SVKNQVHGVYUGNB-SNVBAGLBSA-N 0 0 350.758 3.663 20 5 FHBDRN CCn1cc(CC(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)c2ccccc21 ZINC000541999522 568395705 /nfs/dbraw/zinc/39/57/05/568395705.db2.gz IRPJGTYSPZAVNR-UHFFFAOYSA-N 0 0 353.378 3.759 20 5 FHBDRN CC1(C)CN(C(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)CC2(CCCC2)O1 ZINC000408305600 568399817 /nfs/dbraw/zinc/39/98/17/568399817.db2.gz LILYTFFUFPZSGE-UHFFFAOYSA-N 0 0 357.410 3.640 20 5 FHBDRN Cc1cc(/C=C/c2nc(-c3c([N+](=O)[O-])ncn3C)no2)ccc1OC(C)C ZINC000569390726 568400224 /nfs/dbraw/zinc/40/02/24/568400224.db2.gz RQEWOSJZPWWDRW-SOFGYWHQSA-N 0 0 369.381 3.644 20 5 FHBDRN CN(C(=O)Cc1c(F)cc([N+](=O)[O-])cc1F)c1cccc2cccnc21 ZINC000569406532 568401089 /nfs/dbraw/zinc/40/10/89/568401089.db2.gz WULNQXDOKNKFBG-UHFFFAOYSA-N 0 0 357.316 3.627 20 5 FHBDRN Cc1c(NC(=O)[C@@H](C)OCC(C)C)cc(Br)cc1[N+](=O)[O-] ZINC000569419362 568401738 /nfs/dbraw/zinc/40/17/38/568401738.db2.gz HQJBSNPOQADCPR-SNVBAGLBSA-N 0 0 359.220 3.665 20 5 FHBDRN CCc1nn(C)c(Oc2ccc(NC(=O)c3ccco3)cc2)c1[N+](=O)[O-] ZINC000569498136 568403705 /nfs/dbraw/zinc/40/37/05/568403705.db2.gz YSBFQKSXHOKSDB-UHFFFAOYSA-N 0 0 356.338 3.528 20 5 FHBDRN CCc1ccc(CN(CC(=O)Nc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000569522546 568404691 /nfs/dbraw/zinc/40/46/91/568404691.db2.gz QOGAUIWQZMKZRJ-UHFFFAOYSA-N 0 0 353.422 3.760 20 5 FHBDRN CC[C@@]1(c2ccc(C)cc2)CC(=O)N(CCc2ccc([N+](=O)[O-])cc2)C1=O ZINC000569525889 568405450 /nfs/dbraw/zinc/40/54/50/568405450.db2.gz XHHGURNTENAJIG-NRFANRHFSA-N 0 0 366.417 3.553 20 5 FHBDRN C[C@H](c1nc(-c2ccc3c(c2)OCCO3)no1)c1cccc([N+](=O)[O-])c1 ZINC000569528347 568405617 /nfs/dbraw/zinc/40/56/17/568405617.db2.gz WRHCVWVYKOEKSV-NSHDSACASA-N 0 0 353.334 3.568 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)F)cc1NCc1noc(-c2cccs2)n1 ZINC000569693839 568411827 /nfs/dbraw/zinc/41/18/27/568411827.db2.gz TWSLEELCDZEROF-UHFFFAOYSA-N 0 0 371.300 3.732 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1OCCCO[C@@H]1CCCCO1 ZINC000569763525 568421782 /nfs/dbraw/zinc/42/17/82/568421782.db2.gz UQDIHELUTVMJHP-CQSZACIVSA-N 0 0 360.204 3.669 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)N2CC(C)(C)[C@@H]2[C@@H]2CCCO2)cc1[N+](=O)[O-] ZINC000569895464 568434610 /nfs/dbraw/zinc/43/46/10/568434610.db2.gz PYKANNVLMVQYGW-JQFCIGGWSA-N 0 0 361.442 3.563 20 5 FHBDRN COc1ccc([C@H]2CCN(C(=O)[C@@H](C)c3cccc([N+](=O)[O-])c3)C2)cc1 ZINC000569898821 568434736 /nfs/dbraw/zinc/43/47/36/568434736.db2.gz PNVTXKLBDFRSJR-YOEHRIQHSA-N 0 0 354.406 3.723 20 5 FHBDRN C[C@@H](NC(=O)Nc1ncc(C(F)(F)F)s1)c1ccccc1[N+](=O)[O-] ZINC000569944243 568444020 /nfs/dbraw/zinc/44/40/20/568444020.db2.gz XPBMNACOBAZXBT-SSDOTTSWSA-N 0 0 360.317 3.953 20 5 FHBDRN Cc1cc(N[C@@H]2CCN(CC(F)(F)F)C2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000570098071 568450658 /nfs/dbraw/zinc/45/06/58/568450658.db2.gz CIMSWUBQBUDCKE-SECBINFHSA-N 0 0 371.281 3.971 20 5 FHBDRN COC(=O)c1ccc(OCC(=O)c2cc(C)c(C)cc2C)c([N+](=O)[O-])c1 ZINC000007129059 568453520 /nfs/dbraw/zinc/45/35/20/568453520.db2.gz NECNSBXMVJZUOH-UHFFFAOYSA-N 0 0 357.362 3.568 20 5 FHBDRN COc1ccc(CSCC(=O)N(C)[C@H]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000033101948 568458493 /nfs/dbraw/zinc/45/84/93/568458493.db2.gz BHBHFTRJHHPLKM-HIFRSBDPSA-N 0 0 366.483 3.874 20 5 FHBDRN CC(C)(C(=O)NCCCCOCc1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000570179058 568459516 /nfs/dbraw/zinc/45/95/16/568459516.db2.gz ILUFNHZSZGBZGO-UHFFFAOYSA-N 0 0 370.449 3.986 20 5 FHBDRN CC(C)(C)c1ncc(C(=O)N2CCS[C@H]2c2ccc([N+](=O)[O-])cc2)cn1 ZINC000570315462 568467666 /nfs/dbraw/zinc/46/76/66/568467666.db2.gz KMKJGKCZKVPMBB-INIZCTEOSA-N 0 0 372.450 3.570 20 5 FHBDRN O=C(NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)c1ccc([N+](=O)[O-])o1 ZINC000033195096 568470495 /nfs/dbraw/zinc/47/04/95/568470495.db2.gz SQMWCOAFGHZZEW-BQBZGAKWSA-N 0 0 374.237 3.827 20 5 FHBDRN CCCc1n[nH]c(C(=O)N[C@H]2CC=C(c3ccc(F)cc3)CC2)c1[N+](=O)[O-] ZINC000482231488 568471565 /nfs/dbraw/zinc/47/15/65/568471565.db2.gz LIJFOTKLUATBBX-HNNXBMFYSA-N 0 0 372.400 3.775 20 5 FHBDRN Cc1oc2ccccc2c1Cc1nc(-c2ccc(N)c([N+](=O)[O-])c2)no1 ZINC000570549223 568486574 /nfs/dbraw/zinc/48/65/74/568486574.db2.gz PJXHBVXIOHQCSW-UHFFFAOYSA-N 0 0 350.334 3.872 20 5 FHBDRN COc1cc(C(=O)N[C@@H]2CCC(C)(C)C[C@@H]2C)cc([N+](=O)[O-])c1OC ZINC000482233952 568487484 /nfs/dbraw/zinc/48/74/84/568487484.db2.gz IPKDEQYQCKMGQQ-WCQYABFASA-N 0 0 350.415 3.557 20 5 FHBDRN CC(=O)c1cc(N[C@H]2CC(=O)N(c3ccccc3Cl)C2)ccc1[N+](=O)[O-] ZINC000570706858 568502105 /nfs/dbraw/zinc/50/21/05/568502105.db2.gz YRQXKNPSEBMFTL-ZDUSSCGKSA-N 0 0 373.796 3.668 20 5 FHBDRN CCN(C(=O)[C@H](C)c1cccc([N+](=O)[O-])c1)[C@H](COC)Cc1ccccc1 ZINC000570778860 568525984 /nfs/dbraw/zinc/52/59/84/568525984.db2.gz NDLLSQXXJLHOGY-UZLBHIALSA-N 0 0 370.449 3.805 20 5 FHBDRN CCS[C@H]1CCC[C@H](NC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)C1 ZINC000482247877 568533027 /nfs/dbraw/zinc/53/30/27/568533027.db2.gz VUKXVUMZBDXVHI-HOCLYGCPSA-N 0 0 361.467 3.730 20 5 FHBDRN CCn1c(SCc2nnc(C)o2)nc2cc3ccccc3cc2c1=O ZINC000007577933 568533912 /nfs/dbraw/zinc/53/39/12/568533912.db2.gz VYEMPAWACOHOSS-UHFFFAOYSA-N 0 0 352.419 3.553 20 5 FHBDRN CCN(CC)C(=O)CSCc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000120408339 568545426 /nfs/dbraw/zinc/54/54/26/568545426.db2.gz KJTKMJTXVPRIMH-UHFFFAOYSA-N 0 0 350.362 3.715 20 5 FHBDRN O=C(NCCOc1cccc2ccccc21)NCc1ccc([N+](=O)[O-])cc1 ZINC000050121456 568735155 /nfs/dbraw/zinc/73/51/55/568735155.db2.gz PPWNEUIWZZFPAH-UHFFFAOYSA-N 0 0 365.389 3.626 20 5 FHBDRN O=C(Nc1nnc(Cc2ccccc2)s1)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000003016540 571343522 /nfs/dbraw/zinc/34/35/22/571343522.db2.gz URICHTRPDKHNAQ-UHFFFAOYSA-N 0 0 374.809 3.943 20 5 FHBDRN CC[C@H](Nc1ccc([N+](=O)[O-])cc1-c1nn[nH]n1)c1cc(F)ccc1F ZINC000736370925 598975368 /nfs/dbraw/zinc/97/53/68/598975368.db2.gz UDUHOZZGZCHCTO-AWEZNQCLSA-N 0 0 360.324 3.616 20 5 FHBDRN C[C@@H]1C[C@H](c2ccccc2F)N(c2ccc([N+](=O)[O-])cc2-c2nn[nH]n2)C1 ZINC000820667147 599077158 /nfs/dbraw/zinc/07/71/58/599077158.db2.gz LGBLCYJNCMBEDS-PIGZYNQJSA-N 0 0 368.372 3.502 20 5 FHBDRN O=[N+]([O-])c1cnc(Nc2cccc(Nc3ccccc3)c2)c(-c2nn[nH]n2)c1 ZINC000823650846 599186461 /nfs/dbraw/zinc/18/64/61/599186461.db2.gz CJAADQGDOFBMHV-UHFFFAOYSA-N 0 0 374.364 3.657 20 5 FHBDRN C[C@H](SCc1ccc(F)cc1-c1nn[nH]n1)c1cccc([N+](=O)[O-])c1 ZINC000736192122 598314451 /nfs/dbraw/zinc/31/44/51/598314451.db2.gz KYHQLSMTVIHELR-JTQLQIEISA-N 0 0 359.386 3.908 20 5 FHBDRN C[C@@H](c1cc2ccccc2o1)N(C)c1ccc([N+](=O)[O-])cc1-c1nn[nH]n1 ZINC000736199368 598814030 /nfs/dbraw/zinc/81/40/30/598814030.db2.gz XNGWKELGZLTDKP-NSHDSACASA-N 0 0 364.365 3.719 20 5 FHBDRN CC[C@H](Nc1ccc([N+](=O)[O-])cc1-c1nn[nH]n1)c1ccc(F)cc1F ZINC000736369346 599528150 /nfs/dbraw/zinc/52/81/50/599528150.db2.gz KSYNJKZFDQTFAQ-AWEZNQCLSA-N 0 0 360.324 3.616 20 5 FHBDRN Cc1cccc([C@H]2CCCN2c2ccc([N+](=O)[O-])cc2-c2nn[nH]n2)c1C ZINC000822299674 599578329 /nfs/dbraw/zinc/57/83/29/599578329.db2.gz QOKIENQKRIDQNL-QGZVFWFLSA-N 0 0 364.409 3.733 20 5 FHBDRN O=C([O-])N1CCC[C@@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000739929723 599860521 /nfs/dbraw/zinc/86/05/21/599860521.db2.gz XYQFJCDNDSVQFB-GFCCVEGCSA-N 0 0 361.423 3.555 20 5 FHBDRN C[C@H](C[N@H+](Cc1ccccc1)Cc1ccc(Cl)cc1[N+](=O)[O-])C(=O)[O-] ZINC000736583245 600215378 /nfs/dbraw/zinc/21/53/78/600215378.db2.gz LUPSURIRXQCNEQ-CYBMUJFWSA-N 0 0 362.813 3.971 20 5 FHBDRN CC[C@H](Nc1ccc([N+](=O)[O-])c(-c2nn[nH]n2)c1)c1ccc(Cl)cc1 ZINC000825148828 607449621 /nfs/dbraw/zinc/44/96/21/607449621.db2.gz UOSOSRVKXNKJSS-AWEZNQCLSA-N 0 0 358.789 3.992 20 5 FHBDRN C[NH+](C)Cc1cc(CNc2ccc(/C=C/C(=O)[O-])cc2[N+](=O)[O-])ccc1F ZINC000737367663 600623622 /nfs/dbraw/zinc/62/36/22/600623622.db2.gz BJOJWZMCZWRJPN-VMPITWQZSA-N 0 0 373.384 3.505 20 5 FHBDRN CCCC[NH+]1CCC(Nc2cc(Cl)c(C(=O)[O-])cc2[N+](=O)[O-])CC1 ZINC000829395946 602252994 /nfs/dbraw/zinc/25/29/94/602252994.db2.gz HVCSTTZHWBEAQX-UHFFFAOYSA-N 0 0 355.822 3.623 20 5 FHBDRN C[C@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)[C@@H]1CCCN(C(=O)[O-])C1 ZINC000739030649 602270570 /nfs/dbraw/zinc/27/05/70/602270570.db2.gz BNMGNDWIVBDWHR-DZGCQCFKSA-N 0 0 373.409 3.723 20 5 FHBDRN O=C([O-])[C@@H]1CCC[N@@H+]1Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000414687199 604528150 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CN(CCCOc1ccc(F)cc1)c1ncnc2sc([N+](=O)[O-])cc21 ZINC000582981270 936341750 /nfs/dbraw/zinc/34/17/50/936341750.db2.gz AXVPCLVGXNKWFZ-UHFFFAOYSA-N 0 0 362.386 3.644 20 5 FHBDRN CC[C@@H](C)n1ncc(C(=O)N(C)CCc2ccccc2[N+](=O)[O-])c1C1CC1 ZINC000572907945 936343539 /nfs/dbraw/zinc/34/35/39/936343539.db2.gz JNHQKQKWHKMRSC-CQSZACIVSA-N 0 0 370.453 3.954 20 5 FHBDRN COC(=O)c1ccc(OCc2csc(C(C)(C)C)n2)cc1[N+](=O)[O-] ZINC000613110207 936374107 /nfs/dbraw/zinc/37/41/07/936374107.db2.gz ITAOJRBBNHDNJT-UHFFFAOYSA-N 0 0 350.396 3.714 20 5 FHBDRN COC(=O)c1ccc(OCc2csc(-c3ccc(C)o3)n2)cc1[N+](=O)[O-] ZINC000613109817 936373961 /nfs/dbraw/zinc/37/39/61/936373961.db2.gz PMELNSVEWNCVSZ-UHFFFAOYSA-N 0 0 374.374 3.985 20 5 FHBDRN Cc1nc([N+](=O)[O-])c(Br)n1Cc1ccccc1OC(C)C ZINC000102201712 936378455 /nfs/dbraw/zinc/37/84/55/936378455.db2.gz QLYITCQHFOTMCD-UHFFFAOYSA-N 0 0 354.204 3.698 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(-c2nc(-c3cnn(C(C)(C)C)c3)no2)c1 ZINC000583051034 937080651 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FHBDRN Cc1c(NC(=O)c2cccc([N+](=O)[O-])c2N)cnn1-c1ccc(Cl)cc1 ZINC000577567117 927288539 /nfs/dbraw/zinc/28/85/39/927288539.db2.gz PWHTUYXVDOGQKW-UHFFFAOYSA-N 0 0 371.784 3.577 20 5 FHBDRN CO[C@H](CNC(=O)c1cc(SC)ccc1[N+](=O)[O-])C1CCCCC1 ZINC000598436898 927304646 /nfs/dbraw/zinc/30/46/46/927304646.db2.gz BGYFULHEBYCNDT-MRXNPFEDSA-N 0 0 352.456 3.642 20 5 FHBDRN Cc1ccc(NC(=O)[C@H](C)N(C)CCc2cccc([N+](=O)[O-])c2)cc1C ZINC000583131497 937153256 /nfs/dbraw/zinc/15/32/56/937153256.db2.gz NPXWUJAWQNUQIM-INIZCTEOSA-N 0 0 355.438 3.713 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCc1cnn(-c2ccccc2)c1 ZINC000120142169 927393161 /nfs/dbraw/zinc/39/31/61/927393161.db2.gz XNGDBOMVLMYQPW-UHFFFAOYSA-N 0 0 365.393 3.719 20 5 FHBDRN COc1ccccc1[C@]1(C)C[C@H]1NC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000610181613 927400321 /nfs/dbraw/zinc/40/03/21/927400321.db2.gz FCZGGKPGXSWAEL-AEFFLSMTSA-N 0 0 360.797 3.717 20 5 FHBDRN COc1ccccc1[C@@]1(C)C[C@@H]1NC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000610181615 927400635 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FHBDRN CC1(C)CN(C(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)CCS1 ZINC000176469566 937191151 /nfs/dbraw/zinc/19/11/51/937191151.db2.gz AOTBQNOLRMRUBY-UHFFFAOYSA-N 0 0 363.464 3.686 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(Oc2ccccc2I)n1 ZINC000162583188 937194873 /nfs/dbraw/zinc/19/48/73/937194873.db2.gz CWKWKVYIIPGXOQ-UHFFFAOYSA-N 0 0 356.119 3.695 20 5 FHBDRN C[C@]1(c2ccccc2)C[C@@H]1NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000610191201 927822986 /nfs/dbraw/zinc/82/29/86/927822986.db2.gz XBFSTSPXNBAXPF-AZUAARDMSA-N 0 0 351.406 3.629 20 5 FHBDRN CCO[C@H]1C[C@H](N(C)C(=O)Cc2ccccc2[N+](=O)[O-])C12CCCCC2 ZINC000610192015 927835189 /nfs/dbraw/zinc/83/51/89/927835189.db2.gz PNCFKWXTHAUUEO-ROUUACIJSA-N 0 0 360.454 3.724 20 5 FHBDRN Cc1ccc(-c2ncccc2NC(=O)CCn2cc([N+](=O)[O-])nc2C)s1 ZINC000187054951 927877196 /nfs/dbraw/zinc/87/71/96/927877196.db2.gz RQSSWFUUYSHUSU-UHFFFAOYSA-N 0 0 371.422 3.560 20 5 FHBDRN CN(CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])c1c(F)cccc1F ZINC000064800597 927909603 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366.421 3.699 20 5 FHBDRN C[C@H](Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])[C@H]1CC2CCC1CC2 ZINC000394500772 928266044 /nfs/dbraw/zinc/26/60/44/928266044.db2.gz PYHUBJTYEJWHOM-LFUGVXIPSA-N 0 0 352.456 3.625 20 5 FHBDRN CC(C)(C)c1noc(COc2ccc(Br)cc2[N+](=O)[O-])n1 ZINC000610219289 928266116 /nfs/dbraw/zinc/26/61/16/928266116.db2.gz UGFZNRGFSDHTPN-UHFFFAOYSA-N 0 0 356.176 3.617 20 5 FHBDRN Cc1c(C(=O)Nc2cc(Cl)ccc2C)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000248112011 937235262 /nfs/dbraw/zinc/23/52/62/937235262.db2.gz RCHHOBZVPUJGCG-UHFFFAOYSA-N 0 0 371.784 3.698 20 5 FHBDRN Cc1cc(Cl)ccc1OCCCNC(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000610225487 928322835 /nfs/dbraw/zinc/32/28/35/928322835.db2.gz BXAGWPQZQNAIQO-UHFFFAOYSA-N 0 0 362.813 3.684 20 5 FHBDRN CC(C)n1nccc1C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000120411950 928326005 /nfs/dbraw/zinc/32/60/05/928326005.db2.gz AARDYJQBKIIKRD-UHFFFAOYSA-N 0 0 357.395 3.748 20 5 FHBDRN CC[C@@H](C)[C@@H](NC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)C(F)(F)F ZINC000278137828 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FHBDRN Cc1nn(C)c(C(=O)N[C@@H](CC2CCCC2)c2ccccc2)c1[N+](=O)[O-] ZINC000154247903 928621403 /nfs/dbraw/zinc/62/14/03/928621403.db2.gz JTGXUHHNIHWTKF-INIZCTEOSA-N 0 0 356.426 3.688 20 5 FHBDRN CC[C@](C)(NC(=O)c1cc(SC)ccc1[N+](=O)[O-])c1nccs1 ZINC000154258452 928642899 /nfs/dbraw/zinc/64/28/99/928642899.db2.gz RSUJOVTXKQPBLC-HNNXBMFYSA-N 0 0 351.453 3.828 20 5 FHBDRN CCc1noc(CC)c1CNC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000154295984 928700531 /nfs/dbraw/zinc/70/05/31/928700531.db2.gz MIVBQMVZCYXULL-UHFFFAOYSA-N 0 0 372.425 3.582 20 5 FHBDRN Cc1nn(Cc2ccc(C(=O)N[C@H]3CC34CCCC4)cc2)c(C)c1[N+](=O)[O-] ZINC000430256322 928764265 /nfs/dbraw/zinc/76/42/65/928764265.db2.gz YFOOWVCDENCMTF-KRWDZBQOSA-N 0 0 368.437 3.519 20 5 FHBDRN O=C(N[C@@H]1c2ccccc2C[C@H]1O)c1cc2ccccc2c2cccnc12 ZINC000179599136 928851428 /nfs/dbraw/zinc/85/14/28/928851428.db2.gz VBUAZXQGEWEKER-IFMALSPDSA-N 0 0 354.409 3.776 20 5 FHBDRN CNc1ccc(C(=O)N2CC[C@@H](c3cccc(Cl)c3)C2)cc1[N+](=O)[O-] ZINC000548791316 937283925 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3.728 20 5 FHBDRN O=C(c1cccc(Cl)c1[N+](=O)[O-])N(Cc1ccco1)C[C@@H]1CCCO1 ZINC000175767925 928933366 /nfs/dbraw/zinc/93/33/66/928933366.db2.gz RYQYSLJISJEQPP-ZDUSSCGKSA-N 0 0 364.785 3.663 20 5 FHBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCC[C@H](c3ccccc3)CC2)s1 ZINC000608981715 928940671 /nfs/dbraw/zinc/94/06/71/928940671.db2.gz OZYRQCCXJHMSQR-AWEZNQCLSA-N 0 0 366.464 3.615 20 5 FHBDRN Cc1nc2ccccc2c(SCC(=O)Nc2cc([N+](=O)[O-])ccc2C)n1 ZINC000004361508 928942233 /nfs/dbraw/zinc/94/22/33/928942233.db2.gz RGXMHFWWSHYDCS-UHFFFAOYSA-N 0 0 368.418 3.886 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N(CC(F)F)CC1CCC1 ZINC000535611687 928948934 /nfs/dbraw/zinc/94/89/34/928948934.db2.gz ODRRPKUVSIGUMX-NSHDSACASA-N 0 0 358.410 3.969 20 5 FHBDRN CCOCCCn1c(NC(=O)c2ccc([N+](=O)[O-])s2)nc2ccccc21 ZINC000609063021 928964786 /nfs/dbraw/zinc/96/47/86/928964786.db2.gz QAXZNBQJQCXXCI-UHFFFAOYSA-N 0 0 374.422 3.685 20 5 FHBDRN CS(=O)(=O)c1ccc(OCCCSc2cccc([N+](=O)[O-])c2)cc1 ZINC000509652985 928971629 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3.610 20 5 FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)NCCCCCSC ZINC000274933379 929059766 /nfs/dbraw/zinc/05/97/66/929059766.db2.gz YITKBRUSBRZQET-UHFFFAOYSA-N 0 0 372.512 3.596 20 5 FHBDRN COc1cc(C(=O)NC[C@@H]2[C@@H](c3ccccc3)C2(C)C)c([N+](=O)[O-])cc1F ZINC000457997685 929073682 /nfs/dbraw/zinc/07/36/82/929073682.db2.gz OUFDMMHSSGBCLH-RDTXWAMCSA-N 0 0 372.396 3.912 20 5 FHBDRN CN(C)C(=O)c1ccc(OCc2coc(-c3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000134677139 929130139 /nfs/dbraw/zinc/13/01/39/929130139.db2.gz GXIWPMRZHNKLAZ-UHFFFAOYSA-N 0 0 367.361 3.531 20 5 FHBDRN C[C@@H]1CN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)C[C@H](c2ccccc2)O1 ZINC000134681804 929131398 /nfs/dbraw/zinc/13/13/98/929131398.db2.gz HFXTUDHKWOZMON-SJKOYZFVSA-N 0 0 360.797 3.850 20 5 FHBDRN O=C(Cc1cccc([N+](=O)[O-])c1)NCCc1c[nH]c2cc(Cl)ccc12 ZINC000610239184 929134722 /nfs/dbraw/zinc/13/47/22/929134722.db2.gz HLOXRZBTSNKGDY-UHFFFAOYSA-N 0 0 357.797 3.631 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)c2cnn(CC3CCC3)c2)c1C ZINC000890666391 929137429 /nfs/dbraw/zinc/13/74/29/929137429.db2.gz CZZKEYFUPJKBPO-CQSZACIVSA-N 0 0 356.426 3.699 20 5 FHBDRN CCNC(=O)Nc1cccc(NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)c1 ZINC000134697970 929150859 /nfs/dbraw/zinc/15/08/59/929150859.db2.gz AYCALUOKIVRHFH-UHFFFAOYSA-N 0 0 362.773 3.642 20 5 FHBDRN C[C@@H](C(=O)NCc1cc([N+](=O)[O-])c(F)cc1F)c1c(F)cccc1F ZINC001143376651 929166605 /nfs/dbraw/zinc/16/66/05/929166605.db2.gz JFKWURGBXFRVTP-MRVPVSSYSA-N 0 0 356.275 3.571 20 5 FHBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1Cl)c1cnn(CC2CCC2)c1 ZINC000890669378 929173150 /nfs/dbraw/zinc/17/31/50/929173150.db2.gz OLKLLGDHNYZKSF-NSHDSACASA-N 0 0 362.817 3.736 20 5 FHBDRN C[C@H](C(=O)Nc1ncc(C2CCOCC2)s1)c1cccc([N+](=O)[O-])c1 ZINC000578294531 929189453 /nfs/dbraw/zinc/18/94/53/929189453.db2.gz PLKUKGCGAKDBMR-NSHDSACASA-N 0 0 361.423 3.688 20 5 FHBDRN C[C@H](NC(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F)c1cnn(CC2CCC2)c1 ZINC000890671307 929197456 /nfs/dbraw/zinc/19/74/56/929197456.db2.gz HMUZWCFPHQWHGY-STQMWFEESA-N 0 0 374.416 3.711 20 5 FHBDRN CN(Cc1csc(Br)c1)C(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000134750402 929209815 /nfs/dbraw/zinc/20/98/15/929209815.db2.gz NOKMBMXUNIPTPM-UHFFFAOYSA-N 0 0 369.240 3.620 20 5 FHBDRN CC1=C[C@@H](C)CN(CC(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)C1 ZINC000430284053 929251407 /nfs/dbraw/zinc/25/14/07/929251407.db2.gz KHIAZKJNWJYEMG-GFCCVEGCSA-N 0 0 372.450 3.555 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)NCc1c(C)c2ccccc2n1C ZINC000471222460 929262503 /nfs/dbraw/zinc/26/25/03/929262503.db2.gz GWAMOQGVEDRIHJ-UHFFFAOYSA-N 0 0 367.405 3.724 20 5 FHBDRN O=C(CCc1nnc(C2CCCC2)o1)N1CCCc2ccc([N+](=O)[O-])cc21 ZINC000154815394 929287916 /nfs/dbraw/zinc/28/79/16/929287916.db2.gz XMWUHHLIKDEMAF-UHFFFAOYSA-N 0 0 370.409 3.547 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2noc(CN3CCCCc4ccccc43)n2)c1 ZINC000471227014 929313840 /nfs/dbraw/zinc/31/38/40/929313840.db2.gz GZXSLUOCXWFKIJ-UHFFFAOYSA-N 0 0 350.378 3.988 20 5 FHBDRN COc1cc(N2CCC(OCc3ccccc3)CC2)c(F)cc1[N+](=O)[O-] ZINC000535628713 929322406 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COc1ccc(CC(=O)N2C[C@@H](C)C[C@H]2c2cccc(F)c2)cc1[N+](=O)[O-] ZINC000610244131 929468878 /nfs/dbraw/zinc/46/88/78/929468878.db2.gz ANIBUYZDHMQZID-GUYCJALGSA-N 0 0 372.396 3.895 20 5 FHBDRN CCCN(CCc1ccccn1)C(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000609792831 929490497 /nfs/dbraw/zinc/49/04/97/929490497.db2.gz KEHJVTSGYPMFDZ-UHFFFAOYSA-N 0 0 361.829 3.667 20 5 FHBDRN C[C@@H]1CN(c2ccc(NC(=O)c3ccc(F)cc3[N+](=O)[O-])cc2)C[C@@H](C)O1 ZINC000125825133 937337388 /nfs/dbraw/zinc/33/73/88/937337388.db2.gz RWRCTOSCOKAZLY-CHWSQXEVSA-N 0 0 373.384 3.600 20 5 FHBDRN Cc1nnc(-c2cccc(NC(=O)c3c[nH]c4cc([N+](=O)[O-])ccc34)c2)o1 ZINC000610243250 929530636 /nfs/dbraw/zinc/53/06/36/929530636.db2.gz YRNZAHMYFBPVRZ-UHFFFAOYSA-N 0 0 363.333 3.687 20 5 FHBDRN O=[N+]([O-])c1cnccc1N1CCO[C@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000611763761 937338463 /nfs/dbraw/zinc/33/84/63/937338463.db2.gz HJYBEDVQESTROM-HNNXBMFYSA-N 0 0 353.300 3.587 20 5 FHBDRN CC[C@]1(CO)CCCN(C(=O)c2cc([N+](=O)[O-])ccc2SC(C)C)C1 ZINC000187216379 929589914 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CCc1ccc(C(=O)N(CC)[C@@H](COC)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000471444423 929632293 /nfs/dbraw/zinc/63/22/93/929632293.db2.gz RAESYDMNXPYJMR-LJQANCHMSA-N 0 0 370.449 3.877 20 5 FHBDRN Cc1c(NC(=O)N2C[C@@H](c3ccsc3)O[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000155471982 929669108 /nfs/dbraw/zinc/66/91/08/929669108.db2.gz LXORERYFDUTIHT-ZBEGNZNMSA-N 0 0 361.423 3.959 20 5 FHBDRN COc1cc(F)c([C@H](C)NC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)cc1OC ZINC000255125206 929670983 /nfs/dbraw/zinc/67/09/83/929670983.db2.gz UMZQECMFMQEIKY-PWWFUAJNSA-N 0 0 374.368 3.642 20 5 FHBDRN CO[C@@H](C)CN(C)c1ccc(C(=O)Nc2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000579969232 929671679 /nfs/dbraw/zinc/67/16/79/929671679.db2.gz POLJEJOHEFUOIW-AWEZNQCLSA-N 0 0 357.410 3.627 20 5 FHBDRN Cc1nn(C(F)F)c(C)c1COC(=O)/C=C/c1ccc([N+](=O)[O-])cc1 ZINC000784982220 929687045 /nfs/dbraw/zinc/68/70/45/929687045.db2.gz ABZUJVSQZFZBAZ-VMPITWQZSA-N 0 0 351.309 3.560 20 5 FHBDRN Cc1nn(C(F)F)c(C)c1COC(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000784982037 929690852 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930964866 /nfs/dbraw/zinc/96/48/66/930964866.db2.gz IQRDRJWHNQMJJT-HNNXBMFYSA-N 0 0 355.442 3.615 20 5 FHBDRN Cc1ccc(C)c(C2=NO[C@H](C(=O)Nc3ccc([N+](=O)[O-])c(C)c3)C2)c1 ZINC001266633595 930967622 /nfs/dbraw/zinc/96/76/22/930967622.db2.gz OVBACXCJKLORRH-SFHVURJKSA-N 0 0 353.378 3.652 20 5 FHBDRN COC(=O)c1cc(NC(=O)NC(C)(C)c2ccccc2[N+](=O)[O-])ccc1C ZINC000433001382 930970513 /nfs/dbraw/zinc/97/05/13/930970513.db2.gz ZTDZTXRFUFFGCB-UHFFFAOYSA-N 0 0 371.393 3.747 20 5 FHBDRN COc1ccc(-c2cnc(NC(=O)c3cccc([N+](=O)[O-])c3C)n2C)cc1 ZINC000580672659 930998974 /nfs/dbraw/zinc/99/89/74/930998974.db2.gz QSJLMDRBVNDAQU-UHFFFAOYSA-N 0 0 366.377 3.565 20 5 FHBDRN O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N(Cc1ccco1)C[C@@H]1CCCO1 ZINC000119266456 931000576 /nfs/dbraw/zinc/00/05/76/931000576.db2.gz JFIHHGIYKXZSGB-INIZCTEOSA-N 0 0 364.785 3.663 20 5 FHBDRN CN(C(=O)c1ccc(Br)c([N+](=O)[O-])c1)C(C1CC1)C1CC1 ZINC000050402477 931008644 /nfs/dbraw/zinc/00/86/44/931008644.db2.gz URIPSBWRUCLWSX-UHFFFAOYSA-N 0 0 353.216 3.618 20 5 FHBDRN CCO[C@@H](CCNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)C1CCCC1 ZINC000119280011 931018650 /nfs/dbraw/zinc/01/86/50/931018650.db2.gz HYQDCNDVBJVORY-IBGZPJMESA-N 0 0 373.453 3.720 20 5 FHBDRN CCO[C@H](CCNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)C1CCCC1 ZINC000119280162 931018847 /nfs/dbraw/zinc/01/88/47/931018847.db2.gz HYQDCNDVBJVORY-LJQANCHMSA-N 0 0 373.453 3.720 20 5 FHBDRN O=C(c1ccc(Oc2ccccc2)o1)N1CCc2ncc([N+](=O)[O-])cc2C1 ZINC000537578497 931040861 /nfs/dbraw/zinc/04/08/61/931040861.db2.gz PLCQVABUHGNVAB-UHFFFAOYSA-N 0 0 365.345 3.574 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)c1cc(OC)c(C(C)C)c(OC)c1 ZINC000510337478 931081457 /nfs/dbraw/zinc/08/14/57/931081457.db2.gz ZWVZXSVCRQKIHR-UHFFFAOYSA-N 0 0 374.393 3.996 20 5 FHBDRN CCS[C@@H]1CCC[C@H]1NC(=O)c1cc([N+](=O)[O-])ccc1Br ZINC000175823267 931084118 /nfs/dbraw/zinc/08/41/18/931084118.db2.gz MCDAVIJCHFKXCZ-CHWSQXEVSA-N 0 0 373.272 3.761 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N1CCc2c(F)cc(F)cc2C1 ZINC000134311380 931100635 /nfs/dbraw/zinc/10/06/35/931100635.db2.gz POZFKDDQRQUFJY-UHFFFAOYSA-N 0 0 366.751 3.654 20 5 FHBDRN COC(=O)[C@H](C)c1ccc(NC(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000580760849 931118823 /nfs/dbraw/zinc/11/88/23/931118823.db2.gz DLBLHVDVEVASLL-QWHCGFSZSA-N 0 0 356.378 3.614 20 5 FHBDRN Nc1c(C(=O)Nc2cc(F)ccc2OCC(F)(F)F)cccc1[N+](=O)[O-] ZINC000175857956 931169443 /nfs/dbraw/zinc/16/94/43/931169443.db2.gz KQKBMLMAXCGURH-UHFFFAOYSA-N 0 0 373.262 3.510 20 5 FHBDRN CCOC1(c2nc(Cc3c[nH]c4ccc([N+](=O)[O-])cc34)no2)CCCC1 ZINC000579883365 931197945 /nfs/dbraw/zinc/19/79/45/931197945.db2.gz BCQVDHYTLDIJMX-UHFFFAOYSA-N 0 0 356.382 3.856 20 5 FHBDRN O=Cc1ccc([N+](=O)[O-])c(OCc2cc(Br)ccc2F)c1 ZINC000050517587 931199859 /nfs/dbraw/zinc/19/98/59/931199859.db2.gz QWDPWDUCNMPRHL-UHFFFAOYSA-N 0 0 354.131 3.888 20 5 FHBDRN Cc1c(NC(=O)N(CCc2ccccc2)[C@H]2CCOC2)cccc1[N+](=O)[O-] ZINC000175871915 931203003 /nfs/dbraw/zinc/20/30/03/931203003.db2.gz UUXKSUFDDSNQSL-KRWDZBQOSA-N 0 0 369.421 3.769 20 5 FHBDRN CNC(=O)c1ccc(Oc2cc(Br)ccc2C)c([N+](=O)[O-])c1 ZINC000320044387 931214599 /nfs/dbraw/zinc/21/45/99/931214599.db2.gz RNYKUTOPJHOJBI-UHFFFAOYSA-N 0 0 365.183 3.818 20 5 FHBDRN O=C(c1cccc([N+](=O)[O-])c1Cl)N1CCCC[C@H]([C@H]2CCOC2)C1 ZINC000891327854 931216639 /nfs/dbraw/zinc/21/66/39/931216639.db2.gz HWMMGKHNUDDKCL-STQMWFEESA-N 0 0 352.818 3.527 20 5 FHBDRN CC(C)(C(=O)N1CCCC[C@@H]([C@@H]2CCOC2)C1)c1ccccc1[N+](=O)[O-] ZINC000891328134 931220426 /nfs/dbraw/zinc/22/04/26/931220426.db2.gz IQSJADDUEOTBCC-HZPDHXFCSA-N 0 0 360.454 3.538 20 5 FHBDRN O=C(c1cccc(Cl)c1[N+](=O)[O-])N1CCCC[C@H]([C@H]2CCOC2)C1 ZINC000891330076 931227679 /nfs/dbraw/zinc/22/76/79/931227679.db2.gz BUFIDUVQRNJNDU-STQMWFEESA-N 0 0 352.818 3.527 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)c2ccc(Br)o2)cc1[N+](=O)[O-] ZINC000177832547 931231717 /nfs/dbraw/zinc/23/17/17/931231717.db2.gz PUWUFLVYJFZCJP-SECBINFHSA-N 0 0 353.172 3.750 20 5 FHBDRN CN(Cc1cc(F)c(F)c(F)c1)C(=O)/C=C\c1ccc([N+](=O)[O-])cc1 ZINC000588390057 931232033 /nfs/dbraw/zinc/23/20/33/931232033.db2.gz OSRBATXQHJJWQB-DAXSKMNVSA-N 0 0 350.296 3.684 20 5 FHBDRN O=C(NCCc1cccnc1)c1cc([N+](=O)[O-])ccc1SC1CCCC1 ZINC000134350326 931255034 /nfs/dbraw/zinc/25/50/34/931255034.db2.gz HNYKCEWDDHAJKN-UHFFFAOYSA-N 0 0 371.462 3.997 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)c2cnc(-c3ccncc3)s2)cc1[N+](=O)[O-] ZINC000177842643 931262797 /nfs/dbraw/zinc/26/27/97/931262797.db2.gz DQPVQZVVMYERPI-GFCCVEGCSA-N 0 0 368.418 3.913 20 5 FHBDRN O=C(c1c(Cl)cccc1[N+](=O)[O-])N1CCCC[C@H]([C@H]2CCOC2)C1 ZINC000891335406 931263391 /nfs/dbraw/zinc/26/33/91/931263391.db2.gz NETCKEDWUBMRPN-STQMWFEESA-N 0 0 352.818 3.527 20 5 FHBDRN O=C(Nc1cccc(COCCc2ccccc2)c1)c1cc([N+](=O)[O-])c[nH]1 ZINC000146215305 931265015 /nfs/dbraw/zinc/26/50/15/931265015.db2.gz QDCQNXDAPUIVDG-UHFFFAOYSA-N 0 0 365.389 3.935 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)[C@H](C)Oc2ccc(F)c(F)c2)cc1[N+](=O)[O-] ZINC000177846840 931286645 /nfs/dbraw/zinc/28/66/45/931286645.db2.gz WWEHWFLLKZTSTD-NEPJUHHUSA-N 0 0 364.348 3.826 20 5 FHBDRN COc1cc(C(=O)NCC[C@@H]2CCC[C@@H](C)C2)cc([N+](=O)[O-])c1OC ZINC000610176520 931308056 /nfs/dbraw/zinc/30/80/56/931308056.db2.gz QRUAXANXVXLVLF-OLZOCXBDSA-N 0 0 350.415 3.558 20 5 FHBDRN CCOc1ccccc1OCC(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000177853647 931323670 /nfs/dbraw/zinc/32/36/70/931323670.db2.gz UQQOATYVZZUUSN-CQSZACIVSA-N 0 0 358.394 3.558 20 5 FHBDRN COc1cc(C(=O)N[C@@H](C)c2ncc(-c3ccccc3)o2)ccc1[N+](=O)[O-] ZINC000126055531 931326135 /nfs/dbraw/zinc/32/61/35/931326135.db2.gz XBEAODNLXLTZIO-LBPRGKRZSA-N 0 0 367.361 3.749 20 5 FHBDRN COc1ccc(CCC(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1F ZINC000177860184 931327613 /nfs/dbraw/zinc/32/76/13/931327613.db2.gz SQFUWUJHQHICBP-CYBMUJFWSA-N 0 0 360.385 3.861 20 5 FHBDRN CC(=O)c1cccc(O[C@@H](C)C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000177862235 931331452 /nfs/dbraw/zinc/33/14/52/931331452.db2.gz LPSAFBLMGLOFMQ-HIFRSBDPSA-N 0 0 370.405 3.751 20 5 FHBDRN CC(=O)c1cccc(O[C@H](C)C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000177862211 931331662 /nfs/dbraw/zinc/33/16/62/931331662.db2.gz LPSAFBLMGLOFMQ-UKRRQHHQSA-N 0 0 370.405 3.751 20 5 FHBDRN COc1ccc(OC2CCN(Cc3ccc([N+](=O)[O-])cc3OC)CC2)cc1 ZINC000580929067 931362386 /nfs/dbraw/zinc/36/23/86/931362386.db2.gz NFNQJCHTYXGRDL-UHFFFAOYSA-N 0 0 372.421 3.655 20 5 FHBDRN Cc1cccc(C)c1NCC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000126091904 931383703 /nfs/dbraw/zinc/38/37/03/931383703.db2.gz HLOJCRYNGKDJLY-UHFFFAOYSA-N 0 0 353.422 3.815 20 5 FHBDRN Cc1nnc(-c2cccc(C(=O)N[C@@H](C)c3ccc(C)c([N+](=O)[O-])c3)c2)o1 ZINC000177863408 931392144 /nfs/dbraw/zinc/39/21/44/931392144.db2.gz SMKWONNFHFCYGZ-LBPRGKRZSA-N 0 0 366.377 3.753 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)c2cccnc2N2CCCCC2)cc1[N+](=O)[O-] ZINC000177871883 931392877 /nfs/dbraw/zinc/39/28/77/931392877.db2.gz XEEYYLFCKFBRAH-HNNXBMFYSA-N 0 0 368.437 3.780 20 5 FHBDRN O=C(CCn1cnc2ccccc21)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000126107641 931396676 /nfs/dbraw/zinc/39/66/76/931396676.db2.gz CXUDSIKCOANZPB-UHFFFAOYSA-N 0 0 364.405 3.526 20 5 FHBDRN O=[N+]([O-])c1ccc(OS(=O)(=O)c2ccc(Cl)s2)c(Cl)c1 ZINC000021820284 931399369 /nfs/dbraw/zinc/39/93/69/931399369.db2.gz LYKRVFBLTNBTOG-UHFFFAOYSA-N 0 0 354.192 3.731 20 5 FHBDRN Cc1nnc([C@@H](C)OC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)s1 ZINC000785031303 931418893 /nfs/dbraw/zinc/41/88/93/931418893.db2.gz IRDBFSRRFBJBTF-SNVBAGLBSA-N 0 0 365.414 3.759 20 5 FHBDRN CCS[C@@H]1CCCC[C@H]1[NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000175873465 931423449 /nfs/dbraw/zinc/42/34/49/931423449.db2.gz ORTLDCMCEPEXLR-HZPDHXFCSA-N 0 0 352.456 3.615 20 5 FHBDRN Cc1ccc2ncc(-c3noc(-c4cc(Cl)cc([N+](=O)[O-])c4)n3)n2c1 ZINC000580980745 931441838 /nfs/dbraw/zinc/44/18/38/931441838.db2.gz YUFRUXNOSFKBOS-UHFFFAOYSA-N 0 0 355.741 3.921 20 5 FHBDRN CC(C)c1cc(NC(=O)c2ccc([N+](=O)[O-])cn2)n(-c2ccccc2)n1 ZINC000581004211 931463188 /nfs/dbraw/zinc/46/31/88/931463188.db2.gz RXYBJZBUYKGIBJ-UHFFFAOYSA-N 0 0 351.366 3.551 20 5 FHBDRN Nc1cc([N+](=O)[O-])ccc1C(=O)OCc1csc(-c2ccccc2F)n1 ZINC000728314558 931472120 /nfs/dbraw/zinc/47/21/20/931472120.db2.gz SDLNENJWGQOHQG-UHFFFAOYSA-N 0 0 373.365 3.797 20 5 FHBDRN CC[C@H](C)c1ccc(NC(=O)COC(=O)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000003365904 931478284 /nfs/dbraw/zinc/47/82/84/931478284.db2.gz FHXRXGNEBPDNEU-AWEZNQCLSA-N 0 0 370.405 3.833 20 5 FHBDRN O=[N+]([O-])c1ccc(NCc2cccnc2-n2ccnc2)cc1C(F)(F)F ZINC000160734681 931480656 /nfs/dbraw/zinc/48/06/56/931480656.db2.gz CLQIITWEODATHM-UHFFFAOYSA-N 0 0 363.299 3.806 20 5 FHBDRN C/C(=C\c1ccccc1)CN(C)S(=O)(=O)c1cc(C)cc([N+](=O)[O-])c1C ZINC001211508024 931540172 /nfs/dbraw/zinc/54/01/72/931540172.db2.gz WXYBOOYXZAYAQX-XNTDXEJSSA-N 0 0 374.462 3.936 20 5 FHBDRN CCc1nnc([C@H](C)OC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)o1 ZINC000785032939 931551373 /nfs/dbraw/zinc/55/13/73/931551373.db2.gz UVVJQVNPNKQICJ-NSHDSACASA-N 0 0 363.373 3.545 20 5 FHBDRN O=C(c1c[nH]nc1[N+](=O)[O-])N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000581108686 931572505 /nfs/dbraw/zinc/57/25/05/931572505.db2.gz AYIAOLKZIVGFMG-GFCCVEGCSA-N 0 0 355.181 3.602 20 5 FHBDRN COc1cc(COC(=O)/C=C/C(C)C)c([N+](=O)[O-])cc1OCC(F)F ZINC000785036367 931587552 /nfs/dbraw/zinc/58/75/52/931587552.db2.gz QDUMWFNRUUKREE-SNAWJCMRSA-N 0 0 359.325 3.503 20 5 FHBDRN COc1ccccc1[C@@H](CNC(=O)c1ccc([N+](=O)[O-])s1)OC(C)C ZINC000187395368 931605226 /nfs/dbraw/zinc/60/52/26/931605226.db2.gz VZYCTZXNOBYTCH-CQSZACIVSA-N 0 0 364.423 3.561 20 5 FHBDRN O=C(COc1cccc([N+](=O)[O-])c1)NCc1ccc(OC2CCCC2)cc1 ZINC000581145327 931614887 /nfs/dbraw/zinc/61/48/87/931614887.db2.gz AXKMCBUXQCJEHU-UHFFFAOYSA-N 0 0 370.405 3.611 20 5 FHBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)c1cncc(C(F)(F)F)c1 ZINC000581154045 931626384 /nfs/dbraw/zinc/62/63/84/931626384.db2.gz AHANSERAGIPNLG-UHFFFAOYSA-N 0 0 367.327 3.761 20 5 FHBDRN CC[C@H](C)n1ncc(C(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)c1C ZINC000581156318 931628209 /nfs/dbraw/zinc/62/82/09/931628209.db2.gz MTTFNVOXPRDRGL-LBPRGKRZSA-N 0 0 369.425 3.525 20 5 FHBDRN Cc1cc(N2CCc3ccc(O)cc3C2)c(Br)cc1[N+](=O)[O-] ZINC000581222617 931697456 /nfs/dbraw/zinc/69/74/56/931697456.db2.gz BRZWROMHWFACNN-UHFFFAOYSA-N 0 0 363.211 3.934 20 5 FHBDRN CCON(C(=O)c1ccc(N2C[C@@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1)C(C)C ZINC001143390028 931721475 /nfs/dbraw/zinc/72/14/75/931721475.db2.gz KQMOWFWBUFNZQW-GJZGRUSLSA-N 0 0 363.458 3.879 20 5 FHBDRN Cc1ccc([C@H]2C[C@@H](C)N(c3nc4ccc([N+](=O)[O-])cc4c(=O)[nH]3)C2)cc1 ZINC000561326319 931733746 /nfs/dbraw/zinc/73/37/46/931733746.db2.gz UFLYGPPQZJZSAN-HIFRSBDPSA-N 0 0 364.405 3.934 20 5 FHBDRN Cc1ccc([C@@H]2C[C@@H](C)N(c3nc4ccc([N+](=O)[O-])cc4c(=O)[nH]3)C2)cc1 ZINC000561326323 931735098 /nfs/dbraw/zinc/73/50/98/931735098.db2.gz UFLYGPPQZJZSAN-UKRRQHHQSA-N 0 0 364.405 3.934 20 5 FHBDRN CCCCOc1cccc(NC(=O)C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000121290423 931735592 /nfs/dbraw/zinc/73/55/92/931735592.db2.gz JWFDSUMFFMIMLP-UHFFFAOYSA-N 0 0 371.393 3.659 20 5 FHBDRN CN(C[C@H]1CCCO[C@H]1c1ccccc1)C(=O)c1ccccc1[N+](=O)[O-] ZINC000050867633 931758727 /nfs/dbraw/zinc/75/87/27/931758727.db2.gz YQLDWJLLEHORIS-APWZRJJASA-N 0 0 354.406 3.835 20 5 FHBDRN CN(C[C@H]1CCCO[C@@H]1c1ccccc1)C(=O)c1ccc([N+](=O)[O-])cc1 ZINC000050869907 931759224 /nfs/dbraw/zinc/75/92/24/931759224.db2.gz WYOYEAWBCKIFOU-IEBWSBKVSA-N 0 0 354.406 3.835 20 5 FHBDRN Cn1ncc([N+](=O)[O-])c1C(=O)Nc1ccccc1Oc1cc(F)cc(F)c1 ZINC000126400178 931797219 /nfs/dbraw/zinc/79/72/19/931797219.db2.gz BDLHPNKSRZDONG-UHFFFAOYSA-N 0 0 374.303 3.651 20 5 FHBDRN O=C(NC[C@H]1CCO[C@@H]1c1ccccc1)c1ccc([N+](=O)[O-])cc1Cl ZINC000430551933 931800097 /nfs/dbraw/zinc/80/00/97/931800097.db2.gz QYIQWNIZXNYESH-CXAGYDPISA-N 0 0 360.797 3.756 20 5 FHBDRN CC1(C)CC(NC(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)CC(C)(C)C1 ZINC001266700773 931828653 /nfs/dbraw/zinc/82/86/53/931828653.db2.gz VGUXOEQVNOLVRX-UHFFFAOYSA-N 0 0 362.426 3.701 20 5 FHBDRN O=[N+]([O-])c1ccnn1C[C@@H]1CCCO[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000581321396 931831851 /nfs/dbraw/zinc/83/18/51/931831851.db2.gz JXZNADNUAPBWRN-WFASDCNBSA-N 0 0 355.316 3.978 20 5 FHBDRN O=C(CCSc1ncccc1[N+](=O)[O-])N[C@H]1CCCc2ccccc21 ZINC000126462298 931838035 /nfs/dbraw/zinc/83/80/35/931838035.db2.gz KGPYCCUDPFIXPU-HNNXBMFYSA-N 0 0 357.435 3.666 20 5 FHBDRN O=C(c1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CC[C@H]2[C@@H](C(F)(F)F)[C@H]21 ZINC000610494673 931852313 /nfs/dbraw/zinc/85/23/13/931852313.db2.gz KMHYGQRYJPXQHC-GDPRMGEGSA-N 0 0 368.233 3.636 20 5 FHBDRN CC(=O)c1cc(N2C[C@@H](C)O[C@H](c3ccc(F)cc3)C2)ccc1[N+](=O)[O-] ZINC000561334900 931859139 /nfs/dbraw/zinc/85/91/39/931859139.db2.gz IMOBEIWAXIAPHL-BLVKFPJESA-N 0 0 358.369 3.903 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CC[C@H](c2ccccc2)[C@@H](C)C1 ZINC000581343105 931860735 /nfs/dbraw/zinc/86/07/35/931860735.db2.gz YWZIZDPBHDKXGM-WMZOPIPTSA-N 0 0 367.449 3.967 20 5 FHBDRN CC(C)(NC(=O)c1coc(-c2ccccc2)n1)c1ccc([N+](=O)[O-])cc1 ZINC000430563008 931864767 /nfs/dbraw/zinc/86/47/67/931864767.db2.gz HPUWTPVNBGYTLH-UHFFFAOYSA-N 0 0 351.362 3.915 20 5 FHBDRN C[C@@H](NC(=O)c1ccc(Br)cc1F)c1cccc([N+](=O)[O-])c1 ZINC000048383044 931879620 /nfs/dbraw/zinc/87/96/20/931879620.db2.gz MCTCEPIPZRWNLI-SECBINFHSA-N 0 0 367.174 3.987 20 5 FHBDRN Cc1cc(NC(=O)C(=O)N[C@H](C)c2ccccc2[N+](=O)[O-])ccc1C1CC1 ZINC000477088803 931910805 /nfs/dbraw/zinc/91/08/05/931910805.db2.gz MJPQUYNBPREZAR-CYBMUJFWSA-N 0 0 367.405 3.597 20 5 FHBDRN O=[N+]([O-])c1ccc(CN2CCc3c(ncn3-c3ccc(F)cc3)C2)c(F)c1 ZINC000510401695 931919599 /nfs/dbraw/zinc/91/95/99/931919599.db2.gz JDMWOPQHSKYKEY-UHFFFAOYSA-N 0 0 370.359 3.617 20 5 FHBDRN C[C@@H](NC(=O)NCC[C@H]1CNc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000891380521 931969787 /nfs/dbraw/zinc/96/97/87/931969787.db2.gz CHLDIMSRAKVBRL-HIFRSBDPSA-N 0 0 354.410 3.554 20 5 FHBDRN C[C@H](NC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1cccc(O)c1 ZINC000175887875 931971397 /nfs/dbraw/zinc/97/13/97/931971397.db2.gz OXKNGCSYZHLBBL-VIFPVBQESA-N 0 0 354.284 3.810 20 5 FHBDRN C[C@H]1C[C@H]1c1ccc(CNc2cc(CN3CCOCC3)ccc2[N+](=O)[O-])o1 ZINC000581409688 931983334 /nfs/dbraw/zinc/98/33/34/931983334.db2.gz VMUYGTZRPOJMIU-WMLDXEAASA-N 0 0 371.437 3.756 20 5 FHBDRN O=[N+]([O-])c1cccc(CN(Cc2cc(F)cc3c2OCOC3)C2CC2)c1 ZINC000177999124 932003152 /nfs/dbraw/zinc/00/31/52/932003152.db2.gz QLVRUIQOWQRFCN-UHFFFAOYSA-N 0 0 358.369 3.765 20 5 FHBDRN CN(C)C(=O)c1cccc(CSCCCOc2ccc([N+](=O)[O-])cc2)c1 ZINC000060515006 932037646 /nfs/dbraw/zinc/03/76/46/932037646.db2.gz QPPYISSBNMQXLR-UHFFFAOYSA-N 0 0 374.462 3.999 20 5 FHBDRN Cc1cc(C)cc([C@@H](C)NC(=O)C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)c1 ZINC000121370999 932049436 /nfs/dbraw/zinc/04/94/36/932049436.db2.gz MMNDINGVJAYJLN-OAHLLOKOSA-N 0 0 369.421 3.644 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2noc(CN3CC[C@@H]3c3cccc(F)c3)n2)c1 ZINC000610505652 932053086 /nfs/dbraw/zinc/05/30/86/932053086.db2.gz QABJBMITZXQPTK-MRXNPFEDSA-N 0 0 354.341 3.731 20 5 FHBDRN CCOc1cc(/C=C\C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)ccc1O ZINC000588412361 932073169 /nfs/dbraw/zinc/07/31/69/932073169.db2.gz WUAUESMXCFJGAH-CHOZFAJLSA-N 0 0 356.378 3.590 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N(C2CC2)C2CCCCC2)c1C ZINC000106186307 932079023 /nfs/dbraw/zinc/07/90/23/932079023.db2.gz DRJXUICRSSHQGS-UHFFFAOYSA-N 0 0 352.456 3.697 20 5 FHBDRN Cc1csc([C@H]2CCCN(Cc3nc4cc([N+](=O)[O-])ccc4[nH]3)C2)n1 ZINC000581467717 932104739 /nfs/dbraw/zinc/10/47/39/932104739.db2.gz CQGNWNLIGVZCII-LBPRGKRZSA-N 0 0 357.439 3.616 20 5 FHBDRN O=C(NC/C=C/c1ccccc1)c1c(Br)cccc1[N+](=O)[O-] ZINC001266734757 932113845 /nfs/dbraw/zinc/11/38/45/932113845.db2.gz KZSVCMQTESKHOA-VMPITWQZSA-N 0 0 361.195 3.801 20 5 FHBDRN Cc1nc2ccccc2c2c(NC(=O)C[C@H]3COC(=O)C3)c3ccccc3n21 ZINC000160926937 932182750 /nfs/dbraw/zinc/18/27/50/932182750.db2.gz IDFCLGAQDJIELH-CQSZACIVSA-N 0 0 373.412 3.841 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(C(=O)NCC2(Cc3ccccc3)CCCC2)n1 ZINC001266753483 932199616 /nfs/dbraw/zinc/19/96/16/932199616.db2.gz JEXYWSMBDYFAKS-UHFFFAOYSA-N 0 0 353.422 3.831 20 5 FHBDRN CN(Cc1cccc(OC(F)(F)F)c1)C(=O)c1csc([N+](=O)[O-])c1 ZINC000178069116 932268723 /nfs/dbraw/zinc/26/87/23/932268723.db2.gz GCIKXSLDRRPUOL-UHFFFAOYSA-N 0 0 360.313 3.827 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N[C@H](C)c1ccc2c(c1)CC(=O)N2 ZINC000276369160 932278057 /nfs/dbraw/zinc/27/80/57/932278057.db2.gz CIKINPUMXCUPNP-GFCCVEGCSA-N 0 0 368.393 3.589 20 5 FHBDRN CCn1nc(C)c(CNC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)c1C ZINC000066478559 932297610 /nfs/dbraw/zinc/29/76/10/932297610.db2.gz YFZTVEXNUZEEGM-UHFFFAOYSA-N 0 0 358.423 3.573 20 5 FHBDRN Cc1sc(NC(=O)CCn2cccc2)nc1-c1cccc([N+](=O)[O-])c1 ZINC000610512991 932313526 /nfs/dbraw/zinc/31/35/26/932313526.db2.gz VDDHKLZABMGMFF-UHFFFAOYSA-N 0 0 356.407 3.857 20 5 FHBDRN CCc1cc(NC[C@H](C)c2ccncc2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000610517120 932335678 /nfs/dbraw/zinc/33/56/78/932335678.db2.gz ZFLOLSULSZICLY-AWEZNQCLSA-N 0 0 363.421 3.647 20 5 FHBDRN Cc1c(NC(=O)N(C)Cc2ccncc2)cc([N+](=O)[O-])cc1C(F)(F)F ZINC000933335375 932338891 /nfs/dbraw/zinc/33/88/91/932338891.db2.gz BBHXRXRCINVROV-UHFFFAOYSA-N 0 0 368.315 3.981 20 5 FHBDRN COc1c(C(=O)Nc2cc(-c3ccco3)nn2C(C)C)cccc1[N+](=O)[O-] ZINC000477128464 932346248 /nfs/dbraw/zinc/34/62/48/932346248.db2.gz RAIWWMBIJNJQIV-UHFFFAOYSA-N 0 0 370.365 3.893 20 5 FHBDRN COCCCC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1OC)c1ccccc1 ZINC000477138572 932349334 /nfs/dbraw/zinc/34/93/34/932349334.db2.gz NRVQWGSUUZSJHF-KRWDZBQOSA-N 0 0 372.421 3.891 20 5 FHBDRN CCc1cc(NC(=O)[C@@H]2C[C@@H]3C[C@@H]3C[C@H]2C)c2cc([N+](=O)[O-])ccc2n1 ZINC001266777453 932363642 /nfs/dbraw/zinc/36/36/42/932363642.db2.gz QORNWJBAZZBYAU-LMOYCYGVSA-N 0 0 353.422 3.748 20 5 FHBDRN Cc1nn(C)cc1[C@H]1CCCN1c1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000610726483 932370556 /nfs/dbraw/zinc/37/05/56/932370556.db2.gz WORDLWNRBCWFFM-CQSZACIVSA-N 0 0 354.332 3.997 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCCO[C@H]1c1ccccc1 ZINC000145331857 932385169 /nfs/dbraw/zinc/38/51/69/932385169.db2.gz QGORNPZKQFSRHT-BEFAXECRSA-N 0 0 370.405 3.501 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCCO[C@H]1c1ccccc1 ZINC000145331645 932385277 /nfs/dbraw/zinc/38/52/77/932385277.db2.gz QGORNPZKQFSRHT-KXBFYZLASA-N 0 0 370.405 3.501 20 5 FHBDRN CC(C)n1c(CNC(=O)Cc2ccc([N+](=O)[O-])cc2F)nc2ccccc21 ZINC000477237836 932426891 /nfs/dbraw/zinc/42/68/91/932426891.db2.gz VUJZVCJASBPNMN-UHFFFAOYSA-N 0 0 370.384 3.523 20 5 FHBDRN COCCC1(CNC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)CCCCC1 ZINC000477251667 932433072 /nfs/dbraw/zinc/43/30/72/932433072.db2.gz ROSFMPIBQVPYHL-UHFFFAOYSA-N 0 0 362.470 3.976 20 5 FHBDRN C[C@@H]1Sc2ccccc2N(C(=O)COc2ccccc2[N+](=O)[O-])[C@H]1C ZINC000430637683 932477853 /nfs/dbraw/zinc/47/78/53/932477853.db2.gz BODLEDRNXPTBJR-STQMWFEESA-N 0 0 358.419 3.890 20 5 FHBDRN C[C@H]1Sc2ccccc2N(C(=O)COc2ccccc2[N+](=O)[O-])[C@@H]1C ZINC000430637680 932477995 /nfs/dbraw/zinc/47/79/95/932477995.db2.gz BODLEDRNXPTBJR-CHWSQXEVSA-N 0 0 358.419 3.890 20 5 FHBDRN CCOc1cc(C(=O)NCC2(C)CCC(C)CC2)c([N+](=O)[O-])cc1OC ZINC000477351030 932487650 /nfs/dbraw/zinc/48/76/50/932487650.db2.gz CQFMCAAHJVXLDZ-UHFFFAOYSA-N 0 0 364.442 3.948 20 5 FHBDRN COc1cc(CN(C)CCCOc2ccccc2C)c([N+](=O)[O-])cc1OC ZINC000510450664 932500531 /nfs/dbraw/zinc/50/05/31/932500531.db2.gz XAIMSZPMCJZRLY-UHFFFAOYSA-N 0 0 374.437 3.821 20 5 FHBDRN COC(=O)c1ccc(CNc2ccc([N+](=O)[O-])c3cnccc23)cc1OC ZINC000157415906 932511166 /nfs/dbraw/zinc/51/11/66/932511166.db2.gz RLXRYKZIXFMMEW-UHFFFAOYSA-N 0 0 367.361 3.550 20 5 FHBDRN O=C1Nc2cc(Cl)c([N+](=O)[O-])cc2/C1=C/c1csc([N+](=O)[O-])c1 ZINC000255366999 932522282 /nfs/dbraw/zinc/52/22/82/932522282.db2.gz GENOCVNJEVMCHA-QPIMQUGISA-N 0 0 351.727 3.711 20 5 FHBDRN C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000477401199 932536891 /nfs/dbraw/zinc/53/68/91/932536891.db2.gz SBHSNWVEZLBQAB-BXUZGUMPSA-N 0 0 369.343 3.739 20 5 FHBDRN Cc1c(CNS(=O)(=O)c2ccc(CC(C)C)cc2)cccc1[N+](=O)[O-] ZINC001211518071 932560196 /nfs/dbraw/zinc/56/01/96/932560196.db2.gz HPTUZTDSRRKHLO-UHFFFAOYSA-N 0 0 362.451 3.580 20 5 FHBDRN C[C@H](C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)N1CCCCC1 ZINC000175930033 932569961 /nfs/dbraw/zinc/56/99/61/932569961.db2.gz HEAUOVZZWCCEEL-GFCCVEGCSA-N 0 0 360.439 3.531 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])c(Cl)c1)N1CCOc2c(Cl)cccc21 ZINC000161013898 932586516 /nfs/dbraw/zinc/58/65/16/932586516.db2.gz GKABWDGXMMQELE-UHFFFAOYSA-N 0 0 353.161 3.941 20 5 FHBDRN Cc1c2ccccc2n(C)c1CNC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000471686005 932605144 /nfs/dbraw/zinc/60/51/44/932605144.db2.gz CTAULHDMQJSRPN-AWEZNQCLSA-N 0 0 366.421 3.955 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)Nc2c(-c3ccncc3)nc3ccccn32)c1 ZINC000430654246 932610930 /nfs/dbraw/zinc/61/09/30/932610930.db2.gz PYMFEXURQCYQBU-UHFFFAOYSA-N 0 0 373.372 3.865 20 5 FHBDRN C[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)CCN1Cc1csc([N+](=O)[O-])c1 ZINC000134630974 932612575 /nfs/dbraw/zinc/61/25/75/932612575.db2.gz OQLUXANVNLSTAZ-YPMHNXCESA-N 0 0 355.460 3.534 20 5 FHBDRN CCC(=O)c1ccc(C(=O)Nc2ccnn2-c2ccc([N+](=O)[O-])cc2)cc1 ZINC000471695843 932635548 /nfs/dbraw/zinc/63/55/48/932635548.db2.gz CHHISPJYWUFAHV-UHFFFAOYSA-N 0 0 364.361 3.626 20 5 FHBDRN CC(C)n1nc2c(c1NC(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1)CCC2 ZINC000471697035 932636940 /nfs/dbraw/zinc/63/69/40/932636940.db2.gz LBOZMPVFRUBFBL-GFCCVEGCSA-N 0 0 374.466 3.980 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(NCc2ccc(NC(=O)C(C)C)cc2)c1 ZINC000302059605 932657097 /nfs/dbraw/zinc/65/70/97/932657097.db2.gz BDVUUQKLHAPWFX-UHFFFAOYSA-N 0 0 371.393 3.588 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1)N1CCc2cc(Br)cc(F)c21 ZINC000178148001 932677197 /nfs/dbraw/zinc/67/71/97/932677197.db2.gz ZKMKZUDNHNNKJJ-UHFFFAOYSA-N 0 0 365.158 3.699 20 5 FHBDRN CC1(C)[C@H](NC(=O)c2ccc(F)cc2[N+](=O)[O-])C[C@@H]1OCc1ccccc1 ZINC000471710569 932681066 /nfs/dbraw/zinc/68/10/66/932681066.db2.gz CCKZBTKKJXPRSX-MSOLQXFVSA-N 0 0 372.396 3.848 20 5 FHBDRN O=[N+]([O-])c1cnc(NC[C@]2(O)CCC[C@H](C(F)(F)F)C2)c(Cl)c1 ZINC000302495841 932688492 /nfs/dbraw/zinc/68/84/92/932688492.db2.gz BIIVAEKOUCMOCU-UFBFGSQYSA-N 0 0 353.728 3.539 20 5 FHBDRN Nc1c(C(=O)N2CCC[C@H]2c2nc3ccccc3s2)cccc1[N+](=O)[O-] ZINC000178154241 932702323 /nfs/dbraw/zinc/70/23/23/932702323.db2.gz BXNPSGMSGGPTQX-AWEZNQCLSA-N 0 0 368.418 3.764 20 5 FHBDRN COc1cc(NC2CCN(c3ccsc3[N+](=O)[O-])CC2)cc(OC)c1 ZINC000610542237 932728859 /nfs/dbraw/zinc/72/88/59/932728859.db2.gz HCPDPUKGQWKZFP-UHFFFAOYSA-N 0 0 363.439 3.754 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cn1)N1C[C@H](c2ccccc2)[C@@H]2CCCC[C@@H]21 ZINC000548254603 932735517 /nfs/dbraw/zinc/73/55/17/932735517.db2.gz KFRKUGIZMDVNEB-SCTDSRPQSA-N 0 0 351.406 3.788 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(Oc2ccc(S(=O)(=O)c3ccccc3)cc2)n1 ZINC000178175731 932758848 /nfs/dbraw/zinc/75/88/48/932758848.db2.gz XMNXJZUPYURRFH-UHFFFAOYSA-N 0 0 370.386 3.923 20 5 FHBDRN Cc1n[nH]c(C)c1[C@H](C)CC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000135274352 932788908 /nfs/dbraw/zinc/78/89/08/932788908.db2.gz WPWQDPIKYWPKAV-GFCCVEGCSA-N 0 0 356.426 3.620 20 5 FHBDRN Cc1cc(OCC(=O)Nc2ccc3nn(C(C)C)cc3c2)ccc1[N+](=O)[O-] ZINC000430679527 932869210 /nfs/dbraw/zinc/86/92/10/932869210.db2.gz MIPFDDQWAJNWQU-UHFFFAOYSA-N 0 0 368.393 3.851 20 5 FHBDRN C[C@H]1C[C@@H](NC(=O)OC(C)(C)C)CCN1Cc1ccc([N+](=O)[O-])cc1F ZINC000134664385 932895109 /nfs/dbraw/zinc/89/51/09/932895109.db2.gz GRKIKEOHDTUWGB-JSGCOSHPSA-N 0 0 367.421 3.612 20 5 FHBDRN COCCC1(CNC(=O)c2ccc(Cl)cc2[N+](=O)[O-])CCCCC1 ZINC000187471599 932899221 /nfs/dbraw/zinc/89/92/21/932899221.db2.gz WTSHOLBJEUWFRQ-UHFFFAOYSA-N 0 0 354.834 3.965 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(NCc2cccc(COC3CCOCC3)c2)n1 ZINC000178222705 932911370 /nfs/dbraw/zinc/91/13/70/932911370.db2.gz WQAXNKWPYFCZDW-UHFFFAOYSA-N 0 0 357.410 3.606 20 5 FHBDRN C[C@H]1COCC[C@@H]1c1noc(CCc2c(Cl)cccc2[N+](=O)[O-])n1 ZINC000924052657 932934755 /nfs/dbraw/zinc/93/47/55/932934755.db2.gz MZXQEEGPLFSQEH-QWRGUYRKSA-N 0 0 351.790 3.556 20 5 FHBDRN C[C@H]1COCC[C@H]1c1noc(CCc2c(Cl)cccc2[N+](=O)[O-])n1 ZINC000924052660 932934998 /nfs/dbraw/zinc/93/49/98/932934998.db2.gz MZXQEEGPLFSQEH-WDEREUQCSA-N 0 0 351.790 3.556 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@@H](C)c1ccc(F)c2ccccc21 ZINC000561629563 932943286 /nfs/dbraw/zinc/94/32/86/932943286.db2.gz RTNSURHLSSQXKA-LBPRGKRZSA-N 0 0 370.384 3.660 20 5 FHBDRN COC(=O)c1ccc(F)c(NC(=O)/C(C)=C\c2ccc([N+](=O)[O-])cc2)c1 ZINC000588436328 932948494 /nfs/dbraw/zinc/94/84/94/932948494.db2.gz LAUZEVFUTAMWJZ-LUAWRHEFSA-N 0 0 358.325 3.563 20 5 FHBDRN COC(=O)/C=C\c1ccc(NC[C@H](C)c2nc(C)cs2)c([N+](=O)[O-])c1 ZINC000588436553 932954236 /nfs/dbraw/zinc/95/42/36/932954236.db2.gz NQFMPEYCRKWFFF-XOIDGJRKSA-N 0 0 361.423 3.762 20 5 FHBDRN CC(=O)Nc1cc(NC(=O)/C(C)=C\c2ccc([N+](=O)[O-])cc2)ccc1C ZINC000588437025 932960095 /nfs/dbraw/zinc/96/00/95/932960095.db2.gz VVGQFTQXLWUUOC-RAXLEYEMSA-N 0 0 353.378 3.904 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1CN[C@H](c1cnn(C)c1)c1ccc(F)cc1 ZINC000187512466 932966490 /nfs/dbraw/zinc/96/64/90/932966490.db2.gz YVTVEWRNKSSPJH-IBGZPJMESA-N 0 0 354.385 3.655 20 5 FHBDRN O=C1CCc2cc(NCc3cccc([N+](=O)[O-])c3)ccc2N1CC1CC1 ZINC000187524107 932976675 /nfs/dbraw/zinc/97/66/75/932976675.db2.gz HWWUQYYAEQBBHX-UHFFFAOYSA-N 0 0 351.406 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Cn1c(COc2cc(F)cc([N+](=O)[O-])c2)nnc1-c1ccc(Cl)cc1 ZINC000471856497 933167328 /nfs/dbraw/zinc/16/73/28/933167328.db2.gz KZRGYKATCRBNJE-UHFFFAOYSA-N 0 0 362.748 3.762 20 5 FHBDRN C[C@H]1CCCC[C@H]1CCNC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000510536095 933197724 /nfs/dbraw/zinc/19/77/24/933197724.db2.gz FWWWFURYLKTVFP-GJZGRUSLSA-N 0 0 356.426 3.727 20 5 FHBDRN C[C@H]1CCCC[C@H]1CCNC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000510542809 933206751 /nfs/dbraw/zinc/20/67/51/933206751.db2.gz CEOOARAZGYKEMU-GJZGRUSLSA-N 0 0 356.426 3.727 20 5 FHBDRN O=[N+]([O-])c1ccc(SC2CCCCC2)c(S(=O)(=O)N2CCCC2)c1 ZINC000098065908 933245092 /nfs/dbraw/zinc/24/50/92/933245092.db2.gz WBTAYAFEDBMXEN-UHFFFAOYSA-N 0 0 370.496 3.804 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(OCc2nnc(-c3ccc(Cl)cc3)n2C)n1 ZINC000471863867 933246225 /nfs/dbraw/zinc/24/62/25/933246225.db2.gz PZYUTNUYXMEYCJ-UHFFFAOYSA-N 0 0 373.800 3.635 20 5 FHBDRN CC[C@@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2SCCOC)CC1 ZINC000157997785 933247142 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C[C@H](c1ccccc1)N(C)C(=O)COc1ccc([N+](=O)[O-])c2ncccc12 ZINC000471868565 933288881 /nfs/dbraw/zinc/28/88/81/933288881.db2.gz CFFQQDXJMMBIRK-CQSZACIVSA-N 0 0 365.389 3.741 20 5 FHBDRN C[C@H](c1cccc([N+](=O)[O-])c1)N1C(=O)[C@H](C)N(Cc2ccccc2)C1=O ZINC000430854281 933320540 /nfs/dbraw/zinc/32/05/40/933320540.db2.gz ZUNTXANCOZYGNM-KGLIPLIRSA-N 0 0 353.378 3.509 20 5 FHBDRN O=C(c1csc(-c2cccc([N+](=O)[O-])c2)n1)N1C[C@@H]2CCCC[C@@H]2C1 ZINC000178337455 933330371 /nfs/dbraw/zinc/33/03/71/933330371.db2.gz KVVGHFHNYTUXPK-OKILXGFUSA-N 0 0 357.435 3.981 20 5 FHBDRN CN(Cc1nc(-c2cccs2)no1)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000510631642 933331256 /nfs/dbraw/zinc/33/12/56/933331256.db2.gz SUQWUEVHGSEIHJ-UHFFFAOYSA-N 0 0 364.814 3.992 20 5 FHBDRN C[C@H](C1CC1)N(Cc1ccccc1)S(=O)(=O)c1ccccc1[N+](=O)[O-] ZINC000023994062 933351027 /nfs/dbraw/zinc/35/10/27/933351027.db2.gz IWPWLBNQGXMTHZ-CQSZACIVSA-N 0 0 360.435 3.584 20 5 FHBDRN Cc1c(NC(=O)N(C)CCc2ccccc2[N+](=O)[O-])cnn1CCC(C)C ZINC000477767892 933376778 /nfs/dbraw/zinc/37/67/78/933376778.db2.gz JIDJUSWSXIPSGC-UHFFFAOYSA-N 0 0 373.457 3.852 20 5 FHBDRN O=C1N[C@H](C[C@H]2CCCc3ccccc32)C(=O)N1c1cccc([N+](=O)[O-])c1 ZINC000430911454 933396979 /nfs/dbraw/zinc/39/69/79/933396979.db2.gz CFWHUQLIRLTZKL-RDTXWAMCSA-N 0 0 365.389 3.530 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N[C@H](C)c1ccc(Br)cn1 ZINC000477784900 933430906 /nfs/dbraw/zinc/43/09/06/933430906.db2.gz REIPBQFAHHOEKU-SNVBAGLBSA-N 0 0 364.199 3.552 20 5 FHBDRN O=C1CCc2cc([N+](=O)[O-])c(NCc3c(F)c(F)cc(F)c3F)cc2N1 ZINC000610589108 933441359 /nfs/dbraw/zinc/44/13/59/933441359.db2.gz HHGBXHLKNIMHAE-UHFFFAOYSA-N 0 0 369.274 3.648 20 5 FHBDRN COc1ccc(C)cc1CNC(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000610592305 933446771 /nfs/dbraw/zinc/44/67/71/933446771.db2.gz UVAZDOACIKGLKB-CQSZACIVSA-N 0 0 357.410 3.781 20 5 FHBDRN O=C(N[C@H]1CCCc2occc21)c1ccc(Br)cc1[N+](=O)[O-] ZINC000430940733 933451191 /nfs/dbraw/zinc/45/11/91/933451191.db2.gz QRNOTVTVAORMLE-LBPRGKRZSA-N 0 0 365.183 3.758 20 5 FHBDRN CC(C)Oc1ccc(NCC(=O)N2CCc3cc([N+](=O)[O-])ccc32)c(F)c1 ZINC000178344514 933457060 /nfs/dbraw/zinc/45/70/60/933457060.db2.gz TYIRANXDFAKJCC-UHFFFAOYSA-N 0 0 373.384 3.522 20 5 FHBDRN O=C(N[C@@H]1C[C@H]1c1ccccc1F)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000458038510 933463417 /nfs/dbraw/zinc/46/34/17/933463417.db2.gz GMYVDNHILRZCCQ-DOTOQJQBSA-N 0 0 369.396 3.620 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)N2CCN(C)c3ccccc3C2)cc1[N+](=O)[O-] ZINC000610596925 933470045 /nfs/dbraw/zinc/47/00/45/933470045.db2.gz WBBMRFRDXVOGJP-HNNXBMFYSA-N 0 0 368.437 3.626 20 5 FHBDRN CC(C)(NC(=O)c1cnnc(-c2ccccc2)c1)c1ccccc1[N+](=O)[O-] ZINC000561696419 933479504 /nfs/dbraw/zinc/47/95/04/933479504.db2.gz JBYFKKMQQLNLSQ-UHFFFAOYSA-N 0 0 362.389 3.717 20 5 FHBDRN Cc1ccc(C(=O)N2C[C@H](C(F)(F)F)[C@@H](C(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000610597810 933483711 /nfs/dbraw/zinc/48/37/11/933483711.db2.gz FENCMWVAGVBRCE-UWVGGRQHSA-N 0 0 370.249 3.716 20 5 FHBDRN COc1ccc(Cl)cc1N(C)C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000510712954 933499429 /nfs/dbraw/zinc/49/94/29/933499429.db2.gz HGMIAPAWTRQSPJ-UHFFFAOYSA-N 0 0 373.796 3.875 20 5 FHBDRN CC1=C[C@@H](C)CN(C(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C1 ZINC000430967108 933517690 /nfs/dbraw/zinc/51/76/90/933517690.db2.gz QTFODTNHOZTZNK-SNVBAGLBSA-N 0 0 357.332 3.721 20 5 FHBDRN CC[C@@H](c1ccncc1)N(C)C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000135397253 933519566 /nfs/dbraw/zinc/51/95/66/933519566.db2.gz PBZXJZGVQGQOJH-SFHVURJKSA-N 0 0 352.394 3.623 20 5 FHBDRN CC(C)[C@H]1CN(C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)c2ccccc2N1 ZINC000176087057 933519843 /nfs/dbraw/zinc/51/98/43/933519843.db2.gz YIRFQIOFYUKOJU-MRXNPFEDSA-N 0 0 370.365 3.600 20 5 FHBDRN CCc1ccc(C(=O)N[C@@H](CC)c2nc3ccccc3[nH]2)cc1[N+](=O)[O-] ZINC000471893098 933529891 /nfs/dbraw/zinc/52/98/91/933529891.db2.gz OPLXLRGZFMMWFE-AWEZNQCLSA-N 0 0 352.394 3.915 20 5 FHBDRN CCc1ccc(C(=O)N[C@H](CC)c2nc3ccccc3[nH]2)cc1[N+](=O)[O-] ZINC000471893099 933530527 /nfs/dbraw/zinc/53/05/27/933530527.db2.gz 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CCc1ccc(C(=O)N2CCN(Cc3ccccc3)C[C@H]2C)cc1[N+](=O)[O-] ZINC000471910754 933675231 /nfs/dbraw/zinc/67/52/31/933675231.db2.gz JGWWPLDKUGNONZ-MRXNPFEDSA-N 0 0 367.449 3.504 20 5 FHBDRN COC[C@@H](Nc1ccc(C(C)=O)cc1[N+](=O)[O-])c1ccc(F)c(F)c1 ZINC000091026806 933678196 /nfs/dbraw/zinc/67/81/96/933678196.db2.gz VPMSIHUYOFORRF-MRXNPFEDSA-N 0 0 350.321 3.875 20 5 FHBDRN Cc1ccccc1CC1CN(C(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)C1 ZINC000610660128 933679478 /nfs/dbraw/zinc/67/94/78/933679478.db2.gz FFLCXXYZCFIKPQ-UHFFFAOYSA-N 0 0 363.417 3.559 20 5 FHBDRN Cc1cc2nc(NC(=O)Cn3ccc4cc([N+](=O)[O-])ccc43)oc2c(C)c1 ZINC000610661936 933687614 /nfs/dbraw/zinc/68/76/14/933687614.db2.gz WSYZJBHPOFUNIG-UHFFFAOYSA-N 0 0 364.361 3.946 20 5 FHBDRN COC[C@H](Nc1ccc(C(C)=O)cc1[N+](=O)[O-])c1ccc(F)c(F)c1 ZINC000091026805 933695363 /nfs/dbraw/zinc/69/53/63/933695363.db2.gz VPMSIHUYOFORRF-INIZCTEOSA-N 0 0 350.321 3.875 20 5 FHBDRN CCc1ccc(C(=O)NCc2cccc(OC(F)F)c2)cc1[N+](=O)[O-] ZINC000471915127 933710143 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FHBDRN O=[N+]([O-])c1cc(-c2ccccc2)ccc1OC[C@H](O)COCC(F)(F)F ZINC000431097109 933828921 /nfs/dbraw/zinc/82/89/21/933828921.db2.gz ASLWTIPWMLMXKL-CQSZACIVSA-N 0 0 371.311 3.580 20 5 FHBDRN Cc1ccc([C@@H](NS(=O)(=O)CCc2ccc([N+](=O)[O-])cc2)C2CC2)cc1 ZINC000431099026 933832314 /nfs/dbraw/zinc/83/23/14/933832314.db2.gz QAWKHQUFXZWRHD-LJQANCHMSA-N 0 0 374.462 3.516 20 5 FHBDRN CCSc1nnc(NC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)s1 ZINC000431107107 933844149 /nfs/dbraw/zinc/84/41/49/933844149.db2.gz PITQQLMGMQKHEG-UHFFFAOYSA-N 0 0 367.456 3.615 20 5 FHBDRN CC(C)(C)OC(=O)N[C@@H]1CCCN(c2ccc([N+](=O)[O-])c3cccnc32)C1 ZINC000178397948 933869322 /nfs/dbraw/zinc/86/93/22/933869322.db2.gz UHCFOAPJOZRXKS-CYBMUJFWSA-N 0 0 372.425 3.637 20 5 FHBDRN CCOC(=O)c1cc(C(=O)N2CC(C)(C)c3ccccc32)cc([N+](=O)[O-])c1 ZINC000610709024 933876021 /nfs/dbraw/zinc/87/60/21/933876021.db2.gz KVHJUJLLWZOREP-UHFFFAOYSA-N 0 0 368.389 3.710 20 5 FHBDRN Cc1nc(COC(=O)c2ccc(Br)cc2[N+](=O)[O-])sc1C ZINC000176056972 933922509 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374.466 3.844 20 5 FHBDRN Cc1c(NC(=O)C[C@H]2CCCCO2)cc(Br)cc1[N+](=O)[O-] ZINC000431249062 934248946 /nfs/dbraw/zinc/24/89/46/934248946.db2.gz SHYPJPJKPSKHGO-LLVKDONJSA-N 0 0 357.204 3.563 20 5 FHBDRN Cc1cccc(C)c1OC[C@H](C)NC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000535676338 934256245 /nfs/dbraw/zinc/25/62/45/934256245.db2.gz QXIWODBWMQXFRN-AWEZNQCLSA-N 0 0 367.405 3.890 20 5 FHBDRN CC(C)COC[C@H](NC(=O)c1c[nH]c2cccc([N+](=O)[O-])c21)c1ccco1 ZINC000535672044 934266887 /nfs/dbraw/zinc/26/68/87/934266887.db2.gz NGBSDOQUQALEFN-HNNXBMFYSA-N 0 0 371.393 3.813 20 5 FHBDRN CC[C@@H](NC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12)c1ccc(OC)cc1 ZINC000535695577 934288023 /nfs/dbraw/zinc/28/80/23/934288023.db2.gz FBKVKQWENQEYGT-OAHLLOKOSA-N 0 0 353.378 3.966 20 5 FHBDRN O=C(N[C@@H]1C[C@@H]1c1c(F)cccc1F)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000535697255 934291545 /nfs/dbraw/zinc/29/15/45/934291545.db2.gz WZFGVXYBJIDVER-LKFCYVNXSA-N 0 0 357.316 3.640 20 5 FHBDRN COc1cccc2c1CC[C@H]2NC(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000158057076 934301400 /nfs/dbraw/zinc/30/14/00/934301400.db2.gz KZYIFHPYSMXLKE-MRXNPFEDSA-N 0 0 363.373 3.569 20 5 FHBDRN CC(C)[C@@]1(C)C[C@H]1NC(=O)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000458108168 934306190 /nfs/dbraw/zinc/30/61/90/934306190.db2.gz FDRAJWYIWHUNCR-IIBYNOLFSA-N 0 0 352.409 3.985 20 5 FHBDRN COc1ccnc2c(NC(=O)CCOc3ccccc3[N+](=O)[O-])cccc12 ZINC000535769573 934358186 /nfs/dbraw/zinc/35/81/86/934358186.db2.gz OXOZKKBFMBHMJO-UHFFFAOYSA-N 0 0 367.361 3.559 20 5 FHBDRN C[C@H](NC(=O)N[C@@H](c1ccccc1)[C@@H]1CCCO1)c1ccc([N+](=O)[O-])cc1 ZINC000458193584 934365480 /nfs/dbraw/zinc/36/54/80/934365480.db2.gz CUNHKOHNHDLAGF-JVPBZIDWSA-N 0 0 369.421 3.875 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N(C)CCCOc1ccc(F)cc1 ZINC001125557595 934370089 /nfs/dbraw/zinc/37/00/89/934370089.db2.gz AGIUQVFHAVZICL-UHFFFAOYSA-N 0 0 360.385 3.892 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N1CC(CC)(c2ccccc2)C1 ZINC000458219891 934390773 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374.437 3.578 20 5 FHBDRN COc1cc([N+](=O)[O-])cnc1N1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 ZINC000891958488 934450905 /nfs/dbraw/zinc/45/09/05/934450905.db2.gz YPNUDKYDASNROH-HTQZYQBOSA-N 0 0 373.253 3.566 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)NC[C@@H]1CCCO[C@H]1c1ccccc1 ZINC000277117710 934495724 /nfs/dbraw/zinc/49/57/24/934495724.db2.gz RGTBHHDLBVUKGR-KXBFYZLASA-N 0 0 370.405 3.501 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)NC[C@@H]1CCCO[C@@H]1c1ccccc1 ZINC000277117707 934495848 /nfs/dbraw/zinc/49/58/48/934495848.db2.gz RGTBHHDLBVUKGR-HNAYVOBHSA-N 0 0 370.405 3.501 20 5 FHBDRN COC(=O)C(C)(C)[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1C)c1ccccc1 ZINC000610826079 934501071 /nfs/dbraw/zinc/50/10/71/934501071.db2.gz VHTXDQNAIVOESD-QGZVFWFLSA-N 0 0 370.405 3.574 20 5 FHBDRN Cc1ccc(C[C@H]2CCCN(C(=O)Cc3ccccc3[N+](=O)[O-])C2)cc1 ZINC000065163669 934509220 /nfs/dbraw/zinc/50/92/20/934509220.db2.gz RSHTYGHKFWIRTN-GOSISDBHSA-N 0 0 352.434 3.927 20 5 FHBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1CNC(C)(C)C(=O)Nc1ccccc1 ZINC000610844471 934514746 /nfs/dbraw/zinc/51/47/46/934514746.db2.gz VHXJSOTUMPJYPQ-UHFFFAOYSA-N 0 0 371.437 3.889 20 5 FHBDRN COC[C@H]1CCCN1C(=O)c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1 ZINC000610860830 934533487 /nfs/dbraw/zinc/53/34/87/934533487.db2.gz DIVOXWLTDNQFLX-MRXNPFEDSA-N 0 0 372.446 3.997 20 5 FHBDRN COC(=O)c1ccc(C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc1F ZINC000610882112 934555771 /nfs/dbraw/zinc/55/57/71/934555771.db2.gz MIYFANBBFYUKNC-UHFFFAOYSA-N 0 0 374.368 3.571 20 5 FHBDRN COc1ccc(CC(=O)N(c2ccccn2)C2CCCC2)cc1[N+](=O)[O-] ZINC000610896312 934580684 /nfs/dbraw/zinc/58/06/84/934580684.db2.gz PEBFXXGDSFCVQJ-UHFFFAOYSA-N 0 0 355.394 3.517 20 5 FHBDRN Cc1c(C(=O)N2CCC[C@@H]2CC(=O)c2cccs2)cccc1[N+](=O)[O-] ZINC000176212038 934605798 /nfs/dbraw/zinc/60/57/98/934605798.db2.gz LRCKNBJDZIIQNK-CYBMUJFWSA-N 0 0 358.419 3.842 20 5 FHBDRN O=C(CSc1ccccc1[N+](=O)[O-])N1Cc2ccccc2C(F)(F)C1 ZINC000610925818 934628736 /nfs/dbraw/zinc/62/87/36/934628736.db2.gz DBTDLEAXEZOSDZ-UHFFFAOYSA-N 0 0 364.373 3.821 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)N2CC[C@@H](O)[C@H](C3CCCC3)C2)cc1[N+](=O)[O-] ZINC000458307956 934649042 /nfs/dbraw/zinc/64/90/42/934649042.db2.gz HTNQNIXIUWYLCV-QFBILLFUSA-N 0 0 374.481 3.906 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N1CC(Oc2ccccc2)C1 ZINC000610964236 934662778 /nfs/dbraw/zinc/66/27/78/934662778.db2.gz OABPBZNCDMONHA-UHFFFAOYSA-N 0 0 366.295 3.517 20 5 FHBDRN CC[C@H]1CN(C)c2ccccc2CN1C(=O)Cc1cccc([N+](=O)[O-])c1C ZINC000610971996 934669551 /nfs/dbraw/zinc/66/95/51/934669551.db2.gz YDCJYHYGZBXCLN-SFHVURJKSA-N 0 0 367.449 3.703 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)C1(c2ccc(Cl)cc2)CC1 ZINC000512974492 934691484 /nfs/dbraw/zinc/69/14/84/934691484.db2.gz VVVSKDJMNPKMQB-UHFFFAOYSA-N 0 0 358.825 3.981 20 5 FHBDRN Cc1ccc([C@H]2CCN(C(=O)NCCc3ccccc3[N+](=O)[O-])C2)c(C)c1 ZINC000471989919 934704967 /nfs/dbraw/zinc/70/49/67/934704967.db2.gz VWGACZAPOKPPOA-SFHVURJKSA-N 0 0 367.449 3.953 20 5 FHBDRN CSc1cc(NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])ccn1 ZINC000611231276 934743032 /nfs/dbraw/zinc/74/30/32/934743032.db2.gz YNYRQIHPJCNFFI-UHFFFAOYSA-N 0 0 357.313 3.983 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)[C@H]2CCN(C)c3ccccc32)cc1[N+](=O)[O-] ZINC000611010436 934744308 /nfs/dbraw/zinc/74/43/08/934744308.db2.gz HWHSEPOKBMRCQA-YOEHRIQHSA-N 0 0 353.422 3.704 20 5 FHBDRN CC(=O)c1ccc(OCc2nc(-c3ccccc3C)no2)c([N+](=O)[O-])c1 ZINC000611000642 934746948 /nfs/dbraw/zinc/74/69/48/934746948.db2.gz XKKVVRARYFNCEI-UHFFFAOYSA-N 0 0 353.334 3.735 20 5 FHBDRN COc1cccc(C(C)(C)CNC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)c1 ZINC000611005728 934748592 /nfs/dbraw/zinc/74/85/92/934748592.db2.gz WJOGLPKMGQRYCJ-UHFFFAOYSA-N 0 0 367.405 3.792 20 5 FHBDRN C[C@H]1CC(C)(C)CC[C@@H]1NC(=O)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000176290860 934762303 /nfs/dbraw/zinc/76/23/03/934762303.db2.gz IPJNCDKLJCXWCP-GWCFXTLKSA-N 0 0 367.833 3.518 20 5 FHBDRN CC(C)CSCCCNc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-] ZINC000535910352 934781853 /nfs/dbraw/zinc/78/18/53/934781853.db2.gz MHBIFXRUWZYIKN-UHFFFAOYSA-N 0 0 353.488 3.924 20 5 FHBDRN O=C(c1cc(F)cc(C(F)(F)F)c1)N1CCc2c1cccc2[N+](=O)[O-] ZINC000176295206 934789085 /nfs/dbraw/zinc/78/90/85/934789085.db2.gz VUFQEJKMWWGVFY-UHFFFAOYSA-N 0 0 354.259 3.956 20 5 FHBDRN Cc1ccc(CNC(=O)NCc2ccccc2[N+](=O)[O-])c(OCC2CC2)c1 ZINC000176298757 934789618 /nfs/dbraw/zinc/78/96/18/934789618.db2.gz YAKNMOAMNXNVRH-UHFFFAOYSA-N 0 0 369.421 3.691 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CCc2c(Cl)cccc2C1 ZINC000135454531 934799306 /nfs/dbraw/zinc/79/93/06/934799306.db2.gz RXIAYEMGFYAPSG-UHFFFAOYSA-N 0 0 369.808 3.857 20 5 FHBDRN Cc1cc(C(=O)N2[C@H](C)CO[C@H](c3ccccc3)[C@@H]2C)ccc1[N+](=O)[O-] ZINC000110026686 934815756 /nfs/dbraw/zinc/81/57/56/934815756.db2.gz JAIFSVWBENGLHA-VCBZYWHSSA-N 0 0 354.406 3.894 20 5 FHBDRN Cc1cc(C(=O)NC[C@@H](c2ccccc2)C(F)(F)F)ccc1[N+](=O)[O-] ZINC000187701254 934818823 /nfs/dbraw/zinc/81/88/23/934818823.db2.gz DXZFLRWMQUUUQP-AWEZNQCLSA-N 0 0 352.312 3.979 20 5 FHBDRN Cn1cnc([N+](=O)[O-])c1NCc1cc(Cl)cc(Cl)c1OC(F)F ZINC000465055769 934824418 /nfs/dbraw/zinc/82/44/18/934824418.db2.gz HNHDTPLQSABXJK-UHFFFAOYSA-N 0 0 367.139 3.849 20 5 FHBDRN Cc1cc(C(=O)N[C@H]2CCN(c3ccc(Cl)cc3)C2)cc([N+](=O)[O-])c1 ZINC000538434097 934847890 /nfs/dbraw/zinc/84/78/90/934847890.db2.gz FLGSOJVBIQCCCM-HNNXBMFYSA-N 0 0 359.813 3.565 20 5 FHBDRN C[C@H](N(C)C(=O)c1cc(F)cc([N+](=O)[O-])c1Br)C1(C)CC1 ZINC000755021562 934852059 /nfs/dbraw/zinc/85/20/59/934852059.db2.gz NUBYPWICXJBYEK-QMMMGPOBSA-N 0 0 359.195 3.757 20 5 FHBDRN C[C@@H]1C[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2C(=O)c2ccccc2)CCO1 ZINC000538447454 934852522 /nfs/dbraw/zinc/85/25/22/934852522.db2.gz VMERQBPTHARDOF-HIFRSBDPSA-N 0 0 368.389 3.579 20 5 FHBDRN C[C@@H](NCc1cc(C(N)=O)co1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000187708811 934855530 /nfs/dbraw/zinc/85/55/30/934855530.db2.gz GPVBYMWTOJQRKI-LLVKDONJSA-N 0 0 371.418 3.866 20 5 FHBDRN CC[C@@H](C)N(C(=O)c1ccc(Cn2cc([N+](=O)[O-])cn2)cc1)[C@@H](C)CC 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0 0 368.267 3.637 20 5 FHBDRN C[C@@H](NC(=O)c1c[nH]nc1-c1c(F)cccc1F)c1cccc([N+](=O)[O-])c1 ZINC000178501878 934887553 /nfs/dbraw/zinc/88/75/53/934887553.db2.gz XDVRWHWVXYSABD-SNVBAGLBSA-N 0 0 372.331 3.754 20 5 FHBDRN O=C(c1ccc(F)c(C(F)(F)F)c1)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000533873546 934889607 /nfs/dbraw/zinc/88/96/07/934889607.db2.gz KSFWZVKWXFBNOK-UHFFFAOYSA-N 0 0 368.286 3.951 20 5 FHBDRN C[C@H]1CCN(C(=O)CN(C)c2ccccc2[N+](=O)[O-])[C@H]1c1cccc(F)c1 ZINC000472046587 934891335 /nfs/dbraw/zinc/89/13/35/934891335.db2.gz AQTPCLAFXKHGPM-VBKZILBWSA-N 0 0 371.412 3.780 20 5 FHBDRN O=C(N[C@@H](c1cc(F)ccc1F)C(F)F)c1ccc([N+](=O)[O-])cc1F ZINC000447714088 934894477 /nfs/dbraw/zinc/89/44/77/934894477.db2.gz LOZARBSYSSNNPB-ZDUSSCGKSA-N 0 0 360.238 3.748 20 5 FHBDRN O=C(NCc1ccccc1F)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC000538832745 934919755 /nfs/dbraw/zinc/91/97/55/934919755.db2.gz ILQXFEDTWWVBOM-UHFFFAOYSA-N 0 0 351.337 3.726 20 5 FHBDRN CN(Cc1cc(Br)cs1)C(=O)c1ccc([N+](=O)[O-])s1 ZINC000057593325 934927610 /nfs/dbraw/zinc/92/76/10/934927610.db2.gz GSOCYRAGROJIGM-UHFFFAOYSA-N 0 0 361.242 3.753 20 5 FHBDRN Cc1cc(C(=O)N[C@@H]2CCN(C)[C@H]2c2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000536370125 934928351 /nfs/dbraw/zinc/92/83/51/934928351.db2.gz JKKJPKQHTFZVEQ-AEFFLSMTSA-N 0 0 373.840 3.732 20 5 FHBDRN CO[C@@H](c1ccc(F)cc1)[C@@H](C)Nc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 ZINC000538930276 934953476 /nfs/dbraw/zinc/95/34/76/934953476.db2.gz XEGLNKZKOXWREH-NSPYISDASA-N 0 0 373.384 3.807 20 5 FHBDRN O=C(N[C@@H]1CCOC2(CCCC2)C1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000156829640 934954716 /nfs/dbraw/zinc/95/47/16/934954716.db2.gz YUFGSLISEFUGDS-MRXNPFEDSA-N 0 0 373.453 3.761 20 5 FHBDRN O=C(N[C@@H]1CCCc2cn(C3CCCC3)nc21)c1ccc(F)cc1[N+](=O)[O-] ZINC000611567442 934995320 /nfs/dbraw/zinc/99/53/20/934995320.db2.gz WTUBOJRACNIHFM-MRXNPFEDSA-N 0 0 372.400 3.853 20 5 FHBDRN O=C(Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1)c1cc[nH]c(=O)c1 ZINC000472090598 934996246 /nfs/dbraw/zinc/99/62/46/934996246.db2.gz OPVYMDHXOJFXOS-UHFFFAOYSA-N 0 0 351.318 3.740 20 5 FHBDRN CC(C)(C)[C@H]1CCCC[C@H]1NC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000110050215 935008939 /nfs/dbraw/zinc/00/89/39/935008939.db2.gz SYXXEYNXNPHHID-DOTOQJQBSA-N 0 0 371.437 3.771 20 5 FHBDRN CCCc1n[nH]c(C(=O)N[C@@H](C)c2cccc3ccccc32)c1[N+](=O)[O-] ZINC000110041859 935009027 /nfs/dbraw/zinc/00/90/27/935009027.db2.gz FTLQMXHHERTGFS-LBPRGKRZSA-N 0 0 352.394 3.915 20 5 FHBDRN CCCn1ccnc1CCCN(C)C(=O)N[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000277356471 935016021 /nfs/dbraw/zinc/01/60/21/935016021.db2.gz ALZMUZWJWNSNHQ-HNNXBMFYSA-N 0 0 373.457 3.537 20 5 FHBDRN O=C(N=c1[nH]c2ccccc2n1C1CCCCC1)c1ccc([N+](=O)[O-])o1 ZINC000071933889 935018038 /nfs/dbraw/zinc/01/80/38/935018038.db2.gz QFGZHJDNBWJQJM-UHFFFAOYSA-N 0 0 354.366 3.717 20 5 FHBDRN C[C@H]1C[C@@H](C(=O)[O-])C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000263094343 935018509 /nfs/dbraw/zinc/01/85/09/935018509.db2.gz UYSGKDDNADUTRZ-GXTWGEPZSA-N 0 0 360.435 3.866 20 5 FHBDRN 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FHBDRN Cc1cc(NC(=O)NCc2nc3cc(Cl)ccc3n2C)ccc1[N+](=O)[O-] ZINC000548649556 935120003 /nfs/dbraw/zinc/12/00/03/935120003.db2.gz IOOMTZRZCJGYIU-UHFFFAOYSA-N 0 0 373.800 3.765 20 5 FHBDRN COc1ccc(NC(=O)c2cnc3onc(C(C)(C)C)c3c2)c([N+](=O)[O-])c1 ZINC000518142441 945078623 /nfs/dbraw/zinc/07/86/23/945078623.db2.gz SEBZJITZHMHVSV-UHFFFAOYSA-N 0 0 370.365 3.689 20 5 FHBDRN Cc1ccc(-c2ncco2)cc1NCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000134940136 935134814 /nfs/dbraw/zinc/13/48/14/935134814.db2.gz IVAVLHYREMNJIY-UHFFFAOYSA-N 0 0 366.377 3.917 20 5 FHBDRN Cc1ccccc1OCCNc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-] ZINC000071970422 935137509 /nfs/dbraw/zinc/13/75/09/935137509.db2.gz AZTUIUPLZOJTJE-UHFFFAOYSA-N 0 0 357.410 3.532 20 5 FHBDRN CCCn1ccnc1CCCN(C)C(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000277422661 935148247 /nfs/dbraw/zinc/14/82/47/935148247.db2.gz DJZSYDPAESLIAY-UHFFFAOYSA-N 0 0 370.409 3.652 20 5 FHBDRN C[C@H](C(=O)N1C[C@@H](C)O[C@H](c2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000582037226 935157005 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FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)NCc1nc(C(C)C)cs1 ZINC000439899519 945081825 /nfs/dbraw/zinc/08/18/25/945081825.db2.gz JLOCCCMWCCDCOL-UHFFFAOYSA-N 0 0 364.427 3.895 20 5 FHBDRN O=C(N[C@@H]1C[C@@H]1c1ccccc1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000431347522 935210684 /nfs/dbraw/zinc/21/06/84/935210684.db2.gz BXIXAAQGQWXEOX-HUUCEWRRSA-N 0 0 350.296 3.900 20 5 FHBDRN O=C(Nc1cc(Cl)ccc1F)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000119778624 935217429 /nfs/dbraw/zinc/21/74/29/935217429.db2.gz GEKYTGAUQZQQNM-UHFFFAOYSA-N 0 0 360.732 3.825 20 5 FHBDRN Cc1c(F)cccc1NC(=O)c1cc([N+](=O)[O-])ccc1Sc1nc[nH]n1 ZINC000539489422 935220359 /nfs/dbraw/zinc/22/03/59/935220359.db2.gz CNNSSBHEOQQHRE-UHFFFAOYSA-N 0 0 373.369 3.564 20 5 FHBDRN CCCn1ccc2cc(NC(=O)COc3ccccc3[N+](=O)[O-])ccc21 ZINC000051421308 935221264 /nfs/dbraw/zinc/22/12/64/935221264.db2.gz UFMHKSYLPNTWFS-UHFFFAOYSA-N 0 0 353.378 3.977 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N(Cc1ccccc1)CC1CCC1 ZINC000072030280 935229146 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CNC(=O)c1ccc(N[C@@H](C[C@@H]2CCOC2)c2ccccc2)c([N+](=O)[O-])c1 ZINC000157957698 935244339 /nfs/dbraw/zinc/24/43/39/935244339.db2.gz NBDIKXAZNVSINH-KSSFIOAISA-N 0 0 369.421 3.534 20 5 FHBDRN CCCn1c(C)cc(C(=O)Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)c1C ZINC000072066371 935263771 /nfs/dbraw/zinc/26/37/71/935263771.db2.gz GWVQSEJQRAFBMW-UHFFFAOYSA-N 0 0 367.409 3.565 20 5 FHBDRN O=C(N[C@H]1C[C@@H]1c1ccccc1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000431356763 935264583 /nfs/dbraw/zinc/26/45/83/935264583.db2.gz CZMBCDKHBPSQPD-CABCVRRESA-N 0 0 361.195 3.643 20 5 FHBDRN CC(C)(C(=O)NCC1(c2cccc(F)c2)CC1)c1ccccc1[N+](=O)[O-] ZINC000551356607 935265093 /nfs/dbraw/zinc/26/50/93/935265093.db2.gz ZQSHVBVEISEPGJ-UHFFFAOYSA-N 0 0 356.397 3.860 20 5 FHBDRN COc1ccc(C(=O)Nc2ccc3[nH]c(C4CCC4)nc3c2)cc1[N+](=O)[O-] ZINC000072058569 935267025 /nfs/dbraw/zinc/26/70/25/935267025.db2.gz QIPCHTYVNXGONZ-UHFFFAOYSA-N 0 0 366.377 4.000 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(Oc2ccc(F)c(C(F)(F)F)c2)n1 ZINC000327637029 935280308 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CSc1ccc(C(=O)Nc2ccc(CO)c(Cl)c2)cc1[N+](=O)[O-] ZINC000431361918 935314211 /nfs/dbraw/zinc/31/42/11/935314211.db2.gz CLXDUSNFCNAVDB-UHFFFAOYSA-N 0 0 352.799 3.715 20 5 FHBDRN Cc1c([C@H]2OCC[C@@H]2Nc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cnn1C ZINC000431363542 935314631 /nfs/dbraw/zinc/31/46/31/935314631.db2.gz QLZBXTSOMFENOO-DZGCQCFKSA-N 0 0 370.331 3.598 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N(C)[C@H](C)c1ccc(F)c(F)c1 ZINC000427106646 945092015 /nfs/dbraw/zinc/09/20/15/945092015.db2.gz FVBIYARMJPVYDT-SNVBAGLBSA-N 0 0 350.321 3.715 20 5 FHBDRN CSc1ccccc1CN(C)C(=O)NCc1cccc([N+](=O)[O-])c1C ZINC000472177111 935316404 /nfs/dbraw/zinc/31/64/04/935316404.db2.gz VTDHQKYGSOSTID-UHFFFAOYSA-N 0 0 359.451 3.967 20 5 FHBDRN O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1nccs1 ZINC000014461819 935323982 /nfs/dbraw/zinc/32/39/82/935323982.db2.gz ZZAZOSKJOIXMQP-UHFFFAOYSA-N 0 0 363.342 3.801 20 5 FHBDRN Cc1nc(C)c(C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)s1 ZINC000551670061 935325773 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FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccc(N2CCCC2)cc1C ZINC000427109315 945094570 /nfs/dbraw/zinc/09/45/70/945094570.db2.gz GQEBNWRKRCQNIQ-UHFFFAOYSA-N 0 0 355.394 3.764 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1F)N1CC(Cc2ccc(F)c(F)c2)C1 ZINC000548697199 935350351 /nfs/dbraw/zinc/35/03/51/935350351.db2.gz PLVRNIQEUHLLGM-UHFFFAOYSA-N 0 0 365.311 3.719 20 5 FHBDRN COc1ccc2c(c1)C1(CC1)CN(C(=O)c1ccc([N+](=O)[O-])c(C)c1)C2 ZINC000582153119 935350428 /nfs/dbraw/zinc/35/04/28/935350428.db2.gz CRRYUEZWXLXALL-UHFFFAOYSA-N 0 0 352.390 3.599 20 5 FHBDRN CCc1ccc(C(=O)N[C@H](C)[C@H](OC)c2ccc(OC)cc2)cc1[N+](=O)[O-] ZINC000540089098 935352613 /nfs/dbraw/zinc/35/26/13/935352613.db2.gz PCUMXNQMYKSEOX-YJYMSZOUSA-N 0 0 372.421 3.672 20 5 FHBDRN CCO[C@@H]1C[C@H](N(C)C(=O)c2ccc([N+](=O)[O-])c(Cl)c2)C12CCC2 ZINC000161169772 935362959 /nfs/dbraw/zinc/36/29/59/935362959.db2.gz BGIDLRJREZFLFS-LSDHHAIUSA-N 0 0 352.818 3.668 20 5 FHBDRN O=C([O-])c1cc(NC[C@@H](c2cccs2)[NH+]2CCCC2)ccc1[N+](=O)[O-] ZINC000551867779 935364108 /nfs/dbraw/zinc/36/41/08/935364108.db2.gz XLZLYYJVOAPCJW-HNNXBMFYSA-N 0 0 361.423 3.604 20 5 FHBDRN CC(C)(C)[C@@H]1OCCC[C@@H]1CNC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000118368958 935392184 /nfs/dbraw/zinc/39/21/84/935392184.db2.gz IRQMNMRJGXZVLR-IAQYHMDHSA-N 0 0 354.834 3.819 20 5 FHBDRN CC1=CCCN(C(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)C1 ZINC000437974004 945098606 /nfs/dbraw/zinc/09/86/06/945098606.db2.gz WCMWGRQUUUEFTM-UHFFFAOYSA-N 0 0 351.406 3.999 20 5 FHBDRN O=C([C@@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1)N1CCc2c(F)ccc(F)c2C1 ZINC000934350505 935409374 /nfs/dbraw/zinc/40/93/74/935409374.db2.gz YTAWZUGHKUGTRU-HUUCEWRRSA-N 0 0 358.344 3.561 20 5 FHBDRN O=C(Nc1ccccc1C(=O)N1CCCC1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000051529122 935431075 /nfs/dbraw/zinc/43/10/75/935431075.db2.gz ZPRUFKBSNHPNLI-UHFFFAOYSA-N 0 0 373.796 3.737 20 5 FHBDRN CC(C)(C)c1coc(NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)n1 ZINC000582249245 935455893 /nfs/dbraw/zinc/45/58/93/935455893.db2.gz JJDPOBNTGCHMDI-UHFFFAOYSA-N 0 0 372.425 3.735 20 5 FHBDRN CSc1ccc(C(=O)N(C)[C@@H](CCO)c2ccccc2)cc1[N+](=O)[O-] ZINC000158293707 935491102 /nfs/dbraw/zinc/49/11/02/935491102.db2.gz UVTDVHUNZDOASB-HNNXBMFYSA-N 0 0 360.435 3.512 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(OC)cc2C)cc1OC ZINC000263949645 935501446 /nfs/dbraw/zinc/50/14/46/935501446.db2.gz ZWZZQYKAOZQQRN-UHFFFAOYSA-N 0 0 360.366 3.571 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N1CCOC2(CCCCC2)C1 ZINC000178558842 935505286 /nfs/dbraw/zinc/50/52/86/935505286.db2.gz AGRWPXWJGZPEFJ-UHFFFAOYSA-N 0 0 372.343 3.789 20 5 FHBDRN CCn1cnnc1CN[C@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000158343124 935514223 /nfs/dbraw/zinc/51/42/23/935514223.db2.gz PHBLYUNLTCHNIN-GFCCVEGCSA-N 0 0 357.439 3.786 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1cc(NC(=O)C(C)C)ccc1C ZINC000277547855 935523758 /nfs/dbraw/zinc/52/37/58/935523758.db2.gz INXOQSTXNZCKDB-UHFFFAOYSA-N 0 0 371.393 3.759 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)N[C@@H](C)Cc2cccs2)cc1SC ZINC000264002716 935523774 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ZINC000583922352 938487670 /nfs/dbraw/zinc/48/76/70/938487670.db2.gz MRGJIWCBTQIPIP-UHFFFAOYSA-N 0 0 374.344 3.519 20 5 FHBDRN CC[C@](C)(O)CN(Cc1ccccc1)C(=O)c1cc(F)cc([N+](=O)[O-])c1 ZINC000440038421 945181275 /nfs/dbraw/zinc/18/12/75/945181275.db2.gz RZUBRMNWZZKIQR-IBGZPJMESA-N 0 0 360.385 3.537 20 5 FHBDRN COc1cc(CCNc2cccc(F)c2C(C)=O)c([N+](=O)[O-])cc1OC ZINC000052721249 938516356 /nfs/dbraw/zinc/51/63/56/938516356.db2.gz YFAIGNSGHLXMKU-UHFFFAOYSA-N 0 0 362.357 3.608 20 5 FHBDRN COc1cc(-c2nc(-c3ccnc(OC(C)C)c3)no2)cc([N+](=O)[O-])c1C ZINC000573014898 938518068 /nfs/dbraw/zinc/51/80/68/938518068.db2.gz CTCMITDOVUEEDJ-UHFFFAOYSA-N 0 0 370.365 3.811 20 5 FHBDRN CC1(C)CN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)Cc2ccccc21 ZINC000536180949 938521024 /nfs/dbraw/zinc/52/10/24/938521024.db2.gz PVTMVFXNHOEFSB-UHFFFAOYSA-N 0 0 364.405 3.938 20 5 FHBDRN O=C1[C@@H](Nc2c(Cl)cccc2[N+](=O)[O-])CCN1Cc1ccc(F)cc1 ZINC000432141123 945182407 /nfs/dbraw/zinc/18/24/07/945182407.db2.gz YTDYTPSMGAWEDD-AWEZNQCLSA-N 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373.356 3.912 20 5 FHBDRN COc1cc(C(=O)Nc2cc([N+](=O)[O-])c(Cl)cc2C)ccc1[N+](=O)[O-] ZINC000135498768 938599057 /nfs/dbraw/zinc/59/90/57/938599057.db2.gz IJBXOJJBALTJJO-UHFFFAOYSA-N 0 0 365.729 3.726 20 5 FHBDRN CSc1ccc(C(=O)NCCC2C[C@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000584117265 938604510 /nfs/dbraw/zinc/60/45/10/938604510.db2.gz AKTSVJNIALDDLR-RYUDHWBXSA-N 0 0 352.456 3.640 20 5 FHBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)N1C[C@H](c2ccccc2)[C@@H]2CCC[C@H]21 ZINC000584128973 938609509 /nfs/dbraw/zinc/60/95/09/938609509.db2.gz PRJSGZALHPSAME-GVDBMIGSSA-N 0 0 372.446 3.552 20 5 FHBDRN COc1ccc(NC(=O)c2cc(-c3ccc(F)cc3)on2)cc1[N+](=O)[O-] ZINC000543852967 938614844 /nfs/dbraw/zinc/61/48/44/938614844.db2.gz RPZQXRACVCPWEB-UHFFFAOYSA-N 0 0 357.297 3.650 20 5 FHBDRN COC[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1SC1CCCC1)C1CC1 ZINC000162092803 938644209 /nfs/dbraw/zinc/64/42/09/938644209.db2.gz PUNHCAHVPXWBKL-INIZCTEOSA-N 0 0 364.467 3.784 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)c1nc(C(F)(F)F)cs1 ZINC000278702198 938669837 /nfs/dbraw/zinc/66/98/37/938669837.db2.gz JUIWACCLBNOXST-MRVPVSSYSA-N 0 0 359.329 3.870 20 5 FHBDRN Cn1cc(CNc2cnn(C(C)(C)C)c2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000179074238 938683928 /nfs/dbraw/zinc/68/39/28/938683928.db2.gz SQHFZTBBDWJDPP-UHFFFAOYSA-N 0 0 354.414 3.559 20 5 FHBDRN COc1ccccc1C[C@@H](C)N(C)C(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000080997327 938713125 /nfs/dbraw/zinc/71/31/25/938713125.db2.gz BSGWWJYAVYADOY-GFCCVEGCSA-N 0 0 362.813 3.960 20 5 FHBDRN COc1ccccc1C[C@H](C)N(C)C(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000080996856 938713212 /nfs/dbraw/zinc/71/32/12/938713212.db2.gz AGBWSGHBAHUGER-ZDUSSCGKSA-N 0 0 367.405 3.788 20 5 FHBDRN O=C(CSc1ccccc1[N+](=O)[O-])N1CCc2ccc(Cl)cc2C1 ZINC000124245918 945198487 /nfs/dbraw/zinc/19/84/87/945198487.db2.gz IPKSTABSQUHDPC-UHFFFAOYSA-N 0 0 362.838 3.925 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1NC[C@H](O)c1ccc(F)cc1 ZINC000106261656 945200024 /nfs/dbraw/zinc/20/00/24/945200024.db2.gz OLZWCZJIKKWTIC-AWEZNQCLSA-N 0 0 355.163 3.642 20 5 FHBDRN O=[N+]([O-])c1cnc(Oc2cc(F)cc([N+](=O)[O-])c2)c(Br)c1 ZINC000135529775 938780659 /nfs/dbraw/zinc/78/06/59/938780659.db2.gz YZECWHXVHPAHPP-UHFFFAOYSA-N 0 0 358.079 3.592 20 5 FHBDRN Cc1cc(C)c(S(=O)(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)s1 ZINC000431548410 938798599 /nfs/dbraw/zinc/79/85/99/938798599.db2.gz DIOKKMNBFFHHNO-LBPRGKRZSA-N 0 0 354.453 3.621 20 5 FHBDRN O=C1OC(c2ccc(Cl)c([N+](=O)[O-])c2)=N/C1=C/c1ccc([N+](=O)[O-])cc1 ZINC000003082523 938811837 /nfs/dbraw/zinc/81/18/37/938811837.db2.gz USFVDALBMAHOEQ-NTUHNPAUSA-N 0 0 373.708 3.501 20 5 FHBDRN Cc1cccc([C@H]2CCCN2S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)c1 ZINC000056140544 938811942 /nfs/dbraw/zinc/81/19/42/938811942.db2.gz HDZDGNMTJHTUFA-MRXNPFEDSA-N 0 0 364.398 3.568 20 5 FHBDRN Cc1cc(F)c(C(=O)Nc2ccnn2-c2ccc([N+](=O)[O-])cc2)cc1F ZINC000128178343 938829035 /nfs/dbraw/zinc/82/90/35/938829035.db2.gz ZLXBIXPRFFWYAK-UHFFFAOYSA-N 0 0 358.304 3.619 20 5 FHBDRN O=C(NCc1cc2ccccc2o1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000087059737 938841460 /nfs/dbraw/zinc/84/14/60/938841460.db2.gz SJMCOYDWKAOWRQ-UHFFFAOYSA-N 0 0 351.362 3.609 20 5 FHBDRN Cc1ccc(NC(=O)c2ccc(N[C@@H](C)CCCO)c([N+](=O)[O-])c2)cc1 ZINC000088758162 938853133 /nfs/dbraw/zinc/85/31/33/938853133.db2.gz IKACIXBBEYCELW-AWEZNQCLSA-N 0 0 357.410 3.728 20 5 FHBDRN Cc1c(CC(=O)NCCCSc2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000438895401 945210231 /nfs/dbraw/zinc/21/02/31/945210231.db2.gz JUDWTHDVEJADFP-UHFFFAOYSA-N 0 0 362.426 3.883 20 5 FHBDRN O=C(N[C@H]1CCSc2ccccc21)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000065669211 938872697 /nfs/dbraw/zinc/87/26/97/938872697.db2.gz BOAOVKAOZQSVEP-ZDUSSCGKSA-N 0 0 350.346 3.840 20 5 FHBDRN COc1cc(Cl)ccc1-c1noc(-c2cccc([N+](=O)[O-])c2OC)n1 ZINC000573247571 938881079 /nfs/dbraw/zinc/88/10/79/938881079.db2.gz XDMYNSNHLBRWOP-UHFFFAOYSA-N 0 0 361.741 3.982 20 5 FHBDRN Cc1cc(OCc2ccc(S(C)(=O)=O)cc2)c(Cl)cc1[N+](=O)[O-] ZINC000506434469 945213938 /nfs/dbraw/zinc/21/39/38/945213938.db2.gz TXHODKLEMMMNET-UHFFFAOYSA-N 0 0 355.799 3.539 20 5 FHBDRN O=C(COc1ccccc1)COc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000506435142 945214043 /nfs/dbraw/zinc/21/40/43/945214043.db2.gz YCKVSRLAXOQFTP-UHFFFAOYSA-N 0 0 355.268 3.641 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)Nc1ccc(Br)cc1 ZINC000065711603 938923680 /nfs/dbraw/zinc/92/36/80/938923680.db2.gz YCSBJNOYVYDQAB-UHFFFAOYSA-N 0 0 374.194 3.951 20 5 FHBDRN O=[N+]([O-])c1ccc(OCc2cn3cc(Br)ccc3n2)cc1F ZINC000176858823 938924805 /nfs/dbraw/zinc/92/48/05/938924805.db2.gz KCYMTRQVJMONNS-UHFFFAOYSA-N 0 0 366.146 3.723 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(C)Cc1ccc(Cl)s1 ZINC000065685087 938941662 /nfs/dbraw/zinc/94/16/62/938941662.db2.gz RFBFVFRMIFMGFQ-UHFFFAOYSA-N 0 0 374.871 3.693 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC[C@H]1Cc1ccccc1 ZINC000065685374 938941674 /nfs/dbraw/zinc/94/16/74/938941674.db2.gz URAZKBDBWKEJAX-KRWDZBQOSA-N 0 0 374.462 3.553 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC[C@@H]1c1cccs1 ZINC000065685065 938941730 /nfs/dbraw/zinc/94/17/30/938941730.db2.gz YCANSCBTIKPJQF-CQSZACIVSA-N 0 0 366.464 3.745 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(CC)c1ccc(F)cc1 ZINC000065685135 938941959 /nfs/dbraw/zinc/94/19/59/938941959.db2.gz PNFARKMUILIYEF-UHFFFAOYSA-N 0 0 352.387 3.512 20 5 FHBDRN CN(C)c1nc2ccc(NC(=O)c3c[nH]c4ccc([N+](=O)[O-])cc34)cc2o1 ZINC000158875821 938959478 /nfs/dbraw/zinc/95/94/78/938959478.db2.gz GMLQIUAYSLENOU-UHFFFAOYSA-N 0 0 365.349 3.536 20 5 FHBDRN COCCCOc1cc(C)ccc1CNC(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000128262073 938968272 /nfs/dbraw/zinc/96/82/72/938968272.db2.gz DHVJIPYAOAHAAX-UHFFFAOYSA-N 0 0 373.409 3.640 20 5 FHBDRN COc1ccc(CNC(=O)Nc2nc3ccccc3s2)cc1[N+](=O)[O-] ZINC000409578419 938968742 /nfs/dbraw/zinc/96/87/42/938968742.db2.gz BARTYKKIZBREIO-UHFFFAOYSA-N 0 0 358.379 3.535 20 5 FHBDRN Cc1cn(C2CCCCC2)nc1NC(=O)CN(C)c1ccccc1[N+](=O)[O-] ZINC000544064988 938974144 /nfs/dbraw/zinc/97/41/44/938974144.db2.gz CICLJXPWPIDVBZ-UHFFFAOYSA-N 0 0 371.441 3.680 20 5 FHBDRN O=[N+]([O-])c1cccnc1N[C@H]1CCOc2c(Br)cccc21 ZINC000409639795 938978703 /nfs/dbraw/zinc/97/87/03/938978703.db2.gz FQILUBNGVKNLCV-NSHDSACASA-N 0 0 350.172 3.688 20 5 FHBDRN O=C([C@@H]1C[C@@]12CCc1ccccc12)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000179149092 938979785 /nfs/dbraw/zinc/97/97/85/938979785.db2.gz UOSOGCSDKVGTJF-RBBKRZOGSA-N 0 0 362.429 3.990 20 5 FHBDRN CC(C)(NC(=O)/C=C/c1cnc2ccccc2n1)c1ccc([N+](=O)[O-])cc1 ZINC000176885132 938980077 /nfs/dbraw/zinc/98/00/77/938980077.db2.gz VFBDVLXKWNHJFM-FMIVXFBMSA-N 0 0 362.389 3.603 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)cnc1N1CCC(N2CCc3ccccc32)CC1 ZINC000409641562 938980237 /nfs/dbraw/zinc/98/02/37/938980237.db2.gz XMDQJCLRTKPYQB-UHFFFAOYSA-N 0 0 358.829 3.675 20 5 FHBDRN Cc1ccc(F)cc1NC(=O)COc1ccc([N+](=O)[O-])c2cccnc12 ZINC000431577257 938981657 /nfs/dbraw/zinc/98/16/57/938981657.db2.gz GEUVEAJLNUVGHY-UHFFFAOYSA-N 0 0 355.325 3.608 20 5 FHBDRN Cc1nn(C)c(-c2nc([C@@H](c3cccc(C)c3)C(C)C)no2)c1[N+](=O)[O-] ZINC000573287717 938982782 /nfs/dbraw/zinc/98/27/82/938982782.db2.gz YFPFCACPVZIDCP-CQSZACIVSA-N 0 0 355.398 3.783 20 5 FHBDRN Cc1cccc(C2(NC(=O)c3cc4c(c([N+](=O)[O-])c3)OCO4)CCCC2)c1 ZINC001125726726 938983658 /nfs/dbraw/zinc/98/36/58/938983658.db2.gz DKEQQVLHDMLSGU-UHFFFAOYSA-N 0 0 368.389 3.831 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNc1nccc(OCc2ccccc2)n1 ZINC000544067234 938983660 /nfs/dbraw/zinc/98/36/60/938983660.db2.gz FEKATSRVCIMHDS-UHFFFAOYSA-N 0 0 366.377 3.585 20 5 FHBDRN Cc1nc(NC(=O)c2ccc(Cl)c(Br)c2)ccc1[N+](=O)[O-] ZINC000511285002 938984662 /nfs/dbraw/zinc/98/46/62/938984662.db2.gz LAEOSCIGPWOGNX-UHFFFAOYSA-N 0 0 370.590 3.966 20 5 FHBDRN CC(=O)Nc1cccc(CSCCC(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000409835479 938996011 /nfs/dbraw/zinc/99/60/11/938996011.db2.gz JFENCEBLXORMMZ-UHFFFAOYSA-N 0 0 373.434 3.815 20 5 FHBDRN O=C(Nc1ccc2cc([N+](=O)[O-])ccc2n1)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000176921423 938996041 /nfs/dbraw/zinc/99/60/41/938996041.db2.gz FDNPSFGNHXCJSW-UHFFFAOYSA-N 0 0 374.259 3.582 20 5 FHBDRN COc1cc(C(=O)Nc2ccc(OC)c(OC(C)C)c2)cc([N+](=O)[O-])c1C ZINC000480582619 938996206 /nfs/dbraw/zinc/99/62/06/938996206.db2.gz QCIXRYVTSBVCAM-UHFFFAOYSA-N 0 0 374.393 3.960 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)N1CCSc2ccccc21 ZINC000065715799 938996933 /nfs/dbraw/zinc/99/69/33/938996933.db2.gz HFBVFZHEWBZIEY-UHFFFAOYSA-N 0 0 353.403 3.688 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)NCCc1ccc(Cl)cc1 ZINC000065713203 938997058 /nfs/dbraw/zinc/99/70/58/938997058.db2.gz PYAWMPXOQAAWNF-UHFFFAOYSA-N 0 0 357.797 3.562 20 5 FHBDRN O=C(c1ccn(-c2ccccc2[N+](=O)[O-])n1)N1CCCc2ccc(F)cc21 ZINC000179252883 938997832 /nfs/dbraw/zinc/99/78/32/938997832.db2.gz WGDYTPPPKCRRIF-UHFFFAOYSA-N 0 0 366.352 3.513 20 5 FHBDRN Cc1ccc([C@@H](C)N(C)C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)c(C)c1 ZINC000480596840 938998810 /nfs/dbraw/zinc/99/88/10/938998810.db2.gz GMXNGIFXNNTJET-CYBMUJFWSA-N 0 0 352.394 3.921 20 5 FHBDRN Cc1ccc([C@@H]2CCN(S(=O)(=O)Cc3ccccc3[N+](=O)[O-])C2)c(C)c1 ZINC000480601426 938999491 /nfs/dbraw/zinc/99/94/91/938999491.db2.gz PNDIMFNAFXKHLA-MRXNPFEDSA-N 0 0 374.462 3.531 20 5 FHBDRN O=c1c2cc([N+](=O)[O-])ccc2ncn1Cc1ccc(Cl)c(Cl)c1 ZINC000005227602 939005762 /nfs/dbraw/zinc/00/57/62/939005762.db2.gz OQKLSLWVNUUQFG-UHFFFAOYSA-N 0 0 350.161 3.660 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)N(Cc1ccc(F)cc1)C1CC1 ZINC000065720115 939006766 /nfs/dbraw/zinc/00/67/66/939006766.db2.gz WQJFXUIOEFNMLB-UHFFFAOYSA-N 0 0 367.380 3.880 20 5 FHBDRN CCCC[C@@H]1CCC[C@@H]1NC(=O)c1ccc2c(c1[N+](=O)[O-])OCCCO2 ZINC001125772663 939007753 /nfs/dbraw/zinc/00/77/53/939007753.db2.gz IDCIMGXHQGNJRN-HIFRSBDPSA-N 0 0 362.426 3.845 20 5 FHBDRN CC[C@H](NC(=O)[C@@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1)c1nc2ccccc2[nH]1 ZINC001125774195 939008777 /nfs/dbraw/zinc/00/87/77/939008777.db2.gz QUTLSPAXPGULLY-OAGGEKHMSA-N 0 0 364.405 3.842 20 5 FHBDRN Cc1nn(C)c(C)c1CNc1cc(C)c([N+](=O)[O-])cc1Br ZINC000235829538 939009678 /nfs/dbraw/zinc/00/96/78/939009678.db2.gz WCHGYYDGSABUTN-UHFFFAOYSA-N 0 0 353.220 3.628 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(Sc2ccccc2Br)n1 ZINC000166887586 939010574 /nfs/dbraw/zinc/01/05/74/939010574.db2.gz KFXVGQMMHKFPJX-UHFFFAOYSA-N 0 0 369.196 3.690 20 5 FHBDRN CC1(c2ccccc2)CC(NC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)C1 ZINC000410076901 939014131 /nfs/dbraw/zinc/01/41/31/939014131.db2.gz HEEZVHISMVONFQ-UHFFFAOYSA-N 0 0 363.417 3.786 20 5 FHBDRN COc1ccccc1[C@H]1CCCN1C(=O)/C=C\c1ccc([N+](=O)[O-])cc1 ZINC000255635731 939018831 /nfs/dbraw/zinc/01/88/31/939018831.db2.gz CMZWWWRNFNUEEM-ADYSOMBNSA-N 0 0 352.390 3.980 20 5 FHBDRN CC(C)c1ccc(C(=O)Nc2ccc(-c3ncn(C)n3)cc2)cc1[N+](=O)[O-] ZINC000188137358 939019405 /nfs/dbraw/zinc/01/94/05/939019405.db2.gz NNCAUZMOTOFXON-UHFFFAOYSA-N 0 0 365.393 3.766 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)N[C@H]2CCOc3c(F)cccc32)cc1[N+](=O)[O-] ZINC000188168948 939021466 /nfs/dbraw/zinc/02/14/66/939021466.db2.gz MHFADTNRMBSDFJ-LRDDRELGSA-N 0 0 373.384 3.926 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1ccccc1-c1cccs1 ZINC000065737424 939021725 /nfs/dbraw/zinc/02/17/25/939021725.db2.gz MUQKFXWYRWZUDJ-UHFFFAOYSA-N 0 0 356.407 3.857 20 5 FHBDRN Cc1noc(C)c1[C@H](C)NC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000612044766 939025235 /nfs/dbraw/zinc/02/52/35/939025235.db2.gz WDYOUEBVQVVTMI-QMMMGPOBSA-N 0 0 369.830 3.823 20 5 FHBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])NC1(C(F)(F)F)CC1 ZINC000612048293 939027076 /nfs/dbraw/zinc/02/70/76/939027076.db2.gz CVDMODXJGAXTJU-UHFFFAOYSA-N 0 0 354.737 3.551 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1CCOC ZINC000188213251 939046913 /nfs/dbraw/zinc/04/69/13/939046913.db2.gz NANMYQUOPXMRDQ-INIZCTEOSA-N 0 0 356.422 3.991 20 5 FHBDRN O=C(Nc1cnc2ccccc2n1)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000177017535 939049708 /nfs/dbraw/zinc/04/97/08/939049708.db2.gz KEVCBEJYKMDXPS-UHFFFAOYSA-N 0 0 373.166 3.553 20 5 FHBDRN COc1ccccc1[C@H](OC(=O)c1ccc([N+](=O)[O-])cc1)c1ccccn1 ZINC000179314606 939080758 /nfs/dbraw/zinc/08/07/58/939080758.db2.gz HTLTZAMOPHFTMS-IBGZPJMESA-N 0 0 364.357 3.945 20 5 FHBDRN CC(C)(C)C1CCN(C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)CC1 ZINC000179351103 939084426 /nfs/dbraw/zinc/08/44/26/939084426.db2.gz VYAVFPGNVIHQST-UHFFFAOYSA-N 0 0 356.426 3.679 20 5 FHBDRN C[C@@H](C[C@@H](O)c1ccco1)NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000179325225 939086310 /nfs/dbraw/zinc/08/63/10/939086310.db2.gz PPYVDCURTFNBFS-GXFFZTMASA-N 0 0 360.391 3.645 20 5 FHBDRN CCCOc1ccccc1NC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000179368459 939097777 /nfs/dbraw/zinc/09/77/77/939097777.db2.gz KTRMRCSYSFKUQN-UHFFFAOYSA-N 0 0 366.377 3.822 20 5 FHBDRN Cc1ccc(-n2cc(NC(=O)c3cccc(C)c3[N+](=O)[O-])cn2)c(C)c1 ZINC000188265063 939126155 /nfs/dbraw/zinc/12/61/55/939126155.db2.gz FERHRHQJEUPTRU-UHFFFAOYSA-N 0 0 350.378 3.958 20 5 FHBDRN O=C(NCc1ccsc1)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC000179420715 939153981 /nfs/dbraw/zinc/15/39/81/939153981.db2.gz BKSZLEFYNSMTHQ-UHFFFAOYSA-N 0 0 356.201 3.741 20 5 FHBDRN Cc1cc([N+](=O)[O-])nn1Cc1cccc(C(=O)Nc2ccc(F)c(C)c2)c1 ZINC001125785588 939182000 /nfs/dbraw/zinc/18/20/00/939182000.db2.gz HGEBBJVRIPFRDY-UHFFFAOYSA-N 0 0 368.368 3.848 20 5 FHBDRN Cc1cccc([C@@H](NC(=O)Cc2cccc([N+](=O)[O-])c2)C(F)(F)F)c1 ZINC000511830339 945233309 /nfs/dbraw/zinc/23/33/09/945233309.db2.gz ZJCKYYQMJSBRFG-MRXNPFEDSA-N 0 0 352.312 3.866 20 5 FHBDRN C[C@@H](NC(=O)/C=C\c1ccc([N+](=O)[O-])cc1)c1noc(-c2ccccc2)n1 ZINC000255772125 939197844 /nfs/dbraw/zinc/19/78/44/939197844.db2.gz NMDIFFCAZMXSFX-KIWPFMIBSA-N 0 0 364.361 3.535 20 5 FHBDRN COc1ccccc1C[C@H](C)N(C)C(=O)c1cc(OC)c(C)c([N+](=O)[O-])c1 ZINC000188341976 939200914 /nfs/dbraw/zinc/20/09/14/939200914.db2.gz TXHQKXJNWLVCNT-ZDUSSCGKSA-N 0 0 372.421 3.624 20 5 FHBDRN Nc1c(C(=O)N[C@@H]2C[C@H]2c2ccc(Cl)c(Cl)c2)cccc1[N+](=O)[O-] ZINC000437316207 945235463 /nfs/dbraw/zinc/23/54/63/945235463.db2.gz CJTBBZWQBHQEAW-GXFFZTMASA-N 0 0 366.204 3.770 20 5 FHBDRN C[C@@H](NC(=O)COc1ccc([N+](=O)[O-])c(F)c1)C(C)(C)c1ccccc1 ZINC000102734204 939225451 /nfs/dbraw/zinc/22/54/51/939225451.db2.gz MXDKWXDTZCBYDS-CYBMUJFWSA-N 0 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ZINC000511834715 945247389 /nfs/dbraw/zinc/24/73/89/945247389.db2.gz ZYLJUJKCSLNEII-CQSZACIVSA-N 0 0 353.300 3.640 20 5 FHBDRN C[C@H](CNC(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)C(F)(F)F ZINC000426235693 945250200 /nfs/dbraw/zinc/25/02/00/945250200.db2.gz DWKKSFKHOZHFRK-SSDOTTSWSA-N 0 0 373.253 3.611 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)NCCOc1cccc2ccccc21 ZINC000511836171 945251345 /nfs/dbraw/zinc/25/13/45/945251345.db2.gz WXUUHOMOEMBNGP-UHFFFAOYSA-N 0 0 350.374 3.865 20 5 FHBDRN CC(C)Oc1ccc([C@H](C)NC(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)cc1 ZINC000507466003 945254279 /nfs/dbraw/zinc/25/42/79/945254279.db2.gz GUBQGFXQFPGVKQ-LBPRGKRZSA-N 0 0 368.393 3.749 20 5 FHBDRN O=[N+]([O-])c1cncc(Cl)c1OCc1nnc(-c2cccc(Cl)c2)o1 ZINC000506446807 945254384 /nfs/dbraw/zinc/25/43/84/945254384.db2.gz XAXWNLFJQZYJBD-UHFFFAOYSA-N 0 0 367.148 3.926 20 5 FHBDRN COCC[C@@H](NC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-])C(C)(C)C ZINC000511841682 945257996 /nfs/dbraw/zinc/25/79/96/945257996.db2.gz YRMIPJOPZRKWLX-OAHLLOKOSA-N 0 0 371.865 3.541 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)N[C@@H](C)c2ccc(F)cc2F)cc1C ZINC000437338046 945258675 /nfs/dbraw/zinc/25/86/75/945258675.db2.gz NWITWUJZORJLBA-NSHDSACASA-N 0 0 370.377 3.529 20 5 FHBDRN CCCCCN([C@@H](C)CCC)S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC ZINC000516812109 945260637 /nfs/dbraw/zinc/26/06/37/945260637.db2.gz QWIMOPCDMDHPGS-AWEZNQCLSA-N 0 0 372.487 3.973 20 5 FHBDRN Cc1noc2ncc(NC(=O)c3cc([N+](=O)[O-])cc(C(F)(F)F)c3)cc12 ZINC000437349275 945261615 /nfs/dbraw/zinc/26/16/15/945261615.db2.gz VQLVRZBUIKGWTP-UHFFFAOYSA-N 0 0 366.255 3.711 20 5 FHBDRN COc1c(C(=O)N[C@@H]2C[C@H]2c2ccc(Cl)c(F)c2)cccc1[N+](=O)[O-] ZINC000437354793 945266523 /nfs/dbraw/zinc/26/65/23/945266523.db2.gz IOQRZAKQXDGLAY-SMDDNHRTSA-N 0 0 364.760 3.682 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1NCCc1cccc(C(F)(F)F)n1)CCN2 ZINC000432180308 945269837 /nfs/dbraw/zinc/26/98/37/945269837.db2.gz VHCSAXHWNJGPGQ-UHFFFAOYSA-N 0 0 352.316 3.631 20 5 FHBDRN COc1ccc(NC(=O)NCCCn2ccc3ccccc32)cc1[N+](=O)[O-] ZINC000543894336 945276963 /nfs/dbraw/zinc/27/69/63/945276963.db2.gz YSNLTUHROVTVOZ-UHFFFAOYSA-N 0 0 368.393 3.770 20 5 FHBDRN COC(=O)CCc1ccc(NC(=O)c2c(C)cc(C)c([N+](=O)[O-])c2C)cc1 ZINC000179545142 939883811 /nfs/dbraw/zinc/88/38/11/939883811.db2.gz OKGRDNYPJYOISY-UHFFFAOYSA-N 0 0 370.405 3.878 20 5 FHBDRN Cc1nn(C)c(C)c1[C@@H]1CCCN1C(=O)c1c(C)cc(C)c([N+](=O)[O-])c1C ZINC000179551762 939884104 /nfs/dbraw/zinc/88/41/04/939884104.db2.gz XDBUKMVLWMPWHI-INIZCTEOSA-N 0 0 370.453 3.848 20 5 FHBDRN CCOc1ccc(NC(=O)c2ccc([N+](=O)[O-])c3cccnc23)cc1OC ZINC000179548500 939884209 /nfs/dbraw/zinc/88/42/09/939884209.db2.gz LDYVWOGYEQJZIG-UHFFFAOYSA-N 0 0 367.361 3.803 20 5 FHBDRN Cc1cccc(OCCN(C)C(=O)c2ccc([N+](=O)[O-])c3cccnc23)c1 ZINC000179556141 939887780 /nfs/dbraw/zinc/88/77/80/939887780.db2.gz FUZNHXVYUVJTJX-UHFFFAOYSA-N 0 0 365.389 3.602 20 5 FHBDRN Cc1cccc(C(=O)N[C@@H]2C[C@H]2c2cc(F)c(F)c(F)c2)c1[N+](=O)[O-] ZINC000437371079 945279347 /nfs/dbraw/zinc/27/93/47/945279347.db2.gz SAPSAPAPQOYXSP-SMDDNHRTSA-N 0 0 350.296 3.606 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H](CCO)c1ccccc1 ZINC000179607957 939893867 /nfs/dbraw/zinc/89/38/67/939893867.db2.gz YPHDMOHSLVCJMK-OAHLLOKOSA-N 0 0 374.462 3.603 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)NC1CCCCCC1 ZINC000086966337 945280861 /nfs/dbraw/zinc/28/08/61/945280861.db2.gz YJSIIEGWLJGOCC-UHFFFAOYSA-N 0 0 355.232 3.739 20 5 FHBDRN CCSc1cccc(NS(=O)(=O)CCc2ccccc2[N+](=O)[O-])c1 ZINC000179663214 939912857 /nfs/dbraw/zinc/91/28/57/939912857.db2.gz KISKVILEVJEUKM-UHFFFAOYSA-N 0 0 366.464 3.691 20 5 FHBDRN Cc1ccc([C@@H](NS(=O)(=O)c2ccc(C)cc2[N+](=O)[O-])C2CC2)cc1 ZINC000507499829 945281888 /nfs/dbraw/zinc/28/18/88/945281888.db2.gz VIBFJPUXLMKFMY-GOSISDBHSA-N 0 0 360.435 3.641 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1F)c1cccc(Br)c1F ZINC000236139035 939921055 /nfs/dbraw/zinc/92/10/55/939921055.db2.gz HXGRESIUFHWFBM-UHFFFAOYSA-N 0 0 357.110 3.888 20 5 FHBDRN Cc1ccc(Sc2ccc(C(=O)N3CC[C@H](CO)C3)cc2[N+](=O)[O-])cc1 ZINC000179681990 939922367 /nfs/dbraw/zinc/92/23/67/939922367.db2.gz XXPGGZUYYGQCOI-AWEZNQCLSA-N 0 0 372.446 3.509 20 5 FHBDRN C[C@H](C(=O)NCc1ccc([N+](=O)[O-])cc1)c1ccc(Br)cc1 ZINC000179747795 939930640 /nfs/dbraw/zinc/93/06/40/939930640.db2.gz ZWRAUTWTLWSHFF-NSHDSACASA-N 0 0 363.211 3.777 20 5 FHBDRN CC(=O)C[C@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000179777715 939933489 /nfs/dbraw/zinc/93/34/89/939933489.db2.gz AZZPXKJGXGCTEI-LBPRGKRZSA-N 0 0 358.419 3.843 20 5 FHBDRN COc1ccc(Cc2noc(Cc3c[nH]c4ccc([N+](=O)[O-])cc34)n2)cc1 ZINC000136372036 939937001 /nfs/dbraw/zinc/93/70/01/939937001.db2.gz VIROWLYZMDCVLM-UHFFFAOYSA-N 0 0 364.361 3.649 20 5 FHBDRN C[C@@H](NC(=O)Nc1cccc([N+](=O)[O-])c1)c1ccc(N2CCCC2=O)cc1 ZINC000065829282 939938596 /nfs/dbraw/zinc/93/85/96/939938596.db2.gz GCPAPRJOHPJZAL-CYBMUJFWSA-N 0 0 368.393 3.604 20 5 FHBDRN O=C(COCc1cccc(Cl)c1)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000410621820 939939618 /nfs/dbraw/zinc/93/96/18/939939618.db2.gz MQYIDZHSGMBEBX-UHFFFAOYSA-N 0 0 360.797 3.744 20 5 FHBDRN COc1ccc(-c2nnc(NC(=O)c3ccc(F)cc3[N+](=O)[O-])s2)cc1 ZINC000136389150 939945328 /nfs/dbraw/zinc/94/53/28/939945328.db2.gz LPSGITXABWVWEX-UHFFFAOYSA-N 0 0 374.353 3.513 20 5 FHBDRN CN(CCCc1cc(-c2ccccc2)no1)C(=O)c1ccccc1[N+](=O)[O-] ZINC000364456640 939947363 /nfs/dbraw/zinc/94/73/63/939947363.db2.gz DIGXNXMEUKYVQJ-UHFFFAOYSA-N 0 0 365.389 3.955 20 5 FHBDRN Cc1c(Cc2noc(C[C@@H]3OCCc4ccsc43)n2)cccc1[N+](=O)[O-] ZINC000364472236 939950023 /nfs/dbraw/zinc/95/00/23/939950023.db2.gz AUWXKHQCNAMXAY-HNNXBMFYSA-N 0 0 371.418 3.795 20 5 FHBDRN CC(C)c1nc(-c2ccccc2NC(=O)c2ccc([N+](=O)[O-])s2)n[nH]1 ZINC000364482580 939951308 /nfs/dbraw/zinc/95/13/08/939951308.db2.gz LZHNPWGOZCDVKY-UHFFFAOYSA-N 0 0 357.395 3.817 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1Cl)N1CCC[C@@H](C[C@H]2CCOC2)C1 ZINC000375837682 939954972 /nfs/dbraw/zinc/95/49/72/939954972.db2.gz CVIOSEDRGXWTBJ-QWHCGFSZSA-N 0 0 352.818 3.527 20 5 FHBDRN Cn1ccnc1[C@H]1CCCN1C(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000364522436 939955815 /nfs/dbraw/zinc/95/58/15/939955815.db2.gz GEZAWYUYIKYIJY-OAHLLOKOSA-N 0 0 356.426 3.603 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@H](Oc2ccccc2)C1 ZINC000573326478 939955864 /nfs/dbraw/zinc/95/58/64/939955864.db2.gz IQXUDHBLQGQMGT-YOEHRIQHSA-N 0 0 372.446 3.755 20 5 FHBDRN COC[C@H](Nc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-])c1ccccc1 ZINC000091981863 939959382 /nfs/dbraw/zinc/95/93/82/939959382.db2.gz IOAHQISILADBHK-KRWDZBQOSA-N 0 0 357.410 3.533 20 5 FHBDRN CN(C(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F)c1ccc([N+](=O)[O-])nc1 ZINC000410810346 939960729 /nfs/dbraw/zinc/96/07/29/939960729.db2.gz UFJLKSPCTFDNSC-GXTWGEPZSA-N 0 0 363.776 3.939 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)Cc1ccccc1O[C@@H]1CCOC1 ZINC000410877366 939963689 /nfs/dbraw/zinc/96/36/89/939963689.db2.gz PZUOJHXNHZZELM-QGZVFWFLSA-N 0 0 370.405 3.506 20 5 FHBDRN COc1cc(C(=O)N[C@@H]2CCCCC23CCCC3)c([N+](=O)[O-])cc1F ZINC000410877489 939965746 /nfs/dbraw/zinc/96/57/46/939965746.db2.gz CFZHEYXRBKHYET-MRXNPFEDSA-N 0 0 350.390 3.975 20 5 FHBDRN Cc1nn(CCC(=O)N(C(C)C)[C@H](C)c2ccccc2)c(C)c1[N+](=O)[O-] ZINC000410899212 939967086 /nfs/dbraw/zinc/96/70/86/939967086.db2.gz ZTSCWONAJNLZLS-OAHLLOKOSA-N 0 0 358.442 3.796 20 5 FHBDRN CCc1ccc(NC(=O)C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1CC ZINC000179831890 939967164 /nfs/dbraw/zinc/96/71/64/939967164.db2.gz NQLYOTSVNHXKJC-ZDUSSCGKSA-N 0 0 369.421 3.536 20 5 FHBDRN COCCCCc1cccnc1NC(=O)C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000410879018 939969382 /nfs/dbraw/zinc/96/93/82/939969382.db2.gz JKZGXYTWWMPMRS-UHFFFAOYSA-N 0 0 371.437 3.875 20 5 FHBDRN COCC(C)(C)N(C)C(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000410927442 939973007 /nfs/dbraw/zinc/97/30/07/939973007.db2.gz HTIKAUFUEZSNKK-UHFFFAOYSA-N 0 0 372.421 3.671 20 5 FHBDRN CC(C)(NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C(F)(F)F ZINC000410956104 939978653 /nfs/dbraw/zinc/97/86/53/939978653.db2.gz WAJUKCMPXJGJAG-UHFFFAOYSA-N 0 0 359.329 3.789 20 5 FHBDRN O=C(c1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCOC[C@H]1CC1CCC1 ZINC000410998290 939982445 /nfs/dbraw/zinc/98/24/45/939982445.db2.gz QCLFAGKGKWXBRO-CYBMUJFWSA-N 0 0 372.343 3.645 20 5 FHBDRN CN(Cc1ccccc1C(F)(F)F)C(=O)CNc1ccccc1[N+](=O)[O-] ZINC000065859931 939984966 /nfs/dbraw/zinc/98/49/66/939984966.db2.gz UVYQGARIZPGVII-UHFFFAOYSA-N 0 0 367.327 3.684 20 5 FHBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCOC1(C)C ZINC000411035149 939987384 /nfs/dbraw/zinc/98/73/84/939987384.db2.gz PRDHNCYCZUSFIN-OAHLLOKOSA-N 0 0 352.456 3.640 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])Nc1ccc(SC(F)F)cc1 ZINC000065857471 939990741 /nfs/dbraw/zinc/99/07/41/939990741.db2.gz MAWZOCNAYKAIEJ-UHFFFAOYSA-N 0 0 353.350 3.960 20 5 FHBDRN CCN(c1ccnc(NC(=O)c2cccc([N+](=O)[O-])c2C)n1)C1CCCC1 ZINC000411105561 939998534 /nfs/dbraw/zinc/99/85/34/939998534.db2.gz VLCLJXWAGBJMAV-UHFFFAOYSA-N 0 0 369.425 3.714 20 5 FHBDRN C[C@H](c1ccccc1)N(C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000047543896 945288260 /nfs/dbraw/zinc/28/82/60/945288260.db2.gz IHBJEJRFAPFIDD-LLVKDONJSA-N 0 0 354.815 3.630 20 5 FHBDRN Cc1c(C(=O)N[C@H](C)[C@@H](C)c2ccccc2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000177183530 940002439 /nfs/dbraw/zinc/00/24/39/940002439.db2.gz AMTLEXVADSLOPT-DGCLKSJQSA-N 0 0 357.366 3.733 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N(C)Cc2ccc(Cl)s2)c1F ZINC000411168306 940010168 /nfs/dbraw/zinc/01/01/68/940010168.db2.gz AJTBNDGFAVVJOW-UHFFFAOYSA-N 0 0 372.805 3.659 20 5 FHBDRN COc1cc(C)c(NC(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)cc1OC ZINC000411222828 940015622 /nfs/dbraw/zinc/01/56/22/940015622.db2.gz ODXFHJKDUYWZTE-UHFFFAOYSA-N 0 0 374.393 3.960 20 5 FHBDRN COCCN(C(=O)Nc1cccc([N+](=O)[O-])c1)[C@@H]1CCCc2cccnc21 ZINC000364908424 940020663 /nfs/dbraw/zinc/02/06/63/940020663.db2.gz OKMYRQBNFPCKIN-QGZVFWFLSA-N 0 0 370.409 3.548 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N2CCC[C@@H]2c2ccccc2)c1F ZINC000411250009 940022247 /nfs/dbraw/zinc/02/22/47/940022247.db2.gz XXUJSWJMVOFJEB-OAHLLOKOSA-N 0 0 358.369 3.649 20 5 FHBDRN CCOc1cc(C)ccc1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000448731593 940023596 /nfs/dbraw/zinc/02/35/96/940023596.db2.gz IUWDTGNXMINBIK-UHFFFAOYSA-N 0 0 356.378 3.904 20 5 FHBDRN COc1cc(F)ccc1NC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000136560277 940028858 /nfs/dbraw/zinc/02/88/58/940028858.db2.gz JEBFKTSIZNIHDC-UHFFFAOYSA-N 0 0 359.357 3.939 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)Nc2ccc(C)c(OC)c2C)c1F ZINC000411374440 940033189 /nfs/dbraw/zinc/03/31/89/940033189.db2.gz CKMVTEZJYYQEDT-UHFFFAOYSA-N 0 0 362.357 3.549 20 5 FHBDRN CC[C@@H](C)[C@H](C)N(C(=O)C(=O)Nc1cc([N+](=O)[O-])c(C)cc1C)C1CC1 ZINC000411402044 940039434 /nfs/dbraw/zinc/03/94/34/940039434.db2.gz OJHIFFSQOJIZGD-RISCZKNCSA-N 0 0 361.442 3.576 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)C(=O)N(C)C1CCC(C)(C)CC1 ZINC000411408920 940039962 /nfs/dbraw/zinc/03/99/62/940039962.db2.gz OZIKPPXNWHEICG-UHFFFAOYSA-N 0 0 361.442 3.577 20 5 FHBDRN CC(=O)c1c(C)[nH]c(C(=O)CN(Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1C ZINC000411410141 940039966 /nfs/dbraw/zinc/03/99/66/940039966.db2.gz CNSVIRQKLOVTQB-UHFFFAOYSA-N 0 0 369.421 3.590 20 5 FHBDRN CCC[C@]1(C)CCCN(C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)C1 ZINC000437387840 945291744 /nfs/dbraw/zinc/29/17/44/945291744.db2.gz RVTVTAPGAHMWSB-LJQANCHMSA-N 0 0 356.426 3.823 20 5 FHBDRN CCN(C(=O)c1cc([N+](=O)[O-])cc(F)c1F)[C@H]1CCCc2cccnc21 ZINC000365045232 940043391 /nfs/dbraw/zinc/04/33/91/940043391.db2.gz WCWARXNMKYOUQX-HNNXBMFYSA-N 0 0 361.348 3.808 20 5 FHBDRN Cc1nnc([C@@H]2CC23CCN(c2nc4ccccc4cc2[N+](=O)[O-])CC3)o1 ZINC000365030697 940045517 /nfs/dbraw/zinc/04/55/17/940045517.db2.gz YSGDXATZXGSABG-AWEZNQCLSA-N 0 0 365.393 3.609 20 5 FHBDRN CCC(=O)Nc1ccc(NC(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)cc1 ZINC000411460677 940049761 /nfs/dbraw/zinc/04/97/61/940049761.db2.gz UWYQOVGTSYREII-UHFFFAOYSA-N 0 0 371.393 3.983 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)NC[C@@H]1C[C@H]1c1ccccc1 ZINC000111050717 945292392 /nfs/dbraw/zinc/29/23/92/945292392.db2.gz TXBWNPRIQPTVNF-LPHOPBHVSA-N 0 0 353.422 3.707 20 5 FHBDRN COc1ccc(NC(=O)NCCSCc2ccccc2)cc1[N+](=O)[O-] ZINC000782612722 940051594 /nfs/dbraw/zinc/05/15/94/940051594.db2.gz JWCVCVDPPIYQKX-UHFFFAOYSA-N 0 0 361.423 3.658 20 5 FHBDRN CCc1ccc([C@@H](NCc2cc(C)ncn2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000612414505 940053287 /nfs/dbraw/zinc/05/32/87/940053287.db2.gz JGQGLVMVIMAKMX-IBGZPJMESA-N 0 0 352.394 3.728 20 5 FHBDRN COc1ccc(C(=O)C[C@@H](C)C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000612422684 940059282 /nfs/dbraw/zinc/05/92/82/940059282.db2.gz UKSXTMUESXEWCM-CYBMUJFWSA-N 0 0 356.378 3.759 20 5 FHBDRN CC(C)Oc1cc(C(=O)N(C)C2Cc3ccccc3C2)ccc1[N+](=O)[O-] ZINC000411596339 940069105 /nfs/dbraw/zinc/06/91/05/940069105.db2.gz LUGYUXBUYNVVTJ-UHFFFAOYSA-N 0 0 354.406 3.621 20 5 FHBDRN C[C@@H](C(=O)Nc1ccc2c(c1)OCCCO2)c1ccc([N+](=O)[O-])cc1F ZINC000612442110 940070955 /nfs/dbraw/zinc/07/09/55/940070955.db2.gz HVPLDSJCWAUPMF-LLVKDONJSA-N 0 0 360.341 3.637 20 5 FHBDRN Cc1cccc([C@@H]2CCCN2C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)n1 ZINC000167508749 940073282 /nfs/dbraw/zinc/07/32/82/940073282.db2.gz BWTZQXIKOBSYKG-SFHVURJKSA-N 0 0 366.421 3.850 20 5 FHBDRN C[C@H](c1ccc([S@](C)=O)cc1)N(C)C(=O)/C=C/c1ccc([N+](=O)[O-])cc1 ZINC000177290549 940082022 /nfs/dbraw/zinc/08/20/22/940082022.db2.gz HDBBICCZYLSTOF-LHFWLYMWSA-N 0 0 372.446 3.565 20 5 FHBDRN C[C@@H](C(=O)N1CCCO[C@H](c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000612469757 940088584 /nfs/dbraw/zinc/08/85/84/940088584.db2.gz WWKQOHUXZZXDSX-KUHUBIRLSA-N 0 0 372.396 3.828 20 5 FHBDRN CCC[C@@H](NC(=O)C(=O)Nc1c(C)ccc([N+](=O)[O-])c1C)C1CCCC1 ZINC000411714097 940095103 /nfs/dbraw/zinc/09/51/03/940095103.db2.gz CTWMMKIUHWDMFU-OAHLLOKOSA-N 0 0 361.442 3.625 20 5 FHBDRN CCc1c(NC(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)cnn1CC(C)C ZINC000612485496 940095514 /nfs/dbraw/zinc/09/55/14/940095514.db2.gz UWTBFBYTCJMQPX-GFCCVEGCSA-N 0 0 362.405 3.891 20 5 FHBDRN Cc1nnc(-c2cccc(NC(=O)c3cccc(Cl)c3[N+](=O)[O-])c2)o1 ZINC000177314732 940107922 /nfs/dbraw/zinc/10/79/22/940107922.db2.gz YSFIFHJYQLMYHT-UHFFFAOYSA-N 0 0 358.741 3.859 20 5 FHBDRN O=C(COc1cc([N+](=O)[O-])ccc1Cl)NCc1ccc(Cl)cc1 ZINC000177333782 940119637 /nfs/dbraw/zinc/11/96/37/940119637.db2.gz UFHZZYWTASWWHW-UHFFFAOYSA-N 0 0 355.177 3.597 20 5 FHBDRN CC(C)(C(=O)Nc1ccc(NC(=O)C2CC2)cc1)c1ccccc1[N+](=O)[O-] ZINC000431659259 940120587 /nfs/dbraw/zinc/12/05/87/940120587.db2.gz ROMFINGKNZBUBE-UHFFFAOYSA-N 0 0 367.405 3.860 20 5 FHBDRN O=[N+]([O-])c1ccc(Cl)c(OCc2nc(CCc3ccccc3)no2)c1 ZINC000177336278 940121128 /nfs/dbraw/zinc/12/11/28/940121128.db2.gz VMHCRMNGPNEKHR-UHFFFAOYSA-N 0 0 359.769 3.995 20 5 FHBDRN C[C@@H]1CC2(CCC2)CN1C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000365334108 940127604 /nfs/dbraw/zinc/12/76/04/940127604.db2.gz ZXQOLFSMSCWPFD-OAHLLOKOSA-N 0 0 357.454 3.602 20 5 FHBDRN CC(C)(C)n1cc(NC(=O)c2c([N+](=O)[O-])cccc2C(F)(F)F)cn1 ZINC000612532693 940128215 /nfs/dbraw/zinc/12/82/15/940128215.db2.gz NJBYWPXJQZTKNH-UHFFFAOYSA-N 0 0 356.304 3.817 20 5 FHBDRN Cc1c(CC(=O)N[C@@H]2CCCOc3c(F)cccc32)cccc1[N+](=O)[O-] ZINC000179918985 940129215 /nfs/dbraw/zinc/12/92/15/940129215.db2.gz LUMHDQXEYNRHGU-MRXNPFEDSA-N 0 0 358.369 3.615 20 5 FHBDRN Cc1cc2cc(C(=O)N3CCC(n4ccc([N+](=O)[O-])n4)CC3)oc2cc1C ZINC000365368127 940134816 /nfs/dbraw/zinc/13/48/16/940134816.db2.gz VYWZPFQBZICFGN-UHFFFAOYSA-N 0 0 368.393 3.632 20 5 FHBDRN Cc1cc(CNC(=O)c2cc([N+](=O)[O-])ccc2SCC2CCCC2)[nH]n1 ZINC000612545629 940137579 /nfs/dbraw/zinc/13/75/79/940137579.db2.gz KSRYBJFIXYHWJR-UHFFFAOYSA-N 0 0 374.466 3.839 20 5 FHBDRN C[C@H](CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)c1ccc(F)cc1F ZINC000136717686 940143097 /nfs/dbraw/zinc/14/30/97/940143097.db2.gz HJZVGVXIUZOBJF-LLVKDONJSA-N 0 0 373.359 3.817 20 5 FHBDRN O=C(N[C@@H](c1ccccc1)c1ccncc1)c1cc([N+](=O)[O-])cc(F)c1F ZINC000365412596 940150546 /nfs/dbraw/zinc/15/05/46/940150546.db2.gz NRUSQZRIDVMVJY-SFHVURJKSA-N 0 0 369.327 3.787 20 5 FHBDRN Cc1ccc(Cl)c(OC[C@@H](O)COc2cc(F)cc([N+](=O)[O-])c2)c1 ZINC000612605174 940175665 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COc1cc(OCC(=O)Oc2c(Cl)cccc2Cl)ccc1[N+](=O)[O-] ZINC000066015206 940195104 /nfs/dbraw/zinc/19/51/04/940195104.db2.gz ZIRVCGWUQWIBIT-UHFFFAOYSA-N 0 0 372.160 3.895 20 5 FHBDRN CCC1CCC(CNC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)CC1 ZINC000066026025 940204559 /nfs/dbraw/zinc/20/45/59/940204559.db2.gz ZELWMKHPXYBDJD-UHFFFAOYSA-N 0 0 356.426 3.727 20 5 FHBDRN CC(C)CCn1nccc1NC(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000612676926 940218545 /nfs/dbraw/zinc/21/85/45/940218545.db2.gz QYERKFGOVLNLPD-ZDUSSCGKSA-N 0 0 362.455 3.957 20 5 FHBDRN CC(C)[C@@H]1c2ccccc2CCN1S(=O)(=O)Cc1ccccc1[N+](=O)[O-] ZINC000612679682 940219587 /nfs/dbraw/zinc/21/95/87/940219587.db2.gz DHTGUJWCMZPIGE-LJQANCHMSA-N 0 0 374.462 3.680 20 5 FHBDRN COc1ccc(CSCC(=O)Nc2cccc(Cl)n2)cc1[N+](=O)[O-] ZINC000177500199 940236619 /nfs/dbraw/zinc/23/66/19/940236619.db2.gz ZTYIXJYNMLYJJA-UHFFFAOYSA-N 0 0 367.814 3.524 20 5 FHBDRN Cc1cccnc1C(=O)Nc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1 ZINC000427374831 945309259 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Cc1ccc2nc(NC(=O)c3cc([N+](=O)[O-])cc4c3OCCO4)sc2c1 ZINC000066268423 940380419 /nfs/dbraw/zinc/38/04/19/940380419.db2.gz CDXXKXCHPZKRRQ-UHFFFAOYSA-N 0 0 371.374 3.536 20 5 FHBDRN CCOc1cc(OCc2nc(CCc3ccccc3)no2)ccc1[N+](=O)[O-] ZINC000188609517 940393645 /nfs/dbraw/zinc/39/36/45/940393645.db2.gz OPDQFDUXJURVDD-UHFFFAOYSA-N 0 0 369.377 3.741 20 5 FHBDRN COC(=O)c1ccccc1C(=O)c1ccc(NC[C@@H]2C[C@H]2C)c([N+](=O)[O-])c1 ZINC000579896566 940413074 /nfs/dbraw/zinc/41/30/74/940413074.db2.gz NJMASMMUYZYIIA-OCCSQVGLSA-N 0 0 368.389 3.680 20 5 FHBDRN CN(C(=O)c1cc([N+](=O)[O-])cc2c1OCCO2)c1cccc2ccccc21 ZINC000066333304 940438673 /nfs/dbraw/zinc/43/86/73/940438673.db2.gz ICZYWKGOTCHLEY-UHFFFAOYSA-N 0 0 364.357 3.796 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1N[C@H]1CCc2nnc(-c3ccc(F)cc3)n2C1 ZINC000472499133 940439080 /nfs/dbraw/zinc/43/90/80/940439080.db2.gz MHDNTQSMHUYOPR-HNNXBMFYSA-N 0 0 367.384 3.728 20 5 FHBDRN COc1cc(CN2Cc3ccccc3C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000180087576 940445567 /nfs/dbraw/zinc/44/55/67/940445567.db2.gz QTZYQBWLNVGUOC-UHFFFAOYSA-N 0 0 364.348 3.763 20 5 FHBDRN Cc1cccnc1-c1noc(CCOc2ccc(Cl)cc2[N+](=O)[O-])n1 ZINC000545611235 945321778 /nfs/dbraw/zinc/32/17/78/945321778.db2.gz PPHULXSHBGKVMH-UHFFFAOYSA-N 0 0 360.757 3.623 20 5 FHBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N[C@H]1CCC[C@@H](F)C1 ZINC000580077544 940451955 /nfs/dbraw/zinc/45/19/55/940451955.db2.gz UVWAFFAHUKHNEC-ZJUUUORDSA-N 0 0 359.195 3.676 20 5 FHBDRN COC(=O)c1ccc(OCc2csc(Br)c2)cc1[N+](=O)[O-] ZINC000613109146 940452007 /nfs/dbraw/zinc/45/20/07/940452007.db2.gz PFIGILUQRPCICK-UHFFFAOYSA-N 0 0 372.196 3.784 20 5 FHBDRN COc1ccc(C2(NC(=O)CCc3ccc([N+](=O)[O-])cc3Cl)CC2)cc1 ZINC001125806666 940452343 /nfs/dbraw/zinc/45/23/43/940452343.db2.gz IKSDDZCXQWGFCI-UHFFFAOYSA-N 0 0 374.824 3.995 20 5 FHBDRN CC[C@H]1CN(c2ccccc2)CCN1c1ncnc2ccc([N+](=O)[O-])cc21 ZINC000613114161 940457221 /nfs/dbraw/zinc/45/72/21/940457221.db2.gz HJCPOFQTCCGLIH-HNNXBMFYSA-N 0 0 363.421 3.643 20 5 FHBDRN COc1ccc(OC)c(CN(C(=O)c2ccc([N+](=O)[O-])o2)C(C)(C)C)c1 ZINC000548994394 940458627 /nfs/dbraw/zinc/45/86/27/940458627.db2.gz ZXVMIGHEORSYSJ-UHFFFAOYSA-N 0 0 362.382 3.646 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(Cl)c(OC)c2)c1 ZINC000548994144 940459343 /nfs/dbraw/zinc/45/93/43/940459343.db2.gz ZKXABEULOSVEKB-UHFFFAOYSA-N 0 0 350.758 3.908 20 5 FHBDRN CCn1nc(C)c(C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1Cl ZINC000177843078 940461635 /nfs/dbraw/zinc/46/16/35/940461635.db2.gz LVJARPXYRHQMRJ-SNVBAGLBSA-N 0 0 350.806 3.572 20 5 FHBDRN C[C@H](C(=O)N1CCC[C@H](Nc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000580274188 940471482 /nfs/dbraw/zinc/47/14/82/940471482.db2.gz ZPRWXOZFNBZVOM-YJBOKZPZSA-N 0 0 353.422 3.801 20 5 FHBDRN C[C@@H](C(=O)Nc1cn(C)nc1-c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000580299592 940472552 /nfs/dbraw/zinc/47/25/52/940472552.db2.gz OSWOHAJOCKRYIH-CYBMUJFWSA-N 0 0 350.378 3.738 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)/C=C/c2cnc3ccccc3n2)cc1[N+](=O)[O-] ZINC000177873688 940472912 /nfs/dbraw/zinc/47/29/12/940472912.db2.gz GIQKPJJCXOTURG-HBWSCVEGSA-N 0 0 362.389 3.737 20 5 FHBDRN CC[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1OC)c1cc(F)ccc1F ZINC000427395716 945323533 /nfs/dbraw/zinc/32/35/33/945323533.db2.gz ALHIDZGMTQXHAQ-HNNXBMFYSA-N 0 0 350.321 3.763 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(-n3ccnc3)c(F)c2)c1 ZINC000580337508 940473249 /nfs/dbraw/zinc/47/32/49/940473249.db2.gz HESNXNRUTXXOOZ-UHFFFAOYSA-N 0 0 370.340 3.571 20 5 FHBDRN C[C@@H](C(=O)Nc1cccc(OC[C@@H]2CCCO2)c1)c1cccc([N+](=O)[O-])c1 ZINC000580507618 940477407 /nfs/dbraw/zinc/47/74/07/940477407.db2.gz QFUKXQJBOCYXAC-KUHUBIRLSA-N 0 0 370.405 3.895 20 5 FHBDRN C[C@@H](C(=O)Nc1cccc(OC[C@H]2CCCO2)c1)c1cccc([N+](=O)[O-])c1 ZINC000580507616 940477450 /nfs/dbraw/zinc/47/74/50/940477450.db2.gz QFUKXQJBOCYXAC-AUUYWEPGSA-N 0 0 370.405 3.895 20 5 FHBDRN Cc1ccccc1C[C@H]1CCCN1C(=O)NCc1ccccc1[N+](=O)[O-] ZINC000580733887 940483242 /nfs/dbraw/zinc/48/32/42/940483242.db2.gz BAIHSOJNMDAAKX-GOSISDBHSA-N 0 0 353.422 3.820 20 5 FHBDRN CCOc1ccc(C(=O)Nc2cncc(Cl)c2Cl)cc1[N+](=O)[O-] ZINC000180110229 940483303 /nfs/dbraw/zinc/48/33/03/940483303.db2.gz ZVCJQSVZNBGFMT-UHFFFAOYSA-N 0 0 356.165 3.948 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CCO[C@@H](c3ccccc3)C2)c1 ZINC000549005327 940484014 /nfs/dbraw/zinc/48/40/14/940484014.db2.gz BBMNPHHWNKJEGA-DNVCBOLYSA-N 0 0 370.405 3.644 20 5 FHBDRN CC(=O)c1cc(NC2CCN(c3cccc(C)n3)CC2)ccc1[N+](=O)[O-] ZINC000376222933 940484593 /nfs/dbraw/zinc/48/45/93/940484593.db2.gz SOMDLMOMLURZCY-UHFFFAOYSA-N 0 0 354.410 3.582 20 5 FHBDRN CC(C)[C@@H]1N(C(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)CC12CCC2 ZINC000580750408 940484724 /nfs/dbraw/zinc/48/47/24/940484724.db2.gz HQHFZCCQRWFUDL-SFHVURJKSA-N 0 0 370.453 3.839 20 5 FHBDRN Cc1ccc(OC[C@@H](O)Cc2ccccc2C(F)(F)F)c([N+](=O)[O-])c1 ZINC000580822258 940486336 /nfs/dbraw/zinc/48/63/36/940486336.db2.gz UMXPVMVNGFACMB-ZDUSSCGKSA-N 0 0 355.312 3.904 20 5 FHBDRN CNc1c(C(=O)N(CCOC)Cc2ccc(C)cc2C)cccc1[N+](=O)[O-] ZINC000613225181 940486892 /nfs/dbraw/zinc/48/68/92/940486892.db2.gz UQVRXJMLRKYHCF-UHFFFAOYSA-N 0 0 371.437 3.542 20 5 FHBDRN Cc1cc(C(=O)NC(C)C)ccc1NC(=O)c1cc(F)cc(C)c1[N+](=O)[O-] ZINC000177938904 940487909 /nfs/dbraw/zinc/48/79/09/940487909.db2.gz YZGMLFKJDIXPIU-UHFFFAOYSA-N 0 0 373.384 3.741 20 5 FHBDRN CC(C)n1ccc(CNC(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)n1 ZINC000580926937 940489090 /nfs/dbraw/zinc/48/90/90/940489090.db2.gz GDIPJWPBDRAGCV-UHFFFAOYSA-N 0 0 371.319 3.713 20 5 FHBDRN CNc1c(C(=O)Nc2nc3ccccc3n2C2CC2)cccc1[N+](=O)[O-] ZINC000613235948 940490033 /nfs/dbraw/zinc/49/00/33/940490033.db2.gz WWYWTVHFJWGKLF-UHFFFAOYSA-N 0 0 351.366 3.573 20 5 FHBDRN C[C@H](Cc1ccccc1F)NC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000431774380 940491273 /nfs/dbraw/zinc/49/12/73/940491273.db2.gz FDRXVMJKQNSKJO-CYBMUJFWSA-N 0 0 359.401 3.899 20 5 FHBDRN COc1cccc([C@@H](C)NC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000431773690 940491958 /nfs/dbraw/zinc/49/19/58/940491958.db2.gz PWBGSTOYHXKBLY-CYBMUJFWSA-N 0 0 357.410 3.899 20 5 FHBDRN CO[C@@H]1[C@H]2C[C@H]3CN(c4ccc([N+](=O)[O-])c(-c5ccccc5)n4)[C@H]1[C@H]3C2 ZINC000581074203 940492713 /nfs/dbraw/zinc/49/27/13/940492713.db2.gz MFDUIEDRHRSIFU-IYNKWVJVSA-N 0 0 351.406 3.516 20 5 FHBDRN C[C@@H](CN(C)C(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1)c1ccccc1 ZINC000066458681 940495021 /nfs/dbraw/zinc/49/50/21/940495021.db2.gz RDNNQRIZRCJPCP-HNNXBMFYSA-N 0 0 364.405 3.656 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NS(=O)(=O)c1c(C)ccc2ncccc21 ZINC000613263942 940496946 /nfs/dbraw/zinc/49/69/46/940496946.db2.gz FGNIZJMYHVRYSU-UHFFFAOYSA-N 0 0 371.418 3.869 20 5 FHBDRN CCC(=O)Nc1cccc(-c2noc(-c3cccc(OC)c3[N+](=O)[O-])n2)c1 ZINC000581275182 940498381 /nfs/dbraw/zinc/49/83/81/940498381.db2.gz QFLWWUTWMKQGLR-UHFFFAOYSA-N 0 0 368.349 3.669 20 5 FHBDRN Cc1ccc([C@@H](CNc2cc(C)c([N+](=O)[O-])c(C(=O)[O-])c2)[NH+](C)C)cc1 ZINC000581313952 940498761 /nfs/dbraw/zinc/49/87/61/940498761.db2.gz XGKWJPGIYIPRTO-QGZVFWFLSA-N 0 0 357.410 3.625 20 5 FHBDRN CC(C)CCSc1ccc(C(=O)N2CCOCC23CC3)cc1[N+](=O)[O-] ZINC000549013644 940498945 /nfs/dbraw/zinc/49/89/45/940498945.db2.gz ZWXJFPBERSCMRN-UHFFFAOYSA-N 0 0 364.467 3.738 20 5 FHBDRN Cc1cc(NC[C@H](c2ccccc2)[NH+]2CCCC2)c(C(=O)[O-])cc1[N+](=O)[O-] ZINC000581432284 940502354 /nfs/dbraw/zinc/50/23/54/940502354.db2.gz QBNPGDVNZRPFCN-LJQANCHMSA-N 0 0 369.421 3.850 20 5 FHBDRN CC(C)(C)OC(=O)NC[C@@H]1CCN(Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000178012414 940506498 /nfs/dbraw/zinc/50/64/98/940506498.db2.gz YQRCIVCURDKBSB-ZDUSSCGKSA-N 0 0 369.849 3.595 20 5 FHBDRN Cc1nc(CC2CC2)sc1C(=O)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000581495185 940507147 /nfs/dbraw/zinc/50/71/47/940507147.db2.gz WPAOBBVGZDJZAH-UHFFFAOYSA-N 0 0 359.451 3.627 20 5 FHBDRN CC(C)[C@H]1C[C@@H](CC(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)CCO1 ZINC000581511626 940507720 /nfs/dbraw/zinc/50/77/20/940507720.db2.gz UXCSUASTXSHOIC-IFXJQAMLSA-N 0 0 373.453 3.576 20 5 FHBDRN COC(=O)Nc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)ccc1F ZINC000066489671 940507926 /nfs/dbraw/zinc/50/79/26/940507926.db2.gz FLUOHXLNYPGRMD-UHFFFAOYSA-N 0 0 367.720 3.818 20 5 FHBDRN CCOC(=O)C1CCC([N@H+](CC)Cc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000581733186 940510911 /nfs/dbraw/zinc/51/09/11/940510911.db2.gz RKQYOOHDPLTVFD-UHFFFAOYSA-N 0 0 352.406 3.678 20 5 FHBDRN O=[N+]([O-])c1cc2ccccc2nc1N1CCCN2c3ccccc3C[C@@H]2C1 ZINC000581758681 940511874 /nfs/dbraw/zinc/51/18/74/940511874.db2.gz WSJHWSHLBHNWNX-QGZVFWFLSA-N 0 0 360.417 3.784 20 5 FHBDRN CC(=O)Nc1ccc(F)c(C(=O)Oc2cc(Cl)ccc2[N+](=O)[O-])c1 ZINC000124777810 945328883 /nfs/dbraw/zinc/32/88/83/945328883.db2.gz KGFLUQRNXUPEFS-UHFFFAOYSA-N 0 0 352.705 3.565 20 5 FHBDRN COc1ccc(OCCC(=O)Oc2cc(Cl)ccc2[N+](=O)[O-])cc1 ZINC000124792203 945329099 /nfs/dbraw/zinc/32/90/99/945329099.db2.gz MZDKRZCHHWPTJX-UHFFFAOYSA-N 0 0 351.742 3.631 20 5 FHBDRN O=C(c1ccc(F)cc1[N+](=O)[O-])N1CC[C@@](F)(c2ccccc2F)C1 ZINC000549014267 940590429 /nfs/dbraw/zinc/59/04/29/940590429.db2.gz BFEARYAATDWUQL-KRWDZBQOSA-N 0 0 350.296 3.584 20 5 FHBDRN CCOc1cc(Cl)ccc1NC(=O)c1ccc([N+](=O)[O-])cc1OC ZINC000427389444 945333974 /nfs/dbraw/zinc/33/39/74/945333974.db2.gz FVFIWMCTGHWNID-UHFFFAOYSA-N 0 0 350.758 3.908 20 5 FHBDRN Cc1nc(-c2ccc(CNC(=O)c3ccc([N+](=O)[O-])cc3C)o2)cs1 ZINC000511490221 940629709 /nfs/dbraw/zinc/62/97/09/940629709.db2.gz MDOXTAFTPHSNKN-UHFFFAOYSA-N 0 0 357.391 3.858 20 5 FHBDRN CCOC(=O)c1c(C)onc1COc1cc(C)c([N+](=O)[O-])cc1Cl ZINC000581888554 940629911 /nfs/dbraw/zinc/62/99/11/940629911.db2.gz KMMDGFMKACOZSX-UHFFFAOYSA-N 0 0 354.746 3.609 20 5 FHBDRN CN(C(=O)CCCNc1ccc([N+](=O)[O-])cc1)C1CCC(F)(F)CC1 ZINC000581905249 940631950 /nfs/dbraw/zinc/63/19/50/940631950.db2.gz XCEZVKCSIJXBCR-UHFFFAOYSA-N 0 0 355.385 3.823 20 5 FHBDRN CCc1ccc([C@@H](NCCc2nnc(C)s2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000582127957 940648595 /nfs/dbraw/zinc/64/85/95/940648595.db2.gz QPTSHHHAOVGCQG-SFHVURJKSA-N 0 0 372.450 3.832 20 5 FHBDRN COc1cc(CN2CCC3(CC2)OCc2ccccc23)c([N+](=O)[O-])cc1F ZINC000613380845 940651806 /nfs/dbraw/zinc/65/18/06/940651806.db2.gz RHVHGKHQYLWHFT-UHFFFAOYSA-N 0 0 372.396 3.764 20 5 FHBDRN C[C@@H]1CCc2ccccc2[C@@H]1NC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000582443740 940672039 /nfs/dbraw/zinc/67/20/39/940672039.db2.gz BZPSWMNBPBAMLT-NSPYISDASA-N 0 0 360.360 3.855 20 5 FHBDRN O=[N+]([O-])c1ccc(N[C@H]2CCCN(CC(F)(F)F)C2)c2ncccc12 ZINC000582452062 940672249 /nfs/dbraw/zinc/67/22/49/940672249.db2.gz ROXSFNJYPWCLND-NSHDSACASA-N 0 0 354.332 3.582 20 5 FHBDRN Cc1ccc(NC(=O)N2CCO[C@H](CCc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000582448031 940672324 /nfs/dbraw/zinc/67/23/24/940672324.db2.gz OJXROLROFCYVKA-GOSISDBHSA-N 0 0 369.421 3.769 20 5 FHBDRN Cc1cc(NC(=O)c2ccc(F)cc2[N+](=O)[O-])nn1-c1cccc(F)c1 ZINC000180137878 940673724 /nfs/dbraw/zinc/67/37/24/940673724.db2.gz POHMBVOEUYEDPE-UHFFFAOYSA-N 0 0 358.304 3.619 20 5 FHBDRN CC(C)(NC(=O)Cc1coc(-c2cccs2)n1)c1ccccc1[N+](=O)[O-] ZINC000582504441 940682491 /nfs/dbraw/zinc/68/24/91/940682491.db2.gz DZSKDDJWYOUNGH-UHFFFAOYSA-N 0 0 371.418 3.905 20 5 FHBDRN COc1ccccc1[C@H]1CCCN1c1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000427414340 945344048 /nfs/dbraw/zinc/34/40/48/945344048.db2.gz LWWBPKWSDFLIBI-MRXNPFEDSA-N 0 0 366.377 3.995 20 5 FHBDRN Cc1sc(S(=O)(=O)N2CC(C)(C)[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000613471787 940739039 /nfs/dbraw/zinc/73/90/39/940739039.db2.gz BVTALKOXEJDMPU-OAHLLOKOSA-N 0 0 366.464 3.737 20 5 FHBDRN COc1cc(C(=O)N(Cc2ccccc2)CC(F)F)ccc1[N+](=O)[O-] ZINC000174622934 940756717 /nfs/dbraw/zinc/75/67/17/940756717.db2.gz APGZMSPUMGSOLJ-UHFFFAOYSA-N 0 0 350.321 3.511 20 5 FHBDRN CN(CCc1ccc(Br)cc1)C(=O)c1cccc([N+](=O)[O-])c1 ZINC000106666810 945353152 /nfs/dbraw/zinc/35/31/52/945353152.db2.gz IKWUAXVJULOSCD-UHFFFAOYSA-N 0 0 363.211 3.672 20 5 FHBDRN COc1ccc2oc([C@@H](C)NC(=O)c3cc([N+](=O)[O-])cnc3C)c(C)c2c1 ZINC000106665749 945353262 /nfs/dbraw/zinc/35/32/62/945353262.db2.gz BQNCFYHATNLOFX-GFCCVEGCSA-N 0 0 369.377 3.852 20 5 FHBDRN Cc1cccc(NC(=O)N2CCN([C@H](C)c3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000170686644 940780738 /nfs/dbraw/zinc/78/07/38/940780738.db2.gz GIHRBLDLYRLPAB-MRXNPFEDSA-N 0 0 368.437 3.814 20 5 FHBDRN CC(C)N(C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2)[C@H](C)c1ccsc1 ZINC000582659762 940794376 /nfs/dbraw/zinc/79/43/76/940794376.db2.gz MQSQKKRDKYUHMV-LLVKDONJSA-N 0 0 362.407 3.997 20 5 FHBDRN Cc1c(CC(=O)N2C[C@@H](C(C)C)Nc3ccccc32)cccc1[N+](=O)[O-] ZINC000440258302 945349781 /nfs/dbraw/zinc/34/97/81/945349781.db2.gz HZTKVGAWZKGSIV-KRWDZBQOSA-N 0 0 353.422 3.929 20 5 FHBDRN CC[C@@H](NC(=O)c1nn(CC)cc1[N+](=O)[O-])c1cccc2ccccc21 ZINC000894850066 945350565 /nfs/dbraw/zinc/35/05/65/945350565.db2.gz HSIBLEDYUFLTFD-MRXNPFEDSA-N 0 0 352.394 3.846 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN(C)[C@@H](C)c1cc(F)ccc1F ZINC000053125744 940827189 /nfs/dbraw/zinc/82/71/89/940827189.db2.gz WSHVKVLKFGTBHG-LBPRGKRZSA-N 0 0 363.364 3.813 20 5 FHBDRN CN(CCc1ccc(Br)cc1)C(=O)c1ccccc1[N+](=O)[O-] ZINC000106667205 945352809 /nfs/dbraw/zinc/35/28/09/945352809.db2.gz XJUDBGSKXBXWQF-UHFFFAOYSA-N 0 0 363.211 3.672 20 5 FHBDRN COc1cc(C(=O)N2CCC(c3ccccc3C)CC2)ccc1[N+](=O)[O-] ZINC000106662029 945354333 /nfs/dbraw/zinc/35/43/33/945354333.db2.gz UZPHCOZEOPYBBZ-UHFFFAOYSA-N 0 0 354.406 3.932 20 5 FHBDRN O=C(Nc1ccc(F)c([N+](=O)[O-])c1)c1c(F)cccc1Br ZINC000175372152 940856491 /nfs/dbraw/zinc/85/64/91/940856491.db2.gz ABSHDCHTIJYCIJ-UHFFFAOYSA-N 0 0 357.110 3.888 20 5 FHBDRN CCCOc1ncccc1CNC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000175451607 940865792 /nfs/dbraw/zinc/86/57/92/940865792.db2.gz BZXJJZTWYUUGCY-UHFFFAOYSA-N 0 0 372.425 3.513 20 5 FHBDRN COc1cc(C(=O)N2CC[C@H](C)C[C@@H]2c2ccco2)c([N+](=O)[O-])cc1OC ZINC000175464907 940867884 /nfs/dbraw/zinc/86/78/84/940867884.db2.gz RKJBKVNKWQGPHB-SWLSCSKDSA-N 0 0 374.393 3.818 20 5 FHBDRN Cc1ccc(CNC(=O)c2ccc(Br)cc2[N+](=O)[O-])c(C)c1 ZINC000175572956 940889844 /nfs/dbraw/zinc/88/98/44/940889844.db2.gz XNOZFNJARSKLBA-UHFFFAOYSA-N 0 0 363.211 3.904 20 5 FHBDRN CCc1ccc(CNC(=O)c2ccc(Br)cc2[N+](=O)[O-])s1 ZINC000175610199 940898691 /nfs/dbraw/zinc/89/86/91/940898691.db2.gz BQAKEWSXQOXORD-UHFFFAOYSA-N 0 0 369.240 3.911 20 5 FHBDRN COc1ccc([C@@H]2CCCN2C(=O)Cc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000124924673 945359197 /nfs/dbraw/zinc/35/91/97/945359197.db2.gz LMYKTFOMBSOCLZ-SFHVURJKSA-N 0 0 358.369 3.649 20 5 FHBDRN CC(C)(CNC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-])C(F)(F)F ZINC000549057923 940911824 /nfs/dbraw/zinc/91/18/24/940911824.db2.gz RZVRAZJHIGJMAU-UHFFFAOYSA-N 0 0 367.755 3.678 20 5 FHBDRN C[C@H](Nc1ccc(C(N)=O)cc1[N+](=O)[O-])c1cccc(OC(F)(F)F)c1 ZINC000175730864 940915911 /nfs/dbraw/zinc/91/59/11/940915911.db2.gz ALARDKUCJUVIKO-VIFPVBQESA-N 0 0 369.299 3.765 20 5 FHBDRN Cc1ccc(NC(=O)N(CCc2ccccc2)[C@@H]2CCOC2)cc1[N+](=O)[O-] ZINC000175861453 940940756 /nfs/dbraw/zinc/94/07/56/940940756.db2.gz MJKFJOBMDMZKKI-GOSISDBHSA-N 0 0 369.421 3.769 20 5 FHBDRN COc1cc(C(=O)N2CCCC[C@H]2c2cccn2C)cc([N+](=O)[O-])c1C ZINC000188683238 940955952 /nfs/dbraw/zinc/95/59/52/940955952.db2.gz XIWGPQIMALAPRO-INIZCTEOSA-N 0 0 357.410 3.618 20 5 FHBDRN Cc1csc2ncn(Cc3cc([N+](=O)[O-])ccc3C(F)(F)F)c(=O)c12 ZINC000549063786 940963250 /nfs/dbraw/zinc/96/32/50/940963250.db2.gz ISJKMZXVIKCTMT-UHFFFAOYSA-N 0 0 369.324 3.742 20 5 FHBDRN CC(=O)c1cc(N2CCO[C@@H](c3ccc(F)cc3F)C2)ccc1[N+](=O)[O-] ZINC000376419832 940963656 /nfs/dbraw/zinc/96/36/56/940963656.db2.gz IJYHRRPRPPSYRP-GOSISDBHSA-N 0 0 362.332 3.654 20 5 FHBDRN COC(=O)[C@@H](C)Cc1ccc(NC(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1 ZINC000186239099 940963786 /nfs/dbraw/zinc/96/37/86/940963786.db2.gz MSPYKJQTMZFWHA-ZDUSSCGKSA-N 0 0 356.378 3.507 20 5 FHBDRN COCCn1nc(C)c(NCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)c1C ZINC000186261513 940967037 /nfs/dbraw/zinc/96/70/37/940967037.db2.gz JJBCFQWGPKNFGT-UHFFFAOYSA-N 0 0 370.409 3.927 20 5 FHBDRN O=C(NCc1nc2ccccc2n1C1CC1)c1ccc([N+](=O)[O-])cc1Cl ZINC000186266477 940968834 /nfs/dbraw/zinc/96/88/34/940968834.db2.gz PVRUXSDKLIFNHX-UHFFFAOYSA-N 0 0 370.796 3.863 20 5 FHBDRN CCOc1cc(C(=O)N2CCc3ccc([N+](=O)[O-])cc32)cc(Cl)c1O ZINC000186447410 941000360 /nfs/dbraw/zinc/00/03/60/941000360.db2.gz AMXHUEPPANILHG-UHFFFAOYSA-N 0 0 362.769 3.555 20 5 FHBDRN CC(=O)N1CCC(C[NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC1 ZINC000180478679 941026033 /nfs/dbraw/zinc/02/60/33/941026033.db2.gz GSPHNPYLXYZTAJ-NRFANRHFSA-N 0 0 367.449 3.532 20 5 FHBDRN COc1cc(CCNC(=O)C2(C)CCCCCC2)c([N+](=O)[O-])cc1OC ZINC000180521710 941035942 /nfs/dbraw/zinc/03/59/42/941035942.db2.gz ORUZUCZRUPSQNX-UHFFFAOYSA-N 0 0 364.442 3.631 20 5 FHBDRN CC(=O)NCc1ccc([C@@H]2CCCN2c2cc(Cl)ccc2[N+](=O)[O-])o1 ZINC000376459392 941048381 /nfs/dbraw/zinc/04/83/81/941048381.db2.gz FNWRDMWMZSWPSO-HNNXBMFYSA-N 0 0 363.801 3.819 20 5 FHBDRN CC(C)(NC(=O)Cc1coc(-c2cccs2)n1)c1ccc([N+](=O)[O-])cc1 ZINC000176505753 941053549 /nfs/dbraw/zinc/05/35/49/941053549.db2.gz IZKRXBVEEKXQER-UHFFFAOYSA-N 0 0 371.418 3.905 20 5 FHBDRN CCOC1CC2(C1)CCN(C(=O)c1cc([N+](=O)[O-])ccc1SCC)C2 ZINC000376463913 941055736 /nfs/dbraw/zinc/05/57/36/941055736.db2.gz WTYZVUYPVXVDDV-UHFFFAOYSA-N 0 0 364.467 3.738 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)F)cc1N1CCC(F)(c2cccnc2)CC1 ZINC000376463909 941055779 /nfs/dbraw/zinc/05/57/79/941055779.db2.gz WTQMEQXEWJJWDS-UHFFFAOYSA-N 0 0 370.306 3.869 20 5 FHBDRN COC1(C(=O)Nc2nccc3ccc([N+](=O)[O-])cc32)CCC(F)(F)CC1 ZINC000892640774 941059680 /nfs/dbraw/zinc/05/96/80/941059680.db2.gz YQVNWLZUONSTPN-UHFFFAOYSA-N 0 0 365.336 3.676 20 5 FHBDRN Cc1ccc(-c2csc(NC(=O)CC[C@@H]3CCOC3)n2)cc1[N+](=O)[O-] ZINC000176603233 941063519 /nfs/dbraw/zinc/06/35/19/941063519.db2.gz WXPFSFCAOYHUCD-GFCCVEGCSA-N 0 0 361.423 3.782 20 5 FHBDRN Cc1cnc(OCC(=O)N(C)[C@H](C)c2ccc(Cl)cc2)c([N+](=O)[O-])c1 ZINC000176704289 941070356 /nfs/dbraw/zinc/07/03/56/941070356.db2.gz IXXQSSPLEUEGSD-GFCCVEGCSA-N 0 0 363.801 3.550 20 5 FHBDRN C[C@@H](NC(=O)c1c(N)cccc1[N+](=O)[O-])c1nc(-c2ccccc2)cs1 ZINC000180762812 941072494 /nfs/dbraw/zinc/07/24/94/941072494.db2.gz DLRVZFFTWWSYIO-LLVKDONJSA-N 0 0 368.418 3.792 20 5 FHBDRN Cc1ccc(C(C)(C)C(=O)OCC(=O)Nc2c(C)cccc2[N+](=O)[O-])cc1 ZINC000728666524 941076374 /nfs/dbraw/zinc/07/63/74/941076374.db2.gz SDNCYYXIXGDYTC-UHFFFAOYSA-N 0 0 370.405 3.671 20 5 FHBDRN C[C@@H](NC(=O)c1c(N)cccc1[N+](=O)[O-])c1cccc(Cl)c1Cl ZINC000180792637 941077020 /nfs/dbraw/zinc/07/70/20/941077020.db2.gz QUXXUAMWTYNLQJ-MRVPVSSYSA-N 0 0 354.193 3.975 20 5 FHBDRN CC(=O)Nc1ccc(C)c(C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1 ZINC000188748473 941078383 /nfs/dbraw/zinc/07/83/83/941078383.db2.gz XQZZBOLAWPPMAI-UHFFFAOYSA-N 0 0 369.421 3.912 20 5 FHBDRN CO[C@@H]1CC[C@H]2OCCN(Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)[C@@H]2C1 ZINC000180813645 941080638 /nfs/dbraw/zinc/08/06/38/941080638.db2.gz OQDPGHFAPPXYBZ-YVWKXTFCSA-N 0 0 372.421 3.623 20 5 FHBDRN Nc1cccc([N+](=O)[O-])c1C(=O)N1CCc2cc(Cl)cc(Cl)c2C1 ZINC000180852198 941083541 /nfs/dbraw/zinc/08/35/41/941083541.db2.gz SIAYOGQEQITSFW-UHFFFAOYSA-N 0 0 366.204 3.682 20 5 FHBDRN CCC(CC)[C@@H]1C[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2Cl)CCO1 ZINC000180842161 941084633 /nfs/dbraw/zinc/08/46/33/941084633.db2.gz XAUPYGVQJWZKNC-WBMJQRKESA-N 0 0 354.834 3.962 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)NC(C)(C)c1ccc(F)c(F)c1 ZINC000176903710 941085149 /nfs/dbraw/zinc/08/51/49/941085149.db2.gz CDTSWVLJXVCDDQ-UHFFFAOYSA-N 0 0 350.321 3.547 20 5 FHBDRN Cc1nc(-c2cccc(NC(=O)c3c(N)cccc3[N+](=O)[O-])c2)cs1 ZINC000180888653 941088494 /nfs/dbraw/zinc/08/84/94/941088494.db2.gz YEPPGAANSWDILS-UHFFFAOYSA-N 0 0 354.391 3.861 20 5 FHBDRN CCn1c(NC(=O)c2ccc([N+](=O)[O-])c(OC)c2)nc2cc(Cl)ccc21 ZINC000180906444 941089974 /nfs/dbraw/zinc/08/99/74/941089974.db2.gz ISCVAXLDAXLIJU-UHFFFAOYSA-N 0 0 374.784 3.879 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])o1)N1CCCCc2cc(Br)ccc21 ZINC000180931586 941093610 /nfs/dbraw/zinc/09/36/10/941093610.db2.gz IRJZUOYPPZHPEC-UHFFFAOYSA-N 0 0 365.183 3.933 20 5 FHBDRN C[C@@H]1CC[C@@]2(CCN(C(=O)c3ccc(N4CCCC4)c([N+](=O)[O-])c3)C2)C1 ZINC000541009853 941100370 /nfs/dbraw/zinc/10/03/70/941100370.db2.gz TZXFVOOSXMTNNV-FOIQADDNSA-N 0 0 357.454 3.847 20 5 FHBDRN O=C(Nc1cnc2c(c1)CCCC2)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000782839331 941103073 /nfs/dbraw/zinc/10/30/73/941103073.db2.gz KPYYVKGOCRXZRG-UHFFFAOYSA-N 0 0 366.421 3.721 20 5 FHBDRN C[C@H](Cc1ccccc1C(F)(F)F)NC(=O)c1ccccc1[N+](=O)[O-] ZINC000181203675 941110788 /nfs/dbraw/zinc/11/07/88/941110788.db2.gz CXALQWHNHQCICI-LLVKDONJSA-N 0 0 352.312 3.975 20 5 FHBDRN CC[C@@H](C)Oc1cc(C)ccc1CNC(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000181183487 941112401 /nfs/dbraw/zinc/11/24/01/941112401.db2.gz CZCWSZICGVTHCO-CYBMUJFWSA-N 0 0 357.410 3.593 20 5 FHBDRN CCOc1cc(C(=O)N[C@@H]2CCCC[C@@H]2C(C)C)c([N+](=O)[O-])cc1OC ZINC000103056304 941115089 /nfs/dbraw/zinc/11/50/89/941115089.db2.gz RRSUDIDXNPFEQT-UKRRQHHQSA-N 0 0 364.442 3.947 20 5 FHBDRN O=C(Nc1cccc(CC(F)(F)F)c1)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000181279359 941119525 /nfs/dbraw/zinc/11/95/25/941119525.db2.gz BBIKAIIWBFVQNG-UHFFFAOYSA-N 0 0 368.267 3.681 20 5 FHBDRN CSc1cccc(C(=O)Nc2ccc(-c3ncc[nH]3)cc2)c1[N+](=O)[O-] ZINC000188848626 941119600 /nfs/dbraw/zinc/11/96/00/941119600.db2.gz DLEUAHVOWOTDFT-UHFFFAOYSA-N 0 0 354.391 3.959 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN1c2ccccc2SC[C@H]1C ZINC000177389244 941120374 /nfs/dbraw/zinc/12/03/74/941120374.db2.gz COFVIOJHEDZBEA-GFCCVEGCSA-N 0 0 373.434 3.543 20 5 FHBDRN Nc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(-n2ncc3ccccc32)cc1 ZINC000181315029 941121244 /nfs/dbraw/zinc/12/12/44/941121244.db2.gz RSLMHAJAYBZNDJ-UHFFFAOYSA-N 0 0 373.372 3.768 20 5 FHBDRN O=C(Nc1cccc(Cl)c1)c1cc([N+](=O)[O-])ccc1SCCO ZINC000136034296 941123375 /nfs/dbraw/zinc/12/33/75/941123375.db2.gz VXPRPQXJKQZWHZ-UHFFFAOYSA-N 0 0 352.799 3.585 20 5 FHBDRN CCOCCCC(=O)Nc1ccc(OCc2ccccc2)cc1[N+](=O)[O-] ZINC000188964038 941134572 /nfs/dbraw/zinc/13/45/72/941134572.db2.gz PKBVVWAAWLLJQQ-UHFFFAOYSA-N 0 0 358.394 3.929 20 5 FHBDRN CC(C)OCCC(=O)Nc1ccc(OCc2ccccc2)cc1[N+](=O)[O-] ZINC000188980336 941137939 /nfs/dbraw/zinc/13/79/39/941137939.db2.gz JVIUXIMPVSUQAW-UHFFFAOYSA-N 0 0 358.394 3.927 20 5 FHBDRN CCN(Cc1ccccn1)C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000177656885 941144222 /nfs/dbraw/zinc/14/42/22/941144222.db2.gz MOGWZMHMOIQVHF-UHFFFAOYSA-N 0 0 368.418 3.776 20 5 FHBDRN CCSc1cc(CNC(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)ccn1 ZINC000189096775 941145459 /nfs/dbraw/zinc/14/54/59/941145459.db2.gz CVZMYWBYIKDLJR-NSHDSACASA-N 0 0 363.414 3.661 20 5 FHBDRN COCCCOc1ccc(C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000177728362 941147299 /nfs/dbraw/zinc/14/72/99/941147299.db2.gz QSGPRKUAEQDVCL-HNNXBMFYSA-N 0 0 372.421 3.810 20 5 FHBDRN Cc1nc(CC(C)C)oc1C(=O)Nc1ccc([N+](=O)[O-])c2ncccc12 ZINC000189202172 941154011 /nfs/dbraw/zinc/15/40/11/941154011.db2.gz VHSMYEHQNJALAJ-UHFFFAOYSA-N 0 0 354.366 3.890 20 5 FHBDRN O=C(N[C@H]1CCOc2c(F)cccc21)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000189266264 941154441 /nfs/dbraw/zinc/15/44/41/941154441.db2.gz MNBGHUKCCMBYIR-HNNXBMFYSA-N 0 0 371.368 3.562 20 5 FHBDRN CCc1cnc(NC(=O)c2ccc(Br)c([N+](=O)[O-])c2)s1 ZINC000072504660 941155229 /nfs/dbraw/zinc/15/52/29/941155229.db2.gz HIXPHBXDNSJKEM-UHFFFAOYSA-N 0 0 356.201 3.629 20 5 FHBDRN O=[N+]([O-])c1cccc(F)c1CS(=O)(=O)c1cccc(C(F)(F)F)c1 ZINC000189335020 941156364 /nfs/dbraw/zinc/15/63/64/941156364.db2.gz BNGYHMKWCKHDBA-UHFFFAOYSA-N 0 0 363.288 3.727 20 5 FHBDRN CC(C)CCc1nc(Cn2nc(-c3ccccc3[N+](=O)[O-])oc2=O)cs1 ZINC000563113432 941156390 /nfs/dbraw/zinc/15/63/90/941156390.db2.gz RBPYAQVOLJAFPE-UHFFFAOYSA-N 0 0 374.422 3.505 20 5 FHBDRN CC(F)(F)c1cccc(NC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)c1 ZINC000189390708 941156810 /nfs/dbraw/zinc/15/68/10/941156810.db2.gz RQIBHNWQRDBIPX-UHFFFAOYSA-N 0 0 350.277 3.688 20 5 FHBDRN O=[N+]([O-])c1cc(Cc2ccccc2)ccc1OC[C@@H](O)CC(F)(F)F ZINC000189421029 941157298 /nfs/dbraw/zinc/15/72/98/941157298.db2.gz IGAUQHBUNNNVPJ-AWEZNQCLSA-N 0 0 355.312 3.878 20 5 FHBDRN COC[C@@H](Cc1ccccc1)N(C)C(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000189499834 941159302 /nfs/dbraw/zinc/15/93/02/941159302.db2.gz LTBLTUGOZOZLCV-RHSMWYFYSA-N 0 0 374.412 3.554 20 5 FHBDRN CCOC[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1SC(C)C)C(C)C ZINC000189563282 941161297 /nfs/dbraw/zinc/16/12/97/941161297.db2.gz RCCDQVGOHDIOID-HNNXBMFYSA-N 0 0 354.472 3.886 20 5 FHBDRN COC(=O)Nc1ccc(NC(=S)Nc2ccc([N+](=O)[O-])cc2)cc1F ZINC000782890973 941164880 /nfs/dbraw/zinc/16/48/80/941164880.db2.gz GGHDXKGBOQUYPC-UHFFFAOYSA-N 0 0 364.358 3.721 20 5 FHBDRN Cc1cccc(OCC(=O)Nc2ccccc2OC(F)F)c1[N+](=O)[O-] ZINC000124015003 941212041 /nfs/dbraw/zinc/21/20/41/941212041.db2.gz AKKFKCANVKDDTA-UHFFFAOYSA-N 0 0 352.293 3.522 20 5 FHBDRN O=C(c1ccc(F)cc1C(F)(F)F)N1CCc2c1cccc2[N+](=O)[O-] ZINC000178270426 941215285 /nfs/dbraw/zinc/21/52/85/941215285.db2.gz CCJPKIGWZSJERM-UHFFFAOYSA-N 0 0 354.259 3.956 20 5 FHBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])N1C[C@H]2CCCC[C@@H]2C1 ZINC000178367588 941237199 /nfs/dbraw/zinc/23/71/99/941237199.db2.gz OTGTXWJDRBGIDH-CHWSQXEVSA-N 0 0 352.818 3.666 20 5 FHBDRN Cc1c(C(=O)N2C[C@]3(C[C@@H]4CC[C@H]3C4)OC(C)(C)C2)cccc1[N+](=O)[O-] ZINC000407973982 941252143 /nfs/dbraw/zinc/25/21/43/941252143.db2.gz RXGKADQKLLZAKQ-SIFCLUCFSA-N 0 0 358.438 3.713 20 5 FHBDRN CO[C@H](CNC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)c1ccccc1 ZINC000178469890 941262835 /nfs/dbraw/zinc/26/28/35/941262835.db2.gz UPTIAKUJRISPAM-OAHLLOKOSA-N 0 0 368.311 3.731 20 5 FHBDRN CCOC(=O)c1ccnc(N(CC)Cc2c[nH]c3ccccc23)c1[N+](=O)[O-] ZINC000189875807 941292794 /nfs/dbraw/zinc/29/27/94/941292794.db2.gz KFHWARWENVJMNH-UHFFFAOYSA-N 0 0 368.393 3.674 20 5 FHBDRN COC[C@@H](C)n1ccc(NCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)n1 ZINC000189884542 941293592 /nfs/dbraw/zinc/29/35/92/941293592.db2.gz LESVTWDINUBZRL-CYBMUJFWSA-N 0 0 356.382 3.871 20 5 FHBDRN O=C([C@H]1C[C@@]12CCc1ccccc12)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000178677338 941294536 /nfs/dbraw/zinc/29/45/36/941294536.db2.gz QKZZYPUNBWAAQU-DENIHFKCSA-N 0 0 362.429 3.990 20 5 FHBDRN CCCOC1(CNc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)CCCCC1 ZINC000189907967 941299253 /nfs/dbraw/zinc/29/92/53/941299253.db2.gz JJFFFUICEMSTSB-UHFFFAOYSA-N 0 0 370.471 3.540 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2nc(CN3CCO[C@@H](C4CCC4)C3)cs2)c1 ZINC000414473444 941300883 /nfs/dbraw/zinc/30/08/83/941300883.db2.gz QSOZBMOBFLNPSP-QGZVFWFLSA-N 0 0 359.451 3.719 20 5 FHBDRN CCCOc1ccc(CNC(=O)NCc2ccccc2[N+](=O)[O-])c(C)c1 ZINC000189970478 941317728 /nfs/dbraw/zinc/31/77/28/941317728.db2.gz JJDILFLKOZMEOZ-UHFFFAOYSA-N 0 0 357.410 3.691 20 5 FHBDRN O=C(COc1c(Br)cccc1[N+](=O)[O-])c1ccc(F)cc1F ZINC000178983891 941326828 /nfs/dbraw/zinc/32/68/28/941326828.db2.gz FEVAHMNFJKYPGT-UHFFFAOYSA-N 0 0 372.121 3.897 20 5 FHBDRN C/C=C/c1ccc(OCC(=O)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)c(OC)c1 ZINC000452185224 941366097 /nfs/dbraw/zinc/36/60/97/941366097.db2.gz ZGFSDXQSKVLGQC-NNTXTVRGSA-N 0 0 370.405 3.893 20 5 FHBDRN CCOC(=O)[C@@H](N[C@@H](C)CCc1ccccc1[N+](=O)[O-])c1cccc(O)c1 ZINC000190027755 941368369 /nfs/dbraw/zinc/36/83/69/941368369.db2.gz BOLISHGWVCEDLH-LIRRHRJNSA-N 0 0 372.421 3.516 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N(C)CC1(c2ccccc2)CC1 ZINC000190029829 941371531 /nfs/dbraw/zinc/37/15/31/941371531.db2.gz NWCSTYSUFHVVPQ-UHFFFAOYSA-N 0 0 355.394 3.799 20 5 FHBDRN CC(=O)N1C[C@@H](CCC(=O)Oc2c(C)cccc2[N+](=O)[O-])c2ccccc21 ZINC000376623803 941372688 /nfs/dbraw/zinc/37/26/88/941372688.db2.gz RTCVGMGDVGKRRX-OAHLLOKOSA-N 0 0 368.389 3.739 20 5 FHBDRN COCC[C@H]1CCCCN(C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000376624367 941373173 /nfs/dbraw/zinc/37/31/73/941373173.db2.gz VPGYMGDHHHTCOJ-GFCCVEGCSA-N 0 0 355.822 3.919 20 5 FHBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]2CCC[C@H]21 ZINC000408021172 941392774 /nfs/dbraw/zinc/39/27/74/941392774.db2.gz GLBXLAHGLMERQD-IINYFYTJSA-N 0 0 353.216 3.680 20 5 FHBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CCC[C@@H]21 ZINC000408021175 941392800 /nfs/dbraw/zinc/39/28/00/941392800.db2.gz GLBXLAHGLMERQD-YGRLFVJLSA-N 0 0 353.216 3.680 20 5 FHBDRN CC(=O)c1cccc(-c2nc(CCNc3ccccc3[N+](=O)[O-])no2)c1 ZINC000472647715 941408630 /nfs/dbraw/zinc/40/86/30/941408630.db2.gz DGELLHTXUKELJF-UHFFFAOYSA-N 0 0 352.350 3.502 20 5 FHBDRN C[C@@H](Nc1ccc([N+](=O)[O-])c(OC(F)F)c1)c1nnc2n1CCCCC2 ZINC000376812200 941439862 /nfs/dbraw/zinc/43/98/62/941439862.db2.gz VQBFUFGQGZDLPW-SNVBAGLBSA-N 0 0 367.356 3.687 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@H](C[C@@H]2CCOC2)C1 ZINC000376948886 941474925 /nfs/dbraw/zinc/47/49/25/941474925.db2.gz MPFJRTSXVUEWBK-CEXWTWQISA-N 0 0 374.481 3.829 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N[C@H]1C[C@H](CO)c2ccccc21 ZINC000376956281 941477380 /nfs/dbraw/zinc/47/73/80/941477380.db2.gz FTUSOYCLRZAIMN-CJNGLKHVSA-N 0 0 355.394 3.554 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N[C@@H]1C[C@@H](CO)c2ccccc21 ZINC000376956285 941477388 /nfs/dbraw/zinc/47/73/88/941477388.db2.gz FTUSOYCLRZAIMN-XJKSGUPXSA-N 0 0 355.394 3.554 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1CCC(Nc2ccccc2C)CC1 ZINC000376972741 941478847 /nfs/dbraw/zinc/47/88/47/941478847.db2.gz RWNFKTCFXGVCMW-UHFFFAOYSA-N 0 0 369.421 3.629 20 5 FHBDRN COc1cc(C(=O)N2C[C@@H](c3ccccc3)C(C)(C)C2)ccc1[N+](=O)[O-] ZINC000122317917 941504442 /nfs/dbraw/zinc/50/44/42/941504442.db2.gz HXALQSNOBUEZNU-INIZCTEOSA-N 0 0 354.406 3.869 20 5 FHBDRN CCOc1cc(NC(=O)[C@H]2CCC(=O)c3ccccc32)ccc1[N+](=O)[O-] ZINC000892745226 941506082 /nfs/dbraw/zinc/50/60/82/941506082.db2.gz UDKLOEVYCUCMKQ-HNNXBMFYSA-N 0 0 354.362 3.692 20 5 FHBDRN Cc1cc(SCC(=O)OC(C)(C)C)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000472662035 941512214 /nfs/dbraw/zinc/51/22/14/941512214.db2.gz XYOIWWJQEGMOMD-UHFFFAOYSA-N 0 0 361.423 3.794 20 5 FHBDRN O=C(c1n[nH]c2ccc([N+](=O)[O-])cc21)N1CCC[C@@H](c2ccccc2)CC1 ZINC000066763922 941515330 /nfs/dbraw/zinc/51/53/30/941515330.db2.gz RMLYHQRYVNCBSW-OAHLLOKOSA-N 0 0 364.405 3.881 20 5 FHBDRN O=C(COc1ccccc1[N+](=O)[O-])Nc1ccccc1OC1CCCC1 ZINC000046664809 941517750 /nfs/dbraw/zinc/51/77/50/941517750.db2.gz NPOBVRIXTGWSRA-UHFFFAOYSA-N 0 0 356.378 3.934 20 5 FHBDRN CN(CCOc1cccc(Cl)c1)C(=S)Nc1ccc([N+](=O)[O-])cc1 ZINC000008109491 941529422 /nfs/dbraw/zinc/52/94/22/941529422.db2.gz XBUUFYVFQZFYIO-UHFFFAOYSA-N 0 0 365.842 3.956 20 5 FHBDRN C[C@@H](N[C@@H](C)c1cccc(O)c1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000181534885 941530759 /nfs/dbraw/zinc/53/07/59/941530759.db2.gz SEVMWRIXGMCKFW-NWDGAFQWSA-N 0 0 354.366 3.762 20 5 FHBDRN COC(=O)c1cc(NC(=O)c2cc(F)ccc2Cl)c(C)c([N+](=O)[O-])c1 ZINC000431838951 941531097 /nfs/dbraw/zinc/53/10/97/941531097.db2.gz AMTWICDWHDPAEJ-UHFFFAOYSA-N 0 0 366.732 3.735 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CC[C@@H](c2ccccc2F)C1 ZINC000412056407 941566026 /nfs/dbraw/zinc/56/60/26/941566026.db2.gz OHRSWDVJMAHAFG-FHLIZLRMSA-N 0 0 354.381 3.854 20 5 FHBDRN COc1ccc(NC(=O)N[C@H](C)[C@@H]2Oc3ccccc3[C@H]2C)cc1[N+](=O)[O-] ZINC000541106894 941582853 /nfs/dbraw/zinc/58/28/53/941582853.db2.gz WMAFJHZPIDRAQS-SEDUGSJDSA-N 0 0 371.393 3.678 20 5 FHBDRN Cc1ccc(-c2nnc(N(C)CCc3cccc([N+](=O)[O-])c3)n2C)cc1F ZINC000565273067 941588884 /nfs/dbraw/zinc/58/88/84/941588884.db2.gz QBMOIWMKDMXWDQ-UHFFFAOYSA-N 0 0 369.400 3.517 20 5 FHBDRN COc1ccc(-c2nnc(S/C=C/c3ccc([N+](=O)[O-])o3)n2C)cc1 ZINC000066777224 941591592 /nfs/dbraw/zinc/59/15/92/941591592.db2.gz KYYDKHXDGQORIZ-MDZDMXLPSA-N 0 0 358.379 3.755 20 5 FHBDRN COc1ccc(NC(=O)N[C@H](C)[C@@H]2Oc3ccccc3[C@@H]2C)cc1[N+](=O)[O-] ZINC000541106897 941596779 /nfs/dbraw/zinc/59/67/79/941596779.db2.gz WMAFJHZPIDRAQS-VNBZBWLYSA-N 0 0 371.393 3.678 20 5 FHBDRN CC(C)c1ccc(C2(CNC(=O)c3c[nH]nc3[N+](=O)[O-])CCCC2)cc1 ZINC000549181679 941601526 /nfs/dbraw/zinc/60/15/26/941601526.db2.gz SZKIPJUXBIDDFX-UHFFFAOYSA-N 0 0 356.426 3.683 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NCc2ccccc2OC(C)C)c1 ZINC000549199101 941635005 /nfs/dbraw/zinc/63/50/05/941635005.db2.gz XPGMOLKIKVHJOG-UHFFFAOYSA-N 0 0 358.394 3.711 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)NCCc1cc2ccccc2[nH]1 ZINC000511521868 941661262 /nfs/dbraw/zinc/66/12/62/941661262.db2.gz PUQSGCSKWVVQTJ-UHFFFAOYSA-N 0 0 366.421 3.503 20 5 FHBDRN C[C@@H]1C[C@@H](c2ccc(C(F)(F)F)cc2)N(C(=O)c2c[nH]nc2[N+](=O)[O-])C1 ZINC000549223304 941675353 /nfs/dbraw/zinc/67/53/53/941675353.db2.gz IFSAQFFJTWYZOE-RNCFNFMXSA-N 0 0 368.315 3.560 20 5 FHBDRN CC(=O)c1cc([N+](=O)[O-])ccc1N1CCC(Cn2nc(C)cc2C)CC1 ZINC000377390090 941687999 /nfs/dbraw/zinc/68/79/99/941687999.db2.gz GLSCXIOGBPRYRO-UHFFFAOYSA-N 0 0 356.426 3.527 20 5 FHBDRN C/C(=C/c1cccc(Cl)c1)C(=O)OCC(=O)Nc1cccc([N+](=O)[O-])c1 ZINC001125859109 941689184 /nfs/dbraw/zinc/68/91/84/941689184.db2.gz LJDBVOXBUCKNTH-WQLSENKSSA-N 0 0 374.780 3.833 20 5 FHBDRN C[C@H](OC(=O)COc1cccc2cccnc21)c1cccc([N+](=O)[O-])c1 ZINC000729245743 941700902 /nfs/dbraw/zinc/70/09/02/941700902.db2.gz GYUUOSQTFSGXFN-ZDUSSCGKSA-N 0 0 352.346 3.826 20 5 FHBDRN O=C(C1CCCC1)N1CCCC[C@H]1c1nc(-c2ccccc2[N+](=O)[O-])no1 ZINC000377423043 941710071 /nfs/dbraw/zinc/71/00/71/941710071.db2.gz HDYHXUIIKINKFX-INIZCTEOSA-N 0 0 370.409 3.889 20 5 FHBDRN C[C@@H](Oc1c(Cl)nccc1[N+](=O)[O-])c1cccc(Br)n1 ZINC001225432133 941714183 /nfs/dbraw/zinc/71/41/83/941714183.db2.gz YQNKJFVYXFSHMF-SSDOTTSWSA-N 0 0 358.579 3.941 20 5 FHBDRN Cc1cc(C(=O)N2CCCC[C@H]2c2nnc(C3CCC3)o2)cc([N+](=O)[O-])c1 ZINC000377438903 941723624 /nfs/dbraw/zinc/72/36/24/941723624.db2.gz WVRBCGUPHMIJDW-INIZCTEOSA-N 0 0 370.409 3.921 20 5 FHBDRN Cc1ccccc1[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2F)[C@@H](C)CO1 ZINC000174421317 941724681 /nfs/dbraw/zinc/72/46/81/941724681.db2.gz JLMBCUHXVYSOII-SCLBCKFNSA-N 0 0 358.369 3.645 20 5 FHBDRN C[C@H](NC(=O)c1c(Cl)cccc1[N+](=O)[O-])c1nccn1-c1ccccc1 ZINC000377447918 941730758 /nfs/dbraw/zinc/73/07/58/941730758.db2.gz UGHNXXXFZYOTPS-LBPRGKRZSA-N 0 0 370.796 3.925 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(Br)cc2F)c1 ZINC000067296271 941735299 /nfs/dbraw/zinc/73/52/99/941735299.db2.gz SZQIWMPFGPQSOJ-UHFFFAOYSA-N 0 0 369.146 3.757 20 5 FHBDRN CC1(C)C[C@@H](NC(=O)CCOc2ccccc2[N+](=O)[O-])c2ccccc21 ZINC000431842624 941741463 /nfs/dbraw/zinc/74/14/63/941741463.db2.gz ICQKPWMRLSLWEX-MRXNPFEDSA-N 0 0 354.406 3.903 20 5 FHBDRN CC1(C)C[C@H](NC(=O)CCOc2ccccc2[N+](=O)[O-])c2ccccc21 ZINC000431842622 941741623 /nfs/dbraw/zinc/74/16/23/941741623.db2.gz ICQKPWMRLSLWEX-INIZCTEOSA-N 0 0 354.406 3.903 20 5 FHBDRN O=C(Cn1ncc2ccc([N+](=O)[O-])cc21)N[C@H](c1ccccc1)C1CCC1 ZINC000729379073 941742259 /nfs/dbraw/zinc/74/22/59/941742259.db2.gz NOKHBLLAMOIOGK-HXUWFJFHSA-N 0 0 364.405 3.602 20 5 FHBDRN C[C@H](Nc1ccc(C(=O)NC2CCCC2)cc1[N+](=O)[O-])c1ccccn1 ZINC000052933960 941743256 /nfs/dbraw/zinc/74/32/56/941743256.db2.gz RNVRTSMTCSLLPG-ZDUSSCGKSA-N 0 0 354.410 3.835 20 5 FHBDRN O=C(NCC1CCC(F)CC1)c1cc([N+](=O)[O-])ccc1Br ZINC000843726432 941748749 /nfs/dbraw/zinc/74/87/49/941748749.db2.gz HNZYAZWOXWLQBV-UHFFFAOYSA-N 0 0 359.195 3.615 20 5 FHBDRN Cc1cc(Cl)cc2cc(-c3noc(CCn4cc([N+](=O)[O-])cn4)n3)oc21 ZINC000445859447 941753545 /nfs/dbraw/zinc/75/35/45/941753545.db2.gz NLXAHXJZTAWHJD-UHFFFAOYSA-N 0 0 373.756 3.792 20 5 FHBDRN O=C(N[C@@H]1COc2cccc(Cl)c21)c1c(Cl)cccc1[N+](=O)[O-] ZINC000377479566 941759349 /nfs/dbraw/zinc/75/93/49/941759349.db2.gz VGTASODLMJILPI-SNVBAGLBSA-N 0 0 353.161 3.765 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1OCCCOCC(F)(F)F ZINC000151144102 941760133 /nfs/dbraw/zinc/76/01/33/941760133.db2.gz RIXVPCUCBZVIAU-UHFFFAOYSA-N 0 0 358.110 3.705 20 5 FHBDRN O=C(NCc1nc(-c2ccccc2)c[nH]1)c1ccc([N+](=O)[O-])cc1Cl ZINC000120663290 941761629 /nfs/dbraw/zinc/76/16/29/941761629.db2.gz OLDLDWCOJIUQBW-UHFFFAOYSA-N 0 0 356.769 3.568 20 5 FHBDRN O=C(NCC1CCC(F)CC1)c1cccc([N+](=O)[O-])c1Br ZINC000843726052 941761685 /nfs/dbraw/zinc/76/16/85/941761685.db2.gz BXQPYJBYLCQROK-UHFFFAOYSA-N 0 0 359.195 3.615 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N(C)[C@@H](C)c1ccc(F)c(F)c1 ZINC000073446840 941762012 /nfs/dbraw/zinc/76/20/12/941762012.db2.gz XNRVPISXFGRHEE-JTQLQIEISA-N 0 0 350.321 3.715 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N2C[C@H](c3ccccc3)C[C@@H]2C)c1F ZINC000412105846 941764105 /nfs/dbraw/zinc/76/41/05/941764105.db2.gz ASWVGPJQKIPMLH-DZGCQCFKSA-N 0 0 372.396 3.690 20 5 FHBDRN O=C(Cc1noc2ccc(F)cc21)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000415362893 941776544 /nfs/dbraw/zinc/77/65/44/941776544.db2.gz QVMUVIKGAHHYKE-UHFFFAOYSA-N 0 0 369.352 3.609 20 5 FHBDRN Cc1cc(NC(=O)NCC2(CO)CC(c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000433590988 941779402 /nfs/dbraw/zinc/77/94/02/941779402.db2.gz MNRWWNYJLIONTL-UHFFFAOYSA-N 0 0 369.421 3.581 20 5 FHBDRN CCOC(=O)CC1(NC(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)CCCC1 ZINC000433598859 941784429 /nfs/dbraw/zinc/78/44/29/941784429.db2.gz IMFPPDBAQWIBHK-UHFFFAOYSA-N 0 0 363.414 3.599 20 5 FHBDRN CCS(=O)(=O)c1ccc(CSCc2cccc([N+](=O)[O-])c2)cc1 ZINC000419394213 941786505 /nfs/dbraw/zinc/78/65/05/941786505.db2.gz OQOXTYBAVSXQCE-UHFFFAOYSA-N 0 0 351.449 3.822 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1F)N[C@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000122547964 941790974 /nfs/dbraw/zinc/79/09/74/941790974.db2.gz PGUJDTYFWPFCFM-IFXJQAMLSA-N 0 0 372.396 3.561 20 5 FHBDRN COc1cccc(C2(NC(=O)CSc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000122544949 941791503 /nfs/dbraw/zinc/79/15/03/941791503.db2.gz YJSWTQJXGLMSIB-UHFFFAOYSA-N 0 0 358.419 3.501 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1cnn(C)c1Cl ZINC000892959162 941806544 /nfs/dbraw/zinc/80/65/44/941806544.db2.gz BUBBYTLMRJGSEW-UHFFFAOYSA-N 0 0 354.819 3.736 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N[C@@H](c2ccccc2)C(C)C)c1F ZINC000412127380 941807514 /nfs/dbraw/zinc/80/75/14/941807514.db2.gz FWXCGGWUABKOPB-LJQANCHMSA-N 0 0 360.385 3.799 20 5 FHBDRN COc1ccc(CCCNc2ccc3cc([N+](=O)[O-])ccc3n2)cc1OC ZINC000513238273 941809956 /nfs/dbraw/zinc/80/99/56/941809956.db2.gz KTSJEPBPENHJGF-UHFFFAOYSA-N 0 0 367.405 3.627 20 5 FHBDRN CN(C[C@@H]1CCC[C@H]1O)C(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 ZINC000129332286 941816673 /nfs/dbraw/zinc/81/66/73/941816673.db2.gz CVDKRCAXAXULDA-KBXCAEBGSA-N 0 0 370.405 3.620 20 5 FHBDRN CC1CCC(OC2CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)CC1 ZINC000377581637 941822976 /nfs/dbraw/zinc/82/29/76/941822976.db2.gz KRBVMDRXWDZQQZ-UHFFFAOYSA-N 0 0 364.417 3.934 20 5 FHBDRN C[C@@H]1[C@H](Cc2ccccc2)CCN1C(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000583835683 941834603 /nfs/dbraw/zinc/83/46/03/941834603.db2.gz PPMOVHJXQPUKTL-HIFRSBDPSA-N 0 0 374.387 3.895 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N[C@H]1CCOc2c(F)cccc21 ZINC000190078260 941836195 /nfs/dbraw/zinc/83/61/95/941836195.db2.gz UOWDCSGTJNJIHE-AWEZNQCLSA-N 0 0 359.357 3.996 20 5 FHBDRN Cc1c(NC(=O)CNc2ccccc2[N+](=O)[O-])cccc1C(F)(F)F ZINC000472813449 941846809 /nfs/dbraw/zinc/84/68/09/941846809.db2.gz UKILFQHFDCAXHO-UHFFFAOYSA-N 0 0 353.300 3.973 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N[C@H]1CCCc2cc(N)ccc21 ZINC000415479770 941848998 /nfs/dbraw/zinc/84/89/98/941848998.db2.gz GOFFPZICSXSZCT-INIZCTEOSA-N 0 0 354.410 3.993 20 5 FHBDRN CC(C)CN(CCc1ccccc1)C(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-] ZINC000433703870 941849647 /nfs/dbraw/zinc/84/96/47/941849647.db2.gz PXZXGNCIQDLABC-UHFFFAOYSA-N 0 0 358.442 3.782 20 5 FHBDRN Cc1oc(C(C)C)nc1C(=O)NCCCNc1ccc(C)cc1[N+](=O)[O-] ZINC000513316557 941851352 /nfs/dbraw/zinc/85/13/52/941851352.db2.gz FSXBLACHEFPNLM-UHFFFAOYSA-N 0 0 360.414 3.555 20 5 FHBDRN CC[C@@H](CNC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)Oc1ccccc1F ZINC000412153647 941852594 /nfs/dbraw/zinc/85/25/94/941852594.db2.gz BQWCJARLWLVSOY-YESZJQIVSA-N 0 0 372.396 3.811 20 5 FHBDRN C[C@@H](CC(=O)c1ccccc1F)C(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000513337436 941852802 /nfs/dbraw/zinc/85/28/02/941852802.db2.gz BARDTGHHLKFKJG-AWEZNQCLSA-N 0 0 372.396 3.644 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)NC[C@H](c1ccccc1)C1CC1 ZINC000431846687 941853560 /nfs/dbraw/zinc/85/35/60/941853560.db2.gz TTWVQFMMKIQMIC-LJQANCHMSA-N 0 0 353.422 3.630 20 5 FHBDRN O=C1[C@H](Nc2ccccc2C(F)(F)F)CCN1c1cccc([N+](=O)[O-])c1 ZINC000433726806 941857646 /nfs/dbraw/zinc/85/76/46/941857646.db2.gz KKGDXYIIPIQRCE-OAHLLOKOSA-N 0 0 365.311 3.831 20 5 FHBDRN O=C(Nc1ccc(OCC(F)F)cc1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412173119 941862502 /nfs/dbraw/zinc/86/25/02/941862502.db2.gz VJEVQOUQRABPNW-JKSUJKDBSA-N 0 0 362.332 3.981 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)CCn1ccc2ccccc21 ZINC000513353730 941863678 /nfs/dbraw/zinc/86/36/78/941863678.db2.gz MIOWFYDZNIZHPT-UHFFFAOYSA-N 0 0 351.406 3.641 20 5 FHBDRN CCO[C@H](CCNC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)C1CCCC1 ZINC000412176204 941864235 /nfs/dbraw/zinc/86/42/35/941864235.db2.gz YCYAQEGYOPFYNL-IPMKNSEASA-N 0 0 360.454 3.800 20 5 FHBDRN CCO[C@@H](CCNC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)C1CCCC1 ZINC000412176207 941864306 /nfs/dbraw/zinc/86/43/06/941864306.db2.gz YCYAQEGYOPFYNL-OTWHNJEPSA-N 0 0 360.454 3.800 20 5 FHBDRN CCOc1cc(CN2CCCN(c3ccccc3F)CC2)ccc1[N+](=O)[O-] ZINC000513360590 941869010 /nfs/dbraw/zinc/86/90/10/941869010.db2.gz CMUAPUPPMBYEBP-UHFFFAOYSA-N 0 0 373.428 3.845 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@]2(C)CCCc3ccccc32)c1 ZINC000549293509 941869727 /nfs/dbraw/zinc/86/97/27/941869727.db2.gz AXQKGMMBYLJGCW-HXUWFJFHSA-N 0 0 354.406 3.975 20 5 FHBDRN C[C@@H]([C@@H]1Cc2ccccc2O1)N(C)C(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000119216255 941870682 /nfs/dbraw/zinc/87/06/82/941870682.db2.gz BZMAMSRRSXFPDO-BUXKBTBVSA-N 0 0 365.389 3.540 20 5 FHBDRN C[C@H](NC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1)c1cnn(C)c1 ZINC000119268025 941875394 /nfs/dbraw/zinc/87/53/94/941875394.db2.gz RTAICKSZOBBSIU-ZDUSSCGKSA-N 0 0 365.393 3.563 20 5 FHBDRN Cc1ccc(C[C@@H]2CCCN2C(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])cc1 ZINC000433768674 941875687 /nfs/dbraw/zinc/87/56/87/941875687.db2.gz LDXVYJFPVGMGDO-HNNXBMFYSA-N 0 0 356.426 3.597 20 5 FHBDRN CC(C)Oc1cc(C(=O)N[C@H](C)CNc2ccccc2)ccc1[N+](=O)[O-] ZINC000412184750 941883566 /nfs/dbraw/zinc/88/35/66/941883566.db2.gz OPZNOIVHDVHWRB-CQSZACIVSA-N 0 0 357.410 3.612 20 5 FHBDRN O=C(C[C@@H]1COCCN1Cc1c(Cl)cccc1[N+](=O)[O-])c1ccccc1 ZINC000119548219 941887323 /nfs/dbraw/zinc/88/73/23/941887323.db2.gz WOBBLAZZOJDSLH-OAHLLOKOSA-N 0 0 374.824 3.722 20 5 FHBDRN CCCOc1cccc(CCNC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)c1 ZINC000412191646 941890843 /nfs/dbraw/zinc/89/08/43/941890843.db2.gz AUHWAACEGJDVIY-VQTJNVASSA-N 0 0 368.433 3.846 20 5 FHBDRN O=[N+]([O-])c1cnc(SCc2ccc3c(c2)OCO3)c(Br)c1 ZINC000480785255 941892990 /nfs/dbraw/zinc/89/29/90/941892990.db2.gz KKIZNYBCCDVBSB-UHFFFAOYSA-N 0 0 369.196 3.773 20 5 FHBDRN C[C@H](CNc1nc(NC[C@H](C)C(F)(F)F)ccc1[N+](=O)[O-])C(F)(F)F ZINC000433786488 941895468 /nfs/dbraw/zinc/89/54/68/941895468.db2.gz XPOPWNHPHRFLSB-JGVFFNPUSA-N 0 0 374.285 3.632 20 5 FHBDRN CO[C@@H]1CC[C@H](NC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)C1 ZINC000472833264 941897526 /nfs/dbraw/zinc/89/75/26/941897526.db2.gz NDTCZZZJLGYPNE-DLBZAZTESA-N 0 0 369.421 3.504 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N(CC(C)C)C2CCCC2)c1F ZINC000412196179 941898033 /nfs/dbraw/zinc/89/80/33/941898033.db2.gz SYFIKIFEGZKYQB-UHFFFAOYSA-N 0 0 352.406 3.712 20 5 FHBDRN O=C([C@H]1C[C@]1(F)c1ccccc1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000412201855 941904757 /nfs/dbraw/zinc/90/47/57/941904757.db2.gz KDGAKOUNZYDPOE-XLIONFOSSA-N 0 0 354.381 3.971 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CC3(CCC3)c3cc(Br)ccc32)nc1 ZINC000433823297 941920182 /nfs/dbraw/zinc/92/01/82/941920182.db2.gz WGIASTVMFZHFER-UHFFFAOYSA-N 0 0 361.199 3.721 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N1Cc2ccccc2C(C)(C)C1 ZINC000536250715 941924450 /nfs/dbraw/zinc/92/44/50/941924450.db2.gz XGNQDGDNBOEIRF-UHFFFAOYSA-N 0 0 355.394 3.929 20 5 FHBDRN O=C(Nc1c2c(ccc1Cl)OCC2)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000415588398 941926092 /nfs/dbraw/zinc/92/60/92/941926092.db2.gz DMBLRNUDSWHECT-UONOGXRCSA-N 0 0 358.781 3.925 20 5 FHBDRN Cc1c(C(=O)N[C@H]2CCO[C@H]2c2ccc(Cl)cc2)cccc1[N+](=O)[O-] ZINC000182460972 941927081 /nfs/dbraw/zinc/92/70/81/941927081.db2.gz QQMABALSXXMTOF-RDJZCZTQSA-N 0 0 360.797 3.817 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)NCCc2ccc(C(C)(C)C)cc2)c1[N+](=O)[O-] ZINC000433831376 941928154 /nfs/dbraw/zinc/92/81/54/941928154.db2.gz MMELSGVHRFTFRN-UHFFFAOYSA-N 0 0 358.442 3.711 20 5 FHBDRN O=C(c1ccc(Cl)cc1[N+](=O)[O-])N1CC(OCCCc2ccccc2)C1 ZINC000480799491 941931391 /nfs/dbraw/zinc/93/13/91/941931391.db2.gz BGPLUQDFTGDEKY-UHFFFAOYSA-N 0 0 374.824 3.722 20 5 FHBDRN C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2SCC2CCCC2)CCO1 ZINC000182474129 941933260 /nfs/dbraw/zinc/93/32/60/941933260.db2.gz QKAVVGRFMAKJQN-CYBMUJFWSA-N 0 0 364.467 3.738 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1OC(F)F)N1CCC[C@H]2CCCC[C@H]21 ZINC000182491627 941934380 /nfs/dbraw/zinc/93/43/80/941934380.db2.gz HNLPTRLVUXZPSM-BXUZGUMPSA-N 0 0 354.353 3.991 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CCc3cc(F)ccc3C2)ccc1[N+](=O)[O-] ZINC000412227982 941937060 /nfs/dbraw/zinc/93/70/60/941937060.db2.gz NXRWVNBYUPFSJT-UHFFFAOYSA-N 0 0 358.369 3.720 20 5 FHBDRN CCN(CC(=O)Nc1ccccc1OC)[C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000182606129 941946869 /nfs/dbraw/zinc/94/68/69/941946869.db2.gz DGFGGPYGMWJYCC-HNNXBMFYSA-N 0 0 371.437 3.933 20 5 FHBDRN COc1ccc([C@@H](NC(=O)c2ccc([N+](=O)[O-])s2)C(F)(F)F)cc1 ZINC000182603707 941946929 /nfs/dbraw/zinc/94/69/29/941946929.db2.gz ITIKSNOHDGKZGX-GFCCVEGCSA-N 0 0 360.313 3.698 20 5 FHBDRN COc1ccc([C@@H](NC(=O)c2ccccc2[N+](=O)[O-])C(F)(F)F)cc1 ZINC000182609970 941947188 /nfs/dbraw/zinc/94/71/88/941947188.db2.gz MTIAOXKXLJRWGQ-CQSZACIVSA-N 0 0 354.284 3.637 20 5 FHBDRN CC(C)N(Cc1cccc(Br)c1)C(=O)c1cc([N+](=O)[O-])c[nH]1 ZINC000513459934 941948454 /nfs/dbraw/zinc/94/84/54/941948454.db2.gz KOZHKFDIRRXSNF-UHFFFAOYSA-N 0 0 366.215 3.736 20 5 FHBDRN Cc1cn([C@@H](C)c2ccccc2)[nH]c1=NC(=O)c1ccc([N+](=O)[O-])cc1C ZINC000472851924 941949867 /nfs/dbraw/zinc/94/98/67/941949867.db2.gz OVNHDDPNDLGPEP-HNNXBMFYSA-N 0 0 364.405 3.692 20 5 FHBDRN O=C([C@@H]1C[C@@]1(F)c1ccccc1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000412234779 941950029 /nfs/dbraw/zinc/95/00/29/941950029.db2.gz QGAHXEXCKPKIEN-AZUAARDMSA-N 0 0 354.381 3.971 20 5 FHBDRN CCOc1nccc(C)c1C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000433867937 941955373 /nfs/dbraw/zinc/95/53/73/941955373.db2.gz KPGUADKZVLPYEQ-UHFFFAOYSA-N 0 0 369.299 3.968 20 5 FHBDRN COc1ccc([C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2F)C(F)(F)F)cc1 ZINC000182640874 941957104 /nfs/dbraw/zinc/95/71/04/941957104.db2.gz RPLYMDWKRYYDLP-CQSZACIVSA-N 0 0 372.274 3.776 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N[C@H](C)c2cccc(C(F)(F)F)c2)c1[N+](=O)[O-] ZINC000433869808 941957811 /nfs/dbraw/zinc/95/78/11/941957811.db2.gz UHRZDGVWPRIUEP-SECBINFHSA-N 0 0 370.331 3.951 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)N[C@H](c1c(F)cccc1F)C(F)(F)F ZINC000182772230 941958716 /nfs/dbraw/zinc/95/87/16/941958716.db2.gz KOIZCQVZOOLKIE-OAHLLOKOSA-N 0 0 374.265 3.835 20 5 FHBDRN COc1cc(CS[C@H]2CCO[C@@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000182788346 941967030 /nfs/dbraw/zinc/96/70/30/941967030.db2.gz SDYDRQAZWJKDDW-OTYXRUKQSA-N 0 0 363.382 3.658 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N2C[C@H](C)C[C@H]2c2cccnc2)c1 ZINC000182838969 941978407 /nfs/dbraw/zinc/97/84/07/941978407.db2.gz QXWDNYPAQIDPMD-PXAZEXFGSA-N 0 0 357.435 3.935 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)N1CC[C@H](CC(F)(F)F)C1 ZINC000433918339 941997234 /nfs/dbraw/zinc/99/72/34/941997234.db2.gz JINVCFIYBYTJTC-SECBINFHSA-N 0 0 365.739 3.732 20 5 FHBDRN C[C@@H]1C[C@@H](c2cccnc2)N(C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)C1 ZINC000412261032 941997726 /nfs/dbraw/zinc/99/77/26/941997726.db2.gz VXTCGSPFYJCBAR-MAAHGYRXSA-N 0 0 351.406 3.703 20 5 FHBDRN O=C(Nc1cccc(-c2noc(C3CC3)n2)c1)c1cc(F)cc([N+](=O)[O-])c1 ZINC000433937624 942003862 /nfs/dbraw/zinc/00/38/62/942003862.db2.gz WUMBOWCEXLDGKY-UHFFFAOYSA-N 0 0 368.324 3.914 20 5 FHBDRN C[C@H](NC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F)c1ccc(Cl)cn1 ZINC000549338383 942006894 /nfs/dbraw/zinc/00/68/94/942006894.db2.gz WFUOOSCPKJYEFM-JTQLQIEISA-N 0 0 365.792 3.937 20 5 FHBDRN O=c1oc(-c2cccs2)nn1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000549340111 942007544 /nfs/dbraw/zinc/00/75/44/942007544.db2.gz VEHFLWBVTMWURZ-UHFFFAOYSA-N 0 0 371.296 3.540 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NCCc2c[nH]c3cccc(C)c23)c1 ZINC000549341563 942015248 /nfs/dbraw/zinc/01/52/48/942015248.db2.gz VJRZAAZCZRSZHV-UHFFFAOYSA-N 0 0 367.405 3.756 20 5 FHBDRN CC(C)Oc1cc(C(=O)N[C@H](C)c2ccc(Cl)cn2)ccc1[N+](=O)[O-] ZINC000412270320 942016608 /nfs/dbraw/zinc/01/66/08/942016608.db2.gz OIFARVGVERSEJO-LLVKDONJSA-N 0 0 363.801 3.921 20 5 FHBDRN COc1cc(C(=O)N2CC[C@@](C)(c3ccc(C)cc3)C2)ccc1[N+](=O)[O-] ZINC000433960868 942018853 /nfs/dbraw/zinc/01/88/53/942018853.db2.gz ZGGQTHFXZVRHIU-HXUWFJFHSA-N 0 0 354.406 3.716 20 5 FHBDRN COc1c2ccccc2oc1CNC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412275660 942022499 /nfs/dbraw/zinc/02/24/99/942022499.db2.gz DRUVMSLWJCMRJH-JKSUJKDBSA-N 0 0 366.373 3.770 20 5 FHBDRN COc1ccccc1[C@@H]1C[C@H]1C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000412276536 942022898 /nfs/dbraw/zinc/02/28/98/942022898.db2.gz UMMYTEAUWSJLGC-LSDHHAIUSA-N 0 0 360.797 3.677 20 5 FHBDRN Cc1ccccc1C[C@H]1CCCN1C(=O)COc1cccc([N+](=O)[O-])c1 ZINC000513579944 942023216 /nfs/dbraw/zinc/02/32/16/942023216.db2.gz JREUEFBWLXFWTD-QGZVFWFLSA-N 0 0 354.406 3.516 20 5 FHBDRN O=C(CCOc1cccc(Cl)c1)Nc1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000536252054 942026625 /nfs/dbraw/zinc/02/66/25/942026625.db2.gz CSNBFQYCXATIFN-UHFFFAOYSA-N 0 0 360.757 3.532 20 5 FHBDRN Cc1csc(C(C)(C)NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)n1 ZINC000182961967 942029836 /nfs/dbraw/zinc/02/98/36/942029836.db2.gz ZWEABEOKUUJBMI-UHFFFAOYSA-N 0 0 371.365 3.626 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)Nc1nccn1-c1ccccc1 ZINC000549351155 942030129 /nfs/dbraw/zinc/03/01/29/942030129.db2.gz PZPSAUNWSXMCQW-UHFFFAOYSA-N 0 0 365.393 3.611 20 5 FHBDRN COc1cc(C(=O)N2CCC[C@H]2Cc2ccccc2C)ccc1[N+](=O)[O-] ZINC000513596340 942033216 /nfs/dbraw/zinc/03/32/16/942033216.db2.gz AAQVPVPSIUCMAY-KRWDZBQOSA-N 0 0 354.406 3.759 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)NCCc2c(Cl)cccc2Cl)c1[N+](=O)[O-] ZINC000433994710 942033242 /nfs/dbraw/zinc/03/32/42/942033242.db2.gz ULGPKKQPRPPFCU-UHFFFAOYSA-N 0 0 371.224 3.721 20 5 FHBDRN Cc1nn(C)cc1[C@H]1CCCN1C(=O)Nc1cccc([N+](=O)[O-])c1Cl ZINC000377846669 942033786 /nfs/dbraw/zinc/03/37/86/942033786.db2.gz FDVYHNMBXFCNKW-CYBMUJFWSA-N 0 0 363.805 3.659 20 5 FHBDRN O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCOc2ccc(C(F)(F)F)cc21 ZINC000472885420 942037399 /nfs/dbraw/zinc/03/73/99/942037399.db2.gz UTYZTRDFUZRHOV-UHFFFAOYSA-N 0 0 370.258 3.792 20 5 FHBDRN CC(C)[C@@H](O)C(C)(C)C[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000158999830 942041441 /nfs/dbraw/zinc/04/14/41/942041441.db2.gz HGPNDOCQYLDPDH-MRXNPFEDSA-N 0 0 363.483 3.851 20 5 FHBDRN Cc1nn(CCC(=O)N2CCCCC[C@H]2c2ccccc2)c(C)c1[N+](=O)[O-] ZINC000102234370 942043834 /nfs/dbraw/zinc/04/38/34/942043834.db2.gz IQYCQJTZOCMLDR-SFHVURJKSA-N 0 0 370.453 3.942 20 5 FHBDRN Cc1c([C@H]2CCCN2C(=O)Nc2cccc([N+](=O)[O-])c2Cl)cnn1C ZINC000377872187 942044576 /nfs/dbraw/zinc/04/45/76/942044576.db2.gz CPAOSIMWQINTCV-CYBMUJFWSA-N 0 0 363.805 3.659 20 5 FHBDRN COc1ccc([C@H](C)NC(=O)c2cc(F)cc(C)c2[N+](=O)[O-])c(OC)c1 ZINC000122673995 942044652 /nfs/dbraw/zinc/04/46/52/942044652.db2.gz WCAWPMCPTVHJLQ-NSHDSACASA-N 0 0 362.357 3.551 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])N1CCC(F)(c2ccccc2)CC1 ZINC000434004943 942044752 /nfs/dbraw/zinc/04/47/52/942044752.db2.gz DNGFCQBJRKASNB-UHFFFAOYSA-N 0 0 357.385 3.765 20 5 FHBDRN O=[N+]([O-])c1cc(-c2nc(Cc3ccc(F)cc3)no2)ccc1OC(F)F ZINC000513609327 942045444 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CCN(CCc1ccccc1)C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513653768 942057423 /nfs/dbraw/zinc/05/74/23/942057423.db2.gz TUTVTFJQDIXUDK-UHFFFAOYSA-N 0 0 364.348 3.901 20 5 FHBDRN Cn1ccnc1[C@@H](NCc1ccc(Cl)s1)c1ccc([N+](=O)[O-])cc1 ZINC000513655340 942057841 /nfs/dbraw/zinc/05/78/41/942057841.db2.gz LWHRLSBIDFPYIW-HNNXBMFYSA-N 0 0 362.842 3.922 20 5 FHBDRN CCn1c(-c2ccc([N+](=O)[O-])cc2)nnc1N1CC[C@@]2(CC[C@H](C)C2)C1 ZINC000549367582 942063573 /nfs/dbraw/zinc/06/35/73/942063573.db2.gz BUROUIUUFYKOLS-IFXJQAMLSA-N 0 0 355.442 3.890 20 5 FHBDRN CCCNc1ccc(CNC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)cc1 ZINC000412292420 942072141 /nfs/dbraw/zinc/07/21/41/942072141.db2.gz MNMCEFLNPVDMQZ-RBUKOAKNSA-N 0 0 353.422 3.837 20 5 FHBDRN O=C(NCc1ccco1)c1cccc(COc2ccc(F)cc2[N+](=O)[O-])c1 ZINC000102599442 942072256 /nfs/dbraw/zinc/07/22/56/942072256.db2.gz RZJATBKLESOOBS-UHFFFAOYSA-N 0 0 370.336 3.836 20 5 FHBDRN CN(CCn1cc([N+](=O)[O-])cn1)[C@@H](c1ccc(Cl)cc1)c1ccccn1 ZINC000377931858 942075623 /nfs/dbraw/zinc/07/56/23/942075623.db2.gz LMTAPLBLXPXSFP-SFHVURJKSA-N 0 0 371.828 3.561 20 5 FHBDRN CO[C@H]1CCOc2c(NC(=O)[C@@H]3C[C@H]3c3ccc([N+](=O)[O-])cc3)cccc21 ZINC000412296667 942080081 /nfs/dbraw/zinc/08/00/81/942080081.db2.gz BXYWWBYXLDUYQH-JZXOWHBKSA-N 0 0 368.389 3.807 20 5 FHBDRN O=C(N[C@@H]1C[C@@H]1c1cccc(F)c1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513723564 942084154 /nfs/dbraw/zinc/08/41/54/942084154.db2.gz FSWPOVPSSTXTRI-CHWSQXEVSA-N 0 0 366.295 3.621 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)Nc1scnc1-c1ccccc1 ZINC000102725581 942087932 /nfs/dbraw/zinc/08/79/32/942087932.db2.gz WUZYEQCITDBLPG-UHFFFAOYSA-N 0 0 355.375 3.979 20 5 FHBDRN CC(C)(C)OC(=O)[C@@]1(C)CCN(c2ccc([N+](=O)[O-])c3ncccc23)C1 ZINC000413357369 942091241 /nfs/dbraw/zinc/09/12/41/942091241.db2.gz KUMWBCAISFVMQL-IBGZPJMESA-N 0 0 357.410 3.701 20 5 FHBDRN Cc1nc2cc(C(=O)N(Cc3ccc([N+](=O)[O-])cc3)C3CC3)ccc2o1 ZINC000280032858 942091306 /nfs/dbraw/zinc/09/13/06/942091306.db2.gz LBQQUPDRHWVHSW-UHFFFAOYSA-N 0 0 351.362 3.849 20 5 FHBDRN CC1(C)CN(C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)[C@@H]1[C@@H]1CCCO1 ZINC000290412958 942098525 /nfs/dbraw/zinc/09/85/25/942098525.db2.gz MYHPEIPKNAXDOV-UONOGXRCSA-N 0 0 353.806 3.670 20 5 FHBDRN CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)C(C)(C)C1CCOCC1 ZINC000280072545 942101909 /nfs/dbraw/zinc/10/19/09/942101909.db2.gz USIFVCUEVGDHGI-UHFFFAOYSA-N 0 0 354.834 3.659 20 5 FHBDRN O=C(N[C@H]1C[C@H](c2ccccc2F)C1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412305637 942110503 /nfs/dbraw/zinc/11/05/03/942110503.db2.gz CUIVCUWYVGEPKK-DFEHZGFQSA-N 0 0 354.381 3.900 20 5 FHBDRN CC(C)CN(Cc1cnn(C)c1)c1ccc([N+](=O)[O-])c(OC(F)F)c1 ZINC000413380530 942114136 /nfs/dbraw/zinc/11/41/36/942114136.db2.gz SSZZBUQGESZXDJ-UHFFFAOYSA-N 0 0 354.357 3.592 20 5 FHBDRN COc1cc(Br)ccc1C(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000102832978 942114931 /nfs/dbraw/zinc/11/49/31/942114931.db2.gz AAHREYMEJOYZLN-UHFFFAOYSA-N 0 0 365.183 3.643 20 5 FHBDRN CO[C@]1(C)CCCN(C(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CC1 ZINC000280170801 942122009 /nfs/dbraw/zinc/12/20/09/942122009.db2.gz ZANDRCINMIRKQR-OAHLLOKOSA-N 0 0 360.332 3.645 20 5 FHBDRN CCO[C@H]1C[C@@H](Nc2cc(C(F)(F)C(F)(F)F)ncc2[N+](=O)[O-])C1 ZINC000413382905 942123570 /nfs/dbraw/zinc/12/35/70/942123570.db2.gz ANMWAVSACIYNKL-OCAPTIKFSA-N 0 0 355.263 3.623 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CCC[C@@H]2c2ccc(Br)cn2)s1 ZINC000413383199 942123722 /nfs/dbraw/zinc/12/37/22/942123722.db2.gz XDYJPXOAPGHJTR-SNVBAGLBSA-N 0 0 355.217 3.550 20 5 FHBDRN CSc1ccc(C(=O)N[C@@H]2CCO[C@H](C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000480882887 942133407 /nfs/dbraw/zinc/13/34/07/942133407.db2.gz ONYZKVHSBJFRPN-DOMZBBRYSA-N 0 0 352.456 3.640 20 5 FHBDRN CNc1ccc(C(=O)N[C@@H]2CCSc3ccc(F)cc32)cc1[N+](=O)[O-] ZINC000016110724 942135161 /nfs/dbraw/zinc/13/51/61/942135161.db2.gz XRAGZOUEMMPOFZ-CYBMUJFWSA-N 0 0 361.398 3.743 20 5 FHBDRN COc1cc(C(=O)N[C@@H](C)[C@H](C)c2ccccc2)cc([N+](=O)[O-])c1OC ZINC000473541655 942135250 /nfs/dbraw/zinc/13/52/50/942135250.db2.gz PQQDNORRNXHZDY-STQMWFEESA-N 0 0 358.394 3.534 20 5 FHBDRN CC(C)(C)CCNC(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000514498747 942140459 /nfs/dbraw/zinc/14/04/59/942140459.db2.gz KHVCCRRMUIWSBV-UHFFFAOYSA-N 0 0 361.364 3.968 20 5 FHBDRN O=[N+]([O-])c1cc(Br)cnc1NC[C@H]1CC12CCSCC2 ZINC000420652554 942142963 /nfs/dbraw/zinc/14/29/63/942142963.db2.gz MQHYTSOHBFUEIS-SECBINFHSA-N 0 0 358.261 3.698 20 5 FHBDRN Cc1cc(C(=O)N2CCC[C@@H]2c2ccc3c(c2)OCO3)cc([N+](=O)[O-])c1 ZINC000102915319 942145522 /nfs/dbraw/zinc/14/55/22/942145522.db2.gz AISYALVSSFJHGK-MRXNPFEDSA-N 0 0 354.362 3.609 20 5 FHBDRN CC(C)(C)[C@H]1C[C@H](NC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])CCO1 ZINC000280272098 942147910 /nfs/dbraw/zinc/14/79/10/942147910.db2.gz VCKZDBIGKFNZKZ-IAQYHMDHSA-N 0 0 372.824 3.640 20 5 FHBDRN Cc1cc(C)n([C@H](C)CC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)n1 ZINC000501979042 942149574 /nfs/dbraw/zinc/14/95/74/942149574.db2.gz NUOKKVLXYNNYDX-MRXNPFEDSA-N 0 0 358.442 3.796 20 5 FHBDRN Cc1sc(C(=O)NCCCc2c[nH]c3ccc(F)cc23)cc1[N+](=O)[O-] ZINC000501997419 942160995 /nfs/dbraw/zinc/16/09/95/942160995.db2.gz CLGGXRSQJBKQLE-UHFFFAOYSA-N 0 0 361.398 3.948 20 5 FHBDRN Cc1nc2ccccc2n1C1CCN(c2ccc([N+](=O)[O-])c(C)n2)CC1 ZINC000280336170 942166325 /nfs/dbraw/zinc/16/63/25/942166325.db2.gz VFWZZZQEDSDSPD-UHFFFAOYSA-N 0 0 351.410 3.798 20 5 FHBDRN Cc1ccccc1OCCN(C)C(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000016147238 942169054 /nfs/dbraw/zinc/16/90/54/942169054.db2.gz RPUCENRDSFPBND-UHFFFAOYSA-N 0 0 360.435 3.533 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)NCCc2ccc(C)cc2C)cc1SC ZINC000103001666 942171308 /nfs/dbraw/zinc/17/13/08/942171308.db2.gz ZVYUASICSCHMAZ-UHFFFAOYSA-N 0 0 374.462 3.915 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)N2CC[C@@H](c3ccccc3)C2)cc1SC ZINC000103003755 942171510 /nfs/dbraw/zinc/17/15/10/942171510.db2.gz SKSMQQJTXWLYAJ-CQSZACIVSA-N 0 0 372.446 3.955 20 5 FHBDRN O=[N+]([O-])c1cnc(N2C[C@@H](c3ccc(Cl)cc3)[C@H](CO)C2)c(Cl)c1 ZINC000378021778 942171811 /nfs/dbraw/zinc/17/18/11/942171811.db2.gz GSMHOKKRMFHSEA-FZMZJTMJSA-N 0 0 368.220 3.509 20 5 FHBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])Nc1cnn(CC2CC2)c1 ZINC000183390155 942175676 /nfs/dbraw/zinc/17/56/76/942175676.db2.gz VCOXMZFGVLXYPE-UHFFFAOYSA-N 0 0 366.830 3.586 20 5 FHBDRN Cc1ccc(C(=O)N(Cc2ccccc2[N+](=O)[O-])CC(F)(F)F)nc1C ZINC000413432905 942183831 /nfs/dbraw/zinc/18/38/31/942183831.db2.gz IOWNYCGXBKPNDM-UHFFFAOYSA-N 0 0 367.327 3.811 20 5 FHBDRN COc1cc(NC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)c(C)c(OC)c1 ZINC000412316840 942184754 /nfs/dbraw/zinc/18/47/54/942184754.db2.gz COXXUBBSWFQLGI-JKSUJKDBSA-N 0 0 356.378 3.663 20 5 FHBDRN C[C@H](NCc1nc2cc([N+](=O)[O-])ccc2o1)c1ccccc1-n1cccn1 ZINC000183152587 942185099 /nfs/dbraw/zinc/18/50/99/942185099.db2.gz PQYCCMVIQYVDHA-ZDUSSCGKSA-N 0 0 363.377 3.773 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N1CC[C@@H](c2ccccc2OC)C1 ZINC000280459750 942186311 /nfs/dbraw/zinc/18/63/11/942186311.db2.gz OGQOINJHQWIAKR-CQSZACIVSA-N 0 0 370.405 3.632 20 5 FHBDRN CN(C(=O)Cc1ccc([N+](=O)[O-])cc1)[C@H](c1ccccc1)C(F)(F)F ZINC000103050739 942192324 /nfs/dbraw/zinc/19/23/24/942192324.db2.gz XPIQDGNDQXJJGY-MRXNPFEDSA-N 0 0 352.312 3.899 20 5 FHBDRN C[C@@H](N[C@H](c1ccn(C)n1)c1ccc(F)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000366691970 942204848 /nfs/dbraw/zinc/20/48/48/942204848.db2.gz CLGNLUKWUDKPNN-YJYMSZOUSA-N 0 0 354.385 3.908 20 5 FHBDRN Cn1ccnc1-c1cccc(NC(=O)c2c(Cl)cccc2[N+](=O)[O-])c1 ZINC000110231399 942205918 /nfs/dbraw/zinc/20/59/18/942205918.db2.gz ZIEOQGNHTSTHKO-UHFFFAOYSA-N 0 0 356.769 3.901 20 5 FHBDRN C[C@H]1CN(C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)CCC1(F)F ZINC000290473562 942208208 /nfs/dbraw/zinc/20/82/08/942208208.db2.gz QPAOOLNIBGVOTA-QMMMGPOBSA-N 0 0 365.283 3.705 20 5 FHBDRN O=C(NCCc1ccccc1[N+](=O)[O-])N[C@@H](CC(F)F)c1ccccc1 ZINC000420787315 942209749 /nfs/dbraw/zinc/20/97/49/942209749.db2.gz BZHWRJPDIKKKDU-HNNXBMFYSA-N 0 0 363.364 3.833 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCC(c3ccncn3)CC2)cc1C(F)(F)F ZINC000413469909 942212799 /nfs/dbraw/zinc/21/27/99/942212799.db2.gz LSYVGANHEGSPLW-UHFFFAOYSA-N 0 0 352.316 3.788 20 5 FHBDRN Cc1nc2cc(NC(=O)c3ccc(OC(F)F)c([N+](=O)[O-])c3)ccc2[nH]1 ZINC000513730604 942221710 /nfs/dbraw/zinc/22/17/10/942221710.db2.gz MCZMWTYPUIKOCX-UHFFFAOYSA-N 0 0 362.292 3.633 20 5 FHBDRN COc1ccc([C@@H](NCCOc2ccccc2[N+](=O)[O-])C(F)(F)F)cc1 ZINC000183420539 942222560 /nfs/dbraw/zinc/22/25/60/942222560.db2.gz IKEDYXGESSAPRU-MRXNPFEDSA-N 0 0 370.327 3.875 20 5 FHBDRN CSc1ccc(C(=O)Nc2cc3c(cc2C(C)=O)OCO3)cc1[N+](=O)[O-] ZINC000137022758 942225334 /nfs/dbraw/zinc/22/53/34/942225334.db2.gz FGJLBBATQRCTRK-UHFFFAOYSA-N 0 0 374.374 3.500 20 5 FHBDRN CCOc1ccc(C(=O)N[C@@H]2CCO[C@@H](C(CC)CC)C2)cc1[N+](=O)[O-] ZINC000183429759 942226088 /nfs/dbraw/zinc/22/60/88/942226088.db2.gz FGSDERSQTFKTSJ-CRAIPNDOSA-N 0 0 364.442 3.707 20 5 FHBDRN C[C@@H](Cc1ccccc1Cl)C(=O)NCCNc1ccc([N+](=O)[O-])cc1 ZINC000513700026 942226524 /nfs/dbraw/zinc/22/65/24/942226524.db2.gz GABWMXUTOMRYEG-ZDUSSCGKSA-N 0 0 361.829 3.655 20 5 FHBDRN COc1cc(NC(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)c(C)c(OC)c1 ZINC000412320347 942228855 /nfs/dbraw/zinc/22/88/55/942228855.db2.gz MHVOEJTWRIGEDC-UHFFFAOYSA-N 0 0 374.393 3.960 20 5 FHBDRN O=[N+]([O-])c1ccccc1CN1CCO[C@@H](c2ccc(F)cc2Cl)C1 ZINC000187845719 942229266 /nfs/dbraw/zinc/22/92/66/942229266.db2.gz QZDDVUIOUASOFV-QGZVFWFLSA-N 0 0 350.777 3.961 20 5 FHBDRN CC[C@@H]1C[C@@H](C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2C)CCO1 ZINC000280698885 942231277 /nfs/dbraw/zinc/23/12/77/942231277.db2.gz LFBKMLSGQGXUPZ-CMPLNLGQSA-N 0 0 371.231 3.809 20 5 FHBDRN CCn1cc(OC(=O)c2ccc(N3C[C@@H](C)C[C@H](C)C3)c([N+](=O)[O-])c2)cn1 ZINC001269054908 942232236 /nfs/dbraw/zinc/23/22/36/942232236.db2.gz IOILWQYYCYBTHO-KBPBESRZSA-N 0 0 372.425 3.513 20 5 FHBDRN C[C@H](NC(=O)N[C@H]1c2ccc(F)cc2O[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000480970585 942246363 /nfs/dbraw/zinc/24/63/63/942246363.db2.gz YQVAHKOCVCWUDP-WVQJBOLRSA-N 0 0 359.357 3.616 20 5 FHBDRN COc1cc(C(=O)N2c3ccc([N+](=O)[O-])cc3C[C@H]2C)cc(OC)c1C ZINC000103377843 942247848 /nfs/dbraw/zinc/24/78/48/942247848.db2.gz CCIKKLQETDMURQ-LLVKDONJSA-N 0 0 356.378 3.512 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)OCC(=O)Nc2cccc(C)c2C)c1 ZINC000016195795 942247883 /nfs/dbraw/zinc/24/78/83/942247883.db2.gz PWGFQVVXQBWROQ-UHFFFAOYSA-N 0 0 374.418 3.729 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)OCC(=O)Nc2c(C)cccc2C)c1 ZINC000016195816 942248140 /nfs/dbraw/zinc/24/81/40/942248140.db2.gz QYPRHQFGZFLDAE-UHFFFAOYSA-N 0 0 374.418 3.729 20 5 FHBDRN COc1ccc(CCC(=O)N2c3ccc([N+](=O)[O-])cc3C[C@@H]2C)cc1OC ZINC000103377851 942248121 /nfs/dbraw/zinc/24/81/21/942248121.db2.gz KIBBXBXSFWXYCB-ZDUSSCGKSA-N 0 0 370.405 3.522 20 5 FHBDRN CCCCN(C)C(=O)C1CCN(c2nccc3ccc([N+](=O)[O-])cc32)CC1 ZINC000413067391 942250416 /nfs/dbraw/zinc/25/04/16/942250416.db2.gz IXVCWULARMTLNY-UHFFFAOYSA-N 0 0 370.453 3.618 20 5 FHBDRN CN1CCCN(C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)c2cc(F)ccc21 ZINC000413494251 942252103 /nfs/dbraw/zinc/25/21/03/942252103.db2.gz HJLHCJPVBVZIHG-DLBZAZTESA-N 0 0 369.396 3.711 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N(C[C@H]1CCCO1)C1CCCC1 ZINC000122840293 942252156 /nfs/dbraw/zinc/25/21/56/942252156.db2.gz QOJFFWRRVJMTEQ-OAHLLOKOSA-N 0 0 363.414 3.559 20 5 FHBDRN COc1cc(OCC(=O)N(C(C)C)C2CCCCC2)ccc1[N+](=O)[O-] ZINC000103390324 942256512 /nfs/dbraw/zinc/25/65/12/942256512.db2.gz JWQHSRILUAWWBX-UHFFFAOYSA-N 0 0 350.415 3.552 20 5 FHBDRN Cc1ccccc1-c1noc([C@H](C)Oc2ccc([N+](=O)[O-])c(CO)c2)n1 ZINC000431857075 942260159 /nfs/dbraw/zinc/26/01/59/942260159.db2.gz KMECYPLIJKBBRT-LBPRGKRZSA-N 0 0 355.350 3.586 20 5 FHBDRN O=C(Nc1cccc(CNc2ncc([N+](=O)[O-])cc2F)c1)C1CCCC1 ZINC000413076020 942260353 /nfs/dbraw/zinc/26/03/53/942260353.db2.gz UPMFKBZYODBMDV-UHFFFAOYSA-N 0 0 358.373 3.870 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CCC[C@@H](CC(F)(F)F)C1 ZINC000420946992 942270016 /nfs/dbraw/zinc/27/00/16/942270016.db2.gz MJNCGNLVZWCUJJ-LBPRGKRZSA-N 0 0 359.348 3.506 20 5 FHBDRN Cc1c(NC(=O)[C@H](C)N2CCC[C@@H](CC(F)(F)F)C2)cccc1[N+](=O)[O-] ZINC000420954709 942274304 /nfs/dbraw/zinc/27/43/04/942274304.db2.gz VAWFFWXMWIXFBK-STQMWFEESA-N 0 0 373.375 3.895 20 5 FHBDRN CCCCc1nnc(N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)n1CC ZINC000549397217 942276339 /nfs/dbraw/zinc/27/63/39/942276339.db2.gz HOAGKHKVDPCTHE-UHFFFAOYSA-N 0 0 373.457 3.597 20 5 FHBDRN Cc1nc(C(C)C)ccc1CSCc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000419490282 942280960 /nfs/dbraw/zinc/28/09/60/942280960.db2.gz HHVPRUSLCRBZQC-UHFFFAOYSA-N 0 0 359.451 3.954 20 5 FHBDRN O=C(NC[C@H]1CC12CC2)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000416041410 942287054 /nfs/dbraw/zinc/28/70/54/942287054.db2.gz DIBOWNDGAJQOGR-OAHLLOKOSA-N 0 0 352.390 3.704 20 5 FHBDRN O=[N+]([O-])c1cccc(Cl)c1CN1CC[C@@](O)(Cc2ccc(F)cc2)C1 ZINC000421010448 942290625 /nfs/dbraw/zinc/29/06/25/942290625.db2.gz IDDGCHHCNKBFBS-GOSISDBHSA-N 0 0 364.804 3.567 20 5 FHBDRN CCn1cc([C@@H]2OCC[C@H]2CNc2ccc([N+](=O)[O-])c3cccnc23)cn1 ZINC000413519066 942291828 /nfs/dbraw/zinc/29/18/28/942291828.db2.gz VRPWFXYYSXFOLQ-ORAYPTAESA-N 0 0 367.409 3.549 20 5 FHBDRN COc1cc(CSCc2ccn(CC(F)(F)F)n2)ccc1[N+](=O)[O-] ZINC000419530107 942292986 /nfs/dbraw/zinc/29/29/86/942292986.db2.gz JFBQPNUBCVBZNF-UHFFFAOYSA-N 0 0 361.345 3.796 20 5 FHBDRN CCN(C(=O)Cc1ccc([N+](=O)[O-])cc1)c1ccc(Br)cc1 ZINC000501074439 942296509 /nfs/dbraw/zinc/29/65/09/942296509.db2.gz IBVGAZRLVKQCHZ-UHFFFAOYSA-N 0 0 363.211 3.953 20 5 FHBDRN CC[C@H](CC1CCCCC1)C(=O)N1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000366749978 942296947 /nfs/dbraw/zinc/29/69/47/942296947.db2.gz HUQMWFJWTUUYCP-MRXNPFEDSA-N 0 0 362.474 3.951 20 5 FHBDRN CO[C@H](CNC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C)c1ccccc1 ZINC000103601496 942297053 /nfs/dbraw/zinc/29/70/53/942297053.db2.gz YQUAQAGNGHAOLW-LJQANCHMSA-N 0 0 371.437 3.903 20 5 FHBDRN O=C(Cc1cccc([N+](=O)[O-])c1)N1CCC[C@H]1Cc1cc(F)ccc1F ZINC000416057365 942298790 /nfs/dbraw/zinc/29/87/90/942298790.db2.gz ZWNJNCFHZVOEFK-INIZCTEOSA-N 0 0 360.360 3.649 20 5 FHBDRN CCCN(C[C@H]1COc2ccccc2O1)C(=O)c1cc([N+](=O)[O-])ccc1C ZINC000502221608 942298977 /nfs/dbraw/zinc/29/89/77/942298977.db2.gz WEJUFFCEXRTBER-INIZCTEOSA-N 0 0 370.405 3.595 20 5 FHBDRN O=[N+]([O-])c1ccc(N2C[C@@H](O)C[C@@H]2c2ccccc2)cc1C(F)(F)F ZINC000413513019 942300217 /nfs/dbraw/zinc/30/02/17/942300217.db2.gz YFDBBXXEJQIIJX-XJKSGUPXSA-N 0 0 352.312 3.926 20 5 FHBDRN COc1cc(CN(C)C(=O)Cc2cccc([N+](=O)[O-])c2C)ccc1SC ZINC000163893730 942303900 /nfs/dbraw/zinc/30/39/00/942303900.db2.gz KXHVASKKBCAWHS-UHFFFAOYSA-N 0 0 374.462 3.835 20 5 FHBDRN COc1cc(C(=O)NC(C)(C)Cc2ccc(C)cc2)c([N+](=O)[O-])cc1OC ZINC000416060199 942304796 /nfs/dbraw/zinc/30/47/96/942304796.db2.gz KTOCUAXNXOJIFH-UHFFFAOYSA-N 0 0 372.421 3.672 20 5 FHBDRN O=C(NCC1(C(F)F)CC1)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000501108127 942311125 /nfs/dbraw/zinc/31/11/25/942311125.db2.gz PWNDKSAWTFJOJA-UHFFFAOYSA-N 0 0 364.146 3.524 20 5 FHBDRN Cc1cc(C)cc([C@H](C)NC(=O)NCCNc2ccccc2[N+](=O)[O-])c1 ZINC000502249793 942313008 /nfs/dbraw/zinc/31/30/08/942313008.db2.gz OSVRGCITONFXQX-HNNXBMFYSA-N 0 0 356.426 3.684 20 5 FHBDRN O=C(N[C@@H](c1cc2ccccc2o1)c1ccncc1)c1ccc([N+](=O)[O-])cn1 ZINC000378141490 942318530 /nfs/dbraw/zinc/31/85/30/942318530.db2.gz NPBUXOBWEBPKAR-LJQANCHMSA-N 0 0 374.356 3.650 20 5 FHBDRN O=C(Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1)N1CC[C@@]12CCOC2 ZINC000421054278 942321643 /nfs/dbraw/zinc/32/16/43/942321643.db2.gz HXWUJQLVWDBZSD-IBGZPJMESA-N 0 0 369.377 3.784 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)c1cn2ccnc2s1 ZINC000188057639 942322888 /nfs/dbraw/zinc/32/28/88/942322888.db2.gz NTWRECKPAAUXLM-UHFFFAOYSA-N 0 0 356.285 3.575 20 5 FHBDRN CC(C)(C)c1cc(CSc2ccc([N+](=O)[O-])c(S(C)(=O)=O)c2)no1 ZINC000419586916 942322861 /nfs/dbraw/zinc/32/28/61/942322861.db2.gz HHMVVMBPJSJSFD-UHFFFAOYSA-N 0 0 370.452 3.576 20 5 FHBDRN C[C@@H]1C[C@@H](CNc2cc(C(F)(F)C(F)(F)F)ncc2[N+](=O)[O-])[C@@H](C)O1 ZINC000413535940 942325722 /nfs/dbraw/zinc/32/57/22/942325722.db2.gz QLTZFSWBNIBMCS-HLTSFMKQSA-N 0 0 369.290 3.869 20 5 FHBDRN C[C@@H]1C[C@H](CNc2cc(C(F)(F)C(F)(F)F)ncc2[N+](=O)[O-])[C@@H](C)O1 ZINC000413535942 942325979 /nfs/dbraw/zinc/32/59/79/942325979.db2.gz QLTZFSWBNIBMCS-IWSPIJDZSA-N 0 0 369.290 3.869 20 5 FHBDRN COc1cccc(CCCNC(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)c1 ZINC000085637582 942326989 /nfs/dbraw/zinc/32/69/89/942326989.db2.gz ULENROMNFBHFOP-UHFFFAOYSA-N 0 0 357.410 3.975 20 5 FHBDRN Cc1cc(S(=O)(=O)N2c3ccccc3SC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000434109840 942337442 /nfs/dbraw/zinc/33/74/42/942337442.db2.gz VRNHECQSPHHXPP-LBPRGKRZSA-N 0 0 364.448 3.593 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1C(F)(F)F)N1CCSC[C@@H]1C1CCC1 ZINC000416094617 942338341 /nfs/dbraw/zinc/33/83/41/942338341.db2.gz PKKSIZOSHSISAR-CQSZACIVSA-N 0 0 374.384 3.971 20 5 FHBDRN Cc1ccccc1[C@@]1(F)CCN(C(=O)CCc2cccc([N+](=O)[O-])c2)C1 ZINC000501171069 942339024 /nfs/dbraw/zinc/33/90/24/942339024.db2.gz CZNTYJZLKYDXAS-HXUWFJFHSA-N 0 0 356.397 3.933 20 5 FHBDRN CCc1n[nH]c(C(=O)N(Cc2ccccc2)Cc2ccccc2)c1[N+](=O)[O-] ZINC000188130901 942339840 /nfs/dbraw/zinc/33/98/40/942339840.db2.gz CKOIRVBZQYSCIS-UHFFFAOYSA-N 0 0 364.405 3.723 20 5 FHBDRN COc1cc(C(=O)Nc2csc(-c3ccncc3)n2)c([N+](=O)[O-])cc1F ZINC001268827456 942343575 /nfs/dbraw/zinc/34/35/75/942343575.db2.gz VMPPMGPUCXTWIZ-UHFFFAOYSA-N 0 0 374.353 3.513 20 5 FHBDRN CC(=O)N(C)c1ccc(NC(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)cn1 ZINC000416100585 942344309 /nfs/dbraw/zinc/34/43/09/942344309.db2.gz AOLQLCGXELLXBE-UHFFFAOYSA-N 0 0 370.409 3.522 20 5 FHBDRN COc1ccc(NC(=O)N2CCC[C@H](CC(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000421099358 942346476 /nfs/dbraw/zinc/34/64/76/942346476.db2.gz YVXRCIIKIILHSX-SNVBAGLBSA-N 0 0 361.320 3.800 20 5 FHBDRN C[C@H](NC(=O)NCc1cnccc1C(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000413143943 942348116 /nfs/dbraw/zinc/34/81/16/942348116.db2.gz MKTPJJCYTQQLSJ-ZDUSSCGKSA-N 0 0 356.426 3.848 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)NCC1CCC(F)(F)CC1 ZINC000501223791 942351590 /nfs/dbraw/zinc/35/15/90/942351590.db2.gz WLDOSNAAFHGMEF-UHFFFAOYSA-N 0 0 351.353 3.560 20 5 FHBDRN O=[N+]([O-])c1cnc(Nc2ccc(NC[C@@H]3CCCO3)c(F)c2)c(F)c1 ZINC000413154475 942352100 /nfs/dbraw/zinc/35/21/00/942352100.db2.gz NZZWQQCPRKSCKM-LBPRGKRZSA-N 0 0 350.325 3.603 20 5 FHBDRN O=C1CC[C@H](c2cccc(Nc3cc(C(F)(F)F)ncc3[N+](=O)[O-])c2)N1 ZINC000413559242 942356397 /nfs/dbraw/zinc/35/63/97/942356397.db2.gz JGMIRHVJMPQWRE-LLVKDONJSA-N 0 0 366.299 3.703 20 5 FHBDRN Cc1ccccc1[C@]1(F)CCN(C(=O)CCOc2ccccc2[N+](=O)[O-])C1 ZINC000501242909 942357416 /nfs/dbraw/zinc/35/74/16/942357416.db2.gz FTBMMTSVNBKXDI-FQEVSTJZSA-N 0 0 372.396 3.769 20 5 FHBDRN Cc1cc(F)cc([C@]2(F)CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)C2)c1 ZINC000501252856 942365080 /nfs/dbraw/zinc/36/50/80/942365080.db2.gz JWUPRPLWWSATMO-SFHVURJKSA-N 0 0 364.323 3.892 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)Nc1nc2c(s1)CCC2(C)C ZINC000421137059 942369582 /nfs/dbraw/zinc/36/95/82/942369582.db2.gz UHDPOWZEQYGNBM-UHFFFAOYSA-N 0 0 360.439 3.939 20 5 FHBDRN CCN(C(=O)Cc1ccc([N+](=O)[O-])cc1)[C@@H](C)Cc1ccc(OC)cc1 ZINC000066806103 942370205 /nfs/dbraw/zinc/37/02/05/942370205.db2.gz AONHBXSXLNSUHN-HNNXBMFYSA-N 0 0 356.422 3.626 20 5 FHBDRN O=C(Nc1cc(Br)cc([N+](=O)[O-])c1)c1cccnc1C1CC1 ZINC000501269218 942374293 /nfs/dbraw/zinc/37/42/93/942374293.db2.gz ANDOCDOTNGVSNH-UHFFFAOYSA-N 0 0 362.183 3.882 20 5 FHBDRN Cc1cc(F)cc2c1CN(C(=O)c1cc3cc([N+](=O)[O-])ccc3o1)CC2 ZINC000501270659 942375173 /nfs/dbraw/zinc/37/51/73/942375173.db2.gz BYDKWOIWWMHOJG-UHFFFAOYSA-N 0 0 354.337 3.987 20 5 FHBDRN Cc1cc(NC2CCN(C(=O)OC(C)C)CC2)c2cccc([N+](=O)[O-])c2n1 ZINC000302039060 942386664 /nfs/dbraw/zinc/38/66/64/942386664.db2.gz VRZDZIWZEXTSKD-UHFFFAOYSA-N 0 0 372.425 3.873 20 5 FHBDRN O=C(N[C@H]1CCCc2cc(F)ccc21)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000501315614 942397102 /nfs/dbraw/zinc/39/71/02/942397102.db2.gz WAKMGPYGPFLRAH-IBGZPJMESA-N 0 0 369.396 3.879 20 5 FHBDRN CCCn1ncc(C(=O)Nc2ccc([N+](=O)[O-])c3ncccc23)c1C1CC1 ZINC001268850078 942407735 /nfs/dbraw/zinc/40/77/35/942407735.db2.gz SCVHCRXBBYNKSF-UHFFFAOYSA-N 0 0 365.393 3.879 20 5 FHBDRN O=[N+]([O-])c1ccc2ccnc(N3CCC(OC[C@H]4CCCCO4)CC3)c2c1 ZINC000413181285 942409826 /nfs/dbraw/zinc/40/98/26/942409826.db2.gz QDXGJNAXQONOPT-GOSISDBHSA-N 0 0 371.437 3.698 20 5 FHBDRN CCOC(=O)c1ccccc1NC(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000505248463 942418873 /nfs/dbraw/zinc/41/88/73/942418873.db2.gz BQTXQHIPSKZQAF-UHFFFAOYSA-N 0 0 354.318 3.770 20 5 FHBDRN Cc1c(NC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)cnn1CC(C)C ZINC000501342572 942420145 /nfs/dbraw/zinc/42/01/45/942420145.db2.gz VTTUXPBEAAKLBD-ZDUSSCGKSA-N 0 0 362.455 3.875 20 5 FHBDRN O=C([O-])c1cccc(C[NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)c1 ZINC000617338517 942422434 /nfs/dbraw/zinc/42/24/34/942422434.db2.gz DNUVPAALKUSZOM-UHFFFAOYSA-N 0 0 352.346 3.843 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])Nc1nc2c(ccc(F)c2F)s1 ZINC000501356350 942429616 /nfs/dbraw/zinc/42/96/16/942429616.db2.gz PRANSMUGLTXAJT-UHFFFAOYSA-N 0 0 364.333 3.533 20 5 FHBDRN Cc1cc(N(C)Cc2noc(C3CC3)n2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000413615681 942440371 /nfs/dbraw/zinc/44/03/71/942440371.db2.gz XMRPOOHVBZOZHT-UHFFFAOYSA-N 0 0 356.304 3.819 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1-c1nc(CC(=O)N(C)C2CCCCC2)no1 ZINC000421262327 942450272 /nfs/dbraw/zinc/45/02/72/942450272.db2.gz ODCZMSVBIGVTLF-UHFFFAOYSA-N 0 0 372.425 3.595 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CC(=O)c2ccccc21 ZINC000416190177 942454488 /nfs/dbraw/zinc/45/44/88/942454488.db2.gz BIHJJIZQASTJCO-KDOFPFPSSA-N 0 0 352.390 3.607 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[C@H](Cc2ccc(F)cc2)C1 ZINC000122900215 942457169 /nfs/dbraw/zinc/45/71/69/942457169.db2.gz ZZPRYNVVGYWJRC-CQSZACIVSA-N 0 0 373.384 3.839 20 5 FHBDRN O=C(CSc1ccccc1[N+](=O)[O-])N1CCC(CC(F)(F)F)CC1 ZINC000501416362 942457626 /nfs/dbraw/zinc/45/76/26/942457626.db2.gz HOGYFCCKAYKLQN-UHFFFAOYSA-N 0 0 362.373 3.878 20 5 FHBDRN CC(C)c1ccc2c(c1)[C@@H](Nc1ccc3ncc([N+](=O)[O-])n3n1)CCC2 ZINC000502456977 942459249 /nfs/dbraw/zinc/45/92/49/942459249.db2.gz MJDWMEAIURMVMN-INIZCTEOSA-N 0 0 351.410 3.672 20 5 FHBDRN CCC(CC)(CNC(=O)c1cc(C)ccc1[N+](=O)[O-])C(=O)OC(C)(C)C ZINC000424947428 942459591 /nfs/dbraw/zinc/45/95/91/942459591.db2.gz DNWKAYBPYUBUEX-UHFFFAOYSA-N 0 0 364.442 3.781 20 5 FHBDRN COc1ccccc1C1CC(NC(=O)Cc2cccc([N+](=O)[O-])c2C)C1 ZINC000378255660 942464762 /nfs/dbraw/zinc/46/47/62/942464762.db2.gz WXVQHUIGUFYYQX-UHFFFAOYSA-N 0 0 354.406 3.517 20 5 FHBDRN Cc1ccc([C@@H]2NC(=O)N([C@@H](C)c3ccc([N+](=O)[O-])cc3)C2=O)cc1C ZINC000419964269 942468535 /nfs/dbraw/zinc/46/85/35/942468535.db2.gz IPWPQXJFXLTXJO-GUYCJALGSA-N 0 0 353.378 3.566 20 5 FHBDRN C[C@@H](c1ccc([N+](=O)[O-])cc1)N1C(=O)[C@@H]2CC[C@@H](c3ccccc3)N2C1=O ZINC000419969357 942470885 /nfs/dbraw/zinc/47/08/85/942470885.db2.gz RZCGJKSGGAOITA-KKXDTOCCSA-N 0 0 365.389 3.824 20 5 FHBDRN C[C@@H](c1ccc([N+](=O)[O-])cc1)N1C(=O)[C@H]2C[C@@H](C3CCCCC3)CN2C1=O ZINC000419968455 942471793 /nfs/dbraw/zinc/47/17/93/942471793.db2.gz PZFMEINPFVIYSH-FDQGKXFDSA-N 0 0 371.437 3.889 20 5 FHBDRN C[C@H](CC(=O)c1cccs1)NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000413653880 942473544 /nfs/dbraw/zinc/47/35/44/942473544.db2.gz KSYZENRNOLQUKI-BYCMXARLSA-N 0 0 358.419 3.538 20 5 FHBDRN C[C@H](NC(=O)NCc1cccc(OC(F)F)c1)c1cccc([N+](=O)[O-])c1 ZINC000051302159 942475607 /nfs/dbraw/zinc/47/56/07/942475607.db2.gz MQXLHEBDFOSHCP-NSHDSACASA-N 0 0 365.336 3.757 20 5 FHBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)NCc1cc(C)nc(C)n1 ZINC000501447120 942481929 /nfs/dbraw/zinc/48/19/29/942481929.db2.gz OIHAIXKXWOLCKW-UHFFFAOYSA-N 0 0 374.466 3.824 20 5 FHBDRN CCN(C(=O)Cc1c(F)c(OC)ccc1[N+](=O)[O-])c1cc(C)ccc1C ZINC000413201331 942484918 /nfs/dbraw/zinc/48/49/18/942484918.db2.gz KHUFMRAVAXMKRK-UHFFFAOYSA-N 0 0 360.385 3.955 20 5 FHBDRN Cc1cn2c(n1)[C@@H](CNc1ncc([N+](=O)[O-])cc1C(F)(F)F)CCC2 ZINC000413212386 942487175 /nfs/dbraw/zinc/48/71/75/942487175.db2.gz YIADDQQNGGKLLW-SNVBAGLBSA-N 0 0 355.320 3.503 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(CO)c(Cl)c1 ZINC000416207548 942487686 /nfs/dbraw/zinc/48/76/86/942487686.db2.gz YDXVHEPHKVMKML-ZDUSSCGKSA-N 0 0 362.813 3.948 20 5 FHBDRN CC[C@@](C)(C(=O)OC)N(CC1CC1)C(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000425029415 942492878 /nfs/dbraw/zinc/49/28/78/942492878.db2.gz IMFWNSKKGMWQFW-IBGZPJMESA-N 0 0 374.393 3.535 20 5 FHBDRN CCN(C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)c1cccc(OC)c1 ZINC000501458764 942494250 /nfs/dbraw/zinc/49/42/50/942494250.db2.gz DQXDZALXLJCPNZ-UHFFFAOYSA-N 0 0 355.394 3.844 20 5 FHBDRN CC(C)(C(=O)NC[C@@H]1CCO[C@H]1c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000502514016 942507799 /nfs/dbraw/zinc/50/77/99/942507799.db2.gz AHAWIYHBWHDQIT-LPHOPBHVSA-N 0 0 368.433 3.766 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC[C@H]1c1cc(C)on1 ZINC000366903224 942509526 /nfs/dbraw/zinc/50/95/26/942509526.db2.gz NRODXSFPGMRBQJ-HNNXBMFYSA-N 0 0 360.370 3.659 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H]1/C=C\c1ccccc1 ZINC000505380867 942513743 /nfs/dbraw/zinc/51/37/43/942513743.db2.gz UYRPMTHCEBVTFI-ZBTGYSDGSA-N 0 0 352.390 3.921 20 5 FHBDRN COc1ccc(Cl)cc1C(C)(C)NC(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000425039365 942514673 /nfs/dbraw/zinc/51/46/73/942514673.db2.gz SEXIGVXPAKXDMZ-UHFFFAOYSA-N 0 0 362.813 3.851 20 5 FHBDRN CCO[C@@H]1C[C@H](Nc2ccc([N+](=O)[O-])c3ncccc23)C12CCOCC2 ZINC000413228213 942516038 /nfs/dbraw/zinc/51/60/38/942516038.db2.gz KIDRFGMXSTZPRR-DLBZAZTESA-N 0 0 357.410 3.529 20 5 FHBDRN CC(C)(C)OC(=O)[C@@H]1CCCN(c2nccc3ccc([N+](=O)[O-])cc32)C1 ZINC000413229710 942516997 /nfs/dbraw/zinc/51/69/97/942516997.db2.gz KNSZDQYLHZTLFR-CQSZACIVSA-N 0 0 357.410 3.701 20 5 FHBDRN CC(C)(C)OC(=O)[C@H]1CCCN(c2ccc([N+](=O)[O-])c3ncccc23)C1 ZINC000413240708 942532569 /nfs/dbraw/zinc/53/25/69/942532569.db2.gz VOGONWXFWNHPOB-ZDUSSCGKSA-N 0 0 357.410 3.701 20 5 FHBDRN O=[N+]([O-])c1ccc(CSCCCS(=O)(=O)c2ccc(F)cc2)cc1 ZINC000513817250 942535376 /nfs/dbraw/zinc/53/53/76/942535376.db2.gz DPVBRPNYULYIHY-UHFFFAOYSA-N 0 0 369.439 3.831 20 5 FHBDRN O=[N+]([O-])c1ccc2ccnc(N3CCC(c4noc(C5CC5)n4)CC3)c2c1 ZINC000413231913 942537213 /nfs/dbraw/zinc/53/72/13/942537213.db2.gz MNILRRFCFCHZCH-UHFFFAOYSA-N 0 0 365.393 3.787 20 5 FHBDRN Cc1ccccc1O[C@@H](C)CNC(=O)CSc1ccccc1[N+](=O)[O-] ZINC000541262195 942538998 /nfs/dbraw/zinc/53/89/98/942538998.db2.gz JYKFHUDKTHQQOO-AWEZNQCLSA-N 0 0 360.435 3.579 20 5 FHBDRN CC[C@H](CNC(=O)N(C)CCc1ccccc1[N+](=O)[O-])CC(F)(F)F ZINC000413737258 942542154 /nfs/dbraw/zinc/54/21/54/942542154.db2.gz KTKIHZTVQWOKCP-LBPRGKRZSA-N 0 0 361.364 3.757 20 5 FHBDRN CC(C)c1[nH]nc(C(=O)Nc2ccc(CC(F)(F)F)cc2)c1[N+](=O)[O-] ZINC000434243627 942543336 /nfs/dbraw/zinc/54/33/36/942543336.db2.gz OYQBIBVIBJFIOS-UHFFFAOYSA-N 0 0 356.304 3.798 20 5 FHBDRN CCOc1ccc2c(c1)CCN(C(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1)C2 ZINC000434244615 942545026 /nfs/dbraw/zinc/54/50/26/942545026.db2.gz IIAGEDJHTWENFU-UHFFFAOYSA-N 0 0 368.433 3.856 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N2C[C@@H](C)C[C@H]2c2cccc(F)c2)c1[N+](=O)[O-] ZINC000434246431 942546651 /nfs/dbraw/zinc/54/66/51/942546651.db2.gz SQMPHSIZWZZWFT-FZMZJTMJSA-N 0 0 360.389 3.804 20 5 FHBDRN COc1cc(NC(=O)Nc2cc([N+](=O)[O-])ccc2C)ccc1NC(C)=O ZINC000502587551 942550928 /nfs/dbraw/zinc/55/09/28/942550928.db2.gz IOUVAKFSMSATME-UHFFFAOYSA-N 0 0 358.354 3.514 20 5 FHBDRN CCCC(=O)Nc1ccc(CNC(=O)c2cc([N+](=O)[O-])c(C)cc2C)cc1 ZINC000421425434 942553851 /nfs/dbraw/zinc/55/38/51/942553851.db2.gz DAHYZVNABVDWBI-UHFFFAOYSA-N 0 0 369.421 3.880 20 5 FHBDRN COc1ccc(N(CC(C)C)C(=O)c2cc([N+](=O)[O-])ccc2OC)cc1 ZINC000501572959 942556243 /nfs/dbraw/zinc/55/62/43/942556243.db2.gz XXVPZRPPWQDMDX-UHFFFAOYSA-N 0 0 358.394 3.915 20 5 FHBDRN COCC[C@H](Cc1ccco1)Nc1ncc([N+](=O)[O-])cc1C(F)(F)F ZINC000413247869 942561847 /nfs/dbraw/zinc/56/18/47/942561847.db2.gz QQPMJZMAIHCKNP-SNVBAGLBSA-N 0 0 359.304 3.661 20 5 FHBDRN Cc1ccc(S(=O)(=O)N2CCC[C@@H](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000518510489 942563610 /nfs/dbraw/zinc/56/36/10/942563610.db2.gz RPGDCSYTXLQYLN-KRWDZBQOSA-N 0 0 374.462 3.547 20 5 FHBDRN Cc1cc(C)c(NC(=O)CNC(=O)c2cc([N+](=O)[O-])c(C)cc2C)c(C)c1 ZINC000421419816 942563766 /nfs/dbraw/zinc/56/37/66/942563766.db2.gz JNONOICQPDKKGM-UHFFFAOYSA-N 0 0 369.421 3.505 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CC[C@@H](n3cnc4c3CCCC4)C2)c2cccnc21 ZINC000413253688 942567946 /nfs/dbraw/zinc/56/79/46/942567946.db2.gz WAPKFJCBBSFPAR-CQSZACIVSA-N 0 0 363.421 3.670 20 5 FHBDRN Cc1cccc(OCCCC(=O)OCc2ccc(N(C)C)c([N+](=O)[O-])c2)c1 ZINC001268937037 942571957 /nfs/dbraw/zinc/57/19/57/942571957.db2.gz QFXCTSPHPPAKEY-UHFFFAOYSA-N 0 0 372.421 3.872 20 5 FHBDRN COCCOc1cc(C)ccc1NC(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC000421440817 942574368 /nfs/dbraw/zinc/57/43/68/942574368.db2.gz AVJMCWGREITZFX-UHFFFAOYSA-N 0 0 358.394 3.798 20 5 FHBDRN COC1(C(F)(F)F)CCN(C(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)CC1 ZINC000416269164 942575222 /nfs/dbraw/zinc/57/52/22/942575222.db2.gz OHURORGXEJILFL-UHFFFAOYSA-N 0 0 374.359 3.902 20 5 FHBDRN Cn1cc(-c2cccc(CNC(=O)c3cc(Cl)ccc3[N+](=O)[O-])c2)cn1 ZINC000120231928 942579704 /nfs/dbraw/zinc/57/97/04/942579704.db2.gz DMXQQLXAIFILKW-UHFFFAOYSA-N 0 0 370.796 3.579 20 5 FHBDRN C[C@@H](CNC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1)CC(F)(F)F ZINC000413762724 942580298 /nfs/dbraw/zinc/58/02/98/942580298.db2.gz MBEJJEDTMVIXOT-LLVKDONJSA-N 0 0 359.348 3.857 20 5 FHBDRN COc1cccc(C2=CCN(C(=O)C(C)(C)c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000501638344 942583087 /nfs/dbraw/zinc/58/30/87/942583087.db2.gz JLAJZMJMCQPYJL-UHFFFAOYSA-N 0 0 366.417 3.807 20 5 FHBDRN Cc1c(CC(=O)N2CCC[C@@H](Oc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000416269773 942583726 /nfs/dbraw/zinc/58/37/26/942583726.db2.gz HMRFKXWCJRPZND-GOSISDBHSA-N 0 0 354.406 3.516 20 5 FHBDRN COC(=O)c1cc(C(=O)O[C@H](C)c2ccc(Cl)cc2)cc([N+](=O)[O-])c1 ZINC000015963899 942584674 /nfs/dbraw/zinc/58/46/74/942584674.db2.gz ZOZAJGMXSKHZOU-SNVBAGLBSA-N 0 0 363.753 3.953 20 5 FHBDRN CCOc1cc(CNC(=O)c2cc([N+](=O)[O-])c(C)cc2C)ccc1OC ZINC000421464479 942585515 /nfs/dbraw/zinc/58/55/15/942585515.db2.gz FXLCVPNWJVZURC-UHFFFAOYSA-N 0 0 358.394 3.549 20 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FHBDRN COc1ccccc1C[C@@H](C)N(C)C(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC000421488117 942603103 /nfs/dbraw/zinc/60/31/03/942603103.db2.gz ZTBCPOSCFREZKP-OAHLLOKOSA-N 0 0 356.422 3.923 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@@](C)(OC)CC1 ZINC000366568281 942603501 /nfs/dbraw/zinc/60/35/01/942603501.db2.gz YPKKEFAKFJZLKW-QGZVFWFLSA-N 0 0 352.456 3.738 20 5 FHBDRN O=[N+]([O-])c1ccc2ccnc(N3CCC[C@@](CO)(c4ccccc4)C3)c2c1 ZINC000413286279 942605071 /nfs/dbraw/zinc/60/50/71/942605071.db2.gz RXESSKHSUODDHT-OAQYLSRUSA-N 0 0 363.417 3.674 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)Nc1ccccc1O[C@H]1CCOC1 ZINC000421492504 942605555 /nfs/dbraw/zinc/60/55/55/942605555.db2.gz UZINMWIQRLZYSL-AWEZNQCLSA-N 0 0 356.378 3.632 20 5 FHBDRN CC(C)(C)O[C@H](C(=O)NCCc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000513924204 942608438 /nfs/dbraw/zinc/60/84/38/942608438.db2.gz PRGMJWJKFKOGSV-SFHVURJKSA-N 0 0 356.422 3.810 20 5 FHBDRN Cc1ccc(NC(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])cc1-c1ncco1 ZINC000434363496 942617405 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3.870 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)Nc1cccc(-c2ncco2)c1 ZINC000513965027 942646741 /nfs/dbraw/zinc/64/67/41/942646741.db2.gz SBLYDSFWOOXXCL-UHFFFAOYSA-N 0 0 362.345 3.843 20 5 FHBDRN O=[N+]([O-])c1cnccc1N1CCC[C@H](c2nc(-c3ccc(F)cc3)no2)C1 ZINC000066811905 942656448 /nfs/dbraw/zinc/65/64/48/942656448.db2.gz BXAGUELQZCQRHC-ZDUSSCGKSA-N 0 0 369.356 3.563 20 5 FHBDRN O=[N+]([O-])c1ccc2ccnc(N3CCCN4c5ccccc5C[C@H]4C3)c2c1 ZINC000413315973 942656920 /nfs/dbraw/zinc/65/69/20/942656920.db2.gz WEBYDYIDCDNLQB-SFHVURJKSA-N 0 0 360.417 3.784 20 5 FHBDRN O=C(NC[C@H]1CC[C@@H](c2ccccc2)O1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412360264 942662933 /nfs/dbraw/zinc/66/29/33/942662933.db2.gz OVLAONYRQIJOIO-WCIQWLHISA-N 0 0 366.417 3.735 20 5 FHBDRN O=[N+]([O-])c1ccc2ccnc(N[C@@H]3CCO[C@@H](c4ccccn4)C3)c2c1 ZINC000413329627 942666954 /nfs/dbraw/zinc/66/69/54/942666954.db2.gz ZBEIDOINRKDPMQ-RDTXWAMCSA-N 0 0 350.378 3.870 20 5 FHBDRN COc1cccc([C@@H]2C[C@H]2CNC(=O)Nc2cc([N+](=O)[O-])ccc2C)c1 ZINC000413834097 942668302 /nfs/dbraw/zinc/66/83/02/942668302.db2.gz LXMOWYUOXCOCFN-YOEHRIQHSA-N 0 0 355.394 3.837 20 5 FHBDRN CC1(C)CN(C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)[C@@H]1c1ccncc1 ZINC000412361969 942669488 /nfs/dbraw/zinc/66/94/88/942669488.db2.gz NAFHIPIPWBJQSL-RCCFBDPRSA-N 0 0 351.406 3.703 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)NC[C@H]2CCCCC(F)(F)C2)c1F ZINC000412362930 942669961 /nfs/dbraw/zinc/66/99/61/942669961.db2.gz VLLHNYKEZZEEER-NSHDSACASA-N 0 0 374.359 3.617 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)NC[C@H](c2ccccc2)C2CC2)c1F ZINC000412364506 942670713 /nfs/dbraw/zinc/67/07/13/942670713.db2.gz PZSYKAAVUGIGCW-MRXNPFEDSA-N 0 0 372.396 3.595 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H]1CC12CCSCC2 ZINC000421586257 942673645 /nfs/dbraw/zinc/67/36/45/942673645.db2.gz FJCABOGTDMQRAV-QWHCGFSZSA-N 0 0 366.508 3.725 20 5 FHBDRN CCc1[nH]nc(-c2nc(Cc3cccc(C(F)(F)F)c3)no2)c1[N+](=O)[O-] ZINC000420472423 942675854 /nfs/dbraw/zinc/67/58/54/942675854.db2.gz 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CC(C)c1cccc(N(C)S(=O)(=O)CCc2ccc([N+](=O)[O-])cc2)c1 ZINC000503447134 943196350 /nfs/dbraw/zinc/19/63/50/943196350.db2.gz LITNZVAGNIOBPO-UHFFFAOYSA-N 0 0 362.451 3.727 20 5 FHBDRN COc1ccc(-c2n[nH]cc2CNCc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000183805483 943205010 /nfs/dbraw/zinc/20/50/10/943205010.db2.gz KLAYCZHYXWKYEL-UHFFFAOYSA-N 0 0 372.812 3.937 20 5 FHBDRN O=C(c1ccc(-c2cc[nH]n2)s1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000431905446 943213853 /nfs/dbraw/zinc/21/38/53/943213853.db2.gz VLTQBMHQSAQIOW-UHFFFAOYSA-N 0 0 368.418 3.851 20 5 FHBDRN CCOc1ccc2c(c1)CCN(C(=O)Nc1cc([N+](=O)[O-])ccc1OC)C2 ZINC000434197616 943218888 /nfs/dbraw/zinc/21/88/88/943218888.db2.gz RUHRWMQFGYHGCC-UHFFFAOYSA-N 0 0 371.393 3.592 20 5 FHBDRN Cc1cc(OCC(=O)NCc2ccc(C(F)(F)F)cc2)ccc1[N+](=O)[O-] ZINC000430125725 943221048 /nfs/dbraw/zinc/22/10/48/943221048.db2.gz MTRSSMINLLSYOD-UHFFFAOYSA-N 0 0 368.311 3.617 20 5 FHBDRN O=C(Nc1ccc([C@@H]2CCOC2)cc1)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000514714201 943242869 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Cc1csc([C@H](NCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C2CC2)n1 ZINC000181617098 943319976 /nfs/dbraw/zinc/31/99/76/943319976.db2.gz AWQPOHPRVSTSFX-OAHLLOKOSA-N 0 0 371.422 3.651 20 5 FHBDRN Cc1c(NC(=O)N[C@H]2CCCSC2)cc(Br)cc1[N+](=O)[O-] ZINC000435322432 943322489 /nfs/dbraw/zinc/32/24/89/943322489.db2.gz CQJMAVXAFCCLEU-JTQLQIEISA-N 0 0 374.260 3.683 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC(OC2CCC2)CC1 ZINC000417075744 943328992 /nfs/dbraw/zinc/32/89/92/943328992.db2.gz MCJXHCFRUHDJJN-UHFFFAOYSA-N 0 0 363.414 3.559 20 5 FHBDRN COc1cc(NCc2cc([N+](=O)[O-])ccc2OC)c(Cl)c(OC)c1 ZINC000417072310 943334757 /nfs/dbraw/zinc/33/47/57/943334757.db2.gz XFLRVHVNWJDTEF-UHFFFAOYSA-N 0 0 352.774 3.886 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccnc(OC(C)C)c1 ZINC001269944630 943346799 /nfs/dbraw/zinc/34/67/99/943346799.db2.gz DVPHCOXSDJJFAO-HNNXBMFYSA-N 0 0 357.410 3.984 20 5 FHBDRN Cc1cnc(COC(=O)c2cc3c(ccnc3Cl)o2)c(C)c1[N+](=O)[O-] ZINC001269436716 943367297 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Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCC1(c2ncccc2C)CC1 ZINC000365879746 943393611 /nfs/dbraw/zinc/39/36/11/943393611.db2.gz KRVLMJOIHWIZKN-UHFFFAOYSA-N 0 0 354.410 3.768 20 5 FHBDRN O=C(NC[C@H]1CCC[C@@H]1C1CC1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000412460065 943399670 /nfs/dbraw/zinc/39/96/70/943399670.db2.gz GKZRUMMRBCNYGD-QZTJIDSGSA-N 0 0 371.481 3.754 20 5 FHBDRN CC(C)[N@H+](C)Cc1ccccc1CNc1ccc([N+](=O)[O-])c(C(=O)[O-])c1 ZINC000514939157 943407202 /nfs/dbraw/zinc/40/72/02/943407202.db2.gz KNUFWOCXBOXVCK-UHFFFAOYSA-N 0 0 357.410 3.745 20 5 FHBDRN O=[N+]([O-])c1cc(C[S@](=O)Cc2sccc2Cl)c2c(c1)COCO2 ZINC000417183013 943407437 /nfs/dbraw/zinc/40/74/37/943407437.db2.gz AJDSBSTWWUCHLY-QHCPKHFHSA-N 0 0 373.839 3.625 20 5 FHBDRN Cc1cccc(O[C@H]2CCCC[C@@H]2NC(=O)c2cc([N+](=O)[O-])cnc2C)c1 ZINC000435458376 943423508 /nfs/dbraw/zinc/42/35/08/943423508.db2.gz PAQWDJQTAKIDOB-OALUTQOASA-N 0 0 369.421 3.727 20 5 FHBDRN Cc1cccc(O[C@@H]2CCCC[C@@H]2NC(=O)c2cc([N+](=O)[O-])cnc2C)c1 ZINC000435458378 943423646 /nfs/dbraw/zinc/42/36/46/943423646.db2.gz PAQWDJQTAKIDOB-RBUKOAKNSA-N 0 0 369.421 3.727 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(-c2nc([C@@H](OC)c3ccc(F)cc3)no2)c1 ZINC000514971089 943424511 /nfs/dbraw/zinc/42/45/11/943424511.db2.gz VGQWMWODGJXPOU-INIZCTEOSA-N 0 0 373.340 3.918 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1OC(=O)[C@@H]1CC(=O)N(c2ccccc2Cl)C1 ZINC000760018428 943431390 /nfs/dbraw/zinc/43/13/90/943431390.db2.gz QLWBGBRPXYXQNJ-GFCCVEGCSA-N 0 0 374.780 3.515 20 5 FHBDRN Cc1cc(C)n(Cc2ccc(C(=O)Oc3c(C)cccc3[N+](=O)[O-])cc2)n1 ZINC000760018449 943434101 /nfs/dbraw/zinc/43/41/01/943434101.db2.gz QNDIKDVEGCBFON-UHFFFAOYSA-N 0 0 365.389 3.984 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)OCCc2ccsc2)cc1SC ZINC000728770646 943440134 /nfs/dbraw/zinc/44/01/34/943440134.db2.gz QDGDGYKHAKRDOQ-UHFFFAOYSA-N 0 0 353.421 3.786 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)[C@H]1Cc2cc(Cl)ccc2O1 ZINC000503962936 943440764 /nfs/dbraw/zinc/44/07/64/943440764.db2.gz RNLJCADEKGGYRJ-GOSISDBHSA-N 0 0 374.824 3.989 20 5 FHBDRN COc1ccc(NC(=O)N(C)Cc2cc(F)cc(F)c2)cc1[N+](=O)[O-] ZINC000434211798 943444879 /nfs/dbraw/zinc/44/48/79/943444879.db2.gz NSIQLBKDGWFBKL-UHFFFAOYSA-N 0 0 351.309 3.546 20 5 FHBDRN Cc1cc2sc(NC(=O)NCc3cccc([N+](=O)[O-])c3)nc2cc1F ZINC000515031532 943462678 /nfs/dbraw/zinc/46/26/78/943462678.db2.gz YYCGCYWCWQVCTN-UHFFFAOYSA-N 0 0 360.370 3.974 20 5 FHBDRN COc1cccc(N2CC=C(c3ccc4c(c3)OCCO4)CC2)c1[N+](=O)[O-] ZINC000505704571 943473145 /nfs/dbraw/zinc/47/31/45/943473145.db2.gz DXIPHXKHTITKHB-UHFFFAOYSA-N 0 0 368.389 3.668 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)N1CCCc2c(OC(F)F)cccc21 ZINC000515085657 943493235 /nfs/dbraw/zinc/49/32/35/943493235.db2.gz ZJISLYBVLJBMRR-UHFFFAOYSA-N 0 0 362.332 3.718 20 5 FHBDRN O=C([C@@H]1CC[C@H](Nc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1)N1CCCC1 ZINC000435582550 943501253 /nfs/dbraw/zinc/50/12/53/943501253.db2.gz DXMIGALKDLOIIA-YPMHNXCESA-N 0 0 371.359 3.817 20 5 FHBDRN CC(C)c1nn(C)cc1NC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000431935607 943505641 /nfs/dbraw/zinc/50/56/41/943505641.db2.gz GDEGVHFOZKDCHC-UHFFFAOYSA-N 0 0 369.328 3.697 20 5 FHBDRN COC(=O)c1cnc(N[C@H]2C[C@H](c3cccc(Cl)c3)C2)c([N+](=O)[O-])c1 ZINC000435590187 943507260 /nfs/dbraw/zinc/50/72/60/943507260.db2.gz XQTRSQKPAIXGDF-YEORSEQZSA-N 0 0 361.785 3.788 20 5 FHBDRN CCC(=O)c1ccc(N[C@H]2CC[C@@H](C(=O)N3CCCCC3)C2)c([N+](=O)[O-])c1 ZINC000435593810 943508409 /nfs/dbraw/zinc/50/84/09/943508409.db2.gz SVNYXTAIWBUFIS-CVEARBPZSA-N 0 0 373.453 3.781 20 5 FHBDRN O=[N+]([O-])c1ccccc1CN1CCO[C@H](c2ccc(F)c(Cl)c2)C1 ZINC000066845484 943509853 /nfs/dbraw/zinc/50/98/53/943509853.db2.gz UNTNJFHDXXNFFD-KRWDZBQOSA-N 0 0 350.777 3.961 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H]1c2ccccc2CC[C@H]1C(C)C ZINC001267836164 943510278 /nfs/dbraw/zinc/51/02/78/943510278.db2.gz KKIBKSIULXKSPC-LPHOPBHVSA-N 0 0 353.422 3.988 20 5 FHBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc(Cl)nc1 ZINC000103744470 943518254 /nfs/dbraw/zinc/51/82/54/943518254.db2.gz NCURMXSGAJNUKW-MRVPVSSYSA-N 0 0 356.165 3.703 20 5 FHBDRN O=C(NCc1nc(C2CCCCC2)no1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000417335020 943523383 /nfs/dbraw/zinc/52/33/83/943523383.db2.gz UUZALVUFDFESLR-UHFFFAOYSA-N 0 0 364.789 3.609 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)NCCc2ccc3[nH]ccc3c2)c1 ZINC000515147831 943524072 /nfs/dbraw/zinc/52/40/72/943524072.db2.gz ZZEKUXHAHMRRLD-UHFFFAOYSA-N 0 0 367.405 3.512 20 5 FHBDRN CCN(Cc1c([N+](=O)[O-])ncn1C)C(c1ccccc1)c1ccccc1 ZINC000584754793 943536757 /nfs/dbraw/zinc/53/67/57/943536757.db2.gz DEHDURFVKYSMSC-UHFFFAOYSA-N 0 0 350.422 3.940 20 5 FHBDRN CC(C)c1noc(CCCNc2cc(C(F)(F)F)ncc2[N+](=O)[O-])n1 ZINC000436307186 943539392 /nfs/dbraw/zinc/53/93/92/943539392.db2.gz JWYZPFQYHBRUMJ-UHFFFAOYSA-N 0 0 359.308 3.560 20 5 FHBDRN COC(=O)c1cc(NC(=O)c2cc3cc(F)ccc3o2)c(C)c([N+](=O)[O-])c1 ZINC000515184422 943540372 /nfs/dbraw/zinc/54/03/72/943540372.db2.gz NRAAHPPQMVTSIE-UHFFFAOYSA-N 0 0 372.308 3.827 20 5 FHBDRN CCc1ccc(C(=O)N2CC[C@H](COc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000504187811 943540574 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20 5 FHBDRN Cc1ccc(NC(=O)c2ccc(N[C@H]3CC[C@H](O)CC3)c([N+](=O)[O-])c2)cc1 ZINC000511628737 943622682 /nfs/dbraw/zinc/62/26/82/943622682.db2.gz UOFZLGWDSWWFFP-JCNLHEQBSA-N 0 0 369.421 3.871 20 5 FHBDRN COc1ccc([C@@H](C)OC(=O)c2ccc(N)c([N+](=O)[O-])c2)cc1Cl ZINC000728776380 943630143 /nfs/dbraw/zinc/63/01/43/943630143.db2.gz POMSZOVRIMAHRN-SECBINFHSA-N 0 0 350.758 3.757 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)[C@H]1CCCCO1 ZINC000504579041 943691292 /nfs/dbraw/zinc/69/12/92/943691292.db2.gz VEKRIMNZMCGEME-IUODEOHRSA-N 0 0 352.456 3.784 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1OCC(=O)NC[C@H](c1ccccc1)C(C)C ZINC000053312197 943692009 /nfs/dbraw/zinc/69/20/09/943692009.db2.gz UBACRNLQKLFZQR-KRWDZBQOSA-N 0 0 372.421 3.538 20 5 FHBDRN COc1cc(C(=O)N[C@@](C)(c2ccccc2)C(F)(F)F)ccc1[N+](=O)[O-] ZINC000504586517 943698277 /nfs/dbraw/zinc/69/82/77/943698277.db2.gz UVKDFEZGTUKWFA-INIZCTEOSA-N 0 0 368.311 3.811 20 5 FHBDRN COc1cc(C(=O)NC(CC(C)C)CC(C)C)c([N+](=O)[O-])cc1OC ZINC000504625369 943711636 /nfs/dbraw/zinc/71/16/36/943711636.db2.gz CWPRPQUKZWRPGM-UHFFFAOYSA-N 0 0 352.431 3.803 20 5 FHBDRN O=[N+]([O-])c1cc(-c2nc(Cc3ccc(F)cc3)no2)ccc1NC1CC1 ZINC000504644312 943728450 /nfs/dbraw/zinc/72/84/50/943728450.db2.gz LZWZNWSFJGXEAO-UHFFFAOYSA-N 0 0 354.341 3.949 20 5 FHBDRN Cc1ccc(OC[C@@H](O)COc2cc(C)c([N+](=O)[O-])cc2Cl)cc1 ZINC000504672845 943738886 /nfs/dbraw/zinc/73/88/86/943738886.db2.gz FXJOPOWVRZRUKH-CYBMUJFWSA-N 0 0 351.786 3.684 20 5 FHBDRN C[C@@H](C(=O)[O-])[C@H](C)[NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000417618617 943754377 /nfs/dbraw/zinc/75/43/77/943754377.db2.gz XYGJNUZEHPTJEZ-NEPJUHHUSA-N 0 0 362.357 3.725 20 5 FHBDRN Cc1cnn(-c2ccc(NC(=O)[C@H](C)c3cccc([N+](=O)[O-])c3)cc2F)c1 ZINC000516840324 943761508 /nfs/dbraw/zinc/76/15/08/943761508.db2.gz XDSBPMGDEZAHBI-CYBMUJFWSA-N 0 0 368.368 3.970 20 5 FHBDRN CN(c1ccccc1)c1ccc(C[NH2+]CC2(C(=O)[O-])CCC2)cc1[N+](=O)[O-] ZINC000417613032 943761972 /nfs/dbraw/zinc/76/19/72/943761972.db2.gz CEJOJZLYELJBRK-UHFFFAOYSA-N 0 0 369.421 3.707 20 5 FHBDRN CCOC[C@@H]1CCCN(Cc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000425409487 943762352 /nfs/dbraw/zinc/76/23/52/943762352.db2.gz WDVJVHXBTQPKSE-GFCCVEGCSA-N 0 0 357.248 3.606 20 5 FHBDRN Cc1cc(C(=O)N[C@@H]2C[C@H]2c2cc(F)c(F)c(F)c2)ccc1[N+](=O)[O-] ZINC000437379771 943764056 /nfs/dbraw/zinc/76/40/56/943764056.db2.gz IOSWMJSHMKBVMQ-SMDDNHRTSA-N 0 0 350.296 3.606 20 5 FHBDRN CC[C@H](CSc1ccccc1)NC(=O)c1cc(F)cc([N+](=O)[O-])c1N ZINC000504717977 943767746 /nfs/dbraw/zinc/76/77/46/943767746.db2.gz WVYQKDNJEZYOMY-GFCCVEGCSA-N 0 0 363.414 3.617 20 5 FHBDRN COC(=O)c1ccc(NC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)cc1 ZINC000435816241 943772376 /nfs/dbraw/zinc/77/23/76/943772376.db2.gz ISTCVKZECGTYNR-UHFFFAOYSA-N 0 0 372.380 3.720 20 5 FHBDRN CC(C)(C)CC[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1OC(F)F)C(=O)[O-] ZINC000417635954 943773938 /nfs/dbraw/zinc/77/39/38/943773938.db2.gz KOUVRZXCYDEPGI-LBPRGKRZSA-N 0 0 360.357 3.565 20 5 FHBDRN O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)N1CCc2c(Cl)cccc2C1 ZINC000515326951 943790858 /nfs/dbraw/zinc/79/08/58/943790858.db2.gz WXJOBPHODKLPFN-UHFFFAOYSA-N 0 0 366.751 3.654 20 5 FHBDRN C[C@@H]([C@H]([NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C(=O)[O-])C1CC1 ZINC000417642682 943790827 /nfs/dbraw/zinc/79/08/27/943790827.db2.gz WPSYZVBKFVEIOC-DIFFPNOSSA-N 0 0 360.435 3.912 20 5 FHBDRN CCOc1ccc(C(=O)N[C@H]2C[C@H](c3cccc(F)c3)C2)cc1[N+](=O)[O-] ZINC000437421579 943793176 /nfs/dbraw/zinc/79/31/76/943793176.db2.gz OEOWBNKZKJWLNP-KOMQPUFPSA-N 0 0 358.369 3.809 20 5 FHBDRN O=C(N[C@H]1C[C@H](c2ccccc2F)C1)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000437423917 943795874 /nfs/dbraw/zinc/79/58/74/943795874.db2.gz CNLUSYSNZRLMPO-HAQNSBGRSA-N 0 0 353.353 3.891 20 5 FHBDRN CC(C)(C)c1ccc(NC(=O)CNC(=O)C2CCCCC2)cc1[N+](=O)[O-] ZINC000515316992 943797941 /nfs/dbraw/zinc/79/79/41/943797941.db2.gz GRGKIZMSULTKOI-UHFFFAOYSA-N 0 0 361.442 3.527 20 5 FHBDRN O=C(c1ccc(-c2csnn2)cc1)N1CCCc2ccc([N+](=O)[O-])cc21 ZINC001125911400 943809691 /nfs/dbraw/zinc/80/96/91/943809691.db2.gz OFLVAUNMRXXFFJ-UHFFFAOYSA-N 0 0 366.402 3.706 20 5 FHBDRN COC(=O)c1cc(NC(=O)c2ccc(OC)c(C3CC3)c2)cc([N+](=O)[O-])c1 ZINC000435861194 943813677 /nfs/dbraw/zinc/81/36/77/943813677.db2.gz IGJVXWCRBSTRAF-UHFFFAOYSA-N 0 0 370.361 3.520 20 5 FHBDRN COc1cccc(C(=O)Nc2cccc(-c3ncc(C)o3)c2)c1[N+](=O)[O-] ZINC000435865905 943820985 /nfs/dbraw/zinc/82/09/85/943820985.db2.gz DRZFUBVRVNTDCV-UHFFFAOYSA-N 0 0 353.334 3.819 20 5 FHBDRN Cc1ccc(C(=O)N(C)C)cc1OCc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000105393736 943821751 /nfs/dbraw/zinc/82/17/51/943821751.db2.gz CJEVBGZVYSQJHU-UHFFFAOYSA-N 0 0 372.421 3.971 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)NC[C@H]1CCC[C@H](C(F)(F)F)C1 ZINC000437460718 943830124 /nfs/dbraw/zinc/83/01/24/943830124.db2.gz HXLDQVAGJBERDO-STQMWFEESA-N 0 0 359.348 3.763 20 5 FHBDRN COc1cccc(C(=O)N[C@@H]2CC(C)(C)Oc3cc(F)ccc32)c1[N+](=O)[O-] ZINC000435906889 943837344 /nfs/dbraw/zinc/83/73/44/943837344.db2.gz IENSFNKINZKPOB-CQSZACIVSA-N 0 0 374.368 3.775 20 5 FHBDRN COCc1cc(NCCc2cccc([N+](=O)[O-])c2)c2cc(F)ccc2n1 ZINC000584872848 943839246 /nfs/dbraw/zinc/83/92/46/943839246.db2.gz YBQFJSJFRRIDRO-UHFFFAOYSA-N 0 0 355.369 3.505 20 5 FHBDRN CCOc1ccc([C@H](C)Nc2ccc(COCCO)cc2)cc1[N+](=O)[O-] ZINC000424316554 943839941 /nfs/dbraw/zinc/83/99/41/943839941.db2.gz NCGKIVIKXZWTAR-AWEZNQCLSA-N 0 0 360.410 3.676 20 5 FHBDRN Cc1ccc(NC(=O)NCCc2ccc(OC(F)F)cc2)cc1[N+](=O)[O-] ZINC000515385274 943845590 /nfs/dbraw/zinc/84/55/90/943845590.db2.gz HQBXTSBZXFVIDR-UHFFFAOYSA-N 0 0 365.336 3.869 20 5 FHBDRN CCCOc1cc(NC(=O)[C@]2(C)C[C@H]2F)c([N+](=O)[O-])cc1OCCC ZINC000425414357 943847881 /nfs/dbraw/zinc/84/78/81/943847881.db2.gz HWSOJWPDIDANNF-NVXWUHKLSA-N 0 0 354.378 3.859 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1CN1CCO[C@@H](c2ccco2)C1 ZINC000425419178 943864401 /nfs/dbraw/zinc/86/44/01/943864401.db2.gz JLSHTMSUECGICH-OAHLLOKOSA-N 0 0 367.199 3.524 20 5 FHBDRN C[C@H](NC(=O)N1CC2(CCC2)[C@H]1C1CCOCC1)c1cccc([N+](=O)[O-])c1 ZINC000425420397 943866790 /nfs/dbraw/zinc/86/67/90/943866790.db2.gz SCUZDQKQPZZBHL-KBXCAEBGSA-N 0 0 373.453 3.647 20 5 FHBDRN CC(C)COCCCNC(=O)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000435939277 943871781 /nfs/dbraw/zinc/87/17/81/943871781.db2.gz GDBMKDXJVVUYHN-UHFFFAOYSA-N 0 0 370.424 3.613 20 5 FHBDRN CSc1ccc(CCNC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)cc1 ZINC000437515219 943876293 /nfs/dbraw/zinc/87/62/93/943876293.db2.gz LPKHYUSLDKEECJ-UHFFFAOYSA-N 0 0 355.419 3.771 20 5 FHBDRN O=C(CCc1cccc(OC(F)F)c1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000425424735 943886719 /nfs/dbraw/zinc/88/67/19/943886719.db2.gz NQPLXIIZRJGQNC-UHFFFAOYSA-N 0 0 362.332 3.718 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])N[C@@H]1C[C@H]1c1cccc2ccccc21 ZINC000435972848 943896130 /nfs/dbraw/zinc/89/61/30/943896130.db2.gz RHZYJPNDTHEBQR-PKOBYXMFSA-N 0 0 361.401 3.832 20 5 FHBDRN COc1ccc([C@@H]2CCN(C(=O)CSc3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000504898203 943896183 /nfs/dbraw/zinc/89/61/83/943896183.db2.gz QJHWVYSJYYVQAA-OAHLLOKOSA-N 0 0 372.446 3.712 20 5 FHBDRN COc1ccc(CN(C(=O)COc2ccc([N+](=O)[O-])cc2)C(C)(C)C)cc1 ZINC000516995799 943899633 /nfs/dbraw/zinc/89/96/33/943899633.db2.gz GYAGLIIVSUNOIN-UHFFFAOYSA-N 0 0 372.421 3.810 20 5 FHBDRN CCn1c(-c2cccc([N+](=O)[O-])c2)nnc1N(C)Cc1ccccc1C ZINC000516982550 943903480 /nfs/dbraw/zinc/90/34/80/943903480.db2.gz JUOMDIFJTYGNEX-UHFFFAOYSA-N 0 0 351.410 3.818 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])c2ncccc12)c1ccncc1C(F)(F)F ZINC000517008780 943906308 /nfs/dbraw/zinc/90/63/08/943906308.db2.gz VWKAXFRXGWQSLI-UHFFFAOYSA-N 0 0 362.267 3.809 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)NCc2cccc3c2CCCN3)cc1[N+](=O)[O-] ZINC000417859806 943912430 /nfs/dbraw/zinc/91/24/30/943912430.db2.gz WZYQLZMFVGKYDX-CQSZACIVSA-N 0 0 368.437 3.822 20 5 FHBDRN CC1(C)CN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)Cc2ccccc21 ZINC000517020618 943921220 /nfs/dbraw/zinc/92/12/20/943921220.db2.gz KXOKJZGSXPHHJF-UHFFFAOYSA-N 0 0 364.405 3.938 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(NC(N)=O)cc1 ZINC000505735577 943921506 /nfs/dbraw/zinc/92/15/06/943921506.db2.gz GBPVEKXFMJBJCQ-UHFFFAOYSA-N 0 0 374.422 3.840 20 5 FHBDRN Cc1cc([C@@H]2NC(=O)N([C@H](C)c3ccc(C)c([N+](=O)[O-])c3)C2=O)ccc1F ZINC000431958276 943928074 /nfs/dbraw/zinc/92/80/74/943928074.db2.gz ZEJJVAXPMAGYBC-PXAZEXFGSA-N 0 0 371.368 3.705 20 5 FHBDRN CC1=C[C@@H](C)CN(C(=O)c2ccc(N3CCC[C@@H](C)C3)c([N+](=O)[O-])c2)C1 ZINC000436002702 943935888 /nfs/dbraw/zinc/93/58/88/943935888.db2.gz RAMDHTTYBQDMSB-HUUCEWRRSA-N 0 0 357.454 3.869 20 5 FHBDRN COC[C@H](C)Nc1ccccc1NC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000437593423 943936496 /nfs/dbraw/zinc/93/64/96/943936496.db2.gz TWHRRFZUVZYDGG-LBPRGKRZSA-N 0 0 368.393 3.775 20 5 FHBDRN CCOC(=O)c1cc(-c2nc(-c3ccc(C)cc3)no2)cc([N+](=O)[O-])c1 ZINC000504962039 943938695 /nfs/dbraw/zinc/93/86/95/943938695.db2.gz IMCOCSUPHACDBH-UHFFFAOYSA-N 0 0 353.334 3.797 20 5 FHBDRN Cc1c(-c2nc(-c3cccc([N+](=O)[O-])c3)no2)nnn1-c1ccc(C)cc1 ZINC000504968977 943944396 /nfs/dbraw/zinc/94/43/96/943944396.db2.gz KZIGXIOVHXRSMW-UHFFFAOYSA-N 0 0 362.349 3.509 20 5 FHBDRN CCc1ccc(-c2noc(-c3cc(C(=O)OC)cc([N+](=O)[O-])c3)n2)cc1 ZINC000504976030 943947595 /nfs/dbraw/zinc/94/75/95/943947595.db2.gz ZXGZYIYYBRGAEQ-UHFFFAOYSA-N 0 0 353.334 3.661 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1)[nH]cc2-c1nc(COc2ccccc2F)no1 ZINC000436017893 943957170 /nfs/dbraw/zinc/95/71/70/943957170.db2.gz QQNFDOBBOXNMBR-UHFFFAOYSA-N 0 0 354.297 3.844 20 5 FHBDRN C[C@@H](C(=O)N1CCC[C@]2(C1)OCc1ccccc12)c1cccc([N+](=O)[O-])c1 ZINC000517065134 943965506 /nfs/dbraw/zinc/96/55/06/943965506.db2.gz IZVYLVGSTMVTDE-QVKFZJNVSA-N 0 0 366.417 3.746 20 5 FHBDRN Cc1ccc(Cn2cc([N+](=O)[O-])cc(Cl)c2=O)cc1Br ZINC000437608505 943966153 /nfs/dbraw/zinc/96/61/53/943966153.db2.gz XPMKFQPMSVIBSP-UHFFFAOYSA-N 0 0 357.591 3.529 20 5 FHBDRN COc1cccc(C(=O)N[C@](C)(c2ccccc2)C(F)(F)F)c1[N+](=O)[O-] ZINC000436042166 943966286 /nfs/dbraw/zinc/96/62/86/943966286.db2.gz FPYBZOHTXOCTFF-MRXNPFEDSA-N 0 0 368.311 3.811 20 5 FHBDRN COc1cccc(C(=O)Nc2cc(F)c(OC(C)C)c(F)c2)c1[N+](=O)[O-] ZINC000436042659 943966961 /nfs/dbraw/zinc/96/69/61/943966961.db2.gz RSAHLVAKTQYSLQ-UHFFFAOYSA-N 0 0 366.320 3.921 20 5 FHBDRN Cc1[nH]c2c(cc(C)cc2CNC(=O)CNc2ccccc2[N+](=O)[O-])c1C ZINC000500030946 943974120 /nfs/dbraw/zinc/97/41/20/943974120.db2.gz FGOKVCPVYNUJMA-UHFFFAOYSA-N 0 0 366.421 3.730 20 5 FHBDRN O=C(c1n[nH]c2ccc([N+](=O)[O-])cc21)N1CCCC[C@H]1c1ccc(F)cc1 ZINC000500033019 943978511 /nfs/dbraw/zinc/97/85/11/943978511.db2.gz XFOFNODMIKOFGN-KRWDZBQOSA-N 0 0 368.368 3.978 20 5 FHBDRN Cc1ccccc1OCCNC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000436070508 943990722 /nfs/dbraw/zinc/99/07/22/943990722.db2.gz ZOYXVOJUBBLKBZ-UHFFFAOYSA-N 0 0 372.424 3.799 20 5 FHBDRN CC(=O)Nc1ccc(/C=C\c2nc(-c3cccc([N+](=O)[O-])c3)no2)cc1 ZINC000505035997 943991545 /nfs/dbraw/zinc/99/15/45/943991545.db2.gz OWFXFAMUKNHVES-YFHOEESVSA-N 0 0 350.334 3.774 20 5 FHBDRN CC(C)Oc1ccc(C(=O)Nc2ccc([N+](=O)[O-])c3ncccc23)nc1 ZINC000436053852 943996305 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O=C(c1ccc(NC2CC2)nc1)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000515597858 944035270 /nfs/dbraw/zinc/03/52/70/944035270.db2.gz LLYQNSVCMULJHU-MRXNPFEDSA-N 0 0 366.421 3.584 20 5 FHBDRN C[C@H](c1ccc(F)c(F)c1)N(C)C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000126558645 944038297 /nfs/dbraw/zinc/03/82/97/944038297.db2.gz ZOHDLCOCEGKBAU-GFCCVEGCSA-N 0 0 363.364 3.818 20 5 FHBDRN O=C(Nc1cc2c(cc1[N+](=O)[O-])OCCCO2)c1cncc2ccccc21 ZINC000515603948 944040281 /nfs/dbraw/zinc/04/02/81/944040281.db2.gz UUDYFVIIBFCXGK-UHFFFAOYSA-N 0 0 365.345 3.557 20 5 FHBDRN COc1ccc(CNc2ncnc3sc4c(c32)CCC4)cc1[N+](=O)[O-] ZINC000515590836 944043919 /nfs/dbraw/zinc/04/39/19/944043919.db2.gz XWZOZVIETWJWMS-UHFFFAOYSA-N 0 0 356.407 3.709 20 5 FHBDRN Cc1cc(NC[C@H](C)Oc2ccccc2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000505764164 944055078 /nfs/dbraw/zinc/05/50/78/944055078.db2.gz VIDUNEIZYFBYRM-HNNXBMFYSA-N 0 0 364.405 3.662 20 5 FHBDRN CC[C@H]1CCN(C(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)[C@H]1C ZINC001269694688 944057008 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3.931 20 5 FHBDRN CC(C)CN(C)C(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 ZINC000053460786 944071967 /nfs/dbraw/zinc/07/19/67/944071967.db2.gz WXBBSBHQJDMZBY-AWEZNQCLSA-N 0 0 356.426 3.891 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)c2cccc(Cn3ccnc3)c2)cc1[N+](=O)[O-] ZINC000500085658 944072852 /nfs/dbraw/zinc/07/28/52/944072852.db2.gz HFJLKPQYOCFYKB-HNNXBMFYSA-N 0 0 364.405 3.639 20 5 FHBDRN CC(=O)[C@@H](Cc1ccc(F)c(F)c1F)Sc1ncccc1[N+](=O)[O-] ZINC000436184483 944077724 /nfs/dbraw/zinc/07/77/24/944077724.db2.gz CJQKBEYALKKTQF-GFCCVEGCSA-N 0 0 356.325 3.700 20 5 FHBDRN COc1c(C)cc(CN(C)CC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1C ZINC000110295786 944079073 /nfs/dbraw/zinc/07/90/73/944079073.db2.gz ATQBDTDLBKYSJT-UHFFFAOYSA-N 0 0 371.437 3.599 20 5 FHBDRN CC[C@H](C)[C@@H](NC(=O)CSc1ccc([N+](=O)[O-])cc1)C(F)(F)F ZINC000436185143 944079453 /nfs/dbraw/zinc/07/94/53/944079453.db2.gz VYPULCZLBIYZED-TVQRCGJNSA-N 0 0 350.362 3.780 20 5 FHBDRN COCc1cccc(OCC2(Cn3cc([N+](=O)[O-])c(C4CC4)n3)CC2)c1 ZINC000436182306 944093100 /nfs/dbraw/zinc/09/31/00/944093100.db2.gz GMWICOHNBIJNDO-UHFFFAOYSA-N 0 0 357.410 3.674 20 5 FHBDRN CC[C@@H](C)[C@H](NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)C(F)(F)F ZINC000436182607 944093361 /nfs/dbraw/zinc/09/33/61/944093361.db2.gz HBNCSZRYLBPOKH-HQJQHLMTSA-N 0 0 370.274 3.903 20 5 FHBDRN Cc1ccc(C(=O)N2CCO[C@H](c3ccccc3Cl)C2)cc1[N+](=O)[O-] ZINC000505149195 944094026 /nfs/dbraw/zinc/09/40/26/944094026.db2.gz RAWMRLXYYCDADB-KRWDZBQOSA-N 0 0 360.797 3.770 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CCN(C)C[C@@H]1c1ccccc1 ZINC000517214668 944095580 /nfs/dbraw/zinc/09/55/80/944095580.db2.gz AMFOFAWJVRNIBM-GOSISDBHSA-N 0 0 368.437 3.732 20 5 FHBDRN Cn1cnc([N+](=O)[O-])c1-c1noc(-c2cc(-c3ccc(Cl)cc3)c[nH]2)n1 ZINC000517202104 944100074 /nfs/dbraw/zinc/10/00/74/944100074.db2.gz RJXVQYIIOGPEBB-UHFFFAOYSA-N 0 0 370.756 3.694 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1C[C@@H]2[C@@H]3C=C[C@@H](C3)[C@]2(C)C1 ZINC000452594214 944106266 /nfs/dbraw/zinc/10/62/66/944106266.db2.gz 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ZINC000072733685 944144475 /nfs/dbraw/zinc/14/44/75/944144475.db2.gz CQVLXANYIQRMFL-UHFFFAOYSA-N 0 0 360.317 3.734 20 5 FHBDRN Cc1c(Cl)cc(S(=O)(=O)N2CCC[C@H]2C2CCCC2)cc1[N+](=O)[O-] ZINC000515723745 944155027 /nfs/dbraw/zinc/15/50/27/944155027.db2.gz YGMJOHSAJMRHCA-HNNXBMFYSA-N 0 0 372.874 3.900 20 5 FHBDRN COc1ccc(OCCNc2cc(C(F)(F)F)ncc2[N+](=O)[O-])cc1 ZINC000436262367 944155053 /nfs/dbraw/zinc/15/50/53/944155053.db2.gz DWDGANKQMWNSQW-UHFFFAOYSA-N 0 0 357.288 3.508 20 5 FHBDRN COc1ccc(CNC(=O)[C@@H](C)c2ccc(Cl)s2)cc1[N+](=O)[O-] ZINC000425916921 944155147 /nfs/dbraw/zinc/15/51/47/944155147.db2.gz LBAOMZSVVLBUNU-VIFPVBQESA-N 0 0 354.815 3.738 20 5 FHBDRN O=C(CCC1CCCCC1)N1CCN(Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000515743424 944162823 /nfs/dbraw/zinc/16/28/23/944162823.db2.gz CYTGDXDOIQIIRA-UHFFFAOYSA-N 0 0 359.470 3.600 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)F)cc1Nc1ccc(N2CCCC2)nc1 ZINC000436269245 944167783 /nfs/dbraw/zinc/16/77/83/944167783.db2.gz JGNJVXBGQNQPKX-UHFFFAOYSA-N 0 0 353.304 3.747 20 5 FHBDRN COc1cccc(CN(Cc2c(F)cccc2[N+](=O)[O-])C[C@@H]2CCCO2)c1 ZINC000505785049 944170096 /nfs/dbraw/zinc/17/00/96/944170096.db2.gz SDAAZKSBFJVHLZ-KRWDZBQOSA-N 0 0 374.412 3.924 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)F)cc1NCc1ccnc(N2CCCC2)c1 ZINC000436276886 944173842 /nfs/dbraw/zinc/17/38/42/944173842.db2.gz VIFWJWSRLBQAGQ-UHFFFAOYSA-N 0 0 367.331 3.616 20 5 FHBDRN COc1ccc([C@@H](C)N(C)C(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)cc1 ZINC000515748692 944176439 /nfs/dbraw/zinc/17/64/39/944176439.db2.gz JULOGHABSTWTCU-GFCCVEGCSA-N 0 0 353.378 3.918 20 5 FHBDRN O=C1c2ccccc2C(=O)N1CCCCSCc1ccccc1[N+](=O)[O-] ZINC000517284495 944179679 /nfs/dbraw/zinc/17/96/79/944179679.db2.gz KPKWKXGIGDAOGC-UHFFFAOYSA-N 0 0 370.430 3.904 20 5 FHBDRN Cc1ccc(C[C@H]2CCCN2S(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000500150497 944179795 /nfs/dbraw/zinc/17/97/95/944179795.db2.gz VDVRKBXNEGBMTI-QGZVFWFLSA-N 0 0 374.462 3.607 20 5 FHBDRN Cc1ccccc1[C@@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1C ZINC000515756809 944185606 /nfs/dbraw/zinc/18/56/06/944185606.db2.gz DIFVVULIBGAUJN-KRWDZBQOSA-N 0 0 360.435 3.737 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)F)cc1NCc1ccn(-c2ccccc2)n1 ZINC000436305643 944188685 /nfs/dbraw/zinc/18/86/85/944188685.db2.gz ISSZMPODDRXYQV-UHFFFAOYSA-N 0 0 363.299 3.806 20 5 FHBDRN COc1ccc(Nc2cc(C(F)(F)F)ncc2[N+](=O)[O-])cc1NC(C)=O ZINC000436307524 944190450 /nfs/dbraw/zinc/19/04/50/944190450.db2.gz KUKMIUUAEFJARM-UHFFFAOYSA-N 0 0 370.287 3.719 20 5 FHBDRN C[C@@H]1CN(c2cc(C(F)(F)F)ncc2[N+](=O)[O-])C[C@@H](c2ccccc2)O1 ZINC000436321047 944199165 /nfs/dbraw/zinc/19/91/65/944199165.db2.gz WGSSWAKKLUOKKN-ABAIWWIYSA-N 0 0 367.327 3.975 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)F)cc1NCc1ccc(N2CCCC2)nc1 ZINC000436309897 944206486 /nfs/dbraw/zinc/20/64/86/944206486.db2.gz QDQGTPBESFCGTH-UHFFFAOYSA-N 0 0 367.331 3.616 20 5 FHBDRN CN(CCOc1ccc(Br)cc1)Cc1csc([N+](=O)[O-])c1 ZINC000515781607 944208090 /nfs/dbraw/zinc/20/80/90/944208090.db2.gz KLPIQEWBSFGFBT-UHFFFAOYSA-N 0 0 371.256 3.930 20 5 FHBDRN O=C(NCCOc1cccc2ccccc21)Nc1cccc([N+](=O)[O-])c1 ZINC000515784780 944211131 /nfs/dbraw/zinc/21/11/31/944211131.db2.gz BXJRYBBUCVDORU-UHFFFAOYSA-N 0 0 351.362 3.949 20 5 FHBDRN CC1(C)CN(c2cc(C(F)(F)F)ncc2[N+](=O)[O-])CC2(CCCC2)O1 ZINC000436335006 944212841 /nfs/dbraw/zinc/21/28/41/944212841.db2.gz GKTPVWNYAALBHQ-UHFFFAOYSA-N 0 0 359.348 3.937 20 5 FHBDRN Cc1csc([C@@H](C)NC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)n1 ZINC000436355128 944223932 /nfs/dbraw/zinc/22/39/32/944223932.db2.gz RGFJXBHDMDBBKV-GFCCVEGCSA-N 0 0 363.442 3.937 20 5 FHBDRN O=C(Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)c1cccc2c1OCO2 ZINC000517328653 944223965 /nfs/dbraw/zinc/22/39/65/944223965.db2.gz OLJBAZKLTBVKFI-UHFFFAOYSA-N 0 0 369.358 3.699 20 5 FHBDRN Cc1csc([C@H](C)NC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)n1 ZINC000436355131 944223974 /nfs/dbraw/zinc/22/39/74/944223974.db2.gz RGFJXBHDMDBBKV-LBPRGKRZSA-N 0 0 363.442 3.937 20 5 FHBDRN Cc1cc(NC(=O)c2ccc(C)cc2C)n(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000105582158 944226897 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C[C@H](C(=O)NCCCCc1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)OCO2 ZINC000584544439 944233345 /nfs/dbraw/zinc/23/33/45/944233345.db2.gz CKFVCLRUEOWVNN-AWEZNQCLSA-N 0 0 370.405 3.566 20 5 FHBDRN CC(C)COc1ccc(CCNC(=O)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000517350985 944236410 /nfs/dbraw/zinc/23/64/10/944236410.db2.gz HSPNBSBCJAFJAY-UHFFFAOYSA-N 0 0 356.422 3.531 20 5 FHBDRN CC(C)Oc1ccccc1[C@@H](C)NC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000517356841 944240291 /nfs/dbraw/zinc/24/02/91/944240291.db2.gz NPUCSIDZCSPGNE-GFCCVEGCSA-N 0 0 368.393 3.749 20 5 FHBDRN Cc1cccnc1/C=C/C(=O)OCc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000759788946 944241106 /nfs/dbraw/zinc/24/11/06/944241106.db2.gz DICZSLXCEKNYSD-VQHVLOKHSA-N 0 0 356.378 3.842 20 5 FHBDRN CC(=O)N1CCC(CNc2cc(C)c(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000549488682 944244419 /nfs/dbraw/zinc/24/44/19/944244419.db2.gz FPCWYOUSMIBWED-UHFFFAOYSA-N 0 0 359.348 3.592 20 5 FHBDRN C[C@H]1CCc2c(sc3ncn(Cc4c(F)cccc4[N+](=O)[O-])c(=O)c32)C1 ZINC000728786892 944245112 /nfs/dbraw/zinc/24/51/12/944245112.db2.gz FJGRLYWZMOSETO-JTQLQIEISA-N 0 0 373.409 3.678 20 5 FHBDRN COc1ccc(NC(=O)N[C@H]2C[C@H](c3cccc(F)c3)C2)cc1[N+](=O)[O-] ZINC000436376587 944245772 /nfs/dbraw/zinc/24/57/72/944245772.db2.gz BYRSMVNVEJSIIG-NNUKFRKNSA-N 0 0 359.357 3.810 20 5 FHBDRN COc1ccc(NC(=O)N[C@@H]2C[C@H]2c2cccc(Cl)c2)cc1[N+](=O)[O-] ZINC000436388684 944257385 /nfs/dbraw/zinc/25/73/85/944257385.db2.gz LPAVKEUFNPECQG-UONOGXRCSA-N 0 0 361.785 3.934 20 5 FHBDRN C[C@@H]1CC[C@@H](C)N(C(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C1 ZINC000426261178 944259598 /nfs/dbraw/zinc/25/95/98/944259598.db2.gz OSCVCOZMJWVKDN-GHMZBOCLSA-N 0 0 359.348 3.944 20 5 FHBDRN CC(C)(C)c1ccc(C2CCN(C(=O)c3c[nH]nc3[N+](=O)[O-])CC2)cc1 ZINC000518315476 944261429 /nfs/dbraw/zinc/26/14/29/944261429.db2.gz PXBCRXXQPLHRDN-UHFFFAOYSA-N 0 0 356.426 3.635 20 5 FHBDRN CCOc1c(Cl)cc(C(=O)Nc2ccc([N+](=O)[O-])c(C)n2)cc1OC ZINC000133859405 944261770 /nfs/dbraw/zinc/26/17/70/944261770.db2.gz KCQZWMPYXALMRT-UHFFFAOYSA-N 0 0 365.773 3.611 20 5 FHBDRN CC(C)COc1cccc(NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)c1 ZINC000515862793 944267262 /nfs/dbraw/zinc/26/72/62/944267262.db2.gz LGBJGOSGCDOHKV-UHFFFAOYSA-N 0 0 354.366 3.758 20 5 FHBDRN CC(C)c1ccc(C[C@H](C)NC(=O)COc2ccccc2[N+](=O)[O-])cc1 ZINC000500210147 944268100 /nfs/dbraw/zinc/26/81/00/944268100.db2.gz DXKQRYFTIIPJDG-HNNXBMFYSA-N 0 0 356.422 3.844 20 5 FHBDRN CC[C@](C)(NC(=O)CSc1ccc([N+](=O)[O-])cc1)c1nc(C)cs1 ZINC000151299358 944268455 /nfs/dbraw/zinc/26/84/55/944268455.db2.gz NJHVQNIWGZKCRX-INIZCTEOSA-N 0 0 365.480 3.893 20 5 FHBDRN COc1cccc(C[C@H]2CCCN2C(=O)c2cccc([N+](=O)[O-])c2C)c1 ZINC000518325452 944276501 /nfs/dbraw/zinc/27/65/01/944276501.db2.gz WGXADICOVUMEDW-MRXNPFEDSA-N 0 0 354.406 3.759 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)c2ccnc(N3CC[C@H](C)C3)c2)cc1[N+](=O)[O-] ZINC000438026556 944294256 /nfs/dbraw/zinc/29/42/56/944294256.db2.gz GTGRWBYZBOYFTO-DZGCQCFKSA-N 0 0 368.437 3.635 20 5 FHBDRN COc1cc(CSCc2nc(N)c3ccccc3n2)c([N+](=O)[O-])cc1F ZINC000184036889 944305303 /nfs/dbraw/zinc/30/53/03/944305303.db2.gz ICASBBQJRKUGBC-UHFFFAOYSA-N 0 0 374.397 3.701 20 5 FHBDRN C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCCN(Cc2csc([N+](=O)[O-])c2)C1 ZINC000133871800 944314716 /nfs/dbraw/zinc/31/47/16/944314716.db2.gz SQPVYKJCBVAKGR-GXTWGEPZSA-N 0 0 369.487 3.782 20 5 FHBDRN C[C@H]1C[C@H](C)CN(C(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C1 ZINC000426276804 944320824 /nfs/dbraw/zinc/32/08/24/944320824.db2.gz KHKHRFVIJPJADU-QWRGUYRKSA-N 0 0 359.348 3.801 20 5 FHBDRN C[C@H]1CCC[C@@H](c2noc(-c3ccc(-n4cncn4)c([N+](=O)[O-])c3)n2)C1 ZINC000544284964 944322625 /nfs/dbraw/zinc/32/26/25/944322625.db2.gz QACJBAXFRHFNHN-NWDGAFQWSA-N 0 0 354.370 3.519 20 5 FHBDRN O=C(NCCc1cccc2cccnc21)c1c(Cl)cccc1[N+](=O)[O-] ZINC000518372318 944323536 /nfs/dbraw/zinc/32/35/36/944323536.db2.gz OJCCBZLTOTZLKZ-UHFFFAOYSA-N 0 0 355.781 3.769 20 5 FHBDRN CN(CC1(c2ccccc2)CC1)c1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-] ZINC000436461677 944328575 /nfs/dbraw/zinc/32/85/75/944328575.db2.gz ZPYDPAWJSSWNMQ-UHFFFAOYSA-N 0 0 365.433 3.655 20 5 FHBDRN Cc1ccc([C@@H](C)N(C)S(=O)(=O)c2ccc([N+](=O)[O-])cc2C)c(C)c1 ZINC000515924121 944333014 /nfs/dbraw/zinc/33/30/14/944333014.db2.gz SFUAACQVINNFIE-OAHLLOKOSA-N 0 0 362.451 3.902 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCCC(=O)OC(C)(C)C ZINC000506483149 944333768 /nfs/dbraw/zinc/33/37/68/944333768.db2.gz AXTUJUGHMJCFQN-UHFFFAOYSA-N 0 0 368.455 3.559 20 5 FHBDRN C[C@H]1Cc2ccccc2[C@@H]1NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000518402421 944341220 /nfs/dbraw/zinc/34/12/20/944341220.db2.gz NVCYHGYKBAHCHU-VBKZILBWSA-N 0 0 365.433 3.858 20 5 FHBDRN C[C@@H]1Cc2ccccc2[C@H]1NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000518402423 944341496 /nfs/dbraw/zinc/34/14/96/944341496.db2.gz NVCYHGYKBAHCHU-VLIAUNLRSA-N 0 0 365.433 3.858 20 5 FHBDRN CNC(=O)c1ccc(Oc2ccc(Br)cc2F)c([N+](=O)[O-])c1 ZINC000053549215 944343811 /nfs/dbraw/zinc/34/38/11/944343811.db2.gz BBGULLBXZWMDHB-UHFFFAOYSA-N 0 0 369.146 3.648 20 5 FHBDRN C[C@@H]1CCc2[nH]c3ccc(C(=O)N(C)c4ccc([N+](=O)[O-])nc4)cc3c2C1 ZINC001270303848 944344066 /nfs/dbraw/zinc/34/40/66/944344066.db2.gz SFQFROVHAMZAPS-GFCCVEGCSA-N 0 0 364.405 3.873 20 5 FHBDRN Cc1ccc(OC[C@@H](O)COc2cccc(C(F)(F)F)c2)c([N+](=O)[O-])c1 ZINC000550175773 944346567 /nfs/dbraw/zinc/34/65/67/944346567.db2.gz LLXUAPITBLWHEM-ZDUSSCGKSA-N 0 0 371.311 3.741 20 5 FHBDRN Cc1cc(OC[C@@H](O)CO[C@@H]2CCCc3ccccc32)ccc1[N+](=O)[O-] ZINC000550175740 944347013 /nfs/dbraw/zinc/34/70/13/944347013.db2.gz KDJVFTRHIOXRLJ-OXQOHEQNSA-N 0 0 357.406 3.737 20 5 FHBDRN Cc1ccccc1Nc1nc(Cn2c(C)c([N+](=O)[O-])ccc2=O)cs1 ZINC000436473374 944353740 /nfs/dbraw/zinc/35/37/40/944353740.db2.gz HVFMVUKVEWFADB-UHFFFAOYSA-N 0 0 356.407 3.622 20 5 FHBDRN C[C@H](NC(=O)c1c(Cl)cccc1[N+](=O)[O-])[C@H]1Oc2ccccc2[C@@H]1C ZINC000438138950 944363527 /nfs/dbraw/zinc/36/35/27/944363527.db2.gz BUXZAKUNMPHHRB-DINDLPBHSA-N 0 0 360.797 3.931 20 5 FHBDRN C[C@H](NC(=O)CSc1ccc([N+](=O)[O-])cc1)[C@@H]1Oc2ccccc2[C@@H]1C ZINC000438158169 944371131 /nfs/dbraw/zinc/37/11/31/944371131.db2.gz WFHTWARFKUCOHA-WTOJCKNJSA-N 0 0 372.446 3.756 20 5 FHBDRN CN(Cc1ccc(Cl)nc1)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000123561593 944372518 /nfs/dbraw/zinc/37/25/18/944372518.db2.gz NDOXXXIEIZPXDK-UHFFFAOYSA-N 0 0 355.181 3.961 20 5 FHBDRN CC(C)c1ccc(C(=O)Nc2ccn(-c3ccccc3)n2)cc1[N+](=O)[O-] ZINC000439146144 944378294 /nfs/dbraw/zinc/37/82/94/944378294.db2.gz ZKXQDHMHPGQCMP-UHFFFAOYSA-N 0 0 350.378 3.578 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)c1cccc(N2CCCC2=O)c1 ZINC000086625372 944381399 /nfs/dbraw/zinc/38/13/99/944381399.db2.gz SWYJTFXSTUWLBP-UHFFFAOYSA-N 0 0 353.378 3.591 20 5 FHBDRN CC(C)(C)[C@@H](NCn1c2cc([N+](=O)[O-])ccc2oc1=O)c1ccccc1 ZINC000123578286 944384390 /nfs/dbraw/zinc/38/43/90/944384390.db2.gz YIRWXVCUNQQXJN-KRWDZBQOSA-N 0 0 355.394 3.837 20 5 FHBDRN Cc1cc(NC(=O)N[C@H](c2ccccc2)[C@@H]2CCOC2)ccc1[N+](=O)[O-] ZINC000473769007 944386526 /nfs/dbraw/zinc/38/65/26/944386526.db2.gz ZZDYOKHEWRQFGT-CRAIPNDOSA-N 0 0 355.394 3.803 20 5 FHBDRN Cc1cc(NC(=O)N(C)C[C@H]2OCCc3ccccc32)ccc1[N+](=O)[O-] ZINC000473768373 944387817 /nfs/dbraw/zinc/38/78/17/944387817.db2.gz KCWHJRDMSSYXHW-GOSISDBHSA-N 0 0 355.394 3.681 20 5 FHBDRN CC[C@H](Cc1ccccc1)NC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000123626462 944389139 /nfs/dbraw/zinc/38/91/39/944389139.db2.gz YHIMUGIMVKESOK-QGZVFWFLSA-N 0 0 353.422 3.684 20 5 FHBDRN CCOc1c(Cl)cc(-c2noc(-c3ccc([N+](=O)[O-])[nH]3)n2)cc1OC ZINC000545533546 944391351 /nfs/dbraw/zinc/39/13/51/944391351.db2.gz RIACTOYGDQEYEJ-UHFFFAOYSA-N 0 0 364.745 3.701 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)NC[C@H]1CCCO[C@@H]1C(C)C ZINC000439169294 944391658 /nfs/dbraw/zinc/39/16/58/944391658.db2.gz NGLOETPVIFIGCP-MLGOLLRUSA-N 0 0 354.834 3.738 20 5 FHBDRN C[C@@]1(CNC(=O)c2ccc([N+](=O)[O-])cc2Cl)CCOC2(CCC2)C1 ZINC000894674133 944392803 /nfs/dbraw/zinc/39/28/03/944392803.db2.gz VGSMGMKSTULSKQ-MRXNPFEDSA-N 0 0 352.818 3.717 20 5 FHBDRN Cc1ccc(S(=O)(=O)N2CCCC3(CCCCC3)C2)cc1[N+](=O)[O-] ZINC000518441730 944395322 /nfs/dbraw/zinc/39/53/22/944395322.db2.gz IALMADHPCMQIPB-UHFFFAOYSA-N 0 0 352.456 3.638 20 5 FHBDRN CN(CCc1ccccc1)C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000150736346 944398193 /nfs/dbraw/zinc/39/81/93/944398193.db2.gz TWYGPIDEHBWOFB-UHFFFAOYSA-N 0 0 363.211 3.672 20 5 FHBDRN CCCOc1ccc(C(F)(F)F)cc1NC(=O)c1ccc([N+](=O)[O-])[nH]1 ZINC000518461899 944402201 /nfs/dbraw/zinc/40/22/01/944402201.db2.gz GRONJIRPDROCFT-UHFFFAOYSA-N 0 0 357.288 3.983 20 5 FHBDRN COc1ccc(OC)c(CCNc2ccc([N+](=O)[O-])c3cnccc23)c1 ZINC000053582786 944402470 /nfs/dbraw/zinc/40/24/70/944402470.db2.gz HVNQARVOTBXYPZ-UHFFFAOYSA-N 0 0 353.378 3.815 20 5 FHBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)N1CCCc2cc(Cl)cc(F)c21 ZINC000517567071 944406367 /nfs/dbraw/zinc/40/63/67/944406367.db2.gz ZDPDIACIVSWPIE-UHFFFAOYSA-N 0 0 370.789 3.529 20 5 FHBDRN O=C(c1csc(-c2ccc([N+](=O)[O-])cc2)n1)N1Cc2ccccc2C1 ZINC000105976001 944406290 /nfs/dbraw/zinc/40/62/90/944406290.db2.gz LZUHZIZEMSJITN-UHFFFAOYSA-N 0 0 351.387 3.874 20 5 FHBDRN C[C@H](NC(=O)Cc1coc(-c2cccs2)n1)c1cccc([N+](=O)[O-])c1 ZINC000105952482 944410314 /nfs/dbraw/zinc/41/03/14/944410314.db2.gz SWNLIRMPRSLULO-NSHDSACASA-N 0 0 357.391 3.731 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)NC[C@@H]1CCc2ccccc21 ZINC000467217520 944411965 /nfs/dbraw/zinc/41/19/65/944411965.db2.gz NTGCGTJLIPCEBB-ZDUSSCGKSA-N 0 0 359.813 3.777 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1F)N1CCC(F)(c2cccnc2)CC1 ZINC000517596397 944412521 /nfs/dbraw/zinc/41/25/21/944412521.db2.gz RJIVQXBAVVKNSQ-UHFFFAOYSA-N 0 0 362.336 3.622 20 5 FHBDRN O=[N+]([O-])c1cc(NC(=S)Nc2ccc3c(c2)OCCO3)ccc1Cl ZINC000017449276 944412665 /nfs/dbraw/zinc/41/26/65/944412665.db2.gz IRFYVXBAICYWJQ-UHFFFAOYSA-N 0 0 365.798 3.828 20 5 FHBDRN CN(Cc1cccc([N+](=O)[O-])c1)[C@@H]1c2cc(Cl)cc(Cl)c2C[C@H]1O ZINC000518474001 944413702 /nfs/dbraw/zinc/41/37/02/944413702.db2.gz QZVGDWRBCGVSRC-IAGOWNOFSA-N 0 0 367.232 3.992 20 5 FHBDRN CN(Cc1ccc(F)cc1F)c1c(Br)cncc1[N+](=O)[O-] ZINC000500288517 944415886 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FHBDRN Cc1ccc(S(=O)(=O)N2CC[C@H](C)C[C@H]2c2ccco2)cc1[N+](=O)[O-] ZINC000439219583 944434721 /nfs/dbraw/zinc/43/47/21/944434721.db2.gz AROBBZZRAMJAOT-LRDDRELGSA-N 0 0 364.423 3.658 20 5 FHBDRN Cc1ccccc1CN(C(=O)Cc1c(F)cc([N+](=O)[O-])cc1F)C1CC1 ZINC000517612811 944443904 /nfs/dbraw/zinc/44/39/04/944443904.db2.gz BNTHWOYMJRBIQX-UHFFFAOYSA-N 0 0 360.360 3.915 20 5 FHBDRN Cn1ccnc1Sc1ccc(NC(=O)c2csc([N+](=O)[O-])c2)cc1 ZINC000044400980 944447781 /nfs/dbraw/zinc/44/77/81/944447781.db2.gz XWAZHELWWCRSHY-UHFFFAOYSA-N 0 0 360.420 3.793 20 5 FHBDRN Cc1cc(S(=O)(=O)N2CC[C@@H](C)C[C@@H]2c2ccco2)ccc1[N+](=O)[O-] ZINC000439234528 944447882 /nfs/dbraw/zinc/44/78/82/944447882.db2.gz IABLBEVLJGZCQT-MLGOLLRUSA-N 0 0 364.423 3.658 20 5 FHBDRN O=c1c2ccc([N+](=O)[O-])cc2ncn1Cc1cc(Cl)cc2cccnc21 ZINC000505850600 944448029 /nfs/dbraw/zinc/44/80/29/944448029.db2.gz HRYVLSIGJKAAJY-UHFFFAOYSA-N 0 0 366.764 3.555 20 5 FHBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1CC[C@H](C)C[C@@H]1c1ccco1 ZINC000439235698 944448475 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FHBDRN CCN(CCOC)c1cccc(CNc2cc([N+](=O)[O-])c(C)cc2C)n1 ZINC000566651295 944474536 /nfs/dbraw/zinc/47/45/36/944474536.db2.gz GFOSQKJSNSYFQO-UHFFFAOYSA-N 0 0 358.442 3.691 20 5 FHBDRN Cc1ccnc(NC(=O)c2cc([N+](=O)[O-])cc(Br)c2C)c1 ZINC000550220386 944489754 /nfs/dbraw/zinc/48/97/54/944489754.db2.gz QSXKCGCLIOGFGS-UHFFFAOYSA-N 0 0 350.172 3.621 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)NC[C@H]1CCCc2ccccc21 ZINC000046938094 944495011 /nfs/dbraw/zinc/49/50/11/944495011.db2.gz ZPWFMWOCUNZDTB-MRXNPFEDSA-N 0 0 353.422 3.856 20 5 FHBDRN CO[C@@H]1Cc2ccccc2N(C(=O)c2c(C)cc(Cl)cc2[N+](=O)[O-])C1 ZINC000500319966 944497365 /nfs/dbraw/zinc/49/73/65/944497365.db2.gz XNWBMZSTHVLUKC-CQSZACIVSA-N 0 0 360.797 3.775 20 5 FHBDRN Cc1ccc(C2=CCN(C(=O)[C@H](C)c3cccc([N+](=O)[O-])c3)CC2)cn1 ZINC000566655891 944502651 /nfs/dbraw/zinc/50/26/51/944502651.db2.gz PEFCVSPPXWUQLM-OAHLLOKOSA-N 0 0 351.406 3.718 20 5 FHBDRN CC(C)[C@H]([NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)C(=O)[O-] ZINC000426671141 944505042 /nfs/dbraw/zinc/50/50/42/944505042.db2.gz KPIWNPAHHRKQQP-KRWDZBQOSA-N 0 0 362.357 3.725 20 5 FHBDRN Cc1c(F)ccc([N+](=O)[O-])c1C(=O)N1CCC(OCc2ccccc2)CC1 ZINC000843758514 944508567 /nfs/dbraw/zinc/50/85/67/944508567.db2.gz ROWPSTGJUJXQJX-UHFFFAOYSA-N 0 0 372.396 3.864 20 5 FHBDRN C[C@@H](Oc1cccc(C(C)(C)C)c1)C(=O)N(C)c1ccc([N+](=O)[O-])nc1 ZINC000439290272 944509571 /nfs/dbraw/zinc/50/95/71/944509571.db2.gz VTZGHZIGWXSYHH-CYBMUJFWSA-N 0 0 357.410 3.718 20 5 FHBDRN CCc1nc([C@H](C)NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)cs1 ZINC000110506478 944513986 /nfs/dbraw/zinc/51/39/86/944513986.db2.gz VQBDWHJESZZLGN-JTQLQIEISA-N 0 0 360.439 3.679 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1)[C@@H](Nc1cccc(N3CCOCC3)c1)CCC2 ZINC000584569651 944524937 /nfs/dbraw/zinc/52/49/37/944524937.db2.gz BNVXDRSRAHCCKJ-FQEVSTJZSA-N 0 0 353.422 3.921 20 5 FHBDRN CCOc1cc(N2CCC(OC(=O)[C@@H]3CC34CCC4)CC2)ccc1[N+](=O)[O-] ZINC000759843097 944533324 /nfs/dbraw/zinc/53/33/24/944533324.db2.gz JCMNDEBETHVFFS-INIZCTEOSA-N 0 0 374.437 3.696 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N(C)[C@@H]1CCCc2nc(C)sc21 ZINC000110528873 944534207 /nfs/dbraw/zinc/53/42/07/944534207.db2.gz CJBVLAAKVBCTDL-CQSZACIVSA-N 0 0 361.423 3.518 20 5 FHBDRN CC(C)n1nc2c(c1NC(=O)N(C)Cc1ccccc1[N+](=O)[O-])CCC2 ZINC000473807123 944534704 /nfs/dbraw/zinc/53/47/04/944534704.db2.gz NPCOJNVUEVZDFI-UHFFFAOYSA-N 0 0 357.414 3.525 20 5 FHBDRN CCC(CC)N(C1CC1)S(=O)(=O)c1cc(Cl)c(C)c([N+](=O)[O-])c1 ZINC000516148204 944536473 /nfs/dbraw/zinc/53/64/73/944536473.db2.gz PXHWNHHRXGEIEQ-UHFFFAOYSA-N 0 0 360.863 3.898 20 5 FHBDRN O=C(NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)c1cc(F)ccc1Cl ZINC000517723384 944538271 /nfs/dbraw/zinc/53/82/71/944538271.db2.gz CZKNHTURFHPNAK-UHFFFAOYSA-N 0 0 361.760 3.841 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)N1CC[C@H](c2ccc(Cl)cc2)C1 ZINC000517711297 944541941 /nfs/dbraw/zinc/54/19/41/944541941.db2.gz JGXJNTXLBKHASP-HNNXBMFYSA-N 0 0 359.813 3.947 20 5 FHBDRN Cn1ccnc1[C@@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1ccccc1F ZINC000017590869 944543379 /nfs/dbraw/zinc/54/33/79/944543379.db2.gz BQQMOQZIASIECA-INIZCTEOSA-N 0 0 371.328 3.577 20 5 FHBDRN CCC(C)(C)[C@@H]1CCCN1C(=O)c1nnn(-c2cccc([N+](=O)[O-])c2)c1C ZINC000133906845 944544778 /nfs/dbraw/zinc/54/47/78/944544778.db2.gz PMWCPLOQIHSBPH-INIZCTEOSA-N 0 0 371.441 3.525 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@H]1CCc2sc(Cl)cc21 ZINC000518620389 944550309 /nfs/dbraw/zinc/55/03/09/944550309.db2.gz JANAZLGALSAEEN-NSHDSACASA-N 0 0 372.855 3.584 20 5 FHBDRN C[C@@H](Nc1ccc(C(=O)N2C3CCC2CC3)cc1[N+](=O)[O-])c1ccccn1 ZINC000516170840 944555126 /nfs/dbraw/zinc/55/51/26/944555126.db2.gz UBNRFQXCWYSBNW-IUDNXUCKSA-N 0 0 366.421 3.930 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1CNc1cccc(C(=O)NC(C)(C)C)c1 ZINC000429800755 944557950 /nfs/dbraw/zinc/55/79/50/944557950.db2.gz SPGADQJNJBBPKR-UHFFFAOYSA-N 0 0 357.410 3.744 20 5 FHBDRN Cc1nn(CCC(=O)Nc2csnc2-c2ccccc2)c(C)c1[N+](=O)[O-] ZINC000436719190 944559183 /nfs/dbraw/zinc/55/91/83/944559183.db2.gz OPUZNYLFHCABAO-UHFFFAOYSA-N 0 0 371.422 3.560 20 5 FHBDRN CCOc1ccc(C(C)=O)cc1COc1c(Cl)cncc1[N+](=O)[O-] ZINC000506555770 944564393 /nfs/dbraw/zinc/56/43/93/944564393.db2.gz PUZLGFDNCHGETH-UHFFFAOYSA-N 0 0 350.758 3.824 20 5 FHBDRN COc1cc(CN[C@@H](C)c2c(F)cccc2OC)c([N+](=O)[O-])cc1F ZINC000184309587 944566558 /nfs/dbraw/zinc/56/65/58/944566558.db2.gz PJLYARZNEJELAW-JTQLQIEISA-N 0 0 352.337 3.741 20 5 FHBDRN Cc1[nH]nc2ncc(NC(=O)c3ccc(C(C)(C)C)c([N+](=O)[O-])c3)cc12 ZINC000518654370 944578854 /nfs/dbraw/zinc/57/88/54/944578854.db2.gz ZIVKGZGVFSDFBC-UHFFFAOYSA-N 0 0 353.382 3.724 20 5 FHBDRN COc1ccc(NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)cc1 ZINC000050256201 944580025 /nfs/dbraw/zinc/58/00/25/944580025.db2.gz HZZDLOJPASLAHR-UHFFFAOYSA-N 0 0 355.375 3.979 20 5 FHBDRN O=c1[nH]ccc2c1C[N@H+](Cc1ccc(-c3ccccc3[N+](=O)[O-])s1)CC2 ZINC000426373482 944583689 /nfs/dbraw/zinc/58/36/89/944583689.db2.gz SMTXWCRZAAANGK-UHFFFAOYSA-N 0 0 367.430 3.982 20 5 FHBDRN COc1ccc2cc(NC(=O)[C@H](C)c3cccc([N+](=O)[O-])c3)ccc2n1 ZINC000518664143 944587068 /nfs/dbraw/zinc/58/70/68/944587068.db2.gz APAUSSLFWDJWAX-GFCCVEGCSA-N 0 0 351.362 3.894 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)NCCOc2cccc3ccccc32)c1 ZINC000147445552 944598679 /nfs/dbraw/zinc/59/86/79/944598679.db2.gz HNPLJFWMDNRXLE-UHFFFAOYSA-N 0 0 366.373 3.565 20 5 FHBDRN C[C@@H]1COc2ccccc2CN1C(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000543896602 944601233 /nfs/dbraw/zinc/60/12/33/944601233.db2.gz UYMQRZXIKPRMNS-GFCCVEGCSA-N 0 0 360.797 3.600 20 5 FHBDRN Cc1ncc(NC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)c(C2CC2)n1 ZINC000439415428 944605429 /nfs/dbraw/zinc/60/54/29/944605429.db2.gz DLSGKUHHGOHLSV-UHFFFAOYSA-N 0 0 361.789 3.546 20 5 FHBDRN Cc1cccc([C@@H]2CCCN2C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)n1 ZINC000518688995 944605889 /nfs/dbraw/zinc/60/58/89/944605889.db2.gz CCDXAVCQQKKBHZ-SFHVURJKSA-N 0 0 367.405 3.625 20 5 FHBDRN C[C@H](O)CNC(=O)c1cccc(Sc2ccc(Cl)cc2)c1[N+](=O)[O-] ZINC000184344808 944623933 /nfs/dbraw/zinc/62/39/33/944623933.db2.gz IOHOTAUAVBXUEZ-JTQLQIEISA-N 0 0 366.826 3.510 20 5 FHBDRN O=[N+]([O-])c1cncc(Cl)c1OCc1ccc(OCC(F)(F)F)nc1 ZINC000506578739 944625239 /nfs/dbraw/zinc/62/52/39/944625239.db2.gz MYBPIBRPGPUOCZ-UHFFFAOYSA-N 0 0 363.679 3.558 20 5 FHBDRN Cc1c(C(=O)Nc2cncc3ccccc32)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000759867773 944631457 /nfs/dbraw/zinc/63/14/57/944631457.db2.gz LUAGUZWXZNVPDZ-UHFFFAOYSA-N 0 0 366.333 3.920 20 5 FHBDRN CC(C)N(Cc1cccs1)C(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000516250106 944636168 /nfs/dbraw/zinc/63/61/68/944636168.db2.gz QHUVEYNWJFEFFE-UHFFFAOYSA-N 0 0 370.434 3.893 20 5 FHBDRN O=[N+]([O-])c1ccc(OC(F)F)c(CN[C@@H]2CCOc3c(F)cccc32)c1 ZINC000438468043 944653384 /nfs/dbraw/zinc/65/33/84/944653384.db2.gz VXKMWWVNCNRHJC-CQSZACIVSA-N 0 0 368.311 3.949 20 5 FHBDRN Cc1c(NCc2c(F)cc([N+](=O)[O-])cc2F)cccc1NC(=O)N(C)C ZINC000506246665 944662870 /nfs/dbraw/zinc/66/28/70/944662870.db2.gz NLGXKUHNCISXQW-UHFFFAOYSA-N 0 0 364.352 3.887 20 5 FHBDRN CC[C@@H]1CCC[C@@H]1NC(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000426029467 944671605 /nfs/dbraw/zinc/67/16/05/944671605.db2.gz PURMKJTXLAQZFH-RISCZKNCSA-N 0 0 359.348 3.992 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCC[C@H](C(F)(F)F)C1 ZINC000438474284 944675869 /nfs/dbraw/zinc/67/58/69/944675869.db2.gz UYUFMCJFJFAZNU-QWRGUYRKSA-N 0 0 360.332 3.702 20 5 FHBDRN CC(C)(c1nc(-c2ccc3[nH]c(=O)[nH]c3c2)no1)c1ccccc1[N+](=O)[O-] ZINC000426398706 944681406 /nfs/dbraw/zinc/68/14/06/944681406.db2.gz XZCAYXUYWGSDGH-UHFFFAOYSA-N 0 0 365.349 3.553 20 5 FHBDRN CN(C[C@@H]1OCCc2ccccc21)C(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000506257248 944686558 /nfs/dbraw/zinc/68/65/58/944686558.db2.gz YCSBSRMERKKXHF-IBGZPJMESA-N 0 0 366.373 3.727 20 5 FHBDRN CCc1cccc(CC)c1NC(=O)COc1c(Cl)cncc1[N+](=O)[O-] ZINC000506599675 944699396 /nfs/dbraw/zinc/69/93/96/944699396.db2.gz HIRIFXITBGRCHL-UHFFFAOYSA-N 0 0 363.801 3.786 20 5 FHBDRN Cc1cc(S(C)(=O)=O)cc(NCc2c(F)cc([N+](=O)[O-])cc2F)c1C ZINC000506258601 944708019 /nfs/dbraw/zinc/70/80/19/944708019.db2.gz JFTJFBQYDSAPLL-UHFFFAOYSA-N 0 0 370.377 3.505 20 5 FHBDRN COc1cc(CNc2cnn(-c3ccccc3)c2C)c([N+](=O)[O-])cc1F ZINC000506259344 944712120 /nfs/dbraw/zinc/71/21/20/944712120.db2.gz OFHRAWIOQGZOAL-UHFFFAOYSA-N 0 0 356.357 3.849 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@]1(O)CCCC(C)(C)C1 ZINC000438508029 944718110 /nfs/dbraw/zinc/71/81/10/944718110.db2.gz XIXKTHXSDXDJMH-UZLBHIALSA-N 0 0 362.470 3.611 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H](C)[C@@H]1Oc2ccccc2[C@@H]1C ZINC000438509490 944720916 /nfs/dbraw/zinc/72/09/16/944720916.db2.gz YKPHCZIGYRGFNL-VEVIJQCQSA-N 0 0 355.394 3.978 20 5 FHBDRN CCOC(=O)c1nn(-c2ccccc2)cc1/C=C\c1ccc([N+](=O)[O-])cn1 ZINC000439517317 944721140 /nfs/dbraw/zinc/72/11/40/944721140.db2.gz CAOALAWBQFKRQS-HJWRWDBZSA-N 0 0 364.361 3.523 20 5 FHBDRN CC(=O)Nc1ccc(-c2noc(C(C)(C)c3ccccc3[N+](=O)[O-])n2)cc1 ZINC000426411393 944724011 /nfs/dbraw/zinc/72/40/11/944724011.db2.gz MJGAZIDASLTOCN-UHFFFAOYSA-N 0 0 366.377 3.929 20 5 FHBDRN Cc1c(CC(=O)Nc2ccccc2C(=O)NC(C)(C)C)cccc1[N+](=O)[O-] ZINC000162747478 944728853 /nfs/dbraw/zinc/72/88/53/944728853.db2.gz GZHGWUNDISARGJ-UHFFFAOYSA-N 0 0 369.421 3.613 20 5 FHBDRN CC(C)(C(=O)N1CCC[C@H](Nc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000426710734 944733484 /nfs/dbraw/zinc/73/34/84/944733484.db2.gz KUCUOCOQAJKCML-SFHVURJKSA-N 0 0 367.449 3.976 20 5 FHBDRN O=C([O-])Cc1ccccc1C[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000426711903 944734586 /nfs/dbraw/zinc/73/45/86/944734586.db2.gz SPYFNQSSZDGYTR-UHFFFAOYSA-N 0 0 366.373 3.772 20 5 FHBDRN CCO[C@H]1C[C@@H](N(C)C(=O)c2ccc([N+](=O)[O-])cc2[O-])C12CCCCC2 ZINC000436869119 944734853 /nfs/dbraw/zinc/73/48/53/944734853.db2.gz LLARQFMCRBFBPY-SJORKVTESA-N 0 0 362.426 3.500 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)Nc1ccccc1O[C@H](C)C(F)(F)F ZINC000516343280 944744121 /nfs/dbraw/zinc/74/41/21/944744121.db2.gz UVCDFBFZDFUADQ-SNVBAGLBSA-N 0 0 369.299 3.880 20 5 FHBDRN C[C@H](CCc1ccccc1)NS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000516341911 944744602 /nfs/dbraw/zinc/74/46/02/944744602.db2.gz DQRFQOMSTSFNEV-GFCCVEGCSA-N 0 0 368.842 3.548 20 5 FHBDRN Cc1cccc(OCC(=O)Nc2ccc(N3CCCC3)cc2C)c1[N+](=O)[O-] ZINC000123971924 944749818 /nfs/dbraw/zinc/74/98/18/944749818.db2.gz WXOQOQIAOGRIEI-UHFFFAOYSA-N 0 0 369.421 3.829 20 5 FHBDRN CC(C)(NC(=O)NC[C@@H]1CCc2ccccc21)c1ccc([N+](=O)[O-])cc1 ZINC000431978236 944752120 /nfs/dbraw/zinc/75/21/20/944752120.db2.gz VHVVJTDVWKGJSZ-HNNXBMFYSA-N 0 0 353.422 3.859 20 5 FHBDRN C[C@H](F)CCNC(=O)c1ccc(N2C[C@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000506929699 944767869 /nfs/dbraw/zinc/76/78/69/944767869.db2.gz DZZJUOHGVNCKQW-MJBXVCDLSA-N 0 0 351.422 3.555 20 5 FHBDRN C[C@@]1(C(=O)[O-])CCCC[C@H]1[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000426749825 944769091 /nfs/dbraw/zinc/76/90/91/944769091.db2.gz IUDQMBONDIBWIW-IEBWSBKVSA-N 0 0 358.394 3.978 20 5 FHBDRN O=C(c1cc(OCc2ccccc2)ccc1[N+](=O)[O-])N1C2CCC1CC2 ZINC000516373006 944775168 /nfs/dbraw/zinc/77/51/68/944775168.db2.gz XGIFKKXCFXJPBO-UHFFFAOYSA-N 0 0 352.390 3.941 20 5 FHBDRN Cc1cc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2)n(-c2ccccc2C)n1 ZINC000518792078 944775828 /nfs/dbraw/zinc/77/58/28/944775828.db2.gz WOUWBMDVPTXFRJ-UHFFFAOYSA-N 0 0 354.341 3.789 20 5 FHBDRN CCOC(=O)[C@@H](C)Sc1nc2cc3ccccc3cc2c(=O)n1CC ZINC000516378611 944781866 /nfs/dbraw/zinc/78/18/66/944781866.db2.gz LCYOGGXOBGJWNS-GFCCVEGCSA-N 0 0 356.447 3.613 20 5 FHBDRN CC(C)(C(=O)N1CC[C@](F)(c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000518798667 944792348 /nfs/dbraw/zinc/79/23/48/944792348.db2.gz NMCNQIGZNUSFHH-HXUWFJFHSA-N 0 0 356.397 3.970 20 5 FHBDRN CC(C)Nc1ccc(C(=O)N2CCS[C@@H]2c2ccc([N+](=O)[O-])cc2)cn1 ZINC000426774304 944792665 /nfs/dbraw/zinc/79/26/65/944792665.db2.gz UDSWKRUQLVHQKJ-GOSISDBHSA-N 0 0 372.450 3.698 20 5 FHBDRN CC(C)[C@@H](NC(=O)c1cc(F)cc([N+](=O)[O-])c1)c1nc2ccccc2[nH]1 ZINC000518799354 944793307 /nfs/dbraw/zinc/79/33/07/944793307.db2.gz XAAVPDHNGGPYOW-MRXNPFEDSA-N 0 0 356.357 3.737 20 5 FHBDRN COc1ccc(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)cc1Cl ZINC000500410243 944802159 /nfs/dbraw/zinc/80/21/59/944802159.db2.gz LTINSILUFVKOQT-UHFFFAOYSA-N 0 0 355.177 3.840 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)NC1(c2ccccc2)CCCC1 ZINC000506946876 944803800 /nfs/dbraw/zinc/80/38/00/944803800.db2.gz CLJKICGXCPMERH-UHFFFAOYSA-N 0 0 369.421 3.872 20 5 FHBDRN O=[N+]([O-])c1cnc(NC2CCC3(CCOCC3)CC2)c(Br)c1 ZINC000439617741 944816301 /nfs/dbraw/zinc/81/63/01/944816301.db2.gz ZLUZRCIWCVVPKD-UHFFFAOYSA-N 0 0 370.247 3.904 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)c1c[nH]nc1-c1ccc(F)cc1 ZINC000468784642 944829367 /nfs/dbraw/zinc/82/93/67/944829367.db2.gz BAXPKUYLXHVGEX-UHFFFAOYSA-N 0 0 374.759 3.707 20 5 FHBDRN O=C([O-])[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1c(Cl)oc2ccccc21 ZINC000426808811 944829853 /nfs/dbraw/zinc/82/98/53/944829853.db2.gz ODNDOHNLROTDFI-AWEZNQCLSA-N 0 0 374.780 3.780 20 5 FHBDRN O=C([O-])[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1ccc2ccccc2c1 ZINC000426812153 944833615 /nfs/dbraw/zinc/83/36/15/944833615.db2.gz WYQBKTQOFKWMAE-SFHVURJKSA-N 0 0 350.374 3.534 20 5 FHBDRN Cc1cccc(-c2nc(Cc3c[nH]c4ccc([N+](=O)[O-])cc34)no2)c1O ZINC000436948942 944836568 /nfs/dbraw/zinc/83/65/68/944836568.db2.gz IQYNQLQXZFPQMX-UHFFFAOYSA-N 0 0 350.334 3.731 20 5 FHBDRN CCC[C@H](C)CC(=O)NCCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000500415633 944839799 /nfs/dbraw/zinc/83/97/99/944839799.db2.gz QYXALHYAAUPLCY-NSHDSACASA-N 0 0 361.364 3.968 20 5 FHBDRN CCc1cccc2c1OCC[C@H]2NC(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000506999319 944852768 /nfs/dbraw/zinc/85/27/68/944852768.db2.gz DDRGLYKWEWQTIN-MRXNPFEDSA-N 0 0 369.421 3.599 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](C(=O)[O-])C12CC3CC(CC(C3)C1)C2 ZINC000426828374 944853812 /nfs/dbraw/zinc/85/38/12/944853812.db2.gz LFTOYYRUKQHXRO-ITOSSNOYSA-N 0 0 358.438 3.662 20 5 FHBDRN CCOc1ccc(NC(=O)CNc2ccc(F)c(CC)c2)c([N+](=O)[O-])c1 ZINC000506298798 944862569 /nfs/dbraw/zinc/86/25/69/944862569.db2.gz RASVBWUVXVHCRC-UHFFFAOYSA-N 0 0 361.373 3.746 20 5 FHBDRN COCC(=O)Nc1ccc(OCc2cc([N+](=O)[O-])ccc2OC(C)C)cc1 ZINC000500423497 944869316 /nfs/dbraw/zinc/86/93/16/944869316.db2.gz RALNBAKHNDNBOA-UHFFFAOYSA-N 0 0 374.393 3.546 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)Nc2cc(Br)ccc2F)c1 ZINC000110647834 944874126 /nfs/dbraw/zinc/87/41/26/944874126.db2.gz DWZJOGBXQZUJPI-UHFFFAOYSA-N 0 0 369.146 3.757 20 5 FHBDRN C[C@@H](F)CCNC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 ZINC000507027588 944875905 /nfs/dbraw/zinc/87/59/05/944875905.db2.gz KPKVSFPTDLDBJC-CHWSQXEVSA-N 0 0 360.389 3.641 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(N[C@H]2CCO[C@@H](c3ccc(F)cc3)C2)c1 ZINC000541597474 944876346 /nfs/dbraw/zinc/87/63/46/944876346.db2.gz ZELMYRGGLJXLKF-MAUKXSAKSA-N 0 0 374.368 3.853 20 5 FHBDRN O=[N+]([O-])c1ccc(NCCc2ccn(-c3ccccc3)n2)c2ncccc12 ZINC000507029424 944878422 /nfs/dbraw/zinc/87/84/22/944878422.db2.gz IABWOOHBGZEHLH-UHFFFAOYSA-N 0 0 359.389 3.983 20 5 FHBDRN CC(F)(F)CCNc1ccc(I)cc1[N+](=O)[O-] ZINC000383143011 944883456 /nfs/dbraw/zinc/88/34/56/944883456.db2.gz XYBDGMRIHZJRHQ-UHFFFAOYSA-N 0 0 356.110 3.657 20 5 FHBDRN Cn1cnc([N+](=O)[O-])c1N[C@H](COc1ccccc1F)c1ccccc1 ZINC000426889576 944892435 /nfs/dbraw/zinc/89/24/35/944892435.db2.gz GITIKKYTBWTPRM-OAHLLOKOSA-N 0 0 356.357 3.700 20 5 FHBDRN CCc1c(NC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)onc1C(F)(F)F ZINC000505925670 944897903 /nfs/dbraw/zinc/89/79/03/944897903.db2.gz WESLIDUYTNOMLZ-UHFFFAOYSA-N 0 0 368.271 3.898 20 5 FHBDRN COc1ccc(C(=O)N[C@H](Cc2ccc(F)cc2)C(C)C)cc1[N+](=O)[O-] ZINC000437011094 944911846 /nfs/dbraw/zinc/91/18/46/944911846.db2.gz UAZRKESFEDGJGN-MRXNPFEDSA-N 0 0 360.385 3.740 20 5 FHBDRN CC[C@@H](c1ccccc1)N(CC(C)C)C(=O)CCn1cc([N+](=O)[O-])cn1 ZINC000518923283 944926276 /nfs/dbraw/zinc/92/62/76/944926276.db2.gz PMWNVBSXIXPPMM-SFHVURJKSA-N 0 0 358.442 3.817 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1C[C@H](c2ccc(F)cc2)C[C@@H]1C ZINC000426899117 944927594 /nfs/dbraw/zinc/92/75/94/944927594.db2.gz QKMNIWYHXHGKBX-GXTWGEPZSA-N 0 0 358.369 3.761 20 5 FHBDRN O=C(c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)N1CCCC2(CCCC2)C1 ZINC000438690208 944929865 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FHBDRN O=C(NCCCc1ccc(O)cc1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000426483390 944953950 /nfs/dbraw/zinc/95/39/50/944953950.db2.gz IKXFZWNFTAIIRD-UHFFFAOYSA-N 0 0 369.421 3.607 20 5 FHBDRN Cc1ccc([C@@H]2NC(=O)N(Cc3ccc([N+](=O)[O-])cc3Cl)C2=O)cc1C ZINC000432043275 944963845 /nfs/dbraw/zinc/96/38/45/944963845.db2.gz RKJRHHAFBXORPV-INIZCTEOSA-N 0 0 373.796 3.658 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1cc2c(cc1C)OCO2 ZINC000511732393 944964567 /nfs/dbraw/zinc/96/45/67/944964567.db2.gz BEDPDRJDMFJFDD-UHFFFAOYSA-N 0 0 360.391 3.996 20 5 FHBDRN Cc1c(NC(=O)Cc2cscc2Br)cccc1[N+](=O)[O-] ZINC000432060149 944968495 /nfs/dbraw/zinc/96/84/95/944968495.db2.gz CSSBGJGQWAWTGB-UHFFFAOYSA-N 0 0 355.213 3.908 20 5 FHBDRN C[C@@H]1C[C@@H](c2ccccc2)[C@H](C)N1C(=O)CNc1ccccc1[N+](=O)[O-] ZINC000426969579 944972979 /nfs/dbraw/zinc/97/29/79/944972979.db2.gz WKYOXIDGMPHKRE-HLLBOEOZSA-N 0 0 353.422 3.800 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1CCC(Cc2ccc(F)cc2)CC1 ZINC000426975064 944975042 /nfs/dbraw/zinc/97/50/42/944975042.db2.gz PXGACONUVATQSG-UHFFFAOYSA-N 0 0 372.396 3.837 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)[C@H]1CCCN(c2ccccc2)C1=O ZINC000432054192 944976161 /nfs/dbraw/zinc/97/61/61/944976161.db2.gz SQBXUWODFBOLOZ-MRXNPFEDSA-N 0 0 367.405 3.593 20 5 FHBDRN Cc1ccc(NC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)c2n[nH]cc21 ZINC000467375417 944979027 /nfs/dbraw/zinc/97/90/27/944979027.db2.gz DWWHHBHVVBVOSM-UHFFFAOYSA-N 0 0 359.773 3.755 20 5 FHBDRN C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)NCCC(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000437066522 944986585 /nfs/dbraw/zinc/98/65/85/944986585.db2.gz SUHXWVFOLGVUAB-VXGBXAGGSA-N 0 0 373.375 3.759 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)Cc1nsc2ccccc12 ZINC001270536570 945001141 /nfs/dbraw/zinc/00/11/41/945001141.db2.gz RVEIAWHNEYHEFD-UHFFFAOYSA-N 0 0 357.391 3.784 20 5 FHBDRN Cc1sc(S(=O)(=O)NCc2cccc3ccccc32)cc1[N+](=O)[O-] ZINC000467408697 945002984 /nfs/dbraw/zinc/00/29/84/945002984.db2.gz YFYPSJCNAZRAEN-UHFFFAOYSA-N 0 0 362.432 3.596 20 5 FHBDRN CC[C@@](C)(NC(=O)CCNc1ccccc1[N+](=O)[O-])c1nc(C)cs1 ZINC000151200455 945007646 /nfs/dbraw/zinc/00/76/46/945007646.db2.gz HAVKHTLMOGRSOT-QGZVFWFLSA-N 0 0 362.455 3.603 20 5 FHBDRN CCc1ccc(OCC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000437090964 945011277 /nfs/dbraw/zinc/01/12/77/945011277.db2.gz JFDJBTATKVZTMK-UHFFFAOYSA-N 0 0 354.406 3.727 20 5 FHBDRN CC[C@@H](CNC(=O)c1cc([N+](=O)[O-])c(C)s1)Oc1cccc(F)c1 ZINC000439832184 945012382 /nfs/dbraw/zinc/01/23/82/945012382.db2.gz XCUIGCOYDFIHHT-LBPRGKRZSA-N 0 0 352.387 3.691 20 5 FHBDRN O=[N+]([O-])c1cccc(OC[C@@H](O)CNc2cccc(NC3CCCC3)c2)c1 ZINC000516563409 945013991 /nfs/dbraw/zinc/01/39/91/945013991.db2.gz IDUZHGSXVAFEJC-IBGZPJMESA-N 0 0 371.437 3.801 20 5 FHBDRN Cc1ccc(OCC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)c(C)c1 ZINC000437100306 945019142 /nfs/dbraw/zinc/01/91/42/945019142.db2.gz WFYLJXKEXGHVAO-UHFFFAOYSA-N 0 0 354.406 3.782 20 5 FHBDRN COc1ccc(C[C@H](C)CN(C)C(=O)c2ccc([N+](=O)[O-])cc2OC)cc1 ZINC000427021627 945020879 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FHBDRN O=C1CCN1c1cccc(-c2noc(/C=C/c3cccc([N+](=O)[O-])c3)n2)c1 ZINC000438820036 945050613 /nfs/dbraw/zinc/05/06/13/945050613.db2.gz NYUDTVYYKXFQNG-BQYQJAHWSA-N 0 0 362.345 3.552 20 5 FHBDRN Cc1cc2c(cc1C)O[C@@H](C(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1)C2 ZINC000437124209 945054226 /nfs/dbraw/zinc/05/42/26/945054226.db2.gz HGAIFLGHNUBLAN-HXUWFJFHSA-N 0 0 366.417 3.706 20 5 FHBDRN CC[C@@H](C(=O)OC)N(C(=O)CCc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000151317301 945056108 /nfs/dbraw/zinc/05/61/08/945056108.db2.gz JZHQCKIYIKFTFL-SFHVURJKSA-N 0 0 370.405 3.512 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H]1CCc2c1cccc2O ZINC000439883097 945060918 /nfs/dbraw/zinc/06/09/18/945060918.db2.gz MVVLFOABIYOIKP-CQSZACIVSA-N 0 0 357.366 3.508 20 5 FHBDRN COc1ccc(NC(=O)c2cc([N+](=O)[O-])c[nH]2)c(OCc2ccccc2)c1 ZINC000439882903 945061355 /nfs/dbraw/zinc/06/13/55/945061355.db2.gz LSRJGRPDSVKQQY-UHFFFAOYSA-N 0 0 367.361 3.763 20 5 FHBDRN CC(C)(Oc1ccc(F)cc1)C(=O)Nc1cc([N+](=O)[O-])c(F)cc1F ZINC000124932995 945373458 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FHBDRN Cc1c(NC(=O)N2CCC[C@@H]2[C@@H]2C[C@H](C)CC[C@@H]2O)cccc1[N+](=O)[O-] ZINC000281312314 945586160 /nfs/dbraw/zinc/58/61/60/945586160.db2.gz IPETZFHWDRXNMB-OLUCIUBSSA-N 0 0 361.442 3.697 20 5 FHBDRN Cc1ccc(CNc2cccc(C(=O)N3CCSCC3)c2)cc1[N+](=O)[O-] ZINC000125102055 945592706 /nfs/dbraw/zinc/59/27/06/945592706.db2.gz VSZMXQXWZISAHJ-UHFFFAOYSA-N 0 0 371.462 3.704 20 5 FHBDRN COC(=O)CCCOc1ccc(CNc2cccc(C)c2[N+](=O)[O-])cc1 ZINC000549523555 945596451 /nfs/dbraw/zinc/59/64/51/945596451.db2.gz JPAZLNYADHQYFH-UHFFFAOYSA-N 0 0 358.394 3.847 20 5 FHBDRN CO[C@H]1CCC[C@@H]1C(=O)N(Cc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC001126572035 945601302 /nfs/dbraw/zinc/60/13/02/945601302.db2.gz BDTMPWNREGATBM-OALUTQOASA-N 0 0 354.406 3.943 20 5 FHBDRN COc1cc(-c2nc([C@H]3CCC(F)(F)C3)no2)cc([N+](=O)[O-])c1OC ZINC000281409069 945625546 /nfs/dbraw/zinc/62/55/46/945625546.db2.gz OADQTCTZDWMHKL-QMMMGPOBSA-N 0 0 355.297 3.565 20 5 FHBDRN COC[C@@H](C)Nc1ccccc1NC(=O)Cc1cccc([N+](=O)[O-])c1C ZINC000281498890 945665164 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945736203 /nfs/dbraw/zinc/73/62/03/945736203.db2.gz FIYNYHNUOUEAHC-SECBINFHSA-N 0 0 354.740 3.946 20 5 FHBDRN CN(C[C@H]1CCCOC1)C(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000107646219 945740146 /nfs/dbraw/zinc/74/01/46/945740146.db2.gz WWUHXJWGJNYBET-OAHLLOKOSA-N 0 0 369.421 3.837 20 5 FHBDRN C[C@H](NC(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)c1cncs1 ZINC000894477090 945752214 /nfs/dbraw/zinc/75/22/14/945752214.db2.gz MIBGHSZCDMAOHR-QMMMGPOBSA-N 0 0 374.344 3.631 20 5 FHBDRN O=C(Nc1cc2c(cc1[N+](=O)[O-])OCCCO2)[C@H]1CSc2ccccc21 ZINC000522767719 945759413 /nfs/dbraw/zinc/75/94/13/945759413.db2.gz ABVWTSDWMITUDP-LBPRGKRZSA-N 0 0 372.402 3.584 20 5 FHBDRN CCN(CC)C(=O)Nc1ccc([C@@H](C)NC(=O)c2ccc([N+](=O)[O-])o2)cc1 ZINC000044623598 945767056 /nfs/dbraw/zinc/76/70/56/945767056.db2.gz DETOSGQTCYXLDS-GFCCVEGCSA-N 0 0 374.397 3.553 20 5 FHBDRN CCCOc1ccc(CNC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cn1 ZINC000107722122 945767160 /nfs/dbraw/zinc/76/71/60/945767160.db2.gz KUBFOTFZNINJJV-UHFFFAOYSA-N 0 0 364.789 3.754 20 5 FHBDRN CN(C(=O)C(C)(C)Cc1nc2ccccc2[nH]1)c1cccc([N+](=O)[O-])c1 ZINC000281626750 945790570 /nfs/dbraw/zinc/79/05/70/945790570.db2.gz ULXQSNUPCCWKOY-UHFFFAOYSA-N 0 0 352.394 3.703 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)N[C@@H]1CCc2sc(Cl)cc21 ZINC000519849497 945817488 /nfs/dbraw/zinc/81/74/88/945817488.db2.gz JZCZGJNOAUAVHL-CYBMUJFWSA-N 0 0 365.842 3.839 20 5 FHBDRN CCCC(O)(CCC)CNC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000444080998 945820044 /nfs/dbraw/zinc/82/00/44/945820044.db2.gz KAHPTSOMENIYAR-UHFFFAOYSA-N 0 0 366.461 3.742 20 5 FHBDRN CNc1c(C(=O)N[C@@H]2CC[C@@H](c3ccc(F)cc3)C2)cccc1[N+](=O)[O-] ZINC000473662364 945820624 /nfs/dbraw/zinc/82/06/24/945820624.db2.gz QBQMHILMGWDUGK-UKRRQHHQSA-N 0 0 357.385 3.842 20 5 FHBDRN Cn1cc([N+](=O)[O-])cc1C(=O)NCc1ccccc1Oc1ccccc1 ZINC000519875128 945829066 /nfs/dbraw/zinc/82/90/66/945829066.db2.gz WLSXZDDDBAMDMT-UHFFFAOYSA-N 0 0 351.362 3.656 20 5 FHBDRN CCOc1ccccc1C1=CCN(C(=O)Cc2ccccc2[N+](=O)[O-])CC1 ZINC000125388472 945835631 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CO[C@@H]1CCN(C(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)[C@@H](C)C1 ZINC000281861320 945890427 /nfs/dbraw/zinc/89/04/27/945890427.db2.gz VKZFZVPMPRROCD-DZGCQCFKSA-N 0 0 350.418 3.733 20 5 FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC[C@@H](C)C1 ZINC000186434256 945890447 /nfs/dbraw/zinc/89/04/47/945890447.db2.gz BHYWVHVEFXPGPV-CYBMUJFWSA-N 0 0 352.456 3.596 20 5 FHBDRN CCCO[C@@H]1CCCN(C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)CC1 ZINC000108236900 945894158 /nfs/dbraw/zinc/89/41/58/945894158.db2.gz YPFWLDYNCZBSPU-MRXNPFEDSA-N 0 0 361.442 3.590 20 5 FHBDRN O=C(N[C@H]1CCCC12CCOCC2)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000281895191 945906560 /nfs/dbraw/zinc/90/65/60/945906560.db2.gz FHMZEKYUZLCEBJ-AWEZNQCLSA-N 0 0 372.343 3.693 20 5 FHBDRN Cc1ccc([C@H]2C[C@H](C)N(C(=O)CNc3ccccc3[N+](=O)[O-])C2)cc1 ZINC000428328638 945938092 /nfs/dbraw/zinc/93/80/92/945938092.db2.gz ZRZRCNDBWMSICV-RDJZCZTQSA-N 0 0 353.422 3.720 20 5 FHBDRN COc1ccc(SCCc2nc(Cc3ccccc3[N+](=O)[O-])no2)cc1 ZINC000545527626 945953104 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3.587 20 5 FHBDRN Cc1cccc(C(=O)N2CCC([C@H](O)c3ccc(F)cc3)CC2)c1[N+](=O)[O-] ZINC000108458439 945977774 /nfs/dbraw/zinc/97/77/74/945977774.db2.gz NQWJHDNAGNIYCA-LJQANCHMSA-N 0 0 372.396 3.628 20 5 FHBDRN Cc1cc(-c2nc(Cc3ccccc3[N+](=O)[O-])no2)nn1[C@@H](C)C1CC1 ZINC000545537816 945980684 /nfs/dbraw/zinc/98/06/84/945980684.db2.gz XHVQLRWMHYAHGZ-LBPRGKRZSA-N 0 0 353.382 3.712 20 5 FHBDRN CSc1ccc(C(=O)Nc2ccc(-c3c[nH]cn3)cc2)cc1[N+](=O)[O-] ZINC000519994410 945993468 /nfs/dbraw/zinc/99/34/68/945993468.db2.gz QGTQTWTTXLWRRE-UHFFFAOYSA-N 0 0 354.391 3.959 20 5 FHBDRN C[C@@H](c1ccccc1[N+](=O)[O-])N(C)[C@H]1CCCN(c2ccccc2)C1=O ZINC000444154674 945996676 /nfs/dbraw/zinc/99/66/76/945996676.db2.gz DYBSYCFTLQCIQY-KXBFYZLASA-N 0 0 353.422 3.783 20 5 FHBDRN CCCCOC(=O)c1ccc(OC(=O)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000897280809 946000121 /nfs/dbraw/zinc/00/01/21/946000121.db2.gz VLFOCHCMRAKLGM-UHFFFAOYSA-N 0 0 357.362 3.700 20 5 FHBDRN C[C@H](Oc1ccc([N+](=O)[O-])c(Cl)c1)C(=O)Nc1ccc(F)cc1F ZINC000127155474 946005402 /nfs/dbraw/zinc/00/54/02/946005402.db2.gz LAKCMKHNTRRXED-QMMMGPOBSA-N 0 0 356.712 3.932 20 5 FHBDRN Cc1sc(C(=O)N2CCO[C@H](c3ccc(Cl)cc3)C2)cc1[N+](=O)[O-] ZINC000108549161 946005731 /nfs/dbraw/zinc/00/57/31/946005731.db2.gz PQKRUTXMCNSTIY-AWEZNQCLSA-N 0 0 366.826 3.832 20 5 FHBDRN C[C@@H](C1CC1)N(C(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])C1CC1 ZINC000520008827 946013401 /nfs/dbraw/zinc/01/34/01/946013401.db2.gz SWBAKBRLKUCGEI-JTQLQIEISA-N 0 0 372.343 3.939 20 5 FHBDRN Cc1cc([C@@H](C)NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)c(C)s1 ZINC000520010228 946015936 /nfs/dbraw/zinc/01/59/36/946015936.db2.gz VNHZDNGQHJSPJB-GFCCVEGCSA-N 0 0 370.434 3.950 20 5 FHBDRN CN(C(=O)CSc1ccc([N+](=O)[O-])cc1)c1ccc2ccccc2n1 ZINC000522864007 946018429 /nfs/dbraw/zinc/01/84/29/946018429.db2.gz HEONXGJYWJUCMO-UHFFFAOYSA-N 0 0 353.403 3.898 20 5 FHBDRN Cn1nccc1[C@@H]1CCCCN1c1ccc([N+](=O)[O-])c(OC(F)F)c1 ZINC000281984299 946022022 /nfs/dbraw/zinc/02/20/22/946022022.db2.gz VGJDFDXBUYEWIN-ZDUSSCGKSA-N 0 0 352.341 3.661 20 5 FHBDRN C[C@@H](Oc1ccc([N+](=O)[O-])c(Cl)c1)C(=O)Nc1cc(F)ccc1F ZINC000127156155 946030563 /nfs/dbraw/zinc/03/05/63/946030563.db2.gz YQPUTHPLHHOPNW-MRVPVSSYSA-N 0 0 356.712 3.932 20 5 FHBDRN CC(C)(C)c1nnc(NC(=O)CCCNc2ccc([N+](=O)[O-])cc2)s1 ZINC000108676604 946033171 /nfs/dbraw/zinc/03/31/71/946033171.db2.gz DKXQLCSACOYCRL-UHFFFAOYSA-N 0 0 363.443 3.575 20 5 FHBDRN CC[C@H](c1ccncc1)N(C)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186005008 946039102 /nfs/dbraw/zinc/03/91/02/946039102.db2.gz XXDCHRPOPFGPLV-MRXNPFEDSA-N 0 0 362.817 3.936 20 5 FHBDRN CCCCNC(=O)c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1 ZINC000522881803 946045075 /nfs/dbraw/zinc/04/50/75/946045075.db2.gz PXEYIADJQMHJJU-UHFFFAOYSA-N 0 0 357.197 3.617 20 5 FHBDRN C[C@@H](CNC(=O)c1cc(Cl)cc([N+](=O)[O-])c1)COCc1ccccc1 ZINC000522877421 946047270 /nfs/dbraw/zinc/04/72/70/946047270.db2.gz GUOOZVVEHSPBNV-ZDUSSCGKSA-N 0 0 362.813 3.831 20 5 FHBDRN CSc1cccc(C(=O)N[C@@H](C)c2nc3ccccc3[nH]2)c1[N+](=O)[O-] ZINC000186006125 946067852 /nfs/dbraw/zinc/06/78/52/946067852.db2.gz KFOGPWPQFFVRPG-JTQLQIEISA-N 0 0 356.407 3.684 20 5 FHBDRN Cc1ccc(F)c(NS(=O)(=O)c2cc(Cl)c(C)c([N+](=O)[O-])c2)c1 ZINC000018707301 946076421 /nfs/dbraw/zinc/07/64/21/946076421.db2.gz CECSHBWVTYAEMY-UHFFFAOYSA-N 0 0 358.778 3.805 20 5 FHBDRN O=C(N[C@H]1C=CCCC1)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12 ZINC000444231889 946103633 /nfs/dbraw/zinc/10/36/33/946103633.db2.gz KNHZVMSOXFQLDF-ZDUSSCGKSA-N 0 0 354.356 3.798 20 5 FHBDRN CCC[C@H](CC1CCCC1)C(=O)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000522930909 946113065 /nfs/dbraw/zinc/11/30/65/946113065.db2.gz RXZFLJNRUGFJEA-IAGOWNOFSA-N 0 0 374.485 3.999 20 5 FHBDRN O=C(NC[C@@H]1CCCS1)c1cc(F)cc2c(=O)c3cccc(F)c3[nH]c12 ZINC000444244410 946113422 /nfs/dbraw/zinc/11/34/22/946113422.db2.gz MSHFWSLXKCEAIA-NSHDSACASA-N 0 0 374.412 3.585 20 5 FHBDRN CCC[C@@H](CC1CCCC1)C(=O)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000522930908 946113446 /nfs/dbraw/zinc/11/34/46/946113446.db2.gz RXZFLJNRUGFJEA-DLBZAZTESA-N 0 0 374.485 3.999 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N(C)[C@H](C)c1cc(F)ccc1F ZINC000074525416 946114560 /nfs/dbraw/zinc/11/45/60/946114560.db2.gz ZFCHSSOEXRSBNU-SNVBAGLBSA-N 0 0 350.321 3.715 20 5 FHBDRN CCN(C(=O)c1ccc([N+](=O)[O-])c(OC)c1)[C@H](C)Cc1ccc(OC)cc1 ZINC000108983239 946117961 /nfs/dbraw/zinc/11/79/61/946117961.db2.gz WMJLDCWEOFUCAT-CQSZACIVSA-N 0 0 372.421 3.705 20 5 FHBDRN COc1cccc(CO[C@H](C)C(=O)O[C@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000066877994 946119172 /nfs/dbraw/zinc/11/91/72/946119172.db2.gz MWNXEOWFNUZOLQ-ZIAGYGMSSA-N 0 0 359.378 3.813 20 5 FHBDRN COc1ccc(/C=C/C(=O)O[C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1OC ZINC000066877953 946119565 /nfs/dbraw/zinc/11/95/65/946119565.db2.gz IXXDYMZSDIAINL-KKNAONHISA-N 0 0 357.362 3.930 20 5 FHBDRN C[C@H](OC(=O)c1ccccc1N(C)C(=O)C1CC1)c1ccc([N+](=O)[O-])cc1 ZINC000066878366 946120569 /nfs/dbraw/zinc/12/05/69/946120569.db2.gz AWKGHHVOXOGWTE-ZDUSSCGKSA-N 0 0 368.389 3.886 20 5 FHBDRN C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000027800236 946122154 /nfs/dbraw/zinc/12/21/54/946122154.db2.gz LKHNBAWKKWZNHI-ZDUSSCGKSA-N 0 0 369.421 3.649 20 5 FHBDRN CC/C=C(/C)C(=O)O[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000109124512 946153441 /nfs/dbraw/zinc/15/34/41/946153441.db2.gz ZAQLLRNJMNCWSK-BSKOKIOFSA-N 0 0 374.315 3.840 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)c1cccc(N2CCCC2)c1 ZINC000088217767 946160205 /nfs/dbraw/zinc/16/02/05/946160205.db2.gz YQCASTFISBJORA-OAHLLOKOSA-N 0 0 353.422 3.994 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1)C(=O)N1CCC[C@H]1c1cccc(Cl)c1 ZINC000121248044 946178031 /nfs/dbraw/zinc/17/80/31/946178031.db2.gz RBAVWXPYJODBEX-INIZCTEOSA-N 0 0 373.796 3.550 20 5 FHBDRN CC(C)[C@H]1CCN1C(=O)c1cc(F)cc2c(=O)c3cccc(F)c3[nH]c12 ZINC000444289639 946180283 /nfs/dbraw/zinc/18/02/83/946180283.db2.gz NJAUWUWWABBPBP-MRXNPFEDSA-N 0 0 356.372 3.830 20 5 FHBDRN CC(C)[C@@H]1CCN1C(=O)c1cc(F)cc2c(=O)c3cccc(F)c3[nH]c12 ZINC000444289638 946180719 /nfs/dbraw/zinc/18/07/19/946180719.db2.gz NJAUWUWWABBPBP-INIZCTEOSA-N 0 0 356.372 3.830 20 5 FHBDRN CCc1n[nH]c(C(=O)N(C)[C@@H]2CCC[C@@H]2c2ccc(C)cc2)c1[N+](=O)[O-] ZINC000444295644 946180845 /nfs/dbraw/zinc/18/08/45/946180845.db2.gz FBVKRRXZUTXSOG-GDBMZVCRSA-N 0 0 356.426 3.597 20 5 FHBDRN O=C(N[C@H](c1cccnc1)C1CC1)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000444296894 946183442 /nfs/dbraw/zinc/18/34/42/946183442.db2.gz ZFVJLABELXSAQL-NRFANRHFSA-N 0 0 369.424 3.957 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N=c1nc(-c2cccc(Cl)c2)[n-]s1 ZINC000522980765 946184388 /nfs/dbraw/zinc/18/43/88/946184388.db2.gz XZWUZCHQWBJGFO-UHFFFAOYSA-N 0 0 374.809 3.749 20 5 FHBDRN O=C(Nc1ccc2c(c1)COC2)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000444298441 946185330 /nfs/dbraw/zinc/18/53/30/946185330.db2.gz NTAPRVBOMZAALU-UHFFFAOYSA-N 0 0 356.381 3.964 20 5 FHBDRN O=C(Nc1cccc2c1OCO2)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000444300770 946187874 /nfs/dbraw/zinc/18/78/74/946187874.db2.gz JEHXAWYEEBYCQH-UHFFFAOYSA-N 0 0 358.353 3.662 20 5 FHBDRN Cc1sc(S(=O)(=O)N2CCC[C@H]2C2CCCCC2)cc1[N+](=O)[O-] ZINC000467416258 946188455 /nfs/dbraw/zinc/18/84/55/946188455.db2.gz GDULXPBTCWXPBS-ZDUSSCGKSA-N 0 0 358.485 3.698 20 5 FHBDRN COc1ccc(NC(=O)CN(C)[C@H](C)c2ccc(C)cc2)c([N+](=O)[O-])c1 ZINC000052907251 946195289 /nfs/dbraw/zinc/19/52/89/946195289.db2.gz JMFPYYTXLNSPHS-CQSZACIVSA-N 0 0 357.410 3.543 20 5 FHBDRN COc1cc(C(=O)NCc2c(Cl)cccc2Cl)ccc1[N+](=O)[O-] ZINC000522986911 946205479 /nfs/dbraw/zinc/20/54/79/946205479.db2.gz OTGWBVZTNHSOBT-UHFFFAOYSA-N 0 0 355.177 3.840 20 5 FHBDRN CC1CCC(N(C(=O)COc2ccc([N+](=O)[O-])c(F)c2)C2CC2)CC1 ZINC000109263546 946213085 /nfs/dbraw/zinc/21/30/85/946213085.db2.gz ZDDRCGRLLLZOJF-UHFFFAOYSA-N 0 0 350.390 3.682 20 5 FHBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NCc1cc(F)ccc1F ZINC000104562121 946249111 /nfs/dbraw/zinc/24/91/11/946249111.db2.gz VPKDLIUMNQGHIV-VIFPVBQESA-N 0 0 370.739 3.610 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2nc(-c3ccc(Oc4ncccn4)cc3)no2)c1 ZINC000545624719 946257824 /nfs/dbraw/zinc/25/78/24/946257824.db2.gz OHXJUWIALWSFKE-UHFFFAOYSA-N 0 0 361.317 3.894 20 5 FHBDRN CC(=O)Nc1ccc(-c2noc(/C=C\c3ccccc3[N+](=O)[O-])n2)cc1 ZINC000545626205 946260888 /nfs/dbraw/zinc/26/08/88/946260888.db2.gz AMEJZJPOVJGQJG-FLIBITNWSA-N 0 0 350.334 3.774 20 5 FHBDRN C[C@H](Nc1cc(Cl)c(C(F)(F)F)cc1[N+](=O)[O-])C(=O)NC(C)(C)C ZINC000109391378 946272269 /nfs/dbraw/zinc/27/22/69/946272269.db2.gz YORIKEVCAGKHQW-ZETCQYMHSA-N 0 0 367.755 3.982 20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])N[C@@H]1CCCOc2ccc(F)cc21 ZINC000054283147 946279623 /nfs/dbraw/zinc/27/96/23/946279623.db2.gz GNXPYYMWFNCELU-OAHLLOKOSA-N 0 0 373.384 3.566 20 5 FHBDRN CCCN(C[C@H]1CCCCO1)C(=O)c1cccc(SC)c1[N+](=O)[O-] ZINC000186463036 946284147 /nfs/dbraw/zinc/28/41/47/946284147.db2.gz WMRDRIATTVVNQI-CYBMUJFWSA-N 0 0 352.456 3.738 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CC[C@@](C)(c2ccccc2)C1 ZINC000438489752 946284586 /nfs/dbraw/zinc/28/45/86/946284586.db2.gz JXIDBIMBVGLWMZ-HXUWFJFHSA-N 0 0 353.422 3.505 20 5 FHBDRN C[C@@H](C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)c1ccc(Cl)s1 ZINC000088231160 946290514 /nfs/dbraw/zinc/29/05/14/946290514.db2.gz DGLBHWHYAZABGN-SNVBAGLBSA-N 0 0 350.827 3.998 20 5 FHBDRN Cc1ccccc1OCCCC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088231432 946291459 /nfs/dbraw/zinc/29/14/59/946291459.db2.gz ZEXJZAAUNDJPFE-UHFFFAOYSA-N 0 0 354.406 3.647 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(Cl)c1N1CCC(NC(=O)c2ccccc2)CC1 ZINC000302715531 946292414 /nfs/dbraw/zinc/29/24/14/946292414.db2.gz YAWIQDNYDNTKJV-UHFFFAOYSA-N 0 0 373.840 3.955 20 5 FHBDRN O=C(NCc1cc(F)ccc1F)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000151887779 946294143 /nfs/dbraw/zinc/29/41/43/946294143.db2.gz WTHQJUVPJMZVBV-UHFFFAOYSA-N 0 0 361.348 3.747 20 5 FHBDRN C[C@@H](SCc1ccccc1)C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088231566 946295492 /nfs/dbraw/zinc/29/54/92/946295492.db2.gz GTCYKONHUPTITM-CQSZACIVSA-N 0 0 356.447 3.801 20 5 FHBDRN Cc1nc(-c2ccco2)ccc1C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088231058 946296105 /nfs/dbraw/zinc/29/61/05/946296105.db2.gz OQRSRYXTHMSVAZ-UHFFFAOYSA-N 0 0 363.373 3.757 20 5 FHBDRN Cc1cccc2c(CCC(=O)N3CCc4ccc([N+](=O)[O-])cc4C3)c[nH]c21 ZINC000088231792 946296463 /nfs/dbraw/zinc/29/64/63/946296463.db2.gz IIKFNLVFSGGCOJ-UHFFFAOYSA-N 0 0 363.417 3.902 20 5 FHBDRN C[C@H](CCc1cccc(F)c1)C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088231646 946296600 /nfs/dbraw/zinc/29/66/00/946296600.db2.gz HVLCDSZKMCCZLX-CQSZACIVSA-N 0 0 356.397 3.888 20 5 FHBDRN C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N(C)Cc1ccc(Cl)s1 ZINC000018939004 946299645 /nfs/dbraw/zinc/29/96/45/946299645.db2.gz SREDEFMOKVOOBB-SNVBAGLBSA-N 0 0 353.831 3.769 20 5 FHBDRN CN(Cc1ccc2ccccc2c1)S(=O)(=O)c1ccccc1[N+](=O)[O-] ZINC000018940751 946299719 /nfs/dbraw/zinc/29/97/19/946299719.db2.gz PCTABDNUAHERGX-UHFFFAOYSA-N 0 0 356.403 3.569 20 5 FHBDRN COc1ccccc1-c1noc(-c2ccn(-c3cccc([N+](=O)[O-])c3)n2)n1 ZINC000109455606 946300835 /nfs/dbraw/zinc/30/08/35/946300835.db2.gz GESPTEPRVFGWHJ-UHFFFAOYSA-N 0 0 363.333 3.506 20 5 FHBDRN O=C(CCC(=O)N1CC2(CCC2)[C@@H]1c1ccco1)c1cccc([N+](=O)[O-])c1 ZINC000456550506 946306186 /nfs/dbraw/zinc/30/61/86/946306186.db2.gz BEASNJPQCAFJQQ-IBGZPJMESA-N 0 0 368.389 3.905 20 5 FHBDRN COc1cc(N2CC(c3ncc(C4CC4)cn3)C2)c(Cl)cc1[N+](=O)[O-] ZINC000894902338 946313378 /nfs/dbraw/zinc/31/33/78/946313378.db2.gz KFTGAUSXSGDCLV-UHFFFAOYSA-N 0 0 360.801 3.528 20 5 FHBDRN O=C(OCc1cccc([N+](=O)[O-])c1)c1cc(F)ccc1Br ZINC000018965976 946330134 /nfs/dbraw/zinc/33/01/34/946330134.db2.gz NBTUHUSOJYQWEW-UHFFFAOYSA-N 0 0 354.131 3.853 20 5 FHBDRN Cc1cccc(NC2CCN(C(=O)c3cc(C)cc([N+](=O)[O-])c3)CC2)c1 ZINC000151888763 946331106 /nfs/dbraw/zinc/33/11/06/946331106.db2.gz FQKQVXOGUYOYEC-UHFFFAOYSA-N 0 0 353.422 3.928 20 5 FHBDRN C[C@@H](NC(=O)c1cnn(-c2ccccc2Cl)c1)c1cccc([N+](=O)[O-])c1 ZINC000109559494 946333006 /nfs/dbraw/zinc/33/30/06/946333006.db2.gz QSZKGPRJUJENJP-GFCCVEGCSA-N 0 0 370.796 3.925 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@](C)(CO)C1CCCCC1 ZINC000444318082 946346974 /nfs/dbraw/zinc/34/69/74/946346974.db2.gz XAUCXRLKYJITLE-OXQOHEQNSA-N 0 0 362.470 3.611 20 5 FHBDRN CC(C)(C)OC(=O)NC1CCC(Nc2c(F)cccc2[N+](=O)[O-])CC1 ZINC000310591328 946348772 /nfs/dbraw/zinc/34/87/72/946348772.db2.gz HRMYWBVIPMRPFC-UHFFFAOYSA-N 0 0 353.394 3.982 20 5 FHBDRN CN(C(=O)c1cc([N+](=O)[O-])ccc1SCC1CCCC1)[C@@H]1CCOC1 ZINC000541621690 946357888 /nfs/dbraw/zinc/35/78/88/946357888.db2.gz JXDMJNUXUYDEPI-OAHLLOKOSA-N 0 0 364.467 3.738 20 5 FHBDRN Cc1nn(C)c(C(=O)N2CCC[C@@H](C)[C@H]2c2ccc(C)cc2)c1[N+](=O)[O-] ZINC000151397150 946362785 /nfs/dbraw/zinc/36/27/85/946362785.db2.gz WPPFWDIGQQHCPU-CJNGLKHVSA-N 0 0 356.426 3.559 20 5 FHBDRN CCOC(=O)c1ccc(C(=O)Oc2cc([N+](=O)[O-])c(Cl)cc2C)cc1 ZINC001126119216 946375224 /nfs/dbraw/zinc/37/52/24/946375224.db2.gz DGGSFHQOWNIIMU-UHFFFAOYSA-N 0 0 363.753 3.953 20 5 FHBDRN Cc1cc(F)ccc1-c1noc(-c2ccn(-c3ccccc3[N+](=O)[O-])n2)n1 ZINC000545674950 946377353 /nfs/dbraw/zinc/37/73/53/946377353.db2.gz FYRQLZOTXGDUKG-UHFFFAOYSA-N 0 0 365.324 3.945 20 5 FHBDRN COc1ccc([C@H]2CCCN2c2ccc([N+](=O)[O-])c3cnccc32)nc1 ZINC000897295753 946392669 /nfs/dbraw/zinc/39/26/69/946392669.db2.gz IJQJTLLLXSYVGD-LJQANCHMSA-N 0 0 350.378 3.888 20 5 FHBDRN CN(CC1(c2ccccc2)CC1)C(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000444376177 946400311 /nfs/dbraw/zinc/40/03/11/946400311.db2.gz LFVKPJYYNGVEBF-UHFFFAOYSA-N 0 0 367.449 3.977 20 5 FHBDRN CCCc1[nH]nc(C(=O)Nc2cc(-c3ccccc3)ns2)c1[N+](=O)[O-] ZINC000475485991 946409403 /nfs/dbraw/zinc/40/94/03/946409403.db2.gz INXDESBFHBTRAH-UHFFFAOYSA-N 0 0 357.395 3.646 20 5 FHBDRN Cc1c(C(=O)N(Cc2ccccc2)CC2(O)CCCC2)cccc1[N+](=O)[O-] ZINC000475491783 946425780 /nfs/dbraw/zinc/42/57/80/946425780.db2.gz JFRGSTSWQPWQCV-UHFFFAOYSA-N 0 0 368.433 3.851 20 5 FHBDRN COc1ccc(OCCN(C)Cc2ccc(F)cc2Cl)c([N+](=O)[O-])c1 ZINC000441317388 946430501 /nfs/dbraw/zinc/43/05/01/946430501.db2.gz XGMJATNLWVZGLY-UHFFFAOYSA-N 0 0 368.792 3.907 20 5 FHBDRN O=C(N[C@H]1COc2ccc(F)cc21)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000444322884 946434612 /nfs/dbraw/zinc/43/46/12/946434612.db2.gz WANJWKKKCLLFGJ-IBGZPJMESA-N 0 0 374.371 3.684 20 5 FHBDRN Cc1sc(S(=O)(=O)N2CCCc3cc(C)cc(F)c32)cc1[N+](=O)[O-] ZINC000466973859 946435616 /nfs/dbraw/zinc/43/56/16/946435616.db2.gz PDXGYKGTRGMARP-UHFFFAOYSA-N 0 0 370.427 3.554 20 5 FHBDRN COCCOc1cc(C)ccc1NC(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000047854992 946444314 /nfs/dbraw/zinc/44/43/14/946444314.db2.gz QEZUMMQCXTWLFS-UHFFFAOYSA-N 0 0 373.409 3.592 20 5 FHBDRN O=c1[nH]c2ccccc2cc1CSCCOc1cccc([N+](=O)[O-])c1 ZINC000111379852 946445727 /nfs/dbraw/zinc/44/57/27/946445727.db2.gz RMDKRMAWWNXLJD-UHFFFAOYSA-N 0 0 356.403 3.749 20 5 FHBDRN O=C(Nc1ccnn1CC1CC1)c1cc(F)c(Cl)c([N+](=O)[O-])c1Cl ZINC000897000575 946445840 /nfs/dbraw/zinc/44/58/40/946445840.db2.gz BLGRENMHVRQQTC-UHFFFAOYSA-N 0 0 373.171 3.900 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])[nH]1)N1CCC(c2ccccc2C(F)(F)F)CC1 ZINC000475126521 946446685 /nfs/dbraw/zinc/44/66/85/946446685.db2.gz FFIZUHHSPNFKES-UHFFFAOYSA-N 0 0 367.327 3.962 20 5 FHBDRN O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCOc2ccc(F)cc21 ZINC000088264730 946446937 /nfs/dbraw/zinc/44/69/37/946446937.db2.gz VWZAHSKWHZPKBO-UHFFFAOYSA-N 0 0 358.350 3.988 20 5 FHBDRN Cc1ccsc1[C@H]1C[C@H]1C(=O)N=c1cc(-c2cccc([N+](=O)[O-])c2)[nH][nH]1 ZINC000440145076 946457649 /nfs/dbraw/zinc/45/76/49/946457649.db2.gz KUCJDBBWUGSHIR-UONOGXRCSA-N 0 0 368.418 3.519 20 5 FHBDRN C[C@@H](OC(=O)c1cnn(Cc2ccccc2)c1)c1cccc([N+](=O)[O-])c1 ZINC000025122111 946470916 /nfs/dbraw/zinc/47/09/16/946470916.db2.gz VQRQVTADYMUVKM-CQSZACIVSA-N 0 0 351.362 3.758 20 5 FHBDRN CC[C@H](COC)Nc1ccc(C(=O)Nc2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000523087480 946484530 /nfs/dbraw/zinc/48/45/30/946484530.db2.gz HYRAIWFFORVZCW-OAHLLOKOSA-N 0 0 357.410 3.992 20 5 FHBDRN Cc1c(NC(=O)Nc2cnn(Cc3ccccc3)c2)cccc1[N+](=O)[O-] ZINC000048053225 946485206 /nfs/dbraw/zinc/48/52/06/946485206.db2.gz OTFPETGCDGMTQT-UHFFFAOYSA-N 0 0 351.366 3.792 20 5 FHBDRN CCCC[C@@H]1CCC[C@@H]1NC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000111599990 946489536 /nfs/dbraw/zinc/48/95/36/946489536.db2.gz FTMOHBXXRIAZRL-WBMJQRKESA-N 0 0 357.410 3.525 20 5 FHBDRN CC(C)c1ccc(C(=O)N[C@H]2CCCC[C@H]2n2cccn2)cc1[N+](=O)[O-] ZINC000473899290 946499698 /nfs/dbraw/zinc/49/96/98/946499698.db2.gz XNBZHPOFRPPZCT-DLBZAZTESA-N 0 0 356.426 3.828 20 5 FHBDRN C[C@H](NC(=O)C[C@H]1CCc2sccc2C1=O)c1ccccc1[N+](=O)[O-] ZINC000897307071 946501673 /nfs/dbraw/zinc/50/16/73/946501673.db2.gz GZCCJWHOPXCQJY-NWDGAFQWSA-N 0 0 358.419 3.669 20 5 FHBDRN Cc1c(NC(=O)NCc2coc(-c3cccs3)n2)cccc1[N+](=O)[O-] ZINC000043347482 946505863 /nfs/dbraw/zinc/50/58/63/946505863.db2.gz RKDJVFJJGDCRGG-UHFFFAOYSA-N 0 0 358.379 3.941 20 5 FHBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H](C)[C@H](OC)C1 ZINC000469873936 946527714 /nfs/dbraw/zinc/52/77/14/946527714.db2.gz GRJCCGIASYZYCJ-XJKSGUPXSA-N 0 0 366.483 3.984 20 5 FHBDRN Nc1ccc2c(c1)CCC[C@@H]2NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000186567906 946553894 /nfs/dbraw/zinc/55/38/94/946553894.db2.gz WZDRAJJOEKUFFJ-KRWDZBQOSA-N 0 0 366.421 3.559 20 5 FHBDRN C[C@H](CNC(=O)N1CC[C@H](C(F)(F)F)[C@@H]1C)c1ccccc1[N+](=O)[O-] ZINC000897064729 946558351 /nfs/dbraw/zinc/55/83/51/946558351.db2.gz WNIZINAQBPJWII-MDZLAQPJSA-N 0 0 359.348 3.681 20 5 FHBDRN CC(C)CN(CC(C)(C)C)C(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000475184830 946577122 /nfs/dbraw/zinc/57/71/22/946577122.db2.gz SFDYKJKCROVZLW-UHFFFAOYSA-N 0 0 358.442 3.925 20 5 FHBDRN COc1cc(Cc2noc(CCc3ccc(C)cc3)n2)ccc1[N+](=O)[O-] ZINC000545765408 946587356 /nfs/dbraw/zinc/58/73/56/946587356.db2.gz RARANMWCHVBMRO-UHFFFAOYSA-N 0 0 353.378 3.671 20 5 FHBDRN CS[C@H]1CCCCN(C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000129510601 946588425 /nfs/dbraw/zinc/58/84/25/946588425.db2.gz VECGNORYUTWATO-ZFWWWQNUSA-N 0 0 351.472 3.891 20 5 FHBDRN COc1ccc(Cl)cc1CCNC(=O)[C@@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1 ZINC001126141820 946595315 /nfs/dbraw/zinc/59/53/15/946595315.db2.gz QAYMWRNJWHFDPD-IAGOWNOFSA-N 0 0 374.824 3.719 20 5 FHBDRN CSc1cccc(C(=O)Nc2ccc(C(=O)NC(C)C)cc2)c1[N+](=O)[O-] ZINC000186194777 946596081 /nfs/dbraw/zinc/59/60/81/946596081.db2.gz LFUBGBNZEPOZCY-UHFFFAOYSA-N 0 0 373.434 3.707 20 5 FHBDRN CSc1cccc(C(=O)Nc2cccc(-c3n[nH]c(C)n3)c2)c1[N+](=O)[O-] ZINC000186200381 946597597 /nfs/dbraw/zinc/59/75/97/946597597.db2.gz KICUHCKWAQEULZ-UHFFFAOYSA-N 0 0 369.406 3.663 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](c1ccccc1)C1(CO)CCCC1 ZINC001143517590 946606564 /nfs/dbraw/zinc/60/65/64/946606564.db2.gz VNVDLCBYDCQPMW-LJQANCHMSA-N 0 0 368.433 3.927 20 5 FHBDRN CSc1cccc(C(=O)N2C[C@@H](C)Oc3cc(F)ccc32)c1[N+](=O)[O-] ZINC000186584961 946615195 /nfs/dbraw/zinc/61/51/95/946615195.db2.gz PRYRHVICBAGHCC-SNVBAGLBSA-N 0 0 362.382 3.884 20 5 FHBDRN CCCNC(=O)c1ccc(NC(=O)c2cccc(SC)c2[N+](=O)[O-])cc1 ZINC000186205184 946619124 /nfs/dbraw/zinc/61/91/24/946619124.db2.gz UEUCYQVXCOCWOD-UHFFFAOYSA-N 0 0 373.434 3.709 20 5 FHBDRN COc1ccc(C(=O)N2CCC[C@]2(C)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000186215438 946629941 /nfs/dbraw/zinc/62/99/41/946629941.db2.gz ABXOCNHEZGAAGF-HXUWFJFHSA-N 0 0 354.406 3.841 20 5 FHBDRN COc1ccc(O[C@H](C)CNC(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)cc1 ZINC000475553192 946637323 /nfs/dbraw/zinc/63/73/23/946637323.db2.gz FJTVIJXCPIYVHX-CQSZACIVSA-N 0 0 373.409 3.809 20 5 FHBDRN CCO[C@@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2SC)C12CCCC2 ZINC001126606228 946651744 /nfs/dbraw/zinc/65/17/44/946651744.db2.gz BSISSHUJIWXRFX-HZPDHXFCSA-N 0 0 364.467 3.784 20 5 FHBDRN Cc1cccc(C)c1NC(=O)CN(C)c1ccc2ncccc2c1[N+](=O)[O-] ZINC000112072649 946656553 /nfs/dbraw/zinc/65/65/53/946656553.db2.gz OZLZZEARKAJZAU-UHFFFAOYSA-N 0 0 364.405 3.835 20 5 FHBDRN CC(C)(CNC(=O)CSc1ccc([N+](=O)[O-])cc1)c1cccs1 ZINC000074648759 946657123 /nfs/dbraw/zinc/65/71/23/946657123.db2.gz ZOJIWVQDVGQSHL-UHFFFAOYSA-N 0 0 350.465 3.842 20 5 FHBDRN Cc1sc(C(=O)N2C[C@@H](C)O[C@H](c3ccc(F)cc3)C2)cc1[N+](=O)[O-] ZINC000151932621 946657420 /nfs/dbraw/zinc/65/74/20/946657420.db2.gz NHVYDTKLKMHIEM-BMIGLBTASA-N 0 0 364.398 3.706 20 5 FHBDRN COC(=O)c1sc(NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)cc1C ZINC000523102534 946662476 /nfs/dbraw/zinc/66/24/76/946662476.db2.gz OMRJSCQYCQCERX-UHFFFAOYSA-N 0 0 354.771 3.657 20 5 FHBDRN Cc1cc(-c2nc(-c3cccc(OCC(F)F)n3)no2)cc([N+](=O)[O-])c1 ZINC000545847513 946668525 /nfs/dbraw/zinc/66/85/25/946668525.db2.gz FYYSLWKSVYRRKS-UHFFFAOYSA-N 0 0 362.292 3.659 20 5 FHBDRN CC(=O)c1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2Br)cc1 ZINC000129503402 946671615 /nfs/dbraw/zinc/67/16/15/946671615.db2.gz BRTOCNXDILVWNI-UHFFFAOYSA-N 0 0 363.167 3.812 20 5 FHBDRN C[C@@H](NC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2)c1ccc2c(c1)CCCC2 ZINC000027805973 946675365 /nfs/dbraw/zinc/67/53/65/946675365.db2.gz BTADHFYOHWUTIN-GFCCVEGCSA-N 0 0 368.389 3.693 20 5 FHBDRN CC[C@H](Nc1cccc2c1CCN2C(=O)COC)c1cccc([N+](=O)[O-])c1 ZINC000186606007 946692160 /nfs/dbraw/zinc/69/21/60/946692160.db2.gz JWNBGYOFLKSDEW-KRWDZBQOSA-N 0 0 369.421 3.694 20 5 FHBDRN Cc1nn(C)c(Nc2cnn(-c3ccc(Cl)cc3Cl)c2)c1[N+](=O)[O-] ZINC000473919746 946701965 /nfs/dbraw/zinc/70/19/65/946701965.db2.gz PHRWPFJQKWGGLU-UHFFFAOYSA-N 0 0 367.196 3.873 20 5 FHBDRN Cc1c(C(=O)N(CC(C)C)CC(C)(C)C)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000475198548 946706796 /nfs/dbraw/zinc/70/67/96/946706796.db2.gz QTMDGEBXQRGUMN-UHFFFAOYSA-N 0 0 373.457 3.628 20 5 FHBDRN CC[C@H](C[C@H](C)CO)NC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000475218404 946719807 /nfs/dbraw/zinc/71/98/07/946719807.db2.gz WJMHYOSSIKJPIR-VHSXEESVSA-N 0 0 363.336 3.532 20 5 FHBDRN CC(C)(C)C[C@H](O)CNC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000475217596 946732555 /nfs/dbraw/zinc/73/25/55/946732555.db2.gz XKPWCZYLXWBBFG-JTQLQIEISA-N 0 0 363.336 3.532 20 5 FHBDRN C[C@@H](C[C@@H]1CCCO1)NC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000475217521 946733321 /nfs/dbraw/zinc/73/33/21/946733321.db2.gz WYISLUXBJPEVME-ONGXEEELSA-N 0 0 361.320 3.693 20 5 FHBDRN Cc1cc(C)n(-c2ccc(C(=O)Nc3cccc([N+](=O)[O-])c3)cc2F)n1 ZINC000112164193 946735379 /nfs/dbraw/zinc/73/53/79/946735379.db2.gz DNJZPLFYEVJPJO-UHFFFAOYSA-N 0 0 354.341 3.789 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H](C)CCc1cccn1C ZINC000074744803 946735344 /nfs/dbraw/zinc/73/53/44/946735344.db2.gz GQGZTQIFSSRALD-MRXNPFEDSA-N 0 0 372.469 3.875 20 5 FHBDRN O=C(Nc1ccccc1OCC1CC1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088390489 946739618 /nfs/dbraw/zinc/73/96/18/946739618.db2.gz KWMTXWISCFNUGZ-UHFFFAOYSA-N 0 0 367.405 3.974 20 5 FHBDRN CC[C@@H]1CN(C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CCS1 ZINC000475239127 946749166 /nfs/dbraw/zinc/74/91/66/946749166.db2.gz WDIRPSVRWXWMLR-SNVBAGLBSA-N 0 0 363.361 3.973 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)C[C@H]2CC(=O)Nc3ccccc32)cc1[N+](=O)[O-] ZINC001126610694 946749435 /nfs/dbraw/zinc/74/94/35/946749435.db2.gz HKVMZFJCHYWUOY-HIFRSBDPSA-N 0 0 367.405 3.597 20 5 FHBDRN Cc1ccccc1-n1cc(C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cn1 ZINC000112171302 946750493 /nfs/dbraw/zinc/75/04/93/946750493.db2.gz QLJOFVHZMUJCSH-AWEZNQCLSA-N 0 0 350.378 3.580 20 5 FHBDRN C[C@@H](NC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)[C@H]1CCCOC1 ZINC000475232589 946755263 /nfs/dbraw/zinc/75/52/63/946755263.db2.gz JVEYTUHYOORJPE-ZJUUUORDSA-N 0 0 361.320 3.550 20 5 FHBDRN N=C(N)N(c1ccc(F)cc1)c1c(Br)cc(F)cc1[N+](=O)[O-] ZINC001167992913 946768044 /nfs/dbraw/zinc/76/80/44/946768044.db2.gz SOQAMAWIFKVLPB-UHFFFAOYSA-N 0 0 371.141 3.667 20 5 FHBDRN O=[N+]([O-])C[C@@H](Oc1ccc(Br)c(OC(F)(F)F)c1)C1CC1 ZINC001227853105 946768747 /nfs/dbraw/zinc/76/87/47/946768747.db2.gz JOUOZHVTLZDPCF-LLVKDONJSA-N 0 0 370.121 3.782 20 5 FHBDRN COc1ccc2c(c1)OC[C@H]2CC(=O)Nc1cc([N+](=O)[O-])c(C)cc1C ZINC000536275220 946769701 /nfs/dbraw/zinc/76/97/01/946769701.db2.gz OYFVGGWWTLTQGA-CYBMUJFWSA-N 0 0 356.378 3.725 20 5 FHBDRN COc1ccc(C(=O)N(C)Cc2ccccc2[N+](=O)[O-])c(OCC(C)C)c1 ZINC000475259025 946770966 /nfs/dbraw/zinc/77/09/66/946770966.db2.gz IQSZTQPCLHWRRO-UHFFFAOYSA-N 0 0 372.421 3.910 20 5 FHBDRN CCO[C@@H](CCNc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-])C(C)C ZINC000074772232 946774596 /nfs/dbraw/zinc/77/45/96/946774596.db2.gz JBJSAEOIZCIMRV-KRWDZBQOSA-N 0 0 351.447 3.596 20 5 FHBDRN C[C@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccc(Br)cn1 ZINC000475248639 946775014 /nfs/dbraw/zinc/77/50/14/946775014.db2.gz SIWHJDLTNSXYRO-VIFPVBQESA-N 0 0 365.187 3.635 20 5 FHBDRN CCOC(=O)c1ccnc(N(C)Cc2cccc3ccccc32)c1[N+](=O)[O-] ZINC000523112904 946775155 /nfs/dbraw/zinc/77/51/55/946775155.db2.gz KVQBJCJKKKSWBK-UHFFFAOYSA-N 0 0 365.389 3.956 20 5 FHBDRN C[C@@H](N[C@@H](c1cnn(C)c1)c1ccc(F)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000186647556 946781115 /nfs/dbraw/zinc/78/11/15/946781115.db2.gz GZWUPFUERLATHP-BFUOFWGJSA-N 0 0 354.385 3.908 20 5 FHBDRN CCCOc1ccc([C@@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)cc1OC ZINC000048503101 946781785 /nfs/dbraw/zinc/78/17/85/946781785.db2.gz MKRIFEXFXAZEKK-CYBMUJFWSA-N 0 0 358.394 3.883 20 5 FHBDRN CCOC(=O)c1ccnc(N[C@H](C)CCc2ccc(OC)cc2)c1[N+](=O)[O-] ZINC000523112472 946782913 /nfs/dbraw/zinc/78/29/13/946782913.db2.gz GPTFVEIQDXMKFP-CYBMUJFWSA-N 0 0 373.409 3.608 20 5 FHBDRN C[C@@H](C(=O)Nc1nccnc1-c1ccccc1)c1ccc([N+](=O)[O-])cc1F ZINC001271731887 946791404 /nfs/dbraw/zinc/79/14/04/946791404.db2.gz JUYYMDNABAMZDM-GFCCVEGCSA-N 0 0 366.352 3.933 20 5 FHBDRN Cc1c(C(=O)N2Cc3ccc([N+](=O)[O-])cc3C2)ccn1Cc1ccccc1 ZINC001126613958 946807383 /nfs/dbraw/zinc/80/73/83/946807383.db2.gz ZCNXTXUHDGJUDP-UHFFFAOYSA-N 0 0 361.401 3.909 20 5 FHBDRN COc1cccc([C@@H]2C[C@@H](C)CN2C(=O)COc2ccccc2[N+](=O)[O-])c1 ZINC000544322455 946815640 /nfs/dbraw/zinc/81/56/40/946815640.db2.gz LZZQTBTWSOTEJJ-KDOFPFPSSA-N 0 0 370.405 3.592 20 5 FHBDRN COC(=O)c1cccc(CNc2cc(C)nc3c2cccc3[N+](=O)[O-])c1 ZINC000302001299 946819431 /nfs/dbraw/zinc/81/94/31/946819431.db2.gz JCYWBAGYQVSKPD-UHFFFAOYSA-N 0 0 351.362 3.850 20 5 FHBDRN CCOc1ccccc1OCC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000129760239 946822288 /nfs/dbraw/zinc/82/22/88/946822288.db2.gz SRVJSJDPBNQQDR-UHFFFAOYSA-N 0 0 370.405 3.564 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1COC(=O)[C@H](C)Oc1cccc(Cl)c1 ZINC000026100985 946823798 /nfs/dbraw/zinc/82/37/98/946823798.db2.gz UNEUNGYBHXIDRP-NSHDSACASA-N 0 0 365.769 3.768 20 5 FHBDRN COc1ccc(C[C@H](C)C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000186304436 946829373 /nfs/dbraw/zinc/82/93/73/946829373.db2.gz PXZQRQIURXBZGY-LBPRGKRZSA-N 0 0 362.813 3.752 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](c2ccccc2)C(F)(F)F)c1 ZINC000067549342 946830499 /nfs/dbraw/zinc/83/04/99/946830499.db2.gz VMCQUHFGVNQJDY-AWEZNQCLSA-N 0 0 354.284 3.637 20 5 FHBDRN Cc1nc(NC(=O)c2cc(C3CC3)nn2-c2ccccc2)ccc1[N+](=O)[O-] ZINC000475305784 946847604 /nfs/dbraw/zinc/84/76/04/946847604.db2.gz ZIBXKXASMGCIKQ-UHFFFAOYSA-N 0 0 363.377 3.614 20 5 FHBDRN COc1ccc(CNC(=O)NC2(Cc3ccccc3)CCC2)cc1[N+](=O)[O-] ZINC000473953218 946862314 /nfs/dbraw/zinc/86/23/14/946862314.db2.gz QOHCSFVNAYMNSC-UHFFFAOYSA-N 0 0 369.421 3.568 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N(C)Cc1c(F)cccc1F ZINC000511901635 946869510 /nfs/dbraw/zinc/86/95/10/946869510.db2.gz POJRHPUAUPNEKL-UHFFFAOYSA-N 0 0 350.321 3.544 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCCC1CCOCC1 ZINC000458882006 946887096 /nfs/dbraw/zinc/88/70/96/946887096.db2.gz HYFUXEWVPFARDP-UHFFFAOYSA-N 0 0 363.458 3.722 20 5 FHBDRN COc1ccc(CNC(=O)Nc2c(C)cccc2SC)cc1[N+](=O)[O-] ZINC000473967025 946899731 /nfs/dbraw/zinc/89/97/31/946899731.db2.gz FWDVWHVVFZCIQE-UHFFFAOYSA-N 0 0 361.423 3.955 20 5 FHBDRN CC(C)[C@@H](Oc1ccc(Cl)cc1)C(=O)NCc1cccc([N+](=O)[O-])c1 ZINC001126172827 946909485 /nfs/dbraw/zinc/90/94/85/946909485.db2.gz JXQUVCIWTXTTKT-QGZVFWFLSA-N 0 0 362.813 3.968 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1C[C@@H]1c1cccc(F)c1F ZINC000186324381 946912439 /nfs/dbraw/zinc/91/24/39/946912439.db2.gz NMLVPTHTLSMWKW-CHWSQXEVSA-N 0 0 366.751 3.946 20 5 FHBDRN C[C@@H]1c2c(F)cccc2CCN1C(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000523145016 946912688 /nfs/dbraw/zinc/91/26/88/946912688.db2.gz KPUXASWLHPESQQ-CYBMUJFWSA-N 0 0 357.385 3.682 20 5 FHBDRN COc1ccc(C(=O)Nc2cc([N+](=O)[O-])ccc2OC)c(OCC(C)C)c1 ZINC000475344744 946913525 /nfs/dbraw/zinc/91/35/25/946913525.db2.gz ZURYYOFLVRTSGY-UHFFFAOYSA-N 0 0 374.393 3.899 20 5 FHBDRN CC(C)(NC(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1)c1cccc(F)c1 ZINC001126174191 946915562 /nfs/dbraw/zinc/91/55/62/946915562.db2.gz QVGMOPSRCNDWCS-UHFFFAOYSA-N 0 0 368.368 3.585 20 5 FHBDRN C[C@H](c1ccccc1)[C@@H](CO)NC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000112606930 946917749 /nfs/dbraw/zinc/91/77/49/946917749.db2.gz CKOCAPQCQOBJMF-BDJLRTHQSA-N 0 0 363.801 3.534 20 5 FHBDRN COc1cccc(NCc2cc(Cl)c3c(c2)OCCO3)c1[N+](=O)[O-] ZINC000475346364 946927174 /nfs/dbraw/zinc/92/71/74/946927174.db2.gz CRBUBIJGHOWMMG-UHFFFAOYSA-N 0 0 350.758 3.640 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNCc1ccccc1Br ZINC000048820785 946929224 /nfs/dbraw/zinc/92/92/24/946929224.db2.gz WGPBHFJWLGKOKW-UHFFFAOYSA-N 0 0 351.200 3.656 20 5 FHBDRN CCCN(C(=O)Cn1cc([N+](=O)[O-])cn1)[C@@H](C)c1cc2ccccc2o1 ZINC000053370920 946945672 /nfs/dbraw/zinc/94/56/72/946945672.db2.gz BZJXZXPKTHUMBQ-ZDUSSCGKSA-N 0 0 356.382 3.537 20 5 FHBDRN C[C@@H]1CCN(C(=O)CSc2ccc([N+](=O)[O-])cc2)c2c(O)cccc21 ZINC000186334306 946948697 /nfs/dbraw/zinc/94/86/97/946948697.db2.gz AFKOUXWETVCEBL-GFCCVEGCSA-N 0 0 358.419 3.933 20 5 FHBDRN CC(C)(C(=O)N1CCS[C@H]2CCCC[C@H]21)c1ccc([N+](=O)[O-])cc1F ZINC000546539863 946949158 /nfs/dbraw/zinc/94/91/58/946949158.db2.gz WSJUKLRTWCYUJE-CVEARBPZSA-N 0 0 366.458 3.898 20 5 FHBDRN O=C(Nc1cnn(-c2ccccc2F)c1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000121466328 946968901 /nfs/dbraw/zinc/96/89/01/946968901.db2.gz VFFTYQVSHRHIPG-UHFFFAOYSA-N 0 0 360.732 3.825 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)c1cccc(OC(F)F)c1 ZINC000186343184 946970745 /nfs/dbraw/zinc/97/07/45/946970745.db2.gz WOKMDFLGDSTAKL-UHFFFAOYSA-N 0 0 356.712 3.780 20 5 FHBDRN CC(C)[C@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])cc2Br)C1 ZINC000444517413 946971957 /nfs/dbraw/zinc/97/19/57/946971957.db2.gz AYMMUDOWICFMRA-NSHDSACASA-N 0 0 355.232 3.866 20 5 FHBDRN CN(CCOC(C)(C)C)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000613860787 946973843 /nfs/dbraw/zinc/97/38/43/946973843.db2.gz WJLHMWWTKKNFAF-UHFFFAOYSA-N 0 0 363.336 3.892 20 5 FHBDRN CCOC(C)(C)CNC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 ZINC000444525403 946974358 /nfs/dbraw/zinc/97/43/58/946974358.db2.gz RPVRZRJKJOGNHY-UHFFFAOYSA-N 0 0 358.394 3.932 20 5 FHBDRN COc1ccc(CNC(=O)[C@H](C)c2cn(C)c3ccccc23)cc1[N+](=O)[O-] ZINC000475386416 947004021 /nfs/dbraw/zinc/00/40/21/947004021.db2.gz HNPCXDJWKBLTEG-CYBMUJFWSA-N 0 0 367.405 3.515 20 5 FHBDRN C[C@@H](CNC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)c1ccncc1 ZINC000613862187 947005551 /nfs/dbraw/zinc/00/55/51/947005551.db2.gz JKXZWXJIJVRZDX-JTQLQIEISA-N 0 0 368.315 3.934 20 5 FHBDRN COc1c(C(=O)NCC(C)(C)c2cccc(Cl)c2)cccc1[N+](=O)[O-] ZINC000475389103 947008790 /nfs/dbraw/zinc/00/87/90/947008790.db2.gz KNHXYVASRGEQRC-UHFFFAOYSA-N 0 0 362.813 3.964 20 5 FHBDRN C[C@@H](C[C@H]1CCOC1)NC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000613862156 947010088 /nfs/dbraw/zinc/01/00/88/947010088.db2.gz FVMLDCORRIBUDZ-VHSXEESVSA-N 0 0 361.320 3.550 20 5 FHBDRN C[C@H](C[C@H]1CCOC1)NC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000613862147 947010371 /nfs/dbraw/zinc/01/03/71/947010371.db2.gz FVMLDCORRIBUDZ-NXEZZACHSA-N 0 0 361.320 3.550 20 5 FHBDRN CCCN([C@H]1CCc2ccccc2C1)S(=O)(=O)c1ccccc1[N+](=O)[O-] ZINC000511924731 947010432 /nfs/dbraw/zinc/01/04/32/947010432.db2.gz FOMRCPOBJRFNMY-KRWDZBQOSA-N 0 0 374.462 3.553 20 5 FHBDRN CCCN([C@@H]1CCc2ccccc2C1)S(=O)(=O)c1cccc([N+](=O)[O-])c1 ZINC000511925844 947014470 /nfs/dbraw/zinc/01/44/70/947014470.db2.gz IFXZFZUMCUGJBB-QGZVFWFLSA-N 0 0 374.462 3.553 20 5 FHBDRN O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCCC12CCC2 ZINC000444617215 947032497 /nfs/dbraw/zinc/03/24/97/947032497.db2.gz PUXNNWZWIJDZTM-UHFFFAOYSA-N 0 0 371.359 3.961 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N1C[C@@H](C)C[C@@H]1c1cccnc1 ZINC000186354180 947040190 /nfs/dbraw/zinc/04/01/90/947040190.db2.gz MOMFNWALLQKRKR-BLLLJJGKSA-N 0 0 356.382 3.613 20 5 FHBDRN O=C(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1cc2cc(Cl)ccc2o1 ZINC000444636530 947048895 /nfs/dbraw/zinc/04/88/95/947048895.db2.gz NQPVENJVPQGNEJ-UHFFFAOYSA-N 0 0 370.752 3.801 20 5 FHBDRN CSCCCCCNc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1 ZINC000186359915 947049984 /nfs/dbraw/zinc/04/99/84/947049984.db2.gz GSPIECZITYQPKD-UHFFFAOYSA-N 0 0 351.472 3.776 20 5 FHBDRN COCCC1(CNC(=O)N(C)Cc2ccccc2[N+](=O)[O-])CCCCC1 ZINC000186355159 947050961 /nfs/dbraw/zinc/05/09/61/947050961.db2.gz VFGASXAWWOMLEQ-UHFFFAOYSA-N 0 0 363.458 3.723 20 5 FHBDRN CC(C)(CCC(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccccc1 ZINC000444631559 947062268 /nfs/dbraw/zinc/06/22/68/947062268.db2.gz AFENURMGBRKMGN-UHFFFAOYSA-N 0 0 366.421 3.845 20 5 FHBDRN Cc1ccccc1[C@@H]1CN(Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)[C@H](C)CO1 ZINC000444655254 947074497 /nfs/dbraw/zinc/07/44/97/947074497.db2.gz SMUWFTLHBRPZKT-KUHUBIRLSA-N 0 0 366.421 3.742 20 5 FHBDRN O=C(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)C1(Cc2ccccc2)CCC1 ZINC000444638898 947080706 /nfs/dbraw/zinc/08/07/06/947080706.db2.gz XESLGSHHTFBIQT-UHFFFAOYSA-N 0 0 364.405 3.500 20 5 FHBDRN O=C(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@H]1C[C@@H]1c1ccccc1Cl ZINC000444639206 947080722 /nfs/dbraw/zinc/08/07/22/947080722.db2.gz YHVUHSAYXLKCHF-OLZOCXBDSA-N 0 0 370.796 3.544 20 5 FHBDRN CCCN(C(=O)CC1(CC(=O)OC)CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000441428589 947089120 /nfs/dbraw/zinc/08/91/20/947089120.db2.gz KYUYIEHTHZGKAA-UHFFFAOYSA-N 0 0 362.426 3.851 20 5 FHBDRN O=C(c1c[nH]c(=O)c([N+](=O)[O-])c1)N1CCCC[C@H]1c1cccc(Cl)c1 ZINC000444669912 947093744 /nfs/dbraw/zinc/09/37/44/947093744.db2.gz XIDUCWYHZIIMTA-AWEZNQCLSA-N 0 0 361.785 3.716 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1NC(=O)CN(C)CC1(c2ccccc2)CC1 ZINC000444670932 947095488 /nfs/dbraw/zinc/09/54/88/947095488.db2.gz BTKCOHTYEBREJZ-UHFFFAOYSA-N 0 0 353.422 3.505 20 5 FHBDRN C[C@@H](NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ncc(-c2ccccc2)o1 ZINC000444678177 947103133 /nfs/dbraw/zinc/10/31/33/947103133.db2.gz YDVOGTLGTWNNAI-GFCCVEGCSA-N 0 0 363.377 3.977 20 5 FHBDRN O=C(OCc1ccc(Cl)c([N+](=O)[O-])c1)[C@@H]1CCCN1c1ccccc1 ZINC000783581406 947129792 /nfs/dbraw/zinc/12/97/92/947129792.db2.gz AJWHSGGRDNVDTJ-INIZCTEOSA-N 0 0 360.797 3.960 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)N(C)Cc1cc(C)cc(C)c1 ZINC000444708335 947136559 /nfs/dbraw/zinc/13/65/59/947136559.db2.gz ZXYMDCANYAXOSG-HNNXBMFYSA-N 0 0 371.437 3.679 20 5 FHBDRN COc1cc(C(=O)NCc2sccc2C)c([N+](=O)[O-])cc1OC(F)F ZINC000026000346 947143517 /nfs/dbraw/zinc/14/35/17/947143517.db2.gz BOJCMCCJDYKILV-UHFFFAOYSA-N 0 0 372.349 3.505 20 5 FHBDRN Cc1cc(NCc2cccc(N3CCC3=O)c2)c2cccc([N+](=O)[O-])c2n1 ZINC000440530541 947144012 /nfs/dbraw/zinc/14/40/12/947144012.db2.gz BBSVFBLDTDSFRP-UHFFFAOYSA-N 0 0 362.389 3.800 20 5 FHBDRN CCCN(C(=O)[C@H]1Oc2ccccc2O[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000441433724 947144758 /nfs/dbraw/zinc/14/47/58/947144758.db2.gz GZZQVYSHNCXDQJ-UGSOOPFHSA-N 0 0 356.378 3.566 20 5 FHBDRN O=C1CCN1c1cccc(CNc2ccc([N+](=O)[O-])cc2OC(F)F)c1 ZINC000440532502 947145553 /nfs/dbraw/zinc/14/55/53/947145553.db2.gz AGRUBSGDRUVKNV-UHFFFAOYSA-N 0 0 363.320 3.545 20 5 FHBDRN CC(C)[C@H]1CCCN(C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C1 ZINC000444362146 947172279 /nfs/dbraw/zinc/17/22/79/947172279.db2.gz JCENDJFMMHEGTQ-KRWDZBQOSA-N 0 0 359.470 3.706 20 5 FHBDRN CCSc1cccc(NC(=O)c2ccnc(-n3ccc([N+](=O)[O-])n3)c2)c1 ZINC001126190914 947176408 /nfs/dbraw/zinc/17/64/08/947176408.db2.gz JDBPMWHRIKDSGI-UHFFFAOYSA-N 0 0 369.406 3.540 20 5 FHBDRN COc1cc(C(=O)Nc2cc(-c3nc(C)no3)ccc2C)ccc1[N+](=O)[O-] ZINC000523381197 947202605 /nfs/dbraw/zinc/20/26/05/947202605.db2.gz NKAWZCXCGITUAW-UHFFFAOYSA-N 0 0 368.349 3.523 20 5 FHBDRN O=[N+]([O-])c1c(Nc2ccc(O[C@@H]3CCCC[C@H]3O)cc2)nc2sccn21 ZINC000440548439 947213294 /nfs/dbraw/zinc/21/32/94/947213294.db2.gz SDHWOLBOCPHGEX-ZIAGYGMSSA-N 0 0 374.422 3.730 20 5 FHBDRN Cc1cccc(OCCC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)c1 ZINC000121290653 947222492 /nfs/dbraw/zinc/22/24/92/947222492.db2.gz BXZDEOJYQIADPL-UHFFFAOYSA-N 0 0 366.320 3.912 20 5 FHBDRN Cc1cccc(OS(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2C)c1Cl ZINC001211684066 947232753 /nfs/dbraw/zinc/23/27/53/947232753.db2.gz WELPZCUJHDZQAH-UHFFFAOYSA-N 0 0 355.799 3.941 20 5 FHBDRN O=C(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)Nc1cccc2c1CCCC2 ZINC000444822054 947236114 /nfs/dbraw/zinc/23/61/14/947236114.db2.gz GCQNNKGBBYBPAA-UHFFFAOYSA-N 0 0 365.393 3.672 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CCCc3c(O)cccc32)c1 ZINC000190278980 947237313 /nfs/dbraw/zinc/23/73/13/947237313.db2.gz FGVCWTSOYIYABC-OAHLLOKOSA-N 0 0 358.419 3.830 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)Nc1c(F)cccc1F ZINC000152048314 947238143 /nfs/dbraw/zinc/23/81/43/947238143.db2.gz KRPMQCGRHWIQAU-UHFFFAOYSA-N 0 0 371.137 3.817 20 5 FHBDRN Cc1ccc(CNC(=O)c2sc(Br)cc2[N+](=O)[O-])cc1 ZINC000444829051 947243377 /nfs/dbraw/zinc/24/33/77/947243377.db2.gz QDGWQBVZSLFAHW-UHFFFAOYSA-N 0 0 355.213 3.657 20 5 FHBDRN COc1cc(NC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)cc(OC)c1 ZINC000444839160 947272318 /nfs/dbraw/zinc/27/23/18/947272318.db2.gz YABZUUSGSYNSBD-UHFFFAOYSA-N 0 0 374.396 3.951 20 5 FHBDRN O=C(c1sc(Br)cc1[N+](=O)[O-])N1CCc2ccccc21 ZINC000444844163 947276533 /nfs/dbraw/zinc/27/65/33/947276533.db2.gz BZVNCJUQWJWAMZ-UHFFFAOYSA-N 0 0 353.197 3.622 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NC[C@@H]1Cc2ccccc2N(C)C1 ZINC000444865905 947291286 /nfs/dbraw/zinc/29/12/86/947291286.db2.gz SPZQLTBTEVAZSA-HNNXBMFYSA-N 0 0 368.437 3.642 20 5 FHBDRN O=[N+]([O-])c1cccnc1NCc1cnn(-c2ccc(Br)cc2)c1 ZINC000444870183 947296460 /nfs/dbraw/zinc/29/64/60/947296460.db2.gz KIZYZZSEBNVSEL-UHFFFAOYSA-N 0 0 374.198 3.550 20 5 FHBDRN O=[N+]([O-])c1ccc(NCc2cnn(-c3ccc(Br)cc3)c2)cn1 ZINC000444877859 947302650 /nfs/dbraw/zinc/30/26/50/947302650.db2.gz PHUMCFURJQGKPG-UHFFFAOYSA-N 0 0 374.198 3.550 20 5 FHBDRN Cc1ccc(NCCCNC(=O)CCc2ccccc2C)c([N+](=O)[O-])c1 ZINC000523512333 947323650 /nfs/dbraw/zinc/32/36/50/947323650.db2.gz VZMVEDGEPZRTFT-UHFFFAOYSA-N 0 0 355.438 3.763 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@H](C)Sc1ccccc1 ZINC000444903998 947324140 /nfs/dbraw/zinc/32/41/40/947324140.db2.gz QPBULTBCHPGABX-LBPRGKRZSA-N 0 0 361.423 3.906 20 5 FHBDRN CCS[C@@H]1CCCC[C@@H]1NC(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000444895120 947332722 /nfs/dbraw/zinc/33/27/22/947332722.db2.gz JTCFKKMGTSPVMD-DZGCQCFKSA-N 0 0 353.444 3.789 20 5 FHBDRN CCCOc1ccc(CNC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000523503913 947334845 /nfs/dbraw/zinc/33/48/45/947334845.db2.gz SZGILBPRJBRWNB-UHFFFAOYSA-N 0 0 356.422 3.978 20 5 FHBDRN CCN(CC)C(=O)c1ccc(CNc2c(F)cc([N+](=O)[O-])cc2F)cc1 ZINC000440591046 947335046 /nfs/dbraw/zinc/33/50/46/947335046.db2.gz NOAAGNXXTCETKH-UHFFFAOYSA-N 0 0 363.364 3.967 20 5 FHBDRN C[C@@H]1CCC[C@@H](C)C1NC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000523504165 947335215 /nfs/dbraw/zinc/33/52/15/947335215.db2.gz ICNWOHUWFNXDHU-NXEZZACHSA-N 0 0 355.232 3.912 20 5 FHBDRN COc1ccc(N(Cc2ccco2)C(=O)c2ccc([N+](=O)[O-])n2C)cc1F ZINC000523505856 947337396 /nfs/dbraw/zinc/33/73/96/947337396.db2.gz LYBKVXCCFWEBQW-UHFFFAOYSA-N 0 0 373.340 3.521 20 5 FHBDRN O=C(c1cc(C2CCCCC2)n[nH]1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000125691858 947353252 /nfs/dbraw/zinc/35/32/52/947353252.db2.gz RVFCNBFHXPZMBF-UHFFFAOYSA-N 0 0 354.410 3.564 20 5 FHBDRN NC(=O)c1ccc(N2Cc3ccccc3-c3ccccc3C2)c([N+](=O)[O-])c1 ZINC000523551607 947365944 /nfs/dbraw/zinc/36/59/44/947365944.db2.gz WWDLYWGZZVPLGD-UHFFFAOYSA-N 0 0 359.385 3.881 20 5 FHBDRN CSc1ccc(C)c(C(=O)Nc2ccc3cc([N+](=O)[O-])ccc3n2)c1 ZINC000440622322 947388277 /nfs/dbraw/zinc/38/82/77/947388277.db2.gz HAFMJFJBJSAEGD-UHFFFAOYSA-N 0 0 353.403 3.848 20 5 FHBDRN CNc1ccc(C(=O)N2CC3(CCC3)c3c2cccc3F)cc1[N+](=O)[O-] ZINC000523575641 947394516 /nfs/dbraw/zinc/39/45/16/947394516.db2.gz XANWRHSPQOXHIF-UHFFFAOYSA-N 0 0 355.369 3.858 20 5 FHBDRN CC[C@@H](NC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)c1nc(C)cs1 ZINC000088559289 947401040 /nfs/dbraw/zinc/40/10/40/947401040.db2.gz ZSZGMJGVKMANKY-OAHLLOKOSA-N 0 0 360.439 3.579 20 5 FHBDRN Cn1cc(C[C@H]2CCN(c3c(Cl)cc([N+](=O)[O-])cc3Cl)C2)cn1 ZINC000126162262 947406825 /nfs/dbraw/zinc/40/68/25/947406825.db2.gz CTHVAZPMFBZKOA-SNVBAGLBSA-N 0 0 355.225 3.704 20 5 FHBDRN CC[C@@H](CNC(=O)Cc1cccc([N+](=O)[O-])c1)Oc1cccc(Cl)c1 ZINC000440629325 947414141 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FHBDRN CC[C@@H](C)[C@@H](CNC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C)OC ZINC000458959107 947526444 /nfs/dbraw/zinc/52/64/44/947526444.db2.gz FSEVOAMHFZNQMU-RHSMWYFYSA-N 0 0 351.447 3.576 20 5 FHBDRN C[C@](O)(C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C(F)(F)F ZINC000536336905 947533458 /nfs/dbraw/zinc/53/34/58/947533458.db2.gz QGSFFSBILUURHN-AWEZNQCLSA-N 0 0 360.357 3.726 20 5 FHBDRN CC1(C)CN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)C[C@]2(C[C@@H]3CC[C@H]2C3)O1 ZINC000440672849 947535094 /nfs/dbraw/zinc/53/50/94/947535094.db2.gz QYGAXYCNWSZSPA-NQCMUKECSA-N 0 0 356.426 3.645 20 5 FHBDRN CC(C)CSCCNC(=O)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000445146362 947536817 /nfs/dbraw/zinc/53/68/17/947536817.db2.gz OTYWQHZYANRZNE-UHFFFAOYSA-N 0 0 354.475 3.800 20 5 FHBDRN CC[C@@H](C)n1[nH]c(=NC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)cc1C ZINC000445135557 947544959 /nfs/dbraw/zinc/54/49/59/947544959.db2.gz NADGTSAGURTNIU-CYBMUJFWSA-N 0 0 374.444 3.831 20 5 FHBDRN CC(C)Cn1cc(CNCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)cn1 ZINC000278858399 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Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)CCc1nc(C2CCCC2)no1 ZINC000128523642 567828209 /nfs/dbraw/zinc/82/82/09/567828209.db2.gz QZAXYUPRQPEOOX-UHFFFAOYSA-N 0 0 358.398 3.824 20 5 FHBDRN O=C([C@@H]1CC12CCSCC2)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452869531 567832805 /nfs/dbraw/zinc/83/28/05/567832805.db2.gz RCTBUAJUWAINRP-RDJZCZTQSA-N 0 0 360.479 3.834 20 5 FHBDRN O=C(c1cc(=O)[nH]c(C2CC2)c1)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452865291 567832986 /nfs/dbraw/zinc/83/29/86/567832986.db2.gz WUIARUOWUBZJJW-OAHLLOKOSA-N 0 0 367.405 3.593 20 5 FHBDRN CC(=O)c1c(C)[nH]c(C(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)c1C ZINC000452865934 567833272 /nfs/dbraw/zinc/83/32/72/567833272.db2.gz GQJVFTMANZFXAD-MRXNPFEDSA-N 0 0 369.421 3.762 20 5 FHBDRN O=C(CSCC(F)(F)F)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452869146 567834728 /nfs/dbraw/zinc/83/47/28/567834728.db2.gz YWAFNHRVIVEWIK-LBPRGKRZSA-N 0 0 362.373 3.596 20 5 FHBDRN Cc1nc(CCNC(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)sc1C ZINC000150805607 567850472 /nfs/dbraw/zinc/85/04/72/567850472.db2.gz UAPFIPZQHUZAOF-GFCCVEGCSA-N 0 0 362.455 3.579 20 5 FHBDRN CO[C@@H](C)c1cccc(NS(=O)(=O)c2cc(C)cc([N+](=O)[O-])c2C)c1 ZINC000541801517 567865812 /nfs/dbraw/zinc/86/58/12/567865812.db2.gz ZUUYAOXQLBHNFL-ZDUSSCGKSA-N 0 0 364.423 3.720 20 5 FHBDRN O=C(CCc1ccccc1O)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452878820 567869316 /nfs/dbraw/zinc/86/93/16/567869316.db2.gz MQAIYQQWCKASHS-QGZVFWFLSA-N 0 0 354.406 3.639 20 5 FHBDRN Cc1ncc([N+](=O)[O-])n1CCSCc1coc(-c2cccc(F)c2)n1 ZINC000601915961 567873443 /nfs/dbraw/zinc/87/34/43/567873443.db2.gz CPKCQIKVUNLOHU-UHFFFAOYSA-N 0 0 362.386 3.827 20 5 FHBDRN O=C(CCc1ccccc1O)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452878819 567873521 /nfs/dbraw/zinc/87/35/21/567873521.db2.gz MQAIYQQWCKASHS-KRWDZBQOSA-N 0 0 354.406 3.639 20 5 FHBDRN CC(C)Oc1cccc([C@H](C)NC(=O)COc2ccc([N+](=O)[O-])cc2)c1 ZINC000481388894 567876874 /nfs/dbraw/zinc/87/68/74/567876874.db2.gz YQXSTXSPQCMLQE-AWEZNQCLSA-N 0 0 358.394 3.638 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2nnc(N3CCC[C@@H]3C3CCC3)n2C2CC2)c1 ZINC000568102532 567883336 /nfs/dbraw/zinc/88/33/36/567883336.db2.gz BADWHTANTWTAMA-QGZVFWFLSA-N 0 0 353.426 3.957 20 5 FHBDRN O=C(c1ccc2nccnc2c1)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452880841 567896783 /nfs/dbraw/zinc/89/67/83/567896783.db2.gz NXDMBJOBFPRQTB-INIZCTEOSA-N 0 0 362.389 3.558 20 5 FHBDRN C[C@@H](OC[C@@H](O)CSc1ccc([N+](=O)[O-])cn1)c1ccc(Cl)cc1 ZINC000159190239 567906468 /nfs/dbraw/zinc/90/64/68/567906468.db2.gz SVCJRYVBALBXMU-IAQYHMDHSA-N 0 0 368.842 3.874 20 5 FHBDRN CC(C)[C@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1F)c1nc(C2CC2)no1 ZINC000541834539 567955801 /nfs/dbraw/zinc/95/58/01/567955801.db2.gz LEYSXCKBQKQXNJ-ZDUSSCGKSA-N 0 0 363.349 3.513 20 5 FHBDRN CC[C@H]1CN(C(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)CCO1 ZINC000030762862 567955933 /nfs/dbraw/zinc/95/59/33/567955933.db2.gz QEVXDCGUOZPHHQ-INIZCTEOSA-N 0 0 355.394 3.589 20 5 FHBDRN Cc1c(CNC(=O)CCOc2ccc(F)cc2Cl)cccc1[N+](=O)[O-] ZINC000481462860 567956472 /nfs/dbraw/zinc/95/64/72/567956472.db2.gz DIFAIAGJVZUMKF-UHFFFAOYSA-N 0 0 366.776 3.781 20 5 FHBDRN COc1cc(C(=O)Nc2ccc(C(=O)C(C)C)cc2)cc([N+](=O)[O-])c1OC ZINC000452922961 567959645 /nfs/dbraw/zinc/95/96/45/567959645.db2.gz AJTXPBIRYLWKDF-UHFFFAOYSA-N 0 0 372.377 3.703 20 5 FHBDRN Cc1cc(O[C@@H](C)C(=O)NCc2cccc([N+](=O)[O-])c2C)ccc1Cl ZINC000481467285 567964534 /nfs/dbraw/zinc/96/45/34/567964534.db2.gz POGVGKIBZXNSRU-ZDUSSCGKSA-N 0 0 362.813 3.949 20 5 FHBDRN COc1ccc(C(=O)NCc2cccc([N+](=O)[O-])c2C)c2ccccc12 ZINC000481469468 567965783 /nfs/dbraw/zinc/96/57/83/567965783.db2.gz YGXVUFOCKWAHGD-UHFFFAOYSA-N 0 0 350.374 3.995 20 5 FHBDRN Cc1c(CNC(=O)c2ccccc2OC(F)(F)F)cccc1[N+](=O)[O-] ZINC000481470506 567967710 /nfs/dbraw/zinc/96/77/10/567967710.db2.gz ZUVNDMSLQATCPH-UHFFFAOYSA-N 0 0 354.284 3.732 20 5 FHBDRN Cc1ccc(-c2ocnc2C(=O)NCc2cccc([N+](=O)[O-])c2C)cc1 ZINC000481467748 567967775 /nfs/dbraw/zinc/96/77/75/567967775.db2.gz QMYGEUGUIRPYQG-UHFFFAOYSA-N 0 0 351.362 3.797 20 5 FHBDRN C/C=C/c1ccc(OCC(=O)NCc2cccc([N+](=O)[O-])c2C)c(OC)c1 ZINC000481476130 567972386 /nfs/dbraw/zinc/97/23/86/567972386.db2.gz IWMTVWIWVLVVOH-GQCTYLIASA-N 0 0 370.405 3.640 20 5 FHBDRN Cc1ccc(-c2nc(CC(=O)NCc3cccc([N+](=O)[O-])c3C)cs2)o1 ZINC000481473784 567976866 /nfs/dbraw/zinc/97/68/66/567976866.db2.gz ALYRYILTTHDKNF-UHFFFAOYSA-N 0 0 371.418 3.787 20 5 FHBDRN COc1ccc(F)cc1NC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000481478715 567980347 /nfs/dbraw/zinc/98/03/47/567980347.db2.gz COYUVTVQAPPWAI-UHFFFAOYSA-N 0 0 367.764 3.760 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)NCCc1ccc(C(F)(F)F)cc1 ZINC000014940161 567981371 /nfs/dbraw/zinc/98/13/71/567981371.db2.gz ZVJDTDJAXNDYLL-UHFFFAOYSA-N 0 0 368.311 3.595 20 5 FHBDRN C[C@@H](CNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F)CC(F)(F)F ZINC000412647760 567981601 /nfs/dbraw/zinc/98/16/01/567981601.db2.gz AJGFSMMIZKBURA-SECBINFHSA-N 0 0 350.312 3.716 20 5 FHBDRN COC(=O)c1cc(NC(=O)c2cc(C(C)C)c(O)cc2C)cc([N+](=O)[O-])c1 ZINC000436603146 567983097 /nfs/dbraw/zinc/98/30/97/567983097.db2.gz LNHQJCBLECMTAE-UHFFFAOYSA-N 0 0 372.377 3.771 20 5 FHBDRN CC(C)(CCc1noc(CCc2ncc(-c3ccccc3F)o2)n1)[N+](=O)[O-] ZINC000291037500 567985821 /nfs/dbraw/zinc/98/58/21/567985821.db2.gz GAAVSXUOSOIWSM-UHFFFAOYSA-N 0 0 374.372 3.637 20 5 FHBDRN Cc1c(CNC(=O)COc2ccc(Cl)c(Cl)c2)cccc1[N+](=O)[O-] ZINC000481484897 567988074 /nfs/dbraw/zinc/98/80/74/567988074.db2.gz XMEDCLZXYLXKTM-UHFFFAOYSA-N 0 0 369.204 3.905 20 5 FHBDRN Cn1nc([N+](=O)[O-])cc1C(=O)Nc1ccccc1Oc1cccc(F)c1 ZINC000481492164 567988332 /nfs/dbraw/zinc/98/83/32/567988332.db2.gz MKGLUEGSAJACDQ-UHFFFAOYSA-N 0 0 356.313 3.512 20 5 FHBDRN Cc1cc([C@@H]2CCCN2C(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)on1 ZINC000481485941 567988557 /nfs/dbraw/zinc/98/85/57/567988557.db2.gz ZBQZUPLQUYUPIE-DOMZBBRYSA-N 0 0 361.423 3.736 20 5 FHBDRN CCc1nc2ccc(Cl)cn2c1-c1nc(CCC(C)(C)[N+](=O)[O-])no1 ZINC000291068294 568000302 /nfs/dbraw/zinc/00/03/02/568000302.db2.gz LCGLCFDYLKDQBR-UHFFFAOYSA-N 0 0 363.805 3.588 20 5 FHBDRN CCCN(C(=O)c1cc2cc([N+](=O)[O-])ccc2o1)[C@@H](CC)C(=O)OCC ZINC000481518077 568005181 /nfs/dbraw/zinc/00/51/81/568005181.db2.gz LBFFQUOJSUUTSX-AWEZNQCLSA-N 0 0 362.382 3.535 20 5 FHBDRN CCOC1(C)CCN(Cc2cc(Br)c([N+](=O)[O-])s2)CC1 ZINC000602670839 568007944 /nfs/dbraw/zinc/00/79/44/568007944.db2.gz GSVFIZQXGBLIHX-UHFFFAOYSA-N 0 0 363.277 3.810 20 5 FHBDRN Cc1cc(NC(=O)c2cc([N+](=O)[O-])cnc2C)ccc1C(=O)OC(C)(C)C ZINC000128563496 568016400 /nfs/dbraw/zinc/01/64/00/568016400.db2.gz HGVZBXPGCBSIHE-UHFFFAOYSA-N 0 0 371.393 3.814 20 5 FHBDRN CC[C@H]([NH2+]Cc1ccc(CN2CCCC2=O)cc1)c1cccc([N+](=O)[O-])c1 ZINC000128564840 568016792 /nfs/dbraw/zinc/01/67/92/568016792.db2.gz WIRRAEWIKUVZES-FQEVSTJZSA-N 0 0 367.449 3.958 20 5 FHBDRN Cc1c(Cc2noc([C@H]3CCC(=O)[C@@H](C)C3(C)C)n2)cccc1[N+](=O)[O-] ZINC000568325942 568024785 /nfs/dbraw/zinc/02/47/85/568024785.db2.gz CQDLKYRJFUKAGN-TZMCWYRMSA-N 0 0 357.410 3.986 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)NCc2nc3cc(F)ccc3o2)c1 ZINC000568332395 568025390 /nfs/dbraw/zinc/02/53/90/568025390.db2.gz VKYWBJQRQASMKZ-UHFFFAOYSA-N 0 0 361.354 3.527 20 5 FHBDRN COc1cc(F)c(F)cc1NC(=O)CSc1ccccc1[N+](=O)[O-] ZINC000568338776 568026287 /nfs/dbraw/zinc/02/62/87/568026287.db2.gz ZTPRAWUZRQEASU-UHFFFAOYSA-N 0 0 354.334 3.612 20 5 FHBDRN C[C@H]1CCC[C@H](N(C)C(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000568341543 568026398 /nfs/dbraw/zinc/02/63/98/568026398.db2.gz SEBOIMODGBALPH-ZFWWWQNUSA-N 0 0 358.442 3.839 20 5 FHBDRN O=[N+]([O-])c1ccc(NCc2ccc(CO)c(F)c2)c(Br)c1 ZINC000541861322 568029012 /nfs/dbraw/zinc/02/90/12/568029012.db2.gz YMLXROYWFZCVPX-UHFFFAOYSA-N 0 0 355.163 3.601 20 5 FHBDRN O=[N+]([O-])c1cc2c(nc1NCc1noc(-c3cccs3)n1)CCCC2 ZINC000568400190 568030537 /nfs/dbraw/zinc/03/05/37/568030537.db2.gz RAJIPBMTOUYYRA-UHFFFAOYSA-N 0 0 357.395 3.592 20 5 FHBDRN COc1ccc(CC(=O)N2CC[C@](F)(c3ccccc3C)C2)cc1[N+](=O)[O-] ZINC000568415628 568032046 /nfs/dbraw/zinc/03/20/46/568032046.db2.gz CIAFZTAYBJBQHE-HXUWFJFHSA-N 0 0 372.396 3.552 20 5 FHBDRN COc1cc(Cc2noc(-c3ccccc3OC3CC3)n2)ccc1[N+](=O)[O-] ZINC000568445762 568038647 /nfs/dbraw/zinc/03/86/47/568038647.db2.gz UOHQZVBSZLERAT-UHFFFAOYSA-N 0 0 367.361 3.785 20 5 FHBDRN CC(C)CN(CCc1ccccc1)C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000481555269 568047346 /nfs/dbraw/zinc/04/73/46/568047346.db2.gz LCAIZHSBTDARQU-UHFFFAOYSA-N 0 0 366.421 3.812 20 5 FHBDRN CCc1ccc([C@H](CO)NCc2coc(-c3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000568552008 568050487 /nfs/dbraw/zinc/05/04/87/568050487.db2.gz RECQEIVQRVHMJZ-IBGZPJMESA-N 0 0 367.405 3.635 20 5 FHBDRN CC(C)(C)Oc1ccc(C(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)nc1 ZINC000481545085 568050755 /nfs/dbraw/zinc/05/07/55/568050755.db2.gz OSIPYWCQLSNGTD-UHFFFAOYSA-N 0 0 369.421 3.972 20 5 FHBDRN Cc1c(Cc2noc(-c3cccnc3OCC(C)C)n2)cccc1[N+](=O)[O-] ZINC000568561706 568051577 /nfs/dbraw/zinc/05/15/77/568051577.db2.gz KUNKSYLUICLFRF-UHFFFAOYSA-N 0 0 368.393 3.974 20 5 FHBDRN Cn1c(-c2ccc([N+](=O)[O-])cc2)nnc1N1CCc2cc(Cl)ccc2C1 ZINC000568567338 568053174 /nfs/dbraw/zinc/05/31/74/568053174.db2.gz LTQUHLBMMGFADL-UHFFFAOYSA-N 0 0 369.812 3.606 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])N1CCC(Cc2cccc(F)c2)CC1 ZINC000065872226 568063508 /nfs/dbraw/zinc/06/35/08/568063508.db2.gz BQKCDFNUGBGHNX-UHFFFAOYSA-N 0 0 371.412 3.627 20 5 FHBDRN CCc1ccc(C(=O)Nc2ncccc2CCCCOC)cc1[N+](=O)[O-] ZINC000291174096 568066347 /nfs/dbraw/zinc/06/63/47/568066347.db2.gz DYJLEVZTQGJCNW-UHFFFAOYSA-N 0 0 357.410 3.774 20 5 FHBDRN C[C@@]1(CNC(=O)c2cccc(Cl)c2[N+](=O)[O-])OCCc2sccc21 ZINC000291173799 568066531 /nfs/dbraw/zinc/06/65/31/568066531.db2.gz SAMYUTDSYQFHOT-INIZCTEOSA-N 0 0 366.826 3.528 20 5 FHBDRN O=C(NC[C@@H]1CCC2(CCCCC2)O1)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000481640023 568074813 /nfs/dbraw/zinc/07/48/13/568074813.db2.gz RDSOCEXKWNTDAP-HNNXBMFYSA-N 0 0 358.394 3.953 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(OCc2ncc(-c3cccs3)o2)c1 ZINC000067429419 568075300 /nfs/dbraw/zinc/07/53/00/568075300.db2.gz CLJPOKSJRBMYQE-UHFFFAOYSA-N 0 0 360.347 3.677 20 5 FHBDRN O=C(Nc1cccnc1N1CCCCC1)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000541889910 568079573 /nfs/dbraw/zinc/07/95/73/568079573.db2.gz MOXGMKFHEIIZQU-UHFFFAOYSA-N 0 0 365.393 3.714 20 5 FHBDRN CN(C)c1nc2cc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4o3)ccc2o1 ZINC000481643471 568080515 /nfs/dbraw/zinc/08/05/15/568080515.db2.gz QSFKTHVBAZFHKL-UHFFFAOYSA-N 0 0 366.333 3.801 20 5 FHBDRN CSCC1CCC(NC(=O)CCOc2cc(C)ccc2[N+](=O)[O-])CC1 ZINC000452978522 568084474 /nfs/dbraw/zinc/08/44/74/568084474.db2.gz LSUDPVURBZRJCL-UHFFFAOYSA-N 0 0 366.483 3.710 20 5 FHBDRN COc1ccc(S(=O)(=O)N(c2ccccc2C)C(C)C)c([N+](=O)[O-])c1 ZINC000068921110 568090022 /nfs/dbraw/zinc/09/00/22/568090022.db2.gz HGAHJNFUNHIDKQ-UHFFFAOYSA-N 0 0 364.423 3.516 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1OC[C@@H](O)Cc1ccc2ccccc2c1 ZINC000481703866 568090667 /nfs/dbraw/zinc/09/06/67/568090667.db2.gz LRMUNNCSKZDZJS-SFHVURJKSA-N 0 0 353.374 3.739 20 5 FHBDRN O=[N+]([O-])c1ccccc1CNc1ccnc2cc(Br)cnc21 ZINC000128632249 568092498 /nfs/dbraw/zinc/09/24/98/568092498.db2.gz BORCBSLGNPHJJB-UHFFFAOYSA-N 0 0 359.183 3.913 20 5 FHBDRN CCO[C@@H]1C[C@@H](N(C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1(C)C ZINC000481724938 568098194 /nfs/dbraw/zinc/09/81/94/568098194.db2.gz CUTSDFSECJQLFF-ZIAGYGMSSA-N 0 0 355.822 3.916 20 5 FHBDRN C[C@H]1[C@@H](C(F)(F)F)CCCN1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000481738695 568100185 /nfs/dbraw/zinc/10/01/85/568100185.db2.gz FGOMTDQPCFBJCX-HZMBPMFUSA-N 0 0 360.332 3.624 20 5 FHBDRN COc1cc(C(=O)N([C@H](C)c2ccccc2)C2CC2)cc([N+](=O)[O-])c1OC ZINC000568666634 568115284 /nfs/dbraw/zinc/11/52/84/568115284.db2.gz XYQRACBMWJXNRH-CYBMUJFWSA-N 0 0 370.405 3.978 20 5 FHBDRN Cc1cc([C@H]2CCCN2C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)no1 ZINC000043331171 568115325 /nfs/dbraw/zinc/11/53/25/568115325.db2.gz TWWWMRXJASZULR-CYBMUJFWSA-N 0 0 350.762 3.914 20 5 FHBDRN Cc1nc(N[C@H]2CCN(c3ccc(F)c(Cl)c3)C2)ccc1[N+](=O)[O-] ZINC000302033535 568119829 /nfs/dbraw/zinc/11/98/29/568119829.db2.gz LBTTZADYOXQEGK-NSHDSACASA-N 0 0 350.781 3.782 20 5 FHBDRN C[C@H]1CN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)c2cccc(F)c2O1 ZINC000481821906 568134579 /nfs/dbraw/zinc/13/45/79/568134579.db2.gz GEZYFZUMYOIXAV-NSHDSACASA-N 0 0 370.340 3.571 20 5 FHBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)NCc1ccc(O)cc1 ZINC000481832410 568136283 /nfs/dbraw/zinc/13/62/83/568136283.db2.gz YFBZDDXRIMLTOM-UHFFFAOYSA-N 0 0 360.435 3.979 20 5 FHBDRN O=C(N[C@H](c1ccccc1)C(F)F)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000481823691 568136372 /nfs/dbraw/zinc/13/63/72/568136372.db2.gz IHBAJSFOPLRIBC-MRXNPFEDSA-N 0 0 372.331 3.517 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(-c3nnco3)cc2)c1 ZINC000481878095 568140332 /nfs/dbraw/zinc/14/03/32/568140332.db2.gz ABOUJYKIHNFLMD-UHFFFAOYSA-N 0 0 356.363 3.619 20 5 FHBDRN O=C(NC[C@@H]1CCC2(CCCCC2)O1)c1ccc([N+](=O)[O-])cc1Cl ZINC000481873893 568140509 /nfs/dbraw/zinc/14/05/09/568140509.db2.gz ZUYDUZRNFRXIMO-ZDUSSCGKSA-N 0 0 352.818 3.860 20 5 FHBDRN CSc1cccc(C(=O)NC[C@@H]2CCC3(CCCCC3)O2)c1[N+](=O)[O-] ZINC000481890279 568152418 /nfs/dbraw/zinc/15/24/18/568152418.db2.gz IKXDTINYMJAPIM-ZDUSSCGKSA-N 0 0 364.467 3.928 20 5 FHBDRN O=C(NC[C@@H]1CCC2(CCCCC2)O1)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000481867510 568165092 /nfs/dbraw/zinc/16/50/92/568165092.db2.gz OVUAQHOCDQKKJS-ZDUSSCGKSA-N 0 0 357.410 3.688 20 5 FHBDRN C[S@@](=O)c1cccc(NC(=O)c2c([N+](=O)[O-])cccc2C(F)(F)F)c1 ZINC000568763417 568187323 /nfs/dbraw/zinc/18/73/23/568187323.db2.gz JIGPTZNBDAQNPR-RUZDIDTESA-N 0 0 372.324 3.603 20 5 FHBDRN CO[C@@H](C)c1cccc(NS(=O)(=O)c2c(C)cc([N+](=O)[O-])cc2C)c1 ZINC000481965579 568200204 /nfs/dbraw/zinc/20/02/04/568200204.db2.gz DYLMLDOBJDXQTK-ZDUSSCGKSA-N 0 0 364.423 3.720 20 5 FHBDRN CC(C)n1cc2c(n1)C[C@H](Nc1ccc([N+](=O)[O-])c3cccnc13)CC2 ZINC000481967694 568201601 /nfs/dbraw/zinc/20/16/01/568201601.db2.gz RWKPMXJSZJLWOU-CQSZACIVSA-N 0 0 351.410 3.890 20 5 FHBDRN CC(C)C[C@H](NC(=O)C(C)(C)C)c1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000453010255 568218071 /nfs/dbraw/zinc/21/80/71/568218071.db2.gz APCXDQUHANDMRX-AWEZNQCLSA-N 0 0 360.414 3.894 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)NCc2ccc(F)c(C)c2)cc1SC ZINC000481996235 568219008 /nfs/dbraw/zinc/21/90/08/568219008.db2.gz CAMNGNMJFVLTOS-UHFFFAOYSA-N 0 0 364.398 3.703 20 5 FHBDRN Cc1ccc(CNc2nc(C)ccc2[N+](=O)[O-])c(OC[C@H]2CCCO2)c1 ZINC000482007832 568226546 /nfs/dbraw/zinc/22/65/46/568226546.db2.gz PWFFLWAEPNZHPU-MRXNPFEDSA-N 0 0 357.410 3.777 20 5 FHBDRN C[C@@H](C(=O)N1CC[C@H](c2c(F)cccc2F)C1)c1cccc([N+](=O)[O-])c1 ZINC000568818767 568228374 /nfs/dbraw/zinc/22/83/74/568228374.db2.gz OYYMFIMLCMSKTB-OCCSQVGLSA-N 0 0 360.360 3.993 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CNc1ccc(Br)cc1 ZINC000007277541 568228450 /nfs/dbraw/zinc/22/84/50/568228450.db2.gz ZOEUPMOYINNSPU-UHFFFAOYSA-N 0 0 364.199 3.716 20 5 FHBDRN CC1(C)CN(C(=O)CCOc2ccccc2[N+](=O)[O-])CC[C@H]1C(F)(F)F ZINC000482028819 568232575 /nfs/dbraw/zinc/23/25/75/568232575.db2.gz APTHQUMCBIQEBZ-CQSZACIVSA-N 0 0 374.359 3.801 20 5 FHBDRN CCSCc1ccc(NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1 ZINC000568859143 568237249 /nfs/dbraw/zinc/23/72/49/568237249.db2.gz DNLGJFJAXPVKLG-QGZVFWFLSA-N 0 0 362.451 3.700 20 5 FHBDRN CCc1ccc([C@@H]2CN(C(=O)c3ccc(CC)c([N+](=O)[O-])c3)CCO2)cc1 ZINC000482047408 568238485 /nfs/dbraw/zinc/23/84/85/568238485.db2.gz VMZZKZCWNUYPRZ-FQEVSTJZSA-N 0 0 368.433 3.933 20 5 FHBDRN O=[N+]([O-])c1ccc(NC[C@H](CO)c2ccccc2Cl)c2ccncc21 ZINC000568908893 568251874 /nfs/dbraw/zinc/25/18/74/568251874.db2.gz GAVXTNKRHHVKHF-GFCCVEGCSA-N 0 0 357.797 3.984 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)Nc1ccc2oc(CO)cc2c1 ZINC000568919868 568252395 /nfs/dbraw/zinc/25/23/95/568252395.db2.gz KXSJAEPGFNHGSQ-UHFFFAOYSA-N 0 0 369.377 3.664 20 5 FHBDRN CC(C)[C@H]1C[C@H](CC(=O)Nc2ccnn2-c2ccc([N+](=O)[O-])cc2)CCO1 ZINC000541930235 568252570 /nfs/dbraw/zinc/25/25/70/568252570.db2.gz HJCOOXVFSCWLBP-RHSMWYFYSA-N 0 0 372.425 3.560 20 5 FHBDRN CNc1ccc(C(=O)N2CC[C@@](C)(c3ccc(C)cc3)C2)cc1[N+](=O)[O-] ZINC000568949291 568254995 /nfs/dbraw/zinc/25/49/95/568254995.db2.gz RAHVITFTZTVCMF-HXUWFJFHSA-N 0 0 353.422 3.749 20 5 FHBDRN Cc1cc(-c2noc([C@@H]3CC(=O)N(C4CCCCC4)C3)n2)cc([N+](=O)[O-])c1 ZINC000568959535 568255948 /nfs/dbraw/zinc/25/59/48/568255948.db2.gz IWKVCFWYEUZKMC-CQSZACIVSA-N 0 0 370.409 3.602 20 5 FHBDRN Cc1cc(C(=O)N(Cc2cccs2)C[C@@H]2CCCO2)ccc1[N+](=O)[O-] ZINC000018232246 568257634 /nfs/dbraw/zinc/25/76/34/568257634.db2.gz DMDTTXNJCYSUFL-HNNXBMFYSA-N 0 0 360.435 3.786 20 5 FHBDRN O=C(N[C@H]1CCCOc2c(F)cccc21)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000482084141 568257779 /nfs/dbraw/zinc/25/77/79/568257779.db2.gz NXOZPZAFYIZGTI-AWEZNQCLSA-N 0 0 369.352 3.859 20 5 FHBDRN O=C(Nc1ccc(F)c(Cl)c1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000128754568 568258568 /nfs/dbraw/zinc/25/85/68/568258568.db2.gz PGSCGMKUXSOCOI-UHFFFAOYSA-N 0 0 360.732 3.825 20 5 FHBDRN COc1ccc2c(c1)C[C@@H](C)N(C(=O)Cc1ccccc1[N+](=O)[O-])[C@@H]2C ZINC000541934612 568261101 /nfs/dbraw/zinc/26/11/01/568261101.db2.gz RCGGSGOLASMRBF-ZIAGYGMSSA-N 0 0 354.406 3.680 20 5 FHBDRN C[C@@H](CNC(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F)CC(F)(F)F ZINC000412670614 568262484 /nfs/dbraw/zinc/26/24/84/568262484.db2.gz IWVMFHTZYAWASH-SSDOTTSWSA-N 0 0 358.238 3.932 20 5 FHBDRN CCOC(=O)c1ccnc(N2C[C@@H](c3ccc(F)cc3)C[C@@H]2C)c1[N+](=O)[O-] ZINC000150846955 568263544 /nfs/dbraw/zinc/26/35/44/568263544.db2.gz KJJGVIFUQWRIJQ-JSGCOSHPSA-N 0 0 373.384 3.688 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)NCc2ccc(C)c(F)c2)cc1SC ZINC000482098260 568267771 /nfs/dbraw/zinc/26/77/71/568267771.db2.gz WBPYQWLLMYRPEU-UHFFFAOYSA-N 0 0 364.398 3.703 20 5 FHBDRN CN(C(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1)[C@H]1CCCOC1 ZINC000569015087 568268608 /nfs/dbraw/zinc/26/86/08/568268608.db2.gz ADVZVJWNZYANQY-HNNXBMFYSA-N 0 0 372.446 3.997 20 5 FHBDRN Cc1cc(C)cc([C@@H]2CCN(C(=O)c3n[nH]c4ccc([N+](=O)[O-])cc43)C2)c1 ZINC000181956422 568268785 /nfs/dbraw/zinc/26/87/85/568268785.db2.gz VUTSRHUATASMTB-CQSZACIVSA-N 0 0 364.405 3.718 20 5 FHBDRN CC(C)N(CC(=O)N[C@H]1CCC[C@@H](C)[C@@H]1C)Cc1ccc([N+](=O)[O-])cc1 ZINC000604411541 568272078 /nfs/dbraw/zinc/27/20/78/568272078.db2.gz HNCGMOULNALHPG-GJYPPUQNSA-N 0 0 361.486 3.746 20 5 FHBDRN O=C(c1nc2ccccc2nc1C1CC1)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000569075451 568272556 /nfs/dbraw/zinc/27/25/56/568272556.db2.gz NWFYIGBCWPGSMQ-UHFFFAOYSA-N 0 0 374.400 3.614 20 5 FHBDRN C[C@H]1C[C@H](c2ccc(C(F)(F)F)cc2)N(c2c([N+](=O)[O-])ncn2C)C1 ZINC000482105445 568275075 /nfs/dbraw/zinc/27/50/75/568275075.db2.gz ZEOVUJLXIABCGD-GXFFZTMASA-N 0 0 354.332 3.935 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CC(C)(C)[C@@H]1c1ccccc1 ZINC000604374188 568276810 /nfs/dbraw/zinc/27/68/10/568276810.db2.gz OGTHNWAHBWVCRF-KRWDZBQOSA-N 0 0 360.435 3.675 20 5 FHBDRN COc1cccc([C@@H]2C[C@H]2c2nc(Cc3ccccc3[N+](=O)[O-])no2)c1 ZINC000453052975 568277589 /nfs/dbraw/zinc/27/75/89/568277589.db2.gz DZAXPAROKJBSGJ-JKSUJKDBSA-N 0 0 351.362 3.848 20 5 FHBDRN C[C@@H](OCCc1ccccc1)c1nc(Cc2ccccc2[N+](=O)[O-])no1 ZINC000453055995 568277633 /nfs/dbraw/zinc/27/76/33/568277633.db2.gz KEYQVJRKDXMQJA-CQSZACIVSA-N 0 0 353.378 3.889 20 5 FHBDRN O=C(NCCc1ccc(Cl)cc1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000008019409 568279221 /nfs/dbraw/zinc/27/92/21/568279221.db2.gz QATXWCWAHJYFFQ-UHFFFAOYSA-N 0 0 359.813 3.795 20 5 FHBDRN C[C@H](OCCc1ccccc1)c1nc(Cc2ccccc2[N+](=O)[O-])no1 ZINC000453055994 568280622 /nfs/dbraw/zinc/28/06/22/568280622.db2.gz KEYQVJRKDXMQJA-AWEZNQCLSA-N 0 0 353.378 3.889 20 5 FHBDRN CCN(C(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-])[C@H]1CCOC(C)(C)C1 ZINC000291736495 568286658 /nfs/dbraw/zinc/28/66/58/568286658.db2.gz XGSDPZTYEZCMAT-LBPRGKRZSA-N 0 0 372.824 3.736 20 5 FHBDRN COc1ccc(CN2CCO[C@@H](c3ccc(F)c(C)c3)C2)cc1[N+](=O)[O-] ZINC000128764075 568290075 /nfs/dbraw/zinc/29/00/75/568290075.db2.gz RCIZNFHNTOPGHG-LJQANCHMSA-N 0 0 360.385 3.624 20 5 FHBDRN O=C(Nc1cc(F)c(Br)c(F)c1)c1ccc([N+](=O)[O-])s1 ZINC000181972528 568290519 /nfs/dbraw/zinc/29/05/19/568290519.db2.gz XELMOJKTLJYCDB-UHFFFAOYSA-N 0 0 363.139 3.949 20 5 FHBDRN COc1ccccc1[C@@H](N[C@H](C)c1ccc([N+](=O)[O-])cc1)c1nccn1C ZINC000128774661 568291067 /nfs/dbraw/zinc/29/10/67/568291067.db2.gz LOKSQTNPYKGELE-AUUYWEPGSA-N 0 0 366.421 3.777 20 5 FHBDRN O=[N+]([O-])c1cnc(Sc2n[nH]c(-c3cc(Cl)cc(Cl)c3)n2)nc1 ZINC000302108075 568291250 /nfs/dbraw/zinc/29/12/50/568291250.db2.gz ATMWJTVHYHKKCM-UHFFFAOYSA-N 0 0 369.193 3.628 20 5 FHBDRN Cc1ccccc1OCCCN(C)C(=O)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000569053309 568291556 /nfs/dbraw/zinc/29/15/56/568291556.db2.gz MLRGSTVRDDKBEN-MRXNPFEDSA-N 0 0 356.422 3.934 20 5 FHBDRN O=C(c1c([N+](=O)[O-])cccc1C(F)(F)F)N1CCc2ccccc2C1 ZINC000569155309 568299824 /nfs/dbraw/zinc/29/98/24/568299824.db2.gz BSCZNMZLJRLGPD-UHFFFAOYSA-N 0 0 350.296 3.812 20 5 FHBDRN Nc1c(C(=O)NC2CCC(c3ccc(F)cc3)CC2)cccc1[N+](=O)[O-] ZINC000541987635 568302588 /nfs/dbraw/zinc/30/25/88/568302588.db2.gz BPMRZJGLSVCPLS-UHFFFAOYSA-N 0 0 357.385 3.772 20 5 FHBDRN O=C(NC[C@@H]1CCCC[C@@H]1C(F)(F)F)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000482193698 568310648 /nfs/dbraw/zinc/31/06/48/568310648.db2.gz PNJDEVRNJVDFJD-CABZTGNLSA-N 0 0 370.331 3.570 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N1CCc2ccc(Cl)cc21 ZINC000482199857 568311318 /nfs/dbraw/zinc/31/13/18/568311318.db2.gz LYPYSSVXYAMLJX-UHFFFAOYSA-N 0 0 361.785 3.529 20 5 FHBDRN COc1ccc(C(=O)NC[C@@H]2CCCC[C@@H]2C(F)(F)F)cc1[N+](=O)[O-] ZINC000482211540 568312947 /nfs/dbraw/zinc/31/29/47/568312947.db2.gz JVQPTKKYKDTJJN-RYUDHWBXSA-N 0 0 360.332 3.702 20 5 FHBDRN O=[N+]([O-])c1cc(Br)cnc1N1CCO[C@@H](C2CCCCC2)C1 ZINC000569273619 568324867 /nfs/dbraw/zinc/32/48/67/568324867.db2.gz XFJZZFQKDZEJMO-CQSZACIVSA-N 0 0 370.247 3.538 20 5 FHBDRN COc1cccc(C2(c3noc(-c4ccc(OC)c([N+](=O)[O-])c4)n3)CC2)c1 ZINC000569290103 568338057 /nfs/dbraw/zinc/33/80/57/568338057.db2.gz BNKRONCMCAAKJR-UHFFFAOYSA-N 0 0 367.361 3.742 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])Nc1cc(F)c(Br)c(F)c1 ZINC000181991373 568342569 /nfs/dbraw/zinc/34/25/69/568342569.db2.gz CXCMVFCDLHBCAR-UHFFFAOYSA-N 0 0 371.137 3.817 20 5 FHBDRN CC(C)[C@@H](NCc1c(F)cccc1[N+](=O)[O-])c1ccc2c(c1)OCCO2 ZINC000181984231 568343569 /nfs/dbraw/zinc/34/35/69/568343569.db2.gz WJXXOMPMUXAPEZ-LJQANCHMSA-N 0 0 360.385 3.992 20 5 FHBDRN Cc1nc2ccccc2c(S[C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])n1 ZINC000004240446 568376045 /nfs/dbraw/zinc/37/60/45/568376045.db2.gz UMFACPPYANXTKG-NSHDSACASA-N 0 0 368.418 3.966 20 5 FHBDRN Cc1csc(Sc2ccc(C(=O)NC[C@@H]3C[C@H]3C)cc2[N+](=O)[O-])n1 ZINC000032382054 568388407 /nfs/dbraw/zinc/38/84/07/568388407.db2.gz GAUJVUBUWADVSE-SKDRFNHKSA-N 0 0 363.464 3.897 20 5 FHBDRN CC(C)OC1CCN(c2nnc(-c3ccc([N+](=O)[O-])cc3)n2C2CC2)CC1 ZINC000569348408 568395726 /nfs/dbraw/zinc/39/57/26/568395726.db2.gz ULVWOSFMWRSTAE-UHFFFAOYSA-N 0 0 371.441 3.582 20 5 FHBDRN CCN(CC)C(=S)SCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000005987932 568396614 /nfs/dbraw/zinc/39/66/14/568396614.db2.gz MFRZHBGFIXZGLR-UHFFFAOYSA-N 0 0 352.441 3.505 20 5 FHBDRN Cc1cccc(C(C)C)c1NC(=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000006232098 568400134 /nfs/dbraw/zinc/40/01/34/568400134.db2.gz PEHTYXWHDISMOJ-UHFFFAOYSA-N 0 0 369.421 3.785 20 5 FHBDRN COc1ccc2c(c1)[C@@H](c1nc(Cc3ccc([N+](=O)[O-])c(C)c3)no1)CC2 ZINC000569409269 568401167 /nfs/dbraw/zinc/40/11/67/568401167.db2.gz WKSBYBISXOGELP-INIZCTEOSA-N 0 0 365.389 3.964 20 5 FHBDRN CSCC1CCC(NC(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)CC1 ZINC000569551581 568404842 /nfs/dbraw/zinc/40/48/42/568404842.db2.gz XBOVLVAICXQVLI-UHFFFAOYSA-N 0 0 363.483 3.584 20 5 FHBDRN C[C@H](Sc1ncccn1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000006913116 568410584 /nfs/dbraw/zinc/41/05/84/568410584.db2.gz WOCMMECKNPOFEH-QMMMGPOBSA-N 0 0 372.328 3.523 20 5 FHBDRN CCn1c(C)nc([N+](=O)[O-])c1N[C@H](C)c1c(C)nn(CC(F)(F)F)c1C ZINC000569731455 568414477 /nfs/dbraw/zinc/41/44/77/568414477.db2.gz UCSRTICKKZMHKH-MRVPVSSYSA-N 0 0 374.367 3.668 20 5 FHBDRN Nc1nc(SC(c2ccc(F)cc2)c2ccc(F)cc2)ncc1[N+](=O)[O-] ZINC000569753722 568420503 /nfs/dbraw/zinc/42/05/03/568420503.db2.gz ZHEYJDBJXZDULN-UHFFFAOYSA-N 0 0 374.372 3.957 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2nc(CN3CC[C@@H](COC(F)F)C3)cs2)c1 ZINC000569769424 568422902 /nfs/dbraw/zinc/42/29/02/568422902.db2.gz VLUFEWMYWUQOSE-LLVKDONJSA-N 0 0 369.393 3.779 20 5 FHBDRN COCCO[C@H]1CCCN(c2cc(C)c(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000569829577 568427942 /nfs/dbraw/zinc/42/79/42/568427942.db2.gz JWIGIGYMPXWCDI-LBPRGKRZSA-N 0 0 362.348 3.554 20 5 FHBDRN O=C(COc1ccc(Cl)cc1[N+](=O)[O-])N1CCC[C@H]2CCCC[C@@H]21 ZINC000007024304 568428160 /nfs/dbraw/zinc/42/81/60/568428160.db2.gz JTOPYZAAJZUCIA-OCCSQVGLSA-N 0 0 352.818 3.808 20 5 FHBDRN CSC[C@@H]1CCCN(C(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000569935148 568434108 /nfs/dbraw/zinc/43/41/08/568434108.db2.gz HQBRWHPNGZERLK-NWDGAFQWSA-N 0 0 372.874 3.617 20 5 FHBDRN C[C@@H](C(=O)Nc1ccccc1OCC(F)F)c1cccc([N+](=O)[O-])c1 ZINC000569984673 568446633 /nfs/dbraw/zinc/44/66/33/568446633.db2.gz NYNFBIDJGZOSQL-LLVKDONJSA-N 0 0 350.321 3.981 20 5 FHBDRN C[C@H](C(=O)Nc1ccccc1OCC(F)F)c1cccc([N+](=O)[O-])c1 ZINC000569984674 568446690 /nfs/dbraw/zinc/44/66/90/568446690.db2.gz NYNFBIDJGZOSQL-NSHDSACASA-N 0 0 350.321 3.981 20 5 FHBDRN Cc1csc(NC2CCN(C(=O)[C@H](C)c3cccc([N+](=O)[O-])c3)CC2)n1 ZINC000570147591 568454937 /nfs/dbraw/zinc/45/49/37/568454937.db2.gz WQKSELGDFBRXFU-CYBMUJFWSA-N 0 0 374.466 3.566 20 5 FHBDRN CC[C@H](c1cccc(OC)c1)N(C)CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000570192494 568460291 /nfs/dbraw/zinc/46/02/91/568460291.db2.gz SNJLKGAGKYPSBV-QGZVFWFLSA-N 0 0 371.437 3.933 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1)CN(Cc1cnc(-c3ccco3)s1)CCO2 ZINC000570210700 568461730 /nfs/dbraw/zinc/46/17/30/568461730.db2.gz GGVMKTIUXTWBPT-UHFFFAOYSA-N 0 0 357.391 3.706 20 5 FHBDRN C[C@H](C(=O)NCC(F)(F)c1ccccc1)c1ccc([N+](=O)[O-])cc1F ZINC000570324824 568469682 /nfs/dbraw/zinc/46/96/82/568469682.db2.gz WGRKNGPLTCFNQR-NSHDSACASA-N 0 0 352.312 3.746 20 5 FHBDRN CS(=O)(=O)c1ccc(N[C@@H]2CCSc3ccccc32)c([N+](=O)[O-])c1 ZINC000007186777 568469932 /nfs/dbraw/zinc/46/99/32/568469932.db2.gz NKIDBBUQLPQCKO-CYBMUJFWSA-N 0 0 364.448 3.647 20 5 FHBDRN O=C(NCCNc1ccc([N+](=O)[O-])cc1)C1(c2cccc(Cl)c2)CCC1 ZINC000033180381 568470059 /nfs/dbraw/zinc/47/00/59/568470059.db2.gz RYWVCVPSPRZROQ-UHFFFAOYSA-N 0 0 373.840 3.898 20 5 FHBDRN COc1ccc(NC(=O)c2cc(OC)c(OC)cc2[N+](=O)[O-])cc1Cl ZINC000007309804 568494457 /nfs/dbraw/zinc/49/44/57/568494457.db2.gz ZZIIXUXWXXHNRF-UHFFFAOYSA-N 0 0 366.757 3.526 20 5 FHBDRN C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N(C)Cc1ccccc1F ZINC000007358671 568501798 /nfs/dbraw/zinc/50/17/98/568501798.db2.gz QBNIAVYASSDWPI-LBPRGKRZSA-N 0 0 356.357 3.977 20 5 FHBDRN CC(=O)c1cc(N[C@@H]2CC(=O)N(c3ccccc3Cl)C2)ccc1[N+](=O)[O-] ZINC000570706857 568502123 /nfs/dbraw/zinc/50/21/23/568502123.db2.gz YRQXKNPSEBMFTL-CYBMUJFWSA-N 0 0 373.796 3.668 20 5 FHBDRN Cc1ccc(OCC(=O)N(C)[C@H]2CCCc3ccccc32)c([N+](=O)[O-])c1 ZINC000007466019 568519656 /nfs/dbraw/zinc/51/96/56/568519656.db2.gz OTUVTIGDKJOMOH-KRWDZBQOSA-N 0 0 354.406 3.818 20 5 FHBDRN O=C(c1cccc2c(=O)c3ccccc3[nH]c12)N1CC(Cc2ccccc2)C1 ZINC000365357198 568551658 /nfs/dbraw/zinc/55/16/58/568551658.db2.gz BHXYCYAFMAPFJZ-UHFFFAOYSA-N 0 0 368.436 3.996 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1OC(F)F)N1CC2(CCC2)[C@H]1C1CC1 ZINC000291843891 568578250 /nfs/dbraw/zinc/57/82/50/568578250.db2.gz FBVKKLNEYPNUHF-CQSZACIVSA-N 0 0 352.337 3.601 20 5 FHBDRN O=[N+]([O-])c1ccc(N[C@H]2C[C@H]2c2c(F)cccc2Cl)c(-c2nn[nH]n2)c1 ZINC000738371905 598972437 /nfs/dbraw/zinc/97/24/37/598972437.db2.gz YTYLWSKEPFOQHZ-OTYXRUKQSA-N 0 0 374.763 3.535 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)ccc1COc1ccc(-c2nn[nH]n2)cc1Cl ZINC000738358203 599159873 /nfs/dbraw/zinc/15/98/73/599159873.db2.gz BBLBGXCWPYQLBI-UHFFFAOYSA-N 0 0 366.164 3.661 20 5 FHBDRN C[C@@H](SCc1ccc(F)cc1-c1nn[nH]n1)c1ccccc1[N+](=O)[O-] ZINC000820548468 599222836 /nfs/dbraw/zinc/22/28/36/599222836.db2.gz AKXIAQFFVIKZEW-SNVBAGLBSA-N 0 0 359.386 3.908 20 5 FHBDRN C[C@@H](c1cccc(Cl)c1)N(C)c1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-] ZINC000736198093 598814979 /nfs/dbraw/zinc/81/49/79/598814979.db2.gz FOEZYGKQAJLJBG-JTQLQIEISA-N 0 0 358.789 3.626 20 5 FHBDRN COc1ccc(CS[C@@H](C)c2ccc(-c3nn[nH]n3)cc2)cc1[N+](=O)[O-] ZINC000737098753 599331393 /nfs/dbraw/zinc/33/13/93/599331393.db2.gz ZBZNPPNAIFZUSR-NSHDSACASA-N 0 0 371.422 3.778 20 5 FHBDRN CCC(C)(C)c1ccc(Oc2ncc([N+](=O)[O-])cc2-c2nn[nH]n2)cc1 ZINC000820847692 599349372 /nfs/dbraw/zinc/34/93/72/599349372.db2.gz JESGNYBRFJDNCU-UHFFFAOYSA-N 0 0 354.370 3.650 20 5 FHBDRN Cc1cccc([C@H]2CCCN2c2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])c1C ZINC000822299600 599577748 /nfs/dbraw/zinc/57/77/48/599577748.db2.gz OJFUOQHYYINVSI-MRXNPFEDSA-N 0 0 364.409 3.733 20 5 FHBDRN O=C([O-])[C@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)c1cc(Cl)cc(Cl)c1 ZINC000833169047 601973687 /nfs/dbraw/zinc/97/36/87/601973687.db2.gz CVZFNIWHGRODLW-CQSZACIVSA-N 0 0 355.177 3.817 20 5 FHBDRN O=C([O-])[C@@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)c1cc(Cl)cc(Cl)c1 ZINC000833169046 601973780 /nfs/dbraw/zinc/97/37/80/601973780.db2.gz CVZFNIWHGRODLW-AWEZNQCLSA-N 0 0 355.177 3.817 20 5 FHBDRN C[C@@H](Oc1ccc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1)C(=O)[O-] ZINC000833537008 604534946 /nfs/dbraw/zinc/53/49/46/604534946.db2.gz FWQQDHXDWTWYBC-CQSZACIVSA-N 0 0 370.405 3.611 20 5 FHBDRN O=C([O-])[C@@H]1CC12CC[NH+](Cc1ccc(-c3ccc([N+](=O)[O-])cc3)o1)CC2 ZINC000833771990 604651097 /nfs/dbraw/zinc/65/10/97/604651097.db2.gz WPPIEAUZNFDRSH-INIZCTEOSA-N 0 0 356.378 3.542 20 5 FHBDRN C[C@@]1(C(=O)[O-])CC[N@H+](Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)C1 ZINC000414659575 604677007 /nfs/dbraw/zinc/67/70/07/604677007.db2.gz TWTOLMWTJGEZHS-LJQANCHMSA-N 0 0 374.368 3.823 20 5 FHBDRN O=C([O-])CCC[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)Cc1ccccc1 ZINC000833226938 604784882 /nfs/dbraw/zinc/78/48/82/604784882.db2.gz VELYYRBRGFDPMU-UHFFFAOYSA-N 0 0 369.377 3.603 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1ccc(CCNC(=O)[O-])cc1 ZINC000830427464 604943123 /nfs/dbraw/zinc/94/31/23/604943123.db2.gz ILJHWVPYPGEUBW-CQSZACIVSA-N 0 0 357.410 3.564 20 5 FHBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@H](C(C)(C)C(=O)[O-])C1 ZINC000593747753 604944583 /nfs/dbraw/zinc/94/45/83/604944583.db2.gz BJACGJZPORHKPL-HNNXBMFYSA-N 0 0 364.442 3.705 20 5 FHBDRN O=C([O-])NC1CCC([NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC1 ZINC000834164148 605617953 /nfs/dbraw/zinc/61/79/53/605617953.db2.gz GDRPAHZVJUAVCA-TVPLGVNVSA-N 0 0 369.421 3.853 20 5 FHBDRN O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1Oc1ccc(-c2cscn2)cc1 ZINC000823630494 606471356 /nfs/dbraw/zinc/47/13/56/606471356.db2.gz YHQIKDAUOZWZDP-UHFFFAOYSA-N 0 0 366.362 3.691 20 5 FHBDRN O=[N+]([O-])c1c(-c2nn[nH]n2)ccnc1Oc1ccc(Cc2ccccc2)cc1 ZINC000823629649 606706103 /nfs/dbraw/zinc/70/61/03/606706103.db2.gz DCKWMJNHWFYFIY-UHFFFAOYSA-N 0 0 374.360 3.553 20 5 FHBDRN CCCCCc1ccc(Oc2nccc(-c3nn[nH]n3)c2[N+](=O)[O-])cc1 ZINC000821061015 607162788 /nfs/dbraw/zinc/16/27/88/607162788.db2.gz JXOKQIVMTNDECY-UHFFFAOYSA-N 0 0 354.370 3.695 20 5 FHBDRN O=[N+]([O-])c1ccc(N[C@@H]2CCSc3c(F)cccc32)c(-c2nn[nH]n2)c1 ZINC000826498625 609601101 /nfs/dbraw/zinc/60/11/01/609601101.db2.gz CYKXIADXDZYXGG-CQSZACIVSA-N 0 0 372.385 3.563 20 5 FHBDRN O=[N+]([O-])c1ccc(N[C@H]2CCSc3c(F)cccc32)c(-c2nn[nH]n2)c1 ZINC000826498624 609601400 /nfs/dbraw/zinc/60/14/00/609601400.db2.gz CYKXIADXDZYXGG-AWEZNQCLSA-N 0 0 372.385 3.563 20 5 FHBDRN CCN(CC)C(=O)Cc1ccc(NC(=O)c2cc(C)cc([N+](=O)[O-])c2)cc1 ZINC000121993900 936313818 /nfs/dbraw/zinc/31/38/18/936313818.db2.gz VBSOBTNYWNJGKB-UHFFFAOYSA-N 0 0 369.421 3.566 20 5 FHBDRN COc1ccc(OCC(=O)Nc2cc(Cl)ccc2C)c([N+](=O)[O-])c1 ZINC000005051448 936315197 /nfs/dbraw/zinc/31/51/97/936315197.db2.gz HCNSJFTVANEJGG-UHFFFAOYSA-N 0 0 350.758 3.583 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)c1nc(COCC(F)(F)F)no1 ZINC000612874130 936332785 /nfs/dbraw/zinc/33/27/85/936332785.db2.gz JHBOFFWGTNZPSH-QMMMGPOBSA-N 0 0 363.317 3.910 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N1CC(C)(C)[C@H]1c1cnn(C)c1 ZINC000582970126 936332986 /nfs/dbraw/zinc/33/29/86/936332986.db2.gz LVPDPMIGBWFDKZ-OAHLLOKOSA-N 0 0 362.817 3.513 20 5 FHBDRN Cc1ccc(SC[C@H](C)NC(=O)Cc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000472274489 936335336 /nfs/dbraw/zinc/33/53/36/936335336.db2.gz IQQNTTMFWNUSQN-ZDUSSCGKSA-N 0 0 362.426 3.882 20 5 FHBDRN CCn1c(C)nc([N+](=O)[O-])c1NCCOc1ccccc1C(F)(F)F ZINC000582986426 936345386 /nfs/dbraw/zinc/34/53/86/936345386.db2.gz VQNBFIMXOKTLEX-UHFFFAOYSA-N 0 0 358.320 3.629 20 5 FHBDRN CN(C(=O)c1ccc(Cl)cc1Br)c1ccc([N+](=O)[O-])nc1 ZINC000582988523 936347160 /nfs/dbraw/zinc/34/71/60/936347160.db2.gz GKIKMPQDKDGLBU-UHFFFAOYSA-N 0 0 370.590 3.682 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H]1CC[C@@H](c2ccccc2)O1 ZINC000573142925 936381910 /nfs/dbraw/zinc/38/19/10/936381910.db2.gz RVIMKKTWJIKTMF-AEFFLSMTSA-N 0 0 355.394 3.945 20 5 FHBDRN CCc1cc(NC(=O)C[C@H](C)c2ccncc2)c2cc([N+](=O)[O-])ccc2n1 ZINC000613189856 936384610 /nfs/dbraw/zinc/38/46/10/936384610.db2.gz YXLJEQQCXMNRQC-ZDUSSCGKSA-N 0 0 364.405 3.655 20 5 FHBDRN C[C@@H](Nc1ncnc2cccc([N+](=O)[O-])c21)c1nccn1-c1ccccc1 ZINC000583046613 936388955 /nfs/dbraw/zinc/38/89/55/936388955.db2.gz ZIXYDNQTKGTBQU-CYBMUJFWSA-N 0 0 360.377 3.897 20 5 FHBDRN CCc1c(NC(=O)c2ccc([N+](=O)[O-])cc2OC)cnn1C(CC)CC ZINC000427081878 945065327 /nfs/dbraw/zinc/06/53/27/945065327.db2.gz ULEIXFJRAIHAQA-UHFFFAOYSA-N 0 0 360.414 3.976 20 5 FHBDRN CCCC[C@H]1CCC[C@H]1NC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000110715629 945065735 /nfs/dbraw/zinc/06/57/35/945065735.db2.gz KRLNPCYKTICOMV-GOEBONIOSA-N 0 0 356.426 3.869 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H]1C[C@H]1c1cccc(F)c1 ZINC000439893078 945066119 /nfs/dbraw/zinc/06/61/19/945066119.db2.gz VRWQQUWDILKTFZ-GJZGRUSLSA-N 0 0 359.357 3.810 20 5 FHBDRN CC1(C)[C@H](NC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)[C@@H]2CCO[C@@H]21 ZINC000278052924 937085668 /nfs/dbraw/zinc/08/56/68/937085668.db2.gz DJZDZSWDGZYPDL-BEVDRBHNSA-N 0 0 362.429 3.637 20 5 FHBDRN Cc1ccc(SC[C@H](C)NC(=O)COc2ccc([N+](=O)[O-])cc2)cc1 ZINC000472279531 937089647 /nfs/dbraw/zinc/08/96/47/937089647.db2.gz PDXNOUKYBIEOHI-AWEZNQCLSA-N 0 0 360.435 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368.389 3.730 20 5 FHBDRN COc1ccc(CC(=O)Nc2ccc(OC(C)C)c(C)c2)cc1[N+](=O)[O-] ZINC000610186360 927694277 /nfs/dbraw/zinc/69/42/77/927694277.db2.gz OKMYLWSDELQCMB-UHFFFAOYSA-N 0 0 358.394 3.880 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)Nc2c(F)cc(F)cc2F)cc1SC ZINC000175298006 927694785 /nfs/dbraw/zinc/69/47/85/927694785.db2.gz SRGPXLYIOSQCMN-UHFFFAOYSA-N 0 0 372.324 3.995 20 5 FHBDRN CC[C@H](C)[C@H](NC(=O)CCn1cc([N+](=O)[O-])cn1)c1ccc(Cl)cc1 ZINC000610187472 927714115 /nfs/dbraw/zinc/71/41/15/927714115.db2.gz RODOBIDJGSQSKD-SJCJKPOMSA-N 0 0 364.833 3.738 20 5 FHBDRN C[C@H]1Cc2ccccc2CN1C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000610189167 927727452 /nfs/dbraw/zinc/72/74/52/927727452.db2.gz UNMKIUXEXXVSDO-HNNXBMFYSA-N 0 0 365.433 3.782 20 5 FHBDRN COCCCOC1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000172764484 927748184 /nfs/dbraw/zinc/74/81/84/927748184.db2.gz TZYVSLCPRDKACS-UHFFFAOYSA-N 0 0 362.348 3.636 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(N2CCCN(c3ccc(F)c(F)c3)CC2)n1 ZINC000583161546 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3.849 20 5 FHBDRN C[C@@]1(c2ccccc2)C[C@@H]1NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000610191202 927823252 /nfs/dbraw/zinc/82/32/52/927823252.db2.gz XBFSTSPXNBAXPF-ICSRJNTNSA-N 0 0 351.406 3.629 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]c(CNCc3cccc(C(F)(F)F)c3)nc2c1 ZINC000510079470 927842090 /nfs/dbraw/zinc/84/20/90/927842090.db2.gz NKTOIZJOBNGQKR-UHFFFAOYSA-N 0 0 350.300 3.780 20 5 FHBDRN CCOc1ccc2c(c1)[C@H](NC(=O)c1cc([N+](=O)[O-])c(C)s1)CCO2 ZINC000187037074 927863860 /nfs/dbraw/zinc/86/38/60/927863860.db2.gz MOXYHSNBBBBBIJ-CYBMUJFWSA-N 0 0 362.407 3.617 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CCC([C@H](O)c2ccccc2)CC1 ZINC000162619870 937205997 /nfs/dbraw/zinc/20/59/97/937205997.db2.gz AVIPMLHPATXPCC-LJQANCHMSA-N 0 0 369.421 3.881 20 5 FHBDRN CC(C)(C)Oc1ccccc1[N-]S(=O)(=O)c1csc([N+](=O)[O-])c1 ZINC000120255089 927892125 /nfs/dbraw/zinc/89/21/25/927892125.db2.gz VOJVUZHFIOHDEX-UHFFFAOYSA-N 0 0 356.425 3.634 20 5 FHBDRN CSc1cccc(C(=O)N2C[C@@H](C)C[C@H]2c2cccnc2)c1[N+](=O)[O-] ZINC000187069265 927896102 /nfs/dbraw/zinc/89/61/02/927896102.db2.gz QKRCKOOINMKLQS-WFASDCNBSA-N 0 0 357.435 3.935 20 5 FHBDRN C[C@@H]1CO[C@@H](c2cccc(Cl)c2)CN1C(=O)Cc1ccccc1[N+](=O)[O-] ZINC000187070076 927896355 /nfs/dbraw/zinc/89/63/55/927896355.db2.gz AJLIKCLYMAPLQS-FZKQIMNGSA-N 0 0 374.824 3.779 20 5 FHBDRN Cc1nc([C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])cc2Cl)cs1 ZINC000187113331 927920796 /nfs/dbraw/zinc/92/07/96/927920796.db2.gz CLGUDYFIXVDLFE-CQSZACIVSA-N 0 0 351.815 3.990 20 5 FHBDRN Cc1cc(=O)c2cc(NC(=O)Cc3ccc([N+](=O)[O-])cc3Cl)ccc2[nH]1 ZINC000430200351 927935833 /nfs/dbraw/zinc/93/58/33/927935833.db2.gz UOEJETWXUPCCMR-UHFFFAOYSA-N 0 0 371.780 3.579 20 5 FHBDRN O=C(Nc1cc(N2CCCC2=O)ccc1Cl)c1ccc([N+](=O)[O-])cc1 ZINC000041929560 927945464 /nfs/dbraw/zinc/94/54/64/927945464.db2.gz YMJQPQIKSSYKKE-UHFFFAOYSA-N 0 0 359.769 3.627 20 5 FHBDRN O=C(N[C@@H]1CCc2ccccc21)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000120277838 927959297 /nfs/dbraw/zinc/95/92/97/927959297.db2.gz SSAGLKAKPKTSGP-GOSISDBHSA-N 0 0 351.406 3.956 20 5 FHBDRN COc1cc(C)c([C@@H](C)Nc2nc3sccn3c2[N+](=O)[O-])cc1OC ZINC000052158858 937209828 /nfs/dbraw/zinc/20/98/28/937209828.db2.gz QMVPDRSYWYCUJD-SNVBAGLBSA-N 0 0 362.411 3.803 20 5 FHBDRN COc1ccc(C[C@H]2CCCN(C(=O)c3ccc([N+](=O)[O-])cc3F)C2)cc1 ZINC000610204076 928017239 /nfs/dbraw/zinc/01/72/39/928017239.db2.gz SMTISFCYBJCWSZ-OAHLLOKOSA-N 0 0 372.396 3.837 20 5 FHBDRN CC(C)(C(=O)Oc1ccc(-c2ccccc2)cc1)n1cc([N+](=O)[O-])cn1 ZINC000102212809 937216108 /nfs/dbraw/zinc/21/61/08/937216108.db2.gz XKEWJWKNVNEGGI-UHFFFAOYSA-N 0 0 351.362 3.799 20 5 FHBDRN Cc1ccccc1[C@@H]1CN(C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)CCO1 ZINC000610208699 928068658 /nfs/dbraw/zinc/06/86/58/928068658.db2.gz IMUXFZQNEIQDQO-IBGZPJMESA-N 0 0 368.433 3.781 20 5 FHBDRN Cc1cnn(-c2ccc(C(=O)NC(C)(C)c3ccc([N+](=O)[O-])cc3)cc2)c1 ZINC000176497748 937217415 /nfs/dbraw/zinc/21/74/15/937217415.db2.gz QWKRNLXUEZIFTJ-UHFFFAOYSA-N 0 0 364.405 3.754 20 5 FHBDRN CCO[C@H]1C[C@@H](Nc2cc(C)nc(-c3ccc([N+](=O)[O-])cc3)n2)C12CCC2 ZINC000610210879 928082038 /nfs/dbraw/zinc/08/20/38/928082038.db2.gz GOILKMRNPUNXMD-SJORKVTESA-N 0 0 368.437 3.542 20 5 FHBDRN Cc1ncc(/C=C/C(=O)OCCSc2ccc([N+](=O)[O-])cc2)s1 ZINC000784937527 928085025 /nfs/dbraw/zinc/08/50/25/928085025.db2.gz JBHIBSIGRIASFE-VOTSOKGWSA-N 0 0 350.421 3.708 20 5 FHBDRN CCOc1ccccc1CN(C)C(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000064834403 928110198 /nfs/dbraw/zinc/11/01/98/928110198.db2.gz NKJHDRBPGQRWTF-UHFFFAOYSA-N 0 0 371.437 3.844 20 5 FHBDRN O=C(Cc1c[nH]c2ccccc12)OCCSc1ccc([N+](=O)[O-])cc1 ZINC000784937036 928111055 /nfs/dbraw/zinc/11/10/55/928111055.db2.gz WEXOMXIVZMRTEF-UHFFFAOYSA-N 0 0 356.403 3.954 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(Cl)c(OC)c1 ZINC000471156226 928146912 /nfs/dbraw/zinc/14/69/12/928146912.db2.gz IMIKSZODSSOFQN-UHFFFAOYSA-N 0 0 350.758 3.908 20 5 FHBDRN Cc1ccc(Cl)cc1NC(=O)CN1c2ccc([N+](=O)[O-])cc2C[C@H]1C ZINC000728201399 928154097 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/nfs/dbraw/zinc/30/94/19/928309419.db2.gz OXDIQIXHFJGSJV-UHFFFAOYSA-N 0 0 371.418 3.588 20 5 FHBDRN CCOc1ccc(-c2noc(COc3ccc(OC)cc3[N+](=O)[O-])n2)cc1 ZINC000126941841 928315244 /nfs/dbraw/zinc/31/52/44/928315244.db2.gz BYFJYGFSNHZHLS-UHFFFAOYSA-N 0 0 371.349 3.631 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1CN[C@H](c1cc(F)ccc1F)C(F)F ZINC000430231500 928333049 /nfs/dbraw/zinc/33/30/49/928333049.db2.gz JXHNSSUGUVSSNM-OAHLLOKOSA-N 0 0 358.291 3.978 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CNc1ccccc1OC(F)(F)F ZINC000022812066 928363849 /nfs/dbraw/zinc/36/38/49/928363849.db2.gz CFOINGJJGLTGGL-UHFFFAOYSA-N 0 0 369.299 3.852 20 5 FHBDRN Cn1c(NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)nc2cc(F)ccc21 ZINC000545121491 937240152 /nfs/dbraw/zinc/24/01/52/937240152.db2.gz KWRBYGMLOPRYMM-UHFFFAOYSA-N 0 0 374.347 3.676 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1CN[C@H](CO)c1c(Cl)cccc1Cl ZINC000430236447 928381378 /nfs/dbraw/zinc/38/13/78/928381378.db2.gz AVLRXCAQYVCTED-CQSZACIVSA-N 0 0 371.220 3.733 20 5 FHBDRN CC[C@H](C)[C@H](NC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)C(F)(F)F ZINC000278137823 937243504 /nfs/dbraw/zinc/24/35/04/937243504.db2.gz NEVRVMTXLMEJSZ-RTHLEPHNSA-N 0 0 371.315 3.555 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1CN[C@@H](C)c1nc(C(F)(F)F)cs1 ZINC000430243369 928429410 /nfs/dbraw/zinc/42/94/10/928429410.db2.gz KXJYSWIFALTETL-QMMMGPOBSA-N 0 0 361.345 3.930 20 5 FHBDRN COc1cc(F)cc(CNC(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])c1 ZINC001266296166 928436118 /nfs/dbraw/zinc/43/61/18/928436118.db2.gz ITQAFTJLJZZKHR-UHFFFAOYSA-N 0 0 372.274 3.691 20 5 FHBDRN Cc1ccc(SC[C@@H](C)NC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)cc1 ZINC000472281818 937246140 /nfs/dbraw/zinc/24/61/40/937246140.db2.gz XJSCCPFTLRKAEZ-GFCCVEGCSA-N 0 0 374.418 3.543 20 5 FHBDRN COc1cc(CN(Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc2c1OCCO2 ZINC000127057881 928454663 /nfs/dbraw/zinc/45/46/63/928454663.db2.gz RXTWYVFWHFVJDE-UHFFFAOYSA-N 0 0 370.405 3.539 20 5 FHBDRN Cc1c(Br)c(N[C@H](C)c2cccc(O)c2)ncc1[N+](=O)[O-] ZINC000394752175 928472724 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CC(C)(C)OC1CC(CC(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000583226301 937257070 /nfs/dbraw/zinc/25/70/70/937257070.db2.gz KQYHLLCLDGFYJK-UHFFFAOYSA-N 0 0 373.453 3.719 20 5 FHBDRN C[C@@H](C(=O)NCCC1Cc2ccccc2C1)c1ccc([N+](=O)[O-])cc1F ZINC000583230724 937260104 /nfs/dbraw/zinc/26/01/04/937260104.db2.gz DURIERUTNFHMFT-CYBMUJFWSA-N 0 0 356.397 3.759 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)OCc1ncc(C)c([N+](=O)[O-])c1C ZINC000588570334 937262991 /nfs/dbraw/zinc/26/29/91/937262991.db2.gz YZJBQAQLAPARNT-FLIBITNWSA-N 0 0 371.349 3.662 20 5 FHBDRN COc1ccc([C@@H](NC(=O)CCNc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000248146325 937263398 /nfs/dbraw/zinc/26/33/98/937263398.db2.gz SPOJAZFYKXAUCY-FQEVSTJZSA-N 0 0 369.421 3.673 20 5 FHBDRN CC(C)(C)OCCNC(=O)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12 ZINC000547704434 928652417 /nfs/dbraw/zinc/65/24/17/928652417.db2.gz VODZHLZCXXCDAL-UHFFFAOYSA-N 0 0 374.387 3.504 20 5 FHBDRN C[C@@H](C(=O)NC1(c2ccc(F)cc2)CCOCC1)c1cccc([N+](=O)[O-])c1 ZINC000583239309 937270355 /nfs/dbraw/zinc/27/03/55/937270355.db2.gz RZYNWQPUMOZPKV-CQSZACIVSA-N 0 0 372.396 3.660 20 5 FHBDRN CCOc1cc(NC(=O)N2[C@H](C)CC[C@@H]2C)c([N+](=O)[O-])cc1OCC ZINC000176567368 937273988 /nfs/dbraw/zinc/27/39/88/937273988.db2.gz IVRPYMAWYQJNDT-TXEJJXNPSA-N 0 0 351.403 3.797 20 5 FHBDRN CCOc1cc(NC(=O)N2[C@H](C)CC[C@H]2C)c([N+](=O)[O-])cc1OCC ZINC000176567406 937274163 /nfs/dbraw/zinc/27/41/63/937274163.db2.gz IVRPYMAWYQJNDT-VXGBXAGGSA-N 0 0 351.403 3.797 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)N[C@H](C)c2cccc(O)c2)cc1SC ZINC000430259959 928845224 /nfs/dbraw/zinc/84/52/24/928845224.db2.gz PHFWYCCBNSFGPS-SNVBAGLBSA-N 0 0 362.407 3.522 20 5 FHBDRN COc1cc(C(=O)N[C@@H](CC2CC2)c2ccccc2)c([N+](=O)[O-])cc1OC ZINC000610236085 928870215 /nfs/dbraw/zinc/87/02/15/928870215.db2.gz IWNODQZFZKGTOC-INIZCTEOSA-N 0 0 370.405 3.883 20 5 FHBDRN COCc1nc2cc(NC(=O)c3cc(SC)ccc3[N+](=O)[O-])ccc2o1 ZINC000176597263 937285752 /nfs/dbraw/zinc/28/57/52/937285752.db2.gz ISEPDIPSKUTGIS-UHFFFAOYSA-N 0 0 373.390 3.857 20 5 FHBDRN COc1cc(O)cc(NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 ZINC000509531010 928921270 /nfs/dbraw/zinc/92/12/70/928921270.db2.gz ZXEAZOXDJFOIQM-UHFFFAOYSA-N 0 0 356.256 3.580 20 5 FHBDRN COC(=O)CCSc1ccc(C(=O)Nc2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000608971395 928931087 /nfs/dbraw/zinc/93/10/87/928931087.db2.gz HZBWCRKGHMNGOR-UHFFFAOYSA-N 0 0 374.418 3.811 20 5 FHBDRN O=C(c1cccc(Cl)c1[N+](=O)[O-])N(Cc1ccco1)C[C@H]1CCCO1 ZINC000175767944 928934808 /nfs/dbraw/zinc/93/48/08/928934808.db2.gz RYQYSLJISJEQPP-CYBMUJFWSA-N 0 0 364.785 3.663 20 5 FHBDRN COc1ccc(CN(C(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000583256431 937287905 /nfs/dbraw/zinc/28/79/05/937287905.db2.gz HHMBULIOMJSLJI-AWEZNQCLSA-N 0 0 354.406 3.898 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCO[C@](C)(c2ccccc2)C1 ZINC000583257045 937290292 /nfs/dbraw/zinc/29/02/92/937290292.db2.gz MEOCIKDODTVFFI-FQEVSTJZSA-N 0 0 354.406 3.599 20 5 FHBDRN Cc1ccc(C(=O)CCC(=O)CCC(=O)Nc2cccc([N+](=O)[O-])c2)s1 ZINC000032643954 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NLXCTTIGYCRPJW-WFASDCNBSA-N 0 0 365.393 3.609 20 5 FHBDRN Nc1ccc([N+](=O)[O-])cc1-c1nc(-c2cc(Br)cs2)no1 ZINC000071302686 930729628 /nfs/dbraw/zinc/72/96/28/930729628.db2.gz HVXKYBQRYCOIAG-UHFFFAOYSA-N 0 0 367.184 3.718 20 5 FHBDRN COc1ccccc1[C@@H]1CCN(C(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000579666568 930734021 /nfs/dbraw/zinc/73/40/21/930734021.db2.gz CUOOAIUOGIVDOQ-GOEBONIOSA-N 0 0 354.406 3.723 20 5 FHBDRN COc1ccc(OC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000050256561 930752369 /nfs/dbraw/zinc/75/23/69/930752369.db2.gz QYGFDDQSUWNABE-UHFFFAOYSA-N 0 0 356.359 3.946 20 5 FHBDRN C[C@](O)(C1CCN(c2c3ccccc3ncc2[N+](=O)[O-])CC1)C(F)(F)F ZINC000580510553 930781003 /nfs/dbraw/zinc/78/10/03/930781003.db2.gz VWVAQXNFMHYZRN-INIZCTEOSA-N 0 0 369.343 3.673 20 5 FHBDRN CCCn1c(C)cc(C(=O)COc2ccc(C(C)=O)cc2[N+](=O)[O-])c1C ZINC000119165076 930796361 /nfs/dbraw/zinc/79/63/61/930796361.db2.gz ZKEARJZOIKOAER-UHFFFAOYSA-N 0 0 358.394 3.887 20 5 FHBDRN O=C(COc1cccc([N+](=O)[O-])c1)N1C[C@H](c2ccccc2)[C@@H]2CCC[C@@H]21 ZINC000561137924 930805033 /nfs/dbraw/zinc/80/50/33/930805033.db2.gz LHVKLIOPHCNCIJ-ZCNNSNEGSA-N 0 0 366.417 3.768 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])N[C@H]1CC[C@@H](c2ccc(F)cc2)C1 ZINC000471590571 930826547 /nfs/dbraw/zinc/82/65/47/930826547.db2.gz NMZOIOPIGMWDTM-PBHICJAKSA-N 0 0 357.385 3.869 20 5 FHBDRN COC1CCC(N(C)C(=O)CCc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000932923156 930848044 /nfs/dbraw/zinc/84/80/44/930848044.db2.gz UQIZWYFUZHPEKE-UHFFFAOYSA-N 0 0 354.834 3.597 20 5 FHBDRN CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1N[C@H](C)Cc1c(C)noc1C ZINC000077226440 930866103 /nfs/dbraw/zinc/86/61/03/930866103.db2.gz PCQFCBBLPKHOJU-SECBINFHSA-N 0 0 365.361 3.559 20 5 FHBDRN C[C@H](c1ccc(F)c(F)c1)N(C)c1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1 ZINC000580589665 930892006 /nfs/dbraw/zinc/89/20/06/930892006.db2.gz KGIPTSWVPNYLLS-SECBINFHSA-N 0 0 360.320 3.719 20 5 FHBDRN COc1cc(C(=O)N[C@H]2CC(C)(C)c3ccccc32)c([N+](=O)[O-])cc1OC ZINC000119213615 930892194 /nfs/dbraw/zinc/89/21/94/930892194.db2.gz HBLAKEIPTJKJBI-HNNXBMFYSA-N 0 0 370.405 3.764 20 5 FHBDRN COc1cc(Cc2noc(C[C@H]3CCC[C@H]3C)n2)c([N+](=O)[O-])c(OC)c1 ZINC000580601789 930911140 /nfs/dbraw/zinc/91/11/40/930911140.db2.gz QJIOMUQYMOQTRF-VXGBXAGGSA-N 0 0 361.398 3.565 20 5 FHBDRN C[C@@H]1CN(C(=O)CCc2cccc([N+](=O)[O-])c2)C[C@H](c2ccsc2)O1 ZINC000155801003 930922219 /nfs/dbraw/zinc/92/22/19/930922219.db2.gz MIANHLGHYXYXMC-CXAGYDPISA-N 0 0 360.435 3.578 20 5 FHBDRN Cc1ccc([C@H](C)[NH2+]Cc2ccccc2Cn2cccn2)cc1[N+](=O)[O-] ZINC000119248407 930951647 /nfs/dbraw/zinc/95/16/47/930951647.db2.gz HNVBQHIIKNNMJO-INIZCTEOSA-N 0 0 350.422 3.999 20 5 FHBDRN CC(C)c1cc(C(=O)N(C)Cc2cc([N+](=O)[O-])ccc2Cl)cc(=O)[nH]1 ZINC000121238272 931012762 /nfs/dbraw/zinc/01/27/62/931012762.db2.gz WIIWVRJFQYETAI-UHFFFAOYSA-N 0 0 363.801 3.744 20 5 FHBDRN C[C@@H]1C[C@H](NC(=O)c2cc(F)cc3c(=O)c4cc(F)ccc4[nH]c23)CS1 ZINC000580701091 931022606 /nfs/dbraw/zinc/02/26/06/931022606.db2.gz HOOWUPPWMPWUQJ-SKDRFNHKSA-N 0 0 374.412 3.583 20 5 FHBDRN C[C@H](C(=O)N1C[C@@H](c2ccccc2)OC[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000579785148 931028853 /nfs/dbraw/zinc/02/88/53/931028853.db2.gz PIHSWFIYKMBNJM-DOXZYTNZSA-N 0 0 354.406 3.687 20 5 FHBDRN Cc1sc(C(=O)N[C@@H]2CC(C)(C)Oc3ccc(N)cc32)cc1[N+](=O)[O-] ZINC000580709389 931041843 /nfs/dbraw/zinc/04/18/43/931041843.db2.gz XAXUUKXPXFAVTD-GFCCVEGCSA-N 0 0 361.423 3.579 20 5 FHBDRN CCN(c1ccccc1)S(=O)(=O)c1cc([N+](=O)[O-])c(C)cc1Cl ZINC000083975881 931051336 /nfs/dbraw/zinc/05/13/36/931051336.db2.gz TXTCNQRPCUYHRQ-UHFFFAOYSA-N 0 0 354.815 3.772 20 5 FHBDRN O=[N+]([O-])c1cc(F)ccc1Sc1nnnn1-c1ccc(Cl)cc1 ZINC000068836966 931061050 /nfs/dbraw/zinc/06/10/50/931061050.db2.gz PDPUWMKSKSDEJN-UHFFFAOYSA-N 0 0 351.750 3.514 20 5 FHBDRN Cc1nccn1-c1ccc([C@@H](C)NC(=O)c2cc(F)ccc2[N+](=O)[O-])cc1 ZINC000119310052 931068795 /nfs/dbraw/zinc/06/87/95/931068795.db2.gz XDIOCNYITSMVIG-GFCCVEGCSA-N 0 0 368.368 3.719 20 5 FHBDRN O=C(CCC1CCCC1)N1CCN(c2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000247288684 931081319 /nfs/dbraw/zinc/08/13/19/931081319.db2.gz ACBYUDLCEUTBKA-UHFFFAOYSA-N 0 0 365.861 3.867 20 5 FHBDRN CC1(C)CN(C(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)CC[C@H]1O ZINC000275955408 931102209 /nfs/dbraw/zinc/10/22/09/931102209.db2.gz ZCEWTZRXPNFRMV-GOSISDBHSA-N 0 0 370.405 3.620 20 5 FHBDRN O=C(NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)[C@@H]1CCCC(F)(F)C1 ZINC000580796977 931156226 /nfs/dbraw/zinc/15/62/26/931156226.db2.gz LWMWEQTZLVPFHU-LLVKDONJSA-N 0 0 351.353 3.560 20 5 FHBDRN CNc1c(C(=O)N2CCC(c3ncccc3Cl)CC2)cccc1[N+](=O)[O-] ZINC000430515096 931167347 /nfs/dbraw/zinc/16/73/47/931167347.db2.gz NFGQPPFTSNVMHU-UHFFFAOYSA-N 0 0 374.828 3.705 20 5 FHBDRN CC(C)(NC(=O)[C@H]1C[C@@]12CCc1ccccc12)c1ccccc1[N+](=O)[O-] ZINC000579872153 931170144 /nfs/dbraw/zinc/17/01/44/931170144.db2.gz NUWXHTNVKWEHNL-DYESRHJHSA-N 0 0 350.418 3.850 20 5 FHBDRN CC(C)(NC(=O)C(C)(C)Oc1ccc(F)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000430520974 931198465 /nfs/dbraw/zinc/19/84/65/931198465.db2.gz PVGDFFIGOMBAFB-UHFFFAOYSA-N 0 0 360.385 3.943 20 5 FHBDRN COC(=O)c1cc([N+](=O)[O-])c(C)cc1NCc1nc(C)c2ccccc2n1 ZINC000561186260 931223706 /nfs/dbraw/zinc/22/37/06/931223706.db2.gz VDPKXOWDVJVEIM-UHFFFAOYSA-N 0 0 366.377 3.554 20 5 FHBDRN O=C(c1cccc(Cl)c1[N+](=O)[O-])N1CCCC[C@@H]([C@H]2CCOC2)C1 ZINC000891330074 931227577 /nfs/dbraw/zinc/22/75/77/931227577.db2.gz BUFIDUVQRNJNDU-OLZOCXBDSA-N 0 0 352.818 3.527 20 5 FHBDRN COc1ccc(F)cc1[C@H](C)NC(=O)c1cc(SC)ccc1[N+](=O)[O-] ZINC000046403037 931238141 /nfs/dbraw/zinc/23/81/41/931238141.db2.gz SVNWCHQWXBOESK-JTQLQIEISA-N 0 0 364.398 3.955 20 5 FHBDRN C[C@@H](SCc1ccc(S(C)(=O)=O)cc1)c1ccccc1[N+](=O)[O-] ZINC000580848050 931258525 /nfs/dbraw/zinc/25/85/25/931258525.db2.gz HBIOJOOOULFRJG-GFCCVEGCSA-N 0 0 351.449 3.993 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)OCc1nc2ccccc2s1 ZINC000160664850 931275067 /nfs/dbraw/zinc/27/50/67/931275067.db2.gz SINNCXCSTGGLJD-UHFFFAOYSA-N 0 0 367.386 3.972 20 5 FHBDRN Cc1noc2nc(C)cc(C(=O)N[C@H](C)c3ccc(C)c([N+](=O)[O-])c3)c12 ZINC000177843508 931289126 /nfs/dbraw/zinc/28/91/26/931289126.db2.gz YPALWWMHBAJRPQ-LLVKDONJSA-N 0 0 354.366 3.547 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)c2ccn(-c3ccccc3F)n2)cc1[N+](=O)[O-] ZINC000177851019 931295308 /nfs/dbraw/zinc/29/53/08/931295308.db2.gz LBKHDHVICLPFIW-CYBMUJFWSA-N 0 0 368.368 3.719 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N2CCCC[C@@H]([C@@H]3CCOC3)C2)c1 ZINC000891337608 931297193 /nfs/dbraw/zinc/29/71/93/931297193.db2.gz HOAPPWSKAQYPCC-ZIAGYGMSSA-N 0 0 364.467 3.596 20 5 FHBDRN CC[C@@H](CSC)N(C)C(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC001266664392 931308214 /nfs/dbraw/zinc/30/82/14/931308214.db2.gz BXRNHUYBLPGTKV-AWEZNQCLSA-N 0 0 359.451 3.870 20 5 FHBDRN O=C(c1ccc(Cl)cc1[N+](=O)[O-])N1CCCC[C@H]([C@H]2CCOC2)C1 ZINC000891340533 931317428 /nfs/dbraw/zinc/31/74/28/931317428.db2.gz GYDYAHVNMACVFS-STQMWFEESA-N 0 0 352.818 3.527 20 5 FHBDRN O=C(C1CC(OCc2ccccc2)C1)N1CCCc2ccc([N+](=O)[O-])cc21 ZINC000610466636 931321714 /nfs/dbraw/zinc/32/17/14/931321714.db2.gz MCIADSKVVLAINQ-UHFFFAOYSA-N 0 0 366.417 3.869 20 5 FHBDRN CC[C@H](CNc1cccc(C(N)=O)c1[N+](=O)[O-])Oc1cccc(Cl)c1 ZINC000561233606 931338278 /nfs/dbraw/zinc/33/82/78/931338278.db2.gz LUIKNGJEGXCXMZ-GFCCVEGCSA-N 0 0 363.801 3.617 20 5 FHBDRN C[C@H]1Oc2ccccc2[C@@H]1NC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000580915650 931341553 /nfs/dbraw/zinc/34/15/53/931341553.db2.gz WGFFWBYMBMKHBE-RFAUZJTJSA-N 0 0 366.295 3.866 20 5 FHBDRN Cn1nc([N+](=O)[O-])cc1-c1nc(C2(c3ccc(F)cc3)CCCCC2)no1 ZINC000580919789 931342327 /nfs/dbraw/zinc/34/23/27/931342327.db2.gz ZICQFZFHEAYKKU-UHFFFAOYSA-N 0 0 371.372 3.768 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@H](c1ccccc1)C(C)(C)C ZINC000126087633 931382565 /nfs/dbraw/zinc/38/25/65/931382565.db2.gz AJDVVXPMEQGLAG-QGZVFWFLSA-N 0 0 369.421 3.745 20 5 FHBDRN COc1ccc(OC)c(CCC(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000177864978 931393168 /nfs/dbraw/zinc/39/31/68/931393168.db2.gz FZJYTUSRELDWBL-AWEZNQCLSA-N 0 0 372.421 3.730 20 5 FHBDRN COc1ccc(CSCC(=O)Nc2cccc3cc[nH]c32)cc1[N+](=O)[O-] ZINC000548148466 931404942 /nfs/dbraw/zinc/40/49/42/931404942.db2.gz MZAGTFJGHGXKNP-UHFFFAOYSA-N 0 0 371.418 3.957 20 5 FHBDRN Cc1c(Br)cc([N+](=O)[O-])cc1-c1nc([C@H]2CCCOC2)no1 ZINC000580958510 931409043 /nfs/dbraw/zinc/40/90/43/931409043.db2.gz CYVOBCQIOGHKDF-VIFPVBQESA-N 0 0 368.187 3.610 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)[C@H](C)N2CCc3ccccc3C2)cc1[N+](=O)[O-] ZINC000177875739 931431046 /nfs/dbraw/zinc/43/10/46/931431046.db2.gz GKGJUHOISQKZEI-CVEARBPZSA-N 0 0 367.449 3.527 20 5 FHBDRN CCS[C@@H]1CCC[C@@H](NC(=O)N(C)Cc2ccccc2[N+](=O)[O-])C1 ZINC000175874974 931434056 /nfs/dbraw/zinc/43/40/56/931434056.db2.gz PAAGEVLWHVODBE-HUUCEWRRSA-N 0 0 351.472 3.801 20 5 FHBDRN O=C(Nc1cnn(-c2ccccc2F)c1)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000160712106 931437923 /nfs/dbraw/zinc/43/79/23/931437923.db2.gz KIGSUXJIDKCAOR-UHFFFAOYSA-N 0 0 360.732 3.825 20 5 FHBDRN O=C(NCc1cccc(OC(F)F)c1)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000050639576 931447524 /nfs/dbraw/zinc/44/75/24/931447524.db2.gz KPRXNCRFZKGFCD-UHFFFAOYSA-N 0 0 361.304 3.608 20 5 FHBDRN CC(=O)c1ccc([N+](=O)[O-])cc1N1CCN(C/C=C\c2ccccc2)CC1 ZINC000581032513 931478991 /nfs/dbraw/zinc/47/89/91/931478991.db2.gz MXVBGCYRBOCXLT-YVMONPNESA-N 0 0 365.433 3.633 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](C)CCc2ccc(O)cc2)c1 ZINC000155975811 931515540 /nfs/dbraw/zinc/51/55/40/931515540.db2.gz WBIHBFKQCCXSGU-LBPRGKRZSA-N 0 0 360.435 3.773 20 5 FHBDRN CC[C@@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)OC)cc([N+](=O)[O-])c1C ZINC000581047715 931525667 /nfs/dbraw/zinc/52/56/67/931525667.db2.gz UZSAJPQHAZVWNE-HNNXBMFYSA-N 0 0 370.405 3.897 20 5 FHBDRN O=C(Cc1cccc([N+](=O)[O-])c1)NCC1(CCOCc2ccccc2)CC1 ZINC000187358939 931552003 /nfs/dbraw/zinc/55/20/03/931552003.db2.gz GTWBDYATJKIGJF-UHFFFAOYSA-N 0 0 368.433 3.641 20 5 FHBDRN O=C(CCc1ccc2c(c1)OC(F)(F)O2)OCc1cccc([N+](=O)[O-])c1 ZINC001125485739 931582065 /nfs/dbraw/zinc/58/20/65/931582065.db2.gz PUVRETGVMZTIQE-UHFFFAOYSA-N 0 0 365.288 3.592 20 5 FHBDRN COc1ccc(CNC(=O)[C@H]2C[C@H]2c2ccccc2Cl)cc1[N+](=O)[O-] ZINC000581145832 931615168 /nfs/dbraw/zinc/61/51/68/931615168.db2.gz KPHJKLYGNCSSJX-KBPBESRZSA-N 0 0 360.797 3.677 20 5 FHBDRN C[C@H](c1nc(CCn2cnc3ccccc32)no1)c1cccc([N+](=O)[O-])c1 ZINC000581183863 931649001 /nfs/dbraw/zinc/64/90/01/931649001.db2.gz VMCPSJKHMSLACF-ZDUSSCGKSA-N 0 0 363.377 3.722 20 5 FHBDRN CCOc1ccc(C(=O)N2CC[C@@H](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000126250341 931661090 /nfs/dbraw/zinc/66/10/90/931661090.db2.gz ANGJWXFEBZIAOK-INIZCTEOSA-N 0 0 354.406 3.698 20 5 FHBDRN CN(C[C@H]1CCCC[C@H]1O)C(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000276054274 931687790 /nfs/dbraw/zinc/68/77/90/931687790.db2.gz ZFXLCZKQTZMGAS-FOIQADDNSA-N 0 0 364.445 3.717 20 5 FHBDRN O=C(Nc1ccc(F)cc1-c1nc(C2CC2)no1)c1cccc([N+](=O)[O-])c1 ZINC000471642019 931709477 /nfs/dbraw/zinc/70/94/77/931709477.db2.gz IHPRYFITJZNPHA-UHFFFAOYSA-N 0 0 368.324 3.914 20 5 FHBDRN Nc1ccc([N+](=O)[O-])cc1C(=O)OCc1csc(-c2ccccc2F)n1 ZINC000728321540 931715077 /nfs/dbraw/zinc/71/50/77/931715077.db2.gz XZGIITFDLHTJIU-UHFFFAOYSA-N 0 0 373.365 3.797 20 5 FHBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N2C[C@H](c3ccccc3)[C@@H]3CCC[C@@H]32)c1 ZINC000510370446 931717862 /nfs/dbraw/zinc/71/78/62/931717862.db2.gz ZHMBDXWVQGXXLT-OTWHNJEPSA-N 0 0 372.446 3.552 20 5 FHBDRN CNC(=O)c1ccc(CSCCCOc2ccc([N+](=O)[O-])cc2)cc1 ZINC000066904036 931735715 /nfs/dbraw/zinc/73/57/15/931735715.db2.gz NYSTYRFMNUWNRO-UHFFFAOYSA-N 0 0 360.435 3.657 20 5 FHBDRN CCc1ccc(S(=O)(=O)N(C)[C@@H](C)c2cccs2)cc1[N+](=O)[O-] ZINC000581248127 931736651 /nfs/dbraw/zinc/73/66/51/931736651.db2.gz NIEYLCXTOGDXHH-NSHDSACASA-N 0 0 354.453 3.600 20 5 FHBDRN CN(C[C@@H]1CCCO[C@@H]1c1ccccc1)C(=O)c1ccc([N+](=O)[O-])cc1F ZINC000050861875 931739072 /nfs/dbraw/zinc/73/90/72/931739072.db2.gz WBBRPLSAPRKZRC-HNAYVOBHSA-N 0 0 372.396 3.974 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)N(C)C[C@H]1CCCO[C@H]1c1ccccc1 ZINC000050867233 931759221 /nfs/dbraw/zinc/75/92/21/931759221.db2.gz ZGESYOUUCDZRLB-APWZRJJASA-N 0 0 369.421 3.538 20 5 FHBDRN CNC(=O)c1ccc(NCCn2ccc3cc(Cl)ccc32)c([N+](=O)[O-])c1 ZINC000581268512 931760902 /nfs/dbraw/zinc/76/09/02/931760902.db2.gz WUQNHSXJJNXAOZ-UHFFFAOYSA-N 0 0 372.812 3.675 20 5 FHBDRN COc1ccc(NC(=O)COc2cc(Cl)ccc2[N+](=O)[O-])cc1Cl ZINC000121286784 931765164 /nfs/dbraw/zinc/76/51/64/931765164.db2.gz CFWWZGZXCCEPOG-UHFFFAOYSA-N 0 0 371.176 3.928 20 5 FHBDRN O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+](CCc3c(F)cccc3Cl)C2)nc1 ZINC000477061658 931787999 /nfs/dbraw/zinc/78/79/99/931787999.db2.gz ADNWBODTPNYEKL-GFCCVEGCSA-N 0 0 364.808 3.511 20 5 FHBDRN CN(C[C@@H]1CCCO[C@H]1c1ccccc1)C(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000050894052 931791432 /nfs/dbraw/zinc/79/14/32/931791432.db2.gz NOSKYSNMXRGVNS-RXVVDRJESA-N 0 0 368.433 3.764 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)N1CCCCC[C@@H]1[C@H]1CCCCC1=O ZINC000126401817 931803037 /nfs/dbraw/zinc/80/30/37/931803037.db2.gz CRVWHPZNSNCROX-QZTJIDSGSA-N 0 0 358.438 3.668 20 5 FHBDRN Cc1nc(-c2ccc(NC(=O)c3ccc(Cl)cc3[N+](=O)[O-])cc2)n[nH]1 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372.711 3.867 20 5 FHBDRN Cc1cc(OCC(=O)Nc2c(F)cccc2N2CCCC2)ccc1[N+](=O)[O-] ZINC000430571464 931910517 /nfs/dbraw/zinc/91/05/17/931910517.db2.gz DCVMCZSMDSXHJN-UHFFFAOYSA-N 0 0 373.384 3.660 20 5 FHBDRN Cc1ccc(C(=O)NC2CCN(c3cccc(F)c3[N+](=O)[O-])CC2)s1 ZINC000050954646 931926488 /nfs/dbraw/zinc/92/64/88/931926488.db2.gz DDCKFJXXFXPKCJ-UHFFFAOYSA-N 0 0 363.414 3.503 20 5 FHBDRN CC(C)(NC(=O)Cc1cccc([N+](=O)[O-])c1)c1cccc(Cl)c1F ZINC000471646551 931933930 /nfs/dbraw/zinc/93/39/30/931933930.db2.gz LXFNZCMUAQZWDO-UHFFFAOYSA-N 0 0 350.777 3.981 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N[C@@H]1[C@H]2CCO[C@@H]2C12CCCC2 ZINC000165606741 931940290 /nfs/dbraw/zinc/94/02/90/931940290.db2.gz PEMCANCZNXLEMY-DFBGVHRSSA-N 0 0 365.817 3.717 20 5 FHBDRN COc1ccc(C)cc1Cc1noc(COc2ccc([N+](=O)[O-])c(C)c2)n1 ZINC000581394668 931946212 /nfs/dbraw/zinc/94/62/12/931946212.db2.gz UUTMYKPPODXTNE-UHFFFAOYSA-N 0 0 369.377 3.773 20 5 FHBDRN CN(C[C@H]1CCCO[C@@H]1c1ccccc1)c1nc2sccn2c1[N+](=O)[O-] ZINC000050956789 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20 5 FHBDRN C[C@@H]1C[C@H](c2ccc(F)cc2)CN1C(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000135235625 932079984 /nfs/dbraw/zinc/07/99/84/932079984.db2.gz JRNPMZCBPOCZHY-HIFRSBDPSA-N 0 0 358.369 3.517 20 5 FHBDRN C[C@H]1C[C@H](c2ccc(F)cc2)CN1C(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000135239513 932080775 /nfs/dbraw/zinc/08/07/75/932080775.db2.gz YGTXGDVGDMMBHZ-HOCLYGCPSA-N 0 0 372.396 3.907 20 5 FHBDRN O=[N+]([O-])c1ccccc1CN(Cc1nc(-c2ccc(F)cc2)no1)C1CC1 ZINC000135236660 932085915 /nfs/dbraw/zinc/08/59/15/932085915.db2.gz JWEBGKMVOOUEHJ-UHFFFAOYSA-N 0 0 368.368 3.949 20 5 FHBDRN CC(=O)Nc1ccc(Cl)cc1NC(=O)c1cc([N+](=O)[O-])c(F)cc1C ZINC001125503133 932088086 /nfs/dbraw/zinc/08/80/86/932088086.db2.gz JZSGDKPPUITUAY-UHFFFAOYSA-N 0 0 365.748 3.906 20 5 FHBDRN CCc1n[nH]c(C(=O)NCCc2ccc(-c3ccccc3)cc2)c1[N+](=O)[O-] ZINC000178013331 932095791 /nfs/dbraw/zinc/09/57/91/932095791.db2.gz IQJVWPLXWCWSPD-UHFFFAOYSA-N 0 0 364.405 3.520 20 5 FHBDRN COc1cc(C(=O)N2C[C@H](c3ccc(F)cc3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000135246587 932096640 /nfs/dbraw/zinc/09/66/40/932096640.db2.gz IWTLLMDTCPCIOV-IUODEOHRSA-N 0 0 358.369 3.761 20 5 FHBDRN CC(=O)N1CCCN(C(=O)c2cccc(Cl)c2[N+](=O)[O-])c2ccccc21 ZINC000175900124 932132783 /nfs/dbraw/zinc/13/27/83/932132783.db2.gz GLWPFTCHVMFOTI-UHFFFAOYSA-N 0 0 373.796 3.652 20 5 FHBDRN COC(=O)Cc1cccc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)c1 ZINC000178026996 932132995 /nfs/dbraw/zinc/13/29/95/932132995.db2.gz FDOFBQHKPWWNGO-UHFFFAOYSA-N 0 0 370.386 3.777 20 5 FHBDRN Cc1cc(NC(=O)c2cc([N+](=O)[O-])cc(C)n2)nn1-c1cccc(Cl)c1 ZINC001266744997 932139591 /nfs/dbraw/zinc/13/95/91/932139591.db2.gz JRFWJWFCJRGALT-UHFFFAOYSA-N 0 0 371.784 3.698 20 5 FHBDRN CC[C@@H](O)CN(Cc1nc2cc([N+](=O)[O-])ccc2o1)Cc1ccccc1 ZINC000134501906 932141416 /nfs/dbraw/zinc/14/14/16/932141416.db2.gz ULKCRZXYMYXPHS-MRXNPFEDSA-N 0 0 355.394 3.509 20 5 FHBDRN COc1ccccc1[C@@H](CNC(=O)c1ccc([N+](=O)[O-])c(C)c1)OC(C)C ZINC000187416635 932174102 /nfs/dbraw/zinc/17/41/02/932174102.db2.gz MWZMUMYYCAYAIQ-LJQANCHMSA-N 0 0 372.421 3.808 20 5 FHBDRN Cc1sc(NC(=O)C[C@@H]2CCCCO2)nc1-c1cccc([N+](=O)[O-])c1 ZINC000127189337 932238023 /nfs/dbraw/zinc/23/80/23/932238023.db2.gz CXOQZDNARHKDPQ-AWEZNQCLSA-N 0 0 361.423 3.924 20 5 FHBDRN Cc1ccc(C[C@H]2CCCN(S(=O)(=O)c3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000561494133 932248848 /nfs/dbraw/zinc/24/88/48/932248848.db2.gz SUBORPOTEWTPNV-QGZVFWFLSA-N 0 0 374.462 3.547 20 5 FHBDRN O=C(Nc1ccccc1-c1ncc2n1CCCC2)c1ccc([N+](=O)[O-])o1 ZINC000581564588 932251535 /nfs/dbraw/zinc/25/15/35/932251535.db2.gz XTCBTZGBAZCZTR-UHFFFAOYSA-N 0 0 352.350 3.640 20 5 FHBDRN Cc1cc(=NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)[nH]n1C1CCCCC1 ZINC000581581133 932275034 /nfs/dbraw/zinc/27/50/34/932275034.db2.gz MGEOHXXDCZDLKX-UHFFFAOYSA-N 0 0 362.817 3.933 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CC[C@@H]2c2cccc(F)c2)c(Br)c1 ZINC000610512595 932313243 /nfs/dbraw/zinc/31/32/43/932313243.db2.gz QBSULTDCFYBKOQ-CYBMUJFWSA-N 0 0 352.163 3.843 20 5 FHBDRN Cc1ccc(CN(c2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])C2CC2)o1 ZINC000610514847 932328861 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C[C@H](C(=O)NCCNc1ccccc1[N+](=O)[O-])c1cc2ccccc2o1 ZINC000175927433 932568651 /nfs/dbraw/zinc/56/86/51/932568651.db2.gz FLWSYBLECZFUFK-ZDUSSCGKSA-N 0 0 353.378 3.673 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N1CCO[C@@H](c2cccs2)C1 ZINC000477428579 932576885 /nfs/dbraw/zinc/57/68/85/932576885.db2.gz RJQGFZZNUNIVHG-CYBMUJFWSA-N 0 0 366.826 3.832 20 5 FHBDRN CCOc1ccc(-c2nc(Cn3cc([N+](=O)[O-])cc(C)c3=O)cs2)cc1 ZINC000127292572 932631147 /nfs/dbraw/zinc/63/11/47/932631147.db2.gz KFRROPNFGVRLDF-UHFFFAOYSA-N 0 0 371.418 3.635 20 5 FHBDRN O=C(Cc1c(Cl)cccc1Cl)NCCNc1ccccc1[N+](=O)[O-] ZINC000008145643 932658848 /nfs/dbraw/zinc/65/88/48/932658848.db2.gz DYNAQHUSJOWLPY-UHFFFAOYSA-N 0 0 368.220 3.672 20 5 FHBDRN Cc1ccc(NC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)cc1Cl ZINC000109984431 932670584 /nfs/dbraw/zinc/67/05/84/932670584.db2.gz LUHDPLLWODAWLE-UHFFFAOYSA-N 0 0 357.753 3.650 20 5 FHBDRN O=C(Nc1c(-c2ccncc2)nc2ccccn21)c1ccc([N+](=O)[O-])s1 ZINC000430659383 932681949 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/nfs/dbraw/zinc/58/02/19/933580219.db2.gz HEHALQFEQCOJLN-UHFFFAOYSA-N 0 0 355.419 3.655 20 5 FHBDRN COC(=O)[C@H](C)Cc1ccc(NC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)cc1 ZINC000588454621 933582119 /nfs/dbraw/zinc/58/21/19/933582119.db2.gz XPLIKSXHSZMOSK-YRBHFNIASA-N 0 0 368.389 3.598 20 5 FHBDRN Cc1ccccc1CC1CN(C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000610640181 933588668 /nfs/dbraw/zinc/58/86/68/933588668.db2.gz IBZVDLQBGYIYPB-HNNXBMFYSA-N 0 0 353.422 3.848 20 5 FHBDRN Cc1cccc(C)c1NC(=O)COC(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000003485185 933592228 /nfs/dbraw/zinc/59/22/28/933592228.db2.gz ACLNPXAHSOQDEY-UHFFFAOYSA-N 0 0 362.769 3.661 20 5 FHBDRN Cc1ccncc1CN(C)C(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000510764602 933668475 /nfs/dbraw/zinc/66/84/75/933668475.db2.gz PKLAEINXBNQZQU-UHFFFAOYSA-N 0 0 353.300 3.589 20 5 FHBDRN COc1ccc(CN(Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C2CC2)cc1 ZINC000510765680 933675340 /nfs/dbraw/zinc/67/53/40/933675340.db2.gz OLOKBKSRZHZDJK-UHFFFAOYSA-N 0 0 352.394 3.644 20 5 FHBDRN CSc1ccc(C(=O)N2CC(Cc3ccccc3C)C2)cc1[N+](=O)[O-] ZINC000610660455 933679629 /nfs/dbraw/zinc/67/96/29/933679629.db2.gz RCBNCZAZQUAVHG-UHFFFAOYSA-N 0 0 356.447 3.940 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)c1cn(-c2ccc(Cl)cc2)nn1 ZINC000610664571 933680804 /nfs/dbraw/zinc/68/08/04/933680804.db2.gz HBXLFHKBJZMROD-UHFFFAOYSA-N 0 0 371.784 3.698 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])c[nH]1)N1CCC[C@H]1c1ccccc1Br ZINC000610669715 933704918 /nfs/dbraw/zinc/70/49/18/933704918.db2.gz JXNSMNGSZMBRQT-AWEZNQCLSA-N 0 0 364.199 3.663 20 5 FHBDRN C[C@H](NCc1ccnn1CCc1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000610676126 933749044 /nfs/dbraw/zinc/74/90/44/933749044.db2.gz NCFLWLMVAFLUJU-INIZCTEOSA-N 0 0 350.422 3.885 20 5 FHBDRN Cc1nn(C)c(C(=O)N2CCC[C@H]2c2cccc3ccccc32)c1[N+](=O)[O-] ZINC000098102560 933756452 /nfs/dbraw/zinc/75/64/52/933756452.db2.gz SKSHMYKOWOVKOY-KRWDZBQOSA-N 0 0 364.405 3.767 20 5 FHBDRN C[C@H](NC(=O)OC(C)(C)C)[C@H](C)c1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000276844893 933776201 /nfs/dbraw/zinc/77/62/01/933776201.db2.gz CTNPPNNPSWRZAL-QWRGUYRKSA-N 0 0 362.386 3.662 20 5 FHBDRN CCCOc1ccc([C@@H](C)NC(=O)COc2ccc([N+](=O)[O-])c(C)c2)cc1 ZINC000510818327 933805919 /nfs/dbraw/zinc/80/59/19/933805919.db2.gz XXIHLWYBXLRPHM-OAHLLOKOSA-N 0 0 372.421 3.948 20 5 FHBDRN CCc1ccc(C(=O)NCCCCOCc2ccccc2)cc1[N+](=O)[O-] ZINC000471928044 933841880 /nfs/dbraw/zinc/84/18/80/933841880.db2.gz QFRWJOXGKWYSRA-UHFFFAOYSA-N 0 0 356.422 3.884 20 5 FHBDRN O=C(NC1(C(F)(F)F)CC1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000610704409 933849007 /nfs/dbraw/zinc/84/90/07/933849007.db2.gz WZUVTIHCHPYISZ-UHFFFAOYSA-N 0 0 357.313 3.543 20 5 FHBDRN O=C(c1c(F)c(F)cc(F)c1F)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000431110125 933850957 /nfs/dbraw/zinc/85/09/57/933850957.db2.gz GTWVLBZHBUKLFV-UHFFFAOYSA-N 0 0 368.286 3.956 20 5 FHBDRN C/C(=C/C(=O)Nc1ccc(Br)c([N+](=O)[O-])c1)c1ccco1 ZINC001266938880 933857907 /nfs/dbraw/zinc/85/79/07/933857907.db2.gz SLRVRKMURASGBN-CLFYSBASSA-N 0 0 351.156 3.992 20 5 FHBDRN COC(=O)c1cccc(NCc2ccc([N+](=O)[O-])c(OC)c2)c1Cl ZINC000431120109 933857945 /nfs/dbraw/zinc/85/79/45/933857945.db2.gz MEAXQUNMGYSRGP-UHFFFAOYSA-N 0 0 350.758 3.656 20 5 FHBDRN C/C(=C\C(=O)Nc1ccc(Br)c([N+](=O)[O-])c1)c1ccco1 ZINC001266938881 933858032 /nfs/dbraw/zinc/85/80/32/933858032.db2.gz SLRVRKMURASGBN-VQHVLOKHSA-N 0 0 351.156 3.992 20 5 FHBDRN O=C(N[C@H]1COc2c1cccc2Cl)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000610709556 933871664 /nfs/dbraw/zinc/87/16/64/933871664.db2.gz WXKWVKZNGXMYHR-ZDUSSCGKSA-N 0 0 358.737 3.858 20 5 FHBDRN CC1(C)CN(C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)c2ccccc21 ZINC000610709059 933876026 /nfs/dbraw/zinc/87/60/26/933876026.db2.gz MSWZAPLGDCQUNX-UHFFFAOYSA-N 0 0 362.389 3.719 20 5 FHBDRN CN(C[C@H]1CCCO[C@H]1c1ccccc1)C(=O)c1ccc(F)cc1[N+](=O)[O-] ZINC000610712013 933893631 /nfs/dbraw/zinc/89/36/31/933893631.db2.gz KXKLDDCUQDNYLX-BEFAXECRSA-N 0 0 372.396 3.974 20 5 FHBDRN O=C(N[C@@H]1C[C@H]1C1CC1)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000431140003 933909567 /nfs/dbraw/zinc/90/95/67/933909567.db2.gz QRHNYPMJGYNRSA-FUHWJXTLSA-N 0 0 352.390 3.702 20 5 FHBDRN COc1ccc(NC(=O)[C@@H](C)Nc2cccc3cc[nH]c32)c([N+](=O)[O-])c1 ZINC000548461979 933994149 /nfs/dbraw/zinc/99/41/49/933994149.db2.gz XPGRLKWOVLOWSN-LLVKDONJSA-N 0 0 354.366 3.524 20 5 FHBDRN COc1cc(C(=O)OCc2c(F)cccc2Cl)c([N+](=O)[O-])cc1OC ZINC000003498322 934011706 /nfs/dbraw/zinc/01/17/06/934011706.db2.gz STJODGWAOYHTPY-UHFFFAOYSA-N 0 0 369.732 3.762 20 5 FHBDRN Cc1c(NC(=O)Cc2cccs2)cc(Br)cc1[N+](=O)[O-] ZINC000431176038 934018632 /nfs/dbraw/zinc/01/86/32/934018632.db2.gz BPEILUWXBSREHF-UHFFFAOYSA-N 0 0 355.213 3.908 20 5 FHBDRN Cc1c(NC(=O)c2ccncc2Cl)cc(Br)cc1[N+](=O)[O-] ZINC000431179270 934025313 /nfs/dbraw/zinc/02/53/13/934025313.db2.gz CCZQZHFTDGEHLN-UHFFFAOYSA-N 0 0 370.590 3.966 20 5 FHBDRN CCOc1ccc(OCCOC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000003499482 934033483 /nfs/dbraw/zinc/03/34/83/934033483.db2.gz VNJQABVUZLCTLR-UHFFFAOYSA-N 0 0 365.769 3.883 20 5 FHBDRN O=C(c1cc(C(F)(F)F)ccc1F)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000471951073 934040717 /nfs/dbraw/zinc/04/07/17/934040717.db2.gz ITXKEOQBPYFKPM-UHFFFAOYSA-N 0 0 368.286 3.951 20 5 FHBDRN C[C@H](C[C@@H]1CCOC1)NC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000610742481 934044156 /nfs/dbraw/zinc/04/41/56/934044156.db2.gz LMSAAOHARCRWKH-CABCVRRESA-N 0 0 369.421 3.883 20 5 FHBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H](C)[C@@H]1C ZINC000581991732 934082390 /nfs/dbraw/zinc/08/23/90/934082390.db2.gz ZRVUWXQPZASGSW-KOLCDFICSA-N 0 0 355.232 3.926 20 5 FHBDRN Cc1nc(N2CCC(N3c4ccccc4C[C@@H]3C)CC2)ccc1[N+](=O)[O-] ZINC000610754609 934090208 /nfs/dbraw/zinc/09/02/08/934090208.db2.gz JTPOJWHXQIPWOV-AWEZNQCLSA-N 0 0 352.438 3.718 20 5 FHBDRN COc1cc(-c2noc(-c3ccc([N+](=O)[O-])cc3C)n2)cc(OC)c1OC ZINC000134787924 934103881 /nfs/dbraw/zinc/10/38/81/934103881.db2.gz HGNSWAXUXFRLPM-UHFFFAOYSA-N 0 0 371.349 3.646 20 5 FHBDRN Cc1nc(NC(=O)c2ccc([N+](=O)[O-])cn2)sc1Cc1ccccc1 ZINC000610770821 934146862 /nfs/dbraw/zinc/14/68/62/934146862.db2.gz YENRLHXFNKXAKH-UHFFFAOYSA-N 0 0 354.391 3.598 20 5 FHBDRN CCS[C@H]1CCCC[C@@H]1NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1C ZINC000176113145 934150979 /nfs/dbraw/zinc/15/09/79/934150979.db2.gz IFVKOJKEWWWRKW-ZFWWWQNUSA-N 0 0 367.427 3.606 20 5 FHBDRN O=C([O-])[C@H]1CC[C@H](C[NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000276967199 934159131 /nfs/dbraw/zinc/15/91/31/934159131.db2.gz GQVZAPKORGOIFH-HDJSIYSDSA-N 0 0 358.394 3.835 20 5 FHBDRN O=C(COC(=O)c1ccccc1Cl)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000003507440 934167326 /nfs/dbraw/zinc/16/73/26/934167326.db2.gz BQZLHVKVJDMHAI-UHFFFAOYSA-N 0 0 369.160 3.697 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1Oc1ncnc2c1CCCC2 ZINC000610785881 934189058 /nfs/dbraw/zinc/18/90/58/934189058.db2.gz NXMXSKFQENRCTF-UHFFFAOYSA-N 0 0 350.172 3.818 20 5 FHBDRN COc1ccc(-c2ccc(CNCc3ccc(F)cn3)o2)c([N+](=O)[O-])c1 ZINC000610787722 934190010 /nfs/dbraw/zinc/19/00/10/934190010.db2.gz GGSYMQSMFNKJES-UHFFFAOYSA-N 0 0 357.341 3.687 20 5 FHBDRN COC(=O)c1cccc(COc2c(Br)cccc2[N+](=O)[O-])c1 ZINC000431215165 934213542 /nfs/dbraw/zinc/21/35/42/934213542.db2.gz AVIWFDDJIAKDTG-UHFFFAOYSA-N 0 0 366.167 3.723 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)NC2(C)Cc3ccccc3C2)cc1[N+](=O)[O-] ZINC000510951859 934216459 /nfs/dbraw/zinc/21/64/59/934216459.db2.gz OWIXQONPQRHGRB-AWEZNQCLSA-N 0 0 353.422 3.821 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1-c1nc(-c2ccc(OC(C)(C)C)cn2)no1 ZINC000350554670 934225936 /nfs/dbraw/zinc/22/59/36/934225936.db2.gz XUMZWGCBDFOLNC-UHFFFAOYSA-N 0 0 355.354 3.588 20 5 FHBDRN Cc1c(NC(=O)Cc2ccc(Br)cc2O)cccc1[N+](=O)[O-] ZINC000431245890 934247204 /nfs/dbraw/zinc/24/72/04/934247204.db2.gz HGEHIUDTUJUMIY-UHFFFAOYSA-N 0 0 365.183 3.553 20 5 FHBDRN Cc1c(NC(=O)[C@H]2CCCCS2)cc(Br)cc1[N+](=O)[O-] ZINC000431255750 934254440 /nfs/dbraw/zinc/25/44/40/934254440.db2.gz NKGNEWYOQKEHQX-GFCCVEGCSA-N 0 0 359.245 3.890 20 5 FHBDRN O=C(Nc1scnc1C1CC1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000535668952 934262718 /nfs/dbraw/zinc/26/27/18/934262718.db2.gz USRAKFDVAZNTPH-UHFFFAOYSA-N 0 0 358.423 3.781 20 5 FHBDRN C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N(C)Cc1ccc(Cl)c(F)c1 ZINC000535680915 934272915 /nfs/dbraw/zinc/27/29/15/934272915.db2.gz QAZCKOZQKISGEF-NSHDSACASA-N 0 0 365.792 3.846 20 5 FHBDRN CC(=O)Nc1cccc([C@@H](C)NC(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)c1 ZINC000535696668 934290400 /nfs/dbraw/zinc/29/04/00/934290400.db2.gz OICLMGVMSWZYJH-LLVKDONJSA-N 0 0 366.377 3.526 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N(C)[C@H]2CCC[C@@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000458097235 934294750 /nfs/dbraw/zinc/29/47/50/934294750.db2.gz SQPNTFXGVKLBRO-CABCVRRESA-N 0 0 356.426 3.850 20 5 FHBDRN CCc1cccc2c1N(C(=O)c1ccn(-c3ccccc3[N+](=O)[O-])n1)CC2 ZINC000535722822 934311065 /nfs/dbraw/zinc/31/10/65/934311065.db2.gz QOGNEMIKFSBGTH-UHFFFAOYSA-N 0 0 362.389 3.546 20 5 FHBDRN COc1ccccc1[C@H](CO)Nc1ccc([N+](=O)[O-])c(OC(C)(C)C)c1 ZINC000535720572 934316923 /nfs/dbraw/zinc/31/69/23/934316923.db2.gz VKYLPDNNTLCTQR-HNNXBMFYSA-N 0 0 360.410 3.926 20 5 FHBDRN O=[N+]([O-])c1c(Sc2nccn2Cc2ccccn2)ccc2ncccc21 ZINC000535720331 934318016 /nfs/dbraw/zinc/31/80/16/934318016.db2.gz QMYDIAPAKLFMMT-UHFFFAOYSA-N 0 0 363.402 3.934 20 5 FHBDRN CCN(C(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])[C@@H](C)C(F)(F)F ZINC000477940962 934325369 /nfs/dbraw/zinc/32/53/69/934325369.db2.gz DMWHXGTVJCTULF-BDAKNGLRSA-N 0 0 368.739 3.815 20 5 FHBDRN C[C@H](NC(=O)c1cc([N+](=O)[O-])cn1C)[C@@H](C)c1ccccc1C(F)(F)F ZINC000535748577 934337819 /nfs/dbraw/zinc/33/78/19/934337819.db2.gz REBFFCCJRCHMNF-MNOVXSKESA-N 0 0 369.343 3.874 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)NC[C@](C)(O)c1cccc(Cl)c1 ZINC000588470380 934394071 /nfs/dbraw/zinc/39/40/71/934394071.db2.gz YVRXZEOHRSASPP-XGCMIMOYSA-N 0 0 374.824 3.675 20 5 FHBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)Nc1ccc([N+](=O)[O-])c2ncccc12 ZINC000588470538 934413989 /nfs/dbraw/zinc/41/39/89/934413989.db2.gz SPHVFWXTMYJSAK-YHYXMXQVSA-N 0 0 364.317 3.703 20 5 FHBDRN Cc1c(CC(=O)NC[C@H](c2ccccc2)C(F)(F)F)cccc1[N+](=O)[O-] ZINC000187681993 934459689 /nfs/dbraw/zinc/45/96/89/934459689.db2.gz IZKVHEMKAPXDDW-OAHLLOKOSA-N 0 0 366.339 3.908 20 5 FHBDRN Cc1noc(C[C@@H](N[C@@H](C)c2ccccc2[N+](=O)[O-])c2ccccc2)n1 ZINC000277040793 934463271 /nfs/dbraw/zinc/46/32/71/934463271.db2.gz GCXLRILENNXCIL-SUMWQHHRSA-N 0 0 352.394 3.921 20 5 FHBDRN CCCn1ccnc1CCCN(C)C(=O)c1cccc(Cl)c1[N+](=O)[O-] ZINC000277071334 934474924 /nfs/dbraw/zinc/47/49/24/934474924.db2.gz AGBROZCSZBBFRO-UHFFFAOYSA-N 0 0 364.833 3.560 20 5 FHBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)c1ccn(C)n1 ZINC000458250357 934486289 /nfs/dbraw/zinc/48/62/89/934486289.db2.gz CSVFVUGDJUTPJC-LBPRGKRZSA-N 0 0 362.455 3.567 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)NC[C@H]2CCOc3ccccc32)cc1[N+](=O)[O-] ZINC000176174756 934497677 /nfs/dbraw/zinc/49/76/77/934497677.db2.gz NVLILEYBMPDZEZ-GOEBONIOSA-N 0 0 369.421 3.830 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2nc(CN3CCN(c4cccs4)CC3)co2)cc1 ZINC000119427298 934506405 /nfs/dbraw/zinc/50/64/05/934506405.db2.gz QHQJIXMMVLBBAM-UHFFFAOYSA-N 0 0 370.434 3.634 20 5 FHBDRN CN(CCOC(C)(C)C)C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000610862472 934534231 /nfs/dbraw/zinc/53/42/31/934534231.db2.gz JWZCAGUIZLLJEG-UHFFFAOYSA-N 0 0 363.439 3.605 20 5 FHBDRN C[C@H]1CCN(c2cc(Cl)c(C(F)(F)F)cc2[N+](=O)[O-])CC[S@@]1=O ZINC000277135370 934542854 /nfs/dbraw/zinc/54/28/54/934542854.db2.gz JOPYMSJAMNVCOG-FHOATMSYSA-N 0 0 370.780 3.614 20 5 FHBDRN C[C@H](CC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1)C(=O)c1ccccc1 ZINC000610874837 934551516 /nfs/dbraw/zinc/55/15/16/934551516.db2.gz WYWDKGGSKJUEQW-OAHLLOKOSA-N 0 0 366.417 3.995 20 5 FHBDRN C[C@@H](CC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1)C(=O)c1ccccc1 ZINC000610874836 934551670 /nfs/dbraw/zinc/55/16/70/934551670.db2.gz WYWDKGGSKJUEQW-HNNXBMFYSA-N 0 0 366.417 3.995 20 5 FHBDRN Cc1cccc(C(=O)NC[C@@H](c2ccccc2)C(F)(F)F)c1[N+](=O)[O-] ZINC000187684890 934560120 /nfs/dbraw/zinc/56/01/20/934560120.db2.gz JAUGSWVQXUTJCZ-AWEZNQCLSA-N 0 0 352.312 3.979 20 5 FHBDRN C[C@H]1CO[C@H](c2cccc(Cl)c2)CN1C(=O)c1ccccc1[N+](=O)[O-] ZINC000187685167 934560255 /nfs/dbraw/zinc/56/02/55/934560255.db2.gz QTDDYPAKIJUNPL-SJCJKPOMSA-N 0 0 360.797 3.850 20 5 FHBDRN C[C@@H]1CO[C@H](c2cccc(Cl)c2)CN1C(=O)c1ccccc1[N+](=O)[O-] ZINC000187685149 934560428 /nfs/dbraw/zinc/56/04/28/934560428.db2.gz QTDDYPAKIJUNPL-PXAZEXFGSA-N 0 0 360.797 3.850 20 5 FHBDRN COc1ccc(NCc2ccc(-c3ccc(OC)cc3[N+](=O)[O-])o2)nc1 ZINC000610890319 934561256 /nfs/dbraw/zinc/56/12/56/934561256.db2.gz CBIVLGJZUCCCHR-UHFFFAOYSA-N 0 0 355.350 3.879 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(N3CCCC3)cc2C)c1 ZINC000145659855 934562381 /nfs/dbraw/zinc/56/23/81/934562381.db2.gz ROIKWQLQBKKNKH-UHFFFAOYSA-N 0 0 355.394 3.764 20 5 FHBDRN CC(C)[C@H](CCO)NC(=O)c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1 ZINC000610886672 934565039 /nfs/dbraw/zinc/56/50/39/934565039.db2.gz CMDSMTHUAINSMB-SFHVURJKSA-N 0 0 374.462 3.883 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])cc2c1OCCO2)N1CCC[C@H]1CCC1CCCC1 ZINC000610896437 934566418 /nfs/dbraw/zinc/56/64/18/934566418.db2.gz SNECCVHEEWUPLI-HNNXBMFYSA-N 0 0 374.437 3.941 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])cc2c1OCCO2)N1CCC[C@@H]1CCC1CCCC1 ZINC000610896438 934567471 /nfs/dbraw/zinc/56/74/71/934567471.db2.gz SNECCVHEEWUPLI-OAHLLOKOSA-N 0 0 374.437 3.941 20 5 FHBDRN O=C(N[C@@H]1C[C@H]1c1ccc(Br)s1)c1ccc([N+](=O)[O-])s1 ZINC000477978608 934580642 /nfs/dbraw/zinc/58/06/42/934580642.db2.gz UUDCAQNWFPTQMA-RNFRBKRXSA-N 0 0 373.253 3.766 20 5 FHBDRN C[C@@H](NC(=O)c1cc2cc([N+](=O)[O-])ccc2o1)[C@H]1COc2ccccc21 ZINC000535860821 934606711 /nfs/dbraw/zinc/60/67/11/934606711.db2.gz OVSJBUCURGGWLB-IAQYHMDHSA-N 0 0 352.346 3.636 20 5 FHBDRN CC(C)(C)c1csc(CCNC(=O)c2cccc(Cl)c2[N+](=O)[O-])n1 ZINC000176262501 934607565 /nfs/dbraw/zinc/60/75/65/934607565.db2.gz AFAIHQHHVMNEAP-UHFFFAOYSA-N 0 0 367.858 3.975 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)cnc1N1C[C@H](C(F)(F)F)[C@H](C(F)(F)F)C1 ZINC000610929429 934626348 /nfs/dbraw/zinc/62/63/48/934626348.db2.gz KAMYLRRTBDWAFO-KNVOCYPGSA-N 0 0 363.645 3.820 20 5 FHBDRN CC(C)c1[nH]nc(C(=O)N2CC3(CCCC3)c3ccccc32)c1[N+](=O)[O-] ZINC000610923927 934627742 /nfs/dbraw/zinc/62/77/42/934627742.db2.gz RDAQKYWHMQVEKN-UHFFFAOYSA-N 0 0 354.410 3.914 20 5 FHBDRN CN(c1ccc([N+](=O)[O-])s1)[C@H]1CCN(c2ccccc2Cl)C1=O ZINC000610952698 934648961 /nfs/dbraw/zinc/64/89/61/934648961.db2.gz JRHSWBCMCZRBTA-LBPRGKRZSA-N 0 0 351.815 3.551 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N1CC[C@@H](c2ccco2)C1 ZINC000610960238 934658490 /nfs/dbraw/zinc/65/84/90/934658490.db2.gz HTQBCVROVYEYBB-SNVBAGLBSA-N 0 0 354.284 3.836 20 5 FHBDRN CC(=O)c1cnc(NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)s1 ZINC000135447337 934681222 /nfs/dbraw/zinc/68/12/22/934681222.db2.gz STMHJPICYHAQRV-UHFFFAOYSA-N 0 0 374.403 3.630 20 5 FHBDRN O=C(c1ccc(Cl)c([N+](=O)[O-])c1)N1CCC(C2CCOCC2)CC1 ZINC000158073188 934699672 /nfs/dbraw/zinc/69/96/72/934699672.db2.gz ZCOCYQHDPVIZGJ-UHFFFAOYSA-N 0 0 352.818 3.527 20 5 FHBDRN COc1ccc(CNC(=O)[C@H](C)Cc2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000535883875 934699786 /nfs/dbraw/zinc/69/97/86/934699786.db2.gz WKQRPJJTOGHBLD-GFCCVEGCSA-N 0 0 362.813 3.752 20 5 FHBDRN CCOc1ccccc1N(C)C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000535885878 934703447 /nfs/dbraw/zinc/70/34/47/934703447.db2.gz RUNVVSIKMAGNTO-UHFFFAOYSA-N 0 0 353.378 3.611 20 5 FHBDRN O=[N+]([O-])c1ccc(CN2CCc3sc(Br)cc3C2)cc1 ZINC000610990191 934723858 /nfs/dbraw/zinc/72/38/58/934723858.db2.gz QNHAPZBCTFFCQI-UHFFFAOYSA-N 0 0 353.241 3.977 20 5 FHBDRN CCC1(CNC(=O)CSCc2ccc(OC)c([N+](=O)[O-])c2)CCC1 ZINC000084256022 934745491 /nfs/dbraw/zinc/74/54/91/934745491.db2.gz LEYMVMSGBZNOEW-UHFFFAOYSA-N 0 0 352.456 3.533 20 5 FHBDRN O=C(NCc1cccc([N+](=O)[O-])c1)N[C@@H](C1CCCCC1)C(F)(F)F ZINC000548509814 934749139 /nfs/dbraw/zinc/74/91/39/934749139.db2.gz LLCWJSQXQBMNAA-AWEZNQCLSA-N 0 0 359.348 3.905 20 5 FHBDRN Cc1ccc(NC(=O)c2ccc(N[C@]3(C)CCOC3)c([N+](=O)[O-])c2)cc1 ZINC000535914061 934789469 /nfs/dbraw/zinc/78/94/69/934789469.db2.gz JVYOIHXUIQMERC-LJQANCHMSA-N 0 0 355.394 3.746 20 5 FHBDRN O=C(N[C@@H]1CCCc2cn(C3CCCC3)nc21)c1ccc([N+](=O)[O-])cc1 ZINC000611555602 934802105 /nfs/dbraw/zinc/80/21/05/934802105.db2.gz ZRSBZSJEOLTMRS-QGZVFWFLSA-N 0 0 354.410 3.714 20 5 FHBDRN CCc1ccc(CN(C)S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])cc1 ZINC000146457203 934808697 /nfs/dbraw/zinc/80/86/97/934808697.db2.gz PKGSREGVDOMRFJ-UHFFFAOYSA-N 0 0 368.842 3.631 20 5 FHBDRN O=[N+]([O-])c1ccn(CCSc2nc(-c3ccco3)nc3ccccc32)n1 ZINC000178488420 934836951 /nfs/dbraw/zinc/83/69/51/934836951.db2.gz STEHCGPRJLGLGY-UHFFFAOYSA-N 0 0 367.390 3.787 20 5 FHBDRN O=[N+]([O-])c1ccc(CN2CCOCC2)cc1NCc1ccccc1Cl ZINC000472022767 934846304 /nfs/dbraw/zinc/84/63/04/934846304.db2.gz RRRATHRCRBXEAW-UHFFFAOYSA-N 0 0 361.829 3.693 20 5 FHBDRN Cn1ccnc1[C@@H](NCC(C)(C)[C@H]1CCCCO1)c1ccc([N+](=O)[O-])cc1 ZINC000611560791 934849351 /nfs/dbraw/zinc/84/93/51/934849351.db2.gz XMNJMNCOYKUTFO-MSOLQXFVSA-N 0 0 372.469 3.603 20 5 FHBDRN Cn1ccnc1[C@H](NCC(C)(C)[C@H]1CCCCO1)c1cccc([N+](=O)[O-])c1 ZINC000611560716 934849408 /nfs/dbraw/zinc/84/94/08/934849408.db2.gz BMFAJZSPEPSWSK-QZTJIDSGSA-N 0 0 372.469 3.603 20 5 FHBDRN C[C@@H](NC(=O)c1ccccc1[N+](=O)[O-])c1ccc(Br)s1 ZINC000468169882 934854803 /nfs/dbraw/zinc/85/48/03/934854803.db2.gz QJVBNVXOKMQOGZ-MRVPVSSYSA-N 0 0 355.213 3.910 20 5 FHBDRN Cc1cc(S(=O)(=O)N2C[C@H](C)C[C@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000511004087 934856774 /nfs/dbraw/zinc/85/67/74/934856774.db2.gz QAJLLRKIVMMFAZ-ACJLOTCBSA-N 0 0 360.435 3.675 20 5 FHBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N1CCC[C@H]1c1ccccc1 ZINC000119526178 934864287 /nfs/dbraw/zinc/86/42/87/934864287.db2.gz DVPMFUDUWBKMTE-AWEZNQCLSA-N 0 0 366.826 3.774 20 5 FHBDRN Cc1cc(NC(=O)c2ccc(N3CCCCCC3)nc2)ccc1[N+](=O)[O-] ZINC000538544862 934866902 /nfs/dbraw/zinc/86/69/02/934866902.db2.gz QLHCRDXFMFIVFM-UHFFFAOYSA-N 0 0 354.410 3.931 20 5 FHBDRN C[C@@H]1CC[C@H](C(F)(F)F)CN1C(=O)c1c[nH]c2ccc([N+](=O)[O-])cc21 ZINC000611561840 934867991 /nfs/dbraw/zinc/86/79/91/934867991.db2.gz VMKAUBQOPZNRBK-ZJUUUORDSA-N 0 0 355.316 3.879 20 5 FHBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N(Cc1ccccc1)C1CC1 ZINC000119532924 934871825 /nfs/dbraw/zinc/87/18/25/934871825.db2.gz UFFOBKZCEUDVPG-UHFFFAOYSA-N 0 0 366.826 3.602 20 5 FHBDRN O=C(NC1CCC2(CC2)CC1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000434002366 934874555 /nfs/dbraw/zinc/87/45/55/934874555.db2.gz ILPFCJJHQRNNIF-UHFFFAOYSA-N 0 0 353.216 3.810 20 5 FHBDRN C[C@H](NC(=O)N(C)CCCOCc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000538622009 934881088 /nfs/dbraw/zinc/88/10/88/934881088.db2.gz UTMLFZCBEXNERK-INIZCTEOSA-N 0 0 371.437 3.904 20 5 FHBDRN COC(=O)Cc1ccc(NC[C@H]2CCCO[C@H]2C(C)(C)C)c([N+](=O)[O-])c1 ZINC000450339490 934892313 /nfs/dbraw/zinc/89/23/13/934892313.db2.gz ARDHQBJXIGFQFQ-RDTXWAMCSA-N 0 0 364.442 3.564 20 5 FHBDRN Cn1c(CN2CCc3ccc([N+](=O)[O-])cc3C2)nc2ccc(Cl)cc21 ZINC000538731043 934893509 /nfs/dbraw/zinc/89/35/09/934893509.db2.gz QVKZBGBFMDFANC-UHFFFAOYSA-N 0 0 356.813 3.693 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(OCc2cccc(Br)c2)c1 ZINC000071844694 934893672 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FHBDRN C[C@@H]1C[C@@H](c2ccccc2)N(S(=O)(=O)c2c(F)cccc2[N+](=O)[O-])C1 ZINC000511030907 934971062 /nfs/dbraw/zinc/97/10/62/934971062.db2.gz PMRYPEWHGRSVII-WBMJQRKESA-N 0 0 364.398 3.506 20 5 FHBDRN O=C(c1coc(C2CCCCC2)n1)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000548602892 934976361 /nfs/dbraw/zinc/97/63/61/934976361.db2.gz IHPWVSROFDEVRB-UHFFFAOYSA-N 0 0 355.394 3.829 20 5 FHBDRN CSc1cc(CNC(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)ccn1 ZINC000538971308 934976670 /nfs/dbraw/zinc/97/66/70/934976670.db2.gz DHGFKGSUNZECLF-GFCCVEGCSA-N 0 0 360.439 3.581 20 5 FHBDRN CC(C)NC(=O)c1ccc(N2CC[C@H](CC(F)(F)F)C2)c([N+](=O)[O-])c1 ZINC000277333984 934988635 /nfs/dbraw/zinc/98/86/35/934988635.db2.gz DZNQCZSVIFBACW-LLVKDONJSA-N 0 0 359.348 3.512 20 5 FHBDRN Cc1csc(Sc2ccc(C(=O)N3CC(F)(F)C3)cc2[N+](=O)[O-])n1 ZINC000611566006 934990045 /nfs/dbraw/zinc/99/00/45/934990045.db2.gz NZLNTUZQWQYXDZ-UHFFFAOYSA-N 0 0 371.390 3.602 20 5 FHBDRN Cc1c(C(=O)N2CCc3c2cccc3[N+](=O)[O-])cnn1C1CCCCC1 ZINC000611568395 935009371 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FHBDRN O=C(Oc1cccc([N+](=O)[O-])c1)c1cnc(-c2ccc3c(c2)OCO3)s1 ZINC000728455330 935052312 /nfs/dbraw/zinc/05/23/12/935052312.db2.gz HOTMRJFJBOYRGZ-UHFFFAOYSA-N 0 0 370.342 3.666 20 5 FHBDRN COc1ccc2c(c1)CN(C(=O)C1(c3ccc([N+](=O)[O-])cc3)CCC1)CC2 ZINC001125574978 935059162 /nfs/dbraw/zinc/05/91/62/935059162.db2.gz VDHDUTYHTAKDOU-UHFFFAOYSA-N 0 0 366.417 3.610 20 5 FHBDRN CC[C@@H](c1ccncc1)N(CC)C(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000157314622 935061682 /nfs/dbraw/zinc/06/16/82/935061682.db2.gz SCLWMZIGEIGANC-INIZCTEOSA-N 0 0 357.410 3.759 20 5 FHBDRN CC[C@H](C)NC(=O)c1ccc(NC(=O)c2csc([N+](=O)[O-])c2)c(C)c1 ZINC000519049930 945074975 /nfs/dbraw/zinc/07/49/75/945074975.db2.gz OLXPIAFYVGUYFN-NSHDSACASA-N 0 0 361.423 3.745 20 5 FHBDRN C[C@@H](CC(=O)N1CCc2ncc([N+](=O)[O-])cc2C1)c1c[nH]c2ccccc21 ZINC000427095876 945075796 /nfs/dbraw/zinc/07/57/96/945075796.db2.gz YMRXXRNWWRYMOG-ZDUSSCGKSA-N 0 0 364.405 3.550 20 5 FHBDRN CCCc1n[nH]c(C(=O)NCCCCc2ccc(Cl)s2)c1[N+](=O)[O-] ZINC000516637594 945076912 /nfs/dbraw/zinc/07/69/12/945076912.db2.gz WWKUSPCPIGXNLL-UHFFFAOYSA-N 0 0 370.862 3.738 20 5 FHBDRN O=C(c1c[nH]c2cccc([N+](=O)[O-])c12)N1CC=C(c2ccc(O)cc2)CC1 ZINC000536505396 935109789 /nfs/dbraw/zinc/10/97/89/935109789.db2.gz SFGAFIGCHMJJDI-UHFFFAOYSA-N 0 0 363.373 3.711 20 5 FHBDRN COc1ccc(-c2nnc(CN[C@H](C)c3cccc([N+](=O)[O-])c3)o2)cc1 ZINC000539276631 935126518 /nfs/dbraw/zinc/12/65/18/935126518.db2.gz OEZRNHOFKCMNNT-GFCCVEGCSA-N 0 0 354.366 3.504 20 5 FHBDRN Cc1c(Cl)cc(S(=O)(=O)N2C[C@H](C)c3ccccc32)cc1[N+](=O)[O-] ZINC000071976899 935129403 /nfs/dbraw/zinc/12/94/03/935129403.db2.gz DNOXOGGXMNTEMO-JTQLQIEISA-N 0 0 366.826 3.869 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)Nc1cc(C)n([C@H](C)C2CC2)n1 ZINC000439895372 945078658 /nfs/dbraw/zinc/07/86/58/945078658.db2.gz FVPVICHKERYYRJ-GFCCVEGCSA-N 0 0 373.413 3.535 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)NC(C)(C)c1ncc(C)s1 ZINC000439896659 945079914 /nfs/dbraw/zinc/07/99/14/945079914.db2.gz GXYTWXAIJLMONW-UHFFFAOYSA-N 0 0 364.427 3.815 20 5 FHBDRN Cn1cc(CCNC(=O)Nc2ccc([N+](=O)[O-])cc2)c2ccc(F)cc21 ZINC000472141375 935158871 /nfs/dbraw/zinc/15/88/71/935158871.db2.gz BNZGKPMMOCWKIE-UHFFFAOYSA-N 0 0 356.357 3.590 20 5 FHBDRN COc1cccc([C@H]2C[C@@H]2C(=O)Nc2ccc3cc([N+](=O)[O-])ccc3n2)c1 ZINC000084776548 935169547 /nfs/dbraw/zinc/16/95/47/935169547.db2.gz KVUMYIFSKIGYPG-SJORKVTESA-N 0 0 363.373 3.894 20 5 FHBDRN Cc1c2ccccc2n(C)c1CNC(=O)N[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000472141971 935171416 /nfs/dbraw/zinc/17/14/16/935171416.db2.gz JSJRWBGXMCUWBK-AWEZNQCLSA-N 0 0 366.421 3.955 20 5 FHBDRN CC(C)N(C(=O)CN(C)CCc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000511059285 935175288 /nfs/dbraw/zinc/17/52/88/935175288.db2.gz LEAIMPXDGVIPBQ-UHFFFAOYSA-N 0 0 355.438 3.511 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N(CC1CCCCC1)C1CC1 ZINC000511060004 935177395 /nfs/dbraw/zinc/17/73/95/935177395.db2.gz BNBUZLPTYJWXBX-UHFFFAOYSA-N 0 0 372.874 3.982 20 5 FHBDRN O=C(NC1(c2cccc(Br)c2)CCC1)c1ccc([N+](=O)[O-])o1 ZINC000072012309 935199060 /nfs/dbraw/zinc/19/90/60/935199060.db2.gz AJMGMWHOFKTQNP-UHFFFAOYSA-N 0 0 365.183 3.760 20 5 FHBDRN CC[C@@H](CNC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc21)Oc1cccc(F)c1 ZINC000439927622 945083893 /nfs/dbraw/zinc/08/38/93/945083893.db2.gz IUDGHCYDMANHFP-AWEZNQCLSA-N 0 0 371.368 3.803 20 5 FHBDRN Cc1c(C(=O)N2c3ccccc3SC[C@@H]2C)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000176648135 935215573 /nfs/dbraw/zinc/21/55/73/935215573.db2.gz MVCWFAJYEHFPAE-JTQLQIEISA-N 0 0 373.390 3.952 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)C1(c2cccc(F)c2)CCCC1 ZINC000072017316 935218384 /nfs/dbraw/zinc/21/83/84/935218384.db2.gz GXNOPVUZLOBOMZ-UHFFFAOYSA-N 0 0 356.397 3.905 20 5 FHBDRN C[C@H]1[C@H](c2ccccc2)CCN1c1nnc(-c2cccc([N+](=O)[O-])c2)n1C ZINC000562011559 935226297 /nfs/dbraw/zinc/22/62/97/935226297.db2.gz FWVVCRMRRCPLCV-KBXCAEBGSA-N 0 0 363.421 3.773 20 5 FHBDRN CC1(C)CCC(NC(=O)Cc2ccc([N+](=O)[O-])cc2Br)CC1 ZINC000446029215 935232306 /nfs/dbraw/zinc/23/23/06/935232306.db2.gz OZKUKGHFNDZTBH-UHFFFAOYSA-N 0 0 369.259 3.985 20 5 FHBDRN CCc1ccc(C(=O)Nc2n[nH]c(-c3ccccc3Cl)n2)cc1[N+](=O)[O-] ZINC000472158071 935235431 /nfs/dbraw/zinc/23/54/31/935235431.db2.gz NMZBLTRJDRNSAQ-UHFFFAOYSA-N 0 0 371.784 3.848 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)COc1ccsc1Cl ZINC000551285766 935240574 /nfs/dbraw/zinc/24/05/74/935240574.db2.gz QGBVMYNACQLWKE-UHFFFAOYSA-N 0 0 356.787 3.726 20 5 FHBDRN CC(C)c1[nH]nc(C(=O)Nc2cccc(Cl)c2-n2cccn2)c1[N+](=O)[O-] ZINC000519065125 945087319 /nfs/dbraw/zinc/08/73/19/945087319.db2.gz ARUSZFJPTVFUOQ-UHFFFAOYSA-N 0 0 374.788 3.533 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1OCCOc1cccc(Br)c1 ZINC000072050155 935250268 /nfs/dbraw/zinc/25/02/68/935250268.db2.gz RSLDXXISZPQPSA-UHFFFAOYSA-N 0 0 368.183 3.824 20 5 FHBDRN O=[N+]([O-])c1ccc(/C=C/c2cccc(I)c2)nc1 ZINC000551349056 935260883 /nfs/dbraw/zinc/26/08/83/935260883.db2.gz QLBDRUHPMVYXPW-SNAWJCMRSA-N 0 0 352.131 3.765 20 5 FHBDRN CC(C)(C)c1ccc(NC(=O)c2ccc(N3CCCC3)nn2)cc1[N+](=O)[O-] ZINC000551359628 935265196 /nfs/dbraw/zinc/26/51/96/935265196.db2.gz UREGVMSIQYDOHT-UHFFFAOYSA-N 0 0 369.425 3.535 20 5 FHBDRN C[C@H](Sc1ccccn1)C(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000084925107 935267179 /nfs/dbraw/zinc/26/71/79/935267179.db2.gz RGNQFKVVMQYIRX-AWEZNQCLSA-N 0 0 359.451 3.610 20 5 FHBDRN Cc1c(NC(=O)[C@H](C)N2CCC(CC(F)(F)F)CC2)cccc1[N+](=O)[O-] ZINC000551406648 935270177 /nfs/dbraw/zinc/27/01/77/935270177.db2.gz NIVCFLKAMZODFP-LBPRGKRZSA-N 0 0 373.375 3.895 20 5 FHBDRN CC(C)CN(CCc1ccccc1)S(=O)(=O)c1ccc([N+](=O)[O-])s1 ZINC000519066750 945089190 /nfs/dbraw/zinc/08/91/90/945089190.db2.gz OZYQNHLPFSEOGJ-UHFFFAOYSA-N 0 0 368.480 3.546 20 5 FHBDRN C[C@H](OCCCNC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12)c1ccccc1 ZINC000119824945 935272661 /nfs/dbraw/zinc/27/26/61/935272661.db2.gz OOPJVNJAUJPOPA-AWEZNQCLSA-N 0 0 367.405 3.974 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H](Cc2ccccc2)C(C)C)c1 ZINC000469527294 945090506 /nfs/dbraw/zinc/09/05/06/945090506.db2.gz MWNWRYKHMJSEAK-MRXNPFEDSA-N 0 0 356.422 3.848 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)[C@@H](C)Sc1ccccn1 ZINC000084970651 935291641 /nfs/dbraw/zinc/29/16/41/935291641.db2.gz KEFAJLPZYLXOED-CQSZACIVSA-N 0 0 359.451 3.908 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N1CCC[C@H]1c1ccc[nH]1 ZINC000119880845 935311755 /nfs/dbraw/zinc/31/17/55/935311755.db2.gz LGDGNAUXYQOAPV-AWEZNQCLSA-N 0 0 353.300 3.919 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N1CCC=C(c2ccccc2)C1 ZINC000551597623 935317450 /nfs/dbraw/zinc/31/74/50/935317450.db2.gz VXMJPPZXFIJOBC-UHFFFAOYSA-N 0 0 367.405 3.602 20 5 FHBDRN Cc1cccc(OCCN(C)C(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)c1 ZINC000119897962 935323516 /nfs/dbraw/zinc/32/35/16/935323516.db2.gz QWILXJDBCJEMGL-UHFFFAOYSA-N 0 0 353.378 3.536 20 5 FHBDRN CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)Nc2ccc(F)cn2)CC1 ZINC000728475527 935323795 /nfs/dbraw/zinc/32/37/95/935323795.db2.gz DHQGNYUACLJOJL-UHFFFAOYSA-N 0 0 358.373 3.618 20 5 FHBDRN CC(C)[C@@H](CC(=O)OCC(=O)Nc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000728476383 935324236 /nfs/dbraw/zinc/32/42/36/935324236.db2.gz YWXKQCSUKGSIFG-GOSISDBHSA-N 0 0 370.405 3.906 20 5 FHBDRN COc1ccc2cc(COC(=O)COc3ccccc3[N+](=O)[O-])ccc2c1 ZINC000892203097 935327445 /nfs/dbraw/zinc/32/74/45/935327445.db2.gz QIGDDIMCFGDJBK-UHFFFAOYSA-N 0 0 367.357 3.879 20 5 FHBDRN COc1ccccc1C[C@@H](C)N(C)C(=O)Cc1cccc([N+](=O)[O-])c1C ZINC000438832526 945093560 /nfs/dbraw/zinc/09/35/60/945093560.db2.gz MQRNIYTUEITHHP-CQSZACIVSA-N 0 0 356.422 3.544 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccccc1OCC(F)(F)F ZINC000427108222 945093954 /nfs/dbraw/zinc/09/39/54/945093954.db2.gz NCFWQGGMDGFMSU-UHFFFAOYSA-N 0 0 370.283 3.797 20 5 FHBDRN COc1cc(Cc2noc(CCSc3ccccc3)n2)ccc1[N+](=O)[O-] ZINC000545053571 935346865 /nfs/dbraw/zinc/34/68/65/935346865.db2.gz NHILVLGVBGMZEK-UHFFFAOYSA-N 0 0 371.418 3.912 20 5 FHBDRN CCOc1ccc2c(c1)CCN(C(=O)[C@H](C)c1cccc([N+](=O)[O-])c1)C2 ZINC000582156318 935358434 /nfs/dbraw/zinc/35/84/34/935358434.db2.gz OBMVMVVHAMKKJP-CQSZACIVSA-N 0 0 354.406 3.682 20 5 FHBDRN COc1cc(Cc2noc(Cc3ccc(Cl)cc3)n2)ccc1[N+](=O)[O-] ZINC000545054753 935364688 /nfs/dbraw/zinc/36/46/88/935364688.db2.gz HOPJPXFALOHBNM-UHFFFAOYSA-N 0 0 359.769 3.821 20 5 FHBDRN COc1ccccc1C(C)(C)CNC(=O)[C@@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1 ZINC001125585515 935373986 /nfs/dbraw/zinc/37/39/86/935373986.db2.gz CMZXEWNMDLYCBP-IAGOWNOFSA-N 0 0 368.433 3.801 20 5 FHBDRN COc1ccccc1C(C)(C)CNC(=O)[C@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1 ZINC001125585675 935378461 /nfs/dbraw/zinc/37/84/61/935378461.db2.gz CMZXEWNMDLYCBP-SJORKVTESA-N 0 0 368.433 3.801 20 5 FHBDRN Cc1cc(-c2noc(-c3cc([N+](=O)[O-])cc4c3OCCO4)n2)ccc1F ZINC000551994834 935397740 /nfs/dbraw/zinc/39/77/40/935397740.db2.gz UIDBTGAMKADHNC-UHFFFAOYSA-N 0 0 357.297 3.531 20 5 FHBDRN O=C(CSCC(=O)c1ccc(Cl)cc1)Nc1cccc([N+](=O)[O-])c1 ZINC000119986944 935409289 /nfs/dbraw/zinc/40/92/89/935409289.db2.gz SCNOVADCINZLAG-UHFFFAOYSA-N 0 0 364.810 3.803 20 5 FHBDRN COc1ccccc1[C@H](C)NC(=O)CNc1c(C)ccc([N+](=O)[O-])c1C ZINC000085288912 935417260 /nfs/dbraw/zinc/41/72/60/935417260.db2.gz MTDHQOCAIDOYFZ-AWEZNQCLSA-N 0 0 357.410 3.510 20 5 FHBDRN COc1ccc2c(c1)CN(C(=O)Nc1cc([N+](=O)[O-])c(C)cc1C)CC2 ZINC000119993220 935426696 /nfs/dbraw/zinc/42/66/96/935426696.db2.gz VNTFISCJBLYOQM-UHFFFAOYSA-N 0 0 355.394 3.810 20 5 FHBDRN COc1cc(Cl)c(C)cc1NC(=O)c1ccc([N+](=O)[O-])cc1OC ZINC000427124118 945100816 /nfs/dbraw/zinc/10/08/16/945100816.db2.gz OFKNYEPFQKZWIX-UHFFFAOYSA-N 0 0 350.758 3.826 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC[C@H]1Cc1cccc(F)c1 ZINC000047319752 945100984 /nfs/dbraw/zinc/10/09/84/945100984.db2.gz ZKJSKWZBOZSJBP-HNNXBMFYSA-N 0 0 373.384 3.982 20 5 FHBDRN Cc1ccc(CNC(=O)Nc2cc([N+](=O)[O-])ccc2C)c(N2CCCC2)n1 ZINC000611582694 935452953 /nfs/dbraw/zinc/45/29/53/935452953.db2.gz SZSYDSFYLAWUHS-UHFFFAOYSA-N 0 0 369.425 3.529 20 5 FHBDRN Cc1c(C(=O)N2CCC[C@H]2c2ccc3c(c2)OCO3)cccc1[N+](=O)[O-] ZINC000077330417 935496902 /nfs/dbraw/zinc/49/69/02/935496902.db2.gz GJTVHKNGUDZWKK-INIZCTEOSA-N 0 0 354.362 3.609 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@H](OCC)c1ccccc1 ZINC000439932595 945105436 /nfs/dbraw/zinc/10/54/36/945105436.db2.gz ONIAKKKGXPZDPH-GOSISDBHSA-N 0 0 373.409 3.893 20 5 FHBDRN O=C(Nc1ccc(CN2CCCC2=O)cc1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000120053142 935511687 /nfs/dbraw/zinc/51/16/87/935511687.db2.gz RIDDVSZACXFEMP-UHFFFAOYSA-N 0 0 373.796 3.623 20 5 FHBDRN Cc1cc(C)c(NC(=O)CN(C)Cc2cccc([N+](=O)[O-])c2C)c(C)c1 ZINC000051589661 935513546 /nfs/dbraw/zinc/51/35/46/935513546.db2.gz ZAOVTLMACHAFJX-UHFFFAOYSA-N 0 0 355.438 3.899 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2cnc(CC[N@@H+]3CCOCC34CCCCC4)o2)c1 ZINC000451810422 935522320 /nfs/dbraw/zinc/52/23/20/935522320.db2.gz CNVHRPBCLDJUDU-UHFFFAOYSA-N 0 0 371.437 3.827 20 5 FHBDRN CCOc1ccc(C(=O)N2CCOC3(C2)CCCCCC3)cc1[N+](=O)[O-] ZINC000120063927 935526523 /nfs/dbraw/zinc/52/65/23/935526523.db2.gz IWEUNGCSTZKIIQ-UHFFFAOYSA-N 0 0 362.426 3.559 20 5 FHBDRN Cc1cccnc1[C@@H](NC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12)C(C)C ZINC000115406205 935529209 /nfs/dbraw/zinc/52/92/09/935529209.db2.gz GSEOFPKQIKTMLT-KRWDZBQOSA-N 0 0 352.394 3.907 20 5 FHBDRN Cc1cccc(C(=O)N[C@@H](C)c2cccc(N3CCCC3)c2)c1[N+](=O)[O-] ZINC000120079804 935539197 /nfs/dbraw/zinc/53/91/97/935539197.db2.gz SJZMXNLJGGUERI-HNNXBMFYSA-N 0 0 353.422 3.994 20 5 FHBDRN COc1cccc(C(=O)Nc2nc3cc(F)c(C)cc3s2)c1[N+](=O)[O-] ZINC000478101093 935569668 /nfs/dbraw/zinc/56/96/68/935569668.db2.gz LZZUKSQPDLRWFW-UHFFFAOYSA-N 0 0 361.354 3.913 20 5 FHBDRN C[C@H](Oc1ccc(F)cc1Cl)C(=O)N(C)c1cccc([N+](=O)[O-])c1 ZINC000158114353 935573515 /nfs/dbraw/zinc/57/35/15/935573515.db2.gz IHZRZQLAVZXJKD-JTQLQIEISA-N 0 0 352.749 3.818 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])Cc1nc(-c2ccc(F)c(F)c2)no1 ZINC000511104752 935577813 /nfs/dbraw/zinc/57/78/13/935577813.db2.gz CQORJHVRGCIDTR-UHFFFAOYSA-N 0 0 374.347 3.598 20 5 FHBDRN Cc1c(C(=O)NCc2ccc(F)c(Cl)c2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000158127811 935579729 /nfs/dbraw/zinc/57/97/29/935579729.db2.gz FEPMGKSBXQCLDR-UHFFFAOYSA-N 0 0 367.720 3.534 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)N2CCC[C@H]([C@@H]3CCOC3)C2)cc1[N+](=O)[O-] ZINC000439937804 945111451 /nfs/dbraw/zinc/11/14/51/945111451.db2.gz YTFQXNHLTNVXLC-JKSUJKDBSA-N 0 0 360.454 3.781 20 5 FHBDRN CCc1oc2ccccc2c1CN(C)c1ncc(C(=O)OC)cc1[N+](=O)[O-] ZINC000478267685 935594919 /nfs/dbraw/zinc/59/49/19/935594919.db2.gz NTCTVSFDBVLRRJ-UHFFFAOYSA-N 0 0 369.377 3.721 20 5 FHBDRN Cc1ccc(S(=O)(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)c(C)c1 ZINC000478240728 935596226 /nfs/dbraw/zinc/59/62/26/935596226.db2.gz WLNNECOEIDKKTN-UHFFFAOYSA-N 0 0 360.435 3.565 20 5 FHBDRN CC(C)(C)c1ncc(/C=C2/N=C(c3cccc([N+](=O)[O-])c3)OC2=O)s1 ZINC000255502889 935600687 /nfs/dbraw/zinc/60/06/87/935600687.db2.gz DCCFRESVKNKJQR-MDWZMJQESA-N 0 0 357.391 3.693 20 5 FHBDRN O=C(COc1cccc([N+](=O)[O-])c1)N[C@@H]1CC[C@H](c2cccc(F)c2)C1 ZINC000478277921 935605266 /nfs/dbraw/zinc/60/52/66/935605266.db2.gz GWVQFEMEWNNLGL-GOEBONIOSA-N 0 0 358.369 3.565 20 5 FHBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)N1CCC[C@@H]1C[C@H](O)c1cccs1 ZINC000255503366 935608084 /nfs/dbraw/zinc/60/80/84/935608084.db2.gz RBUGILSBRBOSFB-XKJZPFPASA-N 0 0 372.446 3.784 20 5 FHBDRN CCc1n[nH]c(C(=O)N2CCC(CC)(Cc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000478320848 935608901 /nfs/dbraw/zinc/60/89/01/935608901.db2.gz DEFLMICPNGKEEJ-UHFFFAOYSA-N 0 0 370.453 3.755 20 5 FHBDRN Nc1c([N+](=O)[O-])cnn1Cc1csc(-c2ccc(C(F)(F)F)cc2)n1 ZINC000127543175 935618935 /nfs/dbraw/zinc/61/89/35/935618935.db2.gz WYJVRMODZHTTEK-UHFFFAOYSA-N 0 0 369.328 3.564 20 5 FHBDRN Cc1noc2nc(C(C)C)cc(C(=O)N(C)c3cccc([N+](=O)[O-])c3)c12 ZINC000158563619 935635448 /nfs/dbraw/zinc/63/54/48/935635448.db2.gz MGCPEWDHQBIFLK-UHFFFAOYSA-N 0 0 354.366 3.839 20 5 FHBDRN Cc1cc([C@@H]2CN(C(=O)Nc3ccc([N+](=O)[O-])cc3)CCO2)ccc1F ZINC000127574531 935635753 /nfs/dbraw/zinc/63/57/53/935635753.db2.gz DILFJDWYOHAULO-KRWDZBQOSA-N 0 0 359.357 3.648 20 5 FHBDRN Cc1cc(C(=O)N[C@@H](CO)c2c(Cl)cccc2Cl)ccc1[N+](=O)[O-] ZINC000478468887 935638321 /nfs/dbraw/zinc/63/83/21/935638321.db2.gz PZTXBZTVTCKYGQ-ZDUSSCGKSA-N 0 0 369.204 3.673 20 5 FHBDRN O=C(N[C@H]1C[C@H](c2ccc(Cl)cc2)C1)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000478551923 935650988 /nfs/dbraw/zinc/65/09/88/935650988.db2.gz ZVHAJBASEKNWEO-YEORSEQZSA-N 0 0 374.780 3.653 20 5 FHBDRN COc1ccc(NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])c(C)n1 ZINC000127616112 935660437 /nfs/dbraw/zinc/66/04/37/935660437.db2.gz WAKBIUUUSSGQTM-UHFFFAOYSA-N 0 0 355.272 3.578 20 5 FHBDRN CC(C)c1ncc(NC(=O)c2ccc(Br)cc2[N+](=O)[O-])cn1 ZINC000478678233 935674859 /nfs/dbraw/zinc/67/48/59/935674859.db2.gz UXCZNOIBRDHBHZ-UHFFFAOYSA-N 0 0 365.187 3.523 20 5 FHBDRN Cc1cc(C(=O)N(C)c2cccc([N+](=O)[O-])c2)nn1-c1ccc(F)cc1F ZINC000158278850 935676492 /nfs/dbraw/zinc/67/64/92/935676492.db2.gz OIHPNCHFLYFPAS-UHFFFAOYSA-N 0 0 372.331 3.644 20 5 FHBDRN O=C(Cc1cccc([N+](=O)[O-])c1)N[C@@H](CCc1ccccc1)C(F)(F)F ZINC000478692275 935678720 /nfs/dbraw/zinc/67/87/20/935678720.db2.gz YLZVHEDNYNGIOH-INIZCTEOSA-N 0 0 366.339 3.817 20 5 FHBDRN Cc1cccc2c1N(C1CC1)CCN2C(=O)c1ccc([N+](=O)[O-])cc1C ZINC000478680740 935682936 /nfs/dbraw/zinc/68/29/36/935682936.db2.gz HTFSGVLNVONGOK-UHFFFAOYSA-N 0 0 351.406 3.841 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N(C)c1nc(C)cc(C)n1 ZINC000582444349 935713608 /nfs/dbraw/zinc/71/36/08/935713608.db2.gz AOSUBXNUIHYRGY-UHFFFAOYSA-N 0 0 360.439 3.780 20 5 FHBDRN Cc1ccn(-c2ccccc2CNC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)n1 ZINC000161273295 935714449 /nfs/dbraw/zinc/71/44/49/935714449.db2.gz FFYRIGYHXRODHN-UHFFFAOYSA-N 0 0 370.796 3.672 20 5 FHBDRN C[C@H]1CCc2ccccc2[C@H]1NC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000582443741 935715562 /nfs/dbraw/zinc/71/55/62/935715562.db2.gz BZPSWMNBPBAMLT-WLRWDXFRSA-N 0 0 360.360 3.855 20 5 FHBDRN CC(C)c1nnc([C@H]2CCCCN2c2ncc(Cl)cc2[N+](=O)[O-])[nH]1 ZINC000582447273 935721637 /nfs/dbraw/zinc/72/16/37/935721637.db2.gz DTEQHSGEXCPCGP-LLVKDONJSA-N 0 0 350.810 3.616 20 5 FHBDRN Cc1c(CNC(=O)NC[C@H]2CCCO[C@H]2C(C)(C)C)cccc1[N+](=O)[O-] ZINC000478857631 935745758 /nfs/dbraw/zinc/74/57/58/935745758.db2.gz UCJDQEATDFPJSF-NVXWUHKLSA-N 0 0 363.458 3.544 20 5 FHBDRN CCO[C@H]1C[C@H](N(C)C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)C12CCC2 ZINC000478856598 935748912 /nfs/dbraw/zinc/74/89/12/935748912.db2.gz GFNPDWAANVKSPG-HOTGVXAUSA-N 0 0 366.845 3.597 20 5 FHBDRN Cc1cccc(NC(=O)[C@@H](C)N(C)CCc2ccccc2[N+](=O)[O-])c1C ZINC000511134822 935760249 /nfs/dbraw/zinc/76/02/49/935760249.db2.gz CEUXMUQNVOSUNX-MRXNPFEDSA-N 0 0 355.438 3.713 20 5 FHBDRN COC(=O)c1ccc(F)c(CN(Cc2cccc([N+](=O)[O-])c2)C2CC2)c1 ZINC000511135350 935762775 /nfs/dbraw/zinc/76/27/75/935762775.db2.gz OSQPQPHECMSCOQ-UHFFFAOYSA-N 0 0 358.369 3.685 20 5 FHBDRN COC1(CNC(=O)c2c([N+](=O)[O-])cccc2C(F)(F)F)CCCCC1 ZINC000478970565 935765815 /nfs/dbraw/zinc/76/58/15/935765815.db2.gz DOUYELYPMIHLPX-UHFFFAOYSA-N 0 0 360.332 3.693 20 5 FHBDRN Cc1nc(COC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)c(C)s1 ZINC000158389512 935770096 /nfs/dbraw/zinc/77/00/96/935770096.db2.gz MMBBDEUZWHPDJK-JTQLQIEISA-N 0 0 352.437 3.892 20 5 FHBDRN CCc1ccccc1NC(=O)[C@@H](C)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000511137078 935770740 /nfs/dbraw/zinc/77/07/40/935770740.db2.gz BMPWQOLGDBIEIU-OAHLLOKOSA-N 0 0 355.438 3.659 20 5 FHBDRN C[C@@H](NC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1)c1cccc(Cl)c1 ZINC000479020427 935772126 /nfs/dbraw/zinc/77/21/26/935772126.db2.gz OUZNALGZIQMTJN-GFCCVEGCSA-N 0 0 370.796 3.925 20 5 FHBDRN Cn1ccnc1[C@@H](N[C@@H]1CCc2c1cccc2[N+](=O)[O-])c1ccc(F)cc1 ZINC000582496706 935776361 /nfs/dbraw/zinc/77/63/61/935776361.db2.gz IRCATCWDXXTZKW-MJGOQNOKSA-N 0 0 366.396 3.834 20 5 FHBDRN CC(F)(F)c1ccc(CNC(=O)NCCc2ccccc2[N+](=O)[O-])cc1 ZINC000432117857 945122699 /nfs/dbraw/zinc/12/26/99/945122699.db2.gz SVHQTASOMVVESP-UHFFFAOYSA-N 0 0 363.364 3.748 20 5 FHBDRN COc1ccc(CCNC(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)cc1OC ZINC000127758837 935777574 /nfs/dbraw/zinc/77/75/74/935777574.db2.gz VGHBWNVJTYVNMG-UHFFFAOYSA-N 0 0 373.409 3.593 20 5 FHBDRN CC(C)c1ccc(C(=O)N2C[C@@H](C)C(=O)Nc3ccccc32)cc1[N+](=O)[O-] ZINC000187751717 935788749 /nfs/dbraw/zinc/78/87/49/935788749.db2.gz QQYPMQWOSMFSND-CYBMUJFWSA-N 0 0 367.405 3.953 20 5 FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H]2CCC[C@@H]21 ZINC000159112987 935795167 /nfs/dbraw/zinc/79/51/67/935795167.db2.gz LAEUAFUSDBUNSF-BBRMVZONSA-N 0 0 364.467 3.738 20 5 FHBDRN CCOc1ccc2nc(NC(=O)c3ccc(F)cc3[N+](=O)[O-])sc2c1 ZINC000158438191 935795851 /nfs/dbraw/zinc/79/58/51/935795851.db2.gz HHMNBIRQMLFROP-UHFFFAOYSA-N 0 0 361.354 3.995 20 5 FHBDRN O=C(Nc1ccc2ccccc2n1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000479119583 935796934 /nfs/dbraw/zinc/79/69/34/935796934.db2.gz GDQZLWXSMXISRU-UHFFFAOYSA-N 0 0 359.345 3.581 20 5 FHBDRN CCCn1ccnc1CCCN(C)C(=O)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000277678909 935811385 /nfs/dbraw/zinc/81/13/85/935811385.db2.gz WOSGDKROUWYXHQ-UHFFFAOYSA-N 0 0 364.833 3.560 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(N[C@H](Cc2nccn2C)c2ccccc2)n1 ZINC000611616735 935815060 /nfs/dbraw/zinc/81/50/60/935815060.db2.gz AOUODFZRNZJJED-MRXNPFEDSA-N 0 0 351.410 3.736 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(N2CCC(n3ccc(C(F)(F)F)n3)CC2)n1 ZINC000611617676 935816726 /nfs/dbraw/zinc/81/67/26/935816726.db2.gz UJDGBVLRWOFGPD-UHFFFAOYSA-N 0 0 369.347 3.663 20 5 FHBDRN O=[N+]([O-])c1cnccc1N1CCO[C@@H](c2ccccc2C(F)(F)F)C1 ZINC000611617725 935818130 /nfs/dbraw/zinc/81/81/30/935818130.db2.gz AIPMVDDCJRNLRB-OAHLLOKOSA-N 0 0 353.300 3.587 20 5 FHBDRN C[C@@H](NC(=O)[C@@H](C)Oc1cccnc1[N+](=O)[O-])c1cccc2ccccc21 ZINC000023754163 935818355 /nfs/dbraw/zinc/81/83/55/935818355.db2.gz DSLPOHRTVNXAJY-ZIAGYGMSSA-N 0 0 365.389 3.788 20 5 FHBDRN Cn1cc(Oc2ccccc2-c2nc(-c3ccc([N+](=O)[O-])cc3)no2)cn1 ZINC000511159038 935820343 /nfs/dbraw/zinc/82/03/43/935820343.db2.gz XIIHKMDAUFRXOK-UHFFFAOYSA-N 0 0 363.333 3.838 20 5 FHBDRN COCCCN(Cc1ccncc1)C(=O)Nc1c(C)ccc([N+](=O)[O-])c1C ZINC000127835318 935820661 /nfs/dbraw/zinc/82/06/61/935820661.db2.gz QVRUFZULCACMOV-UHFFFAOYSA-N 0 0 372.425 3.677 20 5 FHBDRN CCOc1ncccc1NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000050314064 935829579 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Cn1cc(CNCc2nc3cc([N+](=O)[O-])ccc3[nH]2)c(C2CCCCC2)n1 ZINC000278579951 938551988 /nfs/dbraw/zinc/55/19/88/938551988.db2.gz DAUQWZLCYSNDRD-UHFFFAOYSA-N 0 0 368.441 3.542 20 5 FHBDRN O=[N+]([O-])c1cccc(OC[C@H](O)COc2ccc(Cl)c(Cl)c2)c1 ZINC000573026793 938569299 /nfs/dbraw/zinc/56/92/99/938569299.db2.gz XKTZMUNUOGYXCM-NSHDSACASA-N 0 0 358.177 3.720 20 5 FHBDRN CCN(c1ccc(C(=O)Nc2cc([N+](=O)[O-])ccc2NC)cn1)C(C)C ZINC000584055901 938573279 /nfs/dbraw/zinc/57/32/79/938573279.db2.gz VJUWZVYATWRBSE-UHFFFAOYSA-N 0 0 357.414 3.519 20 5 FHBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)N[C@H]1CCC[C@H]1c1ccccc1 ZINC000536207698 938581260 /nfs/dbraw/zinc/58/12/60/938581260.db2.gz CLHAUGQQFGZOBJ-OALUTQOASA-N 0 0 353.422 3.773 20 5 FHBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)N1CCC[C@H](Cc2ccccc2)C1 ZINC000536207511 938581672 /nfs/dbraw/zinc/58/16/72/938581672.db2.gz AOZALRQRGOMAOD-LJQANCHMSA-N 0 0 367.449 3.802 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CCCc2cc(F)cc(F)c21 ZINC000414964313 945187852 /nfs/dbraw/zinc/18/78/52/945187852.db2.gz UTTSHBGLVZZEKV-JKSUJKDBSA-N 0 0 358.344 3.956 20 5 FHBDRN COc1cccc(C2(CNC(=O)CSc3ccccc3[N+](=O)[O-])CC2)c1 ZINC000584085767 938592419 /nfs/dbraw/zinc/59/24/19/938592419.db2.gz XNZWXHNKLLIGFC-UHFFFAOYSA-N 0 0 372.446 3.544 20 5 FHBDRN CC(=O)Nc1cc(C(=O)Nc2cc([N+](=O)[O-])c(Cl)cc2C)ccc1F ZINC000135501130 938594129 /nfs/dbraw/zinc/59/41/29/938594129.db2.gz FEBCAMSAORODJQ-UHFFFAOYSA-N 0 0 365.748 3.906 20 5 FHBDRN O=C(NC[C@H](c1ccccc1)C1CC1)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000584090749 938596047 /nfs/dbraw/zinc/59/60/47/938596047.db2.gz XVSPIOAJRRUMCH-LJQANCHMSA-N 0 0 365.433 3.856 20 5 FHBDRN COC(=O)[C@@H](C)Cc1ccc(Nc2cc(OC)c(OC)cc2[N+](=O)[O-])cc1 ZINC000584105629 938602606 /nfs/dbraw/zinc/60/26/06/938602606.db2.gz ILWJDCLMILGGQK-LBPRGKRZSA-N 0 0 374.393 3.707 20 5 FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N(C)Cc1ccccc1C ZINC000162039098 938605717 /nfs/dbraw/zinc/60/57/17/938605717.db2.gz KNONAOVRKIJHCI-UHFFFAOYSA-N 0 0 374.462 3.914 20 5 FHBDRN CCOc1ccc([C@@H](C)NC(=O)c2c(C)cccc2[N+](=O)[O-])cc1OC ZINC000507373214 945190657 /nfs/dbraw/zinc/19/06/57/945190657.db2.gz WEPWCWIGANLSOW-CYBMUJFWSA-N 0 0 358.394 3.802 20 5 FHBDRN Cn1ncc(C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)c1C(F)F ZINC000543853840 938636841 /nfs/dbraw/zinc/63/68/41/938636841.db2.gz BGRLVIFOAPNAKQ-UHFFFAOYSA-N 0 0 364.230 3.537 20 5 FHBDRN CS(=O)(=O)Cc1ccc(N[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000278673133 938640446 /nfs/dbraw/zinc/64/04/46/938640446.db2.gz JIUUEVAJZHWSIF-GOSISDBHSA-N 0 0 360.435 3.629 20 5 FHBDRN NC(=O)c1ccc(-c2nc(COc3cc(F)ccc3[N+](=O)[O-])cs2)cc1 ZINC000052888509 938644583 /nfs/dbraw/zinc/64/45/83/938644583.db2.gz WCMMTABOXTVGJA-UHFFFAOYSA-N 0 0 373.365 3.535 20 5 FHBDRN CCc1nc(CSc2nc3cc4ccccc4cc3c(=O)n2CC)no1 ZINC000052890167 938646398 /nfs/dbraw/zinc/64/63/98/938646398.db2.gz PMDKEGMQIYUULV-UHFFFAOYSA-N 0 0 366.446 3.807 20 5 FHBDRN O=C(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)N1CCC[C@H]1c1ccsc1 ZINC000278687135 938650433 /nfs/dbraw/zinc/65/04/33/938650433.db2.gz MNTINRGDQNNGOI-HNNXBMFYSA-N 0 0 371.422 3.579 20 5 FHBDRN O=C(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)N1CCC[C@@H]1c1ccsc1 ZINC000278687144 938650503 /nfs/dbraw/zinc/65/05/03/938650503.db2.gz MNTINRGDQNNGOI-OAHLLOKOSA-N 0 0 371.422 3.579 20 5 FHBDRN O=C(c1cc(F)cc([N+](=O)[O-])c1)N1C[C@H]2CCCCN2c2ccccc21 ZINC000584251728 938656044 /nfs/dbraw/zinc/65/60/44/938656044.db2.gz FCYLEVAFGMCZRK-OAHLLOKOSA-N 0 0 355.369 3.753 20 5 FHBDRN CCOc1cc(CNc2ccc(F)c(C(=O)OC)c2F)ccc1[N+](=O)[O-] ZINC000584264075 938664733 /nfs/dbraw/zinc/66/47/33/938664733.db2.gz HFNQYYUNRFUFAS-UHFFFAOYSA-N 0 0 366.320 3.670 20 5 FHBDRN O=C(Cc1coc(-c2ccccc2)n1)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000162134765 938671672 /nfs/dbraw/zinc/67/16/72/938671672.db2.gz DTXLUFZACHONHL-UHFFFAOYSA-N 0 0 363.373 3.772 20 5 FHBDRN Cc1ccc([C@@H]2C[C@H](C)N(C(=O)c3cc4c(cc3[N+](=O)[O-])OCO4)C2)cc1 ZINC000573182158 938678876 /nfs/dbraw/zinc/67/88/76/938678876.db2.gz KIMRIQZFAVSRQC-DZGCQCFKSA-N 0 0 368.389 3.650 20 5 FHBDRN C[C@@H](C(=O)NC[C@H](C)Oc1ccccc1Cl)c1cccc([N+](=O)[O-])c1 ZINC000584325731 938687817 /nfs/dbraw/zinc/68/78/17/938687817.db2.gz YKCKDPLXOCPQPP-QWHCGFSZSA-N 0 0 362.813 3.935 20 5 FHBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)N[C@H](CC(F)(F)F)c1ccccc1 ZINC000056128025 938698808 /nfs/dbraw/zinc/69/88/08/938698808.db2.gz RHGBMODFEASLIF-GFCCVEGCSA-N 0 0 374.340 3.567 20 5 FHBDRN COc1ccc(NC(=O)N[C@@H]2COc3ccc(Cl)cc32)cc1[N+](=O)[O-] ZINC000611826376 938699040 /nfs/dbraw/zinc/69/90/40/938699040.db2.gz QYCMTHUBSKDFFB-GFCCVEGCSA-N 0 0 363.757 3.512 20 5 FHBDRN CC[C@@H](Nc1cccc(C(=O)NCCOC)c1)c1cccc([N+](=O)[O-])c1 ZINC000584366840 938711827 /nfs/dbraw/zinc/71/18/27/938711827.db2.gz PBGAEINKCUSNLO-GOSISDBHSA-N 0 0 357.410 3.534 20 5 FHBDRN O=C1CCCN1CC[C@@H]1CN(c2ccccc2[N+](=O)[O-])c2ccccc21 ZINC000081030494 938716475 /nfs/dbraw/zinc/71/64/75/938716475.db2.gz WXLXMVZJVBXODJ-OAHLLOKOSA-N 0 0 351.406 3.843 20 5 FHBDRN CCNC(=O)Nc1ccc(C)c(NCc2ccc(OC)c([N+](=O)[O-])c2)c1 ZINC000278745578 938780731 /nfs/dbraw/zinc/78/07/31/938780731.db2.gz MVEQVHUWIDSPEC-UHFFFAOYSA-N 0 0 358.398 3.665 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CCc2cc(N)ccc21 ZINC000573221950 938805318 /nfs/dbraw/zinc/80/53/18/938805318.db2.gz WOLZSHJGXNWOOR-IBGZPJMESA-N 0 0 368.437 3.785 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1OCC(=O)Nc1ccccc1C(C)(C)C ZINC000024202796 938835547 /nfs/dbraw/zinc/83/55/47/938835547.db2.gz KZKNMEBEPRQGRX-UHFFFAOYSA-N 0 0 358.394 3.918 20 5 FHBDRN CC(C)C[C@H]1CCCN(C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000151889909 938839753 /nfs/dbraw/zinc/83/97/53/938839753.db2.gz XUEVXMCSEZFOAV-OAHLLOKOSA-N 0 0 356.426 3.679 20 5 FHBDRN COc1ccc(C2=N/C(=C\c3cc(Cl)cs3)C(=O)O2)cc1[N+](=O)[O-] ZINC000588600929 938840402 /nfs/dbraw/zinc/84/04/02/938840402.db2.gz RHGMPNKULGOAOB-WDZFZDKYSA-N 0 0 364.766 3.663 20 5 FHBDRN Cc1cc(OCC(=O)N(C)Cc2ccccc2F)c(Cl)cc1[N+](=O)[O-] ZINC000506433172 945208824 /nfs/dbraw/zinc/20/88/24/945208824.db2.gz OHBCSJGTZNGYLX-UHFFFAOYSA-N 0 0 366.776 3.733 20 5 FHBDRN CCOc1cc(NC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])ccc1OC ZINC000065669582 938874583 /nfs/dbraw/zinc/87/45/83/938874583.db2.gz SMQUDITZYRUTQZ-UHFFFAOYSA-N 0 0 352.293 3.533 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)[C@H]2COc3cc(C)c(C)cc32)cc1[N+](=O)[O-] ZINC000472322049 938883810 /nfs/dbraw/zinc/88/38/10/938883810.db2.gz RFIBFUUQYJWGGU-YOEHRIQHSA-N 0 0 354.406 3.873 20 5 FHBDRN O=C(c1cnc(-c2ccco2)s1)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000179098846 938887669 /nfs/dbraw/zinc/88/76/69/938887669.db2.gz YVXUWPROIVPKTJ-UHFFFAOYSA-N 0 0 355.375 3.904 20 5 FHBDRN Cc1c(CC(=O)Nc2ccc(N3CCCC3)c(F)c2)cccc1[N+](=O)[O-] ZINC000162229194 938898948 /nfs/dbraw/zinc/89/89/48/938898948.db2.gz VVHWMMFRZRSCSM-UHFFFAOYSA-N 0 0 357.385 3.824 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)Nc1c(C)cnc2c(OC)cccc21 ZINC000573262106 938909797 /nfs/dbraw/zinc/90/97/97/938909797.db2.gz XWMZRRPSHTWEHU-UHFFFAOYSA-N 0 0 367.361 3.721 20 5 FHBDRN CNc1ccc(C(=O)Nc2ccc(Cl)c(NC(C)=O)c2)cc1[N+](=O)[O-] ZINC000144897584 938952126 /nfs/dbraw/zinc/95/21/26/938952126.db2.gz NVBUEQBLKBQDFC-UHFFFAOYSA-N 0 0 362.773 3.501 20 5 FHBDRN COc1ccc(CCNc2ccc([N+](=O)[O-])c3ncccc23)cc1OC ZINC000196204612 938960987 /nfs/dbraw/zinc/96/09/87/938960987.db2.gz DNRYYICTUVIZCJ-UHFFFAOYSA-N 0 0 353.378 3.815 20 5 FHBDRN O=[N+]([O-])c1cnc2ccc(Br)cc2c1NCC1(C(F)F)CC1 ZINC000480491663 938964606 /nfs/dbraw/zinc/96/46/06/938964606.db2.gz DXTHOAFDWDBQQF-UHFFFAOYSA-N 0 0 372.169 3.785 20 5 FHBDRN Cc1ncsc1CN(C)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000157815026 938965968 /nfs/dbraw/zinc/96/59/68/938965968.db2.gz DJWPFIANMHIMNK-UHFFFAOYSA-N 0 0 356.245 3.754 20 5 FHBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)N1CC[C@H]1c1ccc(Cl)cc1 ZINC000511261810 938967177 /nfs/dbraw/zinc/96/71/77/938967177.db2.gz QJNYAKDTESUCFF-HNNXBMFYSA-N 0 0 366.826 3.525 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2ccc(CN3CCN(c4ccccn4)CC3)o2)c1 ZINC000158894570 938967645 /nfs/dbraw/zinc/96/76/45/938967645.db2.gz FKQSBMBAHRHDGR-UHFFFAOYSA-N 0 0 364.405 3.572 20 5 FHBDRN Cc1cc(C(=O)N2CCC[C@@H]2c2nc([C@@H](C)C3CC3)no2)ccc1[N+](=O)[O-] ZINC000290054107 938967864 /nfs/dbraw/zinc/96/78/64/938967864.db2.gz JXVXAQAZUWESLF-BLLLJJGKSA-N 0 0 370.409 3.777 20 5 FHBDRN O=C(c1ccc(N2CCCC2)c([N+](=O)[O-])c1)N1CC[C@@H]1c1ccccc1 ZINC000053081043 938968175 /nfs/dbraw/zinc/96/81/75/938968175.db2.gz ZHSBLYSVEUNKBY-QGZVFWFLSA-N 0 0 351.406 3.782 20 5 FHBDRN C[C@H](NC(=O)Cn1c2ccccc2c(=O)c2ccccc21)c1cccc(O)c1 ZINC000171383422 938969528 /nfs/dbraw/zinc/96/95/28/938969528.db2.gz PDTMHYUFSLORJI-HNNXBMFYSA-N 0 0 372.424 3.738 20 5 FHBDRN Cc1ccccc1[C@]1(F)CCN(C(=O)NCCc2ccccc2[N+](=O)[O-])C1 ZINC000409628547 938973650 /nfs/dbraw/zinc/97/36/50/938973650.db2.gz BTEWFGHWUWZQAS-FQEVSTJZSA-N 0 0 371.412 3.726 20 5 FHBDRN CC(C)C(=O)Nc1ccc(C(=O)CSc2ncccc2[N+](=O)[O-])cc1 ZINC000065693121 938974167 /nfs/dbraw/zinc/97/41/67/938974167.db2.gz OMYZYGBNSCUREN-UHFFFAOYSA-N 0 0 359.407 3.559 20 5 FHBDRN CCCn1nccc1C1CCN(c2cccc(OCC)c2[N+](=O)[O-])CC1 ZINC000409637618 938978786 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FHBDRN C[C@H]1CCN(CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)[C@@H]1c1cccc(F)c1 ZINC000472344993 939006202 /nfs/dbraw/zinc/00/62/02/939006202.db2.gz BNTUFKKTUDHFKZ-XOBRGWDASA-N 0 0 371.412 3.780 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)N1CCC[C@H]1c1cccs1 ZINC000065718867 939007126 /nfs/dbraw/zinc/00/71/26/939007126.db2.gz PXHBYYJZIQPZCA-INIZCTEOSA-N 0 0 355.419 3.975 20 5 FHBDRN Cc1ccc(NC(=O)c2ccc([N+](=O)[O-])s2)c(OC[C@H]2CCCO2)c1 ZINC000065717062 939007341 /nfs/dbraw/zinc/00/73/41/939007341.db2.gz UYCPRUQVTBOLAI-GFCCVEGCSA-N 0 0 362.407 3.775 20 5 FHBDRN CO[C@H]1Cc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3SC)cc2C1 ZINC000935347477 939010176 /nfs/dbraw/zinc/01/01/76/939010176.db2.gz WPHSQQKGVCHPLL-HNNXBMFYSA-N 0 0 358.419 3.683 20 5 FHBDRN O=C(CSc1ccc(F)c(F)c1)OCc1ccc([N+](=O)[O-])c(F)c1 ZINC000782540761 939011775 /nfs/dbraw/zinc/01/17/75/939011775.db2.gz OQNOQESEQKVQPH-UHFFFAOYSA-N 0 0 357.309 3.848 20 5 FHBDRN Cc1cn2c(n1)CN(Cc1ccc(-c3ccccc3[N+](=O)[O-])s1)CC2 ZINC000611983709 939011798 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CCOc1cc(NC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)ccc1OC ZINC000065734922 939017738 /nfs/dbraw/zinc/01/77/38/939017738.db2.gz ANCRJOFBXYSQBF-UHFFFAOYSA-N 0 0 369.377 3.596 20 5 FHBDRN CCc1ccc(CSc2ccc([N+](=O)[O-])c(S(C)(=O)=O)c2)cc1 ZINC000179258312 939017779 /nfs/dbraw/zinc/01/77/79/939017779.db2.gz CPQGVCIBRKKRQY-UHFFFAOYSA-N 0 0 351.449 3.853 20 5 FHBDRN CSc1cccc(C(=O)NCc2nc(-c3ccccc3)c[nH]2)c1[N+](=O)[O-] ZINC000188091164 939018134 /nfs/dbraw/zinc/01/81/34/939018134.db2.gz ZKQRDUFCNTWAAS-UHFFFAOYSA-N 0 0 368.418 3.637 20 5 FHBDRN CC(C)Oc1ccccc1CNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000065736420 939018327 /nfs/dbraw/zinc/01/83/27/939018327.db2.gz QLVAMHJDUAIIMY-UHFFFAOYSA-N 0 0 367.405 3.653 20 5 FHBDRN COc1cc(C(=O)N[C@H](c2nc(C)cs2)C2CC2)cc([N+](=O)[O-])c1C ZINC000188127938 939018667 /nfs/dbraw/zinc/01/86/67/939018667.db2.gz ZQIQBWFWEGRONR-HNNXBMFYSA-N 0 0 361.423 3.558 20 5 FHBDRN CSc1cccc(C(=O)N2CCC[C@@H](c3nccs3)C2)c1[N+](=O)[O-] ZINC000188127179 939018671 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COc1cc(C(=O)N2CCOc3ccc(Cl)cc32)cc([N+](=O)[O-])c1C ZINC000188242530 939073232 /nfs/dbraw/zinc/07/32/32/939073232.db2.gz VAWCKAAQMYQDAG-UHFFFAOYSA-N 0 0 362.769 3.604 20 5 FHBDRN COc1ccc(C(=O)NCc2cccc([N+](=O)[O-])c2)cc1-c1ccccn1 ZINC000179328892 939086244 /nfs/dbraw/zinc/08/62/44/939086244.db2.gz VZRYYKDJIHMGAA-UHFFFAOYSA-N 0 0 363.373 3.595 20 5 FHBDRN C[C@H](C[C@@H](O)c1ccco1)NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000179325233 939086370 /nfs/dbraw/zinc/08/63/70/939086370.db2.gz PPYVDCURTFNBFS-ZWNOBZJWSA-N 0 0 360.391 3.645 20 5 FHBDRN CC(=O)c1ccc(CNC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)nc1C ZINC000179365607 939097124 /nfs/dbraw/zinc/09/71/24/939097124.db2.gz CVQGVMRMUPBNMI-UHFFFAOYSA-N 0 0 369.402 3.646 20 5 FHBDRN CSc1cccc(C(=O)N2CCc3c([nH]c4ccccc43)C2)c1[N+](=O)[O-] ZINC000188258005 939113876 /nfs/dbraw/zinc/11/38/76/939113876.db2.gz PGRYANWYDWNXEC-UHFFFAOYSA-N 0 0 367.430 3.997 20 5 FHBDRN CO[C@@H](CNC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1)c1ccccc1 ZINC000179402456 939138276 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O=[N+]([O-])c1cccc(Cl)c1NCc1nc(COc2ccccc2)n[nH]1 ZINC000432176265 945260625 /nfs/dbraw/zinc/26/06/25/945260625.db2.gz LHIAUNNJXIYVHN-UHFFFAOYSA-N 0 0 359.773 3.557 20 5 FHBDRN Cc1cccc(C)c1Oc1ccccc1NC(=O)c1cc([N+](=O)[O-])n[nH]1 ZINC000506768627 945264118 /nfs/dbraw/zinc/26/41/18/945264118.db2.gz WIKZUUNCMRXWFY-UHFFFAOYSA-N 0 0 352.350 3.979 20 5 FHBDRN Cc1ccc([C@H]2CCCN2S(=O)(=O)c2ccc(C)cc2[N+](=O)[O-])cc1 ZINC000507494201 945265592 /nfs/dbraw/zinc/26/55/92/945265592.db2.gz MTOSBNBGGVXHQF-MRXNPFEDSA-N 0 0 360.435 3.737 20 5 FHBDRN COC(=O)[C@@]1(c2ccccc2)CCN(c2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000432176987 945271938 /nfs/dbraw/zinc/27/19/38/945271938.db2.gz NXQMPKKVIZHOSN-SFHVURJKSA-N 0 0 360.797 3.569 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)NC[C@H]2CCO[C@H]2c2ccccc2)c1 ZINC000518268111 945272379 /nfs/dbraw/zinc/27/23/79/945272379.db2.gz RMQAOBWXJUQPDN-KDOFPFPSSA-N 0 0 372.446 3.824 20 5 FHBDRN O=C(NC[C@@H](Cc1ccccc1)C(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000518267901 945273424 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FHBDRN CSc1ccc(CNC(=O)c2ccc([N+](=O)[O-])c3cccnc23)cc1 ZINC000179639985 939907034 /nfs/dbraw/zinc/90/70/34/939907034.db2.gz ZJJJYXJJTRYCEA-UHFFFAOYSA-N 0 0 353.403 3.795 20 5 FHBDRN CCOc1cc(N2CC[C@@H](n3ncc4ccccc43)C2)ccc1[N+](=O)[O-] ZINC000511330690 939912116 /nfs/dbraw/zinc/91/21/16/939912116.db2.gz AJRMIGGTXWGDRP-MRXNPFEDSA-N 0 0 352.394 3.795 20 5 FHBDRN O=C(OCc1nc(-c2ccc([N+](=O)[O-])cc2)no1)c1cc(Cl)cs1 ZINC000758752963 945280935 /nfs/dbraw/zinc/28/09/35/945280935.db2.gz WLWYBPUNONFZEV-UHFFFAOYSA-N 0 0 365.754 3.717 20 5 FHBDRN O=C(N[C@@H]1CCc2ccccc21)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000431634898 939913401 /nfs/dbraw/zinc/91/34/01/939913401.db2.gz PAGSQOTZOQVXHB-OAHLLOKOSA-N 0 0 361.195 3.775 20 5 FHBDRN Cc1noc(C2(C)CCN(c3ccc([N+](=O)[O-])c(C(F)(F)F)c3)CC2)n1 ZINC000511331319 939914007 /nfs/dbraw/zinc/91/40/07/939914007.db2.gz CNWXNALVYWZGDX-UHFFFAOYSA-N 0 0 370.331 3.863 20 5 FHBDRN Cc1ccc(NC(=O)N2CCO[C@H](c3ccc(F)c(C)c3)C2)cc1[N+](=O)[O-] ZINC000136301364 939915027 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O=C(Nc1ccc([N+](=O)[O-])c(Cl)c1)c1cnn(Cc2ccccc2)c1 ZINC000102840701 940234257 /nfs/dbraw/zinc/23/42/57/940234257.db2.gz WTKYZGBEXMUAAK-UHFFFAOYSA-N 0 0 356.769 3.745 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc3c(c2)C(=O)CCO3)c1 ZINC000376049206 940241350 /nfs/dbraw/zinc/24/13/50/940241350.db2.gz ZMMNPGLDHBPHNN-UHFFFAOYSA-N 0 0 358.375 3.534 20 5 FHBDRN CN(C(=O)CCOc1ccccc1[N+](=O)[O-])[C@H]1CCCc2ccccc21 ZINC000055011721 940247955 /nfs/dbraw/zinc/24/79/55/940247955.db2.gz CUYLNQSWTHEWNR-KRWDZBQOSA-N 0 0 354.406 3.900 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])c1ccc(OC(F)(F)Cl)cc1 ZINC000782641762 940266539 /nfs/dbraw/zinc/26/65/39/940266539.db2.gz IMJGDAOAPMTOBK-UHFFFAOYSA-N 0 0 356.712 3.693 20 5 FHBDRN Cc1ccc(S(=O)(=O)N2CCC(Cc3ccccc3)CC2)c([N+](=O)[O-])c1 ZINC000507556469 945312240 /nfs/dbraw/zinc/31/22/40/945312240.db2.gz WLKKOTWZFATXFO-UHFFFAOYSA-N 0 0 374.462 3.547 20 5 FHBDRN CCCCCc1nnc(NC(=O)c2cc(OCC)ccc2[N+](=O)[O-])s1 ZINC000548959137 940274127 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Cc1ccc(C[C@H](C)NC(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)s1 ZINC000124602573 945311284 /nfs/dbraw/zinc/31/12/84/945311284.db2.gz AGAGMUGGLYTDTA-LBPRGKRZSA-N 0 0 359.451 3.664 20 5 FHBDRN CN(Cc1ccc(Br)s1)C(=O)Cc1ccccc1[N+](=O)[O-] ZINC000018107840 945311491 /nfs/dbraw/zinc/31/14/91/945311491.db2.gz BZTXWUGDXOOXHD-UHFFFAOYSA-N 0 0 369.240 3.620 20 5 FHBDRN C[C@@H]1CC[C@@H](C(F)(F)F)CN1c1c([N+](=O)[O-])c(C(F)(F)F)nn1C ZINC000601139693 940323788 /nfs/dbraw/zinc/32/37/88/940323788.db2.gz MHFSKJTUTYQRCO-RNFRBKRXSA-N 0 0 360.258 3.514 20 5 FHBDRN O=[N+]([O-])c1cc(C(F)(F)F)ccc1NCCc1nc(C2CCC2)no1 ZINC000612897499 940328267 /nfs/dbraw/zinc/32/82/67/940328267.db2.gz OCFPFGBLYFWQCG-UHFFFAOYSA-N 0 0 356.304 3.919 20 5 FHBDRN CCc1ccc(-c2nc(Cc3ccc4c(c3)OCCO4)no2)cc1[N+](=O)[O-] ZINC000612893855 940331102 /nfs/dbraw/zinc/33/11/02/940331102.db2.gz JNFLNMHBIHJJQY-UHFFFAOYSA-N 0 0 367.361 3.569 20 5 FHBDRN CNc1ccc(-c2nc([C@H](C)c3cccc(OC)c3)no2)cc1[N+](=O)[O-] ZINC000612917848 940335899 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FHBDRN O=C(c1c[nH]c2cc([N+](=O)[O-])ccc12)N1CC=C(c2ccc(O)cc2)CC1 ZINC000613019778 940399501 /nfs/dbraw/zinc/39/95/01/940399501.db2.gz XLQUPMXJOVVLNR-UHFFFAOYSA-N 0 0 363.373 3.711 20 5 FHBDRN CCCCn1nccc1NC(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000124664941 945318650 /nfs/dbraw/zinc/31/86/50/945318650.db2.gz MYYMDBJBNOKKLV-UHFFFAOYSA-N 0 0 367.203 3.606 20 5 FHBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H](CO)[C@@H]1C ZINC000414022160 940416655 /nfs/dbraw/zinc/41/66/55/940416655.db2.gz GEGCCFYFAIXITR-KBPBESRZSA-N 0 0 366.483 3.576 20 5 FHBDRN C[C@@H](NC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1)c1cccc(-n2cccn2)c1 ZINC000579902916 940420395 /nfs/dbraw/zinc/42/03/95/940420395.db2.gz IRVQMGCOZWVGOY-HUUCEWRRSA-N 0 0 364.405 3.761 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N[C@H](C)Cc1cn(C)c2ccc(F)cc12 ZINC000414037595 940437897 /nfs/dbraw/zinc/43/78/97/940437897.db2.gz ITFNDAFFMRJUMS-CYBMUJFWSA-N 0 0 369.396 3.895 20 5 FHBDRN CCN(C(=O)c1cc([N+](=O)[O-])cc2c1OCCO2)[C@H](C)c1ccc(F)cc1 ZINC000066328196 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362.813 3.824 20 5 FHBDRN Cc1nc(C(C)(C)NC(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)sc1C ZINC000580239587 940470367 /nfs/dbraw/zinc/47/03/67/940470367.db2.gz JMNPPTNSFPQAIS-UHFFFAOYSA-N 0 0 369.393 3.540 20 5 FHBDRN Cc1oc2ccccc2c1Cc1nc(Cc2ccc([N+](=O)[O-])cn2)no1 ZINC000580243094 940470576 /nfs/dbraw/zinc/47/05/76/940470576.db2.gz GKHOURSTTWJLKR-UHFFFAOYSA-N 0 0 350.334 3.609 20 5 FHBDRN Cc1nc(Cl)sc1C(=O)NCCCNc1ccc(C)cc1[N+](=O)[O-] ZINC000177881071 940473590 /nfs/dbraw/zinc/47/35/90/940473590.db2.gz VBVPJGPTHLDWPC-UHFFFAOYSA-N 0 0 368.846 3.554 20 5 FHBDRN O=C(Oc1cc(Cl)ccc1[N+](=O)[O-])c1ccc(CN2CCCC2=O)cc1 ZINC000124838630 945323822 /nfs/dbraw/zinc/32/38/22/945323822.db2.gz UKDSWWKTPHMLKI-UHFFFAOYSA-N 0 0 374.780 3.590 20 5 FHBDRN C[C@@H](C(=O)NCCCO[C@@H](C)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000580393504 940475731 /nfs/dbraw/zinc/47/57/31/940475731.db2.gz IIAFZPRUMUTEFZ-CVEARBPZSA-N 0 0 356.422 3.982 20 5 FHBDRN C[C@@H](C(=O)NCCc1ccc(OC(F)F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000580389539 940475777 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20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCC(C)(C)[C@@H]1CCCCO1 ZINC000613188850 940480717 /nfs/dbraw/zinc/48/07/17/940480717.db2.gz HZGJUIWMGAFDRT-WMZOPIPTSA-N 0 0 362.470 3.875 20 5 FHBDRN CC(=O)c1ccc([N+](=O)[O-])cc1N1CCC2(CC1)OCCc1ccsc12 ZINC000580672363 940481853 /nfs/dbraw/zinc/48/18/53/940481853.db2.gz OFCCBRQGFGGOKY-UHFFFAOYSA-N 0 0 372.446 3.927 20 5 FHBDRN CO[C@@H]1CCCC[C@@H]1C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000511448321 940481989 /nfs/dbraw/zinc/48/19/89/940481989.db2.gz WOBPTYGQKUZOEN-SMDDNHRTSA-N 0 0 371.231 3.809 20 5 FHBDRN O=C(NCCOc1ccc([N+](=O)[O-])cc1)c1ccc(Cl)c2ncccc12 ZINC000549008127 940491174 /nfs/dbraw/zinc/49/11/74/940491174.db2.gz CZJWDGKIEOUGBM-UHFFFAOYSA-N 0 0 371.780 3.605 20 5 FHBDRN CC(=O)Oc1ccc(COc2ccc(Br)cc2[N+](=O)[O-])cc1 ZINC000177963537 940493496 /nfs/dbraw/zinc/49/34/96/940493496.db2.gz STLJQLWTGUECDJ-UHFFFAOYSA-N 0 0 366.167 3.862 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NC[C@H]2CCO[C@H]2c2ccccc2)c1 ZINC000549010541 940493994 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3.695 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2noc([C@@H]3CCN(c4ccccc4F)C3)n2)c1 ZINC000581458314 940504257 /nfs/dbraw/zinc/50/42/57/940504257.db2.gz MKMTUKYSEPWRED-CYBMUJFWSA-N 0 0 354.341 3.778 20 5 FHBDRN COC(=O)c1ccc2c(c1)CN(C(=O)Nc1cc([N+](=O)[O-])c(C)cc1C)C2 ZINC000613296248 940505741 /nfs/dbraw/zinc/50/57/41/940505741.db2.gz AWQZHDBIXUQPAQ-UHFFFAOYSA-N 0 0 369.377 3.546 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CCc2ccc(O)cc2CC1 ZINC000613300279 940506944 /nfs/dbraw/zinc/50/69/44/940506944.db2.gz RCMAPUBPJWTMQW-UHFFFAOYSA-N 0 0 355.394 3.550 20 5 FHBDRN C[C@H]1CN(c2ccc([N+](=O)[O-])c(OCc3ccccc3)n2)CC2(CCC2)O1 ZINC000581605141 940509972 /nfs/dbraw/zinc/50/99/72/940509972.db2.gz PDMWMYIDYWYIEC-HNNXBMFYSA-N 0 0 369.421 3.717 20 5 FHBDRN CC(=O)Nc1cc(Cl)ccc1NC(=O)[C@@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1 ZINC001125810091 940512061 /nfs/dbraw/zinc/51/20/61/940512061.db2.gz MFRVGGIAMVSCJP-HUUCEWRRSA-N 0 0 373.796 3.949 20 5 FHBDRN CC(=O)Nc1cc(Cl)ccc1NC(=O)[C@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1 ZINC001125810088 940512071 /nfs/dbraw/zinc/51/20/71/940512071.db2.gz MFRVGGIAMVSCJP-CABCVRRESA-N 0 0 373.796 3.949 20 5 FHBDRN CC(=O)Nc1cc(C(=O)Oc2cc(Cl)ccc2[N+](=O)[O-])ccc1F ZINC000124778054 945328589 /nfs/dbraw/zinc/32/85/89/945328589.db2.gz VFQRHSZTKVACLK-UHFFFAOYSA-N 0 0 352.705 3.565 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1cc(C2CCCCC2)nn1C ZINC000427384592 945329938 /nfs/dbraw/zinc/32/99/38/945329938.db2.gz OQRCKMYLMBNWRW-UHFFFAOYSA-N 0 0 358.398 3.637 20 5 FHBDRN CCC[C@H](C)c1cc(NC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)n[nH]1 ZINC000173333887 940610730 /nfs/dbraw/zinc/61/07/30/940610730.db2.gz UHCFBRQSNWWQLF-LBPRGKRZSA-N 0 0 368.397 3.660 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)N2CC[C@@H](Cc3ccc(C(C)C)cc3)C2)n1 ZINC000427388874 945334828 /nfs/dbraw/zinc/33/48/28/945334828.db2.gz CHWMDXJMPSRLCS-INIZCTEOSA-N 0 0 370.453 3.639 20 5 FHBDRN Cc1cccc(C)c1CC(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000582026229 940642849 /nfs/dbraw/zinc/64/28/49/940642849.db2.gz YKELYVICGYZCSW-UHFFFAOYSA-N 0 0 351.406 3.594 20 5 FHBDRN COc1ccc(CNC(=O)N2CCC[C@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000431815504 940645035 /nfs/dbraw/zinc/64/50/35/940645035.db2.gz YXTRELBUCORHCU-KRWDZBQOSA-N 0 0 369.421 3.693 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CCc2sc(Cl)cc2C1 ZINC000582060601 940645119 /nfs/dbraw/zinc/64/51/19/940645119.db2.gz RSZKIHADDUOGGF-UHFFFAOYSA-N 0 0 365.842 3.615 20 5 FHBDRN CSCc1ccc(NC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)cc1 ZINC000066551916 940646865 /nfs/dbraw/zinc/64/68/65/940646865.db2.gz XQKWBDFHODAYPU-UHFFFAOYSA-N 0 0 368.418 3.896 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2noc([C@@H]3CCN(c4ccccc4F)C3)n2)s1 ZINC000582163926 940647578 /nfs/dbraw/zinc/64/75/78/940647578.db2.gz NEVSXRWXUYTMSP-SNVBAGLBSA-N 0 0 360.370 3.839 20 5 FHBDRN CC(=O)c1cc(NCc2ccc(-n3nc(C)cc3C)nc2)ccc1[N+](=O)[O-] ZINC000582136497 940649784 /nfs/dbraw/zinc/64/97/84/940649784.db2.gz QKTVWHRPVQIPEY-UHFFFAOYSA-N 0 0 365.393 3.607 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)F)cc1N1CCC[C@H](OCC(F)(F)F)C1 ZINC000582160007 940651342 /nfs/dbraw/zinc/65/13/42/940651342.db2.gz BTCACXDHHXISAR-QMMMGPOBSA-N 0 0 373.253 3.556 20 5 FHBDRN COc1cc(C(=O)N2CC[C@@H](c3ccc(C)cc3)C2)c([N+](=O)[O-])cc1F ZINC000582162673 940652811 /nfs/dbraw/zinc/65/28/11/940652811.db2.gz JNQCIPKMVVTIAT-CQSZACIVSA-N 0 0 358.369 3.681 20 5 FHBDRN O=[N+]([O-])c1ccc(Cc2noc(C3(Cc4ccccc4Cl)CC3)n2)nc1 ZINC000582267324 940658063 /nfs/dbraw/zinc/65/80/63/940658063.db2.gz MFHXRFOIXPBEKG-UHFFFAOYSA-N 0 0 370.796 3.891 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)Nc2ccc(-c3nc[nH]n3)cc2)cc1[N+](=O)[O-] ZINC000111092160 945338190 /nfs/dbraw/zinc/33/81/90/945338190.db2.gz KPPVXNCJXHIFEV-UHFFFAOYSA-N 0 0 365.393 3.930 20 5 FHBDRN COC(=O)c1cc(C)nc(N2C[C@H](C)C[C@@H]2c2ccccc2F)c1[N+](=O)[O-] ZINC000582292937 940663894 /nfs/dbraw/zinc/66/38/94/940663894.db2.gz SZROAQWXYHJAMJ-BDJLRTHQSA-N 0 0 373.384 3.811 20 5 FHBDRN Cn1ccnc1[C@@H](N[C@H]1CCc2c1cccc2[N+](=O)[O-])c1ccc(F)cc1 ZINC000582496704 940674815 /nfs/dbraw/zinc/67/48/15/940674815.db2.gz IRCATCWDXXTZKW-HKUYNNGSSA-N 0 0 366.396 3.834 20 5 FHBDRN O=C(c1nnc2ccccc2n1)N(c1cccc([N+](=O)[O-])c1)C1CCCC1 ZINC001125819200 940701221 /nfs/dbraw/zinc/70/12/21/940701221.db2.gz YEMWAEVSXVWIKG-UHFFFAOYSA-N 0 0 363.377 3.522 20 5 FHBDRN C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1ccc(N2CCCC2)c(F)c1 ZINC000106614768 945343097 /nfs/dbraw/zinc/34/30/97/945343097.db2.gz UXTRAABYIBNJCE-ZDUSSCGKSA-N 0 0 369.396 3.926 20 5 FHBDRN CCc1c(C(=O)Nc2ccc([N+](=O)[O-])cc2)cnn1-c1ccccc1C ZINC000472544606 940724951 /nfs/dbraw/zinc/72/49/51/940724951.db2.gz FJWHVVUOCYHKGE-UHFFFAOYSA-N 0 0 350.378 3.904 20 5 FHBDRN Cc1sc(Br)c(C(=O)N(C)c2ccc([N+](=O)[O-])nc2)c1C ZINC000582569930 940729585 /nfs/dbraw/zinc/72/95/85/940729585.db2.gz QFZKJDPZXZRTNM-UHFFFAOYSA-N 0 0 370.228 3.707 20 5 FHBDRN C[C@H]1N(C(=O)c2c([N+](=O)[O-])cccc2C(F)(F)F)CCC12CCOCC2 ZINC000582575077 940734037 /nfs/dbraw/zinc/73/40/37/940734037.db2.gz RLHWMODGLSBCGW-LLVKDONJSA-N 0 0 372.343 3.645 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)OCc2ccc(Cl)nc2)cc1SC ZINC000728650827 940752684 /nfs/dbraw/zinc/75/26/84/940752684.db2.gz LAPAQWIYXZAQMG-UHFFFAOYSA-N 0 0 368.798 3.731 20 5 FHBDRN O=C(OCc1csc(-c2ccccn2)n1)c1ccc(F)cc1[N+](=O)[O-] ZINC000124903095 945347346 /nfs/dbraw/zinc/34/73/46/945347346.db2.gz OEJLKWGYEBOALD-UHFFFAOYSA-N 0 0 359.338 3.609 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccnn1-c1ccc(Cl)cc1 ZINC000174821736 940780466 /nfs/dbraw/zinc/78/04/66/940780466.db2.gz BJUZFNLONCKZKW-UHFFFAOYSA-N 0 0 356.769 3.995 20 5 FHBDRN Cc1ccc([C@@H](C)N(C)C(=O)C(=O)Nc2cc(F)cc([N+](=O)[O-])c2)c(C)c1 ZINC000472556783 940782123 /nfs/dbraw/zinc/78/21/23/940782123.db2.gz PJOLYQPPUPKAAG-CYBMUJFWSA-N 0 0 373.384 3.509 20 5 FHBDRN Cc1nc(C(C)(C)NC(=O)Nc2cc(F)cc([N+](=O)[O-])c2)sc1C ZINC000470123845 940785429 /nfs/dbraw/zinc/78/54/29/940785429.db2.gz XVWAWMATPQIKEO-UHFFFAOYSA-N 0 0 352.391 3.864 20 5 FHBDRN O=c1onc(-c2cccs2)n1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000549041911 940815186 /nfs/dbraw/zinc/81/51/86/940815186.db2.gz ZDCUJSWGOUXZLM-UHFFFAOYSA-N 0 0 371.296 3.540 20 5 FHBDRN CCC(CC)(NC(=O)c1c([N+](=O)[O-])c(C)nn1C)c1ccc(Cl)cc1 ZINC000170802387 940824109 /nfs/dbraw/zinc/82/41/09/940824109.db2.gz DYNWPKIIMVEROG-UHFFFAOYSA-N 0 0 364.833 3.735 20 5 FHBDRN C[C@@H](NC(=O)c1ccc(Br)cc1[N+](=O)[O-])c1cccc(O)c1 ZINC000175214324 940827235 /nfs/dbraw/zinc/82/72/35/940827235.db2.gz VDGKRRFNHPUPRX-SECBINFHSA-N 0 0 365.183 3.554 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N(Cc2ccccc2)CC(F)F)c1 ZINC000175402190 940864873 /nfs/dbraw/zinc/86/48/73/940864873.db2.gz AYMKYTPCROMIMM-UHFFFAOYSA-N 0 0 350.321 3.511 20 5 FHBDRN O=[N+]([O-])c1cc(I)ccc1N[C@@H]1CCC(F)(F)C1 ZINC000310804030 940865287 /nfs/dbraw/zinc/86/52/87/940865287.db2.gz HINXNKFYQYOIBQ-MRVPVSSYSA-N 0 0 368.121 3.799 20 5 FHBDRN O=C(N[C@H]1CCO[C@H]1c1ccc(Cl)c(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000180246494 940875325 /nfs/dbraw/zinc/87/53/25/940875325.db2.gz RQWFYSYAJCICOU-HOTGVXAUSA-N 0 0 364.760 3.647 20 5 FHBDRN O=C(N[C@H]1CCCc2occc21)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000180251819 940876321 /nfs/dbraw/zinc/87/63/21/940876321.db2.gz WTUXHAYZSFGZFC-LBPRGKRZSA-N 0 0 352.293 3.597 20 5 FHBDRN Cc1c(NC(=O)[C@H](C)Nc2ccc3c(c2)C(=O)CCC3)cccc1[N+](=O)[O-] ZINC000175517245 940882585 /nfs/dbraw/zinc/88/25/85/940882585.db2.gz APTQPBNZIXRGKE-ZDUSSCGKSA-N 0 0 367.405 3.861 20 5 FHBDRN O=C(N[C@@H]1CCO[C@@H]1c1ccc(Cl)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000180257473 940884802 /nfs/dbraw/zinc/88/48/02/940884802.db2.gz PJWXNVDBNLUPOV-HZPDHXFCSA-N 0 0 364.760 3.647 20 5 FHBDRN COC(=O)c1cc(C(=O)N2CC[C@@H](C)C[C@H]2c2ccco2)cc([N+](=O)[O-])c1 ZINC000175650771 940903117 /nfs/dbraw/zinc/90/31/17/940903117.db2.gz VWZNUDPZCOCGEB-WBMJQRKESA-N 0 0 372.377 3.588 20 5 FHBDRN C[C@@H](NC(=O)c1c(F)cccc1Br)c1cccc([N+](=O)[O-])c1 ZINC000175638848 940906312 /nfs/dbraw/zinc/90/63/12/940906312.db2.gz ZWOQUJOWFHKGRZ-SECBINFHSA-N 0 0 367.174 3.987 20 5 FHBDRN COc1cc(C(=O)N[C@@H](C)c2nc(C(C)(C)C)cs2)ccc1[N+](=O)[O-] ZINC000106677520 945359619 /nfs/dbraw/zinc/35/96/19/945359619.db2.gz IWCCDLROEZYCGC-JTQLQIEISA-N 0 0 363.439 3.848 20 5 FHBDRN CC(=O)c1cc([N+](=O)[O-])ccc1N1CCC2(CC1)OCc1ccccc12 ZINC000376402068 940916631 /nfs/dbraw/zinc/91/66/31/940916631.db2.gz GIQMHTSZNGFQGV-UHFFFAOYSA-N 0 0 352.390 3.823 20 5 FHBDRN COc1cc(S(=O)(=O)Nc2cc(C)c(F)cc2Cl)ccc1[N+](=O)[O-] ZINC000507599179 945360976 /nfs/dbraw/zinc/36/09/76/945360976.db2.gz AEPKEIPVCMYSDY-UHFFFAOYSA-N 0 0 374.777 3.505 20 5 FHBDRN C[C@H]1c2ccccc2CCN1C(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000170957221 940935785 /nfs/dbraw/zinc/93/57/85/940935785.db2.gz TYDLVMYUIXKAJN-AWEZNQCLSA-N 0 0 362.389 3.540 20 5 FHBDRN Cc1csc([C@H](C)CNC(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)n1 ZINC000186077667 940941377 /nfs/dbraw/zinc/94/13/77/940941377.db2.gz JOOBXTZFBYWWKY-KOLCDFICSA-N 0 0 351.403 3.522 20 5 FHBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)Nc1cccc(Oc2cccnn2)c1 ZINC000255901751 940954832 /nfs/dbraw/zinc/95/48/32/940954832.db2.gz PNSFLESIGGAOIS-FLIBITNWSA-N 0 0 362.345 3.829 20 5 FHBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)Oc1cccc(Oc2ncccn2)c1 ZINC000255906450 940964067 /nfs/dbraw/zinc/96/40/67/940964067.db2.gz ADYPGEUNIKMDNC-YFHOEESVSA-N 0 0 363.329 3.796 20 5 FHBDRN C[C@H](CCc1ccccc1[N+](=O)[O-])Nc1cccc([C@H]2CCC(=O)N2)c1 ZINC000414320780 940965967 /nfs/dbraw/zinc/96/59/67/940965967.db2.gz SYNGZXLBGDVGNT-RDTXWAMCSA-N 0 0 353.422 3.979 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N1c2ccccc2[C@@H](C)CC1(C)C ZINC000180325578 940972757 /nfs/dbraw/zinc/97/27/57/940972757.db2.gz YKXKJPZFSCRXJW-ZDUSSCGKSA-N 0 0 356.426 3.809 20 5 FHBDRN COc1ccc(C[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1OC ZINC000180328919 940973047 /nfs/dbraw/zinc/97/30/47/940973047.db2.gz INUJTTOKEPNLTI-LBPRGKRZSA-N 0 0 358.394 3.738 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)N1CCC[C@H]1[C@@H]1CCCCC1=O ZINC000176155142 940999158 /nfs/dbraw/zinc/99/91/58/940999158.db2.gz QZCNOPYCUQVBGW-ROUUACIJSA-N 0 0 373.453 3.537 20 5 FHBDRN Cc1ccc2nc(NC(=O)CN[C@@H](C)c3cccc([N+](=O)[O-])c3)sc2c1 ZINC000180457675 941022287 /nfs/dbraw/zinc/02/22/87/941022287.db2.gz IGLGCMUUKWJMLO-LBPRGKRZSA-N 0 0 370.434 3.802 20 5 FHBDRN Cc1ccc2c(n1)OCCN2C(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000180468489 941023830 /nfs/dbraw/zinc/02/38/30/941023830.db2.gz IBAPBTYYANQTJR-UHFFFAOYSA-N 0 0 355.394 3.635 20 5 FHBDRN Cc1cc(C)n([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)n1 ZINC000180468123 941023886 /nfs/dbraw/zinc/02/38/86/941023886.db2.gz FQUKQPBCNQRBNR-SNVBAGLBSA-N 0 0 356.304 3.627 20 5 FHBDRN O=[N+]([O-])c1ccccc1-c1ccc(CN2CCO[C@@H]([C@@H]3CCCO3)C2)s1 ZINC000180563010 941048129 /nfs/dbraw/zinc/04/81/29/941048129.db2.gz UQMZYXBWAZHTMM-ZWKOTPCHSA-N 0 0 374.462 3.703 20 5 FHBDRN CO[C@H](C)c1nc(C)c(C(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)s1 ZINC000176497182 941055172 /nfs/dbraw/zinc/05/51/72/941055172.db2.gz AMHPPZVOJGLQIC-LLVKDONJSA-N 0 0 363.439 3.732 20 5 FHBDRN O=C(N[C@H]1CC12CCCCC2)c1cc([N+](=O)[O-])ccc1Br ZINC000180680804 941063756 /nfs/dbraw/zinc/06/37/56/941063756.db2.gz 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ZINC000180804984 941079857 /nfs/dbraw/zinc/07/98/57/941079857.db2.gz LUBWJESTVCKDIR-UHFFFAOYSA-N 0 0 352.293 3.847 20 5 FHBDRN Nc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(OC2CCCC2)c(F)c1 ZINC000180821260 941081023 /nfs/dbraw/zinc/08/10/23/941081023.db2.gz LYNQJOGIMJKYRC-UHFFFAOYSA-N 0 0 359.357 3.890 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)NC1CCC(c2ccc(F)cc2)CC1 ZINC000541002231 941085070 /nfs/dbraw/zinc/08/50/70/941085070.db2.gz FOUDLVYRKGOCKA-UHFFFAOYSA-N 0 0 372.396 3.955 20 5 FHBDRN Cn1c(SCc2nc3cc([N+](=O)[O-])ccc3o2)nnc1-c1cccs1 ZINC000176936380 941086307 /nfs/dbraw/zinc/08/63/07/941086307.db2.gz RJQPQUNWSSCRRZ-UHFFFAOYSA-N 0 0 373.419 3.885 20 5 FHBDRN CN(Cc1cc(Cl)cc(Cl)c1)C(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000180945604 941095170 /nfs/dbraw/zinc/09/51/70/941095170.db2.gz BZPNQSDYFPEKSW-UHFFFAOYSA-N 0 0 354.193 3.756 20 5 FHBDRN CCC(=O)Nc1ccc(NC(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)cc1 ZINC000188829249 941098465 /nfs/dbraw/zinc/09/84/65/941098465.db2.gz XLSNPSJXGDUVGU-UHFFFAOYSA-N 0 0 357.366 3.513 20 5 FHBDRN COc1ccc2oc([C@H](C)NC(=O)c3c(N)cccc3[N+](=O)[O-])c(C)c2c1 ZINC000181050710 941106031 /nfs/dbraw/zinc/10/60/31/941106031.db2.gz GOZPUIIORCLQJR-NSHDSACASA-N 0 0 369.377 3.731 20 5 FHBDRN Cc1n[nH]c(C)c1[C@@H]1CCCN1C(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000181044686 941106074 /nfs/dbraw/zinc/10/60/74/941106074.db2.gz NWUYJJBEBWKSFJ-LRDDRELGSA-N 0 0 371.441 3.851 20 5 FHBDRN Nc1cccc([N+](=O)[O-])c1C(=O)NCCCc1ccc(Cl)cc1Cl ZINC000181151397 941109095 /nfs/dbraw/zinc/10/90/95/941109095.db2.gz VDGCTHLLJPSUFQ-UHFFFAOYSA-N 0 0 368.220 3.846 20 5 FHBDRN Cc1cc(NC(=O)c2c(N)cccc2[N+](=O)[O-])ccc1OCC(F)(F)F ZINC000181106059 941109561 /nfs/dbraw/zinc/10/95/61/941109561.db2.gz FWXQZFXQUCDCGJ-UHFFFAOYSA-N 0 0 369.299 3.679 20 5 FHBDRN Cc1ccc(CNC(=O)c2c(N)cccc2[N+](=O)[O-])c(OC(C)(C)C)c1 ZINC000181176414 941112020 /nfs/dbraw/zinc/11/20/20/941112020.db2.gz DDRGFCHOVZHZCY-UHFFFAOYSA-N 0 0 357.410 3.593 20 5 FHBDRN CC[C@H](C)Oc1cc(C)ccc1CNC(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000181183502 941112383 /nfs/dbraw/zinc/11/23/83/941112383.db2.gz CZCWSZICGVTHCO-ZDUSSCGKSA-N 0 0 357.410 3.593 20 5 FHBDRN O=C(N[C@@H]1[C@H]2CCc3ccccc3[C@@H]12)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000541031062 941112735 /nfs/dbraw/zinc/11/27/35/941112735.db2.gz OSOZRSIFJHQWKC-IAOVAPTHSA-N 0 0 374.343 3.654 20 5 FHBDRN CCOc1ccc(NS(=O)(=O)c2c(C)ccc(C)c2[N+](=O)[O-])c(F)c1 ZINC000414419079 941120064 /nfs/dbraw/zinc/12/00/64/941120064.db2.gz ZNUJSGIKZHZALX-UHFFFAOYSA-N 0 0 368.386 3.550 20 5 FHBDRN COc1ccc(OC(=O)CCc2ccc(OC(F)F)cc2)c([N+](=O)[O-])c1 ZINC000122176133 941120437 /nfs/dbraw/zinc/12/04/37/941120437.db2.gz LOXQFGCAAVVKRE-UHFFFAOYSA-N 0 0 367.304 3.743 20 5 FHBDRN Cc1cc(NC(=O)c2c(N)cccc2[N+](=O)[O-])nn1-c1ccccc1Cl ZINC000181321193 941121282 /nfs/dbraw/zinc/12/12/82/941121282.db2.gz IPVRPLHRVMIZEE-UHFFFAOYSA-N 0 0 371.784 3.577 20 5 FHBDRN Cc1coc(-c2cccc(NC(=O)c3cc4c(c([N+](=O)[O-])c3)OCO4)c2)n1 ZINC000181324701 941122093 /nfs/dbraw/zinc/12/20/93/941122093.db2.gz WXTQQVPHXOSENX-UHFFFAOYSA-N 0 0 367.317 3.539 20 5 FHBDRN Cc1cc2c(cc1NC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)OCO2 ZINC000181333877 941122966 /nfs/dbraw/zinc/12/29/66/941122966.db2.gz BFHZWRJZEBLSPT-UHFFFAOYSA-N 0 0 368.267 3.903 20 5 FHBDRN C[C@]1(C(=O)N2CCc3c(Br)ccc([N+](=O)[O-])c3C2)C=CCC1 ZINC000935875390 941127136 /nfs/dbraw/zinc/12/71/36/941127136.db2.gz KYFBBILMORNRIU-INIZCTEOSA-N 0 0 365.227 3.598 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)COc1cc(Cl)cc(Cl)c1 ZINC000014734595 941131641 /nfs/dbraw/zinc/13/16/41/941131641.db2.gz BXVVDXKTCKHUPH-UHFFFAOYSA-N 0 0 371.176 3.928 20 5 FHBDRN COC(=O)c1c(C2CC2)csc1NC(=O)c1cc([N+](=O)[O-])ccc1C ZINC000177518854 941132012 /nfs/dbraw/zinc/13/20/12/941132012.db2.gz FLEOGHLGRFIARO-UHFFFAOYSA-N 0 0 360.391 3.881 20 5 FHBDRN COC(=O)c1cc(CN(C)C(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)oc1C ZINC000188948802 941133000 /nfs/dbraw/zinc/13/30/00/941133000.db2.gz WYMKZROASVLDRB-UHFFFAOYSA-N 0 0 374.393 3.678 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CCO[C@@H](c2cccc(F)c2)C1 ZINC000066694587 941143506 /nfs/dbraw/zinc/14/35/06/941143506.db2.gz HROPBRUQHVOXAC-MRXNPFEDSA-N 0 0 364.760 3.601 20 5 FHBDRN CCSc1cc(CNC(=O)CSc2ccc([N+](=O)[O-])cc2)ccn1 ZINC000189098385 941145482 /nfs/dbraw/zinc/14/54/82/941145482.db2.gz LADCZZNLIKDOHF-UHFFFAOYSA-N 0 0 363.464 3.510 20 5 FHBDRN CCCc1[nH]nc(C(=O)Nc2ccc3c(c2)OC(CC)(CC)O3)c1[N+](=O)[O-] ZINC000189077774 941146592 /nfs/dbraw/zinc/14/65/92/941146592.db2.gz FMAFORCLUIMOQE-UHFFFAOYSA-N 0 0 374.397 3.810 20 5 FHBDRN COc1ccc(C(=O)N2CCCc3c([N+](=O)[O-])cccc32)c(OC(C)C)c1 ZINC000189080020 941146621 /nfs/dbraw/zinc/14/66/21/941146621.db2.gz UBHSROPMDABQOT-UHFFFAOYSA-N 0 0 370.405 3.984 20 5 FHBDRN COCCCOc1ccc(C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000177728347 941147246 /nfs/dbraw/zinc/14/72/46/941147246.db2.gz QSGPRKUAEQDVCL-OAHLLOKOSA-N 0 0 372.421 3.810 20 5 FHBDRN COc1ccc(C(=O)Nc2ccc([N+](=O)[O-])c(C)c2)c(OC(F)F)c1 ZINC000189142472 941147307 /nfs/dbraw/zinc/14/73/07/941147307.db2.gz HMDWMTCASNXIMR-UHFFFAOYSA-N 0 0 352.293 3.766 20 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/nfs/dbraw/zinc/15/74/32/941157432.db2.gz CFACRKIUIDWVOS-UHFFFAOYSA-N 0 0 371.824 3.641 20 5 FHBDRN COC[C@@H](Cc1ccccc1)N(C)C(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000189498429 941159325 /nfs/dbraw/zinc/15/93/25/941159325.db2.gz IPGZXGSGUJPNRX-QGZVFWFLSA-N 0 0 362.813 3.578 20 5 FHBDRN COc1ccc(NC(=O)N(C)Cc2ccccc2[N+](=O)[O-])c2cccnc12 ZINC000178134418 941159644 /nfs/dbraw/zinc/15/96/44/941159644.db2.gz POZBWYGUPJJDJA-UHFFFAOYSA-N 0 0 366.377 3.816 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1)C(=O)NC1CCC2(CCCCC2)CC1 ZINC000189630811 941232321 /nfs/dbraw/zinc/23/23/21/941232321.db2.gz IITQONLGEBOBMT-UHFFFAOYSA-N 0 0 359.426 3.543 20 5 FHBDRN CC(C)c1ccc(C(=O)Nc2cc(-c3cccnc3)[nH]n2)cc1[N+](=O)[O-] ZINC000189682940 941255232 /nfs/dbraw/zinc/25/52/32/941255232.db2.gz FIBSSDYYASNTKG-UHFFFAOYSA-N 0 0 351.366 3.756 20 5 FHBDRN CCOc1cccc2[nH]cc(CC(=O)Nc3ccc([N+](=O)[O-])c(C)c3)c21 ZINC000189764017 941273882 /nfs/dbraw/zinc/27/38/82/941273882.db2.gz BEAZJLMJBDHBHN-UHFFFAOYSA-N 0 0 353.378 3.964 20 5 FHBDRN COc1ccc(CNc2cccc(C(=O)OC(C)(C)C)n2)cc1[N+](=O)[O-] ZINC000549106082 941287022 /nfs/dbraw/zinc/28/70/22/941287022.db2.gz LJMASUXEDOPRGY-UHFFFAOYSA-N 0 0 359.382 3.566 20 5 FHBDRN Cc1ccc(-n2cccn2)cc1N[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000189840201 941287034 /nfs/dbraw/zinc/28/70/34/941287034.db2.gz AVCMVCAIKPODHR-CQSZACIVSA-N 0 0 365.393 3.528 20 5 FHBDRN COc1ccc(C(=O)N2C[C@H](C)Oc3c(Cl)cccc32)cc1[N+](=O)[O-] ZINC000189847829 941288333 /nfs/dbraw/zinc/28/83/33/941288333.db2.gz FYLAMZXQCWDEBP-JTQLQIEISA-N 0 0 362.769 3.685 20 5 FHBDRN Cc1c(CC(=O)N2CCC(COc3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000178687680 941292372 /nfs/dbraw/zinc/29/23/72/941292372.db2.gz XCBXKRFUQFFKEP-UHFFFAOYSA-N 0 0 368.433 3.763 20 5 FHBDRN CCN(Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C[C@H](O)C(F)(F)F ZINC000189874851 941292796 /nfs/dbraw/zinc/29/27/96/941292796.db2.gz FSXMICDXFGEQHV-HNNXBMFYSA-N 0 0 358.316 3.600 20 5 FHBDRN O=C(Nc1cnc2ccccc2n1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000178668818 941293961 /nfs/dbraw/zinc/29/39/61/941293961.db2.gz HODZHVUMQUEUCN-UHFFFAOYSA-N 0 0 362.267 3.809 20 5 FHBDRN COC[C@H](Cc1ccccc1)N(C)C(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000189902723 941296966 /nfs/dbraw/zinc/29/69/66/941296966.db2.gz QCDRBAKGGMHECI-KRWDZBQOSA-N 0 0 357.410 3.625 20 5 FHBDRN C[C@H]1C[C@H]1N(c1ccccc1)S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000414473035 941298313 /nfs/dbraw/zinc/29/83/13/941298313.db2.gz PRJBCPUZRQIMFE-XHDPSFHLSA-N 0 0 366.826 3.852 20 5 FHBDRN COc1cc(-c2noc(CN(C)Cc3ccccc3[N+](=O)[O-])n2)ccc1C ZINC000178774984 941302536 /nfs/dbraw/zinc/30/25/36/941302536.db2.gz MAXWSNOUZRPSGE-UHFFFAOYSA-N 0 0 368.393 3.594 20 5 FHBDRN Cc1c2ccccc2c(=O)oc1C(=O)N1CCCc2ccc([N+](=O)[O-])cc21 ZINC001125848201 941336275 /nfs/dbraw/zinc/33/62/75/941336275.db2.gz IYVYGJJTNJYWGF-UHFFFAOYSA-N 0 0 364.357 3.603 20 5 FHBDRN Cn1c(COc2c(Br)cccc2[N+](=O)[O-])nc2ccccc21 ZINC000179115789 941336557 /nfs/dbraw/zinc/33/65/57/941336557.db2.gz BCPJDTMRDITRME-UHFFFAOYSA-N 0 0 362.183 3.823 20 5 FHBDRN CC(C)[C@H]1CCCC[C@H]1NC(=O)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000103326267 941353230 /nfs/dbraw/zinc/35/32/30/941353230.db2.gz PVDYFGVZNRKDLV-TZMCWYRMSA-N 0 0 367.833 3.518 20 5 FHBDRN Cc1ccc(C(=O)O[C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])cc1Cl ZINC000728675895 941364857 /nfs/dbraw/zinc/36/48/57/941364857.db2.gz XAGQZARXPSTQBG-NSHDSACASA-N 0 0 362.769 3.741 20 5 FHBDRN Cc1ccc(S(=O)(=O)Oc2cccc(Cl)c2Cl)cc1[N+](=O)[O-] ZINC000023861929 941365925 /nfs/dbraw/zinc/36/59/25/941365925.db2.gz QSNRKUGGZRRLEW-UHFFFAOYSA-N 0 0 362.190 3.978 20 5 FHBDRN CCOC(=O)C1(CNc2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])CC1 ZINC000472647599 941408610 /nfs/dbraw/zinc/40/86/10/941408610.db2.gz FIBSAJREWGBHQC-UHFFFAOYSA-N 0 0 368.389 3.581 20 5 FHBDRN Cc1nc([C@@H]2CCCCN2c2ccc([N+](=O)[O-])c(OC(F)F)c2)no1 ZINC000376812011 941440037 /nfs/dbraw/zinc/44/00/37/941440037.db2.gz UKRUPNXLIMWZNY-LBPRGKRZSA-N 0 0 354.313 3.619 20 5 FHBDRN O=C(Nc1cnc(-c2ccccc2)nc1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000110186763 941454217 /nfs/dbraw/zinc/45/42/17/941454217.db2.gz NBMSOGGRIDELRQ-UHFFFAOYSA-N 0 0 354.753 3.958 20 5 FHBDRN CCC(=O)c1ccc(-c2nc(CCNc3ccccc3[N+](=O)[O-])no2)cc1 ZINC000472652905 941485225 /nfs/dbraw/zinc/48/52/25/941485225.db2.gz JXIREXDIXSQBEO-UHFFFAOYSA-N 0 0 366.377 3.892 20 5 FHBDRN COc1cccc(C(=O)N(C)C)c1OCc1ccc([N+](=O)[O-])cc1Cl ZINC000564017151 941488655 /nfs/dbraw/zinc/48/86/55/941488655.db2.gz IQYWFYAMIAKXNL-UHFFFAOYSA-N 0 0 364.785 3.538 20 5 FHBDRN CCOc1cc(NC(=O)c2cnn(C(C)C)c2Cl)ccc1[N+](=O)[O-] ZINC000892741600 941503445 /nfs/dbraw/zinc/50/34/45/941503445.db2.gz NYYLAHPHQVZTDI-UHFFFAOYSA-N 0 0 352.778 3.677 20 5 FHBDRN COc1cc2c(cc1F)CC[C@H]2NC(=O)Nc1ccc(C)c([N+](=O)[O-])c1 ZINC000549153297 941546066 /nfs/dbraw/zinc/54/60/66/941546066.db2.gz GYFZNBUAXNVYAU-OAHLLOKOSA-N 0 0 359.357 3.860 20 5 FHBDRN CC1=C(c2ccco2)CN(Cc2cc([N+](=O)[O-])cc3c2OCOC3)CC1 ZINC000549159519 941557765 /nfs/dbraw/zinc/55/77/65/941557765.db2.gz WNDMCVVBFOZYDD-UHFFFAOYSA-N 0 0 356.378 3.734 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H](c1ccccc1)c1cccnc1 ZINC000377209110 941562431 /nfs/dbraw/zinc/56/24/31/941562431.db2.gz VRXIRKQUVGJIEQ-IBGZPJMESA-N 0 0 363.373 3.518 20 5 FHBDRN Nc1c(C(=O)Nc2ccc(Oc3cccnc3)cc2)cccc1[N+](=O)[O-] ZINC000583236427 941582652 /nfs/dbraw/zinc/58/26/52/941582652.db2.gz XBZVRMQMNNBLLT-UHFFFAOYSA-N 0 0 350.334 3.617 20 5 FHBDRN Cc1cc(N2CCC[C@@H](c3nccn3C)C2)c2cccc([N+](=O)[O-])c2n1 ZINC000365547156 941587349 /nfs/dbraw/zinc/58/73/49/941587349.db2.gz ODISLKAOMAVDPP-CQSZACIVSA-N 0 0 351.410 3.569 20 5 FHBDRN Cc1ccc(C2CCN(C(=O)c3cc(F)c([N+](=O)[O-])cc3F)CC2)cn1 ZINC000377247831 941593064 /nfs/dbraw/zinc/59/30/64/941593064.db2.gz CNELUBQZTWSYRX-UHFFFAOYSA-N 0 0 361.348 3.596 20 5 FHBDRN COc1ccc(NC(=O)N[C@H](C)COc2cccc(C)c2)cc1[N+](=O)[O-] ZINC000541106438 941595907 /nfs/dbraw/zinc/59/59/07/941595907.db2.gz RVMMWGATSRSGRO-CYBMUJFWSA-N 0 0 359.382 3.501 20 5 FHBDRN CC(=O)Nc1cc(C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)ccc1C ZINC000153900498 941603153 /nfs/dbraw/zinc/60/31/53/941603153.db2.gz MLUZHLBEURYXEZ-UHFFFAOYSA-N 0 0 367.405 3.666 20 5 FHBDRN CC(=O)Nc1cccc(C(=O)N2CCCCc3cc([N+](=O)[O-])ccc32)c1 ZINC000892859578 941629256 /nfs/dbraw/zinc/62/92/56/941629256.db2.gz FRQRLRAZOCPJPS-UHFFFAOYSA-N 0 0 353.378 3.536 20 5 FHBDRN COc1cc(OCc2nc(Cc3ccc(C)s3)no2)ccc1[N+](=O)[O-] ZINC000565625590 941631866 /nfs/dbraw/zinc/63/18/66/941631866.db2.gz JJLJVPKUKQOMHO-UHFFFAOYSA-N 0 0 361.379 3.526 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]c(C(Cl)=Cc3cn(-c4ccccc4)nn3)nc2c1 ZINC000728700292 941689155 /nfs/dbraw/zinc/68/91/55/941689155.db2.gz NMHKWOLCBKKXLX-ZSOIEALJSA-N 0 0 366.768 3.789 20 5 FHBDRN Cc1c(NC(=O)N2CC[C@@H](c3ccccc3)[C@@H](CO)C2)cccc1[N+](=O)[O-] ZINC000377395237 941690117 /nfs/dbraw/zinc/69/01/17/941690117.db2.gz DFWJFMFTFYAUHQ-SJORKVTESA-N 0 0 369.421 3.533 20 5 FHBDRN Cn1cc([N+](=O)[O-])cc1C(=O)Nc1nc2c(ccc3ccccc23)s1 ZINC000024473930 941694402 /nfs/dbraw/zinc/69/44/02/941694402.db2.gz NPZJQPRBRAUPPR-UHFFFAOYSA-N 0 0 352.375 3.949 20 5 FHBDRN CCOc1ccc(C(=O)Nc2ccc(-c3cc[nH]n3)cc2)cc1[N+](=O)[O-] ZINC000063079583 941709027 /nfs/dbraw/zinc/70/90/27/941709027.db2.gz QDMBYIQJTQLFIY-UHFFFAOYSA-N 0 0 352.350 3.636 20 5 FHBDRN CCc1ccc(C(=O)N(C)[C@H](C)[C@@H]2Cc3ccccc3O2)cc1[N+](=O)[O-] ZINC000433555232 941738399 /nfs/dbraw/zinc/73/83/99/941738399.db2.gz OAHLRNQXUGFWIK-YJYMSZOUSA-N 0 0 354.406 3.621 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N(c2ccccn2)C2CCCC2)c1F ZINC000415310618 941749447 /nfs/dbraw/zinc/74/94/47/941749447.db2.gz WYAWAXOUOLWCJQ-UHFFFAOYSA-N 0 0 373.384 3.656 20 5 FHBDRN CCOC(=O)c1cc2cc(C(=O)Nc3ccc(C)c([N+](=O)[O-])c3)ccc2[nH]1 ZINC000024484938 941760905 /nfs/dbraw/zinc/76/09/05/941760905.db2.gz SFCBIHKETYUQNO-UHFFFAOYSA-N 0 0 367.361 3.814 20 5 FHBDRN O=C(Cc1noc2ccc(F)cc21)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000415334226 941761770 /nfs/dbraw/zinc/76/17/70/941761770.db2.gz XKHRGCUFQIOCBW-UHFFFAOYSA-N 0 0 369.352 3.609 20 5 FHBDRN CSCCN(C)[C@@H](C(=O)Nc1ccc(C)cc1[N+](=O)[O-])c1ccccc1 ZINC000151142727 941761825 /nfs/dbraw/zinc/76/18/25/941761825.db2.gz QLBGNJLUTBYTIG-GOSISDBHSA-N 0 0 373.478 3.878 20 5 FHBDRN Cc1ccc(C(=O)Nc2ccc([N+](=O)[O-])cc2C(=O)c2ccccc2)cn1 ZINC000073446454 941762187 /nfs/dbraw/zinc/76/21/87/941762187.db2.gz KIJSOZHNEJDVTG-UHFFFAOYSA-N 0 0 361.357 3.782 20 5 FHBDRN Cc1cc(NC[C@H](O)COc2ccc(C(F)(F)F)cc2)ccc1[N+](=O)[O-] ZINC000513173419 941766093 /nfs/dbraw/zinc/76/60/93/941766093.db2.gz JMEYWVALCUEQFU-AWEZNQCLSA-N 0 0 370.327 3.774 20 5 FHBDRN C[C@@H]([C@@H]1Cc2ccccc2O1)N(C)C(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000433565965 941767241 /nfs/dbraw/zinc/76/72/41/941767241.db2.gz XVVUXOZPDHCKIG-SGTLLEGYSA-N 0 0 366.373 3.805 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1C(F)(F)F)N1CCc2ccccc2C1 ZINC000549258683 941774683 /nfs/dbraw/zinc/77/46/83/941774683.db2.gz NPAZAGAKGQJSIN-UHFFFAOYSA-N 0 0 350.296 3.812 20 5 FHBDRN C[C@H]1CC(CCNc2ncc(Br)cc2[N+](=O)[O-])C[C@H](C)O1 ZINC000549261656 941785200 /nfs/dbraw/zinc/78/52/00/941785200.db2.gz UTEZYWVIVIHQBB-UWVGGRQHSA-N 0 0 358.236 3.758 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)NCc1ncc(-c2ccccc2)o1 ZINC000122571442 941798439 /nfs/dbraw/zinc/79/84/39/941798439.db2.gz XUZOQHGVMNHZMA-UHFFFAOYSA-N 0 0 352.350 3.880 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1N1CCCCC1)N1C[C@@H]2CCCC[C@@H]2C1 ZINC000178328751 941823926 /nfs/dbraw/zinc/82/39/26/941823926.db2.gz DEZKPFDAPPANKX-IYBDPMFKSA-N 0 0 357.454 3.847 20 5 FHBDRN O=C(NCCc1ccc(F)cc1Cl)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412135503 941829381 /nfs/dbraw/zinc/82/93/81/941829381.db2.gz YUTCOXPXVIWNAE-JKSUJKDBSA-N 0 0 362.788 3.850 20 5 FHBDRN Cc1c(C[S@](C)=O)cccc1NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412138679 941833534 /nfs/dbraw/zinc/83/35/34/941833534.db2.gz STZJTHQJCXAXJK-ZDXGUKGBSA-N 0 0 372.446 3.524 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CCOC3(CCCCC3)C2)ccc1[N+](=O)[O-] ZINC000412139628 941834219 /nfs/dbraw/zinc/83/42/19/941834219.db2.gz AIYROPHIBOLBFU-UHFFFAOYSA-N 0 0 362.426 3.557 20 5 FHBDRN Nc1ccc(S[C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)c(Cl)c1 ZINC000513296929 941834781 /nfs/dbraw/zinc/83/47/81/941834781.db2.gz MGDHHVLFMQUKBV-OAHLLOKOSA-N 0 0 363.826 3.728 20 5 FHBDRN COCCOc1cccc(C(=O)Nc2cc([N+](=O)[O-])c(Cl)cc2C)c1 ZINC000118687171 941842190 /nfs/dbraw/zinc/84/21/90/941842190.db2.gz GWZYMJLDHGOHAB-UHFFFAOYSA-N 0 0 364.785 3.834 20 5 FHBDRN COCc1nc(CNc2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)cs1 ZINC000517448693 941842939 /nfs/dbraw/zinc/84/29/39/941842939.db2.gz HTEPVANXNLWXLA-UHFFFAOYSA-N 0 0 351.428 3.987 20 5 FHBDRN CO[C@H](CNC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)c1cccc(Cl)c1 ZINC000412150002 941845806 /nfs/dbraw/zinc/84/58/06/941845806.db2.gz KCEFUMBIDRMSCS-RCCFBDPRSA-N 0 0 374.824 3.856 20 5 FHBDRN CC(C)Oc1ccc([C@@H](C)NC(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])cc1 ZINC000433708457 941851732 /nfs/dbraw/zinc/85/17/32/941851732.db2.gz RHVYITWFVUYWCM-GFCCVEGCSA-N 0 0 360.414 3.720 20 5 FHBDRN C[C@H](CNC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1F ZINC000412164073 941857201 /nfs/dbraw/zinc/85/72/01/941857201.db2.gz VXNHMWPIJNLIOW-ZTFRIQLXSA-N 0 0 360.360 3.896 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N2CCC[C@H](C(C)C)CC2)cc1OC ZINC000513335404 941859795 /nfs/dbraw/zinc/85/97/95/941859795.db2.gz OWTZPSVRRDVYND-AWEZNQCLSA-N 0 0 364.442 3.900 20 5 FHBDRN O=C(NC[C@@H]1SCCc2ccccc21)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412171613 941861194 /nfs/dbraw/zinc/86/11/94/941861194.db2.gz UNLIROBMYQZSOM-OTWHNJEPSA-N 0 0 368.458 3.845 20 5 FHBDRN CC(C)[C@@H](CNC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)c1cccnc1 ZINC000412171944 941861596 /nfs/dbraw/zinc/86/15/96/941861596.db2.gz FLIAQQQAGOTLSE-IPMKNSEASA-N 0 0 353.422 3.649 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CCS[C@H]3CCCC[C@@H]32)ccc1[N+](=O)[O-] ZINC000412175803 941864228 /nfs/dbraw/zinc/86/42/28/941864228.db2.gz PBIKQQWBZVOGMO-RDJZCZTQSA-N 0 0 364.467 3.882 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N1CCOc2c(Cl)cccc21 ZINC000472819730 941865209 /nfs/dbraw/zinc/86/52/09/941865209.db2.gz UIUUBUGVJRTXLA-UHFFFAOYSA-N 0 0 367.188 3.870 20 5 FHBDRN CC(C)C[C@@H]1CCC(=O)N(Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1=O ZINC000119216770 941870790 /nfs/dbraw/zinc/87/07/90/941870790.db2.gz GFDDYUJDKPPXBE-AWEZNQCLSA-N 0 0 371.393 3.561 20 5 FHBDRN C[C@@H](NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)c1ccncc1F ZINC000513399524 941896417 /nfs/dbraw/zinc/89/64/17/941896417.db2.gz NFVFOZLBYHTZSW-SNVBAGLBSA-N 0 0 372.381 3.743 20 5 FHBDRN Cc1cc(N2CCC[C@@H]([C@H](O)C(F)(F)F)C2)c2cccc([N+](=O)[O-])c2n1 ZINC000433789531 941898278 /nfs/dbraw/zinc/89/82/78/941898278.db2.gz NINUOIXBDIRISU-BZNIZROVSA-N 0 0 369.343 3.591 20 5 FHBDRN Cc1cc(N2CCC[C@H]([C@@H](O)C(F)(F)F)C2)c2cccc([N+](=O)[O-])c2n1 ZINC000433789532 941898454 /nfs/dbraw/zinc/89/84/54/941898454.db2.gz NINUOIXBDIRISU-MEDUHNTESA-N 0 0 369.343 3.591 20 5 FHBDRN COC(=O)c1cc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c(C)cc1C ZINC000472834086 941904165 /nfs/dbraw/zinc/90/41/65/941904165.db2.gz FJRCJRVKIVHTQV-UHFFFAOYSA-N 0 0 362.769 3.904 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCC[C@H]([C@H](O)C(F)(F)F)C2)cc1C(F)(F)F ZINC000433799419 941909378 /nfs/dbraw/zinc/90/93/78/941909378.db2.gz RFKZDRLFGFYWAY-UFBFGSQYSA-N 0 0 372.265 3.753 20 5 FHBDRN O=C(NCCc1ccc(F)cc1)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000549307336 941911347 /nfs/dbraw/zinc/91/13/47/941911347.db2.gz RZMUXUQPVYHKAA-UHFFFAOYSA-N 0 0 356.275 3.725 20 5 FHBDRN CC(C)Oc1cc(C(=O)NC[C@H]2[C@@H]3c4ccccc4C[C@H]23)ccc1[N+](=O)[O-] ZINC000412206042 941912966 /nfs/dbraw/zinc/91/29/66/941912966.db2.gz MLRBSQPAJSHVMW-MBOZVWFJSA-N 0 0 366.417 3.698 20 5 FHBDRN Nc1nccc(C(=O)Nc2ccc(OCC3CCCCC3)cc2)c1[N+](=O)[O-] ZINC000584359860 941916686 /nfs/dbraw/zinc/91/66/86/941916686.db2.gz PUJLWDXYWMWJKT-UHFFFAOYSA-N 0 0 370.409 3.614 20 5 FHBDRN CCC[C@@H](C)NC(=O)[C@@H]1CCCN(c2nc3ccccc3cc2[N+](=O)[O-])C1 ZINC000473528909 941925354 /nfs/dbraw/zinc/92/53/54/941925354.db2.gz IBJLNKACGCIJIZ-GDBMZVCRSA-N 0 0 370.453 3.664 20 5 FHBDRN COc1ccc2cc(CNC(=O)c3[nH]nc(C(C)C)c3[N+](=O)[O-])ccc2c1 ZINC000433833585 941929709 /nfs/dbraw/zinc/92/97/09/941929709.db2.gz ODADNYDCMMTQTE-UHFFFAOYSA-N 0 0 368.393 3.533 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)NCC[C@@H]1C[C@@H](C)O[C@@H](C)C1 ZINC000549316026 941929913 /nfs/dbraw/zinc/92/99/13/941929913.db2.gz DKTNFKIALSFPFX-CLLJXQQHSA-N 0 0 354.834 3.880 20 5 FHBDRN O=C(Nc1ccccc1C(F)(F)F)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000182473589 941933287 /nfs/dbraw/zinc/93/32/87/941933287.db2.gz WQRSLWAUHFTELP-UHFFFAOYSA-N 0 0 354.240 3.595 20 5 FHBDRN C[C@H](Nc1ccc(C(=O)N2CCCCCO2)cc1[N+](=O)[O-])c1ccccn1 ZINC000472845884 941933980 /nfs/dbraw/zinc/93/39/80/941933980.db2.gz AQLIKUJRZJICCH-AWEZNQCLSA-N 0 0 370.409 3.721 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1OC(F)F)N1CCSc2ccccc21 ZINC000182486308 941934155 /nfs/dbraw/zinc/93/41/55/941934155.db2.gz CJVFXLIMDKIARC-UHFFFAOYSA-N 0 0 366.345 3.949 20 5 FHBDRN CCN(Cc1ccc(Cl)s1)C(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-] ZINC000433837734 941935068 /nfs/dbraw/zinc/93/50/68/941935068.db2.gz GOWCCXXAAOKVBB-UHFFFAOYSA-N 0 0 356.835 3.819 20 5 FHBDRN COC(=O)c1c(C)c([N+](=O)[O-])ccc1NC1CC(C)(C)N(O)C(C)(C)C1 ZINC001167721431 941939479 /nfs/dbraw/zinc/93/94/79/941939479.db2.gz YUCPFRSMAPVWGB-UHFFFAOYSA-N 0 0 365.430 3.513 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCN(C(=O)c2ccc(F)cc2)CC1 ZINC000182592523 941945703 /nfs/dbraw/zinc/94/57/03/941945703.db2.gz XCCXVDHXULNGBP-OAHLLOKOSA-N 0 0 371.412 3.561 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])N[C@H](c1ccccn1)C1CCCC1 ZINC000365672816 941945741 /nfs/dbraw/zinc/94/57/41/941945741.db2.gz PQXCDHAJXWHEAO-SFHVURJKSA-N 0 0 354.410 3.721 20 5 FHBDRN COc1ccc([C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2C)C(F)(F)F)cc1 ZINC000182613156 941947445 /nfs/dbraw/zinc/94/74/45/941947445.db2.gz CVYNFXPNEGRNOF-OAHLLOKOSA-N 0 0 368.311 3.945 20 5 FHBDRN COc1ccccc1O[C@@H]1CCCN(C(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000513478954 941955972 /nfs/dbraw/zinc/95/59/72/941955972.db2.gz HOWMFXJPRZTGIH-MRXNPFEDSA-N 0 0 371.393 3.679 20 5 FHBDRN CC(C)Oc1ncccc1NC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000182641843 941957156 /nfs/dbraw/zinc/95/71/56/941957156.db2.gz PXGDMRUREJAJGN-UHFFFAOYSA-N 0 0 367.308 3.631 20 5 FHBDRN COc1ccc([C@@H](NC(=O)Cc2ccccc2[N+](=O)[O-])C(F)(F)F)cc1 ZINC000182639561 941957186 /nfs/dbraw/zinc/95/71/86/941957186.db2.gz ZERQINYQKXIBAA-MRXNPFEDSA-N 0 0 368.311 3.566 20 5 FHBDRN O=C(Cc1cccc([N+](=O)[O-])c1)N[C@@H](c1c(F)cccc1F)C(F)(F)F ZINC000182771726 941958777 /nfs/dbraw/zinc/95/87/77/941958777.db2.gz DNGJPYOUUNDJJI-HNNXBMFYSA-N 0 0 374.265 3.835 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)N[C@@H](c1c(F)cccc1F)C(F)(F)F ZINC000182772214 941958810 /nfs/dbraw/zinc/95/88/10/941958810.db2.gz KOIZCQVZOOLKIE-HNNXBMFYSA-N 0 0 374.265 3.835 20 5 FHBDRN COc1cc(CSc2ncc(C)cn2)c([N+](=O)[O-])cc1OCC(F)F ZINC000182704596 941960413 /nfs/dbraw/zinc/96/04/13/941960413.db2.gz WXKMAYNQDLYLFI-UHFFFAOYSA-N 0 0 371.365 3.638 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](CO)c1ccccc1 ZINC000182711120 941960989 /nfs/dbraw/zinc/96/09/89/941960989.db2.gz FJDRSHBWTLUQOY-MRXNPFEDSA-N 0 0 360.435 3.559 20 5 FHBDRN O=C1COc2c(NCc3ccc(-c4ccccc4[N+](=O)[O-])o3)cccc2N1 ZINC000377757903 941964683 /nfs/dbraw/zinc/96/46/83/941964683.db2.gz GPNZINBVRAQTKR-UHFFFAOYSA-N 0 0 365.345 3.798 20 5 FHBDRN Cc1cc(NC(=O)N2C[C@@H](c3ccsc3)O[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000182763190 941965957 /nfs/dbraw/zinc/96/59/57/941965957.db2.gz NLDPJEUJCXXDIC-LRDDRELGSA-N 0 0 361.423 3.959 20 5 FHBDRN O=C(N[C@@H](c1ccccc1)c1cccnc1)c1cc([N+](=O)[O-])cc(F)c1F ZINC000377754772 941968794 /nfs/dbraw/zinc/96/87/94/941968794.db2.gz XFVBVBHEHXNFMP-SFHVURJKSA-N 0 0 369.327 3.787 20 5 FHBDRN C[C@H]1C[C@@H](c2cccnc2)N(C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000182814321 941971975 /nfs/dbraw/zinc/97/19/75/941971975.db2.gz PQRHKDDOGNSAKB-SJCJKPOMSA-N 0 0 359.813 3.795 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)NCc2cnccc2C(F)(F)F)c1C ZINC000893067652 941972930 /nfs/dbraw/zinc/97/29/30/941972930.db2.gz IAFVIMHPJLLHCN-UHFFFAOYSA-N 0 0 353.300 3.555 20 5 FHBDRN Cc1cc(C(=O)NCCc2coc(-c3ccc(F)cc3)n2)cc([N+](=O)[O-])c1 ZINC000101531745 941984070 /nfs/dbraw/zinc/98/40/70/941984070.db2.gz PXVBPAYOLRJYCZ-UHFFFAOYSA-N 0 0 369.352 3.670 20 5 FHBDRN Cc1cc(-c2nc(-c3ccc(OCC(F)F)nc3)no2)cc([N+](=O)[O-])c1 ZINC000545840707 941987922 /nfs/dbraw/zinc/98/79/22/941987922.db2.gz BCCUQLCEKPMRFW-UHFFFAOYSA-N 0 0 362.292 3.659 20 5 FHBDRN CC[C@@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccc(OC)c(OC)c1 ZINC000513536825 941994253 /nfs/dbraw/zinc/99/42/53/941994253.db2.gz PMHJCYKFQBYXDG-OAHLLOKOSA-N 0 0 359.382 3.885 20 5 FHBDRN O=C(NCc1c(F)cccc1N1CCCC1)Nc1cccc([N+](=O)[O-])c1 ZINC000513555127 942010143 /nfs/dbraw/zinc/01/01/43/942010143.db2.gz VHGNIVBVYIGHHO-UHFFFAOYSA-N 0 0 358.373 3.656 20 5 FHBDRN Cc1noc(NC(=O)c2ccc(SCCC(C)C)c([N+](=O)[O-])c2)n1 ZINC000101857982 942015692 /nfs/dbraw/zinc/01/56/92/942015692.db2.gz HCVWSFLVECICNT-UHFFFAOYSA-N 0 0 350.400 3.677 20 5 FHBDRN CCSc1cc(CNC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)ccn1 ZINC000412271168 942017105 /nfs/dbraw/zinc/01/71/05/942017105.db2.gz OFZDYEQBTZILAO-JKSUJKDBSA-N 0 0 357.435 3.522 20 5 FHBDRN CC(C)(C(=O)Nc1ccc(OC(F)F)nc1)c1ccccc1[N+](=O)[O-] ZINC000513579541 942022260 /nfs/dbraw/zinc/02/22/60/942022260.db2.gz XIWPFEVTKXVTPU-UHFFFAOYSA-N 0 0 351.309 3.508 20 5 FHBDRN O=C(CCOCC1CC1)N(Cc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000433981229 942022567 /nfs/dbraw/zinc/02/25/67/942022567.db2.gz NAUYNWSVALUUMK-UHFFFAOYSA-N 0 0 354.406 3.945 20 5 FHBDRN Cc1ccc([C@@H]2CN(C(=O)Nc3cccc([N+](=O)[O-])c3Cl)CCO2)o1 ZINC000377847888 942034180 /nfs/dbraw/zinc/03/41/80/942034180.db2.gz RBEDYCYJRDSKSE-AWEZNQCLSA-N 0 0 365.773 3.755 20 5 FHBDRN O=C(Nc1cc([N+](=O)[O-])ccc1[O-])c1ccccc1Oc1ccncc1 ZINC000513610027 942037270 /nfs/dbraw/zinc/03/72/70/942037270.db2.gz ZRDXBMVYLJSIRD-UHFFFAOYSA-N 0 0 351.318 3.740 20 5 FHBDRN C[C@@H](c1ccc(OC(F)F)cc1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000513612157 942038040 /nfs/dbraw/zinc/03/80/40/942038040.db2.gz VPYHYBQJTMWMHE-JTQLQIEISA-N 0 0 357.334 3.731 20 5 FHBDRN O=C(c1sccc1Cl)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000513612150 942038054 /nfs/dbraw/zinc/03/80/54/942038054.db2.gz VLGYIYLLNRXIJM-UHFFFAOYSA-N 0 0 366.826 3.993 20 5 FHBDRN Cc1nn(CCC(=O)Nc2c(C)c(C)ccc2Cl)c(C)c1[N+](=O)[O-] ZINC000434014997 942040421 /nfs/dbraw/zinc/04/04/21/942040421.db2.gz HFWWSDIIRAXOLB-UHFFFAOYSA-N 0 0 350.806 3.707 20 5 FHBDRN CCOc1cc(NC(=O)[C@@H]2CCCCS2)c([N+](=O)[O-])cc1OCC ZINC000541183652 942042421 /nfs/dbraw/zinc/04/24/21/942042421.db2.gz UQOMSXHZABXTRR-HNNXBMFYSA-N 0 0 354.428 3.616 20 5 FHBDRN CCNC(=O)Nc1cccc(NC(=O)c2ccc([N+](=O)[O-])c(C)c2)c1C ZINC000434026023 942052968 /nfs/dbraw/zinc/05/29/68/942052968.db2.gz QWZJJQPFLOPAMR-UHFFFAOYSA-N 0 0 356.382 3.605 20 5 FHBDRN CCNC(=O)Nc1cccc(NC(=O)c2cccc(C)c2[N+](=O)[O-])c1C ZINC000434027848 942054076 /nfs/dbraw/zinc/05/40/76/942054076.db2.gz NOPRQEZHGFUYAR-UHFFFAOYSA-N 0 0 356.382 3.605 20 5 FHBDRN CC[C@H](C(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1)c1ccc(F)cc1 ZINC000460752414 942055452 /nfs/dbraw/zinc/05/54/52/942055452.db2.gz FJZBGPIBMHHTDR-KRWDZBQOSA-N 0 0 371.412 3.576 20 5 FHBDRN Cc1cccc(CCN[C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000513655071 942057826 /nfs/dbraw/zinc/05/78/26/942057826.db2.gz KVCSALYZQQXOGA-IBGZPJMESA-N 0 0 350.422 3.558 20 5 FHBDRN Cc1c(CNC(=O)[C@H]2CC(C)(C)Oc3ccccc32)cccc1[N+](=O)[O-] ZINC000412284217 942063018 /nfs/dbraw/zinc/06/30/18/942063018.db2.gz DLHMFMBDZPBZHV-INIZCTEOSA-N 0 0 354.406 3.864 20 5 FHBDRN Cn1ccnc1[C@H](NC1CC(c2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000513673375 942067447 /nfs/dbraw/zinc/06/74/47/942067447.db2.gz QCQPHZFNAKONFE-AFMYVXGZSA-N 0 0 362.433 3.954 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(OC2CCCC2)nc1 ZINC000513675338 942068357 /nfs/dbraw/zinc/06/83/57/942068357.db2.gz QOTMOBSDMHWDEM-UHFFFAOYSA-N 0 0 357.366 3.572 20 5 FHBDRN O=C(Nc1ccc2ncccc2c1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513679616 942069989 /nfs/dbraw/zinc/06/99/89/942069989.db2.gz GUXSZPGHSSCOMU-UHFFFAOYSA-N 0 0 359.288 3.997 20 5 FHBDRN C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1ccc(OC2CCCC2)nc1 ZINC000513681013 942073815 /nfs/dbraw/zinc/07/38/15/942073815.db2.gz WNQZVDYKHMSCMZ-CYBMUJFWSA-N 0 0 367.405 3.903 20 5 FHBDRN Cc1nn(C)c(C(=O)NCc2cccc(-c3cccc(C)c3)c2)c1[N+](=O)[O-] ZINC000102625711 942075518 /nfs/dbraw/zinc/07/55/18/942075518.db2.gz NPRUAHTXUNALEO-UHFFFAOYSA-N 0 0 364.405 3.542 20 5 FHBDRN Cc1nc(-c2cccc(NC(=O)c3c[nH]c4ccc([N+](=O)[O-])cc34)c2)no1 ZINC000102637793 942076971 /nfs/dbraw/zinc/07/69/71/942076971.db2.gz JCYMBNNREVJEFY-UHFFFAOYSA-N 0 0 363.333 3.687 20 5 FHBDRN Cc1cccnc1CCc1noc(-c2ccc([N+](=O)[O-])c(OC(C)C)c2)n1 ZINC000420506133 942087967 /nfs/dbraw/zinc/08/79/67/942087967.db2.gz UGAYARXAHIGLBU-UHFFFAOYSA-N 0 0 368.393 3.921 20 5 FHBDRN CC(C)(C)OC(=O)[C@]1(C)CCN(c2ccc([N+](=O)[O-])c3ncccc23)C1 ZINC000413357370 942091227 /nfs/dbraw/zinc/09/12/27/942091227.db2.gz KUMWBCAISFVMQL-LJQANCHMSA-N 0 0 357.410 3.701 20 5 FHBDRN CC(C)(C)OC(=O)[C@]1(C)CCN(c2ccc([N+](=O)[O-])c3cnccc32)C1 ZINC000413358383 942091292 /nfs/dbraw/zinc/09/12/92/942091292.db2.gz MPNDXTAOVZUJOK-LJQANCHMSA-N 0 0 357.410 3.701 20 5 FHBDRN CCC(=O)c1ccc(N[C@H]2CCO[C@]3(CCSC3)C2)c([N+](=O)[O-])c1 ZINC000280037823 942092585 /nfs/dbraw/zinc/09/25/85/942092585.db2.gz AMCPNNAJDMVVJD-SUMWQHHRSA-N 0 0 350.440 3.654 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CN[C@H](C)c1ccc(Br)cn1 ZINC000280038728 942093283 /nfs/dbraw/zinc/09/32/83/942093283.db2.gz ISXNCZJQZOGSLA-SNVBAGLBSA-N 0 0 366.215 3.612 20 5 FHBDRN COc1ccc(F)cc1[C@H](C)NC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000110226822 942094910 /nfs/dbraw/zinc/09/49/10/942094910.db2.gz YCRURHGCMGFWDP-VIFPVBQESA-N 0 0 352.749 3.887 20 5 FHBDRN CO[C@@H]1CCCN(C(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)C1 ZINC000102762333 942101395 /nfs/dbraw/zinc/10/13/95/942101395.db2.gz GOIOROCZXRFGOO-MRXNPFEDSA-N 0 0 355.394 3.589 20 5 FHBDRN CCC[C@@H](CC)S(=O)(=O)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000280105618 942108040 /nfs/dbraw/zinc/10/80/40/942108040.db2.gz YFHJNEPABBZXNA-OAHLLOKOSA-N 0 0 352.412 3.743 20 5 FHBDRN CO[C@@H]1CCCN(C(=O)c2ccc(Sc3ccc([N+](=O)[O-])cc3)cc2)C1 ZINC000501907661 942109196 /nfs/dbraw/zinc/10/91/96/942109196.db2.gz CFUJPAKCVIYCRW-MRXNPFEDSA-N 0 0 372.446 3.997 20 5 FHBDRN O=[N+]([O-])c1cnc(Nc2ccc3c(c2)CN(CC(F)(F)F)C3)c(F)c1 ZINC000413377644 942113515 /nfs/dbraw/zinc/11/35/15/942113515.db2.gz XILCLOWVVFOPTO-UHFFFAOYSA-N 0 0 356.279 3.750 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)Nc1cc(C2CCCC2)nn1C ZINC000280164472 942120908 /nfs/dbraw/zinc/12/09/08/942120908.db2.gz XFFDPUGQISPTOP-UHFFFAOYSA-N 0 0 358.398 3.637 20 5 FHBDRN CC[C@H](C)[C@H](C)N(C(=O)Cc1c(F)c(OC)ccc1[N+](=O)[O-])C1CC1 ZINC000413372524 942122206 /nfs/dbraw/zinc/12/22/06/942122206.db2.gz OPDJJVITKROLIF-RYUDHWBXSA-N 0 0 352.406 3.711 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1OC(=O)c1cccc(Oc2cnccn2)c1 ZINC000760015717 942122900 /nfs/dbraw/zinc/12/29/00/942122900.db2.gz HRRITTXMUXMEDK-UHFFFAOYSA-N 0 0 351.318 3.705 20 5 FHBDRN CCc1ccc(C(=O)NCc2cccc(OCCCOC)c2)cc1[N+](=O)[O-] ZINC000501943003 942124377 /nfs/dbraw/zinc/12/43/77/942124377.db2.gz AVNFTDWXRJDHIR-UHFFFAOYSA-N 0 0 372.421 3.503 20 5 FHBDRN COc1cc(C(=O)NCCCc2c[nH]c3ccc(F)cc23)ccc1[N+](=O)[O-] ZINC000501943020 942124416 /nfs/dbraw/zinc/12/44/16/942124416.db2.gz AYJKMZTVXJTUPJ-UHFFFAOYSA-N 0 0 371.368 3.586 20 5 FHBDRN O=[N+]([O-])c1ccn(C2CCN(c3nc(C4CCCCC4)ns3)CC2)n1 ZINC000420627706 942125966 /nfs/dbraw/zinc/12/59/66/942125966.db2.gz OMAZVMBFUFFAMO-UHFFFAOYSA-N 0 0 362.459 3.532 20 5 FHBDRN Cc1nn(C)c2nccc(NCc3cc([N+](=O)[O-])cc(C(F)(F)F)c3)c12 ZINC000420631280 942129784 /nfs/dbraw/zinc/12/97/84/942129784.db2.gz TUUDQNRJIAVZAN-UHFFFAOYSA-N 0 0 365.315 3.816 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CCOc2c(F)cccc2C1 ZINC000377991143 942131654 /nfs/dbraw/zinc/13/16/54/942131654.db2.gz LGNXECWSWBHWMK-UHFFFAOYSA-N 0 0 359.357 3.777 20 5 FHBDRN C[C@@H]1CC[C@@H](CNc2cc(C(F)(F)C(F)(F)F)ncc2[N+](=O)[O-])O1 ZINC000413381478 942136906 /nfs/dbraw/zinc/13/69/06/942136906.db2.gz WHKTUFJIXBTMFY-SFYZADRCSA-N 0 0 355.263 3.623 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CC[C@@H](O)CC23CCC3)nc1-c1ccc(F)cc1 ZINC000420643490 942138697 /nfs/dbraw/zinc/13/86/97/942138697.db2.gz XLOOEZTUDHXYJQ-OAHLLOKOSA-N 0 0 357.385 3.680 20 5 FHBDRN CCOC(=O)c1cc(N[C@@H](C)c2nc3c(s2)CCC3)ccc1[N+](=O)[O-] ZINC000413392276 942139467 /nfs/dbraw/zinc/13/94/67/942139467.db2.gz IKEFUWNXFKKBMO-JTQLQIEISA-N 0 0 361.423 3.890 20 5 FHBDRN Cc1ccc(C(=O)NC2CC2)cc1NC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000110222124 942139567 /nfs/dbraw/zinc/13/95/67/942139567.db2.gz QTLBVJLZELECEZ-UHFFFAOYSA-N 0 0 373.796 3.701 20 5 FHBDRN CC(C)NC(=O)c1ccc(NC[C@H]2CC23CCSCC3)c([N+](=O)[O-])c1 ZINC000420649818 942141261 /nfs/dbraw/zinc/14/12/61/942141261.db2.gz GUCKZSRZWPKHSZ-CQSZACIVSA-N 0 0 363.483 3.678 20 5 FHBDRN C[C@@H](Nc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2)c1nc2c(s1)CCC2 ZINC000413396336 942143701 /nfs/dbraw/zinc/14/37/01/942143701.db2.gz OPRLKIKOAPCEDO-SECBINFHSA-N 0 0 358.423 3.598 20 5 FHBDRN C[C@H](Nc1ncc([N+](=O)[O-])cc1Br)c1nc2c(s1)CCC2 ZINC000413396483 942143866 /nfs/dbraw/zinc/14/38/66/942143866.db2.gz OXWIQSJKFQQXEU-ZETCQYMHSA-N 0 0 369.244 3.871 20 5 FHBDRN CC(C)(C)[C@H]1C[C@@H](NC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])CCO1 ZINC000280272107 942147640 /nfs/dbraw/zinc/14/76/40/942147640.db2.gz VCKZDBIGKFNZKZ-XHDPSFHLSA-N 0 0 372.824 3.640 20 5 FHBDRN CC(C)NC(=O)c1ccc(N[C@@H](C)CCCc2cccnc2)c([N+](=O)[O-])c1 ZINC000413404912 942153028 /nfs/dbraw/zinc/15/30/28/942153028.db2.gz XOESRJPQZKICHP-HNNXBMFYSA-N 0 0 370.453 3.951 20 5 FHBDRN CO[C@@H]1CCC[C@H](CC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000280298534 942154374 /nfs/dbraw/zinc/15/43/74/942154374.db2.gz NXBKKKXCQWOBGC-CMPLNLGQSA-N 0 0 358.341 3.730 20 5 FHBDRN O=C(NCC1(c2ccncc2)CCCC1)c1ccc([N+](=O)[O-])cc1Cl ZINC000501997882 942161050 /nfs/dbraw/zinc/16/10/50/942161050.db2.gz HERQPTJAGSDJPR-UHFFFAOYSA-N 0 0 359.813 3.885 20 5 FHBDRN C[C@H](NC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1)c1ccon1 ZINC000501999195 942162138 /nfs/dbraw/zinc/16/21/38/942162138.db2.gz QPSXWKCTSWFEKR-LBPRGKRZSA-N 0 0 352.350 3.817 20 5 FHBDRN CCC1(CNC(=O)c2ccnc(-c3ccccc3)c2[N+](=O)[O-])CCOCC1 ZINC000293727440 942163399 /nfs/dbraw/zinc/16/33/99/942163399.db2.gz NBXFPTCJIGJPCF-UHFFFAOYSA-N 0 0 369.421 3.593 20 5 FHBDRN Cn1cc([N+](=O)[O-])cc1C(=O)N(Cc1cccs1)Cc1cccs1 ZINC000024467831 942172586 /nfs/dbraw/zinc/17/25/86/942172586.db2.gz KRQDPLIKMVPBHH-UHFFFAOYSA-N 0 0 361.448 3.899 20 5 FHBDRN Cc1cc(NC(=O)C2CCC(NC(=O)C(C)(C)C)CC2)ccc1[N+](=O)[O-] ZINC000280392645 942174580 /nfs/dbraw/zinc/17/45/80/942174580.db2.gz GHMZGPSVCJRQAX-UHFFFAOYSA-N 0 0 361.442 3.563 20 5 FHBDRN Cc1c(NC(=O)CCC(F)(F)F)cc(Br)cc1[N+](=O)[O-] ZINC000280418442 942179417 /nfs/dbraw/zinc/17/94/17/942179417.db2.gz AFLHZGLGAPIUDE-UHFFFAOYSA-N 0 0 355.110 3.947 20 5 FHBDRN O=[N+]([O-])c1cccc(F)c1CN1CCC(n2ccc(C(F)(F)F)n2)CC1 ZINC000183145202 942183683 /nfs/dbraw/zinc/18/36/83/942183683.db2.gz YXPOZTRPLMUQLI-UHFFFAOYSA-N 0 0 372.322 3.786 20 5 FHBDRN CCOc1ccc2c(c1)CCN(C(=O)c1cc(SC)ccc1[N+](=O)[O-])C2 ZINC000434097931 942185841 /nfs/dbraw/zinc/18/58/41/942185841.db2.gz NUJRWRIKPKGBHB-UHFFFAOYSA-N 0 0 372.446 3.914 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)NCc1ccccc1N1CCCCC1 ZINC000183155992 942186822 /nfs/dbraw/zinc/18/68/22/942186822.db2.gz VJWBBLBWCIOTKR-UHFFFAOYSA-N 0 0 369.421 3.524 20 5 FHBDRN COC(=O)c1nc([C@H]2CCCN2c2cccc(F)c2[N+](=O)[O-])sc1C ZINC000280591778 942210663 /nfs/dbraw/zinc/21/06/63/942210663.db2.gz WYSXAELECZTXTL-GFCCVEGCSA-N 0 0 365.386 3.627 20 5 FHBDRN CNC(=O)c1ccc(NC(=O)c2c(Cl)cccc2[N+](=O)[O-])cc1Cl ZINC000110236591 942214054 /nfs/dbraw/zinc/21/40/54/942214054.db2.gz RHQXUNXUUGHIIJ-UHFFFAOYSA-N 0 0 368.176 3.514 20 5 FHBDRN COc1cc(C(=O)N2CCC[C@@H](CC(C)C)C2)cc([N+](=O)[O-])c1OC ZINC000469130446 942214170 /nfs/dbraw/zinc/21/41/70/942214170.db2.gz UZPFYVVCPJJVFM-ZDUSSCGKSA-N 0 0 350.415 3.510 20 5 FHBDRN Cc1ccc([C@H](C)N(C)S(=O)(=O)c2c(C)c(C)ccc2[N+](=O)[O-])cc1 ZINC000480941657 942217742 /nfs/dbraw/zinc/21/77/42/942217742.db2.gz YQYJGSKQLUVLGE-HNNXBMFYSA-N 0 0 362.451 3.902 20 5 FHBDRN COc1cc(C(F)(F)F)ncc1NC(=O)c1cccc(C)c1[N+](=O)[O-] ZINC000616711110 942221472 /nfs/dbraw/zinc/22/14/72/942221472.db2.gz LQJMODKCTVDDFU-UHFFFAOYSA-N 0 0 355.272 3.578 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)N[C@@H](CC(F)F)c1ccccc1 ZINC000420818202 942221678 /nfs/dbraw/zinc/22/16/78/942221678.db2.gz KTDAKNDCJPEYRE-INIZCTEOSA-N 0 0 363.364 3.833 20 5 FHBDRN COc1ccc(CN(C)[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1C ZINC000103144765 942223716 /nfs/dbraw/zinc/22/37/16/942223716.db2.gz UPVNHXRHGKRBAV-HNNXBMFYSA-N 0 0 371.437 3.679 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H]1CCOC2(CCCCC2)C1 ZINC000122763012 942226351 /nfs/dbraw/zinc/22/63/51/942226351.db2.gz NIALOUWVOKNKOS-CYBMUJFWSA-N 0 0 363.414 3.607 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@H]1CCOC2(CCCCC2)C1 ZINC000122763246 942226595 /nfs/dbraw/zinc/22/65/95/942226595.db2.gz NIALOUWVOKNKOS-ZDUSSCGKSA-N 0 0 363.414 3.607 20 5 FHBDRN C[C@H](CO)N(CC1CCC1)C(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000280665301 942226750 /nfs/dbraw/zinc/22/67/50/942226750.db2.gz FTRIMLXFZIRWMP-CQSZACIVSA-N 0 0 364.445 3.717 20 5 FHBDRN COc1ccc([C@H]2CCCN2c2nc3ccc([N+](=O)[O-])cc3c(=O)[nH]2)cc1 ZINC000280671445 942228040 /nfs/dbraw/zinc/22/80/40/942228040.db2.gz CLWVCSDWEQLNEH-QGZVFWFLSA-N 0 0 366.377 3.594 20 5 FHBDRN CC[C@@](C)(NC(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1)c1nccs1 ZINC000413488797 942240291 /nfs/dbraw/zinc/24/02/91/942240291.db2.gz QJEQASNDGRNJFI-QGZVFWFLSA-N 0 0 363.439 3.894 20 5 FHBDRN CC[C@H](Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])c1ccccc1 ZINC000413488518 942240503 /nfs/dbraw/zinc/24/05/03/942240503.db2.gz PMSJSWYZIZGMOQ-KRWDZBQOSA-N 0 0 369.421 3.630 20 5 FHBDRN CC(C)[C@H]1CCCC[C@@H]1NC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000103326277 942244256 /nfs/dbraw/zinc/24/42/56/942244256.db2.gz KPNONADDNNUHSP-OCCSQVGLSA-N 0 0 367.833 3.518 20 5 FHBDRN COc1cc(C(=O)N2[C@H](C)CCC[C@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000103368249 942246682 /nfs/dbraw/zinc/24/66/82/942246682.db2.gz SWRKPVQZUNZRRD-NXEZZACHSA-N 0 0 358.341 3.608 20 5 FHBDRN CCc1ccccc1NC(=O)COC(=O)c1cc(SC)ccc1[N+](=O)[O-] ZINC000016196753 942246888 /nfs/dbraw/zinc/24/68/88/942246888.db2.gz ZYNZDNZDNWJGRX-UHFFFAOYSA-N 0 0 374.418 3.675 20 5 FHBDRN Cc1cnn(-c2ccc(C(=O)N3c4ccc([N+](=O)[O-])cc4C[C@@H]3C)cc2)c1 ZINC000103375674 942247912 /nfs/dbraw/zinc/24/79/12/942247912.db2.gz GAPMVIWTJJGKSU-AWEZNQCLSA-N 0 0 362.389 3.680 20 5 FHBDRN C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)CCCc1nc(C(C)(C)C)no1 ZINC000103375885 942247941 /nfs/dbraw/zinc/24/79/41/942247941.db2.gz YOCMZPQPAOGXRG-GFCCVEGCSA-N 0 0 372.425 3.576 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)O[C@H](C)C(=O)c2ccc(F)cc2)c1 ZINC000016196696 942247969 /nfs/dbraw/zinc/24/79/69/942247969.db2.gz MJMPJQZZXYWFED-SNVBAGLBSA-N 0 0 363.366 3.884 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)OCC(=O)c2cc(C)ccc2C)c1 ZINC000016196452 942248079 /nfs/dbraw/zinc/24/80/79/942248079.db2.gz RUNWLGXLUTZESO-UHFFFAOYSA-N 0 0 359.403 3.973 20 5 FHBDRN COc1ccc(OC)c(CCC(=O)N2c3ccc([N+](=O)[O-])cc3C[C@@H]2C)c1 ZINC000103376254 942248624 /nfs/dbraw/zinc/24/86/24/942248624.db2.gz WFOSKWFDFDCFSW-ZDUSSCGKSA-N 0 0 370.405 3.522 20 5 FHBDRN CC(C)C(=O)Nc1ccc(C(=O)N2c3ccc([N+](=O)[O-])cc3C[C@@H]2C)cc1 ZINC000103376051 942249046 /nfs/dbraw/zinc/24/90/46/942249046.db2.gz REVGSGURHPNIHJ-ZDUSSCGKSA-N 0 0 367.405 3.781 20 5 FHBDRN COc1ccc2c(CC(=O)N3c4ccc([N+](=O)[O-])cc4C[C@@H]3C)coc2c1 ZINC000103377995 942249354 /nfs/dbraw/zinc/24/93/54/942249354.db2.gz FQHQLEGDLKCVMB-LBPRGKRZSA-N 0 0 366.373 3.870 20 5 FHBDRN CCN(CC)c1ccc(CNc2ncc([N+](=O)[O-])cc2C(F)(F)F)cn1 ZINC000413069481 942250654 /nfs/dbraw/zinc/25/06/54/942250654.db2.gz YEQZAHAEQMHACN-UHFFFAOYSA-N 0 0 369.347 3.862 20 5 FHBDRN CCOCCN(C(=O)Cc1ccccc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000416010968 942251507 /nfs/dbraw/zinc/25/15/07/942251507.db2.gz ICMSSEOIBRWHAZ-UHFFFAOYSA-N 0 0 362.813 3.860 20 5 FHBDRN CC(C)c1ccc(C(=O)N2CCN(c3cccs3)CC2)cc1[N+](=O)[O-] ZINC000187908487 942253806 /nfs/dbraw/zinc/25/38/06/942253806.db2.gz HOWAUQJUCCCMQY-UHFFFAOYSA-N 0 0 359.451 3.742 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N(C)[C@H](C)C2CCCCC2)c1C ZINC001211651249 942253985 /nfs/dbraw/zinc/25/39/85/942253985.db2.gz OKECZIKWUNJGMR-CQSZACIVSA-N 0 0 354.472 3.801 20 5 FHBDRN C[C@@H](C(=O)N1CC[C@@H](c2ccccc2F)C1)c1ccc([N+](=O)[O-])cc1F ZINC000502161366 942254347 /nfs/dbraw/zinc/25/43/47/942254347.db2.gz XJVAJVGUCUDJQO-CHWSQXEVSA-N 0 0 360.360 3.993 20 5 FHBDRN COc1cc(C(=O)N2C[C@@H]3CCCCC[C@H]32)c([N+](=O)[O-])cc1OC(F)F ZINC000378082462 942256942 /nfs/dbraw/zinc/25/69/42/942256942.db2.gz HDARENKJRGRPHQ-CMPLNLGQSA-N 0 0 370.352 3.610 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N(C)[C@H]1CCCC[C@@H]1c1ccccc1 ZINC000416008680 942258992 /nfs/dbraw/zinc/25/89/92/942258992.db2.gz MPKAYSHIHUOPMY-MSOLQXFVSA-N 0 0 370.453 3.675 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)N[C@@H](C(C)C)C(F)(F)F)cc1SC ZINC000416010052 942259478 /nfs/dbraw/zinc/25/94/78/942259478.db2.gz GMQFTQVPTWDGJE-LBPRGKRZSA-N 0 0 366.361 3.642 20 5 FHBDRN C[C@@H]1CN(c2ncc([N+](=O)[O-])cc2C(F)(F)F)C[C@@H](c2ccccc2)O1 ZINC000413077830 942260278 /nfs/dbraw/zinc/26/02/78/942260278.db2.gz SHHNERCMLAYQFF-ABAIWWIYSA-N 0 0 367.327 3.975 20 5 FHBDRN CC(=O)c1ccc2c(c1)CN(c1ncc([N+](=O)[O-])cc1C(F)(F)F)C2 ZINC000413500657 942260974 /nfs/dbraw/zinc/26/09/74/942260974.db2.gz GJTOVEQLAIYRDC-UHFFFAOYSA-N 0 0 351.284 3.731 20 5 FHBDRN CC(C)[C@H](NC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])C(F)(F)F ZINC000416013984 942261406 /nfs/dbraw/zinc/26/14/06/942261406.db2.gz NKNAIDRBQTVOOR-JTQLQIEISA-N 0 0 358.238 3.930 20 5 FHBDRN C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCC[C@@H](CC(F)(F)F)C1 ZINC000420955960 942275294 /nfs/dbraw/zinc/27/52/94/942275294.db2.gz XJDGOGFKXLZOMN-NEPJUHHUSA-N 0 0 359.348 3.586 20 5 FHBDRN CCOc1ccc(C(=O)NCc2ncoc2-c2ccccc2)cc1[N+](=O)[O-] ZINC000378103906 942280407 /nfs/dbraw/zinc/28/04/07/942280407.db2.gz PCGBKYWVNHMVRF-UHFFFAOYSA-N 0 0 367.361 3.579 20 5 FHBDRN CC(C)(C)OC(=O)CC[C@@H]1CCCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000416037654 942284120 /nfs/dbraw/zinc/28/41/20/942284120.db2.gz YSNAZFXKYPIEEX-LBPRGKRZSA-N 0 0 368.455 3.773 20 5 FHBDRN O=[N+]([O-])c1cnc(NC2CCN(c3nc4ccccc4s3)CC2)c(F)c1 ZINC000413093726 942284252 /nfs/dbraw/zinc/28/42/52/942284252.db2.gz JPTZRXNJAJMSCY-UHFFFAOYSA-N 0 0 373.413 3.820 20 5 FHBDRN O=[N+]([O-])c1ccn(C2CCN(c3nc(-c4ccccc4)cs3)CC2)n1 ZINC000366740759 942286526 /nfs/dbraw/zinc/28/65/26/942286526.db2.gz AFYNYEBICRDZDW-UHFFFAOYSA-N 0 0 355.423 3.756 20 5 FHBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1c2ccccc2SC[C@@H]1C ZINC000434109107 942291839 /nfs/dbraw/zinc/29/18/39/942291839.db2.gz NRPNBLKRIGNTRO-NSHDSACASA-N 0 0 364.448 3.593 20 5 FHBDRN Cc1noc(C(C)(C)NC(=O)Nc2ccc(C(C)(C)C)c([N+](=O)[O-])c2)n1 ZINC000501086243 942291921 /nfs/dbraw/zinc/29/19/21/942291921.db2.gz VIYHZVZKQIGKKP-UHFFFAOYSA-N 0 0 361.402 3.641 20 5 FHBDRN COc1ccc(CSCC(=O)N2CC[C@@H](C)C[C@H](C)C2)cc1[N+](=O)[O-] ZINC000502217565 942295560 /nfs/dbraw/zinc/29/55/60/942295560.db2.gz DEVKFNZUNKTTPN-KGLIPLIRSA-N 0 0 366.483 3.731 20 5 FHBDRN O=C(Nc1cc(Br)cc([N+](=O)[O-])c1)c1ncccc1Cl ZINC000513736663 942295664 /nfs/dbraw/zinc/29/56/64/942295664.db2.gz IGANSXIUKPGCSX-UHFFFAOYSA-N 0 0 356.563 3.658 20 5 FHBDRN CCOc1ncccc1CNC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000103602625 942297362 /nfs/dbraw/zinc/29/73/62/942297362.db2.gz RRPGFTGOSLGPTQ-UHFFFAOYSA-N 0 0 372.425 3.509 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CCN(C)c3ccc(F)cc32)ccc1[N+](=O)[O-] ZINC000413525572 942301266 /nfs/dbraw/zinc/30/12/66/942301266.db2.gz ZQUPOZLBLLMPJM-UHFFFAOYSA-N 0 0 373.384 3.618 20 5 FHBDRN COc1ccc(N(CC(C)C)C(=O)COc2ccccc2[N+](=O)[O-])cc1 ZINC000501085279 942302045 /nfs/dbraw/zinc/30/20/45/942302045.db2.gz NFVZJGZGNKOFKC-UHFFFAOYSA-N 0 0 358.394 3.671 20 5 FHBDRN O=C(N[C@@H]1COCc2ccccc21)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000419558789 942303352 /nfs/dbraw/zinc/30/33/52/942303352.db2.gz OIPULAUTTOOQTC-LJQANCHMSA-N 0 0 367.405 3.540 20 5 FHBDRN COc1cccc([C@H](Nc2ccc([N+](=O)[O-])c(C)n2)c2cccnc2)c1 ZINC000378130929 942304656 /nfs/dbraw/zinc/30/46/56/942304656.db2.gz CYUKOIGWCJKVLW-IBGZPJMESA-N 0 0 350.378 3.903 20 5 FHBDRN Cc1cccc(C)c1NC(=O)[C@@H](C)OC(=O)/C=C/c1ccc([N+](=O)[O-])cc1 ZINC000015655182 942306884 /nfs/dbraw/zinc/30/68/84/942306884.db2.gz VETDRHDZOUWJNZ-SAAWKEMMSA-N 0 0 368.389 3.795 20 5 FHBDRN CCN(c1ccc(F)c(F)c1)S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-] ZINC000481061770 942307713 /nfs/dbraw/zinc/30/77/13/942307713.db2.gz RDZNWEQDPSJGPU-UHFFFAOYSA-N 0 0 370.377 3.705 20 5 FHBDRN CCOc1cccc2[nH]cc(CC(=O)Nc3ccc(OC)cc3[N+](=O)[O-])c21 ZINC000188007789 942309228 /nfs/dbraw/zinc/30/92/28/942309228.db2.gz SOGPQFZXUKJJLT-UHFFFAOYSA-N 0 0 369.377 3.665 20 5 FHBDRN COc1ccc2c(c1OC)CCN(C/C=C/c1ccccc1[N+](=O)[O-])C2 ZINC000501122578 942320109 /nfs/dbraw/zinc/32/01/09/942320109.db2.gz RMFVCWNKXJKCDN-FNORWQNLSA-N 0 0 354.406 3.684 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(N2C[C@@H](c3ccccc3)C3(CCC3)C2)n1 ZINC000413534919 942324473 /nfs/dbraw/zinc/32/44/73/942324473.db2.gz PTRFHUFBAPLMKP-HNNXBMFYSA-N 0 0 367.405 3.551 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(N2CC3(CCOCC3)[C@@H]2c2ccccc2)n1 ZINC000413535553 942325234 /nfs/dbraw/zinc/32/52/34/942325234.db2.gz DSPCXJDKHJQVEG-SFHVURJKSA-N 0 0 353.422 3.965 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)ccc1CSc1nnnn1Cc1ccccc1 ZINC000501141994 942326363 /nfs/dbraw/zinc/32/63/63/942326363.db2.gz JXMSVDAMYZSJRZ-UHFFFAOYSA-N 0 0 361.814 3.575 20 5 FHBDRN COc1cc(CSCc2nnc(C3CC3)s2)c([N+](=O)[O-])cc1F ZINC000419598577 942326866 /nfs/dbraw/zinc/32/68/66/942326866.db2.gz RYIMYINXMYHJLH-UHFFFAOYSA-N 0 0 355.416 3.905 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1COCc2ccccc21 ZINC000416080976 942327395 /nfs/dbraw/zinc/32/73/95/942327395.db2.gz MEXWGWANFVSMME-DNVCBOLYSA-N 0 0 354.406 3.551 20 5 FHBDRN CNC(=O)c1ccc(N[C@@H]2CC[C@@H](c3ccccc3F)C2)c([N+](=O)[O-])c1 ZINC000481092470 942327659 /nfs/dbraw/zinc/32/76/59/942327659.db2.gz PDAUHHAITWIRGV-TZMCWYRMSA-N 0 0 357.385 3.842 20 5 FHBDRN COc1cc(F)c([C@@H](C)NCc2c(F)cccc2[N+](=O)[O-])cc1OC ZINC000183497172 942333247 /nfs/dbraw/zinc/33/32/47/942333247.db2.gz PHKDRUNBXFECAL-SNVBAGLBSA-N 0 0 352.337 3.741 20 5 FHBDRN COC(=O)c1cnc(N[C@H]2CC[C@H](c3ccccc3F)C2)c([N+](=O)[O-])c1 ZINC000481096568 942335506 /nfs/dbraw/zinc/33/55/06/942335506.db2.gz SJJHDAHSCGUUHR-AAEUAGOBSA-N 0 0 359.357 3.664 20 5 FHBDRN COc1ccc(C)cc1CCNC(=O)Nc1c(C)ccc([N+](=O)[O-])c1C ZINC000085634761 942337053 /nfs/dbraw/zinc/33/70/53/942337053.db2.gz BRLIONMFUWFECV-UHFFFAOYSA-N 0 0 357.410 3.893 20 5 FHBDRN Cc1cc(Cc2noc(C[C@@H]3OCCc4ccccc43)n2)ccc1[N+](=O)[O-] ZINC000274075162 942339346 /nfs/dbraw/zinc/33/93/46/942339346.db2.gz WWMFNTVRUWBITL-SFHVURJKSA-N 0 0 365.389 3.734 20 5 FHBDRN CNC(=O)c1ccc(N2C[C@@H](c3ccccc3)C3(CCC3)C2)c([N+](=O)[O-])c1 ZINC000413544064 942341391 /nfs/dbraw/zinc/34/13/91/942341391.db2.gz ZKPHXCHXCYGQLU-KRWDZBQOSA-N 0 0 365.433 3.729 20 5 FHBDRN O=C(NCC1CCC(F)(F)CC1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000501175538 942341532 /nfs/dbraw/zinc/34/15/32/942341532.db2.gz NYCUIQBLEUAATF-UHFFFAOYSA-N 0 0 353.369 3.724 20 5 FHBDRN CC(C)(C)Oc1cc(NCc2nnc(-c3ccncc3)[nH]2)ccc1[N+](=O)[O-] ZINC000413548018 942343559 /nfs/dbraw/zinc/34/35/59/942343559.db2.gz FEFRTSOWXQKIMG-UHFFFAOYSA-N 0 0 368.397 3.564 20 5 FHBDRN C[C@@H](C(=O)N1CCSC[C@@H]1C1CCC1)c1ccc([N+](=O)[O-])cc1F ZINC000416101227 942346120 /nfs/dbraw/zinc/34/61/20/942346120.db2.gz BAOCIWYDIPJWDX-BDJLRTHQSA-N 0 0 352.431 3.582 20 5 FHBDRN O=C(Cc1ccc(Cl)cc1)Nc1ccnn1-c1ccc([N+](=O)[O-])cc1 ZINC000103931144 942346936 /nfs/dbraw/zinc/34/69/36/942346936.db2.gz CWYFSEAWOQWDBT-UHFFFAOYSA-N 0 0 356.769 3.615 20 5 FHBDRN O=[N+]([O-])c1c(N2CC3(CCOCC3)[C@H]2c2ccccc2)nc2sccn21 ZINC000413552814 942347637 /nfs/dbraw/zinc/34/76/37/942347637.db2.gz WEMRQSSNIOMNCV-CQSZACIVSA-N 0 0 370.434 3.662 20 5 FHBDRN O=[N+]([O-])c1cnc(Nc2ccc(O[C@@H]3CCOC3)cc2)c(C(F)(F)F)c1 ZINC000413155058 942351992 /nfs/dbraw/zinc/35/19/92/942351992.db2.gz PBTBGGSCLVBTBX-CYBMUJFWSA-N 0 0 369.299 3.920 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)Nc1cccc(-c2ncc[nH]2)c1 ZINC000103966883 942351959 /nfs/dbraw/zinc/35/19/59/942351959.db2.gz AVBBVIOJMYGXFT-UHFFFAOYSA-N 0 0 354.391 3.716 20 5 FHBDRN C[C@@H](Sc1ncc(Br)cc1[N+](=O)[O-])C(=O)OC(C)(C)C ZINC000481123095 942359200 /nfs/dbraw/zinc/35/92/00/942359200.db2.gz PPTVPPUAZCKBIE-SSDOTTSWSA-N 0 0 363.233 3.575 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc([S@@](C)=O)cc1 ZINC000159095043 942361693 /nfs/dbraw/zinc/36/16/93/942361693.db2.gz IYBJKPDFAMWJOB-DEOSSOPVSA-N 0 0 364.448 3.697 20 5 FHBDRN Cc1ccccc1[C@]1(F)CCN(C(=O)COc2ccc([N+](=O)[O-])c(C)c2)C1 ZINC000501259248 942368015 /nfs/dbraw/zinc/36/80/15/942368015.db2.gz QDGXRFVVYSBHBD-FQEVSTJZSA-N 0 0 372.396 3.688 20 5 FHBDRN CSc1ccc2cc(Cn3cc([N+](=O)[O-])ccc3=O)c(Cl)nc2c1 ZINC000016280504 942372928 /nfs/dbraw/zinc/37/29/28/942372928.db2.gz BOLDQQZRCUZYRF-UHFFFAOYSA-N 0 0 361.810 3.728 20 5 FHBDRN CC1(C)CCc2sc(NC(=O)N3CCc4ccc([N+](=O)[O-])cc4C3)nc21 ZINC000421122905 942374649 /nfs/dbraw/zinc/37/46/49/942374649.db2.gz XOVBVJQMIORWQZ-UHFFFAOYSA-N 0 0 372.450 3.865 20 5 FHBDRN Cn1c(C(=O)N2CCC[C@H]2Cc2c(F)cccc2Cl)ccc1[N+](=O)[O-] ZINC000502357818 942378752 /nfs/dbraw/zinc/37/87/52/942378752.db2.gz YEFBLGGBIOLYIG-NSHDSACASA-N 0 0 365.792 3.573 20 5 FHBDRN COc1ccc([C@H]2C[C@H](NC(=O)Cc3cccc([N+](=O)[O-])c3C)C2)cc1F ZINC000501288153 942389610 /nfs/dbraw/zinc/38/96/10/942389610.db2.gz YTGIFHGPKPQZCB-WKILWMFISA-N 0 0 372.396 3.656 20 5 FHBDRN Cc1cc(NC(=O)C(=O)N(C)[C@@H]2CCC[C@@H]2C(C)(C)C)ccc1[N+](=O)[O-] ZINC000419788732 942391851 /nfs/dbraw/zinc/39/18/51/942391851.db2.gz QNSRYWAZJFWERL-GOEBONIOSA-N 0 0 361.442 3.515 20 5 FHBDRN CCN(C(=O)c1cc([N+](=O)[O-])ccc1OC)[C@@H](C)Cc1ccc(OC)cc1 ZINC000066805541 942395702 /nfs/dbraw/zinc/39/57/02/942395702.db2.gz ALAJJQOPMYWUKJ-AWEZNQCLSA-N 0 0 372.421 3.705 20 5 FHBDRN O=C(c1cccc([N+](=O)[O-])c1)N(CCc1ccccc1)Cc1ccncc1 ZINC000501318876 942398321 /nfs/dbraw/zinc/39/83/21/942398321.db2.gz LTAKBZYKZBIYSD-UHFFFAOYSA-N 0 0 361.401 3.875 20 5 FHBDRN O=C(OCc1ccc(F)cc1Br)c1ccc([N+](=O)[O-])cc1 ZINC000014073714 942403851 /nfs/dbraw/zinc/40/38/51/942403851.db2.gz XUMXQSRGFPESPE-UHFFFAOYSA-N 0 0 354.131 3.853 20 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ZINC001268853846 942414437 /nfs/dbraw/zinc/41/44/37/942414437.db2.gz LOBRPBYDCOWLOP-INIZCTEOSA-N 0 0 355.394 3.821 20 5 FHBDRN C[C@]1(C(=O)Nc2ccc([N+](=O)[O-])c3ncccc23)OCCc2ccccc21 ZINC001268854539 942416090 /nfs/dbraw/zinc/41/60/90/942416090.db2.gz XHHJSVOESQXJAD-FQEVSTJZSA-N 0 0 363.373 3.570 20 5 FHBDRN CCNC(=O)c1cccc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)c1 ZINC000015813062 942425739 /nfs/dbraw/zinc/42/57/39/942425739.db2.gz JAARLCGMBAFRDW-UHFFFAOYSA-N 0 0 369.402 3.812 20 5 FHBDRN C[C@H](CCc1ccco1)NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513744600 942426237 /nfs/dbraw/zinc/42/62/37/942426237.db2.gz NAAJDYBNHFICMR-SNVBAGLBSA-N 0 0 354.309 3.540 20 5 FHBDRN CC(C)OCc1nc([C@H](C)Nc2ccc([N+](=O)[O-])c(OC(F)F)c2)no1 ZINC000290699546 942427387 /nfs/dbraw/zinc/42/73/87/942427387.db2.gz KMQXUHDALNRMAE-VIFPVBQESA-N 0 0 372.328 3.677 20 5 FHBDRN O=[N+]([O-])c1cccc(Cl)c1OCc1ccc(CN2CCOCC2)cc1 ZINC000421220086 942434085 /nfs/dbraw/zinc/43/40/85/942434085.db2.gz WAZQCOXUEAAFEU-UHFFFAOYSA-N 0 0 362.813 3.659 20 5 FHBDRN Cc1cc(C(=O)Nc2cc(F)ccc2OC[C@H]2CCCO2)ccc1[N+](=O)[O-] ZINC000502419956 942435784 /nfs/dbraw/zinc/43/57/84/942435784.db2.gz WGHNSROFFCYDLJ-OAHLLOKOSA-N 0 0 374.368 3.852 20 5 FHBDRN Cc1cc(NC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)cc2n[nH]cc21 ZINC000501390481 942445515 /nfs/dbraw/zinc/44/55/15/942445515.db2.gz GPLZRECQRYRLDJ-UHFFFAOYSA-N 0 0 365.393 3.976 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1)N(S(=O)(=O)c1cc(Cl)cc(Cl)c1)CC2 ZINC000014099078 942453431 /nfs/dbraw/zinc/45/34/31/942453431.db2.gz TZPTWYUYMUMAEY-UHFFFAOYSA-N 0 0 373.217 3.653 20 5 FHBDRN Cc1cc(C(=O)N[C@H](C)c2ccc(-n3cccn3)c(F)c2)ccc1[N+](=O)[O-] ZINC000505298694 942454345 /nfs/dbraw/zinc/45/43/45/942454345.db2.gz BZXBHERJQSBTNY-CYBMUJFWSA-N 0 0 368.368 3.719 20 5 FHBDRN Cc1cccc([C@H]2NC(=O)N([C@@H](C)c3ccc([N+](=O)[O-])cc3)C2=O)c1C ZINC000419957387 942459102 /nfs/dbraw/zinc/45/91/02/942459102.db2.gz BOKRSZSUFLZNBU-SUMWQHHRSA-N 0 0 353.378 3.566 20 5 FHBDRN COc1cccc([C@H]2CN(c3ccc([N+](=O)[O-])c4ncccc34)CCO2)c1 ZINC000413194788 942459857 /nfs/dbraw/zinc/45/98/57/942459857.db2.gz MAVRDHSGHVZTFK-LJQANCHMSA-N 0 0 365.389 3.730 20 5 FHBDRN CCCN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2C)c2ccc(F)cc21 ZINC001269108523 942461953 /nfs/dbraw/zinc/46/19/53/942461953.db2.gz AOWZNLHJIIEAMT-UHFFFAOYSA-N 0 0 357.385 3.919 20 5 FHBDRN C[C@@H](NC(=O)c1ccc(N2CCC[C@H](C)C2)c([N+](=O)[O-])c1)C(F)(F)F ZINC000424951012 942465218 /nfs/dbraw/zinc/46/52/18/942465218.db2.gz NZCUZAMUJKAQAF-WDEREUQCSA-N 0 0 359.348 3.512 20 5 FHBDRN O=[N+]([O-])c1cnc(NCc2cccc(COCC(F)(F)F)c2)c(F)c1 ZINC000413203297 942485302 /nfs/dbraw/zinc/48/53/02/942485302.db2.gz MNJDSORYVSPNHL-UHFFFAOYSA-N 0 0 359.279 3.820 20 5 FHBDRN Cc1nnc(Sc2ncc([N+](=O)[O-])cc2F)n1[C@@H]1CCC[C@@H](C)C1 ZINC000413214795 942488873 /nfs/dbraw/zinc/48/88/73/942488873.db2.gz WQAHINATVBUSTG-MWLCHTKSSA-N 0 0 351.407 3.931 20 5 FHBDRN O=C(COc1cccc([N+](=O)[O-])c1)N1CCC[C@H]1/C=C\c1ccccc1 ZINC000505373370 942492991 /nfs/dbraw/zinc/49/29/91/942492991.db2.gz SCZMEQVPJMFHOI-CPFIRTDXSA-N 0 0 352.390 3.678 20 5 FHBDRN CCOc1cc(C(=O)Nc2ccc3c(c2)CCCN3)c([N+](=O)[O-])cc1OC ZINC000237067905 942494881 /nfs/dbraw/zinc/49/48/81/942494881.db2.gz AKCYISZQSPDIQZ-UHFFFAOYSA-N 0 0 371.393 3.613 20 5 FHBDRN CN(CC(=O)N1CCC[C@@H]1/C=C\c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000505350423 942495286 /nfs/dbraw/zinc/49/52/86/942495286.db2.gz GOKRWCYZMRVWQE-SWNWVQGVSA-N 0 0 365.433 3.735 20 5 FHBDRN CN(CC(=O)N1CCC[C@H]1/C=C\c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000505350417 942495535 /nfs/dbraw/zinc/49/55/35/942495535.db2.gz GOKRWCYZMRVWQE-HWOXTHGCSA-N 0 0 365.433 3.735 20 5 FHBDRN CCOc1cc(C(=O)N(CC)c2cccc(OC)c2)c([N+](=O)[O-])cc1OC ZINC000501461060 942496461 /nfs/dbraw/zinc/49/64/61/942496461.db2.gz LNGXRZCXKOGVMT-UHFFFAOYSA-N 0 0 374.393 3.677 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)NCc1cnccc1C(C)(C)C ZINC000413689977 942498753 /nfs/dbraw/zinc/49/87/53/942498753.db2.gz FLEVLDFRPKPLOX-UHFFFAOYSA-N 0 0 358.398 3.618 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N2CCC[C@@H]2/C=C/c2ccccc2)c1 ZINC000505359247 942500476 /nfs/dbraw/zinc/50/04/76/942500476.db2.gz IFIJYSSXPMHABA-ZNFPLGDCSA-N 0 0 352.390 3.921 20 5 FHBDRN O=[N+]([O-])c1ccc(CN(CCO)Cc2ccc(Cl)c(Cl)c2)cc1 ZINC000502535415 942511931 /nfs/dbraw/zinc/51/19/31/942511931.db2.gz ZAMQGQKRAXWFQK-UHFFFAOYSA-N 0 0 355.221 3.896 20 5 FHBDRN CC(C)OC(=O)Cc1nc(CSCc2ccc([N+](=O)[O-])cc2)cs1 ZINC000513814030 942532593 /nfs/dbraw/zinc/53/25/93/942532593.db2.gz PWUIEKFVQDFIKT-UHFFFAOYSA-N 0 0 366.464 3.979 20 5 FHBDRN Cc1ccc(S(=O)(=O)N2CCCc3c([N+](=O)[O-])cccc32)c(Cl)c1 ZINC000513814009 942532975 /nfs/dbraw/zinc/53/29/75/942532975.db2.gz PLZIYBGXLHBUSS-UHFFFAOYSA-N 0 0 366.826 3.698 20 5 FHBDRN Cc1ccc(CN(C(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])C(C)C)s1 ZINC000434226072 942533770 /nfs/dbraw/zinc/53/37/70/942533770.db2.gz OODVTERDFNRVGB-UHFFFAOYSA-N 0 0 350.444 3.862 20 5 FHBDRN COc1cccc2c1CCN(c1ncc([N+](=O)[O-])cc1C(F)(F)F)C2 ZINC000413235980 942539215 /nfs/dbraw/zinc/53/92/15/942539215.db2.gz GBPBCNLAOYDFKF-UHFFFAOYSA-N 0 0 353.300 3.580 20 5 FHBDRN Cc1ccnc(OC2CCN(c3ccc([N+](=O)[O-])c4ncccc34)CC2)c1 ZINC000413237821 942540685 /nfs/dbraw/zinc/54/06/85/942540685.db2.gz HVUJIBDNQXBJTR-UHFFFAOYSA-N 0 0 364.405 3.894 20 5 FHBDRN Cc1cn([C@H](C)c2ccccc2)nc1NC(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000434239981 942541776 /nfs/dbraw/zinc/54/17/76/942541776.db2.gz OKYQFDFYCCBGBC-CQSZACIVSA-N 0 0 365.393 3.775 20 5 FHBDRN C[C@H]1[C@@H](c2ccccc2)CCN1C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000434240283 942541849 /nfs/dbraw/zinc/54/18/49/942541849.db2.gz RGXRBKACACGDRZ-KXBFYZLASA-N 0 0 363.417 3.954 20 5 FHBDRN CC(C)c1[nH]nc(C(=O)Nc2cccc(CC(F)(F)F)c2)c1[N+](=O)[O-] ZINC000434241501 942542491 /nfs/dbraw/zinc/54/24/91/942542491.db2.gz CURLDHRQTCNGKT-UHFFFAOYSA-N 0 0 356.304 3.798 20 5 FHBDRN C[C@@H]1CCN(C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)c2c(O)cccc21 ZINC000413716772 942544391 /nfs/dbraw/zinc/54/43/91/942544391.db2.gz UYESGLAIALGWEI-OAUYIBNBSA-N 0 0 352.390 3.944 20 5 FHBDRN CC(C)(CNC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F)OCC1CC1 ZINC000413711802 942544605 /nfs/dbraw/zinc/54/46/05/942544605.db2.gz JEXPBWUYDPFCKD-UHFFFAOYSA-N 0 0 373.356 3.523 20 5 FHBDRN O=C(Nc1ccc(-c2ccccn2)cn1)c1cc([N+](=O)[O-])ccc1Cl ZINC000378296438 942545038 /nfs/dbraw/zinc/54/50/38/942545038.db2.gz CFIOWMYFYVWSGZ-UHFFFAOYSA-N 0 0 354.753 3.958 20 5 FHBDRN O=C([C@@H]1CC[C@@H]2C[C@@H]2C1)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F ZINC000421420475 942550308 /nfs/dbraw/zinc/55/03/08/942550308.db2.gz BCNMIDDCJUJZMY-YRGRVCCFSA-N 0 0 356.344 3.922 20 5 FHBDRN CC(C)Oc1cccc(CC(=O)N2CCCc3c([N+](=O)[O-])cccc32)c1 ZINC000513840321 942551713 /nfs/dbraw/zinc/55/17/13/942551713.db2.gz AKZNZDVTBBTOCL-UHFFFAOYSA-N 0 0 354.406 3.904 20 5 FHBDRN COc1cc(C2(C(=O)N3CCCc4c([N+](=O)[O-])cccc43)CC2)ccc1C ZINC000513842698 942552744 /nfs/dbraw/zinc/55/27/44/942552744.db2.gz MYXQMWBFXMTLTA-UHFFFAOYSA-N 0 0 366.417 3.923 20 5 FHBDRN Cc1n[nH]c(C)c1[C@H]1CCCN1C(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000183562370 942554453 /nfs/dbraw/zinc/55/44/53/942554453.db2.gz SBQXAZKULUHEEM-QLJPJBMISA-N 0 0 360.389 3.541 20 5 FHBDRN Cc1n[nH]c(C)c1[C@H]1CCCN1C(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000183562338 942554525 /nfs/dbraw/zinc/55/45/25/942554525.db2.gz SBQXAZKULUHEEM-MGPLVRAMSA-N 0 0 360.389 3.541 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])c[nH]1)N1CCC[C@@H](COc2ccccc2Cl)C1 ZINC000513862250 942557288 /nfs/dbraw/zinc/55/72/88/942557288.db2.gz SOIKFDWMSJADDP-GFCCVEGCSA-N 0 0 363.801 3.508 20 5 FHBDRN Cc1ccc(NC(=O)c2cc([N+](=O)[O-])c(C)cc2C)cc1C(=O)NC(C)C ZINC000421453591 942565658 /nfs/dbraw/zinc/56/56/58/942565658.db2.gz CWQKHKLPEOYBRV-UHFFFAOYSA-N 0 0 369.421 3.911 20 5 FHBDRN CC[C@H]1C[C@]1(NC(=O)CCn1nc(C)c([N+](=O)[O-])c1C)c1cccc(C)c1 ZINC000501608020 942566239 /nfs/dbraw/zinc/56/62/39/942566239.db2.gz OFGVKNMVIQCXCQ-OXJNMPFZSA-N 0 0 370.453 3.548 20 5 FHBDRN Cc1cnccc1OC1CCN(c2nccc3ccc([N+](=O)[O-])cc32)CC1 ZINC000413257012 942568886 /nfs/dbraw/zinc/56/88/86/942568886.db2.gz ACTJICYATPMARL-UHFFFAOYSA-N 0 0 364.405 3.894 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)NC[C@H](C)COCc2ccccc2)c1 ZINC000501598740 942570163 /nfs/dbraw/zinc/57/01/63/942570163.db2.gz ACRZXLPADONLKK-AWEZNQCLSA-N 0 0 374.462 3.899 20 5 FHBDRN CCc1[nH]nc(C(=O)Nc2cc(-c3cccnc3)ccc2C)c1[N+](=O)[O-] ZINC000366554606 942572679 /nfs/dbraw/zinc/57/26/79/942572679.db2.gz XHWKKGITCXTZGM-UHFFFAOYSA-N 0 0 351.366 3.503 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCCC[C@H]1OC(F)F ZINC000501627325 942573418 /nfs/dbraw/zinc/57/34/18/942573418.db2.gz GUAGFXCLRJAPPU-LERXQTSPSA-N 0 0 374.409 3.742 20 5 FHBDRN CC(=O)Nc1c2cccc(C)c2n(C)c1OCc1cccc([N+](=O)[O-])c1 ZINC000502602135 942575070 /nfs/dbraw/zinc/57/50/70/942575070.db2.gz WHSOGWOPOVROTO-UHFFFAOYSA-N 0 0 353.378 3.932 20 5 FHBDRN CCCN(CC)C(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000501612728 942575969 /nfs/dbraw/zinc/57/59/69/942575969.db2.gz KNIQPMZCQXSFPT-UHFFFAOYSA-N 0 0 350.362 3.964 20 5 FHBDRN CC(C)c1nccc(C2CCN(C(=O)c3csc([N+](=O)[O-])c3)CC2)n1 ZINC000378314301 942578533 /nfs/dbraw/zinc/57/85/33/942578533.db2.gz VBTFLKKIFXSQGS-UHFFFAOYSA-N 0 0 360.439 3.590 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N[C@@H](c1ccccc1)[C@H]1CCCO1 ZINC000421460247 942582544 /nfs/dbraw/zinc/58/25/44/942582544.db2.gz FWQNQKUAMLZOMC-MOPGFXCFSA-N 0 0 354.406 3.862 20 5 FHBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])Nc1cnc2ccccc2n1 ZINC000543120269 942583680 /nfs/dbraw/zinc/58/36/80/942583680.db2.gz BOJBTSZESCMDLI-UHFFFAOYSA-N 0 0 374.809 3.922 20 5 FHBDRN Cc1cc(C2=CCN(Cc3ncc(C4CC4)o3)CC2)cc([N+](=O)[O-])c1N ZINC000378323223 942588954 /nfs/dbraw/zinc/58/89/54/942588954.db2.gz JCVAPBWQHFXFBZ-UHFFFAOYSA-N 0 0 354.410 3.640 20 5 FHBDRN CCn1ccc(CN(C)C(=O)c2ccnc(-c3ccccc3)c2[N+](=O)[O-])c1 ZINC001269137209 942589164 /nfs/dbraw/zinc/58/91/64/942589164.db2.gz NCPDIVCUIVNDOS-UHFFFAOYSA-N 0 0 364.405 3.750 20 5 FHBDRN Cc1cc(C)cc(CN(C)C(=O)c2cc([N+](=O)[O-])ccc2SCCO)c1 ZINC000434345525 942593923 /nfs/dbraw/zinc/59/39/23/942593923.db2.gz AFVWTDSWSBXBHD-UHFFFAOYSA-N 0 0 374.462 3.568 20 5 FHBDRN COCc1nccc([C@@H]2CCCN(c3c(Cl)cccc3[N+](=O)[O-])C2)n1 ZINC000366566868 942594560 /nfs/dbraw/zinc/59/45/60/942594560.db2.gz CMKSSQQYWUOAMC-GFCCVEGCSA-N 0 0 362.817 3.569 20 5 FHBDRN CCOC(=O)CN(C(=O)c1ccc([N+](=O)[O-])c(C)c1)[C@H](C)c1ccccc1 ZINC000513910792 942602236 /nfs/dbraw/zinc/60/22/36/942602236.db2.gz GINBZYNFDINOHI-OAHLLOKOSA-N 0 0 370.405 3.670 20 5 FHBDRN CCOc1ccc(C(=O)N(CC)c2ccc(OC)c(OC)c2)cc1[N+](=O)[O-] ZINC000501672688 942604405 /nfs/dbraw/zinc/60/44/05/942604405.db2.gz HGYVUTFCQFVAGC-UHFFFAOYSA-N 0 0 374.393 3.677 20 5 FHBDRN COc1ccc(CNC(=O)[C@H]2C[C@H]2c2cccc(Cl)c2)cc1[N+](=O)[O-] ZINC000501678701 942607695 /nfs/dbraw/zinc/60/76/95/942607695.db2.gz MHXHQPSCBYCIBY-GJZGRUSLSA-N 0 0 360.797 3.677 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCN([C@@H](C)c2ccsc2)CC1 ZINC000421499265 942611795 /nfs/dbraw/zinc/61/17/95/942611795.db2.gz ASEJARFUXQVRSW-HNNXBMFYSA-N 0 0 373.478 3.792 20 5 FHBDRN CC1(C)CN(c2ncc([N+](=O)[O-])cc2C(F)(F)F)C[C@H](C(F)(F)F)O1 ZINC000413294338 942613649 /nfs/dbraw/zinc/61/36/49/942613649.db2.gz BAMNRRFXTNFXMO-SECBINFHSA-N 0 0 373.253 3.555 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc3oc(CC)nc3c2)c1 ZINC000549419495 942619286 /nfs/dbraw/zinc/61/92/86/942619286.db2.gz ITTBIGPVVGRZON-UHFFFAOYSA-N 0 0 355.350 3.949 20 5 FHBDRN COc1ccc(CNC(=O)c2ccc(F)c(C(F)(F)F)c2)cc1[N+](=O)[O-] ZINC000501697946 942620402 /nfs/dbraw/zinc/62/04/02/942620402.db2.gz AXNYRCUDPSRFCK-UHFFFAOYSA-N 0 0 372.274 3.691 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](CO)CC1CCCC1 ZINC000513942893 942621731 /nfs/dbraw/zinc/62/17/31/942621731.db2.gz UXLKHMZXLAZBDZ-CQSZACIVSA-N 0 0 366.483 3.766 20 5 FHBDRN Cc1nc([C@H]2CCCCCN2C(=O)c2cc([N+](=O)[O-])c(C)cc2C)no1 ZINC000421520633 942625970 /nfs/dbraw/zinc/62/59/70/942625970.db2.gz XKPIAWWRJHXOHI-OAHLLOKOSA-N 0 0 358.398 3.661 20 5 FHBDRN CCOc1cc(CN(C)c2ccncc2[N+](=O)[O-])ccc1OC(F)F ZINC000066808410 942629333 /nfs/dbraw/zinc/62/93/33/942629333.db2.gz DYLQTMLGOMUWBD-UHFFFAOYSA-N 0 0 353.325 3.626 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NCc1nc2ccccc2n1C1CC1 ZINC000421526544 942638608 /nfs/dbraw/zinc/63/86/08/942638608.db2.gz WXLJRXDOJBTIPQ-UHFFFAOYSA-N 0 0 364.405 3.826 20 5 FHBDRN O=[N+]([O-])c1ccc2ccnc(N3CCC(CO)(c4ccccc4)CC3)c2c1 ZINC000413305066 942639631 /nfs/dbraw/zinc/63/96/31/942639631.db2.gz QVXGIOCZJYOZDL-UHFFFAOYSA-N 0 0 363.417 3.674 20 5 FHBDRN Cc1c2ccc(NC(=O)[C@@H]3C[C@H]3c3ccc([N+](=O)[O-])cc3)cc2nn1C ZINC000413823235 942649558 /nfs/dbraw/zinc/64/95/58/942649558.db2.gz MMMGQQRVQVXCHV-DLBZAZTESA-N 0 0 350.378 3.532 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCCN3c4ccccc4C[C@H]3C2)c2cccnc21 ZINC000413315119 942653611 /nfs/dbraw/zinc/65/36/11/942653611.db2.gz UTYOBRNRVPWPIQ-INIZCTEOSA-N 0 0 360.417 3.784 20 5 FHBDRN O=[N+]([O-])c1cnc(N[C@@H]2CCO[C@@H](c3ccccn3)C2)c(C(F)(F)F)c1 ZINC000413315926 942656953 /nfs/dbraw/zinc/65/69/53/942656953.db2.gz LGJJUMGNZLFNME-QMTHXVAHSA-N 0 0 368.315 3.736 20 5 FHBDRN CCCc1nc(C)c(CNC(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)o1 ZINC000412357281 942661927 /nfs/dbraw/zinc/66/19/27/942661927.db2.gz HGWFNQCYCJXTSA-UHFFFAOYSA-N 0 0 361.398 3.561 20 5 FHBDRN Cc1nn(C)c2cc(NC(=O)c3ccc([N+](=O)[O-])c(OC(C)C)c3)ccc12 ZINC000412360239 942662865 /nfs/dbraw/zinc/66/28/65/942662865.db2.gz RIIGEALDUFDZLI-UHFFFAOYSA-N 0 0 368.393 3.829 20 5 FHBDRN O=C(NCCOc1ccc([N+](=O)[O-])cc1)[C@@H]1CCC[C@@H]1Cc1ccccc1 ZINC001125876614 942663996 /nfs/dbraw/zinc/66/39/96/942663996.db2.gz OILKIAJBJCGFQH-YLJYHZDGSA-N 0 0 368.433 3.749 20 5 FHBDRN Cc1cnc(OC(C)C)c(NC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)c1 ZINC000413844435 942664284 /nfs/dbraw/zinc/66/42/84/942664284.db2.gz RDFUOEQJRZIJSI-JKSUJKDBSA-N 0 0 355.394 3.828 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N[C@H](C)[C@@H]1OCCc2sccc21 ZINC000421574070 942666375 /nfs/dbraw/zinc/66/63/75/942666375.db2.gz KNNJZNCLKZGXBI-PXAZEXFGSA-N 0 0 360.435 3.705 20 5 FHBDRN CC[C@@H](C)CNC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 ZINC000421577422 942668685 /nfs/dbraw/zinc/66/86/85/942668685.db2.gz FQIBMSQSXJTVGV-KGLIPLIRSA-N 0 0 356.426 3.939 20 5 FHBDRN O=C(NCC[C@H]1CCc2ccccc21)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412366095 942670806 /nfs/dbraw/zinc/67/08/06/942670806.db2.gz DSKQWPJSFFNMKY-LSTHTHJFSA-N 0 0 350.418 3.935 20 5 FHBDRN CC[C@@H](NC(=O)NCCNc1ccccc1[N+](=O)[O-])c1ccc(C)cc1 ZINC000514017088 942673430 /nfs/dbraw/zinc/67/34/30/942673430.db2.gz DJNAENUNSKRGOG-MRXNPFEDSA-N 0 0 356.426 3.766 20 5 FHBDRN Cc1ccc(NC(=O)c2ccc(N3CCOC[C@H](C)C3)c([N+](=O)[O-])c2)cc1 ZINC000513998326 942674752 /nfs/dbraw/zinc/67/47/52/942674752.db2.gz BAACFEFWNXBEEI-OAHLLOKOSA-N 0 0 369.421 3.628 20 5 FHBDRN C[C@@H]1CCCN(C(=O)COc2ccc([N+](=O)[O-])cc2Cc2ccccc2)C1 ZINC000016458756 942675127 /nfs/dbraw/zinc/67/51/27/942675127.db2.gz HVIBIRCTVIIPNK-MRXNPFEDSA-N 0 0 368.433 3.823 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1CN1CCCC[C@H]1c1noc(C2CC2)n1 ZINC000366612202 942679909 /nfs/dbraw/zinc/67/99/09/942679909.db2.gz YBYZOYFKRLBUNK-HNNXBMFYSA-N 0 0 358.398 3.591 20 5 FHBDRN CN(Cc1csc(Nc2ccccc2)n1)Cc1ccccc1[N+](=O)[O-] ZINC000501812846 942679926 /nfs/dbraw/zinc/67/99/26/942679926.db2.gz HJYLMFNCCSQWOJ-UHFFFAOYSA-N 0 0 354.435 3.849 20 5 FHBDRN COc1cc(N2CCC3(CC2)OCCc2ccccc23)c(F)cc1[N+](=O)[O-] ZINC000413333650 942683300 /nfs/dbraw/zinc/68/33/00/942683300.db2.gz NLELBMDJEDIYRX-UHFFFAOYSA-N 0 0 372.396 3.811 20 5 FHBDRN Cc1noc(CCCNc2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])n1 ZINC000066816156 942693727 /nfs/dbraw/zinc/69/37/27/942693727.db2.gz NLLCOBNDMUFWER-UHFFFAOYSA-N 0 0 366.377 3.562 20 5 FHBDRN C[C@@H](C(=O)OC(C)(C)C)c1noc([C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)n1 ZINC000420499483 942706780 /nfs/dbraw/zinc/70/67/80/942706780.db2.gz CWHGSDOWUSMQAN-DDTOSNHZSA-N 0 0 359.382 3.694 20 5 FHBDRN Cc1sc(C(=O)N2CCC[C@@H](C(=O)OC(C)(C)C)[C@H]2C)cc1[N+](=O)[O-] ZINC000421631763 942709079 /nfs/dbraw/zinc/70/90/79/942709079.db2.gz KNMUNSBDKMBVHG-ZYHUDNBSSA-N 0 0 368.455 3.547 20 5 FHBDRN Cc1nc([C@@H]2CCCCCN2C(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)no1 ZINC000501842488 942710096 /nfs/dbraw/zinc/71/00/96/942710096.db2.gz OZYPCEZJQWEHQH-HNNXBMFYSA-N 0 0 369.381 3.525 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1Cc1nc([C@@H]2CCC(C)(C)c3ccccc32)no1 ZINC000420512151 942716874 /nfs/dbraw/zinc/71/68/74/942716874.db2.gz VSUQFNJOCVRJHU-CQSZACIVSA-N 0 0 367.409 3.734 20 5 FHBDRN O=C(Nc1ccc(OCc2ccccc2)cc1)c1cc([N+](=O)[O-])c[nH]c1=O ZINC000016493387 942731607 /nfs/dbraw/zinc/73/16/07/942731607.db2.gz ZEAXOMBHUKTGAZ-UHFFFAOYSA-N 0 0 365.345 3.527 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCO[C@@H](CC)C1 ZINC000421672483 942737311 /nfs/dbraw/zinc/73/73/11/942737311.db2.gz UOCZZEASJYSPPX-JSGCOSHPSA-N 0 0 352.456 3.784 20 5 FHBDRN CCOc1cccc(CN[C@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)c1 ZINC000514092570 942743010 /nfs/dbraw/zinc/74/30/10/942743010.db2.gz FOEDXXSJZOEMCN-IBGZPJMESA-N 0 0 366.421 3.606 20 5 FHBDRN O=C(c1ccc(-c2cc[nH]n2)s1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000431866362 942748694 /nfs/dbraw/zinc/74/86/94/942748694.db2.gz UTYGKPOGGJVVJZ-UHFFFAOYSA-N 0 0 368.418 3.851 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc3c(c2)C(=O)CCCC3)c1 ZINC000421711213 942764630 /nfs/dbraw/zinc/76/46/30/942764630.db2.gz AOVAMCMMGNGKMJ-UHFFFAOYSA-N 0 0 354.362 3.765 20 5 FHBDRN CCCc1n[nH]c(C(=O)N2CC[C@](C)(CCc3ccccc3)C2)c1[N+](=O)[O-] ZINC000434572187 942765315 /nfs/dbraw/zinc/76/53/15/942765315.db2.gz YXAJJKXMFQZOMU-FQEVSTJZSA-N 0 0 370.453 3.755 20 5 FHBDRN Cc1ccc(NC(=O)N[C@@H]2C[C@H]2c2cc(F)c(F)c(F)c2)cc1[N+](=O)[O-] ZINC000436260652 942766695 /nfs/dbraw/zinc/76/66/95/942766695.db2.gz MXJXMUSWQXMJSW-SMDDNHRTSA-N 0 0 365.311 3.998 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N(CCOC)CC(C)C ZINC000502833580 942785096 /nfs/dbraw/zinc/78/50/96/942785096.db2.gz RPJFYBDEXGSGHM-UHFFFAOYSA-N 0 0 354.472 3.842 20 5 FHBDRN Cn1ncc([N+](=O)[O-])c1NC(=O)c1ccc(-c2ccc(Cl)cc2)s1 ZINC001269819215 942788066 /nfs/dbraw/zinc/78/80/66/942788066.db2.gz GDLPILFZDFXYEJ-UHFFFAOYSA-N 0 0 362.798 3.963 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N(C)CCCc1nc2ccccc2[nH]1 ZINC000421746621 942793783 /nfs/dbraw/zinc/79/37/83/942793783.db2.gz DTOMLKHBGJNQBH-UHFFFAOYSA-N 0 0 366.421 3.793 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NC[C@H]1CCN(c2ccc(F)cc2)C1 ZINC000421749208 942794279 /nfs/dbraw/zinc/79/42/79/942794279.db2.gz PGJPLSUCYIDYRJ-OAHLLOKOSA-N 0 0 371.412 3.607 20 5 FHBDRN Cc1ccc(C[C@@H](C)NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)s1 ZINC000514178621 942804327 /nfs/dbraw/zinc/80/43/27/942804327.db2.gz OLYDMVOOEAMMIH-SECBINFHSA-N 0 0 370.377 3.927 20 5 FHBDRN COC1([C@@H](C)NC(=O)c2cc3ccccc3c3cccnc23)CCOCC1 ZINC000421764805 942811359 /nfs/dbraw/zinc/81/13/59/942811359.db2.gz YCIOBILLSGURGE-OAHLLOKOSA-N 0 0 364.445 3.702 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)Nc1cccc([C@H](C)C(=O)OC)c1 ZINC000413942108 942812285 /nfs/dbraw/zinc/81/22/85/942812285.db2.gz VZYBZGUJKHZPKP-LBPRGKRZSA-N 0 0 372.377 3.522 20 5 FHBDRN Cc1csc([C@H](NC(=O)NC[C@@H](C)c2ccccc2[N+](=O)[O-])C2CC2)n1 ZINC000893244450 942813415 /nfs/dbraw/zinc/81/34/15/942813415.db2.gz OXEBJDTYKCIQRU-BDJLRTHQSA-N 0 0 374.466 3.914 20 5 FHBDRN O=C(c1ccc(OC(F)F)c([N+](=O)[O-])c1)N1CC2(CC2)c2ccccc21 ZINC000514190341 942817328 /nfs/dbraw/zinc/81/73/28/942817328.db2.gz QVJWWKUAQITFSD-UHFFFAOYSA-N 0 0 360.316 3.888 20 5 FHBDRN Cc1cc(NC2CCN(C(=O)CCc3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000514191842 942817787 /nfs/dbraw/zinc/81/77/87/942817787.db2.gz CKKYTPKVMUDJAT-UHFFFAOYSA-N 0 0 367.449 3.939 20 5 FHBDRN Cc1nn(CC(=O)N(C2CC2)C2CCC(C)CC2)c2ccc([N+](=O)[O-])cc12 ZINC000502890808 942819989 /nfs/dbraw/zinc/81/99/89/942819989.db2.gz YEFQQJZHBJOUMP-UHFFFAOYSA-N 0 0 370.453 3.823 20 5 FHBDRN O=C(NCc1nccc2ccccc21)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514218109 942826378 /nfs/dbraw/zinc/82/63/78/942826378.db2.gz JYRSDHCJHKFKDY-UHFFFAOYSA-N 0 0 373.315 3.674 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1F)N1CC[C@@H](C(F)(F)F)C2(CCC2)C1 ZINC000514218055 942826484 /nfs/dbraw/zinc/82/64/84/942826484.db2.gz HLJMYWRNXAUYPQ-CQSZACIVSA-N 0 0 374.334 3.858 20 5 FHBDRN C[C@H]1Cc2ccccc2CN1C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514220202 942827386 /nfs/dbraw/zinc/82/73/86/942827386.db2.gz YOGLISYMZIGVIH-NSHDSACASA-N 0 0 362.332 3.783 20 5 FHBDRN CCOc1cc(CS(=O)(=O)Cc2cc(C)ccc2C)ccc1[N+](=O)[O-] ZINC000434638269 942830348 /nfs/dbraw/zinc/83/03/48/942830348.db2.gz SUQFOFOUPCWRNH-UHFFFAOYSA-N 0 0 363.435 3.725 20 5 FHBDRN Cc1nn(CCC(=O)N2CC(C)(C)C[C@@H]2c2ccccc2)c(C)c1[N+](=O)[O-] ZINC000425127568 942833486 /nfs/dbraw/zinc/83/34/86/942833486.db2.gz ZIQOCMORRVGZMJ-QGZVFWFLSA-N 0 0 370.453 3.798 20 5 FHBDRN Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)N1CC[C@H](Cc2ccncc2)C1 ZINC000367091948 942838357 /nfs/dbraw/zinc/83/83/57/942838357.db2.gz MMKVHXCYHMSEKP-CQSZACIVSA-N 0 0 358.373 3.534 20 5 FHBDRN COc1cc(Cc2noc(-c3cc(C)cc(C)c3)n2)c([N+](=O)[O-])c(OC)c1 ZINC000584569123 942838535 /nfs/dbraw/zinc/83/85/35/942838535.db2.gz JRLHBLTZTCPKLF-UHFFFAOYSA-N 0 0 369.377 3.870 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@H]1c1ccccc1C(F)(F)F ZINC000505459725 942839955 /nfs/dbraw/zinc/83/99/55/942839955.db2.gz HWGVWXOTZRSURW-DZGCQCFKSA-N 0 0 365.311 3.603 20 5 FHBDRN COc1cccc(-c2noc(CN[C@@H](C)c3cccc([N+](=O)[O-])c3)n2)c1 ZINC000378510737 942845481 /nfs/dbraw/zinc/84/54/81/942845481.db2.gz IQIRAKKJQSZREW-LBPRGKRZSA-N 0 0 354.366 3.504 20 5 FHBDRN Cc1ccccc1[C@]1(F)CCN([C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000502905086 942845445 /nfs/dbraw/zinc/84/54/45/942845445.db2.gz CUXNPOZYDAPCAI-YWZLYKJASA-N 0 0 371.412 3.801 20 5 FHBDRN Cc1cc(NC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])cn2ccnc12 ZINC000502927459 942847987 /nfs/dbraw/zinc/84/79/87/942847987.db2.gz XRTMRTPPSNYUEY-UHFFFAOYSA-N 0 0 374.784 3.612 20 5 FHBDRN COC(=O)c1cnc(N[C@H](C)c2cccc(OC(F)F)c2)c([N+](=O)[O-])c1 ZINC000190167902 942848202 /nfs/dbraw/zinc/84/82/02/942848202.db2.gz PHHIEDYYPRVXOY-SECBINFHSA-N 0 0 367.308 3.551 20 5 FHBDRN COc1ccc(OCC(=O)Nc2cc(Cl)ccc2C)cc1[N+](=O)[O-] ZINC000190198737 942853968 /nfs/dbraw/zinc/85/39/68/942853968.db2.gz XPQOVZIDIKXDNZ-UHFFFAOYSA-N 0 0 350.758 3.583 20 5 FHBDRN O=C(c1ccc(F)cc1)C1CCN(Cc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000434677982 942863101 /nfs/dbraw/zinc/86/31/01/942863101.db2.gz ASFUXUNUJJQRHX-UHFFFAOYSA-N 0 0 360.360 3.968 20 5 FHBDRN Cc1cc(F)cc([C@@]2(F)CCN(Cc3nc4cc([N+](=O)[O-])ccc4[nH]3)C2)c1 ZINC000502955522 942863588 /nfs/dbraw/zinc/86/35/88/942863588.db2.gz FTKZVNAVPCTCGK-LJQANCHMSA-N 0 0 372.375 3.989 20 5 FHBDRN O=[N+]([O-])c1nn(CCCOc2cccc(Cl)c2)cc1Br ZINC000519114071 942864991 /nfs/dbraw/zinc/86/49/91/942864991.db2.gz BOAXKFIBHZEUNV-UHFFFAOYSA-N 0 0 360.595 3.676 20 5 FHBDRN C[C@@H]1CCC[C@@H]1CNC(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000545459472 942866855 /nfs/dbraw/zinc/86/68/55/942866855.db2.gz YLRQTALIFCNUKB-ZYHUDNBSSA-N 0 0 359.348 3.849 20 5 FHBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)NC(C)(C)COC(C)C ZINC000413986469 942868515 /nfs/dbraw/zinc/86/85/15/942868515.db2.gz IKKXYSBMSYMRLR-UHFFFAOYSA-N 0 0 373.247 3.599 20 5 FHBDRN CC(C)OCC(C)(C)NC(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC000413990276 942869081 /nfs/dbraw/zinc/86/90/81/942869081.db2.gz OPAWVHCCCHKZQU-UHFFFAOYSA-N 0 0 357.410 3.590 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NC[C@](C)(Cc1ccccc1)[C@@H](C)O ZINC000421900099 942878094 /nfs/dbraw/zinc/87/80/94/942878094.db2.gz XAVILWSYBADJJL-IERDGZPVSA-N 0 0 370.449 3.571 20 5 FHBDRN CC(=O)CN(CC(C)C)C(=O)c1cc([N+](=O)[O-])ccc1SC(C)C ZINC000421902439 942879080 /nfs/dbraw/zinc/87/90/80/942879080.db2.gz CWVWHMZMUPYUSC-UHFFFAOYSA-N 0 0 352.456 3.783 20 5 FHBDRN O=C(c1ccc(NC2CC2)c([N+](=O)[O-])c1)N1CCC[C@@H](CC(F)(F)F)C1 ZINC000421934495 942886772 /nfs/dbraw/zinc/88/67/72/942886772.db2.gz CKOCEZPALOKHOO-NSHDSACASA-N 0 0 371.359 3.974 20 5 FHBDRN CCOc1ccc(C(=O)N2CCC[C@@H](CC(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000421937868 942888814 /nfs/dbraw/zinc/88/88/14/942888814.db2.gz IWILRPBFEHCHIX-NSHDSACASA-N 0 0 360.332 3.798 20 5 FHBDRN CCc1ccc([C@H]2CN(C(=O)c3ccc([N+](=O)[O-])cc3Cl)CCN2)cc1 ZINC000505483773 942890342 /nfs/dbraw/zinc/89/03/42/942890342.db2.gz MBLSICSDVXPVJT-GOSISDBHSA-N 0 0 373.840 3.597 20 5 FHBDRN COc1ccc(OC(F)F)c(NCc2cc(OC)c(F)cc2[N+](=O)[O-])c1 ZINC000184004558 942895625 /nfs/dbraw/zinc/89/56/25/942895625.db2.gz PXPUYMZZHKABDX-UHFFFAOYSA-N 0 0 372.299 3.965 20 5 FHBDRN O=C(c1c[nH]c2cc([N+](=O)[O-])ccc12)N1CCC[C@@H](CC(F)(F)F)C1 ZINC000421949246 942901920 /nfs/dbraw/zinc/90/19/20/942901920.db2.gz XFDRHQVBIIAGDS-JTQLQIEISA-N 0 0 355.316 3.881 20 5 FHBDRN CC[C@@H]1CN(C(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[C@H](CC)O1 ZINC000421961050 942909883 /nfs/dbraw/zinc/90/98/83/942909883.db2.gz FLBUBHJVBJWSJN-TXEJJXNPSA-N 0 0 360.332 3.643 20 5 FHBDRN CCOc1ccc(C(=O)N2C[C@H]3CCC(=O)c4cccc2c43)cc1[N+](=O)[O-] ZINC000183840256 942910439 /nfs/dbraw/zinc/91/04/39/942910439.db2.gz LUTZRIMQWWBLRG-CYBMUJFWSA-N 0 0 366.373 3.714 20 5 FHBDRN Cc1sc(S(=O)(=O)N2Cc3sccc3CC2(C)C)cc1[N+](=O)[O-] ZINC000416524240 942912131 /nfs/dbraw/zinc/91/21/31/942912131.db2.gz UJEHVJBTYYUTCY-UHFFFAOYSA-N 0 0 372.493 3.552 20 5 FHBDRN O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1CC[C@@H](n2ncc3ccccc32)C1 ZINC000378581538 942913253 /nfs/dbraw/zinc/91/32/53/942913253.db2.gz LMJXAKUYVUQBPF-OAHLLOKOSA-N 0 0 370.796 3.685 20 5 FHBDRN CC[C@H]1C[C@H](NC(=O)c2cccc3c(=O)c4cccc(F)c4[nH]c23)CCO1 ZINC000421993429 942927392 /nfs/dbraw/zinc/92/73/92/942927392.db2.gz RULAASGYZDMZFE-OLZOCXBDSA-N 0 0 368.408 3.508 20 5 FHBDRN O=C(CO[C@@H]1CCCc2ccccc21)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000430117256 942929694 /nfs/dbraw/zinc/92/96/94/942929694.db2.gz YRELUINPPBIURD-LJQANCHMSA-N 0 0 352.390 3.578 20 5 FHBDRN CN([C@@H]1CCC[C@@H]1c1ccccc1)S(=O)(=O)Cc1ccccc1[N+](=O)[O-] ZINC000416540146 942931612 /nfs/dbraw/zinc/93/16/12/942931612.db2.gz GRYACHFLCYWGPE-IEBWSBKVSA-N 0 0 374.462 3.693 20 5 FHBDRN COc1cc(CSc2nnc(OC(C)C)s2)c([N+](=O)[O-])cc1F ZINC000183853509 942932142 /nfs/dbraw/zinc/93/21/42/942932142.db2.gz ZHVGRIBJMTVFDJ-UHFFFAOYSA-N 0 0 359.404 3.674 20 5 FHBDRN CC(C)CCSc1ccc(C(=O)N2C[C@@H](O)CC[C@@H]2C)cc1[N+](=O)[O-] ZINC000422023614 942941883 /nfs/dbraw/zinc/94/18/83/942941883.db2.gz YBQAHNNUPNJZIY-ZFWWWQNUSA-N 0 0 366.483 3.718 20 5 FHBDRN COc1ccc2c(c1)C[C@@H](C(C)C)CN2C(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000422031278 942946818 /nfs/dbraw/zinc/94/68/18/942946818.db2.gz BXRXAABXYDULMQ-CQSZACIVSA-N 0 0 369.421 3.661 20 5 FHBDRN COc1cc(C(=O)N2C[C@@H](C)C[C@H]2c2cccnc2)cc([N+](=O)[O-])c1C ZINC000190218179 942947536 /nfs/dbraw/zinc/94/75/36/942947536.db2.gz VIOQDVVAMXZREO-SJCJKPOMSA-N 0 0 355.394 3.530 20 5 FHBDRN C[C@H](O)c1ccc(CNC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000178359421 942958704 /nfs/dbraw/zinc/95/87/04/942958704.db2.gz WLHRJFBPVVXASC-AWEZNQCLSA-N 0 0 369.421 3.522 20 5 FHBDRN O=[N+]([O-])c1ccc2oc(CSc3n[nH]c(-c4ccccc4)n3)nc2c1 ZINC000434797035 942961166 /nfs/dbraw/zinc/96/11/66/942961166.db2.gz SMLDGIUHJCBNFP-UHFFFAOYSA-N 0 0 353.363 3.813 20 5 FHBDRN CC[C@H](CC(F)(F)F)NC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000545462652 942961956 /nfs/dbraw/zinc/96/19/56/942961956.db2.gz FXPSXGOIQOTZKU-PSASIEDQSA-N 0 0 368.739 3.863 20 5 FHBDRN CN(CC(=O)Nc1c(Cl)cccc1Cl)Cc1cccc([N+](=O)[O-])c1 ZINC000016636049 942968873 /nfs/dbraw/zinc/96/88/73/942968873.db2.gz LUBOHAUAINJJHN-UHFFFAOYSA-N 0 0 368.220 3.972 20 5 FHBDRN CCN(C(=O)CCCNc1ccc([N+](=O)[O-])cc1)c1ccc(OC)cc1 ZINC000505522878 942970917 /nfs/dbraw/zinc/97/09/17/942970917.db2.gz XGHFCTATQHZPDT-UHFFFAOYSA-N 0 0 357.410 3.849 20 5 FHBDRN CO[C@H]1CCOc2c(NC(=O)CSc3ccc([N+](=O)[O-])cc3)cccc21 ZINC000468678612 942994329 /nfs/dbraw/zinc/99/43/29/942994329.db2.gz XOWIIDDMOHWJBT-INIZCTEOSA-N 0 0 374.418 3.796 20 5 FHBDRN CCCCCn1cc(CNC(=O)c2ccc(OCC)c([N+](=O)[O-])c2)c(C)n1 ZINC000503143453 942998977 /nfs/dbraw/zinc/99/89/77/942998977.db2.gz SKZSEGFCUAPOSQ-UHFFFAOYSA-N 0 0 374.441 3.619 20 5 FHBDRN O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1C[C@H]2CCC(=O)c3cccc1c32 ZINC000183859065 942999796 /nfs/dbraw/zinc/99/97/96/942999796.db2.gz IQFYKFZGYQXHMM-SNVBAGLBSA-N 0 0 356.765 3.969 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N[C@@H]2CCC(C)(C)c3ccccc32)c1[N+](=O)[O-] ZINC000434187139 943006853 /nfs/dbraw/zinc/00/68/53/943006853.db2.gz PQRSMSGNRUFLBY-CQSZACIVSA-N 0 0 356.426 3.984 20 5 FHBDRN CCCn1ncc(NC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)c1C1CC1 ZINC000412383332 943007129 /nfs/dbraw/zinc/00/71/29/943007129.db2.gz NSVROLCHLUXICA-JKSUJKDBSA-N 0 0 354.410 3.821 20 5 FHBDRN CC[C@H](CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)CC(F)(F)F ZINC000416605885 943007762 /nfs/dbraw/zinc/00/77/62/943007762.db2.gz YXRAVAFTKHHKJB-QMMMGPOBSA-N 0 0 374.768 3.505 20 5 FHBDRN Cc1cc(NC(=O)c2ccc(N(C)C)cc2F)c2cc([N+](=O)[O-])ccc2n1 ZINC000183687029 943013941 /nfs/dbraw/zinc/01/39/41/943013941.db2.gz SSELHLLNLCOFEF-UHFFFAOYSA-N 0 0 368.368 3.909 20 5 FHBDRN O=C(N[C@H]1C[C@@H]1c1ccccc1C(F)(F)F)c1ccc([N+](=O)[O-])s1 ZINC000505551572 943016862 /nfs/dbraw/zinc/01/68/62/943016862.db2.gz SRPVOXUXNQAQJZ-KOLCDFICSA-N 0 0 356.325 3.961 20 5 FHBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CC2(C1)CCCCC2 ZINC000503173326 943021832 /nfs/dbraw/zinc/02/18/32/943021832.db2.gz ZCRIRURGRRUFII-LBPRGKRZSA-N 0 0 352.818 3.808 20 5 FHBDRN COc1cc(C2(C(=O)N(C)Cc3ccccc3[N+](=O)[O-])CCC2)ccc1C ZINC000503174579 943022800 /nfs/dbraw/zinc/02/28/00/943022800.db2.gz DQIYXUROZRAHHG-UHFFFAOYSA-N 0 0 368.433 3.992 20 5 FHBDRN C[C@H](NS(=O)(=O)CCc1ccc([N+](=O)[O-])cc1)c1ccc(C2CC2)cc1 ZINC000416667292 943028938 /nfs/dbraw/zinc/02/89/38/943028938.db2.gz PSEIRTDITQHXPI-AWEZNQCLSA-N 0 0 374.462 3.695 20 5 FHBDRN C[C@H](NC(=O)N1CCC[C@@H](Oc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000416675229 943036015 /nfs/dbraw/zinc/03/60/15/943036015.db2.gz DHTDQBLQAPSZPR-HNAYVOBHSA-N 0 0 369.421 3.909 20 5 FHBDRN CCn1nccc1NC(=O)c1ccc(N2C[C@@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000514472003 943042704 /nfs/dbraw/zinc/04/27/04/943042704.db2.gz OVDADQMXXZJLRK-KBPBESRZSA-N 0 0 371.441 3.546 20 5 FHBDRN CCc1cccc(C)c1NC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000133644123 943044479 /nfs/dbraw/zinc/04/44/79/943044479.db2.gz MLEATQMMKHKVHR-UHFFFAOYSA-N 0 0 350.378 3.904 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CCc3ccc(F)c(F)c32)ccc1[N+](=O)[O-] ZINC000412391977 943047707 /nfs/dbraw/zinc/04/77/07/943047707.db2.gz MPPSRJOVEJOXSA-UHFFFAOYSA-N 0 0 362.332 3.863 20 5 FHBDRN CCN(C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2)[C@@H](C)c1cccc(OC)c1 ZINC000514498907 943056523 /nfs/dbraw/zinc/05/65/23/943056523.db2.gz IOMNDXALFXUMAM-LBPRGKRZSA-N 0 0 372.377 3.555 20 5 FHBDRN CN1CCC[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)c2ccccc21 ZINC000412393177 943057072 /nfs/dbraw/zinc/05/70/72/943057072.db2.gz HIFXXFBDSXVPRV-IPMKNSEASA-N 0 0 365.433 3.786 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@@H]1c2ccccc2CC[C@H]1C(C)C ZINC000183876843 943057431 /nfs/dbraw/zinc/05/74/31/943057431.db2.gz MPROFZGPNDYPMQ-JXFKEZNVSA-N 0 0 370.453 3.566 20 5 FHBDRN COc1ccc(CCCNc2ncc(Cl)cc2[N+](=O)[O-])cc1OC ZINC000434945152 943066277 /nfs/dbraw/zinc/06/62/77/943066277.db2.gz AUPDTZVYUGJGML-UHFFFAOYSA-N 0 0 351.790 3.705 20 5 FHBDRN Cc1c(CNC(=O)N[C@H]2C[C@H](c3ccc(F)cc3)C2)cccc1[N+](=O)[O-] ZINC000431900079 943078180 /nfs/dbraw/zinc/07/81/80/943078180.db2.gz SKVDOXNNXAWJHK-JCNLHEQBSA-N 0 0 357.385 3.788 20 5 FHBDRN CC(C)C(=O)Nc1cccc(NC(=O)CSc2ccc([N+](=O)[O-])cc2)c1 ZINC000514520436 943078698 /nfs/dbraw/zinc/07/86/98/943078698.db2.gz WTSSVPDIQFESIL-UHFFFAOYSA-N 0 0 373.434 3.920 20 5 FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc2c(c1)COC2 ZINC000509959017 943082668 /nfs/dbraw/zinc/08/26/68/943082668.db2.gz KEKVZJUWPICESM-UHFFFAOYSA-N 0 0 374.418 3.616 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)NC(C)(C)COCc1ccccc1 ZINC000503255035 943087859 /nfs/dbraw/zinc/08/78/59/943087859.db2.gz HCCVSYURAWMABV-UHFFFAOYSA-N 0 0 373.409 3.720 20 5 FHBDRN C[C@H](C(=O)Nc1ccnn1-c1cccc(F)c1)c1ccc([N+](=O)[O-])cc1F ZINC000183906223 943091501 /nfs/dbraw/zinc/09/15/01/943091501.db2.gz YQEKLNXTEIJVRN-NSHDSACASA-N 0 0 372.331 3.801 20 5 FHBDRN COc1ccc(CC(=O)Nc2ccc(OC(C)C)c(OC)c2)cc1[N+](=O)[O-] ZINC000545925182 943101525 /nfs/dbraw/zinc/10/15/25/943101525.db2.gz FCVIZIGXBMNJEC-UHFFFAOYSA-N 0 0 374.393 3.580 20 5 FHBDRN O=[N+]([O-])c1ccc(OCc2nc(-c3ccoc3)no2)c(Br)c1 ZINC000133662123 943105278 /nfs/dbraw/zinc/10/52/78/943105278.db2.gz WCDRIBJKFZTDDQ-UHFFFAOYSA-N 0 0 366.127 3.579 20 5 FHBDRN Cc1cnc(C(C)(C)NC(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)s1 ZINC000412420892 943107634 /nfs/dbraw/zinc/10/76/34/943107634.db2.gz UADRBQBUOZDAEI-UHFFFAOYSA-N 0 0 363.439 3.812 20 5 FHBDRN C/C(=C/c1cccc([N+](=O)[O-])c1)CNCc1noc(-c2ccccc2F)n1 ZINC000435030292 943113398 /nfs/dbraw/zinc/11/33/98/943113398.db2.gz QGHDQODPNBVIFM-LCYFTJDESA-N 0 0 368.368 3.977 20 5 FHBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)N(Cc1ccc(F)cc1)CC1CC1 ZINC000126354044 943117299 /nfs/dbraw/zinc/11/72/99/943117299.db2.gz QXKATJQROQSOHX-UHFFFAOYSA-N 0 0 371.412 3.898 20 5 FHBDRN O=C(N[C@H]1C[C@@H]1c1ccccc1C(F)(F)F)c1ccc([N+](=O)[O-])cc1 ZINC000505592650 943119155 /nfs/dbraw/zinc/11/91/55/943119155.db2.gz HCTDSNGWJROINL-HIFRSBDPSA-N 0 0 350.296 3.900 20 5 FHBDRN Cc1ccc([C@H](CC(=O)OC(C)C)NC(=O)c2ccccc2[N+](=O)[O-])cc1 ZINC000014383013 943128143 /nfs/dbraw/zinc/12/81/43/943128143.db2.gz VGZYPHLMLJJIKR-KRWDZBQOSA-N 0 0 370.405 3.716 20 5 FHBDRN COc1ccc(-c2nnc(CNc3ccc([N+](=O)[O-])cc3Cl)[nH]2)cc1 ZINC000505596654 943135573 /nfs/dbraw/zinc/13/55/73/943135573.db2.gz MCJCUIXXMXWKAZ-UHFFFAOYSA-N 0 0 359.773 3.654 20 5 FHBDRN CCOc1cc(Oc2cc([S@](C)=O)c(C)cc2OC)ccc1[N+](=O)[O-] ZINC000425272288 943135994 /nfs/dbraw/zinc/13/59/94/943135994.db2.gz FVWAQACFEZOPNB-VWLOTQADSA-N 0 0 365.407 3.840 20 5 FHBDRN C[C@H](C(=O)Nc1ccc2c(c1)CCCC(=O)N2)c1ccc([N+](=O)[O-])cc1F ZINC000183765182 943136859 /nfs/dbraw/zinc/13/68/59/943136859.db2.gz BJUOOICQAXPPLH-NSHDSACASA-N 0 0 371.368 3.751 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)c1ccc(NC(=O)C2CC2)cc1 ZINC000183769427 943138550 /nfs/dbraw/zinc/13/85/50/943138550.db2.gz AMNXARRPPJIZLN-UHFFFAOYSA-N 0 0 373.796 3.527 20 5 FHBDRN COc1cc(C)c([S@](C)=O)cc1Oc1cc(C)c([N+](=O)[O-])cc1F ZINC000425273736 943140770 /nfs/dbraw/zinc/14/07/70/943140770.db2.gz JNAYOKPIVQVOAD-DEOSSOPVSA-N 0 0 353.371 3.889 20 5 FHBDRN CC(=O)c1cc(NCCC(C)(C)C(=O)OC(C)(C)C)ccc1[N+](=O)[O-] ZINC000425278628 943169473 /nfs/dbraw/zinc/16/94/73/943169473.db2.gz ZEUFXMRSQPXRSY-UHFFFAOYSA-N 0 0 350.415 3.967 20 5 FHBDRN CC(C)c1ccc(C(=O)N2CCC(c3ccncn3)CC2)cc1[N+](=O)[O-] ZINC000412430097 943170919 /nfs/dbraw/zinc/17/09/19/943170919.db2.gz NJIZPYFOFQSXPG-UHFFFAOYSA-N 0 0 354.410 3.528 20 5 FHBDRN C[C@@H](CC(=O)NCCNc1ccccc1[N+](=O)[O-])c1ccc(F)cc1F ZINC000503408270 943178286 /nfs/dbraw/zinc/17/82/86/943178286.db2.gz QJHRTNKQSGTFRI-LBPRGKRZSA-N 0 0 363.364 3.595 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC[C@H]1c1ccccn1 ZINC000514650266 943180062 /nfs/dbraw/zinc/18/00/62/943180062.db2.gz CCDRKPPBAFJRSO-INIZCTEOSA-N 0 0 356.382 3.758 20 5 FHBDRN Cc1ccc([C@@H]2CCCN2S(=O)(=O)CCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000503438173 943184243 /nfs/dbraw/zinc/18/42/43/943184243.db2.gz SPQZLKWIYPMGEM-IBGZPJMESA-N 0 0 374.462 3.613 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])c2cccnc12)N1C[C@@H]2CCC(=O)c3cccc1c32 ZINC000183801182 943185923 /nfs/dbraw/zinc/18/59/23/943185923.db2.gz VVSTZTKPSBYLHW-LBPRGKRZSA-N 0 0 373.368 3.864 20 5 FHBDRN COC(=O)c1ccc(OC(=O)c2cc(C3CC3)oc2C2CC2)cc1[N+](=O)[O-] ZINC001267796181 943193209 /nfs/dbraw/zinc/19/32/09/943193209.db2.gz XRTMEWPLKWOODR-UHFFFAOYSA-N 0 0 371.345 3.948 20 5 FHBDRN COc1cccc([N+](=O)[O-])c1N1CCC(OCCc2ccccc2)CC1 ZINC000514678702 943195188 /nfs/dbraw/zinc/19/51/88/943195188.db2.gz FBFWNPRMFJVMLW-UHFFFAOYSA-N 0 0 356.422 3.832 20 5 FHBDRN Cc1ccc(NC(=O)[C@H](C)OC(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1F ZINC000016862112 943197986 /nfs/dbraw/zinc/19/79/86/943197986.db2.gz KQPBHGBQSCZDTI-LBPRGKRZSA-N 0 0 360.341 3.535 20 5 FHBDRN COCCN(Cc1ccccc1)Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000505612864 943204330 /nfs/dbraw/zinc/20/43/30/943204330.db2.gz UMEFEECHUJZIIC-UHFFFAOYSA-N 0 0 366.364 3.845 20 5 FHBDRN CC(C)(CCO)Nc1cnc(Cl)nc1Sc1ccc([N+](=O)[O-])cc1 ZINC001167739852 943206107 /nfs/dbraw/zinc/20/61/07/943206107.db2.gz XNXIWWPOGOOEOL-UHFFFAOYSA-N 0 0 368.846 3.762 20 5 FHBDRN CC[C@@H](CNC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)c1ccccc1 ZINC000046762877 943211922 /nfs/dbraw/zinc/21/19/22/943211922.db2.gz YLGOVPBCRFAHHZ-HNNXBMFYSA-N 0 0 364.405 3.704 20 5 FHBDRN Cn1c(C(=O)Nc2cc(C3CCC3)nn2-c2ccccc2)ccc1[N+](=O)[O-] ZINC000503489023 943216699 /nfs/dbraw/zinc/21/66/99/943216699.db2.gz BEQBKSUHHYXKNM-UHFFFAOYSA-N 0 0 365.393 3.639 20 5 FHBDRN CN(C)c1ccc(NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000014426698 943217328 /nfs/dbraw/zinc/21/73/28/943217328.db2.gz XRTGQBRCHKKGCR-UHFFFAOYSA-N 0 0 368.437 3.516 20 5 FHBDRN C[C@H]1C[C@@H](O)CCN1Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000430122235 943217886 /nfs/dbraw/zinc/21/78/86/943217886.db2.gz JSFKRNVFGIJIBS-BBRMVZONSA-N 0 0 360.385 3.871 20 5 FHBDRN COc1cccc([N+](=O)[O-])c1NC1CC[NH+]([C@H](C)c2ccncc2)CC1 ZINC000514739087 943251680 /nfs/dbraw/zinc/25/16/80/943251680.db2.gz NPDWTFCTZXDDCW-CQSZACIVSA-N 0 0 356.426 3.636 20 5 FHBDRN O=[N+]([O-])c1ccc(NCc2ncnn2-c2ccccc2)c(Br)c1 ZINC000503569121 943266602 /nfs/dbraw/zinc/26/66/02/943266602.db2.gz NXYPPAILHBKKSY-UHFFFAOYSA-N 0 0 374.198 3.550 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc2n[nH]nc2c1 ZINC000503574962 943271204 /nfs/dbraw/zinc/27/12/04/943271204.db2.gz XKNDLXWSQLCIBA-UHFFFAOYSA-N 0 0 357.395 3.621 20 5 FHBDRN Cc1ccc(C=Cc2nc(SCCOc3ccc([N+](=O)[O-])cc3)n[nH]2)o1 ZINC000514746286 943275687 /nfs/dbraw/zinc/27/56/87/943275687.db2.gz FGUNTUUBWNEULK-HJWRWDBZSA-N 0 0 372.406 3.956 20 5 FHBDRN Cn1c(Sc2ccc([N+](=O)[O-])cc2Br)nnc1C1CCC1 ZINC000503587254 943276133 /nfs/dbraw/zinc/27/61/33/943276133.db2.gz RIGVPQXDXBRKPO-UHFFFAOYSA-N 0 0 369.244 3.905 20 5 FHBDRN Cn1c(-c2ccc([N+](=O)[O-])cc2)nnc1N1CCC[C@@H]1C1CCCCC1 ZINC000514784975 943289426 /nfs/dbraw/zinc/28/94/26/943289426.db2.gz BIMAKJDMQLPVHP-QGZVFWFLSA-N 0 0 355.442 3.939 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCCc1ccncc1C ZINC000503631777 943301361 /nfs/dbraw/zinc/30/13/61/943301361.db2.gz VOIZCFFJMVTEIW-UHFFFAOYSA-N 0 0 359.451 3.773 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)NCCc2cc(F)c(F)c(F)c2)c1 ZINC000503661551 943316377 /nfs/dbraw/zinc/31/63/77/943316377.db2.gz AOOPIMGFGGFXMY-UHFFFAOYSA-N 0 0 370.352 3.707 20 5 FHBDRN Cc1c(NC(=O)N2CCC(C)(C)C2)cc(Br)cc1[N+](=O)[O-] ZINC000435322251 943323267 /nfs/dbraw/zinc/32/32/67/943323267.db2.gz BDCHUIIHWGPGIC-UHFFFAOYSA-N 0 0 356.220 3.930 20 5 FHBDRN Cc1c(NC(=O)N2C[C@@H](C)[C@H](C)C2)cc(Br)cc1[N+](=O)[O-] ZINC000435323765 943323701 /nfs/dbraw/zinc/32/37/01/943323701.db2.gz PBKDUJMLUJXBRF-RKDXNWHRSA-N 0 0 356.220 3.785 20 5 FHBDRN CCOc1cc(CNc2cccc([C@H](C)C(=O)OC)c2)ccc1[N+](=O)[O-] ZINC000417077846 943331002 /nfs/dbraw/zinc/33/10/02/943331002.db2.gz MUEUYTNFXZHXKA-ZDUSSCGKSA-N 0 0 358.394 3.882 20 5 FHBDRN Cc1c(NC(=O)N[C@@H](C)c2ccon2)cc(Br)cc1[N+](=O)[O-] ZINC000435328487 943332788 /nfs/dbraw/zinc/33/27/88/943332788.db2.gz LGPSDDCSMWMPJN-QMMMGPOBSA-N 0 0 369.175 3.536 20 5 FHBDRN CC(C)(CCC(=O)NCc1ccc(COc2ccc(F)cc2)cc1)[N+](=O)[O-] ZINC000843664409 943333532 /nfs/dbraw/zinc/33/35/32/943333532.db2.gz SYZALPZXKMEAMO-UHFFFAOYSA-N 0 0 374.412 3.856 20 5 FHBDRN Cc1c(NC(=O)N2CC[C@H](C3CC3)C2)cc(Br)cc1[N+](=O)[O-] ZINC000435334223 943336978 /nfs/dbraw/zinc/33/69/78/943336978.db2.gz XTSKNBRTCGUCQQ-NSHDSACASA-N 0 0 368.231 3.930 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccnc(OC(C)C)c1 ZINC001269944631 943346932 /nfs/dbraw/zinc/34/69/32/943346932.db2.gz DVPHCOXSDJJFAO-OAHLLOKOSA-N 0 0 357.410 3.984 20 5 FHBDRN O=C1NCCN1c1cc(N[C@@H]2CCc3c2cccc3[N+](=O)[O-])ccc1Cl ZINC000514871701 943351327 /nfs/dbraw/zinc/35/13/27/943351327.db2.gz AHRPNEMVNHLHQR-OAHLLOKOSA-N 0 0 372.812 3.877 20 5 FHBDRN O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CCC[C@@H](n3ccnn3)C2)s1 ZINC000425355114 943361469 /nfs/dbraw/zinc/36/14/69/943361469.db2.gz UGYFXBCZEVQPTQ-CQSZACIVSA-N 0 0 369.450 3.752 20 5 FHBDRN COc1cc(CCC(=O)N2CCc3c2cccc3[N+](=O)[O-])ccc1Cl ZINC000435367163 943361940 /nfs/dbraw/zinc/36/19/40/943361940.db2.gz SQOORYWHJRIBNI-UHFFFAOYSA-N 0 0 360.797 3.779 20 5 FHBDRN CCCOc1ccc2c(c1)CCN(C(=O)c1ccc([N+](=O)[O-])cc1C)C2 ZINC000435378892 943368789 /nfs/dbraw/zinc/36/87/89/943368789.db2.gz ACABVZIQGHBIEV-UHFFFAOYSA-N 0 0 354.406 3.891 20 5 FHBDRN CCNc1ccc(C(=O)Nc2ccc(N3CCCCC3)nc2)cc1[N+](=O)[O-] ZINC000514905552 943376046 /nfs/dbraw/zinc/37/60/46/943376046.db2.gz NCHZZAGQQTXVAX-UHFFFAOYSA-N 0 0 369.425 3.664 20 5 FHBDRN COC(=O)Nc1cccc(C(=O)Oc2cc(Cl)ccc2[N+](=O)[O-])c1 ZINC000728769121 943379494 /nfs/dbraw/zinc/37/94/94/943379494.db2.gz OWDIKAHTBXUKLF-UHFFFAOYSA-N 0 0 350.714 3.646 20 5 FHBDRN COc1cc(C(=O)NCCc2ccc([N+](=O)[O-])cc2)ccc1OCC(C)C ZINC000053217301 943381541 /nfs/dbraw/zinc/38/15/41/943381541.db2.gz CZNFKBUQVBRZJK-UHFFFAOYSA-N 0 0 372.421 3.611 20 5 FHBDRN Cc1cc(Br)ccc1C(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000053219000 943381994 /nfs/dbraw/zinc/38/19/94/943381994.db2.gz XTPDRWJLXDHGLY-UHFFFAOYSA-N 0 0 363.211 3.638 20 5 FHBDRN O=C(COc1cc(Cl)ccc1Cl)NCCc1ccc([N+](=O)[O-])cc1 ZINC000053217356 943382751 /nfs/dbraw/zinc/38/27/51/943382751.db2.gz OPDPJMAJTRMMIB-UHFFFAOYSA-N 0 0 369.204 3.639 20 5 FHBDRN CC(C)(Oc1ccc(Cl)cc1)C(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000053218038 943385645 /nfs/dbraw/zinc/38/56/45/943385645.db2.gz PNGWOSDGMPHZAT-UHFFFAOYSA-N 0 0 362.813 3.765 20 5 FHBDRN Cc1ccc(S(=O)(=O)N2CCC[C@H]2/C=C\c2ccccc2)cc1[N+](=O)[O-] ZINC000503861955 943389917 /nfs/dbraw/zinc/38/99/17/943389917.db2.gz PGNULQIKABMWNE-MQNTZWLQSA-N 0 0 372.446 3.770 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)NCCc1nc2ccccc2s1 ZINC000503876838 943393965 /nfs/dbraw/zinc/39/39/65/943393965.db2.gz VPMWAUMQUMECKA-UHFFFAOYSA-N 0 0 372.406 3.577 20 5 FHBDRN O=C(CSc1ccccc1[N+](=O)[O-])N1CCSC2(CCC2)CC1 ZINC000412458132 943399348 /nfs/dbraw/zinc/39/93/48/943399348.db2.gz XTRLQALLPJJWSV-UHFFFAOYSA-N 0 0 352.481 3.575 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@]1(O)CCCC1(C)C ZINC000503943254 943428228 /nfs/dbraw/zinc/42/82/28/943428228.db2.gz FEUNQUSTQHXUPY-GOSISDBHSA-N 0 0 366.483 3.768 20 5 FHBDRN Cc1sc(S(=O)(=O)N(C)c2ccc(Cl)cc2F)cc1[N+](=O)[O-] ZINC000435473973 943433647 /nfs/dbraw/zinc/43/36/47/943433647.db2.gz LEYXQZHDRSFLRM-UHFFFAOYSA-N 0 0 364.807 3.582 20 5 FHBDRN Cc1ccc(NCCCNC(=O)C2(C(F)F)CCCC2)c([N+](=O)[O-])c1 ZINC000515013834 943457475 /nfs/dbraw/zinc/45/74/75/943457475.db2.gz MPDNLJPWHRMOKQ-UHFFFAOYSA-N 0 0 355.385 3.647 20 5 FHBDRN O=C(N[C@H](c1ccccc1)c1ccncc1)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000503999550 943459286 /nfs/dbraw/zinc/45/92/86/943459286.db2.gz XTISZZNDWPPUFD-HXUWFJFHSA-N 0 0 372.384 3.991 20 5 FHBDRN COc1ccc([C@@H](NC(=O)Nc2cc([N+](=O)[O-])ccc2OC)C2CC2)cc1 ZINC000504002728 943461258 /nfs/dbraw/zinc/46/12/58/943461258.db2.gz OSNDUJXPCNVMEF-SFHVURJKSA-N 0 0 371.393 3.885 20 5 FHBDRN CCC1(CC)CN(C(=O)Cc2ccc([N+](=O)[O-])cc2Br)C1 ZINC000504043251 943473284 /nfs/dbraw/zinc/47/32/84/943473284.db2.gz PUBQUZBGPQNJDO-UHFFFAOYSA-N 0 0 355.232 3.548 20 5 FHBDRN COc1cc(C(=O)N2CC[C@H](C)[C@@H]3CCCC[C@H]32)c([N+](=O)[O-])cc1OC ZINC000515061542 943481193 /nfs/dbraw/zinc/48/11/93/943481193.db2.gz FKRHMYHMBLJNKW-KCQAQPDRSA-N 0 0 362.426 3.653 20 5 FHBDRN O=C(NC1CC1)c1ccc(N[C@H]2C[C@H](c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000435585927 943503606 /nfs/dbraw/zinc/50/36/06/943503606.db2.gz WSSXVPXDEOWLRH-JCNLHEQBSA-N 0 0 351.406 3.845 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@H]1c2ccccc2CC[C@H]1C(C)C ZINC001267836165 943510526 /nfs/dbraw/zinc/51/05/26/943510526.db2.gz KKIBKSIULXKSPC-QFBILLFUSA-N 0 0 353.422 3.988 20 5 FHBDRN CCn1nc(C)c([N+](=O)[O-])c1N[C@H]1C[C@@H]1c1ccccc1OC(F)F ZINC000435577992 943510680 /nfs/dbraw/zinc/51/06/80/943510680.db2.gz LGUQDYBDGNZDEA-NEPJUHHUSA-N 0 0 352.341 3.689 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)Nc1ccc(Oc2ccccn2)cc1 ZINC000504157011 943523811 /nfs/dbraw/zinc/52/38/11/943523811.db2.gz JQCICPPJZKOPPF-UHFFFAOYSA-N 0 0 365.345 3.800 20 5 FHBDRN O=C(COc1cccc([N+](=O)[O-])c1)Nc1ccc(Oc2ccccn2)cc1 ZINC000504160007 943524837 /nfs/dbraw/zinc/52/48/37/943524837.db2.gz ZTJZSPLEBFYJQL-UHFFFAOYSA-N 0 0 365.345 3.800 20 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943565640 /nfs/dbraw/zinc/56/56/40/943565640.db2.gz KQKLRHFZCZOJQG-UHFFFAOYSA-N 0 0 357.297 3.650 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)N[C@H]1C[C@@H]1c1ccccc1OC(F)F ZINC000435726611 943570706 /nfs/dbraw/zinc/57/07/06/943570706.db2.gz RFSYEHDVORUHBO-KGLIPLIRSA-N 0 0 363.320 3.874 20 5 FHBDRN C[C@@H](Oc1cccc(Cl)c1)C(=O)N1c2ccc([N+](=O)[O-])cc2C[C@H]1C ZINC000504299281 943578968 /nfs/dbraw/zinc/57/89/68/943578968.db2.gz MQPBRYCZRGFFHM-VXGBXAGGSA-N 0 0 360.797 3.993 20 5 FHBDRN Cc1ccn(-c2ccc(C(=O)N3c4ccc([N+](=O)[O-])cc4C[C@@H]3C)cc2)n1 ZINC000504326011 943595279 /nfs/dbraw/zinc/59/52/79/943595279.db2.gz WTTGAMOPPRTAKL-AWEZNQCLSA-N 0 0 362.389 3.680 20 5 FHBDRN COC(=O)[C@H](C)c1ccc(NC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000417444566 943615505 /nfs/dbraw/zinc/61/55/05/943615505.db2.gz YPFDDOLTASZGEA-CHWSQXEVSA-N 0 0 371.393 3.754 20 5 FHBDRN CC1(CCNc2cc(Cl)c(C(F)(F)F)cc2[N+](=O)[O-])OCCO1 ZINC000302149042 943617766 /nfs/dbraw/zinc/61/77/66/943617766.db2.gz 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366.421 3.871 20 5 FHBDRN CN(C)c1ccc(-c2cncc(C(=O)Nc3ccc([N+](=O)[O-])cc3)c2)cc1 ZINC000136883543 944109056 /nfs/dbraw/zinc/10/90/56/944109056.db2.gz SILOPEGUGIZOFL-UHFFFAOYSA-N 0 0 362.389 3.975 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)Nc2c(C)cccc2OC)cc1OC ZINC000436213496 944121866 /nfs/dbraw/zinc/12/18/66/944121866.db2.gz YTYBEMORAAEPGC-UHFFFAOYSA-N 0 0 360.366 3.571 20 5 FHBDRN CCN(CC(F)(F)F)C(=O)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000436244099 944130562 /nfs/dbraw/zinc/13/05/62/944130562.db2.gz JPLOKNPJHFHXFS-UHFFFAOYSA-N 0 0 366.314 3.845 20 5 FHBDRN CC(C)COC[C@@H](NC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc21)c1ccco1 ZINC000505184833 944131147 /nfs/dbraw/zinc/13/11/47/944131147.db2.gz NJHUJVIFNPILOK-QGZVFWFLSA-N 0 0 371.393 3.813 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](c2cccc(F)c2)c2ccccn2)c1 ZINC000500118121 944133623 /nfs/dbraw/zinc/13/36/23/944133623.db2.gz CVEHKHLJGIIPMG-IBGZPJMESA-N 0 0 365.364 3.957 20 5 FHBDRN CC(C)C[C@@H](C)n1nccc1NC(=O)CCOc1ccccc1[N+](=O)[O-] 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C[C@@H](Oc1ccc([N+](=O)[O-])cc1I)c1ccncc1 ZINC001226031816 944510158 /nfs/dbraw/zinc/51/01/58/944510158.db2.gz FKFNGEKOJRMEAW-SECBINFHSA-N 0 0 370.146 3.734 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)Nc2cccc3c2OC(C)(C)C3)c1F ZINC000517708373 944514168 /nfs/dbraw/zinc/51/41/68/944514168.db2.gz IJHNCNIKVSLGEI-UHFFFAOYSA-N 0 0 374.368 3.637 20 5 FHBDRN CCCOc1ccc(CNC(=O)NCc2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000516128308 944514580 /nfs/dbraw/zinc/51/45/80/944514580.db2.gz HDJFLUXOTVCHSD-UHFFFAOYSA-N 0 0 357.410 3.691 20 5 FHBDRN CCc1nc([C@H](C)NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)cs1 ZINC000110506387 944514733 /nfs/dbraw/zinc/51/47/33/944514733.db2.gz KSZSZNWJXMQILB-LBPRGKRZSA-N 0 0 374.466 3.705 20 5 FHBDRN O=C(NC[C@@H](CO)Cc1ccco1)c1cc2ccccc2c2cccnc12 ZINC000643154530 944523481 /nfs/dbraw/zinc/52/34/81/944523481.db2.gz PLALCLJAVGWPHX-HNNXBMFYSA-N 0 0 360.413 3.562 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCc1nccn1C(F)F ZINC000506208434 944525708 /nfs/dbraw/zinc/52/57/08/944525708.db2.gz RLZNTWGFRVHYBW-UHFFFAOYSA-N 0 0 370.381 3.619 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H](CO)c1cccc(Cl)c1F ZINC000439334708 944531503 /nfs/dbraw/zinc/53/15/03/944531503.db2.gz XFJJVCOKTKRDIW-AWEZNQCLSA-N 0 0 367.764 3.551 20 5 FHBDRN Cc1c(NC(=O)[C@H](C)N2CC[C@@](F)(c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000516162280 944531912 /nfs/dbraw/zinc/53/19/12/944531912.db2.gz UJCVBOSOLNSBSW-YWZLYKJASA-N 0 0 371.412 3.801 20 5 FHBDRN COc1cc(CN(Cc2ccccc2)[C@H](C)CCO)c([N+](=O)[O-])cc1F ZINC000184296082 944532530 /nfs/dbraw/zinc/53/25/30/944532530.db2.gz LWRPGIXQJFDGQV-CQSZACIVSA-N 0 0 362.401 3.516 20 5 FHBDRN CCn1c(C)nc([N+](=O)[O-])c1NCc1cccc(NC(=O)CC(C)C)c1 ZINC000518602132 944539058 /nfs/dbraw/zinc/53/90/58/944539058.db2.gz GIVQWEMMJWPOIQ-UHFFFAOYSA-N 0 0 359.430 3.716 20 5 FHBDRN CSCc1cccc(CNC(=O)CSc2ccccc2[N+](=O)[O-])c1 ZINC000438381834 944548594 /nfs/dbraw/zinc/54/85/94/944548594.db2.gz VVMZSLZJWBRTMP-UHFFFAOYSA-N 0 0 362.476 3.866 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NCc1nc(-c2cccc(Cl)c2)no1 ZINC000015288214 944551378 /nfs/dbraw/zinc/55/13/78/944551378.db2.gz VIUHFQNOUQDUHH-UHFFFAOYSA-N 0 0 360.757 3.919 20 5 FHBDRN Cc1c(Br)c(Nc2ccc3c(c2)COC3)ncc1[N+](=O)[O-] ZINC000541577074 944555880 /nfs/dbraw/zinc/55/58/80/944555880.db2.gz DRFJYWSRYZUPRS-UHFFFAOYSA-N 0 0 350.172 3.835 20 5 FHBDRN Cc1nc(CCNC(=O)c2c([N+](=O)[O-])cccc2C(F)(F)F)sc1C ZINC000516171438 944556140 /nfs/dbraw/zinc/55/61/40/944556140.db2.gz OZOJAGFMNBKLHK-UHFFFAOYSA-N 0 0 373.356 3.659 20 5 FHBDRN C[C@@H](NC(=O)COc1ccccc1C(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000053656380 944557163 /nfs/dbraw/zinc/55/71/63/944557163.db2.gz QZCNHXZCLCWAJW-LLVKDONJSA-N 0 0 368.311 3.870 20 5 FHBDRN COc1ccc2c(c1)CCN(C(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1)CC2 ZINC000439379203 944573265 /nfs/dbraw/zinc/57/32/65/944573265.db2.gz PVDZWFRDSRCOSP-UHFFFAOYSA-N 0 0 368.433 3.508 20 5 FHBDRN Cc1ccc(-n2ccnc2)c(-c2nc(Cc3ccccc3[N+](=O)[O-])no2)c1 ZINC000516187117 944576470 /nfs/dbraw/zinc/57/64/70/944576470.db2.gz IFQJJPPSPUAICD-UHFFFAOYSA-N 0 0 361.361 3.730 20 5 FHBDRN COc1ccc(OC(=O)c2ccn(-c3cccc(Cl)c3)n2)c([N+](=O)[O-])c1 ZINC000108455323 944584291 /nfs/dbraw/zinc/58/42/91/944584291.db2.gz RSCWBPLOUFVODV-UHFFFAOYSA-N 0 0 373.752 3.662 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CNc1cccc(C(F)(F)F)c1 ZINC000015289760 944586263 /nfs/dbraw/zinc/58/62/63/944586263.db2.gz ODDMMMGJIKYAMA-UHFFFAOYSA-N 0 0 353.300 3.973 20 5 FHBDRN CSc1cccc(NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)n1 ZINC000516206590 944587107 /nfs/dbraw/zinc/58/71/07/944587107.db2.gz NYSSICCOAJKJQV-UHFFFAOYSA-N 0 0 355.322 3.565 20 5 FHBDRN CCCn1c(C)cc(C(=O)COc2c(Cl)cncc2[N+](=O)[O-])c1C ZINC000506569118 944589852 /nfs/dbraw/zinc/58/98/52/944589852.db2.gz WZDJJCTVUNTPTM-UHFFFAOYSA-N 0 0 351.790 3.733 20 5 FHBDRN O=[N+]([O-])c1cncc(Cl)c1OCc1nnc(-c2ccc(Cl)cc2)o1 ZINC000506572518 944599753 /nfs/dbraw/zinc/59/97/53/944599753.db2.gz ZVLINWDELCJCIY-UHFFFAOYSA-N 0 0 367.148 3.926 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)c1cccc(C(F)(F)F)c1F ZINC000544129036 944603735 /nfs/dbraw/zinc/60/37/35/944603735.db2.gz FCJFELACGJMCFL-UHFFFAOYSA-N 0 0 372.274 3.691 20 5 FHBDRN CC1(C)CCN(c2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)CCS1 ZINC000516235393 944605400 /nfs/dbraw/zinc/60/54/00/944605400.db2.gz RELBGZVQOFGAMH-UHFFFAOYSA-N 0 0 363.483 3.553 20 5 FHBDRN CC(C)(C(=O)N1C[C@@H]2CCC(=O)c3cccc1c32)c1ccccc1[N+](=O)[O-] ZINC000500357808 944614670 /nfs/dbraw/zinc/61/46/70/944614670.db2.gz KOOUCQJRTQVHGH-ZDUSSCGKSA-N 0 0 364.401 3.979 20 5 FHBDRN O=C(NC1CCC2(CCOCC2)CC1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000438460362 944638994 /nfs/dbraw/zinc/63/89/94/944638994.db2.gz BGMHULHONLSNFG-UHFFFAOYSA-N 0 0 352.818 3.717 20 5 FHBDRN Cc1c2ccccc2oc1[C@H](C)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1C ZINC000516255138 944643614 /nfs/dbraw/zinc/64/36/14/944643614.db2.gz QEYPWJXTOKNHFA-ZDUSSCGKSA-N 0 0 374.418 3.997 20 5 FHBDRN Cc1nc2ccc(CN3CCN(c4cccc([N+](=O)[O-])c4)CC3)cc2s1 ZINC000426395619 944653811 /nfs/dbraw/zinc/65/38/11/944653811.db2.gz JWTNHVRKEMCZGS-UHFFFAOYSA-N 0 0 368.462 3.835 20 5 FHBDRN Cc1cccc2c1CN([C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)CC2 ZINC000759875083 944666191 /nfs/dbraw/zinc/66/61/91/944666191.db2.gz MUUBORKRHCGTDD-ZDUSSCGKSA-N 0 0 373.840 3.942 20 5 FHBDRN CC(C)N(C)c1ccccc1CNC(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000438477760 944678786 /nfs/dbraw/zinc/67/87/86/944678786.db2.gz MHSYRJYWJIPOCA-UHFFFAOYSA-N 0 0 371.437 3.525 20 5 FHBDRN CN(C[C@H]1OCCc2ccccc21)C(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000506257249 944686938 /nfs/dbraw/zinc/68/69/38/944686938.db2.gz YCSBSRMERKKXHF-LJQANCHMSA-N 0 0 366.373 3.727 20 5 FHBDRN CN(C(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1)c1cccc2cccnc21 ZINC001270500343 944690445 /nfs/dbraw/zinc/69/04/45/944690445.db2.gz HPQYIKWYQIRYDV-UHFFFAOYSA-N 0 0 373.372 3.605 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1[C@@H]1Nc2ccc(Cl)cc2C(=O)N1C ZINC000500379544 944691376 /nfs/dbraw/zinc/69/13/76/944691376.db2.gz MUSHIYXMPIQSEX-MRXNPFEDSA-N 0 0 361.785 3.843 20 5 FHBDRN CO[C@H](CNC(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000439515275 944699587 /nfs/dbraw/zinc/69/95/87/944699587.db2.gz PLASTSKLOMOBNR-GOSISDBHSA-N 0 0 360.385 3.975 20 5 FHBDRN CC(C)c1ccc(C(=O)NCc2cc(=O)[nH]c3ccccc23)cc1[N+](=O)[O-] ZINC000439515684 944699639 /nfs/dbraw/zinc/69/96/39/944699639.db2.gz VJVWCCIXKDZBJN-UHFFFAOYSA-N 0 0 365.389 3.902 20 5 FHBDRN COc1ccc(C(=O)NC[C@@H]2CCC[C@@H](C(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000438511709 944700415 /nfs/dbraw/zinc/70/04/15/944700415.db2.gz HDVYGQATDZMJTO-ZYHUDNBSSA-N 0 0 360.332 3.702 20 5 FHBDRN O=C(c1cc2cccc([N+](=O)[O-])c2[nH]1)N1CCC[C@H](Nc2ccccc2)C1 ZINC000426702351 944703931 /nfs/dbraw/zinc/70/39/31/944703931.db2.gz AQSZXSZASZNWRI-INIZCTEOSA-N 0 0 364.405 3.793 20 5 FHBDRN Cc1c(C(=O)[O-])cnn1C1CC[NH+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC000516304072 944705031 /nfs/dbraw/zinc/70/50/31/944705031.db2.gz QXUBZLDIJARZMC-CYBMUJFWSA-N 0 0 372.425 3.504 20 5 FHBDRN COc1cc(C(=O)NC[C@H]2CCC[C@@H](C(F)(F)F)C2)ccc1[N+](=O)[O-] ZINC000438514626 944706757 /nfs/dbraw/zinc/70/67/57/944706757.db2.gz FIHZUIOQRUFQCX-CMPLNLGQSA-N 0 0 360.332 3.702 20 5 FHBDRN CCOc1ccc(NC(=O)CNc2cccc3c2CCCC3)c([N+](=O)[O-])c1 ZINC000015123181 944710793 /nfs/dbraw/zinc/71/07/93/944710793.db2.gz GKMIEIYPYSXWSO-UHFFFAOYSA-N 0 0 369.421 3.923 20 5 FHBDRN Nc1ccc(-c2noc(-c3cccc(Br)c3)n2)cc1[N+](=O)[O-] ZINC000545552137 944714134 /nfs/dbraw/zinc/71/41/34/944714134.db2.gz FAQJEQRDSFRBSG-UHFFFAOYSA-N 0 0 361.155 3.657 20 5 FHBDRN CC(C)(C(=O)N[C@H]1CCCc2c(O)cccc21)c1ccccc1[N+](=O)[O-] ZINC000506260397 944714519 /nfs/dbraw/zinc/71/45/19/944714519.db2.gz YHUHDCACDIBHIX-INIZCTEOSA-N 0 0 354.406 3.772 20 5 FHBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@](C)(O)CC1 ZINC000473603302 944714923 /nfs/dbraw/zinc/71/49/23/944714923.db2.gz AGVWYRYHMJHELL-SFHVURJKSA-N 0 0 366.483 3.864 20 5 FHBDRN CC(C)(c1nc(-c2ccc3c(c2)CCO3)no1)c1ccccc1[N+](=O)[O-] ZINC000426409835 944717618 /nfs/dbraw/zinc/71/76/18/944717618.db2.gz GPLNETMEJFEXBM-UHFFFAOYSA-N 0 0 351.362 3.906 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@]1(O)CCCC(C)(C)C1 ZINC000438508026 944718446 /nfs/dbraw/zinc/71/84/46/944718446.db2.gz XIXKTHXSDXDJMH-OXJNMPFZSA-N 0 0 362.470 3.611 20 5 FHBDRN CC(C)[C@H](CNC(=O)CCOc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000516316984 944719320 /nfs/dbraw/zinc/71/93/20/944719320.db2.gz UYQBYTSPTFZDNT-KRWDZBQOSA-N 0 0 356.422 3.920 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H](C)[C@H]1Oc2ccccc2[C@@H]1C ZINC000438509488 944721681 /nfs/dbraw/zinc/72/16/81/944721681.db2.gz YKPHCZIGYRGFNL-JCGVRSQUSA-N 0 0 355.394 3.978 20 5 FHBDRN Cc1ccc(C(=O)CCCC(=O)N2CCc3c2cccc3[N+](=O)[O-])cc1 ZINC000184100434 944724658 /nfs/dbraw/zinc/72/46/58/944724658.db2.gz DSXODGYNLVQHOK-UHFFFAOYSA-N 0 0 352.390 3.846 20 5 FHBDRN CCC[C@@H]([NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)C(=O)[O-] ZINC000426711059 944733740 /nfs/dbraw/zinc/73/37/40/944733740.db2.gz NGNUNGKLSKLFQL-OAHLLOKOSA-N 0 0 362.357 3.869 20 5 FHBDRN COc1cc(-c2noc(C(C)(C)c3ccc([N+](=O)[O-])cc3F)n2)ccc1O ZINC000436869970 944735664 /nfs/dbraw/zinc/73/56/64/944735664.db2.gz GARZIVJEGQPRIW-UHFFFAOYSA-N 0 0 373.340 3.824 20 5 FHBDRN C[C@@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccc2c(c1)CC(=O)N2 ZINC000047156217 944738143 /nfs/dbraw/zinc/73/81/43/944738143.db2.gz OFMWSXAXURNRTP-SECBINFHSA-N 0 0 374.784 3.626 20 5 FHBDRN CC(C)c1ccc(CNS(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])cc1 ZINC000516341742 944744556 /nfs/dbraw/zinc/74/45/56/944744556.db2.gz XBQCFKGXMAFQKN-UHFFFAOYSA-N 0 0 368.842 3.850 20 5 FHBDRN CC[C@@H](C)[C@@H](C)N(C1CC1)S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-] ZINC000517869612 944746096 /nfs/dbraw/zinc/74/60/96/944746096.db2.gz KEUSBFCZDBGPSL-BXUZGUMPSA-N 0 0 354.472 3.799 20 5 FHBDRN Cc1c([N+](=O)[O-])cc(C(=O)N(C)CCCc2ccccc2)cc1[N+](=O)[O-] ZINC000047165066 944755884 /nfs/dbraw/zinc/75/58/84/944755884.db2.gz UDODWFDJOHURMJ-UHFFFAOYSA-N 0 0 357.366 3.516 20 5 FHBDRN CN(C/C=C\c1ccccc1[N+](=O)[O-])CC(=O)Nc1cccc(Cl)c1 ZINC000506926987 944765337 /nfs/dbraw/zinc/76/53/37/944765337.db2.gz LIGWXKOACWOGPZ-ALCCZGGFSA-N 0 0 359.813 3.832 20 5 FHBDRN Cc1ccc(C(C)(C)CC(=O)NCCNc2ccc([N+](=O)[O-])cc2)cc1 ZINC000015139209 944770658 /nfs/dbraw/zinc/77/06/58/944770658.db2.gz IMLRERNLRWVPDQ-UHFFFAOYSA-N 0 0 355.438 3.799 20 5 FHBDRN C[C@H](NC(=O)CCCNc1ccc([N+](=O)[O-])cc1)c1ccc(Cl)cn1 ZINC000189731985 944787612 /nfs/dbraw/zinc/78/76/12/944787612.db2.gz JTEZVABXKDVAIU-LBPRGKRZSA-N 0 0 362.817 3.713 20 5 FHBDRN O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCC(Cc2cccc(F)c2)CC1 ZINC000518801045 944796714 /nfs/dbraw/zinc/79/67/14/944796714.db2.gz XBKZBBYMIDEKNA-UHFFFAOYSA-N 0 0 360.360 3.968 20 5 FHBDRN O=C([O-])CC[C@H](Cc1ccccc1)[NH2+]C/C=C\c1ccccc1[N+](=O)[O-] ZINC000517891752 944799708 /nfs/dbraw/zinc/79/97/08/944799708.db2.gz UADXCIPGOXGCNP-OEPRFQHASA-N 0 0 354.406 3.674 20 5 FHBDRN Cc1ocnc1-c1noc(-c2ccc(N3CCC[C@@H](C)C3)c([N+](=O)[O-])c2)n1 ZINC000516388471 944806522 /nfs/dbraw/zinc/80/65/22/944806522.db2.gz ZXKKXOYOWCVCQL-LLVKDONJSA-N 0 0 369.381 3.845 20 5 FHBDRN CN(c1ccccc1)c1ccc(C[NH2+][C@@H](C(=O)[O-])C(C)(C)C)cc1[N+](=O)[O-] ZINC000426803255 944823688 /nfs/dbraw/zinc/82/36/88/944823688.db2.gz LJUSEHQFFMUTLX-SFHVURJKSA-N 0 0 371.437 3.952 20 5 FHBDRN O=C([O-])[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CC1CCC(C(F)(F)F)CC1 ZINC000426815968 944837173 /nfs/dbraw/zinc/83/71/73/944837173.db2.gz IADRHBCLISUEFC-UBHUBRDASA-N 0 0 374.359 3.549 20 5 FHBDRN COc1cc(CNc2cnn(-c3ccccc3F)c2C)c([N+](=O)[O-])cc1F ZINC000506299683 944848782 /nfs/dbraw/zinc/84/87/82/944848782.db2.gz WJCYFDOFAQGKGN-UHFFFAOYSA-N 0 0 374.347 3.988 20 5 FHBDRN CC(=O)c1ccc(OCC(=O)Nc2cccc3ccccc32)c([N+](=O)[O-])c1 ZINC000120718480 944857830 /nfs/dbraw/zinc/85/78/30/944857830.db2.gz OCIIKIAVFMLWPY-UHFFFAOYSA-N 0 0 364.357 3.968 20 5 FHBDRN CCOc1ccc(C(=O)N[C@@H]2CCOc3c(CC)cccc32)cc1[N+](=O)[O-] ZINC000507012218 944860548 /nfs/dbraw/zinc/86/05/48/944860548.db2.gz BQXWRSOOXZSGIT-MRXNPFEDSA-N 0 0 370.405 3.810 20 5 FHBDRN O=[N+]([O-])c1cccc([C@H](O)CN2CCc3c2cccc3C(F)(F)F)c1 ZINC000759911033 944861850 /nfs/dbraw/zinc/86/18/50/944861850.db2.gz LZIVYFJUAQJIHE-MRXNPFEDSA-N 0 0 352.312 3.710 20 5 FHBDRN CCCc1nc(C)c(-c2nc(Cc3c[nH]c4ccc([N+](=O)[O-])cc34)no2)o1 ZINC000426460253 944869508 /nfs/dbraw/zinc/86/95/08/944869508.db2.gz MTURNFOARAJIJP-UHFFFAOYSA-N 0 0 367.365 3.966 20 5 FHBDRN O=C(CSc1cccs1)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2 ZINC000505914491 944871462 /nfs/dbraw/zinc/87/14/62/944871462.db2.gz ZLXMICYUTDOOSY-UHFFFAOYSA-N 0 0 366.420 3.548 20 5 FHBDRN Cc1noc(C)c1-c1ccc(OC(=O)c2cc([N+](=O)[O-])cnc2C)cc1 ZINC000759915008 944875382 /nfs/dbraw/zinc/87/53/82/944875382.db2.gz MEDSPBFTFWWJNA-UHFFFAOYSA-N 0 0 353.334 3.789 20 5 FHBDRN C[C@@H](Nc1ncc([N+](=O)[O-])c(N)n1)c1ccc(Oc2ccccc2)cc1 ZINC000507030014 944876797 /nfs/dbraw/zinc/87/67/97/944876797.db2.gz NCDDUBPPDYQWIC-GFCCVEGCSA-N 0 0 351.366 3.763 20 5 FHBDRN CCOc1ccc(C(=O)N2C[C@@H]3CCC[C@]3(C(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000894387104 944883387 /nfs/dbraw/zinc/88/33/87/944883387.db2.gz UCAMNGKYECSJBL-LRDDRELGSA-N 0 0 372.343 3.798 20 5 FHBDRN O=C(NCc1nc(CNc2ccc([N+](=O)[O-])cc2)cs1)c1ccccc1 ZINC000426890515 944892736 /nfs/dbraw/zinc/89/27/36/944892736.db2.gz LCRIRPUNONMZKU-UHFFFAOYSA-N 0 0 368.418 3.593 20 5 FHBDRN O=C(NCC1Cc2ccccc2C1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000426468016 944895984 /nfs/dbraw/zinc/89/59/84/944895984.db2.gz ISUMZARGVSXWQL-UHFFFAOYSA-N 0 0 365.433 3.684 20 5 FHBDRN CC(C)(C)CN(CC(F)(F)F)C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000518894493 944898526 /nfs/dbraw/zinc/89/85/26/944898526.db2.gz HJHRRPGKCVKXAB-UHFFFAOYSA-N 0 0 371.359 3.987 20 5 FHBDRN CC(=O)Nc1ccc(C)c(NC(=O)C(C)(C)c2ccccc2[N+](=O)[O-])c1 ZINC000432016287 944912054 /nfs/dbraw/zinc/91/20/54/944912054.db2.gz WEIQINBPZMIFOD-UHFFFAOYSA-N 0 0 355.394 3.778 20 5 FHBDRN CC(C)(C(=O)Nc1ccc(-c2nnco2)cc1)c1ccccc1[N+](=O)[O-] ZINC000432003220 944916168 /nfs/dbraw/zinc/91/61/68/944916168.db2.gz ZOMYAXRNCCSZJT-UHFFFAOYSA-N 0 0 352.350 3.561 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])N[C@@H]1CC[C@H](Cc2ccccc2)C1 ZINC000438676893 944917564 /nfs/dbraw/zinc/91/75/64/944917564.db2.gz WUGPHABKDYSJIC-IAGOWNOFSA-N 0 0 353.422 3.534 20 5 FHBDRN CC[C@H](c1ccccc1)N(CC(C)C)C(=O)CCn1cc([N+](=O)[O-])cn1 ZINC000518923282 944926616 /nfs/dbraw/zinc/92/66/16/944926616.db2.gz PMWNVBSXIXPPMM-GOSISDBHSA-N 0 0 358.442 3.817 20 5 FHBDRN Cc1ccccc1O[C@@H](C)CNC(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000511701916 944926590 /nfs/dbraw/zinc/92/65/90/944926590.db2.gz TVHZNWYWKUCEQF-INIZCTEOSA-N 0 0 371.437 3.555 20 5 FHBDRN Cc1cc(C(=O)Nc2cc(Cl)ccc2-n2cccn2)cc([N+](=O)[O-])c1 ZINC000518934567 944940043 /nfs/dbraw/zinc/94/00/43/944940043.db2.gz KLSKNQPGPIJSEZ-UHFFFAOYSA-N 0 0 356.769 3.995 20 5 FHBDRN C[C@H]1CCCC[C@@H]1N(C)C(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000518025801 944946134 /nfs/dbraw/zinc/94/61/34/944946134.db2.gz AHYQBUCPSWPOMW-UGSOOPFHSA-N 0 0 358.442 3.839 20 5 FHBDRN CC[C@H]1CN(c2c(Cl)cc(Cl)cc2[N+](=O)[O-])C[C@@]2(CCOC2)O1 ZINC000408103395 944946687 /nfs/dbraw/zinc/94/66/87/944946687.db2.gz ALAQDOMMDFDMCY-XHDPSFHLSA-N 0 0 361.225 3.676 20 5 FHBDRN Cc1ccc(NC(=O)Cc2cscc2Br)cc1[N+](=O)[O-] ZINC000432044638 944947711 /nfs/dbraw/zinc/94/77/11/944947711.db2.gz FESBOBAZQOBZNU-UHFFFAOYSA-N 0 0 355.213 3.908 20 5 FHBDRN O=C(Nc1n[nH]c2ccc([N+](=O)[O-])cc21)c1ccc([C@@H]2CCCOC2)cc1 ZINC000507088565 944947715 /nfs/dbraw/zinc/94/77/15/944947715.db2.gz RJPZYNCBFKQYOV-CQSZACIVSA-N 0 0 366.377 3.617 20 5 FHBDRN C[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)CC1(F)F ZINC000507115187 944948973 /nfs/dbraw/zinc/94/89/73/944948973.db2.gz GKIHUKRDAKELNL-MRVPVSSYSA-N 0 0 352.259 3.731 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)Cc1cscc1Br ZINC000432050435 944952048 /nfs/dbraw/zinc/95/20/48/944952048.db2.gz YTWQLKHDSGPZCS-UHFFFAOYSA-N 0 0 355.213 3.908 20 5 FHBDRN Cc1ccc(C)c(Oc2ccc(CNC(=O)c3cc([N+](=O)[O-])c[nH]3)cn2)c1 ZINC000516502302 944952853 /nfs/dbraw/zinc/95/28/53/944952853.db2.gz FZRNQIISIQFUKJ-UHFFFAOYSA-N 0 0 366.377 3.657 20 5 FHBDRN COc1ccc(CC(=O)N[C@H]2CCC[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000518929628 944952882 /nfs/dbraw/zinc/95/28/82/944952882.db2.gz GRZBONZGSIIYBO-IRXDYDNUSA-N 0 0 354.406 3.598 20 5 FHBDRN COc1ccc(CC(=O)N[C@@H]2CCC[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000518929627 944953031 /nfs/dbraw/zinc/95/30/31/944953031.db2.gz GRZBONZGSIIYBO-IAGOWNOFSA-N 0 0 354.406 3.598 20 5 FHBDRN C[C@@H](NC(=O)CSc1ccccc1[N+](=O)[O-])c1ccc(F)cc1F ZINC000543129685 944959197 /nfs/dbraw/zinc/95/91/97/944959197.db2.gz PGUBYSAIDBKZDN-SNVBAGLBSA-N 0 0 352.362 3.843 20 5 FHBDRN COc1ccccc1[C@@H](NC(=O)c1cc(F)cc([N+](=O)[O-])c1)c1ccco1 ZINC000426985418 944978228 /nfs/dbraw/zinc/97/82/28/944978228.db2.gz WYEPGJVEFCUUCP-GOSISDBHSA-N 0 0 370.336 3.855 20 5 FHBDRN CC1=CCCN(C(=O)c2ccc(N3C[C@H](C)C[C@H](C)C3)c([N+](=O)[O-])c2)C1 ZINC000437959303 944985732 /nfs/dbraw/zinc/98/57/32/944985732.db2.gz GVKFSVJBUJBOAV-IYBDPMFKSA-N 0 0 357.454 3.869 20 5 FHBDRN CC(C)(C)[C@H]1CCCN(CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000543207058 944993015 /nfs/dbraw/zinc/99/30/15/944993015.db2.gz KEARUJSNMQRSDZ-HNNXBMFYSA-N 0 0 368.499 3.517 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)c1cc(F)c2ncccc2c1 ZINC001270536070 944997646 /nfs/dbraw/zinc/99/76/46/944997646.db2.gz HCSYKKMPLDERHI-UHFFFAOYSA-N 0 0 355.325 3.933 20 5 FHBDRN CCc1cccc2c(CCNC(=O)NCc3ccc([N+](=O)[O-])cc3)c[nH]c21 ZINC000518978855 945001662 /nfs/dbraw/zinc/00/16/62/945001662.db2.gz HABMWSPPOGJSDM-UHFFFAOYSA-N 0 0 366.421 3.680 20 5 FHBDRN CC(C)Oc1cccc(CN(C)c2nc3ccc([N+](=O)[O-])cc3c(=O)[nH]2)c1 ZINC000516538549 945003654 /nfs/dbraw/zinc/00/36/54/945003654.db2.gz PZQUNLWDIKYCIT-UHFFFAOYSA-N 0 0 368.393 3.667 20 5 FHBDRN NC(=O)c1cccc(NCCCOc2ccc3ccccc3c2)c1[N+](=O)[O-] ZINC000516557401 945023873 /nfs/dbraw/zinc/02/38/73/945023873.db2.gz NBAHVLFIUPHNOP-UHFFFAOYSA-N 0 0 365.389 3.728 20 5 FHBDRN O=[N+]([O-])c1cc(C[N@H+]2CC[C@](O)(C3CC3)C2)ccc1Oc1ccc(F)cc1 ZINC000426509181 945025888 /nfs/dbraw/zinc/02/58/88/945025888.db2.gz RXHPUJLCHPURDI-HXUWFJFHSA-N 0 0 372.396 3.873 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)Nc1ccc2c(c1)C(=O)CCC2 ZINC000427041487 945036772 /nfs/dbraw/zinc/03/67/72/945036772.db2.gz SIIOUHRTBLAWBX-UHFFFAOYSA-N 0 0 363.373 3.707 20 5 FHBDRN Cc1ccccc1[C@H]1CCN(CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000507210879 945042665 /nfs/dbraw/zinc/04/26/65/945042665.db2.gz UFAGOBYCBWQGQJ-AWEZNQCLSA-N 0 0 373.840 3.985 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H]1CCO[C@H](CC(C)C)C1 ZINC000439870638 945044665 /nfs/dbraw/zinc/04/46/65/945044665.db2.gz GWKXTUGWHCMQJV-UKRRQHHQSA-N 0 0 365.430 3.709 20 5 FHBDRN COc1cc(OCC(=O)N[C@@H]2C[C@H](C)CC[C@H]2C(C)C)ccc1[N+](=O)[O-] ZINC000519032927 945045339 /nfs/dbraw/zinc/04/53/39/945045339.db2.gz FXEJBKIOXSZTKJ-VNQPRFMTSA-N 0 0 364.442 3.559 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)NCCCOc1ccccc1 ZINC000439875158 945047936 /nfs/dbraw/zinc/04/79/36/945047936.db2.gz YXDHAYYHHWEOGK-UHFFFAOYSA-N 0 0 359.382 3.584 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)Nc1cccc(NC(C)=O)c1 ZINC000439875200 945047981 /nfs/dbraw/zinc/04/79/81/945047981.db2.gz CSMXLQIWUJUKPF-UHFFFAOYSA-N 0 0 358.354 3.596 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@@H](Nc2ccccc2)C1 ZINC000439875320 945048315 /nfs/dbraw/zinc/04/83/15/945048315.db2.gz DCTGSEAEMDICNZ-OAHLLOKOSA-N 0 0 370.409 3.712 20 5 FHBDRN COC(=O)c1cccc(-c2noc(-c3ccc(Cl)cc3[N+](=O)[O-])n2)c1 ZINC000438819008 945049728 /nfs/dbraw/zinc/04/97/28/945049728.db2.gz KVYAFLZYRBILLP-UHFFFAOYSA-N 0 0 359.725 3.752 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N(C)Cc1ccccc1OC ZINC000439890042 945051221 /nfs/dbraw/zinc/05/12/21/945051221.db2.gz ZBWHLGURVQUAJI-UHFFFAOYSA-N 0 0 359.382 3.666 20 5 FHBDRN CCO[C@@H]1C[C@H](NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)C12CCCC2 ZINC000437121601 945051417 /nfs/dbraw/zinc/05/14/17/945051417.db2.gz CSZRMTSAPIDGFL-DLBZAZTESA-N 0 0 358.394 3.809 20 5 FHBDRN C[C@H](C(=O)Nc1cc(Br)ccn1)c1ccc([N+](=O)[O-])cc1F ZINC000438807528 945052940 /nfs/dbraw/zinc/05/29/40/945052940.db2.gz DRLDNWOTTOHRMY-QMMMGPOBSA-N 0 0 368.162 3.634 20 5 FHBDRN CC(C)[C@H](Cc1ccc(F)cc1)N(C)C(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000437125771 945055873 /nfs/dbraw/zinc/05/58/73/945055873.db2.gz QFJPPAQNRGLITH-IBGZPJMESA-N 0 0 374.412 3.838 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)NC1(c2cccc(F)c2)CC1 ZINC000439880588 945059727 /nfs/dbraw/zinc/05/97/27/945059727.db2.gz KSFKIWUEDVBYHJ-UHFFFAOYSA-N 0 0 359.357 3.943 20 5 FHBDRN COCCOc1cccc(NC(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)c1 ZINC000541610707 945062995 /nfs/dbraw/zinc/06/29/95/945062995.db2.gz KMESZLJWUBIVGZ-GFCCVEGCSA-N 0 0 362.357 3.501 20 5 FHBDRN Cc1cc2c(cc1C)N(S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)CC2 ZINC000507608068 945370709 /nfs/dbraw/zinc/37/07/09/945370709.db2.gz WATPCVUDTMVAON-UHFFFAOYSA-N 0 0 366.826 3.616 20 5 FHBDRN CCc1c(C(=O)COc2ccc([N+](=O)[O-])c(Cl)c2)[nH]c(C)c1C(C)=O ZINC000124934100 945372842 /nfs/dbraw/zinc/37/28/42/945372842.db2.gz UKQFGAXEDCVQEF-UHFFFAOYSA-N 0 0 364.785 3.911 20 5 FHBDRN O=C(CCn1ccnc1)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000522679805 945380518 /nfs/dbraw/zinc/38/05/18/945380518.db2.gz JGXUBFUNVGTVCF-UHFFFAOYSA-N 0 0 352.350 3.612 20 5 FHBDRN O=C(c1cc2c(s1)CCCCCC2)N1CCc2ncc([N+](=O)[O-])cc2C1 ZINC000408135925 945385815 /nfs/dbraw/zinc/38/58/15/945385815.db2.gz ZYMKCIVMTDXNMY-UHFFFAOYSA-N 0 0 371.462 3.909 20 5 FHBDRN COc1ccc(N[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c(OC)c1 ZINC000066863327 945397198 /nfs/dbraw/zinc/39/71/98/945397198.db2.gz KCGDBTCKXQXOKA-NSHDSACASA-N 0 0 370.365 3.835 20 5 FHBDRN CC(=O)c1csc(C(=O)Nc2cc(C)nn2-c2ccc([N+](=O)[O-])cc2)c1 ZINC000106767856 945402620 /nfs/dbraw/zinc/40/26/20/945402620.db2.gz KROGFSGZGKXACQ-UHFFFAOYSA-N 0 0 370.390 3.605 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)Nc2c(F)cccc2Oc2ccccc2)n1 ZINC000427465469 945411053 /nfs/dbraw/zinc/41/10/53/945411053.db2.gz NMRSPMHEQOYSEP-UHFFFAOYSA-N 0 0 370.340 3.995 20 5 FHBDRN COc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])cc3OC)CCCC2)cc1 ZINC000427465227 945411149 /nfs/dbraw/zinc/41/11/49/945411149.db2.gz MIRJDYQXKBUGQO-UHFFFAOYSA-N 0 0 370.405 3.811 20 5 FHBDRN CC(C)(C)OC(=O)[C@H](NC(=O)Nc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000507645484 945412643 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FHBDRN O=C(Nc1ccc(Cl)cc1)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000018172911 945444588 /nfs/dbraw/zinc/44/45/88/945444588.db2.gz OBKDYDGHZHCZHF-UHFFFAOYSA-N 0 0 360.801 3.602 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1Cc1nc2ccc(Br)cc2c(=O)[nH]1 ZINC000507690657 945452782 /nfs/dbraw/zinc/45/27/82/945452782.db2.gz AIDAIBTYZAPYFG-UHFFFAOYSA-N 0 0 374.194 3.905 20 5 FHBDRN C[C@H](Cc1cccs1)NC(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000184386515 945453759 /nfs/dbraw/zinc/45/37/59/945453759.db2.gz QBYNRZTWXASWOL-SNVBAGLBSA-N 0 0 353.831 3.740 20 5 FHBDRN COc1cc(-c2noc(-c3cc4cc([N+](=O)[O-])ccc4s3)n2)ccn1 ZINC000507693315 945456493 /nfs/dbraw/zinc/45/64/93/945456493.db2.gz YWSPZLXXSUNHSA-UHFFFAOYSA-N 0 0 354.347 3.930 20 5 FHBDRN CCC(CC)(C(=O)NCc1ccc(OC)c([N+](=O)[O-])c1)c1ccccc1 ZINC000440372074 945462881 /nfs/dbraw/zinc/46/28/81/945462881.db2.gz BNUPAUHFCICPIH-UHFFFAOYSA-N 0 0 356.422 3.978 20 5 FHBDRN CCOC(=O)c1ccc(OC2CC(C)(C)OC(C)(C)C2)c([N+](=O)[O-])c1 ZINC001227302489 945468097 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369.421 3.686 20 5 FHBDRN COc1ccc(CSCC(=O)N[C@H](C)c2ccccc2)cc1[N+](=O)[O-] ZINC000107152069 945502876 /nfs/dbraw/zinc/50/28/76/945502876.db2.gz FIGIMZIFYJZBRZ-CYBMUJFWSA-N 0 0 360.435 3.714 20 5 FHBDRN CN(Cc1ccc(F)cc1Cl)C(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000107159171 945502979 /nfs/dbraw/zinc/50/29/79/945502979.db2.gz URHBMVHFGYEIIQ-UHFFFAOYSA-N 0 0 366.776 3.815 20 5 FHBDRN CN1CCCN(C(=O)c2c(F)cccc2[N+](=O)[O-])c2cc(Cl)ccc21 ZINC001126485975 945512622 /nfs/dbraw/zinc/51/26/22/945512622.db2.gz UAXFKBSNBLZCAU-UHFFFAOYSA-N 0 0 363.776 3.874 20 5 FHBDRN CCCc1ccc([C@@H](C)N(CC(N)=O)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000511878263 945517279 /nfs/dbraw/zinc/51/72/79/945517279.db2.gz XOXWHKZNTICDID-OAHLLOKOSA-N 0 0 355.438 3.596 20 5 FHBDRN Cc1c(C(=O)Nc2nc(Cc3ccccc3)ns2)cccc1[N+](=O)[O-] ZINC000107197775 945518291 /nfs/dbraw/zinc/51/82/91/945518291.db2.gz YQALZAQTOTZJNT-UHFFFAOYSA-N 0 0 354.391 3.598 20 5 FHBDRN CC(=O)c1ccc(O[C@@H](C[N+](=O)[O-])c2ccc3c(c2)OCO3)c(Cl)c1 ZINC001226232950 945519359 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20 5 FHBDRN CN(Cc1ccc[nH]1)C(=O)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12 ZINC000444101825 945882955 /nfs/dbraw/zinc/88/29/55/945882955.db2.gz AOGILKRUHMUFQO-UHFFFAOYSA-N 0 0 367.355 3.560 20 5 FHBDRN CCn1c(-c2ccco2)nn(CN2CCc3c2cccc3[N+](=O)[O-])c1=S ZINC000178917855 945885178 /nfs/dbraw/zinc/88/51/78/945885178.db2.gz KIKZVNKKMBIOEN-UHFFFAOYSA-N 0 0 371.422 3.622 20 5 FHBDRN Cc1ccc(Cc2nnc(NC(=O)c3ccccc3[N+](=O)[O-])s2)cc1 ZINC000108248218 945897342 /nfs/dbraw/zinc/89/73/42/945897342.db2.gz BMTQJMZVBYJQJG-UHFFFAOYSA-N 0 0 354.391 3.598 20 5 FHBDRN C[C@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccc(NC(=O)C2CC2)cc1 ZINC000045032789 945898426 /nfs/dbraw/zinc/89/84/26/945898426.db2.gz JUVGGNJZQAWSFJ-LBPRGKRZSA-N 0 0 368.393 3.826 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC[C@@H]1c1ccncc1 ZINC000281892107 945905480 /nfs/dbraw/zinc/90/54/80/945905480.db2.gz HHGCCTJPJJWNQX-MRXNPFEDSA-N 0 0 356.382 3.758 20 5 FHBDRN Cc1ccc(F)c(N2CCC[C@H](Sc3ncccc3[N+](=O)[O-])C2=O)c1 ZINC000522822996 945918589 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C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCCCc1ccc(O)cc1 ZINC000522841054 945974278 /nfs/dbraw/zinc/97/42/78/945974278.db2.gz JLHGWBOKSULDTL-CYBMUJFWSA-N 0 0 360.435 3.530 20 5 FHBDRN CC[C@H](NC(=O)c1cc(OC)c(OC)cc1F)c1cccc([N+](=O)[O-])c1 ZINC000133980964 945977102 /nfs/dbraw/zinc/97/71/02/945977102.db2.gz GOBRKEFETNKZJH-HNNXBMFYSA-N 0 0 362.357 3.632 20 5 FHBDRN C[C@@H]1C[C@H](c2cccc(F)c2)N(CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000444167889 946015237 /nfs/dbraw/zinc/01/52/37/946015237.db2.gz MRPPAOZORPMQEM-AUUYWEPGSA-N 0 0 371.412 3.780 20 5 FHBDRN COC(=O)c1ccc(NCc2ccc([N+](=O)[O-])cc2Cl)c(OC)c1 ZINC000428331336 946024478 /nfs/dbraw/zinc/02/44/78/946024478.db2.gz QXQRZEBMUHWAHG-UHFFFAOYSA-N 0 0 350.758 3.656 20 5 FHBDRN Cc1nc(C2(NC(=O)c3cc(Cl)cc([N+](=O)[O-])c3)CCCCC2)no1 ZINC000522876124 946042608 /nfs/dbraw/zinc/04/26/08/946042608.db2.gz VMSDQHZFFYJERC-UHFFFAOYSA-N 0 0 364.789 3.529 20 5 FHBDRN Cc1nn(CCC(=O)N(c2ccccc2)C2CCCC2)c(C)c1[N+](=O)[O-] ZINC000108745775 946049717 /nfs/dbraw/zinc/04/97/17/946049717.db2.gz PGFWHPPUMOKCMA-UHFFFAOYSA-N 0 0 356.426 3.774 20 5 FHBDRN COc1cc(Cl)c(C)cc1NC(=O)COc1ccc([N+](=O)[O-])c(C)c1 ZINC000001284593 946056586 /nfs/dbraw/zinc/05/65/86/946056586.db2.gz PCBOJDDLRUEFDQ-UHFFFAOYSA-N 0 0 364.785 3.891 20 5 FHBDRN CO[C@@H](c1ccc(Cl)cc1)[C@H](C)NC(=O)c1cc(F)cc([N+](=O)[O-])c1 ZINC000522887722 946056829 /nfs/dbraw/zinc/05/68/29/946056829.db2.gz HZRCXBMQRWPZTE-MGPLVRAMSA-N 0 0 366.776 3.893 20 5 FHBDRN Cc1cc(OCC(=O)Nc2ccccc2Br)ccc1[N+](=O)[O-] ZINC000001284616 946058278 /nfs/dbraw/zinc/05/82/78/946058278.db2.gz CTCMPTNZIJMDTM-UHFFFAOYSA-N 0 0 365.183 3.683 20 5 FHBDRN CCOc1cc(N(C)CC(=O)Nc2cccc(Cl)c2)ccc1[N+](=O)[O-] ZINC000301973273 946060540 /nfs/dbraw/zinc/06/05/40/946060540.db2.gz JJTMLPLMJNTLPI-UHFFFAOYSA-N 0 0 363.801 3.722 20 5 FHBDRN O=C(Nc1nc2c(s1)CCCCCC2)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000108838296 946066347 /nfs/dbraw/zinc/06/63/47/946066347.db2.gz KJSCCRLHSQVHER-UHFFFAOYSA-N 0 0 371.422 3.839 20 5 FHBDRN O=C(COc1cccc([N+](=O)[O-])c1)Nc1nc2c(s1)CCCCCC2 ZINC000108836685 946066606 /nfs/dbraw/zinc/06/66/06/946066606.db2.gz ZYQACKZCSFVKLJ-UHFFFAOYSA-N 0 0 361.423 3.728 20 5 FHBDRN CCOCCOc1c(Cl)cccc1NC(=O)c1ccc([N+](=O)[O-])s1 ZINC000062917190 946070166 /nfs/dbraw/zinc/07/01/66/946070166.db2.gz XXZSDCLWWFAKAJ-UHFFFAOYSA-N 0 0 370.814 3.977 20 5 FHBDRN O=[N+]([O-])c1cccc(OCCSc2ncccc2Br)c1 ZINC000522901005 946082667 /nfs/dbraw/zinc/08/26/67/946082667.db2.gz MGFNXTLJIIGSGI-UHFFFAOYSA-N 0 0 355.213 3.923 20 5 FHBDRN CC(C)Oc1cccc([C@@H](C)NC(=O)NCc2ccccc2[N+](=O)[O-])c1 ZINC000045625352 946088686 /nfs/dbraw/zinc/08/86/86/946088686.db2.gz AOPKSMAPZOWQGP-CQSZACIVSA-N 0 0 357.410 3.942 20 5 FHBDRN CN(Cc1ccc(OC(F)F)cc1)C(=O)NCc1ccccc1[N+](=O)[O-] ZINC000045624362 946090050 /nfs/dbraw/zinc/09/00/50/946090050.db2.gz KDXBWEQAAKNCLN-UHFFFAOYSA-N 0 0 365.336 3.538 20 5 FHBDRN CN(Cc1ccc(C(F)(F)F)cc1)C(=O)NCc1ccccc1[N+](=O)[O-] ZINC000045623834 946093024 /nfs/dbraw/zinc/09/30/24/946093024.db2.gz KDFPOIVJPJTXAG-UHFFFAOYSA-N 0 0 367.327 3.955 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)N1CC[C@H](c2ccccc2)C1 ZINC000186011480 946095555 /nfs/dbraw/zinc/09/55/55/946095555.db2.gz LEZUKMZOOMONAQ-HNNXBMFYSA-N 0 0 359.813 3.947 20 5 FHBDRN CC[C@@H](CC1CCCCC1)C(=O)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000522931436 946113386 /nfs/dbraw/zinc/11/33/86/946113386.db2.gz LPNHMBPHYKMMER-DLBZAZTESA-N 0 0 374.485 3.999 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN(CCc1ccc(F)cc1)C1CC1 ZINC000444243678 946118347 /nfs/dbraw/zinc/11/83/47/946118347.db2.gz HWCFLFHXOZZUFA-UHFFFAOYSA-N 0 0 371.412 3.688 20 5 FHBDRN COc1ccc2[nH]cc(CC(=O)O[C@H](C)c3ccc([N+](=O)[O-])cc3)c2c1 ZINC000066878594 946121547 /nfs/dbraw/zinc/12/15/47/946121547.db2.gz ALQDNQQOCDOAOS-GFCCVEGCSA-N 0 0 354.362 3.932 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H]1CCCc2ccc(F)cc21 ZINC000475063029 946130445 /nfs/dbraw/zinc/13/04/45/946130445.db2.gz BJGLMDQVTRZVQP-HNNXBMFYSA-N 0 0 359.357 3.942 20 5 FHBDRN C[C@@H](OC(=O)c1cccc(N2CCCC2=O)c1)c1ccc([N+](=O)[O-])cc1 ZINC000066878987 946140154 /nfs/dbraw/zinc/14/01/54/946140154.db2.gz MKOHVGYGICXAHL-CYBMUJFWSA-N 0 0 354.362 3.640 20 5 FHBDRN CCc1n[nH]c(C(=O)N(CC2CCC2)[C@H](C)c2ccccc2)c1[N+](=O)[O-] ZINC000444260573 946142321 /nfs/dbraw/zinc/14/23/21/946142321.db2.gz OSNCIASTYYZZJQ-CYBMUJFWSA-N 0 0 356.426 3.884 20 5 FHBDRN CNc1ccc(C(=O)N(C)[C@@H](C)Cc2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000522951505 946150082 /nfs/dbraw/zinc/15/00/82/946150082.db2.gz DKNYRRPILALQPI-LBPRGKRZSA-N 0 0 361.829 3.993 20 5 FHBDRN CCN1C(=O)c2cc(Cl)ccc2N[C@H]1c1ccc(OC)c([N+](=O)[O-])c1 ZINC000109147742 946166465 /nfs/dbraw/zinc/16/64/65/946166465.db2.gz GZYOEPCNYFRPKJ-MRXNPFEDSA-N 0 0 361.785 3.843 20 5 FHBDRN O=C(CSc1nnc(CCC2CCCC2)[nH]1)c1cccc([N+](=O)[O-])c1 ZINC000109197821 946188747 /nfs/dbraw/zinc/18/87/47/946188747.db2.gz MWATWXXKGAYGAX-UHFFFAOYSA-N 0 0 360.439 3.811 20 5 FHBDRN CCC(CC)CNC(=O)c1ccc(Cn2nc(C)c([N+](=O)[O-])c2C)cc1 ZINC000104549223 946210402 /nfs/dbraw/zinc/21/04/02/946210402.db2.gz AKHDBTKGXVTTPH-UHFFFAOYSA-N 0 0 358.442 3.622 20 5 FHBDRN CC[C@H](C)C(=O)Nc1cccc(CNC(=O)c2cccc(C)c2[N+](=O)[O-])c1 ZINC000045939563 946253912 /nfs/dbraw/zinc/25/39/12/946253912.db2.gz PXNUPSHNUGISKE-ZDUSSCGKSA-N 0 0 369.421 3.818 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(C(=O)Nc2ccc(C)c(NC(=O)C(C)(C)C)c2)n1 ZINC001126106347 946277898 /nfs/dbraw/zinc/27/78/98/946277898.db2.gz UIYFABIXDSMLPU-UHFFFAOYSA-N 0 0 370.409 3.844 20 5 FHBDRN Cc1sc(-c2nc(CC(=O)Nc3ccc(C)cc3)no2)cc1[N+](=O)[O-] ZINC000109442333 946287487 /nfs/dbraw/zinc/28/74/87/946287487.db2.gz BEJYZXGURNXCCK-UHFFFAOYSA-N 0 0 358.379 3.504 20 5 FHBDRN COc1ccccc1C[C@H](C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088230790 946293336 /nfs/dbraw/zinc/29/33/36/946293336.db2.gz LHFOWUKNDUFJLN-HNNXBMFYSA-N 0 0 368.433 3.757 20 5 FHBDRN CC(C)C[C@@H]1CCCN(C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000151889824 946295548 /nfs/dbraw/zinc/29/55/48/946295548.db2.gz XUEVXMCSEZFOAV-HNNXBMFYSA-N 0 0 356.426 3.679 20 5 FHBDRN CS[C@@H]1CCC[C@H](NC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000186017583 946296522 /nfs/dbraw/zinc/29/65/22/946296522.db2.gz GHSTYNWGFIHAJN-WCQYABFASA-N 0 0 357.863 3.722 20 5 FHBDRN COc1ccc(-c2noc(/C=C/c3ccccc3[N+](=O)[O-])n2)cc1OC ZINC000109465868 946299558 /nfs/dbraw/zinc/29/95/58/946299558.db2.gz SIDOWNKYWSMWNX-CSKARUKUSA-N 0 0 353.334 3.832 20 5 FHBDRN CCS[C@@H]1CCCCN(C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000181802846 946299589 /nfs/dbraw/zinc/29/95/89/946299589.db2.gz JIBCMVQSMXVLCA-GFCCVEGCSA-N 0 0 374.409 3.944 20 5 FHBDRN O=C(Nc1nc(-c2ccccn2)cs1)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000053791597 946307161 /nfs/dbraw/zinc/30/71/61/946307161.db2.gz XILIGZRBKKOMEX-UHFFFAOYSA-N 0 0 365.374 3.847 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N[C@@H]1COc2ccc(Cl)cc21 ZINC000475076700 946319309 /nfs/dbraw/zinc/31/93/09/946319309.db2.gz WVDZFJHQEXWWPO-CQSZACIVSA-N 0 0 367.188 3.694 20 5 FHBDRN O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)N1CC2(CCC2)[C@@H]1c1ccco1 ZINC000456553457 946335352 /nfs/dbraw/zinc/33/53/52/946335352.db2.gz CYLUXVNBQGNFKG-KRWDZBQOSA-N 0 0 362.332 3.762 20 5 FHBDRN C[C@@H](CCc1cccn1C)NC(=O)CCc1ccc([N+](=O)[O-])cc1Cl ZINC001126114524 946337306 /nfs/dbraw/zinc/33/73/06/946337306.db2.gz PSZBGNBAHYLYMP-ZDUSSCGKSA-N 0 0 363.845 3.657 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@](C)(CO)C1CCCCC1 ZINC000444318080 946346311 /nfs/dbraw/zinc/34/63/11/946346311.db2.gz XAUCXRLKYJITLE-JXFKEZNVSA-N 0 0 362.470 3.611 20 5 FHBDRN CSc1cccc(C(=O)N(C)CCN(C)c2ccccc2)c1[N+](=O)[O-] ZINC000186470216 946350137 /nfs/dbraw/zinc/35/01/37/946350137.db2.gz QAIWWACOMWEGQM-UHFFFAOYSA-N 0 0 359.451 3.525 20 5 FHBDRN CN(C(=O)[C@@H]1C[C@@H]1c1cc(F)c(F)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000186024728 946351278 /nfs/dbraw/zinc/35/12/78/946351278.db2.gz JBHMVTHCOOWYRF-CHWSQXEVSA-N 0 0 350.296 3.779 20 5 FHBDRN CCOc1ccc(C(=O)N2CC3(CCC3)[C@@H]2c2ccco2)cc1[N+](=O)[O-] ZINC000456566897 946354548 /nfs/dbraw/zinc/35/45/48/946354548.db2.gz OPRVBLYKGXNCEB-KRWDZBQOSA-N 0 0 356.378 3.954 20 5 FHBDRN COc1ccc(CSCC(=O)N2CCCCC(C)(C)C2)cc1[N+](=O)[O-] ZINC000438501166 946362602 /nfs/dbraw/zinc/36/26/02/946362602.db2.gz LJRMAPWAAYUEJL-UHFFFAOYSA-N 0 0 366.483 3.875 20 5 FHBDRN CN(C(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-])c1ccc(Cl)nc1 ZINC001270846028 946368848 /nfs/dbraw/zinc/36/88/48/946368848.db2.gz ZIRVQEOUHCEYPK-UHFFFAOYSA-N 0 0 368.780 3.982 20 5 FHBDRN COc1cc(CN[C@@H](C)c2nccs2)c([N+](=O)[O-])cc1OCC(F)F ZINC000184428478 946382313 /nfs/dbraw/zinc/38/23/13/946382313.db2.gz NEGQOVRMCYEKSK-VIFPVBQESA-N 0 0 373.381 3.555 20 5 FHBDRN Cc1nc2ccc(C(=O)N(Cc3ccc([N+](=O)[O-])cc3)C(C)C)cc2n1C ZINC000475108382 946385749 /nfs/dbraw/zinc/38/57/49/946385749.db2.gz HYLSBWVQLJGLPP-UHFFFAOYSA-N 0 0 366.421 3.841 20 5 FHBDRN C[C@H]1C[C@@H](CNC(=O)c2cc(F)c(Cl)c([N+](=O)[O-])c2Cl)CCO1 ZINC000897297171 946396485 /nfs/dbraw/zinc/39/64/85/946396485.db2.gz XMVBQUVUMMPOHJ-YUMQZZPRSA-N 0 0 365.188 3.586 20 5 FHBDRN CC(=O)Nc1cccc([C@@H](C)NC(=O)Nc2cc([N+](=O)[O-])ccc2C)c1 ZINC000043149389 946398201 /nfs/dbraw/zinc/39/82/01/946398201.db2.gz YROKBGYBLVEJBG-GFCCVEGCSA-N 0 0 356.382 3.744 20 5 FHBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1OC(=O)[C@@H](C(=O)OC(C)(C)C)C1CC1 ZINC001126121050 946398678 /nfs/dbraw/zinc/39/86/78/946398678.db2.gz PFJFUXQFAHAZLK-AWEZNQCLSA-N 0 0 369.801 3.830 20 5 FHBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1OC(=O)[C@@H]1CCN(c2ccccc2)C1 ZINC001126121575 946409323 /nfs/dbraw/zinc/40/93/23/946409323.db2.gz VBPKWBHLSKXWHN-CYBMUJFWSA-N 0 0 360.797 3.989 20 5 FHBDRN CN1CCC[C@@H](NC(=O)CSc2ccccc2[N+](=O)[O-])c2ccccc21 ZINC000456599607 946410620 /nfs/dbraw/zinc/41/06/20/946410620.db2.gz RTDJLTQVBZLRPD-OAHLLOKOSA-N 0 0 371.462 3.774 20 5 FHBDRN COc1ccc(Br)c(NC(=O)c2cccc([N+](=O)[O-])c2)c1 ZINC000111324516 946427964 /nfs/dbraw/zinc/42/79/64/946427964.db2.gz UBARROXFQWGTLO-UHFFFAOYSA-N 0 0 351.156 3.618 20 5 FHBDRN COCc1cccc(NC(=O)c2ccc(Br)c([N+](=O)[O-])c2)c1 ZINC000026032188 946433920 /nfs/dbraw/zinc/43/39/20/946433920.db2.gz PVXANSGUHOCNEC-UHFFFAOYSA-N 0 0 365.183 3.756 20 5 FHBDRN C[C@H]1Cc2ccccc2N1C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000129489831 946434188 /nfs/dbraw/zinc/43/41/88/946434188.db2.gz PPNKWOHHKVHOBO-JTQLQIEISA-N 0 0 361.195 3.949 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])Nc1cccc(OC(F)(F)F)c1 ZINC000047834690 946441283 /nfs/dbraw/zinc/44/12/83/946441283.db2.gz WKEVAMLJMHIZMA-UHFFFAOYSA-N 0 0 355.272 3.815 20 5 FHBDRN COCCOc1cc(C)ccc1NC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000047855835 946444048 /nfs/dbraw/zinc/44/40/48/946444048.db2.gz WUNXFTBKQXDZFE-AWEZNQCLSA-N 0 0 373.409 3.811 20 5 FHBDRN CSc1cccc(C(=O)N[C@@H]2CCCN(c3ccccc3)C2)c1[N+](=O)[O-] ZINC000186512722 946444788 /nfs/dbraw/zinc/44/47/88/946444788.db2.gz GHPVZZMTVSZIFW-CQSZACIVSA-N 0 0 371.462 3.716 20 5 FHBDRN CN(C(=O)CNc1ccccc1[N+](=O)[O-])[C@@H]1CCC[C@@H]1c1ccccc1 ZINC001299178979 946453874 /nfs/dbraw/zinc/45/38/74/946453874.db2.gz LURJFVVRIFILSD-SJLPKXTDSA-N 0 0 353.422 3.801 20 5 FHBDRN COC(=O)[C@H](NCc1ccc(-c2ccccc2[N+](=O)[O-])o1)c1cccs1 ZINC000475148075 946473961 /nfs/dbraw/zinc/47/39/61/946473961.db2.gz XGYZTNMWJPEHTO-QGZVFWFLSA-N 0 0 372.402 3.920 20 5 FHBDRN COc1cccc2c1N(C(=O)c1cccc(SC)c1[N+](=O)[O-])CCC2 ZINC000186115475 946485778 /nfs/dbraw/zinc/48/57/78/946485778.db2.gz QZXOCECSOZEIGQ-UHFFFAOYSA-N 0 0 358.419 3.918 20 5 FHBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1csc2ccccc12 ZINC000487485951 946494813 /nfs/dbraw/zinc/49/48/13/946494813.db2.gz NMVLDNFGXLSZLG-NSHDSACASA-N 0 0 369.402 3.567 20 5 FHBDRN CCCCc1ccc(C(=O)OCC(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000025817597 946495026 /nfs/dbraw/zinc/49/50/26/946495026.db2.gz ZBIYGRZUFSJPFE-UHFFFAOYSA-N 0 0 356.378 3.733 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1CN[C@@H](C)c1ccc(Br)cn1 ZINC000475500980 946502079 /nfs/dbraw/zinc/50/20/79/946502079.db2.gz IFAHDIBJSKNGNX-NSHDSACASA-N 0 0 350.216 3.912 20 5 FHBDRN CSc1cccc(C(=O)N2C[C@H](C)C(=O)Nc3ccccc32)c1[N+](=O)[O-] ZINC000186533526 946507496 /nfs/dbraw/zinc/50/74/96/946507496.db2.gz FQTIEWIVODFRTH-NSHDSACASA-N 0 0 371.418 3.552 20 5 FHBDRN CSc1cccc(C(=O)N2CCCN(C)c3ccccc32)c1[N+](=O)[O-] ZINC000186532677 946507556 /nfs/dbraw/zinc/50/75/56/946507556.db2.gz NCBDGRJVNNUBMP-UHFFFAOYSA-N 0 0 357.435 3.803 20 5 FHBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H](C)[C@@H](OC)C1 ZINC000469873932 946527728 /nfs/dbraw/zinc/52/77/28/946527728.db2.gz GRJCCGIASYZYCJ-CJNGLKHVSA-N 0 0 366.483 3.984 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N[C@@H]1CCCc2ccc(F)cc21 ZINC000093063465 946535025 /nfs/dbraw/zinc/53/50/25/946535025.db2.gz IKYVBBVMMKDNNF-LJQANCHMSA-N 0 0 367.380 3.952 20 5 FHBDRN CCn1cc(CN(C(=O)NC[C@@H](C)c2ccccc2[N+](=O)[O-])C(C)C)cn1 ZINC000897052659 946538164 /nfs/dbraw/zinc/53/81/64/946538164.db2.gz MEMCXDMPVKVBCG-OAHLLOKOSA-N 0 0 373.457 3.535 20 5 FHBDRN CCC[C@@H](O)CNC(=O)c1ccc(SCCC(C)C)c([N+](=O)[O-])c1 ZINC000475167964 946546116 /nfs/dbraw/zinc/54/61/16/946546116.db2.gz ZDYIDXPZVXJSRI-CQSZACIVSA-N 0 0 354.472 3.624 20 5 FHBDRN COc1ccc(CNC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc32)cc1Cl ZINC000128495104 946548859 /nfs/dbraw/zinc/54/88/59/946548859.db2.gz ICWONJSCAKONJT-UHFFFAOYSA-N 0 0 359.769 3.668 20 5 FHBDRN CCN(C(=O)COc1ccc([N+](=O)[O-])cc1)c1ccc(Cl)cc1F ZINC000441400787 946557021 /nfs/dbraw/zinc/55/70/21/946557021.db2.gz LMDPZPNGBLTIJK-UHFFFAOYSA-N 0 0 352.749 3.819 20 5 FHBDRN CCCC(=O)Nc1cccc(NC(=O)c2cccc([N+](=O)[O-])c2OC)c1C ZINC000475176534 946568529 /nfs/dbraw/zinc/56/85/29/946568529.db2.gz UYKQFQUUSQHASK-UHFFFAOYSA-N 0 0 371.393 3.903 20 5 FHBDRN CC[C@H](C)[C@@](C)(O)CNC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000475188498 946591264 /nfs/dbraw/zinc/59/12/64/946591264.db2.gz CBUILEBDZFWQGD-XPTSAGLGSA-N 0 0 363.336 3.532 20 5 FHBDRN Cc1cc(Cc2noc(-c3cc(-c4ccccn4)no3)n2)ccc1[N+](=O)[O-] ZINC000545782517 946594447 /nfs/dbraw/zinc/59/44/47/946594447.db2.gz VXTSFTLHMJKJJQ-UHFFFAOYSA-N 0 0 363.333 3.594 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)CCc1cccn1C ZINC000159147861 946595985 /nfs/dbraw/zinc/59/59/85/946595985.db2.gz WUISWVPTIUKIET-CYBMUJFWSA-N 0 0 361.467 3.796 20 5 FHBDRN O=C(Nc1ccc(F)c(C2CC2)c1)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000439786431 946603770 /nfs/dbraw/zinc/60/37/70/946603770.db2.gz DEEGMKYUKRSUOI-UHFFFAOYSA-N 0 0 371.368 3.906 20 5 FHBDRN CCC[C@H](C)[C@@H]1CCCN1C(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000159145410 946616754 /nfs/dbraw/zinc/61/67/54/946616754.db2.gz MCYVEJCUNUINFQ-HOCLYGCPSA-N 0 0 356.426 3.821 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N[C@@H](C(=O)OC(C)(C)C)C(C)C ZINC000475550402 946621245 /nfs/dbraw/zinc/62/12/45/946621245.db2.gz RDLPTDKRQWIZJI-OAHLLOKOSA-N 0 0 365.430 3.699 20 5 FHBDRN CCOC(=O)Cc1cccc(NC(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)c1 ZINC000475545565 946629722 /nfs/dbraw/zinc/62/97/22/946629722.db2.gz FGPZRWKXOZYKJV-UHFFFAOYSA-N 0 0 371.393 3.961 20 5 FHBDRN CSc1cccc(C(=O)NC[C@@H](C)Oc2ccccc2F)c1[N+](=O)[O-] ZINC000186594340 946635645 /nfs/dbraw/zinc/63/56/45/946635645.db2.gz XPGGJMZQLJBRQI-LLVKDONJSA-N 0 0 364.398 3.653 20 5 FHBDRN C[C@@H]1C[C@H](c2noc(-c3cc(Br)cc([N+](=O)[O-])c3)n2)CCO1 ZINC000545799313 946645221 /nfs/dbraw/zinc/64/52/21/946645221.db2.gz SLCGDDCGLRUVMP-RKDXNWHRSA-N 0 0 368.187 3.690 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)[C@@H]1COCC[C@@H]1c1ccccc1 ZINC000414731364 946645324 /nfs/dbraw/zinc/64/53/24/946645324.db2.gz SVULFTFYWUXPDS-IAGOWNOFSA-N 0 0 354.406 3.970 20 5 FHBDRN COc1cc(NC(=O)NCCc2ccc([N+](=O)[O-])cc2)ccc1OC(C)C ZINC000186240678 946649002 /nfs/dbraw/zinc/64/90/02/946649002.db2.gz MWDVEKMHGIYLOL-UHFFFAOYSA-N 0 0 373.409 3.755 20 5 FHBDRN CCC(CC)n1nccc1C(=O)Nc1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000151938299 946659306 /nfs/dbraw/zinc/65/93/06/946659306.db2.gz XHSFGWHXZFOJEX-UHFFFAOYSA-N 0 0 353.382 3.953 20 5 FHBDRN CO[C@H]1C[C@H](NC(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1(C)C ZINC000475192498 946660609 /nfs/dbraw/zinc/66/06/09/946660609.db2.gz TZNFYZBAPFEXPM-RYUDHWBXSA-N 0 0 361.320 3.549 20 5 FHBDRN Cc1cc(Cc2noc(CSCc3cccnc3)n2)ccc1[N+](=O)[O-] ZINC000545849780 946668395 /nfs/dbraw/zinc/66/83/95/946668395.db2.gz JZKKAGQVSKAKIR-UHFFFAOYSA-N 0 0 356.407 3.705 20 5 FHBDRN CCOc1ccc([C@@H](C)NC(=O)NCc2cccc([N+](=O)[O-])c2)cc1OC ZINC000067536387 946671586 /nfs/dbraw/zinc/67/15/86/946671586.db2.gz XXAUGWRITPYMHB-CYBMUJFWSA-N 0 0 373.409 3.563 20 5 FHBDRN COc1ccc(NC(=O)c2cc3ccc(F)cc3nc2C)c([N+](=O)[O-])c1 ZINC000121407347 946672714 /nfs/dbraw/zinc/67/27/14/946672714.db2.gz IPIXGVHQQSPBIQ-UHFFFAOYSA-N 0 0 355.325 3.851 20 5 FHBDRN Cc1ccc(NCCCNC(=O)N(C)[C@@H](C)c2ccco2)c([N+](=O)[O-])c1 ZINC000121415476 946699127 /nfs/dbraw/zinc/69/91/27/946699127.db2.gz RVDHFLNYCVUUBK-AWEZNQCLSA-N 0 0 360.414 3.701 20 5 FHBDRN CC[C@@H](Nc1nc(C)cc(C(=O)OC)c1[N+](=O)[O-])c1ccc(OC)cc1 ZINC000550345934 946701453 /nfs/dbraw/zinc/70/14/53/946701453.db2.gz NYLUUFUBTPUVJM-OAHLLOKOSA-N 0 0 359.382 3.657 20 5 FHBDRN CCc1ccc([C@@H](Nc2cnn(CCOC)c2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000544386436 946709292 /nfs/dbraw/zinc/70/92/92/946709292.db2.gz POKMIZALUQXFMF-IBGZPJMESA-N 0 0 370.409 3.795 20 5 FHBDRN O=C(Nc1ccc(-c2cc[nH]n2)cc1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088388726 946723633 /nfs/dbraw/zinc/72/36/33/946723633.db2.gz PFLRYQBNBOVRBK-UHFFFAOYSA-N 0 0 363.377 3.575 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NCCOc1ccc(F)c(F)c1 ZINC000475578931 946736658 /nfs/dbraw/zinc/73/66/58/946736658.db2.gz DPVIDPWFNUCWMP-UHFFFAOYSA-N 0 0 365.336 3.690 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)c2cc(-c3ccccc3)nn2C)cc1[N+](=O)[O-] ZINC001126610448 946737254 /nfs/dbraw/zinc/73/72/54/946737254.db2.gz AYWFMJRXLKHGGH-AWEZNQCLSA-N 0 0 364.405 3.795 20 5 FHBDRN CC(C)CCSc1ccc(C(=O)N2CC[C@@H](O)[C@H](C)C2)cc1[N+](=O)[O-] ZINC000186631280 946747390 /nfs/dbraw/zinc/74/73/90/946747390.db2.gz ROWUYMLVKWRICX-CZUORRHYSA-N 0 0 366.483 3.576 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)Nc1cccc(Oc2ccncc2)c1 ZINC000112183086 946757076 /nfs/dbraw/zinc/75/70/76/946757076.db2.gz VVGOMFPHQXQSEL-UHFFFAOYSA-N 0 0 350.334 3.738 20 5 FHBDRN CC(C)C[C@@]1(C)CC(=O)N(Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1=O ZINC000536276774 946763378 /nfs/dbraw/zinc/76/33/78/946763378.db2.gz ZCMRIYMFFPTKCI-IBGZPJMESA-N 0 0 371.393 3.561 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])Nc1cccc(Oc2ccncc2)c1 ZINC000112198799 946774245 /nfs/dbraw/zinc/77/42/45/946774245.db2.gz RFFTYGFXEABEQG-UHFFFAOYSA-N 0 0 364.361 3.833 20 5 FHBDRN Cc1ccc(C(=O)Nc2c(-c3cccnc3)nc3ccccn32)cc1[N+](=O)[O-] ZINC000440416353 946774672 /nfs/dbraw/zinc/77/46/72/946774672.db2.gz VLHPKRGDIYKZGO-UHFFFAOYSA-N 0 0 373.372 3.865 20 5 FHBDRN O=C(Nc1ncccn1)c1ccccc1Sc1ccccc1[N+](=O)[O-] ZINC000440415610 946774890 /nfs/dbraw/zinc/77/48/90/946774890.db2.gz YXQPIDPKCIPEDB-UHFFFAOYSA-N 0 0 352.375 3.788 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CN(Cc1cccs1)C[C@@H]1CCCO1 ZINC000020954560 946775132 /nfs/dbraw/zinc/77/51/32/946775132.db2.gz IURCSCNJACSIKW-INIZCTEOSA-N 0 0 362.451 3.846 20 5 FHBDRN C[C@H](CNC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1)Oc1ccccc1 ZINC000121455335 946776065 /nfs/dbraw/zinc/77/60/65/946776065.db2.gz VQKVJCXWKZAPNZ-OAHLLOKOSA-N 0 0 369.421 3.736 20 5 FHBDRN O=C(CCSCc1ccccn1)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186303084 946797060 /nfs/dbraw/zinc/79/70/60/946797060.db2.gz VMWISQSOPHHFKZ-UHFFFAOYSA-N 0 0 365.842 3.583 20 5 FHBDRN Cc1ccccc1[C@@H](NC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1C)C(C)C ZINC000112221935 946805776 /nfs/dbraw/zinc/80/57/76/946805776.db2.gz OMOOTMUFWMVMRQ-SFHVURJKSA-N 0 0 369.421 3.664 20 5 FHBDRN O=C(c1ccn(C2CCCC2)n1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000129756103 946806557 /nfs/dbraw/zinc/80/65/57/946806557.db2.gz IEOYAFANBUZWOH-UHFFFAOYSA-N 0 0 354.410 3.711 20 5 FHBDRN CCC[C@@H](NC(=O)CNc1cc([N+](=O)[O-])ccc1OC)c1ccccc1 ZINC000025908599 946821648 /nfs/dbraw/zinc/82/16/48/946821648.db2.gz AVNKDFFSZSQCBJ-MRXNPFEDSA-N 0 0 357.410 3.673 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)c2csc(N3CCCCC3)n2)cc1[N+](=O)[O-] ZINC001126614633 946824627 /nfs/dbraw/zinc/82/46/27/946824627.db2.gz BESYCSZEENPWAV-ZDUSSCGKSA-N 0 0 374.466 3.841 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)c2ccnc(-c3ccccc3)n2)cc1[N+](=O)[O-] ZINC001126614850 946837791 /nfs/dbraw/zinc/83/77/91/946837791.db2.gz GWZJVGLDUVAJMH-AWEZNQCLSA-N 0 0 362.389 3.851 20 5 FHBDRN CN(Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)Cc1cccc(Cl)c1 ZINC000025918366 946842825 /nfs/dbraw/zinc/84/28/25/946842825.db2.gz QMHNSUHWJDSMKL-UHFFFAOYSA-N 0 0 358.785 3.930 20 5 FHBDRN Cc1ccc(-n2cccn2)cc1NC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000475598072 946845537 /nfs/dbraw/zinc/84/55/37/946845537.db2.gz YZXVQUHKDXTRAG-UHFFFAOYSA-N 0 0 361.361 3.823 20 5 FHBDRN O=C(COc1cccc2cccnc21)Nc1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000182582201 946846797 /nfs/dbraw/zinc/84/67/97/946846797.db2.gz YHZUCTMCUTUJOH-UHFFFAOYSA-N 0 0 374.356 3.709 20 5 FHBDRN CC[C@H](C)[C@H](C)N(C1CC1)S(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000729490456 946859884 /nfs/dbraw/zinc/85/98/84/946859884.db2.gz GZPMFCHIQAWFPL-QWRGUYRKSA-N 0 0 360.863 3.836 20 5 FHBDRN CC(C)c1ccc(C(=O)Nc2ccc3c(c2)C(=O)N(C)CC3)cc1[N+](=O)[O-] ZINC000473953922 946863729 /nfs/dbraw/zinc/86/37/29/946863729.db2.gz VZNAJXUFIFNFEB-UHFFFAOYSA-N 0 0 367.405 3.599 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)[C@@H](O)Cc1c(F)cccc1Cl ZINC000475322678 946864241 /nfs/dbraw/zinc/86/42/41/946864241.db2.gz QZANNPYCNJFMGH-INIZCTEOSA-N 0 0 366.776 3.546 20 5 FHBDRN COC(=O)c1ccc(NC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)cc1F ZINC000473948409 946872685 /nfs/dbraw/zinc/87/26/85/946872685.db2.gz CTJXXUGNTBQOJV-UHFFFAOYSA-N 0 0 360.341 3.896 20 5 FHBDRN CN(Cc1nc([C@H]2CCOC3(CCCC3)C2)no1)c1ccccc1[N+](=O)[O-] ZINC000897188425 946875776 /nfs/dbraw/zinc/87/57/76/946875776.db2.gz CGBSPORLIJQDLD-AWEZNQCLSA-N 0 0 372.425 3.821 20 5 FHBDRN Cc1cc2cc[nH]c2cc1NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000444454164 946886006 /nfs/dbraw/zinc/88/60/06/946886006.db2.gz HSMIVEFNZOWFJI-UHFFFAOYSA-N 0 0 361.361 3.823 20 5 FHBDRN C/C=C\c1ccc(OCC(=O)N2CCc3c2cccc3[N+](=O)[O-])c(OC)c1 ZINC000523134462 946886771 /nfs/dbraw/zinc/88/67/71/946886771.db2.gz HVVDDCNNBWVFRS-HYXAFXHYSA-N 0 0 368.389 3.605 20 5 FHBDRN CCOc1cc(C)ccc1CNC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000125598107 946889338 /nfs/dbraw/zinc/88/93/38/946889338.db2.gz PQJIPDBWGSFHLG-UHFFFAOYSA-N 0 0 369.421 3.570 20 5 FHBDRN O=C(COCC1CCCC1)Nc1ccc([N+](=O)[O-])c(Br)c1 ZINC000839312056 946889643 /nfs/dbraw/zinc/88/96/43/946889643.db2.gz JDDBLVVAIRGDRP-UHFFFAOYSA-N 0 0 357.204 3.503 20 5 FHBDRN Cc1cc2cc[nH]c2cc1NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000444457828 946892893 /nfs/dbraw/zinc/89/28/93/946892893.db2.gz NJTOWLWAZJWNTN-UHFFFAOYSA-N 0 0 361.361 3.823 20 5 FHBDRN COCc1cccc(CC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)c1 ZINC000186696471 946894541 /nfs/dbraw/zinc/89/45/41/946894541.db2.gz RUTFDUKXQOPUAQ-UHFFFAOYSA-N 0 0 366.320 3.524 20 5 FHBDRN CSc1cccc(C)c1NC(=O)NCCNc1ccc([N+](=O)[O-])cc1 ZINC000473965735 946898781 /nfs/dbraw/zinc/89/87/81/946898781.db2.gz CECDDZOOSGGKAY-UHFFFAOYSA-N 0 0 360.439 3.859 20 5 FHBDRN O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1CCSC[C@H]1c1nccs1 ZINC000184504069 946901409 /nfs/dbraw/zinc/90/14/09/946901409.db2.gz HAWNXMBNOACJGU-LBPRGKRZSA-N 0 0 369.855 3.635 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)N1CCC[C@H]1c1ccccc1 ZINC000184506547 946901549 /nfs/dbraw/zinc/90/15/49/946901549.db2.gz VCFIPTGVZJKFNE-KRWDZBQOSA-N 0 0 367.405 3.514 20 5 FHBDRN COC(=O)[C@](C)(Cc1ccc(O)cc1)Nc1c(C)cc(C)c([N+](=O)[O-])c1C ZINC001168080313 946907986 /nfs/dbraw/zinc/90/79/86/946907986.db2.gz JWNFWOWIDSANDS-FQEVSTJZSA-N 0 0 372.421 3.812 20 5 FHBDRN C/C(=C/c1ccc(Br)o1)C(=O)NCc1cccc([N+](=O)[O-])c1 ZINC001126173089 946910017 /nfs/dbraw/zinc/91/00/17/946910017.db2.gz UHLQDPSSMZTFOM-YFHOEESVSA-N 0 0 365.183 3.670 20 5 FHBDRN O=C(NCCCO[C@H]1CCCc2ccccc21)c1c(F)cccc1[N+](=O)[O-] ZINC001126175743 946912326 /nfs/dbraw/zinc/91/23/26/946912326.db2.gz FAJCOZRROALZIF-SFHVURJKSA-N 0 0 372.396 3.948 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)NC/C=C/c2ccccc2)cc1SC ZINC000112584002 946916727 /nfs/dbraw/zinc/91/67/27/946916727.db2.gz GMXZBTYKRAIMPH-RMKNXTFCSA-N 0 0 358.419 3.769 20 5 FHBDRN O=C(Cn1ccc2c1cccc2[N+](=O)[O-])Nc1ccc(Br)cc1 ZINC000112653845 946919677 /nfs/dbraw/zinc/91/96/77/946919677.db2.gz YKKLZCKMNYFRJP-UHFFFAOYSA-N 0 0 374.194 3.951 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)N[C@@H]1C[C@H]1c1cccc(F)c1 ZINC000184509057 946920422 /nfs/dbraw/zinc/92/04/22/946920422.db2.gz CABWWPJLKYIHSG-GOEBONIOSA-N 0 0 363.776 3.743 20 5 FHBDRN COc1ccc([C@@H](NC(=O)CCc2cccc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000087064588 946920490 /nfs/dbraw/zinc/92/04/90/946920490.db2.gz STKKLMPHPCDNPF-FQEVSTJZSA-N 0 0 354.406 3.804 20 5 FHBDRN Cc1ccc([C@H](C)CNC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)cc1 ZINC000523148975 946925581 /nfs/dbraw/zinc/92/55/81/946925581.db2.gz HZDHEFUAXTTXJC-OAHLLOKOSA-N 0 0 351.406 3.778 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)S(=O)(=O)c1cccc(Cl)c1 ZINC000511909583 946937118 /nfs/dbraw/zinc/93/71/18/946937118.db2.gz IRXPNLZRWQDQSM-UHFFFAOYSA-N 0 0 368.842 3.848 20 5 FHBDRN CC(C)(C(=O)N1CCS[C@@H]2CCCC[C@@H]21)c1ccc([N+](=O)[O-])cc1F ZINC000546539866 946948629 /nfs/dbraw/zinc/94/86/29/946948629.db2.gz WSJUKLRTWCYUJE-JKSUJKDBSA-N 0 0 366.458 3.898 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@H]1C[C@H]1c1ccc(F)cc1F ZINC000186334691 946948998 /nfs/dbraw/zinc/94/89/98/946948998.db2.gz YFUZMJVQLAUTLX-KBPBESRZSA-N 0 0 366.751 3.946 20 5 FHBDRN Cc1nc(-c2ccsc2)ccc1C(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000523153435 946953559 /nfs/dbraw/zinc/95/35/59/946953559.db2.gz IVNAARJUOXCLST-UHFFFAOYSA-N 0 0 367.430 3.999 20 5 FHBDRN C[C@H](Oc1ccc(F)cc1Cl)C(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000112781343 946954311 /nfs/dbraw/zinc/95/43/11/946954311.db2.gz NJJXJFCGPUNWKM-JTQLQIEISA-N 0 0 352.749 3.818 20 5 FHBDRN CCOC(C)(C)CNC(=O)c1cc([N+](=O)[O-])ccc1SCC(C)C ZINC000444520835 946971913 /nfs/dbraw/zinc/97/19/13/946971913.db2.gz JZVIRVIFCODCAX-UHFFFAOYSA-N 0 0 354.472 3.888 20 5 FHBDRN Cc1c(NC(=O)C(=O)N[C@H](CC(C)C)c2ccccc2)cccc1[N+](=O)[O-] ZINC000048976081 946982663 /nfs/dbraw/zinc/98/26/63/946982663.db2.gz YSGATYZJHNGJAW-QGZVFWFLSA-N 0 0 369.421 3.745 20 5 FHBDRN CO[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2SCC(C)C)CC[C@@H]1C ZINC000469880322 947003331 /nfs/dbraw/zinc/00/33/31/947003331.db2.gz QGKFAEJVLDEUKL-BBRMVZONSA-N 0 0 366.483 3.840 20 5 FHBDRN CO[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2SCC(C)C)CC[C@@H]1C ZINC000469880329 947003672 /nfs/dbraw/zinc/00/36/72/947003672.db2.gz QGKFAEJVLDEUKL-XJKSGUPXSA-N 0 0 366.483 3.840 20 5 FHBDRN Cc1ccc2c(c1)CC[C@@H]2NS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000511923601 947007891 /nfs/dbraw/zinc/00/78/91/947007891.db2.gz QQKGOLISHULGAV-AWEZNQCLSA-N 0 0 366.826 3.522 20 5 FHBDRN CC(C)(C)OC1CC(CCNC(=O)CSc2ccc([N+](=O)[O-])cc2)C1 ZINC000432262418 947014899 /nfs/dbraw/zinc/01/48/99/947014899.db2.gz MYGAHXSFIXWQLY-UHFFFAOYSA-N 0 0 366.483 3.787 20 5 FHBDRN CC(C)(C)OC1CC(CCNC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000432267578 947025373 /nfs/dbraw/zinc/02/53/73/947025373.db2.gz ANEJBWXTWLKTLD-UHFFFAOYSA-N 0 0 368.861 3.891 20 5 FHBDRN O=C(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1c(Cl)cccc1Cl ZINC000444634226 947046750 /nfs/dbraw/zinc/04/67/50/947046750.db2.gz HDRRYJMWZPBIPA-UHFFFAOYSA-N 0 0 365.176 3.708 20 5 FHBDRN Cc1cc2cc(C(=O)NCc3nc4cc([N+](=O)[O-])ccc4[nH]3)oc2cc1C ZINC000444635151 947048884 /nfs/dbraw/zinc/04/88/84/947048884.db2.gz JYZSLUJGDRCRPY-UHFFFAOYSA-N 0 0 364.361 3.764 20 5 FHBDRN O=[N+]([O-])c1cccc(CS(=O)(=O)N(C2CC2)[C@@H]2CCc3ccccc32)c1 ZINC000152022728 947049923 /nfs/dbraw/zinc/04/99/23/947049923.db2.gz DBJZCFPJCOQOHW-LJQANCHMSA-N 0 0 372.446 3.577 20 5 FHBDRN O=C(NCc1ccc(Br)cc1Cl)c1ccc([N+](=O)[O-])o1 ZINC000049355888 947050835 /nfs/dbraw/zinc/05/08/35/947050835.db2.gz GKAXUUBNALQUMD-UHFFFAOYSA-N 0 0 359.563 3.534 20 5 FHBDRN Cc1csc(CNC(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000452750011 947059236 /nfs/dbraw/zinc/05/92/36/947059236.db2.gz WMXKXRCMHYSJMT-SNVBAGLBSA-N 0 0 354.815 3.702 20 5 FHBDRN C[C@H]1CCc2sc(C(=O)NCc3nc4cc([N+](=O)[O-])ccc4[nH]3)cc2C1 ZINC000444637253 947061166 /nfs/dbraw/zinc/06/11/66/947061166.db2.gz PGBQMKIVRUQDKF-JTQLQIEISA-N 0 0 370.434 3.587 20 5 FHBDRN C[C@H](NC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)c1ccc(F)cc1F ZINC000088478323 947061409 /nfs/dbraw/zinc/06/14/09/947061409.db2.gz UWOONORRTMXVDM-NSHDSACASA-N 0 0 361.348 3.702 20 5 FHBDRN CC[C@H](C)[C@@H](C(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccccc1 ZINC000444632960 947062234 /nfs/dbraw/zinc/06/22/34/947062234.db2.gz QYIGTAOSNFBTSY-ORAYPTAESA-N 0 0 366.421 3.917 20 5 FHBDRN CCC[C@H](C(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccccc1 ZINC000444633692 947063995 /nfs/dbraw/zinc/06/39/95/947063995.db2.gz DMQHVSLWCCHUAL-HNNXBMFYSA-N 0 0 352.394 3.671 20 5 FHBDRN O=C(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccc2c3c(cccc31)CC2 ZINC000444633757 947064924 /nfs/dbraw/zinc/06/49/24/947064924.db2.gz DOXLTRJNYZUWTH-UHFFFAOYSA-N 0 0 372.384 3.653 20 5 FHBDRN CCc1nc2c(s1)[C@H](N(C)Cc1nc3cc([N+](=O)[O-])ccc3[nH]1)CCC2 ZINC000444659715 947077048 /nfs/dbraw/zinc/07/70/48/947077048.db2.gz QHZXCPKBDJGWMY-OAHLLOKOSA-N 0 0 371.466 3.999 20 5 FHBDRN CCS[C@@H]1CCC[C@H]1NC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000182291776 947081590 /nfs/dbraw/zinc/08/15/90/947081590.db2.gz PJBLKVGZDULGPF-DGCLKSJQSA-N 0 0 360.382 3.600 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)Nc1nccn1Cc1ccccc1 ZINC000523284700 947082919 /nfs/dbraw/zinc/08/29/19/947082919.db2.gz AEJSOXWATHPPBX-UHFFFAOYSA-N 0 0 368.418 3.570 20 5 FHBDRN Cc1ccc(NC(=O)CCCNc2ccc([N+](=O)[O-])cc2)cc1[N+](=O)[O-] ZINC000020893698 947098619 /nfs/dbraw/zinc/09/86/19/947098619.db2.gz QBRUGFRBCOKAKQ-UHFFFAOYSA-N 0 0 358.354 3.642 20 5 FHBDRN COc1ccc2c(c1)C[C@H](C)N(Cc1nc3cc([N+](=O)[O-])ccc3[nH]1)[C@H]2C ZINC000444679711 947103665 /nfs/dbraw/zinc/10/36/65/947103665.db2.gz BINFIPDSXZQRSB-STQMWFEESA-N 0 0 366.421 3.988 20 5 FHBDRN CCc1n[nH]c(C(=O)N2C[C@H](c3ccccc3)[C@H]3CCCC[C@@H]32)c1[N+](=O)[O-] ZINC000444356822 947123350 /nfs/dbraw/zinc/12/33/50/947123350.db2.gz FMIBOJFZVOKIQU-INMHGKMJSA-N 0 0 368.437 3.679 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)N(C)Cc1cc(C)cc(C)c1 ZINC000444708336 947136372 /nfs/dbraw/zinc/13/63/72/947136372.db2.gz ZXYMDCANYAXOSG-OAHLLOKOSA-N 0 0 371.437 3.679 20 5 FHBDRN CCOC(=O)[C@H]1CCN(CCOc2cccc([N+](=O)[O-])c2)c2ccccc21 ZINC000444709325 947138074 /nfs/dbraw/zinc/13/80/74/947138074.db2.gz QEWUOZHLKYEHFC-SFHVURJKSA-N 0 0 370.405 3.531 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N(Cc1cccc(F)c1)C(C)C ZINC000511957269 947153179 /nfs/dbraw/zinc/15/31/79/947153179.db2.gz WLKMKNIJIZIAAU-UHFFFAOYSA-N 0 0 366.414 3.642 20 5 FHBDRN COc1ccc(NC(=O)N2CCC[C@@H]2Cc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000543885443 947157331 /nfs/dbraw/zinc/15/73/31/947157331.db2.gz SRIGPXXUSLNFAQ-MRXNPFEDSA-N 0 0 373.384 3.982 20 5 FHBDRN CCN(CC)C(=O)[C@@H](C)Sc1ccc(Br)cc1[N+](=O)[O-] ZINC000088501310 947181632 /nfs/dbraw/zinc/18/16/32/947181632.db2.gz OBJHGEIOECNPIM-SECBINFHSA-N 0 0 361.261 3.706 20 5 FHBDRN CC(=O)Nc1cccc(NC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)c1 ZINC000444824064 947237978 /nfs/dbraw/zinc/23/79/78/947237978.db2.gz FZCYRFFQZWVLNH-UHFFFAOYSA-N 0 0 371.396 3.892 20 5 FHBDRN Nc1c(C(=O)Nc2ccc(OC(F)F)c3cccnc23)cccc1[N+](=O)[O-] ZINC000186412586 947237870 /nfs/dbraw/zinc/23/78/70/947237870.db2.gz LBYGYYOXCTWHAP-UHFFFAOYSA-N 0 0 374.303 3.579 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H](OC)C[C@@H]1C ZINC000441435756 947239709 /nfs/dbraw/zinc/23/97/09/947239709.db2.gz FNTXLWXQQRAUAD-GXTWGEPZSA-N 0 0 352.456 3.736 20 5 FHBDRN Cc1cc(N2CC(C)(C)O[C@@H]3CCC[C@H]32)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000440564877 947239772 /nfs/dbraw/zinc/23/97/72/947239772.db2.gz QEVOVGXEHQWCPO-IAGOWNOFSA-N 0 0 368.437 3.897 20 5 FHBDRN C[C@@H](NC(=O)c1sc(Br)cc1[N+](=O)[O-])c1ccccc1 ZINC000444827743 947242098 /nfs/dbraw/zinc/24/20/98/947242098.db2.gz LGASYXJZARMYEA-MRVPVSSYSA-N 0 0 355.213 3.910 20 5 FHBDRN CN(Cc1cccc(F)c1)C(=O)c1sc(Br)cc1[N+](=O)[O-] ZINC000444829009 947243446 /nfs/dbraw/zinc/24/34/46/947243446.db2.gz PYYSOUNTYIDGTA-UHFFFAOYSA-N 0 0 373.203 3.830 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)N1CC[C@@H](c2ccccc2)C1 ZINC000519915948 947259387 /nfs/dbraw/zinc/25/93/87/947259387.db2.gz XOFBMDHUGLAYGX-QGZVFWFLSA-N 0 0 353.422 3.803 20 5 FHBDRN CC[C@H](COC)NC(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000523455549 947273501 /nfs/dbraw/zinc/27/35/01/947273501.db2.gz RNYTWXIKMTVCFI-CYBMUJFWSA-N 0 0 359.382 3.934 20 5 FHBDRN CC[C@@H](COC)NC(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000523455550 947273601 /nfs/dbraw/zinc/27/36/01/947273601.db2.gz RNYTWXIKMTVCFI-ZDUSSCGKSA-N 0 0 359.382 3.934 20 5 FHBDRN O=C(Nc1ccc2c(c1)CCO2)c1sc(Br)cc1[N+](=O)[O-] ZINC000444856564 947284243 /nfs/dbraw/zinc/28/42/43/947284243.db2.gz ITVSYDYABJJGIE-UHFFFAOYSA-N 0 0 369.196 3.606 20 5 FHBDRN O=C(NCc1ccc(F)c(F)c1)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000444858440 947285483 /nfs/dbraw/zinc/28/54/83/947285483.db2.gz MSLDYMFUIUYDTQ-UHFFFAOYSA-N 0 0 364.351 3.890 20 5 FHBDRN CC(=O)c1ccc(NC(=O)c2sc(Br)cc2[N+](=O)[O-])cc1 ZINC000444861120 947286961 /nfs/dbraw/zinc/28/69/61/947286961.db2.gz RQFYXXJSXLBDRT-UHFFFAOYSA-N 0 0 369.196 3.874 20 5 FHBDRN O=C(Nc1ccc(SC2CCCC2)cc1)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC000444861335 947288284 /nfs/dbraw/zinc/28/82/84/947288284.db2.gz SSSOGJVDHFRHKK-UHFFFAOYSA-N 0 0 359.407 3.982 20 5 FHBDRN C[C@H](Cc1ccsc1)NC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000523493211 947310220 /nfs/dbraw/zinc/31/02/20/947310220.db2.gz NLTZIYPMWITESK-SECBINFHSA-N 0 0 369.240 3.780 20 5 FHBDRN O=[N+]([O-])c1ccc(Br)cc1NCc1ccc(-n2ccnc2)nc1 ZINC000301370032 947312000 /nfs/dbraw/zinc/31/20/00/947312000.db2.gz UTTJNEHVYIIBNR-UHFFFAOYSA-N 0 0 374.198 3.550 20 5 FHBDRN CC(C)(C(=O)N1CCCN(c2ccccc2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000523509303 947321356 /nfs/dbraw/zinc/32/13/56/947321356.db2.gz VYCFGBXLMXLFOO-UHFFFAOYSA-N 0 0 367.449 3.611 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NC(C)(C)c1ccc(F)c(F)c1 ZINC000444901988 947322439 /nfs/dbraw/zinc/32/24/39/947322439.db2.gz USCJVOHKNXFLOU-UHFFFAOYSA-N 0 0 365.336 3.938 20 5 FHBDRN Cc1ccc(NCCCNC(=O)c2ccc(Cl)cc2F)c([N+](=O)[O-])c1 ZINC000523512661 947325740 /nfs/dbraw/zinc/32/57/40/947325740.db2.gz LMMAGESTJSWBBU-UHFFFAOYSA-N 0 0 365.792 3.928 20 5 FHBDRN Cc1ccc(NCCCNC(=O)c2cc(Cl)ccc2F)c([N+](=O)[O-])c1 ZINC000523516398 947328213 /nfs/dbraw/zinc/32/82/13/947328213.db2.gz DFEWMMSRGSSHHT-UHFFFAOYSA-N 0 0 365.792 3.928 20 5 FHBDRN Cc1ccc(NCCCNC(=O)c2ccc3[nH]ccc3c2)c([N+](=O)[O-])c1 ZINC000523517544 947328605 /nfs/dbraw/zinc/32/86/05/947328605.db2.gz KHSKRVBFWPAXHW-UHFFFAOYSA-N 0 0 352.394 3.617 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)NCc2ccc(Br)s2)c1 ZINC000088147434 947334495 /nfs/dbraw/zinc/33/44/95/947334495.db2.gz RACRHXKURIKBLX-UHFFFAOYSA-N 0 0 355.213 3.657 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N1CCC[C@@H]1Cc1ccc(F)cc1 ZINC000444896449 947337052 /nfs/dbraw/zinc/33/70/52/947337052.db2.gz LUMFLOATVBBOEO-OAHLLOKOSA-N 0 0 373.384 3.982 20 5 FHBDRN COc1ccc(CC[C@H](C)NC(=O)Nc2ccc([N+](=O)[O-])cc2OC)cc1 ZINC000444920680 947339243 /nfs/dbraw/zinc/33/92/43/947339243.db2.gz LXZABACZTHSGQP-ZDUSSCGKSA-N 0 0 373.409 3.755 20 5 FHBDRN CCc1ccc(CC)c(NC(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)c1 ZINC000444922937 947340357 /nfs/dbraw/zinc/34/03/57/947340357.db2.gz QCLFVHWLNXSNRS-UHFFFAOYSA-N 0 0 367.409 3.918 20 5 FHBDRN COc1ccc(Cl)cc1CNC(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000444925132 947342475 /nfs/dbraw/zinc/34/24/75/947342475.db2.gz UBKNIZXSWFMHKV-UHFFFAOYSA-N 0 0 365.773 3.587 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cnn([C@H](C)C2CC2)c1 ZINC000186433026 947344048 /nfs/dbraw/zinc/34/40/48/947344048.db2.gz RITHKNWTXYIZKE-VXGBXAGGSA-N 0 0 360.439 3.882 20 5 FHBDRN COc1ccc(C[C@@H](C)CNC(=O)Nc2ccc([N+](=O)[O-])cc2OC)cc1 ZINC000444914463 947351509 /nfs/dbraw/zinc/35/15/09/947351509.db2.gz ROSBRPVSHBNOIC-CYBMUJFWSA-N 0 0 373.409 3.612 20 5 FHBDRN C[C@@H](Oc1ccccc1Cl)C(=O)Nc1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000440614017 947357405 /nfs/dbraw/zinc/35/74/05/947357405.db2.gz FHDJJEWCHWFECB-LLVKDONJSA-N 0 0 371.780 3.624 20 5 FHBDRN Cc1ccc2c(c1)[C@H](Nc1ncc([N+](=O)[O-])c(C)c1Br)CO2 ZINC000544394560 947366472 /nfs/dbraw/zinc/36/64/72/947366472.db2.gz LYQITNHPQZQWQL-LLVKDONJSA-N 0 0 364.199 3.915 20 5 FHBDRN CSc1cccc(N(C)C(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)c1 ZINC000523554624 947368408 /nfs/dbraw/zinc/36/84/08/947368408.db2.gz AGYQBISMPOCTIH-UHFFFAOYSA-N 0 0 355.419 3.934 20 5 FHBDRN Cc1ccc([C@@H](C)NCc2nc(-c3ccc(F)cc3)no2)cc1[N+](=O)[O-] ZINC000181834946 947375120 /nfs/dbraw/zinc/37/51/20/947375120.db2.gz VHLOMMBNVHCPDI-GFCCVEGCSA-N 0 0 356.357 3.943 20 5 FHBDRN CC[C@@H](CNC(=O)c1ccc([N+](=O)[O-])s1)Oc1cccc(Cl)c1 ZINC000440616071 947377124 /nfs/dbraw/zinc/37/71/24/947377124.db2.gz CPUVZDDEDDHDNM-NSHDSACASA-N 0 0 354.815 3.897 20 5 FHBDRN COC[C@H](NC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1)c1ccccc1 ZINC000121519326 947379915 /nfs/dbraw/zinc/37/99/15/947379915.db2.gz QPBVVRUXBKMFFH-SFHVURJKSA-N 0 0 369.421 3.657 20 5 FHBDRN O=C(c1ccncc1Oc1ccccc1)N1CCc2c1cccc2[N+](=O)[O-] ZINC000440628322 947427926 /nfs/dbraw/zinc/42/79/26/947427926.db2.gz JXYBIADSQZWGDO-UHFFFAOYSA-N 0 0 361.357 3.985 20 5 FHBDRN O=C(Nc1ccc(OC2CCCCC2)cc1)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC000445007007 947429808 /nfs/dbraw/zinc/42/98/08/947429808.db2.gz ICLYXAVQCQOHNV-UHFFFAOYSA-N 0 0 357.366 3.659 20 5 FHBDRN COC(C)(C)C[C@H](C)NC(=O)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000445008671 947433357 /nfs/dbraw/zinc/43/33/57/947433357.db2.gz LIKBVIHZTQHDNW-ZDUSSCGKSA-N 0 0 352.434 3.615 20 5 FHBDRN O=[N+]([O-])c1c(NCc2ccncc2OCC(F)F)ccc2ncccc21 ZINC000440639602 947461667 /nfs/dbraw/zinc/46/16/67/947461667.db2.gz SSNCGNKPBDHUPH-UHFFFAOYSA-N 0 0 360.320 3.794 20 5 FHBDRN Cc1cccnc1CCCNC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000452773963 947495326 /nfs/dbraw/zinc/49/53/26/947495326.db2.gz CIRCXNPDFQATAU-UHFFFAOYSA-N 0 0 367.327 3.680 20 5 FHBDRN Cc1[nH]nc(C(=O)Nc2nc(-c3cc(C)c(C)cc3C)cs2)c1[N+](=O)[O-] ZINC000523683686 947512147 /nfs/dbraw/zinc/51/21/47/947512147.db2.gz RCUKVYATEAUVDG-UHFFFAOYSA-N 0 0 371.422 3.927 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N(CC(F)F)c1cccc(Cl)c1 ZINC000440657370 947517378 /nfs/dbraw/zinc/51/73/78/947517378.db2.gz FVEWDYAMAORFEL-UHFFFAOYSA-N 0 0 370.739 3.925 20 5 FHBDRN Cc1c(C(=O)N2C[C@@H](C)O[C@@H](c3ccc(F)cc3)C2)cccc1[N+](=O)[O-] ZINC000152075018 947519802 /nfs/dbraw/zinc/51/98/02/947519802.db2.gz ZRHQJOXBOVLDRM-KZULUSFZSA-N 0 0 358.369 3.645 20 5 FHBDRN CC(C)(C)OC(=O)C1CCC(NC(=O)Nc2cccc([N+](=O)[O-])c2)CC1 ZINC000093926770 947527258 /nfs/dbraw/zinc/52/72/58/947527258.db2.gz LIGWEJJVGXCZOT-UHFFFAOYSA-N 0 0 363.414 3.617 20 5 FHBDRN O=C(Nc1ccc(O[C@H]2CCCC[C@@H]2O)cc1)c1ccc([N+](=O)[O-])cc1F ZINC000125728543 947545050 /nfs/dbraw/zinc/54/50/50/947545050.db2.gz COSAZHWDHGLLBB-ROUUACIJSA-N 0 0 374.368 3.669 20 5 FHBDRN CC(C)(C(=O)NCCCNc1ccccc1)c1ccc([N+](=O)[O-])cc1F ZINC000546570023 947546314 /nfs/dbraw/zinc/54/63/14/947546314.db2.gz QKDZDJAGLDGNPT-UHFFFAOYSA-N 0 0 359.401 3.630 20 5 FHBDRN Cc1cccc(CCNC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)c1 ZINC000445170698 947549270 /nfs/dbraw/zinc/54/92/70/947549270.db2.gz CZURJTDMRSKPJP-UHFFFAOYSA-N 0 0 356.425 3.962 20 5 FHBDRN Cc1cc(S(=O)(=O)N(C)c2cccc3ccccc32)ccc1[N+](=O)[O-] ZINC000523730761 947550547 /nfs/dbraw/zinc/55/05/47/947550547.db2.gz JACFXZUOVQAKTE-UHFFFAOYSA-N 0 0 356.403 3.882 20 5 FHBDRN CSc1cc(C(=O)COc2cccc([N+](=O)[O-])c2C)ccc1NC(C)=O ZINC000053837819 947554222 /nfs/dbraw/zinc/55/42/22/947554222.db2.gz HXZDBFQOMWEVOQ-UHFFFAOYSA-N 0 0 374.418 3.845 20 5 FHBDRN O=[N+]([O-])c1cccc(F)c1CN1CCC[C@@H]1c1nnc(-c2ccccc2)[nH]1 ZINC000120334744 947556932 /nfs/dbraw/zinc/55/69/32/947556932.db2.gz ZJJAGNDXACANIA-QGZVFWFLSA-N 0 0 367.384 3.856 20 5 FHBDRN CCc1cnccc1CNC(=O)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000445149608 947569185 /nfs/dbraw/zinc/56/91/85/947569185.db2.gz LNYVYPNHKZJATA-UHFFFAOYSA-N 0 0 357.413 3.569 20 5 FHBDRN Cc1cccc(NC(=O)[C@H](C)N2CCc3ccc([N+](=O)[O-])cc3C2)c1C ZINC000088605353 947573439 /nfs/dbraw/zinc/57/34/39/947573439.db2.gz QQPYWNLRHOWKBZ-HNNXBMFYSA-N 0 0 353.422 3.597 20 5 FHBDRN COc1ccc([C@H](C)NCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1F ZINC000121539264 947583816 /nfs/dbraw/zinc/58/38/16/947583816.db2.gz CPPLMCATFKRKDL-NSHDSACASA-N 0 0 372.356 3.643 20 5 FHBDRN CC(=O)c1cc(C(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)cs1 ZINC000508520773 947585772 /nfs/dbraw/zinc/58/57/72/947585772.db2.gz QQVBAYMMXNDYIR-UHFFFAOYSA-N 0 0 372.324 3.808 20 5 FHBDRN C[C@H]1C[C@H](c2ccccc2)CN1c1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-] ZINC000523751785 947587106 /nfs/dbraw/zinc/58/71/06/947587106.db2.gz SKJXNOUBUYDPCQ-YOEHRIQHSA-N 0 0 365.433 3.869 20 5 FHBDRN C[C@H]1C[C@@H](c2ccccc2)CN1c1cc2nc[nH]c(=O)c2cc1[N+](=O)[O-] ZINC000523752703 947587719 /nfs/dbraw/zinc/58/77/19/947587719.db2.gz NNZNYTGBBBPXQE-GXTWGEPZSA-N 0 0 350.378 3.626 20 5 FHBDRN CCOc1c(Cl)cc(NC(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)cc1Cl ZINC000445211186 947589761 /nfs/dbraw/zinc/58/97/61/947589761.db2.gz HBEVRKDPPZGMLY-UHFFFAOYSA-N 0 0 372.164 3.653 20 5 FHBDRN COc1ccc2c(c1)CCN2C(=O)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000445198417 947597009 /nfs/dbraw/zinc/59/70/09/947597009.db2.gz VPHOAXNZDCFUKX-UHFFFAOYSA-N 0 0 370.408 3.893 20 5 FHBDRN COC[C@@H](C)N(C)C(=O)c1ccccc1Sc1ccccc1[N+](=O)[O-] ZINC000440674506 947598196 /nfs/dbraw/zinc/59/81/96/947598196.db2.gz GBNSMSJSTMOTCZ-CYBMUJFWSA-N 0 0 360.435 3.853 20 5 FHBDRN Cc1cc(C)n(-c2ccccc2NC(=O)CCc2cccc([N+](=O)[O-])c2)n1 ZINC000087086613 947601457 /nfs/dbraw/zinc/60/14/57/947601457.db2.gz SDYOBFMXRQZGTA-UHFFFAOYSA-N 0 0 364.405 3.969 20 5 FHBDRN CO[C@H]1CCN(C(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000441462824 947611624 /nfs/dbraw/zinc/61/16/24/947611624.db2.gz CNXWJOAOUZITDX-PBHICJAKSA-N 0 0 369.421 3.978 20 5 FHBDRN O=C(COC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)C1CCCCC1 ZINC000021471612 947623756 /nfs/dbraw/zinc/62/37/56/947623756.db2.gz XZZXMFDWLPZZGU-UHFFFAOYSA-N 0 0 374.437 3.504 20 5 FHBDRN Cc1nc(NCc2ccc(COC3CCOCC3)cc2)ccc1[N+](=O)[O-] ZINC000127984275 947624264 /nfs/dbraw/zinc/62/42/64/947624264.db2.gz IRUGLKRDLUZQBU-UHFFFAOYSA-N 0 0 357.410 3.606 20 5 FHBDRN O=C(NC[C@@H]1CCOC1)c1ccccc1Sc1ccccc1[N+](=O)[O-] ZINC000440697634 947627993 /nfs/dbraw/zinc/62/79/93/947627993.db2.gz VWJXYLVYMRWRFI-ZDUSSCGKSA-N 0 0 358.419 3.512 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CN1C[C@@H](c2ccccc2C)OC[C@H]1C ZINC000441463595 947634104 /nfs/dbraw/zinc/63/41/04/947634104.db2.gz KTHYWUQMYJAGJJ-QRWLVFNGSA-N 0 0 356.422 3.874 20 5 FHBDRN C[C@@H](c1ccncc1)N(C)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000273450060 947636491 /nfs/dbraw/zinc/63/64/91/947636491.db2.gz YPMAHGWMTVSUOW-NSHDSACASA-N 0 0 350.216 3.945 20 5 FHBDRN C[C@@H]1CCC[C@H](NC(=O)c2sc(Br)cc2[N+](=O)[O-])[C@@H]1C ZINC000445248173 947645950 /nfs/dbraw/zinc/64/59/50/947645950.db2.gz IZEPGWCCWOLWLT-HLTSFMKQSA-N 0 0 361.261 3.973 20 5 FHBDRN O=C(Nc1ccc(F)c(F)c1)c1sc(Br)cc1[N+](=O)[O-] ZINC000445256858 947659682 /nfs/dbraw/zinc/65/96/82/947659682.db2.gz XSFKYLIXHOUIMV-UHFFFAOYSA-N 0 0 363.139 3.949 20 5 FHBDRN COC(=O)c1ccc2c(c1)CN(Cc1ccc([N+](=O)[O-])cc1Cl)CC2 ZINC000543905848 947662038 /nfs/dbraw/zinc/66/20/38/947662038.db2.gz HMBSGELJTWRKDT-UHFFFAOYSA-N 0 0 360.797 3.593 20 5 FHBDRN O=C(Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1)Nc1cccc2ccccc21 ZINC000508525069 947667766 /nfs/dbraw/zinc/66/77/66/947667766.db2.gz DDWLGUVEWNSGMX-UHFFFAOYSA-N 0 0 373.372 3.645 20 5 FHBDRN CC(C)(C)OC(=O)N1CCCN(c2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000104957818 947677882 /nfs/dbraw/zinc/67/78/82/947677882.db2.gz OBZAFMJNIAURQF-UHFFFAOYSA-N 0 0 355.822 3.695 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1C(=O)OCC(=O)C12CC3CC(CC(C3)C1)C2 ZINC000026114699 947681548 /nfs/dbraw/zinc/68/15/48/947681548.db2.gz CELXTUQZTJOPEB-UHFFFAOYSA-N 0 0 357.406 3.846 20 5 FHBDRN Cc1cnc([C@@H](NC(=O)Nc2ccc([N+](=O)[O-])cc2F)C2CC2)s1 ZINC000544622469 947710889 /nfs/dbraw/zinc/71/08/89/947710889.db2.gz BRZLTBSSSMKCMN-ZDUSSCGKSA-N 0 0 350.375 3.772 20 5 FHBDRN Cc1cccc(C)c1NC(=O)Cc1noc(-c2ccc(F)cc2[N+](=O)[O-])n1 ZINC000445320247 947724923 /nfs/dbraw/zinc/72/49/23/947724923.db2.gz MYTLLGJEWSWKHD-UHFFFAOYSA-N 0 0 370.340 3.582 20 5 FHBDRN O=C(Cc1noc(-c2ccccc2[N+](=O)[O-])n1)Nc1cccc2ccccc21 ZINC000445332232 947731999 /nfs/dbraw/zinc/73/19/99/947731999.db2.gz OWXZQNBDLSDIMY-UHFFFAOYSA-N 0 0 374.356 3.979 20 5 FHBDRN CC[C@]1(C(C)C)C[C@H]1NC(=O)c1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000457305207 947744603 /nfs/dbraw/zinc/74/46/03/947744603.db2.gz VAENSMTUILRBAL-RHSMWYFYSA-N 0 0 372.368 3.759 20 5 FHBDRN Cc1ccc(C)c(CC(=O)O[C@@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)c1 ZINC000759939606 947746642 /nfs/dbraw/zinc/74/66/42/947746642.db2.gz DIAZZYOAVLZELF-DLBZAZTESA-N 0 0 357.410 3.678 20 5 FHBDRN O=[N+]([O-])c1ccc(OC[C@@H](O)COc2ccccc2Cl)c2cccnc21 ZINC000184584222 947747210 /nfs/dbraw/zinc/74/72/10/947747210.db2.gz MLOODXBFERYIPO-GFCCVEGCSA-N 0 0 374.780 3.615 20 5 FHBDRN CNc1ccc(C(=O)Nc2cnn(CC(C)C)c2C(F)F)cc1[N+](=O)[O-] ZINC000536366368 947755636 /nfs/dbraw/zinc/75/56/36/947755636.db2.gz ZLNZFVOFZIIJOJ-UHFFFAOYSA-N 0 0 367.356 3.679 20 5 FHBDRN Cc1cc(F)c(C(=O)O[C@@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)cc1F ZINC000759940088 947790456 /nfs/dbraw/zinc/79/04/56/947790456.db2.gz NUMHHMIJQDFLND-HUUCEWRRSA-N 0 0 365.336 3.719 20 5 FHBDRN CC(=O)c1ccc(OC(=O)c2ccc([N+](=O)[O-])c3cccnc23)c(F)c1 ZINC000162904547 947796379 /nfs/dbraw/zinc/79/63/79/947796379.db2.gz KRDGXAJFQKZRKV-UHFFFAOYSA-N 0 0 354.293 3.704 20 5 FHBDRN C/C(=C/C(=O)Nc1cccnc1-n1ccnc1C)c1ccc([N+](=O)[O-])cc1 ZINC000785340023 947804473 /nfs/dbraw/zinc/80/44/73/947804473.db2.gz HOZCMJISMZJCMC-SEYXRHQNSA-N 0 0 363.377 3.526 20 5 FHBDRN O=C(Cc1c[nH]c2ccccc12)O[C@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1 ZINC000759942309 947805983 /nfs/dbraw/zinc/80/59/83/947805983.db2.gz CCTOXTRLAJJEIN-IRXDYDNUSA-N 0 0 368.393 3.542 20 5 FHBDRN COc1cc(C(=O)Nc2csnc2-c2ccccc2)ccc1[N+](=O)[O-] ZINC001126236832 947810374 /nfs/dbraw/zinc/81/03/74/947810374.db2.gz DXZXBQYWHLSOBK-UHFFFAOYSA-N 0 0 355.375 3.979 20 5 FHBDRN CSc1ccc(C(=O)N[C@H](C)c2ccc(Cl)cn2)cc1[N+](=O)[O-] ZINC000473181173 947814935 /nfs/dbraw/zinc/81/49/35/947814935.db2.gz IYUCEQVFUUWYQR-SECBINFHSA-N 0 0 351.815 3.856 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H](Nc2ccccc2)C(C)C)c1 ZINC000549599935 947817555 /nfs/dbraw/zinc/81/75/55/947817555.db2.gz SJFWICFQLROQDW-GOSISDBHSA-N 0 0 371.437 3.860 20 5 FHBDRN O=[N+]([O-])c1cccc(Cl)c1N1CCC[C@H](c2nnc3ccccn32)C1 ZINC000432309726 947831063 /nfs/dbraw/zinc/83/10/63/947831063.db2.gz YRRXPANLMVPHDG-LBPRGKRZSA-N 0 0 357.801 3.675 20 5 FHBDRN CCN(C[C@@H](O)C(F)(F)F)C(=O)c1cc2ccccc2c2cccnc12 ZINC000189769205 947855705 /nfs/dbraw/zinc/85/57/05/947855705.db2.gz GILGQMAMLJXVEI-MRXNPFEDSA-N 0 0 362.351 3.773 20 5 FHBDRN CC(C)NC(=O)[C@H]1CCC[C@H](Nc2ccnc3c2cccc3[N+](=O)[O-])C1 ZINC000432310475 947863399 /nfs/dbraw/zinc/86/33/99/947863399.db2.gz BKXDSKLXQYFBLB-KBPBESRZSA-N 0 0 356.426 3.638 20 5 FHBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)c1c(F)cccc1[N+](=O)[O-] ZINC001126248474 947864859 /nfs/dbraw/zinc/86/48/59/947864859.db2.gz RQKRNKDIXSQEQW-UHFFFAOYSA-N 0 0 353.693 3.856 20 5 FHBDRN CC(=O)N(c1ccc(NC(=O)c2cc(C)ccc2[N+](=O)[O-])cc1)[C@H]1C[C@@H]1C ZINC000294305440 947869434 /nfs/dbraw/zinc/86/94/34/947869434.db2.gz XEAFFTDHQFEFEG-DJJJIMSYSA-N 0 0 367.405 3.917 20 5 FHBDRN COC(=O)c1cc([N+](=O)[O-])c(NC[C@H](C)c2nccs2)cc1Cl ZINC000302159558 947869718 /nfs/dbraw/zinc/86/97/18/947869718.db2.gz XQNLFLPUTBBOJC-QMMMGPOBSA-N 0 0 355.803 3.707 20 5 FHBDRN COc1ccc([C@@H](CNc2ncccc2[N+](=O)[O-])[NH+]2CCCCC2)cc1 ZINC000015170678 947876771 /nfs/dbraw/zinc/87/67/71/947876771.db2.gz FZOBDMUXQRWISU-GOSISDBHSA-N 0 0 356.426 3.638 20 5 FHBDRN CCCCN(C)c1nnc(-c2cccc([N+](=O)[O-])c2)n1C[C@@H]1CCCCO1 ZINC000549605302 947884866 /nfs/dbraw/zinc/88/48/66/947884866.db2.gz BWVDECIHNFZSDT-KRWDZBQOSA-N 0 0 373.457 3.659 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCC[C@@H](SC)C1 ZINC000248400436 947908314 /nfs/dbraw/zinc/90/83/14/947908314.db2.gz XSUPLVLFBWPYGO-BFYDXBDKSA-N 0 0 350.484 3.954 20 5 FHBDRN CC(C)c1ccc(C(=O)NCc2ccc3c(c2)OCCCO3)cc1[N+](=O)[O-] ZINC000473187874 947922587 /nfs/dbraw/zinc/92/25/87/947922587.db2.gz RUKDXFIBJIGVOR-UHFFFAOYSA-N 0 0 370.405 3.810 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)NCc1ccccc1OC(F)(F)F ZINC000152319035 947926551 /nfs/dbraw/zinc/92/65/51/947926551.db2.gz CAMWGHKWNWVPQP-UHFFFAOYSA-N 0 0 368.311 3.742 20 5 FHBDRN CC(C)[C@H](NC(=O)Cn1ccc([N+](=O)[O-])n1)c1ccc(C(C)(C)C)cc1 ZINC000511977833 947945974 /nfs/dbraw/zinc/94/59/74/947945974.db2.gz QKGNHLHHEAEWSW-SFHVURJKSA-N 0 0 358.442 3.602 20 5 FHBDRN O=C(c1csc(N2CCCCC2)n1)N1CCCc2ccc([N+](=O)[O-])cc21 ZINC000888932146 947951832 /nfs/dbraw/zinc/95/18/32/947951832.db2.gz YJUPDUMYYAVQRD-UHFFFAOYSA-N 0 0 372.450 3.635 20 5 FHBDRN O=C(OCc1ccc([N+](=O)[O-])cc1Br)[C@H]1CC12CCCC2 ZINC001126271737 947961776 /nfs/dbraw/zinc/96/17/76/947961776.db2.gz WMWQXKPRSUVZPR-GFCCVEGCSA-N 0 0 354.200 3.981 20 5 FHBDRN Cc1cc(C)n(-c2ccc(CNc3ccnc4c3cccc4[N+](=O)[O-])cn2)n1 ZINC000432317586 947973287 /nfs/dbraw/zinc/97/32/87/947973287.db2.gz KJMBNAAAQXYLCR-UHFFFAOYSA-N 0 0 374.404 3.953 20 5 FHBDRN COc1ccc(SCCC(=O)N2CCc3cc([N+](=O)[O-])ccc32)cc1 ZINC000105307750 947995126 /nfs/dbraw/zinc/99/51/26/947995126.db2.gz LHSWUQHDJQVXKK-UHFFFAOYSA-N 0 0 358.419 3.675 20 5 FHBDRN CC(C)C[C@H]1COCCN1C(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000131157844 948000715 /nfs/dbraw/zinc/00/07/15/948000715.db2.gz CACSCWRAGQYIDK-AWEZNQCLSA-N 0 0 360.332 3.501 20 5 FHBDRN O=C(c1ccc(Cl)c([N+](=O)[O-])c1)N(Cc1ccco1)C[C@@H]1CCCO1 ZINC000000741273 948006023 /nfs/dbraw/zinc/00/60/23/948006023.db2.gz LCZVCJNHVZDCEV-AWEZNQCLSA-N 0 0 364.785 3.663 20 5 FHBDRN Cc1c(C(=O)N2C[C@H](C)Cc3ccccc32)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000105378719 948022831 /nfs/dbraw/zinc/02/28/31/948022831.db2.gz QDOSINQJTCCOFA-LLVKDONJSA-N 0 0 355.350 3.650 20 5 FHBDRN CCc1ccccc1NC(=O)CN(C)c1ccnc2c1cccc2[N+](=O)[O-] ZINC000432321695 948024866 /nfs/dbraw/zinc/02/48/66/948024866.db2.gz HHMINICHMDIQBU-UHFFFAOYSA-N 0 0 364.405 3.780 20 5 FHBDRN O=[N+]([O-])c1cc2c(ncnc2NCCc2cc(C(F)(F)F)ccn2)s1 ZINC000549615499 948033667 /nfs/dbraw/zinc/03/36/67/948033667.db2.gz DKOMNAKKCHEXTD-UHFFFAOYSA-N 0 0 369.328 3.668 20 5 FHBDRN C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCc2ccc(Cl)cc2C1 ZINC000536416496 948033828 /nfs/dbraw/zinc/03/38/28/948033828.db2.gz JRLHCKLHILQILJ-LBPRGKRZSA-N 0 0 359.813 3.634 20 5 FHBDRN CC(C)(C)C(=O)Nc1ccc(C(=O)COc2cc(F)ccc2[N+](=O)[O-])cc1 ZINC000005216247 948043533 /nfs/dbraw/zinc/04/35/33/948043533.db2.gz LZGGZAPZCBIOAW-UHFFFAOYSA-N 0 0 374.368 3.980 20 5 FHBDRN COc1ccc(CNc2ccnc3c2cccc3[N+](=O)[O-])cc1NC(C)=O ZINC000432323737 948047601 /nfs/dbraw/zinc/04/76/01/948047601.db2.gz GGLNDTPUORFLCI-UHFFFAOYSA-N 0 0 366.377 3.722 20 5 FHBDRN C/C=C/c1ccc(OS(=O)(=O)c2cccc([N+](=O)[O-])c2C)c(OC)c1 ZINC000027944387 948079445 /nfs/dbraw/zinc/07/94/45/948079445.db2.gz LULIQBQYNVBWRV-GQCTYLIASA-N 0 0 363.391 3.713 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@H]1c1cccn1C ZINC000184657703 948094443 /nfs/dbraw/zinc/09/44/43/948094443.db2.gz CNHWOOZMJACSLA-LPHOPBHVSA-N 0 0 355.438 3.866 20 5 FHBDRN CN(Cc1nccn1CC(F)(F)F)c1ccnc2c1cccc2[N+](=O)[O-] ZINC000432330862 948116546 /nfs/dbraw/zinc/11/65/46/948116546.db2.gz GOVZKPYFIKKNEF-UHFFFAOYSA-N 0 0 365.315 3.538 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@H]1c1ccncc1 ZINC000184664075 948119132 /nfs/dbraw/zinc/11/91/32/948119132.db2.gz FZSLWWWPDNMDDP-LPHOPBHVSA-N 0 0 353.422 3.922 20 5 FHBDRN CC(=O)c1ccc(OCc2nnc(-c3ccccc3)s2)c([N+](=O)[O-])c1 ZINC000125896573 948122771 /nfs/dbraw/zinc/12/27/71/948122771.db2.gz HQLRMZUGNKYFGZ-UHFFFAOYSA-N 0 0 355.375 3.895 20 5 FHBDRN CCC[C@H](C)NC(=O)[C@H]1CCCN(c2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000432331905 948130038 /nfs/dbraw/zinc/13/00/38/948130038.db2.gz RQCHGWOLWLRMRE-STQMWFEESA-N 0 0 353.850 3.769 20 5 FHBDRN O=[N+]([O-])c1cccc2c(N3CCN(c4ncccc4Cl)CC3)ccnc21 ZINC000432334462 948141694 /nfs/dbraw/zinc/14/16/94/948141694.db2.gz GXDZEPLLPNVCKP-UHFFFAOYSA-N 0 0 369.812 3.518 20 5 FHBDRN COc1c(C)cc(Cl)cc1NC(=O)c1cc([N+](=O)[O-])c(F)cc1N ZINC001301031659 948148549 /nfs/dbraw/zinc/14/85/49/948148549.db2.gz DMYKUXXWANMPPG-UHFFFAOYSA-N 0 0 353.737 3.539 20 5 FHBDRN COc1cc(C(=O)N(C)C/C(C)=C/c2ccccc2)c([N+](=O)[O-])cc1OC ZINC000427589767 948164747 /nfs/dbraw/zinc/16/47/47/948164747.db2.gz UAABIAANUUOCAD-GXDHUFHOSA-N 0 0 370.405 3.788 20 5 FHBDRN O=[N+]([O-])c1cccc2c(NCc3cccc4c3OCCCO4)ccnc21 ZINC000432341893 948167293 /nfs/dbraw/zinc/16/72/93/948167293.db2.gz CPNKRVOZSXNWQC-UHFFFAOYSA-N 0 0 351.362 3.916 20 5 FHBDRN O=C(CC[S@@](=O)CCCCc1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000507771743 948168104 /nfs/dbraw/zinc/16/81/04/948168104.db2.gz GUNMUYWQSPVPDN-SANMLTNESA-N 0 0 374.462 3.695 20 5 FHBDRN O=[N+]([O-])c1cccc2c(NCCc3cc(F)cc4c3OCOC4)ccnc21 ZINC000432341973 948168503 /nfs/dbraw/zinc/16/85/03/948168503.db2.gz DPKNWBBCFOWLRW-UHFFFAOYSA-N 0 0 369.352 3.803 20 5 FHBDRN CN(Cc1cnn(-c2ccccc2)c1)c1ccnc2c1cccc2[N+](=O)[O-] ZINC000432348152 948192365 /nfs/dbraw/zinc/19/23/65/948192365.db2.gz QQHARQWQGQYWEC-UHFFFAOYSA-N 0 0 359.389 3.965 20 5 FHBDRN CCO[C@H]1C[C@H](NC(=O)CCc2c(Cl)cccc2[N+](=O)[O-])C12CCC2 ZINC001126299011 948208540 /nfs/dbraw/zinc/20/85/40/948208540.db2.gz DXPQIOFVEJBAPJ-HOTGVXAUSA-N 0 0 366.845 3.645 20 5 FHBDRN Cc1cccc(O[C@H](C)C(=O)O[C@@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)c1 ZINC000759949027 948208938 /nfs/dbraw/zinc/20/89/38/948208938.db2.gz NJIADNCDIPTWDQ-HYVNUMGLSA-N 0 0 373.409 3.594 20 5 FHBDRN COC(=O)c1cc(NC(=O)C2(c3ccc(C)cc3)CCC2)cc([N+](=O)[O-])c1 ZINC001126300572 948214747 /nfs/dbraw/zinc/21/47/47/948214747.db2.gz PGBXWLXHJYGQRK-UHFFFAOYSA-N 0 0 368.389 3.750 20 5 FHBDRN COC(=O)c1cc(NC(=O)CC2CC(c3ccccc3)C2)cc([N+](=O)[O-])c1 ZINC001126300634 948215583 /nfs/dbraw/zinc/21/55/83/948215583.db2.gz QRMDNWHZZUIJDA-UHFFFAOYSA-N 0 0 368.389 3.904 20 5 FHBDRN Cc1ccc([C@@H]2C[C@@H](C)N(S(=O)(=O)c3ccc([N+](=O)[O-])cc3C)C2)cc1 ZINC001211697555 948230081 /nfs/dbraw/zinc/23/00/81/948230081.db2.gz UDCLCCNRMJBQTD-NVXWUHKLSA-N 0 0 374.462 3.778 20 5 FHBDRN CC[C@H](C)[C@@H](C)N(C(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1)C1CC1 ZINC000520524445 948230108 /nfs/dbraw/zinc/23/01/08/948230108.db2.gz NRKBGAUTMIORST-UONOGXRCSA-N 0 0 356.426 3.820 20 5 FHBDRN CCc1c(C(=O)N2CCCc3ccc([N+](=O)[O-])cc32)cnn1CCC(C)C ZINC000427592372 948235513 /nfs/dbraw/zinc/23/55/13/948235513.db2.gz DSVSDSQUTCKFRB-UHFFFAOYSA-N 0 0 370.453 3.993 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](C)c2ccccc2OC(C)C)c1 ZINC000147090892 948250249 /nfs/dbraw/zinc/25/02/49/948250249.db2.gz JXVUULZKEXVBFE-ZDUSSCGKSA-N 0 0 358.394 3.882 20 5 FHBDRN CC[C@]1(C)Oc2ccc(NC(=O)COc3ccc([N+](=O)[O-])c(C)c3)cc2O1 ZINC000432373791 948255212 /nfs/dbraw/zinc/25/52/12/948255212.db2.gz AGVBQNMNABKQLX-LJQANCHMSA-N 0 0 372.377 3.818 20 5 FHBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N[C@H]2CCCC[C@@H]2c2ccccc2)c1 ZINC000512036149 948255477 /nfs/dbraw/zinc/25/54/77/948255477.db2.gz DXZTXCKGNPFDQA-MSOLQXFVSA-N 0 0 360.435 3.600 20 5 FHBDRN COC1CCC(C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)CC1 ZINC000585750502 948258147 /nfs/dbraw/zinc/25/81/47/948258147.db2.gz CZBFSJJEDWTZSQ-UHFFFAOYSA-N 0 0 357.204 3.501 20 5 FHBDRN Cc1c(Cl)cccc1N1CCCN(C(=O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000585749309 948261297 /nfs/dbraw/zinc/26/12/97/948261297.db2.gz PZBBEJPHZVNIKP-UHFFFAOYSA-N 0 0 373.840 3.909 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC(CCCO)CC1 ZINC000543946251 948271072 /nfs/dbraw/zinc/27/10/72/948271072.db2.gz OWVMZCDGMPHQAL-UHFFFAOYSA-N 0 0 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359.407 3.889 20 5 FHBDRN Cc1cc2cc(CNC(=O)N(C)CCc3ccccc3[N+](=O)[O-])ccc2[nH]1 ZINC000512181770 948703581 /nfs/dbraw/zinc/70/35/81/948703581.db2.gz IGIAHGBVSNIQED-UHFFFAOYSA-N 0 0 366.421 3.769 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)N[C@H]1C[C@H](c2ccc(F)cc2)C1 ZINC000432519951 948722728 /nfs/dbraw/zinc/72/27/28/948722728.db2.gz QQIZKAKZAXXTHG-SAABIXHNSA-N 0 0 371.412 3.864 20 5 FHBDRN CC(C)COc1ccc(NC(=O)N(C)Cc2ccccc2[N+](=O)[O-])cn1 ZINC000523980342 948737477 /nfs/dbraw/zinc/73/74/77/948737477.db2.gz DJKOTZRQCIGPDO-UHFFFAOYSA-N 0 0 358.398 3.689 20 5 FHBDRN COc1cc(C(=O)Nc2nc(-c3ccccc3)co2)cc([N+](=O)[O-])c1C ZINC000508529362 948741936 /nfs/dbraw/zinc/74/19/36/948741936.db2.gz AEYDUZFTHCBRIJ-UHFFFAOYSA-N 0 0 353.334 3.819 20 5 FHBDRN Cc1cc(SCC(=O)Nc2ccccc2[N+](=O)[O-])n(-c2ccccc2)n1 ZINC000571943091 948750713 /nfs/dbraw/zinc/75/07/13/948750713.db2.gz OEEQCOCYTQHRNT-UHFFFAOYSA-N 0 0 368.418 3.820 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)Oc2ccc3c(c2)OC(=O)C[C@H]3C)c1 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Cc1sc(C(=O)Nc2ccc3[nH]c([C@H]4CCCO4)nc3c2)cc1[N+](=O)[O-] ZINC000109021546 209295702 /nfs/dbraw/zinc/29/57/02/209295702.db2.gz HPHWQYDDRFGRBW-CQSZACIVSA-N 0 0 372.406 3.945 20 5 FHBDRN COc1c(F)cc(NCc2nc(-c3cccc([N+](=O)[O-])c3)no2)cc1F ZINC000108428783 209287080 /nfs/dbraw/zinc/28/70/80/209287080.db2.gz HWKYUXOXIWTBMM-UHFFFAOYSA-N 0 0 362.292 3.544 20 5 FHBDRN Cc1ccc(C(=O)NCc2cc(F)ccc2Br)cc1[N+](=O)[O-] ZINC000108375417 209286352 /nfs/dbraw/zinc/28/63/52/209286352.db2.gz NNSLVOYNKWITDM-UHFFFAOYSA-N 0 0 367.174 3.735 20 5 FHBDRN O=C(c1cnn(-c2cccc(Cl)c2)c1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000108258905 209283972 /nfs/dbraw/zinc/28/39/72/209283972.db2.gz FXEGJUDAKKMAQR-UHFFFAOYSA-N 0 0 368.780 3.637 20 5 FHBDRN O=C(Nc1ccc(OC(F)F)cc1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000107512810 209277512 /nfs/dbraw/zinc/27/75/12/209277512.db2.gz PYMWNONIPBCREP-UHFFFAOYSA-N 0 0 374.303 3.634 20 5 FHBDRN C[C@@H](NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)c1cccc(Cl)c1 ZINC000107512598 209277801 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O=[N+]([O-])c1cc(S(=O)(=O)N2CCCCCC2)ccc1NC1CCCC1 ZINC000008148965 207220428 /nfs/dbraw/zinc/22/04/28/207220428.db2.gz QPYZKUBPGOXPHW-UHFFFAOYSA-N 0 0 367.471 3.514 20 5 FHBDRN Cc1ccc(C(=O)Nc2nc3cc4c(cc3s2)OCCO4)cc1[N+](=O)[O-] ZINC000011751332 207319878 /nfs/dbraw/zinc/31/98/78/207319878.db2.gz CQHMLIPHQIEDIC-UHFFFAOYSA-N 0 0 371.374 3.536 20 5 FHBDRN O=C1c2ccc([N+](=O)[O-])cc2C(=O)N1Cc1ccc(Cl)c2cccnc12 ZINC000031647682 208013049 /nfs/dbraw/zinc/01/30/49/208013049.db2.gz AASCLTHKLBAHJA-UHFFFAOYSA-N 0 0 367.748 3.593 20 5 FHBDRN O=C(Nc1ccccc1OC(F)F)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000032058856 208023053 /nfs/dbraw/zinc/02/30/53/208023053.db2.gz KOTKQBKSEUUVJC-UHFFFAOYSA-N 0 0 374.303 3.634 20 5 FHBDRN COc1cc2c(cc1OC)CN(C/C=C\c1ccccc1[N+](=O)[O-])CC2 ZINC000033324017 208085567 /nfs/dbraw/zinc/08/55/67/208085567.db2.gz CCWIMBIGBIRCFQ-ALCCZGGFSA-N 0 0 354.406 3.684 20 5 FHBDRN CCC1CCC(N(C(=O)c2cc(C(=O)OC)cc([N+](=O)[O-])c2)C2CC2)CC1 ZINC000045416461 208334099 /nfs/dbraw/zinc/33/40/99/208334099.db2.gz AXFLYBOUDKZAKU-UHFFFAOYSA-N 0 0 374.437 3.955 20 5 FHBDRN Cc1c(C(=O)NCc2ccccc2[N+](=O)[O-])cnn1-c1cccc(Cl)c1 ZINC000046135849 208361640 /nfs/dbraw/zinc/36/16/40/208361640.db2.gz GEFYXYOPGBWZRY-UHFFFAOYSA-N 0 0 370.796 3.672 20 5 FHBDRN C[C@@H](c1ccncc1)N(C)C(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000047277725 208375685 /nfs/dbraw/zinc/37/56/85/208375685.db2.gz RIURVJQMKJWYRK-INIZCTEOSA-N 0 0 371.440 3.769 20 5 FHBDRN O=C(Nc1cccc(C(=O)N2CCCC2)c1)c1ccc([N+](=O)[O-])cc1Cl ZINC000030479613 220620156 /nfs/dbraw/zinc/62/01/56/220620156.db2.gz RRILIEUNPSMGAS-UHFFFAOYSA-N 0 0 373.796 3.737 20 5 FHBDRN Cc1c(CN(C)[C@@H]2CCCN(c3ccccc3)C2=O)cccc1[N+](=O)[O-] ZINC000078736883 132191485 /nfs/dbraw/zinc/19/14/85/132191485.db2.gz JFWCZQIYKAJPTQ-LJQANCHMSA-N 0 0 353.422 3.531 20 5 FHBDRN O=C(Nc1ccc2c(c1)CCC2)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000008030412 132305362 /nfs/dbraw/zinc/30/53/62/132305362.db2.gz GPTWIXVSOIHMGV-UHFFFAOYSA-N 0 0 365.433 3.939 20 5 FHBDRN C[C@@H](Nc1ccccc1[N+](=O)[O-])c1cc(F)ccc1N1CCC(O)CC1 ZINC000078559876 132377275 /nfs/dbraw/zinc/37/72/75/132377275.db2.gz HTCPZGKGOUSLCN-CYBMUJFWSA-N 0 0 359.401 3.868 20 5 FHBDRN O=C(Nc1ccccc1Cl)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000043466105 136121294 /nfs/dbraw/zinc/12/12/94/136121294.db2.gz FJKHMBDBHZWDCL-UHFFFAOYSA-N 0 0 360.801 3.602 20 5 FHBDRN O=C(C1CCN(c2ccccc2[N+](=O)[O-])CC1)N1CCC[C@@H]1C1CCCC1 ZINC000056033465 136127521 /nfs/dbraw/zinc/12/75/21/136127521.db2.gz VUSWDUVXXAGJPM-GOSISDBHSA-N 0 0 371.481 3.992 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@H](CCO)c1ccc(Cl)cc1 ZINC000481360984 567818952 /nfs/dbraw/zinc/81/89/52/567818952.db2.gz QBKQFHSZJKEKCL-MRXNPFEDSA-N 0 0 363.801 3.802 20 5 FHBDRN C[C@@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1F)c1noc(-c2ccccc2)n1 ZINC000541786243 567823498 /nfs/dbraw/zinc/82/34/98/567823498.db2.gz HPBXPYYEEGYZKS-SNVBAGLBSA-N 0 0 371.328 3.667 20 5 FHBDRN CC[C@@H](CNC(=O)Nc1ccc([N+](=O)[O-])cc1F)Oc1ccccc1F ZINC000541785700 567830465 /nfs/dbraw/zinc/83/04/65/567830465.db2.gz ZKMQFCHKETYNCR-LBPRGKRZSA-N 0 0 365.336 3.852 20 5 FHBDRN CN(CCOc1cccc(Cl)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1F ZINC000541787572 567832516 /nfs/dbraw/zinc/83/25/16/567832516.db2.gz RVINDEYYVFNXIL-UHFFFAOYSA-N 0 0 367.764 3.930 20 5 FHBDRN O=C(c1c[nH]c2cccc([N+](=O)[O-])c21)N1CCC(Cc2nccs2)CC1 ZINC000601743880 567833584 /nfs/dbraw/zinc/83/35/84/567833584.db2.gz UKYDHPJYQDEEOH-UHFFFAOYSA-N 0 0 370.434 3.628 20 5 FHBDRN CCc1nc(CC(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cs1 ZINC000452867983 567834096 /nfs/dbraw/zinc/83/40/96/567834096.db2.gz YJSRXMXJQHPMER-CQSZACIVSA-N 0 0 359.451 3.562 20 5 FHBDRN Cc1ccc(F)cc1C(=O)C(=O)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452870192 567834367 /nfs/dbraw/zinc/83/43/67/567834367.db2.gz ZMDSQCVVCSCDAM-HNNXBMFYSA-N 0 0 370.380 3.631 20 5 FHBDRN C[C@H](OCc1ccccc1)C(=O)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452864294 567836124 /nfs/dbraw/zinc/83/61/24/567836124.db2.gz VZIRPTFVTAQSJZ-LPHOPBHVSA-N 0 0 368.433 3.906 20 5 FHBDRN CO[C@@H]1CCN(C(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000452863222 567837046 /nfs/dbraw/zinc/83/70/46/567837046.db2.gz DVWRARPUNSRONS-IFXJQAMLSA-N 0 0 369.421 3.835 20 5 FHBDRN CC[C@@](C)(NCC(=O)Nc1ccc([N+](=O)[O-])cc1C)c1nc(C)cs1 ZINC000072863053 567840875 /nfs/dbraw/zinc/84/08/75/567840875.db2.gz GKFMDGHFNYNRBA-QGZVFWFLSA-N 0 0 362.455 3.522 20 5 FHBDRN CCS[C@H]1CC[C@@H](N(C)S(=O)(=O)c2c(C)cc([N+](=O)[O-])cc2C)C1 ZINC000481379307 567863219 /nfs/dbraw/zinc/86/32/19/567863219.db2.gz VYNFVDAJZPTVIF-HIFRSBDPSA-N 0 0 372.512 3.506 20 5 FHBDRN NS(=O)(=O)c1ccc(Sc2ccc3ccccc3c2)c([N+](=O)[O-])c1 ZINC000008063776 567871269 /nfs/dbraw/zinc/87/12/69/567871269.db2.gz FZTDWLBBXFISAI-UHFFFAOYSA-N 0 0 360.416 3.547 20 5 FHBDRN CCCN1CCN(C(=O)c2cccc([N+](=O)[O-])c2C)c2ccc(F)cc21 ZINC000481390081 567882053 /nfs/dbraw/zinc/88/20/53/567882053.db2.gz CEUUTCLHAFWZPE-UHFFFAOYSA-N 0 0 357.385 3.919 20 5 FHBDRN O=C(C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1)Nc1ccc(Cl)cc1 ZINC000481401842 567888891 /nfs/dbraw/zinc/88/88/91/567888891.db2.gz JHPDJQQJDXBBSX-QGZVFWFLSA-N 0 0 373.840 3.798 20 5 FHBDRN CC(=O)Nc1cccc(C(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000452895048 567903081 /nfs/dbraw/zinc/90/30/81/567903081.db2.gz YAIVJNWZXIKJNT-QGZVFWFLSA-N 0 0 367.405 3.573 20 5 FHBDRN O=[N+]([O-])c1ccc(SC[C@H](O)COc2cccc3ccccc32)nc1 ZINC000159183962 567906054 /nfs/dbraw/zinc/90/60/54/567906054.db2.gz BASGHHLDAADQKW-OAHLLOKOSA-N 0 0 356.403 3.675 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NCc1ccc2[nH]c(C)cc2c1 ZINC000481421958 567913466 /nfs/dbraw/zinc/91/34/66/567913466.db2.gz DOUAYGIODHERND-UHFFFAOYSA-N 0 0 354.366 3.715 20 5 FHBDRN CCOCc1nc([C@H](C)NCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)no1 ZINC000290982841 567917481 /nfs/dbraw/zinc/91/74/81/567917481.db2.gz UHCZRRMVAZASIL-LBPRGKRZSA-N 0 0 372.381 3.625 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N(C)Cc1ccccc1N(C)C ZINC000568134090 567930629 /nfs/dbraw/zinc/93/06/29/567930629.db2.gz NMYLXNVXUPFWRH-UHFFFAOYSA-N 0 0 356.426 3.942 20 5 FHBDRN C[C@@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)c2ccccc21 ZINC000541825341 567930792 /nfs/dbraw/zinc/93/07/92/567930792.db2.gz UJKAUCZISNLVPU-GFCCVEGCSA-N 0 0 364.398 3.827 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N1CC=C(c2ccccc2C)C1 ZINC000541832948 567937303 /nfs/dbraw/zinc/93/73/03/567937303.db2.gz OFUQYCKSGZZKTD-UHFFFAOYSA-N 0 0 367.405 3.521 20 5 FHBDRN COc1cc(C)cc(C(=O)N2CCS[C@H]2c2ccc([N+](=O)[O-])cc2)c1O ZINC000436588684 567946190 /nfs/dbraw/zinc/94/61/90/567946190.db2.gz IUJYRFCOZBJTAT-SFHVURJKSA-N 0 0 374.418 3.505 20 5 FHBDRN O=C(NCCc1ccccc1[N+](=O)[O-])c1c([O-])cc(Cl)cc1Cl ZINC000436589347 567946777 /nfs/dbraw/zinc/94/67/77/567946777.db2.gz KDJBJXQGSNSQHF-UHFFFAOYSA-N 0 0 355.177 3.580 20 5 FHBDRN CCOc1ccc(CNC(=O)c2ccc(Cl)cc2[N+](=O)[O-])cc1OC ZINC000481449895 567953813 /nfs/dbraw/zinc/95/38/13/567953813.db2.gz UPWXTGYAQPIDPY-UHFFFAOYSA-N 0 0 364.785 3.586 20 5 FHBDRN Cc1ccccc1C1(C(=O)NCc2cccc([N+](=O)[O-])c2C)CCOCC1 ZINC000481463119 567955142 /nfs/dbraw/zinc/95/51/42/567955142.db2.gz HAFLSYIRRLVOTB-UHFFFAOYSA-N 0 0 368.433 3.576 20 5 FHBDRN Cc1ccc(C)c(N2CCN(C(=O)Nc3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000481453156 567955976 /nfs/dbraw/zinc/95/59/76/567955976.db2.gz MLAKKWZQTPBRDJ-UHFFFAOYSA-N 0 0 354.410 3.566 20 5 FHBDRN O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1CCO[C@H](c2ccsc2)C1 ZINC000120366278 567959852 /nfs/dbraw/zinc/95/98/52/567959852.db2.gz OWNNGFYRRJHEFD-AWEZNQCLSA-N 0 0 352.799 3.523 20 5 FHBDRN CC(C)CCSc1ccc(C(=O)N2CCC[C@H](CO)C2)cc1[N+](=O)[O-] ZINC000128558849 567969814 /nfs/dbraw/zinc/96/98/14/567969814.db2.gz PVBHIQBMZZPDEL-AWEZNQCLSA-N 0 0 366.483 3.578 20 5 FHBDRN CC(C)(CCc1noc([C@H]2C[C@@H]2c2cc(F)c(F)c(F)c2)n1)[N+](=O)[O-] ZINC000291030667 567973046 /nfs/dbraw/zinc/97/30/46/567973046.db2.gz DYIGPUYNHFISJR-ZJUUUORDSA-N 0 0 355.316 3.746 20 5 FHBDRN CC(C)CCSc1ccc(C(=O)N2CCC[C@@H](CO)C2)cc1[N+](=O)[O-] ZINC000128559090 567973077 /nfs/dbraw/zinc/97/30/77/567973077.db2.gz PVBHIQBMZZPDEL-CQSZACIVSA-N 0 0 366.483 3.578 20 5 FHBDRN C[C@@H](CNC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)CC(F)(F)F ZINC000412645400 567975229 /nfs/dbraw/zinc/97/52/29/567975229.db2.gz AEHCKVIJLJSXDQ-GFCCVEGCSA-N 0 0 373.375 3.516 20 5 FHBDRN CC(C)(CCc1noc(COc2c(Cl)cccc2Cl)n1)[N+](=O)[O-] ZINC000291042748 567982146 /nfs/dbraw/zinc/98/21/46/567982146.db2.gz GVOZVIHMJYNRLW-UHFFFAOYSA-N 0 0 360.197 3.943 20 5 FHBDRN CN(C)c1ccccc1CNCc1cc(Br)c([N+](=O)[O-])s1 ZINC000602591411 567995058 /nfs/dbraw/zinc/99/50/58/567995058.db2.gz ASDCLNQMOYIWQO-UHFFFAOYSA-N 0 0 370.272 3.775 20 5 FHBDRN O=C(c1c[nH]c2cc([N+](=O)[O-])ccc12)N1CCOC2(C1)CCCCCC2 ZINC000408222057 567996001 /nfs/dbraw/zinc/99/60/01/567996001.db2.gz OAPFCTFGVGNKNT-UHFFFAOYSA-N 0 0 357.410 3.642 20 5 FHBDRN COc1ccc(CCCC(=O)NCc2cccc([N+](=O)[O-])c2C)c(OC)c1 ZINC000481499120 568006692 /nfs/dbraw/zinc/00/66/92/568006692.db2.gz ZOUHWCGIAJZHIT-UHFFFAOYSA-N 0 0 372.421 3.560 20 5 FHBDRN C[C@@H](C(=O)N1c2ccccc2N(C)CC[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000568348070 568024148 /nfs/dbraw/zinc/02/41/48/568024148.db2.gz PXMWLLWYEUEWFI-LSDHHAIUSA-N 0 0 353.422 3.960 20 5 FHBDRN Cc1ccc(CS(=O)(=O)Nc2ccc([N+](=O)[O-])c3ncccc23)cc1C ZINC000568320757 568024159 /nfs/dbraw/zinc/02/41/59/568024159.db2.gz KYVZNLPSXDYVTL-UHFFFAOYSA-N 0 0 371.418 3.702 20 5 FHBDRN Cc1c(Cc2noc([C@@H]3CCC(=O)[C@@H](C)C3(C)C)n2)cccc1[N+](=O)[O-] ZINC000568325941 568024711 /nfs/dbraw/zinc/02/47/11/568024711.db2.gz CQDLKYRJFUKAGN-OCCSQVGLSA-N 0 0 357.410 3.986 20 5 FHBDRN Cn1cc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl ZINC000568349638 568024741 /nfs/dbraw/zinc/02/47/41/568024741.db2.gz WQNGCNILEQZIHW-WCQYABFASA-N 0 0 354.193 3.526 20 5 FHBDRN Cc1nc(C(=O)NCc2cccc([N+](=O)[O-])c2C)c(-c2ccccc2)o1 ZINC000481503389 568027113 /nfs/dbraw/zinc/02/71/13/568027113.db2.gz SVIOOIWDQZMWAT-UHFFFAOYSA-N 0 0 351.362 3.797 20 5 FHBDRN Cc1sc(C(=O)N(C)CCCc2nc3ccccc3[nH]2)cc1[N+](=O)[O-] ZINC000064445706 568028818 /nfs/dbraw/zinc/02/88/18/568028818.db2.gz RAYLKHOQDKIOJW-UHFFFAOYSA-N 0 0 358.423 3.546 20 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/nfs/dbraw/zinc/04/92/33/568049233.db2.gz AMRJAMNNNWZEAK-CYBMUJFWSA-N 0 0 373.240 3.503 20 5 FHBDRN O=[N+]([O-])c1ccccc1Cc1noc(-c2cc(O)ccc2C(F)(F)F)n1 ZINC000568562564 568051670 /nfs/dbraw/zinc/05/16/70/568051670.db2.gz URZSDSRHJLMKCF-UHFFFAOYSA-N 0 0 365.267 3.960 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@@H]1c1cccn1C ZINC000072905991 568057105 /nfs/dbraw/zinc/05/71/05/568057105.db2.gz VNXJJEKAJSIGPP-SUMWQHHRSA-N 0 0 359.451 3.778 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)Nc2cc(C3CC3)ccn2)cc1OC ZINC000291141311 568063243 /nfs/dbraw/zinc/06/32/43/568063243.db2.gz IWNTYTDPXPYSSZ-UHFFFAOYSA-N 0 0 357.366 3.527 20 5 FHBDRN COCCCCc1cccnc1NC(=O)c1cc(OC)c(C)c([N+](=O)[O-])c1 ZINC000291162107 568067064 /nfs/dbraw/zinc/06/70/64/568067064.db2.gz CPMCHQSINSRTPP-UHFFFAOYSA-N 0 0 373.409 3.528 20 5 FHBDRN Cc1c(NC(=O)[C@@H](C)N2CC3(CC3)c3ccccc32)cccc1[N+](=O)[O-] ZINC000481626547 568072134 /nfs/dbraw/zinc/07/21/34/568072134.db2.gz QSYAAOLBEPTHME-CQSZACIVSA-N 0 0 351.406 3.782 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)NC[C@@H]1CCC2(CCCCC2)O1 ZINC000481634843 568074760 /nfs/dbraw/zinc/07/47/60/568074760.db2.gz ROJJPCLOKCSUBZ-HNNXBMFYSA-N 0 0 364.467 3.685 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)NC[C@H]1CCC2(CCCCC2)O1 ZINC000481634844 568075247 /nfs/dbraw/zinc/07/52/47/568075247.db2.gz ROJJPCLOKCSUBZ-OAHLLOKOSA-N 0 0 364.467 3.685 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)NC[C@H]2CCC3(CCCCC3)O2)c1 ZINC000481644036 568080336 /nfs/dbraw/zinc/08/03/36/568080336.db2.gz LJMCDSJWOJDZLT-CYBMUJFWSA-N 0 0 364.467 3.928 20 5 FHBDRN CC(C)C[C@H](NC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)c1ccccc1 ZINC000481654730 568082204 /nfs/dbraw/zinc/08/22/04/568082204.db2.gz HUWGYBNHVMCLMS-KRWDZBQOSA-N 0 0 352.394 3.988 20 5 FHBDRN CC(=O)C[C@@H](C)NC(=O)c1ccc(SCCC(C)C)c([N+](=O)[O-])c1 ZINC000128624645 568092636 /nfs/dbraw/zinc/09/26/36/568092636.db2.gz BWHUIKROMBHZON-GFCCVEGCSA-N 0 0 352.456 3.830 20 5 FHBDRN CN(C)c1ccc([N+](=O)[O-])c(OC[C@@H](O)Cc2ccc3ccccc3c2)c1 ZINC000481717540 568093820 /nfs/dbraw/zinc/09/38/20/568093820.db2.gz KLDLWPVRAKHECG-IBGZPJMESA-N 0 0 366.417 3.796 20 5 FHBDRN COc1ccc(OC[C@@H](O)Cc2ccc3ccccc3c2)c([N+](=O)[O-])c1 ZINC000481725281 568098398 /nfs/dbraw/zinc/09/83/98/568098398.db2.gz OYCIWUUQLZQEHX-KRWDZBQOSA-N 0 0 353.374 3.739 20 5 FHBDRN COc1ccc(Cc2nnc(SCc3cccc([N+](=O)[O-])c3)o2)cc1 ZINC000024786361 568100272 /nfs/dbraw/zinc/10/02/72/568100272.db2.gz TVVLJRVCTQEKPJ-UHFFFAOYSA-N 0 0 357.391 3.870 20 5 FHBDRN O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)NCc1ccc(C2CC2)cc1F ZINC000568640500 568103403 /nfs/dbraw/zinc/10/34/03/568103403.db2.gz WUPSYLKKHMLQNA-UHFFFAOYSA-N 0 0 364.323 3.748 20 5 FHBDRN C[C@]1(CN[C@H](c2ccc([N+](=O)[O-])cc2)C(F)(F)F)CCO[C@@H]1C1CC1 ZINC000568641003 568103566 /nfs/dbraw/zinc/10/35/66/568103566.db2.gz BTIGFMVHUYAJOP-BZUAXINKSA-N 0 0 358.360 3.993 20 5 FHBDRN Cc1ccnc2ccc(C(=O)Nc3ccc4cc([N+](=O)[O-])ccc4n3)cc12 ZINC000568660975 568113125 /nfs/dbraw/zinc/11/31/25/568113125.db2.gz ZOOJQZIXCGLHHZ-UHFFFAOYSA-N 0 0 358.357 3.674 20 5 FHBDRN CC(=O)Nc1ccc(SCC(=O)Nc2c(C)cccc2[N+](=O)[O-])cc1 ZINC000006919665 568113636 /nfs/dbraw/zinc/11/36/36/568113636.db2.gz WSFJFRGEGVZRPL-UHFFFAOYSA-N 0 0 359.407 3.592 20 5 FHBDRN Cn1c(C(=O)N[C@H](c2ccccc2)c2ccc(F)cc2)ccc1[N+](=O)[O-] ZINC000481771274 568119393 /nfs/dbraw/zinc/11/93/93/568119393.db2.gz QSTNFOKYRZLOGG-GOSISDBHSA-N 0 0 353.353 3.592 20 5 FHBDRN Cc1c(C(=O)N2CCC[C@]2(C)CC(C)C)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000452989122 568123745 /nfs/dbraw/zinc/12/37/45/568123745.db2.gz OTOBIXMFJDEQHG-LJQANCHMSA-N 0 0 371.441 3.525 20 5 FHBDRN CCC[C@@H](NC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1CC)c1ccccc1 ZINC000568700901 568129205 /nfs/dbraw/zinc/12/92/05/568129205.db2.gz OOEHIJYPVMVRRW-QGZVFWFLSA-N 0 0 369.421 3.753 20 5 FHBDRN O=C1COc2c(N[C@H]3CCC[C@@H]3Cc3ccccc3[N+](=O)[O-])cccc2N1 ZINC000568699674 568131883 /nfs/dbraw/zinc/13/18/83/568131883.db2.gz CAIUBZJVNBIEMT-HIFRSBDPSA-N 0 0 367.405 3.749 20 5 FHBDRN O=C(c1cc(Cl)cc(Cl)c1[N+](=O)[O-])N1CCC[C@H](c2ncc[nH]2)C1 ZINC000291471867 568140338 /nfs/dbraw/zinc/14/03/38/568140338.db2.gz JHNCIRMPYNESMK-VIFPVBQESA-N 0 0 369.208 3.645 20 5 FHBDRN COc1ccc(NC(=O)c2cc(C(C)C)n(C(C)(C)C)n2)c([N+](=O)[O-])c1 ZINC000128688263 568140342 /nfs/dbraw/zinc/14/03/42/568140342.db2.gz GLRRNNXTAVTYCO-UHFFFAOYSA-N 0 0 360.414 3.931 20 5 FHBDRN O=C(NC[C@@H]1CCC2(CCCCC2)O1)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000481866334 568145074 /nfs/dbraw/zinc/14/50/74/568145074.db2.gz XFCZJAOVFXSDEH-AWEZNQCLSA-N 0 0 357.410 3.688 20 5 FHBDRN Cc1cc(=O)n(CCCCOc2cccc(C(F)(F)F)c2)cc1[N+](=O)[O-] ZINC000128690347 568145539 /nfs/dbraw/zinc/14/55/39/568145539.db2.gz WJSNHQNXPTZNIC-UHFFFAOYSA-N 0 0 370.327 3.943 20 5 FHBDRN CCC(=O)c1ccc(Oc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])c(F)c1 ZINC000481838073 568147817 /nfs/dbraw/zinc/14/78/17/568147817.db2.gz PFOKCIXTVNOGLN-UHFFFAOYSA-N 0 0 367.354 3.522 20 5 FHBDRN O=C(NCc1ccc(F)cc1F)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000568734597 568150470 /nfs/dbraw/zinc/15/04/70/568150470.db2.gz JFXFRCBGODZSSE-UHFFFAOYSA-N 0 0 360.238 3.822 20 5 FHBDRN C[C@@H]1CN(c2nnc(-c3cccc([N+](=O)[O-])c3)n2C2CC2)C[C@H](C)S1 ZINC000568757816 568181885 /nfs/dbraw/zinc/18/18/85/568181885.db2.gz GXBDWUWWVHMKTQ-TXEJJXNPSA-N 0 0 359.455 3.518 20 5 FHBDRN Cc1ccc(CCCNC(=O)CCOc2ccccc2[N+](=O)[O-])c(C)c1 ZINC000603950270 568187133 /nfs/dbraw/zinc/18/71/33/568187133.db2.gz KRRPQWCWFZQNQY-UHFFFAOYSA-N 0 0 356.422 3.730 20 5 FHBDRN C[S@](=O)c1cccc(NC(=O)c2c([N+](=O)[O-])cccc2C(F)(F)F)c1 ZINC000568763418 568187341 /nfs/dbraw/zinc/18/73/41/568187341.db2.gz JIGPTZNBDAQNPR-VWLOTQADSA-N 0 0 372.324 3.603 20 5 FHBDRN COC(=O)c1cc(OCc2ccccc2C(F)(F)F)ccc1[N+](=O)[O-] ZINC000481942122 568195061 /nfs/dbraw/zinc/19/50/61/568195061.db2.gz IYYLNNWXNPGTMO-UHFFFAOYSA-N 0 0 355.268 3.979 20 5 FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1cccc(C(C)=O)c1 ZINC000481943960 568197850 /nfs/dbraw/zinc/19/78/50/568197850.db2.gz JMRRFJNXLHKMJR-UHFFFAOYSA-N 0 0 374.418 3.788 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N(C)[C@@H]1CCc2ccccc21 ZINC000481968040 568201671 /nfs/dbraw/zinc/20/16/71/568201671.db2.gz TUILQOCGNIFPFF-QGZVFWFLSA-N 0 0 360.435 3.520 20 5 FHBDRN CCOC(=O)c1cc(N[C@H]2CCc3cn(C(C)C)nc3C2)ccc1[N+](=O)[O-] ZINC000481971490 568202532 /nfs/dbraw/zinc/20/25/32/568202532.db2.gz SWXVANCPZYHBBH-HNNXBMFYSA-N 0 0 372.425 3.518 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N(Cc1cccs1)C(C)C ZINC000481976657 568210643 /nfs/dbraw/zinc/21/06/43/568210643.db2.gz KWKMLTFHOIQOLX-UHFFFAOYSA-N 0 0 368.480 3.872 20 5 FHBDRN COC1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)CC1 ZINC000481977200 568210773 /nfs/dbraw/zinc/21/07/73/568210773.db2.gz ZEUUUZVMMWELJI-UHFFFAOYSA-N 0 0 372.446 3.997 20 5 FHBDRN Cc1ccc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)cc1Br ZINC000389111655 568213265 /nfs/dbraw/zinc/21/32/65/568213265.db2.gz NADBLSSZIRPSCA-UHFFFAOYSA-N 0 0 368.162 3.639 20 5 FHBDRN CCOCCC1(CNc2cc(C)c([N+](=O)[O-])c(C(=O)OC)c2)CCC1 ZINC000481992776 568216029 /nfs/dbraw/zinc/21/60/29/568216029.db2.gz MHCKDHOJFREAJS-UHFFFAOYSA-N 0 0 350.415 3.699 20 5 FHBDRN C[C@H](NC(=O)N1CC(C)(C)[C@H]1c1cccnc1)c1cccc([N+](=O)[O-])c1 ZINC000291590237 568217003 /nfs/dbraw/zinc/21/70/03/568217003.db2.gz HKJBTXDDJXHHEX-SUMWQHHRSA-N 0 0 354.410 3.844 20 5 FHBDRN CNc1ccc(C(=O)NCc2ccc(-c3ccccc3)o2)cc1[N+](=O)[O-] ZINC000604183227 568220285 /nfs/dbraw/zinc/22/02/85/568220285.db2.gz PQQCEUQBMOFFLW-UHFFFAOYSA-N 0 0 351.362 3.827 20 5 FHBDRN Cc1cc(Cc2noc(-c3nc4cccnc4s3)n2)ccc1[N+](=O)[O-] ZINC000568799118 568223004 /nfs/dbraw/zinc/22/30/04/568223004.db2.gz ZIZMBNXKPWXRKN-UHFFFAOYSA-N 0 0 353.363 3.549 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N1CCC[C@@H]1[C@@H]1C[C@@H](C)CC[C@H]1O ZINC000408262798 568223401 /nfs/dbraw/zinc/22/34/01/568223401.db2.gz ZQVQQPLABJIPDC-DUOKCRBOSA-N 0 0 374.481 3.922 20 5 FHBDRN C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000482010694 568226798 /nfs/dbraw/zinc/22/67/98/568226798.db2.gz RFLNILLIXDPMLR-VXGBXAGGSA-N 0 0 360.332 3.553 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)Nc1cncc(Cl)c1Br ZINC000568805518 568229040 /nfs/dbraw/zinc/22/90/40/568229040.db2.gz SDRXTUABEFOJGZ-UHFFFAOYSA-N 0 0 370.590 3.587 20 5 FHBDRN CCN(C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F)[C@@H]1CCOC(C)(C)C1 ZINC000291620007 568230310 /nfs/dbraw/zinc/23/03/10/568230310.db2.gz NAGQYXCMXPAOQE-GFCCVEGCSA-N 0 0 372.368 3.616 20 5 FHBDRN O=C(N[C@@H](c1ccccc1)C(F)F)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000482014176 568230596 /nfs/dbraw/zinc/23/05/96/568230596.db2.gz DNXBGXNPSSVUQU-INIZCTEOSA-N 0 0 361.348 3.905 20 5 FHBDRN O=C(N[C@H](c1ccccc1)C(F)F)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000482014178 568230607 /nfs/dbraw/zinc/23/06/07/568230607.db2.gz DNXBGXNPSSVUQU-MRXNPFEDSA-N 0 0 361.348 3.905 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CCC[C@@H]2c2ccccn2)ccc1[N+](=O)[O-] ZINC000568849949 568236172 /nfs/dbraw/zinc/23/61/72/568236172.db2.gz OEKDHZXQHPOBMT-MRXNPFEDSA-N 0 0 355.394 3.754 20 5 FHBDRN O=C(N[C@@H](c1ccccc1)C(F)F)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000482045086 568238221 /nfs/dbraw/zinc/23/82/21/568238221.db2.gz RSWDQCKWMKHXHQ-ZDUSSCGKSA-N 0 0 372.274 3.932 20 5 FHBDRN CCCc1cnc(NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)s1 ZINC000541929350 568249924 /nfs/dbraw/zinc/24/99/24/568249924.db2.gz MXIABNIBCMODSD-UHFFFAOYSA-N 0 0 357.338 3.858 20 5 FHBDRN C[C@@H](CNC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)CC(F)(F)F ZINC000412660326 568250609 /nfs/dbraw/zinc/25/06/09/568250609.db2.gz ROWGSUAEJREJNV-LLVKDONJSA-N 0 0 359.348 3.513 20 5 FHBDRN CCS[C@H]1CCCC[C@@H]1NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000541927811 568251745 /nfs/dbraw/zinc/25/17/45/568251745.db2.gz NONGCDKUKIPDFE-FZMZJTMJSA-N 0 0 374.409 3.990 20 5 FHBDRN C[C@]1(CNC(=O)c2ccc([N+](=O)[O-])cc2Cl)OCCc2sccc21 ZINC000291673464 568252614 /nfs/dbraw/zinc/25/26/14/568252614.db2.gz WDRRAJNTHURILL-MRXNPFEDSA-N 0 0 366.826 3.528 20 5 FHBDRN COc1ccc(NC(=O)N(Cc2ccccc2F)C2CC2)cc1[N+](=O)[O-] ZINC000568924114 568252677 /nfs/dbraw/zinc/25/26/77/568252677.db2.gz VUUQDIHPWPLTHP-UHFFFAOYSA-N 0 0 359.357 3.939 20 5 FHBDRN C[C@@H](CNC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])CC(F)(F)F ZINC000412664555 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ZINC000821883152 599068084 /nfs/dbraw/zinc/06/80/84/599068084.db2.gz QUIOGVHNBUHFCC-SNVBAGLBSA-N 0 0 357.395 3.637 20 5 FHBDRN O=[N+]([O-])c1ccc(N[C@@H]2CCCCc3ccccc32)c(-c2nn[nH]n2)c1 ZINC000738368952 598246015 /nfs/dbraw/zinc/24/60/15/598246015.db2.gz GJGXLAGFMKMDBW-MRXNPFEDSA-N 0 0 350.382 3.655 20 5 FHBDRN O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1N1CCC[C@H](c2ccccc2)CC1 ZINC000738360295 598459370 /nfs/dbraw/zinc/45/93/70/598459370.db2.gz VGJVAYAIRBANQD-HNNXBMFYSA-N 0 0 364.409 3.549 20 5 FHBDRN CCCCCOc1ccc(Oc2ncc([N+](=O)[O-])cc2-c2nn[nH]n2)cc1 ZINC000821060372 599427933 /nfs/dbraw/zinc/42/79/33/599427933.db2.gz CKZXBADFRJUXNT-UHFFFAOYSA-N 0 0 370.369 3.531 20 5 FHBDRN CCc1ccc([C@@H]2CCCCN2c2ccc([N+](=O)[O-])cc2-c2nn[nH]n2)o1 ZINC000821481817 599578595 /nfs/dbraw/zinc/57/85/95/599578595.db2.gz OTZHFTTVLGLMFJ-INIZCTEOSA-N 0 0 368.397 3.662 20 5 FHBDRN CCC(CC)(CC(=O)[O-])[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000828804724 601260659 /nfs/dbraw/zinc/26/06/59/601260659.db2.gz QZRONCANMRSZBP-UHFFFAOYSA-N 0 0 363.439 3.841 20 5 FHBDRN CC[C@@H]([NH2+]Cc1cc(C)c(OCC(=O)[O-])c(C)c1)c1cccc([N+](=O)[O-])c1 ZINC000828988762 601265907 /nfs/dbraw/zinc/26/59/07/601265907.db2.gz DAQYOWRMFKKADU-GOSISDBHSA-N 0 0 372.421 3.916 20 5 FHBDRN O=C([O-])[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1cc(Cl)cc(Cl)c1 ZINC000833169883 601973830 /nfs/dbraw/zinc/97/38/30/601973830.db2.gz MQCQCLQCKWPLEF-CQSZACIVSA-N 0 0 355.177 3.817 20 5 FHBDRN C[C@]1(C(=O)[O-])CC[N@H+](Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)C1 ZINC000414659574 604677789 /nfs/dbraw/zinc/67/77/89/604677789.db2.gz TWTOLMWTJGEZHS-IBGZPJMESA-N 0 0 374.368 3.823 20 5 FHBDRN CCOc1ccc([C@H](C)[NH2+]CCc2ccc(NC(=O)[O-])cc2)cc1[N+](=O)[O-] ZINC000833664140 605002828 /nfs/dbraw/zinc/00/28/28/605002828.db2.gz PEDIBKNSCBGFKW-ZDUSSCGKSA-N 0 0 373.409 3.977 20 5 FHBDRN O=[N+]([O-])c1ccc2oc(C(Cl)=Cc3ccc(-c4nn[nH]n4)cc3)nc2c1 ZINC000823643800 606339723 /nfs/dbraw/zinc/33/97/23/606339723.db2.gz BKRHYGNJBPNYMZ-GHXNOFRVSA-N 0 0 368.740 3.653 20 5 FHBDRN O=[N+]([O-])c1c(-c2nn[nH]n2)ccnc1Oc1ccc2oc3ccccc3c2c1 ZINC000823629742 607161806 /nfs/dbraw/zinc/16/18/06/607161806.db2.gz GFBCYGQURONPRZ-UHFFFAOYSA-N 0 0 374.316 3.862 20 5 FHBDRN O=[N+]([O-])c1cc(-c2ccccc2)ccc1Oc1cccc(-c2nn[nH]n2)n1 ZINC000826497893 607897809 /nfs/dbraw/zinc/89/78/09/607897809.db2.gz XZRZGEBKLFNNJZ-UHFFFAOYSA-N 0 0 360.333 3.629 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2ccc(CNc3cccc(-c4nn[nH]n4)c3)o2)c1 ZINC000826499751 609475597 /nfs/dbraw/zinc/47/55/97/609475597.db2.gz VPTNSQHWEXZSRI-UHFFFAOYSA-N 0 0 362.349 3.647 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)cnc1N1CCO[C@H](c2ccc(Cl)cc2)C1 ZINC000153606640 936313813 /nfs/dbraw/zinc/31/38/13/936313813.db2.gz KRDOAQHTKSGUON-AWEZNQCLSA-N 0 0 354.193 3.875 20 5 FHBDRN CC(C)(C(=O)N[C@@H]1CCOc2ccc(F)cc21)c1ccccc1[N+](=O)[O-] ZINC000582970858 936335351 /nfs/dbraw/zinc/33/53/51/936335351.db2.gz QAFUACFOFWJHAZ-OAHLLOKOSA-N 0 0 358.369 3.652 20 5 FHBDRN COCc1ccc([C@@H]2CCCN2C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)o1 ZINC000162051405 936341363 /nfs/dbraw/zinc/34/13/63/936341363.db2.gz ZYSHJZBQBRYUBI-AWEZNQCLSA-N 0 0 364.785 3.965 20 5 FHBDRN COc1ccc(CSCc2nc([C@H]3CCCS3)no2)cc1[N+](=O)[O-] ZINC000612948873 936348564 /nfs/dbraw/zinc/34/85/64/936348564.db2.gz ANEVVDJRPZBPSM-CYBMUJFWSA-N 0 0 367.452 3.988 20 5 FHBDRN O=[N+]([O-])c1ccc(N[C@H]2CCc3ccccc3C2)c(F)c1N1CCOCC1 ZINC000582990372 936351855 /nfs/dbraw/zinc/35/18/55/936351855.db2.gz GOAFMKMNSRXQPB-INIZCTEOSA-N 0 0 371.412 3.540 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](c1ccco1)c1ccccc1 ZINC000061442683 936353147 /nfs/dbraw/zinc/35/31/47/936353147.db2.gz IHGAKBQIMUFTLS-SFHVURJKSA-N 0 0 352.346 3.716 20 5 FHBDRN CCOc1ccc(C(=O)Nc2cccc(C(F)(F)F)n2)cc1[N+](=O)[O-] ZINC000161483564 936357166 /nfs/dbraw/zinc/35/71/66/936357166.db2.gz QLMLVIILFCYQLI-UHFFFAOYSA-N 0 0 355.272 3.660 20 5 FHBDRN Nc1nc(CSCc2ccc([N+](=O)[O-])cc2)nc(Nc2ccccc2)n1 ZINC000061455492 936360505 /nfs/dbraw/zinc/36/05/05/936360505.db2.gz MZHHSQCAUZFXQR-UHFFFAOYSA-N 0 0 368.422 3.539 20 5 FHBDRN CC(C)CC(=O)Nc1ccc(C(=O)COc2ccc([N+](=O)[O-])cc2)cc1 ZINC000005107363 936368194 /nfs/dbraw/zinc/36/81/94/936368194.db2.gz MFGDWBZBBAQBHR-UHFFFAOYSA-N 0 0 356.378 3.841 20 5 FHBDRN Cc1cc(C)c(NS(=O)(=O)CCc2ccccc2[N+](=O)[O-])c(Cl)c1 ZINC000613112154 936377051 /nfs/dbraw/zinc/37/70/51/936377051.db2.gz UCBGCKXHSRIJGZ-UHFFFAOYSA-N 0 0 368.842 3.849 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1Cl)N[C@@H]1CCCc2ccccc21 ZINC000005118531 936377149 /nfs/dbraw/zinc/37/71/49/936377149.db2.gz NFGWNBMSYQUFAW-MRXNPFEDSA-N 0 0 360.797 3.821 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1Cl)NCc1cccc(Cl)c1 ZINC000005118527 936377283 /nfs/dbraw/zinc/37/72/83/936377283.db2.gz RFVGLLXNAWSFMP-UHFFFAOYSA-N 0 0 355.177 3.597 20 5 FHBDRN COCc1cncc(C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)c1 ZINC000613170278 936381293 /nfs/dbraw/zinc/38/12/93/936381293.db2.gz LKCAXZOXHPREIX-UHFFFAOYSA-N 0 0 370.390 3.512 20 5 FHBDRN Cc1cc(F)cc(C(=O)NCCOc2cccc(Cl)c2)c1[N+](=O)[O-] ZINC000176761297 936385912 /nfs/dbraw/zinc/38/59/12/936385912.db2.gz CKLNDAZIQWKPPM-UHFFFAOYSA-N 0 0 352.749 3.505 20 5 FHBDRN CCCC[C@H]1CCC[C@@H]1NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000110726049 945064905 /nfs/dbraw/zinc/06/49/05/945064905.db2.gz MIFSVCTXOWUVDE-YOEHRIQHSA-N 0 0 356.426 3.869 20 5 FHBDRN CCCC[C@@H]1CCC[C@@H]1NC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000110715622 945065217 /nfs/dbraw/zinc/06/52/17/945065217.db2.gz KRLNPCYKTICOMV-ZBFHGGJFSA-N 0 0 356.426 3.869 20 5 FHBDRN CCCC[C@H]1CCC[C@@H]1NC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000110719700 945065989 /nfs/dbraw/zinc/06/59/89/945065989.db2.gz OCZQVBMYVTUHFN-YOEHRIQHSA-N 0 0 356.426 3.869 20 5 FHBDRN C[C@@H](C(=O)Nc1nc(C(F)(F)F)cs1)c1ccc([N+](=O)[O-])cc1F ZINC000541607171 945067234 /nfs/dbraw/zinc/06/72/34/945067234.db2.gz BJGYNUMHLACRPR-ZCFIWIBFSA-N 0 0 363.292 3.951 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H]1CCC[C@H](SC)C1 ZINC000439903739 945068463 /nfs/dbraw/zinc/06/84/63/945068463.db2.gz QTVTWKDNJJADKW-AAEUAGOBSA-N 0 0 353.444 3.789 20 5 FHBDRN CCCC[C@H]1CCC[C@H]1NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000110726056 945069220 /nfs/dbraw/zinc/06/92/20/945069220.db2.gz MIFSVCTXOWUVDE-WMLDXEAASA-N 0 0 356.426 3.869 20 5 FHBDRN COCC1(CCNc2ccc([N+](=O)[O-])c(OCc3ccccc3)n2)CCC1 ZINC000514801233 937085389 /nfs/dbraw/zinc/08/53/89/937085389.db2.gz OGJKGVSFGDYIPJ-UHFFFAOYSA-N 0 0 371.437 3.609 20 5 FHBDRN C[C@H](NC(=O)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1)c1cccc(O)c1 ZINC000458373612 937085540 /nfs/dbraw/zinc/08/55/40/937085540.db2.gz CAFHQYMIOXEPEV-YOEHRIQHSA-N 0 0 369.421 3.951 20 5 FHBDRN COc1ccc(-c2ccc(CN(C)[C@H](C)c3nc(C)no3)o2)c([N+](=O)[O-])c1 ZINC000514871786 937103169 /nfs/dbraw/zinc/10/31/69/937103169.db2.gz DENOGOQOMNTXLN-LLVKDONJSA-N 0 0 372.381 3.748 20 5 FHBDRN C[C@@H](NC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1)[C@@H]1Oc2ccccc2[C@H]1C ZINC000516616405 945069465 /nfs/dbraw/zinc/06/94/65/945069465.db2.gz VZBJREDWLXDEPP-FGBSKUFISA-N 0 0 354.406 3.768 20 5 FHBDRN CCc1cnc(CCNC(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)s1 ZINC000176375181 937113816 /nfs/dbraw/zinc/11/38/16/937113816.db2.gz WNNUGNGCODPDSO-GFCCVEGCSA-N 0 0 362.455 3.525 20 5 FHBDRN COC(=O)c1cc(NC(=O)[C@@H]2C[C@H]2c2ccccc2Cl)cc([N+](=O)[O-])c1 ZINC000583108979 937126978 /nfs/dbraw/zinc/12/69/78/937126978.db2.gz HAEURNCUUYJKLJ-LSDHHAIUSA-N 0 0 374.780 3.777 20 5 FHBDRN COc1ccc(C)cc1[C@H](C)NCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000161540111 937127237 /nfs/dbraw/zinc/12/72/37/937127237.db2.gz LQNXVZDOMSWZCN-ZDUSSCGKSA-N 0 0 368.393 3.813 20 5 FHBDRN COCc1ccccc1NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000044548988 927061828 /nfs/dbraw/zinc/06/18/28/927061828.db2.gz CHHMVUIMBKKKGD-UHFFFAOYSA-N 0 0 369.421 3.984 20 5 FHBDRN CO[C@](C)([C@@H](C)NC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1)C1CC1 ZINC000579684960 927077924 /nfs/dbraw/zinc/07/79/24/927077924.db2.gz VNZAYFOXCKZUPW-MCMMXHMISA-N 0 0 364.445 3.615 20 5 FHBDRN Cc1c(NC(=O)[C@H](C)N(C)Cc2nc3ccccc3o2)cccc1[N+](=O)[O-] ZINC000153852132 927083048 /nfs/dbraw/zinc/08/30/48/927083048.db2.gz AWZFMXVYEFLLAC-ZDUSSCGKSA-N 0 0 368.393 3.503 20 5 FHBDRN COc1cc(C(=O)Nc2cccc([C@H](C)OC)c2)cc([N+](=O)[O-])c1OC ZINC000610174079 927119623 /nfs/dbraw/zinc/11/96/23/927119623.db2.gz HLVXDCUBMVKCBW-NSHDSACASA-N 0 0 360.366 3.572 20 5 FHBDRN C[C@H](c1ccccc1)[C@](C)(O)C(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000176411431 937136603 /nfs/dbraw/zinc/13/66/03/937136603.db2.gz QJLXPGLRDIQMSI-IERDGZPVSA-N 0 0 370.449 3.588 20 5 FHBDRN Cc1cc(C)c(NC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)c(C)c1 ZINC000070731898 927127599 /nfs/dbraw/zinc/12/75/99/927127599.db2.gz KVFPPVHFNSUOGB-UHFFFAOYSA-N 0 0 350.378 3.958 20 5 FHBDRN Cc1ccc(C(=O)Nc2cccc(OC[C@H]3CCCO3)c2)cc1[N+](=O)[O-] ZINC000247972127 937136966 /nfs/dbraw/zinc/13/69/66/937136966.db2.gz ATHZKJAJHYCHJG-QGZVFWFLSA-N 0 0 356.378 3.713 20 5 FHBDRN Cc1nc(NC(=O)c2c(Cl)nccc2C(F)(F)F)ccc1[N+](=O)[O-] ZINC000133624311 927155004 /nfs/dbraw/zinc/15/50/04/927155004.db2.gz TYQOPMPDNOCNNY-UHFFFAOYSA-N 0 0 360.679 3.618 20 5 FHBDRN Cc1cc(OCC(=O)Nc2cccc(OC(F)(F)F)c2)ccc1[N+](=O)[O-] ZINC000430141574 927161849 /nfs/dbraw/zinc/16/18/49/927161849.db2.gz YAXBJZZRABSENM-UHFFFAOYSA-N 0 0 370.283 3.819 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N1CC[C@@H](c2cccc(C)c2)C1 ZINC000471105888 927173589 /nfs/dbraw/zinc/17/35/89/927173589.db2.gz YUOLKKADNMBRHB-MRXNPFEDSA-N 0 0 354.406 3.932 20 5 FHBDRN CCO[C@@H]1C[C@H](N(C)c2nc3ccc([N+](=O)[O-])cc3c(=O)[nH]2)C1(CC)CC ZINC000557603418 927180849 /nfs/dbraw/zinc/18/08/49/927180849.db2.gz AJCQYZZAAPSLHW-JKSUJKDBSA-N 0 0 374.441 3.664 20 5 FHBDRN CN(C[C@@H]1CCCC[C@H]1O)C(=O)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000278088533 937142233 /nfs/dbraw/zinc/14/22/33/937142233.db2.gz PXMYZIRQRHOFOD-IFXJQAMLSA-N 0 0 364.445 3.717 20 5 FHBDRN NC(=O)c1cccc(NCc2cc(Cl)ccc2OC(F)F)c1[N+](=O)[O-] ZINC000557629972 927230706 /nfs/dbraw/zinc/23/07/06/927230706.db2.gz DOJGWOTUGNCWFG-UHFFFAOYSA-N 0 0 371.727 3.561 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2noc(CCc3nnc(C4CCCC4)o3)n2)s1 ZINC000278088038 937145431 /nfs/dbraw/zinc/14/54/31/937145431.db2.gz GZQKPDALTBJPRW-UHFFFAOYSA-N 0 0 361.383 3.532 20 5 FHBDRN O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N(CCc1ccccc1)[C@@H]1CCOC1 ZINC000175276915 927243878 /nfs/dbraw/zinc/24/38/78/927243878.db2.gz UQAKHNPSGYMYSY-QGZVFWFLSA-N 0 0 374.824 3.722 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N(Cc1ccccc1)[C@H](CO)C(C)C ZINC000175280514 927255150 /nfs/dbraw/zinc/25/51/50/927255150.db2.gz GKEKGSRJFMZSMS-LJQANCHMSA-N 0 0 371.437 3.954 20 5 FHBDRN C[C@H](C1CC1)n1cc(N[C@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)cn1 ZINC000579743913 927263150 /nfs/dbraw/zinc/26/31/50/927263150.db2.gz OHMMDGKUCCYZFN-ACJLOTCBSA-N 0 0 366.425 3.697 20 5 FHBDRN O=C(NC[C@H]1CCCO[C@@H]1c1ccccc1)c1ccc([N+](=O)[O-])cc1F ZINC000145926643 937148056 /nfs/dbraw/zinc/14/80/56/937148056.db2.gz YHIJBYZVANNJCD-RDTXWAMCSA-N 0 0 358.369 3.632 20 5 FHBDRN Cc1c(CC(=O)N[C@H](C)c2cccc(-n3cccn3)c2)cccc1[N+](=O)[O-] ZINC000126839986 927294028 /nfs/dbraw/zinc/29/40/28/927294028.db2.gz RUVPWJDRJBUFOT-OAHLLOKOSA-N 0 0 364.405 3.509 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)Nc1ncc(C2(O)CCCCC2)s1 ZINC000274652232 927347776 /nfs/dbraw/zinc/34/77/76/927347776.db2.gz CHMRYOMSDKDFDN-UHFFFAOYSA-N 0 0 361.423 3.764 20 5 FHBDRN O=C(c1ccnc(-c2ccccc2)c1[N+](=O)[O-])N(CC1CC1)CC1CC1 ZINC000598444983 927354829 /nfs/dbraw/zinc/35/48/29/927354829.db2.gz OBJJXNFIROZFNN-UHFFFAOYSA-N 0 0 351.406 3.919 20 5 FHBDRN Cn1ccnc1[C@H](NCCc1ccc(F)cc1F)c1cccc([N+](=O)[O-])c1 ZINC000577638441 927366063 /nfs/dbraw/zinc/36/60/63/927366063.db2.gz RKAPAGQOEFXVSS-GOSISDBHSA-N 0 0 372.375 3.528 20 5 FHBDRN O=C(OCc1ccc(Cl)nc1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000023373495 927370361 /nfs/dbraw/zinc/37/03/61/927370361.db2.gz HWZCQALQQQAGMY-UHFFFAOYSA-N 0 0 361.785 3.600 20 5 FHBDRN COc1ccc(C(=O)Nc2nc(-c3ccc(C)c([N+](=O)[O-])c3)cs2)cn1 ZINC000247992783 937157875 /nfs/dbraw/zinc/15/78/75/937157875.db2.gz NMHXDTKKMSXYIN-UHFFFAOYSA-N 0 0 370.390 3.683 20 5 FHBDRN Cc1ccc(OCCNC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)cc1 ZINC000022639118 927395261 /nfs/dbraw/zinc/39/52/61/927395261.db2.gz UOPLBNNCBAIMLY-AWEZNQCLSA-N 0 0 360.435 3.579 20 5 FHBDRN COC(=O)c1cc(NC(=O)[C@H](C)c2cc3ccccc3o2)cc([N+](=O)[O-])c1 ZINC000176428390 937160922 /nfs/dbraw/zinc/16/09/22/937160922.db2.gz CGAGSWVRQNZYBG-LLVKDONJSA-N 0 0 368.345 3.870 20 5 FHBDRN Cc1cccc(NC(=O)CN(C)C(=O)Nc2ccc([N+](=O)[O-])cc2C)c1C ZINC000162553178 937162563 /nfs/dbraw/zinc/16/25/63/937162563.db2.gz FXHLRGACCXMRIE-UHFFFAOYSA-N 0 0 370.409 3.622 20 5 FHBDRN C[C@@H](c1ccc(Cl)cc1Cl)N(C)C(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC000186885975 927445118 /nfs/dbraw/zinc/44/51/18/927445118.db2.gz TWJDNXSMYHWAQP-QMMMGPOBSA-N 0 0 370.192 3.835 20 5 FHBDRN CN(C(=O)Cc1ccc(F)cc1Br)c1cccc([N+](=O)[O-])c1 ZINC000186886897 927460358 /nfs/dbraw/zinc/46/03/58/927460358.db2.gz FZTCVLUZRRXPAM-UHFFFAOYSA-N 0 0 367.174 3.702 20 5 FHBDRN CN(Cc1ccc(C(N)=O)cc1[N+](=O)[O-])C1c2ccccc2-c2ccccc21 ZINC000176435031 937166547 /nfs/dbraw/zinc/16/65/47/937166547.db2.gz RLKJQQBFHXNUPY-UHFFFAOYSA-N 0 0 373.412 3.896 20 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C[C@H]1CCCN(c2ccc(C(=O)NCCc3ccsc3)cc2[N+](=O)[O-])C1 ZINC000510115249 928450942 /nfs/dbraw/zinc/45/09/42/928450942.db2.gz YQGOXRQPHZVYSJ-AWEZNQCLSA-N 0 0 373.478 3.865 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1CN(C)[C@H](C)c1ccc([S@@](C)=O)cc1 ZINC000430244341 928461130 /nfs/dbraw/zinc/46/11/30/928461130.db2.gz PCZVCZCFKBJECQ-YMXBGEKHSA-N 0 0 362.451 3.534 20 5 FHBDRN Cc1ccc(S(=O)(=O)N(C)[C@@H](C)c2ccc(F)c(F)c2)cc1[N+](=O)[O-] ZINC000023440472 928463175 /nfs/dbraw/zinc/46/31/75/928463175.db2.gz ZPGLNHAKKOOAFQ-NSHDSACASA-N 0 0 370.377 3.563 20 5 FHBDRN C[C@@H]1CCCN(c2ccc(C(=O)OCc3cscn3)cc2[N+](=O)[O-])C1 ZINC000748078208 928467780 /nfs/dbraw/zinc/46/77/80/928467780.db2.gz GGQIUMAJBJYROR-GFCCVEGCSA-N 0 0 361.423 3.645 20 5 FHBDRN CCCOc1cc(NC(=O)Cc2ccoc2)c([N+](=O)[O-])cc1OCCC ZINC000120463492 928519492 /nfs/dbraw/zinc/51/94/92/928519492.db2.gz LDLNOOXARAVSBL-UHFFFAOYSA-N 0 0 362.382 3.947 20 5 FHBDRN COc1ccccc1[C@H](NC(=O)c1csc([N+](=O)[O-])c1)c1ccco1 ZINC000178823867 937252892 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FHBDRN C/C=C(/C)C(=O)N(CCOC)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 ZINC000254993707 928756489 /nfs/dbraw/zinc/75/64/89/928756489.db2.gz LKUXYTZYGYTHGU-QCDXTXTGSA-N 0 0 361.423 3.664 20 5 FHBDRN C[C@@H]1C[C@H]1c1ccc(CNC(=O)N(C)CCc2ccccc2[N+](=O)[O-])o1 ZINC000578215741 928788338 /nfs/dbraw/zinc/78/83/38/928788338.db2.gz IJLVWQANAXAHGW-CZUORRHYSA-N 0 0 357.410 3.695 20 5 FHBDRN O=C(N[C@@H]1c2ccccc2C[C@@H]1O)c1cc2ccccc2c2cccnc12 ZINC000179599107 928851269 /nfs/dbraw/zinc/85/12/69/928851269.db2.gz VBUAZXQGEWEKER-RBBKRZOGSA-N 0 0 354.409 3.776 20 5 FHBDRN CSCc1cccc(NC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)c1 ZINC000109234102 928883970 /nfs/dbraw/zinc/88/39/70/928883970.db2.gz ISRGIMQVJGBKST-UHFFFAOYSA-N 0 0 368.418 3.896 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H](OC)c1ccccc1 ZINC000134440043 928897732 /nfs/dbraw/zinc/89/77/32/928897732.db2.gz JENZQJHPFHVBFO-MRXNPFEDSA-N 0 0 360.435 3.824 20 5 FHBDRN O=C(NCC[C@H]1CCCCO1)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000278162686 937284651 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FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](C)c2cnn(CC3CCC3)c2)c1 ZINC000890676936 929230833 /nfs/dbraw/zinc/23/08/33/929230833.db2.gz JMMGQPGFIXKAOA-LBPRGKRZSA-N 0 0 374.466 3.804 20 5 FHBDRN C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1Cl)c1cnn(CC2CCC2)c1 ZINC000890677281 929231418 /nfs/dbraw/zinc/23/14/18/929231418.db2.gz NBKSIZGFXQYMSQ-LLVKDONJSA-N 0 0 362.817 3.736 20 5 FHBDRN CC1(C)CN(c2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000609586325 929245279 /nfs/dbraw/zinc/24/52/79/929245279.db2.gz NADBTRJMBLYAHQ-KRWDZBQOSA-N 0 0 360.435 3.586 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)F)cc1N1CCO[C@@H](c2cccs2)C1 ZINC000278182711 937315567 /nfs/dbraw/zinc/31/55/67/937315567.db2.gz DFNJSCVDWYMYPH-LLVKDONJSA-N 0 0 359.329 3.648 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(OC(F)(F)F)cc2)c1 ZINC000060063691 929267225 /nfs/dbraw/zinc/26/72/25/929267225.db2.gz FQHDOXIMPSLGEM-UHFFFAOYSA-N 0 0 356.256 3.754 20 5 FHBDRN Cc1ccc(C(=O)Nc2ccc3[nH]c([C@@H]4CCCO4)nc3c2)cc1[N+](=O)[O-] ZINC000060062794 929267834 /nfs/dbraw/zinc/26/78/34/929267834.db2.gz ILYWUERSSRHOIZ-KRWDZBQOSA-N 0 0 366.377 3.883 20 5 FHBDRN CCS[C@H]1CCCC[C@H]1NC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000134831613 929313577 /nfs/dbraw/zinc/31/35/77/929313577.db2.gz NZNNFUHYWYTDEI-DYVFJYSZSA-N 0 0 374.466 3.575 20 5 FHBDRN CCOc1cccc(CCNC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000178850563 937322315 /nfs/dbraw/zinc/32/23/15/937322315.db2.gz CKCYOTNTQCRUHE-CQSZACIVSA-N 0 0 357.410 3.596 20 5 FHBDRN Cc1nc([C@H]2CCCN2c2ccc(C(=O)NC(C)C)cc2[N+](=O)[O-])cs1 ZINC000275060157 929377824 /nfs/dbraw/zinc/37/78/24/929377824.db2.gz VXADLRXXXKFFPF-OAHLLOKOSA-N 0 0 374.466 3.839 20 5 FHBDRN Cc1cnn(Cc2ccccc2F)c1NC(=O)c1ccc([N+](=O)[O-])cc1F ZINC000187188868 929389831 /nfs/dbraw/zinc/38/98/31/929389831.db2.gz XIBBENSTGWPLGG-UHFFFAOYSA-N 0 0 372.331 3.679 20 5 FHBDRN O=C(c1cc(F)c([N+](=O)[O-])cc1F)N1CCS[C@H](c2ccccc2)C1 ZINC000359864366 929407113 /nfs/dbraw/zinc/40/71/13/929407113.db2.gz BCPXHLRLLMJTSG-INIZCTEOSA-N 0 0 364.373 3.803 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O=C(COc1cccc([N+](=O)[O-])c1)Nc1ccc(Oc2ccncc2)cc1 ZINC000050488644 931131099 /nfs/dbraw/zinc/13/10/99/931131099.db2.gz MTZMMASPCLXJHM-UHFFFAOYSA-N 0 0 365.345 3.800 20 5 FHBDRN CCc1c(NC(=O)Cc2ccc(OC)c([N+](=O)[O-])c2)cnn1CCC(C)C ZINC000580810242 931180070 /nfs/dbraw/zinc/18/00/70/931180070.db2.gz QVBQFONGQVSLBV-UHFFFAOYSA-N 0 0 374.441 3.590 20 5 FHBDRN O=Cc1ccc([N+](=O)[O-])c(OCc2ccc(Br)cc2F)c1 ZINC000050517465 931199964 /nfs/dbraw/zinc/19/99/64/931199964.db2.gz NHBCHMOIMNTJDD-UHFFFAOYSA-N 0 0 354.131 3.888 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1Cl)N1CCC([C@H](O)c2ccccc2)CC1 ZINC000247318685 931202544 /nfs/dbraw/zinc/20/25/44/931202544.db2.gz LFDKBUUFUPIZSW-GOSISDBHSA-N 0 0 374.824 3.834 20 5 FHBDRN COc1cccc(-c2cc(NC(=O)c3cc(C)cc([N+](=O)[O-])c3)n(C)n2)c1 ZINC000119337154 931216730 /nfs/dbraw/zinc/21/67/30/931216730.db2.gz VPEBFZHUPNMRQI-UHFFFAOYSA-N 0 0 366.377 3.565 20 5 FHBDRN Cc1ccc2c(c1)CN(C(=O)c1ccc(NC3CC3)c([N+](=O)[O-])c1)CCO2 ZINC000557638741 931243580 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3.788 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)c2ccc(OC(F)F)cc2)cc1[N+](=O)[O-] ZINC000177860608 931333545 /nfs/dbraw/zinc/33/35/45/931333545.db2.gz DDVCHWLZCGAFIT-LLVKDONJSA-N 0 0 350.321 3.996 20 5 FHBDRN CCCc1nc(C)c(NC(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)s1 ZINC000580916319 931340547 /nfs/dbraw/zinc/34/05/47/931340547.db2.gz QQKMAQLWYHINFN-UHFFFAOYSA-N 0 0 355.366 3.772 20 5 FHBDRN CCC1(CC)[C@H](OC)C[C@H]1N(C)c1ncnc2sc([N+](=O)[O-])cc21 ZINC000561261585 931370596 /nfs/dbraw/zinc/37/05/96/931370596.db2.gz XLDJBMNOGMBBCB-VXGBXAGGSA-N 0 0 350.444 3.629 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])cc1[N+](=O)[O-] ZINC000177858803 931371283 /nfs/dbraw/zinc/37/12/83/931371283.db2.gz BJPPZGOLPBKDQU-SNVBAGLBSA-N 0 0 363.757 3.956 20 5 FHBDRN C[C@H]1CN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C[C@@H](C(F)(F)F)O1 ZINC000610468677 931376479 /nfs/dbraw/zinc/37/64/79/931376479.db2.gz BDBGWDGGXYCJCC-CPCISQLKSA-N 0 0 358.238 3.770 20 5 FHBDRN COc1ccc(C(=O)CCC(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000177866049 931389894 /nfs/dbraw/zinc/38/98/94/931389894.db2.gz OANFCXKDWOYHKY-AWEZNQCLSA-N 0 0 370.405 3.752 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)c2ccccc2OC(F)F)cc1[N+](=O)[O-] ZINC000177866474 931389963 /nfs/dbraw/zinc/38/99/63/931389963.db2.gz XJBJMRZXDWABDR-NSHDSACASA-N 0 0 350.321 3.996 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)c2cnn(Cc3ccccc3)c2)cc1[N+](=O)[O-] ZINC000177870851 931394560 /nfs/dbraw/zinc/39/45/60/931394560.db2.gz SAXKLCLCDNBVFG-OAHLLOKOSA-N 0 0 364.405 3.639 20 5 FHBDRN CCO[C@H]1C[C@@H](NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C12CCC2 ZINC000610185964 931406756 /nfs/dbraw/zinc/40/67/56/931406756.db2.gz XOIVEZLBVVGRSV-CVEARBPZSA-N 0 0 360.435 3.887 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)[C@@H](C)N2CCc3ccccc3C2)cc1[N+](=O)[O-] ZINC000177875716 931430974 /nfs/dbraw/zinc/43/09/74/931430974.db2.gz GKGJUHOISQKZEI-HZPDHXFCSA-N 0 0 367.449 3.527 20 5 FHBDRN Nc1c(C(=O)Nc2cc(Cl)c(O)c3ccccc23)cccc1[N+](=O)[O-] ZINC001167440933 931433030 /nfs/dbraw/zinc/43/30/30/931433030.db2.gz YAPWUWRVIXCHMS-UHFFFAOYSA-N 0 0 357.753 3.942 20 5 FHBDRN CCS[C@@H]1CCC[C@H](NC(=O)N(C)Cc2ccccc2[N+](=O)[O-])C1 ZINC000175874941 931433973 /nfs/dbraw/zinc/43/39/73/931433973.db2.gz PAAGEVLWHVODBE-LSDHHAIUSA-N 0 0 351.472 3.801 20 5 FHBDRN CCN(CCOC)C(=O)c1cc([N+](=O)[O-])ccc1SCC1CCCC1 ZINC000581029877 931478172 /nfs/dbraw/zinc/47/81/72/931478172.db2.gz VMDDMXLXFJUCSR-UHFFFAOYSA-N 0 0 366.483 3.986 20 5 FHBDRN Cc1c(Br)c(NC[C@](C)(O)CCC(C)C)ncc1[N+](=O)[O-] ZINC000581038392 931513808 /nfs/dbraw/zinc/51/38/08/931513808.db2.gz HMDDDZFDNFMBAN-CQSZACIVSA-N 0 0 360.252 3.660 20 5 FHBDRN COc1cc(C(=O)N2CC[C@H](C)[C@H]3CCCC[C@H]32)c([N+](=O)[O-])cc1F ZINC000581057947 931531992 /nfs/dbraw/zinc/53/19/92/931531992.db2.gz ZVHDBMFGLLXKOL-YWPYICTPSA-N 0 0 350.390 3.783 20 5 FHBDRN CC(=O)c1cc(NC[C@]2(O)CCC[C@H](C(F)(F)F)C2)ccc1[N+](=O)[O-] ZINC000561310356 931540746 /nfs/dbraw/zinc/54/07/46/931540746.db2.gz GQSHIKUFGYLMLR-NHYWBVRUSA-N 0 0 360.332 3.693 20 5 FHBDRN Cn1cnc([N+](=O)[O-])c1CSCCOc1ccc(Cl)cc1Cl ZINC000477008286 931549785 /nfs/dbraw/zinc/54/97/85/931549785.db2.gz AGRJSEWBQIIBHL-UHFFFAOYSA-N 0 0 362.238 3.947 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N1CC[C@H](c2cccc(F)c2)C1 ZINC000581093388 931551581 /nfs/dbraw/zinc/55/15/81/931551581.db2.gz FUDGAFAOFDCSAW-AWEZNQCLSA-N 0 0 362.788 3.946 20 5 FHBDRN O=[N+]([O-])c1ncccc1N1CCO[C@H](c2cccc(C(F)(F)F)c2)C1 ZINC000610480090 931579774 /nfs/dbraw/zinc/57/97/74/931579774.db2.gz JIOZKYISFRIMME-AWEZNQCLSA-N 0 0 353.300 3.587 20 5 FHBDRN Cn1cnc([N+](=O)[O-])c1CSc1ncnc2sc3c(c21)CCCC3 ZINC000610479983 931580418 /nfs/dbraw/zinc/58/04/18/931580418.db2.gz YRGLQCDJDBZEHA-UHFFFAOYSA-N 0 0 361.452 3.504 20 5 FHBDRN Cc1cc(NC(=O)NCc2cc(COC(C)(C)C)on2)ccc1[N+](=O)[O-] ZINC000187381533 931588095 /nfs/dbraw/zinc/58/80/95/931588095.db2.gz RMXFJJKGYAZKFI-UHFFFAOYSA-N 0 0 362.386 3.528 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)c(N2CCCN(CC(F)F)CC2)c(Cl)c1 ZINC000302456262 931591366 /nfs/dbraw/zinc/59/13/66/931591366.db2.gz UOCRTXDTTZFMMY-UHFFFAOYSA-N 0 0 354.184 3.679 20 5 FHBDRN CC(C)C[C@@H]1OCCC[C@@H]1NC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000187384203 931594655 /nfs/dbraw/zinc/59/46/55/931594655.db2.gz UHIMMMKZFJGFDX-ZFWWWQNUSA-N 0 0 372.368 3.520 20 5 FHBDRN O=C(NCCc1c[nH]c2cc(F)ccc12)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000050766726 931608994 /nfs/dbraw/zinc/60/89/94/931608994.db2.gz SRWDRURZYZNQKG-UHFFFAOYSA-N 0 0 366.352 3.669 20 5 FHBDRN C[C@]1(NC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)CCO[C@H]1C1CC1 ZINC000276049923 931679307 /nfs/dbraw/zinc/67/93/07/931679307.db2.gz YTTJXMDSZYWCFV-UNMCSNQZSA-N 0 0 362.429 3.781 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])N1CCCCC[C@@H]1[C@H]1CCCCC1=O ZINC000126259355 931685298 /nfs/dbraw/zinc/68/52/98/931685298.db2.gz NLCADPSAAIZILI-NVXWUHKLSA-N 0 0 373.453 3.537 20 5 FHBDRN CN(C[C@H]1CCCC[C@@H]1O)C(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000276054304 931687764 /nfs/dbraw/zinc/68/77/64/931687764.db2.gz ZFXLCZKQTZMGAS-QRWLVFNGSA-N 0 0 364.445 3.717 20 5 FHBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N2C[C@H](c3ccccc3)[C@H]3CCC[C@H]32)c1 ZINC000510370444 931717420 /nfs/dbraw/zinc/71/74/20/931717420.db2.gz ZHMBDXWVQGXXLT-GUDVDZBRSA-N 0 0 372.446 3.552 20 5 FHBDRN Cc1cc2ccccc2n1CC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000430542346 931736686 /nfs/dbraw/zinc/73/66/86/931736686.db2.gz WCQHMIXDLUKBAP-UHFFFAOYSA-N 0 0 351.406 3.909 20 5 FHBDRN COc1ccc(-n2c(C)nnc2SCCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000477045801 931742394 /nfs/dbraw/zinc/74/23/94/931742394.db2.gz UBHIERYFKHRJGW-UHFFFAOYSA-N 0 0 370.434 3.827 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H](C)COc1c(C)cccc1C ZINC000510374796 931768096 /nfs/dbraw/zinc/76/80/96/931768096.db2.gz IMVZJYNGKIGFNJ-CQSZACIVSA-N 0 0 373.409 3.809 20 5 FHBDRN Cc1ccccc1[C@@H]1CCN(C(=O)COc2ccc([N+](=O)[O-])c(C)c2)C1 ZINC000430547353 931780987 /nfs/dbraw/zinc/78/09/87/931780987.db2.gz KTRZOBSOXOZIDT-MRXNPFEDSA-N 0 0 354.406 3.607 20 5 FHBDRN CC(C)(NC(=O)CCCOCc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000430549282 931787473 /nfs/dbraw/zinc/78/74/73/931787473.db2.gz NHMYGPJGQNRJLW-UHFFFAOYSA-N 0 0 356.422 3.943 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1C(F)(F)F)N1CC[C@@H](c2cccnc2)C1 ZINC000581312210 931815155 /nfs/dbraw/zinc/81/51/55/931815155.db2.gz MYYOWHDPMLTMBQ-GFCCVEGCSA-N 0 0 365.311 3.638 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@H](c2ccccc2)C1 ZINC000134428431 931820034 /nfs/dbraw/zinc/82/00/34/931820034.db2.gz JTAVCMQAXZVPGF-KRWDZBQOSA-N 0 0 372.446 3.921 20 5 FHBDRN Cc1cc(OCC(=O)NCC(C)(C)c2ccccc2F)ccc1[N+](=O)[O-] ZINC000430555760 931821755 /nfs/dbraw/zinc/82/17/55/931821755.db2.gz PNAXIABVWFDFEM-UHFFFAOYSA-N 0 0 360.385 3.515 20 5 FHBDRN Cc1ccc(NC(=O)c2ccc(N[C@H](C)[C@H](C)CO)c([N+](=O)[O-])c2)cc1 ZINC000077227488 931831900 /nfs/dbraw/zinc/83/19/00/931831900.db2.gz QJJODJRIUZKITK-ZIAGYGMSSA-N 0 0 357.410 3.584 20 5 FHBDRN Cc1cc(OCC(=O)NCc2ccccc2COC(C)C)ccc1[N+](=O)[O-] ZINC000077222657 931832488 /nfs/dbraw/zinc/83/24/88/931832488.db2.gz UUNWEPUPZBEVIC-UHFFFAOYSA-N 0 0 372.421 3.523 20 5 FHBDRN CC(C)(NC(=O)c1ccc(N2CCCC2)c(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000430558473 931838004 /nfs/dbraw/zinc/83/80/04/931838004.db2.gz YMQYOBOHVSACBS-UHFFFAOYSA-N 0 0 371.412 3.999 20 5 FHBDRN Cc1ccc(S(=O)(=O)N[C@@H]2CCc3sc(Cl)cc32)c([N+](=O)[O-])c1 ZINC000581337806 931854623 /nfs/dbraw/zinc/85/46/23/931854623.db2.gz ALIQXORLVYOENR-SNVBAGLBSA-N 0 0 372.855 3.584 20 5 FHBDRN Cc1cc(NC(=O)[C@@H]2CC23CCCCC3)n(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000477089596 931909929 /nfs/dbraw/zinc/90/99/29/931909929.db2.gz OCMSPYUGCXQCHM-INIZCTEOSA-N 0 0 354.410 3.998 20 5 FHBDRN Cc1cc(N(C)Cc2ccc(OCC(F)(F)F)cc2)ncc1[N+](=O)[O-] ZINC000561339195 931930839 /nfs/dbraw/zinc/93/08/39/931930839.db2.gz YUEKIISJXIPWML-UHFFFAOYSA-N 0 0 355.316 3.876 20 5 FHBDRN COc1ccc([C@@H]2CCN(C(=O)c3cccc(Cl)c3[N+](=O)[O-])C2)cc1 ZINC000175997869 931946092 /nfs/dbraw/zinc/94/60/92/931946092.db2.gz JABVBZYGFJCALL-CYBMUJFWSA-N 0 0 360.797 3.887 20 5 FHBDRN CCc1cnc(NC(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)s1 ZINC000510412271 931959837 /nfs/dbraw/zinc/95/98/37/931959837.db2.gz HUEJUORALCZNJQ-UHFFFAOYSA-N 0 0 370.228 3.937 20 5 FHBDRN C[C@@H]1C[C@@H]1c1ccc(CNc2cc(CN3CCOCC3)ccc2[N+](=O)[O-])o1 ZINC000581409686 931983626 /nfs/dbraw/zinc/98/36/26/931983626.db2.gz VMUYGTZRPOJMIU-PBHICJAKSA-N 0 0 371.437 3.756 20 5 FHBDRN Cc1ccc(NC(=O)COC(=O)c2ccc(Cl)cc2[N+](=O)[O-])c(C)c1 ZINC000003386760 931985799 /nfs/dbraw/zinc/98/57/99/931985799.db2.gz UVTSWWIOYZEVCB-UHFFFAOYSA-N 0 0 362.769 3.661 20 5 FHBDRN CC(C)c1ccc(C(=O)O[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000003387088 931985861 /nfs/dbraw/zinc/98/58/61/931985861.db2.gz IUYJMZPEMWMNLO-ZDUSSCGKSA-N 0 0 356.378 3.902 20 5 FHBDRN CN(C)c1cccc(CNC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000121323631 931995731 /nfs/dbraw/zinc/99/57/31/931995731.db2.gz SRKZNSLZMNLJQT-UHFFFAOYSA-N 0 0 368.437 3.535 20 5 FHBDRN COc1cc(C(=O)N2CCCCC[C@@H]2c2ccco2)c([N+](=O)[O-])cc1OC ZINC000135161566 932006014 /nfs/dbraw/zinc/00/60/14/932006014.db2.gz NIXSYONFLNDXDH-CQSZACIVSA-N 0 0 374.393 3.963 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)O[C@@H](C)c1ccc(C(F)(F)F)cc1 ZINC000728333258 932008180 /nfs/dbraw/zinc/00/81/80/932008180.db2.gz QWOAFYKZRFEWJP-JTQLQIEISA-N 0 0 371.315 3.813 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2nnc(CNC3(c4ccc(F)cc4)CCC3)o2)cc1 ZINC000610390348 932010277 /nfs/dbraw/zinc/01/02/77/932010277.db2.gz DBEKEWWXIFLFKK-UHFFFAOYSA-N 0 0 368.368 3.953 20 5 FHBDRN CC[C@@H]1CN(c2cc(C)c(C(F)(F)F)cc2[N+](=O)[O-])C[C@@]2(CCOC2)O1 ZINC000581417170 932014800 /nfs/dbraw/zinc/01/48/00/932014800.db2.gz GUDSILNPSPYBOT-MLGOLLRUSA-N 0 0 374.359 3.696 20 5 FHBDRN O=C1OC(c2c(Cl)cccc2[N+](=O)[O-])=N/C1=C/c1cccc([N+](=O)[O-])c1 ZINC000255298335 932016968 /nfs/dbraw/zinc/01/69/68/932016968.db2.gz CCTBKPGWZUUTMF-XYOKQWHBSA-N 0 0 373.708 3.501 20 5 FHBDRN COC(=O)c1cc(C(=O)N2CCCCC[C@H]2c2ccco2)cc([N+](=O)[O-])c1 ZINC000135166046 932019233 /nfs/dbraw/zinc/01/92/33/932019233.db2.gz VHGJCZIVHCCHST-INIZCTEOSA-N 0 0 372.377 3.732 20 5 FHBDRN CN(CCOc1ccccc1)Cn1c2cc([N+](=O)[O-])ccc2oc1=S ZINC000023840936 932030062 /nfs/dbraw/zinc/03/00/62/932030062.db2.gz VHBDJWXJPDWILW-UHFFFAOYSA-N 0 0 359.407 3.840 20 5 FHBDRN C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc(-c2ccc(-n3cccn3)nc2)no1 ZINC000558559199 932058366 /nfs/dbraw/zinc/05/83/66/932058366.db2.gz GVVANUGXJSXVSA-ACCUITESSA-N 0 0 374.360 3.786 20 5 FHBDRN COc1ccccc1Cc1nnc(SCc2ccccc2[N+](=O)[O-])o1 ZINC000066260351 932067084 /nfs/dbraw/zinc/06/70/84/932067084.db2.gz FCBAFHIRSKYRLH-UHFFFAOYSA-N 0 0 357.391 3.870 20 5 FHBDRN Cc1ccc(C)c(NC(=O)CN(Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000135226503 932076453 /nfs/dbraw/zinc/07/64/53/932076453.db2.gz LBLDPJNPTMGJPS-UHFFFAOYSA-N 0 0 353.422 3.815 20 5 FHBDRN CCS[C@@H](C)c1noc(CN(Cc2ccccc2[N+](=O)[O-])C2CC2)n1 ZINC000135228065 932076756 /nfs/dbraw/zinc/07/67/56/932076756.db2.gz PSVBABGYKYQQJO-LBPRGKRZSA-N 0 0 362.455 3.957 20 5 FHBDRN CCOc1cc(/C=C\C(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)ccc1O ZINC000588412231 932077321 /nfs/dbraw/zinc/07/73/21/932077321.db2.gz ASWBQKGAGLGYDB-VURMDHGXSA-N 0 0 356.378 3.968 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H](c2ccc(F)cc2)C[C@@H]1C ZINC000135242130 932078893 /nfs/dbraw/zinc/07/88/93/932078893.db2.gz UXAZMNBJHIXVPS-JSGCOSHPSA-N 0 0 358.369 3.761 20 5 FHBDRN COc1ccc(C)cc1NC(=O)CN(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000135234677 932086033 /nfs/dbraw/zinc/08/60/33/932086033.db2.gz XJWIRVXGCMOVAD-UHFFFAOYSA-N 0 0 369.421 3.515 20 5 FHBDRN O=C(NCCc1coc(-c2ccc(F)cc2)n1)c1ccc(F)cc1[N+](=O)[O-] ZINC000135257617 932116981 /nfs/dbraw/zinc/11/69/81/932116981.db2.gz WXAINGSKWSAIBH-UHFFFAOYSA-N 0 0 373.315 3.501 20 5 FHBDRN CCn1cc(CC(=O)OCC(=O)c2ccc([N+](=O)[O-])cc2)c2ccccc21 ZINC000728339928 932123079 /nfs/dbraw/zinc/12/30/79/932123079.db2.gz FLEMPWUOTNEUNQ-UHFFFAOYSA-N 0 0 366.373 3.538 20 5 FHBDRN COc1ccc(OC)c([C@@H]2C[C@H]2C(=O)N[C@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000276264401 932137592 /nfs/dbraw/zinc/13/75/92/932137592.db2.gz MORYYNAAJUHBRR-ISTRZQFTSA-N 0 0 370.405 3.593 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)Nc1ccnn1CCc1ccccc1 ZINC001125506283 932140576 /nfs/dbraw/zinc/14/05/76/932140576.db2.gz JCVAQCDQDMPXKA-UHFFFAOYSA-N 0 0 364.405 3.903 20 5 FHBDRN C[C@H](OC(=O)c1ccccc1F)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000003393194 932145498 /nfs/dbraw/zinc/14/54/98/932145498.db2.gz DNBXTNGHDHERFJ-VIFPVBQESA-N 0 0 366.732 3.571 20 5 FHBDRN Cc1nc(C)c(/C=C2/N=C(c3c(Cl)cccc3[N+](=O)[O-])OC2=O)s1 ZINC000255312287 932149358 /nfs/dbraw/zinc/14/93/58/932149358.db2.gz APMIVTXOBNFVIJ-UXBLZVDNSA-N 0 0 363.782 3.666 20 5 FHBDRN Cn1c2ccc(Cl)cc2nc1NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC001125508071 932151400 /nfs/dbraw/zinc/15/14/00/932151400.db2.gz REYCHDSIGNENRK-UONOGXRCSA-N 0 0 370.796 3.877 20 5 FHBDRN O=[N+]([O-])c1cc(CN2CCc3c(ncn3-c3ccc(F)cc3)C2)cs1 ZINC000510429855 932189318 /nfs/dbraw/zinc/18/93/18/932189318.db2.gz VQYSLNQNAPCMGT-UHFFFAOYSA-N 0 0 358.398 3.539 20 5 FHBDRN COC(=O)c1cc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)c(C)cc1C ZINC000471671933 932233325 /nfs/dbraw/zinc/23/33/25/932233325.db2.gz RBWNNMRHTMMWEK-UHFFFAOYSA-N 0 0 368.345 3.997 20 5 FHBDRN Cc1c(CN2CCN(C(=O)c3ccc(Cl)cc3)CC2)cccc1[N+](=O)[O-] ZINC000051091648 932279588 /nfs/dbraw/zinc/27/95/88/932279588.db2.gz MEGVQBXNCRBBQN-UHFFFAOYSA-N 0 0 373.840 3.515 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CCC(c3nccs3)CC2)c(Br)c1 ZINC000610512476 932284359 /nfs/dbraw/zinc/28/43/59/932284359.db2.gz HGSMKEKQCUOLSH-UHFFFAOYSA-N 0 0 369.244 3.593 20 5 FHBDRN O=C(N[C@@H]1COc2c1cccc2Cl)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000610712501 932286785 /nfs/dbraw/zinc/28/67/85/932286785.db2.gz MFWMHSRATKWABH-CYBMUJFWSA-N 0 0 357.753 3.593 20 5 FHBDRN Cc1sc(C(=O)Nc2cccc(Oc3cccnn3)c2)cc1[N+](=O)[O-] ZINC000175910909 932307381 /nfs/dbraw/zinc/30/73/81/932307381.db2.gz DIOFTGZLVFCYPW-UHFFFAOYSA-N 0 0 356.363 3.799 20 5 FHBDRN CCc1ccc(C(=O)N2CCO[C@](C)(c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000157319064 932326444 /nfs/dbraw/zinc/32/64/44/932326444.db2.gz PRQKTYMDKYGPDP-FQEVSTJZSA-N 0 0 354.406 3.545 20 5 FHBDRN CC(C)n1nc2c(c1NC(=O)Cc1c[nH]c3ccc([N+](=O)[O-])cc13)CCC2 ZINC000471676945 932338868 /nfs/dbraw/zinc/33/88/68/932338868.db2.gz FEDWYDJFYMZZRK-UHFFFAOYSA-N 0 0 367.409 3.523 20 5 FHBDRN CCc1cccc(CC(=O)Nc2cc(CC)nc3ccc([N+](=O)[O-])cc32)c1 ZINC001266777680 932365061 /nfs/dbraw/zinc/36/50/61/932365061.db2.gz ZUFPOFWQGYVWTF-UHFFFAOYSA-N 0 0 363.417 3.871 20 5 FHBDRN Cc1nc(C(C)(C)NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)sc1C ZINC000135268185 932376887 /nfs/dbraw/zinc/37/68/87/932376887.db2.gz RZDFYKJYDYEGFF-UHFFFAOYSA-N 0 0 372.450 3.743 20 5 FHBDRN Cc1c(NC(=O)N(C)[C@@H](C)C(C)(C)O)cc([N+](=O)[O-])cc1C(F)(F)F ZINC000933344945 932376930 /nfs/dbraw/zinc/37/69/30/932376930.db2.gz JJQRSCUONWEWLH-VIFPVBQESA-N 0 0 363.336 3.545 20 5 FHBDRN CCCc1n[nH]c(C(=O)N[C@H]2CCCc3sc(Cl)cc32)c1[N+](=O)[O-] ZINC000561513491 932389413 /nfs/dbraw/zinc/38/94/13/932389413.db2.gz ZDIMRHAKSBLLGX-VIFPVBQESA-N 0 0 368.846 3.793 20 5 FHBDRN CC(C)(C)OC(=O)N1CC=C(CNc2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC000302480886 932394821 /nfs/dbraw/zinc/39/48/21/932394821.db2.gz XOLBAOLDTKBSQR-UHFFFAOYSA-N 0 0 369.368 3.852 20 5 FHBDRN Cc1nn(C)cc1[C@@H]1CCCN1C(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000610729396 932408043 /nfs/dbraw/zinc/40/80/43/932408043.db2.gz LTBFUFYXYDVKQM-KRWDZBQOSA-N 0 0 370.453 3.912 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)NCCO[C@H]1CCCC[C@H]1C ZINC000477275346 932440095 /nfs/dbraw/zinc/44/00/95/932440095.db2.gz AWTHJKBTNMQWRF-ABAIWWIYSA-N 0 0 354.834 3.882 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)NCCO[C@@H]1CCCC[C@@H]1C ZINC000477275349 932445171 /nfs/dbraw/zinc/44/51/71/932445171.db2.gz AWTHJKBTNMQWRF-XHDPSFHLSA-N 0 0 354.834 3.882 20 5 FHBDRN COc1c(C(=O)O[C@@H](C)CCc2ccc3c(c2)OCO3)cccc1[N+](=O)[O-] ZINC000796660328 932456169 /nfs/dbraw/zinc/45/61/69/932456169.db2.gz QCBZGLHHLHLFIY-LBPRGKRZSA-N 0 0 373.361 3.510 20 5 FHBDRN CC[C@@H](C)n1ncc(NC(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])c1C1CC1 ZINC000477301792 932456818 /nfs/dbraw/zinc/45/68/18/932456818.db2.gz SOBLIIVSUAAXFM-SNVBAGLBSA-N 0 0 360.418 3.739 20 5 FHBDRN Cc1nn(CCC(=O)Nc2ccc(CC(F)(F)F)cc2)c(C)c1[N+](=O)[O-] ZINC000127246582 932464262 /nfs/dbraw/zinc/46/42/62/932464262.db2.gz NGSZTIJWKPDFLC-UHFFFAOYSA-N 0 0 370.331 3.542 20 5 FHBDRN C[C@H]1Sc2ccccc2N(C(=O)COc2ccccc2[N+](=O)[O-])[C@H]1C ZINC000430637682 932478230 /nfs/dbraw/zinc/47/82/30/932478230.db2.gz BODLEDRNXPTBJR-QWHCGFSZSA-N 0 0 358.419 3.890 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CCC=C(c2ccccc2)C1 ZINC000581681748 932485087 /nfs/dbraw/zinc/48/50/87/932485087.db2.gz GAGKXJQCTDNAQC-UHFFFAOYSA-N 0 0 351.406 3.631 20 5 FHBDRN O=C1OC(c2cccc([N+](=O)[O-])c2)=N/C1=C/c1ccc([N+](=O)[O-])cc1Cl ZINC000588425054 932495060 /nfs/dbraw/zinc/49/50/60/932495060.db2.gz NZBOSDZLNRVHJG-VGOFMYFVSA-N 0 0 373.708 3.501 20 5 FHBDRN C[C@@H](CNC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)c1ccncc1 ZINC000610526797 932496639 /nfs/dbraw/zinc/49/66/39/932496639.db2.gz XGJAOCHGTMKHLN-LBPRGKRZSA-N 0 0 368.418 3.647 20 5 FHBDRN CO[C@@H](c1ccc(Cl)cc1)[C@@H](C)NC(=O)c1ccc([N+](=O)[O-])cc1F ZINC000127258400 932503654 /nfs/dbraw/zinc/50/36/54/932503654.db2.gz LJRHAEFDQCECAL-QLJPJBMISA-N 0 0 366.776 3.893 20 5 FHBDRN CO[C@@H](c1ccc(Cl)cc1)[C@H](C)NC(=O)c1ccc([N+](=O)[O-])cc1F ZINC000127258158 932504039 /nfs/dbraw/zinc/50/40/39/932504039.db2.gz LJRHAEFDQCECAL-MGPLVRAMSA-N 0 0 366.776 3.893 20 5 FHBDRN COc1cc(OC)cc(-c2noc([C@@H](C)c3cccc([N+](=O)[O-])c3)n2)c1 ZINC000581692764 932511445 /nfs/dbraw/zinc/51/14/45/932511445.db2.gz PQYOVHIJUNTQAI-NSHDSACASA-N 0 0 355.350 3.814 20 5 FHBDRN COCCN(C(=O)NCCCCc1ccc([N+](=O)[O-])cc1)C1CCCC1 ZINC000610530205 932520887 /nfs/dbraw/zinc/52/08/87/932520887.db2.gz YCURQEPGSWINSC-UHFFFAOYSA-N 0 0 363.458 3.518 20 5 FHBDRN O=C(COc1ccccc1[N+](=O)[O-])N1CC=C(c2cccc(Cl)c2)CC1 ZINC000477379421 932522207 /nfs/dbraw/zinc/52/22/07/932522207.db2.gz XIANPYNVIQGVEN-UHFFFAOYSA-N 0 0 372.808 3.943 20 5 FHBDRN O=C(N[C@@H](c1cccc(Cl)c1)c1ccccn1)c1ccc([N+](=O)[O-])o1 ZINC000126799898 932559113 /nfs/dbraw/zinc/55/91/13/932559113.db2.gz PQPOGUZJUCENCB-INIZCTEOSA-N 0 0 357.753 3.756 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N1CCO[C@H](c2ccccc2)C1 ZINC000477419467 932574737 /nfs/dbraw/zinc/57/47/37/932574737.db2.gz MMXDZRFEFVMKBK-INIZCTEOSA-N 0 0 360.797 3.770 20 5 FHBDRN Cc1coc(-c2cccc(NS(=O)(=O)c3cc([N+](=O)[O-])ccc3C)c2)n1 ZINC000126803666 932576690 /nfs/dbraw/zinc/57/66/90/932576690.db2.gz DLFCTUVXLQHVHQ-UHFFFAOYSA-N 0 0 373.390 3.667 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N[C@H](C)CC(=O)c1ccccc1 ZINC000477432447 932576812 /nfs/dbraw/zinc/57/68/12/932576812.db2.gz VOYJVMMIDCJCDR-GFCCVEGCSA-N 0 0 360.797 3.948 20 5 FHBDRN Cc1sc(S(=O)(=O)N([C@H](C)c2ccccc2)C2CC2)cc1[N+](=O)[O-] ZINC000510458889 932581236 /nfs/dbraw/zinc/58/12/36/932581236.db2.gz RSZKIHQVYUWSEZ-LLVKDONJSA-N 0 0 366.464 3.879 20 5 FHBDRN Cc1cncc(NC(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 ZINC000430653860 932595797 /nfs/dbraw/zinc/59/57/97/932595797.db2.gz MKAZABYBGQOZHO-UHFFFAOYSA-N 0 0 368.315 3.758 20 5 FHBDRN Cc1ccc(NC(=O)Cc2ccc([N+](=O)[O-])cc2F)cc1Br ZINC000477477903 932641789 /nfs/dbraw/zinc/64/17/89/932641789.db2.gz QRUAGGGVGVZTHO-UHFFFAOYSA-N 0 0 367.174 3.986 20 5 FHBDRN O=C(Nc1c(-c2ccncc2)nc2ccccn21)c1cccc([N+](=O)[O-])c1 ZINC000430658965 932665306 /nfs/dbraw/zinc/66/53/06/932665306.db2.gz KNZCGSIRXGUHIN-UHFFFAOYSA-N 0 0 359.345 3.557 20 5 FHBDRN COC(=O)c1cc(C(=O)N(C)[C@@H]2CCCc3ccccc32)cc([N+](=O)[O-])c1 ZINC000023151985 932670558 /nfs/dbraw/zinc/67/05/58/932670558.db2.gz DEDAVZMTBKIFIG-GOSISDBHSA-N 0 0 368.389 3.531 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)Nc2cc(-c3ccc(C)o3)ccc2C)n1 ZINC000477546672 932681669 /nfs/dbraw/zinc/68/16/69/932681669.db2.gz DSZGTYOVOONRPR-UHFFFAOYSA-N 0 0 354.366 3.940 20 5 FHBDRN CC1(C)[C@H](OCc2ccccc2)C[C@@H]1NC(=O)c1csc([N+](=O)[O-])c1 ZINC000471715985 932692112 /nfs/dbraw/zinc/69/21/12/932692112.db2.gz MAFSCTIEKOIYON-LSDHHAIUSA-N 0 0 360.435 3.770 20 5 FHBDRN Cc1cccc(NC(=O)CNc2cc([N+](=O)[O-])ccc2OC(F)F)c1 ZINC000098041148 932718600 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CC[C@H](OC(=O)c1ccc(OC)c([N+](=O)[O-])c1)c1cccc([N+](=O)[O-])c1 ZINC001266834804 932813367 /nfs/dbraw/zinc/81/33/67/932813367.db2.gz DJMVMDJUWSOYCC-HNNXBMFYSA-N 0 0 360.322 3.820 20 5 FHBDRN O=C(Nc1ccc(C(F)(F)F)nc1)[C@H]1C[C@H]1c1cccc([N+](=O)[O-])c1 ZINC001266838288 932816851 /nfs/dbraw/zinc/81/68/51/932816851.db2.gz IOYNZDQWOHNSLG-STQMWFEESA-N 0 0 351.284 3.751 20 5 FHBDRN COc1cccc(C(=O)Nc2ccc(OC(F)F)cc2F)c1[N+](=O)[O-] ZINC000512448293 932832615 /nfs/dbraw/zinc/83/26/15/932832615.db2.gz ZLIVFSJAPUITBU-UHFFFAOYSA-N 0 0 356.256 3.596 20 5 FHBDRN COc1cc(Cc2noc(CCCC[C@H](C)C(C)=O)n2)ccc1[N+](=O)[O-] ZINC000548288609 932840314 /nfs/dbraw/zinc/84/03/14/932840314.db2.gz RHHWRAOQACJOPR-LBPRGKRZSA-N 0 0 361.398 3.515 20 5 FHBDRN Cc1ccccc1[C@H]1CCN(C(=O)NCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000510478556 932859384 /nfs/dbraw/zinc/85/93/84/932859384.db2.gz WHAWEMJUWJRGQP-KRWDZBQOSA-N 0 0 353.422 3.645 20 5 FHBDRN Cc1ccc(S(=O)(=O)N2CCC[C@H]2c2cccc(F)c2)c([N+](=O)[O-])c1 ZINC000101573528 932928607 /nfs/dbraw/zinc/92/86/07/932928607.db2.gz PWTMAGMWBHPZDN-HNNXBMFYSA-N 0 0 364.398 3.568 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)Oc1ccc2ccc(=O)oc2c1 ZINC000588435563 932935994 /nfs/dbraw/zinc/93/59/94/932935994.db2.gz OONDNZQYNLFIKL-BENRWUELSA-N 0 0 351.314 3.710 20 5 FHBDRN CC(=O)Nc1cccc(NC(=O)/C(C)=C\c2ccc([N+](=O)[O-])cc2)c1C ZINC000588436523 932953693 /nfs/dbraw/zinc/95/36/93/932953693.db2.gz RCWHXYNMEYRCOV-QXMHVHEDSA-N 0 0 353.378 3.904 20 5 FHBDRN COC(=O)/C=C\c1ccc(NC[C@H](C)c2ncc(C)s2)c([N+](=O)[O-])c1 ZINC000588436670 932958517 /nfs/dbraw/zinc/95/85/17/932958517.db2.gz WVQFQZXDYFUTTF-XOIDGJRKSA-N 0 0 361.423 3.762 20 5 FHBDRN CN(Cc1cc([N+](=O)[O-])ccc1Cl)C[C@@H](O)c1cc(F)ccc1F ZINC000051286906 932958771 /nfs/dbraw/zinc/95/87/71/932958771.db2.gz GUEKWRBHRJCROV-MRXNPFEDSA-N 0 0 356.756 3.692 20 5 FHBDRN Cn1ccc(C(=O)Nc2cc([N+](=O)[O-])ccc2Sc2cccs2)n1 ZINC000610935145 932962513 /nfs/dbraw/zinc/96/25/13/932962513.db2.gz FCXBKHFOBXTCLC-UHFFFAOYSA-N 0 0 360.420 3.793 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(N2CCO[C@@H](c3cccc(C(F)(F)F)c3)C2)n1 ZINC000178244983 932967076 /nfs/dbraw/zinc/96/70/76/932967076.db2.gz FNSNUJBFKBKUCB-OAHLLOKOSA-N 0 0 367.327 3.895 20 5 FHBDRN CO[C@H](C)CCNC(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000581907791 932974182 /nfs/dbraw/zinc/97/41/82/932974182.db2.gz GMWHRHMWOJIBQR-CYBMUJFWSA-N 0 0 359.382 3.934 20 5 FHBDRN C[C@@H](OC(=O)Cc1cccc([N+](=O)[O-])c1)c1nc2cc(Cl)ccc2n1C ZINC000176043224 932982949 /nfs/dbraw/zinc/98/29/49/932982949.db2.gz OXBXDPRSYYLOFS-LLVKDONJSA-N 0 0 373.796 3.982 20 5 FHBDRN Cc1ccc(OCCNC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000178257721 932992035 /nfs/dbraw/zinc/99/20/35/932992035.db2.gz MVQHAOIZZKHOEK-UHFFFAOYSA-N 0 0 369.421 3.656 20 5 FHBDRN CNC(=O)CCCCC(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000548332518 933001778 /nfs/dbraw/zinc/00/17/78/933001778.db2.gz AVMWYYOKMCUAFE-UHFFFAOYSA-N 0 0 371.393 3.632 20 5 FHBDRN CS[C@H]1CCC[C@@H](NC(=O)c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000175982691 933007618 /nfs/dbraw/zinc/00/76/18/933007618.db2.gz ZKZXEZVNNNVDDW-MNOVXSKESA-N 0 0 373.272 3.761 20 5 FHBDRN Cc1cnc(OCC(=O)N[C@@H](C)c2ccc3ccccc3c2)c([N+](=O)[O-])c1 ZINC000178282720 933022556 /nfs/dbraw/zinc/02/25/56/933022556.db2.gz YLJCRPGUZHIZSR-AWEZNQCLSA-N 0 0 365.389 3.708 20 5 FHBDRN COc1ccc(CNc2nn([C@@H](C)c3ccccc3)cc2C)cc1[N+](=O)[O-] ZINC000471816783 933023865 /nfs/dbraw/zinc/02/38/65/933023865.db2.gz QCOLDGCUBLSPSI-HNNXBMFYSA-N 0 0 366.421 3.752 20 5 FHBDRN COC(=O)c1cc(NCc2cc(OC)c(OC)cc2[N+](=O)[O-])c(C)cc1C ZINC000471819701 933036652 /nfs/dbraw/zinc/03/66/52/933036652.db2.gz JLOGLROXZOYNHX-UHFFFAOYSA-N 0 0 374.393 3.628 20 5 FHBDRN O=C(NCc1cc(F)cc(F)c1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000178287517 933041141 /nfs/dbraw/zinc/04/11/41/933041141.db2.gz AKUVCTNWTFEEMO-UHFFFAOYSA-N 0 0 361.348 3.747 20 5 FHBDRN COC(=O)CCc1ccc(NC(=O)/C(C)=C\c2ccc([N+](=O)[O-])cc2)cc1 ZINC000588438275 933055365 /nfs/dbraw/zinc/05/53/65/933055365.db2.gz SHMTUCVWCPMVRC-YPKPFQOOSA-N 0 0 368.389 3.742 20 5 FHBDRN COc1ccc(CN(C)C(=O)/C(C)=C\c2ccc([N+](=O)[O-])cc2)cc1C ZINC000588438451 933058957 /nfs/dbraw/zinc/05/89/57/933058957.db2.gz UMIMMXPVJJWDRN-QINSGFPZSA-N 0 0 354.406 3.974 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N(C[C@@H]1CCCO1)c1ccncc1 ZINC000588438787 933062986 /nfs/dbraw/zinc/06/29/86/933062986.db2.gz UCNBTPLIPRCUMX-ZDRDQBANSA-N 0 0 367.405 3.605 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CN1CCC[C@@H]1c1nc2c(n1C)CCCC2 ZINC000548349386 933064225 /nfs/dbraw/zinc/06/42/25/933064225.db2.gz BSNFVXLTYXIVQM-GOSISDBHSA-N 0 0 370.453 3.553 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N1C[C@H](C)O[C@@H](c2ccccc2)C1 ZINC000588444564 933102294 /nfs/dbraw/zinc/10/22/94/933102294.db2.gz URADWNNYEZOMJE-YGSZSEMYSA-N 0 0 366.417 3.987 20 5 FHBDRN CC(C)[C@H](CCc1ccccc1)c1nc(-c2c([N+](=O)[O-])ncn2C)no1 ZINC000520851018 933151231 /nfs/dbraw/zinc/15/12/31/933151231.db2.gz QFQTWVRRSYFTLD-AWEZNQCLSA-N 0 0 355.398 3.751 20 5 FHBDRN CC(=Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H](C)CC(=O)c1ccc(F)cc1 ZINC000588446739 933167980 /nfs/dbraw/zinc/16/79/80/933167980.db2.gz OVEVZXLOFLLTQU-YBEMTRGBSA-N 0 0 370.380 3.915 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@@H]1[C@H]1CCCCC1=O ZINC000588446749 933168030 /nfs/dbraw/zinc/16/80/30/933168030.db2.gz LUXSRQKDIUERLT-RUDFYFPKSA-N 0 0 356.422 3.748 20 5 FHBDRN CC(C)c1ccc(CN2CCNC(=O)C[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000510520771 933177093 /nfs/dbraw/zinc/17/70/93/933177093.db2.gz LKANPJWLENEDDT-IBGZPJMESA-N 0 0 367.449 3.781 20 5 FHBDRN C[C@H](c1ccccc1)N(C1CC1)S(=O)(=O)CCc1ccccc1[N+](=O)[O-] ZINC000510540847 933203949 /nfs/dbraw/zinc/20/39/49/933203949.db2.gz WVMQXRGKTUAOJC-OAHLLOKOSA-N 0 0 374.462 3.693 20 5 FHBDRN C[C@@H]1CCCC[C@@H]1CCNC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000510542810 933206786 /nfs/dbraw/zinc/20/67/86/933206786.db2.gz CEOOARAZGYKEMU-HUUCEWRRSA-N 0 0 356.426 3.727 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCSC2(CCCCC2)C1 ZINC000430772682 933225124 /nfs/dbraw/zinc/22/51/24/933225124.db2.gz CWEQPEBXJAIVBE-UHFFFAOYSA-N 0 0 363.483 3.593 20 5 FHBDRN C/C=C\c1ccc(NC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])cc1 ZINC000561676474 933238841 /nfs/dbraw/zinc/23/88/41/933238841.db2.gz VLBRBWYFSZMTBG-RQOWECAXSA-N 0 0 373.796 3.650 20 5 FHBDRN C[C@H]1CCCC[C@@H]1CCNC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000510576010 933241270 /nfs/dbraw/zinc/24/12/70/933241270.db2.gz UTUMJZTZJJGEAQ-LSDHHAIUSA-N 0 0 356.426 3.727 20 5 FHBDRN Cc1cc(OCC(=O)Nc2c(C)cc(N(C)C)cc2C)ccc1[N+](=O)[O-] ZINC000430794509 933243930 /nfs/dbraw/zinc/24/39/30/933243930.db2.gz QMDCRBNYBCXBJV-UHFFFAOYSA-N 0 0 357.410 3.604 20 5 FHBDRN Cc1cc(OCC(=O)NC[C@@H]2CCCC[C@@H]2C(F)(F)F)ccc1[N+](=O)[O-] ZINC000430804842 933249879 /nfs/dbraw/zinc/24/98/79/933249879.db2.gz BOGCDFCWFKPWSI-JSGCOSHPSA-N 0 0 374.359 3.767 20 5 FHBDRN CCCOc1cc(F)ccc1NC(=O)COc1ccc([N+](=O)[O-])c(C)c1 ZINC000430807206 933251174 /nfs/dbraw/zinc/25/11/74/933251174.db2.gz PHWXETCOWXIZHB-UHFFFAOYSA-N 0 0 362.357 3.849 20 5 FHBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N2CCC[C@H]2c2ccc(Cl)cc2)c1 ZINC000220342014 933254670 /nfs/dbraw/zinc/25/46/70/933254670.db2.gz YIHVPMUSCCJDNC-INIZCTEOSA-N 0 0 366.826 3.774 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N1CC(c2nc3ccccc3s2)C1 ZINC000477728793 933254863 /nfs/dbraw/zinc/25/48/63/933254863.db2.gz WRYDCNOINKVBIP-UHFFFAOYSA-N 0 0 367.430 3.763 20 5 FHBDRN Cc1cc(OCC(=O)Nc2cccnc2-c2ccccc2)ccc1[N+](=O)[O-] ZINC000430818932 933259901 /nfs/dbraw/zinc/25/99/01/933259901.db2.gz AFWWZYHNJAMWHG-UHFFFAOYSA-N 0 0 363.373 3.983 20 5 FHBDRN Cc1cccc(Oc2ccc(NC(=O)c3ccnc(N)c3[N+](=O)[O-])cc2)c1 ZINC000548385385 933267768 /nfs/dbraw/zinc/26/77/68/933267768.db2.gz MWQZAYPRHGFRFG-UHFFFAOYSA-N 0 0 364.361 3.755 20 5 FHBDRN Cc1c(CN[C@@H](c2ccc(F)cc2)c2cnccn2)cccc1[N+](=O)[O-] ZINC000477741898 933278465 /nfs/dbraw/zinc/27/84/65/933278465.db2.gz GWLYUDKCNCNCBR-IBGZPJMESA-N 0 0 352.369 3.712 20 5 FHBDRN Cc1cc(OCC(=O)N[C@H]2CC[C@H](c3cccc(F)c3)C2)ccc1[N+](=O)[O-] ZINC000430831971 933282123 /nfs/dbraw/zinc/28/21/23/933282123.db2.gz FBXZZWLRGUFBOW-RDJZCZTQSA-N 0 0 372.396 3.874 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CCC[C@H]2OCc2ccccc2)c1 ZINC000430866145 933339534 /nfs/dbraw/zinc/33/95/34/933339534.db2.gz YLSHYRNPUIPVBA-IEBWSBKVSA-N 0 0 354.406 3.771 20 5 FHBDRN COCCCN(Cc1ccncc1)C(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000187642205 933345225 /nfs/dbraw/zinc/34/52/25/933345225.db2.gz BULNITCHHYPKAG-UHFFFAOYSA-N 0 0 371.437 3.792 20 5 FHBDRN O=C(c1csc(-c2ccc([N+](=O)[O-])cc2)n1)N1C[C@@H]2CCCC[C@H]2C1 ZINC000178337526 933394631 /nfs/dbraw/zinc/39/46/31/933394631.db2.gz DODFKLNYMAILLL-KBPBESRZSA-N 0 0 357.435 3.981 20 5 FHBDRN CC(C)[C@H](NC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1)C(C)(C)O ZINC000276787693 933446722 /nfs/dbraw/zinc/44/67/22/933446722.db2.gz QMUOIBYHZZNHLB-IBGZPJMESA-N 0 0 352.434 3.619 20 5 FHBDRN CC(C)N(C(=O)c1csc([N+](=O)[O-])c1)c1ccc(Br)cn1 ZINC000055796718 933453396 /nfs/dbraw/zinc/45/33/96/933453396.db2.gz RNOWSUBOUKXFRY-UHFFFAOYSA-N 0 0 370.228 3.869 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)N[C@H]2C[C@@]2(C)c2ccccc2)cc1[N+](=O)[O-] ZINC000610594885 933472627 /nfs/dbraw/zinc/47/26/27/933472627.db2.gz DNSBHTNRKKLYPS-DCPHZVHLSA-N 0 0 353.422 3.994 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)NC[C@H]2OCCc3ccccc32)cc1[N+](=O)[O-] ZINC000610597067 933482647 /nfs/dbraw/zinc/48/26/47/933482647.db2.gz VAHVOZPZLSYVEN-AUUYWEPGSA-N 0 0 369.421 3.577 20 5 FHBDRN O=C(NCc1c(F)c(F)cc(F)c1F)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000610602463 933500399 /nfs/dbraw/zinc/50/03/99/933500399.db2.gz GGSCUPAMJKWJQT-UHFFFAOYSA-N 0 0 362.666 3.735 20 5 FHBDRN CN(CC(=O)Nc1ccc(COC(C)(C)C)cc1)c1ccccc1[N+](=O)[O-] ZINC000610624551 933544194 /nfs/dbraw/zinc/54/41/94/933544194.db2.gz DTOTYVDGBLZBGO-UHFFFAOYSA-N 0 0 371.437 3.985 20 5 FHBDRN CC(C)(C)OCc1ccc(NC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)cc1 ZINC000610624636 933544730 /nfs/dbraw/zinc/54/47/30/933544730.db2.gz PBOZAJGOYAXGQT-UHFFFAOYSA-N 0 0 372.377 3.891 20 5 FHBDRN COCCN(Cc1cccs1)C(=O)c1ccc(SC)c([N+](=O)[O-])c1 ZINC000610620991 933550320 /nfs/dbraw/zinc/55/03/20/933550320.db2.gz MUYNCGULDUVJHJ-UHFFFAOYSA-N 0 0 366.464 3.667 20 5 FHBDRN COc1cc(C(=O)N[C@H](C)c2ccccc2OC(F)F)ccc1[N+](=O)[O-] ZINC000510736191 933607696 /nfs/dbraw/zinc/60/76/96/933607696.db2.gz QLNKMRGGDOJGSG-SNVBAGLBSA-N 0 0 366.320 3.696 20 5 FHBDRN C[C@H](NC(=O)NCc1ncoc1-c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000477822524 933621389 /nfs/dbraw/zinc/62/13/89/933621389.db2.gz NVWGCDWTOATSOS-ZDUSSCGKSA-N 0 0 366.377 3.810 20 5 FHBDRN O=C(Nc1nc(-c2ccccc2)ns1)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000065074397 933653591 /nfs/dbraw/zinc/65/35/91/933653591.db2.gz AXBYEXOZZMTAHJ-UHFFFAOYSA-N 0 0 365.374 3.847 20 5 FHBDRN C[C@@H](C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)N1CCC[C@H](C)C1 ZINC000610655869 933659016 /nfs/dbraw/zinc/65/90/16/933659016.db2.gz VWUAOZQHJJUGGR-STQMWFEESA-N 0 0 374.466 3.777 20 5 FHBDRN Cc1ccc(-c2nnc(NC(=O)c3cccc([N+](=O)[O-])c3)s2)c(C)c1 ZINC000065082860 933736613 /nfs/dbraw/zinc/73/66/13/933736613.db2.gz XBCSQKHQXXGARQ-UHFFFAOYSA-N 0 0 354.391 3.982 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1Cl)N(Cc1ccco1)C[C@@H]1CCCO1 ZINC000098106970 933765246 /nfs/dbraw/zinc/76/52/46/933765246.db2.gz PCJXUHNYAHLTIN-AWEZNQCLSA-N 0 0 364.785 3.663 20 5 FHBDRN Cc1cc(OCC(=O)N(Cc2ccco2)C2CCCC2)ccc1[N+](=O)[O-] ZINC000510811184 933780476 /nfs/dbraw/zinc/78/04/76/933780476.db2.gz JFPPINHUOZDUSX-UHFFFAOYSA-N 0 0 358.394 3.846 20 5 FHBDRN CCOc1ccccc1[C@@H](C)NC(=O)COc1ccc([N+](=O)[O-])c(C)c1 ZINC000510812717 933781532 /nfs/dbraw/zinc/78/15/32/933781532.db2.gz NCMPGRZAYONCQE-CQSZACIVSA-N 0 0 358.394 3.558 20 5 FHBDRN CCc1ccc(C(=O)N(c2ccccc2)[C@H](CC)C(=O)OC)cc1[N+](=O)[O-] ZINC000471924114 933792225 /nfs/dbraw/zinc/79/22/25/933792225.db2.gz ZZVBQZJQNPPELE-QGZVFWFLSA-N 0 0 370.405 3.756 20 5 FHBDRN NC(=O)c1cc(NCCc2ccc([N+](=O)[O-])cc2)c(Cl)cc1Cl ZINC000431098128 933830062 /nfs/dbraw/zinc/83/00/62/933830062.db2.gz BWCFNFFOJLPFBO-UHFFFAOYSA-N 0 0 354.193 3.655 20 5 FHBDRN C[C@H](CC(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1)C1CCCCC1 ZINC000510839964 933840533 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Cc1c(CC(=O)N2CCC(Nc3ccc(F)cc3)CC2)cccc1[N+](=O)[O-] ZINC000119443017 934809381 /nfs/dbraw/zinc/80/93/81/934809381.db2.gz VBADHCOFPYQKQS-UHFFFAOYSA-N 0 0 371.412 3.688 20 5 FHBDRN CCOC(=O)CC[C@@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1SC(C)C ZINC000538245503 934817426 /nfs/dbraw/zinc/81/74/26/934817426.db2.gz DNENNGZBEFLTGI-GFCCVEGCSA-N 0 0 368.455 3.557 20 5 FHBDRN Cc1noc(C)c1[C@H](C)CC(=O)Nc1ccnn1-c1ccc([N+](=O)[O-])cc1 ZINC000156660529 934838856 /nfs/dbraw/zinc/83/88/56/934838856.db2.gz ROFBTNHAMKPKKI-LLVKDONJSA-N 0 0 369.381 3.518 20 5 FHBDRN Cn1ccnc1[C@H](NCC(C)(C)[C@@H]1CCCCO1)c1ccc([N+](=O)[O-])cc1 ZINC000611560794 934849590 /nfs/dbraw/zinc/84/95/90/934849590.db2.gz XMNJMNCOYKUTFO-ZWKOTPCHSA-N 0 0 372.469 3.603 20 5 FHBDRN CC[C@H](C)[C@H](NC(=O)CCOc1cc(C)ccc1[N+](=O)[O-])C(F)(F)F ZINC000538491869 934858026 /nfs/dbraw/zinc/85/80/26/934858026.db2.gz YRSSQXQBAYTNIH-NHYWBVRUSA-N 0 0 362.348 3.765 20 5 FHBDRN COc1ccc(NC(=O)C2(CCOCc3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000472031575 934861382 /nfs/dbraw/zinc/86/13/82/934861382.db2.gz HSHGNIVXIJWXIC-UHFFFAOYSA-N 0 0 370.405 3.929 20 5 FHBDRN Cc1onc(-c2ccccn2)c1C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000119530943 934864301 /nfs/dbraw/zinc/86/43/01/934864301.db2.gz SUEPBYGXUPJYBY-UHFFFAOYSA-N 0 0 358.741 3.859 20 5 FHBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1C[C@H](C)C[C@H]1c1ccccc1 ZINC000511014705 934888070 /nfs/dbraw/zinc/88/80/70/934888070.db2.gz QQLLKXVBQBABGG-DYVFJYSZSA-N 0 0 360.435 3.675 20 5 FHBDRN CC(C)n1cnnc1[C@H]1CCCN(c2nccc3c2cccc3[N+](=O)[O-])C1 ZINC000450340442 934901062 /nfs/dbraw/zinc/90/10/62/934901062.db2.gz FWXKNILRBOCHDC-AWEZNQCLSA-N 0 0 366.425 3.699 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NC[C@@H](C)Oc1cccc(F)c1 ZINC000538788699 934904635 /nfs/dbraw/zinc/90/46/35/934904635.db2.gz XGMCSDQIPKQZGX-CYBMUJFWSA-N 0 0 360.385 3.856 20 5 FHBDRN CC(C)Sc1ccc(Cl)cc1NC(=O)c1c([N+](=O)[O-])cnn1C ZINC000119597481 934907952 /nfs/dbraw/zinc/90/79/52/934907952.db2.gz ZMDQOYQNEBYHCW-UHFFFAOYSA-N 0 0 354.819 3.735 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(OCc2ccc(Br)cc2)c1 ZINC000388447966 934910376 /nfs/dbraw/zinc/91/03/76/934910376.db2.gz IEGTUSMQJPWMCN-UHFFFAOYSA-N 0 0 366.167 3.723 20 5 FHBDRN C[C@@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1)c1ccc(OCC2CC2)c(F)c1 ZINC000119631941 934939162 /nfs/dbraw/zinc/93/91/62/934939162.db2.gz GAJCKGMBPRNFLP-CYBMUJFWSA-N 0 0 372.396 3.943 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)c1cnc2onc(C(C)C)c2c1 ZINC000014182700 934942891 /nfs/dbraw/zinc/94/28/91/934942891.db2.gz FPBAQZSZZPJJFW-UHFFFAOYSA-N 0 0 356.338 3.515 20 5 FHBDRN C[C@H](NC(=O)NCc1cccc([N+](=O)[O-])c1)c1ccc2ncsc2c1 ZINC000548599390 934961289 /nfs/dbraw/zinc/96/12/89/934961289.db2.gz KUJCTZWEXHBPCG-NSHDSACASA-N 0 0 356.407 3.765 20 5 FHBDRN CC(C)Oc1cc(C(=O)N(C)Cc2nc3ccccc3[nH]2)ccc1[N+](=O)[O-] ZINC000563192385 934976372 /nfs/dbraw/zinc/97/63/72/934976372.db2.gz ULYZWUFCVRSVFV-UHFFFAOYSA-N 0 0 368.393 3.531 20 5 FHBDRN O=C(N[C@@H]1CCCc2cn(C3CCCC3)nc21)c1csc([N+](=O)[O-])c1 ZINC000611567425 934995389 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364.405 3.799 20 5 FHBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N2CCC[C@@H]2c2ccccc2Cl)c1 ZINC000511047664 935054534 /nfs/dbraw/zinc/05/45/34/935054534.db2.gz PHNKZXSEDUKWEK-MRXNPFEDSA-N 0 0 366.826 3.774 20 5 FHBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1CSc1nnnn1C1CCCC1 ZINC000511048729 935072183 /nfs/dbraw/zinc/07/21/83/935072183.db2.gz YZQRCHUCVWVLNI-UHFFFAOYSA-N 0 0 363.443 3.776 20 5 FHBDRN CC[C@](C)(NC(=O)Nc1cc([N+](=O)[O-])ccc1OC)c1nccs1 ZINC000157497094 935084380 /nfs/dbraw/zinc/08/43/80/935084380.db2.gz HFNQPZDPWAQNCS-HNNXBMFYSA-N 0 0 350.400 3.507 20 5 FHBDRN CCOc1cc2c(cc1NC(=O)c1ccc([N+](=O)[O-])c(OC)c1)O[C@H](C)C2 ZINC000511051556 935091987 /nfs/dbraw/zinc/09/19/87/935091987.db2.gz RJAXETFVGBSWLY-LLVKDONJSA-N 0 0 372.377 3.578 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)Nc1cc(C)n([C@@H](C)C2CC2)n1 ZINC000439895376 945078677 /nfs/dbraw/zinc/07/86/77/945078677.db2.gz FVPVICHKERYYRJ-LBPRGKRZSA-N 0 0 373.413 3.535 20 5 FHBDRN Nn1c(SCc2ccc(Cl)c([N+](=O)[O-])c2)nnc1-c1cccs1 ZINC000134934666 935133483 /nfs/dbraw/zinc/13/34/83/935133483.db2.gz XWSAMYBLWUCKRU-UHFFFAOYSA-N 0 0 367.843 3.574 20 5 FHBDRN COc1ccc(C2(CNC(=O)[C@H](C)c3cccc([N+](=O)[O-])c3)CCC2)cc1 ZINC000582037275 935156866 /nfs/dbraw/zinc/15/68/66/935156866.db2.gz PLXITAIQRGFELM-OAHLLOKOSA-N 0 0 368.433 3.945 20 5 FHBDRN COc1cc(Br)ccc1C(=O)Nc1cc(F)cc([N+](=O)[O-])c1 ZINC000389340236 935157505 /nfs/dbraw/zinc/15/75/05/935157505.db2.gz RBQCXNCPZXQECU-UHFFFAOYSA-N 0 0 369.146 3.757 20 5 FHBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1COc1cc(Cl)ccc1C(N)=O ZINC000511057330 935162412 /nfs/dbraw/zinc/16/24/12/935162412.db2.gz JPLYMIKMFIDTMJ-UHFFFAOYSA-N 0 0 364.785 3.713 20 5 FHBDRN COc1cccc([C@@H]2C[C@@H]2C(=O)Nc2ccc3cc([N+](=O)[O-])ccc3n2)c1 ZINC000084776547 935170265 /nfs/dbraw/zinc/17/02/65/935170265.db2.gz KVUMYIFSKIGYPG-IRXDYDNUSA-N 0 0 363.373 3.894 20 5 FHBDRN Cc1c2ccccc2n(C)c1CNC(=O)N[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000472141972 935171560 /nfs/dbraw/zinc/17/15/60/935171560.db2.gz JSJRWBGXMCUWBK-CQSZACIVSA-N 0 0 366.421 3.955 20 5 FHBDRN COc1ccc(-c2nc(CN(C)CCc3ccccc3[N+](=O)[O-])co2)cc1 ZINC000511059830 935173452 /nfs/dbraw/zinc/17/34/52/935173452.db2.gz OSTNQNGFONGASK-UHFFFAOYSA-N 0 0 367.405 3.933 20 5 FHBDRN C[C@H](NC(=O)c1cccc(Nc2cnn(C)c2)c1)c1ccccc1[N+](=O)[O-] ZINC000539364151 935190543 /nfs/dbraw/zinc/19/05/43/935190543.db2.gz SRJINTPJVDXFJF-ZDUSSCGKSA-N 0 0 365.393 3.563 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000051407337 935194894 /nfs/dbraw/zinc/19/48/94/935194894.db2.gz KURNPTAOLWVJDI-UHFFFAOYSA-N 0 0 358.354 3.946 20 5 FHBDRN Cn1c2ccccc2nc1C(C)(C)NC(=O)Nc1ccc([N+](=O)[O-])cc1F ZINC000472146655 935198346 /nfs/dbraw/zinc/19/83/46/935198346.db2.gz ZZODEGIBTACYOK-UHFFFAOYSA-N 0 0 371.372 3.677 20 5 FHBDRN C[C@@H](N[C@H](CO)c1ccc(Br)cc1)c1ccccc1[N+](=O)[O-] ZINC000611337576 935200112 /nfs/dbraw/zinc/20/01/12/935200112.db2.gz LUDFVEOTAHEROK-IAQYHMDHSA-N 0 0 365.227 3.742 20 5 FHBDRN Cc1ccc(Sc2ccc(C[N@H+](C)CCC(=O)[O-])cc2[N+](=O)[O-])cc1 ZINC000263416810 935205264 /nfs/dbraw/zinc/20/52/64/935205264.db2.gz NOMIQSVFLZBPEN-UHFFFAOYSA-N 0 0 360.435 3.961 20 5 FHBDRN CCOc1ccc(NC(=O)Cc2nc3cc4ccccc4cc3c(=O)[nH]2)cc1 ZINC000119777238 935217219 /nfs/dbraw/zinc/21/72/19/935217219.db2.gz MWMATSJPSYZBBK-UHFFFAOYSA-N 0 0 373.412 3.656 20 5 FHBDRN CCCN(C(=O)COc1ccc([N+](=O)[O-])cc1)[C@@H]1CCc2ccccc2C1 ZINC000072024147 935217612 /nfs/dbraw/zinc/21/76/12/935217612.db2.gz KCWLTHIOSODHIY-LJQANCHMSA-N 0 0 368.433 3.770 20 5 FHBDRN O=C(Cc1nc(COc2cccc([N+](=O)[O-])c2)cs1)Nc1ccccc1 ZINC000072036744 935225789 /nfs/dbraw/zinc/22/57/89/935225789.db2.gz JWKKJTVXWNMHHP-UHFFFAOYSA-N 0 0 369.402 3.812 20 5 FHBDRN C[C@H](c1nc(Cc2ccccc2)no1)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000511071764 935234615 /nfs/dbraw/zinc/23/46/15/935234615.db2.gz HJHSESBCLZGXHL-OAHLLOKOSA-N 0 0 366.421 3.804 20 5 FHBDRN C[C@H](c1nc(-c2ccc3c(c2)CCC(=O)N3)no1)c1cccc([N+](=O)[O-])c1 ZINC000582088483 935239229 /nfs/dbraw/zinc/23/92/29/935239229.db2.gz LOLSNFGAVGNZIW-NSHDSACASA-N 0 0 364.361 3.681 20 5 FHBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N[C@H](C)CC(F)(F)F ZINC000551314508 935253271 /nfs/dbraw/zinc/25/32/71/935253271.db2.gz NIWIRASTIQPWNY-ZCFIWIBFSA-N 0 0 369.137 3.736 20 5 FHBDRN COCCN(CCCc1ccccc1)C(=O)c1ccc([N+](=O)[O-])cc1C ZINC000072064412 935264441 /nfs/dbraw/zinc/26/44/41/935264441.db2.gz KAZOHHXKNPXTQF-UHFFFAOYSA-N 0 0 356.422 3.625 20 5 FHBDRN CC1(C)CN(Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c2ccccc2O1 ZINC000135502554 935264487 /nfs/dbraw/zinc/26/44/87/935264487.db2.gz JAEQXGQKLKOTFO-UHFFFAOYSA-N 0 0 366.377 3.822 20 5 FHBDRN O=[N+]([O-])c1cccc(OCCOc2nc(-c3ccccc3Cl)no2)c1 ZINC000072068248 935270924 /nfs/dbraw/zinc/27/09/24/935270924.db2.gz NXIJLYGKDINWCN-UHFFFAOYSA-N 0 0 361.741 3.756 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1OCC(=O)N[C@H](CC(C)C)c1ccccc1 ZINC000072068030 935271346 /nfs/dbraw/zinc/27/13/46/935271346.db2.gz UPFVRJDVGMIMND-QGZVFWFLSA-N 0 0 372.421 3.886 20 5 FHBDRN C[C@H](CCc1ccc(O)cc1)NC(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000551413439 935276737 /nfs/dbraw/zinc/27/67/37/935276737.db2.gz JZKQBLBEGOSRBQ-GFCCVEGCSA-N 0 0 354.362 3.798 20 5 FHBDRN CC(C)(C(=O)N1CCC(c2ccc(O)cc2)CC1)c1ccccc1[N+](=O)[O-] ZINC000551616905 935315436 /nfs/dbraw/zinc/31/54/36/935315436.db2.gz OTOQQIPOZUWTMR-UHFFFAOYSA-N 0 0 368.433 3.984 20 5 FHBDRN C[C@@H](Nc1ccc2c(c1)C(=O)CCC2)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000426183292 945092522 /nfs/dbraw/zinc/09/25/22/945092522.db2.gz KTHVMNBQUKVOKU-GFCCVEGCSA-N 0 0 353.378 3.553 20 5 FHBDRN COc1ccc(Cl)cc1NC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000014462845 935324282 /nfs/dbraw/zinc/32/42/82/935324282.db2.gz YEQLEJKAACFFCK-UHFFFAOYSA-N 0 0 372.768 3.695 20 5 FHBDRN C[C@H]1CC[C@H](CCC(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)O1 ZINC000551680068 935327614 /nfs/dbraw/zinc/32/76/14/935327614.db2.gz MQVATWHUBLPPDL-TVQRCGJNSA-N 0 0 357.204 3.644 20 5 FHBDRN Cc1ccn(-c2ccc(NC(=O)CCNc3ccccc3[N+](=O)[O-])cc2)n1 ZINC000551697882 935330864 /nfs/dbraw/zinc/33/08/64/935330864.db2.gz WUBDPDUJILUSNH-UHFFFAOYSA-N 0 0 365.393 3.530 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)c2ccc3c(c2)NC(=O)C3(C)C)cc1[N+](=O)[O-] ZINC000551739414 935335312 /nfs/dbraw/zinc/33/53/12/935335312.db2.gz AQANSELCFXGSRD-GFCCVEGCSA-N 0 0 367.405 3.624 20 5 FHBDRN C[C@H]1[C@@H](C(F)(F)F)CCN1C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000472183076 935337541 /nfs/dbraw/zinc/33/75/41/935337541.db2.gz PLXSJPPIHBJMGB-KWQFWETISA-N 0 0 365.739 3.731 20 5 FHBDRN Cc1cccc(C(=O)Nc2ccc(-n3ccnc3)c(Cl)c2)c1[N+](=O)[O-] ZINC000119937450 935348956 /nfs/dbraw/zinc/34/89/56/935348956.db2.gz AXJAXHWCWOXVJV-UHFFFAOYSA-N 0 0 356.769 3.995 20 5 FHBDRN CCOc1ccc([C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])cc2OC)cc1 ZINC000427109228 945094744 /nfs/dbraw/zinc/09/47/44/945094744.db2.gz QITKSBDBYHYBRP-GOSISDBHSA-N 0 0 370.405 3.979 20 5 FHBDRN CC(=O)c1ccc(N2CCN(c3ccc([N+](=O)[O-])c(C)c3)CC2)c(F)c1 ZINC000051476357 935356074 /nfs/dbraw/zinc/35/60/74/935356074.db2.gz UKEZPMQXUIYUKF-UHFFFAOYSA-N 0 0 357.385 3.572 20 5 FHBDRN COCCN(Cc1cncs1)c1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000447810967 935379341 /nfs/dbraw/zinc/37/93/41/935379341.db2.gz CFEJTVRYWTWMLS-UHFFFAOYSA-N 0 0 361.345 3.723 20 5 FHBDRN Cc1ccccc1[C@H]1CN(c2cc(C(F)(F)F)ncc2[N+](=O)[O-])CCO1 ZINC000582219507 935421841 /nfs/dbraw/zinc/42/18/41/935421841.db2.gz XINCIDQRKIFHSO-OAHLLOKOSA-N 0 0 367.327 3.895 20 5 FHBDRN Cc1cccc(C)c1COC(=O)CCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000781739510 935424016 /nfs/dbraw/zinc/42/40/16/935424016.db2.gz KKKXVMJJJYRSPQ-UHFFFAOYSA-N 0 0 358.350 3.796 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC[C@@H]1Cc1cccc(F)c1 ZINC000047319750 945100959 /nfs/dbraw/zinc/10/09/59/945100959.db2.gz ZKJSKWZBOZSJBP-OAHLLOKOSA-N 0 0 373.384 3.982 20 5 FHBDRN O=C(O[C@@H]([C@H]1CCCO1)C(F)(F)F)c1ccc([N+](=O)[O-])cc1Cl ZINC000158233586 935461302 /nfs/dbraw/zinc/46/13/02/935461302.db2.gz UWGYHIMNSHZAOM-MNOVXSKESA-N 0 0 353.680 3.515 20 5 FHBDRN C/C(=C\C(=O)N1CCO[C@@H](c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000785123710 935486669 /nfs/dbraw/zinc/48/66/69/935486669.db2.gz IUPLIASTJLSUJK-OCKXMSAZSA-N 0 0 352.390 3.598 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1cc(C)nn1-c1ccccc1C ZINC000427118969 945105221 /nfs/dbraw/zinc/10/52/21/945105221.db2.gz DDMIILLGIXGEMR-UHFFFAOYSA-N 0 0 366.377 3.658 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1F)N1CCCc2c(OC(F)F)cccc21 ZINC000582321628 935517663 /nfs/dbraw/zinc/51/76/63/935517663.db2.gz WZXMWLXOBKIIKT-UHFFFAOYSA-N 0 0 366.295 3.928 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCc1c(F)cc(F)cc1F ZINC000511101713 935559557 /nfs/dbraw/zinc/55/95/57/935559557.db2.gz OCRBCNJYJMVRIS-LBPRGKRZSA-N 0 0 366.339 3.897 20 5 FHBDRN COc1cc(C(=O)NCCCSc2ccccc2)cc([N+](=O)[O-])c1C ZINC000478065657 935563499 /nfs/dbraw/zinc/56/34/99/935563499.db2.gz KWCIICZIDDKCIT-UHFFFAOYSA-N 0 0 360.435 3.824 20 5 FHBDRN COC(=O)c1cc(F)cc(NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)c1F ZINC000478079839 935565767 /nfs/dbraw/zinc/56/57/67/935565767.db2.gz JBQXDRLUGYDVBE-UHFFFAOYSA-N 0 0 370.695 3.565 20 5 FHBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1Cn1cc(C(F)(F)F)ccc1=O ZINC000511104647 935578900 /nfs/dbraw/zinc/57/89/00/935578900.db2.gz HYSVHNMTWZIXCM-UHFFFAOYSA-N 0 0 356.300 3.611 20 5 FHBDRN CCOc1cc(C(=O)N(C)[C@H]2CCC(C)(C)C2)c([N+](=O)[O-])cc1OC ZINC000478180630 935583071 /nfs/dbraw/zinc/58/30/71/935583071.db2.gz MKSZYBBFKULYBZ-LBPRGKRZSA-N 0 0 350.415 3.653 20 5 FHBDRN O=C([C@H]1CCOc2ccccc21)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000152417020 935586274 /nfs/dbraw/zinc/58/62/74/935586274.db2.gz USHYJHZAKUKQBR-KRWDZBQOSA-N 0 0 352.390 3.652 20 5 FHBDRN Cc1nc(CCNC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])sc1C ZINC000478167951 935587468 /nfs/dbraw/zinc/58/74/68/935587468.db2.gz ADRQYWZAIWOLAR-UHFFFAOYSA-N 0 0 373.356 3.659 20 5 FHBDRN Cc1sc(C(=O)N[C@@H]2C[C@H]2c2ccc(OC(F)F)cc2)cc1[N+](=O)[O-] ZINC000478216421 935593495 /nfs/dbraw/zinc/59/34/95/935593495.db2.gz ZABXCHRYAIAFHM-NWDGAFQWSA-N 0 0 368.361 3.852 20 5 FHBDRN O=C(Nc1cccc(NCC(F)(F)F)c1)c1ccc(F)cc1[N+](=O)[O-] ZINC000548734556 935599415 /nfs/dbraw/zinc/59/94/15/935599415.db2.gz JBXFXZVABYAXHR-UHFFFAOYSA-N 0 0 357.263 3.960 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N[C@@H]1CC[C@H](c2cccc(F)c2)C1 ZINC000478292399 935607100 /nfs/dbraw/zinc/60/71/00/935607100.db2.gz KNWZFIICPULAAS-GOEBONIOSA-N 0 0 358.369 3.565 20 5 FHBDRN CCN(CCOC)c1cccc(COc2c(Cl)cccc2[N+](=O)[O-])n1 ZINC000562038589 935609248 /nfs/dbraw/zinc/60/92/48/935609248.db2.gz NVWRMMHQLMOPHP-UHFFFAOYSA-N 0 0 365.817 3.695 20 5 FHBDRN Cc1ccc(SCCNC(=O)NCc2cccc([N+](=O)[O-])c2C)cc1 ZINC000478461945 935629734 /nfs/dbraw/zinc/62/97/34/935629734.db2.gz RWICWHBLZSFLRY-UHFFFAOYSA-N 0 0 359.451 3.803 20 5 FHBDRN Cc1ccccc1[C@]1(F)CCN(C(=O)NCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000507296650 945113460 /nfs/dbraw/zinc/11/34/60/945113460.db2.gz NLJDULLSRDZQAF-FQEVSTJZSA-N 0 0 371.412 3.726 20 5 FHBDRN CO[C@@H](c1ccc(Cl)cc1)[C@@H](C)NC(=O)Cc1ccccc1[N+](=O)[O-] ZINC000127574597 935635765 /nfs/dbraw/zinc/63/57/65/935635765.db2.gz RGRKJJIUPPYSMT-KZULUSFZSA-N 0 0 362.813 3.683 20 5 FHBDRN Cc1cc(Cl)c(S(=O)(=O)N([C@H](C)C2CC2)C2CC2)cc1[N+](=O)[O-] ZINC000176666621 935645588 /nfs/dbraw/zinc/64/55/88/935645588.db2.gz QBZLUUVKSBJDAO-SNVBAGLBSA-N 0 0 358.847 3.508 20 5 FHBDRN CCOc1cccc([C@@H](C)NC(=O)NCc2cccc([N+](=O)[O-])c2C)c1 ZINC000478561243 935646047 /nfs/dbraw/zinc/64/60/47/935646047.db2.gz YNWKXORXUSERRU-CQSZACIVSA-N 0 0 357.410 3.862 20 5 FHBDRN COc1ccccc1-c1nn(C)cc1C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000127595772 935651543 /nfs/dbraw/zinc/65/15/43/935651543.db2.gz KGEXAHBFWQMIEN-UHFFFAOYSA-N 0 0 366.377 3.565 20 5 FHBDRN Cc1ccc2c(c1)N(C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)C[C@@H](C)O2 ZINC000582401136 935653643 /nfs/dbraw/zinc/65/36/43/935653643.db2.gz IKEADCLQFJQNSC-CQSZACIVSA-N 0 0 368.389 3.680 20 5 FHBDRN CCOc1cc(CCCNC(=O)c2ccc([N+](=O)[O-])cc2C)ccc1OC ZINC000127612016 935654351 /nfs/dbraw/zinc/65/43/51/935654351.db2.gz GPAXRRHXGFUVJD-UHFFFAOYSA-N 0 0 372.421 3.673 20 5 FHBDRN CN(CCOc1ccccc1C(C)(C)C)c1cccc(C(N)=O)c1[N+](=O)[O-] ZINC000516672302 945115575 /nfs/dbraw/zinc/11/55/75/945115575.db2.gz LLHPZCQCUTZTDB-UHFFFAOYSA-N 0 0 371.437 3.506 20 5 FHBDRN CC(C)(C)CC[C@H](CO)NC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000478609248 935664926 /nfs/dbraw/zinc/66/49/26/935664926.db2.gz MMPOWHFUCSDZHS-GFCCVEGCSA-N 0 0 362.348 3.531 20 5 FHBDRN COc1cc(C(=O)N[C@H](C)c2cc(F)ccc2OC)cc([N+](=O)[O-])c1C ZINC000478691286 935678813 /nfs/dbraw/zinc/67/88/13/935678813.db2.gz BWILBKUDRRSBSG-LLVKDONJSA-N 0 0 362.357 3.551 20 5 FHBDRN Cc1coc(-c2cccc(NC(=O)NCCc3ccc([N+](=O)[O-])cc3)c2)n1 ZINC000158286334 935683828 /nfs/dbraw/zinc/68/38/28/935683828.db2.gz NPWBOHCAFHKANU-UHFFFAOYSA-N 0 0 366.377 3.922 20 5 FHBDRN Cc1cc(C(=O)N2CCN(C3CC3)c3c(C)cccc32)cc([N+](=O)[O-])c1 ZINC000478691126 935685317 /nfs/dbraw/zinc/68/53/17/935685317.db2.gz ZIQVVUKZSYYLBH-UHFFFAOYSA-N 0 0 351.406 3.841 20 5 FHBDRN CN(C(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)C1CCCCCCC1 ZINC000110065313 935686570 /nfs/dbraw/zinc/68/65/70/935686570.db2.gz GXOUQFREOXTMSC-UHFFFAOYSA-N 0 0 357.410 3.621 20 5 FHBDRN Cc1ccccc1C1(C(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)CCC1 ZINC000472225016 935698287 /nfs/dbraw/zinc/69/82/87/935698287.db2.gz RMWMYZPPCZPJKW-UHFFFAOYSA-N 0 0 350.418 3.910 20 5 FHBDRN Cc1ncsc1/C=C\C(=O)N(C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000588517883 935705690 /nfs/dbraw/zinc/70/56/90/935705690.db2.gz DROIXBPNVMWZPX-WAYWQWQTSA-N 0 0 351.815 3.685 20 5 FHBDRN CCOc1cc(CNC(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)ccc1OC ZINC000127679630 935722071 /nfs/dbraw/zinc/72/20/71/935722071.db2.gz PXCUZJTVDCSMPV-UHFFFAOYSA-N 0 0 373.409 3.941 20 5 FHBDRN O=C(Cc1ccc(Br)c(F)c1)Nc1ccc(F)c([N+](=O)[O-])c1 ZINC000127698839 935745196 /nfs/dbraw/zinc/74/51/96/935745196.db2.gz FMMAFQSNFOAEAV-UHFFFAOYSA-N 0 0 371.137 3.817 20 5 FHBDRN Cc1c(CNC(=O)NCCc2c[nH]c3ccc(F)cc23)cccc1[N+](=O)[O-] ZINC000478862335 935745802 /nfs/dbraw/zinc/74/58/02/935745802.db2.gz XXIUSZFHHSAGCE-UHFFFAOYSA-N 0 0 370.384 3.566 20 5 FHBDRN C[C@@H](c1ccc(Cl)c(Cl)c1)[S@](=O)CCn1cc([N+](=O)[O-])cn1 ZINC000158851822 935754349 /nfs/dbraw/zinc/75/43/49/935754349.db2.gz HSDMBRUZNDJIDP-AUADJRAKSA-N 0 0 362.238 3.608 20 5 FHBDRN CN1Cc2cc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4o3)ccc2NC1=O ZINC000478990265 935766623 /nfs/dbraw/zinc/76/66/23/935766623.db2.gz LYQAYDPSLHXOMP-UHFFFAOYSA-N 0 0 366.333 3.571 20 5 FHBDRN CN(C(=O)c1ccc(F)c(Br)c1)c1cccc([N+](=O)[O-])c1 ZINC000158388499 935770223 /nfs/dbraw/zinc/77/02/23/935770223.db2.gz QCLTYTCNBXJTEH-UHFFFAOYSA-N 0 0 353.147 3.773 20 5 FHBDRN Cc1cc(C(=O)CN(C)CCc2ccccc2[N+](=O)[O-])c(C)n1C1CC1 ZINC000511140793 935776837 /nfs/dbraw/zinc/77/68/37/935776837.db2.gz KDARGLIOKBSSAN-UHFFFAOYSA-N 0 0 355.438 3.705 20 5 FHBDRN CCc1noc(CC)c1Cc1nc(Cc2cccc([N+](=O)[O-])c2C)no1 ZINC000545076572 935782927 /nfs/dbraw/zinc/78/29/27/935782927.db2.gz JORIDFCDEHSKPG-UHFFFAOYSA-N 0 0 356.382 3.581 20 5 FHBDRN O=c1c([N+](=O)[O-])cc(Br)cn1C[C@@H]1CCCc2ccccc21 ZINC000158415280 935784957 /nfs/dbraw/zinc/78/49/57/935784957.db2.gz GHBXSNQBXOKVFS-LBPRGKRZSA-N 0 0 363.211 3.639 20 5 FHBDRN Cc1ccc(C)c(NC(=O)[C@H](C)N(C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000511146014 935786120 /nfs/dbraw/zinc/78/61/20/935786120.db2.gz XPLBKCWZVCFFIS-INIZCTEOSA-N 0 0 355.438 3.713 20 5 FHBDRN CC(C)c1ccc(C(=O)N2C[C@H](C)C(=O)Nc3ccccc32)cc1[N+](=O)[O-] ZINC000187751741 935788743 /nfs/dbraw/zinc/78/87/43/935788743.db2.gz QQYPMQWOSMFSND-ZDUSSCGKSA-N 0 0 367.405 3.953 20 5 FHBDRN C[C@H](NCc1c(F)cc([N+](=O)[O-])cc1F)c1noc(Cc2ccccc2)n1 ZINC000509572040 945123914 /nfs/dbraw/zinc/12/39/14/945123914.db2.gz ATANPRXFIDEPBN-NSHDSACASA-N 0 0 374.347 3.698 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@@H](c2ccc(F)cc2)C1 ZINC000431435863 935797822 /nfs/dbraw/zinc/79/78/22/935797822.db2.gz QTGUZBYYKCEIGP-CYBMUJFWSA-N 0 0 359.357 3.764 20 5 FHBDRN C[C@@]1(c2ccccc2)C[C@@H]1NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000611616138 935808667 /nfs/dbraw/zinc/80/86/67/935808667.db2.gz KKTKAQMTPHKCBK-YJBOKZPZSA-N 0 0 362.332 3.656 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(N2CCC(c3c[nH]c4ncccc34)CC2)n1 ZINC000611616983 935814445 /nfs/dbraw/zinc/81/44/45/935814445.db2.gz ZMBRFJFQNLTOFU-UHFFFAOYSA-N 0 0 351.410 3.867 20 5 FHBDRN O=C(N[C@@H]1[C@H]2CCO[C@H]2C12CCC2)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000277684614 935814841 /nfs/dbraw/zinc/81/48/41/935814841.db2.gz ADAVNIIXXNGJEP-MAODMQOUSA-N 0 0 374.440 3.781 20 5 FHBDRN Cc1cc(C(=O)N2CCN(C3CC3)c3cc(F)ccc32)cc([N+](=O)[O-])c1 ZINC000479178945 935815230 /nfs/dbraw/zinc/81/52/30/935815230.db2.gz QVGULJYRSCMWQV-UHFFFAOYSA-N 0 0 355.369 3.672 20 5 FHBDRN O=C(NCc1ccc(-n2ccnc2)cc1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000127819481 935817761 /nfs/dbraw/zinc/81/77/61/935817761.db2.gz HJOMJRBBKUEFFY-UHFFFAOYSA-N 0 0 371.784 3.756 20 5 FHBDRN CSc1ccncc1NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000611618397 935819596 /nfs/dbraw/zinc/81/95/96/935819596.db2.gz NHEJTPTYTFFQOJ-UHFFFAOYSA-N 0 0 355.322 3.565 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)Nc1cnn(-c2ccc(Cl)cc2)c1 ZINC000479241731 935820382 /nfs/dbraw/zinc/82/03/82/935820382.db2.gz JSKMBAKXTMXWDL-UHFFFAOYSA-N 0 0 356.769 3.615 20 5 FHBDRN Cc1cn(-c2ccc(F)cc2)nc1-c1nc(-c2ccc([N+](=O)[O-])cc2)no1 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FHBDRN CO[C@H](c1ccc(F)cc1)[C@H](C)Nc1ncnc2ccc([N+](=O)[O-])cc21 ZINC000611714379 936069986 /nfs/dbraw/zinc/06/99/86/936069986.db2.gz PTRNZHSKKDVTDC-GTNSWQLSSA-N 0 0 356.357 3.865 20 5 FHBDRN COc1ccc([C@@H](OC)[C@H](C)Nc2ncnc3ccc([N+](=O)[O-])cc32)cc1 ZINC000611714736 936078424 /nfs/dbraw/zinc/07/84/24/936078424.db2.gz ZPKDMZVDRDEXJL-SGTLLEGYSA-N 0 0 368.393 3.735 20 5 FHBDRN CC1CCN(c2ccc(NC(=O)c3ccc(N)c([N+](=O)[O-])c3)cc2)CC1 ZINC000061076636 936084775 /nfs/dbraw/zinc/08/47/75/936084775.db2.gz ZBGWORQPHXGAAB-UHFFFAOYSA-N 0 0 354.410 3.666 20 5 FHBDRN CCc1cc(NC[C@@H]2CCC[C@@H](O)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000078304471 936100078 /nfs/dbraw/zinc/10/00/78/936100078.db2.gz LLXYTUPTMVOMEA-CXAGYDPISA-N 0 0 356.426 3.577 20 5 FHBDRN COC(=O)Cc1ccccc1NC(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000187817926 936104499 /nfs/dbraw/zinc/10/44/99/936104499.db2.gz WNWDCSGBLRHBHN-UHFFFAOYSA-N 0 0 356.378 3.686 20 5 FHBDRN O=C(Nc1ccc(O[C@H]2CCCC[C@@H]2O)cc1)c1cc(F)ccc1[N+](=O)[O-] ZINC000135684437 936117114 /nfs/dbraw/zinc/11/71/14/936117114.db2.gz DXCISESPZMAUAR-ROUUACIJSA-N 0 0 374.368 3.669 20 5 FHBDRN C/C(=C\C(=O)N1CCO[C@@H](c2ccc(F)cc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000785150972 936121183 /nfs/dbraw/zinc/12/11/83/936121183.db2.gz NAHXYXUZLDHAEY-XYDKVEKUSA-N 0 0 370.380 3.737 20 5 FHBDRN Cc1cn2c(n1)CN(Cc1ccc(-c3ccc([N+](=O)[O-])cc3)s1)CC2 ZINC000611983759 936121843 /nfs/dbraw/zinc/12/18/43/936121843.db2.gz HUUHOYXOGGZZAF-UHFFFAOYSA-N 0 0 354.435 3.844 20 5 FHBDRN Cc1c(CC(=O)Nc2c(F)cccc2Br)cccc1[N+](=O)[O-] ZINC000439980867 945145792 /nfs/dbraw/zinc/14/57/92/945145792.db2.gz FTDYOQSKDZKTME-UHFFFAOYSA-N 0 0 367.174 3.986 20 5 FHBDRN O=C(Nc1scnc1C1CC1)c1c(Br)cccc1[N+](=O)[O-] ZINC001267186512 936139396 /nfs/dbraw/zinc/13/93/96/936139396.db2.gz FCCMYQZLFWQXJV-UHFFFAOYSA-N 0 0 368.212 3.944 20 5 FHBDRN Cc1c(Br)cc(C(=O)N[C@H](C)c2ccccn2)cc1[N+](=O)[O-] ZINC000178670963 936139594 /nfs/dbraw/zinc/13/95/94/936139594.db2.gz ICLMDDKJLDNVMR-SNVBAGLBSA-N 0 0 364.199 3.552 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N(Cc1cccc(Cl)c1)C(C)C ZINC000061139775 936148150 /nfs/dbraw/zinc/14/81/50/936148150.db2.gz KNEJRCULNYUUBJ-UHFFFAOYSA-N 0 0 364.833 3.580 20 5 FHBDRN CNC(=O)c1ccc(N2C[C@@H](C)C[C@H]2c2cccc(F)c2)c([N+](=O)[O-])c1 ZINC000078450452 936158756 /nfs/dbraw/zinc/15/87/56/936158756.db2.gz JXRRRVOACAWCHI-SJCJKPOMSA-N 0 0 357.385 3.681 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CCCCCNC(=O)OC(C)(C)C ZINC000121947270 936170485 /nfs/dbraw/zinc/17/04/85/936170485.db2.gz XATRALNRLCCLSY-UHFFFAOYSA-N 0 0 365.430 3.927 20 5 FHBDRN CC(C)(C)OC(=O)NC/C=C\CNc1ccc([N+](=O)[O-])c(OC(F)F)c1 ZINC000588551830 936172730 /nfs/dbraw/zinc/17/27/30/936172730.db2.gz YIAVGMZYSRGHFS-PLNGDYQASA-N 0 0 373.356 3.689 20 5 FHBDRN CC[C@@](C)(NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)c1nc(C)cs1 ZINC000135735279 936177751 /nfs/dbraw/zinc/17/77/51/936177751.db2.gz ZBSOEFRRXOVCQN-GOSISDBHSA-N 0 0 372.450 3.825 20 5 FHBDRN C[C@H](c1ccccc1)N1CC(=O)N([C@@H](C)c2ccccc2[N+](=O)[O-])C1=O ZINC000277931254 936206184 /nfs/dbraw/zinc/20/61/84/936206184.db2.gz QSSWDGPQDCRZBD-KGLIPLIRSA-N 0 0 353.378 3.681 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)[C@H](O)c1ccccc1Cl ZINC000161426251 936210914 /nfs/dbraw/zinc/21/09/14/936210914.db2.gz PAUOROVVGQRGJH-QGZVFWFLSA-N 0 0 362.813 3.719 20 5 FHBDRN CC[NH+](CC)[C@H](CNc1cc(C)c([N+](=O)[O-])c(C(=O)[O-])c1)c1ccco1 ZINC000582847370 936212577 /nfs/dbraw/zinc/21/25/77/936212577.db2.gz LPOAKLWFZMCCAA-OAHLLOKOSA-N 0 0 361.398 3.689 20 5 FHBDRN COc1ccc2c(c1)CC[C@@H](NC(=O)Nc1cccc([N+](=O)[O-])c1C)C2 ZINC000612292448 936214348 /nfs/dbraw/zinc/21/43/48/936214348.db2.gz YXVDBAALDWOULO-OAHLLOKOSA-N 0 0 355.394 3.591 20 5 FHBDRN COC(=O)c1cc(C)nc(N[C@H]2C[C@H](c3ccc(F)cc3)C2)c1[N+](=O)[O-] ZINC000431498037 936218664 /nfs/dbraw/zinc/21/86/64/936218664.db2.gz ZPGAFXWZBMOXJR-MQMHXKEQSA-N 0 0 359.357 3.582 20 5 FHBDRN CCn1c(Cc2ccccc2)nnc1Sc1ncc(C)cc1[N+](=O)[O-] ZINC000078627904 936221755 /nfs/dbraw/zinc/22/17/55/936221755.db2.gz PBPURWSOYAVVJT-UHFFFAOYSA-N 0 0 355.423 3.652 20 5 FHBDRN O=[N+]([O-])c1cncc(Br)c1N[C@@H]1CCc2c1cccc2O ZINC000091485223 936227892 /nfs/dbraw/zinc/22/78/92/936227892.db2.gz NESFNABVAFZJEJ-LLVKDONJSA-N 0 0 350.172 3.557 20 5 FHBDRN O=[N+]([O-])c1ccc(CN2CCC[C@H](n3ccc(C(F)(F)F)n3)C2)c(F)c1 ZINC000582866003 936239175 /nfs/dbraw/zinc/23/91/75/936239175.db2.gz QOVXWVMYIODNOF-ZDUSSCGKSA-N 0 0 372.322 3.786 20 5 FHBDRN O=[N+]([O-])c1ccc(Nc2cccc(C[S@](=O)C3CCOCC3)c2)cc1 ZINC000091483373 936240238 /nfs/dbraw/zinc/24/02/38/936240238.db2.gz SAKQZRPSXMPUJY-RUZDIDTESA-N 0 0 360.435 3.766 20 5 FHBDRN Cc1cc(Br)ccc1CNc1ncnc2cccc([N+](=O)[O-])c21 ZINC000612444454 936241420 /nfs/dbraw/zinc/24/14/20/936241420.db2.gz VKYYSVKVTHTAFP-UHFFFAOYSA-N 0 0 373.210 3.643 20 5 FHBDRN O=C(Cn1ccc([N+](=O)[O-])n1)Nc1ccc(Oc2cccc(Cl)c2)cc1 ZINC000061261187 936250835 /nfs/dbraw/zinc/25/08/35/936250835.db2.gz RREBVWHORILXAO-UHFFFAOYSA-N 0 0 372.768 3.876 20 5 FHBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC(C)(C)C1 ZINC000135836971 936270149 /nfs/dbraw/zinc/27/01/49/936270149.db2.gz QOWIBNROIOVTFK-UHFFFAOYSA-N 0 0 352.456 3.594 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NCCOc1cccc(F)c1 ZINC000135841253 936270604 /nfs/dbraw/zinc/27/06/04/936270604.db2.gz ZCVSQUCJTYQSAC-UHFFFAOYSA-N 0 0 364.398 3.655 20 5 FHBDRN C[C@@H](C(=O)N[C@H]1CCN(c2ccc(Cl)cc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000516696897 945153138 /nfs/dbraw/zinc/15/31/38/945153138.db2.gz HYTFIWSFXJQGKO-CJNGLKHVSA-N 0 0 373.840 3.747 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](C)C[C@H](O)c2ccccc2)c1 ZINC000161659813 936280950 /nfs/dbraw/zinc/28/09/50/936280950.db2.gz JXUSZCLLAOFITI-SJCJKPOMSA-N 0 0 360.435 3.559 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)C[C@@H](O)c2ccccc2)c1 ZINC000161660186 936281466 /nfs/dbraw/zinc/28/14/66/936281466.db2.gz JXUSZCLLAOFITI-SJKOYZFVSA-N 0 0 360.435 3.559 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NCC(C)(C)C1=CCCCC1 ZINC000572893777 936290288 /nfs/dbraw/zinc/29/02/88/936290288.db2.gz WYLHJAQMSPVMFU-UHFFFAOYSA-N 0 0 373.453 3.739 20 5 FHBDRN CCOc1cccc([C@@H]2C[C@H]2NC(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)c1 ZINC000437231622 945154032 /nfs/dbraw/zinc/15/40/32/945154032.db2.gz IMUWVTSOTAVPFX-WMLDXEAASA-N 0 0 365.389 3.761 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)Nc2ccc3ncccc3c2)c1 ZINC000582933193 936305490 /nfs/dbraw/zinc/30/54/90/936305490.db2.gz HZLLSGRPHYVFQK-UHFFFAOYSA-N 0 0 357.391 3.561 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(C)[C@H](C)C1CCCCC1 ZINC000582935169 936306716 /nfs/dbraw/zinc/30/67/16/936306716.db2.gz CCCFWQBQOAIJBB-CYBMUJFWSA-N 0 0 361.442 3.523 20 5 FHBDRN CCc1cccc2c1OCC[C@@H]2Nc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 ZINC000506735235 945159931 /nfs/dbraw/zinc/15/99/31/945159931.db2.gz WWBJMCITSRDGRW-HNNXBMFYSA-N 0 0 367.405 3.978 20 5 FHBDRN COCc1cccc2sc(NC(=O)c3ccc([N+](=O)[O-])cc3C)nc21 ZINC000519134421 945161225 /nfs/dbraw/zinc/16/12/25/945161225.db2.gz YKIDEZHSAAATCT-UHFFFAOYSA-N 0 0 357.391 3.912 20 5 FHBDRN CC(C)Oc1ccc(Nc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])cc1 ZINC000052361165 938258758 /nfs/dbraw/zinc/25/87/58/938258758.db2.gz XVKVTKXVTXSUEV-UHFFFAOYSA-N 0 0 350.396 3.529 20 5 FHBDRN CC(C)(C(=O)NCCc1c[nH]c2ccc(F)cc12)c1ccc([N+](=O)[O-])cc1 ZINC000583469271 938264285 /nfs/dbraw/zinc/26/42/85/938264285.db2.gz FIYWLSHPULASDF-UHFFFAOYSA-N 0 0 369.396 3.852 20 5 FHBDRN O=C(c1cnc(-c2ccco2)s1)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000536042530 938269956 /nfs/dbraw/zinc/26/99/56/938269956.db2.gz SZUFOMHNDPYQDU-UHFFFAOYSA-N 0 0 355.375 3.510 20 5 FHBDRN CCCN(C)c1ccc(C(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)cc1 ZINC000536042428 938271496 /nfs/dbraw/zinc/27/14/96/938271496.db2.gz VIOSIJWUEIRDRW-UHFFFAOYSA-N 0 0 353.422 3.640 20 5 FHBDRN CCc1cccc2c1OCC[C@@H]2NC(=O)[C@@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1 ZINC001125663035 938271816 /nfs/dbraw/zinc/27/18/16/938271816.db2.gz WKLTWEZKKDQZBC-QRVBRYPASA-N 0 0 366.417 3.901 20 5 FHBDRN Cc1cc(NC(=O)N2CC3(CCC3)[C@H]2C2CCOCC2)ccc1[N+](=O)[O-] ZINC000583496559 938277819 /nfs/dbraw/zinc/27/78/19/938277819.db2.gz XBXJOPPJFIZSNA-QGZVFWFLSA-N 0 0 359.426 3.716 20 5 FHBDRN COC1CCC(C)(CNC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000472289748 938281923 /nfs/dbraw/zinc/28/19/23/938281923.db2.gz CXUXQCXEYRXEHG-UHFFFAOYSA-N 0 0 363.458 3.724 20 5 FHBDRN Cc1cccc(C2(CNC(=O)COc3cccc([N+](=O)[O-])c3)CCCC2)c1 ZINC001125668087 938282227 /nfs/dbraw/zinc/28/22/27/938282227.db2.gz ANEYUQXDKOWOGY-UHFFFAOYSA-N 0 0 368.433 3.910 20 5 FHBDRN Cc1nc(C(F)(F)F)ccc1C(=O)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000536063291 938295739 /nfs/dbraw/zinc/29/57/39/938295739.db2.gz LULVJURINCTDKE-UHFFFAOYSA-N 0 0 365.311 3.516 20 5 FHBDRN Cc1cc(C)cc(C2(C(=O)N3CCc4c(cccc4[N+](=O)[O-])C3)CC2)c1 ZINC000536064692 938297289 /nfs/dbraw/zinc/29/72/89/938297289.db2.gz GEWKXGRYNSGDIT-UHFFFAOYSA-N 0 0 350.418 3.828 20 5 FHBDRN Cc1c(Br)c(NCCC2SCCS2)ncc1[N+](=O)[O-] ZINC000693784538 938300889 /nfs/dbraw/zinc/30/08/89/938300889.db2.gz OXRGIXVSKWDRQZ-UHFFFAOYSA-N 0 0 364.290 3.669 20 5 FHBDRN O=C(Nc1cccc(C(F)F)c1)c1cc2c(cc1[N+](=O)[O-])OCCCO2 ZINC001125677156 938303743 /nfs/dbraw/zinc/30/37/43/938303743.db2.gz MGADFBIGRJINSI-UHFFFAOYSA-N 0 0 364.304 3.946 20 5 FHBDRN Cc1c(NC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)cnn1-c1ccccc1 ZINC000161775751 938308079 /nfs/dbraw/zinc/30/80/79/938308079.db2.gz WBGIHHQYLMERJA-UHFFFAOYSA-N 0 0 356.769 3.995 20 5 FHBDRN Cc1cc(F)cc(C(=O)N2C[C@@H](c3ccccc3)O[C@@H](C)C2)c1[N+](=O)[O-] ZINC000176788166 938308997 /nfs/dbraw/zinc/30/89/97/938308997.db2.gz VPVLFXSNTBLADK-GUYCJALGSA-N 0 0 358.369 3.645 20 5 FHBDRN C[C@H](C(=O)N(C)CCc1ccccc1[N+](=O)[O-])c1cn(C)c2ccccc12 ZINC000583581179 938309005 /nfs/dbraw/zinc/30/90/05/938309005.db2.gz BWEVCWKUJHZHQI-HNNXBMFYSA-N 0 0 365.433 3.891 20 5 FHBDRN O=C(Nc1cccc(CNc2ccc([N+](=O)[O-])cn2)c1)c1ccc(F)cc1 ZINC000052489232 938336457 /nfs/dbraw/zinc/33/64/57/938336457.db2.gz OWTBCOOESOXZIL-UHFFFAOYSA-N 0 0 366.352 3.993 20 5 FHBDRN Cc1nc(C)c([C@H](C)N(C)C(=O)NCCc2ccccc2[N+](=O)[O-])s1 ZINC000075108876 938342062 /nfs/dbraw/zinc/34/20/62/938342062.db2.gz PIWOMIIZHFENEW-LBPRGKRZSA-N 0 0 362.455 3.613 20 5 FHBDRN CC(C)Oc1cc(N[C@H](C)CCc2ccccc2[N+](=O)[O-])ccc1C(N)=O ZINC000437243272 945166649 /nfs/dbraw/zinc/16/66/49/945166649.db2.gz HPXHBQAISQJJKW-CQSZACIVSA-N 0 0 371.437 3.914 20 5 FHBDRN CCOc1ncc(-c2nc(Cc3ccccc3[N+](=O)[O-])no2)cc1Cl ZINC000583665000 938348406 /nfs/dbraw/zinc/34/84/06/938348406.db2.gz AMVMHXQGDSSNLZ-UHFFFAOYSA-N 0 0 360.757 3.683 20 5 FHBDRN COc1ccc(OCCSCCOc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000437252252 945168382 /nfs/dbraw/zinc/16/83/82/945168382.db2.gz DZIWKIFBYKQJSH-UHFFFAOYSA-N 0 0 367.398 3.934 20 5 FHBDRN CCc1noc(CC)c1CC(=O)Nc1cc(C)nc2ccc([N+](=O)[O-])cc21 ZINC000161832316 938363814 /nfs/dbraw/zinc/36/38/14/938363814.db2.gz PZGWZBGMTWKEHT-UHFFFAOYSA-N 0 0 368.393 3.745 20 5 FHBDRN CC(C)(C(=O)N1CC(C)(C)c2c1cccc2Cl)n1cc([N+](=O)[O-])cn1 ZINC000102246983 938368318 /nfs/dbraw/zinc/36/83/18/938368318.db2.gz YCHIWMIIUNNAMT-UHFFFAOYSA-N 0 0 362.817 3.504 20 5 FHBDRN COc1ccc([C@H](C)OC(=O)c2cc3c(cc2[N+](=O)[O-])OCCCO3)cc1 ZINC001267286602 938374005 /nfs/dbraw/zinc/37/40/05/938374005.db2.gz MCTFRMWWMNGXLO-LBPRGKRZSA-N 0 0 373.361 3.683 20 5 FHBDRN Cc1c(Br)c(=O)n(Cc2sccc2Cl)cc1[N+](=O)[O-] ZINC000506416280 945169319 /nfs/dbraw/zinc/16/93/19/945169319.db2.gz MPHCKBYOTNNUPD-UHFFFAOYSA-N 0 0 363.620 3.591 20 5 FHBDRN CC[C@H](CCO)NC(=O)c1cc([N+](=O)[O-])ccc1SC1CCCC1 ZINC000161854532 938379794 /nfs/dbraw/zinc/37/97/94/938379794.db2.gz ZDBUVADPBZDMON-GFCCVEGCSA-N 0 0 352.456 3.520 20 5 FHBDRN O=[N+]([O-])c1cccc(Cl)c1N1CCC(Oc2ncccc2F)CC1 ZINC000432136323 945171173 /nfs/dbraw/zinc/17/11/73/945171173.db2.gz CCIRNLWBPACLCY-UHFFFAOYSA-N 0 0 351.765 3.830 20 5 FHBDRN CCCC(=O)Nc1cccc(NC(=O)NCc2ccccc2[N+](=O)[O-])c1C ZINC000148139317 938387899 /nfs/dbraw/zinc/38/78/99/938387899.db2.gz IWYSHIWLOFDXKQ-UHFFFAOYSA-N 0 0 370.409 3.964 20 5 FHBDRN CC(C)(C)n1cc(NC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)cn1 ZINC000445183722 938389084 /nfs/dbraw/zinc/38/90/84/938389084.db2.gz DSUBBIBQBKMMCL-UHFFFAOYSA-N 0 0 360.417 3.885 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000278420172 938407658 /nfs/dbraw/zinc/40/76/58/938407658.db2.gz CDCJZRHSVNPEJV-RDJZCZTQSA-N 0 0 358.369 3.692 20 5 FHBDRN Cc1ccc(CN(C(=O)CN(C)Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000052589645 938417407 /nfs/dbraw/zinc/41/74/07/938417407.db2.gz OWQVWUFTUBLCNY-UHFFFAOYSA-N 0 0 367.449 3.526 20 5 FHBDRN CCS[C@H]1CCCC[C@H]1NC(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000427204032 945174301 /nfs/dbraw/zinc/17/43/01/945174301.db2.gz LNQSBJOCMGLAST-CABCVRRESA-N 0 0 354.497 3.867 20 5 FHBDRN CNC(=O)c1ccc(N2CC[C@H](c3cccc(Cl)c3)C2)c([N+](=O)[O-])c1 ZINC000432138770 945175839 /nfs/dbraw/zinc/17/58/39/945175839.db2.gz YFVTUSRAVDUKRG-AWEZNQCLSA-N 0 0 359.813 3.602 20 5 FHBDRN O=[N+]([O-])c1c(N[C@@H](C[C@H]2CCOC2)c2ccccc2)nc2sccn21 ZINC000157962942 938455682 /nfs/dbraw/zinc/45/56/82/938455682.db2.gz WQNLYRCIUKWMJO-OCCSQVGLSA-N 0 0 358.423 3.884 20 5 FHBDRN C[C@H](NC(=O)c1ccc(F)cc1[N+](=O)[O-])c1nc(-c2ccncc2)cs1 ZINC000135446722 938463855 /nfs/dbraw/zinc/46/38/55/938463855.db2.gz GLZBVXZAZDWGKJ-JTQLQIEISA-N 0 0 372.381 3.743 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(C(=O)N[C@@H]2CCOC3(CCCCC3)C2)c1F ZINC000278491206 938477265 /nfs/dbraw/zinc/47/72/65/938477265.db2.gz YVEXKRHVKLFDRO-CYBMUJFWSA-N 0 0 350.390 3.654 20 5 FHBDRN CC(C)C[C@@H](C)Oc1cc(CNC(=O)Cc2ccccc2[N+](=O)[O-])ccn1 ZINC000110949441 945179576 /nfs/dbraw/zinc/17/95/76/945179576.db2.gz ZCECAYVCLGMZBN-OAHLLOKOSA-N 0 0 371.437 3.662 20 5 FHBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1ncncc1OC ZINC000583942964 938493846 /nfs/dbraw/zinc/49/38/46/938493846.db2.gz SULYCJDKGBNSEO-UHFFFAOYSA-N 0 0 362.411 3.538 20 5 FHBDRN CCN(CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)[C@@H](C)c1cccc(OC)c1 ZINC000052706031 938504330 /nfs/dbraw/zinc/50/43/30/938504330.db2.gz MKJKKBOCEZINNG-HNNXBMFYSA-N 0 0 371.437 3.649 20 5 FHBDRN COc1cc(Cc2noc(-c3cscc3C)n2)c([N+](=O)[O-])c(OC)c1 ZINC000583973853 938511649 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Cc1c(CC(=O)NCc2ccc(OC(F)F)c(F)c2)cccc1[N+](=O)[O-] ZINC000511284464 938984489 /nfs/dbraw/zinc/98/44/89/938984489.db2.gz DJMXUTYMPHERSJ-UHFFFAOYSA-N 0 0 368.311 3.503 20 5 FHBDRN CCCN(Cc1ccccc1F)c1sc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000611921239 938986392 /nfs/dbraw/zinc/98/63/92/938986392.db2.gz FUMIFVPVLVOPLI-UHFFFAOYSA-N 0 0 372.443 3.616 20 5 FHBDRN COc1ccc([C@H](C)NC(=O)c2ccc(SC)c([N+](=O)[O-])c2)cc1F ZINC000024314060 938991821 /nfs/dbraw/zinc/99/18/21/938991821.db2.gz WLNZPXOJFQBFQD-JTQLQIEISA-N 0 0 364.398 3.955 20 5 FHBDRN Cc1ccc(C(=O)N2CCN(Cc3ccc([N+](=O)[O-])cc3Cl)CC2)cc1 ZINC000543856489 938993348 /nfs/dbraw/zinc/99/33/48/938993348.db2.gz GIXOKOYXADBUKV-UHFFFAOYSA-N 0 0 373.840 3.515 20 5 FHBDRN COC(=O)c1cnc(N[C@H]2CC[C@@H](c3ccc(F)cc3)C2)c([N+](=O)[O-])c1 ZINC000480572477 938994714 /nfs/dbraw/zinc/99/47/14/938994714.db2.gz BGDPCNDTBQVXSD-DOMZBBRYSA-N 0 0 359.357 3.664 20 5 FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N(C)[C@@H]1CCC[C@@H](C)C1 ZINC000179238309 938996452 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FHBDRN C[C@@H](C(=O)NC(C)(C)COCc1ccccc1)c1ccc([N+](=O)[O-])cc1F ZINC000409893035 939003555 /nfs/dbraw/zinc/00/35/55/939003555.db2.gz RZAXHBGRFPKZHG-CQSZACIVSA-N 0 0 374.412 3.949 20 5 FHBDRN O=C([C@H]1CC(c2ccccc2[N+](=O)[O-])=NO1)N(CC1CC1)C1CCCCC1 ZINC001125769734 939004608 /nfs/dbraw/zinc/00/46/08/939004608.db2.gz IBDOOZLSNQKUQX-LJQANCHMSA-N 0 0 371.437 3.659 20 5 FHBDRN CCN(CCc1ccccc1)C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000065724985 939006756 /nfs/dbraw/zinc/00/67/56/939006756.db2.gz JZGNKCDWSMSREC-UHFFFAOYSA-N 0 0 351.406 3.641 20 5 FHBDRN COc1cccc2c1N(C(=O)Cn1ccc3cc([N+](=O)[O-])ccc31)CCC2 ZINC000065725726 939007079 /nfs/dbraw/zinc/00/70/79/939007079.db2.gz XXODXVRXOKTQRQ-UHFFFAOYSA-N 0 0 365.389 3.538 20 5 FHBDRN COC(=O)c1cc(NC(=O)c2cc(C)n(C(C)C)c2C)cc([N+](=O)[O-])c1 ZINC000136151617 939009014 /nfs/dbraw/zinc/00/90/14/939009014.db2.gz ZRCVXPQHJRXJIP-UHFFFAOYSA-N 0 0 359.382 3.633 20 5 FHBDRN CCOc1cccc2[nH]cc(CC(=O)Nc3cc([N+](=O)[O-])ccc3C)c21 ZINC000188008983 939016838 /nfs/dbraw/zinc/01/68/38/939016838.db2.gz JMFOFYQLIPLSJA-UHFFFAOYSA-N 0 0 353.378 3.964 20 5 FHBDRN CCOc1cccc2[nH]cc(CC(=O)Nc3cccc([N+](=O)[O-])c3C)c21 ZINC000188010467 939016846 /nfs/dbraw/zinc/01/68/46/939016846.db2.gz YYYUVUQSGHQXER-UHFFFAOYSA-N 0 0 353.378 3.964 20 5 FHBDRN CC(C)c1ccc(C(=O)N(C)[C@@H]2CCCc3c2cnn3C)cc1[N+](=O)[O-] ZINC000188064056 939017537 /nfs/dbraw/zinc/01/75/37/939017537.db2.gz ZTVFCBRLUFKJEW-MRXNPFEDSA-N 0 0 356.426 3.601 20 5 FHBDRN CNC(=O)Nc1cccc(NC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)c1 ZINC000188094651 939018442 /nfs/dbraw/zinc/01/84/42/939018442.db2.gz GNMAHYCFEZCMHI-UHFFFAOYSA-N 0 0 356.382 3.722 20 5 FHBDRN O=C(/C=C\c1ccnc(Cl)c1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000255641259 939023200 /nfs/dbraw/zinc/02/32/00/939023200.db2.gz WPHSASAYCMCTIZ-BAQGIRSFSA-N 0 0 357.797 3.848 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1OCC(=O)Nc1c(C)cc(C)cc1Cl ZINC000506752192 945221157 /nfs/dbraw/zinc/22/11/57/945221157.db2.gz SCNIYFFTSVFJGZ-UHFFFAOYSA-N 0 0 364.785 3.891 20 5 FHBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1COc1ccc2c(c1)NC(=O)CC2 ZINC000440077524 945221205 /nfs/dbraw/zinc/22/12/05/945221205.db2.gz LWGMAPUGNLQOGT-UHFFFAOYSA-N 0 0 356.378 3.846 20 5 FHBDRN CSc1ccc(CNC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)cc1 ZINC000065758960 939041809 /nfs/dbraw/zinc/04/18/09/939041809.db2.gz YMSUVPSGKKLWNC-UHFFFAOYSA-N 0 0 357.435 3.821 20 5 FHBDRN CSc1cccc(C(=O)N2CCO[C@@H](c3ccsc3)C2)c1[N+](=O)[O-] ZINC000188207627 939046232 /nfs/dbraw/zinc/04/62/32/939046232.db2.gz FPJXXGVEZIACJD-CYBMUJFWSA-N 0 0 364.448 3.592 20 5 FHBDRN Cc1cc(N2CCC([C@@H]3CCOC3)CC2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000612099192 939059123 /nfs/dbraw/zinc/05/91/23/939059123.db2.gz AAUOLWRPGGJCSP-QGZVFWFLSA-N 0 0 368.437 3.613 20 5 FHBDRN COc1ccc2cccc(CC(=O)N3CCc4c3cccc4[N+](=O)[O-])c2c1 ZINC000179281438 939061239 /nfs/dbraw/zinc/06/12/39/939061239.db2.gz AOTFSQHAVIYRDO-UHFFFAOYSA-N 0 0 362.385 3.888 20 5 FHBDRN CC1(C)CN(C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)c2ccccc2O1 ZINC000179328692 939086449 /nfs/dbraw/zinc/08/64/49/939086449.db2.gz WFOMIUGHAOXEPG-UHFFFAOYSA-N 0 0 365.389 3.823 20 5 FHBDRN COc1ccc(C[C@H](C)C(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000179365874 939097294 /nfs/dbraw/zinc/09/72/94/939097294.db2.gz WQCYYXTUVDQBNH-HNNXBMFYSA-N 0 0 368.433 3.973 20 5 FHBDRN CC[C@H](CNC(=O)c1ccc([N+](=O)[O-])[nH]1)Oc1ccccc1C(F)(F)F ZINC000440082649 945227672 /nfs/dbraw/zinc/22/76/72/945227672.db2.gz WNAJVRJFKLNXCM-SNVBAGLBSA-N 0 0 371.315 3.529 20 5 FHBDRN CCN(C(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1)[C@H](C)c1cc2ccccc2o1 ZINC000188272061 939126051 /nfs/dbraw/zinc/12/60/51/939126051.db2.gz DWDNJUHUQBKLMS-LLVKDONJSA-N 0 0 355.350 3.665 20 5 FHBDRN COc1cccc(Cl)c1CNC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000188284934 939133806 /nfs/dbraw/zinc/13/38/06/939133806.db2.gz GEQIHNHTVKXQGH-UHFFFAOYSA-N 0 0 355.177 3.840 20 5 FHBDRN O=C(O[C@@H]1COc2cc(Cl)ccc21)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000785214985 939139621 /nfs/dbraw/zinc/13/96/21/939139621.db2.gz NEUWCCNBNLFFPB-CQSZACIVSA-N 0 0 355.680 3.817 20 5 FHBDRN Cc1ccc(CN(Cc2ccco2)C(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)s1 ZINC000188296224 939150350 /nfs/dbraw/zinc/15/03/50/939150350.db2.gz KLZMNNQJGYQNHT-UHFFFAOYSA-N 0 0 373.390 3.501 20 5 FHBDRN O=C(NCCc1ccc[nH]1)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000135870565 939162323 /nfs/dbraw/zinc/16/23/23/939162323.db2.gz OOJWCLOQDMALLZ-UHFFFAOYSA-N 0 0 350.378 3.639 20 5 FHBDRN O=[N+]([O-])c1ccc2ncnc(NCc3sccc3Br)c2c1 ZINC000148359616 939179631 /nfs/dbraw/zinc/17/96/31/939179631.db2.gz INFCSFAADGYMFP-UHFFFAOYSA-N 0 0 365.212 3.974 20 5 FHBDRN CCCCc1oc2ccccc2c1CN(C)C(=O)c1c([N+](=O)[O-])cnn1C ZINC000179507792 939193006 /nfs/dbraw/zinc/19/30/06/939193006.db2.gz ZWKRHKRILDKERK-UHFFFAOYSA-N 0 0 370.409 3.689 20 5 FHBDRN O=C(OCCCCC(F)(F)F)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000179510412 939219531 /nfs/dbraw/zinc/21/95/31/939219531.db2.gz XVEXYWVYTKOXRT-UHFFFAOYSA-N 0 0 357.288 3.670 20 5 FHBDRN O=C(CCn1cc([N+](=O)[O-])cn1)Nc1ccccc1Oc1cccc(F)c1 ZINC000065812807 939223838 /nfs/dbraw/zinc/22/38/38/939223838.db2.gz ACSIJXKFWKUSKN-UHFFFAOYSA-N 0 0 370.340 3.752 20 5 FHBDRN CC(C)CN(C(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C1CCCC1 ZINC000437318517 945237614 /nfs/dbraw/zinc/23/76/14/945237614.db2.gz ZZEZNNPKZWDKCH-UHFFFAOYSA-N 0 0 367.833 3.614 20 5 FHBDRN Cc1ccc2c(c1)CC[C@@H]2NS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000516786251 945239365 /nfs/dbraw/zinc/23/93/65/945239365.db2.gz YBSPNDZSUAVCGV-AWEZNQCLSA-N 0 0 366.826 3.522 20 5 FHBDRN Nc1c(C(=O)N[C@@H]2C[C@H]2c2ccc3ccccc3c2)cc(F)cc1[N+](=O)[O-] ZINC000437309061 945243716 /nfs/dbraw/zinc/24/37/16/945243716.db2.gz VIIQOICLVFUGBL-DOTOQJQBSA-N 0 0 365.364 3.755 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2ccc(CNc3ccc(OC(F)F)cn3)o2)c1 ZINC000427274077 945244810 /nfs/dbraw/zinc/24/48/10/945244810.db2.gz OSRKQLIZQVAMFA-UHFFFAOYSA-N 0 0 361.304 3.885 20 5 FHBDRN Cc1ccc2c(c1)nc(CNC(=O)c1c(C)cc(Cl)cc1[N+](=O)[O-])n2C ZINC000438940454 945245627 /nfs/dbraw/zinc/24/56/27/945245627.db2.gz CBBPMTYTWAAJGI-UHFFFAOYSA-N 0 0 372.812 3.682 20 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945259034 /nfs/dbraw/zinc/25/90/34/945259034.db2.gz WSKRVONBGGTXMX-UHFFFAOYSA-N 0 0 364.785 3.850 20 5 FHBDRN O=[N+]([O-])c1ccc(OC(F)F)c(CN2CCC=C(c3ccncc3)C2)c1 ZINC000518258521 945261778 /nfs/dbraw/zinc/26/17/78/945261778.db2.gz LEPJASJGRPVXHY-UHFFFAOYSA-N 0 0 361.348 3.881 20 5 FHBDRN CCc1nc2ccccc2n1C1CCN(c2ccc([N+](=O)[O-])cn2)CC1 ZINC000092961374 945266036 /nfs/dbraw/zinc/26/60/36/945266036.db2.gz WUXNATMHEWHHHL-UHFFFAOYSA-N 0 0 351.410 3.743 20 5 FHBDRN CCCCCOC1CN(C(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C1 ZINC000437354240 945266529 /nfs/dbraw/zinc/26/65/29/945266529.db2.gz LFXDDLQOVYAUIR-UHFFFAOYSA-N 0 0 360.332 3.645 20 5 FHBDRN CCc1ccc(-c2nc(C3(NC(C)=O)CCCCC3)no2)cc1[N+](=O)[O-] ZINC000545602574 945270053 /nfs/dbraw/zinc/27/00/53/945270053.db2.gz ZHAUDENWRQFMPD-UHFFFAOYSA-N 0 0 358.398 3.503 20 5 FHBDRN CCc1n[nH]c(C(=O)N2CCCC[C@@H]2c2cc3ccccc3[nH]2)c1[N+](=O)[O-] ZINC000188446457 939877589 /nfs/dbraw/zinc/87/75/89/939877589.db2.gz YBLYPACBRYPSKA-MRXNPFEDSA-N 0 0 367.409 3.729 20 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FHBDRN COCc1ccccc1-c1noc(Cc2c[nH]c3ccc([N+](=O)[O-])cc23)n1 ZINC000612902782 940335432 /nfs/dbraw/zinc/33/54/32/940335432.db2.gz SPOCTVCLPQXVIB-UHFFFAOYSA-N 0 0 364.361 3.863 20 5 FHBDRN CC1(C)SC[C@@H]1Nc1cc(C(F)(F)C(F)(F)F)ncc1[N+](=O)[O-] ZINC000548964595 940336214 /nfs/dbraw/zinc/33/62/14/940336214.db2.gz JXNNCYQLBOHZPR-VIFPVBQESA-N 0 0 357.304 3.950 20 5 FHBDRN COc1cccc([C@@H](C)c2noc(COc3cccc([N+](=O)[O-])c3)n2)c1 ZINC000612918197 940336261 /nfs/dbraw/zinc/33/62/61/940336261.db2.gz WRNUQCHVAVNQOI-GFCCVEGCSA-N 0 0 355.350 3.717 20 5 FHBDRN C[C@H]1CCC[C@@H](c2noc(Cc3cc4c(cc3[N+](=O)[O-])OCCO4)n2)C1 ZINC000612911161 940337468 /nfs/dbraw/zinc/33/74/68/940337468.db2.gz BMUFYRIHNGPMAN-NWDGAFQWSA-N 0 0 359.382 3.634 20 5 FHBDRN O=[N+]([O-])c1ccc(-n2cc(-c3nc([C@@H]4CCc5ccccc54)no3)cn2)cc1 ZINC000612933083 940344355 /nfs/dbraw/zinc/34/43/55/940344355.db2.gz LNLABWSNQLKIJV-GOSISDBHSA-N 0 0 373.372 3.909 20 5 FHBDRN O=[N+]([O-])c1cccc(OC[C@@H](O)CSc2nc3ccccc3s2)c1 ZINC000066237209 940349168 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FHBDRN CC(=O)N(C)c1ccc(NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)cc1 ZINC000612997032 940382526 /nfs/dbraw/zinc/38/25/26/940382526.db2.gz PHDQLGNRAKNCGC-UHFFFAOYSA-N 0 0 373.384 3.633 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)NC1CC(C)(c2ccccc2)C1 ZINC000511407224 940388503 /nfs/dbraw/zinc/38/85/03/940388503.db2.gz OZCOYJYXUHJHAJ-UHFFFAOYSA-N 0 0 367.449 3.899 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)N(C2CC2)C2CC(c3ccccc3C)C2)n1 ZINC000427360188 945314667 /nfs/dbraw/zinc/31/46/67/945314667.db2.gz RKPLAYXXNWNXPC-UHFFFAOYSA-N 0 0 368.437 3.670 20 5 FHBDRN CCc1nc(C)c([C@@H](C)N(C)C(=O)c2ccc([N+](=O)[O-])cc2OC)s1 ZINC000427360327 945314706 /nfs/dbraw/zinc/31/47/06/945314706.db2.gz YVBMVOCBPPXABM-LLVKDONJSA-N 0 0 363.439 3.764 20 5 FHBDRN O=C(Nc1ccc(-c2nccs2)cc1)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000180080042 940416303 /nfs/dbraw/zinc/41/63/03/940416303.db2.gz WFCXFIXSPVRZOD-UHFFFAOYSA-N 0 0 369.358 3.699 20 5 FHBDRN CC(C)(C)C[C@@H](Nc1nccc(C(N)=O)c1[N+](=O)[O-])c1ccc(F)cc1 ZINC000580021245 940436370 /nfs/dbraw/zinc/43/63/70/940436370.db2.gz WEGVDTZXWQLVKK-CQSZACIVSA-N 0 0 360.389 3.817 20 5 FHBDRN O=C(CCc1ccc(OC(F)(F)F)cc1)NCc1ccc([N+](=O)[O-])cc1 ZINC000066330237 940439053 /nfs/dbraw/zinc/43/90/53/940439053.db2.gz CWCGQTAHFGCWBG-UHFFFAOYSA-N 0 0 368.311 3.742 20 5 FHBDRN CN(C(=O)c1ccc([N+](=O)[O-])s1)c1nc2c(s1)COc1ccccc1-2 ZINC000376190004 940442504 /nfs/dbraw/zinc/44/25/04/940442504.db2.gz WXHNQJNQCNQTOC-UHFFFAOYSA-N 0 0 373.415 3.949 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NCc2c(Cl)cccc2OC)c1 ZINC000548996495 940464499 /nfs/dbraw/zinc/46/44/99/940464499.db2.gz NCGLSYDSIQKUTH-UHFFFAOYSA-N 0 0 364.785 3.586 20 5 FHBDRN Cc1ccc(C)c(S(=O)(=O)N2CCc3cc(Cl)ccc32)c1[N+](=O)[O-] ZINC000507568846 945323105 /nfs/dbraw/zinc/32/31/05/945323105.db2.gz UKTWHZOERGAREY-UHFFFAOYSA-N 0 0 366.826 3.616 20 5 FHBDRN O=[N+]([O-])c1ccc2nc(N3CCN(c4ccc(Cl)cn4)CC3)ccc2c1 ZINC000066372590 940467964 /nfs/dbraw/zinc/46/79/64/940467964.db2.gz JDLOUIBPMCTHNB-UHFFFAOYSA-N 0 0 369.812 3.518 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1CCC[C@@H]1/C=C/c1ccccc1 ZINC000427395163 945323504 /nfs/dbraw/zinc/32/35/04/945323504.db2.gz NTVPURSCOPKLKW-ZNFPLGDCSA-N 0 0 352.390 3.921 20 5 FHBDRN C[C@H](C(=O)Nc1cn(C)nc1-c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000580299593 940472466 /nfs/dbraw/zinc/47/24/66/940472466.db2.gz OSWOHAJOCKRYIH-ZDUSSCGKSA-N 0 0 350.378 3.738 20 5 FHBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCc3cc(Cl)ccc32)c(Cl)c1 ZINC000507568601 945323576 /nfs/dbraw/zinc/32/35/76/945323576.db2.gz PWWIPWCMDVUPHG-UHFFFAOYSA-N 0 0 373.217 3.653 20 5 FHBDRN COc1cc(F)cc2sc(NC(=O)c3ccc(F)cc3[N+](=O)[O-])nc21 ZINC000128489525 945323630 /nfs/dbraw/zinc/32/36/30/945323630.db2.gz YTQAIYBPICPHQE-UHFFFAOYSA-N 0 0 365.317 3.744 20 5 FHBDRN CCOc1cccc(NCc2noc(-c3ccccc3C)n2)c1[N+](=O)[O-] ZINC000580354392 940473723 /nfs/dbraw/zinc/47/37/23/940473723.db2.gz AFGIDFJDORONFX-UHFFFAOYSA-N 0 0 354.366 3.964 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)NCC[C@H]1COc2ccccc2O1 ZINC000580368285 940474198 /nfs/dbraw/zinc/47/41/98/940474198.db2.gz GZFRVIMPFIBLSU-HNNXBMFYSA-N 0 0 371.393 3.509 20 5 FHBDRN CCN(CCCNC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000580389584 940475671 /nfs/dbraw/zinc/47/56/71/940475671.db2.gz PNJZVCLTEIEZKW-INIZCTEOSA-N 0 0 355.438 3.731 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)c1c(OC)cnc2ccccc21 ZINC000580468481 940478453 /nfs/dbraw/zinc/47/84/53/940478453.db2.gz MYZHTFSUHTZUIQ-UHFFFAOYSA-N 0 0 367.361 3.803 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N1CCCCC[C@H]1c1noc(C)n1 ZINC000580545781 940479073 /nfs/dbraw/zinc/47/90/73/940479073.db2.gz QUOUWCNYSOGTJR-INIZCTEOSA-N 0 0 373.413 3.998 20 5 FHBDRN C[C@@H](c1ccc(F)c(F)c1)N(C)c1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1 ZINC000580589667 940479965 /nfs/dbraw/zinc/47/99/65/940479965.db2.gz KGIPTSWVPNYLLS-VIFPVBQESA-N 0 0 360.320 3.719 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)NCC1CC(c2ccccc2)C1 ZINC000549003844 940480101 /nfs/dbraw/zinc/48/01/01/940480101.db2.gz PGTXUOPTKGYVBL-UHFFFAOYSA-N 0 0 353.422 3.930 20 5 FHBDRN O=[N+]([O-])c1ccc2ncnc(N[C@H]3CCO[C@@H](c4ccccc4)C3)c2c1 ZINC000613188205 940480596 /nfs/dbraw/zinc/48/05/96/940480596.db2.gz UWMBRQQFYKBDMC-KBXCAEBGSA-N 0 0 350.378 3.870 20 5 FHBDRN Cc1cc(N[C@H]2CC[N@@H+]([C@@H](C)c3ccccc3)C2)cc(C(=O)[O-])c1[N+](=O)[O-] ZINC000580650800 940481340 /nfs/dbraw/zinc/48/13/40/940481340.db2.gz ZKUDUZCUIKQDJX-HOCLYGCPSA-N 0 0 369.421 3.849 20 5 FHBDRN O=C(N[C@@H]1CCCc2occc21)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000431763713 940482272 /nfs/dbraw/zinc/48/22/72/940482272.db2.gz CPCPUFQLJBONTC-CYBMUJFWSA-N 0 0 365.183 3.758 20 5 FHBDRN Cc1cc(NC(=O)c2cc(F)c(C)cc2F)c2cc([N+](=O)[O-])ccc2n1 ZINC000613197620 940482656 /nfs/dbraw/zinc/48/26/56/940482656.db2.gz XLPRFRWQNVFZKP-UHFFFAOYSA-N 0 0 357.316 3.712 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@H](c3ccc(F)cc3)C2)c1 ZINC000549006429 940485732 /nfs/dbraw/zinc/48/57/32/940485732.db2.gz NUUMBGDVKDOHNR-AWEZNQCLSA-N 0 0 358.369 3.762 20 5 FHBDRN CNc1c(C(=O)NCCc2ccc(C(F)(F)F)cc2)cccc1[N+](=O)[O-] ZINC000613223886 940486526 /nfs/dbraw/zinc/48/65/26/940486526.db2.gz GXNPQBABDZVKQZ-UHFFFAOYSA-N 0 0 367.327 3.628 20 5 FHBDRN CCOc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2NC)cc1OCC ZINC000613223870 940486568 /nfs/dbraw/zinc/48/65/68/940486568.db2.gz FBRZZIKSJMIXQI-UHFFFAOYSA-N 0 0 359.382 3.686 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2noc(CN[C@@H]3CCCC[C@@H]3C(F)(F)F)n2)c1 ZINC000580832250 940486673 /nfs/dbraw/zinc/48/66/73/940486673.db2.gz UDOWKXSEWBOQKM-QWHCGFSZSA-N 0 0 370.331 3.856 20 5 FHBDRN CNc1c(C(=O)N2CCc3[nH]c4ccc(C)cc4c3C2)cccc1[N+](=O)[O-] ZINC000613225135 940486848 /nfs/dbraw/zinc/48/68/48/940486848.db2.gz PLIHWSBUPWKOJV-UHFFFAOYSA-N 0 0 364.405 3.625 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCOc2ccccc2C1 ZINC000613228746 940487406 /nfs/dbraw/zinc/48/74/06/940487406.db2.gz BAGYFMKSNCXEOG-INIZCTEOSA-N 0 0 354.406 3.585 20 5 FHBDRN CN(C(=O)c1ccc2nc(C(F)(F)F)cn2c1)c1ccc([N+](=O)[O-])cc1 ZINC000472526580 940488277 /nfs/dbraw/zinc/48/82/77/940488277.db2.gz ZCSCJPDTZOKQGW-UHFFFAOYSA-N 0 0 364.283 3.538 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CCc3ccc(Cl)cc3C2)c1 ZINC000549007192 940489271 /nfs/dbraw/zinc/48/92/71/940489271.db2.gz ONXKYQBFPPUSNN-UHFFFAOYSA-N 0 0 360.797 3.845 20 5 FHBDRN COc1ccc2c(c1)ncc([N+](=O)[O-])c2N1CCC[C@@H]1[C@H]1CCCOC1 ZINC000580949724 940489737 /nfs/dbraw/zinc/48/97/37/940489737.db2.gz WUNWIZOSRPXQJI-SUMWQHHRSA-N 0 0 357.410 3.547 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NC2CC(C)(c3ccccc3)C2)c1 ZINC000549012365 940496878 /nfs/dbraw/zinc/49/68/78/940496878.db2.gz IZQZPZCTGPLGAJ-UHFFFAOYSA-N 0 0 354.406 3.844 20 5 FHBDRN COc1ccc(CSCC(=O)N2CC[C@@H]3CCCC[C@@H]32)cc1[N+](=O)[O-] ZINC000581311925 940498567 /nfs/dbraw/zinc/49/85/67/940498567.db2.gz FTKUBPGLJXLBSO-GJZGRUSLSA-N 0 0 364.467 3.628 20 5 FHBDRN CCn1ncc2cc(-c3nc(-c4ccc(C)c([N+](=O)[O-])c4)no3)c(C)nc21 ZINC000581335713 940499635 /nfs/dbraw/zinc/49/96/35/940499635.db2.gz ZSGZDTRNASDEIE-UHFFFAOYSA-N 0 0 364.365 3.693 20 5 FHBDRN O=C(NCc1cccc([N+](=O)[O-])c1)Nc1ccc2c(c1)C(=O)CCCC2 ZINC000581363394 940500493 /nfs/dbraw/zinc/50/04/93/940500493.db2.gz AEKZAMWXMAFJMM-UHFFFAOYSA-N 0 0 353.378 3.826 20 5 FHBDRN C[C@H](C(=O)NC[C@@H]1CCO[C@@H]1c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000581404058 940501478 /nfs/dbraw/zinc/50/14/78/940501478.db2.gz HYCJQGBWEDRQEJ-UCLAIMLFSA-N 0 0 354.406 3.592 20 5 FHBDRN O=c1c2sccc2c(Br)cn1Cc1cccc([N+](=O)[O-])c1 ZINC000581457728 940504233 /nfs/dbraw/zinc/50/42/33/940504233.db2.gz JGYBHKZLUBQPFY-UHFFFAOYSA-N 0 0 365.208 3.782 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1[C@H](C)Cc2cc(F)ccc2[C@H]1C ZINC000427399646 945326797 /nfs/dbraw/zinc/32/67/97/945326797.db2.gz POVSQRVVHRLFSH-VXGBXAGGSA-N 0 0 358.369 3.891 20 5 FHBDRN CN(Cc1ccccc1Br)C(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000172940227 940505783 /nfs/dbraw/zinc/50/57/83/940505783.db2.gz TVKVQGGTCSIHSA-UHFFFAOYSA-N 0 0 363.211 3.558 20 5 FHBDRN COC(=O)Nc1cc(NC(=O)C=Cc2ccc([N+](=O)[O-])cc2)ccc1F ZINC000066489681 940507896 /nfs/dbraw/zinc/50/78/96/940507896.db2.gz ONSDQNNXNMKVCC-RUDMXATFSA-N 0 0 359.313 3.564 20 5 FHBDRN COCc1nc2cc(NC(=O)[C@H](C)c3cccc([N+](=O)[O-])c3)ccc2o1 ZINC000581644559 940509251 /nfs/dbraw/zinc/50/92/51/940509251.db2.gz RLMAFOHOPBFIQZ-LLVKDONJSA-N 0 0 355.350 3.625 20 5 FHBDRN O=[N+]([O-])c1cc(CN2CCO[C@@H](c3cccc(F)c3)C2)ccc1Cl ZINC000178013128 940509646 /nfs/dbraw/zinc/50/96/46/940509646.db2.gz IFXZUJBLXKVREO-QGZVFWFLSA-N 0 0 350.777 3.961 20 5 FHBDRN CSc1ccc(NC(=O)c2sc(Br)cc2[N+](=O)[O-])cn1 ZINC000581660706 940512036 /nfs/dbraw/zinc/51/20/36/940512036.db2.gz XZFFXGIVJDDVDR-UHFFFAOYSA-N 0 0 374.241 3.788 20 5 FHBDRN Cc1sc(S(=O)(=O)N2CC[C@@H](C)C[C@@H]2c2ccco2)cc1[N+](=O)[O-] ZINC000124876419 945330940 /nfs/dbraw/zinc/33/09/40/945330940.db2.gz WDHORVHUATULKJ-ZWNOBZJWSA-N 0 0 370.452 3.720 20 5 FHBDRN Cc1ccc(C(=O)N2C[C@H](c3ccccc3)OCC2(C)C)cc1[N+](=O)[O-] ZINC000066513064 940592668 /nfs/dbraw/zinc/59/26/68/940592668.db2.gz QIYIVQRQPJQDCB-GOSISDBHSA-N 0 0 354.406 3.896 20 5 FHBDRN CCOc1cc(NC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)ccc1C ZINC000066525311 940597599 /nfs/dbraw/zinc/59/75/99/940597599.db2.gz LXVSWJVKYWNGRN-UHFFFAOYSA-N 0 0 366.377 3.740 20 5 FHBDRN O=C(CSc1ccccc1[N+](=O)[O-])NCCOc1ccccc1Cl ZINC000164201274 940603969 /nfs/dbraw/zinc/60/39/69/940603969.db2.gz MTZXLYPKDDPITA-UHFFFAOYSA-N 0 0 366.826 3.536 20 5 FHBDRN COc1ccc2c(c1)C[C@H](C)N(C(=O)c1ccc([N+](=O)[O-])cc1OC)[C@@H]2C ZINC000427391338 945335164 /nfs/dbraw/zinc/33/51/64/945335164.db2.gz QEDRVSAKWFHEQP-QWHCGFSZSA-N 0 0 370.405 3.760 20 5 FHBDRN Cc1ccc([C@@H]2OCCC[C@H]2CNC(=O)c2ccc([N+](=O)[O-])cc2F)cc1 ZINC000173489551 940629198 /nfs/dbraw/zinc/62/91/98/940629198.db2.gz ZMYWNQZJCGNONF-KXBFYZLASA-N 0 0 372.396 3.940 20 5 FHBDRN CCCCN(CC(F)(F)F)C(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000581905858 940632125 /nfs/dbraw/zinc/63/21/25/940632125.db2.gz AEGSBVBFODKLQC-UHFFFAOYSA-N 0 0 354.275 3.607 20 5 FHBDRN O=C([O-])c1ccc([N+](=O)[O-])c(NC[C@H](c2ccccc2)[NH+]2CCCC2)c1 ZINC000582065578 940645088 /nfs/dbraw/zinc/64/50/88/940645088.db2.gz WYUSIOQUHXNIBQ-GOSISDBHSA-N 0 0 355.394 3.542 20 5 FHBDRN Nc1cccc([N+](=O)[O-])c1C(=O)NCc1ccc(-c2ccccc2)cc1F ZINC000582139435 940649859 /nfs/dbraw/zinc/64/98/59/940649859.db2.gz KDXRFDZACNVHLF-UHFFFAOYSA-N 0 0 365.364 3.913 20 5 FHBDRN C[C@@H](CCOCc1ccccc1)NC(=O)Nc1ccc([N+](=O)[O-])cc1F ZINC000582085574 940651976 /nfs/dbraw/zinc/65/19/76/940651976.db2.gz MKUUKZCPKPFEMO-ZDUSSCGKSA-N 0 0 361.373 3.851 20 5 FHBDRN Cc1cc(-c2nc(-c3ccnc(N4CCCC4)c3)no2)ccc1[N+](=O)[O-] ZINC000582223585 940655049 /nfs/dbraw/zinc/65/50/49/940655049.db2.gz RWLDTPYGXDZYFB-UHFFFAOYSA-N 0 0 351.366 3.615 20 5 FHBDRN COc1c(C(=O)Nc2cccc(C(=O)OC(C)(C)C)c2)cccc1[N+](=O)[O-] ZINC000582182900 940659125 /nfs/dbraw/zinc/65/91/25/940659125.db2.gz UXRDPBOLPWPRBQ-UHFFFAOYSA-N 0 0 372.377 3.811 20 5 FHBDRN C[C@H]1CN(C(=O)CSc2ccc([N+](=O)[O-])cc2)[C@H](c2ccccc2)CO1 ZINC000173671279 940659791 /nfs/dbraw/zinc/65/97/91/940659791.db2.gz XDWLLXFTGVKFMD-KSSFIOAISA-N 0 0 372.446 3.676 20 5 FHBDRN C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2Cl)[C@H](c2ccccc2)CO1 ZINC000173672515 940659897 /nfs/dbraw/zinc/65/98/97/940659897.db2.gz SONYFLUFCFCUEJ-SJCJKPOMSA-N 0 0 360.797 3.850 20 5 FHBDRN O=[N+]([O-])c1cc2c(ncnc2Sc2ccc3c(c2)OCCCO3)s1 ZINC000582377043 940662426 /nfs/dbraw/zinc/66/24/26/940662426.db2.gz OWPNCVRIUOCASP-UHFFFAOYSA-N 0 0 361.404 3.912 20 5 FHBDRN CN(CC(=O)Nc1ccccc1)C(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000047584434 945338283 /nfs/dbraw/zinc/33/82/83/945338283.db2.gz NRPSQZOSPHAWBK-UHFFFAOYSA-N 0 0 369.421 3.603 20 5 FHBDRN CC(C)C(C)(C)[N-]S(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000582394083 940668863 /nfs/dbraw/zinc/66/88/63/940668863.db2.gz SBEKNYCYTSANME-UHFFFAOYSA-N 0 0 355.243 3.615 20 5 FHBDRN CCS[C@H]1CCC[C@@H]1NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000178109106 940678563 /nfs/dbraw/zinc/67/85/63/940678563.db2.gz KEMJAIKQRAEQTM-RDJZCZTQSA-N 0 0 363.483 3.599 20 5 FHBDRN CCO[C@H]1C[C@H]1NC(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000582525819 940702852 /nfs/dbraw/zinc/70/28/52/940702852.db2.gz VKADDJMOUOEVCC-SJORKVTESA-N 0 0 357.366 3.686 20 5 FHBDRN C[C@H](CNC(=O)CSc1ccccc1[N+](=O)[O-])COCc1ccccc1 ZINC000507586461 945342238 /nfs/dbraw/zinc/34/22/38/945342238.db2.gz WVDNDNZQHAPWAT-OAHLLOKOSA-N 0 0 374.462 3.656 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@H]2CCCC[C@H]21 ZINC000180162988 940721987 /nfs/dbraw/zinc/72/19/87/940721987.db2.gz FJYBAMHFEATGOH-CVEARBPZSA-N 0 0 364.467 3.879 20 5 FHBDRN CCS[C@H]1CC[C@H](N(C)C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000174415116 940731625 /nfs/dbraw/zinc/73/16/25/940731625.db2.gz RJUQMGRZMBSKHQ-JSGCOSHPSA-N 0 0 356.875 3.923 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)NCc1ccc(C(C)(F)F)cc1 ZINC000490224498 940750717 /nfs/dbraw/zinc/75/07/17/940750717.db2.gz XUXTWWSEXROMKO-UHFFFAOYSA-N 0 0 350.321 3.645 20 5 FHBDRN CC(=O)Nc1cccc(C(=O)Nc2ccc3cc([N+](=O)[O-])ccc3n2)c1C ZINC000188652594 940769146 /nfs/dbraw/zinc/76/91/46/940769146.db2.gz NWFMJWFGBGNHLN-UHFFFAOYSA-N 0 0 364.361 3.662 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(Cc2noc([C@@H]3CCC(=O)[C@@H](C)C3(C)C)n2)c1 ZINC000582631867 940769619 /nfs/dbraw/zinc/76/96/19/940769619.db2.gz DLCNYVXMCYRNIP-RISCZKNCSA-N 0 0 373.409 3.686 20 5 FHBDRN O=[N+]([O-])c1ccccc1NCCc1noc([C@H]2CCCC(F)(F)C2)n1 ZINC000582631138 940770514 /nfs/dbraw/zinc/77/05/14/940770514.db2.gz NNZWCGQUMDBMGP-NSHDSACASA-N 0 0 352.341 3.925 20 5 FHBDRN O=C(OCc1ccc([N+](=O)[O-])cc1)c1cc(F)c(F)cc1Br ZINC000749605634 940771607 /nfs/dbraw/zinc/77/16/07/940771607.db2.gz WKZWRRDKZFDMTD-UHFFFAOYSA-N 0 0 372.121 3.993 20 5 FHBDRN CC(C)C[C@H](NC(=O)C(=O)Nc1cc(F)cc([N+](=O)[O-])c1)c1ccccc1 ZINC000472556978 940786631 /nfs/dbraw/zinc/78/66/31/940786631.db2.gz AZLPPHXXSRAUQH-KRWDZBQOSA-N 0 0 373.384 3.576 20 5 FHBDRN CC(C)COc1ccc(CC(=O)NCCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000106630249 945350161 /nfs/dbraw/zinc/35/01/61/945350161.db2.gz OQXLDGSTLWJPOZ-UHFFFAOYSA-N 0 0 356.422 3.531 20 5 FHBDRN CN(CCc1ccc(Br)cc1)C(=O)c1ccc([N+](=O)[O-])cc1 ZINC000106666844 945353017 /nfs/dbraw/zinc/35/30/17/945353017.db2.gz XGUUFJKLBUUVNA-UHFFFAOYSA-N 0 0 363.211 3.672 20 5 FHBDRN 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FHBDRN NC(=O)C[C@@H](Nc1ccc([N+](=O)[O-])cc1Cl)c1cccc(Cl)c1 ZINC000175780801 940927388 /nfs/dbraw/zinc/92/73/88/940927388.db2.gz LWGKQAARRPVEBD-CQSZACIVSA-N 0 0 354.193 3.930 20 5 FHBDRN O=C(/C=C\c1ccc(Cl)nc1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000255901269 940953554 /nfs/dbraw/zinc/95/35/54/940953554.db2.gz GQAUQEODSXNYPS-WMZJFQQLSA-N 0 0 357.797 3.848 20 5 FHBDRN C[C@@H](CCc1ccccc1[N+](=O)[O-])Nc1cccc([C@@H]2CCC(=O)N2)c1 ZINC000414320778 940966136 /nfs/dbraw/zinc/96/61/36/940966136.db2.gz SYNGZXLBGDVGNT-KSSFIOAISA-N 0 0 353.422 3.979 20 5 FHBDRN CCc1c(NC(=O)Cc2ccc([N+](=O)[O-])cc2F)cnn1CCC(C)C ZINC000427426791 945364043 /nfs/dbraw/zinc/36/40/43/945364043.db2.gz DMRHNFYYGBBBQC-UHFFFAOYSA-N 0 0 362.405 3.720 20 5 FHBDRN CC[C@@H](NC(=O)c1ccc(Br)cc1[N+](=O)[O-])c1ccncc1 ZINC000176003969 940971340 /nfs/dbraw/zinc/97/13/40/940971340.db2.gz SXCXSKXQDCISFZ-CYBMUJFWSA-N 0 0 364.199 3.633 20 5 FHBDRN Cc1n[nH]c2cc(NC(=O)c3cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c3C)ccc12 ZINC000180334637 940978468 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C[C@H](NC(=O)c1c(N)cccc1[N+](=O)[O-])c1ccc(Cl)cc1Cl ZINC000180595835 941049535 /nfs/dbraw/zinc/04/95/35/941049535.db2.gz FMPINTJFWYHAQB-QMMMGPOBSA-N 0 0 354.193 3.975 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)Nc1c(F)cc(Cl)cc1F ZINC000180662100 941060375 /nfs/dbraw/zinc/06/03/75/941060375.db2.gz AJAVXRLTDOGEEZ-UHFFFAOYSA-N 0 0 362.741 3.636 20 5 FHBDRN Cc1ccc(Oc2ccc(NC(=O)c3c(N)cccc3[N+](=O)[O-])cn2)cc1 ZINC000180666298 941061437 /nfs/dbraw/zinc/06/14/37/941061437.db2.gz ZARVRTUROOLDFR-UHFFFAOYSA-N 0 0 364.361 3.925 20 5 FHBDRN CC(C)Oc1ccc(CC[C@H](C)NC(=O)c2c(N)cccc2[N+](=O)[O-])cc1 ZINC000180679013 941063188 /nfs/dbraw/zinc/06/31/88/941063188.db2.gz JTRAESBVKYDIMS-AWEZNQCLSA-N 0 0 371.437 3.715 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1[C@H](C)SCc1nnnn1-c1ccccc1 ZINC000180686726 941064104 /nfs/dbraw/zinc/06/41/04/941064104.db2.gz FJVXSYOKWHATBE-ZDUSSCGKSA-N 0 0 355.423 3.873 20 5 FHBDRN O=C(Nc1ccc2cc([N+](=O)[O-])ccc2n1)c1cnn(Cc2ccccc2)c1 ZINC000176701007 941071978 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C[C@H](NC(=O)c1ccc(F)cc1[N+](=O)[O-])c1ccc(Br)cc1 ZINC000177045032 941095541 /nfs/dbraw/zinc/09/55/41/941095541.db2.gz FCAQAPZSCMBVHO-VIFPVBQESA-N 0 0 367.174 3.987 20 5 FHBDRN CCNc1ccc(C(=O)Nc2cc(C3CCCC3)nn2C)cc1[N+](=O)[O-] ZINC000541008061 941096648 /nfs/dbraw/zinc/09/66/48/941096648.db2.gz ONWLRIMFOJRUQK-UHFFFAOYSA-N 0 0 357.414 3.670 20 5 FHBDRN COC(=O)CC1(CNC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)CCCCC1 ZINC000472611434 941097383 /nfs/dbraw/zinc/09/73/83/941097383.db2.gz VACURKFUEWEPGU-UHFFFAOYSA-N 0 0 374.393 3.584 20 5 FHBDRN C[C@H](c1nc2ccccc2o1)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000180969316 941098353 /nfs/dbraw/zinc/09/83/53/941098353.db2.gz YFBLZVMKQCHJOO-CQSZACIVSA-N 0 0 352.394 3.619 20 5 FHBDRN C[C@@H](c1nc2ccccc2o1)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000180969296 941098389 /nfs/dbraw/zinc/09/83/89/941098389.db2.gz YFBLZVMKQCHJOO-AWEZNQCLSA-N 0 0 352.394 3.619 20 5 FHBDRN C[C@H](O)[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)C1 ZINC000181056495 941106246 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FHBDRN CC(C)CCO[C@@H]1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000177252089 941110740 /nfs/dbraw/zinc/11/07/40/941110740.db2.gz JCZCCAYSDZZZRO-CYBMUJFWSA-N 0 0 355.822 3.917 20 5 FHBDRN C[C@@H](Cc1ccccc1C(F)(F)F)NC(=O)Cc1ccccc1[N+](=O)[O-] ZINC000181211236 941110860 /nfs/dbraw/zinc/11/08/60/941110860.db2.gz HUUNGHHTRKQYDH-LBPRGKRZSA-N 0 0 366.339 3.904 20 5 FHBDRN COc1ccc([C@@H](CCO)Nc2ccc([N+](=O)[O-])c(OC(F)F)c2)cc1 ZINC000181208401 941110925 /nfs/dbraw/zinc/11/09/25/941110925.db2.gz ITHRIQMLLBRNLR-CQSZACIVSA-N 0 0 368.336 3.740 20 5 FHBDRN CC(C)n1ncc2ccc(NC(=O)c3cc4c(c([N+](=O)[O-])c3)OCO4)cc21 ZINC000181197189 941112681 /nfs/dbraw/zinc/11/26/81/941112681.db2.gz LJQJOFFPPAFCRS-UHFFFAOYSA-N 0 0 368.349 3.506 20 5 FHBDRN CC(C)[C@@H]1C[C@H](CC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)CCO1 ZINC000541028595 941113637 /nfs/dbraw/zinc/11/36/37/941113637.db2.gz CDYNXFNTMOJQHO-BEFAXECRSA-N 0 0 360.454 3.927 20 5 FHBDRN Cc1ccccc1C1CCN(C(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)CC1 ZINC000181217523 941114545 /nfs/dbraw/zinc/11/45/45/941114545.db2.gz NOOIBEBNPBICAY-UHFFFAOYSA-N 0 0 368.389 3.652 20 5 FHBDRN CCOc1cc(C(=O)N[C@@H]2CCC[C@H](C)CC2)c([N+](=O)[O-])cc1OC ZINC000188850096 941118690 /nfs/dbraw/zinc/11/86/90/941118690.db2.gz ZASPYDWFOYNMJF-QWHCGFSZSA-N 0 0 350.415 3.701 20 5 FHBDRN CCC1(CC)CCCN(C(=O)CCn2nc(C)c([N+](=O)[O-])c2C)CC1 ZINC000188866691 941123202 /nfs/dbraw/zinc/12/32/02/941123202.db2.gz WXHFLRSHHRQKBG-UHFFFAOYSA-N 0 0 350.463 3.617 20 5 FHBDRN Cc1ccc(CN(C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)nc1 ZINC000616096491 941130733 /nfs/dbraw/zinc/13/07/33/941130733.db2.gz FAIBILKQFPYAKE-UHFFFAOYSA-N 0 0 366.324 3.564 20 5 FHBDRN Cc1nc(CC(C)C)oc1C(=O)Nc1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000188972419 941135728 /nfs/dbraw/zinc/13/57/28/941135728.db2.gz OVMCRVDPFBTKSA-UHFFFAOYSA-N 0 0 354.366 3.890 20 5 FHBDRN Cc1nccc(C(=O)Nc2ccc(OCc3ccccc3)cc2[N+](=O)[O-])n1 ZINC000188970275 941135894 /nfs/dbraw/zinc/13/58/94/941135894.db2.gz FPAFFGDSOLFXBJ-UHFFFAOYSA-N 0 0 364.361 3.525 20 5 FHBDRN COc1cc(C(=O)N2CC[C@H](c3ccccc3)[C@H]2C)cc([N+](=O)[O-])c1C ZINC000189102902 941145421 /nfs/dbraw/zinc/14/54/21/941145421.db2.gz PLXGWLJIKWLSHX-PBHICJAKSA-N 0 0 354.406 3.930 20 5 FHBDRN Cc1cc(=O)n(Cc2ccc(Br)c(Cl)c2)cc1[N+](=O)[O-] ZINC000189069296 941146125 /nfs/dbraw/zinc/14/61/25/941146125.db2.gz IBRLTGSSXPQSEP-UHFFFAOYSA-N 0 0 357.591 3.529 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N(C)[C@H](C)c1cnn(C)c1 ZINC000189172089 941149615 /nfs/dbraw/zinc/14/96/15/941149615.db2.gz KXSMWBPKBFADCK-GFCCVEGCSA-N 0 0 362.455 3.662 20 5 FHBDRN Cc1cnc([C@H](C)NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)s1 ZINC000177911987 941152768 /nfs/dbraw/zinc/15/27/68/941152768.db2.gz IECXEOKJCWHGAA-JTQLQIEISA-N 0 0 374.447 3.974 20 5 FHBDRN CC(C)c1nnc2ccc(NC(=O)[C@H](C)c3ccc([N+](=O)[O-])cc3F)cn21 ZINC000189273973 941154380 /nfs/dbraw/zinc/15/43/80/941154380.db2.gz PEMDFAFIWAEXCA-LLVKDONJSA-N 0 0 371.372 3.642 20 5 FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC(C2CCCC2)C1 ZINC000376567535 941156985 /nfs/dbraw/zinc/15/69/85/941156985.db2.gz XAJSARJGFSGGSI-UHFFFAOYSA-N 0 0 364.467 3.596 20 5 FHBDRN CC[C@](C)(O)CN(Cc1ccccc1)C(=O)c1ccc([N+](=O)[O-])cc1C ZINC000189496091 941159371 /nfs/dbraw/zinc/15/93/71/941159371.db2.gz OJVCYBVQFHUFPF-FQEVSTJZSA-N 0 0 356.422 3.707 20 5 FHBDRN COc1cnccc1[C@H](C)NCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000189544317 941161082 /nfs/dbraw/zinc/16/10/82/941161082.db2.gz RSHVDCZHIHAAMU-LBPRGKRZSA-N 0 0 370.434 3.973 20 5 FHBDRN Cc1cc(Oc2ccc(I)cc2)ncc1[N+](=O)[O-] ZINC000092026677 941166732 /nfs/dbraw/zinc/16/67/32/941166732.db2.gz HCGLODNSNHUIRC-UHFFFAOYSA-N 0 0 356.119 3.695 20 5 FHBDRN Cc1cccc2c1OCC[C@H]2NC(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000189594482 941212456 /nfs/dbraw/zinc/21/24/56/941212456.db2.gz GCYVLGUDBBLRBL-SJKOYZFVSA-N 0 0 358.369 3.786 20 5 FHBDRN COc1cnccc1[C@@H](C)NC(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000189622316 941227364 /nfs/dbraw/zinc/22/73/64/941227364.db2.gz QBTAWWQGTVPPHL-GFCCVEGCSA-N 0 0 357.410 3.787 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N1C[C@]2(C[C@@H]3CC[C@H]2C3)OC(C)(C)C1 ZINC000407971029 941230330 /nfs/dbraw/zinc/23/03/30/941230330.db2.gz FYHQVIHSKOYBQE-SIFCLUCFSA-N 0 0 358.438 3.713 20 5 FHBDRN C[C@@H]1CO[C@@H](c2ccccc2)CN1C(=O)/C=C/c1ccc([N+](=O)[O-])cc1 ZINC000066712811 941270217 /nfs/dbraw/zinc/27/02/17/941270217.db2.gz AKNBCAUMHXIHQH-YQLYKAFASA-N 0 0 352.390 3.597 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)Nc2cnn([C@@H](C)C3CC3)c2)cc1[N+](=O)[O-] ZINC000189749235 941271037 /nfs/dbraw/zinc/27/10/37/941271037.db2.gz AGYVUIRPYUXXDP-OLZOCXBDSA-N 0 0 357.414 3.953 20 5 FHBDRN CCCN(c1cccc([N+](=O)[O-])c1)S(=O)(=O)Cc1ccccc1Cl ZINC001211645750 941285910 /nfs/dbraw/zinc/28/59/10/941285910.db2.gz CVVFRDABPHTKIB-UHFFFAOYSA-N 0 0 368.842 3.995 20 5 FHBDRN Cc1ccc(-n2cccn2)cc1N[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000189840180 941287171 /nfs/dbraw/zinc/28/71/71/941287171.db2.gz AVCMVCAIKPODHR-AWEZNQCLSA-N 0 0 365.393 3.528 20 5 FHBDRN Cc1ccc(-n2cccn2)cc1N[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000189841365 941287660 /nfs/dbraw/zinc/28/76/60/941287660.db2.gz SFFSGBJRMVCVAT-CQSZACIVSA-N 0 0 365.393 3.528 20 5 FHBDRN O=C(Cc1ccc2c(c1)CCC2)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000178680244 941294422 /nfs/dbraw/zinc/29/44/22/941294422.db2.gz RYVDHWNEYHUYSO-UHFFFAOYSA-N 0 0 350.418 3.817 20 5 FHBDRN CC(C)c1ccc(C(=O)N[C@@H](C[S@@](C)=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000189918645 941303388 /nfs/dbraw/zinc/30/33/88/941303388.db2.gz FIVMKZZBMMCMRH-MRDQGFSESA-N 0 0 374.462 3.568 20 5 FHBDRN CCC(CC)[C@@H]1C[C@H](NC(=O)Nc2cc([N+](=O)[O-])ccc2OC)CCO1 ZINC000181492491 941336560 /nfs/dbraw/zinc/33/65/60/941336560.db2.gz DXOSJJYICXVZCE-DYVFJYSZSA-N 0 0 365.430 3.709 20 5 FHBDRN CC[C@H](O)CN(Cc1ccccc1)C(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000179179418 941338884 /nfs/dbraw/zinc/33/88/84/941338884.db2.gz PHVNPJFBKFZGOI-KXBFYZLASA-N 0 0 371.437 3.639 20 5 FHBDRN Cc1c(Br)cc(C(=O)N2CCSCC[C@H]2C)cc1[N+](=O)[O-] ZINC000190018242 941345943 /nfs/dbraw/zinc/34/59/43/941345943.db2.gz DWARVKXCQTVINT-SECBINFHSA-N 0 0 373.272 3.633 20 5 FHBDRN CCOC(=O)[C@@H](N[C@H](C)CCc1ccccc1[N+](=O)[O-])c1cccc(O)c1 ZINC000190027798 941368153 /nfs/dbraw/zinc/36/81/53/941368153.db2.gz BOLISHGWVCEDLH-KUHUBIRLSA-N 0 0 372.421 3.516 20 5 FHBDRN Cc1sc(C(=O)N[C@H](C)c2nc(C(F)(F)F)cs2)cc1[N+](=O)[O-] ZINC000278809393 941385164 /nfs/dbraw/zinc/38/51/64/941385164.db2.gz SHNWNXKRVWWTNR-RXMQYKEDSA-N 0 0 365.358 3.931 20 5 FHBDRN Cc1cc(NCc2ccc(OCCO)cc2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000549121626 941405701 /nfs/dbraw/zinc/40/57/01/941405701.db2.gz LGOYZPRZEFNKAC-UHFFFAOYSA-N 0 0 370.327 3.905 20 5 FHBDRN CN(c1ccccc1)c1ccc(C[N@@H+]2CC[C@@](C)(C(=O)[O-])C2)cc1[N+](=O)[O-] ZINC000414652783 941425725 /nfs/dbraw/zinc/42/57/25/941425725.db2.gz HHNKTSIVHXSHAS-HXUWFJFHSA-N 0 0 369.421 3.659 20 5 FHBDRN CN(Cc1cnn(-c2ccccc2)c1)C(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000110184939 941430530 /nfs/dbraw/zinc/43/05/30/941430530.db2.gz UJJGFVJSHZNBER-UHFFFAOYSA-N 0 0 370.796 3.706 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H]1CC(C)(C)Oc2ccccc21 ZINC000414721054 941449493 /nfs/dbraw/zinc/44/94/93/941449493.db2.gz FHKYWJUNFYKVEM-AWEZNQCLSA-N 0 0 356.378 3.887 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1CC(C)(C)Oc2ccccc21 ZINC000414721055 941449552 /nfs/dbraw/zinc/44/95/52/941449552.db2.gz FHKYWJUNFYKVEM-CQSZACIVSA-N 0 0 356.378 3.887 20 5 FHBDRN O=C(Nc1cc2c(cc1[N+](=O)[O-])OCCCO2)[C@H]1C[C@@]1(F)c1ccccc1 ZINC000414733071 941451491 /nfs/dbraw/zinc/45/14/91/941451491.db2.gz CINBUVUINPAICC-BFUOFWGJSA-N 0 0 372.352 3.580 20 5 FHBDRN CCOc1ccc(NC(=O)CCCNc2ccc([N+](=O)[O-])cc2)cc1OC ZINC000024387919 941470583 /nfs/dbraw/zinc/47/05/83/941470583.db2.gz LIRMUCUPZPJLOT-UHFFFAOYSA-N 0 0 373.409 3.833 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)NCCC2Cc3ccccc3C2)c1 ZINC000122314297 941504409 /nfs/dbraw/zinc/50/44/09/941504409.db2.gz JHDAQUHDICSYRX-UHFFFAOYSA-N 0 0 356.447 3.852 20 5 FHBDRN Cc1cccc(N[C@H]2CCc3nnc(-c4ccc(F)cc4)n3C2)c1[N+](=O)[O-] ZINC000549137548 941513556 /nfs/dbraw/zinc/51/35/56/941513556.db2.gz OKMLGOSGZGVQJW-HNNXBMFYSA-N 0 0 367.384 3.728 20 5 FHBDRN O=C(CSc1ccccc1[N+](=O)[O-])OCc1ccc(-n2cccn2)cc1 ZINC000024420836 941518975 /nfs/dbraw/zinc/51/89/75/941518975.db2.gz AVNWPJHTDJFAMS-UHFFFAOYSA-N 0 0 369.402 3.616 20 5 FHBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N(C1CC1)C1CCCCC1 ZINC000146781906 941520366 /nfs/dbraw/zinc/52/03/66/941520366.db2.gz VLVNGMREZRJBQB-UHFFFAOYSA-N 0 0 358.847 3.734 20 5 FHBDRN O=[N+]([O-])c1cc(CNCc2cc(Br)cc3c2OCC3)cs1 ZINC000122331392 941528502 /nfs/dbraw/zinc/52/85/02/941528502.db2.gz IEWSCBKSAPUDAT-UHFFFAOYSA-N 0 0 369.240 3.644 20 5 FHBDRN CCOc1cccc(N2CC[C@@H](OCc3csc(C)n3)C2)c1[N+](=O)[O-] ZINC000377180679 941538623 /nfs/dbraw/zinc/53/86/23/941538623.db2.gz WIKLTSDFLFANJO-CQSZACIVSA-N 0 0 363.439 3.554 20 5 FHBDRN O=C(Nc1nncn1-c1cccnc1)c1cc2ccccc2c2cccnc12 ZINC000377183459 941539560 /nfs/dbraw/zinc/53/95/60/941539560.db2.gz ITNAEUWNZZNACI-UHFFFAOYSA-N 0 0 366.384 3.616 20 5 FHBDRN Cc1ccc(C(=O)N2CCC[C@@H]2c2cccc3c2OCCO3)cc1[N+](=O)[O-] ZINC000066772356 941539718 /nfs/dbraw/zinc/53/97/18/941539718.db2.gz JNFXIQZBEMVSKE-MRXNPFEDSA-N 0 0 368.389 3.652 20 5 FHBDRN Cc1ccc(C(=O)N2CCC[C@H]2c2cccc3c2OCCO3)cc1[N+](=O)[O-] ZINC000066772358 941540720 /nfs/dbraw/zinc/54/07/20/941540720.db2.gz JNFXIQZBEMVSKE-INIZCTEOSA-N 0 0 368.389 3.652 20 5 FHBDRN CC[C@@H](NCc1nnc(-c2ccccc2OC)o1)c1cccc([N+](=O)[O-])c1 ZINC000181542795 941548972 /nfs/dbraw/zinc/54/89/72/941548972.db2.gz NFAVPKKTAHANSG-MRXNPFEDSA-N 0 0 368.393 3.894 20 5 FHBDRN CC[C@@H]1c2ccsc2CCN1C(=O)CNc1cc([N+](=O)[O-])ccc1F ZINC000178306206 941559595 /nfs/dbraw/zinc/55/95/95/941559595.db2.gz XLQWVPISMSJLHM-OAHLLOKOSA-N 0 0 363.414 3.743 20 5 FHBDRN COc1ccccc1[C@@H]1CCCN1C(=O)Nc1ccc(OC)c([N+](=O)[O-])c1 ZINC000541106279 941582267 /nfs/dbraw/zinc/58/22/67/941582267.db2.gz NTXZBATVWYYKTO-HNNXBMFYSA-N 0 0 371.393 3.981 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N(C(C)C)C2CCCCC2)c1F ZINC000415083569 941592989 /nfs/dbraw/zinc/59/29/89/941592989.db2.gz PXTAUBGILRFXEJ-UHFFFAOYSA-N 0 0 352.406 3.855 20 5 FHBDRN COc1cc2c(cc1N[C@@H](C)c1cccc([N+](=O)[O-])c1C)NC(=O)CC2 ZINC000274372805 941599017 /nfs/dbraw/zinc/59/90/17/941599017.db2.gz LCTAKCDRXHVIIQ-LBPRGKRZSA-N 0 0 355.394 3.970 20 5 FHBDRN CC(=O)N1CCN(c2ccc([N+](=O)[O-])c3cccnc32)CC12CCCCC2 ZINC000408039027 941601477 /nfs/dbraw/zinc/60/14/77/941601477.db2.gz SKRYLGBBBQXNMF-UHFFFAOYSA-N 0 0 368.437 3.514 20 5 FHBDRN COC(=O)c1ccc(Cl)c(NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)c1 ZINC000128323273 941614639 /nfs/dbraw/zinc/61/46/39/941614639.db2.gz GKRFTUDDKUHFHC-UHFFFAOYSA-N 0 0 369.160 3.941 20 5 FHBDRN CC(C)(C)OC(=O)CC[C@H]1CCCN(Cc2csc([N+](=O)[O-])c2)C1 ZINC000412069195 941621422 /nfs/dbraw/zinc/62/14/22/941621422.db2.gz NGXJZYKQRQFAJR-CYBMUJFWSA-N 0 0 354.472 3.990 20 5 FHBDRN CCCCOc1cccc(Nc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)c1 ZINC000302652744 941623128 /nfs/dbraw/zinc/62/31/28/941623128.db2.gz NIHPJTIOFCZLKC-UHFFFAOYSA-N 0 0 364.423 3.921 20 5 FHBDRN O=[N+]([O-])c1ccc(CN2CCC(n3cc(Cl)cn3)CC2)c(Cl)c1 ZINC000541122974 941640991 /nfs/dbraw/zinc/64/09/91/941640991.db2.gz KORVKXGFNYNABG-UHFFFAOYSA-N 0 0 355.225 3.935 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N(C)[C@@H](C)c2ccc(OC)cc2)c1 ZINC000549212739 941650307 /nfs/dbraw/zinc/65/03/07/941650307.db2.gz ZJQRMXPZERAUJE-ZDUSSCGKSA-N 0 0 358.394 3.835 20 5 FHBDRN CC(C)Cn1nccc1NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000122356230 941658730 /nfs/dbraw/zinc/65/87/30/941658730.db2.gz WRKFYAGLQDXXOA-UHFFFAOYSA-N 0 0 371.422 3.823 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N[C@H]1CCCC[C@@H]1n1cccn1 ZINC000120177006 941672696 /nfs/dbraw/zinc/67/26/96/941672696.db2.gz SULRNVQBYSQGCA-HOCLYGCPSA-N 0 0 357.414 3.714 20 5 FHBDRN CCN(C(=O)Nc1cccc([N+](=O)[O-])c1)[C@H](COC)Cc1ccccc1 ZINC000472755572 941686885 /nfs/dbraw/zinc/68/68/85/941686885.db2.gz WYEUJRHBXXVWKJ-SFHVURJKSA-N 0 0 357.410 3.706 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])N(Cc1ccco1)c1ccccc1 ZINC000729249734 941701231 /nfs/dbraw/zinc/70/12/31/941701231.db2.gz AKPDJAWNXQVNPW-UHFFFAOYSA-N 0 0 351.362 3.833 20 5 FHBDRN COc1ccc(NC(=O)[C@H](C)CC(=O)c2ccccc2F)cc1[N+](=O)[O-] ZINC000541143613 941703792 /nfs/dbraw/zinc/70/37/92/941703792.db2.gz NDGBRJPRCGATIG-LLVKDONJSA-N 0 0 360.341 3.590 20 5 FHBDRN Cc1ccccc1[C@H](NC(=O)c1c([N+](=O)[O-])cnn1C)[C@H]1CCC[C@H](C)C1 ZINC000122385468 941709696 /nfs/dbraw/zinc/70/96/96/941709696.db2.gz PTPBKAILEIMZPE-DHSIGJKJSA-N 0 0 370.453 3.934 20 5 FHBDRN COC1(c2noc(-c3csc(-c4cccc([N+](=O)[O-])c4)n3)n2)CCC1 ZINC000545813510 941715038 /nfs/dbraw/zinc/71/50/38/941715038.db2.gz YAEUACLISASKEC-UHFFFAOYSA-N 0 0 358.379 3.794 20 5 FHBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)Nc1ccc(C(F)(F)F)cc1 ZINC000536248717 941719374 /nfs/dbraw/zinc/71/93/74/941719374.db2.gz OQNUECMECWGOEI-UHFFFAOYSA-N 0 0 353.300 3.978 20 5 FHBDRN C[C@H]1CN(C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2N(C)C1=O ZINC000365569082 941727964 /nfs/dbraw/zinc/72/79/64/941727964.db2.gz VLIDDZDPABXMNQ-NSHDSACASA-N 0 0 373.796 3.508 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000024068432 941730236 /nfs/dbraw/zinc/73/02/36/941730236.db2.gz TWIFGOWGXVCVFU-NSHDSACASA-N 0 0 361.379 3.931 20 5 FHBDRN CCc1ccc(C(=O)N(C)[C@H](C)[C@H]2Cc3ccccc3O2)cc1[N+](=O)[O-] ZINC000433555229 941738343 /nfs/dbraw/zinc/73/83/43/941738343.db2.gz OAHLRNQXUGFWIK-BFUOFWGJSA-N 0 0 354.406 3.621 20 5 FHBDRN CCOc1ccc(CNc2nc3ccccc3cc2[N+](=O)[O-])cc1OC ZINC000473521422 941743839 /nfs/dbraw/zinc/74/38/39/941743839.db2.gz OUUJUNOTDCEDCW-UHFFFAOYSA-N 0 0 353.378 3.584 20 5 FHBDRN O=[N+]([O-])c1cc2ccccc2nc1N1CCO[C@]2(CCc3ccccc32)C1 ZINC000473521004 941744131 /nfs/dbraw/zinc/74/41/31/941744131.db2.gz JGZCTPPPFVLXIX-OAQYLSRUSA-N 0 0 361.401 3.821 20 5 FHBDRN O=[N+]([O-])c1cc2ccccc2nc1NCc1csc(-c2ccco2)n1 ZINC000473522943 941744325 /nfs/dbraw/zinc/74/43/25/941744325.db2.gz MRMDTUSZGUDZPS-UHFFFAOYSA-N 0 0 352.375 3.894 20 5 FHBDRN Cc1cccc2c1CCN(C(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C)C2 ZINC000729416201 941748303 /nfs/dbraw/zinc/74/83/03/941748303.db2.gz UHRAWUFMRMWSSC-UHFFFAOYSA-N 0 0 369.377 3.627 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1OC(=O)c1cccc(OC[C@@H]2CCCO2)c1 ZINC000760013384 941748754 /nfs/dbraw/zinc/74/87/54/941748754.db2.gz ATJPXFDWZIRFAW-INIZCTEOSA-N 0 0 357.362 3.680 20 5 FHBDRN COc1ccc(OCCSc2c(OC)cccc2OC)c([N+](=O)[O-])c1 ZINC000473522744 941752171 /nfs/dbraw/zinc/75/21/71/941752171.db2.gz UETKUTJIQQFHIV-UHFFFAOYSA-N 0 0 365.407 3.792 20 5 FHBDRN Cc1c(C(=O)N(CC(F)(F)F)C(C)C)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000122456753 941752130 /nfs/dbraw/zinc/75/21/30/941752130.db2.gz QGVFYUDFTVKJJP-UHFFFAOYSA-N 0 0 363.292 3.533 20 5 FHBDRN C[C@H]1CCC[C@H](OCc2cccc(NC(=O)c3nn(C)cc3[N+](=O)[O-])c2)C1 ZINC000270799294 941759420 /nfs/dbraw/zinc/75/94/20/941759420.db2.gz NGCQDKOGHXERAZ-BBRMVZONSA-N 0 0 372.425 3.676 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1OCc1nc(-c2ccoc2)no1 ZINC000151148829 941760591 /nfs/dbraw/zinc/76/05/91/941760591.db2.gz XQUIFLMMVOOKKS-UHFFFAOYSA-N 0 0 366.127 3.579 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N(C)[C@H](C)c1ccc(F)c(F)c1 ZINC000073446842 941762296 /nfs/dbraw/zinc/76/22/96/941762296.db2.gz XNRVPISXFGRHEE-SNVBAGLBSA-N 0 0 350.321 3.715 20 5 FHBDRN CN(C(=O)c1ccc([N+](=O)[O-])cc1Br)c1ccccc1F ZINC000151156746 941763639 /nfs/dbraw/zinc/76/36/39/941763639.db2.gz SQTWGYZLEOEJPK-UHFFFAOYSA-N 0 0 353.147 3.773 20 5 FHBDRN Cc1c(NC(=O)[C@@H](C)N2CCC[C@@H]2c2nccs2)cccc1[N+](=O)[O-] ZINC000377502477 941768713 /nfs/dbraw/zinc/76/87/13/941768713.db2.gz MGZHRCZLXSJSFD-IUODEOHRSA-N 0 0 360.439 3.524 20 5 FHBDRN O=[N+]([O-])c1cc(F)ccc1NC[C@H](O)COc1ccc(C(F)(F)F)cc1 ZINC000513181809 941773909 /nfs/dbraw/zinc/77/39/09/941773909.db2.gz DENAETMUYMFEOP-LBPRGKRZSA-N 0 0 374.290 3.605 20 5 FHBDRN Cc1cc(NC(=O)NC[C@H]2CCCN(c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000433593781 941781103 /nfs/dbraw/zinc/78/11/03/941781103.db2.gz KZMRRKFPXADGMW-MRXNPFEDSA-N 0 0 368.437 3.941 20 5 FHBDRN C[C@@H]1CCC[C@]1(O)CNc1cc(C(F)(F)C(F)(F)F)ncc1[N+](=O)[O-] ZINC000549262180 941783526 /nfs/dbraw/zinc/78/35/26/941783526.db2.gz ZVSVFGBRUJLVIF-PELKAZGASA-N 0 0 369.290 3.607 20 5 FHBDRN CCOc1cc(N[C@@H]2CC(=O)N(Cc3ccccc3)[C@H]2C)ccc1[N+](=O)[O-] ZINC000542138537 941798272 /nfs/dbraw/zinc/79/82/72/941798272.db2.gz KJIYCWPYHVYTGZ-WMLDXEAASA-N 0 0 369.421 3.595 20 5 FHBDRN C[C@H]1CCc2onc(C(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)c2C1 ZINC000433614878 941798884 /nfs/dbraw/zinc/79/88/84/941798884.db2.gz FDMBMPRNWJGOPU-QMMMGPOBSA-N 0 0 367.308 3.561 20 5 FHBDRN CCC(CC)[C@H]1C[C@@H](NC(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)CCO1 ZINC000190064530 941802933 /nfs/dbraw/zinc/80/29/33/941802933.db2.gz MFVVCYNUGHSADV-MAUKXSAKSA-N 0 0 364.442 3.625 20 5 FHBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H](C)N(C)[C@@H](C)C1 ZINC000513237852 941810039 /nfs/dbraw/zinc/81/00/39/941810039.db2.gz GHJDGQNEJWARJN-OKILXGFUSA-N 0 0 365.499 3.652 20 5 FHBDRN COC(=O)[C@@H](C)[C@@H](NCc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000182348158 941813617 /nfs/dbraw/zinc/81/36/17/941813617.db2.gz WTRCOSTVWJYSQT-YVEFUNNKSA-N 0 0 362.813 3.888 20 5 FHBDRN O=C(CCOCC(F)F)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000549275868 941818198 /nfs/dbraw/zinc/81/81/98/941818198.db2.gz LHLCEJZCWHIVHR-UHFFFAOYSA-N 0 0 366.320 3.997 20 5 FHBDRN Cc1ccc(NC(=O)C(=O)N(C)C2CCC(C(C)C)CC2)cc1[N+](=O)[O-] ZINC000433666546 941826137 /nfs/dbraw/zinc/82/61/37/941826137.db2.gz GZICXZPDQWFNSU-UHFFFAOYSA-N 0 0 361.442 3.515 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N(C)[C@@H](C)c2cc(F)ccc2F)c1[N+](=O)[O-] ZINC000433677710 941830079 /nfs/dbraw/zinc/83/00/79/941830079.db2.gz BPCURRAVOCWAES-VIFPVBQESA-N 0 0 352.341 3.553 20 5 FHBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)[C@@H]1C[C@H]1c1cccc(O)c1 ZINC000412134473 941831711 /nfs/dbraw/zinc/83/17/11/941831711.db2.gz YWNNUMKRSHAYQJ-RBUKOAKNSA-N 0 0 354.406 3.543 20 5 FHBDRN CO[C@@H](CNC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)c1ccc(Cl)cc1 ZINC000412138887 941833674 /nfs/dbraw/zinc/83/36/74/941833674.db2.gz QZHOHBNWPJRDDE-KSZLIROESA-N 0 0 374.824 3.856 20 5 FHBDRN CCOc1ccc([C@H](C)NC(=O)Nc2ccc([N+](=O)[O-])cc2)cc1OC ZINC000047611691 941838754 /nfs/dbraw/zinc/83/87/54/941838754.db2.gz UWYPGZUGDBEOEW-LBPRGKRZSA-N 0 0 359.382 3.885 20 5 FHBDRN Cn1ccnc1[C@H]1CCN(c2c3cccc(Cl)c3ncc2[N+](=O)[O-])C1 ZINC000892986007 941841863 /nfs/dbraw/zinc/84/18/63/941841863.db2.gz SPNLOEIYCURRGX-NSHDSACASA-N 0 0 357.801 3.524 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N(C)Cc2cccc3ccccc32)c1[N+](=O)[O-] ZINC000433691866 941843034 /nfs/dbraw/zinc/84/30/34/941843034.db2.gz WTNUVEUIOQGGKC-UHFFFAOYSA-N 0 0 352.394 3.867 20 5 FHBDRN CC[C@H](CO)NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000182347517 941846334 /nfs/dbraw/zinc/84/63/34/941846334.db2.gz GCKYBKNKPPKBHQ-CYBMUJFWSA-N 0 0 364.785 3.541 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1OC(=O)Cc1ccc(Br)cc1 ZINC000760014450 941849721 /nfs/dbraw/zinc/84/97/21/941849721.db2.gz AELGGJPVAUBGAI-UHFFFAOYSA-N 0 0 350.168 3.814 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCc1ccc2c(c1)CCCN2 ZINC000415482948 941852974 /nfs/dbraw/zinc/85/29/74/941852974.db2.gz LESPFEKJVXTODX-UHFFFAOYSA-N 0 0 354.410 3.891 20 5 FHBDRN CC(C)Oc1cc(C(=O)NCc2ncc(C(C)(C)C)o2)ccc1[N+](=O)[O-] ZINC000412158810 941853614 /nfs/dbraw/zinc/85/36/14/941853614.db2.gz MWWYAEGXYXEMIA-UHFFFAOYSA-N 0 0 361.398 3.598 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N1CCC(c2cccc(N)c2)CC1 ZINC000415491662 941856927 /nfs/dbraw/zinc/85/69/27/941856927.db2.gz BEJSAVVVYKULEO-UHFFFAOYSA-N 0 0 370.409 3.597 20 5 FHBDRN C[C@H]1CN(C)c2ccccc2CN1C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412162268 941856949 /nfs/dbraw/zinc/85/69/49/941856949.db2.gz AWEHJOWRYRPRED-ZOCIIQOWSA-N 0 0 365.433 3.565 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CC[C@H](c2ccc(F)cc2)C1 ZINC000412162999 941857096 /nfs/dbraw/zinc/85/70/96/941857096.db2.gz CEAYRJMXIKGNPC-ZYSHUDEJSA-N 0 0 354.381 3.854 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N[C@@H](C)[C@H](C)c2ccccc2)c1F ZINC000412165287 941857381 /nfs/dbraw/zinc/85/73/81/941857381.db2.gz UOAOVNFQVGLNJR-STQMWFEESA-N 0 0 360.385 3.593 20 5 FHBDRN CCN(C(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-])[C@H](C)Cc1ccc(OC)cc1 ZINC000433743058 941861079 /nfs/dbraw/zinc/86/10/79/941861079.db2.gz VAHCGAKHMADJGT-CYBMUJFWSA-N 0 0 374.441 3.543 20 5 FHBDRN CCc1cnc(CN(C)C(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)s1 ZINC000412173520 941862426 /nfs/dbraw/zinc/86/24/26/941862426.db2.gz VSGBWNYBSYIDRN-UHFFFAOYSA-N 0 0 363.439 3.673 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N[C@@H](C)c2ccc(C)c(F)c2)c1F ZINC000412174403 941863359 /nfs/dbraw/zinc/86/33/59/941863359.db2.gz PJZAUJODZNJIPJ-NSHDSACASA-N 0 0 364.348 3.610 20 5 FHBDRN Cc1cn([C@H](C)c2ccccc2)nc1NC(=O)Cc1ccccc1[N+](=O)[O-] ZINC000472821594 941867225 /nfs/dbraw/zinc/86/72/25/941867225.db2.gz DWSDDFGGFSFXJG-OAHLLOKOSA-N 0 0 364.405 3.890 20 5 FHBDRN CC(C)Oc1cc(C(=O)N[C@H](c2cnn(C)c2)C(C)(C)C)ccc1[N+](=O)[O-] ZINC000412179585 941867550 /nfs/dbraw/zinc/86/75/50/941867550.db2.gz ALDCFXOEKHGTCK-QGZVFWFLSA-N 0 0 374.441 3.633 20 5 FHBDRN COc1cc(C(=O)N(C)CCc2cccc([N+](=O)[O-])c2)ccc1OC(C)C ZINC000513354683 941873565 /nfs/dbraw/zinc/87/35/65/941873565.db2.gz XXDSQHTWMYNDDZ-UHFFFAOYSA-N 0 0 372.421 3.705 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](C)CCc2ccc(OC)cc2)c1 ZINC000549298996 941878858 /nfs/dbraw/zinc/87/88/58/941878858.db2.gz GMIZXAVVEJLCAM-AWEZNQCLSA-N 0 0 372.421 3.753 20 5 FHBDRN O=C1[C@@H](Nc2cc([N+](=O)[O-])ccc2Nc2ccccc2)CCN1C1CC1 ZINC000433761432 941880055 /nfs/dbraw/zinc/88/00/55/941880055.db2.gz BEJQICUJVYHBIZ-KRWDZBQOSA-N 0 0 352.394 3.514 20 5 FHBDRN Cc1cn([C@H](C)c2ccccc2)[nH]c1=NC(=O)c1ccc(F)cc1[N+](=O)[O-] ZINC000472828612 941887149 /nfs/dbraw/zinc/88/71/49/941887149.db2.gz IERHYQRMYPUMLN-CYBMUJFWSA-N 0 0 368.368 3.522 20 5 FHBDRN C[C@@H](CC1CCCC1)c1nc(-c2ccc(-n3cncn3)c([N+](=O)[O-])c2)no1 ZINC000453204710 941890429 /nfs/dbraw/zinc/89/04/29/941890429.db2.gz WIZXUCZBUPKLOR-LBPRGKRZSA-N 0 0 368.397 3.909 20 5 FHBDRN CC(C)(C)c1ccccc1OCCNC(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000517496985 941894622 /nfs/dbraw/zinc/89/46/22/941894622.db2.gz VZOMAWMCYGEZKW-UHFFFAOYSA-N 0 0 371.437 3.771 20 5 FHBDRN C[C@@H](NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)c1ccncc1F ZINC000513399107 941895304 /nfs/dbraw/zinc/89/53/04/941895304.db2.gz GKYLOYGWDZVNKH-SNVBAGLBSA-N 0 0 372.381 3.743 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CCC[C@H](Nc2ccccc2)C1 ZINC000412193698 941896941 /nfs/dbraw/zinc/89/69/41/941896941.db2.gz OIOGNAUGGTZSIA-YSIASYRMSA-N 0 0 365.433 3.801 20 5 FHBDRN CS[C@@H]1CCCCN(C(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)C1 ZINC000412194141 941897239 /nfs/dbraw/zinc/89/72/39/941897239.db2.gz GPSDIJAXFOCOJA-CQSZACIVSA-N 0 0 352.456 3.740 20 5 FHBDRN CCc1ccccc1NC(=O)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000103463247 941897300 /nfs/dbraw/zinc/89/73/00/941897300.db2.gz KLVQYXPDGQZQFD-UHFFFAOYSA-N 0 0 350.378 3.659 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1cccc(O)c1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000412194603 941897449 /nfs/dbraw/zinc/89/74/49/941897449.db2.gz BPBHMORTUGMSCQ-RBUKOAKNSA-N 0 0 352.390 3.595 20 5 FHBDRN CCO[C@H]1C[C@H](N(C)C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)C12CCC2 ZINC000412195458 941897942 /nfs/dbraw/zinc/89/79/42/941897942.db2.gz PUGHEXZOPNITEG-MHORFTMASA-N 0 0 358.438 3.504 20 5 FHBDRN Cc1cc(N2CCC[C@H]([C@H](O)C(F)(F)F)C2)c2cccc([N+](=O)[O-])c2n1 ZINC000433789533 941898701 /nfs/dbraw/zinc/89/87/01/941898701.db2.gz NINUOIXBDIRISU-ZBEGNZNMSA-N 0 0 369.343 3.591 20 5 FHBDRN CC[C@H]1CN(C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)c2ccccc2O1 ZINC000460621647 941899245 /nfs/dbraw/zinc/89/92/45/941899245.db2.gz PEFJCEKIQMAKJV-HNNXBMFYSA-N 0 0 367.405 3.987 20 5 FHBDRN CC(C)N(C(=O)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1)c1ccccc1 ZINC000103463420 941901260 /nfs/dbraw/zinc/90/12/60/941901260.db2.gz AYKLHEFKYJJARB-UHFFFAOYSA-N 0 0 364.405 3.900 20 5 FHBDRN O=C([C@@H]1C[C@]1(F)c1ccccc1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000412201853 941904238 /nfs/dbraw/zinc/90/42/38/941904238.db2.gz KDGAKOUNZYDPOE-PXNSSMCTSA-N 0 0 354.381 3.971 20 5 FHBDRN Cc1ccc([C@@H]2C[C@@H](C)CCN2S(=O)(=O)c2csc([N+](=O)[O-])c2)o1 ZINC000119898501 941905941 /nfs/dbraw/zinc/90/59/41/941905941.db2.gz URFJVRSNFNYTRO-GWCFXTLKSA-N 0 0 370.452 3.720 20 5 FHBDRN CCN(C(=O)c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1)[C@@H](C)CO ZINC000513432399 941918452 /nfs/dbraw/zinc/91/84/52/941918452.db2.gz QTLVZHYRLXFEGI-ZDUSSCGKSA-N 0 0 360.435 3.589 20 5 FHBDRN Cc1ccc(OC(=O)CCc2cnn(-c3ccccc3)c2)c([N+](=O)[O-])c1 ZINC000052737629 941919284 /nfs/dbraw/zinc/91/92/84/941919284.db2.gz ORGKLBNTBFDDSQ-UHFFFAOYSA-N 0 0 351.362 3.627 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N[C@H]1CCO[C@H]1c1ccc(Cl)cc1 ZINC000182427241 941923238 /nfs/dbraw/zinc/92/32/38/941923238.db2.gz KXNYZMWNYJSKIF-HKUYNNGSSA-N 0 0 374.824 3.827 20 5 FHBDRN Cc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)c(C)c1O ZINC000182424711 941923401 /nfs/dbraw/zinc/92/34/01/941923401.db2.gz HHWVKXRSXJPMSE-UHFFFAOYSA-N 0 0 352.293 3.771 20 5 FHBDRN Cc1cc(C(=O)N[C@H]2CCO[C@@H]2c2ccc(Cl)cc2)cc([N+](=O)[O-])c1 ZINC000182442485 941925037 /nfs/dbraw/zinc/92/50/37/941925037.db2.gz WZQBBUFWCLSHCP-DLBZAZTESA-N 0 0 360.797 3.817 20 5 FHBDRN COc1ccc(C(=O)Nc2cc(-c3cc(C)ccc3F)[nH]n2)cc1[N+](=O)[O-] ZINC000190093720 941925204 /nfs/dbraw/zinc/92/52/04/941925204.db2.gz CQZJRIJSEDKXTG-UHFFFAOYSA-N 0 0 370.340 3.693 20 5 FHBDRN O=C(NCCC1Cc2ccccc2C1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412218070 941925934 /nfs/dbraw/zinc/92/59/34/941925934.db2.gz QYKPKUPDGAIICY-VQTJNVASSA-N 0 0 350.418 3.620 20 5 FHBDRN CCN(CCc1nccs1)C(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1 ZINC000412218698 941926394 /nfs/dbraw/zinc/92/63/94/941926394.db2.gz SABQFSKVMLPSLW-UHFFFAOYSA-N 0 0 363.439 3.543 20 5 FHBDRN Cc1cc(NC(=O)CCc2nnc(-c3ccsc3)o2)ccc1[N+](=O)[O-] ZINC000182410537 941930652 /nfs/dbraw/zinc/93/06/52/941930652.db2.gz BULGNWRINMWPKQ-UHFFFAOYSA-N 0 0 358.379 3.586 20 5 FHBDRN CCCOc1ccc(NC(=O)Cc2c(F)c(OC)ccc2[N+](=O)[O-])cc1 ZINC000412229924 941942401 /nfs/dbraw/zinc/94/24/01/941942401.db2.gz QZVVICDDSLTICY-UHFFFAOYSA-N 0 0 362.357 3.713 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCN(C(=O)c2ccc(F)cc2)CC1 ZINC000182592542 941945784 /nfs/dbraw/zinc/94/57/84/941945784.db2.gz XCCXVDHXULNGBP-HNNXBMFYSA-N 0 0 371.412 3.561 20 5 FHBDRN COc1ccc([C@H](NC(=O)c2cccc([N+](=O)[O-])c2C)C(F)(F)F)cc1 ZINC000182588492 941945851 /nfs/dbraw/zinc/94/58/51/941945851.db2.gz NEDWMIZYYRCCJT-HNNXBMFYSA-N 0 0 368.311 3.945 20 5 FHBDRN Cc1sc(NC(=O)C2CCC(=O)CC2)nc1-c1cccc([N+](=O)[O-])c1 ZINC000433873146 941950115 /nfs/dbraw/zinc/95/01/15/941950115.db2.gz CNJGMCFEQICARK-UHFFFAOYSA-N 0 0 359.407 3.725 20 5 FHBDRN C[C@@H]1CCc2onc(C(=O)Nc3ccc([N+](=O)[O-])c4ncccc34)c2C1 ZINC000433864397 941953671 /nfs/dbraw/zinc/95/36/71/941953671.db2.gz XJMIGJWUQSDNCZ-SNVBAGLBSA-N 0 0 352.350 3.508 20 5 FHBDRN CCCN(C(=O)Cc1noc2ccc(OC)cc21)c1cccc([N+](=O)[O-])c1 ZINC000415617175 941954310 /nfs/dbraw/zinc/95/43/10/941954310.db2.gz CHBFKKDOPLCYDU-UHFFFAOYSA-N 0 0 369.377 3.730 20 5 FHBDRN CO[C@@H](CC(C)C)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000415618665 941954677 /nfs/dbraw/zinc/95/46/77/941954677.db2.gz XDJUYYRXBOQRMX-ZDUSSCGKSA-N 0 0 359.220 3.665 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)Nc1cccc(Br)c1Cl ZINC000549323947 941956220 /nfs/dbraw/zinc/95/62/20/941956220.db2.gz BQVCNARGDQPVCY-UHFFFAOYSA-N 0 0 370.590 3.966 20 5 FHBDRN Cc1csc([C@@H](C)CNC(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)n1 ZINC000412245275 941956267 /nfs/dbraw/zinc/95/62/67/941956267.db2.gz DKVGISBATCJQPJ-NSHDSACASA-N 0 0 363.439 3.680 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1OC(F)F)N1CCCc2ccc(F)cc21 ZINC000182635132 941956440 /nfs/dbraw/zinc/95/64/40/941956440.db2.gz CPYQRBDJAWEXFZ-UHFFFAOYSA-N 0 0 366.295 3.928 20 5 FHBDRN CC(C)Oc1cc(C(=O)N(C)C[C@H](C)c2nccs2)ccc1[N+](=O)[O-] ZINC000412250729 941960646 /nfs/dbraw/zinc/96/06/46/941960646.db2.gz KRIGLNWWBUQRMT-LBPRGKRZSA-N 0 0 363.439 3.714 20 5 FHBDRN CC(C)Oc1cc(C(=O)N(C)C[C@@H](C)c2nccs2)ccc1[N+](=O)[O-] ZINC000412250728 941960952 /nfs/dbraw/zinc/96/09/52/941960952.db2.gz KRIGLNWWBUQRMT-GFCCVEGCSA-N 0 0 363.439 3.714 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCN([C@@H](C)c2cccnc2)CC1 ZINC000182807545 941970268 /nfs/dbraw/zinc/97/02/68/941970268.db2.gz YOJBYJLPGUSXRF-DLBZAZTESA-N 0 0 354.454 3.738 20 5 FHBDRN O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CC[C@@H](C(F)(F)F)C2(CCC2)C1 ZINC000513518433 941977963 /nfs/dbraw/zinc/97/79/63/941977963.db2.gz MHLIQIXZOFOMKG-CYBMUJFWSA-N 0 0 360.307 3.929 20 5 FHBDRN COC[C@@H](C)SCc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-] ZINC000182835044 941978239 /nfs/dbraw/zinc/97/82/39/941978239.db2.gz AHKCQMFYJIBADS-SECBINFHSA-N 0 0 351.371 3.515 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])c[nH]1)N1CCC[C@@H](c2cccc(C(F)(F)F)c2)C1 ZINC000513520539 941980222 /nfs/dbraw/zinc/98/02/22/941980222.db2.gz OYMIFUSCTMLBII-GFCCVEGCSA-N 0 0 367.327 3.962 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)NCc1cccc2c1CCCN2 ZINC000415668514 941987017 /nfs/dbraw/zinc/98/70/17/941987017.db2.gz ZYEUKXZILABPKK-UHFFFAOYSA-N 0 0 370.409 3.673 20 5 FHBDRN C[C@H]1C[C@H](c2cccnc2)N(C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)C1 ZINC000412261035 941997782 /nfs/dbraw/zinc/99/77/82/941997782.db2.gz VXTCGSPFYJCBAR-NOENWEJRSA-N 0 0 351.406 3.703 20 5 FHBDRN CCOc1ccc([C@@H](O)C2CCN(c3ccc(N)cc3[N+](=O)[O-])CC2)cc1 ZINC000365704254 942001083 /nfs/dbraw/zinc/00/10/83/942001083.db2.gz PCKQFBPHIDPPEN-HXUWFJFHSA-N 0 0 371.437 3.526 20 5 FHBDRN Cc1ccccc1C[C@H]1CCCN1C(=O)COc1ccccc1[N+](=O)[O-] ZINC000513553404 942008813 /nfs/dbraw/zinc/00/88/13/942008813.db2.gz KYMJNZHPQKNUJJ-QGZVFWFLSA-N 0 0 354.406 3.516 20 5 FHBDRN Cc1ccc(-c2ccncc2)cc1NC(=O)COc1ccccc1[N+](=O)[O-] ZINC000101848388 942014835 /nfs/dbraw/zinc/01/48/35/942014835.db2.gz KRXZESKHMJZOKV-UHFFFAOYSA-N 0 0 363.373 3.983 20 5 FHBDRN CCCCN1CCc2ccc(NC(=O)c3n[nH]c(C(C)C)c3[N+](=O)[O-])cc21 ZINC000433965005 942020047 /nfs/dbraw/zinc/02/00/47/942020047.db2.gz ODNZWKBRXUASMM-UHFFFAOYSA-N 0 0 371.441 3.856 20 5 FHBDRN O=C(N[C@@H]1CCO[C@@H](c2ccccc2)C1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412272001 942021266 /nfs/dbraw/zinc/02/12/66/942021266.db2.gz PSGAOMGRUPQLMW-GSEOLPGOSA-N 0 0 366.417 3.735 20 5 FHBDRN CC(C)c1nnc2ccc(NC(=O)[C@@H]3C[C@H]3c3ccc([N+](=O)[O-])cc3)cn21 ZINC000412281147 942025924 /nfs/dbraw/zinc/02/59/24/942025924.db2.gz SZYDHNORLMILRO-JKSUJKDBSA-N 0 0 365.393 3.503 20 5 FHBDRN C[C@H](NC(=O)[C@@H]1COCC[C@@H]1c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000415743151 942029131 /nfs/dbraw/zinc/02/91/31/942029131.db2.gz KAYUJELCNNNKJU-GDIGMMSISA-N 0 0 354.406 3.592 20 5 FHBDRN CN(Cc1cc(F)cc(F)c1)C(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000433989660 942030251 /nfs/dbraw/zinc/03/02/51/942030251.db2.gz ZJMGRFHVJSXRLL-UHFFFAOYSA-N 0 0 352.362 3.624 20 5 FHBDRN C[C@H](c1ccc(OC(F)F)cc1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000513612158 942038303 /nfs/dbraw/zinc/03/83/03/942038303.db2.gz VPYHYBQJTMWMHE-SNVBAGLBSA-N 0 0 357.334 3.731 20 5 FHBDRN Cc1c(-c2nc(-c3ccc(OCC(F)F)nc3)no2)cccc1[N+](=O)[O-] ZINC000545845073 942041345 /nfs/dbraw/zinc/04/13/45/942041345.db2.gz PXMRWBJWYNZYDY-UHFFFAOYSA-N 0 0 362.292 3.659 20 5 FHBDRN Cc1nn(CCC(=O)N2CCCCC[C@@H]2c2ccccc2)c(C)c1[N+](=O)[O-] ZINC000102234368 942043710 /nfs/dbraw/zinc/04/37/10/942043710.db2.gz IQYCQJTZOCMLDR-GOSISDBHSA-N 0 0 370.453 3.942 20 5 FHBDRN Cc1nn(C)c(N[C@H](C)c2nc3ccccc3n2C(F)F)c1[N+](=O)[O-] ZINC000513623584 942043836 /nfs/dbraw/zinc/04/38/36/942043836.db2.gz FXBRJMNXXYYOJT-SECBINFHSA-N 0 0 350.329 3.555 20 5 FHBDRN CC[C@H](C)COc1cc([N+](=O)[O-])c(Cn2ccc(C)cc2=O)cc1OC ZINC000513622891 942043892 /nfs/dbraw/zinc/04/38/92/942043892.db2.gz ACMKPKRCPPDYLP-ZDUSSCGKSA-N 0 0 360.410 3.547 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N2CC[C@H](Cc3ccccc3)[C@@H]2C)c1[N+](=O)[O-] ZINC000434033771 942047900 /nfs/dbraw/zinc/04/79/00/942047900.db2.gz YDMPVDGFKIELSM-DZGCQCFKSA-N 0 0 356.426 3.535 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1Cl)N1CC[C@H](Nc2ccccc2)C1 ZINC000377880865 942049205 /nfs/dbraw/zinc/04/92/05/942049205.db2.gz WCSZZBFJQIPHAT-ZDUSSCGKSA-N 0 0 360.801 3.967 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1Cl)N1CC[C@@H](Nc2ccccc2)C1 ZINC000377880857 942049235 /nfs/dbraw/zinc/04/92/35/942049235.db2.gz WCSZZBFJQIPHAT-CYBMUJFWSA-N 0 0 360.801 3.967 20 5 FHBDRN O=C([C@@H]1CCOc2ccccc21)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000163805942 942054183 /nfs/dbraw/zinc/05/41/83/942054183.db2.gz IXDKFWCBJPCWFD-GOSISDBHSA-N 0 0 352.390 3.652 20 5 FHBDRN COc1ccc(NC(=O)c2nc(-c3ccccc3)cs2)cc1[N+](=O)[O-] ZINC000513660638 942060877 /nfs/dbraw/zinc/06/08/77/942060877.db2.gz NFVLCLOOHKWBJD-UHFFFAOYSA-N 0 0 355.375 3.979 20 5 FHBDRN CC(C)c1[nH]ccc1C(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000513642953 942061485 /nfs/dbraw/zinc/06/14/85/942061485.db2.gz PUUDNUYTDZMUFX-UHFFFAOYSA-N 0 0 357.410 3.730 20 5 FHBDRN CCn1c(-c2ccc([N+](=O)[O-])cc2)nnc1N1CC[C@@]2(CC[C@@H](C)C2)C1 ZINC000549367581 942063469 /nfs/dbraw/zinc/06/34/69/942063469.db2.gz BUROUIUUFYKOLS-AUUYWEPGSA-N 0 0 355.442 3.890 20 5 FHBDRN Cc1cc(C)c(NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)c(C)n1 ZINC000513668595 942064827 /nfs/dbraw/zinc/06/48/27/942064827.db2.gz ARCRDHNPQXWEKR-UHFFFAOYSA-N 0 0 351.309 3.769 20 5 FHBDRN CC(C)(CNC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)c1cccs1 ZINC000087104667 942065778 /nfs/dbraw/zinc/06/57/78/942065778.db2.gz FPFSGSQXYZJRFE-UHFFFAOYSA-N 0 0 359.451 3.702 20 5 FHBDRN O=C(Nc1cccc(-n2cccn2)c1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513674809 942068693 /nfs/dbraw/zinc/06/86/93/942068693.db2.gz KUHOGVBIWVNXFJ-UHFFFAOYSA-N 0 0 374.303 3.634 20 5 FHBDRN O=C(c1ccc(OC(F)F)c([N+](=O)[O-])c1)N1CCc2cc(F)c(F)cc21 ZINC000513680850 942073444 /nfs/dbraw/zinc/07/34/44/942073444.db2.gz UHIQMMFBKQYABL-UHFFFAOYSA-N 0 0 370.258 3.677 20 5 FHBDRN COCC1(c2noc(-c3ccc([N+](=O)[O-])c(OC(C)C)c3)n2)CCCC1 ZINC000420501896 942084496 /nfs/dbraw/zinc/08/44/96/942084496.db2.gz PQJNOMGKFUKYAF-UHFFFAOYSA-N 0 0 361.398 3.890 20 5 FHBDRN CCS(=O)(=O)c1ccc(CN[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)s1 ZINC000280014725 942086281 /nfs/dbraw/zinc/08/62/81/942086281.db2.gz GXQQHIJKLCLJIG-GFCCVEGCSA-N 0 0 368.480 3.609 20 5 FHBDRN CCC(=O)c1ccc(NCC(=O)Nc2c(C)cccc2C)c([N+](=O)[O-])c1 ZINC000279994254 942086739 /nfs/dbraw/zinc/08/67/39/942086739.db2.gz HCENFYMICCQVNP-UHFFFAOYSA-N 0 0 355.394 3.855 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)Nc2scnc2-c2ccccc2)c1 ZINC000102724885 942087857 /nfs/dbraw/zinc/08/78/57/942087857.db2.gz QXWLYEYNKGCZIX-UHFFFAOYSA-N 0 0 355.375 3.979 20 5 FHBDRN C[C@@H](NC(=O)c1c(Cl)cccc1[N+](=O)[O-])c1ccc2c(c1)CCC(=O)N2 ZINC000110224054 942094820 /nfs/dbraw/zinc/09/48/20/942094820.db2.gz FKWZOFPUNSNSTB-SNVBAGLBSA-N 0 0 373.796 3.624 20 5 FHBDRN C[C@H](NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)c1ccc(F)cc1F ZINC000513722826 942097747 /nfs/dbraw/zinc/09/77/47/942097747.db2.gz ADHITVAZUQDKKJ-QMMMGPOBSA-N 0 0 372.274 3.965 20 5 FHBDRN Cn1ccnc1-c1cccc(CNC(=O)c2cc([N+](=O)[O-])ccc2Cl)c1 ZINC000366632327 942100813 /nfs/dbraw/zinc/10/08/13/942100813.db2.gz QCZMGXVJUPKXQM-UHFFFAOYSA-N 0 0 370.796 3.579 20 5 FHBDRN CCC(CC)[C@H]1C[C@H](NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])CCO1 ZINC000183358899 942117754 /nfs/dbraw/zinc/11/77/54/942117754.db2.gz WNYJPJKFPKTIKF-CZUORRHYSA-N 0 0 354.834 3.962 20 5 FHBDRN CCC(CC)[C@H]1C[C@H](NC(=O)c2ccc([N+](=O)[O-])c3cccnc23)CCO1 ZINC000183357484 942117951 /nfs/dbraw/zinc/11/79/51/942117951.db2.gz IWAVJNXYEAFFSI-RDTXWAMCSA-N 0 0 371.437 3.857 20 5 FHBDRN COC(=O)c1nc([C@H]2CCCN2c2ccc([N+](=O)[O-])cc2F)sc1C ZINC000280160144 942120038 /nfs/dbraw/zinc/12/00/38/942120038.db2.gz CTTYVWBFZRCWCX-CYBMUJFWSA-N 0 0 365.386 3.627 20 5 FHBDRN CCOc1ccc(NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)cc1OC ZINC000128371150 942120162 /nfs/dbraw/zinc/12/01/62/942120162.db2.gz DJBOEOIVGFHXSW-UHFFFAOYSA-N 0 0 350.758 3.908 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N2C[C@H](C)Cc3ccccc32)c1F ZINC000413371498 942121365 /nfs/dbraw/zinc/12/13/65/942121365.db2.gz MXZCNBYAOHIJRH-GFCCVEGCSA-N 0 0 358.369 3.510 20 5 FHBDRN CC(=O)c1ccc2c(c1)CN(C(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)C2 ZINC000413372149 942121419 /nfs/dbraw/zinc/12/14/19/942121419.db2.gz XDIIDVWQCLHRPO-ZDUSSCGKSA-N 0 0 367.405 3.892 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)NCCCc2c[nH]c3ccc(F)cc23)c1 ZINC000501944690 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3.603 20 5 FHBDRN C[C@@H](CCCc1cccnc1)Nc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 ZINC000413395883 942142975 /nfs/dbraw/zinc/14/29/75/942142975.db2.gz OBTLJNXZOWRIHJ-ZDUSSCGKSA-N 0 0 354.410 3.698 20 5 FHBDRN O=C(NCCc1cccc2[nH]ccc21)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000501972679 942146354 /nfs/dbraw/zinc/14/63/54/942146354.db2.gz CTRHLTQUFYHYFL-UHFFFAOYSA-N 0 0 364.405 3.623 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1CCOC2(CCCCC2)C1 ZINC000280281563 942150014 /nfs/dbraw/zinc/15/00/14/942150014.db2.gz YWMUQDYWSSXOAG-AWEZNQCLSA-N 0 0 362.426 3.605 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(N2CC[C@@H](C(F)(F)F)C3(CCOCC3)C2)c1 ZINC000413402909 942152756 /nfs/dbraw/zinc/15/27/56/942152756.db2.gz WFQYEDOGMODNSB-OAHLLOKOSA-N 0 0 374.359 3.789 20 5 FHBDRN CCOc1ccc2c(c1)CCN(C(=O)c1ccc(Cl)cc1[N+](=O)[O-])C2 ZINC000434095433 942164929 /nfs/dbraw/zinc/16/49/29/942164929.db2.gz IIBGPLKXEJIQRD-UHFFFAOYSA-N 0 0 360.797 3.845 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@](CO)(C(C)C)C1 ZINC000378012721 942165335 /nfs/dbraw/zinc/16/53/35/942165335.db2.gz ZBVSMTXPADRBCZ-SFHVURJKSA-N 0 0 366.483 3.576 20 5 FHBDRN CCc1ccc(C(=O)NCC2(c3ccncc3)CCCC2)cc1[N+](=O)[O-] ZINC000502007760 942165576 /nfs/dbraw/zinc/16/55/76/942165576.db2.gz CLFKIOCVGUKWFC-UHFFFAOYSA-N 0 0 353.422 3.794 20 5 FHBDRN C[C@H](c1ccccc1[N+](=O)[O-])N1C(=O)[C@@H]2CC[C@@H](c3ccccc3)N2C1=O ZINC000280369871 942168523 /nfs/dbraw/zinc/16/85/23/942168523.db2.gz KLXQAARIONQKNS-SKDZVZGDSA-N 0 0 365.389 3.824 20 5 FHBDRN O=C(NCc1ccc(F)cc1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000047744527 942173808 /nfs/dbraw/zinc/17/38/08/942173808.db2.gz ADMMZJGYDMEILD-UHFFFAOYSA-N 0 0 372.274 3.605 20 5 FHBDRN CCNc1ccc(C(=O)N2CCc3cc(OCC)ccc3C2)cc1[N+](=O)[O-] ZINC000434097469 942180284 /nfs/dbraw/zinc/18/02/84/942180284.db2.gz HZXJIKNDDFIFSM-UHFFFAOYSA-N 0 0 369.421 3.624 20 5 FHBDRN O=[N+]([O-])c1cnc(NC2CCC(C(F)F)CC2)c(Br)c1 ZINC000413433635 942183880 /nfs/dbraw/zinc/18/38/80/942183880.db2.gz CRQBQLZMQJEPPF-UHFFFAOYSA-N 0 0 350.163 3.988 20 5 FHBDRN COc1ccccc1C(C)(C)NC(=O)c1cc(SC)ccc1[N+](=O)[O-] ZINC000103035899 942187877 /nfs/dbraw/zinc/18/78/77/942187877.db2.gz BYXMIILYDBPGAB-UHFFFAOYSA-N 0 0 360.435 3.990 20 5 FHBDRN O=C(NC[C@H]1CCC(F)(F)C1)c1cccc([N+](=O)[O-])c1Br ZINC000280577739 942206355 /nfs/dbraw/zinc/20/63/55/942206355.db2.gz KYQYYSWDZLYMNP-QMMMGPOBSA-N 0 0 363.158 3.523 20 5 FHBDRN C[C@@H](CNC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000513698435 942207568 /nfs/dbraw/zinc/20/75/68/942207568.db2.gz APUHORQQPOKFMM-JTQLQIEISA-N 0 0 368.311 3.869 20 5 FHBDRN Cc1ccc(NC(=O)c2ccc(N3C[C@@H]4C[C@H]3CS4)c([N+](=O)[O-])c2)cc1 ZINC000413449025 942209976 /nfs/dbraw/zinc/20/99/76/942209976.db2.gz GGYQTZSCSOHJAD-HOTGVXAUSA-N 0 0 369.446 3.850 20 5 FHBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)N1CCC[C@H](CC(F)(F)F)C1 ZINC000420821421 942213216 /nfs/dbraw/zinc/21/32/16/942213216.db2.gz RGXIRZPCLICVTD-CYBMUJFWSA-N 0 0 359.348 3.511 20 5 FHBDRN C[C@H](NC(=O)c1c(Cl)cccc1[N+](=O)[O-])c1nc2ccccc2n1C ZINC000137155991 942217048 /nfs/dbraw/zinc/21/70/48/942217048.db2.gz CBBQKDSANTWSLA-JTQLQIEISA-N 0 0 358.785 3.626 20 5 FHBDRN CO[C@@H]1Cc2ccccc2N(C(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)C1 ZINC000412318151 942217506 /nfs/dbraw/zinc/21/75/06/942217506.db2.gz GDJOWSXNAWULJL-MRXNPFEDSA-N 0 0 370.405 3.600 20 5 FHBDRN CN(CCOc1ccccc1Cl)C(=O)/C=C/c1ccc([N+](=O)[O-])cc1 ZINC000016175410 942219118 /nfs/dbraw/zinc/21/91/18/942219118.db2.gz NBICNIJEVCJACQ-DHZHZOJOSA-N 0 0 360.797 3.799 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)N(Cc1cccc(F)c1)C[C@H]1CCCO1 ZINC000051190817 942226532 /nfs/dbraw/zinc/22/65/32/942226532.db2.gz WDVOQELFNNEZNN-GOSISDBHSA-N 0 0 373.384 3.947 20 5 FHBDRN CN([C@@H](c1ccccc1)C(F)(F)F)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000103163040 942228928 /nfs/dbraw/zinc/22/89/28/942228928.db2.gz CBCCCTZNMTXQMR-AWEZNQCLSA-N 0 0 374.340 3.519 20 5 FHBDRN C[C@@H](NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)[C@H](C)c1ccccc1 ZINC000473542284 942230330 /nfs/dbraw/zinc/23/03/30/942230330.db2.gz ASZJEDHWUHJUMH-LSDHHAIUSA-N 0 0 364.405 3.703 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)NC(C)(C)c2cccc(C)c2)c1F ZINC000413472486 942231422 /nfs/dbraw/zinc/23/14/22/942231422.db2.gz HBWUBDMMLYVKDE-UHFFFAOYSA-N 0 0 360.385 3.645 20 5 FHBDRN COc1cc2c(c(OC)c1)N(C(=O)c1ccc(C)c([N+](=O)[O-])c1)CCC2 ZINC000415990081 942231881 /nfs/dbraw/zinc/23/18/81/942231881.db2.gz BZXHMFPIHYYRQK-UHFFFAOYSA-N 0 0 356.378 3.513 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N[C@@H]1CCC[C@@H]1OCc1ccccc1 ZINC000122796877 942235263 /nfs/dbraw/zinc/23/52/63/942235263.db2.gz FNHWZAMOZOSZMD-UXHICEINSA-N 0 0 368.433 3.782 20 5 FHBDRN COc1ccc(CN(C)C(=O)CCOc2cc(C)ccc2[N+](=O)[O-])cc1C ZINC000103218027 942235555 /nfs/dbraw/zinc/23/55/55/942235555.db2.gz VDWCVLCFPXANII-UHFFFAOYSA-N 0 0 372.421 3.648 20 5 FHBDRN CC[C@@H](Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])c1ccccc1 ZINC000413488519 942240247 /nfs/dbraw/zinc/24/02/47/942240247.db2.gz PMSJSWYZIZGMOQ-QGZVFWFLSA-N 0 0 369.421 3.630 20 5 FHBDRN O=C(NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N[C@@H]1CCCC[C@H]1F ZINC000413492154 942243397 /nfs/dbraw/zinc/24/33/97/942243397.db2.gz CKMHZZNJCCHESO-CHWSQXEVSA-N 0 0 363.311 3.694 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)O[C@H](C)C(=O)Nc2cccc(C)c2)c1 ZINC000016196582 942247424 /nfs/dbraw/zinc/24/74/24/942247424.db2.gz DXSXMGWRPTVVCG-GFCCVEGCSA-N 0 0 374.418 3.809 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)O[C@@H](C)C(=O)Nc2cccc(C)c2)c1 ZINC000016196581 942247513 /nfs/dbraw/zinc/24/75/13/942247513.db2.gz DXSXMGWRPTVVCG-LBPRGKRZSA-N 0 0 374.418 3.809 20 5 FHBDRN C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1ccn(-c2cccc(F)c2)n1 ZINC000103374844 942247882 /nfs/dbraw/zinc/24/78/82/942247882.db2.gz MZAAWNQZVYGXOJ-GFCCVEGCSA-N 0 0 366.352 3.511 20 5 FHBDRN CC(C)C(=O)Nc1ccc(C(=O)N2c3ccc([N+](=O)[O-])cc3C[C@H]2C)cc1 ZINC000103376049 942248630 /nfs/dbraw/zinc/24/86/30/942248630.db2.gz REVGSGURHPNIHJ-CYBMUJFWSA-N 0 0 367.405 3.781 20 5 FHBDRN CCOc1ccc(C(=O)N2c3ccc([N+](=O)[O-])cc3C[C@H]2C)cc1OC ZINC000103377778 942249152 /nfs/dbraw/zinc/24/91/52/942249152.db2.gz MTQGEAASVIZVSI-GFCCVEGCSA-N 0 0 356.378 3.594 20 5 FHBDRN C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)Cc1csc(C(C)(C)C)n1 ZINC000103375288 942249195 /nfs/dbraw/zinc/24/91/95/942249195.db2.gz HNDKRDGFCLNNGA-NSHDSACASA-N 0 0 359.451 3.869 20 5 FHBDRN O=c1c([N+](=O)[O-])cc(Cl)cn1CCOc1cc(Cl)cc(Cl)c1 ZINC000502137501 942251354 /nfs/dbraw/zinc/25/13/54/942251354.db2.gz WOORDRPHMXCUDZ-UHFFFAOYSA-N 0 0 363.584 3.796 20 5 FHBDRN Cc1ccn2ncc(C(=O)N(Cc3ccc([N+](=O)[O-])cc3)C(C)C)c2c1 ZINC000501005396 942254160 /nfs/dbraw/zinc/25/41/60/942254160.db2.gz ZXXKXMBRGBBRPB-UHFFFAOYSA-N 0 0 352.394 3.602 20 5 FHBDRN O=[N+]([O-])c1ccc(N2C[C@@H](O)C[C@@H]2c2ccccc2)cc1OC(F)F ZINC000413494950 942254961 /nfs/dbraw/zinc/25/49/61/942254961.db2.gz AWVJSWXOYZPARH-DZGCQCFKSA-N 0 0 350.321 3.509 20 5 FHBDRN Cc1cc(Cl)ccc1OCCCNC(=O)c1csc([N+](=O)[O-])c1 ZINC000501009865 942255677 /nfs/dbraw/zinc/25/56/77/942255677.db2.gz FIMABVAKTZLRCP-UHFFFAOYSA-N 0 0 354.815 3.817 20 5 FHBDRN CN(C)c1cccc(CCC(=O)N2CCCc3c([N+](=O)[O-])cccc32)c1 ZINC000472934446 942256935 /nfs/dbraw/zinc/25/69/35/942256935.db2.gz YNGJBQKQMYQVBI-UHFFFAOYSA-N 0 0 353.422 3.573 20 5 FHBDRN Cc1sc(C(=O)N2CCO[C@H](c3ccccc3Cl)C2)cc1[N+](=O)[O-] ZINC000103445381 942260025 /nfs/dbraw/zinc/26/00/25/942260025.db2.gz ZAEXMODIFIQCFA-AWEZNQCLSA-N 0 0 366.826 3.832 20 5 FHBDRN Cc1cccc(C(=O)N2CCO[C@H](c3ccccc3Cl)C2)c1[N+](=O)[O-] ZINC000103445489 942260107 /nfs/dbraw/zinc/26/01/07/942260107.db2.gz SCKQPKZIYKLXCZ-INIZCTEOSA-N 0 0 360.797 3.770 20 5 FHBDRN COc1cc(C2(C(=O)NCc3ccc([N+](=O)[O-])cc3)CCC2)ccc1C ZINC000502169868 942260126 /nfs/dbraw/zinc/26/01/26/942260126.db2.gz RCMXCGIHXCIPEY-UHFFFAOYSA-N 0 0 354.406 3.650 20 5 FHBDRN Cc1cc(C(=O)N2CCO[C@@H](c3ccccc3Cl)C2)cc([N+](=O)[O-])c1 ZINC000103444938 942260129 /nfs/dbraw/zinc/26/01/29/942260129.db2.gz JEGYTOOKKPWJAI-QGZVFWFLSA-N 0 0 360.797 3.770 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1F)N1CCO[C@@H](c2ccccc2Cl)C1 ZINC000103445114 942260217 /nfs/dbraw/zinc/26/02/17/942260217.db2.gz RHZPLFBIUNNKFQ-MRXNPFEDSA-N 0 0 364.760 3.601 20 5 FHBDRN Cc1cc(C)cc([C@H](C)NC(=O)NCCNc2ccc([N+](=O)[O-])cc2)c1 ZINC000502172605 942263003 /nfs/dbraw/zinc/26/30/03/942263003.db2.gz PHLVYELIZIQUHI-HNNXBMFYSA-N 0 0 356.426 3.684 20 5 FHBDRN Cc1c(NC(=O)[C@H](C)N2CCC[C@H](CC(F)(F)F)C2)cccc1[N+](=O)[O-] ZINC000420954707 942274231 /nfs/dbraw/zinc/27/42/31/942274231.db2.gz VAWFFWXMWIXFBK-QWHCGFSZSA-N 0 0 373.375 3.895 20 5 FHBDRN CCOC(=O)c1csc(CSCc2cc([N+](=O)[O-])ccc2OC)n1 ZINC000419478253 942274278 /nfs/dbraw/zinc/27/42/78/942274278.db2.gz MLVNATPTVHXZBL-UHFFFAOYSA-N 0 0 368.436 3.670 20 5 FHBDRN Cc1c(NC(=O)[C@@H](C)N2CCC[C@@H](CC(F)(F)F)C2)cccc1[N+](=O)[O-] ZINC000420954705 942274524 /nfs/dbraw/zinc/27/45/24/942274524.db2.gz VAWFFWXMWIXFBK-OLZOCXBDSA-N 0 0 373.375 3.895 20 5 FHBDRN CCOC(=O)c1csc(CSCc2cccc([N+](=O)[O-])c2C)n1 ZINC000419484869 942276532 /nfs/dbraw/zinc/27/65/32/942276532.db2.gz XJPSRPDAMWCUKA-UHFFFAOYSA-N 0 0 352.437 3.970 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(C)c1cccc(C(C)C)c1 ZINC000063182009 942289088 /nfs/dbraw/zinc/28/90/88/942289088.db2.gz QDUKBLAJLOJKAO-UHFFFAOYSA-N 0 0 364.423 3.552 20 5 FHBDRN CCn1cc([C@@H]2OCC[C@H]2CNc2ccc([N+](=O)[O-])c3cnccc23)cn1 ZINC000413517572 942291157 /nfs/dbraw/zinc/29/11/57/942291157.db2.gz SJTUXZGYAGPCCJ-ORAYPTAESA-N 0 0 367.409 3.549 20 5 FHBDRN CCC(=O)c1ccc(NCc2nccc(C(F)(F)F)n2)c([N+](=O)[O-])c1 ZINC000413519311 942291974 /nfs/dbraw/zinc/29/19/74/942291974.db2.gz SAHZWYMUOSUUQK-UHFFFAOYSA-N 0 0 354.288 3.608 20 5 FHBDRN O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCC[C@H]1Cc1cc(F)ccc1F ZINC000416048780 942295246 /nfs/dbraw/zinc/29/52/46/942295246.db2.gz OHRYTNYIRWSQBB-HNNXBMFYSA-N 0 0 364.323 3.859 20 5 FHBDRN COc1ccc(CSCC(=O)N2CC[C@H](C)C[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000502217567 942295647 /nfs/dbraw/zinc/29/56/47/942295647.db2.gz DEVKFNZUNKTTPN-UONOGXRCSA-N 0 0 366.483 3.731 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)N1CCC[C@H]1Cc1cc(F)ccc1F ZINC000416050008 942296058 /nfs/dbraw/zinc/29/60/58/942296058.db2.gz QADMEPBHTQDKIJ-KRWDZBQOSA-N 0 0 360.360 3.649 20 5 FHBDRN COc1cc2c(c(OC)c1)N(C(=O)c1ccc([N+](=O)[O-])cc1C)CCC2 ZINC000416050989 942301528 /nfs/dbraw/zinc/30/15/28/942301528.db2.gz SPMDTBBVRKJEGS-UHFFFAOYSA-N 0 0 356.378 3.513 20 5 FHBDRN CCSc1ccc([C@@H](C)NC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000103631006 942302311 /nfs/dbraw/zinc/30/23/11/942302311.db2.gz RRSAQCDCYMVHNV-GFCCVEGCSA-N 0 0 373.434 3.523 20 5 FHBDRN Cc1cc(=O)n(CCCOc2cccc(C(F)(F)F)c2)cc1[N+](=O)[O-] ZINC000128431113 942302574 /nfs/dbraw/zinc/30/25/74/942302574.db2.gz HGYFNTMXEOFXDK-UHFFFAOYSA-N 0 0 356.300 3.553 20 5 FHBDRN Cc1cc(/C=C2/CCn3c2nc2ccc([N+](=O)[O-])cc2c3=O)ccc1F ZINC000103717344 942303796 /nfs/dbraw/zinc/30/37/96/942303796.db2.gz JWCBJVKJHCKGTL-LCYFTJDESA-N 0 0 351.337 3.697 20 5 FHBDRN C[C@@H]1CN(C)c2ccccc2N(C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)C1 ZINC000413522923 942309435 /nfs/dbraw/zinc/30/94/35/942309435.db2.gz SRKPZBNYLDBHJE-FHLIZLRMSA-N 0 0 365.433 3.817 20 5 FHBDRN CCC(=O)c1ccc(N2CCC[C@H]2C[C@@H](O)c2ccco2)c([N+](=O)[O-])c1 ZINC000366425942 942312919 /nfs/dbraw/zinc/31/29/19/942312919.db2.gz DJMHKCDFERZIEI-KBXCAEBGSA-N 0 0 358.394 3.873 20 5 FHBDRN C[C@H]1CCSCCN1C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000501126479 942313236 /nfs/dbraw/zinc/31/32/36/942313236.db2.gz WWNYWKYCFZNGFP-VIFPVBQESA-N 0 0 374.260 3.717 20 5 FHBDRN COc1ccccc1CCN(C)C(=O)Nc1c(C)ccc([N+](=O)[O-])c1C ZINC000085638532 942322542 /nfs/dbraw/zinc/32/25/42/942322542.db2.gz OSLWWXSKCMUGRF-UHFFFAOYSA-N 0 0 357.410 3.927 20 5 FHBDRN Cc1nn(C)c(C)c1[C@H]1CCCN1c1ccc([N+](=O)[O-])c2ncccc12 ZINC000413125823 942323618 /nfs/dbraw/zinc/32/36/18/942323618.db2.gz JEMAEVIGCAHXGE-MRXNPFEDSA-N 0 0 351.410 3.835 20 5 FHBDRN COc1cc(C(=O)N2c3ccccc3N(C)CC[C@H]2C)cc([N+](=O)[O-])c1C ZINC000188064490 942324539 /nfs/dbraw/zinc/32/45/39/942324539.db2.gz MBCLNONFQANYOZ-CYBMUJFWSA-N 0 0 369.421 3.787 20 5 FHBDRN CO[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2SC(C)C)CC[C@H]1C ZINC000188071634 942325935 /nfs/dbraw/zinc/32/59/35/942325935.db2.gz JEFDQQUHALUTGF-IUODEOHRSA-N 0 0 352.456 3.592 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1COCc2ccccc21 ZINC000416080968 942327271 /nfs/dbraw/zinc/32/72/71/942327271.db2.gz MEXWGWANFVSMME-BEFAXECRSA-N 0 0 354.406 3.551 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(O)c(COC(C)C)c2)c1 ZINC000290661954 942337171 /nfs/dbraw/zinc/33/71/71/942337171.db2.gz RVIUCHICZKMYGQ-UHFFFAOYSA-N 0 0 374.393 3.876 20 5 FHBDRN Cc1cc(NC(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)nn1C(C)C ZINC000421086211 942337395 /nfs/dbraw/zinc/33/73/95/942337395.db2.gz JCVWKBJUTOHJRB-UHFFFAOYSA-N 0 0 371.319 3.765 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1)N(Cc1ccncc1)Cc1cccnc1 ZINC000051283287 942343469 /nfs/dbraw/zinc/34/34/69/942343469.db2.gz MZBVSZFTOFNXDS-UHFFFAOYSA-N 0 0 363.377 3.619 20 5 FHBDRN COC(=O)[C@@H](CNc1ccc([N+](=O)[O-])c2cnccc12)c1ccc(C)cc1 ZINC000501202980 942348057 /nfs/dbraw/zinc/34/80/57/942348057.db2.gz WKSVOHOFTHMHIR-INIZCTEOSA-N 0 0 365.389 3.820 20 5 FHBDRN O=C(C1CCC1)N(CCCNc1ccc([N+](=O)[O-])c2ncccc12)C1CC1 ZINC000413143886 942348071 /nfs/dbraw/zinc/34/80/71/942348071.db2.gz XDXIVESXZGVGNO-UHFFFAOYSA-N 0 0 368.437 3.736 20 5 FHBDRN C[C@@H](NC(=O)Cc1cccc([N+](=O)[O-])c1)c1ccc(OCC2CC2)c(F)c1 ZINC000120192828 942349784 /nfs/dbraw/zinc/34/97/84/942349784.db2.gz RZFRNRNETIUUHI-CYBMUJFWSA-N 0 0 372.396 3.943 20 5 FHBDRN O=C(c1c[nH]c(=O)c([N+](=O)[O-])c1)N(Cc1ccccc1)Cc1ccccc1 ZINC000188131106 942350592 /nfs/dbraw/zinc/35/05/92/942350592.db2.gz ZXWYHDOHNXIZHM-UHFFFAOYSA-N 0 0 363.373 3.538 20 5 FHBDRN Cc1cc(F)cc([C@@]2(F)CCN(C(=O)Cc3cccc([N+](=O)[O-])c3)C2)c1 ZINC000501222446 942351048 /nfs/dbraw/zinc/35/10/48/942351048.db2.gz LLEFSOFWTKADQM-LJQANCHMSA-N 0 0 360.360 3.682 20 5 FHBDRN COc1cccc(C=C2CCN(C(=O)Cc3ccccc3[N+](=O)[O-])CC2)c1 ZINC000472939328 942351739 /nfs/dbraw/zinc/35/17/39/942351739.db2.gz IVKWREQCCOUCKA-UHFFFAOYSA-N 0 0 366.417 3.852 20 5 FHBDRN CC(=O)c1ccc2c(c1)CN(C(=O)N[C@@H](C)c1ccc([N+](=O)[O-])cc1)C2 ZINC000413564547 942352771 /nfs/dbraw/zinc/35/27/71/942352771.db2.gz FXTMNLLQGNVRAQ-LBPRGKRZSA-N 0 0 353.378 3.584 20 5 FHBDRN O=C(c1ccc(NC2CC2)c([N+](=O)[O-])c1)N1CCSC[C@@H]1C1CCC1 ZINC000416115743 942359627 /nfs/dbraw/zinc/35/96/27/942359627.db2.gz QUAPMBUWKVYPPI-QGZVFWFLSA-N 0 0 361.467 3.527 20 5 FHBDRN COc1ccccc1CN(CC(=O)Nc1ccc([N+](=O)[O-])cc1C)C1CC1 ZINC000072578936 942361621 /nfs/dbraw/zinc/36/16/21/942361621.db2.gz ORMBHAJYOUHLMM-UHFFFAOYSA-N 0 0 369.421 3.515 20 5 FHBDRN O=C(Nc1cc(F)ccc1OC[C@H]1CCCO1)c1cccc([N+](=O)[O-])c1 ZINC000502315149 942362011 /nfs/dbraw/zinc/36/20/11/942362011.db2.gz WXEOLZNTOPLAAZ-OAHLLOKOSA-N 0 0 360.341 3.544 20 5 FHBDRN O=C(c1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCSC[C@@H]1C1CCC1 ZINC000416119713 942365052 /nfs/dbraw/zinc/36/50/52/942365052.db2.gz YXPTXCZVIGPJQI-CQSZACIVSA-N 0 0 374.384 3.971 20 5 FHBDRN CS(=O)(=O)CC1(CNc2c(Cl)cc([N+](=O)[O-])cc2Cl)CCC1 ZINC000413578518 942371651 /nfs/dbraw/zinc/37/16/51/942371651.db2.gz JWAVGUVFDMHOMA-UHFFFAOYSA-N 0 0 367.254 3.528 20 5 FHBDRN CCc1cnccc1C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000501281592 942380563 /nfs/dbraw/zinc/38/05/63/942380563.db2.gz FDILZWBLMMTVEO-UHFFFAOYSA-N 0 0 350.172 3.567 20 5 FHBDRN CC[C@@H](CO)N(C)C(=O)c1ccc(SCCC(C)C)c([N+](=O)[O-])c1 ZINC000452286510 942396619 /nfs/dbraw/zinc/39/66/19/942396619.db2.gz XTTUCDDRSDSJIW-AWEZNQCLSA-N 0 0 354.472 3.576 20 5 FHBDRN Cc1nc(-c2cccc(NC(=O)[C@H](C)c3ccc([N+](=O)[O-])cc3F)c2)no1 ZINC000183247867 942398169 /nfs/dbraw/zinc/39/81/69/942398169.db2.gz HUDAJYTWBSTDFO-SNVBAGLBSA-N 0 0 370.340 3.835 20 5 FHBDRN C[C@H]1CCN(C(=O)c2ccc(Br)cc2[N+](=O)[O-])C[C@H](C)C1 ZINC000502370574 942402471 /nfs/dbraw/zinc/40/24/71/942402471.db2.gz VLCWALAQKFOLCO-WDEREUQCSA-N 0 0 355.232 3.866 20 5 FHBDRN CC[C@@H](Cc1ccccc1C)C(=O)N1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000424836125 942412637 /nfs/dbraw/zinc/41/26/37/942412637.db2.gz SEHLABVOHZIQEH-INIZCTEOSA-N 0 0 368.433 3.893 20 5 FHBDRN COc1ccc(F)c(C(=O)Nc2ccc([N+](=O)[O-])c3ncccc23)c1OC ZINC001268853740 942414601 /nfs/dbraw/zinc/41/46/01/942414601.db2.gz HGXZFCGGLNBUDD-UHFFFAOYSA-N 0 0 371.324 3.552 20 5 FHBDRN COc1ccc2c(CC(=O)Oc3ccc(OC)cc3[N+](=O)[O-])coc2c1 ZINC000014785461 942417932 /nfs/dbraw/zinc/41/79/32/942417932.db2.gz RNVIORGYZQCURS-UHFFFAOYSA-N 0 0 357.318 3.506 20 5 FHBDRN COc1ccc(OC(=O)c2cccc(Br)c2)c([N+](=O)[O-])c1 ZINC000014785514 942418942 /nfs/dbraw/zinc/41/89/42/942418942.db2.gz LMRMWFWAQAWZMM-UHFFFAOYSA-N 0 0 352.140 3.585 20 5 FHBDRN CN(C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)c1ccc2cc[nH]c2c1 ZINC000473538331 942425765 /nfs/dbraw/zinc/42/57/65/942425765.db2.gz GUXVRBUPZVHACM-UHFFFAOYSA-N 0 0 350.378 3.927 20 5 FHBDRN O=[N+]([O-])c1ccccc1/C=C/CNC1(c2noc(C(F)F)n2)CCC1 ZINC000366482093 942433977 /nfs/dbraw/zinc/43/39/77/942433977.db2.gz MHZLLRREPLEFQI-ZZXKWVIFSA-N 0 0 350.325 3.598 20 5 FHBDRN CCOc1ccc(CNC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)cc1 ZINC000513743982 942434105 /nfs/dbraw/zinc/43/41/05/942434105.db2.gz FNELWOWJEGPZKE-UHFFFAOYSA-N 0 0 366.320 3.525 20 5 FHBDRN COc1ccc(OC)c([C@@H]2CCCN2C(=O)Cc2ccccc2[N+](=O)[O-])c1 ZINC000015827663 942435411 /nfs/dbraw/zinc/43/54/11/942435411.db2.gz UJUAFRUVIORNCJ-SFHVURJKSA-N 0 0 370.405 3.518 20 5 FHBDRN COc1ccccc1N1CC[C@H](Nc2nccc3ccc([N+](=O)[O-])cc32)C1 ZINC000413181887 942436982 /nfs/dbraw/zinc/43/69/82/942436982.db2.gz FSENFWCHJHPKFP-HNNXBMFYSA-N 0 0 364.405 3.842 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)C(F)(F)F)cc1N[C@@H]1CCC[C@@H](CO)C1 ZINC000413620998 942442067 /nfs/dbraw/zinc/44/20/67/942442067.db2.gz XWXQFQGUSRUPAJ-RKDXNWHRSA-N 0 0 369.290 3.607 20 5 FHBDRN CCC(=O)c1ccc(N[C@H]2CCCc3cn(CCOC)nc32)c([N+](=O)[O-])c1 ZINC000366828932 942442760 /nfs/dbraw/zinc/44/27/60/942442760.db2.gz PMOZIZDCFXOFNN-INIZCTEOSA-N 0 0 372.425 3.520 20 5 FHBDRN O=C(COc1cccc([N+](=O)[O-])c1)Nc1ccc2[nH]c(C3CCC3)nc2c1 ZINC000502444363 942455745 /nfs/dbraw/zinc/45/57/45/942455745.db2.gz PJXWRNADMXGPML-UHFFFAOYSA-N 0 0 366.377 3.756 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)c2ccc(-n3cccn3)c(F)c2)c1 ZINC000505323236 942462290 /nfs/dbraw/zinc/46/22/90/942462290.db2.gz QSPSKVMJRCEQOF-CYBMUJFWSA-N 0 0 368.368 3.719 20 5 FHBDRN CCSc1cccc(NS(=O)(=O)c2cc([N+](=O)[O-])ccc2C)c1 ZINC000505323847 942463038 /nfs/dbraw/zinc/46/30/38/942463038.db2.gz ZJHGIZKVAAFBSH-UHFFFAOYSA-N 0 0 352.437 3.816 20 5 FHBDRN C[C@@H](c1ccc([N+](=O)[O-])cc1)N1C(=O)[C@H](C)N(Cc2ccccc2)C1=O ZINC000419962312 942467813 /nfs/dbraw/zinc/46/78/13/942467813.db2.gz GWFAQZONVFPQOI-KBPBESRZSA-N 0 0 353.378 3.509 20 5 FHBDRN CCC(=O)c1ccc(N2CCOC[C@H]2c2nc(C)cs2)c([N+](=O)[O-])c1 ZINC000366858402 942469244 /nfs/dbraw/zinc/46/92/44/942469244.db2.gz OUFVLUQIWUEMFG-HNNXBMFYSA-N 0 0 361.423 3.530 20 5 FHBDRN CCSc1ccc(CC(=O)Nc2ccc3cc([N+](=O)[O-])ccc3n2)cc1 ZINC000505310549 942470315 /nfs/dbraw/zinc/47/03/15/942470315.db2.gz LEMJJXIMZOLFGL-UHFFFAOYSA-N 0 0 367.430 3.858 20 5 FHBDRN CC(C)n1cc2c(n1)C[C@H](Nc1nccc3ccc([N+](=O)[O-])cc31)CC2 ZINC000413209539 942478913 /nfs/dbraw/zinc/47/89/13/942478913.db2.gz URPSRYSSBAIXFU-OAHLLOKOSA-N 0 0 351.410 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CCO[C@H](C(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1)c1ccccc1 ZINC000413667275 942492985 /nfs/dbraw/zinc/49/29/85/942492985.db2.gz HVZUBVOVXFIAQM-IBGZPJMESA-N 0 0 354.406 3.864 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N2CCC[C@H]2/C=C\c2ccccc2)c1 ZINC000505359245 942500166 /nfs/dbraw/zinc/50/01/66/942500166.db2.gz IFIJYSSXPMHABA-YDZSZYSISA-N 0 0 352.390 3.921 20 5 FHBDRN Cn1cc([N+](=O)[O-])cc1C(=O)N1CCC[C@H]1c1nc2ccccc2s1 ZINC000024583713 942503331 /nfs/dbraw/zinc/50/33/31/942503331.db2.gz FBEYHWDRQVVZGY-ZDUSSCGKSA-N 0 0 356.407 3.520 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)[C@H]1CC(C)(C)Oc2ccccc21 ZINC000412338775 942503347 /nfs/dbraw/zinc/50/33/47/942503347.db2.gz SQAXBMQFZOZFSE-KRWDZBQOSA-N 0 0 368.433 3.941 20 5 FHBDRN COCCOc1ccccc1NC(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1 ZINC000413226813 942512124 /nfs/dbraw/zinc/51/21/24/942512124.db2.gz IBJJFRSHKHKRPL-UHFFFAOYSA-N 0 0 374.393 3.660 20 5 FHBDRN O=[N+]([O-])c1cnc(N[C@H]2CCO[C@H]2c2ccc(Cl)c(F)c2)c(F)c1 ZINC000413228778 942515979 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20 5 FHBDRN O=[N+]([O-])c1ccc(-c2nc(CN3CCCC[C@@H]3Cn3cccn3)co2)cc1 ZINC000378307063 942563434 /nfs/dbraw/zinc/56/34/34/942563434.db2.gz BOFBGRYBMWAGMD-GOSISDBHSA-N 0 0 367.409 3.501 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1C[C@H](c2ccccc2)OC[C@@H]1C ZINC000421452692 942564692 /nfs/dbraw/zinc/56/46/92/942564692.db2.gz BKHUNONXRRHYCY-HNAYVOBHSA-N 0 0 354.406 3.814 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N(C)CC(=O)Nc1c(C)cccc1C ZINC000421452009 942564849 /nfs/dbraw/zinc/56/48/49/942564849.db2.gz LYXHALBPERPTLY-UHFFFAOYSA-N 0 0 369.421 3.539 20 5 FHBDRN O=[N+]([O-])c1ccc2nc(N3CCO[C@@H](c4ccc(F)c(F)c4)C3)ccc2c1 ZINC000066815291 942565815 /nfs/dbraw/zinc/56/58/15/942565815.db2.gz JLEAJBLLNAXKPU-GOSISDBHSA-N 0 0 371.343 3.999 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)Nc1ccccc1OCC(F)(F)F ZINC000014127738 942565946 /nfs/dbraw/zinc/56/59/46/942565946.db2.gz PEQJAPYMDUUEKA-UHFFFAOYSA-N 0 0 370.283 3.553 20 5 FHBDRN Cn1c2ccc([N+](=O)[O-])cc2nc1-c1ccc(OC[C@@H]2CCCO2)cc1 ZINC000513857605 942566408 /nfs/dbraw/zinc/56/64/08/942566408.db2.gz NVFQBDONSLBSSL-INIZCTEOSA-N 0 0 353.378 3.706 20 5 FHBDRN Cc1c(Br)c(=O)n(CCCc2ccsc2)cc1[N+](=O)[O-] ZINC000541290584 942567599 /nfs/dbraw/zinc/56/75/99/942567599.db2.gz JDPJIDBEDVMJPH-UHFFFAOYSA-N 0 0 357.229 3.522 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC(OC2CCC2)CC1 ZINC000416260744 942568155 /nfs/dbraw/zinc/56/81/55/942568155.db2.gz SRHVXDQVVQGMQS-CYBMUJFWSA-N 0 0 364.467 3.636 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)Nc1ccc(NC(=O)NC2CC2)cc1 ZINC000421436245 942572345 /nfs/dbraw/zinc/57/23/45/942572345.db2.gz QQNXVALQGMFQQT-UHFFFAOYSA-N 0 0 368.393 3.748 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CCC[C@@H](Oc3ccccc3)C2)c1 ZINC000416269438 942574768 /nfs/dbraw/zinc/57/47/68/942574768.db2.gz DRWLJDBXIBRUIA-QGZVFWFLSA-N 0 0 370.405 3.677 20 5 FHBDRN CCc1ccccc1OCCC(=O)OCc1ccc(N(C)C)c([N+](=O)[O-])c1 ZINC001268941030 942575101 /nfs/dbraw/zinc/57/51/01/942575101.db2.gz FOGMJJRWNYFCHG-UHFFFAOYSA-N 0 0 372.421 3.736 20 5 FHBDRN CC[C@H](C)NC(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])c(C)cc2C)cc1 ZINC000421443400 942576429 /nfs/dbraw/zinc/57/64/29/942576429.db2.gz IQKWBDRGNMHHPC-AWEZNQCLSA-N 0 0 369.421 3.992 20 5 FHBDRN Cc1ccccc1C[C@@H](C)C(=O)OCc1ccc(N(C)C)c([N+](=O)[O-])c1 ZINC001268943338 942576766 /nfs/dbraw/zinc/57/67/66/942576766.db2.gz YDWYQRDNVXXGHO-OAHLLOKOSA-N 0 0 356.422 3.891 20 5 FHBDRN O=[N+]([O-])c1ccc(NC[C@@]2(CO)C[C@@H]2c2ccc(F)cc2)c2cccnc21 ZINC000413263743 942578421 /nfs/dbraw/zinc/57/84/21/942578421.db2.gz MZBXZWRXCGFHKU-OXQOHEQNSA-N 0 0 367.380 3.860 20 5 FHBDRN O=[N+]([O-])c1ccc(NC[C@@]2(CO)C[C@H]2c2ccc(F)cc2)c2cccnc21 ZINC000413263742 942578620 /nfs/dbraw/zinc/57/86/20/942578620.db2.gz MZBXZWRXCGFHKU-OXJNMPFZSA-N 0 0 367.380 3.860 20 5 FHBDRN C[C@@H](NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)c1c(F)cccc1F ZINC000513719548 942584659 /nfs/dbraw/zinc/58/46/59/942584659.db2.gz CLOWQHLURQUGAJ-MRVPVSSYSA-N 0 0 372.274 3.965 20 5 FHBDRN C[C@H](C(=O)N1CCC[C@@H](Oc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1F 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20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N(C)C[C@H]1OCCc2ccccc21 ZINC000513956187 942634464 /nfs/dbraw/zinc/63/44/64/942634464.db2.gz VOAAATVZRAAUJC-GOSISDBHSA-N 0 0 355.394 3.681 20 5 FHBDRN O=[N+]([O-])c1cnc(N2Cc3ccc(O)cc3C3(CC3)C2)c(C(F)(F)F)c1 ZINC000413305609 942639373 /nfs/dbraw/zinc/63/93/73/942639373.db2.gz SEACZFHBHIUICG-UHFFFAOYSA-N 0 0 365.311 3.766 20 5 FHBDRN C[C@H]1CN(c2ncc([N+](=O)[O-])cc2C(F)(F)F)Cc2ccccc2O1 ZINC000413306240 942639691 /nfs/dbraw/zinc/63/96/91/942639691.db2.gz VBULNHMXAUUSLH-JTQLQIEISA-N 0 0 353.300 3.796 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N(C)C1CCN(c2ccccc2)CC1 ZINC000421528181 942639922 /nfs/dbraw/zinc/63/99/22/942639922.db2.gz AGEPFZIUVYDMPC-UHFFFAOYSA-N 0 0 367.449 3.953 20 5 FHBDRN CC(C)OCc1nc([C@@H](C)Nc2nccc3ccc([N+](=O)[O-])cc32)no1 ZINC000413307482 942640571 /nfs/dbraw/zinc/64/05/71/942640571.db2.gz HRUKERLXEBLRGR-LLVKDONJSA-N 0 0 357.370 3.624 20 5 FHBDRN CCc1cc(=O)c2cc(NC(=O)c3cc(C)cc([N+](=O)[O-])c3)ccc2[nH]1 ZINC000183309098 942640610 /nfs/dbraw/zinc/64/06/10/942640610.db2.gz MMTWIBHFAWDGDB-UHFFFAOYSA-N 0 0 351.362 3.559 20 5 FHBDRN Cc1cc(C)n(Cc2cccc(C(=O)Nc3ccc([N+](=O)[O-])cc3)c2)n1 ZINC000063473574 942640792 /nfs/dbraw/zinc/64/07/92/942640792.db2.gz OQNSGDWRJXMBCM-UHFFFAOYSA-N 0 0 350.378 3.709 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)Nc1ccc2nnc(C3CCC3)n2c1 ZINC000421536881 942644874 /nfs/dbraw/zinc/64/48/74/942644874.db2.gz WMXLQVAUBBMGKS-UHFFFAOYSA-N 0 0 365.393 3.774 20 5 FHBDRN C[C@@]1(CNC(=O)CSc2ccccc2[N+](=O)[O-])C[C@H]1c1ccccc1 ZINC000501741832 942645416 /nfs/dbraw/zinc/64/54/16/942645416.db2.gz JPYLWSJTMCMFRL-KXBFYZLASA-N 0 0 356.447 3.997 20 5 FHBDRN CC1(C)CCN(C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)CCS1 ZINC000434154564 942650308 /nfs/dbraw/zinc/65/03/08/942650308.db2.gz RSNDTKNBSAGIPQ-UHFFFAOYSA-N 0 0 365.499 3.845 20 5 FHBDRN COC(=O)c1ccc(C(F)(F)F)cc1NC(=O)c1csc([N+](=O)[O-])c1 ZINC000501755633 942654990 /nfs/dbraw/zinc/65/49/90/942654990.db2.gz DJFTYYRVXWNRPL-UHFFFAOYSA-N 0 0 374.296 3.714 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCC[C@H]1OC(F)F ZINC000501756439 942656028 /nfs/dbraw/zinc/65/60/28/942656028.db2.gz PHVUBUYWQQTLLT-CHWSQXEVSA-N 0 0 374.409 3.985 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CCCc2c(F)cc(F)cc21 ZINC000413320495 942658174 /nfs/dbraw/zinc/65/81/74/942658174.db2.gz PUFMYIODCYXBMR-JKSUJKDBSA-N 0 0 358.344 3.956 20 5 FHBDRN O=[N+]([O-])c1ccc(N[C@H]2CCO[C@H](c3ccncc3)C2)c2cccnc21 ZINC000413319174 942658255 /nfs/dbraw/zinc/65/82/55/942658255.db2.gz OFKCRQLUIHQZKY-KSSFIOAISA-N 0 0 350.378 3.870 20 5 FHBDRN O=[N+]([O-])c1ccc2nc(N3CCO[C@H](c4ccccc4F)C3)ccc2c1 ZINC000066814276 942659072 /nfs/dbraw/zinc/65/90/72/942659072.db2.gz OIWWXJDXHDNYGF-SFHVURJKSA-N 0 0 353.353 3.860 20 5 FHBDRN CC(C)(O)CN(C(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1)C1CC1 ZINC000190111415 942659118 /nfs/dbraw/zinc/65/91/18/942659118.db2.gz DCDSUQVKVPXIDG-UHFFFAOYSA-N 0 0 369.421 3.714 20 5 FHBDRN Cc1ccc(C(=O)N2CCC(Nc3ccc([N+](=O)[O-])cc3F)CC2)cc1 ZINC000066813060 942659419 /nfs/dbraw/zinc/65/94/19/942659419.db2.gz INEGWQQBHNENAB-UHFFFAOYSA-N 0 0 357.385 3.759 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CC2(CCC2)[C@H]1[C@@H]1CCCO1 ZINC000365778546 942661312 /nfs/dbraw/zinc/66/13/12/942661312.db2.gz ANLMEKYHGRIVEL-NZSAHSFTSA-N 0 0 372.465 3.724 20 5 FHBDRN CC(C)Cn1c(-c2ccc([N+](=O)[O-])cc2)nnc1N(C)Cc1ccoc1 ZINC000549424061 942662755 /nfs/dbraw/zinc/66/27/55/942662755.db2.gz PFTRXZJTXQRYMM-UHFFFAOYSA-N 0 0 355.398 3.739 20 5 FHBDRN O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccnc(OCc2ccccc2)c1 ZINC000501760694 942662806 /nfs/dbraw/zinc/66/28/06/942662806.db2.gz VUUGNNKQRDJUDF-UHFFFAOYSA-N 0 0 363.373 3.750 20 5 FHBDRN O=C(N[C@H]1COc2cccc(Cl)c21)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412359337 942662926 /nfs/dbraw/zinc/66/29/26/942662926.db2.gz ODLCQQMAIGUCLG-GUTXKFCHSA-N 0 0 358.781 3.602 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N[C@@H](c1nccs1)C(F)(F)F ZINC000421572427 942664049 /nfs/dbraw/zinc/66/40/49/942664049.db2.gz CUVCOEGVXJTLOM-NSHDSACASA-N 0 0 359.329 3.702 20 5 FHBDRN Cc1n[nH]c(C(=O)N[C@@H](c2cccc(Cl)c2)C2CCCC2)c1[N+](=O)[O-] ZINC000434421639 942664142 /nfs/dbraw/zinc/66/41/42/942664142.db2.gz MNBFFAUQINNHOC-CQSZACIVSA-N 0 0 362.817 3.941 20 5 FHBDRN O=C(N[C@@H]1CCC[C@H]1OC(F)F)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000501780415 942669742 /nfs/dbraw/zinc/66/97/42/942669742.db2.gz LPBPAWDWQFGXET-MWLCHTKSSA-N 0 0 368.258 3.504 20 5 FHBDRN COCCCCc1cccnc1NC(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC000421580210 942670771 /nfs/dbraw/zinc/67/07/71/942670771.db2.gz VHFBBKFNWPTPBY-UHFFFAOYSA-N 0 0 357.410 3.828 20 5 FHBDRN Cc1csc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)n1 ZINC000006979943 942676954 /nfs/dbraw/zinc/67/69/54/942676954.db2.gz UFUNMKIVWHGSRJ-UHFFFAOYSA-N 0 0 360.439 3.848 20 5 FHBDRN Nc1ccc(-c2noc(C[C@H](c3ccc(O)cc3)C3CC3)n2)cc1[N+](=O)[O-] ZINC000420476312 942679426 /nfs/dbraw/zinc/67/94/26/942679426.db2.gz PQZNYPQIKSYSDV-HNNXBMFYSA-N 0 0 366.377 3.669 20 5 FHBDRN CCOc1ccc([C@H]2CCCN2C(=O)Nc2ccncc2[N+](=O)[O-])cc1 ZINC000183615033 942682378 /nfs/dbraw/zinc/68/23/78/942682378.db2.gz QAWABHKMGRUUCF-MRXNPFEDSA-N 0 0 356.382 3.758 20 5 FHBDRN CCN(C(=O)Cc1c(F)c(OC)ccc1[N+](=O)[O-])[C@H]1CCCC[C@H]1C ZINC000413335688 942684852 /nfs/dbraw/zinc/68/48/52/942684852.db2.gz LVRDQBQBLVIQKY-OCCSQVGLSA-N 0 0 352.406 3.712 20 5 FHBDRN CC(=O)c1ccc([N+](=O)[O-])cc1N1CCC2(CC1)OCCc1ccccc12 ZINC000413335541 942684926 /nfs/dbraw/zinc/68/49/26/942684926.db2.gz PVISTZPFCZWAGR-UHFFFAOYSA-N 0 0 366.417 3.866 20 5 FHBDRN O=C(/C=C/c1cccc([N+](=O)[O-])c1)N[C@H](c1ccccc1)[C@H]1CCOC1 ZINC000378386787 942697410 /nfs/dbraw/zinc/69/74/10/942697410.db2.gz BQCMEYPRTDTVDA-BYGNXNDRSA-N 0 0 352.390 3.502 20 5 FHBDRN CCN(Cc1ccncc1)[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000502731016 942700557 /nfs/dbraw/zinc/70/05/57/942700557.db2.gz PXGGGIVVXPMJIB-CYBMUJFWSA-N 0 0 353.382 3.623 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(Cc2noc([C@H]3CCc4ccccc4O3)n2)c1 ZINC000420495061 942702327 /nfs/dbraw/zinc/70/23/27/942702327.db2.gz SVWUUGNFXSOUDK-QGZVFWFLSA-N 0 0 367.361 3.644 20 5 FHBDRN CC[C@@H]1CN(c2ccccc2)CCN1C(=O)c1cc([N+](=O)[O-])c(C)s1 ZINC000183622961 942704074 /nfs/dbraw/zinc/70/40/74/942704074.db2.gz DJKZRAGGLUZKIV-CQSZACIVSA-N 0 0 359.451 3.706 20 5 FHBDRN CCn1c(-c2cccc([N+](=O)[O-])c2)nnc1N1CC[C@@]2(CC[C@H](C)C2)C1 ZINC000549427710 942704329 /nfs/dbraw/zinc/70/43/29/942704329.db2.gz NRNRCWQCEUVRER-IFXJQAMLSA-N 0 0 355.442 3.890 20 5 FHBDRN O=[N+]([O-])c1cc2ccccc2nc1N[C@@H]1CCO[C@@H](c2cccs2)C1 ZINC000413347426 942705686 /nfs/dbraw/zinc/70/56/86/942705686.db2.gz AQERGJSPVAYGMU-CZUORRHYSA-N 0 0 355.419 3.959 20 5 FHBDRN CO[C@@H](c1nc(-c2ccc([N+](=O)[O-])c3c2CCCN3)no1)c1ccccc1 ZINC000420499874 942706320 /nfs/dbraw/zinc/70/63/20/942706320.db2.gz KKIUPBRAMIFONI-QGZVFWFLSA-N 0 0 366.377 3.739 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)ccc1N1CCc2c(cnn2-c2ccccc2)C1 ZINC000502757995 942707564 /nfs/dbraw/zinc/70/75/64/942707564.db2.gz WFAJKKAMMZWXKO-UHFFFAOYSA-N 0 0 354.797 3.997 20 5 FHBDRN COC(=O)c1cc(C(=O)N[C@H]2CCC[C@H](C(C)C)CC2)cc([N+](=O)[O-])c1 ZINC001269795200 942712158 /nfs/dbraw/zinc/71/21/58/942712158.db2.gz MIDDQOLPPAHLAR-BBRMVZONSA-N 0 0 362.426 3.716 20 5 FHBDRN Cc1ccc(-c2[nH]nc(NC(=O)CSc3ccc([N+](=O)[O-])cc3)c2C)o1 ZINC000434507567 942714832 /nfs/dbraw/zinc/71/48/32/942714832.db2.gz ZUFFJENCWRKARV-UHFFFAOYSA-N 0 0 372.406 3.926 20 5 FHBDRN O=C(c1ccc(OC(F)F)c([N+](=O)[O-])c1)N1CC[C@H](C2CCCC2)C1 ZINC000421647904 942720847 /nfs/dbraw/zinc/72/08/47/942720847.db2.gz XUVCAPFHXOMRSF-ZDUSSCGKSA-N 0 0 354.353 3.849 20 5 FHBDRN CC(C)[C@@H]1CCCN(c2ccc(C(=O)c3nccn3C)cc2[N+](=O)[O-])CC1 ZINC000514082258 942734971 /nfs/dbraw/zinc/73/49/71/942734971.db2.gz GNMMXXJGGAKORK-OAHLLOKOSA-N 0 0 370.453 3.822 20 5 FHBDRN Cc1cnc(N(CCO)Cc2ccc(Cl)c(Cl)c2)c([N+](=O)[O-])c1 ZINC000502789179 942743435 /nfs/dbraw/zinc/74/34/35/942743435.db2.gz JYHWRWFJQXHCJK-UHFFFAOYSA-N 0 0 356.209 3.604 20 5 FHBDRN CC(C)Oc1cc(C(=O)N(C)C2CC(OC(C)(C)C)C2)ccc1[N+](=O)[O-] ZINC000421689835 942745880 /nfs/dbraw/zinc/74/58/80/942745880.db2.gz NYRKYSUBJZBOIA-UHFFFAOYSA-N 0 0 364.442 3.800 20 5 FHBDRN Cc1nn(CCC(=O)N(C(C)C)[C@@H](C)c2ccsc2)c(C)c1[N+](=O)[O-] ZINC000421689212 942746458 /nfs/dbraw/zinc/74/64/58/942746458.db2.gz JJZDRTLFXMSSGE-ZDUSSCGKSA-N 0 0 364.471 3.858 20 5 FHBDRN CCCNc1ccc(CNC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)cc1 ZINC000434555288 942753297 /nfs/dbraw/zinc/75/32/97/942753297.db2.gz SZJLFTQVSWTIEO-UHFFFAOYSA-N 0 0 368.437 3.921 20 5 FHBDRN CSCC1CCC(NC(=O)CSc2ccccc2[N+](=O)[O-])CC1 ZINC000452491434 942757750 /nfs/dbraw/zinc/75/77/50/942757750.db2.gz LUVCKTPKZFAMDC-UHFFFAOYSA-N 0 0 354.497 3.725 20 5 FHBDRN O=C(Nc1ccc2cccc(Cl)c2n1)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000505429909 942765201 /nfs/dbraw/zinc/76/52/01/942765201.db2.gz VOVDRHJQGAKILI-UHFFFAOYSA-N 0 0 371.736 3.777 20 5 FHBDRN C[C@@H](C(=O)OC(C)(C)C)N(C(=O)c1ccc(Cl)cc1[N+](=O)[O-])C1CC1 ZINC000413917680 942776858 /nfs/dbraw/zinc/77/68/58/942776858.db2.gz QQRXXGYQYOOTDM-JTQLQIEISA-N 0 0 368.817 3.583 20 5 FHBDRN O=C(c1ccc(OC(F)F)c([N+](=O)[O-])c1)N1CCC[C@@H]2CCCC[C@H]21 ZINC000514139449 942777562 /nfs/dbraw/zinc/77/75/62/942777562.db2.gz ALFHKRPRMQKHSG-WCQYABFASA-N 0 0 354.353 3.991 20 5 FHBDRN CN(Cc1ccc(F)cc1F)C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514161368 942782667 /nfs/dbraw/zinc/78/26/67/942782667.db2.gz ZNTXNLCPKGCRIZ-UHFFFAOYSA-N 0 0 372.274 3.747 20 5 FHBDRN C[C@H](CCCCO)NC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 ZINC000452503567 942783121 /nfs/dbraw/zinc/78/31/21/942783121.db2.gz ONHQYCUHRPNQGY-CQSZACIVSA-N 0 0 358.394 3.668 20 5 FHBDRN CC[C@H](NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)c1nccs1 ZINC000514181238 942791099 /nfs/dbraw/zinc/79/10/99/942791099.db2.gz ZVLQRYHPNXKSCT-VIFPVBQESA-N 0 0 357.338 3.534 20 5 FHBDRN CC[C@@H](c1ccncc1)N(C)C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514184687 942794059 /nfs/dbraw/zinc/79/40/59/942794059.db2.gz XSAWFLAIHJCDHK-ZDUSSCGKSA-N 0 0 365.336 3.815 20 5 FHBDRN COc1cc(Cn2nc(C)c3cc([N+](=O)[O-])ccc32)ccc1OC(F)F ZINC000502849006 942795809 /nfs/dbraw/zinc/79/58/09/942795809.db2.gz WNCHWHARIIVRAL-UHFFFAOYSA-N 0 0 363.320 3.911 20 5 FHBDRN Cc1cccc2sc(C(=O)Nc3c([N+](=O)[O-])cnn3C)c(Cl)c21 ZINC001269819736 942800804 /nfs/dbraw/zinc/80/08/04/942800804.db2.gz KZIVSQBRFKSQAT-UHFFFAOYSA-N 0 0 350.787 3.757 20 5 FHBDRN CCOc1ccccc1NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514174479 942801040 /nfs/dbraw/zinc/80/10/40/942801040.db2.gz NCZOKCWWDTYEGW-UHFFFAOYSA-N 0 0 352.293 3.847 20 5 FHBDRN O=C(NC[C@@H]1CCc2ccccc21)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514199625 942809595 /nfs/dbraw/zinc/80/95/95/942809595.db2.gz NPCCKPXQHWNYNO-ZDUSSCGKSA-N 0 0 362.332 3.656 20 5 FHBDRN Cc1cc(NC(=O)[C@@H]2CCC(=O)N(C)[C@H]2c2cccs2)ccc1[N+](=O)[O-] ZINC000378478912 942813871 /nfs/dbraw/zinc/81/38/71/942813871.db2.gz ZQCLTNPXNZLZJV-CXAGYDPISA-N 0 0 373.434 3.513 20 5 FHBDRN Cc1cc(NC(=O)[C@@H]2CCC(=O)N(C)[C@@H]2c2cccs2)ccc1[N+](=O)[O-] ZINC000378478913 942814226 /nfs/dbraw/zinc/81/42/26/942814226.db2.gz ZQCLTNPXNZLZJV-DYVFJYSZSA-N 0 0 373.434 3.513 20 5 FHBDRN O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CCC[C@@](O)(C(F)(F)F)C1 ZINC000514212763 942822284 /nfs/dbraw/zinc/82/22/84/942822284.db2.gz AHQVQOUYBWSQMY-NSHDSACASA-N 0 0 358.238 3.507 20 5 FHBDRN CCn1c(-c2cccc([N+](=O)[O-])c2)nnc1N(C)Cc1ccc(OC)cc1 ZINC000549438554 942823804 /nfs/dbraw/zinc/82/38/04/942823804.db2.gz CVFMKHWFYHYAJK-UHFFFAOYSA-N 0 0 367.409 3.518 20 5 FHBDRN CC(C)c1ccc(C(=O)N2CCO[C@@H](c3cccs3)C2)cc1[N+](=O)[O-] ZINC000190122325 942825666 /nfs/dbraw/zinc/82/56/66/942825666.db2.gz BYAAMKYOLPPPDO-MRXNPFEDSA-N 0 0 360.435 3.993 20 5 FHBDRN O=C(N[C@H]1C[C@H]1Cc1ccccc1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514217705 942825796 /nfs/dbraw/zinc/82/57/96/942825796.db2.gz GSKTUGNFIUMNRN-KGLIPLIRSA-N 0 0 362.332 3.557 20 5 FHBDRN O=C(Nc1ccc2c(c1)CCCC2=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412374594 942830503 /nfs/dbraw/zinc/83/05/03/942830503.db2.gz ODGRZAHZQLXROZ-ZWKOTPCHSA-N 0 0 350.374 3.856 20 5 FHBDRN O=C(NCCCc1cccc(F)c1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514208543 942832406 /nfs/dbraw/zinc/83/24/06/942832406.db2.gz NBUZOXCCBQGQMZ-UHFFFAOYSA-N 0 0 368.311 3.698 20 5 FHBDRN O=C(Nc1ccc(-c2ccccn2)cn1)c1ccc([N+](=O)[O-])cc1Cl ZINC000367088834 942834927 /nfs/dbraw/zinc/83/49/27/942834927.db2.gz FNCAWEMGXCFXCO-UHFFFAOYSA-N 0 0 354.753 3.958 20 5 FHBDRN Nc1c(C(=O)N2CC[C@](F)(c3cccc(Cl)c3)C2)cccc1[N+](=O)[O-] ZINC000514230148 942839879 /nfs/dbraw/zinc/83/98/79/942839879.db2.gz WKZMEHYNNXAUAG-QGZVFWFLSA-N 0 0 363.776 3.541 20 5 FHBDRN C[C@@H](NC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-])c1cccc(O)c1 ZINC000183649162 942840845 /nfs/dbraw/zinc/84/08/45/942840845.db2.gz YSTOTYQKJIBJJN-SNVBAGLBSA-N 0 0 366.826 3.923 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N2CC3(CCOCC3)[C@H]2C(C)C)c1 ZINC000413969643 942841498 /nfs/dbraw/zinc/84/14/98/942841498.db2.gz FIWPIERHVNFYRF-MRXNPFEDSA-N 0 0 364.467 3.594 20 5 FHBDRN COc1cc(COc2ccccc2F)c([N+](=O)[O-])cc1OCC(F)F ZINC000502905776 942844413 /nfs/dbraw/zinc/84/44/13/942844413.db2.gz ZUNOUWJTTVBWOP-UHFFFAOYSA-N 0 0 357.284 3.965 20 5 FHBDRN CC(C)c1ccc(C(=O)N[C@H](CCCO)c2ccccc2)cc1[N+](=O)[O-] ZINC000190170964 942848520 /nfs/dbraw/zinc/84/85/20/942848520.db2.gz WKCISUVYIWXWHF-GOSISDBHSA-N 0 0 356.422 3.962 20 5 FHBDRN O=[N+]([O-])c1cccc(OCCN[C@H](c2cc(F)ccc2F)C(F)F)c1 ZINC000434665231 942852708 /nfs/dbraw/zinc/85/27/08/942852708.db2.gz ZFECDRIDPQFWEG-OAHLLOKOSA-N 0 0 358.291 3.848 20 5 FHBDRN CCOc1ccc(-c2noc(COc3ccc(OC)c([N+](=O)[O-])c3)n2)cc1 ZINC000190196769 942853695 /nfs/dbraw/zinc/85/36/95/942853695.db2.gz DHEATGXIAMXTNJ-UHFFFAOYSA-N 0 0 371.349 3.631 20 5 FHBDRN CC(C)[C@H](NC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])C(F)(F)F ZINC000413979860 942859377 /nfs/dbraw/zinc/85/93/77/942859377.db2.gz AORJQHRPQJZANW-PELKAZGASA-N 0 0 368.739 3.719 20 5 FHBDRN Cc1cc(F)cc([C@]2(F)CCN(Cc3nc4cc([N+](=O)[O-])ccc4[nH]3)C2)c1 ZINC000502955519 942862868 /nfs/dbraw/zinc/86/28/68/942862868.db2.gz FTKZVNAVPCTCGK-IBGZPJMESA-N 0 0 372.375 3.989 20 5 FHBDRN Cn1cc(CCC(=O)Nc2ccc3cc([N+](=O)[O-])ccc3n2)c2ccccc21 ZINC000469179469 942864182 /nfs/dbraw/zinc/86/41/82/942864182.db2.gz IDTOKEIXYZYPGG-UHFFFAOYSA-N 0 0 374.400 3.628 20 5 FHBDRN COc1ccc(C(=O)CCC(=O)Nc2cccc([N+](=O)[O-])c2)c(Cl)c1 ZINC000502953871 942866904 /nfs/dbraw/zinc/86/69/04/942866904.db2.gz ZLCCFFSBELYGQA-UHFFFAOYSA-N 0 0 362.769 3.858 20 5 FHBDRN CC(C)[C@H](NC(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-])C(F)(F)F ZINC000413991739 942873543 /nfs/dbraw/zinc/87/35/43/942873543.db2.gz WOUPUXCCAQEXMO-HNNXBMFYSA-N 0 0 367.327 3.974 20 5 FHBDRN Cc1cccc([C@H]2CCCN2CC(=O)Nc2ccc([N+](=O)[O-])cc2C)c1 ZINC000434707983 942873917 /nfs/dbraw/zinc/87/39/17/942873917.db2.gz BCDJDAVLLALDCF-LJQANCHMSA-N 0 0 353.422 3.987 20 5 FHBDRN CC(C)[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1Br)C(F)(F)F ZINC000413996413 942875630 /nfs/dbraw/zinc/87/56/30/942875630.db2.gz LKHTXNTXWOBTBV-JTQLQIEISA-N 0 0 369.137 3.674 20 5 FHBDRN CC(C)(C)[C@H]1CCC[C@@H]1NC(=O)c1cc([N+](=O)[O-])ccc1SCCO ZINC000413997613 942875947 /nfs/dbraw/zinc/87/59/47/942875947.db2.gz WFEFLVBOVGQESN-GJZGRUSLSA-N 0 0 366.483 3.624 20 5 FHBDRN CCCN(C(=O)COc1cccc([N+](=O)[O-])c1)[C@@H]1CCc2ccccc2C1 ZINC000509983401 942893258 /nfs/dbraw/zinc/89/32/58/942893258.db2.gz BLUFYONZXOHBNA-GOSISDBHSA-N 0 0 368.433 3.770 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NCc1cc(C(F)F)on1 ZINC000928149363 942894959 /nfs/dbraw/zinc/89/49/59/942894959.db2.gz YYOQUMDJGPNSFZ-UHFFFAOYSA-N 0 0 357.338 3.562 20 5 FHBDRN C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1cncc(-c2ccccn2)c1 ZINC000378574759 942905610 /nfs/dbraw/zinc/90/56/10/942905610.db2.gz CRURODSEFSBXSI-CYBMUJFWSA-N 0 0 360.373 3.643 20 5 FHBDRN CSC[C@@](C)(O)CNc1cc(Cl)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000078022465 942907754 /nfs/dbraw/zinc/90/77/54/942907754.db2.gz VMUCRLPZNNBNTE-NSHDSACASA-N 0 0 358.769 3.793 20 5 FHBDRN Cc1ccc(NCCCNC(=O)Cc2ccc(Cl)s2)c([N+](=O)[O-])c1 ZINC000509997609 942910393 /nfs/dbraw/zinc/91/03/93/942910393.db2.gz XNZWMDVSGHLLCQ-UHFFFAOYSA-N 0 0 367.858 3.779 20 5 FHBDRN Cc1occc1C(=O)NC1CCN(c2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000066817165 942911259 /nfs/dbraw/zinc/91/12/59/942911259.db2.gz FIYJQHGLXIANCI-UHFFFAOYSA-N 0 0 363.801 3.548 20 5 FHBDRN CC[C@H]1CN(C(=O)c2ccnc(-c3ccccc3)c2[N+](=O)[O-])C[C@H](CC)O1 ZINC000421972622 942911560 /nfs/dbraw/zinc/91/15/60/942911560.db2.gz KOFHSEWCNOVDFE-HOTGVXAUSA-N 0 0 369.421 3.686 20 5 FHBDRN CCc1ccc(C(=O)N2CC3(CCOCC3)[C@@H]3CCC[C@@H]32)cc1[N+](=O)[O-] ZINC000584451920 942915263 /nfs/dbraw/zinc/91/52/63/942915263.db2.gz FHZBJJWJQFMEPK-SJORKVTESA-N 0 0 358.438 3.579 20 5 FHBDRN O=C(N[C@@H]1C[C@H]1c1ccccc1C(F)(F)F)c1ccccc1[N+](=O)[O-] ZINC000505501037 942916345 /nfs/dbraw/zinc/91/63/45/942916345.db2.gz YUTFQHCAXYBEIV-GXTWGEPZSA-N 0 0 350.296 3.900 20 5 FHBDRN CS(=O)(=O)c1ccc(N2CCC[C@@H](c3ccccc3)CC2)c([N+](=O)[O-])c1 ZINC000066818497 942919916 /nfs/dbraw/zinc/91/99/16/942919916.db2.gz DUQKNLBLCDAMOD-MRXNPFEDSA-N 0 0 374.462 3.772 20 5 FHBDRN CN([C@H]1CCC[C@H]1c1ccccc1)S(=O)(=O)c1ccc([N+](=O)[O-])s1 ZINC000416539553 942929585 /nfs/dbraw/zinc/92/95/85/942929585.db2.gz DMWUGGLWPNIOKO-KBPBESRZSA-N 0 0 366.464 3.613 20 5 FHBDRN Cc1ccc([C@@H](NC(=O)CCNc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000514337821 942937625 /nfs/dbraw/zinc/93/76/25/942937625.db2.gz IKQPLMLWEMMTNH-HXUWFJFHSA-N 0 0 353.422 3.973 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N[C@H]2CCC[C@@H]2C(C)(C)C)c1F ZINC000412825938 942948642 /nfs/dbraw/zinc/94/86/42/942948642.db2.gz PZTLVEBRWLZXQI-STQMWFEESA-N 0 0 352.406 3.616 20 5 FHBDRN Cc1c(CNC(=O)c2coc(-c3c(F)cccc3F)n2)cccc1[N+](=O)[O-] ZINC001269215600 942960130 /nfs/dbraw/zinc/96/01/30/942960130.db2.gz PFQOXAFFIJEABX-UHFFFAOYSA-N 0 0 373.315 3.766 20 5 FHBDRN C[C@H](Nc1ccc(NC(=O)c2cc([N+](=O)[O-])n[nH]2)cc1)c1ccccc1 ZINC000509958378 942971389 /nfs/dbraw/zinc/97/13/89/942971389.db2.gz IMEKACPLORGMAE-LBPRGKRZSA-N 0 0 351.366 3.743 20 5 FHBDRN O=C(CCc1c(Cl)cccc1[N+](=O)[O-])Nc1ccc(-c2nc[nH]n2)cc1 ZINC001125887888 942985371 /nfs/dbraw/zinc/98/53/71/942985371.db2.gz BPOAHRQEZCBZFZ-UHFFFAOYSA-N 0 0 371.784 3.605 20 5 FHBDRN Cc1csc(NC(=O)CSCc2c(F)cc([N+](=O)[O-])cc2F)n1 ZINC000506439153 942986209 /nfs/dbraw/zinc/98/62/09/942986209.db2.gz MUVNOGFKUAITHY-UHFFFAOYSA-N 0 0 359.379 3.510 20 5 FHBDRN CC[C@H](CNS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])CC(F)(F)F ZINC000416591962 942994409 /nfs/dbraw/zinc/99/44/09/942994409.db2.gz IPDWOIXIWGGZBR-QMMMGPOBSA-N 0 0 374.768 3.505 20 5 FHBDRN CC1CCC(Oc2cc(CNC(=O)c3ccc([N+](=O)[O-])cc3)ccn2)CC1 ZINC000505550488 942998594 /nfs/dbraw/zinc/99/85/94/942998594.db2.gz LPNQFDUWJINALM-UHFFFAOYSA-N 0 0 369.421 3.877 20 5 FHBDRN CCOCCC1(CNC(=O)CSc2ccc([N+](=O)[O-])cc2)CCCC1 ZINC000133640748 943002935 /nfs/dbraw/zinc/00/29/35/943002935.db2.gz VPBAKNSDYIHOPL-UHFFFAOYSA-N 0 0 366.483 3.790 20 5 FHBDRN COc1cc(CN(C)C(=O)c2cc3cc([N+](=O)[O-])ccc3o2)cc(OC)c1 ZINC000514424940 943006509 /nfs/dbraw/zinc/00/65/09/943006509.db2.gz UBFGNFSAXVSFHT-UHFFFAOYSA-N 0 0 370.361 3.630 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H]3CCCN3c3ccccc32)c1 ZINC000514423614 943006580 /nfs/dbraw/zinc/00/65/80/943006580.db2.gz ASBVCELWMYQMQI-ZDUSSCGKSA-N 0 0 369.446 3.946 20 5 FHBDRN COC(=O)c1cccc(Cl)c1COc1nc(C)cc(C)c1[N+](=O)[O-] ZINC000505546990 943006630 /nfs/dbraw/zinc/00/66/30/943006630.db2.gz LXYAONYFQPXYMU-UHFFFAOYSA-N 0 0 350.758 3.626 20 5 FHBDRN Cc1cccc(CCCNC(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)n1 ZINC000293748089 943007266 /nfs/dbraw/zinc/00/72/66/943007266.db2.gz WODHZFNDPGISOG-UHFFFAOYSA-N 0 0 367.327 3.680 20 5 FHBDRN O=C(N[C@@H]1C[C@@H]1c1ccccc1C(F)(F)F)c1ccc([N+](=O)[O-])s1 ZINC000505551573 943017152 /nfs/dbraw/zinc/01/71/52/943017152.db2.gz SRPVOXUXNQAQJZ-MWLCHTKSSA-N 0 0 356.325 3.961 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)N(C)C2CC(OC(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000422167709 943019705 /nfs/dbraw/zinc/01/97/05/943019705.db2.gz BNYVPMRAOBQZOM-IUDNXUCKSA-N 0 0 363.458 3.952 20 5 FHBDRN O=C(Cc1cc(F)c(Cl)cc1[N+](=O)[O-])Nc1ncsc1C1CC1 ZINC000893267325 943030884 /nfs/dbraw/zinc/03/08/84/943030884.db2.gz XYUOTIYIFLMMBJ-UHFFFAOYSA-N 0 0 355.778 3.902 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CC[C@@H](c2ccccc2)[C@@H]1C ZINC000434901217 943037736 /nfs/dbraw/zinc/03/77/36/943037736.db2.gz TUVNFSYFENRJME-DOTOQJQBSA-N 0 0 353.422 3.720 20 5 FHBDRN CCNc1ccc(C(=O)NC[C@@H](c2cccnc2)C(C)C)cc1[N+](=O)[O-] ZINC000434169502 943037832 /nfs/dbraw/zinc/03/78/32/943037832.db2.gz JJOSFLFCESQBNW-MRXNPFEDSA-N 0 0 356.426 3.591 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])N1CC(c2cccc(C(F)(F)F)c2)C1 ZINC000412398330 943050523 /nfs/dbraw/zinc/05/05/23/943050523.db2.gz QYPJEYXKJDSDTJ-UHFFFAOYSA-N 0 0 364.323 3.782 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])N[C@@H]1C[C@@H]1c1ccccc1C(F)(F)F ZINC000505567151 943053345 /nfs/dbraw/zinc/05/33/45/943053345.db2.gz WBAPDCVHJKYMFM-UKRRQHHQSA-N 0 0 364.323 3.828 20 5 FHBDRN O=C(NCCNc1ccc([N+](=O)[O-])cc1)c1ccc2c3c(cccc31)CC2 ZINC000514497870 943055524 /nfs/dbraw/zinc/05/55/24/943055524.db2.gz FTUXLYZZCYZDHA-UHFFFAOYSA-N 0 0 361.401 3.689 20 5 FHBDRN O=C(c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])N1CCCC2(CC2)C1 ZINC000613726287 943056125 /nfs/dbraw/zinc/05/61/25/943056125.db2.gz WSMBBUAFTFGOLI-UHFFFAOYSA-N 0 0 358.316 3.552 20 5 FHBDRN Cc1nn(C)cc1[C@@H]1CCCN1C(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000363922339 943058224 /nfs/dbraw/zinc/05/82/24/943058224.db2.gz OGFHXEVBLCCGBV-DYVFJYSZSA-N 0 0 371.441 3.553 20 5 FHBDRN CC(C)c1ccc(C(=O)N2CCC(Cc3nccn3C)CC2)cc1[N+](=O)[O-] ZINC000190231985 943059379 /nfs/dbraw/zinc/05/93/79/943059379.db2.gz ZOPBIZOHSPSXBJ-UHFFFAOYSA-N 0 0 370.453 3.547 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CCN(Cc2ccccc2)[C@@H](C)C1 ZINC000416728344 943059654 /nfs/dbraw/zinc/05/96/54/943059654.db2.gz LPSUNSJLGPWQFG-INIZCTEOSA-N 0 0 368.437 3.641 20 5 FHBDRN Cc1cc(Cl)c(C(=O)Nc2cc(-c3ccncc3)nn2C)cc1[N+](=O)[O-] ZINC001126430296 943061785 /nfs/dbraw/zinc/06/17/85/943061785.db2.gz CTMIDLWVRQAHOA-UHFFFAOYSA-N 0 0 371.784 3.604 20 5 FHBDRN CN(C(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])c1ccccc1 ZINC000048020851 943070046 /nfs/dbraw/zinc/07/00/46/943070046.db2.gz BMKXXKSHRWWFPO-UHFFFAOYSA-N 0 0 354.284 3.813 20 5 FHBDRN C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)NCCc3ccco3)cc2[N+](=O)[O-])C1 ZINC000514516660 943077034 /nfs/dbraw/zinc/07/70/34/943077034.db2.gz UQLKKLZLKOVCNV-GASCZTMLSA-N 0 0 371.437 3.643 20 5 FHBDRN O=C(NCc1cccc(OCC(F)F)c1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000110272059 943081644 /nfs/dbraw/zinc/08/16/44/943081644.db2.gz AHQQLMUBGYASBF-UHFFFAOYSA-N 0 0 370.739 3.822 20 5 FHBDRN CC(C)(C)n1ccnc1SCc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000503249001 943083909 /nfs/dbraw/zinc/08/39/09/943083909.db2.gz RLKOOGFFMRJCKA-UHFFFAOYSA-N 0 0 359.411 3.889 20 5 FHBDRN Cc1ccc(C)n1-c1nc(CC(=O)Oc2c(C)cccc2[N+](=O)[O-])cs1 ZINC000760017186 943101970 /nfs/dbraw/zinc/10/19/70/943101970.db2.gz MYMUCXISBGBRAJ-UHFFFAOYSA-N 0 0 371.418 3.915 20 5 FHBDRN CC(C)OC(=O)C[C@H](NC(=O)c1ccc(F)cc1)c1ccccc1[N+](=O)[O-] ZINC000014375869 943110382 /nfs/dbraw/zinc/11/03/82/943110382.db2.gz ZLQBCHZVHCCMSE-INIZCTEOSA-N 0 0 374.368 3.547 20 5 FHBDRN COC(=O)c1ccccc1C(=O)c1ccc(N[C@H]2CC23CC3)c([N+](=O)[O-])c1 ZINC000425269206 943128967 /nfs/dbraw/zinc/12/89/67/943128967.db2.gz BOIVHLDLJQRSDR-KRWDZBQOSA-N 0 0 366.373 3.577 20 5 FHBDRN CCOc1cc(Oc2cc([S@@](C)=O)c(C)cc2OC)ccc1[N+](=O)[O-] ZINC000425272287 943136439 /nfs/dbraw/zinc/13/64/39/943136439.db2.gz FVWAQACFEZOPNB-RUZDIDTESA-N 0 0 365.407 3.840 20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])NCCCc1ccc(Cl)cc1 ZINC000503363377 943150141 /nfs/dbraw/zinc/15/01/41/943150141.db2.gz ULZLMGJVLHSUON-UHFFFAOYSA-N 0 0 361.829 3.799 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)Cc1ccncc1 ZINC000503388073 943152772 /nfs/dbraw/zinc/15/27/72/943152772.db2.gz IXARKBGOXPEWIN-ZDUSSCGKSA-N 0 0 359.451 3.853 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CN1CCC(N2CCc3ccccc32)CC1 ZINC000503382946 943158360 /nfs/dbraw/zinc/15/83/60/943158360.db2.gz KRNYNJSJKFZHPA-UHFFFAOYSA-N 0 0 367.449 3.631 20 5 FHBDRN CCOc1cc(COc2cccc(-c3noc(C)n3)c2)ccc1[N+](=O)[O-] ZINC000514635759 943167764 /nfs/dbraw/zinc/16/77/64/943167764.db2.gz TUXMCBWTKOEPAP-UHFFFAOYSA-N 0 0 355.350 3.931 20 5 FHBDRN C[C@H](Nc1nccc(C(N)=O)c1[N+](=O)[O-])c1cc(Cl)ccc1Cl ZINC000514638947 943170993 /nfs/dbraw/zinc/17/09/93/943170993.db2.gz POFMMURUBJPAAH-ZETCQYMHSA-N 0 0 355.181 3.569 20 5 FHBDRN CC(C)[C@@H](CNC(=O)c1cc2cc([N+](=O)[O-])ccc2o1)c1cccnc1 ZINC000434177570 943178227 /nfs/dbraw/zinc/17/82/27/943178227.db2.gz PLJOBYQUMFRDHP-MRXNPFEDSA-N 0 0 353.378 3.906 20 5 FHBDRN COC(=O)c1ccc(OC(=O)[C@@H]2CC[C@@H]2c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC001267794903 943185740 /nfs/dbraw/zinc/18/57/40/943185740.db2.gz MBOADZNUCMZNEX-HUUCEWRRSA-N 0 0 373.336 3.620 20 5 FHBDRN O=[N+]([O-])c1cc2ccccc2nc1N1CC2(CCC2)[C@H]1C1CCOCC1 ZINC000425287636 943193416 /nfs/dbraw/zinc/19/34/16/943193416.db2.gz WFPSXXBHZQDVRU-GOSISDBHSA-N 0 0 353.422 3.929 20 5 FHBDRN CN(c1ccccc1)c1ccc(C[N@@H+]2CCC[C@H](C(=O)[O-])C2)cc1[N+](=O)[O-] ZINC000414672726 943200102 /nfs/dbraw/zinc/20/01/02/943200102.db2.gz CKHUYWAUYAWILO-INIZCTEOSA-N 0 0 369.421 3.659 20 5 FHBDRN O=[N+]([O-])c1cccc(F)c1CN(Cc1cccs1)C[C@@H]1CCCO1 ZINC000505612850 943203683 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CN(CCc1ccccc1[N+](=O)[O-])Cc1nc2cc(Cl)ccc2c(=O)[nH]1 ZINC000514742538 943254271 /nfs/dbraw/zinc/25/42/71/943254271.db2.gz UCXVQOFVHXDMJL-UHFFFAOYSA-N 0 0 372.812 3.572 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCC[C@@H]2OCC[C@H]21 ZINC000503571807 943268973 /nfs/dbraw/zinc/26/89/73/943268973.db2.gz BVHAQNDBVNHZBK-IMJJTQAJSA-N 0 0 364.467 3.784 20 5 FHBDRN CO[C@H]1c2ccccc2C[C@H]1NC(=O)Nc1cc([N+](=O)[O-])c(C)cc1C ZINC000416996070 943280327 /nfs/dbraw/zinc/28/03/27/943280327.db2.gz IKARKWZHWKTWOU-AEFFLSMTSA-N 0 0 355.394 3.646 20 5 FHBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N(c2ccccc2F)C2CCCC2)c1 ZINC000514775255 943282747 /nfs/dbraw/zinc/28/27/47/943282747.db2.gz JLHQJHTYAPQKDD-UHFFFAOYSA-N 0 0 364.398 3.872 20 5 FHBDRN O=C(c1ccccc1)c1ccc(NCCOCC(F)(F)F)c([N+](=O)[O-])c1 ZINC000514777710 943284074 /nfs/dbraw/zinc/28/40/74/943284074.db2.gz VINDVKMFPDGVMF-UHFFFAOYSA-N 0 0 368.311 3.817 20 5 FHBDRN Cc1ccc(OCCN(C)C(=O)CSc2ccc([N+](=O)[O-])cc2)cc1 ZINC000016966510 943289265 /nfs/dbraw/zinc/28/92/65/943289265.db2.gz URYSCVLPFBVCEX-UHFFFAOYSA-N 0 0 360.435 3.533 20 5 FHBDRN Cc1nn(CCC(=O)NCc2c(C)c(C)c(C)c(C)c2C)c(C)c1[N+](=O)[O-] ZINC000435267049 943291454 /nfs/dbraw/zinc/29/14/54/943291454.db2.gz LHSINZNOSITDLZ-UHFFFAOYSA-N 0 0 372.469 3.657 20 5 FHBDRN O=C(NCCc1ccccc1[N+](=O)[O-])N1CCC[C@H](c2ccccc2)C1 ZINC000431916746 943299030 /nfs/dbraw/zinc/29/90/30/943299030.db2.gz PJRGWVWNPQDWGL-SFHVURJKSA-N 0 0 353.422 3.727 20 5 FHBDRN CC(C)S(=O)(=O)CCCOc1ccc(-c2ccccc2)cc1[N+](=O)[O-] ZINC000122983113 943302197 /nfs/dbraw/zinc/30/21/97/943302197.db2.gz HNFHILXAFTZIMK-UHFFFAOYSA-N 0 0 363.435 3.854 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCOC2(CCC2)C1 ZINC000503617685 943303555 /nfs/dbraw/zinc/30/35/55/943303555.db2.gz KTBYCSAGBCBNFE-ZDUSSCGKSA-N 0 0 364.467 3.928 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N[C@H]1CCN(c2ccc(F)cc2)C1 ZINC000417045979 943316119 /nfs/dbraw/zinc/31/61/19/943316119.db2.gz RWDMDNFCMJRXOG-HNNXBMFYSA-N 0 0 372.400 3.751 20 5 FHBDRN Cc1c(NC(=O)N(C)Cc2ccoc2)cc(Br)cc1[N+](=O)[O-] ZINC000435323222 943323696 /nfs/dbraw/zinc/32/36/96/943323696.db2.gz KPOHFYCNKBPBQG-UHFFFAOYSA-N 0 0 368.187 3.923 20 5 FHBDRN Cc1c(NC(=O)N2CC[C@@H](C)[C@H]2C)cc(Br)cc1[N+](=O)[O-] ZINC000435322827 943323841 /nfs/dbraw/zinc/32/38/41/943323841.db2.gz HDMASLZEMWBKRX-PSASIEDQSA-N 0 0 356.220 3.928 20 5 FHBDRN Cc1c(NC(=O)NC[C@H]2CCCS2)cc(Br)cc1[N+](=O)[O-] ZINC000435325330 943325084 /nfs/dbraw/zinc/32/50/84/943325084.db2.gz ZOEWNYUGFRQJOO-SNVBAGLBSA-N 0 0 374.260 3.683 20 5 FHBDRN O=[N+]([O-])c1ccc(CNc2ccc(F)cc2N2CCOCC2)c(Cl)c1 ZINC000417056240 943326667 /nfs/dbraw/zinc/32/66/67/943326667.db2.gz KKBMJRHBYLSRIP-UHFFFAOYSA-N 0 0 365.792 3.836 20 5 FHBDRN COc1cc(NCc2ccc([N+](=O)[O-])cc2OC)c(Cl)c(OC)c1 ZINC000417056892 943327099 /nfs/dbraw/zinc/32/70/99/943327099.db2.gz AHHOVOIIHWYUNA-UHFFFAOYSA-N 0 0 352.774 3.886 20 5 FHBDRN Cc1cccc(CN(C)C(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)n1 ZINC000514832522 943327931 /nfs/dbraw/zinc/32/79/31/943327931.db2.gz NURVFSARIAZMHG-UHFFFAOYSA-N 0 0 368.418 3.694 20 5 FHBDRN C[C@@H](NC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(-n2cccn2)cc1 ZINC000514834640 943329636 /nfs/dbraw/zinc/32/96/36/943329636.db2.gz UZPLXWDPGKMWLH-HUUCEWRRSA-N 0 0 364.405 3.761 20 5 FHBDRN Cc1c(NC(=O)NCCc2ccco2)cc(Br)cc1[N+](=O)[O-] ZINC000435328890 943333816 /nfs/dbraw/zinc/33/38/16/943333816.db2.gz NHTNHBNMKRQWLK-UHFFFAOYSA-N 0 0 368.187 3.623 20 5 FHBDRN CC(C)(CCO)Nc1nc2ccsc2c(Oc2cccc([N+](=O)[O-])c2)n1 ZINC001167741423 943335733 /nfs/dbraw/zinc/33/57/33/943335733.db2.gz UGULYKAPMICIMO-UHFFFAOYSA-N 0 0 374.422 3.965 20 5 FHBDRN Cc1c(NC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)cnn1-c1ccccc1 ZINC000435339185 943341463 /nfs/dbraw/zinc/34/14/63/943341463.db2.gz PUJGNFZAGIUDJC-UHFFFAOYSA-N 0 0 361.361 3.823 20 5 FHBDRN COc1cc(C)c([C@@H](C)OC(=O)COc2cccc([N+](=O)[O-])c2)cc1C ZINC001269939048 943343853 /nfs/dbraw/zinc/34/38/53/943343853.db2.gz KWQIHADHXQXZQT-CQSZACIVSA-N 0 0 359.378 3.903 20 5 FHBDRN COc1ccc(CCC(=O)NCCc2ccc([N+](=O)[O-])cc2)cc1Cl ZINC000053215406 943344741 /nfs/dbraw/zinc/34/47/41/943344741.db2.gz AJSNINSIEHEBOW-UHFFFAOYSA-N 0 0 362.813 3.548 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])c(-n2ccnc2)c1)N1CCSC12CCCCC2 ZINC000514872933 943352519 /nfs/dbraw/zinc/35/25/19/943352519.db2.gz VOZNKCXHEDETOR-UHFFFAOYSA-N 0 0 372.450 3.630 20 5 FHBDRN COc1ccccc1[C@@H]1CCCN1C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000126472232 943354475 /nfs/dbraw/zinc/35/44/75/943354475.db2.gz GELNXSCUQONPBK-SFHVURJKSA-N 0 0 369.421 3.693 20 5 FHBDRN CC(C)(NS(=O)(=O)c1ccc(F)cc1Cl)c1ccc([N+](=O)[O-])cc1 ZINC000431922746 943358808 /nfs/dbraw/zinc/35/88/08/943358808.db2.gz GNHMDEZPYAGJLX-UHFFFAOYSA-N 0 0 372.805 3.601 20 5 FHBDRN CCOc1cc(NC(=O)N[C@H]2CCC[C@@H]2C)c([N+](=O)[O-])cc1OCC ZINC000503783909 943369443 /nfs/dbraw/zinc/36/94/43/943369443.db2.gz RMVCWAXQVQBIED-RYUDHWBXSA-N 0 0 351.403 3.702 20 5 FHBDRN O=C(COc1cccc([N+](=O)[O-])c1)N1CCSc2ccc(Cl)cc21 ZINC000514900530 943370931 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FHBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)N[C@@H]1C[C@H]1c1ccc2ccccc2c1 ZINC000435432290 943396126 /nfs/dbraw/zinc/39/61/26/943396126.db2.gz IGMMMCKNOCSNMX-DLBZAZTESA-N 0 0 368.414 3.582 20 5 FHBDRN O=[N+]([O-])c1cc(F)c(CSc2nccc(C(F)(F)F)n2)c(F)c1 ZINC000505690850 943397432 /nfs/dbraw/zinc/39/74/32/943397432.db2.gz XGBGNADRSUEWLH-UHFFFAOYSA-N 0 0 351.256 3.974 20 5 FHBDRN O=C(NC[C@@H]1CCC[C@H]1C1CC1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000412460069 943399376 /nfs/dbraw/zinc/39/93/76/943399376.db2.gz GKZRUMMRBCNYGD-ROUUACIJSA-N 0 0 371.481 3.754 20 5 FHBDRN O=[N+]([O-])c1cc(C[S@@](=O)Cc2sccc2Cl)c2c(c1)COCO2 ZINC000417183010 943407315 /nfs/dbraw/zinc/40/73/15/943407315.db2.gz AJDSBSTWWUCHLY-HSZRJFAPSA-N 0 0 373.839 3.625 20 5 FHBDRN C[C@H](N[C@H](Cn1ccccc1=O)c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000503926906 943412101 /nfs/dbraw/zinc/41/21/01/943412101.db2.gz IAHQFCOQDAWMSL-QFBILLFUSA-N 0 0 363.417 3.849 20 5 FHBDRN CC(C)(C)n1ncnc1CN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000503952958 943436228 /nfs/dbraw/zinc/43/62/28/943436228.db2.gz LTNSOJWCOIUGAF-LJQANCHMSA-N 0 0 365.437 3.821 20 5 FHBDRN O=[N+]([O-])c1c(-c2nc(C3CCOCC3)no2)ccnc1-c1ccccc1 ZINC000417282093 943487525 /nfs/dbraw/zinc/48/75/25/943487525.db2.gz OZJIPCVAKOFPEU-UHFFFAOYSA-N 0 0 352.350 3.601 20 5 FHBDRN CNC(=O)c1ccc(N[C@H]2C[C@H](c3cc(F)cc(F)c3)C2)c([N+](=O)[O-])c1 ZINC000435591987 943507136 /nfs/dbraw/zinc/50/71/36/943507136.db2.gz IKJDLBIURZISCS-NNUKFRKNSA-N 0 0 361.348 3.591 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H](COC(F)F)C1 ZINC000557657298 943510537 /nfs/dbraw/zinc/51/05/37/943510537.db2.gz IXUYMKRQKCPCPI-LLVKDONJSA-N 0 0 374.409 3.797 20 5 FHBDRN O=C(c1ccc(Br)cc1[N+](=O)[O-])N1CCCc2occc2C1 ZINC000515091410 943511255 /nfs/dbraw/zinc/51/12/55/943511255.db2.gz HELOSVVTHKVWRU-UHFFFAOYSA-N 0 0 365.183 3.539 20 5 FHBDRN CC(C)N(CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)c1ccc(F)cc1 ZINC000504146586 943514865 /nfs/dbraw/zinc/51/48/65/943514865.db2.gz VDQUEUNTXZLPJV-UHFFFAOYSA-N 0 0 357.385 3.538 20 5 FHBDRN Cc1ncsc1CN(C)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425398868 943522319 /nfs/dbraw/zinc/52/23/19/943522319.db2.gz CTJZNGHJVQMQPB-UHFFFAOYSA-N 0 0 356.245 3.754 20 5 FHBDRN O=C(c1c[nH]c2ccc([N+](=O)[O-])cc12)N1CC[C@H](c2cccc(F)c2)C1 ZINC000515147322 943524065 /nfs/dbraw/zinc/52/40/65/943524065.db2.gz GRXFHXGGKBJSII-ZDUSSCGKSA-N 0 0 353.353 3.845 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CCc3cc(F)c(OC)cc32)c1 ZINC000515154741 943537012 /nfs/dbraw/zinc/53/70/12/943537012.db2.gz SIGVCCYHCKDBDS-MRXNPFEDSA-N 0 0 374.368 3.559 20 5 FHBDRN O=C(NC[C@H](Cc1ccccc1)C(F)(F)F)c1ccc([N+](=O)[O-])s1 ZINC000584752054 943539654 /nfs/dbraw/zinc/53/96/54/943539654.db2.gz QIGLZCXKVKZDSP-NSHDSACASA-N 0 0 358.341 3.807 20 5 FHBDRN Cc1c(CC(=O)Nc2cc(Cl)c(N)c(Cl)c2)cccc1[N+](=O)[O-] ZINC000162396321 943553585 /nfs/dbraw/zinc/55/35/85/943553585.db2.gz VIPBCZHWWZINJD-UHFFFAOYSA-N 0 0 354.193 3.973 20 5 FHBDRN COc1ccc(CC(=O)N2Cc3sccc3CC2(C)C)cc1[N+](=O)[O-] ZINC000515211973 943557516 /nfs/dbraw/zinc/55/75/16/943557516.db2.gz ZURMTAGHHSHZJJ-UHFFFAOYSA-N 0 0 360.435 3.571 20 5 FHBDRN CS(=O)(=O)c1ccccc1CN[C@@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417385916 943563010 /nfs/dbraw/zinc/56/30/10/943563010.db2.gz YDXPLKYSTLTMNQ-GOSISDBHSA-N 0 0 374.462 3.556 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)N[C@@H]1C[C@H]1c1cc(F)c(F)c(F)c1 ZINC000435726673 943570917 /nfs/dbraw/zinc/57/09/17/943570917.db2.gz ANCFYRZAFGRRBR-SMDDNHRTSA-N 0 0 351.284 3.690 20 5 FHBDRN C[C@H](Oc1cccc(Cl)c1)C(=O)N1c2ccc([N+](=O)[O-])cc2C[C@@H]1C ZINC000504299280 943579105 /nfs/dbraw/zinc/57/91/05/943579105.db2.gz MQPBRYCZRGFFHM-RYUDHWBXSA-N 0 0 360.797 3.993 20 5 FHBDRN CN(Cc1cc(Cl)ccc1F)C(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000515249471 943585308 /nfs/dbraw/zinc/58/53/08/943585308.db2.gz JGVMHFJLSJMRNW-UHFFFAOYSA-N 0 0 372.730 3.867 20 5 FHBDRN O=C(c1cccc2c1CCCN2)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000423729233 943605887 /nfs/dbraw/zinc/60/58/87/943605887.db2.gz URZDINLMUSSMJF-UHFFFAOYSA-N 0 0 351.406 3.758 20 5 FHBDRN CCN(CC)C(=O)c1ccc(C(=O)Oc2cccc([N+](=O)[O-])c2C)cc1 ZINC000103765525 943607943 /nfs/dbraw/zinc/60/79/43/943607943.db2.gz JSPXTAACQYVGBU-UHFFFAOYSA-N 0 0 356.378 3.604 20 5 FHBDRN O=C(Cc1ccccc1C(F)(F)F)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000105365689 943640241 /nfs/dbraw/zinc/64/02/41/943640241.db2.gz QRYMRIZXMANWGR-UHFFFAOYSA-N 0 0 350.296 3.745 20 5 FHBDRN CCc1nn(C)c(Sc2nnc3cc(C)c4ccccc4n32)c1[N+](=O)[O-] ZINC000584800688 943641570 /nfs/dbraw/zinc/64/15/70/943641570.db2.gz IIRZPYKJTQDKLG-UHFFFAOYSA-N 0 0 368.422 3.546 20 5 FHBDRN Cc1ccc([C@H](C)N2C(=O)[C@H](C)N(Cc3ccccc3)C2=O)cc1[N+](=O)[O-] ZINC000431952174 943655024 /nfs/dbraw/zinc/65/50/24/943655024.db2.gz QBNHVMZCLQAXJE-GJZGRUSLSA-N 0 0 367.405 3.817 20 5 FHBDRN Cc1ccc([C@@H](C)N2C(=O)[C@H](c3ccccc3)N(C)C2=O)cc1[N+](=O)[O-] ZINC000431950487 943656988 /nfs/dbraw/zinc/65/69/88/943656988.db2.gz LNFMGILOYLYIQO-DYVFJYSZSA-N 0 0 353.378 3.600 20 5 FHBDRN O=C(NCc1coc(-c2cccs2)n1)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000014710654 943711160 /nfs/dbraw/zinc/71/11/60/943711160.db2.gz BXUXXVKRBOXCNF-UHFFFAOYSA-N 0 0 363.782 3.895 20 5 FHBDRN CC(C)(C)OC(=O)C(C)(C)CCNC(=O)Nc1ccc([N+](=O)[O-])cc1F ZINC000424104492 943720220 /nfs/dbraw/zinc/72/02/20/943720220.db2.gz GXWYWYYLBSAKRZ-UHFFFAOYSA-N 0 0 369.393 3.613 20 5 FHBDRN Cc1cc(OC[C@@H](O)COCc2ccccc2)c(Cl)cc1[N+](=O)[O-] ZINC000504672770 943739194 /nfs/dbraw/zinc/73/91/94/943739194.db2.gz DSYGWOJRINEYLI-AWEZNQCLSA-N 0 0 351.786 3.513 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)N[C@H]1CCCOc2ccccc21 ZINC000504691630 943758038 /nfs/dbraw/zinc/75/80/38/943758038.db2.gz WBQQRQSGQBSCPM-INIZCTEOSA-N 0 0 358.419 3.717 20 5 FHBDRN CCSc1ccc([C@@H](C)NC(=O)COc2ccccc2[N+](=O)[O-])cc1 ZINC000504695024 943760422 /nfs/dbraw/zinc/76/04/22/943760422.db2.gz MAMYASOHXFQNLM-CYBMUJFWSA-N 0 0 360.435 3.963 20 5 FHBDRN CC[C@@H](CSc1ccccc1)NC(=O)c1cc(F)cc([N+](=O)[O-])c1N ZINC000504717978 943767311 /nfs/dbraw/zinc/76/73/11/943767311.db2.gz WVYQKDNJEZYOMY-LBPRGKRZSA-N 0 0 363.414 3.617 20 5 FHBDRN COc1cccc(C2=CCN(C(=O)c3cccc(OC)c3[N+](=O)[O-])CC2)c1 ZINC000435814574 943771794 /nfs/dbraw/zinc/77/17/94/943771794.db2.gz XHZFGNJCHIATAZ-UHFFFAOYSA-N 0 0 368.389 3.542 20 5 FHBDRN O=C(N[C@H]1C[C@H](c2ccccc2)C1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000437396297 943773331 /nfs/dbraw/zinc/77/33/31/943773331.db2.gz QZHMJQIMOYSWRW-IYARVYRRSA-N 0 0 365.433 3.871 20 5 FHBDRN C[C@H]1C[C@H](c2ccccc2)N(c2ccc([N+](=O)[O-])cc2S(C)(=O)=O)C1 ZINC000828194707 943775894 /nfs/dbraw/zinc/77/58/94/943775894.db2.gz SACPFOHFKJDRJJ-SUMWQHHRSA-N 0 0 360.435 3.586 20 5 FHBDRN Cc1cc(C(=O)N[C@H]2C[C@@H]2c2ccccc2OC(F)F)ccc1[N+](=O)[O-] ZINC000437403722 943779905 /nfs/dbraw/zinc/77/99/05/943779905.db2.gz LIEKFEIRRZXDJE-KGLIPLIRSA-N 0 0 362.332 3.791 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)N[C@H]1C[C@H](c2cccc(F)c2)C1 ZINC000437411811 943784594 /nfs/dbraw/zinc/78/45/94/943784594.db2.gz WDTCZRUNTWJFCS-CTYIDZIISA-N 0 0 360.410 3.888 20 5 FHBDRN O=[N+]([O-])c1ccc(CSc2nnc(-c3ccncc3)n2C2CC2)cc1 ZINC000019822283 943792035 /nfs/dbraw/zinc/79/20/35/943792035.db2.gz ZJDFTZOFRFVARZ-UHFFFAOYSA-N 0 0 353.407 3.876 20 5 FHBDRN Nc1ccc(-c2noc([C@H]3C[C@H]3c3ccc(F)cc3F)n2)cc1[N+](=O)[O-] ZINC000515329565 943792603 /nfs/dbraw/zinc/79/26/03/943792603.db2.gz VETVPZGSQWGNQL-RYUDHWBXSA-N 0 0 358.304 3.776 20 5 FHBDRN COc1c(C(=O)N[C@H]2C[C@H](c3cccc(Cl)c3)C2)cccc1[N+](=O)[O-] ZINC000437425382 943798012 /nfs/dbraw/zinc/79/80/12/943798012.db2.gz GRGPJFRJUAJHHH-MQMHXKEQSA-N 0 0 360.797 3.933 20 5 FHBDRN COc1ccc(C(=O)N(C)Cc2cc([N+](=O)[O-])ccc2Cl)cc1OC ZINC000053334636 943798090 /nfs/dbraw/zinc/79/80/90/943798090.db2.gz NEEKBPSHMRSMJJ-UHFFFAOYSA-N 0 0 364.785 3.538 20 5 FHBDRN Cn1c(-c2nc(-c3cccnc3Oc3ccccc3)no2)ccc1[N+](=O)[O-] ZINC000504797039 943801012 /nfs/dbraw/zinc/80/10/12/943801012.db2.gz QVETZVPVXLBBQS-UHFFFAOYSA-N 0 0 363.333 3.838 20 5 FHBDRN CC(C)C[C@@H]1C[C@H](NC(=O)c2c([N+](=O)[O-])cccc2C(F)(F)F)CCO1 ZINC000515332768 943802081 /nfs/dbraw/zinc/80/20/81/943802081.db2.gz RDKWOGNCHQQWCV-VXGBXAGGSA-N 0 0 374.359 3.937 20 5 FHBDRN C[C@H](C(=O)N[C@@H](CCO)c1ccc(Cl)cc1)c1cccc([N+](=O)[O-])c1 ZINC000584863738 943810666 /nfs/dbraw/zinc/81/06/66/943810666.db2.gz ZRORMMIIHPSSBW-SJCJKPOMSA-N 0 0 362.813 3.592 20 5 FHBDRN CC(C)CN(Cc1ccccc1F)C(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000515370894 943816406 /nfs/dbraw/zinc/81/64/06/943816406.db2.gz LAUPZZHXDASPCS-UHFFFAOYSA-N 0 0 360.385 3.798 20 5 FHBDRN COCc1cccc2sc(NC(=O)c3cccc(OC)c3[N+](=O)[O-])nc21 ZINC000435873196 943826480 /nfs/dbraw/zinc/82/64/80/943826480.db2.gz UGFXBQZBKVABCT-UHFFFAOYSA-N 0 0 373.390 3.612 20 5 FHBDRN Cc1ncc([N+](=O)[O-])c(OCC(=O)Nc2ccc(C(F)(F)F)cc2)c1C ZINC000566498186 943830350 /nfs/dbraw/zinc/83/03/50/943830350.db2.gz CKDPGWMFCNVRTF-UHFFFAOYSA-N 0 0 369.299 3.643 20 5 FHBDRN Cc1c(CC(=O)N[C@H]2C[C@H](c3cc(F)cc(F)c3)C2)cccc1[N+](=O)[O-] ZINC000437482449 943835116 /nfs/dbraw/zinc/83/51/16/943835116.db2.gz JLEPBLVLFDXQNF-CZIWCDLHSA-N 0 0 360.360 3.786 20 5 FHBDRN O=[N+]([O-])c1ccccc1C[C@H](Nc1ccc(COCCO)cc1)C1CC1 ZINC000424317045 943841008 /nfs/dbraw/zinc/84/10/08/943841008.db2.gz NRBRYGLTAAOTTK-IBGZPJMESA-N 0 0 356.422 3.537 20 5 FHBDRN O=[N+]([O-])c1ccccc1C[C@@H](Nc1ccc(COCCO)cc1)C1CC1 ZINC000424317047 943841274 /nfs/dbraw/zinc/84/12/74/943841274.db2.gz NRBRYGLTAAOTTK-LJQANCHMSA-N 0 0 356.422 3.537 20 5 FHBDRN Cc1ccc([C@@H]2C[C@@H](C)CCN2C(=O)CNc2ccccc2[N+](=O)[O-])o1 ZINC000437470936 943843100 /nfs/dbraw/zinc/84/31/00/943843100.db2.gz JUSSGMZJPXWBIH-GUYCJALGSA-N 0 0 357.410 3.908 20 5 FHBDRN Cn1ccnc1[C@H](N[C@H]1C[C@@]1(F)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000424325591 943845281 /nfs/dbraw/zinc/84/52/81/943845281.db2.gz NYSAGPYVRYHBMP-NLWGTHIKSA-N 0 0 366.396 3.645 20 5 FHBDRN CCCOc1cc(NC(=O)[C@@]2(C)C[C@H]2F)c([N+](=O)[O-])cc1OCCC ZINC000425414363 943848113 /nfs/dbraw/zinc/84/81/13/943848113.db2.gz HWSOJWPDIDANNF-WBVHZDCISA-N 0 0 354.378 3.859 20 5 FHBDRN CSc1ccc(CCNC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)cc1 ZINC000437478490 943848232 /nfs/dbraw/zinc/84/82/32/943848232.db2.gz VMWKCKBSSAZNTI-UHFFFAOYSA-N 0 0 371.462 3.864 20 5 FHBDRN O=C(NCc1c(F)cc(F)c(F)c1F)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000435911230 943848825 /nfs/dbraw/zinc/84/88/25/943848825.db2.gz JVNSMLGYYPYGLW-UHFFFAOYSA-N 0 0 367.258 3.563 20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])N[C@H]1C[C@H](c2cccc(F)c2)C1 ZINC000437500584 943864828 /nfs/dbraw/zinc/86/48/28/943864828.db2.gz XNJZKEKTIFURDD-KOMQPUFPSA-N 0 0 357.385 3.598 20 5 FHBDRN C[C@@H]1CCCC[C@H]1c1nc(-c2ccc(-n3cncn3)c([N+](=O)[O-])c2)no1 ZINC000424359867 943865873 /nfs/dbraw/zinc/86/58/73/943865873.db2.gz IMSXWTBBPTXXDP-DGCLKSJQSA-N 0 0 354.370 3.519 20 5 FHBDRN CO[C@H](CNC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1)c1ccccc1 ZINC000435940353 943872634 /nfs/dbraw/zinc/87/26/34/943872634.db2.gz XYVXICBLVBMQBS-OAQYLSRUSA-N 0 0 372.424 3.799 20 5 FHBDRN CSc1ccc(CCNC(=O)c2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000437526802 943888216 /nfs/dbraw/zinc/88/82/16/943888216.db2.gz JPPMIXPRRYVMGL-UHFFFAOYSA-N 0 0 350.827 3.943 20 5 FHBDRN Cc1nc(NCc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)n(C)n1 ZINC000162490499 943889223 /nfs/dbraw/zinc/88/92/23/943889223.db2.gz KWDAOYMRJWQFNI-UHFFFAOYSA-N 0 0 357.345 3.575 20 5 FHBDRN CCN(C(=O)COc1cc(F)ccc1[N+](=O)[O-])[C@H](C)c1ccc(F)cc1 ZINC000053367333 943889243 /nfs/dbraw/zinc/88/92/43/943889243.db2.gz AUAZSQBMPRITIE-GFCCVEGCSA-N 0 0 364.348 3.862 20 5 FHBDRN COC[C@H](NCc1ccc(Br)cc1[N+](=O)[O-])c1ccc(C)o1 ZINC000425430785 943890490 /nfs/dbraw/zinc/89/04/90/943890490.db2.gz GKXUGZFLTMZXAP-ZDUSSCGKSA-N 0 0 369.215 3.736 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H]1C[C@H](c2cc(F)cc(F)c2)C1 ZINC000437524298 943903424 /nfs/dbraw/zinc/90/34/24/943903424.db2.gz GBWFZKCCFSHMHQ-YEORSEQZSA-N 0 0 362.332 3.558 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)NCc2ccc3c(c2)CCCN3)cc1[N+](=O)[O-] ZINC000417856739 943906892 /nfs/dbraw/zinc/90/68/92/943906892.db2.gz SNHRUEYSRBQCOL-CQSZACIVSA-N 0 0 368.437 3.822 20 5 FHBDRN COCc1cccc(CNC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)c1 ZINC000435995852 943921395 /nfs/dbraw/zinc/92/13/95/943921395.db2.gz OALDJAHUYQXTEW-UHFFFAOYSA-N 0 0 372.424 3.758 20 5 FHBDRN CC(=O)c1cc(N[C@@H]2CCN(c3c(F)cccc3F)C2)ccc1[N+](=O)[O-] ZINC000517022054 943923003 /nfs/dbraw/zinc/92/30/03/943923003.db2.gz VGEFDHUNLLJJDD-CYBMUJFWSA-N 0 0 361.348 3.766 20 5 FHBDRN O=C(NCc1cccc([N+](=O)[O-])c1)c1ccc(Cl)c(Br)c1 ZINC000228994311 943926383 /nfs/dbraw/zinc/92/63/83/943926383.db2.gz LTFOMXRSGMOGQN-UHFFFAOYSA-N 0 0 369.602 3.941 20 5 FHBDRN Cc1cc([C@H]2NC(=O)N([C@H](C)c3ccc(C)c([N+](=O)[O-])c3)C2=O)ccc1F ZINC000431958278 943927906 /nfs/dbraw/zinc/92/79/06/943927906.db2.gz ZEJJVAXPMAGYBC-SJKOYZFVSA-N 0 0 371.368 3.705 20 5 FHBDRN C[C@]12CCN(Cc3ccc(Br)cc3[N+](=O)[O-])C[C@H]1C2(F)F ZINC000425443357 943932549 /nfs/dbraw/zinc/93/25/49/943932549.db2.gz JXHHOOYQKQPAIA-OLZOCXBDSA-N 0 0 361.186 3.834 20 5 FHBDRN COc1cccc(C(=O)N2CCC[C@@H]2/C=C\c2ccccc2)c1[N+](=O)[O-] ZINC000436023401 943942786 /nfs/dbraw/zinc/94/27/86/943942786.db2.gz WEDFMHOCYSSAGO-BFFYNSAMSA-N 0 0 352.390 3.921 20 5 FHBDRN CC(C)C(=O)Nc1ccc(-c2nc(-c3cccc([N+](=O)[O-])c3)no2)cc1 ZINC000504984956 943942859 /nfs/dbraw/zinc/94/28/59/943942859.db2.gz BUBJTPFNCJLJKS-UHFFFAOYSA-N 0 0 352.350 3.906 20 5 FHBDRN C[C@@H](NC(=O)CC1CCCCC1)c1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000504968503 943944552 /nfs/dbraw/zinc/94/45/52/943944552.db2.gz FVWWJQGFFPKKQA-GFCCVEGCSA-N 0 0 358.398 3.792 20 5 FHBDRN COC(=O)c1ccc(/C=C\c2nc(-c3cccc([N+](=O)[O-])c3)no2)cc1 ZINC000504975396 943947062 /nfs/dbraw/zinc/94/70/62/943947062.db2.gz RKVJEHICYRTIEM-YFHOEESVSA-N 0 0 351.318 3.602 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2noc(Cc3coc(-c4cccs4)n3)n2)c1 ZINC000504981404 943950390 /nfs/dbraw/zinc/95/03/90/943950390.db2.gz SGAZPZKTMXCQPN-UHFFFAOYSA-N 0 0 354.347 3.952 20 5 FHBDRN CN(CC(=O)OC(C)(C)C)C(=O)c1cc2ccccc2c2cccnc12 ZINC000505743049 943952377 /nfs/dbraw/zinc/95/23/77/943952377.db2.gz AFICRGXPGGZOAN-UHFFFAOYSA-N 0 0 350.418 3.802 20 5 FHBDRN CC1(F)CC(NC(=O)c2cc(F)cc3c(=O)c4cc(F)ccc4[nH]c23)C1 ZINC000517072350 943955273 /nfs/dbraw/zinc/95/52/73/943955273.db2.gz OVBXECWXTQQCRD-UHFFFAOYSA-N 0 0 360.335 3.580 20 5 FHBDRN CCC(CC)[C@@H](CCNC(=O)N(C)Cc1ccccc1[N+](=O)[O-])OC ZINC000437604844 943961761 /nfs/dbraw/zinc/96/17/61/943961761.db2.gz KLKBAVLGVLPNSV-QGZVFWFLSA-N 0 0 351.447 3.578 20 5 FHBDRN COc1cccc(C(=O)N[C@@H](c2ccc(F)c(C)c2)C2CC2)c1[N+](=O)[O-] ZINC000436037343 943961910 /nfs/dbraw/zinc/96/19/10/943961910.db2.gz UOUHIMPRHZXCDP-QGZVFWFLSA-N 0 0 358.369 3.932 20 5 FHBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N[C@@H]1C[C@H]1c1ccccc1 ZINC000436041003 943965405 /nfs/dbraw/zinc/96/54/05/943965405.db2.gz CDMYZVITBOWCDC-TUKIKUTGSA-N 0 0 360.797 3.688 20 5 FHBDRN COC[C@H](C)Nc1ccccc1NC(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000437609858 943966916 /nfs/dbraw/zinc/96/69/16/943966916.db2.gz CPRSTDYAJPKCGF-AWEZNQCLSA-N 0 0 357.410 3.613 20 5 FHBDRN COC[C@H](C)Nc1ccccc1NC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000437613860 943970403 /nfs/dbraw/zinc/97/04/03/943970403.db2.gz CJKSFDRDFRRCBT-LBPRGKRZSA-N 0 0 368.393 3.775 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)Nc1ccc(C2CC2)c(C)c1 ZINC000566533513 943972686 /nfs/dbraw/zinc/97/26/86/943972686.db2.gz MXTKRKVBPGWTFN-UHFFFAOYSA-N 0 0 367.405 3.920 20 5 FHBDRN CC1(C)CC[C@@H](CNC(=O)c2c(N)cccc2[N+](=O)[O-])c2ccccc21 ZINC000500031339 943976247 /nfs/dbraw/zinc/97/62/47/943976247.db2.gz RGNTYHSPTBWXOL-ZDUSSCGKSA-N 0 0 353.422 3.762 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N(C)Cc1cc(C)c(OC)c(C)c1 ZINC000506079775 943976697 /nfs/dbraw/zinc/97/66/97/943976697.db2.gz UUUOXNWZLGACTA-UHFFFAOYSA-N 0 0 358.394 3.501 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])N[C@@H]1C[C@H]1c1c(F)cccc1Cl ZINC000437630347 943977465 /nfs/dbraw/zinc/97/74/65/943977465.db2.gz OMQKFXRQYYMLJQ-BXUZGUMPSA-N 0 0 363.776 3.743 20 5 FHBDRN CC(C)Oc1ccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1Cl ZINC000505044533 943980672 /nfs/dbraw/zinc/98/06/72/943980672.db2.gz PQZJNFZKRYMDBV-UHFFFAOYSA-N 0 0 370.814 3.836 20 5 FHBDRN C[C@H](NC(=O)N[C@@H]1C[C@H]1c1c(F)cccc1F)c1cccc([N+](=O)[O-])c1 ZINC000437634225 943981386 /nfs/dbraw/zinc/98/13/86/943981386.db2.gz GQGIPHAHIYOIRK-OWRWGESLSA-N 0 0 361.348 3.789 20 5 FHBDRN COC[C@H](C)Nc1ccccc1NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000437620061 943982675 /nfs/dbraw/zinc/98/26/75/943982675.db2.gz YKPCYWPUFBPULT-NSHDSACASA-N 0 0 363.801 3.947 20 5 FHBDRN CN(CC1CCCCC1)C(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000053422927 943985102 /nfs/dbraw/zinc/98/51/02/943985102.db2.gz CRKUAFWHLUMBQD-UHFFFAOYSA-N 0 0 356.426 3.648 20 5 FHBDRN COc1ccc(NC(=O)N2CCc3[nH]c4ccccc4c3C2)cc1[N+](=O)[O-] ZINC000543888504 943996560 /nfs/dbraw/zinc/99/65/60/943996560.db2.gz PJIQYXCBUSLTFS-UHFFFAOYSA-N 0 0 366.377 3.675 20 5 FHBDRN Cc1cc(CN(C)C(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)ccc1F ZINC000436081600 943999148 /nfs/dbraw/zinc/99/91/48/943999148.db2.gz KJIOMZOCLDBAFW-UHFFFAOYSA-N 0 0 355.369 3.656 20 5 FHBDRN O=C(NCc1cccc(F)c1)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000436088534 944004713 /nfs/dbraw/zinc/00/47/13/944004713.db2.gz LUVNVJSAUIXBRT-UHFFFAOYSA-N 0 0 364.351 3.890 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)N[C@@H]1C[C@H]1c1ccc(Cl)cc1 ZINC000437638300 944005905 /nfs/dbraw/zinc/00/59/05/944005905.db2.gz SMCLLROCVVFFPM-DLBZAZTESA-N 0 0 359.813 3.646 20 5 FHBDRN COc1ccccc1SC[C@H](C)CNC(=O)Cc1ccccc1[N+](=O)[O-] ZINC000505063629 944006473 /nfs/dbraw/zinc/00/64/73/944006473.db2.gz RNTMOXADRLJUHR-CQSZACIVSA-N 0 0 374.462 3.691 20 5 FHBDRN Cc1ccc(F)c(CN(C)C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)c1 ZINC000436074830 944009892 /nfs/dbraw/zinc/00/98/92/944009892.db2.gz YSPOHXOUMWJXPM-UHFFFAOYSA-N 0 0 357.385 3.889 20 5 FHBDRN CC(C)CCO[C@@H]1CCCC[C@H]1NC(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000437652344 944010160 /nfs/dbraw/zinc/01/01/60/944010160.db2.gz QHBTVGDGFJSFLD-QZTJIDSGSA-N 0 0 363.458 3.768 20 5 FHBDRN Cc1cccc(NC(=O)c2cc(F)cc3c(=O)c4cc(F)ccc4[nH]c23)n1 ZINC000436075822 944010649 /nfs/dbraw/zinc/01/06/49/944010649.db2.gz NSAXVYJEFBQVQM-UHFFFAOYSA-N 0 0 365.339 3.915 20 5 FHBDRN O=C(c1cc2sccc2s1)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000517105082 944012920 /nfs/dbraw/zinc/01/29/20/944012920.db2.gz DMYYNYILRIUCSM-UHFFFAOYSA-N 0 0 373.459 3.833 20 5 FHBDRN O=C(NCc1ccsc1)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12 ZINC000436100976 944015557 /nfs/dbraw/zinc/01/55/57/944015557.db2.gz OLNJDHLZANVIJV-UHFFFAOYSA-N 0 0 370.380 3.951 20 5 FHBDRN Cc1ccc([C@@H]2CCCN2C(=O)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 ZINC000517116409 944022732 /nfs/dbraw/zinc/02/27/32/944022732.db2.gz RFAYZJNPGYLRJZ-SFHVURJKSA-N 0 0 367.405 3.514 20 5 FHBDRN CCCCO[C@@H]1C[C@@H](N(C)C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1(C)C ZINC000500058848 944028880 /nfs/dbraw/zinc/02/88/80/944028880.db2.gz WTACEMISHBKJFQ-HZPDHXFCSA-N 0 0 374.441 3.527 20 5 FHBDRN CC(C)c1ccc(C(=O)Nc2ccnn2-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000126561229 944038603 /nfs/dbraw/zinc/03/86/03/944038603.db2.gz HXIWGMFWXKJXDT-UHFFFAOYSA-N 0 0 351.366 3.551 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N(Cc1ccc(F)cc1)C1CC1 ZINC000123068997 944039124 /nfs/dbraw/zinc/03/91/24/944039124.db2.gz OOVQZBSMKDIQOU-UHFFFAOYSA-N 0 0 359.357 3.939 20 5 FHBDRN CC[C@H](C)N(Cc1ccccc1)C(=O)COc1ccc(C=O)cc1[N+](=O)[O-] ZINC000053441137 944039266 /nfs/dbraw/zinc/03/92/66/944039266.db2.gz YIASYXOOSFNKOO-HNNXBMFYSA-N 0 0 370.405 3.613 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCc2cc3c(c(Br)c2)OCO3)c1 ZINC000515590680 944043617 /nfs/dbraw/zinc/04/36/17/944043617.db2.gz KMOWQABWXJBKJA-UHFFFAOYSA-N 0 0 366.167 3.973 20 5 FHBDRN Cc1ccc([C@H]2C[C@@H](C)CCN2S(=O)(=O)c2ccc([N+](=O)[O-])cc2)o1 ZINC000437702750 944045894 /nfs/dbraw/zinc/04/58/94/944045894.db2.gz NLOUAOWLOGOATF-BLLLJJGKSA-N 0 0 364.423 3.658 20 5 FHBDRN C[C@H](NC(=O)N(C)Cc1ccccc1[N+](=O)[O-])[C@H]1Oc2ccccc2[C@H]1C ZINC000437720551 944052852 /nfs/dbraw/zinc/05/28/52/944052852.db2.gz BXLDANNSSIJBDS-TYILLQQXSA-N 0 0 369.421 3.689 20 5 FHBDRN O=C(c1c[nH]c2ccc([N+](=O)[O-])cc12)N1CC[C@@H](c2ccccc2F)C1 ZINC000500076679 944055241 /nfs/dbraw/zinc/05/52/41/944055241.db2.gz UKIQJNOHFBKQFH-GFCCVEGCSA-N 0 0 353.353 3.845 20 5 FHBDRN C[C@H](NC(=O)N1CC2(CCC2)[C@@H]1C1CCOCC1)c1ccccc1[N+](=O)[O-] ZINC000425477505 944056739 /nfs/dbraw/zinc/05/67/39/944056739.db2.gz AZFABGHHJFRWTK-KSSFIOAISA-N 0 0 373.453 3.647 20 5 FHBDRN O=C(Nc1ccccc1O)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12 ZINC000436155895 944060670 /nfs/dbraw/zinc/06/06/70/944060670.db2.gz TVKFARYQLYUQNL-UHFFFAOYSA-N 0 0 366.323 3.917 20 5 FHBDRN Cc1ccc2cc(C(=O)NCCc3c[nH]c4ccc([N+](=O)[O-])cc34)[nH]c2c1 ZINC000566554154 944061318 /nfs/dbraw/zinc/06/13/18/944061318.db2.gz NINNFGRBBWXFGA-UHFFFAOYSA-N 0 0 362.389 3.838 20 5 FHBDRN Cn1cc(-c2cc(COc3ccc(C(F)(F)F)cc3[N+](=O)[O-])on2)cn1 ZINC000184031105 944062681 /nfs/dbraw/zinc/06/26/81/944062681.db2.gz GWJYVRIABDVFHH-UHFFFAOYSA-N 0 0 368.271 3.581 20 5 FHBDRN COc1ccc([C@H](C)N(C)C(=O)Nc2ccc([N+](=O)[O-])cc2OC)cc1 ZINC000123074292 944063302 /nfs/dbraw/zinc/06/33/02/944063302.db2.gz WRCNRDGHLWWLRV-LBPRGKRZSA-N 0 0 359.382 3.837 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)Nc1nc(C2CCC2)cs1 ZINC000436169619 944072528 /nfs/dbraw/zinc/07/25/28/944072528.db2.gz HMPAMXXGGRQEBE-UHFFFAOYSA-N 0 0 356.407 3.981 20 5 FHBDRN O=C(c1cc2cccc([N+](=O)[O-])c2[nH]1)N1CC[C@H](c2ccccc2F)C1 ZINC000500085692 944072696 /nfs/dbraw/zinc/07/26/96/944072696.db2.gz ABRYXRVTYONRTE-ZDUSSCGKSA-N 0 0 353.353 3.845 20 5 FHBDRN C[C@H]1CC[C@H](C)N(S(=O)(=O)c2c(Cl)cc(Cl)cc2[N+](=O)[O-])C1 ZINC000436188477 944082049 /nfs/dbraw/zinc/08/20/49/944082049.db2.gz UPOOMSOKLPYBME-IUCAKERBSA-N 0 0 367.254 3.711 20 5 FHBDRN CCOc1ccc(-c2nc(-c3cc(OC)ccc3OC)no2)cc1[N+](=O)[O-] ZINC000545522806 944091329 /nfs/dbraw/zinc/09/13/29/944091329.db2.gz XQGVLDIIHATFAB-UHFFFAOYSA-N 0 0 371.349 3.728 20 5 FHBDRN CC[C@@H](C)[C@H](NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)C(F)(F)F ZINC000436180255 944091972 /nfs/dbraw/zinc/09/19/72/944091972.db2.gz YRXVFSXMZXLFOJ-ABAIWWIYSA-N 0 0 373.375 3.902 20 5 FHBDRN COc1cc(C(=O)Nc2nc(C3CCC3)cs2)c([N+](=O)[O-])cc1OC ZINC000436181698 944094126 /nfs/dbraw/zinc/09/41/26/944094126.db2.gz FHPMPXRWBHLTIF-UHFFFAOYSA-N 0 0 363.395 3.588 20 5 FHBDRN O=[N+]([O-])c1ccc(OCc2nncn2-c2ccccc2)c(C(F)(F)F)c1 ZINC000436200001 944094900 /nfs/dbraw/zinc/09/49/00/944094900.db2.gz 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3.516 20 5 FHBDRN C[C@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1Oc2ccccc2[C@@H]1C ZINC000438159096 944371685 /nfs/dbraw/zinc/37/16/85/944371685.db2.gz SGNZQCNZULCERY-SYTFOFBDSA-N 0 0 374.824 3.860 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)[C@H]2Oc3ccccc3[C@H]2C)c1 ZINC000438141540 944374657 /nfs/dbraw/zinc/37/46/57/944374657.db2.gz KMYKZQBGIASVIM-FMTVUPSXSA-N 0 0 372.446 4.000 20 5 FHBDRN C[C@@H](C(=O)NC[C@]1(C)CCOC2(CCC2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000894660099 944380653 /nfs/dbraw/zinc/38/06/53/944380653.db2.gz IUXWFLBCVLRPEE-FZKQIMNGSA-N 0 0 364.417 3.693 20 5 FHBDRN Cn1ncc([N+](=O)[O-])c1C(=O)Nc1cc(C2CCC(C(C)(C)C)CC2)[nH]n1 ZINC000123590395 944386141 /nfs/dbraw/zinc/38/61/41/944386141.db2.gz IZLQIUIWWSIKST-UHFFFAOYSA-N 0 0 374.445 3.624 20 5 FHBDRN CC(=O)c1cc(N[C@@H](CO)c2cccc(Cl)c2F)ccc1[N+](=O)[O-] ZINC000578781233 944387521 /nfs/dbraw/zinc/38/75/21/944387521.db2.gz KZDUOHFIRRKORZ-AWEZNQCLSA-N 0 0 352.749 3.735 20 5 FHBDRN COc1cc2c(cc1F)CN(C(=O)Nc1ccc([N+](=O)[O-])c(C)c1)CC2 ZINC000473768323 944387558 /nfs/dbraw/zinc/38/75/58/944387558.db2.gz XDMZMYBQTZSTIJ-UHFFFAOYSA-N 0 0 359.357 3.641 20 5 FHBDRN O=C(Nc1cnn(-c2ccc(Cl)cc2Cl)c1)c1cc([N+](=O)[O-])c[nH]1 ZINC000473769761 944388501 /nfs/dbraw/zinc/38/85/01/944388501.db2.gz GEPWZUBJEBLZDT-UHFFFAOYSA-N 0 0 366.164 3.668 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)NC[C@@H]1CCCO[C@@H]1C(C)C ZINC000439169292 944391971 /nfs/dbraw/zinc/39/19/71/944391971.db2.gz NGLOETPVIFIGCP-BLLLJJGKSA-N 0 0 354.834 3.738 20 5 FHBDRN COc1ccc(O[C@@H](C)CNC(=O)Nc2ccc([N+](=O)[O-])c(C)c2)cc1 ZINC000473765340 944392883 /nfs/dbraw/zinc/39/28/83/944392883.db2.gz NUMJUGCOYGFSSC-ZDUSSCGKSA-N 0 0 359.382 3.501 20 5 FHBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC(=O)[C@H](C)C1 ZINC000505844440 944398980 /nfs/dbraw/zinc/39/89/80/944398980.db2.gz GNAYURQXLMZUKP-GFCCVEGCSA-N 0 0 350.440 3.538 20 5 FHBDRN CC(C)c1csc(CNC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)n1 ZINC000151305585 944401831 /nfs/dbraw/zinc/40/18/31/944401831.db2.gz LZPUCOCPTZEEGQ-UHFFFAOYSA-N 0 0 374.466 3.705 20 5 FHBDRN Cc1ccc([C@H](C)Nc2c([N+](=O)[O-])cc(CO)c(C)c2[N+](=O)[O-])s1 ZINC000053582230 944403323 /nfs/dbraw/zinc/40/33/23/944403323.db2.gz WZNMKYYUGBKJSM-JTQLQIEISA-N 0 0 351.384 3.847 20 5 FHBDRN O=C(CNc1ccc2ncccc2c1[N+](=O)[O-])Nc1ccc(Cl)cc1 ZINC000053578363 944403497 /nfs/dbraw/zinc/40/34/97/944403497.db2.gz TWEYXOVMPXUTLL-UHFFFAOYSA-N 0 0 356.769 3.847 20 5 FHBDRN O=C1CCCCN1c1ccc(CNc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1 ZINC000053582936 944403600 /nfs/dbraw/zinc/40/36/00/944403600.db2.gz NOWVPNBIDZCQOH-UHFFFAOYSA-N 0 0 370.365 3.632 20 5 FHBDRN COC(=O)c1cc(NC(=O)C[C@H](C)c2ccc(OC)cc2)cc([N+](=O)[O-])c1 ZINC000426299580 944406153 /nfs/dbraw/zinc/40/61/53/944406153.db2.gz XMSZKYYGLMRBBV-LBPRGKRZSA-N 0 0 372.377 3.522 20 5 FHBDRN CC(=O)Nc1cc(Cl)ccc1NC(=O)c1cc([N+](=O)[O-])c(C)s1 ZINC000105971191 944407410 /nfs/dbraw/zinc/40/74/10/944407410.db2.gz MDVLVIHJHWYEQR-UHFFFAOYSA-N 0 0 353.787 3.829 20 5 FHBDRN Cc1cc(C(=O)Nc2ccnn2Cc2ccccc2F)ccc1[N+](=O)[O-] ZINC000105974122 944407590 /nfs/dbraw/zinc/40/75/90/944407590.db2.gz HVQYUXBOLDFFNF-UHFFFAOYSA-N 0 0 354.341 3.539 20 5 FHBDRN CCCCOC1CCN(C(=O)c2c(C)cc(Cl)cc2[N+](=O)[O-])CC1 ZINC000439169784 944407827 /nfs/dbraw/zinc/40/78/27/944407827.db2.gz RWLUGLRVANFUEY-UHFFFAOYSA-N 0 0 354.834 3.978 20 5 FHBDRN Cc1cn(CC(=O)Nc2ccc(Oc3ccccc3)cc2)nc1[N+](=O)[O-] ZINC000439199651 944427626 /nfs/dbraw/zinc/42/76/26/944427626.db2.gz OEYHHNORTMJDGR-UHFFFAOYSA-N 0 0 352.350 3.531 20 5 FHBDRN Cc1ccc(-n2cccn2)cc1NC(=O)Nc1ccc([N+](=O)[O-])cc1F ZINC000473775522 944429652 /nfs/dbraw/zinc/42/96/52/944429652.db2.gz XYZJAXRXMCCWJP-UHFFFAOYSA-N 0 0 355.329 3.872 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)c1cnc2onc(C(C)(C)C)c2c1 ZINC000516016214 944429543 /nfs/dbraw/zinc/42/95/43/944429543.db2.gz SIAPLNXJFSGEQZ-UHFFFAOYSA-N 0 0 370.365 3.689 20 5 FHBDRN C/C=C/c1ccc(OC[C@@H](O)COc2ccc(C)cc2[N+](=O)[O-])c(OC)c1 ZINC000516020599 944433029 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CCN(C(=O)Cc1ccc([N+](=O)[O-])cc1F)[C@@H](C)Cc1ccsc1 ZINC000426315650 944443004 /nfs/dbraw/zinc/44/30/04/944443004.db2.gz WXSJHQZLSJNHBZ-LBPRGKRZSA-N 0 0 350.415 3.818 20 5 FHBDRN Cc1c(NC(=O)c2c(C)cc(C)c([N+](=O)[O-])c2C)cnn1C1CCOCC1 ZINC000296099942 944450451 /nfs/dbraw/zinc/45/04/51/944450451.db2.gz MSSQXKYDPRDPHY-UHFFFAOYSA-N 0 0 372.425 3.629 20 5 FHBDRN Cc1cc(Br)ccc1CNC(=O)Cc1ccccc1[N+](=O)[O-] ZINC000110324891 944451547 /nfs/dbraw/zinc/45/15/47/944451547.db2.gz UJLHMODCCWIOGB-UHFFFAOYSA-N 0 0 363.211 3.525 20 5 FHBDRN Cc1[nH]nc(C(=O)Nc2cccc(OCCc3ccccc3)c2)c1[N+](=O)[O-] ZINC000506196344 944451944 /nfs/dbraw/zinc/45/19/44/944451944.db2.gz LVEITYJYOGZGHQ-UHFFFAOYSA-N 0 0 366.377 3.500 20 5 FHBDRN COCCc1nc2cc(NC(=O)Nc3ccc([N+](=O)[O-])c(C)c3)ccc2o1 ZINC000473783322 944458746 /nfs/dbraw/zinc/45/87/46/944458746.db2.gz KXFYZSHEXWCRFD-UHFFFAOYSA-N 0 0 370.365 3.877 20 5 FHBDRN O=C(N[C@@H]1C[C@@H]1c1ccccc1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000425972945 944463995 /nfs/dbraw/zinc/46/39/95/944463995.db2.gz DOZLLZSIMRPBSO-RTBURBONSA-N 0 0 351.406 3.825 20 5 FHBDRN O=C(N[C@H]1C[C@H]1c1ccccc1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000425972943 944464238 /nfs/dbraw/zinc/46/42/38/944464238.db2.gz DOZLLZSIMRPBSO-OALUTQOASA-N 0 0 351.406 3.825 20 5 FHBDRN CCN(C(=O)c1ccc(Br)cc1[N+](=O)[O-])c1cccnc1C ZINC000439235160 944465405 /nfs/dbraw/zinc/46/54/05/944465405.db2.gz OVOIBHKSWFRTDJ-UHFFFAOYSA-N 0 0 364.199 3.727 20 5 FHBDRN CCc1ccnc(CNC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1 ZINC000438289492 944466700 /nfs/dbraw/zinc/46/67/00/944466700.db2.gz DWBNGAHMWPQFAZ-UHFFFAOYSA-N 0 0 356.426 3.672 20 5 FHBDRN C[C@@H]1CC[C@@H](COc2c3cc(Br)ccc3ncc2[N+](=O)[O-])O1 ZINC000473789496 944470089 /nfs/dbraw/zinc/47/00/89/944470089.db2.gz YNJWVIKSIUEHQG-KOLCDFICSA-N 0 0 367.199 3.852 20 5 FHBDRN COC(=O)[C@H](Cc1ccc(Cl)cc1)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000438295766 944471480 /nfs/dbraw/zinc/47/14/80/944471480.db2.gz WBOVXWSXHYXIJJ-PXAZEXFGSA-N 0 0 362.813 3.683 20 5 FHBDRN C[C@@H]1CCN(C(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)[C@H]2CCCC[C@@H]12 ZINC000517645563 944476117 /nfs/dbraw/zinc/47/61/17/944476117.db2.gz ZQVMPYGFJHNADG-IAISJRAMSA-N 0 0 369.421 3.889 20 5 FHBDRN Cc1cccc(NC(=O)[C@@H](C)OC(=O)CSc2ccccc2[N+](=O)[O-])c1 ZINC000025059425 944477058 /nfs/dbraw/zinc/47/70/58/944477058.db2.gz SWNPDCITMVRCPS-CYBMUJFWSA-N 0 0 374.418 3.566 20 5 FHBDRN CCOC(=O)c1cc(C(=O)N2CCCc3ccc(C)cc32)cc([N+](=O)[O-])c1 ZINC000110394996 944478254 /nfs/dbraw/zinc/47/82/54/944478254.db2.gz NTGBNPSWNZMAPI-UHFFFAOYSA-N 0 0 368.389 3.673 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N(Cc1ccccc1)CC1CCOCC1 ZINC000110391272 944478320 /nfs/dbraw/zinc/47/83/20/944478320.db2.gz JMBPWGQFBLUIGC-UHFFFAOYSA-N 0 0 368.433 3.972 20 5 FHBDRN O=C(c1cc2c(cc1[N+](=O)[O-])OCO2)N1CC[C@H](c2ccc(Cl)cc2)C1 ZINC000517649181 944479387 /nfs/dbraw/zinc/47/93/87/944479387.db2.gz BHKIZFISJFHYHB-LBPRGKRZSA-N 0 0 374.780 3.607 20 5 FHBDRN Cc1cc(NC(=O)NCc2ccc(OC(C)(C)C)nc2)ccc1[N+](=O)[O-] ZINC000473791512 944493735 /nfs/dbraw/zinc/49/37/35/944493735.db2.gz XUHRFSDWEQPKNZ-UHFFFAOYSA-N 0 0 358.398 3.797 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N(CC(F)(F)F)c1ccccn1 ZINC000414992516 944494928 /nfs/dbraw/zinc/49/49/28/944494928.db2.gz BTJKIBMWHGFMJH-UONOGXRCSA-N 0 0 365.311 3.689 20 5 FHBDRN CCc1ccc([C@H](NCc2snnc2C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000426336622 944496847 /nfs/dbraw/zinc/49/68/47/944496847.db2.gz VSJXUFXCZWLDBT-QGZVFWFLSA-N 0 0 358.423 3.789 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2cnn(Cc3cncn3Cc3ccccc3)c2)c1 ZINC000438331486 944501044 /nfs/dbraw/zinc/50/10/44/944501044.db2.gz YETWUEYTABAUKI-UHFFFAOYSA-N 0 0 359.389 3.751 20 5 FHBDRN C[C@@H](C(=O)N1CC[C@@]2(C1)CCc1ccccc1O2)c1cccc([N+](=O)[O-])c1 ZINC000519571305 944503778 /nfs/dbraw/zinc/50/37/78/944503778.db2.gz LKPZBRVSLBNBCD-QVKFZJNVSA-N 0 0 366.417 3.695 20 5 FHBDRN CC(=O)Nc1cc(F)c(F)cc1NC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc21 ZINC000506541463 944505965 /nfs/dbraw/zinc/50/59/65/944505965.db2.gz OJUCVBRRSASDGF-UHFFFAOYSA-N 0 0 374.303 3.565 20 5 FHBDRN CCc1nc([C@H](C)NC(=O)c2ccc(SC)c([N+](=O)[O-])c2)cs1 ZINC000110497019 944509555 /nfs/dbraw/zinc/50/95/55/944509555.db2.gz RRJOSCQYHRFILG-VIFPVBQESA-N 0 0 351.453 3.827 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCC[C@@H](CO)C1 ZINC000516108685 944509808 /nfs/dbraw/zinc/50/98/08/944509808.db2.gz LVBCNKCQTUHUAT-UONOGXRCSA-N 0 0 366.483 3.625 20 5 FHBDRN C[C@H](C(=O)OC(C)(C)C)N(C(=O)c1cc2cc([N+](=O)[O-])ccc2o1)C1CC1 ZINC000412502261 944511936 /nfs/dbraw/zinc/51/19/36/944511936.db2.gz BPCYCVMSIHDYCD-LLVKDONJSA-N 0 0 374.393 3.676 20 5 FHBDRN C[C@H]1CO[C@@H](c2ccccc2Cl)CN1C(=O)Cc1ccccc1[N+](=O)[O-] ZINC000110515807 944519576 /nfs/dbraw/zinc/51/95/76/944519576.db2.gz JQSWYYUWDUFDSS-SCLBCKFNSA-N 0 0 374.824 3.779 20 5 FHBDRN CCOCCN(CC)c1c2cc(Br)ccc2ncc1[N+](=O)[O-] ZINC000518592657 944521768 /nfs/dbraw/zinc/52/17/68/944521768.db2.gz HSTLIODRQDTBEG-UHFFFAOYSA-N 0 0 368.231 3.768 20 5 FHBDRN C[C@H](C(=O)OC(C)(C)C)N(C(=O)c1ccc([N+](=O)[O-])cc1Cl)C1CC1 ZINC000412503517 944524103 /nfs/dbraw/zinc/52/41/03/944524103.db2.gz GBPCZSJSKPFQIA-SNVBAGLBSA-N 0 0 368.817 3.583 20 5 FHBDRN C[C@@H]1CO[C@H](c2ccccc2Cl)CN1C(=O)c1cccc([N+](=O)[O-])c1 ZINC000110515608 944531664 /nfs/dbraw/zinc/53/16/64/944531664.db2.gz YOQPMZBRLMALFA-PXAZEXFGSA-N 0 0 360.797 3.850 20 5 FHBDRN CC(C)(C)c1ccc(CCNC(=O)NCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000516150262 944537806 /nfs/dbraw/zinc/53/78/06/944537806.db2.gz MFVMCEJSAYCMNO-UHFFFAOYSA-N 0 0 355.438 3.934 20 5 FHBDRN CCN(CCCNC(=O)c1c(C)c(F)ccc1[N+](=O)[O-])c1ccccc1 ZINC000843758196 944540005 /nfs/dbraw/zinc/54/00/05/944540005.db2.gz KPPGRZQWFIJIQJ-UHFFFAOYSA-N 0 0 359.401 3.689 20 5 FHBDRN CCOc1ccc(C(=O)Nc2cnc3c(cnn3C(C)C)c2)cc1[N+](=O)[O-] ZINC000017573713 944540653 /nfs/dbraw/zinc/54/06/53/944540653.db2.gz CYYOHCANILKSLT-UHFFFAOYSA-N 0 0 369.381 3.571 20 5 FHBDRN C[C@H](Cc1ccc(C(F)(F)F)cc1)NC(=O)c1ccccc1[N+](=O)[O-] ZINC000110556807 944541235 /nfs/dbraw/zinc/54/12/35/944541235.db2.gz AOSFLQJHZBTAOW-LLVKDONJSA-N 0 0 352.312 3.975 20 5 FHBDRN O=[N+]([O-])c1ccc(OCc2cc3c(c(Br)c2)OCO3)c(F)c1 ZINC000505869263 944553612 /nfs/dbraw/zinc/55/36/12/944553612.db2.gz WMBFSWYXYDCERP-UHFFFAOYSA-N 0 0 370.130 3.804 20 5 FHBDRN C[C@H](NC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)[C@H]1Oc2ccccc2[C@@H]1C ZINC000438389417 944555609 /nfs/dbraw/zinc/55/56/09/944555609.db2.gz FOEXIHZDKXFDEX-ZKTNFTSUSA-N 0 0 365.389 3.759 20 5 FHBDRN COC(=O)c1c(C)c([N+](=O)[O-])ccc1NCc1ccc2oc(C)nc2c1 ZINC001167759562 944561022 /nfs/dbraw/zinc/56/10/22/944561022.db2.gz CATGTNMSOMWXIL-UHFFFAOYSA-N 0 0 355.350 3.752 20 5 FHBDRN CSc1ccccc1N(C)S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000425993714 944565745 /nfs/dbraw/zinc/56/57/45/944565745.db2.gz MLPKYZFSDBHKMV-UHFFFAOYSA-N 0 0 372.855 3.795 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])Nc1ccc(OC(F)F)c2cccnc12 ZINC000184310251 944567506 /nfs/dbraw/zinc/56/75/06/944567506.db2.gz XLXYBHTUMMRDGI-UHFFFAOYSA-N 0 0 373.315 3.926 20 5 FHBDRN Cc1ccc(C(=O)N[C@]2(Cc3ccc(Cl)cc3)CCOC2)cc1[N+](=O)[O-] ZINC000500340912 944569534 /nfs/dbraw/zinc/56/95/34/944569534.db2.gz DZHKBKUXAKVHMB-IBGZPJMESA-N 0 0 374.824 3.688 20 5 FHBDRN Cc1ccc(C(=O)N[C@@]2(Cc3ccc(Cl)cc3)CCOC2)cc1[N+](=O)[O-] ZINC000500340913 944569718 /nfs/dbraw/zinc/56/97/18/944569718.db2.gz DZHKBKUXAKVHMB-LJQANCHMSA-N 0 0 374.824 3.688 20 5 FHBDRN CC(C)Cc1cccc([C@@H](C)c2nc(-c3c([N+](=O)[O-])ncn3C)no2)c1 ZINC000516189124 944577792 /nfs/dbraw/zinc/57/77/92/944577792.db2.gz JONAGDJKXGRLOX-GFCCVEGCSA-N 0 0 355.398 3.729 20 5 FHBDRN CCCn1nc(C)c(C(=O)OCc2ccc(Cl)c([N+](=O)[O-])c2)c1C ZINC000759856006 944579079 /nfs/dbraw/zinc/57/90/79/944579079.db2.gz DTXXTEMGEKUBIZ-UHFFFAOYSA-N 0 0 351.790 3.829 20 5 FHBDRN CCCc1ccc(C(=O)Nc2cc3c(cc2[N+](=O)[O-])OCCCO3)cc1 ZINC000518656755 944580862 /nfs/dbraw/zinc/58/08/62/944580862.db2.gz SNAMEKUWKXHJDM-UHFFFAOYSA-N 0 0 356.378 3.961 20 5 FHBDRN Cc1cccc(O[C@@H](C)C(=O)N(C)Cc2cc([N+](=O)[O-])ccc2Cl)c1 ZINC000140238680 944582274 /nfs/dbraw/zinc/58/22/74/944582274.db2.gz KFYKHCOOBHUFSU-ZDUSSCGKSA-N 0 0 362.813 3.983 20 5 FHBDRN Cc1cc(CNC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)ccc1F ZINC000120295872 944585879 /nfs/dbraw/zinc/58/58/79/944585879.db2.gz SDXZDCJPRUQSJG-UHFFFAOYSA-N 0 0 357.385 3.917 20 5 FHBDRN CC(C)(C)[C@H]1CCCC[C@H]1NS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000506223435 944589092 /nfs/dbraw/zinc/58/90/92/944589092.db2.gz LTCPOGHBIHNLMT-JKSUJKDBSA-N 0 0 354.472 3.619 20 5 FHBDRN O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)N[C@H]1CCC[C@H]1c1ccccc1 ZINC000516209544 944589847 /nfs/dbraw/zinc/58/98/47/944589847.db2.gz BLVSRAOTYYNSRO-KSSFIOAISA-N 0 0 360.360 3.868 20 5 FHBDRN C[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000506570371 944593199 /nfs/dbraw/zinc/59/31/99/944593199.db2.gz KGPZYPPQQMXBOY-ZDUSSCGKSA-N 0 0 369.421 3.649 20 5 FHBDRN CCOC(=O)c1cc(NCc2ccc3oc(C)nc3c2)ccc1[N+](=O)[O-] ZINC001167760566 944602432 /nfs/dbraw/zinc/60/24/32/944602432.db2.gz OYLZXJAMDCOSAH-UHFFFAOYSA-N 0 0 355.350 3.833 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)NCCC(C)(C)C(=O)OC(C)(C)C ZINC000425626552 944608711 /nfs/dbraw/zinc/60/87/11/944608711.db2.gz TWFIYIFLXLMWHN-UHFFFAOYSA-N 0 0 365.430 3.783 20 5 FHBDRN O=[N+]([O-])c1cc2c(ncnc2NCc2c(F)cc(F)c(F)c2F)s1 ZINC000566695417 944627576 /nfs/dbraw/zinc/62/75/76/944627576.db2.gz FRKJWXTVWSPYSQ-UHFFFAOYSA-N 0 0 358.276 3.768 20 5 FHBDRN O=[N+]([O-])c1ccccc1-c1ccc(CN2CCN(CC(F)(F)F)CC2)o1 ZINC000506245934 944658985 /nfs/dbraw/zinc/65/89/85/944658985.db2.gz CIRZZDJIYOJDAH-UHFFFAOYSA-N 0 0 369.343 3.535 20 5 FHBDRN COc1cccc(Cc2noc(C(C)(C)c3ccccc3[N+](=O)[O-])n2)c1 ZINC000426401511 944671960 /nfs/dbraw/zinc/67/19/60/944671960.db2.gz ADNPGQAZLCTPRF-UHFFFAOYSA-N 0 0 353.378 3.903 20 5 FHBDRN Cc1nn(C(C)C)c(C)c1Cc1nc(Cc2ccccc2[N+](=O)[O-])no1 ZINC000426401792 944672058 /nfs/dbraw/zinc/67/20/58/944672058.db2.gz BAEOMMNLXIUIBI-UHFFFAOYSA-N 0 0 355.398 3.554 20 5 FHBDRN CC[C@@H](NC(=O)c1ncccc1C(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000092443794 944672828 /nfs/dbraw/zinc/67/28/28/944672828.db2.gz QSBQPMGTCGBFIR-CYBMUJFWSA-N 0 0 353.300 3.890 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)c1ccc(C(F)(F)F)cc1O ZINC000436829109 944674725 /nfs/dbraw/zinc/67/47/25/944674725.db2.gz RVWPHZREOMWNNZ-UHFFFAOYSA-N 0 0 368.311 3.634 20 5 FHBDRN O=C(NCCOc1ccc(C(F)(F)F)cc1)Nc1ccc([N+](=O)[O-])cc1 ZINC000506251343 944675880 /nfs/dbraw/zinc/67/58/80/944675880.db2.gz XSXLTLYPKJENJV-UHFFFAOYSA-N 0 0 369.299 3.814 20 5 FHBDRN Cc1ccc(S(=O)(=O)NC2(c3ccccc3)CCCC2)c([N+](=O)[O-])c1 ZINC000506254676 944681348 /nfs/dbraw/zinc/68/13/48/944681348.db2.gz ODEBSCVMNSCXIS-UHFFFAOYSA-N 0 0 360.435 3.651 20 5 FHBDRN CCOC(=O)c1cc(C(=O)N(CC(C)C)CC(C)C)cc([N+](=O)[O-])c1 ZINC000073519778 944689566 /nfs/dbraw/zinc/68/95/66/944689566.db2.gz ZEFZXXGHDHHLIN-UHFFFAOYSA-N 0 0 350.415 3.526 20 5 FHBDRN CC(=O)Nc1ccc(Oc2cc(C(F)(F)F)ncc2[N+](=O)[O-])c(F)c1 ZINC000436395019 944695811 /nfs/dbraw/zinc/69/58/11/944695811.db2.gz GVDPPRUUHRIVOF-UHFFFAOYSA-N 0 0 359.235 3.898 20 5 FHBDRN O=C([O-])[C@H](Cc1ccccc1)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000426697947 944697778 /nfs/dbraw/zinc/69/77/78/944697778.db2.gz YHFXRIHPVQHWMY-KRWDZBQOSA-N 0 0 366.373 3.640 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@]1(O)CCCC(C)(C)C1 ZINC000438501735 944697958 /nfs/dbraw/zinc/69/79/58/944697958.db2.gz MFDYYSUDRKHWFA-FZKQIMNGSA-N 0 0 366.483 3.523 20 5 FHBDRN COc1c(Cl)cc(NC(=O)COc2cccc([N+](=O)[O-])c2)cc1Cl ZINC000506258180 944701675 /nfs/dbraw/zinc/70/16/75/944701675.db2.gz GPGLCPOIDIVQJH-UHFFFAOYSA-N 0 0 371.176 3.928 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)NC1CCC2(CCOCC2)CC1 ZINC000438516981 944712050 /nfs/dbraw/zinc/71/20/50/944712050.db2.gz PDNDIGWJKMOXTL-UHFFFAOYSA-N 0 0 364.467 3.543 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])Nc1cccc(OC2CCCC2)c1 ZINC000516332081 944731987 /nfs/dbraw/zinc/73/19/87/944731987.db2.gz QKRJYPHQMQQGKH-UHFFFAOYSA-N 0 0 355.394 3.967 20 5 FHBDRN COc1ccc([C@@H]2CCCN2C(=O)Nc2cccc([N+](=O)[O-])c2)c(OC)c1 ZINC000017742734 944738754 /nfs/dbraw/zinc/73/87/54/944738754.db2.gz YWGMNJUGIMGDMT-KRWDZBQOSA-N 0 0 371.393 3.981 20 5 FHBDRN C[C@@H]1Oc2cc(F)ccc2[C@@H]1Nc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 ZINC000516337713 944738763 /nfs/dbraw/zinc/73/87/63/944738763.db2.gz YHLDUFLKDJJJQW-NIVTXAMTSA-N 0 0 357.341 3.553 20 5 FHBDRN CCOc1cc(-c2noc(COc3ccc([N+](=O)[O-])c(C)c3)n2)ccc1O ZINC000436875733 944744079 /nfs/dbraw/zinc/74/40/79/944744079.db2.gz FBDAHXQGTUQZBD-UHFFFAOYSA-N 0 0 371.349 3.637 20 5 FHBDRN Cc1ncsc1/C=C\c1nc(CCNc2ccccc2[N+](=O)[O-])no1 ZINC000516345844 944751851 /nfs/dbraw/zinc/75/18/51/944751851.db2.gz SXTHOKAJGWSSIG-SREVYHEPSA-N 0 0 357.395 3.568 20 5 FHBDRN COc1ccccc1CCN(C)C(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000517859992 944755609 /nfs/dbraw/zinc/75/56/09/944755609.db2.gz JNXZJYFCFZDJEG-UHFFFAOYSA-N 0 0 354.362 3.664 20 5 FHBDRN Cc1ccc(N(C)S(=O)(=O)c2ccc([N+](=O)[O-])c3cccnc32)cc1C ZINC000463522229 944770244 /nfs/dbraw/zinc/77/02/44/944770244.db2.gz XUOOREGRLHZVOK-UHFFFAOYSA-N 0 0 371.418 3.585 20 5 FHBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)N1CC[C@@H](CC2CC2)C1 ZINC000518821435 944798443 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CC(C)(c1nc([C@@H]2COc3ccccc3O2)no1)c1ccccc1[N+](=O)[O-] ZINC000426446686 944825897 /nfs/dbraw/zinc/82/58/97/944825897.db2.gz BATJEIULEXURHX-INIZCTEOSA-N 0 0 367.361 3.816 20 5 FHBDRN O=C([O-])[C@H](Cc1ccco1)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000426812411 944834697 /nfs/dbraw/zinc/83/46/97/944834697.db2.gz YLOJLTIPGBVQDE-INIZCTEOSA-N 0 0 372.402 3.702 20 5 FHBDRN CC(C)CCOc1ccccc1CNC(=O)Cc1ccccc1[N+](=O)[O-] ZINC000506636982 944836717 /nfs/dbraw/zinc/83/67/17/944836717.db2.gz XGCDWBQDGDYXLS-UHFFFAOYSA-N 0 0 356.422 3.879 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)Nc2cccc3c2OCCC3=O)cc1[N+](=O)[O-] ZINC000506990241 944840547 /nfs/dbraw/zinc/84/05/47/944840547.db2.gz XDOLRYVPTJEPBZ-GFCCVEGCSA-N 0 0 369.377 3.751 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])Nc1ccc(Br)c(F)c1 ZINC000438605427 944844371 /nfs/dbraw/zinc/84/43/71/944844371.db2.gz PHBFVDVTSBQFIR-UHFFFAOYSA-N 0 0 368.162 3.818 20 5 FHBDRN CC(C)N(c1ccc(Cl)cc1)S(=O)(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000518843757 944854800 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COc1cc(CN(C)c2ccc([N+](=O)[O-])c(OC(F)F)c2)ccc1O ZINC000092926495 944881379 /nfs/dbraw/zinc/88/13/79/944881379.db2.gz ORWJKCDPRJQBBP-UHFFFAOYSA-N 0 0 354.309 3.547 20 5 FHBDRN O=[N+]([O-])c1ccc(NCCc2ccn(-c3ccccc3)n2)c2ccncc21 ZINC000507040267 944887123 /nfs/dbraw/zinc/88/71/23/944887123.db2.gz SQVNKQXQYSQJNF-UHFFFAOYSA-N 0 0 359.389 3.983 20 5 FHBDRN CC(C)(NC(=O)N[C@@H]1CCCc2cc(N)ccc21)c1ccccc1[N+](=O)[O-] ZINC000418559521 944888714 /nfs/dbraw/zinc/88/87/14/944888714.db2.gz QUGOFHCTIZTLDN-QGZVFWFLSA-N 0 0 368.437 3.789 20 5 FHBDRN Cc1c(NC(=O)N[C@@H]2CC[N@@H+]([C@H](C)c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000506306334 944888896 /nfs/dbraw/zinc/88/88/96/944888896.db2.gz BDVFHDQJYIONRQ-NVXWUHKLSA-N 0 0 368.437 3.860 20 5 FHBDRN Cc1c(NC(=O)N[C@H]2CC[N@@H+]([C@H](C)c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000506306335 944889338 /nfs/dbraw/zinc/88/93/38/944889338.db2.gz BDVFHDQJYIONRQ-WBVHZDCISA-N 0 0 368.437 3.860 20 5 FHBDRN Cc1c(NC(=O)N2CC[C@@H](COc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000506314205 944890280 /nfs/dbraw/zinc/89/02/80/944890280.db2.gz DTIWHYFYQLVISW-OAHLLOKOSA-N 0 0 355.394 3.836 20 5 FHBDRN CC(C)Cn1c(-c2ccc([N+](=O)[O-])cc2)nnc1N(C)C[C@@H]1CCCCO1 ZINC000517969592 944893535 /nfs/dbraw/zinc/89/35/35/944893535.db2.gz VLYUXFBCCYMKML-KRWDZBQOSA-N 0 0 373.457 3.515 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCC1(O)CCCCC1 ZINC000506653657 944895388 /nfs/dbraw/zinc/89/53/88/944895388.db2.gz NJWSDZGTWASTOY-UHFFFAOYSA-N 0 0 352.456 3.522 20 5 FHBDRN COc1ccc(Cl)cc1CN(C)C(=O)c1ccc([N+](=O)[O-])cc1OC ZINC000426883460 944903521 /nfs/dbraw/zinc/90/35/21/944903521.db2.gz SRUDNDGILUCZMV-UHFFFAOYSA-N 0 0 364.785 3.538 20 5 FHBDRN O=C(NCCCOc1cccc2cccnc21)Nc1cccc([N+](=O)[O-])c1 ZINC000518887521 944907662 /nfs/dbraw/zinc/90/76/62/944907662.db2.gz AJGBQWQVKACEMT-UHFFFAOYSA-N 0 0 366.377 3.734 20 5 FHBDRN CC(C)[C@H](Cc1ccc(F)cc1)NC(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000437012346 944913530 /nfs/dbraw/zinc/91/35/30/944913530.db2.gz LAWCQJPDIZPVEZ-SFHVURJKSA-N 0 0 373.428 3.919 20 5 FHBDRN CCc1ccc([C@H](CO)NC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)cc1 ZINC000439746018 944924684 /nfs/dbraw/zinc/92/46/84/944924684.db2.gz MIDJFIONVWLGNS-SFHVURJKSA-N 0 0 356.422 3.744 20 5 FHBDRN CCO[C@H](C)c1noc(CSCc2c(F)cc([N+](=O)[O-])cc2F)n1 ZINC000507092850 944930506 /nfs/dbraw/zinc/93/05/06/944930506.db2.gz FVMFYBKJFCBMJH-MRVPVSSYSA-N 0 0 359.354 3.787 20 5 FHBDRN CC[C@H](C)c1nnc(N(C)Cc2ccccc2[N+](=O)[O-])n1C[C@@H]1CCCO1 ZINC000549508527 944931631 /nfs/dbraw/zinc/93/16/31/944931631.db2.gz OMPWNAMYLAYAKO-HOCLYGCPSA-N 0 0 373.457 3.515 20 5 FHBDRN CC[C@@H](C)Oc1ccc(NS(=O)(=O)c2cc([N+](=O)[O-])ccc2C)cc1 ZINC000511709473 944934534 /nfs/dbraw/zinc/93/45/34/944934534.db2.gz APKXHEJFKNOUBG-CYBMUJFWSA-N 0 0 364.423 3.881 20 5 FHBDRN CCC(CC)[C@@H](CCNC(=O)c1cc(SC)ccc1[N+](=O)[O-])OC ZINC000437026843 944942757 /nfs/dbraw/zinc/94/27/57/944942757.db2.gz WXFKFGLBJATHMR-MRXNPFEDSA-N 0 0 354.472 3.888 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC(CC)(CO)CC1 ZINC000507085584 944942887 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FHBDRN COc1ccc(CN2C[C@H]3CCCCN3c3ccccc32)cc1[N+](=O)[O-] ZINC000550048630 945630443 /nfs/dbraw/zinc/63/04/43/945630443.db2.gz HDNUSNQROIWQCE-MRXNPFEDSA-N 0 0 353.422 3.983 20 5 FHBDRN COc1ccc(CN2C[C@@H]3CCCCN3c3ccccc32)cc1[N+](=O)[O-] ZINC000550048627 945630729 /nfs/dbraw/zinc/63/07/29/945630729.db2.gz HDNUSNQROIWQCE-INIZCTEOSA-N 0 0 353.422 3.983 20 5 FHBDRN CCC(=O)Nc1ccc(NC(=O)CCOc2cc(C)ccc2[N+](=O)[O-])cc1 ZINC000058937224 945633146 /nfs/dbraw/zinc/63/31/46/945633146.db2.gz ZNTIYAHQUXFKEC-UHFFFAOYSA-N 0 0 371.393 3.659 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CC[C@H](C)[C@@H](C)C2)cc1OC ZINC000248616934 945633311 /nfs/dbraw/zinc/63/33/11/945633311.db2.gz RUCLERGBJIINHB-RWMBFGLXSA-N 0 0 350.415 3.557 20 5 FHBDRN O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC[C@H]1[C@@H]1CCCOC1 ZINC000519662657 945636512 /nfs/dbraw/zinc/63/65/12/945636512.db2.gz ZXGSKIKVROXVKC-DOMZBBRYSA-N 0 0 360.435 3.841 20 5 FHBDRN Cn1nccc1[C@@H]1CCCCN1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000281453613 945639395 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COc1cc2nc(NC(=O)c3cc(C)cc([N+](=O)[O-])c3)sc2cc1OC ZINC000147349864 945667049 /nfs/dbraw/zinc/66/70/49/945667049.db2.gz BAPIJJGKRGJLRW-UHFFFAOYSA-N 0 0 373.390 3.782 20 5 FHBDRN CCc1ccc(CNc2ccc([N+](=O)[O-])c(N3CCOCC3)c2F)s1 ZINC000519533048 945667404 /nfs/dbraw/zinc/66/74/04/945667404.db2.gz NYOAGEIZGJPTLW-UHFFFAOYSA-N 0 0 365.430 3.807 20 5 FHBDRN CCCc1ccc(CN2C(=O)N[C@@](C)(c3cccc([N+](=O)[O-])c3)C2=O)cc1 ZINC000519727473 945679709 /nfs/dbraw/zinc/67/97/09/945679709.db2.gz QABVABSVTGWAGP-FQEVSTJZSA-N 0 0 367.405 3.515 20 5 FHBDRN O=C(CCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])N1CCCC[C@@H]1C1CCC1 ZINC000843743281 945680951 /nfs/dbraw/zinc/68/09/51/945680951.db2.gz LPRDQUPRHANSMF-MRXNPFEDSA-N 0 0 361.398 3.617 20 5 FHBDRN COC(=O)c1c(C2CC2)csc1NC(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000439660243 945701089 /nfs/dbraw/zinc/70/10/89/945701089.db2.gz IWJXDYLMAGNRPD-UHFFFAOYSA-N 0 0 360.391 3.881 20 5 FHBDRN COC(=O)N(C)Cc1ccc(NC(=O)c2c(C)ccc([N+](=O)[O-])c2C)cc1 ZINC001126032272 945713010 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Cc1ccc(NC(=O)C2CC2)cc1NC(=O)c1cccc(C)c1[N+](=O)[O-] ZINC000044551151 945736150 /nfs/dbraw/zinc/73/61/50/945736150.db2.gz AQXRHIFPLRMOAY-UHFFFAOYSA-N 0 0 353.378 3.812 20 5 FHBDRN C[C@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl)c1c(F)cccc1F ZINC000522742668 945736106 /nfs/dbraw/zinc/73/61/06/945736106.db2.gz FIYNYHNUOUEAHC-VIFPVBQESA-N 0 0 354.740 3.946 20 5 FHBDRN CCc1[nH]nc(C(=O)Nc2nc(-c3ccc(C)cc3)c(C)s2)c1[N+](=O)[O-] ZINC000444033603 945740594 /nfs/dbraw/zinc/74/05/94/945740594.db2.gz GHVRRFAFRJGLDQ-UHFFFAOYSA-N 0 0 371.422 3.873 20 5 FHBDRN COc1ccc(-c2ocnc2C(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 ZINC000519792121 945746118 /nfs/dbraw/zinc/74/61/18/945746118.db2.gz UKTOXUSAVSQFKD-UHFFFAOYSA-N 0 0 353.334 3.819 20 5 FHBDRN Cc1cc(Cl)c(C(=O)N2C[C@@H](C)OC3(CCCC3)C2)cc1[N+](=O)[O-] ZINC000843745773 945769300 /nfs/dbraw/zinc/76/93/00/945769300.db2.gz QVHNSDIKTCKJBX-GFCCVEGCSA-N 0 0 352.818 3.730 20 5 FHBDRN COc1ccc(Cc2nc(-c3ccnc4ccccc43)no2)c([N+](=O)[O-])c1 ZINC001211851755 945787879 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O=C(COc1ccc([N+](=O)[O-])cc1)Nc1ccc(Cl)c2ncccc12 ZINC000026078346 946693645 /nfs/dbraw/zinc/69/36/45/946693645.db2.gz LTZXIRGJVLJRKZ-UHFFFAOYSA-N 0 0 357.753 3.814 20 5 FHBDRN CC(C)Oc1ccc(NC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)cc1 ZINC000088361549 946706745 /nfs/dbraw/zinc/70/67/45/946706745.db2.gz AKKXWQQSCFIHDF-UHFFFAOYSA-N 0 0 355.394 3.972 20 5 FHBDRN CCOc1cc(C)ccc1NC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088363072 946708028 /nfs/dbraw/zinc/70/80/28/946708028.db2.gz NSJDXVOEVSACSU-UHFFFAOYSA-N 0 0 355.394 3.892 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)NCC2(c3ccccc3)CCCC2)c1 ZINC000067543128 946708902 /nfs/dbraw/zinc/70/89/02/946708902.db2.gz CJZPRBLEOGBZKF-UHFFFAOYSA-N 0 0 354.406 3.845 20 5 FHBDRN O=C(c1cnc([C@@H]2CCCO2)s1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000129725984 946715177 /nfs/dbraw/zinc/71/51/77/946715177.db2.gz ALGHEQUMYNVHFC-HNNXBMFYSA-N 0 0 373.434 3.708 20 5 FHBDRN CC[C@H](C[C@@H](C)CO)NC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000475218400 946718772 /nfs/dbraw/zinc/71/87/72/946718772.db2.gz WJMHYOSSIKJPIR-NXEZZACHSA-N 0 0 363.336 3.532 20 5 FHBDRN CSc1cccc(C(=O)Nc2nc3cc(F)ccc3n2C)c1[N+](=O)[O-] ZINC000186618477 946720123 /nfs/dbraw/zinc/72/01/23/946720123.db2.gz JGLFMJNRXMGGRX-UHFFFAOYSA-N 0 0 360.370 3.595 20 5 FHBDRN O=c1[nH]c(-c2cn(Cc3ccccc3)nn2)nc2cc3ccccc3cc21 ZINC000487500699 946729630 /nfs/dbraw/zinc/72/96/30/946729630.db2.gz JVKZNBMOIGXUGE-UHFFFAOYSA-N 0 0 353.385 3.795 20 5 FHBDRN CC(C)C[C@H]1CCCN(C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)C1 ZINC000151973640 946731915 /nfs/dbraw/zinc/73/19/15/946731915.db2.gz HNBYBNXGZGYPTJ-OAHLLOKOSA-N 0 0 356.426 3.679 20 5 FHBDRN O=C(NCCc1ccc(O)cc1)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000475218128 946740003 /nfs/dbraw/zinc/74/00/03/946740003.db2.gz YCRHPZGOMRNKKJ-UHFFFAOYSA-N 0 0 369.299 3.683 20 5 FHBDRN CC[C@@H](C)C(=O)Nc1cccc(CNC(=O)c2cccc([N+](=O)[O-])c2)c1 ZINC000049087306 946755008 /nfs/dbraw/zinc/75/50/08/946755008.db2.gz AAEUSSAUKDFWGB-CYBMUJFWSA-N 0 0 355.394 3.509 20 5 FHBDRN C[C@H](NC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)[C@@H]1CCCOC1 ZINC000475232588 946755623 /nfs/dbraw/zinc/75/56/23/946755623.db2.gz JVEYTUHYOORJPE-VHSXEESVSA-N 0 0 361.320 3.550 20 5 FHBDRN O=C(c1ncoc1-c1ccc(F)cc1)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000186636121 946766915 /nfs/dbraw/zinc/76/69/15/946766915.db2.gz DXHHJAOOAXEEOO-UHFFFAOYSA-N 0 0 367.336 3.982 20 5 FHBDRN COc1ccc(Cl)cc1CNC(=O)c1cc(SC)ccc1[N+](=O)[O-] ZINC000048486455 946769465 /nfs/dbraw/zinc/76/94/65/946769465.db2.gz DHUUMNZATATFMJ-UHFFFAOYSA-N 0 0 366.826 3.909 20 5 FHBDRN O=C(CCc1cc(F)ccc1[N+](=O)[O-])N1CCSC[C@@H]1c1ccccc1 ZINC001126152679 946774229 /nfs/dbraw/zinc/77/42/29/946774229.db2.gz HQYYWBMFBBDXRA-GOSISDBHSA-N 0 0 374.437 3.983 20 5 FHBDRN CCO[C@H](CCNc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1)C(C)C ZINC000074772249 946774946 /nfs/dbraw/zinc/77/49/46/946774946.db2.gz GAJXTQBUZLQAIP-GOSISDBHSA-N 0 0 363.458 3.694 20 5 FHBDRN Cc1cc(CCNC(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)cc(C)c1O ZINC000475589148 946781347 /nfs/dbraw/zinc/78/13/47/946781347.db2.gz YZCKGUKRPOUAQA-UHFFFAOYSA-N 0 0 357.410 3.898 20 5 FHBDRN C[C@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000475278423 946796799 /nfs/dbraw/zinc/79/67/99/946796799.db2.gz WARHBNODKHYXQT-NHYWBVRUSA-N 0 0 368.359 3.768 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)NCCOc2ccc(C(C)C)cc2)c1 ZINC000067549305 946814348 /nfs/dbraw/zinc/81/43/48/946814348.db2.gz PDFNQEXGPKQDDI-UHFFFAOYSA-N 0 0 358.394 3.536 20 5 FHBDRN Cc1c(Br)cc(C(=O)N2C[C@@H](C)S[C@H](C)C2)cc1[N+](=O)[O-] ZINC000125584488 946820739 /nfs/dbraw/zinc/82/07/39/946820739.db2.gz SKNUEVOFKRJHHH-RKDXNWHRSA-N 0 0 373.272 3.632 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)c2csc(N3CCCCC3)n2)cc1[N+](=O)[O-] ZINC001126614632 946824988 /nfs/dbraw/zinc/82/49/88/946824988.db2.gz BESYCSZEENPWAV-CYBMUJFWSA-N 0 0 374.466 3.841 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1)N1CCC[C@@H]1C[C@H](O)c1ccc(F)cc1 ZINC000162818375 946825129 /nfs/dbraw/zinc/82/51/29/946825129.db2.gz KFJQVRCMVMKSQO-AEFFLSMTSA-N 0 0 373.384 3.854 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)Nc2cccc(OCC(F)(F)F)c2)c1 ZINC000067547905 946826627 /nfs/dbraw/zinc/82/66/27/946826627.db2.gz ZHXOWPWKRLSLNH-UHFFFAOYSA-N 0 0 370.283 3.797 20 5 FHBDRN C/C=C/C[C@@H](CO)NC(=O)c1cc([N+](=O)[O-])ccc1SC1CCCC1 ZINC000613847713 946832084 /nfs/dbraw/zinc/83/20/84/946832084.db2.gz BLWSAVBJSXRYCX-IBUXWKBASA-N 0 0 364.467 3.686 20 5 FHBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)c1c[nH]nc1-c1cccc(Cl)c1 ZINC000536278189 946868081 /nfs/dbraw/zinc/86/80/81/946868081.db2.gz DVDGEYSRDGDXEF-UHFFFAOYSA-N 0 0 370.796 3.611 20 5 FHBDRN Cc1c(CS(=O)(=O)Cc2c(F)cccc2Cl)cccc1[N+](=O)[O-] ZINC000048717428 946897786 /nfs/dbraw/zinc/89/77/86/946897786.db2.gz HAKCOGOKHDWBHW-UHFFFAOYSA-N 0 0 357.790 3.811 20 5 FHBDRN Cc1cc(C)n(-c2ccc(Cn3cnc(-c4cccc([N+](=O)[O-])c4)n3)cc2)n1 ZINC000112521745 946905415 /nfs/dbraw/zinc/90/54/15/946905415.db2.gz XETFILAHWVFHBI-UHFFFAOYSA-N 0 0 374.404 3.704 20 5 FHBDRN COCCOc1cccc(CCC(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)c1 ZINC000475338154 946907910 /nfs/dbraw/zinc/90/79/10/946907910.db2.gz MRQLASSKMABPME-UHFFFAOYSA-N 0 0 372.421 3.808 20 5 FHBDRN COc1cccc([C@@H]2C[C@H](C)CN2C(=O)Cc2ccccc2[N+](=O)[O-])c1 ZINC000544323614 946909145 /nfs/dbraw/zinc/90/91/45/946909145.db2.gz XFZZUFMIYBPAMT-LIRRHRJNSA-N 0 0 354.406 3.756 20 5 FHBDRN O=C(NCc1cccc([N+](=O)[O-])c1)c1ccnc(OC2CCCCC2)c1 ZINC001126172989 946910218 /nfs/dbraw/zinc/91/02/18/946910218.db2.gz PVPDPVDAQQJDDH-UHFFFAOYSA-N 0 0 355.394 3.631 20 5 FHBDRN CCCOc1cc(OC)ccc1C(=O)N1c2ccc([N+](=O)[O-])cc2C[C@@H]1C ZINC000475341458 946911132 /nfs/dbraw/zinc/91/11/32/946911132.db2.gz GEXSZQFGILFNIU-ZDUSSCGKSA-N 0 0 370.405 3.984 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@H]1C[C@@H]1c1cccc(F)c1F ZINC000186324344 946912422 /nfs/dbraw/zinc/91/24/22/946912422.db2.gz NMLVPTHTLSMWKW-OLZOCXBDSA-N 0 0 366.751 3.946 20 5 FHBDRN COc1cccc(C2=CCN(C(=O)N[C@@H](C)c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000458885467 946916737 /nfs/dbraw/zinc/91/67/37/946916737.db2.gz GIUPWSOVDGSUIG-AWEZNQCLSA-N 0 0 367.405 3.773 20 5 FHBDRN C[C@H](c1ccccc1)[C@H](CO)NC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000112606936 946918022 /nfs/dbraw/zinc/91/80/22/946918022.db2.gz CKOCAPQCQOBJMF-BZNIZROVSA-N 0 0 363.801 3.534 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@H]1C[C@H]1c1ccc(F)c(F)c1 ZINC000186331554 946919146 /nfs/dbraw/zinc/91/91/46/946919146.db2.gz AFBYXNZHBFLSJP-STQMWFEESA-N 0 0 366.751 3.946 20 5 FHBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CC[C@@H](C)[C@H](C)C1 ZINC000550396384 946923612 /nfs/dbraw/zinc/92/36/12/946923612.db2.gz IAIZRRZRSKKPLW-NXEZZACHSA-N 0 0 355.232 3.784 20 5 FHBDRN O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)[C@H]1CC(=O)c2ccccc21 ZINC000475352491 946925774 /nfs/dbraw/zinc/92/57/74/946925774.db2.gz USSXPUJGACQZOU-LBPRGKRZSA-N 0 0 362.288 3.505 20 5 FHBDRN CC1(C)CC2(CC(Nc3ccc([N+](=O)[O-])c(C(=O)N4CCCC4)c3)C2)CO1 ZINC000897215858 946930874 /nfs/dbraw/zinc/93/08/74/946930874.db2.gz CKJCDJHMMUKLEX-UHFFFAOYSA-N 0 0 373.453 3.590 20 5 FHBDRN O=C(CCc1ccc(F)cc1F)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186332463 946935017 /nfs/dbraw/zinc/93/50/17/946935017.db2.gz LTJDQAXPWANGTH-UHFFFAOYSA-N 0 0 354.740 3.775 20 5 FHBDRN O=[N+]([O-])c1ccn(CCSc2nn(-c3ccccc3)c(=S)s2)n1 ZINC000178464208 946936978 /nfs/dbraw/zinc/93/69/78/946936978.db2.gz XVOAWCWOTOWYGF-UHFFFAOYSA-N 0 0 365.465 3.560 20 5 FHBDRN C[C@@H](CCCc1cccnc1)NC(=O)N[C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000458887506 946937862 /nfs/dbraw/zinc/93/78/62/946937862.db2.gz IZYZPKPNZYWIJY-GJZGRUSLSA-N 0 0 356.426 3.761 20 5 FHBDRN CC(C)N(CCc1nccs1)C(=O)N[C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000458890452 946942552 /nfs/dbraw/zinc/94/25/52/946942552.db2.gz PWFYNDJZMASKGF-ZDUSSCGKSA-N 0 0 362.455 3.775 20 5 FHBDRN C[C@H](NC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1)c1cccc2ccccc21 ZINC000048873604 946943784 /nfs/dbraw/zinc/94/37/84/946943784.db2.gz DLJJUFVBRGBIAH-ZDUSSCGKSA-N 0 0 363.373 3.564 20 5 FHBDRN Cc1ccc(NC(=O)C(=O)N(C)[C@@H](c2ccccc2)C(C)C)cc1[N+](=O)[O-] ZINC000112754804 946944613 /nfs/dbraw/zinc/94/46/13/946944613.db2.gz TYXKUDSTRBKAPJ-GOSISDBHSA-N 0 0 369.421 3.697 20 5 FHBDRN CCOc1ccc(NC(=O)COc2cccc(Cl)c2F)c([N+](=O)[O-])c1 ZINC000186710226 946949036 /nfs/dbraw/zinc/94/90/36/946949036.db2.gz LULRWSGPECVFAC-UHFFFAOYSA-N 0 0 368.748 3.804 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)N(C)Cc2c(F)cccc2F)c1 ZINC000511915113 946961250 /nfs/dbraw/zinc/96/12/50/946961250.db2.gz DPNHDVNVAFTOGB-UHFFFAOYSA-N 0 0 364.348 3.609 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)NCC(C)(C)c1ccc(F)cc1Cl ZINC000112841468 946973330 /nfs/dbraw/zinc/97/33/30/946973330.db2.gz HDAMBTABCUJBGQ-UHFFFAOYSA-N 0 0 365.792 3.798 20 5 FHBDRN CN(Cc1c(F)cccc1F)C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000511918188 946980969 /nfs/dbraw/zinc/98/09/69/946980969.db2.gz ZBBFMOFGZMUATL-UHFFFAOYSA-N 0 0 372.274 3.747 20 5 FHBDRN CCN(C[C@H]1CCOC1)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000613861841 946994441 /nfs/dbraw/zinc/99/44/41/946994441.db2.gz HTKVZBZNXXJPOZ-SNVBAGLBSA-N 0 0 361.320 3.504 20 5 FHBDRN COc1cccc(NC[C@@H](c2c(F)cccc2F)N(C)C)c1[N+](=O)[O-] ZINC000475385427 946995654 /nfs/dbraw/zinc/99/56/54/946995654.db2.gz AUIRVWKOGPIVDY-AWEZNQCLSA-N 0 0 351.353 3.596 20 5 FHBDRN CN(C(=O)CSc1ccccc1[N+](=O)[O-])[C@@H]1CCc2ccccc2C1 ZINC000511921255 946996481 /nfs/dbraw/zinc/99/64/81/946996481.db2.gz UUDPXQYUHIFHBI-MRXNPFEDSA-N 0 0 356.447 3.703 20 5 FHBDRN O=Cc1ccc(Oc2ncnc3ccc(Br)cc32)c([N+](=O)[O-])c1 ZINC000112963586 946998728 /nfs/dbraw/zinc/99/87/28/946998728.db2.gz FHAQVNMZXSBAEX-UHFFFAOYSA-N 0 0 374.150 3.905 20 5 FHBDRN CO[C@H]1CCOc2c(NC(=O)C(C)(C)c3ccccc3[N+](=O)[O-])cccc21 ZINC000509630181 947005845 /nfs/dbraw/zinc/00/58/45/947005845.db2.gz AXRLTIVDEMIYPI-KRWDZBQOSA-N 0 0 370.405 3.981 20 5 FHBDRN Cc1cccc(CN(CC(C)C)C(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)c1 ZINC000523223221 947006923 /nfs/dbraw/zinc/00/69/23/947006923.db2.gz RDVDFJRBHBXTQH-UHFFFAOYSA-N 0 0 358.442 3.520 20 5 FHBDRN C[C@H]1N(c2ccc(Br)cc2[N+](=O)[O-])CCC12CCOCC2 ZINC000408196714 947007088 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3.816 20 5 FHBDRN O=C(Nc1ccc(Oc2cccc(F)c2)cc1)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC000445171104 947568458 /nfs/dbraw/zinc/56/84/58/947568458.db2.gz FNWBTRHJDZQFLE-UHFFFAOYSA-N 0 0 369.308 3.879 20 5 FHBDRN C[C@@H](C(=O)Nc1ccccc1Cl)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088605318 947572386 /nfs/dbraw/zinc/57/23/86/947572386.db2.gz MNBJTVHWIGBCJP-LBPRGKRZSA-N 0 0 359.813 3.634 20 5 FHBDRN O=C(NCc1ccc(C(F)F)cc1)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000184553337 947573332 /nfs/dbraw/zinc/57/33/32/947573332.db2.gz PUJCDCHNYZMVRJ-UHFFFAOYSA-N 0 0 372.331 3.648 20 5 FHBDRN Cc1c2ccccc2oc1[C@H](C)NS(=O)(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000523757525 947574325 /nfs/dbraw/zinc/57/43/25/947574325.db2.gz NVXUGALIWAUIBF-ZDUSSCGKSA-N 0 0 374.418 3.997 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1)CN(Cc1coc(-c3ccc(F)cc3)n1)CC2 ZINC000088605673 947575640 /nfs/dbraw/zinc/57/56/40/947575640.db2.gz YBDTXQYJJXXVPS-UHFFFAOYSA-N 0 0 353.353 3.947 20 5 FHBDRN Cc1ccc(NC(=O)[C@H](C)N2CCc3ccc([N+](=O)[O-])cc3C2)c(C)c1 ZINC000088605936 947587542 /nfs/dbraw/zinc/58/75/42/947587542.db2.gz GLBVMZREYDTJEM-HNNXBMFYSA-N 0 0 353.422 3.597 20 5 FHBDRN COc1cc(N2C[C@]3(C[C@@H]4CC[C@H]3C4)OC(C)(C)C2)c(F)cc1[N+](=O)[O-] ZINC000440682771 947598242 /nfs/dbraw/zinc/59/82/42/947598242.db2.gz WPWZNOMSZIUPSF-NQCMUKECSA-N 0 0 364.417 3.917 20 5 FHBDRN O=C(O[C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)[C@@H]1Cc2ccccc2S1 ZINC000759934079 947600877 /nfs/dbraw/zinc/60/08/77/947600877.db2.gz UUNZVQGWTUXYAY-LZWOXQAQSA-N 0 0 373.434 3.535 20 5 FHBDRN CO[C@@H]1CCN(C(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000441462826 947611939 /nfs/dbraw/zinc/61/19/39/947611939.db2.gz CNXWJOAOUZITDX-RHSMWYFYSA-N 0 0 369.421 3.978 20 5 FHBDRN O=C(N[C@@H]1COc2ccc(F)cc21)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000445218522 947618654 /nfs/dbraw/zinc/61/86/54/947618654.db2.gz WAXRVIICHZRXGR-GOSISDBHSA-N 0 0 374.371 3.684 20 5 FHBDRN Cc1cc(CNC(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)ccc1-c1ccccc1 ZINC000445219549 947619546 /nfs/dbraw/zinc/61/95/46/947619546.db2.gz XUVGLYZBSYIDIF-UHFFFAOYSA-N 0 0 363.373 3.601 20 5 FHBDRN Cc1ccc(CCNC(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000523831965 947629087 /nfs/dbraw/zinc/62/90/87/947629087.db2.gz QISJFGGVXOMFAH-CYBMUJFWSA-N 0 0 362.813 3.683 20 5 FHBDRN CC(C)c1ccccc1OC[C@@H](O)CN1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088616536 947631511 /nfs/dbraw/zinc/63/15/11/947631511.db2.gz AOQCYHVZYVYCRG-IBGZPJMESA-N 0 0 370.449 3.516 20 5 FHBDRN O=C(Nc1cccc(-c2ncco2)c1)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000125757782 947676369 /nfs/dbraw/zinc/67/63/69/947676369.db2.gz LBIQWWRVBLHFRF-UHFFFAOYSA-N 0 0 364.361 3.840 20 5 FHBDRN COc1cccc(N2C[C@H](C(F)(F)F)[C@H](C(F)(F)F)C2)c1[N+](=O)[O-] ZINC000613884227 947701009 /nfs/dbraw/zinc/70/10/09/947701009.db2.gz SDIMFQVAAFIKEP-OCAPTIKFSA-N 0 0 358.238 3.780 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H]1[C@@H]2Cc3ccccc3[C@H]12 ZINC000248392403 947702963 /nfs/dbraw/zinc/70/29/63/947702963.db2.gz KPBHZRNGCRWQME-QAJUQPOASA-N 0 0 364.445 3.866 20 5 FHBDRN COCC[C@H](C)NC(=O)c1ccccc1Sc1ccccc1[N+](=O)[O-] ZINC000440718385 947706097 /nfs/dbraw/zinc/70/60/97/947706097.db2.gz RCGLGJPFICSFJY-ZDUSSCGKSA-N 0 0 360.435 3.901 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1F)N[C@@H]1COc2ccc(Cl)cc21 ZINC000544621982 947714823 /nfs/dbraw/zinc/71/48/23/947714823.db2.gz MQFVPEYDDAYGAB-CYBMUJFWSA-N 0 0 351.721 3.643 20 5 FHBDRN Cc1cccc(NC(=O)Cc2noc(/C=C/c3cccc([N+](=O)[O-])c3)n2)c1 ZINC000445328110 947715994 /nfs/dbraw/zinc/71/59/94/947715994.db2.gz NBVLLAUMZLYCPY-CMDGGOBGSA-N 0 0 364.361 3.638 20 5 FHBDRN C[C@H](NC(=O)N1Cc2ccccc2OC[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000543909088 947722751 /nfs/dbraw/zinc/72/27/51/947722751.db2.gz YMXZQQIRKXFAPB-KBPBESRZSA-N 0 0 355.394 3.649 20 5 FHBDRN CCc1ccc(NC(=O)Cc2noc(-c3cc([N+](=O)[O-])ccc3C)n2)cc1 ZINC000445321252 947725862 /nfs/dbraw/zinc/72/58/62/947725862.db2.gz UFHVYHYYMQXYRU-UHFFFAOYSA-N 0 0 366.377 3.697 20 5 FHBDRN C[C@@H](c1ccccc1)c1ccc(OC(=O)Cn2cc([N+](=O)[O-])cn2)cc1 ZINC000728850372 947737563 /nfs/dbraw/zinc/73/75/63/947737563.db2.gz OUXXWGHQUNRDGH-AWEZNQCLSA-N 0 0 351.362 3.549 20 5 FHBDRN Cc1cc(C)c(NC(=O)Cc2noc(-c3ccccc3[N+](=O)[O-])n2)c(C)c1 ZINC000445340463 947738309 /nfs/dbraw/zinc/73/83/09/947738309.db2.gz IIHJRZNJXBUDCF-UHFFFAOYSA-N 0 0 366.377 3.751 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])o1)N1CCC[C@H]1c1nc2cc(Cl)ccc2[nH]1 ZINC000440730346 947740234 /nfs/dbraw/zinc/74/02/34/947740234.db2.gz JFVPIVVCBWLJCT-LBPRGKRZSA-N 0 0 360.757 3.695 20 5 FHBDRN CCn1c2ccccc2nc1[C@H](C)NC(=O)Cc1cccc([N+](=O)[O-])c1C ZINC000121561274 947748486 /nfs/dbraw/zinc/74/84/86/947748486.db2.gz BSPIEJDDSKRXSW-AWEZNQCLSA-N 0 0 366.421 3.693 20 5 FHBDRN CN(CC1CCN(c2c(F)cccc2[N+](=O)[O-])CC1)C(=O)OC(C)(C)C ZINC000220659130 947758635 /nfs/dbraw/zinc/75/86/35/947758635.db2.gz YGLMGIAPTSAIIB-UHFFFAOYSA-N 0 0 367.421 3.817 20 5 FHBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(NC[C@H]2CCCc3ccccc32)s1 ZINC000129118185 947774844 /nfs/dbraw/zinc/77/48/44/947774844.db2.gz BYNNGIVLZDWJRR-GFCCVEGCSA-N 0 0 366.464 3.592 20 5 FHBDRN O=C(O[C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1)c1nccc2ccccc21 ZINC000759940335 947787023 /nfs/dbraw/zinc/78/70/23/947787023.db2.gz DXFBJAPNHRSQRO-CVEARBPZSA-N 0 0 366.377 3.680 20 5 FHBDRN CCNc1ccc(C(=O)N2CC[C@@H](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000125787751 947797247 /nfs/dbraw/zinc/79/72/47/947797247.db2.gz ZEBYMRMEPMTWQU-INIZCTEOSA-N 0 0 353.422 3.731 20 5 FHBDRN CS[C@@H]1CCCCN(C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000129510846 947823446 /nfs/dbraw/zinc/82/34/46/947823446.db2.gz VECGNORYUTWATO-UKRRQHHQSA-N 0 0 351.472 3.891 20 5 FHBDRN O=C(OCc1cc(F)ccc1F)c1cc([N+](=O)[O-])ccc1Br ZINC000725986193 947829243 /nfs/dbraw/zinc/82/92/43/947829243.db2.gz RTUDFANBADEIFF-UHFFFAOYSA-N 0 0 372.121 3.993 20 5 FHBDRN Cc1cccc(NC(=O)[C@H](C)OC(=O)c2ccc([N+](=O)[O-])cc2C)c1C ZINC000725987622 947831794 /nfs/dbraw/zinc/83/17/94/947831794.db2.gz KWBGZIUKPQLCSB-AWEZNQCLSA-N 0 0 356.378 3.704 20 5 FHBDRN Cc1ccc(S(=O)(=O)N(C)Cc2ccc(F)c(Cl)c2)c([N+](=O)[O-])c1 ZINC000432310437 947863197 /nfs/dbraw/zinc/86/31/97/947863197.db2.gz BEOSIRZCDLGDPN-UHFFFAOYSA-N 0 0 372.805 3.516 20 5 FHBDRN C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CC[C@H](CC(F)(F)F)C1 ZINC000278870518 947899220 /nfs/dbraw/zinc/89/92/20/947899220.db2.gz SOFUDTVCHFJJDT-WDEREUQCSA-N 0 0 370.331 3.980 20 5 FHBDRN CCc1nc([C@H](C)NC(=O)C2(c3ccc([N+](=O)[O-])cc3)CCC2)cs1 ZINC001126261325 947909610 /nfs/dbraw/zinc/90/96/10/947909610.db2.gz VBDPPCNLTJKZRF-LBPRGKRZSA-N 0 0 359.451 3.913 20 5 FHBDRN CCc1ccc(C(=O)Nc2cc(Cl)cc(C(=O)OC)c2)cc1[N+](=O)[O-] ZINC001126262827 947919923 /nfs/dbraw/zinc/91/99/23/947919923.db2.gz AUPKKVPLSTWPKT-UHFFFAOYSA-N 0 0 362.769 3.850 20 5 FHBDRN CO[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2SCC(C)C)[C@H](C)C1 ZINC000441486035 947968269 /nfs/dbraw/zinc/96/82/69/947968269.db2.gz MIMJSKCAQYZEJC-HIFRSBDPSA-N 0 0 366.483 3.982 20 5 FHBDRN CCC[C@H](NC(=O)c1[nH]ncc1[N+](=O)[O-])c1ccc(Cl)c(Cl)c1 ZINC000125840402 947969542 /nfs/dbraw/zinc/96/95/42/947969542.db2.gz CVQCVTVTJXTMHD-NSHDSACASA-N 0 0 357.197 3.896 20 5 FHBDRN O=C(NCc1cc([N+](=O)[O-])ccc1Cl)N[C@H](c1ccncc1)C1CC1 ZINC000893601955 948000680 /nfs/dbraw/zinc/00/06/80/948000680.db2.gz MENHFHXLTRBJQU-INIZCTEOSA-N 0 0 360.801 3.594 20 5 FHBDRN CC(C)[C@@H]1C[C@@H](CNC(=O)NC(C)(C)c2ccccc2[N+](=O)[O-])CCO1 ZINC000459063893 948010527 /nfs/dbraw/zinc/01/05/27/948010527.db2.gz NDTQLRQLBJCGNR-YOEHRIQHSA-N 0 0 363.458 3.580 20 5 FHBDRN Cc1oc(-c2cccs2)nc1CC(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000125860034 948014236 /nfs/dbraw/zinc/01/42/36/948014236.db2.gz YEBKMLKWYJHQHE-UHFFFAOYSA-N 0 0 371.418 3.521 20 5 FHBDRN Cc1cnc(CCN(C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)s1 ZINC000165652244 948031584 /nfs/dbraw/zinc/03/15/84/948031584.db2.gz OIKWUDZJLVVTRQ-UHFFFAOYSA-N 0 0 354.819 3.720 20 5 FHBDRN O=C(NCCNc1ccnc2c1cccc2[N+](=O)[O-])c1ccccc1Cl ZINC000432323505 948048002 /nfs/dbraw/zinc/04/80/02/948048002.db2.gz CJEULWPADGPFHN-UHFFFAOYSA-N 0 0 370.796 3.638 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCN([C@H](C)c2nccs2)CC1 ZINC000184644305 948061201 /nfs/dbraw/zinc/06/12/01/948061201.db2.gz MVWARZGECNHRNW-HUUCEWRRSA-N 0 0 360.483 3.800 20 5 FHBDRN CC(C)CCSCC(=O)O[C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000759945290 948080306 /nfs/dbraw/zinc/08/03/06/948080306.db2.gz UECVBEIQRILVMY-KGLIPLIRSA-N 0 0 355.460 3.598 20 5 FHBDRN O=C(c1ccsc1)N1CCCN(c2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000432329370 948084981 /nfs/dbraw/zinc/08/49/81/948084981.db2.gz OXPLZXPPMQKNRE-UHFFFAOYSA-N 0 0 365.842 3.662 20 5 FHBDRN C[C@]1(CCNC(=O)c2cc([N+](=O)[O-])ccc2Cl)CC1(Cl)Cl ZINC000839416306 948089294 /nfs/dbraw/zinc/08/92/94/948089294.db2.gz VOLLRURDSSTYFP-LBPRGKRZSA-N 0 0 351.617 3.952 20 5 FHBDRN COc1ccc(CN(C)c2ccnc3c2cccc3[N+](=O)[O-])c(OC)c1 ZINC000432331440 948110175 /nfs/dbraw/zinc/11/01/75/948110175.db2.gz MYTFSMPJRPIUAM-UHFFFAOYSA-N 0 0 353.378 3.797 20 5 FHBDRN O=[N+]([O-])c1cccc2c(N3CCO[C@@]4(CCc5ccccc54)C3)ccnc21 ZINC000432331241 948112746 /nfs/dbraw/zinc/11/27/46/948112746.db2.gz KPJJHCBJONNGGL-NRFANRHFSA-N 0 0 361.401 3.821 20 5 FHBDRN CCn1nccc1C1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2C)CC1 ZINC000278923952 948130209 /nfs/dbraw/zinc/13/02/09/948130209.db2.gz UIDVDFLCOMGOLQ-UHFFFAOYSA-N 0 0 357.414 3.531 20 5 FHBDRN COc1cccc([C@@H]2CN(c3ccnc4c3cccc4[N+](=O)[O-])CCO2)c1 ZINC000432339541 948155641 /nfs/dbraw/zinc/15/56/41/948155641.db2.gz SPOPCQXCHGSXLE-IBGZPJMESA-N 0 0 365.389 3.730 20 5 FHBDRN CCC(CC)C(=O)N1CCC(Nc2ccnc3c2cccc3[N+](=O)[O-])CC1 ZINC000432340304 948159863 /nfs/dbraw/zinc/15/98/63/948159863.db2.gz YAROQHUHFUVLDD-UHFFFAOYSA-N 0 0 370.453 3.982 20 5 FHBDRN O=[N+]([O-])c1cccc2c(N3CCN(c4ccc(F)cc4)CC3)ccnc21 ZINC000432339134 948162088 /nfs/dbraw/zinc/16/20/88/948162088.db2.gz ZGVRMJZDLROWLJ-UHFFFAOYSA-N 0 0 352.369 3.609 20 5 FHBDRN CCOc1ccc(SCC(=O)Nc2cc([N+](=O)[O-])ccc2OC)cc1 ZINC000019169469 948193900 /nfs/dbraw/zinc/19/39/00/948193900.db2.gz UJBHIYHUICZXDQ-UHFFFAOYSA-N 0 0 362.407 3.733 20 5 FHBDRN Cc1ccc(-n2cnnc2SC[C@@H](O)c2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000136842294 948207653 /nfs/dbraw/zinc/20/76/53/948207653.db2.gz QJOKMIGHMYZRLE-QGZVFWFLSA-N 0 0 370.434 3.618 20 5 FHBDRN CCO[C@@H]1C[C@@H](NC(=O)CCc2c(Cl)cccc2[N+](=O)[O-])C12CCC2 ZINC001126299013 948208387 /nfs/dbraw/zinc/20/83/87/948208387.db2.gz DXPQIOFVEJBAPJ-HZPDHXFCSA-N 0 0 366.845 3.645 20 5 FHBDRN Cc1cccc(C(=O)Nc2cnn(-c3ccccc3Cl)c2)c1[N+](=O)[O-] ZINC000106670990 948213416 /nfs/dbraw/zinc/21/34/16/948213416.db2.gz WJPSJNXGMDNBDG-UHFFFAOYSA-N 0 0 356.769 3.995 20 5 FHBDRN CC(C)(NC(=O)Nc1cccc2c1OCCC2)c1ccc([N+](=O)[O-])cc1 ZINC000467767592 948218519 /nfs/dbraw/zinc/21/85/19/948218519.db2.gz GWIKEXBIDUDMNZ-UHFFFAOYSA-N 0 0 355.394 3.977 20 5 FHBDRN Cn1cc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H]1Cc1c(F)cccc1Cl ZINC000520517219 948219433 /nfs/dbraw/zinc/21/94/33/948219433.db2.gz RHPFTKOEQCEVDE-LLVKDONJSA-N 0 0 365.792 3.573 20 5 FHBDRN CCCN(CCc1cccc(F)c1)C(=O)c1ccc([N+](=O)[O-])cc1OC ZINC000427591781 948227357 /nfs/dbraw/zinc/22/73/57/948227357.db2.gz ANBSRZNCQQZBQY-UHFFFAOYSA-N 0 0 360.385 3.837 20 5 FHBDRN COC[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)C1CC1 ZINC000441542017 948238355 /nfs/dbraw/zinc/23/83/55/948238355.db2.gz GWGLRDCGQIUOFN-QGZVFWFLSA-N 0 0 356.378 3.542 20 5 FHBDRN CN(C[C@@H]1OCCc2ccccc21)C(=O)C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000550420422 948248387 /nfs/dbraw/zinc/24/83/87/948248387.db2.gz SZRVMTJESFICSN-IBGZPJMESA-N 0 0 368.433 3.645 20 5 FHBDRN Cc1ccc(OCC(=O)O[C@@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)c(C)c1 ZINC000759953287 948253787 /nfs/dbraw/zinc/25/37/87/948253787.db2.gz XLRBTNCGMCEEBX-NVXWUHKLSA-N 0 0 373.409 3.514 20 5 FHBDRN Cc1nc(C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)sc1C ZINC000585750745 948256916 /nfs/dbraw/zinc/25/69/16/948256916.db2.gz NWUAGDCNEWGBIK-UHFFFAOYSA-N 0 0 356.201 3.683 20 5 FHBDRN COCc1cccc2sc(NC(=O)c3cc(OC)ccc3[N+](=O)[O-])nc21 ZINC000520541804 948257744 /nfs/dbraw/zinc/25/77/44/948257744.db2.gz NUTPHVIXYNUFAZ-UHFFFAOYSA-N 0 0 373.390 3.612 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1CCCc2c(Cl)ccc(F)c21 ZINC000427594758 948264400 /nfs/dbraw/zinc/26/44/00/948264400.db2.gz RKUFOHCOPDDXEN-UHFFFAOYSA-N 0 0 364.760 3.989 20 5 FHBDRN CC(C)Oc1ccc(CC[C@H](C)NC(=O)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000108588401 948282325 /nfs/dbraw/zinc/28/23/25/948282325.db2.gz JZWLJRLUWCZKNN-AWEZNQCLSA-N 0 0 371.437 3.715 20 5 FHBDRN O=C(O[C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1)c1cnc2ccsc2c1 ZINC000759956343 948282506 /nfs/dbraw/zinc/28/25/06/948282506.db2.gz YDRVCJOFYBUKIF-KGLIPLIRSA-N 0 0 372.406 3.742 20 5 FHBDRN COC[C@H](NC(=O)c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1)C1CC1 ZINC000441573994 948291676 /nfs/dbraw/zinc/29/16/76/948291676.db2.gz RNOWPVYEQVBHOH-SFHVURJKSA-N 0 0 372.446 3.901 20 5 FHBDRN COc1ccc(NC(=O)[C@@H]2C[C@H]2c2cc(F)c(F)c(F)c2)c([N+](=O)[O-])c1 ZINC000184727100 948300302 /nfs/dbraw/zinc/30/03/02/948300302.db2.gz AMWDOSFTSUUZKW-WDEREUQCSA-N 0 0 366.295 3.763 20 5 FHBDRN Cc1cc(Oc2ccc(Br)nc2[N+](=O)[O-])nc(C2CCC2)n1 ZINC000895083084 948304066 /nfs/dbraw/zinc/30/40/66/948304066.db2.gz SHQXWFHCDJELBA-UHFFFAOYSA-N 0 0 365.187 3.911 20 5 FHBDRN O=[N+]([O-])c1cccc([C@@H](O)CSc2nc(-c3ccc(F)cc3)c[nH]2)c1 ZINC000136854356 948315850 /nfs/dbraw/zinc/31/58/50/948315850.db2.gz GIRKYXDDEJYORH-INIZCTEOSA-N 0 0 359.382 3.950 20 5 FHBDRN CC(C)(C)c1ccc(NC(=O)N2CCOc3ncccc3C2)cc1[N+](=O)[O-] ZINC000585808461 948329243 /nfs/dbraw/zinc/32/92/43/948329243.db2.gz SZVNMBJVLRIRCP-UHFFFAOYSA-N 0 0 370.409 3.714 20 5 FHBDRN CC(C)(C)c1ccc(NC(=O)N(C[C@@H]2CCOC2)C2CC2)cc1[N+](=O)[O-] ZINC000585807987 948334338 /nfs/dbraw/zinc/33/43/38/948334338.db2.gz RHGGNIFNCOKMRO-ZDUSSCGKSA-N 0 0 361.442 3.925 20 5 FHBDRN COc1cc(OCC(=O)Nc2ccc(COC(C)C)cc2)ccc1[N+](=O)[O-] ZINC000520590932 948346917 /nfs/dbraw/zinc/34/69/17/948346917.db2.gz JZSBJONUPZSECB-UHFFFAOYSA-N 0 0 374.393 3.546 20 5 FHBDRN CCN(CC)C(=O)[C@H]1CCC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000512067101 948351057 /nfs/dbraw/zinc/35/10/57/948351057.db2.gz KOAYHMMKCYRLLJ-GOSISDBHSA-N 0 0 371.437 3.688 20 5 FHBDRN CCOC(CCNC(=O)c1cccc2c(=O)c3ccccc3[nH]c12)OCC ZINC000278975287 948352850 /nfs/dbraw/zinc/35/28/50/948352850.db2.gz CDMBZGMZCLLLFV-UHFFFAOYSA-N 0 0 368.433 3.613 20 5 FHBDRN CO[C@H]1CN(C(=O)c2cccc3c(=O)c4ccccc4[nH]c23)CC[C@@H]1C ZINC000278980494 948366498 /nfs/dbraw/zinc/36/64/98/948366498.db2.gz CTUIFRYJZIPCSF-UGSOOPFHSA-N 0 0 350.418 3.591 20 5 FHBDRN Cc1cc(OCC(=O)NCC2(c3cccc(Cl)c3)CC2)ccc1[N+](=O)[O-] ZINC001126310883 948371320 /nfs/dbraw/zinc/37/13/20/948371320.db2.gz YABSMPOLCMFNLE-UHFFFAOYSA-N 0 0 374.824 3.783 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)c2nc(C(F)(F)F)cs2)c1 ZINC000278990110 948376614 /nfs/dbraw/zinc/37/66/14/948376614.db2.gz RZUIVYKWJQBBNB-MRVPVSSYSA-N 0 0 359.329 3.870 20 5 FHBDRN O=[N+]([O-])c1ccc(S(=O)(=O)Nc2ccccc2Cl)c2ncccc12 ZINC000184764330 948386135 /nfs/dbraw/zinc/38/61/35/948386135.db2.gz KMMIAGBNYTYWNI-UHFFFAOYSA-N 0 0 363.782 3.597 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)N[C@@H]1CCCOc2ccccc21 ZINC000512096584 948409290 /nfs/dbraw/zinc/40/92/90/948409290.db2.gz ZEUNSUCOACLWLT-GOSISDBHSA-N 0 0 369.421 3.693 20 5 FHBDRN Cc1ccc(C)c(C(=O)OCC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000005583182 948436588 /nfs/dbraw/zinc/43/65/88/948436588.db2.gz OWDJHACOIIZACT-UHFFFAOYSA-N 0 0 362.769 3.661 20 5 FHBDRN CC[C@H](C)Oc1cccc(NC(=O)c2cc(C(=O)OC)cc([N+](=O)[O-])c2)c1 ZINC000512111652 948445989 /nfs/dbraw/zinc/44/59/89/948445989.db2.gz AEKHSLOLQGEZSH-LBPRGKRZSA-N 0 0 372.377 3.811 20 5 FHBDRN C[C@@H](c1ccccc1)N(C)S(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21 ZINC000184785643 948482563 /nfs/dbraw/zinc/48/25/63/948482563.db2.gz LBXAMMNPXMVHAG-ZDUSSCGKSA-N 0 0 371.418 3.525 20 5 FHBDRN CCC1(CO)CCN(C(=O)c2cc([N+](=O)[O-])ccc2SC(C)C)CC1 ZINC000182071973 948492827 /nfs/dbraw/zinc/49/28/27/948492827.db2.gz AKDQBXGBTGCOEW-UHFFFAOYSA-N 0 0 366.483 3.720 20 5 FHBDRN C[C@@H]1COCC[C@H]1NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000432474275 948527978 /nfs/dbraw/zinc/52/79/78/948527978.db2.gz BJECVQJRWREFKF-CXAGYDPISA-N 0 0 372.446 3.901 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)NCc1cccc(OC(F)F)c1 ZINC000050378713 948546833 /nfs/dbraw/zinc/54/68/33/948546833.db2.gz KCKYECHGLQHGBU-UHFFFAOYSA-N 0 0 368.361 3.605 20 5 FHBDRN CC[C@@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(Cl)s1 ZINC000512153124 948564094 /nfs/dbraw/zinc/56/40/94/948564094.db2.gz HOZNNOXIJXIMKF-LLVKDONJSA-N 0 0 360.844 3.739 20 5 FHBDRN CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)Nc2cccnc2F)CC1 ZINC000843692271 948593698 /nfs/dbraw/zinc/59/36/98/948593698.db2.gz RFBRAWUIRYWJCY-UHFFFAOYSA-N 0 0 358.373 3.618 20 5 FHBDRN O=[N+]([O-])c1ccc2cnn(CN3CCSC[C@@H]3c3ccccc3)c2c1 ZINC000738069852 948601602 /nfs/dbraw/zinc/60/16/02/948601602.db2.gz MXEIXUPMCJRKQM-GOSISDBHSA-N 0 0 354.435 3.692 20 5 FHBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NCc1cccc2cc[nH]c21 ZINC000467032602 948625671 /nfs/dbraw/zinc/62/56/71/948625671.db2.gz MTILWNZEQSMUDL-NSHDSACASA-N 0 0 373.796 3.813 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)N2CCOCC3(CCCC3)C2)cc1[N+](=O)[O-] ZINC000613961292 948633076 /nfs/dbraw/zinc/63/30/76/948633076.db2.gz ACWWPZAPWKKJGG-UHFFFAOYSA-N 0 0 360.454 3.925 20 5 FHBDRN Cc1ccsc1[C@H](CO)NC(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000536457407 948655712 /nfs/dbraw/zinc/65/57/12/948655712.db2.gz WGPUYTODYXSOJU-AWEZNQCLSA-N 0 0 362.451 3.726 20 5 FHBDRN Cn1nc([C@@H]2CCCO2)cc1NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000279238181 948656597 /nfs/dbraw/zinc/65/65/97/948656597.db2.gz ZUDUTPYENJVVDO-ZDUSSCGKSA-N 0 0 372.406 3.647 20 5 FHBDRN CC(C)c1[nH]nc(C(=O)Nc2c3c(cc4c2CCC4)CCC3)c1[N+](=O)[O-] ZINC000427626530 948662701 /nfs/dbraw/zinc/66/27/01/948662701.db2.gz QDSJIBOMQNUTLQ-UHFFFAOYSA-N 0 0 354.410 3.671 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)c1ccc(C(F)(F)F)nc1Cl ZINC000178546003 948667418 /nfs/dbraw/zinc/66/74/18/948667418.db2.gz ZLCGDACKGFIOPA-UHFFFAOYSA-N 0 0 359.691 3.592 20 5 FHBDRN C[C@H](C(=O)N1CCC[C@H]1CC(=O)c1ccco1)c1cccc([N+](=O)[O-])c1 ZINC000571716474 948671829 /nfs/dbraw/zinc/67/18/29/948671829.db2.gz QUANLDPDFOPKMU-ZFWWWQNUSA-N 0 0 356.378 3.555 20 5 FHBDRN CC(C)[C@@H](CNC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1)Nc1ccccc1 ZINC000571717033 948673757 /nfs/dbraw/zinc/67/37/57/948673757.db2.gz NNGRJGXFULCAKK-HNAYVOBHSA-N 0 0 355.438 3.951 20 5 FHBDRN CCc1nc(CN(C)Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)cs1 ZINC000728899540 948694432 /nfs/dbraw/zinc/69/44/32/948694432.db2.gz WJTDWDWTUWCUIP-UHFFFAOYSA-N 0 0 357.439 3.567 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H](C)c1cncc(F)c1 ZINC000459172862 948727394 /nfs/dbraw/zinc/72/73/94/948727394.db2.gz AEYVPRURXYJPBZ-ZDUSSCGKSA-N 0 0 360.389 3.810 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)COC(=O)c2c(C)cccc2[N+](=O)[O-])cc1C ZINC000026119016 948733903 /nfs/dbraw/zinc/73/39/03/948733903.db2.gz XGTAIEFUAURJLL-HNNXBMFYSA-N 0 0 370.405 3.554 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])Nc1ccc(N2CCCC2=O)c(Cl)c1 ZINC000021562291 948734832 /nfs/dbraw/zinc/73/48/32/948734832.db2.gz IUSLQZFZGWKFKX-UHFFFAOYSA-N 0 0 373.796 3.556 20 5 FHBDRN C[C@@H](NC(=O)NC(C)(C)c1ccccc1[N+](=O)[O-])c1nc2c(s1)CCC2 ZINC000459180126 948736547 /nfs/dbraw/zinc/73/65/47/948736547.db2.gz FJRJGIDULSRVJS-LLVKDONJSA-N 0 0 374.466 3.836 20 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356.382 3.613 20 5 FHBDRN COc1cc(OC)cc(C(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000452882032 567887917 /nfs/dbraw/zinc/88/79/17/567887917.db2.gz OXXYBXXMVCSJHD-OAHLLOKOSA-N 0 0 370.405 3.632 20 5 FHBDRN CCCN1CCN(C(=O)c2ccc([N+](=O)[O-])c(OC)c2)c2ccc(F)cc21 ZINC000481402659 567891827 /nfs/dbraw/zinc/89/18/27/567891827.db2.gz OFHZESSETASSPZ-UHFFFAOYSA-N 0 0 373.384 3.619 20 5 FHBDRN COC(=O)c1ccc(NCc2csc(-c3cccc([N+](=O)[O-])c3)n2)cn1 ZINC000541821853 567903646 /nfs/dbraw/zinc/90/36/46/567903646.db2.gz VVZSDIIKSQGVGN-UHFFFAOYSA-N 0 0 370.390 3.512 20 5 FHBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)N[C@@H](C1CCCC1)C(F)(F)F ZINC000481403294 567903941 /nfs/dbraw/zinc/90/39/41/567903941.db2.gz OWIOVMRCZDJJCX-AWEZNQCLSA-N 0 0 359.348 3.558 20 5 FHBDRN O=[N+]([O-])c1ccc(SC[C@@H](O)CO[C@@H]2CCCc3ccccc32)nc1 ZINC000159187541 567907281 /nfs/dbraw/zinc/90/72/81/567907281.db2.gz ZYIXJZABAWCNMO-DOTOQJQBSA-N 0 0 360.435 3.537 20 5 FHBDRN CC(C)[C@@H]1C[C@@H](CNC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CCO1 ZINC000452891676 567909777 /nfs/dbraw/zinc/90/97/77/567909777.db2.gz OOOLWEYNMMHXEY-WFASDCNBSA-N 0 0 362.451 3.991 20 5 FHBDRN CC(C)[C@H]1C[C@H](CNC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)CCO1 ZINC000452898204 567911977 /nfs/dbraw/zinc/91/19/77/567911977.db2.gz SBSLMRFIHMNQCR-JJRVBVJISA-N 0 0 366.483 3.643 20 5 FHBDRN C[C@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1)c1nccn1-c1ccccc1 ZINC000481429361 567928439 /nfs/dbraw/zinc/92/84/39/567928439.db2.gz WMYRISBZDDRSPF-ZDUSSCGKSA-N 0 0 351.366 3.663 20 5 FHBDRN COc1cc(S(=O)(=O)N(c2ccc(C)cc2)C(C)C)ccc1[N+](=O)[O-] ZINC000150812581 567929122 /nfs/dbraw/zinc/92/91/22/567929122.db2.gz HTVAWZHFESNJDA-UHFFFAOYSA-N 0 0 364.423 3.516 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)Nc2nc3cc(Cl)ccn3n2)cc1[N+](=O)[O-] ZINC000464652100 567935752 /nfs/dbraw/zinc/93/57/52/567935752.db2.gz XNAWPZKQMRNNMF-UHFFFAOYSA-N 0 0 373.800 3.841 20 5 FHBDRN O=[N+]([O-])c1ccc(SC[C@@H](O)COc2ccc3ccccc3c2)nc1 ZINC000159191165 567945876 /nfs/dbraw/zinc/94/58/76/567945876.db2.gz NTBRNLBAXYEQES-INIZCTEOSA-N 0 0 356.403 3.675 20 5 FHBDRN Cn1ncc2c1CCC[C@@H]2NCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000264975832 567946250 /nfs/dbraw/zinc/94/62/50/567946250.db2.gz RZAOBWLJLBJODV-INIZCTEOSA-N 0 0 369.450 3.619 20 5 FHBDRN Cc1ccc(C)c(OC[C@@H](O)Cn2ccnc2-c2ccc([N+](=O)[O-])cc2)c1 ZINC000051451958 567961271 /nfs/dbraw/zinc/96/12/71/567961271.db2.gz DKIWGZCUJPZYPK-SFHVURJKSA-N 0 0 367.405 3.515 20 5 FHBDRN Cc1c(CNC(=O)c2cnn(-c3cccc(Cl)c3)c2)cccc1[N+](=O)[O-] ZINC000481464057 567966470 /nfs/dbraw/zinc/96/64/70/567966470.db2.gz HJODQTWEVATMFC-UHFFFAOYSA-N 0 0 370.796 3.672 20 5 FHBDRN Cc1c(CNC(=O)c2cc(-c3ccc(F)cc3)on2)cccc1[N+](=O)[O-] ZINC000481469731 567967780 /nfs/dbraw/zinc/96/77/80/567967780.db2.gz ZKBJFWMDSKVVKA-UHFFFAOYSA-N 0 0 355.325 3.627 20 5 FHBDRN CSc1nc(C2CC2)nc(C)c1C(=O)NCc1cccc([N+](=O)[O-])c1C ZINC000481483037 567977690 /nfs/dbraw/zinc/97/76/90/567977690.db2.gz YFDZFSMGJDIFFW-UHFFFAOYSA-N 0 0 372.450 3.531 20 5 FHBDRN C/C=C\c1ccc(OCC(=O)NCc2cccc([N+](=O)[O-])c2C)c(OC)c1 ZINC000481476134 567978739 /nfs/dbraw/zinc/97/87/39/567978739.db2.gz IWMTVWIWVLVVOH-XQRVVYSFSA-N 0 0 370.405 3.640 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1C[C@H](C)O[C@@H]1C ZINC000412649791 567980346 /nfs/dbraw/zinc/98/03/46/567980346.db2.gz JWIZZJWMVRFJGA-XQQFMLRXSA-N 0 0 352.456 3.640 20 5 FHBDRN Cc1c(CNC(=O)COc2cc(Cl)ccc2Cl)cccc1[N+](=O)[O-] ZINC000481477258 567980909 /nfs/dbraw/zinc/98/09/09/567980909.db2.gz GRTNOQZKBASIEL-UHFFFAOYSA-N 0 0 369.204 3.905 20 5 FHBDRN CN(Cc1nccn1C(F)F)Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602443797 567980978 /nfs/dbraw/zinc/98/09/78/567980978.db2.gz VXOXMKADADHWJB-UHFFFAOYSA-N 0 0 364.274 3.837 20 5 FHBDRN CCCCOc1ccc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000518087897 567984944 /nfs/dbraw/zinc/98/49/44/567984944.db2.gz BAMWAZHBXNPBHK-UHFFFAOYSA-N 0 0 364.423 3.883 20 5 FHBDRN CN(CCc1nccs1)Cc1cc(Br)c([N+](=O)[O-])s1 ZINC000602484589 567985199 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FHBDRN CN(C)c1ccccc1CN(C)C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000568319901 568024046 /nfs/dbraw/zinc/02/40/46/568024046.db2.gz ZAFFDPRATCDFCH-UHFFFAOYSA-N 0 0 368.437 3.507 20 5 FHBDRN Cc1sc(C(=O)N[C@H]2CCO[C@@H]2c2ccc(F)c(F)c2)cc1[N+](=O)[O-] ZINC000181863527 568029309 /nfs/dbraw/zinc/02/93/09/568029309.db2.gz JGYMCVZOTDUUBC-SWLSCSKDSA-N 0 0 368.361 3.503 20 5 FHBDRN Cc1ccnc(OC2CCN(c3ccc([N+](=O)[O-])c(OC(C)C)n3)CC2)c1 ZINC000568415132 568032085 /nfs/dbraw/zinc/03/20/85/568032085.db2.gz IEGZBZLWIUQXAC-UHFFFAOYSA-N 0 0 372.425 3.528 20 5 FHBDRN COc1ccccc1[C@@H]1CCN(C(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000150820246 568032228 /nfs/dbraw/zinc/03/22/28/568032228.db2.gz OYKQPXVDPAZEEA-GFCCVEGCSA-N 0 0 360.797 3.887 20 5 FHBDRN CCOC(=O)c1cccc(NC(=O)CSc2ccc([N+](=O)[O-])cc2)c1 ZINC000008097636 568033913 /nfs/dbraw/zinc/03/39/13/568033913.db2.gz PYDMFGXAZPHMAY-UHFFFAOYSA-N 0 0 360.391 3.502 20 5 FHBDRN COc1ccc(NC(=O)NCc2cc(-c3ccccc3)on2)cc1[N+](=O)[O-] ZINC000568434162 568037816 /nfs/dbraw/zinc/03/78/16/568037816.db2.gz PBQRBLFNZJKFAG-UHFFFAOYSA-N 0 0 368.349 3.580 20 5 FHBDRN O=[N+]([O-])c1cc2c(nc1N1CC[C@@H](n3ncc4ccccc43)C1)CCCC2 ZINC000568505495 568042889 /nfs/dbraw/zinc/04/28/89/568042889.db2.gz ZZZSHYKPDXSKSG-MRXNPFEDSA-N 0 0 363.421 3.670 20 5 FHBDRN C[C@@H]1CSC[C@@H]1NC(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000568493983 568044615 /nfs/dbraw/zinc/04/46/15/568044615.db2.gz GVLNMAHWKJBNBE-DYVFJYSZSA-N 0 0 372.446 3.655 20 5 FHBDRN C[C@H]1CSC[C@H]1NC(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000568493985 568044649 /nfs/dbraw/zinc/04/46/49/568044649.db2.gz GVLNMAHWKJBNBE-SUMWQHHRSA-N 0 0 372.446 3.655 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1OC(F)F)N1CC(C2CCCCC2)C1 ZINC000568552469 568050476 /nfs/dbraw/zinc/05/04/76/568050476.db2.gz YECKPYUZWKWYBG-UHFFFAOYSA-N 0 0 354.353 3.849 20 5 FHBDRN C[C@@H](C(=O)NC[C@H](C)Oc1ccc(Cl)cc1)c1cccc([N+](=O)[O-])c1 ZINC000568579514 568059156 /nfs/dbraw/zinc/05/91/56/568059156.db2.gz OXJQZGGORFAIHH-QWHCGFSZSA-N 0 0 362.813 3.935 20 5 FHBDRN COc1cc(C(=O)NCCCO[C@@H](C)c2ccccc2)ccc1[N+](=O)[O-] ZINC000159243645 568064383 /nfs/dbraw/zinc/06/43/83/568064383.db2.gz QLSXCJALCCIHQE-AWEZNQCLSA-N 0 0 358.394 3.501 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)Nc2cccc(-c3nnco3)c2)c1 ZINC000024738379 568066609 /nfs/dbraw/zinc/06/66/09/568066609.db2.gz DFDYLNZMOVRYCF-UHFFFAOYSA-N 0 0 356.363 3.619 20 5 FHBDRN COc1ccc(NC(=O)Cc2nc(-c3ccccc3)oc2C)c([N+](=O)[O-])c1 ZINC000120375957 568067032 /nfs/dbraw/zinc/06/70/32/568067032.db2.gz CQTKCUWEFYVMIE-UHFFFAOYSA-N 0 0 367.361 3.748 20 5 FHBDRN COc1cccc(NC(=O)COc2ccc([N+](=O)[O-])cc2C(F)(F)F)c1 ZINC000067650050 568080176 /nfs/dbraw/zinc/08/01/76/568080176.db2.gz APIQDUWSFXCKAA-UHFFFAOYSA-N 0 0 370.283 3.640 20 5 FHBDRN O=C(NCc1ccc(C2CC2)cc1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000481664946 568083770 /nfs/dbraw/zinc/08/37/70/568083770.db2.gz QANKBCIFVWLZCY-UHFFFAOYSA-N 0 0 362.389 3.588 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(N2CCN([C@H](C)c3ccccc3Cl)CC2)n1 ZINC000481677041 568085867 /nfs/dbraw/zinc/08/58/67/568085867.db2.gz KBCAWMPJEIBJLA-CQSZACIVSA-N 0 0 360.845 3.835 20 5 FHBDRN COc1ccc(C)cc1C1(CNc2nc(C)ccc2[N+](=O)[O-])CCOCC1 ZINC000481694964 568092165 /nfs/dbraw/zinc/09/21/65/568092165.db2.gz LYZDAOJGYMBSOC-UHFFFAOYSA-N 0 0 371.437 3.776 20 5 FHBDRN Cc1cc(=O)n(CC/C=C/c2ccc(Br)cc2)cc1[N+](=O)[O-] ZINC000128624605 568092696 /nfs/dbraw/zinc/09/26/96/568092696.db2.gz ZKUABVMDBZAEQM-DUXPYHPUSA-N 0 0 363.211 3.931 20 5 FHBDRN O=C(N[C@@H]1CCC[C@@H]2OCC[C@@H]21)c1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000291284537 568096267 /nfs/dbraw/zinc/09/62/67/568096267.db2.gz GJXZIJNJJMHMGE-WQAKAFBOSA-N 0 0 359.209 3.589 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)N2CCCC3(CCOCC3)C2)cc1[N+](=O)[O-] ZINC000408231729 568101629 /nfs/dbraw/zinc/10/16/29/568101629.db2.gz OYWMQDNGHKZGKZ-UHFFFAOYSA-N 0 0 360.454 3.925 20 5 FHBDRN CCCO[C@@H]1CCCN(c2nnc(-c3cccc([N+](=O)[O-])c3)n2CC)CC1 ZINC000291314101 568102674 /nfs/dbraw/zinc/10/26/74/568102674.db2.gz PXPDTUZLBHGSIH-QGZVFWFLSA-N 0 0 373.457 3.659 20 5 FHBDRN Cc1cc(O)c(C(C)C)cc1C(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000436626109 568104136 /nfs/dbraw/zinc/10/41/36/568104136.db2.gz HDEFUZRBWFKPOJ-UHFFFAOYSA-N 0 0 354.366 3.861 20 5 FHBDRN Cn1nc([N+](=O)[O-])cc1C(=O)Nc1ccc2[nH]c(C3CCCCC3)nc2c1 ZINC000481822153 568134707 /nfs/dbraw/zinc/13/47/07/568134707.db2.gz VAOIOQLNTQRXGP-UHFFFAOYSA-N 0 0 368.397 3.505 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(OC2CCOCC2)cc1 ZINC000291404373 568136188 /nfs/dbraw/zinc/13/61/88/568136188.db2.gz IFRYDNINNRCCOL-UHFFFAOYSA-N 0 0 370.405 3.967 20 5 FHBDRN Cc1ccc(OCCCC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)c(C)c1 ZINC000481874729 568140575 /nfs/dbraw/zinc/14/05/75/568140575.db2.gz ZOEVEHRFQCRRHD-UHFFFAOYSA-N 0 0 368.433 3.956 20 5 FHBDRN CC[C@H]1CCCCN1C(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000603726675 568143422 /nfs/dbraw/zinc/14/34/22/568143422.db2.gz QQAJMUCXAPQQNK-NSHDSACASA-N 0 0 360.332 3.941 20 5 FHBDRN COc1cc(C(=O)Nc2ccc(OCC3CC3)cc2)c([N+](=O)[O-])cc1OC ZINC000265021594 568152390 /nfs/dbraw/zinc/15/23/90/568152390.db2.gz MIBRMPZEXAODDF-UHFFFAOYSA-N 0 0 372.377 3.653 20 5 FHBDRN O=C(c1ccccc1[N+](=O)[O-])N1CCc2c(Br)cccc2C1 ZINC000128677857 568153395 /nfs/dbraw/zinc/15/33/95/568153395.db2.gz WERMVYAUXKMORH-UHFFFAOYSA-N 0 0 361.195 3.556 20 5 FHBDRN CO[C@H]1CCN(c2nnc(-c3ccc([N+](=O)[O-])cc3)n2CC(C)C)[C@H](C)C1 ZINC000291449819 568163537 /nfs/dbraw/zinc/16/35/37/568163537.db2.gz FNNJQPFLIMXKLV-PBHICJAKSA-N 0 0 373.457 3.513 20 5 FHBDRN COC(=O)c1cc(OCc2cccc(C(F)(F)F)c2)ccc1[N+](=O)[O-] ZINC000481902412 568166502 /nfs/dbraw/zinc/16/65/02/568166502.db2.gz WKSYBLBOXPRYDX-UHFFFAOYSA-N 0 0 355.268 3.979 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)Nc1ccc(OC(F)F)cc1 ZINC000481959673 568196945 /nfs/dbraw/zinc/19/69/45/568196945.db2.gz BGEKNFGYXNLWKX-UHFFFAOYSA-N 0 0 372.349 3.614 20 5 FHBDRN CC(C)n1cc2c(n1)C[C@@H](Nc1ccc([N+](=O)[O-])c3cccnc13)CC2 ZINC000481967693 568201622 /nfs/dbraw/zinc/20/16/22/568201622.db2.gz RWKPMXJSZJLWOU-AWEZNQCLSA-N 0 0 351.410 3.890 20 5 FHBDRN CCOc1ccc(NS(=O)(=O)c2c(C)cc([N+](=O)[O-])cc2C)cc1F ZINC000481972794 568202882 /nfs/dbraw/zinc/20/28/82/568202882.db2.gz NXQVEUDVKAHFPW-UHFFFAOYSA-N 0 0 368.386 3.550 20 5 FHBDRN COC(=O)c1c(C)cccc1NC(=O)c1cc(SC)ccc1[N+](=O)[O-] ZINC000024874222 568208222 /nfs/dbraw/zinc/20/82/22/568208222.db2.gz YSIPOSSDRUPYMD-UHFFFAOYSA-N 0 0 360.391 3.664 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(N[C@@H]2CCN(c3ccccc3OC(F)F)C2)n1 ZINC000481983442 568215410 /nfs/dbraw/zinc/21/54/10/568215410.db2.gz SYNOEUYBHSOIOP-GFCCVEGCSA-N 0 0 364.352 3.590 20 5 FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(C(C)=O)cc1 ZINC000481993113 568216070 /nfs/dbraw/zinc/21/60/70/568216070.db2.gz RCRNRSBUBOVSDZ-UHFFFAOYSA-N 0 0 374.418 3.788 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(NCc2nc3cc(Br)cnc3[nH]2)c1 ZINC000481993164 568216075 /nfs/dbraw/zinc/21/60/75/568216075.db2.gz SLVVZURPIOXUAN-UHFFFAOYSA-N 0 0 362.187 3.549 20 5 FHBDRN Cc1ccc(NC(=O)C(=O)N(CCC(C)C)CCC(C)C)cc1[N+](=O)[O-] ZINC000604151823 568217283 /nfs/dbraw/zinc/21/72/83/568217283.db2.gz NWURYSRICOIBRL-UHFFFAOYSA-N 0 0 363.458 3.763 20 5 FHBDRN Cc1ccc(-c2n[nH]cc2CN2CCOc3ccc([N+](=O)[O-])cc3C2)cc1 ZINC000568821132 568228659 /nfs/dbraw/zinc/22/86/59/568228659.db2.gz ZGTNVQPNFKVLKI-UHFFFAOYSA-N 0 0 364.405 3.688 20 5 FHBDRN CCOc1cc(NC(=O)NC(C2CC2)C2CC2)c([N+](=O)[O-])cc1OCC ZINC000043838626 568230664 /nfs/dbraw/zinc/23/06/64/568230664.db2.gz NTTSIYDTOZTWHN-UHFFFAOYSA-N 0 0 363.414 3.702 20 5 FHBDRN CCOc1cc(NC(=O)NCc2ccccc2)c([N+](=O)[O-])cc1OCC ZINC000043839012 568230728 /nfs/dbraw/zinc/23/07/28/568230728.db2.gz IVRIERKAGCEUSN-UHFFFAOYSA-N 0 0 359.382 3.714 20 5 FHBDRN COc1cc(C(=O)N(c2ccccc2OC)C(C)C)c([N+](=O)[O-])cc1OC ZINC000291644196 568240272 /nfs/dbraw/zinc/24/02/72/568240272.db2.gz LGWVSWHRAGLAAF-UHFFFAOYSA-N 0 0 374.393 3.676 20 5 FHBDRN CC(C)N(Cc1ccccc1F)C(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000568909316 568251878 /nfs/dbraw/zinc/25/18/78/568251878.db2.gz ZZFVDNSZBCXOAK-UHFFFAOYSA-N 0 0 366.339 3.992 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1[O-])N1CC[C@@](F)(c2cccc(Cl)c2)C1 ZINC000436661288 568253668 /nfs/dbraw/zinc/25/36/68/568253668.db2.gz CORCQMQUSZEXFQ-KRWDZBQOSA-N 0 0 364.760 3.665 20 5 FHBDRN Cc1cc(NC[C@H]2CCN(CC(F)(F)F)C2)c2cccc([N+](=O)[O-])c2n1 ZINC000302031109 568253739 /nfs/dbraw/zinc/25/37/39/568253739.db2.gz SBTLOXUBSXRTJK-GFCCVEGCSA-N 0 0 368.359 3.748 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(N[C@@H](CO)c2ccc(Br)cc2)n1 ZINC000541935739 568257355 /nfs/dbraw/zinc/25/73/55/568257355.db2.gz FIQDZQQGEBQZTH-ZDUSSCGKSA-N 0 0 366.215 3.515 20 5 FHBDRN C[C@@H](C(=O)NCCNc1ccc([N+](=O)[O-])cc1)c1cc2ccccc2o1 ZINC000482087644 568257967 /nfs/dbraw/zinc/25/79/67/568257967.db2.gz GAQZYYUVNYLFIA-CYBMUJFWSA-N 0 0 353.378 3.673 20 5 FHBDRN CCC(CC)[C@H]1C[C@@H](NC(=O)N(C)Cc2ccccc2[N+](=O)[O-])CCO1 ZINC000181959961 568260864 /nfs/dbraw/zinc/26/08/64/568260864.db2.gz LGBOKBOSLPTKEI-FUHWJXTLSA-N 0 0 363.458 3.720 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N[C@@H]1c2ccc(F)cc2O[C@H]1C ZINC000482131600 568269922 /nfs/dbraw/zinc/26/99/22/568269922.db2.gz PAWLVPFXZDNKCD-GTNSWQLSSA-N 0 0 359.357 3.994 20 5 FHBDRN CC[C@H](NC(=O)CCn1nc(C)c([N+](=O)[O-])c1C)C(C)(C)c1ccccc1 ZINC000120393367 568275039 /nfs/dbraw/zinc/27/50/39/568275039.db2.gz ZTGBZRXCIUWCOP-KRWDZBQOSA-N 0 0 372.469 3.671 20 5 FHBDRN O=C(Nc1cc(Cl)ccc1O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000541958418 568284131 /nfs/dbraw/zinc/28/41/31/568284131.db2.gz WEPAVZYOPDSKRW-UHFFFAOYSA-N 0 0 358.684 3.808 20 5 FHBDRN Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)NCc1cc([O-])ccc1[N+](=O)[O-] ZINC000569128259 568285418 /nfs/dbraw/zinc/28/54/18/568285418.db2.gz HSPWLPGELKPJRW-SECBINFHSA-N 0 0 372.347 3.527 20 5 FHBDRN CNc1c(C(=O)Nc2nc(-c3ccccc3F)co2)cccc1[N+](=O)[O-] ZINC000482151536 568285789 /nfs/dbraw/zinc/28/57/89/568285789.db2.gz ZPHXHPPKNIZHQK-UHFFFAOYSA-N 0 0 356.313 3.683 20 5 FHBDRN O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCCC[C@@H]1c1cc[nH]n1 ZINC000569133371 568286048 /nfs/dbraw/zinc/28/60/48/568286048.db2.gz OWUYJEYZNAZAJH-CQSZACIVSA-N 0 0 356.407 3.900 20 5 FHBDRN CCN(C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)[C@@H]1CCOC(C)(C)C1 ZINC000291736549 568286680 /nfs/dbraw/zinc/28/66/80/568286680.db2.gz XHRGNDVCZHQLQO-OAHLLOKOSA-N 0 0 361.442 3.589 20 5 FHBDRN C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)N[C@@H]3CCC[C@@H]3F)cc2[N+](=O)[O-])C1 ZINC000569145226 568293240 /nfs/dbraw/zinc/29/32/40/568293240.db2.gz ICMXDZJDAQVHOW-LUYZLQTOSA-N 0 0 363.433 3.698 20 5 FHBDRN C[C@H](NC(=O)NC(C)(C)c1ccccc1[N+](=O)[O-])c1nc2ccccc2[nH]1 ZINC000291744024 568293955 /nfs/dbraw/zinc/29/39/55/568293955.db2.gz SMCZJKLVXGMMPP-LBPRGKRZSA-N 0 0 367.409 3.767 20 5 FHBDRN C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1c[nH]c2cccc([N+](=O)[O-])c21 ZINC000482171653 568300372 /nfs/dbraw/zinc/30/03/72/568300372.db2.gz BEOJYTJURCZTLS-MWLCHTKSSA-N 0 0 355.316 3.879 20 5 FHBDRN COCc1cc(NCCc2ccc([N+](=O)[O-])cc2)c2cc(F)ccc2n1 ZINC000569162577 568301034 /nfs/dbraw/zinc/30/10/34/568301034.db2.gz OQPFVYVKYNNQBX-UHFFFAOYSA-N 0 0 355.369 3.505 20 5 FHBDRN C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000482177642 568301872 /nfs/dbraw/zinc/30/18/72/568301872.db2.gz KDIQNTHESFWJIT-GWCFXTLKSA-N 0 0 371.359 3.972 20 5 FHBDRN Cc1ccc(Sc2ccc(C(=O)NC(C)(C)[C@H](C)O)cc2[N+](=O)[O-])cc1 ZINC000541993593 568302558 /nfs/dbraw/zinc/30/25/58/568302558.db2.gz LWJUCGXFYVXBFO-ZDUSSCGKSA-N 0 0 374.462 3.944 20 5 FHBDRN O=C(c1ccc(Br)cc1F)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000029889718 568309187 /nfs/dbraw/zinc/30/91/87/568309187.db2.gz LBOYQIYOAOIDLF-UHFFFAOYSA-N 0 0 365.158 3.699 20 5 FHBDRN O=C(NC[C@H]1CCCC[C@H]1C(F)(F)F)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000482193697 568310692 /nfs/dbraw/zinc/31/06/92/568310692.db2.gz PNJDEVRNJVDFJD-BXKDBHETSA-N 0 0 370.331 3.570 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H]2CCCC[C@H]2C(F)(F)F)c1 ZINC000482210696 568312805 /nfs/dbraw/zinc/31/28/05/568312805.db2.gz NHXXMSDGFZFIKV-GXFFZTMASA-N 0 0 360.332 3.702 20 5 FHBDRN Cc1c(-c2ccc(Cl)cc2)nnn1CCOc1cccc([N+](=O)[O-])c1 ZINC000569265857 568322501 /nfs/dbraw/zinc/32/25/01/568322501.db2.gz JFKGHHONXZKVGM-UHFFFAOYSA-N 0 0 358.785 3.894 20 5 FHBDRN Cc1cc(NC(=O)CC2(C(F)(F)F)CC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000569269157 568323824 /nfs/dbraw/zinc/32/38/24/568323824.db2.gz QSSZWLFACUJHNK-UHFFFAOYSA-N 0 0 353.300 3.544 20 5 FHBDRN Cc1ccc(F)c2c1CCCN2C(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000569285230 568333283 /nfs/dbraw/zinc/33/32/83/568333283.db2.gz DMBBXUOMVBFRJR-UHFFFAOYSA-N 0 0 364.323 3.842 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)Nc1cc(F)c(Br)c(F)c1 ZINC000181983662 568337636 /nfs/dbraw/zinc/33/76/36/568337636.db2.gz PJJHUDONDVBRKW-UHFFFAOYSA-N 0 0 372.125 3.591 20 5 FHBDRN Cn1c(-c2ccc([N+](=O)[O-])cc2)nnc1N1CCC(CC(F)(F)F)CC1 ZINC000569292416 568338683 /nfs/dbraw/zinc/33/86/83/568338683.db2.gz NAMGLHMJSUMDIY-UHFFFAOYSA-N 0 0 369.347 3.559 20 5 FHBDRN CC1CCC(N(C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)C2CC2)CC1 ZINC000045415435 568366342 /nfs/dbraw/zinc/36/63/42/568366342.db2.gz WTDPXTNZKXVMAX-UHFFFAOYSA-N 0 0 368.437 3.964 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CNc1cnn(CC(C)C)c1C(C)C ZINC000569313092 568367828 /nfs/dbraw/zinc/36/78/28/568367828.db2.gz PEKHASNUPMIRJB-UHFFFAOYSA-N 0 0 373.457 3.930 20 5 FHBDRN O=C(c1cc([O-])cc([N+](=O)[O-])c1)N1C[C@H](c2ccccc2)C2(CCC2)C1 ZINC000412674778 568371736 /nfs/dbraw/zinc/37/17/36/568371736.db2.gz NQMZKTWWBKVFOA-GOSISDBHSA-N 0 0 352.390 3.710 20 5 FHBDRN C[C@@H]1CN(Cc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2N(C)C1=O ZINC000541999676 568379879 /nfs/dbraw/zinc/37/98/79/568379879.db2.gz RVGNYYWOCDQZGZ-GFCCVEGCSA-N 0 0 359.813 3.867 20 5 FHBDRN COc1cccc([N+](=O)[O-])c1NCc1ccc(C)cc1O[C@@H]1CCOC1 ZINC000569398375 568400735 /nfs/dbraw/zinc/40/07/35/568400735.db2.gz ZESFNICKPVBFRP-OAHLLOKOSA-N 0 0 358.394 3.692 20 5 FHBDRN COc1ccc(C[C@@H](C)Nc2ccc([N+](=O)[O-])c(C(C)=O)c2)cc1OC ZINC000569491970 568403358 /nfs/dbraw/zinc/40/33/58/568403358.db2.gz SQTATRMPDVZGLI-GFCCVEGCSA-N 0 0 358.394 3.858 20 5 FHBDRN C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N(C)Cc1ccc(F)cc1 ZINC000006976622 568408275 /nfs/dbraw/zinc/40/82/75/568408275.db2.gz FWAVKSMOOMEPHY-LBPRGKRZSA-N 0 0 356.357 3.977 20 5 FHBDRN C[C@H]1CCCN(c2ccc(C(=O)N(C)c3nccs3)cc2[N+](=O)[O-])C1 ZINC000041842014 568412039 /nfs/dbraw/zinc/41/20/39/568412039.db2.gz RDJCUDTUQKPMRZ-LBPRGKRZSA-N 0 0 360.439 3.564 20 5 FHBDRN Cn1ncc([N+](=O)[O-])c1C(=O)N[C@@H](c1c(Cl)cccc1Cl)C1CC1 ZINC000569655686 568416219 /nfs/dbraw/zinc/41/62/19/568416219.db2.gz YJPZRIYPYVOLEE-CYBMUJFWSA-N 0 0 369.208 3.516 20 5 FHBDRN Cc1ccc2snc(-c3nc(-c4ccc(N)c([N+](=O)[O-])c4)no3)c2c1 ZINC000569826545 568427926 /nfs/dbraw/zinc/42/79/26/568427926.db2.gz AFVGZDJYAHRXPO-UHFFFAOYSA-N 0 0 353.363 3.812 20 5 FHBDRN CSc1ccc(C(=O)N2CC[C@@H](c3cc(C)ccn3)C2)cc1[N+](=O)[O-] ZINC000569865336 568431756 /nfs/dbraw/zinc/43/17/56/568431756.db2.gz KBOOPAKTRACOGW-CQSZACIVSA-N 0 0 357.435 3.650 20 5 FHBDRN COc1cc(NC(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)cc2cccnc21 ZINC000569876699 568433034 /nfs/dbraw/zinc/43/30/34/568433034.db2.gz WUDYWKBSGWSXCT-UHFFFAOYSA-N 0 0 373.315 3.611 20 5 FHBDRN Cc1cc(NC[C@@H](C)[N@H+](C)Cc2ccccc2)cc(C(=O)[O-])c1[N+](=O)[O-] ZINC000569930079 568437860 /nfs/dbraw/zinc/43/78/60/568437860.db2.gz BRHWMRNKYDCJMA-CQSZACIVSA-N 0 0 357.410 3.534 20 5 FHBDRN O=[N+]([O-])c1ccc(CSc2nnc([C@H]3COc4ccccc4O3)o2)cc1 ZINC000007088895 568444720 /nfs/dbraw/zinc/44/47/20/568444720.db2.gz HHVBZQYDXRYKQF-OAHLLOKOSA-N 0 0 371.374 3.783 20 5 FHBDRN C[C@@H](C(=O)Nc1cccc(Oc2cnccn2)c1)c1cccc([N+](=O)[O-])c1 ZINC000570146527 568455009 /nfs/dbraw/zinc/45/50/09/568455009.db2.gz UURLWTWPMIIYRH-CYBMUJFWSA-N 0 0 364.361 3.919 20 5 FHBDRN C[C@@H]1CCC[C@H](N(C)C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C1 ZINC000033099173 568455117 /nfs/dbraw/zinc/45/51/17/568455117.db2.gz GMSLWJSQUSPHQS-WBVHZDCISA-N 0 0 359.470 3.848 20 5 FHBDRN COc1ccc([C@H](C)N(C)C(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)cc1 ZINC000570075048 568457304 /nfs/dbraw/zinc/45/73/04/568457304.db2.gz FKUFNONAWAMMSL-NSHDSACASA-N 0 0 364.348 3.644 20 5 FHBDRN COCCOC1CCC(c2nc(-c3ccc([N+](=O)[O-])cc3C)no2)CC1 ZINC000570082524 568457504 /nfs/dbraw/zinc/45/75/04/568457504.db2.gz LBYWFUQQTCKYQZ-UHFFFAOYSA-N 0 0 361.398 3.642 20 5 FHBDRN COc1ccc(CSCC(=O)N(C)[C@@H]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000033101947 568458457 /nfs/dbraw/zinc/45/84/57/568458457.db2.gz BHBHFTRJHHPLKM-UKRRQHHQSA-N 0 0 366.483 3.874 20 5 FHBDRN CCN(CC)C(=O)c1ccc(Nc2cc(C(=O)OC)ccc2[N+](=O)[O-])cc1 ZINC000542012165 568503320 /nfs/dbraw/zinc/50/33/20/568503320.db2.gz OUUNPQFQODCMEO-UHFFFAOYSA-N 0 0 371.393 3.607 20 5 FHBDRN COc1ccc(C(=O)COc2cc([N+](=O)[O-])ccc2OC)cc1Cl ZINC000007410750 568505057 /nfs/dbraw/zinc/50/50/57/568505057.db2.gz SBUMJCPYESCIBY-UHFFFAOYSA-N 0 0 351.742 3.527 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CCC[C@@H](C(F)(F)F)[C@H]2C)c1 ZINC000570742867 568513524 /nfs/dbraw/zinc/51/35/24/568513524.db2.gz IMBGDKBWYCADAP-ZWNOBZJWSA-N 0 0 360.332 3.797 20 5 FHBDRN CSCCCCCNC(=O)c1c([N+](=O)[O-])cccc1C(F)(F)F ZINC000482245754 568523056 /nfs/dbraw/zinc/52/30/56/568523056.db2.gz PKKRRQNSHNUWOA-UHFFFAOYSA-N 0 0 350.362 3.877 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)NCc2ccc(Cl)cc2)cc1SC ZINC000482245813 568523169 /nfs/dbraw/zinc/52/31/69/568523169.db2.gz UPLDGJCQRHIVBL-UHFFFAOYSA-N 0 0 366.826 3.909 20 5 FHBDRN Cc1cc(OCC(=O)NCCc2ccc(C(C)C)cc2)ccc1[N+](=O)[O-] ZINC000007549427 568530479 /nfs/dbraw/zinc/53/04/79/568530479.db2.gz KXNRBABSDQGBCR-UHFFFAOYSA-N 0 0 356.422 3.764 20 5 FHBDRN CCN(CC)C(=O)CSc1nc2cc3ccccc3cc2c(=O)n1CC ZINC000007577822 568533685 /nfs/dbraw/zinc/53/36/85/568533685.db2.gz SNNXPUSYJHELHB-UHFFFAOYSA-N 0 0 369.490 3.530 20 5 FHBDRN CC(=O)c1oc2cc(C)ccc2c1CC(=O)Nc1ccc([N+](=O)[O-])c(C)n1 ZINC000570846311 568545307 /nfs/dbraw/zinc/54/53/07/568545307.db2.gz FIKYTEMTTFVOFK-UHFFFAOYSA-N 0 0 367.361 3.737 20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])N1CCCCC[C@H]1c1ccncc1 ZINC000049764843 568590005 /nfs/dbraw/zinc/59/00/05/568590005.db2.gz BXRNHANEDQFDOK-SFHVURJKSA-N 0 0 368.437 3.936 20 5 FHBDRN CC(=O)Nc1cc(Cl)ccc1NC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000570904566 568639632 /nfs/dbraw/zinc/63/96/32/568639632.db2.gz POOCPEXCIHVZRD-SNVBAGLBSA-N 0 0 361.785 3.949 20 5 FHBDRN O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1NC1CC(c2cccc(Cl)c2)C1 ZINC000823630282 599047953 /nfs/dbraw/zinc/04/79/53/599047953.db2.gz VMQJJQNYEUOFDU-UHFFFAOYSA-N 0 0 370.800 3.786 20 5 FHBDRN CC(C)Oc1ccc(-c2nn[nH]n2)cc1N[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000820151692 599155223 /nfs/dbraw/zinc/15/52/23/599155223.db2.gz MWERBMLIQAWZOE-LBPRGKRZSA-N 0 0 368.397 3.735 20 5 FHBDRN O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1N[C@H](c1ccc(F)cc1)C1CCC1 ZINC000738360820 598796565 /nfs/dbraw/zinc/79/65/65/598796565.db2.gz ZJAAPHVQADWECU-KRWDZBQOSA-N 0 0 368.372 3.867 20 5 FHBDRN O=[N+]([O-])c1ccc(N[C@@H](c2ccccc2)C2CCC2)c(-c2nn[nH]n2)c1 ZINC000738370376 598796756 /nfs/dbraw/zinc/79/67/56/598796756.db2.gz PGKOLLGCMVJJPX-KRWDZBQOSA-N 0 0 350.382 3.728 20 5 FHBDRN C[C@@H](c1ccc(Cl)cc1)N(C)c1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-] ZINC000736199037 598814178 /nfs/dbraw/zinc/81/41/78/598814178.db2.gz MRLYLBRYGKQAPQ-JTQLQIEISA-N 0 0 358.789 3.626 20 5 FHBDRN C[C@H](c1ccc(Cl)cc1)N(C)c1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-] ZINC000736199038 598814186 /nfs/dbraw/zinc/81/41/86/598814186.db2.gz MRLYLBRYGKQAPQ-SNVBAGLBSA-N 0 0 358.789 3.626 20 5 FHBDRN COc1ccc([C@@H](Nc2ccc([N+](=O)[O-])cc2-c2nn[nH]n2)C(C)C)cc1 ZINC000821782676 599299745 /nfs/dbraw/zinc/29/97/45/599299745.db2.gz KEXJZMWAGVRXRV-KRWDZBQOSA-N 0 0 368.397 3.593 20 5 FHBDRN O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1N[C@H]1CCSc2ccc(F)cc21 ZINC000823629671 599320778 /nfs/dbraw/zinc/32/07/78/599320778.db2.gz DTROJYRELYJAQU-LBPRGKRZSA-N 0 0 372.385 3.563 20 5 FHBDRN C[C@@H](Nc1ccc([N+](=O)[O-])cc1-c1nn[nH]n1)c1ccc(F)cc1Cl ZINC000736134339 599440743 /nfs/dbraw/zinc/44/07/43/599440743.db2.gz BWAMPVWZSBQHSU-MRVPVSSYSA-N 0 0 362.752 3.741 20 5 FHBDRN C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCN(c2ccc(C(=O)[O-])cc2)C[C@H]1C ZINC000828495050 600822138 /nfs/dbraw/zinc/82/21/38/600822138.db2.gz UWQQRBMTCRVCSJ-CABCVRRESA-N 0 0 369.421 3.565 20 5 FHBDRN C[NH+](C)[C@@H](CNc1cc(Cl)c(C(=O)[O-])cc1[N+](=O)[O-])c1ccsc1 ZINC000830584926 602250524 /nfs/dbraw/zinc/25/05/24/602250524.db2.gz HHRGCDGSZBRNHC-AWEZNQCLSA-N 0 0 369.830 3.723 20 5 FHBDRN C[C@@H]([NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)[C@H]1CCCN(C(=O)[O-])C1 ZINC000739032391 602270417 /nfs/dbraw/zinc/27/04/17/602270417.db2.gz WYIKLLBJGJDCDR-HIFRSBDPSA-N 0 0 373.409 3.723 20 5 FHBDRN CC(C)C[N@H+](CCC(=O)[O-])Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000833486457 604577887 /nfs/dbraw/zinc/57/78/87/604577887.db2.gz IXJRTOOWPMWWNM-UHFFFAOYSA-N 0 0 363.439 3.651 20 5 FHBDRN O=[N+]([O-])c1ccc2sc(C=Cc3ccc(-c4nn[nH]n4)s3)nc2c1 ZINC000823644654 606387983 /nfs/dbraw/zinc/38/79/83/606387983.db2.gz JXKUQDZBOMPLJV-UTCJRWHESA-N 0 0 356.392 3.617 20 5 FHBDRN O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1NC[C@H]1CCC[C@H](C(F)(F)F)C1 ZINC000823629911 606596133 /nfs/dbraw/zinc/59/61/33/606596133.db2.gz LOVBGPLVEBZNLL-ONGXEEELSA-N 0 0 370.335 3.556 20 5 FHBDRN O=[N+]([O-])c1cccc(F)c1CSc1ccc(-c2nn[nH]n2)cc1Cl ZINC000823647620 606852144 /nfs/dbraw/zinc/85/21/44/606852144.db2.gz NGNGMTCOQXSUPZ-UHFFFAOYSA-N 0 0 365.777 3.860 20 5 FHBDRN CC[C@@H](C)n1ncc(Nc2ccc([N+](=O)[O-])cc2-c2nn[nH]n2)c1C1CC1 ZINC000825080726 608098652 /nfs/dbraw/zinc/09/86/52/608098652.db2.gz BRDOIHDQNMZEQS-SNVBAGLBSA-N 0 0 368.401 3.563 20 5 FHBDRN CCCC[C@H](CC)C(=O)Nc1cc(-c2nn[nH]n2)cc([N+](=O)[O-])c1Cl ZINC000825260308 608161129 /nfs/dbraw/zinc/16/11/29/608161129.db2.gz NNLAOVCZZHYYAV-VIFPVBQESA-N 0 0 366.809 3.583 20 5 FHBDRN C[C@@H](SCCc1ccc([N+](=O)[O-])cc1)c1ccc(-c2nn[nH]n2)cc1 ZINC000824757169 609329082 /nfs/dbraw/zinc/32/90/82/609329082.db2.gz TXXZXPZMZSDKOQ-GFCCVEGCSA-N 0 0 355.423 3.812 20 5 FHBDRN Cc1ccc([C@H](C)Nc2ncc(Cl)c(C)c2-c2nn[nH]n2)cc1[N+](=O)[O-] ZINC000826284571 609570689 /nfs/dbraw/zinc/57/06/89/609570689.db2.gz YCWIFRBXASOYMY-JTQLQIEISA-N 0 0 373.804 3.613 20 5 FHBDRN COCc1nc2cc(NC(=O)c3cc4cccc([N+](=O)[O-])c4[nH]3)ccc2o1 ZINC000431508278 936312917 /nfs/dbraw/zinc/31/29/17/936312917.db2.gz 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CC(C)(C(=O)N[C@H]1C[C@]1(C)c1ccccc1)c1ccc([N+](=O)[O-])cc1F ZINC000612997926 936353629 /nfs/dbraw/zinc/35/36/29/936353629.db2.gz UGPAFZFCFFECLE-FXAWDEMLSA-N 0 0 356.397 3.858 20 5 FHBDRN Cc1oc(-c2cccs2)nc1CSCCn1cc([N+](=O)[O-])cn1 ZINC000162156959 936353883 /nfs/dbraw/zinc/35/38/83/936353883.db2.gz JZRJWEWDNZNTBF-UHFFFAOYSA-N 0 0 350.425 3.750 20 5 FHBDRN O=[N+]([O-])c1ccccc1CN1CCN(c2ncc(Cl)cc2Cl)CC1 ZINC000052040078 936357735 /nfs/dbraw/zinc/35/77/35/936357735.db2.gz NBFHMWNXOMDAFI-UHFFFAOYSA-N 0 0 367.236 3.619 20 5 FHBDRN Cc1ccc(-c2noc(-c3cccc(Cn4ccnc4)c3)n2)cc1[N+](=O)[O-] ZINC000569619878 936366216 /nfs/dbraw/zinc/36/62/16/936366216.db2.gz BKLCTVSQKLFUJE-UHFFFAOYSA-N 0 0 361.361 3.865 20 5 FHBDRN COC(=O)c1ccc(OCc2ccc(Br)s2)cc1[N+](=O)[O-] ZINC000613109867 936373871 /nfs/dbraw/zinc/37/38/71/936373871.db2.gz BVSABYGKRCUMIB-UHFFFAOYSA-N 0 0 372.196 3.784 20 5 FHBDRN COC(=O)c1ccc(Oc2ncnc3c4ccccc4oc32)cc1[N+](=O)[O-] ZINC000613114164 936377483 /nfs/dbraw/zinc/37/74/83/936377483.db2.gz 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364.442 3.947 20 5 FHBDRN Cc1ccc2c(c1)CC[C@H]2NC(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000510302352 929761958 /nfs/dbraw/zinc/76/19/58/929761958.db2.gz DVPJCJXFXGOWAT-LJQANCHMSA-N 0 0 353.422 3.899 20 5 FHBDRN CCS[C@@H]1CCC[C@@H](NC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2)C1 ZINC000177640880 929762523 /nfs/dbraw/zinc/76/25/23/929762523.db2.gz JYMBHIMAZMAJAI-CHWSQXEVSA-N 0 0 367.427 3.606 20 5 FHBDRN COc1cc(OCC(=O)Nc2ccc3occ(C)c3c2)ccc1[N+](=O)[O-] ZINC000187312055 929768085 /nfs/dbraw/zinc/76/80/85/929768085.db2.gz GWWZNDFLHMXMRE-UHFFFAOYSA-N 0 0 356.334 3.676 20 5 FHBDRN O=C(Nc1cnn(Cc2ccc(Cl)cc2)c1)c1cc(F)cc([N+](=O)[O-])c1 ZINC000610303830 929770312 /nfs/dbraw/zinc/77/03/12/929770312.db2.gz NMQNZTFIBDEIIK-UHFFFAOYSA-N 0 0 374.759 3.884 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)N1CC[C@H]1c1cccc(F)c1 ZINC000610305290 929770612 /nfs/dbraw/zinc/77/06/12/929770612.db2.gz SYQMDWKNKNNFEY-SFHVURJKSA-N 0 0 353.353 3.662 20 5 FHBDRN CS(=O)(=O)c1cccc(Sc2cc(Cl)ccc2F)c1[N+](=O)[O-] ZINC000579987473 929774089 /nfs/dbraw/zinc/77/40/89/929774089.db2.gz VOIKUKWCHISGDZ-UHFFFAOYSA-N 0 0 361.803 3.942 20 5 FHBDRN C[C@H]1c2ccc(F)cc2CCN1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000610003885 929774099 /nfs/dbraw/zinc/77/40/99/929774099.db2.gz MPJLYZOYRHPIBS-LBPRGKRZSA-N 0 0 358.369 3.720 20 5 FHBDRN CC(C)(C)OC(=O)Cc1cccc(NC(=O)Cc2cccc([N+](=O)[O-])c2)c1 ZINC000610306579 929778669 /nfs/dbraw/zinc/77/86/69/929778669.db2.gz GIDNGISXXWSSKL-UHFFFAOYSA-N 0 0 370.405 3.660 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)N[C@@H]1CCC[C@@H]1Cc1ccccc1 ZINC000610013762 929780025 /nfs/dbraw/zinc/78/00/25/929780025.db2.gz AOVZIDTXWXXVHT-IEBWSBKVSA-N 0 0 353.422 3.805 20 5 FHBDRN Cc1ccc(-c2ccc(C(=O)OCCn3cc([N+](=O)[O-])cn3)c(F)c2)cc1 ZINC000748124646 929780837 /nfs/dbraw/zinc/78/08/37/929780837.db2.gz HBJHNSRCHJCCNP-UHFFFAOYSA-N 0 0 369.352 3.763 20 5 FHBDRN CCO[C@H]1C[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2Cl)C12CCCC2 ZINC000610309547 929807010 /nfs/dbraw/zinc/80/70/10/929807010.db2.gz 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CC(C)O[C@@H]1C[C@H](N[C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)C1(C)C ZINC000560547781 929885312 /nfs/dbraw/zinc/88/53/12/929885312.db2.gz BEAFBEXVBSYZGR-KSZLIROESA-N 0 0 372.469 3.599 20 5 FHBDRN Cc1nc(NC(=O)[C@H](OC2CCCC2)c2ccccc2)ccc1[N+](=O)[O-] ZINC000134076437 929901399 /nfs/dbraw/zinc/90/13/99/929901399.db2.gz YJPZLGDBSCLZMV-GOSISDBHSA-N 0 0 355.394 3.937 20 5 FHBDRN C[C@@H]1CN(C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)C[C@@H](C)S1 ZINC000610321956 929928116 /nfs/dbraw/zinc/92/81/16/929928116.db2.gz BWJWYZKVRXBWFT-RKDXNWHRSA-N 0 0 361.370 3.554 20 5 FHBDRN COC(=O)c1cc(NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)ccc1C ZINC000471489524 929975177 /nfs/dbraw/zinc/97/51/77/929975177.db2.gz UJJAIUCQUBIOPM-UHFFFAOYSA-N 0 0 369.377 3.516 20 5 FHBDRN O=[N+]([O-])c1ccc(Cl)c(OS(=O)(=O)c2c[nH]c3cccc(F)c32)c1 ZINC000799779133 930003466 /nfs/dbraw/zinc/00/34/66/930003466.db2.gz SIRSWKQPMDDXNU-UHFFFAOYSA-N 0 0 370.745 3.636 20 5 FHBDRN O=[N+]([O-])c1cnn(C[C@@H](O)CSc2ccc(C3CCCCC3)cc2)c1 ZINC000610335923 930014777 /nfs/dbraw/zinc/01/47/77/930014777.db2.gz DNWJNIBMXYTYPY-QGZVFWFLSA-N 0 0 361.467 3.992 20 5 FHBDRN Cc1nn(CCC(=O)N[C@@H](C)[C@@H](C)C2CCCCC2)c(C)c1[N+](=O)[O-] ZINC000176695358 937378831 /nfs/dbraw/zinc/37/88/31/937378831.db2.gz NUZDYJOFOVYPFQ-OLZOCXBDSA-N 0 0 350.463 3.519 20 5 FHBDRN C[C@H]1CCCN(c2ccc(C(=O)Nc3c(O)cccc3F)cc2[N+](=O)[O-])C1 ZINC000610339805 930032248 /nfs/dbraw/zinc/03/22/48/930032248.db2.gz QULHWPMNFWPZTA-LBPRGKRZSA-N 0 0 373.384 3.928 20 5 FHBDRN COC(=O)[C@@H](NCc1cccc([N+](=O)[O-])c1)c1ccc(Cl)cc1Cl ZINC000610341577 930039312 /nfs/dbraw/zinc/03/93/12/930039312.db2.gz ADPABIJSSRHWLD-HNNXBMFYSA-N 0 0 369.204 3.906 20 5 FHBDRN CNc1ccc(C(=O)NCc2ccc(-c3ccncc3)cc2)cc1[N+](=O)[O-] ZINC000610069003 930066312 /nfs/dbraw/zinc/06/63/12/930066312.db2.gz JEDKLSKKCJVITG-UHFFFAOYSA-N 0 0 362.389 3.629 20 5 FHBDRN COc1ccc(SCC(=O)Nc2ccc3cc([N+](=O)[O-])ccc3n2)cc1 ZINC000176701649 937380176 /nfs/dbraw/zinc/38/01/76/937380176.db2.gz CUICKBADDHRFEM-UHFFFAOYSA-N 0 0 369.402 3.882 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)Nc1cccc(N(C)C)n1 ZINC000121138312 930082959 /nfs/dbraw/zinc/08/29/59/930082959.db2.gz VUTLIJFEONEIMN-UHFFFAOYSA-N 0 0 360.439 3.809 20 5 FHBDRN Cc1[nH][nH]c(=NC(=O)c2csc([N+](=O)[O-])c2)c1-c1cccc(Cl)c1 ZINC000610354654 930105051 /nfs/dbraw/zinc/10/50/51/930105051.db2.gz XJLUGMPNWYTKMD-UHFFFAOYSA-N 0 0 362.798 3.682 20 5 FHBDRN C[C@@H]1CN(C(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)C[C@H](C)S1 ZINC000548039219 930110122 /nfs/dbraw/zinc/11/01/22/930110122.db2.gz XNBAUVHPJYEZNK-BETUJISGSA-N 0 0 352.459 3.647 20 5 FHBDRN Cc1ccn(-c2ccccc2NC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)n1 ZINC000177686216 930112479 /nfs/dbraw/zinc/11/24/79/930112479.db2.gz GCEQSOQHQZYKKF-AWEZNQCLSA-N 0 0 365.393 3.972 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C(=O)N[C@@H](C)COc2ccccc2F)cc1Cl ZINC001125410995 930113857 /nfs/dbraw/zinc/11/38/57/930113857.db2.gz YMLHBUALOXSIMP-NSHDSACASA-N 0 0 366.776 3.893 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)ccc1NC[C@H]1CC[C@@H](c2nc(C3CC3)no2)O1 ZINC000471518097 930123157 /nfs/dbraw/zinc/12/31/57/930123157.db2.gz MDIDYLUGFGNHND-RISCZKNCSA-N 0 0 364.789 3.841 20 5 FHBDRN CC(C)c1ccc([C@@]2(C)CC(=O)N(Cc3cccc([N+](=O)[O-])c3)C2=O)cc1 ZINC000431530085 937392093 /nfs/dbraw/zinc/39/20/93/937392093.db2.gz FWSWYYVLBFUSCP-OAQYLSRUSA-N 0 0 366.417 3.935 20 5 FHBDRN CCCc1csc(NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)n1 ZINC000127147315 930155663 /nfs/dbraw/zinc/15/56/63/930155663.db2.gz IZLHSMPANPYSNJ-UHFFFAOYSA-N 0 0 360.439 3.856 20 5 FHBDRN C[C@@H](OC(=O)[C@H](C)C1CC1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000748143487 930179710 /nfs/dbraw/zinc/17/97/10/930179710.db2.gz NXVWNLPGZPZWRM-RKDXNWHRSA-N 0 0 374.315 3.530 20 5 FHBDRN CC[C@H]1c2ccsc2CCN1C(=O)COc1cc(F)cc([N+](=O)[O-])c1 ZINC000135357734 937393816 /nfs/dbraw/zinc/39/38/16/937393816.db2.gz YWTBLFMTUSEPOZ-HNNXBMFYSA-N 0 0 364.398 3.710 20 5 FHBDRN CCOC(=O)c1cc(N2CCC[C@@H]2c2ccc(COC)o2)ccc1[N+](=O)[O-] ZINC000161689520 937395984 /nfs/dbraw/zinc/39/59/84/937395984.db2.gz BGXKTZFGYIQXKF-QGZVFWFLSA-N 0 0 374.393 3.852 20 5 FHBDRN O=C(CCc1c(Cl)cccc1[N+](=O)[O-])Nc1ccc(C(F)(F)F)nn1 ZINC001266574865 930222588 /nfs/dbraw/zinc/22/25/88/930222588.db2.gz UCUPUWNUKBUHCH-UHFFFAOYSA-N 0 0 374.706 3.628 20 5 FHBDRN O=C(c1cccc(Cl)c1[N+](=O)[O-])N(C[C@@H]1CCCO1)C1CCCC1 ZINC000175900672 930267123 /nfs/dbraw/zinc/26/71/23/930267123.db2.gz DULUPIXIHZKSCU-ZDUSSCGKSA-N 0 0 352.818 3.812 20 5 FHBDRN Cc1ncc([N+](=O)[O-])n1CCN(Cc1c(F)cccc1F)C1CCCC1 ZINC001167355928 930267938 /nfs/dbraw/zinc/26/79/38/930267938.db2.gz FAJRYJNDZLIWET-UHFFFAOYSA-N 0 0 364.396 3.823 20 5 FHBDRN CNC(=O)c1ccc(NCc2ccc(-c3ccccc3)o2)c([N+](=O)[O-])c1 ZINC000064914883 930309970 /nfs/dbraw/zinc/30/99/70/930309970.db2.gz XMJJQNYAPSNMPY-UHFFFAOYSA-N 0 0 351.362 3.827 20 5 FHBDRN CCOc1ccc(NC(=O)CNc2ccc(C)c(C(C)=O)c2)c([N+](=O)[O-])c1 ZINC000583392167 937402742 /nfs/dbraw/zinc/40/27/42/937402742.db2.gz WYGYVMZDSCUBNK-UHFFFAOYSA-N 0 0 371.393 3.555 20 5 FHBDRN Cc1cccc2[nH]c(CCC(=O)N[C@H](C)c3ccc(C)c([N+](=O)[O-])c3)nc21 ZINC000177728028 930337413 /nfs/dbraw/zinc/33/74/13/930337413.db2.gz IIXWJCGWCIFWFO-CQSZACIVSA-N 0 0 366.421 3.898 20 5 FHBDRN O=C(NCCNc1ccccc1[N+](=O)[O-])N[C@H](CC1CC1)c1ccccc1 ZINC000610400613 930370537 /nfs/dbraw/zinc/37/05/37/930370537.db2.gz MLTHUDNSDMCXKW-GOSISDBHSA-N 0 0 368.437 3.847 20 5 FHBDRN CCCc1ccc([C@@H](C)N(CC(N)=O)Cc2cc(F)ccc2[N+](=O)[O-])cc1 ZINC000728287496 930378109 /nfs/dbraw/zinc/37/81/09/930378109.db2.gz DWUNMPGCDIZXJP-CQSZACIVSA-N 0 0 373.428 3.735 20 5 FHBDRN CN(CCCc1cc(-c2cccc(F)c2)n[nH]1)c1ccc([N+](=O)[O-])nc1 ZINC000580254627 930409392 /nfs/dbraw/zinc/40/93/92/930409392.db2.gz YGHGIRDZSSLHKJ-UHFFFAOYSA-N 0 0 355.373 3.588 20 5 FHBDRN COc1cc(CNC(=O)CCc2ccc([N+](=O)[O-])cc2Cl)ccc1C ZINC001125432728 930415148 /nfs/dbraw/zinc/41/51/48/930415148.db2.gz TWJZOVLNVXKIOO-UHFFFAOYSA-N 0 0 362.813 3.814 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)Oc1ccc(F)c2c1C(=O)C[C@@H]2C ZINC000728290117 930457987 /nfs/dbraw/zinc/45/79/87/930457987.db2.gz ZAPMRCFDPUIMOZ-VIFPVBQESA-N 0 0 359.309 3.652 20 5 FHBDRN C[C@@H]1C[C@H](Nc2cc(C(=O)[O-])ccc2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1 ZINC000379603566 930473501 /nfs/dbraw/zinc/47/35/01/930473501.db2.gz FXIKZYQYUMFVRW-RHSMWYFYSA-N 0 0 369.421 3.758 20 5 FHBDRN COc1cc(Br)cc(OC)c1OCc1cccc([N+](=O)[O-])c1 ZINC000118979397 930484251 /nfs/dbraw/zinc/48/42/51/930484251.db2.gz PXJYFTLCPIOLKE-UHFFFAOYSA-N 0 0 368.183 3.954 20 5 FHBDRN CNc1c(C(=O)NCc2cc(Cl)sc2Cl)cccc1[N+](=O)[O-] ZINC000312784678 930506164 /nfs/dbraw/zinc/50/61/64/930506164.db2.gz SVFKUDHEFWFWLF-UHFFFAOYSA-N 0 0 360.222 3.935 20 5 FHBDRN CC[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)C[C@@H]1O ZINC000536467733 930515875 /nfs/dbraw/zinc/51/58/75/930515875.db2.gz MIUOGGBVSRNIAI-DYVFJYSZSA-N 0 0 372.446 3.589 20 5 FHBDRN CCOc1ccc(NC(=O)COc2cc(Cl)ccc2F)c([N+](=O)[O-])c1 ZINC000536016577 937419940 /nfs/dbraw/zinc/41/99/40/937419940.db2.gz DQEIAEHNBXUROE-UHFFFAOYSA-N 0 0 368.748 3.804 20 5 FHBDRN Cc1cc2cc[nH]c2cc1NC(=O)NCCOc1ccc([N+](=O)[O-])cc1 ZINC000548081991 930541195 /nfs/dbraw/zinc/54/11/95/930541195.db2.gz BIWBFZXASLQAJO-UHFFFAOYSA-N 0 0 354.366 3.585 20 5 FHBDRN C[C@H](CC(=O)c1ccc(F)cc1)NC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000119023985 930543334 /nfs/dbraw/zinc/54/33/34/930543334.db2.gz QWUZYJNAMFOZOP-SNVBAGLBSA-N 0 0 364.760 3.779 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1)[nH]cc2-c1nc(COCC(F)(F)C(F)F)no1 ZINC000278246596 937430487 /nfs/dbraw/zinc/43/04/87/937430487.db2.gz RDOVGVYSAJXGIL-UHFFFAOYSA-N 0 0 374.250 3.543 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCC[C@H]2c2cc[nH]n2)nc1-c1ccc(F)cc1 ZINC000579575406 930569849 /nfs/dbraw/zinc/56/98/49/930569849.db2.gz CIHPUKQFMRZDTQ-HNNXBMFYSA-N 0 0 353.357 3.861 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)Nc1nnc(/C=C\c2ccco2)s1 ZINC000255471355 930580823 /nfs/dbraw/zinc/58/08/23/930580823.db2.gz GPDDMVDKLUGWSQ-ALCCZGGFSA-N 0 0 356.363 3.770 20 5 FHBDRN O=c1cc(-c2noc(-c3cc(F)cc([N+](=O)[O-])c3)n2)c2ccccc2[nH]1 ZINC000580377987 930592454 /nfs/dbraw/zinc/59/24/54/930592454.db2.gz VCMLYFQOHIPGGN-UHFFFAOYSA-N 0 0 352.281 3.705 20 5 FHBDRN CCCc1nnc(NC(=O)c2cc([N+](=O)[O-])ccc2SCC)s1 ZINC000134219844 930601932 /nfs/dbraw/zinc/60/19/32/930601932.db2.gz HENBLGJZNQGIAA-UHFFFAOYSA-N 0 0 352.441 3.763 20 5 FHBDRN CC(C)NC(=O)c1ccc(NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)cc1 ZINC000119066422 930606456 /nfs/dbraw/zinc/60/64/56/930606456.db2.gz DKGBJIGDYCOJDH-UHFFFAOYSA-N 0 0 361.785 3.639 20 5 FHBDRN COc1ccc(N(C(=O)CNc2ccccc2[N+](=O)[O-])[C@H](C)C2CC2)cc1 ZINC000109892990 930621823 /nfs/dbraw/zinc/62/18/23/930621823.db2.gz IPCMQOWMOYVQBS-CQSZACIVSA-N 0 0 369.421 3.847 20 5 FHBDRN O=C(NCCCn1ccc2ccccc21)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000109893237 930623322 /nfs/dbraw/zinc/62/33/22/930623322.db2.gz FSAIQQDZMUVHLW-UHFFFAOYSA-N 0 0 362.389 3.851 20 5 FHBDRN CC[C@@H](C)c1cc(C(=O)Nc2cc(-c3cccc([N+](=O)[O-])c3)[nH]n2)on1 ZINC000175806859 930627046 /nfs/dbraw/zinc/62/70/46/930627046.db2.gz DWRPAGAWNDMTST-SNVBAGLBSA-N 0 0 355.354 3.739 20 5 FHBDRN C[C@H](CC(=O)NCCc1ccccc1[N+](=O)[O-])C(=O)c1ccc(Cl)cc1 ZINC000548094861 930657997 /nfs/dbraw/zinc/65/79/97/930657997.db2.gz BPTGXEFJKXGJGC-CYBMUJFWSA-N 0 0 374.824 3.816 20 5 FHBDRN Cc1cccc(C2=CCN(C(=O)NCCc3ccccc3[N+](=O)[O-])CC2)c1 ZINC000548094512 930658804 /nfs/dbraw/zinc/65/88/04/930658804.db2.gz AOLWHKRHAPONDA-UHFFFAOYSA-N 0 0 365.433 3.945 20 5 FHBDRN Cn1cc([N+](=O)[O-])cc1C(=O)N1CCC(C)(c2ccc(Cl)cc2)CC1 ZINC000548094270 930665024 /nfs/dbraw/zinc/66/50/24/930665024.db2.gz RDFQURONQAQQHE-UHFFFAOYSA-N 0 0 361.829 3.781 20 5 FHBDRN CNC(=O)c1cc(NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])ccc1Cl ZINC000047916559 930700928 /nfs/dbraw/zinc/70/09/28/930700928.db2.gz UYKOXWWFXOMVTN-UHFFFAOYSA-N 0 0 368.176 3.514 20 5 FHBDRN CC(=O)c1ccc(OCC(=O)N2CCC[C@@H]2c2cccs2)c([N+](=O)[O-])c1 ZINC000119149455 930748502 /nfs/dbraw/zinc/74/85/02/930748502.db2.gz ACFOCEZHZNECKE-CQSZACIVSA-N 0 0 374.418 3.601 20 5 FHBDRN C[C@H](c1ccccc1Cl)N(C)C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000046358204 930765643 /nfs/dbraw/zinc/76/56/43/930765643.db2.gz GBTDJEPAYOUOMD-SNVBAGLBSA-N 0 0 358.785 3.958 20 5 FHBDRN CC(=O)c1ccc(OCc2noc(-c3ccccc3C)n2)c([N+](=O)[O-])c1 ZINC000119160155 930779926 /nfs/dbraw/zinc/77/99/26/930779926.db2.gz ADHRPTRSAWBKMP-UHFFFAOYSA-N 0 0 353.334 3.735 20 5 FHBDRN CC[C@H]1c2ccsc2CCN1CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000050276502 930793905 /nfs/dbraw/zinc/79/39/05/930793905.db2.gz OBVCBCKVEGGCPY-AWEZNQCLSA-N 0 0 359.451 3.913 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])N1CCCc2c(F)ccc(F)c21 ZINC000119166846 930796644 /nfs/dbraw/zinc/79/66/44/930796644.db2.gz DMPKNRVVTXPWMX-UHFFFAOYSA-N 0 0 362.332 3.621 20 5 FHBDRN COc1cccc(CNC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)c1 ZINC000050288102 930820359 /nfs/dbraw/zinc/82/03/59/930820359.db2.gz KIKJUYDRMRAODF-UHFFFAOYSA-N 0 0 369.402 3.657 20 5 FHBDRN CN(C)c1ccc(-c2noc(CCCNc3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000544918560 930830985 /nfs/dbraw/zinc/83/09/85/930830985.db2.gz XDRTXNFKBRXNKI-UHFFFAOYSA-N 0 0 367.409 3.756 20 5 FHBDRN Cc1ccc([C@@H](C)N[C@H](C)C(=O)c2c[nH]c3ncccc23)cc1[N+](=O)[O-] ZINC000537175672 930853952 /nfs/dbraw/zinc/85/39/52/930853952.db2.gz VJDNNGDJTPUSNW-CHWSQXEVSA-N 0 0 352.394 3.702 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)[C@@]12CCO[C@H]1CCCC2 ZINC001266631303 930925025 /nfs/dbraw/zinc/92/50/25/930925025.db2.gz RDOLVHYTUJBQLE-ZFWWWQNUSA-N 0 0 358.316 3.901 20 5 FHBDRN C[C@@H](Nc1ccc(C(=O)N[C@@H]2CCC[C@@H]2F)cc1[N+](=O)[O-])c1ccccn1 ZINC000579754342 930942594 /nfs/dbraw/zinc/94/25/94/930942594.db2.gz NBAQSDKMFUJMOC-IVMMDQJWSA-N 0 0 372.400 3.783 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)NCCc1cccc(Cl)c1 ZINC000023789787 930950036 /nfs/dbraw/zinc/95/00/36/930950036.db2.gz CBTDMXJNCBPNSB-UHFFFAOYSA-N 0 0 361.829 3.799 20 5 FHBDRN C[C@@H](NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)[C@@H](C)c1ccccc1 ZINC000119244189 930951688 /nfs/dbraw/zinc/95/16/88/930951688.db2.gz OLXKZNKKFVPLGZ-ZIAGYGMSSA-N 0 0 351.406 3.927 20 5 FHBDRN COc1cc(CNCc2ccc(-c3ccco3)cc2F)c([N+](=O)[O-])cc1O ZINC000580638403 930959534 /nfs/dbraw/zinc/95/95/34/930959534.db2.gz UYFNBWHJKNVWFU-UHFFFAOYSA-N 0 0 372.352 3.998 20 5 FHBDRN CCn1c(C)nnc1SCc1ccc(Br)cc1[N+](=O)[O-] ZINC000580645621 930961086 /nfs/dbraw/zinc/96/10/86/930961086.db2.gz OLVQYUISWYKKJP-UHFFFAOYSA-N 0 0 357.233 3.569 20 5 FHBDRN Cc1cc(C(=O)N2CCC[C@@H]2c2ccc3c(c2)OCO3)ccc1[N+](=O)[O-] ZINC000077329786 930973406 /nfs/dbraw/zinc/97/34/06/930973406.db2.gz DOPRWDZKDROCFR-MRXNPFEDSA-N 0 0 354.362 3.609 20 5 FHBDRN CCOC(=O)CC[C@@H](C)NC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000275929312 930988105 /nfs/dbraw/zinc/98/81/05/930988105.db2.gz HQLGRJDOYNFBFC-CYBMUJFWSA-N 0 0 366.417 3.555 20 5 FHBDRN Cc1ccc(NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)c(C)n1 ZINC000119272178 931019547 /nfs/dbraw/zinc/01/95/47/931019547.db2.gz PERGQUOQFDANIK-UHFFFAOYSA-N 0 0 354.391 3.982 20 5 FHBDRN Cc1cc2c(ncn(Cc3ccc([N+](=O)[O-])cc3C(F)(F)F)c2=O)s1 ZINC000134299602 931031096 /nfs/dbraw/zinc/03/10/96/931031096.db2.gz UYPDJECHTXJEIW-UHFFFAOYSA-N 0 0 369.324 3.742 20 5 FHBDRN Cc1cc(S(=O)(=O)[N-]c2ccccc2C(F)(F)F)ccc1[N+](=O)[O-] ZINC000083955231 931033534 /nfs/dbraw/zinc/03/35/34/931033534.db2.gz YRZKHJRHIAIPPX-UHFFFAOYSA-N 0 0 360.313 3.723 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N[C@@H]1CCN(c2cccc(Cl)c2)C1 ZINC000119283952 931035000 /nfs/dbraw/zinc/03/50/00/931035000.db2.gz QCRBEXQKFAAKCB-MRXNPFEDSA-N 0 0 373.840 3.576 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)NC1(c2ccccc2F)CC1 ZINC000119291529 931035394 /nfs/dbraw/zinc/03/53/94/931035394.db2.gz JBCGEXHQNFEELQ-UHFFFAOYSA-N 0 0 357.385 3.732 20 5 FHBDRN Cc1cccn2cc(CCNC(=O)Nc3ccc([N+](=O)[O-])cc3Cl)nc12 ZINC000610455304 931052205 /nfs/dbraw/zinc/05/22/05/931052205.db2.gz KVHYCASJUHOBJE-UHFFFAOYSA-N 0 0 373.800 3.569 20 5 FHBDRN Cc1cc(Cl)c(S(=O)(=O)N(C2CC2)C2CCCC2)cc1[N+](=O)[O-] ZINC000083981416 931059119 /nfs/dbraw/zinc/05/91/19/931059119.db2.gz JEMNJXSSEGRAKQ-UHFFFAOYSA-N 0 0 358.847 3.652 20 5 FHBDRN Cc1nccn1-c1ccc([C@H](C)NC(=O)c2ccc([N+](=O)[O-])s2)cc1 ZINC000119302215 931068340 /nfs/dbraw/zinc/06/83/40/931068340.db2.gz KXWBZMJBNZWYMX-NSHDSACASA-N 0 0 356.407 3.641 20 5 FHBDRN C[C@@H]1CN(C(=O)c2cc(F)cc3c(=O)c4cc(F)ccc4[nH]c23)C[C@H](C)O1 ZINC000275937649 931081832 /nfs/dbraw/zinc/08/18/32/931081832.db2.gz ITCACNFESRJFMK-PHIMTYICSA-N 0 0 372.371 3.621 20 5 FHBDRN CCC[C@@H]1CN(C(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)CCO1 ZINC000275951617 931093782 /nfs/dbraw/zinc/09/37/82/931093782.db2.gz KSMXXVCXFSPZNV-OAHLLOKOSA-N 0 0 350.418 3.735 20 5 FHBDRN O=C(Oc1ccc(N2CCCC2=O)cc1)c1cc([N+](=O)[O-])ccc1Cl ZINC000247308723 931144229 /nfs/dbraw/zinc/14/42/29/931144229.db2.gz HTELAORCSPBCGM-UHFFFAOYSA-N 0 0 360.753 3.594 20 5 FHBDRN CCOC(=O)c1ccc(-c2nc(-c3ccc(C)c([N+](=O)[O-])c3)no2)cc1 ZINC000580803771 931175900 /nfs/dbraw/zinc/17/59/00/931175900.db2.gz QNJVDLYJEDARJB-UHFFFAOYSA-N 0 0 353.334 3.797 20 5 FHBDRN O=C(c1cccc([N+](=O)[O-])c1Cl)N1CCCC[C@@H]([C@H]2CCOC2)C1 ZINC000891327852 931216330 /nfs/dbraw/zinc/21/63/30/931216330.db2.gz HWMMGKHNUDDKCL-OLZOCXBDSA-N 0 0 352.818 3.527 20 5 FHBDRN C[C@@H]1C[C@@H](CNC(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)CCO1 ZINC000537764760 931222294 /nfs/dbraw/zinc/22/22/94/931222294.db2.gz WGRMVPMOTSIICE-CABCVRRESA-N 0 0 369.421 3.883 20 5 FHBDRN Cc1ncc(/C=C\C(=O)Nc2ccc([N+](=O)[O-])c(Br)c2)s1 ZINC000588390428 931238170 /nfs/dbraw/zinc/23/81/70/931238170.db2.gz YEJMFJKZRODIGB-HYXAFXHYSA-N 0 0 368.212 3.774 20 5 FHBDRN Cc1nc(N(C)CCCc2cc(-c3ccc(F)cc3)n[nH]2)ccc1[N+](=O)[O-] ZINC000471624380 931250347 /nfs/dbraw/zinc/25/03/47/931250347.db2.gz CHVUEZGSGPSVEX-UHFFFAOYSA-N 0 0 369.400 3.896 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)c2cccc(OC(F)F)c2)cc1[N+](=O)[O-] ZINC000177840437 931262360 /nfs/dbraw/zinc/26/23/60/931262360.db2.gz ZZXSLZACIVHLBF-LLVKDONJSA-N 0 0 350.321 3.996 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)c2cnc(-c3ccccc3)nc2)cc1[N+](=O)[O-] ZINC000177835823 931264580 /nfs/dbraw/zinc/26/45/80/931264580.db2.gz YYNYWSINLRYKMQ-CQSZACIVSA-N 0 0 362.389 3.851 20 5 FHBDRN CCOc1ccc(OCC(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000177838855 931267643 /nfs/dbraw/zinc/26/76/43/931267643.db2.gz CPFYKIHKOACQPF-AWEZNQCLSA-N 0 0 358.394 3.558 20 5 FHBDRN CCOc1ccc(OCC(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000177838869 931267864 /nfs/dbraw/zinc/26/78/64/931267864.db2.gz CPFYKIHKOACQPF-CQSZACIVSA-N 0 0 358.394 3.558 20 5 FHBDRN CCOCC(C)(C)CNC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000580858850 931274936 /nfs/dbraw/zinc/27/49/36/931274936.db2.gz ATFGRFBSSNXEJL-UHFFFAOYSA-N 0 0 360.863 3.519 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)Cc2ccccc2OC(F)F)cc1[N+](=O)[O-] ZINC000177850275 931290778 /nfs/dbraw/zinc/29/07/78/931290778.db2.gz DTBUQQUGKZRLJO-GFCCVEGCSA-N 0 0 364.348 3.925 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)Cc2cnn(-c3ccccc3)c2)cc1[N+](=O)[O-] ZINC000177850465 931290950 /nfs/dbraw/zinc/29/09/50/931290950.db2.gz JIMAIIKJVLNVOU-HNNXBMFYSA-N 0 0 364.405 3.509 20 5 FHBDRN CCc1ccccc1NC(=O)[C@H](C)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000580880757 931296374 /nfs/dbraw/zinc/29/63/74/931296374.db2.gz FAIIVIADEJVIPU-HNNXBMFYSA-N 0 0 355.438 3.659 20 5 FHBDRN Cc1cc(F)cc(C(=O)NCCc2csc(C(C)(C)C)n2)c1[N+](=O)[O-] ZINC000160674014 931296417 /nfs/dbraw/zinc/29/64/17/931296417.db2.gz VYYMAIBABLTZMY-UHFFFAOYSA-N 0 0 365.430 3.769 20 5 FHBDRN CO[C@@H](c1ccc(F)cc1)[C@H](C)NC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc21 ZINC000537835175 931312169 /nfs/dbraw/zinc/31/21/69/931312169.db2.gz YFOZNOJFXYLMNC-BBATYDOGSA-N 0 0 371.368 3.721 20 5 FHBDRN COc1cc(C(=O)N[C@H](C)c2cccc(C)c2C)cc([N+](=O)[O-])c1OC ZINC000610176446 931324660 /nfs/dbraw/zinc/32/46/60/931324660.db2.gz MGGQOBXUQBQBDE-CYBMUJFWSA-N 0 0 358.394 3.720 20 5 FHBDRN CCn1c(NC(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)nc2cccnc21 ZINC000476987065 931336438 /nfs/dbraw/zinc/33/64/38/931336438.db2.gz VSGYNHSKLUZFRZ-UHFFFAOYSA-N 0 0 367.409 3.909 20 5 FHBDRN CSc1ccc(C(=O)N2CCCC[C@@H]([C@H]3CCOC3)C2)cc1[N+](=O)[O-] ZINC000891343205 931347526 /nfs/dbraw/zinc/34/75/26/931347526.db2.gz SRIMORYTOBPJBX-CABCVRRESA-N 0 0 364.467 3.596 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1Cl)N1CCCC[C@@H]([C@H]2CCOC2)C1 ZINC000891343395 931355522 /nfs/dbraw/zinc/35/55/22/931355522.db2.gz WBZLZTCWWWSKNW-OLZOCXBDSA-N 0 0 352.818 3.527 20 5 FHBDRN COc1cccc(C[C@H]2CCCN2C(=O)[C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000580926724 931358080 /nfs/dbraw/zinc/35/80/80/931358080.db2.gz MGBZRZGBPNUHFL-CRAIPNDOSA-N 0 0 368.433 3.941 20 5 FHBDRN CCOc1ccc([C@@H](C)NC(=O)Cc2ccccc2[N+](=O)[O-])cc1OCC ZINC000060387859 931366946 /nfs/dbraw/zinc/36/69/46/931366946.db2.gz WUDXWUYOALEFEP-CQSZACIVSA-N 0 0 372.421 3.812 20 5 FHBDRN CN1C(=O)c2cc(Br)ccc2N[C@H]1c1csc([N+](=O)[O-])c1 ZINC000135076419 931367015 /nfs/dbraw/zinc/36/70/15/931367015.db2.gz UYJUOPZURNJVLT-GFCCVEGCSA-N 0 0 368.212 3.615 20 5 FHBDRN CCC1(CC)[C@@H](OC)C[C@@H]1N(C)c1ncnc2sc([N+](=O)[O-])cc21 ZINC000561261584 931371891 /nfs/dbraw/zinc/37/18/91/931371891.db2.gz XLDJBMNOGMBBCB-RYUDHWBXSA-N 0 0 350.444 3.629 20 5 FHBDRN C[C@@]1(c2ccccc2)CN(C(=O)c2ccc([N+](=O)[O-])cc2Cl)CCO1 ZINC000156695912 931377509 /nfs/dbraw/zinc/37/75/09/931377509.db2.gz KEBZILHVXHPKKA-SFHVURJKSA-N 0 0 360.797 3.636 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)c2ccc(Br)cn2)cc1[N+](=O)[O-] ZINC000177865856 931390096 /nfs/dbraw/zinc/39/00/96/931390096.db2.gz AEZPNJGRAAIKBR-SNVBAGLBSA-N 0 0 364.199 3.552 20 5 FHBDRN COc1cc(CCC(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc(OC)c1 ZINC000177864350 931391812 /nfs/dbraw/zinc/39/18/12/931391812.db2.gz UYQOUQCMTDZNFB-CQSZACIVSA-N 0 0 372.421 3.730 20 5 FHBDRN C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)NC(C)(C)C3CC3)cc2[N+](=O)[O-])C1 ZINC000610183948 931401351 /nfs/dbraw/zinc/40/13/51/931401351.db2.gz ZQHVQLVFJAHRQL-ZIAGYGMSSA-N 0 0 359.470 3.996 20 5 FHBDRN CCOc1cc(CN(C)c2ccc([N+](=O)[O-])c(C)n2)ccc1OC(F)F ZINC000471633153 931406224 /nfs/dbraw/zinc/40/62/24/931406224.db2.gz IQWMTRUFJUIWRP-UHFFFAOYSA-N 0 0 367.352 3.935 20 5 FHBDRN COc1ccc(NC(=O)c2ccn(-c3cccc(Cl)c3)n2)c([N+](=O)[O-])c1 ZINC000119360293 931444925 /nfs/dbraw/zinc/44/49/25/931444925.db2.gz KTIUBHWSOKKWGA-UHFFFAOYSA-N 0 0 372.768 3.695 20 5 FHBDRN CC(C)(C)OC(=O)N1Cc2ccc(CNc3ccc([N+](=O)[O-])nc3)cc2C1 ZINC000827980082 931516522 /nfs/dbraw/zinc/51/65/22/931516522.db2.gz ZXZPWSHZDGUAJB-UHFFFAOYSA-N 0 0 370.409 3.853 20 5 FHBDRN CC(F)(F)c1cccc(NC(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)c1 ZINC000187355479 931548279 /nfs/dbraw/zinc/54/82/79/931548279.db2.gz LEEPMBBSCOLPKM-UHFFFAOYSA-N 0 0 373.319 3.540 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCN(c3ccc4ccc(Cl)cc4n3)CC2)cn1 ZINC000548153518 931561920 /nfs/dbraw/zinc/56/19/20/931561920.db2.gz OACLESBPDZHNRP-UHFFFAOYSA-N 0 0 369.812 3.518 20 5 FHBDRN O=[N+]([O-])c1ncccc1N1CCO[C@@H](c2cccc(C(F)(F)F)c2)C1 ZINC000610480091 931578640 /nfs/dbraw/zinc/57/86/40/931578640.db2.gz JIOZKYISFRIMME-CQSZACIVSA-N 0 0 353.300 3.587 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1CN1CCN(c2nccc3sccc32)CC1 ZINC000581123878 931586124 /nfs/dbraw/zinc/58/61/24/931586124.db2.gz OCYDVMATHOSIKB-UHFFFAOYSA-N 0 0 368.462 3.835 20 5 FHBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])c1ccnc(-c2ccco2)c1 ZINC001266677982 931610577 /nfs/dbraw/zinc/61/05/77/931610577.db2.gz UERFDJBKEBWPSN-UHFFFAOYSA-N 0 0 371.780 3.876 20 5 FHBDRN C[C@@H]1C[C@@H](c2ccccc2)N(C(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)C1 ZINC000581156090 931628277 /nfs/dbraw/zinc/62/82/77/931628277.db2.gz CLLMHBWFJKSGCL-DYVFJYSZSA-N 0 0 368.389 3.589 20 5 FHBDRN Cc1ccc(NC(=O)N2CCCN3c4ccccc4C[C@H]3C2)cc1[N+](=O)[O-] ZINC000581159722 931629997 /nfs/dbraw/zinc/62/99/97/931629997.db2.gz UZSDLWJSZALHDF-KRWDZBQOSA-N 0 0 366.421 3.572 20 5 FHBDRN Cn1c(C(=O)OCc2csc(-c3ccccc3F)n2)ccc1[N+](=O)[O-] ZINC000728319531 931642349 /nfs/dbraw/zinc/64/23/49/931642349.db2.gz DJBHDMXBOUUPOJ-UHFFFAOYSA-N 0 0 361.354 3.553 20 5 FHBDRN CCn1c(C)nc([N+](=O)[O-])c1Sc1nccn1Cc1ccc(OC)cc1 ZINC000581211303 931682347 /nfs/dbraw/zinc/68/23/47/931682347.db2.gz FWRGTTZZPUTUHI-UHFFFAOYSA-N 0 0 373.438 3.524 20 5 FHBDRN COC1(C)CCN(C(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)CC1 ZINC000276051811 931687262 /nfs/dbraw/zinc/68/72/62/931687262.db2.gz ZAGMDNIFDOYWOG-UHFFFAOYSA-N 0 0 350.418 3.735 20 5 FHBDRN Cc1ccc(SCC(F)(F)F)c(NC(=O)c2cc([N+](=O)[O-])nn2C)c1 ZINC000477025818 931710864 /nfs/dbraw/zinc/71/08/64/931710864.db2.gz PJJUZHMJCINODA-UHFFFAOYSA-N 0 0 374.344 3.543 20 5 FHBDRN COCCCOc1cc(C)ccc1CNC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000127168746 931728938 /nfs/dbraw/zinc/72/89/38/931728938.db2.gz VIMWZQISPNYYSE-UHFFFAOYSA-N 0 0 373.409 3.640 20 5 FHBDRN C[C@@H](c1cccc(Cl)c1F)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000548157216 931769751 /nfs/dbraw/zinc/76/97/51/931769751.db2.gz HRKKEZOCQYWDTD-LBPRGKRZSA-N 0 0 364.808 3.666 20 5 FHBDRN Cc1cc(OCC(=O)Nc2cccc(N(C)C(C)C)c2)ccc1[N+](=O)[O-] ZINC000430547770 931778894 /nfs/dbraw/zinc/77/88/94/931778894.db2.gz FZYJTESWSMOWEI-UHFFFAOYSA-N 0 0 357.410 3.765 20 5 FHBDRN CCN(C(=O)c1cc(OC)c(OC)c([N+](=O)[O-])c1)c1ccccc1Cl ZINC000581283478 931782594 /nfs/dbraw/zinc/78/25/94/931782594.db2.gz YSRNRHOFSPSQJS-UHFFFAOYSA-N 0 0 364.785 3.932 20 5 FHBDRN CCOc1cc(C(=O)N[C@H]2CCCCC2(C)C)c([N+](=O)[O-])cc1OC ZINC000157061114 931815255 /nfs/dbraw/zinc/81/52/55/931815255.db2.gz HRPOOANXEWLNFK-INIZCTEOSA-N 0 0 350.415 3.701 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1NCc1ccccc1)N1CCC[C@H]1CF ZINC000581329784 931842145 /nfs/dbraw/zinc/84/21/45/931842145.db2.gz FMROYEWQLRQIJQ-INIZCTEOSA-N 0 0 357.385 3.781 20 5 FHBDRN O=C(c1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CC[C@@H]2[C@H]1[C@H]2C(F)(F)F ZINC000610494676 931852867 /nfs/dbraw/zinc/85/28/67/931852867.db2.gz KMHYGQRYJPXQHC-LSJOCFKGSA-N 0 0 368.233 3.636 20 5 FHBDRN C[C@@H](CNC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C1CCCCC1 ZINC000581381361 931922933 /nfs/dbraw/zinc/92/29/33/931922933.db2.gz ZNAKYZYSMIMPDE-NSHDSACASA-N 0 0 367.833 3.519 20 5 FHBDRN Cc1ccc(C(=O)NC2CCN(c3ccc(F)cc3[N+](=O)[O-])CC2)s1 ZINC000050954834 931926407 /nfs/dbraw/zinc/92/64/07/931926407.db2.gz HOTWRGFHRFFYCX-UHFFFAOYSA-N 0 0 363.414 3.503 20 5 FHBDRN COc1ccc(C(=O)COc2cc(Cl)ccc2[N+](=O)[O-])c(OC)c1 ZINC000121304509 931944861 /nfs/dbraw/zinc/94/48/61/931944861.db2.gz FXMAAJNPSAPGQV-UHFFFAOYSA-N 0 0 351.742 3.527 20 5 FHBDRN C[C@@H]1CN(c2cc(C(F)(F)C(F)(F)F)ncc2[N+](=O)[O-])CC(C)(C)O1 ZINC000581409461 931985048 /nfs/dbraw/zinc/98/50/48/931985048.db2.gz QWEPFZKGTJZXAI-MRVPVSSYSA-N 0 0 369.290 3.648 20 5 FHBDRN COc1ccc(CC(=O)NC[C@H]2CCCC[C@@H]2C(F)(F)F)cc1[N+](=O)[O-] ZINC000610503511 931998652 /nfs/dbraw/zinc/99/86/52/931998652.db2.gz CPKPVLPMMNGTMX-OLZOCXBDSA-N 0 0 374.359 3.631 20 5 FHBDRN CC[C@@H]1CN(c2cc(C)c(C(F)(F)F)cc2[N+](=O)[O-])C[C@]2(CCOC2)O1 ZINC000581417171 932014970 /nfs/dbraw/zinc/01/49/70/932014970.db2.gz GUDSILNPSPYBOT-WBMJQRKESA-N 0 0 374.359 3.696 20 5 FHBDRN COC(=O)c1cc(C(=O)N2CCCCC[C@@H]2c2ccco2)cc([N+](=O)[O-])c1 ZINC000135166026 932019539 /nfs/dbraw/zinc/01/95/39/932019539.db2.gz VHGJCZIVHCCHST-MRXNPFEDSA-N 0 0 372.377 3.732 20 5 FHBDRN CC(C)(C)[C@@H]1OCCC[C@H]1CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000135169074 932021628 /nfs/dbraw/zinc/02/16/28/932021628.db2.gz CACNMAMQXTWPPK-ORAYPTAESA-N 0 0 373.453 3.576 20 5 FHBDRN O=C(Nc1ccc(F)cc1-c1nc(C2CC2)no1)c1ccc([N+](=O)[O-])o1 ZINC000471653365 932029035 /nfs/dbraw/zinc/02/90/35/932029035.db2.gz JNWMGUGJSASPPB-UHFFFAOYSA-N 0 0 358.285 3.507 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])N1CC[C@@H](Cc2ccc(F)cc2)C1 ZINC000135188261 932042222 /nfs/dbraw/zinc/04/22/22/932042222.db2.gz YVJDAAJNGABLLX-INIZCTEOSA-N 0 0 372.396 3.594 20 5 FHBDRN COc1ccc(CNc2ncc([N+](=O)[O-])c(C)c2Br)cc1 ZINC000165711565 932042674 /nfs/dbraw/zinc/04/26/74/932042674.db2.gz LLOBPBGVASUVDZ-UHFFFAOYSA-N 0 0 352.188 3.681 20 5 FHBDRN COc1ccccc1C[C@H](C)N(C)C(=O)/C=C\c1ccc([N+](=O)[O-])cc1 ZINC000255303055 932043948 /nfs/dbraw/zinc/04/39/48/932043948.db2.gz GYVQWSHGPCGUAT-WVUXNXBLSA-N 0 0 354.406 3.706 20 5 FHBDRN O=C(c1cc(F)c(F)cc1[N+](=O)[O-])N1CCCc2c(F)ccc(F)c21 ZINC000178000091 932059937 /nfs/dbraw/zinc/05/99/37/932059937.db2.gz IBEORDGQZWKJKJ-UHFFFAOYSA-N 0 0 354.259 3.744 20 5 FHBDRN Cc1ccc(NC(=O)CN(Cc2ccccc2[N+](=O)[O-])C2CC2)c(C)c1 ZINC000135228820 932076867 /nfs/dbraw/zinc/07/68/67/932076867.db2.gz LRYQAPHTWAKQND-UHFFFAOYSA-N 0 0 353.422 3.815 20 5 FHBDRN Cc1c(Br)c(NCCOC2CCCCC2)ncc1[N+](=O)[O-] ZINC000165766800 932079191 /nfs/dbraw/zinc/07/91/91/932079191.db2.gz XJGNIHNTXOGTDJ-UHFFFAOYSA-N 0 0 358.236 3.822 20 5 FHBDRN COc1cc(C(=O)N2C[C@H](c3ccc(F)cc3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000135246611 932096400 /nfs/dbraw/zinc/09/64/00/932096400.db2.gz IWTLLMDTCPCIOV-SWLSCSKDSA-N 0 0 358.369 3.761 20 5 FHBDRN Cc1ccc(-c2nc(CCNC(=O)c3ccc(F)cc3[N+](=O)[O-])co2)cc1 ZINC000135263036 932112053 /nfs/dbraw/zinc/11/20/53/932112053.db2.gz SCJDIZNXHPKWLY-UHFFFAOYSA-N 0 0 369.352 3.670 20 5 FHBDRN CN(Cc1nc2ccccc2s1)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000023850677 932127865 /nfs/dbraw/zinc/12/78/65/932127865.db2.gz WMRQXCWQOVAAJV-UHFFFAOYSA-N 0 0 353.407 3.644 20 5 FHBDRN CC(C)[C@@H](NC(=O)COc1ccccc1[N+](=O)[O-])c1ccc(F)cc1F ZINC000119387010 932178843 /nfs/dbraw/zinc/17/88/43/932178843.db2.gz ZMIGHURHAXJMIO-GOSISDBHSA-N 0 0 364.348 3.765 20 5 FHBDRN O=C(NC1CC1)c1ccc(N2CC[C@@](F)(c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000561487143 932210481 /nfs/dbraw/zinc/21/04/81/932210481.db2.gz VGXWSIXLTCEDNF-FQEVSTJZSA-N 0 0 369.396 3.562 20 5 FHBDRN CC(=O)N(C)c1ccc(NC(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000078530282 932215981 /nfs/dbraw/zinc/21/59/81/932215981.db2.gz LNEFKIOTYSUKPH-ZDUSSCGKSA-N 0 0 370.409 3.769 20 5 FHBDRN CC1(C)[C@H](C(F)(F)F)CCN1C(=O)c1c[nH]c2ccc([N+](=O)[O-])cc21 ZINC000276357489 932253983 /nfs/dbraw/zinc/25/39/83/932253983.db2.gz OYHVJHMCVDXHFI-CYBMUJFWSA-N 0 0 355.316 3.879 20 5 FHBDRN O=C(NCc1cccc([N+](=O)[O-])c1)NC[C@@H]1CCCC[C@H]1C(F)(F)F ZINC000610509878 932255116 /nfs/dbraw/zinc/25/51/16/932255116.db2.gz VVEVHQDGUTYFBA-GXTWGEPZSA-N 0 0 359.348 3.763 20 5 FHBDRN CSc1ccc(C(=O)Nc2cn(C)nc2-c2ccccc2)cc1[N+](=O)[O-] ZINC000538035429 932260281 /nfs/dbraw/zinc/26/02/81/932260281.db2.gz ZZKQDAYEBMEGHP-UHFFFAOYSA-N 0 0 368.418 3.970 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)C(=O)Nc2ccc(C(C)C)cc2)cc1[N+](=O)[O-] ZINC000178068091 932271408 /nfs/dbraw/zinc/27/14/08/932271408.db2.gz FDQRXXOVAJBTBG-CQSZACIVSA-N 0 0 369.421 3.843 20 5 FHBDRN O=[N+]([O-])c1cccc(F)c1CN1CCc2c(ncn2-c2ccc(F)cc2)C1 ZINC000510433555 932275539 /nfs/dbraw/zinc/27/55/39/932275539.db2.gz DROBEUWCZHESFL-UHFFFAOYSA-N 0 0 370.359 3.617 20 5 FHBDRN COc1ccc(C)cc1CNc1ncc([N+](=O)[O-])cc1Br ZINC000610512206 932288177 /nfs/dbraw/zinc/28/81/77/932288177.db2.gz OWBYZGYPTZFDMQ-UHFFFAOYSA-N 0 0 352.188 3.681 20 5 FHBDRN Cc1ccc(C)c(OCc2nnc(Sc3ccc([N+](=O)[O-])cn3)o2)c1 ZINC000022419896 932325358 /nfs/dbraw/zinc/32/53/58/932325358.db2.gz XYPNSLAOWONYJR-UHFFFAOYSA-N 0 0 358.379 3.720 20 5 FHBDRN Cc1c(NC(=O)NCc2cccc([N+](=O)[O-])c2)cnn1-c1ccccc1F ZINC000157326832 932332585 /nfs/dbraw/zinc/33/25/85/932332585.db2.gz USYTXXHCKMWBTD-UHFFFAOYSA-N 0 0 369.356 3.550 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)c1ccn(C2CCCCC2)n1 ZINC000581624175 932334703 /nfs/dbraw/zinc/33/47/03/932334703.db2.gz WTZSHOLIKVSEMI-UHFFFAOYSA-N 0 0 356.426 3.611 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)Nc1ccc2c(c1)C(=O)CCC2 ZINC000477131027 932345838 /nfs/dbraw/zinc/34/58/38/932345838.db2.gz CKSJFZGTLGCAIS-UHFFFAOYSA-N 0 0 367.405 3.820 20 5 FHBDRN Cc1cc(NCc2nnc(C(C)C)n2C)c(Br)cc1[N+](=O)[O-] ZINC000276405639 932357474 /nfs/dbraw/zinc/35/74/74/932357474.db2.gz AJPNBAHMKZIHAH-UHFFFAOYSA-N 0 0 368.235 3.530 20 5 FHBDRN Cc1ccc(-c2nc(-c3ccc(Br)o3)no2)cc1[N+](=O)[O-] ZINC000477166279 932362361 /nfs/dbraw/zinc/36/23/61/932362361.db2.gz UPIQQLMPKUHTOD-UHFFFAOYSA-N 0 0 350.128 3.976 20 5 FHBDRN COc1ccc(C(=O)Nc2ccc(-c3coc(C)n3)cc2)cc1[N+](=O)[O-] ZINC000933343659 932363101 /nfs/dbraw/zinc/36/31/01/932363101.db2.gz IFSUNSROOVQBPL-UHFFFAOYSA-N 0 0 353.334 3.819 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N[C@@H](Cc1ccccc1)C1CC1 ZINC000135265036 932367241 /nfs/dbraw/zinc/36/72/41/932367241.db2.gz PCUVPLLLYQLABS-FQEVSTJZSA-N 0 0 363.417 3.756 20 5 FHBDRN COc1ccc(S(=O)(=O)N(C)c2ccc(C(C)C)cc2)c([N+](=O)[O-])c1 ZINC000477177165 932374276 /nfs/dbraw/zinc/37/42/76/932374276.db2.gz JKRSNUYJFDWYBC-UHFFFAOYSA-N 0 0 364.423 3.552 20 5 FHBDRN CN(Cc1ccc(Cl)cc1Cl)C(=O)c1cccc([N+](=O)[O-])c1N ZINC000610519888 932377379 /nfs/dbraw/zinc/37/73/79/932377379.db2.gz KRERRHSMRSHTCO-UHFFFAOYSA-N 0 0 354.193 3.756 20 5 FHBDRN Cc1cc(NC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])ccc1O ZINC000157359898 932384068 /nfs/dbraw/zinc/38/40/68/932384068.db2.gz QRAFOHOJWGXHCV-UHFFFAOYSA-N 0 0 350.758 3.670 20 5 FHBDRN Cc1ccc(Cl)c(NS(=O)(=O)CCc2ccccc2[N+](=O)[O-])c1 ZINC000157354936 932384175 /nfs/dbraw/zinc/38/41/75/932384175.db2.gz ZQAATQNAHAZVJZ-UHFFFAOYSA-N 0 0 354.815 3.541 20 5 FHBDRN COc1cc(/C=C/c2ccncn2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000157351557 932384244 /nfs/dbraw/zinc/38/42/44/932384244.db2.gz LXQBRRWAPUMOSA-NSCUHMNNSA-N 0 0 355.272 3.505 20 5 FHBDRN Cc1ccc(NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)cc1-c1ncco1 ZINC000127217586 932409075 /nfs/dbraw/zinc/40/90/75/932409075.db2.gz RWSIYRYKTWJPQR-UHFFFAOYSA-N 0 0 363.333 3.687 20 5 FHBDRN O=c1c(Cl)c(NCCC2=CCCC2)cnn1-c1ccc([N+](=O)[O-])cc1 ZINC000157438045 932531053 /nfs/dbraw/zinc/53/10/53/932531053.db2.gz ZLRFLWZRDCJTIK-UHFFFAOYSA-N 0 0 360.801 3.706 20 5 FHBDRN COc1ccc(Cl)cc1CNC(=O)C1(c2ccc([N+](=O)[O-])cc2)CCC1 ZINC001125528489 932538675 /nfs/dbraw/zinc/53/86/75/932538675.db2.gz OUOGCFQOXBOGOC-UHFFFAOYSA-N 0 0 374.824 3.995 20 5 FHBDRN Cc1noc(C)c1[C@@H](C)NC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000121461426 932582764 /nfs/dbraw/zinc/58/27/64/932582764.db2.gz NPYFBOJWVXQTRS-LLVKDONJSA-N 0 0 358.398 3.635 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N[C@H](C)C[C@H](O)c1cccs1 ZINC000276542862 932613214 /nfs/dbraw/zinc/61/32/14/932613214.db2.gz GMHGRMLAKNSVSL-MFKMUULPSA-N 0 0 368.842 3.860 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N1CCc2[nH]c3ccc(C)cc3c2C1 ZINC000023134806 932618999 /nfs/dbraw/zinc/61/89/99/932618999.db2.gz JPOYKOUAWGZZNU-UHFFFAOYSA-N 0 0 365.389 3.592 20 5 FHBDRN Cc1onc(-c2ccccn2)c1C(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000127288783 932622658 /nfs/dbraw/zinc/62/26/58/932622658.db2.gz NJFIGADJUZNQLQ-LBPRGKRZSA-N 0 0 366.377 3.753 20 5 FHBDRN CC(C)(C)n1cc(NC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])cn1 ZINC000477497295 932654356 /nfs/dbraw/zinc/65/43/56/932654356.db2.gz ICYGETFPWDOVGI-UHFFFAOYSA-N 0 0 365.821 3.564 20 5 FHBDRN C[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000157932069 932657215 /nfs/dbraw/zinc/65/72/15/932657215.db2.gz GLVKRNPEZZOSHS-FMKPAKJESA-N 0 0 354.410 3.574 20 5 FHBDRN COC(=O)c1cc(C(=O)N(C)[C@H]2CCCc3ccccc32)cc([N+](=O)[O-])c1 ZINC000023151987 932670411 /nfs/dbraw/zinc/67/04/11/932670411.db2.gz DEDAVZMTBKIFIG-SFHVURJKSA-N 0 0 368.389 3.531 20 5 FHBDRN C[C@@H](OC(=O)Cc1cccc([N+](=O)[O-])c1)c1nc2ccc(Cl)cc2n1C ZINC000176025957 932675229 /nfs/dbraw/zinc/67/52/29/932675229.db2.gz OJJWDVXPIIMOIO-LLVKDONJSA-N 0 0 373.796 3.982 20 5 FHBDRN CN(Cc1cccc(OC(F)(F)F)c1)C(=O)c1ccc([N+](=O)[O-])cc1F ZINC000127303739 932683698 /nfs/dbraw/zinc/68/36/98/932683698.db2.gz GIIQMLHHEVUXSN-UHFFFAOYSA-N 0 0 372.274 3.905 20 5 FHBDRN CN(Cc1cc(Br)cs1)C(=O)c1ccc(F)cc1[N+](=O)[O-] ZINC000121468973 932683806 /nfs/dbraw/zinc/68/38/06/932683806.db2.gz AMPIQSGORUTZQG-UHFFFAOYSA-N 0 0 373.203 3.830 20 5 FHBDRN CCOC(=O)c1sc(CNc2ccc([N+](=O)[O-])c3cccnc23)nc1C ZINC000610542273 932729039 /nfs/dbraw/zinc/72/90/39/932729039.db2.gz NNAVROHCMGQZQL-UHFFFAOYSA-N 0 0 372.406 3.697 20 5 FHBDRN Cc1cccn(Cc2c(F)cccc2NCc2csc([N+](=O)[O-])c2)c1=O ZINC000581846774 932733368 /nfs/dbraw/zinc/73/33/68/932733368.db2.gz GNRPKSRLPMSXIC-UHFFFAOYSA-N 0 0 373.409 3.926 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)NCC1(CCO)CCCCC1 ZINC000276578960 932733885 /nfs/dbraw/zinc/73/38/85/932733885.db2.gz LHZXJTYWTSMPNU-UHFFFAOYSA-N 0 0 354.834 3.619 20 5 FHBDRN O=[N+]([O-])c1c(N[C@@H](C[C@@H]2CCOC2)c2ccccc2)nc2sccn21 ZINC000157962641 932735839 /nfs/dbraw/zinc/73/58/39/932735839.db2.gz WQNLYRCIUKWMJO-JSGCOSHPSA-N 0 0 358.423 3.884 20 5 FHBDRN COc1cc(C(=O)N[C@H]2c3cccc(F)c3CC[C@H]2C)ccc1[N+](=O)[O-] ZINC000430663532 932743783 /nfs/dbraw/zinc/74/37/83/932743783.db2.gz KBMZXMFUHCUEDC-ADLMAVQZSA-N 0 0 358.369 3.796 20 5 FHBDRN COc1ccc(CC[C@H](C)NC(=O)c2cc([N+](=O)[O-])c(C)cc2C)cc1 ZINC001125535954 932746735 /nfs/dbraw/zinc/74/67/35/932746735.db2.gz FZGHEXWWAHUAFX-HNNXBMFYSA-N 0 0 356.422 3.971 20 5 FHBDRN CSc1ccccc1CN(C)C(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000471740743 932757717 /nfs/dbraw/zinc/75/77/17/932757717.db2.gz YMEZSBCIZOJNNN-UHFFFAOYSA-N 0 0 359.451 3.701 20 5 FHBDRN Cc1cn(-c2ccccc2)nc1C(=O)N1c2ccc([N+](=O)[O-])cc2C[C@H]1C ZINC000471741131 932761093 /nfs/dbraw/zinc/76/10/93/932761093.db2.gz ZRVACVPZOKNCSS-CQSZACIVSA-N 0 0 362.389 3.680 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(NC2CCN(Cc3ccc(F)c(F)c3)CC2)n1 ZINC000178179191 932762661 /nfs/dbraw/zinc/76/26/61/932762661.db2.gz XSTXSHWYTQOXBU-UHFFFAOYSA-N 0 0 362.380 3.653 20 5 FHBDRN Cc1nc(C(F)(F)F)ccc1NC(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000512381974 932772101 /nfs/dbraw/zinc/77/21/01/932772101.db2.gz XXPFKMATJCVWJR-UHFFFAOYSA-N 0 0 368.315 3.758 20 5 FHBDRN C[C@H]1CN(S(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc21 ZINC000121474057 932779648 /nfs/dbraw/zinc/77/96/48/932779648.db2.gz FMPCTTVEMOATDF-JTQLQIEISA-N 0 0 352.799 3.561 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NC[C@H](C)COCc1ccccc1 ZINC001125537217 932783329 /nfs/dbraw/zinc/78/33/29/932783329.db2.gz VJTXCVSHMQLXEC-AWEZNQCLSA-N 0 0 356.422 3.794 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)CCc1nnc(C2CCCC2)o1 ZINC000156402329 932785883 /nfs/dbraw/zinc/78/58/83/932785883.db2.gz CQEKOJVEDNRXBJ-UHFFFAOYSA-N 0 0 358.398 3.824 20 5 FHBDRN COc1ccc(N(C(=O)c2cccc([N+](=O)[O-])c2N)[C@@H](C)C2CC2)cc1 ZINC000178184083 932798925 /nfs/dbraw/zinc/79/89/25/932798925.db2.gz KNMCCUJCJCWXAQ-LBPRGKRZSA-N 0 0 355.394 3.631 20 5 FHBDRN Cc1cc2n[nH]cc2cc1NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000276628770 932811872 /nfs/dbraw/zinc/81/18/72/932811872.db2.gz BEDPFPKIEFOJJP-UHFFFAOYSA-N 0 0 365.393 3.632 20 5 FHBDRN O=[N+]([O-])c1cc2ccccc2nc1N1CCC[C@H](c2nnc3ccccn32)C1 ZINC000276628821 932812241 /nfs/dbraw/zinc/81/22/41/932812241.db2.gz NWKSZLVJLKBREE-HNNXBMFYSA-N 0 0 374.404 3.570 20 5 FHBDRN COc1ccc(/C=C\C(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)cc1OC ZINC000255370209 932834185 /nfs/dbraw/zinc/83/41/85/932834185.db2.gz RAPCKXBOIYLPNW-VURMDHGXSA-N 0 0 356.378 3.881 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])Nc1ccc(F)c(Br)c1 ZINC000135310358 932836523 /nfs/dbraw/zinc/83/65/23/932836523.db2.gz UPBWWVXTFCGZON-UHFFFAOYSA-N 0 0 353.147 3.678 20 5 FHBDRN CCOc1ccc(Cl)cc1CCNC(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000157973777 932838422 /nfs/dbraw/zinc/83/84/22/932838422.db2.gz IKIRVGLLWCGGLH-UHFFFAOYSA-N 0 0 362.813 3.548 20 5 FHBDRN COc1ccc(C(=O)N[C@@H]2c3cccc(F)c3CC[C@@H]2C)cc1[N+](=O)[O-] ZINC000430672115 932853471 /nfs/dbraw/zinc/85/34/71/932853471.db2.gz YMRMQSSLTUIMQU-VOJFVSQTSA-N 0 0 358.369 3.796 20 5 FHBDRN O=C(CO[C@H]1CCCc2ccccc21)N1CCc2c1cccc2[N+](=O)[O-] ZINC000430680685 932873052 /nfs/dbraw/zinc/87/30/52/932873052.db2.gz PJXBBUOEOSTLCT-IBGZPJMESA-N 0 0 352.390 3.578 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)NC[C@@H]1CCN(c2ccccc2)C1 ZINC000276670287 932880713 /nfs/dbraw/zinc/88/07/13/932880713.db2.gz ZASUZZOTWXWJJA-AWEZNQCLSA-N 0 0 373.840 3.813 20 5 FHBDRN Cc1ccccc1[C@H](NC(=O)COc1ccc([N+](=O)[O-])c(C)c1)C1CC1 ZINC000430681627 932895157 /nfs/dbraw/zinc/89/51/57/932895157.db2.gz FGUZCGFIMUCHRB-HXUWFJFHSA-N 0 0 354.406 3.858 20 5 FHBDRN COCCC1(CNC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)CCCCC1 ZINC000187475574 932910187 /nfs/dbraw/zinc/91/01/87/932910187.db2.gz LYAZZFOBBLWNPY-UHFFFAOYSA-N 0 0 359.426 3.793 20 5 FHBDRN Cn1cc(CCNC(=O)CCc2cccc([N+](=O)[O-])c2)c2ccc(F)cc21 ZINC000187475329 932910229 /nfs/dbraw/zinc/91/02/29/932910229.db2.gz POLUCFVTMHLTBN-UHFFFAOYSA-N 0 0 369.396 3.517 20 5 FHBDRN Cc1c(NC(=O)[C@H](C)Nc2cnn([C@H](C)C3CC3)c2)cccc1[N+](=O)[O-] ZINC000187475462 932910394 /nfs/dbraw/zinc/91/03/94/932910394.db2.gz XSUYPGPCAMMCBB-QWHCGFSZSA-N 0 0 357.414 3.510 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@H](C)c1ccc(F)c2ccccc21 ZINC000561629562 932922743 /nfs/dbraw/zinc/92/27/43/932922743.db2.gz RTNSURHLSSQXKA-GFCCVEGCSA-N 0 0 370.384 3.660 20 5 FHBDRN COc1ccc(CN(C)C(=O)/C(C)=C\c2ccc([N+](=O)[O-])cc2)c(OC)c1 ZINC000588435613 932933490 /nfs/dbraw/zinc/93/34/90/932933490.db2.gz JVUNJQJJTZRZGL-KAMYIIQDSA-N 0 0 370.405 3.674 20 5 FHBDRN CCOc1ccc(C(=O)N[C@H](C)c2ccc3c(c2)CCC3)cc1[N+](=O)[O-] ZINC001266854774 932951056 /nfs/dbraw/zinc/95/10/56/932951056.db2.gz CEUJKBGFIRNREF-CYBMUJFWSA-N 0 0 354.406 3.973 20 5 FHBDRN CCOCc1ccc(CNC(=O)/C(C)=C\c2ccc([N+](=O)[O-])cc2)cc1 ZINC000588436825 932954260 /nfs/dbraw/zinc/95/42/60/932954260.db2.gz TVYHQGNXAYCCPI-QINSGFPZSA-N 0 0 354.406 3.851 20 5 FHBDRN CNC(=O)c1cc(Cl)ccc1NC(=O)/C(C)=C\c1ccc([N+](=O)[O-])cc1 ZINC000588436816 932959913 /nfs/dbraw/zinc/95/99/13/932959913.db2.gz PGWVORNAOSOGMH-LUAWRHEFSA-N 0 0 373.796 3.650 20 5 FHBDRN COc1ccc([C@H](C)CCNC(=O)COc2ccc([N+](=O)[O-])c(C)c2)cc1 ZINC000430689624 932973811 /nfs/dbraw/zinc/97/38/11/932973811.db2.gz DNHZPQHCEOINHI-CQSZACIVSA-N 0 0 372.421 3.601 20 5 FHBDRN Cc1cc(Br)cc(NC(=O)c2cc([N+](=O)[O-])cnc2C)c1 ZINC000187552917 933001080 /nfs/dbraw/zinc/00/10/80/933001080.db2.gz PTBVJVXPMQVOKM-UHFFFAOYSA-N 0 0 350.172 3.621 20 5 FHBDRN CC(C)c1ccc(CN(C(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)C2CC2)cc1 ZINC000187548343 933001243 /nfs/dbraw/zinc/00/12/43/933001243.db2.gz XNHYEMUVTCEGSF-UHFFFAOYSA-N 0 0 355.394 3.624 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1-c1nc(-c2ccc(Br)o2)no1 ZINC000178268805 933003837 /nfs/dbraw/zinc/00/38/37/933003837.db2.gz CTFFJSPDPBQLPB-UHFFFAOYSA-N 0 0 350.128 3.976 20 5 FHBDRN CCO[C@H](C)c1nc(CN2CCOc3ccc([N+](=O)[O-])cc3C2)cs1 ZINC000581913677 933011768 /nfs/dbraw/zinc/01/17/68/933011768.db2.gz VCGKKACKIZFPKK-GFCCVEGCSA-N 0 0 363.439 3.543 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CCC[C@@H]1CCCc1ccccc1 ZINC000156481123 933036129 /nfs/dbraw/zinc/03/61/29/933036129.db2.gz OMEANEUAHXMMEF-SFHVURJKSA-N 0 0 370.453 3.504 20 5 FHBDRN COCCOc1cc(C)ccc1NC(=O)/C(C)=C\c1ccc([N+](=O)[O-])cc1 ZINC000588438094 933054259 /nfs/dbraw/zinc/05/42/59/933054259.db2.gz ZKZYMCOHWHPCIO-SQFISAMPSA-N 0 0 370.405 3.970 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)OCc1nnc(-c2ccccc2)o1 ZINC000588438145 933054272 /nfs/dbraw/zinc/05/42/72/933054272.db2.gz NMSKIYVAIGWOIP-QBFSEMIESA-N 0 0 365.345 3.792 20 5 FHBDRN CC(=O)Nc1ccc(CCNC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)cc1 ZINC000187621217 933066634 /nfs/dbraw/zinc/06/66/34/933066634.db2.gz MJJHSDBPNCQZFU-UHFFFAOYSA-N 0 0 369.421 3.649 20 5 FHBDRN C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)Nc1cnn([C@@H](C)C2CC2)c1 ZINC000187621907 933066783 /nfs/dbraw/zinc/06/67/83/933066783.db2.gz NHYHZPVFKVLVIA-OLZOCXBDSA-N 0 0 357.414 3.592 20 5 FHBDRN Cc1ccc(-c2noc(C(=O)Nc3ccc(Cl)cc3)n2)cc1[N+](=O)[O-] ZINC000544949960 933067923 /nfs/dbraw/zinc/06/79/23/933067923.db2.gz CRSXPKTZGVHLDB-UHFFFAOYSA-N 0 0 358.741 3.859 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N(CCc1nccs1)C(C)C ZINC000588440998 933071944 /nfs/dbraw/zinc/07/19/44/933071944.db2.gz IPWITDYAYMFAPI-OWBHPGMISA-N 0 0 359.451 3.934 20 5 FHBDRN CCOc1cc2c(cc1OCC)CN(c1cc(C)c([N+](=O)[O-])cn1)CC2 ZINC000074727084 933076802 /nfs/dbraw/zinc/07/68/02/933076802.db2.gz ZVIFZGNHNOHPKV-UHFFFAOYSA-N 0 0 357.410 3.658 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H](O)c1ccc(Cl)cc1 ZINC000588444181 933098367 /nfs/dbraw/zinc/09/83/67/933098367.db2.gz QZWHVCAPQVISAG-XSLBHYSZSA-N 0 0 360.797 3.501 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)Oc1ccc(NC(=O)C2CC2)cc1 ZINC000588444500 933102317 /nfs/dbraw/zinc/10/23/17/933102317.db2.gz OFNXPCMNMZLDPK-SEYXRHQNSA-N 0 0 366.373 3.952 20 5 FHBDRN CSc1ccccc1C(=O)O[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000023982102 933103912 /nfs/dbraw/zinc/10/39/12/933103912.db2.gz XNJVJSBROLNLNM-GFCCVEGCSA-N 0 0 374.418 3.809 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N1CCO[C@@H](c2cccc(F)c2)C1 ZINC000588445131 933110991 /nfs/dbraw/zinc/11/09/91/933110991.db2.gz LGNNSBGQWITMTO-KWRJMZDGSA-N 0 0 370.380 3.737 20 5 FHBDRN CCc1nnc(-c2ccc(NC(=O)NCc3cccc([N+](=O)[O-])c3)cc2)o1 ZINC000176008920 933114254 /nfs/dbraw/zinc/11/42/54/933114254.db2.gz RSYHFGMNTOWBPO-UHFFFAOYSA-N 0 0 367.365 3.529 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N1CCO[C@@H](c2cccs2)C1 ZINC000588446582 933158118 /nfs/dbraw/zinc/15/81/18/933158118.db2.gz QXPPPEYKXIPURA-DVFVSVACSA-N 0 0 358.419 3.660 20 5 FHBDRN Cn1c(C(=O)NCCc2cccc([N+](=O)[O-])c2)ccc1-c1ccc(F)cc1 ZINC001266874802 933159137 /nfs/dbraw/zinc/15/91/37/933159137.db2.gz AXVOVDVZJSKFQT-UHFFFAOYSA-N 0 0 367.380 3.712 20 5 FHBDRN C[C@@H]1CC[C@H](c2ccccc2)N(S(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000510507606 933164371 /nfs/dbraw/zinc/16/43/71/933164371.db2.gz IHPHPXGXSRLPLF-DNVCBOLYSA-N 0 0 374.462 3.898 20 5 FHBDRN C[C@@H]1CC[C@@H](c2ccccc2)N(S(=O)(=O)Cc2cccc([N+](=O)[O-])c2)C1 ZINC000510506652 933168167 /nfs/dbraw/zinc/16/81/67/933168167.db2.gz BEUFXUJSXUSTSE-BEFAXECRSA-N 0 0 374.462 3.898 20 5 FHBDRN C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCSC2(CCCCC2)C1 ZINC000430759754 933212478 /nfs/dbraw/zinc/21/24/78/933212478.db2.gz FTFXHUUECVJQMO-CQSZACIVSA-N 0 0 363.483 3.674 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N([C@H](C)c1ccccc1)C1CC1 ZINC000510557643 933224780 /nfs/dbraw/zinc/22/47/80/933224780.db2.gz FVLDAYGUAIHJSJ-CQSZACIVSA-N 0 0 360.435 3.818 20 5 FHBDRN Cc1cccc([C@@H]2CCN(C(=O)COc3ccc([N+](=O)[O-])c(C)c3)C2)c1 ZINC000430786369 933230728 /nfs/dbraw/zinc/23/07/28/933230728.db2.gz APRRPEISJHBUNC-QGZVFWFLSA-N 0 0 354.406 3.607 20 5 FHBDRN O=c1[nH]cnc2cc(NC[C@@H]3CCC4(CCCCC4)O3)c([N+](=O)[O-])cc21 ZINC000581978191 933231401 /nfs/dbraw/zinc/23/14/01/933231401.db2.gz IYRYFVAEQSXIKW-LBPRGKRZSA-N 0 0 358.398 3.537 20 5 FHBDRN Cc1cc(OCC(=O)N2[C@@H](C)Cc3cc(F)ccc3[C@@H]2C)ccc1[N+](=O)[O-] ZINC000430802216 933238302 /nfs/dbraw/zinc/23/83/02/933238302.db2.gz KKRCOCFWWUBANC-KBPBESRZSA-N 0 0 372.396 3.956 20 5 FHBDRN C[C@@H]1[C@@H](C(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000430801450 933247910 /nfs/dbraw/zinc/24/79/10/933247910.db2.gz CHVYLCPAOKHWQI-UYHISHBKSA-N 0 0 358.825 3.957 20 5 FHBDRN Cc1cc(OCC(=O)NC[C@@H]2CCCC[C@H]2C(F)(F)F)ccc1[N+](=O)[O-] ZINC000430804840 933249688 /nfs/dbraw/zinc/24/96/88/933249688.db2.gz BOGCDFCWFKPWSI-GXTWGEPZSA-N 0 0 374.359 3.767 20 5 FHBDRN CSc1cc(C)ccc1CNC(=O)COc1ccc([N+](=O)[O-])c(C)c1 ZINC000430809030 933253139 /nfs/dbraw/zinc/25/31/39/933253139.db2.gz CFNNAIJAGMPELM-UHFFFAOYSA-N 0 0 360.435 3.629 20 5 FHBDRN Cc1cc(OCC(=O)N2CCCc3ccc(F)c(F)c32)ccc1[N+](=O)[O-] ZINC000430808863 933253295 /nfs/dbraw/zinc/25/32/95/933253295.db2.gz FAKCJBXWTPYYJV-UHFFFAOYSA-N 0 0 362.332 3.540 20 5 FHBDRN Cc1cc(OCC(=O)NCC2(Cc3ccc(F)cc3)CC2)ccc1[N+](=O)[O-] ZINC000430823503 933265405 /nfs/dbraw/zinc/26/54/05/933265405.db2.gz NRXKJMBIMXBBJY-UHFFFAOYSA-N 0 0 372.396 3.560 20 5 FHBDRN Cc1ccc(NC(=O)COc2ccc([N+](=O)[O-])c(C)c2)cc1-c1ncco1 ZINC000430825573 933271744 /nfs/dbraw/zinc/27/17/44/933271744.db2.gz DQGLPWDZYLFIDS-UHFFFAOYSA-N 0 0 367.361 3.884 20 5 FHBDRN Cc1cc(OCC(=O)N[C@H]2CC[C@@H](c3ccccc3F)C2)ccc1[N+](=O)[O-] ZINC000430838694 933287962 /nfs/dbraw/zinc/28/79/62/933287962.db2.gz PMGFOSXUMTWRIO-CABCVRRESA-N 0 0 372.396 3.874 20 5 FHBDRN COc1cc([N+](=O)[O-])cnc1N1CCC[C@@H](c2nc3ccccc3o2)C1 ZINC000891792790 933295607 /nfs/dbraw/zinc/29/56/07/933295607.db2.gz LXVBMBVHFYDCGD-GFCCVEGCSA-N 0 0 354.366 3.524 20 5 FHBDRN Cc1cccc([C@H]2NC(=O)N([C@H](C)c3cccc([N+](=O)[O-])c3)C2=O)c1C ZINC000430853425 933322918 /nfs/dbraw/zinc/32/29/18/933322918.db2.gz WFPRJPDQBOVVHN-CXAGYDPISA-N 0 0 353.378 3.566 20 5 FHBDRN CCc1ccccc1NC(=O)[C@@H](C)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088605368 933331000 /nfs/dbraw/zinc/33/10/00/933331000.db2.gz HPWZHDUJAIWAPO-CQSZACIVSA-N 0 0 353.422 3.543 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)c2ccc(Br)cn2)c1 ZINC000477762214 933348228 /nfs/dbraw/zinc/34/82/28/933348228.db2.gz GFPNEYOUECMIJW-SNVBAGLBSA-N 0 0 364.199 3.552 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N1CCC(C)=C(c2ccco2)C1 ZINC000512757126 933356825 /nfs/dbraw/zinc/35/68/25/933356825.db2.gz DWGNNNOSHHATSR-UHFFFAOYSA-N 0 0 356.378 3.906 20 5 FHBDRN Cc1cc(O[C@@H](C)C(=O)N2CCc3cc([N+](=O)[O-])ccc32)ccc1Cl ZINC000510661808 933378201 /nfs/dbraw/zinc/37/82/01/933378201.db2.gz AXPPHBUZBSTLMH-LBPRGKRZSA-N 0 0 360.797 3.913 20 5 FHBDRN Cc1ccc(-c2csc(NC(=O)[C@H](C)c3cncnc3)n2)cc1[N+](=O)[O-] ZINC000430898888 933379365 /nfs/dbraw/zinc/37/93/65/933379365.db2.gz XUUMFIHXQAVOEI-LLVKDONJSA-N 0 0 369.406 3.559 20 5 FHBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])NC[C@H]1CCC(F)(F)C1 ZINC000430908458 933393327 /nfs/dbraw/zinc/39/33/27/933393327.db2.gz VVPMIFFGVSABGJ-JTQLQIEISA-N 0 0 361.776 3.525 20 5 FHBDRN O=C1c2cccc([N+](=O)[O-])c2C(=O)N1CC1CCC(C(F)(F)F)CC1 ZINC000471878968 933419444 /nfs/dbraw/zinc/41/94/44/933419444.db2.gz XIRUJOGPSDVHMC-UHFFFAOYSA-N 0 0 356.300 3.560 20 5 FHBDRN O=[N+]([O-])c1cccc(F)c1CN1CC[C@@H](OCCCc2ccccc2)C1 ZINC000430936167 933441539 /nfs/dbraw/zinc/44/15/39/933441539.db2.gz STNDURIPYSHWEQ-QGZVFWFLSA-N 0 0 358.413 3.958 20 5 FHBDRN O=C(N[C@@H](c1ccccc1)c1ccncc1)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000065044501 933452408 /nfs/dbraw/zinc/45/24/08/933452408.db2.gz RWMLZVGUBYYIAU-IBGZPJMESA-N 0 0 372.384 3.991 20 5 FHBDRN CC(C)[C@H](CNC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)Nc1ccccc1 ZINC000065044253 933456150 /nfs/dbraw/zinc/45/61/50/933456150.db2.gz VCPJUSZLRODVRC-KRWDZBQOSA-N 0 0 366.421 3.943 20 5 FHBDRN Cc1ccc(C(=O)N2C[C@@H](C(F)(F)F)[C@H](C(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000610597809 933485473 /nfs/dbraw/zinc/48/54/73/933485473.db2.gz FENCMWVAGVBRCE-NXEZZACHSA-N 0 0 370.249 3.716 20 5 FHBDRN COC(=O)c1cccc(NC(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1C ZINC000610629808 933570353 /nfs/dbraw/zinc/57/03/53/933570353.db2.gz XRSJGQILHPTIRU-CYBMUJFWSA-N 0 0 371.393 3.881 20 5 FHBDRN CCC[C@@H](NC(=O)c1c[nH]nc1[N+](=O)[O-])c1cccc(C(F)(F)F)c1 ZINC000548419574 933580752 /nfs/dbraw/zinc/58/07/52/933580752.db2.gz KDLXEKCSCWWIKH-GFCCVEGCSA-N 0 0 356.304 3.608 20 5 FHBDRN COc1ccc(C)cc1CNC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000610639796 933588725 /nfs/dbraw/zinc/58/87/25/933588725.db2.gz CVSFFRXTOYLQQZ-UHFFFAOYSA-N 0 0 357.410 3.646 20 5 FHBDRN CCOc1cc(CNc2cc3c(cc2F)NC(=O)CC3)ccc1[N+](=O)[O-] ZINC000276824331 933595281 /nfs/dbraw/zinc/59/52/81/933595281.db2.gz AEZHNUNHTXQCFB-UHFFFAOYSA-N 0 0 359.357 3.629 20 5 FHBDRN COc1cc(C(=O)OCc2cccc([N+](=O)[O-])c2)ccc1OC(F)F ZINC000003489782 933599122 /nfs/dbraw/zinc/59/91/22/933599122.db2.gz BOCSDXQBEULQJY-UHFFFAOYSA-N 0 0 353.277 3.562 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CCC(C)(c2ccccc2)CC1 ZINC000510748577 933638146 /nfs/dbraw/zinc/63/81/46/933638146.db2.gz ISHUDGXROGXESV-UHFFFAOYSA-N 0 0 367.449 3.895 20 5 FHBDRN COC[C@H](Cc1ccccc1)N(C)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000510760732 933664087 /nfs/dbraw/zinc/66/40/87/933664087.db2.gz FDISCWVVFGZZOO-HNNXBMFYSA-N 0 0 350.365 3.563 20 5 FHBDRN CCOc1ccc(NC(=O)CCc2cccc([N+](=O)[O-])c2)cc1OCC ZINC000610664989 933699872 /nfs/dbraw/zinc/69/98/72/933699872.db2.gz RIFFZDULVAQWHD-UHFFFAOYSA-N 0 0 358.394 3.964 20 5 FHBDRN CC[C@H]1CN(C)c2ccccc2CN1C(=O)c1cc([N+](=O)[O-])c(C)s1 ZINC000610670316 933710202 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FHBDRN CSc1cncc(NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)c1 ZINC000891875227 933762782 /nfs/dbraw/zinc/76/27/82/933762782.db2.gz UCQMNVHEDSQOCI-UHFFFAOYSA-N 0 0 372.450 3.567 20 5 FHBDRN Cc1cc(OCC(=O)NCc2cccc3ccccc32)ccc1[N+](=O)[O-] ZINC000510805279 933765041 /nfs/dbraw/zinc/76/50/41/933765041.db2.gz VNBNXVLSYLBVDS-UHFFFAOYSA-N 0 0 350.374 3.752 20 5 FHBDRN COc1cccc(Cc2cnc(NC(=O)c3cccc([N+](=O)[O-])c3)s2)c1 ZINC000024031365 933773251 /nfs/dbraw/zinc/77/32/51/933773251.db2.gz YERWCWCBGNCLPX-UHFFFAOYSA-N 0 0 369.402 3.903 20 5 FHBDRN CCN(C(=O)c1c([N+](=O)[O-])c(C)nn1C)[C@@H](C)c1cc2ccccc2o1 ZINC000098102496 933809642 /nfs/dbraw/zinc/80/96/42/933809642.db2.gz RYCZXUQEVSKHOW-LBPRGKRZSA-N 0 0 356.382 3.606 20 5 FHBDRN Cc1cc(OCc2cccc(F)c2)ccc1NC(=O)c1cc([N+](=O)[O-])n[nH]1 ZINC000510826432 933817594 /nfs/dbraw/zinc/81/75/94/933817594.db2.gz ADUUADQNMPUIFI-UHFFFAOYSA-N 0 0 370.340 3.597 20 5 FHBDRN COc1ccc(CNC(=O)N2CCC(C)=C(c3ccco3)C2)cc1[N+](=O)[O-] ZINC000510839282 933837787 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CCCN(C(=O)c1cccs1)C1CCN(c2cccnc2[N+](=O)[O-])CC1 ZINC000610909443 934613841 /nfs/dbraw/zinc/61/38/41/934613841.db2.gz OGUYTIACBSEAKN-UHFFFAOYSA-N 0 0 374.466 3.573 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N2CCCC[C@@H]2c2ccc(F)cc2)c1[N+](=O)[O-] ZINC000610923949 934627700 /nfs/dbraw/zinc/62/77/00/934627700.db2.gz WIJTXDGQPUWNRP-CQSZACIVSA-N 0 0 360.389 3.948 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N(C)C[C@H]1COc2ccccc2O1 ZINC000176219682 934632902 /nfs/dbraw/zinc/63/29/02/934632902.db2.gz LCAWFUNXUKANPM-AWEZNQCLSA-N 0 0 371.393 3.515 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N1CCC[C@]2(CCCOC2)C1 ZINC000610960398 934658325 /nfs/dbraw/zinc/65/83/25/934658325.db2.gz ZKLIRXZQEGXHIU-INIZCTEOSA-N 0 0 372.343 3.646 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N1CCC[C@@H]1C[C@H](O)c1cccs1 ZINC000176243655 934661846 /nfs/dbraw/zinc/66/18/46/934661846.db2.gz OUVGZOFXPQVHRK-CJNGLKHVSA-N 0 0 360.435 3.693 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCCOc2ccccc21 ZINC000610967154 934663467 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CC[C@@H](Nc1ccccc1[N+](=O)[O-])[C@@H](c1ccc(C)cc1)n1cncn1 ZINC000535909247 934775977 /nfs/dbraw/zinc/77/59/77/934775977.db2.gz HAFNSRHIXVOQSB-VQIMIIECSA-N 0 0 351.410 3.975 20 5 FHBDRN Cn1c(=O)c2cc3ccccc3cc2nc1SCCO[C@H]1CC1(F)F ZINC000657236888 934799383 /nfs/dbraw/zinc/79/93/83/934799383.db2.gz NXJLKLHHLQHCKW-HNNXBMFYSA-N 0 0 362.401 3.603 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])NC[C@H](c1ccccc1)C(F)(F)F ZINC000187697432 934803187 /nfs/dbraw/zinc/80/31/87/934803187.db2.gz BGEHKOVJSOAUFW-CQSZACIVSA-N 0 0 352.312 3.600 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1nnc(C(F)F)s1 ZINC000119442368 934808651 /nfs/dbraw/zinc/80/86/51/934808651.db2.gz NONGMYYRBPVISP-UHFFFAOYSA-N 0 0 360.367 3.748 20 5 FHBDRN COc1cc(Cn2c(C)nc([N+](=O)[O-])c2Br)ccc1SC ZINC000068051357 934809405 /nfs/dbraw/zinc/80/94/05/934809405.db2.gz PILYVEVQQYHBFW-UHFFFAOYSA-N 0 0 372.244 3.641 20 5 FHBDRN CCc1ccc(CN[C@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)s1 ZINC000611560364 934822667 /nfs/dbraw/zinc/82/26/67/934822667.db2.gz ZEGPBTXIWVDCGA-KRWDZBQOSA-N 0 0 356.451 3.831 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(-c2nc(-c3cc(OC)cc(OC)c3)no2)c1 ZINC000561914840 934831584 /nfs/dbraw/zinc/83/15/84/934831584.db2.gz PVEGPDOZPXDENY-UHFFFAOYSA-N 0 0 371.349 3.728 20 5 FHBDRN CC(C)N(Cc1ccccc1)S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000119489098 934833699 /nfs/dbraw/zinc/83/36/99/934833699.db2.gz MHFQXLVXRLTJMC-UHFFFAOYSA-N 0 0 368.842 3.848 20 5 FHBDRN CSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](c1cnn(C)c1)C(C)(C)C ZINC000934123587 934833745 /nfs/dbraw/zinc/83/37/45/934833745.db2.gz LXYDWDBMIYNIFL-HNNXBMFYSA-N 0 0 362.455 3.567 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)[C@@H]1CC(=O)c2ccccc21 ZINC000277249955 934840489 /nfs/dbraw/zinc/84/04/89/934840489.db2.gz RRARSJMNJZJRTB-GOSISDBHSA-N 0 0 352.390 3.702 20 5 FHBDRN Cc1cc(NC(=O)c2ccccc2[N+](=O)[O-])n(-c2ccc(Cl)cc2)n1 ZINC000060854763 934843248 /nfs/dbraw/zinc/84/32/48/934843248.db2.gz OIEVTYKMEQKHEV-UHFFFAOYSA-N 0 0 356.769 3.995 20 5 FHBDRN C[C@H]1C[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2C(=O)c2ccccc2)CCO1 ZINC000538447453 934852393 /nfs/dbraw/zinc/85/23/93/934852393.db2.gz VMERQBPTHARDOF-DZGCQCFKSA-N 0 0 368.389 3.579 20 5 FHBDRN CN(Cc1cc([N+](=O)[O-])cc2c1OCOC2)c1ccc(F)c(Cl)c1 ZINC000538513998 934864407 /nfs/dbraw/zinc/86/44/07/934864407.db2.gz HZYHQFWNZKQWTL-UHFFFAOYSA-N 0 0 352.749 3.890 20 5 FHBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H]1C[C@H](C)O ZINC000538606837 934876747 /nfs/dbraw/zinc/87/67/47/934876747.db2.gz OQHVSESHVQXAHO-UONOGXRCSA-N 0 0 366.483 3.863 20 5 FHBDRN C[C@@H](CC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)c1ccc(F)cc1F ZINC000121709687 934877067 /nfs/dbraw/zinc/87/70/67/934877067.db2.gz SPCOONFWVRWRET-LBPRGKRZSA-N 0 0 360.360 3.952 20 5 FHBDRN C[C@H]1C[C@H](c2ccccc2)N(S(=O)(=O)Cc2ccccc2[N+](=O)[O-])C1 ZINC000511013882 934883344 /nfs/dbraw/zinc/88/33/44/934883344.db2.gz OURSRLQHTHDJMN-KBXCAEBGSA-N 0 0 360.435 3.508 20 5 FHBDRN C[C@H]1C[C@@H](c2ccccc2)N(S(=O)(=O)Cc2ccccc2[N+](=O)[O-])C1 ZINC000511013884 934883621 /nfs/dbraw/zinc/88/36/21/934883621.db2.gz OURSRLQHTHDJMN-KSSFIOAISA-N 0 0 360.435 3.508 20 5 FHBDRN C[C@H](NC(=O)c1c[nH]nc1-c1c(F)cccc1F)c1cccc([N+](=O)[O-])c1 ZINC000178501868 934887492 /nfs/dbraw/zinc/88/74/92/934887492.db2.gz XDVRWHWVXYSABD-JTQLQIEISA-N 0 0 372.331 3.754 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1CN(C)Cc1nc2c(s1)CCCC2 ZINC000538730332 934892710 /nfs/dbraw/zinc/89/27/10/934892710.db2.gz BPNRUVIREMYIDX-UHFFFAOYSA-N 0 0 361.467 3.961 20 5 FHBDRN O=C(N[C@@H]1C[C@H]1c1cccc(F)c1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000119598848 934907714 /nfs/dbraw/zinc/90/77/14/934907714.db2.gz NYOFIGKFQJIINO-RBUKOAKNSA-N 0 0 369.396 3.964 20 5 FHBDRN O=C(Nc1cccc2c1CCO2)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000434214796 934921076 /nfs/dbraw/zinc/92/10/76/934921076.db2.gz SRRYUADIUXWPQU-UHFFFAOYSA-N 0 0 353.378 3.726 20 5 FHBDRN COc1ccc(CSCC(=O)OC[C@H]2CC=CCC2)cc1[N+](=O)[O-] ZINC000071878271 934934766 /nfs/dbraw/zinc/93/47/66/934934766.db2.gz QJZRHKJDPDUHEC-ZDUSSCGKSA-N 0 0 351.424 3.736 20 5 FHBDRN CN1CCOc2ccc(Nc3ccc([N+](=O)[O-])c(OC(F)F)c3)cc21 ZINC000538932715 934952696 /nfs/dbraw/zinc/95/26/96/934952696.db2.gz WMUNBAFLZOFPDS-UHFFFAOYSA-N 0 0 351.309 3.768 20 5 FHBDRN C[C@@H]1C[C@@H](c2ccccc2)N(S(=O)(=O)CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000511026296 934953358 /nfs/dbraw/zinc/95/33/58/934953358.db2.gz HHQXMITZAVKDQQ-BEFAXECRSA-N 0 0 374.462 3.550 20 5 FHBDRN CCCCOCCCNC(=O)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC000755031162 934960898 /nfs/dbraw/zinc/96/08/98/934960898.db2.gz PVSYIPOEHZUILL-UHFFFAOYSA-N 0 0 374.235 3.686 20 5 FHBDRN Cc1cc(O)ccc1NC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000154034631 934966718 /nfs/dbraw/zinc/96/67/18/934966718.db2.gz CWAFUSPXSQPLOU-UHFFFAOYSA-N 0 0 350.758 3.670 20 5 FHBDRN C[C@@H]1C[C@@H](c2ccccc2)N(S(=O)(=O)Cc2cccc([N+](=O)[O-])c2)C1 ZINC000511030233 934966915 /nfs/dbraw/zinc/96/69/15/934966915.db2.gz ONGSNZUSJNKZJC-KDOFPFPSSA-N 0 0 360.435 3.508 20 5 FHBDRN CC[C@H]1CC[C@@H](C)N1C(=O)CSCc1ccc(OC)c([N+](=O)[O-])c1 ZINC000538992958 934980865 /nfs/dbraw/zinc/98/08/65/934980865.db2.gz UCIHDZVVZKORCB-OCCSQVGLSA-N 0 0 352.456 3.626 20 5 FHBDRN COc1ccc2c(c1)N(Cc1cc(OC)c(F)cc1[N+](=O)[O-])C[C@@H](C)O2 ZINC001167508644 935003030 /nfs/dbraw/zinc/00/30/30/935003030.db2.gz IQUMPVRVNSGJLR-LLVKDONJSA-N 0 0 362.357 3.539 20 5 FHBDRN CNc1ccc([N+](=O)[O-])cc1NC(=O)c1cc(C(C)C)n(C(C)(C)C)n1 ZINC000563198671 935005642 /nfs/dbraw/zinc/00/56/42/935005642.db2.gz KNXCGJJLJAPYOR-UHFFFAOYSA-N 0 0 359.430 3.964 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N2CCC[C@@H]2c2ccsc2)c1C ZINC000119676567 935014100 /nfs/dbraw/zinc/01/41/00/935014100.db2.gz DTFSDYGZKFZSJM-CQSZACIVSA-N 0 0 366.464 3.799 20 5 FHBDRN CC(C)Cn1cc(NC(=O)Cc2cccc([N+](=O)[O-])c2)c(C(F)F)n1 ZINC000536438716 935015004 /nfs/dbraw/zinc/01/50/04/935015004.db2.gz JIALIFUXWQHURE-UHFFFAOYSA-N 0 0 352.341 3.566 20 5 FHBDRN C[C@H](OC(=O)c1ccc(Cn2cc([N+](=O)[O-])cn2)cc1)c1ccccc1F ZINC001267065470 935024478 /nfs/dbraw/zinc/02/44/78/935024478.db2.gz RXGYXUKYRQGRHX-ZDUSSCGKSA-N 0 0 369.352 3.897 20 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/nfs/dbraw/zinc/09/98/45/935099845.db2.gz GJFVRLQZKQSRGJ-UHFFFAOYSA-N 0 0 367.814 3.773 20 5 FHBDRN COc1ccc(C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c(OCC2CC2)c1 ZINC000472129053 935107519 /nfs/dbraw/zinc/10/75/19/935107519.db2.gz XMOQYSBNBCNMNO-ZDUSSCGKSA-N 0 0 370.405 3.883 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N[C@H](C)c2c(F)cccc2F)c1C ZINC000511056769 935131870 /nfs/dbraw/zinc/13/18/70/935131870.db2.gz QBFJHKZTRGVSDI-LLVKDONJSA-N 0 0 370.377 3.529 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])c2cccnc12)N1CCS[C@@H]2CCCC[C@H]21 ZINC000157675173 935135655 /nfs/dbraw/zinc/13/56/55/935135655.db2.gz MVDLGJOFLRJKQP-HZPDHXFCSA-N 0 0 357.435 3.643 20 5 FHBDRN Cc1c(NC(=O)Nc2ccc(O[C@@H]3CCOC3)cc2)cccc1[N+](=O)[O-] ZINC000157694270 935143372 /nfs/dbraw/zinc/14/33/72/935143372.db2.gz DMOUYICUEBCJJG-OAHLLOKOSA-N 0 0 357.366 3.715 20 5 FHBDRN Cc1c(NC(=O)NC[C@@]2(C)OCCc3sccc32)cccc1[N+](=O)[O-] ZINC000582032036 935152097 /nfs/dbraw/zinc/15/20/97/935152097.db2.gz NWBSDDTTYXUKRF-QGZVFWFLSA-N 0 0 361.423 3.574 20 5 FHBDRN CC[C@H](C)[C@H](O)CNC(=O)c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1 ZINC000427090215 945080063 /nfs/dbraw/zinc/08/00/63/945080063.db2.gz VHWWJIFAWYYCCY-SCLBCKFNSA-N 0 0 374.462 3.883 20 5 FHBDRN C[C@@H](CC(C)(C)c1ccccc1)NC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC001125579570 935154735 /nfs/dbraw/zinc/15/47/35/935154735.db2.gz TVDMLYTZJSDTFY-ZDUSSCGKSA-N 0 0 370.405 3.810 20 5 FHBDRN C[C@@H](C(=O)N1C[C@@H](C)O[C@@H](c2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000582037225 935156952 /nfs/dbraw/zinc/15/69/52/935156952.db2.gz GQCCHIJSWGGGKL-SPYBWZPUSA-N 0 0 354.406 3.687 20 5 FHBDRN CCOc1c(F)cccc1C(=O)Nc1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000084776658 935168768 /nfs/dbraw/zinc/16/87/68/935168768.db2.gz MWRKNYQDMARJNW-UHFFFAOYSA-N 0 0 355.325 3.933 20 5 FHBDRN Cc1c(CC(=O)N[C@H]2CCC[C@H]2Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000438825065 945081008 /nfs/dbraw/zinc/08/10/08/945081008.db2.gz ATJLSMXIEWHPJU-OALUTQOASA-N 0 0 352.434 3.973 20 5 FHBDRN C[C@H](NC(=O)Cc1ccccc1[N+](=O)[O-])c1ccc(OCC2CC2)c(F)c1 ZINC000119746084 935183612 /nfs/dbraw/zinc/18/36/12/935183612.db2.gz MSRZOQBGVPWIIR-ZDUSSCGKSA-N 0 0 372.396 3.943 20 5 FHBDRN C[C@@H]1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[S@@]1=O ZINC000277445662 935184134 /nfs/dbraw/zinc/18/41/34/935184134.db2.gz JPJVZOKIGICMLC-OZAJXLCCSA-N 0 0 364.492 3.666 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)Nc1cnn(CC(C)C)c1C ZINC000439912545 945087606 /nfs/dbraw/zinc/08/76/06/945087606.db2.gz VELZFUBXBPPUFL-UHFFFAOYSA-N 0 0 361.402 3.798 20 5 FHBDRN CCOc1cn(-c2ccccc2)nc1C(=O)Oc1cccc([N+](=O)[O-])c1C ZINC000728468201 935201270 /nfs/dbraw/zinc/20/12/70/935201270.db2.gz BLLBDIYIZHTUOE-UHFFFAOYSA-N 0 0 367.361 3.707 20 5 FHBDRN COc1ccc(NC(=O)[C@@H](C)Sc2ccc(Cl)cn2)c([N+](=O)[O-])c1 ZINC000119789829 935223180 /nfs/dbraw/zinc/22/31/80/935223180.db2.gz OCLSEIXRMDSKQL-SECBINFHSA-N 0 0 367.814 3.771 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])Nc1cccc(OC(F)(F)F)c1 ZINC000072035537 935225736 /nfs/dbraw/zinc/22/57/36/935225736.db2.gz RJDGGVAOFLUBJB-UHFFFAOYSA-N 0 0 355.272 3.544 20 5 FHBDRN O=C(NCCc1c(F)cccc1F)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000437161113 945085660 /nfs/dbraw/zinc/08/56/60/945085660.db2.gz ADZHUGVWHHGPGW-UHFFFAOYSA-N 0 0 374.265 3.864 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N(C)[C@@H](C)c1ccc(Cl)c(Cl)c1 ZINC000299345431 935238049 /nfs/dbraw/zinc/23/80/49/935238049.db2.gz MEUQXRZMKAKPFQ-VIFPVBQESA-N 0 0 371.224 3.626 20 5 FHBDRN Cc1cc(C(=O)Nc2cccc([N+](=O)[O-])c2)nn1-c1ccccc1Cl ZINC000539548398 935239983 /nfs/dbraw/zinc/23/99/83/935239983.db2.gz WLYOANGWXLPWRH-UHFFFAOYSA-N 0 0 356.769 3.995 20 5 FHBDRN CC[C@@H]1C[C@@H](C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)CCO1 ZINC000551330070 935250057 /nfs/dbraw/zinc/25/00/57/935250057.db2.gz YKUMYPCSMHDVCN-TVQRCGJNSA-N 0 0 357.204 3.501 20 5 FHBDRN O=[N+]([O-])c1ccccc1CN1CCCC[C@H]1c1nnc(C2CCOCC2)o1 ZINC000277474163 935253416 /nfs/dbraw/zinc/25/34/16/935253416.db2.gz RWIULFOEKXYPLE-KRWDZBQOSA-N 0 0 372.425 3.599 20 5 FHBDRN O=C(N[C@@H]1C[C@@H]1c1ccccc1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000431356765 935264415 /nfs/dbraw/zinc/26/44/15/935264415.db2.gz CZMBCDKHBPSQPD-HUUCEWRRSA-N 0 0 361.195 3.643 20 5 FHBDRN Cc1cc(C(=O)Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)c(F)cc1F ZINC000539760065 935289196 /nfs/dbraw/zinc/28/91/96/935289196.db2.gz ZLPYRRMBIWBKPQ-UHFFFAOYSA-N 0 0 357.316 3.928 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)[C@H](C)Sc1ccccn1 ZINC000084970654 935291577 /nfs/dbraw/zinc/29/15/77/935291577.db2.gz KEFAJLPZYLXOED-AWEZNQCLSA-N 0 0 359.451 3.908 20 5 FHBDRN CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)OC[C@@H]2CCCCO2)CC1 ZINC000072100602 935309097 /nfs/dbraw/zinc/30/90/97/935309097.db2.gz XOGPRCFYLLUINM-INIZCTEOSA-N 0 0 362.426 3.557 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@](F)(c2cc(F)cc(F)c2)C1 ZINC000551685567 935329388 /nfs/dbraw/zinc/32/93/88/935329388.db2.gz YTQKNYUDUSMOOY-GOSISDBHSA-N 0 0 364.323 3.892 20 5 FHBDRN C[C@@H](C1CCCCC1)N(C)C(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1 ZINC000451232164 935332324 /nfs/dbraw/zinc/33/23/24/935332324.db2.gz SGXZCCRXBOANRU-AWEZNQCLSA-N 0 0 356.426 3.821 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccc(-c2nccs2)cc1 ZINC000427108097 945093746 /nfs/dbraw/zinc/09/37/46/945093746.db2.gz POARRFDIEGQADF-UHFFFAOYSA-N 0 0 355.375 3.979 20 5 FHBDRN CCN(Cc1ccncc1)C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000051468517 935338095 /nfs/dbraw/zinc/33/80/95/935338095.db2.gz HDYDPOLBFHFABR-UHFFFAOYSA-N 0 0 368.418 3.776 20 5 FHBDRN CO[C@H](c1ccc(F)cc1)[C@H](C)NC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000540004003 935341840 /nfs/dbraw/zinc/34/18/40/935341840.db2.gz NSJNEVSDKYNWEQ-UGSOOPFHSA-N 0 0 374.412 3.904 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N[C@H]1C[C@H]1c1c(F)cccc1F ZINC000134983873 935343249 /nfs/dbraw/zinc/34/32/49/935343249.db2.gz PBYAEQLSHNRXAF-DYVFJYSZSA-N 0 0 371.343 3.569 20 5 FHBDRN O=C(Nc1ccc(-n2ccc(C(F)(F)F)n2)cc1)c1ccc([N+](=O)[O-])o1 ZINC000582153279 935350148 /nfs/dbraw/zinc/35/01/48/935350148.db2.gz MWNHCQAFEIVHPH-UHFFFAOYSA-N 0 0 366.255 3.645 20 5 FHBDRN O=C(CN1CC[C@@H](C(F)(F)F)C2(CCC2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000582169242 935367478 /nfs/dbraw/zinc/36/74/78/935367478.db2.gz CDPSEJGPZBRQGZ-CQSZACIVSA-N 0 0 371.359 3.588 20 5 FHBDRN COc1ccccc1C(C)(C)CNC(=O)[C@@H]1C[C@H]1c1cccc([N+](=O)[O-])c1 ZINC001125585513 935374187 /nfs/dbraw/zinc/37/41/87/935374187.db2.gz CMZXEWNMDLYCBP-DLBZAZTESA-N 0 0 368.433 3.801 20 5 FHBDRN COc1cccc([C@@H](Nc2ccc([N+](=O)[O-])c(C)c2)c2nccn2C)c1 ZINC000051500564 935388544 /nfs/dbraw/zinc/38/85/44/935388544.db2.gz FSAXMDSGFDBLRP-GOSISDBHSA-N 0 0 352.394 3.847 20 5 FHBDRN CCc1ccc(C(=O)N2CCC(F)(c3ccccn3)CC2)cc1[N+](=O)[O-] ZINC000551998395 935397513 /nfs/dbraw/zinc/39/75/13/935397513.db2.gz RDIQDKCYQAHIRK-UHFFFAOYSA-N 0 0 357.385 3.653 20 5 FHBDRN Cn1cc(NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)c(-c2ccccc2)n1 ZINC000091145133 935398691 /nfs/dbraw/zinc/39/86/91/935398691.db2.gz COSGBMWNTOPORF-UHFFFAOYSA-N 0 0 356.769 3.901 20 5 FHBDRN Cc1ccc([C@H](C)NCc2csc(-c3cnn(C)c3)n2)cc1[N+](=O)[O-] ZINC000611404298 935399486 /nfs/dbraw/zinc/39/94/86/935399486.db2.gz POVBZPOROKIWPW-LBPRGKRZSA-N 0 0 357.439 3.611 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)N[C@H](c2ccccc2)c2ccc(C)cc2)n1 ZINC000427112097 945098107 /nfs/dbraw/zinc/09/81/07/945098107.db2.gz YYXQUPPPKOCKTP-GOSISDBHSA-N 0 0 364.405 3.639 20 5 FHBDRN Cc1ccccc1[C@@H]1CN(c2cc(C(F)(F)F)ncc2[N+](=O)[O-])CCO1 ZINC000582219506 935421974 /nfs/dbraw/zinc/42/19/74/935421974.db2.gz XINCIDQRKIFHSO-HNNXBMFYSA-N 0 0 367.327 3.895 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N(C)C[C@@H]1CCCCO1 ZINC000540435421 935453628 /nfs/dbraw/zinc/45/36/28/935453628.db2.gz NXNLYQGACWCJNA-AWEZNQCLSA-N 0 0 352.456 3.736 20 5 FHBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1COc1ccc(Cl)cc1C(N)=O ZINC000511095558 935467866 /nfs/dbraw/zinc/46/78/66/935467866.db2.gz WINIFNAAHWPDSY-UHFFFAOYSA-N 0 0 364.785 3.713 20 5 FHBDRN COc1ccc2c(c1)N(C(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1)C[C@@H](C)O2 ZINC000582278416 935474634 /nfs/dbraw/zinc/47/46/34/935474634.db2.gz KACLWRVJLCPLKT-OLZOCXBDSA-N 0 0 356.378 3.521 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)NCCc1cc2ccccc2o1 ZINC000540530466 935480534 /nfs/dbraw/zinc/48/05/34/935480534.db2.gz PBYPBHJIGOSXSL-UHFFFAOYSA-N 0 0 354.362 3.712 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)N(Cc2ccccc2)c2cccc(C)c2)n1 ZINC000427117784 945103639 /nfs/dbraw/zinc/10/36/39/945103639.db2.gz PMLAIFOOTCUFSJ-UHFFFAOYSA-N 0 0 364.405 3.967 20 5 FHBDRN Cc1cc2c[nH]nc2cc1NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000263906456 935489221 /nfs/dbraw/zinc/48/92/21/935489221.db2.gz HDKIFOLDKNOFTJ-UHFFFAOYSA-N 0 0 365.393 3.632 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)NCCc1c[nH]c2cc(F)ccc12 ZINC000051582241 935501354 /nfs/dbraw/zinc/50/13/54/935501354.db2.gz IPKWGTBPZAPEAV-UHFFFAOYSA-N 0 0 372.356 3.588 20 5 FHBDRN Cc1c(CC(=O)N2CCC[C@H]2c2ccc3c(c2)OCO3)cccc1[N+](=O)[O-] ZINC000120055900 935510143 /nfs/dbraw/zinc/51/01/43/935510143.db2.gz OCJYSESDXFYNAT-KRWDZBQOSA-N 0 0 368.389 3.538 20 5 FHBDRN CC[C@@H](NC(=O)c1ccc(Cn2cc([N+](=O)[O-])cn2)cc1)C1CCCCC1 ZINC001125592690 935512542 /nfs/dbraw/zinc/51/25/42/935512542.db2.gz PUPLOHGFVZOWSX-LJQANCHMSA-N 0 0 370.453 3.928 20 5 FHBDRN O=C(Nc1cccc(F)c1)C1CC[NH+](Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000507281559 945106146 /nfs/dbraw/zinc/10/61/46/945106146.db2.gz GBLUMFAPAQVHSZ-UHFFFAOYSA-N 0 0 357.385 3.585 20 5 FHBDRN CC(C)Oc1cncc(NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)n1 ZINC000582336242 935538342 /nfs/dbraw/zinc/53/83/42/935538342.db2.gz YXMPVJQKJVPBNK-UHFFFAOYSA-N 0 0 356.304 3.803 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N(C)CCc1ccc(F)cc1 ZINC000439933483 945107594 /nfs/dbraw/zinc/10/75/94/945107594.db2.gz QBGBVTKAJSYEEG-UHFFFAOYSA-N 0 0 361.373 3.839 20 5 FHBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCCCO1 ZINC000540728612 935545609 /nfs/dbraw/zinc/54/56/09/935545609.db2.gz NAVNTIMARMZKHD-CQSZACIVSA-N 0 0 352.456 3.786 20 5 FHBDRN C[C@H]1CC[C@H](CNC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])C1 ZINC000478112386 935574890 /nfs/dbraw/zinc/57/48/90/935574890.db2.gz OSZGUIHVHBEYBQ-QWRGUYRKSA-N 0 0 360.332 3.702 20 5 FHBDRN COc1cc(NC(=O)c2ccc([N+](=O)[O-])cc2OC)c(OC)cc1Cl ZINC000427122982 945109929 /nfs/dbraw/zinc/10/99/29/945109929.db2.gz FVYLRWSLJUEIAL-UHFFFAOYSA-N 0 0 366.757 3.526 20 5 FHBDRN Cc1ccc(C)c(S(=O)(=O)N[C@H](C)c2ccc(F)cc2F)c1[N+](=O)[O-] ZINC000478169161 935587416 /nfs/dbraw/zinc/58/74/16/935587416.db2.gz PXILODWRLQBUQV-LLVKDONJSA-N 0 0 370.377 3.529 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N(c2ccc(OC)c(F)c2)C(C)C)c1 ZINC000158139518 935588494 /nfs/dbraw/zinc/58/84/94/935588494.db2.gz OOLGYIZQGUNDJD-UHFFFAOYSA-N 0 0 362.357 3.806 20 5 FHBDRN CN(C(=O)Cc1ccc([N+](=O)[O-])cc1Br)[C@@H]1CCC(C)(C)C1 ZINC000478199320 935591639 /nfs/dbraw/zinc/59/16/39/935591639.db2.gz ZLNLCMCYOJEQTQ-CYBMUJFWSA-N 0 0 369.259 3.937 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])[C@H]1CCN(c2ccccc2Cl)C1=O ZINC000511107721 935593507 /nfs/dbraw/zinc/59/35/07/935593507.db2.gz OIWPWJPFEJWCRR-SFHVURJKSA-N 0 0 373.840 3.528 20 5 FHBDRN CNc1c(C(=O)N[C@@H]2CC[C@@H](c3cccc(F)c3)C2)cccc1[N+](=O)[O-] ZINC000478245400 935597077 /nfs/dbraw/zinc/59/70/77/935597077.db2.gz AUULMIHBAGMKDO-UKRRQHHQSA-N 0 0 357.385 3.842 20 5 FHBDRN O=[N+]([O-])c1ccc(NCc2cn3ccsc3n2)c(Br)c1 ZINC000478261627 935598969 /nfs/dbraw/zinc/59/89/69/935598969.db2.gz YBZITEVWRPTBPE-UHFFFAOYSA-N 0 0 353.201 3.679 20 5 FHBDRN O=C(COc1cccc([N+](=O)[O-])c1)N[C@@H]1CC[C@@H](c2cccc(F)c2)C1 ZINC000478277920 935605412 /nfs/dbraw/zinc/60/54/12/935605412.db2.gz GWVQFEMEWNNLGL-GDBMZVCRSA-N 0 0 358.369 3.565 20 5 FHBDRN Nc1c(C(=O)N[C@H]2CC[C@@H](c3cccc(F)c3)C2)cc(F)cc1[N+](=O)[O-] ZINC000478290439 935607930 /nfs/dbraw/zinc/60/79/30/935607930.db2.gz IDNDTBKQUNZNPS-RISCZKNCSA-N 0 0 361.348 3.521 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)Nc2cnc([C@@H](C)CC)nc2)cc1OC ZINC000478288083 935608096 /nfs/dbraw/zinc/60/80/96/935608096.db2.gz GXIDMGGKFZBTST-NSHDSACASA-N 0 0 374.397 3.558 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N[C@H]1CC[C@@H](c2cccc(F)c2)C1 ZINC000478292403 935608204 /nfs/dbraw/zinc/60/82/04/935608204.db2.gz KNWZFIICPULAAS-ZBFHGGJFSA-N 0 0 358.369 3.565 20 5 FHBDRN CCOC(=O)c1cc(C(=O)Nc2cc(F)cc(Cl)c2)cc([N+](=O)[O-])c1 ZINC000478376456 935614606 /nfs/dbraw/zinc/61/46/06/935614606.db2.gz KEYUQIQPOJMGLB-UHFFFAOYSA-N 0 0 366.732 3.816 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1)c1c(F)cc(Br)cc1F ZINC000127549900 935618893 /nfs/dbraw/zinc/61/88/93/935618893.db2.gz UZDYHIQUVFQMIZ-UHFFFAOYSA-N 0 0 357.110 3.888 20 5 FHBDRN CCOc1ccccc1OCCCC(=O)N(C)c1cccc([N+](=O)[O-])c1 ZINC000158238510 935649780 /nfs/dbraw/zinc/64/97/80/935649780.db2.gz KLWQNZGKGFNTMU-UHFFFAOYSA-N 0 0 358.394 3.816 20 5 FHBDRN C[C@H]1CC[C@@]2(CCN(c3ccc(S(=O)(=O)C(F)F)cc3[N+](=O)[O-])C2)C1 ZINC000302066255 935652891 /nfs/dbraw/zinc/65/28/91/935652891.db2.gz WFQHJIQQUNHQIS-MEDUHNTESA-N 0 0 374.409 3.608 20 5 FHBDRN Cc1noc2nc(C3CC3)cc(C(=O)N(C)c3cccc([N+](=O)[O-])c3)c12 ZINC000158605603 935654913 /nfs/dbraw/zinc/65/49/13/935654913.db2.gz DYNMCBMNDWDJIO-UHFFFAOYSA-N 0 0 352.350 3.593 20 5 FHBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N(CC1CC1)C1CCC1 ZINC000478601027 935663141 /nfs/dbraw/zinc/66/31/41/935663141.db2.gz JECNPCGGOMNIGK-NSHDSACASA-N 0 0 352.818 3.807 20 5 FHBDRN COc1ccccc1CC(C)(C)NC(=O)NCc1cccc([N+](=O)[O-])c1C ZINC000478599608 935663253 /nfs/dbraw/zinc/66/32/53/935663253.db2.gz WJOYVXFNSYYJOV-UHFFFAOYSA-N 0 0 371.437 3.732 20 5 FHBDRN CCN(C(=O)[C@@H](C)N(C)CCc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000511118646 935665621 /nfs/dbraw/zinc/66/56/21/935665621.db2.gz BCCNQXMGVGAPND-MRXNPFEDSA-N 0 0 355.438 3.511 20 5 FHBDRN Cc1cc(C)n(Cc2cccc(C(=O)N(C)c3cccc([N+](=O)[O-])c3)c2)n1 ZINC000158262358 935666046 /nfs/dbraw/zinc/66/60/46/935666046.db2.gz SYMNKJCNHDXCJR-UHFFFAOYSA-N 0 0 364.405 3.733 20 5 FHBDRN Cc1nn(C)c(C(=O)Nc2nc(-c3ccc(C)c(C)c3)cs2)c1[N+](=O)[O-] ZINC000127638169 935673628 /nfs/dbraw/zinc/67/36/28/935673628.db2.gz HKGXYXCRPODDDX-UHFFFAOYSA-N 0 0 371.422 3.629 20 5 FHBDRN Cc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2C)cc1NC(=O)N(C)C ZINC000478682768 935674141 /nfs/dbraw/zinc/67/41/41/935674141.db2.gz WQCGKXDYXVUGIG-UHFFFAOYSA-N 0 0 356.382 3.557 20 5 FHBDRN Cc1c(CNC(=O)NCCc2ccc(F)cc2Cl)cccc1[N+](=O)[O-] ZINC000478662230 935677345 /nfs/dbraw/zinc/67/73/45/935677345.db2.gz ODERSZHQKIWLJJ-UHFFFAOYSA-N 0 0 365.792 3.738 20 5 FHBDRN CCOc1cc(OCc2ccc(OCC(F)(F)F)nc2)ccc1[N+](=O)[O-] ZINC000478729988 935687735 /nfs/dbraw/zinc/68/77/35/935687735.db2.gz IMOJENVGGNCFQT-UHFFFAOYSA-N 0 0 372.299 3.909 20 5 FHBDRN CCOc1cc(OCc2nnc(-c3ccc(C)cc3)o2)ccc1[N+](=O)[O-] ZINC000478719837 935693265 /nfs/dbraw/zinc/69/32/65/935693265.db2.gz QMEOZKNALHBBLM-UHFFFAOYSA-N 0 0 355.350 3.931 20 5 FHBDRN CC(=O)c1ccc(OC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)c(F)c1 ZINC000728490477 935703467 /nfs/dbraw/zinc/70/34/67/935703467.db2.gz CLPAVCXPQLFMBU-UHFFFAOYSA-N 0 0 358.325 3.730 20 5 FHBDRN CCCn1ccnc1CCCN(C)C(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000277600189 935704711 /nfs/dbraw/zinc/70/47/11/935704711.db2.gz PZDOWBKKMGDXRN-UHFFFAOYSA-N 0 0 364.833 3.560 20 5 FHBDRN Cc1sc(C(=O)N2CCC[C@@H]2CC(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000085492979 935709217 /nfs/dbraw/zinc/70/92/17/935709217.db2.gz BULMGTVSLFMMHD-CQSZACIVSA-N 0 0 358.419 3.842 20 5 FHBDRN C[C@@H](SCc1ccc2c(c1)OCO2)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000478770068 935715373 /nfs/dbraw/zinc/71/53/73/935715373.db2.gz RZNWYQREZFTPJC-LLVKDONJSA-N 0 0 360.391 3.584 20 5 FHBDRN CCC(CC)c1nnc(NC(=O)c2ccc([N+](=O)[O-])cc2OC)s1 ZINC000427129542 945119138 /nfs/dbraw/zinc/11/91/38/945119138.db2.gz YFAREXNGZWILSA-UHFFFAOYSA-N 0 0 350.400 3.611 20 5 FHBDRN O=C(Nc1cc(F)c(F)c(F)c1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000127731708 935759207 /nfs/dbraw/zinc/75/92/07/935759207.db2.gz RZTRTSVQLJSBJJ-UHFFFAOYSA-N 0 0 365.311 3.865 20 5 FHBDRN Cc1cc(C(F)(F)F)nn1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000562055999 935762416 /nfs/dbraw/zinc/76/24/16/935762416.db2.gz AMPHHOXZJUHYKL-UHFFFAOYSA-N 0 0 352.272 3.822 20 5 FHBDRN CCOCCC1(CNc2cc(C)nc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000127742431 935765442 /nfs/dbraw/zinc/76/54/42/935765442.db2.gz CJNBRMYZHAKXGA-UHFFFAOYSA-N 0 0 356.426 3.979 20 5 FHBDRN CC[C@@]1(c2ccc(C)cc2)CC(=O)N(Cc2cccc([N+](=O)[O-])c2)C1=O ZINC000158381254 935765530 /nfs/dbraw/zinc/76/55/30/935765530.db2.gz ZSRVFZHSCUMOPP-FQEVSTJZSA-N 0 0 352.390 3.510 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1C(=O)NCc1ccccc1-c1cnn(C)c1 ZINC001267130419 935767733 /nfs/dbraw/zinc/76/77/33/935767733.db2.gz BZDKLYBFZAHGCI-UHFFFAOYSA-N 0 0 364.405 3.542 20 5 FHBDRN CCC[C@]12CCCN1C(=O)N(CCCCc1ccc([N+](=O)[O-])cc1)C2=O ZINC000478998153 935767741 /nfs/dbraw/zinc/76/77/41/935767741.db2.gz VIOOOXKGSCWBAE-LJQANCHMSA-N 0 0 359.426 3.514 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N(C)Cc1cccc(OC)c1 ZINC000479021441 935772213 /nfs/dbraw/zinc/77/22/13/935772213.db2.gz QGDGKCOUJXBVQA-UHFFFAOYSA-N 0 0 360.435 3.988 20 5 FHBDRN C[C@H](c1nnc(-c2cccs2)o1)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000511140781 935776743 /nfs/dbraw/zinc/77/67/43/935776743.db2.gz URHGFOJRYHMFJO-GFCCVEGCSA-N 0 0 358.423 3.942 20 5 FHBDRN CN(C(=O)c1ccc(-c2nc(C3CC3)no2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000158421058 935786643 /nfs/dbraw/zinc/78/66/43/935786643.db2.gz MBLNGWIBPWMPSU-UHFFFAOYSA-N 0 0 364.361 3.799 20 5 FHBDRN Cc1n[nH]c(C(=O)NCc2cccc(-c3ccc(C)cc3)c2)c1[N+](=O)[O-] ZINC000468245532 935789564 /nfs/dbraw/zinc/78/95/64/935789564.db2.gz PQBDLRVCGHSJKM-UHFFFAOYSA-N 0 0 350.378 3.532 20 5 FHBDRN C[C@@H]1CCN(C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)c2ccccc21 ZINC000519100338 945123869 /nfs/dbraw/zinc/12/38/69/945123869.db2.gz GFCAWMHUYHMQGH-CQSZACIVSA-N 0 0 362.389 3.935 20 5 FHBDRN CCOc1ccc(CNC(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)cc1OC ZINC000127816701 935817031 /nfs/dbraw/zinc/81/70/31/935817031.db2.gz UFSLSCNKABAMBA-UHFFFAOYSA-N 0 0 373.409 3.941 20 5 FHBDRN CC(=O)c1cccc(OCCCC(=O)N(C)c2cccc([N+](=O)[O-])c2)c1 ZINC000158473209 935819407 /nfs/dbraw/zinc/81/94/07/935819407.db2.gz HSBBKQKVDKQYJZ-UHFFFAOYSA-N 0 0 356.378 3.619 20 5 FHBDRN C[C@H](O)C[C@H](CNC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000159229463 935819641 /nfs/dbraw/zinc/81/96/41/935819641.db2.gz FWRUFHYSKAEMCP-GXTWGEPZSA-N 0 0 362.813 3.533 20 5 FHBDRN CC[C@@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)Nc1ccc(C2CC2)c(C)c1 ZINC000479297230 935823312 /nfs/dbraw/zinc/82/33/12/935823312.db2.gz QOQJFVIFBLJNHD-MRXNPFEDSA-N 0 0 371.441 3.652 20 5 FHBDRN CN(Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)Cc1ccccc1Cl ZINC000023819633 935828382 /nfs/dbraw/zinc/82/83/82/935828382.db2.gz XNXZNWGDXZNJDF-UHFFFAOYSA-N 0 0 358.785 3.930 20 5 FHBDRN CCC(=O)c1ccc(NCc2cccc(OCCOC)c2)c([N+](=O)[O-])c1 ZINC000479372157 935830810 /nfs/dbraw/zinc/83/08/10/935830810.db2.gz DTVJMEFERGNBIT-UHFFFAOYSA-N 0 0 358.394 3.825 20 5 FHBDRN CCC(=O)c1ccc(NCc2ccn(-c3ccccc3)n2)c([N+](=O)[O-])c1 ZINC000479368861 935830951 /nfs/dbraw/zinc/83/09/51/935830951.db2.gz TYCFPKPCBKAZKS-UHFFFAOYSA-N 0 0 350.378 3.985 20 5 FHBDRN CCC(=O)c1ccc(NCc2cccc(C(=O)NC3CC3)c2)c([N+](=O)[O-])c1 ZINC000479369900 935831116 /nfs/dbraw/zinc/83/11/16/935831116.db2.gz DUEOIBFAGKXLPE-UHFFFAOYSA-N 0 0 367.405 3.692 20 5 FHBDRN Cc1c(C(=O)N2CC[C@@H](OCCCc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000176339514 935836076 /nfs/dbraw/zinc/83/60/76/935836076.db2.gz DDLNAOZODTXNCQ-GOSISDBHSA-N 0 0 368.433 3.767 20 5 FHBDRN COc1ccc(Br)c(C(=O)N(C)c2cccc([N+](=O)[O-])c2)c1 ZINC000158556704 935836206 /nfs/dbraw/zinc/83/62/06/935836206.db2.gz CFTSFVKKWSMPOD-UHFFFAOYSA-N 0 0 365.183 3.643 20 5 FHBDRN CC[C@H]1CC[C@H](NC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC1 ZINC000479412187 935837252 /nfs/dbraw/zinc/83/72/52/935837252.db2.gz ADJBBLOLXYJPBR-CTYIDZIISA-N 0 0 356.426 3.694 20 5 FHBDRN CSc1ccc(O[C@@H](C)C(=O)N2CCc3cc([N+](=O)[O-])ccc32)cc1 ZINC000127933294 935850806 /nfs/dbraw/zinc/85/08/06/935850806.db2.gz NWAKVVKAFROGID-LBPRGKRZSA-N 0 0 358.419 3.673 20 5 FHBDRN Cc1cc(C(=O)Nc2cccc(CN3CCCCC3=O)c2)cc([N+](=O)[O-])c1 ZINC000050473470 935867271 /nfs/dbraw/zinc/86/72/71/935867271.db2.gz MRJPFSQKCXYBRU-UHFFFAOYSA-N 0 0 367.405 3.668 20 5 FHBDRN Cc1ccccc1[C@@H]1C[C@H]1C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2 ZINC000127963455 935869464 /nfs/dbraw/zinc/86/94/64/935869464.db2.gz BWIGIUNGWOKSSB-LSDHHAIUSA-N 0 0 368.389 3.807 20 5 FHBDRN CO[C@H](c1ccccc1Cl)[C@H](C)NC(=O)c1ccc([N+](=O)[O-])cc1F ZINC000479648258 935871794 /nfs/dbraw/zinc/87/17/94/935871794.db2.gz OPQLAOIYZBAYTQ-QFYYESIMSA-N 0 0 366.776 3.893 20 5 FHBDRN Cc1coc(-c2ccc(C)c(NCc3ccc(C(N)=O)cc3[N+](=O)[O-])c2)n1 ZINC000127980535 935873393 /nfs/dbraw/zinc/87/33/93/935873393.db2.gz SAYNOFWWAWPWFH-UHFFFAOYSA-N 0 0 366.377 3.578 20 5 FHBDRN CC(C)(C)OC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1ccc([N+](=O)[O-])cc1 ZINC000479750676 935886424 /nfs/dbraw/zinc/88/64/24/935886424.db2.gz HVVBYHZUEHFYJA-XIRDDKMYSA-N 0 0 374.437 3.710 20 5 FHBDRN COc1ccccc1CN(Cc1ccccc1[N+](=O)[O-])C[C@@H]1CCCO1 ZINC000051798468 935890518 /nfs/dbraw/zinc/89/05/18/935890518.db2.gz BZJVPOHYJGJIEY-SFHVURJKSA-N 0 0 356.422 3.785 20 5 FHBDRN O=C(NCCc1ccccc1[N+](=O)[O-])c1coc(-c2ccccc2Cl)n1 ZINC000548746004 935898418 /nfs/dbraw/zinc/89/84/18/935898418.db2.gz JWQMGECAFFZCSS-UHFFFAOYSA-N 0 0 371.780 3.876 20 5 FHBDRN Cc1c(NC(=O)N2CCC[C@]3(C2)OCc2ccccc23)cccc1[N+](=O)[O-] ZINC000479821833 935899907 /nfs/dbraw/zinc/89/99/07/935899907.db2.gz IRKJWPKCODZEFN-HXUWFJFHSA-N 0 0 367.405 3.957 20 5 FHBDRN Cc1ccccc1C[C@@H](C)NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000519114319 945136289 /nfs/dbraw/zinc/13/62/89/945136289.db2.gz LSWVLUOYMIVPKP-MRXNPFEDSA-N 0 0 367.449 3.864 20 5 FHBDRN CC(C)Oc1nc(N2CCC(OCC3CCCC3)CC2)ccc1[N+](=O)[O-] ZINC000563424681 935909759 /nfs/dbraw/zinc/90/97/59/935909759.db2.gz FOXCVGDRCIDWMP-UHFFFAOYSA-N 0 0 363.458 3.953 20 5 FHBDRN COc1cc(C(=O)NC2CCC(C)(C)CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000128043169 935913762 /nfs/dbraw/zinc/91/37/62/935913762.db2.gz YCVRZEDYEZORKN-UHFFFAOYSA-N 0 0 372.368 3.903 20 5 FHBDRN C[C@H](Sc1ccccn1)C(=O)OCc1cc([N+](=O)[O-])ccc1Cl ZINC000135174651 935921696 /nfs/dbraw/zinc/92/16/96/935921696.db2.gz LLLKXAPKTJIJAO-JTQLQIEISA-N 0 0 352.799 3.867 20 5 FHBDRN O=C(CC1CCSCC1)OCc1cnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000135178714 935921910 /nfs/dbraw/zinc/92/19/10/935921910.db2.gz MVFZBGIXRUFBPC-UHFFFAOYSA-N 0 0 362.407 3.826 20 5 FHBDRN Cc1c([N+](=O)[O-])cc(C(=O)NC(C)(C)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000728499569 935925908 /nfs/dbraw/zinc/92/59/08/935925908.db2.gz SFHSNJOQVAIFBE-UHFFFAOYSA-N 0 0 361.329 3.616 20 5 FHBDRN CCN(CC)C(=O)c1ccc(Nc2ncnc3ccc([N+](=O)[O-])cc32)cc1 ZINC000611699658 935936315 /nfs/dbraw/zinc/93/63/15/935936315.db2.gz GFRHZIVDCZGGRS-UHFFFAOYSA-N 0 0 365.393 3.764 20 5 FHBDRN COc1ccccc1CN(c1ncnc2ccc([N+](=O)[O-])cc21)C1CC1 ZINC000611700276 935939507 /nfs/dbraw/zinc/93/95/07/935939507.db2.gz FXTMGPJCIAPURT-UHFFFAOYSA-N 0 0 350.378 3.716 20 5 FHBDRN CCn1c(C)nc([N+](=O)[O-])c1N1CCC[C@@H](Oc2ccccc2Cl)C1 ZINC000582686686 935941119 /nfs/dbraw/zinc/94/11/19/935941119.db2.gz CEOKYOUODQIKIM-CYBMUJFWSA-N 0 0 364.833 3.821 20 5 FHBDRN O=C(Nc1cc(F)cc([N+](=O)[O-])c1)c1cnn(-c2ccccc2Cl)c1 ZINC000548750896 935943684 /nfs/dbraw/zinc/94/36/84/935943684.db2.gz LAMNUBPORGIANZ-UHFFFAOYSA-N 0 0 360.732 3.825 20 5 FHBDRN O=[N+]([O-])c1ccc2ncnc(N[C@H]3CCN(c4ccc(F)cc4F)C3)c2c1 ZINC000611706491 935945123 /nfs/dbraw/zinc/94/51/23/935945123.db2.gz MZWBQVYLGPRAKC-LBPRGKRZSA-N 0 0 371.347 3.507 20 5 FHBDRN CC[C@H](NC(=O)c1cc(OC)c(C)c([N+](=O)[O-])c1)c1nc2ccccc2[nH]1 ZINC000480041980 935945138 /nfs/dbraw/zinc/94/51/38/935945138.db2.gz RXGTWZPAPUGSLO-ZDUSSCGKSA-N 0 0 368.393 3.669 20 5 FHBDRN Cc1cc(NC(=O)N(C)CCc2ccccc2[N+](=O)[O-])cnc1C(F)F ZINC000934593189 935951463 /nfs/dbraw/zinc/95/14/63/935951463.db2.gz VQDKNGGOFVMGEM-UHFFFAOYSA-N 0 0 364.352 3.942 20 5 FHBDRN O=[N+]([O-])c1cc(CN2CCC[C@H](O)C2)ccc1Oc1ccccc1Cl ZINC000158746687 935954015 /nfs/dbraw/zinc/95/40/15/935954015.db2.gz IHNNVSUTMSSNHK-AWEZNQCLSA-N 0 0 362.813 3.997 20 5 FHBDRN CCn1nc(C)c([N+](=O)[O-])c1N[C@H]1CCN(c2ccc(Cl)c(F)c2)C1 ZINC000480080462 935959294 /nfs/dbraw/zinc/95/92/94/935959294.db2.gz BPYNJNVYNUPMQQ-NSHDSACASA-N 0 0 367.812 3.603 20 5 FHBDRN CC(C)c1ccc(C(=O)Nc2nc(-c3cnn(C)c3)cs2)cc1[N+](=O)[O-] ZINC000187774464 935959816 /nfs/dbraw/zinc/95/98/16/935959816.db2.gz WTMPANLFMPUQBP-UHFFFAOYSA-N 0 0 371.422 3.828 20 5 FHBDRN C[C@H](Nc1ncnc2ccc([N+](=O)[O-])cc21)c1cccc(-n2cccn2)c1 ZINC000611709923 935965906 /nfs/dbraw/zinc/96/59/06/935965906.db2.gz XRVVTMBDYIYAJA-ZDUSSCGKSA-N 0 0 360.377 3.897 20 5 FHBDRN CCC[C@H](NC(=O)c1c([N+](=O)[O-])cnn1C)c1cccc(C(F)(F)F)c1 ZINC000166113605 935966234 /nfs/dbraw/zinc/96/62/34/935966234.db2.gz OKVBKOSXMILAJZ-LBPRGKRZSA-N 0 0 370.331 3.618 20 5 FHBDRN CC(C)CCC(=O)Oc1cc([N+](=O)[O-])ccc1I ZINC000781744590 935972787 /nfs/dbraw/zinc/97/27/87/935972787.db2.gz DPWIOHDQVQTRKD-UHFFFAOYSA-N 0 0 363.151 3.541 20 5 FHBDRN O=[N+]([O-])c1ccc2ncnc(N3CCO[C@H](c4ccccc4Cl)C3)c2c1 ZINC000611711246 935981322 /nfs/dbraw/zinc/98/13/22/935981322.db2.gz UPUDHMNTFAIKPK-KRWDZBQOSA-N 0 0 370.796 3.769 20 5 FHBDRN Cc1ccc([C@@H]2OCCC[C@H]2NC(=O)c2ccc([N+](=O)[O-])cc2C)cc1 ZINC000074517754 935983950 /nfs/dbraw/zinc/98/39/50/935983950.db2.gz SNTBNOKIMBMIER-MOPGFXCFSA-N 0 0 354.406 3.862 20 5 FHBDRN CCS[C@H]1CCC[C@H]1NC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000431478507 935993343 /nfs/dbraw/zinc/99/33/43/935993343.db2.gz QSVJNJCMFXMLPJ-OLZOCXBDSA-N 0 0 373.272 3.761 20 5 FHBDRN CCOCc1ccc(NC(=O)CCOc2cc(C)ccc2[N+](=O)[O-])cc1 ZINC000075585933 936013210 /nfs/dbraw/zinc/01/32/10/936013210.db2.gz MAWRJEMPJFASDO-UHFFFAOYSA-N 0 0 358.394 3.847 20 5 FHBDRN Cc1nc(-c2ccccc2NC(=O)c2cc([N+](=O)[O-])ccc2Cl)no1 ZINC000076162786 936023995 /nfs/dbraw/zinc/02/39/95/936023995.db2.gz GTSWSHOHCKCVKV-UHFFFAOYSA-N 0 0 358.741 3.859 20 5 FHBDRN COc1cc(C(=O)N(CCc2ccccc2)CC(C)C)ccc1[N+](=O)[O-] ZINC000511191859 936031811 /nfs/dbraw/zinc/03/18/11/936031811.db2.gz SGKQIVPQEFDRCA-UHFFFAOYSA-N 0 0 356.422 3.944 20 5 FHBDRN Cc1ccc2c(c1C)OC[C@@H]2NC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000077334879 936045112 /nfs/dbraw/zinc/04/51/12/936045112.db2.gz GCQFHFKZTCTYRC-KRWDZBQOSA-N 0 0 351.362 3.556 20 5 FHBDRN O=[N+]([O-])c1ccc2ncnc(N[C@@H](c3ccccc3)[C@@H]3CCCO3)c2c1 ZINC000611711794 936045342 /nfs/dbraw/zinc/04/53/42/936045342.db2.gz ZZQTWWZFXPBXFF-ROUUACIJSA-N 0 0 350.378 3.870 20 5 FHBDRN Cc1ccnc(Oc2ccc([N+](=O)[O-])cc2Br)c1[N+](=O)[O-] ZINC000077989478 936056149 /nfs/dbraw/zinc/05/61/49/936056149.db2.gz OQEHZZJBUZBKER-UHFFFAOYSA-N 0 0 354.116 3.761 20 5 FHBDRN CC(=O)c1ccc(Nc2ccc(N3CCOC[C@H]3C)cc2)c([N+](=O)[O-])c1 ZINC000078019897 936056271 /nfs/dbraw/zinc/05/62/71/936056271.db2.gz LSMCVECHBWFBKM-CYBMUJFWSA-N 0 0 355.394 3.766 20 5 FHBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCn2cc(C)nc2C1 ZINC000611894777 936083339 /nfs/dbraw/zinc/08/33/39/936083339.db2.gz KJCIVPWXCACWQX-UHFFFAOYSA-N 0 0 374.466 3.648 20 5 FHBDRN O=[N+]([O-])c1ccc(N[C@H](CCO)c2cccs2)c(Br)c1 ZINC000078301323 936092966 /nfs/dbraw/zinc/09/29/66/936092966.db2.gz DQLJDYYNPXWMGC-GFCCVEGCSA-N 0 0 357.229 3.954 20 5 FHBDRN Cc1sc(S(=O)(=O)NCc2ccc3sccc3c2)cc1[N+](=O)[O-] ZINC000582778462 936106662 /nfs/dbraw/zinc/10/66/62/936106662.db2.gz XRSWTECVRUXHPV-UHFFFAOYSA-N 0 0 368.461 3.658 20 5 FHBDRN O=C(OCCCc1ccncc1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000051900181 936107002 /nfs/dbraw/zinc/10/70/02/936107002.db2.gz UDJLZAJUBYAMHA-UHFFFAOYSA-N 0 0 369.402 3.903 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])Nc1ccccc1OCC(F)(F)F ZINC000061110894 936121337 /nfs/dbraw/zinc/12/13/37/936121337.db2.gz OTIMZSZYAJKLAO-UHFFFAOYSA-N 0 0 369.299 3.858 20 5 FHBDRN CCSc1nccnc1-c1noc(C(C)(C)c2ccccc2[N+](=O)[O-])n1 ZINC000426545772 945145768 /nfs/dbraw/zinc/14/57/68/945145768.db2.gz RVZTULSWZBCEPO-UHFFFAOYSA-N 0 0 371.422 3.873 20 5 FHBDRN C[C@H]1CN(c2ncc([N+](=O)[O-])cc2Cl)C[C@H](c2ccc(F)cc2)O1 ZINC000078369487 936132060 /nfs/dbraw/zinc/13/20/60/936132060.db2.gz FOYDSCYWDUSAER-ZUZCIYMTSA-N 0 0 351.765 3.749 20 5 FHBDRN Cc1ccnc(Oc2ccc(Br)cc2[N+](=O)[O-])c1[N+](=O)[O-] ZINC000078413078 936149873 /nfs/dbraw/zinc/14/98/73/936149873.db2.gz DIIQSIKTUMTEGF-UHFFFAOYSA-N 0 0 354.116 3.761 20 5 FHBDRN C[C@@H](CCc1cccn1C)Nc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1 ZINC000078423534 936154107 /nfs/dbraw/zinc/15/41/07/936154107.db2.gz ZDVABMAKDAUXPK-HNNXBMFYSA-N 0 0 370.453 3.603 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)c1c(Cl)cc(F)cc1Cl ZINC000431490733 936155818 /nfs/dbraw/zinc/15/58/18/936155818.db2.gz NEMQORVZPFUCDR-UHFFFAOYSA-N 0 0 373.167 3.979 20 5 FHBDRN Cc1c2ccccc2n(C)c1CNC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000582809660 936157495 /nfs/dbraw/zinc/15/74/95/936157495.db2.gz YOXIPFZUZIPAHY-UHFFFAOYSA-N 0 0 373.359 3.532 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1N1CCC([C@H]2CCOC2)CC1 ZINC000612099178 936163649 /nfs/dbraw/zinc/16/36/49/936163649.db2.gz RUMFUQUZNGASDW-LBPRGKRZSA-N 0 0 355.232 3.610 20 5 FHBDRN O=C(c1csc([N+](=O)[O-])c1)N1CCCCC[C@@H]1[C@H]1CCCCC1=O ZINC000178675680 936166334 /nfs/dbraw/zinc/16/63/34/936166334.db2.gz XDHMGQXYMPCPLP-ZIAGYGMSSA-N 0 0 350.440 3.800 20 5 FHBDRN CNC(=O)c1ccc(N2C[C@@H](C)C[C@H]2c2ccccc2F)c([N+](=O)[O-])c1 ZINC000078502702 936181994 /nfs/dbraw/zinc/18/19/94/936181994.db2.gz FRTYDMJKDUWQGC-SJCJKPOMSA-N 0 0 357.385 3.681 20 5 FHBDRN CC(C)C1CCN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)CC1 ZINC000431495070 936202522 /nfs/dbraw/zinc/20/25/22/936202522.db2.gz OOHJFZKDJWLKBH-UHFFFAOYSA-N 0 0 355.232 3.866 20 5 FHBDRN COc1cc(Cc2noc([C@H](c3cccnc3)C(C)C)n2)ccc1[N+](=O)[O-] ZINC000582837787 936202562 /nfs/dbraw/zinc/20/25/62/936202562.db2.gz DUSUDVLWBUEXFS-SFHVURJKSA-N 0 0 368.393 3.760 20 5 FHBDRN COC(=O)c1cc(C(=O)N(C)Cc2ccc(C(C)C)cc2)cc([N+](=O)[O-])c1 ZINC000015386997 945149612 /nfs/dbraw/zinc/14/96/12/945149612.db2.gz BRZAQCDKYISZCT-UHFFFAOYSA-N 0 0 370.405 3.777 20 5 FHBDRN O=C(N[C@@H](C1CCCCC1)C(F)(F)F)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000440000361 945150132 /nfs/dbraw/zinc/15/01/32/945150132.db2.gz OSENSIXMCHPBRD-AWEZNQCLSA-N 0 0 370.331 3.712 20 5 FHBDRN CCn1c(C)nc([N+](=O)[O-])c1N1C[C@H](c2cc(C)ccc2C)OC[C@H]1C ZINC000572875874 936218227 /nfs/dbraw/zinc/21/82/27/936218227.db2.gz GRQIXRUTNYLENB-RHSMWYFYSA-N 0 0 358.442 3.703 20 5 FHBDRN O=C(c1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCC([C@H]2CCOC2)CC1 ZINC000612346500 936222586 /nfs/dbraw/zinc/22/25/86/936222586.db2.gz MKGIPNVUJQKJIK-LBPRGKRZSA-N 0 0 372.343 3.502 20 5 FHBDRN O=[N+]([O-])c1cncc(Br)c1N[C@H]1CCc2c1cccc2O ZINC000091485222 936228954 /nfs/dbraw/zinc/22/89/54/936228954.db2.gz NESFNABVAFZJEJ-NSHDSACASA-N 0 0 350.172 3.557 20 5 FHBDRN Cc1cnc(Oc2ccc([N+](=O)[O-])cc2Br)c([N+](=O)[O-])c1 ZINC000078665636 936232205 /nfs/dbraw/zinc/23/22/05/936232205.db2.gz OJJSCGMDJIWZPL-UHFFFAOYSA-N 0 0 354.116 3.761 20 5 FHBDRN COC(=O)c1cccc(NC(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)c1C ZINC000612449872 936242152 /nfs/dbraw/zinc/24/21/52/936242152.db2.gz AHKRZICKMVGZCU-LLVKDONJSA-N 0 0 360.341 3.571 20 5 FHBDRN CNc1ccc([N+](=O)[O-])cc1NC(=O)c1cccc([C@@H]2CCCOC2)c1 ZINC000519600071 945151776 /nfs/dbraw/zinc/15/17/76/945151776.db2.gz DPKOJWIKLNTHCA-OAHLLOKOSA-N 0 0 355.394 3.783 20 5 FHBDRN C[C@H](C(=O)N[C@H]1COc2c1cccc2Cl)c1ccc([N+](=O)[O-])cc1F ZINC000612478712 936253950 /nfs/dbraw/zinc/25/39/50/936253950.db2.gz BYJLVUCEUDOVDG-VFZGTOFNSA-N 0 0 364.760 3.741 20 5 FHBDRN COc1cccc(CN(C)C(=O)c2c([N+](=O)[O-])cccc2C(F)(F)F)c1 ZINC000612518319 936261817 /nfs/dbraw/zinc/26/18/17/936261817.db2.gz VQLALMPYZWVBNY-UHFFFAOYSA-N 0 0 368.311 3.894 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CCO[C@@H](c2cccs2)C1 ZINC000161549098 936268122 /nfs/dbraw/zinc/26/81/22/936268122.db2.gz IZZVIGLJRYZUNW-CYBMUJFWSA-N 0 0 352.799 3.523 20 5 FHBDRN COc1ccc(-n2ccc(CN[C@H](C)c3cccc([N+](=O)[O-])c3C)n2)cc1 ZINC000178711989 936276098 /nfs/dbraw/zinc/27/60/98/936276098.db2.gz YWIMWCTXGBOWCJ-OAHLLOKOSA-N 0 0 366.421 3.948 20 5 FHBDRN CCc1ccc(-c2csc(NC(=O)c3ccc([N+](=O)[O-])n3C)n2)s1 ZINC000612580323 936277374 /nfs/dbraw/zinc/27/73/74/936277374.db2.gz QYMBELJNAYFHBZ-UHFFFAOYSA-N 0 0 362.436 3.933 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](Cc1ccccc1)[C@@H](O)C(F)(F)F ZINC000612580289 936277571 /nfs/dbraw/zinc/27/75/71/936277571.db2.gz NBHXJPUTLOMHON-IAGOWNOFSA-N 0 0 368.355 3.527 20 5 FHBDRN C[C@H](CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)Cc1cccs1 ZINC000135846471 936278056 /nfs/dbraw/zinc/27/80/56/936278056.db2.gz NTHURUVUIUDWQK-LBPRGKRZSA-N 0 0 357.435 3.675 20 5 FHBDRN CCN1C(=O)CCc2cc(Nc3ncnc4ccc([N+](=O)[O-])cc43)ccc21 ZINC000612664977 936304168 /nfs/dbraw/zinc/30/41/68/936304168.db2.gz ANXCGTMOIGXGMA-UHFFFAOYSA-N 0 0 363.377 3.581 20 5 FHBDRN CC[C@@]1(CNC(=O)Nc2cc(F)cc([N+](=O)[O-])c2)OCCc2ccccc21 ZINC000582933847 936305973 /nfs/dbraw/zinc/30/59/73/936305973.db2.gz VIRDPHZWULUXNH-IBGZPJMESA-N 0 0 373.384 3.734 20 5 FHBDRN Cc1ccc(SCCn2cnc3cc([N+](=O)[O-])ccc3c2=O)cc1C ZINC000078922205 936309258 /nfs/dbraw/zinc/30/92/58/936309258.db2.gz YSMYGAGMJVSKOX-UHFFFAOYSA-N 0 0 355.419 3.714 20 5 FHBDRN CN(Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)Cc1ccc(F)cc1F ZINC000047406888 945157822 /nfs/dbraw/zinc/15/78/22/945157822.db2.gz HRIKMQBAUSKTAG-UHFFFAOYSA-N 0 0 360.320 3.555 20 5 FHBDRN COC(=O)CCc1ccc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)cc1 ZINC000519132366 945159299 /nfs/dbraw/zinc/15/92/99/945159299.db2.gz ROYKSQDTCFUPFM-UHFFFAOYSA-N 0 0 368.345 3.699 20 5 FHBDRN CC(C)[C@@H](O)C(C)(C)CNC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000178878886 938250009 /nfs/dbraw/zinc/25/00/09/938250009.db2.gz HBOBGOFRWPVWBU-OAHLLOKOSA-N 0 0 350.440 3.582 20 5 FHBDRN Cc1ccc([C@@H]2OCCC[C@@H]2CNC(=O)c2c(F)cccc2[N+](=O)[O-])cc1 ZINC000601262307 938261840 /nfs/dbraw/zinc/26/18/40/938261840.db2.gz YCLWZDDJGLGHJM-BEFAXECRSA-N 0 0 372.396 3.940 20 5 FHBDRN Cc1cc(Cc2noc(-c3cccc(-n4cccn4)c3)n2)ccc1[N+](=O)[O-] ZINC000583472843 938268991 /nfs/dbraw/zinc/26/89/91/938268991.db2.gz GOOQIWFWNSKTFP-UHFFFAOYSA-N 0 0 361.361 3.730 20 5 FHBDRN CC[C@H](O[C@@H]1CCC[C@@H](C)C1)C(=O)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000536043945 938270035 /nfs/dbraw/zinc/27/00/35/938270035.db2.gz QLXWWWCPNADZNX-OGWOLHLISA-N 0 0 360.454 3.853 20 5 FHBDRN CNc1ccc(C(=O)N[C@H]2C[C@H](c3cc(F)cc(F)c3)C2)cc1[N+](=O)[O-] ZINC000583478704 938270602 /nfs/dbraw/zinc/27/06/02/938270602.db2.gz VEQARECNOFKDOZ-NNUKFRKNSA-N 0 0 361.348 3.591 20 5 FHBDRN CN1CCN(C)[C@H](c2nc(-c3cc4ccccc4c4ccccc34)no2)C1 ZINC001211584987 938284176 /nfs/dbraw/zinc/28/41/76/938284176.db2.gz JNHGDGILWMCZJG-FQEVSTJZSA-N 0 0 358.445 3.961 20 5 FHBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1N)c1ccc(F)c2ccccc21 ZINC000583521147 938290137 /nfs/dbraw/zinc/29/01/37/938290137.db2.gz WBQWSHFCBSRXOY-NSHDSACASA-N 0 0 353.353 3.960 20 5 FHBDRN COC1(c2noc(-c3ccc(C(C)(C)C)c([N+](=O)[O-])c3)n2)CCOCC1 ZINC000278295769 938290768 /nfs/dbraw/zinc/29/07/68/938290768.db2.gz VSZLCUKYAVJUHE-UHFFFAOYSA-N 0 0 361.398 3.594 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CSc1nnc(-c2cccc(C)c2)n1C ZINC000024222886 938294615 /nfs/dbraw/zinc/29/46/15/938294615.db2.gz DUOIUBQCCOYAER-UHFFFAOYSA-N 0 0 370.434 4.000 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NCC1(C)CCCCCC1 ZINC000583536061 938296075 /nfs/dbraw/zinc/29/60/75/938296075.db2.gz SGBQFYANRYAJFQ-UHFFFAOYSA-N 0 0 361.442 3.572 20 5 FHBDRN Cc1ccc(OCCCC(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)c(C)c1 ZINC000536064047 938297048 /nfs/dbraw/zinc/29/70/48/938297048.db2.gz RFFXRSNCQNTDFN-UHFFFAOYSA-N 0 0 368.433 3.956 20 5 FHBDRN Cc1cc(NC(=O)c2ncoc2[C@@H]2CCCO2)c2cc([N+](=O)[O-])ccc2n1 ZINC000161765042 938299771 /nfs/dbraw/zinc/29/97/71/938299771.db2.gz PGIHOWOYEWLWDE-HNNXBMFYSA-N 0 0 368.349 3.543 20 5 FHBDRN Cc1cc(F)cc(C(=O)N[C@H]2CCOc3c(Cl)cccc32)c1[N+](=O)[O-] ZINC000176785881 938302343 /nfs/dbraw/zinc/30/23/43/938302343.db2.gz LDCLASMTRPADNH-AWEZNQCLSA-N 0 0 364.760 3.949 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)F)cc1Nc1cnn(CC(F)(F)F)c1 ZINC000278316892 938304111 /nfs/dbraw/zinc/30/41/11/938304111.db2.gz HNSIISKFWGXXOS-UHFFFAOYSA-N 0 0 355.198 3.511 20 5 FHBDRN O=C(c1sc(Br)cc1[N+](=O)[O-])N(CC(F)(F)F)C1CC1 ZINC000278321384 938307093 /nfs/dbraw/zinc/30/70/93/938307093.db2.gz VOZMHJVWEIDJST-UHFFFAOYSA-N 0 0 373.150 3.586 20 5 FHBDRN Cc1nn(C(F)F)c(C)c1Cc1nc(-c2ccc([N+](=O)[O-])s2)no1 ZINC000278323112 938307408 /nfs/dbraw/zinc/30/74/08/938307408.db2.gz ZBTYGKVUDASZJB-UHFFFAOYSA-N 0 0 355.326 3.506 20 5 FHBDRN COc1ccc(NC(=O)C2CC(OCc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000611777783 938308712 /nfs/dbraw/zinc/30/87/12/938308712.db2.gz YQLHPNSVKWKSSO-UHFFFAOYSA-N 0 0 356.378 3.537 20 5 FHBDRN Cc1nn(Cc2ccc(C(=O)N[C@H]3CCCC3(C)C)cc2)c(C)c1[N+](=O)[O-] ZINC000427180351 945164021 /nfs/dbraw/zinc/16/40/21/945164021.db2.gz YEEBAWCMZYKENB-KRWDZBQOSA-N 0 0 370.453 3.765 20 5 FHBDRN CC(C)(C(=O)N1CCO[C@@H](c2ccsc2)C1)c1ccccc1[N+](=O)[O-] ZINC000583634662 938330134 /nfs/dbraw/zinc/33/01/34/938330134.db2.gz CTVUXVCPAVUHGT-MRXNPFEDSA-N 0 0 360.435 3.534 20 5 FHBDRN C[C@H](NC(=O)N1CCOC[C@H]1c1ccc(F)cc1)c1ccccc1[N+](=O)[O-] ZINC000458624360 938337420 /nfs/dbraw/zinc/33/74/20/938337420.db2.gz RONCFGGRLQHSRV-UGSOOPFHSA-N 0 0 373.384 3.578 20 5 FHBDRN CCOC(=O)c1sc2ncnc(NCc3ccc([N+](=O)[O-])cc3)c2c1C ZINC000052488137 938338994 /nfs/dbraw/zinc/33/89/94/938338994.db2.gz CGYQKTNIVGVNJF-UHFFFAOYSA-N 0 0 372.406 3.697 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1CCCOc2ccccc21 ZINC000536098608 938346749 /nfs/dbraw/zinc/34/67/49/938346749.db2.gz JNSWRHZYZOYLPT-AWEZNQCLSA-N 0 0 356.378 3.637 20 5 FHBDRN Cc1ccccc1-c1nc(COC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)no1 ZINC000161819658 938347054 /nfs/dbraw/zinc/34/70/54/938347054.db2.gz KEGGMUJNKRSTRU-DHZHZOJOSA-N 0 0 365.345 3.710 20 5 FHBDRN Cc1ccc(Br)cc1-c1noc(-c2cccnc2[N+](=O)[O-])n1 ZINC001213171965 938359387 /nfs/dbraw/zinc/35/93/87/938359387.db2.gz JAYHATYYFPODHO-UHFFFAOYSA-N 0 0 361.155 3.778 20 5 FHBDRN COCc1cccc(CNC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1 ZINC000163387566 938362663 /nfs/dbraw/zinc/36/26/63/938362663.db2.gz BPUBWGISCNSNHK-UHFFFAOYSA-N 0 0 369.421 3.615 20 5 FHBDRN CC(C)[C@H]1CCC[C@H](NS(=O)(=O)CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC001211594599 938366613 /nfs/dbraw/zinc/36/66/13/938366613.db2.gz IUJBLBCFQQRRFZ-IRXDYDNUSA-N 0 0 368.499 3.662 20 5 FHBDRN COc1ccc(CC(=O)Nc2cc(C)nc3ccc([N+](=O)[O-])cc32)cc1 ZINC000161850177 938370823 /nfs/dbraw/zinc/37/08/23/938370823.db2.gz QTPYEUVADLRGTN-UHFFFAOYSA-N 0 0 351.362 3.641 20 5 FHBDRN C[C@H]1OCC[C@@H]1Sc1cc(C(F)(F)C(F)(F)F)ncc1[N+](=O)[O-] ZINC000278396547 938381794 /nfs/dbraw/zinc/38/17/94/938381794.db2.gz GHRXBPMVIICGHT-SVRRBLITSA-N 0 0 358.288 3.913 20 5 FHBDRN C[C@@H]1OCC[C@H]1Sc1cc(C(F)(F)C(F)(F)F)ncc1[N+](=O)[O-] ZINC000278396538 938381924 /nfs/dbraw/zinc/38/19/24/938381924.db2.gz GHRXBPMVIICGHT-POYBYMJQSA-N 0 0 358.288 3.913 20 5 FHBDRN CC(C)c1nn(C)cc1-c1noc(C(C)(C)c2ccc([N+](=O)[O-])cc2)n1 ZINC000426207050 945170299 /nfs/dbraw/zinc/17/02/99/945170299.db2.gz HMIXLHOAMSKMJT-UHFFFAOYSA-N 0 0 355.398 3.828 20 5 FHBDRN O=[N+]([O-])c1cc(S(=O)(=O)C(F)F)ccc1Nc1cccc(Cl)c1 ZINC000219270110 938395571 /nfs/dbraw/zinc/39/55/71/938395571.db2.gz DJSLFCDAYWDYBN-UHFFFAOYSA-N 0 0 362.741 3.988 20 5 FHBDRN CCCOc1cc(NC(=O)[C@@H]2CCO[C@H]2C)c([N+](=O)[O-])cc1OCCC ZINC000536125141 938406687 /nfs/dbraw/zinc/40/66/87/938406687.db2.gz FMKXRKIWOMTWMV-QWHCGFSZSA-N 0 0 366.414 3.536 20 5 FHBDRN COc1ccc(C)cc1[C@@H](C)NC(=O)NCc1cccc([N+](=O)[O-])c1C ZINC000458686949 938425709 /nfs/dbraw/zinc/42/57/09/938425709.db2.gz IHMKRKTUIZIVRB-CQSZACIVSA-N 0 0 357.410 3.781 20 5 FHBDRN C[C@H]1CN(c2c(Cl)cc(Cl)cc2[N+](=O)[O-])C[C@]2(CCCOC2)O1 ZINC000408108913 945174097 /nfs/dbraw/zinc/17/40/97/945174097.db2.gz VBKWIUWBXFBQMT-BONVTDFDSA-N 0 0 361.225 3.676 20 5 FHBDRN Cc1c(NC(=O)C(=O)N[C@H]2CCC[C@@H]2CCC(C)C)cccc1[N+](=O)[O-] ZINC000070026191 938435956 /nfs/dbraw/zinc/43/59/56/938435956.db2.gz UWYODNVXOMDWPF-ZBFHGGJFSA-N 0 0 361.442 3.563 20 5 FHBDRN O=C(c1csc([N+](=O)[O-])c1)N1CCC[C@H](c2nc3ccccc3o2)C1 ZINC000052620924 938444286 /nfs/dbraw/zinc/44/42/86/938444286.db2.gz GVKNIQFHHCCCTG-NSHDSACASA-N 0 0 357.391 3.817 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H]1CC[C@@H]2CCCC[C@@H]2C1 ZINC000583842826 938446573 /nfs/dbraw/zinc/44/65/73/938446573.db2.gz NJIOVBNUJGSCAH-ARFHVFGLSA-N 0 0 373.453 3.571 20 5 FHBDRN CCOC(=O)[C@@]1(NCc2ccc([N+](=O)[O-])cc2Cl)CCc2ccccc21 ZINC000611791376 938449184 /nfs/dbraw/zinc/44/91/84/938449184.db2.gz MKKSIIOTDVUKHC-LJQANCHMSA-N 0 0 374.824 3.743 20 5 FHBDRN Cc1csc(CCCCNC(=O)c2cc(F)cc(C)c2[N+](=O)[O-])n1 ZINC000176802312 938451448 /nfs/dbraw/zinc/45/14/48/938451448.db2.gz KCSYBDCRBWKCOB-UHFFFAOYSA-N 0 0 351.403 3.560 20 5 FHBDRN C[C@H]1C[C@H](CNC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)CCO1 ZINC000536149606 938459561 /nfs/dbraw/zinc/45/95/61/938459561.db2.gz HMBXPVPVOHICNX-LSDHHAIUSA-N 0 0 370.405 3.932 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)CCCc1cc(F)ccc1F ZINC000124222309 945176536 /nfs/dbraw/zinc/17/65/36/945176536.db2.gz NXEXTBXHXSYGTC-UHFFFAOYSA-N 0 0 364.348 3.521 20 5 FHBDRN CC(C)Oc1cccc(C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)n1 ZINC000179008781 938487735 /nfs/dbraw/zinc/48/77/35/938487735.db2.gz YWDSKBNVSRCQMI-UHFFFAOYSA-N 0 0 357.410 3.828 20 5 FHBDRN O=C(NCC1=CCCOC1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000583955522 938502606 /nfs/dbraw/zinc/50/26/06/938502606.db2.gz UGQMGCNHIHVMJC-UHFFFAOYSA-N 0 0 370.430 3.823 20 5 FHBDRN O=C1[C@H](Nc2ccnc3c2cccc3[N+](=O)[O-])CCCN1C1CCCCC1 ZINC000432139703 945180910 /nfs/dbraw/zinc/18/09/10/945180910.db2.gz MTBWZKHVMKOQLD-QGZVFWFLSA-N 0 0 368.437 3.879 20 5 FHBDRN CC1(C)[C@H](NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)[C@@H]2CCCO[C@@H]21 ZINC000437250407 945180976 /nfs/dbraw/zinc/18/09/76/945180976.db2.gz XSXIQRBXZXERMP-MJBXVCDLSA-N 0 0 372.343 3.547 20 5 FHBDRN Cc1c(Br)cc(C(=O)N[C@@H]2CCC[C@@H](F)C2)cc1[N+](=O)[O-] ZINC000583996415 938526141 /nfs/dbraw/zinc/52/61/41/938526141.db2.gz QULHGDKMCMHCQH-GHMZBOCLSA-N 0 0 359.195 3.676 20 5 FHBDRN O=C(C[C@H]1CC[C@@H](C(F)(F)F)O1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000935157312 938531052 /nfs/dbraw/zinc/53/10/52/938531052.db2.gz GISIHBRDSXODQY-CABCVRRESA-N 0 0 372.343 3.586 20 5 FHBDRN O=C(NCc1ccc(OC(F)(F)F)cc1)Nc1cccc([N+](=O)[O-])c1 ZINC000024238993 938558649 /nfs/dbraw/zinc/55/86/49/938558649.db2.gz JWYAFXQBKJBRRE-UHFFFAOYSA-N 0 0 355.272 3.815 20 5 FHBDRN CCn1c(-c2cccc([N+](=O)[O-])c2)nnc1N1CC[C@H](C)C2(CCC2)C1 ZINC000584059767 938575900 /nfs/dbraw/zinc/57/59/00/938575900.db2.gz JGCCGDPUNAJMLI-AWEZNQCLSA-N 0 0 355.442 3.890 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H](C[C@H]1CCOC1)c1ccccc1 ZINC000158810188 938579904 /nfs/dbraw/zinc/57/99/04/938579904.db2.gz BHKIWLDYURPBBS-BEFAXECRSA-N 0 0 354.406 3.801 20 5 FHBDRN CC(C)N(Cc1ccccc1F)c1nnc(-c2ccc([N+](=O)[O-])cc2)n1C ZINC000584081042 938589799 /nfs/dbraw/zinc/58/97/99/938589799.db2.gz FKNWXQDVKHSPPE-UHFFFAOYSA-N 0 0 369.400 3.944 20 5 FHBDRN COc1ccc(OC(=O)/C=C\c2nc3ccccc3s2)cc1[N+](=O)[O-] ZINC000588587421 938597683 /nfs/dbraw/zinc/59/76/83/938597683.db2.gz VYBBBRFBUJIYNH-HJWRWDBZSA-N 0 0 356.359 3.832 20 5 FHBDRN Cc1ccc(NC(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)c2cccnc12 ZINC000584134193 938613737 /nfs/dbraw/zinc/61/37/37/938613737.db2.gz APKRCJODIHDSAF-UHFFFAOYSA-N 0 0 357.316 3.911 20 5 FHBDRN COC(=O)[C@@H](NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)c1ccsc1 ZINC000278657535 938627930 /nfs/dbraw/zinc/62/79/30/938627930.db2.gz HBFGFTOURHDZPC-ZDUSSCGKSA-N 0 0 374.340 3.679 20 5 FHBDRN Cn1cc(C(=O)Nc2ccc(F)cc2F)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000052932654 938662767 /nfs/dbraw/zinc/66/27/67/938662767.db2.gz NDDCNOMSYKUQLZ-UHFFFAOYSA-N 0 0 358.304 3.526 20 5 FHBDRN Cc1cccc(NC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)c1C ZINC000052927250 938663077 /nfs/dbraw/zinc/66/30/77/938663077.db2.gz ZJISYTQENOIKGU-UHFFFAOYSA-N 0 0 350.378 3.864 20 5 FHBDRN C[C@@H](Nc1ccc(C(=O)NC2CCCC2)cc1[N+](=O)[O-])c1ccccn1 ZINC000052933963 938663153 /nfs/dbraw/zinc/66/31/53/938663153.db2.gz RNVRTSMTCSLLPG-CYBMUJFWSA-N 0 0 354.410 3.835 20 5 FHBDRN Cc1ccc(NC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)c(F)c1 ZINC000052935581 938671100 /nfs/dbraw/zinc/67/11/00/938671100.db2.gz FFHANYKETNXARZ-UHFFFAOYSA-N 0 0 354.341 3.695 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N(CC(F)(F)F)[C@@H](C)C(C)C ZINC000573175453 938675639 /nfs/dbraw/zinc/67/56/39/938675639.db2.gz MEWZMMGFJVQZMP-NSHDSACASA-N 0 0 368.377 3.501 20 5 FHBDRN O=C(OC[C@H]1CC1(Cl)Cl)c1ccc(Br)cc1[N+](=O)[O-] ZINC000176818922 938676442 /nfs/dbraw/zinc/67/64/42/938676442.db2.gz OZCKFIYJBRWMHJ-ZCFIWIBFSA-N 0 0 368.998 3.708 20 5 FHBDRN COc1ccc(-c2ccc(C[NH2+]CC3(C(=O)[O-])CCCC3)o2)c([N+](=O)[O-])c1 ZINC000584327575 938688453 /nfs/dbraw/zinc/68/84/53/938688453.db2.gz JATVMCFQEWAOPM-UHFFFAOYSA-N 0 0 374.393 3.598 20 5 FHBDRN Cc1cc(C(=O)N(C)Cc2cc([N+](=O)[O-])ccc2Cl)ccc1[N+](=O)[O-] ZINC000052991192 938695864 /nfs/dbraw/zinc/69/58/64/938695864.db2.gz YXTBPBVBGQUTOY-UHFFFAOYSA-N 0 0 363.757 3.737 20 5 FHBDRN COc1ccc(NC(=O)N2C[C@@H](C(F)(F)F)CC[C@@H]2C)cc1[N+](=O)[O-] ZINC000611825133 938703430 /nfs/dbraw/zinc/70/34/30/938703430.db2.gz MFWLFARNEKOPNS-UWVGGRQHSA-N 0 0 361.320 3.798 20 5 FHBDRN CCCCn1ncc(C(=O)OCc2ccc([N+](=O)[O-])c(OCC)c2)c1C ZINC000755550852 938707588 /nfs/dbraw/zinc/70/75/88/938707588.db2.gz MXMKHNWSRFJXBA-UHFFFAOYSA-N 0 0 361.398 3.656 20 5 FHBDRN O=[N+]([O-])c1ccc2c(-c3nc(Cc4cc(F)cc(F)c4)no3)c[nH]c2c1 ZINC000545589089 945198776 /nfs/dbraw/zinc/19/87/76/945198776.db2.gz XFFKJRPSABBVKX-UHFFFAOYSA-N 0 0 356.288 3.995 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)OCc1ccc(Cl)cc1Cl ZINC000065659542 938779392 /nfs/dbraw/zinc/77/93/92/938779392.db2.gz OAEPVSDRADLJSZ-UHFFFAOYSA-N 0 0 358.181 3.540 20 5 FHBDRN Cc1cc(S(C)(=O)=O)cc(NCc2c(Cl)cccc2[N+](=O)[O-])c1C ZINC000480258729 938783603 /nfs/dbraw/zinc/78/36/03/938783603.db2.gz NMBOYFVGSOIONJ-UHFFFAOYSA-N 0 0 368.842 3.881 20 5 FHBDRN O=C1NCCN1c1cccc(N[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)c1 ZINC000278750064 938794456 /nfs/dbraw/zinc/79/44/56/938794456.db2.gz NTVMMSVBWGIFDK-GOSISDBHSA-N 0 0 352.394 3.614 20 5 FHBDRN Cc1noc(C)c1[C@@H](C)NCc1ccc(Br)cc1[N+](=O)[O-] ZINC000162199682 938800558 /nfs/dbraw/zinc/80/05/58/938800558.db2.gz JGFCXFMFPBCMLN-MRVPVSSYSA-N 0 0 354.204 3.813 20 5 FHBDRN CCc1ccc(C(=O)Nc2ccnn2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000081821329 938803884 /nfs/dbraw/zinc/80/38/84/938803884.db2.gz YQFQOQMLUGHKRI-UHFFFAOYSA-N 0 0 350.378 3.654 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CCO[C@@H](c2ccccc2)C1 ZINC000085638201 938836480 /nfs/dbraw/zinc/83/64/80/938836480.db2.gz VOEIDBYLMBBPRE-QGZVFWFLSA-N 0 0 355.394 3.817 20 5 FHBDRN CCn1c(-c2ccc([N+](=O)[O-])cc2)nn(CN2CC[C@H](C)[C@@H]2C)c1=S ZINC000162208992 938840987 /nfs/dbraw/zinc/84/09/87/938840987.db2.gz RJUZZRYAHCVOOV-STQMWFEESA-N 0 0 361.471 3.697 20 5 FHBDRN Cc1nc2ccc(NC(=O)N(C)CCc3ccccc3[N+](=O)[O-])cc2o1 ZINC000584417857 938844555 /nfs/dbraw/zinc/84/45/55/938844555.db2.gz KKTSPURXCZMMCG-UHFFFAOYSA-N 0 0 354.366 3.751 20 5 FHBDRN Cc1n[nH]c(C(=O)NCc2ccc(C)cc2Oc2ccccc2)c1[N+](=O)[O-] ZINC000088230422 938847218 /nfs/dbraw/zinc/84/72/18/938847218.db2.gz BYAXMLCOLRHUAB-UHFFFAOYSA-N 0 0 366.377 3.657 20 5 FHBDRN O=[N+]([O-])c1cnc2ccc(N[C@@H]3CCCOc4c(Cl)cccc43)nn21 ZINC000302039148 938847419 /nfs/dbraw/zinc/84/74/19/938847419.db2.gz VXIDZPNIYLAIIW-GFCCVEGCSA-N 0 0 359.773 3.617 20 5 FHBDRN Cc1cccc(C)c1OCCCNC(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000065674309 938858638 /nfs/dbraw/zinc/85/86/38/938858638.db2.gz QJNBRBAJTZRTCV-UHFFFAOYSA-N 0 0 371.437 3.599 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2nc(CN3CCO[C@@H](c4ccccc4)C3)co2)cc1 ZINC000089885573 938870851 /nfs/dbraw/zinc/87/08/51/938870851.db2.gz MWBANSXFEAVAGP-LJQANCHMSA-N 0 0 365.389 3.823 20 5 FHBDRN Cc1cc(C)cc(N2CC[C@H](C(=O)Nc3cc([N+](=O)[O-])ccc3C)C2=O)c1 ZINC000053059273 938878216 /nfs/dbraw/zinc/87/82/16/938878216.db2.gz VLUWTLFDUINXSZ-QGZVFWFLSA-N 0 0 367.405 3.512 20 5 FHBDRN Cc1ccc(NC(=O)N2CC[C@@]3(C2)CCc2ccccc2O3)cc1[N+](=O)[O-] ZINC000573251846 938883905 /nfs/dbraw/zinc/88/39/05/938883905.db2.gz ZXBZMGIKVBPWSO-HXUWFJFHSA-N 0 0 367.405 3.905 20 5 FHBDRN CC(C)(C)c1coc(NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)n1 ZINC000518211209 945212917 /nfs/dbraw/zinc/21/29/17/945212917.db2.gz DJXUKERDYYJAIG-UHFFFAOYSA-N 0 0 368.187 3.895 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1ccc(OC(F)F)cc1 ZINC000519202789 945213942 /nfs/dbraw/zinc/21/39/42/945213942.db2.gz LBPYIODTRVASHB-UHFFFAOYSA-N 0 0 372.349 3.559 20 5 FHBDRN CC[C@@H](OC(=O)CC1CCC2(CC1)OCCO2)c1cccc([N+](=O)[O-])c1 ZINC001267374940 938906295 /nfs/dbraw/zinc/90/62/95/938906295.db2.gz VWPAGFCDPQPZKC-QGZVFWFLSA-N 0 0 363.410 3.913 20 5 FHBDRN Cc1cc(OCC(=O)N[C@H](C)c2ccc(F)cc2)c(Cl)cc1[N+](=O)[O-] ZINC000506434968 945215092 /nfs/dbraw/zinc/21/50/92/945215092.db2.gz YSWKZYKBRUFCPW-LLVKDONJSA-N 0 0 366.776 3.952 20 5 FHBDRN Cn1ccnc1C(=O)c1ccc(Nc2ccc3c(c2)CCC3)c([N+](=O)[O-])c1 ZINC000480432239 938919495 /nfs/dbraw/zinc/91/94/95/938919495.db2.gz MSUMCSCPPRNBMU-UHFFFAOYSA-N 0 0 362.389 3.792 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NCc1cn2cc(Cl)ccc2n1 ZINC000093913105 938931953 /nfs/dbraw/zinc/93/19/53/938931953.db2.gz ODCFOIQTUSXYNT-UHFFFAOYSA-N 0 0 372.812 3.751 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(Cc1cccs1)C1CC1 ZINC000065685471 938942339 /nfs/dbraw/zinc/94/23/39/938942339.db2.gz DZNJBVCOOVLQSW-UHFFFAOYSA-N 0 0 366.464 3.572 20 5 FHBDRN CC(C)(C)C[C@@H]1CCCN1C(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000143938628 938950706 /nfs/dbraw/zinc/95/07/06/938950706.db2.gz UHKPHFXDZXCHOF-INIZCTEOSA-N 0 0 356.426 3.821 20 5 FHBDRN CC[C@H](C)Cc1nc(Cc2ccc([N+](=O)[O-])cc2Br)no1 ZINC000562896856 938955937 /nfs/dbraw/zinc/95/59/37/938955937.db2.gz PYMNTQMLIROQMN-VIFPVBQESA-N 0 0 354.204 3.920 20 5 FHBDRN Cc1ccnc(Oc2cccc(I)c2)c1[N+](=O)[O-] ZINC000070495746 938965627 /nfs/dbraw/zinc/96/56/27/938965627.db2.gz NSISCFDXPXCQSP-UHFFFAOYSA-N 0 0 356.119 3.695 20 5 FHBDRN COC(=O)c1cc(NC(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)c(C)cc1C ZINC000480533596 938969931 /nfs/dbraw/zinc/96/99/31/938969931.db2.gz CFHLUJOYRSEGFK-UHFFFAOYSA-N 0 0 372.377 3.568 20 5 FHBDRN C[C@@H]1[C@H](C(F)(F)F)CCN1c1c(Br)cncc1[N+](=O)[O-] ZINC000480550253 938971420 /nfs/dbraw/zinc/97/14/20/938971420.db2.gz GRCHCEAKXXJKIW-RNFRBKRXSA-N 0 0 354.126 3.529 20 5 FHBDRN Cc1ccc(CN(C)C(=O)c2c(Br)cccc2[N+](=O)[O-])s1 ZINC001125714709 938973526 /nfs/dbraw/zinc/97/35/26/938973526.db2.gz AJMQDCMDNBOXLV-UHFFFAOYSA-N 0 0 369.240 3.999 20 5 FHBDRN CC(C)[C@@H](NC(=O)NCCc1ccccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000409631572 938977561 /nfs/dbraw/zinc/97/75/61/938977561.db2.gz OKBCAMWVPUPJGY-GOSISDBHSA-N 0 0 359.401 3.973 20 5 FHBDRN CC[C@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](O)c1ccccc1 ZINC000728593943 938978314 /nfs/dbraw/zinc/97/83/14/938978314.db2.gz KSMYIFRSHVNQIW-GOEBONIOSA-N 0 0 363.801 3.882 20 5 FHBDRN Cn1c(C(=O)N[C@@H]2C[C@H]2c2ccc(Cl)c(Cl)c2)ccc1[N+](=O)[O-] ZINC000437301086 945219764 /nfs/dbraw/zinc/21/97/64/945219764.db2.gz GBVKKBQDKHYATJ-JOYOIKCWSA-N 0 0 354.193 3.526 20 5 FHBDRN Cc1cc(C)cc(OCCNC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)c1 ZINC000065700459 938990488 /nfs/dbraw/zinc/99/04/88/938990488.db2.gz BKDNZLXSESCDFX-UHFFFAOYSA-N 0 0 353.378 3.502 20 5 FHBDRN COC(=O)c1cnc(N[C@@H]2CC[C@H](c3ccc(F)cc3)C2)c([N+](=O)[O-])c1 ZINC000480572479 938994172 /nfs/dbraw/zinc/99/41/72/938994172.db2.gz BGDPCNDTBQVXSD-SWLSCSKDSA-N 0 0 359.357 3.664 20 5 FHBDRN COc1ccc(CNC(=O)Cc2ccc(C(C)(C)C)cc2)cc1[N+](=O)[O-] ZINC000480566064 938994517 /nfs/dbraw/zinc/99/45/17/938994517.db2.gz XBEZKRGNLQGMNM-UHFFFAOYSA-N 0 0 356.422 3.760 20 5 FHBDRN O=[N+]([O-])c1cccc2c1CCN(Cc1nnc(-c3ccccc3)s1)C2 ZINC000545223232 938995078 /nfs/dbraw/zinc/99/50/78/938995078.db2.gz OZRJPLDOFCLXSS-UHFFFAOYSA-N 0 0 352.419 3.672 20 5 FHBDRN Cc1c(NC(=O)[C@@H](C)N2CC[C@H](CC(F)(F)F)C2)cccc1[N+](=O)[O-] ZINC000278781164 938995109 /nfs/dbraw/zinc/99/51/09/938995109.db2.gz NOZWZAULEFEUJS-VXGBXAGGSA-N 0 0 359.348 3.505 20 5 FHBDRN COC(=O)[C@@H](Cc1ccc(C)cc1)Sc1ncc([N+](=O)[O-])cc1Cl ZINC000480577743 938996085 /nfs/dbraw/zinc/99/60/85/938996085.db2.gz IZHOUUYKLZUTIX-CQSZACIVSA-N 0 0 366.826 3.828 20 5 FHBDRN CCN(C(C)=O)c1nc(CN(Cc2ccccc2[N+](=O)[O-])C2CC2)cs1 ZINC000179242370 938996426 /nfs/dbraw/zinc/99/64/26/938996426.db2.gz OXIQJXCBFSYBEK-UHFFFAOYSA-N 0 0 374.466 3.589 20 5 FHBDRN CCCN(Cc1ccccc1)C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000065716113 938997009 /nfs/dbraw/zinc/99/70/09/938997009.db2.gz XSYBJVQWLGAQBB-UHFFFAOYSA-N 0 0 351.406 3.988 20 5 FHBDRN CCCOc1ccccc1NC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000065716712 938997026 /nfs/dbraw/zinc/99/70/26/938997026.db2.gz LOUCQCCVUQRWBH-UHFFFAOYSA-N 0 0 353.378 3.977 20 5 FHBDRN COCCOc1cc(C)ccc1CNC(=O)Nc1ccc(C)c([N+](=O)[O-])c1 ZINC000128282018 938997124 /nfs/dbraw/zinc/99/71/24/938997124.db2.gz VLPGMTUNWHXFPQ-UHFFFAOYSA-N 0 0 373.409 3.559 20 5 FHBDRN Cc1cc(C(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)c(C(F)(F)F)o1 ZINC000472343055 939002153 /nfs/dbraw/zinc/00/21/53/939002153.db2.gz UKGDAFLYLKWJJH-UHFFFAOYSA-N 0 0 354.284 3.714 20 5 FHBDRN Cc1sc(NC(=O)c2cc([N+](=O)[O-])c(C)cc2Cl)c(C(N)=O)c1C ZINC001125763336 939002391 /nfs/dbraw/zinc/00/23/91/939002391.db2.gz CLZIQPGIFFKJIQ-UHFFFAOYSA-N 0 0 367.814 3.586 20 5 FHBDRN COc1ccc(C)cc1[C@H](C)NC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000065720076 939006576 /nfs/dbraw/zinc/00/65/76/939006576.db2.gz YANMEIHZGWTESG-AWEZNQCLSA-N 0 0 367.405 3.744 20 5 FHBDRN CCCC[C@H]1CCC[C@@H]1NC(=O)c1ccc2c(c1[N+](=O)[O-])OCCCO2 ZINC001125772665 939007796 /nfs/dbraw/zinc/00/77/96/939007796.db2.gz IDCIMGXHQGNJRN-ZFWWWQNUSA-N 0 0 362.426 3.845 20 5 FHBDRN Cc1ccccc1O[C@@H](C)CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000136154305 939011643 /nfs/dbraw/zinc/01/16/43/939011643.db2.gz QUYPJLAJOZRZCI-AWEZNQCLSA-N 0 0 367.405 3.511 20 5 FHBDRN Cc1ccc(O[C@@H](C)CNC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)cc1 ZINC000136164536 939012871 /nfs/dbraw/zinc/01/28/71/939012871.db2.gz ABBMRKGSVYTAMN-AWEZNQCLSA-N 0 0 367.405 3.511 20 5 FHBDRN CCC[C@H](NC(=O)COc1ccc(OC)cc1[N+](=O)[O-])c1ccccc1 ZINC000005262687 939014659 /nfs/dbraw/zinc/01/46/59/939014659.db2.gz LDKSGYVZEUBTEL-INIZCTEOSA-N 0 0 358.394 3.640 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NCc1cccc(COC)c1 ZINC000136203828 939014670 /nfs/dbraw/zinc/01/46/70/939014670.db2.gz BANRVHRZXVYWIT-UHFFFAOYSA-N 0 0 360.435 3.783 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)Nc1nc(-c2ccccn2)cs1 ZINC000014688982 939015204 /nfs/dbraw/zinc/01/52/04/939015204.db2.gz IRMFASBGERPZFK-UHFFFAOYSA-N 0 0 372.431 3.844 20 5 FHBDRN O=C(CC[C@@H]1CCOC1)N(CC1CC1)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000176946329 939016513 /nfs/dbraw/zinc/01/65/13/939016513.db2.gz PMSUMYDWDPEBRE-CYBMUJFWSA-N 0 0 352.818 3.808 20 5 FHBDRN CSc1cccc(C(=O)N2C[C@@H](C)O[C@H](c3ccccc3)C2)c1[N+](=O)[O-] ZINC000188082652 939017679 /nfs/dbraw/zinc/01/76/79/939017679.db2.gz XJTJODYFLKHIOL-CJNGLKHVSA-N 0 0 372.446 3.919 20 5 FHBDRN O=C(Nc1ccc(-n2ccnc2)c(F)c1)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000065729409 939018325 /nfs/dbraw/zinc/01/83/25/939018325.db2.gz ZKFNQYSARZBMMB-UHFFFAOYSA-N 0 0 365.324 3.653 20 5 FHBDRN NC(=O)[C@@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)c1ccccc1 ZINC000102420875 939018543 /nfs/dbraw/zinc/01/85/43/939018543.db2.gz ZJFWIDOCFIXHAV-SFHVURJKSA-N 0 0 367.430 3.640 20 5 FHBDRN CC(C)c1ccc(C(=O)N2CC[C@]3(C2)OCc2ccccc23)cc1[N+](=O)[O-] ZINC000188135479 939019365 /nfs/dbraw/zinc/01/93/65/939019365.db2.gz QYJXKXTYRKDCMG-OAQYLSRUSA-N 0 0 366.417 3.990 20 5 FHBDRN O=C(/C=C\c1ccc(Cl)nc1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000255637975 939020194 /nfs/dbraw/zinc/02/01/94/939020194.db2.gz RRMIPHQNOGJFRL-UITAMQMPSA-N 0 0 357.797 3.848 20 5 FHBDRN Cc1c(CC(=O)OCc2nc(C(F)(F)F)cs2)cccc1[N+](=O)[O-] ZINC000179259336 939020716 /nfs/dbraw/zinc/02/07/16/939020716.db2.gz UEJHFPLJSRUGJM-UHFFFAOYSA-N 0 0 360.313 3.664 20 5 FHBDRN CO[C@@H](CNC(=O)c1cccc(SC)c1[N+](=O)[O-])c1ccc(F)cc1 ZINC000188181965 939027875 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5 FHBDRN CN(Cc1ccc(OC[C@H]2CCCO2)cc1)Cc1ccccc1[N+](=O)[O-] ZINC000179315940 939080048 /nfs/dbraw/zinc/08/00/48/939080048.db2.gz PWWUPYOQBDNKAV-LJQANCHMSA-N 0 0 356.422 3.785 20 5 FHBDRN Cc1cnc2c(c1)N(C(=O)c1cc3cc([N+](=O)[O-])ccc3s1)CCO2 ZINC000179344274 939084447 /nfs/dbraw/zinc/08/44/47/939084447.db2.gz UPRGQSIBRMBUDJ-UHFFFAOYSA-N 0 0 355.375 3.552 20 5 FHBDRN O=C(N[C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000179350957 939094528 /nfs/dbraw/zinc/09/45/28/939094528.db2.gz QRGZMMQYGKSDJN-XKQJLSEDSA-N 0 0 372.446 3.887 20 5 FHBDRN CC[C@H](CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)c1ccccc1 ZINC000179372554 939098259 /nfs/dbraw/zinc/09/82/59/939098259.db2.gz AJNNTPMZPSEZPI-CQSZACIVSA-N 0 0 351.406 3.929 20 5 FHBDRN CSc1ccc([N+](=O)[O-])cc1C(=O)N(C)C[C@H](C)c1nccs1 ZINC000935364414 939118264 /nfs/dbraw/zinc/11/82/64/939118264.db2.gz UOKSXDKWEGJAOV-JTQLQIEISA-N 0 0 351.453 3.649 20 5 FHBDRN CO[C@H](CNC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1)c1ccccc1 ZINC000179402470 939138296 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3.522 20 5 FHBDRN CNc1ccc(C(=O)OCc2coc(-c3ccccc3)n2)cc1[N+](=O)[O-] ZINC000024299675 940002730 /nfs/dbraw/zinc/00/27/30/940002730.db2.gz QZOUMODJVQBXKL-UHFFFAOYSA-N 0 0 353.334 3.649 20 5 FHBDRN Cc1sc(S(=O)(=O)N2CCC[C@@H]2c2cccc(C)c2)cc1[N+](=O)[O-] ZINC000467396503 945288438 /nfs/dbraw/zinc/28/84/38/945288438.db2.gz ZHVOWXAILQLIRK-CQSZACIVSA-N 0 0 366.464 3.799 20 5 FHBDRN Cc1ccc(Cc2nnc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)s2)cc1 ZINC000518281841 945288546 /nfs/dbraw/zinc/28/85/46/945288546.db2.gz ZNSWFNGKCYFVIW-UHFFFAOYSA-N 0 0 372.381 3.737 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N1CCc2ccc(F)c(F)c2C1 ZINC000427327842 945288838 /nfs/dbraw/zinc/28/88/38/945288838.db2.gz AUEUOESZFUSWAE-UHFFFAOYSA-N 0 0 366.751 3.654 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N[C@@H]2C[C@H]2c2ccc(Cl)c(F)c2)c1[N+](=O)[O-] ZINC000437363089 945289942 /nfs/dbraw/zinc/28/99/42/945289942.db2.gz JHMBUEOPJUFOJR-JOYOIKCWSA-N 0 0 366.780 3.520 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)NCc2c(C)cc(C)cc2C)c1F ZINC000411338646 940028492 /nfs/dbraw/zinc/02/84/92/940028492.db2.gz OEJOHEAYWWFXPU-UHFFFAOYSA-N 0 0 360.385 3.527 20 5 FHBDRN C[C@@](O)(C1CCN(C/C=C/c2ccccc2[N+](=O)[O-])CC1)C(F)(F)F ZINC000545244333 940032225 /nfs/dbraw/zinc/03/22/25/940032225.db2.gz NMHAXTXCVYVCFK-MQDFFIGUSA-N 0 0 358.360 3.633 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]cc(Cc3nc(COc4ccc(F)cc4)no3)c2c1 ZINC000136564583 940032608 /nfs/dbraw/zinc/03/26/08/940032608.db2.gz RYBLEQJKGNWZJW-UHFFFAOYSA-N 0 0 368.324 3.768 20 5 FHBDRN O=C(Nc1ccc(Cl)cc1Cl)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000179865296 940034384 /nfs/dbraw/zinc/03/43/84/940034384.db2.gz VORUMWRWUOULQJ-UHFFFAOYSA-N 0 0 355.133 3.883 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)Nc2ncc(-c3ccc(C)cc3C)s2)n1 ZINC000427332943 945291194 /nfs/dbraw/zinc/29/11/94/945291194.db2.gz XXCJOABYHZHAFN-UHFFFAOYSA-N 0 0 371.422 3.804 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N(C)[C@H](C)c2ccccc2C)c1F ZINC000411359102 940035677 /nfs/dbraw/zinc/03/56/77/940035677.db2.gz XKPPRIYLWXCXDM-CYBMUJFWSA-N 0 0 360.385 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ZINC000375913034 940056264 /nfs/dbraw/zinc/05/62/64/940056264.db2.gz STWXODVJLXDWRQ-MRXNPFEDSA-N 0 0 350.321 3.890 20 5 FHBDRN O=C(N[C@@H]1CCCOc2ccc(F)cc21)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000411588579 940070889 /nfs/dbraw/zinc/07/08/89/940070889.db2.gz GHKLAKCMPLOIFT-LZLYRXPVSA-N 0 0 370.380 3.868 20 5 FHBDRN Cc1ccc(C)n1C1CCN(c2ncnc3cccc([N+](=O)[O-])c32)CC1 ZINC000612442181 940071078 /nfs/dbraw/zinc/07/10/78/940071078.db2.gz SNHNLTBWJJNUQW-UHFFFAOYSA-N 0 0 351.410 3.798 20 5 FHBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NC[C@H]1CCc2ccccc21 ZINC000609506806 940073193 /nfs/dbraw/zinc/07/31/93/940073193.db2.gz XPENXZCDIJAOKG-GXTWGEPZSA-N 0 0 374.824 3.862 20 5 FHBDRN COc1ccccc1C(C)(C)CNC(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000612465472 940082988 /nfs/dbraw/zinc/08/29/88/940082988.db2.gz KUBXJMFTBWWMLG-CYBMUJFWSA-N 0 0 374.412 3.940 20 5 FHBDRN Cc1ccc(Cc2ccccn2)cc1NC(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000548932555 940085012 /nfs/dbraw/zinc/08/50/12/940085012.db2.gz AIIGSXRINJVMGY-UHFFFAOYSA-N 0 0 362.389 3.724 20 5 FHBDRN CC(C)(C)c1ccc(NC(=O)C(=O)NC2(C3CCC3)CCC2)cc1[N+](=O)[O-] ZINC000411692292 940090666 /nfs/dbraw/zinc/09/06/66/940090666.db2.gz JMYSNZNSJRHHDB-UHFFFAOYSA-N 0 0 373.453 3.670 20 5 FHBDRN CN(c1ccccc1)C1CC[NH+](CCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC000065956060 940106772 /nfs/dbraw/zinc/10/67/72/940106772.db2.gz IWFGGOFSOIVRGN-UHFFFAOYSA-N 0 0 355.438 3.574 20 5 FHBDRN Cc1n[nH]cc1C1CCN(C(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)CC1 ZINC000375965641 940115123 /nfs/dbraw/zinc/11/51/23/940115123.db2.gz SCSAWNUGJPZDQC-CYBMUJFWSA-N 0 0 374.466 3.513 20 5 FHBDRN Cc1c(C(=O)Oc2ccc(NC(=O)c3ccco3)cc2)cccc1[N+](=O)[O-] ZINC000051035767 940119676 /nfs/dbraw/zinc/11/96/76/940119676.db2.gz UWVPITOKPOHXRV-UHFFFAOYSA-N 0 0 366.329 3.968 20 5 FHBDRN CCOc1ccccc1NC(=O)COc1cc([N+](=O)[O-])ccc1Cl ZINC000177335022 940120314 /nfs/dbraw/zinc/12/03/14/940120314.db2.gz FDUBSMCTRRTQTL-UHFFFAOYSA-N 0 0 350.758 3.664 20 5 FHBDRN COc1ccc(C[NH2+][C@H](CCO)c2ccc(Cl)c(F)c2)cc1[N+](=O)[O-] ZINC000601137037 940123273 /nfs/dbraw/zinc/12/32/73/940123273.db2.gz QQJJYFAIVCFRJM-OAHLLOKOSA-N 0 0 368.792 3.609 20 5 FHBDRN CS(C)(=O)=Nc1cccc(C(=O)Nc2ccc([N+](=O)[O-])c(Cl)c2)c1 ZINC001125797045 940133248 /nfs/dbraw/zinc/13/32/48/940133248.db2.gz ZSTVLEOEEVABFV-UHFFFAOYSA-N 0 0 367.814 3.860 20 5 FHBDRN Cc1cccc(CC2CN(C(=O)[C@@H](C)c3ccc([N+](=O)[O-])cc3F)C2)c1 ZINC000612552446 940136048 /nfs/dbraw/zinc/13/60/48/940136048.db2.gz BXASLKLODNRWLL-AWEZNQCLSA-N 0 0 356.397 3.847 20 5 FHBDRN NC(=O)Nc1ccc(C(=O)COc2ccc([N+](=O)[O-])c3ccccc23)cc1 ZINC000124444966 945298438 /nfs/dbraw/zinc/29/84/38/945298438.db2.gz AFMPHCHJXXYERR-UHFFFAOYSA-N 0 0 365.345 3.500 20 5 FHBDRN O=C(NCCCOc1ccc(F)cc1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000136721061 940143690 /nfs/dbraw/zinc/14/36/90/940143690.db2.gz HFUMRTMTYDKJCF-UHFFFAOYSA-N 0 0 352.749 3.586 20 5 FHBDRN CC[C@H](CNC(=O)c1cc(F)ccc1[N+](=O)[O-])Oc1ccccc1Cl ZINC000177373085 940154811 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COc1ccccc1-n1nnnc1S[C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000179981837 940183946 /nfs/dbraw/zinc/18/39/46/940183946.db2.gz JPWVMBWNSARQBQ-LBPRGKRZSA-N 0 0 371.422 3.741 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1[C@H](C)Sc1nnc(-c2cccnc2)n1C ZINC000179988051 940198192 /nfs/dbraw/zinc/19/81/92/940198192.db2.gz KSMVXXVGDFMKAS-LBPRGKRZSA-N 0 0 355.423 3.947 20 5 FHBDRN COC(=O)C(C)(C)[C@H]1CCCN(c2nc3ccccc3cc2[N+](=O)[O-])C1 ZINC000616061990 940208373 /nfs/dbraw/zinc/20/83/73/940208373.db2.gz XKJQTCXKRJNNRT-AWEZNQCLSA-N 0 0 357.410 3.559 20 5 FHBDRN O=C(Nc1nc2ccc(OC(F)(F)F)cc2s1)c1cc([N+](=O)[O-])c[nH]1 ZINC000612663987 940209418 /nfs/dbraw/zinc/20/94/18/940209418.db2.gz XAEKLGPIECCAGN-UHFFFAOYSA-N 0 0 372.284 3.684 20 5 FHBDRN CCn1c(COC(=O)c2cc([N+](=O)[O-])ccc2F)nc2c1cccc2F ZINC000728623120 940210313 /nfs/dbraw/zinc/21/03/13/940210313.db2.gz WJPYBZTUCGIZGF-UHFFFAOYSA-N 0 0 361.304 3.600 20 5 FHBDRN CC(C)(C)Oc1ccc(CNC(=O)c2ccc([N+](=O)[O-])cc2Cl)cn1 ZINC000179998649 940210672 /nfs/dbraw/zinc/21/06/72/940210672.db2.gz DCZSRPCRCRFNMW-UHFFFAOYSA-N 0 0 363.801 3.751 20 5 FHBDRN Cc1nn(-c2ccccc2)cc1CNc1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000511368724 940239226 /nfs/dbraw/zinc/23/92/26/940239226.db2.gz HDGYGTKRIIPVCW-UHFFFAOYSA-N 0 0 359.389 3.671 20 5 FHBDRN Cc1ccc(CN2CCC(c3noc(C(F)F)n3)CC2)cc1[N+](=O)[O-] ZINC000376048258 940239897 /nfs/dbraw/zinc/23/98/97/940239897.db2.gz YEPLHLUSFSLKKW-UHFFFAOYSA-N 0 0 352.341 3.603 20 5 FHBDRN COC(=O)c1scc(C)c1NC(=O)/C=C(\C)c1ccc([N+](=O)[O-])cc1 ZINC000782639890 940252615 /nfs/dbraw/zinc/25/26/15/940252615.db2.gz VFFMDFVXMKJQGC-CSKARUKUSA-N 0 0 360.391 3.793 20 5 FHBDRN CO[C@](C)(c1noc(-c2ccc(OC(F)F)c([N+](=O)[O-])c2)n1)C1CC1 ZINC000584500192 940288722 /nfs/dbraw/zinc/28/87/22/940288722.db2.gz VTOAMNDCQXCFAE-HNNXBMFYSA-N 0 0 355.297 3.518 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)NC1(c2ccc(F)cc2F)CCC1 ZINC000427377496 945310825 /nfs/dbraw/zinc/31/08/25/945310825.db2.gz YZRJFKUHQYEAKS-UHFFFAOYSA-N 0 0 362.332 3.691 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H](C)c1ccc(OC(F)F)cc1 ZINC000511393053 940329937 /nfs/dbraw/zinc/32/99/37/940329937.db2.gz YOCAVELDBCBATM-NSHDSACASA-N 0 0 350.321 3.996 20 5 FHBDRN Cc1ccc(F)cc1-c1noc([C@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)n1 ZINC000612892933 940331456 /nfs/dbraw/zinc/33/14/56/940331456.db2.gz NHVVHNPJPJSUFD-NSHDSACASA-N 0 0 370.340 3.583 20 5 FHBDRN COc1cccc([C@H](C)c2noc(CN(C)c3ccccc3[N+](=O)[O-])n2)c1 ZINC000612918227 940336137 /nfs/dbraw/zinc/33/61/37/940336137.db2.gz YJASUEAAKNIGJU-ZDUSSCGKSA-N 0 0 368.393 3.775 20 5 FHBDRN COc1cccc([C@H](C)c2noc(Cc3ccc(OC)c([N+](=O)[O-])c3)n2)c1 ZINC000612917326 940339174 /nfs/dbraw/zinc/33/91/74/940339174.db2.gz JWGRQJCLGROXCH-LBPRGKRZSA-N 0 0 369.377 3.738 20 5 FHBDRN Cc1ccc(S(=O)(=O)N(C)[C@@H](C)c2ccc(F)c(F)c2)c([N+](=O)[O-])c1 ZINC000507542739 945316826 /nfs/dbraw/zinc/31/68/26/945316826.db2.gz PWMYFOPINYFWGL-NSHDSACASA-N 0 0 370.377 3.563 20 5 FHBDRN COc1cccc(Cc2nnc(SCc3ccc([N+](=O)[O-])cc3)o2)c1 ZINC000066256868 940370896 /nfs/dbraw/zinc/37/08/96/940370896.db2.gz IBGGSDGFOYWZSH-UHFFFAOYSA-N 0 0 357.391 3.870 20 5 FHBDRN CC[C@H](CNC(=O)c1cccc(Cl)c1[N+](=O)[O-])Oc1ccccc1F ZINC000177720699 940385559 /nfs/dbraw/zinc/38/55/59/940385559.db2.gz PCUPBZVMTQEAAO-LLVKDONJSA-N 0 0 366.776 3.975 20 5 FHBDRN CCOc1cc(OCc2nc(Cc3ccccc3C)no2)ccc1[N+](=O)[O-] ZINC000188608978 940392811 /nfs/dbraw/zinc/39/28/11/940392811.db2.gz XHLSVRNZXNZRRR-UHFFFAOYSA-N 0 0 369.377 3.855 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)OCCCc2ccsc2)cc1OC ZINC000782672633 940395599 /nfs/dbraw/zinc/39/55/99/940395599.db2.gz LRGHSMUHYSXZSL-UHFFFAOYSA-N 0 0 365.407 3.853 20 5 FHBDRN CCOc1cc(OCC(=O)Nc2c(C)cccc2Cl)ccc1[N+](=O)[O-] ZINC000188612418 940404706 /nfs/dbraw/zinc/40/47/06/940404706.db2.gz DEGQGOJUAZTYQW-UHFFFAOYSA-N 0 0 364.785 3.973 20 5 FHBDRN Cc1cc(C)c(NC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])cc1O ZINC000613032461 940408476 /nfs/dbraw/zinc/40/84/76/940408476.db2.gz LVPRACPMIQRESD-UHFFFAOYSA-N 0 0 364.785 3.978 20 5 FHBDRN Cc1c(CN2C(=O)CN(Cc3ccc(Cl)cc3)C2=O)cccc1[N+](=O)[O-] ZINC000431723914 940411575 /nfs/dbraw/zinc/41/15/75/940411575.db2.gz LVAHABPGGHRFKI-UHFFFAOYSA-N 0 0 373.796 3.521 20 5 FHBDRN CCOc1cc(OCC(=O)N2CCC[C@@H]3CCCC[C@H]32)ccc1[N+](=O)[O-] ZINC000188618233 940423150 /nfs/dbraw/zinc/42/31/50/940423150.db2.gz IOSBORZYUDZAFP-GOEBONIOSA-N 0 0 362.426 3.554 20 5 FHBDRN O=[N+]([O-])c1ccc([C@@H](NC[C@@H]2COc3ccccc32)C(F)(F)F)cc1 ZINC000579966489 940425885 /nfs/dbraw/zinc/42/58/85/940425885.db2.gz IYHIVICFODJHTH-MLGOLLRUSA-N 0 0 352.312 3.964 20 5 FHBDRN C[C@@H](O)C[C@H](C)CNC(=O)c1cc([N+](=O)[O-])ccc1SC1CCCC1 ZINC000124695234 945319652 /nfs/dbraw/zinc/31/96/52/945319652.db2.gz ZSZPUTNXRCYZIN-QWHCGFSZSA-N 0 0 366.483 3.766 20 5 FHBDRN CCO[C@H]1C[C@H](NC(=O)c2c(C)cc(Cl)cc2[N+](=O)[O-])C12CCC2 ZINC000613072680 940435030 /nfs/dbraw/zinc/43/50/30/940435030.db2.gz NSMPJPRYBQSMEO-KBPBESRZSA-N 0 0 352.818 3.634 20 5 FHBDRN CC(C)c1cccc(N(C)C(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)c1 ZINC000066336643 940439093 /nfs/dbraw/zinc/43/90/93/940439093.db2.gz CJQYPUBSBRJAOM-UHFFFAOYSA-N 0 0 356.378 3.766 20 5 FHBDRN CC(=O)c1cc([N+](=O)[O-])ccc1N1CCC[C@H](n2ccnc2C(C)C)C1 ZINC000376189242 940441563 /nfs/dbraw/zinc/44/15/63/940441563.db2.gz UQEZQIIRLUUQKI-INIZCTEOSA-N 0 0 356.426 3.959 20 5 FHBDRN COC(=O)c1ccc(OCc2coc(-c3ccccc3)n2)cc1[N+](=O)[O-] ZINC000613109884 940452427 /nfs/dbraw/zinc/45/24/27/940452427.db2.gz CRMFEBXPDMIVGO-UHFFFAOYSA-N 0 0 354.318 3.615 20 5 FHBDRN COC(=O)c1ccc(OCC(=O)C23CC4CC(CC(C4)C2)C3)cc1[N+](=O)[O-] ZINC000613110509 940452623 /nfs/dbraw/zinc/45/26/23/940452623.db2.gz PWGXWSKVFXTETG-UHFFFAOYSA-N 0 0 373.405 3.546 20 5 FHBDRN COC(=O)c1ccc(OCc2coc(-c3cccc(F)c3)n2)cc1[N+](=O)[O-] ZINC000613112918 940456003 /nfs/dbraw/zinc/45/60/03/940456003.db2.gz JYGZUQFCFNUKTG-UHFFFAOYSA-N 0 0 372.308 3.755 20 5 FHBDRN CO[C@H](CNC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1)C1CC1 ZINC000511432255 940460341 /nfs/dbraw/zinc/46/03/41/940460341.db2.gz LOIAXFKKRWVLHZ-QGZVFWFLSA-N 0 0 372.446 3.901 20 5 FHBDRN COc1cccc(F)c1[C@@H](C)NC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000124831438 945322616 /nfs/dbraw/zinc/32/26/16/945322616.db2.gz NFQKXAAPFZCPBX-GFCCVEGCSA-N 0 0 373.384 3.571 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2nc(Cc3ccccc3Br)no2)cc1 ZINC000580136160 940465044 /nfs/dbraw/zinc/46/50/44/940465044.db2.gz KPFNTFFZWNNHNE-UHFFFAOYSA-N 0 0 360.167 3.998 20 5 FHBDRN Cc1c(C(=O)N2C[C@H](c3ccccc3)[C@H]3COCC[C@@H]32)cccc1[N+](=O)[O-] ZINC000376206161 940467352 /nfs/dbraw/zinc/46/73/52/940467352.db2.gz GTTVWCUGHPTEST-GGPKGHCWSA-N 0 0 366.417 3.548 20 5 FHBDRN Cc1oc(NC(=O)c2sc(Br)cc2[N+](=O)[O-])nc1C1CC1 ZINC000892525151 940467353 /nfs/dbraw/zinc/46/73/53/940467353.db2.gz UHISIAFQKPULNW-UHFFFAOYSA-N 0 0 372.200 3.845 20 5 FHBDRN CCc1ccc([C@H]2CN(c3cc([N+](=O)[O-])ccc3C(C)=O)CCO2)cc1 ZINC000580354565 940473768 /nfs/dbraw/zinc/47/37/68/940473768.db2.gz JRTRMVZKHPGMCF-HXUWFJFHSA-N 0 0 354.406 3.938 20 5 FHBDRN C[C@@H]1[C@H](c2nc(-c3ccc(N)c([N+](=O)[O-])c3)no2)CCN1c1ccccc1 ZINC000580481064 940476587 /nfs/dbraw/zinc/47/65/87/940476587.db2.gz NLXCTTIGYCRPJW-IUODEOHRSA-N 0 0 365.393 3.609 20 5 FHBDRN COc1cc(COc2ccc(F)cc2-c2ccnn2C)ccc1[N+](=O)[O-] ZINC000580486311 940476758 /nfs/dbraw/zinc/47/67/58/940476758.db2.gz YSIGIVUJVVTYHN-UHFFFAOYSA-N 0 0 357.341 3.722 20 5 FHBDRN Cc1ccc(NCCCNC(=O)c2ccoc2C(F)(F)F)c([N+](=O)[O-])c1 ZINC000580490635 940476849 /nfs/dbraw/zinc/47/68/49/940476849.db2.gz RDZCSFKDCNPKQY-UHFFFAOYSA-N 0 0 371.315 3.747 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)N2CCOc3ccc([N+](=O)[O-])cc3C2)cc1 ZINC000580493788 940476936 /nfs/dbraw/zinc/47/69/36/940476936.db2.gz RDPJZCLNSFBIBN-CQSZACIVSA-N 0 0 355.394 3.568 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC(c2cccnc2)CC1 ZINC000613189686 940481153 /nfs/dbraw/zinc/48/11/53/940481153.db2.gz VZZKBNHPLLIQJI-QGZVFWFLSA-N 0 0 367.449 3.965 20 5 FHBDRN NC(=O)c1ccnc(N2CCCCC[C@H]2/C=C\c2cccs2)c1[N+](=O)[O-] ZINC000580663542 940481389 /nfs/dbraw/zinc/48/13/89/940481389.db2.gz OTCOZOHYMAAEFK-WSROAFLRSA-N 0 0 372.450 3.613 20 5 FHBDRN C[C@H]1[C@H](CO)CCCN1C(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000414076734 940482625 /nfs/dbraw/zinc/48/26/25/940482625.db2.gz QCRIEBOQCLFRFF-HOCLYGCPSA-N 0 0 369.421 3.571 20 5 FHBDRN CC(C)c1ccc2occ(-c3nc(-c4c([N+](=O)[O-])ncn4C)no3)c2c1 ZINC000580675830 940483527 /nfs/dbraw/zinc/48/35/27/940483527.db2.gz NXSLPPTUSIJWHA-UHFFFAOYSA-N 0 0 353.338 3.915 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)NCCc2ccccc2Br)c1 ZINC000580683648 940483762 /nfs/dbraw/zinc/48/37/62/940483762.db2.gz WPQFYURMAFGNMR-UHFFFAOYSA-N 0 0 363.211 3.638 20 5 FHBDRN Cc1ccc(C(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)c(C2CC2)n1 ZINC000580817492 940486367 /nfs/dbraw/zinc/48/63/67/940486367.db2.gz KILHUJQPHJUDFR-UHFFFAOYSA-N 0 0 364.405 3.629 20 5 FHBDRN C[C@H](NC(=O)N1CC[C@H](Oc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000580830694 940486711 /nfs/dbraw/zinc/48/67/11/940486711.db2.gz MFIZHUBCRBAIAC-KSSFIOAISA-N 0 0 355.394 3.519 20 5 FHBDRN O=C(C[C@H](c1ccc(O)cc1)C1CC1)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000580938693 940489255 /nfs/dbraw/zinc/48/92/55/940489255.db2.gz QCHAGROHTDODSR-IBGZPJMESA-N 0 0 366.417 3.769 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@@H](c3ccc(C)cc3)C2)c1 ZINC000549008907 940489829 /nfs/dbraw/zinc/48/98/29/940489829.db2.gz JFUHPRSKCGMBFI-MRXNPFEDSA-N 0 0 354.406 3.932 20 5 FHBDRN CC(C)(C)c1ccc(NC(=O)C(=O)N[C@H]2CC3CCC2CC3)cc1[N+](=O)[O-] ZINC000580883175 940490055 /nfs/dbraw/zinc/49/00/55/940490055.db2.gz FVTSKUUBTWBCBF-ZUEPYMLJSA-N 0 0 373.453 3.526 20 5 FHBDRN C[C@@H](C(=O)Nc1cc(C2(C)CCCC2)on1)c1ccc([N+](=O)[O-])cc1F ZINC000448413482 940491744 /nfs/dbraw/zinc/49/17/44/940491744.db2.gz KABHJHXCBZYRQH-LLVKDONJSA-N 0 0 361.373 3.718 20 5 FHBDRN NC(=O)c1ccnc(Oc2cc(C(F)(F)F)ccc2Cl)c1[N+](=O)[O-] ZINC000581044052 940493963 /nfs/dbraw/zinc/49/39/63/940493963.db2.gz MWDZWUPKLQBEKO-UHFFFAOYSA-N 0 0 361.663 3.553 20 5 FHBDRN COc1cc(F)c(F)cc1NC(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000581223165 940496864 /nfs/dbraw/zinc/49/68/64/940496864.db2.gz NMCOVXKDLJVAJX-MRVPVSSYSA-N 0 0 354.284 3.763 20 5 FHBDRN Cc1ccc([C@H](CNc2cc(C)c([N+](=O)[O-])c(C(=O)[O-])c2)[NH+](C)C)cc1 ZINC000581313951 940498726 /nfs/dbraw/zinc/49/87/26/940498726.db2.gz XGKWJPGIYIPRTO-KRWDZBQOSA-N 0 0 357.410 3.625 20 5 FHBDRN Cc1c(Cc2noc(C(=O)c3ccc(Cl)s3)n2)cccc1[N+](=O)[O-] ZINC000581336669 940499624 /nfs/dbraw/zinc/49/96/24/940499624.db2.gz YKVXEDLCHPABPE-UHFFFAOYSA-N 0 0 363.782 3.823 20 5 FHBDRN CCc1cc(C)nc(Sc2nnc(-c3ccc([N+](=O)[O-])cc3)n2CC)n1 ZINC000613282080 940502028 /nfs/dbraw/zinc/50/20/28/940502028.db2.gz DSNRISALBJZSBE-UHFFFAOYSA-N 0 0 370.438 3.685 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H](C[C@H]1CCOC1)c1ccccc1 ZINC000427398953 945326601 /nfs/dbraw/zinc/32/66/01/945326601.db2.gz KYFURSMLSYUPTF-KDOFPFPSSA-N 0 0 370.405 3.501 20 5 FHBDRN C[C@@H](NC(=O)NCc1ccc([N+](=O)[O-])cc1Cl)c1ccc2n[nH]cc2c1 ZINC000581540214 940506024 /nfs/dbraw/zinc/50/60/24/940506024.db2.gz QGWKVCPJJLPPLL-SNVBAGLBSA-N 0 0 373.800 3.685 20 5 FHBDRN Cc1c(CN2CCn3c(C4CCCC4)nnc3[C@@H]2C)cccc1[N+](=O)[O-] ZINC000581507102 940507539 /nfs/dbraw/zinc/50/75/39/940507539.db2.gz WGIDOEGUXFMJCT-AWEZNQCLSA-N 0 0 355.442 3.729 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2ccc(CN3CCOC[C@@H]3CC(F)F)o2)c1 ZINC000581515950 940508147 /nfs/dbraw/zinc/50/81/47/940508147.db2.gz PSNXAGNATDIIKJ-AWEZNQCLSA-N 0 0 352.337 3.711 20 5 FHBDRN CC(C)(C(=O)NC[C@@H]1CSc2ccccc2O1)c1ccccc1[N+](=O)[O-] ZINC000581727827 940510905 /nfs/dbraw/zinc/51/09/05/940510905.db2.gz NKLUFZSQWWCDAD-CYBMUJFWSA-N 0 0 372.446 3.542 20 5 FHBDRN COc1ccc(CNc2ccc(N3C[C@@H](C)O[C@@H](C)C3)cc2)cc1[N+](=O)[O-] ZINC000124796340 945330091 /nfs/dbraw/zinc/33/00/91/945330091.db2.gz WOACPYPFBKMFSE-GASCZTMLSA-N 0 0 371.437 3.829 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H](C)c1nc(C2CCCCC2)no1 ZINC000427389188 945334466 /nfs/dbraw/zinc/33/44/66/945334466.db2.gz FYYCMIKTGBNSBK-LLVKDONJSA-N 0 0 374.397 3.525 20 5 FHBDRN O=[N+]([O-])c1ccccc1-c1cnn(CCOCC(F)(F)C(F)(F)F)c1 ZINC000581677334 940588025 /nfs/dbraw/zinc/58/80/25/940588025.db2.gz XHCMBDVEMDFPRT-UHFFFAOYSA-N 0 0 365.258 3.673 20 5 FHBDRN Cc1ncc2c(n1)CC[C@H](NC(=O)c1cc3ccccc3c3cccnc13)C2 ZINC000613321621 940590791 /nfs/dbraw/zinc/59/07/91/940590791.db2.gz LVDDYNFEHCFCQD-KRWDZBQOSA-N 0 0 368.440 3.774 20 5 FHBDRN CCCc1c(C(=O)N(C)CCc2ccccc2[N+](=O)[O-])[nH]c(C)c1C(C)=O ZINC000581779047 940590970 /nfs/dbraw/zinc/59/09/70/940590970.db2.gz KBFCEZBCROVXAC-UHFFFAOYSA-N 0 0 371.437 3.701 20 5 FHBDRN O=[N+]([O-])c1ccc(N[C@H]2CCN(Cc3csc(C4CCCC4)n3)C2)nc1 ZINC000173466694 940619956 /nfs/dbraw/zinc/61/99/56/940619956.db2.gz ODPLFCVIOPELMF-AWEZNQCLSA-N 0 0 373.482 3.790 20 5 FHBDRN Nc1ccc(-c2noc([C@@H]3C[C@H]3c3cc(F)ccc3F)n2)cc1[N+](=O)[O-] ZINC000581915607 940625721 /nfs/dbraw/zinc/62/57/21/940625721.db2.gz KWUPUTZRFUNFDO-CMPLNLGQSA-N 0 0 358.304 3.776 20 5 FHBDRN CCOC(=O)Nc1ccc(C(=O)N2c3ccc([N+](=O)[O-])cc3C[C@@H]2C)cc1 ZINC000728810654 945335418 /nfs/dbraw/zinc/33/54/18/945335418.db2.gz URIYUKBDRVQWLP-LBPRGKRZSA-N 0 0 369.377 3.755 20 5 FHBDRN CCOc1ccc(F)c(NC(=O)c2ccc([N+](=O)[O-])cc2OC)c1F ZINC000427391201 945335482 /nfs/dbraw/zinc/33/54/82/945335482.db2.gz MOLOZROHRFZGPY-UHFFFAOYSA-N 0 0 352.293 3.533 20 5 FHBDRN CC[C@H]1c2ccsc2CCN1c1nnc(-c2ccc([N+](=O)[O-])cc2)n1C ZINC000581912082 940632724 /nfs/dbraw/zinc/63/27/24/940632724.db2.gz WIXUPPUFKKNELI-HNNXBMFYSA-N 0 0 369.450 3.966 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NS(=O)(=O)c1ccc(C(F)F)cc1 ZINC000581965102 940635469 /nfs/dbraw/zinc/63/54/69/940635469.db2.gz SUHPURFAFXOUIY-UHFFFAOYSA-N 0 0 356.350 3.950 20 5 FHBDRN CSc1ccc(OC[C@H](O)COc2cc(C)c([N+](=O)[O-])cc2F)cc1 ZINC000414129371 940635511 /nfs/dbraw/zinc/63/55/11/940635511.db2.gz UUPCKQRJCFMCBO-LBPRGKRZSA-N 0 0 367.398 3.583 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)F)cc1N1CCC[C@@H](OCC(F)(F)F)C1 ZINC000582160006 940651475 /nfs/dbraw/zinc/65/14/75/940651475.db2.gz BTCACXDHHXISAR-MRVPVSSYSA-N 0 0 373.253 3.556 20 5 FHBDRN CCN(C[C@@H](O)c1ccc(C)cc1)C(=O)c1cc(SC)ccc1[N+](=O)[O-] ZINC000178089870 940651867 /nfs/dbraw/zinc/65/18/67/940651867.db2.gz AKXATPHJEGCZLO-GOSISDBHSA-N 0 0 374.462 3.821 20 5 FHBDRN CSc1ccc(C(=O)N2C[C@@H](C)OC[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000173680359 940654017 /nfs/dbraw/zinc/65/40/17/940654017.db2.gz VKSSOADAZWTOOP-DYVFJYSZSA-N 0 0 372.446 3.919 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(Cc2noc(/C=C\c3scnc3C)n2)c1 ZINC000582326959 940665912 /nfs/dbraw/zinc/66/59/12/940665912.db2.gz DRYWEBAZKBBSAK-WAYWQWQTSA-N 0 0 358.379 3.513 20 5 FHBDRN CCCC(=O)N1CCCC[C@@H]1c1nc(-c2ccc(C)c([N+](=O)[O-])c2)no1 ZINC000290189904 940677127 /nfs/dbraw/zinc/67/71/27/940677127.db2.gz TUEMTRMWKWTJLE-CQSZACIVSA-N 0 0 358.398 3.807 20 5 FHBDRN Cn1cnc([N+](=O)[O-])c1N1CCC[C@@H]1c1cc(F)cc(Br)c1 ZINC000613431268 940702229 /nfs/dbraw/zinc/70/22/29/940702229.db2.gz NYNGIFYLUGNKDN-GFCCVEGCSA-N 0 0 369.194 3.571 20 5 FHBDRN O=C(Cn1cc(-c2ccccc2[N+](=O)[O-])cn1)N1CCC[C@H]2CCCC[C@H]21 ZINC000582556605 940717896 /nfs/dbraw/zinc/71/78/96/940717896.db2.gz PFSIGJYDCUIWJH-CRAIPNDOSA-N 0 0 368.437 3.640 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@H]2CCCC[C@@H]21 ZINC000180162955 940722123 /nfs/dbraw/zinc/72/21/23/940722123.db2.gz FJYBAMHFEATGOH-HOTGVXAUSA-N 0 0 364.467 3.879 20 5 FHBDRN CCc1ccc(C(=O)NC(C)(C)c2cc(C(F)(F)F)on2)cc1[N+](=O)[O-] ZINC000582563995 940723498 /nfs/dbraw/zinc/72/34/98/940723498.db2.gz DANLXZYFPKHOQA-UHFFFAOYSA-N 0 0 371.315 3.829 20 5 FHBDRN COc1ccc(NC(=O)CCOc2ccccc2Cl)cc1[N+](=O)[O-] ZINC000170560392 940731969 /nfs/dbraw/zinc/73/19/69/940731969.db2.gz RJQRMWXDSMQUHX-UHFFFAOYSA-N 0 0 350.758 3.664 20 5 FHBDRN Cc1sc(S(=O)(=O)Nc2c(F)cccc2Cl)cc1[N+](=O)[O-] ZINC000613469668 940735505 /nfs/dbraw/zinc/73/55/05/940735505.db2.gz CSNXISBZJJVGHI-UHFFFAOYSA-N 0 0 350.780 3.558 20 5 FHBDRN Cc1cc(OC(C)C)ccc1NC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000540910371 940748740 /nfs/dbraw/zinc/74/87/40/940748740.db2.gz YBTQEMNMHBZDQH-UHFFFAOYSA-N 0 0 358.350 3.671 20 5 FHBDRN COCCc1nc2cc(NC(=O)Nc3cc([N+](=O)[O-])ccc3C)ccc2o1 ZINC000440255621 945346028 /nfs/dbraw/zinc/34/60/28/945346028.db2.gz ANNMTMLJDYANAF-UHFFFAOYSA-N 0 0 370.365 3.877 20 5 FHBDRN COc1ccc(C(=O)N(Cc2ccccc2)CC(F)F)cc1[N+](=O)[O-] ZINC000174625408 940757194 /nfs/dbraw/zinc/75/71/94/940757194.db2.gz RTJFLVQYGJRYRA-UHFFFAOYSA-N 0 0 350.321 3.511 20 5 FHBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)N(c1ccccc1)C1CCCC1 ZINC000124906091 945347265 /nfs/dbraw/zinc/34/72/65/945347265.db2.gz KDELOYDLHGYHIL-UHFFFAOYSA-N 0 0 360.435 3.874 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2nc(CNc3cnn4c3CCCC4)cs2)c1 ZINC000601150861 940768197 /nfs/dbraw/zinc/76/81/97/940768197.db2.gz GNMBRQJHXQDBDY-UHFFFAOYSA-N 0 0 355.423 3.863 20 5 FHBDRN Cc1nc([C@H](NCc2ccc([N+](=O)[O-])cc2)c2ccc(Cl)cc2)no1 ZINC000180192223 940788535 /nfs/dbraw/zinc/78/85/35/940788535.db2.gz ZKDRFROWSPNADJ-MRXNPFEDSA-N 0 0 358.785 3.819 20 5 FHBDRN Cc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)n(C(C)(C)C)n1 ZINC000540919988 940791366 /nfs/dbraw/zinc/79/13/66/940791366.db2.gz VJQRORCOOJATAR-UHFFFAOYSA-N 0 0 368.340 3.708 20 5 FHBDRN COCC1(CCNc2cc(C(F)(F)C(F)(F)F)ncc2[N+](=O)[O-])CC1 ZINC000582662868 940794422 /nfs/dbraw/zinc/79/44/22/940794422.db2.gz FZBNTMMLMPGOMH-UHFFFAOYSA-N 0 0 369.290 3.873 20 5 FHBDRN COc1ccc(CSCC(=O)N[C@@H]2CCCC2(C)C)cc1[N+](=O)[O-] ZINC000174985372 940798431 /nfs/dbraw/zinc/79/84/31/940798431.db2.gz XABIPVGPFPMPML-OAHLLOKOSA-N 0 0 352.456 3.532 20 5 FHBDRN Cn1cc([C@@H](NCc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)cn1 ZINC000376352018 940822199 /nfs/dbraw/zinc/82/21/99/940822199.db2.gz OBUQHKJJTMMASE-SFHVURJKSA-N 0 0 356.813 3.861 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)Cc1c[nH]c2cc(Cl)ccc12 ZINC000170791654 940823808 /nfs/dbraw/zinc/82/38/08/940823808.db2.gz QNWOYHYWVYDFRS-UHFFFAOYSA-N 0 0 357.797 3.931 20 5 FHBDRN CCS[C@H]1CCCC[C@H]1NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000175257142 940832550 /nfs/dbraw/zinc/83/25/50/940832550.db2.gz OVOZGLNLOGSSNG-SJORKVTESA-N 0 0 374.466 3.575 20 5 FHBDRN C[C@](O)(CNC(=O)c1cc2cc([N+](=O)[O-])ccc2s1)c1ccc(F)cc1 ZINC000180219275 940833973 /nfs/dbraw/zinc/83/39/73/940833973.db2.gz GNFVEKDCNFIJAK-SFHVURJKSA-N 0 0 374.393 3.586 20 5 FHBDRN CCS[C@H]1CCCC[C@H]1NC(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000175246703 940836107 /nfs/dbraw/zinc/83/61/07/940836107.db2.gz BCEBJWPWOCDHNK-CJNGLKHVSA-N 0 0 352.456 3.544 20 5 FHBDRN C[C@H](c1cc(F)ccc1F)N(C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000053126854 940847477 /nfs/dbraw/zinc/84/74/77/940847477.db2.gz JUMYITZESCGWGY-GFCCVEGCSA-N 0 0 363.364 3.529 20 5 FHBDRN C[C@H](CCc1ccc(O)cc1)NC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000175338659 940848373 /nfs/dbraw/zinc/84/83/73/940848373.db2.gz INMMCZQIGQYSCY-CQSZACIVSA-N 0 0 371.437 3.856 20 5 FHBDRN Cc1nc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3OC(F)F)cc2o1 ZINC000180233663 940851760 /nfs/dbraw/zinc/85/17/60/940851760.db2.gz RCTFOXRYYFDMFH-UHFFFAOYSA-N 0 0 363.276 3.898 20 5 FHBDRN O=C(c1cccc(Cl)c1[N+](=O)[O-])N1CCO[C@H](c2ccc(F)cc2)C1 ZINC000175336843 940854321 /nfs/dbraw/zinc/85/43/21/940854321.db2.gz GMMCXIWBMQSTQX-HNNXBMFYSA-N 0 0 364.760 3.601 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCOC2(CCC2)C1 ZINC000426618332 945355740 /nfs/dbraw/zinc/35/57/40/945355740.db2.gz FDQYFGBOJSEPIX-MRXNPFEDSA-N 0 0 361.442 3.617 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H](C)OC[C@H]2c2ccccc2)c1 ZINC000175433563 940869324 /nfs/dbraw/zinc/86/93/24/940869324.db2.gz RXSBOYGWPABEHK-ACJLOTCBSA-N 0 0 372.446 3.919 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)NCc2cc(F)cc(F)c2)cc1SC ZINC000170867129 940869341 /nfs/dbraw/zinc/86/93/41/940869341.db2.gz LUHVYBVZQHZWGC-UHFFFAOYSA-N 0 0 368.361 3.534 20 5 FHBDRN O=C(Nc1cc([N+](=O)[O-])c(F)cc1F)c1ccc([N+](=O)[O-])cc1Cl ZINC000124918183 945356126 /nfs/dbraw/zinc/35/61/26/945356126.db2.gz SRWJFJNMIVITQZ-UHFFFAOYSA-N 0 0 357.656 3.687 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCC[C@H]2OCC[C@@H]21 ZINC000180247717 940875442 /nfs/dbraw/zinc/87/54/42/940875442.db2.gz WCLZZZCBFDFZGW-FVQBIDKESA-N 0 0 364.467 3.783 20 5 FHBDRN Cc1cccc(C(=O)NCCOc2ccccc2C(F)(F)F)c1[N+](=O)[O-] ZINC000106654373 945357433 /nfs/dbraw/zinc/35/74/33/945357433.db2.gz PTHCEXDKGIZOIG-UHFFFAOYSA-N 0 0 368.311 3.731 20 5 FHBDRN CN(CCc1ccccc1)C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000180267635 940897971 /nfs/dbraw/zinc/89/79/71/940897971.db2.gz SDBYHVQWTSZPDR-UHFFFAOYSA-N 0 0 350.321 3.511 20 5 FHBDRN Cc1sc(C(=O)NCc2cc(N(C)C)nc3ccccc23)cc1[N+](=O)[O-] ZINC000175607751 940898322 /nfs/dbraw/zinc/89/83/22/940898322.db2.gz STPNUYUEGNPKQH-UHFFFAOYSA-N 0 0 370.434 3.509 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)N[C@@H](C)c2nc3ccccc3[nH]2)cc1[N+](=O)[O-] ZINC000175611985 940899121 /nfs/dbraw/zinc/89/91/21/940899121.db2.gz LLIOIQIXELLPEQ-STQMWFEESA-N 0 0 367.409 3.901 20 5 FHBDRN Cc1ccc(CCCC(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)s1 ZINC000175617930 940900117 /nfs/dbraw/zinc/90/01/17/940900117.db2.gz PMKCCFNGRIHQIT-UHFFFAOYSA-N 0 0 373.478 3.636 20 5 FHBDRN COc1ccc(C(=O)CSc2ccc([N+](=O)[O-])cc2F)cc1OC ZINC000613526694 940917061 /nfs/dbraw/zinc/91/70/61/940917061.db2.gz KVAQMVAFCSBZEZ-UHFFFAOYSA-N 0 0 351.355 3.726 20 5 FHBDRN O=C1[C@H](Sc2ccc([N+](=O)[O-])cc2F)CCN1c1ccccc1F ZINC000613526665 940918382 /nfs/dbraw/zinc/91/83/82/940918382.db2.gz KADVEOKQYBMZJQ-OAHLLOKOSA-N 0 0 350.346 3.771 20 5 FHBDRN COc1ccccc1NCc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-] ZINC000180292423 940920558 /nfs/dbraw/zinc/92/05/58/940920558.db2.gz ZXVGJZAOKGSZQR-UHFFFAOYSA-N 0 0 368.336 3.868 20 5 FHBDRN COc1c(O)ccc(C[NH2+][C@H](C)c2ccc(OC(C)C)cc2)c1[N+](=O)[O-] ZINC000892603676 940922044 /nfs/dbraw/zinc/92/20/44/940922044.db2.gz PWKCUVIRMSSXNT-CYBMUJFWSA-N 0 0 360.410 3.947 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)Nc2cccc(Cl)c2F)c1 ZINC000582874006 940930891 /nfs/dbraw/zinc/93/08/91/940930891.db2.gz CIUWTHAAXRBUJH-UHFFFAOYSA-N 0 0 358.778 3.805 20 5 FHBDRN C[C@@H]1c2ccccc2CCN1C(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000106684177 945361665 /nfs/dbraw/zinc/36/16/65/945361665.db2.gz XPBZUYHWEAHJRL-CQSZACIVSA-N 0 0 362.389 3.540 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)NCc1nc2ccccc2n1C1CC1 ZINC000186028806 940937970 /nfs/dbraw/zinc/93/79/70/940937970.db2.gz AYTCYMJDKNFIAT-UHFFFAOYSA-N 0 0 364.405 3.528 20 5 FHBDRN O=C(Nc1cnc2ccccc2n1)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000176088201 940988427 /nfs/dbraw/zinc/98/84/27/940988427.db2.gz PTUXXMAGHOXUFF-UHFFFAOYSA-N 0 0 362.267 3.809 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1c2ccccc2SC[C@@H]1C ZINC000472588215 940993381 /nfs/dbraw/zinc/99/33/81/940993381.db2.gz JNIMGAAIWSSWMB-ZDUSSCGKSA-N 0 0 357.435 3.843 20 5 FHBDRN Cc1c([C@@H](C)NCc2ccccc2[N+](=O)[O-])nnn1-c1cccc(Cl)c1 ZINC000180414411 941008802 /nfs/dbraw/zinc/00/88/02/941008802.db2.gz IDRZTYPEUIRGTN-GFCCVEGCSA-N 0 0 371.828 3.988 20 5 FHBDRN C[C@@H](NCc1nc(COc2ccc(F)cc2)no1)c1cccc([N+](=O)[O-])c1 ZINC000180452256 941018172 /nfs/dbraw/zinc/01/81/72/941018172.db2.gz LWEOFKXCDHXWNI-GFCCVEGCSA-N 0 0 372.356 3.547 20 5 FHBDRN O=C(Cc1ccc2c(c1)OCO2)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000180467134 941023994 /nfs/dbraw/zinc/02/39/94/941023994.db2.gz ARNHGFJATZHCRF-UHFFFAOYSA-N 0 0 368.267 3.524 20 5 FHBDRN CC(C)Cn1cc(C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)cn1 ZINC000180484978 941028280 /nfs/dbraw/zinc/02/82/80/941028280.db2.gz BEHMNFOSEWOZFZ-UHFFFAOYSA-N 0 0 371.422 3.823 20 5 FHBDRN Nc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(-n2cnc3ccccc32)cc1 ZINC000180609719 941052648 /nfs/dbraw/zinc/05/26/48/941052648.db2.gz RSXHUIFSRHOAEV-UHFFFAOYSA-N 0 0 373.372 3.768 20 5 FHBDRN CCCn1nccc1C1CCN(c2ncnc3sc([N+](=O)[O-])cc32)CC1 ZINC000376474939 941065481 /nfs/dbraw/zinc/06/54/81/941065481.db2.gz PWWWWEDXTUIILA-UHFFFAOYSA-N 0 0 372.454 3.590 20 5 FHBDRN COc1cc(C(=O)Nc2ccc(F)cc2OCC(F)F)ccc1[N+](=O)[O-] ZINC000180763926 941073092 /nfs/dbraw/zinc/07/30/92/941073092.db2.gz UJYXPLMHXDYQKA-UHFFFAOYSA-N 0 0 370.283 3.639 20 5 FHBDRN O=C(Nc1cc([N+](=O)[O-])ccc1[O-])c1cnn(-c2ccccc2)c1C1CC1 ZINC000180765616 941073194 /nfs/dbraw/zinc/07/31/94/941073194.db2.gz UTDCZVISLYSSIM-UHFFFAOYSA-N 0 0 364.361 3.616 20 5 FHBDRN CC(C)[C@H](c1ccccc1)N(C)C(=O)C(=O)Nc1cc(F)cc([N+](=O)[O-])c1 ZINC000472603124 941073800 /nfs/dbraw/zinc/07/38/00/941073800.db2.gz SHHVACFVCZPLSB-QGZVFWFLSA-N 0 0 373.384 3.528 20 5 FHBDRN Nc1cccc([N+](=O)[O-])c1C(=O)Nc1cccc(Oc2ccncc2)c1 ZINC000180774434 941074810 /nfs/dbraw/zinc/07/48/10/941074810.db2.gz MQBFFSPNESMVNU-UHFFFAOYSA-N 0 0 350.334 3.617 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@H](C)OC(C)(C)C1 ZINC000180881840 941089456 /nfs/dbraw/zinc/08/94/56/941089456.db2.gz NQIFGUWTCIJCIZ-LBPRGKRZSA-N 0 0 352.456 3.735 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@H](c2cc[nH]n2)C1 ZINC000180882291 941089458 /nfs/dbraw/zinc/08/94/58/941089458.db2.gz HNXGUFAKOKKPCZ-ZDUSSCGKSA-N 0 0 374.466 3.838 20 5 FHBDRN Cc1ccc(CN(C(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)C(C)C)s1 ZINC000180947779 941095172 /nfs/dbraw/zinc/09/51/72/941095172.db2.gz ILTKZBRTMUBBBM-UHFFFAOYSA-N 0 0 362.407 3.744 20 5 FHBDRN O=[N+]([O-])c1ccc2oc(CN3CCO[C@@H](c4ccccc4Cl)C3)nc2c1 ZINC000177047988 941095828 /nfs/dbraw/zinc/09/58/28/941095828.db2.gz IYYMOQKLBMWPRP-QGZVFWFLSA-N 0 0 373.796 3.963 20 5 FHBDRN O=C(Nc1ccc(OCC(F)(F)F)cc1)c1ccc(F)cc1[N+](=O)[O-] ZINC000177072062 941097989 /nfs/dbraw/zinc/09/79/89/941097989.db2.gz DONYHDHMMHWCDX-UHFFFAOYSA-N 0 0 358.247 3.927 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N2C[C@H](c3ccccc3)C(C)(C)C2)c1 ZINC000122170255 941107172 /nfs/dbraw/zinc/10/71/72/941107172.db2.gz IBRIURPPQQRLEE-QGZVFWFLSA-N 0 0 354.406 3.869 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1)N1CC2(CCOCC2)[C@H]1c1ccccc1 ZINC000414408530 941109817 /nfs/dbraw/zinc/10/98/17/941109817.db2.gz MQDLTRBASQNFMX-GOSISDBHSA-N 0 0 367.405 3.980 20 5 FHBDRN C[C@@H](NC(=O)c1c(N)cccc1[N+](=O)[O-])c1cccc(OC(F)(F)F)c1 ZINC000181177245 941112053 /nfs/dbraw/zinc/11/20/53/941112053.db2.gz IIBJUZAYYMKEJE-SECBINFHSA-N 0 0 369.299 3.567 20 5 FHBDRN C[C@@H](NC(=O)c1c(N)cccc1[N+](=O)[O-])c1ccc(OCC2CC2)c(F)c1 ZINC000181194046 941112677 /nfs/dbraw/zinc/11/26/77/941112677.db2.gz MNQWQZNFLQCUCN-LLVKDONJSA-N 0 0 373.384 3.596 20 5 FHBDRN CCOc1cc(C(=O)N[C@@H]2CCCC[C@H]2C(C)C)c([N+](=O)[O-])cc1OC ZINC000103056308 941115126 /nfs/dbraw/zinc/11/51/26/941115126.db2.gz RRSUDIDXNPFEQT-DZGCQCFKSA-N 0 0 364.442 3.947 20 5 FHBDRN CC(C)[C@@H]1N(C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC12CCOCC2 ZINC000414415405 941116773 /nfs/dbraw/zinc/11/67/73/941116773.db2.gz OPOHTNYESNGURW-HNNXBMFYSA-N 0 0 367.833 3.917 20 5 FHBDRN Cc1ccnc(Oc2ccc(NC(=O)c3csc([N+](=O)[O-])c3)cc2)n1 ZINC000177332919 941118404 /nfs/dbraw/zinc/11/84/04/941118404.db2.gz XMZVNQWOEFOKQH-UHFFFAOYSA-N 0 0 356.363 3.799 20 5 FHBDRN CC(C)OCc1cc(NC(=O)[C@H](C)c2cccc([N+](=O)[O-])c2)ccc1O ZINC000583176209 941123140 /nfs/dbraw/zinc/12/31/40/941123140.db2.gz JYLISNHZNQBRFB-CYBMUJFWSA-N 0 0 358.394 3.968 20 5 FHBDRN COc1cc(N2CCC(OCC3CCCC3)CC2)c([N+](=O)[O-])cc1F ZINC000128312615 941124687 /nfs/dbraw/zinc/12/46/87/941124687.db2.gz VYVHPBKMQVENOH-UHFFFAOYSA-N 0 0 352.406 3.918 20 5 FHBDRN COc1cccc(C2(NC(=O)Cc3ccc([N+](=O)[O-])cc3Cl)CC2)c1 ZINC000122185726 941128569 /nfs/dbraw/zinc/12/85/69/941128569.db2.gz SHYDMWQZWYGNNE-UHFFFAOYSA-N 0 0 360.797 3.605 20 5 FHBDRN CCN(Cc1c[nH]c2ccccc12)C(=O)COc1ccccc1[N+](=O)[O-] ZINC000188903521 941128698 /nfs/dbraw/zinc/12/86/98/941128698.db2.gz APKGYXLUBOIDJN-UHFFFAOYSA-N 0 0 353.378 3.504 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)Nc1cnccc1-c1cccc(F)c1 ZINC000177534215 941134641 /nfs/dbraw/zinc/13/46/41/941134641.db2.gz YHDXVBSRBIISMX-UHFFFAOYSA-N 0 0 367.336 3.813 20 5 FHBDRN Cc1cc(C(=O)Nc2ccc(OCc3ccccc3)cc2[N+](=O)[O-])on1 ZINC000188971716 941135652 /nfs/dbraw/zinc/13/56/52/941135652.db2.gz UYCNLEVOBAIPKJ-UHFFFAOYSA-N 0 0 353.334 3.723 20 5 FHBDRN O=C(c1ccc(Cl)cc1[N+](=O)[O-])N1CCC[C@H]1[C@@H]1CCCCC1=O ZINC000177618506 941139579 /nfs/dbraw/zinc/13/95/79/941139579.db2.gz FKWICVRRTARJHV-JSGCOSHPSA-N 0 0 350.802 3.612 20 5 FHBDRN CCSc1cc(CNC(=O)[C@H](CC)Cc2ccc([N+](=O)[O-])cc2)ccn1 ZINC000189097014 941145474 /nfs/dbraw/zinc/14/54/74/941145474.db2.gz PZQIVXZXIBUYRG-MRXNPFEDSA-N 0 0 373.478 3.987 20 5 FHBDRN O=C(Nc1cc(F)cc(F)c1Br)c1cccc([N+](=O)[O-])c1 ZINC000189058041 941146026 /nfs/dbraw/zinc/14/60/26/941146026.db2.gz DGWROMAMOXYNIS-UHFFFAOYSA-N 0 0 357.110 3.888 20 5 FHBDRN COc1cc(C(=O)Nc2cccc(-c3cnco3)c2)cc([N+](=O)[O-])c1C ZINC000189071607 941146239 /nfs/dbraw/zinc/14/62/39/941146239.db2.gz GMMRFWGSQGMJPE-UHFFFAOYSA-N 0 0 353.334 3.819 20 5 FHBDRN O=C(Cn1cc([N+](=O)[O-])cn1)Nc1ccc(Cl)cc1-c1ccccc1 ZINC000189072976 941146248 /nfs/dbraw/zinc/14/62/48/941146248.db2.gz NXFHKEHVNHGKLO-UHFFFAOYSA-N 0 0 356.769 3.750 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])Nc1ccc(F)cc1OCC(F)F ZINC000181389111 941146773 /nfs/dbraw/zinc/14/67/73/941146773.db2.gz MURXRGDJYWWYQH-UHFFFAOYSA-N 0 0 369.299 3.700 20 5 FHBDRN CCN1C(=O)c2cc(Cl)ccc2N[C@H]1c1ccc([N+](=O)[O-])c(OC)c1 ZINC000092198903 941147731 /nfs/dbraw/zinc/14/77/31/941147731.db2.gz USKIYKKAONHGTE-MRXNPFEDSA-N 0 0 361.785 3.843 20 5 FHBDRN O=C(c1cc(Cl)ccc1[N+](=O)[O-])N1CCO[C@H](c2cccc(F)c2)C1 ZINC000066694596 941150615 /nfs/dbraw/zinc/15/06/15/941150615.db2.gz NKUDVEUQRWZRMS-INIZCTEOSA-N 0 0 364.760 3.601 20 5 FHBDRN COc1cc(CNCc2ccc(Cl)cc2F)c([N+](=O)[O-])cc1OC ZINC000189195120 941153813 /nfs/dbraw/zinc/15/38/13/941153813.db2.gz AESNRPGLIUJJMO-UHFFFAOYSA-N 0 0 354.765 3.694 20 5 FHBDRN CC(C)c1nnc2ccc(NC(=O)c3c(Cl)cccc3[N+](=O)[O-])cn21 ZINC000189221066 941154810 /nfs/dbraw/zinc/15/48/10/941154810.db2.gz KDDXEUDDDFRFGS-UHFFFAOYSA-N 0 0 359.773 3.667 20 5 FHBDRN CSc1cccc(N(C)S(=O)(=O)c2c(C)ccc(C)c2[N+](=O)[O-])c1 ZINC000189281371 941156761 /nfs/dbraw/zinc/15/67/61/941156761.db2.gz PLOFUVRDWVYEDY-UHFFFAOYSA-N 0 0 366.464 3.759 20 5 FHBDRN COc1ccc2[nH]c(C(=O)N[C@@H](C)c3ccc(C)c([N+](=O)[O-])c3)cc2c1 ZINC000189395715 941157160 /nfs/dbraw/zinc/15/71/60/941157160.db2.gz OHNIQNXECLZZFZ-LBPRGKRZSA-N 0 0 353.378 3.884 20 5 FHBDRN CCn1nccc1CCSc1ccc(Br)cc1[N+](=O)[O-] ZINC000189478154 941158942 /nfs/dbraw/zinc/15/89/42/941158942.db2.gz KAPZEKOMNGMRTN-UHFFFAOYSA-N 0 0 356.245 3.909 20 5 FHBDRN CC(C)CCSc1ccc(C(=O)N2CC[C@@H](C)[C@H]2CO)cc1[N+](=O)[O-] ZINC000189492441 941159123 /nfs/dbraw/zinc/15/91/23/941159123.db2.gz FFRXZFCTSXNTRQ-CZUORRHYSA-N 0 0 366.483 3.576 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)Nc1ccc(OC(F)F)nc1 ZINC000549099742 941159650 /nfs/dbraw/zinc/15/96/50/941159650.db2.gz BZHRCMXCXVDCAP-UHFFFAOYSA-N 0 0 372.715 3.566 20 5 FHBDRN Cc1nn(-c2ccccc2)cc1NC(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000181417492 941160875 /nfs/dbraw/zinc/16/08/75/941160875.db2.gz XBSIUEHAMFSMRE-UHFFFAOYSA-N 0 0 368.418 3.820 20 5 FHBDRN Cc1c(NC(=O)[C@H](C)Nc2cccc3ccn(C)c32)cccc1[N+](=O)[O-] ZINC000189584041 941163018 /nfs/dbraw/zinc/16/30/18/941163018.db2.gz UPENJROMZAFMIK-ZDUSSCGKSA-N 0 0 352.394 3.834 20 5 FHBDRN Cc1c(NC(=O)[C@@H](C)Nc2cccc3ccn(C)c32)cccc1[N+](=O)[O-] ZINC000189584026 941163069 /nfs/dbraw/zinc/16/30/69/941163069.db2.gz UPENJROMZAFMIK-CYBMUJFWSA-N 0 0 352.394 3.834 20 5 FHBDRN COc1cc(C(=O)Nc2cnn(-c3ccccc3)c2C)cc([N+](=O)[O-])c1C ZINC000189606948 941221471 /nfs/dbraw/zinc/22/14/71/941221471.db2.gz PSTOSLAVASSXDU-UHFFFAOYSA-N 0 0 366.377 3.658 20 5 FHBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CCc2sccc2C1 ZINC000178453739 941256720 /nfs/dbraw/zinc/25/67/20/941256720.db2.gz UQTMLFVYXBWCEW-UHFFFAOYSA-N 0 0 367.224 3.617 20 5 FHBDRN O=C(c1cc2c(c([N+](=O)[O-])c1)OCO2)N1CCC[C@H](c2ccccc2)CC1 ZINC000181440638 941259937 /nfs/dbraw/zinc/25/99/37/941259937.db2.gz XHRZLJPGUIRCDS-HNNXBMFYSA-N 0 0 368.389 3.733 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)Nc2cnn([C@H](C)C3CC3)c2)cc1[N+](=O)[O-] ZINC000189749277 941271073 /nfs/dbraw/zinc/27/10/73/941271073.db2.gz AGYVUIRPYUXXDP-CHWSQXEVSA-N 0 0 357.414 3.953 20 5 FHBDRN O=C(c1ccc(Cl)cc1[N+](=O)[O-])N1CC2(CCOCC2)c2ccccc21 ZINC000189781220 941276713 /nfs/dbraw/zinc/27/67/13/941276713.db2.gz UIQIGLFMVGLESE-UHFFFAOYSA-N 0 0 372.808 3.957 20 5 FHBDRN Cc1cc(O)ccc1NC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000189793533 941280875 /nfs/dbraw/zinc/28/08/75/941280875.db2.gz ANUFRHAGKHKGCK-UHFFFAOYSA-N 0 0 353.281 3.854 20 5 FHBDRN Cc1ccc(C)c(S(=O)(=O)N(Cc2cccs2)C2CC2)c1[N+](=O)[O-] ZINC000189831013 941284124 /nfs/dbraw/zinc/28/41/24/941284124.db2.gz KJSRWIRUVBKMDA-UHFFFAOYSA-N 0 0 366.464 3.626 20 5 FHBDRN C[C@@H](SCc1ccc([N+](=O)[O-])cc1)c1ccc(S(C)(=O)=O)cc1 ZINC000189865525 941294470 /nfs/dbraw/zinc/29/44/70/941294470.db2.gz LHPSFQIBGBCRKJ-GFCCVEGCSA-N 0 0 351.449 3.993 20 5 FHBDRN CC(C)c1ccc(C(=O)N[C@@H](C[S@](C)=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000189918610 941303502 /nfs/dbraw/zinc/30/35/02/941303502.db2.gz FIVMKZZBMMCMRH-QLXKLKPCSA-N 0 0 374.462 3.568 20 5 FHBDRN O=C(COC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)CC1CC1 ZINC000782940458 941310037 /nfs/dbraw/zinc/31/00/37/941310037.db2.gz GYXSQLGSXBRKPN-UHFFFAOYSA-N 0 0 355.346 3.913 20 5 FHBDRN Cc1ccc(C(=O)OCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)cc1Cl ZINC000728673977 941328542 /nfs/dbraw/zinc/32/85/42/941328542.db2.gz KYJICQADSZXOCO-UHFFFAOYSA-N 0 0 373.752 3.964 20 5 FHBDRN CS[C@H]1CCC[C@@H](NC(=O)c2cccc([N+](=O)[O-])c2Br)C1 ZINC000180568178 941359082 /nfs/dbraw/zinc/35/90/82/941359082.db2.gz KGZLOQNLIJSQBE-ZJUUUORDSA-N 0 0 373.272 3.761 20 5 FHBDRN O=C(c1ccc(SCc2c(F)cccc2[N+](=O)[O-])nc1)N1CCCC1 ZINC000103349927 941362491 /nfs/dbraw/zinc/36/24/91/941362491.db2.gz YAYOMEFTZQSRQP-UHFFFAOYSA-N 0 0 361.398 3.657 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H](C)Oc3ccc(Cl)cc32)c1 ZINC000072530949 941367681 /nfs/dbraw/zinc/36/76/81/941367681.db2.gz JJRSZSSJAZIFKW-SNVBAGLBSA-N 0 0 362.769 3.685 20 5 FHBDRN CC(=O)N1C[C@H](CCC(=O)Oc2c(C)cccc2[N+](=O)[O-])c2ccccc21 ZINC000376623802 941372765 /nfs/dbraw/zinc/37/27/65/941372765.db2.gz RTCVGMGDVGKRRX-HNNXBMFYSA-N 0 0 368.389 3.739 20 5 FHBDRN CC(=O)c1ccc(OC(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)c(F)c1 ZINC001125852398 941379202 /nfs/dbraw/zinc/37/92/02/941379202.db2.gz NVEZBDHPFDYCPT-UHFFFAOYSA-N 0 0 361.325 3.943 20 5 FHBDRN Cc1sc(C(=O)N[C@@H](C)c2nc(C(F)(F)F)cs2)cc1[N+](=O)[O-] ZINC000278809394 941385097 /nfs/dbraw/zinc/38/50/97/941385097.db2.gz SHNWNXKRVWWTNR-YFKPBYRVSA-N 0 0 365.358 3.931 20 5 FHBDRN CC(C)(C)C(=O)N1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000128312940 941393864 /nfs/dbraw/zinc/39/38/64/941393864.db2.gz HEAXRDGVRXOXCV-UHFFFAOYSA-N 0 0 371.437 3.545 20 5 FHBDRN CC(=O)N1C[C@@H](CCC(=O)Nc2ccc(F)c([N+](=O)[O-])c2)c2ccccc21 ZINC000376956371 941477367 /nfs/dbraw/zinc/47/73/67/941477367.db2.gz RKWTYZRWHHKHIB-CYBMUJFWSA-N 0 0 371.368 3.603 20 5 FHBDRN CCOc1cc(NC(=O)[C@@H]2CCC(=O)c3ccccc32)ccc1[N+](=O)[O-] ZINC000892745227 941506284 /nfs/dbraw/zinc/50/62/84/941506284.db2.gz UDKLOEVYCUCMKQ-OAHLLOKOSA-N 0 0 354.362 3.692 20 5 FHBDRN CCOc1cc(NC(=O)c2c(Cl)n(C)nc2C(C)C)ccc1[N+](=O)[O-] ZINC000892747744 941509866 /nfs/dbraw/zinc/50/98/66/941509866.db2.gz YYYFDVADYGFSEX-UHFFFAOYSA-N 0 0 366.805 3.756 20 5 FHBDRN CC(=O)c1cc(-c2nc(-c3ccc(C)c([N+](=O)[O-])c3)no2)c(C)nc1C ZINC000472660577 941510109 /nfs/dbraw/zinc/51/01/09/941510109.db2.gz RAGNFLJPDFPRLR-UHFFFAOYSA-N 0 0 352.350 3.835 20 5 FHBDRN CC[C@H](NC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12)c1nc2ccccc2[nH]1 ZINC000066766486 941515341 /nfs/dbraw/zinc/51/53/41/941515341.db2.gz YVSQVXCPBPOYTH-AWEZNQCLSA-N 0 0 363.377 3.834 20 5 FHBDRN C[C@@H](N[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1cccc(O)c1 ZINC000181534869 941530868 /nfs/dbraw/zinc/53/08/68/941530868.db2.gz SEVMWRIXGMCKFW-NEPJUHHUSA-N 0 0 354.366 3.762 20 5 FHBDRN Cc1nccc(-c2cccc(NC(=O)c3cc(F)ccc3[N+](=O)[O-])c2)n1 ZINC000377173420 941541111 /nfs/dbraw/zinc/54/11/11/941541111.db2.gz KFYALYIVVFXLEF-UHFFFAOYSA-N 0 0 352.325 3.752 20 5 FHBDRN CC(=O)c1ccc([N+](=O)[O-])cc1N1CCC(C(=O)c2ccc(O)cc2)CC1 ZINC000377175326 941541844 /nfs/dbraw/zinc/54/18/44/941541844.db2.gz LUADCGLHBRXLQI-UHFFFAOYSA-N 0 0 368.389 3.602 20 5 FHBDRN COc1cc2c(cc1F)CC[C@@H]2NC(=O)Nc1ccc(C)c([N+](=O)[O-])c1 ZINC000549153296 941546388 /nfs/dbraw/zinc/54/63/88/941546388.db2.gz GYFZNBUAXNVYAU-HNNXBMFYSA-N 0 0 359.357 3.860 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1CN[C@H]1CC(C)(C)Oc2ccc(N)cc21 ZINC000415035214 941558207 /nfs/dbraw/zinc/55/82/07/941558207.db2.gz LVYZOENMWMMQQT-KRWDZBQOSA-N 0 0 371.437 3.968 20 5 FHBDRN 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FHBDRN Cc1cccc([N+](=O)[O-])c1OC(=O)c1ccc(CN(C)C(=O)C(C)C)cc1 ZINC000760013391 941748688 /nfs/dbraw/zinc/74/86/88/941748688.db2.gz BBKOQYQPGWJRAH-UHFFFAOYSA-N 0 0 370.405 3.737 20 5 FHBDRN Cc1onc(-c2cccnc2)c1-c1nc(-c2ccc([N+](=O)[O-])s2)no1 ZINC000377467886 941749131 /nfs/dbraw/zinc/74/91/31/941749131.db2.gz GVHPVYLDTADRFF-UHFFFAOYSA-N 0 0 355.335 3.732 20 5 FHBDRN Cc1cc(N(C)C)ccc1NC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C ZINC000122467358 941758953 /nfs/dbraw/zinc/75/89/53/941758953.db2.gz FDHPHJBNJSKORZ-UHFFFAOYSA-N 0 0 372.381 3.747 20 5 FHBDRN CCOc1cccc(CCNC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)c1 ZINC000433559401 941759553 /nfs/dbraw/zinc/75/95/53/941759553.db2.gz HMOPRXSUTZRGFW-UHFFFAOYSA-N 0 0 369.421 3.540 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N[C@H]2CCC[C@H]2c2ccccc2)c1F ZINC000412106950 941764747 /nfs/dbraw/zinc/76/47/47/941764747.db2.gz JFJHPZNAQLYRAI-HOCLYGCPSA-N 0 0 372.396 3.738 20 5 FHBDRN C[C@H]([C@@H]1Cc2ccccc2O1)N(C)C(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000433565966 941767112 /nfs/dbraw/zinc/76/71/12/941767112.db2.gz XVVUXOZPDHCKIG-XIKOKIGWSA-N 0 0 366.373 3.805 20 5 FHBDRN C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CCC[C@H]1c1nccs1 ZINC000377503253 941769940 /nfs/dbraw/zinc/76/99/40/941769940.db2.gz RFQQKLFYSVRGFD-RISCZKNCSA-N 0 0 371.422 3.999 20 5 FHBDRN CC1(C)CC(Nc2cc([N+](=O)[O-])cc(Br)n2)CC(C)(C)N1O ZINC001167717674 941787132 /nfs/dbraw/zinc/78/71/32/941787132.db2.gz ATVJXZHBSLTKDI-UHFFFAOYSA-N 0 0 373.251 3.575 20 5 FHBDRN CNC(=O)c1ccc(N2CC[C@H](c3ccccc3)C[C@H]2C)c([N+](=O)[O-])c1 ZINC000542138681 941791482 /nfs/dbraw/zinc/79/14/82/941791482.db2.gz LRBGKVQQZDIQPL-ZBFHGGJFSA-N 0 0 353.422 3.727 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1F)N[C@@H](C[C@H]1CCOC1)c1ccccc1 ZINC000122548662 941791646 /nfs/dbraw/zinc/79/16/46/941791646.db2.gz PGUJDTYFWPFCFM-KUHUBIRLSA-N 0 0 372.396 3.561 20 5 FHBDRN CC(C)CCOC(=O)[C@H](C)Oc1ccc(Br)c([N+](=O)[O-])c1 ZINC001225504966 941792553 /nfs/dbraw/zinc/79/25/53/941792553.db2.gz 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C[C@@]1(CCc2ccccc2)CCN(c2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000433654611 941815492 /nfs/dbraw/zinc/81/54/92/941815492.db2.gz CQMOSEYESHKHSW-HXUWFJFHSA-N 0 0 353.422 3.543 20 5 FHBDRN CC(C)N(CC(=O)N1CCCCCC1)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000513253361 941819277 /nfs/dbraw/zinc/81/92/77/941819277.db2.gz YYVUOPLTAYCENM-UHFFFAOYSA-N 0 0 367.877 3.861 20 5 FHBDRN COC(=O)c1cnc(NCc2ccc(OC(C)(C)C)cc2)c([N+](=O)[O-])c1 ZINC000616176937 941820274 /nfs/dbraw/zinc/82/02/74/941820274.db2.gz XJSDQZVGIXKXSG-UHFFFAOYSA-N 0 0 359.382 3.566 20 5 FHBDRN COc1ccc(NC(=O)CSc2ccc(N)cc2Cl)c([N+](=O)[O-])c1 ZINC000513269262 941823670 /nfs/dbraw/zinc/82/36/70/941823670.db2.gz VKVJKFUYNVQJLQ-UHFFFAOYSA-N 0 0 367.814 3.570 20 5 FHBDRN O=C(COc1cc(F)cc([N+](=O)[O-])c1)c1cccc(Br)c1 ZINC000433665811 941826104 /nfs/dbraw/zinc/82/61/04/941826104.db2.gz WINVDAWZAGAEAO-UHFFFAOYSA-N 0 0 354.131 3.758 20 5 FHBDRN Cc1c(NC(=O)C(=O)N(C)C2CCC(C(C)C)CC2)cccc1[N+](=O)[O-] ZINC000433676976 941829585 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941855959 /nfs/dbraw/zinc/85/59/59/941855959.db2.gz CVXIZQPPZPISHC-CQSZACIVSA-N 0 0 364.442 3.900 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CC[C@H]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000412162255 941857229 /nfs/dbraw/zinc/85/72/29/941857229.db2.gz KXOQDARQLJIKQO-KRWDZBQOSA-N 0 0 354.406 3.839 20 5 FHBDRN C[C@H](NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)[C@H]1Oc2ccccc2[C@H]1C ZINC000412170947 941858374 /nfs/dbraw/zinc/85/83/74/941858374.db2.gz JPAMKDASBVKPJA-JFYDQMMZSA-N 0 0 366.417 3.768 20 5 FHBDRN CC(=O)N1C[C@@H](C)CN(C(=O)c2ccc([N+](=O)[O-])c(C)c2)c2ccccc21 ZINC000365629640 941860283 /nfs/dbraw/zinc/86/02/83/941860283.db2.gz SBMWWLKQYRWDNX-CYBMUJFWSA-N 0 0 367.405 3.553 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N[C@H](C)c2ccc(F)c(C)c2)c1F ZINC000412178281 941860674 /nfs/dbraw/zinc/86/06/74/941860674.db2.gz MYCDIISPRPEXQX-LLVKDONJSA-N 0 0 364.348 3.610 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N(CCC(F)(F)F)CC1CC1 ZINC000412171917 941861625 /nfs/dbraw/zinc/86/16/25/941861625.db2.gz 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ZINC000103463494 941898067 /nfs/dbraw/zinc/89/80/67/941898067.db2.gz QXDHZNHUYPQOBV-UHFFFAOYSA-N 0 0 350.378 3.714 20 5 FHBDRN Cc1c(NC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)cnn1CCC(C)C ZINC000412197539 941898336 /nfs/dbraw/zinc/89/83/36/941898336.db2.gz DIRMRPUKXGEEPV-DLBZAZTESA-N 0 0 356.426 3.888 20 5 FHBDRN O=C(c1sc(Br)cc1[N+](=O)[O-])N1CC[C@@H](c2ccco2)C1 ZINC000365656539 941903722 /nfs/dbraw/zinc/90/37/22/941903722.db2.gz CCZVMHHNVOAPSB-MRVPVSSYSA-N 0 0 371.212 3.642 20 5 FHBDRN COc1ccc(N(C)C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)cc1F ZINC000182382681 941914059 /nfs/dbraw/zinc/91/40/59/941914059.db2.gz UVJXCVNHAZCSBA-UHFFFAOYSA-N 0 0 370.283 3.621 20 5 FHBDRN NC(=O)c1ccc(CSC[C@@H]2CCc3ccccc3C2)c([N+](=O)[O-])c1 ZINC000513436153 941921665 /nfs/dbraw/zinc/92/16/65/941921665.db2.gz BMPHSMZGBAHUSW-CYBMUJFWSA-N 0 0 356.447 3.732 20 5 FHBDRN Cc1ccc(C(=O)N[C@@H]2CCO[C@@H]2c2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000182433973 941925047 /nfs/dbraw/zinc/92/50/47/941925047.db2.gz 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O=[N+]([O-])c1cc2ccccc2nc1NCc1ccc(N2CCCCC2)nc1 ZINC000473528697 941935096 /nfs/dbraw/zinc/93/50/96/941935096.db2.gz UMKPOUICFVIRKI-UHFFFAOYSA-N 0 0 363.421 3.562 20 5 FHBDRN CC[C@H](NC(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1)c1c(C)noc1C ZINC000412221588 941937847 /nfs/dbraw/zinc/93/78/47/941937847.db2.gz XDKSMQKLHWERSJ-AWEZNQCLSA-N 0 0 361.398 3.868 20 5 FHBDRN COc1c2ccccc2[nH]c1C(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000513452363 941938271 /nfs/dbraw/zinc/93/82/71/941938271.db2.gz XNXSOJRUMUTMMO-UHFFFAOYSA-N 0 0 367.405 3.837 20 5 FHBDRN CCc1cnccc1[C@H](C)NC(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1 ZINC000412225311 941940065 /nfs/dbraw/zinc/94/00/65/941940065.db2.gz GWCAKFHWGWOZJU-ZDUSSCGKSA-N 0 0 357.410 3.830 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCN(C(=O)c2cccc(F)c2)CC1 ZINC000182612540 941947457 /nfs/dbraw/zinc/94/74/57/941947457.db2.gz KVCGSUMDHNOCRN-OAHLLOKOSA-N 0 0 371.412 3.561 20 5 FHBDRN COc1ccccc1O[C@H]1CCCN(C(=O)Nc2cccc([N+](=O)[O-])c2)C1 ZINC000513472597 941952712 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CCCOc1ccc(C(=O)CCC(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000005704494 941963228 /nfs/dbraw/zinc/96/32/28/941963228.db2.gz CIYQVQYFAMEMBG-UHFFFAOYSA-N 0 0 356.378 3.985 20 5 FHBDRN O=C(N[C@H](c1c(F)cccc1F)C(F)(F)F)c1ccc([N+](=O)[O-])s1 ZINC000182747871 941964662 /nfs/dbraw/zinc/96/46/62/941964662.db2.gz LBWCSVAKHDWEBH-LLVKDONJSA-N 0 0 366.267 3.968 20 5 FHBDRN COc1cc(CSC[C@@H]2CCCO2)c([N+](=O)[O-])cc1OCC(F)F ZINC000182812251 941970737 /nfs/dbraw/zinc/97/07/37/941970737.db2.gz BYXBALYOGDVPCI-NSHDSACASA-N 0 0 363.382 3.660 20 5 FHBDRN CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F)c1cc(F)ccc1F ZINC000182819908 941972308 /nfs/dbraw/zinc/97/23/08/941972308.db2.gz HAWGHLCVYHJMJD-UHFFFAOYSA-N 0 0 358.247 3.751 20 5 FHBDRN COc1ccc(-c2noc([C@H](C)Sc3ncccc3[N+](=O)[O-])n2)cc1 ZINC000129346626 941977371 /nfs/dbraw/zinc/97/73/71/941977371.db2.gz DAEQBTIZFAOAJJ-JTQLQIEISA-N 0 0 358.379 3.902 20 5 FHBDRN Cc1cc(C(=O)N2CC[C@H](Oc3cccc(Cl)c3)C2)cc([N+](=O)[O-])c1 ZINC000536250382 941985410 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353.806 3.529 20 5 FHBDRN Cc1ccc([C@]2(C)CCN(C(=O)CCOc3ccccc3[N+](=O)[O-])C2)cc1 ZINC000433953204 942014459 /nfs/dbraw/zinc/01/44/59/942014459.db2.gz ZCYULGIWEFXEPX-OAQYLSRUSA-N 0 0 368.433 3.862 20 5 FHBDRN Cc1ccc(C(=O)N(Cc2ccncc2)Cc2cccnc2)cc1[N+](=O)[O-] ZINC000072576715 942017674 /nfs/dbraw/zinc/01/76/74/942017674.db2.gz MYBQJAAEPUCXIY-UHFFFAOYSA-N 0 0 362.389 3.536 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCC(=O)N(C)[C@@H]2CCCc3ccccc32)c1 ZINC000024542751 942017718 /nfs/dbraw/zinc/01/77/18/942017718.db2.gz KAQUBVFACSZANS-QGZVFWFLSA-N 0 0 354.406 3.818 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)NCCc2cc(Cl)cc(Cl)c2)c1[N+](=O)[O-] ZINC000433980213 942022830 /nfs/dbraw/zinc/02/28/30/942022830.db2.gz HFMOJYLRMRVJDP-UHFFFAOYSA-N 0 0 371.224 3.721 20 5 FHBDRN O=C(Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1)c1ccc2ncccc2c1 ZINC000101949705 942027917 /nfs/dbraw/zinc/02/79/17/942027917.db2.gz BSFMRZNOPSEQCW-UHFFFAOYSA-N 0 0 359.345 3.785 20 5 FHBDRN Cc1ccccc1C[C@H]1CCCN1C(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000513575273 942028966 /nfs/dbraw/zinc/02/89/66/942028966.db2.gz VLTGFQJZGQCMSZ-GOSISDBHSA-N 0 0 354.406 3.516 20 5 FHBDRN COc1cc(C(=O)N2CCC[C@@H]2Cc2ccccc2C)ccc1[N+](=O)[O-] ZINC000513596341 942033076 /nfs/dbraw/zinc/03/30/76/942033076.db2.gz AAQVPVPSIUCMAY-QGZVFWFLSA-N 0 0 354.406 3.759 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)NCc1cccc2c1CCCN2 ZINC000415755388 942036519 /nfs/dbraw/zinc/03/65/19/942036519.db2.gz CUIOCZHSVXEQRZ-UHFFFAOYSA-N 0 0 354.410 3.837 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000158999720 942039252 /nfs/dbraw/zinc/03/92/52/942039252.db2.gz CMICBUURRKOPMT-KXBFYZLASA-N 0 0 354.406 3.801 20 5 FHBDRN COc1ccc(Nc2c([N+](=O)[O-])c(C)nn2C)cc1Cc1ccccc1 ZINC000513620630 942042555 /nfs/dbraw/zinc/04/25/55/942042555.db2.gz SRZZGJRELCCKRL-UHFFFAOYSA-N 0 0 352.394 3.980 20 5 FHBDRN CC(C)(CNC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12)Oc1ccccc1 ZINC000513651458 942055698 /nfs/dbraw/zinc/05/56/98/942055698.db2.gz ZZOUOBIMVOXKEJ-UHFFFAOYSA-N 0 0 353.378 3.664 20 5 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FHBDRN C[C@H](OC(=O)/C=C/c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1Cl ZINC000015655001 942306658 /nfs/dbraw/zinc/30/66/58/942306658.db2.gz HUZIBGOKBKEBOU-OBIHZWKSSA-N 0 0 374.780 3.832 20 5 FHBDRN CC(C)(C)c1n[nH]cc1C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000513737178 942308431 /nfs/dbraw/zinc/30/84/31/942308431.db2.gz WJTMKRIAEZXTFR-UHFFFAOYSA-N 0 0 367.203 3.630 20 5 FHBDRN Cc1nn(Cc2ccc(C(=O)N3C[C@H](C)[C@H](C)[C@H]3C)cc2)c(C)c1[N+](=O)[O-] ZINC000416079031 942318478 /nfs/dbraw/zinc/31/84/78/942318478.db2.gz TTWHXZVPYPKGEZ-KCQAQPDRSA-N 0 0 370.453 3.573 20 5 FHBDRN COc1cc(C(=O)N2CC[C@@H](Cc3ccccc3)C2)cc([N+](=O)[O-])c1C ZINC000188046663 942319848 /nfs/dbraw/zinc/31/98/48/942319848.db2.gz YNLVARAWLHKLTA-INIZCTEOSA-N 0 0 354.406 3.617 20 5 FHBDRN O=C(Nc1cccc2c1CCO2)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000434140632 942320079 /nfs/dbraw/zinc/32/00/79/942320079.db2.gz FFCLYHOMCAQBHM-UHFFFAOYSA-N 0 0 353.378 3.726 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)N1CC=C(c2ccc(O)cc2)CC1 ZINC000183492624 942321500 /nfs/dbraw/zinc/32/15/00/942321500.db2.gz ZCCSNTKWTNZNAR-UHFFFAOYSA-N 0 0 370.430 3.708 20 5 FHBDRN CC(C)c1ccc(C(=O)NCc2ccn(C3CCCC3)n2)cc1[N+](=O)[O-] ZINC000188056367 942322790 /nfs/dbraw/zinc/32/27/90/942322790.db2.gz JUKXYAUAOLFLFZ-UHFFFAOYSA-N 0 0 356.426 3.960 20 5 FHBDRN CC[C@@H](NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)[C@H]1CC1(C)C ZINC000416079958 942326712 /nfs/dbraw/zinc/32/67/12/942326712.db2.gz LDECWQAAPAPUAQ-HZPDHXFCSA-N 0 0 359.470 3.752 20 5 FHBDRN O=[N+]([O-])c1cccc2ncnc(N3CCC[C@H](Oc4ccccc4)C3)c21 ZINC000413537165 942326912 /nfs/dbraw/zinc/32/69/12/942326912.db2.gz GOKXZCDCBIKENF-HNNXBMFYSA-N 0 0 350.378 3.586 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1[C@H](C)SCc1ccc(S(C)(=O)=O)o1 ZINC000419616334 942328928 /nfs/dbraw/zinc/32/89/28/942328928.db2.gz WBSATYURNLATSX-NSHDSACASA-N 0 0 355.437 3.894 20 5 FHBDRN Cc1ccc(C)c(NC(=O)[C@H](C)OC(=O)c2ccc([N+](=O)[O-])c(C)c2)c1 ZINC000015698925 942331665 /nfs/dbraw/zinc/33/16/65/942331665.db2.gz QJEJHKDZXUKMEW-AWEZNQCLSA-N 0 0 356.378 3.704 20 5 FHBDRN CCOc1cc(C(=O)N[C@@H](CC)[C@@H]2CC2(C)C)c([N+](=O)[O-])cc1OC ZINC000416085636 942332918 /nfs/dbraw/zinc/33/29/18/942332918.db2.gz RRAZGKXZDUIBJI-STQMWFEESA-N 0 0 350.415 3.557 20 5 FHBDRN CC[C@H](NC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)[C@@H]1CC1(C)C ZINC000416085724 942333153 /nfs/dbraw/zinc/33/31/53/942333153.db2.gz SBDLXACYSNBKBD-HOTGVXAUSA-N 0 0 356.426 3.550 20 5 FHBDRN O=C(NCCCOc1ccccc1F)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000015712929 942336536 /nfs/dbraw/zinc/33/65/36/942336536.db2.gz ZVAJPWFQSAUKDF-UHFFFAOYSA-N 0 0 352.749 3.586 20 5 FHBDRN CC(C)[C@H]1N(C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)CC12CCOCC2 ZINC000413138395 942337624 /nfs/dbraw/zinc/33/76/24/942337624.db2.gz GYGUUNNXDPIWOR-RHSMWYFYSA-N 0 0 361.442 3.502 20 5 FHBDRN CC(C)(C)C(=O)NC[C@H]1CCCN(c2nc3ccccc3cc2[N+](=O)[O-])C1 ZINC000473537119 942340290 /nfs/dbraw/zinc/34/02/90/942340290.db2.gz ZNKLEUZRZVVMQS-CQSZACIVSA-N 0 0 370.453 3.522 20 5 FHBDRN C[C@H](CNc1ccc(C(=O)c2nccn2C)cc1[N+](=O)[O-])CC(F)(F)F ZINC000413542387 942340417 /nfs/dbraw/zinc/34/04/17/942340417.db2.gz WYWVPKYLGPGUFD-JTQLQIEISA-N 0 0 370.331 3.560 20 5 FHBDRN Cc1cc(F)cc([C@@]2(F)CCN(C(=O)Cc3cccc([N+](=O)[O-])c3C)C2)c1 ZINC000501177519 942342179 /nfs/dbraw/zinc/34/21/79/942342179.db2.gz SCTLFNBMPBZROZ-HXUWFJFHSA-N 0 0 374.387 3.991 20 5 FHBDRN COCc1cc(CNc2ncc([N+](=O)[O-])cc2C(F)(F)F)ccc1F ZINC000413134108 942343258 /nfs/dbraw/zinc/34/32/58/942343258.db2.gz KUKFVFGWJUXOLF-UHFFFAOYSA-N 0 0 359.279 3.906 20 5 FHBDRN CC(C)n1cnnc1[C@H]1CCCN(c2nccc3ccc([N+](=O)[O-])cc32)C1 ZINC000413147482 942349056 /nfs/dbraw/zinc/34/90/56/942349056.db2.gz OQXIKEIMPJKHTQ-HNNXBMFYSA-N 0 0 366.425 3.699 20 5 FHBDRN CCOc1ccc(C(F)(F)F)cc1NC(=O)c1ccc([N+](=O)[O-])n1C ZINC000502317214 942349212 /nfs/dbraw/zinc/34/92/12/942349212.db2.gz BABNAZLATVKDNO-UHFFFAOYSA-N 0 0 357.288 3.603 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N(C)Cc1cc(F)c(F)c(F)c1 ZINC000122877268 942350317 /nfs/dbraw/zinc/35/03/17/942350317.db2.gz HHSDKSOKLHPFOS-UHFFFAOYSA-N 0 0 369.299 3.685 20 5 FHBDRN CSc1cccc(C(=O)N2CCSC[C@@H]2C2CCC2)c1[N+](=O)[O-] ZINC000416105862 942352293 /nfs/dbraw/zinc/35/22/93/942352293.db2.gz GCHPQVVFBWSIGA-CYBMUJFWSA-N 0 0 352.481 3.674 20 5 FHBDRN C[C@H](NC(=O)Cc1cccc([N+](=O)[O-])c1)c1ccc(OCC2CC2)c(F)c1 ZINC000120192677 942353297 /nfs/dbraw/zinc/35/32/97/942353297.db2.gz RZFRNRNETIUUHI-ZDUSSCGKSA-N 0 0 372.396 3.943 20 5 FHBDRN CO[C@H]1CCCC[C@@H]1C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000513741745 942354851 /nfs/dbraw/zinc/35/48/51/942354851.db2.gz PPHFRXLQQSKDEX-STQMWFEESA-N 0 0 357.204 3.501 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N1CCSC[C@@H]1C1CCC1 ZINC000416113852 942357594 /nfs/dbraw/zinc/35/75/94/942357594.db2.gz OJDVDKKLDJNASP-OAHLLOKOSA-N 0 0 354.859 3.535 20 5 FHBDRN COc1cc(Sc2ccc3c(c2)OCCCO3)c([N+](=O)[O-])cc1OC ZINC000501225179 942358722 /nfs/dbraw/zinc/35/87/22/942358722.db2.gz FKFFNCOOPPDULA-UHFFFAOYSA-N 0 0 363.391 3.925 20 5 FHBDRN O=C1CCCN1[C@@H]1CCCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000413572302 942366362 /nfs/dbraw/zinc/36/63/62/942366362.db2.gz RLIGKGXBDOHSSV-CYBMUJFWSA-N 0 0 371.359 3.595 20 5 FHBDRN CC1=C(c2ccco2)CN(C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)CC1 ZINC000412328157 942368996 /nfs/dbraw/zinc/36/89/96/942368996.db2.gz ODHHTMDCYSEMRP-DLBZAZTESA-N 0 0 352.390 3.997 20 5 FHBDRN C[C@@H](CC(=O)NCCNc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1F ZINC000502343145 942371398 /nfs/dbraw/zinc/37/13/98/942371398.db2.gz DHWFWICTRWRSSU-LBPRGKRZSA-N 0 0 363.364 3.595 20 5 FHBDRN Cc1nn(CC(=O)N[C@H](CC(C)(C)C)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000501273338 942377175 /nfs/dbraw/zinc/37/71/75/942377175.db2.gz IIVDRTBUCIFXMN-OAHLLOKOSA-N 0 0 362.405 3.533 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)Nc2ccccc2OC(C)C)c1F ZINC000413169586 942393286 /nfs/dbraw/zinc/39/32/86/942393286.db2.gz YDESMXWBQGOAGQ-UHFFFAOYSA-N 0 0 362.357 3.711 20 5 FHBDRN C[C@@H]1C[C@H](C)CCN(C(=O)c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000502370571 942402605 /nfs/dbraw/zinc/40/26/05/942402605.db2.gz VLCWALAQKFOLCO-GHMZBOCLSA-N 0 0 355.232 3.866 20 5 FHBDRN Cc1ccc(NC(=O)[C@@H](C)OC(=O)c2cccc([N+](=O)[O-])c2C)cc1F ZINC000015800733 942411891 /nfs/dbraw/zinc/41/18/91/942411891.db2.gz RRPDLTZSGKQNQF-GFCCVEGCSA-N 0 0 360.341 3.535 20 5 FHBDRN C[C@@]1(C(=O)Nc2ccc([N+](=O)[O-])c3ncccc23)OCCc2ccccc21 ZINC001268854540 942417610 /nfs/dbraw/zinc/41/76/10/942417610.db2.gz XHHJSVOESQXJAD-HXUWFJFHSA-N 0 0 363.373 3.570 20 5 FHBDRN COc1ccc(OC(=O)COc2cccc3ccccc32)c([N+](=O)[O-])c1 ZINC000014785457 942417867 /nfs/dbraw/zinc/41/78/67/942417867.db2.gz MCSKTSWHWWBEFG-UHFFFAOYSA-N 0 0 353.330 3.741 20 5 FHBDRN C[C@]1(F)CCN(C(=O)c2cc([N+](=O)[O-])ccc2NCc2ccccc2)C1 ZINC000501360865 942421122 /nfs/dbraw/zinc/42/11/22/942421122.db2.gz FMHWNMZGXTWAGN-IBGZPJMESA-N 0 0 357.385 3.781 20 5 FHBDRN COc1ccc([C@H]2C[C@H](NC(=O)c3ccc([N+](=O)[O-])c(C)c3)C2)cc1F ZINC000501346038 942422617 /nfs/dbraw/zinc/42/26/17/942422617.db2.gz BODATYQONACBBK-SHTZXODSSA-N 0 0 358.369 3.727 20 5 FHBDRN COc1ccc([C@H]2C[C@H](NC(=O)c3ccc(F)cc3[N+](=O)[O-])C2)cc1F ZINC000501348305 942423613 /nfs/dbraw/zinc/42/36/13/942423613.db2.gz PQAVCEOMDMBGPD-AULYBMBSSA-N 0 0 362.332 3.558 20 5 FHBDRN O=C(c1ccc2ccncc2n1)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000424879448 942426319 /nfs/dbraw/zinc/42/63/19/942426319.db2.gz VRFNRFBYEUHGLL-INIZCTEOSA-N 0 0 362.389 3.558 20 5 FHBDRN O=C(COc1cccc([N+](=O)[O-])c1)Nc1ccc(Nc2ccccc2)nc1 ZINC000502434130 942450185 /nfs/dbraw/zinc/45/01/85/942450185.db2.gz YXGWZNVAGLJFHI-UHFFFAOYSA-N 0 0 364.361 3.751 20 5 FHBDRN C[C@H](Nc1ncc([N+](=O)[O-])cc1C(F)(F)F)c1ccc([S@@](C)=O)cc1 ZINC000413199049 942454858 /nfs/dbraw/zinc/45/48/58/942454858.db2.gz IIBSIESGNDWIJQ-OLUQVHSISA-N 0 0 373.356 3.919 20 5 FHBDRN Cn1c(-c2cccc([N+](=O)[O-])c2)nnc1N1CCC[C@@H](CC(F)(F)F)C1 ZINC000421263397 942457335 /nfs/dbraw/zinc/45/73/35/942457335.db2.gz PAUUBCPDLMADPA-NSHDSACASA-N 0 0 369.347 3.559 20 5 FHBDRN O=[N+]([O-])c1ccc2ccnc(N[C@@H]3CCOC4(CCSCC4)C3)c2c1 ZINC000413194598 942459802 /nfs/dbraw/zinc/45/98/02/942459802.db2.gz BQRRATQSFHYQAN-CQSZACIVSA-N 0 0 359.451 4.000 20 5 FHBDRN O=C(Cc1ccccc1C(F)(F)F)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000104235578 942460965 /nfs/dbraw/zinc/46/09/65/942460965.db2.gz SORJWDVRYGBQFM-UHFFFAOYSA-N 0 0 350.296 3.745 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N2c3ccccc3CC[C@H]2C)c1C ZINC000014100738 942469698 /nfs/dbraw/zinc/46/96/98/942469698.db2.gz VVSXJPSVWWVMMP-CYBMUJFWSA-N 0 0 360.435 3.742 20 5 FHBDRN C[C@@H](c1ccc([N+](=O)[O-])cc1)N1C(=O)[C@@H]2C[C@@H](C3CCCCC3)CN2C1=O ZINC000419968466 942471625 /nfs/dbraw/zinc/47/16/25/942471625.db2.gz PZFMEINPFVIYSH-XCRHUMRWSA-N 0 0 371.437 3.889 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N1CCC(CC(F)(F)F)CC1 ZINC000501429254 942474008 /nfs/dbraw/zinc/47/40/08/942474008.db2.gz WVIQXKNPIXMZLC-UHFFFAOYSA-N 0 0 360.332 3.798 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CCC[C@H](c3nc4ccc(F)cc4o3)C2)c(F)c1 ZINC000413207599 942478884 /nfs/dbraw/zinc/47/88/84/942478884.db2.gz QYHPIBWZRVGIII-JTQLQIEISA-N 0 0 360.320 3.793 20 5 FHBDRN COc1ccc(NC(=O)c2ccc([C@H]3CCCOC3)cc2)c([N+](=O)[O-])c1 ZINC000502498038 942492095 /nfs/dbraw/zinc/49/20/95/942492095.db2.gz MOYYWIQUOKVTBW-HNNXBMFYSA-N 0 0 356.378 3.750 20 5 FHBDRN COc1ccc2c(c1OC)CCN(c1nccc3ccc([N+](=O)[O-])cc31)C2 ZINC000413218381 942494563 /nfs/dbraw/zinc/49/45/63/942494563.db2.gz HZNBKWHNDIJLNQ-UHFFFAOYSA-N 0 0 365.389 3.723 20 5 FHBDRN COc1cc(C(=O)NCc2cc(C3CC3)ccc2F)c([N+](=O)[O-])cc1F ZINC000452303353 942494884 /nfs/dbraw/zinc/49/48/84/942494884.db2.gz ISPVIHVIBGUNAU-UHFFFAOYSA-N 0 0 362.332 3.689 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1CN1CCC(Oc2cc(C)ccn2)CC1 ZINC000541214258 942494922 /nfs/dbraw/zinc/49/49/22/942494922.db2.gz MCDAGFGVLJLZKW-UHFFFAOYSA-N 0 0 371.437 3.740 20 5 FHBDRN CCN(C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)c1cccnc1 ZINC000104401991 942496014 /nfs/dbraw/zinc/49/60/14/942496014.db2.gz QQMUFTPBVKOSOI-UHFFFAOYSA-N 0 0 354.391 3.780 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1F)N1CCC[C@H]1/C=C/c1ccccc1 ZINC000505354063 942497105 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CCOc1ccc([C@H](C)NC(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1OC ZINC000501819038 942687449 /nfs/dbraw/zinc/68/74/49/942687449.db2.gz QIDATQMIFVQAIO-ZDUSSCGKSA-N 0 0 358.394 3.802 20 5 FHBDRN COc1cc(OC)cc(-c2noc([C@@H]3C[C@H]3c3ccc([N+](=O)[O-])cc3)n2)c1 ZINC000420491758 942696408 /nfs/dbraw/zinc/69/64/08/942696408.db2.gz HHAZLNIKHDJWME-DLBZAZTESA-N 0 0 367.361 3.933 20 5 FHBDRN COc1ccc(Cc2noc([C@@H]3C[C@H]3c3ccc([N+](=O)[O-])cc3)n2)c(F)c1 ZINC000420491065 942697291 /nfs/dbraw/zinc/69/72/91/942697291.db2.gz DPZZPYSQRJPDCY-JKSUJKDBSA-N 0 0 369.352 3.987 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1C[S@](C)=O ZINC000183619674 942697918 /nfs/dbraw/zinc/69/79/18/942697918.db2.gz SMHWOESYOTZYTO-WZQKQDCOSA-N 0 0 374.462 3.681 20 5 FHBDRN CC[C@H](OC1CCCC1)c1nc(Cc2cc(OC)ccc2[N+](=O)[O-])no1 ZINC000420492522 942698102 /nfs/dbraw/zinc/69/81/02/942698102.db2.gz KHWZHFDDNWFJGR-INIZCTEOSA-N 0 0 361.398 3.988 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N1CCC[C@@H](C[C@H]2CCOC2)C1 ZINC000378397434 942714879 /nfs/dbraw/zinc/71/48/79/942714879.db2.gz FRLHAQLHJIQDBG-QWHCGFSZSA-N 0 0 367.833 3.919 20 5 FHBDRN Cc1cccc(C)c1CCNC(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000511547452 942737430 /nfs/dbraw/zinc/73/74/30/942737430.db2.gz OPVGVRSNWOCYHG-UHFFFAOYSA-N 0 0 355.438 3.638 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCO[C@H](CC)C1 ZINC000421672482 942737470 /nfs/dbraw/zinc/73/74/70/942737470.db2.gz UOCZZEASJYSPPX-GXTWGEPZSA-N 0 0 352.456 3.784 20 5 FHBDRN O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCC(OCC2CCCC2)CC1 ZINC000434157782 942740811 /nfs/dbraw/zinc/74/08/11/942740811.db2.gz ADPYACUFGROBNV-UHFFFAOYSA-N 0 0 350.390 3.545 20 5 FHBDRN CN(C(=O)c1ccc([N+](=O)[O-])c2cccnc12)C1CC(OC(C)(C)C)C1 ZINC000421692225 942748266 /nfs/dbraw/zinc/74/82/66/942748266.db2.gz GHJUQMWARBCWOR-UHFFFAOYSA-N 0 0 357.410 3.561 20 5 FHBDRN CSc1ccc(C(=O)N(C)C2CC(OC(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000421694952 942749776 /nfs/dbraw/zinc/74/97/76/942749776.db2.gz UCPDZLUDKVYQQB-UHFFFAOYSA-N 0 0 352.456 3.735 20 5 FHBDRN CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F)C1CC(OC(C)(C)C)C1 ZINC000421695566 942751214 /nfs/dbraw/zinc/75/12/14/942751214.db2.gz WZFLIKYUANVHAK-UHFFFAOYSA-N 0 0 372.368 3.614 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N(C)C2CC(OC(C)(C)C)C2)c1 ZINC000421696212 942752344 /nfs/dbraw/zinc/75/23/44/942752344.db2.gz ZZYYCBHQJGSZKC-UHFFFAOYSA-N 0 0 352.456 3.735 20 5 FHBDRN Cc1cc(NC(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])cn2ccnc12 ZINC000502800043 942753147 /nfs/dbraw/zinc/75/31/47/942753147.db2.gz VOQQFSGKUQSROD-NSHDSACASA-N 0 0 374.784 3.610 20 5 FHBDRN O=C(Nc1cccc(COCCc2ccccc2)c1)c1ccc([N+](=O)[O-])[nH]1 ZINC000502806528 942759601 /nfs/dbraw/zinc/75/96/01/942759601.db2.gz QSJLWHOXWJIDPE-UHFFFAOYSA-N 0 0 365.389 3.935 20 5 FHBDRN COc1ccc(C(=O)Nc2ccc3c(c2)C(=O)CCCC3)cc1[N+](=O)[O-] ZINC000421716558 942768464 /nfs/dbraw/zinc/76/84/64/942768464.db2.gz RKVRLJMFENAGGD-UHFFFAOYSA-N 0 0 354.362 3.765 20 5 FHBDRN CCN(Cc1ccccc1)C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514160941 942782037 /nfs/dbraw/zinc/78/20/37/942782037.db2.gz UYWDLPKFPBYBGE-UHFFFAOYSA-N 0 0 350.321 3.859 20 5 FHBDRN CC[C@@H](NCc1nc(-c2ccccc2OC)no1)c1cccc([N+](=O)[O-])c1 ZINC000378462096 942795166 /nfs/dbraw/zinc/79/51/66/942795166.db2.gz LNFGYNCSWJLBCH-MRXNPFEDSA-N 0 0 368.393 3.894 20 5 FHBDRN CN(C(=O)c1ccc([N+](=O)[O-])cc1F)c1ccc(C(=O)NC(C)(C)C)cc1 ZINC000413926233 942799828 /nfs/dbraw/zinc/79/98/28/942799828.db2.gz PXCDERHCICJQNT-UHFFFAOYSA-N 0 0 373.384 3.539 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCO[C@@H](c2cccc(F)c2)C1 ZINC000421762977 942804358 /nfs/dbraw/zinc/80/43/58/942804358.db2.gz OZDATTRAPGFVSX-GOSISDBHSA-N 0 0 358.369 3.564 20 5 FHBDRN CC(C)(CNC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)c1cccs1 ZINC000514179733 942804987 /nfs/dbraw/zinc/80/49/87/942804987.db2.gz SSKXTVUAZPZNKU-UHFFFAOYSA-N 0 0 370.377 3.965 20 5 FHBDRN CC(C)(C)OC(=O)[C@H]1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000514201120 942810177 /nfs/dbraw/zinc/81/01/77/942810177.db2.gz BILHLXTYUPHWIJ-JTQLQIEISA-N 0 0 360.332 3.782 20 5 FHBDRN CSc1cc(NC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)ccc1Cl ZINC000413948286 942813256 /nfs/dbraw/zinc/81/32/56/942813256.db2.gz VVPFYWDFXGXLMC-UHFFFAOYSA-N 0 0 354.819 3.540 20 5 FHBDRN O=C(Nc1cncc(Br)c1)c1cccc(Cl)c1[N+](=O)[O-] ZINC000312191036 942815542 /nfs/dbraw/zinc/81/55/42/942815542.db2.gz FAKHUWBMOMXECI-UHFFFAOYSA-N 0 0 356.563 3.658 20 5 FHBDRN COc1ccc(OC(=O)c2cc(Cl)c(C)cc2[N+](=O)[O-])cc1[N+](=O)[O-] ZINC001269175384 942816587 /nfs/dbraw/zinc/81/65/87/942816587.db2.gz MHZGQLWQKZKCBV-UHFFFAOYSA-N 0 0 366.713 3.693 20 5 FHBDRN Cc1cccnc1C(C)(C)CNC(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1 ZINC000412374462 942820101 /nfs/dbraw/zinc/82/01/01/942820101.db2.gz UDGMBURCGAWYBY-UHFFFAOYSA-N 0 0 371.437 3.793 20 5 FHBDRN Cc1nc([C@H]2CCCN2c2c3ccccc3n(C)c(=O)c2[N+](=O)[O-])cs1 ZINC000893245257 942823383 /nfs/dbraw/zinc/82/33/83/942823383.db2.gz KMAJUEHUQOSDOC-OAHLLOKOSA-N 0 0 370.434 3.553 20 5 FHBDRN Cc1nn(Cc2cccc(C(=O)NCC(C)C)c2)c2ccc([N+](=O)[O-])cc12 ZINC000502895825 942823512 /nfs/dbraw/zinc/82/35/12/942823512.db2.gz JTVCOTNNMKQPJA-UHFFFAOYSA-N 0 0 366.421 3.687 20 5 FHBDRN COc1ccc(CN(C)C(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)cc1O ZINC000190114634 942824787 /nfs/dbraw/zinc/82/47/87/942824787.db2.gz CDUJUNYYNHFWMW-UHFFFAOYSA-N 0 0 358.394 3.705 20 5 FHBDRN CC[C@@H](O)CN(Cc1ccccc1)C(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC000421788853 942826982 /nfs/dbraw/zinc/82/69/82/942826982.db2.gz YQTARCYDFLUKJL-QGZVFWFLSA-N 0 0 356.422 3.625 20 5 FHBDRN O=C([C@H]1CCc2ccccc2O1)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000412374350 942827408 /nfs/dbraw/zinc/82/74/08/942827408.db2.gz DRYUSXGTYUEUJU-FXAWDEMLSA-N 0 0 366.417 3.695 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CC(Cc2ccc(F)c(F)c2)C1 ZINC000421791121 942827527 /nfs/dbraw/zinc/82/75/27/942827527.db2.gz ZFHDUQOZQKGHBN-UHFFFAOYSA-N 0 0 360.360 3.805 20 5 FHBDRN O=C([C@@H]1CCc2ccccc2O1)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000412374351 942828512 /nfs/dbraw/zinc/82/85/12/942828512.db2.gz DRYUSXGTYUEUJU-PXNSSMCTSA-N 0 0 366.417 3.695 20 5 FHBDRN C[C@@H]1Cc2ccccc2[C@H]1NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514221264 942832889 /nfs/dbraw/zinc/83/28/89/942832889.db2.gz BUWKKBKOLKBEEC-HWPZZCPQSA-N 0 0 362.332 3.860 20 5 FHBDRN Cc1nn(Cc2nnc(Cc3ccccc3C)o2)c2ccc([N+](=O)[O-])cc12 ZINC000502911776 942835403 /nfs/dbraw/zinc/83/54/03/942835403.db2.gz QCMGLGDXAUVFJT-UHFFFAOYSA-N 0 0 363.377 3.583 20 5 FHBDRN CCn1c(SCCc2ccncc2C)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000421829989 942836434 /nfs/dbraw/zinc/83/64/34/942836434.db2.gz AXUBITOJZLVOPQ-UHFFFAOYSA-N 0 0 369.450 3.911 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N2CC3(CCOCC3)[C@@H]2C(C)C)c1 ZINC000413969642 942841783 /nfs/dbraw/zinc/84/17/83/942841783.db2.gz FIWPIERHVNFYRF-INIZCTEOSA-N 0 0 364.467 3.594 20 5 FHBDRN Cc1ncsc1CCC(=O)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000412378242 942853007 /nfs/dbraw/zinc/85/30/07/942853007.db2.gz LOYPNKHZHARDPZ-OAHLLOKOSA-N 0 0 359.451 3.699 20 5 FHBDRN C[C@@H]1CCSCCN1C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000190198543 942853993 /nfs/dbraw/zinc/85/39/93/942853993.db2.gz UEAPNVPAKNNRFU-SECBINFHSA-N 0 0 363.361 3.973 20 5 FHBDRN O=C(c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1)N1CCC2(CCO2)CC1 ZINC000367114241 942861682 /nfs/dbraw/zinc/86/16/82/942861682.db2.gz QIIRROWTMPFFIG-UHFFFAOYSA-N 0 0 367.405 3.734 20 5 FHBDRN Cc1cc(F)cc2c1CN(Cc1nc(-c3cccc([N+](=O)[O-])c3)no1)CC2 ZINC000502937966 942868960 /nfs/dbraw/zinc/86/89/60/942868960.db2.gz ZHXMLRUAUYVVJX-UHFFFAOYSA-N 0 0 368.368 3.651 20 5 FHBDRN CC[C@@H](CNC(=O)Cc1ccc([N+](=O)[O-])cc1Cl)CC(F)(F)F ZINC000413995835 942874984 /nfs/dbraw/zinc/87/49/84/942874984.db2.gz APUKIDFYRUBUAJ-SECBINFHSA-N 0 0 352.740 3.886 20 5 FHBDRN C[C@H](NC(=O)c1ccc([C@H]2CCCOC2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000502966303 942880306 /nfs/dbraw/zinc/88/03/06/942880306.db2.gz TYONDTGIYHWMAJ-KSSFIOAISA-N 0 0 354.406 3.980 20 5 FHBDRN O=C(c1ccc(NC2CC2)c([N+](=O)[O-])c1)N1CCC[C@H](CC(F)(F)F)C1 ZINC000421934492 942886823 /nfs/dbraw/zinc/88/68/23/942886823.db2.gz CKOCEZPALOKHOO-LLVKDONJSA-N 0 0 371.359 3.974 20 5 FHBDRN O=C(c1cc2cccc([N+](=O)[O-])c2[nH]1)N1CCC[C@H](CC(F)(F)F)C1 ZINC000421945141 942899152 /nfs/dbraw/zinc/89/91/52/942899152.db2.gz QUCMEKMCGIHQTB-SNVBAGLBSA-N 0 0 355.316 3.881 20 5 FHBDRN O=C(CCC1CCC1)Nc1ccc([N+](=O)[O-])c(I)c1 ZINC001269193033 942910668 /nfs/dbraw/zinc/91/06/68/942910668.db2.gz QOGZFRODVMWRRS-UHFFFAOYSA-N 0 0 374.178 3.718 20 5 FHBDRN O=[N+]([O-])c1ccc2nc(NCc3ccc4c(c3)OCCCO4)ccc2c1 ZINC000066818865 942911066 /nfs/dbraw/zinc/91/10/66/942911066.db2.gz MXGJLMKUZGXJBP-UHFFFAOYSA-N 0 0 351.362 3.916 20 5 FHBDRN CC[C@@H]1CN(C(=O)c2ccnc(-c3ccccc3)c2[N+](=O)[O-])C[C@H](CC)O1 ZINC000421972624 942911817 /nfs/dbraw/zinc/91/18/17/942911817.db2.gz KOFHSEWCNOVDFE-IYBDPMFKSA-N 0 0 369.421 3.686 20 5 FHBDRN O=C(NCCCC1(O)CCC1)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000421976942 942913551 /nfs/dbraw/zinc/91/35/51/942913551.db2.gz GLDBQUBBZCIALT-UHFFFAOYSA-N 0 0 369.421 3.763 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H](CC)O[C@H](CC)C1 ZINC000421987791 942921192 /nfs/dbraw/zinc/92/11/92/942921192.db2.gz ULBJVLACBFAPNE-ZIAGYGMSSA-N 0 0 352.456 3.736 20 5 FHBDRN CC[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C[C@H](CC)O1 ZINC000421989987 942922402 /nfs/dbraw/zinc/92/24/02/942922402.db2.gz WLKUSKRXPHIHIE-OKILXGFUSA-N 0 0 360.332 3.643 20 5 FHBDRN O=C(N[C@H](C[C@H]1CCOC1)c1ccccc1)c1cc(F)cc([N+](=O)[O-])c1 ZINC000510009222 942923147 /nfs/dbraw/zinc/92/31/47/942923147.db2.gz FYDLVRNKZWFCDJ-FZKQIMNGSA-N 0 0 358.369 3.632 20 5 FHBDRN COc1ccc(OC)c(CCCNC(=O)Nc2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000536254860 942923801 /nfs/dbraw/zinc/92/38/01/942923801.db2.gz RTAAPMFUUIIZGR-UHFFFAOYSA-N 0 0 373.409 3.675 20 5 FHBDRN CC[C@H](CNc1ccccc1)NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412380940 942925214 /nfs/dbraw/zinc/92/52/14/942925214.db2.gz YVHRILZLZITKAZ-AYOQOUSVSA-N 0 0 353.422 3.705 20 5 FHBDRN CN([C@H]1CCC[C@@H]1c1ccccc1)S(=O)(=O)Cc1ccccc1[N+](=O)[O-] ZINC000416540147 942931783 /nfs/dbraw/zinc/93/17/83/942931783.db2.gz GRYACHFLCYWGPE-MJGOQNOKSA-N 0 0 374.462 3.693 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@H](COCC)C1 ZINC000503067731 942948496 /nfs/dbraw/zinc/94/84/96/942948496.db2.gz TZVYMBJEAFOAPI-AWEZNQCLSA-N 0 0 366.483 3.986 20 5 FHBDRN CSc1cccc(C(=O)NC[C@@H]2CCO[C@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000190218796 942948651 /nfs/dbraw/zinc/94/86/51/942948651.db2.gz FYRLATVDWLAPAA-KSSFIOAISA-N 0 0 372.446 3.824 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N(C)Cc1cc(Cl)ccc1F ZINC000434762407 942949412 /nfs/dbraw/zinc/94/94/12/942949412.db2.gz BKDBWZULGPZWQZ-UHFFFAOYSA-N 0 0 372.805 3.516 20 5 FHBDRN Cc1ccc(Sc2ccc(C(=O)N3C[C@@H](O)C[C@@H]3C)cc2[N+](=O)[O-])cc1 ZINC000473003165 942961896 /nfs/dbraw/zinc/96/18/96/942961896.db2.gz UTIWEAKIXCYKCA-ZFWWWQNUSA-N 0 0 372.446 3.650 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N2CC[C@@H](c3ccccc3)C2(C)C)c1[N+](=O)[O-] ZINC000422061543 942970924 /nfs/dbraw/zinc/97/09/24/942970924.db2.gz FNBREOZBWXIYJD-AWEZNQCLSA-N 0 0 356.426 3.850 20 5 FHBDRN CCCCCn1cc(CNC(=O)c2ccc(NCC)c([N+](=O)[O-])c2)c(C)n1 ZINC000503106558 942977861 /nfs/dbraw/zinc/97/78/61/942977861.db2.gz CQPNXGGIGLQAJW-UHFFFAOYSA-N 0 0 373.457 3.652 20 5 FHBDRN CN(CCOc1ccc(Cl)cc1)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000434835492 942993774 /nfs/dbraw/zinc/99/37/74/942993774.db2.gz CSLSRYFRMCFABF-UHFFFAOYSA-N 0 0 361.785 3.900 20 5 FHBDRN C[C@@H](C(=O)N1CCOc2ccc(Cl)cc21)c1ccc([N+](=O)[O-])cc1F ZINC000184304421 942995689 /nfs/dbraw/zinc/99/56/89/942995689.db2.gz LHWQRGNRYXGJHF-SNVBAGLBSA-N 0 0 364.760 3.916 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CC[C@@H](Oc2cccc(F)c2)C1 ZINC000183678828 943000198 /nfs/dbraw/zinc/00/01/98/943000198.db2.gz OBVNCIPYLXCWST-CQSZACIVSA-N 0 0 364.760 3.681 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N(C)CCCOC(C)C ZINC000503127385 943000507 /nfs/dbraw/zinc/00/05/07/943000507.db2.gz VFRFJOXYAFOGHN-UHFFFAOYSA-N 0 0 354.472 3.984 20 5 FHBDRN CCN(CCNC(=O)c1cc2cc([N+](=O)[O-])ccc2o1)c1cccc(C)c1 ZINC000514431603 943001182 /nfs/dbraw/zinc/00/11/82/943001182.db2.gz MGHNUVQLVBYBNO-UHFFFAOYSA-N 0 0 367.405 3.906 20 5 FHBDRN Cc1c(CNC(=O)N[C@@H](C)CCOCc2ccccc2)cccc1[N+](=O)[O-] ZINC000503137226 943005166 /nfs/dbraw/zinc/00/51/66/943005166.db2.gz NULBXSHTWAGNFL-HNNXBMFYSA-N 0 0 371.437 3.698 20 5 FHBDRN O=C(COc1ccccc1)COc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000505552807 943009697 /nfs/dbraw/zinc/00/96/97/943009697.db2.gz FCTFLEIHCCLLBE-UHFFFAOYSA-N 0 0 355.268 3.641 20 5 FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)NCCc1cccc(C)c1 ZINC000128469400 943025463 /nfs/dbraw/zinc/02/54/63/943025463.db2.gz BGNYFSAHQJFZOP-UHFFFAOYSA-N 0 0 374.462 3.614 20 5 FHBDRN COc1ccc(C(=O)C2CCN(c3ccc(F)cc3[N+](=O)[O-])CC2)cc1 ZINC000014328315 943027412 /nfs/dbraw/zinc/02/74/12/943027412.db2.gz YLRZEXORPQVADJ-UHFFFAOYSA-N 0 0 358.369 3.842 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)N2CCC(OC3CCC3)CC2)cc1[N+](=O)[O-] ZINC000416701545 943044073 /nfs/dbraw/zinc/04/40/73/943044073.db2.gz YQEOYEHHBYUHEH-AWEZNQCLSA-N 0 0 361.442 3.707 20 5 FHBDRN O=C(c1cc(=O)c2ccc(Cl)cc2o1)N1CCc2c1cccc2[N+](=O)[O-] ZINC001126430000 943053066 /nfs/dbraw/zinc/05/30/66/943053066.db2.gz FGXIPNQUGXOGLV-UHFFFAOYSA-N 0 0 370.748 3.558 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@H]1c2ccccc2CC[C@H]1C(C)C ZINC000183876863 943058512 /nfs/dbraw/zinc/05/85/12/943058512.db2.gz MPROFZGPNDYPMQ-OXJNMPFZSA-N 0 0 370.453 3.566 20 5 FHBDRN Cc1cc(NC(=O)Cc2ccccc2[N+](=O)[O-])cnc1N1CCCC[C@@H]1C ZINC000503221968 943065058 /nfs/dbraw/zinc/06/50/58/943065058.db2.gz BDDCKACRYFFJOR-HNNXBMFYSA-N 0 0 368.437 3.858 20 5 FHBDRN C[C@@H]1CCN(C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)[C@H]2CCCC[C@@H]12 ZINC000514501608 943066521 /nfs/dbraw/zinc/06/65/21/943066521.db2.gz DSMUPXBXKQOKDE-PVAVHDDUSA-N 0 0 368.437 3.821 20 5 FHBDRN O=C1C[C@@H](Nc2ncc(Cl)cc2[N+](=O)[O-])CN1c1ccccc1Cl ZINC000434951950 943069809 /nfs/dbraw/zinc/06/98/09/943069809.db2.gz QPVNTOFSSSUMGP-SNVBAGLBSA-N 0 0 367.192 3.514 20 5 FHBDRN O=C1C[C@H](Nc2ncc(Cl)cc2[N+](=O)[O-])CN1c1ccccc1Cl ZINC000434951949 943069864 /nfs/dbraw/zinc/06/98/64/943069864.db2.gz QPVNTOFSSSUMGP-JTQLQIEISA-N 0 0 367.192 3.514 20 5 FHBDRN COC(=O)c1cc(Br)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000505584445 943073722 /nfs/dbraw/zinc/07/37/22/943073722.db2.gz HDAUAUXZDZVCEJ-UHFFFAOYSA-N 0 0 366.167 3.723 20 5 FHBDRN C[C@H]1C[C@H](C)CN(c2ccc(C(=O)NCCc3ccco3)cc2[N+](=O)[O-])C1 ZINC000514516661 943077361 /nfs/dbraw/zinc/07/73/61/943077361.db2.gz UQLKKLZLKOVCNV-GJZGRUSLSA-N 0 0 371.437 3.643 20 5 FHBDRN Cc1ccc(NC(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cn1 ZINC000431899964 943077728 /nfs/dbraw/zinc/07/77/28/943077728.db2.gz CPRWQDCWLJPBJZ-UHFFFAOYSA-N 0 0 368.315 3.758 20 5 FHBDRN Cc1ccc(NC(=O)NC(C)(C)c2nc3ccccc3n2C)cc1[N+](=O)[O-] ZINC000183892743 943078390 /nfs/dbraw/zinc/07/83/90/943078390.db2.gz AGDTXKLLZMHPBV-UHFFFAOYSA-N 0 0 367.409 3.847 20 5 FHBDRN COC(=O)c1cccc(Cl)c1COc1ccc(C(C)=O)cc1[N+](=O)[O-] ZINC000505582410 943079678 /nfs/dbraw/zinc/07/96/78/943079678.db2.gz RKKLYXXTUJQGAJ-UHFFFAOYSA-N 0 0 363.753 3.816 20 5 FHBDRN Cc1nn(CCC(=O)N[C@H]2c3ccccc3CCC[C@H]2C)c(C)c1[N+](=O)[O-] ZINC000183908625 943085878 /nfs/dbraw/zinc/08/58/78/943085878.db2.gz VKUGQNLRROMJLT-BFUOFWGJSA-N 0 0 370.453 3.628 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1CNCc1cccc(OC(C)(C)C)n1 ZINC000503260929 943090917 /nfs/dbraw/zinc/09/09/17/943090917.db2.gz RNNCZBCZOBREEJ-UHFFFAOYSA-N 0 0 359.426 3.856 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N2CC3(CCCC3)[C@@H]2C(C)C)c1F ZINC000412417745 943099219 /nfs/dbraw/zinc/09/92/19/943099219.db2.gz ZNLZYCSJHBOQQY-SFHVURJKSA-N 0 0 364.417 3.712 20 5 FHBDRN O=[N+]([O-])c1ccccc1-c1ccc(CN2C[C@@H](O)Cc3ccccc32)o1 ZINC000435046647 943118642 /nfs/dbraw/zinc/11/86/42/943118642.db2.gz VJEISRROPBKLTA-HNNXBMFYSA-N 0 0 350.374 3.778 20 5 FHBDRN CCOC(=O)/C=C\c1ccc(NC(=O)c2cccc([N+](=O)[O-])c2C)cc1 ZINC000205771860 943130147 /nfs/dbraw/zinc/13/01/47/943130147.db2.gz MOPASUXVHJHNJK-XFXZXTDPSA-N 0 0 354.362 3.732 20 5 FHBDRN CC(=O)N1C=Cc2ccccc2[C@@H]1CC(=O)Oc1c(C)cccc1[N+](=O)[O-] ZINC000760016951 943132252 /nfs/dbraw/zinc/13/22/52/943132252.db2.gz KRPMRNDCWHXXAG-SFHVURJKSA-N 0 0 366.373 3.773 20 5 FHBDRN CC(C)[C@@H](C)N(C(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)C1CC1 ZINC000514593916 943135467 /nfs/dbraw/zinc/13/54/67/943135467.db2.gz YUPWHLQKORRSHD-CYBMUJFWSA-N 0 0 358.442 3.837 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OC[C@H](O)CO[C@@H]2CCCc3ccccc32)c1 ZINC000514616789 943152464 /nfs/dbraw/zinc/15/24/64/943152464.db2.gz GQPIOFIENCSALJ-VQIMIIECSA-N 0 0 357.406 3.737 20 5 FHBDRN COc1ccc(N(C(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])[C@H](C)C2CC2)cc1 ZINC000434176931 943175833 /nfs/dbraw/zinc/17/58/33/943175833.db2.gz JAWTTWONVZYPAJ-GFCCVEGCSA-N 0 0 372.425 3.895 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CC3(CCC3)[C@H]2C2CCOCC2)c2ccncc21 ZINC000425284148 943187289 /nfs/dbraw/zinc/18/72/89/943187289.db2.gz PYLQQCNBCIKLOL-LJQANCHMSA-N 0 0 353.422 3.929 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CCSC[C@@H]2c2ccccc2)c1 ZINC000514660995 943188793 /nfs/dbraw/zinc/18/87/93/943188793.db2.gz KBYHWRXCCDAKLL-GOSISDBHSA-N 0 0 372.446 3.924 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1Br)Nc1ccccc1F ZINC000133690533 943196559 /nfs/dbraw/zinc/19/65/59/943196559.db2.gz OLDIUYZOEJWJBU-UHFFFAOYSA-N 0 0 369.146 3.514 20 5 FHBDRN COCCSc1ccc([C@H](C)Nc2c([N+](=O)[O-])c(C)nn2C)cc1 ZINC000505613940 943205734 /nfs/dbraw/zinc/20/57/34/943205734.db2.gz WPHVHTFCCGKPFN-NSHDSACASA-N 0 0 350.444 3.548 20 5 FHBDRN CC1(C)Cc2cccc(Cn3cnc(-c4cccc([N+](=O)[O-])c4)n3)c2O1 ZINC000430125637 943220775 /nfs/dbraw/zinc/22/07/75/943220775.db2.gz CGOSUKYLLWMPQI-UHFFFAOYSA-N 0 0 350.378 3.615 20 5 FHBDRN CC[C@@H](COc1c2cc(Br)ccc2ncc1[N+](=O)[O-])OC ZINC000416913247 943221084 /nfs/dbraw/zinc/22/10/84/943221084.db2.gz VPDOAKLYNAQSFL-JTQLQIEISA-N 0 0 355.188 3.709 20 5 FHBDRN Cc1ccccc1[C@H](C)N(C)C(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000503502566 943223008 /nfs/dbraw/zinc/22/30/08/943223008.db2.gz PETBOOGRUFIMTD-HNNXBMFYSA-N 0 0 364.405 3.922 20 5 FHBDRN Cc1ccc2c(c1)N(C(=O)Cc1c(F)cc([N+](=O)[O-])cc1F)C[C@@H](C)O2 ZINC000514688790 943223960 /nfs/dbraw/zinc/22/39/60/943223960.db2.gz SKGGHOFRUJQDET-LLVKDONJSA-N 0 0 362.332 3.538 20 5 FHBDRN Cc1nc(NC(=O)c2ccc(Cl)cc2Br)ccc1[N+](=O)[O-] ZINC000133700595 943230334 /nfs/dbraw/zinc/23/03/34/943230334.db2.gz SDDLLHYHNPXITJ-UHFFFAOYSA-N 0 0 370.590 3.966 20 5 FHBDRN CCc1ccnc(CNC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 ZINC000437753288 943254691 /nfs/dbraw/zinc/25/46/91/943254691.db2.gz YISDHORXXLHUMZ-UHFFFAOYSA-N 0 0 353.300 3.501 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])Nc1c[nH]nc1-c1ccccc1F ZINC000513793446 943263718 /nfs/dbraw/zinc/26/37/18/943263718.db2.gz YERAGIHFJHOFQK-UHFFFAOYSA-N 0 0 370.340 3.532 20 5 FHBDRN C[C@H]1[C@@H](c2nc(Cc3ccc([N+](=O)[O-])cc3Br)no2)C1(F)F ZINC000514785980 943290106 /nfs/dbraw/zinc/29/01/06/943290106.db2.gz OMRAYDINKMABNQ-KGFZYKRKSA-N 0 0 374.141 3.700 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)N(Cc1ccco1)C1CCCC1 ZINC000105177088 943311215 /nfs/dbraw/zinc/31/12/15/943311215.db2.gz DNHIDZRCKMJTBS-UHFFFAOYSA-N 0 0 357.410 3.885 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N1C[C@H](O)C[C@H]1c1ccccc1 ZINC000417045428 943315367 /nfs/dbraw/zinc/31/53/67/943315367.db2.gz RFVOPFRAVRIKMO-QAPCUYQASA-N 0 0 355.394 3.551 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCc1nc2ccccc2o1 ZINC000425326123 943316223 /nfs/dbraw/zinc/31/62/23/943316223.db2.gz YAYIVDSEWNKREQ-CQSZACIVSA-N 0 0 353.378 3.621 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N1CC[C@H](COc2ccccc2)C1 ZINC000505655544 943318643 /nfs/dbraw/zinc/31/86/43/943318643.db2.gz DDRDIJUEOQJHIQ-AWEZNQCLSA-N 0 0 374.824 3.718 20 5 FHBDRN Cc1ccsc1-c1nnc(N(Cc2cccc([N+](=O)[O-])c2)C2CC2)n1C ZINC000514818712 943319549 /nfs/dbraw/zinc/31/95/49/943319549.db2.gz UOXUPMMDTBQYKP-UHFFFAOYSA-N 0 0 369.450 3.929 20 5 FHBDRN C[C@](O)(C1CCN(Cc2ccc([N+](=O)[O-])cc2Cl)CC1)C(F)(F)F ZINC000545932317 943321597 /nfs/dbraw/zinc/32/15/97/943321597.db2.gz WPIXVMQATCGYHJ-AWEZNQCLSA-N 0 0 366.767 3.774 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCc1nc2cc(F)ccc2o1 ZINC000425335495 943322410 /nfs/dbraw/zinc/32/24/10/943322410.db2.gz ZZZNBLNLDBCKPG-ZDUSSCGKSA-N 0 0 371.368 3.760 20 5 FHBDRN O=[N+]([O-])c1ccc(Cc2noc(C3CC(c4cccc(F)c4)C3)n2)nc1 ZINC000364009687 943324425 /nfs/dbraw/zinc/32/44/25/943324425.db2.gz PXKPDWSFRKDMMO-UHFFFAOYSA-N 0 0 354.341 3.764 20 5 FHBDRN Cc1c(NC(=O)NCc2ccccc2)cc(Br)cc1[N+](=O)[O-] ZINC000435327778 943326226 /nfs/dbraw/zinc/32/62/26/943326226.db2.gz IUIWIDUAHLJIFQ-UHFFFAOYSA-N 0 0 364.199 3.987 20 5 FHBDRN COc1cccc(SC)c1N[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000417077530 943329406 /nfs/dbraw/zinc/32/94/06/943329406.db2.gz PLSQSGUZYDPEKP-CQSZACIVSA-N 0 0 373.434 3.543 20 5 FHBDRN CCOCCN(CC)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000435328292 943332794 /nfs/dbraw/zinc/33/27/94/943332794.db2.gz KOECCRSIOJMPAC-UHFFFAOYSA-N 0 0 374.235 3.556 20 5 FHBDRN Cc1c(NC(=O)N2CCC(F)(F)C2)cc(Br)cc1[N+](=O)[O-] ZINC000435329935 943334496 /nfs/dbraw/zinc/33/44/96/943334496.db2.gz RNJYBFLAHOHPMN-UHFFFAOYSA-N 0 0 364.146 3.539 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)Nc1nnc(-c2ccco2)s1 ZINC000053209825 943344827 /nfs/dbraw/zinc/34/48/27/943344827.db2.gz INJHZDHEKPLIIY-UHFFFAOYSA-N 0 0 373.394 3.537 20 5 FHBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)N(CC2CCC2)c2ccccc2)cc1 ZINC000503765217 943363019 /nfs/dbraw/zinc/36/30/19/943363019.db2.gz MVROOWKHKATIQD-UHFFFAOYSA-N 0 0 374.462 3.774 20 5 FHBDRN CC[C@@H](C)c1ccccc1OCC(=O)NCCNc1ccc([N+](=O)[O-])cc1 ZINC000014529158 943367081 /nfs/dbraw/zinc/36/70/81/943367081.db2.gz DOEPCQIHWVRDID-OAHLLOKOSA-N 0 0 371.437 3.715 20 5 FHBDRN CCCOc1ccc2c(c1)CCN(C(=O)c1ccc([N+](=O)[O-])c(C)c1)C2 ZINC000435385776 943373058 /nfs/dbraw/zinc/37/30/58/943373058.db2.gz UELDXIRFGDZBAP-UHFFFAOYSA-N 0 0 354.406 3.891 20 5 FHBDRN C[C@H](Cc1ccc(C(F)(F)F)cc1)NC(=O)c1cccc([N+](=O)[O-])c1N ZINC000468699996 943375313 /nfs/dbraw/zinc/37/53/13/943375313.db2.gz MQNRKYJTOLIWAB-SNVBAGLBSA-N 0 0 367.327 3.557 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]c(N3CCC[C@H]3c3cccc4c3OCCO4)nc2c1 ZINC000514904937 943375991 /nfs/dbraw/zinc/37/59/91/943375991.db2.gz UGDILSAMSRDSNC-INIZCTEOSA-N 0 0 366.377 3.584 20 5 FHBDRN CCCOc1ccc2c(c1)CCN(C(=O)c1cc([N+](=O)[O-])ccc1OC)C2 ZINC000435388991 943376505 /nfs/dbraw/zinc/37/65/05/943376505.db2.gz JWPYKRKXXYBADE-UHFFFAOYSA-N 0 0 370.405 3.591 20 5 FHBDRN O=[N+]([O-])c1cccc(CS(=O)(=O)N2CCC[C@@H]2/C=C/c2ccccc2)c1 ZINC000503828753 943377627 /nfs/dbraw/zinc/37/76/27/943377627.db2.gz OBKWVZWWANHGQQ-IENJSVCTSA-N 0 0 372.446 3.602 20 5 FHBDRN O=C(CSCc1cccc(Cl)c1)NCCc1ccc([N+](=O)[O-])cc1 ZINC000053217276 943382470 /nfs/dbraw/zinc/38/24/70/943382470.db2.gz FNVKJKZWAHUXAX-UHFFFAOYSA-N 0 0 364.854 3.840 20 5 FHBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCC[C@@H]2/C=C/c2ccccc2)s1 ZINC000503822266 943384426 /nfs/dbraw/zinc/38/44/26/943384426.db2.gz TZIWDAFEJVGNFF-MYSGNRETSA-N 0 0 364.448 3.523 20 5 FHBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCC[C@H]2/C=C/c2ccccc2)s1 ZINC000503822268 943384621 /nfs/dbraw/zinc/38/46/21/943384621.db2.gz TZIWDAFEJVGNFF-VFNNOXKTSA-N 0 0 364.448 3.523 20 5 FHBDRN Cc1ccc(C)c(C(=O)CCC(=O)NCCc2ccc([N+](=O)[O-])cc2)c1 ZINC000053217535 943385822 /nfs/dbraw/zinc/38/58/22/943385822.db2.gz CJJZBNLXNDHWIB-UHFFFAOYSA-N 0 0 354.406 3.533 20 5 FHBDRN O=C(CSc1ccc2c(c1)CCC2)NCCc1ccc([N+](=O)[O-])cc1 ZINC000053216147 943386460 /nfs/dbraw/zinc/38/64/60/943386460.db2.gz TWDPDPWTUSPAPV-UHFFFAOYSA-N 0 0 356.447 3.535 20 5 FHBDRN O=C(N[C@@H](Cc1ccc(Cl)cc1)c1ccccn1)c1cc([N+](=O)[O-])c[nH]1 ZINC000503875705 943393922 /nfs/dbraw/zinc/39/39/22/943393922.db2.gz PPMYUMAFNHGKFF-INIZCTEOSA-N 0 0 370.796 3.685 20 5 FHBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+](C)[C@H](Cc1ccccc1)C(=O)[O-] ZINC000514945303 943397113 /nfs/dbraw/zinc/39/71/13/943397113.db2.gz URJSRGCXDWXLGF-GOSISDBHSA-N 0 0 372.421 3.510 20 5 FHBDRN Cc1cc(C(=O)N2CC[C@]3(C2)CCc2ccccc2O3)ccc1[N+](=O)[O-] ZINC000514977167 943429115 /nfs/dbraw/zinc/42/91/15/943429115.db2.gz KAQHPTRPVQXXEA-FQEVSTJZSA-N 0 0 352.390 3.513 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)N[C@H]2C[C@H]2c2ccccc2)cc1SC ZINC000503945854 943429667 /nfs/dbraw/zinc/42/96/67/943429667.db2.gz HUCGKSHNMWTWLO-JSGCOSHPSA-N 0 0 358.419 3.611 20 5 FHBDRN CNc1ccc(C(=O)Nc2cc(-c3ncc[nH]3)ccc2C)cc1[N+](=O)[O-] ZINC000514982386 943431874 /nfs/dbraw/zinc/43/18/74/943431874.db2.gz XRWPETKEQMAVSB-UHFFFAOYSA-N 0 0 351.366 3.587 20 5 FHBDRN O=C1SCC[C@@H]1Nc1ccc2ccc3ccc(Br)nc3c2n1 ZINC001167951938 943445790 /nfs/dbraw/zinc/44/57/90/943445790.db2.gz HXUYNQREUMBPMH-NSHDSACASA-N 0 0 374.263 3.990 20 5 FHBDRN C[C@@H]1c2cccn2CCN1Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425384906 943447481 /nfs/dbraw/zinc/44/74/81/943447481.db2.gz OEKKZFNYHBXXOY-LLVKDONJSA-N 0 0 350.216 3.736 20 5 FHBDRN Cc1ccc(NC(=O)N(C)[C@@H](C)[C@H]2Cc3ccccc3O2)cc1[N+](=O)[O-] ZINC000434213272 943451310 /nfs/dbraw/zinc/45/13/10/943451310.db2.gz FYKKXAMTTKWNCB-SCLBCKFNSA-N 0 0 355.394 3.759 20 5 FHBDRN CCOc1cc2c(cc1NC(=O)c1cccc(OC)c1[N+](=O)[O-])O[C@H](C)C2 ZINC000435519526 943463625 /nfs/dbraw/zinc/46/36/25/943463625.db2.gz MAUZVQSPSTVIJR-LLVKDONJSA-N 0 0 372.377 3.578 20 5 FHBDRN O=C(Nc1ccc(-c2nccs2)cc1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000014576214 943466863 /nfs/dbraw/zinc/46/68/63/943466863.db2.gz CWKREUKTNMKZDM-UHFFFAOYSA-N 0 0 370.346 3.879 20 5 FHBDRN CC[C@H]1CN(C(=O)c2ccc(SCCC(C)C)c([N+](=O)[O-])c2)CCO1 ZINC000515041383 943469063 /nfs/dbraw/zinc/46/90/63/943469063.db2.gz UBXIBUFCIHIBOW-HNNXBMFYSA-N 0 0 366.483 3.984 20 5 FHBDRN CCSCCCNC(=O)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000505702784 943472773 /nfs/dbraw/zinc/47/27/73/943472773.db2.gz FTSAWNCPZMPIQF-UHFFFAOYSA-N 0 0 358.438 3.693 20 5 FHBDRN CS(=O)(=O)c1ccc(N[C@@H]2C[C@H]2c2ccc(Cl)cc2)c([N+](=O)[O-])c1 ZINC000435573369 943494241 /nfs/dbraw/zinc/49/42/41/943494241.db2.gz HIAYWVMFNBFXHV-DZGCQCFKSA-N 0 0 366.826 3.620 20 5 FHBDRN NC(=O)c1ccc(N[C@@H]2C[C@H]2c2ccc(Cl)c(Cl)c2)c([N+](=O)[O-])c1 ZINC000435575792 943495307 /nfs/dbraw/zinc/49/53/07/943495307.db2.gz TVHRHOBSLLPIBG-IINYFYTJSA-N 0 0 366.204 3.969 20 5 FHBDRN C[C@@H](C1CC1)n1cc(N[C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)cn1 ZINC000584736041 943510572 /nfs/dbraw/zinc/51/05/72/943510572.db2.gz JJOYCADLHPAEJU-SCLBCKFNSA-N 0 0 366.425 3.697 20 5 FHBDRN O=C(COc1ccccc1[N+](=O)[O-])Nc1ccc(Oc2ccccn2)cc1 ZINC000504142759 943513025 /nfs/dbraw/zinc/51/30/25/943513025.db2.gz KROYWVFLFHUUMX-UHFFFAOYSA-N 0 0 365.345 3.800 20 5 FHBDRN CNc1ccc(C(=O)N[C@H](C)c2cccc(OC(C)C)c2)cc1[N+](=O)[O-] ZINC000515131464 943526215 /nfs/dbraw/zinc/52/62/15/943526215.db2.gz XYBLJZGRGKZLAW-CYBMUJFWSA-N 0 0 357.410 3.915 20 5 FHBDRN COc1cc(NC(=O)c2cccc(OC)c2[N+](=O)[O-])c(OC)cc1Cl ZINC000435656337 943529916 /nfs/dbraw/zinc/52/99/16/943529916.db2.gz RJKDURZKNZAQFO-UHFFFAOYSA-N 0 0 366.757 3.526 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)NCC1(Cc2ccccc2)CC1 ZINC000435663678 943533532 /nfs/dbraw/zinc/53/35/32/943533532.db2.gz OIQGMUOOQZSHGR-UHFFFAOYSA-N 0 0 355.394 3.748 20 5 FHBDRN CCNc1ccc(C(=O)N2CC[C@@H](COc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000504170377 943534236 /nfs/dbraw/zinc/53/42/36/943534236.db2.gz WDDVLEQHBWMHKD-OAHLLOKOSA-N 0 0 369.421 3.568 20 5 FHBDRN CCOc1ccc(C(=O)N2C[C@H]3CCCN3c3ccccc32)cc1[N+](=O)[O-] ZINC000515171412 943535584 /nfs/dbraw/zinc/53/55/84/943535584.db2.gz DKORFEABXDZXII-OAHLLOKOSA-N 0 0 367.405 3.623 20 5 FHBDRN CCOc1ccc(OCC)c(NC(=O)c2cccc(OC)c2[N+](=O)[O-])c1 ZINC000435650602 943537718 /nfs/dbraw/zinc/53/77/18/943537718.db2.gz JLMLDCLYPCGOSA-UHFFFAOYSA-N 0 0 360.366 3.653 20 5 FHBDRN CS[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2SCC(C)C)C1 ZINC000452552212 943573331 /nfs/dbraw/zinc/57/33/31/943573331.db2.gz AIJSPILCTXFZHW-ZDUSSCGKSA-N 0 0 354.497 3.920 20 5 FHBDRN Cc1cc(C)c(OCC(=O)N2c3ccc([N+](=O)[O-])cc3C[C@@H]2C)c(C)c1 ZINC000504341566 943593531 /nfs/dbraw/zinc/59/35/31/943593531.db2.gz TWZDPVUDWMOCHX-HNNXBMFYSA-N 0 0 354.406 3.877 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1)CN(c1nnc(-c3ccccc3)n1C1CC1)CC2 ZINC000584786451 943612926 /nfs/dbraw/zinc/61/29/26/943612926.db2.gz ICSBSXZWJRFATK-UHFFFAOYSA-N 0 0 361.405 3.751 20 5 FHBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1nc(C(C)(C)C)co1 ZINC000584787324 943613662 /nfs/dbraw/zinc/61/36/62/943613662.db2.gz BYMXFCSQRHVDLR-SECBINFHSA-N 0 0 367.789 3.940 20 5 FHBDRN Cc1cccc([C@@H]2NC(=O)N([C@@H](C)c3ccc(C)c([N+](=O)[O-])c3)C2=O)c1C ZINC000431948115 943625924 /nfs/dbraw/zinc/62/59/24/943625924.db2.gz CYQVXARNJRFIJI-KSSFIOAISA-N 0 0 367.405 3.874 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1Cc1ccccc1)[C@H]1CCCOC1 ZINC000183974083 943643031 /nfs/dbraw/zinc/64/30/31/943643031.db2.gz SWSBYTGRWADFJR-INIZCTEOSA-N 0 0 355.390 3.560 20 5 FHBDRN O=c1[nH]c(-c2ccc([N+](=O)[O-])s2)nc2cc(Br)c(F)cc12 ZINC000504508405 943648262 /nfs/dbraw/zinc/64/82/62/943648262.db2.gz UPIYKUIODMCSTE-UHFFFAOYSA-N 0 0 370.159 3.874 20 5 FHBDRN Cc1nc2c3ccccc3nc(SCc3c(F)cccc3[N+](=O)[O-])n2n1 ZINC000504508972 943648613 /nfs/dbraw/zinc/64/86/13/943648613.db2.gz ZYFFAJARTQOQCW-UHFFFAOYSA-N 0 0 369.381 3.926 20 5 FHBDRN COc1ccc(-c2nc(SCc3c(F)cccc3[N+](=O)[O-])n[nH]2)cc1 ZINC000504535780 943651418 /nfs/dbraw/zinc/65/14/18/943651418.db2.gz GNXIVSIVUBTANR-UHFFFAOYSA-N 0 0 360.370 3.820 20 5 FHBDRN Cc1cccc(C)c1-n1nnnc1SCc1c(F)cccc1[N+](=O)[O-] ZINC000504523365 943654556 /nfs/dbraw/zinc/65/45/56/943654556.db2.gz AXLLNNBBSPPIEK-UHFFFAOYSA-N 0 0 359.386 3.619 20 5 FHBDRN CCCC1CCC(N(C)C(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)CC1 ZINC000584815208 943663911 /nfs/dbraw/zinc/66/39/11/943663911.db2.gz IPMPZGDCUTZHHG-UHFFFAOYSA-N 0 0 362.426 3.797 20 5 FHBDRN COc1ccc([C@@H](C)OC(=O)COc2ccccc2[N+](=O)[O-])cc1Cl ZINC000728777323 943666778 /nfs/dbraw/zinc/66/67/78/943666778.db2.gz SULBQVKVZNPUMG-LLVKDONJSA-N 0 0 365.769 3.940 20 5 FHBDRN C[C@@](NC(=O)Cc1cccc([N+](=O)[O-])c1)(c1ccccc1)C(F)(F)F ZINC000504571002 943686731 /nfs/dbraw/zinc/68/67/31/943686731.db2.gz QCHQFNIPLAIVHP-MRXNPFEDSA-N 0 0 352.312 3.731 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N[C@](C)(c1ccccc1)C(F)(F)F ZINC000504570765 943687027 /nfs/dbraw/zinc/68/70/27/943687027.db2.gz NULIGGMUKDRPIH-MRXNPFEDSA-N 0 0 368.311 3.811 20 5 FHBDRN CCc1ccc(C(=O)N2CCC(c3cccc(N)c3)CC2)cc1[N+](=O)[O-] ZINC000424033430 943696953 /nfs/dbraw/zinc/69/69/53/943696953.db2.gz LIWINKJYWMATBE-UHFFFAOYSA-N 0 0 353.422 3.759 20 5 FHBDRN COc1cc(C)c([S@](C)=O)cc1OCc1ccc([N+](=O)[O-])cc1Cl ZINC000424098077 943731669 /nfs/dbraw/zinc/73/16/69/943731669.db2.gz BRCQLWSTKLQIDJ-DEOSSOPVSA-N 0 0 369.826 3.882 20 5 FHBDRN O=C(Cc1cccc([N+](=O)[O-])c1)N1CCC[C@H](Oc2ccccc2Cl)C1 ZINC000504670155 943737559 /nfs/dbraw/zinc/73/75/59/943737559.db2.gz OZQMHDLUDUXZLN-INIZCTEOSA-N 0 0 374.824 3.861 20 5 FHBDRN Cc1cccc(OC[C@H](O)COc2cc(C)c([N+](=O)[O-])cc2Cl)c1 ZINC000504673470 943739105 /nfs/dbraw/zinc/73/91/05/943739105.db2.gz MNLMVDQQVMLTBE-ZDUSSCGKSA-N 0 0 351.786 3.684 20 5 FHBDRN CCC1CCC2(CC1)NC(=O)N([C@H](C)c1ccc(C)c([N+](=O)[O-])c1)C2=O ZINC000431955834 943739354 /nfs/dbraw/zinc/73/93/54/943739354.db2.gz WCHSKKSZSGUJQA-VFPJAPOESA-N 0 0 359.426 3.855 20 5 FHBDRN CCn1c([C@H]2CCCS2)nnc1N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000424152305 943753822 /nfs/dbraw/zinc/75/38/22/943753822.db2.gz GWIGNPQLNWPVPS-MRXNPFEDSA-N 0 0 373.482 3.943 20 5 FHBDRN CCOc1cc(C(=O)NC[C@@H]2CCC[C@@H]2C2CC2)c([N+](=O)[O-])cc1OC ZINC000412484506 943758236 /nfs/dbraw/zinc/75/82/36/943758236.db2.gz XIRQYVVOTMORRF-UONOGXRCSA-N 0 0 362.426 3.558 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)N[C@@H]2[C@@H]3CCc4ccccc4[C@@H]32)cc1[N+](=O)[O-] ZINC000435780014 943766322 /nfs/dbraw/zinc/76/63/22/943766322.db2.gz TXPLMCQWJIHNDQ-YXHXOZEPSA-N 0 0 365.433 3.992 20 5 FHBDRN O=C([O-])C[C@@H](C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C(F)(F)F ZINC000417630808 943767686 /nfs/dbraw/zinc/76/76/86/943767686.db2.gz RPORFZGOGGEZIQ-NSHDSACASA-N 0 0 372.299 3.598 20 5 FHBDRN O=c1c2cc([N+](=O)[O-])ccc2ncn1Cc1nc(C2CCCCC2)cs1 ZINC000435782545 943767901 /nfs/dbraw/zinc/76/79/01/943767901.db2.gz RIHNESMQFYBJSA-UHFFFAOYSA-N 0 0 370.434 3.857 20 5 FHBDRN COCCSc1ccc([C@H](C)NC(=O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000504719832 943768095 /nfs/dbraw/zinc/76/80/95/943768095.db2.gz DYEOKWYXWNSRTM-ZDUSSCGKSA-N 0 0 360.435 3.824 20 5 FHBDRN O=C1c2cccc([N+](=O)[O-])c2C(=O)N1Cc1nc(C2CCCCC2)cs1 ZINC000435784326 943769661 /nfs/dbraw/zinc/76/96/61/943769661.db2.gz CMQGTKPXXXNREE-UHFFFAOYSA-N 0 0 371.418 3.895 20 5 FHBDRN O=C(C1CCC(C(F)(F)F)CC1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000435814797 943771597 /nfs/dbraw/zinc/77/15/97/943771597.db2.gz AXLXRQMCPMAEIQ-UHFFFAOYSA-N 0 0 356.344 3.848 20 5 FHBDRN CC[C@@H](CCC(=O)[O-])[NH2+]Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000417627659 943777798 /nfs/dbraw/zinc/77/77/98/943777798.db2.gz SPXBXLKMGVKCMX-LBPRGKRZSA-N 0 0 362.382 3.596 20 5 FHBDRN Cn1cc(CN[C@H]2C[C@@]2(F)c2ccccc2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000424203734 943786938 /nfs/dbraw/zinc/78/69/38/943786938.db2.gz UTJNCOJBPHFRBU-AZUAARDMSA-N 0 0 366.396 3.722 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N1CCO[C@H](c2cccc(F)c2)C1 ZINC001143507601 943794707 /nfs/dbraw/zinc/79/47/07/943794707.db2.gz SSTPKXLABLDYPP-KRWDZBQOSA-N 0 0 358.369 3.564 20 5 FHBDRN COc1ccc(CNC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)cc1 ZINC000435827412 943798614 /nfs/dbraw/zinc/79/86/14/943798614.db2.gz 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ZINC000436138406 944048579 /nfs/dbraw/zinc/04/85/79/944048579.db2.gz BUDMQLLRMVMOLW-CZUORRHYSA-N 0 0 355.822 3.916 20 5 FHBDRN C[C@H](NC(=O)N(C)Cc1ccccc1[N+](=O)[O-])[C@@H]1Oc2ccccc2[C@H]1C ZINC000437720543 944053329 /nfs/dbraw/zinc/05/33/29/944053329.db2.gz BXLDANNSSIJBDS-BIENJYKASA-N 0 0 369.421 3.689 20 5 FHBDRN O=C(c1ccc2c(c1)CCC=C2)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000505106443 944054632 /nfs/dbraw/zinc/05/46/32/944054632.db2.gz ZBQSVAFJZGLFPB-UHFFFAOYSA-N 0 0 363.417 3.517 20 5 FHBDRN CCC[C@@]1(C)CCCN(S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000437712472 944059147 /nfs/dbraw/zinc/05/91/47/944059147.db2.gz CWFJBCMXSSXGCP-HNNXBMFYSA-N 0 0 360.863 3.839 20 5 FHBDRN Cc1ccc(S(=O)(=O)Nc2cccc(C(C)(F)F)c2)cc1[N+](=O)[O-] ZINC000436165735 944070245 /nfs/dbraw/zinc/07/02/45/944070245.db2.gz YUCNFOUVTNKLCB-UHFFFAOYSA-N 0 0 356.350 3.816 20 5 FHBDRN COC(=O)[C@H](C)Sc1ccccc1C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000515639103 944073039 /nfs/dbraw/zinc/07/30/39/944073039.db2.gz NOEIMHXDSSIJDH-NSHDSACASA-N 0 0 360.391 3.501 20 5 FHBDRN CC[C@@H](C)[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F)C(F)(F)F ZINC000436184137 944078522 /nfs/dbraw/zinc/07/85/22/944078522.db2.gz SWTVAFMHPJNYQY-RDDDGLTNSA-N 0 0 370.274 3.903 20 5 FHBDRN CCN(C(=O)C(=O)Nc1cccc([N+](=O)[O-])c1C)[C@@H](C)c1ccc(F)cc1 ZINC000517184842 944082500 /nfs/dbraw/zinc/08/25/00/944082500.db2.gz SFMPSZYIRUVQHP-ZDUSSCGKSA-N 0 0 373.384 3.591 20 5 FHBDRN CC1(C)CC[C@@H](CNC(=O)c2c([N+](=O)[O-])cccc2C(F)(F)F)OC1 ZINC000893331924 944092428 /nfs/dbraw/zinc/09/24/28/944092428.db2.gz MCSYJDSKQPCTHZ-JTQLQIEISA-N 0 0 360.332 3.549 20 5 FHBDRN Cc1cc(C(=O)N2CCO[C@H](c3ccccc3Cl)C2)ccc1[N+](=O)[O-] ZINC000505148274 944093213 /nfs/dbraw/zinc/09/32/13/944093213.db2.gz GWWARJVHHLYEHU-KRWDZBQOSA-N 0 0 360.797 3.770 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])N(CCc1cccc(F)c1)C1CC1 ZINC000505170844 944103361 /nfs/dbraw/zinc/10/33/61/944103361.db2.gz IXAFHHYPGPCWBO-UHFFFAOYSA-N 0 0 372.396 3.737 20 5 FHBDRN O=C([O-])[C@@H](CC[N@H+](Cc1ccccc1[N+](=O)[O-])C1CC1)c1ccccc1 ZINC000515660294 944104204 /nfs/dbraw/zinc/10/42/04/944104204.db2.gz VDDYHBPLRQSLRQ-SFHVURJKSA-N 0 0 354.406 3.818 20 5 FHBDRN CC(C)CN(CC(C)C)C(=O)CNc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000515662345 944105294 /nfs/dbraw/zinc/10/52/94/944105294.db2.gz OOOFLZOTNVPPAW-UHFFFAOYSA-N 0 0 373.400 3.749 20 5 FHBDRN CC[C@@H](C)[C@H](NC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21)C(F)(F)F ZINC000436197983 944108402 /nfs/dbraw/zinc/10/84/02/944108402.db2.gz LPYIFLGMYAJIIH-BMIGLBTASA-N 0 0 357.332 3.643 20 5 FHBDRN O=C(c1n[nH]c2ccc([N+](=O)[O-])cc21)N1CCCC[C@H]1Cc1ccccc1 ZINC000500109137 944114309 /nfs/dbraw/zinc/11/43/09/944114309.db2.gz IBIFGKDPMFUBEJ-HNNXBMFYSA-N 0 0 364.405 3.709 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])NC1(c2ccccc2)CCCC1 ZINC000505195209 944123626 /nfs/dbraw/zinc/12/36/26/944123626.db2.gz DLRBIPFWFNDPLH-UHFFFAOYSA-N 0 0 354.406 3.949 20 5 FHBDRN C[C@@H](C(=O)NC[C@H]1CC[C@H](c2ccccc2)O1)c1ccc([N+](=O)[O-])cc1F ZINC000515702561 944127553 /nfs/dbraw/zinc/12/75/53/944127553.db2.gz OTVMAPSPGPQIAE-VVFCZOMOSA-N 0 0 372.396 3.874 20 5 FHBDRN CC[C@@H](Cc1ccccc1C)C(=O)N1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000424803822 944128136 /nfs/dbraw/zinc/12/81/36/944128136.db2.gz DABKNFJDOISHDW-INIZCTEOSA-N 0 0 370.453 3.532 20 5 FHBDRN CCCOc1cc(NC(=O)NC[C@@H]2C[C@H]2C)c([N+](=O)[O-])cc1OCCC ZINC000505778577 944129372 /nfs/dbraw/zinc/12/93/72/944129372.db2.gz NGYVDCIBICEGJE-OLZOCXBDSA-N 0 0 365.430 3.950 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)c1ccc(-n2cccn2)c(F)c1 ZINC000505202174 944132150 /nfs/dbraw/zinc/13/21/50/944132150.db2.gz CBOXRNQXCMCVAE-CYBMUJFWSA-N 0 0 368.368 3.719 20 5 FHBDRN CC(C)(CCCc1ccccc1)CNc1ncc([N+](=O)[O-])cc1C(N)=O ZINC000505779560 944136650 /nfs/dbraw/zinc/13/66/50/944136650.db2.gz YALSGNDDYHLLEJ-UHFFFAOYSA-N 0 0 356.426 3.550 20 5 FHBDRN O=C(Nc1ccc(O[C@H]2CCCC[C@@H]2O)cc1)c1cc(F)cc([N+](=O)[O-])c1 ZINC000505209187 944137764 /nfs/dbraw/zinc/13/77/64/944137764.db2.gz FPIXEHKSBMAOHZ-ROUUACIJSA-N 0 0 374.368 3.669 20 5 FHBDRN C[C@@H](Nc1ccc(C(=O)NCC2CCC2)cc1[N+](=O)[O-])c1ccccn1 ZINC000053479104 944139397 /nfs/dbraw/zinc/13/93/97/944139397.db2.gz XQEVJQIUMVWRNI-CYBMUJFWSA-N 0 0 354.410 3.693 20 5 FHBDRN COc1cccc(-c2nc(-c3cccc(C(F)(F)F)n3)no2)c1[N+](=O)[O-] ZINC000517261593 944142491 /nfs/dbraw/zinc/14/24/91/944142491.db2.gz VOIGKGAZWAGDAO-UHFFFAOYSA-N 0 0 366.255 3.734 20 5 FHBDRN CC[C@@H](C)c1ccccc1OCC(=O)NCc1ccc(OC)c([N+](=O)[O-])c1 ZINC000515729038 944142582 /nfs/dbraw/zinc/14/25/82/944142582.db2.gz UDNGTROSJCLBQI-CQSZACIVSA-N 0 0 372.421 3.812 20 5 FHBDRN O=C(NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)c1coc(C2CCCC2)n1 ZINC000515721052 944152446 /nfs/dbraw/zinc/15/24/46/944152446.db2.gz YGKUTGGWSDVAEE-UHFFFAOYSA-N 0 0 368.393 3.694 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCOC2(CCCCC2)C1 ZINC000515724434 944154621 /nfs/dbraw/zinc/15/46/21/944154621.db2.gz YBPVOBJZCYWATA-CQSZACIVSA-N 0 0 364.467 3.637 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H]1C[C@H]1c1ccc(Cl)cc1 ZINC000436262532 944154765 /nfs/dbraw/zinc/15/47/65/944154765.db2.gz QGUJMOCBCQMAKD-UONOGXRCSA-N 0 0 361.785 3.934 20 5 FHBDRN CN1C(=O)CCc2cc(Nc3ccc([N+](=O)[O-])c(OC(F)F)c3)ccc21 ZINC000092650260 944163796 /nfs/dbraw/zinc/16/37/96/944163796.db2.gz XMUWSLGPSARDPI-UHFFFAOYSA-N 0 0 363.320 3.849 20 5 FHBDRN O=C(Nc1cccc(C(=O)Nc2ccccn2)c1)c1csc([N+](=O)[O-])c1 ZINC000505785345 944167684 /nfs/dbraw/zinc/16/76/84/944167684.db2.gz SWOKDXYXMSKABK-UHFFFAOYSA-N 0 0 368.374 3.556 20 5 FHBDRN O=C(c1ncsc1-c1ccccc1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000437882785 944198106 /nfs/dbraw/zinc/19/81/06/944198106.db2.gz RUFLFUPXTILBSA-UHFFFAOYSA-N 0 0 365.414 3.917 20 5 FHBDRN COc1ccc(CNC(=O)Nc2cccc(OC(F)F)c2)cc1[N+](=O)[O-] ZINC000515774945 944199258 /nfs/dbraw/zinc/19/92/58/944199258.db2.gz SSSUCMBBPRYZSE-UHFFFAOYSA-N 0 0 367.308 3.527 20 5 FHBDRN C[C@H]1CN(c2cc(C(F)(F)F)ncc2[N+](=O)[O-])C[C@@H](c2ccccc2)O1 ZINC000436321049 944199260 /nfs/dbraw/zinc/19/92/60/944199260.db2.gz WGSSWAKKLUOKKN-NHYWBVRUSA-N 0 0 367.327 3.975 20 5 FHBDRN Cc1ccc([C@H]2COCCN2c2ccc([N+](=O)[O-])c(OC(F)F)c2)o1 ZINC000092667031 944204326 /nfs/dbraw/zinc/20/43/26/944204326.db2.gz HHUBTQZXFKUVKO-CYBMUJFWSA-N 0 0 354.309 3.676 20 5 FHBDRN COC(=O)c1cc(C(=O)N2CCCc3cc(Cl)ccc32)cc([N+](=O)[O-])c1 ZINC000500167747 944204552 /nfs/dbraw/zinc/20/45/52/944204552.db2.gz JOFSQSIRBAGEHS-UHFFFAOYSA-N 0 0 374.780 3.628 20 5 FHBDRN Cc1ccn2cc(CNc3cc(C(F)(F)F)ncc3[N+](=O)[O-])nc2c1 ZINC000436310473 944206517 /nfs/dbraw/zinc/20/65/17/944206517.db2.gz VBZXUCWJCDWBRB-UHFFFAOYSA-N 0 0 351.288 3.577 20 5 FHBDRN COc1cc2c(cc1C(=O)O[C@@H](C)c1cc([N+](=O)[O-])ccc1C)OCO2 ZINC000759783584 944207732 /nfs/dbraw/zinc/20/77/32/944207732.db2.gz DCKQGPXLWNHGII-NSHDSACASA-N 0 0 359.334 3.559 20 5 FHBDRN Cc1nn(Cc2ccc(C(=O)N3C[C@H](C)CC[C@H]3C)cc2)c(C)c1[N+](=O)[O-] ZINC000436333470 944211531 /nfs/dbraw/zinc/21/15/31/944211531.db2.gz JRXLRWUKQDVAAX-ZIAGYGMSSA-N 0 0 370.453 3.717 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)c1n[nH]c(C(C)C)c1Br ZINC000517343255 944221319 /nfs/dbraw/zinc/22/13/19/944221319.db2.gz FOCXMBQYWCYKLB-UHFFFAOYSA-N 0 0 367.203 3.765 20 5 FHBDRN CC1(C)CCc2c(OC(=O)c3cc4c(c([N+](=O)[O-])c3)OCO4)cccc2O1 ZINC001270288431 944230101 /nfs/dbraw/zinc/23/01/01/944230101.db2.gz ANZCNMADFNMNFO-UHFFFAOYSA-N 0 0 371.345 3.646 20 5 FHBDRN CCC[C@@]1(C(=O)OCC)CCCN1C(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000436348094 944231277 /nfs/dbraw/zinc/23/12/77/944231277.db2.gz VFSJGGSCTAMEDZ-IBGZPJMESA-N 0 0 374.393 3.679 20 5 FHBDRN CCCN(CC1CCCCC1)C(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC000518286066 944236505 /nfs/dbraw/zinc/23/65/05/944236505.db2.gz BFJKWVUTXUHGFH-UHFFFAOYSA-N 0 0 371.441 3.608 20 5 FHBDRN CC(C)(CNC(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-])OCC1CC1 ZINC000414003411 944237822 /nfs/dbraw/zinc/23/78/22/944237822.db2.gz JTKMZIIEQHZHQE-UHFFFAOYSA-N 0 0 369.421 3.592 20 5 FHBDRN COc1ccc(CSCC(=O)N2CCC[C@@H]2CC(C)C)cc1[N+](=O)[O-] ZINC000500190595 944241625 /nfs/dbraw/zinc/24/16/25/944241625.db2.gz ZPCAJMVZXFLUFS-OAHLLOKOSA-N 0 0 366.483 3.874 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1N1CC[C@H](OCCCc3ccccc3)C1)CCN2 ZINC000436384465 944254240 /nfs/dbraw/zinc/25/42/40/944254240.db2.gz FTKCUYZCQKJBMR-KRWDZBQOSA-N 0 0 367.449 3.791 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H]1C[C@H]1c1cccc(Cl)c1 ZINC000436386426 944255624 /nfs/dbraw/zinc/25/56/24/944255624.db2.gz ICNLCOJDURSTJV-DZGCQCFKSA-N 0 0 361.785 3.934 20 5 FHBDRN CCOC(=O)c1ccnc(NCc2oc3ccccc3c2OC)c1[N+](=O)[O-] ZINC000473702310 944256884 /nfs/dbraw/zinc/25/68/84/944256884.db2.gz WFEKLOGWLJMRNA-UHFFFAOYSA-N 0 0 371.349 3.533 20 5 FHBDRN CC(C)(C(=O)N[C@H]1CCO[C@H](c2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000500201265 944259641 /nfs/dbraw/zinc/25/96/41/944259641.db2.gz XLDMMOVPGWXQRV-LPHOPBHVSA-N 0 0 368.433 3.909 20 5 FHBDRN CCOc1cccc([C@@H]2C[C@H]2NC(=O)Nc2cc(F)cc([N+](=O)[O-])c2)c1 ZINC000436400216 944277233 /nfs/dbraw/zinc/27/72/33/944277233.db2.gz ISSZJUJSCZZOBM-DLBZAZTESA-N 0 0 359.357 3.810 20 5 FHBDRN COc1ccc(O[C@@H](C)CNc2cc(C(F)(F)F)ncc2[N+](=O)[O-])cc1 ZINC000436402964 944280886 /nfs/dbraw/zinc/28/08/86/944280886.db2.gz DHTHMFMYCAOWPX-JTQLQIEISA-N 0 0 371.315 3.897 20 5 FHBDRN COc1cccc([C@H]2C[C@H](C)CN2c2nc3sccn3c2[N+](=O)[O-])c1 ZINC000543132811 944282599 /nfs/dbraw/zinc/28/25/99/944282599.db2.gz XFMAGTMICYHIFI-SMDDNHRTSA-N 0 0 358.423 3.900 20 5 FHBDRN COc1ccc(CCCNC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)cc1 ZINC000515871305 944287700 /nfs/dbraw/zinc/28/77/00/944287700.db2.gz HRPCJOQRLKYNSX-CQSZACIVSA-N 0 0 374.462 3.833 20 5 FHBDRN COC[C@@H](Cc1ccccc1)N(C)c1ccc([N+](=O)[O-])c2cnccc21 ZINC000473714462 944288588 /nfs/dbraw/zinc/28/85/88/944288588.db2.gz IYTALYXPPYEVQB-MRXNPFEDSA-N 0 0 351.406 3.837 20 5 FHBDRN Cn1nc(CC(C)(C)C)cc1NC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000517434244 944292609 /nfs/dbraw/zinc/29/26/09/944292609.db2.gz LQVDVDXDEWEBQQ-UHFFFAOYSA-N 0 0 369.425 3.510 20 5 FHBDRN O=C(NCc1ccc(-c2ccccc2)o1)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000517433578 944293496 /nfs/dbraw/zinc/29/34/96/944293496.db2.gz SGCBCANNIGTTOS-UHFFFAOYSA-N 0 0 366.329 3.514 20 5 FHBDRN COC(=O)c1ccc(-c2noc(/C=C/c3cccc([N+](=O)[O-])c3)n2)cc1 ZINC000518335709 944294172 /nfs/dbraw/zinc/29/41/72/944294172.db2.gz YBLWIBIQTMGZSU-BJMVGYQFSA-N 0 0 351.318 3.602 20 5 FHBDRN COc1c(C(=O)N[C@@H]2CCCC[C@H]2OCCC(C)C)cccc1[N+](=O)[O-] ZINC000438027237 944294561 /nfs/dbraw/zinc/29/45/61/944294561.db2.gz OVLVYWOICROQCO-NVXWUHKLSA-N 0 0 364.442 3.707 20 5 FHBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])N1CCCc2occc2C1 ZINC000517435587 944295211 /nfs/dbraw/zinc/29/52/11/944295211.db2.gz RYWXMINPVFNBID-UHFFFAOYSA-N 0 0 366.826 3.908 20 5 FHBDRN O=C(NCc1cc(F)ccc1F)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000436422235 944295745 /nfs/dbraw/zinc/29/57/45/944295745.db2.gz LSKXCGWUNNPFMT-UHFFFAOYSA-N 0 0 364.351 3.890 20 5 FHBDRN CCCOc1cccc(CCNC(=O)Cc2cccc([N+](=O)[O-])c2C)c1 ZINC000133867860 944304014 /nfs/dbraw/zinc/30/40/14/944304014.db2.gz GRQSZEMVGOBACH-UHFFFAOYSA-N 0 0 356.422 3.593 20 5 FHBDRN Cc1sc(S(=O)(=O)N(C)[C@@H](C)c2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000123199136 944306184 /nfs/dbraw/zinc/30/61/84/944306184.db2.gz ONAMPUSJNYLJSI-NSHDSACASA-N 0 0 354.453 3.655 20 5 FHBDRN O=C(c1cc([O-])cc([N+](=O)[O-])c1)N1CC2(CCCC2)c2c1cccc2F ZINC000506171686 944309067 /nfs/dbraw/zinc/30/90/67/944309067.db2.gz HMHGEZAXRDOKAX-UHFFFAOYSA-N 0 0 356.353 3.912 20 5 FHBDRN Cc1cc(CN(C)c2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])ccc1F ZINC000436428812 944312192 /nfs/dbraw/zinc/31/21/92/944312192.db2.gz CBDQFBFKKJMDNH-UHFFFAOYSA-N 0 0 357.385 3.571 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(NC[C@@H](CO)Cc2cc(F)c(F)c(F)c2)c1 ZINC000436428461 944312842 /nfs/dbraw/zinc/31/28/42/944312842.db2.gz CXNDAWXFTLCZMZ-LBPRGKRZSA-N 0 0 354.328 3.584 20 5 FHBDRN C[C@H](c1ccc(F)cc1)[S@@](=O)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000517470559 944315177 /nfs/dbraw/zinc/31/51/77/944315177.db2.gz KAVAPEWDGIVLIF-NDHGSNPTSA-N 0 0 365.382 3.610 20 5 FHBDRN C[C@@H]1CCN(C(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C[C@H]1C ZINC000426273820 944318063 /nfs/dbraw/zinc/31/80/63/944318063.db2.gz ABMAETVLTLYAMT-GHMZBOCLSA-N 0 0 359.348 3.801 20 5 FHBDRN COc1ccccc1[C@H](C)N(C)C(=O)COc1ccc([N+](=O)[O-])c(C)c1 ZINC000053541419 944328276 /nfs/dbraw/zinc/32/82/76/944328276.db2.gz FVVHXMVGLJOUBM-AWEZNQCLSA-N 0 0 358.394 3.510 20 5 FHBDRN C[C@H](CC(F)(F)F)NC(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000426277384 944333705 /nfs/dbraw/zinc/33/37/05/944333705.db2.gz KEGGMECOSVVSAL-SSDOTTSWSA-N 0 0 373.253 3.754 20 5 FHBDRN C/C=C/c1ccc(OC[C@@H](O)COc2ccc(C)c([N+](=O)[O-])c2)c(OC)c1 ZINC000550175987 944346064 /nfs/dbraw/zinc/34/60/64/944346064.db2.gz XNBBOSQQINWIND-APHBUQMISA-N 0 0 373.405 3.764 20 5 FHBDRN Cc1cc(OC[C@H](O)CO[C@H]2CCCc3ccccc32)ccc1[N+](=O)[O-] ZINC000550175738 944346496 /nfs/dbraw/zinc/34/64/96/944346496.db2.gz KDJVFTRHIOXRLJ-JXFKEZNVSA-N 0 0 357.406 3.737 20 5 FHBDRN Cc1c(C(=O)Nc2cccc(F)c2F)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000123352199 944346765 /nfs/dbraw/zinc/34/67/65/944346765.db2.gz XGOFNYAQPGQFHV-UHFFFAOYSA-N 0 0 351.265 3.650 20 5 FHBDRN CC(C)O[C@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)C1(C)C ZINC000500260032 944348768 /nfs/dbraw/zinc/34/87/68/944348768.db2.gz DKJFEXOWYHJRCT-KGLIPLIRSA-N 0 0 374.359 3.936 20 5 FHBDRN CC(C)(C(=O)NC[C@@]1(C)CCOC2(CCC2)C1)c1ccccc1[N+](=O)[O-] ZINC000894654661 944365269 /nfs/dbraw/zinc/36/52/69/944365269.db2.gz DBIGAUFLOVNTAU-IBGZPJMESA-N 0 0 360.454 3.728 20 5 FHBDRN COC(=O)C(C)(C)c1ccc(NC(=O)Nc2ccc([N+](=O)[O-])c(C)c2)cc1 ZINC000473762458 944375491 /nfs/dbraw/zinc/37/54/91/944375491.db2.gz HVETWHGUWIAQOX-UHFFFAOYSA-N 0 0 371.393 3.998 20 5 FHBDRN O=C(Cc1cccc([N+](=O)[O-])c1)N1CCC(Cc2ccc(F)c(F)c2)CC1 ZINC000469378324 944375986 /nfs/dbraw/zinc/37/59/86/944375986.db2.gz DOSWVYXKPVAPKZ-UHFFFAOYSA-N 0 0 374.387 3.897 20 5 FHBDRN Cc1cc(NC(=O)N[C@@H](c2cccs2)C(C)(C)CO)ccc1[N+](=O)[O-] ZINC000436508797 944379067 /nfs/dbraw/zinc/37/90/67/944379067.db2.gz JBURRZMXGKPNSX-HNNXBMFYSA-N 0 0 363.439 3.846 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@H](COC)C1 ZINC000506494720 944379757 /nfs/dbraw/zinc/37/97/57/944379757.db2.gz MTNLQHKCMFJEKR-ZDUSSCGKSA-N 0 0 352.456 3.596 20 5 FHBDRN CO[C@@H](c1ccc(F)cc1)[C@@H](C)NC(=O)Nc1ccc([N+](=O)[O-])c(C)c1 ZINC000473768985 944386881 /nfs/dbraw/zinc/38/68/81/944386881.db2.gz ZPYJHFZKTLQZQC-SJKOYZFVSA-N 0 0 361.373 3.940 20 5 FHBDRN CNC(=O)c1ccc(N2CCC[C@H]2CCc2ccccc2)c([N+](=O)[O-])c1 ZINC000053574065 944387757 /nfs/dbraw/zinc/38/77/57/944387757.db2.gz QMCZUXHNUBVWNN-KRWDZBQOSA-N 0 0 353.422 3.556 20 5 FHBDRN CC(C)c1ccc(C(=O)Nc2nc3c(cccc3F)n2C)cc1[N+](=O)[O-] ZINC000439164984 944388568 /nfs/dbraw/zinc/38/85/68/944388568.db2.gz IUMVECKWJRMRLC-UHFFFAOYSA-N 0 0 356.357 3.996 20 5 FHBDRN CCc1c(C(=O)CNc2cc([N+](=O)[O-])ccc2CC)[nH]c(C)c1C(C)=O ZINC000518451780 944389913 /nfs/dbraw/zinc/38/99/13/944389913.db2.gz QULHKOBQVMAWSA-UHFFFAOYSA-N 0 0 357.410 3.854 20 5 FHBDRN CN(Cc1ccc(OC(F)(F)F)cc1)C(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000105865971 944391706 /nfs/dbraw/zinc/39/17/06/944391706.db2.gz FCJNQBWGAMIFBW-UHFFFAOYSA-N 0 0 368.311 3.695 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)NCc1ccccc1OCC(C)C ZINC000515979597 944391972 /nfs/dbraw/zinc/39/19/72/944391972.db2.gz CAJMOVNWSQGKQL-UHFFFAOYSA-N 0 0 358.394 3.568 20 5 FHBDRN O=Cc1cc(Br)ccc1OCCOc1cccc([N+](=O)[O-])c1 ZINC000059008019 944395166 /nfs/dbraw/zinc/39/51/66/944395166.db2.gz AIAPDMRGFPVGHD-UHFFFAOYSA-N 0 0 366.167 3.628 20 5 FHBDRN Cc1ccc(S(=O)(=O)N2CCCC3(CCCCC3)C2)c([N+](=O)[O-])c1 ZINC000518442607 944396813 /nfs/dbraw/zinc/39/68/13/944396813.db2.gz YCHYGOFXWDGTQS-UHFFFAOYSA-N 0 0 352.456 3.638 20 5 FHBDRN O=C(Nc1cc(Br)ccn1)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000123696860 944398045 /nfs/dbraw/zinc/39/80/45/944398045.db2.gz JOBGGVLBBQYXNC-UHFFFAOYSA-N 0 0 356.563 3.658 20 5 FHBDRN C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)Cc1coc(-c2cccs2)n1 ZINC000105948840 944398685 /nfs/dbraw/zinc/39/86/85/944398685.db2.gz FWPVEAKBEAWLAL-LLVKDONJSA-N 0 0 369.402 3.832 20 5 FHBDRN C[C@@H]1CCCN(c2ccc(C(=O)N(C)Cc3ccoc3)cc2[N+](=O)[O-])C1 ZINC000515988922 944399429 /nfs/dbraw/zinc/39/94/29/944399429.db2.gz SDZPOODCNVGKKE-CQSZACIVSA-N 0 0 357.410 3.696 20 5 FHBDRN C[C@H]1CCCN(c2ccc(C(=O)N(C)Cc3ccoc3)cc2[N+](=O)[O-])C1 ZINC000515988921 944399530 /nfs/dbraw/zinc/39/95/30/944399530.db2.gz SDZPOODCNVGKKE-AWEZNQCLSA-N 0 0 357.410 3.696 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccnn1Cc1ccccc1F ZINC000105972133 944406137 /nfs/dbraw/zinc/40/61/37/944406137.db2.gz JLGFKJMYNGRPDO-UHFFFAOYSA-N 0 0 354.341 3.539 20 5 FHBDRN Cc1cc(C(=O)Nc2ccnn2Cc2ccccc2F)cc([N+](=O)[O-])c1 ZINC000105972362 944407568 /nfs/dbraw/zinc/40/75/68/944407568.db2.gz IAFVHYOTBVYVIY-UHFFFAOYSA-N 0 0 354.341 3.539 20 5 FHBDRN Cc1nc2cc(CNc3nc(C4CC4)nc(Cl)c3[N+](=O)[O-])ccc2o1 ZINC001167755665 944414071 /nfs/dbraw/zinc/41/40/71/944414071.db2.gz AJURJMKFXPQRBX-UHFFFAOYSA-N 0 0 359.773 3.977 20 5 FHBDRN CCN(C(=O)CCNc1ccccc1[N+](=O)[O-])[C@@H](C)Cc1ccsc1 ZINC000426304142 944418555 /nfs/dbraw/zinc/41/85/55/944418555.db2.gz QDXRMJTTYAVETC-AWEZNQCLSA-N 0 0 361.467 3.938 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NS(=O)(=O)c1ccc(OC(C)C)cc1 ZINC000473778037 944423295 /nfs/dbraw/zinc/42/32/95/944423295.db2.gz SKWWAVFMYLKCQW-UHFFFAOYSA-N 0 0 364.423 3.800 20 5 FHBDRN CC(C)Oc1ccc([C@H](C)Nc2nc3ccc([N+](=O)[O-])cc3c(=O)[nH]2)cc1 ZINC000517592622 944423980 /nfs/dbraw/zinc/42/39/80/944423980.db2.gz ZDQMNPZCYNLVHT-LBPRGKRZSA-N 0 0 368.393 3.626 20 5 FHBDRN CN(C(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1)c1nccs1 ZINC000123826008 944428773 /nfs/dbraw/zinc/42/87/73/944428773.db2.gz SDHZFNBKVSIJSL-UHFFFAOYSA-N 0 0 368.418 3.940 20 5 FHBDRN COCCn1cc2c(n1)[C@H](Nc1ccc([N+](=O)[O-])cc1Cl)CCC2 ZINC000505846852 944437216 /nfs/dbraw/zinc/43/72/16/944437216.db2.gz UZRIMPXCZCWBEU-OAHLLOKOSA-N 0 0 350.806 3.581 20 5 FHBDRN CC(C)(C)c1noc2ncc(C(=O)N3CCc4ccc([N+](=O)[O-])cc43)cc21 ZINC000516041152 944438102 /nfs/dbraw/zinc/43/81/02/944438102.db2.gz CLIXLQUUCLPWDN-UHFFFAOYSA-N 0 0 366.377 3.631 20 5 FHBDRN Cc1ccc(OCCCCNC(=O)N(C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000046784846 944441569 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CN(Cc1ccccc1C(F)(F)F)C(=O)c1cc(F)cc([N+](=O)[O-])c1N ZINC000516075516 944468676 /nfs/dbraw/zinc/46/86/76/944468676.db2.gz SDTFWEOYUQQTRM-UHFFFAOYSA-N 0 0 371.290 3.607 20 5 FHBDRN CCOc1cc(NC(=O)N[C@@H]2CCC[C@@H](F)C2)c([N+](=O)[O-])cc1OCC ZINC000518524666 944471557 /nfs/dbraw/zinc/47/15/57/944471557.db2.gz JEMYDKCXIIEMFD-VXGBXAGGSA-N 0 0 369.393 3.794 20 5 FHBDRN O=C(Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1)[C@@H]1CCC[C@@H](O)C1 ZINC000439261663 944477499 /nfs/dbraw/zinc/47/74/99/944477499.db2.gz VZPSIOXDUUBRTR-CZUORRHYSA-N 0 0 356.378 3.877 20 5 FHBDRN Cc1ccc(C(=O)N(Cc2ccccc2)CC2CCOCC2)cc1[N+](=O)[O-] ZINC000517649680 944480537 /nfs/dbraw/zinc/48/05/37/944480537.db2.gz WZGHDPBCDVPWRX-UHFFFAOYSA-N 0 0 368.433 3.972 20 5 FHBDRN Cc1ccc(-c2nc(C(=O)NCCc3ccc([N+](=O)[O-])cc3)cs2)o1 ZINC000054167697 944485690 /nfs/dbraw/zinc/48/56/90/944485690.db2.gz JAHTWAJLPOIQED-UHFFFAOYSA-N 0 0 357.391 3.592 20 5 FHBDRN Cn1cnc([N+](=O)[O-])c1CN1CCC(Sc2ccc(Cl)cc2)CC1 ZINC000366647245 944491377 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371.412 3.780 20 5 FHBDRN CC(C)n1cc2cc(NC(=O)COc3ccccc3[N+](=O)[O-])ccc2n1 ZINC000522868059 946033045 /nfs/dbraw/zinc/03/30/45/946033045.db2.gz AFNMPQFQPADKDA-UHFFFAOYSA-N 0 0 354.366 3.543 20 5 FHBDRN COC(=O)c1cc(NC(=O)c2csc3c2CC[C@H](C)C3)cc([N+](=O)[O-])c1 ZINC000522871283 946033147 /nfs/dbraw/zinc/03/31/47/946033147.db2.gz ISTNBPFJDCPDTC-JTQLQIEISA-N 0 0 374.418 3.820 20 5 FHBDRN COc1ccc2c(c1)OCC[C@H]2NC(=O)Nc1ccc([N+](=O)[O-])c(C)c1 ZINC000613784432 946037849 /nfs/dbraw/zinc/03/78/49/946037849.db2.gz VITDQCBDUXFGHV-OAHLLOKOSA-N 0 0 357.366 3.557 20 5 FHBDRN O=C(CCCOCCc1ccccc1)N1CCCc2ccc([N+](=O)[O-])cc21 ZINC000522875914 946041033 /nfs/dbraw/zinc/04/10/33/946041033.db2.gz DCRGFYURYFWRQE-UHFFFAOYSA-N 0 0 368.433 3.914 20 5 FHBDRN Cc1oc(-c2ccccc2)nc1Cn1cc(Br)c([N+](=O)[O-])n1 ZINC000108718485 946047284 /nfs/dbraw/zinc/04/72/84/946047284.db2.gz APXUUPSUNPEFNV-UHFFFAOYSA-N 0 0 363.171 3.566 20 5 FHBDRN C[C@@H]1CCC[C@@H](CNC(=O)c2ccc3c(c2[N+](=O)[O-])OCCCO3)[C@@H]1C ZINC001270823406 946055870 /nfs/dbraw/zinc/05/58/70/946055870.db2.gz TYHOAZNCYOWPKD-MCIONIFRSA-N 0 0 362.426 3.558 20 5 FHBDRN O=[N+]([O-])c1cc(F)c(N2CC[C@@H](c3nccc(C(F)(F)F)n3)C2)c(F)c1 ZINC000896907402 946056991 /nfs/dbraw/zinc/05/69/91/946056991.db2.gz MQKGTCLYBUFGJF-MRVPVSSYSA-N 0 0 374.269 3.676 20 5 FHBDRN CCN(C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2)C12CC3CC(CC(C3)C1)C2 ZINC000181780845 946071828 /nfs/dbraw/zinc/07/18/28/946071828.db2.gz FYTTUYFOLFESEJ-UHFFFAOYSA-N 0 0 372.421 3.754 20 5 FHBDRN CCOCCOc1c(Cl)cccc1NC(=O)c1csc([N+](=O)[O-])c1 ZINC000062918540 946072783 /nfs/dbraw/zinc/07/27/83/946072783.db2.gz UTXOIUFIBHTCIA-UHFFFAOYSA-N 0 0 370.814 3.977 20 5 FHBDRN C[C@H](NC(=O)NC[C@@H]1CCOc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000108884380 946074521 /nfs/dbraw/zinc/07/45/21/946074521.db2.gz HUFYASKYQJLLNA-ZFWWWQNUSA-N 0 0 355.394 3.521 20 5 FHBDRN COc1ccc(CC(=O)N2CCC(c3ccccc3F)CC2)cc1[N+](=O)[O-] ZINC000522896500 946077029 /nfs/dbraw/zinc/07/70/29/946077029.db2.gz INLOLJXRMVLTHC-UHFFFAOYSA-N 0 0 372.396 3.691 20 5 FHBDRN CSCCCCNc1c2cc(Br)ccc2ncc1[N+](=O)[O-] ZINC000522903367 946084426 /nfs/dbraw/zinc/08/44/26/946084426.db2.gz JXTLXKZYOOLSFU-UHFFFAOYSA-N 0 0 370.272 3.883 20 5 FHBDRN CC(C)Oc1cccc([C@H](C)NC(=O)NCc2ccccc2[N+](=O)[O-])c1 ZINC000045625354 946089758 /nfs/dbraw/zinc/08/97/58/946089758.db2.gz AOPKSMAPZOWQGP-AWEZNQCLSA-N 0 0 357.410 3.942 20 5 FHBDRN Cc1ccc(OCCCCNC(=O)NCc2ccccc2[N+](=O)[O-])cc1 ZINC000045624315 946090061 /nfs/dbraw/zinc/09/00/61/946090061.db2.gz ZESJHRIMFQBRJS-UHFFFAOYSA-N 0 0 357.410 3.562 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])N(Cc1ccco1)Cc1ccco1 ZINC000045624571 946090515 /nfs/dbraw/zinc/09/05/15/946090515.db2.gz KATNXKCMUPBSQW-UHFFFAOYSA-N 0 0 355.350 3.693 20 5 FHBDRN CC(C)[C@H]1CCN(C(=O)c2cccc3c(=O)c4cccc(F)c4[nH]c23)C1 ZINC000444227084 946094737 /nfs/dbraw/zinc/09/47/37/946094737.db2.gz OARMZXVQCXYNFG-ZDUSSCGKSA-N 0 0 352.409 3.939 20 5 FHBDRN CN(Cc1ccc([N+](=O)[O-])cc1)[C@@H](c1ccc(F)cc1)c1ncccn1 ZINC000066881333 946098686 /nfs/dbraw/zinc/09/86/86/946098686.db2.gz QZQNPLCJFIKCOW-SFHVURJKSA-N 0 0 352.369 3.745 20 5 FHBDRN O=C(N[C@@H](CCO)c1ccccc1)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000444235503 946107788 /nfs/dbraw/zinc/10/77/88/946107788.db2.gz ITCGPXPMKXHLCU-IBGZPJMESA-N 0 0 372.424 3.535 20 5 FHBDRN CN(C(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1)c1ccc2c(c1)OCO2 ZINC000444239428 946110819 /nfs/dbraw/zinc/11/08/19/946110819.db2.gz KXMNMTDJBZBQFB-UHFFFAOYSA-N 0 0 372.380 3.687 20 5 FHBDRN CCC[C@@H](CC1CCCC1)C(=O)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000522930910 946112997 /nfs/dbraw/zinc/11/29/97/946112997.db2.gz RXZFLJNRUGFJEA-IRXDYDNUSA-N 0 0 374.485 3.999 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)Nc2cccc(-c3nccc(C)n3)c2)c1 ZINC000522929498 946117746 /nfs/dbraw/zinc/11/77/46/946117746.db2.gz ZCGROKHYWOEGRK-UHFFFAOYSA-N 0 0 364.361 3.621 20 5 FHBDRN COc1ccc(/C=C\C(=O)O[C@H](C)c2ccc([N+](=O)[O-])cc2)cc1OC ZINC000066877956 946119292 /nfs/dbraw/zinc/11/92/92/946119292.db2.gz IXXDYMZSDIAINL-ZRVMKQEGSA-N 0 0 357.362 3.930 20 5 FHBDRN COc1cccc(-c2cc(C(=O)Nc3cccc([N+](=O)[O-])c3C)n[nH]2)c1 ZINC000151769481 946121766 /nfs/dbraw/zinc/12/17/66/946121766.db2.gz PVOGBVKSERZGEC-UHFFFAOYSA-N 0 0 352.350 3.554 20 5 FHBDRN C[C@@H](C1CC1)n1cc(NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)cn1 ZINC000186448894 946123012 /nfs/dbraw/zinc/12/30/12/946123012.db2.gz IXMRLNKARXGBNX-ZDUSSCGKSA-N 0 0 369.425 3.615 20 5 FHBDRN C[C@H]1OCCN(C(=O)c2ccccc2Sc2ccccc2[N+](=O)[O-])[C@H]1C ZINC000441058204 946153749 /nfs/dbraw/zinc/15/37/49/946153749.db2.gz ABGYIENDRIETAP-UONOGXRCSA-N 0 0 372.446 3.995 20 5 FHBDRN COC(=O)c1ccc(OC(=O)c2c(C)cc(C)c([N+](=O)[O-])c2C)cc1OC ZINC001271667323 946173909 /nfs/dbraw/zinc/17/39/09/946173909.db2.gz RJVZMLIBPNWNOU-UHFFFAOYSA-N 0 0 373.361 3.534 20 5 FHBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCCCC[C@H]2c2ccco2)c(F)c1 ZINC000522982727 946186455 /nfs/dbraw/zinc/18/64/55/946186455.db2.gz BOBDWQBUBQONJV-AWEZNQCLSA-N 0 0 368.386 3.633 20 5 FHBDRN COc1ccc(NC(=O)CN(C)[C@@H](C)c2ccc(C)cc2)c([N+](=O)[O-])c1 ZINC000052907253 946195687 /nfs/dbraw/zinc/19/56/87/946195687.db2.gz JMFPYYTXLNSPHS-AWEZNQCLSA-N 0 0 357.410 3.543 20 5 FHBDRN O=C(CCc1ccc(F)cc1)O[C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000759926728 946208876 /nfs/dbraw/zinc/20/88/76/946208876.db2.gz BQSQBNDXKMFIDC-HZPDHXFCSA-N 0 0 361.373 3.590 20 5 FHBDRN COc1ccc([C@H](C)CCNC(=O)c2ccc(OC)c([N+](=O)[O-])c2)cc1 ZINC000151876279 946213708 /nfs/dbraw/zinc/21/37/08/946213708.db2.gz OHMDQMZIUQBZIL-CYBMUJFWSA-N 0 0 358.394 3.536 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)NCC1(c2ccc(F)cc2)CC1 ZINC000109319714 946234977 /nfs/dbraw/zinc/23/49/77/946234977.db2.gz NYEIGSKMLMYJBQ-UHFFFAOYSA-N 0 0 367.380 3.537 20 5 FHBDRN Cc1c(NC(=O)NCc2ccc(OC3CCCC3)nc2)cccc1[N+](=O)[O-] ZINC000045930682 946246006 /nfs/dbraw/zinc/24/60/06/946246006.db2.gz ZUAJJQNREFTFBV-UHFFFAOYSA-N 0 0 370.409 3.941 20 5 FHBDRN CC(C)(C)n1cc(NC(=O)c2ccnc(-c3ccccc3)c2[N+](=O)[O-])cn1 ZINC001126102224 946248050 /nfs/dbraw/zinc/24/80/50/946248050.db2.gz QRBYXZXYGYJDPD-UHFFFAOYSA-N 0 0 365.393 3.861 20 5 FHBDRN CC(C)N(c1ccc(F)cc1)S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000109344254 946253395 /nfs/dbraw/zinc/25/33/95/946253395.db2.gz FYXMFNPESNFDKM-UHFFFAOYSA-N 0 0 372.805 3.991 20 5 FHBDRN COc1ccc(C2(NC(=O)c3cccc([N+](=O)[O-])c3OC)CCCC2)cc1 ZINC000475462208 946275788 /nfs/dbraw/zinc/27/57/88/946275788.db2.gz AJIUTRIOEHGSNS-UHFFFAOYSA-N 0 0 370.405 3.811 20 5 FHBDRN Cc1ccc([C@@H]2C[C@@H](C)N(C(=O)COc3ccc([N+](=O)[O-])c(C)c3)C2)cc1 ZINC001270835971 946278711 /nfs/dbraw/zinc/27/87/11/946278711.db2.gz QRJMKUFKOTVSGL-SJLPKXTDSA-N 0 0 368.433 3.995 20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])N[C@H]1CCCOc2ccc(F)cc21 ZINC000054283148 946285243 /nfs/dbraw/zinc/28/52/43/946285243.db2.gz GNXPYYMWFNCELU-HNNXBMFYSA-N 0 0 373.384 3.566 20 5 FHBDRN C[C@H]1C[C@H](c2cccnc2)N(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000186016929 946285572 /nfs/dbraw/zinc/28/55/72/946285572.db2.gz OXGHNNCXKDVGHC-YVEFUNNKSA-N 0 0 374.828 3.936 20 5 FHBDRN CC(C)Cn1c(-c2cccc([N+](=O)[O-])c2)nnc1N(C)CCC(F)(F)F ZINC000519657723 946286107 /nfs/dbraw/zinc/28/61/07/946286107.db2.gz ZLJRPJNUGNOSMV-UHFFFAOYSA-N 0 0 371.363 3.898 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(C)[C@@H]1CCCc2ccccc21 ZINC000018940724 946299836 /nfs/dbraw/zinc/29/98/36/946299836.db2.gz YKNVCRZVBIIZCS-QGZVFWFLSA-N 0 0 360.435 3.601 20 5 FHBDRN Cn1c(Cl)cnc1CSc1nc2cc3ccccc3cc2c(=O)n1C ZINC000018962642 946330043 /nfs/dbraw/zinc/33/00/43/946330043.db2.gz JSAGYCCCTAQDOV-UHFFFAOYSA-N 0 0 370.865 3.766 20 5 FHBDRN Cc1c(C(=O)N[C@H](C)c2nc(-c3ccc(F)cc3)no2)cccc1[N+](=O)[O-] ZINC000109554098 946332693 /nfs/dbraw/zinc/33/26/93/946332693.db2.gz IAMSTMGVGHPEPZ-LLVKDONJSA-N 0 0 370.340 3.583 20 5 FHBDRN Cc1ccc(-c2noc(-c3ccc(F)cc3[N+](=O)[O-])n2)c(N2CCCC2)n1 ZINC000545661735 946334423 /nfs/dbraw/zinc/33/44/23/946334423.db2.gz VGAJKEXDEUJANR-UHFFFAOYSA-N 0 0 369.356 3.755 20 5 FHBDRN O=C(N[C@@H](COc1ccccc1F)c1ccccc1)c1ccc([N+](=O)[O-])o1 ZINC000046119196 946347536 /nfs/dbraw/zinc/34/75/36/946347536.db2.gz MRBDTCDCHVUNTF-HNNXBMFYSA-N 0 0 370.336 3.877 20 5 FHBDRN COc1c(C(=O)Nc2ccc3[nH]c(C4CCC4)nc3c2)cccc1[N+](=O)[O-] ZINC000475474016 946351862 /nfs/dbraw/zinc/35/18/62/946351862.db2.gz ZCOAAMRCXYGMNX-UHFFFAOYSA-N 0 0 366.377 4.000 20 5 FHBDRN O=C(/C=C/c1ccc([N+](=O)[O-])cc1)Nc1cc(F)ccc1OC(F)F ZINC000121288696 946357198 /nfs/dbraw/zinc/35/71/98/946357198.db2.gz FIXLEZXCTGZPBW-FPYGCLRLSA-N 0 0 352.268 3.987 20 5 FHBDRN CSCc1cc(F)ccc1CNC(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000087053741 946358810 /nfs/dbraw/zinc/35/88/10/946358810.db2.gz XPHZGSJTXQWLSB-UHFFFAOYSA-N 0 0 363.414 3.596 20 5 FHBDRN C[C@H](NC(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1)[C@H]1CCOC1 ZINC000438497167 946364683 /nfs/dbraw/zinc/36/46/83/946364683.db2.gz ZVMIWAYRLYIERA-KBPBESRZSA-N 0 0 371.393 3.934 20 5 FHBDRN Cc1cccc(NC2CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)c1 ZINC000151890523 946372379 /nfs/dbraw/zinc/37/23/79/946372379.db2.gz DFSRNIQJDKKWQC-UHFFFAOYSA-N 0 0 357.385 3.759 20 5 FHBDRN Cc1nn([C@@H](C)C(=O)N[C@H](C)c2ccc3c(c2)CCCC3)c(C)c1[N+](=O)[O-] ZINC000111175322 946378053 /nfs/dbraw/zinc/37/80/53/946378053.db2.gz VNGHVUOICOZBHJ-DOMZBBRYSA-N 0 0 370.453 3.725 20 5 FHBDRN O=C(Nc1cc(-c2ccccc2)ns1)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000475482509 946391895 /nfs/dbraw/zinc/39/18/95/946391895.db2.gz XAUKQWWUULAXPD-UHFFFAOYSA-N 0 0 365.374 3.847 20 5 FHBDRN Cc1ccc(Cc2nnc(NC(=O)c3ccc(F)cc3[N+](=O)[O-])s2)cc1 ZINC000129490460 946398502 /nfs/dbraw/zinc/39/85/02/946398502.db2.gz YYKPKLIBRNDDCW-UHFFFAOYSA-N 0 0 372.381 3.737 20 5 FHBDRN O=C(NCCNc1ccccc1[N+](=O)[O-])Nc1ccccc1C(F)(F)F ZINC000043159428 946401300 /nfs/dbraw/zinc/40/13/00/946401300.db2.gz GATAUWYNFQEZHB-UHFFFAOYSA-N 0 0 368.315 3.847 20 5 FHBDRN COc1cc(C(=O)N[C@H](C)c2ccc(C)c(F)c2)c([N+](=O)[O-])cc1OC ZINC000088252766 946412806 /nfs/dbraw/zinc/41/28/06/946412806.db2.gz UBDQQUYVEROVAX-LLVKDONJSA-N 0 0 362.357 3.551 20 5 FHBDRN CCOc1ccc(C(=O)O[C@@H](c2ccccn2)C(F)(F)F)cc1[N+](=O)[O-] ZINC000159971657 946413008 /nfs/dbraw/zinc/41/30/08/946413008.db2.gz CBPSUKQRCHPTQA-AWEZNQCLSA-N 0 0 370.283 3.849 20 5 FHBDRN CN(Cc1ccccc1)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000047864348 946445848 /nfs/dbraw/zinc/44/58/48/946445848.db2.gz HFFUNCKWNRAPIA-UHFFFAOYSA-N 0 0 351.309 3.860 20 5 FHBDRN COc1c(C(=O)N[C@@H]2CCOc3c(Cl)cccc32)cccc1[N+](=O)[O-] ZINC000475124741 946445879 /nfs/dbraw/zinc/44/58/79/946445879.db2.gz ZODKMWUQZCPNRO-CYBMUJFWSA-N 0 0 362.769 3.510 20 5 FHBDRN CSc1cccc(C(=O)N[C@@H](C)c2cccc(NC(C)=O)c2)c1[N+](=O)[O-] ZINC000186078240 946446712 /nfs/dbraw/zinc/44/67/12/946446712.db2.gz JQGBVLVMLJMJJX-NSHDSACASA-N 0 0 373.434 3.766 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)Nc1cccc(OC(F)F)c1 ZINC000047907754 946449714 /nfs/dbraw/zinc/44/97/14/946449714.db2.gz VMWXDDVQUFGAGY-UHFFFAOYSA-N 0 0 351.309 3.860 20 5 FHBDRN CC[C@@H]1CN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)c2ccccc2O1 ZINC000441324758 946449968 /nfs/dbraw/zinc/44/99/68/946449968.db2.gz RDTGURDBAFMEEJ-OAHLLOKOSA-N 0 0 366.377 3.822 20 5 FHBDRN COc1c(C(=O)Nc2cccc(Br)c2)cccc1[N+](=O)[O-] ZINC000137551819 946455441 /nfs/dbraw/zinc/45/54/41/946455441.db2.gz NSCYOMYEPMHYHZ-UHFFFAOYSA-N 0 0 351.156 3.618 20 5 FHBDRN O=[N+]([O-])c1ccc(NCC2(O)Cc3ccccc3C2)c(C(F)(F)F)c1 ZINC000523088073 946484452 /nfs/dbraw/zinc/48/44/52/946484452.db2.gz QCRYBKJTHBDGSL-UHFFFAOYSA-N 0 0 352.312 3.555 20 5 FHBDRN Cc1ccoc1C(=O)NCCCNc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000523088412 946486065 /nfs/dbraw/zinc/48/60/65/946486065.db2.gz FYKMTAXSDNINNZ-UHFFFAOYSA-N 0 0 371.315 3.747 20 5 FHBDRN COC(=O)[C@H](NCc1ccc(-c2cccc([N+](=O)[O-])c2)o1)c1cccs1 ZINC000475144733 946493857 /nfs/dbraw/zinc/49/38/57/946493857.db2.gz VAOTYCKYRCPTNY-QGZVFWFLSA-N 0 0 372.402 3.920 20 5 FHBDRN CCNC(=O)c1ccc(NC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000048117198 946503296 /nfs/dbraw/zinc/50/32/96/946503296.db2.gz OCLLEDAPJXKMNX-ZDUSSCGKSA-N 0 0 370.409 3.536 20 5 FHBDRN CSc1cccc(C(=O)NC[C@H]2CCCO[C@@H]2C(C)(C)C)c1[N+](=O)[O-] ZINC000186524231 946504229 /nfs/dbraw/zinc/50/42/29/946504229.db2.gz OZHHTTQXFYCDDI-WBMJQRKESA-N 0 0 366.483 3.888 20 5 FHBDRN CCOc1ccc(CNC(=O)Nc2cccc([N+](=O)[O-])c2C)cc1OC ZINC000043347199 946505936 /nfs/dbraw/zinc/50/59/36/946505936.db2.gz HYENQVAQJACVHW-UHFFFAOYSA-N 0 0 359.382 3.632 20 5 FHBDRN CSc1cccc(NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2C)c1C ZINC000441363559 946509315 /nfs/dbraw/zinc/50/93/15/946509315.db2.gz XKVGTXGECXSJCZ-UHFFFAOYSA-N 0 0 359.407 3.511 20 5 FHBDRN CC[C@H](C)[C@@H](O)CNC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 ZINC000475151812 946509698 /nfs/dbraw/zinc/50/96/98/946509698.db2.gz ZXYRRUURUIDCCJ-GUYCJALGSA-N 0 0 358.394 3.524 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N(C)[C@H](C)[C@H]1Cc2ccccc2O1 ZINC000127197283 946524429 /nfs/dbraw/zinc/52/44/29/946524429.db2.gz YUUBOWYZIVGWCI-FZKQIMNGSA-N 0 0 355.394 3.759 20 5 FHBDRN COC(=O)[C@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)c1cccs1 ZINC000475159922 946529332 /nfs/dbraw/zinc/52/93/32/946529332.db2.gz SUMDRUZBKHJRGF-QGZVFWFLSA-N 0 0 372.402 3.920 20 5 FHBDRN O=C(CSC(F)F)N(CC1CC1)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000839267314 946530304 /nfs/dbraw/zinc/53/03/04/946530304.db2.gz PBNMCAAEQKEMNC-UHFFFAOYSA-N 0 0 350.774 3.947 20 5 FHBDRN C[C@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccccc1C(F)(F)F ZINC000511895111 946535821 /nfs/dbraw/zinc/53/58/21/946535821.db2.gz VLVFCLLKVCTUHM-JTQLQIEISA-N 0 0 374.340 3.653 20 5 FHBDRN C[C@H](CNC(=O)N1CC(C)(C)[C@@H]1c1cccnc1)c1ccccc1[N+](=O)[O-] ZINC000897058025 946544894 /nfs/dbraw/zinc/54/48/94/946544894.db2.gz LOHTZPZGDPDHIW-KDOFPFPSSA-N 0 0 368.437 3.886 20 5 FHBDRN Cc1csc([C@H]2CCN(C(=O)NC[C@H](C)c3ccccc3[N+](=O)[O-])C2)n1 ZINC000897049987 946549199 /nfs/dbraw/zinc/54/91/99/946549199.db2.gz LWYYEILBGDATGB-JSGCOSHPSA-N 0 0 374.466 3.662 20 5 FHBDRN Cc1cncc([C@@H]2CCCN2C(=O)NC[C@@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000897050878 946549541 /nfs/dbraw/zinc/54/95/41/946549541.db2.gz VTSKZUQEIDAHSQ-QAPCUYQASA-N 0 0 368.437 3.948 20 5 FHBDRN CC(=O)Nc1ccc(Br)cc1NCc1ccccc1[N+](=O)[O-] ZINC000475177234 946551768 /nfs/dbraw/zinc/55/17/68/946551768.db2.gz YNHCIJKGEWQKPF-UHFFFAOYSA-N 0 0 364.199 3.928 20 5 FHBDRN CCc1ccc([C@H](NC[C@](C)(O)C(F)(F)F)c2ccc([N+](=O)[O-])cc2)o1 ZINC000544380002 946554350 /nfs/dbraw/zinc/55/43/50/946554350.db2.gz ASSSQOFNNAWBIR-CVEARBPZSA-N 0 0 372.343 3.743 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NC[C@H]2CCCO[C@H]2C(C)(C)C)c1 ZINC000520419323 946562900 /nfs/dbraw/zinc/56/29/00/946562900.db2.gz ZVWOMKBLQRVBFY-CXAGYDPISA-N 0 0 364.442 3.565 20 5 FHBDRN CCCCn1cc(C(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)c(C)n1 ZINC000186180994 946585204 /nfs/dbraw/zinc/58/52/04/946585204.db2.gz XMYCIVOJLXYICC-UHFFFAOYSA-N 0 0 356.426 3.705 20 5 FHBDRN CCN(Cc1c(F)cccc1F)C(=O)c1cccc([N+](=O)[O-])c1OC ZINC000475523073 946587664 /nfs/dbraw/zinc/58/76/64/946587664.db2.gz DNOKVAKSYZPBME-UHFFFAOYSA-N 0 0 350.321 3.544 20 5 FHBDRN Cc1c(C(=O)N2CCO[C@@H](c3cccc(Cl)c3)C2)cccc1[N+](=O)[O-] ZINC000186193649 946589949 /nfs/dbraw/zinc/58/99/49/946589949.db2.gz QONIESYOYIWGNC-QGZVFWFLSA-N 0 0 360.797 3.770 20 5 FHBDRN CC[C@@H](C)[C@@](C)(O)CNC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000475188497 946591447 /nfs/dbraw/zinc/59/14/47/946591447.db2.gz CBUILEBDZFWQGD-OTYXRUKQSA-N 0 0 363.336 3.532 20 5 FHBDRN COc1c(C)cc(CN(C)C(=O)c2cccc([N+](=O)[O-])c2OC)cc1C ZINC000475529736 946591691 /nfs/dbraw/zinc/59/16/91/946591691.db2.gz MBRZSQBCFCQGSY-UHFFFAOYSA-N 0 0 358.394 3.501 20 5 FHBDRN CC1(CNC(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CCOCC1 ZINC000475190362 946598494 /nfs/dbraw/zinc/59/84/94/946598494.db2.gz MYUUSWCQRYFALY-UHFFFAOYSA-N 0 0 361.320 3.552 20 5 FHBDRN COc1ccc(Br)c(CNCc2ccccc2[N+](=O)[O-])c1 ZINC000112017728 946602890 /nfs/dbraw/zinc/60/28/90/946602890.db2.gz XDDRLHHJXSYZLK-UHFFFAOYSA-N 0 0 351.200 3.656 20 5 FHBDRN CCCCOc1ccc(-c2nc(Cc3ccc([N+](=O)[O-])cn3)no2)cc1 ZINC000545776829 946611195 /nfs/dbraw/zinc/61/11/95/946611195.db2.gz PFJCFSJDBYAEEN-UHFFFAOYSA-N 0 0 354.366 3.810 20 5 FHBDRN CO[C@H](c1noc(-c2cc([N+](=O)[O-])cnc2C)n1)c1cccc(Cl)c1 ZINC000545775907 946619495 /nfs/dbraw/zinc/61/94/95/946619495.db2.gz ZWAHKGQLEBHAAY-AWEZNQCLSA-N 0 0 360.757 3.737 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]cc(Cc3noc(Cc4n[nH]c5ccccc54)n3)c2c1 ZINC000545780098 946621167 /nfs/dbraw/zinc/62/11/67/946621167.db2.gz IXIKLBNJIGXWGT-UHFFFAOYSA-N 0 0 374.360 3.517 20 5 FHBDRN O=C(CC[S@@](=O)c1ccc(F)c(Cl)c1)Nc1ccccc1[N+](=O)[O-] ZINC000507740937 946621270 /nfs/dbraw/zinc/62/12/70/946621270.db2.gz JNQBPWZDEIHMPE-XMMPIXPASA-N 0 0 370.789 3.524 20 5 FHBDRN Nc1c(C(=O)NCCCOc2ccc3ccccc3c2)cccc1[N+](=O)[O-] ZINC000475544736 946628556 /nfs/dbraw/zinc/62/85/56/946628556.db2.gz WKXGHTMRWUQLBH-UHFFFAOYSA-N 0 0 365.389 3.529 20 5 FHBDRN CCS[C@@H]1CCCCN(C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)C1 ZINC000112038081 946630559 /nfs/dbraw/zinc/63/05/59/946630559.db2.gz ZTOWAWVDCZJZNJ-QGZVFWFLSA-N 0 0 374.466 3.528 20 5 FHBDRN Cc1c(F)ccc([N+](=O)[O-])c1C(=O)NCCOc1ccc(C(C)C)cc1 ZINC000843767561 946644970 /nfs/dbraw/zinc/64/49/70/946644970.db2.gz JNMYZAPYUCAARK-UHFFFAOYSA-N 0 0 360.385 3.975 20 5 FHBDRN O=C(c1ccccc1[N+](=O)[O-])N1CCC(Cc2cc(F)cc(F)c2)CC1 ZINC000456717490 946648491 /nfs/dbraw/zinc/64/84/91/946648491.db2.gz KMVHXWZYTYVIQD-UHFFFAOYSA-N 0 0 360.360 3.968 20 5 FHBDRN CCCC(=O)Nc1cccc(CNC(=O)c2c(C)c(F)ccc2[N+](=O)[O-])c1 ZINC000843767594 946654221 /nfs/dbraw/zinc/65/42/21/946654221.db2.gz KSFXQNXBHIPQNP-UHFFFAOYSA-N 0 0 373.384 3.711 20 5 FHBDRN COc1ccc(Nc2ccc3ncccc3c2[N+](=O)[O-])cc1NC(C)=O ZINC000112073752 946655754 /nfs/dbraw/zinc/65/57/54/946655754.db2.gz WPLXWOCKTQDALU-UHFFFAOYSA-N 0 0 352.350 3.854 20 5 FHBDRN COc1cccc(C2(C(=O)Nc3ccc([N+](=O)[O-])c(C)n3)CCCC2)c1 ZINC000134016508 946659502 /nfs/dbraw/zinc/65/95/02/946659502.db2.gz QJHZZCDGPAKHGV-UHFFFAOYSA-N 0 0 355.394 3.757 20 5 FHBDRN Cc1ccc(NCCCNC(=O)N(C)[C@H](C)c2ccncc2)c([N+](=O)[O-])c1 ZINC000121399204 946660513 /nfs/dbraw/zinc/66/05/13/946660513.db2.gz JCCXMTYPPOPDIC-OAHLLOKOSA-N 0 0 371.441 3.503 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NC1(c2ccc3c(c2)OCO3)CC1 ZINC000475567180 946668226 /nfs/dbraw/zinc/66/82/26/946668226.db2.gz QVASBSQCRVAIHT-UHFFFAOYSA-N 0 0 369.377 3.751 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)N[C@H]2C[C@H]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000428360094 946674276 /nfs/dbraw/zinc/67/42/76/946674276.db2.gz IENQCFQCBLKILJ-QGTPRVQTSA-N 0 0 353.422 3.895 20 5 FHBDRN Cc1ccc(N2CCCN(C(=O)c3cc(F)cc(C)c3[N+](=O)[O-])CC2)cc1 ZINC000125567803 946675701 /nfs/dbraw/zinc/67/57/01/946675701.db2.gz CHKYHNHHVAHWJR-UHFFFAOYSA-N 0 0 371.412 3.703 20 5 FHBDRN O=[N+]([O-])c1ccc2c(ccn2Cc2nc([C@@H]3CCOC4(CCC4)C3)no2)c1 ZINC000897103423 946682315 /nfs/dbraw/zinc/68/23/15/946682315.db2.gz IRQVALGFLFEQEJ-CQSZACIVSA-N 0 0 368.393 3.798 20 5 FHBDRN CO[C@H]1CCCC[C@H]1NC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000475195955 946682846 /nfs/dbraw/zinc/68/28/46/946682846.db2.gz ORTUJJGAWIVBJB-YPMHNXCESA-N 0 0 361.320 3.693 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)NCc2ccc(C(F)(F)F)cc2)c1 ZINC000067542416 946709032 /nfs/dbraw/zinc/70/90/32/946709032.db2.gz LVAUPUCEOUPCFV-UHFFFAOYSA-N 0 0 354.284 3.552 20 5 FHBDRN CCO[C@H]1C[C@H](NC(=O)c2cccc(SC)c2[N+](=O)[O-])C12CCCC2 ZINC000186617932 946718802 /nfs/dbraw/zinc/71/88/02/946718802.db2.gz DPSBWFSKCMUNML-GJZGRUSLSA-N 0 0 364.467 3.784 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H](C)CCc1cccn1C ZINC000074744802 946734676 /nfs/dbraw/zinc/73/46/76/946734676.db2.gz GQGZTQIFSSRALD-INIZCTEOSA-N 0 0 372.469 3.875 20 5 FHBDRN O=C(c1cccnc1SC(F)(F)F)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000067543704 946738672 /nfs/dbraw/zinc/73/86/72/946738672.db2.gz XVCRBFJQFYZZPK-UHFFFAOYSA-N 0 0 369.324 3.805 20 5 FHBDRN COC(=O)c1cc(C)nc(N[C@@H]2CCC[C@@H](C(F)(F)F)C2)c1[N+](=O)[O-] ZINC000585702610 946740011 /nfs/dbraw/zinc/74/00/11/946740011.db2.gz SPBYYFBIKVDZAL-NXEZZACHSA-N 0 0 361.320 3.618 20 5 FHBDRN O=[N+]([O-])c1ccc(CN2CCSC[C@H]2c2nccs2)c(Cl)c1 ZINC000186639985 946768890 /nfs/dbraw/zinc/76/88/90/946768890.db2.gz AHCQPMDIHYGBDJ-ZDUSSCGKSA-N 0 0 355.872 3.995 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)c1cn(C)c2ccccc12 ZINC000186641698 946769752 /nfs/dbraw/zinc/76/97/52/946769752.db2.gz UPBZXCFLUNACMX-GFCCVEGCSA-N 0 0 353.378 3.837 20 5 FHBDRN CS(=O)(=O)CCCNc1cc([N+](=O)[O-])ccc1Sc1cccs1 ZINC000151997364 946770585 /nfs/dbraw/zinc/77/05/85/946770585.db2.gz RMPBWVCQVZEOBA-UHFFFAOYSA-N 0 0 372.493 3.654 20 5 FHBDRN CCO[C@@H](CCNc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1)C(C)C ZINC000074772247 946775261 /nfs/dbraw/zinc/77/52/61/946775261.db2.gz GAJXTQBUZLQAIP-SFHVURJKSA-N 0 0 363.458 3.694 20 5 FHBDRN C[C@@H](NC(=O)Nc1cccc([N+](=O)[O-])c1)c1ccc(Br)cn1 ZINC000475250682 946778339 /nfs/dbraw/zinc/77/83/39/946778339.db2.gz SKBRADDMGATKDX-SECBINFHSA-N 0 0 365.187 3.635 20 5 FHBDRN CCOC(=O)c1ccnc(Nc2ccc(CCSC)cc2)c1[N+](=O)[O-] ZINC000523112514 946782169 /nfs/dbraw/zinc/78/21/69/946782169.db2.gz JSLPOZQUBXCFRW-UHFFFAOYSA-N 0 0 361.423 3.816 20 5 FHBDRN Cc1cn(-c2ccccc2)nc1C(=O)Nc1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000186298296 946794713 /nfs/dbraw/zinc/79/47/13/946794713.db2.gz BFZDLNOABORGEE-UHFFFAOYSA-N 0 0 373.372 3.889 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CC[C@H](C)C[C@@H]2C)cc1OC ZINC000112837033 946799801 /nfs/dbraw/zinc/79/98/01/946799801.db2.gz BEHZVFIXJOMGII-SGMGOOAPSA-N 0 0 350.415 3.557 20 5 FHBDRN CCCOc1nc(C(=O)Nc2ccc([N+](=O)[O-])c(C)n2)cc2ccccc21 ZINC000475294531 946812978 /nfs/dbraw/zinc/81/29/78/946812978.db2.gz NLKBOJZNWMPJDU-UHFFFAOYSA-N 0 0 366.377 3.888 20 5 FHBDRN Cc1c(Br)cc(C(=O)N2C[C@H](C)S[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000125584734 946820825 /nfs/dbraw/zinc/82/08/25/946820825.db2.gz SKNUEVOFKRJHHH-IUCAKERBSA-N 0 0 373.272 3.632 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NCC(=O)Nc1ccccc1C(C)(C)C ZINC000025908164 946822764 /nfs/dbraw/zinc/82/27/64/946822764.db2.gz GZTUHEKZBPKKMB-UHFFFAOYSA-N 0 0 357.410 3.952 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)NCCc2cccc3ccccc32)c1 ZINC000067548430 946829313 /nfs/dbraw/zinc/82/93/13/946829313.db2.gz AKHHEISQOOPSMO-UHFFFAOYSA-N 0 0 350.374 3.729 20 5 FHBDRN C[C@H]1CCN(C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)c2c(O)cccc21 ZINC000186309348 946841428 /nfs/dbraw/zinc/84/14/28/946841428.db2.gz OJHCCFPBPCDDPJ-LBPRGKRZSA-N 0 0 365.389 3.865 20 5 FHBDRN O=C(C[C@H]1OCCc2ccccc21)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186312194 946844600 /nfs/dbraw/zinc/84/46/00/946844600.db2.gz JLSJTXCMECUDPB-QGZVFWFLSA-N 0 0 360.797 3.569 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)c1cc(F)c(F)c(F)c1F ZINC000186313885 946865297 /nfs/dbraw/zinc/86/52/97/946865297.db2.gz VUHBWOPEXYRUAK-UHFFFAOYSA-N 0 0 362.666 3.735 20 5 FHBDRN CN(C)c1ccccc1NCc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000092137798 946865708 /nfs/dbraw/zinc/86/57/08/946865708.db2.gz KFUWVSXRCDCSFA-UHFFFAOYSA-N 0 0 351.410 3.673 20 5 FHBDRN CCc1n[nH]c(C(=O)NC(C)(C)c2ccc(C(C)(C)C)cc2)c1[N+](=O)[O-] ZINC000444337322 946869485 /nfs/dbraw/zinc/86/94/85/946869485.db2.gz GEEDXGWQXUCHFK-UHFFFAOYSA-N 0 0 358.442 3.843 20 5 FHBDRN Cc1nc(NC(=O)c2cc(-c3ccccc3Cl)on2)ccc1[N+](=O)[O-] ZINC000475316179 946880094 /nfs/dbraw/zinc/88/00/94/946880094.db2.gz KWWFIEPLTYYFKC-UHFFFAOYSA-N 0 0 358.741 3.859 20 5 FHBDRN COc1cc(C(=O)Nc2cc3[nH]ccc3cc2C)cc([N+](=O)[O-])c1OC ZINC000444452003 946883285 /nfs/dbraw/zinc/88/32/85/946883285.db2.gz XKDDEOYNVQKOPR-UHFFFAOYSA-N 0 0 355.350 3.654 20 5 FHBDRN Cc1c(F)ccc([N+](=O)[O-])c1C(=O)Nc1ccc(OC[C@H]2CCCO2)cc1 ZINC000843769487 946884933 /nfs/dbraw/zinc/88/49/33/946884933.db2.gz ZDLZKUYKEJGCGN-OAHLLOKOSA-N 0 0 374.368 3.852 20 5 FHBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)c1[nH]c2ccc(F)cc2c1Cl ZINC000536278433 946885470 /nfs/dbraw/zinc/88/54/70/946885470.db2.gz OZCONPTUCMXJPK-UHFFFAOYSA-N 0 0 361.760 3.841 20 5 FHBDRN O=C(Nc1ccncc1Br)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000147516067 946901110 /nfs/dbraw/zinc/90/11/10/946901110.db2.gz QVMAGDDLZYWVCW-UHFFFAOYSA-N 0 0 356.563 3.658 20 5 FHBDRN C/C(=C\c1ccc(Br)o1)C(=O)NCc1cccc([N+](=O)[O-])c1 ZINC001126173088 946909474 /nfs/dbraw/zinc/90/94/74/946909474.db2.gz UHLQDPSSMZTFOM-JXMROGBWSA-N 0 0 365.183 3.670 20 5 FHBDRN O=C(NCCCO[C@@H]1CCCc2ccccc21)c1c(F)cccc1[N+](=O)[O-] ZINC001126175742 946913006 /nfs/dbraw/zinc/91/30/06/946913006.db2.gz FAJCOZRROALZIF-GOSISDBHSA-N 0 0 372.396 3.948 20 5 FHBDRN C[C@H](NC(=O)N1CCC[C@@H](c2nccs2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000458885645 946915740 /nfs/dbraw/zinc/91/57/40/946915740.db2.gz GUPZEVLMDCWEJM-GXTWGEPZSA-N 0 0 360.439 3.702 20 5 FHBDRN COc1cc(Nc2ncc(Br)cc2[N+](=O)[O-])cc(OC)c1 ZINC000048759837 946916244 /nfs/dbraw/zinc/91/62/44/946916244.db2.gz BALFHAZPAGWENT-UHFFFAOYSA-N 0 0 354.160 3.513 20 5 FHBDRN CC(=O)Nc1ccc(Sc2ncc(Br)cc2[N+](=O)[O-])cc1 ZINC000048760074 946916741 /nfs/dbraw/zinc/91/67/41/946916741.db2.gz OIGVSRSMUBQZIB-UHFFFAOYSA-N 0 0 368.212 3.862 20 5 FHBDRN Cc1cc(OCC(=O)Nc2cnn(CC(C)C)c2C(C)C)ccc1[N+](=O)[O-] ZINC000432244639 946918963 /nfs/dbraw/zinc/91/89/63/946918963.db2.gz FSLREDGELDMALJ-UHFFFAOYSA-N 0 0 374.441 3.897 20 5 FHBDRN Cc1c(F)ccc([N+](=O)[O-])c1C(=O)Nc1cccc(C(=O)NC(C)(C)C)c1 ZINC000843770035 946923795 /nfs/dbraw/zinc/92/37/95/946923795.db2.gz OUNSFWZXHWJLRS-UHFFFAOYSA-N 0 0 373.384 3.823 20 5 FHBDRN CC[C@@H](NC(=O)Cc1ccc(OC)c([N+](=O)[O-])c1)c1ccc(F)cc1F ZINC000523147217 946924596 /nfs/dbraw/zinc/92/45/96/946924596.db2.gz VIAIQMIXMOZHRP-OAHLLOKOSA-N 0 0 364.348 3.692 20 5 FHBDRN C[C@H](NC(=O)N(Cc1ccccc1)CC(C)(C)O)c1ccc([N+](=O)[O-])cc1 ZINC000458887573 946937482 /nfs/dbraw/zinc/93/74/82/946937482.db2.gz KCMYJMOGPNVHEK-HNNXBMFYSA-N 0 0 371.437 3.639 20 5 FHBDRN C[C@H](NC(=O)N1CCc2c3ccccc3[nH]c2C1)c1ccc([N+](=O)[O-])cc1 ZINC000458887594 946937628 /nfs/dbraw/zinc/93/76/28/946937628.db2.gz KKHQAUBUGGGART-ZDUSSCGKSA-N 0 0 364.405 3.905 20 5 FHBDRN COc1ccc(CC(C)(C)NC(=O)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000458890440 946942856 /nfs/dbraw/zinc/94/28/56/946942856.db2.gz PRZTXXPOOWVIHF-AWEZNQCLSA-N 0 0 371.437 3.985 20 5 FHBDRN CNC(=O)c1ccc(NCc2ccccc2N2CCCCC2)c([N+](=O)[O-])c1 ZINC000302017123 946942984 /nfs/dbraw/zinc/94/29/84/946942984.db2.gz CLLGWILEHXZDFO-UHFFFAOYSA-N 0 0 368.437 3.557 20 5 FHBDRN Cc1c(NC(=O)C(=O)N(C)[C@H](c2ccccc2)C(C)C)cccc1[N+](=O)[O-] ZINC000112754717 946944848 /nfs/dbraw/zinc/94/48/48/946944848.db2.gz MUNRVQLDWUCRQW-SFHVURJKSA-N 0 0 369.421 3.697 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1C[C@H]1c1ccc(F)cc1F ZINC000186334673 946948753 /nfs/dbraw/zinc/94/87/53/946948753.db2.gz YFUZMJVQLAUTLX-UONOGXRCSA-N 0 0 366.751 3.946 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@H]1C[C@@H]1c1ccc(F)cc1F ZINC000186334657 946948887 /nfs/dbraw/zinc/94/88/87/946948887.db2.gz YFUZMJVQLAUTLX-KGLIPLIRSA-N 0 0 366.751 3.946 20 5 FHBDRN Cc1nn(Cc2ccc(OCc3ccccc3F)nc2)c(C)c1[N+](=O)[O-] ZINC000186335443 946949056 /nfs/dbraw/zinc/94/90/56/946949056.db2.gz LCPRLGVDQWSNKE-UHFFFAOYSA-N 0 0 356.357 3.570 20 5 FHBDRN O=C(CCCc1ccccn1)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000112791211 946952919 /nfs/dbraw/zinc/95/29/19/946952919.db2.gz PCTCZOCOXDNMNK-UHFFFAOYSA-N 0 0 351.309 3.553 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CC[C@H](C)C[C@H]2C)cc1SC ZINC000112833741 946958304 /nfs/dbraw/zinc/95/83/04/946958304.db2.gz CUPXFTICYJAYFK-DMDPSCGWSA-N 0 0 352.456 3.880 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N1CCC(Oc2ccc(F)cc2)CC1 ZINC000151792727 946961190 /nfs/dbraw/zinc/96/11/90/946961190.db2.gz RDEZDDZITYBNIR-UHFFFAOYSA-N 0 0 372.396 3.737 20 5 FHBDRN CCC1(CC)CCC(NC(=O)C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000475371339 946973854 /nfs/dbraw/zinc/97/38/54/946973854.db2.gz UTXPFHLKQSQPIU-UHFFFAOYSA-N 0 0 361.442 3.707 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N1CC2(CCC2)c2c1cccc2F ZINC000523177616 946984533 /nfs/dbraw/zinc/98/45/33/946984533.db2.gz COZBULAFUAFERR-UHFFFAOYSA-N 0 0 356.353 3.581 20 5 FHBDRN C[C@H](OCCCNC(=O)CSc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000025967766 946997684 /nfs/dbraw/zinc/99/76/84/946997684.db2.gz VQBBZUPJVOBEBQ-HNNXBMFYSA-N 0 0 374.462 3.971 20 5 FHBDRN COc1ccc([C@H](C)CCNC(=O)c2cc([N+](=O)[O-])c(F)cc2C)cc1 ZINC001126181572 946998815 /nfs/dbraw/zinc/99/88/15/946998815.db2.gz KUJSIYLSNRGOIJ-GFCCVEGCSA-N 0 0 360.385 3.975 20 5 FHBDRN Cc1nn(CCC(=O)N(C)C2CCC(C(C)(C)C)CC2)c(C)c1[N+](=O)[O-] ZINC000523223065 947005145 /nfs/dbraw/zinc/00/51/45/947005145.db2.gz JLEMUNGICWSDOA-UHFFFAOYSA-N 0 0 364.490 3.862 20 5 FHBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N2CC3(CCC3)[C@@H]2c2ccccc2)c1 ZINC000432260172 947005258 /nfs/dbraw/zinc/00/52/58/947005258.db2.gz SMPDDMGIEXYGTJ-KRWDZBQOSA-N 0 0 358.419 3.511 20 5 FHBDRN CCc1ccc(N(C(C)=O)c2nc(Cn3cnc([N+](=O)[O-])c3)cs2)cc1 ZINC000026123194 947009839 /nfs/dbraw/zinc/00/98/39/947009839.db2.gz XFHOJYMFUISXLL-UHFFFAOYSA-N 0 0 371.422 3.543 20 5 FHBDRN Cc1cc(C(=O)N2C[C@H](C)O[C@@H](c3ccc(F)cc3)C2)ccc1[N+](=O)[O-] ZINC000152013531 947022457 /nfs/dbraw/zinc/02/24/57/947022457.db2.gz DJAZXFQIZSNLSU-SCLBCKFNSA-N 0 0 358.369 3.645 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(O)cc1CCOC ZINC000444587804 947028577 /nfs/dbraw/zinc/02/85/77/947028577.db2.gz CLULZWOCWQIUDJ-OAHLLOKOSA-N 0 0 372.421 3.697 20 5 FHBDRN C[C@H](Cc1cccc(F)c1)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186352881 947029569 /nfs/dbraw/zinc/02/95/69/947029569.db2.gz NSDUVEVNDKNEMB-LLVKDONJSA-N 0 0 350.777 3.882 20 5 FHBDRN O=C(NCCCOC1CCCC1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000121280994 947042716 /nfs/dbraw/zinc/04/27/16/947042716.db2.gz QFGMSCVYCNVBSL-UHFFFAOYSA-N 0 0 361.442 3.618 20 5 FHBDRN O=C(Nc1cccc2cnccc21)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000031273516 947044923 /nfs/dbraw/zinc/04/49/23/947044923.db2.gz DKORBXPBVDIMME-UHFFFAOYSA-N 0 0 359.345 3.581 20 5 FHBDRN COC(=O)c1ccc(CNc2ccc([N+](=O)[O-])cc2Cl)nc1C1CC1 ZINC000302038595 947047582 /nfs/dbraw/zinc/04/75/82/947047582.db2.gz QNAZWTKMUZSOKI-UHFFFAOYSA-N 0 0 361.785 3.919 20 5 FHBDRN Cc1ccc(CCCCC(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000444646331 947067713 /nfs/dbraw/zinc/06/77/13/947067713.db2.gz SGLIVIGLYYUFAD-UHFFFAOYSA-N 0 0 366.421 3.809 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]c(CN3CC[C@@H](COCc4ccccc4)C3)nc2c1 ZINC000444650136 947071042 /nfs/dbraw/zinc/07/10/42/947071042.db2.gz NMUVDDQCZXMFAS-MRXNPFEDSA-N 0 0 366.421 3.510 20 5 FHBDRN Cc1c(C(=O)NCc2ccc(OC(F)(F)F)cc2)cccc1[N+](=O)[O-] ZINC000021121164 947075031 /nfs/dbraw/zinc/07/50/31/947075031.db2.gz HNJASFYTWJFYOE-UHFFFAOYSA-N 0 0 354.284 3.732 20 5 FHBDRN CN(Cc1c(F)cccc1F)C(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000511941957 947075133 /nfs/dbraw/zinc/07/51/33/947075133.db2.gz VBDMQJAKCMDDDU-UHFFFAOYSA-N 0 0 352.362 3.624 20 5 FHBDRN O=C(C[C@H]1CCCN1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1cccs1 ZINC000444660011 947077390 /nfs/dbraw/zinc/07/73/90/947077390.db2.gz FCTNAZIHCZURQN-GFCCVEGCSA-N 0 0 370.434 3.770 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]c(CN3CCO[C@H](c4cccc(Cl)c4)C3)nc2c1 ZINC000444675158 947100284 /nfs/dbraw/zinc/10/02/84/947100284.db2.gz QTDLWRXUKPFVEP-KRWDZBQOSA-N 0 0 372.812 3.698 20 5 FHBDRN CC[C@H]1CN(c2ccccc2)CCN1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444677956 947101386 /nfs/dbraw/zinc/10/13/86/947101386.db2.gz XMMQGCFXASZCLK-HNNXBMFYSA-N 0 0 365.437 3.572 20 5 FHBDRN Cc1cc(C)cc(CN(C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c1 ZINC000444712373 947140702 /nfs/dbraw/zinc/14/07/02/947140702.db2.gz ZEKWDBHCOZGJAO-UHFFFAOYSA-N 0 0 352.394 3.894 20 5 FHBDRN CC(C)[C@@H]1CCCN(C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C1 ZINC000444362147 947173477 /nfs/dbraw/zinc/17/34/77/947173477.db2.gz JCENDJFMMHEGTQ-QGZVFWFLSA-N 0 0 359.470 3.706 20 5 FHBDRN COc1cccc(C(=O)Nc2ccc3cn(C(C)C)nc3c2)c1[N+](=O)[O-] ZINC000444800092 947217394 /nfs/dbraw/zinc/21/73/94/947217394.db2.gz JZSJNVKYHINRPT-UHFFFAOYSA-N 0 0 354.366 3.786 20 5 FHBDRN Cc1ccc(C[C@@H](C)N(C)C(=O)CCOc2ccccc2[N+](=O)[O-])cc1 ZINC000523406903 947217408 /nfs/dbraw/zinc/21/74/08/947217408.db2.gz YPXNKRAUUBURBY-MRXNPFEDSA-N 0 0 356.422 3.762 20 5 FHBDRN C[C@H](CC1CCCCC1)NS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC001211683493 947217451 /nfs/dbraw/zinc/21/74/51/947217451.db2.gz GLJQIUDXCAQARU-LLVKDONJSA-N 0 0 360.863 3.885 20 5 FHBDRN Cc1c(C(=O)Oc2ccc3c(c2)C(=O)CC(C)(C)O3)cccc1[N+](=O)[O-] ZINC001271482141 947227751 /nfs/dbraw/zinc/22/77/51/947227751.db2.gz UARHOTDGXPPERR-UHFFFAOYSA-N 0 0 355.346 3.866 20 5 FHBDRN CCOC(=O)c1csc(CCNc2c(C)cc([N+](=O)[O-])cc2Cl)n1 ZINC000444839884 947273870 /nfs/dbraw/zinc/27/38/70/947273870.db2.gz SEFHXBODSHVNOU-UHFFFAOYSA-N 0 0 369.830 3.844 20 5 FHBDRN CO[C@H](CNC(=O)c1cccc2c(=O)c3ccccc3[nH]c12)c1ccccc1 ZINC000444843613 947277765 /nfs/dbraw/zinc/27/77/65/947277765.db2.gz BAEVNNHIBDDTHE-HXUWFJFHSA-N 0 0 372.424 3.799 20 5 FHBDRN CCCc1ccccc1NC(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444855227 947282229 /nfs/dbraw/zinc/28/22/29/947282229.db2.gz XUPRSLGXYGYVNM-UHFFFAOYSA-N 0 0 353.382 3.745 20 5 FHBDRN Cc1cc([C@@H](C)NC(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)c(C)s1 ZINC000444855380 947282524 /nfs/dbraw/zinc/28/25/24/947282524.db2.gz YBQNBULCNVSYNV-SNVBAGLBSA-N 0 0 373.438 3.710 20 5 FHBDRN Cc1cccc(OCCC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)c1 ZINC000523498932 947305448 /nfs/dbraw/zinc/30/54/48/947305448.db2.gz LGWIAVQSEAAEDI-UHFFFAOYSA-N 0 0 356.422 3.811 20 5 FHBDRN CC(C)COc1ccc(NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)cn1 ZINC000523491470 947309237 /nfs/dbraw/zinc/30/92/37/947309237.db2.gz RKTJIBJIAMISLX-UHFFFAOYSA-N 0 0 357.410 3.941 20 5 FHBDRN CCc1ccccc1OCC(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000523496396 947314987 /nfs/dbraw/zinc/31/49/87/947314987.db2.gz VFWXVPWQCUWHAI-UHFFFAOYSA-N 0 0 356.422 3.675 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@@H](C)COCc1ccccc1 ZINC000444897783 947319786 /nfs/dbraw/zinc/31/97/86/947319786.db2.gz FUVPFBPFPSTYTD-CQSZACIVSA-N 0 0 373.409 3.578 20 5 FHBDRN Cc1cc(C(=O)Nc2ccc(C(=O)N(C)C)c(Cl)c2)cc([N+](=O)[O-])c1 ZINC000148379958 947325177 /nfs/dbraw/zinc/32/51/77/947325177.db2.gz MAJGYGPOVOWKKU-UHFFFAOYSA-N 0 0 361.785 3.511 20 5 FHBDRN C[C@H](NC(=O)c1cc(F)cc([N+](=O)[O-])c1)c1ncc(-c2ccccc2)o1 ZINC000523515411 947327174 /nfs/dbraw/zinc/32/71/74/947327174.db2.gz HOUYSRPDJOELMZ-NSHDSACASA-N 0 0 355.325 3.880 20 5 FHBDRN CCc1cccc2c1OCC[C@H]2NC(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000444907728 947327728 /nfs/dbraw/zinc/32/77/28/947327728.db2.gz PGDNUOXXCIYXPC-OAHLLOKOSA-N 0 0 371.393 3.811 20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])NCC1(c2cccc(Cl)c2)CC1 ZINC000523500388 947330830 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COc1cc([N+](=O)[O-])ccc1NC(=O)NCc1ccc(OC(C)C)cc1 ZINC000444917345 947353238 /nfs/dbraw/zinc/35/32/38/947353238.db2.gz DMXPLFQHQDXOLP-UHFFFAOYSA-N 0 0 359.382 3.712 20 5 FHBDRN O=[N+]([O-])c1cccnc1Sc1nnc(-c2ccco2)n1Cc1ccco1 ZINC000152050387 947355116 /nfs/dbraw/zinc/35/51/16/947355116.db2.gz BUANOHRPTGSTGU-UHFFFAOYSA-N 0 0 369.362 3.634 20 5 FHBDRN Cc1cc(C)nc(SCc2nc(-c3ccc(C)c([N+](=O)[O-])c3)no2)n1 ZINC000546280416 947358018 /nfs/dbraw/zinc/35/80/18/947358018.db2.gz ZXUKXTVHKVCMKI-UHFFFAOYSA-N 0 0 357.395 3.652 20 5 FHBDRN CC[C@H](CNC(=O)Cc1ccccc1[N+](=O)[O-])Oc1cccc(Cl)c1 ZINC000440616868 947378883 /nfs/dbraw/zinc/37/88/83/947378883.db2.gz SIAOUSHRCGTKDS-OAHLLOKOSA-N 0 0 362.813 3.765 20 5 FHBDRN CO[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2SC(C)C)[C@@H](C)C1 ZINC000441439790 947392418 /nfs/dbraw/zinc/39/24/18/947392418.db2.gz VCAZIRJNSCXSJP-GXTWGEPZSA-N 0 0 352.456 3.735 20 5 FHBDRN CC(C)c1ccc(CNC(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000444983444 947397047 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FHBDRN CSc1cccc(C(=O)N2CC[C@H](Oc3ccccc3)C2)c1[N+](=O)[O-] ZINC000567931008 947470985 /nfs/dbraw/zinc/47/09/85/947470985.db2.gz PBBZEGVQTBRUKM-AWEZNQCLSA-N 0 0 358.419 3.610 20 5 FHBDRN O=C(NCc1ccc(OC2CCCCC2)nc1)c1csc([N+](=O)[O-])c1 ZINC000523682247 947510337 /nfs/dbraw/zinc/51/03/37/947510337.db2.gz OYYVETSBNZRIQQ-UHFFFAOYSA-N 0 0 361.423 3.693 20 5 FHBDRN O=C(N[C@H]1CCCOc2ccccc21)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000523681376 947510452 /nfs/dbraw/zinc/51/04/52/947510452.db2.gz KTTOQDVXWWVXFU-INIZCTEOSA-N 0 0 351.362 3.720 20 5 FHBDRN CCOc1ccc(N(CC)S(=O)(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1 ZINC000523727133 947536807 /nfs/dbraw/zinc/53/68/07/947536807.db2.gz CXFUXTHFSDVOHD-UHFFFAOYSA-N 0 0 364.423 3.517 20 5 FHBDRN O=C(c1cccc2c(=O)c3ccccc3[nH]c12)N1CCc2ccsc2C1 ZINC000445133464 947543940 /nfs/dbraw/zinc/54/39/40/947543940.db2.gz HLBWIBQGDXBZSC-UHFFFAOYSA-N 0 0 360.438 3.941 20 5 FHBDRN Cc1cc2cc[nH]c2cc1NC(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000445155477 947550926 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Cc1csc([C@@H](C)NC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)n1 ZINC000184555410 947596801 /nfs/dbraw/zinc/59/68/01/947596801.db2.gz BLFIAIGDTJEDDK-SECBINFHSA-N 0 0 354.819 3.574 20 5 FHBDRN O=[N+]([O-])c1ccccc1Cc1noc(C2(c3ccccc3)CCOCC2)n1 ZINC000445202538 947599423 /nfs/dbraw/zinc/59/94/23/947599423.db2.gz DRGXWGULUCETMG-UHFFFAOYSA-N 0 0 365.389 3.665 20 5 FHBDRN CO[C@@H]1CCN(C(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000441462827 947611809 /nfs/dbraw/zinc/61/18/09/947611809.db2.gz CNXWJOAOUZITDX-WMLDXEAASA-N 0 0 369.421 3.978 20 5 FHBDRN COc1cnccc1[C@@H](C)NC(=O)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000445217273 947617669 /nfs/dbraw/zinc/61/76/69/947617669.db2.gz GHZBMTSHFVXXJU-CYBMUJFWSA-N 0 0 373.412 3.576 20 5 FHBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CCc2ccccc2CC1 ZINC000523811022 947630136 /nfs/dbraw/zinc/63/01/36/947630136.db2.gz NFGJXXGXCJVSAN-CYBMUJFWSA-N 0 0 374.824 3.643 20 5 FHBDRN COc1ccc(F)cc1CNC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000186720133 947634972 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947738635 /nfs/dbraw/zinc/73/86/35/947738635.db2.gz RBMLVGMWMSINFR-OAHLLOKOSA-N 0 0 357.366 3.710 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1C(=O)O[C@H](C)C(=O)Nc1ccc(Cl)cc1 ZINC000026117295 947738799 /nfs/dbraw/zinc/73/87/99/947738799.db2.gz MVJVQSSEUXJWIO-LLVKDONJSA-N 0 0 362.769 3.741 20 5 FHBDRN Cc1c(Cl)cccc1NC(=O)Cc1noc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000445348414 947743377 /nfs/dbraw/zinc/74/33/77/947743377.db2.gz JROXQRIIPBGMOE-UHFFFAOYSA-N 0 0 372.768 3.788 20 5 FHBDRN Cc1cc(C)cc(-c2cc(=NC(=O)c3cc([N+](=O)[O-])ccc3C)[nH][nH]2)c1 ZINC000523946226 947751447 /nfs/dbraw/zinc/75/14/47/947751447.db2.gz YGARXTLXMPOFSK-UHFFFAOYSA-N 0 0 350.378 3.584 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)NCc1cc(F)ccc1F ZINC000184585627 947751838 /nfs/dbraw/zinc/75/18/38/947751838.db2.gz PFHCCHXIZDTSOT-UHFFFAOYSA-N 0 0 355.728 3.526 20 5 FHBDRN CCCN(C(=O)[C@H]1Cc2cc(Cl)ccc2O1)c1cccc([N+](=O)[O-])c1 ZINC000441470712 947771911 /nfs/dbraw/zinc/77/19/11/947771911.db2.gz JSHZPBQJOUEHDR-QGZVFWFLSA-N 0 0 360.797 3.995 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)CCN1C(=O)CCc2ccccc21 ZINC000129527262 947775023 /nfs/dbraw/zinc/77/50/23/947775023.db2.gz CFXFXFNOXAMUPE-UHFFFAOYSA-N 0 0 367.405 3.520 20 5 FHBDRN O=C(O[C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1)c1nccc2ccccc21 ZINC000759940339 947788455 /nfs/dbraw/zinc/78/84/55/947788455.db2.gz DXFBJAPNHRSQRO-HZPDHXFCSA-N 0 0 366.377 3.680 20 5 FHBDRN O=C(O[C@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)c1cc2c(s1)CCC2 ZINC000759942251 947811939 /nfs/dbraw/zinc/81/19/39/947811939.db2.gz QQZPEVPLJJDXDG-STQMWFEESA-N 0 0 361.423 3.682 20 5 FHBDRN O=C(O[C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1)c1cc2c(s1)CCC2 ZINC000759942242 947811950 /nfs/dbraw/zinc/81/19/50/947811950.db2.gz QQZPEVPLJJDXDG-CHWSQXEVSA-N 0 0 361.423 3.682 20 5 FHBDRN COc1cccc(N2CCC(OCc3ccccc3F)CC2)c1[N+](=O)[O-] ZINC000613890194 947818292 /nfs/dbraw/zinc/81/82/92/947818292.db2.gz JEAWCHKHHXVWKQ-UHFFFAOYSA-N 0 0 360.385 3.928 20 5 FHBDRN CCCN(C(=O)c1cccc(C(=O)NC2CC2)c1)c1cccc([N+](=O)[O-])c1 ZINC000441475162 947820148 /nfs/dbraw/zinc/82/01/48/947820148.db2.gz NBCZUYUBGROCBG-UHFFFAOYSA-N 0 0 367.405 3.544 20 5 FHBDRN Cc1cc(N2CCC[C@@H](n3ccc(C(F)(F)F)n3)C2)ccc1[N+](=O)[O-] ZINC000302155340 947824581 /nfs/dbraw/zinc/82/45/81/947824581.db2.gz IQXRRDFEUHHDKM-CYBMUJFWSA-N 0 0 354.332 3.960 20 5 FHBDRN Cc1ccc(NC(=O)[C@@H](C)OC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)cc1F ZINC000728867464 947824803 /nfs/dbraw/zinc/82/48/03/947824803.db2.gz NKKRYDCLECMTTF-AGEOTTOMSA-N 0 0 372.352 3.626 20 5 FHBDRN COc1c(C)cnc(CN(C)C(=O)Nc2ccc([N+](=O)[O-])c(C)c2)c1C ZINC000184604226 947835297 /nfs/dbraw/zinc/83/52/97/947835297.db2.gz UZJGEYWNUNDYKR-UHFFFAOYSA-N 0 0 358.398 3.588 20 5 FHBDRN Cc1c(CN[C@H](c2cnn(C)c2)c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000184606620 947838576 /nfs/dbraw/zinc/83/85/76/947838576.db2.gz IJJFYJCJROIGJM-IBGZPJMESA-N 0 0 354.385 3.655 20 5 FHBDRN Cc1cc(NC(=O)N[C@@H](c2ccccc2)[C@H]2CCCO2)ccc1[N+](=O)[O-] ZINC000184608209 947843323 /nfs/dbraw/zinc/84/33/23/947843323.db2.gz VISWCFCEGIULLW-MSOLQXFVSA-N 0 0 355.394 3.945 20 5 FHBDRN CCCN(C(=O)CCc1ccccc1C(=O)OC)c1cccc([N+](=O)[O-])c1 ZINC000441478493 947868352 /nfs/dbraw/zinc/86/83/52/947868352.db2.gz TVUIZZHBDBTXAI-UHFFFAOYSA-N 0 0 370.405 3.757 20 5 FHBDRN CN(Cc1cscn1)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000184614076 947879908 /nfs/dbraw/zinc/87/99/08/947879908.db2.gz YOYVCOKPZRFITG-UHFFFAOYSA-N 0 0 360.317 3.734 20 5 FHBDRN CO[C@H](CNc1ccc(C(=O)Nc2ccc(C)cc2)cc1[N+](=O)[O-])C1CC1 ZINC000549605452 947882066 /nfs/dbraw/zinc/88/20/66/947882066.db2.gz LBQRWEGICJUPHL-LJQANCHMSA-N 0 0 369.421 3.992 20 5 FHBDRN O=C1CCCN1Cc1ccccc1CNc1c(Cl)cccc1[N+](=O)[O-] ZINC000432313543 947902588 /nfs/dbraw/zinc/90/25/88/947902588.db2.gz SIZVIKVIMIKDGR-UHFFFAOYSA-N 0 0 359.813 3.983 20 5 FHBDRN Cc1ccc([C@@H](Cn2ccnc2)NC(=O)c2ccc([N+](=O)[O-])s2)c(C)c1 ZINC000441480968 947903882 /nfs/dbraw/zinc/90/38/82/947903882.db2.gz LQVIBTITSYYXSL-OAHLLOKOSA-N 0 0 370.434 3.641 20 5 FHBDRN O=C(c1cc(C(F)(F)F)ccn1)N1CCCc2ccc([N+](=O)[O-])cc21 ZINC000888931372 947926783 /nfs/dbraw/zinc/92/67/83/947926783.db2.gz LMKZTHGVDLZVSF-UHFFFAOYSA-N 0 0 351.284 3.602 20 5 FHBDRN CCc1nc([C@@H](C)NC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)cs1 ZINC000184625365 947939211 /nfs/dbraw/zinc/93/92/11/947939211.db2.gz MBSPOTBEKJVHAT-SECBINFHSA-N 0 0 368.846 3.828 20 5 FHBDRN O=C(OCc1cc([N+](=O)[O-])ccc1Cl)c1cnc([C@@H]2CCCO2)s1 ZINC000125830380 947942725 /nfs/dbraw/zinc/94/27/25/947942725.db2.gz XACJHZSDNTXJLJ-LBPRGKRZSA-N 0 0 368.798 3.913 20 5 FHBDRN O=[N+]([O-])c1ccc(OCCCc2ccccc2Br)cc1CO ZINC000432314920 947958381 /nfs/dbraw/zinc/95/83/81/947958381.db2.gz SGGBUUHHTGBGLQ-UHFFFAOYSA-N 0 0 366.211 3.861 20 5 FHBDRN O=C(OCc1ccc([N+](=O)[O-])cc1Br)[C@@H]1CC12CCCC2 ZINC001126271741 947961487 /nfs/dbraw/zinc/96/14/87/947961487.db2.gz WMWQXKPRSUVZPR-LBPRGKRZSA-N 0 0 354.200 3.981 20 5 FHBDRN Cc1ccc([C@@H]2CCCCN2C(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)cc1 ZINC001126271010 947961919 /nfs/dbraw/zinc/96/19/19/947961919.db2.gz HMJMPTPJEXAOTN-INIZCTEOSA-N 0 0 368.389 3.999 20 5 FHBDRN Cn1cc(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)c2cc(F)ccc21 ZINC000432318682 948000745 /nfs/dbraw/zinc/00/07/45/948000745.db2.gz CJOCNCRBURYBAX-UHFFFAOYSA-N 0 0 361.760 3.809 20 5 FHBDRN COc1ccc(NC(=O)c2oc(Br)cc2C)c([N+](=O)[O-])c1 ZINC000128687090 948003920 /nfs/dbraw/zinc/00/39/20/948003920.db2.gz SMGDECRITFSFPR-UHFFFAOYSA-N 0 0 355.144 3.520 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NCc1cnc(C2CC2)o1 ZINC000459063977 948010325 /nfs/dbraw/zinc/01/03/25/948010325.db2.gz DFLDBHSDPCDCTH-UHFFFAOYSA-N 0 0 358.398 3.580 20 5 FHBDRN O=C(Cc1cccc(Cl)c1)O[C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000759944257 948010734 /nfs/dbraw/zinc/01/07/34/948010734.db2.gz SISQCKAVNMQUAW-CABCVRRESA-N 0 0 363.801 3.714 20 5 FHBDRN Cc1nn(CCC(=O)NC2CCC3(CCCCC3)CC2)c(C)c1[N+](=O)[O-] ZINC000188335672 948036107 /nfs/dbraw/zinc/03/61/07/948036107.db2.gz HLYXAPJEZBDYLC-UHFFFAOYSA-N 0 0 362.474 3.808 20 5 FHBDRN O=C(CCc1cnn(-c2ccccc2)c1)Nc1cc([N+](=O)[O-])c(F)cc1F ZINC000066961065 948042300 /nfs/dbraw/zinc/04/23/00/948042300.db2.gz ARNWLUGNOOVFJP-UHFFFAOYSA-N 0 0 372.331 3.630 20 5 FHBDRN CN(Cc1c(F)cccc1F)C(=O)CSc1ccccc1[N+](=O)[O-] ZINC000511985855 948049092 /nfs/dbraw/zinc/04/90/92/948049092.db2.gz XOPSKDFMDGJDGG-UHFFFAOYSA-N 0 0 352.362 3.624 20 5 FHBDRN CC(C)CCSCC(=O)O[C@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1 ZINC000759945286 948079028 /nfs/dbraw/zinc/07/90/28/948079028.db2.gz UECVBEIQRILVMY-KBPBESRZSA-N 0 0 355.460 3.598 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1N1CCC(C(=O)N2CCc3ccccc32)CC1 ZINC000080588584 948082602 /nfs/dbraw/zinc/08/26/02/948082602.db2.gz MNKKWRYQULSFPQ-UHFFFAOYSA-N 0 0 365.433 3.709 20 5 FHBDRN CNC(=O)c1ccc(N[C@@H](C)c2nc(C(F)(F)F)cs2)c([N+](=O)[O-])c1 ZINC000278911035 948085546 /nfs/dbraw/zinc/08/55/46/948085546.db2.gz ZXHWKVTXJUDXCD-ZETCQYMHSA-N 0 0 374.344 3.603 20 5 FHBDRN Cc1c(F)ccc([N+](=O)[O-])c1C(=O)NC[C@H](C)COCc1ccccc1 ZINC000843774382 948086695 /nfs/dbraw/zinc/08/66/95/948086695.db2.gz LLEIDUYPSFXZPM-ZDUSSCGKSA-N 0 0 360.385 3.625 20 5 FHBDRN C[C@@H]1CC(=O)Oc2cc(OC(=O)/C=C/c3ccc([N+](=O)[O-])cc3)ccc21 ZINC000785360566 948099722 /nfs/dbraw/zinc/09/97/22/948099722.db2.gz CBSJEAQIFBCRET-OXFRDRNISA-N 0 0 353.330 3.626 20 5 FHBDRN O=C(Cc1cccc(Cl)c1)O[C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1 ZINC000759944795 948103082 /nfs/dbraw/zinc/10/30/82/948103082.db2.gz SISQCKAVNMQUAW-LSDHHAIUSA-N 0 0 363.801 3.714 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H](OC)c1ccccc1 ZINC000184668493 948124059 /nfs/dbraw/zinc/12/40/59/948124059.db2.gz YDATWMIHZJAQGP-LPHOPBHVSA-N 0 0 356.422 3.667 20 5 FHBDRN O=C(CCc1ccccc1F)O[C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000759947807 948135800 /nfs/dbraw/zinc/13/58/00/948135800.db2.gz XBLMPXLDHSYYMF-HZPDHXFCSA-N 0 0 361.373 3.590 20 5 FHBDRN CSc1ccc(C(=O)O[C@@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)cc1 ZINC000759946949 948136128 /nfs/dbraw/zinc/13/61/28/948136128.db2.gz JTEUPGBHMIMYJG-LSDHHAIUSA-N 0 0 361.423 3.854 20 5 FHBDRN O=[N+]([O-])c1cccc2c(N[C@H]3CCOC4(CCSCC4)C3)ccnc21 ZINC000432340747 948158724 /nfs/dbraw/zinc/15/87/24/948158724.db2.gz OVIWHBMHFBEYKR-ZDUSSCGKSA-N 0 0 359.451 4.000 20 5 FHBDRN CCCCNC(=O)[C@@H]1CC[C@@H](C)N(c2ccnc3c2cccc3[N+](=O)[O-])C1 ZINC000432340770 948158994 /nfs/dbraw/zinc/15/89/94/948158994.db2.gz PDJHZWHDHYTPRR-HUUCEWRRSA-N 0 0 370.453 3.664 20 5 FHBDRN O=C(OCc1ccc([N+](=O)[O-])c(F)c1)c1ccc([N+](=O)[O-])cc1Cl ZINC000782009713 948162231 /nfs/dbraw/zinc/16/22/31/948162231.db2.gz XYOJKTVLDDWXDW-UHFFFAOYSA-N 0 0 354.677 3.653 20 5 FHBDRN CN(CC(=O)Nc1cccc(Cl)c1)c1ccnc2c1cccc2[N+](=O)[O-] ZINC000432342408 948164481 /nfs/dbraw/zinc/16/44/81/948164481.db2.gz JJIKTBIIMUSDLW-UHFFFAOYSA-N 0 0 370.796 3.871 20 5 FHBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)N[C@@H]2CCCC[C@H]2c2ccccc2)cc1 ZINC000512008054 948175681 /nfs/dbraw/zinc/17/56/81/948175681.db2.gz LKRUSNMONNTTJS-RBUKOAKNSA-N 0 0 374.462 3.741 20 5 FHBDRN COc1ccc2c(c1)OC[C@@H](Nc1ccnc3c1cccc3[N+](=O)[O-])C2 ZINC000432346216 948180495 /nfs/dbraw/zinc/18/04/95/948180495.db2.gz JUCNSWYVTJBWHM-ZDUSSCGKSA-N 0 0 351.362 3.567 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)N(Cc2cccs2)C(C)C)cc1C ZINC000512015577 948194844 /nfs/dbraw/zinc/19/48/44/948194844.db2.gz QBDGIBGUEOARDD-UHFFFAOYSA-N 0 0 368.480 3.872 20 5 FHBDRN CCNc1ccc(C(=O)Oc2ccc3c(c2)OC(=O)C[C@@H]3C)cc1[N+](=O)[O-] ZINC000785367205 948202529 /nfs/dbraw/zinc/20/25/29/948202529.db2.gz SRHZVTIWYMWOFS-NSHDSACASA-N 0 0 370.361 3.658 20 5 FHBDRN Cc1ccc(-c2nc(SC[C@@H](O)c3cccc([N+](=O)[O-])c3)n[nH]2)cc1 ZINC000136841324 948206808 /nfs/dbraw/zinc/20/68/08/948206808.db2.gz LOMXSPRZHAMQCH-OAHLLOKOSA-N 0 0 356.407 3.514 20 5 FHBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)c1cccnc1OCC(F)F ZINC000125935958 948228005 /nfs/dbraw/zinc/22/80/05/948228005.db2.gz MTTVMPBVCWDEKX-UHFFFAOYSA-N 0 0 371.727 3.848 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]nc(-c3nc(-c4cccc5ncccc54)no3)c2c1 ZINC000585731437 948241630 /nfs/dbraw/zinc/24/16/30/948241630.db2.gz HSSBFZUGLRMLDD-UHFFFAOYSA-N 0 0 358.317 3.736 20 5 FHBDRN O=[N+]([O-])c1cc(C(F)(F)F)ccc1-c1nc(Cc2cccnc2)no1 ZINC000585731180 948244576 /nfs/dbraw/zinc/24/45/76/948244576.db2.gz IUVSVCUXZISWQL-UHFFFAOYSA-N 0 0 350.256 3.649 20 5 FHBDRN O=C(CC[S@](=O)Cc1ccccc1C1CC1)Nc1ccccc1[N+](=O)[O-] ZINC000507774826 948250193 /nfs/dbraw/zinc/25/01/93/948250193.db2.gz MQVWLMQDRPLHBJ-SANMLTNESA-N 0 0 372.446 3.750 20 5 FHBDRN CCCC1CCC(NC(=O)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000067398780 948250231 /nfs/dbraw/zinc/25/02/31/948250231.db2.gz FLAFCGJTRUEYSK-UHFFFAOYSA-N 0 0 367.833 3.662 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])N1CCCC[C@H]1Cc1ccc(F)cc1 ZINC000520540590 948250678 /nfs/dbraw/zinc/25/06/78/948250678.db2.gz JFVHNSAMXBKNIK-SFHVURJKSA-N 0 0 356.397 3.900 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)[C@@H](C)Cn2ncc3ccccc32)cc1[N+](=O)[O-] ZINC000585745497 948251196 /nfs/dbraw/zinc/25/11/96/948251196.db2.gz KKNNYBUTIUFZKF-LSDHHAIUSA-N 0 0 366.421 3.766 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H]1CCC[C@H]1Cc1ccccc1 ZINC000427593581 948253385 /nfs/dbraw/zinc/25/33/85/948253385.db2.gz LLBXPWVIOVIMPE-YJBOKZPZSA-N 0 0 354.406 3.745 20 5 FHBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N[C@@H]2CCCC[C@H]2c2ccccc2)c1 ZINC000512036152 948255297 /nfs/dbraw/zinc/25/52/97/948255297.db2.gz DXZTXCKGNPFDQA-ZWKOTPCHSA-N 0 0 360.435 3.600 20 5 FHBDRN Cc1c(Cl)cccc1N1CCCN(C(=O)c2ccccc2[N+](=O)[O-])CC1 ZINC000585749285 948261171 /nfs/dbraw/zinc/26/11/71/948261171.db2.gz GRGLHYBIYVWNRZ-UHFFFAOYSA-N 0 0 373.840 3.909 20 5 FHBDRN C[C@@H](Oc1ccc(F)cc1Cl)C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000125951406 948261799 /nfs/dbraw/zinc/26/17/99/948261799.db2.gz RUZNLKFDCXAXGX-LLVKDONJSA-N 0 0 366.776 3.514 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCC(=O)NCCCSc2ccccc2)c1 ZINC000019192797 948265317 /nfs/dbraw/zinc/26/53/17/948265317.db2.gz SHQDQOAMESSKPE-UHFFFAOYSA-N 0 0 360.435 3.581 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N[C@H](c1ccccc1)C1CCC1 ZINC000520556827 948278828 /nfs/dbraw/zinc/27/88/28/948278828.db2.gz QELXIEKSHZIAQI-QGZVFWFLSA-N 0 0 360.435 3.723 20 5 FHBDRN CC(C)N(Cc1cccs1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000512042901 948280381 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356.382 3.613 20 5 FHBDRN C[C@H]1Cc2cccc(C(=O)N3CCC[C@@H](c4ccc([N+](=O)[O-])cc4)C3)c2O1 ZINC000452875291 567876051 /nfs/dbraw/zinc/87/60/51/567876051.db2.gz VBIBCKNHJBKZHE-WMLDXEAASA-N 0 0 366.417 3.938 20 5 FHBDRN O=C(COCc1ccccc1)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452884427 567886455 /nfs/dbraw/zinc/88/64/55/567886455.db2.gz PXLZLADOBUPJNZ-SFHVURJKSA-N 0 0 354.406 3.518 20 5 FHBDRN COc1ccc(C(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)c(OC)c1 ZINC000452881887 567889084 /nfs/dbraw/zinc/88/90/84/567889084.db2.gz ORLITWRPARLACU-HNNXBMFYSA-N 0 0 370.405 3.632 20 5 FHBDRN O=C(COCc1ccccc1)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452884424 567896831 /nfs/dbraw/zinc/89/68/31/567896831.db2.gz PXLZLADOBUPJNZ-GOSISDBHSA-N 0 0 354.406 3.518 20 5 FHBDRN COc1ccc(F)cc1C(=O)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452897045 567904637 /nfs/dbraw/zinc/90/46/37/567904637.db2.gz ZMNRFWJJLMGNKS-AWEZNQCLSA-N 0 0 358.369 3.762 20 5 FHBDRN CC(C)[C@@H]1C[C@@H](CNC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)CCO1 ZINC000452898212 567908517 /nfs/dbraw/zinc/90/85/17/567908517.db2.gz SBSLMRFIHMNQCR-ZQIUZPCESA-N 0 0 366.483 3.643 20 5 FHBDRN Cc1cc(Nc2ncnc3cccc([N+](=O)[O-])c32)nn1C1CCCCC1 ZINC000568129796 567910859 /nfs/dbraw/zinc/91/08/59/567910859.db2.gz QFLSAUVOFJHOIB-UHFFFAOYSA-N 0 0 352.398 3.714 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)N(C)[C@H]2CCc3ccccc32)c1 ZINC000541821485 567911171 /nfs/dbraw/zinc/91/11/71/567911171.db2.gz PIODXAFNNWCZKY-INIZCTEOSA-N 0 0 360.435 3.520 20 5 FHBDRN Cc1ncsc1-c1nc(CSc2ccc([N+](=O)[O-])cc2F)no1 ZINC000366012399 567932617 /nfs/dbraw/zinc/93/26/17/567932617.db2.gz UJOKICPZABMYHJ-UHFFFAOYSA-N 0 0 352.372 3.841 20 5 FHBDRN CC(C)(C)[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F)C(F)(F)F ZINC000541846552 567961459 /nfs/dbraw/zinc/96/14/59/567961459.db2.gz NQMDKWPZZAXSDA-NSHDSACASA-N 0 0 370.274 3.903 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1ccc(OC)c(Cl)c1 ZINC000521415748 567962935 /nfs/dbraw/zinc/96/29/35/567962935.db2.gz HWOCCVJSOUJXFP-UHFFFAOYSA-N 0 0 370.814 3.620 20 5 FHBDRN CC(C)(CCc1noc(COc2cccc(C(F)(F)F)c2)n1)[N+](=O)[O-] ZINC000291015443 567965400 /nfs/dbraw/zinc/96/54/00/567965400.db2.gz BSMMSPKODMUHKS-UHFFFAOYSA-N 0 0 359.304 3.655 20 5 FHBDRN Cc1c(CNC(=O)Cc2ccc(Br)s2)cccc1[N+](=O)[O-] ZINC000481472114 567966185 /nfs/dbraw/zinc/96/61/85/567966185.db2.gz CEUQHRVFYMHQRB-UHFFFAOYSA-N 0 0 369.240 3.586 20 5 FHBDRN Cc1c(CNC(=O)c2ccc(OCC(F)(F)F)cc2)cccc1[N+](=O)[O-] ZINC000481470482 567966282 /nfs/dbraw/zinc/96/62/82/567966282.db2.gz ZLAONLQSWNYSPL-UHFFFAOYSA-N 0 0 368.311 3.774 20 5 FHBDRN Cc1c(CNC(=O)CCc2ncc(-c3ccccc3)o2)cccc1[N+](=O)[O-] ZINC000481471702 567967776 /nfs/dbraw/zinc/96/77/76/567967776.db2.gz IJMMLQJMAHJFHM-UHFFFAOYSA-N 0 0 365.389 3.807 20 5 FHBDRN Cc1noc2nc(C(C)C)cc(C(=O)NCc3cccc([N+](=O)[O-])c3C)c12 ZINC000481482818 567975125 /nfs/dbraw/zinc/97/51/25/567975125.db2.gz RBRYDIWKPKHPNT-UHFFFAOYSA-N 0 0 368.393 3.801 20 5 FHBDRN Cc1cc([C@H]2CCCN2C(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)on1 ZINC000481485942 567988665 /nfs/dbraw/zinc/98/86/65/567988665.db2.gz ZBQZUPLQUYUPIE-IUODEOHRSA-N 0 0 361.423 3.736 20 5 FHBDRN COc1ccccc1C[C@H](C)CC(=O)NCc1cccc([N+](=O)[O-])c1C ZINC000481503143 567996882 /nfs/dbraw/zinc/99/68/82/567996882.db2.gz SJNMKZBYACIBEZ-AWEZNQCLSA-N 0 0 356.422 3.797 20 5 FHBDRN Cc1c(CNC(=O)CCc2ccc(OC(F)F)cc2)cccc1[N+](=O)[O-] ZINC000481495743 567998625 /nfs/dbraw/zinc/99/86/25/567998625.db2.gz STZXHKKHOIGTKY-UHFFFAOYSA-N 0 0 364.348 3.754 20 5 FHBDRN Cc1c(CNC(=O)[C@@H]2CCOc3ccc(Cl)cc32)cccc1[N+](=O)[O-] ZINC000481495827 568002519 /nfs/dbraw/zinc/00/25/19/568002519.db2.gz TXLNBIICAUPGEA-CQSZACIVSA-N 0 0 360.797 3.739 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1C[C@H](c2ccc(F)cc2)C1 ZINC000481520265 568005125 /nfs/dbraw/zinc/00/51/25/568005125.db2.gz VJKTUOPLSJZKSO-CTYIDZIISA-N 0 0 358.369 3.809 20 5 FHBDRN CCCN(C(=O)c1cc2cc([N+](=O)[O-])ccc2o1)[C@H](CC)C(=O)OCC ZINC000481518081 568005199 /nfs/dbraw/zinc/00/51/99/568005199.db2.gz LBFFQUOJSUUTSX-CQSZACIVSA-N 0 0 362.382 3.535 20 5 FHBDRN Cc1cc(N2CCC[C@H]2c2cnn(C)c2)c(Br)cc1[N+](=O)[O-] ZINC000302703465 568019196 /nfs/dbraw/zinc/01/91/96/568019196.db2.gz VMZBZRGIWMCNFP-ZDUSSCGKSA-N 0 0 365.231 3.741 20 5 FHBDRN CC[C@H](NC(=O)c1ccccc1)c1noc(-c2cccc([N+](=O)[O-])c2C)n1 ZINC000568327486 568024703 /nfs/dbraw/zinc/02/47/03/568024703.db2.gz CXWZNGQENMXYFV-HNNXBMFYSA-N 0 0 366.377 3.834 20 5 FHBDRN CN(C(=O)CSCc1c(F)cccc1F)c1ccc([N+](=O)[O-])cc1 ZINC000568330589 568024911 /nfs/dbraw/zinc/02/49/11/568024911.db2.gz QRBZRFZKQXMVNW-UHFFFAOYSA-N 0 0 352.362 3.769 20 5 FHBDRN O=C(C1CC1)[C@@H]1CN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CCO1 ZINC000568338199 568026267 /nfs/dbraw/zinc/02/62/67/568026267.db2.gz WCIVBMPPZFKAQT-KRWDZBQOSA-N 0 0 372.446 3.503 20 5 FHBDRN CC(C)(C(=O)NC[C@@]1(C)OCCc2sccc21)c1ccccc1[N+](=O)[O-] ZINC000568376762 568035401 /nfs/dbraw/zinc/03/54/01/568035401.db2.gz KJVRMFTVSXMXQP-LJQANCHMSA-N 0 0 374.462 3.538 20 5 FHBDRN O=C(c1csc(-c2ccc([N+](=O)[O-])cc2)n1)N1CCCc2ncccc21 ZINC000065095449 568042406 /nfs/dbraw/zinc/04/24/06/568042406.db2.gz NGGBEPNARHNCQA-UHFFFAOYSA-N 0 0 366.402 3.706 20 5 FHBDRN CCc1cc(O)ccc1NC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000481535665 568044236 /nfs/dbraw/zinc/04/42/36/568044236.db2.gz XMIKALPAGUMWCR-SNVBAGLBSA-N 0 0 364.785 3.922 20 5 FHBDRN CC(C)(C)[C@@H]1NC(=O)CC[C@H]1Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000568494456 568044626 /nfs/dbraw/zinc/04/46/26/568044626.db2.gz LRXJOTJNSCBFGA-BXUZGUMPSA-N 0 0 359.348 3.719 20 5 FHBDRN C[C@@H]1[C@H](C(F)(F)F)CCCN1c1nnc(-c2ccc([N+](=O)[O-])cc2)n1C ZINC000568566546 568048685 /nfs/dbraw/zinc/04/86/85/568048685.db2.gz FRZWPHZKSPTSMY-ZWNOBZJWSA-N 0 0 369.347 3.558 20 5 FHBDRN CC1(C)CCN(C(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)c2ccccc21 ZINC000568560716 568051519 /nfs/dbraw/zinc/05/15/19/568051519.db2.gz LPJIONAPNJAJQT-UHFFFAOYSA-N 0 0 368.389 3.694 20 5 FHBDRN Cc1cc(O)c(C(C)C)cc1C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000436619914 568059121 /nfs/dbraw/zinc/05/91/21/568059121.db2.gz RAPZYWVOQNKSMA-UHFFFAOYSA-N 0 0 354.406 3.931 20 5 FHBDRN COC(=O)c1cc(NC(=O)c2ccc([N+](=O)[O-])c(C)c2)cc(Cl)c1F ZINC000481575829 568059694 /nfs/dbraw/zinc/05/96/94/568059694.db2.gz XRELKZUCDUKOBQ-UHFFFAOYSA-N 0 0 366.732 3.735 20 5 FHBDRN CC1CCC(N2C[C@H](c3nc(-c4cccc([N+](=O)[O-])c4)no3)CC2=O)CC1 ZINC000265002043 568060253 /nfs/dbraw/zinc/06/02/53/568060253.db2.gz NRUKGIGILPHNAO-HNFVBEJKSA-N 0 0 370.409 3.539 20 5 FHBDRN CC(=O)NC1(c2noc(-c3cc4cc([N+](=O)[O-])ccc4o3)n2)CCCCC1 ZINC000265003493 568060442 /nfs/dbraw/zinc/06/04/42/568060442.db2.gz KYZAMIVTRBVVKH-UHFFFAOYSA-N 0 0 370.365 3.687 20 5 FHBDRN O=C(NC[C@H]1CCO[C@@H]1c1ccccc1)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000481592813 568063363 /nfs/dbraw/zinc/06/33/63/568063363.db2.gz KKCUESQLSUCPRM-AUUYWEPGSA-N 0 0 366.373 3.849 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(-c2nnco2)c1 ZINC000024735839 568063757 /nfs/dbraw/zinc/06/37/57/568063757.db2.gz ZQUVMZOIKNZEEE-LLVKDONJSA-N 0 0 370.390 3.764 20 5 FHBDRN C[C@@H](C(=O)NC[C@H]1CCO[C@@H]1c1ccccc1)c1ccc([N+](=O)[O-])cc1F ZINC000481597750 568064394 /nfs/dbraw/zinc/06/43/94/568064394.db2.gz TXNVSAUMGSTEOR-ZXYWRSMDSA-N 0 0 372.396 3.731 20 5 FHBDRN Cn1c(SCc2ccc([N+](=O)[O-])cc2C(F)(F)F)nnc1C1CC1 ZINC000159257512 568069641 /nfs/dbraw/zinc/06/96/41/568069641.db2.gz PAYMPSXPUKUWPH-UHFFFAOYSA-N 0 0 358.345 3.912 20 5 FHBDRN C[C@@H](C(=O)NC[C@@H]1CCC2(CCCCC2)O1)c1ccc([N+](=O)[O-])cc1F ZINC000481634111 568074450 /nfs/dbraw/zinc/07/44/50/568074450.db2.gz PMYKTXQMOPBPCA-HIFRSBDPSA-N 0 0 364.417 3.836 20 5 FHBDRN CCc1ccc(C(=O)Nc2ccc3oc(N(C)C)nc3c2)cc1[N+](=O)[O-] ZINC000481635555 568075155 /nfs/dbraw/zinc/07/51/55/568075155.db2.gz ULWNSEUUBYPPCQ-UHFFFAOYSA-N 0 0 354.366 3.617 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)N[C@H]1C[C@H]1c1cccc(F)c1 ZINC000067333985 568077124 /nfs/dbraw/zinc/07/71/24/568077124.db2.gz QDXTYLNKGXGQEW-ROUUACIJSA-N 0 0 357.385 3.598 20 5 FHBDRN COc1ccc(CN2CCC[C@@H]2c2ccc3c(c2)OCCO3)cc1[N+](=O)[O-] ZINC000051560135 568079960 /nfs/dbraw/zinc/07/99/60/568079960.db2.gz GQXHOLCGHXYDEM-MRXNPFEDSA-N 0 0 370.405 3.712 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(Sc2nnc3cc(C)c4ccccc4n32)n1 ZINC000481678398 568085279 /nfs/dbraw/zinc/08/52/79/568085279.db2.gz UBBUTLKMCNEKHT-UHFFFAOYSA-N 0 0 351.391 3.954 20 5 FHBDRN COc1ccc([C@H](CNc2nc(C)ccc2[N+](=O)[O-])[NH+]2CCCC2)cc1 ZINC000481684198 568089058 /nfs/dbraw/zinc/08/90/58/568089058.db2.gz KMWDXDOSQLPTGA-SFHVURJKSA-N 0 0 356.426 3.556 20 5 FHBDRN COc1cc(CN2CCC[C@@]3(C2)OCc2ccccc23)c([N+](=O)[O-])cc1F ZINC000481703596 568091522 /nfs/dbraw/zinc/09/15/22/568091522.db2.gz RXYLYCZFYUZWCW-FQEVSTJZSA-N 0 0 372.396 3.764 20 5 FHBDRN COc1cc(C[N@@H+]2CCC[C@@]3(C2)OCc2ccccc23)ccc1[N+](=O)[O-] ZINC000481698410 568092111 /nfs/dbraw/zinc/09/21/11/568092111.db2.gz YASCKWFPYAUOQS-FQEVSTJZSA-N 0 0 354.406 3.625 20 5 FHBDRN Cc1c(CC(=O)N2CCC[C@@H]2CC(=O)c2cccs2)cccc1[N+](=O)[O-] ZINC000128632519 568092606 /nfs/dbraw/zinc/09/26/06/568092606.db2.gz DYPGGSDIWPVMEC-OAHLLOKOSA-N 0 0 372.446 3.771 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(N2CCCN(Cc3ccc(Cl)cc3)CC2)n1 ZINC000481708339 568095017 /nfs/dbraw/zinc/09/50/17/568095017.db2.gz ASVOSUOKLDUINQ-UHFFFAOYSA-N 0 0 360.845 3.664 20 5 FHBDRN O=C(N[C@@H]1CCC[C@@H]2OCC[C@H]21)c1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000291284531 568096230 /nfs/dbraw/zinc/09/62/30/568096230.db2.gz GJXZIJNJJMHMGE-BIMULSAOSA-N 0 0 359.209 3.589 20 5 FHBDRN O=c1[nH]c(N2CCC[C@H]2c2ccc(F)cc2)nc2ccc([N+](=O)[O-])cc12 ZINC000568642142 568104102 /nfs/dbraw/zinc/10/41/02/568104102.db2.gz YHBVPBNXWOJXCQ-INIZCTEOSA-N 0 0 354.341 3.724 20 5 FHBDRN C[C@H](NC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1)c1ccc(F)c2ccccc21 ZINC000568672509 568117020 /nfs/dbraw/zinc/11/70/20/568117020.db2.gz FXJJWRFXGIFBSL-LBPRGKRZSA-N 0 0 370.384 3.696 20 5 FHBDRN CSc1ccc(C(=O)NC[C@H]2CCN(c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000024813435 568130611 /nfs/dbraw/zinc/13/06/11/568130611.db2.gz QXULWHDDUDTDCP-CQSZACIVSA-N 0 0 371.462 3.573 20 5 FHBDRN CCCCCN(Cc1ccc(Cl)cc1)C(=O)c1cc([N+](=O)[O-])nn1C ZINC000481807405 568131951 /nfs/dbraw/zinc/13/19/51/568131951.db2.gz DDFHOJXNJFKSHF-UHFFFAOYSA-N 0 0 364.833 3.814 20 5 FHBDRN CNC(=O)c1ccc(N[C@@H]2CC(C)(C)Oc3cc(F)ccc32)c([N+](=O)[O-])c1 ZINC000481816600 568134832 /nfs/dbraw/zinc/13/48/32/568134832.db2.gz ROAWJILTCGUUCY-OAHLLOKOSA-N 0 0 373.384 3.808 20 5 FHBDRN CCN(CCc1cccs1)C(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000481832242 568136391 /nfs/dbraw/zinc/13/63/91/568136391.db2.gz SFNXKSWLODGJDH-UHFFFAOYSA-N 0 0 370.434 3.547 20 5 FHBDRN O=C(Nc1ccc2c(c1)OC(F)(F)O2)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000603734268 568146126 /nfs/dbraw/zinc/14/61/26/568146126.db2.gz ZURUVAQRWWDEIL-UHFFFAOYSA-N 0 0 362.244 3.915 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(CN2CCCC2=O)cc1 ZINC000291479570 568152080 /nfs/dbraw/zinc/15/20/80/568152080.db2.gz RLVGWKPCXRQCLO-UHFFFAOYSA-N 0 0 367.405 3.532 20 5 FHBDRN Cn1nc([N+](=O)[O-])cc1C(=O)NC1(c2ccc(Cl)cc2)CCCCC1 ZINC000481884646 568153062 /nfs/dbraw/zinc/15/30/62/568153062.db2.gz DDNLJXOBXHHZEM-UHFFFAOYSA-N 0 0 362.817 3.571 20 5 FHBDRN O=C(NCCc1ccc(Br)cc1)Nc1ccc([N+](=O)[O-])cc1 ZINC000217542396 568163114 /nfs/dbraw/zinc/16/31/14/568163114.db2.gz LAJFAVDAARVFER-UHFFFAOYSA-N 0 0 364.199 3.722 20 5 FHBDRN C[C@H](Nc1ncc([N+](=O)[O-])c(N)n1)c1ccc(Oc2ccccc2)c(F)c1 ZINC000603871814 568174307 /nfs/dbraw/zinc/17/43/07/568174307.db2.gz VNYJORLBSGGQKM-NSHDSACASA-N 0 0 369.356 3.902 20 5 FHBDRN COCCCCc1cccnc1NC(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000291510563 568182020 /nfs/dbraw/zinc/18/20/20/568182020.db2.gz XDSZUWDXVBJYFT-UHFFFAOYSA-N 0 0 363.801 3.865 20 5 FHBDRN C[C@@H]1CCCN(c2ccc(C(=O)N3C[C@H]4CCC[C@@H]4C3)cc2[N+](=O)[O-])C1 ZINC000408248889 568187021 /nfs/dbraw/zinc/18/70/21/568187021.db2.gz LKRDITODLZXZKR-DJIMGWMZSA-N 0 0 357.454 3.703 20 5 FHBDRN COC(=O)c1cc(OCC(=O)c2ccc3ccccc3c2)ccc1[N+](=O)[O-] ZINC000481946709 568195276 /nfs/dbraw/zinc/19/52/76/568195276.db2.gz VYRZLAADFUSICN-UHFFFAOYSA-N 0 0 365.341 3.796 20 5 FHBDRN CS[C@@H]1CCC[C@@H](Nc2ccc([N+](=O)[O-])c(N3CCOCC3)c2F)C1 ZINC000568768230 568195952 /nfs/dbraw/zinc/19/59/52/568195952.db2.gz JZARSXAPBLBKIC-CHWSQXEVSA-N 0 0 369.462 3.657 20 5 FHBDRN C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000481981473 568213408 /nfs/dbraw/zinc/21/34/08/568213408.db2.gz CLBNORRROISBNF-SKDRFNHKSA-N 0 0 364.751 3.980 20 5 FHBDRN C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000481981470 568213423 /nfs/dbraw/zinc/21/34/23/568213423.db2.gz CLBNORRROISBNF-CABZTGNLSA-N 0 0 364.751 3.980 20 5 FHBDRN CCc1[nH]nc(C(=O)Nc2nc(-c3ccccc3)c(C)s2)c1[N+](=O)[O-] ZINC000609473223 568217931 /nfs/dbraw/zinc/21/79/31/568217931.db2.gz IENWNMXIFQURJA-UHFFFAOYSA-N 0 0 357.395 3.565 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(N2CCN([C@@H](C)c3ccc(Cl)cc3)CC2)n1 ZINC000481995556 568221750 /nfs/dbraw/zinc/22/17/50/568221750.db2.gz YUDVEVJJVOSSNW-AWEZNQCLSA-N 0 0 360.845 3.835 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N1CCC[C@@H]1[C@@H]1C[C@H](C)CC[C@@H]1O ZINC000408262799 568223430 /nfs/dbraw/zinc/22/34/30/568223430.db2.gz ZQVQQPLABJIPDC-IUHNQTRMSA-N 0 0 374.481 3.922 20 5 FHBDRN C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1c[nH]c2cc([N+](=O)[O-])ccc21 ZINC000482021627 568228616 /nfs/dbraw/zinc/22/86/16/568228616.db2.gz NOMVZCIQPJSQST-TVQRCGJNSA-N 0 0 355.316 3.879 20 5 FHBDRN COc1cc(Cl)c(NC(=O)c2ccc(OC)c([N+](=O)[O-])c2)cc1C ZINC000568811993 568229545 /nfs/dbraw/zinc/22/95/45/568229545.db2.gz BOBBLRHHBRQPLG-UHFFFAOYSA-N 0 0 350.758 3.826 20 5 FHBDRN CCc1nc([C@H](C)NC(=O)NC(C)(C)c2ccccc2[N+](=O)[O-])cs1 ZINC000291621564 568230442 /nfs/dbraw/zinc/23/04/42/568230442.db2.gz AUALIMJXVAMXPH-NSHDSACASA-N 0 0 362.455 3.909 20 5 FHBDRN COc1ccc(CSCC(=O)N2C[C@H](C)c3ccccc32)cc1[N+](=O)[O-] ZINC000482034672 568235011 /nfs/dbraw/zinc/23/50/11/568235011.db2.gz CSNJWTBABZIDIR-ZDUSSCGKSA-N 0 0 372.446 3.987 20 5 FHBDRN CCn1c(SC[C@H]2CCC[C@@H](O)C2)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000291639662 568236456 /nfs/dbraw/zinc/23/64/56/568236456.db2.gz MJTKREIGKXARER-SWLSCSKDSA-N 0 0 362.455 3.516 20 5 FHBDRN CCOc1cccc(NCCc2cc(F)cc3c2OCOC3)c1[N+](=O)[O-] ZINC000302101562 568237567 /nfs/dbraw/zinc/23/75/67/568237567.db2.gz LNVMOTXTONZATB-UHFFFAOYSA-N 0 0 362.357 3.654 20 5 FHBDRN CNc1c(C(=O)N2CC[C@@H](C(F)(F)F)C(C)(C)C2)cccc1[N+](=O)[O-] ZINC000482043638 568237883 /nfs/dbraw/zinc/23/78/83/568237883.db2.gz PLGCIUWXKUGZLW-GFCCVEGCSA-N 0 0 359.348 3.687 20 5 FHBDRN CC1(C)CN(C(=O)Cc2ccc([N+](=O)[O-])cc2F)CC[C@@H]1C(F)(F)F ZINC000482048690 568238633 /nfs/dbraw/zinc/23/86/33/568238633.db2.gz XXCHAWBROTXNFI-ZDUSSCGKSA-N 0 0 362.323 3.713 20 5 FHBDRN CCn1c(C)nc([N+](=O)[O-])c1NCc1ccc(OCC(F)(F)F)cc1 ZINC000568872631 568240334 /nfs/dbraw/zinc/24/03/34/568240334.db2.gz ZOYKGEYSXALDDZ-UHFFFAOYSA-N 0 0 358.320 3.673 20 5 FHBDRN O=C(c1ccc(OC(F)F)c([N+](=O)[O-])c1)N1CC[C@@H]1Cc1ccccc1 ZINC000541925648 568246425 /nfs/dbraw/zinc/24/64/25/568246425.db2.gz AYPSRNGMCUHJJC-CQSZACIVSA-N 0 0 362.332 3.653 20 5 FHBDRN Cc1ccc(CNc2nc(C)cc(C)c2[N+](=O)[O-])c(OC[C@H]2CCOC2)c1 ZINC000541932686 568247085 /nfs/dbraw/zinc/24/70/85/568247085.db2.gz UQNKKEPRHUTBTQ-INIZCTEOSA-N 0 0 371.437 3.942 20 5 FHBDRN CCOC(=O)c1sc([C@@H](C)Nc2nc(C)cc(C)c2[N+](=O)[O-])nc1C ZINC000541933427 568251368 /nfs/dbraw/zinc/25/13/68/568251368.db2.gz LKPAOVXBHNLPOX-LLVKDONJSA-N 0 0 364.427 3.721 20 5 FHBDRN CC[C@]1(CO)CCCN(C(=O)c2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000291669665 568252520 /nfs/dbraw/zinc/25/25/20/568252520.db2.gz LTHJFEXGLIHJHZ-HNNXBMFYSA-N 0 0 361.225 3.526 20 5 FHBDRN Cc1nnc([C@@H](C)NC(=O)c2cc(Cl)cc(Cl)c2[N+](=O)[O-])s1 ZINC000291670757 568252537 /nfs/dbraw/zinc/25/25/37/568252537.db2.gz IGTXHGUYJORDSH-RXMQYKEDSA-N 0 0 361.210 3.553 20 5 FHBDRN C[C@@H](NC(=O)Nc1cccc([N+](=O)[O-])c1)c1cccc(-n2cccn2)c1 ZINC000072930779 568253382 /nfs/dbraw/zinc/25/33/82/568253382.db2.gz BOZJTUOBICSQSG-CYBMUJFWSA-N 0 0 351.366 3.663 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H](C1CC1)C(F)(F)F ZINC000568929546 568253395 /nfs/dbraw/zinc/25/33/95/568253395.db2.gz FZMNEOOIJRERIH-AWEZNQCLSA-N 0 0 359.348 3.856 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2noc(C3(Cc4ccccc4)CCOCC3)n2)c1 ZINC000453029692 568255108 /nfs/dbraw/zinc/25/51/08/568255108.db2.gz RVQCCXAWNLFWEQ-UHFFFAOYSA-N 0 0 365.389 3.936 20 5 FHBDRN CCOc1c(OC)cc(CNc2nc(C)cc(C)c2[N+](=O)[O-])cc1OC ZINC000541936279 568257683 /nfs/dbraw/zinc/25/76/83/568257683.db2.gz WBYJTPXASMQZPD-UHFFFAOYSA-N 0 0 361.398 3.635 20 5 FHBDRN Cc1cnc(N2CCO[C@@H](c3ccccc3C(F)(F)F)C2)c([N+](=O)[O-])c1 ZINC000541935287 568259780 /nfs/dbraw/zinc/25/97/80/568259780.db2.gz LKCABYUYHVRVNW-OAHLLOKOSA-N 0 0 367.327 3.895 20 5 FHBDRN Cc1nn(Cc2ccccc2)c(C)c1C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000007915864 568265449 /nfs/dbraw/zinc/26/54/49/568265449.db2.gz REYYDFHTINSZED-UHFFFAOYSA-N 0 0 350.378 3.709 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N1CC(COc2ccccc2)C1 ZINC000569031614 568269845 /nfs/dbraw/zinc/26/98/45/568269845.db2.gz VDUFOUIHNVNLKL-UHFFFAOYSA-N 0 0 361.785 3.791 20 5 FHBDRN CC(C)S(=O)(=O)c1ccc(CN[C@H](C)c2ccccc2[N+](=O)[O-])cc1 ZINC000541952854 568271801 /nfs/dbraw/zinc/27/18/01/568271801.db2.gz XEGWKKDPURAGGS-CQSZACIVSA-N 0 0 362.451 3.628 20 5 FHBDRN CC[C@H](C)COc1cc([N+](=O)[O-])c(CN2CCC(F)(F)C2)cc1OC ZINC000541955912 568276649 /nfs/dbraw/zinc/27/66/49/568276649.db2.gz GMRBDNQXKAIBHE-LBPRGKRZSA-N 0 0 358.385 3.869 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)Nc1cc(-c2cccs2)[nH]n1 ZINC000120393300 568279258 /nfs/dbraw/zinc/27/92/58/568279258.db2.gz HGKCIUOOCFQTFP-UHFFFAOYSA-N 0 0 367.390 3.709 20 5 FHBDRN CCc1nc(C)c(CNCc2csc(-c3cccc([N+](=O)[O-])c3)n2)o1 ZINC000291732108 568283289 /nfs/dbraw/zinc/28/32/89/568283289.db2.gz JQTCBZRBGNCIFW-UHFFFAOYSA-N 0 0 358.423 3.867 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N[C@@H](C)c1ccc2n[nH]cc2c1 ZINC000482145438 568285137 /nfs/dbraw/zinc/28/51/37/568285137.db2.gz YOBPVHMBTXCHEM-LBPRGKRZSA-N 0 0 353.382 3.971 20 5 FHBDRN O=C(c1c[nH]c2cccc([N+](=O)[O-])c12)N1CCC(F)(c2ccccn2)CC1 ZINC000569130389 568285544 /nfs/dbraw/zinc/28/55/44/568285544.db2.gz NVLQQERKBLFIHI-UHFFFAOYSA-N 0 0 368.368 3.572 20 5 FHBDRN COc1ccc([C@H](NC(=O)COc2cc(C)ccc2[N+](=O)[O-])C2CC2)cc1 ZINC000026333657 568286096 /nfs/dbraw/zinc/28/60/96/568286096.db2.gz KLRCEVBHGQXIOP-HXUWFJFHSA-N 0 0 370.405 3.558 20 5 FHBDRN CNC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccc2[nH]c(C)c(C)c2c1 ZINC000604447907 568290710 /nfs/dbraw/zinc/29/07/10/568290710.db2.gz WLLOBWQMTCLHAW-UHFFFAOYSA-N 0 0 352.394 3.665 20 5 FHBDRN CCOC(=O)c1cc(NC(=O)c2cc(C)cc([N+](=O)[O-])c2)ccc1Cl ZINC000604449772 568291448 /nfs/dbraw/zinc/29/14/48/568291448.db2.gz HAEZPSOKTQPTLM-UHFFFAOYSA-N 0 0 362.769 3.986 20 5 FHBDRN CN(Cc1ccccc1N1CCCC1)C(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000152004195 568295426 /nfs/dbraw/zinc/29/54/26/568295426.db2.gz RLTRLFGKYGGFLW-UHFFFAOYSA-N 0 0 367.449 3.786 20 5 FHBDRN CC1(C)CCN(C(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)c2ccccc21 ZINC000569153052 568295443 /nfs/dbraw/zinc/29/54/43/568295443.db2.gz GJOQWABEOMTUKM-UHFFFAOYSA-N 0 0 354.362 3.652 20 5 FHBDRN Cc1ccccc1[C@@H]1CN(C(=O)[C@H](C)c2cccc([N+](=O)[O-])c2)[C@@H](C)CO1 ZINC000569061355 568295757 /nfs/dbraw/zinc/29/57/57/568295757.db2.gz RZDXDWBBEAXYNZ-YRNRMSPPSA-N 0 0 368.433 3.995 20 5 FHBDRN O=[N+]([O-])c1cc(F)ccc1NC[C@@H]1CCN(c2ccc(F)c(F)c2)C1 ZINC000604460111 568296121 /nfs/dbraw/zinc/29/61/21/568296121.db2.gz IKYGPPQZBRSWBK-NSHDSACASA-N 0 0 351.328 3.951 20 5 FHBDRN CC1(C)CN(C(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)[C@@H]1c1cccs1 ZINC000569164051 568298276 /nfs/dbraw/zinc/29/82/76/568298276.db2.gz YHPQWTARSIXCGY-OAHLLOKOSA-N 0 0 360.391 3.608 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)Nc2ccccc2C(C)=O)cc1SC ZINC000482164940 568299634 /nfs/dbraw/zinc/29/96/34/568299634.db2.gz QPPKYUANTUKOAA-UHFFFAOYSA-N 0 0 360.391 3.780 20 5 FHBDRN Cc1cc(Cc2noc([C@]3(F)CCN(C(C)(C)C)C3)n2)ccc1[N+](=O)[O-] ZINC000569159736 568300563 /nfs/dbraw/zinc/30/05/63/568300563.db2.gz XJBRHDYCOCEUGQ-SFHVURJKSA-N 0 0 362.405 3.546 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)[C@H]2CCN(c3ccccc3F)C2)cc1[N+](=O)[O-] ZINC000569160816 568300839 /nfs/dbraw/zinc/30/08/39/568300839.db2.gz ZQOAXMMBKHKFGC-HOCLYGCPSA-N 0 0 371.412 3.746 20 5 FHBDRN C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000482177645 568301867 /nfs/dbraw/zinc/30/18/67/568301867.db2.gz KDIQNTHESFWJIT-ZWNOBZJWSA-N 0 0 371.359 3.972 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CCCO[C@H]1CC(C)C ZINC000482181731 568302370 /nfs/dbraw/zinc/30/23/70/568302370.db2.gz OBSNORBQXWXBBF-NEWSRXKRSA-N 0 0 362.470 3.873 20 5 FHBDRN O=C(NC[C@@H]1CCCC[C@H]1C(F)(F)F)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000482193699 568310690 /nfs/dbraw/zinc/31/06/90/568310690.db2.gz PNJDEVRNJVDFJD-JOYOIKCWSA-N 0 0 370.331 3.570 20 5 FHBDRN CCCc1nc(C)c(CNCc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)o1 ZINC000291801758 568317368 /nfs/dbraw/zinc/31/73/68/568317368.db2.gz XINOFHNLVBOHED-UHFFFAOYSA-N 0 0 369.425 3.534 20 5 FHBDRN COc1ccc2ccc(C(=O)N3CCc4ccc([N+](=O)[O-])cc4C3)cc2c1 ZINC000569247456 568318990 /nfs/dbraw/zinc/31/89/90/568318990.db2.gz REQNZWGGSJXQSY-UHFFFAOYSA-N 0 0 362.385 3.955 20 5 FHBDRN O=C(N[C@@H]1CCCC[C@H]1O)c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1 ZINC000482221422 568321282 /nfs/dbraw/zinc/32/12/82/568321282.db2.gz ZGWBCUQAEOJZBM-QZTJIDSGSA-N 0 0 372.446 3.779 20 5 FHBDRN COc1cc(C(=O)NC[C@H]2CCCC[C@@H]2C(F)(F)F)ccc1[N+](=O)[O-] ZINC000482224103 568359058 /nfs/dbraw/zinc/35/90/58/568359058.db2.gz IMVSVQCFSBUQMZ-NEPJUHHUSA-N 0 0 360.332 3.702 20 5 FHBDRN Cc1nc2ccccc2c(S[C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])n1 ZINC000004240453 568376073 /nfs/dbraw/zinc/37/60/73/568376073.db2.gz UMFACPPYANXTKG-LLVKDONJSA-N 0 0 368.418 3.966 20 5 FHBDRN COc1ccc(NC(=O)COc2ccc(C(F)(F)F)cc2)cc1[N+](=O)[O-] ZINC000541999200 568378279 /nfs/dbraw/zinc/37/82/79/568378279.db2.gz RSIGSFOXVUFKQC-UHFFFAOYSA-N 0 0 370.283 3.640 20 5 FHBDRN CC(C)n1cnnc1S[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000005506196 568390399 /nfs/dbraw/zinc/39/03/99/568390399.db2.gz CZSIRDLNEFUYOX-JTQLQIEISA-N 0 0 360.399 3.671 20 5 FHBDRN COc1ccc(C(=O)NCCCO[C@@H](C)c2ccccc2)cc1[N+](=O)[O-] ZINC000054518969 568391066 /nfs/dbraw/zinc/39/10/66/568391066.db2.gz PBLCXFXHCSMTOX-AWEZNQCLSA-N 0 0 358.394 3.501 20 5 FHBDRN O=C(COCCc1ccccc1)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000541998450 568393075 /nfs/dbraw/zinc/39/30/75/568393075.db2.gz RCIWLJZYXGPKIH-UHFFFAOYSA-N 0 0 368.311 3.811 20 5 FHBDRN CN(CC(=O)Nc1cc(F)cc(F)c1)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000542000032 568394053 /nfs/dbraw/zinc/39/40/53/568394053.db2.gz JKIZSCWDIRZPDP-UHFFFAOYSA-N 0 0 369.755 3.597 20 5 FHBDRN COc1ccc(NC(=O)c2csc(Cc3ccccc3)n2)cc1[N+](=O)[O-] ZINC000542001332 568394110 /nfs/dbraw/zinc/39/41/10/568394110.db2.gz IUKAAGQICHCOCU-UHFFFAOYSA-N 0 0 369.402 3.903 20 5 FHBDRN COc1ccc(NC(=O)[C@H](C)Oc2cccc(Cl)c2)cc1[N+](=O)[O-] ZINC000541999053 568394330 /nfs/dbraw/zinc/39/43/30/568394330.db2.gz SVKNQVHGVYUGNB-JTQLQIEISA-N 0 0 350.758 3.663 20 5 FHBDRN COc1ccc(NC(=O)c2ccc(OC(F)(F)F)cc2)cc1[N+](=O)[O-] ZINC000541995403 568399313 /nfs/dbraw/zinc/39/93/13/568399313.db2.gz PWLSCRWRYWIQTP-UHFFFAOYSA-N 0 0 356.256 3.754 20 5 FHBDRN Cc1cc2cc(NC(=O)c3cc(Cl)cc([N+](=O)[O-])c3)ccc2n(C)c1=O ZINC000569395397 568400464 /nfs/dbraw/zinc/40/04/64/568400464.db2.gz SVVAVCNRBJIMKY-UHFFFAOYSA-N 0 0 371.780 3.661 20 5 FHBDRN COCC(C)(C)CCCNC(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC000291810599 568400569 /nfs/dbraw/zinc/40/05/69/568400569.db2.gz KEDJKKVEWMALBJ-UHFFFAOYSA-N 0 0 371.437 3.839 20 5 FHBDRN Cc1cccc(NC(=O)Cc2noc([C@@H](C)c3cccc([N+](=O)[O-])c3)n2)c1 ZINC000569409600 568401164 /nfs/dbraw/zinc/40/11/64/568401164.db2.gz JDTBHAIHWCGAKS-ZDUSSCGKSA-N 0 0 366.377 3.619 20 5 FHBDRN CCc1c(NC(=O)c2ccc(NC)c([N+](=O)[O-])c2)cnn1CCC(C)C ZINC000569417791 568401753 /nfs/dbraw/zinc/40/17/53/568401753.db2.gz YLHPNFUWMLRSEY-UHFFFAOYSA-N 0 0 359.430 3.694 20 5 FHBDRN C[C@@H](C(=O)N(C[C@@H](C)c1ccccc1)[C@@H](C)CO)c1cccc([N+](=O)[O-])c1 ZINC000569423639 568401781 /nfs/dbraw/zinc/40/17/81/568401781.db2.gz KAXORHGCIUMXAW-IXDOHACOSA-N 0 0 370.449 3.711 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])N1C[C@H](c2ccccc2)[C@H]2CCC[C@@H]21 ZINC000569484184 568403226 /nfs/dbraw/zinc/40/32/26/568403226.db2.gz CONDUDQFDHAHIE-GGPKGHCWSA-N 0 0 350.418 3.932 20 5 FHBDRN CCc1ccc(C(=O)N(Cc2ccccc2)[C@@H](CC)CO)cc1[N+](=O)[O-] ZINC000569620841 568410402 /nfs/dbraw/zinc/41/04/02/568410402.db2.gz GTSNLUXMPJOWAD-SFHVURJKSA-N 0 0 356.422 3.571 20 5 FHBDRN COc1cccc([N+](=O)[O-])c1N1CCC(c2nc3ccccc3[nH]2)CC1 ZINC000569646875 568411170 /nfs/dbraw/zinc/41/11/70/568411170.db2.gz UFACRSPXKWYGBL-UHFFFAOYSA-N 0 0 352.394 3.864 20 5 FHBDRN COCCO[C@@H]1CCCN(c2cc(C)c(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000569829576 568427961 /nfs/dbraw/zinc/42/79/61/568427961.db2.gz JWIGIGYMPXWCDI-GFCCVEGCSA-N 0 0 362.348 3.554 20 5 FHBDRN O=C(COc1ccc(Cl)cc1[N+](=O)[O-])N1CCC[C@H]2CCCC[C@H]21 ZINC000007024307 568428152 /nfs/dbraw/zinc/42/81/52/568428152.db2.gz JTOPYZAAJZUCIA-TZMCWYRMSA-N 0 0 352.818 3.808 20 5 FHBDRN O=C(COc1ccc(Cl)cc1[N+](=O)[O-])N1CCC[C@@H]2CCCC[C@@H]21 ZINC000007024306 568428193 /nfs/dbraw/zinc/42/81/93/568428193.db2.gz JTOPYZAAJZUCIA-JSGCOSHPSA-N 0 0 352.818 3.808 20 5 FHBDRN Cc1cc(NC[C@H]2CCC[N@@H+]2C2CCCCC2)cc(C(=O)[O-])c1[N+](=O)[O-] ZINC000569852024 568439117 /nfs/dbraw/zinc/43/91/17/568439117.db2.gz OYBWWDGTQHRTAI-MRXNPFEDSA-N 0 0 361.442 3.810 20 5 FHBDRN COc1ccc([C@@H](C)NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])cc1F ZINC000007073810 568441277 /nfs/dbraw/zinc/44/12/77/568441277.db2.gz RDRBOTXMMYQWNB-SECBINFHSA-N 0 0 352.749 3.887 20 5 FHBDRN COc1ccc([C@H](C)NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])cc1F ZINC000007073806 568441338 /nfs/dbraw/zinc/44/13/38/568441338.db2.gz RDRBOTXMMYQWNB-VIFPVBQESA-N 0 0 352.749 3.887 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)N1CCc2sc(Cl)cc2C1 ZINC000569974244 568445373 /nfs/dbraw/zinc/44/53/73/568445373.db2.gz DVXSXIAYQHTKGY-UHFFFAOYSA-N 0 0 368.867 3.987 20 5 FHBDRN COc1cc2c(cc1Cl)CN(C(=O)c1cc(C)cc([N+](=O)[O-])c1)CC2 ZINC000570121425 568452371 /nfs/dbraw/zinc/45/23/71/568452371.db2.gz SMAFCYOHIMRGEC-UHFFFAOYSA-N 0 0 360.797 3.764 20 5 FHBDRN COc1ccc(CSCC(=O)N(C)[C@H]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000033101950 568458531 /nfs/dbraw/zinc/45/85/31/568458531.db2.gz BHBHFTRJHHPLKM-ZFWWWQNUSA-N 0 0 366.483 3.874 20 5 FHBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCCC[C@H]1O ZINC000482230931 568458863 /nfs/dbraw/zinc/45/88/63/568458863.db2.gz VDOGPVDVXLUIOZ-HUUCEWRRSA-N 0 0 352.456 3.520 20 5 FHBDRN O=C(c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)N1CCC[C@@H]1c1ccccc1 ZINC000033242883 568471356 /nfs/dbraw/zinc/47/13/56/568471356.db2.gz VRRDEGCYBWLNSW-QGZVFWFLSA-N 0 0 362.389 3.758 20 5 FHBDRN Cc1ccccc1[C@@H](C(=O)[O-])[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000570577124 568487394 /nfs/dbraw/zinc/48/73/94/568487394.db2.gz SYKIMBDKGITQCY-IBGZPJMESA-N 0 0 370.405 3.572 20 5 FHBDRN CCN(CCCNC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000007367875 568503279 /nfs/dbraw/zinc/50/32/79/568503279.db2.gz WSGGEDJIRQMTKM-UHFFFAOYSA-N 0 0 361.829 3.895 20 5 FHBDRN COc1ccc(OCC(=O)N[C@@H](CC(C)C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000007441927 568511033 /nfs/dbraw/zinc/51/10/33/568511033.db2.gz OAXYMIHZIJIKKG-KRWDZBQOSA-N 0 0 372.421 3.886 20 5 FHBDRN Cc1nc(C2(NC(=O)Nc3cc(C)c([N+](=O)[O-])cc3C)CCCCC2)no1 ZINC000482244752 568522537 /nfs/dbraw/zinc/52/25/37/568522537.db2.gz RQKQQCPSXVQYEX-UHFFFAOYSA-N 0 0 373.413 3.884 20 5 FHBDRN Cc1nc(-c2ccccc2NC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)no1 ZINC000365363377 568567719 /nfs/dbraw/zinc/56/77/19/568567719.db2.gz ORAJXJORSVSOFT-UHFFFAOYSA-N 0 0 372.768 3.788 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N(C)[C@H](C)c1ccccc1Cl ZINC000055267781 568604136 /nfs/dbraw/zinc/60/41/36/568604136.db2.gz QFIXARUJJXRMLS-GFCCVEGCSA-N 0 0 368.842 3.938 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCN(c3ccccc3O)CC2)c(C(F)(F)F)c1 ZINC000049980444 568636839 /nfs/dbraw/zinc/63/68/39/568636839.db2.gz XBNDREGZZBWPED-UHFFFAOYSA-N 0 0 367.327 3.646 20 5 FHBDRN C[C@H](C(=O)N(Cc1ncc[nH]1)c1cccc(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000570904506 568639815 /nfs/dbraw/zinc/63/98/15/568639815.db2.gz GFHTWARRDNLRHS-ZDUSSCGKSA-N 0 0 368.368 3.794 20 5 FHBDRN O=[N+]([O-])c1ccc(N[C@@H]2C[C@@H]2c2c(F)cccc2Cl)c(-c2nn[nH]n2)c1 ZINC000738371900 598972322 /nfs/dbraw/zinc/97/23/22/598972322.db2.gz YTYLWSKEPFOQHZ-LKFCYVNXSA-N 0 0 374.763 3.535 20 5 FHBDRN Cc1ccccc1[C@H](Nc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-])C1CC1 ZINC000737425085 598774644 /nfs/dbraw/zinc/77/46/44/598774644.db2.gz YSZPFBQOPBYYLP-QGZVFWFLSA-N 0 0 350.382 3.647 20 5 FHBDRN CC(C)(C)CCCNc1cc(-c2nn[nH]n2)c2cc([N+](=O)[O-])ccc2n1 ZINC000819907749 599565735 /nfs/dbraw/zinc/56/57/35/599565735.db2.gz RCXRXFPQXDEANS-UHFFFAOYSA-N 0 0 355.402 3.561 20 5 FHBDRN CCc1ccc([C@@H]2CCCCN2c2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])o1 ZINC000821481504 599579144 /nfs/dbraw/zinc/57/91/44/599579144.db2.gz KPUHHLWKKMDTDG-HNNXBMFYSA-N 0 0 368.397 3.662 20 5 FHBDRN Cc1cc(NC2CC[NH+](Cc3ccccc3)CC2)cc(C(=O)[O-])c1[N+](=O)[O-] ZINC000577377668 601544329 /nfs/dbraw/zinc/54/43/29/601544329.db2.gz UOASZSLPZUJXFT-UHFFFAOYSA-N 0 0 369.421 3.678 20 5 FHBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](c1ccccc1)[C@H](C)C(=O)[O-] ZINC000827058533 601657976 /nfs/dbraw/zinc/65/79/76/601657976.db2.gz IWMSLXDDIHIPHC-IFXJQAMLSA-N 0 0 372.421 3.934 20 5 FHBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](c1ccccc1)[C@@H](C)C(=O)[O-] ZINC000827058532 601658174 /nfs/dbraw/zinc/65/81/74/601658174.db2.gz IWMSLXDDIHIPHC-AUUYWEPGSA-N 0 0 372.421 3.934 20 5 FHBDRN Cc1ccc([C@@H](CNc2cc(C)c([N+](=O)[O-])c(C(=O)[O-])c2)[NH+]2CCCC2)o1 ZINC000566291492 602315222 /nfs/dbraw/zinc/31/52/22/602315222.db2.gz KFPNRNOJQYRFBV-MRXNPFEDSA-N 0 0 373.409 3.752 20 5 FHBDRN O=C([O-])[C@@H]1CCC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000263421148 604524023 /nfs/dbraw/zinc/52/40/23/604524023.db2.gz OXLVVHPHYGVNRV-AWEZNQCLSA-N 0 0 350.758 3.557 20 5 FHBDRN O=[N+]([O-])c1ccc2oc(C(Cl)=Cc3cccc(-c4nn[nH]n4)c3)nc2c1 ZINC000823645987 606339749 /nfs/dbraw/zinc/33/97/49/606339749.db2.gz YZLFQRGSBYCJLG-KPKJPENVSA-N 0 0 368.740 3.653 20 5 FHBDRN O=[N+]([O-])c1cccc2nc(C=Cc3ccc(-c4nn[nH]n4)s3)ccc21 ZINC000823648321 606389921 /nfs/dbraw/zinc/38/99/21/606389921.db2.gz ULUBPOYPJYYIDL-XQRVVYSFSA-N 0 0 350.363 3.555 20 5 FHBDRN O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1N1CCCC[C@@H]1c1ccc(F)cc1 ZINC000823629701 606476820 /nfs/dbraw/zinc/47/68/20/606476820.db2.gz FHQHRPBMLJRZAD-OAHLLOKOSA-N 0 0 368.372 3.646 20 5 FHBDRN CC[C@@H](Nc1c(F)cc(-c2nn[nH]n2)cc1F)c1cccc([N+](=O)[O-])c1 ZINC000820924835 606479070 /nfs/dbraw/zinc/47/90/70/606479070.db2.gz ACKYFXBJRDBOHU-CQSZACIVSA-N 0 0 360.324 3.616 20 5 FHBDRN O=C(NCc1cc(F)cc(F)c1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000431508218 936313355 /nfs/dbraw/zinc/31/33/55/936313355.db2.gz QFICSGXHWXMONU-UHFFFAOYSA-N 0 0 371.137 3.566 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N2CCO[C@@H](c3cccs3)C2)c1 ZINC000161930986 936323843 /nfs/dbraw/zinc/32/38/43/936323843.db2.gz HOEBFFCZGXPSFT-CQSZACIVSA-N 0 0 364.448 3.592 20 5 FHBDRN CCOc1cc(C(=O)Nc2ccc(C)c(C(C)=O)c2)c([N+](=O)[O-])cc1OC ZINC000582972917 936337244 /nfs/dbraw/zinc/33/72/44/936337244.db2.gz LJZWJDMMIJGHLG-UHFFFAOYSA-N 0 0 372.377 3.765 20 5 FHBDRN CC[C@@](C)(CO)NC(=O)c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1 ZINC000543850973 936337255 /nfs/dbraw/zinc/33/72/55/936337255.db2.gz KLRVXSAMHBDXRK-SFHVURJKSA-N 0 0 360.435 3.637 20 5 FHBDRN Cc1ccc(S(=O)(=O)N2CC[C@H]2c2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000511220581 936339157 /nfs/dbraw/zinc/33/91/57/936339157.db2.gz BOVJZMKOBKXDLN-HNNXBMFYSA-N 0 0 366.826 3.692 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(-c2nc(C(C)(C)c3ccc(Cl)cc3)no2)n1 ZINC000582991382 936352501 /nfs/dbraw/zinc/35/25/01/936352501.db2.gz NAYGIVUHROHVST-UHFFFAOYSA-N 0 0 361.789 3.841 20 5 FHBDRN CS(=O)(=O)c1cccc(NC[C@@H](c2ccccc2)C2CC2)c1[N+](=O)[O-] ZINC000431513283 936360744 /nfs/dbraw/zinc/36/07/44/936360744.db2.gz KMWGWMBOQQXTGP-HNNXBMFYSA-N 0 0 360.435 3.604 20 5 FHBDRN CCOc1ccc(C(=O)Nc2ccc(C)c(NC(C)=O)c2)cc1[N+](=O)[O-] ZINC000048887405 936388017 /nfs/dbraw/zinc/38/80/17/936388017.db2.gz LLTXVKJUMMWQBK-UHFFFAOYSA-N 0 0 357.366 3.513 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H](c1cccnc1)C(C)C ZINC000439884592 945063744 /nfs/dbraw/zinc/06/37/44/945063744.db2.gz VOAOMSPDIVXOIB-INIZCTEOSA-N 0 0 372.425 3.950 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N(C)Cc1cc(F)cc(F)c1 ZINC000439901780 945067836 /nfs/dbraw/zinc/06/78/36/945067836.db2.gz NSQYDDPTJFOYRN-UHFFFAOYSA-N 0 0 365.336 3.936 20 5 FHBDRN COc1ccc(N(C)C(=O)c2ccc([N+](=O)[O-])cc2OC)cc1Cl ZINC000427084953 945068066 /nfs/dbraw/zinc/06/80/66/945068066.db2.gz BNERCRXTTOFMKX-UHFFFAOYSA-N 0 0 350.758 3.542 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@H]1Cc1ccccc1 ZINC000439903707 945068081 /nfs/dbraw/zinc/06/80/81/945068081.db2.gz RCGUKMGRPOQBRS-HNNXBMFYSA-N 0 0 355.394 3.842 20 5 FHBDRN CC[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1)c1c(C)noc1C ZINC000161510412 937086785 /nfs/dbraw/zinc/08/67/85/937086785.db2.gz AOBHVBDRBAXNPD-INIZCTEOSA-N 0 0 372.425 3.681 20 5 FHBDRN CC[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1)c1c(C)noc1C ZINC000161510486 937086807 /nfs/dbraw/zinc/08/68/07/937086807.db2.gz AOBHVBDRBAXNPD-MRXNPFEDSA-N 0 0 372.425 3.681 20 5 FHBDRN CC(C)[C@H](CNC(=O)CSc1ccc([N+](=O)[O-])cn1)c1ccccc1 ZINC000178764124 937096743 /nfs/dbraw/zinc/09/67/43/937096743.db2.gz CZAAPXAZTHHSES-INIZCTEOSA-N 0 0 359.451 3.638 20 5 FHBDRN O=[N+]([O-])c1ccc(OCCCSc2ccc(C(F)(F)F)nn2)cc1 ZINC000186873435 927048040 /nfs/dbraw/zinc/04/80/40/927048040.db2.gz VPZUIDCHFNOKFO-UHFFFAOYSA-N 0 0 359.329 3.965 20 5 FHBDRN CC(=O)c1ccc(N2CCC([C@@H](O)c3ccccc3)CC2)c([N+](=O)[O-])c1 ZINC000023357135 927056806 /nfs/dbraw/zinc/05/68/06/927056806.db2.gz FZZPHRCAPWGWMG-FQEVSTJZSA-N 0 0 354.406 3.747 20 5 FHBDRN COC(=O)c1cc(C)nc(N[C@H](c2ccccc2C)C2CC2)c1[N+](=O)[O-] ZINC000557567838 927057620 /nfs/dbraw/zinc/05/76/20/927057620.db2.gz MYFRAGRLVYXEAS-INIZCTEOSA-N 0 0 355.394 3.956 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCCCn1cnc2ccccc21 ZINC000120077484 927076413 /nfs/dbraw/zinc/07/64/13/927076413.db2.gz SSWLQPKPHKJQSD-UHFFFAOYSA-N 0 0 367.409 3.773 20 5 FHBDRN CCC[C@@H](Cc1ccccc1)NC(=O)c1cc(OC)c(OC)c([N+](=O)[O-])c1 ZINC000610173989 927119374 /nfs/dbraw/zinc/11/93/74/927119374.db2.gz APNUDWOEIAXGHR-INIZCTEOSA-N 0 0 372.421 3.753 20 5 FHBDRN C[C@H](c1ccccc1)[C@@](C)(O)C(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000176411465 937136356 /nfs/dbraw/zinc/13/63/56/937136356.db2.gz QJLXPGLRDIQMSI-IIBYNOLFSA-N 0 0 370.449 3.588 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)Nc1nc2cc(C)ccc2n1CC ZINC000471104131 927123914 /nfs/dbraw/zinc/12/39/14/927123914.db2.gz NASPDHRWMAOGTC-UHFFFAOYSA-N 0 0 368.393 3.924 20 5 FHBDRN COc1ccc(COCCNC(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)cc1 ZINC000120090417 927139757 /nfs/dbraw/zinc/13/97/57/927139757.db2.gz GGOSNIJUKGCVSN-UHFFFAOYSA-N 0 0 373.409 3.559 20 5 FHBDRN C[C@H](CNC(=O)NCc1ccc([N+](=O)[O-])cc1)Oc1ccccc1Cl ZINC000175262701 927141438 /nfs/dbraw/zinc/14/14/38/927141438.db2.gz CHOIPETZDUPTTI-GFCCVEGCSA-N 0 0 363.801 3.515 20 5 FHBDRN CCCn1ccc2ccc(NC(=O)CCn3nc(C)c([N+](=O)[O-])c3C)cc21 ZINC000175269934 927147216 /nfs/dbraw/zinc/14/72/16/927147216.db2.gz NPQVQRIKZNYXTJ-UHFFFAOYSA-N 0 0 369.425 3.802 20 5 FHBDRN CCC[C@H]1CCCC[C@H]1NC(=O)c1cc(OC)c(OC)c([N+](=O)[O-])c1 ZINC000610174205 927170503 /nfs/dbraw/zinc/17/05/03/927170503.db2.gz POZJBSCFSCLHMV-GXTWGEPZSA-N 0 0 350.415 3.701 20 5 FHBDRN CCOC(=O)c1cc(C(=O)N2CCc3c2cccc3Cl)cc([N+](=O)[O-])c1 ZINC000157484575 927173525 /nfs/dbraw/zinc/17/35/25/927173525.db2.gz OMEFTVBEDHZMLE-UHFFFAOYSA-N 0 0 374.780 3.628 20 5 FHBDRN CN(C[C@@H]1CCCC[C@@H]1O)C(=O)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000278088547 937142160 /nfs/dbraw/zinc/14/21/60/937142160.db2.gz PXMYZIRQRHOFOD-LIRRHRJNSA-N 0 0 364.445 3.717 20 5 FHBDRN COc1ccc(C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)c(Br)c1 ZINC000133638439 927217824 /nfs/dbraw/zinc/21/78/24/927217824.db2.gz NAEFHLYWIWYSGM-UHFFFAOYSA-N 0 0 365.183 3.927 20 5 FHBDRN CCc1ccc(OC[C@@H](O)COCc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000579727107 927220153 /nfs/dbraw/zinc/22/01/53/927220153.db2.gz NQJYMXZOAYRDPF-HNNXBMFYSA-N 0 0 365.813 3.767 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)NCc1cc2c(s1)CCCC2 ZINC000577557243 927242814 /nfs/dbraw/zinc/24/28/14/927242814.db2.gz JJLHHWFNHJSWNI-UHFFFAOYSA-N 0 0 360.435 3.864 20 5 FHBDRN COc1ccccc1N(CC(=O)Nc1cc([N+](=O)[O-])ccc1C)C(C)C ZINC000577563758 927246769 /nfs/dbraw/zinc/24/67/69/927246769.db2.gz BDINXMOANRHWNY-UHFFFAOYSA-N 0 0 357.410 3.765 20 5 FHBDRN Cc1c(CC(=O)N[C@@H]2CCC[C@H]2OCc2ccccc2)cccc1[N+](=O)[O-] ZINC000133656163 927350994 /nfs/dbraw/zinc/35/09/94/927350994.db2.gz DWCZOSDXQXVABC-UYAOXDASSA-N 0 0 368.433 3.700 20 5 FHBDRN CC1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000598445034 927362140 /nfs/dbraw/zinc/36/21/40/927362140.db2.gz QCAWWTWARPOFED-VGPLMAKISA-N 0 0 367.243 3.689 20 5 FHBDRN Cc1ncc(-c2ccc(NC(=O)COc3ccc([N+](=O)[O-])c(C)c3)cc2)o1 ZINC000430154774 927386429 /nfs/dbraw/zinc/38/64/29/927386429.db2.gz YCLAJHCZKFCTQD-UHFFFAOYSA-N 0 0 367.361 3.884 20 5 FHBDRN COc1ccccc1[C@]1(C)C[C@H]1NC(=O)c1cc(SC)ccc1[N+](=O)[O-] ZINC000610181624 927400422 /nfs/dbraw/zinc/40/04/22/927400422.db2.gz FEHJHTCEHNFMLV-MJGOQNOKSA-N 0 0 372.446 3.785 20 5 FHBDRN CCc1c(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cnn1CC(C)C ZINC000157497564 927418571 /nfs/dbraw/zinc/41/85/71/927418571.db2.gz XZPQVUBDAYHZIG-UHFFFAOYSA-N 0 0 350.806 3.915 20 5 FHBDRN CC(=O)N1CCc2cc(NCc3ccccc3C3CC3)cc([N+](=O)[O-])c21 ZINC001167052349 927432926 /nfs/dbraw/zinc/43/29/26/927432926.db2.gz MKFDPGQMMMPKLH-UHFFFAOYSA-N 0 0 351.406 3.993 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCOCc1ccccc1 ZINC000176441737 937165108 /nfs/dbraw/zinc/16/51/08/937165108.db2.gz LAGWBSDUNCANQU-UHFFFAOYSA-N 0 0 371.437 3.732 20 5 FHBDRN CCC[C@@H]1[C@@H](C)CCCN1C(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000175289850 927457243 /nfs/dbraw/zinc/45/72/43/927457243.db2.gz CZWNHOHALLHLGW-GXTWGEPZSA-N 0 0 350.415 3.653 20 5 FHBDRN Cc1ccc(Oc2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3F)cc2)nn1 ZINC000610184100 927482386 /nfs/dbraw/zinc/48/23/86/927482386.db2.gz FERDABVSDXJBJW-UHFFFAOYSA-N 0 0 368.324 3.877 20 5 FHBDRN Cc1noc(C)c1[C@H](C)NC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000122077143 937171255 /nfs/dbraw/zinc/17/12/55/937171255.db2.gz DEGWBAIDBNBSQU-NSHDSACASA-N 0 0 358.398 3.635 20 5 FHBDRN Cc1cc(NC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)ccc1OC(C)C ZINC000610186096 927571379 /nfs/dbraw/zinc/57/13/79/927571379.db2.gz BSZJQLPOLDDROF-UHFFFAOYSA-N 0 0 358.350 3.671 20 5 FHBDRN C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCC(c2ccsc2)CC1 ZINC000186913767 927573711 /nfs/dbraw/zinc/57/37/11/927573711.db2.gz QTMCRGXGRHMHPA-CYBMUJFWSA-N 0 0 359.451 3.863 20 5 FHBDRN CC[C@@H](C)[C@H](NC(=O)CCn1cc([N+](=O)[O-])cn1)c1ccc(Cl)cc1 ZINC000610187471 927713977 /nfs/dbraw/zinc/71/39/77/927713977.db2.gz RODOBIDJGSQSKD-PXAZEXFGSA-N 0 0 364.833 3.738 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N2[C@H](C)C[C@@H]3CCCC[C@H]32)cc1OC ZINC000246866733 927735476 /nfs/dbraw/zinc/73/54/76/927735476.db2.gz WGCABOXZWDMMEI-VNHYZAJKSA-N 0 0 362.426 3.795 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@](C)(C1CC1)C(F)(F)F ZINC000471137219 927746379 /nfs/dbraw/zinc/74/63/79/927746379.db2.gz OONNHTAWWVOTQC-LKFCYVNXSA-N 0 0 362.373 3.923 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)NCc1cccc(C(F)(F)F)c1 ZINC000043076681 927773295 /nfs/dbraw/zinc/77/32/95/927773295.db2.gz RJDKNFGDPXOZJE-UHFFFAOYSA-N 0 0 367.327 3.955 20 5 FHBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1Cc2ccccc2C[C@@H]1C ZINC000610189198 927775999 /nfs/dbraw/zinc/77/59/99/927775999.db2.gz WYMVSIHCFHMQSR-STQMWFEESA-N 0 0 374.824 3.989 20 5 FHBDRN C[C@]1(CNC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)CCCC[C@H]1O ZINC000278107738 937194479 /nfs/dbraw/zinc/19/44/79/937194479.db2.gz KAMVRABHRKCKHJ-XMSQKQJNSA-N 0 0 364.445 3.765 20 5 FHBDRN CN(CCc1cccs1)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000175306195 927819420 /nfs/dbraw/zinc/81/94/20/927819420.db2.gz IKZCWJPPKKZJFZ-UHFFFAOYSA-N 0 0 371.365 3.964 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1C[C@@]1(C)c1ccccc1 ZINC000610190646 927820861 /nfs/dbraw/zinc/82/08/61/927820861.db2.gz RJBLKRSJKJRFLN-IXDGSTSKSA-N 0 0 356.447 3.922 20 5 FHBDRN C/C(=C/C(=O)OCc1nnc(C2CC2)n1C1CC1)c1ccc([N+](=O)[O-])cc1 ZINC000784930154 927849331 /nfs/dbraw/zinc/84/93/31/927849331.db2.gz CZVAFKAHBHALDB-BENRWUELSA-N 0 0 368.393 3.545 20 5 FHBDRN C[C@H](CNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21)Cc1cccs1 ZINC000610191361 927858921 /nfs/dbraw/zinc/85/89/21/927858921.db2.gz MREKSKUYBLPOLJ-ZDUSSCGKSA-N 0 0 357.435 3.606 20 5 FHBDRN COc1ccc(CC(=O)N[C@H]2CCCc3c(C)cccc32)cc1[N+](=O)[O-] ZINC000598480584 927869631 /nfs/dbraw/zinc/86/96/31/927869631.db2.gz WFFHNAHPVNJOOA-KRWDZBQOSA-N 0 0 354.406 3.648 20 5 FHBDRN CCOC(=O)/C=C/c1ccc(NC(=O)c2cc(F)cc(C)c2[N+](=O)[O-])cc1 ZINC000175731512 927876907 /nfs/dbraw/zinc/87/69/07/927876907.db2.gz QDWBWUXYLWPMCY-RMKNXTFCSA-N 0 0 372.352 3.871 20 5 FHBDRN C[C@@H]1CO[C@@H](c2cccc(Cl)c2)CN1C(=O)c1cccc([N+](=O)[O-])c1 ZINC000187062632 927878871 /nfs/dbraw/zinc/87/88/71/927878871.db2.gz VPFKGPZGVIWNGD-SJKOYZFVSA-N 0 0 360.797 3.850 20 5 FHBDRN CSc1cccc(C(=O)Nc2c(C)c(C(F)(F)F)nn2C)c1[N+](=O)[O-] ZINC000187078716 927901913 /nfs/dbraw/zinc/90/19/13/927901913.db2.gz SPMHZEYZMHQKOO-UHFFFAOYSA-N 0 0 374.344 3.630 20 5 FHBDRN O=C(NCc1coc(-c2ccccc2)n1)c1c[nH]c2cc([N+](=O)[O-])ccc21 ZINC000610200624 927951116 /nfs/dbraw/zinc/95/11/16/927951116.db2.gz PDKKJRIEAFJFOU-UHFFFAOYSA-N 0 0 362.345 3.661 20 5 FHBDRN C[C@H](Sc1ccccn1)C(=O)OCCSc1ccc([N+](=O)[O-])cc1 ZINC000784932906 927995355 /nfs/dbraw/zinc/99/53/55/927995355.db2.gz AWEZZLHQRMNIKF-LBPRGKRZSA-N 0 0 364.448 3.806 20 5 FHBDRN Cc1cccc2c(CCNC(=O)c3c[nH]c4cc([N+](=O)[O-])ccc34)c[nH]c21 ZINC000610204111 928016866 /nfs/dbraw/zinc/01/68/66/928016866.db2.gz AUAADQAGEBQSHB-UHFFFAOYSA-N 0 0 362.389 3.838 20 5 FHBDRN C[C@@]1(c2ccccc2)C[C@@H]1NC(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000610204790 928034118 /nfs/dbraw/zinc/03/41/18/928034118.db2.gz CLZJWGDXOBOOMY-ICSRJNTNSA-N 0 0 353.422 3.633 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1CN(Cc1ccnc(OC(C)C)c1)C1CC1 ZINC000430208592 928074779 /nfs/dbraw/zinc/07/47/79/928074779.db2.gz PFFOZTFXGGPHKP-UHFFFAOYSA-N 0 0 371.437 3.950 20 5 FHBDRN COc1cc(C(=O)N2CCS[C@H]2c2ccc([N+](=O)[O-])cc2)ccc1C ZINC000610209856 928076784 /nfs/dbraw/zinc/07/67/84/928076784.db2.gz JHNYDSXUYJRZIF-SFHVURJKSA-N 0 0 358.419 3.800 20 5 FHBDRN O=C1[C@@H](Nc2ccc(F)cc2[N+](=O)[O-])CCCN1c1ccccc1Cl ZINC000610211035 928081350 /nfs/dbraw/zinc/08/13/50/928081350.db2.gz NDORORNYMGYZLH-AWEZNQCLSA-N 0 0 363.776 3.995 20 5 FHBDRN Cc1ccc(OCC(=O)N2CCS[C@@H]2c2ccc([N+](=O)[O-])cc2)cc1 ZINC000610210491 928089581 /nfs/dbraw/zinc/08/95/81/928089581.db2.gz VZBXJWBFEXPJCC-GOSISDBHSA-N 0 0 358.419 3.556 20 5 FHBDRN CC[C@@](C)(NC(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1)c1nccs1 ZINC000154094981 928134922 /nfs/dbraw/zinc/13/49/22/928134922.db2.gz HZUDZBTUPSDWEN-BDJLRTHQSA-N 0 0 365.480 3.974 20 5 FHBDRN O=C(C[C@@H]1OCCc2ccccc21)OCCSc1ccc([N+](=O)[O-])cc1 ZINC000784938048 928152773 /nfs/dbraw/zinc/15/27/73/928152773.db2.gz LTELKTMDDNRBMU-SFHVURJKSA-N 0 0 373.430 3.934 20 5 FHBDRN O=[N+]([O-])c1ccc2oc(CSc3ncn(-c4ccccc4)n3)nc2c1 ZINC000083091800 928169901 /nfs/dbraw/zinc/16/99/01/928169901.db2.gz ZGRNDGYERIJFDI-UHFFFAOYSA-N 0 0 353.363 3.609 20 5 FHBDRN CCCC[C@@H](NC(=O)c1ccc(N)c([N+](=O)[O-])c1)c1ccc(OC)cc1 ZINC000728552060 937224485 /nfs/dbraw/zinc/22/44/85/937224485.db2.gz SDLGOWDEWSWDGQ-QGZVFWFLSA-N 0 0 357.410 3.847 20 5 FHBDRN Cc1c(NC(=O)CCN(CC2CCC2)CC(F)(F)F)cccc1[N+](=O)[O-] ZINC000178817837 937227644 /nfs/dbraw/zinc/22/76/44/937227644.db2.gz IZRCCYLBLAFBIG-UHFFFAOYSA-N 0 0 373.375 3.896 20 5 FHBDRN Cc1c(NC(=O)C(=O)N2CCCC[C@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000430219978 928271733 /nfs/dbraw/zinc/27/17/33/928271733.db2.gz AVSMVBNKVLBLNK-SFHVURJKSA-N 0 0 367.405 3.596 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1CN1C[C@H](C)O[C@@H](c2ccc(F)cc2)C1 ZINC000430224537 928279558 /nfs/dbraw/zinc/27/95/58/928279558.db2.gz ZLOVYCDJCHHUON-ORAYPTAESA-N 0 0 360.385 3.705 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)N1CCc2c3ccccc3[nH]c2C1 ZINC000126915837 928284992 /nfs/dbraw/zinc/28/49/92/928284992.db2.gz VMDDVHWZNWAFOM-UHFFFAOYSA-N 0 0 367.430 3.753 20 5 FHBDRN C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N(C)Cc1cc2ccccc2o1 ZINC000472282003 937234077 /nfs/dbraw/zinc/23/40/77/937234077.db2.gz DTTCNKRXFJXVFK-CYBMUJFWSA-N 0 0 353.378 3.800 20 5 FHBDRN Cc1c(C(=O)N(CC(=O)Nc2ccc(F)cc2)C(C)C)cccc1[N+](=O)[O-] ZINC000248120349 937234435 /nfs/dbraw/zinc/23/44/35/937234435.db2.gz RGDVLDPHWJMPRE-UHFFFAOYSA-N 0 0 373.384 3.532 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)Nc2c3c(nn2-c2ccccc2)CCC3)c1 ZINC000610222544 928293898 /nfs/dbraw/zinc/29/38/98/928293898.db2.gz WLHYILMPNFWFAA-UHFFFAOYSA-N 0 0 362.389 3.830 20 5 FHBDRN CCN(C(=O)Cc1cccc([N+](=O)[O-])c1)c1ccc(Br)cc1 ZINC000610223486 928302912 /nfs/dbraw/zinc/30/29/12/928302912.db2.gz NOTPILHDSMAFJD-UHFFFAOYSA-N 0 0 363.211 3.953 20 5 FHBDRN CCN(CC)C(=O)Cc1ccc(NC(=O)c2cc(C)ccc2[N+](=O)[O-])cc1 ZINC000610223620 928303075 /nfs/dbraw/zinc/30/30/75/928303075.db2.gz HXGYSPSWXCOBFA-UHFFFAOYSA-N 0 0 369.421 3.566 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1CN(Cc1ccccc1)C[C@@H]1CCCO1 ZINC000430229532 928322648 /nfs/dbraw/zinc/32/26/48/928322648.db2.gz XXIMJQZMHLDFBU-IBGZPJMESA-N 0 0 356.422 3.785 20 5 FHBDRN Cc1ccnc(C(=O)Nc2ccc(OCc3ccccc3)cc2[N+](=O)[O-])n1 ZINC000471162327 928329132 /nfs/dbraw/zinc/32/91/32/928329132.db2.gz VPXBNOABOAMJDE-UHFFFAOYSA-N 0 0 364.361 3.525 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N(Cc2cccc(F)c2)C[C@@H]2CCCO2)c1 ZINC000610226466 928334594 /nfs/dbraw/zinc/33/45/94/928334594.db2.gz HLVHOCSOIRBPRD-KRWDZBQOSA-N 0 0 372.396 3.864 20 5 FHBDRN O=C(CSC[C@@H]1CCCCO1)OCCSc1ccc([N+](=O)[O-])cc1 ZINC000784940218 928343205 /nfs/dbraw/zinc/34/32/05/928343205.db2.gz YXAULEBDQXXOOD-AWEZNQCLSA-N 0 0 371.480 3.532 20 5 FHBDRN Cc1c(Br)cc(C(=O)N2CCSC(C)(C)C2)cc1[N+](=O)[O-] ZINC000126995616 928380108 /nfs/dbraw/zinc/38/01/08/928380108.db2.gz GJUYWZNAYOTJQD-UHFFFAOYSA-N 0 0 373.272 3.633 20 5 FHBDRN COc1ccc(-c2nc(COc3cc([N+](=O)[O-])ccc3OC)co2)cc1 ZINC000022842311 928389337 /nfs/dbraw/zinc/38/93/37/928389337.db2.gz ATXXZGHCYCRMFK-UHFFFAOYSA-N 0 0 356.334 3.846 20 5 FHBDRN Cc1cc(Br)ccc1NC(=O)c1cc(F)cc([N+](=O)[O-])c1N ZINC000319019665 928417308 /nfs/dbraw/zinc/41/73/08/928417308.db2.gz DGHFAUMQMIZPSU-UHFFFAOYSA-N 0 0 368.162 3.639 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1CN[C@H](C)c1nc(C(F)(F)F)cs1 ZINC000430243367 928429171 /nfs/dbraw/zinc/42/91/71/928429171.db2.gz KXJYSWIFALTETL-MRVPVSSYSA-N 0 0 361.345 3.930 20 5 FHBDRN CN(C(=O)/C=C\c1ccc([N+](=O)[O-])cc1)c1ccc(-c2ccccc2)nn1 ZINC000254945133 928429402 /nfs/dbraw/zinc/42/94/02/928429402.db2.gz TWKGNFADKZDJPS-ZROIWOOFSA-N 0 0 360.373 3.728 20 5 FHBDRN O=C(CNC1(C(F)F)CCCCC1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000510116995 928458394 /nfs/dbraw/zinc/45/83/94/928458394.db2.gz DFAXMHHFGWEQPL-UHFFFAOYSA-N 0 0 361.776 3.744 20 5 FHBDRN Cc1noc([C@H](OC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)c2ccccc2)n1 ZINC000160258719 928536336 /nfs/dbraw/zinc/53/63/36/928536336.db2.gz SFMRIFPHZJFIHE-OAHLLOKOSA-N 0 0 373.752 3.886 20 5 FHBDRN CCN(CC(=O)Nc1c(C)cccc1[N+](=O)[O-])[C@@H](C)c1cccc(O)c1 ZINC000471177622 928600330 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FHBDRN O=C(CCc1nc2ccccc2[nH]1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000178833291 937279970 /nfs/dbraw/zinc/27/99/70/937279970.db2.gz QJRBUGLPCKLPCA-UHFFFAOYSA-N 0 0 364.405 3.595 20 5 FHBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1C2CCCC1CCC2 ZINC000610236052 928876979 /nfs/dbraw/zinc/87/69/79/928876979.db2.gz OOWKVSHNTUGBNO-LMWSTFAQSA-N 0 0 352.818 3.949 20 5 FHBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1C2CCCC1CCC2 ZINC000610236053 928880004 /nfs/dbraw/zinc/88/00/04/928880004.db2.gz OOWKVSHNTUGBNO-XGNXJENSSA-N 0 0 352.818 3.949 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N(C[C@H]1CCCO1)C1CCCC1 ZINC000610235874 928894441 /nfs/dbraw/zinc/89/44/41/928894441.db2.gz WVHZAAURGICAPB-MRXNPFEDSA-N 0 0 366.845 3.741 20 5 FHBDRN COc1cc(C(=O)N2C3CCCC2CCC3)c([N+](=O)[O-])cc1OC(F)F ZINC000610235865 928901844 /nfs/dbraw/zinc/90/18/44/928901844.db2.gz GTNOFRKMZMERFS-UHFFFAOYSA-N 0 0 370.352 3.752 20 5 FHBDRN COc1ccc([C@@H](C)N(C)C(=O)CCNc2ccccc2[N+](=O)[O-])cc1 ZINC000248180336 937289371 /nfs/dbraw/zinc/28/93/71/937289371.db2.gz CWHKDGOVBLWDFF-CQSZACIVSA-N 0 0 357.410 3.625 20 5 FHBDRN Cc1c(NC(=O)CCNC2(C(F)F)CCCCC2)cccc1[N+](=O)[O-] ZINC000510131798 928924057 /nfs/dbraw/zinc/92/40/57/928924057.db2.gz ITTZRXYTWAGJTD-UHFFFAOYSA-N 0 0 355.385 3.789 20 5 FHBDRN Cc1ccc(NC(=O)c2ccc(N[C@H](C)C(C)(C)O)c([N+](=O)[O-])c2)cc1 ZINC000608973246 928930448 /nfs/dbraw/zinc/93/04/48/928930448.db2.gz CAOMIDQEURPTKW-CYBMUJFWSA-N 0 0 357.410 3.727 20 5 FHBDRN CC(C)(CNC(=O)[C@H]1CC(c2ccccc2[N+](=O)[O-])=NO1)C1CCCCC1 ZINC001266324406 928989251 /nfs/dbraw/zinc/98/92/51/928989251.db2.gz HNQWRVVVGVFNFM-GOSISDBHSA-N 0 0 373.453 3.811 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)CCC(=O)OCC ZINC001266324466 928992348 /nfs/dbraw/zinc/99/23/48/928992348.db2.gz JDQYTTMHHWCWDZ-GFCCVEGCSA-N 0 0 368.455 3.559 20 5 FHBDRN O=C(C[C@H]1CCCN1C(=O)Cc1ccc([N+](=O)[O-])cc1F)c1ccccc1 ZINC000120588098 929016097 /nfs/dbraw/zinc/01/60/97/929016097.db2.gz AHZJIQXWJAOMTD-MRXNPFEDSA-N 0 0 370.380 3.540 20 5 FHBDRN O=C([C@@H]1CSCCS1)N(c1cccc([N+](=O)[O-])c1)C1CCCC1 ZINC000120590436 929016528 /nfs/dbraw/zinc/01/65/28/929016528.db2.gz LDHIYGBYJDGXPN-HNNXBMFYSA-N 0 0 352.481 3.719 20 5 FHBDRN O=C(CCCc1c[nH]c2ccccc12)NCc1cc([N+](=O)[O-])c(F)cc1F ZINC001143376393 929039362 /nfs/dbraw/zinc/03/93/62/929039362.db2.gz BPGWWEFWDKALRJ-UHFFFAOYSA-N 0 0 373.359 3.993 20 5 FHBDRN CS[C@H]1CCCCN([C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000134597023 929094255 /nfs/dbraw/zinc/09/42/55/929094255.db2.gz RVNDGOGIZPGLNN-AAEUAGOBSA-N 0 0 371.890 3.793 20 5 FHBDRN C[C@H]1CN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)C[C@H](c2ccccc2)O1 ZINC000134681822 929131295 /nfs/dbraw/zinc/13/12/95/929131295.db2.gz HFXTUDHKWOZMON-YVEFUNNKSA-N 0 0 360.797 3.850 20 5 FHBDRN COc1ccc2c(c1)CCCCN2C(=O)/C=C\c1ccc([N+](=O)[O-])cc1 ZINC001266340822 929157332 /nfs/dbraw/zinc/15/73/32/929157332.db2.gz OGRFOXXQNNADBS-GHXNOFRVSA-N 0 0 352.390 3.986 20 5 FHBDRN C[C@@H](C(=O)N[C@@H](C)c1cnn(CC2CCC2)c1)c1cccc([N+](=O)[O-])c1 ZINC000890670334 929180214 /nfs/dbraw/zinc/18/02/14/929180214.db2.gz KWWOVDVYWNTYMN-KGLIPLIRSA-N 0 0 356.426 3.572 20 5 FHBDRN C[C@@H](NC(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F)c1cnn(CC2CCC2)c1 ZINC000890671304 929197534 /nfs/dbraw/zinc/19/75/34/929197534.db2.gz HMUZWCFPHQWHGY-CHWSQXEVSA-N 0 0 374.416 3.711 20 5 FHBDRN O=[N+]([O-])c1ccc(N[C@H]2CCCN(Cc3ccc(F)cc3Cl)C2)nc1 ZINC000609512993 929203113 /nfs/dbraw/zinc/20/31/13/929203113.db2.gz CIKGYQBITQNJKM-AWEZNQCLSA-N 0 0 364.808 3.859 20 5 FHBDRN O=C(c1ccccc1F)N1CCC(Nc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000052243814 937311462 /nfs/dbraw/zinc/31/14/62/937311462.db2.gz URDOWBNNGRPQOF-UHFFFAOYSA-N 0 0 361.348 3.590 20 5 FHBDRN Cc1nc([C@H]2CCCN2C(=O)N[C@H](C)c2ccccc2[N+](=O)[O-])cs1 ZINC000275022685 929212576 /nfs/dbraw/zinc/21/25/76/929212576.db2.gz QGNFSYTYWXMABR-BDJLRTHQSA-N 0 0 360.439 3.967 20 5 FHBDRN O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1CCO[C@@H](c2ccccc2F)C1 ZINC000134778911 929241569 /nfs/dbraw/zinc/24/15/69/929241569.db2.gz QVKVBDHFFLUTCR-MRXNPFEDSA-N 0 0 364.760 3.601 20 5 FHBDRN Cc1c2ccccc2n(C)c1CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000471224821 929294927 /nfs/dbraw/zinc/29/49/27/929294927.db2.gz VJTSXWIQGAKKRD-UHFFFAOYSA-N 0 0 357.797 3.978 20 5 FHBDRN Cc1c(C(=O)N2CCc3ccc([N+](=O)[O-])cc32)cnn1-c1ccccc1C ZINC000046186152 929337463 /nfs/dbraw/zinc/33/74/63/929337463.db2.gz WXROLZXWPWDEBG-UHFFFAOYSA-N 0 0 362.389 3.600 20 5 FHBDRN Cn1cc([N+](=O)[O-])c(C(=O)Nc2cc(Cl)ccc2OC2CCCC2)n1 ZINC000275055586 929338411 /nfs/dbraw/zinc/33/84/11/929338411.db2.gz NJCUNTIACDWDBM-UHFFFAOYSA-N 0 0 364.789 3.555 20 5 FHBDRN CNc1ccc(C(=O)N2CC[C@H](c3ccccc3)[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000610243043 929356416 /nfs/dbraw/zinc/35/64/16/929356416.db2.gz MPNUAAGXGSPNOX-YOEHRIQHSA-N 0 0 353.422 3.902 20 5 FHBDRN COC(=O)c1ccnc(N(Cc2ccccn2)C2CCCCC2)c1[N+](=O)[O-] ZINC001167101437 929381562 /nfs/dbraw/zinc/38/15/62/929381562.db2.gz BLDJNFRTJUIUDF-UHFFFAOYSA-N 0 0 370.409 3.511 20 5 FHBDRN Cc1c2ccccc2n(C)c1CNC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000471234580 929397711 /nfs/dbraw/zinc/39/77/11/929397711.db2.gz KTLDBDKZBLKOTL-UHFFFAOYSA-N 0 0 357.797 3.978 20 5 FHBDRN C[C@@H](Nc1ccc(NC(=O)c2c[nH]nc2[N+](=O)[O-])cc1)c1ccccc1 ZINC000547757929 929407197 /nfs/dbraw/zinc/40/71/97/929407197.db2.gz IRDHUDSMAFCBTM-GFCCVEGCSA-N 0 0 351.366 3.743 20 5 FHBDRN C[C@H](CC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1ccncc1 ZINC000120712192 929438822 /nfs/dbraw/zinc/43/88/22/929438822.db2.gz KQSVUMIYFMWGNN-SNVBAGLBSA-N 0 0 351.309 3.724 20 5 FHBDRN CC1(CNC(=O)[C@@H]2C[C@H]2c2cccc([N+](=O)[O-])c2)Cc2ccccc2C1 ZINC001266353903 929449558 /nfs/dbraw/zinc/44/95/58/929449558.db2.gz GVYIVCOTCAFITF-RBUKOAKNSA-N 0 0 350.418 3.620 20 5 FHBDRN Cc1c(CNC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)oc2ccccc12 ZINC000134867645 929450565 /nfs/dbraw/zinc/45/05/65/929450565.db2.gz KRUYRODMMMGUHK-UHFFFAOYSA-N 0 0 363.373 3.990 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2noc(CN3CCCCc4ccccc43)n2)cc1 ZINC000471236276 929450879 /nfs/dbraw/zinc/45/08/79/929450879.db2.gz VOZVLZVAIIVDHA-UHFFFAOYSA-N 0 0 350.378 3.988 20 5 FHBDRN Cc1nn(C(C)(C)C)cc1[C@H](C)NC(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000154883440 929450920 /nfs/dbraw/zinc/45/09/20/929450920.db2.gz TWODWJUJVUERLK-JTQLQIEISA-N 0 0 364.833 3.999 20 5 FHBDRN Cc1cccnc1[C@H](NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)C(C)C ZINC000134873407 929454473 /nfs/dbraw/zinc/45/44/73/929454473.db2.gz RJNFACIWOGHTDB-LJQANCHMSA-N 0 0 366.421 3.836 20 5 FHBDRN C[C@@H](N[C@H](C)c1cccc([N+](=O)[O-])c1)c1noc(Cc2ccccc2)n1 ZINC000165338080 929509198 /nfs/dbraw/zinc/50/91/98/929509198.db2.gz OZTUDQDCUCOFEY-ZIAGYGMSSA-N 0 0 352.394 3.980 20 5 FHBDRN O=C(c1ccc(Cl)cc1[N+](=O)[O-])N(C[C@@H]1CCCO1)C1CCCC1 ZINC000610243269 929530122 /nfs/dbraw/zinc/53/01/22/929530122.db2.gz MLAJLPWCMKBTQH-AWEZNQCLSA-N 0 0 352.818 3.812 20 5 FHBDRN O=C(c1c[nH]c2ccc([N+](=O)[O-])cc12)N(C[C@H]1CCCO1)C1CCCC1 ZINC000610243296 929530446 /nfs/dbraw/zinc/53/04/46/929530446.db2.gz XDTFDDWTTDUTDR-OAHLLOKOSA-N 0 0 357.410 3.640 20 5 FHBDRN CCOc1ccccc1N1CCN(c2ccc([N+](=O)[O-])c(OCC)c2)CC1 ZINC000471241190 929599200 /nfs/dbraw/zinc/59/92/00/929599200.db2.gz PAUAQTQPHWWPLR-UHFFFAOYSA-N 0 0 371.437 3.719 20 5 FHBDRN O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1C[C@@H]2CCCN2c2ccccc21 ZINC000609855107 929611567 /nfs/dbraw/zinc/61/15/67/929611567.db2.gz DSMRGTFLBYOCBK-AWEZNQCLSA-N 0 0 357.797 3.877 20 5 FHBDRN O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)N1CCC[C@H]2CCC[C@@H]21 ZINC000175346139 929620865 /nfs/dbraw/zinc/62/08/65/929620865.db2.gz YJPPTBKYXLLDOI-MFKMUULPSA-N 0 0 355.341 3.993 20 5 FHBDRN O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)N1CCC[C@@H]2CCC[C@H]21 ZINC000175346193 929621989 /nfs/dbraw/zinc/62/19/89/929621989.db2.gz YJPPTBKYXLLDOI-GXFFZTMASA-N 0 0 355.341 3.993 20 5 FHBDRN CCN(C[C@H]1CCCO1)C(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000275632210 929641575 /nfs/dbraw/zinc/64/15/75/929641575.db2.gz IMDPVCZVDPGYGS-OAHLLOKOSA-N 0 0 350.418 3.735 20 5 FHBDRN COC1CCN(C(=O)c2cc(F)cc3c(=O)c4cc(F)ccc4[nH]c23)CC1 ZINC000275634116 929650704 /nfs/dbraw/zinc/65/07/04/929650704.db2.gz MONRJCTUAJNZMB-UHFFFAOYSA-N 0 0 372.371 3.623 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2C[C@@H]2c2c(F)cccc2Cl)c1 ZINC000121061885 929661833 /nfs/dbraw/zinc/66/18/33/929661833.db2.gz HWCTWBTWJIONAU-IINYFYTJSA-N 0 0 364.760 3.682 20 5 FHBDRN COc1ccccc1[C@@H](CC(C)C)NC(=O)COc1cccc([N+](=O)[O-])c1 ZINC000471450903 929696038 /nfs/dbraw/zinc/69/60/38/929696038.db2.gz QQWVUEPJMKYYAI-GOSISDBHSA-N 0 0 372.421 3.886 20 5 FHBDRN COCC(=O)N1CCc2cc(N[C@H](C)c3cc([N+](=O)[O-])ccc3C)ccc21 ZINC000547979882 929705175 /nfs/dbraw/zinc/70/51/75/929705175.db2.gz GSUSXNMPSWZYSD-CQSZACIVSA-N 0 0 369.421 3.612 20 5 FHBDRN COc1ccc(CC(=O)N2C[C@H](C)C[C@@H]2c2ccccc2F)cc1[N+](=O)[O-] ZINC000610295712 929710887 /nfs/dbraw/zinc/71/08/87/929710887.db2.gz HFLMFDAUGPYSBM-CXAGYDPISA-N 0 0 372.396 3.895 20 5 FHBDRN COc1ccc(CS(=O)(=O)[C@@H](C)c2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000583333086 937354339 /nfs/dbraw/zinc/35/43/39/937354339.db2.gz FIMRJQCFJWUFOG-NSHDSACASA-N 0 0 369.826 3.933 20 5 FHBDRN CCc1cc2c(ncnc2Oc2cc(C(=O)OC)ccc2[N+](=O)[O-])s1 ZINC000052279395 937355647 /nfs/dbraw/zinc/35/56/47/937355647.db2.gz QQSJSDWUIKNDGQ-UHFFFAOYSA-N 0 0 359.363 3.741 20 5 FHBDRN Cc1cccc(C(=O)NCc2ccc(OC3CCCC3)nc2)c1[N+](=O)[O-] ZINC000046300680 929747078 /nfs/dbraw/zinc/74/70/78/929747078.db2.gz JBHIUQZLWLNHQX-UHFFFAOYSA-N 0 0 355.394 3.550 20 5 FHBDRN Cc1ccc2c(c1)CC[C@@H]2NC(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000510302351 929762129 /nfs/dbraw/zinc/76/21/29/929762129.db2.gz DVPJCJXFXGOWAT-IBGZPJMESA-N 0 0 353.422 3.899 20 5 FHBDRN CC(=O)c1cccc(S(=O)(=O)Nc2cc([N+](=O)[O-])c(Cl)cc2C)c1 ZINC000134061349 929783117 /nfs/dbraw/zinc/78/31/17/929783117.db2.gz FFGSRWXFKGJEPW-UHFFFAOYSA-N 0 0 368.798 3.560 20 5 FHBDRN O=C(Nc1cc(CC2CC2)nn1-c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000157779239 929788764 /nfs/dbraw/zinc/78/87/64/929788764.db2.gz DBYQYMWTKWZQQV-UHFFFAOYSA-N 0 0 362.389 3.985 20 5 FHBDRN CCn1c2ccccc2nc1[C@H](C)NC(=O)/C=C\c1ccc([N+](=O)[O-])cc1 ZINC000255134609 929800348 /nfs/dbraw/zinc/80/03/48/929800348.db2.gz HIQVXFMUKOBOSH-ZVHGMHCTSA-N 0 0 364.405 3.855 20 5 FHBDRN Cc1nc2cc(NC(=O)Cc3ccc([N+](=O)[O-])cc3Cl)ccc2n1C ZINC000610310281 929800844 /nfs/dbraw/zinc/80/08/44/929800844.db2.gz GVOKRLIBOMBQNB-UHFFFAOYSA-N 0 0 358.785 3.625 20 5 FHBDRN CCN(CCNC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12)c1ccccc1C ZINC000109872141 929803512 /nfs/dbraw/zinc/80/35/12/929803512.db2.gz WVZQQYMBVQRUGR-UHFFFAOYSA-N 0 0 366.421 3.641 20 5 FHBDRN COc1cc(CN2CCc3c(cccc3[N+](=O)[O-])C2)ccc1OC(F)F ZINC000536005047 929809910 /nfs/dbraw/zinc/80/99/10/929809910.db2.gz UGMRPISNWKIBTR-UHFFFAOYSA-N 0 0 364.348 3.763 20 5 FHBDRN O=C(c1cc2c(cc1[N+](=O)[O-])OCO2)N1CCCc2cccc(Cl)c21 ZINC000560403197 929812983 /nfs/dbraw/zinc/81/29/83/929812983.db2.gz QEVIEABQYZLYEK-UHFFFAOYSA-N 0 0 360.753 3.570 20 5 FHBDRN Cc1nc(NC(=O)[C@@H]2C[C@H]2c2ccccc2OC(F)F)ccc1[N+](=O)[O-] ZINC000134066671 929831908 /nfs/dbraw/zinc/83/19/08/929831908.db2.gz FGDPPMIGKXCSJD-NWDGAFQWSA-N 0 0 363.320 3.642 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)Nc1n[nH]cc1-c1ccc(Cl)cc1 ZINC001167328955 929886694 /nfs/dbraw/zinc/88/66/94/929886694.db2.gz BFJDVIYTKJJNNJ-UHFFFAOYSA-N 0 0 372.768 3.656 20 5 FHBDRN Cc1ccc2nc(C)c(C(=O)NCCNc3ccc([N+](=O)[O-])cc3)cc2c1 ZINC000248338227 937368466 /nfs/dbraw/zinc/36/84/66/937368466.db2.gz RDSUYHOBARSDMK-UHFFFAOYSA-N 0 0 364.405 3.602 20 5 FHBDRN CC[C@H](CC(F)(F)F)Nc1ccc([N+](=O)[O-])c(N2CCOCC2)c1F ZINC000579128391 929898909 /nfs/dbraw/zinc/89/89/09/929898909.db2.gz QGZDFISJHXFWNN-SNVBAGLBSA-N 0 0 365.327 3.713 20 5 FHBDRN Cc1ccnc([C@H]2CCN(C(=O)C(C)(C)c3ccccc3[N+](=O)[O-])C2)c1 ZINC000579130538 929901086 /nfs/dbraw/zinc/90/10/86/929901086.db2.gz TXLFXXUWOBNGSJ-HNNXBMFYSA-N 0 0 353.422 3.592 20 5 FHBDRN Cc1ccc(-c2cc(CN3CCOc4ccc([N+](=O)[O-])cc4C3)on2)cc1 ZINC000583351278 937370077 /nfs/dbraw/zinc/37/00/77/937370077.db2.gz RQVDVZKJGAWSIF-UHFFFAOYSA-N 0 0 365.389 3.953 20 5 FHBDRN CN(CCC1CCOCC1)C(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000275684989 929917584 /nfs/dbraw/zinc/91/75/84/929917584.db2.gz QAIHMZOAGSQSBU-UHFFFAOYSA-N 0 0 364.445 3.982 20 5 FHBDRN C[C@H]1Oc2ccccc2[C@@H]1NC(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000579150066 929943395 /nfs/dbraw/zinc/94/33/95/929943395.db2.gz ABYXQDWFPKOMQQ-RFAUZJTJSA-N 0 0 366.295 3.866 20 5 FHBDRN Cc1ccc2c(c1)[C@@H](NC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1)CO2 ZINC000121107879 929943422 /nfs/dbraw/zinc/94/34/22/929943422.db2.gz UXCPZVRDNNVOGN-INIZCTEOSA-N 0 0 355.394 3.571 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3F)n2)s1 ZINC001125402090 929953234 /nfs/dbraw/zinc/95/32/34/929953234.db2.gz SXCSNMQCKYWMCO-NSHDSACASA-N 0 0 374.397 3.781 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)CCOc1ccccc1Cl ZINC000560721427 929955599 /nfs/dbraw/zinc/95/55/99/929955599.db2.gz QHCZQGWJOMWFII-UHFFFAOYSA-N 0 0 362.813 3.718 20 5 FHBDRN Cc1cc(NC(=O)NCCOc2ccc([N+](=O)[O-])cc2)ccc1OC(C)C ZINC000610329982 929980023 /nfs/dbraw/zinc/98/00/23/929980023.db2.gz URHBCBISQAOVIZ-UHFFFAOYSA-N 0 0 373.409 3.891 20 5 FHBDRN COC[C@H](NC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc21)c1cccc(Cl)c1 ZINC000583353750 937376379 /nfs/dbraw/zinc/37/63/79/937376379.db2.gz GURRNJLTXCTAKM-KRWDZBQOSA-N 0 0 373.796 3.847 20 5 FHBDRN C[C@@H](CNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1)COCc1ccccc1 ZINC000610041912 930015235 /nfs/dbraw/zinc/01/52/35/930015235.db2.gz LYULGMNXMAYHLA-INIZCTEOSA-N 0 0 370.449 3.842 20 5 FHBDRN CCc1ocnc1C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)c(C)s1 ZINC000610041639 930016540 /nfs/dbraw/zinc/01/65/40/930016540.db2.gz YCEDTLQTULBOSQ-UHFFFAOYSA-N 0 0 358.379 3.829 20 5 FHBDRN C/C(=C/C(=O)OCc1c(C)nn(C(F)F)c1C)c1ccc([N+](=O)[O-])cc1 ZINC000784994986 930029647 /nfs/dbraw/zinc/02/96/47/930029647.db2.gz FLIBEBQREQWSEO-NTMALXAHSA-N 0 0 365.336 3.950 20 5 FHBDRN Cc1cc(C(=O)N[C@@H](CC(=O)OC(C)C)c2ccccc2[N+](=O)[O-])oc1C ZINC000134111502 930038742 /nfs/dbraw/zinc/03/87/42/930038742.db2.gz XFRDQBIQXYCDAI-HNNXBMFYSA-N 0 0 374.393 3.617 20 5 FHBDRN CCc1ccccc1NC(=O)[C@H](C)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000536003344 937384598 /nfs/dbraw/zinc/38/45/98/937384598.db2.gz MSSUEHRDDGALPJ-AWEZNQCLSA-N 0 0 353.422 3.543 20 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FHBDRN COc1cccc(F)c1[C@H](C)NC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000121165574 930222775 /nfs/dbraw/zinc/22/27/75/930222775.db2.gz RKVGXHQHEARZDL-LBPRGKRZSA-N 0 0 373.384 3.571 20 5 FHBDRN COc1cccc(F)c1[C@@H](C)NC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000121165742 930222802 /nfs/dbraw/zinc/22/28/02/930222802.db2.gz RKVGXHQHEARZDL-GFCCVEGCSA-N 0 0 373.384 3.571 20 5 FHBDRN O=C(Oc1cccc(Oc2ncccn2)c1)c1c(F)cccc1[N+](=O)[O-] ZINC001125658732 937398933 /nfs/dbraw/zinc/39/89/33/937398933.db2.gz WNMRJKUFUXQKMP-UHFFFAOYSA-N 0 0 355.281 3.535 20 5 FHBDRN CN1CCCN(C(=O)c2cccc(Cl)c2[N+](=O)[O-])c2cc(F)ccc21 ZINC000175893784 930251439 /nfs/dbraw/zinc/25/14/39/930251439.db2.gz BHELIELQNUGLKG-UHFFFAOYSA-N 0 0 363.776 3.874 20 5 FHBDRN Cc1onc(-c2ccccc2)c1C(=O)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000560995594 930268494 /nfs/dbraw/zinc/26/84/94/930268494.db2.gz ZIZNALKYLPMOBZ-UHFFFAOYSA-N 0 0 365.389 3.873 20 5 FHBDRN Cc1cccc(C)c1OC[C@H](C)NC(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000510318589 930269662 /nfs/dbraw/zinc/26/96/62/930269662.db2.gz HTOBNLARCLBAKV-HNNXBMFYSA-N 0 0 374.462 3.887 20 5 FHBDRN O=[N+]([O-])c1ccccc1-c1ccc(CN2CCOC[C@@H]2CC(F)F)o1 ZINC000580128534 930283584 /nfs/dbraw/zinc/28/35/84/930283584.db2.gz LIBGVQNNIFQXCE-LBPRGKRZSA-N 0 0 352.337 3.711 20 5 FHBDRN CCCOc1cc(O)ccc1NC(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000430481936 930290727 /nfs/dbraw/zinc/29/07/27/930290727.db2.gz HDCYOAIJNMVSJH-UHFFFAOYSA-N 0 0 359.382 3.530 20 5 FHBDRN O=C(Nc1cc(-c2ccccc2)ns1)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000610388276 930293091 /nfs/dbraw/zinc/29/30/91/930293091.db2.gz PPUBJGHVMJQXRJ-UHFFFAOYSA-N 0 0 369.358 3.699 20 5 FHBDRN Cn1cnc([N+](=O)[O-])c1-c1noc(-c2ccc(C(C)(C)C)c(Cl)c2)n1 ZINC000580135931 930295531 /nfs/dbraw/zinc/29/55/31/930295531.db2.gz ZHKPHDMIFFJRMB-UHFFFAOYSA-N 0 0 361.789 3.996 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(Oc2ccc(Br)c(C)c2)n1 ZINC000319202347 930307988 /nfs/dbraw/zinc/30/79/88/930307988.db2.gz QPJOMRPWNCWWTR-UHFFFAOYSA-N 0 0 367.155 3.640 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(=O)n1CCOC(c1ccccc1)c1ccccc1 ZINC000471545778 930339918 /nfs/dbraw/zinc/33/99/18/930339918.db2.gz CTINZZLUYLRXSW-UHFFFAOYSA-N 0 0 364.401 3.871 20 5 FHBDRN O=C(Nc1cccc(Br)c1)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000050016481 930349045 /nfs/dbraw/zinc/34/90/45/930349045.db2.gz QGCKCTGWPOYXTL-UHFFFAOYSA-N 0 0 357.110 3.888 20 5 FHBDRN Cc1noc(C)c1[C@@H](C)CNC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000178873946 937412081 /nfs/dbraw/zinc/41/20/81/937412081.db2.gz QXGWTWDERFYGPZ-VIFPVBQESA-N 0 0 359.407 3.948 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CCC=C(c2ccccc2)C1 ZINC000579504286 930399051 /nfs/dbraw/zinc/39/90/51/930399051.db2.gz RGKZLKOCEBVRLT-UHFFFAOYSA-N 0 0 351.406 3.631 20 5 FHBDRN COc1cc(CNC(=O)c2c([N+](=O)[O-])cccc2C(F)(F)F)ccc1C ZINC000580244585 930399138 /nfs/dbraw/zinc/39/91/38/930399138.db2.gz MDTMJUNEGHZWCN-UHFFFAOYSA-N 0 0 368.311 3.861 20 5 FHBDRN CCC[C@@H](Nc1c2ccccc2n(C)c(=O)c1[N+](=O)[O-])c1ccccn1 ZINC000892335492 937414657 /nfs/dbraw/zinc/41/46/57/937414657.db2.gz RWOPBPZZJWUXDY-OAHLLOKOSA-N 0 0 352.394 3.795 20 5 FHBDRN C[C@@H](C(=O)N1CCC[C@@H](Nc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000580274185 930429662 /nfs/dbraw/zinc/42/96/62/930429662.db2.gz ZPRWXOZFNBZVOM-CRAIPNDOSA-N 0 0 353.422 3.801 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNCc1cc(Br)cs1 ZINC000070941029 930440349 /nfs/dbraw/zinc/44/03/49/930440349.db2.gz XBDKEXJTEMLLKQ-UHFFFAOYSA-N 0 0 357.229 3.717 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N[C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2 ZINC000275814694 930445486 /nfs/dbraw/zinc/44/54/86/930445486.db2.gz MVCWZIPGYXNWNL-MAZHCROVSA-N 0 0 364.829 3.634 20 5 FHBDRN O=C(COc1cccc([N+](=O)[O-])c1)N[C@H]1CC[C@@H](c2ccc(F)cc2)C1 ZINC000471550370 930447232 /nfs/dbraw/zinc/44/72/32/930447232.db2.gz XXBZSPJDEJLAHS-ZBFHGGJFSA-N 0 0 358.369 3.565 20 5 FHBDRN CCOc1ccc(C(=O)O[C@H](C)c2nc3ccccc3n2C)cc1[N+](=O)[O-] ZINC000175930467 930488040 /nfs/dbraw/zinc/48/80/40/930488040.db2.gz SILKLVUIGMFMIV-GFCCVEGCSA-N 0 0 369.377 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Cc1ccc([C@@H](C)NC(=O)c2cccc(-n3ccnc3)c2)cc1[N+](=O)[O-] ZINC000177869806 931394551 /nfs/dbraw/zinc/39/45/51/931394551.db2.gz XVLQZNGNQAEJMK-CQSZACIVSA-N 0 0 350.378 3.580 20 5 FHBDRN CO[C@H](C)c1nc(C)c(C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)s1 ZINC000177870644 931394709 /nfs/dbraw/zinc/39/47/09/931394709.db2.gz NHCMIFRULHOICA-ZYHUDNBSSA-N 0 0 363.439 3.867 20 5 FHBDRN O=C(Nc1ccc(CN2CCCC2=O)cc1)c1ccc([N+](=O)[O-])cc1Cl ZINC000126115738 931398336 /nfs/dbraw/zinc/39/83/36/931398336.db2.gz HDSULQPCASYTHE-UHFFFAOYSA-N 0 0 373.796 3.623 20 5 FHBDRN Cc1cccc(C)c1OCCCNC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000580988932 931449385 /nfs/dbraw/zinc/44/93/85/931449385.db2.gz UXYVTDWYGAQXIS-INIZCTEOSA-N 0 0 356.422 3.900 20 5 FHBDRN Cc1n[nH]c(C(=O)N[C@@H](CC(C)C)c2ccc(Cl)cc2)c1[N+](=O)[O-] ZINC000610199692 931481643 /nfs/dbraw/zinc/48/16/43/931481643.db2.gz GOLRSWCZCWMEQK-ZDUSSCGKSA-N 0 0 350.806 3.797 20 5 FHBDRN COCc1cc([N+](=O)[O-])ccc1NCc1ccnc(OCC(F)(F)F)c1 ZINC000156781462 931481678 /nfs/dbraw/zinc/48/16/78/931481678.db2.gz SYSQDPSWISUWLD-UHFFFAOYSA-N 0 0 371.315 3.689 20 5 FHBDRN NC(=O)c1cccc(N2CCC(c3ccc(Cl)cc3)CC2)c1[N+](=O)[O-] ZINC000561306530 931539671 /nfs/dbraw/zinc/53/96/71/931539671.db2.gz BEKZZCZENRIUSY-UHFFFAOYSA-N 0 0 359.813 3.731 20 5 FHBDRN COCCSCCCOC(=O)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000785033287 931540205 /nfs/dbraw/zinc/54/02/05/931540205.db2.gz XAWNIAPASVNLNY-UHFFFAOYSA-N 0 0 371.458 3.608 20 5 FHBDRN CC(C)(C)C[C@@H](CO)NC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000276023152 931541544 /nfs/dbraw/zinc/54/15/44/931541544.db2.gz VFERPQMZJFZNGN-AWEZNQCLSA-N 0 0 352.434 3.621 20 5 FHBDRN Cc1ccc(C[C@H](C)NC(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)s1 ZINC000581094159 931556250 /nfs/dbraw/zinc/55/62/50/931556250.db2.gz RYQGWRLUDXYSHF-VIFPVBQESA-N 0 0 354.378 3.533 20 5 FHBDRN CC[C@@H](CNC(=O)c1cc(F)c(F)cc1[N+](=O)[O-])Oc1ccccc1C ZINC000175982236 931568009 /nfs/dbraw/zinc/56/80/09/931568009.db2.gz OGTBTMRHSRRACG-LBPRGKRZSA-N 0 0 364.348 3.769 20 5 FHBDRN O=C(OCc1cccc([N+](=O)[O-])c1)c1coc(-c2c(F)cccc2F)n1 ZINC001125485733 931581016 /nfs/dbraw/zinc/58/10/16/931581016.db2.gz PNEIIYGHLORFBB-UHFFFAOYSA-N 0 0 360.272 3.885 20 5 FHBDRN COc1ccc(CNC(=O)[C@@H]2C[C@@H]2c2ccccc2Cl)cc1[N+](=O)[O-] ZINC000581145835 931615257 /nfs/dbraw/zinc/61/52/57/931615257.db2.gz KPHJKLYGNCSSJX-ZIAGYGMSSA-N 0 0 360.797 3.677 20 5 FHBDRN CC[C@@H](C)n1ncc(C(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)c1C ZINC000581156317 931628332 /nfs/dbraw/zinc/62/83/32/931628332.db2.gz MTTFNVOXPRDRGL-GFCCVEGCSA-N 0 0 369.425 3.525 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)CSc1nc2ccccc2o1 ZINC000581207156 931674821 /nfs/dbraw/zinc/67/48/21/931674821.db2.gz NSUQKGGLNZKUJG-UHFFFAOYSA-N 0 0 371.418 3.529 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])N1CCCCC[C@H]1[C@H]1CCCCC1=O ZINC000126259578 931685220 /nfs/dbraw/zinc/68/52/20/931685220.db2.gz NLCADPSAAIZILI-WBVHZDCISA-N 0 0 373.453 3.537 20 5 FHBDRN C[C@]1(NC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)CCO[C@@H]1C1CC1 ZINC000276049917 931685729 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3.926 20 5 FHBDRN CC(C)CC(CC(C)C)NC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000510395728 931897945 /nfs/dbraw/zinc/89/79/45/931897945.db2.gz RRPVGZDVXOXEPB-UHFFFAOYSA-N 0 0 369.849 3.764 20 5 FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N(C)CCc1ccccc1 ZINC000135108559 931935152 /nfs/dbraw/zinc/93/51/52/931935152.db2.gz OQDNJVUQJBQUDI-UHFFFAOYSA-N 0 0 374.462 3.648 20 5 FHBDRN COCCN(Cc1ccc(C)o1)C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000177989685 931939417 /nfs/dbraw/zinc/93/94/17/931939417.db2.gz BOTALXJAKBTUCZ-UHFFFAOYSA-N 0 0 374.418 4.000 20 5 FHBDRN CC[C@H](C)CN(C)S(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000610263447 931940404 /nfs/dbraw/zinc/94/04/04/931940404.db2.gz LOAIMNFKRFHHKD-QMMMGPOBSA-N 0 0 355.243 3.568 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NCc1ccc2sccc2c1 ZINC000581398055 931952868 /nfs/dbraw/zinc/95/28/68/931952868.db2.gz WLGDIAXDHQGEQW-UHFFFAOYSA-N 0 0 362.432 3.596 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)Nc1cc(C2CCCC2)[nH]n1 ZINC000135146621 931967892 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ZINC000276264410 932137470 /nfs/dbraw/zinc/13/74/70/932137470.db2.gz MORYYNAAJUHBRR-PVUWLOKVSA-N 0 0 370.405 3.593 20 5 FHBDRN CCS[C@@H]1CCC[C@@H]1NC(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000178031157 932139589 /nfs/dbraw/zinc/13/95/89/932139589.db2.gz VOSQLKRDCJAPSH-JKSUJKDBSA-N 0 0 351.472 3.577 20 5 FHBDRN O=C(Cc1cc(F)ccc1Br)Nc1ccc([N+](=O)[O-])cc1 ZINC000119385658 932177820 /nfs/dbraw/zinc/17/78/20/932177820.db2.gz VYNCZDWNBBSUEC-UHFFFAOYSA-N 0 0 353.147 3.678 20 5 FHBDRN C[C@@H](C(=O)N1CC[C@H](Cc2ccc(F)cc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000581522938 932201340 /nfs/dbraw/zinc/20/13/40/932201340.db2.gz LDMNWGQAWSZEHZ-GDBMZVCRSA-N 0 0 356.397 3.929 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1OCC(=O)NCc1cccc(COC(C)C)c1 ZINC000077244392 932204257 /nfs/dbraw/zinc/20/42/57/932204257.db2.gz KUVJUKOJJYWDGO-UHFFFAOYSA-N 0 0 372.421 3.523 20 5 FHBDRN COc1cc(F)c(C(=O)Nc2ccc([N+](=O)[O-])c3ncccc23)cc1OC ZINC000187418365 932210084 /nfs/dbraw/zinc/21/00/84/932210084.db2.gz LHVULIKQPHTPPW-UHFFFAOYSA-N 0 0 371.324 3.552 20 5 FHBDRN C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)Nc3ccncc3)cc2[N+](=O)[O-])C1 ZINC000022260341 932231136 /nfs/dbraw/zinc/23/11/36/932231136.db2.gz YQRVKPIPSOQQPL-ZIAGYGMSSA-N 0 0 354.410 3.724 20 5 FHBDRN CSc1ccc(C(=O)NCC(C)(C)[C@H]2CCCCO2)cc1[N+](=O)[O-] ZINC000610719992 932246531 /nfs/dbraw/zinc/24/65/31/932246531.db2.gz YGPBYSRLQUTLJU-OAHLLOKOSA-N 0 0 352.456 3.642 20 5 FHBDRN CC(C)c1ccc(C(=O)NCc2noc(-c3cccs3)n2)cc1[N+](=O)[O-] ZINC000581569562 932258202 /nfs/dbraw/zinc/25/82/02/932258202.db2.gz IUXBCCXBUZWQQH-UHFFFAOYSA-N 0 0 372.406 3.760 20 5 FHBDRN O=C(Nc1cccc2cc[nH]c21)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000548189369 932267030 /nfs/dbraw/zinc/26/70/30/932267030.db2.gz OQLFKEFLFQLIFB-UHFFFAOYSA-N 0 0 364.405 3.931 20 5 FHBDRN Cc1cc(NC(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)sn1 ZINC000157237060 932267037 /nfs/dbraw/zinc/26/70/37/932267037.db2.gz GAJHNURLSUAIAG-UHFFFAOYSA-N 0 0 356.201 3.683 20 5 FHBDRN O=C(Nc1ccc2c(c1)CCC(=O)N2)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000126607860 932269953 /nfs/dbraw/zinc/26/99/53/932269953.db2.gz JTFMMUNDYZOZON-UHFFFAOYSA-N 0 0 360.757 3.777 20 5 FHBDRN CCc1cccc(C)c1NC(=O)C(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000178067669 932271458 /nfs/dbraw/zinc/27/14/58/932271458.db2.gz HVFAXFHQPSAHEO-AWEZNQCLSA-N 0 0 369.421 3.590 20 5 FHBDRN CCC1(CC)[C@H](NC(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)[C@@H](C)[C@H]1OC ZINC001266763091 932273440 /nfs/dbraw/zinc/27/34/40/932273440.db2.gz RKRMNLUOSVIEAP-YLGOIMDESA-N 0 0 366.433 3.793 20 5 FHBDRN Cc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2N)cc1Br ZINC000157307845 932322387 /nfs/dbraw/zinc/32/23/87/932322387.db2.gz WKHWDWMZGAYLSQ-UHFFFAOYSA-N 0 0 350.172 3.500 20 5 FHBDRN CCc1cc(NC[C@@H](C)c2ccncc2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000610517121 932335477 /nfs/dbraw/zinc/33/54/77/932335477.db2.gz ZFLOLSULSZICLY-CQSZACIVSA-N 0 0 363.421 3.647 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1F)N(Cc1cscn1)c1ccccc1 ZINC000477119606 932340091 /nfs/dbraw/zinc/34/00/91/932340091.db2.gz MFEBBEPWPMNCCX-UHFFFAOYSA-N 0 0 371.393 3.966 20 5 FHBDRN O=[N+]([O-])c1ccc(N[C@@H]2CCN(c3ccc(Cl)c(Cl)c3)C2)cn1 ZINC000477137481 932349585 /nfs/dbraw/zinc/34/95/85/932349585.db2.gz VLNJCDMJPQBZKF-LLVKDONJSA-N 0 0 353.209 3.987 20 5 FHBDRN CCc1cc(NC(=O)[C@@H]2CCO[C@H](C(C)C)C2)c2cc([N+](=O)[O-])ccc2n1 ZINC001266776771 932360384 /nfs/dbraw/zinc/36/03/84/932360384.db2.gz GULORRIPSOTDSO-YJYMSZOUSA-N 0 0 371.437 3.517 20 5 FHBDRN Cc1cnc(OCCOc2ccc(Br)cc2)c([N+](=O)[O-])c1 ZINC000477156190 932360661 /nfs/dbraw/zinc/36/06/61/932360661.db2.gz KBRLLWJPEKPIAY-UHFFFAOYSA-N 0 0 353.172 3.519 20 5 FHBDRN Cc1ccc(N2C(=O)C(=Cc3ccc([N+](=O)[O-])s3)NC2=S)c(C)c1 ZINC000588421034 932389285 /nfs/dbraw/zinc/38/92/85/932389285.db2.gz CANZYVNWGRAQFE-WQLSENKSSA-N 0 0 359.432 3.535 20 5 FHBDRN CC(C)/C=C/C(=O)O[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000785058439 932395686 /nfs/dbraw/zinc/39/56/86/932395686.db2.gz IDXLGVCUUHJJEI-QBBOHKLWSA-N 0 0 374.315 3.696 20 5 FHBDRN Cc1ccccc1-c1nc(COC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)no1 ZINC000255341984 932406683 /nfs/dbraw/zinc/40/66/83/932406683.db2.gz KEGGMUJNKRSTRU-FLIBITNWSA-N 0 0 365.345 3.710 20 5 FHBDRN O=C(COC/C=C\c1ccccc1)N1CCCc2ccc([N+](=O)[O-])cc21 ZINC000477230985 932423556 /nfs/dbraw/zinc/42/35/56/932423556.db2.gz YTKKIVJOPCYJCS-YVMONPNESA-N 0 0 352.390 3.604 20 5 FHBDRN O=C(Nc1cc(F)cc(Cl)c1)N1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000581659411 932427419 /nfs/dbraw/zinc/42/74/19/932427419.db2.gz GPNLZWXZUZUGRJ-UHFFFAOYSA-N 0 0 365.748 3.814 20 5 FHBDRN CCOC(=O)/C=C\c1ccc(NC(=O)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000255354098 932443030 /nfs/dbraw/zinc/44/30/30/932443030.db2.gz XEKXLELNYAUHES-LCYFTJDESA-N 0 0 368.389 3.742 20 5 FHBDRN CC(C)C[C@@H]1OCCC[C@H]1NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000477277613 932445283 /nfs/dbraw/zinc/44/52/83/932445283.db2.gz DTPQJKQZYRUFKW-DOMZBBRYSA-N 0 0 372.368 3.520 20 5 FHBDRN CN(CCCCO)C(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000276459969 932457712 /nfs/dbraw/zinc/45/77/12/932457712.db2.gz XGOSTKDCXHLWAB-UHFFFAOYSA-N 0 0 359.382 3.623 20 5 FHBDRN COCCCN(Cc1ccncc1)C(=O)Nc1cc(C)c([N+](=O)[O-])cc1C ZINC000276468361 932460584 /nfs/dbraw/zinc/46/05/84/932460584.db2.gz YEZSEEMAVNBKEB-UHFFFAOYSA-N 0 0 372.425 3.677 20 5 FHBDRN CC(C)c1nnc([C@H](C)NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]1 ZINC000477311407 932465170 /nfs/dbraw/zinc/46/51/70/932465170.db2.gz UHFPKKXWVIHXHG-VIFPVBQESA-N 0 0 359.411 3.542 20 5 FHBDRN CC[C@H](NC(=O)c1cc2c(cc1Cl)NC(=O)C2)c1cccc([N+](=O)[O-])c1 ZINC001266794803 932471460 /nfs/dbraw/zinc/47/14/60/932471460.db2.gz KFRCKZSWMNLSAO-HNNXBMFYSA-N 0 0 373.796 3.624 20 5 FHBDRN CN(CCCCO)C(=O)/C=C/c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000276494888 932486161 /nfs/dbraw/zinc/48/61/61/932486161.db2.gz TUNPFRZIYOMXJQ-PKNBQFBNSA-N 0 0 360.435 3.567 20 5 FHBDRN O=[N+]([O-])c1ccc(OC(F)F)c(CNc2ccc(Br)cn2)c1 ZINC000157399956 932490721 /nfs/dbraw/zinc/49/07/21/932490721.db2.gz WHQYXJKXIXFJQB-UHFFFAOYSA-N 0 0 374.141 3.966 20 5 FHBDRN CSc1ccccc1C(=O)O[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000003420623 932494083 /nfs/dbraw/zinc/49/40/83/932494083.db2.gz RYRLAMSFOJTIHC-LLVKDONJSA-N 0 0 360.391 3.501 20 5 FHBDRN C[C@@H](Cc1cccc(F)c1)C(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000581690055 932507528 /nfs/dbraw/zinc/50/75/28/932507528.db2.gz UJVIJDPIWWDTRE-ZDUSSCGKSA-N 0 0 369.396 3.753 20 5 FHBDRN O=C(Nc1ccc2c(c1)CCO2)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000178106274 932509788 /nfs/dbraw/zinc/50/97/88/932509788.db2.gz GLMDXGDLKSSCED-UHFFFAOYSA-N 0 0 353.378 3.726 20 5 FHBDRN COCCN(CCCc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000126783478 932547709 /nfs/dbraw/zinc/54/77/09/932547709.db2.gz GHWWRZBFMFYLPA-UHFFFAOYSA-N 0 0 357.410 3.708 20 5 FHBDRN C[C@H](NC(=O)N1CCO[C@@H](c2cccs2)C1)c1cccc([N+](=O)[O-])c1 ZINC000156365750 932553250 /nfs/dbraw/zinc/55/32/50/932553250.db2.gz SCLDHLXOKWOJFO-SWLSCSKDSA-N 0 0 361.423 3.500 20 5 FHBDRN C[C@@H](C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)N1CCCCC1 ZINC000175930019 932569572 /nfs/dbraw/zinc/56/95/72/932569572.db2.gz HEAUOVZZWCCEEL-LBPRGKRZSA-N 0 0 360.439 3.531 20 5 FHBDRN CCOc1ccc(C(=O)N2CCC[C@@H](C(F)(F)F)[C@@H]2C)cc1[N+](=O)[O-] ZINC000477421714 932574770 /nfs/dbraw/zinc/57/47/70/932574770.db2.gz SLEZQQVIKDPCCC-CMPLNLGQSA-N 0 0 360.332 3.797 20 5 FHBDRN COc1cc(Cc2noc(-c3ccc(C)c(F)c3)n2)c([N+](=O)[O-])c(OC)c1 ZINC000581765383 932637173 /nfs/dbraw/zinc/63/71/73/932637173.db2.gz VNINRTBKACCHST-UHFFFAOYSA-N 0 0 373.340 3.700 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)Nc2c3c(nn2C(C)C)CCC3)c1 ZINC000471698848 932642722 /nfs/dbraw/zinc/64/27/22/932642722.db2.gz SSKSYYGXYMDUEA-UHFFFAOYSA-N 0 0 360.439 3.835 20 5 FHBDRN Cc1ccc2c(c1)N(C(=O)CSc1ccc([N+](=O)[O-])cc1)C[C@H](C)O2 ZINC000477535989 932675355 /nfs/dbraw/zinc/67/53/55/932675355.db2.gz NBOYJBOBNPDGTP-ZDUSSCGKSA-N 0 0 358.419 3.809 20 5 FHBDRN CC1(C)[C@@H](NC(=O)c2csc([N+](=O)[O-])c2)C[C@@H]1OCc1ccccc1 ZINC000471715981 932691850 /nfs/dbraw/zinc/69/18/50/932691850.db2.gz MAFSCTIEKOIYON-GJZGRUSLSA-N 0 0 360.435 3.770 20 5 FHBDRN CC[C@H](C)n1ncc(NC(=O)CNc2ccccc2[N+](=O)[O-])c1C1CC1 ZINC000477568339 932695166 /nfs/dbraw/zinc/69/51/66/932695166.db2.gz ZGDHAWYHSHMUFU-LBPRGKRZSA-N 0 0 357.414 3.690 20 5 FHBDRN CC[C@H](C)n1ncc(NC(=O)Cc2ccc([N+](=O)[O-])cc2F)c1C1CC1 ZINC000477567308 932695203 /nfs/dbraw/zinc/69/52/03/932695203.db2.gz WNWZUGOTFUSZCP-NSHDSACASA-N 0 0 360.389 3.960 20 5 FHBDRN Cc1nc(Cn2cc([N+](=O)[O-])cc(C)c2=O)oc1-c1ccc(Cl)cc1 ZINC000127314408 932705407 /nfs/dbraw/zinc/70/54/07/932705407.db2.gz LUKGRPXZYYLTND-UHFFFAOYSA-N 0 0 359.769 3.730 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)Nc1c(-c2ccncc2)nc2ccccn21 ZINC000430661563 932705545 /nfs/dbraw/zinc/70/55/45/932705545.db2.gz GCTNRVRIKNQEFZ-UHFFFAOYSA-N 0 0 373.372 3.865 20 5 FHBDRN Cc1cc2c(cc1C)[C@@H](C(=O)N1c3ccc([N+](=O)[O-])cc3C[C@@H]1C)CO2 ZINC000471734395 932737534 /nfs/dbraw/zinc/73/75/34/932737534.db2.gz FTVMHLNALHHHPR-GUYCJALGSA-N 0 0 352.390 3.665 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)N[C@@H]1CC[C@H](c2ccc(F)cc2)C1 ZINC000471735447 932741312 /nfs/dbraw/zinc/74/13/12/932741312.db2.gz JFZOWLXBAPQYOU-FUHWJXTLSA-N 0 0 371.412 3.912 20 5 FHBDRN O=[N+]([O-])c1nn(Cc2cc(Cl)cc(Cl)c2)cc1Br ZINC000581853338 932745295 /nfs/dbraw/zinc/74/52/95/932745295.db2.gz YCEXZTTXMZPKRX-UHFFFAOYSA-N 0 0 350.987 3.909 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CCCSc2ccccc21 ZINC000045911966 932748846 /nfs/dbraw/zinc/74/88/46/932748846.db2.gz JIVNBWHNYXKSDQ-UHFFFAOYSA-N 0 0 357.435 3.844 20 5 FHBDRN Cc1ccc(C(=O)OCC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)cc1C ZINC000003443599 932752697 /nfs/dbraw/zinc/75/26/97/932752697.db2.gz AOLGDTYLPYLUPT-UHFFFAOYSA-N 0 0 362.769 3.661 20 5 FHBDRN CCOC(=O)c1cc(NCC2(CCOC)CCCC2)ccc1[N+](=O)[O-] ZINC000471750723 932787129 /nfs/dbraw/zinc/78/71/29/932787129.db2.gz PFLIVPUJAKGGQW-UHFFFAOYSA-N 0 0 350.415 3.780 20 5 FHBDRN O=C(Cc1ccc(O)cc1Cl)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000135274953 932790012 /nfs/dbraw/zinc/79/00/12/932790012.db2.gz KVSWQXXIJYIPDG-UHFFFAOYSA-N 0 0 360.797 3.688 20 5 FHBDRN COc1cc(-c2nc(COc3ncc(C)cc3[N+](=O)[O-])cs2)ccc1O ZINC000157973106 932837552 /nfs/dbraw/zinc/83/75/52/932837552.db2.gz ADYXHOHKDXQNKB-UHFFFAOYSA-N 0 0 373.390 3.715 20 5 FHBDRN O=C(OCc1ccc(F)c(F)c1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000781718316 932847394 /nfs/dbraw/zinc/84/73/94/932847394.db2.gz IBABOVZDYFDCCW-UHFFFAOYSA-N 0 0 359.231 3.831 20 5 FHBDRN Cc1cc(C)nc(NC(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)c1 ZINC000510480861 932850623 /nfs/dbraw/zinc/85/06/23/932850623.db2.gz VCTZSUUFTPVZOA-UHFFFAOYSA-N 0 0 364.199 3.930 20 5 FHBDRN C[C@H](OC(=O)Cc1ccccc1[N+](=O)[O-])c1nc2cc(Cl)ccc2n1C ZINC000176036911 932876214 /nfs/dbraw/zinc/87/62/14/932876214.db2.gz ATLLMWURXFDDRV-NSHDSACASA-N 0 0 373.796 3.982 20 5 FHBDRN C[C@@H]1CCN(C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C[C@@H]1n1ccnc1 ZINC000127342570 932886306 /nfs/dbraw/zinc/88/63/06/932886306.db2.gz JZAMMTIZYLHQQQ-ABAIWWIYSA-N 0 0 363.805 3.560 20 5 FHBDRN Cn1cc(CNc2ccc3c(c2)CCCO3)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000178218989 932908621 /nfs/dbraw/zinc/90/86/21/932908621.db2.gz SSIMMNLDDCLUHC-UHFFFAOYSA-N 0 0 364.405 3.932 20 5 FHBDRN COCCN(Cc1ccccc1)C(=O)/C(C)=C\c1ccc([N+](=O)[O-])cc1 ZINC000588435419 932930026 /nfs/dbraw/zinc/93/00/26/932930026.db2.gz LGALYKNTVSWPDL-PEZBUJJGSA-N 0 0 354.406 3.673 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNc1ccnc(Cc2ccccc2)n1 ZINC000165883881 932940396 /nfs/dbraw/zinc/94/03/96/932940396.db2.gz HLEWWAMDSJZADV-UHFFFAOYSA-N 0 0 350.378 3.596 20 5 FHBDRN CCOc1cccc([C@H](C)NC(=O)[C@H]2C[C@@H]2c2cccc([N+](=O)[O-])c2)c1 ZINC001125542203 932941936 /nfs/dbraw/zinc/94/19/36/932941936.db2.gz WLBXMJFLIWOIKO-BKTGTZMESA-N 0 0 354.406 3.974 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)Nc1ccccc1OCC(F)F ZINC000178236650 932945572 /nfs/dbraw/zinc/94/55/72/932945572.db2.gz KIDHJRVPDFOGIU-UHFFFAOYSA-N 0 0 365.336 3.903 20 5 FHBDRN Cc1cc(OCC(=O)N2C[C@H](c3ccc(F)cc3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000430687605 932946312 /nfs/dbraw/zinc/94/63/12/932946312.db2.gz RMZVOTNUKHDPAX-GOEBONIOSA-N 0 0 372.396 3.826 20 5 FHBDRN CCc1nc(C)c([C@H](C)N(C)C(=O)NCc2cccc([N+](=O)[O-])c2)s1 ZINC000175975810 932948140 /nfs/dbraw/zinc/94/81/40/932948140.db2.gz RRXAJYMYRDISHJ-LBPRGKRZSA-N 0 0 362.455 3.825 20 5 FHBDRN CC[C@H](CNC(=O)c1cc(F)c(F)cc1[N+](=O)[O-])Oc1cccc(C)c1 ZINC000175976037 932948558 /nfs/dbraw/zinc/94/85/58/932948558.db2.gz HTCQLLSFZVMCRA-GFCCVEGCSA-N 0 0 364.348 3.769 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(-c2nnco2)c1 ZINC000588436534 932953437 /nfs/dbraw/zinc/95/34/37/932953437.db2.gz XXTPVGSGSZVKHX-XFXZXTDPSA-N 0 0 350.334 3.687 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC([C@H]2CCCO2)CC1 ZINC000187514143 932971147 /nfs/dbraw/zinc/97/11/47/932971147.db2.gz ZFLRZJDLIWAAPK-MRXNPFEDSA-N 0 0 364.467 3.738 20 5 FHBDRN COc1cc(-c2nc(-c3ccc(Br)o3)no2)ccc1[N+](=O)[O-] ZINC000178266128 933004009 /nfs/dbraw/zinc/00/40/09/933004009.db2.gz CSQDGMWXUOTMSF-UHFFFAOYSA-N 0 0 366.127 3.676 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CNc1cccc(C(C)(F)F)c1 ZINC000187572443 933005331 /nfs/dbraw/zinc/00/53/31/933005331.db2.gz ICKITHHSDBYXJB-UHFFFAOYSA-N 0 0 365.336 3.766 20 5 FHBDRN CC(F)(F)c1cccc(NCC(=O)N2CCc3ccc([N+](=O)[O-])cc32)c1 ZINC000187572837 933006953 /nfs/dbraw/zinc/00/69/53/933006953.db2.gz WULMQOJUMLWRSF-UHFFFAOYSA-N 0 0 361.348 3.708 20 5 FHBDRN CS[C@H]1CCC[C@H](NC(=O)c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000175982658 933007048 /nfs/dbraw/zinc/00/70/48/933007048.db2.gz ZKZXEZVNNNVDDW-QWRGUYRKSA-N 0 0 373.272 3.761 20 5 FHBDRN Cc1cc2c(cc1C)[C@H](C(=O)N1CCCc3ccc([N+](=O)[O-])cc31)CO2 ZINC000471819750 933036712 /nfs/dbraw/zinc/03/67/12/933036712.db2.gz JQUYCWPWVIQPOK-QGZVFWFLSA-N 0 0 352.390 3.667 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc(C)nn1-c1ccccn1 ZINC000588438334 933057554 /nfs/dbraw/zinc/05/75/54/933057554.db2.gz HMUUSNYOFAYIRI-QBFSEMIESA-N 0 0 363.377 3.526 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N1C[C@@H](C)C(=O)Nc2ccccc21 ZINC000588439716 933063749 /nfs/dbraw/zinc/06/37/49/933063749.db2.gz WDCZRRAJOALBTP-YBEMTRGBSA-N 0 0 365.389 3.620 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CN1CCC[C@H]1c1nc2c(n1C)CCCC2 ZINC000548349389 933064532 /nfs/dbraw/zinc/06/45/32/933064532.db2.gz BSNFVXLTYXIVQM-SFHVURJKSA-N 0 0 370.453 3.553 20 5 FHBDRN Cc1c(CN2CCC[C@H]2c2nc3c(n2C)CCCC3)cccc1[N+](=O)[O-] ZINC000548349965 933066408 /nfs/dbraw/zinc/06/64/08/933066408.db2.gz FVXUOVDEUPHLNO-IBGZPJMESA-N 0 0 354.454 3.853 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)N1CCC[C@H]1C[C@H](O)c1cccs1 ZINC000175997588 933075147 /nfs/dbraw/zinc/07/51/47/933075147.db2.gz NGHWIRVCFRVOOQ-GJZGRUSLSA-N 0 0 361.423 3.776 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N[C@H](C)C[C@@H](O)c1ccccc1 ZINC000588446631 933159768 /nfs/dbraw/zinc/15/97/68/933159768.db2.gz SKJGYZBYXTZOQQ-ODNRPBLHSA-N 0 0 354.406 3.627 20 5 FHBDRN COCc1nc2cc(NC(=O)/C(C)=C\c3ccc([N+](=O)[O-])cc3)ccc2o1 ZINC000588446750 933167998 /nfs/dbraw/zinc/16/79/98/933167998.db2.gz LZPJWXNRQNZRDS-XFXZXTDPSA-N 0 0 367.361 3.924 20 5 FHBDRN C=CC(=O)Nc1cc(NC(=O)/C(C)=C\c2ccc([N+](=O)[O-])cc2)ccc1F ZINC000588446782 933169212 /nfs/dbraw/zinc/16/92/12/933169212.db2.gz RVWXRYJMJGULGO-BENRWUELSA-N 0 0 369.352 3.900 20 5 FHBDRN Cc1c(F)c(C(F)(F)F)ccc1C(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000468106761 933185127 /nfs/dbraw/zinc/18/51/27/933185127.db2.gz UPRRVVBIVFQZQY-UHFFFAOYSA-N 0 0 356.275 3.991 20 5 FHBDRN Cn1cc(-c2cc(F)ccc2NC(=O)c2cc(F)cc([N+](=O)[O-])c2)cn1 ZINC000477695357 933193849 /nfs/dbraw/zinc/19/38/49/933193849.db2.gz RVWNYLOGLBEWDX-UHFFFAOYSA-N 0 0 358.304 3.526 20 5 FHBDRN CCc1csc(NC(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)n1 ZINC000510572752 933231196 /nfs/dbraw/zinc/23/11/96/933231196.db2.gz VWFDHDVXUOJERZ-UHFFFAOYSA-N 0 0 370.228 3.937 20 5 FHBDRN O=C1OC(c2ccc(Cl)c([N+](=O)[O-])c2)=N/C1=C/c1cccnc1Cl ZINC000255397249 933237592 /nfs/dbraw/zinc/23/75/92/933237592.db2.gz CYXGNOUTFBZFLJ-IZZDOVSWSA-N 0 0 364.144 3.641 20 5 FHBDRN CC(=O)c1ccc(NC(=O)COc2ccc([N+](=O)[O-])c(C)c2)cc1Cl ZINC000430799661 933237647 /nfs/dbraw/zinc/23/76/47/933237647.db2.gz MDBSAYBSOGBOIT-UHFFFAOYSA-N 0 0 362.769 3.777 20 5 FHBDRN O=C(C=Cc1nc2ccccc2s1)Nc1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000255397300 933238940 /nfs/dbraw/zinc/23/89/40/933238940.db2.gz GTVGZINAVNYBBT-FPLPWBNLSA-N 0 0 365.374 3.733 20 5 FHBDRN Cc1cc(OCC(=O)NC[C@@H]2CCC[C@H](C(F)(F)F)C2)ccc1[N+](=O)[O-] ZINC000430807276 933251097 /nfs/dbraw/zinc/25/10/97/933251097.db2.gz LWLFCUVXNJODSO-OLZOCXBDSA-N 0 0 374.359 3.767 20 5 FHBDRN Cc1nn(Cc2ccc(C(=O)NCC3CC(C)(C)C3)cc2)c(C)c1[N+](=O)[O-] ZINC000548384606 933261039 /nfs/dbraw/zinc/26/10/39/933261039.db2.gz KJZYIGASUDDPMC-UHFFFAOYSA-N 0 0 370.453 3.622 20 5 FHBDRN COc1cc(C(=O)NCC[C@H]2CCCC[C@H]2C)c([N+](=O)[O-])cc1OC ZINC000510603881 933265076 /nfs/dbraw/zinc/26/50/76/933265076.db2.gz YRPOWAVIXBWFTP-CHWSQXEVSA-N 0 0 350.415 3.558 20 5 FHBDRN CCN(C(=O)COc1ccc([N+](=O)[O-])c(C)c1)c1ccc2[nH]ccc2c1 ZINC000430826040 933271157 /nfs/dbraw/zinc/27/11/57/933271157.db2.gz UIXHZZAHNMKLAG-UHFFFAOYSA-N 0 0 353.378 3.816 20 5 FHBDRN C/C=C/c1ccc(NC(=O)C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)cc1 ZINC000510610892 933282800 /nfs/dbraw/zinc/28/28/00/933282800.db2.gz LBUKYPIGUDXMKQ-SNAWJCMRSA-N 0 0 353.378 3.822 20 5 FHBDRN Cc1cc(OCC(=O)N[C@H]2CCCc3ccc(F)cc32)ccc1[N+](=O)[O-] ZINC000430831803 933282995 /nfs/dbraw/zinc/28/29/95/933282995.db2.gz VVKZLYJKXDGDBF-KRWDZBQOSA-N 0 0 358.369 3.615 20 5 FHBDRN Cc1cc(OCC(=O)N(C)Cc2cccc(OC(C)C)c2)ccc1[N+](=O)[O-] ZINC000430838495 933287717 /nfs/dbraw/zinc/28/77/17/933287717.db2.gz KPYOAYSQPXIVFR-UHFFFAOYSA-N 0 0 372.421 3.728 20 5 FHBDRN O=[N+]([O-])c1ccc2oc(CN3CCC[C@H]3c3ccc4c(c3)OCO4)nc2c1 ZINC000610581419 933318361 /nfs/dbraw/zinc/31/83/61/933318361.db2.gz ZUMLKBJGWKGZJI-HNNXBMFYSA-N 0 0 367.361 3.802 20 5 FHBDRN O=[N+]([O-])c1ccc2oc(CN3CCCC[C@@H]3c3noc(C4CC4)n3)nc2c1 ZINC000610581174 933322399 /nfs/dbraw/zinc/32/23/99/933322399.db2.gz JBAXUQBLYDYPSE-CQSZACIVSA-N 0 0 369.381 3.724 20 5 FHBDRN Cc1ccccc1N1CCN(C(=O)C(C)(C)c2ccccc2[N+](=O)[O-])CC1 ZINC000430880746 933355158 /nfs/dbraw/zinc/35/51/58/933355158.db2.gz VMHAXBAGDUAMNI-UHFFFAOYSA-N 0 0 367.449 3.530 20 5 FHBDRN Cc1ccc(-c2csc(NC(=O)[C@@H](C)c3cncnc3)n2)cc1[N+](=O)[O-] ZINC000430898890 933379752 /nfs/dbraw/zinc/37/97/52/933379752.db2.gz XUUMFIHXQAVOEI-NSHDSACASA-N 0 0 369.406 3.559 20 5 FHBDRN CNc1ccc(C(=O)N(CCC(F)(F)F)CC(F)(F)F)cc1[N+](=O)[O-] ZINC000548396467 933404152 /nfs/dbraw/zinc/40/41/52/933404152.db2.gz AXUIMXZJKGICMQ-UHFFFAOYSA-N 0 0 373.253 3.593 20 5 FHBDRN COC[C@@H]1CCCN1c1ccc(C(=O)Nc2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000610588381 933438016 /nfs/dbraw/zinc/43/80/16/933438016.db2.gz LAQVWGNSENHCQL-KRWDZBQOSA-N 0 0 369.421 3.771 20 5 FHBDRN Cc1cc(C(=O)N2C[C@H](C(F)(F)F)[C@H](C(F)(F)F)C2)ccc1[N+](=O)[O-] ZINC000610598092 933482888 /nfs/dbraw/zinc/48/28/88/933482888.db2.gz SBLDMACQCOBJLR-AOOOYVTPSA-N 0 0 370.249 3.716 20 5 FHBDRN Cc1cccc(C(=O)N2C[C@@H](C(F)(F)F)[C@H](C(F)(F)F)C2)c1[N+](=O)[O-] ZINC000610597893 933484039 /nfs/dbraw/zinc/48/40/39/933484039.db2.gz JHCMPBIJONXWFF-NXEZZACHSA-N 0 0 370.249 3.716 20 5 FHBDRN C[C@@H](OC(=O)Cc1ccccc1[N+](=O)[O-])c1nc2ccc(Cl)cc2n1C ZINC000176018554 933518675 /nfs/dbraw/zinc/51/86/75/933518675.db2.gz OPOWJPMLNKJSRD-LLVKDONJSA-N 0 0 373.796 3.982 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)c2cc3c([nH]c2=O)CCCCC3)cc1[N+](=O)[O-] ZINC000610620908 933550329 /nfs/dbraw/zinc/55/03/29/933550329.db2.gz ZURLINVBOSGHQA-CYBMUJFWSA-N 0 0 369.421 3.764 20 5 FHBDRN CC(F)(F)c1cccc(NC(=O)NCCOc2ccc([N+](=O)[O-])cc2)c1 ZINC000548414590 933557981 /nfs/dbraw/zinc/55/79/81/933557981.db2.gz JRSQWLLZXZPSFM-UHFFFAOYSA-N 0 0 365.336 3.907 20 5 FHBDRN CCc1ccc(C(=O)N[C@@H](c2ccccc2)[C@H]2CCCO2)cc1[N+](=O)[O-] ZINC000471904883 933601829 /nfs/dbraw/zinc/60/18/29/933601829.db2.gz IDMQBZRSCBMBER-MOPGFXCFSA-N 0 0 354.406 3.807 20 5 FHBDRN COc1cc(C(=O)N[C@@H](C)c2ccccc2OC(F)F)ccc1[N+](=O)[O-] ZINC000510736190 933608143 /nfs/dbraw/zinc/60/81/43/933608143.db2.gz QLNKMRGGDOJGSG-JTQLQIEISA-N 0 0 366.320 3.696 20 5 FHBDRN CN(C(=O)c1ccc(C(=O)NCC(C)(C)C)cc1)c1cccc([N+](=O)[O-])c1 ZINC000158021124 933636372 /nfs/dbraw/zinc/63/63/72/933636372.db2.gz WOUATSBYAQVHMJ-UHFFFAOYSA-N 0 0 369.421 3.647 20 5 FHBDRN Cc1nn(C)c(C(=O)Nc2ccccc2SC2CCCC2)c1[N+](=O)[O-] ZINC000098098302 933640331 /nfs/dbraw/zinc/64/03/31/933640331.db2.gz KJIQJZFLIMUHAL-UHFFFAOYSA-N 0 0 360.439 3.924 20 5 FHBDRN O=C(Nc1ccc2cc([N+](=O)[O-])ccc2n1)C1(c2ccc(F)cc2)CCC1 ZINC000610653777 933652609 /nfs/dbraw/zinc/65/26/09/933652609.db2.gz ZUVVGVAEEOBZHD-UHFFFAOYSA-N 0 0 365.364 3.764 20 5 FHBDRN Cc1cccc(CC2CN(C(=O)Cn3ccc4cc([N+](=O)[O-])ccc43)C2)c1 ZINC000610659757 933670325 /nfs/dbraw/zinc/67/03/25/933670325.db2.gz QGBNUNXJLLHZOW-UHFFFAOYSA-N 0 0 363.417 3.559 20 5 FHBDRN Cc1nn(-c2ccccc2)cc1C(=O)Nc1c(C)ccc([N+](=O)[O-])c1C ZINC000610664701 933684720 /nfs/dbraw/zinc/68/47/20/933684720.db2.gz VIIQSNFAQXUQIT-UHFFFAOYSA-N 0 0 350.378 3.958 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1Sc1cc2c(nn1)CCC2 ZINC000610661761 933688478 /nfs/dbraw/zinc/68/84/78/933688478.db2.gz DFYWZHLIIBPEOE-UHFFFAOYSA-N 0 0 352.213 3.787 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)Nc1nnc(Cc2ccccc2)s1 ZINC000610665140 933700277 /nfs/dbraw/zinc/70/02/77/933700277.db2.gz CIYONDRJAFDOKG-UHFFFAOYSA-N 0 0 368.418 3.608 20 5 FHBDRN Cc1cc(N[C@@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)ccc1C1CC1 ZINC000477844335 933724849 /nfs/dbraw/zinc/72/48/49/933724849.db2.gz DJEILQQUHZUQPB-GOSISDBHSA-N 0 0 365.389 3.525 20 5 FHBDRN CC[C@H]1CN(C)c2ccccc2CN1C(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000610675855 933750971 /nfs/dbraw/zinc/75/09/71/933750971.db2.gz BYDUJIBGQNUDJL-KRWDZBQOSA-N 0 0 368.437 3.535 20 5 FHBDRN Cc1noc(C[C@H](NCc2c(F)cc([N+](=O)[O-])cc2F)c2ccccc2)n1 ZINC000510812938 933783865 /nfs/dbraw/zinc/78/38/65/933783865.db2.gz SOFKUYAGJCEZLB-KRWDZBQOSA-N 0 0 374.347 3.638 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)N1CCCc2cccc(OC(F)F)c21 ZINC000098106556 933793081 /nfs/dbraw/zinc/79/30/81/933793081.db2.gz LQLPQJAZXFNAAP-UHFFFAOYSA-N 0 0 362.332 3.718 20 5 FHBDRN O=C(Cc1cccc([N+](=O)[O-])c1)Nc1cccc(NCC(F)(F)F)c1 ZINC000468135188 933820028 /nfs/dbraw/zinc/82/00/28/933820028.db2.gz YXFGBUYCYMCHLM-UHFFFAOYSA-N 0 0 353.300 3.750 20 5 FHBDRN Cc1ccc([C@@H](NS(=O)(=O)CCc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000431096791 933829024 /nfs/dbraw/zinc/82/90/24/933829024.db2.gz KYVIMTWQNBIYNX-LJQANCHMSA-N 0 0 374.462 3.516 20 5 FHBDRN C[C@@H]1CCCN(c2ccc(C(=O)NC3(C(F)(F)F)CC3)cc2[N+](=O)[O-])C1 ZINC000610704250 933848908 /nfs/dbraw/zinc/84/89/08/933848908.db2.gz LREHKDYSVGSYMF-LLVKDONJSA-N 0 0 371.359 3.656 20 5 FHBDRN CCC1(CC)CCCN(S(=O)(=O)CCc2ccccc2[N+](=O)[O-])CC1 ZINC001211526551 933863966 /nfs/dbraw/zinc/86/39/66/933863966.db2.gz ZHBAXMWUBVTXQT-UHFFFAOYSA-N 0 0 368.499 3.759 20 5 FHBDRN C[C@H]1c2nncn2CCN1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000276877226 933866755 /nfs/dbraw/zinc/86/67/55/933866755.db2.gz ZLLGCUZBEITCAC-NSHDSACASA-N 0 0 373.800 3.677 20 5 FHBDRN CC1(C)CN(C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)c2ccccc21 ZINC000610709137 933875965 /nfs/dbraw/zinc/87/59/65/933875965.db2.gz RNWSBWYSDSCQQU-UHFFFAOYSA-N 0 0 362.389 3.719 20 5 FHBDRN CCOC(=O)c1cc(N2CCCO[C@H](c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000610715401 933906393 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Cc1nc(N2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)ccc1[N+](=O)[O-] ZINC000610755407 934096553 /nfs/dbraw/zinc/09/65/53/934096553.db2.gz WSQWLKZIQQDRSO-IUCAKERBSA-N 0 0 357.254 3.865 20 5 FHBDRN CC[C@@H](Nc1ccc([N+](=O)[O-])s1)[C@@H]1CN(Cc2ccccc2)CCO1 ZINC000610756130 934105420 /nfs/dbraw/zinc/10/54/20/934105420.db2.gz YKMHNKUTMVEYAL-CVEARBPZSA-N 0 0 361.467 3.748 20 5 FHBDRN CC(C)(C)OC(=O)C[C@H]1CCCN(Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000610763307 934122403 /nfs/dbraw/zinc/12/24/03/934122403.db2.gz DOKYNAJNVWSSKE-CYBMUJFWSA-N 0 0 352.406 3.678 20 5 FHBDRN Cn1nc(Br)cc1/C=C/c1ccc2c(cccc2[N+](=O)[O-])n1 ZINC000782301900 934167400 /nfs/dbraw/zinc/16/74/00/934167400.db2.gz DZKWOWHJLOQQHX-FNORWQNLSA-N 0 0 359.183 3.809 20 5 FHBDRN Cc1nn(-c2ccccc2)cc1CNC(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000510931038 934187888 /nfs/dbraw/zinc/18/78/88/934187888.db2.gz QLXJJPWKRDTFJI-UHFFFAOYSA-N 0 0 370.796 3.672 20 5 FHBDRN COc1cc(C(=O)N2CCc3ccccc3[C@@H]2C(C)C)ccc1[N+](=O)[O-] ZINC000610792022 934209275 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ZINC000003514811 934480147 /nfs/dbraw/zinc/48/01/47/934480147.db2.gz RDOKGXLKGFFTEU-UHFFFAOYSA-N 0 0 374.368 3.827 20 5 FHBDRN Cc1ccccc1NC(=O)[C@@H](C)OC(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000003514220 934483021 /nfs/dbraw/zinc/48/30/21/934483021.db2.gz NLHQIPAJNWCDJF-LLVKDONJSA-N 0 0 362.769 3.741 20 5 FHBDRN C[C@@H]([NH2+]Cc1ccnn1CCc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000610831448 934502599 /nfs/dbraw/zinc/50/25/99/934502599.db2.gz UAVBUWRPNDFXNU-MRXNPFEDSA-N 0 0 350.422 3.885 20 5 FHBDRN COC(=O)C(C)(C)[C@@H](NC(=O)c1ccc([N+](=O)[O-])c(C)c1)c1ccccc1 ZINC000610823774 934508187 /nfs/dbraw/zinc/50/81/87/934508187.db2.gz KBDLSVCSZJMRPM-KRWDZBQOSA-N 0 0 370.405 3.574 20 5 FHBDRN O=[N+]([O-])c1ccc(NC[C@H](CO)Cc2ccc(C(F)(F)F)cc2)s1 ZINC000610864790 934538981 /nfs/dbraw/zinc/53/89/81/934538981.db2.gz VWVVFKBPIMVYDQ-LLVKDONJSA-N 0 0 360.357 3.938 20 5 FHBDRN C[C@@H](Cc1cccc(F)c1)N(C)C(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000458264131 934545006 /nfs/dbraw/zinc/54/50/06/934545006.db2.gz FLRSMDNBZBLCBQ-AWEZNQCLSA-N 0 0 360.385 3.592 20 5 FHBDRN Cc1cc(F)cc(C(=O)N(C)[C@H]2CCCN(c3ccccc3)C2)c1[N+](=O)[O-] ZINC000176238455 934551622 /nfs/dbraw/zinc/55/16/22/934551622.db2.gz UQSVECUCBQRIRX-KRWDZBQOSA-N 0 0 371.412 3.783 20 5 FHBDRN C[C@]1(c2ccccc2)C[C@H]1NC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000610880725 934553141 /nfs/dbraw/zinc/55/31/41/934553141.db2.gz NKDQJIDPXQYIFA-TZIWHRDSSA-N 0 0 365.433 3.999 20 5 FHBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)O[C@H](c1ncccn1)C1CCCC1 ZINC000255420866 934567417 /nfs/dbraw/zinc/56/74/17/934567417.db2.gz SEJJPKJNTSIEIY-YFWYWMRJSA-N 0 0 353.378 3.873 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)Nc1c(F)cccc1Br ZINC000084245449 934596756 /nfs/dbraw/zinc/59/67/56/934596756.db2.gz ILZUFPRQNVKCRT-UHFFFAOYSA-N 0 0 353.147 3.678 20 5 FHBDRN CC1(C)CN(S(=O)(=O)c2ccc([N+](=O)[O-])s2)c2ccccc2S1 ZINC000176207998 934605579 /nfs/dbraw/zinc/60/55/79/934605579.db2.gz VCLHBOSVYQBAQI-UHFFFAOYSA-N 0 0 370.477 3.736 20 5 FHBDRN 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Cc1ccc(S(=O)(=O)N2C[C@H](C)C[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000510994821 934802967 /nfs/dbraw/zinc/80/29/67/934802967.db2.gz HWPFJLAZQURCFQ-FZKQIMNGSA-N 0 0 360.435 3.675 20 5 FHBDRN CC1CCN(C(=O)c2ccccc2NC(=O)c2ccccc2[N+](=O)[O-])CC1 ZINC000014003901 934810120 /nfs/dbraw/zinc/81/01/20/934810120.db2.gz FXXYFLQZHSXTTE-UHFFFAOYSA-N 0 0 367.405 3.719 20 5 FHBDRN Cc1cccc(C(=O)Nc2ccc(Br)nc2C)c1[N+](=O)[O-] ZINC000091100854 934814091 /nfs/dbraw/zinc/81/40/91/934814091.db2.gz BUBMDGYDAFFYMI-UHFFFAOYSA-N 0 0 350.172 3.621 20 5 FHBDRN O=C(COc1cccc([N+](=O)[O-])c1)N1CC=C(c2c(F)cccc2F)CC1 ZINC000472015001 934830072 /nfs/dbraw/zinc/83/00/72/934830072.db2.gz ZXQZFXRCMGJBMP-UHFFFAOYSA-N 0 0 374.343 3.568 20 5 FHBDRN Cc1ccc(CC(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)s1 ZINC000091963852 934833604 /nfs/dbraw/zinc/83/36/04/934833604.db2.gz DRLHOUNXCFZNST-UHFFFAOYSA-N 0 0 355.213 3.908 20 5 FHBDRN O=Cc1ccc(OCC(=O)N2CCCCC[C@H]2c2ccco2)c([N+](=O)[O-])c1 ZINC000119498900 934835588 /nfs/dbraw/zinc/83/55/88/934835588.db2.gz JSCGRHBHFCSPEK-HNNXBMFYSA-N 0 0 372.377 3.523 20 5 FHBDRN CCN(C(=O)CCOc1cc(C)ccc1[N+](=O)[O-])c1ccc(OC)cc1 ZINC000538399847 934838408 /nfs/dbraw/zinc/83/84/08/934838408.db2.gz PSQKSYBENYCPAX-UHFFFAOYSA-N 0 0 358.394 3.734 20 5 FHBDRN CCN(c1ccc(F)cc1)S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000119510808 934851273 /nfs/dbraw/zinc/85/12/73/934851273.db2.gz ZPAYALFSTQSTJW-UHFFFAOYSA-N 0 0 358.778 3.603 20 5 FHBDRN C[C@H]1CC[C@@H](C(F)(F)F)CN1C(=O)c1c[nH]c2cccc([N+](=O)[O-])c21 ZINC000611561778 934872693 /nfs/dbraw/zinc/87/26/93/934872693.db2.gz MWAFCZCMCKCBOW-VHSXEESVSA-N 0 0 355.316 3.879 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)c1nc(N)nc(Nc2ccccc2)n1 ZINC000071814122 934879519 /nfs/dbraw/zinc/87/95/19/934879519.db2.gz ACFRAPPFSMLTFA-LLVKDONJSA-N 0 0 368.422 3.959 20 5 FHBDRN Cc1nn2c(CN3CCc4c(cccc4[N+](=O)[O-])C3)c(C(C)C)nc2s1 ZINC000538726281 934893638 /nfs/dbraw/zinc/89/36/38/934893638.db2.gz HWFXVQVSCGTECW-UHFFFAOYSA-N 0 0 371.466 3.689 20 5 FHBDRN COc1ccc(-c2nc(COc3ccc(OC)cc3[N+](=O)[O-])co2)cc1 ZINC000071836248 934895057 /nfs/dbraw/zinc/89/50/57/934895057.db2.gz UKWYBXZIWFOXBL-UHFFFAOYSA-N 0 0 356.334 3.846 20 5 FHBDRN CC(C)CCSc1ccc(C(=O)N2CCC(=O)CC2)cc1[N+](=O)[O-] ZINC000538705521 934895709 /nfs/dbraw/zinc/89/57/09/934895709.db2.gz QKGMICFVEOQPPZ-UHFFFAOYSA-N 0 0 350.440 3.538 20 5 FHBDRN COc1ccc(C(=O)Nc2ccccc2OCC(F)(F)F)cc1[N+](=O)[O-] ZINC000014127500 934896878 /nfs/dbraw/zinc/89/68/78/934896878.db2.gz BECLWBZNWZCRCF-UHFFFAOYSA-N 0 0 370.283 3.797 20 5 FHBDRN O=C(NCc1cc([N+](=O)[O-])ccc1Cl)N1CC[C@H](CC(F)(F)F)C1 ZINC000277302940 934912468 /nfs/dbraw/zinc/91/24/68/934912468.db2.gz CGUOMBWNJBTRNI-SECBINFHSA-N 0 0 365.739 3.732 20 5 FHBDRN Cc1ccc(CNC(=O)c2cc([N+](=O)[O-])cc(Br)c2C)s1 ZINC000550600231 934945667 /nfs/dbraw/zinc/94/56/67/934945667.db2.gz VVXAXINQPYQLRX-UHFFFAOYSA-N 0 0 369.240 3.966 20 5 FHBDRN O=C(COc1ccccc1[N+](=O)[O-])NCc1cc(Cl)sc1Cl ZINC000538905608 934947417 /nfs/dbraw/zinc/94/74/17/934947417.db2.gz CLTCZNANMXCMIA-UHFFFAOYSA-N 0 0 361.206 3.658 20 5 FHBDRN O=C([C@H]1C[C@@]12CCc1ccccc12)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000178503346 934959155 /nfs/dbraw/zinc/95/91/55/934959155.db2.gz AZVJEOLGFPCERO-IFMALSPDSA-N 0 0 362.429 3.990 20 5 FHBDRN Cc1ccc(-c2cc(C(=O)N(Cc3cccc([N+](=O)[O-])c3)C3CC3)[nH]n2)o1 ZINC000178506453 934964669 /nfs/dbraw/zinc/96/46/69/934964669.db2.gz DWVYUWHUVUSGJZ-UHFFFAOYSA-N 0 0 366.377 3.691 20 5 FHBDRN CSc1cc(CNC(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)ccn1 ZINC000538971310 934969875 /nfs/dbraw/zinc/96/98/75/934969875.db2.gz DHGFKGSUNZECLF-LBPRGKRZSA-N 0 0 360.439 3.581 20 5 FHBDRN COc1ccc([C@H](OC)[C@H](C)Nc2nc3sccn3c2[N+](=O)[O-])cc1 ZINC000538979811 934975593 /nfs/dbraw/zinc/97/55/93/934975593.db2.gz KWLSBTTYZUDGEK-GXFFZTMASA-N 0 0 362.411 3.501 20 5 FHBDRN CCOC(=O)C1(C(=O)Nc2cccc(Oc3ccc([N+](=O)[O-])cc3)c2)CC1 ZINC000531062411 934978709 /nfs/dbraw/zinc/97/87/09/934978709.db2.gz VOVOAVCZJBXSIR-UHFFFAOYSA-N 0 0 370.361 3.669 20 5 FHBDRN CC(C)(C)[C@@H]1CCCC[C@H]1NC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000110050213 935002834 /nfs/dbraw/zinc/00/28/34/935002834.db2.gz SYXXEYNXNPHHID-NVXWUHKLSA-N 0 0 371.437 3.771 20 5 FHBDRN CCn1c(SCCCOC(C)C)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000157146470 935025532 /nfs/dbraw/zinc/02/55/32/935025532.db2.gz ZDPGGTDHIOCOGU-UHFFFAOYSA-N 0 0 350.444 3.780 20 5 FHBDRN Cc1n[nH]c(C)c1[C@@H]1CCCN1C(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000157173823 935027381 /nfs/dbraw/zinc/02/73/81/935027381.db2.gz MNJDATWIKRLNTK-BBRMVZONSA-N 0 0 374.466 3.779 20 5 FHBDRN Cc1n[nH]c(C)c1[C@H]1CCCN1C(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000157173675 935027578 /nfs/dbraw/zinc/02/75/78/935027578.db2.gz MNJDATWIKRLNTK-CZUORRHYSA-N 0 0 374.466 3.779 20 5 FHBDRN CO[C@@H](c1ccc(Br)cc1)[C@@H](C)Nc1ccc([N+](=O)[O-])cn1 ZINC000539107703 935028230 /nfs/dbraw/zinc/02/82/30/935028230.db2.gz UIJGLFDRUWPWFQ-MEBBXXQBSA-N 0 0 366.215 3.940 20 5 FHBDRN Cn1cc(NC(=O)CSc2ccc([N+](=O)[O-])cc2)c(-c2ccccc2)n1 ZINC000539135949 935039767 /nfs/dbraw/zinc/03/97/67/935039767.db2.gz GRVPMRATPGMXTM-UHFFFAOYSA-N 0 0 368.418 3.726 20 5 FHBDRN COc1ccc(COC(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])cc1 ZINC000728455585 935060387 /nfs/dbraw/zinc/06/03/87/935060387.db2.gz WGVMUFDOVGMDRN-UHFFFAOYSA-N 0 0 363.391 3.691 20 5 FHBDRN COc1ccccc1COC(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-] ZINC000728455477 935061024 /nfs/dbraw/zinc/06/10/24/935061024.db2.gz RORGNWPAOWMNFB-UHFFFAOYSA-N 0 0 363.391 3.691 20 5 FHBDRN C[C@H](NC(=O)c1cc2cc([N+](=O)[O-])ccc2o1)c1nc(C(C)(C)C)no1 ZINC000437154076 945074082 /nfs/dbraw/zinc/07/40/82/945074082.db2.gz XHQGDYAWQSUTCV-VIFPVBQESA-N 0 0 358.354 3.513 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H](C)Cc1cccc(OC)c1 ZINC000439910502 945074718 /nfs/dbraw/zinc/07/47/18/945074718.db2.gz QSDDCNKGSKUFKJ-ZDUSSCGKSA-N 0 0 373.409 3.755 20 5 FHBDRN O=[N+]([O-])c1cccc(N2CCN(Cc3coc(-c4cccs4)n3)CC2)c1 ZINC000071952346 935075307 /nfs/dbraw/zinc/07/53/07/935075307.db2.gz WYUPFCXISLASGF-UHFFFAOYSA-N 0 0 370.434 3.634 20 5 FHBDRN CCOC(=O)c1nn(-c2ccccc2)cc1OCc1cccc([N+](=O)[O-])c1 ZINC000071962404 935097062 /nfs/dbraw/zinc/09/70/62/935097062.db2.gz PSWQXGLRWLNFSL-UHFFFAOYSA-N 0 0 367.361 3.536 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N(C)[C@H](C)c1cccc(O)c1 ZINC000439894763 945077955 /nfs/dbraw/zinc/07/79/55/945077955.db2.gz DLPCZNVYXIELPK-GFCCVEGCSA-N 0 0 359.382 3.924 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)Nc1ccc2[nH]c(C3CCC3)nc2c1 ZINC000119727789 935126258 /nfs/dbraw/zinc/12/62/58/935126258.db2.gz NHKATYVQHSZMRC-UHFFFAOYSA-N 0 0 351.366 3.694 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])c2cccnc12)N(CCC(F)(F)F)CC1CC1 ZINC000157668922 935129968 /nfs/dbraw/zinc/12/99/68/935129968.db2.gz ZPNMNDVUQIKHAI-UHFFFAOYSA-N 0 0 367.327 3.948 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)c1cccc(-c2ccoc2)c1 ZINC000119726690 935131861 /nfs/dbraw/zinc/13/18/61/935131861.db2.gz HKEYFCWJDFMVCV-UHFFFAOYSA-N 0 0 352.346 3.793 20 5 FHBDRN CC(C)(C)c1noc2ncc(C(=O)N3CCc4cc([N+](=O)[O-])ccc43)cc21 ZINC000518145608 945081769 /nfs/dbraw/zinc/08/17/69/945081769.db2.gz PSKSZNPHWWOKBU-UHFFFAOYSA-N 0 0 366.377 3.631 20 5 FHBDRN Cn1ncc([N+](=O)[O-])c1C(=O)Nc1ccc(CCCc2ccccc2)cc1 ZINC000166078450 935189211 /nfs/dbraw/zinc/18/92/11/935189211.db2.gz WPMPQUVJSSFXRZ-UHFFFAOYSA-N 0 0 364.405 3.756 20 5 FHBDRN CC[C@H](C)C(=O)O[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000023520620 945082671 /nfs/dbraw/zinc/08/26/71/945082671.db2.gz YHSHVZXIPIRQTA-IUCAKERBSA-N 0 0 362.304 3.530 20 5 FHBDRN O=C(c1c[nH]c2cc([N+](=O)[O-])ccc12)N(Cc1ccccc1)CC(F)F ZINC000437174884 945082994 /nfs/dbraw/zinc/08/29/94/945082994.db2.gz ZCLYIQHYZRNQGX-UHFFFAOYSA-N 0 0 359.332 3.984 20 5 FHBDRN O=C([O-])c1ccc(C[NH2+][C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])cc1 ZINC000263408390 935198903 /nfs/dbraw/zinc/19/89/03/935198903.db2.gz KNUZCZKBQWZHHM-FUHWJXTLSA-N 0 0 354.406 3.794 20 5 FHBDRN Cc1c(C(=O)Nc2ccc(OC[C@H]3CCCO3)cc2)cccc1[N+](=O)[O-] ZINC000046508159 935201852 /nfs/dbraw/zinc/20/18/52/935201852.db2.gz FRYIDLIPIJXZDJ-MRXNPFEDSA-N 0 0 356.378 3.713 20 5 FHBDRN O=[N+]([O-])c1ccc2nc(N3CC[C@H](n4cnc5c4CCCC5)C3)ccc2c1 ZINC000548662133 935202491 /nfs/dbraw/zinc/20/24/91/935202491.db2.gz RLYNXDCFIGMHFL-INIZCTEOSA-N 0 0 363.421 3.670 20 5 FHBDRN CC(C)(C(=O)N1CCC(c2ccncc2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000277454444 935206071 /nfs/dbraw/zinc/20/60/71/935206071.db2.gz GDPSSPXWLWQXRQ-UHFFFAOYSA-N 0 0 353.422 3.674 20 5 FHBDRN CC(C)C[C@H](C[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)C(=O)[O-] ZINC000263464980 935214858 /nfs/dbraw/zinc/21/48/58/935214858.db2.gz FXDWUWSDOHUKHR-CYBMUJFWSA-N 0 0 363.439 3.555 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)Sc1cccc(F)c1 ZINC000084842819 935217234 /nfs/dbraw/zinc/21/72/34/935217234.db2.gz XWUQEQIGYFSREL-JTQLQIEISA-N 0 0 350.371 3.862 20 5 FHBDRN COc1cc(NC(=O)CCOc2cc(C)ccc2[N+](=O)[O-])ccc1Cl ZINC000539497653 935222042 /nfs/dbraw/zinc/22/20/42/935222042.db2.gz OVRXSCDPXPQPFW-UHFFFAOYSA-N 0 0 364.785 3.973 20 5 FHBDRN COc1ccc(/C=C\C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc1O ZINC000588499865 935239937 /nfs/dbraw/zinc/23/99/37/935239937.db2.gz QERFJVBQTGAGBY-XFFZJAGNSA-N 0 0 370.405 3.759 20 5 FHBDRN Cc1sc(C(=O)Nc2ccc(CN(C)C)c(Cl)c2)cc1[N+](=O)[O-] ZINC000478040027 935249929 /nfs/dbraw/zinc/24/99/29/935249929.db2.gz ZWPNRNVSLMXHDA-UHFFFAOYSA-N 0 0 353.831 3.932 20 5 FHBDRN CSc1ccc(C(=O)Nc2nnc(CC(C)C)s2)cc1[N+](=O)[O-] ZINC000014380065 935253241 /nfs/dbraw/zinc/25/32/41/935253241.db2.gz ITKMFGQCHICNMN-UHFFFAOYSA-N 0 0 352.441 3.619 20 5 FHBDRN CC(C)c1cc(Br)ccc1NCc1c([N+](=O)[O-])ncn1C ZINC000551338962 935257006 /nfs/dbraw/zinc/25/70/06/935257006.db2.gz KUSGLCQPTHTOPK-UHFFFAOYSA-N 0 0 353.220 3.826 20 5 FHBDRN COc1ccc(NC(=O)CCSc2ccc(Cl)cn2)c([N+](=O)[O-])c1 ZINC000119819322 935258844 /nfs/dbraw/zinc/25/88/44/935258844.db2.gz YDWMHOWVHGNIHY-UHFFFAOYSA-N 0 0 367.814 3.773 20 5 FHBDRN Cc1c(Cc2nc3cc(C(F)(F)F)ccc3c(=O)[nH]2)cccc1[N+](=O)[O-] ZINC000119818866 935259531 /nfs/dbraw/zinc/25/95/31/935259531.db2.gz KRSFIYKXLGFMNW-UHFFFAOYSA-N 0 0 363.295 3.749 20 5 FHBDRN CCC(CC)(CNC(=O)c1[nH]nc(C)c1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000072075975 935270909 /nfs/dbraw/zinc/27/09/09/935270909.db2.gz GLGKAHKNWQVUSC-UHFFFAOYSA-N 0 0 364.833 3.768 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)cnc1N1CCC[C@H]1C[C@H](O)c1ccc(F)cc1 ZINC000161142800 935280302 /nfs/dbraw/zinc/28/03/02/935280302.db2.gz KVQNQXOREPDDNH-HOCLYGCPSA-N 0 0 365.792 3.875 20 5 FHBDRN O=[N+]([O-])c1ccc(CN(Cc2ccccc2)C[C@H](O)C(F)(F)F)c(F)c1 ZINC000611576688 935282859 /nfs/dbraw/zinc/28/28/59/935282859.db2.gz QJDMVJJNBNRNCM-INIZCTEOSA-N 0 0 372.318 3.659 20 5 FHBDRN CSc1ccc(-c2nc(-c3nccc4[nH]ccc43)no2)cc1[N+](=O)[O-] ZINC000551433692 935284062 /nfs/dbraw/zinc/28/40/62/935284062.db2.gz ITEMJQBTLKSZRA-UHFFFAOYSA-N 0 0 353.363 3.910 20 5 FHBDRN CCN(C(=O)c1cc([N+](=O)[O-])ccc1C)c1ccc(Br)cn1 ZINC000072080701 935286517 /nfs/dbraw/zinc/28/65/17/935286517.db2.gz YSDKCEBTOFTEAA-UHFFFAOYSA-N 0 0 364.199 3.727 20 5 FHBDRN CCOc1cc(CN2CCC(F)(c3cccnc3)CC2)ccc1[N+](=O)[O-] ZINC000551464179 935287890 /nfs/dbraw/zinc/28/78/90/935287890.db2.gz WXBZQTSJLRCCDO-UHFFFAOYSA-N 0 0 359.401 3.849 20 5 FHBDRN COc1ccc(CCNC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)c(Cl)c1 ZINC000472175296 935310439 /nfs/dbraw/zinc/31/04/39/935310439.db2.gz QXVKVGGYPJRPCO-UHFFFAOYSA-N 0 0 374.780 3.976 20 5 FHBDRN O=C(COc1ccsc1Cl)N1CCCc2ccc([N+](=O)[O-])cc21 ZINC000551557202 935310743 /nfs/dbraw/zinc/31/07/43/935310743.db2.gz BYISHSPNGBMCKX-UHFFFAOYSA-N 0 0 352.799 3.668 20 5 FHBDRN Cc1nn(Cc2ccc(C(=O)N3CCC[C@@H](C)CC3)cc2)c(C)c1[N+](=O)[O-] ZINC000068778862 935316602 /nfs/dbraw/zinc/31/66/02/935316602.db2.gz FOILMMUKWQODEI-CQSZACIVSA-N 0 0 370.453 3.719 20 5 FHBDRN CN(Cc1nc2c(s1)CCCC2)C(=O)/C=C\c1ccc([N+](=O)[O-])cc1 ZINC000255491122 935321585 /nfs/dbraw/zinc/32/15/85/935321585.db2.gz OONBXSOZOVNCKG-FLIBITNWSA-N 0 0 357.435 3.602 20 5 FHBDRN COCc1ccc(C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)cc1 ZINC000551667344 935325829 /nfs/dbraw/zinc/32/58/29/935325829.db2.gz DYBZCFJSOBOJLG-UHFFFAOYSA-N 0 0 365.183 3.756 20 5 FHBDRN CN(C(=O)Cc1cc(Br)ccc1F)c1ccc([N+](=O)[O-])cc1 ZINC000119906708 935328376 /nfs/dbraw/zinc/32/83/76/935328376.db2.gz XPOOPEHSKDDQRN-UHFFFAOYSA-N 0 0 367.174 3.702 20 5 FHBDRN CC(C)(C(=O)N[C@H]1CCO[C@@H]1c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000551684374 935329154 /nfs/dbraw/zinc/32/91/54/935329154.db2.gz CLACEAHFCWDHDK-FUHWJXTLSA-N 0 0 354.406 3.519 20 5 FHBDRN Cc1occc1CN(C)C(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000119916868 935332400 /nfs/dbraw/zinc/33/24/00/935332400.db2.gz PDEZUXKGHVTRAG-UHFFFAOYSA-N 0 0 367.199 3.839 20 5 FHBDRN CC[C@@H](C)C[C@@H](C)NC(=O)C(=O)Nc1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000551768395 935346433 /nfs/dbraw/zinc/34/64/33/935346433.db2.gz UHHBZCPVWVHDFM-CHWSQXEVSA-N 0 0 363.458 3.772 20 5 FHBDRN CCn1cc(CN(C)C(=O)Nc2ccc(C(C)(C)C)c([N+](=O)[O-])c2)cn1 ZINC000551966186 935385676 /nfs/dbraw/zinc/38/56/76/935385676.db2.gz SLMKVIAXHOBMSF-UHFFFAOYSA-N 0 0 359.430 3.773 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])Cc1nccn1Cc1ccccc1 ZINC000511092053 935393728 /nfs/dbraw/zinc/39/37/28/935393728.db2.gz NXSXETCLAPAJMO-UHFFFAOYSA-N 0 0 350.422 3.514 20 5 FHBDRN CCOc1cc(/C=C\C(=O)N[C@@H](CC)c2cccc([N+](=O)[O-])c2)ccc1O ZINC000255498141 935403800 /nfs/dbraw/zinc/40/38/00/935403800.db2.gz JOGWUFINMMSZGT-CCCPALQASA-N 0 0 370.405 3.980 20 5 FHBDRN Cc1cccc(Cl)c1NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000085296324 935416746 /nfs/dbraw/zinc/41/67/46/935416746.db2.gz UGFVVLUHALMAKO-UHFFFAOYSA-N 0 0 356.769 3.995 20 5 FHBDRN O=C(N[C@@H](c1cccc2ccccc21)C(F)(F)F)c1[nH]ncc1[N+](=O)[O-] ZINC000511780922 945100121 /nfs/dbraw/zinc/10/01/21/945100121.db2.gz ZBPJQHKBKMDYDI-AWEZNQCLSA-N 0 0 364.283 3.505 20 5 FHBDRN O=C(NC[C@@H](c1c[nH]c2ccccc21)c1ccccc1)c1cc([N+](=O)[O-])c[nH]1 ZINC000051528933 935431216 /nfs/dbraw/zinc/43/12/16/935431216.db2.gz FEIDITMMDVCCIB-QGZVFWFLSA-N 0 0 374.400 3.966 20 5 FHBDRN O=C(NCCOc1cccc(Cl)c1Cl)c1ccc([N+](=O)[O-])cc1 ZINC000516653906 945100981 /nfs/dbraw/zinc/10/09/81/945100981.db2.gz BDPZVTHBBAMXER-UHFFFAOYSA-N 0 0 355.177 3.710 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])Cc1csc(-c2ccccn2)n1 ZINC000511094442 935449994 /nfs/dbraw/zinc/44/99/94/935449994.db2.gz HAQLFDSGPGNXQC-UHFFFAOYSA-N 0 0 354.435 3.788 20 5 FHBDRN O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1CCC(OC2CCCC2)CC1 ZINC000119709082 935451816 /nfs/dbraw/zinc/45/18/16/935451816.db2.gz WOPANIGMCQEYIK-UHFFFAOYSA-N 0 0 352.818 3.812 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@H](OC(F)F)C1 ZINC000611585406 935482464 /nfs/dbraw/zinc/48/24/64/935482464.db2.gz DQWOGGPYQOQWNK-LBPRGKRZSA-N 0 0 374.409 3.939 20 5 FHBDRN CC(C)(C(=O)N1CC[C@H](CC(F)(F)F)C1)c1ccc([N+](=O)[O-])cc1F ZINC000277536841 935493602 /nfs/dbraw/zinc/49/36/02/935493602.db2.gz WMUOCXWGDIPYQB-SNVBAGLBSA-N 0 0 362.323 3.812 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)NCc1cc2ccccc2[nH]1 ZINC000439931051 945104556 /nfs/dbraw/zinc/10/45/56/945104556.db2.gz NDCSPSVJDNEOFB-UHFFFAOYSA-N 0 0 354.366 3.797 20 5 FHBDRN O=C(c1c[nH]c2ccc([N+](=O)[O-])cc12)N(CC1CCC1)CC(F)(F)F ZINC000085430262 935503311 /nfs/dbraw/zinc/50/33/11/935503311.db2.gz VJZUTJJDBMJXMG-UHFFFAOYSA-N 0 0 355.316 3.881 20 5 FHBDRN CCOc1ccc(OCC)c(NC(=O)c2ccc([N+](=O)[O-])cc2OC)c1 ZINC000427119456 945105002 /nfs/dbraw/zinc/10/50/02/945105002.db2.gz JGOWUVAPBKIBGI-UHFFFAOYSA-N 0 0 360.366 3.653 20 5 FHBDRN CCN1CCc2ccc(NC(=O)c3cc4cccc([N+](=O)[O-])c4[nH]3)cc21 ZINC000110812878 945107287 /nfs/dbraw/zinc/10/72/87/945107287.db2.gz CYPPIWORMOBUAL-UHFFFAOYSA-N 0 0 350.378 3.711 20 5 FHBDRN CO[C@@H]1CCOc2c(NC(=O)[C@@H](C)c3cccc([N+](=O)[O-])c3)cccc21 ZINC000548728769 935540930 /nfs/dbraw/zinc/54/09/30/935540930.db2.gz VCHUHTWIBADKHB-YVEFUNNKSA-N 0 0 356.378 3.807 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1OC(=O)CCC(C)(C)NC(=O)OC(C)(C)C ZINC000760021541 945107930 /nfs/dbraw/zinc/10/79/30/945107930.db2.gz BYBFHZSAMSVEJZ-UHFFFAOYSA-N 0 0 366.414 3.892 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc2nc(C(F)(F)F)cn2c1 ZINC000472220060 935550580 /nfs/dbraw/zinc/55/05/80/935550580.db2.gz CVVAOSYGYVMUMM-UHFFFAOYSA-N 0 0 364.283 3.822 20 5 FHBDRN CN(C(=O)CCCc1nnc(-c2ccccc2)o1)c1cccc([N+](=O)[O-])c1 ZINC000158102568 935566238 /nfs/dbraw/zinc/56/62/38/935566238.db2.gz GMIQYGGEMOBQML-UHFFFAOYSA-N 0 0 366.377 3.631 20 5 FHBDRN CN(Cc1cc(Br)cs1)C(=O)c1ccc([N+](=O)[O-])cc1 ZINC000044631564 935569371 /nfs/dbraw/zinc/56/93/71/935569371.db2.gz LSKNTCSCZPLSIT-UHFFFAOYSA-N 0 0 355.213 3.691 20 5 FHBDRN CCN(Cc1ccc(Cl)s1)C(=O)c1ccc([N+](=O)[O-])cc1OC ZINC000427122802 945109885 /nfs/dbraw/zinc/10/98/85/945109885.db2.gz DUEWADRUIFVEAX-UHFFFAOYSA-N 0 0 354.815 3.981 20 5 FHBDRN CCOc1cc(C(=O)N(C)[C@@H]2CCC(C)(C)C2)c([N+](=O)[O-])cc1OC ZINC000478180625 935583305 /nfs/dbraw/zinc/58/33/05/935583305.db2.gz MKSZYBBFKULYBZ-GFCCVEGCSA-N 0 0 350.415 3.653 20 5 FHBDRN Nc1c(C(=O)Nc2ccc3[nH]c(C4CCC4)nc3c2)cccc1[N+](=O)[O-] ZINC000176314476 935584321 /nfs/dbraw/zinc/58/43/21/935584321.db2.gz JDGVUVINVPMWAW-UHFFFAOYSA-N 0 0 351.366 3.573 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)N(C)[C@H]2CCC(C)(C)C2)cc1SC ZINC000478231421 935589348 /nfs/dbraw/zinc/58/93/48/935589348.db2.gz MYLGENUVVPMHJS-NSHDSACASA-N 0 0 352.456 3.976 20 5 FHBDRN CC(C)(C)OC(=O)[C@H](NC(=O)c1cc(F)cc([N+](=O)[O-])c1)c1ccccc1 ZINC000478198884 935591057 /nfs/dbraw/zinc/59/10/57/935591057.db2.gz OBJGIYFSQAFBPD-MRXNPFEDSA-N 0 0 374.368 3.547 20 5 FHBDRN CC(C)[C@@H]1CN(C(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])CCS1 ZINC000437204314 945114644 /nfs/dbraw/zinc/11/46/44/945114644.db2.gz XSIMNMOGIAQZLX-HNNXBMFYSA-N 0 0 372.874 3.617 20 5 FHBDRN CCSCc1ccnc(NC(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)c1 ZINC000563323176 935607987 /nfs/dbraw/zinc/60/79/87/935607987.db2.gz MHAICVPBSIOAML-UHFFFAOYSA-N 0 0 356.407 3.977 20 5 FHBDRN CCN(CC1CCC1)C(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000478317983 935608803 /nfs/dbraw/zinc/60/88/03/935608803.db2.gz VWWANCMKKMMGRE-UHFFFAOYSA-N 0 0 355.232 3.548 20 5 FHBDRN Cc1nc(C(C)(C)NC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)sc1C ZINC000158177439 935609585 /nfs/dbraw/zinc/60/95/85/935609585.db2.gz RJOBLPMWZDJLSH-UHFFFAOYSA-N 0 0 353.831 3.987 20 5 FHBDRN Cc1ccc(-c2ccnn2C)cc1NC(=O)NCc1ccccc1[N+](=O)[O-] ZINC000439962913 945112041 /nfs/dbraw/zinc/11/20/41/945112041.db2.gz RTHHMGXHWNYTOY-UHFFFAOYSA-N 0 0 365.393 3.625 20 5 FHBDRN COc1cc(C(=O)NCC2(Cc3ccccc3)CC2)cc([N+](=O)[O-])c1C ZINC000478348670 935616532 /nfs/dbraw/zinc/61/65/32/935616532.db2.gz UNTRTPFHUAHIJM-UHFFFAOYSA-N 0 0 354.406 3.665 20 5 FHBDRN Cn1cc(-c2cc(CNc3ccc(C(C)(C)C)c([N+](=O)[O-])c3)on2)cn1 ZINC000559946150 935616639 /nfs/dbraw/zinc/61/66/39/935616639.db2.gz BXIMVQJHTSCVPO-UHFFFAOYSA-N 0 0 355.398 3.893 20 5 FHBDRN COc1cccc(-c2nc(C(=O)Nc3cccc([N+](=O)[O-])c3C)c(C)[nH]2)c1 ZINC000158182273 935617138 /nfs/dbraw/zinc/61/71/38/935617138.db2.gz NUCIYSQZZJRRQL-UHFFFAOYSA-N 0 0 366.377 3.863 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1cccc([N+](=O)[O-])c1)N(Cc1ccco1)c1ccccn1 ZINC001125595894 935622855 /nfs/dbraw/zinc/62/28/55/935622855.db2.gz RCWCPKBEGJPFAZ-ZWKOTPCHSA-N 0 0 363.373 3.920 20 5 FHBDRN Cc1c(NC(=O)[C@H](C)N2CCC=C(c3ccco3)C2)cccc1[N+](=O)[O-] ZINC000511112217 935631293 /nfs/dbraw/zinc/63/12/93/935631293.db2.gz YGFYILRKSNFJSY-AWEZNQCLSA-N 0 0 355.394 3.613 20 5 FHBDRN COc1ccc([C@@H](C)NC(=O)NCc2cccc([N+](=O)[O-])c2C)cc1F ZINC000478431590 935632001 /nfs/dbraw/zinc/63/20/01/935632001.db2.gz GZMUFCDSTJSBMT-GFCCVEGCSA-N 0 0 361.373 3.611 20 5 FHBDRN CO[C@H](c1ccc(Cl)cc1)[C@@H](C)NC(=O)c1ccc([N+](=O)[O-])s1 ZINC000127577749 935636144 /nfs/dbraw/zinc/63/61/44/935636144.db2.gz VGZIRECRICMTTE-OTYXRUKQSA-N 0 0 354.815 3.816 20 5 FHBDRN CCS[C@@H]1CCCC[C@@H]1NC(=O)c1cc(OC)c(C)c([N+](=O)[O-])c1 ZINC000478490705 935636208 /nfs/dbraw/zinc/63/62/08/935636208.db2.gz QHRDYOIAUGGTSH-XJKSGUPXSA-N 0 0 352.456 3.706 20 5 FHBDRN COc1cc(NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)c(C)cc1C ZINC000478561862 935646067 /nfs/dbraw/zinc/64/60/67/935646067.db2.gz QPKZUUHCPVWUPH-UHFFFAOYSA-N 0 0 366.377 3.658 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NC[C@H]1CCOc2ccccc21 ZINC000127612500 935654315 /nfs/dbraw/zinc/65/43/15/935654315.db2.gz KYAOGEKVTUHFGA-CQSZACIVSA-N 0 0 355.394 3.899 20 5 FHBDRN Cc1c(CC(=O)NC[C@@H](Nc2ccccc2)C(C)C)cccc1[N+](=O)[O-] ZINC000158264517 935665497 /nfs/dbraw/zinc/66/54/97/935665497.db2.gz SHAOWLPSWSBNHX-GOSISDBHSA-N 0 0 355.438 3.699 20 5 FHBDRN CC(C)c1ncc(NC(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])cn1 ZINC000478641815 935668826 /nfs/dbraw/zinc/66/88/26/935668826.db2.gz UQYMOVZKOVFTOF-JTQLQIEISA-N 0 0 364.789 3.568 20 5 FHBDRN CCc1cc(Br)ccc1NC(=O)c1cc([N+](=O)[O-])cnc1C ZINC000478639728 935669408 /nfs/dbraw/zinc/66/94/08/935669408.db2.gz NZMBZYZHRXGYIE-UHFFFAOYSA-N 0 0 364.199 3.875 20 5 FHBDRN COc1cc(C(=O)Nc2ccc3c(c2)OC(C)(C)O3)cc([N+](=O)[O-])c1C ZINC000478670738 935672050 /nfs/dbraw/zinc/67/20/50/935672050.db2.gz UHTRPSGJBGPAEU-UHFFFAOYSA-N 0 0 358.350 3.671 20 5 FHBDRN CC(C)c1ncc(NC(=O)c2c([N+](=O)[O-])cccc2C(F)(F)F)cn1 ZINC000478669967 935672084 /nfs/dbraw/zinc/67/20/84/935672084.db2.gz ZJMVWMFIJJNSOH-UHFFFAOYSA-N 0 0 354.288 3.779 20 5 FHBDRN CN(C(=O)c1c(F)cccc1Br)c1cccc([N+](=O)[O-])c1 ZINC000158274635 935675785 /nfs/dbraw/zinc/67/57/85/935675785.db2.gz RVKZCKKEAUEVJA-UHFFFAOYSA-N 0 0 353.147 3.773 20 5 FHBDRN CCN(C[C@@H]1CCN(c2ccc([N+](=O)[O-])c(C(C)=O)c2)C1)CC(F)(F)F ZINC000288214743 935678021 /nfs/dbraw/zinc/67/80/21/935678021.db2.gz DJAJSTNNDAPDFA-ZDUSSCGKSA-N 0 0 373.375 3.508 20 5 FHBDRN CN(Cc1ccccc1Br)C(=O)c1ccc([N+](=O)[O-])s1 ZINC000023572467 935689311 /nfs/dbraw/zinc/68/93/11/935689311.db2.gz SSEPMGKTVUHJDP-UHFFFAOYSA-N 0 0 355.213 3.691 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])Cc1nc(-c2cccc(Cl)c2)no1 ZINC000511123355 935696923 /nfs/dbraw/zinc/69/69/23/935696923.db2.gz IPKWOOCREWHDJM-UHFFFAOYSA-N 0 0 372.812 3.973 20 5 FHBDRN CCOc1ccc([C@@H]2C[C@H]2NC(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)cc1 ZINC000437206426 945117642 /nfs/dbraw/zinc/11/76/42/945117642.db2.gz LAXVTAHASPUYEW-OYYNGEPBSA-N 0 0 372.396 3.908 20 5 FHBDRN CN(C(=O)Cc1coc(-c2ccc(F)cc2)n1)c1cccc([N+](=O)[O-])c1 ZINC000158312478 935713746 /nfs/dbraw/zinc/71/37/46/935713746.db2.gz BWOUNTYHLHBZEW-UHFFFAOYSA-N 0 0 355.325 3.594 20 5 FHBDRN Cn1nccc1-c1cc(F)ccc1OCCOc1ccccc1[N+](=O)[O-] ZINC000478821786 935734737 /nfs/dbraw/zinc/73/47/37/935734737.db2.gz KKNMFMZTUXVIBY-UHFFFAOYSA-N 0 0 357.341 3.592 20 5 FHBDRN O=C(N[C@@H](CCc1ccccc1)C(F)(F)F)c1ccc([N+](=O)[O-])cc1 ZINC000478832759 935736028 /nfs/dbraw/zinc/73/60/28/935736028.db2.gz MVNHUDRGHDPKOU-HNNXBMFYSA-N 0 0 352.312 3.888 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCOC2(CCCC2)C1 ZINC000161286123 935740762 /nfs/dbraw/zinc/74/07/62/935740762.db2.gz GGIYQXLKEXXMCU-CYBMUJFWSA-N 0 0 364.467 3.928 20 5 FHBDRN Cc1ccccc1C1(CNC(=O)NCc2cccc([N+](=O)[O-])c2C)CC1 ZINC000478879235 935748116 /nfs/dbraw/zinc/74/81/16/935748116.db2.gz AVNGIEQFFKQOFV-UHFFFAOYSA-N 0 0 353.422 3.743 20 5 FHBDRN Cc1cc(OCC(=O)NC23CC4CC(CC(C4)C2)C3)c(F)cc1[N+](=O)[O-] ZINC000478889840 935752532 /nfs/dbraw/zinc/75/25/32/935752532.db2.gz QNWDPZBZFOQJQM-UHFFFAOYSA-N 0 0 362.401 3.506 20 5 FHBDRN Cc1cc(OCC(=O)N2CCC[C@@H]3CCCC[C@@H]32)c(F)cc1[N+](=O)[O-] ZINC000478909125 935753866 /nfs/dbraw/zinc/75/38/66/935753866.db2.gz LJMOJXORBBMBCH-ZFWWWQNUSA-N 0 0 350.390 3.602 20 5 FHBDRN C[C@H]1CN(c2cccc(Cl)c2)CCN1C(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000562054353 935755555 /nfs/dbraw/zinc/75/55/55/935755555.db2.gz WTQNKJOYYNGGRJ-AWEZNQCLSA-N 0 0 373.840 3.528 20 5 FHBDRN COCCN(C)c1ccc(/C=C\c2ccc3cccc([N+](=O)[O-])c3n2)cn1 ZINC000478919034 935756467 /nfs/dbraw/zinc/75/64/67/935756467.db2.gz HWNZDKPQZYLYEA-TWGQIWQCSA-N 0 0 364.405 3.791 20 5 FHBDRN C[C@@H](NC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1)c1ccccc1Cl ZINC000479011708 935768455 /nfs/dbraw/zinc/76/84/55/935768455.db2.gz APJVFOCHRRTYFI-GFCCVEGCSA-N 0 0 370.796 3.925 20 5 FHBDRN CCCc1ccc([C@@H](NC(=O)c2[nH]ncc2[N+](=O)[O-])c2cccs2)cc1 ZINC000479081632 935784020 /nfs/dbraw/zinc/78/40/20/935784020.db2.gz ZEPJXHNRCLVJLD-MRXNPFEDSA-N 0 0 370.434 3.851 20 5 FHBDRN C[C@@H](Nc1cc(C(F)(F)C(F)(F)F)ncc1[N+](=O)[O-])c1cnccn1 ZINC000601185279 935784626 /nfs/dbraw/zinc/78/46/26/935784626.db2.gz UHCMZXVOLXAGIV-SSDOTTSWSA-N 0 0 363.246 3.607 20 5 FHBDRN COCCCn1c(C)cc(C(=O)COc2cccc([N+](=O)[O-])c2C)c1C ZINC000047355587 945123556 /nfs/dbraw/zinc/12/35/56/945123556.db2.gz CLHACRJLSZUOIE-UHFFFAOYSA-N 0 0 360.410 3.620 20 5 FHBDRN COC[C@H]1CCCN(C(=O)c2cccc3c(=O)c4ccccc4[nH]c23)C1 ZINC000277663138 935791177 /nfs/dbraw/zinc/79/11/77/935791177.db2.gz GQZJEMNCNBCIAV-AWEZNQCLSA-N 0 0 350.418 3.592 20 5 FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H]2CCC[C@H]21 ZINC000159113283 935795105 /nfs/dbraw/zinc/79/51/05/935795105.db2.gz LAEUAFUSDBUNSF-XJKSGUPXSA-N 0 0 364.467 3.738 20 5 FHBDRN CCc1c(C(=O)Nc2cccc([N+](=O)[O-])c2)cnn1-c1ccccc1C ZINC000472230426 935807212 /nfs/dbraw/zinc/80/72/12/935807212.db2.gz MVXWICDMLLQZOE-UHFFFAOYSA-N 0 0 350.378 3.904 20 5 FHBDRN Cc1nc(C)c([C@@H](C)N(C)C(=O)c2cc([N+](=O)[O-])cc(C)c2F)s1 ZINC000277671963 935807343 /nfs/dbraw/zinc/80/73/43/935807343.db2.gz MKIZCILIRHKPCB-SNVBAGLBSA-N 0 0 351.403 3.949 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@@](C)(c2ccc(F)cc2)C1 ZINC000431440198 935809047 /nfs/dbraw/zinc/80/90/47/935809047.db2.gz YXGZAXAERBMWGO-LJQANCHMSA-N 0 0 373.384 3.938 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(N2C[C@H](C(F)(F)F)[C@@H](C(F)(F)F)C2)n1 ZINC000611616985 935814540 /nfs/dbraw/zinc/81/45/40/935814540.db2.gz SJGYMFHCEFGZDN-IUCAKERBSA-N 0 0 357.254 3.784 20 5 FHBDRN O=[N+]([O-])c1ncccc1N1CCO[C@H](c2ccccc2C(F)(F)F)C1 ZINC000611617766 935817991 /nfs/dbraw/zinc/81/79/91/935817991.db2.gz RJVUXXMPBMCPLA-AWEZNQCLSA-N 0 0 353.300 3.587 20 5 FHBDRN Cc1c(CNC(=O)NC[C@H](C)Sc2ccccc2)cccc1[N+](=O)[O-] ZINC000479310676 935824057 /nfs/dbraw/zinc/82/40/57/935824057.db2.gz DAKHXIFRFIYFBZ-ZDUSSCGKSA-N 0 0 359.451 3.883 20 5 FHBDRN CC(=O)c1csc(NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)n1 ZINC000050294331 935827373 /nfs/dbraw/zinc/82/73/73/935827373.db2.gz WBHBVWQCWPNMOX-UHFFFAOYSA-N 0 0 374.403 3.630 20 5 FHBDRN COc1ccccc1NC1CCN(C(=O)c2cccc([N+](=O)[O-])c2C)CC1 ZINC000085499645 935828249 /nfs/dbraw/zinc/82/82/49/935828249.db2.gz PMSGMVIRAVIUIP-UHFFFAOYSA-N 0 0 369.421 3.629 20 5 FHBDRN CCCN(C(=O)c1cccc([N+](=O)[O-])c1N)[C@@H]1CCCc2cccnc21 ZINC000479358396 935830530 /nfs/dbraw/zinc/83/05/30/935830530.db2.gz MKUFRARVCBZQRU-MRXNPFEDSA-N 0 0 354.410 3.502 20 5 FHBDRN CCn1nc(C)c([N+](=O)[O-])c1NCCc1ccc(F)c(Br)c1 ZINC000479371291 935831252 /nfs/dbraw/zinc/83/12/52/935831252.db2.gz MEZYDFYGQVLBAL-UHFFFAOYSA-N 0 0 371.210 3.676 20 5 FHBDRN COc1cc(CNc2cnn(-c3ccc(Cl)cc3)c2)c([N+](=O)[O-])cc1O ZINC000479387797 935834840 /nfs/dbraw/zinc/83/48/40/935834840.db2.gz FUKJCIBNQOYAKZ-UHFFFAOYSA-N 0 0 374.784 3.760 20 5 FHBDRN CCOc1cc(C(=O)N(C)[C@H](CC)c2ccncc2)c([N+](=O)[O-])cc1OC ZINC000127899615 935837680 /nfs/dbraw/zinc/83/76/80/935837680.db2.gz PGULNKANEXOQNR-OAHLLOKOSA-N 0 0 373.409 3.620 20 5 FHBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1COc1cccc(-c2ncnn2C)c1 ZINC000479416077 935837988 /nfs/dbraw/zinc/83/79/88/935837988.db2.gz HJFMALMWAVGHLS-UHFFFAOYSA-N 0 0 368.393 3.757 20 5 FHBDRN Cc1cccc(C2(C(=O)NCCc3ccc(Cl)cc3[N+](=O)[O-])CC2)c1 ZINC000479426853 935838504 /nfs/dbraw/zinc/83/85/04/935838504.db2.gz POAJFDBBKYLIHR-UHFFFAOYSA-N 0 0 358.825 3.947 20 5 FHBDRN CC[C@@H]1[C@@H](C)CCN1C(=O)c1ccc(Cn2nc(C)c([N+](=O)[O-])c2C)cc1 ZINC000479431511 935838604 /nfs/dbraw/zinc/83/86/04/935838604.db2.gz ZQRUZMLZSZBGIF-SCLBCKFNSA-N 0 0 370.453 3.717 20 5 FHBDRN CNC(=O)c1ccc(N[C@@H](Cc2ccccc2OC)C(C)C)c([N+](=O)[O-])c1 ZINC000479462140 935839592 /nfs/dbraw/zinc/83/95/92/935839592.db2.gz FIYYLEUYBOYFQI-KRWDZBQOSA-N 0 0 371.437 3.642 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1Sc1ccccc1)N1CCC(CO)CC1 ZINC000178612521 935845256 /nfs/dbraw/zinc/84/52/56/935845256.db2.gz MVOPGONQYLCYMF-UHFFFAOYSA-N 0 0 372.446 3.591 20 5 FHBDRN CCC[C@H](NC(=O)c1cc([O-])cc([N+](=O)[O-])c1)c1ccc(F)cc1F ZINC000507301137 945128991 /nfs/dbraw/zinc/12/89/91/945128991.db2.gz GHJCOVLYQDTTHP-INIZCTEOSA-N 0 0 350.321 3.850 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)NC[C@H](c1ccccc1)C1CC1 ZINC000431460483 935857569 /nfs/dbraw/zinc/85/75/69/935857569.db2.gz RCUOUFSPZBWRAJ-GOSISDBHSA-N 0 0 369.421 3.596 20 5 FHBDRN Cc1ccc(-c2nc(CC(=O)N(C)c3cccc([N+](=O)[O-])c3)cs2)o1 ZINC000158609465 935862263 /nfs/dbraw/zinc/86/22/63/935862263.db2.gz UVTVPXMYYOVIEZ-UHFFFAOYSA-N 0 0 357.391 3.825 20 5 FHBDRN CO[C@H](CNC(=O)CCc1cccc([N+](=O)[O-])c1)c1ccccc1Cl ZINC000121828101 935864079 /nfs/dbraw/zinc/86/40/79/935864079.db2.gz YHXAVBIPFFFCDH-QGZVFWFLSA-N 0 0 362.813 3.685 20 5 FHBDRN Cc1cc([C@@H](C)NC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)c(C)s1 ZINC000479669419 935875913 /nfs/dbraw/zinc/87/59/13/935875913.db2.gz YPOSXVQKZAQMNS-GFCCVEGCSA-N 0 0 370.434 3.950 20 5 FHBDRN COc1ccc(CCCC(=O)N(C)c2cccc([N+](=O)[O-])c2)c(OC)c1 ZINC000158632708 935876750 /nfs/dbraw/zinc/87/67/50/935876750.db2.gz APJFCEGIYLSQDY-UHFFFAOYSA-N 0 0 358.394 3.598 20 5 FHBDRN O=C(c1csc(-c2cccc([N+](=O)[O-])c2)n1)N1CCc2ccccc2C1 ZINC000050535362 935882853 /nfs/dbraw/zinc/88/28/53/935882853.db2.gz OBRQLPUAAXPAFM-UHFFFAOYSA-N 0 0 365.414 3.917 20 5 FHBDRN Cc1cccc(C2(c3noc(COc4cccc([N+](=O)[O-])c4)n3)CC2)c1 ZINC000562119700 935887319 /nfs/dbraw/zinc/88/73/19/935887319.db2.gz MBYYAUWQBDVRPX-UHFFFAOYSA-N 0 0 351.362 3.945 20 5 FHBDRN CCOc1cc(F)ccc1NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000046516900 935889434 /nfs/dbraw/zinc/88/94/34/935889434.db2.gz LKFWHLQYVFHJTA-UHFFFAOYSA-N 0 0 370.340 3.571 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC[C@H](C(F)(F)F)[C@@H]1C ZINC000479772608 935890997 /nfs/dbraw/zinc/89/09/97/935890997.db2.gz CFBIKCNAPWKSBA-ONGXEEELSA-N 0 0 361.320 3.798 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)Nc1nc(-c2cccs2)cs1 ZINC000024022394 935891566 /nfs/dbraw/zinc/89/15/66/935891566.db2.gz UQRGGTWMLIXVJR-UHFFFAOYSA-N 0 0 361.404 3.797 20 5 FHBDRN Cc1csc(N(CC(F)(F)F)C(=O)c2cccc([N+](=O)[O-])c2C)n1 ZINC000115800136 935903432 /nfs/dbraw/zinc/90/34/32/935903432.db2.gz OQWPLHTWZZJVCN-UHFFFAOYSA-N 0 0 359.329 3.877 20 5 FHBDRN CCn1nc(C)c([N+](=O)[O-])c1Nc1ccc2c(c1)nc1n2CCCCC1 ZINC000479870835 935909948 /nfs/dbraw/zinc/90/99/48/935909948.db2.gz BTXULQHCYJRVIN-UHFFFAOYSA-N 0 0 354.414 3.939 20 5 FHBDRN CCC(CC)[C@H](O)CNC(=O)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000277769338 935911391 /nfs/dbraw/zinc/91/13/91/935911391.db2.gz SCRPROYHKAIRJQ-GOSISDBHSA-N 0 0 352.434 3.621 20 5 FHBDRN CCS[C@H]1CCC[C@@H](NC(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)C1 ZINC000479898932 935913386 /nfs/dbraw/zinc/91/33/86/935913386.db2.gz HDTIRKDLXINMHP-KGLIPLIRSA-N 0 0 352.456 3.706 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000176718878 935913863 /nfs/dbraw/zinc/91/38/63/935913863.db2.gz FVHJWXYIHSEMDO-LLVKDONJSA-N 0 0 374.353 3.703 20 5 FHBDRN CC(=O)N1C=Cc2ccccc2[C@H]1CC(=O)OCc1ccccc1[N+](=O)[O-] ZINC000024199403 935918297 /nfs/dbraw/zinc/91/82/97/935918297.db2.gz VJQJYOIZBXVHOL-LJQANCHMSA-N 0 0 366.373 3.602 20 5 FHBDRN CC[C@H](NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)c1ccc(OC)cc1 ZINC000128060517 935919817 /nfs/dbraw/zinc/91/98/17/935919817.db2.gz CMCYTWHYKLNFTF-SFHVURJKSA-N 0 0 367.405 3.895 20 5 FHBDRN CN(C[C@H]1CCC[C@@H]1O)C(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000128073444 935936071 /nfs/dbraw/zinc/93/60/71/935936071.db2.gz NKPOCPOIFLGIQJ-BEFAXECRSA-N 0 0 369.421 3.571 20 5 FHBDRN C[C@H](OCCCNc1ncnc2ccc([N+](=O)[O-])cc21)c1ccccc1 ZINC000611700761 935939843 /nfs/dbraw/zinc/93/98/43/935939843.db2.gz VMOXRXAHGAVPQT-AWEZNQCLSA-N 0 0 352.394 3.540 20 5 FHBDRN O=[N+]([O-])c1ccc2ncnc(NC[C@@H]3CCC[C@@H](C(F)(F)F)C3)c2c1 ZINC000611705699 935944678 /nfs/dbraw/zinc/94/46/78/935944678.db2.gz BBDMDIIMIGXCPR-GHMZBOCLSA-N 0 0 354.332 3.741 20 5 FHBDRN C[C@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1cccc(-n2cccn2)c1 ZINC000075062995 935945062 /nfs/dbraw/zinc/94/50/62/935945062.db2.gz XRDQEVMXXBXCOI-LBPRGKRZSA-N 0 0 353.338 3.862 20 5 FHBDRN C[C@@H](Nc1nc2sccn2c1[N+](=O)[O-])c1cccc(-n2cccn2)c1 ZINC000075062850 935950651 /nfs/dbraw/zinc/95/06/51/935950651.db2.gz PIBUYHJVXZWARA-LLVKDONJSA-N 0 0 354.395 3.663 20 5 FHBDRN Cc1cnc(OCCOc2ccccc2Br)c([N+](=O)[O-])c1 ZINC000507337003 945135691 /nfs/dbraw/zinc/13/56/91/945135691.db2.gz AJQYVKSQVYTMBU-UHFFFAOYSA-N 0 0 353.172 3.519 20 5 FHBDRN Cc1c(CNC(=O)N2CCC(OCCC(C)C)CC2)cccc1[N+](=O)[O-] ZINC000480062614 935951879 /nfs/dbraw/zinc/95/18/79/935951879.db2.gz VAVKGIHCEBIIPT-UHFFFAOYSA-N 0 0 363.458 3.640 20 5 FHBDRN Cc1ccc(C)n1C1CCN(CC(=O)Nc2c(C)cccc2[N+](=O)[O-])CC1 ZINC000507337303 945135776 /nfs/dbraw/zinc/13/57/76/945135776.db2.gz FVWOKMWDOKYETN-UHFFFAOYSA-N 0 0 370.453 3.597 20 5 FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@H](C)CCC[C@@H]1C ZINC000158742124 935955341 /nfs/dbraw/zinc/95/53/41/935955341.db2.gz UPNQPTKEDIKQLC-KGLIPLIRSA-N 0 0 366.483 3.984 20 5 FHBDRN Cc1c(CNC(=O)NC(C)(C)c2ccc(F)c(F)c2)cccc1[N+](=O)[O-] ZINC000480071652 935956878 /nfs/dbraw/zinc/95/68/78/935956878.db2.gz KICPJQNEJDAJJB-UHFFFAOYSA-N 0 0 363.364 3.916 20 5 FHBDRN Cc1c(CNC(=O)N2C[C@@H](C)O[C@H](c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000480071228 935957575 /nfs/dbraw/zinc/95/75/75/935957575.db2.gz QHWQJNBSGKIYGR-KUHUBIRLSA-N 0 0 369.421 3.575 20 5 FHBDRN Cc1c(CNC(=O)N2C[C@H](C)O[C@@H](c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000480071227 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CC(=O)c1cc(NCc2cn(C)nc2-c2ccccc2)ccc1[N+](=O)[O-] ZINC000583770039 938400031 /nfs/dbraw/zinc/40/00/31/938400031.db2.gz IBXGOBBQKQUQGT-UHFFFAOYSA-N 0 0 350.378 3.810 20 5 FHBDRN O=C(N[C@@H]1CCC[C@H]2OCC[C@@H]21)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000278437062 938428214 /nfs/dbraw/zinc/42/82/14/938428214.db2.gz DUVMFAUHWOPOTJ-OMWUSAIZSA-N 0 0 362.429 3.781 20 5 FHBDRN C[C@@H]1CN(c2c(Cl)cc(Cl)cc2[N+](=O)[O-])C[C@]2(CCCOC2)O1 ZINC000408108912 945173951 /nfs/dbraw/zinc/17/39/51/945173951.db2.gz VBKWIUWBXFBQMT-BMIGLBTASA-N 0 0 361.225 3.676 20 5 FHBDRN O=[N+]([O-])c1cc(F)c(Nc2cnn(-c3cnc4ccccc4n3)c2)c(F)c1 ZINC000536139927 938433949 /nfs/dbraw/zinc/43/39/49/938433949.db2.gz GLBGCZLUHPROCJ-UHFFFAOYSA-N 0 0 368.303 3.746 20 5 FHBDRN CCc1nccn1[C@H]1CCCN(c2cc(C(F)(F)F)ncc2[N+](=O)[O-])C1 ZINC000278445059 938434290 /nfs/dbraw/zinc/43/42/90/938434290.db2.gz QYNWCDLISMQREF-NSHDSACASA-N 0 0 369.347 3.609 20 5 FHBDRN C[C@@H](CCc1ccccc1[N+](=O)[O-])Nc1ccc2c(c1)N(C(N)=O)CCC2 ZINC000426554547 945175379 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3.808 20 5 FHBDRN CC(=O)CCc1ccc(O[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000039501925 938573199 /nfs/dbraw/zinc/57/31/99/938573199.db2.gz PZBRPMNFIMZAPY-AWEZNQCLSA-N 0 0 356.378 3.522 20 5 FHBDRN Cc1cccc(OCCNC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000179038128 938577068 /nfs/dbraw/zinc/57/70/68/938577068.db2.gz GRJMNIIKEBHTRM-UHFFFAOYSA-N 0 0 369.421 3.656 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)ccc1OCCCOc1ccc2c(c1)OCO2 ZINC000519170521 945187575 /nfs/dbraw/zinc/18/75/75/945187575.db2.gz KINUBNRIBUGXQH-UHFFFAOYSA-N 0 0 351.742 3.825 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(Cc2noc(-c3sccc3Cl)n2)c1 ZINC000584079568 938586056 /nfs/dbraw/zinc/58/60/56/938586056.db2.gz OCINXRFZRUFOCC-UHFFFAOYSA-N 0 0 351.771 3.959 20 5 FHBDRN O=C(Nc1n[nH]c2c1cccc2Cl)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000158807738 938589417 /nfs/dbraw/zinc/58/94/17/938589417.db2.gz FGHSFNCGRPIUKC-UHFFFAOYSA-N 0 0 367.752 3.925 20 5 FHBDRN CCCN(C(=O)[C@H]1CC(=O)N(C2CCCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000584092192 938594168 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20 5 FHBDRN CCn1nccc1C1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2C)CC1 ZINC000278669299 938634124 /nfs/dbraw/zinc/63/41/24/938634124.db2.gz FTNVYNRVHHVSNT-UHFFFAOYSA-N 0 0 357.414 3.531 20 5 FHBDRN O=[N+]([O-])c1ccc(NCCNc2ncc(C(F)(F)F)cc2Cl)nc1 ZINC000018058086 945192611 /nfs/dbraw/zinc/19/26/11/945192611.db2.gz OOHBADYIHLBTSE-UHFFFAOYSA-N 0 0 361.711 3.581 20 5 FHBDRN Cc1c(OCc2csc(-c3ccc(C(N)=O)cc3)n2)cccc1[N+](=O)[O-] ZINC000052892564 938646489 /nfs/dbraw/zinc/64/64/89/938646489.db2.gz OHRIBZZKSPLMDW-UHFFFAOYSA-N 0 0 369.402 3.705 20 5 FHBDRN C[C@@H](CNC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)Oc1ccccc1 ZINC000437269719 945193238 /nfs/dbraw/zinc/19/32/38/945193238.db2.gz RFHLOIHPIPHBJY-NSHDSACASA-N 0 0 368.311 3.811 20 5 FHBDRN CCNC(=O)Nc1cccc(NCc2ccc(OC)c([N+](=O)[O-])c2)c1C ZINC000278685450 938651732 /nfs/dbraw/zinc/65/17/32/938651732.db2.gz PLHHAYZNSSVRQF-UHFFFAOYSA-N 0 0 358.398 3.665 20 5 FHBDRN C[C@H]1C[C@H](c2ccccc2)N(C(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)C1 ZINC000573154548 938654340 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O=[N+]([O-])c1ccc2[nH]cc(CCNc3nc(C(F)(F)F)cs3)c2c1 ZINC000584343487 938692821 /nfs/dbraw/zinc/69/28/21/938692821.db2.gz XDGJADUMLTWQGR-UHFFFAOYSA-N 0 0 356.329 3.628 20 5 FHBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@H](CC(F)(F)F)c2ccccc2)cc1 ZINC000056128015 938698816 /nfs/dbraw/zinc/69/88/16/938698816.db2.gz OOLCELUTEFYMIQ-CQSZACIVSA-N 0 0 374.340 3.567 20 5 FHBDRN Cc1cc(C(=O)N(C)c2nnc(-c3ccccc3)s2)ccc1[N+](=O)[O-] ZINC000080799857 938700165 /nfs/dbraw/zinc/70/01/65/938700165.db2.gz AUJWBHOCVYQXQO-UHFFFAOYSA-N 0 0 354.391 3.698 20 5 FHBDRN COc1ccc(NC(=O)N2Cc3ccccc3C(F)(F)C2)cc1[N+](=O)[O-] ZINC000611828807 938702798 /nfs/dbraw/zinc/70/27/98/938702798.db2.gz USWLYDRYICQDFM-UHFFFAOYSA-N 0 0 363.320 3.743 20 5 FHBDRN COc1ccc(NC(=O)N2C[C@H](C(F)(F)F)CC[C@H]2C)cc1[N+](=O)[O-] ZINC000611825132 938703336 /nfs/dbraw/zinc/70/33/36/938703336.db2.gz MFWLFARNEKOPNS-NXEZZACHSA-N 0 0 361.320 3.798 20 5 FHBDRN CCn1c2ccc(Cl)cc2nc1NC(=O)c1cc([O-])cc([N+](=O)[O-])c1 ZINC000507396301 945197592 /nfs/dbraw/zinc/19/75/92/945197592.db2.gz CLVGTZVOFHBICS-UHFFFAOYSA-N 0 0 360.757 3.576 20 5 FHBDRN CC(=O)c1ccc([N+](=O)[O-])cc1N1CCC[C@H](C(=O)Nc2ccccc2)C1 ZINC000584372094 938717066 /nfs/dbraw/zinc/71/70/66/938717066.db2.gz HTIGMBJLMLWLFH-HNNXBMFYSA-N 0 0 367.405 3.653 20 5 FHBDRN COC(=O)/C=C/c1ccc(Oc2cc(F)cc([N+](=O)[O-])c2)c([N+](=O)[O-])c1 ZINC000135531186 938721890 /nfs/dbraw/zinc/72/18/90/938721890.db2.gz BUESNCWNMBAULG-HWKANZROSA-N 0 0 362.269 3.621 20 5 FHBDRN CC(=O)c1ccc(NCCc2cccc(C(F)(F)F)n2)c([N+](=O)[O-])c1 ZINC000432150980 945203534 /nfs/dbraw/zinc/20/35/34/945203534.db2.gz DVUIZMKXHDZBCP-UHFFFAOYSA-N 0 0 353.300 3.866 20 5 FHBDRN C[C@@H](NC(=O)N1CCOc2ccc([N+](=O)[O-])cc2C1)[C@H](C)c1ccccc1 ZINC000584383635 938786903 /nfs/dbraw/zinc/78/69/03/938786903.db2.gz IUDJMIHRGNWOTH-LSDHHAIUSA-N 0 0 369.421 3.691 20 5 FHBDRN COc1ccc(N(C)C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)cc1OC ZINC000584396533 938806986 /nfs/dbraw/zinc/80/69/86/938806986.db2.gz NEQCDIRDQXNISP-UHFFFAOYSA-N 0 0 359.382 3.897 20 5 FHBDRN COc1ccc(NC(=O)[C@H]2C[C@]23CCCc2ccccc23)c([N+](=O)[O-])c1 ZINC000480330105 938856363 /nfs/dbraw/zinc/85/63/63/938856363.db2.gz RFXMEDWXNPOSKW-UZLBHIALSA-N 0 0 352.390 3.836 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@H]2CCCc3sccc32)c1 ZINC000162216672 938859749 /nfs/dbraw/zinc/85/97/49/938859749.db2.gz BOQOPIDJNVXPHQ-AWEZNQCLSA-N 0 0 360.435 3.927 20 5 FHBDRN Cc1cc(OCC(=O)NCc2cccc(Cl)c2)c(Cl)cc1[N+](=O)[O-] ZINC000506433475 945212831 /nfs/dbraw/zinc/21/28/31/945212831.db2.gz NJPVRIHNWFCHGX-UHFFFAOYSA-N 0 0 369.204 3.905 20 5 FHBDRN Cc1noc(C2CCN(c3ccc([N+](=O)[O-])c(OC(C)(C)C)c3)CC2)n1 ZINC000091455369 938901344 /nfs/dbraw/zinc/90/13/44/938901344.db2.gz ZGXZHIFHXOHOLM-UHFFFAOYSA-N 0 0 360.414 3.848 20 5 FHBDRN CCc1nn(C)c(N2CCC(Oc3ccccc3Cl)CC2)c1[N+](=O)[O-] ZINC000091673560 938904488 /nfs/dbraw/zinc/90/44/88/938904488.db2.gz IKDQGMJVDWTGKL-UHFFFAOYSA-N 0 0 364.833 3.592 20 5 FHBDRN COc1cc(F)ccc1NCc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000092118382 938911591 /nfs/dbraw/zinc/91/15/91/938911591.db2.gz DTXCEKCHVUCCIS-UHFFFAOYSA-N 0 0 356.357 3.755 20 5 FHBDRN CC(C)(CNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)c1ccccc1F ZINC000302624755 938921943 /nfs/dbraw/zinc/92/19/43/938921943.db2.gz HUXXUNDECTZTSR-UHFFFAOYSA-N 0 0 366.414 3.527 20 5 FHBDRN CC(C)Oc1cccc(CN(C)C(=O)NCc2ccc([N+](=O)[O-])cc2)c1 ZINC000179112757 938942610 /nfs/dbraw/zinc/94/26/10/938942610.db2.gz VIUPFESYYKBNJK-UHFFFAOYSA-N 0 0 357.410 3.724 20 5 FHBDRN COc1c2ccccc2oc1CNC(=O)c1cc(OC)c(C)c([N+](=O)[O-])c1 ZINC000480512802 938965802 /nfs/dbraw/zinc/96/58/02/938965802.db2.gz PNPJIQXUBZOBQE-UHFFFAOYSA-N 0 0 370.361 3.597 20 5 FHBDRN Cc1cnc(C2CCN(C(=O)Nc3ccc([N+](=O)[O-])cc3F)CC2)s1 ZINC000431564425 938972401 /nfs/dbraw/zinc/97/24/01/938972401.db2.gz LMNNQGRXBRDXMH-UHFFFAOYSA-N 0 0 364.402 3.910 20 5 FHBDRN CC(=O)N(c1nc(Cn2c(C)ncc2[N+](=O)[O-])cs1)c1ccc(C)cc1 ZINC000065693336 938974173 /nfs/dbraw/zinc/97/41/73/938974173.db2.gz QPXLJHCCVWFEQX-UHFFFAOYSA-N 0 0 371.422 3.598 20 5 FHBDRN Cc1ncc([N+](=O)[O-])n1CC(=O)N[C@@H](CC(C)(C)C)c1ccc(F)cc1 ZINC000065693530 938974179 /nfs/dbraw/zinc/97/41/79/938974179.db2.gz CKJDROMZILVJKL-HNNXBMFYSA-N 0 0 362.405 3.533 20 5 FHBDRN CC(=O)OCCCc1cccc(NC(=O)c2cc(C)cc([N+](=O)[O-])c2)c1 ZINC000135581078 938977041 /nfs/dbraw/zinc/97/70/41/938977041.db2.gz IDSYSFHBABCZPV-UHFFFAOYSA-N 0 0 356.378 3.651 20 5 FHBDRN CCOc1cccc(N2CCC[C@@H](c3ncc4n3CCCC4)C2)c1[N+](=O)[O-] ZINC000409640471 938978904 /nfs/dbraw/zinc/97/89/04/938978904.db2.gz UVDVLXGGKBBOCO-OAHLLOKOSA-N 0 0 370.453 3.910 20 5 FHBDRN CCN(Cc1cccc(NC(=O)c2ccc([N+](=O)[O-])cc2C)c1)C(C)=O ZINC000511284524 938984446 /nfs/dbraw/zinc/98/44/46/938984446.db2.gz IYXZRMLUPOHOGJ-UHFFFAOYSA-N 0 0 355.394 3.524 20 5 FHBDRN Cc1c(Br)c(N[C@H]2CCCC23CCOCC3)ncc1[N+](=O)[O-] ZINC000409672894 938991069 /nfs/dbraw/zinc/99/10/69/938991069.db2.gz KVMUVMQWXZWHKB-LBPRGKRZSA-N 0 0 370.247 3.822 20 5 FHBDRN Cc1sc(S(=O)(=O)N2CC[C@H]2c2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000511293726 938991947 /nfs/dbraw/zinc/99/19/47/938991947.db2.gz AOVFLVQBZNLPFS-LBPRGKRZSA-N 0 0 372.855 3.754 20 5 FHBDRN COc1ccc([C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])cc2)cc1OC ZINC000141988779 938995236 /nfs/dbraw/zinc/99/52/36/938995236.db2.gz OYTKKMDECLOOBY-MRXNPFEDSA-N 0 0 356.378 3.589 20 5 FHBDRN C[C@H](c1ccc(F)c(F)c1)N(C)C(=O)CSc1ncccc1[N+](=O)[O-] ZINC000120437138 938996018 /nfs/dbraw/zinc/99/60/18/938996018.db2.gz NARBSAWODIFCAO-SNVBAGLBSA-N 0 0 367.377 3.580 20 5 FHBDRN COCCCC[C@@H](Nc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccccc1 ZINC000480576159 938996073 /nfs/dbraw/zinc/99/60/73/938996073.db2.gz GBZPMTSYLXMEQM-MRXNPFEDSA-N 0 0 354.410 3.863 20 5 FHBDRN Cc1c(Br)c(N[C@H](C)CCC(=O)OC(C)C)ncc1[N+](=O)[O-] ZINC000480581553 938996074 /nfs/dbraw/zinc/99/60/74/938996074.db2.gz NZYPIJMIMFAWHQ-SECBINFHSA-N 0 0 374.235 3.593 20 5 FHBDRN CCOc1cc(CNC(=O)c2ccccc2[N+](=O)[O-])ccc1OC(F)F ZINC000046608885 938996175 /nfs/dbraw/zinc/99/61/75/938996175.db2.gz YXMRGRGCSNXWPZ-UHFFFAOYSA-N 0 0 366.320 3.525 20 5 FHBDRN Cc1ccc2c(c1)[C@H](Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])CCC2 ZINC000179237771 938996414 /nfs/dbraw/zinc/99/64/14/938996414.db2.gz MPGAOSBCVPZNPB-MRXNPFEDSA-N 0 0 360.435 3.796 20 5 FHBDRN COc1cc(C(=O)Nc2ccc(CSC)cc2)c([N+](=O)[O-])cc1F ZINC001125766353 939003282 /nfs/dbraw/zinc/00/32/82/939003282.db2.gz MVNLXVHZJAXRBO-UHFFFAOYSA-N 0 0 350.371 3.858 20 5 FHBDRN COc1ccc(NC(=O)c2cccc(OCC(F)(F)F)c2)cc1[N+](=O)[O-] ZINC000543858340 939009514 /nfs/dbraw/zinc/00/95/14/939009514.db2.gz LZXAMJIBITUMKL-UHFFFAOYSA-N 0 0 370.283 3.797 20 5 FHBDRN Cc1nn(C)c(C(=O)N2CCCCC[C@@H]2/C=C\c2cccs2)c1[N+](=O)[O-] ZINC000611988340 939015981 /nfs/dbraw/zinc/01/59/81/939015981.db2.gz NBKUSGCDOVLQHA-CFYYFVFUSA-N 0 0 374.466 3.796 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)N1CCCc2c(F)cc(F)cc21 ZINC000065732221 939017445 /nfs/dbraw/zinc/01/74/45/939017445.db2.gz RCEIQAZSSNKADL-UHFFFAOYSA-N 0 0 371.343 3.807 20 5 FHBDRN Cc1ccccc1OCCCN(C)C(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000065729820 939017451 /nfs/dbraw/zinc/01/74/51/939017451.db2.gz BSPUGXIZKCFIPO-UHFFFAOYSA-N 0 0 367.405 3.926 20 5 FHBDRN CC(C)c1ccc(C(=O)Nc2nc3ccc(Cl)cn3n2)cc1[N+](=O)[O-] ZINC000188065849 939017566 /nfs/dbraw/zinc/01/75/66/939017566.db2.gz ZLQQOTTWCQCYJK-UHFFFAOYSA-N 0 0 359.773 3.667 20 5 FHBDRN CCC(=O)Nc1ccc(NC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)cc1 ZINC000065733945 939018300 /nfs/dbraw/zinc/01/83/00/939018300.db2.gz WPNHOWCLDBRDQQ-UHFFFAOYSA-N 0 0 366.377 3.537 20 5 FHBDRN Cc1ccc(-c2cc(C(=O)N(C)Cc3ccccc3[N+](=O)[O-])[nH]n2)c(C)c1 ZINC000188182481 939028024 /nfs/dbraw/zinc/02/80/24/939028024.db2.gz OHQRFMPRANNQJD-UHFFFAOYSA-N 0 0 364.405 3.874 20 5 FHBDRN Cc1ccc(Br)cc1CNC(=O)c1cccc(C)c1[N+](=O)[O-] ZINC000188223980 939058654 /nfs/dbraw/zinc/05/86/54/939058654.db2.gz WMCKQPVVDMMBTC-UHFFFAOYSA-N 0 0 363.211 3.904 20 5 FHBDRN Cc1cc(N2CCC([C@H]3CCOC3)CC2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000612099191 939059207 /nfs/dbraw/zinc/05/92/07/939059207.db2.gz AAUOLWRPGGJCSP-KRWDZBQOSA-N 0 0 368.437 3.613 20 5 FHBDRN O=C(NCc1coc(-c2ccccc2)n1)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000179330853 939087814 /nfs/dbraw/zinc/08/78/14/939087814.db2.gz CGDZPUZAQXFBPJ-UHFFFAOYSA-N 0 0 357.753 3.833 20 5 FHBDRN O=C(c1csc([N+](=O)[O-])c1)N1CCC(OCc2ccc(F)cc2)CC1 ZINC000179336181 939089072 /nfs/dbraw/zinc/08/90/72/939089072.db2.gz DNABXHKSAQEKHB-UHFFFAOYSA-N 0 0 364.398 3.617 20 5 FHBDRN O=C(c1ccn(-c2ccccc2[N+](=O)[O-])n1)N1CCC=Cc2ccccc21 ZINC000188244942 939094496 /nfs/dbraw/zinc/09/44/96/939094496.db2.gz YMAHLJZFMPROAF-UHFFFAOYSA-N 0 0 360.373 3.844 20 5 FHBDRN CCc1ccc(CNc2cc(CN3CCOCC3)ccc2[N+](=O)[O-])s1 ZINC000472363773 939098685 /nfs/dbraw/zinc/09/86/85/939098685.db2.gz MGNKDRIXJHXIFG-UHFFFAOYSA-N 0 0 361.467 3.663 20 5 FHBDRN O=C(N[C@@H]1C[C@H]1c1ccc(Br)cc1)c1csc([N+](=O)[O-])c1 ZINC000437307741 945227565 /nfs/dbraw/zinc/22/75/65/945227565.db2.gz QZZFNTKCDYJCEJ-NWDGAFQWSA-N 0 0 367.224 3.705 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1cccc(Cl)c1-n1cccn1 ZINC000427249153 945227571 /nfs/dbraw/zinc/22/75/71/945227571.db2.gz KSJVZWRXIBOSLQ-UHFFFAOYSA-N 0 0 372.768 3.695 20 5 FHBDRN COc1ccc(-c2nc(-c3c(C)nc4sc(C)cn43)no2)cc1[N+](=O)[O-] ZINC000426567411 945228263 /nfs/dbraw/zinc/22/82/63/945228263.db2.gz KDDVKFNQTRXUCA-UHFFFAOYSA-N 0 0 371.378 3.646 20 5 FHBDRN O=[N+]([O-])c1ccc(OC(F)F)c(CN2CCC([C@H]3CCCO3)CC2)c1 ZINC000188280616 939127697 /nfs/dbraw/zinc/12/76/97/939127697.db2.gz DDQCABWEGMMTHO-OAHLLOKOSA-N 0 0 356.369 3.587 20 5 FHBDRN COc1c(O)ccc(CNCc2cccc(C(F)(F)F)c2)c1[N+](=O)[O-] ZINC000892436330 939135634 /nfs/dbraw/zinc/13/56/34/939135634.db2.gz YSZZQOLUWXFHIE-UHFFFAOYSA-N 0 0 356.300 3.618 20 5 FHBDRN O=C(CC/C=C\c1ccccc1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000255711194 939136104 /nfs/dbraw/zinc/13/61/04/939136104.db2.gz XGDUCLACKQOGIZ-YWEYNIOJSA-N 0 0 365.433 3.737 20 5 FHBDRN COc1ccc(C[C@H](C)C(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000179452023 939163952 /nfs/dbraw/zinc/16/39/52/939163952.db2.gz ZKWSTNADDDBXQV-HNNXBMFYSA-N 0 0 368.433 3.973 20 5 FHBDRN CCN(Cc1cccc(Cl)c1)S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-] ZINC000507431630 945232719 /nfs/dbraw/zinc/23/27/19/945232719.db2.gz VUVYQBIKCHWTKS-UHFFFAOYSA-N 0 0 368.842 3.767 20 5 FHBDRN C/C(=C\C(=O)NC[C@H]1CCN(c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000785225935 939181494 /nfs/dbraw/zinc/18/14/94/939181494.db2.gz UQLBFOPUDTYBAX-HJUDDPQBSA-N 0 0 365.433 3.641 20 5 FHBDRN C[C@H](NC(=O)/C=C\c1ccc([N+](=O)[O-])cc1)c1noc(-c2ccccc2)n1 ZINC000255772179 939198598 /nfs/dbraw/zinc/19/85/98/939198598.db2.gz NMDIFFCAZMXSFX-SUIFULHWSA-N 0 0 364.361 3.535 20 5 FHBDRN CO[C@H](C)[C@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000188364502 939215987 /nfs/dbraw/zinc/21/59/87/939215987.db2.gz JHGOTHXUPZOOQU-QWHCGFSZSA-N 0 0 360.435 3.899 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N1CCC=Cc2ccccc21 ZINC000188409561 939228381 /nfs/dbraw/zinc/22/83/81/939228381.db2.gz RQEFKNZXNACIQG-UHFFFAOYSA-N 0 0 364.810 3.860 20 5 FHBDRN C[C@@H](CCC1CC1)NC(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000426238254 945245255 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3.556 20 5 FHBDRN CCN([C@H](C)c1ccc(F)cc1)S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-] ZINC000507479516 945263566 /nfs/dbraw/zinc/26/35/66/945263566.db2.gz SPVFHMVEJQONHN-CYBMUJFWSA-N 0 0 366.414 3.814 20 5 FHBDRN COCc1cc([N+](=O)[O-])ccc1NCCc1cccc(C(F)(F)F)n1 ZINC000432177293 945266430 /nfs/dbraw/zinc/26/64/30/945266430.db2.gz PHCDHIHZSUBSMK-UHFFFAOYSA-N 0 0 355.316 3.810 20 5 FHBDRN O=[N+]([O-])c1ccc(CN(Cc2cc(F)cc3c2OCOC3)C2CC2)cc1 ZINC000179520789 939876764 /nfs/dbraw/zinc/87/67/64/939876764.db2.gz BTPPYEAHUMPJJM-UHFFFAOYSA-N 0 0 358.369 3.765 20 5 FHBDRN COc1cc(-c2noc(C(C)(C)c3ccccc3[N+](=O)[O-])n2)cc(C)n1 ZINC000426585310 945279153 /nfs/dbraw/zinc/27/91/53/945279153.db2.gz WNZGIRCPBNFWOF-UHFFFAOYSA-N 0 0 354.366 3.683 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1CN(C)CC(=O)Nc1ccccc1CC ZINC000506772802 945279190 /nfs/dbraw/zinc/27/91/90/945279190.db2.gz QGIFXZPCCJKWHB-UHFFFAOYSA-N 0 0 371.437 3.626 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N[C@@H]1CCOc2ccc(F)cc21 ZINC000179557997 939888308 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0 361.348 3.808 20 5 FHBDRN CCN(C(=O)CSCc1ccc(OC)c([N+](=O)[O-])c1)[C@@H](C)C(C)C ZINC000516798191 940044374 /nfs/dbraw/zinc/04/43/74/940044374.db2.gz PCMWVULZUGXRSN-ZDUSSCGKSA-N 0 0 354.472 3.730 20 5 FHBDRN CN(C(=O)Cc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CCCc2cccnc21 ZINC000365034423 940045438 /nfs/dbraw/zinc/04/54/38/940045438.db2.gz JWJWJVUBGADOAT-MRXNPFEDSA-N 0 0 359.813 3.722 20 5 FHBDRN Cc1nn(-c2ccccc2)c(C)c1CNC(=O)c1cccc([N+](=O)[O-])c1C ZINC000018202833 940047298 /nfs/dbraw/zinc/04/72/98/940047298.db2.gz NEPQXKSHHSGKGW-UHFFFAOYSA-N 0 0 364.405 3.636 20 5 FHBDRN O=C(NCc1ccc(Br)cc1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000106465485 945292564 /nfs/dbraw/zinc/29/25/64/945292564.db2.gz GZXCHIXCFFJBQE-UHFFFAOYSA-N 0 0 369.602 3.941 20 5 FHBDRN CCc1ccc([C@H](NCc2cc(C)ncn2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000612414506 940053380 /nfs/dbraw/zinc/05/33/80/940053380.db2.gz JGQGLVMVIMAKMX-LJQANCHMSA-N 0 0 352.394 3.728 20 5 FHBDRN Cc1[nH]nc(C(=O)Nc2ccccc2NCCc2ccccc2)c1[N+](=O)[O-] ZINC000612412085 940055169 /nfs/dbraw/zinc/05/51/69/940055169.db2.gz VYWFLLNNZQAQOP-UHFFFAOYSA-N 0 0 365.393 3.533 20 5 FHBDRN COc1ccc2cc(CN(C)C(=O)Cc3ccccc3[N+](=O)[O-])ccc2c1 ZINC000018212987 940055623 /nfs/dbraw/zinc/05/56/23/940055623.db2.gz VOBHMXMVWBRJIM-UHFFFAOYSA-N 0 0 364.401 3.958 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)C[C@@H](c1ccc(O)cc1)C1CC1 ZINC000411529046 940057984 /nfs/dbraw/zinc/05/79/84/940057984.db2.gz SZQALFANUDXMHO-GOSISDBHSA-N 0 0 370.405 3.509 20 5 FHBDRN COC[C@@H](NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000437388263 945293396 /nfs/dbraw/zinc/29/33/96/945293396.db2.gz BWGBCBJJDIZGRR-OAHLLOKOSA-N 0 0 352.749 3.505 20 5 FHBDRN CC(C)Oc1cc(C(=O)N[C@@H]2CCOc3c(F)cccc32)ccc1[N+](=O)[O-] ZINC000411597133 940069088 /nfs/dbraw/zinc/06/90/88/940069088.db2.gz UIHKYHQJNKVOHF-OAHLLOKOSA-N 0 0 374.368 3.775 20 5 FHBDRN O=[N+]([O-])c1cccc2ncnc(N[C@H]3CCN(c4ccc(F)cc4F)C3)c21 ZINC000612444453 940072311 /nfs/dbraw/zinc/07/23/11/940072311.db2.gz VKMHWSQOZMBEGN-LBPRGKRZSA-N 0 0 371.347 3.507 20 5 FHBDRN C[C@H](c1ccccc1)n1ccc(Nc2ncnc3cccc([N+](=O)[O-])c32)n1 ZINC000612447691 940074138 /nfs/dbraw/zinc/07/41/38/940074138.db2.gz GXSAUSBDUGSXBA-CYBMUJFWSA-N 0 0 360.377 3.509 20 5 FHBDRN Cc1ccc(-c2c[nH]cc2C(=O)NCCc2ccc([N+](=O)[O-])cc2)s1 ZINC000188562253 940077448 /nfs/dbraw/zinc/07/74/48/940077448.db2.gz WVAMHHWXACUEBT-UHFFFAOYSA-N 0 0 355.419 3.932 20 5 FHBDRN O=C(NC1CCN(c2ccc(Cl)cc2[N+](=O)[O-])CC1)C1CCCCC1 ZINC000065946002 940087853 /nfs/dbraw/zinc/08/78/53/940087853.db2.gz AFIFQZLGSXICNT-UHFFFAOYSA-N 0 0 365.861 3.914 20 5 FHBDRN O=[N+]([O-])c1sccc1NC[C@@H](c1ccc(Cl)cc1)N1CCOCC1 ZINC000065945844 940088333 /nfs/dbraw/zinc/08/83/33/940088333.db2.gz NEECDPRWQRGVDG-HNNXBMFYSA-N 0 0 367.858 3.795 20 5 FHBDRN CCn1c(COC(=O)c2ccc(C)c([N+](=O)[O-])c2)nc2c1cccc2F ZINC000728616502 940098775 /nfs/dbraw/zinc/09/87/75/940098775.db2.gz MUPDVIVJQLURQR-UHFFFAOYSA-N 0 0 357.341 3.769 20 5 FHBDRN COc1c(O)ccc(CN[C@@H](C)c2ccccc2OC(F)F)c1[N+](=O)[O-] ZINC000892499999 940102691 /nfs/dbraw/zinc/10/26/91/940102691.db2.gz DGGTUTLBYQDZBM-JTQLQIEISA-N 0 0 368.336 3.761 20 5 FHBDRN COc1cc(CN2CC[C@](F)(c3cc(F)cc(F)c3)C2)ccc1[N+](=O)[O-] ZINC000584484861 940108275 /nfs/dbraw/zinc/10/82/75/940108275.db2.gz AUWIAORRDOJQLL-GOSISDBHSA-N 0 0 366.339 3.952 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CN1CCC(N(C)c2ccccc2)CC1 ZINC000065957004 940121680 /nfs/dbraw/zinc/12/16/80/940121680.db2.gz QVRKAEIPUOGNBR-UHFFFAOYSA-N 0 0 355.438 3.704 20 5 FHBDRN Cc1ccn(C2CCN(C(=O)Nc3ccc(Cl)c([N+](=O)[O-])c3)CC2)n1 ZINC000365321623 940123717 /nfs/dbraw/zinc/12/37/17/940123717.db2.gz VLAJFDDBLWLVIB-UHFFFAOYSA-N 0 0 363.805 3.622 20 5 FHBDRN CCS[C@@H]1CC[C@H](N(C)C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000136721533 940143614 /nfs/dbraw/zinc/14/36/14/940143614.db2.gz YJYJQYMSNXRZDF-DZGCQCFKSA-N 0 0 361.467 3.751 20 5 FHBDRN CC(C)[C@@H](CNc1ccc([N+](=O)[O-])c(OC(F)F)c1)c1ccnn1C ZINC000615944204 940146578 /nfs/dbraw/zinc/14/65/78/940146578.db2.gz UAGOFMFQXWDLEP-GFCCVEGCSA-N 0 0 354.357 3.781 20 5 FHBDRN Cc1ccc(CN(C)C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)cc1 ZINC000179939766 940147235 /nfs/dbraw/zinc/14/72/35/940147235.db2.gz XNJSGDGTLSRQBS-UHFFFAOYSA-N 0 0 350.321 3.777 20 5 FHBDRN O=C(N[C@H](c1ccccc1)c1ccccn1)c1cc([N+](=O)[O-])cc(F)c1F ZINC000365416746 940150423 /nfs/dbraw/zinc/15/04/23/940150423.db2.gz VJZVPZJHZBTYBH-GOSISDBHSA-N 0 0 369.327 3.787 20 5 FHBDRN O=C(N[C@H](c1ccccc1)c1ccncc1)c1cc([N+](=O)[O-])cc(F)c1F ZINC000365412595 940150482 /nfs/dbraw/zinc/15/04/82/940150482.db2.gz NRUSQZRIDVMVJY-GOSISDBHSA-N 0 0 369.327 3.787 20 5 FHBDRN CCOc1ccc(NC(=O)C[NH2+][C@H](CC)c2ccccc2)c([N+](=O)[O-])c1 ZINC000411877554 940151398 /nfs/dbraw/zinc/15/13/98/940151398.db2.gz DEOGCUALMHZLGA-MRXNPFEDSA-N 0 0 357.410 3.673 20 5 FHBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])c1cc(F)c(F)cc1F ZINC000540893700 940159921 /nfs/dbraw/zinc/15/99/21/940159921.db2.gz YCVYZENUUSWYKI-UHFFFAOYSA-N 0 0 358.703 3.638 20 5 FHBDRN CCc1cc(=NC(=O)c2cc([N+](=O)[O-])ccc2SCC2CCCC2)[nH][nH]1 ZINC000612584772 940162681 /nfs/dbraw/zinc/16/26/81/940162681.db2.gz NFBGGXWQHCDAKV-UHFFFAOYSA-N 0 0 374.466 3.837 20 5 FHBDRN CCNC(=O)N1CCc2ccc(N[C@@H](C)c3cccc([N+](=O)[O-])c3)cc21 ZINC000179970098 940171381 /nfs/dbraw/zinc/17/13/81/940171381.db2.gz BYXMZKSLOZZPQG-ZDUSSCGKSA-N 0 0 354.410 3.860 20 5 FHBDRN Cc1cc2c(o1)CC(C)(C)C[C@@H]2NS(=O)(=O)c1ccc([N+](=O)[O-])s1 ZINC000066000661 940175702 /nfs/dbraw/zinc/17/57/02/940175702.db2.gz NOYZBIVKNJWXLF-NSHDSACASA-N 0 0 370.452 3.550 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1cc(-c2ccncc2)[nH]n1 ZINC000128300025 940185717 /nfs/dbraw/zinc/18/57/17/940185717.db2.gz PVAMRBXKDGJNKX-UHFFFAOYSA-N 0 0 369.406 3.744 20 5 FHBDRN Cc1ccccc1C1(C(=O)NCCNc2ccccc2[N+](=O)[O-])CCC1 ZINC000472451287 940190981 /nfs/dbraw/zinc/19/09/81/940190981.db2.gz AOPGWNFRSCTFIL-UHFFFAOYSA-N 0 0 353.422 3.553 20 5 FHBDRN CCc1ccc(C(=O)N(Cc2ccc(O)cc2)CC2CC2)cc1[N+](=O)[O-] ZINC000154056681 940197067 /nfs/dbraw/zinc/19/70/67/940197067.db2.gz SIKHKBUODZYFHQ-UHFFFAOYSA-N 0 0 354.406 3.915 20 5 FHBDRN O=C(NC[C@H](O)c1ccccc1Cl)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000124502010 945302908 /nfs/dbraw/zinc/30/29/08/945302908.db2.gz NBIPLRHDGIVKAW-AWEZNQCLSA-N 0 0 370.192 3.757 20 5 FHBDRN COc1cc(OCC(=O)N[C@@H](c2ccccc2)C(C)(C)C)ccc1[N+](=O)[O-] ZINC000066021791 940205042 /nfs/dbraw/zinc/20/50/42/940205042.db2.gz YXAGYEZAMNEKLC-IBGZPJMESA-N 0 0 372.421 3.886 20 5 FHBDRN CCCN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2OC)c2ccc(F)cc21 ZINC000427346625 945303326 /nfs/dbraw/zinc/30/33/26/945303326.db2.gz JURJGOLQIGTJKY-UHFFFAOYSA-N 0 0 373.384 3.619 20 5 FHBDRN Cc1c(NC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)cccc1N(C)C ZINC000548953474 940217255 /nfs/dbraw/zinc/21/72/55/940217255.db2.gz JMZAHTZZUNDABQ-UHFFFAOYSA-N 0 0 356.426 3.676 20 5 FHBDRN O=C(Nc1ccc(O)cc1F)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000124561955 945305976 /nfs/dbraw/zinc/30/59/76/945305976.db2.gz UGUJGRYAZFWEEQ-UHFFFAOYSA-N 0 0 359.338 3.815 20 5 FHBDRN CCn1c(COC(=O)c2cc([N+](=O)[O-])ccc2C)nc2c1cccc2F ZINC000728625979 940263258 /nfs/dbraw/zinc/26/32/58/940263258.db2.gz OYKRINZFOZGWSZ-UHFFFAOYSA-N 0 0 357.341 3.769 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(OC(F)F)cc2)c1 ZINC000548958225 940266877 /nfs/dbraw/zinc/26/68/77/940266877.db2.gz NBVKVEGCVMGHJQ-UHFFFAOYSA-N 0 0 352.293 3.847 20 5 FHBDRN O=C(CCNC(=O)c1cc2ccccc2c2cccnc12)Nc1cccnc1 ZINC000066098361 940277813 /nfs/dbraw/zinc/27/78/13/940277813.db2.gz PDOBBOQDEBUWEW-UHFFFAOYSA-N 0 0 370.412 3.542 20 5 FHBDRN COCCC[C@@H](C)C(=O)N(C)c1nc(-c2ccccc2[N+](=O)[O-])cs1 ZINC000180033725 940296748 /nfs/dbraw/zinc/29/67/48/940296748.db2.gz SNYPFLLUTCSATJ-GFCCVEGCSA-N 0 0 363.439 3.744 20 5 FHBDRN O=[N+]([O-])c1cc2c(ncnc2N2CCCC[C@@H]2c2noc(C3CC3)n2)s1 ZINC000376106860 940322311 /nfs/dbraw/zinc/32/23/11/940322311.db2.gz MSLLENYQFJNFKW-LLVKDONJSA-N 0 0 372.410 3.592 20 5 FHBDRN CCc1nc(C)c([C@H](C)N(C)C(=O)c2ccc([N+](=O)[O-])cc2OC)s1 ZINC000427360331 945315161 /nfs/dbraw/zinc/31/51/61/945315161.db2.gz YVBMVOCBPPXABM-NSHDSACASA-N 0 0 363.439 3.764 20 5 FHBDRN C[C@@H]1CCC[C@H](c2noc(Cc3cc4c(cc3[N+](=O)[O-])OCCO4)n2)C1 ZINC000612911153 940337483 /nfs/dbraw/zinc/33/74/83/940337483.db2.gz BMUFYRIHNGPMAN-NEPJUHHUSA-N 0 0 359.382 3.634 20 5 FHBDRN COc1cccc([C@@H](C)c2noc(CCc3cccc([N+](=O)[O-])c3)n2)c1 ZINC000612917147 940339046 /nfs/dbraw/zinc/33/90/46/940339046.db2.gz FROBCLOHXCXLDB-CYBMUJFWSA-N 0 0 353.378 3.923 20 5 FHBDRN O=[N+]([O-])c1ccccc1NCCc1noc(CNc2ccccc2Cl)n1 ZINC000612928379 940341376 /nfs/dbraw/zinc/34/13/76/940341376.db2.gz XWVPCRXDKQYMBS-UHFFFAOYSA-N 0 0 373.800 3.898 20 5 FHBDRN COC(=O)c1cc(-c2nc([C@H]3CCc4ccccc43)no2)cc([N+](=O)[O-])c1 ZINC000612932808 940343507 /nfs/dbraw/zinc/34/35/07/940343507.db2.gz DUMJEBDLRAMQLL-INIZCTEOSA-N 0 0 365.345 3.510 20 5 FHBDRN COc1cc(OCc2nc([C@H]3CCc4ccccc43)no2)ccc1[N+](=O)[O-] ZINC000612933246 940344206 /nfs/dbraw/zinc/34/42/06/940344206.db2.gz PCILGPLRAPGMNM-HNNXBMFYSA-N 0 0 367.361 3.644 20 5 FHBDRN C[C@@H](c1cccs1)c1noc([C@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)n1 ZINC000612947392 940352698 /nfs/dbraw/zinc/35/26/98/940352698.db2.gz RFZICZWSZAZDSJ-QWRGUYRKSA-N 0 0 372.406 3.682 20 5 FHBDRN O=[N+]([O-])c1ccc(Cc2noc(-c3cc4ccc(F)cc4s3)n2)nc1 ZINC000612969714 940367156 /nfs/dbraw/zinc/36/71/56/940367156.db2.gz DVSXNCHLUBGJGW-UHFFFAOYSA-N 0 0 356.338 3.984 20 5 FHBDRN COc1cc(C(=O)N[C@@H]2CC[C@H](c3ccccc3)C2)c([N+](=O)[O-])cc1OC ZINC000376148510 940371671 /nfs/dbraw/zinc/37/16/71/940371671.db2.gz IOVNXVUTLGKWFC-LSDHHAIUSA-N 0 0 370.405 3.678 20 5 FHBDRN CC(C)(C(=O)N1CCC(c2cccnc2)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000612998524 940382325 /nfs/dbraw/zinc/38/23/25/940382325.db2.gz JDVQDZVAQVNNKS-UHFFFAOYSA-N 0 0 371.412 3.813 20 5 FHBDRN CC(C)OC1CCC(NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)CC1 ZINC000612998762 940382373 /nfs/dbraw/zinc/38/23/73/940382373.db2.gz GIMOXEVBCRGCOW-UHFFFAOYSA-N 0 0 366.433 3.864 20 5 FHBDRN Cc1cccnc1NC(=O)C1CCN(c2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000376155778 940385711 /nfs/dbraw/zinc/38/57/11/940385711.db2.gz DXSPFGDTAWEGHH-UHFFFAOYSA-N 0 0 374.828 3.807 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2C[C@H](C)Oc3ccc(C)cc32)c1 ZINC000548972489 940388500 /nfs/dbraw/zinc/38/85/00/940388500.db2.gz VVHOVUSGCADJQY-ZDUSSCGKSA-N 0 0 356.378 3.730 20 5 FHBDRN CC(C)(CNC(=O)c1c([N+](=O)[O-])cccc1C(F)(F)F)c1cccnc1 ZINC000414011031 940397080 /nfs/dbraw/zinc/39/70/80/940397080.db2.gz PMEYOBOLLRAJKM-UHFFFAOYSA-N 0 0 367.327 3.716 20 5 FHBDRN C[C@H]1CCc2c(F)cccc2[C@H]1NC(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000431721846 940409435 /nfs/dbraw/zinc/40/94/35/940409435.db2.gz JJHPPVLTSFCCJY-SGTLLEGYSA-N 0 0 357.385 3.857 20 5 FHBDRN CCOC[C@@H]1CCCN(C(=O)c2c([N+](=O)[O-])cccc2C(F)(F)F)C1 ZINC000579886016 940412103 /nfs/dbraw/zinc/41/21/03/940412103.db2.gz VVZZEJNAQKYZCP-LLVKDONJSA-N 0 0 360.332 3.502 20 5 FHBDRN CCOC(=O)CCC1CCN(c2cccc(OCC)c2[N+](=O)[O-])CC1 ZINC000613048423 940419523 /nfs/dbraw/zinc/41/95/23/940419523.db2.gz MAPUIGACGAKJAG-UHFFFAOYSA-N 0 0 350.415 3.553 20 5 FHBDRN O=C(NCc1cc(Br)ccc1F)c1ccc(F)cc1[N+](=O)[O-] ZINC000161673228 940429622 /nfs/dbraw/zinc/42/96/22/940429622.db2.gz HYEYRKZSPLNAIM-UHFFFAOYSA-N 0 0 371.137 3.566 20 5 FHBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@H](CO)[C@@H]1C ZINC000414032349 940430834 /nfs/dbraw/zinc/43/08/34/940430834.db2.gz KSMRLYFPAAHJDJ-UONOGXRCSA-N 0 0 366.483 3.720 20 5 FHBDRN O=C(CC[C@H]1Cc2ccccc2NC1=O)Oc1cc(Cl)ccc1[N+](=O)[O-] ZINC000124808944 945320747 /nfs/dbraw/zinc/32/07/47/945320747.db2.gz XOICPBYPSVPARK-LBPRGKRZSA-N 0 0 374.780 3.745 20 5 FHBDRN Cc1sc(C(=O)Nc2nc(C3CCOCC3)cs2)cc1[N+](=O)[O-] ZINC000376193539 940446957 /nfs/dbraw/zinc/44/69/57/940446957.db2.gz CYRUHZYSHPFBBA-UHFFFAOYSA-N 0 0 353.425 3.568 20 5 FHBDRN O=C(OCCCc1ccsc1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000782678499 940447295 /nfs/dbraw/zinc/44/72/95/940447295.db2.gz ZGWBPJRXTWVZPG-UHFFFAOYSA-N 0 0 357.391 3.632 20 5 FHBDRN COC(=O)c1ccc(OCc2ccccc2OC(F)F)cc1[N+](=O)[O-] ZINC000613109210 940451949 /nfs/dbraw/zinc/45/19/49/940451949.db2.gz TUVHLDILDOGCNE-UHFFFAOYSA-N 0 0 353.277 3.562 20 5 FHBDRN Cc1cc(=O)[nH]c2cc(C(=O)N3CCCc4c([N+](=O)[O-])cccc43)ccc12 ZINC000580252745 940470711 /nfs/dbraw/zinc/47/07/11/940470711.db2.gz GGYFODXRSGAVKT-UHFFFAOYSA-N 0 0 363.373 3.750 20 5 FHBDRN Cc1cccc(C(=O)N2CC[C@]3(C2)CCc2ccccc2O3)c1[N+](=O)[O-] ZINC000580264132 940471140 /nfs/dbraw/zinc/47/11/40/940471140.db2.gz QDWFTQKWQCNIQR-FQEVSTJZSA-N 0 0 352.390 3.513 20 5 FHBDRN COC(=O)Nc1cccc(C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000177875588 940473119 /nfs/dbraw/zinc/47/31/19/940473119.db2.gz HCXUHEGOQHBKKL-LBPRGKRZSA-N 0 0 357.366 3.573 20 5 FHBDRN O=C(c1ccccc1)c1ccc(N2CC(C(F)(F)F)C2)c([N+](=O)[O-])c1 ZINC000580361988 940473922 /nfs/dbraw/zinc/47/39/22/940473922.db2.gz XAYMUOWBEWZTOA-UHFFFAOYSA-N 0 0 350.296 3.824 20 5 FHBDRN C[C@H]1C[C@@H](c2ccsc2)CN1c1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1 ZINC000376212648 940474600 /nfs/dbraw/zinc/47/46/00/940474600.db2.gz OLKYUVAWJCBFNA-CMPLNLGQSA-N 0 0 356.407 3.688 20 5 FHBDRN CC(C)n1cc(NC(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)cn1 ZINC000066389857 940477886 /nfs/dbraw/zinc/47/78/86/940477886.db2.gz DLAVIZVIPZAWNO-UHFFFAOYSA-N 0 0 371.441 3.861 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(C(=O)OC)c1C ZINC000613175146 940478039 /nfs/dbraw/zinc/47/80/39/940478039.db2.gz VJQLUVDVJPEPLP-OAHLLOKOSA-N 0 0 370.405 3.897 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C)[C@@H](C1)C2(F)F ZINC000580592366 940479921 /nfs/dbraw/zinc/47/99/21/940479921.db2.gz QPLNJFNUBUSXIU-HIFRSBDPSA-N 0 0 356.394 3.824 20 5 FHBDRN CCOC(=O)/C=C\c1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2F)cc1 ZINC000255886768 940480799 /nfs/dbraw/zinc/48/07/99/940480799.db2.gz IWIJLVIMESJUIW-YHYXMXQVSA-N 0 0 358.325 3.563 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1-c1noc(-c2cc(F)ccc2-n2cccn2)n1 ZINC000580630898 940481007 /nfs/dbraw/zinc/48/10/07/940481007.db2.gz KTYWKJYTVLUOAD-UHFFFAOYSA-N 0 0 365.324 3.945 20 5 FHBDRN Cc1c(NC(=O)c2ncccc2Cl)cc(Br)cc1[N+](=O)[O-] ZINC000511448589 940481071 /nfs/dbraw/zinc/48/10/71/940481071.db2.gz YMGZEFSWHTVCFG-UHFFFAOYSA-N 0 0 370.590 3.966 20 5 FHBDRN CC(C)C(=O)c1ccc([C@@H](C)C(=O)NCCc2cccc([N+](=O)[O-])c2)cc1 ZINC000549005726 940483589 /nfs/dbraw/zinc/48/35/89/940483589.db2.gz AWDWLMAMAWPSMM-OAHLLOKOSA-N 0 0 368.433 3.896 20 5 FHBDRN Cc1ccc(-c2noc([C@@H](C)NC(=O)c3ccccc3[N+](=O)[O-])n2)cc1F ZINC000472522966 940484282 /nfs/dbraw/zinc/48/42/82/940484282.db2.gz RPGGCACSDFMRBL-LLVKDONJSA-N 0 0 370.340 3.583 20 5 FHBDRN C[C@H](C(=O)Nc1csc(-c2ccccn2)n1)c1cccc([N+](=O)[O-])c1 ZINC000580810808 940486184 /nfs/dbraw/zinc/48/61/84/940486184.db2.gz OUBISKLTNBSITG-NSHDSACASA-N 0 0 354.391 3.856 20 5 FHBDRN Cc1ccoc1CNC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 ZINC000580850864 940487003 /nfs/dbraw/zinc/48/70/03/940487003.db2.gz RZVLDPJMUXHGJN-UHFFFAOYSA-N 0 0 357.410 3.663 20 5 FHBDRN CCC(=O)Nc1ccc(C)c(NC(=O)Cc2cccc([N+](=O)[O-])c2C)c1 ZINC000161732240 940488137 /nfs/dbraw/zinc/48/81/37/940488137.db2.gz UPFLCGMNGNLGBK-UHFFFAOYSA-N 0 0 355.394 3.741 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H]1CCCN(c2ccccc2)C1 ZINC000580921109 940489029 /nfs/dbraw/zinc/48/90/29/940489029.db2.gz CNMHMPBNMCUVPJ-MRXNPFEDSA-N 0 0 368.437 3.948 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[C@]2(C1)CCc1ccccc1O2 ZINC000580934307 940489281 /nfs/dbraw/zinc/48/92/81/940489281.db2.gz JTUPVECZAAWJHO-FQEVSTJZSA-N 0 0 352.390 3.513 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[C@@]2(C1)CCc1ccccc1O2 ZINC000580934308 940489319 /nfs/dbraw/zinc/48/93/19/940489319.db2.gz JTUPVECZAAWJHO-HXUWFJFHSA-N 0 0 352.390 3.513 20 5 FHBDRN Cc1c(-c2noc(Cc3ccc4c(c3)CCCO4)n2)cccc1[N+](=O)[O-] ZINC000580951783 940489727 /nfs/dbraw/zinc/48/97/27/940489727.db2.gz MWIWDDANIGSIFP-UHFFFAOYSA-N 0 0 351.362 3.869 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NCc2cccc(OC(F)F)c2)c1 ZINC000549009271 940490347 /nfs/dbraw/zinc/49/03/47/940490347.db2.gz IEARFBUEVBHSOX-UHFFFAOYSA-N 0 0 366.320 3.525 20 5 FHBDRN O=C(NCc1ccc(C2CC2)cc1)N1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000581064715 940492277 /nfs/dbraw/zinc/49/22/77/940492277.db2.gz YIDKCVMQTBXJHB-UHFFFAOYSA-N 0 0 367.405 3.576 20 5 FHBDRN Cc1cccc(C)c1OCCC(=O)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000581078354 940492950 /nfs/dbraw/zinc/49/29/50/940492950.db2.gz WDSFXSJNHDOEAD-UHFFFAOYSA-N 0 0 356.422 3.682 20 5 FHBDRN O=C(NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)c1cc(F)cc(Cl)c1 ZINC000581092903 940493388 /nfs/dbraw/zinc/49/33/88/940493388.db2.gz DFERDEPIFYQSLC-UHFFFAOYSA-N 0 0 361.760 3.841 20 5 FHBDRN O=C(Nc1ccccc1NCCCc1ccccc1)c1cc([N+](=O)[O-])n[nH]1 ZINC000581267319 940498129 /nfs/dbraw/zinc/49/81/29/940498129.db2.gz FWOIWZXGVPJCCZ-UHFFFAOYSA-N 0 0 365.393 3.615 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])NCC(F)(F)c1ccc(Cl)cc1 ZINC000581387300 940503141 /nfs/dbraw/zinc/50/31/41/940503141.db2.gz MBPGWPRTDDWFAU-UHFFFAOYSA-N 0 0 369.755 3.839 20 5 FHBDRN C[C@@H]1Cc2ccccc2[C@@H]1NC(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000511475276 940506244 /nfs/dbraw/zinc/50/62/44/940506244.db2.gz KQOUZRGZXXRPEN-AUUYWEPGSA-N 0 0 353.422 3.712 20 5 FHBDRN COc1ccc2c(c1)OCC[C@H]2NC(=O)Nc1cc([N+](=O)[O-])c(C)cc1C ZINC000613300703 940508943 /nfs/dbraw/zinc/50/89/43/940508943.db2.gz WSPHPPALZKJCQR-OAHLLOKOSA-N 0 0 371.393 3.866 20 5 FHBDRN COc1ccccc1OC[C@@H](C)CNC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000581760492 940511864 /nfs/dbraw/zinc/51/18/64/940511864.db2.gz NCJICASZLWMJNQ-GJZGRUSLSA-N 0 0 372.421 3.538 20 5 FHBDRN COc1ccc(NCc2ccc(OC)c([N+](=O)[O-])c2)c(Br)c1 ZINC000124880003 945331295 /nfs/dbraw/zinc/33/12/95/945331295.db2.gz YUGYUNSQYYRSPC-UHFFFAOYSA-N 0 0 367.199 3.987 20 5 FHBDRN O=C(NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)C1(c2ccccc2)CCC1 ZINC000581691942 940589194 /nfs/dbraw/zinc/58/91/94/940589194.db2.gz XBWNZWHEPVXKNW-UHFFFAOYSA-N 0 0 363.417 3.857 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCC[C@H]1c1cccc(F)c1 ZINC000173232375 940598534 /nfs/dbraw/zinc/59/85/34/940598534.db2.gz VNRKAOADPLKGSC-SFHVURJKSA-N 0 0 357.385 3.818 20 5 FHBDRN Cc1nn(C(C)(C)C)cc1[C@@H](C)Nc1ncnc2ccc([N+](=O)[O-])cc21 ZINC000613333785 940605573 /nfs/dbraw/zinc/60/55/73/940605573.db2.gz XHXFPNRAPCQMMK-LLVKDONJSA-N 0 0 354.414 3.971 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)N[C@@H]2C[C@@H]3CCC(C)(C)c4cccc2c43)n1 ZINC000427388867 945334793 /nfs/dbraw/zinc/33/47/93/945334793.db2.gz CHBSHFPZGLIPIV-SWLSCSKDSA-N 0 0 368.437 3.841 20 5 FHBDRN C[C@@H](C(=O)NC[C@@H]1CCO[C@H]1c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000581839899 940626190 /nfs/dbraw/zinc/62/61/90/940626190.db2.gz HYCJQGBWEDRQEJ-LJHODMEESA-N 0 0 354.406 3.592 20 5 FHBDRN COc1ccc2c(c1)C[C@@H](C)N(C(=O)c1ccc([N+](=O)[O-])cc1OC)[C@H]2C ZINC000427391337 945335573 /nfs/dbraw/zinc/33/55/73/945335573.db2.gz QEDRVSAKWFHEQP-OLZOCXBDSA-N 0 0 370.405 3.760 20 5 FHBDRN COc1ccc(C[C@@H](C)NC(=O)Nc2cccc([N+](=O)[O-])c2C)cc1OC ZINC000106579236 945335842 /nfs/dbraw/zinc/33/58/42/945335842.db2.gz ALMQIFAHXKYCIJ-GFCCVEGCSA-N 0 0 373.409 3.673 20 5 FHBDRN CO[C@@H](C)CCNC(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000581907792 940633010 /nfs/dbraw/zinc/63/30/10/940633010.db2.gz GMWHRHMWOJIBQR-ZDUSSCGKSA-N 0 0 359.382 3.934 20 5 FHBDRN CSCc1ccc(NC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2)cc1 ZINC000066551602 940641603 /nfs/dbraw/zinc/64/16/03/940641603.db2.gz XNPVFYRBFZIYCX-UHFFFAOYSA-N 0 0 361.379 3.927 20 5 FHBDRN COc1ccc2c(c1)[C@@H](C(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1)CC2 ZINC000431815571 940644438 /nfs/dbraw/zinc/64/44/38/940644438.db2.gz WKUDAPUHOWYWQA-DYVFJYSZSA-N 0 0 354.406 3.819 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H](C)c1ccc2n[nH]cc2c1 ZINC000582092298 940652817 /nfs/dbraw/zinc/65/28/17/940652817.db2.gz KDEXVJYLCCXTFE-NSHDSACASA-N 0 0 353.382 3.916 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2noc(-c3ccc(-c4cncnc4)cc3F)n2)s1 ZINC000582267302 940658151 /nfs/dbraw/zinc/65/81/51/940658151.db2.gz LJFJEZIKPBKQGT-UHFFFAOYSA-N 0 0 369.337 3.969 20 5 FHBDRN COc1cc(N2CC[C@H](OCCCc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000431821551 940660779 /nfs/dbraw/zinc/66/07/79/940660779.db2.gz FZCLQLMDLYBUFY-SFHVURJKSA-N 0 0 356.422 3.832 20 5 FHBDRN O=C(NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)c1cncc2ccccc21 ZINC000582273353 940662875 /nfs/dbraw/zinc/66/28/75/940662875.db2.gz MMSXFFRMMGOOSS-UHFFFAOYSA-N 0 0 360.373 3.597 20 5 FHBDRN O=C(COc1ccccc1[N+](=O)[O-])Nc1ncc(-c2ccccc2F)s1 ZINC000549017970 940676990 /nfs/dbraw/zinc/67/69/90/940676990.db2.gz BXVVHJQNXJQTFX-UHFFFAOYSA-N 0 0 373.365 3.875 20 5 FHBDRN CCOC(=O)c1cc(COC)cc(NCc2csc([N+](=O)[O-])c2)c1 ZINC000427407747 945339897 /nfs/dbraw/zinc/33/98/97/945339897.db2.gz MQNVVADBLCDJKK-UHFFFAOYSA-N 0 0 350.396 3.592 20 5 FHBDRN CCO[C@@H]1C[C@@H]1NC(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000582525816 940702619 /nfs/dbraw/zinc/70/26/19/940702619.db2.gz VKADDJMOUOEVCC-DLBZAZTESA-N 0 0 357.366 3.686 20 5 FHBDRN CCO[C@H]1C[C@@H]1NC(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000582525818 940702649 /nfs/dbraw/zinc/70/26/49/940702649.db2.gz VKADDJMOUOEVCC-IRXDYDNUSA-N 0 0 357.366 3.686 20 5 FHBDRN COc1ccc(C(=O)Nc2ccc(F)c(Br)c2)cc1[N+](=O)[O-] ZINC000174109823 940703106 /nfs/dbraw/zinc/70/31/06/940703106.db2.gz MCRPOAHWLFQKFG-UHFFFAOYSA-N 0 0 369.146 3.757 20 5 FHBDRN COCc1ccc([C@H]2CCCN2c2ncnc3ccc([N+](=O)[O-])cc32)o1 ZINC000613433951 940705846 /nfs/dbraw/zinc/70/58/46/940705846.db2.gz DCKHHJWKFNOZHM-MRXNPFEDSA-N 0 0 354.366 3.619 20 5 FHBDRN C[C@@H](CNC(=O)Cc1ccc([N+](=O)[O-])cc1Cl)c1ccc(F)cc1F ZINC000174340085 940723928 /nfs/dbraw/zinc/72/39/28/940723928.db2.gz FOWXYOPHZVERAH-JTQLQIEISA-N 0 0 368.767 3.989 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(NC[C@@H]2CCC[C@@H](C(F)(F)F)C2)n1 ZINC000582562192 940724351 /nfs/dbraw/zinc/72/43/51/940724351.db2.gz LQSURUWOEMNLBT-NXEZZACHSA-N 0 0 361.320 3.557 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)NCC[C@@H]1C[C@@H](C)O[C@@H](C)C1 ZINC000549023744 940727257 /nfs/dbraw/zinc/72/72/57/940727257.db2.gz XBEKARBQRAYLQO-BTTYYORXSA-N 0 0 365.430 3.709 20 5 FHBDRN CCCN(Cc1ccccc1F)S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1 ZINC000613472374 940739464 /nfs/dbraw/zinc/73/94/64/940739464.db2.gz GHZOLMSUGGPPPJ-UHFFFAOYSA-N 0 0 372.443 3.705 20 5 FHBDRN COC(=O)c1c(C)csc1NC(=O)c1ccc(SC)c([N+](=O)[O-])c1 ZINC000582630465 940765768 /nfs/dbraw/zinc/76/57/68/940765768.db2.gz OODRRJIBIMGOQZ-UHFFFAOYSA-N 0 0 366.420 3.726 20 5 FHBDRN Cc1cccc(NC(=O)N2CCN([C@@H](C)c3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000170686642 940780946 /nfs/dbraw/zinc/78/09/46/940780946.db2.gz GIHRBLDLYRLPAB-INIZCTEOSA-N 0 0 368.437 3.814 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NCCc2c[nH]c3ccc(F)cc23)c1 ZINC000549036843 940785336 /nfs/dbraw/zinc/78/53/36/940785336.db2.gz UCLFORROBCEDJE-UHFFFAOYSA-N 0 0 371.368 3.586 20 5 FHBDRN C[C@H](C(=O)NCCNc1ccccc1[N+](=O)[O-])c1ccc(Cl)s1 ZINC000175054706 940800318 /nfs/dbraw/zinc/80/03/18/940800318.db2.gz SQPPEHRKIJJEQN-JTQLQIEISA-N 0 0 353.831 3.642 20 5 FHBDRN COc1ccc(CN[C@@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000582681814 940802448 /nfs/dbraw/zinc/80/24/48/940802448.db2.gz HSBDNSYPUMBJDA-LJQANCHMSA-N 0 0 366.421 3.525 20 5 FHBDRN CC(=O)c1csc(NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])n1 ZINC000175080814 940807926 /nfs/dbraw/zinc/80/79/26/940807926.db2.gz RWQNLVFGHLRAKB-UHFFFAOYSA-N 0 0 359.285 3.525 20 5 FHBDRN CCn1ncc2ccc(NC(=O)CCOc3cc(C)ccc3[N+](=O)[O-])cc21 ZINC000170817842 940831236 /nfs/dbraw/zinc/83/12/36/940831236.db2.gz HUCJHGDOOGHEMP-UHFFFAOYSA-N 0 0 368.393 3.680 20 5 FHBDRN C[C@H](NC(=O)c1c(F)cccc1[N+](=O)[O-])c1nc(C2CCCCC2)no1 ZINC001126569406 945352541 /nfs/dbraw/zinc/35/25/41/945352541.db2.gz RCOMSRSWXICCOS-JTQLQIEISA-N 0 0 362.361 3.656 20 5 FHBDRN O=C(N[C@@H]1CCO[C@H]1c1ccc(Cl)c(F)c1)c1ccc([N+](=O)[O-])s1 ZINC000180223627 940848001 /nfs/dbraw/zinc/84/80/01/940848001.db2.gz REULIZCTPBOSDK-RISCZKNCSA-N 0 0 370.789 3.709 20 5 FHBDRN O=C(CN(Cc1ccc(Cl)cc1)C1CC1)Nc1ccccc1[N+](=O)[O-] ZINC000053128503 940848406 /nfs/dbraw/zinc/84/84/06/940848406.db2.gz RFJZHJPQSTVDLQ-UHFFFAOYSA-N 0 0 359.813 3.851 20 5 FHBDRN C[C@@H](c1cc2ccccc2o1)N(C)C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000180234438 940851758 /nfs/dbraw/zinc/85/17/58/940851758.db2.gz USCUBUZIWZVFLZ-NSHDSACASA-N 0 0 368.345 3.903 20 5 FHBDRN C[C@H](c1cc2ccccc2o1)N(C)C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000180234456 940851768 /nfs/dbraw/zinc/85/17/68/940851768.db2.gz USCUBUZIWZVFLZ-LLVKDONJSA-N 0 0 368.345 3.903 20 5 FHBDRN CCOc1ccc(C(=O)NC[C@H](c2cccnc2)C(C)C)cc1[N+](=O)[O-] ZINC000175334451 940853798 /nfs/dbraw/zinc/85/37/98/940853798.db2.gz BAQMUCUGBYVTHZ-INIZCTEOSA-N 0 0 357.410 3.558 20 5 FHBDRN CC1(C)C[C@@H](NCc2ccccc2S(C)(=O)=O)c2cc([N+](=O)[O-])ccc21 ZINC000414268335 940862204 /nfs/dbraw/zinc/86/22/04/940862204.db2.gz XATRSOQZULNSPJ-QGZVFWFLSA-N 0 0 374.462 3.511 20 5 FHBDRN C[C@@H](c1cccc(Cl)c1)N(C)C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000180272386 940899591 /nfs/dbraw/zinc/89/95/91/940899591.db2.gz NMEIFNWVYUCKLC-JTQLQIEISA-N 0 0 362.769 3.810 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1F)C(=O)NC(=O)Nc1ccccc1 ZINC000613526686 940917163 /nfs/dbraw/zinc/91/71/63/940917163.db2.gz KGOGKYBGDAHFTJ-SNVBAGLBSA-N 0 0 363.370 3.563 20 5 FHBDRN COc1ccc(CN[C@H](C(=O)OC(C)(C)C)c2ccccc2)cc1[N+](=O)[O-] ZINC000180282247 940917541 /nfs/dbraw/zinc/91/75/41/940917541.db2.gz JAMFNNXEYHJBIY-SFHVURJKSA-N 0 0 372.421 3.776 20 5 FHBDRN CCCCCc1nnc(NC(=O)c2ccc(NCC)c([N+](=O)[O-])c2)s1 ZINC000014714476 940932586 /nfs/dbraw/zinc/93/25/86/940932586.db2.gz LOAMLSPDKIJFGC-UHFFFAOYSA-N 0 0 363.443 3.863 20 5 FHBDRN Cc1cc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2C)c(Cl)cc1F ZINC000507599974 945361576 /nfs/dbraw/zinc/36/15/76/945361576.db2.gz YKDIURQHNBCRQL-UHFFFAOYSA-N 0 0 358.778 3.805 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)c1c(F)cc(Br)cc1F ZINC000175900627 940949729 /nfs/dbraw/zinc/94/97/29/940949729.db2.gz XWIGWIMPNBJUIP-UHFFFAOYSA-N 0 0 371.137 3.566 20 5 FHBDRN COc1cccc([C@@H](Nc2ccc(N)cc2[N+](=O)[O-])c2ccccn2)c1 ZINC000376418852 940959726 /nfs/dbraw/zinc/95/97/26/940959726.db2.gz DSGYUJDYTJJHIQ-LJQANCHMSA-N 0 0 350.378 3.782 20 5 FHBDRN COC(=O)[C@H](C)Cc1ccc(NC(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1 ZINC000186239082 940963672 /nfs/dbraw/zinc/96/36/72/940963672.db2.gz MSPYKJQTMZFWHA-CYBMUJFWSA-N 0 0 356.378 3.507 20 5 FHBDRN O=C(NCc1nc2ccccc2n1C1CC1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000186261447 940967299 /nfs/dbraw/zinc/96/72/99/940967299.db2.gz GFNUNPMGHANQEB-UHFFFAOYSA-N 0 0 370.796 3.863 20 5 FHBDRN O=C(NCCc1cccc(F)c1)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000018136816 945365881 /nfs/dbraw/zinc/36/58/81/945365881.db2.gz BNFWYUZQFIRXKO-UHFFFAOYSA-N 0 0 371.412 3.697 20 5 FHBDRN COc1ccc(CNCc2ccc(Cl)cc2[N+](=O)[O-])c(OC)c1OC ZINC000892617313 940977352 /nfs/dbraw/zinc/97/73/52/940977352.db2.gz VJMDESDBTVTXMG-UHFFFAOYSA-N 0 0 366.801 3.564 20 5 FHBDRN O=[N+]([O-])c1ccc(C(F)(F)F)c(CSc2nc3cncnc3[nH]2)c1 ZINC000549066437 940985407 /nfs/dbraw/zinc/98/54/07/940985407.db2.gz XOEZNWBWYWAPAV-UHFFFAOYSA-N 0 0 355.301 3.572 20 5 FHBDRN C[C@@H](NCC(=O)N(C)c1nc2ccccc2s1)c1cccc([N+](=O)[O-])c1 ZINC000180399200 941004084 /nfs/dbraw/zinc/00/40/84/941004084.db2.gz DDDMFHZRXWIIMD-GFCCVEGCSA-N 0 0 370.434 3.518 20 5 FHBDRN Cc1c([C@@H](C)NCc2ccccc2[N+](=O)[O-])nnn1-c1ccc(Cl)cc1 ZINC000180413230 941006456 /nfs/dbraw/zinc/00/64/56/941006456.db2.gz UYNHZYXHRIWSFP-GFCCVEGCSA-N 0 0 371.828 3.988 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)Nc2cccc(C[S@](C)=O)c2C)c1C ZINC000889028862 945369368 /nfs/dbraw/zinc/36/93/68/945369368.db2.gz BHKGQPDCXAKXNB-VWLOTQADSA-N 0 0 360.435 3.651 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])s1)N1CC[C@@H](OCCCc2ccccc2)C1 ZINC000176329024 941023418 /nfs/dbraw/zinc/02/34/18/941023418.db2.gz NMZLZQUTHULJNZ-OAHLLOKOSA-N 0 0 360.435 3.520 20 5 FHBDRN Cc1c(Br)cccc1NC(=O)c1cccc([N+](=O)[O-])c1N ZINC000176390109 941032662 /nfs/dbraw/zinc/03/26/62/941032662.db2.gz DJLGONUPEIYPCK-UHFFFAOYSA-N 0 0 350.172 3.500 20 5 FHBDRN COc1ccc(C[C@H](C)C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1OC ZINC000180503793 941034802 /nfs/dbraw/zinc/03/48/02/941034802.db2.gz RMSZPYLCKAMIBP-KBPBESRZSA-N 0 0 372.421 3.668 20 5 FHBDRN COc1ccc2c(c1)OCC[C@H]2Nc1ncnc2sc([N+](=O)[O-])cc21 ZINC000376452709 941038741 /nfs/dbraw/zinc/03/87/41/941038741.db2.gz BPFSAEFCCCLAEP-GFCCVEGCSA-N 0 0 358.379 3.544 20 5 FHBDRN Cc1cccc(NC(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)c1C ZINC000122130751 941041001 /nfs/dbraw/zinc/04/10/01/941041001.db2.gz SNTDNGKYTGIDLV-UHFFFAOYSA-N 0 0 354.410 3.566 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)NC2CC(C)(c3ccccc3)C2)c1F ZINC000412030199 941044213 /nfs/dbraw/zinc/04/42/13/941044213.db2.gz ATNAMMLOGUUMNM-UHFFFAOYSA-N 0 0 372.396 3.522 20 5 FHBDRN CC(C)(NC(=O)CCSCc1ccccn1)c1ccc([N+](=O)[O-])cc1 ZINC000176498006 941052361 /nfs/dbraw/zinc/05/23/61/941052361.db2.gz TWWINSAUORPXOS-UHFFFAOYSA-N 0 0 359.451 3.665 20 5 FHBDRN COC(=O)[C@@H](NCc1ccccc1[N+](=O)[O-])c1cccc(Cl)c1Cl ZINC000180614795 941055458 /nfs/dbraw/zinc/05/54/58/941055458.db2.gz KRZFWSNIGVJPKR-HNNXBMFYSA-N 0 0 369.204 3.906 20 5 FHBDRN CCc1cc(NC(=O)C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)ccc1C ZINC000180617194 941055485 /nfs/dbraw/zinc/05/54/85/941055485.db2.gz CTIVXUSBMKFGKX-AWEZNQCLSA-N 0 0 369.421 3.590 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1cn(C)nc1-c1ccccc1 ZINC000180642775 941059212 /nfs/dbraw/zinc/05/92/12/941059212.db2.gz JHIAJIMMBMYPGB-UHFFFAOYSA-N 0 0 350.378 3.864 20 5 FHBDRN COc1ccccc1[C@@H](C)CC(=O)OCCOc1cccc([N+](=O)[O-])c1 ZINC000728664034 941061342 /nfs/dbraw/zinc/06/13/42/941061342.db2.gz WKZQBURZAHZDGV-AWEZNQCLSA-N 0 0 359.378 3.719 20 5 FHBDRN Cn1cc([C@@H](Nc2ncnc3sc([N+](=O)[O-])cc32)c2ccccc2)cn1 ZINC000376479772 941068735 /nfs/dbraw/zinc/06/87/35/941068735.db2.gz YWYGOAKYODEMJK-HNNXBMFYSA-N 0 0 366.406 3.535 20 5 FHBDRN CCN(c1ccccc1F)S(=O)(=O)c1cc(C)c([N+](=O)[O-])cc1C ZINC000414387342 941082233 /nfs/dbraw/zinc/08/22/33/941082233.db2.gz ZCSVYVVQNJHBDT-UHFFFAOYSA-N 0 0 352.387 3.566 20 5 FHBDRN O=[N+]([O-])c1ccc(CN[C@@H](CCO)c2ccccc2Br)cc1 ZINC000540995202 941085160 /nfs/dbraw/zinc/08/51/60/941085160.db2.gz BELZQAWOJKQUJF-INIZCTEOSA-N 0 0 365.227 3.571 20 5 FHBDRN CC(C)(C)c1nnc(NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)s1 ZINC000180860011 941086005 /nfs/dbraw/zinc/08/60/05/941086005.db2.gz UZSIVAXSMSGIPY-UHFFFAOYSA-N 0 0 372.353 3.598 20 5 FHBDRN CCn1c(NC(=O)c2ccc([N+](=O)[O-])s2)nc2cc(Cl)ccc21 ZINC000180904213 941089795 /nfs/dbraw/zinc/08/97/95/941089795.db2.gz UVPJTMWNLPFKFR-UHFFFAOYSA-N 0 0 350.787 3.932 20 5 FHBDRN COc1cc(C(=O)N2C[C@H](C)Oc3ccc(C)cc32)cc([N+](=O)[O-])c1C ZINC000188807687 941094573 /nfs/dbraw/zinc/09/45/73/941094573.db2.gz XPSIYGBIPKNSRU-LBPRGKRZSA-N 0 0 356.378 3.648 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[C@@]2(C1)OCc1ccccc12 ZINC000188823728 941096653 /nfs/dbraw/zinc/09/66/53/941096653.db2.gz TUUSTHDQTHCSDI-IBGZPJMESA-N 0 0 353.378 3.567 20 5 FHBDRN C[C@@H]1CC[C@]2(CCN(C(=O)C3CCN(c4ccccc4[N+](=O)[O-])CC3)C2)C1 ZINC000541011842 941098230 /nfs/dbraw/zinc/09/82/30/941098230.db2.gz ZJCFOILCGQGHSP-IERDGZPVSA-N 0 0 371.481 3.850 20 5 FHBDRN CCOc1cc(Nc2ccc(N3CCC(O)CC3)cc2)ccc1[N+](=O)[O-] ZINC000180979252 941098908 /nfs/dbraw/zinc/09/89/08/941098908.db2.gz ZSPZGXAKRYOQGX-UHFFFAOYSA-N 0 0 357.410 3.698 20 5 FHBDRN COc1ccc2c(c1)OCC[C@@H]2NC(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000365524269 941099024 /nfs/dbraw/zinc/09/90/24/941099024.db2.gz CRCCMHAKWALDDW-HNNXBMFYSA-N 0 0 362.769 3.510 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@H](c1ccccc1)[C@@H]1CCCO1 ZINC000188834165 941106726 /nfs/dbraw/zinc/10/67/26/941106726.db2.gz LYFWTIQLDMUFTL-ZWKOTPCHSA-N 0 0 355.394 3.945 20 5 FHBDRN C[C@H]1c2ccc(F)cc2CCN1C(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000075108906 941109230 /nfs/dbraw/zinc/10/92/30/941109230.db2.gz NOAKLMZAJOBKCP-ZDUSSCGKSA-N 0 0 357.385 3.605 20 5 FHBDRN COC[C@@H](NC(=O)c1ccc([N+](=O)[O-])c(Cl)c1)c1ccc(F)c(F)c1 ZINC000181136166 941110385 /nfs/dbraw/zinc/11/03/85/941110385.db2.gz CYKQHWNJGRTWCA-CQSZACIVSA-N 0 0 370.739 3.644 20 5 FHBDRN Nc1cccc([N+](=O)[O-])c1C(=O)Nc1nc(-c2cccc(F)c2)cs1 ZINC000181208341 941110933 /nfs/dbraw/zinc/11/09/33/941110933.db2.gz WBILNDORDBDNLB-UHFFFAOYSA-N 0 0 358.354 3.692 20 5 FHBDRN CCOC(=O)CC[C@H]1CCCN(c2ccc([N+](=O)[O-])c(OC(F)F)c2)C1 ZINC000181232857 941113573 /nfs/dbraw/zinc/11/35/73/941113573.db2.gz WDVSEQDLSYFDEY-GFCCVEGCSA-N 0 0 372.368 3.756 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CCCC[C@H]2C(C)C)cc1OC ZINC000103056139 941114923 /nfs/dbraw/zinc/11/49/23/941114923.db2.gz YXXIQFYPYJTBMS-DZGCQCFKSA-N 0 0 364.442 3.947 20 5 FHBDRN C[C@@H](Cc1c(Cl)cccc1Cl)NC(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000181269328 941118944 /nfs/dbraw/zinc/11/89/44/941118944.db2.gz XCQOURDFCOOVHT-VIFPVBQESA-N 0 0 368.220 3.845 20 5 FHBDRN Nc1cccc([N+](=O)[O-])c1C(=O)Nc1cc(Cc2ccccc2)ccc1O ZINC000181266818 941119000 /nfs/dbraw/zinc/11/90/00/941119000.db2.gz HBXRDZQCNURGQQ-UHFFFAOYSA-N 0 0 363.373 3.726 20 5 FHBDRN C[C@H]1CCCN(c2ccc(C(=O)Nc3ccc(O)cc3F)cc2[N+](=O)[O-])C1 ZINC000782854944 941122246 /nfs/dbraw/zinc/12/22/46/941122246.db2.gz JUTWJVIAVACWSL-LBPRGKRZSA-N 0 0 373.384 3.928 20 5 FHBDRN Cc1c(Cl)cccc1NC(=O)c1cc([N+](=O)[O-])ccc1SCCO ZINC000136039518 941123402 /nfs/dbraw/zinc/12/34/02/941123402.db2.gz IBKSWFPDEUYZJK-UHFFFAOYSA-N 0 0 366.826 3.893 20 5 FHBDRN NC(=O)[C@@H]1CCC[C@H](Nc2cc(Cl)c(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000150901376 941123958 /nfs/dbraw/zinc/12/39/58/941123958.db2.gz LTWMNTCHZXSYGA-SFYZADRCSA-N 0 0 365.739 3.723 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H](C)c1cn(-c2ccccc2)nn1 ZINC000181337289 941124647 /nfs/dbraw/zinc/12/46/47/941124647.db2.gz IEWKOJZBFWVPDB-GJZGRUSLSA-N 0 0 351.410 3.896 20 5 FHBDRN CC1(C(=O)N2CCc3c(Br)ccc([N+](=O)[O-])c3C2)CC=CC1 ZINC000935875013 941125249 /nfs/dbraw/zinc/12/52/49/941125249.db2.gz JOIGNYGREFTQGT-UHFFFAOYSA-N 0 0 365.227 3.598 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)Nc2cccc(C)c2Br)c1 ZINC000122183629 941131606 /nfs/dbraw/zinc/13/16/06/941131606.db2.gz ZLHCPKYHWSZGAI-UHFFFAOYSA-N 0 0 365.183 3.927 20 5 FHBDRN O=C(Nc1ccc(OCc2ccccc2)cc1[N+](=O)[O-])[C@H]1CCCCO1 ZINC000188970742 941135476 /nfs/dbraw/zinc/13/54/76/941135476.db2.gz RKHNSGVEJCGAFR-GOSISDBHSA-N 0 0 356.378 3.681 20 5 FHBDRN CO[C@@H](C)CCC(=O)Nc1ccc(OCc2ccccc2)cc1[N+](=O)[O-] ZINC000188971101 941135488 /nfs/dbraw/zinc/13/54/88/941135488.db2.gz ZZXDMYTWMMAGGL-AWEZNQCLSA-N 0 0 358.394 3.927 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])N[C@@H](C1CCCC1)C(F)(F)F ZINC000177636047 941141486 /nfs/dbraw/zinc/14/14/86/941141486.db2.gz ZXTDSGXUUDAKCQ-HNNXBMFYSA-N 0 0 360.332 3.601 20 5 FHBDRN O=[N+]([O-])c1cnc(N[C@@H]2CCCC23CCOCC3)c(Br)c1 ZINC000407952594 941152520 /nfs/dbraw/zinc/15/25/20/941152520.db2.gz INZVTBNGSIHVAL-GFCCVEGCSA-N 0 0 356.220 3.514 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)Nc1ccc2nnc(C(C)C)n2c1 ZINC000189237534 941155181 /nfs/dbraw/zinc/15/51/81/941155181.db2.gz OEIIKJAJFNWLMI-UHFFFAOYSA-N 0 0 367.409 3.938 20 5 FHBDRN CCOC(=O)c1c(C2CC2)csc1NC(=O)c1ccc([N+](=O)[O-])o1 ZINC000072499264 941155189 /nfs/dbraw/zinc/15/51/89/941155189.db2.gz LAPCOSFSNLJMFC-UHFFFAOYSA-N 0 0 350.352 3.556 20 5 FHBDRN CC[C@](C)(O)CN(Cc1ccccc1)C(=O)Cc1cccc([N+](=O)[O-])c1C ZINC000189459083 941158240 /nfs/dbraw/zinc/15/82/40/941158240.db2.gz SPUVTNUHOQBNBA-NRFANRHFSA-N 0 0 370.449 3.636 20 5 FHBDRN COCCc1ccccc1NC(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000189478923 941158970 /nfs/dbraw/zinc/15/89/70/941158970.db2.gz HGTBPXOBIIRQGJ-UHFFFAOYSA-N 0 0 363.801 3.759 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N1CC=C(c2ccccc2F)C1 ZINC000541066680 941159632 /nfs/dbraw/zinc/15/96/32/941159632.db2.gz NPUYOFQZHOVHMH-UHFFFAOYSA-N 0 0 357.341 3.674 20 5 FHBDRN CCCN(Cc1ccccc1)C(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000072516101 941163927 /nfs/dbraw/zinc/16/39/27/941163927.db2.gz NWEGQBDXTADSGL-UHFFFAOYSA-N 0 0 358.394 3.664 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CCOc3c(C)cccc32)c1 ZINC000189595453 941213291 /nfs/dbraw/zinc/21/32/91/941213291.db2.gz SRLSNRZRVITUHI-OAHLLOKOSA-N 0 0 358.419 3.879 20 5 FHBDRN CCSc1cc(CNCc2cc([N+](=O)[O-])ccc2OC(F)F)ccn1 ZINC000189599579 941214441 /nfs/dbraw/zinc/21/44/41/941214441.db2.gz FNWDXEVTPPDOFK-UHFFFAOYSA-N 0 0 369.393 3.993 20 5 FHBDRN CC(=O)c1ccc(NC[C@](C)(Cc2ccccc2)[C@@H](C)O)c([N+](=O)[O-])c1 ZINC000189652580 941242554 /nfs/dbraw/zinc/24/25/54/941242554.db2.gz ZBPYITLDYDFSJN-QRWLVFNGSA-N 0 0 356.422 3.839 20 5 FHBDRN C[C@H](Nc1ccc(C(N)=O)cc1[N+](=O)[O-])c1ccc(OC(F)(F)F)cc1 ZINC000189694762 941263457 /nfs/dbraw/zinc/26/34/57/941263457.db2.gz HTBDZPPXPGYIQW-VIFPVBQESA-N 0 0 369.299 3.765 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)NCC1(Cc2ccccc2)CC1 ZINC000178474109 941263809 /nfs/dbraw/zinc/26/38/09/941263809.db2.gz LECLECRFKUMCNL-UHFFFAOYSA-N 0 0 353.422 3.759 20 5 FHBDRN O=C(CCc1ccc(OC(F)F)cc1)Nc1ccc(F)c([N+](=O)[O-])c1 ZINC000122226627 941263916 /nfs/dbraw/zinc/26/39/16/941263916.db2.gz ZSFQTACYDIMRQQ-UHFFFAOYSA-N 0 0 354.284 3.907 20 5 FHBDRN Cc1ccc(-c2cc(C(=O)N3CCc4c3cccc4[N+](=O)[O-])n[nH]2)c(C)c1 ZINC000189718081 941266954 /nfs/dbraw/zinc/26/69/54/941266954.db2.gz FGOOADPKLBSDGR-UHFFFAOYSA-N 0 0 362.389 3.805 20 5 FHBDRN CC(C)NC(=O)c1ccc(NCc2ccnc(OC(C)C)c2)c([N+](=O)[O-])c1 ZINC000189728583 941269077 /nfs/dbraw/zinc/26/90/77/941269077.db2.gz HYBAKTXJSKPVRL-UHFFFAOYSA-N 0 0 372.425 3.527 20 5 FHBDRN COc1cc(C(=O)Nc2cccc(-c3ncco3)c2)cc([N+](=O)[O-])c1C ZINC000189750614 941270985 /nfs/dbraw/zinc/27/09/85/941270985.db2.gz KMFDUQMKADGAGS-UHFFFAOYSA-N 0 0 353.334 3.819 20 5 FHBDRN COc1ccc(OCCN2CCC[C@@H]2c2csc(C)n2)c([N+](=O)[O-])c1 ZINC000189749085 941271166 /nfs/dbraw/zinc/27/11/66/941271166.db2.gz YTZJFIAUNAFQCN-OAHLLOKOSA-N 0 0 363.439 3.584 20 5 FHBDRN Cc1ccc(C)c(S(=O)(=O)N2CCC[C@H]2c2cccs2)c1[N+](=O)[O-] ZINC000189803157 941279728 /nfs/dbraw/zinc/27/97/28/941279728.db2.gz UNSZTQNUIXDRKH-ZDUSSCGKSA-N 0 0 366.464 3.799 20 5 FHBDRN Cc1cc(C(=O)N2CC3(CCOCC3)c3ccccc32)cc([N+](=O)[O-])c1 ZINC000189807203 941280963 /nfs/dbraw/zinc/28/09/63/941280963.db2.gz PZWAVVIRLHFFMP-UHFFFAOYSA-N 0 0 352.390 3.612 20 5 FHBDRN Cc1sc(C(=O)N2CC3(CCOCC3)c3ccccc32)cc1[N+](=O)[O-] ZINC000189855799 941290107 /nfs/dbraw/zinc/29/01/07/941290107.db2.gz PTUBZWQMVOLBDZ-UHFFFAOYSA-N 0 0 358.419 3.673 20 5 FHBDRN COC[C@@H](C)n1ccc(NCc2ccc(-c3ccccc3[N+](=O)[O-])o2)n1 ZINC000189862567 941290272 /nfs/dbraw/zinc/29/02/72/941290272.db2.gz WCICWGBJVYDBIJ-CYBMUJFWSA-N 0 0 356.382 3.871 20 5 FHBDRN Cc1ccc(C)c(S(=O)(=O)N(C)[C@@H](C)c2cccs2)c1[N+](=O)[O-] ZINC000189863286 941290478 /nfs/dbraw/zinc/29/04/78/941290478.db2.gz AKQSIZDJJLZBRY-LBPRGKRZSA-N 0 0 354.453 3.655 20 5 FHBDRN COC[C@H](C)n1ccc(NCc2csc(-c3cccc([N+](=O)[O-])c3)n2)n1 ZINC000189852379 941290506 /nfs/dbraw/zinc/29/05/06/941290506.db2.gz XCEVHDHMGJKQIU-LBPRGKRZSA-N 0 0 373.438 3.734 20 5 FHBDRN COc1ccc(CCCN(C)C(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)cc1 ZINC000189890594 941294568 /nfs/dbraw/zinc/29/45/68/941294568.db2.gz AJRCSJYKYTWQTC-UHFFFAOYSA-N 0 0 372.421 3.625 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H]1CCOc2c(C)cccc21 ZINC000189903144 941296702 /nfs/dbraw/zinc/29/67/02/941296702.db2.gz YGQRISAHQCQVDZ-CQSZACIVSA-N 0 0 357.366 3.557 20 5 FHBDRN COc1ccccc1[C@@H](NC(=O)c1csc([N+](=O)[O-])c1)c1ccco1 ZINC000178823880 941307387 /nfs/dbraw/zinc/30/73/87/941307387.db2.gz PYAAXVOTORZSHS-MRXNPFEDSA-N 0 0 358.375 3.777 20 5 FHBDRN O=C(c1ccc(-n2ccnc2)cc1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000178833725 941311595 /nfs/dbraw/zinc/31/15/95/941311595.db2.gz DICJGCFCDBMCLI-UHFFFAOYSA-N 0 0 362.389 3.585 20 5 FHBDRN CC(C)c1ccc(C(=O)NCCc2nc3cc(F)ccc3[nH]2)cc1[N+](=O)[O-] ZINC000189967852 941317074 /nfs/dbraw/zinc/31/70/74/941317074.db2.gz GHLWSZAPXWOQGO-UHFFFAOYSA-N 0 0 370.384 3.706 20 5 FHBDRN O=C(NCCc1ccc(F)cc1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000179038056 941332474 /nfs/dbraw/zinc/33/24/74/941332474.db2.gz CRYGAYNRSJIUKY-UHFFFAOYSA-N 0 0 357.385 3.651 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1CNc1cccc([C@@H](C)C(=O)OC)c1 ZINC000414484378 941348988 /nfs/dbraw/zinc/34/89/88/941348988.db2.gz HAOBZLXTFASGCX-CYBMUJFWSA-N 0 0 358.394 3.882 20 5 FHBDRN C[C@H](NC(=O)Cc1cc(Cl)cc2c1OCC2)c1ccc([N+](=O)[O-])cc1 ZINC000452182748 941367342 /nfs/dbraw/zinc/36/73/42/941367342.db2.gz IVRYSSCIOMSYCU-NSHDSACASA-N 0 0 360.797 3.603 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1CNc1cccc([C@H]2CCC(=O)N2)c1 ZINC000414535456 941375612 /nfs/dbraw/zinc/37/56/12/941375612.db2.gz IDDNSOAHHPNCRT-QGZVFWFLSA-N 0 0 355.394 3.557 20 5 FHBDRN COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N(C)CC(F)F)cc1 ZINC000103397322 941381731 /nfs/dbraw/zinc/38/17/31/941381731.db2.gz ISARPXRCFNFKDK-UHFFFAOYSA-N 0 0 366.320 3.733 20 5 FHBDRN Cc1ccc2cccc(OS(=O)(=O)c3ccc(C)c([N+](=O)[O-])c3)c2n1 ZINC000023863413 941382937 /nfs/dbraw/zinc/38/29/37/941382937.db2.gz GRIIWLTVQPGPOV-UHFFFAOYSA-N 0 0 358.375 3.528 20 5 FHBDRN CN(C)c1ccc(N(C)C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)cc1 ZINC000103415634 941400391 /nfs/dbraw/zinc/40/03/91/941400391.db2.gz JKQADQAEPBEZOV-UHFFFAOYSA-N 0 0 368.437 3.538 20 5 FHBDRN CN(c1ccccc1)c1ccc(C[N@@H+]2CC[C@](C)(C(=O)[O-])C2)cc1[N+](=O)[O-] ZINC000414652782 941425809 /nfs/dbraw/zinc/42/58/09/941425809.db2.gz HHNKTSIVHXSHAS-FQEVSTJZSA-N 0 0 369.421 3.659 20 5 FHBDRN C[C@@H](COc1ccccc1)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000122285942 941427246 /nfs/dbraw/zinc/42/72/46/941427246.db2.gz JBARHLQGQKBKLR-NSHDSACASA-N 0 0 366.320 3.850 20 5 FHBDRN O=C([O-])[C@H]1CCCC[N@@H+]1Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000414677202 941434309 /nfs/dbraw/zinc/43/43/09/941434309.db2.gz HVNXSRABXVXRFR-MRXNPFEDSA-N 0 0 374.368 3.965 20 5 FHBDRN O=[N+]([O-])c1cc(F)cnc1-c1noc(-c2ccncc2-c2ccccc2)n1 ZINC001213065337 941435713 /nfs/dbraw/zinc/43/57/13/941435713.db2.gz KZXTVBGNCFLCTQ-UHFFFAOYSA-N 0 0 363.308 3.908 20 5 FHBDRN O=C(Nc1cc2c(cc1Cl)OCO2)c1c(Cl)cccc1[N+](=O)[O-] ZINC000110187102 941454243 /nfs/dbraw/zinc/45/42/43/941454243.db2.gz QMLZURBILQAUKD-UHFFFAOYSA-N 0 0 355.133 3.883 20 5 FHBDRN Cc1cc(N[C@H]2c3ccccc3C[C@@H]2O)c(Br)cc1[N+](=O)[O-] ZINC000302657872 941457080 /nfs/dbraw/zinc/45/70/80/941457080.db2.gz HQVCLKCZJHCEBL-HOTGVXAUSA-N 0 0 363.211 3.736 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])s1)N1CCC[C@H](Cn2cnc3ccccc32)C1 ZINC000376939671 941470763 /nfs/dbraw/zinc/47/07/63/941470763.db2.gz ASGBHRZBHKNBRB-ZDUSSCGKSA-N 0 0 370.434 3.558 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CC=C(c2cccnc2)CC1 ZINC000376950281 941475507 /nfs/dbraw/zinc/47/55/07/941475507.db2.gz RGJAVCLKGCXWDC-QGZVFWFLSA-N 0 0 365.433 3.874 20 5 FHBDRN Cc1cc(N2CCCC[C@H]2c2nnc([C@H]3CCCO3)o2)ccc1[N+](=O)[O-] ZINC000377159346 941536747 /nfs/dbraw/zinc/53/67/47/941536747.db2.gz QTURTXRQILWDRZ-JKSUJKDBSA-N 0 0 358.398 3.869 20 5 FHBDRN CC(=O)Nc1ccc(NC(=O)CSc2ccccc2[N+](=O)[O-])cc1C ZINC000892770608 941537512 /nfs/dbraw/zinc/53/75/12/941537512.db2.gz NDURJKCMQRRKMM-UHFFFAOYSA-N 0 0 359.407 3.592 20 5 FHBDRN Cc1c(C(=O)N2CCC[C@@H]2c2cccc3c2OCCO3)cccc1[N+](=O)[O-] ZINC000066772165 941540589 /nfs/dbraw/zinc/54/05/89/941540589.db2.gz YPUBQDQKVFJEBP-QGZVFWFLSA-N 0 0 368.389 3.652 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N1CCC[C@@H]1c1cccc2c1OCCO2 ZINC000066769419 941541009 /nfs/dbraw/zinc/54/10/09/941541009.db2.gz FYISRCXPHMBLQJ-QGZVFWFLSA-N 0 0 368.389 3.652 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1CN[C@@H]1CC(C)(C)Oc2ccc(N)cc21 ZINC000415035216 941558162 /nfs/dbraw/zinc/55/81/62/941558162.db2.gz LVYZOENMWMMQQT-QGZVFWFLSA-N 0 0 371.437 3.968 20 5 FHBDRN CC1=C(c2ccco2)CN([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)CC1 ZINC000549162249 941560417 /nfs/dbraw/zinc/56/04/17/941560417.db2.gz OLVRYFFSJVFEOY-CQSZACIVSA-N 0 0 355.394 3.694 20 5 FHBDRN Cc1nc(C(C)C)ccc1C(=O)Nc1ccnn1-c1ccc([N+](=O)[O-])cc1 ZINC001125857058 941579531 /nfs/dbraw/zinc/57/95/31/941579531.db2.gz GPHBRLQXBMLBCA-UHFFFAOYSA-N 0 0 365.393 3.860 20 5 FHBDRN CCC(C)(C)c1ccc(NC(=O)C(=O)Nc2cc(F)cc([N+](=O)[O-])c2)cc1 ZINC000472696310 941594416 /nfs/dbraw/zinc/59/44/16/941594416.db2.gz ZJJASIGFHQUAAF-UHFFFAOYSA-N 0 0 373.384 3.999 20 5 FHBDRN COCCCCNC(=O)c1cc([N+](=O)[O-])ccc1SC1CCCC1 ZINC000136165228 941599974 /nfs/dbraw/zinc/59/99/74/941599974.db2.gz BOYVVVYSOACOQX-UHFFFAOYSA-N 0 0 352.456 3.786 20 5 FHBDRN Cc1cccc(NC[C@H](CO)Cc2cc(F)c(F)c(F)c2)c1[N+](=O)[O-] ZINC000549183420 941603695 /nfs/dbraw/zinc/60/36/95/941603695.db2.gz NJQASNDNOJAQPO-GFCCVEGCSA-N 0 0 354.328 3.584 20 5 FHBDRN O=C(CCc1cncnc1)N(Cc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000565553451 941615569 /nfs/dbraw/zinc/61/55/69/941615569.db2.gz DAHUSMVTWNYDTM-UHFFFAOYSA-N 0 0 362.389 3.551 20 5 FHBDRN CCCOCc1ccccc1CNC(=O)c1cc(OCC)ccc1[N+](=O)[O-] ZINC000549198091 941627278 /nfs/dbraw/zinc/62/72/78/941627278.db2.gz DGCRZGORUKZCHY-UHFFFAOYSA-N 0 0 372.421 3.850 20 5 FHBDRN O=C(c1cc2c(s1)CCOC2)N1CCCCc2cc([N+](=O)[O-])ccc21 ZINC000892857866 941627718 /nfs/dbraw/zinc/62/77/18/941627718.db2.gz ASMFGXUGWVVWRS-UHFFFAOYSA-N 0 0 358.419 3.712 20 5 FHBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N1CCC[C@H]1c1ccsc1 ZINC000146819715 941637830 /nfs/dbraw/zinc/63/78/30/941637830.db2.gz OBOIXUXAXIDVKU-LBPRGKRZSA-N 0 0 372.855 3.836 20 5 FHBDRN O=[N+]([O-])c1cc(F)cc(Oc2nn3cc(-c4cccnc4)nc3s2)c1 ZINC000541116095 941645854 /nfs/dbraw/zinc/64/58/54/941645854.db2.gz FCPUHCKNUSUTNF-UHFFFAOYSA-N 0 0 357.326 3.692 20 5 FHBDRN Cc1cnn([C@@H]2CCN(C(=O)c3cc([N+](=O)[O-])ccc3SC(C)C)C2)c1 ZINC000377329047 941652395 /nfs/dbraw/zinc/65/23/95/941652395.db2.gz FEEFZEFRSZFHRE-OAHLLOKOSA-N 0 0 374.466 3.687 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(NCc2ccc(OC(F)F)cc2)c1 ZINC000541115314 941656174 /nfs/dbraw/zinc/65/61/74/941656174.db2.gz PQYAHIARUPZYQV-UHFFFAOYSA-N 0 0 352.293 3.595 20 5 FHBDRN CC1(C)CC(=O)c2ccc(OCCOc3ccccc3[N+](=O)[O-])cc2O1 ZINC000541124259 941666997 /nfs/dbraw/zinc/66/69/97/941666997.db2.gz GMJKNALTLLVOCM-UHFFFAOYSA-N 0 0 357.362 3.796 20 5 FHBDRN C[C@H]1C[C@H](c2ccc(C(F)(F)F)cc2)N(C(=O)c2c[nH]nc2[N+](=O)[O-])C1 ZINC000549223306 941675253 /nfs/dbraw/zinc/67/52/53/941675253.db2.gz IFSAQFFJTWYZOE-TVQRCGJNSA-N 0 0 368.315 3.560 20 5 FHBDRN COc1cc2c(cc1F)CC[C@@H]2NC(=O)Nc1cc(F)cc([N+](=O)[O-])c1 ZINC000549230170 941684633 /nfs/dbraw/zinc/68/46/33/941684633.db2.gz KZPMVMWSXVQZTF-HNNXBMFYSA-N 0 0 363.320 3.691 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NC(C)(C)c2ccc(F)c(F)c2)c1 ZINC000549232202 941686530 /nfs/dbraw/zinc/68/65/30/941686530.db2.gz WKLMJQWQFLNNMO-UHFFFAOYSA-N 0 0 364.348 3.937 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CCSc3ncccc32)ccc1[N+](=O)[O-] ZINC000415227998 941688744 /nfs/dbraw/zinc/68/87/44/941688744.db2.gz LERVPXKNIFFSMM-UHFFFAOYSA-N 0 0 359.407 3.530 20 5 FHBDRN Cc1nc([C@@H]2CCCOC2)sc1C(=O)Nc1ccc(C)c([N+](=O)[O-])c1 ZINC000377399965 941692743 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FHBDRN CN(CC(=O)NC(C)(C)C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000120653897 941724332 /nfs/dbraw/zinc/72/43/32/941724332.db2.gz RSQJDVIEORQOKJ-UHFFFAOYSA-N 0 0 361.467 3.670 20 5 FHBDRN COc1ccc(CN(C)Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)cc1 ZINC000103457518 941735631 /nfs/dbraw/zinc/73/56/31/941735631.db2.gz UIWMTMNMEYEJHO-UHFFFAOYSA-N 0 0 352.394 3.556 20 5 FHBDRN Cc1cccc([C@@H](C)CNC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)c1 ZINC000445882398 941745927 /nfs/dbraw/zinc/74/59/27/941745927.db2.gz ADYUUBIALCYCJY-HNNXBMFYSA-N 0 0 353.422 3.775 20 5 FHBDRN NC(=O)c1ccc(CN2CC=C(c3ccccc3Cl)CC2)c([N+](=O)[O-])c1 ZINC000091858161 941766991 /nfs/dbraw/zinc/76/69/91/941766991.db2.gz LQFNSCBAOQJXEX-UHFFFAOYSA-N 0 0 371.824 3.636 20 5 FHBDRN C[C@H](NCc1coc(-c2ccc([N+](=O)[O-])cc2)n1)c1ccc2n[nH]cc2c1 ZINC000513195497 941770664 /nfs/dbraw/zinc/77/06/64/941770664.db2.gz CQNILUPNWYFCRB-LBPRGKRZSA-N 0 0 363.377 3.977 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CC[C@H](OC(F)F)C2)nc1-c1ccc(F)cc1 ZINC000549261086 941778676 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FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC12CCCCC2 ZINC000365589486 941806067 /nfs/dbraw/zinc/80/60/67/941806067.db2.gz TXLGYLXZCJVJLW-UHFFFAOYSA-N 0 0 364.467 3.882 20 5 FHBDRN CC[C@@H](Cc1ccccc1)N(C)C(=O)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC000412126656 941810141 /nfs/dbraw/zinc/81/01/41/941810141.db2.gz FFBYCDDJLPPHAK-HNNXBMFYSA-N 0 0 374.412 3.765 20 5 FHBDRN Cc1ccc([C@H](NC(=O)COc2cc(F)cc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000433655116 941815210 /nfs/dbraw/zinc/81/52/10/941815210.db2.gz VJDZLFYFEBUTHK-IBGZPJMESA-N 0 0 358.369 3.689 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C(=O)Nc2ccccc2C[S@](C)=O)cc1Cl ZINC001267660288 941819961 /nfs/dbraw/zinc/81/99/61/941819961.db2.gz IETJQOCFJWKASZ-DEOSSOPVSA-N 0 0 366.826 3.687 20 5 FHBDRN CC(C)(C)[C@H]1OCCC[C@H]1CNC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412133887 941831223 /nfs/dbraw/zinc/83/12/23/941831223.db2.gz ZFBHDRBUQPHADU-OWLYRPNTSA-N 0 0 360.454 3.656 20 5 FHBDRN CCCCN(C(=O)CCn1cc([N+](=O)[O-])cn1)[C@@H](CC)c1ccccc1 ZINC000513294205 941833016 /nfs/dbraw/zinc/83/30/16/941833016.db2.gz OJJIHKVKXOMXBZ-SFHVURJKSA-N 0 0 358.442 3.961 20 5 FHBDRN O=[N+]([O-])c1ccc([C@H](NC[C@@H](CO)c2ccc(F)cc2)C(F)(F)F)cc1 ZINC000584534173 941834694 /nfs/dbraw/zinc/83/46/94/941834694.db2.gz DWBUGFKULWHPIG-BBRMVZONSA-N 0 0 372.318 3.703 20 5 FHBDRN CC(=O)c1ccc(OS(=O)(=O)c2cc(Cl)c(C)c([N+](=O)[O-])c2)cc1 ZINC000019680389 941837296 /nfs/dbraw/zinc/83/72/96/941837296.db2.gz JEAKJKFZPOXGCF-UHFFFAOYSA-N 0 0 369.782 3.527 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N(Cc2ccc(Cl)cc2)C2CC2)c1[N+](=O)[O-] ZINC000433695937 941837566 /nfs/dbraw/zinc/83/75/66/941837566.db2.gz ZRMOYNKDTUDJNT-UHFFFAOYSA-N 0 0 362.817 3.900 20 5 FHBDRN CCOC(=O)c1cc(NC[C@H]2CCN(c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000433700444 941840103 /nfs/dbraw/zinc/84/01/03/941840103.db2.gz BXHCEZDXGVNSGG-OAHLLOKOSA-N 0 0 369.421 3.710 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N[C@H](C)Cc2cc(C)cc(C)c2)c1F ZINC000412143627 941841555 /nfs/dbraw/zinc/84/15/55/941841555.db2.gz JMDXCBXEYGPOMG-CQSZACIVSA-N 0 0 374.412 3.649 20 5 FHBDRN CN(C(=O)CSc1ccc(N)cc1Cl)c1ccc([N+](=O)[O-])cc1 ZINC000513300540 941843324 /nfs/dbraw/zinc/84/33/24/941843324.db2.gz KIOJQZSULCEMFN-UHFFFAOYSA-N 0 0 351.815 3.586 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)NC[C@@H](c1ccccc1)C1CC1 ZINC000431846686 941853664 /nfs/dbraw/zinc/85/36/64/941853664.db2.gz TTWVQFMMKIQMIC-IBGZPJMESA-N 0 0 353.422 3.630 20 5 FHBDRN Cc1noc([C@H](NC/C=C/c2ccccc2[N+](=O)[O-])c2ccccc2)n1 ZINC000377630101 941856108 /nfs/dbraw/zinc/85/61/08/941856108.db2.gz XHJPCDNAZPVYLB-JGZYNSJSSA-N 0 0 350.378 3.679 20 5 FHBDRN CCOc1cc(C(=O)N2CCC[C@H](C(C)C)CC2)c([N+](=O)[O-])cc1OC ZINC000513329394 941856125 /nfs/dbraw/zinc/85/61/25/941856125.db2.gz CVXIZQPPZPISHC-AWEZNQCLSA-N 0 0 364.442 3.900 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N(Cc2ccc(F)cc2)CC2CC2)c1[N+](=O)[O-] ZINC000433741449 941860580 /nfs/dbraw/zinc/86/05/80/941860580.db2.gz HXMYZMKJIZCSRC-UHFFFAOYSA-N 0 0 360.389 3.633 20 5 FHBDRN CCS[C@@H]1CCC[C@H]1NC(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1 ZINC000412174258 941863524 /nfs/dbraw/zinc/86/35/24/941863524.db2.gz XNZMMNLTMSYPAH-CZUORRHYSA-N 0 0 352.456 3.786 20 5 FHBDRN CCN(Cc1ccc(OC)c(OC)c1)C(=O)/C=C/c1ccc([N+](=O)[O-])cc1 ZINC000020013379 941866375 /nfs/dbraw/zinc/86/63/75/941866375.db2.gz TWXNOCNPSOXCHW-XYOKQWHBSA-N 0 0 370.405 3.674 20 5 FHBDRN C[C@H]([C@H]1Cc2ccccc2O1)N(C)C(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000119216553 941870593 /nfs/dbraw/zinc/87/05/93/941870593.db2.gz BZMAMSRRSXFPDO-CWTRNNRKSA-N 0 0 365.389 3.540 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])c(Cl)c1)N1CCC(c2ccc(O)cc2)CC1 ZINC000119195271 941872928 /nfs/dbraw/zinc/87/29/28/941872928.db2.gz OLKDUPFRVKJCKN-UHFFFAOYSA-N 0 0 360.797 3.974 20 5 FHBDRN CC(C)(CNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21)Oc1ccccc1 ZINC000513356421 941874443 /nfs/dbraw/zinc/87/44/43/941874443.db2.gz FGRYZXQIBYJWOJ-UHFFFAOYSA-N 0 0 367.405 3.523 20 5 FHBDRN CC[C@H]1CCCC[C@@H]1N(C)C(=O)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC000412186439 941884392 /nfs/dbraw/zinc/88/43/92/941884392.db2.gz SAQBEFYETRGKGG-JSGCOSHPSA-N 0 0 352.406 3.712 20 5 FHBDRN CN(Cc1cc(F)ccc1[N+](=O)[O-])[C@@H](c1ccc(F)cc1)c1cnccn1 ZINC000377669304 941884994 /nfs/dbraw/zinc/88/49/94/941884994.db2.gz KUMCLIHSVLSQSZ-IBGZPJMESA-N 0 0 370.359 3.884 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NC(C)(C)c2nc(C)c(C)s2)c1 ZINC000549300506 941886466 /nfs/dbraw/zinc/88/64/66/941886466.db2.gz KYXHTKZTGIANCJ-UHFFFAOYSA-N 0 0 363.439 3.732 20 5 FHBDRN O=C1CCCN1C[C@H](NCc1c(Cl)cccc1[N+](=O)[O-])c1ccccc1 ZINC000119657230 941896261 /nfs/dbraw/zinc/89/62/61/941896261.db2.gz NCRDPRCUMPEYCH-KRWDZBQOSA-N 0 0 373.840 3.702 20 5 FHBDRN CSc1cccc(NC(=O)Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)c1 ZINC000103463480 941900191 /nfs/dbraw/zinc/90/01/91/941900191.db2.gz VXOALRKCCQZFEF-UHFFFAOYSA-N 0 0 368.418 3.819 20 5 FHBDRN O=C(NCCCSc1ccccc1)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000119901446 941906093 /nfs/dbraw/zinc/90/60/93/941906093.db2.gz DYDSULRLFQQFFZ-UHFFFAOYSA-N 0 0 352.362 3.785 20 5 FHBDRN CCCN1C(=O)N=NC1SCc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000549307263 941908127 /nfs/dbraw/zinc/90/81/27/941908127.db2.gz OZFYMLMZHAJGNY-UHFFFAOYSA-N 0 0 362.333 3.613 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N[C@@H]1CCO[C@H]1c1ccc(Cl)cc1 ZINC000182427223 941923095 /nfs/dbraw/zinc/92/30/95/941923095.db2.gz KXNYZMWNYJSKIF-MJGOQNOKSA-N 0 0 374.824 3.827 20 5 FHBDRN O=C(N[C@@H]1CCO[C@H]1c1ccc(Cl)cc1)c1ccc(F)cc1[N+](=O)[O-] ZINC000182452911 941925917 /nfs/dbraw/zinc/92/59/17/941925917.db2.gz QYZLEDYKKRQNQZ-ZBFHGGJFSA-N 0 0 364.760 3.647 20 5 FHBDRN CC(C)Oc1cccc([C@@H](C)NC(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])c1 ZINC000433831242 941926537 /nfs/dbraw/zinc/92/65/37/941926537.db2.gz CDAAAAXVECUNLW-GFCCVEGCSA-N 0 0 360.414 3.720 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)Nc1cccc(COCc2ccco2)c1 ZINC000046683749 941932866 /nfs/dbraw/zinc/93/28/66/941932866.db2.gz ANHFYSNBEMBSSZ-UHFFFAOYSA-N 0 0 367.361 3.860 20 5 FHBDRN CCc1cc(N[C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)ccc1C ZINC000182482768 941933762 /nfs/dbraw/zinc/93/37/62/941933762.db2.gz MLQYJEVHEXHKBE-ZDUSSCGKSA-N 0 0 357.410 3.913 20 5 FHBDRN COc1ccc(C[C@@H](C)CNC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)cc1 ZINC000412225528 941940056 /nfs/dbraw/zinc/94/00/56/941940056.db2.gz WSBYRXOFNTUXQC-VOBQZIQPSA-N 0 0 368.433 3.702 20 5 FHBDRN CC[C@H](C)n1[nH]c(=NC(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)cc1C ZINC000412229316 941942416 /nfs/dbraw/zinc/94/24/16/941942416.db2.gz HJXAWCGUGAPUKY-LBPRGKRZSA-N 0 0 360.414 3.532 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1F)N1CC[C@@](F)(c2ccccc2F)C1 ZINC000549320504 941943403 /nfs/dbraw/zinc/94/34/03/941943403.db2.gz BKDDERBHWGJTMH-KRWDZBQOSA-N 0 0 350.296 3.584 20 5 FHBDRN CS[C@H]1CCCCN(C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000182574340 941945315 /nfs/dbraw/zinc/94/53/15/941945315.db2.gz ZJDGMNRDZWEFRL-NSHDSACASA-N 0 0 360.382 3.554 20 5 FHBDRN COc1ccc([C@@H](NC(=O)c2cccc([N+](=O)[O-])c2C)C(F)(F)F)cc1 ZINC000182588505 941945885 /nfs/dbraw/zinc/94/58/85/941945885.db2.gz NEDWMIZYYRCCJT-OAHLLOKOSA-N 0 0 368.311 3.945 20 5 FHBDRN C[C@@H](C[NH2+]Cc1cc([N+](=O)[O-])ccc1OC(F)F)N(C)c1ccccc1 ZINC000517536094 941947399 /nfs/dbraw/zinc/94/73/99/941947399.db2.gz RMDTUFWRGMYMOW-ZDUSSCGKSA-N 0 0 365.380 3.811 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N(C)[C@@H](C)c2ccc(F)c(F)c2)c1[N+](=O)[O-] ZINC000433849888 941948471 /nfs/dbraw/zinc/94/84/71/941948471.db2.gz VBQGTGYDZPIHAM-VIFPVBQESA-N 0 0 352.341 3.553 20 5 FHBDRN Cc1cc(C(=O)N2CCN([C@@H](C)c3cc([N+](=O)[O-])ccc3C)CC2)c(C)o1 ZINC000182690689 941952770 /nfs/dbraw/zinc/95/27/70/941952770.db2.gz XLZMQINWAANCCT-HNNXBMFYSA-N 0 0 371.437 3.632 20 5 FHBDRN COc1ccc2oc(C(=O)Nc3n[nH]c4ccc([N+](=O)[O-])cc43)c(C)c2c1 ZINC000122632336 941954666 /nfs/dbraw/zinc/95/46/66/941954666.db2.gz NEYGULVBATUTRT-UHFFFAOYSA-N 0 0 366.333 3.787 20 5 FHBDRN CN(c1nc(Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)cs1)C1CC1 ZINC000122627652 941954886 /nfs/dbraw/zinc/95/48/86/941954886.db2.gz INCKRYCETQFDEJ-UHFFFAOYSA-N 0 0 355.423 3.562 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CCO[C@H](C2CCCCC2)C1 ZINC000412249072 941964188 /nfs/dbraw/zinc/96/41/88/941964188.db2.gz JHNSKJXQWYPWQL-OTWHNJEPSA-N 0 0 358.438 3.506 20 5 FHBDRN CCn1ncc(NC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)c1C(F)(F)F ZINC000415634194 941965681 /nfs/dbraw/zinc/96/56/81/941965681.db2.gz ZGJUARIOZXBZSU-NWDGAFQWSA-N 0 0 368.315 3.572 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCN([C@H](C)c2cccnc2)CC1 ZINC000182807600 941970395 /nfs/dbraw/zinc/97/03/95/941970395.db2.gz YOJBYJLPGUSXRF-SJORKVTESA-N 0 0 354.454 3.738 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CCc3[nH]c4ccccc4c3C2)c1 ZINC000549329855 941972693 /nfs/dbraw/zinc/97/26/93/941972693.db2.gz PIJFMJSKUUOSFT-UHFFFAOYSA-N 0 0 365.389 3.673 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H]1CCCc2cc(N)ccc21 ZINC000415667670 941981801 /nfs/dbraw/zinc/98/18/01/941981801.db2.gz YKOJJTWOIGZDTA-MRXNPFEDSA-N 0 0 370.409 3.775 20 5 FHBDRN CCc1c(NC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)onc1C(F)(F)F ZINC000412253411 941985405 /nfs/dbraw/zinc/98/54/05/941985405.db2.gz IMRCWBSNUBCXGC-NWDGAFQWSA-N 0 0 369.299 3.906 20 5 FHBDRN CCC(CC)(CNC(=O)c1cc([N+](=O)[O-])cc(Br)c1C)OC ZINC000576852166 941995943 /nfs/dbraw/zinc/99/59/43/941995943.db2.gz ZCUPYKCKELMNRS-UHFFFAOYSA-N 0 0 373.247 3.601 20 5 FHBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)N1CC[C@@H](CC(F)(F)F)C1 ZINC000433923298 941998648 /nfs/dbraw/zinc/99/86/48/941998648.db2.gz YKGVAMCMEZWKFU-AWEZNQCLSA-N 0 0 373.375 3.901 20 5 FHBDRN O=[N+]([O-])c1ccc(Cc2noc(C3(c4ccccc4)CC(F)(F)C3)n2)nc1 ZINC000377799589 941999828 /nfs/dbraw/zinc/99/98/28/941999828.db2.gz WLGLAIWLGIVRDM-UHFFFAOYSA-N 0 0 372.331 3.679 20 5 FHBDRN CC(=O)Nc1c(C)ccc(NC(=O)NCc2cccc([N+](=O)[O-])c2C)c1C ZINC000616304925 942001072 /nfs/dbraw/zinc/00/10/72/942001072.db2.gz QOTCDDUPJDTUOB-UHFFFAOYSA-N 0 0 370.409 3.800 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1Cl)N1CCC(OCC2CC2)CC1 ZINC000377821349 942014188 /nfs/dbraw/zinc/01/41/88/942014188.db2.gz NJKZEMJSVVMALD-UHFFFAOYSA-N 0 0 353.806 3.671 20 5 FHBDRN O=C(Nc1n[nH]c2ccc([N+](=O)[O-])cc21)c1ccc(Br)s1 ZINC000122655180 942016149 /nfs/dbraw/zinc/01/61/49/942016149.db2.gz ABYSDMIPJBKHQE-UHFFFAOYSA-N 0 0 367.184 3.547 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1Cl)N1CCC[C@@H](OCC2CC2)C1 ZINC000377822722 942016332 /nfs/dbraw/zinc/01/63/32/942016332.db2.gz ZGQLTIFLBOHYOR-GFCCVEGCSA-N 0 0 353.806 3.671 20 5 FHBDRN Cc1ccccc1C[C@@H]1CCCN1C(=O)CNc1ccccc1[N+](=O)[O-] ZINC000513558605 942016482 /nfs/dbraw/zinc/01/64/82/942016482.db2.gz DEZYOCKRGALUKU-KRWDZBQOSA-N 0 0 353.422 3.549 20 5 FHBDRN O=C(N[C@H]1CCO[C@@H](c2ccccc2)C1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412272003 942020969 /nfs/dbraw/zinc/02/09/69/942020969.db2.gz PSGAOMGRUPQLMW-IJXRJRJASA-N 0 0 366.417 3.735 20 5 FHBDRN O=C(N[C@@H]1CCO[C@H](c2ccccc2)C1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412272005 942021177 /nfs/dbraw/zinc/02/11/77/942021177.db2.gz PSGAOMGRUPQLMW-MDNKFWRPSA-N 0 0 366.417 3.735 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N[C@H](C)CC(C)(C)c2ccccc2)c1[N+](=O)[O-] ZINC000433981595 942023639 /nfs/dbraw/zinc/02/36/39/942023639.db2.gz QWZOWRBCWKYBNC-CYBMUJFWSA-N 0 0 358.442 3.928 20 5 FHBDRN COc1ccc(OCc2ncc(-c3ccccc3OC)o2)c([N+](=O)[O-])c1 ZINC000377837781 942026725 /nfs/dbraw/zinc/02/67/25/942026725.db2.gz QWPBZJNLFQKNGZ-UHFFFAOYSA-N 0 0 356.334 3.846 20 5 FHBDRN O=c1cc(CSCc2c(Cl)cccc2[N+](=O)[O-])nc2sccn21 ZINC000162300708 942027743 /nfs/dbraw/zinc/02/77/43/942027743.db2.gz IMRFOXVTVFLCAA-UHFFFAOYSA-N 0 0 367.839 3.751 20 5 FHBDRN Cc1ccc([C@]2(C)CCN(C(=O)NCc3ccccc3[N+](=O)[O-])C2)cc1 ZINC000434003597 942029416 /nfs/dbraw/zinc/02/94/16/942029416.db2.gz UKONELAYERVDTB-HXUWFJFHSA-N 0 0 353.422 3.776 20 5 FHBDRN COc1cc(C(=O)N(C)Cc2cc(Cl)ccc2F)ccc1[N+](=O)[O-] ZINC000434004497 942029443 /nfs/dbraw/zinc/02/94/43/942029443.db2.gz TVVQXLODRJLKSV-UHFFFAOYSA-N 0 0 352.749 3.668 20 5 FHBDRN CN(Cc1cc(Cl)ccc1F)C(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000433993565 942032771 /nfs/dbraw/zinc/03/27/71/942032771.db2.gz NUHJTAJTUBFIGX-UHFFFAOYSA-N 0 0 366.776 3.815 20 5 FHBDRN COc1ccc(C(=O)N(C)Cc2cc(Cl)ccc2F)cc1[N+](=O)[O-] ZINC000433995770 942033444 /nfs/dbraw/zinc/03/34/44/942033444.db2.gz ZOQPIBCWYCQBLQ-UHFFFAOYSA-N 0 0 352.749 3.668 20 5 FHBDRN CC(C)S(=O)(=O)c1ccc(Cn2ccc3c2cccc3[N+](=O)[O-])cc1 ZINC000513598478 942033917 /nfs/dbraw/zinc/03/39/17/942033917.db2.gz TVYYAGKLWGTASA-UHFFFAOYSA-N 0 0 358.419 3.780 20 5 FHBDRN CN(Cc1cc(F)cc(F)c1)C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000433996964 942034110 /nfs/dbraw/zinc/03/41/10/942034110.db2.gz KSTDNVZGHSHCSS-UHFFFAOYSA-N 0 0 361.348 3.720 20 5 FHBDRN CC[C@@H](C)COc1cc([N+](=O)[O-])c(Cn2ccc(C)cc2=O)cc1OC ZINC000513622890 942044003 /nfs/dbraw/zinc/04/40/03/942044003.db2.gz ACMKPKRCPPDYLP-CYBMUJFWSA-N 0 0 360.410 3.547 20 5 FHBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)c1nc(-c2ccccc2)cs1 ZINC000513637701 942049947 /nfs/dbraw/zinc/04/99/47/942049947.db2.gz MGHGFAVFJPXEKQ-UHFFFAOYSA-N 0 0 353.403 3.691 20 5 FHBDRN Cc1nn(-c2ccccc2)cc1CNC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000183003228 942061067 /nfs/dbraw/zinc/06/10/67/942061067.db2.gz IPDGJKRERVXFFJ-UHFFFAOYSA-N 0 0 365.393 3.719 20 5 FHBDRN C[C@@H](NC(=O)c1ccc([N+](=O)[O-])[nH]1)c1cccc(OCc2ccccc2)c1 ZINC000434047806 942063946 /nfs/dbraw/zinc/06/39/46/942063946.db2.gz LBKFZONLSVBSNH-CQSZACIVSA-N 0 0 365.389 3.993 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](c2ccccn2)C2CCCC2)c1 ZINC000377911326 942066318 /nfs/dbraw/zinc/06/63/18/942066318.db2.gz NFCVQTHVWNGGTM-GOSISDBHSA-N 0 0 355.394 3.660 20 5 FHBDRN O=C(Cc1c(Cl)cccc1Cl)Nc1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000536251917 942072247 /nfs/dbraw/zinc/07/22/47/942072247.db2.gz BCBJRSAUTXRHBS-UHFFFAOYSA-N 0 0 365.176 3.959 20 5 FHBDRN CCOC(=O)CC[C@@H]1CCCN(c2ccc3ncccc3c2[N+](=O)[O-])C1 ZINC000128362370 942072270 /nfs/dbraw/zinc/07/22/70/942072270.db2.gz LJQURIFFGPUXJU-AWEZNQCLSA-N 0 0 357.410 3.703 20 5 FHBDRN CCOCCCn1c(-c2cccc([N+](=O)[O-])c2)nnc1N(C)C1CCCC1 ZINC000460772859 942074834 /nfs/dbraw/zinc/07/48/34/942074834.db2.gz SPKFWIIKCTVXGT-UHFFFAOYSA-N 0 0 373.457 3.659 20 5 FHBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCC[C@H](CO)C1 ZINC000412940140 942077708 /nfs/dbraw/zinc/07/77/08/942077708.db2.gz QWPWZVGIQIISFE-KBPBESRZSA-N 0 0 366.483 3.768 20 5 FHBDRN Cc1ccc2c(c1)CC[C@@H]2NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513680411 942079171 /nfs/dbraw/zinc/07/91/71/942079171.db2.gz OLOHIBQSMMYNDL-AWEZNQCLSA-N 0 0 362.332 3.922 20 5 FHBDRN Cc1c(CC(=O)N[C@H](c2ccccc2)C2CCOCC2)cccc1[N+](=O)[O-] ZINC000366627174 942080803 /nfs/dbraw/zinc/08/08/03/942080803.db2.gz LBWMSVGBWKAZBR-OAQYLSRUSA-N 0 0 368.433 3.730 20 5 FHBDRN CCS(=O)(=O)c1ccc(CN[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)s1 ZINC000280014728 942086317 /nfs/dbraw/zinc/08/63/17/942086317.db2.gz GXQQHIJKLCLJIG-LBPRGKRZSA-N 0 0 368.480 3.609 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)NCC(C)(C)c2cccnc2)cc1[N+](=O)[O-] ZINC000413358378 942091125 /nfs/dbraw/zinc/09/11/25/942091125.db2.gz KXAFXPRXJOLCHD-AWEZNQCLSA-N 0 0 356.426 3.636 20 5 FHBDRN CC(C)(C)OC(=O)[C@]1(C)CCN(c2ccc([N+](=O)[O-])c3cccnc32)C1 ZINC000413358379 942091256 /nfs/dbraw/zinc/09/12/56/942091256.db2.gz MPMGUYDHGOQVNN-LJQANCHMSA-N 0 0 357.410 3.701 20 5 FHBDRN CO[C@H]1c2ccccc2C[C@H]1NC(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000413357368 942091313 /nfs/dbraw/zinc/09/13/13/942091313.db2.gz JRYIDJQTFDLFSK-IRWQIABSSA-N 0 0 369.421 3.576 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C[C@@H](O)COc1ccc(C(C)(C)C)cc1 ZINC000501876644 942098719 /nfs/dbraw/zinc/09/87/19/942098719.db2.gz VEKQQQFFWBSMGA-GOSISDBHSA-N 0 0 372.465 3.764 20 5 FHBDRN CC1(C)CN(C(=O)COc2ccc([N+](=O)[O-])cc2)C[C@@H]1c1ccccc1 ZINC000434091031 942112730 /nfs/dbraw/zinc/11/27/30/942112730.db2.gz BRKUXGCLKSECAJ-GOSISDBHSA-N 0 0 354.406 3.626 20 5 FHBDRN CC(=O)c1ccc(OCC(=O)N2CCC[C@H]2c2ccsc2)c([N+](=O)[O-])c1 ZINC000366641324 942120625 /nfs/dbraw/zinc/12/06/25/942120625.db2.gz OZTJPDPTRUEQEC-HNNXBMFYSA-N 0 0 374.418 3.601 20 5 FHBDRN O=[N+]([O-])c1cncc(Br)c1N1CCC[C@H](CC(F)(F)F)C1 ZINC000420622159 942123665 /nfs/dbraw/zinc/12/36/65/942123665.db2.gz ISKQSEUVMXHMQZ-MRVPVSSYSA-N 0 0 368.153 3.921 20 5 FHBDRN O=C(c1ccc(N2CCCC2)c([N+](=O)[O-])c1)N1CC2(CCC2)[C@@H]1C1CC1 ZINC000365745897 942123725 /nfs/dbraw/zinc/12/37/25/942123725.db2.gz HBZLKPAOTDCHTP-SFHVURJKSA-N 0 0 355.438 3.600 20 5 FHBDRN CC(C)(C)c1ccc(NC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)c(O)c1 ZINC000501945104 942126030 /nfs/dbraw/zinc/12/60/30/942126030.db2.gz HKALKTKHZQJNOY-UHFFFAOYSA-N 0 0 358.350 3.579 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)c2ncsc2C(F)(F)F)cc1[N+](=O)[O-] ZINC000280198827 942133831 /nfs/dbraw/zinc/13/38/31/942133831.db2.gz DUXYYVMRDOXFRZ-MRVPVSSYSA-N 0 0 359.329 3.870 20 5 FHBDRN CO[C@](C)([C@@H](C)NC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-])C1CC1 ZINC000415914761 942139812 /nfs/dbraw/zinc/13/98/12/942139812.db2.gz BSVHCLJOSSGVLX-RFAUZJTJSA-N 0 0 360.332 3.547 20 5 FHBDRN COc1cccc(N2CC[C@@H](C(F)(F)F)C3(CCOCC3)C2)c1[N+](=O)[O-] ZINC000413394514 942141704 /nfs/dbraw/zinc/14/17/04/942141704.db2.gz HDDNIPGXUYICEQ-CQSZACIVSA-N 0 0 374.359 3.789 20 5 FHBDRN O=[N+]([O-])c1cnc(NC[C@@H]2CC23CCSCC3)c(Br)c1 ZINC000420651282 942143233 /nfs/dbraw/zinc/14/32/33/942143233.db2.gz JIRYHOBNPIFJFF-VIFPVBQESA-N 0 0 358.261 3.698 20 5 FHBDRN CC(C)NC(=O)c1ccc(N[C@H](C)c2nc3c(s2)CCC3)c([N+](=O)[O-])c1 ZINC000413397764 942143877 /nfs/dbraw/zinc/14/38/77/942143877.db2.gz QRLAJAAMKPZANQ-LLVKDONJSA-N 0 0 374.466 3.851 20 5 FHBDRN COC(=O)c1cc(C)nc(Nc2ccc(OC)c(SC)c2)c1[N+](=O)[O-] ZINC000413399936 942144480 /nfs/dbraw/zinc/14/44/80/942144480.db2.gz TZGJLXLRTKUMGF-UHFFFAOYSA-N 0 0 363.395 3.559 20 5 FHBDRN O=C(Nc1ccn(Cc2ccccc2)n1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000110230074 942147141 /nfs/dbraw/zinc/14/71/41/942147141.db2.gz ITEUZEYRLLZTFK-UHFFFAOYSA-N 0 0 356.769 3.745 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)C(F)(F)F)cc1NCCCC1(O)CCC1 ZINC000420640020 942147447 /nfs/dbraw/zinc/14/74/47/942147447.db2.gz QIHPOKJVDSSAFJ-UHFFFAOYSA-N 0 0 369.290 3.751 20 5 FHBDRN O=C(NC1CC1)c1ccc(N2CCC[C@H](CC(F)(F)F)C2)c([N+](=O)[O-])c1 ZINC000420640564 942148215 /nfs/dbraw/zinc/14/82/15/942148215.db2.gz YUIAFRFKOFKCLS-LLVKDONJSA-N 0 0 371.359 3.656 20 5 FHBDRN COc1ccc(OC)c(CC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1 ZINC000501989706 942155394 /nfs/dbraw/zinc/15/53/94/942155394.db2.gz IVWBNGKJGIXWTB-UHFFFAOYSA-N 0 0 372.421 3.592 20 5 FHBDRN C[C@@H](NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)c1ccc(F)c(F)c1 ZINC000513725937 942156192 /nfs/dbraw/zinc/15/61/92/942156192.db2.gz SWJGLOUNLRWBED-MRVPVSSYSA-N 0 0 372.274 3.965 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)N(C)[C@H]2CCC[C@@H](C)C2)cc1SC ZINC000102985508 942166584 /nfs/dbraw/zinc/16/65/84/942166584.db2.gz FLPBQVTUCAVKRF-NEPJUHHUSA-N 0 0 352.456 3.976 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)N2CC[C@H](c3ccccc3)C2)cc1SC ZINC000103003754 942171263 /nfs/dbraw/zinc/17/12/63/942171263.db2.gz SKSMQQJTXWLYAJ-AWEZNQCLSA-N 0 0 372.446 3.955 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)N(C)CCc2ccccc2)cc1SC ZINC000102993767 942175487 /nfs/dbraw/zinc/17/54/87/942175487.db2.gz KPEXLCYQOFKNCM-UHFFFAOYSA-N 0 0 360.435 3.640 20 5 FHBDRN CC(=O)c1ccc2c(c1)CN(C(=O)N[C@H](C)c1ccccc1[N+](=O)[O-])C2 ZINC000413438395 942185921 /nfs/dbraw/zinc/18/59/21/942185921.db2.gz PTQAPEBKCHYNDJ-GFCCVEGCSA-N 0 0 353.378 3.584 20 5 FHBDRN O=C(NC1CCC2(CCOCC2)CC1)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000378040664 942201458 /nfs/dbraw/zinc/20/14/58/942201458.db2.gz UGDAVEZFXCKMDG-UHFFFAOYSA-N 0 0 352.818 3.717 20 5 FHBDRN CN1CC[C@H](CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])c2ccccc21 ZINC000110239742 942203794 /nfs/dbraw/zinc/20/37/94/942203794.db2.gz XVWSNJIIZRIUPI-GFCCVEGCSA-N 0 0 359.813 3.602 20 5 FHBDRN C[C@H](N[C@H](c1ccn(C)n1)c1ccc(F)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000366691968 942204132 /nfs/dbraw/zinc/20/41/32/942204132.db2.gz CLGNLUKWUDKPNN-DJJJIMSYSA-N 0 0 354.385 3.908 20 5 FHBDRN CS[C@H](C)CNC(=O)c1ccc(N2C[C@@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000502079404 942207489 /nfs/dbraw/zinc/20/74/89/942207489.db2.gz NOJOLNRCKVYLKW-MELADBBJSA-N 0 0 365.499 3.558 20 5 FHBDRN CCOc1ccc(SCC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])cc1 ZINC000016168365 942208711 /nfs/dbraw/zinc/20/87/11/942208711.db2.gz ZSWYIUXRRHZCJP-UHFFFAOYSA-N 0 0 362.407 3.733 20 5 FHBDRN C[C@H](CNC(=O)NCc1ccc([N+](=O)[O-])cc1Cl)CC(F)(F)F ZINC000413450032 942210161 /nfs/dbraw/zinc/21/01/61/942210161.db2.gz HDPWVFFCAZPMGF-QMMMGPOBSA-N 0 0 353.728 3.636 20 5 FHBDRN Cc1c(CNC(=O)N2CCC[C@H](CC(F)(F)F)C2)cccc1[N+](=O)[O-] ZINC000420834998 942218484 /nfs/dbraw/zinc/21/84/84/942218484.db2.gz ICHOHQDVGZUEMK-GFCCVEGCSA-N 0 0 359.348 3.777 20 5 FHBDRN COC(=O)c1nc([C@H]2CCCN2Cc2csc([N+](=O)[O-])c2)sc1C ZINC000280631240 942222091 /nfs/dbraw/zinc/22/20/91/942222091.db2.gz YWPKKUZTGQPXBA-LLVKDONJSA-N 0 0 367.452 3.545 20 5 FHBDRN COc1ccc(CN(C)[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1C ZINC000103144768 942223743 /nfs/dbraw/zinc/22/37/43/942223743.db2.gz UPVNHXRHGKRBAV-OAHLLOKOSA-N 0 0 371.437 3.679 20 5 FHBDRN COc1ccc(CN(C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1C ZINC000103145330 942224095 /nfs/dbraw/zinc/22/40/95/942224095.db2.gz JXXDAQGQGITYGK-UHFFFAOYSA-N 0 0 368.393 3.594 20 5 FHBDRN O=C(NCC1(C2CC2)CCC1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000502099182 942225555 /nfs/dbraw/zinc/22/55/55/942225555.db2.gz KBWZQXWTBNWAIE-UHFFFAOYSA-N 0 0 353.216 3.667 20 5 FHBDRN COc1cc(C(=O)N2CC[C@H](c3ccccc3F)C2)cc([N+](=O)[O-])c1C ZINC000502105082 942228091 /nfs/dbraw/zinc/22/80/91/942228091.db2.gz MIDWVUXPLZWQJY-ZDUSSCGKSA-N 0 0 358.369 3.681 20 5 FHBDRN Cc1ccc(-c2cc(C(=O)N3CCc4ccc([N+](=O)[O-])cc43)n[nH]2)c(C)c1 ZINC000187825369 942228169 /nfs/dbraw/zinc/22/81/69/942228169.db2.gz VBPUQKOZEVJBPO-UHFFFAOYSA-N 0 0 362.389 3.805 20 5 FHBDRN O=C(NCc1ccccc1Cl)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513731210 942238553 /nfs/dbraw/zinc/23/85/53/942238553.db2.gz SVGOEHSUWCUDDV-UHFFFAOYSA-N 0 0 356.712 3.780 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CSc1ccc(N)cc1Cl ZINC000502121126 942241613 /nfs/dbraw/zinc/24/16/13/942241613.db2.gz GSWQIBBZOBXJMT-UHFFFAOYSA-N 0 0 351.815 3.870 20 5 FHBDRN C[C@H](NC(=O)N1CC[C@@H](c2ccccc2F)C1)c1cccc([N+](=O)[O-])c1 ZINC000502123087 942241848 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FHBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N(C)[C@H]1CCCC[C@H]1c1ccccc1 ZINC000416008682 942258972 /nfs/dbraw/zinc/25/89/72/942258972.db2.gz MPKAYSHIHUOPMY-ROUUACIJSA-N 0 0 370.453 3.675 20 5 FHBDRN CCCCC[C@@H]1CCCN1S(=O)(=O)CCc1ccccc1[N+](=O)[O-] ZINC000501014814 942263090 /nfs/dbraw/zinc/26/30/90/942263090.db2.gz RGUXTCNKNZFHFI-MRXNPFEDSA-N 0 0 354.472 3.512 20 5 FHBDRN CCNc1ccc(C(=O)Nc2ccc([C@H](C)C(=O)OC)cc2)cc1[N+](=O)[O-] ZINC000416014724 942263473 /nfs/dbraw/zinc/26/34/73/942263473.db2.gz OQVFWVYMOCKAHZ-LBPRGKRZSA-N 0 0 371.393 3.555 20 5 FHBDRN O=C(Nc1ccc(O[C@H]2CCOC2)cc1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000128410035 942272118 /nfs/dbraw/zinc/27/21/18/942272118.db2.gz KDDJYZHLRYZHLV-AWEZNQCLSA-N 0 0 362.769 3.668 20 5 FHBDRN CCOC(=O)c1csc(CSCCc2ccc([N+](=O)[O-])cc2)n1 ZINC000419477935 942273218 /nfs/dbraw/zinc/27/32/18/942273218.db2.gz LYOIXDHSWLWMEF-UHFFFAOYSA-N 0 0 352.437 3.704 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)N(C)[C@H]2CCCC[C@@H]2c2ccccc2)n1 ZINC000416021679 942273488 /nfs/dbraw/zinc/27/34/88/942273488.db2.gz YSHSTEVEBKMALK-CVEARBPZSA-N 0 0 356.426 3.610 20 5 FHBDRN CCc1nc(C)c(NC(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)s1 ZINC000584553734 942276269 /nfs/dbraw/zinc/27/62/69/942276269.db2.gz DEJVEQYRXIUZTJ-UHFFFAOYSA-N 0 0 373.438 3.768 20 5 FHBDRN Cc1ncsc1CCC(=O)N1CCS[C@@H]1c1ccc([N+](=O)[O-])cc1 ZINC000413505894 942280443 /nfs/dbraw/zinc/28/04/43/942280443.db2.gz AQKQNTCXHWGGRK-MRXNPFEDSA-N 0 0 363.464 3.567 20 5 FHBDRN Cn1ccnc1SCc1ccc(C(=O)OCc2ccc([N+](=O)[O-])cc2)o1 ZINC000126323487 942282642 /nfs/dbraw/zinc/28/26/42/942282642.db2.gz YDJTUJPGJIWXFU-UHFFFAOYSA-N 0 0 373.390 3.571 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CCOc2ccc(Cl)cc21 ZINC000413513599 942289841 /nfs/dbraw/zinc/28/98/41/942289841.db2.gz MDPZBKGMTRQHIW-LSDHHAIUSA-N 0 0 358.781 3.777 20 5 FHBDRN CC(C)(C)c1ccc(NC(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)cc1 ZINC000015630826 942290169 /nfs/dbraw/zinc/29/01/69/942290169.db2.gz ZZEGGXBNIZTFAW-UHFFFAOYSA-N 0 0 365.393 3.725 20 5 FHBDRN O=C(OCc1nc(-c2ccsc2)no1)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000015644290 942291819 /nfs/dbraw/zinc/29/18/19/942291819.db2.gz WBXAXOIGSMTYRK-UHFFFAOYSA-N 0 0 365.754 3.717 20 5 FHBDRN C[C@@H](OC(=O)c1cc([N+](=O)[O-])ccc1Cl)C(=O)Nc1cccc(F)c1 ZINC000015650768 942292391 /nfs/dbraw/zinc/29/23/91/942292391.db2.gz WWTAMJDKLCBOLR-SECBINFHSA-N 0 0 366.732 3.571 20 5 FHBDRN CO[C@@H](CNC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C)CC(C)C ZINC000419520700 942299158 /nfs/dbraw/zinc/29/91/58/942299158.db2.gz QIEFGEKMFMPBLC-QGZVFWFLSA-N 0 0 351.447 3.576 20 5 FHBDRN O=[N+]([O-])c1ccc(N2C[C@@H](O)C[C@H]2c2ccccc2)cc1C(F)(F)F ZINC000413513014 942300386 /nfs/dbraw/zinc/30/03/86/942300386.db2.gz YFDBBXXEJQIIJX-BBRMVZONSA-N 0 0 352.312 3.926 20 5 FHBDRN O=C(NCc1nccs1)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 ZINC000136285583 942300582 /nfs/dbraw/zinc/30/05/82/942300582.db2.gz LFUFICWTZZCJBN-UHFFFAOYSA-N 0 0 368.418 3.593 20 5 FHBDRN C[C@H]1CCN(C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)CCS1 ZINC000501110490 942302833 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FHBDRN O=C(Nc1cc(F)c(F)cc1F)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513739575 942315411 /nfs/dbraw/zinc/31/54/11/942315411.db2.gz JYPDLJHGVRZEJL-UHFFFAOYSA-N 0 0 362.210 3.866 20 5 FHBDRN CC[C@H](Cc1ccccc1)NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513739503 942316435 /nfs/dbraw/zinc/31/64/35/942316435.db2.gz JDGMUGRYEFWYCE-CQSZACIVSA-N 0 0 364.348 3.947 20 5 FHBDRN CC(C)(NC(=O)NCCCOc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000431858321 942320619 /nfs/dbraw/zinc/32/06/19/942320619.db2.gz CLRXLSBXBSXKPO-UHFFFAOYSA-N 0 0 357.410 3.598 20 5 FHBDRN CCc1cc(NC(=O)c2cn3ccnc3s2)c2cc([N+](=O)[O-])ccc2n1 ZINC000188059396 942323353 /nfs/dbraw/zinc/32/33/53/942323353.db2.gz IPPGLIJNRNUTAD-UHFFFAOYSA-N 0 0 367.390 3.667 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])NCCc1cc(Cl)cc(Cl)c1 ZINC000502277594 942327700 /nfs/dbraw/zinc/32/77/00/942327700.db2.gz QDWSWESXXCTEJZ-UHFFFAOYSA-N 0 0 353.205 3.803 20 5 FHBDRN CSc1cccc(C(=O)NCCCCN(C)c2ccccc2)c1[N+](=O)[O-] ZINC000188079061 942327636 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3.880 20 5 FHBDRN CC[C@@H](NC(=O)c1cc(OC)c(OC(F)F)cc1[N+](=O)[O-])[C@@H]1CC1(C)C ZINC000416087776 942334994 /nfs/dbraw/zinc/33/49/94/942334994.db2.gz ZDQKRDXMLCVPJU-WDEREUQCSA-N 0 0 372.368 3.759 20 5 FHBDRN CCC(=O)c1ccc(N2CCC3(C[C@H]3c3nnc(C)o3)CC2)c([N+](=O)[O-])c1 ZINC000366432912 942335247 /nfs/dbraw/zinc/33/52/47/942335247.db2.gz NIZVXWJJFHDDTC-AWEZNQCLSA-N 0 0 370.409 3.653 20 5 FHBDRN CCC(=O)c1ccc(N2CCC3(C[C@@H]3c3nnc(C)o3)CC2)c([N+](=O)[O-])c1 ZINC000366432919 942335426 /nfs/dbraw/zinc/33/54/26/942335426.db2.gz NIZVXWJJFHDDTC-CQSZACIVSA-N 0 0 370.409 3.653 20 5 FHBDRN Cc1cc(F)cc([C@@]2(F)CCN(C(=O)Cc3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000501173448 942340612 /nfs/dbraw/zinc/34/06/12/942340612.db2.gz KBXQACWIHNPJML-LJQANCHMSA-N 0 0 360.360 3.682 20 5 FHBDRN C[C@H]1CN(S(=O)(=O)c2c(Cl)cc(Cl)cc2[N+](=O)[O-])CC[C@@H]1C ZINC000501177881 942342199 /nfs/dbraw/zinc/34/21/99/942342199.db2.gz LBCCVKBQGSLVJW-IUCAKERBSA-N 0 0 367.254 3.568 20 5 FHBDRN 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O=C(/C=C/c1ccc([N+](=O)[O-])cc1)NCc1ccc(C(F)(F)F)cc1 ZINC000016301167 942398144 /nfs/dbraw/zinc/39/81/44/942398144.db2.gz DMBHZSGQKSJSJO-BJMVGYQFSA-N 0 0 350.296 3.943 20 5 FHBDRN C[C@@H](NC(=O)COc1cccnc1[N+](=O)[O-])c1ccc(Cl)c(Cl)c1 ZINC000005970717 942399649 /nfs/dbraw/zinc/39/96/49/942399649.db2.gz QGBKAQPETDSFRU-SECBINFHSA-N 0 0 370.192 3.553 20 5 FHBDRN COc1ccc2c(c1)[C@H](OC(=O)[C@@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1)CCO2 ZINC001268850272 942402559 /nfs/dbraw/zinc/40/25/59/942402559.db2.gz VPHWHNNXHVMKBN-GPMSIDNRSA-N 0 0 369.373 3.774 20 5 FHBDRN CC(C)CN(C(=O)c1cc([N+](=O)[O-])nn1C)[C@@H](C)c1ccccc1Cl ZINC000501312767 942407550 /nfs/dbraw/zinc/40/75/50/942407550.db2.gz AIJIGKKEAFYQCO-LBPRGKRZSA-N 0 0 364.833 3.841 20 5 FHBDRN Cc1ccccc1C[C@@H]1CCCN1c1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000513744327 942408277 /nfs/dbraw/zinc/40/82/77/942408277.db2.gz JQPSEEOHRSOHCS-INIZCTEOSA-N 0 0 374.462 3.518 20 5 FHBDRN COc1ccc([C@H]2C[C@H](NC(=O)c3cc(F)cc([N+](=O)[O-])c3)C2)cc1F ZINC000501326652 942412994 /nfs/dbraw/zinc/41/29/94/942412994.db2.gz GBUYHEOCBIOGCK-YEORSEQZSA-N 0 0 362.332 3.558 20 5 FHBDRN C[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2Br)C[C@H](C)C1 ZINC000502395808 942421351 /nfs/dbraw/zinc/42/13/51/942421351.db2.gz YGPSFFDCLUDEFZ-WDEREUQCSA-N 0 0 355.232 3.866 20 5 FHBDRN CC(C)c1cccc(NC(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)c1 ZINC000015814370 942426036 /nfs/dbraw/zinc/42/60/36/942426036.db2.gz FVGDGUQQMMAMLA-UHFFFAOYSA-N 0 0 351.366 3.551 20 5 FHBDRN COc1ccc(OC)c([C@H]2CCCN2C(=O)Cc2ccccc2[N+](=O)[O-])c1 ZINC000015827665 942435107 /nfs/dbraw/zinc/43/51/07/942435107.db2.gz UJUAFRUVIORNCJ-GOSISDBHSA-N 0 0 370.405 3.518 20 5 FHBDRN O=C(NC[C@@H]1C[C@H]1C1CCC1)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC000424902479 942439181 /nfs/dbraw/zinc/43/91/81/942439181.db2.gz CPGMUFKEGGBKHY-RDJZCZTQSA-N 0 0 351.406 3.823 20 5 FHBDRN CN(CCOCc1ccccc1)c1ncc([N+](=O)[O-])cc1C(F)(F)F ZINC000413190614 942439940 /nfs/dbraw/zinc/43/99/40/942439940.db2.gz XFNPRXLBCJKBIB-UHFFFAOYSA-N 0 0 355.316 3.662 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3.755 20 5 FHBDRN C[C@H](NC(=O)Nc1ccncc1[N+](=O)[O-])c1ccc(Br)cc1 ZINC000183560430 942544809 /nfs/dbraw/zinc/54/48/09/942544809.db2.gz WAMLVHFWWDQYNZ-VIFPVBQESA-N 0 0 365.187 3.635 20 5 FHBDRN COc1cc(C)ccc1CN[C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000513717525 942546646 /nfs/dbraw/zinc/54/66/46/942546646.db2.gz PVFWWFPWGGZVQH-LJQANCHMSA-N 0 0 366.421 3.525 20 5 FHBDRN CCc1ccc(C(C)(C)NC(=O)c2cc(OC)c(OC)c([N+](=O)[O-])c2)cc1 ZINC000434248073 942547963 /nfs/dbraw/zinc/54/79/63/942547963.db2.gz HOLQJVVEHZYEEC-UHFFFAOYSA-N 0 0 372.421 3.840 20 5 FHBDRN CC(C)(C(=O)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1)C1CCC(O)CC1 ZINC000416247312 942548951 /nfs/dbraw/zinc/54/89/51/942548951.db2.gz OQPSLSGXRMHMRW-LRYGQEGESA-N 0 0 374.481 3.878 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N[C@@H]2C[C@@H]2c2c(F)cccc2Cl)c1[N+](=O)[O-] ZINC000434252401 942550058 /nfs/dbraw/zinc/55/00/58/942550058.db2.gz ZVTOUAWRSOISEI-GZMMTYOYSA-N 0 0 366.780 3.520 20 5 FHBDRN CC[C@@H](Cc1ccc(C)cc1)N(C)C(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-] ZINC000434251052 942550066 /nfs/dbraw/zinc/55/00/66/942550066.db2.gz UHLHHKDXXQOKAC-HNNXBMFYSA-N 0 0 358.442 3.843 20 5 FHBDRN CCCOc1cccc(CC(=O)N2CCCc3c([N+](=O)[O-])cccc32)c1 ZINC000513843394 942553844 /nfs/dbraw/zinc/55/38/44/942553844.db2.gz ZATLKTLYUYZUMT-UHFFFAOYSA-N 0 0 354.406 3.906 20 5 FHBDRN COc1cc(Cl)ccc1CNC(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000502575415 942555715 /nfs/dbraw/zinc/55/57/15/942555715.db2.gz OQBDLKCPJYIRFI-UHFFFAOYSA-N 0 0 360.753 3.933 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)Nc1ccc(C(=O)NC(C)(C)C)cc1 ZINC000421415414 942561677 /nfs/dbraw/zinc/56/16/77/942561677.db2.gz CCEBKDZFKANOBH-UHFFFAOYSA-N 0 0 369.421 3.992 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)Nc1cccc(C(=O)NC(C)(C)C)c1 ZINC000421429713 942566380 /nfs/dbraw/zinc/56/63/80/942566380.db2.gz HYKSUEUGDGRTBU-UHFFFAOYSA-N 0 0 369.421 3.992 20 5 FHBDRN COC1(C(F)(F)F)CCN(C(=O)c2c(C)cc(C)c([N+](=O)[O-])c2C)CC1 ZINC000416268700 942573527 /nfs/dbraw/zinc/57/35/27/942573527.db2.gz LDTMTTGNQWIWCE-UHFFFAOYSA-N 0 0 374.359 3.704 20 5 FHBDRN CN(C)c1ccc(COC(=O)C[C@H]2CCc3ccccc32)cc1[N+](=O)[O-] ZINC001268940932 942574080 /nfs/dbraw/zinc/57/40/80/942574080.db2.gz CQFKUJUDKDZGCI-MRXNPFEDSA-N 0 0 354.406 3.824 20 5 FHBDRN COCCOc1ccc(NC(=O)c2cc([N+](=O)[O-])c(C)cc2C)cc1F ZINC000421447909 942579366 /nfs/dbraw/zinc/57/93/66/942579366.db2.gz SZGUAGOTBMJOEB-UHFFFAOYSA-N 0 0 362.357 3.628 20 5 FHBDRN CC(C)(CNC(=O)c1cc([N+](=O)[O-])c[nH]1)c1ccc(Cl)c(Cl)c1 ZINC000502607910 942580038 /nfs/dbraw/zinc/58/00/38/942580038.db2.gz NVLRDSFHFGAOAW-UHFFFAOYSA-N 0 0 356.209 3.937 20 5 FHBDRN CC[C@H]1C[C@@]1(NC(=O)COc1ccccc1[N+](=O)[O-])c1cccc(C)c1 ZINC000501632159 942581582 /nfs/dbraw/zinc/58/15/82/942581582.db2.gz RUOZJGHCPDEWMC-YWZLYKJASA-N 0 0 354.406 3.724 20 5 FHBDRN O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1CCC[C@@H](Oc2ccccc2)C1 ZINC000416270305 942583407 /nfs/dbraw/zinc/58/34/07/942583407.db2.gz LOIMEEMKKKIZDB-QGZVFWFLSA-N 0 0 360.797 3.932 20 5 FHBDRN CCCc1n[nH]c(C(=O)N[C@H](C)Cc2ccc(C(C)C)cc2)c1[N+](=O)[O-] ZINC000501653222 942587948 /nfs/dbraw/zinc/58/79/48/942587948.db2.gz AONKIDGMFNHKIS-CYBMUJFWSA-N 0 0 358.442 3.755 20 5 FHBDRN Cc1cc(NCc2ccc(C(N)=O)cc2[N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000616973543 942589395 /nfs/dbraw/zinc/58/93/95/942589395.db2.gz AJNWOOVULUGCFN-UHFFFAOYSA-N 0 0 353.300 3.633 20 5 FHBDRN CC(C)c1ccc(C(=O)N[C@@H]2CCCC[C@H]2OC(F)F)cc1[N+](=O)[O-] ZINC000501656782 942589745 /nfs/dbraw/zinc/58/97/45/942589745.db2.gz OJENATFTGHYPIT-UKRRQHHQSA-N 0 0 356.369 3.998 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCCC[C@H]1OC(F)F ZINC000501659081 942591062 /nfs/dbraw/zinc/59/10/62/942591062.db2.gz OPYLEDLYCQRZAQ-FVQBIDKESA-N 0 0 370.396 3.830 20 5 FHBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc2ccsc21 ZINC000501662606 942592844 /nfs/dbraw/zinc/59/28/44/942592844.db2.gz FCXPTNRHXWFKDX-NSHDSACASA-N 0 0 369.402 3.567 20 5 FHBDRN COc1cc(C(=O)N[C@@H]2CC[C@H](C)c3ccccc32)cc([N+](=O)[O-])c1OC ZINC000501682662 942597527 /nfs/dbraw/zinc/59/75/27/942597527.db2.gz WIWQLGHUDCDUMB-BLLLJJGKSA-N 0 0 370.405 3.980 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1)N(S(=O)(=O)Cc1ccc3ccccc3c1)CC2 ZINC000501682797 942598190 /nfs/dbraw/zinc/59/81/90/942598190.db2.gz ZRXKEQBOYKLQDG-UHFFFAOYSA-N 0 0 368.414 3.641 20 5 FHBDRN COc1cccc(C2=CCN(C(=O)c3cc(Cl)cc([N+](=O)[O-])c3)C2)c1 ZINC000501684596 942599294 /nfs/dbraw/zinc/59/92/94/942599294.db2.gz VDKIIYWFLQIKKW-UHFFFAOYSA-N 0 0 358.781 3.796 20 5 FHBDRN Cc1ccc(NC(=O)Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)c(C)c1 ZINC000501672667 942602517 /nfs/dbraw/zinc/60/25/17/942602517.db2.gz HBJLWBYYWAHDLZ-UHFFFAOYSA-N 0 0 350.378 3.714 20 5 FHBDRN Cc1cccc(NC(=O)Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)c1C ZINC000501673812 942605062 /nfs/dbraw/zinc/60/50/62/942605062.db2.gz HINHLZJWNIIOGP-UHFFFAOYSA-N 0 0 350.378 3.714 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N1CCOc2cccc(F)c2C1 ZINC000513915195 942606259 /nfs/dbraw/zinc/60/62/59/942606259.db2.gz OUTBITCRSTZZPJ-UHFFFAOYSA-N 0 0 364.760 3.731 20 5 FHBDRN CC(C)(C)O[C@@H](C(=O)NCCc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000513924203 942608447 /nfs/dbraw/zinc/60/84/47/942608447.db2.gz PRGMJWJKFKOGSV-GOSISDBHSA-N 0 0 356.422 3.810 20 5 FHBDRN CC[C@@H](C)Oc1ccc(C(=O)NCc2cc([N+](=O)[O-])ccc2OC)cc1 ZINC000541329273 942613203 /nfs/dbraw/zinc/61/32/03/942613203.db2.gz DSDRYHQAFUAMBT-CYBMUJFWSA-N 0 0 358.394 3.711 20 5 FHBDRN COc1cc(N(C)C(=O)c2cc([N+](=O)[O-])c(C)cc2C)cc(OC)c1OC ZINC000421481819 942613755 /nfs/dbraw/zinc/61/37/55/942613755.db2.gz QGHQFBPVABDMSS-UHFFFAOYSA-N 0 0 374.393 3.514 20 5 FHBDRN C[C@@H]1CN(C(=O)c2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC2(CCC2)O1 ZINC000843729404 942616211 /nfs/dbraw/zinc/61/62/11/942616211.db2.gz FXUDORHVMMKKQT-SECBINFHSA-N 0 0 359.209 3.685 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCC(n2cc(Cl)cn2)CC1 ZINC000421522460 942627555 /nfs/dbraw/zinc/62/75/55/942627555.db2.gz ZSFVKQYJSRUEEX-UHFFFAOYSA-N 0 0 362.817 3.539 20 5 FHBDRN C[C@H]1CN(C(=O)c2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC2(CCC2)O1 ZINC000843729405 942631014 /nfs/dbraw/zinc/63/10/14/942631014.db2.gz FXUDORHVMMKKQT-VIFPVBQESA-N 0 0 359.209 3.685 20 5 FHBDRN Cc1c2ccccc2oc1[C@H](C)NCc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000183578488 942634254 /nfs/dbraw/zinc/63/42/54/942634254.db2.gz OCWFYCMKNGAHJA-LBPRGKRZSA-N 0 0 353.378 3.599 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)Nc1nc(C2CCOCC2)cs1 ZINC000421540788 942634803 /nfs/dbraw/zinc/63/48/03/942634803.db2.gz KTUYMNFIHRGNNT-UHFFFAOYSA-N 0 0 361.423 3.814 20 5 FHBDRN Cc1cnn(Cc2cc(F)ccc2F)c1NC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000502676257 942637182 /nfs/dbraw/zinc/63/71/82/942637182.db2.gz PZONJYCKYPKYQG-UHFFFAOYSA-N 0 0 372.331 3.679 20 5 FHBDRN CC(C)OCc1nc([C@H](C)Nc2nccc3ccc([N+](=O)[O-])cc32)no1 ZINC000413307484 942640902 /nfs/dbraw/zinc/64/09/02/942640902.db2.gz HRUKERLXEBLRGR-NSHDSACASA-N 0 0 357.370 3.624 20 5 FHBDRN Cc1cc(NC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])cc2n[nH]cc21 ZINC000501743155 942646453 /nfs/dbraw/zinc/64/64/53/942646453.db2.gz FKMPQASWEARIKC-UHFFFAOYSA-N 0 0 374.784 3.841 20 5 FHBDRN CC(C)c1[nH]nc(C(=O)Nc2cc(-c3ccccc3)ns2)c1[N+](=O)[O-] ZINC000434399953 942649328 /nfs/dbraw/zinc/64/93/28/942649328.db2.gz QNRGPWGWGSRECN-UHFFFAOYSA-N 0 0 357.395 3.817 20 5 FHBDRN COc1ccc(Cl)cc1CNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000501765950 942657751 /nfs/dbraw/zinc/65/77/51/942657751.db2.gz NPOQDFVNTWMZJB-UHFFFAOYSA-N 0 0 373.796 3.528 20 5 FHBDRN C[C@]1(CNc2ncc([N+](=O)[O-])cc2C(F)(F)F)OCCc2sccc21 ZINC000413316809 942657797 /nfs/dbraw/zinc/65/77/97/942657797.db2.gz XVOXWJIAJCAOPR-CQSZACIVSA-N 0 0 373.356 3.970 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N[C@@H]1CCO[C@@H](c2cccs2)C1 ZINC000421557092 942660721 /nfs/dbraw/zinc/66/07/21/942660721.db2.gz QNKYNSYCVIJZCW-CZUORRHYSA-N 0 0 360.435 3.923 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)Nc1ccnc(OCc2ccccc2)c1 ZINC000501755846 942661174 /nfs/dbraw/zinc/66/11/74/942661174.db2.gz MDSIXSLLRUITSJ-UHFFFAOYSA-N 0 0 364.361 3.525 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NCc1ccnc(C(F)(F)F)c1 ZINC000421570921 942662548 /nfs/dbraw/zinc/66/25/48/942662548.db2.gz UASIVLMTIPBMKU-UHFFFAOYSA-N 0 0 353.300 3.555 20 5 FHBDRN CC1(C)CN(C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)[C@H]1c1ccncc1 ZINC000412361967 942669703 /nfs/dbraw/zinc/66/97/03/942669703.db2.gz NAFHIPIPWBJQSL-KSZLIROESA-N 0 0 351.406 3.703 20 5 FHBDRN COc1ccccc1[C@@H]1C[C@H]1C(=O)NC(C)(C)c1ccccc1[N+](=O)[O-] ZINC000413840493 942669879 /nfs/dbraw/zinc/66/98/79/942669879.db2.gz VLYHWQIJKBOOPV-LSDHHAIUSA-N 0 0 354.406 3.758 20 5 FHBDRN C[C@@H](NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)[C@H]1OCCc2sccc21 ZINC000412364609 942670940 /nfs/dbraw/zinc/67/09/40/942670940.db2.gz QEYUYFQRSFBXHF-YJXLDUANSA-N 0 0 372.446 3.579 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)Nc2cccc(-c3ccnc(C)n3)c2)c1 ZINC000146959867 942682618 /nfs/dbraw/zinc/68/26/18/942682618.db2.gz ZQVWUONCNLQERO-UHFFFAOYSA-N 0 0 364.361 3.621 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1N1CCC3(CC1)OCCc1ccccc13)CCN2 ZINC000413333655 942683434 /nfs/dbraw/zinc/68/34/34/942683434.db2.gz NLXAYSWBIVEAJP-UHFFFAOYSA-N 0 0 365.433 3.631 20 5 FHBDRN CC1(C)C[C@@H](c2nc(Cc3ccc([N+](=O)[O-])cn3)no2)c2ccccc2O1 ZINC000420486216 942691383 /nfs/dbraw/zinc/69/13/83/942691383.db2.gz DLXKVQCGOFNCMP-OAHLLOKOSA-N 0 0 366.377 3.657 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(Cc2noc([C@H]3C[C@]3(F)c3ccccc3)n2)c1 ZINC000420491069 942697003 /nfs/dbraw/zinc/69/70/03/942697003.db2.gz DQVQALZHQQBAOJ-BEFAXECRSA-N 0 0 369.352 3.930 20 5 FHBDRN COc1cc(NC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)cc(OC)c1C ZINC000412371162 942701409 /nfs/dbraw/zinc/70/14/09/942701409.db2.gz XXZKKNKZBPQDPS-JKSUJKDBSA-N 0 0 356.378 3.663 20 5 FHBDRN O=[N+]([O-])c1ccc([C@@H]2C[C@H]2c2nc(COCc3ccccc3)no2)cc1 ZINC000420497158 942705602 /nfs/dbraw/zinc/70/56/02/942705602.db2.gz AAYWSLNYDMAHDQ-DLBZAZTESA-N 0 0 351.362 3.966 20 5 FHBDRN CCOC(=O)[C@](C)(CNc1ccc(C(C)=O)cc1[N+](=O)[O-])c1ccccc1 ZINC000469236760 942706507 /nfs/dbraw/zinc/70/65/07/942706507.db2.gz SENRPVOXWHFPOX-HXUWFJFHSA-N 0 0 370.405 3.730 20 5 FHBDRN C[C@H](C(=O)OC(C)(C)C)c1noc([C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)n1 ZINC000420499484 942706712 /nfs/dbraw/zinc/70/67/12/942706712.db2.gz CWHGSDOWUSMQAN-LEWSCRJBSA-N 0 0 359.382 3.694 20 5 FHBDRN O=C(NCCOCc1ccc(Cl)cc1)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000514056151 942710143 /nfs/dbraw/zinc/71/01/43/942710143.db2.gz XZOGWMNRYISDPI-UHFFFAOYSA-N 0 0 374.780 3.941 20 5 FHBDRN O=C(NCCNc1ccccc1[N+](=O)[O-])c1cc(Cl)c(F)cc1Cl ZINC000549426754 942710451 /nfs/dbraw/zinc/71/04/51/942710451.db2.gz YHVYPTVCFOLWAG-UHFFFAOYSA-N 0 0 372.183 3.883 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCO[C@H](c3ccccc3F)C2)c2ccncc21 ZINC000066814579 942710505 /nfs/dbraw/zinc/71/05/05/942710505.db2.gz JVNPEFDFQXXYBY-IBGZPJMESA-N 0 0 353.353 3.860 20 5 FHBDRN CCCNc1ccc(CNC(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)cc1 ZINC000434509506 942717078 /nfs/dbraw/zinc/71/70/78/942717078.db2.gz INYKGPRULRCVBC-UHFFFAOYSA-N 0 0 352.394 3.828 20 5 FHBDRN Cc1coc(-c2ccc(C)c(NC(=O)Nc3ccncc3[N+](=O)[O-])c2)n1 ZINC000183624173 942722424 /nfs/dbraw/zinc/72/24/24/942722424.db2.gz GFXVHFCQVNGZEH-UHFFFAOYSA-N 0 0 353.338 3.906 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)NC[C@H]1CCCc2ccccc21 ZINC000514059345 942722803 /nfs/dbraw/zinc/72/28/03/942722803.db2.gz NCXQHJFSNWFXCM-QGZVFWFLSA-N 0 0 353.422 3.557 20 5 FHBDRN CCOc1cc(C(=O)N2CC[C@H](C3CCCC3)C2)c([N+](=O)[O-])cc1OC ZINC000421655765 942723279 /nfs/dbraw/zinc/72/32/79/942723279.db2.gz OKDMPGNPOBCJHD-AWEZNQCLSA-N 0 0 362.426 3.654 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NCC(C)(C)c1cccnc1 ZINC000413890111 942725935 /nfs/dbraw/zinc/72/59/35/942725935.db2.gz RCMWZCAQJHPMJJ-UHFFFAOYSA-N 0 0 370.453 3.888 20 5 FHBDRN CC(C)(NC(=O)NCCCOC1CCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000431865985 942728085 /nfs/dbraw/zinc/72/80/85/942728085.db2.gz DCXVUEMBDDOMJQ-UHFFFAOYSA-N 0 0 363.458 3.869 20 5 FHBDRN CC(C)[C@H]1CCCN(c2ccc(C(=O)c3nccn3C)cc2[N+](=O)[O-])CC1 ZINC000514082255 942734908 /nfs/dbraw/zinc/73/49/08/942734908.db2.gz GNMMXXJGGAKORK-HNNXBMFYSA-N 0 0 370.453 3.822 20 5 FHBDRN CC[C@@]1(C)CN(c2nnc(-c3cccc([N+](=O)[O-])c3)n2CC(C)C)CCO1 ZINC000549432891 942745885 /nfs/dbraw/zinc/74/58/85/942745885.db2.gz CVLMVXXKYCKAAJ-IBGZPJMESA-N 0 0 373.457 3.515 20 5 FHBDRN C[C@H](NC(=O)NCc1nc(C(C)(C)C)cs1)c1cccc([N+](=O)[O-])c1 ZINC000104790971 942748560 /nfs/dbraw/zinc/74/85/60/942748560.db2.gz OPFXFBHBGVQFHA-NSHDSACASA-N 0 0 362.455 3.909 20 5 FHBDRN CCCCCn1cc(CNc2cc(C)c([N+](=O)[O-])c(C(=O)OC)c2)c(C)n1 ZINC000502799080 942751474 /nfs/dbraw/zinc/75/14/74/942751474.db2.gz HXALWFXYGWVVDY-UHFFFAOYSA-N 0 0 374.441 3.997 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cn1)N1CCSc2ccc(C(F)(F)F)cc21 ZINC000363820026 942755896 /nfs/dbraw/zinc/75/58/96/942755896.db2.gz NXWPLUWLEMJCSB-UHFFFAOYSA-N 0 0 369.324 3.761 20 5 FHBDRN CC(C)CC[C@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)c1ccc(Cl)cc1 ZINC000502812191 942763988 /nfs/dbraw/zinc/76/39/88/942763988.db2.gz SBDNMSNUTGAKCU-INIZCTEOSA-N 0 0 364.833 3.738 20 5 FHBDRN O=c1c(Cl)cc(C(F)(F)F)cn1Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000505437510 942774118 /nfs/dbraw/zinc/77/41/18/942774118.db2.gz CFMZTIFBSQTBPQ-UHFFFAOYSA-N 0 0 368.645 3.755 20 5 FHBDRN O=C(c1ccc(OC(F)F)c([N+](=O)[O-])c1)N1CCC[C@H]2CCCC[C@H]21 ZINC000514139448 942777644 /nfs/dbraw/zinc/77/76/44/942777644.db2.gz ALFHKRPRMQKHSG-DGCLKSJQSA-N 0 0 354.353 3.991 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1CN[C@@H](c1ncon1)c1ccc(Cl)cc1 ZINC000183633876 942780480 /nfs/dbraw/zinc/78/04/80/942780480.db2.gz FWXUVXYRYCCGOK-MRXNPFEDSA-N 0 0 358.785 3.819 20 5 FHBDRN Cc1sc(C(=O)N2CC[C@@H](O)[C@H]2c2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000425105274 942785060 /nfs/dbraw/zinc/78/50/60/942785060.db2.gz GWKYULWWSDCQHD-UKRRQHHQSA-N 0 0 366.826 3.566 20 5 FHBDRN CC(C)c1ccc(C(=O)NC(C)(C)c2cn(C(C)C)nn2)cc1[N+](=O)[O-] ZINC000421733642 942786410 /nfs/dbraw/zinc/78/64/10/942786410.db2.gz ATFKZZHHGFZQLO-UHFFFAOYSA-N 0 0 359.430 3.556 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2nc(CN3CCOc4c(F)cccc4C3)co2)cc1 ZINC000434622951 942794358 /nfs/dbraw/zinc/79/43/58/942794358.db2.gz JEMFWCGUCPIBEC-UHFFFAOYSA-N 0 0 369.352 3.784 20 5 FHBDRN CCc1ccc(CCNC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)cc1 ZINC000514185195 942795886 /nfs/dbraw/zinc/79/58/86/942795886.db2.gz FJZSRDJGHSGSPT-UHFFFAOYSA-N 0 0 364.348 3.731 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)CCC(=O)c2cccc(F)c2)cc1[N+](=O)[O-] ZINC000502851358 942796628 /nfs/dbraw/zinc/79/66/28/942796628.db2.gz KOMINJBLWLFJMO-ZDUSSCGKSA-N 0 0 358.369 3.883 20 5 FHBDRN Cc1cc(C(=O)N(C)c2ccc(C(=O)NC(C)(C)C)cc2)cc([N+](=O)[O-])c1 ZINC000413924970 942798888 /nfs/dbraw/zinc/79/88/88/942798888.db2.gz NXMVMEFVYVGOAK-UHFFFAOYSA-N 0 0 369.421 3.708 20 5 FHBDRN Cc1ccoc1C(=O)NCCCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000514176619 942802480 /nfs/dbraw/zinc/80/24/80/942802480.db2.gz SABYOJPVGHRBGG-UHFFFAOYSA-N 0 0 371.315 3.747 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)Nc1ccc(OCC(C)(C)O)cc1 ZINC000421778149 942805731 /nfs/dbraw/zinc/80/57/31/942805731.db2.gz DTETVWADCHLFCV-UHFFFAOYSA-N 0 0 358.394 3.614 20 5 FHBDRN CSc1cc(NC(=O)CCn2nc(C)c([N+](=O)[O-])c2C)ccc1Cl ZINC000413940470 942806189 /nfs/dbraw/zinc/80/61/89/942806189.db2.gz AVWAAGVDRKQMNK-UHFFFAOYSA-N 0 0 368.846 3.812 20 5 FHBDRN COc1ccc(OC(=O)C(C)(C)c2ccc(F)cc2F)cc1[N+](=O)[O-] ZINC001269176531 942810125 /nfs/dbraw/zinc/81/01/25/942810125.db2.gz SWQGUIDZOHWNPE-UHFFFAOYSA-N 0 0 351.305 3.765 20 5 FHBDRN CN(C)C(=O)[C@@H]1CCC[C@H](Nc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000514187151 942812499 /nfs/dbraw/zinc/81/24/99/942812499.db2.gz OWGLGVLEYHVRPT-PWSUYJOCSA-N 0 0 359.348 3.673 20 5 FHBDRN Cc1ccc(SCCn2cc(Br)c([N+](=O)[O-])n2)cc1C ZINC000502866497 942813765 /nfs/dbraw/zinc/81/37/65/942813765.db2.gz CPLVJIOIDWMLPF-UHFFFAOYSA-N 0 0 356.245 3.963 20 5 FHBDRN CCNc1ccc(C(=O)NCc2cccc(OC(C)(C)C)n2)cc1[N+](=O)[O-] ZINC000502868163 942815369 /nfs/dbraw/zinc/81/53/69/942815369.db2.gz RDARRHDEGNHKOI-UHFFFAOYSA-N 0 0 372.425 3.529 20 5 FHBDRN CCN(C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)[C@H](C)c1cccnc1 ZINC000514190389 942817365 /nfs/dbraw/zinc/81/73/65/942817365.db2.gz RQVAREDNMHYEIB-LLVKDONJSA-N 0 0 365.336 3.815 20 5 FHBDRN CO[C@@](C)([C@@H](C)NC(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-])C1CC1 ZINC000413958004 942819895 /nfs/dbraw/zinc/81/98/95/942819895.db2.gz OBVXAFQVCXOIIJ-XCLFUZPHSA-N 0 0 369.421 3.590 20 5 FHBDRN O=C(c1cc2cc([N+](=O)[O-])ccc2o1)N1CC2(CCC2)[C@H]1C1CCOCC1 ZINC000425121091 942821582 /nfs/dbraw/zinc/82/15/82/942821582.db2.gz LQKDSKKIOAOJKF-GOSISDBHSA-N 0 0 370.405 3.762 20 5 FHBDRN Cc1cccc2c1OCC[C@H]2NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000190142507 942821774 /nfs/dbraw/zinc/82/17/74/942821774.db2.gz GCIWKPRYOPJCPW-GOSISDBHSA-N 0 0 365.389 3.567 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)Nc2cnn(-c3ccccc3)c2)c1 ZINC000502882093 942826871 /nfs/dbraw/zinc/82/68/71/942826871.db2.gz WRTSWKIIAKQWLZ-UHFFFAOYSA-N 0 0 354.391 3.755 20 5 FHBDRN CCOc1ccc(CCNC(=O)c2c(C)cccc2[N+](=O)[O-])cc1OCC ZINC000183652139 942832699 /nfs/dbraw/zinc/83/26/99/942832699.db2.gz OEROPWDRUJNNQK-UHFFFAOYSA-N 0 0 372.421 3.673 20 5 FHBDRN C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CC[C@H](C(F)(F)F)C(C)(C)C1 ZINC000190160231 942835199 /nfs/dbraw/zinc/83/51/99/942835199.db2.gz NZWIVKWZLAYMAS-RISCZKNCSA-N 0 0 373.375 3.832 20 5 FHBDRN COC(=O)c1cnc(N[C@@H](C)c2cccc(OC(C)C)c2)c([N+](=O)[O-])c1 ZINC000190168122 942848161 /nfs/dbraw/zinc/84/81/61/942848161.db2.gz GARSGLVDBISOBZ-LBPRGKRZSA-N 0 0 359.382 3.737 20 5 FHBDRN COC(=O)c1cnc(N[C@@H](C)c2cccc(OC(F)F)c2)c([N+](=O)[O-])c1 ZINC000190167883 942848619 /nfs/dbraw/zinc/84/86/19/942848619.db2.gz PHHIEDYYPRVXOY-VIFPVBQESA-N 0 0 367.308 3.551 20 5 FHBDRN CN(Cc1ccn(-c2ccc(F)cc2F)n1)Cc1ccccc1[N+](=O)[O-] ZINC000190172611 942849366 /nfs/dbraw/zinc/84/93/66/942849366.db2.gz JJUNQBUSNUYKDP-UHFFFAOYSA-N 0 0 358.348 3.691 20 5 FHBDRN COC[C@H](Cc1ccccc1)N(C)C(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000190192639 942849744 /nfs/dbraw/zinc/84/97/44/942849744.db2.gz PKWYXITUDQXJLG-KXBFYZLASA-N 0 0 371.437 3.555 20 5 FHBDRN Cc1cccc2c1OCC[C@H]2NC(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000190193352 942849752 /nfs/dbraw/zinc/84/97/52/942849752.db2.gz RYTIVJKATVYZBN-CXAGYDPISA-N 0 0 355.394 3.787 20 5 FHBDRN CCOc1ccc(NC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)cc1CO ZINC000190195298 942853594 /nfs/dbraw/zinc/85/35/94/942853594.db2.gz CVLWMJATAGAEGO-UHFFFAOYSA-N 0 0 358.394 3.862 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N(CC)Cc2occc2C)cc1OC ZINC000413976253 942857235 /nfs/dbraw/zinc/85/72/35/942857235.db2.gz JKAAFKLXFFUKJY-UHFFFAOYSA-N 0 0 362.382 3.566 20 5 FHBDRN C[C@@H](O)[C@H]1CCCCN1C(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000181611241 942857332 /nfs/dbraw/zinc/85/73/32/942857332.db2.gz JINPAYRYIMKTPP-RDTXWAMCSA-N 0 0 369.421 3.714 20 5 FHBDRN CCc1ccc(NC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)cc1F ZINC000502921882 942857416 /nfs/dbraw/zinc/85/74/16/942857416.db2.gz YYNCLVQJQDGCIC-UHFFFAOYSA-N 0 0 354.341 3.734 20 5 FHBDRN C[C@H](CNC(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-])CC(F)(F)F ZINC000413997892 942876013 /nfs/dbraw/zinc/87/60/13/942876013.db2.gz VUAGTAXQJXMNNE-NSHDSACASA-N 0 0 367.327 3.975 20 5 FHBDRN CN(Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)Cc1ccc(Cl)cc1 ZINC000016590317 942880765 /nfs/dbraw/zinc/88/07/65/942880765.db2.gz SRGJUEIVVCVYFS-UHFFFAOYSA-N 0 0 358.785 3.930 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)N1CCC[C@H](CC(F)(F)F)C1 ZINC000421937901 942888836 /nfs/dbraw/zinc/88/88/36/942888836.db2.gz JCJSRHAGDWHFFH-CYBMUJFWSA-N 0 0 373.375 3.978 20 5 FHBDRN CCCNc1nnc(SCc2cc(OC)c(F)cc2[N+](=O)[O-])s1 ZINC000183838130 942899341 /nfs/dbraw/zinc/89/93/41/942899341.db2.gz IRWMCMPYJHHPJY-UHFFFAOYSA-N 0 0 358.420 3.708 20 5 FHBDRN CC[C@H]1Cc2ccccc2CN1C(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000183834448 942901094 /nfs/dbraw/zinc/90/10/94/942901094.db2.gz BAZDIVRPVCQAPN-KRWDZBQOSA-N 0 0 354.406 3.727 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)N1CCC[C@H](CC(F)(F)F)C1 ZINC000421955555 942907155 /nfs/dbraw/zinc/90/71/55/942907155.db2.gz FULBAAOBCAIMJH-LLVKDONJSA-N 0 0 362.373 3.878 20 5 FHBDRN CCC(CC)(CC)CNC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000133704390 942908549 /nfs/dbraw/zinc/90/85/49/942908549.db2.gz LWIWNVIABVXFQE-UHFFFAOYSA-N 0 0 355.822 3.519 20 5 FHBDRN CC[C@@H]1CN(C(=O)c2ccnc(-c3ccccc3)c2[N+](=O)[O-])C[C@@H](CC)O1 ZINC000421972623 942911707 /nfs/dbraw/zinc/91/17/07/942911707.db2.gz KOFHSEWCNOVDFE-HZPDHXFCSA-N 0 0 369.421 3.686 20 5 FHBDRN Cc1cc(OCC(=O)Nc2nc3c(s2)C[C@H](C)CC3)ccc1[N+](=O)[O-] ZINC000430102214 942915057 /nfs/dbraw/zinc/91/50/57/942915057.db2.gz JLLOKAHOLXCAAR-SNVBAGLBSA-N 0 0 361.423 3.502 20 5 FHBDRN Cc1ccc([C@H](NC(=O)CCNc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000514337820 942937990 /nfs/dbraw/zinc/93/79/90/942937990.db2.gz IKQPLMLWEMMTNH-FQEVSTJZSA-N 0 0 353.422 3.973 20 5 FHBDRN Cc1ccc([C@]2(C)CCN(CC(=O)Nc3c(C)cccc3[N+](=O)[O-])C2)cc1 ZINC000434751848 942943018 /nfs/dbraw/zinc/94/30/18/942943018.db2.gz JDRUIZQVYQUTHA-OAQYLSRUSA-N 0 0 367.449 3.814 20 5 FHBDRN O=C(Nc1ccc2nccnc2c1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000430056596 942979340 /nfs/dbraw/zinc/97/93/40/942979340.db2.gz HDILVNVYFHHCRF-UHFFFAOYSA-N 0 0 373.166 3.553 20 5 FHBDRN Cc1c(CNC(=O)c2ccc(Br)s2)cccc1[N+](=O)[O-] ZINC000231862881 942981053 /nfs/dbraw/zinc/98/10/53/942981053.db2.gz WOZHKOFHMHFETL-UHFFFAOYSA-N 0 0 355.213 3.657 20 5 FHBDRN C[C@@H]1CCCC[C@@H]1OCCNC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000503097875 942985076 /nfs/dbraw/zinc/98/50/76/942985076.db2.gz GXKBEPHAWGWISV-ABAIWWIYSA-N 0 0 355.822 3.965 20 5 FHBDRN CCCCCn1cc(CNC(=O)c2ccc(CC)c([N+](=O)[O-])c2)c(C)n1 ZINC000503117603 942986329 /nfs/dbraw/zinc/98/63/29/942986329.db2.gz HPAQKKZGZNOVOI-UHFFFAOYSA-N 0 0 358.442 3.782 20 5 FHBDRN CCc1ccc(CN(C2CC2)S(=O)(=O)c2cccc([N+](=O)[O-])c2C)cc1 ZINC000514405480 942991905 /nfs/dbraw/zinc/99/19/05/942991905.db2.gz HNCQTFQHUMSCFS-UHFFFAOYSA-N 0 0 374.462 3.819 20 5 FHBDRN CC(C)CCSc1ccc(C(=O)N2CC[C@@]23CCOC3)cc1[N+](=O)[O-] ZINC000422085794 942992990 /nfs/dbraw/zinc/99/29/90/942992990.db2.gz HCBAWCIUQOXCNT-SFHVURJKSA-N 0 0 364.467 3.738 20 5 FHBDRN CCN(Cc1nc2cc([N+](=O)[O-])ccc2o1)Cc1ccc(OC)c(OC)c1 ZINC000434836490 942994464 /nfs/dbraw/zinc/99/44/64/942994464.db2.gz ADFCZWBYGBAAET-UHFFFAOYSA-N 0 0 371.393 3.775 20 5 FHBDRN O=[N+]([O-])C[C@@H](Oc1ccc(Br)c(C(F)(F)F)c1)C1CC1 ZINC001225651482 942999177 /nfs/dbraw/zinc/99/91/77/942999177.db2.gz XVAIZFRHOHOWKF-LLVKDONJSA-N 0 0 354.122 3.902 20 5 FHBDRN C[C@@H]1CC[C@@H](O)CN1C(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000422130918 943016666 /nfs/dbraw/zinc/01/66/66/943016666.db2.gz VHMVRSSFKUJAHJ-UKRRQHHQSA-N 0 0 372.446 3.731 20 5 FHBDRN Cc1cc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)ccc1Br ZINC000318661114 943028650 /nfs/dbraw/zinc/02/86/50/943028650.db2.gz HWBVYDBHKQYLGT-UHFFFAOYSA-N 0 0 368.162 3.639 20 5 FHBDRN COCCN(CC(=O)Nc1ccc([N+](=O)[O-])cc1C)[C@@H](C)c1ccccc1 ZINC000434894986 943032013 /nfs/dbraw/zinc/03/20/13/943032013.db2.gz JYRYLXIKEFCPPD-INIZCTEOSA-N 0 0 371.437 3.551 20 5 FHBDRN CCOc1ccc(OCCn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)cc1 ZINC000505560653 943033376 /nfs/dbraw/zinc/03/33/76/943033376.db2.gz VOVKPZOBCVTVIB-UHFFFAOYSA-N 0 0 353.378 3.936 20 5 FHBDRN C[C@H](NS(=O)(=O)Cc1ccccc1[N+](=O)[O-])c1ccc(C2CC2)cc1 ZINC000416672433 943034550 /nfs/dbraw/zinc/03/45/50/943034550.db2.gz YQQSOUNTLXQZOS-ZDUSSCGKSA-N 0 0 360.435 3.653 20 5 FHBDRN C[C@H]1c2c(Cl)cc(Cl)cc2CCN1Cc1c([N+](=O)[O-])ncn1C ZINC000434905211 943042422 /nfs/dbraw/zinc/04/24/22/943042422.db2.gz QJDAFHUDLQLXLE-VIFPVBQESA-N 0 0 355.225 3.754 20 5 FHBDRN O=C(Cc1csc(-c2ccccc2)n1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000514488716 943057615 /nfs/dbraw/zinc/05/76/15/943057615.db2.gz QIEASIUSAOTIHG-UHFFFAOYSA-N 0 0 365.414 3.850 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CCC[C@@]3(CCSC3)C2)ccc1[N+](=O)[O-] ZINC000412405748 943057918 /nfs/dbraw/zinc/05/79/18/943057918.db2.gz ZCNHFYWSPXWAAJ-GOSISDBHSA-N 0 0 364.467 3.741 20 5 FHBDRN CC(C)(NC(=O)NC[C@H]1CC12CCSCC2)c1ccccc1[N+](=O)[O-] ZINC000422223696 943061613 /nfs/dbraw/zinc/06/16/13/943061613.db2.gz IBKBIAWPLNXDQZ-CYBMUJFWSA-N 0 0 363.483 3.662 20 5 FHBDRN Cc1nc(C(=O)Nc2cccc([N+](=O)[O-])c2)nn1-c1ccccc1C(C)C ZINC000503219743 943063042 /nfs/dbraw/zinc/06/30/42/943063042.db2.gz RJEOBMNHMXLIDN-UHFFFAOYSA-N 0 0 365.393 3.860 20 5 FHBDRN C[C@@H]1CCN(C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)[C@@H]2CCCC[C@@H]12 ZINC000514501607 943066970 /nfs/dbraw/zinc/06/69/70/943066970.db2.gz DSMUPXBXKQOKDE-HYVNUMGLSA-N 0 0 368.437 3.821 20 5 FHBDRN COc1ccc(OC)c(CN(c2ncc(Cl)cc2[N+](=O)[O-])C2CC2)c1 ZINC000434951484 943069966 /nfs/dbraw/zinc/06/99/66/943069966.db2.gz QVKABTWYNICPFS-UHFFFAOYSA-N 0 0 363.801 3.829 20 5 FHBDRN C[C@@H](CC(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc21)c1ccc(F)cc1F ZINC000536253569 943072955 /nfs/dbraw/zinc/07/29/55/943072955.db2.gz NGMBOXKYMJEBBU-VIFPVBQESA-N 0 0 360.320 3.882 20 5 FHBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)N1CC2(C1)CCCCC2 ZINC000503248623 943083528 /nfs/dbraw/zinc/08/35/28/943083528.db2.gz PBVDEWDYLUBURC-UHFFFAOYSA-N 0 0 360.457 3.947 20 5 FHBDRN Cn1ncc(Oc2ccc(-c3ccccc3)cc2[N+](=O)[O-])c(Cl)c1=O ZINC000503247913 943083831 /nfs/dbraw/zinc/08/38/31/943083831.db2.gz SVYYDKZHNFRNEI-UHFFFAOYSA-N 0 0 357.753 3.801 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](CO)c1ccsc1 ZINC000505586905 943087903 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C[C@H](NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)c1nc2c(s1)CCC2 ZINC000412417038 943098233 /nfs/dbraw/zinc/09/82/33/943098233.db2.gz MDUQROLTMNUQTF-LEWSCRJBSA-N 0 0 357.435 3.521 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1Br)c1ccccc1F ZINC000133654847 943100213 /nfs/dbraw/zinc/10/02/13/943100213.db2.gz ZQGGJTOLIRAEDI-UHFFFAOYSA-N 0 0 354.131 3.758 20 5 FHBDRN CS(=O)(=O)c1ccc(NCc2ccc(C(F)(F)F)cc2)c([N+](=O)[O-])c1 ZINC000016738914 943101497 /nfs/dbraw/zinc/10/14/97/943101497.db2.gz JFBWYRXWAPMLHO-UHFFFAOYSA-N 0 0 374.340 3.629 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1Cl)N1C[C@@H]2CCCN2c2ccccc21 ZINC000514559051 943102340 /nfs/dbraw/zinc/10/23/40/943102340.db2.gz QUJQSOSSWZJKKM-ZDUSSCGKSA-N 0 0 357.797 3.877 20 5 FHBDRN CCCOc1cc(NC(=O)N2CC(CF)C2)c([N+](=O)[O-])cc1OCCC ZINC000416779065 943105521 /nfs/dbraw/zinc/10/55/21/943105521.db2.gz WUAFQEMWHKQOCY-UHFFFAOYSA-N 0 0 369.393 3.606 20 5 FHBDRN O=C(c1cc(F)cc(Br)c1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000514562182 943111539 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FHBDRN COC(=O)c1cnc([C@@H](C)Nc2ccc([N+](=O)[O-])c(OC(F)F)c2)s1 ZINC000425273496 943141089 /nfs/dbraw/zinc/14/10/89/943141089.db2.gz OUMKDHMBJXYYDV-SSDOTTSWSA-N 0 0 373.337 3.612 20 5 FHBDRN O=C(NC[C@H]1CCCCN1Cc1ccc([N+](=O)[O-])cc1)Nc1ccccc1 ZINC000058754100 943145979 /nfs/dbraw/zinc/14/59/79/943145979.db2.gz JZQRUSMHLWEGMA-LJQANCHMSA-N 0 0 368.437 3.771 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)NCCCOC1CCCCC1 ZINC000514622900 943157345 /nfs/dbraw/zinc/15/73/45/943157345.db2.gz XQAWPZRXRGGSGU-UHFFFAOYSA-N 0 0 363.458 3.518 20 5 FHBDRN Cc1nc(C)c(C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)nc1C ZINC000183787748 943172520 /nfs/dbraw/zinc/17/25/20/943172520.db2.gz VZHPDBPRSKDVCT-UHFFFAOYSA-N 0 0 354.288 3.581 20 5 FHBDRN COC(=O)c1ccc(OC(=O)[C@H](C)c2cc3ccccc3o2)cc1[N+](=O)[O-] ZINC001267794282 943182804 /nfs/dbraw/zinc/18/28/04/943182804.db2.gz HTGYOIMLROXOGC-LLVKDONJSA-N 0 0 369.329 3.837 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CCSC[C@H]2c2ccccc2)c1 ZINC000514660996 943188915 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368.389 3.744 20 5 FHBDRN COc1cccc(C(=O)COc2ccc([N+](=O)[O-])cc2Br)c1 ZINC000133696071 943228750 /nfs/dbraw/zinc/22/87/50/943228750.db2.gz RXMXEWMMBAOMNY-UHFFFAOYSA-N 0 0 366.167 3.628 20 5 FHBDRN Nc1nc(C2CC2)c(C(=O)OCc2cc(Cl)ccc2[N+](=O)[O-])s1 ZINC000758538373 943232848 /nfs/dbraw/zinc/23/28/48/943232848.db2.gz QWXRHTGPVGZHIS-UHFFFAOYSA-N 0 0 353.787 3.521 20 5 FHBDRN Cc1c(CC(=O)NCCCCOCc2ccccc2)cccc1[N+](=O)[O-] ZINC000164017226 943236861 /nfs/dbraw/zinc/23/68/61/943236861.db2.gz NTIIHTUSYSTDNE-UHFFFAOYSA-N 0 0 356.422 3.559 20 5 FHBDRN C[C@@H]1C[C@H](C(C)(C)C)CCN1C(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000503542533 943238539 /nfs/dbraw/zinc/23/85/39/943238539.db2.gz XQNPKGVTRXLHCO-CHWSQXEVSA-N 0 0 373.457 3.827 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCCSc1ccccn1 ZINC000425296588 943246304 /nfs/dbraw/zinc/24/63/04/943246304.db2.gz MKLVIJPQXZMBEU-MRXNPFEDSA-N 0 0 373.478 3.857 20 5 FHBDRN CCOc1cc(NC(=O)Cc2cccc(OC)c2)c([N+](=O)[O-])cc1OCC ZINC000514720919 943247148 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O=C(c1cc([N+](=O)[O-])ccc1OC(F)F)N1CCSC2(CCC2)CC1 ZINC000412468904 943393061 /nfs/dbraw/zinc/39/30/61/943393061.db2.gz WBCWSJZVCXFQFP-UHFFFAOYSA-N 0 0 372.393 3.698 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])c2ncccc12)C1(c2cccnc2)CCCC1 ZINC000514966407 943412990 /nfs/dbraw/zinc/41/29/90/943412990.db2.gz OBEKUQYEMPHUOE-UHFFFAOYSA-N 0 0 362.389 3.989 20 5 FHBDRN CCSc1ccc(CC(=O)NCc2cc([N+](=O)[O-])ccc2OC)cc1 ZINC000503929556 943421341 /nfs/dbraw/zinc/42/13/41/943421341.db2.gz WNBWUKSRGRPBJX-UHFFFAOYSA-N 0 0 360.435 3.574 20 5 FHBDRN O=C(NCc1cc2ccccc2s1)c1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000514959480 943422260 /nfs/dbraw/zinc/42/22/60/943422260.db2.gz STLBMXREPIIRTH-UHFFFAOYSA-N 0 0 370.386 3.511 20 5 FHBDRN Cc1cc(C(=O)N2CC[C@@]3(C2)CCc2ccccc2O3)ccc1[N+](=O)[O-] ZINC000514977168 943428770 /nfs/dbraw/zinc/42/87/70/943428770.db2.gz KAQHPTRPVQXXEA-HXUWFJFHSA-N 0 0 352.390 3.513 20 5 FHBDRN Cc1c(CC(=O)N2CCC(OC3CCCCC3)CC2)cccc1[N+](=O)[O-] ZINC000164032184 943441821 /nfs/dbraw/zinc/44/18/21/943441821.db2.gz NGPOGMHCOVLPGU-UHFFFAOYSA-N 0 0 360.454 3.786 20 5 FHBDRN COC[C@@H]1CCCN(C(=O)c2cccc3c(=O)c4ccccc4[nH]c23)CC1 ZINC000584704649 943449518 /nfs/dbraw/zinc/44/95/18/943449518.db2.gz QSYMQLSNYFNNNN-OAHLLOKOSA-N 0 0 364.445 3.570 20 5 FHBDRN O=C(c1cc(C(F)(F)F)ccc1[N+](=O)[O-])N1CC[C@H](c2ccncc2)C1 ZINC000566453464 943457790 /nfs/dbraw/zinc/45/77/90/943457790.db2.gz XYXMEAQVPGRRSS-LBPRGKRZSA-N 0 0 365.311 3.638 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)NCC(=O)Nc1c(C)cccc1C ZINC000515019268 943461428 /nfs/dbraw/zinc/46/14/28/943461428.db2.gz IXUMRVWMPJWEQT-UHFFFAOYSA-N 0 0 370.409 3.534 20 5 FHBDRN CC(=O)NC1(c2noc([C@@H]3C[C@H]3c3ccc([N+](=O)[O-])cc3)n2)CCCCC1 ZINC000417252990 943470058 /nfs/dbraw/zinc/47/00/58/943470058.db2.gz MNPXMPMDFFUYCB-JKSUJKDBSA-N 0 0 370.409 3.544 20 5 FHBDRN Cc1ccc2nc(SCc3cccc([N+](=O)[O-])c3C)n(C)c(=O)c2c1 ZINC000042178113 943487058 /nfs/dbraw/zinc/48/70/58/943487058.db2.gz JLGFHIGDSZXQBJ-UHFFFAOYSA-N 0 0 355.419 3.751 20 5 FHBDRN C[C@@H]1C[C@H](C)CN(C(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000017167377 943494354 /nfs/dbraw/zinc/49/43/54/943494354.db2.gz RKDYAHHUAGNVKR-TXEJJXNPSA-N 0 0 373.375 3.920 20 5 FHBDRN CCC(=O)Nc1ccc(C)c(NC(=O)c2cccc(OC)c2[N+](=O)[O-])c1 ZINC000435557179 943497659 /nfs/dbraw/zinc/49/76/59/943497659.db2.gz QLGSKRHTVRORNF-UHFFFAOYSA-N 0 0 357.366 3.513 20 5 FHBDRN O=C([C@@H]1CC[C@H](Nc2ccc(Cl)cc2[N+](=O)[O-])C1)N1CCCCC1 ZINC000435582683 943501520 /nfs/dbraw/zinc/50/15/20/943501520.db2.gz BLHPQIRRHBRTCK-OCCSQVGLSA-N 0 0 351.834 3.841 20 5 FHBDRN Cc1ccc(C(=O)N2CCC(OCc3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000105308457 943502268 /nfs/dbraw/zinc/50/22/68/943502268.db2.gz KXVLDWCXYVXZPU-UHFFFAOYSA-N 0 0 354.406 3.725 20 5 FHBDRN CCOC(=O)c1cc(C(=O)Nc2ccc(C)c(OCC)c2)cc([N+](=O)[O-])c1 ZINC000584735799 943502948 /nfs/dbraw/zinc/50/29/48/943502948.db2.gz QSTJMRJSSORRPL-UHFFFAOYSA-N 0 0 372.377 3.731 20 5 FHBDRN O=C(c1cc2cc([N+](=O)[O-])ccc2o1)N1CC[C@@H](COc2ccccc2)C1 ZINC000504126880 943506572 /nfs/dbraw/zinc/50/65/72/943506572.db2.gz DFLTWTYQPZTKER-CQSZACIVSA-N 0 0 366.373 3.882 20 5 FHBDRN CC1=CCCN(c2ccc(S(=O)(=O)Nc3ccccc3)cc2[N+](=O)[O-])C1 ZINC000435597352 943510088 /nfs/dbraw/zinc/51/00/88/943510088.db2.gz LPSHWSPIQPFOFN-UHFFFAOYSA-N 0 0 373.434 3.552 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1)[C@@H](NCc1ncc(C(F)(F)F)cn1)CCCC2 ZINC000417324544 943515439 /nfs/dbraw/zinc/51/54/39/943515439.db2.gz AJKVMSLLHWHLAS-HNNXBMFYSA-N 0 0 366.343 3.961 20 5 FHBDRN CCc1ccnc(CNc2cc(CC)nc(-c3ccc([N+](=O)[O-])cc3)n2)c1 ZINC000435601912 943520544 /nfs/dbraw/zinc/52/05/44/943520544.db2.gz RLYNNEDONGEAJF-UHFFFAOYSA-N 0 0 363.421 3.606 20 5 FHBDRN Cc1c(N[C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)cnn1[C@H]1CCOC1 ZINC000417348098 943527663 /nfs/dbraw/zinc/52/76/63/943527663.db2.gz IKKNVZDEHOSYMW-FUHWJXTLSA-N 0 0 356.426 3.941 20 5 FHBDRN Cc1ccc([C@H]2NC(=O)N([C@@H](C)c3ccc(C)c([N+](=O)[O-])c3)C2=O)cc1C ZINC000431938543 943528450 /nfs/dbraw/zinc/52/84/50/943528450.db2.gz NFMLXNGRVHARBU-KBXCAEBGSA-N 0 0 367.405 3.874 20 5 FHBDRN CC[C@H](C)n1nc(C(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)cc1C ZINC000584745456 943532029 /nfs/dbraw/zinc/53/20/29/943532029.db2.gz LCKMCLFWLUQPMG-LBPRGKRZSA-N 0 0 369.425 3.525 20 5 FHBDRN C[C@@H]1CCN(C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)[C@@H]2CCCC[C@@H]12 ZINC000515171380 943535587 /nfs/dbraw/zinc/53/55/87/943535587.db2.gz CSORMHJYAWEUES-MDASCCDHSA-N 0 0 368.437 3.821 20 5 FHBDRN CC[C@@H](C)n1c(Sc2c([N+](=O)[O-])ncn2C)nnc1-c1ccccc1 ZINC000504174146 943535766 /nfs/dbraw/zinc/53/57/66/943535766.db2.gz JSHVPYVKLMDCKC-LLVKDONJSA-N 0 0 358.427 3.709 20 5 FHBDRN Cc1cc(OCC(=O)N[C@@H]2CCC[C@H]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC001126416087 943543473 /nfs/dbraw/zinc/54/34/73/943543473.db2.gz ZYRBFAWGPAHXLD-PKOBYXMFSA-N 0 0 368.433 3.810 20 5 FHBDRN COCCOc1ccc(-c2nc(-c3cccc([N+](=O)[O-])c3)cs2)cn1 ZINC000435682195 943543792 /nfs/dbraw/zinc/54/37/92/943543792.db2.gz DDUWUDVLDRQKFB-UHFFFAOYSA-N 0 0 357.391 3.806 20 5 FHBDRN COc1cccc(C(=O)N[C@H](c2ccccc2)c2ccccn2)c1[N+](=O)[O-] ZINC000435669206 943550418 /nfs/dbraw/zinc/55/04/18/943550418.db2.gz JIGOEAYVAJDDPR-GOSISDBHSA-N 0 0 363.373 3.518 20 5 FHBDRN CC(C)c1[nH]nc(C(=O)Nc2ccc3ccc(Cl)cc3n2)c1[N+](=O)[O-] ZINC000504261619 943557244 /nfs/dbraw/zinc/55/72/44/943557244.db2.gz ORBFZZCLCSWQCI-UHFFFAOYSA-N 0 0 359.773 3.895 20 5 FHBDRN CCCc1[nH]nc(C(=O)Nc2ccc3ccc(Cl)cc3n2)c1[N+](=O)[O-] ZINC000504270313 943566366 /nfs/dbraw/zinc/56/63/66/943566366.db2.gz HEZUFQYBJPOABI-UHFFFAOYSA-N 0 0 359.773 3.724 20 5 FHBDRN CCc1ccc(C(=O)N(Cc2ccccc2)C[C@@H](O)CC)cc1[N+](=O)[O-] ZINC000435707269 943569391 /nfs/dbraw/zinc/56/93/91/943569391.db2.gz RXHRLEUMKWTUTB-SFHVURJKSA-N 0 0 356.422 3.571 20 5 FHBDRN C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1cccc(NC(=O)C2CC2)c1 ZINC000504293752 943576566 /nfs/dbraw/zinc/57/65/66/943576566.db2.gz SOTYZCYBIXOPCF-LBPRGKRZSA-N 0 0 365.389 3.535 20 5 FHBDRN COc1ccc(CCCC(=O)N2c3ccc([N+](=O)[O-])cc3C[C@@H]2C)cc1 ZINC000504286113 943582204 /nfs/dbraw/zinc/58/22/04/943582204.db2.gz JGMHQMBTQMTOJW-AWEZNQCLSA-N 0 0 354.406 3.904 20 5 FHBDRN C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)[C@H]1Cc2cc(Cl)ccc2O1 ZINC000504286551 943582648 /nfs/dbraw/zinc/58/26/48/943582648.db2.gz PUKOPEMYQMPZIM-DYZYQPBXSA-N 0 0 358.781 3.530 20 5 FHBDRN Cc1ccc(OCCC(=O)N2c3ccc([N+](=O)[O-])cc3C[C@H]2C)cc1C ZINC000504286469 943582692 /nfs/dbraw/zinc/58/26/92/943582692.db2.gz OULKHVQBSAZWSM-OAHLLOKOSA-N 0 0 354.406 3.958 20 5 FHBDRN C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)[C@@H]1Cc2cc(Cl)ccc2O1 ZINC000504286550 943582822 /nfs/dbraw/zinc/58/28/22/943582822.db2.gz PUKOPEMYQMPZIM-BTDLBPIBSA-N 0 0 358.781 3.530 20 5 FHBDRN Cc1ccc(C(=O)CCC(=O)N2c3ccc([N+](=O)[O-])cc3C[C@@H]2C)s1 ZINC000504319128 943588591 /nfs/dbraw/zinc/58/85/91/943588591.db2.gz VPSUHIHZOFWHLJ-NSHDSACASA-N 0 0 358.419 3.905 20 5 FHBDRN Cc1ccc([C@@H]2C[C@H]2NC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])cc1 ZINC000843665513 943590556 /nfs/dbraw/zinc/59/05/56/943590556.db2.gz IIFMWQNZNIQAAG-XJKSGUPXSA-N 0 0 362.788 3.911 20 5 FHBDRN O=C(NCCc1ccccc1[N+](=O)[O-])N(Cc1ccccc1F)C1CC1 ZINC000074764147 943595470 /nfs/dbraw/zinc/59/54/70/943595470.db2.gz ADKALCYFWFMJLL-UHFFFAOYSA-N 0 0 357.385 3.651 20 5 FHBDRN O=C(c1n[nH]c2ccc([N+](=O)[O-])cc21)N1CCC[C@@H]1/C=C\c1ccccc1 ZINC000504336636 943599960 /nfs/dbraw/zinc/59/99/60/943599960.db2.gz OLWIECGOHGMYPB-WHLNPGIBSA-N 0 0 362.389 3.789 20 5 FHBDRN C[C@H](C(=O)Nc1ccc2nc(N(C)C)ccc2c1)c1cccc([N+](=O)[O-])c1 ZINC000515265588 943600863 /nfs/dbraw/zinc/60/08/63/943600863.db2.gz DDTRUMABRXQOGU-ZDUSSCGKSA-N 0 0 364.405 3.951 20 5 FHBDRN CC(C)[C@H](NC(=O)NCc1ccc([N+](=O)[O-])cc1Cl)C(F)(F)F ZINC000417427165 943603376 /nfs/dbraw/zinc/60/33/76/943603376.db2.gz PJCVKWCSRUTZES-NSHDSACASA-N 0 0 353.728 3.634 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)Nc2c(F)cccc2Cl)c1 ZINC000584784146 943603862 /nfs/dbraw/zinc/60/38/62/943603862.db2.gz MDSCXVZSRQCNIX-UHFFFAOYSA-N 0 0 358.778 3.805 20 5 FHBDRN COc1cc(C(=O)NCc2cccc(CSC)c2)c([N+](=O)[O-])cc1F ZINC001269557712 943629947 /nfs/dbraw/zinc/62/99/47/943629947.db2.gz YSLWVSJXNZSKHS-UHFFFAOYSA-N 0 0 364.398 3.536 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N1CCOC[C@@H]1CC1CCC1 ZINC000584802446 943634899 /nfs/dbraw/zinc/63/48/99/943634899.db2.gz WOHOUXPPPYKSSL-HNNXBMFYSA-N 0 0 372.343 3.645 20 5 FHBDRN O=c1c(Cl)cc(C(F)(F)F)cn1Cc1c(F)cccc1[N+](=O)[O-] ZINC000504502150 943646956 /nfs/dbraw/zinc/64/69/56/943646956.db2.gz HRWBXGFPIAGUGE-UHFFFAOYSA-N 0 0 350.655 3.616 20 5 FHBDRN O=[N+]([O-])c1cccc(F)c1CSc1nnnn1-c1ccc(Cl)cc1 ZINC000504501871 943646977 /nfs/dbraw/zinc/64/69/77/943646977.db2.gz FCUHAEFEKYBXPQ-UHFFFAOYSA-N 0 0 365.777 3.655 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCO[C@@H](C)C1 ZINC000504534364 943649976 /nfs/dbraw/zinc/64/99/76/943649976.db2.gz RGCPAZVSRMXJLB-STQMWFEESA-N 0 0 352.456 3.642 20 5 FHBDRN Cc1ccc(-n2nnnc2SCc2c(F)cccc2[N+](=O)[O-])cc1C ZINC000504537101 943651647 /nfs/dbraw/zinc/65/16/47/943651647.db2.gz YVOXECMLNSEJHZ-UHFFFAOYSA-N 0 0 359.386 3.619 20 5 FHBDRN O=C(NCCNc1ccccc1[N+](=O)[O-])[C@H]1C[C@@H]1c1ccccc1Cl ZINC000105376307 943686200 /nfs/dbraw/zinc/68/62/00/943686200.db2.gz WWAGGWNNNXXVMP-KGLIPLIRSA-N 0 0 359.813 3.580 20 5 FHBDRN Cc1ccc(CN(C)CC(=O)N(C)[C@H](C)c2ccccc2)cc1[N+](=O)[O-] ZINC000504575917 943689711 /nfs/dbraw/zinc/68/97/11/943689711.db2.gz TVUNOQXXTIXMJM-MRXNPFEDSA-N 0 0 355.438 3.555 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1OCC(=O)NC[C@@H](c1ccccc1)C(C)C ZINC000053312196 943689859 /nfs/dbraw/zinc/68/98/59/943689859.db2.gz UBACRNLQKLFZQR-QGZVFWFLSA-N 0 0 372.421 3.538 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)[C@@H]1CCCCO1 ZINC000504579043 943691442 /nfs/dbraw/zinc/69/14/42/943691442.db2.gz VEKRIMNZMCGEME-WFASDCNBSA-N 0 0 352.456 3.784 20 5 FHBDRN CC(C)n1cc([C@@H](C)NC(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)cn1 ZINC000584829922 943708565 /nfs/dbraw/zinc/70/85/65/943708565.db2.gz BUNQJRXFRKSFBA-SNVBAGLBSA-N 0 0 370.331 3.882 20 5 FHBDRN CC[C@@H](CSc1ccc(C)c(C)c1)NC(=O)c1[nH]nc(C)c1[N+](=O)[O-] ZINC000504655439 943718550 /nfs/dbraw/zinc/71/85/50/943718550.db2.gz RLOBVJCCFUNDNK-ZDUSSCGKSA-N 0 0 362.455 3.544 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1OC(=O)COc1cccc(C(F)(F)F)c1 ZINC000760018201 943731174 /nfs/dbraw/zinc/73/11/74/943731174.db2.gz NRYDTIYHHILAGP-UHFFFAOYSA-N 0 0 355.268 3.906 20 5 FHBDRN C[C@@H](C(=O)[O-])[C@H](C)[NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000417619850 943755147 /nfs/dbraw/zinc/75/51/47/943755147.db2.gz ZSEZUGSOTXSAFV-KGLIPLIRSA-N 0 0 357.410 3.562 20 5 FHBDRN COCCSc1ccc([C@@H](C)NC(=O)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000504694569 943759584 /nfs/dbraw/zinc/75/95/84/943759584.db2.gz JGRORIKRFVKORT-CQSZACIVSA-N 0 0 374.462 3.753 20 5 FHBDRN COCCSc1ccc([C@@H](C)NC(=O)c2ccc([N+](=O)[O-])s2)cc1 ZINC000504695036 943760199 /nfs/dbraw/zinc/76/01/99/943760199.db2.gz MCOVELYZIZNFNI-LLVKDONJSA-N 0 0 366.464 3.886 20 5 FHBDRN O=C([O-])C1(C[NH2+]Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)CCC1 ZINC000417630268 943768845 /nfs/dbraw/zinc/76/88/45/943768845.db2.gz XUGOXDJENKBWQR-UHFFFAOYSA-N 0 0 374.368 3.871 20 5 FHBDRN CCn1c([C@@H]2CCCS2)nnc1N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000424164489 943769404 /nfs/dbraw/zinc/76/94/04/943769404.db2.gz XEOMWQYXIKXTTR-INIZCTEOSA-N 0 0 373.482 3.943 20 5 FHBDRN C[C@@H]1C[C@H](C)CN(C(=O)c2cccc3c(=O)c4cccc(F)c4[nH]c23)C1 ZINC000435815406 943772566 /nfs/dbraw/zinc/77/25/66/943772566.db2.gz FHQFFJKPISMKMF-BETUJISGSA-N 0 0 352.409 3.939 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc3c(c2)CCCC(=O)N3)c1C ZINC001125910605 943775531 /nfs/dbraw/zinc/77/55/31/943775531.db2.gz PBLRHTUZQQAOCE-UHFFFAOYSA-N 0 0 353.378 3.739 20 5 FHBDRN O=C(N[C@H]1C[C@H](c2ccccc2)C1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000437401035 943778484 /nfs/dbraw/zinc/77/84/84/943778484.db2.gz TUQTYANFSHONHI-JOCQHMNTSA-N 0 0 362.332 3.872 20 5 FHBDRN C[C@H]1CCCN(C(=O)c2cc(F)cc3c(=O)c4cccc(F)c4[nH]c23)C1 ZINC000435814136 943787301 /nfs/dbraw/zinc/78/73/01/943787301.db2.gz QLZQJOHGHJJUQA-NSHDSACASA-N 0 0 356.372 3.832 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1C(F)(F)F)N1CC[C@@H](c2ccncc2)C1 ZINC000516877269 943787511 /nfs/dbraw/zinc/78/75/11/943787511.db2.gz SKTSBRXFMHQIDD-GFCCVEGCSA-N 0 0 365.311 3.638 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(-c2nc([C@@H]3CCO[C@H]3C(C)(C)C)no2)c1 ZINC000424219471 943790275 /nfs/dbraw/zinc/79/02/75/943790275.db2.gz AQOXCFHVZYHZHC-IUODEOHRSA-N 0 0 361.398 3.962 20 5 FHBDRN O=C([O-])[C@@H]1CCC[C@@H]1C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000417651958 943798008 /nfs/dbraw/zinc/79/80/08/943798008.db2.gz YJMYYONERLJRJH-CZUORRHYSA-N 0 0 360.435 3.914 20 5 FHBDRN CCN(Cc1cccc(F)c1)c1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-] ZINC000515352083 943801114 /nfs/dbraw/zinc/80/11/14/943801114.db2.gz QSLOPYNUGLCPTN-UHFFFAOYSA-N 0 0 357.385 3.653 20 5 FHBDRN C[C@@H]1CCN(C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)CC12CCC2 ZINC000408090556 943805634 /nfs/dbraw/zinc/80/56/34/943805634.db2.gz VHJVBKMZYJHZJM-OAHLLOKOSA-N 0 0 357.454 3.847 20 5 FHBDRN C[C@H](C(=O)N[C@H](CCO)c1ccc(Cl)cc1)c1cccc([N+](=O)[O-])c1 ZINC000584863740 943810751 /nfs/dbraw/zinc/81/07/51/943810751.db2.gz ZRORMMIIHPSSBW-YVEFUNNKSA-N 0 0 362.813 3.592 20 5 FHBDRN COc1cc(CNc2ccccc2OCC(F)F)c([N+](=O)[O-])cc1F ZINC000184018919 943819081 /nfs/dbraw/zinc/81/90/81/943819081.db2.gz CQFPIMDKEDXKGG-UHFFFAOYSA-N 0 0 356.300 3.999 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N[C@H]1C[C@H](c2cccc(Cl)c2)C1 ZINC000437452579 943822821 /nfs/dbraw/zinc/82/28/21/943822821.db2.gz XMABTAXVBVCKPZ-CTYIDZIISA-N 0 0 360.797 3.689 20 5 FHBDRN Cc1ccsc1-c1nnc(N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)n1C ZINC000584867627 943829903 /nfs/dbraw/zinc/82/99/03/943829903.db2.gz ZIMNEDOGAVMFGJ-UHFFFAOYSA-N 0 0 369.450 3.929 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])NC[C@@H]1CCC[C@H](C(F)(F)F)C1 ZINC000437460646 943830075 /nfs/dbraw/zinc/83/00/75/943830075.db2.gz HHDYTCKVBLLHTF-YPMHNXCESA-N 0 0 359.348 3.763 20 5 FHBDRN CC1(C)CN(C(=O)c2ccc([N+](=O)[O-])c3cccnc23)[C@@H]1c1ccncc1 ZINC000516929416 943838855 /nfs/dbraw/zinc/83/88/55/943838855.db2.gz YZYKEFGFMOHYAI-GOSISDBHSA-N 0 0 362.389 3.761 20 5 FHBDRN Cc1cccc(CNc2cc(C(F)(F)C(F)(F)F)ncc2[N+](=O)[O-])n1 ZINC000584879014 943848295 /nfs/dbraw/zinc/84/82/95/943848295.db2.gz UVQAMHJEVDYLPZ-UHFFFAOYSA-N 0 0 362.258 3.959 20 5 FHBDRN C[C@H](NC(=O)c1csc([N+](=O)[O-])c1)c1nc2ccccc2n1C(F)F ZINC000515401472 943850535 /nfs/dbraw/zinc/85/05/35/943850535.db2.gz WQVRQOGVYIBTGU-QMMMGPOBSA-N 0 0 366.349 3.892 20 5 FHBDRN CC(C)c1cccnc1NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000504844131 943854788 /nfs/dbraw/zinc/85/47/88/943854788.db2.gz VREXPNMLFAMEHN-UHFFFAOYSA-N 0 0 368.437 3.968 20 5 FHBDRN C[C@@H](NC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1)[C@@H]1CCCOC1 ZINC000504867537 943856326 /nfs/dbraw/zinc/85/63/26/943856326.db2.gz SCUAJNGBJATDPP-GDBMZVCRSA-N 0 0 369.421 3.883 20 5 FHBDRN COC1(CNC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)CCC1 ZINC000504867982 943858260 /nfs/dbraw/zinc/85/82/60/943858260.db2.gz XIMJTDGXMTZONS-UHFFFAOYSA-N 0 0 356.378 3.686 20 5 FHBDRN CCC[C@]1(C(F)(F)F)CCCN1C(=O)c1cccc(OC)c1[N+](=O)[O-] ZINC000435923694 943859108 /nfs/dbraw/zinc/85/91/08/943859108.db2.gz SYJCFQFOJJDCGD-OAHLLOKOSA-N 0 0 360.332 3.941 20 5 FHBDRN CCN(CCc1ccc(C(F)(F)F)cc1)C(=O)c1cc([N+](=O)[O-])cn1C ZINC000515413196 943859388 /nfs/dbraw/zinc/85/93/88/943859388.db2.gz AHBVGEKQGDUVHC-UHFFFAOYSA-N 0 0 369.343 3.657 20 5 FHBDRN C[C@H]1CCCC[C@@H]1c1nc(-c2ccc(-n3cncn3)c([N+](=O)[O-])c2)no1 ZINC000424359866 943866074 /nfs/dbraw/zinc/86/60/74/943866074.db2.gz IMSXWTBBPTXXDP-AAEUAGOBSA-N 0 0 354.370 3.519 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN(CC1CCC1)c1ccccc1 ZINC000437507268 943868566 /nfs/dbraw/zinc/86/85/66/943868566.db2.gz LQTPSOKVIVYRLT-UHFFFAOYSA-N 0 0 369.421 3.849 20 5 FHBDRN O=C(Nc1nccs1)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12 ZINC000435936346 943870181 /nfs/dbraw/zinc/87/01/81/943870181.db2.gz MEXCZWFBGYBYIZ-UHFFFAOYSA-N 0 0 357.341 3.668 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)[C@@H]1CCCOC1 ZINC000504895890 943893738 /nfs/dbraw/zinc/89/37/38/943893738.db2.gz AXYPBSVJXKEBRV-QWHCGFSZSA-N 0 0 352.456 3.642 20 5 FHBDRN CCOc1cc(C(=O)NC2CC(C(C)(C)C)C2)c([N+](=O)[O-])cc1OC ZINC000504918285 943897318 /nfs/dbraw/zinc/89/73/18/943897318.db2.gz JDNUVJKPAKUEKB-UHFFFAOYSA-N 0 0 350.415 3.557 20 5 FHBDRN C[C@@H](C(=O)NCCc1nc(C(C)(C)C)cs1)c1cccc([N+](=O)[O-])c1 ZINC000515450894 943905976 /nfs/dbraw/zinc/90/59/76/943905976.db2.gz IIPMGCMWXFQCPS-GFCCVEGCSA-N 0 0 361.467 3.811 20 5 FHBDRN C[C@H]1C[C@H](CCNC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])CCO1 ZINC000541500919 943910436 /nfs/dbraw/zinc/91/04/36/943910436.db2.gz DNLOQPFAFATFKX-NWDGAFQWSA-N 0 0 372.874 3.662 20 5 FHBDRN COc1cccc(C(=O)N2CC=C(c3c(F)cccc3F)CC2)c1[N+](=O)[O-] ZINC000435988254 943913623 /nfs/dbraw/zinc/91/36/23/943913623.db2.gz FYKIHDSTTORHHN-UHFFFAOYSA-N 0 0 374.343 3.811 20 5 FHBDRN CC(C)(C)C1CC(NC(=O)c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000504941867 943918539 /nfs/dbraw/zinc/91/85/39/943918539.db2.gz GSLBGRXHDNRYTA-UHFFFAOYSA-N 0 0 355.232 3.912 20 5 FHBDRN COc1ccc([C@@H]2CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4o3)C2)cc1 ZINC000504926082 943923869 /nfs/dbraw/zinc/92/38/69/943923869.db2.gz WVNINBSZVMLMLY-CQSZACIVSA-N 0 0 366.373 3.979 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)Nc1n[nH]c2c1cccc2Cl ZINC000436000058 943931383 /nfs/dbraw/zinc/93/13/83/943931383.db2.gz KKWYGRMHNAIUCL-UHFFFAOYSA-N 0 0 365.176 3.959 20 5 FHBDRN O=[N+]([O-])c1cc(CN2CCN(Cc3nc4ccccc4s3)CC2)cs1 ZINC000506069604 943934633 /nfs/dbraw/zinc/93/46/33/943934633.db2.gz DADBSQYOEQXANU-UHFFFAOYSA-N 0 0 374.491 3.584 20 5 FHBDRN CC1=C[C@H](C)CN(C(=O)c2ccc(N3CCC[C@@H](C)C3)c([N+](=O)[O-])c2)C1 ZINC000436002699 943935810 /nfs/dbraw/zinc/93/58/10/943935810.db2.gz RAMDHTTYBQDMSB-CABCVRRESA-N 0 0 357.454 3.869 20 5 FHBDRN COc1cccc(C(=O)Nc2ccc(F)cc2-n2cccc2)c1[N+](=O)[O-] ZINC000436021051 943940215 /nfs/dbraw/zinc/94/02/15/943940215.db2.gz GZILKVFIPXPRRR-UHFFFAOYSA-N 0 0 355.325 3.786 20 5 FHBDRN COc1ccc2c(c1)C[C@@H](C)N(C(=O)c1cccc(OC)c1[N+](=O)[O-])[C@H]2C ZINC000436020919 943941342 /nfs/dbraw/zinc/94/13/42/943941342.db2.gz MOIHZSGAGJYNHQ-OLZOCXBDSA-N 0 0 370.405 3.760 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(C1CC1)C1CCC(C)CC1 ZINC000515514405 943946017 /nfs/dbraw/zinc/94/60/17/943946017.db2.gz RWMPHPNPETWRTC-UHFFFAOYSA-N 0 0 352.456 3.635 20 5 FHBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N[C@@H](CC(F)(F)F)c2ccccc2)c1 ZINC000515518013 943949808 /nfs/dbraw/zinc/94/98/08/943949808.db2.gz OQZDYVYBJLRRBJ-AWEZNQCLSA-N 0 0 374.340 3.567 20 5 FHBDRN COc1ccccc1O[C@@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000517046725 943949786 /nfs/dbraw/zinc/94/97/86/943949786.db2.gz IFUFLDQKSXLHDI-MRXNPFEDSA-N 0 0 370.405 3.595 20 5 FHBDRN CCOc1cccc2c1OCC(c1nc(-c3cccc([N+](=O)[O-])c3)no1)=C2 ZINC000504981728 943950580 /nfs/dbraw/zinc/95/05/80/943950580.db2.gz XHHLGJMSVQQXKB-UHFFFAOYSA-N 0 0 365.345 3.977 20 5 FHBDRN CSc1ccc(NS(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1 ZINC000014871259 943952860 /nfs/dbraw/zinc/95/28/60/943952860.db2.gz KZVDBZQYFLCNJH-UHFFFAOYSA-N 0 0 358.828 3.771 20 5 FHBDRN COC[C@@H](C)Nc1ccccc1NC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000437613858 943970444 /nfs/dbraw/zinc/97/04/44/943970444.db2.gz CJKSFDRDFRRCBT-GFCCVEGCSA-N 0 0 368.393 3.775 20 5 FHBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])N[C@@H]1C[C@H]1c1ccccc1 ZINC000436048365 943971419 /nfs/dbraw/zinc/97/14/19/943971419.db2.gz GRNZLWRVROHBOU-LSDHHAIUSA-N 0 0 360.797 3.689 20 5 FHBDRN C[C@@H](Oc1cccc2ccccc21)C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000436048066 943971436 /nfs/dbraw/zinc/97/14/36/943971436.db2.gz UUXILBXNTMAAEM-OAHLLOKOSA-N 0 0 364.401 3.874 20 5 FHBDRN CCC[C@@H]1C[C@H]1NC(=O)c1cc(F)cc2c(=O)c3cccc(F)c3[nH]c12 ZINC000436048709 943972124 /nfs/dbraw/zinc/97/21/24/943972124.db2.gz WKODLMXYTXBWSB-QLJPJBMISA-N 0 0 356.372 3.878 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N(C)Cc1cccc2ccccc21 ZINC000515523500 943975906 /nfs/dbraw/zinc/97/59/06/943975906.db2.gz NOZQCOMKEHRJJI-UHFFFAOYSA-N 0 0 370.430 3.877 20 5 FHBDRN Cc1ccc(Cn2c(=O)oc3ccc([N+](=O)[O-])cc32)cc1Br ZINC000437629556 943976585 /nfs/dbraw/zinc/97/65/85/943976585.db2.gz YRMQXYBPLZMJKT-UHFFFAOYSA-N 0 0 363.167 3.622 20 5 FHBDRN CC(C)(C)[C@@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1 ZINC000515524236 943976918 /nfs/dbraw/zinc/97/69/18/943976918.db2.gz BCLMQUPIXNEGOO-INIZCTEOSA-N 0 0 366.414 3.800 20 5 FHBDRN COC(=O)c1ccc(CCNc2ccc3ncccc3c2[N+](=O)[O-])cc1 ZINC000515546344 943979824 /nfs/dbraw/zinc/97/98/24/943979824.db2.gz YODKOOUAOFSHHI-UHFFFAOYSA-N 0 0 351.362 3.584 20 5 FHBDRN COc1ccc(Cl)cc1NCCc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000505025129 943982605 /nfs/dbraw/zinc/98/26/05/943982605.db2.gz QLICACSABOKHQY-UHFFFAOYSA-N 0 0 374.784 3.961 20 5 FHBDRN Cc1cnc(NC(=O)c2cc(F)cc3c(=O)c4cc(F)ccc4[nH]c23)s1 ZINC000436066236 943986108 /nfs/dbraw/zinc/98/61/08/943986108.db2.gz DCGOFZDPFVMIGR-UHFFFAOYSA-N 0 0 371.368 3.977 20 5 FHBDRN O=[N+]([O-])c1ccc2nc(N3CCC[C@H](OCC(F)(F)F)C3)ccc2c1 ZINC000515555174 943990242 /nfs/dbraw/zinc/99/02/42/943990242.db2.gz WARXDZYSFGISDW-ZDUSSCGKSA-N 0 0 355.316 3.691 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1C(F)(F)F)N1CCc2c1cccc2F ZINC000500039076 943992197 /nfs/dbraw/zinc/99/21/97/943992197.db2.gz NYWRWUPOXHIRCS-UHFFFAOYSA-N 0 0 354.259 3.956 20 5 FHBDRN COc1cc([C@@H](C)NCc2ccc(Br)cc2[N+](=O)[O-])ccn1 ZINC000425460271 944006482 /nfs/dbraw/zinc/00/64/82/944006482.db2.gz RCBGLILSSLKJAO-SNVBAGLBSA-N 0 0 366.215 3.612 20 5 FHBDRN CC(C)CCSc1ccc(C(=O)N2CCSCC2)cc1[N+](=O)[O-] ZINC000515557696 944009187 /nfs/dbraw/zinc/00/91/87/944009187.db2.gz AQLVHOAKLDOOGG-UHFFFAOYSA-N 0 0 354.497 3.922 20 5 FHBDRN Cc1cc(CN(C)C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)ccc1F ZINC000436078525 944011511 /nfs/dbraw/zinc/01/15/11/944011511.db2.gz QXHLKGBHJPAMIT-UHFFFAOYSA-N 0 0 368.368 3.500 20 5 FHBDRN CC(C)[C@H](C(=O)[O-])[C@H](C)[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000424621549 944016120 /nfs/dbraw/zinc/01/61/20/944016120.db2.gz OBPZEGVGCFXVGU-NHYWBVRUSA-N 0 0 363.439 3.553 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H](C)c1ncc(Br)cn1 ZINC000559863744 944023063 /nfs/dbraw/zinc/02/30/63/944023063.db2.gz LXGYNYAFXULEND-QWRGUYRKSA-N 0 0 365.231 3.868 20 5 FHBDRN CC[C@@H](NC(=O)NCCNc1ccc([N+](=O)[O-])cc1)c1ccc(C)cc1 ZINC000505085921 944025527 /nfs/dbraw/zinc/02/55/27/944025527.db2.gz RCBIXUIPCDLSSM-GOSISDBHSA-N 0 0 356.426 3.766 20 5 FHBDRN O=C(N[C@@H]1CCOc2c(-c3ccccc3)cccc21)c1ccc([N+](=O)[O-])[nH]1 ZINC000505085939 944025942 /nfs/dbraw/zinc/02/59/42/944025942.db2.gz RHJAKYLDTRIAJA-MRXNPFEDSA-N 0 0 363.373 3.844 20 5 FHBDRN CC(C)[C@H]1CCC[C@@H](NC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)C1 ZINC000505067444 944026317 /nfs/dbraw/zinc/02/63/17/944026317.db2.gz CBBLBNGMMDRQNM-GOEBONIOSA-N 0 0 356.426 3.725 20 5 FHBDRN O=C1CCc2cc(Oc3ccc([N+](=O)[O-])c(OC(F)F)c3)ccc2N1 ZINC000092584729 944031480 /nfs/dbraw/zinc/03/14/80/944031480.db2.gz ZUAFAHVDXZYBTE-UHFFFAOYSA-N 0 0 350.277 3.873 20 5 FHBDRN Cc1sc(C(=O)N2C[C@H]3CCCCN3c3ccccc32)cc1[N+](=O)[O-] ZINC000566553349 944033719 /nfs/dbraw/zinc/03/37/19/944033719.db2.gz MWVVCCNGENWRFO-CYBMUJFWSA-N 0 0 357.435 3.984 20 5 FHBDRN O=C(c1ccc2[nH]c3ccccc3c(=O)c2c1)N(Cc1ccncc1)C1CC1 ZINC000436133993 944045761 /nfs/dbraw/zinc/04/57/61/944045761.db2.gz NOWIGIISIPXHBM-UHFFFAOYSA-N 0 0 369.424 3.881 20 5 FHBDRN O=[N+]([O-])c1cccnc1N[C@H]1CCN(c2cccc(OC(F)(F)F)c2)C1 ZINC000511652478 944050479 /nfs/dbraw/zinc/05/04/79/944050479.db2.gz DIWOSCBNOKJNTO-NSHDSACASA-N 0 0 368.315 3.579 20 5 FHBDRN COc1ccc(CC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)c(F)c1 ZINC000436140906 944051699 /nfs/dbraw/zinc/05/16/99/944051699.db2.gz LQASUFWIMCHNLN-UHFFFAOYSA-N 0 0 360.385 3.722 20 5 FHBDRN CCOc1cc(C(=O)NCc2ccc([C@H]3C[C@@H]3C)o2)c([N+](=O)[O-])cc1OC ZINC000515620380 944054700 /nfs/dbraw/zinc/05/47/00/944054700.db2.gz SUOPGFSDPNOUJA-AAEUAGOBSA-N 0 0 374.393 3.649 20 5 FHBDRN Cn1cc([N+](=O)[O-])cc1C(=O)N(Cc1cccs1)c1ccc(F)cc1 ZINC000515628720 944061337 /nfs/dbraw/zinc/06/13/37/944061337.db2.gz JGLPEYQJEKFHLN-UHFFFAOYSA-N 0 0 359.382 3.981 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)Nc2cc3[nH]ccc3cc2C)c1 ZINC000436162283 944066024 /nfs/dbraw/zinc/06/60/24/944066024.db2.gz RFHXQZAUKZSTFQ-UHFFFAOYSA-N 0 0 359.407 3.802 20 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ZINC000760020390 944095319 /nfs/dbraw/zinc/09/53/19/944095319.db2.gz YDWRUEVQOYATKM-WFASDCNBSA-N 0 0 354.362 3.717 20 5 FHBDRN CC(=O)[C@@H](Cc1ccc(F)c(F)c1F)Sc1ccc([N+](=O)[O-])cn1 ZINC000436209234 944101502 /nfs/dbraw/zinc/10/15/02/944101502.db2.gz KDCTVKXAIJSYJY-GFCCVEGCSA-N 0 0 356.325 3.700 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1OC(=O)COc1cccc(Br)c1 ZINC000760019386 944106746 /nfs/dbraw/zinc/10/67/46/944106746.db2.gz SSLPUEZALUYWFZ-UHFFFAOYSA-N 0 0 366.167 3.650 20 5 FHBDRN CC1CCC(N(C)C(=O)CNc2cc([N+](=O)[O-])ccc2OC(F)F)CC1 ZINC000515664854 944108494 /nfs/dbraw/zinc/10/84/94/944108494.db2.gz NCUBMHMEIVBLLP-UHFFFAOYSA-N 0 0 371.384 3.645 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc2oc(CO)cc2c1 ZINC000515684288 944112315 /nfs/dbraw/zinc/11/23/15/944112315.db2.gz JBNMEHRDSBPSAV-LLVKDONJSA-N 0 0 372.402 3.953 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)c2[nH]nc3ccc(Cl)cc32)cc1[N+](=O)[O-] ZINC000500108389 944113555 /nfs/dbraw/zinc/11/35/55/944113555.db2.gz UXCYYMYLUNFVJY-SNVBAGLBSA-N 0 0 358.785 3.924 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)c1[nH]nc2ccc(Cl)cc21 ZINC000505189553 944119087 /nfs/dbraw/zinc/11/90/87/944119087.db2.gz IDWVAKIRUAYTPA-UHFFFAOYSA-N 0 0 365.176 3.708 20 5 FHBDRN O=[N+]([O-])c1nn(Cc2nc(-c3ccccc3)cs2)cc1Br ZINC000436213005 944121857 /nfs/dbraw/zinc/12/18/57/944121857.db2.gz WVICUOKYXJNZIR-UHFFFAOYSA-N 0 0 365.212 3.726 20 5 FHBDRN CC(C)n1cnnc1[C@H]1CCCN(c2ccc([N+](=O)[O-])c3cccnc32)C1 ZINC000092655527 944122379 /nfs/dbraw/zinc/12/23/79/944122379.db2.gz LMKZIWFCLLZMHW-AWEZNQCLSA-N 0 0 366.425 3.699 20 5 FHBDRN CCOc1ccc(C(=O)N(CCOC)[C@H](C)c2ccccc2)cc1[N+](=O)[O-] ZINC000500115549 944122424 /nfs/dbraw/zinc/12/24/24/944122424.db2.gz AJMGCRJGINJBCJ-OAHLLOKOSA-N 0 0 372.421 3.843 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1CCC[C@@H]1C1CCCCC1 ZINC000515706708 944131669 /nfs/dbraw/zinc/13/16/69/944131669.db2.gz GKWWHVJMNWHRBZ-OAHLLOKOSA-N 0 0 352.456 3.637 20 5 FHBDRN COc1cc(CCNc2ccc([N+](=O)[O-])c(OC(F)F)c2)ccc1O ZINC000092654554 944131802 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COc1cccc(NC2CCN(c3cc([N+](=O)[O-])ccc3C(C)=O)CC2)c1 ZINC000566581805 944168712 /nfs/dbraw/zinc/16/87/12/944168712.db2.gz PBJFPTPGWJMMJP-UHFFFAOYSA-N 0 0 369.421 3.887 20 5 FHBDRN COc1ccc(CNC(=O)CCSc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000515732484 944170132 /nfs/dbraw/zinc/17/01/32/944170132.db2.gz WUHXFFJXHGGJDG-UHFFFAOYSA-N 0 0 364.398 3.541 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)F)cc1Sc1ncn(-c2ccccc2)n1 ZINC000436273929 944172517 /nfs/dbraw/zinc/17/25/17/944172517.db2.gz LMMJIEDOTCAULW-UHFFFAOYSA-N 0 0 367.312 3.741 20 5 FHBDRN CC[C@@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1F)c1cccc(Cl)c1 ZINC000515736512 944173239 /nfs/dbraw/zinc/17/32/39/944173239.db2.gz LRLSTCXWQCNUCP-CQSZACIVSA-N 0 0 372.805 3.817 20 5 FHBDRN CCN(CCNC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1)c1cccc(C)c1 ZINC000515749269 944176885 /nfs/dbraw/zinc/17/68/85/944176885.db2.gz KGCRTWXBGNPTDC-INIZCTEOSA-N 0 0 370.453 3.790 20 5 FHBDRN COC[C@H](NC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1)c1ccccc1 ZINC000436343778 944219774 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CCCN(C[C@H]1CCCCO1)C(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000517351934 944236901 /nfs/dbraw/zinc/23/69/01/944236901.db2.gz ZLJSLLCPIOYBNY-GOEBONIOSA-N 0 0 366.483 3.883 20 5 FHBDRN COC(=O)c1cc(NC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)c(C)c([N+](=O)[O-])c1 ZINC000515817584 944237627 /nfs/dbraw/zinc/23/76/27/944237627.db2.gz ZPHPOCOGCUFXMW-LSDHHAIUSA-N 0 0 372.352 3.571 20 5 FHBDRN CN(C(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12)C1C2CC3CC(C2)CC1C3 ZINC000515826407 944244896 /nfs/dbraw/zinc/24/48/96/944244896.db2.gz LNCWNJLQOUUYJW-UHFFFAOYSA-N 0 0 353.422 3.973 20 5 FHBDRN COc1ccc([C@@H]2Nc3ccccc3C(=O)N2CC(C)C)cc1[N+](=O)[O-] ZINC000517370676 944250533 /nfs/dbraw/zinc/25/05/33/944250533.db2.gz LLBAVCNXGXXJSN-GOSISDBHSA-N 0 0 355.394 3.826 20 5 FHBDRN CCOc1ccc(CN(C)C(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)cc1 ZINC000543889640 944252476 /nfs/dbraw/zinc/25/24/76/944252476.db2.gz BELBBMAKGVOJNC-UHFFFAOYSA-N 0 0 359.382 3.666 20 5 FHBDRN Cn1cc(-c2noc(/C=C\c3cccc([N+](=O)[O-])c3)n2)c(C(F)(F)F)n1 ZINC000426257197 944255623 /nfs/dbraw/zinc/25/56/23/944255623.db2.gz QXBDVGOUCWPMPF-WAYWQWQTSA-N 0 0 365.271 3.568 20 5 FHBDRN CCOC(=O)Cc1cccc(Nc2cc(C(F)(F)F)ncc2[N+](=O)[O-])c1 ZINC000436388823 944257477 /nfs/dbraw/zinc/25/74/77/944257477.db2.gz LWJNFHJRYVYQME-UHFFFAOYSA-N 0 0 369.299 3.858 20 5 FHBDRN CC(C)(C(=O)N[C@H]1CCO[C@@H](c2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000500201266 944259438 /nfs/dbraw/zinc/25/94/38/944259438.db2.gz XLDMMOVPGWXQRV-QFBILLFUSA-N 0 0 368.433 3.909 20 5 FHBDRN O=C(CC1CCCCC1)NCCNc1cc(C(F)(F)F)ncc1[N+](=O)[O-] ZINC000436396186 944272761 /nfs/dbraw/zinc/27/27/61/944272761.db2.gz ZDMPXJUQXONLIQ-UHFFFAOYSA-N 0 0 374.363 3.507 20 5 FHBDRN CC(C)NC(=O)[C@H]1CCC[C@H](Nc2cc(C(F)(F)F)ncc2[N+](=O)[O-])C1 ZINC000436398499 944274241 /nfs/dbraw/zinc/27/42/41/944274241.db2.gz VEIYMTYVTVDVKG-QWRGUYRKSA-N 0 0 374.363 3.504 20 5 FHBDRN C[C@@H](NCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)c1ncn(C)n1 ZINC000436416793 944288454 /nfs/dbraw/zinc/28/84/54/944288454.db2.gz YMKVGPALDYZLKX-GFCCVEGCSA-N 0 0 371.372 3.506 20 5 FHBDRN Cc1ccc(CNc2ccc(Cl)cc2[N+](=O)[O-])cc1S(C)(=O)=O ZINC000436420378 944294818 /nfs/dbraw/zinc/29/48/18/944294818.db2.gz FDONTYCYUGVWEA-UHFFFAOYSA-N 0 0 354.815 3.572 20 5 FHBDRN C[C@H](c1ccccc1[N+](=O)[O-])N(C)[C@H]1CCN(c2ccccc2F)C1=O ZINC000436423828 944296764 /nfs/dbraw/zinc/29/67/64/944296764.db2.gz AWKXFHNJLKFFNQ-ACJLOTCBSA-N 0 0 357.385 3.532 20 5 FHBDRN CC(C)CC[C@@](C)(O)CNC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000438033312 944298743 /nfs/dbraw/zinc/29/87/43/944298743.db2.gz XUYGLIMTXGCPFI-OAHLLOKOSA-N 0 0 362.348 3.531 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)Nc2ccc(-n3ccnc3)nc2)cc1[N+](=O)[O-] ZINC000025011334 944307532 /nfs/dbraw/zinc/30/75/32/944307532.db2.gz RMOPTQBPDUWCGK-UHFFFAOYSA-N 0 0 365.393 3.725 20 5 FHBDRN COC(=O)c1cc(Oc2ccnc(Cc3ccccc3)n2)ccc1[N+](=O)[O-] ZINC000184037896 944308226 /nfs/dbraw/zinc/30/82/26/944308226.db2.gz OONPSGMYRFSBLU-UHFFFAOYSA-N 0 0 365.345 3.555 20 5 FHBDRN Cc1ccc(NC[C@@H](CO)Cc2cc(F)c(F)c(F)c2)c([N+](=O)[O-])c1 ZINC000436427212 944311405 /nfs/dbraw/zinc/31/14/05/944311405.db2.gz ZXRDKYVFQOTFDU-LBPRGKRZSA-N 0 0 354.328 3.584 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN(CCc1cccc(F)c1)C1CC1 ZINC000506479750 944316492 /nfs/dbraw/zinc/31/64/92/944316492.db2.gz JMEQYSVTOZYNRB-UHFFFAOYSA-N 0 0 371.412 3.688 20 5 FHBDRN COc1cc(NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)ccc1O ZINC000438075982 944317730 /nfs/dbraw/zinc/31/77/30/944317730.db2.gz JKRJJDSUKFLXAD-UHFFFAOYSA-N 0 0 371.374 3.685 20 5 FHBDRN Cc1cccc(C)c1-n1nnnc1CSCc1ccc([N+](=O)[O-])cc1 ZINC000105633922 944321756 /nfs/dbraw/zinc/32/17/56/944321756.db2.gz QXAJKSINWLAJPS-UHFFFAOYSA-N 0 0 355.423 3.621 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)N2CCCC[C@H]2c2cccc(Cl)c2)n1 ZINC000436447099 944323333 /nfs/dbraw/zinc/32/33/33/944323333.db2.gz ADHJSJHPWKTECR-AWEZNQCLSA-N 0 0 362.817 3.832 20 5 FHBDRN CC[C@]1(C)CCN(C(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C1 ZINC000426275261 944327640 /nfs/dbraw/zinc/32/76/40/944327640.db2.gz NVQQEPPNFTZQPQ-OAHLLOKOSA-N 0 0 359.348 3.945 20 5 FHBDRN CC(C)NC(=O)c1ccc(NC[C@@H]2CCc3ccccc32)c([N+](=O)[O-])c1 ZINC000518399984 944338834 /nfs/dbraw/zinc/33/88/34/944338834.db2.gz YXCLAZYNDXGXJP-INIZCTEOSA-N 0 0 353.422 3.875 20 5 FHBDRN CNC(=O)c1ccc(NCc2ccc(Cl)cc2Cl)c([N+](=O)[O-])c1 ZINC000053548688 944342735 /nfs/dbraw/zinc/34/27/35/944342735.db2.gz SBIBAYOXDMKBHC-UHFFFAOYSA-N 0 0 354.193 3.873 20 5 FHBDRN CCOc1ccc([C@@H]2CCCN2c2ccc(C(=O)NC)cc2[N+](=O)[O-])cc1 ZINC000053552889 944343253 /nfs/dbraw/zinc/34/32/53/944343253.db2.gz YLEMUNISFHVKLP-KRWDZBQOSA-N 0 0 369.421 3.695 20 5 FHBDRN CNC(=O)c1ccc(NCc2cccc(C(F)(F)F)c2)c([N+](=O)[O-])c1 ZINC000053549235 944343585 /nfs/dbraw/zinc/34/35/85/944343585.db2.gz ATNJYJSNBYUJLT-UHFFFAOYSA-N 0 0 353.300 3.585 20 5 FHBDRN CNC(=O)c1ccc(Sc2ncc(-c3ccccc3)n2C)c([N+](=O)[O-])c1 ZINC000053552018 944343695 /nfs/dbraw/zinc/34/36/95/944343695.db2.gz NDOPRMMQGAWODO-UHFFFAOYSA-N 0 0 368.418 3.506 20 5 FHBDRN CNC(=O)c1ccc(N[C@H](c2ccc(OC)cc2)C(C)C)c([N+](=O)[O-])c1 ZINC000053553151 944344121 /nfs/dbraw/zinc/34/41/21/944344121.db2.gz MFHGHNBMHPUYSH-SFHVURJKSA-N 0 0 357.410 3.772 20 5 FHBDRN Cc1nn([C@H](C)C(=O)N[C@@H](C)c2ccc(Cl)cc2Cl)cc1[N+](=O)[O-] ZINC000436472845 944352002 /nfs/dbraw/zinc/35/20/02/944352002.db2.gz ARGRJKDXGJBTBI-WCBMZHEXSA-N 0 0 371.224 3.845 20 5 FHBDRN CO[C@@]1(C)C[C@@H](N(C)C(=O)c2cc(SC)ccc2[N+](=O)[O-])C1(C)C ZINC000437770762 944356910 /nfs/dbraw/zinc/35/69/10/944356910.db2.gz GJMIODSCHFWSBY-PBHICJAKSA-N 0 0 352.456 3.592 20 5 FHBDRN Nc1ccc(C(=O)N[C@@H](Cc2ccccc2)c2ccccc2)cc1[N+](=O)[O-] ZINC000025283326 944362147 /nfs/dbraw/zinc/36/21/47/944362147.db2.gz IOGZGHARFHIHQE-IBGZPJMESA-N 0 0 361.401 3.891 20 5 FHBDRN CCCCn1cc(C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)c(C)n1 ZINC000473755586 944366142 /nfs/dbraw/zinc/36/61/42/944366142.db2.gz GNWTWIOLRRHMLX-UHFFFAOYSA-N 0 0 358.442 3.951 20 5 FHBDRN CN(Cc1cccc(C(N)=O)c1)C(=O)c1cc2ccccc2c2cccnc12 ZINC000108440577 944368344 /nfs/dbraw/zinc/36/83/44/944368344.db2.gz KOWWIUQFDSJVPW-UHFFFAOYSA-N 0 0 369.424 3.759 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H](c1cccs1)C(C)(C)CO ZINC000436484917 944368514 /nfs/dbraw/zinc/36/85/14/944368514.db2.gz DJGVDNHZJFBUJT-OAHLLOKOSA-N 0 0 363.439 3.846 20 5 FHBDRN CC[C@H]1C[C@@]1(NC(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-])c1cccc(C)c1 ZINC000506181868 944370678 /nfs/dbraw/zinc/37/06/78/944370678.db2.gz BYQPKMYFFFYXLK-DJJJIMSYSA-N 0 0 356.426 3.805 20 5 FHBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)c1ncsc1-c1ccccc1 ZINC000438161614 944372818 /nfs/dbraw/zinc/37/28/18/944372818.db2.gz XNMOQJOKPVVZRD-UHFFFAOYSA-N 0 0 353.403 3.691 20 5 FHBDRN Cc1cc(NC(=O)N[C@H](c2cccs2)C(C)(C)CO)ccc1[N+](=O)[O-] ZINC000436508798 944378876 /nfs/dbraw/zinc/37/88/76/944378876.db2.gz JBURRZMXGKPNSX-OAHLLOKOSA-N 0 0 363.439 3.846 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(Br)cc1O ZINC000123608399 944380112 /nfs/dbraw/zinc/38/01/12/944380112.db2.gz QFECOHZQHDFZIU-UHFFFAOYSA-N 0 0 351.156 3.624 20 5 FHBDRN Cc1cc(F)cc(C(=O)NC[C@@]2(C)CCOC3(CCC3)C2)c1[N+](=O)[O-] ZINC000894661169 944383700 /nfs/dbraw/zinc/38/37/00/944383700.db2.gz BYZTZZUPBFFSCQ-KRWDZBQOSA-N 0 0 350.390 3.512 20 5 FHBDRN COc1cc(CNC(=O)Nc2ccc([N+](=O)[O-])c(C)c2)c2ccccc2n1 ZINC000473767782 944384748 /nfs/dbraw/zinc/38/47/48/944384748.db2.gz INXMTYVSQOCVQO-UHFFFAOYSA-N 0 0 366.377 3.782 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)NCCSCc1ccc(C)cc1 ZINC000015031988 944385406 /nfs/dbraw/zinc/38/54/06/944385406.db2.gz IBLJXJKLODUGSZ-UHFFFAOYSA-N 0 0 360.435 3.575 20 5 FHBDRN O=C(COc1cccc([N+](=O)[O-])c1)Nc1nc(-c2ccccc2F)cs1 ZINC000515977324 944389385 /nfs/dbraw/zinc/38/93/85/944389385.db2.gz UKZWZIBDYMTTMP-UHFFFAOYSA-N 0 0 373.365 3.875 20 5 FHBDRN CN(CCCOc1cccc(Cl)c1)C(=O)c1cc(F)cc([N+](=O)[O-])c1 ZINC000517558004 944389466 /nfs/dbraw/zinc/38/94/66/944389466.db2.gz XAGPBTYYZUCAPA-UHFFFAOYSA-N 0 0 366.776 3.928 20 5 FHBDRN Cc1cccc(C(=O)N2CCCC2)c1NC(=O)c1cc(F)cc([N+](=O)[O-])c1 ZINC000517557998 944389535 /nfs/dbraw/zinc/38/95/35/944389535.db2.gz WULBKHQRVLVJAZ-UHFFFAOYSA-N 0 0 371.368 3.531 20 5 FHBDRN COc1ccccc1[C@]1(C)C[C@@H]1NC(=O)Nc1ccc([N+](=O)[O-])c(C)c1 ZINC000473765628 944392691 /nfs/dbraw/zinc/39/26/91/944392691.db2.gz BKCONBWWFBXPHP-HKUYNNGSSA-N 0 0 355.394 3.764 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1cnc2onc(C(C)(C)C)c2c1 ZINC000515982282 944395416 /nfs/dbraw/zinc/39/54/16/944395416.db2.gz QOLQOQVLNVLIMD-UHFFFAOYSA-N 0 0 368.393 3.701 20 5 FHBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCCC3(CCCCC3)C2)c(Cl)c1 ZINC000518442606 944396521 /nfs/dbraw/zinc/39/65/21/944396521.db2.gz YCGXXXGEUBIZPM-UHFFFAOYSA-N 0 0 372.874 3.983 20 5 FHBDRN CCn1nc(C)c([N+](=O)[O-])c1N1CC[C@](F)(c2cccc(Cl)c2)C1 ZINC000509527828 944397277 /nfs/dbraw/zinc/39/72/77/944397277.db2.gz UNIYCHIQGDRVBK-MRXNPFEDSA-N 0 0 352.797 3.848 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCc1nc2ccccc2[nH]1 ZINC000506185580 944400557 /nfs/dbraw/zinc/40/05/57/944400557.db2.gz CHBNAQUWYRKWTG-UHFFFAOYSA-N 0 0 370.434 3.903 20 5 FHBDRN O=[N+]([O-])c1cnn([C@H]2CCCN(Cc3cccn3Cc3cccs3)C2)c1 ZINC000364343581 944402655 /nfs/dbraw/zinc/40/26/55/944402655.db2.gz WXXSTXIELOLBJQ-INIZCTEOSA-N 0 0 371.466 3.540 20 5 FHBDRN Cc1sc(CNc2c(Br)cncc2[N+](=O)[O-])nc1C(C)C ZINC000500278433 944403522 /nfs/dbraw/zinc/40/35/22/944403522.db2.gz HVFBAOAFOKPEPE-UHFFFAOYSA-N 0 0 371.260 3.675 20 5 FHBDRN Cc1ccc(F)c2c1CCCN2C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000517594269 944411758 /nfs/dbraw/zinc/41/17/58/944411758.db2.gz QTSVOBNJBUJMOT-UHFFFAOYSA-N 0 0 367.380 3.976 20 5 FHBDRN Cc1ccc(CN(C(C)C)S(=O)(=O)c2c(F)cccc2[N+](=O)[O-])s1 ZINC000123763297 944418457 /nfs/dbraw/zinc/41/84/57/944418457.db2.gz NBANOHYUSUAIGV-UHFFFAOYSA-N 0 0 372.443 3.703 20 5 FHBDRN CO[C@@H](c1ccccc1F)[C@H](C)NC(=O)Nc1ccc([N+](=O)[O-])c(C)c1 ZINC000473776323 944423674 /nfs/dbraw/zinc/42/36/74/944423674.db2.gz NAPXZGXNPPTOIK-YVEFUNNKSA-N 0 0 361.373 3.940 20 5 FHBDRN C[C@@H]1CC(CCNC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)C[C@@H](C)O1 ZINC000517592658 944423953 /nfs/dbraw/zinc/42/39/53/944423953.db2.gz ZPYHSRVSONHRTN-GHMZBOCLSA-N 0 0 372.368 3.520 20 5 FHBDRN O=C(NCC1(C(F)(F)F)CC1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000557127009 944425243 /nfs/dbraw/zinc/42/52/43/944425243.db2.gz LXGHMXIDOMLFDO-UHFFFAOYSA-N 0 0 371.340 3.791 20 5 FHBDRN Cc1ccc2nc(CS[C@H](C)c3cccc([N+](=O)[O-])c3)cc(=O)n2c1 ZINC000518483298 944426880 /nfs/dbraw/zinc/42/68/80/944426880.db2.gz MMKNDEBGOFOCAD-CYBMUJFWSA-N 0 0 355.419 3.906 20 5 FHBDRN CC[C@@H](NC(=O)CSCc1ccc(OC)c([N+](=O)[O-])c1)C(C)(C)C ZINC000518484267 944428571 /nfs/dbraw/zinc/42/85/71/944428571.db2.gz PBZFEHWZKBPGCA-OAHLLOKOSA-N 0 0 354.472 3.778 20 5 FHBDRN Cc1ccc(-c2cc(=NC(=O)c3ccc(Cl)cc3[N+](=O)[O-])[nH][nH]2)s1 ZINC000518484212 944428657 /nfs/dbraw/zinc/42/86/57/944428657.db2.gz MNGQTFMPLQDRDK-UHFFFAOYSA-N 0 0 362.798 3.682 20 5 FHBDRN CCCn1nc(C)c(C(=O)OCc2cc([N+](=O)[O-])ccc2OCC)c1C ZINC000759823233 944436300 /nfs/dbraw/zinc/43/63/00/944436300.db2.gz GDBOCUQYYPVVQM-UHFFFAOYSA-N 0 0 361.398 3.574 20 5 FHBDRN Cc1cc(NC(=O)N2CCO[C@@H](CCc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000473779403 944442168 /nfs/dbraw/zinc/44/21/68/944442168.db2.gz PBFGSTDDBKKPIC-SFHVURJKSA-N 0 0 369.421 3.769 20 5 FHBDRN CCCc1n[nH]c(C(=O)NCCc2cc(Cl)cc(Cl)c2)c1[N+](=O)[O-] ZINC000517614183 944444628 /nfs/dbraw/zinc/44/46/28/944444628.db2.gz ADJIJFXOLFYMRW-UHFFFAOYSA-N 0 0 371.224 3.550 20 5 FHBDRN CCC[C@@H](NCc1cc(C)nc(N2CCCC2)n1)c1cccc([N+](=O)[O-])c1 ZINC000426325303 944447821 /nfs/dbraw/zinc/44/78/21/944447821.db2.gz IHLXPMJXTIWXFC-LJQANCHMSA-N 0 0 369.469 3.924 20 5 FHBDRN CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)O[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000759827323 944448293 /nfs/dbraw/zinc/44/82/93/944448293.db2.gz KEJAQKOUYASZSA-DOMZBBRYSA-N 0 0 366.414 3.748 20 5 FHBDRN CN(CCOC(=O)/C=C/SCc1ccco1)c1ccc([N+](=O)[O-])cc1 ZINC000759828633 944461506 /nfs/dbraw/zinc/46/15/06/944461506.db2.gz PJSHMTLUCQNPQX-XYOKQWHBSA-N 0 0 362.407 3.614 20 5 FHBDRN CCCC(=O)Nc1cccc(CNC(=O)Nc2cccc([N+](=O)[O-])c2)c1 ZINC000046850109 944464758 /nfs/dbraw/zinc/46/47/58/944464758.db2.gz XHGDLXCAZYUOGD-UHFFFAOYSA-N 0 0 356.382 3.655 20 5 FHBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1CC[C@H](C)C[C@H]1c1ccco1 ZINC000439235699 944467083 /nfs/dbraw/zinc/46/70/83/944467083.db2.gz QBFSZGVMWVPBMR-WFASDCNBSA-N 0 0 364.423 3.658 20 5 FHBDRN C[C@H](COc1cccc(F)c1)NC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000518525283 944471508 /nfs/dbraw/zinc/47/15/08/944471508.db2.gz OPUWDPFNUFTFHP-SNVBAGLBSA-N 0 0 367.764 3.976 20 5 FHBDRN Cc1ccc2c(c1)N(C(=O)c1ccn(-c3ccc([N+](=O)[O-])cc3)n1)CCC2 ZINC000110393802 944478331 /nfs/dbraw/zinc/47/83/31/944478331.db2.gz BJJZLTNFSKFXBT-UHFFFAOYSA-N 0 0 362.389 3.682 20 5 FHBDRN COc1ccccc1[C@H]1CCN(C(=O)Nc2ccc([N+](=O)[O-])c(C)c2)C1 ZINC000473786242 944483610 /nfs/dbraw/zinc/48/36/10/944483610.db2.gz KVTKGOBDKDODJN-AWEZNQCLSA-N 0 0 355.394 3.933 20 5 FHBDRN Cc1cc(NC(=O)N(C)[C@H](C)[C@H]2Cc3ccccc3O2)ccc1[N+](=O)[O-] ZINC000473787403 944485846 /nfs/dbraw/zinc/48/58/46/944485846.db2.gz VXRVKOVUIYMDBZ-FZKQIMNGSA-N 0 0 355.394 3.759 20 5 FHBDRN CN(CCC1CCCCC1)C(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000506204531 944494464 /nfs/dbraw/zinc/49/44/64/944494464.db2.gz FDOAHLMSPWJHAO-UHFFFAOYSA-N 0 0 356.426 3.823 20 5 FHBDRN CCc1ccc([C@@H](NCc2snnc2C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000426336621 944496961 /nfs/dbraw/zinc/49/69/61/944496961.db2.gz VSJXUFXCZWLDBT-KRWDZBQOSA-N 0 0 358.423 3.789 20 5 FHBDRN O=C(NC[C@H]1C[C@@H]1c1ccccc1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000110456412 944501817 /nfs/dbraw/zinc/50/18/17/944501817.db2.gz KATCYSQRNSKPSH-QZTJIDSGSA-N 0 0 365.433 3.729 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCCCc1nccs1 ZINC000506208841 944503093 /nfs/dbraw/zinc/50/30/93/944503093.db2.gz TUDANHIREYUPIL-UHFFFAOYSA-N 0 0 365.480 3.916 20 5 FHBDRN COc1cc(CNCc2ccccc2N(C)C(C)C)c([N+](=O)[O-])cc1OC ZINC000438334031 944503231 /nfs/dbraw/zinc/50/32/31/944503231.db2.gz JQDUHAQLIKIJAI-UHFFFAOYSA-N 0 0 373.453 3.746 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H](C)c1cc(F)ccc1OC ZINC000046985741 944506000 /nfs/dbraw/zinc/50/60/00/944506000.db2.gz KDWWLTRTKGKFNN-SNVBAGLBSA-N 0 0 363.345 3.634 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H](O)C1CCCCC1 ZINC000506206019 944506343 /nfs/dbraw/zinc/50/63/43/944506343.db2.gz CDCFGYSVCLZYIZ-INIZCTEOSA-N 0 0 366.483 3.768 20 5 FHBDRN CN(c1ccccc1)c1ccc(C[N@H+](C)CC2(CO)CC2)cc1[N+](=O)[O-] ZINC000438339272 944519993 /nfs/dbraw/zinc/51/99/93/944519993.db2.gz NBUCGXOBXJSZKI-UHFFFAOYSA-N 0 0 355.438 3.567 20 5 FHBDRN Cn1c(C(=O)N2CCC(c3c[nH]c4cc(F)ccc43)CC2)ccc1[N+](=O)[O-] ZINC000517700283 944522433 /nfs/dbraw/zinc/52/24/33/944522433.db2.gz ZMPLINXWDSLPEJ-UHFFFAOYSA-N 0 0 370.384 3.574 20 5 FHBDRN C[C@H]1COc2ccccc2CN1C(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000543896603 944525414 /nfs/dbraw/zinc/52/54/14/944525414.db2.gz UYMQRZXIKPRMNS-LBPRGKRZSA-N 0 0 360.797 3.600 20 5 FHBDRN Cn1c2ccccc2c(N[C@@H](c2ccccn2)C2CCC2)c([N+](=O)[O-])c1=O ZINC000894726086 944528607 /nfs/dbraw/zinc/52/86/07/944528607.db2.gz OVVQMEMWNYOVJV-QGZVFWFLSA-N 0 0 364.405 3.795 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)c1c(F)ccc(F)c1Cl ZINC001270116162 944529246 /nfs/dbraw/zinc/52/92/46/944529246.db2.gz VVDLBTMLRBPRKC-UHFFFAOYSA-N 0 0 354.740 3.841 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(-n3ccnc3)c(F)c2)c1 ZINC000516142796 944530458 /nfs/dbraw/zinc/53/04/58/944530458.db2.gz DVMARQCVSCSPCG-UHFFFAOYSA-N 0 0 372.381 3.894 20 5 FHBDRN CC(C)c1ccc(C(=O)Nc2cnccc2-n2cccn2)cc1[N+](=O)[O-] ZINC000473801699 944539931 /nfs/dbraw/zinc/53/99/31/944539931.db2.gz WBSLZAUBLXGZQZ-UHFFFAOYSA-N 0 0 351.366 3.551 20 5 FHBDRN Cn1ccnc1[C@@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1cccc(F)c1 ZINC000017590703 944543867 /nfs/dbraw/zinc/54/38/67/944543867.db2.gz BDAFVAVDDZUHDB-INIZCTEOSA-N 0 0 371.328 3.577 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@@]1(Cc2ccc(Cl)cc2)CCOC1 ZINC000500336459 944546164 /nfs/dbraw/zinc/54/61/64/944546164.db2.gz VVVRUXBNVKLIDD-LJQANCHMSA-N 0 0 374.824 3.688 20 5 FHBDRN COc1ccc(C(=O)Nc2csnc2-c2ccccc2)cc1[N+](=O)[O-] ZINC000436726633 944549527 /nfs/dbraw/zinc/54/95/27/944549527.db2.gz WMCCFKOZRGJDGA-UHFFFAOYSA-N 0 0 355.375 3.979 20 5 FHBDRN CC(C)c1ccc(C(=O)N[C@@H](C)C(=O)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000439346544 944549682 /nfs/dbraw/zinc/54/96/82/944549682.db2.gz ZQKZHYNOCLCDLQ-AWEZNQCLSA-N 0 0 354.406 3.648 20 5 FHBDRN Cc1nn(Cc2ccc(C(=O)NCC(C)(C)C(C)C)cc2)c(C)c1[N+](=O)[O-] ZINC000438385287 944552824 /nfs/dbraw/zinc/55/28/24/944552824.db2.gz LMMMBBUQZWEBBA-UHFFFAOYSA-N 0 0 372.469 3.868 20 5 FHBDRN CCCCCC[C@](C)(NC(=O)c1cccc([N+](=O)[O-])c1C)C(=O)OCC ZINC001125940280 944560305 /nfs/dbraw/zinc/56/03/05/944560305.db2.gz FQMJJVSZHTXDFS-IBGZPJMESA-N 0 0 364.442 3.925 20 5 FHBDRN CCCN(C[C@@H]1CCCCO1)C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000181633883 944561333 /nfs/dbraw/zinc/56/13/33/944561333.db2.gz DXXXOKWQLVZBFR-ZDUSSCGKSA-N 0 0 372.368 3.618 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N(C)c1cc(OC)ccn1 ZINC000425618697 944568859 /nfs/dbraw/zinc/56/88/59/944568859.db2.gz KRFUDBPJWKBOLN-UHFFFAOYSA-N 0 0 361.423 3.777 20 5 FHBDRN C[C@@H](c1nc2ccccc2s1)N(C)C(=O)COc1ccccc1[N+](=O)[O-] ZINC000015094168 944568918 /nfs/dbraw/zinc/56/89/18/944568918.db2.gz RQMYYXPTNYASJI-LBPRGKRZSA-N 0 0 371.418 3.803 20 5 FHBDRN Cc1cc(NC(=O)N[C@H](CO)c2cccc(Cl)c2F)ccc1[N+](=O)[O-] ZINC000439375295 944570049 /nfs/dbraw/zinc/57/00/49/944570049.db2.gz SSUBURQHHSPTLF-CYBMUJFWSA-N 0 0 367.764 3.551 20 5 FHBDRN CC[C@H](CSC)NC(=O)c1cc([N+](=O)[O-])cc(Br)c1C ZINC000516198605 944570757 /nfs/dbraw/zinc/57/07/57/944570757.db2.gz ZDORLXDJBDDWQW-SECBINFHSA-N 0 0 361.261 3.537 20 5 FHBDRN C[C@@H](CC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1ccncc1 ZINC000120712053 944571729 /nfs/dbraw/zinc/57/17/29/944571729.db2.gz KQSVUMIYFMWGNN-JTQLQIEISA-N 0 0 351.309 3.724 20 5 FHBDRN Cn1ccnc1CC1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000110581106 944579906 /nfs/dbraw/zinc/57/99/06/944579906.db2.gz RJWBWXUHMORXRK-UHFFFAOYSA-N 0 0 368.359 3.806 20 5 FHBDRN CNc1ccc(C(=O)Nc2cc(-c3ccnn3C)ccc2C)cc1[N+](=O)[O-] ZINC000517760240 944580069 /nfs/dbraw/zinc/58/00/69/944580069.db2.gz TVLDNVWCMCRXHU-UHFFFAOYSA-N 0 0 365.393 3.598 20 5 FHBDRN Cc1c(CC(=O)N2C[C@@H]3CCC[C@]3(C(F)(F)F)C2)cccc1[N+](=O)[O-] ZINC000894381594 944583333 /nfs/dbraw/zinc/58/33/33/944583333.db2.gz LXPWTTSDYVNGQG-BBRMVZONSA-N 0 0 356.344 3.637 20 5 FHBDRN Cc1cc(-c2noc(COc3c(Cl)cncc3[N+](=O)[O-])n2)ccc1F ZINC000506563862 944583875 /nfs/dbraw/zinc/58/38/75/944583875.db2.gz SNQSXWLPKOEVAI-UHFFFAOYSA-N 0 0 364.720 3.720 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C[NH2+]CCC[C@@H](Cc1ccccc1)C(=O)[O-] ZINC000426672351 944591452 /nfs/dbraw/zinc/59/14/52/944591452.db2.gz AHVVWWJTIJRJDB-KRWDZBQOSA-N 0 0 356.422 3.717 20 5 FHBDRN C[C@H](Cc1cccc(O)c1)NC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000426009602 944598199 /nfs/dbraw/zinc/59/81/99/944598199.db2.gz XVUOHDKUZQIOKS-CQSZACIVSA-N 0 0 369.421 3.606 20 5 FHBDRN Cc1csc([C@H]2CCCCN2Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)n1 ZINC000516238673 944607411 /nfs/dbraw/zinc/60/74/11/944607411.db2.gz AKVNMXXZOVASQI-OAHLLOKOSA-N 0 0 357.439 3.963 20 5 FHBDRN CC[C@H](C)C(=O)Nc1cccc(CNC(=O)Nc2ccc([N+](=O)[O-])cc2)c1 ZINC000047141242 944613478 /nfs/dbraw/zinc/61/34/78/944613478.db2.gz LGWCKBZRLMHHKP-ZDUSSCGKSA-N 0 0 370.409 3.901 20 5 FHBDRN O=C(CCc1cccc(Cl)c1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000053677888 944616072 /nfs/dbraw/zinc/61/60/72/944616072.db2.gz VBXIKQXWYNSTDD-UHFFFAOYSA-N 0 0 373.840 3.530 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NCCc1cccc2[nH]ccc21 ZINC000506238165 944617854 /nfs/dbraw/zinc/61/78/54/944617854.db2.gz MUJWAIPAKPIXNO-UHFFFAOYSA-N 0 0 351.406 3.974 20 5 FHBDRN Cc1cc(C)cc(OCCNC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000516228501 944620440 /nfs/dbraw/zinc/62/04/40/944620440.db2.gz YJIDIOLDQSGNKU-OAHLLOKOSA-N 0 0 357.410 3.651 20 5 FHBDRN COc1cc(-c2noc(CSc3ccc([N+](=O)[O-])cc3)n2)ccc1O ZINC000436782845 944627315 /nfs/dbraw/zinc/62/73/15/944627315.db2.gz DJSSGYZXIUBRCS-UHFFFAOYSA-N 0 0 359.363 3.651 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)NCC2(CC(C)C)CC2)cc1OC ZINC000150747347 944628858 /nfs/dbraw/zinc/62/88/58/944628858.db2.gz OPZLEXSMGIULCT-UHFFFAOYSA-N 0 0 350.415 3.558 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCCc2c(O)cccc21 ZINC000190262420 944646228 /nfs/dbraw/zinc/64/62/28/944646228.db2.gz GYTXFOBTXISSJP-YVEFUNNKSA-N 0 0 372.446 3.975 20 5 FHBDRN Cc1cc(C)c(NC(=O)COc2c(Cl)cncc2[N+](=O)[O-])c(Cl)c1 ZINC000506585769 944651115 /nfs/dbraw/zinc/65/11/15/944651115.db2.gz TZYRTJBFAUZROC-UHFFFAOYSA-N 0 0 370.192 3.931 20 5 FHBDRN COc1cccc(C(=O)COc2ccc([N+](=O)[O-])cc2C(F)(F)F)c1 ZINC000517805033 944652784 /nfs/dbraw/zinc/65/27/84/944652784.db2.gz XOCDUGSHXXTYHK-UHFFFAOYSA-N 0 0 355.268 3.884 20 5 FHBDRN Cc1cc(NCc2c(F)cc([N+](=O)[O-])cc2F)nn1-c1ccc(C)cc1 ZINC000506248402 944668914 /nfs/dbraw/zinc/66/89/14/944668914.db2.gz XHXSNGPGDOBRIF-UHFFFAOYSA-N 0 0 358.348 3.710 20 5 FHBDRN CC[C@@H](C)[C@H](C)N(C(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)C1CC1 ZINC000517833615 944679971 /nfs/dbraw/zinc/67/99/71/944679971.db2.gz ZGKNSCVJCBQZMN-KGLIPLIRSA-N 0 0 356.426 3.820 20 5 FHBDRN Cc1c(NC(=O)N[C@H](C)[C@H]2Oc3ccccc3[C@H]2C)cccc1[N+](=O)[O-] ZINC000438492372 944685670 /nfs/dbraw/zinc/68/56/70/944685670.db2.gz MQSHFADABSKMJR-BVRBVLIYSA-N 0 0 355.394 3.978 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1[C@H]1Nc2ccc(Cl)cc2C(=O)N1C ZINC000500379543 944691454 /nfs/dbraw/zinc/69/14/54/944691454.db2.gz MUSHIYXMPIQSEX-INIZCTEOSA-N 0 0 361.785 3.843 20 5 FHBDRN C[C@@]1(c2ccccc2)CCN(CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000438501888 944699486 /nfs/dbraw/zinc/69/94/86/944699486.db2.gz UQHRYGIYRGFQTB-LJQANCHMSA-N 0 0 373.840 3.850 20 5 FHBDRN CCN(CC)C(=O)c1ccc(NCc2c(F)cc([N+](=O)[O-])cc2F)cc1 ZINC000506258105 944702108 /nfs/dbraw/zinc/70/21/08/944702108.db2.gz FSJMDGYJRPCCFD-UHFFFAOYSA-N 0 0 363.364 3.967 20 5 FHBDRN O=C(CSc1ccccc1[N+](=O)[O-])OC[C@@H]1CCC2(CCCC2)O1 ZINC000781936005 944707735 /nfs/dbraw/zinc/70/77/35/944707735.db2.gz NFWICTNUNMCVOG-ZDUSSCGKSA-N 0 0 351.424 3.722 20 5 FHBDRN O=C([O-])c1cccc(CC[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)c1 ZINC000426689358 944709921 /nfs/dbraw/zinc/70/99/21/944709921.db2.gz URLCPXIAWIZWSR-UHFFFAOYSA-N 0 0 366.373 3.885 20 5 FHBDRN C[C@H](Cc1ccccc1F)NC(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000054166736 944710881 /nfs/dbraw/zinc/71/08/81/944710881.db2.gz IROHJAAFFUFMCJ-CHWSQXEVSA-N 0 0 362.426 3.962 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)N2CCOc3ccc(F)cc3C2)cc1[N+](=O)[O-] ZINC000426041283 944711467 /nfs/dbraw/zinc/71/14/67/944711467.db2.gz ZHTAAOOVBHADEC-ZDUSSCGKSA-N 0 0 373.384 3.708 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])NC[C@@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000438506189 944715783 /nfs/dbraw/zinc/71/57/83/944715783.db2.gz FQKAGGRAGXICIG-CHWSQXEVSA-N 0 0 374.359 3.849 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H](C)[C@@H]1Oc2ccccc2[C@H]1C ZINC000438509489 944721852 /nfs/dbraw/zinc/72/18/52/944721852.db2.gz YKPHCZIGYRGFNL-SNUQEOBHSA-N 0 0 355.394 3.978 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1OCCOc1ccccc1Br ZINC000506911367 944737087 /nfs/dbraw/zinc/73/70/87/944737087.db2.gz XIIOZQNFEBEHOY-UHFFFAOYSA-N 0 0 368.183 3.824 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)Nc1ccc(-c2ncco2)cc1 ZINC000500395159 944744238 /nfs/dbraw/zinc/74/42/38/944744238.db2.gz KOTKJBHWXSECLP-UHFFFAOYSA-N 0 0 362.345 3.843 20 5 FHBDRN Cc1cc(=NC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)[nH]n1C1CCCCC1 ZINC000516359390 944746676 /nfs/dbraw/zinc/74/66/76/944746676.db2.gz NCXPYBIUEYBDHT-UHFFFAOYSA-N 0 0 367.409 3.760 20 5 FHBDRN Cc1ccc(CSCCNC(=O)CCOc2ccccc2[N+](=O)[O-])cc1 ZINC000517871816 944748237 /nfs/dbraw/zinc/74/82/37/944748237.db2.gz SLAOTWLOIDIJKQ-UHFFFAOYSA-N 0 0 374.462 3.722 20 5 FHBDRN O=[N+]([O-])c1cc(F)c(CS(=O)(=O)Cc2ccccc2C2CC2)c(F)c1 ZINC000506943517 944763421 /nfs/dbraw/zinc/76/34/21/944763421.db2.gz HMMTYOSVMIGEMJ-UHFFFAOYSA-N 0 0 367.373 3.865 20 5 FHBDRN O=C1CCCN1c1ccc(NCc2c(F)cc([N+](=O)[O-])cc2F)cc1F ZINC000506271857 944764073 /nfs/dbraw/zinc/76/40/73/944764073.db2.gz YMXXLSDZAQZMDY-UHFFFAOYSA-N 0 0 365.311 3.751 20 5 FHBDRN Cc1nn(Cc2ccc(C(=O)N3CCC[C@@H]3C(C)C)cc2)c(C)c1[N+](=O)[O-] ZINC000518787749 944766615 /nfs/dbraw/zinc/76/66/15/944766615.db2.gz AMDSFXTYRVISOJ-GOSISDBHSA-N 0 0 370.453 3.717 20 5 FHBDRN CCCCc1ccc(NC(=O)c2cn(-c3cccc([N+](=O)[O-])c3)nn2)cc1 ZINC000518787356 944767891 /nfs/dbraw/zinc/76/78/91/944767891.db2.gz VUAHECANDRDZEY-UHFFFAOYSA-N 0 0 365.393 3.770 20 5 FHBDRN CCOc1ccc(-c2noc(C(C)(C)c3ccccc3[N+](=O)[O-])n2)cn1 ZINC000426428976 944779361 /nfs/dbraw/zinc/77/93/61/944779361.db2.gz VDCHBAWCBRTNPQ-UHFFFAOYSA-N 0 0 354.366 3.764 20 5 FHBDRN O=C([O-])[C@H](CC1CCCC1)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000426762978 944785936 /nfs/dbraw/zinc/78/59/36/944785936.db2.gz PAYRQAYTQJXBBJ-KRWDZBQOSA-N 0 0 358.394 3.978 20 5 FHBDRN Cc1ocnc1-c1noc(-c2ccc(N3CCC[C@H](C)C3)c([N+](=O)[O-])c2)n1 ZINC000516388472 944808049 /nfs/dbraw/zinc/80/80/49/944808049.db2.gz ZXKKXOYOWCVCQL-NSHDSACASA-N 0 0 369.381 3.845 20 5 FHBDRN Cc1cn2c(n1)[C@@H](CNC(=O)c1cc3cc([N+](=O)[O-])ccc3s1)CCC2 ZINC000505903764 944812826 /nfs/dbraw/zinc/81/28/26/944812826.db2.gz KBCAJFCJZMWQCY-GFCCVEGCSA-N 0 0 370.434 3.622 20 5 FHBDRN COc1cccc2c1[C@@H](C(=O)NCc1ccc([N+](=O)[O-])cc1Cl)CC2 ZINC000500410664 944814591 /nfs/dbraw/zinc/81/45/91/944814591.db2.gz ODLXRIACDMJXJE-AWEZNQCLSA-N 0 0 360.797 3.603 20 5 FHBDRN CCCCc1ccc(CC(=O)NCCOc2ccc([N+](=O)[O-])cc2)cc1 ZINC000518829498 944818689 /nfs/dbraw/zinc/81/86/89/944818689.db2.gz HHINNDYQCYMUPU-UHFFFAOYSA-N 0 0 356.422 3.675 20 5 FHBDRN CC[C@@H](NC(=O)Nc1cccc2c1OCCC2=O)c1cccc([N+](=O)[O-])c1 ZINC000506986666 944834628 /nfs/dbraw/zinc/83/46/28/944834628.db2.gz MWSNUGCNPDBGMJ-OAHLLOKOSA-N 0 0 369.377 3.833 20 5 FHBDRN CC(C)(C)[C@H]1CCC[C@@H]1NC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000412829314 944835773 /nfs/dbraw/zinc/83/57/73/944835773.db2.gz UGYMAHYPDCGZDX-HOCLYGCPSA-N 0 0 357.410 3.793 20 5 FHBDRN CCC[C@@H](C)CC(=O)NCCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000500415632 944839427 /nfs/dbraw/zinc/83/94/27/944839427.db2.gz QYXALHYAAUPLCY-LLVKDONJSA-N 0 0 361.364 3.968 20 5 FHBDRN CCOc1ccc(C(=O)NC[C@H]2CCO[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000518849494 944843396 /nfs/dbraw/zinc/84/33/96/944843396.db2.gz JGHRGYNXABIWBO-APWZRJJASA-N 0 0 370.405 3.501 20 5 FHBDRN O=C(NCCCc1cccc(C(F)(F)F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000506996776 944849072 /nfs/dbraw/zinc/84/90/72/944849072.db2.gz JHFWEKWNVHSYQG-UHFFFAOYSA-N 0 0 352.312 3.976 20 5 FHBDRN Cc1ccc(S(=O)(=O)N(c2ccc(F)cc2)C(C)C)cc1[N+](=O)[O-] ZINC000518843334 944853713 /nfs/dbraw/zinc/85/37/13/944853713.db2.gz CFTNUYGAIFQJNX-UHFFFAOYSA-N 0 0 352.387 3.646 20 5 FHBDRN COc1ccc([C@H]2C[C@H](NC(=O)c3cc(C)ccc3[N+](=O)[O-])C2)cc1F ZINC000506302046 944856644 /nfs/dbraw/zinc/85/66/44/944856644.db2.gz RITNNOGFJIFNCO-HDJSIYSDSA-N 0 0 358.369 3.727 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H](C)c1cccc(OC(C)C)c1 ZINC000426851678 944861474 /nfs/dbraw/zinc/86/14/74/944861474.db2.gz SEAXPKXWMLMBBV-CYBMUJFWSA-N 0 0 358.394 3.882 20 5 FHBDRN Cc1nn(-c2ccccc2)c2nc(C(=O)Nc3ccc([N+](=O)[O-])cc3)ccc12 ZINC000516446384 944867959 /nfs/dbraw/zinc/86/79/59/944867959.db2.gz OLTMXBDCWKAYPG-UHFFFAOYSA-N 0 0 373.372 3.889 20 5 FHBDRN CC(C)N(C)c1ccccc1CNC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000518857453 944870576 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FHBDRN Cc1cccc(C)c1OC[C@H](C)Nc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 ZINC000507022234 944889220 /nfs/dbraw/zinc/88/92/20/944889220.db2.gz OWXFRDXYEKYVKK-AWEZNQCLSA-N 0 0 369.421 3.976 20 5 FHBDRN COc1ccc(-c2noc(Cn3ccc4cc([N+](=O)[O-])ccc43)n2)cc1 ZINC000518868802 944891711 /nfs/dbraw/zinc/89/17/11/944891711.db2.gz LXYVBRQGMGJLPL-UHFFFAOYSA-N 0 0 350.334 3.656 20 5 FHBDRN Cc1ccc([C@@H](C)N(C)C(=O)C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)c(C)c1 ZINC000516471084 944901830 /nfs/dbraw/zinc/90/18/30/944901830.db2.gz CZDPOZKVUMAXJK-OAHLLOKOSA-N 0 0 369.421 3.678 20 5 FHBDRN Cc1ccc(NC(=O)c2ccc(SC[C@@H](C)CO)c([N+](=O)[O-])c2)cc1 ZINC000426907000 944915571 /nfs/dbraw/zinc/91/55/71/944915571.db2.gz LBMUKWJHXGBPTP-ZDUSSCGKSA-N 0 0 360.435 3.876 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)NCCc1ccc2ccccc2c1 ZINC000426910818 944919955 /nfs/dbraw/zinc/91/99/55/944919955.db2.gz CSZMVBHGBNHGCF-UHFFFAOYSA-N 0 0 350.374 3.729 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)N[C@@H]2CCOC3(CCCC3)C2)cc1[N+](=O)[O-] ZINC000151234376 944921883 /nfs/dbraw/zinc/92/18/83/944921883.db2.gz XFLGOTGFLCUWNI-GDBMZVCRSA-N 0 0 361.442 3.755 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](CC)C[C@@H](C)CO ZINC000507095622 944932909 /nfs/dbraw/zinc/93/29/09/944932909.db2.gz VCZSADVTCJNNCD-OLZOCXBDSA-N 0 0 354.472 3.624 20 5 FHBDRN CC(C)(C)CNc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-] ZINC000511712368 944939017 /nfs/dbraw/zinc/93/90/17/944939017.db2.gz MUVIIPLFYJXGIT-UHFFFAOYSA-N 0 0 363.439 3.854 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCC(C)(C)[C@@H](O)C(C)C ZINC000507086368 944944043 /nfs/dbraw/zinc/94/40/43/944944043.db2.gz HDDOLCJBIJXBGB-INIZCTEOSA-N 0 0 368.499 3.870 20 5 FHBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])N1CCOCC12CCCC2 ZINC000543326466 944944009 /nfs/dbraw/zinc/94/40/09/944944009.db2.gz IVRBJYOQZLBCFP-UHFFFAOYSA-N 0 0 370.858 3.512 20 5 FHBDRN CCO[C@H]1C[C@H](N(C)C(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)C1(C)C ZINC001126450580 944951466 /nfs/dbraw/zinc/95/14/66/944951466.db2.gz DAPSFVJGXLMMIA-IRXDYDNUSA-N 0 0 364.442 3.658 20 5 FHBDRN O=C(CCc1ccc(-c2ccccc2)[nH]1)NCCc1ccc([N+](=O)[O-])cc1 ZINC000054168364 944954068 /nfs/dbraw/zinc/95/40/68/944954068.db2.gz BNZXJXBARGVKJQ-UHFFFAOYSA-N 0 0 363.417 3.881 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)N2C[C@]3(CCCO3)[C@@H]2C2CC2)cc1[N+](=O)[O-] ZINC000516506525 944955045 /nfs/dbraw/zinc/95/50/45/944955045.db2.gz GATNKKUMVXJLLV-FXAWDEMLSA-N 0 0 358.438 3.676 20 5 FHBDRN CCCN(c1ccc(Cl)cc1)S(=O)(=O)c1ccccc1[N+](=O)[O-] ZINC000518950611 944960604 /nfs/dbraw/zinc/96/06/04/944960604.db2.gz VCUXCLOLTJMPEN-UHFFFAOYSA-N 0 0 354.815 3.854 20 5 FHBDRN CN(C)c1cc(Br)cc(C(=O)Nc2cccc([N+](=O)[O-])c2)c1 ZINC000432040486 944960832 /nfs/dbraw/zinc/96/08/32/944960832.db2.gz GUYXJZXZYPGYQK-UHFFFAOYSA-N 0 0 364.199 3.676 20 5 FHBDRN O=[N+]([O-])c1cccnc1N(CCc1ccccn1)Cc1ccc(F)cc1 ZINC000432060242 944968462 /nfs/dbraw/zinc/96/84/62/944968462.db2.gz IQQSUAGRIWXXKC-UHFFFAOYSA-N 0 0 352.369 3.773 20 5 FHBDRN O=[N+]([O-])c1ccc(N(CCCO)Cc2ccc(Cl)c(Cl)c2)nc1 ZINC000432061923 944970386 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CCOc1ccc([N+](=O)[O-])cc1NC(=O)NCc1cc(C)cc(OC)c1 ZINC000439888679 945051403 /nfs/dbraw/zinc/05/14/03/945051403.db2.gz MKOZMEQDEVNRHF-UHFFFAOYSA-N 0 0 359.382 3.632 20 5 FHBDRN Cc1nn(-c2ccccc2)cc1CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000181698319 945371126 /nfs/dbraw/zinc/37/11/26/945371126.db2.gz AUKOFQDIHCYAFP-UHFFFAOYSA-N 0 0 370.796 3.672 20 5 FHBDRN Cc1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2C)c(Cl)cc1F ZINC000507618239 945380871 /nfs/dbraw/zinc/38/08/71/945380871.db2.gz RTUBSBOWFQAUKH-UHFFFAOYSA-N 0 0 358.778 3.805 20 5 FHBDRN O=C(N[C@H](c1nccs1)C(F)(F)F)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000507639482 945385652 /nfs/dbraw/zinc/38/56/52/945385652.db2.gz FTMGRRPKLPMJCE-LLVKDONJSA-N 0 0 370.312 3.566 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])c(Cl)c1)Nc1ccnn1C1CCCC1 ZINC000124955937 945399164 /nfs/dbraw/zinc/39/91/64/945399164.db2.gz DIAYAWGSEUDQJZ-UHFFFAOYSA-N 0 0 364.789 3.577 20 5 FHBDRN O=C(OCc1c(Br)cccc1[N+](=O)[O-])c1ncoc1C1CC1 ZINC000909347327 945409990 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350.268 3.504 20 5 FHBDRN CC(C)c1ccc(C[S@](=O)CCC(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000507693858 945458118 /nfs/dbraw/zinc/45/81/18/945458118.db2.gz MCQHRJBHXOFUIS-AREMUKBSSA-N 0 0 374.462 3.996 20 5 FHBDRN C[C@@H](NC(=O)c1ccccc1[N+](=O)[O-])c1ccc(F)c(Br)c1 ZINC000507701543 945464953 /nfs/dbraw/zinc/46/49/53/945464953.db2.gz GMZRCDIYTJYZHS-SECBINFHSA-N 0 0 367.174 3.987 20 5 FHBDRN O=C(CC[S@](=O)Cc1ccc(Cl)cc1)Nc1ccccc1[N+](=O)[O-] ZINC000507699746 945465042 /nfs/dbraw/zinc/46/50/42/945465042.db2.gz VCBMXMOUJZHVLY-DEOSSOPVSA-N 0 0 366.826 3.526 20 5 FHBDRN CN(C(=O)Cc1ccc([N+](=O)[O-])cc1Br)C1CCCCC1 ZINC000087020541 945470047 /nfs/dbraw/zinc/47/00/47/945470047.db2.gz ZKCPEBBPIGHQJI-UHFFFAOYSA-N 0 0 355.232 3.691 20 5 FHBDRN O=[N+]([O-])c1ccc(Sc2nnc(Cc3cccs3)n2C2CC2)nc1 ZINC000280965087 945481687 /nfs/dbraw/zinc/48/16/87/945481687.db2.gz KARSFMJIPWDCEF-UHFFFAOYSA-N 0 0 359.436 3.720 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCCC[C@@H]1c1ccnn1C ZINC000280995276 945482556 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ZINC001126073890 946035019 /nfs/dbraw/zinc/03/50/19/946035019.db2.gz KJNZTMDDTJFUTC-UHFFFAOYSA-N 0 0 370.409 3.844 20 5 FHBDRN O=[N+]([O-])c1c(F)cccc1N1CC[C@H](c2nccc(C(F)(F)F)n2)C1 ZINC000896908210 946060802 /nfs/dbraw/zinc/06/08/02/946060802.db2.gz WLWLWTVYFFWHNY-VIFPVBQESA-N 0 0 356.279 3.537 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)Nc2ccnn2-c2ccccc2C)c1C ZINC001126081418 946061716 /nfs/dbraw/zinc/06/17/16/946061716.db2.gz JUWUPTYCEGNGJD-UHFFFAOYSA-N 0 0 350.378 3.958 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N(CC)c2cccc(F)c2)cc1OC ZINC000045515554 946064482 /nfs/dbraw/zinc/06/44/82/946064482.db2.gz SOAUONBSWQDWST-UHFFFAOYSA-N 0 0 362.357 3.808 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CCC[C@H]1C(=O)OC(C)(C)C ZINC000181783078 946078548 /nfs/dbraw/zinc/07/85/48/946078548.db2.gz QLVVJODLEINCDP-AWEZNQCLSA-N 0 0 363.414 3.550 20 5 FHBDRN CC[C@H]1CN(CC(=O)Nc2cc([N+](=O)[O-])ccc2C)c2ccccc2O1 ZINC000444217109 946079453 /nfs/dbraw/zinc/07/94/53/946079453.db2.gz VYKPFJKGVAEFHS-HNNXBMFYSA-N 0 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3.656 20 5 FHBDRN CC1CCN(c2ccc(C(=O)NC[C@H]3CC=CCC3)cc2[N+](=O)[O-])CC1 ZINC000109200748 946188728 /nfs/dbraw/zinc/18/87/28/946188728.db2.gz YAQYZRSBMOZCJR-INIZCTEOSA-N 0 0 357.454 3.917 20 5 FHBDRN Cc1ccc([C@@H](NC(=O)COc2ccc(C)cc2[N+](=O)[O-])C2CC2)cc1 ZINC000045840709 946190386 /nfs/dbraw/zinc/19/03/86/946190386.db2.gz PVYUDMXYWDWOAN-HXUWFJFHSA-N 0 0 354.406 3.858 20 5 FHBDRN CC(F)(F)c1cccc(NC(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)c1 ZINC000444313372 946209796 /nfs/dbraw/zinc/20/97/96/946209796.db2.gz HWZLFLQVKKIIDT-UHFFFAOYSA-N 0 0 364.304 3.730 20 5 FHBDRN CCc1n[nH]c(C(=O)N2CCCC[C@H]2CCc2ccccc2)c1[N+](=O)[O-] ZINC000444309794 946215171 /nfs/dbraw/zinc/21/51/71/946215171.db2.gz CDXYSEMDLAPPIY-HNNXBMFYSA-N 0 0 356.426 3.508 20 5 FHBDRN C[C@H](NS(=O)(=O)c1cccc([N+](=O)[O-])c1)c1cccc(C(F)(F)F)c1 ZINC000216109878 946216665 /nfs/dbraw/zinc/21/66/65/946216665.db2.gz PFDRPEBFYCDQSQ-JTQLQIEISA-N 0 0 374.340 3.653 20 5 FHBDRN CN(C)c1ncc(CN(C)C(=O)c2cc3ccccc3c3cccnc23)cn1 ZINC000507735522 946223409 /nfs/dbraw/zinc/22/34/09/946223409.db2.gz RAMNIHRVIODDLS-UHFFFAOYSA-N 0 0 371.444 3.516 20 5 FHBDRN CN(C(=O)CCc1cccc([N+](=O)[O-])c1)[C@H]1CCCN(c2ccccc2)C1 ZINC000151773653 946224953 /nfs/dbraw/zinc/22/49/53/946224953.db2.gz OKIMFBYYMVMHCW-FQEVSTJZSA-N 0 0 367.449 3.655 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)N(Cc1ccccc1F)C1CC1 ZINC000109317388 946234516 /nfs/dbraw/zinc/23/45/16/946234516.db2.gz LTHFAYKNLRSVCR-UHFFFAOYSA-N 0 0 367.380 3.880 20 5 FHBDRN C[C@@H]1Cc2ccccc2CN1C(=O)c1cc2ccccc2c([N+](=O)[O-])c1N ZINC001126595177 946239446 /nfs/dbraw/zinc/23/94/46/946239446.db2.gz GMNOOYFCKIMAPY-CYBMUJFWSA-N 0 0 361.401 3.917 20 5 FHBDRN CCn1cc(Cl)c(NC(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)n1 ZINC000894899956 946249531 /nfs/dbraw/zinc/24/95/31/946249531.db2.gz ACWIFDZJEIPBNZ-UHFFFAOYSA-N 0 0 352.778 3.504 20 5 FHBDRN CCOC(=O)[C@@H]1CN([C@@H](C)c2ccccc2[N+](=O)[O-])Cc2ccccc21 ZINC000441140772 946252889 /nfs/dbraw/zinc/25/28/89/946252889.db2.gz QWJRDKJUWKXDDS-KBXCAEBGSA-N 0 0 354.406 3.818 20 5 FHBDRN COCCN(CCCc1ccccc1)C(=O)c1cc(C)cc([N+](=O)[O-])c1 ZINC000121349601 946264515 /nfs/dbraw/zinc/26/45/15/946264515.db2.gz PDVMQWAWYOLIEC-UHFFFAOYSA-N 0 0 356.422 3.625 20 5 FHBDRN CC(C)c1nn(C)c(Cl)c1C(=O)NCc1cc([N+](=O)[O-])ccc1Cl ZINC000268230827 946268486 /nfs/dbraw/zinc/26/84/86/946268486.db2.gz LNIWDBDGSUXIJC-UHFFFAOYSA-N 0 0 371.224 3.689 20 5 FHBDRN Cc1cccc2nc(COc3c(Br)cccc3[N+](=O)[O-])cn21 ZINC000514108930 946269245 /nfs/dbraw/zinc/26/92/45/946269245.db2.gz HNHIBKGNESVFPR-UHFFFAOYSA-N 0 0 362.183 3.892 20 5 FHBDRN COc1c(C(=O)N2CCC(OC3CCCCC3)CC2)cccc1[N+](=O)[O-] ZINC000475463307 946280545 /nfs/dbraw/zinc/28/05/45/946280545.db2.gz IJQHLSNMNMLDLM-UHFFFAOYSA-N 0 0 362.426 3.557 20 5 FHBDRN COc1ccc(CCCCC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)cc1 ZINC000088230840 946281848 /nfs/dbraw/zinc/28/18/48/946281848.db2.gz DFMZDNJIHQCYCN-UHFFFAOYSA-N 0 0 368.433 3.901 20 5 FHBDRN Cc1ccc(NC(=O)c2ccc(-c3cncnc3)cc2F)cc1[N+](=O)[O-] ZINC000186462343 946285983 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Cc1cccc(C(=O)OCc2nccn2Cc2ccccc2)c1[N+](=O)[O-] ZINC000029313638 946308886 /nfs/dbraw/zinc/30/88/86/946308886.db2.gz XRNBOJSISHRFAQ-UHFFFAOYSA-N 0 0 351.362 3.505 20 5 FHBDRN O=C(CNCc1ccc(-c2cccc([N+](=O)[O-])c2)o1)Nc1cccc(F)c1 ZINC000549551055 946312318 /nfs/dbraw/zinc/31/23/18/946312318.db2.gz QAEAYYSFPCEBKR-UHFFFAOYSA-N 0 0 369.352 3.722 20 5 FHBDRN Cc1ccc(-c2noc([C@H](C)NC(=O)c3cccc([N+](=O)[O-])c3)n2)cc1F ZINC000109506770 946318665 /nfs/dbraw/zinc/31/86/65/946318665.db2.gz RWTXQONREVPNPR-NSHDSACASA-N 0 0 370.340 3.583 20 5 FHBDRN Cc1cc(C)cc(OC[C@@H](O)Cn2cnc3cc4ccccc4cc3c2=O)c1 ZINC000042755316 946322641 /nfs/dbraw/zinc/32/26/41/946322641.db2.gz LQFTWCUQOBBSJA-IBGZPJMESA-N 0 0 374.440 3.606 20 5 FHBDRN Cc1cc(C)cc(OC[C@H](O)Cn2cnc3cc4ccccc4cc3c2=O)c1 ZINC000042755315 946322852 /nfs/dbraw/zinc/32/28/52/946322852.db2.gz LQFTWCUQOBBSJA-LJQANCHMSA-N 0 0 374.440 3.606 20 5 FHBDRN COc1ccc(-c2noc(-c3cnn(-c4ccc([N+](=O)[O-])cc4)c3)n2)cc1 ZINC000109532337 946325037 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20 5 FHBDRN CCNC(=O)N(C)c1cccc(NC/C=C/c2ccccc2[N+](=O)[O-])c1 ZINC000475490488 946424869 /nfs/dbraw/zinc/42/48/69/946424869.db2.gz CGIAFGKEPUMDMS-VQHVLOKHSA-N 0 0 354.410 3.886 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N(Cc1ccccc1)CC1(O)CCCC1 ZINC000475497179 946437907 /nfs/dbraw/zinc/43/79/07/946437907.db2.gz JUUYXNDAECERNU-UHFFFAOYSA-N 0 0 368.433 3.851 20 5 FHBDRN CC(C)CC(=O)Nc1ccc(NC(=O)NCc2ccccc2[N+](=O)[O-])cc1 ZINC000047835117 946440977 /nfs/dbraw/zinc/44/09/77/946440977.db2.gz ILTOAQMNXQPGKV-UHFFFAOYSA-N 0 0 370.409 3.901 20 5 FHBDRN CC(C)C(=O)Nc1cccc(NC(=O)NCc2ccccc2[N+](=O)[O-])c1 ZINC000047836943 946441191 /nfs/dbraw/zinc/44/11/91/946441191.db2.gz IVWBMGPTXUHJMW-UHFFFAOYSA-N 0 0 356.382 3.511 20 5 FHBDRN CC1(C)C[C@H](Nc2c(Cl)c(Cl)ccc2[N+](=O)[O-])CCS1(=O)=O ZINC000896998027 946442222 /nfs/dbraw/zinc/44/22/22/946442222.db2.gz ITOCQVISOGEXMP-MRVPVSSYSA-N 0 0 367.254 3.669 20 5 FHBDRN CC1(C)C[C@@H](Nc2c(Cl)cc([N+](=O)[O-])cc2Cl)CCS1(=O)=O ZINC000896999198 946442968 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CC(=O)c1ccc(OC[C@H](O)c2ccccc2C(F)(F)F)c([N+](=O)[O-])c1 ZINC000179064718 946490016 /nfs/dbraw/zinc/49/00/16/946490016.db2.gz FVOVQOIUABUJAU-HNNXBMFYSA-N 0 0 369.295 3.929 20 5 FHBDRN COC(=O)[C@@H](CC(F)F)NCc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000475144370 946491388 /nfs/dbraw/zinc/49/13/88/946491388.db2.gz MLYVYDSEDBJWCM-GFCCVEGCSA-N 0 0 370.377 3.610 20 5 FHBDRN CCOc1ccc(C(=O)Nc2nccnc2-c2ccccc2)cc1[N+](=O)[O-] ZINC001271722075 946496135 /nfs/dbraw/zinc/49/61/35/946496135.db2.gz CHJVFEIHGGUXRI-UHFFFAOYSA-N 0 0 364.361 3.703 20 5 FHBDRN CC(C)c1ccc(C(=O)N[C@H]2CCCC[C@@H]2n2cccn2)cc1[N+](=O)[O-] ZINC000473899292 946499983 /nfs/dbraw/zinc/49/99/83/946499983.db2.gz XNBZHPOFRPPZCT-IRXDYDNUSA-N 0 0 356.426 3.828 20 5 FHBDRN C[C@H](NC(=O)C[C@@H]1CCc2sccc2C1=O)c1ccccc1[N+](=O)[O-] ZINC000897307072 946501856 /nfs/dbraw/zinc/50/18/56/946501856.db2.gz GZCCJWHOPXCQJY-RYUDHWBXSA-N 0 0 358.419 3.669 20 5 FHBDRN Cc1cc(N(C)Cc2ccc([S@](C)=O)cc2)c2cccc([N+](=O)[O-])c2n1 ZINC000302018903 946511308 /nfs/dbraw/zinc/51/13/08/946511308.db2.gz MUGAINYJLYTCGS-SANMLTNESA-N 0 0 369.446 3.825 20 5 FHBDRN Cc1cc(NCc2ccc3c(c2)CCO3)nc(-c2cccc([N+](=O)[O-])c2)n1 ZINC001167782384 946515357 /nfs/dbraw/zinc/51/53/57/946515357.db2.gz VEDNQBAMSIHSMK-UHFFFAOYSA-N 0 0 362.389 3.907 20 5 FHBDRN COc1cc(F)c([C@@H](C)NC(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1OC ZINC000074610407 946519125 /nfs/dbraw/zinc/51/91/25/946519125.db2.gz YLWKOXXXATXJCR-LLVKDONJSA-N 0 0 362.357 3.551 20 5 FHBDRN Cc1c(COC(C)(C)C)cccc1NCc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000475158775 946528208 /nfs/dbraw/zinc/52/82/08/946528208.db2.gz NJBSAURRXUNEGC-UHFFFAOYSA-N 0 0 371.437 3.929 20 5 FHBDRN CSc1cccc(C(=O)NCc2cccc(N3CC=CC3)c2)c1[N+](=O)[O-] ZINC000186549736 946533607 /nfs/dbraw/zinc/53/36/07/946533607.db2.gz KGPUQDYXELHQCX-UHFFFAOYSA-N 0 0 369.446 3.623 20 5 FHBDRN C[C@H](CNC(=O)N1CCC2(CC2(F)F)CC1)c1ccccc1[N+](=O)[O-] ZINC000897052974 946539387 /nfs/dbraw/zinc/53/93/87/946539387.db2.gz PHFIYUSPRDAWGW-GFCCVEGCSA-N 0 0 353.369 3.529 20 5 FHBDRN C[C@H](CNC(=O)N(C)C1CCC(F)(F)CC1)c1ccccc1[N+](=O)[O-] ZINC000897057870 946544667 /nfs/dbraw/zinc/54/46/67/946544667.db2.gz JUEVRSZKPXZGOW-GFCCVEGCSA-N 0 0 355.385 3.918 20 5 FHBDRN COc1ccc(OC)c(CNC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)c1 ZINC000025826077 946550566 /nfs/dbraw/zinc/55/05/66/946550566.db2.gz KHVCTUWZMHTXQP-UHFFFAOYSA-N 0 0 372.402 3.757 20 5 FHBDRN COc1cc(CCNC(=O)c2cccc(SC)c2[N+](=O)[O-])ccc1C ZINC000186565264 946552515 /nfs/dbraw/zinc/55/25/15/946552515.db2.gz JOQMHDRGFFSUQL-UHFFFAOYSA-N 0 0 360.435 3.606 20 5 FHBDRN CCc1ccc([C@@H](NC[C@@](C)(O)C(F)(F)F)c2ccc([N+](=O)[O-])cc2)o1 ZINC000544380005 946554413 /nfs/dbraw/zinc/55/44/13/946554413.db2.gz ASSSQOFNNAWBIR-JKSUJKDBSA-N 0 0 372.343 3.743 20 5 FHBDRN C[C@H]1CN(Cc2ccccc2NCc2ccccc2[N+](=O)[O-])C[C@H](C)O1 ZINC000475174154 946564315 /nfs/dbraw/zinc/56/43/15/946564315.db2.gz MYDXGTMIFFTKEK-HOTGVXAUSA-N 0 0 355.438 3.816 20 5 FHBDRN COc1cccc(NCCc2ccn(-c3ccc(F)cc3)n2)c1[N+](=O)[O-] ZINC000475516127 946569961 /nfs/dbraw/zinc/56/99/61/946569961.db2.gz JFGNOUBFIYAKEV-UHFFFAOYSA-N 0 0 356.357 3.583 20 5 FHBDRN C[C@H](Cc1ccncc1)NC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000475182462 946571375 /nfs/dbraw/zinc/57/13/75/946571375.db2.gz GCWPJMGPEDQNOW-SNVBAGLBSA-N 0 0 368.315 3.761 20 5 FHBDRN O=C(NCc1ccc(Br)cc1)Nc1cccc([N+](=O)[O-])c1 ZINC000048334098 946578980 /nfs/dbraw/zinc/57/89/80/946578980.db2.gz VKVNNXFXNFOSKH-UHFFFAOYSA-N 0 0 350.172 3.679 20 5 FHBDRN CCc1ccc(NC(=O)[C@H]2C[C@H]2c2cccc([N+](=O)[O-])c2)c(C(=O)OC)c1 ZINC001126142524 946599996 /nfs/dbraw/zinc/59/99/96/946599996.db2.gz GAXSKUZNEGGCGD-HOTGVXAUSA-N 0 0 368.389 3.686 20 5 FHBDRN CCc1ccc(NC(=O)[C@H]2C[C@@H]2c2cccc([N+](=O)[O-])c2)c(C(=O)OC)c1 ZINC001126142522 946600301 /nfs/dbraw/zinc/60/03/01/946600301.db2.gz GAXSKUZNEGGCGD-CVEARBPZSA-N 0 0 368.389 3.686 20 5 FHBDRN COc1cccc(O[C@@H](C)CNC(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)c1 ZINC000475548528 946617863 /nfs/dbraw/zinc/61/78/63/946617863.db2.gz BQYGRABKXIAFHB-AWEZNQCLSA-N 0 0 373.409 3.809 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N[C@@H]1CCc2cn(C(C)C)nc2C1 ZINC000475549753 946619416 /nfs/dbraw/zinc/61/94/16/946619416.db2.gz FYLRCIILEOZYHI-OAHLLOKOSA-N 0 0 371.441 3.668 20 5 FHBDRN COc1ccc(C)cc1CCNC(=O)Nc1cc(C)c([N+](=O)[O-])cc1C ZINC000475550236 946621220 /nfs/dbraw/zinc/62/12/20/946621220.db2.gz VQSDYMCBCMIOBL-UHFFFAOYSA-N 0 0 357.410 3.893 20 5 FHBDRN CCOc1ccccc1[C@H](CC)NC(=O)c1cccc([N+](=O)[O-])c1OC ZINC000475538963 946623345 /nfs/dbraw/zinc/62/33/45/946623345.db2.gz VUEQCEUGQXUVNS-HNNXBMFYSA-N 0 0 358.394 3.883 20 5 FHBDRN CN(Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)Cc1c(F)cccc1F ZINC000550331675 946627412 /nfs/dbraw/zinc/62/74/12/946627412.db2.gz WKKVCLMMBFYATO-UHFFFAOYSA-N 0 0 360.320 3.555 20 5 FHBDRN CSc1cccc(C(=O)Nc2cnn(Cc3ccccc3)c2)c1[N+](=O)[O-] ZINC000186226546 946628084 /nfs/dbraw/zinc/62/80/84/946628084.db2.gz OXDYSVXNVIECOV-UHFFFAOYSA-N 0 0 368.418 3.814 20 5 FHBDRN C[C@]1(Cc2ccccc2)CCCN1C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000186223859 946628425 /nfs/dbraw/zinc/62/84/25/946628425.db2.gz VNGKOFMZSWNVGS-HXUWFJFHSA-N 0 0 368.389 3.561 20 5 FHBDRN CSc1cccc(C(=O)NC[C@H](C)Oc2ccc(F)cc2)c1[N+](=O)[O-] ZINC000186594441 946635590 /nfs/dbraw/zinc/63/55/90/946635590.db2.gz DOACLKTYTVGBJR-NSHDSACASA-N 0 0 364.398 3.653 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NC[C@@H](C)Oc1ccc(F)cc1 ZINC000475554815 946637397 /nfs/dbraw/zinc/63/73/97/946637397.db2.gz NPDFNQOEFZLEBC-CYBMUJFWSA-N 0 0 361.373 3.940 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])o1)N1CCC(Cc2cc(F)cc(F)c2)CC1 ZINC000456707172 946642644 /nfs/dbraw/zinc/64/26/44/946642644.db2.gz BNMIXGXZGJNDNV-UHFFFAOYSA-N 0 0 350.321 3.561 20 5 FHBDRN COC(=O)c1cc(C)nc(N(C)Cc2csc3ccccc23)c1[N+](=O)[O-] ZINC000550340766 946645040 /nfs/dbraw/zinc/64/50/40/946645040.db2.gz JUIZOVNIYBQPMD-UHFFFAOYSA-N 0 0 371.418 3.936 20 5 FHBDRN C[C@H](NC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2)c1cc2ccccc2o1 ZINC000027806267 946676961 /nfs/dbraw/zinc/67/69/61/946676961.db2.gz HBAADLSZLWMKTB-JTQLQIEISA-N 0 0 354.318 3.561 20 5 FHBDRN Cc1cc(NC(=O)COc2cccc([N+](=O)[O-])c2)ccc1C(F)(F)F ZINC000440289999 946677926 /nfs/dbraw/zinc/67/79/26/946677926.db2.gz HNBUTLFPUXNGDD-UHFFFAOYSA-N 0 0 354.284 3.940 20 5 FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[C@H](C)CC1 ZINC000487496910 946683014 /nfs/dbraw/zinc/68/30/14/946683014.db2.gz BETJNENJQAZUIO-JOCQHMNTSA-N 0 0 352.456 3.642 20 5 FHBDRN CCS[C@H]1CCCCN(C(=O)Nc2cc([N+](=O)[O-])ccc2OC)C1 ZINC000112120460 946689345 /nfs/dbraw/zinc/68/93/45/946689345.db2.gz NGHWUSXTKIDFPQ-ZDUSSCGKSA-N 0 0 353.444 3.743 20 5 FHBDRN COc1ccc(CN2CCC(C(=O)c3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000051379374 946690900 /nfs/dbraw/zinc/69/09/00/946690900.db2.gz CQFJWVRDGRZCRY-UHFFFAOYSA-N 0 0 354.406 3.698 20 5 FHBDRN CCS[C@@H]1CCCCN(C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000112134687 946704439 /nfs/dbraw/zinc/70/44/39/946704439.db2.gz WRNPTKMGFFRZJL-CZUORRHYSA-N 0 0 351.472 3.973 20 5 FHBDRN CCS[C@H]1CCCCN(C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000112134688 946705554 /nfs/dbraw/zinc/70/55/54/946705554.db2.gz WRNPTKMGFFRZJL-CJNGLKHVSA-N 0 0 351.472 3.973 20 5 FHBDRN CCOc1ccc(NC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)cc1F ZINC000088363870 946706808 /nfs/dbraw/zinc/70/68/08/946706808.db2.gz HWZJQPGVNBAHBW-UHFFFAOYSA-N 0 0 359.357 3.723 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NC[C@@H](C)[N@H+](C)Cc1ccccc1 ZINC000475575220 946723875 /nfs/dbraw/zinc/72/38/75/946723875.db2.gz QNJGFUSYSQUCDU-MRXNPFEDSA-N 0 0 370.453 3.854 20 5 FHBDRN Cc1cccc2c1CC[C@@H]2NS(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000729489999 946736383 /nfs/dbraw/zinc/73/63/83/946736383.db2.gz AODDSSMGQIGHEL-AWEZNQCLSA-N 0 0 366.826 3.522 20 5 FHBDRN COc1c(C(=O)Nc2ccc(-n3cccn3)c(Cl)c2)cccc1[N+](=O)[O-] ZINC000475580865 946746244 /nfs/dbraw/zinc/74/62/44/946746244.db2.gz GPTMMWXREPVPRE-UHFFFAOYSA-N 0 0 372.768 3.695 20 5 FHBDRN Cc1cn(-c2ccccc2)nc1C(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000186278625 946748741 /nfs/dbraw/zinc/74/87/41/946748741.db2.gz RBAWEMDFOYEDIH-UHFFFAOYSA-N 0 0 364.405 3.754 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)C[C@@H]2CC(=O)Nc3ccccc32)cc1[N+](=O)[O-] ZINC001126610693 946749502 /nfs/dbraw/zinc/74/95/02/946749502.db2.gz HKVMZFJCHYWUOY-DZGCQCFKSA-N 0 0 367.405 3.597 20 5 FHBDRN C[C@@H]1Cc2ccccc2N(S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000104749429 946750725 /nfs/dbraw/zinc/75/07/25/946750725.db2.gz YYKWNAWVWYBBMA-LLVKDONJSA-N 0 0 366.826 3.636 20 5 FHBDRN O=C(COc1ccccc1[N+](=O)[O-])Nc1cccc(Oc2ccncc2)c1 ZINC000112183102 946757374 /nfs/dbraw/zinc/75/73/74/946757374.db2.gz WECBRISJWNGRJB-UHFFFAOYSA-N 0 0 365.345 3.800 20 5 FHBDRN COc1c(C(=O)NCCc2cc(Cl)cc(Cl)c2)cccc1[N+](=O)[O-] ZINC000475254060 946764268 /nfs/dbraw/zinc/76/42/68/946764268.db2.gz ILUXWIFECXEFJS-UHFFFAOYSA-N 0 0 369.204 3.883 20 5 FHBDRN CCc1c(C(=O)N(C)Cc2ccccc2[N+](=O)[O-])cnn1C1CCCC1 ZINC000475258055 946769718 /nfs/dbraw/zinc/76/97/18/946769718.db2.gz GJXAVBLMOBJSMJ-UHFFFAOYSA-N 0 0 356.426 3.741 20 5 FHBDRN COc1c(C(=O)NCC2(c3ccc(Cl)cc3)CC2)cccc1[N+](=O)[O-] ZINC000475589953 946772488 /nfs/dbraw/zinc/77/24/88/946772488.db2.gz MUNVTJXRUYLVOK-UHFFFAOYSA-N 0 0 360.797 3.718 20 5 FHBDRN CCOC(=O)c1ccnc(N[C@@H](c2ccc(OC)cc2)C(C)C)c1[N+](=O)[O-] ZINC000523111767 946774736 /nfs/dbraw/zinc/77/47/36/946774736.db2.gz QQANLNZCTZPHIP-MRXNPFEDSA-N 0 0 373.409 3.984 20 5 FHBDRN COC(=O)c1cc(COc2ccc([N+](=O)[O-])cc2Br)oc1C ZINC000523109937 946778433 /nfs/dbraw/zinc/77/84/33/946778433.db2.gz GCSOCGVCCODXTC-UHFFFAOYSA-N 0 0 370.155 3.624 20 5 FHBDRN O=C(CC1CCC(=O)CC1)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F ZINC000475260760 946788575 /nfs/dbraw/zinc/78/85/75/946788575.db2.gz VRUKNCZWCZFTGP-UHFFFAOYSA-N 0 0 372.343 3.635 20 5 FHBDRN CCOC(=O)c1ccnc(NCc2ccccc2COC(C)C)c1[N+](=O)[O-] ZINC000523113440 946788871 /nfs/dbraw/zinc/78/88/71/946788871.db2.gz RSCVJWKGPQJDMO-UHFFFAOYSA-N 0 0 373.409 3.704 20 5 FHBDRN CCOc1ccc(-c2noc(CSc3ccc([N+](=O)[O-])cc3)n2)cn1 ZINC000545663550 946794858 /nfs/dbraw/zinc/79/48/58/946794858.db2.gz ODQVYXQJMVYLHI-UHFFFAOYSA-N 0 0 358.379 3.731 20 5 FHBDRN O=C(c1cnc(-c2ccsc2)s1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000112231945 946810700 /nfs/dbraw/zinc/81/07/00/946810700.db2.gz OZBOADORFNAOAZ-UHFFFAOYSA-N 0 0 357.416 3.983 20 5 FHBDRN Cc1c(CNC(=O)N2CCC(C)=C(c3ccco3)C2)cccc1[N+](=O)[O-] ZINC000511900259 946811499 /nfs/dbraw/zinc/81/14/99/946811499.db2.gz AVPQDPZWZSTCJK-UHFFFAOYSA-N 0 0 355.394 3.885 20 5 FHBDRN O=C(NCc1ccc(Oc2cccnc2)c(F)c1)c1ccc([N+](=O)[O-])s1 ZINC000067552190 946819455 /nfs/dbraw/zinc/81/94/55/946819455.db2.gz VWLUCGZOSJQCQD-UHFFFAOYSA-N 0 0 373.365 3.913 20 5 FHBDRN CC(C)(C)OCc1cc(C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)no1 ZINC000186665738 946827272 /nfs/dbraw/zinc/82/72/72/946827272.db2.gz RVBNXUFQVPMOSE-UHFFFAOYSA-N 0 0 373.409 3.703 20 5 FHBDRN COc1ccc(C[C@@H](C)C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000186304452 946829526 /nfs/dbraw/zinc/82/95/26/946829526.db2.gz PXZQRQIURXBZGY-GFCCVEGCSA-N 0 0 362.813 3.752 20 5 FHBDRN Cc1cncc(N(Cc2ccc(F)cc2)C(=O)c2ccc([N+](=O)[O-])n2C)c1 ZINC000441420396 946829588 /nfs/dbraw/zinc/82/95/88/946829588.db2.gz FTUNWAOBIMIICC-UHFFFAOYSA-N 0 0 368.368 3.623 20 5 FHBDRN O=C(Cc1ccc(OC(F)F)cc1)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186305944 946831579 /nfs/dbraw/zinc/83/15/79/946831579.db2.gz WXHXORHCUDAOHS-UHFFFAOYSA-N 0 0 370.739 3.709 20 5 FHBDRN Cc1cc(NCc2ncccc2N(C)C)c([N+](=O)[O-])cc1C(F)(F)F ZINC000549577076 946832253 /nfs/dbraw/zinc/83/22/53/946832253.db2.gz GVDVTTUDBGZRQF-UHFFFAOYSA-N 0 0 354.332 3.995 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])c1cccnc1SC(F)(F)F ZINC000067549713 946835105 /nfs/dbraw/zinc/83/51/05/946835105.db2.gz PBMUIOGOVUMHHF-UHFFFAOYSA-N 0 0 357.313 3.532 20 5 FHBDRN O=C(/C=C/c1ccccc1F)O[C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1 ZINC000759928296 946835733 /nfs/dbraw/zinc/83/57/33/946835733.db2.gz ACUVHCQERLRTBD-DMGQIGSTSA-N 0 0 359.357 3.671 20 5 FHBDRN COc1c(C(=O)Nc2ccnn2-c2cccc(Cl)c2)cccc1[N+](=O)[O-] ZINC000475599029 946852189 /nfs/dbraw/zinc/85/21/89/946852189.db2.gz CHANITDERGKZEQ-UHFFFAOYSA-N 0 0 372.768 3.695 20 5 FHBDRN COc1cccc(F)c1NC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000184488376 946857495 /nfs/dbraw/zinc/85/74/95/946857495.db2.gz OCTLXQJNWHWPHF-UHFFFAOYSA-N 0 0 369.146 3.757 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)Nc1cc(NC(=O)C2CC2)ccc1C ZINC000129762940 946876784 /nfs/dbraw/zinc/87/67/84/946876784.db2.gz XTHQCTAFQQKZDF-UHFFFAOYSA-N 0 0 369.377 3.513 20 5 FHBDRN CCNc1ccc(C(=O)N2CC[C@@H](c3ccccc3OC)C2)cc1[N+](=O)[O-] ZINC000523126002 946884766 /nfs/dbraw/zinc/88/47/66/946884766.db2.gz YZEAVOBCSGUZJR-OAHLLOKOSA-N 0 0 369.421 3.665 20 5 FHBDRN C[C@H](C(=O)NCc1ccc([N+](=O)[O-])cc1Cl)c1c(F)cccc1F ZINC000186321234 946884929 /nfs/dbraw/zinc/88/49/29/946884929.db2.gz TXGLJRSYPBKHNR-VIFPVBQESA-N 0 0 354.740 3.946 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)c1ccc(Br)o1 ZINC000186321884 946886183 /nfs/dbraw/zinc/88/61/83/946886183.db2.gz WUHKDDKHQHISRD-UHFFFAOYSA-N 0 0 359.563 3.534 20 5 FHBDRN COc1cc(C(=O)Nc2cc3[nH]ccc3cc2C)c([N+](=O)[O-])cc1OC ZINC000444457537 946892986 /nfs/dbraw/zinc/89/29/86/946892986.db2.gz MQKNIIJVGCBJEV-UHFFFAOYSA-N 0 0 355.350 3.654 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2noc(CN3CCCc4cccc(F)c43)n2)c1 ZINC000025940107 946905439 /nfs/dbraw/zinc/90/54/39/946905439.db2.gz AENLFJZAUUFFIF-UHFFFAOYSA-N 0 0 354.341 3.737 20 5 FHBDRN C[C@@H]1[C@H](C(=O)N2c3ccc([N+](=O)[O-])cc3C[C@@H]2C)CCN1c1ccccc1 ZINC000475341676 946909761 /nfs/dbraw/zinc/90/97/61/946909761.db2.gz DMEODHXCGMANKI-QMTMVMCOSA-N 0 0 365.433 3.787 20 5 FHBDRN COc1c(F)c(F)ccc1-n1c2ccccc2cc2c(=O)c(N)ccc1-2 ZINC001211900820 946912737 /nfs/dbraw/zinc/91/27/37/946912737.db2.gz OCPPADFSLPSYOS-UHFFFAOYSA-N 0 0 352.340 3.965 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N1CC=C(c2ccc(O)cc2)CC1 ZINC000087059942 946915277 /nfs/dbraw/zinc/91/52/77/946915277.db2.gz JYWGMVNWCRNBNF-UHFFFAOYSA-N 0 0 352.390 3.549 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)N[C@@H]1C[C@@H]1c1cccc(F)c1 ZINC000184509069 946920715 /nfs/dbraw/zinc/92/07/15/946920715.db2.gz CABWWPJLKYIHSG-GDBMZVCRSA-N 0 0 363.776 3.743 20 5 FHBDRN O=[N+]([O-])c1cc(C(F)(F)F)cc([N+](=O)[O-])c1N[C@@H](CO)c1ccccc1 ZINC000112672599 946936957 /nfs/dbraw/zinc/93/69/57/946936957.db2.gz LYONFNPSZIKKSX-NSHDSACASA-N 0 0 371.271 3.667 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)N[C@H]1CCCc2c(F)cccc21 ZINC000458890028 946939825 /nfs/dbraw/zinc/93/98/25/946939825.db2.gz TYWBGLJMAIZMLO-KRWDZBQOSA-N 0 0 357.385 3.953 20 5 FHBDRN C[C@H](NC(=O)N(C)[C@@H]1CCc2ccccc2C1)c1ccc([N+](=O)[O-])cc1 ZINC000458890391 946942422 /nfs/dbraw/zinc/94/24/22/946942422.db2.gz OVOFTVFHYCQSGM-IFXJQAMLSA-N 0 0 353.422 3.855 20 5 FHBDRN CCS[C@H]1CC[C@H](N(C)C(=O)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000458890437 946942849 /nfs/dbraw/zinc/94/28/49/946942849.db2.gz PPHKTUYXQOWOIF-RCBQFDQVSA-N 0 0 351.472 3.971 20 5 FHBDRN CSc1cc(NC(=O)c2cccc([N+](=O)[O-])c2Br)ccn1 ZINC000758918821 946946105 /nfs/dbraw/zinc/94/61/05/946946105.db2.gz TYYASZFUIWVEKR-UHFFFAOYSA-N 0 0 368.212 3.727 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@H]1C[C@H]1c1c(F)cccc1F ZINC000186337635 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3.840 20 5 FHBDRN Cc1nn(CCC(=O)NC2CCC(c3ccccc3)CC2)c(C)c1[N+](=O)[O-] ZINC000523223787 947006513 /nfs/dbraw/zinc/00/65/13/947006513.db2.gz URVUKPJSUUEFQS-UHFFFAOYSA-N 0 0 370.453 3.641 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NCc1ccc2c(n1)CCCC2 ZINC000444557615 947014813 /nfs/dbraw/zinc/01/48/13/947014813.db2.gz MGARLRGXXMXOAW-UHFFFAOYSA-N 0 0 353.422 3.724 20 5 FHBDRN CC1CCN(c2ccc(C(=O)N3CCCC34CCC4)cc2[N+](=O)[O-])CC1 ZINC000444611216 947036984 /nfs/dbraw/zinc/03/69/84/947036984.db2.gz FKOMRIZYLVBARZ-UHFFFAOYSA-N 0 0 357.454 3.990 20 5 FHBDRN O=C(CC/C=C/c1ccccc1)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444635206 947047497 /nfs/dbraw/zinc/04/74/97/947047497.db2.gz JWUYEAHCSSPQON-XBXARRHUSA-N 0 0 350.378 3.581 20 5 FHBDRN CC[C@H](Sc1ccccc1)C(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444635817 947047666 /nfs/dbraw/zinc/04/76/66/947047666.db2.gz LPTGLUOEFJXGNX-INIZCTEOSA-N 0 0 370.434 3.658 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N1C[C@@H](C)O[C@@H](c2ccc(F)cc2)C1 ZINC000152027911 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FHBDRN C[C@H](CC(=O)N1CCc2c1cccc2[N+](=O)[O-])C(=O)c1cccc(F)c1 ZINC000073848814 947294595 /nfs/dbraw/zinc/29/45/95/947294595.db2.gz QINOKAZFTDFWIA-GFCCVEGCSA-N 0 0 356.353 3.532 20 5 FHBDRN CC(C)[C@H](NC(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccccc1 ZINC000444868789 947295307 /nfs/dbraw/zinc/29/53/07/947295307.db2.gz CRKSLXKPAGKDAZ-SFHVURJKSA-N 0 0 367.409 3.668 20 5 FHBDRN Cc1nccn1-c1ccc([C@@H](C)NC(=O)c2ccc(F)cc2[N+](=O)[O-])cc1 ZINC000150779931 947309174 /nfs/dbraw/zinc/30/91/74/947309174.db2.gz LYMMPHMAAPUZTL-GFCCVEGCSA-N 0 0 368.368 3.719 20 5 FHBDRN C[C@@H](NC(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1cccc(Cl)c1 ZINC000444884441 947311249 /nfs/dbraw/zinc/31/12/49/947311249.db2.gz HPNNZJPYKBTERC-SNVBAGLBSA-N 0 0 373.800 3.685 20 5 FHBDRN CC1CCN(c2cccc(NC(=O)COc3ccc([N+](=O)[O-])cc3)c2)CC1 ZINC000523494534 947312954 /nfs/dbraw/zinc/31/29/54/947312954.db2.gz JDLRBTQVRBLLIV-UHFFFAOYSA-N 0 0 369.421 3.849 20 5 FHBDRN C[C@@H](Oc1cccc(F)c1)C(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000523499943 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COc1cc([N+](=O)[O-])ccc1NC(=O)NC1(c2nc(C)cs2)CCC1 ZINC000444932435 947355959 /nfs/dbraw/zinc/35/59/59/947355959.db2.gz UZVGJMDGICBWDY-UHFFFAOYSA-N 0 0 362.411 3.569 20 5 FHBDRN CC(F)(F)c1cccc(NC(=O)NCCNc2ccc([N+](=O)[O-])cc2)c1 ZINC000444934363 947356450 /nfs/dbraw/zinc/35/64/50/947356450.db2.gz XBEAMQJQUPGMNG-UHFFFAOYSA-N 0 0 364.352 3.940 20 5 FHBDRN CC[C@@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1OC)c1ccc(OC)cc1 ZINC000444936544 947359670 /nfs/dbraw/zinc/35/96/70/947359670.db2.gz LLHVOPISPQSJDB-OAHLLOKOSA-N 0 0 359.382 3.885 20 5 FHBDRN O=C(Cn1ccc([N+](=O)[O-])n1)N[C@@H](CC1CCCCC1)c1ccccc1 ZINC000523566055 947373911 /nfs/dbraw/zinc/37/39/11/947373911.db2.gz UCPBAEMAKBHGQM-KRWDZBQOSA-N 0 0 356.426 3.619 20 5 FHBDRN O=C(Nc1ccc2cc([N+](=O)[O-])ccc2n1)[C@H]1CCCC[C@@H]1C(F)(F)F ZINC000440618670 947377488 /nfs/dbraw/zinc/37/74/88/947377488.db2.gz NCCIAAFMWNXMGG-STQMWFEESA-N 0 0 367.327 3.872 20 5 FHBDRN CCCc1nnc(Sc2ncc([N+](=O)[O-])c(C)c2Br)o1 ZINC000544395798 947391853 /nfs/dbraw/zinc/39/18/53/947391853.db2.gz USEJHRJSDFNEHU-UHFFFAOYSA-N 0 0 359.205 3.547 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)N2Cc3ccccc3OC[C@H]2C)cc1[N+](=O)[O-] ZINC000543908901 947416377 /nfs/dbraw/zinc/41/63/77/947416377.db2.gz XIJZKCRCGKJZHF-CABCVRRESA-N 0 0 369.421 3.957 20 5 FHBDRN Cc1c(NC(=O)C2=C(C)OCCS2)cc(Br)cc1[N+](=O)[O-] ZINC000839348585 947422888 /nfs/dbraw/zinc/42/28/88/947422888.db2.gz LAOSDFFITANHMJ-UHFFFAOYSA-N 0 0 373.228 3.599 20 5 FHBDRN C[C@H](C(=O)N[C@H]1CCCc2c(O)cccc21)c1ccc([N+](=O)[O-])cc1F ZINC000190292059 947430277 /nfs/dbraw/zinc/43/02/77/947430277.db2.gz NODRWAPERNKRBT-GTNSWQLSSA-N 0 0 358.369 3.737 20 5 FHBDRN O=C(NCCCc1ccc(Cl)cc1)NCCc1ccc([N+](=O)[O-])cc1 ZINC000523617316 947445329 /nfs/dbraw/zinc/44/53/29/947445329.db2.gz KDHMRIWBEQUXTG-UHFFFAOYSA-N 0 0 361.829 3.723 20 5 FHBDRN Cn1cc(-c2ccccc2CNC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cn1 ZINC000759931178 947456406 /nfs/dbraw/zinc/45/64/06/947456406.db2.gz CYFWXQRUBAEAIV-UHFFFAOYSA-N 0 0 370.796 3.579 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(C(=O)N2CCS[C@@H](C)[C@@H]2c2ccccc2)n1 ZINC001126203424 947476011 /nfs/dbraw/zinc/47/60/11/947476011.db2.gz LGCSWNLBOPIYQQ-SUMWQHHRSA-N 0 0 357.435 3.617 20 5 FHBDRN CCCN(C(=O)c1cc2nccnc2cc1F)c1cccc([N+](=O)[O-])c1 ZINC000441449454 947489087 /nfs/dbraw/zinc/48/90/87/947489087.db2.gz RASVLJLTZDRDAB-UHFFFAOYSA-N 0 0 354.341 3.734 20 5 FHBDRN COc1cc(C(=O)Nc2ccc(F)cc2OC(F)F)cc([N+](=O)[O-])c1C ZINC000188256288 947490346 /nfs/dbraw/zinc/49/03/46/947490346.db2.gz WAAOVGCLBRRIEQ-UHFFFAOYSA-N 0 0 370.283 3.905 20 5 FHBDRN COCc1nc(CNc2ccc([N+](=O)[O-])nc2)c(-c2ccccc2)s1 ZINC000440649166 947494482 /nfs/dbraw/zinc/49/44/82/947494482.db2.gz KRKNSFCZAYXWMK-UHFFFAOYSA-N 0 0 356.407 3.872 20 5 FHBDRN COc1ccc(C(C)=O)c(O[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)c1 ZINC000021372977 947498125 /nfs/dbraw/zinc/49/81/25/947498125.db2.gz JHROYXHAPWPNOM-ZDUSSCGKSA-N 0 0 372.377 3.520 20 5 FHBDRN O=C(COc1cccc(Cl)c1Cl)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000021380868 947498428 /nfs/dbraw/zinc/49/84/28/947498428.db2.gz ZWXCVVKAKDVIEU-UHFFFAOYSA-N 0 0 367.188 3.870 20 5 FHBDRN O=C(Nc1ccc2c(c1)CC(=O)N2)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000072819310 947504457 /nfs/dbraw/zinc/50/44/57/947504457.db2.gz CSXLUBYALKFPKC-UHFFFAOYSA-N 0 0 353.359 3.556 20 5 FHBDRN C[C@H](NC(=O)N(C)Cc1cc(C(C)(C)C)n[nH]1)c1ccccc1[N+](=O)[O-] ZINC000445093895 947508162 /nfs/dbraw/zinc/50/81/62/947508162.db2.gz QKSYIUAIIXUZGG-LBPRGKRZSA-N 0 0 359.430 3.518 20 5 FHBDRN CC(C)[C@H]1CCCN(S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000523705689 947516063 /nfs/dbraw/zinc/51/60/63/947516063.db2.gz XLHUPTBYKPJADQ-LBPRGKRZSA-N 0 0 360.863 3.695 20 5 FHBDRN O=C(O[C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1)c1cccc(F)c1Cl ZINC000759932180 947522870 /nfs/dbraw/zinc/52/28/70/947522870.db2.gz MXXYSAYPNDVVHV-CHWSQXEVSA-N 0 0 367.764 3.925 20 5 FHBDRN O=C(O[C@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)c1cccc(F)c1Cl ZINC000759932187 947522882 /nfs/dbraw/zinc/52/28/82/947522882.db2.gz MXXYSAYPNDVVHV-STQMWFEESA-N 0 0 367.764 3.925 20 5 FHBDRN C[C@@](O)(C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C(F)(F)F ZINC000536336909 947533153 /nfs/dbraw/zinc/53/31/53/947533153.db2.gz QGSFFSBILUURHN-CQSZACIVSA-N 0 0 360.357 3.726 20 5 FHBDRN Cc1occc1CN(C)C(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000278858873 947547531 /nfs/dbraw/zinc/54/75/31/947547531.db2.gz DWFJEWRDWFKZSI-UHFFFAOYSA-N 0 0 371.315 3.857 20 5 FHBDRN CCc1onc(C)c1CNCc1cc(Br)c([N+](=O)[O-])s1 ZINC000897336917 947558893 /nfs/dbraw/zinc/55/88/93/947558893.db2.gz RJRFAEBXZMXAHQ-UHFFFAOYSA-N 0 0 360.233 3.567 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCc1ccc2c(n1)CCCC2 ZINC000445163085 947559845 /nfs/dbraw/zinc/55/98/45/947559845.db2.gz HFTMUIFYSXRSLX-UHFFFAOYSA-N 0 0 354.410 3.807 20 5 FHBDRN C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)[C@@H](C)CO1 ZINC000120339935 947562266 /nfs/dbraw/zinc/56/22/66/947562266.db2.gz BQYSVHQBUBXPBF-UONOGXRCSA-N 0 0 356.378 3.637 20 5 FHBDRN Cc1cc(S(=O)(=O)N(C)[C@H](c2ccccc2)C(C)C)ccc1[N+](=O)[O-] ZINC000523758101 947576504 /nfs/dbraw/zinc/57/65/04/947576504.db2.gz OPCDQXQPSPAVKC-SFHVURJKSA-N 0 0 362.451 3.921 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H](C)c1cccc(-n2cccn2)c1 ZINC000074939759 947579996 /nfs/dbraw/zinc/57/99/96/947579996.db2.gz WNAOIOVZLQPZQO-AWEZNQCLSA-N 0 0 365.393 3.972 20 5 FHBDRN C[C@H]1CCC[C@@H](CNC(=O)c2sc(Br)cc2[N+](=O)[O-])C1 ZINC000445189148 947580800 /nfs/dbraw/zinc/58/08/00/947580800.db2.gz VCBQPKJWQVVEPZ-DTWKUNHWSA-N 0 0 361.261 3.975 20 5 FHBDRN C[C@@H]1C[C@H](c2ccccc2)CN1c1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-] ZINC000523751782 947586117 /nfs/dbraw/zinc/58/61/17/947586117.db2.gz SKJXNOUBUYDPCQ-PBHICJAKSA-N 0 0 365.433 3.869 20 5 FHBDRN O=C(O[C@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)c1cc(F)cc(Cl)c1 ZINC000759934189 947587339 /nfs/dbraw/zinc/58/73/39/947587339.db2.gz PNLNRMGLBLTKDX-KBPBESRZSA-N 0 0 367.764 3.925 20 5 FHBDRN O=C(Nc1ccncc1)c1ccccc1Sc1ccccc1[N+](=O)[O-] ZINC000440676665 947598366 /nfs/dbraw/zinc/59/83/66/947598366.db2.gz CXGJRYHDGYNBDE-UHFFFAOYSA-N 0 0 351.387 3.815 20 5 FHBDRN CCc1ccc(/C=C\c2nc(CCNc3ccccc3[N+](=O)[O-])no2)o1 ZINC000445231954 947612830 /nfs/dbraw/zinc/61/28/30/947612830.db2.gz GUMYFIWDEFTPQO-KTKRTIGZSA-N 0 0 354.366 3.958 20 5 FHBDRN CC(C)c1ccc(C[C@H]2CCN(C(=O)c3c[nH]c(=O)c([N+](=O)[O-])c3)C2)cc1 ZINC000445218644 947618261 /nfs/dbraw/zinc/61/82/61/947618261.db2.gz RDAHOPCVPSVGDO-OAHLLOKOSA-N 0 0 369.421 3.524 20 5 FHBDRN O=C(N[C@H](C1CCCC1)C(F)(F)F)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000127918099 947628823 /nfs/dbraw/zinc/62/88/23/947628823.db2.gz HOLBYHDUSPVJQM-OAHLLOKOSA-N 0 0 371.359 3.784 20 5 FHBDRN Cc1ccccc1[C@H](C)CC(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000523817393 947636178 /nfs/dbraw/zinc/63/61/78/947636178.db2.gz ZCMMYMDRDUPNKS-QGZVFWFLSA-N 0 0 367.449 3.746 20 5 FHBDRN CO[C@](C)(CNC(=O)N[C@@H](C)c1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000454754661 947642379 /nfs/dbraw/zinc/64/23/79/947642379.db2.gz GNOPYVZCLAWKGT-IFXJQAMLSA-N 0 0 357.410 3.517 20 5 FHBDRN O=C(c1n[nH]c2ccc([N+](=O)[O-])cc21)N1CC2(CCC2)c2c1cccc2F ZINC000523859468 947668646 /nfs/dbraw/zinc/66/86/46/947668646.db2.gz PZOLDVISPUWUOT-UHFFFAOYSA-N 0 0 366.352 3.692 20 5 FHBDRN CCCN(C(=O)c1ccc(O[C@@H]2CCOC2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000441464280 947671134 /nfs/dbraw/zinc/67/11/34/947671134.db2.gz MQPMPYHRSONQMK-LJQANCHMSA-N 0 0 370.405 3.819 20 5 FHBDRN O=C(CSc1cccc(Cl)c1)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000523869264 947680212 /nfs/dbraw/zinc/68/02/12/947680212.db2.gz UYSQCQFMDJUDFC-UHFFFAOYSA-N 0 0 366.782 3.708 20 5 FHBDRN C[C@@H]1CC[C@H](NC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000523888717 947690204 /nfs/dbraw/zinc/69/02/04/947690204.db2.gz VMBSEUWXSPSQMI-DYEKYZERSA-N 0 0 354.834 3.958 20 5 FHBDRN Cc1cc(C)cc(OCC(=O)O[C@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)c1 ZINC000759936061 947691630 /nfs/dbraw/zinc/69/16/30/947691630.db2.gz DRSOCCYDPZQCID-IRXDYDNUSA-N 0 0 373.409 3.514 20 5 FHBDRN Cn1ccc2c1cccc2C(=O)O[C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000759936032 947695346 /nfs/dbraw/zinc/69/53/46/947695346.db2.gz DHGQZTNMPATUJX-IAGOWNOFSA-N 0 0 368.393 3.624 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CCCC[C@H]1n1cccn1 ZINC000248398203 947698949 /nfs/dbraw/zinc/69/89/49/947698949.db2.gz TVAGDRWFSSSRRH-NZSAHSFTSA-N 0 0 370.453 3.660 20 5 FHBDRN Cc1ccc(CNC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])c(C)c1 ZINC000523878384 947704112 /nfs/dbraw/zinc/70/41/12/947704112.db2.gz PKXPDKHAGBAKDJ-UHFFFAOYSA-N 0 0 362.813 3.950 20 5 FHBDRN Cc1cccc(NC(=O)Cc2noc(-c3ccc([N+](=O)[O-])cc3Cl)n2)c1 ZINC000445327549 947715080 /nfs/dbraw/zinc/71/50/80/947715080.db2.gz ZKDHTCZFQLSUTA-UHFFFAOYSA-N 0 0 372.768 3.788 20 5 FHBDRN Cc1cccc(NC(=O)Cc2noc(/C=C\c3ccc([N+](=O)[O-])cc3)n2)c1 ZINC000445326045 947715500 /nfs/dbraw/zinc/71/55/00/947715500.db2.gz ATUNPWPEGRDSLH-YFHOEESVSA-N 0 0 364.361 3.638 20 5 FHBDRN C[C@H](NC(=O)N1Cc2ccccc2OC[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000543909090 947721202 /nfs/dbraw/zinc/72/12/02/947721202.db2.gz YMXZQQIRKXFAPB-KGLIPLIRSA-N 0 0 355.394 3.649 20 5 FHBDRN CC/C(=C/C(=O)N1CCC(n2ccc([N+](=O)[O-])n2)CC1)c1ccc(C)cc1 ZINC000785335225 947723557 /nfs/dbraw/zinc/72/35/57/947723557.db2.gz GKQQEDTUTNEEFA-PEZBUJJGSA-N 0 0 368.437 3.757 20 5 FHBDRN O=[N+]([O-])c1ccc(OC[C@@H](O)COc2ccc(Cl)cc2)c2cccnc21 ZINC000184582957 947724372 /nfs/dbraw/zinc/72/43/72/947724372.db2.gz WDXBGVPHPSZLJY-ZDUSSCGKSA-N 0 0 374.780 3.615 20 5 FHBDRN CCc1ccc(NC(=O)Cc2noc(-c3ccc(C)c([N+](=O)[O-])c3)n2)cc1 ZINC000445323455 947728306 /nfs/dbraw/zinc/72/83/06/947728306.db2.gz UHAJNXKVGAVMOL-UHFFFAOYSA-N 0 0 366.377 3.697 20 5 FHBDRN Cc1cccc(C)c1NC(=O)Cc1noc(-c2ccc([N+](=O)[O-])c(C)c2)n1 ZINC000445323884 947729039 /nfs/dbraw/zinc/72/90/39/947729039.db2.gz XDOYGCLQZWBPPF-UHFFFAOYSA-N 0 0 366.377 3.751 20 5 FHBDRN Cc1cc(C(=O)COC(=O)c2c(C)cccc2[N+](=O)[O-])c(C)n1C1CC1 ZINC000026118185 947730423 /nfs/dbraw/zinc/73/04/23/947730423.db2.gz IQWWCGGMMBOWDH-UHFFFAOYSA-N 0 0 356.378 3.696 20 5 FHBDRN Cc1cc(C)c(NC(=O)Cc2noc(-c3ccc([N+](=O)[O-])s3)n2)c(C)c1 ZINC000445332344 947731189 /nfs/dbraw/zinc/73/11/89/947731189.db2.gz PGOBEYDBEVNQJY-UHFFFAOYSA-N 0 0 372.406 3.813 20 5 FHBDRN CCOc1cnc(NCc2ccc(-n3nc(C)cc3C)cc2)c([N+](=O)[O-])c1 ZINC001167797505 947733795 /nfs/dbraw/zinc/73/37/95/947733795.db2.gz QYDQMNJIAUFQEH-UHFFFAOYSA-N 0 0 367.409 3.803 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1F)N(Cc1ccsc1)c1cccnc1 ZINC000440726758 947738979 /nfs/dbraw/zinc/73/89/79/947738979.db2.gz PGGSFFBBZQKRCU-UHFFFAOYSA-N 0 0 371.393 3.966 20 5 FHBDRN O=C(Nc1cc(C(F)(F)F)ccn1)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000507757465 947740570 /nfs/dbraw/zinc/74/05/70/947740570.db2.gz PSLQDECSSQBCPJ-UHFFFAOYSA-N 0 0 350.256 3.742 20 5 FHBDRN Cc1cc(NC(=O)N2CCO[C@H](c3cccc(F)c3)C2)ccc1[N+](=O)[O-] ZINC000184601275 947804587 /nfs/dbraw/zinc/80/45/87/947804587.db2.gz RQYLFKSNWODJLE-KRWDZBQOSA-N 0 0 359.357 3.648 20 5 FHBDRN CS[C@H]1CCCCN(C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000129510395 947823919 /nfs/dbraw/zinc/82/39/19/947823919.db2.gz VECGNORYUTWATO-HIFRSBDPSA-N 0 0 351.472 3.891 20 5 FHBDRN COC(=O)c1cc2ccc(Oc3ncnc4ccc([N+](=O)[O-])cc43)cc2o1 ZINC000613894460 947852098 /nfs/dbraw/zinc/85/20/98/947852098.db2.gz AZOPHGYGWCOOEK-UHFFFAOYSA-N 0 0 365.301 3.863 20 5 FHBDRN C[C@H](NS(=O)(=O)Cc1cccc([N+](=O)[O-])c1)c1cc2ccccc2o1 ZINC000151413447 947867398 /nfs/dbraw/zinc/86/73/98/947867398.db2.gz VIVUISGCXNFPDF-LBPRGKRZSA-N 0 0 360.391 3.522 20 5 FHBDRN CCN(C[C@H]1CCCO1)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000184619043 947914041 /nfs/dbraw/zinc/91/40/41/947914041.db2.gz GVRIMCDJAGQHEG-LLVKDONJSA-N 0 0 361.320 3.646 20 5 FHBDRN CCN(C[C@@H]1CCCO1)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000184619026 947914235 /nfs/dbraw/zinc/91/42/35/947914235.db2.gz GVRIMCDJAGQHEG-NSHDSACASA-N 0 0 361.320 3.646 20 5 FHBDRN COc1ccc(CNC(=O)Nc2ccc3[nH]c(C)cc3c2)cc1[N+](=O)[O-] ZINC000520482955 947968165 /nfs/dbraw/zinc/96/81/65/947968165.db2.gz GWIXBEBCZZKUJG-UHFFFAOYSA-N 0 0 354.366 3.715 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)C2=Cc3cc(F)ccc3OC2)cc1[N+](=O)[O-] ZINC000536393998 947989006 /nfs/dbraw/zinc/98/90/06/947989006.db2.gz FJJOIKNKWDVDHF-LBPRGKRZSA-N 0 0 356.353 3.696 20 5 FHBDRN CCc1nn(C)c(N2CCC(Oc3cc(C)ccc3C)CC2)c1[N+](=O)[O-] ZINC000094149851 948018242 /nfs/dbraw/zinc/01/82/42/948018242.db2.gz JFTCBJJYHHLCKE-UHFFFAOYSA-N 0 0 358.442 3.555 20 5 FHBDRN CCc1nn(C)c(NCc2ccc(OC)c(OC3CCCC3)c2)c1[N+](=O)[O-] ZINC000094155331 948019228 /nfs/dbraw/zinc/01/92/28/948019228.db2.gz WYKHDTWRGDUZBE-UHFFFAOYSA-N 0 0 374.441 3.833 20 5 FHBDRN Cc1ccc([C@H](Cn2ccnc2)NC(=O)c2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000441493536 948022053 /nfs/dbraw/zinc/02/20/53/948022053.db2.gz SZZKDHNNNGIMSK-IBGZPJMESA-N 0 0 364.405 3.579 20 5 FHBDRN CN(C)c1ccc([N+](=O)[O-])cc1C(=O)OCc1cc(-c2ccccc2)no1 ZINC000105408507 948029127 /nfs/dbraw/zinc/02/91/27/948029127.db2.gz SJSGVLNNYTTZLE-UHFFFAOYSA-N 0 0 367.361 3.673 20 5 FHBDRN O=[N+]([O-])c1cccc2c(N3CCO[C@@H](c4cccc(F)c4)C3)ccnc21 ZINC000432324921 948070707 /nfs/dbraw/zinc/07/07/07/948070707.db2.gz YGBHJFBVZXAUMG-GOSISDBHSA-N 0 0 353.353 3.860 20 5 FHBDRN CC(C)(C)OC(=O)C1CCN(c2ccnc3c2cccc3[N+](=O)[O-])CC1 ZINC000432328467 948080006 /nfs/dbraw/zinc/08/00/06/948080006.db2.gz WQMCFSQNCZMGBB-UHFFFAOYSA-N 0 0 357.410 3.701 20 5 FHBDRN COc1cccc(C(=O)N(Cc2ccccc2[N+](=O)[O-])CC(F)(F)F)c1 ZINC000106188937 948088855 /nfs/dbraw/zinc/08/88/55/948088855.db2.gz JSVUTAPDHAYUQM-UHFFFAOYSA-N 0 0 368.311 3.808 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)NCc1ccsc1Br ZINC000511995716 948115289 /nfs/dbraw/zinc/11/52/89/948115289.db2.gz UWXXWMRPPPTOOF-UHFFFAOYSA-N 0 0 369.240 3.668 20 5 FHBDRN Cc1cc(F)cc(C(=O)OCCCCC(=O)OC(C)(C)C)c1[N+](=O)[O-] ZINC000785362835 948121576 /nfs/dbraw/zinc/12/15/76/948121576.db2.gz QBPIYMIBEDBYDE-UHFFFAOYSA-N 0 0 355.362 3.711 20 5 FHBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)Oc1ccccc1C(F)(F)F ZINC000027967654 948125232 /nfs/dbraw/zinc/12/52/32/948125232.db2.gz XMGOOMDXWZXSIX-UHFFFAOYSA-N 0 0 361.297 3.690 20 5 FHBDRN O=C(CCCOc1ccccc1)O[C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000759947174 948131213 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CCc1cc(N(CC)C[C@@H]2CCCO2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000520512413 948194048 /nfs/dbraw/zinc/19/40/48/948194048.db2.gz RVRGASGAOSZZKI-KRWDZBQOSA-N 0 0 356.426 3.620 20 5 FHBDRN CCNc1ccc(C(=O)Oc2ccc3c(c2)OC(=O)C[C@H]3C)cc1[N+](=O)[O-] ZINC000785367204 948202690 /nfs/dbraw/zinc/20/26/90/948202690.db2.gz SRHZVTIWYMWOFS-LLVKDONJSA-N 0 0 370.361 3.658 20 5 FHBDRN CCN(CC)C(=O)c1ccc(C(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)cc1 ZINC000512021248 948209158 /nfs/dbraw/zinc/20/91/58/948209158.db2.gz BNRUNEMMDXHNIA-UHFFFAOYSA-N 0 0 369.421 3.946 20 5 FHBDRN Cc1cn(-c2ccccc2)nc1NC(=O)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000106715565 948225367 /nfs/dbraw/zinc/22/53/67/948225367.db2.gz OIGCYWRTGHUYOS-UHFFFAOYSA-N 0 0 356.769 3.995 20 5 FHBDRN Cc1cccc(C(=O)N2CCN(Cc3ccccc3)C(C)(C)C2)c1[N+](=O)[O-] ZINC000520526655 948226504 /nfs/dbraw/zinc/22/65/04/948226504.db2.gz GKNZDYGMCKTOGB-UHFFFAOYSA-N 0 0 367.449 3.640 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1F)C(=O)NCCc1cccs1 ZINC000585732470 948242372 /nfs/dbraw/zinc/24/23/72/948242372.db2.gz FESNWJBAIJQUBN-JTQLQIEISA-N 0 0 354.428 3.635 20 5 FHBDRN O=C(COc1ccsc1Cl)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000585746612 948252138 /nfs/dbraw/zinc/25/21/38/948252138.db2.gz KGFITQCZDRNMSN-UHFFFAOYSA-N 0 0 366.826 3.880 20 5 FHBDRN Cc1noc(C)c1[C@H](C)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000585750451 948257743 /nfs/dbraw/zinc/25/77/43/948257743.db2.gz ZIVORMVANXMOQB-ZETCQYMHSA-N 0 0 368.187 3.704 20 5 FHBDRN CCOc1ccc(OC)cc1NC(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000520544484 948259165 /nfs/dbraw/zinc/25/91/65/948259165.db2.gz FRSKEUKLGPPMHU-UHFFFAOYSA-N 0 0 362.407 3.733 20 5 FHBDRN Cc1ccncc1NC(=O)c1ccc(N2CCC[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000520546774 948263605 /nfs/dbraw/zinc/26/36/05/948263605.db2.gz ZHECNHNQTXMVMA-ZDUSSCGKSA-N 0 0 354.410 3.787 20 5 FHBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@H]2CCCC[C@H]2c2ccccc2)cc1 ZINC000512039337 948268540 /nfs/dbraw/zinc/26/85/40/948268540.db2.gz WZPYYJCNJODANQ-ROUUACIJSA-N 0 0 360.435 3.600 20 5 FHBDRN O=C(O[C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1)c1cc(Cl)ccc1F ZINC000759955586 948276537 /nfs/dbraw/zinc/27/65/37/948276537.db2.gz YAYSVKSMRJSOFA-KGLIPLIRSA-N 0 0 367.764 3.925 20 5 FHBDRN Cc1ccc(S(=O)(=O)N[C@H](c2ccccc2)C2CCC2)c([N+](=O)[O-])c1 ZINC000520557027 948277917 /nfs/dbraw/zinc/27/79/17/948277917.db2.gz TZCSZHQXJAMTJE-GOSISDBHSA-N 0 0 360.435 3.723 20 5 FHBDRN CN(C(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)C1CCCCCC1 ZINC000520558456 948279700 /nfs/dbraw/zinc/27/97/00/948279700.db2.gz GGMCWWWAQKIWCN-UHFFFAOYSA-N 0 0 358.442 3.983 20 5 FHBDRN CCc1nocc1CN(C)C(=O)c1cc([N+](=O)[O-])ccc1SC(C)C ZINC000512043395 948283198 /nfs/dbraw/zinc/28/31/98/948283198.db2.gz VBRMBWLPKINXTC-UHFFFAOYSA-N 0 0 363.439 3.918 20 5 FHBDRN COCc1nc(C)cc(Nc2cccc(Oc3ccc([N+](=O)[O-])cc3)c2)n1 ZINC000467021452 948289344 /nfs/dbraw/zinc/28/93/44/948289344.db2.gz FAJFIOJQFUFUCC-UHFFFAOYSA-N 0 0 366.377 3.797 20 5 FHBDRN C/C(=C\c1cccnc1)C(=O)N1CCS[C@@H]1c1ccc([N+](=O)[O-])cc1 ZINC001126307943 948304182 /nfs/dbraw/zinc/30/41/82/948304182.db2.gz PRAQPAMZGCIQRS-IYPOZPNPSA-N 0 0 355.419 3.667 20 5 FHBDRN O=C(NCCCCOc1ccc(F)cc1)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000071089113 948304267 /nfs/dbraw/zinc/30/42/67/948304267.db2.gz KJCAMQJVIZIBTG-UHFFFAOYSA-N 0 0 366.776 3.976 20 5 FHBDRN C[C@@H](NC(=O)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1)c1cncc(F)c1 ZINC000454817393 948318544 /nfs/dbraw/zinc/31/85/44/948318544.db2.gz OHLYJUUIONERJG-UKRRQHHQSA-N 0 0 372.400 3.779 20 5 FHBDRN Cc1nc(C)c([C@@H](C)N(C)CC(=O)Nc2c(C)cccc2[N+](=O)[O-])s1 ZINC000106877556 948330981 /nfs/dbraw/zinc/33/09/81/948330981.db2.gz UYWTYZLKGHSECM-GFCCVEGCSA-N 0 0 362.455 3.608 20 5 FHBDRN Cc1cc2sc(NC(=O)c3cc(C)cc([N+](=O)[O-])c3N)nc2c(C)c1 ZINC000729512366 948364730 /nfs/dbraw/zinc/36/47/30/948364730.db2.gz GSTMJDRRLFBNNE-UHFFFAOYSA-N 0 0 356.407 3.964 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)NCc1cc(C)cc2c(C)c(C)[nH]c21 ZINC000427601597 948366328 /nfs/dbraw/zinc/36/63/28/948366328.db2.gz ZOFBOWBCCQASRA-UHFFFAOYSA-N 0 0 367.405 3.940 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@H](Nc2ccccc2)C1 ZINC000184754386 948375460 /nfs/dbraw/zinc/37/54/60/948375460.db2.gz ZJCKNFXHGSBHSF-MJGOQNOKSA-N 0 0 367.449 3.877 20 5 FHBDRN Cc1ccc(/C=C\c2nc(N(C)C)ncc2Br)cc1[N+](=O)[O-] ZINC000549626272 948390640 /nfs/dbraw/zinc/39/06/40/948390640.db2.gz MGBBPBVGGSQWIL-SREVYHEPSA-N 0 0 363.215 3.692 20 5 FHBDRN CCN(c1ccccc1C)S(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc21 ZINC000184770851 948402391 /nfs/dbraw/zinc/40/23/91/948402391.db2.gz MSYHJDMDRBXJOY-UHFFFAOYSA-N 0 0 371.418 3.667 20 5 FHBDRN CC(C)Oc1ccccc1Cc1nc(Cc2ccccc2[N+](=O)[O-])no1 ZINC000574731118 948417594 /nfs/dbraw/zinc/41/75/94/948417594.db2.gz CMKMSBMWAJUQQZ-UHFFFAOYSA-N 0 0 353.378 3.947 20 5 FHBDRN Cc1ccc(Cl)c(OC[C@@H](O)COc2c(F)cccc2[N+](=O)[O-])c1 ZINC000184778983 948418008 /nfs/dbraw/zinc/41/80/08/948418008.db2.gz KRTGLCQZGCFRIG-LLVKDONJSA-N 0 0 355.749 3.514 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)N[C@H]1C[C@H](c2ccc(F)cc2)C1 ZINC000432445292 948435863 /nfs/dbraw/zinc/43/58/63/948435863.db2.gz GSUCFISTOHNUEW-SAABIXHNSA-N 0 0 371.412 3.864 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2cnn(Cc3ncc(Br)s3)c2)c1 ZINC000432454269 948470882 /nfs/dbraw/zinc/47/08/82/948470882.db2.gz FESALCXBYPOLDQ-UHFFFAOYSA-N 0 0 365.212 3.726 20 5 FHBDRN CN(C(=O)[C@@H]1C[C@H]1c1cc(F)c(F)c(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000184788884 948484687 /nfs/dbraw/zinc/48/46/87/948484687.db2.gz ZIKGLKYINGABJF-QWHCGFSZSA-N 0 0 350.296 3.779 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2noc(CN3CCSc4ccccc43)n2)c1 ZINC000025915836 948498552 /nfs/dbraw/zinc/49/85/52/948498552.db2.gz ZGBBQYRBMQIBNH-UHFFFAOYSA-N 0 0 354.391 3.757 20 5 FHBDRN C[C@H](Cc1ccccc1F)NC(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000512131076 948506597 /nfs/dbraw/zinc/50/65/97/948506597.db2.gz NEHLPBWCHGDLQE-CQSZACIVSA-N 0 0 359.401 3.549 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)NCc1ccccc1NCCOC ZINC000574795904 948518522 /nfs/dbraw/zinc/51/85/22/948518522.db2.gz UNHYOSCSKFBSAY-UHFFFAOYSA-N 0 0 372.425 3.537 20 5 FHBDRN CC(C)Oc1cc(O)ccc1NC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000432474175 948526892 /nfs/dbraw/zinc/52/68/92/948526892.db2.gz VZNSTTHQIXITGV-UHFFFAOYSA-N 0 0 355.350 3.821 20 5 FHBDRN C[C@@H]1COCC[C@@H]1NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000432474276 948527803 /nfs/dbraw/zinc/52/78/03/948527803.db2.gz BJECVQJRWREFKF-DYVFJYSZSA-N 0 0 372.446 3.901 20 5 FHBDRN COc1ccc(CSCC(=O)N([C@@H](C)C2CC2)C2CC2)cc1[N+](=O)[O-] ZINC000520664221 948540543 /nfs/dbraw/zinc/54/05/43/948540543.db2.gz LPPRQCADNLRTNP-LBPRGKRZSA-N 0 0 364.467 3.626 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)OCc1cccc(C(F)(F)F)c1 ZINC000019284565 948567949 /nfs/dbraw/zinc/56/79/49/948567949.db2.gz ABCAWCFICYQEFT-UHFFFAOYSA-N 0 0 355.268 3.979 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@](C)(O)CCC(C)C ZINC000120927267 948576360 /nfs/dbraw/zinc/57/63/60/948576360.db2.gz BYTLPYWKBRYORD-KRWDZBQOSA-N 0 0 354.472 3.624 20 5 FHBDRN Cc1cc(C(=O)NCc2ccc(F)cc2C(F)(F)F)c(N)c([N+](=O)[O-])c1 ZINC000729521577 948587359 /nfs/dbraw/zinc/58/73/59/948587359.db2.gz NLSLJKUQSRJDTR-UHFFFAOYSA-N 0 0 371.290 3.573 20 5 FHBDRN Cc1cc(N2CCSCC2)ccc1NC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000050495774 948588851 /nfs/dbraw/zinc/58/88/51/948588851.db2.gz MUPBUTOBSLPWGH-UHFFFAOYSA-N 0 0 357.435 3.709 20 5 FHBDRN Cc1cc(CN(C)c2c([N+](=O)[O-])ncn2C)cc(C)c1OCC(F)(F)F ZINC000054125472 948591319 /nfs/dbraw/zinc/59/13/19/948591319.db2.gz OSUGXVMRROAMCR-UHFFFAOYSA-N 0 0 372.347 3.523 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2cnn(Cc3ncc(Br)s3)c2)cc1 ZINC000432496610 948593707 /nfs/dbraw/zinc/59/37/07/948593707.db2.gz MGYAWXWKWIDRQE-UHFFFAOYSA-N 0 0 365.212 3.726 20 5 FHBDRN Cc1ccc(OCCCCNC(=O)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000087132248 948602204 /nfs/dbraw/zinc/60/22/04/948602204.db2.gz WBSCAALXZAGSRZ-UHFFFAOYSA-N 0 0 356.422 3.811 20 5 FHBDRN COc1ccc(N(C(=O)c2ccc(N)c([N+](=O)[O-])c2)[C@@H](C)C2CC2)cc1 ZINC000163091564 948605770 /nfs/dbraw/zinc/60/57/70/948605770.db2.gz WFCLMBAUELAJKS-LBPRGKRZSA-N 0 0 355.394 3.631 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc(OC[C@@H]2CCCO2)cc1 ZINC000087134548 948607969 /nfs/dbraw/zinc/60/79/69/948607969.db2.gz BMCRKVGVEHLDLB-IBGZPJMESA-N 0 0 370.405 3.724 20 5 FHBDRN COc1ccc(CC[C@H](C)NC(=O)c2c(C)c(F)ccc2[N+](=O)[O-])cc1 ZINC000843776672 948620337 /nfs/dbraw/zinc/62/03/37/948620337.db2.gz UXPWCMNVZZVCDF-LBPRGKRZSA-N 0 0 360.385 3.802 20 5 FHBDRN CCn1nccc1C1CCN(C(=O)c2cc(SC)ccc2[N+](=O)[O-])CC1 ZINC000279219303 948630013 /nfs/dbraw/zinc/63/00/13/948630013.db2.gz LODRFZHLYXLYGW-UHFFFAOYSA-N 0 0 374.466 3.553 20 5 FHBDRN Cn1nc([C@H]2CCCO2)cc1NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000279238179 948656930 /nfs/dbraw/zinc/65/69/30/948656930.db2.gz ZUDUTPYENJVVDO-CYBMUJFWSA-N 0 0 372.406 3.647 20 5 FHBDRN CC(C)c1ccc(C(=O)Nc2cc([C@@H]3CCCOC3)nn2C)cc1[N+](=O)[O-] ZINC000279268271 948679327 /nfs/dbraw/zinc/67/93/27/948679327.db2.gz JELMYTRHJGKCFG-CQSZACIVSA-N 0 0 372.425 3.598 20 5 FHBDRN Cc1cccc(C(C)(C)NC(=O)c2ccc3c(c2[N+](=O)[O-])OCCCO3)c1 ZINC001126323971 948697055 /nfs/dbraw/zinc/69/70/55/948697055.db2.gz OLZRDGSEOFMMHV-UHFFFAOYSA-N 0 0 370.405 3.730 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H]1CCCN(c2ccccc2F)C1 ZINC000536485763 948732428 /nfs/dbraw/zinc/73/24/28/948732428.db2.gz LIDTZMCCAGRBNJ-AWEZNQCLSA-N 0 0 372.400 3.833 20 5 FHBDRN O=[N+]([O-])c1cc(Cn2ccc(-c3ccc(F)cc3)n2)c2c(c1)COCO2 ZINC000523978280 948736801 /nfs/dbraw/zinc/73/68/01/948736801.db2.gz PDDOGKFFQAGGMX-UHFFFAOYSA-N 0 0 355.325 3.512 20 5 FHBDRN C[C@H](NC(=O)NC(C)(C)c1ccccc1[N+](=O)[O-])c1nc2c(s1)CCC2 ZINC000459180127 948736753 /nfs/dbraw/zinc/73/67/53/948736753.db2.gz FJRJGIDULSRVJS-NSHDSACASA-N 0 0 374.466 3.836 20 5 FHBDRN CCc1n[nH]c(C(=O)N[C@@H](c2cccs2)c2ccc(F)cc2)c1[N+](=O)[O-] ZINC000523978418 948736878 /nfs/dbraw/zinc/73/68/78/948736878.db2.gz XUIYWFFUXCVNQZ-CQSZACIVSA-N 0 0 374.397 3.600 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]cc(-c3nc(-c4ccc(-c5nnco5)cc4)no3)c2c1 ZINC000445399068 948766877 /nfs/dbraw/zinc/76/68/77/948766877.db2.gz APCHNKJLJMOWNR-UHFFFAOYSA-N 0 0 374.316 3.843 20 5 FHBDRN CCn1c(C)nc([N+](=O)[O-])c1N1CCCC[C@@H]1c1nc2ccccc2o1 ZINC000571951975 948768917 /nfs/dbraw/zinc/76/89/17/948768917.db2.gz BMNIZARGZDQJKM-CQSZACIVSA-N 0 0 355.398 3.992 20 5 FHBDRN O=[N+]([O-])c1ccc(/C=C/c2nc(-c3ccc(-c4nnco4)cc3)no2)cc1 ZINC000445402045 948769594 /nfs/dbraw/zinc/76/95/94/948769594.db2.gz JLDHXAADKPMXQG-XCVCLJGOSA-N 0 0 361.317 3.865 20 5 FHBDRN CCCN(c1ccc(CC)cc1)S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC001211902488 948780941 /nfs/dbraw/zinc/78/09/41/948780941.db2.gz VEPQKJZDPDFEBY-UHFFFAOYSA-N 0 0 362.451 3.904 20 5 FHBDRN CC(C)CC(C)(C)CNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-] ZINC000571967132 948790665 /nfs/dbraw/zinc/79/06/65/948790665.db2.gz NUZDMAUAQKQINC-UHFFFAOYSA-N 0 0 363.458 3.551 20 5 FHBDRN COc1cc(-c2nc(-c3cnn(-c4ccccc4)c3)no2)ccc1[N+](=O)[O-] ZINC000445433370 948796185 /nfs/dbraw/zinc/79/61/85/948796185.db2.gz BZQWDEXCLLYVIS-UHFFFAOYSA-N 0 0 363.333 3.506 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)Nc1ccc(-c2cncnc2)cc1 ZINC000524007078 948798900 /nfs/dbraw/zinc/79/89/00/948798900.db2.gz WZGWKMHMUGBAHA-UHFFFAOYSA-N 0 0 366.402 3.783 20 5 FHBDRN COC(=O)c1cc(NC(=O)c2cc(SC)ccc2C)cc([N+](=O)[O-])c1 ZINC000524043089 948809055 /nfs/dbraw/zinc/80/90/55/948809055.db2.gz NPRSZHDBKQMBKJ-UHFFFAOYSA-N 0 0 360.391 3.664 20 5 FHBDRN Cc1ccc(C)c(CN(C)S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000428404474 948815971 /nfs/dbraw/zinc/81/59/71/948815971.db2.gz MDCVZIZKPLVIBX-UHFFFAOYSA-N 0 0 368.842 3.686 20 5 FHBDRN O=C(Nc1cnn(Cc2ccccc2)c1)c1cc([N+](=O)[O-])ccc1Cl ZINC000071970306 210230342 /nfs/dbraw/zinc/23/03/42/210230342.db2.gz ISFJQVDZKYMMMR-UHFFFAOYSA-N 0 0 356.769 3.745 20 5 FHBDRN O=[N+]([O-])c1ccc(COc2ncnc3ccc(Br)cc32)cc1 ZINC000079423405 210221343 /nfs/dbraw/zinc/22/13/43/210221343.db2.gz HACQXHWCAABMTF-UHFFFAOYSA-N 0 0 360.167 3.880 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CC[C@@H](O)c3ccccc3C2)cc1OC(F)F ZINC000359898961 210195438 /nfs/dbraw/zinc/19/54/38/210195438.db2.gz LYBMZYHNHUWYNV-OAHLLOKOSA-N 0 0 350.321 3.640 20 5 FHBDRN C[C@@H]1C[C@@H](c2cccnc2)N(CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000359875641 210193546 /nfs/dbraw/zinc/19/35/46/210193546.db2.gz NSYBOFRJRZKDCF-PXAZEXFGSA-N 0 0 374.828 3.665 20 5 FHBDRN Cc1cc(Br)ccc1NC(=O)CNc1ccccc1[N+](=O)[O-] ZINC000008054296 210152320 /nfs/dbraw/zinc/15/23/20/210152320.db2.gz KJLLJJMEYRFLOD-UHFFFAOYSA-N 0 0 364.199 3.716 20 5 FHBDRN Cc1cc(C)c(NC(=O)CN(C)c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c(C)c1 ZINC000008054491 210152106 /nfs/dbraw/zinc/15/21/06/210152106.db2.gz HIWJPZHWDZUXAT-UHFFFAOYSA-N 0 0 372.381 3.503 20 5 FHBDRN Cc1ccc(NC(=O)CS[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000008286278 210096145 /nfs/dbraw/zinc/09/61/45/210096145.db2.gz DFPQECGMRVDYFM-CYBMUJFWSA-N 0 0 373.434 3.602 20 5 FHBDRN CCN(CC)C(=O)c1ccc(NC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)cc1 ZINC000007408413 210094894 /nfs/dbraw/zinc/09/48/94/210094894.db2.gz QBSLZNGVMHESBI-VGOFMYFVSA-N 0 0 367.405 3.729 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)COc1ccc(Cl)c(Cl)c1 ZINC000007483349 210094226 /nfs/dbraw/zinc/09/42/26/210094226.db2.gz IDVKUUQUIQTNLD-UHFFFAOYSA-N 0 0 371.176 3.928 20 5 FHBDRN COc1ccc(OCC(=O)Nc2ccc(C)cc2Cl)c([N+](=O)[O-])c1 ZINC000007035575 210089324 /nfs/dbraw/zinc/08/93/24/210089324.db2.gz GQQUJQSQFNSJMY-UHFFFAOYSA-N 0 0 350.758 3.583 20 5 FHBDRN Cc1nn([C@H](C)C(=O)Nc2ccc(C(F)(F)F)cc2)c(C)c1[N+](=O)[O-] ZINC000005346658 210082579 /nfs/dbraw/zinc/08/25/79/210082579.db2.gz FLJVPRJOIMSJCP-SNVBAGLBSA-N 0 0 356.304 3.627 20 5 FHBDRN CC(C)CNC(=O)CSc1nc2ccccc2c2nc3ccccc3n21 ZINC000004246536 210079753 /nfs/dbraw/zinc/07/97/53/210079753.db2.gz VDYTXKRRIZNHQM-UHFFFAOYSA-N 0 0 364.474 3.900 20 5 FHBDRN O=C1c2cccc([N+](=O)[O-])c2C(=O)N1Cc1ccc(Cl)c(Cl)c1 ZINC000004434065 210079305 /nfs/dbraw/zinc/07/93/05/210079305.db2.gz IIXMSOIZLWSBLP-UHFFFAOYSA-N 0 0 351.145 3.698 20 5 FHBDRN Cc1cccc([C@H]2CCCN2c2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])c1 ZINC000054837366 210067882 /nfs/dbraw/zinc/06/78/82/210067882.db2.gz NFQTVKKANVTHFW-MRXNPFEDSA-N 0 0 360.435 3.648 20 5 FHBDRN O=C(c1ccccc1)C1CCN(C(=O)c2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000014411861 220123588 /nfs/dbraw/zinc/12/35/88/220123588.db2.gz FFTLCURFUBSMPT-UHFFFAOYSA-N 0 0 372.808 3.983 20 5 FHBDRN COc1ccc(Br)c(C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000015408985 220153328 /nfs/dbraw/zinc/15/33/28/220153328.db2.gz ADCFLGYDIUIDLC-UHFFFAOYSA-N 0 0 365.183 3.927 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(NC(=O)[C@@H]2C[C@@H]2C)cc1 ZINC000041776007 211773173 /nfs/dbraw/zinc/77/31/73/211773173.db2.gz DVRFDGWEADWDNF-BLLLJJGKSA-N 0 0 353.378 3.750 20 5 FHBDRN O=[N+]([O-])c1ccccc1COc1cccc(I)c1 ZINC000021724887 211322034 /nfs/dbraw/zinc/32/20/34/211322034.db2.gz LWZYLCNXWKYAGH-UHFFFAOYSA-N 0 0 355.131 3.778 20 5 FHBDRN O=C(Nc1ccc2c(c1)CCC2)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000015922799 211150707 /nfs/dbraw/zinc/15/07/07/211150707.db2.gz OALDJBYJRZNJPP-UHFFFAOYSA-N 0 0 351.406 3.936 20 5 FHBDRN Cc1c(NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)cccc1[N+](=O)[O-] ZINC000015790687 211145471 /nfs/dbraw/zinc/14/54/71/211145471.db2.gz OGYMKYHGMLRUJN-UHFFFAOYSA-N 0 0 356.338 3.638 20 5 FHBDRN Cc1c(C(=O)N2CCN(Cc3ccc(Cl)cc3)CC2)cccc1[N+](=O)[O-] ZINC000015698766 211138085 /nfs/dbraw/zinc/13/80/85/211138085.db2.gz XGKMLHRHVHSHRH-UHFFFAOYSA-N 0 0 373.840 3.515 20 5 FHBDRN CCOC(=O)c1c(C)[nH]c(C(=O)c2cc3cc([N+](=O)[O-])ccc3o2)c1C ZINC000015215929 211126131 /nfs/dbraw/zinc/12/61/31/211126131.db2.gz WLEYVXOTUAHTRF-UHFFFAOYSA-N 0 0 356.334 3.694 20 5 FHBDRN O=C(Nc1nc2ccccc2s1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000014825687 211102547 /nfs/dbraw/zinc/10/25/47/211102547.db2.gz MCQIVLPADHKEDF-UHFFFAOYSA-N 0 0 365.374 3.643 20 5 FHBDRN CCOc1ccc(CCNC(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1OCC ZINC000014510882 211092873 /nfs/dbraw/zinc/09/28/73/211092873.db2.gz PPUXUQCRRZNCSD-UHFFFAOYSA-N 0 0 372.421 3.673 20 5 FHBDRN COCCOc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 ZINC000043591117 220949206 /nfs/dbraw/zinc/94/92/06/220949206.db2.gz LPHKGYLOVIXOCQ-UHFFFAOYSA-N 0 0 350.758 3.526 20 5 FHBDRN C[C@@H](NC(=O)c1ccc(F)cc1Br)c1cccc([N+](=O)[O-])c1 ZINC000048383038 221011917 /nfs/dbraw/zinc/01/19/17/221011917.db2.gz BGYQUBBISGEGBU-SECBINFHSA-N 0 0 367.174 3.987 20 5 FHBDRN Cc1nc(S[C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)oc1C ZINC000055237232 221063643 /nfs/dbraw/zinc/06/36/43/221063643.db2.gz KWUFIGBLZTZNBK-VIFPVBQESA-N 0 0 355.803 3.972 20 5 FHBDRN O=C1[C@H](Sc2nc3ccccc3o2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000067428298 221253370 /nfs/dbraw/zinc/25/33/70/221253370.db2.gz ANFOOOQYSMPFMA-OAHLLOKOSA-N 0 0 355.375 3.634 20 5 FHBDRN COCCOc1ccc(F)cc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000066432506 221245282 /nfs/dbraw/zinc/24/52/82/221245282.db2.gz VGZIMNHQDGOKMB-UHFFFAOYSA-N 0 0 368.748 3.665 20 5 FHBDRN CCCCN(c1ccccc1)S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC ZINC000069901222 221328345 /nfs/dbraw/zinc/32/83/45/221328345.db2.gz LUIACTTWFSUSFV-UHFFFAOYSA-N 0 0 364.423 3.599 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](CC(=O)OC(C)C)c1ccccc1 ZINC000072042910 221399367 /nfs/dbraw/zinc/39/93/67/221399367.db2.gz IFJPQIOBQVBOPX-SFHVURJKSA-N 0 0 370.405 3.716 20 5 FHBDRN Cc1c(Cl)cc(S(=O)(=O)N2C[C@@H](C)c3ccccc32)cc1[N+](=O)[O-] ZINC000071976900 221392560 /nfs/dbraw/zinc/39/25/60/221392560.db2.gz DNOXOGGXMNTEMO-SNVBAGLBSA-N 0 0 366.826 3.869 20 5 FHBDRN O=C(c1ccccc1)c1ccc(N2CCCC[C@@H]2CCO)c([N+](=O)[O-])c1 ZINC000096967109 132305291 /nfs/dbraw/zinc/30/52/91/132305291.db2.gz LTCNBMMANJYFLX-QGZVFWFLSA-N 0 0 354.406 3.567 20 5 FHBDRN CCOc1ccc(NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000008286081 132305485 /nfs/dbraw/zinc/30/54/85/132305485.db2.gz SXIOZGREJFTFLX-UHFFFAOYSA-N 0 0 369.421 3.849 20 5 FHBDRN C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)Nc3nccs3)cc2[N+](=O)[O-])C1 ZINC000025966575 132306928 /nfs/dbraw/zinc/30/69/28/132306928.db2.gz ORIXZZAQUACVSA-TXEJJXNPSA-N 0 0 360.439 3.786 20 5 FHBDRN Cc1c2ccccc2oc1C(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000048305882 136123284 /nfs/dbraw/zinc/12/32/84/136123284.db2.gz IFRCWTQRGADOFO-UHFFFAOYSA-N 0 0 365.389 3.612 20 5 FHBDRN O=[N+]([O-])c1c2cccnc2ccc1N1CCN(Cc2cccs2)CC1 ZINC000051400859 136124204 /nfs/dbraw/zinc/12/42/04/136124204.db2.gz WUJOFCQVLYSEDQ-UHFFFAOYSA-N 0 0 354.435 3.527 20 5 FHBDRN Cc1c(C(=O)Nc2ccccc2N2C[C@H](C)O[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000055681916 136127374 /nfs/dbraw/zinc/12/73/74/136127374.db2.gz WYCOUWJWICLIIW-KBPBESRZSA-N 0 0 369.421 3.769 20 5 FHBDRN O=[N+]([O-])c1ccccc1N1CCN(c2ncc(Cl)cc2Cl)CC1 ZINC000068837951 136130118 /nfs/dbraw/zinc/13/01/18/136130118.db2.gz BINKXNSAFHKAMX-UHFFFAOYSA-N 0 0 353.209 3.623 20 5 FHBDRN C[C@@H](Oc1ccccc1Br)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000098073138 222224914 /nfs/dbraw/zinc/22/49/14/222224914.db2.gz XFCMMPLZKYSDRE-SNVBAGLBSA-N 0 0 365.183 3.763 20 5 FHBDRN COc1ccc2oc(C(=O)N3CCc4ccc([N+](=O)[O-])cc43)c(C)c2c1 ZINC000105429327 222369589 /nfs/dbraw/zinc/36/95/89/222369589.db2.gz JBBPISFSRMOVGJ-UHFFFAOYSA-N 0 0 352.346 3.861 20 5 FHBDRN Cc1ccc(C(=O)Nc2ccc(C(=O)NC(C)(C)C)cc2)cc1[N+](=O)[O-] ZINC000105717536 222374264 /nfs/dbraw/zinc/37/42/64/222374264.db2.gz KJBVJDPRRCPDPP-UHFFFAOYSA-N 0 0 355.394 3.684 20 5 FHBDRN CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)NCc2ccsc2)CC1 ZINC000106295651 222386525 /nfs/dbraw/zinc/38/65/25/222386525.db2.gz YLCURSHNMNNGMB-UHFFFAOYSA-N 0 0 359.451 3.823 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1F)N(Cc1ccco1)Cc1cccnc1 ZINC000128532471 567830849 /nfs/dbraw/zinc/83/08/49/567830849.db2.gz MVYLROGEUPTQDR-UHFFFAOYSA-N 0 0 355.325 3.565 20 5 FHBDRN CCCCn1ncc(C(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)c1C ZINC000452863665 567835071 /nfs/dbraw/zinc/83/50/71/567835071.db2.gz VTACREXLSBRFKM-KRWDZBQOSA-N 0 0 370.453 3.920 20 5 FHBDRN CC(C)Nc1ncccc1C(=O)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452870122 567835831 /nfs/dbraw/zinc/83/58/31/567835831.db2.gz ZKYORRSKCPIRNS-INIZCTEOSA-N 0 0 368.437 3.830 20 5 FHBDRN O=C(CSCC(F)(F)F)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452869143 567839314 /nfs/dbraw/zinc/83/93/14/567839314.db2.gz YWAFNHRVIVEWIK-GFCCVEGCSA-N 0 0 362.373 3.596 20 5 FHBDRN C[C@@H](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)C(=O)c1cccc(F)c1 ZINC000072863361 567840883 /nfs/dbraw/zinc/84/08/83/567840883.db2.gz PASQUNDOTHAIIR-LBPRGKRZSA-N 0 0 356.353 3.532 20 5 FHBDRN COCCC1(C(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)CCCC1 ZINC000452864325 567845235 /nfs/dbraw/zinc/84/52/35/567845235.db2.gz WBNWXXAPAWZKPK-KRWDZBQOSA-N 0 0 360.454 3.898 20 5 FHBDRN COc1cc(CC(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)ccc1C ZINC000452869302 567845381 /nfs/dbraw/zinc/84/53/81/567845381.db2.gz IHAPNPUXVITFOS-GOSISDBHSA-N 0 0 368.433 3.861 20 5 FHBDRN CNC(=O)CNCc1ccc(Oc2cc(C)ccc2C(C)C)c([N+](=O)[O-])c1 ZINC000060842587 567855301 /nfs/dbraw/zinc/85/53/01/567855301.db2.gz AUCMTAXSRWATET-UHFFFAOYSA-N 0 0 371.437 3.655 20 5 FHBDRN COc1ccc(CN(C)Cc2ccc(Br)o2)cc1[N+](=O)[O-] ZINC000051423652 567879136 /nfs/dbraw/zinc/87/91/36/567879136.db2.gz YEKOOPJPZGOUJJ-UHFFFAOYSA-N 0 0 355.188 3.591 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2cnc(C(F)(F)F)cc2C)c1 ZINC000464656888 567886059 /nfs/dbraw/zinc/88/60/59/567886059.db2.gz QHRQRYRTTBNGDB-UHFFFAOYSA-N 0 0 369.299 3.968 20 5 FHBDRN Nc1ccc2c(c1)CC[C@@H]2NC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000568110007 567888296 /nfs/dbraw/zinc/88/82/96/567888296.db2.gz CLTLTQBPVYYQRP-IBGZPJMESA-N 0 0 366.421 3.539 20 5 FHBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCCCc3c(Cl)cccc32)s1 ZINC000541826369 567927463 /nfs/dbraw/zinc/92/74/63/567927463.db2.gz SDVMBPMUPHRUQU-UHFFFAOYSA-N 0 0 372.855 3.841 20 5 FHBDRN Cc1noc(-c2ccccc2)c1NC(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000481439275 567934900 /nfs/dbraw/zinc/93/49/00/567934900.db2.gz BWWAPRPZUCYCST-UHFFFAOYSA-N 0 0 366.377 3.922 20 5 FHBDRN C[C@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])s2)c2ccccc21 ZINC000541826580 567937167 /nfs/dbraw/zinc/93/71/67/567937167.db2.gz ZQXNHUBAXUIYES-NSHDSACASA-N 0 0 352.437 3.749 20 5 FHBDRN Cc1cc(Cl)ccc1O[C@@H](C)C(=O)NCc1cccc([N+](=O)[O-])c1C ZINC000481462450 567953982 /nfs/dbraw/zinc/95/39/82/567953982.db2.gz DGMVCXOQUNIOSA-ZDUSSCGKSA-N 0 0 362.813 3.949 20 5 FHBDRN O=C(c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)N1CC2(CCC2)c2ccccc21 ZINC000481453810 567957316 /nfs/dbraw/zinc/95/73/16/567957316.db2.gz WXIYNRNRKFSUNI-UHFFFAOYSA-N 0 0 374.400 3.863 20 5 FHBDRN Cc1cc(C)cc(OC[C@@H](O)Cn2ccnc2-c2ccc([N+](=O)[O-])cc2)c1 ZINC000051451927 567961439 /nfs/dbraw/zinc/96/14/39/567961439.db2.gz VGUOXCOUFBAROZ-SFHVURJKSA-N 0 0 367.405 3.515 20 5 FHBDRN Cc1nc2cc(F)ccc2cc1C(=O)NCc1cccc([N+](=O)[O-])c1C ZINC000481466559 567965511 /nfs/dbraw/zinc/96/55/11/567965511.db2.gz MZBKUHFZECXUGX-UHFFFAOYSA-N 0 0 353.353 3.829 20 5 FHBDRN Cc1c(CNC(=O)c2cnc3onc(C(C)(C)C)c3c2)cccc1[N+](=O)[O-] ZINC000481469582 567966528 /nfs/dbraw/zinc/96/65/28/567966528.db2.gz VZXJTZROTKRDTR-UHFFFAOYSA-N 0 0 368.393 3.667 20 5 FHBDRN CCOc1c(Cl)cc(-c2nc(CCC(C)(C)[N+](=O)[O-])no2)cc1OC ZINC000291029361 567970049 /nfs/dbraw/zinc/97/00/49/567970049.db2.gz DWIZQJXWIYOPSF-UHFFFAOYSA-N 0 0 369.805 3.785 20 5 FHBDRN Cc1c(CNC(=O)COc2ccccc2C(F)(F)F)cccc1[N+](=O)[O-] ZINC000481481190 567972006 /nfs/dbraw/zinc/97/20/06/567972006.db2.gz OCQAAWGNSLTELX-UHFFFAOYSA-N 0 0 368.311 3.617 20 5 FHBDRN Cc1c(CNC(=O)c2cccc(OCC(F)(F)F)c2)cccc1[N+](=O)[O-] ZINC000481476562 567979584 /nfs/dbraw/zinc/97/95/84/567979584.db2.gz GGPBQBKUXGUZNI-UHFFFAOYSA-N 0 0 368.311 3.774 20 5 FHBDRN Cc1cc(NC(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])nn1C1CCCCC1 ZINC000291046234 567991293 /nfs/dbraw/zinc/99/12/93/567991293.db2.gz GOQWYUDPTYCHTL-UHFFFAOYSA-N 0 0 360.418 3.704 20 5 FHBDRN Cc1c(CNC(=O)Cc2ccc(OCC(C)C)cc2)cccc1[N+](=O)[O-] ZINC000481483211 567991782 /nfs/dbraw/zinc/99/17/82/567991782.db2.gz RFVRRRSKWCYWET-UHFFFAOYSA-N 0 0 356.422 3.797 20 5 FHBDRN Cc1cc(C)c(-c2csc(NC(=O)c3nn(C)cc3[N+](=O)[O-])n2)c(C)c1 ZINC000541858398 568018366 /nfs/dbraw/zinc/01/83/66/568018366.db2.gz KZEPIZPUWZKBNU-UHFFFAOYSA-N 0 0 371.422 3.629 20 5 FHBDRN O=C(Nc1ccc2c(c1)NC(=O)CS2)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000128564177 568020109 /nfs/dbraw/zinc/02/01/09/568020109.db2.gz CFJWJDNEOMGWGG-UHFFFAOYSA-N 0 0 363.782 3.545 20 5 FHBDRN Cc1c(CNc2ccc(S(=O)(=O)C(F)(F)F)cc2)cccc1[N+](=O)[O-] ZINC000302702628 568021355 /nfs/dbraw/zinc/02/13/55/568021355.db2.gz VGILZYFKZQYKGQ-UHFFFAOYSA-N 0 0 374.340 3.809 20 5 FHBDRN CC(C)(CCc1noc(CCCc2ncc(-c3ccccc3)o2)n1)[N+](=O)[O-] ZINC000291091175 568023832 /nfs/dbraw/zinc/02/38/32/568023832.db2.gz PNONBAPQQUDAIT-UHFFFAOYSA-N 0 0 370.409 3.888 20 5 FHBDRN CC(C)(CCc1noc(Cc2ccc(Br)c(F)c2)n1)[N+](=O)[O-] ZINC000291093186 568024117 /nfs/dbraw/zinc/02/41/17/568024117.db2.gz PUHNSBIMJWWDEC-UHFFFAOYSA-N 0 0 372.194 3.550 20 5 FHBDRN C[C@H](C(=O)N1c2ccccc2N(C)CC[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000568348067 568024147 /nfs/dbraw/zinc/02/41/47/568024147.db2.gz PXMWLLWYEUEWFI-CABCVRRESA-N 0 0 353.422 3.960 20 5 FHBDRN O=C(Nc1ccc(NC(=O)C2CC2)cc1)Nc1ccc([N+](=O)[O-])cc1F ZINC000568330775 568024902 /nfs/dbraw/zinc/02/49/02/568024902.db2.gz YGKAYKGYLUXGJW-UHFFFAOYSA-N 0 0 358.329 3.726 20 5 FHBDRN O=C(N[C@H]1CCC[C@H](c2nc3ccccc3[nH]2)C1)c1ccc([N+](=O)[O-])s1 ZINC000568394159 568030420 /nfs/dbraw/zinc/03/04/20/568030420.db2.gz FYLSHQUQWOXSDF-RYUDHWBXSA-N 0 0 370.434 3.989 20 5 FHBDRN Cn1nc([N+](=O)[O-])cc1C(=O)N[C@H](c1ccccc1)c1cccc(Cl)c1 ZINC000481536316 568044266 /nfs/dbraw/zinc/04/42/66/568044266.db2.gz JKURFUHKZDNOSC-QGZVFWFLSA-N 0 0 370.796 3.501 20 5 FHBDRN CCN(C[C@@H]1CCN(c2cc([N+](=O)[O-])ccc2C(C)=O)C1)CC(F)(F)F ZINC000568495664 568044621 /nfs/dbraw/zinc/04/46/21/568044621.db2.gz VAUIDZVSYUZSIC-ZDUSSCGKSA-N 0 0 373.375 3.508 20 5 FHBDRN CCCN(C(=O)c1ccc(SC)c([N+](=O)[O-])c1)[C@@H](CC)C(=O)OCC ZINC000481556566 568046926 /nfs/dbraw/zinc/04/69/26/568046926.db2.gz KQBSBQVZLFMSRF-ZDUSSCGKSA-N 0 0 368.455 3.511 20 5 FHBDRN CC(C)(CCc1noc(COc2ccccc2C(F)(F)F)n1)[N+](=O)[O-] ZINC000291071424 568047726 /nfs/dbraw/zinc/04/77/26/568047726.db2.gz LTEMJEMMHTXCBZ-UHFFFAOYSA-N 0 0 359.304 3.655 20 5 FHBDRN CC(C)(CCc1noc(-c2cccc(Oc3ccncc3)c2)n1)[N+](=O)[O-] ZINC000291107322 568048151 /nfs/dbraw/zinc/04/81/51/568048151.db2.gz SFXLJTKXMFVHAJ-UHFFFAOYSA-N 0 0 354.366 3.912 20 5 FHBDRN C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)N3CCC[C@@H]3CF)cc2[N+](=O)[O-])C1 ZINC000568552315 568050518 /nfs/dbraw/zinc/05/05/18/568050518.db2.gz VSWGQBDZTCWFGA-IIAWOOMASA-N 0 0 363.433 3.651 20 5 FHBDRN Cc1nc(CCc2nc(CCC(C)(C)[N+](=O)[O-])no2)oc1-c1ccccc1 ZINC000291119724 568052394 /nfs/dbraw/zinc/05/23/94/568052394.db2.gz UTBJVQNLMITFJQ-UHFFFAOYSA-N 0 0 370.409 3.806 20 5 FHBDRN COc1ccc(OCc2nnc(-c3ccccc3Cl)o2)c([N+](=O)[O-])c1 ZINC000024730623 568063724 /nfs/dbraw/zinc/06/37/24/568063724.db2.gz WFZNYHZSUWRHCR-UHFFFAOYSA-N 0 0 361.741 3.886 20 5 FHBDRN CCOc1cc(NC(=O)c2cc(OC)c(OCC)cc2[N+](=O)[O-])ccc1C ZINC000066525613 568064624 /nfs/dbraw/zinc/06/46/24/568064624.db2.gz XNSUGNKMBWXRDD-UHFFFAOYSA-N 0 0 374.393 3.962 20 5 FHBDRN COC(=O)c1cc(NC(=O)c2cc([N+](=O)[O-])ccc2C)cc(Cl)c1F ZINC000481608037 568064953 /nfs/dbraw/zinc/06/49/53/568064953.db2.gz LEOHIUYBBWMYBJ-UHFFFAOYSA-N 0 0 366.732 3.735 20 5 FHBDRN Cc1c(NC(=O)[C@H](C)N2CC3(CC3)c3ccccc32)cccc1[N+](=O)[O-] ZINC000481626546 568071392 /nfs/dbraw/zinc/07/13/92/568071392.db2.gz QSYAAOLBEPTHME-AWEZNQCLSA-N 0 0 351.406 3.782 20 5 FHBDRN NC(=O)c1[nH]nc2ccc(Nc3c(Cl)cc([N+](=O)[O-])cc3Cl)cc21 ZINC000128604123 568072721 /nfs/dbraw/zinc/07/27/21/568072721.db2.gz RYVQJVNVCCEZOT-UHFFFAOYSA-N 0 0 366.164 3.620 20 5 FHBDRN Cc1nnc(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)s1 ZINC000541884655 568074343 /nfs/dbraw/zinc/07/43/43/568074343.db2.gz NANDTEGXBBHHLN-UHFFFAOYSA-N 0 0 364.814 3.958 20 5 FHBDRN O=C(NC[C@H]1CCC2(CCCCC2)O1)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000481640025 568075316 /nfs/dbraw/zinc/07/53/16/568075316.db2.gz RDSOCEXKWNTDAP-OAHLLOKOSA-N 0 0 358.394 3.953 20 5 FHBDRN Cc1c2ccccc2oc1[C@H](C)NC(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000481673360 568085295 /nfs/dbraw/zinc/08/52/95/568085295.db2.gz GLGMNPOPUKANHZ-ZDUSSCGKSA-N 0 0 354.362 3.906 20 5 FHBDRN CC(C)(C(=O)Nc1nc2c(s1)CSCC2)c1ccc([N+](=O)[O-])cc1 ZINC000568613181 568087652 /nfs/dbraw/zinc/08/76/52/568087652.db2.gz PSZHTONBCMIHJS-UHFFFAOYSA-N 0 0 363.464 3.757 20 5 FHBDRN Cc1nn(-c2ccccc2)cc1CCCNc1nc(C)ccc1[N+](=O)[O-] ZINC000481707314 568091021 /nfs/dbraw/zinc/09/10/21/568091021.db2.gz ROTMQVTYGQTWSL-UHFFFAOYSA-N 0 0 351.410 3.837 20 5 FHBDRN CC(C)(O)[C@@H]1CCCN1C(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000128627523 568092584 /nfs/dbraw/zinc/09/25/84/568092584.db2.gz IVCPPLKHWDGNNV-SFHVURJKSA-N 0 0 369.421 3.714 20 5 FHBDRN C[C@@H](NC(=O)N[C@@H]1CCOc2ccc(F)cc21)c1cccc([N+](=O)[O-])c1 ZINC000069080982 568093763 /nfs/dbraw/zinc/09/37/63/568093763.db2.gz PYYPFAUDMPYSPM-BDJLRTHQSA-N 0 0 359.357 3.618 20 5 FHBDRN Cn1ccnc1[C@H](N[C@H]1C[C@H]1Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000568660950 568113122 /nfs/dbraw/zinc/11/31/22/568113122.db2.gz ZALFKGOGCOWKCQ-YZGWKJHDSA-N 0 0 362.433 3.639 20 5 FHBDRN CS[C@H](CN[C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1)C(C)(C)C ZINC000568671652 568116899 /nfs/dbraw/zinc/11/68/99/568116899.db2.gz ITDBALRHUQSPBM-CVEARBPZSA-N 0 0 362.499 3.785 20 5 FHBDRN COc1cccc(Cl)c1Cc1nc(-c2ccc([N+](=O)[O-])s2)no1 ZINC000568679563 568120281 /nfs/dbraw/zinc/12/02/81/568120281.db2.gz FQNTUAXORVZFME-UHFFFAOYSA-N 0 0 351.771 3.959 20 5 FHBDRN C[C@@H](Oc1ccccc1NC(=O)c1cc([N+](=O)[O-])nn1C)c1ccccc1 ZINC000481795756 568127400 /nfs/dbraw/zinc/12/74/00/568127400.db2.gz OSLYITLUTVJYFV-CYBMUJFWSA-N 0 0 366.377 3.721 20 5 FHBDRN Cc1cc(Cl)cnc1NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000291377679 568128402 /nfs/dbraw/zinc/12/84/02/568128402.db2.gz AMOXGECRAGICLD-UHFFFAOYSA-N 0 0 360.801 3.804 20 5 FHBDRN CCC[C@H](NC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1CC)c1ccccc1 ZINC000568700900 568129184 /nfs/dbraw/zinc/12/91/84/568129184.db2.gz OOEHIJYPVMVRRW-KRWDZBQOSA-N 0 0 369.421 3.753 20 5 FHBDRN O=[N+]([O-])c1ccc(NCC[C@@H]2COc3ccccc3O2)c2ncccc12 ZINC000481815020 568136509 /nfs/dbraw/zinc/13/65/09/568136509.db2.gz MUPGZHPKVFSYFX-CYBMUJFWSA-N 0 0 351.362 3.785 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)Nc1ccc(OC(C)C)cc1 ZINC000291402325 568136543 /nfs/dbraw/zinc/13/65/43/568136543.db2.gz WNIXVDVBDYIRFG-UHFFFAOYSA-N 0 0 371.393 3.522 20 5 FHBDRN CC(C)(C(=O)NC[C@@H]1CCC2(CCCCC2)O1)c1ccc([N+](=O)[O-])cc1 ZINC000481870198 568138828 /nfs/dbraw/zinc/13/88/28/568138828.db2.gz QESPNNOPMKDVLB-KRWDZBQOSA-N 0 0 360.454 3.871 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2c3ccccc3CC23CCOCC3)c1 ZINC000291420051 568141823 /nfs/dbraw/zinc/14/18/23/568141823.db2.gz KHAUYFAMKIOSJK-IBGZPJMESA-N 0 0 366.417 3.727 20 5 FHBDRN CC(C)(C)c1ccc(-c2nc(NC(=O)c3ccc([N+](=O)[O-])cc3)n[nH]2)cc1 ZINC000008115498 568145589 /nfs/dbraw/zinc/14/55/89/568145589.db2.gz MBXALEFITCUYTQ-UHFFFAOYSA-N 0 0 365.393 3.930 20 5 FHBDRN O=[N+]([O-])c1ccc(NCC[C@@H]2COc3ccccc3O2)c2ccncc21 ZINC000481839446 568146801 /nfs/dbraw/zinc/14/68/01/568146801.db2.gz NBKXHXBRTVIVCQ-CYBMUJFWSA-N 0 0 351.362 3.785 20 5 FHBDRN CCNc1ccc(C(=O)Nc2ncc(-c3cccnc3)s2)cc1[N+](=O)[O-] ZINC000568743163 568150212 /nfs/dbraw/zinc/15/02/12/568150212.db2.gz GXWWXMKSAKNGSY-UHFFFAOYSA-N 0 0 369.406 3.797 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)[N-]c2ccc(C)c3ncccc23)c1C ZINC000481846520 568159380 /nfs/dbraw/zinc/15/93/80/568159380.db2.gz XLPGSZXELFMCRB-UHFFFAOYSA-N 0 0 371.418 3.869 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)NCc2ccnc(OC(C)C)c2)cc1[N+](=O)[O-] ZINC000159348731 568159733 /nfs/dbraw/zinc/15/97/33/568159733.db2.gz KXSYYIMHWQBOSA-AWEZNQCLSA-N 0 0 372.425 3.646 20 5 FHBDRN C[C@]1(CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])OCCc2sccc21 ZINC000291451534 568163210 /nfs/dbraw/zinc/16/32/10/568163210.db2.gz NZNDGNBGQRBPGJ-MRXNPFEDSA-N 0 0 366.826 3.528 20 5 FHBDRN O=[N+]([O-])c1ccc2ccnc(N3CCN(Cc4ccsc4)CC3)c2c1 ZINC000568725956 568164388 /nfs/dbraw/zinc/16/43/88/568164388.db2.gz CKPQAZAFUOXFTQ-UHFFFAOYSA-N 0 0 354.435 3.527 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)NC[C@H]1CCC2(CCCCC2)O1 ZINC000481869383 568165013 /nfs/dbraw/zinc/16/50/13/568165013.db2.gz ORKYXJBIYUFGFG-OAHLLOKOSA-N 0 0 366.845 3.789 20 5 FHBDRN CCc1ccc(CC)c(C(=O)COc2ccc([N+](=O)[O-])c(C(=O)OC)c2)c1 ZINC000481901187 568173966 /nfs/dbraw/zinc/17/39/66/568173966.db2.gz QBLIKRQDQIBLKR-UHFFFAOYSA-N 0 0 371.389 3.768 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N1CCN(Cc2ccccc2Cl)CC1 ZINC000481904753 568180312 /nfs/dbraw/zinc/18/03/12/568180312.db2.gz MXNAMJPHBHSHAA-UHFFFAOYSA-N 0 0 373.840 3.515 20 5 FHBDRN Cc1ccc(CNC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])cc1F ZINC000481920450 568187632 /nfs/dbraw/zinc/18/76/32/568187632.db2.gz JELFVAXBUVCFSG-UHFFFAOYSA-N 0 0 365.792 3.738 20 5 FHBDRN CC(C)CCOc1ccc(S(=O)(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000603969813 568191764 /nfs/dbraw/zinc/19/17/64/568191764.db2.gz SSGLNFZOJKVKMD-UHFFFAOYSA-N 0 0 364.423 3.821 20 5 FHBDRN Cc1cc(NC[C@@H](c2ccco2)[NH+]2CCCCC2)cc(C(=O)[O-])c1[N+](=O)[O-] ZINC000568766962 568193152 /nfs/dbraw/zinc/19/31/52/568193152.db2.gz IQIMNYZSXJDGGG-INIZCTEOSA-N 0 0 373.409 3.834 20 5 FHBDRN COC(=O)c1cc(OCC(=O)c2cc(C)c(C)c(C)c2C)ccc1[N+](=O)[O-] ZINC000481945685 568195220 /nfs/dbraw/zinc/19/52/20/568195220.db2.gz SMCZDVIYPZJYFM-UHFFFAOYSA-N 0 0 371.389 3.877 20 5 FHBDRN CS[C@H]1CCC[C@H](Nc2ccc([N+](=O)[O-])c(N3CCOCC3)c2F)C1 ZINC000568768233 568195973 /nfs/dbraw/zinc/19/59/73/568195973.db2.gz JZARSXAPBLBKIC-STQMWFEESA-N 0 0 369.462 3.657 20 5 FHBDRN O=C(N[C@H](c1ccccc1)C(F)F)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000481959466 568196913 /nfs/dbraw/zinc/19/69/13/568196913.db2.gz GTTKYBOEPSADIH-MRXNPFEDSA-N 0 0 372.331 3.517 20 5 FHBDRN CCOCc1cccc(NS(=O)(=O)c2c(C)cc([N+](=O)[O-])cc2C)c1 ZINC000481969671 568201880 /nfs/dbraw/zinc/20/18/80/568201880.db2.gz GRAUBJUFVJBBOE-UHFFFAOYSA-N 0 0 364.423 3.549 20 5 FHBDRN Cn1cccc1C(=O)COc1ccc(Cc2ccccc2)cc1[N+](=O)[O-] ZINC000481969914 568202086 /nfs/dbraw/zinc/20/20/86/568202086.db2.gz YGEYAMJJRODACF-UHFFFAOYSA-N 0 0 350.374 3.786 20 5 FHBDRN Cc1occc1-c1nnc(S[C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])o1 ZINC000007195189 568210309 /nfs/dbraw/zinc/21/03/09/568210309.db2.gz IVYXENDNDMMJEE-SNVBAGLBSA-N 0 0 374.378 3.666 20 5 FHBDRN COc1ccc(NC(=O)c2ccc(F)cc2Br)cc1[N+](=O)[O-] ZINC000389108977 568210859 /nfs/dbraw/zinc/21/08/59/568210859.db2.gz SSBVOCBPKVVKOU-UHFFFAOYSA-N 0 0 369.146 3.757 20 5 FHBDRN COC(=O)c1cc(OCc2ccc(C(F)(F)F)cc2)ccc1[N+](=O)[O-] ZINC000481986434 568215734 /nfs/dbraw/zinc/21/57/34/568215734.db2.gz GDKQMGFDNTXFQI-UHFFFAOYSA-N 0 0 355.268 3.979 20 5 FHBDRN COC(=O)c1cc(OCc2ccccc2OC(F)F)ccc1[N+](=O)[O-] ZINC000481988066 568215792 /nfs/dbraw/zinc/21/57/92/568215792.db2.gz ZHWANUPNMOVJAR-UHFFFAOYSA-N 0 0 353.277 3.562 20 5 FHBDRN CCOCCC1(CNc2ncc(Br)cc2[N+](=O)[O-])CCC1 ZINC000481989419 568215880 /nfs/dbraw/zinc/21/58/80/568215880.db2.gz BKTQXVQFJUTVCA-UHFFFAOYSA-N 0 0 358.236 3.761 20 5 FHBDRN O=C(c1cccc2ccc(=O)[nH]c21)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000568795543 568221993 /nfs/dbraw/zinc/22/19/93/568221993.db2.gz TVKWKQVGKBNRGW-UHFFFAOYSA-N 0 0 363.373 3.653 20 5 FHBDRN O=C(CCc1nc(C2CCCC2)no1)Nc1cccc([N+](=O)[O-])c1Cl ZINC000291623082 568230580 /nfs/dbraw/zinc/23/05/80/568230580.db2.gz ANYKUFOQTIZDSP-UHFFFAOYSA-N 0 0 364.789 3.860 20 5 FHBDRN COCCOc1ccc(F)cc1NC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000568818713 568231007 /nfs/dbraw/zinc/23/10/07/568231007.db2.gz HPKHLUUKDVEJSX-LBPRGKRZSA-N 0 0 362.357 3.501 20 5 FHBDRN CC(C)(O)CCNC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000482024591 568231975 /nfs/dbraw/zinc/23/19/75/568231975.db2.gz GBCSVGRYIZYHMG-UHFFFAOYSA-N 0 0 360.435 3.637 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)Nc1ccccc1OCC(F)F ZINC000120382982 568241160 /nfs/dbraw/zinc/24/11/60/568241160.db2.gz LMRSHNPBNHQDGQ-UHFFFAOYSA-N 0 0 365.336 3.603 20 5 FHBDRN Cc1onc(-c2ccccn2)c1C(=O)Nc1cccc([N+](=O)[O-])c1Cl ZINC000366024781 568244381 /nfs/dbraw/zinc/24/43/81/568244381.db2.gz UOYGRTJWNXQIJF-UHFFFAOYSA-N 0 0 358.741 3.859 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])cc2c1OCCO2)N1CCCc2cccc(Cl)c21 ZINC000517921570 568245592 /nfs/dbraw/zinc/24/55/92/568245592.db2.gz OTYLUUXTIGYXCV-UHFFFAOYSA-N 0 0 374.780 3.612 20 5 FHBDRN Cc1noc([C@@H](C)NCc2ccc(N(C)c3ccccc3)c([N+](=O)[O-])c2)n1 ZINC000568895616 568246184 /nfs/dbraw/zinc/24/61/84/568246184.db2.gz KGRZNNXOOOYTLB-CYBMUJFWSA-N 0 0 367.409 3.905 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(N[C@@H](C)c2noc(Cc3ccccc3)n2)n1 ZINC000541933749 568247633 /nfs/dbraw/zinc/24/76/33/568247633.db2.gz SNSXCFSHGIKICZ-ZDUSSCGKSA-N 0 0 353.382 3.754 20 5 FHBDRN CC(=O)c1ccc(OCCCC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 ZINC000015410987 568251538 /nfs/dbraw/zinc/25/15/38/568251538.db2.gz SYIFOSWNDQWYPJ-UHFFFAOYSA-N 0 0 356.378 3.904 20 5 FHBDRN CCO[C@@H](C)c1nc(CN(C)c2nc(C)cc(C)c2[N+](=O)[O-])cs1 ZINC000541932926 568252362 /nfs/dbraw/zinc/25/23/62/568252362.db2.gz GMEXODFDYMRECT-LBPRGKRZSA-N 0 0 350.444 3.797 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(Cc2noc(-c3ccccc3OC3CC3)n2)c1 ZINC000568914277 568254252 /nfs/dbraw/zinc/25/42/52/568254252.db2.gz DLRWZEQQHJXZAA-UHFFFAOYSA-N 0 0 367.361 3.785 20 5 FHBDRN CC(C)C[C@@H]1C[C@@H](NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)CCO1 ZINC000541938524 568257390 /nfs/dbraw/zinc/25/73/90/568257390.db2.gz FQFZVPBVWPHDDN-QWHCGFSZSA-N 0 0 372.368 3.520 20 5 FHBDRN O=C(N[C@@H]1CCCOc2c(F)cccc21)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000482084142 568257746 /nfs/dbraw/zinc/25/77/46/568257746.db2.gz NXOZPZAFYIZGTI-CQSZACIVSA-N 0 0 369.352 3.859 20 5 FHBDRN CCN(CC)C(=O)c1ccc(CNc2nc(C)cc(C)c2[N+](=O)[O-])cc1 ZINC000541935063 568258340 /nfs/dbraw/zinc/25/83/40/568258340.db2.gz BQFOXYHKCVKBLO-UHFFFAOYSA-N 0 0 356.426 3.701 20 5 FHBDRN COc1ccc([C@H]2CCCN2c2nc(C)cc(C)c2[N+](=O)[O-])c(OC)c1 ZINC000541935294 568258413 /nfs/dbraw/zinc/25/84/13/568258413.db2.gz LWLMIJSXMNMXRJ-MRXNPFEDSA-N 0 0 357.410 3.965 20 5 FHBDRN Cc1ccc(C[C@H]2CCCN2C(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)cc1 ZINC000568970049 568258652 /nfs/dbraw/zinc/25/86/52/568258652.db2.gz AWMSYBMNRXGKRI-OAHLLOKOSA-N 0 0 374.387 3.958 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(N[C@H](CO)c2ccc(Br)cc2)n1 ZINC000541935738 568258698 /nfs/dbraw/zinc/25/86/98/568258698.db2.gz FIQDZQQGEBQZTH-CYBMUJFWSA-N 0 0 366.215 3.515 20 5 FHBDRN CCS[C@H](C)c1noc(CN(C)c2ccc([N+](=O)[O-])c3cnccc32)n1 ZINC000482094850 568263907 /nfs/dbraw/zinc/26/39/07/568263907.db2.gz NUQQBTMQVRZLPE-LLVKDONJSA-N 0 0 373.438 3.977 20 5 FHBDRN CCN(C(=O)c1cc(SC)ccc1[N+](=O)[O-])[C@H]1CCOC(C)(C)C1 ZINC000291718567 568268518 /nfs/dbraw/zinc/26/85/18/568268518.db2.gz VWSCLBXWWHWQQD-LBPRGKRZSA-N 0 0 352.456 3.736 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H](C)Oc1cccc(OC)c1 ZINC000584690290 568268972 /nfs/dbraw/zinc/26/89/72/568268972.db2.gz DRAIWEKEIVARIV-ZDUSSCGKSA-N 0 0 373.409 3.755 20 5 FHBDRN CCOC(=O)C1CCC(CC(=O)N[C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000569104229 568277255 /nfs/dbraw/zinc/27/72/55/568277255.db2.gz AHLACLRWVHFKTI-NFOMZHRRSA-N 0 0 362.426 3.532 20 5 FHBDRN O=[N+]([O-])c1ccc(CNc2ncc(C3CCOCC3)s2)c(Cl)c1 ZINC000453055310 568277610 /nfs/dbraw/zinc/27/76/10/568277610.db2.gz VUASEFQNQMNBIT-UHFFFAOYSA-N 0 0 353.831 3.633 20 5 FHBDRN Cn1c(-c2ccc([N+](=O)[O-])cc2)nnc1N(Cc1cccs1)C1CC1 ZINC000569039486 568278088 /nfs/dbraw/zinc/27/80/88/568278088.db2.gz YJORPEOHRIULCK-UHFFFAOYSA-N 0 0 355.423 3.621 20 5 FHBDRN CCN(Cc1ccc(Cl)s1)S(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1 ZINC000008168112 568278237 /nfs/dbraw/zinc/27/82/37/568278237.db2.gz MHJUJYKJTIVRFZ-UHFFFAOYSA-N 0 0 374.871 3.829 20 5 FHBDRN Cc1cccc2[nH]cc(CCNC(=O)Cc3cccc([N+](=O)[O-])c3C)c21 ZINC000120397363 568279027 /nfs/dbraw/zinc/27/90/27/568279027.db2.gz HNAGRAXYTJZJJH-UHFFFAOYSA-N 0 0 351.406 3.594 20 5 FHBDRN O=C(NCc1ccco1)c1ccccc1NCc1cccc([N+](=O)[O-])c1 ZINC000072950520 568281268 /nfs/dbraw/zinc/28/12/68/568281268.db2.gz XWZPUJBAUYGKBL-UHFFFAOYSA-N 0 0 351.362 3.730 20 5 FHBDRN O=C(Nc1nc(-c2ccccc2F)co1)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000482150481 568285650 /nfs/dbraw/zinc/28/56/50/568285650.db2.gz YDQNROWHBPDJGR-UHFFFAOYSA-N 0 0 367.296 3.518 20 5 FHBDRN COc1ccc2c(c1)[C@@H](c1nc(Cc3ccccc3[N+](=O)[O-])no1)CC2 ZINC000584685695 568287136 /nfs/dbraw/zinc/28/71/36/568287136.db2.gz LSLQQUFIMJSMCO-HNNXBMFYSA-N 0 0 351.362 3.655 20 5 FHBDRN O=C(c1cc2c(c([N+](=O)[O-])c1)OCO2)N(Cc1ccc(F)cc1)CC1CC1 ZINC000181966668 568289284 /nfs/dbraw/zinc/28/92/84/568289284.db2.gz JNQFWLHCPOEHHC-UHFFFAOYSA-N 0 0 372.352 3.515 20 5 FHBDRN CNS(=O)(=O)c1ccc(Sc2ccc3ccccc3c2)c([N+](=O)[O-])c1 ZINC000008063779 568290512 /nfs/dbraw/zinc/29/05/12/568290512.db2.gz UDEJYMFSTKBEPR-UHFFFAOYSA-N 0 0 374.443 3.807 20 5 FHBDRN O=C(NC[C@@H]1CCN(c2ccc(Cl)cc2)C1)c1csc([N+](=O)[O-])c1 ZINC000604466460 568297165 /nfs/dbraw/zinc/29/71/65/568297165.db2.gz LKWMJQJKXZKMKW-NSHDSACASA-N 0 0 365.842 3.566 20 5 FHBDRN CCN(C(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)c1ccccc1F ZINC000604469772 568297757 /nfs/dbraw/zinc/29/77/57/568297757.db2.gz SILIPELTXQIVSA-UHFFFAOYSA-N 0 0 354.341 3.586 20 5 FHBDRN CNc1ccc(C(=O)N(C)Cc2ccc(C(F)(F)F)cc2)cc1[N+](=O)[O-] ZINC000008307749 568298536 /nfs/dbraw/zinc/29/85/36/568298536.db2.gz GIKJSGXJIANGND-UHFFFAOYSA-N 0 0 367.327 3.928 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)[C@@H]2CCN(c3ccccc3F)C2)cc1[N+](=O)[O-] ZINC000569160814 568300835 /nfs/dbraw/zinc/30/08/35/568300835.db2.gz ZQOAXMMBKHKFGC-GDBMZVCRSA-N 0 0 371.412 3.746 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCCO[C@@H]1CC(C)C ZINC000482181730 568302361 /nfs/dbraw/zinc/30/23/61/568302361.db2.gz OBSNORBQXWXBBF-BHIYHBOVSA-N 0 0 362.470 3.873 20 5 FHBDRN O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)Nc1nc2c(cccc2Cl)[nH]1 ZINC000569221033 568314125 /nfs/dbraw/zinc/31/41/25/568314125.db2.gz DQOUCAKBMOVPRD-UHFFFAOYSA-N 0 0 366.711 3.584 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCCC[C@H]1C(F)(F)F ZINC000482213680 568317338 /nfs/dbraw/zinc/31/73/38/568317338.db2.gz MHUVFUJQNUBDDI-ZWNOBZJWSA-N 0 0 360.332 3.702 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1N[C@H]1CCN([C@@H](C)c2ccc(F)cc2)C1=O ZINC000453065405 568318483 /nfs/dbraw/zinc/31/84/83/568318483.db2.gz UVYPAMSOJDHOER-GUYCJALGSA-N 0 0 357.385 3.816 20 5 FHBDRN Cc1c(C(=O)Nc2ccc(NC(=O)NC(C)C)cc2)cccc1[N+](=O)[O-] ZINC000031002438 568324696 /nfs/dbraw/zinc/32/46/96/568324696.db2.gz DKXYKIONOWAGGT-UHFFFAOYSA-N 0 0 356.382 3.685 20 5 FHBDRN Cc1ccc(NC(=O)CCCc2nc(-c3cccs3)no2)cc1[N+](=O)[O-] ZINC000031701951 568335987 /nfs/dbraw/zinc/33/59/87/568335987.db2.gz LCYQEEIACZYYBS-UHFFFAOYSA-N 0 0 372.406 3.976 20 5 FHBDRN Cc1ccc(C(=O)Nc2cc(C(=O)N(C)C)ccc2Cl)cc1[N+](=O)[O-] ZINC000031734413 568336921 /nfs/dbraw/zinc/33/69/21/568336921.db2.gz VISZTAXKPISQRM-UHFFFAOYSA-N 0 0 361.785 3.511 20 5 FHBDRN Cc1c(C(=O)Nc2ccc(Cl)cc2C)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000031873085 568342537 /nfs/dbraw/zinc/34/25/37/568342537.db2.gz ZCFOGWOFGNKPNS-UHFFFAOYSA-N 0 0 371.784 3.698 20 5 FHBDRN O=[N+]([O-])c1cc(F)ccc1N1CCC[C@@H](c2nc(C(F)(F)F)c[nH]2)C1 ZINC000584699383 568349163 /nfs/dbraw/zinc/34/91/63/568349163.db2.gz VNXOVSUUCOYMNG-SECBINFHSA-N 0 0 358.295 3.860 20 5 FHBDRN O=C(Nc1cccc2cnncc21)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000617149144 568368533 /nfs/dbraw/zinc/36/85/33/568368533.db2.gz DRIJFFDQNQGSEE-UHFFFAOYSA-N 0 0 373.166 3.553 20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])NC[C@H]1CCCC[C@H]1C(F)(F)F ZINC000482226171 568370275 /nfs/dbraw/zinc/37/02/75/568370275.db2.gz WISMNHPREJNARX-CHWSQXEVSA-N 0 0 373.375 3.882 20 5 FHBDRN C[C@]1(F)CCCN(c2nc(N3CCC[C@](C)(F)C3)c([N+](=O)[O-])s2)C1 ZINC000569315500 568375954 /nfs/dbraw/zinc/37/59/54/568375954.db2.gz QJJJQSHTIWESKF-GJZGRUSLSA-N 0 0 360.430 3.708 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1NC(=O)CSc1nnc(-c2ccccc2)o1 ZINC000006054526 568397432 /nfs/dbraw/zinc/39/74/32/568397432.db2.gz FCJBDCMBZOIMLI-UHFFFAOYSA-N 0 0 370.390 3.684 20 5 FHBDRN COc1cc(C)c(NC(=O)CCNc2ccccc2[N+](=O)[O-])c(C)c1C ZINC000569395264 568400492 /nfs/dbraw/zinc/40/04/92/568400492.db2.gz NLOSSCZLAGVMHQ-UHFFFAOYSA-N 0 0 357.410 3.969 20 5 FHBDRN COc1cc2c(cc1Cl)CN(C(=O)c1ccc([N+](=O)[O-])cc1F)CC2 ZINC000569403370 568400757 /nfs/dbraw/zinc/40/07/57/568400757.db2.gz BZJUEXJWPRAJRB-UHFFFAOYSA-N 0 0 364.760 3.594 20 5 FHBDRN C[C@@H](CCCC(F)(F)F)NC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000569544788 568403861 /nfs/dbraw/zinc/40/38/61/568403861.db2.gz CWJCGXLYJKPWPO-NSHDSACASA-N 0 0 359.348 3.784 20 5 FHBDRN Cc1cc(NC(=O)[C@H](C)c2cccc([N+](=O)[O-])c2)n(-c2ccccc2F)n1 ZINC000569537265 568406593 /nfs/dbraw/zinc/40/65/93/568406593.db2.gz CIRFICDZHVORPV-CYBMUJFWSA-N 0 0 368.368 3.970 20 5 FHBDRN C[C@@H](Nc1ccc(C(=O)N2CCC[C@@H](F)C2)cc1[N+](=O)[O-])c1ccccn1 ZINC000569586384 568408664 /nfs/dbraw/zinc/40/86/64/568408664.db2.gz NMYILHOYLKKONJ-UKRRQHHQSA-N 0 0 372.400 3.737 20 5 FHBDRN CN(C(=O)CNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C1CCCCC1 ZINC000569692306 568411847 /nfs/dbraw/zinc/41/18/47/568411847.db2.gz ZEZZLTHKQOOVNK-UHFFFAOYSA-N 0 0 359.348 3.817 20 5 FHBDRN C[C@@H]1CCCN(c2ccc(C(=O)N(C)c3nccs3)cc2[N+](=O)[O-])C1 ZINC000041842011 568411874 /nfs/dbraw/zinc/41/18/74/568411874.db2.gz RDJCUDTUQKPMRZ-GFCCVEGCSA-N 0 0 360.439 3.564 20 5 FHBDRN CC[C@H](NS(=O)(=O)c1cc([N+](=O)[O-])ccc1C)c1cc(F)ccc1F ZINC000569747964 568429359 /nfs/dbraw/zinc/42/93/59/568429359.db2.gz JORQGRUMWKRNCE-HNNXBMFYSA-N 0 0 370.377 3.611 20 5 FHBDRN CCCN(c1nccc(C(N)=O)c1[N+](=O)[O-])[C@@H](C)c1cc2ccccc2o1 ZINC000569866171 568431873 /nfs/dbraw/zinc/43/18/73/568431873.db2.gz GMAMNEFYXNFRKZ-LBPRGKRZSA-N 0 0 368.393 3.813 20 5 FHBDRN CC(C)OCc1nc([C@H](C)NCc2ccc(C(C)C)c([N+](=O)[O-])c2)no1 ZINC000569866639 568432015 /nfs/dbraw/zinc/43/20/15/568432015.db2.gz OFJNMVIPKYZIGS-ZDUSSCGKSA-N 0 0 362.430 3.877 20 5 FHBDRN CSC[C@H]1CCCN(C(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000569935147 568434090 /nfs/dbraw/zinc/43/40/90/568434090.db2.gz HQBRWHPNGZERLK-NEPJUHHUSA-N 0 0 372.874 3.617 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2noc(-c3cnc(-c4cccnc4)s3)n2)s1 ZINC000569912811 568435808 /nfs/dbraw/zinc/43/58/08/568435808.db2.gz URCFNYYVWMCWFS-UHFFFAOYSA-N 0 0 357.376 3.892 20 5 FHBDRN CCc1noc(C)c1-c1noc(-c2ccc(N3CCCC3)c([N+](=O)[O-])c2)n1 ZINC000569913220 568435928 /nfs/dbraw/zinc/43/59/28/568435928.db2.gz KXIDRJBOWKJBMG-UHFFFAOYSA-N 0 0 369.381 3.771 20 5 FHBDRN O=[N+]([O-])c1cnc2ccccc2c1NCc1ccc(O)c(Br)c1 ZINC000436713049 568440453 /nfs/dbraw/zinc/44/04/53/568440453.db2.gz DFYBSXWCZOKUDV-UHFFFAOYSA-N 0 0 374.194 3.645 20 5 FHBDRN COC(=O)c1cc([N+](=O)[O-])c(C)cc1NC1CCC(c2nc(C)no2)CC1 ZINC000570031114 568442058 /nfs/dbraw/zinc/44/20/58/568442058.db2.gz CDGBTNHDRKIOCL-UHFFFAOYSA-N 0 0 374.397 3.520 20 5 FHBDRN CC[C@H](C)N(CCO)c1ccc(C(=O)Nc2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000569959907 568444472 /nfs/dbraw/zinc/44/44/72/568444472.db2.gz ZCJIYBJPBNNILU-HNNXBMFYSA-N 0 0 371.437 3.753 20 5 FHBDRN O=[N+]([O-])c1ccc(CSc2nnc([C@@H]3COc4ccccc4O3)o2)cc1 ZINC000007088896 568444726 /nfs/dbraw/zinc/44/47/26/568444726.db2.gz HHVBZQYDXRYKQF-HNNXBMFYSA-N 0 0 371.374 3.783 20 5 FHBDRN O=C(NC(C1CCC1)C1CCC1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000569996531 568447903 /nfs/dbraw/zinc/44/79/03/568447903.db2.gz VQUKMRQBAUJRNO-UHFFFAOYSA-N 0 0 354.353 3.895 20 5 FHBDRN C[C@@H](C(=O)NC1(c2ccccc2)CCOCC1)c1cccc([N+](=O)[O-])c1 ZINC000569998495 568448156 /nfs/dbraw/zinc/44/81/56/568448156.db2.gz IEWGGOAOWDKJFI-OAHLLOKOSA-N 0 0 354.406 3.520 20 5 FHBDRN C[C@@H]1C[C@H](C(C)(C)C)CCN1C(=O)c1cc([N+](=O)[O-])cc2c1OCCO2 ZINC000570126156 568453002 /nfs/dbraw/zinc/45/30/02/568453002.db2.gz FWRZIDPDTBPMEL-CHWSQXEVSA-N 0 0 362.426 3.653 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)NCc1ccc(OC(C)C)nc1 ZINC000570131656 568453125 /nfs/dbraw/zinc/45/31/25/568453125.db2.gz HICVGCFUDQNVHE-UHFFFAOYSA-N 0 0 358.398 3.661 20 5 FHBDRN C[C@H]1CCC[C@@H](N(C)C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C1 ZINC000033099172 568455114 /nfs/dbraw/zinc/45/51/14/568455114.db2.gz GMSLWJSQUSPHQS-DOTOQJQBSA-N 0 0 359.470 3.848 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)c1cc(Br)cs1 ZINC000570267127 568458790 /nfs/dbraw/zinc/45/87/90/568458790.db2.gz FZVMHWYFQWCVJR-UHFFFAOYSA-N 0 0 369.240 3.734 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@@H](c3ccccc3C)C2)c1 ZINC000570178463 568459418 /nfs/dbraw/zinc/45/94/18/568459418.db2.gz GMPWTCNKYDQHLM-OAHLLOKOSA-N 0 0 354.406 3.932 20 5 FHBDRN CC(C)(c1noc(-c2cc([N+](=O)[O-])cc3c2OCCO3)n1)c1ccccc1 ZINC000570192116 568460279 /nfs/dbraw/zinc/46/02/79/568460279.db2.gz JWHJJACYKYASRG-UHFFFAOYSA-N 0 0 367.361 3.742 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1CN1CCC[C@@H](CC(=O)OC(C)(C)C)C1 ZINC000570232000 568463913 /nfs/dbraw/zinc/46/39/13/568463913.db2.gz MDAIHBSBLXAWFP-AWEZNQCLSA-N 0 0 364.442 3.547 20 5 FHBDRN Cc1c(Cl)cc(S(=O)(=O)N2CCCc3ccccc32)cc1[N+](=O)[O-] ZINC000007416882 568505470 /nfs/dbraw/zinc/50/54/70/568505470.db2.gz FVZPUTIHRGIEIZ-UHFFFAOYSA-N 0 0 366.826 3.698 20 5 FHBDRN CCN(CCc1cccs1)S(=O)(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC000493059323 568514131 /nfs/dbraw/zinc/51/41/31/568514131.db2.gz UNZRLFIBHBTGOS-UHFFFAOYSA-N 0 0 368.480 3.526 20 5 FHBDRN CCC[C@@H](NCc1nccn1CC(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000482245176 568522662 /nfs/dbraw/zinc/52/26/62/568522662.db2.gz ZOFDUPIKJHIXIZ-CQSZACIVSA-N 0 0 356.348 3.985 20 5 FHBDRN O=C(CN1CCSc2ccccc21)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000007493351 568522695 /nfs/dbraw/zinc/52/26/95/568522695.db2.gz PEDLKYUWGXXMPW-UHFFFAOYSA-N 0 0 363.826 3.799 20 5 FHBDRN C[C@@H](NC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1)[C@@H](C)c1ccccc1 ZINC000482250117 568528362 /nfs/dbraw/zinc/52/83/62/568528362.db2.gz XYPPJLKAVOQUIX-HUUCEWRRSA-N 0 0 364.405 3.703 20 5 FHBDRN CCS[C@@H]1CCC[C@@H](NC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)C1 ZINC000482247875 568533074 /nfs/dbraw/zinc/53/30/74/568533074.db2.gz VUKXVUMZBDXVHI-GDBMZVCRSA-N 0 0 361.467 3.730 20 5 FHBDRN CCS[C@H]1CCC[C@@H](NC(=O)CCCNc2ccc([N+](=O)[O-])cc2)C1 ZINC000482248548 568533204 /nfs/dbraw/zinc/53/32/04/568533204.db2.gz WRDRFCQBJHIZCQ-WBVHZDCISA-N 0 0 365.499 3.967 20 5 FHBDRN Cc1cc(Cl)c(C(=O)N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1C ZINC000182028295 568559135 /nfs/dbraw/zinc/55/91/35/568559135.db2.gz TUYRDSIFNZKPRO-ZDUSSCGKSA-N 0 0 374.828 3.587 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1OC(F)F)N1CC2(CCC2)[C@@H]1C1CC1 ZINC000291843889 568578317 /nfs/dbraw/zinc/57/83/17/568578317.db2.gz FBVKKLNEYPNUHF-AWEZNQCLSA-N 0 0 352.337 3.601 20 5 FHBDRN Cc1ccc(NC(=O)[C@@H]2CCC(=O)N(C)[C@H]2c2cccs2)cc1[N+](=O)[O-] ZINC000365411857 568639107 /nfs/dbraw/zinc/63/91/07/568639107.db2.gz KRPPHIOEXGHEEH-CXAGYDPISA-N 0 0 373.434 3.513 20 5 FHBDRN Cc1ccc(NC(=O)[C@H]2CCC(=O)N(C)[C@@H]2c2cccs2)cc1[N+](=O)[O-] ZINC000365411859 568639268 /nfs/dbraw/zinc/63/92/68/568639268.db2.gz KRPPHIOEXGHEEH-GUYCJALGSA-N 0 0 373.434 3.513 20 5 FHBDRN C[C@@H](C(=O)N(Cc1ncc[nH]1)c1cccc(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000570904505 568639503 /nfs/dbraw/zinc/63/95/03/568639503.db2.gz GFHTWARRDNLRHS-CYBMUJFWSA-N 0 0 368.368 3.794 20 5 FHBDRN C[C@H]1C[C@H](c2cccc(F)c2)N(c2ccc([N+](=O)[O-])cc2-c2nn[nH]n2)C1 ZINC000820668310 599059623 /nfs/dbraw/zinc/05/96/23/599059623.db2.gz RNDDRPHLWKVWNV-APPDUMDISA-N 0 0 368.372 3.502 20 5 FHBDRN C[C@H]1C[C@@H](c2cccc(F)c2)N(c2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])C1 ZINC000820669222 599060293 /nfs/dbraw/zinc/06/02/93/599060293.db2.gz ZXPMPUPJRUJVGI-ZBEGNZNMSA-N 0 0 368.372 3.502 20 5 FHBDRN C[C@@H]1C[C@@H](c2ccccc2F)N(c2ccc([N+](=O)[O-])cc2-c2nn[nH]n2)C1 ZINC000820667142 599077176 /nfs/dbraw/zinc/07/71/76/599077176.db2.gz LGBLCYJNCMBEDS-DIFFPNOSSA-N 0 0 368.372 3.502 20 5 FHBDRN COc1ccc(C=Cc2ccc3cccc([N+](=O)[O-])c3n2)cc1-c1nn[nH]n1 ZINC000737080444 599153195 /nfs/dbraw/zinc/15/31/95/599153195.db2.gz ARAYYMAGSGNXCG-YVMONPNESA-N 0 0 374.360 3.502 20 5 FHBDRN COc1ccc(C=Cc2ccc3cccc([N+](=O)[O-])c3n2)cc1-c1nn[nH]n1 ZINC000737080443 599153419 /nfs/dbraw/zinc/15/34/19/599153419.db2.gz ARAYYMAGSGNXCG-VMPITWQZSA-N 0 0 374.360 3.502 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)ccc1CSc1ccc(-c2nn[nH]n2)cc1F ZINC000738360646 599174688 /nfs/dbraw/zinc/17/46/88/599174688.db2.gz RQBGGXGUMSJYOU-UHFFFAOYSA-N 0 0 365.777 3.860 20 5 FHBDRN O=[N+]([O-])c1ccc(NCC2(Sc3ccccc3)CC2)c(-c2nn[nH]n2)c1 ZINC000738369637 598594704 /nfs/dbraw/zinc/59/47/04/598594704.db2.gz KWWUWFCMFFNXPX-UHFFFAOYSA-N 0 0 368.422 3.512 20 5 FHBDRN O=[N+]([O-])c1ccc(N[C@H]2CCSc3ccc(F)cc32)c(-c2nn[nH]n2)c1 ZINC000823639824 599322135 /nfs/dbraw/zinc/32/21/35/599322135.db2.gz HYRDTPQIYAPXDS-AWEZNQCLSA-N 0 0 372.385 3.563 20 5 FHBDRN O=C([O-])[C@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)c1ccccc1C(F)(F)F ZINC000739500060 599792059 /nfs/dbraw/zinc/79/20/59/599792059.db2.gz NOORMQISKQPRRW-CQSZACIVSA-N 0 0 354.284 3.529 20 5 FHBDRN O=C([O-])C[N@H+](Cc1ccc(Cl)cc1)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000739796671 600216296 /nfs/dbraw/zinc/21/62/96/600216296.db2.gz HOWMAAMJDSELMC-UHFFFAOYSA-N 0 0 369.204 3.988 20 5 FHBDRN O=[N+]([O-])c1cccc2nc(C=Cc3ccc(-c4nn[nH]n4)cc3F)ccc21 ZINC000823647980 607457488 /nfs/dbraw/zinc/45/74/88/607457488.db2.gz RGQFPHIGLKZBIN-SREVYHEPSA-N 0 0 362.324 3.633 20 5 FHBDRN O=[N+]([O-])c1ccc2sc(C=Cc3ccc(-c4nn[nH]n4)cc3F)nc2c1 ZINC000823646036 607457727 /nfs/dbraw/zinc/45/77/27/607457727.db2.gz ZGFGYKPDCVUHLI-ZZXKWVIFSA-N 0 0 368.353 3.694 20 5 FHBDRN O=C([O-])[C@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1ccc(Cl)cc1Cl ZINC000833164612 600742153 /nfs/dbraw/zinc/74/21/53/600742153.db2.gz BWHQGWNGISWUKD-OAHLLOKOSA-N 0 0 369.204 3.860 20 5 FHBDRN C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCN(c2ccc(C(=O)[O-])cc2)C[C@@H]1C ZINC000828495056 600821799 /nfs/dbraw/zinc/82/17/99/600821799.db2.gz UWQQRBMTCRVCSJ-LSDHHAIUSA-N 0 0 369.421 3.565 20 5 FHBDRN C[NH+](C)[C@H](CNc1cc(Cl)c(C(=O)[O-])cc1[N+](=O)[O-])c1cccs1 ZINC000737357746 600942176 /nfs/dbraw/zinc/94/21/76/600942176.db2.gz DDEZDJDZEXJPON-CYBMUJFWSA-N 0 0 369.830 3.723 20 5 FHBDRN Cc1ccc([C@H](C)[NH2+]Cc2cc(C)c(OCC(=O)[O-])c(C)c2)cc1[N+](=O)[O-] ZINC000832920787 601267749 /nfs/dbraw/zinc/26/77/49/601267749.db2.gz GWNVZRWXUVJQCH-HNNXBMFYSA-N 0 0 372.421 3.834 20 5 FHBDRN C[C@H](Oc1ccc(C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1)C(=O)[O-] ZINC000833537059 604535252 /nfs/dbraw/zinc/53/52/52/604535252.db2.gz HAIWRJMDZDNMFB-AWEZNQCLSA-N 0 0 370.405 3.611 20 5 FHBDRN CCOc1ccc([C@@H](C)[NH2+]CCc2ccc(NC(=O)[O-])cc2)cc1[N+](=O)[O-] ZINC000833664139 605002744 /nfs/dbraw/zinc/00/27/44/605002744.db2.gz PEDIBKNSCBGFKW-CYBMUJFWSA-N 0 0 373.409 3.977 20 5 FHBDRN C[C@H](Nc1ccc(/C=C/C(=O)[O-])cc1[N+](=O)[O-])[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000833526994 605863588 /nfs/dbraw/zinc/86/35/88/605863588.db2.gz XJVJCTCVPRVGQX-YBZQBRCDSA-N 0 0 373.453 3.758 20 5 FHBDRN O=[N+]([O-])c1ccc2oc(C(Cl)=Cc3ccc(-c4nn[nH]n4)cc3)nc2c1 ZINC000823643801 606339677 /nfs/dbraw/zinc/33/96/77/606339677.db2.gz BKRHYGNJBPNYMZ-KPKJPENVSA-N 0 0 368.740 3.653 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCCC[C@H]2c2ccc(F)cc2)c(-c2nn[nH]n2)c1 ZINC000823639914 606477818 /nfs/dbraw/zinc/47/78/18/606477818.db2.gz LTJHQPYYAPDTNW-INIZCTEOSA-N 0 0 368.372 3.646 20 5 FHBDRN CCCC[C@@H](CC)C(=O)Nc1cc(-c2nn[nH]n2)cc([N+](=O)[O-])c1Cl ZINC000825260172 608161072 /nfs/dbraw/zinc/16/10/72/608161072.db2.gz NNLAOVCZZHYYAV-SECBINFHSA-N 0 0 366.809 3.583 20 5 FHBDRN Cc1ccc([C@@H](C)N[C@H](C)c2ccc(-c3nn[nH]n3)cc2F)cc1[N+](=O)[O-] ZINC000826283223 609342733 /nfs/dbraw/zinc/34/27/33/609342733.db2.gz MZIBYNMEWSTVMP-VXGBXAGGSA-N 0 0 370.388 3.634 20 5 FHBDRN Cc1ccc([C@@H](C)N[C@@H](C)c2ccc(-c3nn[nH]n3)cc2F)cc1[N+](=O)[O-] ZINC000826283220 609342794 /nfs/dbraw/zinc/34/27/94/609342794.db2.gz MZIBYNMEWSTVMP-NEPJUHHUSA-N 0 0 370.388 3.634 20 5 FHBDRN COc1cc(CS[C@H](C)c2ccc(-c3nn[nH]n3)cc2)ccc1[N+](=O)[O-] ZINC000826180184 609440171 /nfs/dbraw/zinc/44/01/71/609440171.db2.gz VWWDKWNAPQXUBA-LLVKDONJSA-N 0 0 371.422 3.778 20 5 FHBDRN O=C(N[C@H]1CCOC2(CCC2)C1)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000582949612 936321227 /nfs/dbraw/zinc/32/12/27/936321227.db2.gz DOETYJPWORLKNG-SJORKVTESA-N 0 0 373.453 3.586 20 5 FHBDRN CSc1ccc(-c2nc(Cc3ccc4c(c3)CCO4)no2)cc1[N+](=O)[O-] ZINC000612911947 936335925 /nfs/dbraw/zinc/33/59/25/936335925.db2.gz JVXCOPMSGOPUTN-UHFFFAOYSA-N 0 0 369.402 3.892 20 5 FHBDRN Cc1ccc([C@@H]2COCCN2C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)o1 ZINC000162056832 936341679 /nfs/dbraw/zinc/34/16/79/936341679.db2.gz FPIMSVJWZPTNHC-HNNXBMFYSA-N 0 0 359.382 3.718 20 5 FHBDRN COCc1ccc([C@H]2CCCN2C(=O)c2cc([N+](=O)[O-])cc(C)c2F)o1 ZINC000278001264 936343903 /nfs/dbraw/zinc/34/39/03/936343903.db2.gz DJGMFOHSIUKUPS-OAHLLOKOSA-N 0 0 362.357 3.759 20 5 FHBDRN Cc1cc(NC(=O)N2CCC([C@@H](O)c3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000153641208 936349828 /nfs/dbraw/zinc/34/98/28/936349828.db2.gz NCWIIYKQXNVNAB-IBGZPJMESA-N 0 0 369.421 3.881 20 5 FHBDRN COc1ccc2c(c1)CN(C(=O)c1cc([N+](=O)[O-])ccc1SC)CC2 ZINC001125643296 936372998 /nfs/dbraw/zinc/37/29/98/936372998.db2.gz QENKOHRESRQBLG-UHFFFAOYSA-N 0 0 358.419 3.524 20 5 FHBDRN COc1cccc(C(C)(C)CNC(=O)N(C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000178745551 936380181 /nfs/dbraw/zinc/38/01/81/936380181.db2.gz JSBDEKUMNWCGFW-UHFFFAOYSA-N 0 0 371.437 3.723 20 5 FHBDRN CNc1c(C(=O)N2CCc3sc(Cl)cc3C2)cccc1[N+](=O)[O-] ZINC000583026464 936376872 /nfs/dbraw/zinc/37/68/72/936376872.db2.gz CGCRZYICFSRFES-UHFFFAOYSA-N 0 0 351.815 3.550 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(N(C)C(C)=O)cc1 ZINC000613179802 936378947 /nfs/dbraw/zinc/37/89/47/936378947.db2.gz BZHZBYGGTCQZOE-MRXNPFEDSA-N 0 0 369.421 3.785 20 5 FHBDRN O=[N+]([O-])c1ccc([C@H](NC[C@@H](CO)c2ccccc2)C(F)(F)F)cc1 ZINC000583029542 936381051 /nfs/dbraw/zinc/38/10/51/936381051.db2.gz UMZLXIZQRZUGRN-HOCLYGCPSA-N 0 0 354.328 3.564 20 5 FHBDRN COc1cccc(N2CC[C@H](CNc3ncc(Cl)cc3[N+](=O)[O-])C2)c1 ZINC000153679059 936381197 /nfs/dbraw/zinc/38/11/97/936381197.db2.gz PMGMWFIXAZQTBR-GFCCVEGCSA-N 0 0 362.817 3.590 20 5 FHBDRN COC(=O)c1cc(Br)cc(Nc2ccc(C)c([N+](=O)[O-])c2)n1 ZINC001213665657 936383607 /nfs/dbraw/zinc/38/36/07/936383607.db2.gz DSRLQBNVVUUCLB-UHFFFAOYSA-N 0 0 366.171 3.591 20 5 FHBDRN CCC[C@@H]1C[C@H](c2nc(Cc3cc(OC)ccc3[N+](=O)[O-])no2)CCO1 ZINC000278035017 936386846 /nfs/dbraw/zinc/38/68/46/936386846.db2.gz ZWBSMBKFDRKRDA-IUODEOHRSA-N 0 0 361.398 3.640 20 5 FHBDRN CCO[C@@H](CC(=O)Nc1ccnn1-c1ccc([N+](=O)[O-])cc1)C1=CCCC1 ZINC000075083922 936387670 /nfs/dbraw/zinc/38/76/70/936387670.db2.gz KTYNEXLWJOVFDP-KRWDZBQOSA-N 0 0 370.409 3.625 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H]1CCc2c1cccc2OC ZINC000439885575 945064788 /nfs/dbraw/zinc/06/47/88/945064788.db2.gz ZVYJDZMEMIXOSB-HNNXBMFYSA-N 0 0 371.393 3.811 20 5 FHBDRN O=C(NCCOc1ccc([N+](=O)[O-])cc1)Nc1cccc(F)c1Cl ZINC000548784854 937079312 /nfs/dbraw/zinc/07/93/12/937079312.db2.gz RSYPIOQJEJLXGQ-UHFFFAOYSA-N 0 0 353.737 3.588 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)cnc1N1CCC([C@@H](O)c2ccc(F)cc2)CC1 ZINC000153741766 937084276 /nfs/dbraw/zinc/08/42/76/937084276.db2.gz DXRRPZJHOLLZJJ-INIZCTEOSA-N 0 0 365.792 3.732 20 5 FHBDRN C[C@H](Cc1ccc(Cl)cc1)C(=O)NCCNc1ccc([N+](=O)[O-])cc1 ZINC000535921412 937092748 /nfs/dbraw/zinc/09/27/48/937092748.db2.gz DCIYGAWCBWAIBE-CYBMUJFWSA-N 0 0 361.829 3.655 20 5 FHBDRN C[C@@H](Cc1ccc(Cl)cc1)C(=O)NCCNc1ccc([N+](=O)[O-])cc1 ZINC000535921425 937092807 /nfs/dbraw/zinc/09/28/07/937092807.db2.gz DCIYGAWCBWAIBE-ZDUSSCGKSA-N 0 0 361.829 3.655 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2noc(CN3CC[C@@](F)(c4ccccc4)C3)n2)c1 ZINC000583096556 937116582 /nfs/dbraw/zinc/11/65/82/937116582.db2.gz MVLLMSAUIJFNOD-IBGZPJMESA-N 0 0 368.368 3.716 20 5 FHBDRN O=C(Nc1cnn(C2CCC2)c1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000889058788 937119479 /nfs/dbraw/zinc/11/94/79/937119479.db2.gz XGLYQXMRVURTPE-UHFFFAOYSA-N 0 0 354.288 3.787 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N(C)CC(=O)Nc1c(C)cccc1C ZINC000162463184 937122829 /nfs/dbraw/zinc/12/28/29/937122829.db2.gz ICVAKFURCQJRKN-UHFFFAOYSA-N 0 0 370.409 3.622 20 5 FHBDRN CCS[C@H](C)c1noc(CN(C)[C@H](C)c2cccc([N+](=O)[O-])c2)n1 ZINC000247960571 937124485 /nfs/dbraw/zinc/12/44/85/937124485.db2.gz GEHPUARQBIYJCZ-VXGBXAGGSA-N 0 0 350.444 3.985 20 5 FHBDRN Cc1cc(C(=O)Nc2cccc(Br)c2C)c(N)c([N+](=O)[O-])c1 ZINC000176390180 937124631 /nfs/dbraw/zinc/12/46/31/937124631.db2.gz LFYZAWNKEQQXFL-UHFFFAOYSA-N 0 0 364.199 3.809 20 5 FHBDRN CCS[C@@H](C)c1noc(CN(C)[C@H](C)c2cccc([N+](=O)[O-])c2)n1 ZINC000247960569 937124665 /nfs/dbraw/zinc/12/46/65/937124665.db2.gz GEHPUARQBIYJCZ-NEPJUHHUSA-N 0 0 350.444 3.985 20 5 FHBDRN Cc1ccc(C(=O)NC[C@@H](c2ccccc2Cl)N(C)C)cc1[N+](=O)[O-] ZINC000049409413 927034207 /nfs/dbraw/zinc/03/42/07/927034207.db2.gz DKCYIGRWQFQPEU-KRWDZBQOSA-N 0 0 361.829 3.589 20 5 FHBDRN O=C(c1ccc(Oc2ncnc3sc([N+](=O)[O-])cc32)cc1)N1CCCC1 ZINC000557561228 927050238 /nfs/dbraw/zinc/05/02/38/927050238.db2.gz IGPTYQBDSUCAMB-UHFFFAOYSA-N 0 0 370.390 3.628 20 5 FHBDRN CS(=O)(=O)c1ccc(N[C@@H]2CCC[C@H](C(F)(F)F)C2)c([N+](=O)[O-])c1 ZINC000023357200 927057435 /nfs/dbraw/zinc/05/74/35/927057435.db2.gz CODNNUJNVBNGKJ-VHSXEESVSA-N 0 0 366.361 3.531 20 5 FHBDRN Cc1ccc(C(=O)N(C)C)cc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000044571998 927067820 /nfs/dbraw/zinc/06/78/20/927067820.db2.gz VWBPPXMZSYTPSZ-UHFFFAOYSA-N 0 0 361.785 3.511 20 5 FHBDRN Cc1c([N+](=O)[O-])cc(C(=O)Nc2cc(Cl)ccc2F)cc1[N+](=O)[O-] ZINC000070731625 927125665 /nfs/dbraw/zinc/12/56/65/927125665.db2.gz DCHITQJHHUUHDK-UHFFFAOYSA-N 0 0 353.693 3.856 20 5 FHBDRN CCS[C@H]1CCCC[C@H]1NC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000175267510 927146109 /nfs/dbraw/zinc/14/61/09/927146109.db2.gz VABDGMKYRCIRJS-WBVHZDCISA-N 0 0 374.466 3.575 20 5 FHBDRN COc1cc(C(=O)N2CCCc3c(C)ccc(F)c32)cc([N+](=O)[O-])c1OC ZINC000610174958 927172484 /nfs/dbraw/zinc/17/24/84/927172484.db2.gz OTEVNWOGSVLNIT-UHFFFAOYSA-N 0 0 374.368 3.653 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N1CC[C@H](c2cccc(C)c2)C1 ZINC000471105887 927173946 /nfs/dbraw/zinc/17/39/46/927173946.db2.gz YUOLKKADNMBRHB-INIZCTEOSA-N 0 0 354.406 3.932 20 5 FHBDRN CCN(C(=O)c1cc(OC)c(OC)c([N+](=O)[O-])c1)[C@@H]1CCCC[C@@H]1C ZINC000610174694 927177791 /nfs/dbraw/zinc/17/77/91/927177791.db2.gz XMCKIRHBMAYTQC-GXTWGEPZSA-N 0 0 350.415 3.653 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)Nc1cc(CC)nc2ccccc21 ZINC000471107585 927187426 /nfs/dbraw/zinc/18/74/26/927187426.db2.gz RDUZTFSEAMUPTO-UHFFFAOYSA-N 0 0 365.389 3.778 20 5 FHBDRN COc1cc(C(=O)Nc2ccc(CSC)cc2)cc([N+](=O)[O-])c1OC ZINC000610174495 927193709 /nfs/dbraw/zinc/19/37/09/927193709.db2.gz QJBMTUXKCXBLSM-UHFFFAOYSA-N 0 0 362.407 3.727 20 5 FHBDRN COc1cccc(COCCNC(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)c1 ZINC000120095688 927199271 /nfs/dbraw/zinc/19/92/71/927199271.db2.gz AQOOOUZHPSXTBY-UHFFFAOYSA-N 0 0 373.409 3.559 20 5 FHBDRN C[C@@H](C1CC1)n1cc(Nc2ncc([N+](=O)[O-])cc2Br)cn1 ZINC000302376198 927310830 /nfs/dbraw/zinc/31/08/30/927310830.db2.gz FXTPKGFJOVYMFN-QMMMGPOBSA-N 0 0 352.192 3.663 20 5 FHBDRN COCCN(CCCc1ccccc1)C(=O)c1c(C)c(C)ccc1[N+](=O)[O-] ZINC001125647588 937151429 /nfs/dbraw/zinc/15/14/29/937151429.db2.gz KZSKLIVSASYVAE-UHFFFAOYSA-N 0 0 370.449 3.933 20 5 FHBDRN O=C(N[C@@H]1CCCN(c2ccccc2Cl)C1)c1ccc([N+](=O)[O-])cc1 ZINC000610178481 927322784 /nfs/dbraw/zinc/32/27/84/927322784.db2.gz CHHQVIPUKXVUEX-CQSZACIVSA-N 0 0 359.813 3.647 20 5 FHBDRN COc1cc(Cl)c(NC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)cc1C ZINC000579760649 927323104 /nfs/dbraw/zinc/32/31/04/927323104.db2.gz RQFZJVXBZJYVPN-UHFFFAOYSA-N 0 0 364.741 3.546 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])c(Cl)c1)N1CCO[C@H](CCc2ccccc2)C1 ZINC000120124222 927335902 /nfs/dbraw/zinc/33/59/02/927335902.db2.gz RDXZRUMYXUSVFG-MRXNPFEDSA-N 0 0 374.824 3.722 20 5 FHBDRN CCC[C@H](NC(=O)COc1ccc([N+](=O)[O-])c(F)c1)C1CCCCC1 ZINC000728185370 927361448 /nfs/dbraw/zinc/36/14/48/927361448.db2.gz NPMCJAYAKNZWSC-INIZCTEOSA-N 0 0 352.406 3.978 20 5 FHBDRN Cc1nn(C(C)C)cc1C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000577646541 927369008 /nfs/dbraw/zinc/36/90/08/927369008.db2.gz NVRCIADGAZOOTE-UHFFFAOYSA-N 0 0 367.203 3.695 20 5 FHBDRN COc1ccccc1[C@@]1(C)C[C@H]1NC(=O)c1cc(SC)ccc1[N+](=O)[O-] ZINC000610181623 927400447 /nfs/dbraw/zinc/40/04/47/927400447.db2.gz FEHJHTCEHNFMLV-IEBWSBKVSA-N 0 0 372.446 3.785 20 5 FHBDRN CSc1cccc(C(=O)N[C@H](C)[C@@H]2COc3ccccc32)c1[N+](=O)[O-] ZINC000186890807 927468995 /nfs/dbraw/zinc/46/89/95/927468995.db2.gz LACVIWXMXGSMJT-RISCZKNCSA-N 0 0 358.419 3.611 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1cc(Br)ccc1O ZINC000176434834 937166450 /nfs/dbraw/zinc/16/64/50/937166450.db2.gz DLUICWAYUMHAKN-UHFFFAOYSA-N 0 0 351.156 3.624 20 5 FHBDRN O=C(c1c[nH]c2ccc([N+](=O)[O-])cc21)N1CCC(OCC2CCCC2)CC1 ZINC000176442625 937170137 /nfs/dbraw/zinc/17/01/37/937170137.db2.gz NJKQOMLEZDPBSQ-UHFFFAOYSA-N 0 0 371.437 3.888 20 5 FHBDRN COC(CCCC(C)(C)CNC(=O)c1cc([N+](=O)[O-])ccc1Cl)OC ZINC000274700331 927544236 /nfs/dbraw/zinc/54/42/36/927544236.db2.gz PXLSABGSFOYWKS-UHFFFAOYSA-N 0 0 372.849 3.793 20 5 FHBDRN CC(C)(C)c1ccc(OCCNC(=O)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000022655055 927559626 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FHBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1Cc2ccccc2C[C@@H]1C ZINC000610189197 927776707 /nfs/dbraw/zinc/77/67/07/927776707.db2.gz WYMVSIHCFHMQSR-QWHCGFSZSA-N 0 0 374.824 3.989 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1CN1CCN([C@@H](C)c2ccsc2)CC1 ZINC000430193544 927780838 /nfs/dbraw/zinc/78/08/38/927780838.db2.gz GPNAZDDJGPFVRX-AWEZNQCLSA-N 0 0 361.467 3.544 20 5 FHBDRN CCOC[C@H]1CCN(C(=O)c2cccc3c(=O)c4ccccc4[nH]c23)C1 ZINC000278110029 937195887 /nfs/dbraw/zinc/19/58/87/937195887.db2.gz KLRSMRGGJNCWBA-AWEZNQCLSA-N 0 0 350.418 3.592 20 5 FHBDRN CSc1cccc(C(=O)Nc2cc(C3CCCC3)nn2C)c1[N+](=O)[O-] ZINC000186995383 927823324 /nfs/dbraw/zinc/82/33/24/927823324.db2.gz JDTNBDPGRUJVCZ-UHFFFAOYSA-N 0 0 360.439 3.960 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCc1nc(-c2ccccc2)c[nH]1 ZINC000120233688 927832466 /nfs/dbraw/zinc/83/24/66/927832466.db2.gz QCILZYAFZLXSKC-UHFFFAOYSA-N 0 0 365.393 3.923 20 5 FHBDRN COc1cc(OC)c(NC(=O)c2cc(F)cc(C)c2[N+](=O)[O-])cc1Cl ZINC000175728515 927850549 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CC(C)c1ccccc1NC(=O)[C@H](C)OC(=O)c1ccccc1[N+](=O)[O-] ZINC000023443905 928624834 /nfs/dbraw/zinc/62/48/34/928624834.db2.gz WCPWVVQIWBQEDA-ZDUSSCGKSA-N 0 0 356.378 3.902 20 5 FHBDRN Cn1ccc2c1cccc2NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000608867555 928658705 /nfs/dbraw/zinc/65/87/05/928658705.db2.gz BXDBBCMXDKEADF-UHFFFAOYSA-N 0 0 364.405 3.939 20 5 FHBDRN COC[C@@H](CC(C)(C)C)NC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000655305180 928659184 /nfs/dbraw/zinc/65/91/84/928659184.db2.gz NLMZPQFPGAADEU-OAHLLOKOSA-N 0 0 366.461 3.862 20 5 FHBDRN CC(C)Cc1ccc(C(=O)C2CCN(c3c([N+](=O)[O-])ncn3C)CC2)cc1 ZINC000052209997 937267638 /nfs/dbraw/zinc/26/76/38/937267638.db2.gz VQONBVLMQSRZEQ-UHFFFAOYSA-N 0 0 370.453 3.626 20 5 FHBDRN O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)N1CC2CC1(c1ccccc1)C2 ZINC000598555668 928716056 /nfs/dbraw/zinc/71/60/56/928716056.db2.gz PKPGYKAZXHLARP-UHFFFAOYSA-N 0 0 358.344 3.563 20 5 FHBDRN Cn1c(C(=O)N2CCC(F)(c3cccc(Cl)c3)CC2)ccc1[N+](=O)[O-] ZINC000466898710 928747315 /nfs/dbraw/zinc/74/73/15/928747315.db2.gz ALUPGZPVUYGWKO-UHFFFAOYSA-N 0 0 365.792 3.688 20 5 FHBDRN O=C(CCCc1ccccn1)N1CCS[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000610235008 928796685 /nfs/dbraw/zinc/79/66/85/928796685.db2.gz CAGXPOQYTKYXOH-SFHVURJKSA-N 0 0 357.435 3.587 20 5 FHBDRN CCOc1cc(CNC(=O)c2c(C)c(C)ccc2[N+](=O)[O-])ccc1OC ZINC000888985829 937275894 /nfs/dbraw/zinc/27/58/94/937275894.db2.gz KYYRCRHZKDPYEO-UHFFFAOYSA-N 0 0 358.394 3.549 20 5 FHBDRN Cc1sc(S(=O)(=O)N(C)[C@@H](C)c2cc(C)ccc2C)cc1[N+](=O)[O-] ZINC000467060624 928812107 /nfs/dbraw/zinc/81/21/07/928812107.db2.gz YXSZVEKUVJNGJH-LBPRGKRZSA-N 0 0 368.480 3.963 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H](C)c1noc(-c2ccccc2)n1 ZINC000134427531 928896320 /nfs/dbraw/zinc/89/63/20/928896320.db2.gz RZJLCFPDAPRUMP-GFCCVEGCSA-N 0 0 367.365 3.836 20 5 FHBDRN CC(=O)Nc1ccc(C)cc1NC(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000609022861 928952705 /nfs/dbraw/zinc/95/27/05/928952705.db2.gz QGPRATBTESZCNC-UHFFFAOYSA-N 0 0 353.334 3.860 20 5 FHBDRN O=C(NC1CCC(F)(F)CC1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000535612977 928957364 /nfs/dbraw/zinc/95/73/64/928957364.db2.gz PAJUTWDAYYQDMR-UHFFFAOYSA-N 0 0 363.158 3.665 20 5 FHBDRN CCC[C@H](Cc1ccccc1)NC(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000609033731 928957694 /nfs/dbraw/zinc/95/76/94/928957694.db2.gz DFUNXZDASSMLLX-QGZVFWFLSA-N 0 0 355.438 3.924 20 5 FHBDRN CCN(C(=O)c1c([N+](=O)[O-])cnn1C)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000164956942 928966087 /nfs/dbraw/zinc/96/60/87/928966087.db2.gz OMAXMAQKTRXGSG-JTQLQIEISA-N 0 0 370.331 3.570 20 5 FHBDRN O=C(c1ccc(F)cc1[N+](=O)[O-])N1CCC[C@H](c2nc3ccccc3o2)C1 ZINC000134527330 928977759 /nfs/dbraw/zinc/97/77/59/928977759.db2.gz HKWDZMYFCHANSQ-LBPRGKRZSA-N 0 0 369.352 3.895 20 5 FHBDRN O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1CCC[N@H+](Cc2ccccc2)CC1 ZINC000134533802 928989191 /nfs/dbraw/zinc/98/91/91/928989191.db2.gz SPJDTDCJCIAQJC-UHFFFAOYSA-N 0 0 373.840 3.596 20 5 FHBDRN O=[N+]([O-])c1cccc(CS(=O)(=O)[C@H]2CCc3c2cccc3Cl)c1 ZINC000154579105 929009111 /nfs/dbraw/zinc/00/91/11/929009111.db2.gz XZSSBZOWVFGFFI-INIZCTEOSA-N 0 0 351.811 3.851 20 5 FHBDRN COc1ccc(OCc2nn(-c3ccccc3)c3c2CCC3)c([N+](=O)[O-])c1 ZINC000109703911 929021507 /nfs/dbraw/zinc/02/15/07/929021507.db2.gz SXALWAUKEBFUCL-UHFFFAOYSA-N 0 0 365.389 3.857 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N1CC2(CCC2)[C@H]1c1ccncc1 ZINC000598572095 929056157 /nfs/dbraw/zinc/05/61/57/929056157.db2.gz JUKVOXVFEDLJNL-LJQANCHMSA-N 0 0 351.406 3.676 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CCCO[C@H](c2ccccc2)C1 ZINC000609230951 929088052 /nfs/dbraw/zinc/08/80/52/929088052.db2.gz SVRPYJCUTPBJQW-KRWDZBQOSA-N 0 0 360.797 3.852 20 5 FHBDRN CN(C(=O)c1ccc(C(=O)N(C)C2CCCC2)c([N+](=O)[O-])c1)C1CCCC1 ZINC000176622629 937300102 /nfs/dbraw/zinc/30/01/02/937300102.db2.gz JIKXXINMEHENQH-UHFFFAOYSA-N 0 0 373.453 3.624 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1cccnc1OCC(F)F ZINC000134710179 929163875 /nfs/dbraw/zinc/16/38/75/929163875.db2.gz FDOOMHUZHMMRHQ-UHFFFAOYSA-N 0 0 351.309 3.503 20 5 FHBDRN C[C@H](C(=O)NCc1cc([N+](=O)[O-])c(F)cc1F)c1c(F)cccc1F ZINC001143376654 929168008 /nfs/dbraw/zinc/16/80/08/929168008.db2.gz JFKWURGBXFRVTP-QMMMGPOBSA-N 0 0 356.275 3.571 20 5 FHBDRN Cc1ccc(C(=O)NCCCOc2cccc3cccnc32)cc1[N+](=O)[O-] ZINC000044455500 937309153 /nfs/dbraw/zinc/30/91/53/937309153.db2.gz XSJAEMMNMOYAQB-UHFFFAOYSA-N 0 0 365.389 3.650 20 5 FHBDRN CCc1ccc(C(=O)N(C)Cc2c(C)nc3sc(C)cn32)cc1[N+](=O)[O-] ZINC000134739475 929201581 /nfs/dbraw/zinc/20/15/81/929201581.db2.gz CQURRNXBLXOXKQ-UHFFFAOYSA-N 0 0 372.450 3.755 20 5 FHBDRN Cc1c2ccccc2n(C)c1CNC(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000471219721 929225600 /nfs/dbraw/zinc/22/56/00/929225600.db2.gz JWDDOYBMOALZEW-UHFFFAOYSA-N 0 0 351.406 3.644 20 5 FHBDRN CO[C@]1(C)C[C@H](NC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)C1(C)C ZINC000547749405 929290563 /nfs/dbraw/zinc/29/05/63/929290563.db2.gz OFEHRDUWUATIEK-PGRDOPGGSA-N 0 0 364.445 3.615 20 5 FHBDRN Cc1c2ccccc2n(C)c1CNC(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000471227334 929304840 /nfs/dbraw/zinc/30/48/40/929304840.db2.gz IXYKPWPBPAESEH-CYBMUJFWSA-N 0 0 369.396 3.954 20 5 FHBDRN Cc1cc(S(=O)(=O)N(C)[C@H](C)c2cccc(Cl)c2)ccc1[N+](=O)[O-] ZINC000609673389 929310367 /nfs/dbraw/zinc/31/03/67/929310367.db2.gz FBXLDTCODDMYND-GFCCVEGCSA-N 0 0 368.842 3.938 20 5 FHBDRN Cc1sc(C(=O)N2CCO[C@H](c3ccc(F)c(C)c3)C2)cc1[N+](=O)[O-] ZINC000134843358 929334632 /nfs/dbraw/zinc/33/46/32/929334632.db2.gz RBFUXZJHMYDKQQ-HNNXBMFYSA-N 0 0 364.398 3.626 20 5 FHBDRN CO[C@@H](CNC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1)c1ccccc1 ZINC000178846062 937322038 /nfs/dbraw/zinc/32/20/38/937322038.db2.gz RNEYWOJWCCYAPG-IBGZPJMESA-N 0 0 369.421 3.657 20 5 FHBDRN O=C(N[C@@H](CC1CC1)c1ccccc1)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000610243164 929337108 /nfs/dbraw/zinc/33/71/08/929337108.db2.gz MFWBHCAAZWVRCQ-KRWDZBQOSA-N 0 0 350.378 3.742 20 5 FHBDRN Cc1ccc(-c2nc(CC(=O)N3CCc4ccc([N+](=O)[O-])cc43)cs2)o1 ZINC000046186127 929338459 /nfs/dbraw/zinc/33/84/59/929338459.db2.gz NPGZNEGSMKXPCS-UHFFFAOYSA-N 0 0 369.402 3.752 20 5 FHBDRN Cc1ncc2c(n1)CC[C@H](Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)C2 ZINC000535989007 937325372 /nfs/dbraw/zinc/32/53/72/937325372.db2.gz LYRRYRSIWSYIJR-NSHDSACASA-N 0 0 352.316 3.681 20 5 FHBDRN CC(C)[C@@H]1CCCCN1C(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000583296601 937328971 /nfs/dbraw/zinc/32/89/71/937328971.db2.gz IWEZPIPWSIDWID-SFHVURJKSA-N 0 0 358.442 3.839 20 5 FHBDRN Cc1nc([C@@H]2CCCCCN2C(=O)Nc2cc(F)cc([N+](=O)[O-])c2)no1 ZINC000547760544 929434783 /nfs/dbraw/zinc/43/47/83/929434783.db2.gz OWQBAKJAKUYCTI-AWEZNQCLSA-N 0 0 363.349 3.575 20 5 FHBDRN COC(=O)c1cc(NC(=O)CCc2cccc(C)c2)c(C)c([N+](=O)[O-])c1 ZINC000583298389 937330466 /nfs/dbraw/zinc/33/04/66/937330466.db2.gz KTBLSMXWGQETGS-UHFFFAOYSA-N 0 0 356.378 3.570 20 5 FHBDRN CC(C)(C)OC(=O)C1(NC(=O)Nc2cc(F)cc([N+](=O)[O-])c2)CCCC1 ZINC000547760203 929449545 /nfs/dbraw/zinc/44/95/45/929449545.db2.gz RLOXVOQJQHQTLK-UHFFFAOYSA-N 0 0 367.377 3.510 20 5 FHBDRN Cc1nc([C@H]2CCCN2C(=O)c2cc(F)c([N+](=O)[O-])cc2F)cs1 ZINC000275079721 929480708 /nfs/dbraw/zinc/48/07/08/929480708.db2.gz NEQYOPPPLADKRH-CYBMUJFWSA-N 0 0 353.350 3.615 20 5 FHBDRN CC(C)c1ccc(C(=O)Nc2ccccc2-n2ccnn2)cc1[N+](=O)[O-] ZINC000187225319 929613992 /nfs/dbraw/zinc/61/39/92/929613992.db2.gz MYCCAYDYIWBHDL-UHFFFAOYSA-N 0 0 351.366 3.551 20 5 FHBDRN Cc1cccc(C)c1C(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000175345788 929620911 /nfs/dbraw/zinc/62/09/11/929620911.db2.gz DQCFQFUJAUEBFG-UHFFFAOYSA-N 0 0 354.406 3.895 20 5 FHBDRN Cc1cc(Br)ccc1CC(=O)NCc1ccccc1[N+](=O)[O-] ZINC000180691695 929621041 /nfs/dbraw/zinc/62/10/41/929621041.db2.gz WRWWXMSRFSASEI-UHFFFAOYSA-N 0 0 363.211 3.525 20 5 FHBDRN O=C(N[C@H]1CCSC1)c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1 ZINC000471445369 929642602 /nfs/dbraw/zinc/64/26/02/929642602.db2.gz VRTIAUTWCRWDDC-ZDUSSCGKSA-N 0 0 360.460 3.981 20 5 FHBDRN CCOc1ccc(C(=O)Nc2cccc(OCCCOC)c2)cc1[N+](=O)[O-] ZINC000430458136 929654841 /nfs/dbraw/zinc/65/48/41/929654841.db2.gz HHZPGAYVRIJORH-UHFFFAOYSA-N 0 0 374.393 3.661 20 5 FHBDRN C[C@H]1c2cc(F)cc(F)c2CCN1C(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000468040948 929676236 /nfs/dbraw/zinc/67/62/36/929676236.db2.gz WKKGZQWRRKNOAY-NSHDSACASA-N 0 0 361.348 3.702 20 5 FHBDRN CCN(C(=O)c1cc([N+](=O)[O-])ccc1C)[C@@H](COC)Cc1ccccc1 ZINC000471448642 929676400 /nfs/dbraw/zinc/67/64/00/929676400.db2.gz IGYQVLBHROTVOD-GOSISDBHSA-N 0 0 356.422 3.623 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)NCC(C)(C)C2(O)CCCC2)cc1[N+](=O)[O-] ZINC000458482615 937350297 /nfs/dbraw/zinc/35/02/97/937350297.db2.gz ANLDUZLSYIGZOF-AWEZNQCLSA-N 0 0 363.458 3.595 20 5 FHBDRN CC(C)CO[C@@H]1CCN(C(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)C1 ZINC000275650774 929708222 /nfs/dbraw/zinc/70/82/22/929708222.db2.gz LOMBYPCIWBFYMM-MRXNPFEDSA-N 0 0 364.445 3.981 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H](Cc2ccccc2)[C@@H]1C ZINC000471454964 929725955 /nfs/dbraw/zinc/72/59/55/929725955.db2.gz KIJXTPKJLBZLSP-HOCLYGCPSA-N 0 0 354.406 3.697 20 5 FHBDRN O=C(Cn1ccc2ccc(Cl)cc21)N1CCc2c1cccc2[N+](=O)[O-] ZINC000609972250 929748498 /nfs/dbraw/zinc/74/84/98/929748498.db2.gz BMHQFZKITFTNEY-UHFFFAOYSA-N 0 0 355.781 3.792 20 5 FHBDRN CC[C@H](NC(=O)NCC(C)(C)C1(O)CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000458484375 937356452 /nfs/dbraw/zinc/35/64/52/937356452.db2.gz BOXNCBNMGKMEFK-INIZCTEOSA-N 0 0 363.458 3.676 20 5 FHBDRN O=C(c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)N1CC[C@@H]1c1cccc(F)c1 ZINC000610304851 929779077 /nfs/dbraw/zinc/77/90/77/929779077.db2.gz UMKYARASIWFKLR-GOSISDBHSA-N 0 0 366.352 3.507 20 5 FHBDRN CC[C@@H](NC(=O)N1CC[C@@H](Nc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000176683767 937366787 /nfs/dbraw/zinc/36/67/87/937366787.db2.gz ADFLFYDDTYPSMV-IEBWSBKVSA-N 0 0 368.437 3.942 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)N2CCC[C@H]2[C@H]2CCCOC2)cc1[N+](=O)[O-] ZINC000572956318 937367696 /nfs/dbraw/zinc/36/76/96/937367696.db2.gz URPKVIKIWIJDFL-XIRDDKMYSA-N 0 0 361.442 3.565 20 5 FHBDRN C[C@@H](CC(=O)OCCn1ccc([N+](=O)[O-])n1)c1ccccc1C(F)(F)F ZINC000748128721 929901900 /nfs/dbraw/zinc/90/19/00/929901900.db2.gz JSICVKNMNFTOPD-NSHDSACASA-N 0 0 371.315 3.547 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1n[nH]cc1-c1ccc(Cl)cc1 ZINC001167329416 929909564 /nfs/dbraw/zinc/90/95/64/929909564.db2.gz RHBSQSBODSPKLX-UHFFFAOYSA-N 0 0 372.768 3.899 20 5 FHBDRN CC[C@@H](C)[C@@H](O)CNC(=O)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12 ZINC000275695975 929937456 /nfs/dbraw/zinc/93/74/56/929937456.db2.gz RPMRZVXELWMQHH-QGHHPUGFSA-N 0 0 374.387 3.509 20 5 FHBDRN Cc1ccc2c(c1)O[C@@H](C)CN2C(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1 ZINC000175842910 929948635 /nfs/dbraw/zinc/94/86/35/929948635.db2.gz MUDZIDOPBAOPTM-NSHDSACASA-N 0 0 371.349 3.548 20 5 FHBDRN C[C@H](CC(=O)OCCn1ccc([N+](=O)[O-])n1)c1cccc(C(F)(F)F)c1 ZINC000748131897 929952404 /nfs/dbraw/zinc/95/24/04/929952404.db2.gz PCMRUHOEJSVKQS-LLVKDONJSA-N 0 0 371.315 3.547 20 5 FHBDRN CCCc1nc(CSc2ccc([N+](=O)[O-])c(S(C)(=O)=O)c2)cs1 ZINC000155544769 929967498 /nfs/dbraw/zinc/96/74/98/929967498.db2.gz SGWKELYYWRASIU-UHFFFAOYSA-N 0 0 372.493 3.700 20 5 FHBDRN C[C@@H](C(=O)N1CCC(OCc2ccccc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000583358752 937375336 /nfs/dbraw/zinc/37/53/36/937375336.db2.gz WTWKGXDMLLENLE-MRXNPFEDSA-N 0 0 368.433 3.906 20 5 FHBDRN O=C(OCc1ccc(Br)cc1)c1cc(F)ccc1[N+](=O)[O-] ZINC000064877839 930002323 /nfs/dbraw/zinc/00/23/23/930002323.db2.gz LDANPKXQUODLSD-UHFFFAOYSA-N 0 0 354.131 3.853 20 5 FHBDRN C[C@H](COc1cccc(F)c1)NC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000610041282 930010279 /nfs/dbraw/zinc/01/02/79/930010279.db2.gz ZOVXTSZVBFNHHN-CYBMUJFWSA-N 0 0 360.385 3.595 20 5 FHBDRN Cc1ccn(CC/C=C\c2ccc(Br)cc2)c(=O)c1[N+](=O)[O-] ZINC000471497799 930013444 /nfs/dbraw/zinc/01/34/44/930013444.db2.gz YXPWZKGLULHOTC-RQOWECAXSA-N 0 0 363.211 3.931 20 5 FHBDRN CCn1c2ccc(F)cc2nc1NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC001266552537 930037899 /nfs/dbraw/zinc/03/78/99/930037899.db2.gz DWXWZZTYAMCVGF-LSDHHAIUSA-N 0 0 368.368 3.846 20 5 FHBDRN CC(C)(O)C1CN(C(=O)/C=C/c2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000275726384 930052287 /nfs/dbraw/zinc/05/22/87/930052287.db2.gz XSTVQUYVXLPVTL-CSKARUKUSA-N 0 0 372.446 3.566 20 5 FHBDRN COc1ccc(NC(=O)CNc2ccc(C3CCC3)cc2)c([N+](=O)[O-])c1 ZINC000580034907 930058721 /nfs/dbraw/zinc/05/87/21/930058721.db2.gz UFSIWWSSQSYABH-UHFFFAOYSA-N 0 0 355.394 3.922 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)[C@H]2OCCc3sccc32)c1C ZINC000891147680 930060634 /nfs/dbraw/zinc/06/06/34/930060634.db2.gz RZEHWYOQZYASQG-SJKOYZFVSA-N 0 0 360.435 3.705 20 5 FHBDRN CC(C)C[C@@H](NC(=O)CN(C)c1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000463309884 930067453 /nfs/dbraw/zinc/06/74/53/930067453.db2.gz SZEJFJSZDUQGMB-QGZVFWFLSA-N 0 0 355.438 3.935 20 5 FHBDRN Cc1ccccc1[C@@H]1CN(C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)CCO1 ZINC000610349550 930071058 /nfs/dbraw/zinc/07/10/58/930071058.db2.gz COSJQSCELFFDCR-BEFAXECRSA-N 0 0 369.421 3.747 20 5 FHBDRN COC(=O)c1cc(NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)ccc1C ZINC000471506244 930072388 /nfs/dbraw/zinc/07/23/88/930072388.db2.gz DWMHXXSLKNOWIO-UHFFFAOYSA-N 0 0 356.378 3.606 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3.598 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)N2CC3(CCOCC3)[C@H]2C2CC2)cc1[N+](=O)[O-] ZINC000458495680 937387720 /nfs/dbraw/zinc/38/77/20/937387720.db2.gz HWVJTYJVJRMRQC-KBXCAEBGSA-N 0 0 373.453 3.565 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCOC(C)(C)C1 ZINC000121159410 930175710 /nfs/dbraw/zinc/17/57/10/930175710.db2.gz MGPAPGMADUHLDN-LBPRGKRZSA-N 0 0 352.456 3.783 20 5 FHBDRN CC(C)(COC(=O)c1ccc(Cl)cc1[N+](=O)[O-])C1OCC(C)(C)CO1 ZINC000121152620 930175845 /nfs/dbraw/zinc/17/58/45/930175845.db2.gz BFUFKGIWLRLZRE-UHFFFAOYSA-N 0 0 371.817 3.830 20 5 FHBDRN C[C@@H](NC(=O)COc1cc(F)cc([N+](=O)[O-])c1)c1ccc(Cl)cc1 ZINC000135355483 937393517 /nfs/dbraw/zinc/39/35/17/937393517.db2.gz LQNXDMBUCQXZJL-SNVBAGLBSA-N 0 0 352.749 3.644 20 5 FHBDRN CC1(C)[C@H](NC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)[C@@H]2CCO[C@H]21 ZINC000275762028 930186371 /nfs/dbraw/zinc/18/63/71/930186371.db2.gz KNCAMGZTBJHONJ-VHKYSDTDSA-N 0 0 362.429 3.637 20 5 FHBDRN Nc1ccc(C(=O)N[C@H]2CCCC[C@H]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000728283331 930191434 /nfs/dbraw/zinc/19/14/34/930191434.db2.gz JKSWPJVGWWAQQP-YJBOKZPZSA-N 0 0 353.422 3.708 20 5 FHBDRN Cc1cc(COC(=O)Cc2ccc(Br)cc2)ccc1[N+](=O)[O-] ZINC001266572523 930212895 /nfs/dbraw/zinc/21/28/95/930212895.db2.gz LNSGVNRVKLODBC-UHFFFAOYSA-N 0 0 364.195 3.952 20 5 FHBDRN CN(Cc1cc2ccccc2o1)C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000471535894 930213160 /nfs/dbraw/zinc/21/31/60/930213160.db2.gz HPYZBXWLCRSKBG-UHFFFAOYSA-N 0 0 363.373 3.954 20 5 FHBDRN COCCOc1cccc(NC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000047756754 930240159 /nfs/dbraw/zinc/24/01/59/930240159.db2.gz FQHSOWSETFUBHE-ZDUSSCGKSA-N 0 0 359.382 3.503 20 5 FHBDRN O=C(N[C@@H]1CC[C@@H](c2ccc(F)cc2)C1)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000471538554 930240681 /nfs/dbraw/zinc/24/06/81/930240681.db2.gz PCILSHFLHPVALF-IUODEOHRSA-N 0 0 372.352 3.529 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)N1CC[C@@](F)(c2ccccc2)C1 ZINC000580098615 930241660 /nfs/dbraw/zinc/24/16/60/930241660.db2.gz 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CCc1nnc(-c2ccc(NC(=O)c3cc(C)ccc3[N+](=O)[O-])cc2)o1 ZINC000175796077 930391533 /nfs/dbraw/zinc/39/15/33/930391533.db2.gz CCTYHBINUJBHQE-UHFFFAOYSA-N 0 0 352.350 3.768 20 5 FHBDRN CCc1nnc(-c2ccc(NC(=O)c3ccc([N+](=O)[O-])c(C)c3)cc2)o1 ZINC000175796457 930395222 /nfs/dbraw/zinc/39/52/22/930395222.db2.gz KHAJUXABMGDUBO-UHFFFAOYSA-N 0 0 352.350 3.768 20 5 FHBDRN Cc1c(CC(=O)N[C@@H]2CCc3sc(Cl)cc32)cccc1[N+](=O)[O-] ZINC000580252823 930405549 /nfs/dbraw/zinc/40/55/49/930405549.db2.gz LHMDDYVGNPYAHC-GFCCVEGCSA-N 0 0 350.827 3.964 20 5 FHBDRN CC(C)(CNC(=O)c1ccc([N+](=O)[O-])s1)Oc1cc(F)cc(F)c1 ZINC000579505948 930413744 /nfs/dbraw/zinc/41/37/44/930413744.db2.gz FFNKQXKDDIQBQV-UHFFFAOYSA-N 0 0 356.350 3.522 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N[C@@H]1[C@H]2CCO[C@H]2C12CCCC2 ZINC000275814693 930445572 /nfs/dbraw/zinc/44/55/72/930445572.db2.gz MVCWZIPGYXNWNL-DAXOMENPSA-N 0 0 364.829 3.634 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(=O)n1Cc1ccc(Br)cc1Cl ZINC000471550282 930447054 /nfs/dbraw/zinc/44/70/54/930447054.db2.gz ZVORVZGKBGMELJ-UHFFFAOYSA-N 0 0 357.591 3.529 20 5 FHBDRN COc1ccc(C[NH2+]CCc2ccc([N+](=O)[O-])cc2)c(Br)c1 ZINC000319292536 930453388 /nfs/dbraw/zinc/45/33/88/930453388.db2.gz HTABNQSAMBXPDZ-UHFFFAOYSA-N 0 0 365.227 3.698 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N(CCc2cccc(F)c2)C2CC2)c1 ZINC000070957796 930453646 /nfs/dbraw/zinc/45/36/46/930453646.db2.gz MQGBDYMTUBGGKO-UHFFFAOYSA-N 0 0 358.369 3.590 20 5 FHBDRN CC(C)NC(=O)c1ccc(NCc2ccc(OC(C)C)nc2)c([N+](=O)[O-])c1 ZINC000052327157 937417222 /nfs/dbraw/zinc/41/72/22/937417222.db2.gz JKLHKMWUXGAQBP-UHFFFAOYSA-N 0 0 372.425 3.527 20 5 FHBDRN C[C@H]1CCc2ccccc2N1C(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000610413918 930468032 /nfs/dbraw/zinc/46/80/32/930468032.db2.gz MHDCDVKRDNMHIX-LBPRGKRZSA-N 0 0 363.373 3.830 20 5 FHBDRN CSCC[C@H](C)NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000134180599 930471496 /nfs/dbraw/zinc/47/14/96/930471496.db2.gz AUFQJKNBMHCUSP-JTQLQIEISA-N 0 0 351.453 3.590 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)NCc1ccccc1OCC1CC1 ZINC000610091853 930474069 /nfs/dbraw/zinc/47/40/69/930474069.db2.gz VATQKXVJVRPRIU-UHFFFAOYSA-N 0 0 371.393 3.714 20 5 FHBDRN CCC(O)(CC)CNC(=O)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12 ZINC000275822320 930481940 /nfs/dbraw/zinc/48/19/40/930481940.db2.gz SLODCBSTSCEVOP-UHFFFAOYSA-N 0 0 374.387 3.653 20 5 FHBDRN COc1cc(C(=O)N[C@@H](C)[C@@H]2CC3CCC2CC3)c([N+](=O)[O-])cc1OC ZINC000580317819 930492756 /nfs/dbraw/zinc/49/27/56/930492756.db2.gz FIMUCJCMEVXQEM-ABXWRUBCSA-N 0 0 362.426 3.557 20 5 FHBDRN C[C@H]1c2ccccc2OCCN1C(=O)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC001167379387 930497306 /nfs/dbraw/zinc/49/73/06/930497306.db2.gz OUWNCZYLHQPPAS-LBPRGKRZSA-N 0 0 351.362 3.672 20 5 FHBDRN Cc1cc(N2C[C@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)ncc1[N+](=O)[O-] ZINC000610430831 930526123 /nfs/dbraw/zinc/52/61/23/930526123.db2.gz GQAMBTQUIKZREP-DTORHVGOSA-N 0 0 357.254 3.865 20 5 FHBDRN Cc1noc(C(F)F)c1C(=O)N1CCS[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000610431626 930528926 /nfs/dbraw/zinc/52/89/26/930528926.db2.gz QIOQTJKCAYPGAI-HNNXBMFYSA-N 0 0 369.349 3.717 20 5 FHBDRN O=C(N[C@@H]1CC[C@@H]2CCCC[C@@H]2C1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000610434278 930531983 /nfs/dbraw/zinc/53/19/83/930531983.db2.gz SQMBMOFVQQGHEH-ZMSDIMECSA-N 0 0 368.437 3.869 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)Nc1ncn(C2CCCCC2)n1 ZINC000275861744 930552917 /nfs/dbraw/zinc/55/29/17/930552917.db2.gz ZKHVBECREVSNMX-UHFFFAOYSA-N 0 0 363.805 3.906 20 5 FHBDRN CCOc1cc(NC(=O)N2C[C@@H]3CCC[C@@H]3C2)c([N+](=O)[O-])cc1OCC ZINC000119041316 930557814 /nfs/dbraw/zinc/55/78/14/930557814.db2.gz GTQISEQACRFLHM-BETUJISGSA-N 0 0 363.414 3.656 20 5 FHBDRN C[C@H](C(=O)N1CCN(c2cccc(F)c2)C[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000580360564 930571648 /nfs/dbraw/zinc/57/16/48/930571648.db2.gz ZWOVMPRUBSGBSQ-CABCVRRESA-N 0 0 371.412 3.575 20 5 FHBDRN C[C@@H](Oc1cccnc1[N+](=O)[O-])C(=O)N[C@H](C)c1ccc2c(c1)CCCC2 ZINC000023754748 930601944 /nfs/dbraw/zinc/60/19/44/930601944.db2.gz 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353.220 3.803 20 5 FHBDRN O=C(NCC1(CCOCc2ccccc2)CC1)c1ccc([N+](=O)[O-])s1 ZINC000187365800 931568907 /nfs/dbraw/zinc/56/89/07/931568907.db2.gz MFUYSCLECLLCIL-UHFFFAOYSA-N 0 0 360.435 3.773 20 5 FHBDRN COc1cc(F)ccc1NC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000156840954 931619261 /nfs/dbraw/zinc/61/92/61/931619261.db2.gz KMQZKIDLZFYODJ-UHFFFAOYSA-N 0 0 359.357 3.939 20 5 FHBDRN O=C(NN1CCCCC1)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12 ZINC000276043374 931620824 /nfs/dbraw/zinc/62/08/24/931620824.db2.gz XUWIKAIUCOZBNW-UHFFFAOYSA-N 0 0 357.360 3.503 20 5 FHBDRN COc1ccccc1[C@@H](C)NC(=O)COc1cc(Cl)ccc1[N+](=O)[O-] ZINC000121281345 931637608 /nfs/dbraw/zinc/63/76/08/931637608.db2.gz OLIMRMAEHCZVHB-LLVKDONJSA-N 0 0 364.785 3.513 20 5 FHBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1COc1cccc(-n2cncn2)c1 ZINC000156867496 931641935 /nfs/dbraw/zinc/64/19/35/931641935.db2.gz BGXKOGVLMYPVQD-UHFFFAOYSA-N 0 0 354.366 3.542 20 5 FHBDRN CC(C)(C)c1ccc([C@H](NCCn2ccc([N+](=O)[O-])n2)C(F)(F)F)cc1 ZINC000610485018 931643240 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350.321 3.715 20 5 FHBDRN CC(C)n1ncc2cc(-c3nc(-c4ccc([N+](=O)[O-])cc4)no3)cnc21 ZINC000544932022 931850286 /nfs/dbraw/zinc/85/02/86/931850286.db2.gz CIEBGBGFODIYHZ-UHFFFAOYSA-N 0 0 350.338 3.637 20 5 FHBDRN Cc1cccc(N2CCN(C(=O)c3ccc(Cl)cc3)CC2)c1[N+](=O)[O-] ZINC000302465529 931857901 /nfs/dbraw/zinc/85/79/01/931857901.db2.gz BIWCVQPQXYHBOR-UHFFFAOYSA-N 0 0 359.813 3.519 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)NC2(Cc3ccccc3)CCOCC2)c1C ZINC000891370810 931863073 /nfs/dbraw/zinc/86/30/73/931863073.db2.gz GYPWKUZDABYNLW-UHFFFAOYSA-N 0 0 368.433 3.733 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)Nc1cccc(OC[C@H]2CCCO2)c1 ZINC000043728394 931873595 /nfs/dbraw/zinc/87/35/95/931873595.db2.gz UMJRPCUGENLKOQ-QGZVFWFLSA-N 0 0 357.366 3.797 20 5 FHBDRN CCCc1nc(COC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2)cs1 ZINC000728327443 931890881 /nfs/dbraw/zinc/89/08/81/931890881.db2.gz LDSLTMUDLFDCAX-UHFFFAOYSA-N 0 0 365.367 3.577 20 5 FHBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)c1c(F)cc(F)cc1F ZINC000157140814 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371.437 3.756 20 5 FHBDRN CCc1ccc(NC(=O)COC(=O)c2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000003386747 931985985 /nfs/dbraw/zinc/98/59/85/931985985.db2.gz PZARVFMNZUTFHO-UHFFFAOYSA-N 0 0 362.769 3.606 20 5 FHBDRN CCN(C(=O)c1cc(Cl)cc([N+](=O)[O-])c1)c1ccccc1C(=O)OC ZINC000135153787 932005143 /nfs/dbraw/zinc/00/51/43/932005143.db2.gz HYKSXUAXJODXPI-UHFFFAOYSA-N 0 0 362.769 3.702 20 5 FHBDRN O=C(CSc1ccc(O)cc1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000135186551 932041845 /nfs/dbraw/zinc/04/18/45/932041845.db2.gz AKBJAPCJXNFTIQ-UHFFFAOYSA-N 0 0 358.419 3.584 20 5 FHBDRN COc1ccccc1[C@@H](CNC(=O)c1csc([N+](=O)[O-])c1)OC(C)C ZINC000187411893 932042736 /nfs/dbraw/zinc/04/27/36/932042736.db2.gz HTCLGMAMGMEKDD-OAHLLOKOSA-N 0 0 364.423 3.561 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc2oc(C3CC3)nc2c1 ZINC000033214440 932046225 /nfs/dbraw/zinc/04/62/25/932046225.db2.gz ZXQWCHXWBIMZIL-UHFFFAOYSA-N 0 0 353.334 3.874 20 5 FHBDRN CN(CCc1cccs1)C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000430601217 932050602 /nfs/dbraw/zinc/05/06/02/932050602.db2.gz ZCZZQFYREOIRJF-UHFFFAOYSA-N 0 0 369.240 3.734 20 5 FHBDRN Cc1ccc(CS(=O)(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1C ZINC000561381619 932055029 /nfs/dbraw/zinc/05/50/29/932055029.db2.gz JYMHPEJZEGCDPH-UHFFFAOYSA-N 0 0 374.462 3.706 20 5 FHBDRN Cc1cc(NC[C@@H](c2ccccc2)[NH+]2CCCC2)c(C(=O)[O-])cc1[N+](=O)[O-] ZINC000581432283 932061963 /nfs/dbraw/zinc/06/19/63/932061963.db2.gz QBNPGDVNZRPFCN-IBGZPJMESA-N 0 0 369.421 3.850 20 5 FHBDRN O=C(Nc1ncc(Cl)s1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000610573267 932066378 /nfs/dbraw/zinc/06/63/78/932066378.db2.gz ULODYPPKLUNURX-UHFFFAOYSA-N 0 0 362.592 3.720 20 5 FHBDRN CC(=O)Nc1cccc2c1CCCN2Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610581185 932073917 /nfs/dbraw/zinc/07/39/17/932073917.db2.gz KNKKWTMLFBDLEX-UHFFFAOYSA-N 0 0 366.377 3.647 20 5 FHBDRN Cc1c(Br)c(NCc2ccc(F)cc2F)ncc1[N+](=O)[O-] ZINC000165756157 932083470 /nfs/dbraw/zinc/08/34/70/932083470.db2.gz COLXJQMQKHGARL-UHFFFAOYSA-N 0 0 358.142 3.951 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])c1cccc(Oc2nccs2)c1 ZINC000134486014 932086193 /nfs/dbraw/zinc/08/61/93/932086193.db2.gz WTPSBZVGCFGWFR-UHFFFAOYSA-N 0 0 355.375 3.774 20 5 FHBDRN CC(=O)c1cc(NCc2ccc(C)cc2O[C@H]2CCOC2)ccc1[N+](=O)[O-] ZINC000581446273 932095039 /nfs/dbraw/zinc/09/50/39/932095039.db2.gz MNZGQJFXQBEDOJ-KRWDZBQOSA-N 0 0 370.405 3.886 20 5 FHBDRN CC1(C)[C@@H](C(F)(F)F)CCN1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000276237950 932118785 /nfs/dbraw/zinc/11/87/85/932118785.db2.gz LPFVXKCLWAISER-ZDUSSCGKSA-N 0 0 360.332 3.624 20 5 FHBDRN COc1ccc(-c2nnc(CNc3c(C)ccc([N+](=O)[O-])c3C)o2)cc1 ZINC000471663176 932133580 /nfs/dbraw/zinc/13/35/80/932133580.db2.gz PBDQIXBKFIWIQV-UHFFFAOYSA-N 0 0 354.366 3.882 20 5 FHBDRN CO[C@H](C)[C@H](C)NC(=O)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12 ZINC000276257204 932135673 /nfs/dbraw/zinc/13/56/73/932135673.db2.gz WDERPPWEFBIYAS-VHSXEESVSA-N 0 0 360.360 3.525 20 5 FHBDRN CCOCCOCc1cccc(NC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)c1 ZINC000255312032 932143717 /nfs/dbraw/zinc/14/37/17/932143717.db2.gz XDJVTWLKKZVEQR-FLIBITNWSA-N 0 0 370.405 3.800 20 5 FHBDRN C[C@@H](OC(=O)c1ccccc1F)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000003393196 932145409 /nfs/dbraw/zinc/14/54/09/932145409.db2.gz DNBXTNGHDHERFJ-SECBINFHSA-N 0 0 366.732 3.571 20 5 FHBDRN COc1ccccc1[C@@H](CNC(=O)c1cc([N+](=O)[O-])ccc1C)OC(C)C ZINC000187416419 932170378 /nfs/dbraw/zinc/17/03/78/932170378.db2.gz QESVTKQDMCTNKT-LJQANCHMSA-N 0 0 372.421 3.808 20 5 FHBDRN COc1cccc(-c2cc(NC(=O)c3ccc(C)c([N+](=O)[O-])c3)n(C)n2)c1 ZINC000119383190 932177902 /nfs/dbraw/zinc/17/79/02/932177902.db2.gz SMQWUATZRMSSOI-UHFFFAOYSA-N 0 0 366.377 3.565 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)NC2CCC(C(C)C)CC2)cc1OC ZINC000119386624 932178850 /nfs/dbraw/zinc/17/88/50/932178850.db2.gz UOQWFVPFTVOOLK-UHFFFAOYSA-N 0 0 364.442 3.947 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2ccc(CN3CCOC[C@H]3CC(F)F)o2)c1 ZINC000581515951 932192570 /nfs/dbraw/zinc/19/25/70/932192570.db2.gz PSNXAGNATDIIKJ-CQSZACIVSA-N 0 0 352.337 3.711 20 5 FHBDRN COc1cccc([C@H]2C[C@H](NC(=O)[C@@H](C)c3cccc([N+](=O)[O-])c3)C2)c1 ZINC000581532559 932219080 /nfs/dbraw/zinc/21/90/80/932219080.db2.gz MQTNPYPXMLQDML-JQFCIGGWSA-N 0 0 354.406 3.769 20 5 FHBDRN C[C@@]1(C(=O)OCC(=O)c2ccc([N+](=O)[O-])cc2)CCCc2ccccc21 ZINC000728343625 932253577 /nfs/dbraw/zinc/25/35/77/932253577.db2.gz UEZAELUTEUSZQP-HXUWFJFHSA-N 0 0 353.374 3.615 20 5 FHBDRN O=C(Cc1c[nH]c2cc(Cl)ccc12)OCC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000728343565 932253928 /nfs/dbraw/zinc/25/39/28/932253928.db2.gz OQGGOJYPSQWLOH-UHFFFAOYSA-N 0 0 372.764 3.698 20 5 FHBDRN COc1ccc(NC(=O)c2ccc([N+](=O)[O-])c3cccnc23)c2cccnc12 ZINC000126599259 932265843 /nfs/dbraw/zinc/26/58/43/932265843.db2.gz JZKPRFIXRNADMD-UHFFFAOYSA-N 0 0 374.356 3.952 20 5 FHBDRN Cc1cc(C)c(NC(=O)c2ccc(Br)c([N+](=O)[O-])c2)c(C)n1 ZINC000097040192 932280140 /nfs/dbraw/zinc/28/01/40/932280140.db2.gz KKIBYSDDNTYLHM-UHFFFAOYSA-N 0 0 364.199 3.930 20 5 FHBDRN Cc1ccc(Oc2ccncc2[N+](=O)[O-])c(I)c1 ZINC000075063063 932302391 /nfs/dbraw/zinc/30/23/91/932302391.db2.gz LCTJHCRWCNYKRO-UHFFFAOYSA-N 0 0 356.119 3.695 20 5 FHBDRN C[C@@H](CCOc1ccccc1)C(=O)Nc1cc([N+](=O)[O-])c(F)cc1F ZINC000075082419 932303216 /nfs/dbraw/zinc/30/32/16/932303216.db2.gz KENCRRNZUKUBDZ-NSHDSACASA-N 0 0 350.321 3.917 20 5 FHBDRN CC(C)CCc1nc(Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)cs1 ZINC000581607377 932306879 /nfs/dbraw/zinc/30/68/79/932306879.db2.gz XYOXXJVQKWJOLB-UHFFFAOYSA-N 0 0 357.439 3.947 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1N1CCOC[C@H]1c1ccco1 ZINC000610516471 932330571 /nfs/dbraw/zinc/33/05/71/932330571.db2.gz REYYRNHMUOMHNJ-ZDUSSCGKSA-N 0 0 353.172 3.528 20 5 FHBDRN O=C(Nc1ccc(O[C@@H]2CCOC2)cc1)[C@@H]1C[C@H]1c1cccc([N+](=O)[O-])c1 ZINC000933334327 932333383 /nfs/dbraw/zinc/33/33/83/932333383.db2.gz HBLVKAAZPDPBJE-CEXWTWQISA-N 0 0 368.389 3.505 20 5 FHBDRN CCc1cc(N2CCOC(C)(C)[C@@H]2C)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000477138717 932348998 /nfs/dbraw/zinc/34/89/98/932348998.db2.gz GYUKVYDPUDNPTG-ZDUSSCGKSA-N 0 0 356.426 3.618 20 5 FHBDRN CCc1cc(NC(=O)C(C)=Cc2ccccn2)c2cc([N+](=O)[O-])ccc2n1 ZINC001266776476 932357828 /nfs/dbraw/zinc/35/78/28/932357828.db2.gz CCQRWZCSLSRPPE-JLHYYAGUSA-N 0 0 362.389 3.564 20 5 FHBDRN CCc1cc(NC(=O)C(C)=Cc2ccccn2)c2cc([N+](=O)[O-])ccc2n1 ZINC001266776478 932357873 /nfs/dbraw/zinc/35/78/73/932357873.db2.gz CCQRWZCSLSRPPE-RAXLEYEMSA-N 0 0 362.389 3.564 20 5 FHBDRN CCc1cc(NC(=O)[C@H]2CCO[C@@H](C(C)C)C2)c2cc([N+](=O)[O-])ccc2n1 ZINC001266776770 932360151 /nfs/dbraw/zinc/36/01/51/932360151.db2.gz GULORRIPSOTDSO-ORAYPTAESA-N 0 0 371.437 3.517 20 5 FHBDRN CC[C@H](c1ccccc1)[C@@H]1CCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000477159180 932361025 /nfs/dbraw/zinc/36/10/25/932361025.db2.gz JBSRENOZFRFBRB-MOPGFXCFSA-N 0 0 374.462 3.942 20 5 FHBDRN COc1cccc(-c2nc(C(=O)Nc3cccc([N+](=O)[O-])c3)c(C)[nH]2)c1 ZINC000157369414 932389914 /nfs/dbraw/zinc/38/99/14/932389914.db2.gz DLEAVRQAGFCZHN-UHFFFAOYSA-N 0 0 352.350 3.554 20 5 FHBDRN O=C(Nc1cccc(-c2n[nH]c(C3CC3)n2)c1)c1ccc(F)cc1[N+](=O)[O-] ZINC000127222009 932409521 /nfs/dbraw/zinc/40/95/21/932409521.db2.gz AKJOEYXNFKSRES-UHFFFAOYSA-N 0 0 367.340 3.649 20 5 FHBDRN Cc1ccc(C[C@H](C)NC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)s1 ZINC000126739337 932418160 /nfs/dbraw/zinc/41/81/60/932418160.db2.gz MOAVZQHVNOXFBO-LBPRGKRZSA-N 0 0 370.434 3.511 20 5 FHBDRN Cc1cc(OCC(=O)NC[C@@H]2CCCCC(F)(F)C2)ccc1[N+](=O)[O-] ZINC000581683293 932489142 /nfs/dbraw/zinc/48/91/42/932489142.db2.gz NGADTHJKJRYTNF-CYBMUJFWSA-N 0 0 356.369 3.614 20 5 FHBDRN CN(CCc1cccs1)C(=O)c1cc([N+](=O)[O-])ccc1Br ZINC000097992670 932489298 /nfs/dbraw/zinc/48/92/98/932489298.db2.gz KFPQGCXQGHLTLY-UHFFFAOYSA-N 0 0 369.240 3.734 20 5 FHBDRN CO[C@H](c1ccc(Cl)cc1)[C@H](C)NC(=O)c1ccc([N+](=O)[O-])cc1F ZINC000127257654 932502917 /nfs/dbraw/zinc/50/29/17/932502917.db2.gz LJRHAEFDQCECAL-QFYYESIMSA-N 0 0 366.776 3.893 20 5 FHBDRN COc1c(-c2nc(-c3ccnc(OC4CCC4)c3)no2)cccc1[N+](=O)[O-] ZINC000581692231 932506734 /nfs/dbraw/zinc/50/67/34/932506734.db2.gz MTPCRWSSBNBHIY-UHFFFAOYSA-N 0 0 368.349 3.647 20 5 FHBDRN Cc1ccc(-c2noc(-c3ccc(O[C@@H]4CCOC4)cc3)n2)cc1[N+](=O)[O-] ZINC000581751466 932597628 /nfs/dbraw/zinc/59/76/28/932597628.db2.gz ABQQIVAZLPMAFN-MRXNPFEDSA-N 0 0 367.361 3.788 20 5 FHBDRN COC(=O)c1cc(CNc2ccc3ncccc3c2[N+](=O)[O-])ccc1OC ZINC000051210236 932612514 /nfs/dbraw/zinc/61/25/14/932612514.db2.gz WWAYQNBJZBTQML-UHFFFAOYSA-N 0 0 367.361 3.550 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@@H](c1cccc(F)c1)C(C)(C)C ZINC000178131602 932624530 /nfs/dbraw/zinc/62/45/30/932624530.db2.gz SAEZWOYSSHDHOA-KRWDZBQOSA-N 0 0 362.405 3.533 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])c1c(F)cc(Br)cc1F ZINC000317651719 932663362 /nfs/dbraw/zinc/66/33/62/932663362.db2.gz ZKAGVZGUSQSDJR-UHFFFAOYSA-N 0 0 371.137 3.566 20 5 FHBDRN CCNc1ccc(C(=O)Nc2c3c(nn2C(C)C)CCC3)cc1[N+](=O)[O-] ZINC000471715787 932692561 /nfs/dbraw/zinc/69/25/61/932692561.db2.gz NCODVVOBOMKNOT-UHFFFAOYSA-N 0 0 357.414 3.545 20 5 FHBDRN Nc1c(C(=O)N2CCC(c3c[nH]c4ccccc43)CC2)cccc1[N+](=O)[O-] ZINC000178155653 932698402 /nfs/dbraw/zinc/69/84/02/932698402.db2.gz SOAYSDNTONOJIO-UHFFFAOYSA-N 0 0 364.405 3.678 20 5 FHBDRN C[C@H](CC(=O)c1ccccc1)NC(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000157957376 932700387 /nfs/dbraw/zinc/70/03/87/932700387.db2.gz UKFQZGZFNQMINJ-CYBMUJFWSA-N 0 0 363.373 3.534 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)NCC(C)(C)Oc1ccccc1 ZINC000561567307 932702205 /nfs/dbraw/zinc/70/22/05/932702205.db2.gz FUTQTDIANLXGSI-UHFFFAOYSA-N 0 0 371.437 3.636 20 5 FHBDRN COc1ccc(N(C)C(=O)c2cc(Cl)ccc2[N+](=O)[O-])c(OC)c1 ZINC000157970714 932751938 /nfs/dbraw/zinc/75/19/38/932751938.db2.gz XNZPRDVPZBCEBI-UHFFFAOYSA-N 0 0 350.758 3.542 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)N(C)CC2(O)CCCCCC2)cc1[N+](=O)[O-] ZINC000187443224 932773219 /nfs/dbraw/zinc/77/32/19/932773219.db2.gz BYPYHOAQINHCOO-HNNXBMFYSA-N 0 0 363.458 3.691 20 5 FHBDRN CC[C@H](OC(=O)[C@H]1CC(c2cccc(F)c2)=NO1)c1cccc([N+](=O)[O-])c1 ZINC001266835775 932811338 /nfs/dbraw/zinc/81/13/38/932811338.db2.gz QCFSPERLTXXFFA-ZWKOTPCHSA-N 0 0 372.352 3.921 20 5 FHBDRN CCc1nc(CCNC(=O)c2c(C)cc(Cl)cc2[N+](=O)[O-])cs1 ZINC000276622353 932814078 /nfs/dbraw/zinc/81/40/78/932814078.db2.gz RCSPVIAIHOZKCU-UHFFFAOYSA-N 0 0 353.831 3.548 20 5 FHBDRN O=C(NC[C@H]1CC[C@@H](O)C1)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000276655073 932818392 /nfs/dbraw/zinc/81/83/92/932818392.db2.gz QDWAPKWSVBUISN-XJKSGUPXSA-N 0 0 371.393 3.670 20 5 FHBDRN CCN(Cc1ccccc1C)C(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000135292369 932826395 /nfs/dbraw/zinc/82/63/95/932826395.db2.gz FPELBTQDHUFKEM-UHFFFAOYSA-N 0 0 364.405 3.751 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(F)c(C(=O)N2Cc3cc(F)c(F)cc3C2)c1F ZINC001143401277 932829817 /nfs/dbraw/zinc/82/98/17/932829817.db2.gz PKJQTJRSBVLUIZ-UHFFFAOYSA-N 0 0 354.259 3.616 20 5 FHBDRN C[C@@H]1C[C@H](NC(=O)OC(C)(C)C)CCN1Cc1c(F)cccc1[N+](=O)[O-] ZINC000134661364 932836591 /nfs/dbraw/zinc/83/65/91/932836591.db2.gz DLVIPOHQEJKRMR-CHWSQXEVSA-N 0 0 367.421 3.612 20 5 FHBDRN C[C@@H](OC(=O)Cc1ccc([N+](=O)[O-])cc1)c1nc2ccc(Cl)cc2n1C ZINC000176034777 932868581 /nfs/dbraw/zinc/86/85/81/932868581.db2.gz YILNMEUMKYTQQF-LLVKDONJSA-N 0 0 373.796 3.982 20 5 FHBDRN CC(C)C(=O)c1cnccc1NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000187462564 932885694 /nfs/dbraw/zinc/88/56/94/932885694.db2.gz ZBMJUZCJQLKNDF-UHFFFAOYSA-N 0 0 368.393 3.655 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(N2CCCC2=O)c1 ZINC000588436277 932946789 /nfs/dbraw/zinc/94/67/89/932946789.db2.gz ZPDKKBJPLJJMAD-OWBHPGMISA-N 0 0 365.389 3.764 20 5 FHBDRN CN(Cc1cc([N+](=O)[O-])ccc1Cl)C[C@H](O)c1c(F)cccc1F ZINC000051287073 932959304 /nfs/dbraw/zinc/95/93/04/932959304.db2.gz MFUVUHPGYNLPFY-HNNXBMFYSA-N 0 0 356.756 3.692 20 5 FHBDRN O=C(c1ccc(Cl)cc1[N+](=O)[O-])N1CCN(C2CC2)c2ccccc21 ZINC000187543946 932991973 /nfs/dbraw/zinc/99/19/73/932991973.db2.gz QPCJDBCYXZDDEL-UHFFFAOYSA-N 0 0 357.797 3.877 20 5 FHBDRN C[C@@H]1CC[C@@H](c2ccccc2)N(S(=O)(=O)c2ccccc2[N+](=O)[O-])C1 ZINC000510492759 932998731 /nfs/dbraw/zinc/99/87/31/932998731.db2.gz YUSGOUZXBZKYKZ-ZBFHGGJFSA-N 0 0 360.435 3.757 20 5 FHBDRN Cc1cc(OCC(=O)Nc2ccc(OCC3CC3)cc2)ccc1[N+](=O)[O-] ZINC000430693878 933034001 /nfs/dbraw/zinc/03/40/01/933034001.db2.gz OLYHEWPHXJEQPN-UHFFFAOYSA-N 0 0 356.378 3.710 20 5 FHBDRN CN(CC(=O)N(C)[C@@H]1CCCc2ccccc21)Cc1ccccc1[N+](=O)[O-] ZINC000043783897 933035209 /nfs/dbraw/zinc/03/52/09/933035209.db2.gz BAYGMLNAEVXTBJ-HXUWFJFHSA-N 0 0 367.449 3.563 20 5 FHBDRN COc1ccc(/C=C(/C)C(=O)NCCc2ccc([N+](=O)[O-])cc2)cc1F ZINC000588437530 933052511 /nfs/dbraw/zinc/05/25/11/933052511.db2.gz RDXRDNZVJWWICX-QBFSEMIESA-N 0 0 358.369 3.505 20 5 FHBDRN CCN(C)C(=O)c1cccc(OC(=O)/C(C)=C\c2ccc([N+](=O)[O-])cc2)c1 ZINC000588439134 933062288 /nfs/dbraw/zinc/06/22/88/933062288.db2.gz IJKAHNYLTQBGOJ-OWBHPGMISA-N 0 0 368.389 3.696 20 5 FHBDRN CCc1ccc([C@H](COC)NC(=O)/C(C)=C\c2ccc([N+](=O)[O-])cc2)o1 ZINC000588439430 933065684 /nfs/dbraw/zinc/06/56/84/933065684.db2.gz VOBMSSZSSLWSEQ-MOJYJUKOSA-N 0 0 358.394 3.657 20 5 FHBDRN COc1cccc2c1CC[C@H]2NC(=O)/C(C)=C\c1ccc([N+](=O)[O-])cc1 ZINC000588440159 933069367 /nfs/dbraw/zinc/06/93/67/933069367.db2.gz FAPIFZXRHOUUKD-MENFKHAKSA-N 0 0 352.390 3.810 20 5 FHBDRN C[C@@H](OC(=O)Cc1ccc([N+](=O)[O-])cc1)c1nc2cc(Cl)ccc2n1C ZINC000176052936 933109254 /nfs/dbraw/zinc/10/92/54/933109254.db2.gz XLJFFIMUYVVYPL-LLVKDONJSA-N 0 0 373.796 3.982 20 5 FHBDRN CCc1[nH]nc(C(=O)Nc2ccccc2-c2csc(C)n2)c1[N+](=O)[O-] ZINC000477679320 933114751 /nfs/dbraw/zinc/11/47/51/933114751.db2.gz LBKGJUKGFLRLLA-UHFFFAOYSA-N 0 0 357.395 3.565 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)N1CC[C@H](OCCCc2ccccc2)C1 ZINC000176004600 933115689 /nfs/dbraw/zinc/11/56/89/933115689.db2.gz FOPWQJBMULIMPX-IBGZPJMESA-N 0 0 369.421 3.850 20 5 FHBDRN CCNC(=O)Nc1cccc(NC(=O)/C(C)=C\c2ccc([N+](=O)[O-])cc2)c1 ZINC000588445576 933125894 /nfs/dbraw/zinc/12/58/94/933125894.db2.gz OHDHFUZLJUVFSL-QBFSEMIESA-N 0 0 368.393 3.778 20 5 FHBDRN O=C(N1CCc2c1cccc2[N+](=O)[O-])C1(CCOCc2ccccc2)CC1 ZINC000471853317 933151979 /nfs/dbraw/zinc/15/19/79/933151979.db2.gz ZJLVOIGVQWXZDB-UHFFFAOYSA-N 0 0 366.417 3.871 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N1CCO[C@H](c2ccsc2)C1 ZINC000588446619 933158670 /nfs/dbraw/zinc/15/86/70/933158670.db2.gz GESSZCBHUDWWBG-QFSNBGPKSA-N 0 0 358.419 3.660 20 5 FHBDRN C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H](CCCO)c1ccccc1 ZINC000588446931 933163622 /nfs/dbraw/zinc/16/36/22/933163622.db2.gz VBLTWDUTNFXDQT-IQGVVSCOSA-N 0 0 354.406 3.628 20 5 FHBDRN C[C@@H]1CCCC[C@@H]1CCNC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000510536096 933197810 /nfs/dbraw/zinc/19/78/10/933197810.db2.gz FWWWFURYLKTVFP-HUUCEWRRSA-N 0 0 356.426 3.727 20 5 FHBDRN C[C@@H](c1ccccc1)N(C1CC1)S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000510537645 933200208 /nfs/dbraw/zinc/20/02/08/933200208.db2.gz IYQPVQPCHYGPJG-AWEZNQCLSA-N 0 0 360.435 3.650 20 5 FHBDRN C[C@H](c1ccccc1)N(C1CC1)S(=O)(=O)Cc1ccccc1[N+](=O)[O-] ZINC000510560037 933225779 /nfs/dbraw/zinc/22/57/79/933225779.db2.gz QCJCGHLSPHXCAT-CQSZACIVSA-N 0 0 360.435 3.650 20 5 FHBDRN Cc1cc(OCC(=O)Nc2ccc(-c3ncco3)cc2)ccc1[N+](=O)[O-] ZINC000430783699 933236185 /nfs/dbraw/zinc/23/61/85/933236185.db2.gz DXCIRYFRSCVZGO-UHFFFAOYSA-N 0 0 353.334 3.576 20 5 FHBDRN Cc1cc(OCC(=O)N[C@H](CC(C)(C)C)C(F)(F)F)ccc1[N+](=O)[O-] ZINC000430798440 933236800 /nfs/dbraw/zinc/23/68/00/933236800.db2.gz IICYLCCHRBBYHQ-CYBMUJFWSA-N 0 0 362.348 3.765 20 5 FHBDRN COc1ccc(Cc2nc(-c3cnc4ccsc4c3)no2)cc1[N+](=O)[O-] ZINC000544958298 933237179 /nfs/dbraw/zinc/23/71/79/933237179.db2.gz QTGWXPWFLDDLIL-UHFFFAOYSA-N 0 0 368.374 3.854 20 5 FHBDRN Cc1cc(OCC(=O)N2CCC(c3ccsc3)CC2)ccc1[N+](=O)[O-] ZINC000430793081 933241939 /nfs/dbraw/zinc/24/19/39/933241939.db2.gz VBXJRJCFHYDTKB-UHFFFAOYSA-N 0 0 360.435 3.750 20 5 FHBDRN Cc1cn(C2CCCCC2)nc1NC(=O)COc1ccc([N+](=O)[O-])c(C)c1 ZINC000430795168 933243097 /nfs/dbraw/zinc/24/30/97/933243097.db2.gz TUODWHXNJHPSHG-UHFFFAOYSA-N 0 0 372.425 3.931 20 5 FHBDRN CCOc1cc(C(=O)NCC[C@@H]2CCCC[C@H]2C)c([N+](=O)[O-])cc1OC ZINC000510587494 933249693 /nfs/dbraw/zinc/24/96/93/933249693.db2.gz HBXZZJUQRYXXQI-KGLIPLIRSA-N 0 0 364.442 3.948 20 5 FHBDRN Cc1cc(OCC(=O)N(CC(F)(F)F)C2CCCC2)ccc1[N+](=O)[O-] ZINC000430823582 933265749 /nfs/dbraw/zinc/26/57/49/933265749.db2.gz SXFNCZHMZHOHFO-UHFFFAOYSA-N 0 0 360.332 3.616 20 5 FHBDRN C[C@H](Nc1ccc(NC(=O)c2c([N+](=O)[O-])cnn2C)cc1)c1ccccc1 ZINC000165941515 933294204 /nfs/dbraw/zinc/29/42/04/933294204.db2.gz DYPCJPDUTQSEAH-ZDUSSCGKSA-N 0 0 365.393 3.754 20 5 FHBDRN COCCN(Cc1nc2cc([N+](=O)[O-])ccc2o1)[C@@H](C)c1ccccc1 ZINC000610581526 933309149 /nfs/dbraw/zinc/30/91/49/933309149.db2.gz PDTCYVNIFJTDPV-AWEZNQCLSA-N 0 0 355.394 3.946 20 5 FHBDRN C[C@H](C1CCCCC1)N(C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000510626821 933320716 /nfs/dbraw/zinc/32/07/16/933320716.db2.gz IMNLQYLIZHHEBX-LLVKDONJSA-N 0 0 360.863 3.838 20 5 FHBDRN Cc1ccc(CN(CCc2ccccn2)Cc2cccnc2)cc1[N+](=O)[O-] ZINC000430863274 933336322 /nfs/dbraw/zinc/33/63/22/933336322.db2.gz GYNVDLAUTMHWFO-UHFFFAOYSA-N 0 0 362.433 3.938 20 5 FHBDRN Cc1cc(C)cc([C@H]2NC(=O)N([C@H](C)c3cccc([N+](=O)[O-])c3)C2=O)c1 ZINC000430878173 933342986 /nfs/dbraw/zinc/34/29/86/933342986.db2.gz MCARNYQKCSEZMA-CXAGYDPISA-N 0 0 353.378 3.566 20 5 FHBDRN COc1ccc(NC(=O)c2cnn(-c3cccc(Cl)c3)c2)c([N+](=O)[O-])c1 ZINC000510651824 933363209 /nfs/dbraw/zinc/36/32/09/933363209.db2.gz VUJAQIMIRKQWME-UHFFFAOYSA-N 0 0 372.768 3.695 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)N1C[C@H](C(F)(F)F)[C@H](C(F)(F)F)C1 ZINC000610591592 933445599 /nfs/dbraw/zinc/44/55/99/933445599.db2.gz VFMYJTHAVAYVPD-AOOOYVTPSA-N 0 0 371.237 3.799 20 5 FHBDRN Cc1ccc([C@@H](C)NS(=O)(=O)c2ccc(F)c(Cl)c2)cc1[N+](=O)[O-] ZINC000610590395 933451016 /nfs/dbraw/zinc/45/10/16/933451016.db2.gz VZNGWFSJJMCAIA-SNVBAGLBSA-N 0 0 372.805 3.735 20 5 FHBDRN CCOc1cc(NCc2cccc(N3CCCC3=O)c2)ccc1[N+](=O)[O-] ZINC000178345390 933451136 /nfs/dbraw/zinc/45/11/36/933451136.db2.gz VXNYCHJEWQDTOF-UHFFFAOYSA-N 0 0 355.394 3.732 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1)N1C[C@H](C(F)(F)F)[C@@H](C(F)(F)F)C1 ZINC000610591572 933455797 /nfs/dbraw/zinc/45/57/97/933455797.db2.gz RSWKIUXHECAMSS-UWVGGRQHSA-N 0 0 371.237 3.799 20 5 FHBDRN Cc1ccc(F)cc1[C@H](C)OC(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 ZINC001266905799 933488954 /nfs/dbraw/zinc/48/89/54/933488954.db2.gz YHHBUVPDRDEKLW-LBPRGKRZSA-N 0 0 370.340 3.541 20 5 FHBDRN CC(C)CN(CC(C)C)C(=O)COc1ccc([N+](=O)[O-])c2ncccc12 ZINC000471887786 933492842 /nfs/dbraw/zinc/49/28/42/933492842.db2.gz RKPGXQOWNXJYDK-UHFFFAOYSA-N 0 0 359.426 3.662 20 5 FHBDRN O=[N+]([O-])c1cccc(OCCN2C[C@H](C(F)(F)F)[C@H](C(F)(F)F)C2)c1 ZINC000610604852 933514419 /nfs/dbraw/zinc/51/44/19/933514419.db2.gz PQEMNZLUYLFBRK-TXEJJXNPSA-N 0 0 372.265 3.646 20 5 FHBDRN CC1=C[C@H](C)CN(C(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C1 ZINC000430967107 933517173 /nfs/dbraw/zinc/51/71/73/933517173.db2.gz QTFODTNHOZTZNK-JTQLQIEISA-N 0 0 357.332 3.721 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1Br)N1C[C@@H]2CCCC[C@@H]2C1 ZINC000176090460 933534765 /nfs/dbraw/zinc/53/47/65/933534765.db2.gz VEEFMIJYWIXJIE-PHIMTYICSA-N 0 0 353.216 3.620 20 5 FHBDRN CC[C@H](OC1CCCCC1)C(=O)Nc1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000471895812 933543198 /nfs/dbraw/zinc/54/31/98/933543198.db2.gz AMMWGCIZEGJCEC-KRWDZBQOSA-N 0 0 357.410 3.631 20 5 FHBDRN CC(C)(C)OC(=O)c1cccc(C(=O)NCCc2ccccc2[N+](=O)[O-])c1 ZINC000548418058 933569379 /nfs/dbraw/zinc/56/93/79/933569379.db2.gz HKHGLLVXLKFSCP-UHFFFAOYSA-N 0 0 370.405 3.523 20 5 FHBDRN COC[C@H](NC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1)c1ccccc1 ZINC000178370268 933576558 /nfs/dbraw/zinc/57/65/58/933576558.db2.gz ZORZALHITNVXAT-IBGZPJMESA-N 0 0 369.421 3.657 20 5 FHBDRN Cn1cnc([N+](=O)[O-])c1NCCc1c[nH]c2cc(Cl)cc(Cl)c12 ZINC000477812568 933582486 /nfs/dbraw/zinc/58/24/86/933582486.db2.gz ZOFXQSPRNDKOPE-UHFFFAOYSA-N 0 0 354.197 3.771 20 5 FHBDRN Cc1ccccc1NC(=O)[C@@H](C)OC(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000003485119 933588300 /nfs/dbraw/zinc/58/83/00/933588300.db2.gz QYNMYBACSFMGOU-LLVKDONJSA-N 0 0 362.769 3.741 20 5 FHBDRN 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370.780 3.614 20 5 FHBDRN Cn1nc2c(c1C(=O)N(c1cccc([N+](=O)[O-])c1)C1CCCC1)CCCC2 ZINC000610893511 934568542 /nfs/dbraw/zinc/56/85/42/934568542.db2.gz XXIUFEBWEVIPSL-UHFFFAOYSA-N 0 0 368.437 3.797 20 5 FHBDRN C[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)COc1ccc([N+](=O)[O-])c2cccnc12 ZINC000610891507 934571051 /nfs/dbraw/zinc/57/10/51/934571051.db2.gz HYSPZSFGYBLQON-FMKPAKJESA-N 0 0 369.421 3.701 20 5 FHBDRN O=C(NCCc1ccc(F)cc1)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC000535836410 934574360 /nfs/dbraw/zinc/57/43/60/934574360.db2.gz VCXATWPBVAHHHW-UHFFFAOYSA-N 0 0 365.364 3.768 20 5 FHBDRN CC(C)[C@H]1CN(Cc2cc([N+](=O)[O-])ccc2Br)CCS1 ZINC001167497380 934586802 /nfs/dbraw/zinc/58/68/02/934586802.db2.gz XHXVAPOXIRBDGO-CQSZACIVSA-N 0 0 359.289 3.931 20 5 FHBDRN O=C(CCc1ccc(Br)cc1)NCc1cccc([N+](=O)[O-])c1 ZINC000176193865 934596409 /nfs/dbraw/zinc/59/64/09/934596409.db2.gz QCMXXOWDZVOISA-UHFFFAOYSA-N 0 0 363.211 3.606 20 5 FHBDRN O=C(c1ccn(-c2cccc([N+](=O)[O-])c2)n1)N(CC1CC1)c1ccccc1 ZINC000084242790 934605016 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3.862 20 5 FHBDRN O=[N+]([O-])c1ccc(CSc2nnc3ccccn32)c(C(F)(F)F)c1 ZINC000610946234 934640721 /nfs/dbraw/zinc/64/07/21/934640721.db2.gz UXHGBENMGGKYOC-UHFFFAOYSA-N 0 0 354.313 3.949 20 5 FHBDRN C[C@H]1COCCCN1C(=O)c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1 ZINC000610948807 934643975 /nfs/dbraw/zinc/64/39/75/934643975.db2.gz UHXTZRWYXFABLZ-AWEZNQCLSA-N 0 0 372.446 3.997 20 5 FHBDRN C[C@@H](COc1ccccc1)NC(=O)C1(c2ccc([N+](=O)[O-])cc2)CCC1 ZINC001125560902 934646154 /nfs/dbraw/zinc/64/61/54/934646154.db2.gz WCPRSQBSOFDEAL-HNNXBMFYSA-N 0 0 354.406 3.600 20 5 FHBDRN CNc1ccc(C(=O)Nc2ccc3c(cnn3C(F)F)c2)cc1[N+](=O)[O-] ZINC000610961875 934658310 /nfs/dbraw/zinc/65/83/10/934658310.db2.gz IQNOUWOSZYFXCP-UHFFFAOYSA-N 0 0 361.308 3.634 20 5 FHBDRN C[C@@H](CC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1)C(=O)c1ccccc1 ZINC000610961988 934660023 /nfs/dbraw/zinc/66/00/23/934660023.db2.gz IAJZTNMBRXKGSW-HNNXBMFYSA-N 0 0 366.417 3.995 20 5 FHBDRN Cc1ccc2[nH]c3c(c2c1)CN(C(=O)Cc1cccc([N+](=O)[O-])c1C)CC3 ZINC000610968554 934663349 /nfs/dbraw/zinc/66/33/49/934663349.db2.gz VYJVZGOPHQBVFN-UHFFFAOYSA-N 0 0 363.417 3.820 20 5 FHBDRN CC(=O)Nc1c(C)ccc(NC(=O)Cc2cccc([N+](=O)[O-])c2C)c1C ZINC000610968834 934663637 /nfs/dbraw/zinc/66/36/37/934663637.db2.gz BPTZJHVBVCFMPI-UHFFFAOYSA-N 0 0 355.394 3.660 20 5 FHBDRN Cc1c(CC(=O)N2CCS[C@H](c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000610970597 934666731 /nfs/dbraw/zinc/66/67/31/934666731.db2.gz HFJRUAONEJILFT-SFHVURJKSA-N 0 0 356.447 3.762 20 5 FHBDRN O=C(NC[C@H](O)c1ccc2ccccc2c1)c1cccc(Cl)c1[N+](=O)[O-] ZINC000176314050 934707798 /nfs/dbraw/zinc/70/77/98/934707798.db2.gz DTUHLWHDAQWXFM-KRWDZBQOSA-N 0 0 370.792 3.865 20 5 FHBDRN CNc1c(C(=O)Nc2cc(-c3ncc[nH]3)ccc2C)cccc1[N+](=O)[O-] ZINC000478009597 934732113 /nfs/dbraw/zinc/73/21/13/934732113.db2.gz JTVRBTOIVAMCRX-UHFFFAOYSA-N 0 0 351.366 3.587 20 5 FHBDRN O=[N+]([O-])c1ncccc1Oc1cccc(F)c1I ZINC000611001877 934747372 /nfs/dbraw/zinc/74/73/72/934747372.db2.gz UZFZWWHUJQDVJD-UHFFFAOYSA-N 0 0 360.082 3.526 20 5 FHBDRN CCc1nnc([C@H](C)Sc2nc3cc4ccccc4cc3c(=O)n2C)[nH]1 ZINC000657236882 934799393 /nfs/dbraw/zinc/79/93/93/934799393.db2.gz NUXVYBFFNAJJQO-NSHDSACASA-N 0 0 365.462 3.621 20 5 FHBDRN COCc1nc(C(=O)N(Cc2ccc([N+](=O)[O-])cc2)c2ccccc2)co1 ZINC000548520022 934807234 /nfs/dbraw/zinc/80/72/34/934807234.db2.gz FZUZBIJJCWXNQY-UHFFFAOYSA-N 0 0 367.361 3.576 20 5 FHBDRN CCCCn1ncc(C(=O)Nc2cc([N+](=O)[O-])c(F)cc2F)c1CC ZINC000277227959 934816342 /nfs/dbraw/zinc/81/63/42/934816342.db2.gz MUIMIDSUROLSLF-UHFFFAOYSA-N 0 0 352.341 3.684 20 5 FHBDRN COc1cccc2c1CC[C@@H]2NC(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000119466901 934825897 /nfs/dbraw/zinc/82/58/97/934825897.db2.gz NMWJMSHZVQLULA-PXAZEXFGSA-N 0 0 355.394 3.651 20 5 FHBDRN Cc1ccc(N2C[C@@H](C(=O)O[C@H](C)c3cccc([N+](=O)[O-])c3)CC2=O)cc1 ZINC000024077125 934827237 /nfs/dbraw/zinc/82/72/37/934827237.db2.gz ZKGVKARDMSGSGX-ZBFHGGJFSA-N 0 0 368.389 3.561 20 5 FHBDRN Cc1ccc(N2C[C@@H](C(=O)O[C@@H](C)c3cccc([N+](=O)[O-])c3)CC2=O)cc1 ZINC000024077128 934827267 /nfs/dbraw/zinc/82/72/67/934827267.db2.gz ZKGVKARDMSGSGX-HOCLYGCPSA-N 0 0 368.389 3.561 20 5 FHBDRN CCOc1cccc([C@H]2C[C@H]2NC(=O)c2c(Cl)cccc2[N+](=O)[O-])c1 ZINC000538334094 934830155 /nfs/dbraw/zinc/83/01/55/934830155.db2.gz QGIKTVNEABDKKP-UKRRQHHQSA-N 0 0 360.797 3.933 20 5 FHBDRN Cc1noc(-c2ccccc2)c1NC(=O)Cc1ccc([N+](=O)[O-])cc1F ZINC000472017016 934832505 /nfs/dbraw/zinc/83/25/05/934832505.db2.gz MLYXFSSFVMDLFL-UHFFFAOYSA-N 0 0 355.325 3.879 20 5 FHBDRN Cn1ccnc1[C@H](NCC(C)(C)[C@@H]1CCCCO1)c1cccc([N+](=O)[O-])c1 ZINC000611560718 934851114 /nfs/dbraw/zinc/85/11/14/934851114.db2.gz BMFAJZSPEPSWSK-ZWKOTPCHSA-N 0 0 372.469 3.603 20 5 FHBDRN C[C@@H](N(C)C(=O)c1cc(F)cc([N+](=O)[O-])c1Br)C1(C)CC1 ZINC000755021561 934851955 /nfs/dbraw/zinc/85/19/55/934851955.db2.gz NUBYPWICXJBYEK-MRVPVSSYSA-N 0 0 359.195 3.757 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2nc(Cc3cn4ccccc4n3)no2)c(Cl)c1 ZINC000545011179 934861555 /nfs/dbraw/zinc/86/15/55/934861555.db2.gz QGTYUUSRZCDNFP-UHFFFAOYSA-N 0 0 355.741 3.537 20 5 FHBDRN CCCN(C(=O)c1cc([N+](=O)[O-])ccc1C)[C@@H](C)C(=O)Nc1ccccc1 ZINC000119579740 934896683 /nfs/dbraw/zinc/89/66/83/934896683.db2.gz ZYYRRTONZNWCHL-HNNXBMFYSA-N 0 0 369.421 3.783 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)N2CC[C@H](CC(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000277293322 934897613 /nfs/dbraw/zinc/89/76/13/934897613.db2.gz BOSMMDFEQTXPSS-VXGBXAGGSA-N 0 0 359.348 3.948 20 5 FHBDRN O=C(c1cc(NCCCc2cccs2)ccc1[N+](=O)[O-])N1CCCC1 ZINC000538787501 934904513 /nfs/dbraw/zinc/90/45/13/934904513.db2.gz BNYJOCZDAIJOLQ-UHFFFAOYSA-N 0 0 359.451 3.937 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)Nc1ccc(-c2nncs2)cc1 ZINC000538824508 934919649 /nfs/dbraw/zinc/91/96/49/934919649.db2.gz OETQBOICUVZZAJ-UHFFFAOYSA-N 0 0 374.809 3.948 20 5 FHBDRN COCCOc1ccc(Nc2ccc([N+](=O)[O-])c(OC(F)F)c2)cc1 ZINC000538894449 934941005 /nfs/dbraw/zinc/94/10/05/934941005.db2.gz ZXBYEBSEVDRRQO-UHFFFAOYSA-N 0 0 354.309 3.965 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCc1c(F)cc(F)cc1F ZINC000511024201 934942027 /nfs/dbraw/zinc/94/20/27/934942027.db2.gz FMJIQCUJLUHMKQ-VIFPVBQESA-N 0 0 370.352 3.809 20 5 FHBDRN O=C(NCCCCOCc1ccccc1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000119627896 934944021 /nfs/dbraw/zinc/94/40/21/934944021.db2.gz HTBUGHZVNPCRPU-UHFFFAOYSA-N 0 0 362.813 3.975 20 5 FHBDRN O=C(N[C@H]1CCOC2(CCCC2)C1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000156829762 934954778 /nfs/dbraw/zinc/95/47/78/934954778.db2.gz YUFGSLISEFUGDS-INIZCTEOSA-N 0 0 373.453 3.761 20 5 FHBDRN O=C([C@@H]1C[C@@]12CCc1ccccc12)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000178503371 934959758 /nfs/dbraw/zinc/95/97/58/934959758.db2.gz AZVJEOLGFPCERO-RBBKRZOGSA-N 0 0 362.429 3.990 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1C[C@@H](C)C[C@H]1c1ccccc1 ZINC000511030499 934965818 /nfs/dbraw/zinc/96/58/18/934965818.db2.gz NLHGXBQENJNCHW-GUYCJALGSA-N 0 0 360.435 3.675 20 5 FHBDRN O=C(c1ccnc(OC2CCCCC2)c1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000538964079 934969810 /nfs/dbraw/zinc/96/98/10/934969810.db2.gz YKFNSGFGEXHMNZ-UHFFFAOYSA-N 0 0 367.405 3.904 20 5 FHBDRN C[C@@H]1c2cc(Cl)c(Cl)cc2CCN1CCn1cc([N+](=O)[O-])cn1 ZINC000538953854 934970363 /nfs/dbraw/zinc/97/03/63/934970363.db2.gz JHKFNQLBVAOSAL-SNVBAGLBSA-N 0 0 355.225 3.717 20 5 FHBDRN C[C@H](C1CC1)n1nccc1NC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000156933187 934978656 /nfs/dbraw/zinc/97/86/56/934978656.db2.gz AUBAYPGPCKGJFE-CYBMUJFWSA-N 0 0 369.425 3.959 20 5 FHBDRN CN(Cc1cnn(C)c1)Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000119660899 934979277 /nfs/dbraw/zinc/97/92/77/934979277.db2.gz NCEPNROKYGGWSQ-UHFFFAOYSA-N 0 0 360.801 3.874 20 5 FHBDRN C[C@@H]1C[C@@H](c2ccccc2)N(S(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000511033665 934990228 /nfs/dbraw/zinc/99/02/28/934990228.db2.gz QJZYBTXIIFYPRM-KDOFPFPSSA-N 0 0 360.435 3.508 20 5 FHBDRN CCCc1[nH]nc(C(=O)Nc2ccc(-c3csc(C)n3)cc2)c1[N+](=O)[O-] ZINC000110043010 935002239 /nfs/dbraw/zinc/00/22/39/935002239.db2.gz ASKYRHBBSKEZIU-UHFFFAOYSA-N 0 0 371.422 3.955 20 5 FHBDRN C[C@@H]1CC[C@@H](C(F)(F)F)CN1C(=O)c1c[nH]c2cc([N+](=O)[O-])ccc21 ZINC000611566904 935004426 /nfs/dbraw/zinc/00/44/26/935004426.db2.gz PPYSRLXWKIKHNA-NXEZZACHSA-N 0 0 355.316 3.879 20 5 FHBDRN CC1CCN(c2ccc(CNC(=O)Nc3ccc([N+](=O)[O-])cc3)cn2)CC1 ZINC000071927822 935017466 /nfs/dbraw/zinc/01/74/66/935017466.db2.gz UAMCZTVGKBQIIT-UHFFFAOYSA-N 0 0 369.425 3.548 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@](C)(CC)c1nccs1 ZINC000439907405 945072381 /nfs/dbraw/zinc/07/23/81/945072381.db2.gz AVSRFQHXYPPOJM-MRXNPFEDSA-N 0 0 364.427 3.897 20 5 FHBDRN CO[C@@H](C)c1nsc(Oc2ccc([N+](=O)[O-])cc2Br)n1 ZINC000509545366 945073306 /nfs/dbraw/zinc/07/33/06/945073306.db2.gz STQZRUFEYYSLIN-LURJTMIESA-N 0 0 360.189 3.709 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H]1CC(C)(C)Oc2cc(F)ccc21 ZINC000427094229 945073755 /nfs/dbraw/zinc/07/37/55/945073755.db2.gz SBVJWXGPUCPKIG-OAHLLOKOSA-N 0 0 374.368 3.775 20 5 FHBDRN CCOC(=O)[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1C)c1cccc(C)c1C ZINC000472111467 935061175 /nfs/dbraw/zinc/06/11/75/935061175.db2.gz WMTRVRQZQYDEIH-SFHVURJKSA-N 0 0 370.405 3.554 20 5 FHBDRN CC[C@H](c1ccncc1)N(CC)C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1C ZINC000157349625 935064983 /nfs/dbraw/zinc/06/49/83/935064983.db2.gz PPGNIRQOIUKZHI-MRXNPFEDSA-N 0 0 372.381 3.820 20 5 FHBDRN O=C(NCc1csc(CCc2ccccc2)n1)c1ccc([N+](=O)[O-])s1 ZINC000434554201 935081116 /nfs/dbraw/zinc/08/11/16/935081116.db2.gz BHNGIEDPMIJGLC-UHFFFAOYSA-N 0 0 373.459 3.828 20 5 FHBDRN Cc1c(Br)cc(C(=O)N(CC2CC2)CC2CC2)cc1[N+](=O)[O-] ZINC000124043312 945075312 /nfs/dbraw/zinc/07/53/12/945075312.db2.gz VZYZXHLFTVQIMY-UHFFFAOYSA-N 0 0 367.243 3.928 20 5 FHBDRN O=[N+]([O-])c1cc2cnn(Cc3nc(-c4ccccc4)no3)c2c(Cl)c1 ZINC000539273678 935127266 /nfs/dbraw/zinc/12/72/66/935127266.db2.gz XJNPPKFYJBRKLE-UHFFFAOYSA-N 0 0 355.741 3.696 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])c2cccnc12)N1CCS[C@H]2CCCC[C@H]21 ZINC000157675030 935135489 /nfs/dbraw/zinc/13/54/89/935135489.db2.gz MVDLGJOFLRJKQP-CVEARBPZSA-N 0 0 357.435 3.643 20 5 FHBDRN Cc1c(NC(=O)Nc2ccc(O[C@H]3CCOC3)cc2)cccc1[N+](=O)[O-] ZINC000157694415 935143438 /nfs/dbraw/zinc/14/34/38/935143438.db2.gz DMOUYICUEBCJJG-HNNXBMFYSA-N 0 0 357.366 3.715 20 5 FHBDRN C[C@H](Oc1ccccc1NC(=O)c1ccc([N+](=O)[O-])cn1)C(F)(F)F ZINC000582028164 935145692 /nfs/dbraw/zinc/14/56/92/935145692.db2.gz CBRVMGWSYNTLMS-VIFPVBQESA-N 0 0 355.272 3.572 20 5 FHBDRN CC1=C(c2ccco2)CN(C(=O)NCCc2cccc([N+](=O)[O-])c2)CC1 ZINC000511772953 945080193 /nfs/dbraw/zinc/08/01/93/945080193.db2.gz UUKJESRJJZGCTA-UHFFFAOYSA-N 0 0 355.394 3.619 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N(C)Cc1ccc(OC)cc1 ZINC000439897540 945080578 /nfs/dbraw/zinc/08/05/78/945080578.db2.gz HDPPXJIWULKSJD-UHFFFAOYSA-N 0 0 359.382 3.666 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)NCc1ccn(C2CCCC2)n1 ZINC000439899436 945081557 /nfs/dbraw/zinc/08/15/57/945081557.db2.gz KFQHIJGEKRKPJW-UHFFFAOYSA-N 0 0 373.413 3.627 20 5 FHBDRN CCNc1cnc(-c2noc(-c3cc4cc([N+](=O)[O-])ccc4s3)n2)cn1 ZINC000438831364 945081894 /nfs/dbraw/zinc/08/18/94/945081894.db2.gz BSGXRVYNPAIBKE-UHFFFAOYSA-N 0 0 368.378 3.748 20 5 FHBDRN CCO[C@H]1C[C@H](NC(=O)Cc2cccc([N+](=O)[O-])c2C)C12CCCCC2 ZINC000438826993 945082791 /nfs/dbraw/zinc/08/27/91/945082791.db2.gz HHKCENFNGKQIEU-ROUUACIJSA-N 0 0 360.454 3.690 20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])N(Cc1ccccc1)CC(F)F ZINC000437176523 945082941 /nfs/dbraw/zinc/08/29/41/945082941.db2.gz MWIDOOMTVTWYJB-UHFFFAOYSA-N 0 0 363.364 3.691 20 5 FHBDRN CC(C)NC(=O)c1ccc(NC(=O)C(C)(C)c2ccccc2[N+](=O)[O-])cc1 ZINC000431343625 935198438 /nfs/dbraw/zinc/19/84/38/935198438.db2.gz HAXYYPADZFKQKA-UHFFFAOYSA-N 0 0 369.421 3.649 20 5 FHBDRN CCOc1cccc([C@H]2C[C@H]2Nc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)c1 ZINC000539394088 935201306 /nfs/dbraw/zinc/20/13/06/935201306.db2.gz HPEBPZFABLYVPN-NVXWUHKLSA-N 0 0 367.405 3.846 20 5 FHBDRN CC[C@H](CNC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)c1ccccc1 ZINC000519075573 945083392 /nfs/dbraw/zinc/08/33/92/945083392.db2.gz RDZXDSGKUQIKDB-OAHLLOKOSA-N 0 0 364.405 3.704 20 5 FHBDRN CCc1ccnc(CNC(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)c1 ZINC000511777848 945083462 /nfs/dbraw/zinc/08/34/62/945083462.db2.gz OZYCCOZGNQTWDO-UHFFFAOYSA-N 0 0 353.300 3.501 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)Sc1cccc(F)c1 ZINC000084842820 935217351 /nfs/dbraw/zinc/21/73/51/935217351.db2.gz XWUQEQIGYFSREL-SNVBAGLBSA-N 0 0 350.371 3.862 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N1CCC[C@H]1Cc1ccccc1Cl ZINC000072021626 935217617 /nfs/dbraw/zinc/21/76/17/935217617.db2.gz PLFMYKOJCJCNLB-INIZCTEOSA-N 0 0 374.824 3.861 20 5 FHBDRN CCc1ccc(C(=O)N[C@H](C)c2nc3ccccc3n2C)cc1[N+](=O)[O-] ZINC000472155755 935229295 /nfs/dbraw/zinc/22/92/95/935229295.db2.gz JOKLJHGOJQIHEB-GFCCVEGCSA-N 0 0 352.394 3.535 20 5 FHBDRN CC[C@H]1C[C@H](C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)CCO1 ZINC000551330069 935250043 /nfs/dbraw/zinc/25/00/43/935250043.db2.gz YKUMYPCSMHDVCN-RNCFNFMXSA-N 0 0 357.204 3.501 20 5 FHBDRN CCO[C@H](CC(=O)Nc1cc(Br)cc([N+](=O)[O-])c1)C(C)C ZINC000551325379 935250567 /nfs/dbraw/zinc/25/05/67/935250567.db2.gz HVXWWTITSHEFGY-CYBMUJFWSA-N 0 0 359.220 3.747 20 5 FHBDRN Cc1nn(C)c2ncc(C(=O)Nc3ccc(C(C)(C)C)c([N+](=O)[O-])c3)cc12 ZINC000551358102 935265180 /nfs/dbraw/zinc/26/51/80/935265180.db2.gz RZJLMLKBOBUKBI-UHFFFAOYSA-N 0 0 367.409 3.735 20 5 FHBDRN COC(=O)c1cc(CNc2cc(Br)cc([N+](=O)[O-])c2)c(C)o1 ZINC000551360071 935265312 /nfs/dbraw/zinc/26/53/12/935265312.db2.gz GNCFNXKSUGMGFQ-UHFFFAOYSA-N 0 0 369.171 3.657 20 5 FHBDRN CC(=O)N[C@@H](C(=O)Nc1ccc(C(C)(C)C)c([N+](=O)[O-])c1)C1CCCC1 ZINC000551368019 935267258 /nfs/dbraw/zinc/26/72/58/935267258.db2.gz HXGBYXWQAMHQKG-QGZVFWFLSA-N 0 0 361.442 3.526 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1OCC(=O)Nc1ccccc1C(F)(F)F ZINC000072068149 935270821 /nfs/dbraw/zinc/27/08/21/935270821.db2.gz RCDDRCSHMJMSEW-UHFFFAOYSA-N 0 0 370.283 3.640 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)N1CC[C@](F)(c2cc(F)cc(F)c2)C1 ZINC000551388640 935274397 /nfs/dbraw/zinc/27/43/97/935274397.db2.gz KKPMFJQUFKSCCE-QGZVFWFLSA-N 0 0 365.311 3.976 20 5 FHBDRN COc1ccc(/C=C\C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1O ZINC000588503879 935278471 /nfs/dbraw/zinc/27/84/71/935278471.db2.gz PBDHYBVMHQTLOO-OYVUYXNMSA-N 0 0 356.378 3.508 20 5 FHBDRN C[C@H](C(=O)NCc1c(F)cc(F)cc1F)c1ccc([N+](=O)[O-])cc1F ZINC000511078185 935303562 /nfs/dbraw/zinc/30/35/62/935303562.db2.gz VNLNRACHUABXIX-QMMMGPOBSA-N 0 0 356.275 3.571 20 5 FHBDRN CCc1nc(C)c([C@H](C)N(C)C(=O)c2cc(F)ccc2[N+](=O)[O-])s1 ZINC000119875283 935311605 /nfs/dbraw/zinc/31/16/05/935311605.db2.gz BMUBTXXSWOGRMX-JTQLQIEISA-N 0 0 351.403 3.894 20 5 FHBDRN COc1ccc(CN[C@H](c2nc(C)cs2)C(F)(F)F)cc1[N+](=O)[O-] ZINC000451127526 935315886 /nfs/dbraw/zinc/31/58/86/935315886.db2.gz HDYYCLRMWILARN-GFCCVEGCSA-N 0 0 361.345 3.762 20 5 FHBDRN CCO[C@H]1C[C@@H](NC(=O)C(C)(C)c2ccccc2[N+](=O)[O-])C12CCCC2 ZINC000551598964 935317776 /nfs/dbraw/zinc/31/77/76/935317776.db2.gz JFPDKPZIGBEVNM-SJORKVTESA-N 0 0 360.454 3.726 20 5 FHBDRN CCN(CC(=O)Nc1ccc([N+](=O)[O-])cc1OC)c1ccc2[nH]ccc2c1 ZINC000472180270 935326516 /nfs/dbraw/zinc/32/65/16/935326516.db2.gz DKFKBEBWSQFAMA-UHFFFAOYSA-N 0 0 368.393 3.550 20 5 FHBDRN CN(C(=O)Cc1cc(F)ccc1Br)c1ccc([N+](=O)[O-])cc1 ZINC000119907675 935328282 /nfs/dbraw/zinc/32/82/82/935328282.db2.gz SPMSMASDWDWSMX-UHFFFAOYSA-N 0 0 367.174 3.702 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)F)cc1NCc1ccc2c(c1)CCCN2 ZINC000381373778 935330068 /nfs/dbraw/zinc/33/00/68/935330068.db2.gz NINVZFOUXJGXDL-UHFFFAOYSA-N 0 0 352.316 3.979 20 5 FHBDRN C[C@](NC(=O)COc1cccc([N+](=O)[O-])c1)(c1ccccc1)C(F)(F)F ZINC000539954134 935331199 /nfs/dbraw/zinc/33/11/99/935331199.db2.gz BZCSIPVAINFGAJ-INIZCTEOSA-N 0 0 368.311 3.568 20 5 FHBDRN COC1CCC(C)(CNC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000472182378 935336503 /nfs/dbraw/zinc/33/65/03/935336503.db2.gz MJIUHVOYXVHBCU-UHFFFAOYSA-N 0 0 369.849 3.643 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N[C@@H]1C[C@@H]1c1c(F)cccc1F ZINC000134983935 935343393 /nfs/dbraw/zinc/34/33/93/935343393.db2.gz PBYAEQLSHNRXAF-SUMWQHHRSA-N 0 0 371.343 3.569 20 5 FHBDRN CCCc1n[nH]c(C(=O)N[C@H](C)c2ccccc2OC(C)C)c1[N+](=O)[O-] ZINC000551816756 935352584 /nfs/dbraw/zinc/35/25/84/935352584.db2.gz UJJCPIYCTRGYJU-GFCCVEGCSA-N 0 0 360.414 3.549 20 5 FHBDRN CCc1c(C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])cnn1CCC(C)C ZINC000427109733 945095286 /nfs/dbraw/zinc/09/52/86/945095286.db2.gz WEXOZBQDNMLJJD-UHFFFAOYSA-N 0 0 360.414 3.661 20 5 FHBDRN Cc1ccc([C@H]2CN(C(=O)Nc3cc([N+](=O)[O-])c(C)cc3C)CCO2)o1 ZINC000119945204 935358127 /nfs/dbraw/zinc/35/81/27/935358127.db2.gz IZCKDVMZNPWSFZ-QGZVFWFLSA-N 0 0 359.382 3.718 20 5 FHBDRN O=[N+]([O-])c1cc2c(c(-c3nc(Cc4ccc(Cl)cc4)no3)c1)OCCO2 ZINC000551908827 935372487 /nfs/dbraw/zinc/37/24/87/935372487.db2.gz MZTFCAVRZAPCQM-UHFFFAOYSA-N 0 0 373.752 3.660 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N(C)Cc1ccc(OC(F)F)cc1 ZINC000511090111 935382639 /nfs/dbraw/zinc/38/26/39/935382639.db2.gz HYTYQXVOYKRQTG-UHFFFAOYSA-N 0 0 350.321 3.777 20 5 FHBDRN CNc1ccc([N+](=O)[O-])cc1NC(=O)c1cnc2onc(C(C)(C)C)c2c1 ZINC000582183346 935383710 /nfs/dbraw/zinc/38/37/10/935383710.db2.gz JUEPEMXVNWKWHO-UHFFFAOYSA-N 0 0 369.381 3.723 20 5 FHBDRN CC(C)(C)[C@H]1OCCC[C@H]1CNC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000118368948 935392356 /nfs/dbraw/zinc/39/23/56/935392356.db2.gz IRQMNMRJGXZVLR-NHYWBVRUSA-N 0 0 354.834 3.819 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1)CN(Cc1cnc(-c3ccccn3)s1)CCO2 ZINC000582213284 935407391 /nfs/dbraw/zinc/40/73/91/935407391.db2.gz YPHQMCKBBNEENY-UHFFFAOYSA-N 0 0 368.418 3.508 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1cccc([N+](=O)[O-])c1)N1CCc2c(F)ccc(F)c2C1 ZINC000934350507 935409318 /nfs/dbraw/zinc/40/93/18/935409318.db2.gz YTAWZUGHKUGTRU-LSDHHAIUSA-N 0 0 358.344 3.561 20 5 FHBDRN O=[N+]([O-])c1cccc(Cl)c1CN1CC[C@@H](n2cnc3c2CCCC3)C1 ZINC000432113157 945102024 /nfs/dbraw/zinc/10/20/24/945102024.db2.gz FTFUZLLFSHEHBL-CYBMUJFWSA-N 0 0 360.845 3.771 20 5 FHBDRN C[C@@H](c1ccncc1)N(C)C(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC000540561159 935487756 /nfs/dbraw/zinc/48/77/56/935487756.db2.gz XVUGTDIZRRCZPI-AWEZNQCLSA-N 0 0 362.389 3.885 20 5 FHBDRN C[C@@H](NC(=O)c1cc(F)ccc1[N+](=O)[O-])c1cccc(N2CCCC2)c1 ZINC000120049582 935493580 /nfs/dbraw/zinc/49/35/80/935493580.db2.gz GNDYCLQDPNSULC-CYBMUJFWSA-N 0 0 357.385 3.825 20 5 FHBDRN CC(C)N(CC(F)(F)F)C(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000120060908 935515439 /nfs/dbraw/zinc/51/54/39/935515439.db2.gz AAXZSPHKDDEOQG-SNVBAGLBSA-N 0 0 350.362 3.875 20 5 FHBDRN CO[C@H]1CCOc2c(NC(=O)[C@@H](C)c3cccc([N+](=O)[O-])c3)cccc21 ZINC000548728748 935540924 /nfs/dbraw/zinc/54/09/24/935540924.db2.gz VCHUHTWIBADKHB-SJCJKPOMSA-N 0 0 356.378 3.807 20 5 FHBDRN COCc1cccc(NC(=O)NCCCNc2ccc(C)cc2[N+](=O)[O-])c1 ZINC000158096058 935557193 /nfs/dbraw/zinc/55/71/93/935557193.db2.gz ONBXYSPHSKTYBC-UHFFFAOYSA-N 0 0 372.425 3.673 20 5 FHBDRN Cc1cc2sc(NC(=O)c3n[nH]c(C(C)C)c3[N+](=O)[O-])nc2cc1F ZINC000478075499 935565696 /nfs/dbraw/zinc/56/56/96/935565696.db2.gz HMSNBRYJLYOQSO-UHFFFAOYSA-N 0 0 363.374 3.751 20 5 FHBDRN Cc1ccccc1-n1ncc(C(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)c1N ZINC000466932889 945109167 /nfs/dbraw/zinc/10/91/67/945109167.db2.gz FDXUBCBFCJQZQE-UHFFFAOYSA-N 0 0 365.393 3.540 20 5 FHBDRN CC(C)CCSc1ccc(C(=O)N2CCC[C@@](C)(O)C2)cc1[N+](=O)[O-] ZINC000152409910 935571799 /nfs/dbraw/zinc/57/17/99/935571799.db2.gz KUFLFHHZJJEOOP-GOSISDBHSA-N 0 0 366.483 3.720 20 5 FHBDRN CC(C)(C(=O)NCCCc1ccccc1F)c1ccc([N+](=O)[O-])cc1F ZINC000478119058 935572114 /nfs/dbraw/zinc/57/21/14/935572114.db2.gz NIWUXQSMBHDEHP-UHFFFAOYSA-N 0 0 362.376 3.900 20 5 FHBDRN CCCCc1nnc(NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)s1 ZINC000023360081 935574494 /nfs/dbraw/zinc/57/44/94/935574494.db2.gz BMSPEPSDCJTHFB-UHFFFAOYSA-N 0 0 361.427 3.616 20 5 FHBDRN C[C@H]1CC[C@@H](CNC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])C1 ZINC000478112387 935574618 /nfs/dbraw/zinc/57/46/18/935574618.db2.gz OSZGUIHVHBEYBQ-WDEREUQCSA-N 0 0 360.332 3.702 20 5 FHBDRN Cc1c(C(=O)N[C@@H]2CCN(c3cccc(Cl)c3)C2)cccc1[N+](=O)[O-] ZINC000176314802 935584184 /nfs/dbraw/zinc/58/41/84/935584184.db2.gz HGIXGTILTNMFEK-CQSZACIVSA-N 0 0 359.813 3.565 20 5 FHBDRN COc1ccc(N(C(=O)c2ccc([N+](=O)[O-])c(OC)c2)C(C)C)cc1F ZINC000158133040 935588665 /nfs/dbraw/zinc/58/86/65/935588665.db2.gz CSWPXOJQYYWGAV-UHFFFAOYSA-N 0 0 362.357 3.806 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)N[C@H](C1CCCC1)C(F)(F)F ZINC000437982710 945111043 /nfs/dbraw/zinc/11/10/43/945111043.db2.gz FUOAGPPGXSQJRH-MRXNPFEDSA-N 0 0 369.343 3.787 20 5 FHBDRN C[C@H](NCc1ccc([N+](=O)[O-])cc1F)c1nc(-c2cccc(F)c2)no1 ZINC000478271539 935594937 /nfs/dbraw/zinc/59/49/37/935594937.db2.gz DSDGRJFICQJYFH-JTQLQIEISA-N 0 0 360.320 3.774 20 5 FHBDRN COC(=O)c1cnc(NCC2(c3ccccc3)CCCC2)c([N+](=O)[O-])c1 ZINC000478262578 935599535 /nfs/dbraw/zinc/59/95/35/935599535.db2.gz CNRCRSQARHQBBX-UHFFFAOYSA-N 0 0 355.394 3.700 20 5 FHBDRN C[C@@H](CC(=O)c1ccc(F)cc1)NC(=O)c1cccc(Cl)c1[N+](=O)[O-] ZINC000127520134 935599778 /nfs/dbraw/zinc/59/97/78/935599778.db2.gz BSPIXHAGUBLNFH-JTQLQIEISA-N 0 0 364.760 3.779 20 5 FHBDRN CC(C)(C(=O)N1CCOC2(C1)CCCCCC2)c1ccc([N+](=O)[O-])cc1 ZINC000478302614 935611823 /nfs/dbraw/zinc/61/18/23/935611823.db2.gz AIPTYIQSRDJKDY-UHFFFAOYSA-N 0 0 360.454 3.824 20 5 FHBDRN CCS[C@H]1CCCC[C@@H]1NC(=O)c1cc(OC)c(C)c([N+](=O)[O-])c1 ZINC000478490697 935636012 /nfs/dbraw/zinc/63/60/12/935636012.db2.gz QHRDYOIAUGGTSH-BBRMVZONSA-N 0 0 352.456 3.706 20 5 FHBDRN Cc1c(CNC(=O)NCC(C)(C)c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000478582637 935653904 /nfs/dbraw/zinc/65/39/04/935653904.db2.gz INOQDCIUZUAHED-UHFFFAOYSA-N 0 0 359.401 3.819 20 5 FHBDRN CCOc1cc(C(=O)Nc2cc(F)c(F)c(F)c2)c([N+](=O)[O-])cc1OC ZINC000127603869 935654250 /nfs/dbraw/zinc/65/42/50/935654250.db2.gz PHQXBMXIKQQWRS-UHFFFAOYSA-N 0 0 370.283 3.672 20 5 FHBDRN O=C(c1ccc(OC(F)F)c([N+](=O)[O-])c1)N(CC1CC1)CC1CCC1 ZINC000478589433 935656148 /nfs/dbraw/zinc/65/61/48/935656148.db2.gz UDWYTGSSDUMZDF-UHFFFAOYSA-N 0 0 354.353 3.849 20 5 FHBDRN C[C@@H](NC(=O)NC(C)(C)COCc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000507300258 945116010 /nfs/dbraw/zinc/11/60/10/945116010.db2.gz BLQJDPJTZRLQLC-OAHLLOKOSA-N 0 0 371.437 3.950 20 5 FHBDRN O=c1c([N+](=O)[O-])cc(Br)cn1Cc1cccc2ccccc21 ZINC000158270914 935676447 /nfs/dbraw/zinc/67/64/47/935676447.db2.gz OSIPQMDHIZRREA-UHFFFAOYSA-N 0 0 359.179 3.721 20 5 FHBDRN COc1cc(C(=O)Nc2cc(Cl)ccn2)c([N+](=O)[O-])cc1OC(F)F ZINC000511119159 935678701 /nfs/dbraw/zinc/67/87/01/935678701.db2.gz GOMBRDQIKZJXPP-UHFFFAOYSA-N 0 0 373.699 3.506 20 5 FHBDRN CCOc1cc(OCC(=O)N2c3ccccc3CC[C@H]2C)ccc1[N+](=O)[O-] ZINC000478731767 935687953 /nfs/dbraw/zinc/68/79/53/935687953.db2.gz JAAQVNFXAHIHQV-CQSZACIVSA-N 0 0 370.405 3.740 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2noc(CSCc3ccc4c(c3)OCO4)n2)cc1 ZINC000478738432 935693933 /nfs/dbraw/zinc/69/39/33/935693933.db2.gz YFFFCMUEAAJKQT-UHFFFAOYSA-N 0 0 371.374 3.807 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCCCC(C)(C)CO ZINC000507291258 945118469 /nfs/dbraw/zinc/11/84/69/945118469.db2.gz MHDXCQGOPPFGFF-UHFFFAOYSA-N 0 0 354.472 3.625 20 5 FHBDRN C[C@@H](NC(=O)C1(c2cccc(Cl)c2)CC(=O)C1)c1cccc([N+](=O)[O-])c1 ZINC000582455971 935732131 /nfs/dbraw/zinc/73/21/31/935732131.db2.gz UZKVNKJTVRQIFD-GFCCVEGCSA-N 0 0 372.808 3.726 20 5 FHBDRN O=C(NC[C@@H](O)C1CCCCC1)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000277616006 935732818 /nfs/dbraw/zinc/73/28/18/935732818.db2.gz BIHCQCJBTTVMQZ-LJQANCHMSA-N 0 0 364.445 3.765 20 5 FHBDRN O=C(N[C@H](c1ccccc1)c1cccnc1)c1cc([N+](=O)[O-])ccc1F ZINC000728491559 935741131 /nfs/dbraw/zinc/74/11/31/935741131.db2.gz MRGDOJRINHUSCI-GOSISDBHSA-N 0 0 351.337 3.648 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])s1)N1CC[C@H](OCCCc2ccccc2)C1 ZINC000176329037 935745151 /nfs/dbraw/zinc/74/51/51/935745151.db2.gz NMZLZQUTHULJNZ-HNNXBMFYSA-N 0 0 360.435 3.520 20 5 FHBDRN CCOc1ccc(N(CC)C(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)cc1 ZINC000478890120 935752252 /nfs/dbraw/zinc/75/22/52/935752252.db2.gz QYTFTCVMCRNLTN-UHFFFAOYSA-N 0 0 358.394 3.977 20 5 FHBDRN Cc1n[nH]c(C(=O)NCC2(Sc3ccc(C)cc3)CCCC2)c1[N+](=O)[O-] ZINC000431420347 935753493 /nfs/dbraw/zinc/75/34/93/935753493.db2.gz SWWBULAQSUHDTR-UHFFFAOYSA-N 0 0 374.466 3.770 20 5 FHBDRN CCN(Cc1cccc(F)c1)C(=O)COc1cc(C)c([N+](=O)[O-])cc1F ZINC000478910555 935753889 /nfs/dbraw/zinc/75/38/89/935753889.db2.gz POPNDOAXGOMEJR-UHFFFAOYSA-N 0 0 364.348 3.609 20 5 FHBDRN CC(=O)N1C=Cc2ccccc2[C@H]1CC(=O)Oc1cccc([N+](=O)[O-])c1C ZINC000051705128 935757540 /nfs/dbraw/zinc/75/75/40/935757540.db2.gz DGBYHOGAQBKFFP-GOSISDBHSA-N 0 0 366.373 3.773 20 5 FHBDRN CN(c1ccccc1)C1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2)CC1 ZINC000050076759 935763145 /nfs/dbraw/zinc/76/31/45/935763145.db2.gz HLBWYZGTLARIRY-UHFFFAOYSA-N 0 0 354.410 3.728 20 5 FHBDRN COC1(CNC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCCCC1 ZINC000478957842 935764029 /nfs/dbraw/zinc/76/40/29/935764029.db2.gz IFXRNRLUBKGWMQ-UHFFFAOYSA-N 0 0 360.332 3.693 20 5 FHBDRN CCOc1ccc(C(=O)CCC(=O)Nc2cccc([N+](=O)[O-])c2)cc1F ZINC000472228406 935773281 /nfs/dbraw/zinc/77/32/81/935773281.db2.gz DQHANNMGBAFHCX-UHFFFAOYSA-N 0 0 360.341 3.734 20 5 FHBDRN CCc1c(-c2nc(Cc3ccc([N+](=O)[O-])c(C)c3)no2)cnn1CC(C)C ZINC000545075270 935775076 /nfs/dbraw/zinc/77/50/76/935775076.db2.gz LLPPCTZXKWYUTQ-UHFFFAOYSA-N 0 0 369.425 3.959 20 5 FHBDRN C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1SC1CCCC1)c1cnn(C)c1 ZINC000158402473 935775962 /nfs/dbraw/zinc/77/59/62/935775962.db2.gz FFXLNNCSVRCYJT-LBPRGKRZSA-N 0 0 374.466 3.854 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])Nc1ccc(F)c(Br)c1 ZINC000437209782 945124462 /nfs/dbraw/zinc/12/44/62/945124462.db2.gz YIESAUOXSFJEOW-UHFFFAOYSA-N 0 0 368.162 3.547 20 5 FHBDRN NC(=O)c1ccnc(NCc2ccc(C3CCCCC3)cc2)c1[N+](=O)[O-] ZINC000431437107 935802749 /nfs/dbraw/zinc/80/27/49/935802749.db2.gz YNCSLYAELQAOHI-UHFFFAOYSA-N 0 0 354.410 3.749 20 5 FHBDRN CC(C)CCn1ccc(NC(=O)c2ccc([N+](=O)[O-])c3cccnc23)n1 ZINC000158456179 935813910 /nfs/dbraw/zinc/81/39/10/935813910.db2.gz SBJYHPGKNNFVNU-UHFFFAOYSA-N 0 0 353.382 3.638 20 5 FHBDRN CN(C(=O)CCCOc1ccc(F)cc1F)c1cccc([N+](=O)[O-])c1 ZINC000158472909 935819349 /nfs/dbraw/zinc/81/93/49/935819349.db2.gz WKTKJGJAEHLHEC-UHFFFAOYSA-N 0 0 350.321 3.695 20 5 FHBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)Nc1cccc2c1OCCO2 ZINC000158507434 935824433 /nfs/dbraw/zinc/82/44/33/935824433.db2.gz ULMLYDWMFLHRFG-UHFFFAOYSA-N 0 0 371.393 3.510 20 5 FHBDRN COc1ccc2ccc(C(=O)NCc3ccc(OC)c([N+](=O)[O-])c3)cc2c1 ZINC000431449982 935829973 /nfs/dbraw/zinc/82/99/73/935829973.db2.gz BVWDTQBGINPMGF-UHFFFAOYSA-N 0 0 366.373 3.695 20 5 FHBDRN CCC(=O)c1ccc(NCc2ccc(OC)c(OC)c2OC)c([N+](=O)[O-])c1 ZINC000479371908 935831616 /nfs/dbraw/zinc/83/16/16/935831616.db2.gz POTNWVLKEGKVIP-UHFFFAOYSA-N 0 0 374.393 3.825 20 5 FHBDRN COc1cccc(OCCCNC(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)c1 ZINC000127886781 935833197 /nfs/dbraw/zinc/83/31/97/935833197.db2.gz HUAYBSIIMVEWEU-UHFFFAOYSA-N 0 0 373.409 3.811 20 5 FHBDRN CCc1cc(NC(=O)c2cncnc2C(C)C)c2cc([N+](=O)[O-])ccc2n1 ZINC000277699336 935835201 /nfs/dbraw/zinc/83/52/01/935835201.db2.gz RFFORKIFAAZECG-UHFFFAOYSA-N 0 0 365.393 3.871 20 5 FHBDRN COc1ccc(OCc2cc(Cl)c3c(c2)OCCO3)cc1[N+](=O)[O-] ZINC000479409080 935837397 /nfs/dbraw/zinc/83/73/97/935837397.db2.gz OYCZEULOGBZWMA-UHFFFAOYSA-N 0 0 351.742 3.607 20 5 FHBDRN O=C(CCc1c(Cl)cccc1[N+](=O)[O-])Oc1ccc2nccnc2c1 ZINC001267147858 935846621 /nfs/dbraw/zinc/84/66/21/935846621.db2.gz HVSUCNGPCRMFDR-UHFFFAOYSA-N 0 0 357.753 3.730 20 5 FHBDRN C[C@@H](N[C@@H](CO)c1ccccc1OC(F)(F)F)c1ccc([N+](=O)[O-])cc1 ZINC000479511250 935847735 /nfs/dbraw/zinc/84/77/35/935847735.db2.gz IJCFECHCWCCGGO-ABAIWWIYSA-N 0 0 370.327 3.878 20 5 FHBDRN Cc1c(CNC(=O)Nc2nc(C(F)(F)F)cs2)cccc1[N+](=O)[O-] ZINC000479552448 935858485 /nfs/dbraw/zinc/85/84/85/935858485.db2.gz HIGJVMHBWJRHKL-UHFFFAOYSA-N 0 0 360.317 3.700 20 5 FHBDRN O=C(Nc1ccc2cc([N+](=O)[O-])ccc2n1)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000176697173 935869744 /nfs/dbraw/zinc/86/97/44/935869744.db2.gz UVAYJNJEAJUIEL-UHFFFAOYSA-N 0 0 372.724 3.957 20 5 FHBDRN COc1cc(C(=O)Nc2cccnc2N2CCCCC2)cc([N+](=O)[O-])c1C ZINC000479630529 935870223 /nfs/dbraw/zinc/87/02/23/935870223.db2.gz VRXOUHMUMFCUFG-UHFFFAOYSA-N 0 0 370.409 3.549 20 5 FHBDRN C[C@@H]1CN(S(=O)(=O)c2cc(Cl)ccc2[N+](=O)[O-])c2ccccc21 ZINC000158624721 935873305 /nfs/dbraw/zinc/87/33/05/935873305.db2.gz RFRGDASLPSAGQH-SNVBAGLBSA-N 0 0 352.799 3.561 20 5 FHBDRN CCS[C@@H](C)c1noc(CN(C)Cc2cccc([N+](=O)[O-])c2C)n1 ZINC000127996235 935880612 /nfs/dbraw/zinc/88/06/12/935880612.db2.gz BWQZUTFFHXHEDJ-LBPRGKRZSA-N 0 0 350.444 3.732 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@]1(C)CCCC[C@H]1O ZINC000507304159 945131231 /nfs/dbraw/zinc/13/12/31/945131231.db2.gz NYCCDKQULRUXLN-AEFFLSMTSA-N 0 0 366.483 3.768 20 5 FHBDRN O=C(Nc1ccc2cc([N+](=O)[O-])ccc2n1)c1ccc(Br)nc1 ZINC000176709068 935886529 /nfs/dbraw/zinc/88/65/29/935886529.db2.gz RHFAIRDOWJDPOX-UHFFFAOYSA-N 0 0 373.166 3.553 20 5 FHBDRN C[C@@H](NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)c1cccnc1 ZINC000050552769 935888579 /nfs/dbraw/zinc/88/85/79/935888579.db2.gz LYEAFCGGNSJSNX-LLVKDONJSA-N 0 0 354.391 3.604 20 5 FHBDRN CC1(C)CCC(NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)CC1 ZINC000128008401 935888997 /nfs/dbraw/zinc/88/89/97/935888997.db2.gz IGLZVCSMBYUNKV-UHFFFAOYSA-N 0 0 359.470 3.896 20 5 FHBDRN Cc1c(CNC(=O)NCc2ccccc2N(C)C(C)C)cccc1[N+](=O)[O-] ZINC000479781770 935889571 /nfs/dbraw/zinc/88/95/71/935889571.db2.gz UKRVQFIMTXIYJA-UHFFFAOYSA-N 0 0 370.453 3.747 20 5 FHBDRN COc1ccccc1CN(Cc1cccc([N+](=O)[O-])c1)C[C@H]1CCCO1 ZINC000051799266 935890100 /nfs/dbraw/zinc/89/01/00/935890100.db2.gz PRLKVPNJEZRBTM-LJQANCHMSA-N 0 0 356.422 3.785 20 5 FHBDRN CC1(c2ccccc2)CCN(C(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC000582629651 935892973 /nfs/dbraw/zinc/89/29/73/935892973.db2.gz KNPSHSVPMJUCNZ-UHFFFAOYSA-N 0 0 374.387 3.996 20 5 FHBDRN CC(C)(NC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)c1ccc(F)cc1 ZINC000728500003 935899742 /nfs/dbraw/zinc/89/97/42/935899742.db2.gz FVFVBODVXVZABE-UHFFFAOYSA-N 0 0 368.368 3.585 20 5 FHBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)N(CC(F)(F)F)C1CC1 ZINC000115803292 935903348 /nfs/dbraw/zinc/90/33/48/935903348.db2.gz DLHLBNGYJWVHKJ-UHFFFAOYSA-N 0 0 374.362 3.708 20 5 FHBDRN O=C(Nc1nc2cc(C(F)(F)F)ccc2[nH]1)c1ccc([N+](=O)[O-])s1 ZINC000178629793 935914524 /nfs/dbraw/zinc/91/45/24/935914524.db2.gz JCOOEURLMYUYOU-UHFFFAOYSA-N 0 0 356.285 3.804 20 5 FHBDRN C[C@@H](COc1ccccc1)C(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000472239507 935915355 /nfs/dbraw/zinc/91/53/55/935915355.db2.gz KUWVAOJMICZMNU-INIZCTEOSA-N 0 0 356.422 3.749 20 5 FHBDRN CC1(c2ccc(Cl)cc2)CCN(C(=O)c2ccc([N+](=O)[O-])cn2)CC1 ZINC000548749317 935920389 /nfs/dbraw/zinc/92/03/89/935920389.db2.gz UYVVBYMQJJFUFW-UHFFFAOYSA-N 0 0 359.813 3.837 20 5 FHBDRN Cc1cc(C(=O)Nc2ccc(-c3nccc(C)n3)cc2)c(N)c([N+](=O)[O-])c1 ZINC000176728200 935933569 /nfs/dbraw/zinc/93/35/69/935933569.db2.gz VFAYGSQGYFSQJT-UHFFFAOYSA-N 0 0 363.377 3.503 20 5 FHBDRN C[C@H](C(=O)NCC1CCN(c2ccccc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000548749770 935937541 /nfs/dbraw/zinc/93/75/41/935937541.db2.gz RYJHRJXUKJGZQY-INIZCTEOSA-N 0 0 367.449 3.731 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)N1CCC[C@]2(C1)OCc1ccccc12 ZINC000480012318 935940303 /nfs/dbraw/zinc/94/03/03/935940303.db2.gz LCOUMXSRCHATLO-LJQANCHMSA-N 0 0 353.378 3.648 20 5 FHBDRN O=[N+]([O-])c1ccc2ncnc(NCc3ccc(-c4cccnc4)cc3)c2c1 ZINC000611704642 935941535 /nfs/dbraw/zinc/94/15/35/935941535.db2.gz AAUCJVQPZSQKJQ-UHFFFAOYSA-N 0 0 357.373 3.634 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)Nc1ccc(F)cc1NC1CC1 ZINC000128092195 935943616 /nfs/dbraw/zinc/94/36/16/935943616.db2.gz AGJNWKWVJFXZLE-UHFFFAOYSA-N 0 0 368.368 3.971 20 5 FHBDRN O=[N+]([O-])c1ccc2ncnc(N3CC[C@@H](Cc4ccc(F)cc4)C3)c2c1 ZINC000611707782 935949826 /nfs/dbraw/zinc/94/98/26/935949826.db2.gz RCNOXHVYKPKDRC-AWEZNQCLSA-N 0 0 352.369 3.746 20 5 FHBDRN COc1cccc(C[C@H]2CCCN2c2ncnc3ccc([N+](=O)[O-])cc32)c1 ZINC000611709151 935957695 /nfs/dbraw/zinc/95/76/95/935957695.db2.gz NUUFDHORYMXOCY-OAHLLOKOSA-N 0 0 364.405 3.758 20 5 FHBDRN CCn1nc(C)c([N+](=O)[O-])c1N(C)Cc1cccc(OC(F)(F)F)c1 ZINC000480079101 935959679 /nfs/dbraw/zinc/95/96/79/935959679.db2.gz GGQQNQPCCWYLLV-UHFFFAOYSA-N 0 0 358.320 3.655 20 5 FHBDRN CCCCN(CC(F)(F)F)C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000158752404 935962774 /nfs/dbraw/zinc/96/27/74/935962774.db2.gz REHJJLQREMBPAD-UHFFFAOYSA-N 0 0 357.332 3.810 20 5 FHBDRN Cn1ncc([N+](=O)[O-])c1C(=O)NCc1ccccc1-c1ccc(Cl)cc1 ZINC000166133238 935971263 /nfs/dbraw/zinc/97/12/63/935971263.db2.gz AOBQPBNMQZHYSM-UHFFFAOYSA-N 0 0 370.796 3.579 20 5 FHBDRN C[C@H](Nc1ncnc2ccc([N+](=O)[O-])cc21)c1ccccc1-n1cccn1 ZINC000611710951 936002193 /nfs/dbraw/zinc/00/21/93/936002193.db2.gz JNSIPRPRPKSOAX-ZDUSSCGKSA-N 0 0 360.377 3.897 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)NCCCc2ccccc2)cc1SC ZINC000075465342 936007734 /nfs/dbraw/zinc/00/77/34/936007734.db2.gz DZWAJSUYGKQYBM-UHFFFAOYSA-N 0 0 360.435 3.688 20 5 FHBDRN Cc1ccc2c(c1)[C@H](NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)CC2 ZINC000611614915 936008715 /nfs/dbraw/zinc/00/87/15/936008715.db2.gz CSVIEYONQGSBDP-CQSZACIVSA-N 0 0 362.332 3.922 20 5 FHBDRN O=C(NCCCCc1ccccc1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000611613850 936008763 /nfs/dbraw/zinc/00/87/63/936008763.db2.gz MDVKVRPQGBSWSA-UHFFFAOYSA-N 0 0 364.348 3.949 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(N2CCC(OCc3ccccc3F)CC2)n1 ZINC000611617387 936010615 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FHBDRN Cc1c(NC(=O)C(=O)N[C@@H]2CCC[C@H]2CCC(C)C)cccc1[N+](=O)[O-] ZINC000070026195 938435922 /nfs/dbraw/zinc/43/59/22/938435922.db2.gz UWYODNVXOMDWPF-GOEBONIOSA-N 0 0 361.442 3.563 20 5 FHBDRN COc1ccc(CC[C@@H](C)NC(=O)CCNc2ccccc2[N+](=O)[O-])cc1 ZINC000519150236 945174269 /nfs/dbraw/zinc/17/42/69/945174269.db2.gz MQDFXACDAJLYAX-OAHLLOKOSA-N 0 0 371.437 3.543 20 5 FHBDRN COc1cc([C@H]2Nc3ccccc3C(=O)N2CC(C)C)ccc1[N+](=O)[O-] ZINC000536141016 938439014 /nfs/dbraw/zinc/43/90/14/938439014.db2.gz NHQATJJGXQSQRK-SFHVURJKSA-N 0 0 355.394 3.826 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1)CN(Cc1cscc1Br)CC2 ZINC000583839104 938443325 /nfs/dbraw/zinc/44/33/25/938443325.db2.gz UGKYFXSWKVWKFE-UHFFFAOYSA-N 0 0 353.241 3.977 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H]1CC[C@H]2CCCC[C@@H]2C1 ZINC000583842827 938446677 /nfs/dbraw/zinc/44/66/77/938446677.db2.gz NJIOVBNUJGSCAH-BZUAXINKSA-N 0 0 373.453 3.571 20 5 FHBDRN O=C(CC12CC3CC(CC(C3)C1)C2)N1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000583847808 938447851 /nfs/dbraw/zinc/44/78/51/938447851.db2.gz WAXBASXXPHZZGP-UHFFFAOYSA-N 0 0 372.469 3.561 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCN(c3ncc(Cl)cc3Cl)CC2)cc1 ZINC000247300912 938455742 /nfs/dbraw/zinc/45/57/42/938455742.db2.gz FAVBTKLNMIXSEV-UHFFFAOYSA-N 0 0 353.209 3.623 20 5 FHBDRN C[C@@H](CNC(=O)NCCc1cccc([N+](=O)[O-])c1)c1ccc(F)cc1F ZINC000536148433 938456292 /nfs/dbraw/zinc/45/62/92/938456292.db2.gz AQJUTSKUBPWEPE-LBPRGKRZSA-N 0 0 363.364 3.518 20 5 FHBDRN CC(C)[C@H]1N(C(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)CC12CCCC2 ZINC000458708032 938457412 /nfs/dbraw/zinc/45/74/12/938457412.db2.gz RXBYECCBRHRVSR-QGZVFWFLSA-N 0 0 371.441 3.581 20 5 FHBDRN C[C@@H](NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1)[C@@H](O)Cc1ccccc1 ZINC000178994301 938459316 /nfs/dbraw/zinc/45/93/16/938459316.db2.gz QDAFOWKJTRLNRO-WBMJQRKESA-N 0 0 370.430 3.531 20 5 FHBDRN CC(=O)NCC[C@@H]1CCCN(c2c(Cl)cc(Cl)cc2[N+](=O)[O-])C1 ZINC000583893815 938471149 /nfs/dbraw/zinc/47/11/49/938471149.db2.gz QIVDBUYBPRDPCZ-NSHDSACASA-N 0 0 360.241 3.644 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H](C)c1cccc(O)c1 ZINC000278514845 938495280 /nfs/dbraw/zinc/49/52/80/938495280.db2.gz QMJNEYRZXXXAID-AWEZNQCLSA-N 0 0 357.410 3.982 20 5 FHBDRN CCOc1cc(C(=O)N2CC(C3CCCCC3)C2)c([N+](=O)[O-])cc1OC ZINC000583954519 938501678 /nfs/dbraw/zinc/50/16/78/938501678.db2.gz JBXHGOKZJITAEZ-UHFFFAOYSA-N 0 0 362.426 3.654 20 5 FHBDRN O=C(c1ncsc1C(F)(F)F)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000278525144 938503067 /nfs/dbraw/zinc/50/30/67/938503067.db2.gz CNBOMDZRUSXXEQ-UHFFFAOYSA-N 0 0 357.313 3.663 20 5 FHBDRN CC1(C)[C@H](NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)[C@H]2CCCO[C@@H]21 ZINC000437250404 945180812 /nfs/dbraw/zinc/18/08/12/945180812.db2.gz XSXIQRBXZXERMP-MCIONIFRSA-N 0 0 372.343 3.547 20 5 FHBDRN Cc1cc(NCc2ccc(C(=O)N3CCCCC3)cc2)ncc1[N+](=O)[O-] ZINC000080597073 938512760 /nfs/dbraw/zinc/51/27/60/938512760.db2.gz SFYRITDWQDFYFW-UHFFFAOYSA-N 0 0 354.410 3.536 20 5 FHBDRN CCNC(=O)Nc1ccc(C)c(NC(=O)c2cc([N+](=O)[O-])c(C)s2)c1 ZINC000278537593 938517054 /nfs/dbraw/zinc/51/70/54/938517054.db2.gz SQDNHYAAFJVNAF-UHFFFAOYSA-N 0 0 362.411 3.667 20 5 FHBDRN CC(C)COc1ccc(NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)cn1 ZINC000536184939 938526138 /nfs/dbraw/zinc/52/61/38/938526138.db2.gz HVEKTONMTUTOLW-UHFFFAOYSA-N 0 0 368.393 3.687 20 5 FHBDRN Cc1cnn([C@H]2CCCN(c3cc(C)nc4c3cccc4[N+](=O)[O-])C2)c1 ZINC000302035225 938538861 /nfs/dbraw/zinc/53/88/61/938538861.db2.gz UHRJLRRGTGCCPI-HNNXBMFYSA-N 0 0 351.410 3.798 20 5 FHBDRN COc1cccc([C@@H](Nc2ccc(F)cc2[N+](=O)[O-])c2nccn2C)c1 ZINC000248151707 938544895 /nfs/dbraw/zinc/54/48/95/938544895.db2.gz WNYSRXXFVXIHLB-QGZVFWFLSA-N 0 0 356.357 3.678 20 5 FHBDRN Cc1cnc([C@@H](C)CNC(=O)c2c([N+](=O)[O-])cccc2C(F)(F)F)s1 ZINC000584081369 938589565 /nfs/dbraw/zinc/58/95/65/938589565.db2.gz SZPQOUNPKODMEA-QMMMGPOBSA-N 0 0 373.356 3.912 20 5 FHBDRN COc1ccc(OC(=O)/C=C\c2ccnc3ccccc23)cc1[N+](=O)[O-] ZINC000588587408 938597234 /nfs/dbraw/zinc/59/72/34/938597234.db2.gz JLWFDUPICKRKEU-TWGQIWQCSA-N 0 0 350.330 3.770 20 5 FHBDRN COc1cccc(OCC(=O)Nc2cc([N+](=O)[O-])c(Cl)cc2C)c1 ZINC000135498903 938599476 /nfs/dbraw/zinc/59/94/76/938599476.db2.gz AKHRGBFBVHYNGW-UHFFFAOYSA-N 0 0 350.758 3.583 20 5 FHBDRN Cc1ccc(-n2cc(C(=O)Nc3cc([N+](=O)[O-])c(Cl)cc3C)nn2)cc1 ZINC000135499189 938599710 /nfs/dbraw/zinc/59/97/10/938599710.db2.gz RGHGFEMUASWSPX-UHFFFAOYSA-N 0 0 371.784 3.698 20 5 FHBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)c1ccc(C(=O)N(C)C)cc1 ZINC000135494013 938599997 /nfs/dbraw/zinc/59/99/97/938599997.db2.gz JVJYOWWUGDUBTD-UHFFFAOYSA-N 0 0 361.785 3.511 20 5 FHBDRN CC[C@H](CCO)NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000179050711 938602311 /nfs/dbraw/zinc/60/23/11/938602311.db2.gz HGBAKVCVNXWOIQ-CYBMUJFWSA-N 0 0 360.435 3.637 20 5 FHBDRN CC(C)(C)C[C@@H](CO)NC(=O)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000278629855 938602567 /nfs/dbraw/zinc/60/25/67/938602567.db2.gz MIGMWHDGHSDVJQ-ZDUSSCGKSA-N 0 0 352.434 3.621 20 5 FHBDRN CN(Cc1csc2ccccc12)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000052805977 938605022 /nfs/dbraw/zinc/60/50/22/938605022.db2.gz OALGMAUFVXDHFZ-UHFFFAOYSA-N 0 0 355.419 3.540 20 5 FHBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)N1C[C@H](c2ccccc2)[C@H]2CCC[C@H]21 ZINC000584128972 938609423 /nfs/dbraw/zinc/60/94/23/938609423.db2.gz PRJSGZALHPSAME-BRWVUGGUSA-N 0 0 372.446 3.552 20 5 FHBDRN O=C(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)N1CCC[C@@H]1c1cccs1 ZINC000278640853 938610009 /nfs/dbraw/zinc/61/00/09/938610009.db2.gz IZMCFUQIFFXRLU-CQSZACIVSA-N 0 0 371.422 3.579 20 5 FHBDRN COC(=O)C(C)(C)[C@@H]1CCCN(c2ccc([N+](=O)[O-])c3cccnc32)C1 ZINC000092950199 945189902 /nfs/dbraw/zinc/18/99/02/945189902.db2.gz KLOWLHMRYWCAGL-CYBMUJFWSA-N 0 0 357.410 3.559 20 5 FHBDRN COc1cc(C(=O)N[C@@H]2C[C@H]2c2cccc(Cl)c2)cc([N+](=O)[O-])c1C ZINC000437264750 945189978 /nfs/dbraw/zinc/18/99/78/945189978.db2.gz GFCIYLSNFOUFQG-LSDHHAIUSA-N 0 0 360.797 3.851 20 5 FHBDRN Cc1ccc(C(=O)CCc2nc(Cc3ccccc3[N+](=O)[O-])no2)s1 ZINC000584138095 938615528 /nfs/dbraw/zinc/61/55/28/938615528.db2.gz SURFTTXAZREYDL-UHFFFAOYSA-N 0 0 357.391 3.754 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1cccc2[nH]c(=O)oc21 ZINC000584145037 938616859 /nfs/dbraw/zinc/61/68/59/938616859.db2.gz BPJRWNIBZVGPCG-UHFFFAOYSA-N 0 0 359.363 3.806 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCc1nc2ccccc2o1 ZINC000584206185 938637854 /nfs/dbraw/zinc/63/78/54/938637854.db2.gz IVJREURWZYLURP-OAHLLOKOSA-N 0 0 367.405 3.664 20 5 FHBDRN COc1c(C(=O)N[C@@H]2CCc3sc(Cl)cc32)cccc1[N+](=O)[O-] ZINC000584203513 938639588 /nfs/dbraw/zinc/63/95/88/938639588.db2.gz QXCSDKNOKOQXBM-SNVBAGLBSA-N 0 0 352.799 3.736 20 5 FHBDRN CC1(C)CCC[C@@H](C[NH2+][C@@H](Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C(=O)[O-])C1 ZINC000584268214 938662642 /nfs/dbraw/zinc/66/26/42/938662642.db2.gz QYHIGBRFAKCCBY-ACJLOTCBSA-N 0 0 373.453 3.878 20 5 FHBDRN Cn1cc(C(=O)Nc2ccc(Cl)cc2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000052927830 938663016 /nfs/dbraw/zinc/66/30/16/938663016.db2.gz IZQYIBCXBNMCJQ-UHFFFAOYSA-N 0 0 356.769 3.901 20 5 FHBDRN COc1ccc([C@@H]2CCCN2C(=O)c2cccc([N+](=O)[O-])c2C)c(OC)c1 ZINC000052955405 938676714 /nfs/dbraw/zinc/67/67/14/938676714.db2.gz MJUFKXZYHILRFL-SFHVURJKSA-N 0 0 370.405 3.898 20 5 FHBDRN CCC(CC)N(C(=O)Nc1cc(C(=O)OC)cc([N+](=O)[O-])c1C)C1CC1 ZINC000573181140 938678927 /nfs/dbraw/zinc/67/89/27/938678927.db2.gz YRAMKRUNWDDBAX-UHFFFAOYSA-N 0 0 363.414 3.875 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CC[C@H](C)[C@H](C)C2)cc1SC ZINC000248632989 938680519 /nfs/dbraw/zinc/68/05/19/938680519.db2.gz WZOJYYSVEACKQT-QJPTWQEYSA-N 0 0 352.456 3.880 20 5 FHBDRN CC(=O)c1ccc([N+](=O)[O-])cc1N1CCC(CO)(Cc2ccccc2)CC1 ZINC000584312797 938682118 /nfs/dbraw/zinc/68/21/18/938682118.db2.gz NKVMYPDIQGIRPB-UHFFFAOYSA-N 0 0 368.433 3.619 20 5 FHBDRN CO[C@@H](C)c1cccc(NC(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)c1 ZINC000584314225 938683631 /nfs/dbraw/zinc/68/36/31/938683631.db2.gz YYABGVZLMIYVQO-JTQLQIEISA-N 0 0 350.321 3.762 20 5 FHBDRN CO[C@H](C)c1cccc(NC(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)c1 ZINC000584314226 938683657 /nfs/dbraw/zinc/68/36/57/938683657.db2.gz YYABGVZLMIYVQO-SNVBAGLBSA-N 0 0 350.321 3.762 20 5 FHBDRN CCN(Cc1ccccc1NC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1)C(C)=O ZINC000573185290 938689808 /nfs/dbraw/zinc/68/98/08/938689808.db2.gz ASKVJRYPHAKEDD-AWEZNQCLSA-N 0 0 369.421 3.705 20 5 FHBDRN COc1ccc(NC(=O)N2CCc3cc(F)ccc3[C@H]2C)cc1[N+](=O)[O-] ZINC000611823404 938692856 /nfs/dbraw/zinc/69/28/56/938692856.db2.gz BFWIGLVCXPTTSL-LLVKDONJSA-N 0 0 359.357 3.894 20 5 FHBDRN Cc1ccc(Cl)c(NS(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)c1C ZINC000573192602 938694213 /nfs/dbraw/zinc/69/42/13/938694213.db2.gz UQUTWWJDWBLNNM-UHFFFAOYSA-N 0 0 354.815 3.974 20 5 FHBDRN COc1ccc(NC(=O)N2CCCO[C@@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000611823725 938695361 /nfs/dbraw/zinc/69/53/61/938695361.db2.gz WMPLMKPGKFPEJX-GOSISDBHSA-N 0 0 371.393 3.599 20 5 FHBDRN CCc1ccc([C@@H](CNc2cc(C(=O)[O-])ccc2[N+](=O)[O-])[NH+](C)C)cc1 ZINC000584353965 938696915 /nfs/dbraw/zinc/69/69/15/938696915.db2.gz WJLOAZSSIZJDDR-GOSISDBHSA-N 0 0 357.410 3.570 20 5 FHBDRN CCOc1cc(N2CCC([C@H](O)c3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000080767548 938702617 /nfs/dbraw/zinc/70/26/17/938702617.db2.gz SUHWDQDNLQSJKL-HXUWFJFHSA-N 0 0 356.422 3.944 20 5 FHBDRN COCCOc1ccc([C@H](C)Nc2cc(C)c([N+](=O)[O-])cn2)cc1OC ZINC000074741283 938707993 /nfs/dbraw/zinc/70/79/93/938707993.db2.gz LHYAYFDMJBMOLS-ZDUSSCGKSA-N 0 0 361.398 3.505 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CC[C@](F)(c2ccccc2)C1 ZINC000519187203 945201571 /nfs/dbraw/zinc/20/15/71/945201571.db2.gz QXZIFONLAJOIPG-HXUWFJFHSA-N 0 0 367.380 3.716 20 5 FHBDRN Cc1ccc(-c2noc(-c3cc(Br)cc([N+](=O)[O-])c3)n2)o1 ZINC000584389923 938798433 /nfs/dbraw/zinc/79/84/33/938798433.db2.gz LMGNAJCNLDRSCS-UHFFFAOYSA-N 0 0 350.128 3.976 20 5 FHBDRN C[C@@H](C(=O)NCCc1c[nH]c2ccc(F)cc12)c1cccc([N+](=O)[O-])c1 ZINC000516755626 945206153 /nfs/dbraw/zinc/20/61/53/945206153.db2.gz FQKMZWUXOICVDV-GFCCVEGCSA-N 0 0 355.369 3.678 20 5 FHBDRN Cc1cc([N+](=O)[O-])cnc1NCCNc1cccc(Br)c1 ZINC000302077611 938818346 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O=[N+]([O-])c1ccc(-c2nnc(N3CCC[C@H]4CCC[C@@H]43)n2C2CC2)cc1 ZINC000584416404 938843722 /nfs/dbraw/zinc/84/37/22/938843722.db2.gz CMRBJYMBKKWTJJ-DYVFJYSZSA-N 0 0 353.426 3.957 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N1CCC[C@@H]1Cc1ccc(F)cc1 ZINC000087160909 938848988 /nfs/dbraw/zinc/84/89/88/938848988.db2.gz QEACVJCWRRCRLZ-GOSISDBHSA-N 0 0 356.397 3.900 20 5 FHBDRN Cc1cc(Br)oc1C(=O)NC(C)(C)c1ccccc1[N+](=O)[O-] ZINC000584428372 938861319 /nfs/dbraw/zinc/86/13/19/938861319.db2.gz SXPKDCYZOZKOCU-UHFFFAOYSA-N 0 0 367.199 3.924 20 5 FHBDRN COc1ccc2nc(NC(=O)c3cc(F)c(F)cc3[N+](=O)[O-])sc2c1 ZINC000065668343 938862278 /nfs/dbraw/zinc/86/22/78/938862278.db2.gz IUAVQBMAYCOWHU-UHFFFAOYSA-N 0 0 365.317 3.744 20 5 FHBDRN Cc1cc(CNCc2ccc([N+](=O)[O-])cc2Cl)cc(N2CCCC2)n1 ZINC000289895455 938873485 /nfs/dbraw/zinc/87/34/85/938873485.db2.gz SXQRCKYMTXRWHH-UHFFFAOYSA-N 0 0 360.845 3.842 20 5 FHBDRN CN(C)c1nc(CNc2ccc([N+](=O)[O-])c(-c3ccccc3)n2)cs1 ZINC000090103761 938876078 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Cc1cccc([C@@H](NC(=O)COc2ccc([N+](=O)[O-])cc2)C(F)(F)F)c1 ZINC000511825860 945216538 /nfs/dbraw/zinc/21/65/38/945216538.db2.gz MHBDPICUSIBHQJ-MRXNPFEDSA-N 0 0 368.311 3.702 20 5 FHBDRN CCn1c(=O)c2cc3ccccc3cc2nc1SCCn1cccn1 ZINC000142316760 938948889 /nfs/dbraw/zinc/94/88/89/938948889.db2.gz NEDRVOSDVSIPQK-UHFFFAOYSA-N 0 0 350.447 3.558 20 5 FHBDRN CCC[C@@H](C)NC(=O)[C@@H]1CCCN(c2ccc3ncccc3c2[N+](=O)[O-])C1 ZINC000050933876 938954844 /nfs/dbraw/zinc/95/48/44/938954844.db2.gz GMPQATPZDBTXAX-HUUCEWRRSA-N 0 0 370.453 3.664 20 5 FHBDRN CC(F)(F)c1ccc(CNc2cccc(S(C)(=O)=O)c2[N+](=O)[O-])cc1 ZINC000432156560 945218761 /nfs/dbraw/zinc/21/87/61/945218761.db2.gz PDDXOUMVOJHSDW-UHFFFAOYSA-N 0 0 370.377 3.722 20 5 FHBDRN O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)Nc1nc(-c2ccc[nH]2)cs1 ZINC000573281292 938966563 /nfs/dbraw/zinc/96/65/63/938966563.db2.gz MJHHKSVICNNTBF-UHFFFAOYSA-N 0 0 364.333 3.506 20 5 FHBDRN C[C@@H](c1ccc(Cl)cc1)N1CCN(C(=O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000050964763 938967064 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CCOc1ccc(NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)cc1OC ZINC000179344092 939084236 /nfs/dbraw/zinc/08/42/36/939084236.db2.gz UBYFOKKKNXCIPT-UHFFFAOYSA-N 0 0 369.377 3.665 20 5 FHBDRN O=C(N[C@@H]1[C@H]2CCO[C@@H]2C12CCCC2)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000179350975 939094575 /nfs/dbraw/zinc/09/45/75/939094575.db2.gz QRGZMMQYGKSDJN-XYPHTWIQSA-N 0 0 372.446 3.887 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)Nc1ccc(C(F)(F)F)nc1 ZINC000179363267 939097377 /nfs/dbraw/zinc/09/73/77/939097377.db2.gz KWQJOHOFVVPFDA-UHFFFAOYSA-N 0 0 354.288 3.673 20 5 FHBDRN O=C(CCn1cc([N+](=O)[O-])cn1)Nc1ccccc1SC1CCCC1 ZINC000065777629 939106407 /nfs/dbraw/zinc/10/64/07/939106407.db2.gz XATLVFVGCLGKAD-UHFFFAOYSA-N 0 0 360.439 3.855 20 5 FHBDRN O=C(c1c(Cl)cccc1[N+](=O)[O-])N1CCO[C@H](c2ccc(F)cc2)C1 ZINC000179458023 939162892 /nfs/dbraw/zinc/16/28/92/939162892.db2.gz LMOGSIJSCWRMEA-HNNXBMFYSA-N 0 0 364.760 3.601 20 5 FHBDRN CCC[C@@H](NS(=O)(=O)CCc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000179494764 939170458 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/nfs/dbraw/zinc/24/23/46/945242346.db2.gz LVMMJQJIYTTZPU-UHFFFAOYSA-N 0 0 364.398 3.729 20 5 FHBDRN C[C@@H](N(C)S(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-])C1(C)CC1 ZINC000437308696 945243254 /nfs/dbraw/zinc/24/32/54/945243254.db2.gz SHRDQOPZLKKADY-MRVPVSSYSA-N 0 0 367.254 3.711 20 5 FHBDRN O=[N+]([O-])c1cccc2c(N3CC[C@@H](n4ncc5ccccc54)C3)ccnc21 ZINC000432168132 945246067 /nfs/dbraw/zinc/24/60/67/945246067.db2.gz ZPRZBZVQJIFKJF-OAHLLOKOSA-N 0 0 359.389 3.944 20 5 FHBDRN COCCOc1ccc(NC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000047505929 945250327 /nfs/dbraw/zinc/25/03/27/945250327.db2.gz PNARLCJAYUARAE-ZDUSSCGKSA-N 0 0 359.382 3.503 20 5 FHBDRN CC1(C)CN(C(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])[C@@H]1C1CC1 ZINC000427283184 945250682 /nfs/dbraw/zinc/25/06/82/945250682.db2.gz WWYXOBSCVFTHFY-MRXNPFEDSA-N 0 0 352.818 3.664 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CCc3c2c(F)ccc3F)c(Br)c1 ZINC000432172336 945252319 /nfs/dbraw/zinc/25/23/19/945252319.db2.gz MOCSGKKGXFDVNX-UHFFFAOYSA-N 0 0 356.126 3.725 20 5 FHBDRN CC(C)c1nn(C)cc1-c1noc(/C=C/c2ccc(F)cc2[N+](=O)[O-])n1 ZINC000426241195 945256640 /nfs/dbraw/zinc/25/66/40/945256640.db2.gz CCCMNKZSIMLLIA-FNORWQNLSA-N 0 0 357.345 3.811 20 5 FHBDRN CCCNC(=O)c1cccc(NC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000047519414 945259622 /nfs/dbraw/zinc/25/96/22/945259622.db2.gz WHKIIHQZJAFPBF-ZDUSSCGKSA-N 0 0 370.409 3.617 20 5 FHBDRN CC(C)c1ccc(C(=O)Nc2cccc([C@H]3CNC(=O)C3)c2)cc1[N+](=O)[O-] ZINC000438961354 945268023 /nfs/dbraw/zinc/26/80/23/945268023.db2.gz JLWMNYHSAUVBJB-OAHLLOKOSA-N 0 0 367.405 3.574 20 5 FHBDRN Cc1cccc(C(=O)Nc2ccc([C@H](C)N3CCOCC3)cc2)c1[N+](=O)[O-] ZINC000106405428 945271621 /nfs/dbraw/zinc/27/16/21/945271621.db2.gz DMJCJHPMFGVKLG-HNNXBMFYSA-N 0 0 369.421 3.549 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)ccc1CN1CCC[C@H](c2nnc(C3CC3)[nH]2)C1 ZINC000179518462 939876457 /nfs/dbraw/zinc/87/64/57/939876457.db2.gz YTSSKPGYOMZYJG-ZDUSSCGKSA-N 0 0 361.833 3.623 20 5 FHBDRN O=[N+]([O-])c1ccc(CN(Cc2cncc(Br)c2)C2CC2)cc1 ZINC000179521663 939877193 /nfs/dbraw/zinc/87/71/93/939877193.db2.gz BLNWZFRTSJWBCB-UHFFFAOYSA-N 0 0 362.227 3.917 20 5 FHBDRN CCc1noc(CC)c1CNc1ccc(/C=C\C(=O)OC)cc1[N+](=O)[O-] ZINC000255830339 939885001 /nfs/dbraw/zinc/88/50/01/939885001.db2.gz OFKXEFHNFCOCPU-CLFYSBASSA-N 0 0 359.382 3.506 20 5 FHBDRN CSc1ccc(C(=O)NCCc2nc3c(cccc3C)o2)cc1[N+](=O)[O-] ZINC000437370582 945278972 /nfs/dbraw/zinc/27/89/72/945278972.db2.gz HMANZKGBPLRUAM-UHFFFAOYSA-N 0 0 371.418 3.739 20 5 FHBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(N2CCCC3(CCCCC3)C2)s1 ZINC000179591907 939892546 /nfs/dbraw/zinc/89/25/46/939892546.db2.gz CZPZTFGSEGEZQK-UHFFFAOYSA-N 0 0 358.485 3.611 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])c(Cl)c1)N1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000179623322 939899745 /nfs/dbraw/zinc/89/97/45/939899745.db2.gz QBCBVAMPRMPJSB-MRXNPFEDSA-N 0 0 364.760 3.601 20 5 FHBDRN CCc1ccc(-c2noc([C@H](C)NC(=O)c3ccccc3[N+](=O)[O-])n2)cc1 ZINC000472401570 939901822 /nfs/dbraw/zinc/90/18/22/939901822.db2.gz GFCPYTDFOFQYCO-LBPRGKRZSA-N 0 0 366.377 3.698 20 5 FHBDRN CCc1ccc(-c2noc([C@@H](C)NC(=O)c3ccccc3[N+](=O)[O-])n2)cc1 ZINC000472401569 939901855 /nfs/dbraw/zinc/90/18/55/939901855.db2.gz GFCPYTDFOFQYCO-GFCCVEGCSA-N 0 0 366.377 3.698 20 5 FHBDRN O=C(c1ccc(NC2CC2)c([N+](=O)[O-])c1)N1CC[C@H](c2ccccc2F)C1 ZINC000410283958 939909873 /nfs/dbraw/zinc/90/98/73/939909873.db2.gz HWLKBLDKSGBDGS-AWEZNQCLSA-N 0 0 369.396 3.938 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)N1CC[C@H](c2ccccc2F)C1 ZINC000410285102 939910036 /nfs/dbraw/zinc/91/00/36/939910036.db2.gz CUNGTBZTBXCSBO-HNNXBMFYSA-N 0 0 367.380 3.705 20 5 FHBDRN O=C(N[C@H]1C[C@@H]1c1cccc(F)c1)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000179670576 939913163 /nfs/dbraw/zinc/91/31/63/939913163.db2.gz FHOCICXJJGMCCY-CVEARBPZSA-N 0 0 351.337 3.568 20 5 FHBDRN COc1ccccc1OC[C@@H](C)CNC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000136302885 939915119 /nfs/dbraw/zinc/91/51/19/939915119.db2.gz JBWBVYIWYBLTMY-ZDUSSCGKSA-N 0 0 373.409 3.748 20 5 FHBDRN Cc1onc(C2CC2)c1C(=O)N1CCS[C@@H]1c1ccc([N+](=O)[O-])cc1 ZINC000410530907 939919112 /nfs/dbraw/zinc/91/91/12/939919112.db2.gz PYAMDYRALDLEJX-QGZVFWFLSA-N 0 0 359.407 3.656 20 5 FHBDRN Cc1c(Br)cc(C(=O)N2CC[C@H]3CCC[C@H]32)cc1[N+](=O)[O-] ZINC000614644623 939919664 /nfs/dbraw/zinc/91/96/64/939919664.db2.gz CFOJAQZEOUQODM-ZWNOBZJWSA-N 0 0 353.216 3.680 20 5 FHBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)c1scnc1C(F)(F)F ZINC000410502653 939922419 /nfs/dbraw/zinc/92/24/19/939922419.db2.gz IWXKGWJENHTKQS-UHFFFAOYSA-N 0 0 373.356 3.823 20 5 FHBDRN CN(Cc1ccc(C(F)(F)F)cc1)C(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000034096092 939922744 /nfs/dbraw/zinc/92/27/44/939922744.db2.gz YNFCCACCGSWUSU-UHFFFAOYSA-N 0 0 368.311 3.651 20 5 FHBDRN COC1CN(C(=O)c2ccc(Sc3ccc(C)cc3)c([N+](=O)[O-])c2)C1 ZINC000511334109 939923363 /nfs/dbraw/zinc/92/33/63/939923363.db2.gz POZFHGHUDLFLGS-UHFFFAOYSA-N 0 0 358.419 3.525 20 5 FHBDRN COC[C@H](NC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)c1ccc(F)c(F)c1 ZINC000179715593 939926615 /nfs/dbraw/zinc/92/66/15/939926615.db2.gz MCUYAXIMVPXDCF-AWEZNQCLSA-N 0 0 370.739 3.644 20 5 FHBDRN CN(Cc1nc[nH]n1)Cc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000179790227 939935288 /nfs/dbraw/zinc/93/52/88/939935288.db2.gz PDZZYMXONFFFFT-UHFFFAOYSA-N 0 0 373.800 3.791 20 5 FHBDRN COc1ccccc1OC[C@@H](C)CNC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000136356000 939937479 /nfs/dbraw/zinc/93/74/79/939937479.db2.gz MCGKWQXTZLSHHA-ZDUSSCGKSA-N 0 0 373.409 3.748 20 5 FHBDRN CCO[C@@H]1C[C@H](NC(=O)c2cc(F)ccc2[N+](=O)[O-])C12CCCCC2 ZINC000177133091 939949415 /nfs/dbraw/zinc/94/94/15/939949415.db2.gz VXGNJQKFGPUIPX-JKSUJKDBSA-N 0 0 350.390 3.592 20 5 FHBDRN Cc1c(Cc2noc(C[C@H]3OCCc4ccsc43)n2)cccc1[N+](=O)[O-] ZINC000364472237 939950149 /nfs/dbraw/zinc/95/01/49/939950149.db2.gz AUWXKHQCNAMXAY-OAHLLOKOSA-N 0 0 371.418 3.795 20 5 FHBDRN CC(C)C[C@H]1OCCC[C@@H]1NC(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000410735924 939950909 /nfs/dbraw/zinc/95/09/09/939950909.db2.gz KMFVCNDYPMQKPH-LSDHHAIUSA-N 0 0 374.359 3.937 20 5 FHBDRN CCC[C@@H](OC)C(=O)Nc1ccc(OCc2ccccc2)cc1[N+](=O)[O-] ZINC000410738267 939950953 /nfs/dbraw/zinc/95/09/53/939950953.db2.gz DLCFCVULBSTJJN-GOSISDBHSA-N 0 0 358.394 3.927 20 5 FHBDRN CCc1nccn1C[C@H]1CCCN1C(=O)Nc1cc(C)c([N+](=O)[O-])cc1C ZINC000364539655 939961203 /nfs/dbraw/zinc/96/12/03/939961203.db2.gz QBAFGPSLTRLUPO-OAHLLOKOSA-N 0 0 371.441 3.667 20 5 FHBDRN Cc1ccc([C@@H]2CCN(c3nnc(-c4ccc([N+](=O)[O-])cc4)n3C)C2)cc1 ZINC000548912996 939980469 /nfs/dbraw/zinc/98/04/69/939980469.db2.gz ANEVKEITNQQKGR-QGZVFWFLSA-N 0 0 363.421 3.693 20 5 FHBDRN Cc1cccc(C(=O)N2CCC(Nc3ccccc3F)CC2)c1[N+](=O)[O-] ZINC000364699001 939985402 /nfs/dbraw/zinc/98/54/02/939985402.db2.gz RNDRYCGHOMXBJL-UHFFFAOYSA-N 0 0 357.385 3.759 20 5 FHBDRN CCC[C@@H](NC(=O)c1cc(OC)c(OCC)cc1[N+](=O)[O-])C(C)(C)C ZINC000411034283 939985981 /nfs/dbraw/zinc/98/59/81/939985981.db2.gz LLSOBOICJMMRAQ-MRXNPFEDSA-N 0 0 352.431 3.947 20 5 FHBDRN CCN1CCN(C(=O)c2ccc([N+](=O)[O-])c3cccnc23)c2ccccc21 ZINC000179847011 939993928 /nfs/dbraw/zinc/99/39/28/939993928.db2.gz OWYJZHBKPXXSIX-UHFFFAOYSA-N 0 0 362.389 3.630 20 5 FHBDRN CCCCc1cnc(NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])nc1 ZINC000411073390 939997848 /nfs/dbraw/zinc/99/78/48/939997848.db2.gz PBRCCAWSXOHLKB-UHFFFAOYSA-N 0 0 368.315 3.999 20 5 FHBDRN COc1cc(C(=O)N[C@]2(C)CCCC[C@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000411101175 939998285 /nfs/dbraw/zinc/99/82/85/939998285.db2.gz WLVJXGYOCDZIQC-BMLIUANNSA-N 0 0 372.368 3.903 20 5 FHBDRN O=C(c1cc(C(F)(F)F)ccc1[N+](=O)[O-])N1CC2CC1(C(F)(F)F)C2 ZINC000411118993 939999770 /nfs/dbraw/zinc/99/97/70/939999770.db2.gz WAMVNYHMOQVNTC-UHFFFAOYSA-N 0 0 368.233 3.781 20 5 FHBDRN CCO[C@@H]1C[C@@H](N(C)C(=O)c2cccc(OC)c2[N+](=O)[O-])C1(CC)CC ZINC000435807299 940005172 /nfs/dbraw/zinc/00/51/72/940005172.db2.gz IQVLWFTZHPETKO-HZPDHXFCSA-N 0 0 364.442 3.659 20 5 FHBDRN CCC[C@@H](NC(=O)Cc1c(F)c(OC)ccc1[N+](=O)[O-])c1ccccc1 ZINC000411179955 940007236 /nfs/dbraw/zinc/00/72/36/940007236.db2.gz LULJCSPBSLROIP-OAHLLOKOSA-N 0 0 360.385 3.943 20 5 FHBDRN COc1ccccc1CN(C)C(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1 ZINC000411169786 940010701 /nfs/dbraw/zinc/01/07/01/940010701.db2.gz SHWTUYKYZNWKQL-UHFFFAOYSA-N 0 0 358.394 3.663 20 5 FHBDRN Cc1nnc(-c2ccccc2NC(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)o1 ZINC000364858694 940012171 /nfs/dbraw/zinc/01/21/71/940012171.db2.gz HTJPGIUQOAVHIN-UHFFFAOYSA-N 0 0 374.303 3.684 20 5 FHBDRN O=C(NCCOc1ccc(Cl)cc1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000411199830 940012854 /nfs/dbraw/zinc/01/28/54/940012854.db2.gz ZCIPXAAFUXEUPZ-DLBZAZTESA-N 0 0 360.797 3.547 20 5 FHBDRN Cc1cc(F)c(C(=O)Nc2cc(-c3cccc([N+](=O)[O-])c3)[nH]n2)cc1F ZINC000136524552 940017487 /nfs/dbraw/zinc/01/74/87/940017487.db2.gz PVVIVRVJCXHCLW-UHFFFAOYSA-N 0 0 358.304 3.824 20 5 FHBDRN C[C@H]1C[C@@H](c2ccsc2)CN1c1sc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000364905920 940019480 /nfs/dbraw/zinc/01/94/80/940019480.db2.gz QQGKPNARHDGJJK-GXSJLCMTSA-N 0 0 372.493 3.504 20 5 FHBDRN CC(C)[C@H](CNC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)Nc1ccccc1 ZINC000411252848 940022927 /nfs/dbraw/zinc/02/29/27/940022927.db2.gz FPTDIRGRLUJBIJ-ZCNNSNEGSA-N 0 0 367.449 3.951 20 5 FHBDRN Nc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC[C@@H]1c1nc2ccccc2o1 ZINC000364932322 940025034 /nfs/dbraw/zinc/02/50/34/940025034.db2.gz HWWILYVSXGSORD-MRXNPFEDSA-N 0 0 366.377 3.686 20 5 FHBDRN CCC[C@]1(C)CCCN(C(=O)c2cc(C(=O)OCC)cc([N+](=O)[O-])c2)C1 ZINC000437363123 945290217 /nfs/dbraw/zinc/29/02/17/945290217.db2.gz DJTRCYCDBFENMZ-LJQANCHMSA-N 0 0 362.426 3.814 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CCC[C@H]2c2cccnc2)ccc1[N+](=O)[O-] ZINC000411318500 940026507 /nfs/dbraw/zinc/02/65/07/940026507.db2.gz CJXLXPNWQPXUFF-INIZCTEOSA-N 0 0 355.394 3.754 20 5 FHBDRN O=C(N[C@@H]1C[C@H]1c1ccc(Cl)c(F)c1)c1cc(F)cc([N+](=O)[O-])c1 ZINC000437364182 945291060 /nfs/dbraw/zinc/29/10/60/945291060.db2.gz LBXLGONIXDOQGH-SWLSCSKDSA-N 0 0 352.724 3.812 20 5 FHBDRN Cc1c(Br)c(=O)n(Cc2ccccc2Cl)cc1[N+](=O)[O-] ZINC000544079315 940032371 /nfs/dbraw/zinc/03/23/71/940032371.db2.gz CZXCZVLMTXMZSM-UHFFFAOYSA-N 0 0 357.591 3.529 20 5 FHBDRN CC(C)(C)n1cc(NC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)cn1 ZINC000062402173 940045177 /nfs/dbraw/zinc/04/51/77/940045177.db2.gz HTOBKXXQHMYZMX-UHFFFAOYSA-N 0 0 369.328 3.792 20 5 FHBDRN CCCOc1ccc(CNC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)cc1 ZINC000411476314 940047438 /nfs/dbraw/zinc/04/74/38/940047438.db2.gz OBSGCLXSAPMIPT-RBUKOAKNSA-N 0 0 354.406 3.804 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2nc(CN3CCC([C@@H]4CCOC4)CC3)cs2)c1 ZINC000612402111 940047908 /nfs/dbraw/zinc/04/79/08/940047908.db2.gz JVQLOOZEHOJLEJ-MRXNPFEDSA-N 0 0 373.478 3.967 20 5 FHBDRN O=C(NCCc1ccc(Cl)s1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000411460018 940049721 /nfs/dbraw/zinc/04/97/21/940049721.db2.gz UCJUCXXHOMGZBR-UONOGXRCSA-N 0 0 350.827 3.772 20 5 FHBDRN CCn1c(COC(=O)c2ccc([N+](=O)[O-])c(C)c2)nc2c1cccc2F ZINC000728614002 940051113 /nfs/dbraw/zinc/05/11/13/940051113.db2.gz WXVPHRMXQBLNQF-UHFFFAOYSA-N 0 0 357.341 3.769 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H]1CCCCC12CCCC2 ZINC000411539942 940063741 /nfs/dbraw/zinc/06/37/41/940063741.db2.gz DJTJZYNBSOHEOV-QGZVFWFLSA-N 0 0 373.453 3.769 20 5 FHBDRN O=C(N[C@H](c1ccncc1)c1cc(F)ccc1F)c1ccccc1[N+](=O)[O-] ZINC000365185269 940074573 /nfs/dbraw/zinc/07/45/73/940074573.db2.gz IKXWLWJWGMDBHH-GOSISDBHSA-N 0 0 369.327 3.787 20 5 FHBDRN Cc1ccncc1[C@H](C)Nc1ncc([N+](=O)[O-])c(C)c1Br ZINC000612449552 940075420 /nfs/dbraw/zinc/07/54/20/940075420.db2.gz ICROWCAKYLKFDR-JTQLQIEISA-N 0 0 351.204 3.937 20 5 FHBDRN CC(F)(F)c1cccc(NS(=O)(=O)CCc2ccccc2[N+](=O)[O-])c1 ZINC000188555826 940078845 /nfs/dbraw/zinc/07/88/45/940078845.db2.gz IRZSOKOYULKIGG-UHFFFAOYSA-N 0 0 370.377 3.691 20 5 FHBDRN CCn1c(COC(=O)c2cccc(C)c2[N+](=O)[O-])nc2c1cccc2F ZINC000728614690 940082192 /nfs/dbraw/zinc/08/21/92/940082192.db2.gz MCXLHTMBHWLPMJ-UHFFFAOYSA-N 0 0 357.341 3.769 20 5 FHBDRN Cc1ccc(NC2CCN(C(=O)c3cc(F)ccc3[N+](=O)[O-])CC2)cc1 ZINC000365217780 940083841 /nfs/dbraw/zinc/08/38/41/940083841.db2.gz SMHTYHFBCVURFH-UHFFFAOYSA-N 0 0 357.385 3.759 20 5 FHBDRN C[C@H]1CC(CCNC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)C[C@H](C)O1 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362.773 3.642 20 5 FHBDRN CCOC(=O)c1sc([C@H](C)NCc2c(F)cccc2[N+](=O)[O-])nc1C ZINC000612525868 940123183 /nfs/dbraw/zinc/12/31/83/940123183.db2.gz MLJNMFBBCWFVFO-JTQLQIEISA-N 0 0 367.402 3.526 20 5 FHBDRN Cc1cccc(C(=O)Oc2ccc(NC(=O)c3ccco3)cc2)c1[N+](=O)[O-] ZINC000051036717 940124148 /nfs/dbraw/zinc/12/41/48/940124148.db2.gz IWWCTFPCJOAAJU-UHFFFAOYSA-N 0 0 366.329 3.968 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N2CC[C@@H](c3ccccc3C)C2)c1F ZINC000411828078 940129181 /nfs/dbraw/zinc/12/91/81/940129181.db2.gz NMHPMQKLAPQHAY-CQSZACIVSA-N 0 0 372.396 3.610 20 5 FHBDRN C[C@H](c1ccc(F)cc1F)N1CCN(Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000065968768 940129564 /nfs/dbraw/zinc/12/95/64/940129564.db2.gz QDFBYVIWTKKKPY-CQSZACIVSA-N 0 0 361.392 3.752 20 5 FHBDRN O=C(Nc1ccc2nccn2c1)c1c([N+](=O)[O-])cccc1C(F)(F)F ZINC000612543309 940129713 /nfs/dbraw/zinc/12/97/13/940129713.db2.gz JFSKJFBFDAIWJP-UHFFFAOYSA-N 0 0 350.256 3.514 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)NCC(C)(C)c2ccccc2C)c1F ZINC000411834212 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ZINC000472476130 940363056 /nfs/dbraw/zinc/36/30/56/940363056.db2.gz INPDXEIBUWCHPW-UHFFFAOYSA-N 0 0 367.336 3.587 20 5 FHBDRN Cc1cccc(C2(c3nc(Cc4ccc([N+](=O)[O-])cn4)no3)CCC2)c1 ZINC000612967555 940366240 /nfs/dbraw/zinc/36/62/40/940366240.db2.gz COIPZXVISUHUQV-UHFFFAOYSA-N 0 0 350.378 3.742 20 5 FHBDRN CC(C)(C(=O)N[C@H]1C[C@@]1(C)c1ccccc1)c1ccc([N+](=O)[O-])cc1F ZINC000612997927 940386316 /nfs/dbraw/zinc/38/63/16/940386316.db2.gz UGPAFZFCFFECLE-PXNSSMCTSA-N 0 0 356.397 3.858 20 5 FHBDRN Cc1cc(C(=O)Nc2cc(C(=O)NCC3CC3)ccc2C)cc([N+](=O)[O-])c1 ZINC000188609415 940393242 /nfs/dbraw/zinc/39/32/42/940393242.db2.gz WZMNDNQYLLMJLI-UHFFFAOYSA-N 0 0 367.405 3.604 20 5 FHBDRN CC[C@H](CNC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F)CC(F)(F)F ZINC000414012242 940401017 /nfs/dbraw/zinc/40/10/17/940401017.db2.gz VCTSBZQYMHKNPM-QMMMGPOBSA-N 0 0 354.275 3.510 20 5 FHBDRN Cc1cc(C)c(NC(=O)c2ccc(Br)cc2[N+](=O)[O-])cc1O ZINC000613031862 940401023 /nfs/dbraw/zinc/40/10/23/940401023.db2.gz PXOYOWZPDFQWRG-UHFFFAOYSA-N 0 0 365.183 3.932 20 5 FHBDRN CC[C@H]1c2ccsc2CCN1C(=O)c1cc([N+](=O)[O-])cc2c1OCCO2 ZINC000066306016 940405052 /nfs/dbraw/zinc/40/50/52/940405052.db2.gz USJPDCILBLMCGI-AWEZNQCLSA-N 0 0 374.418 3.577 20 5 FHBDRN COCCCCN(Cc1ccccc1)C(=O)c1cc([N+](=O)[O-])ccc1OC ZINC000066309681 940407008 /nfs/dbraw/zinc/40/70/08/940407008.db2.gz OJDQKKWXFUTOCL-UHFFFAOYSA-N 0 0 372.421 3.672 20 5 FHBDRN O=C(CSc1ccccc1Cl)NCCNc1ccccc1[N+](=O)[O-] ZINC000024320557 940410467 /nfs/dbraw/zinc/41/04/67/940410467.db2.gz CEVXFAMRTUXCMN-UHFFFAOYSA-N 0 0 365.842 3.569 20 5 FHBDRN COCC1(c2noc(COc3ccc([N+](=O)[O-])c(C)c3)n2)CCCCC1 ZINC000579898421 940413503 /nfs/dbraw/zinc/41/35/03/940413503.db2.gz CURMIRWRNXXWBC-UHFFFAOYSA-N 0 0 361.398 3.714 20 5 FHBDRN Cc1nc(NC(=O)c2ccc(Oc3ccccc3)cn2)ccc1[N+](=O)[O-] ZINC000579911541 940416578 /nfs/dbraw/zinc/41/65/78/940416578.db2.gz PFMHRWYTYUJQAA-UHFFFAOYSA-N 0 0 350.334 3.738 20 5 FHBDRN CCC1(CC)CCN(C(=O)c2cc(OC)c(OC)cc2[N+](=O)[O-])CC1 ZINC000188622175 940428269 /nfs/dbraw/zinc/42/82/69/940428269.db2.gz DLPQBTKCNVAQNZ-UHFFFAOYSA-N 0 0 350.415 3.654 20 5 FHBDRN O=C(c1ccccc1OC1CC1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000579998034 940432545 /nfs/dbraw/zinc/43/25/45/940432545.db2.gz KZGUKAATBRVEBQ-UHFFFAOYSA-N 0 0 352.390 3.941 20 5 FHBDRN O=C(OCCCc1ccsc1)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000782677900 940433272 /nfs/dbraw/zinc/43/32/72/940433272.db2.gz TWXWTOJKTNNAPL-UHFFFAOYSA-N 0 0 357.391 3.632 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(-c2nc(-c3c(C)nc4sccn43)no2)c1 ZINC000580003777 940433528 /nfs/dbraw/zinc/43/35/28/940433528.db2.gz MCRWHIJLYOCULI-UHFFFAOYSA-N 0 0 371.378 3.728 20 5 FHBDRN COCC(C)(C)N(Cc1ccccc1)C(=O)c1cc(C)cc([N+](=O)[O-])c1 ZINC000472497993 940435628 /nfs/dbraw/zinc/43/56/28/940435628.db2.gz KLCIUQRDUJFNIF-UHFFFAOYSA-N 0 0 356.422 3.971 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N[C@@H]1CCN(c2ccc(F)cc2)C1 ZINC000414042639 940444921 /nfs/dbraw/zinc/44/49/21/940444921.db2.gz OJGYRIZHGRKZDR-MRXNPFEDSA-N 0 0 371.412 3.668 20 5 FHBDRN O=C(c1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CC[C@@H](c2cccnc2)C1 ZINC000580077189 940451944 /nfs/dbraw/zinc/45/19/44/940451944.db2.gz PJPNXYYCIQKKCS-GFCCVEGCSA-N 0 0 365.311 3.638 20 5 FHBDRN COC(=O)c1ccc(OCc2coc(-c3ccc(F)cc3)n2)cc1[N+](=O)[O-] ZINC000613110238 940452544 /nfs/dbraw/zinc/45/25/44/940452544.db2.gz KRFICBKOKIFIPT-UHFFFAOYSA-N 0 0 372.308 3.755 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])N1CC[C@](F)(c2ccccc2F)C1 ZINC000548991640 940453143 /nfs/dbraw/zinc/45/31/43/940453143.db2.gz LLXAVXQFRWEFCZ-GOSISDBHSA-N 0 0 361.348 3.514 20 5 FHBDRN Cc1oc(NC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])nc1C1CC1 ZINC000892524450 940461200 /nfs/dbraw/zinc/46/12/00/940461200.db2.gz LJJNQZFSTTVUOU-UHFFFAOYSA-N 0 0 353.737 3.742 20 5 FHBDRN Cn1c(SCc2cc([N+](=O)[O-])ccc2Cl)nnc1-c1ccccn1 ZINC000177845799 940462176 /nfs/dbraw/zinc/46/21/76/940462176.db2.gz CISXUQJEKSSJPM-UHFFFAOYSA-N 0 0 361.814 3.731 20 5 FHBDRN COC(C)(C)CN(C)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000580272207 940471594 /nfs/dbraw/zinc/47/15/94/940471594.db2.gz YBNQNYWCIYWFFJ-UHFFFAOYSA-N 0 0 374.235 3.554 20 5 FHBDRN C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N1CC[C@@H](CC2CC2)C1 ZINC000580336088 940473201 /nfs/dbraw/zinc/47/32/01/940473201.db2.gz XPBFGMJTPFNYLR-AAEUAGOBSA-N 0 0 351.834 3.697 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]c(N3CCC(C(F)(F)F)(C(F)(F)F)C3)nc2c1 ZINC000580394850 940475944 /nfs/dbraw/zinc/47/59/44/940475944.db2.gz XOSUDBIEGFSPAX-UHFFFAOYSA-N 0 0 368.237 3.792 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(C(=O)N(C)C)c(Cl)c1 ZINC000511444985 940476938 /nfs/dbraw/zinc/47/69/38/940476938.db2.gz LRJKSPOZUODODF-UHFFFAOYSA-N 0 0 361.785 3.511 20 5 FHBDRN C[C@@H](CNc1ccc([N+](=O)[O-])c(OCc2ccccc2)n1)c1ccncc1 ZINC000613184270 940479141 /nfs/dbraw/zinc/47/91/41/940479141.db2.gz UZLRRTIOYNNTJE-HNNXBMFYSA-N 0 0 364.405 3.601 20 5 FHBDRN C[C@H](CNc1ccc([N+](=O)[O-])c(OCc2ccccc2)n1)c1ccncc1 ZINC000613184274 940479173 /nfs/dbraw/zinc/47/91/73/940479173.db2.gz UZLRRTIOYNNTJE-OAHLLOKOSA-N 0 0 364.405 3.601 20 5 FHBDRN COc1cc(Cc2noc(C[C@@H]3CCC[C@@H]3C)n2)c([N+](=O)[O-])c(OC)c1 ZINC000580601788 940482064 /nfs/dbraw/zinc/48/20/64/940482064.db2.gz QJIOMUQYMOQTRF-RYUDHWBXSA-N 0 0 361.398 3.565 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)c1c(F)cc(C(F)(F)F)cc1F ZINC000580743761 940483545 /nfs/dbraw/zinc/48/35/45/940483545.db2.gz NJVZMNHSBHTWPR-UHFFFAOYSA-N 0 0 360.238 3.822 20 5 FHBDRN C[C@H](SCc1ccc(S(C)(=O)=O)cc1)c1ccccc1[N+](=O)[O-] ZINC000580848051 940487112 /nfs/dbraw/zinc/48/71/12/940487112.db2.gz HBIOJOOOULFRJG-LBPRGKRZSA-N 0 0 351.449 3.993 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1-c1noc(-c2cccnc2OCC(F)F)n1 ZINC000580799938 940487587 /nfs/dbraw/zinc/48/75/87/940487587.db2.gz QJUMBEAHCOTMQK-UHFFFAOYSA-N 0 0 362.292 3.659 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2C[C@H](C)C[C@H]2c2cccnc2)c1 ZINC000549008700 940488112 /nfs/dbraw/zinc/48/81/12/940488112.db2.gz GHKHZSJXZIQACK-ACJLOTCBSA-N 0 0 355.394 3.612 20 5 FHBDRN CCCOc1cccc(NC(=O)N2CCOc3ccc([N+](=O)[O-])cc3C2)c1 ZINC000580920923 940488911 /nfs/dbraw/zinc/48/89/11/940488911.db2.gz QZDIWJUFLIHAHY-UHFFFAOYSA-N 0 0 371.393 3.810 20 5 FHBDRN Cc1ccc(-c2csc(NC(=O)c3ccncc3C)n2)cc1[N+](=O)[O-] ZINC000472526288 940490002 /nfs/dbraw/zinc/49/00/02/940490002.db2.gz DWNSKVBVWTULJN-UHFFFAOYSA-N 0 0 354.391 3.982 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1-c1nc(-c2c(C)nc3sc(C)cn32)no1 ZINC000426603448 945325535 /nfs/dbraw/zinc/32/55/35/945325535.db2.gz BGSQPKIFNKRTGZ-UHFFFAOYSA-N 0 0 371.378 3.646 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)Cn1nc(N(C)C)sc1=S ZINC000066448413 940492632 /nfs/dbraw/zinc/49/26/32/940492632.db2.gz HTPSGKFSBDLGMU-UHFFFAOYSA-N 0 0 367.500 3.516 20 5 FHBDRN Cc1ccc(NC(=O)N2CCCN3c4ccccc4C[C@@H]3C2)cc1[N+](=O)[O-] ZINC000581159723 940494555 /nfs/dbraw/zinc/49/45/55/940494555.db2.gz UZSDLWJSZALHDF-QGZVFWFLSA-N 0 0 366.421 3.572 20 5 FHBDRN Cc1cccc(OCCNC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000431780204 940495400 /nfs/dbraw/zinc/49/54/00/940495400.db2.gz XHWRLVIVUZUUHY-UHFFFAOYSA-N 0 0 357.410 3.517 20 5 FHBDRN Cc1ccc2cccc(NC(=O)c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3)c2n1 ZINC000066462715 940495548 /nfs/dbraw/zinc/49/55/48/940495548.db2.gz ZJTYENADPRYDSV-UHFFFAOYSA-N 0 0 352.306 3.612 20 5 FHBDRN COc1cc(Cl)c(NC(=O)COc2ccccc2[N+](=O)[O-])cc1C ZINC000581214209 940496665 /nfs/dbraw/zinc/49/66/65/940496665.db2.gz DCAYYTFWEOXRSY-UHFFFAOYSA-N 0 0 350.758 3.583 20 5 FHBDRN Cc1ccsc1-c1noc(-c2ccn(-c3ccccc3[N+](=O)[O-])n2)n1 ZINC000581280290 940498294 /nfs/dbraw/zinc/49/82/94/940498294.db2.gz ITFYFNFBKKPPNN-UHFFFAOYSA-N 0 0 353.363 3.867 20 5 FHBDRN C[C@@H](C(=O)N[C@@H](C)CCOCc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000581327971 940499268 /nfs/dbraw/zinc/49/92/68/940499268.db2.gz BBZIPYSKFGYGEU-JKSUJKDBSA-N 0 0 356.422 3.810 20 5 FHBDRN C[C@@H](CCOCc1ccccc1)NC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000581327969 940499346 /nfs/dbraw/zinc/49/93/46/940499346.db2.gz BBZIPYSKFGYGEU-HOTGVXAUSA-N 0 0 356.422 3.810 20 5 FHBDRN COC(=O)c1ccc(Oc2ccnc(Cc3ccccc3)n2)cc1[N+](=O)[O-] ZINC000613284458 940505448 /nfs/dbraw/zinc/50/54/48/940505448.db2.gz HODACUBJLKXHKZ-UHFFFAOYSA-N 0 0 365.345 3.555 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)NCCc2ccc(Br)cc2)c1 ZINC000173058274 940510023 /nfs/dbraw/zinc/51/00/23/940510023.db2.gz SIJUXJPTUMLKTL-UHFFFAOYSA-N 0 0 363.211 3.638 20 5 FHBDRN CC(C)(C(=O)NC[C@H]1CSc2ccccc2O1)c1ccccc1[N+](=O)[O-] ZINC000581727828 940510991 /nfs/dbraw/zinc/51/09/91/940510991.db2.gz NKLUFZSQWWCDAD-ZDUSSCGKSA-N 0 0 372.446 3.542 20 5 FHBDRN COc1ccc(CC(=O)Nc2cnn(CC(C)C)c2C2CC2)cc1[N+](=O)[O-] ZINC000581746120 940511275 /nfs/dbraw/zinc/51/12/75/940511275.db2.gz FWFGHTIUJLOJLF-UHFFFAOYSA-N 0 0 372.425 3.515 20 5 FHBDRN CCc1c(C(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)cnn1CCC(C)C ZINC000427403379 945329274 /nfs/dbraw/zinc/32/92/74/945329274.db2.gz IBBXWNCNBPKPRL-UHFFFAOYSA-N 0 0 370.453 3.598 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1C[C@H](c2ccccc2C)OC[C@@H]1C ZINC000427386119 945332389 /nfs/dbraw/zinc/33/23/89/945332389.db2.gz CVASWLQQPYVDGB-IFXJQAMLSA-N 0 0 370.405 3.514 20 5 FHBDRN O=C(Cc1c[nH]c2cccc(Cl)c12)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000431799796 940601846 /nfs/dbraw/zinc/60/18/46/940601846.db2.gz JDCMGOXOQRFWAZ-UHFFFAOYSA-N 0 0 355.781 3.861 20 5 FHBDRN CCOc1cc(NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)ccc1C ZINC000066525186 940607978 /nfs/dbraw/zinc/60/79/78/940607978.db2.gz GTYKQOXZBCITOX-UHFFFAOYSA-N 0 0 366.377 3.740 20 5 FHBDRN O=C(NCCc1ccc(F)cc1F)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000581858428 940627842 /nfs/dbraw/zinc/62/78/42/940627842.db2.gz UHKXERFTGDZMRX-UHFFFAOYSA-N 0 0 374.265 3.864 20 5 FHBDRN Cc1ccc([C@H]2OCCC[C@@H]2CNC(=O)c2ccc([N+](=O)[O-])cc2F)cc1 ZINC000173489566 940629361 /nfs/dbraw/zinc/62/93/61/940629361.db2.gz ZMYWNQZJCGNONF-DNVCBOLYSA-N 0 0 372.396 3.940 20 5 FHBDRN Cc1cnc(OCC(=O)N(C)[C@@H](C)c2cc3ccccc3o2)c([N+](=O)[O-])c1 ZINC000426611409 945336544 /nfs/dbraw/zinc/33/65/44/945336544.db2.gz RMMGOYNIRAQTOH-ZDUSSCGKSA-N 0 0 369.377 3.643 20 5 FHBDRN Cc1cc(N2CCC[C@@](O)(C(F)(F)F)CC2)c2cccc([N+](=O)[O-])c2n1 ZINC000376262424 940641688 /nfs/dbraw/zinc/64/16/88/940641688.db2.gz QDSXEIHBTDZDRT-INIZCTEOSA-N 0 0 369.343 3.735 20 5 FHBDRN CCOc1cc(NC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)ccc1OC ZINC000047582404 945336942 /nfs/dbraw/zinc/33/69/42/945336942.db2.gz REGVEHPFRNGRCE-GFCCVEGCSA-N 0 0 359.382 3.885 20 5 FHBDRN CC(=O)[C@@H]1C[C@H](C(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)C1(C)C ZINC000582044605 940644503 /nfs/dbraw/zinc/64/45/03/940644503.db2.gz CXMMFOMEIRZTBL-RYQLBKOJSA-N 0 0 358.438 3.552 20 5 FHBDRN CC(C)Cn1c(-c2cccnc2)nnc1N(C)Cc1ccccc1[N+](=O)[O-] ZINC000582075169 940645983 /nfs/dbraw/zinc/64/59/83/940645983.db2.gz LKYQPSPBEKBEOR-UHFFFAOYSA-N 0 0 366.425 3.541 20 5 FHBDRN Cc1c(C[S@@](C)=O)cccc1NC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000582215475 940654201 /nfs/dbraw/zinc/65/42/01/940654201.db2.gz AAJRFDHIPFBXSX-YMXBGEKHSA-N 0 0 360.435 3.524 20 5 FHBDRN CCOC(=O)c1c(C)csc1NC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000582218679 940654696 /nfs/dbraw/zinc/65/46/96/940654696.db2.gz VUYBLCVRCVGIKB-LLVKDONJSA-N 0 0 362.407 3.884 20 5 FHBDRN COc1cc(CN2C[C@@H](C(F)(F)F)CC[C@@H]2C)c([N+](=O)[O-])cc1F ZINC000613384166 940659262 /nfs/dbraw/zinc/65/92/62/940659262.db2.gz UBYPWUPKTHKSHP-ONGXEEELSA-N 0 0 350.312 3.905 20 5 FHBDRN CCN(C[C@@H](O)c1ccc(C)cc1)C(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000178099380 940665132 /nfs/dbraw/zinc/66/51/32/940665132.db2.gz DANWTCKAHJBVFJ-QGZVFWFLSA-N 0 0 362.813 3.752 20 5 FHBDRN Cc1cc(NC(=O)[C@H](C)c2cccc([N+](=O)[O-])c2)nn1-c1ccc(C)cc1 ZINC000582463773 940667240 /nfs/dbraw/zinc/66/72/40/940667240.db2.gz VVUAGXRRJJQSBO-OAHLLOKOSA-N 0 0 364.405 3.561 20 5 FHBDRN CC(C)CCc1noc(CNc2cc(Br)cc([N+](=O)[O-])c2)n1 ZINC000582476917 940667699 /nfs/dbraw/zinc/66/76/99/940667699.db2.gz JJHJTJWQWMLOTO-UHFFFAOYSA-N 0 0 369.219 3.941 20 5 FHBDRN O=C(NCCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C(C1CC1)C1CC1 ZINC000511502745 940671907 /nfs/dbraw/zinc/67/19/07/940671907.db2.gz FKOTVDYAZNSEMA-UHFFFAOYSA-N 0 0 371.359 3.578 20 5 FHBDRN COc1ccc(OCCSCc2ccn(C(C)C)n2)c([N+](=O)[O-])c1 ZINC000173827498 940678491 /nfs/dbraw/zinc/67/84/91/940678491.db2.gz UQPDHPOOEJYOEV-UHFFFAOYSA-N 0 0 351.428 3.693 20 5 FHBDRN COc1cccc(CCCSCc2ccc(C(N)=O)cc2[N+](=O)[O-])c1 ZINC000173848135 940683327 /nfs/dbraw/zinc/68/33/27/940683327.db2.gz QJGGTLRFJZAKMK-UHFFFAOYSA-N 0 0 360.435 3.568 20 5 FHBDRN CCn1c(C)nc([N+](=O)[O-])c1NCc1ccnc(OCc2ccccc2)c1 ZINC000582508793 940686258 /nfs/dbraw/zinc/68/62/58/940686258.db2.gz RDBXCGPRXQEVKI-UHFFFAOYSA-N 0 0 367.409 3.706 20 5 FHBDRN C[C@@H]1CC(CCNC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)C[C@@H](C)O1 ZINC000549019674 940690401 /nfs/dbraw/zinc/69/04/01/940690401.db2.gz UYYPBNYJJNIFJO-GHMZBOCLSA-N 0 0 372.368 3.520 20 5 FHBDRN Cc1cc(Cl)c(C(=O)Nc2ccc(-c3nc[nH]n3)cc2)cc1[N+](=O)[O-] ZINC001125819793 940707097 /nfs/dbraw/zinc/70/70/97/940707097.db2.gz ZXSSXDLPOYZPSH-UHFFFAOYSA-N 0 0 357.757 3.594 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)OCc2ccnc(Cl)c2)cc1SC ZINC000728649574 940737872 /nfs/dbraw/zinc/73/78/72/940737872.db2.gz MTEDNSHAQURYSZ-UHFFFAOYSA-N 0 0 368.798 3.731 20 5 FHBDRN CC[C@H]1c2ccccc2CCN1S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1 ZINC000613474266 940741417 /nfs/dbraw/zinc/74/14/17/940741417.db2.gz WTXQIXBAVWFEFK-AWEZNQCLSA-N 0 0 366.464 3.663 20 5 FHBDRN Cc1cc(C)cc([C@@H](C)NC(=O)N2CCC(n3ccc([N+](=O)[O-])n3)CC2)c1 ZINC000365511333 940755520 /nfs/dbraw/zinc/75/55/20/940755520.db2.gz NAJPHHDWNNNCNQ-OAHLLOKOSA-N 0 0 371.441 3.516 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@@](F)(c3ccccc3)C2)c1 ZINC000582619237 940760337 /nfs/dbraw/zinc/76/03/37/940760337.db2.gz LSYMMTWVMDWJLA-IBGZPJMESA-N 0 0 358.369 3.704 20 5 FHBDRN Cc1c(F)ccc([N+](=O)[O-])c1C(=O)Nc1cccc(OC[C@@H]2CCCO2)c1 ZINC000843762273 945348012 /nfs/dbraw/zinc/34/80/12/945348012.db2.gz WXVALCGPNHCRKZ-HNNXBMFYSA-N 0 0 374.368 3.852 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)N[C@H]1C[C@H](c2ccccc2F)C1 ZINC000438011322 945348785 /nfs/dbraw/zinc/34/87/85/945348785.db2.gz KYYLFBPHCPNDOK-SHTZXODSSA-N 0 0 357.385 3.822 20 5 FHBDRN CSc1ccc(C(=O)NCc2nc(-c3cccs3)c[nH]2)cc1[N+](=O)[O-] ZINC000472559486 940797183 /nfs/dbraw/zinc/79/71/83/940797183.db2.gz ZTNROSQEVHGEAR-UHFFFAOYSA-N 0 0 374.447 3.698 20 5 FHBDRN CSc1cccc(NC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])n1 ZINC000582690504 940812568 /nfs/dbraw/zinc/81/25/68/940812568.db2.gz JCFJMGGHEDCQMJ-UHFFFAOYSA-N 0 0 369.855 3.518 20 5 FHBDRN CSc1ccc(C(=O)N2CC[C@@H](OCCC(C)C)C2)cc1[N+](=O)[O-] ZINC000175175030 940817244 /nfs/dbraw/zinc/81/72/44/940817244.db2.gz NSCJHXUDISWPGL-CQSZACIVSA-N 0 0 352.456 3.594 20 5 FHBDRN C[C@@H](c1cc(F)ccc1F)N(C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000053126851 940833292 /nfs/dbraw/zinc/83/32/92/940833292.db2.gz JUMYITZESCGWGY-LBPRGKRZSA-N 0 0 363.364 3.529 20 5 FHBDRN O=C(NCc1cccc([N+](=O)[O-])c1)N1CCC[C@@H]1/C=C\c1ccccc1 ZINC000540941794 940833976 /nfs/dbraw/zinc/83/39/76/940833976.db2.gz IGTIFKDCQDYQAQ-YUIUBULTSA-N 0 0 351.406 3.982 20 5 FHBDRN Cc1cc(NS(=O)(=O)c2cc([N+](=O)[O-])ccc2C)c(Cl)cc1F ZINC000507605803 945353122 /nfs/dbraw/zinc/35/31/22/945353122.db2.gz OHXRKJWBVMDVQE-UHFFFAOYSA-N 0 0 358.778 3.805 20 5 FHBDRN COCCc1nc2cc(NC(=O)Nc3ccc(C)c([N+](=O)[O-])c3)ccc2o1 ZINC000440262016 945353627 /nfs/dbraw/zinc/35/36/27/945353627.db2.gz VSCQQKNSTYJIQV-UHFFFAOYSA-N 0 0 370.365 3.877 20 5 FHBDRN CCOc1ccc([C@H](C)NCc2nccc(C(F)(F)F)n2)cc1[N+](=O)[O-] ZINC000414256739 940844697 /nfs/dbraw/zinc/84/46/97/940844697.db2.gz ODLUXVKCXVNELJ-JTQLQIEISA-N 0 0 370.331 3.653 20 5 FHBDRN O=C(N[C@@H]1CCO[C@H]1c1ccc(Cl)c(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000180246476 940875152 /nfs/dbraw/zinc/87/51/52/940875152.db2.gz RQWFYSYAJCICOU-CVEARBPZSA-N 0 0 364.760 3.647 20 5 FHBDRN Cc1ccc(CNC(=O)c2ccc(Br)cc2[N+](=O)[O-])cc1F ZINC000175550286 940888520 /nfs/dbraw/zinc/88/85/20/940888520.db2.gz IIZQFVUPNJHOFG-UHFFFAOYSA-N 0 0 367.174 3.735 20 5 FHBDRN C[C@@H](c1ccccc1Cl)N(C)C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000180274023 940909623 /nfs/dbraw/zinc/90/96/23/940909623.db2.gz PZYMAXMIOOOWDU-JTQLQIEISA-N 0 0 362.769 3.810 20 5 FHBDRN O=C(c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12)N1OC2CCC1CC2 ZINC000636405966 940910295 /nfs/dbraw/zinc/91/02/95/940910295.db2.gz XLWVQOCXKDBAOT-UHFFFAOYSA-N 0 0 370.355 3.658 20 5 FHBDRN CC(C)n1c2ccccc2nc1[C@@H]1CCCN(c2c([N+](=O)[O-])cnn2C)C1 ZINC000892606022 940927142 /nfs/dbraw/zinc/92/71/42/940927142.db2.gz VXSZESDIPVTTGG-CQSZACIVSA-N 0 0 368.441 3.643 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)Nc1ccc([C@H]2CCOC2)cc1 ZINC000582896776 940933347 /nfs/dbraw/zinc/93/33/47/940933347.db2.gz VPTWCTRUFGRXRP-AWEZNQCLSA-N 0 0 358.419 3.830 20 5 FHBDRN COc1cc(CNc2cccc(F)c2)c([N+](=O)[O-])cc1OCC(F)F ZINC000180295578 940937065 /nfs/dbraw/zinc/93/70/65/940937065.db2.gz XOTXTKBSTXPNHH-UHFFFAOYSA-N 0 0 356.300 3.999 20 5 FHBDRN Cc1csc([C@H](C)CNC(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)n1 ZINC000186077701 940941316 /nfs/dbraw/zinc/94/13/16/940941316.db2.gz JOOBXTZFBYWWKY-MWLCHTKSSA-N 0 0 351.403 3.522 20 5 FHBDRN Cc1ccc(CN(C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)cc1C ZINC000452046095 940943488 /nfs/dbraw/zinc/94/34/88/940943488.db2.gz VEKKUOMWUVYMIB-UHFFFAOYSA-N 0 0 352.394 3.894 20 5 FHBDRN CC(C)[C@H](CNC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1)c1cccnc1 ZINC000175892768 940947882 /nfs/dbraw/zinc/94/78/82/940947882.db2.gz NYGDHHZYFWOBTM-SFHVURJKSA-N 0 0 370.453 3.964 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1c2ccccc2SC[C@H]1C ZINC000472582580 940948678 /nfs/dbraw/zinc/94/86/78/940948678.db2.gz XIDAKAVIDMKMCL-CYBMUJFWSA-N 0 0 357.435 3.843 20 5 FHBDRN CCOc1ccccc1C1=CCN(C(=O)c2cc([N+](=O)[O-])ccc2N)CC1 ZINC000376417365 940957117 /nfs/dbraw/zinc/95/71/17/940957117.db2.gz YJYFHBDTNHXCQH-UHFFFAOYSA-N 0 0 367.405 3.505 20 5 FHBDRN CC1(C)C[C@@H](Nc2cccc(O[C@H]3CC(=O)N3)c2)c2cc([N+](=O)[O-])ccc21 ZINC000414318037 940958499 /nfs/dbraw/zinc/95/84/99/940958499.db2.gz LIMNBUBAQOIJIT-MJGOQNOKSA-N 0 0 367.405 3.654 20 5 FHBDRN CS(=O)(=O)c1ccc(/C=C/c2ccc3cc([N+](=O)[O-])ccc3n2)cc1 ZINC000545317537 940966739 /nfs/dbraw/zinc/96/67/39/940966739.db2.gz WKIKRWARZWIKBR-QHHAFSJGSA-N 0 0 354.387 3.717 20 5 FHBDRN COc1ccc(C[C@@H](C)C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)cc1OC ZINC000180328356 940973066 /nfs/dbraw/zinc/97/30/66/940973066.db2.gz LWKZGEZUSMENRY-CYBMUJFWSA-N 0 0 358.394 3.738 20 5 FHBDRN CN(C(=O)c1cccc([N+](=O)[O-])c1Br)C(C1CC1)C1CC1 ZINC000180345883 940986401 /nfs/dbraw/zinc/98/64/01/940986401.db2.gz SVPDLSCDXXDTJY-UHFFFAOYSA-N 0 0 353.216 3.618 20 5 FHBDRN CSc1cccc(C(=O)NCc2cc(-c3ccccc3)on2)c1[N+](=O)[O-] ZINC000186442870 941004164 /nfs/dbraw/zinc/00/41/64/941004164.db2.gz QZFYHKFHYHICEH-UHFFFAOYSA-N 0 0 369.402 3.902 20 5 FHBDRN COc1ccccc1-c1nnc(CN[C@H](C)c2cccc([N+](=O)[O-])c2)o1 ZINC000180422037 941010139 /nfs/dbraw/zinc/01/01/39/941010139.db2.gz LIGZIAYPGDYIPV-GFCCVEGCSA-N 0 0 354.366 3.504 20 5 FHBDRN Cc1nn(C)c(C(=O)Nc2ccccc2NCC2CCCCC2)c1[N+](=O)[O-] ZINC000180434349 941014235 /nfs/dbraw/zinc/01/42/35/941014235.db2.gz CWNSLWWPTZGEOF-UHFFFAOYSA-N 0 0 371.441 3.881 20 5 FHBDRN C[C@@H](C(=O)Nc1ccc(OCc2ccccc2)cc1)n1cc([N+](=O)[O-])cn1 ZINC000180502243 941032529 /nfs/dbraw/zinc/03/25/29/941032529.db2.gz YRENTEVVIJLKEP-AWEZNQCLSA-N 0 0 366.377 3.570 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)Nc1nc2cc(F)ccc2n1C ZINC000180549943 941045662 /nfs/dbraw/zinc/04/56/62/941045662.db2.gz OYQKBUYBAGEAJF-UHFFFAOYSA-N 0 0 356.357 3.798 20 5 FHBDRN COc1cccc([C@H]2C[C@@H]2C(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000176505787 941053991 /nfs/dbraw/zinc/05/39/91/941053991.db2.gz WSZVPWDGFKSOFH-MSOLQXFVSA-N 0 0 354.406 3.758 20 5 FHBDRN C[C@H](NC(=O)c1ccc(Br)c(O)c1)c1cccc([N+](=O)[O-])c1 ZINC000136768907 941054628 /nfs/dbraw/zinc/05/46/28/941054628.db2.gz XCFGDFSZKRHZDW-VIFPVBQESA-N 0 0 365.183 3.554 20 5 FHBDRN COc1cc(C(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)ccc1F ZINC000180620043 941056144 /nfs/dbraw/zinc/05/61/44/941056144.db2.gz MIONRVVDUPFOIZ-UHFFFAOYSA-N 0 0 369.146 3.757 20 5 FHBDRN O=C1OC(c2ccccc2)=N/C1=C/c1ccc(Br)c([N+](=O)[O-])c1 ZINC000003626406 941057499 /nfs/dbraw/zinc/05/74/99/941057499.db2.gz UQMNHXZKCBHVLE-MDWZMJQESA-N 0 0 373.162 3.702 20 5 FHBDRN O=C(Nc1ccn(-c2ccccc2)n1)c1cc(Cl)c(F)c([N+](=O)[O-])c1 ZINC001167702349 941069993 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20 5 FHBDRN C[C@H](NC(=O)c1c(N)cccc1[N+](=O)[O-])c1ccc(-c2ccncc2)cc1 ZINC000180838009 941084453 /nfs/dbraw/zinc/08/44/53/941084453.db2.gz MJRSTZNSHUQFMC-ZDUSSCGKSA-N 0 0 362.389 3.730 20 5 FHBDRN CCOC(=O)c1cc(NCc2nccc3ccccc32)ccc1[N+](=O)[O-] ZINC001167704316 941084749 /nfs/dbraw/zinc/08/47/49/941084749.db2.gz KQLCRSJQJFSNFV-UHFFFAOYSA-N 0 0 351.362 3.932 20 5 FHBDRN NC(=O)c1ccc(CNc2ccc(CCC(F)(F)F)cc2)c([N+](=O)[O-])c1 ZINC000176957204 941088423 /nfs/dbraw/zinc/08/84/23/941088423.db2.gz LCOSZKKIPWEDJT-UHFFFAOYSA-N 0 0 367.327 3.801 20 5 FHBDRN C[C@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1F)c1nc2c(s1)CCC2 ZINC000414394369 941091248 /nfs/dbraw/zinc/09/12/48/941091248.db2.gz BCQBDRAZGLVYKL-QMMMGPOBSA-N 0 0 350.375 3.562 20 5 FHBDRN CC(C)(C)c1nnc(NC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)s1 ZINC000177039879 941095416 /nfs/dbraw/zinc/09/54/16/941095416.db2.gz UIMLNDMCDXZZBD-UHFFFAOYSA-N 0 0 363.443 3.801 20 5 FHBDRN C[C@H](c1nc2ccccc2o1)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000180965602 941098031 /nfs/dbraw/zinc/09/80/31/941098031.db2.gz WNLUBMQMDLKADH-CQSZACIVSA-N 0 0 352.394 3.619 20 5 FHBDRN C[C@@H](c1nc2ccccc2o1)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000180965581 941098046 /nfs/dbraw/zinc/09/80/46/941098046.db2.gz WNLUBMQMDLKADH-AWEZNQCLSA-N 0 0 352.394 3.619 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[C@H](Oc2cccc(F)c2)C1 ZINC000188826435 941100704 /nfs/dbraw/zinc/10/07/04/941100704.db2.gz PEPNBKALXZCBJE-INIZCTEOSA-N 0 0 359.357 3.728 20 5 FHBDRN Cc1c(CC(=O)N(c2cccc(F)c2)C2CCOCC2)cccc1[N+](=O)[O-] ZINC000181010963 941102751 /nfs/dbraw/zinc/10/27/51/941102751.db2.gz YWBXQQYYFJZHMR-UHFFFAOYSA-N 0 0 372.396 3.797 20 5 FHBDRN Cc1cc([C@@H](C)NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)c(C)o1 ZINC000181075701 941107333 /nfs/dbraw/zinc/10/73/33/941107333.db2.gz RGPULEXHRUURIN-SECBINFHSA-N 0 0 354.309 3.897 20 5 FHBDRN Cc1cc([C@H](C)NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)c(C)o1 ZINC000181075721 941107549 /nfs/dbraw/zinc/10/75/49/941107549.db2.gz RGPULEXHRUURIN-VIFPVBQESA-N 0 0 354.309 3.897 20 5 FHBDRN O=[N+]([O-])c1ccc(Oc2ccc3nnc(C(F)F)n3n2)c2ccccc21 ZINC000181212668 941111106 /nfs/dbraw/zinc/11/11/06/941111106.db2.gz WCPNUSBXCFUMDE-UHFFFAOYSA-N 0 0 357.276 3.916 20 5 FHBDRN CCc1ccc(C(=O)Nc2cn(-c3ccccc3)nc2C)cc1[N+](=O)[O-] ZINC000181226028 941113163 /nfs/dbraw/zinc/11/31/63/941113163.db2.gz LPIOKIPSHPGUBD-UHFFFAOYSA-N 0 0 350.378 3.904 20 5 FHBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)Cc1csc(C2CCCC2)n1 ZINC000414413175 941114159 /nfs/dbraw/zinc/11/41/59/941114159.db2.gz MAMYKQDSCUXXHP-UHFFFAOYSA-N 0 0 366.464 3.824 20 5 FHBDRN COC(=O)c1ccc(F)c(NC(=O)c2c(C)cc(C)c([N+](=O)[O-])c2C)c1 ZINC000091848249 941114465 /nfs/dbraw/zinc/11/44/65/941114465.db2.gz PBLLWXCXPBFTNA-UHFFFAOYSA-N 0 0 360.341 3.698 20 5 FHBDRN CCOc1cc(C(=O)N[C@H]2CCC[C@@H](C)CC2)c([N+](=O)[O-])cc1OC ZINC000188850153 941118877 /nfs/dbraw/zinc/11/88/77/941118877.db2.gz ZASPYDWFOYNMJF-OLZOCXBDSA-N 0 0 350.415 3.701 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN1c2ccccc2SC[C@@H]1C ZINC000177389261 941120455 /nfs/dbraw/zinc/12/04/55/941120455.db2.gz COFVIOJHEDZBEA-LBPRGKRZSA-N 0 0 373.434 3.543 20 5 FHBDRN COc1cccc2[nH]cc(CC(=O)N[C@@H](C)c3ccc(C)c([N+](=O)[O-])c3)c21 ZINC000181301125 941120506 /nfs/dbraw/zinc/12/05/06/941120506.db2.gz WRYJPDXDZMBOCJ-ZDUSSCGKSA-N 0 0 367.405 3.813 20 5 FHBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])NCc1ccc(Cl)cn1 ZINC000181299431 941120603 /nfs/dbraw/zinc/12/06/03/941120603.db2.gz HBHJIZBCDJRICD-UHFFFAOYSA-N 0 0 372.233 3.705 20 5 FHBDRN NC(=O)[C@H]1CCC[C@@H](Nc2cc(Cl)c(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000150901274 941123494 /nfs/dbraw/zinc/12/34/94/941123494.db2.gz LTWMNTCHZXSYGA-JGVFFNPUSA-N 0 0 365.739 3.723 20 5 FHBDRN Cc1ccc(NC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)cc1-c1ncco1 ZINC000181337759 941124619 /nfs/dbraw/zinc/12/46/19/941124619.db2.gz URVUPFWICVRCSV-UHFFFAOYSA-N 0 0 367.317 3.539 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@@H](C)c1cn(-c2ccccc2)nn1 ZINC000181337274 941124654 /nfs/dbraw/zinc/12/46/54/941124654.db2.gz IEWKOJZBFWVPDB-CABCVRRESA-N 0 0 351.410 3.896 20 5 FHBDRN COc1cc(CN[C@@H]2CCOc3c(C)cccc32)c([N+](=O)[O-])cc1OC ZINC000188878635 941127645 /nfs/dbraw/zinc/12/76/45/941127645.db2.gz LKPPNKUGFTYGKN-OAHLLOKOSA-N 0 0 358.394 3.534 20 5 FHBDRN O=C(N[C@H]1CCOc2c(F)cccc21)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000188968545 941135545 /nfs/dbraw/zinc/13/55/45/941135545.db2.gz WAAATFRNMHTXNK-HNNXBMFYSA-N 0 0 367.336 3.536 20 5 FHBDRN O=C(c1ccc(Cl)cc1[N+](=O)[O-])N1CCC[C@@H]1[C@@H]1CCCCC1=O ZINC000177618492 941139578 /nfs/dbraw/zinc/13/95/78/941139578.db2.gz FKWICVRRTARJHV-GXTWGEPZSA-N 0 0 350.802 3.612 20 5 FHBDRN COc1cc(C(=O)Nc2ccc(-c3cnco3)cc2)cc([N+](=O)[O-])c1C ZINC000188987334 941140674 /nfs/dbraw/zinc/14/06/74/941140674.db2.gz BPZQIYPTJGWJQQ-UHFFFAOYSA-N 0 0 353.334 3.819 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CCO[C@@H](c2ccccc2F)C1 ZINC000066691036 941144833 /nfs/dbraw/zinc/14/48/33/941144833.db2.gz KKKDXJOXAWKHHB-MRXNPFEDSA-N 0 0 364.760 3.601 20 5 FHBDRN O=C(c1ccn(-c2ccccc2[N+](=O)[O-])n1)N1CCC[C@H]1c1ccsc1 ZINC000136050212 941147668 /nfs/dbraw/zinc/14/76/68/941147668.db2.gz WLTXGOGIIIXPSQ-HNNXBMFYSA-N 0 0 368.418 3.819 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)Nc1ccc(Cl)c(OC(F)F)c1 ZINC000181400329 941150867 /nfs/dbraw/zinc/15/08/67/941150867.db2.gz OLYJGSPXEZVTSC-UHFFFAOYSA-N 0 0 372.711 3.867 20 5 FHBDRN C[C@@H](C(=O)N1CC2(CCCC2)OC(C)(C)C1)c1ccc([N+](=O)[O-])cc1F ZINC000189193004 941151157 /nfs/dbraw/zinc/15/11/57/941151157.db2.gz YWJMZSSJOUMCIV-CYBMUJFWSA-N 0 0 364.417 3.788 20 5 FHBDRN COc1ccc(Cn2ccc(NCc3ccc(C)c([N+](=O)[O-])c3)n2)cc1 ZINC000189270111 941154539 /nfs/dbraw/zinc/15/45/39/941154539.db2.gz DRHGRISETKNWLG-UHFFFAOYSA-N 0 0 352.394 3.769 20 5 FHBDRN Cc1c(NS(=O)(=O)c2ccc(CC(F)(F)F)cc2)cccc1[N+](=O)[O-] ZINC000189229380 941155007 /nfs/dbraw/zinc/15/50/07/941155007.db2.gz ZTZMGCWNWRDHDP-UHFFFAOYSA-N 0 0 374.340 3.809 20 5 FHBDRN CN(CC1(c2ccccc2)CC1)C(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000189238293 941155097 /nfs/dbraw/zinc/15/50/97/941155097.db2.gz FTBROPWKWVBSCD-UHFFFAOYSA-N 0 0 354.406 3.554 20 5 FHBDRN Cc1cnc([C@@H](C)NC(=O)c2ccc([N+](=O)[O-])cc2Br)s1 ZINC000177926663 941155145 /nfs/dbraw/zinc/15/51/45/941155145.db2.gz OKOKJNHCUJNZMS-MRVPVSSYSA-N 0 0 370.228 3.613 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N2CCN(C)c3ccc(F)cc32)c1 ZINC000072502890 941155290 /nfs/dbraw/zinc/15/52/90/941155290.db2.gz CJJNQNLEWIPOTP-UHFFFAOYSA-N 0 0 361.398 3.552 20 5 FHBDRN COC(=O)c1cc(C(=O)Nc2cccc(C(C)(F)F)c2)cc([N+](=O)[O-])c1 ZINC000189384540 941156888 /nfs/dbraw/zinc/15/68/88/941156888.db2.gz YUOCOVPQWFGEBN-UHFFFAOYSA-N 0 0 364.304 3.745 20 5 FHBDRN CCc1n[nH]c(C(=O)NCc2ccc(-c3ccccc3)c(C)c2)c1[N+](=O)[O-] ZINC000189468589 941158634 /nfs/dbraw/zinc/15/86/34/941158634.db2.gz OPBCOUGDQOAANI-UHFFFAOYSA-N 0 0 364.405 3.786 20 5 FHBDRN COC[C@@H](Cc1ccccc1)N(C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000189491889 941159027 /nfs/dbraw/zinc/15/90/27/941159027.db2.gz ACVYMEFPEHEVBM-MRXNPFEDSA-N 0 0 357.410 3.625 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1OC(=O)CCc1ccc(OC(F)F)cc1 ZINC000122211631 941159045 /nfs/dbraw/zinc/15/90/45/941159045.db2.gz LMMAUPDIYQBATJ-UHFFFAOYSA-N 0 0 367.304 3.743 20 5 FHBDRN COC[C@@H](Cc1ccccc1)N(C)C(=O)c1cccc(SC)c1[N+](=O)[O-] ZINC000189516972 941159519 /nfs/dbraw/zinc/15/95/19/941159519.db2.gz CBZDCNVRVRNFLS-OAHLLOKOSA-N 0 0 374.462 3.646 20 5 FHBDRN CCOC[C@@H](NC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-])C(C)C ZINC000189541579 941161088 /nfs/dbraw/zinc/16/10/88/941161088.db2.gz VYRDDJLEOSWYAQ-GFCCVEGCSA-N 0 0 360.863 3.518 20 5 FHBDRN COCCc1ccccc1NC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000189579363 941162460 /nfs/dbraw/zinc/16/24/60/941162460.db2.gz VMNJPOAUTZTIKL-UHFFFAOYSA-N 0 0 369.421 3.980 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)Nc1cccc2ccn(C)c21 ZINC000189593097 941166720 /nfs/dbraw/zinc/16/67/20/941166720.db2.gz UAHDBXWHCFZOEF-LBPRGKRZSA-N 0 0 368.393 3.534 20 5 FHBDRN C[C@H](C1CC1)n1cc(NC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)cn1 ZINC000189727483 941268941 /nfs/dbraw/zinc/26/89/41/941268941.db2.gz NIVPMNPQRWIXMF-GFCCVEGCSA-N 0 0 357.414 3.819 20 5 FHBDRN Cc1ccc(-c2nc(NC(=O)c3ccc(C(C)C)c([N+](=O)[O-])c3)n[nH]2)o1 ZINC000189757220 941273416 /nfs/dbraw/zinc/27/34/16/941273416.db2.gz JZWLRRLWRFOXGV-UHFFFAOYSA-N 0 0 355.354 3.657 20 5 FHBDRN CO[C@H](C)CNC(=O)c1cc([N+](=O)[O-])ccc1SCC1CCCC1 ZINC000189845023 941288426 /nfs/dbraw/zinc/28/84/26/941288426.db2.gz XASVXPOHQVAMPU-GFCCVEGCSA-N 0 0 352.456 3.642 20 5 FHBDRN CS(=O)(=O)c1cc([N+](=O)[O-])ccc1SCCCc1ccccc1 ZINC000189855853 941290095 /nfs/dbraw/zinc/29/00/95/941290095.db2.gz BJJYPJWCLPOPFL-UHFFFAOYSA-N 0 0 351.449 3.723 20 5 FHBDRN Cc1cc(C(F)(F)F)ccc1CNC(=O)c1cc([N+](=O)[O-])cnc1C ZINC000189856613 941290119 /nfs/dbraw/zinc/29/01/19/941290119.db2.gz LDIMKQLSVFAVCX-UHFFFAOYSA-N 0 0 353.300 3.555 20 5 FHBDRN COC[C@@H](Cc1ccccc1)N(C)C(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000189902739 941296904 /nfs/dbraw/zinc/29/69/04/941296904.db2.gz QCDRBAKGGMHECI-QGZVFWFLSA-N 0 0 357.410 3.625 20 5 FHBDRN Cc1sc(S(=O)(=O)N(c2ccccc2)[C@@H]2C[C@@H]2C)cc1[N+](=O)[O-] ZINC000414475092 941305640 /nfs/dbraw/zinc/30/56/40/941305640.db2.gz UEPCWFJQSKGGRT-GXFFZTMASA-N 0 0 352.437 3.568 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1C(=O)Nc1ccc2c(c1)CCCC(=O)N2 ZINC001125844596 941305933 /nfs/dbraw/zinc/30/59/33/941305933.db2.gz RUDIDGXLIJVRLU-UHFFFAOYSA-N 0 0 353.378 3.739 20 5 FHBDRN Cn1cccc1[C@@H]1CCCN1C(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000178833829 941311720 /nfs/dbraw/zinc/31/17/20/941311720.db2.gz AJHMWHPSEXVPGM-HNNXBMFYSA-N 0 0 367.327 3.929 20 5 FHBDRN COC(=O)c1oc(COc2c(Br)cccc2[N+](=O)[O-])cc1C ZINC000179115391 941336431 /nfs/dbraw/zinc/33/64/31/941336431.db2.gz HSUGWOWOAWRQLZ-UHFFFAOYSA-N 0 0 370.155 3.624 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1CNc1cccc([C@H](C)C(=O)OC)c1 ZINC000414484380 941349049 /nfs/dbraw/zinc/34/90/49/941349049.db2.gz HAOBZLXTFASGCX-ZDUSSCGKSA-N 0 0 358.394 3.882 20 5 FHBDRN C[C@H]1CN(c2c3cc(Br)ccc3ncc2[N+](=O)[O-])CCCO1 ZINC000408007475 941349964 /nfs/dbraw/zinc/34/99/64/941349964.db2.gz IIXBYAHOAOIHIH-JTQLQIEISA-N 0 0 366.215 3.521 20 5 FHBDRN C[C@@H]1C[C@@H]2CCCC[C@@H]2N1S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000180287513 941353875 /nfs/dbraw/zinc/35/38/75/941353875.db2.gz HCKNYCRRWJUXAT-MDZLAQPJSA-N 0 0 358.847 3.590 20 5 FHBDRN Cc1ccc(C(=O)O[C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])cc1Cl ZINC000728675894 941364766 /nfs/dbraw/zinc/36/47/66/941364766.db2.gz XAGQZARXPSTQBG-LLVKDONJSA-N 0 0 362.769 3.741 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N2C[C@H](C)Oc3ccc(Cl)cc32)c1 ZINC000072530950 941367698 /nfs/dbraw/zinc/36/76/98/941367698.db2.gz JJRSZSSJAZIFKW-JTQLQIEISA-N 0 0 362.769 3.685 20 5 FHBDRN CC(C)NC(=O)[C@@H](C)NCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000414548650 941377258 /nfs/dbraw/zinc/37/72/58/941377258.db2.gz YBURQJDYVBWHAX-LLVKDONJSA-N 0 0 365.817 3.511 20 5 FHBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CCS[C@@H](C)CC1 ZINC000408021975 941393895 /nfs/dbraw/zinc/39/38/95/941393895.db2.gz KOSQZRSMNNFMPD-VIFPVBQESA-N 0 0 373.272 3.633 20 5 FHBDRN Cc1cncn1C1CCN(c2ccc([N+](=O)[O-])c(OC(F)F)c2)CC1 ZINC000376742602 941410440 /nfs/dbraw/zinc/41/04/40/941410440.db2.gz OUKZYUPHIFXZIQ-UHFFFAOYSA-N 0 0 352.341 3.543 20 5 FHBDRN CC[C@H](C)[N@H+](CC(=O)[O-])Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000414680849 941435437 /nfs/dbraw/zinc/43/54/37/941435437.db2.gz LSXPYFDCWGZWLL-LBPRGKRZSA-N 0 0 362.382 3.549 20 5 FHBDRN C[C@@H](Oc1ccc(C(F)(F)F)cc1)C(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000188397833 941451519 /nfs/dbraw/zinc/45/15/19/941451519.db2.gz DRTRGLJNXQGXJR-LLVKDONJSA-N 0 0 368.311 3.697 20 5 FHBDRN C[C@H](C(=O)N1CC=C(c2cncc(F)c2)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000376892120 941460869 /nfs/dbraw/zinc/46/08/69/941460869.db2.gz HSVDSXCCBZSOGA-LBPRGKRZSA-N 0 0 373.359 3.687 20 5 FHBDRN CCOc1cn(-c2ccccc2)nc1C(=O)OCc1csc([N+](=O)[O-])c1 ZINC000728682119 941462450 /nfs/dbraw/zinc/46/24/50/941462450.db2.gz VQCLSKOARITXNN-UHFFFAOYSA-N 0 0 373.390 3.598 20 5 FHBDRN COc1ccc2c(c1)[C@@H](C(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1)CC2 ZINC000431838007 941476749 /nfs/dbraw/zinc/47/67/49/941476749.db2.gz ORZRZUALUFVHLS-KRWDZBQOSA-N 0 0 354.406 3.685 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@H]1[C@@H]2Cc3ccccc3[C@H]12 ZINC000563755033 941479930 /nfs/dbraw/zinc/47/99/30/941479930.db2.gz PHRPRVKRPDWAGN-SCTDSRPQSA-N 0 0 351.406 3.865 20 5 FHBDRN CCOc1cc(NC(=O)C2(OC)CCC(F)(F)CC2)ccc1[N+](=O)[O-] ZINC000892741584 941503478 /nfs/dbraw/zinc/50/34/78/941503478.db2.gz NFLKNABCWGSQBT-UHFFFAOYSA-N 0 0 358.341 3.527 20 5 FHBDRN CCC(=O)c1ccc(N[C@@H](C)c2nnc3n2CCCCC3)c([N+](=O)[O-])c1 ZINC000377094469 941514055 /nfs/dbraw/zinc/51/40/55/941514055.db2.gz VQKHGFUGGXGEBQ-LBPRGKRZSA-N 0 0 357.414 3.679 20 5 FHBDRN Cc1cccc(C(=O)N[C@@H](C)c2nccn2-c2ccccc2)c1[N+](=O)[O-] ZINC000377115570 941523886 /nfs/dbraw/zinc/52/38/86/941523886.db2.gz WMETWOLATFHLAJ-AWEZNQCLSA-N 0 0 350.378 3.580 20 5 FHBDRN Cc1cccc(C(=O)N[C@H](C)c2nccn2-c2ccccc2)c1[N+](=O)[O-] ZINC000377115571 941523968 /nfs/dbraw/zinc/52/39/68/941523968.db2.gz WMETWOLATFHLAJ-CQSZACIVSA-N 0 0 350.378 3.580 20 5 FHBDRN C[C@@H](NC(=O)c1cc(F)c([N+](=O)[O-])cc1F)c1nccn1-c1ccccc1 ZINC000377121061 941525261 /nfs/dbraw/zinc/52/52/61/941525261.db2.gz XXJBIVKWCTZLEQ-LLVKDONJSA-N 0 0 372.331 3.550 20 5 FHBDRN Cc1ccc(C(=O)Nc2ccc(Cl)cc2-n2cccn2)cc1[N+](=O)[O-] ZINC000472669844 941530854 /nfs/dbraw/zinc/53/08/54/941530854.db2.gz DMESOJQTPOMPCQ-UHFFFAOYSA-N 0 0 356.769 3.995 20 5 FHBDRN CC(=O)c1ccc([N+](=O)[O-])cc1N1CC[C@H](n2cc3ccccc3n2)C1 ZINC000377192993 941551502 /nfs/dbraw/zinc/55/15/02/941551502.db2.gz NKEOVXHFNSDMIM-INIZCTEOSA-N 0 0 350.378 3.599 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)N[C@@H]1[C@H]2CCc3ccccc3[C@@H]12 ZINC000549165412 941565431 /nfs/dbraw/zinc/56/54/31/941565431.db2.gz DKMLIJURVWWASR-XUVXKRRUSA-N 0 0 365.433 3.507 20 5 FHBDRN Cc1cc(N[C@H](CO)c2ccsc2)c(Br)cc1[N+](=O)[O-] ZINC000302652785 941573799 /nfs/dbraw/zinc/57/37/99/941573799.db2.gz GVHMMLJXSIXNDN-GFCCVEGCSA-N 0 0 357.229 3.873 20 5 FHBDRN Cc1ccccc1-c1nc(CN(C)CCc2cccc([N+](=O)[O-])c2)no1 ZINC000549169580 941576861 /nfs/dbraw/zinc/57/68/61/941576861.db2.gz ZYHTYVBBEDIRSY-UHFFFAOYSA-N 0 0 352.394 3.628 20 5 FHBDRN O=[N+]([O-])c1cc(CNc2ccc3nccnc3c2Br)cs1 ZINC000313727638 941587904 /nfs/dbraw/zinc/58/79/04/941587904.db2.gz LNIHITJEORAXNN-UHFFFAOYSA-N 0 0 365.212 3.974 20 5 FHBDRN COc1ccc(NC(=O)N[C@@H](C)COc2cccc(C)c2)cc1[N+](=O)[O-] ZINC000541106440 941597586 /nfs/dbraw/zinc/59/75/86/941597586.db2.gz RVMMWGATSRSGRO-ZDUSSCGKSA-N 0 0 359.382 3.501 20 5 FHBDRN CC(C)(C)O[C@@H]1C[C@H](NCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1(C)C ZINC000412065098 941619513 /nfs/dbraw/zinc/61/95/13/941619513.db2.gz FNTQETBUEHIDJO-LSDHHAIUSA-N 0 0 374.441 3.717 20 5 FHBDRN CC(=O)N(C)c1ccc(C(=O)N2CCCCc3cc([N+](=O)[O-])ccc32)cc1 ZINC000892852910 941620077 /nfs/dbraw/zinc/62/00/77/941620077.db2.gz FWRHHVPSGSWRJT-UHFFFAOYSA-N 0 0 367.405 3.561 20 5 FHBDRN O=C(Nc1csc2ccccc12)C(=O)Nc1cc(F)cc([N+](=O)[O-])c1 ZINC000472715888 941624415 /nfs/dbraw/zinc/62/44/15/941624415.db2.gz PSSWBQZIAIVFFL-UHFFFAOYSA-N 0 0 359.338 3.526 20 5 FHBDRN COc1ccc(CCNc2nccc(C)c2[N+](=O)[O-])c(Cl)c1OC ZINC000549198852 941629220 /nfs/dbraw/zinc/62/92/20/941629220.db2.gz XIGOWTHODCUUBS-UHFFFAOYSA-N 0 0 351.790 3.623 20 5 FHBDRN CC(C)Cn1ccnc1CN[C@@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F ZINC000565658099 941631260 /nfs/dbraw/zinc/63/12/60/941631260.db2.gz YSCMJKHTNZCNEG-HNNXBMFYSA-N 0 0 356.348 3.841 20 5 FHBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N1CCC[C@@H]1c1ccsc1 ZINC000146819524 941637841 /nfs/dbraw/zinc/63/78/41/941637841.db2.gz OBOIXUXAXIDVKU-GFCCVEGCSA-N 0 0 372.855 3.836 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CCCc3cc(F)c(F)cc32)c1 ZINC000549210899 941646771 /nfs/dbraw/zinc/64/67/71/941646771.db2.gz QFSUJWBHTQNQPW-UHFFFAOYSA-N 0 0 362.332 3.865 20 5 FHBDRN O=C(NC[C@H](O)COc1ccccc1)c1cc2ccccc2c2cccnc12 ZINC000613664712 941649569 /nfs/dbraw/zinc/64/95/69/941649569.db2.gz JOOGRSODHJJXAP-KRWDZBQOSA-N 0 0 372.424 3.558 20 5 FHBDRN CC(=O)c1sc(NC(=O)c2cc([N+](=O)[O-])cn2C)nc1-c1ccccc1 ZINC000024470329 941661074 /nfs/dbraw/zinc/66/10/74/941661074.db2.gz DLLMJAZYACXPEX-UHFFFAOYSA-N 0 0 370.390 3.512 20 5 FHBDRN O=C(Nc1ccnn1-c1ccc([N+](=O)[O-])cc1)[C@H]1CC[C@H](C(F)(F)F)C1 ZINC000565898926 941667850 /nfs/dbraw/zinc/66/78/50/941667850.db2.gz ZKJYPJCZFJXMQK-QWRGUYRKSA-N 0 0 368.315 3.698 20 5 FHBDRN COc1ccc(OCCn2ccc(-c3ccc(F)cc3)n2)c([N+](=O)[O-])c1 ZINC000541124655 941672617 /nfs/dbraw/zinc/67/26/17/941672617.db2.gz ZAWPFLXYZAUIEV-UHFFFAOYSA-N 0 0 357.341 3.685 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N[C@H]1CCCc2cc(N)ccc21 ZINC000415251734 941703420 /nfs/dbraw/zinc/70/34/20/941703420.db2.gz AAYLLPJDPAFCIL-INIZCTEOSA-N 0 0 354.410 3.993 20 5 FHBDRN Cc1c(NC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)cnn1CCC(C)C ZINC000122394113 941714130 /nfs/dbraw/zinc/71/41/30/941714130.db2.gz ASFQMHXXNXDTNZ-UHFFFAOYSA-N 0 0 364.833 3.980 20 5 FHBDRN CCc1nc([C@@H](C)NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)cs1 ZINC000181784614 941725114 /nfs/dbraw/zinc/72/51/14/941725114.db2.gz DVZFIGPCWDIIBH-MRVPVSSYSA-N 0 0 371.365 3.706 20 5 FHBDRN CCCCn1ncc(NC(=O)CCCNc2ccc([N+](=O)[O-])cc2)c1C ZINC000122441817 941736184 /nfs/dbraw/zinc/73/61/84/941736184.db2.gz FVGSSUBZRYHKJE-UHFFFAOYSA-N 0 0 359.430 3.731 20 5 FHBDRN O=C(CCNc1ncccc1[N+](=O)[O-])Nc1cc(Cl)cc(Cl)c1 ZINC000549248047 941738458 /nfs/dbraw/zinc/73/84/58/941738458.db2.gz JNGLTRXTCTXJJO-UHFFFAOYSA-N 0 0 355.181 3.737 20 5 FHBDRN O=C(c1ccccc1)N1CCC[C@H]1c1nc(-c2ccc([N+](=O)[O-])s2)no1 ZINC000377460568 941741007 /nfs/dbraw/zinc/74/10/07/941741007.db2.gz RRAFYHVBOFSZFQ-LBPRGKRZSA-N 0 0 370.390 3.684 20 5 FHBDRN CC[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1F)c1ccc(OC)c(OC)c1 ZINC000583619232 941753163 /nfs/dbraw/zinc/75/31/63/941753163.db2.gz CKOKKUOOFRHHAV-OAHLLOKOSA-N 0 0 362.357 3.632 20 5 FHBDRN Cc1cc(C(=O)COc2ccc(Br)cc2[N+](=O)[O-])c(C)[nH]1 ZINC000151149042 941760459 /nfs/dbraw/zinc/76/04/59/941760459.db2.gz WZXRAQZZBSMTAT-UHFFFAOYSA-N 0 0 353.172 3.564 20 5 FHBDRN COc1ccccc1C1(CNC(=O)c2csc([N+](=O)[O-])c2)CCCC1 ZINC000500980650 941761879 /nfs/dbraw/zinc/76/18/79/941761879.db2.gz ZKOJIAMGPKPTHQ-UHFFFAOYSA-N 0 0 360.435 3.907 20 5 FHBDRN O=C(c1ccc(NC2CC2)c([N+](=O)[O-])c1)N1CCc2ccc(F)cc2C1 ZINC000433561333 941763247 /nfs/dbraw/zinc/76/32/47/941763247.db2.gz BKDJKBKRTOESER-UHFFFAOYSA-N 0 0 355.369 3.507 20 5 FHBDRN O=[N+]([O-])c1cccc(OC[C@H](O)CSc2ccc3ccccc3n2)c1 ZINC000015232415 941764803 /nfs/dbraw/zinc/76/48/03/941764803.db2.gz NEBSLHXUTTUBKW-HNNXBMFYSA-N 0 0 356.403 3.675 20 5 FHBDRN C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CCC[C@@H]1c1nccs1 ZINC000377503254 941769954 /nfs/dbraw/zinc/76/99/54/941769954.db2.gz RFQQKLFYSVRGFD-SMDDNHRTSA-N 0 0 371.422 3.999 20 5 FHBDRN C[C@H]1CCC[C@]1(O)CNc1cc(C(F)(F)C(F)(F)F)ncc1[N+](=O)[O-] ZINC000549262185 941783660 /nfs/dbraw/zinc/78/36/60/941783660.db2.gz ZVSVFGBRUJLVIF-UFBFGSQYSA-N 0 0 369.290 3.607 20 5 FHBDRN CC1(C)CN(C(=O)c2ccc(Sc3ccc([N+](=O)[O-])cc3)cc2)C[C@H]1O ZINC000468598317 941795035 /nfs/dbraw/zinc/79/50/35/941795035.db2.gz GMVHKMUDENADRK-QGZVFWFLSA-N 0 0 372.446 3.589 20 5 FHBDRN CC(C)C(=O)c1ccc([C@H](C)C(=O)NCCc2ccccc2[N+](=O)[O-])cc1 ZINC000549267817 941798154 /nfs/dbraw/zinc/79/81/54/941798154.db2.gz NFIWDMJLVWPWLN-HNNXBMFYSA-N 0 0 368.433 3.896 20 5 FHBDRN O=[N+]([O-])c1cc(F)ccc1Sc1nnc2ccc(Br)cn21 ZINC000549267599 941798825 /nfs/dbraw/zinc/79/88/25/941798825.db2.gz LUYDHJRQKSOXDZ-UHFFFAOYSA-N 0 0 369.175 3.690 20 5 FHBDRN O=[N+]([O-])c1cnn(CCc2nc(C3CCC(c4ccccc4)CC3)no2)c1 ZINC000453201042 941800568 /nfs/dbraw/zinc/80/05/68/941800568.db2.gz SBDKIYBHOIGVRO-UHFFFAOYSA-N 0 0 367.409 3.858 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N2CCC[C@@H]2c2ccc(C)o2)c1F ZINC000412121886 941804525 /nfs/dbraw/zinc/80/45/25/941804525.db2.gz DATMHFMTSBFLET-CQSZACIVSA-N 0 0 362.357 3.550 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CCc2c(Cl)cccc2C1 ZINC000412124449 941808410 /nfs/dbraw/zinc/80/84/10/941808410.db2.gz NGUAHXZEFLJUSG-DLBZAZTESA-N 0 0 356.809 3.937 20 5 FHBDRN CC[C@H](Cc1ccccc1)N(C)C(=O)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC000412126659 941810299 /nfs/dbraw/zinc/81/02/99/941810299.db2.gz FFBYCDDJLPPHAK-OAHLLOKOSA-N 0 0 374.412 3.765 20 5 FHBDRN Cn1cnc([N+](=O)[O-])c1NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 ZINC000025572972 941832673 /nfs/dbraw/zinc/83/26/73/941832673.db2.gz JBOJUDKRBBQEBR-RNFRBKRXSA-N 0 0 360.258 3.650 20 5 FHBDRN Cc1csc([C@H](NC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)C2CC2)n1 ZINC000412140626 941834929 /nfs/dbraw/zinc/83/49/29/941834929.db2.gz VETONOXQRVBOSS-ARFHVFGLSA-N 0 0 357.435 3.731 20 5 FHBDRN Cc1ccc(NCCCNC(=O)[C@@H]2CC[C@H](C(F)(F)F)C2)c([N+](=O)[O-])c1 ZINC000513312234 941840250 /nfs/dbraw/zinc/84/02/50/941840250.db2.gz MQUOIKMPRCHQOY-OLZOCXBDSA-N 0 0 373.375 3.800 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N2C[C@H](C)[C@H]2c2ccccc2)c1F ZINC000412144829 941841274 /nfs/dbraw/zinc/84/12/74/941841274.db2.gz CAUBYEOMHANBOX-BUXKBTBVSA-N 0 0 358.369 3.505 20 5 FHBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)c1cc(-c2cccnc2)on1 ZINC000118687282 941842248 /nfs/dbraw/zinc/84/22/48/941842248.db2.gz CYWAJQLXFMSEET-UHFFFAOYSA-N 0 0 358.741 3.859 20 5 FHBDRN CC(C)(C)Oc1ccccc1N[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000433712311 941846139 /nfs/dbraw/zinc/84/61/39/941846139.db2.gz HMAMUVQMYXXCOV-KRWDZBQOSA-N 0 0 369.421 3.990 20 5 FHBDRN CC(C)(C)Oc1ccccc1N[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000433712313 941846295 /nfs/dbraw/zinc/84/62/95/941846295.db2.gz HMAMUVQMYXXCOV-QGZVFWFLSA-N 0 0 369.421 3.990 20 5 FHBDRN Cc1oc(C2CC2)nc1C(=O)N1CCS[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000513317828 941851949 /nfs/dbraw/zinc/85/19/49/941851949.db2.gz PEYGWLQDTPIOBM-KRWDZBQOSA-N 0 0 359.407 3.656 20 5 FHBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])NCCCc1nccs1 ZINC000583958950 941852941 /nfs/dbraw/zinc/85/29/41/941852941.db2.gz IDJSLMGWXDZFRA-UHFFFAOYSA-N 0 0 371.871 3.546 20 5 FHBDRN Cc1ccc(C(=O)N2CCC(Sc3ccccn3)CC2)cc1[N+](=O)[O-] ZINC000365621753 941854036 /nfs/dbraw/zinc/85/40/36/941854036.db2.gz FFBQNRHKSPQRGI-UHFFFAOYSA-N 0 0 357.435 3.695 20 5 FHBDRN CN(C)c1nc2ccc(NC(=O)[C@@H]3C[C@H]3c3ccc([N+](=O)[O-])cc3)cc2o1 ZINC000412161377 941856629 /nfs/dbraw/zinc/85/66/29/941856629.db2.gz AVSLHPNAPUSXAM-LSDHHAIUSA-N 0 0 366.377 3.544 20 5 FHBDRN C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F)c1ccncc1F ZINC000513333928 941858398 /nfs/dbraw/zinc/85/83/98/941858398.db2.gz RQQZRWXSVPCLOJ-MRVPVSSYSA-N 0 0 357.263 3.639 20 5 FHBDRN COc1cc(C(=O)N2CCC3(CCCC3)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000365630682 941860128 /nfs/dbraw/zinc/86/01/28/941860128.db2.gz XRGMJQZRYJVKGZ-UHFFFAOYSA-N 0 0 370.352 3.611 20 5 FHBDRN Cc1n[nH]c(C(=O)N[C@@H](C)c2ccc(Oc3ccccc3)cc2)c1[N+](=O)[O-] ZINC000513347857 941860446 /nfs/dbraw/zinc/86/04/46/941860446.db2.gz FMXKTBWLGVAJOU-LBPRGKRZSA-N 0 0 366.377 3.910 20 5 FHBDRN CCN(C(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-])[C@@H](C)Cc1ccc(OC)cc1 ZINC000433743059 941860837 /nfs/dbraw/zinc/86/08/37/941860837.db2.gz VAHCGAKHMADJGT-ZDUSSCGKSA-N 0 0 374.441 3.543 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)c1sccc1-n1cccc1 ZINC000513349279 941860955 /nfs/dbraw/zinc/86/09/55/941860955.db2.gz VURMJAQSAVNZFM-UHFFFAOYSA-N 0 0 355.419 3.762 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N[C@H](C)c2ccc(C)c(F)c2)c1F ZINC000412174402 941863494 /nfs/dbraw/zinc/86/34/94/941863494.db2.gz PJZAUJODZNJIPJ-LLVKDONJSA-N 0 0 364.348 3.610 20 5 FHBDRN CSCc1cc(C(=O)N(C)CCc2cccc([N+](=O)[O-])c2)ccc1F ZINC000513343206 941864459 /nfs/dbraw/zinc/86/44/59/941864459.db2.gz NVENRXWRYSACJQ-UHFFFAOYSA-N 0 0 362.426 3.912 20 5 FHBDRN O=[N+]([O-])c1ccc(C[N@@H+]2C[C@@H](c3ccc(Cl)cc3)[C@H](CO)C2)cc1F ZINC000377647775 941867898 /nfs/dbraw/zinc/86/78/98/941867898.db2.gz SRXHCTHHWYMWKC-HOCLYGCPSA-N 0 0 364.804 3.595 20 5 FHBDRN Cc1cn([C@@H](C)c2ccccc2)[nH]c1=NC(=O)c1cc(F)cc([N+](=O)[O-])c1 ZINC000472822059 941870508 /nfs/dbraw/zinc/87/05/08/941870508.db2.gz FSHIBZZRRKSHCO-ZDUSSCGKSA-N 0 0 368.368 3.522 20 5 FHBDRN CCOc1cc(OCCCn2c(=O)[nH]c3ccccc32)ccc1[N+](=O)[O-] ZINC000616230372 941878802 /nfs/dbraw/zinc/87/88/02/941878802.db2.gz MXTHQMWFTYXLOQ-UHFFFAOYSA-N 0 0 357.366 3.518 20 5 FHBDRN CC(C)N1CC[C@@H](Nc2cc([N+](=O)[O-])ccc2Nc2ccccc2)C1=O ZINC000433761358 941880336 /nfs/dbraw/zinc/88/03/36/941880336.db2.gz AGWCDMOCLBPEQO-QGZVFWFLSA-N 0 0 354.410 3.760 20 5 FHBDRN CC(C)(C(=O)N1CCc2ccc(F)cc2C1)c1ccc([N+](=O)[O-])cc1F ZINC000545830021 941880371 /nfs/dbraw/zinc/88/03/71/941880371.db2.gz XESSJVNYGVIAPX-UHFFFAOYSA-N 0 0 360.360 3.736 20 5 FHBDRN CC(C)c1[nH]nc(C(=O)Nc2ccc(Oc3ccccc3)cn2)c1[N+](=O)[O-] ZINC000433766636 941883721 /nfs/dbraw/zinc/88/37/21/941883721.db2.gz OVPOKRAIFIELHR-UHFFFAOYSA-N 0 0 367.365 3.881 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)[C@@H](C)Cc1cnc2ccccc2n1 ZINC000549299279 941885323 /nfs/dbraw/zinc/88/53/23/941885323.db2.gz GEVXFJKORMIQBZ-AWEZNQCLSA-N 0 0 364.405 3.972 20 5 FHBDRN CC(C)N(CC(=O)N1c2ccccc2C[C@H]1C)Cc1ccc([N+](=O)[O-])cc1 ZINC000513391484 941887790 /nfs/dbraw/zinc/88/77/90/941887790.db2.gz CLDAGPWSTUWXPD-MRXNPFEDSA-N 0 0 367.449 3.783 20 5 FHBDRN COc1c(C)cnc(CN(C)c2ccc([N+](=O)[O-])c(OC(F)F)c2)c1C ZINC000433783153 941889526 /nfs/dbraw/zinc/88/95/26/941889526.db2.gz NTCUKGCNBODCSL-UHFFFAOYSA-N 0 0 367.352 3.853 20 5 FHBDRN COc1ccc(OCCOc2ccc(C(C)=O)cc2Cl)c([N+](=O)[O-])c1 ZINC000119536750 941889876 /nfs/dbraw/zinc/88/98/76/941889876.db2.gz IGZODIKQERDZNG-UHFFFAOYSA-N 0 0 365.769 3.917 20 5 FHBDRN CCC[C@H]1CCC[C@H]1c1nc(-c2ccc(-n3cncn3)c([N+](=O)[O-])c2)no1 ZINC000453207166 941890402 /nfs/dbraw/zinc/89/04/02/941890402.db2.gz ZCXRYOXRUUHVMU-GXTWGEPZSA-N 0 0 368.397 3.909 20 5 FHBDRN CC(C)N(CC(=O)N([C@@H](C)C1CC1)C1CC1)Cc1ccc([N+](=O)[O-])cc1 ZINC000513397188 941890926 /nfs/dbraw/zinc/89/09/26/941890926.db2.gz JUDRYIQZYJDGQS-HNNXBMFYSA-N 0 0 359.470 3.595 20 5 FHBDRN CC[C@@H](NCc1ccc(O)c(OC)c1[N+](=O)[O-])c1cc(F)ccc1F ZINC000893019866 941894976 /nfs/dbraw/zinc/89/49/76/941894976.db2.gz UBSSVWQUQNQNQV-CQSZACIVSA-N 0 0 352.337 3.828 20 5 FHBDRN C[C@H](NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)c1ccncc1F ZINC000513399106 941894984 /nfs/dbraw/zinc/89/49/84/941894984.db2.gz GKYLOYGWDZVNKH-JTQLQIEISA-N 0 0 372.381 3.743 20 5 FHBDRN CO[C@H]1CC[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2NCc2ccccc2)C1 ZINC000472832162 941895761 /nfs/dbraw/zinc/89/57/61/941895761.db2.gz ZVGVDDZMRHALRJ-RDJZCZTQSA-N 0 0 369.421 3.504 20 5 FHBDRN CC(C)Oc1cc(C(=O)N(C)Cc2cccc(N(C)C)c2)ccc1[N+](=O)[O-] ZINC000412192999 941896237 /nfs/dbraw/zinc/89/62/37/941896237.db2.gz DLFGRPLLXYAHTI-UHFFFAOYSA-N 0 0 371.437 3.720 20 5 FHBDRN CC(C)N(CC(=O)N(C)CC1CCCCC1)Cc1ccc([N+](=O)[O-])cc1 ZINC000513400890 941896963 /nfs/dbraw/zinc/89/69/63/941896963.db2.gz HBZMPVPDWQTDKS-UHFFFAOYSA-N 0 0 361.486 3.844 20 5 FHBDRN Cc1ccc(NC(=O)Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)cc1C ZINC000103463434 941897366 /nfs/dbraw/zinc/89/73/66/941897366.db2.gz BAYFCDQDIPBOQW-UHFFFAOYSA-N 0 0 350.378 3.714 20 5 FHBDRN CCc1nn(C)c(N(C)Cc2ccc(Br)cc2C)c1[N+](=O)[O-] ZINC000433808297 941905750 /nfs/dbraw/zinc/90/57/50/941905750.db2.gz BWFXNYWZJIRCKH-UHFFFAOYSA-N 0 0 367.247 3.598 20 5 FHBDRN O=[N+]([O-])c1cncc(Br)c1N1CC[C@@H](CC(F)(F)F)C1 ZINC000433810075 941905780 /nfs/dbraw/zinc/90/57/80/941905780.db2.gz YBPMEQIEEZSWCA-ZETCQYMHSA-N 0 0 354.126 3.531 20 5 FHBDRN C[C@@H]([C@@H]1Cc2ccccc2O1)N(C)C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412201418 941906356 /nfs/dbraw/zinc/90/63/56/941906356.db2.gz QWHGHQXDUKXCGN-NTCOEUGSSA-N 0 0 366.417 3.549 20 5 FHBDRN O=C(N[C@@H]1CCOC2(CCCCC2)C1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412203969 941912441 /nfs/dbraw/zinc/91/24/41/941912441.db2.gz KRUYAIIQYQJKLO-BPQIPLTHSA-N 0 0 358.438 3.696 20 5 FHBDRN CCOc1ccc(-c2nc([C@H](Cc3ccccc3)OC)no2)cc1[N+](=O)[O-] ZINC000453209240 941913746 /nfs/dbraw/zinc/91/37/46/941913746.db2.gz JXMCEKUAKJVQPY-KRWDZBQOSA-N 0 0 369.377 3.974 20 5 FHBDRN CCc1ccc2c(c1)[C@H](OC(=O)c1cc3c(cc1[N+](=O)[O-])OCO3)CCO2 ZINC001267682653 941919968 /nfs/dbraw/zinc/91/99/68/941919968.db2.gz JUQYABAFEIOOCZ-MRXNPFEDSA-N 0 0 371.345 3.567 20 5 FHBDRN O=C(N[C@@H]1CCO[C@@H]1c1ccc(Cl)cc1)c1ccc([N+](=O)[O-])cc1F ZINC000182456375 941926431 /nfs/dbraw/zinc/92/64/31/941926431.db2.gz XSBFTIQPACWEMN-HZPDHXFCSA-N 0 0 364.760 3.647 20 5 FHBDRN CC(=O)Nc1cccc([C@@H](C)NCc2nc3cc([N+](=O)[O-])ccc3o2)c1 ZINC000182537293 941931237 /nfs/dbraw/zinc/93/12/37/941931237.db2.gz FHOFRCBAWBGMKU-LLVKDONJSA-N 0 0 354.366 3.545 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCO[C@H]1c1ccc(Cl)cc1 ZINC000182467967 941932234 /nfs/dbraw/zinc/93/22/34/941932234.db2.gz XMWRLYNIABBBLN-SJORKVTESA-N 0 0 360.797 3.817 20 5 FHBDRN Cc1cn([C@@H](C)c2ccccc2)[nH]c1=NC(=O)c1cccc([N+](=O)[O-])c1C ZINC000472855198 941953894 /nfs/dbraw/zinc/95/38/94/941953894.db2.gz UFLXLWNURUMIRT-HNNXBMFYSA-N 0 0 364.405 3.692 20 5 FHBDRN CCC[C@H]1C[C@H](C(=O)Nc2cc(C)nn2-c2ccc([N+](=O)[O-])cc2)CCO1 ZINC000182773904 941959453 /nfs/dbraw/zinc/95/94/53/941959453.db2.gz IVCBMERWXGBDCS-PBHICJAKSA-N 0 0 372.425 3.623 20 5 FHBDRN O=C(N[C@@H](c1c(F)cccc1F)C(F)(F)F)c1ccccc1[N+](=O)[O-] ZINC000182753211 941964510 /nfs/dbraw/zinc/96/45/10/941964510.db2.gz ZUHGLERRXLZJKX-ZDUSSCGKSA-N 0 0 360.238 3.906 20 5 FHBDRN CC(=O)N1CCN(Cc2ccc(Cl)cc2[N+](=O)[O-])CC12CCCCC2 ZINC000408048512 941970122 /nfs/dbraw/zinc/97/01/22/941970122.db2.gz YQDBUARAJIOUAM-UHFFFAOYSA-N 0 0 365.861 3.615 20 5 FHBDRN CCc1ccc2c(c1)[C@H](OC(=O)c1n[nH]c3ccc([N+](=O)[O-])cc31)CCO2 ZINC001267692679 941970223 /nfs/dbraw/zinc/97/02/23/941970223.db2.gz WUKDUBVZHVSCFI-QGZVFWFLSA-N 0 0 367.361 3.714 20 5 FHBDRN CCn1cc([C@H]2OCCC[C@@H]2Nc2nc3ccccc3cc2[N+](=O)[O-])cn1 ZINC000473530545 941972400 /nfs/dbraw/zinc/97/24/00/941972400.db2.gz ZNBWBSZMSSSZEJ-FUHWJXTLSA-N 0 0 367.409 3.692 20 5 FHBDRN O=C(N[C@H](c1cccc(OC(F)(F)F)c1)C1CC1)c1cc([N+](=O)[O-])c[nH]1 ZINC000513503731 941975904 /nfs/dbraw/zinc/97/59/04/941975904.db2.gz XCINVEOTYSEZST-AWEZNQCLSA-N 0 0 369.299 3.703 20 5 FHBDRN CCc1ccc(NC(=S)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000006941263 941976315 /nfs/dbraw/zinc/97/63/15/941976315.db2.gz KYQZQQXBARHYPU-UHFFFAOYSA-N 0 0 370.478 3.676 20 5 FHBDRN CSc1ccc(C(=O)N2C[C@@H](C)C[C@H]2c2cccnc2)cc1[N+](=O)[O-] ZINC000182836271 941978366 /nfs/dbraw/zinc/97/83/66/941978366.db2.gz NQVBOVFTGOVQTN-WFASDCNBSA-N 0 0 357.435 3.935 20 5 FHBDRN Cc1ccc(SC[C@H](C)NC(=O)NCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000472863174 941985223 /nfs/dbraw/zinc/98/52/23/941985223.db2.gz STRWKRZBTPBKFD-AWEZNQCLSA-N 0 0 359.451 3.883 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N(C)Cc1cn(C)nc1C(F)(F)F ZINC000182920329 941988243 /nfs/dbraw/zinc/98/82/43/941988243.db2.gz OIBACJHXPKQYGF-LLVKDONJSA-N 0 0 356.348 3.849 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N(C)Cc1cn(C)nc1C(F)(F)F ZINC000182920347 941988284 /nfs/dbraw/zinc/98/82/84/941988284.db2.gz OIBACJHXPKQYGF-NSHDSACASA-N 0 0 356.348 3.849 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N2CC[C@@H](c3cccc(C)c3)C2)c1F ZINC000412258991 941988911 /nfs/dbraw/zinc/98/89/11/941988911.db2.gz SEALFMGYIMJXCM-OAHLLOKOSA-N 0 0 372.396 3.610 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N1CCC[C@H]1Cn1ccnc1C(C)C ZINC000377797560 941994462 /nfs/dbraw/zinc/99/44/62/941994462.db2.gz XLYWLTWIQKFKBO-INIZCTEOSA-N 0 0 356.426 3.528 20 5 FHBDRN CSc1cccc(N(C)S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])c1 ZINC000101849596 942014730 /nfs/dbraw/zinc/01/47/30/942014730.db2.gz NZZSYAXJJWFHFE-UHFFFAOYSA-N 0 0 372.855 3.795 20 5 FHBDRN O=C(Nc1cccnc1C(F)(F)F)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000415712513 942015336 /nfs/dbraw/zinc/01/53/36/942015336.db2.gz UJDPSVIULKTXBI-NWDGAFQWSA-N 0 0 351.284 3.751 20 5 FHBDRN Cc1noc(-c2ccccc2)c1NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000122657007 942015777 /nfs/dbraw/zinc/01/57/77/942015777.db2.gz RXQJPWRUDUZOGK-UHFFFAOYSA-N 0 0 368.305 3.719 20 5 FHBDRN COc1ccc(C(=O)N2CCC[C@@H]2Cc2ccccc2C)cc1[N+](=O)[O-] ZINC000513567377 942020512 /nfs/dbraw/zinc/02/05/12/942020512.db2.gz ROFGWSBIEINAKH-QGZVFWFLSA-N 0 0 354.406 3.759 20 5 FHBDRN CC[C@@H]1Cc2ccccc2CN1C(=O)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC000412276565 942023124 /nfs/dbraw/zinc/02/31/24/942023124.db2.gz UOTCARMNZMYJEK-OAHLLOKOSA-N 0 0 372.396 3.649 20 5 FHBDRN O=C(c1ccc(C(F)(F)F)nc1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000163799287 942025585 /nfs/dbraw/zinc/02/55/85/942025585.db2.gz RLRDRJPDQDRXTP-UHFFFAOYSA-N 0 0 365.311 3.813 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])c[nH]c1=O)N1Cc2ccccc2-c2ccccc2C1 ZINC000101959574 942028658 /nfs/dbraw/zinc/02/86/58/942028658.db2.gz ZYIDPSXDXMSFCB-UHFFFAOYSA-N 0 0 361.357 3.518 20 5 FHBDRN Cc1ccc([C@@]2(C)CCN(C(=O)NCc3ccccc3[N+](=O)[O-])C2)cc1 ZINC000434003596 942029297 /nfs/dbraw/zinc/02/92/97/942029297.db2.gz UKONELAYERVDTB-FQEVSTJZSA-N 0 0 353.422 3.776 20 5 FHBDRN CC[C@H](C)COc1cc([N+](=O)[O-])c(Cn2cccc(C)c2=O)cc1OC ZINC000513591214 942030140 /nfs/dbraw/zinc/03/01/40/942030140.db2.gz DCAVRKXCYJSOED-ZDUSSCGKSA-N 0 0 360.410 3.547 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1Cl)N1CCOC[C@@H]1c1ccccc1 ZINC000377872598 942044534 /nfs/dbraw/zinc/04/45/34/942044534.db2.gz FSBIDYRMRWWYCV-OAHLLOKOSA-N 0 0 361.785 3.854 20 5 FHBDRN Cc1nn(CCC(=O)Nc2cccc(OCCC(C)C)c2)c(C)c1[N+](=O)[O-] ZINC000102242026 942045184 /nfs/dbraw/zinc/04/51/84/942045184.db2.gz GNIOVEWURSLDNP-UHFFFAOYSA-N 0 0 374.441 3.862 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1CCC(F)(c2ccccc2)CC1 ZINC000434038177 942049756 /nfs/dbraw/zinc/04/97/56/942049756.db2.gz VRSGVOJLZBQJQP-UHFFFAOYSA-N 0 0 358.369 3.704 20 5 FHBDRN Cc1nn(CCC(=O)N(C)Cc2csc3ccccc23)c(C)c1[N+](=O)[O-] ZINC000102332414 942052487 /nfs/dbraw/zinc/05/24/87/942052487.db2.gz FMBORQYEKKMYLP-UHFFFAOYSA-N 0 0 372.450 3.672 20 5 FHBDRN COc1ccccc1-c1noc(-c2ccc(OC(F)F)c([N+](=O)[O-])c2)n1 ZINC000513628932 942054302 /nfs/dbraw/zinc/05/43/02/942054302.db2.gz DCBHXWAKKCJOKX-UHFFFAOYSA-N 0 0 363.276 3.922 20 5 FHBDRN Cn1ccnc1[C@H](NCc1cccc(Cl)c1)c1ccc([N+](=O)[O-])cc1 ZINC000513655752 942058166 /nfs/dbraw/zinc/05/81/66/942058166.db2.gz OENRVEVIVIKCHD-QGZVFWFLSA-N 0 0 356.813 3.861 20 5 FHBDRN COCCN(C(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1)[C@H]1CC[C@H](C)C1 ZINC000412286701 942065551 /nfs/dbraw/zinc/06/55/51/942065551.db2.gz HUIWCIDSFXAHER-HOCLYGCPSA-N 0 0 364.442 3.659 20 5 FHBDRN CC(C)Oc1cc(C(=O)N(C)Cc2cc(F)cc(F)c2)ccc1[N+](=O)[O-] ZINC000412287401 942066142 /nfs/dbraw/zinc/06/61/42/942066142.db2.gz DVGLYYNQMSCPOR-UHFFFAOYSA-N 0 0 364.348 3.932 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CC[C@H](CC(F)(F)F)C2)ccc1[N+](=O)[O-] ZINC000412290515 942067508 /nfs/dbraw/zinc/06/75/08/942067508.db2.gz JCMSPSLHAPVMSN-LLVKDONJSA-N 0 0 360.332 3.797 20 5 FHBDRN COc1cc(C)cc(NC(=O)Cc2c(F)c(OC)ccc2[N+](=O)[O-])c1C ZINC000412290777 942067825 /nfs/dbraw/zinc/06/78/25/942067825.db2.gz QEJGCYMLMTZFMB-UHFFFAOYSA-N 0 0 362.357 3.549 20 5 FHBDRN C[C@@H](c1ccc(Cl)cc1)N(C)C(=O)COc1ccc(F)cc1[N+](=O)[O-] ZINC000102599549 942072466 /nfs/dbraw/zinc/07/24/66/942072466.db2.gz SBGDMNCARLDXPB-NSHDSACASA-N 0 0 366.776 3.986 20 5 FHBDRN C[C@H](Nc1ncc(Cl)cc1[N+](=O)[O-])c1ccc(Br)cn1 ZINC000480846884 942073408 /nfs/dbraw/zinc/07/34/08/942073408.db2.gz TYZVTKOAGGQNRB-ZETCQYMHSA-N 0 0 357.595 3.974 20 5 FHBDRN C[C@H](CN[C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000513684655 942075061 /nfs/dbraw/zinc/07/50/61/942075061.db2.gz UAARNEOPDKESJI-KUHUBIRLSA-N 0 0 368.412 3.950 20 5 FHBDRN Cn1ccc2ccc(NC(=O)c3ccc(OC(F)F)c([N+](=O)[O-])c3)cc21 ZINC000513686059 942079977 /nfs/dbraw/zinc/07/99/77/942079977.db2.gz VMLGQRVNHXCXMV-UHFFFAOYSA-N 0 0 361.304 3.940 20 5 FHBDRN O=C(N[C@H]1C[C@@H]1c1cccc(F)c1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513723565 942083834 /nfs/dbraw/zinc/08/38/34/942083834.db2.gz FSWPOVPSSTXTRI-OLZOCXBDSA-N 0 0 366.295 3.621 20 5 FHBDRN CC(C)c1[nH]nc(-c2nc(C3(c4ccccc4F)CC3)no2)c1[N+](=O)[O-] ZINC000420529099 942094072 /nfs/dbraw/zinc/09/40/72/942094072.db2.gz NJZAJUIWYDLVHJ-UHFFFAOYSA-N 0 0 357.345 3.710 20 5 FHBDRN Cc1ccc(C2(C(=O)N[C@H](C)c3cccc([N+](=O)[O-])c3)CCOCC2)cc1 ZINC000110230739 942105191 /nfs/dbraw/zinc/10/51/91/942105191.db2.gz JVLLTFKAESHGIG-MRXNPFEDSA-N 0 0 368.433 3.829 20 5 FHBDRN C[C@H](C(=O)Nc1ccc([N+](=O)[O-])c(Cl)c1)n1ccc(C(F)(F)F)n1 ZINC001125864314 942106739 /nfs/dbraw/zinc/10/67/39/942106739.db2.gz NHIOKKWKIYPKKK-SSDOTTSWSA-N 0 0 362.695 3.663 20 5 FHBDRN CCC[C@H](CC)S(=O)(=O)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000280105614 942108239 /nfs/dbraw/zinc/10/82/39/942108239.db2.gz YFHJNEPABBZXNA-HNNXBMFYSA-N 0 0 352.412 3.743 20 5 FHBDRN Cc1nc(N2CCCC[C@@H]2c2nc3cc(Cl)ccc3[nH]2)ncc1[N+](=O)[O-] ZINC000413370370 942109316 /nfs/dbraw/zinc/10/93/16/942109316.db2.gz CLWDZZKLXYRMDD-CQSZACIVSA-N 0 0 372.816 3.955 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@H](C)c1cn(C(C)(C)C)nc1C ZINC000280143943 942114056 /nfs/dbraw/zinc/11/40/56/942114056.db2.gz WBVJTSGUHXTBDV-GFCCVEGCSA-N 0 0 374.441 3.744 20 5 FHBDRN Cc1cnc(N2CCC[C@H]2c2ccc(Br)cn2)c([N+](=O)[O-])c1 ZINC000413380525 942114262 /nfs/dbraw/zinc/11/42/62/942114262.db2.gz SSMHMBXQMOXDNN-ZDUSSCGKSA-N 0 0 363.215 3.797 20 5 FHBDRN CCC(CC)[C@@H]1C[C@@H](NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])CCO1 ZINC000183358921 942117860 /nfs/dbraw/zinc/11/78/60/942117860.db2.gz WNYJPJKFPKTIKF-BBRMVZONSA-N 0 0 354.834 3.962 20 5 FHBDRN CCOC(=O)c1cc(C(=O)N(c2ccccc2)[C@@H]2C[C@H]2C)cc([N+](=O)[O-])c1 ZINC000415899192 942125109 /nfs/dbraw/zinc/12/51/09/942125109.db2.gz WBIRRURXACGLJJ-FZKQIMNGSA-N 0 0 368.389 3.827 20 5 FHBDRN O=C(Nc1ccc(CN2CCCC2=O)cc1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000110225622 942139791 /nfs/dbraw/zinc/13/97/91/942139791.db2.gz NZSXKFRRPBGGLB-UHFFFAOYSA-N 0 0 373.796 3.623 20 5 FHBDRN CC(C)c1ccc(CN(c2ccc(C(N)=O)cc2[N+](=O)[O-])C2CC2)cc1 ZINC000501963224 942140607 /nfs/dbraw/zinc/14/06/07/942140607.db2.gz SFYYLQBKUXDCTG-UHFFFAOYSA-N 0 0 353.422 3.986 20 5 FHBDRN CC(C)(C)C1CCN(C(=O)COc2ccc([N+](=O)[O-])c3cccnc23)CC1 ZINC000472928748 942148133 /nfs/dbraw/zinc/14/81/33/942148133.db2.gz OMYSHERUHHJUDD-UHFFFAOYSA-N 0 0 371.437 3.807 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)[C@@](C)(OC)C1CC1 ZINC000415922216 942149089 /nfs/dbraw/zinc/14/90/89/942149089.db2.gz TUPCRHCGJWBPNE-PIGZYNQJSA-N 0 0 352.456 3.640 20 5 FHBDRN CO[C@H]1CCC[C@@H](CC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000280298542 942154815 /nfs/dbraw/zinc/15/48/15/942154815.db2.gz NXBKKKXCQWOBGC-PWSUYJOCSA-N 0 0 358.341 3.730 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCC[C@H]1OC(F)F ZINC000501973097 942156233 /nfs/dbraw/zinc/15/62/33/942156233.db2.gz FSKXBDLEQBOLSX-VXGBXAGGSA-N 0 0 360.382 3.597 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CCSC(C)(C)CC2)ccc1[N+](=O)[O-] ZINC000412312790 942162344 /nfs/dbraw/zinc/16/23/44/942162344.db2.gz VAXBYJNRKMQIAB-UHFFFAOYSA-N 0 0 352.456 3.740 20 5 FHBDRN CCOc1ccc([C@H]2CCCN2C(=O)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000016141512 942163157 /nfs/dbraw/zinc/16/31/57/942163157.db2.gz IIXPMGIGKHYFAU-GOSISDBHSA-N 0 0 354.406 3.900 20 5 FHBDRN Cc1nc2ccccc2n1C1CCN(c2cc(C)c([N+](=O)[O-])cn2)CC1 ZINC000280338292 942166708 /nfs/dbraw/zinc/16/67/08/942166708.db2.gz VKDBTANYNOTCQN-UHFFFAOYSA-N 0 0 351.410 3.798 20 5 FHBDRN C[C@@H](Cc1ccccc1C(F)(F)F)NC(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000183141603 942168533 /nfs/dbraw/zinc/16/85/33/942168533.db2.gz FEUIUGSHPZYUFY-JTQLQIEISA-N 0 0 367.327 3.557 20 5 FHBDRN C[C@@H](CCc1ccco1)NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000047741147 942169461 /nfs/dbraw/zinc/16/94/61/942169461.db2.gz ABTGGDLRBBOVKB-AWEZNQCLSA-N 0 0 357.410 3.539 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@H](C)c1cccc(F)c1F ZINC000122750661 942177124 /nfs/dbraw/zinc/17/71/24/942177124.db2.gz OSCKXVVXLRITOU-SECBINFHSA-N 0 0 351.309 3.764 20 5 FHBDRN C[C@H](NC(=O)N1CCC[C@H](Oc2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000413440559 942182340 /nfs/dbraw/zinc/18/23/40/942182340.db2.gz SAVUSZWOMJHGDG-RDJZCZTQSA-N 0 0 369.421 3.909 20 5 FHBDRN O=C(NC1CC1)c1ccc(NC2CCC(C(F)F)CC2)c([N+](=O)[O-])c1 ZINC000413437831 942186012 /nfs/dbraw/zinc/18/60/12/942186012.db2.gz IDYVFTXXTDPSES-UHFFFAOYSA-N 0 0 353.369 3.723 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1COC(=O)c1ccc([C@H]2CCC(=O)N2)cc1 ZINC000893157033 942186271 /nfs/dbraw/zinc/18/62/71/942186271.db2.gz IRYDSWYFVJMGCE-QGZVFWFLSA-N 0 0 368.389 3.520 20 5 FHBDRN Cc1noc(C2CCC(Nc3ccc([N+](=O)[O-])c4cnccc34)CC2)n1 ZINC000378041039 942203278 /nfs/dbraw/zinc/20/32/78/942203278.db2.gz JQJMKDMWWRXVQP-UHFFFAOYSA-N 0 0 353.382 3.973 20 5 FHBDRN CC(C)c1csc(CN[C@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)n1 ZINC000513696861 942209592 /nfs/dbraw/zinc/20/95/92/942209592.db2.gz FJOZFENHGABMRO-KRWDZBQOSA-N 0 0 371.466 3.787 20 5 FHBDRN COC[C@H](C)N(C)C(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(OC)cc1 ZINC000502067234 942210406 /nfs/dbraw/zinc/21/04/06/942210406.db2.gz DFZABPJAXVOTTE-ZDUSSCGKSA-N 0 0 374.393 3.503 20 5 FHBDRN CNC(=O)c1cc(NC(=O)c2c(Cl)cccc2[N+](=O)[O-])ccc1Cl ZINC000110232856 942213334 /nfs/dbraw/zinc/21/33/34/942213334.db2.gz HAEAQXAJKAPHOC-UHFFFAOYSA-N 0 0 368.176 3.514 20 5 FHBDRN Cc1noc(C)c1C(C)(C)C(=O)Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1 ZINC000280641413 942219891 /nfs/dbraw/zinc/21/98/91/942219891.db2.gz AKUZIKLYBRHNJX-UHFFFAOYSA-N 0 0 369.381 3.506 20 5 FHBDRN CCC(CC)[C@H]1C[C@H](NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)CCO1 ZINC000183438246 942225911 /nfs/dbraw/zinc/22/59/11/942225911.db2.gz DVLYUQLOPFEFET-GDBMZVCRSA-N 0 0 354.834 3.962 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N(C)[C@H]2CCc3ccccc32)c1C ZINC000480960695 942231079 /nfs/dbraw/zinc/23/10/79/942231079.db2.gz YDWNJUBFLAPCOU-INIZCTEOSA-N 0 0 360.435 3.520 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCO[C@H](C3CCC3)C2)nc1OCc1ccccc1 ZINC000413472509 942231516 /nfs/dbraw/zinc/23/15/16/942231516.db2.gz HFWDRPHDSCJLFM-SFHVURJKSA-N 0 0 369.421 3.574 20 5 FHBDRN CCn1cc(OC(=O)c2ccc(N3C[C@H](C)C[C@H](C)C3)c([N+](=O)[O-])c2)cn1 ZINC001269054909 942232020 /nfs/dbraw/zinc/23/20/20/942232020.db2.gz IOILWQYYCYBTHO-OKILXGFUSA-N 0 0 372.425 3.513 20 5 FHBDRN CC(C)c1nn(C)cc1NC(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000280682547 942233476 /nfs/dbraw/zinc/23/34/76/942233476.db2.gz GBXBSBHGAXBIER-UHFFFAOYSA-N 0 0 359.430 3.596 20 5 FHBDRN CCc1nn(C)c(OC)c1CNC(=O)c1cc2ccccc2c2cccnc12 ZINC000179478972 942237981 /nfs/dbraw/zinc/23/79/81/942237981.db2.gz RWARCPPPCWKEII-UHFFFAOYSA-N 0 0 374.444 3.623 20 5 FHBDRN Cc1nn(C)c(NCc2cccc(Br)c2Cl)c1[N+](=O)[O-] ZINC000413488295 942240301 /nfs/dbraw/zinc/24/03/01/942240301.db2.gz OWLKSXKKSHTDAO-UHFFFAOYSA-N 0 0 359.611 3.665 20 5 FHBDRN O=C(Cc1cc(F)c(Cl)cc1[N+](=O)[O-])N1CCC[C@@H]1c1nccs1 ZINC000365755750 942241611 /nfs/dbraw/zinc/24/16/11/942241611.db2.gz ZCSSYPPSSIIBAE-GFCCVEGCSA-N 0 0 369.805 3.750 20 5 FHBDRN CC(C)c1nc2n(n1)CCC[C@H]2NC(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000187873609 942241919 /nfs/dbraw/zinc/24/19/19/942241919.db2.gz ILZLHVHNUJNBPW-OAHLLOKOSA-N 0 0 371.441 3.698 20 5 FHBDRN C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1cccc(Br)c1 ZINC000103377523 942248258 /nfs/dbraw/zinc/24/82/58/942248258.db2.gz QEEHEDXJNJWKGK-JTQLQIEISA-N 0 0 361.195 3.949 20 5 FHBDRN CCC(=O)Nc1cccc(C(=O)N2c3ccc([N+](=O)[O-])cc3C[C@H]2C)c1 ZINC000103375635 942248614 /nfs/dbraw/zinc/24/86/14/942248614.db2.gz HKJUVKYKMBNWBE-GFCCVEGCSA-N 0 0 353.378 3.535 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N(C)[C@@H](C)C2CCCCC2)c1C ZINC001211651248 942252784 /nfs/dbraw/zinc/25/27/84/942252784.db2.gz OKECZIKWUNJGMR-AWEZNQCLSA-N 0 0 354.472 3.801 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1N1C[C@H](O)C[C@@H]1c1ccccc1 ZINC000413498645 942259201 /nfs/dbraw/zinc/25/92/01/942259201.db2.gz HMPYAHQFBKBSGF-UKRRQHHQSA-N 0 0 363.211 3.670 20 5 FHBDRN CCOCCN(C(=O)c1cc([N+](=O)[O-])cnc1C)c1ccc(Cl)cc1 ZINC000416014469 942260603 /nfs/dbraw/zinc/26/06/03/942260603.db2.gz PCPYBPICEVNSIW-UHFFFAOYSA-N 0 0 363.801 3.635 20 5 FHBDRN CCOC(=O)c1cc(C(=O)N(C)[C@@H](C)c2ccccc2)cc([N+](=O)[O-])c1 ZINC000015596775 942263151 /nfs/dbraw/zinc/26/31/51/942263151.db2.gz PZTHAPXHJSGHKX-ZDUSSCGKSA-N 0 0 356.378 3.605 20 5 FHBDRN Cc1c(Cl)cc2c(c1Cl)CCCN2C(=O)c1cc([N+](=O)[O-])nn1C ZINC000416016989 942265423 /nfs/dbraw/zinc/26/54/23/942265423.db2.gz SPKCTKAAWVDZCF-UHFFFAOYSA-N 0 0 369.208 3.537 20 5 FHBDRN CC(C)[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F)C(F)(F)F ZINC000416019369 942266900 /nfs/dbraw/zinc/26/69/00/942266900.db2.gz WGOIFBDUFSHRTD-JTQLQIEISA-N 0 0 358.238 3.930 20 5 FHBDRN CCC[C@H](C)c1cc(=NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)[nH][nH]1 ZINC000545862227 942267344 /nfs/dbraw/zinc/26/73/44/942267344.db2.gz GGZHNQVVSTVXTB-NSHDSACASA-N 0 0 362.405 3.699 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCC[C@H](CC(F)(F)F)C1 ZINC000420951873 942272963 /nfs/dbraw/zinc/27/29/63/942272963.db2.gz RIEYPCOLPVGQQI-GFCCVEGCSA-N 0 0 359.348 3.506 20 5 FHBDRN C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCC[C@H](CC(F)(F)F)C1 ZINC000420955298 942274375 /nfs/dbraw/zinc/27/43/75/942274375.db2.gz WEWXKOZEMIEEIP-NWDGAFQWSA-N 0 0 359.348 3.586 20 5 FHBDRN CCc1cnc(N2CCN(c3ccc(Cl)cc3[N+](=O)[O-])CC2)s1 ZINC000463073904 942276776 /nfs/dbraw/zinc/27/67/76/942276776.db2.gz LEHKKGSRVJSRLX-UHFFFAOYSA-N 0 0 352.847 3.594 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1)N1CCO[C@H](c2ccccc2Cl)C1 ZINC000103502518 942278138 /nfs/dbraw/zinc/27/81/38/942278138.db2.gz BGOKZUIZMNPGFI-INIZCTEOSA-N 0 0 361.785 3.854 20 5 FHBDRN O=[N+]([O-])c1cccc(Cl)c1CSCc1nnnn1-c1ccccc1 ZINC000162301586 942280043 /nfs/dbraw/zinc/28/00/43/942280043.db2.gz TZWJGIXXZFVGEM-UHFFFAOYSA-N 0 0 361.814 3.657 20 5 FHBDRN CC(C)(C)OC(=O)CC[C@@H]1CCCCN1C(=O)c1ccc([N+](=O)[O-])cc1 ZINC000416034101 942282483 /nfs/dbraw/zinc/28/24/83/942282483.db2.gz MRSMXULESWDGQG-HNNXBMFYSA-N 0 0 362.426 3.711 20 5 FHBDRN O=[N+]([O-])c1cc(CN[C@@H](CC(F)F)c2ccccc2)c2c(c1)COCO2 ZINC000420987202 942283002 /nfs/dbraw/zinc/28/30/02/942283002.db2.gz ONIAVLITTVEHNS-INIZCTEOSA-N 0 0 364.348 3.947 20 5 FHBDRN CC(C)(C)OC(=O)CC[C@H]1CCCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000416037653 942284034 /nfs/dbraw/zinc/28/40/34/942284034.db2.gz YSNAZFXKYPIEEX-GFCCVEGCSA-N 0 0 368.455 3.773 20 5 FHBDRN COc1ccc(S(=O)(=O)N(C)c2cccc(C(C)C)c2)cc1[N+](=O)[O-] ZINC000063182030 942288902 /nfs/dbraw/zinc/28/89/02/942288902.db2.gz VIGZBOKIOLYVOH-UHFFFAOYSA-N 0 0 364.423 3.552 20 5 FHBDRN NC(=O)c1cccc(NCC2(c3c(F)cccc3F)CCC2)c1[N+](=O)[O-] ZINC000413513685 942289524 /nfs/dbraw/zinc/28/95/24/942289524.db2.gz KSBDICUUAAHJMB-UHFFFAOYSA-N 0 0 361.348 3.506 20 5 FHBDRN Cc1c(Cl)cccc1NC(=O)[C@@H](C)OC(=O)c1cccc([N+](=O)[O-])c1 ZINC000015644379 942291833 /nfs/dbraw/zinc/29/18/33/942291833.db2.gz GZTSSODJHNZISU-LLVKDONJSA-N 0 0 362.769 3.741 20 5 FHBDRN O=C([C@H]1C[C@@H]1c1ccccc1)N1CCS[C@@H]1c1ccc([N+](=O)[O-])cc1 ZINC000413520479 942292016 /nfs/dbraw/zinc/29/20/16/942292016.db2.gz PSUGCELRPLTODH-ZIFCJYIRSA-N 0 0 354.431 3.973 20 5 FHBDRN CO[C@@H](CNC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C)c1ccccc1 ZINC000103601494 942297357 /nfs/dbraw/zinc/29/73/57/942297357.db2.gz YQUAQAGNGHAOLW-IBGZPJMESA-N 0 0 371.437 3.903 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)NC(C)(C)Cc2ccc(C)cc2)c1F ZINC000416051574 942302645 /nfs/dbraw/zinc/30/26/45/942302645.db2.gz AXIBMCFZJVIAIY-UHFFFAOYSA-N 0 0 374.412 3.731 20 5 FHBDRN COc1ccc(OCCSCc2nnc(C(C)C)s2)c([N+](=O)[O-])c1 ZINC000419547129 942309251 /nfs/dbraw/zinc/30/92/51/942309251.db2.gz ZZFSXCISXSZXOD-UHFFFAOYSA-N 0 0 369.468 3.891 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)N2CCCC[C@@H]2c2cn[nH]c2)cc1[N+](=O)[O-] ZINC000183214005 942314148 /nfs/dbraw/zinc/31/41/48/942314148.db2.gz WDIOJXYGPVLAJL-CZUORRHYSA-N 0 0 357.414 3.624 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)N2CC3(CCC3)[C@@H]2[C@H]2CCCO2)cc1[N+](=O)[O-] ZINC000290632185 942317046 /nfs/dbraw/zinc/31/70/46/942317046.db2.gz DAAAGFOBZAXZJF-QGTPRVQTSA-N 0 0 373.453 3.707 20 5 FHBDRN COc1ccc2c(c1OC)CCN(C/C=C\c1ccccc1[N+](=O)[O-])C2 ZINC000501122577 942320445 /nfs/dbraw/zinc/32/04/45/942320445.db2.gz RMFVCWNKXJKCDN-ALCCZGGFSA-N 0 0 354.406 3.684 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NC[C@@H](C)N(C)c1ccccc1 ZINC000085636345 942328626 /nfs/dbraw/zinc/32/86/26/942328626.db2.gz BLMNTUWZVHPBGM-CQSZACIVSA-N 0 0 356.426 3.858 20 5 FHBDRN COc1ccc(C(=O)N2CC[C@@](F)(c3ccccc3C)C2)cc1[N+](=O)[O-] ZINC000501160751 942331108 /nfs/dbraw/zinc/33/11/08/942331108.db2.gz AVURRZSCPDVNGK-IBGZPJMESA-N 0 0 358.369 3.623 20 5 FHBDRN O=C(Nc1cc(F)ccc1OC[C@@H]1CCCO1)c1ccc([N+](=O)[O-])cc1 ZINC000502283129 942331218 /nfs/dbraw/zinc/33/12/18/942331218.db2.gz OOSFEKMTTHTNED-HNNXBMFYSA-N 0 0 360.341 3.544 20 5 FHBDRN O=C(NCC1(c2ccc3c(c2)OCO3)CCCCC1)c1ccc([N+](=O)[O-])o1 ZINC000501159772 942331255 /nfs/dbraw/zinc/33/12/55/942331255.db2.gz ZNGZXLLAOSFIPJ-UHFFFAOYSA-N 0 0 372.377 3.548 20 5 FHBDRN CCOc1cc(C(=O)N[C@@H](CC)[C@H]2CC2(C)C)c([N+](=O)[O-])cc1OC ZINC000416085634 942333356 /nfs/dbraw/zinc/33/33/56/942333356.db2.gz RRAZGKXZDUIBJI-OLZOCXBDSA-N 0 0 350.415 3.557 20 5 FHBDRN CC(C)(C)C(=O)NC[C@@H]1CCCN(c2nc3ccccc3cc2[N+](=O)[O-])C1 ZINC000473537118 942338852 /nfs/dbraw/zinc/33/88/52/942338852.db2.gz ZNKLEUZRZVVMQS-AWEZNQCLSA-N 0 0 370.453 3.522 20 5 FHBDRN CCc1[nH]nc(C(=O)Nc2ccccc2N2CCCCCC2)c1[N+](=O)[O-] ZINC000188120670 942341185 /nfs/dbraw/zinc/34/11/85/942341185.db2.gz DIIBTLIVKOTOND-UHFFFAOYSA-N 0 0 357.414 3.513 20 5 FHBDRN O=C(Nc1ccnn1-c1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1Cl ZINC000103930927 942347717 /nfs/dbraw/zinc/34/77/17/942347717.db2.gz AKAGZBQPSNLUSS-UHFFFAOYSA-N 0 0 360.732 3.825 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)N1CC[C@@H](O)CC12CCC2 ZINC000421082056 942348478 /nfs/dbraw/zinc/34/84/78/942348478.db2.gz BQDKOFUTZCWGKQ-LLVKDONJSA-N 0 0 373.331 3.525 20 5 FHBDRN Cc1c(C(=O)Nc2cc(F)ccc2OC[C@H]2CCCO2)cccc1[N+](=O)[O-] ZINC000502317373 942350713 /nfs/dbraw/zinc/35/07/13/942350713.db2.gz MSCXDMYMCOIIAI-CQSZACIVSA-N 0 0 374.368 3.852 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)Nc2cccc(-c3ncc[nH]3)c2)c1 ZINC000103965229 942351242 /nfs/dbraw/zinc/35/12/42/942351242.db2.gz CBKTVQOFKASZGU-UHFFFAOYSA-N 0 0 354.391 3.959 20 5 FHBDRN O=C(c1ccc(OC(F)F)c([N+](=O)[O-])c1)N1CCSC[C@H]1C1CCC1 ZINC000416104722 942351816 /nfs/dbraw/zinc/35/18/16/942351816.db2.gz DXKKJGPMLAAFKT-ZDUSSCGKSA-N 0 0 372.393 3.554 20 5 FHBDRN C[C@H](Cc1cccs1)NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513710416 942352819 /nfs/dbraw/zinc/35/28/19/942352819.db2.gz SHSRRTYYOSNKFU-SECBINFHSA-N 0 0 356.350 3.619 20 5 FHBDRN C[C@H](NC(=O)N1CCC[C@H](Oc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000413566228 942353220 /nfs/dbraw/zinc/35/32/20/942353220.db2.gz ISXXDGYVOKZZOR-KXBFYZLASA-N 0 0 369.421 3.909 20 5 FHBDRN CCOCCN(CC)C(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000502321583 942353620 /nfs/dbraw/zinc/35/36/20/942353620.db2.gz OSVPIFADKPCJLW-UHFFFAOYSA-N 0 0 357.410 3.837 20 5 FHBDRN O=[N+]([O-])c1cnc(NC[C@H](CCO)c2ccccc2)c(C(F)(F)F)c1 ZINC000413157994 942354009 /nfs/dbraw/zinc/35/40/09/942354009.db2.gz UWWYFBXYQQWMDH-LBPRGKRZSA-N 0 0 355.316 3.587 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CC(C)(C)O[C@@H]3CCC[C@H]32)ccc1[N+](=O)[O-] ZINC000412321865 942356217 /nfs/dbraw/zinc/35/62/17/942356217.db2.gz OLVBSJRRZLYFIS-GDBMZVCRSA-N 0 0 362.426 3.554 20 5 FHBDRN O=C(Nc1cc(F)ccc1OC[C@H]1CCCO1)c1ccc([N+](=O)[O-])s1 ZINC000502307397 942357849 /nfs/dbraw/zinc/35/78/49/942357849.db2.gz DGICCTFSUQJPLE-LLVKDONJSA-N 0 0 366.370 3.606 20 5 FHBDRN Cc1cccc(C)c1CS(=O)(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000549398803 942363251 /nfs/dbraw/zinc/36/32/51/942363251.db2.gz VEGVKJOOLYTMSN-UHFFFAOYSA-N 0 0 374.462 3.706 20 5 FHBDRN Cc1cc(F)cc([C@@]2(F)CCN(C(=O)c3csc([N+](=O)[O-])c3)C2)c1 ZINC000501248329 942363957 /nfs/dbraw/zinc/36/39/57/942363957.db2.gz XHRMYECZIXYJKP-MRXNPFEDSA-N 0 0 352.362 3.815 20 5 FHBDRN O=C1CCCN1[C@@H]1CCCN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC1 ZINC000413572838 942367138 /nfs/dbraw/zinc/36/71/38/942367138.db2.gz RQLBWKXUQKQFDT-GFCCVEGCSA-N 0 0 371.359 3.595 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)c1cc[nH]c(=O)c1 ZINC000502339918 942369420 /nfs/dbraw/zinc/36/94/20/942369420.db2.gz PIZFAYMTDZSYAY-NSHDSACASA-N 0 0 361.423 3.689 20 5 FHBDRN CCOc1ccccc1[C@H](CC(C)C)Nc1ccc2ncc([N+](=O)[O-])n2n1 ZINC000502341689 942370571 /nfs/dbraw/zinc/37/05/71/942370571.db2.gz PNPFVMDKXXZLJO-HNNXBMFYSA-N 0 0 369.425 3.657 20 5 FHBDRN C[C@H](Nc1ccc2ncc([N+](=O)[O-])n2n1)c1cc(F)c(Cl)cc1Cl ZINC000502343168 942371181 /nfs/dbraw/zinc/37/11/81/942371181.db2.gz XAAMPIHYBFZMOT-ZETCQYMHSA-N 0 0 370.171 3.678 20 5 FHBDRN CC(C)(C)OC(=O)CC[C@H]1CCCN(c2ncc(Cl)cc2[N+](=O)[O-])C1 ZINC000413595949 942390769 /nfs/dbraw/zinc/39/07/69/942390769.db2.gz QHEUUEYRDPOFEZ-GFCCVEGCSA-N 0 0 369.849 3.982 20 5 FHBDRN CC(C)CN(C(=O)c1nn(C)cc1[N+](=O)[O-])[C@@H](C)c1ccccc1Cl ZINC000501317254 942397108 /nfs/dbraw/zinc/39/71/08/942397108.db2.gz OWECNLIBRLSOKI-LBPRGKRZSA-N 0 0 364.833 3.841 20 5 FHBDRN Cc1[nH]c2ccccc2c1C(=O)O[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000016295937 942398726 /nfs/dbraw/zinc/39/87/26/942398726.db2.gz RDVLGHQWDHYEFQ-LBPRGKRZSA-N 0 0 367.361 3.569 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N2CCN(c3cccc(C)c3)CC2)c1 ZINC000016297799 942398748 /nfs/dbraw/zinc/39/87/48/942398748.db2.gz IWXJNXYEVZPCPG-UHFFFAOYSA-N 0 0 371.462 3.588 20 5 FHBDRN Cn1c(C(=O)N2CCCC[C@H]2CCCc2ccccc2)ccc1[N+](=O)[O-] ZINC000502371486 942403367 /nfs/dbraw/zinc/40/33/67/942403367.db2.gz HPANZHFABJYKHR-KRWDZBQOSA-N 0 0 355.438 3.951 20 5 FHBDRN Cc1cc(=NC(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)[nH]n1C(C)C ZINC000421204037 942404791 /nfs/dbraw/zinc/40/47/91/942404791.db2.gz YBRFJOMAUUDISH-INIZCTEOSA-N 0 0 371.441 3.514 20 5 FHBDRN Cc1cc(=NC(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)[nH]n1C(C)C ZINC000421204039 942405079 /nfs/dbraw/zinc/40/50/79/942405079.db2.gz YBRFJOMAUUDISH-MRXNPFEDSA-N 0 0 371.441 3.514 20 5 FHBDRN CC(C)c1nc2n(n1)CCC[C@H]2Nc1ccc([N+](=O)[O-])c2ncccc12 ZINC000413179981 942410418 /nfs/dbraw/zinc/41/04/18/942410418.db2.gz DCUUUJJUFUDUAB-CQSZACIVSA-N 0 0 352.398 3.805 20 5 FHBDRN CN(Cc1nc2c(s1)CCCC2)c1ncc([N+](=O)[O-])cc1C(F)(F)F ZINC000413184852 942438259 /nfs/dbraw/zinc/43/82/59/942438259.db2.gz OPIGOCQFHAMYTI-UHFFFAOYSA-N 0 0 372.372 3.980 20 5 FHBDRN Cc1ccc(NC(=O)CN(C)Cc2cc([N+](=O)[O-])ccc2Cl)cc1F ZINC000016312830 942442814 /nfs/dbraw/zinc/44/28/14/942442814.db2.gz SZSVVALIJHMPOR-UHFFFAOYSA-N 0 0 365.792 3.766 20 5 FHBDRN O=C(NCCNc1ccc([N+](=O)[O-])cc1)c1csc(-c2cccs2)n1 ZINC000015835013 942454168 /nfs/dbraw/zinc/45/41/68/942454168.db2.gz AZVOQMWABAHQEG-UHFFFAOYSA-N 0 0 374.447 3.622 20 5 FHBDRN CCS[C@@H]1CC[C@H](N(C)C(=O)Nc2ccc([N+](=O)[O-])cc2OC)C1 ZINC000122895981 942454313 /nfs/dbraw/zinc/45/43/13/942454313.db2.gz HKRCXRDVYPCKQU-WCQYABFASA-N 0 0 353.444 3.741 20 5 FHBDRN CCOCc1cccc(NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)c1 ZINC000513745062 942454804 /nfs/dbraw/zinc/45/48/04/942454804.db2.gz UIPYDDMLJNOQJN-UHFFFAOYSA-N 0 0 366.320 3.985 20 5 FHBDRN CCC(C)(C)[C@@H]1CCCN1C(=O)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC000413647585 942457150 /nfs/dbraw/zinc/45/71/50/942457150.db2.gz AWAZNKYVSIRLBQ-HNNXBMFYSA-N 0 0 352.406 3.712 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CCc3c(F)cc(F)cc3C2)c(C(F)(F)F)c1 ZINC000413199442 942463253 /nfs/dbraw/zinc/46/32/53/942463253.db2.gz RBOOQUXMNQMRSS-UHFFFAOYSA-N 0 0 359.254 3.850 20 5 FHBDRN CCn1cnnc1-c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000104264855 942468476 /nfs/dbraw/zinc/46/84/76/942468476.db2.gz IUAHKDNXCOZJCL-UHFFFAOYSA-N 0 0 371.784 3.779 20 5 FHBDRN Cc1nn(-c2ccc(F)cc2)cc1CNC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000502503999 942482503 /nfs/dbraw/zinc/48/25/03/942482503.db2.gz XZCZAAOFJGPXIW-UHFFFAOYSA-N 0 0 369.356 3.550 20 5 FHBDRN Cc1ccc(NCc2nnc3n2CCC[C@@H]3C(F)(F)F)c([N+](=O)[O-])c1 ZINC000366894814 942494939 /nfs/dbraw/zinc/49/49/39/942494939.db2.gz HERLVVZVVILKEK-JTQLQIEISA-N 0 0 355.320 3.547 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N([C@@H](C)c2ccco2)C2CC2)c1F ZINC000413219978 942498304 /nfs/dbraw/zinc/49/83/04/942498304.db2.gz NPUMTTMPHLAIKM-NSHDSACASA-N 0 0 362.357 3.630 20 5 FHBDRN Cn1nc(CCNc2ncc([N+](=O)[O-])cc2C(F)(F)F)c2ccccc21 ZINC000413224326 942501684 /nfs/dbraw/zinc/50/16/84/942501684.db2.gz FJWDIFJUDIBIQL-UHFFFAOYSA-N 0 0 365.315 3.550 20 5 FHBDRN CC(C)Oc1cc(C(=O)N[C@@H](C)c2ccc3n[nH]cc3c2)ccc1[N+](=O)[O-] ZINC000412339051 942503308 /nfs/dbraw/zinc/50/33/08/942503308.db2.gz OWIBNBLRLRVVGR-LBPRGKRZSA-N 0 0 368.393 3.749 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N1CCC[C@@H]1/C=C\c1ccccc1 ZINC000505367220 942505263 /nfs/dbraw/zinc/50/52/63/942505263.db2.gz UCRAAHFRZNGJBO-XZVRFQMRSA-N 0 0 352.390 3.678 20 5 FHBDRN O=C(c1cc2c(c([N+](=O)[O-])c1)OCO2)N1CCC[C@@H]1/C=C\c1ccccc1 ZINC000505366540 942505740 /nfs/dbraw/zinc/50/57/40/942505740.db2.gz NHUFNXHRLFJJEV-HLRDLLSLSA-N 0 0 366.373 3.642 20 5 FHBDRN COc1ccccc1CCN(C)C(=O)c1cc(SC)ccc1[N+](=O)[O-] ZINC000104457930 942517006 /nfs/dbraw/zinc/51/70/06/942517006.db2.gz WQUVNHBLZZFDFX-UHFFFAOYSA-N 0 0 360.435 3.640 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2nc(CN3CC[C@H](O)CC34CCC4)cs2)c1 ZINC000421377594 942527561 /nfs/dbraw/zinc/52/75/61/942527561.db2.gz TZQYDHXQRNJGOW-INIZCTEOSA-N 0 0 359.451 3.598 20 5 FHBDRN O=[N+]([O-])c1cccnc1N1CCO[C@@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000066815587 942527940 /nfs/dbraw/zinc/52/79/40/942527940.db2.gz PICKHOVYZRLIDZ-CQSZACIVSA-N 0 0 354.193 3.875 20 5 FHBDRN CCN(C(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-])[C@@H](C)c1cccc(OC)c1 ZINC000434226795 942534583 /nfs/dbraw/zinc/53/45/83/942534583.db2.gz ULWVAJKCJZXHNZ-LBPRGKRZSA-N 0 0 360.414 3.673 20 5 FHBDRN O=C(Nc1cc(C(F)(F)F)ccn1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000434228814 942534957 /nfs/dbraw/zinc/53/49/57/942534957.db2.gz RMIWCHJQOKXALP-UHFFFAOYSA-N 0 0 366.299 3.599 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CCCCC[C@H]2c2ncon2)ccc1[N+](=O)[O-] ZINC000413723661 942535637 /nfs/dbraw/zinc/53/56/37/942535637.db2.gz UNYTUDCUIQSFAS-HNNXBMFYSA-N 0 0 374.397 3.523 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)[C@@H]1CCc2ccccc2O1 ZINC000413234462 942537825 /nfs/dbraw/zinc/53/78/25/942537825.db2.gz MKFVWSWVTLNANK-IBGZPJMESA-N 0 0 354.406 3.726 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N2C[C@H](C)C[C@@H]2c2ccccc2F)c1[N+](=O)[O-] ZINC000434242288 942542802 /nfs/dbraw/zinc/54/28/02/942542802.db2.gz LHCIKUMHKBCWQC-BXUZGUMPSA-N 0 0 360.389 3.804 20 5 FHBDRN Cc1cc(C)cc(-c2cc(NC(=O)c3n[nH]c(C(C)C)c3[N+](=O)[O-])n[nH]2)c1 ZINC000434261554 942543886 /nfs/dbraw/zinc/54/38/86/942543886.db2.gz QPFOFKGRQJRPHK-UHFFFAOYSA-N 0 0 368.397 3.701 20 5 FHBDRN O=C(NCCc1ccccc1[N+](=O)[O-])c1nc(-c2ccccc2)cs1 ZINC000513829939 942545032 /nfs/dbraw/zinc/54/50/32/942545032.db2.gz MLESLEANOBBXDH-UHFFFAOYSA-N 0 0 353.403 3.691 20 5 FHBDRN COc1cc(NC(=O)Nc2ccc(C)c([N+](=O)[O-])c2)cc(OC)c1OC ZINC000502568570 942549487 /nfs/dbraw/zinc/54/94/87/942549487.db2.gz HGCWJWVHPVLFTI-UHFFFAOYSA-N 0 0 361.354 3.573 20 5 FHBDRN CCOc1ccccc1CCC(=O)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000513836509 942549969 /nfs/dbraw/zinc/54/99/69/942549969.db2.gz JACMSTDWEQWFHO-UHFFFAOYSA-N 0 0 354.406 3.906 20 5 FHBDRN Cc1ccccc1C1=CCN(C(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)C1 ZINC000501587695 942554178 /nfs/dbraw/zinc/55/41/78/942554178.db2.gz VUTOBJLDJPORFB-UHFFFAOYSA-N 0 0 361.401 3.784 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)[C@@H]1C[C@H]1c1cccc(O)c1 ZINC000413243126 942557853 /nfs/dbraw/zinc/55/78/53/942557853.db2.gz VIDNSOMXVFXNCS-RBUKOAKNSA-N 0 0 354.406 3.841 20 5 FHBDRN C[C@H](CNC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F)CC(F)(F)F ZINC000413751839 942559047 /nfs/dbraw/zinc/55/90/47/942559047.db2.gz VJLHAFYPQSZRAC-ZETCQYMHSA-N 0 0 371.262 3.906 20 5 FHBDRN Cc1ccc([C@]2(C)CCN(C(=O)NCCc3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000434264074 942560850 /nfs/dbraw/zinc/56/08/50/942560850.db2.gz NKYVKKOIURTDIM-OAQYLSRUSA-N 0 0 367.449 3.819 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CC[C@@H](COc3ccccc3)C2)c(C(F)(F)F)c1 ZINC000413248734 942561645 /nfs/dbraw/zinc/56/16/45/942561645.db2.gz SAZHDEBNCRWWEX-GFCCVEGCSA-N 0 0 367.327 3.914 20 5 FHBDRN CC[C@H]1C[C@@]1(NC(=O)CCn1nc(C)c([N+](=O)[O-])c1C)c1cccc(C)c1 ZINC000501608019 942566413 /nfs/dbraw/zinc/56/64/13/942566413.db2.gz OFGVKNMVIQCXCQ-JXFKEZNVSA-N 0 0 370.453 3.548 20 5 FHBDRN Cc1ccc(CCCn2cc([N+](=O)[O-])c(C)c(Br)c2=O)cc1 ZINC000541289458 942567403 /nfs/dbraw/zinc/56/74/03/942567403.db2.gz ASCBYNOZWICYGB-UHFFFAOYSA-N 0 0 365.227 3.769 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCO[C@@H](c3ccccc3F)C2)c2ccncc21 ZINC000066814581 942569128 /nfs/dbraw/zinc/56/91/28/942569128.db2.gz JVNPEFDFQXXYBY-LJQANCHMSA-N 0 0 353.353 3.860 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)Nc2cnn(CC(C)C)c2C(C)C)c1 ZINC000501598730 942570187 /nfs/dbraw/zinc/57/01/87/942570187.db2.gz ABHVWAWOEDWHRA-UHFFFAOYSA-N 0 0 360.414 3.832 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)Nc1cccc(N2CCCCC2=O)c1 ZINC000421437593 942572137 /nfs/dbraw/zinc/57/21/37/942572137.db2.gz YLSNYHYQYQOWSE-UHFFFAOYSA-N 0 0 367.405 3.981 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N1CCC[C@@H](Oc2ccccc2)C1 ZINC000416269495 942573956 /nfs/dbraw/zinc/57/39/56/942573956.db2.gz FHBWCIQGAULARO-LJQANCHMSA-N 0 0 354.406 3.597 20 5 FHBDRN CCCNC(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])c(C)cc2C)cc1 ZINC000421442139 942575962 /nfs/dbraw/zinc/57/59/62/942575962.db2.gz CVTCMPJYOPVLQY-UHFFFAOYSA-N 0 0 355.394 3.604 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCCN(c2ccccc2)CC1 ZINC000421443626 942576486 /nfs/dbraw/zinc/57/64/86/942576486.db2.gz GOFFKCGHQXPSIL-UHFFFAOYSA-N 0 0 353.422 3.564 20 5 FHBDRN CCNC(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])c(C)cc2C)c(C)c1 ZINC000421444124 942577506 /nfs/dbraw/zinc/57/75/06/942577506.db2.gz HXDAKMCRJSIUKN-UHFFFAOYSA-N 0 0 355.394 3.522 20 5 FHBDRN COCCCOc1ccccc1NC(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC000421447695 942579425 /nfs/dbraw/zinc/57/94/25/942579425.db2.gz SMTHCWNHNOQNMK-UHFFFAOYSA-N 0 0 358.394 3.879 20 5 FHBDRN O=[N+]([O-])c1ccc2ccnc(NC[C@@]3(CO)C[C@H]3c3ccc(F)cc3)c2c1 ZINC000413268104 942585449 /nfs/dbraw/zinc/58/54/49/942585449.db2.gz RLRGDEXREPCNMJ-AZUAARDMSA-N 0 0 367.380 3.860 20 5 FHBDRN CC(C)Cn1ncc(NC(=O)COc2ccc([N+](=O)[O-])cc2)c1C(C)C ZINC000501643559 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357.410 3.795 20 5 FHBDRN COc1cccc(C2=CCN(C(=O)c3c[nH]c4ccc([N+](=O)[O-])cc34)C2)c1 ZINC000501663832 942594582 /nfs/dbraw/zinc/59/45/82/942594582.db2.gz COYREIBSTAOTNI-UHFFFAOYSA-N 0 0 363.373 3.624 20 5 FHBDRN O=C([C@@H]1CC[C@H](Nc2nccc3ccc([N+](=O)[O-])cc32)C1)N1CCCCC1 ZINC000413271772 942594995 /nfs/dbraw/zinc/59/49/95/942594995.db2.gz QITORNOQTOBEOD-CVEARBPZSA-N 0 0 368.437 3.736 20 5 FHBDRN CCCn1ccnc1CCCN(C)c1nccc2ccc([N+](=O)[O-])cc21 ZINC000413273746 942595823 /nfs/dbraw/zinc/59/58/23/942595823.db2.gz ZRPDGLYKVHMKBX-UHFFFAOYSA-N 0 0 353.426 3.819 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CCOc3cccc(F)c3C2)c(C(F)(F)F)c1 ZINC000413274774 942595939 /nfs/dbraw/zinc/59/59/39/942595939.db2.gz AQFBMTXDKSJENR-UHFFFAOYSA-N 0 0 357.263 3.547 20 5 FHBDRN CC(=O)N1CC[C@@H](NC(=O)Nc2ccc(C)c([N+](=O)[O-])c2)c2ccccc21 ZINC000366962985 942598429 /nfs/dbraw/zinc/59/84/29/942598429.db2.gz RCFKOLGNWOJUMX-MRXNPFEDSA-N 0 0 368.393 3.523 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NCc1cccc(N2CC=CC2)c1 ZINC000421487897 942602227 /nfs/dbraw/zinc/60/22/27/942602227.db2.gz ZYGFBUSXCPZIOR-UHFFFAOYSA-N 0 0 351.406 3.518 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N(C)[C@@H](C)c1ccc([S@@](C)=O)cc1 ZINC000421489438 942603472 /nfs/dbraw/zinc/60/34/72/942603472.db2.gz WAILLUAJGCCTFH-RMKBEBRYSA-N 0 0 374.462 3.782 20 5 FHBDRN CCN(C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21)c1cccc(OC)c1 ZINC000501672849 942604093 /nfs/dbraw/zinc/60/40/93/942604093.db2.gz DOOSVCYZFILDNC-UHFFFAOYSA-N 0 0 353.378 3.611 20 5 FHBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)C1(c2c(F)cccc2F)CCC1 ZINC000421493964 942606396 /nfs/dbraw/zinc/60/63/96/942606396.db2.gz DKLJJCFGFVPFFD-UHFFFAOYSA-N 0 0 360.360 3.654 20 5 FHBDRN CCN(Cc1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1CCN(c2ccccc2)C1=O ZINC000522711088 942613706 /nfs/dbraw/zinc/61/37/06/942613706.db2.gz KMTVGTXXDAIGRK-QGZVFWFLSA-N 0 0 373.840 3.876 20 5 FHBDRN COc1ccc(CN(CC2CC2)C(=O)c2ccc([N+](=O)[O-])cc2)c(OC)c1 ZINC000501689913 942613845 /nfs/dbraw/zinc/61/38/45/942613845.db2.gz BKPXISNYGQWTED-UHFFFAOYSA-N 0 0 370.405 3.664 20 5 FHBDRN COc1ccc([C@H](OC)[C@H](C)NC(=O)c2cc([N+](=O)[O-])c(C)cc2C)cc1 ZINC000421514927 942620182 /nfs/dbraw/zinc/62/01/82/942620182.db2.gz RJQFJUXLQLBGJX-IFXJQAMLSA-N 0 0 372.421 3.726 20 5 FHBDRN COc1ccc([C@@H](OC)[C@@H](C)NC(=O)c2cc([N+](=O)[O-])c(C)cc2C)cc1 ZINC000421514928 942620280 /nfs/dbraw/zinc/62/02/80/942620280.db2.gz RJQFJUXLQLBGJX-KUHUBIRLSA-N 0 0 372.421 3.726 20 5 FHBDRN COCc1ccc([C@H]2CCCN2C(=O)c2cc([N+](=O)[O-])c(C)cc2C)o1 ZINC000421514040 942620971 /nfs/dbraw/zinc/62/09/71/942620971.db2.gz KSENFZTXKKJOGU-MRXNPFEDSA-N 0 0 358.394 3.928 20 5 FHBDRN Cc1ccc(F)c(-c2cc(NC(=O)c3cccc(C)c3[N+](=O)[O-])n[nH]2)c1 ZINC000190104595 942626294 /nfs/dbraw/zinc/62/62/94/942626294.db2.gz YCNZQOATQFIETN-UHFFFAOYSA-N 0 0 354.341 3.993 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CC[C@H](n2ncc3ccccc32)C1 ZINC000421521673 942626875 /nfs/dbraw/zinc/62/68/75/942626875.db2.gz YNFWIXPWOAEMQQ-INIZCTEOSA-N 0 0 364.405 3.649 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N[C@@H]1CCO[C@H](c2ccccc2)C1 ZINC000421523275 942628325 /nfs/dbraw/zinc/62/83/25/942628325.db2.gz SSHZQPXMXHOCBQ-APWZRJJASA-N 0 0 354.406 3.862 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CCC=C(c3ccncc3)C2)ccc1[N+](=O)[O-] ZINC000412347711 942628557 /nfs/dbraw/zinc/62/85/57/942628557.db2.gz PDKDBWZTBCGKOA-UHFFFAOYSA-N 0 0 367.405 3.707 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@H](c1ccc2c(c1)OCCO2)C1CC1 ZINC000501704213 942629419 /nfs/dbraw/zinc/62/94/19/942629419.db2.gz OVSCWHBLZINYHK-IBGZPJMESA-N 0 0 368.389 3.556 20 5 FHBDRN CO[C@H]1CCOc2c(NC(=O)c3cc([N+](=O)[O-])c(C)cc3C)cccc21 ZINC000421538715 942633632 /nfs/dbraw/zinc/63/36/32/942633632.db2.gz QNNHPVPDNWFKNZ-KRWDZBQOSA-N 0 0 356.378 3.934 20 5 FHBDRN COC(=O)c1cc(C(=O)N(C)[C@@H]2CCC[C@@H]2C(C)(C)C)cc([N+](=O)[O-])c1 ZINC000416308548 942635768 /nfs/dbraw/zinc/63/57/68/942635768.db2.gz MHLJKXZHVBTYGS-JKSUJKDBSA-N 0 0 362.426 3.668 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NCC1CCN(c2ccccc2)CC1 ZINC000421542304 942636373 /nfs/dbraw/zinc/63/63/73/942636373.db2.gz WAZUSSCOXQPQLY-UHFFFAOYSA-N 0 0 367.449 3.858 20 5 FHBDRN Cc1cc(NC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)cc2n[nH]cc21 ZINC000501731712 942637728 /nfs/dbraw/zinc/63/77/28/942637728.db2.gz YWDBHWRNOUUPEI-LLVKDONJSA-N 0 0 356.407 3.899 20 5 FHBDRN C[C@@H]1CN(c2ncc([N+](=O)[O-])cc2C(F)(F)F)Cc2ccccc2O1 ZINC000413306242 942639990 /nfs/dbraw/zinc/63/99/90/942639990.db2.gz VBULNHMXAUUSLH-SNVBAGLBSA-N 0 0 353.300 3.796 20 5 FHBDRN C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])c(F)cc2N)CC[C@@H]1c1ccccc1 ZINC000366980907 942642312 /nfs/dbraw/zinc/64/23/12/942642312.db2.gz IIBZYVLFFRDIBM-JSGCOSHPSA-N 0 0 357.385 3.582 20 5 FHBDRN CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1ccccc1 ZINC000016014832 942643753 /nfs/dbraw/zinc/64/37/53/942643753.db2.gz ZVSXOEJPYZFAJA-UHFFFAOYSA-N 0 0 366.377 3.696 20 5 FHBDRN COc1ccc(CNC(=O)Nc2ccc3scnc3c2)cc1[N+](=O)[O-] ZINC000513964466 942645783 /nfs/dbraw/zinc/64/57/83/942645783.db2.gz ITYYDKIFLDUDMD-UHFFFAOYSA-N 0 0 358.379 3.535 20 5 FHBDRN CC1(C)C[C@H](NC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)C(C)(C)O1 ZINC000183596202 942648845 /nfs/dbraw/zinc/64/88/45/942648845.db2.gz MMPWUCIRPMVTHX-INIZCTEOSA-N 0 0 361.442 3.615 20 5 FHBDRN COc1cc(CN(C)C(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)ccc1O ZINC000190113001 942661291 /nfs/dbraw/zinc/66/12/91/942661291.db2.gz DEFJRSCZUUPPEY-UHFFFAOYSA-N 0 0 358.394 3.705 20 5 FHBDRN O=C(N[C@@H](CO)CC1CCCCC1)c1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC000416329550 942661341 /nfs/dbraw/zinc/66/13/41/942661341.db2.gz XXRSIURUPUQSPP-CYBMUJFWSA-N 0 0 374.359 3.675 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N2CCC[C@@H](c3ccccc3)C2)c1F ZINC000412354723 942662174 /nfs/dbraw/zinc/66/21/74/942662174.db2.gz BYSKOWUEZYWKSI-OAHLLOKOSA-N 0 0 372.396 3.691 20 5 FHBDRN O=C(N[C@@H]1COc2cccc(Cl)c21)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412359340 942662931 /nfs/dbraw/zinc/66/29/31/942662931.db2.gz ODLCQQMAIGUCLG-GZBFAFLISA-N 0 0 358.781 3.602 20 5 FHBDRN CO[C@@H](C)C(=O)Nc1cccc(NC(=O)Nc2cccc([N+](=O)[O-])c2C)c1 ZINC000502697440 942664207 /nfs/dbraw/zinc/66/42/07/942664207.db2.gz DTSKHFUYSQSLCY-LBPRGKRZSA-N 0 0 372.381 3.521 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NCCc1cc(C(F)(F)F)ccn1 ZINC000421575131 942666469 /nfs/dbraw/zinc/66/64/69/942666469.db2.gz MZLWYASMLVSKQX-UHFFFAOYSA-N 0 0 367.327 3.598 20 5 FHBDRN Cc1nc(NC(=O)c2ccc(Sc3ccc(C)cc3)c([N+](=O)[O-])c2)n[nH]1 ZINC000502700608 942667017 /nfs/dbraw/zinc/66/70/17/942667017.db2.gz CWNULKRPEOZNSD-UHFFFAOYSA-N 0 0 369.406 3.733 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](CO)CC1CCCCC1 ZINC000416328520 942667743 /nfs/dbraw/zinc/66/77/43/942667743.db2.gz SWDYWARFURVEBZ-AWEZNQCLSA-N 0 0 366.483 3.768 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N[C@H](CO)CC1CCCCC1 ZINC000416327987 942668915 /nfs/dbraw/zinc/66/89/15/942668915.db2.gz QYJHDANVZCKLAJ-AWEZNQCLSA-N 0 0 354.834 3.618 20 5 FHBDRN COc1cccc([C@@H]2C[C@H]2CNC(=O)Nc2cccc([N+](=O)[O-])c2C)c1 ZINC000413837997 942669011 /nfs/dbraw/zinc/66/90/11/942669011.db2.gz STOYPQVUTQQTTC-HOCLYGCPSA-N 0 0 355.394 3.837 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)NC[C@@H]2CCCCC(F)(F)C2)c1F ZINC000412362926 942669579 /nfs/dbraw/zinc/66/95/79/942669579.db2.gz VLLHNYKEZZEEER-LLVKDONJSA-N 0 0 374.359 3.617 20 5 FHBDRN CC(C)Oc1cc(C(=O)N[C@H]2c3ccccc3O[C@H]2C)ccc1[N+](=O)[O-] ZINC000412363751 942669885 /nfs/dbraw/zinc/66/98/85/942669885.db2.gz RRNLRRRDGPGSIK-KPZWWZAWSA-N 0 0 356.378 3.634 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N1CC=C(c2cccnc2)CC1 ZINC000378375119 942674429 /nfs/dbraw/zinc/67/44/29/942674429.db2.gz GHYKDWOHSJNKBO-UHFFFAOYSA-N 0 0 357.797 3.502 20 5 FHBDRN CC(C)(C)OCc1cc(-c2nc(Cc3ccccc3[N+](=O)[O-])no2)no1 ZINC000420471261 942676055 /nfs/dbraw/zinc/67/60/55/942676055.db2.gz AAEIAJSRQXRVRJ-UHFFFAOYSA-N 0 0 358.354 3.539 20 5 FHBDRN C[C@H]([C@H]1Cc2ccccc2O1)N(C)C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000434435338 942676229 /nfs/dbraw/zinc/67/62/29/942676229.db2.gz SMKTXIHWKKVMEN-KZULUSFZSA-N 0 0 365.389 3.540 20 5 FHBDRN CCCc1[nH]nc(C(=O)Nc2ccc(NC(=O)CC(C)C)cc2)c1[N+](=O)[O-] ZINC000264599341 942678155 /nfs/dbraw/zinc/67/81/55/942678155.db2.gz IPAAMKXZTVJEQR-UHFFFAOYSA-N 0 0 373.413 3.507 20 5 FHBDRN CCc1ccc([C@@H](C)NC(=O)[C@H](C)N(C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000501799422 942682196 /nfs/dbraw/zinc/68/21/96/942682196.db2.gz GLSSOHWMFHGFLO-CVEARBPZSA-N 0 0 369.465 3.855 20 5 FHBDRN CCc1ccc([C@H](C)NC(=O)[C@@H](C)N(C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000501799425 942682387 /nfs/dbraw/zinc/68/23/87/942682387.db2.gz GLSSOHWMFHGFLO-JKSUJKDBSA-N 0 0 369.465 3.855 20 5 FHBDRN C[C@@H]1CN(C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)Cc2ccccc2O1 ZINC000412370624 942683532 /nfs/dbraw/zinc/68/35/32/942683532.db2.gz XJKRYQJKQLLHRH-JEBQAFNWSA-N 0 0 352.390 3.508 20 5 FHBDRN Cc1c(Cc2noc([C@@H]3C[C@H]3c3cccc(O)c3)n2)cccc1[N+](=O)[O-] ZINC000420486599 942690438 /nfs/dbraw/zinc/69/04/38/942690438.db2.gz GEUPKTHBPDXMQD-JKSUJKDBSA-N 0 0 351.362 3.854 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H](C)c1ncc(C)s1 ZINC000183617728 942695930 /nfs/dbraw/zinc/69/59/30/942695930.db2.gz BPSASWNTBVDNTR-DOMZBBRYSA-N 0 0 361.467 3.848 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)Nc1cc2c(cc1Cl)OCO2 ZINC000016477289 942698154 /nfs/dbraw/zinc/69/81/54/942698154.db2.gz OSVNQHBETAGOTL-UHFFFAOYSA-N 0 0 366.782 3.708 20 5 FHBDRN CCc1noc(C)c1-c1noc(-c2ccc([N+](=O)[O-])c(OC(C)C)c2)n1 ZINC000420495754 942700796 /nfs/dbraw/zinc/70/07/96/942700796.db2.gz TYUHNZBAJKYXPJ-UHFFFAOYSA-N 0 0 358.354 3.958 20 5 FHBDRN CC[C@@H](Sc1ccccc1)c1nc(-c2c([N+](=O)[O-])nc(C)n2C)no1 ZINC000420494184 942700905 /nfs/dbraw/zinc/70/09/05/942700905.db2.gz QMGIJCPEXHELOI-GFCCVEGCSA-N 0 0 359.411 3.930 20 5 FHBDRN CC[C@H](Sc1ccccc1)c1nc(-c2c([N+](=O)[O-])nc(C)n2C)no1 ZINC000420494188 942701109 /nfs/dbraw/zinc/70/11/09/942701109.db2.gz QMGIJCPEXHELOI-LBPRGKRZSA-N 0 0 359.411 3.930 20 5 FHBDRN CCOC(=O)c1ccc(F)c(C)c1NC(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000505423566 942702538 /nfs/dbraw/zinc/70/25/38/942702538.db2.gz VJWFHMQZLUJDHD-UHFFFAOYSA-N 0 0 360.341 3.780 20 5 FHBDRN CC(=O)Nc1ccc(C)cc1NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000413349311 942707835 /nfs/dbraw/zinc/70/78/35/942707835.db2.gz RNQSKCOKXAGQNG-JKSUJKDBSA-N 0 0 353.378 3.604 20 5 FHBDRN Cn1cc(C(=O)N2CC[C@H](C3CCCC3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000421647603 942720147 /nfs/dbraw/zinc/72/01/47/942720147.db2.gz WAUKOZFTDJGQFK-INIZCTEOSA-N 0 0 368.437 3.648 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N(C)c1ccc(C(=O)NC(C)(C)C)cc1 ZINC000413883603 942722236 /nfs/dbraw/zinc/72/22/36/942722236.db2.gz SHDGGPLQDCGMMI-UHFFFAOYSA-N 0 0 369.421 3.708 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N2CC[C@H](C3CCCC3)C2)cc1OC ZINC000421654240 942722533 /nfs/dbraw/zinc/72/25/33/942722533.db2.gz KMESDOIFUDWAIW-AWEZNQCLSA-N 0 0 362.426 3.654 20 5 FHBDRN CC[C@H](C)c1nnc(N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)n1CC ZINC000549428474 942723175 /nfs/dbraw/zinc/72/31/75/942723175.db2.gz VOLZITNNIMXTOT-AWEZNQCLSA-N 0 0 373.457 3.768 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCC(F)(c2ccccc2)CC1 ZINC000434497680 942723429 /nfs/dbraw/zinc/72/34/29/942723429.db2.gz FGCMLOWSPXPKBQ-UHFFFAOYSA-N 0 0 371.412 3.803 20 5 FHBDRN Cc1cc(S(=O)(=O)N(C)[C@H](C)c2cccs2)c(C)cc1[N+](=O)[O-] ZINC000416370106 942735271 /nfs/dbraw/zinc/73/52/71/942735271.db2.gz JGXKIVZIOVPHPF-GFCCVEGCSA-N 0 0 354.453 3.655 20 5 FHBDRN CCOC(=O)c1ccc(F)c(C)c1NC(=O)c1cccc([N+](=O)[O-])c1C ZINC000505427790 942742984 /nfs/dbraw/zinc/74/29/84/942742984.db2.gz HWHKBSXWBMXXRG-UHFFFAOYSA-N 0 0 360.341 3.780 20 5 FHBDRN CCCCN(C1CC1)S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000416377494 942748689 /nfs/dbraw/zinc/74/86/89/942748689.db2.gz XNMDAIMRVXWYCG-UHFFFAOYSA-N 0 0 366.361 3.567 20 5 FHBDRN O=[N+]([O-])c1cnc(N[C@@H](CO)c2ccc(Br)cc2)c(Cl)c1 ZINC000502800515 942752869 /nfs/dbraw/zinc/75/28/69/942752869.db2.gz XYRWBKAACBVUAX-LBPRGKRZSA-N 0 0 372.606 3.551 20 5 FHBDRN COc1cc(C(=O)N2CCC[C@]2(C)CC(C)C)cc([N+](=O)[O-])c1OC ZINC000452505848 942765820 /nfs/dbraw/zinc/76/58/20/942765820.db2.gz CDPUNHUDTOYURP-GOSISDBHSA-N 0 0 350.415 3.653 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc2c(c1)C(=O)CCCC2 ZINC000421716829 942768406 /nfs/dbraw/zinc/76/84/06/942768406.db2.gz UDAMRKPWTWNZRJ-UHFFFAOYSA-N 0 0 354.362 3.765 20 5 FHBDRN C[C@H](NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1)c1ccc(F)cc1F ZINC000181587274 942775476 /nfs/dbraw/zinc/77/54/76/942775476.db2.gz SDXKNBMNVWZCTE-JTQLQIEISA-N 0 0 360.320 3.774 20 5 FHBDRN CC(=O)c1ccccc1NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514144955 942780507 /nfs/dbraw/zinc/78/05/07/942780507.db2.gz SFZLCUFOXUSKAA-UHFFFAOYSA-N 0 0 350.277 3.651 20 5 FHBDRN O=C(c1ccc(OC(F)F)c([N+](=O)[O-])c1)N1CCC[C@@H](C(F)(F)F)C1 ZINC000514161231 942782889 /nfs/dbraw/zinc/78/28/89/942782889.db2.gz YKIQLZSDHFIIMH-SECBINFHSA-N 0 0 368.258 3.611 20 5 FHBDRN Cc1cc(=NC(=O)c2cc([N+](=O)[O-])ccc2SC(C)C)[nH]n1C(C)C ZINC000421732846 942785028 /nfs/dbraw/zinc/78/50/28/942785028.db2.gz UBNBTVNFBCFUAK-UHFFFAOYSA-N 0 0 362.455 3.855 20 5 FHBDRN Cc1ccc(C(=O)N2CC[C@@H](O)[C@H]2c2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000425109408 942791036 /nfs/dbraw/zinc/79/10/36/942791036.db2.gz UAZSPGVIPFEGDN-IAGOWNOFSA-N 0 0 360.797 3.505 20 5 FHBDRN O=C(NC1(c2cccc(F)c2)CC1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514182002 942791347 /nfs/dbraw/zinc/79/13/47/942791347.db2.gz FAPMEGJJRDANIL-UHFFFAOYSA-N 0 0 366.295 3.754 20 5 FHBDRN O=C(COc1cccc([N+](=O)[O-])c1)N1CC[C@@H](C(F)(F)F)C2(CCC2)C1 ZINC000514185861 942794672 /nfs/dbraw/zinc/79/46/72/942794672.db2.gz FXYLWYBZUUCVQY-CQSZACIVSA-N 0 0 372.343 3.555 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)N2C[C@@H](O)C[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000413930052 942800198 /nfs/dbraw/zinc/80/01/98/942800198.db2.gz BMBJAVGNNYVKOH-WMZOPIPTSA-N 0 0 368.433 3.840 20 5 FHBDRN COc1ccc(OC(=O)CCCOc2ccc3c(c2)CCC3)cc1[N+](=O)[O-] ZINC001269174098 942803134 /nfs/dbraw/zinc/80/31/34/942803134.db2.gz AKBKVHPGCZOSRA-UHFFFAOYSA-N 0 0 371.389 3.857 20 5 FHBDRN CC(=O)c1ccc2c(c1)CN(C(=O)c1c(C)cc(C)c([N+](=O)[O-])c1C)C2 ZINC000413936318 942805530 /nfs/dbraw/zinc/80/55/30/942805530.db2.gz YJLCQURJOFWSLL-UHFFFAOYSA-N 0 0 352.390 3.879 20 5 FHBDRN Cc1ccc([C@@H](CN2CCOCC2)Nc2ccc([N+](=O)[O-])c(C)c2)cc1 ZINC000514180890 942805510 /nfs/dbraw/zinc/80/55/10/942805510.db2.gz XIQXMMLXEZCLIB-LJQANCHMSA-N 0 0 355.438 3.697 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCO[C@H](c2ccccc2F)C1 ZINC000421763895 942810541 /nfs/dbraw/zinc/81/05/41/942810541.db2.gz SCGKPWLGVVAJPE-SFHVURJKSA-N 0 0 358.369 3.564 20 5 FHBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)N[C@H](c2ccccc2)C2CCC2)cc1 ZINC000183647674 942818953 /nfs/dbraw/zinc/81/89/53/942818953.db2.gz AZZNXDVVNIZNEI-LJQANCHMSA-N 0 0 374.462 3.598 20 5 FHBDRN Cc1nn(Cc2nc(-c3ccc(F)c(F)c3)no2)c2ccc([N+](=O)[O-])cc12 ZINC000502883647 942826780 /nfs/dbraw/zinc/82/67/80/942826780.db2.gz SWPJLYJTTHWOEA-UHFFFAOYSA-N 0 0 371.303 3.629 20 5 FHBDRN CCCn1nccc1C1CCN(C(=O)Nc2cc([N+](=O)[O-])ccc2C)CC1 ZINC000367080056 942826877 /nfs/dbraw/zinc/82/68/77/942826877.db2.gz YBKJODVNQCPELA-UHFFFAOYSA-N 0 0 371.441 3.921 20 5 FHBDRN Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)N[C@@H]1CCCC[C@@H]1n1cccn1 ZINC000367093074 942839676 /nfs/dbraw/zinc/83/96/76/942839676.db2.gz RFRZTKJDTOPXKW-HIFRSBDPSA-N 0 0 361.377 3.544 20 5 FHBDRN Nc1c(C(=O)N2CC[C@@](F)(c3cccc(Cl)c3)C2)cccc1[N+](=O)[O-] ZINC000514230147 942840251 /nfs/dbraw/zinc/84/02/51/942840251.db2.gz WKZMEHYNNXAUAG-KRWDZBQOSA-N 0 0 363.776 3.541 20 5 FHBDRN O=C(N[C@@H]1C[C@H]1c1ccccc1C(F)(F)F)c1csc([N+](=O)[O-])c1 ZINC000505460315 942841922 /nfs/dbraw/zinc/84/19/22/942841922.db2.gz MNQUWRHDHLCTDL-CMPLNLGQSA-N 0 0 356.325 3.961 20 5 FHBDRN Cc1cccc2c1OCC[C@H]2NC(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000190167460 942848319 /nfs/dbraw/zinc/84/83/19/942848319.db2.gz WAURLOYISYODMS-MRXNPFEDSA-N 0 0 358.419 3.635 20 5 FHBDRN Cc1ncsc1CCC(=O)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000412378238 942852912 /nfs/dbraw/zinc/85/29/12/942852912.db2.gz LOYPNKHZHARDPZ-HNNXBMFYSA-N 0 0 359.451 3.699 20 5 FHBDRN COc1ccc(OCC(=O)N[C@@H](C)c2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000190180082 942855131 /nfs/dbraw/zinc/85/51/31/942855131.db2.gz LNKXGVRQCAQSNG-NSHDSACASA-N 0 0 364.785 3.513 20 5 FHBDRN CSc1cccc(C(=O)N2CC3(CCOCC3)[C@H]2C(C)C)c1[N+](=O)[O-] ZINC000413979044 942858541 /nfs/dbraw/zinc/85/85/41/942858541.db2.gz QBFWCYYRAOJMPF-MRXNPFEDSA-N 0 0 364.467 3.594 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@H](O)c2ccccc2C1 ZINC000378525497 942861681 /nfs/dbraw/zinc/86/16/81/942861681.db2.gz FTMTZVDVIDCLCI-ACJLOTCBSA-N 0 0 372.446 3.541 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CCC[C@H]2C(C)(C)C)cc1OC ZINC000413983055 942867283 /nfs/dbraw/zinc/86/72/83/942867283.db2.gz GNSCZSTWRSBVSA-ZIAGYGMSSA-N 0 0 364.442 3.947 20 5 FHBDRN CC(C)OCC(C)(C)NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000413999690 942872282 /nfs/dbraw/zinc/87/22/82/942872282.db2.gz LVVSRQGKPYQDED-UHFFFAOYSA-N 0 0 363.439 3.652 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N2CCC[C@@]2(C)Cc2ccc(F)cc2)c1[N+](=O)[O-] ZINC000421917030 942874086 /nfs/dbraw/zinc/87/40/86/942874086.db2.gz JKPJOHZJTBQJHA-IBGZPJMESA-N 0 0 374.416 3.818 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N([C@@H](C)C(=O)OC(C)(C)C)C1CC1 ZINC000421904776 942879968 /nfs/dbraw/zinc/87/99/68/942879968.db2.gz ZNMORDQALUDGGD-ZDUSSCGKSA-N 0 0 362.426 3.546 20 5 FHBDRN C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N(C)Cc1cccs1 ZINC000016586885 942880469 /nfs/dbraw/zinc/88/04/69/942880469.db2.gz BJVXYQNOJMQGQM-SNVBAGLBSA-N 0 0 353.831 3.769 20 5 FHBDRN C[C@H](c1ccccc1)[C@H](C)NC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000473550750 942898409 /nfs/dbraw/zinc/89/84/09/942898409.db2.gz LWDUNBBFQFWVOD-GJZGRUSLSA-N 0 0 364.405 3.703 20 5 FHBDRN CC[C@H]1CN(C(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[C@H](CC)O1 ZINC000421961047 942909867 /nfs/dbraw/zinc/90/98/67/942909867.db2.gz FLBUBHJVBJWSJN-RYUDHWBXSA-N 0 0 360.332 3.643 20 5 FHBDRN CN([C@H]1CCC[C@@H]1c1ccccc1)S(=O)(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000416538775 942927805 /nfs/dbraw/zinc/92/78/05/942927805.db2.gz BVDSOXLOIXLDRH-MOPGFXCFSA-N 0 0 374.462 3.693 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)N[C@@H](CCO)c2ccccc2)cc1[N+](=O)[O-] ZINC000434742108 942934499 /nfs/dbraw/zinc/93/44/99/942934499.db2.gz MNDCLRYGDWJPKI-KRWDZBQOSA-N 0 0 356.422 3.746 20 5 FHBDRN COc1ccc([C@H](NC(=O)c2cc([N+](=O)[O-])ccc2OC)C(C)C)cc1 ZINC000503054762 942952897 /nfs/dbraw/zinc/95/28/97/942952897.db2.gz TVFUNXDTQFWIMQ-GOSISDBHSA-N 0 0 358.394 3.739 20 5 FHBDRN O=[N+]([O-])c1cc(F)c(COc2nc(Cc3ccc(F)cc3)no2)c(F)c1 ZINC000505521137 942963110 /nfs/dbraw/zinc/96/31/10/942963110.db2.gz USZWTVNASQRTQW-UHFFFAOYSA-N 0 0 365.267 3.565 20 5 FHBDRN CC(C)Cn1cnnc1[C@@H]1CCCN1c1ccc([N+](=O)[O-])c2cnccc21 ZINC000078021992 942971850 /nfs/dbraw/zinc/97/18/50/942971850.db2.gz ORZLEVZASJQZAL-SFHVURJKSA-N 0 0 366.425 3.732 20 5 FHBDRN Cc1cc(C(=O)NCC(=O)Nc2ccc(C(C)(C)C)cc2)ccc1[N+](=O)[O-] ZINC000016643642 942976170 /nfs/dbraw/zinc/97/61/70/942976170.db2.gz CZBLAGFRNKSCLJ-UHFFFAOYSA-N 0 0 369.421 3.569 20 5 FHBDRN Cc1c(NC(=O)[C@@H](OC2CCOCC2)c2ccccc2)cccc1[N+](=O)[O-] ZINC000536253839 942986462 /nfs/dbraw/zinc/98/64/62/942986462.db2.gz LTMAAKMEJBOKHG-IBGZPJMESA-N 0 0 370.405 3.779 20 5 FHBDRN O=C(NCc1ncc(-c2ccccc2)cn1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000183856889 942991618 /nfs/dbraw/zinc/99/16/18/942991618.db2.gz SARXKJHSBMEPGZ-UHFFFAOYSA-N 0 0 368.780 3.635 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)NC2(c3ccc(F)cc3)CCCC2)c1[N+](=O)[O-] ZINC000434186977 942998219 /nfs/dbraw/zinc/99/82/19/942998219.db2.gz OBNRUPMKBIRBQV-UHFFFAOYSA-N 0 0 360.389 3.780 20 5 FHBDRN Cc1nn(CC(F)(F)F)cc1-c1nc(-c2ccc(C)c([N+](=O)[O-])c2)no1 ZINC000273698822 943014626 /nfs/dbraw/zinc/01/46/26/943014626.db2.gz GJMHHGJMZRPPQM-UHFFFAOYSA-N 0 0 367.287 3.687 20 5 FHBDRN CCC[C@H](NC(=O)NCCNc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000514458931 943021388 /nfs/dbraw/zinc/02/13/88/943021388.db2.gz JLKDHLSNOCPQAW-INIZCTEOSA-N 0 0 356.426 3.847 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)N[C@@H]1C[C@H]1c1ccccc1C(F)(F)F ZINC000505559313 943028520 /nfs/dbraw/zinc/02/85/20/943028520.db2.gz VFVNVVVMDQCJFS-GOEBONIOSA-N 0 0 364.323 3.828 20 5 FHBDRN Cc1ccc([C@@]2(C)CCN(C(=O)Cc3cccc([N+](=O)[O-])c3C)C2)cc1 ZINC000469258339 943043399 /nfs/dbraw/zinc/04/33/99/943043399.db2.gz PINQPCRQJFDPBL-NRFANRHFSA-N 0 0 352.434 3.944 20 5 FHBDRN O=[N+]([O-])c1ccn(C2CCN(Cc3csc(C4CCCC4)n3)CC2)n1 ZINC000365823240 943063121 /nfs/dbraw/zinc/06/31/21/943063121.db2.gz UXAKZHRNKMSJKJ-UHFFFAOYSA-N 0 0 361.471 3.743 20 5 FHBDRN CCOCCOc1cc(C)ccc1CNc1ncc(Cl)cc1[N+](=O)[O-] ZINC000434958200 943071831 /nfs/dbraw/zinc/07/18/31/943071831.db2.gz KYDFXUOTXFDQDV-UHFFFAOYSA-N 0 0 365.817 3.979 20 5 FHBDRN CCN(Cc1ccc(OC)cc1OC)c1ncc(Cl)cc1[N+](=O)[O-] ZINC000434957413 943071907 /nfs/dbraw/zinc/07/19/07/943071907.db2.gz CZCLZVJLUOCFMG-UHFFFAOYSA-N 0 0 351.790 3.687 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)cnc1NC[C@H](CO)Cc1c(F)cccc1Cl ZINC000434957619 943072466 /nfs/dbraw/zinc/07/24/66/943072466.db2.gz GZTMUXSHIFNJFN-SECBINFHSA-N 0 0 374.199 3.699 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)cnc1NCc1nc(-c2ccc(Cl)cc2)no1 ZINC000434957629 943072529 /nfs/dbraw/zinc/07/25/29/943072529.db2.gz HCNFYEAWKWYIOC-UHFFFAOYSA-N 0 0 366.164 3.959 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)cnc1NC[C@@H](CO)Cc1c(F)cccc1Cl ZINC000434957620 943072718 /nfs/dbraw/zinc/07/27/18/943072718.db2.gz GZTMUXSHIFNJFN-VIFPVBQESA-N 0 0 374.199 3.699 20 5 FHBDRN C[C@H](NC(=O)NCC1(Cc2ccccc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000434968549 943076772 /nfs/dbraw/zinc/07/67/72/943076772.db2.gz STOQPYZPQOZPEJ-HNNXBMFYSA-N 0 0 353.422 3.978 20 5 FHBDRN CCn1cc([C@H]2OCCC[C@@H]2Nc2ccnc3c2cccc3[N+](=O)[O-])cn1 ZINC000425256794 943078763 /nfs/dbraw/zinc/07/87/63/943078763.db2.gz OXIBDFYMTKDLHI-QFBILLFUSA-N 0 0 367.409 3.692 20 5 FHBDRN O=[N+]([O-])c1cccc(Cl)c1N1CCC(c2noc(C(F)F)n2)CC1 ZINC000366613488 943082597 /nfs/dbraw/zinc/08/25/97/943082597.db2.gz AAIJEEQGOMUUSS-UHFFFAOYSA-N 0 0 358.732 3.953 20 5 FHBDRN Cc1cc(C)n(-c2cccc(NC(=O)c3ccc([N+](=O)[O-])c(C)c3)c2)n1 ZINC000514541993 943085378 /nfs/dbraw/zinc/08/53/78/943085378.db2.gz JVTLMPXTYQMYRI-UHFFFAOYSA-N 0 0 350.378 3.958 20 5 FHBDRN CCN1CCc2nc(NC(=O)c3ccc(C(C)C)c([N+](=O)[O-])c3)sc2C1 ZINC000190392670 943088024 /nfs/dbraw/zinc/08/80/24/943088024.db2.gz GCIQIPBWYFOIKL-UHFFFAOYSA-N 0 0 374.466 3.805 20 5 FHBDRN COCC[C@@H](Nc1ccc([N+](=O)[O-])c(-c2ccccc2)n1)c1ccco1 ZINC000503257460 943089111 /nfs/dbraw/zinc/08/91/11/943089111.db2.gz SFKZSYCQNIAKTA-OAHLLOKOSA-N 0 0 353.378 3.861 20 5 FHBDRN COCCN(CCc1ccccc1)C(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000514532712 943091073 /nfs/dbraw/zinc/09/10/73/943091073.db2.gz QOCJSEDGPKCGPU-UHFFFAOYSA-N 0 0 362.813 3.580 20 5 FHBDRN COc1cccc(OCc2cc(OC)c(OCC(F)F)cc2[N+](=O)[O-])c1 ZINC000503276608 943096870 /nfs/dbraw/zinc/09/68/70/943096870.db2.gz OGRJDIUPEQFOJB-UHFFFAOYSA-N 0 0 369.320 3.835 20 5 FHBDRN O=C(OCc1cnn(-c2ccccc2)c1)c1ccc([N+](=O)[O-])cc1Cl ZINC000016718462 943098259 /nfs/dbraw/zinc/09/82/59/943098259.db2.gz KPBZIGCWCSYZKN-UHFFFAOYSA-N 0 0 357.753 3.791 20 5 FHBDRN O=C(Nc1n[nH]c2ccc([N+](=O)[O-])cc21)c1cc(-c2cccc(F)c2)no1 ZINC000536254510 943098682 /nfs/dbraw/zinc/09/86/82/943098682.db2.gz XXEIGPPFNJGFKV-UHFFFAOYSA-N 0 0 367.296 3.518 20 5 FHBDRN O=C(CSc1nc2ccccc2s1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000016725571 943102437 /nfs/dbraw/zinc/10/24/37/943102437.db2.gz WRZISRXHACXNRQ-UHFFFAOYSA-N 0 0 371.443 3.886 20 5 FHBDRN COc1ccc(-c2ccc(CNCc3ncccc3F)o2)c([N+](=O)[O-])c1 ZINC000126353987 943112818 /nfs/dbraw/zinc/11/28/18/943112818.db2.gz CBSAGLGZAGINGO-UHFFFAOYSA-N 0 0 357.341 3.687 20 5 FHBDRN COc1cc(CCC(=O)N(C)Cc2ccccc2[N+](=O)[O-])ccc1Cl ZINC000435034196 943116789 /nfs/dbraw/zinc/11/67/89/943116789.db2.gz MIWBWOGLGWFRSH-UHFFFAOYSA-N 0 0 362.813 3.848 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1Br)Nc1cccc(F)c1 ZINC000133664713 943125930 /nfs/dbraw/zinc/12/59/30/943125930.db2.gz CKKKUNUWARVXKA-UHFFFAOYSA-N 0 0 369.146 3.514 20 5 FHBDRN Cn1cc(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)c(-c2ccccc2)n1 ZINC000183769174 943138606 /nfs/dbraw/zinc/13/86/06/943138606.db2.gz UYYXWNJLFGQKFX-UHFFFAOYSA-N 0 0 370.796 3.579 20 5 FHBDRN CC[C@@H](NC(=O)NCCc1cccc([N+](=O)[O-])c1)c1ccc(OC)cc1 ZINC000126380636 943141258 /nfs/dbraw/zinc/14/12/58/943141258.db2.gz HTXNXZSCNWRPMA-GOSISDBHSA-N 0 0 357.410 3.596 20 5 FHBDRN CCCc1coc(NC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])n1 ZINC000514611019 943146935 /nfs/dbraw/zinc/14/69/35/943146935.db2.gz GEGBCNZUYYQMIX-UHFFFAOYSA-N 0 0 355.803 3.920 20 5 FHBDRN CCc1nn(C)c(S[C@@H]2CCC[N@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000425276140 943150042 /nfs/dbraw/zinc/15/00/42/943150042.db2.gz CZESELQNPRXDDH-OAHLLOKOSA-N 0 0 360.483 3.647 20 5 FHBDRN CC(C)(NC(=O)Cc1coc(-c2ccccc2)n1)c1ccccc1[N+](=O)[O-] ZINC000514623634 943157261 /nfs/dbraw/zinc/15/72/61/943157261.db2.gz RZLHKXIPQJKTBN-UHFFFAOYSA-N 0 0 365.389 3.844 20 5 FHBDRN C[C@@H](NC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F)c1ccc(F)cc1F ZINC000514627618 943160303 /nfs/dbraw/zinc/16/03/03/943160303.db2.gz BOBOIZJTAIFDOW-MRVPVSSYSA-N 0 0 356.275 3.571 20 5 FHBDRN CCC[C@@H]1C[C@H](C(=O)N2CCS[C@@H]2c2ccc([N+](=O)[O-])cc2)CCO1 ZINC000503399676 943162046 /nfs/dbraw/zinc/16/20/46/943162046.db2.gz VTRDIYJBVCRMRN-QGPMSJSTSA-N 0 0 364.467 3.764 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H](OC)C(C)(C)C ZINC000503407625 943167496 /nfs/dbraw/zinc/16/74/96/943167496.db2.gz QTSZMVTXDGXTIV-OAHLLOKOSA-N 0 0 354.472 3.888 20 5 FHBDRN C[C@H](CC(=O)NCCNc1ccccc1[N+](=O)[O-])c1ccc(F)cc1F ZINC000503408269 943178258 /nfs/dbraw/zinc/17/82/58/943178258.db2.gz QJHRTNKQSGTFRI-GFCCVEGCSA-N 0 0 363.364 3.595 20 5 FHBDRN Cc1cc(C(F)(F)F)ccc1CNC(=O)c1c(F)cccc1[N+](=O)[O-] ZINC001269268687 943179290 /nfs/dbraw/zinc/17/92/90/943179290.db2.gz ULJLYZWQOITWSK-UHFFFAOYSA-N 0 0 356.275 3.991 20 5 FHBDRN C[C@@H](C(=O)N1C[C@@H]2CCC(=O)c3cccc1c32)c1ccc([N+](=O)[O-])cc1F ZINC000183801953 943186911 /nfs/dbraw/zinc/18/69/11/943186911.db2.gz BCIQEULCTTXCFD-NEPJUHHUSA-N 0 0 368.364 3.944 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CC3(CCC3)[C@@H]2C2CCOCC2)c2ccncc21 ZINC000425284147 943187245 /nfs/dbraw/zinc/18/72/45/943187245.db2.gz PYLQQCNBCIKLOL-IBGZPJMESA-N 0 0 353.422 3.929 20 5 FHBDRN O=C([O-])[C@H]1CCC[N@H+](Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)C1 ZINC000414678906 943221959 /nfs/dbraw/zinc/22/19/59/943221959.db2.gz JXWAGXAQKROHKR-AWEZNQCLSA-N 0 0 374.368 3.823 20 5 FHBDRN CO[C@H]1c2ccccc2C[C@H]1NC(=O)Nc1c(C)ccc([N+](=O)[O-])c1C ZINC000416918160 943225755 /nfs/dbraw/zinc/22/57/55/943225755.db2.gz KTYDKNNAVCIXGC-QAPCUYQASA-N 0 0 355.394 3.646 20 5 FHBDRN CCC(CC)NC(=O)NCCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000503512758 943227921 /nfs/dbraw/zinc/22/79/21/943227921.db2.gz IYCLTTSBGJFAIU-UHFFFAOYSA-N 0 0 362.352 3.513 20 5 FHBDRN CC(C)c1[nH]nc(C(=O)Nc2ccc(Nc3ccccc3)nc2)c1[N+](=O)[O-] ZINC000434181873 943245021 /nfs/dbraw/zinc/24/50/21/943245021.db2.gz HIRZHXZMGZDDJC-UHFFFAOYSA-N 0 0 366.381 3.832 20 5 FHBDRN Cc1c(C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)sc2nccn12 ZINC000503535451 943247588 /nfs/dbraw/zinc/24/75/88/943247588.db2.gz LAWCDSKDWAKSPF-UHFFFAOYSA-N 0 0 358.423 3.663 20 5 FHBDRN O=C(c1ccc(NC2CC2)c([N+](=O)[O-])c1)N1CC[C@](F)(c2ccccc2)C1 ZINC000514741503 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943772491 /nfs/dbraw/zinc/77/24/91/943772491.db2.gz DICQXEXTOQKVDM-JQWIXIFHSA-N 0 0 360.332 3.702 20 5 FHBDRN CSc1ccc(C(=O)N[C@@H]2CCCOc3ccccc32)cc1[N+](=O)[O-] ZINC000504730104 943774159 /nfs/dbraw/zinc/77/41/59/943774159.db2.gz AAMTVWWPKZASDF-CQSZACIVSA-N 0 0 358.419 3.960 20 5 FHBDRN Cc1cc(NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)ccc1C1CC1 ZINC000516862660 943775607 /nfs/dbraw/zinc/77/56/07/943775607.db2.gz FLNKYDQBSKTAET-UHFFFAOYSA-N 0 0 360.435 3.666 20 5 FHBDRN Cn1cc(C(=O)NC[C@H]2CCC[C@@H]2C2CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000412484587 943776688 /nfs/dbraw/zinc/77/66/88/943776688.db2.gz XKJXFMWJRZQTDP-NVXWUHKLSA-N 0 0 368.437 3.551 20 5 FHBDRN CC[C@H](CCC(=O)[O-])[NH2+]Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000417627658 943777416 /nfs/dbraw/zinc/77/74/16/943777416.db2.gz SPXBXLKMGVKCMX-GFCCVEGCSA-N 0 0 362.382 3.596 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)N[C@@H]1CCCOc2ccccc21 ZINC000504748424 943780304 /nfs/dbraw/zinc/78/03/04/943780304.db2.gz MSUVXXJMAUDPRX-GOSISDBHSA-N 0 0 369.421 3.817 20 5 FHBDRN COCCSc1ccc([C@@H](C)NC(=O)c2csc([N+](=O)[O-])c2)cc1 ZINC000504749703 943780570 /nfs/dbraw/zinc/78/05/70/943780570.db2.gz IYEIIMKJIAYWJM-LLVKDONJSA-N 0 0 366.464 3.886 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CCC1(CC(=O)[O-])CCCCC1 ZINC000417646949 943781005 /nfs/dbraw/zinc/78/10/05/943781005.db2.gz GSMAIPGATLUVKJ-UHFFFAOYSA-N 0 0 364.442 3.898 20 5 FHBDRN Cn1cc(CN[C@H]2C[C@]2(F)c2ccccc2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000424203736 943787381 /nfs/dbraw/zinc/78/73/81/943787381.db2.gz UTJNCOJBPHFRBU-ICSRJNTNSA-N 0 0 366.396 3.722 20 5 FHBDRN C[C@H]([C@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C(=O)[O-])C1CC1 ZINC000417639319 943788676 /nfs/dbraw/zinc/78/86/76/943788676.db2.gz LUHKNOSPKGROGF-GTNSWQLSSA-N 0 0 360.435 3.912 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)c1nc(-c2ccccc2)cs1 ZINC000504765743 943789813 /nfs/dbraw/zinc/78/98/13/943789813.db2.gz PKOZLZUBELCMKJ-UHFFFAOYSA-N 0 0 353.403 3.691 20 5 FHBDRN CNc1ccc(C(=O)Nc2ccc3c(c2)C(=O)CC(C)(C)O3)cc1[N+](=O)[O-] ZINC000516883809 943793223 /nfs/dbraw/zinc/79/32/23/943793223.db2.gz LHRLFEVXKMXJBM-UHFFFAOYSA-N 0 0 369.377 3.633 20 5 FHBDRN C[C@@H](NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1)[C@@H]1OCCc2sccc21 ZINC000516885635 943795369 /nfs/dbraw/zinc/79/53/69/943795369.db2.gz YVVWMNQMUXWJCY-PSLIRLAXSA-N 0 0 366.826 3.742 20 5 FHBDRN COc1cccc(C(=O)N[C@@H]2CCCO[C@H]2c2ccc(C)cc2)c1[N+](=O)[O-] ZINC000435824268 943796220 /nfs/dbraw/zinc/79/62/20/943796220.db2.gz CPJKABWRFHIJBL-APWZRJJASA-N 0 0 370.405 3.562 20 5 FHBDRN O=C(NCCc1ccc(F)cc1)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000435828433 943799673 /nfs/dbraw/zinc/79/96/73/943799673.db2.gz WBDASTZDUOEMOA-UHFFFAOYSA-N 0 0 360.388 3.793 20 5 FHBDRN CCCOc1cc(C)ccc1CNC(=O)c1cccc(OC)c1[N+](=O)[O-] ZINC000435829312 943800330 /nfs/dbraw/zinc/80/03/30/943800330.db2.gz YUBKGCGIGUOGHI-UHFFFAOYSA-N 0 0 358.394 3.631 20 5 FHBDRN COc1cccc(OC)c1OCCCCOc1ncc(C)cc1[N+](=O)[O-] ZINC000515334308 943803196 /nfs/dbraw/zinc/80/31/96/943803196.db2.gz ZLEWTFGYUHIMBK-UHFFFAOYSA-N 0 0 362.382 3.553 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N(CC1CCC1)[C@H](C)CO ZINC000435859294 943812130 /nfs/dbraw/zinc/81/21/30/943812130.db2.gz WWOMCSANZHONOM-CYBMUJFWSA-N 0 0 366.483 3.720 20 5 FHBDRN COc1cccc(C(=O)N[C@H](c2ccc(F)cc2)C(F)(F)F)c1[N+](=O)[O-] ZINC000435867766 943822505 /nfs/dbraw/zinc/82/25/05/943822505.db2.gz PYENSEJCTGSMMP-CQSZACIVSA-N 0 0 372.274 3.776 20 5 FHBDRN COc1cccc(C(=O)NCCCCCOC2CCCCC2)c1[N+](=O)[O-] ZINC000435872226 943825898 /nfs/dbraw/zinc/82/58/98/943825898.db2.gz XJNONHNQPURLMF-UHFFFAOYSA-N 0 0 364.442 3.853 20 5 FHBDRN CC1(C)C[C@H](Nc2ccc(COCCO)cc2)c2cc([N+](=O)[O-])ccc21 ZINC000424319933 943842986 /nfs/dbraw/zinc/84/29/86/943842986.db2.gz RBRWLRFEIXRYLN-IBGZPJMESA-N 0 0 356.422 3.938 20 5 FHBDRN C[C@H](NC(=O)COc1ccc(F)cc1Cl)c1cccc([N+](=O)[O-])c1 ZINC000053338628 943845280 /nfs/dbraw/zinc/84/52/80/943845280.db2.gz UFQYOAQWLZURJV-JTQLQIEISA-N 0 0 352.749 3.644 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N[C@H]1C[C@H](c2cc(F)cc(F)c2)C1 ZINC000437479384 943847863 /nfs/dbraw/zinc/84/78/63/943847863.db2.gz DFOLTRNCQPHEPP-CZIWCDLHSA-N 0 0 360.360 3.868 20 5 FHBDRN CSc1ccc(CCNC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)cc1 ZINC000437480800 943849422 /nfs/dbraw/zinc/84/94/22/943849422.db2.gz WWFSVNFIICSNPQ-UHFFFAOYSA-N 0 0 355.419 3.771 20 5 FHBDRN Cn1cc([N+](=O)[O-])cc1C(=O)N[C@H]1C[C@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000584877251 943852739 /nfs/dbraw/zinc/85/27/39/943852739.db2.gz GCTNCXZZEIEPJF-AULYBMBSSA-N 0 0 367.327 3.628 20 5 FHBDRN CSc1ccc(CCNC(=O)CSc2ccccc2[N+](=O)[O-])cc1 ZINC000437497670 943861798 /nfs/dbraw/zinc/86/17/98/943861798.db2.gz OMAMNBWXWBQOIV-UHFFFAOYSA-N 0 0 362.476 3.768 20 5 FHBDRN O=[N+]([O-])c1cc2c(nc1N[C@@H]1CCOC3(CCSCC3)C1)CCCC2 ZINC000516967551 943868877 /nfs/dbraw/zinc/86/88/77/943868877.db2.gz LFKZEVRTZSVNCK-CQSZACIVSA-N 0 0 363.483 3.725 20 5 FHBDRN O=C(Nc1nccs1)c1cc(F)cc2c(=O)c3cccc(F)c3[nH]c12 ZINC000435938654 943871792 /nfs/dbraw/zinc/87/17/92/943871792.db2.gz SGVOGNDLVIFVOJ-UHFFFAOYSA-N 0 0 357.341 3.668 20 5 FHBDRN C[C@@H]1C[C@@H]1[C@H](Nc1nccc(C(N)=O)c1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000290761436 943885771 /nfs/dbraw/zinc/88/57/71/943885771.db2.gz KAUVKYQKWWQOJH-BIGNPOOSSA-N 0 0 360.801 3.551 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1C[C@H](c2cc(F)cc(F)c2)C1 ZINC000437507786 943886677 /nfs/dbraw/zinc/88/66/77/943886677.db2.gz MWIMTCZLJAYAEM-YEORSEQZSA-N 0 0 362.332 3.558 20 5 FHBDRN O=C(CN1CCS[C@@H]2CCCC[C@@H]21)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000437531023 943892407 /nfs/dbraw/zinc/89/24/07/943892407.db2.gz ZFFNEBFILLZDJD-DZGCQCFKSA-N 0 0 369.874 3.547 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)[C@@H]1CCCOC1 ZINC000504895887 943893643 /nfs/dbraw/zinc/89/36/43/943893643.db2.gz AXYPBSVJXKEBRV-CHWSQXEVSA-N 0 0 352.456 3.642 20 5 FHBDRN O=C(COc1ccccc1[N+](=O)[O-])N1CCC(Cc2ccc(F)cc2)CC1 ZINC000504922972 943921449 /nfs/dbraw/zinc/92/14/49/943921449.db2.gz DMSLAECPLKPJDT-UHFFFAOYSA-N 0 0 372.396 3.594 20 5 FHBDRN Cc1cc([C@@H]2CCCN2C(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)on1 ZINC000435996189 943921516 /nfs/dbraw/zinc/92/15/16/943921516.db2.gz PQRIHPXWGRFQMY-IBGZPJMESA-N 0 0 373.412 3.955 20 5 FHBDRN C[C@H](Cc1ccc(Cl)cc1Cl)NC(=O)c1ccc([N+](=O)[O-])n1C ZINC000504947985 943929567 /nfs/dbraw/zinc/92/95/67/943929567.db2.gz HDILSQZJFWZPAT-SECBINFHSA-N 0 0 356.209 3.601 20 5 FHBDRN O=C(CCC1CCCCC1)N1CCN(Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000515509454 943941153 /nfs/dbraw/zinc/94/11/53/943941153.db2.gz XUNRQSGIXVPBMQ-UHFFFAOYSA-N 0 0 359.470 3.600 20 5 FHBDRN COC[C@H](C)Nc1ccccc1NC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000437601009 943942096 /nfs/dbraw/zinc/94/20/96/943942096.db2.gz JCISTZQTHSMURZ-LBPRGKRZSA-N 0 0 368.393 3.775 20 5 FHBDRN O=C(Nc1ccnn1Cc1ccccc1F)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000120272911 943946324 /nfs/dbraw/zinc/94/63/24/943946324.db2.gz TUBRRLWOPRKNFH-UHFFFAOYSA-N 0 0 374.759 3.884 20 5 FHBDRN CCCN(CC)c1ccc(-c2nc(-c3cccc([N+](=O)[O-])c3)no2)cn1 ZINC000504974733 943946728 /nfs/dbraw/zinc/94/67/28/943946728.db2.gz JSZLZTYFSHRMLU-UHFFFAOYSA-N 0 0 353.382 3.943 20 5 FHBDRN CC1CCC(N(C2CC2)S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000515514179 943947001 /nfs/dbraw/zinc/94/70/01/943947001.db2.gz QNOSTIWOOJXRIB-UHFFFAOYSA-N 0 0 372.874 3.980 20 5 FHBDRN COc1ccccc1O[C@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000517046724 943948669 /nfs/dbraw/zinc/94/86/69/943948669.db2.gz IFUFLDQKSXLHDI-INIZCTEOSA-N 0 0 370.405 3.595 20 5 FHBDRN COc1ccc(SCCc2nc(-c3cccc([N+](=O)[O-])c3)no2)cc1 ZINC000505002758 943954279 /nfs/dbraw/zinc/95/42/79/943954279.db2.gz LUKLUBMEJSBVLN-UHFFFAOYSA-N 0 0 357.391 3.988 20 5 FHBDRN CCN(CC)C(=O)c1ccc(-c2nc(-c3cccc([N+](=O)[O-])c3)no2)cc1 ZINC000504985166 943957814 /nfs/dbraw/zinc/95/78/14/943957814.db2.gz DKJJDGVUFCLYOY-UHFFFAOYSA-N 0 0 366.377 3.794 20 5 FHBDRN C[C@H](C(=O)N1CCC[C@@]2(C1)OCc1ccccc12)c1cccc([N+](=O)[O-])c1 ZINC000517065133 943965576 /nfs/dbraw/zinc/96/55/76/943965576.db2.gz IZVYLVGSTMVTDE-BTYIYWSLSA-N 0 0 366.417 3.746 20 5 FHBDRN COc1cc(CSc2nnc(C(F)(F)F)s2)ccc1[N+](=O)[O-] ZINC000436046092 943969449 /nfs/dbraw/zinc/96/94/49/943969449.db2.gz AJJPCWDBTCYXEN-UHFFFAOYSA-N 0 0 351.331 3.766 20 5 FHBDRN CCOc1cc(CN2CCC[C@H](OCC(F)(F)F)C2)ccc1[N+](=O)[O-] ZINC000515544687 943979972 /nfs/dbraw/zinc/97/99/72/943979972.db2.gz FGVNJTZKORWCRW-ZDUSSCGKSA-N 0 0 362.348 3.537 20 5 FHBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1CNc1ccn(CCC(F)(F)F)n1 ZINC000424570846 943986563 /nfs/dbraw/zinc/98/65/63/943986563.db2.gz QCQJATMYLVZEEZ-UHFFFAOYSA-N 0 0 372.347 3.565 20 5 FHBDRN COc1c(C)cc(CN(C)C(=O)CSc2ccc([N+](=O)[O-])cc2)cc1C ZINC000506084033 943996538 /nfs/dbraw/zinc/99/65/38/943996538.db2.gz WZVZDHCDAFBBLD-UHFFFAOYSA-N 0 0 374.462 3.971 20 5 FHBDRN COc1ccccc1SC[C@@H](C)CNC(=O)c1csc([N+](=O)[O-])c1 ZINC000505054025 943997255 /nfs/dbraw/zinc/99/72/55/943997255.db2.gz JYNUWWZNOOLZOU-NSHDSACASA-N 0 0 366.464 3.823 20 5 FHBDRN C[C@H](C(=O)NCc1cccc(OC(F)F)c1)c1cccc([N+](=O)[O-])c1 ZINC000566539446 944004723 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COc1c(C)cc(CN(C)[C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])cc1C ZINC000110293304 944030838 /nfs/dbraw/zinc/03/08/38/944030838.db2.gz OMOXLWSTHDUECW-OAHLLOKOSA-N 0 0 371.437 3.679 20 5 FHBDRN CC[C@@H](C)N(Cc1ccccc1)C(=O)COc1ccc(C=O)cc1[N+](=O)[O-] ZINC000053441135 944038767 /nfs/dbraw/zinc/03/87/67/944038767.db2.gz YIASYXOOSFNKOO-OAHLLOKOSA-N 0 0 370.405 3.613 20 5 FHBDRN Cc1cc(NC(=O)c2cc([N+](=O)[O-])cc(Br)c2C)sn1 ZINC000500066502 944038971 /nfs/dbraw/zinc/03/89/71/944038971.db2.gz NZLRVOXLFUIHRV-UHFFFAOYSA-N 0 0 356.201 3.683 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)NCC1(c2ccc(F)cc2)CC1 ZINC000500068645 944051944 /nfs/dbraw/zinc/05/19/44/944051944.db2.gz NEKVCLCYNNYUFO-UHFFFAOYSA-N 0 0 360.410 3.674 20 5 FHBDRN CCOc1cc(C(=O)NCc2ccc([C@@H]3C[C@@H]3C)o2)c([N+](=O)[O-])cc1OC ZINC000515620382 944054604 /nfs/dbraw/zinc/05/46/04/944054604.db2.gz SUOPGFSDPNOUJA-WCQYABFASA-N 0 0 374.393 3.649 20 5 FHBDRN COc1ccc(N(C)C(=O)c2cc3cc([N+](=O)[O-])ccc3o2)c(OC)c1 ZINC000505107238 944056141 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COc1cc(C(=O)N[C@@H]2CCCC[C@H]2OCCC(C)C)ccc1[N+](=O)[O-] ZINC000438041950 944307379 /nfs/dbraw/zinc/30/73/79/944307379.db2.gz OHJUGBHENYEMHK-NVXWUHKLSA-N 0 0 364.442 3.707 20 5 FHBDRN Cc1sc(S(=O)(=O)N2CCC[C@@H]2c2cccc(F)c2)cc1[N+](=O)[O-] ZINC000123251467 944311216 /nfs/dbraw/zinc/31/12/16/944311216.db2.gz IMFCXTKJCAQSPE-CYBMUJFWSA-N 0 0 370.427 3.630 20 5 FHBDRN O=C(NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N1C[C@@H]2CCC[C@@H]2C1 ZINC000426274786 944318644 /nfs/dbraw/zinc/31/86/44/944318644.db2.gz DFVXVOKKBOTXIK-TXEJJXNPSA-N 0 0 357.332 3.555 20 5 FHBDRN CC(C)c1ncc(CN(C)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)cn1 ZINC000440460276 944319838 /nfs/dbraw/zinc/31/98/38/944319838.db2.gz KBZRQMYAHFFUJA-UHFFFAOYSA-N 0 0 367.409 3.795 20 5 FHBDRN NC(=O)c1ccc(CSCc2ccc(OC(F)F)cc2)c([N+](=O)[O-])c1 ZINC000105633421 944320534 /nfs/dbraw/zinc/32/05/34/944320534.db2.gz LXPWSTGNRFTNSB-UHFFFAOYSA-N 0 0 368.361 3.729 20 5 FHBDRN CCn1c(C)nc([N+](=O)[O-])c1Nc1cnn(Cc2ccc(Cl)cc2)c1 ZINC000515904965 944321856 /nfs/dbraw/zinc/32/18/56/944321856.db2.gz CZDNOQVTRHFXPZ-UHFFFAOYSA-N 0 0 360.805 3.761 20 5 FHBDRN COc1cc(C[N@@H+]2CC3(CCC3)[C@H]2C2CCOCC2)c([N+](=O)[O-])cc1F ZINC000425554371 944326044 /nfs/dbraw/zinc/32/60/44/944326044.db2.gz ONTNGBZNYUROAD-GOSISDBHSA-N 0 0 364.417 3.524 20 5 FHBDRN O=C(N[C@H]1C[C@H](c2ccc(Cl)c(Cl)c2)C1)c1cc([N+](=O)[O-])c[nH]1 ZINC000500247211 944326836 /nfs/dbraw/zinc/32/68/36/944326836.db2.gz AZIRKBVYVGJNEH-MGCOHNPYSA-N 0 0 354.193 3.906 20 5 FHBDRN COc1ccccc1[C@@H](C)N(C)C(=O)COc1cc(C)ccc1[N+](=O)[O-] ZINC000053542502 944330412 /nfs/dbraw/zinc/33/04/12/944330412.db2.gz FFZVLZOSUFCOMR-CQSZACIVSA-N 0 0 358.394 3.510 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H](C)c1ccc(NC(N)=O)cc1 ZINC000515924836 944333159 /nfs/dbraw/zinc/33/31/59/944333159.db2.gz LKHPKHIYBUNFCN-LLVKDONJSA-N 0 0 371.397 3.531 20 5 FHBDRN Cc1sc(C(=O)N2CCC(OC3CCCCC3)CC2)cc1[N+](=O)[O-] ZINC000123289837 944333814 /nfs/dbraw/zinc/33/38/14/944333814.db2.gz SSPPBTWOXJCPLX-UHFFFAOYSA-N 0 0 352.456 3.919 20 5 FHBDRN O=C(CN1CCC[C@H]1/C=C/c1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000505825853 944336373 /nfs/dbraw/zinc/33/63/73/944336373.db2.gz OAOHPPOFEUBDTK-UJGDBWEASA-N 0 0 351.406 3.711 20 5 FHBDRN CNC(=O)c1ccc(NCCCSc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000053549927 944343881 /nfs/dbraw/zinc/34/38/81/944343881.db2.gz HTZLTLVFTTVVFM-UHFFFAOYSA-N 0 0 363.414 3.688 20 5 FHBDRN COc1ccccc1CCN(C)C(=O)c1c(C)cc(Cl)cc1[N+](=O)[O-] ZINC000439101880 944344795 /nfs/dbraw/zinc/34/47/95/944344795.db2.gz UVXURWPAAYVCQY-UHFFFAOYSA-N 0 0 362.813 3.880 20 5 FHBDRN COc1cc(CN(Cc2ccco2)C[C@H]2CCCO2)c([N+](=O)[O-])cc1F ZINC000184251088 944349350 /nfs/dbraw/zinc/34/93/50/944349350.db2.gz RYEPEROVROTDJM-OAHLLOKOSA-N 0 0 364.373 3.517 20 5 FHBDRN CNC(=O)c1cccc(CSCc2cc(OC)c(F)cc2[N+](=O)[O-])c1 ZINC000184048031 944355736 /nfs/dbraw/zinc/35/57/36/944355736.db2.gz AUMAVKMRWHDZQK-UHFFFAOYSA-N 0 0 364.398 3.536 20 5 FHBDRN Cc1cc2cn[nH]c2c(C(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000438130706 944358074 /nfs/dbraw/zinc/35/80/74/944358074.db2.gz MSOXHQGDFLMTST-UHFFFAOYSA-N 0 0 350.378 3.584 20 5 FHBDRN CC(C)(NC(=O)Nc1cnc2c(c1)CCCC2)c1ccc([N+](=O)[O-])cc1 ZINC000543886257 944364354 /nfs/dbraw/zinc/36/43/54/944364354.db2.gz LLEIQKMRLQMSOC-UHFFFAOYSA-N 0 0 354.410 3.925 20 5 FHBDRN C[C@H](Nc1c(Br)cncc1[N+](=O)[O-])c1c(F)cccc1F ZINC000500272960 944380187 /nfs/dbraw/zinc/38/01/87/944380187.db2.gz RZNOADDNUQYFTG-ZETCQYMHSA-N 0 0 358.142 3.626 20 5 FHBDRN CCO[C@H](CC)C(=O)Nc1ccc(OCc2ccccc2)cc1[N+](=O)[O-] ZINC000517535863 944382738 /nfs/dbraw/zinc/38/27/38/944382738.db2.gz OLXJNOCAYWZQDB-GOSISDBHSA-N 0 0 358.394 3.927 20 5 FHBDRN CO[C@H](c1ccc(F)cc1)[C@H](C)NC(=O)Nc1ccc([N+](=O)[O-])c(C)c1 ZINC000473768984 944386586 /nfs/dbraw/zinc/38/65/86/944386586.db2.gz ZPYJHFZKTLQZQC-SJCJKPOMSA-N 0 0 361.373 3.940 20 5 FHBDRN O=C1[C@H](Sc2c(F)cc(F)cc2F)CCN1c1cccc([N+](=O)[O-])c1 ZINC000517554778 944387286 /nfs/dbraw/zinc/38/72/86/944387286.db2.gz IYXOVQGPMNUIKE-CQSZACIVSA-N 0 0 368.336 3.910 20 5 FHBDRN CC1CCC(OC2CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)CC1 ZINC000517556671 944389649 /nfs/dbraw/zinc/38/96/49/944389649.db2.gz UZLLBGDPDXWRPH-UHFFFAOYSA-N 0 0 364.417 3.934 20 5 FHBDRN CCc1nnc([C@H](C)Sc2nnc(-c3ccc([N+](=O)[O-])cc3)n2CC)o1 ZINC000123670433 944402224 /nfs/dbraw/zinc/40/22/24/944402224.db2.gz OIQRDUFECHCXHA-JTQLQIEISA-N 0 0 374.426 3.672 20 5 FHBDRN O=C(CC[S@](=O)c1cc(Cl)ccc1F)Nc1ccccc1[N+](=O)[O-] ZINC000505842051 944402995 /nfs/dbraw/zinc/40/29/95/944402995.db2.gz BYZKGFDDSJKMOC-DEOSSOPVSA-N 0 0 370.789 3.524 20 5 FHBDRN O=C(CC[S@@](=O)c1cc(Cl)ccc1F)Nc1ccccc1[N+](=O)[O-] ZINC000505842052 944403043 /nfs/dbraw/zinc/40/30/43/944403043.db2.gz BYZKGFDDSJKMOC-XMMPIXPASA-N 0 0 370.789 3.524 20 5 FHBDRN C[C@H](C1CC1)N(C)C(=O)c1ccc(N2C[C@H](C)C[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000500278371 944404226 /nfs/dbraw/zinc/40/42/26/944404226.db2.gz HEMZWWXROYEVJF-RBSFLKMASA-N 0 0 359.470 3.948 20 5 FHBDRN O=C(N[C@H]1CCC[C@@H]1c1ccccc1)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000518454906 944407778 /nfs/dbraw/zinc/40/77/78/944407778.db2.gz ARZBVSIKCASTOC-ZBFHGGJFSA-N 0 0 350.378 3.537 20 5 FHBDRN C[C@H](c1ccccc1Cl)N(C)S(=O)(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000123739915 944408728 /nfs/dbraw/zinc/40/87/28/944408728.db2.gz KKAPSODQHQCEOO-SNVBAGLBSA-N 0 0 372.805 3.769 20 5 FHBDRN COc1ccc(CSCC(=O)Nc2ccc(F)cc2C)cc1[N+](=O)[O-] ZINC000105970571 944413062 /nfs/dbraw/zinc/41/30/62/944413062.db2.gz PQSOADJUTRHCTO-UHFFFAOYSA-N 0 0 364.398 3.923 20 5 FHBDRN O=C(NCCOc1ccc([N+](=O)[O-])cc1)C1(c2ccc(F)cc2)CCCC1 ZINC000517592870 944424682 /nfs/dbraw/zinc/42/46/82/944424682.db2.gz OWJCKIZOISCZJM-UHFFFAOYSA-N 0 0 372.396 3.741 20 5 FHBDRN CO[C@@H](C)C(=O)Nc1cccc(NC(=O)Nc2ccc([N+](=O)[O-])c(C)c2)c1 ZINC000473774380 944427135 /nfs/dbraw/zinc/42/71/35/944427135.db2.gz GMDCTDZOPYPEFG-LBPRGKRZSA-N 0 0 372.381 3.521 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)C[C@H]1CCCO1 ZINC000506192768 944436807 /nfs/dbraw/zinc/43/68/07/944436807.db2.gz POKZRNWJIDSHKV-TZMCWYRMSA-N 0 0 352.456 3.784 20 5 FHBDRN CCOCCC1(CNc2c(Br)cncc2[N+](=O)[O-])CCCC1 ZINC000500293382 944437340 /nfs/dbraw/zinc/43/73/40/944437340.db2.gz RSXDHMUNRIXWBL-UHFFFAOYSA-N 0 0 372.263 3.573 20 5 FHBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CCc2ccsc2C1 ZINC000123851314 944444395 /nfs/dbraw/zinc/44/43/95/944444395.db2.gz BWXBKSVCNSDLMK-UHFFFAOYSA-N 0 0 367.224 3.617 20 5 FHBDRN CC(C)(CCc1ccccc1)NC(=O)NCCOc1ccc([N+](=O)[O-])cc1 ZINC000517617046 944446131 /nfs/dbraw/zinc/44/61/31/944446131.db2.gz IKDOOPXBYOVSOI-UHFFFAOYSA-N 0 0 371.437 3.684 20 5 FHBDRN Cc1cc(S(=O)(=O)N2CC[C@@H](C)C[C@H]2c2ccco2)ccc1[N+](=O)[O-] ZINC000439234529 944447999 /nfs/dbraw/zinc/44/79/99/944447999.db2.gz IABLBEVLJGZCQT-WBMJQRKESA-N 0 0 364.423 3.658 20 5 FHBDRN NC(=S)/C(=C\c1ccc(Cl)c([N+](=O)[O-])c1)c1nc2ccccc2[nH]1 ZINC000017476112 944450521 /nfs/dbraw/zinc/45/05/21/944450521.db2.gz ALZUQWLJGCWPKO-JXMROGBWSA-N 0 0 358.810 3.951 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCCc1cc(F)cc(F)c1 ZINC000500300904 944452341 /nfs/dbraw/zinc/45/23/41/944452341.db2.gz FHGAGWKHSPWWDQ-NSHDSACASA-N 0 0 366.389 3.713 20 5 FHBDRN COc1cc(CNCc2cscc2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000425970841 944453894 /nfs/dbraw/zinc/45/38/94/944453894.db2.gz JXUYFVUCXSXCSD-UHFFFAOYSA-N 0 0 372.393 3.907 20 5 FHBDRN Nc1ccc(-c2noc(-c3cnc4c(F)cccc4c3)n2)cc1[N+](=O)[O-] ZINC000426324658 944457498 /nfs/dbraw/zinc/45/74/98/944457498.db2.gz RGWAKSJERATLLO-UHFFFAOYSA-N 0 0 351.297 3.581 20 5 FHBDRN COc1ccc(CNC(=O)Nc2ccc(-c3ccc[nH]3)cc2)cc1[N+](=O)[O-] ZINC000544254053 944461053 /nfs/dbraw/zinc/46/10/53/944461053.db2.gz JUWKJESSNXSIQP-UHFFFAOYSA-N 0 0 366.377 3.920 20 5 FHBDRN CN(CCC1CCCCC1)C(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000506200769 944467789 /nfs/dbraw/zinc/46/77/89/944467789.db2.gz PWMSBASVHJRYOO-UHFFFAOYSA-N 0 0 356.426 3.823 20 5 FHBDRN C[C@H]1CCCC[C@H]1NC(=O)COc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000518522488 944468839 /nfs/dbraw/zinc/46/88/39/944468839.db2.gz ASZANGQCAJBBNY-GXFFZTMASA-N 0 0 360.332 3.687 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)Nc1nccc2sccc21 ZINC000162679641 944469733 /nfs/dbraw/zinc/46/97/33/944469733.db2.gz LJRVFDFLCYONHD-UHFFFAOYSA-N 0 0 352.375 3.867 20 5 FHBDRN Cc1sc(C(=O)Nc2cccc(-c3n[nH]c(C4CC4)n3)c2)cc1[N+](=O)[O-] ZINC000110405171 944474495 /nfs/dbraw/zinc/47/44/95/944474495.db2.gz YWYNMYLYNVPWFY-UHFFFAOYSA-N 0 0 369.406 3.880 20 5 FHBDRN Cc1ccc([C@@H](C)N(C)C(=O)C(=O)Nc2cccc([N+](=O)[O-])c2C)c(C)c1 ZINC000516084392 944475421 /nfs/dbraw/zinc/47/54/21/944475421.db2.gz ZVXWZDDQQPVHCG-OAHLLOKOSA-N 0 0 369.421 3.678 20 5 FHBDRN Cc1cc(NC(=O)N2CC[C@H](COc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000473788142 944484550 /nfs/dbraw/zinc/48/45/50/944484550.db2.gz OYKQVNAVZHKDEX-HNNXBMFYSA-N 0 0 355.394 3.836 20 5 FHBDRN Cc1cccc(CNC(=O)COc2ccc([N+](=O)[O-])cc2C(F)(F)F)c1 ZINC000517659848 944485056 /nfs/dbraw/zinc/48/50/56/944485056.db2.gz FYPXQKHBIKOXPO-UHFFFAOYSA-N 0 0 368.311 3.617 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]([C@H]2CCCO2)C1 ZINC000894710135 944485293 /nfs/dbraw/zinc/48/52/93/944485293.db2.gz HLLXOCZSYVHPQU-CZUORRHYSA-N 0 0 364.467 3.738 20 5 FHBDRN CC(C)(C)c1ccc(Cn2nccc2NC(=O)c2ccc([N+](=O)[O-])o2)cc1 ZINC000072753987 944488362 /nfs/dbraw/zinc/48/83/62/944488362.db2.gz NTVBQLNWPRLVCJ-UHFFFAOYSA-N 0 0 368.393 3.982 20 5 FHBDRN Cc1cc(NC(=O)N2CCC(CCCn3ccnc3)CC2)ccc1[N+](=O)[O-] ZINC000473790222 944489734 /nfs/dbraw/zinc/48/97/34/944489734.db2.gz ULKDDMQJHQAGSM-UHFFFAOYSA-N 0 0 371.441 3.824 20 5 FHBDRN Cc1cc(C(=O)NCc2ccc(N3CCCCCC3)nc2)ccc1[N+](=O)[O-] ZINC000053632077 944491356 /nfs/dbraw/zinc/49/13/56/944491356.db2.gz IKWIKVUJAFIHFP-UHFFFAOYSA-N 0 0 368.437 3.609 20 5 FHBDRN O=C1CCCc2cc(OCc3cc([N+](=O)[O-])cc4c3OCOC4)ccc21 ZINC000120711818 944492846 /nfs/dbraw/zinc/49/28/46/944492846.db2.gz MFCHLFHCMAIMBY-UHFFFAOYSA-N 0 0 355.346 3.559 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)NC[C@@H]2C[C@H]2c2ccccc2)cc1OC ZINC000110447759 944493223 /nfs/dbraw/zinc/49/32/23/944493223.db2.gz CLFYLZPBTIUHBJ-GJZGRUSLSA-N 0 0 370.405 3.536 20 5 FHBDRN Cc1sc(NC(=O)COc2c(Cl)cncc2[N+](=O)[O-])c(C)c1C ZINC000506537472 944495412 /nfs/dbraw/zinc/49/54/12/944495412.db2.gz CKUNSAYIPCLIMU-UHFFFAOYSA-N 0 0 355.803 3.647 20 5 FHBDRN CCOC(=O)[C@H](Cc1ccccc1)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000438315621 944498420 /nfs/dbraw/zinc/49/84/20/944498420.db2.gz TZBSNMQVCZFDOT-QAPCUYQASA-N 0 0 356.422 3.728 20 5 FHBDRN Cc1nn(C(C)C)cc1C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000518560182 944501292 /nfs/dbraw/zinc/50/12/92/944501292.db2.gz SVGHHXQWYOTISM-UHFFFAOYSA-N 0 0 356.304 3.952 20 5 FHBDRN CCOc1cc(C(=O)NC[C@@H]2C[C@H]2c2ccccc2)c([N+](=O)[O-])cc1OC ZINC000110451948 944501655 /nfs/dbraw/zinc/50/16/55/944501655.db2.gz GCOLRIIFMYPSBE-GJZGRUSLSA-N 0 0 370.405 3.536 20 5 FHBDRN Cc1ncsc1NC(=O)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12 ZINC000519570123 944501935 /nfs/dbraw/zinc/50/19/35/944501935.db2.gz CUWMDOLEPUKTES-UHFFFAOYSA-N 0 0 371.368 3.977 20 5 FHBDRN C[C@H](C(=O)N1CC[C@]2(C1)CCc1ccccc1O2)c1cccc([N+](=O)[O-])c1 ZINC000519571301 944503560 /nfs/dbraw/zinc/50/35/60/944503560.db2.gz LKPZBRVSLBNBCD-BTYIYWSLSA-N 0 0 366.417 3.695 20 5 FHBDRN COc1cccc(CCC(=O)N2c3ccc([N+](=O)[O-])cc3C[C@H]2C)c1F ZINC000516109487 944510877 /nfs/dbraw/zinc/51/08/77/944510877.db2.gz JGCQPRUBKJDRKH-GFCCVEGCSA-N 0 0 358.369 3.653 20 5 FHBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)Cc1cccc([N+](=O)[O-])c1C ZINC000123894855 944511143 /nfs/dbraw/zinc/51/11/43/944511143.db2.gz FRPOZMQUPDOFMX-UHFFFAOYSA-N 0 0 363.757 3.954 20 5 FHBDRN Cc1cc(OCC(=O)NCC2(c3ccccc3)CC2)c(Cl)cc1[N+](=O)[O-] ZINC000506537567 944512953 /nfs/dbraw/zinc/51/29/53/944512953.db2.gz KQYOLSUILIRPKT-UHFFFAOYSA-N 0 0 374.824 3.783 20 5 FHBDRN C[C@H](NC(=O)COc1c(Cl)cncc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000506539091 944514567 /nfs/dbraw/zinc/51/45/67/944514567.db2.gz IVMOKSKVIFFXCR-VIFPVBQESA-N 0 0 370.192 3.553 20 5 FHBDRN CCC(=O)Nc1cccc(CNC(=O)C(C)(C)c2ccccc2[N+](=O)[O-])c1 ZINC000584566700 944516546 /nfs/dbraw/zinc/51/65/46/944516546.db2.gz CVTNHHBXZYMZOQ-UHFFFAOYSA-N 0 0 369.421 3.537 20 5 FHBDRN COC[C@H](OC(=O)c1c(C)cc(Cl)cc1[N+](=O)[O-])c1nccs1 ZINC000278835231 944519343 /nfs/dbraw/zinc/51/93/43/944519343.db2.gz VMACWRAVWXHUPO-NSHDSACASA-N 0 0 356.787 3.558 20 5 FHBDRN CNc1ccc(C(=O)Nc2cc(-c3nc(C)no3)ccc2C)cc1[N+](=O)[O-] ZINC000516133229 944521612 /nfs/dbraw/zinc/52/16/12/944521612.db2.gz JJNQDEQHHBNVPR-UHFFFAOYSA-N 0 0 367.365 3.556 20 5 FHBDRN C[C@H]1CO[C@H](c2ccccc2Cl)CN1C(=O)c1ccc([N+](=O)[O-])cc1 ZINC000110518291 944522339 /nfs/dbraw/zinc/52/23/39/944522339.db2.gz YIIHJOXCSMLLGV-SJCJKPOMSA-N 0 0 360.797 3.850 20 5 FHBDRN COc1ccc(OC)c([C@H](C)NC(=O)c2c(C)c(F)ccc2[N+](=O)[O-])c1 ZINC000843756904 944524472 /nfs/dbraw/zinc/52/44/72/944524472.db2.gz FKLCMSCJQWPBPG-NSHDSACASA-N 0 0 362.357 3.551 20 5 FHBDRN CC(C)c1ccc(CNC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)cc1 ZINC000517705686 944527043 /nfs/dbraw/zinc/52/70/43/944527043.db2.gz TWUFJGAWDQRQPD-UHFFFAOYSA-N 0 0 365.389 3.902 20 5 FHBDRN C[C@@H]1CO[C@@H](c2ccccc2Cl)CN1C(=O)c1cccc([N+](=O)[O-])c1 ZINC000110515615 944532827 /nfs/dbraw/zinc/53/28/27/944532827.db2.gz YOQPMZBRLMALFA-SJKOYZFVSA-N 0 0 360.797 3.850 20 5 FHBDRN CCc1nn(C)c(N2CCC(c3nc4ccccc4s3)CC2)c1[N+](=O)[O-] ZINC000092826997 944533610 /nfs/dbraw/zinc/53/36/10/944533610.db2.gz GRTNPZDXHUOKOG-UHFFFAOYSA-N 0 0 371.466 3.884 20 5 FHBDRN COc1ccc(CN2CC(C)(C)O[C@](C)(C(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000550238404 944533827 /nfs/dbraw/zinc/53/38/27/944533827.db2.gz FMIFGEUTIJFPFJ-HNNXBMFYSA-N 0 0 362.348 3.535 20 5 FHBDRN C[C@@H](C(=O)N1C[C@@H]2CCC[C@]2(C(F)(F)F)C1)c1cccc([N+](=O)[O-])c1 ZINC000894380097 944535087 /nfs/dbraw/zinc/53/50/87/944535087.db2.gz NMBQDHKSMGIMNE-FFSVYQOJSA-N 0 0 356.344 3.889 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])N1CCC[C@H]1CCc1ccccc1 ZINC000518615430 944546108 /nfs/dbraw/zinc/54/61/08/944546108.db2.gz XGCNBOXYWVUKTH-SFHVURJKSA-N 0 0 368.433 3.988 20 5 FHBDRN Cc1cnccc1OC1CCN(Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000518623004 944552560 /nfs/dbraw/zinc/55/25/60/944552560.db2.gz NTUMGVMGKXQHFH-UHFFFAOYSA-N 0 0 361.829 3.995 20 5 FHBDRN CC(C)n1nc2c(c1NC(=O)N[C@@H](C)c1ccccc1[N+](=O)[O-])CCC2 ZINC000473813790 944561357 /nfs/dbraw/zinc/56/13/57/944561357.db2.gz VYNWVHDVBNDTIW-LBPRGKRZSA-N 0 0 357.414 3.744 20 5 FHBDRN CSCc1cccc(CNC(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)c1 ZINC000438403338 944565066 /nfs/dbraw/zinc/56/50/66/944565066.db2.gz YESMKYCXOGIYND-UHFFFAOYSA-N 0 0 355.419 3.869 20 5 FHBDRN Cc1nn(C)c(C(=O)Nc2ccc3oc4ccccc4c3c2)c1[N+](=O)[O-] ZINC000517754623 944566918 /nfs/dbraw/zinc/56/69/18/944566918.db2.gz MACMXRONBVAVAY-UHFFFAOYSA-N 0 0 350.334 3.788 20 5 FHBDRN C[C@H](NC(=O)COc1c(Cl)cncc1[N+](=O)[O-])c1ccccc1Cl ZINC000506561280 944572516 /nfs/dbraw/zinc/57/25/16/944572516.db2.gz LWUJNMVOFQQFKK-VIFPVBQESA-N 0 0 370.192 3.553 20 5 FHBDRN Cc1nc2cc(CNc3ccc([N+](=O)[O-])c4c3CCN(C)C4)ccc2o1 ZINC001167759576 944572976 /nfs/dbraw/zinc/57/29/76/944572976.db2.gz CJDKEMDUSCTUHI-UHFFFAOYSA-N 0 0 352.394 3.644 20 5 FHBDRN CCCc1ccc([C@H](C)N(CC(N)=O)Cc2c(F)cccc2[N+](=O)[O-])cc1 ZINC000505872761 944577302 /nfs/dbraw/zinc/57/73/02/944577302.db2.gz QKISSMDGUHXPSK-AWEZNQCLSA-N 0 0 373.428 3.735 20 5 FHBDRN CCOc1ccc(OC(C)(C)C(=O)NCCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000516219574 944582282 /nfs/dbraw/zinc/58/22/82/944582282.db2.gz SONOKDUWUVHOIQ-UHFFFAOYSA-N 0 0 372.421 3.510 20 5 FHBDRN Cc1c(C(=O)N2CC=C(C(C)(C)C)CC2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000759858694 944593843 /nfs/dbraw/zinc/59/38/43/944593843.db2.gz BETRRXZMRQCNNI-UHFFFAOYSA-N 0 0 361.398 3.938 20 5 FHBDRN CC[C@H](C)Oc1cc(-c2noc(-c3cccc(OC)c3[N+](=O)[O-])n2)ccn1 ZINC000516214210 944595980 /nfs/dbraw/zinc/59/59/80/944595980.db2.gz ZFWPOAUSSFNZOR-NSHDSACASA-N 0 0 370.365 3.893 20 5 FHBDRN COc1cc(Cl)c(NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)cc1C ZINC000426008651 944597552 /nfs/dbraw/zinc/59/75/52/944597552.db2.gz CHQNVWVKAPTWJD-UHFFFAOYSA-N 0 0 360.757 3.694 20 5 FHBDRN CC(C)c1ccc(C(=O)NCc2ccn(-c3ccccc3)n2)cc1[N+](=O)[O-] ZINC000439409074 944599483 /nfs/dbraw/zinc/59/94/83/944599483.db2.gz HRKMGKXIRUZVEV-UHFFFAOYSA-N 0 0 364.405 3.834 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N(C)[C@H](C)c1c(F)cccc1F ZINC000518691554 944607467 /nfs/dbraw/zinc/60/74/67/944607467.db2.gz KYWDRALZLKLFID-LLVKDONJSA-N 0 0 370.377 3.563 20 5 FHBDRN CC[C@H](NC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)c1ccc(C)cc1 ZINC000506576018 944611490 /nfs/dbraw/zinc/61/14/90/944611490.db2.gz CAIPUPPWMIMRKY-SFHVURJKSA-N 0 0 364.405 3.970 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N[C@@H](C)c1cccc(C)c1C ZINC000543176174 944612284 /nfs/dbraw/zinc/61/22/84/944612284.db2.gz UQMNLGSHQBMYNQ-AWEZNQCLSA-N 0 0 357.410 3.781 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N(C)[C@@H]2CCC[C@@H](C)C2)cc1OC ZINC000031998950 944626550 /nfs/dbraw/zinc/62/65/50/944626550.db2.gz VAEUHSDTJTXKNU-CHWSQXEVSA-N 0 0 350.415 3.653 20 5 FHBDRN C[C@H](NC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1)[C@@H]1Oc2ccccc2[C@H]1C ZINC000426673936 944633143 /nfs/dbraw/zinc/63/31/43/944633143.db2.gz IJZWFHKJEQDURT-BIENJYKASA-N 0 0 368.433 3.942 20 5 FHBDRN CC(C)N(C)c1ccccc1CNC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000438457710 944635349 /nfs/dbraw/zinc/63/53/49/944635349.db2.gz GQEVDKBBLYSZPZ-UHFFFAOYSA-N 0 0 366.421 3.851 20 5 FHBDRN COc1ccc(C)c2c1N(C(=O)CCNc1ccccc1[N+](=O)[O-])CCC2 ZINC000110609731 944650967 /nfs/dbraw/zinc/65/09/67/944650967.db2.gz PWKIWGLZTNNBMV-UHFFFAOYSA-N 0 0 369.421 3.693 20 5 FHBDRN COc1c(C)[nH]cc(CN(C)c2c(Cl)c(Cl)ccc2[N+](=O)[O-])c1=O ZINC000894807785 944650911 /nfs/dbraw/zinc/65/09/11/944650911.db2.gz XRXKRONKKOUHKO-UHFFFAOYSA-N 0 0 372.208 3.543 20 5 FHBDRN CCOC(=O)c1ccc(NC(=O)c2cc(SC)ccc2[N+](=O)[O-])cc1 ZINC000018228613 944651263 /nfs/dbraw/zinc/65/12/63/944651263.db2.gz ISLUTQBDYITKOR-UHFFFAOYSA-N 0 0 360.391 3.746 20 5 FHBDRN COC(=O)c1cc(F)cc(NCc2c(F)cc([N+](=O)[O-])cc2F)c1F ZINC000506247621 944668751 /nfs/dbraw/zinc/66/87/51/944668751.db2.gz KUCNJKRGSSJUEC-UHFFFAOYSA-N 0 0 358.247 3.550 20 5 FHBDRN CC[C@H]1CCC[C@@H]1NC(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000426029466 944671946 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CC(C)[C@@H](CCO)NC(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000438493351 944687217 /nfs/dbraw/zinc/68/72/17/944687217.db2.gz VFPRMICMWIDJQM-GOSISDBHSA-N 0 0 373.409 3.916 20 5 FHBDRN C[C@H](OC(=O)CSC(C)(C)C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000017719004 944689072 /nfs/dbraw/zinc/68/90/72/944689072.db2.gz FPQPNXJWQRDJOM-JTQLQIEISA-N 0 0 365.411 3.781 20 5 FHBDRN O=C(N=c1cc(C2CCCCC2)[nH][nH]1)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000426679185 944695124 /nfs/dbraw/zinc/69/51/24/944695124.db2.gz UOFUTYQORFMMPO-UHFFFAOYSA-N 0 0 354.366 3.786 20 5 FHBDRN Cc1c(C(=O)[O-])cnn1C1CC[NH+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC000516304074 944705313 /nfs/dbraw/zinc/70/53/13/944705313.db2.gz QXUBZLDIJARZMC-ZDUSSCGKSA-N 0 0 372.425 3.504 20 5 FHBDRN C[C@H](NCc1ccc(OCC(F)(F)F)nc1)c1ccccc1[N+](=O)[O-] ZINC000516304445 944706202 /nfs/dbraw/zinc/70/62/02/944706202.db2.gz DDBBAOUIUZTRGL-NSHDSACASA-N 0 0 355.316 3.782 20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])NC[C@@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000438515588 944708012 /nfs/dbraw/zinc/70/80/12/944708012.db2.gz IBZSLWZRDFWELU-CHWSQXEVSA-N 0 0 373.375 3.882 20 5 FHBDRN CN(C[C@@H]1OCCc2ccccc21)C(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000506259867 944710112 /nfs/dbraw/zinc/71/01/12/944710112.db2.gz OGENNQGURZYQCY-KRWDZBQOSA-N 0 0 360.797 3.634 20 5 FHBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H](O)C(C)(C)C1 ZINC000438517473 944711131 /nfs/dbraw/zinc/71/11/31/944711131.db2.gz QEVOAPBYDHDYNX-MRXNPFEDSA-N 0 0 366.483 3.720 20 5 FHBDRN O=[N+]([O-])c1ccc(NCc2ccnc(OC3CCOCC3)c2)c(Cl)c1 ZINC000500387340 944712795 /nfs/dbraw/zinc/71/27/95/944712795.db2.gz FZZQUTMUIHAYCX-UHFFFAOYSA-N 0 0 363.801 3.813 20 5 FHBDRN O=C(NC1CCC2(CCOCC2)CC1)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000438520474 944724153 /nfs/dbraw/zinc/72/41/53/944724153.db2.gz WGOTYVGXZHJOSP-UHFFFAOYSA-N 0 0 358.394 3.810 20 5 FHBDRN Nc1nc(Nc2ccc(Oc3ccnc4ccccc43)cc2)ncc1[N+](=O)[O-] ZINC000500391060 944730543 /nfs/dbraw/zinc/73/05/43/944730543.db2.gz SJUQBOZUKNELSF-UHFFFAOYSA-N 0 0 374.360 3.881 20 5 FHBDRN Cc1ccc(C[NH2+]C[C@@H](Cc2ccc(Cl)cc2)C(=O)[O-])cc1[N+](=O)[O-] ZINC000426712421 944734786 /nfs/dbraw/zinc/73/47/86/944734786.db2.gz WNQLWXGYVCFJJU-OAHLLOKOSA-N 0 0 362.813 3.590 20 5 FHBDRN CCOc1ccc(OC)cc1NC(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000517857844 944737575 /nfs/dbraw/zinc/73/75/75/944737575.db2.gz NLRMRQUCAMBCQJ-UHFFFAOYSA-N 0 0 373.409 3.833 20 5 FHBDRN CC[C@H](C)[C@@H](C)N(C1CC1)S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-] ZINC000517869615 944745961 /nfs/dbraw/zinc/74/59/61/944745961.db2.gz KEUSBFCZDBGPSL-SMDDNHRTSA-N 0 0 354.472 3.799 20 5 FHBDRN COc1ccc([C@@H](CCC(=O)[O-])[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000426736768 944748449 /nfs/dbraw/zinc/74/84/49/944748449.db2.gz ZAPBLERTDDJEPT-QGZVFWFLSA-N 0 0 358.394 3.608 20 5 FHBDRN C[C@@H](c1cccc(NC(=O)Nc2ccc([N+](=O)[O-])cc2)c1)N1CCOCC1 ZINC000517865915 944763969 /nfs/dbraw/zinc/76/39/69/944763969.db2.gz WEAKGIALYAWTLM-AWEZNQCLSA-N 0 0 370.409 3.632 20 5 FHBDRN C[C@]1(C(=O)[O-])CCCC[C@H]1[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000426749826 944769226 /nfs/dbraw/zinc/76/92/26/944769226.db2.gz IUDQMBONDIBWIW-MJGOQNOKSA-N 0 0 358.394 3.978 20 5 FHBDRN Cc1cc(C)cc([C@H]2CCN(C(=O)NCc3ccccc3[N+](=O)[O-])C2)c1 ZINC000543193951 944773582 /nfs/dbraw/zinc/77/35/82/944773582.db2.gz VVDGTLPMWPVFRZ-KRWDZBQOSA-N 0 0 353.422 3.911 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)c1c[nH]nc1-c1ccc(Cl)cc1 ZINC000054167939 944777494 /nfs/dbraw/zinc/77/74/94/944777494.db2.gz ILCHUSURQFBGBZ-UHFFFAOYSA-N 0 0 370.796 3.611 20 5 FHBDRN O=c1cc(Nc2ccc(-c3ccc([N+](=O)[O-])cc3)cc2)n(C2CC2)c(=O)[nH]1 ZINC001167762476 944783514 /nfs/dbraw/zinc/78/35/14/944783514.db2.gz GUJANBQRFPAMCB-UHFFFAOYSA-N 0 0 364.361 3.603 20 5 FHBDRN COc1cc(-c2noc(-c3ccc(NC4CC4)c([N+](=O)[O-])c3)n2)ccc1O ZINC000436898778 944788760 /nfs/dbraw/zinc/78/87/60/944788760.db2.gz ZVDZQANOCFCKSW-UHFFFAOYSA-N 0 0 368.349 3.600 20 5 FHBDRN O=C(NCCOc1ccc([N+](=O)[O-])cc1)c1cccc2c1CCCCC2 ZINC001125945944 944789729 /nfs/dbraw/zinc/78/97/29/944789729.db2.gz REUYPTYHEFIAQL-UHFFFAOYSA-N 0 0 354.406 3.673 20 5 FHBDRN O=C([O-])[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1ccc2ccccc2c1 ZINC000426774019 944790970 /nfs/dbraw/zinc/79/09/70/944790970.db2.gz SEOFIOHIMYUAFX-IBGZPJMESA-N 0 0 350.374 3.534 20 5 FHBDRN CC(C)(c1nc(-c2ccc([N+](=O)[O-])s2)no1)c1ccc2c(c1)OCO2 ZINC000426440610 944798242 /nfs/dbraw/zinc/79/82/42/944798242.db2.gz RNUQJNPTODXENP-UHFFFAOYSA-N 0 0 359.363 3.761 20 5 FHBDRN O=[N+]([O-])c1cc2c(ncnc2N2CCSC3(CCCCC3)C2)s1 ZINC000408102264 944803114 /nfs/dbraw/zinc/80/31/14/944803114.db2.gz CVIKXUPBJAXKEM-UHFFFAOYSA-N 0 0 350.469 3.856 20 5 FHBDRN COc1cccc(C[C@@H]([NH2+]Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C(=O)[O-])c1 ZINC000426805860 944806333 /nfs/dbraw/zinc/80/63/33/944806333.db2.gz GMOCADIIZVQGLP-GOSISDBHSA-N 0 0 372.421 3.512 20 5 FHBDRN CN(CC(F)(F)F)C(=O)COc1ccc(-c2ccccc2)cc1[N+](=O)[O-] ZINC000517912427 944814104 /nfs/dbraw/zinc/81/41/04/944814104.db2.gz ICKPKEGFCAYTAN-UHFFFAOYSA-N 0 0 368.311 3.661 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)NCCCc1cccc(C(F)(F)F)c1 ZINC000506982557 944828451 /nfs/dbraw/zinc/82/84/51/944828451.db2.gz NCNCUSWVGFQNSN-UHFFFAOYSA-N 0 0 366.339 3.905 20 5 FHBDRN CCOC(=O)CCc1ccc(NCc2c(F)cc([N+](=O)[O-])cc2F)cc1 ZINC000506296155 944830850 /nfs/dbraw/zinc/83/08/50/944830850.db2.gz XCIVYFBHDMIBOM-UHFFFAOYSA-N 0 0 364.348 3.981 20 5 FHBDRN CC(C)(c1nc(Cc2ccc3c(c2)OCO3)no1)c1ccccc1[N+](=O)[O-] ZINC000426448224 944835075 /nfs/dbraw/zinc/83/50/75/944835075.db2.gz DVPFFDYTTOMBMP-UHFFFAOYSA-N 0 0 367.361 3.623 20 5 FHBDRN O=[N+]([O-])c1ccc(NCc2ccc3c(c2)OCCO3)c(OC(F)F)c1 ZINC000518846060 944839290 /nfs/dbraw/zinc/83/92/90/944839290.db2.gz BZPHQYLTGOSYEF-UHFFFAOYSA-N 0 0 352.293 3.580 20 5 FHBDRN CC(C)(C)[C@@H]1CCC[C@@H]1NC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000412829317 944839433 /nfs/dbraw/zinc/83/94/33/944839433.db2.gz UGYMAHYPDCGZDX-ZBFHGGJFSA-N 0 0 357.410 3.793 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)Nc2cccc3c2OCCC3=O)cc1[N+](=O)[O-] ZINC000506990244 944840330 /nfs/dbraw/zinc/84/03/30/944840330.db2.gz XDOLRYVPTJEPBZ-LBPRGKRZSA-N 0 0 369.377 3.751 20 5 FHBDRN Cc1cc(C(=O)NC(C)C)ccc1NCc1c(F)cc([N+](=O)[O-])cc1F ZINC000506294856 944846858 /nfs/dbraw/zinc/84/68/58/944846858.db2.gz LOCNHWIMROFVKR-UHFFFAOYSA-N 0 0 363.364 3.932 20 5 FHBDRN COc1ccc(C[NH2+][C@@H](CC(=O)[O-])c2cccc(Cl)c2)cc1[N+](=O)[O-] ZINC000426825026 944848734 /nfs/dbraw/zinc/84/87/34/944848734.db2.gz KKJBVGAHZRHDDX-AWEZNQCLSA-N 0 0 364.785 3.562 20 5 FHBDRN Cc1ccc(NC(=O)NCCCCCC(=O)OC(C)(C)C)cc1[N+](=O)[O-] ZINC000506300478 944855439 /nfs/dbraw/zinc/85/54/39/944855439.db2.gz JQAVBNAYWVMEHX-UHFFFAOYSA-N 0 0 365.430 3.927 20 5 FHBDRN CC(C)(O)COc1ccc(NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000426454806 944858233 /nfs/dbraw/zinc/85/82/33/944858233.db2.gz AGTXFENCXMRMMO-UHFFFAOYSA-N 0 0 372.421 3.661 20 5 FHBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NC1(Cc2ccccc2)CC1 ZINC000505910598 944859880 /nfs/dbraw/zinc/85/98/80/944859880.db2.gz AIJWBHXAQBKEEQ-CYBMUJFWSA-N 0 0 374.824 3.907 20 5 FHBDRN CCCc1n[nH]c(C(=O)N[C@@H](C)c2cccc(OC(C)C)c2)c1[N+](=O)[O-] ZINC000518865393 944862202 /nfs/dbraw/zinc/86/22/02/944862202.db2.gz BSGBROORTOUMSS-LBPRGKRZSA-N 0 0 360.414 3.549 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1ccc2c(c1)NC(=O)C2(C)C ZINC000566803610 944868258 /nfs/dbraw/zinc/86/82/58/944868258.db2.gz NGRLHOBQXMXFOS-UHFFFAOYSA-N 0 0 353.378 3.694 20 5 FHBDRN CC(C)[C@@H](CC(=O)[O-])[NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000426832376 944871077 /nfs/dbraw/zinc/87/10/77/944871077.db2.gz JDEHZJARMZKRQE-QGZVFWFLSA-N 0 0 371.437 3.952 20 5 FHBDRN O=C(Nc1nc(C(F)(F)F)c[nH]1)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000507028405 944877245 /nfs/dbraw/zinc/87/72/45/944877245.db2.gz VWNHLIRELITSCZ-UHFFFAOYSA-N 0 0 368.193 3.608 20 5 FHBDRN COc1ccc(CNC(=O)NC2(c3ccccc3)CCCC2)cc1[N+](=O)[O-] ZINC000506649651 944882243 /nfs/dbraw/zinc/88/22/43/944882243.db2.gz BGPKJQKHAPHGIT-UHFFFAOYSA-N 0 0 369.421 3.872 20 5 FHBDRN Cc1nnc(-c2cccc(NCc3c(F)cc([N+](=O)[O-])cc3F)c2)n1C ZINC000506311639 944883658 /nfs/dbraw/zinc/88/36/58/944883658.db2.gz XLRWZIJJKDRSSK-UHFFFAOYSA-N 0 0 359.336 3.589 20 5 FHBDRN CC(C)(NC(=O)N[C@H]1CCCc2cc(N)ccc21)c1ccccc1[N+](=O)[O-] ZINC000418559520 944888903 /nfs/dbraw/zinc/88/89/03/944888903.db2.gz QUGOFHCTIZTLDN-KRWDZBQOSA-N 0 0 368.437 3.789 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CCO[C@@H](c3ccccc3C)C2)c1 ZINC000517968598 944891115 /nfs/dbraw/zinc/89/11/15/944891115.db2.gz YYYYRYPCMSWDSR-LJQANCHMSA-N 0 0 370.405 3.516 20 5 FHBDRN CCOc1ccccc1[C@H](CC)Nc1ccc(C(=O)NC)cc1[N+](=O)[O-] ZINC000507025723 944891619 /nfs/dbraw/zinc/89/16/19/944891619.db2.gz ACNBESGTGBIZKL-HNNXBMFYSA-N 0 0 357.410 3.916 20 5 FHBDRN Cc1ccc(NC(=O)c2ccc(N(C)C3CCOCC3)c([N+](=O)[O-])c2)cc1 ZINC000074775596 944892374 /nfs/dbraw/zinc/89/23/74/944892374.db2.gz KGDLMFIZBGEZOW-UHFFFAOYSA-N 0 0 369.421 3.771 20 5 FHBDRN Cc1ccc(NCc2c(F)cc([N+](=O)[O-])cc2F)cc1C(=O)NC(C)C ZINC000506309530 944894513 /nfs/dbraw/zinc/89/45/13/944894513.db2.gz KBWADKNIIJGYMU-UHFFFAOYSA-N 0 0 363.364 3.932 20 5 FHBDRN Cc1cc(NCc2c(F)cc([N+](=O)[O-])cc2F)ccc1C(=O)NC(C)C ZINC000506309945 944895189 /nfs/dbraw/zinc/89/51/89/944895189.db2.gz MEPXUPKWUKPDQF-UHFFFAOYSA-N 0 0 363.364 3.932 20 5 FHBDRN Cc1nc(CN2CCN(Cc3ccc(C(C)C)c([N+](=O)[O-])c3)CC2)cs1 ZINC000506655220 944897580 /nfs/dbraw/zinc/89/75/80/944897580.db2.gz SFHFJHMAZLRCBD-UHFFFAOYSA-N 0 0 374.510 3.801 20 5 FHBDRN CC[C@@H](Nc1ccccc1[N+](=O)[O-])c1ccccc1OCC(=O)N(C)C ZINC000426881283 944900413 /nfs/dbraw/zinc/90/04/13/944900413.db2.gz DHUAJRPHLDVAQD-OAHLLOKOSA-N 0 0 357.410 3.625 20 5 FHBDRN O=[N+]([O-])c1cccc2nc(/C=C\c3cnnn3Cc3ccccc3)ccc21 ZINC000426903751 944913281 /nfs/dbraw/zinc/91/32/81/944913281.db2.gz REHFLQQNJDXFEX-LUAWRHEFSA-N 0 0 357.373 3.953 20 5 FHBDRN C[C@@H]1CN(Cc2ccccc2)CCN1C(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000518899077 944917423 /nfs/dbraw/zinc/91/74/23/944917423.db2.gz QCBXDCOCWDIFRI-CQSZACIVSA-N 0 0 373.840 3.595 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])N[C@H]1CC[C@H](Cc2ccccc2)C1 ZINC000438676895 944917917 /nfs/dbraw/zinc/91/79/17/944917917.db2.gz WUGPHABKDYSJIC-SJORKVTESA-N 0 0 353.422 3.534 20 5 FHBDRN CS[C@H]1CCCCN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000151235360 944920426 /nfs/dbraw/zinc/92/04/26/944920426.db2.gz IJKFQNWJMYDNRK-ZDUSSCGKSA-N 0 0 373.272 3.715 20 5 FHBDRN Cc1ccccc1O[C@H](C)CNC(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000511701917 944926961 /nfs/dbraw/zinc/92/69/61/944926961.db2.gz TVHZNWYWKUCEQF-MRXNPFEDSA-N 0 0 371.437 3.555 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N1CC2(CCC2)[C@@H]1C1CCOCC1 ZINC000425682543 944930087 /nfs/dbraw/zinc/93/00/87/944930087.db2.gz KBSHHZLPWPBFHI-SFHVURJKSA-N 0 0 373.453 3.970 20 5 FHBDRN COc1cc(C(=O)N[C@H]2CC[C@H](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000438692739 944932302 /nfs/dbraw/zinc/93/23/02/944932302.db2.gz LQFXSBIJERZFHN-WBVHZDCISA-N 0 0 354.406 3.745 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H](C)Cc1ccccc1F ZINC000054166735 944933773 /nfs/dbraw/zinc/93/37/73/944933773.db2.gz IROHJAAFFUFMCJ-QWHCGFSZSA-N 0 0 362.426 3.962 20 5 FHBDRN CC[C@@H](c1ccccc1OC)N(C)C(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-] ZINC000516505962 944941148 /nfs/dbraw/zinc/94/11/48/944941148.db2.gz PILZBNWLLZGJBE-ZDUSSCGKSA-N 0 0 360.414 3.673 20 5 FHBDRN Cc1cc(C)cc(OCCNc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)c1 ZINC000511701460 944944124 /nfs/dbraw/zinc/94/41/24/944944124.db2.gz QPLMSFLCUUMYKH-UHFFFAOYSA-N 0 0 355.394 3.587 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N2CCC[C@@H]3CCCC[C@@H]32)cc1OC ZINC000072768660 944946621 /nfs/dbraw/zinc/94/66/21/944946621.db2.gz NETXHBWNPDISMK-ZFWWWQNUSA-N 0 0 362.426 3.797 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)Nc1ccccc1-c1cn[nH]c1 ZINC000439753661 944953799 /nfs/dbraw/zinc/95/37/99/944953799.db2.gz CGVBFUREMIVEGH-UHFFFAOYSA-N 0 0 361.361 3.647 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)Nc1ccc(F)c(C2CC2)c1 ZINC000439781270 944966546 /nfs/dbraw/zinc/96/65/46/944966546.db2.gz LJYSOHSOWHDXLP-UHFFFAOYSA-N 0 0 359.357 3.942 20 5 FHBDRN NC(=O)c1cc([N+](=O)[O-])cnc1Oc1ccc(Cl)c(C(F)(F)F)c1 ZINC000507128619 944973298 /nfs/dbraw/zinc/97/32/98/944973298.db2.gz LPNMFNCTEVZKQT-UHFFFAOYSA-N 0 0 361.663 3.553 20 5 FHBDRN CNC(=O)c1ccc(N[C@@H](C)c2ccccc2OC(F)F)c([N+](=O)[O-])c1 ZINC000507133256 944986694 /nfs/dbraw/zinc/98/66/94/944986694.db2.gz UUCGCOLUZWWITN-JTQLQIEISA-N 0 0 365.336 3.729 20 5 FHBDRN CC(=O)c1ccc(O[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1F ZINC000106067576 944994045 /nfs/dbraw/zinc/99/40/45/944994045.db2.gz YIZUQGALPDEIID-LBPRGKRZSA-N 0 0 360.341 3.651 20 5 FHBDRN O=C(COc1cccc([N+](=O)[O-])c1)N[C@H](C1CCCCC1)C(F)(F)F ZINC000439820138 945007842 /nfs/dbraw/zinc/00/78/42/945007842.db2.gz BGKBXALGWLBJOP-OAHLLOKOSA-N 0 0 360.332 3.601 20 5 FHBDRN COCC[C@H](NC(=O)c1c([N+](=O)[O-])cccc1C(F)(F)F)c1ccco1 ZINC000516559007 945009194 /nfs/dbraw/zinc/00/91/94/945009194.db2.gz HXGDZQALGGGZJR-NSHDSACASA-N 0 0 372.299 3.714 20 5 FHBDRN O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CC[C@](F)(c2ccccc2F)C1 ZINC000519003446 945017696 /nfs/dbraw/zinc/01/76/96/945017696.db2.gz PBSDJAGKROLBRV-QGZVFWFLSA-N 0 0 350.296 3.584 20 5 FHBDRN Cc1nn2c(CN(Cc3ccc([N+](=O)[O-])cc3)C(C)C)c(C)nc2s1 ZINC000507168854 945018458 /nfs/dbraw/zinc/01/84/58/945018458.db2.gz GEIFTJDDULFNAN-UHFFFAOYSA-N 0 0 359.455 3.726 20 5 FHBDRN CCC[C@@H]1CCCC[C@@H]1NC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000518989197 945019422 /nfs/dbraw/zinc/01/94/22/945019422.db2.gz URZFESZMDTUFHD-WBMJQRKESA-N 0 0 357.410 3.937 20 5 FHBDRN O=C(Nc1ccc(OCc2ccccc2Cl)cc1)c1cc([N+](=O)[O-])n[nH]1 ZINC000507171833 945020288 /nfs/dbraw/zinc/02/02/88/945020288.db2.gz XUMLPSQQQDFKAR-UHFFFAOYSA-N 0 0 372.768 3.803 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)Nc1ccc(C(C)C)cc1 ZINC000439842811 945022867 /nfs/dbraw/zinc/02/28/67/945022867.db2.gz ICMMRLAWLXJKIE-UHFFFAOYSA-N 0 0 371.393 3.694 20 5 FHBDRN COC(=O)c1c(F)cc(NC(=O)c2cc([N+](=O)[O-])c(C)cc2C)cc1F ZINC001270389493 945025573 /nfs/dbraw/zinc/02/55/73/945025573.db2.gz PEIMAKHSFIPJBY-UHFFFAOYSA-N 0 0 364.304 3.529 20 5 FHBDRN O=[N+]([O-])c1cc(C[N@H+]2CC[C@@](O)(C3CC3)C2)ccc1Oc1ccc(F)cc1 ZINC000426509180 945025690 /nfs/dbraw/zinc/02/56/90/945025690.db2.gz RXHPUJLCHPURDI-FQEVSTJZSA-N 0 0 372.396 3.873 20 5 FHBDRN Cc1ccccc1[C@@H]1CCN(CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000507205259 945031238 /nfs/dbraw/zinc/03/12/38/945031238.db2.gz MBBQGSFCNWMXCO-CQSZACIVSA-N 0 0 373.840 3.985 20 5 FHBDRN CC[C@@H](O)CCNC(=O)c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1 ZINC000427053121 945031280 /nfs/dbraw/zinc/03/12/80/945031280.db2.gz IVFFRMYZLAFUBG-OAHLLOKOSA-N 0 0 360.435 3.637 20 5 FHBDRN CCCN(Cc1ccc(C)cc1)C(=O)COc1ccc([N+](=O)[O-])c(OC)c1 ZINC000519017735 945031807 /nfs/dbraw/zinc/03/18/07/945031807.db2.gz JSZCLGISSMWUKU-UHFFFAOYSA-N 0 0 372.421 3.729 20 5 FHBDRN C[C@@H](NC(=O)C(=O)Nc1ccc(C2CCC2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000427036952 945034413 /nfs/dbraw/zinc/03/44/13/945034413.db2.gz SRNAZAPXOVDCJR-CYBMUJFWSA-N 0 0 367.405 3.678 20 5 FHBDRN O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])NC[C@H]1CC=CCC1 ZINC000519023003 945034990 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373.718 3.906 20 5 FHBDRN C[C@H](Nc1ccc([N+](=O)[O-])c(C(=O)[O-])c1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000383417034 945432996 /nfs/dbraw/zinc/43/29/96/945432996.db2.gz OIULWRDJXHEMQR-HOCLYGCPSA-N 0 0 369.421 3.616 20 5 FHBDRN C[C@@H]1CC[C@@H](c2ccccc2)N(C(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)C1 ZINC000507680661 945443299 /nfs/dbraw/zinc/44/32/99/945443299.db2.gz WYGWYMJYJZLXBO-KDOFPFPSSA-N 0 0 367.405 3.533 20 5 FHBDRN C[C@H](NC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1)c1c(F)cncc1F ZINC000511873304 945455201 /nfs/dbraw/zinc/45/52/01/945455201.db2.gz MNEZGFKJDXPJMN-JTQLQIEISA-N 0 0 364.352 3.564 20 5 FHBDRN Cc1c(NCC(=O)Nc2cccc(C(F)(F)F)c2)cccc1[N+](=O)[O-] ZINC000015319705 945474319 /nfs/dbraw/zinc/47/43/19/945474319.db2.gz QEHHRVMWEBAYII-UHFFFAOYSA-N 0 0 353.300 3.973 20 5 FHBDRN COc1cc(OC)cc(N2CCCN(c3cccc(C)c3[N+](=O)[O-])CC2)c1 ZINC000549523077 945474573 /nfs/dbraw/zinc/47/45/73/945474573.db2.gz MYKNQEHJEPJNJK-UHFFFAOYSA-N 0 0 371.437 3.637 20 5 FHBDRN CC[C@@H](CNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1)Oc1cccc(F)c1 ZINC000426649331 945476913 /nfs/dbraw/zinc/47/69/13/945476913.db2.gz XIMACQDZXZAKKX-KRWDZBQOSA-N 0 0 374.412 3.985 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1)N(Cc1cccs1)C[C@H]1CCCO1 ZINC000018182471 945476929 /nfs/dbraw/zinc/47/69/29/945476929.db2.gz SDQFVLXOHYPMHF-OAHLLOKOSA-N 0 0 361.423 3.869 20 5 FHBDRN Cc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2nc[nH]n2)c1C ZINC000507707194 945479934 /nfs/dbraw/zinc/47/99/34/945479934.db2.gz ZAOFKHXCDMSQIP-UHFFFAOYSA-N 0 0 369.406 3.733 20 5 FHBDRN C[C@@H](NC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)c1ccc(F)c(F)c1 ZINC000087022554 945480546 /nfs/dbraw/zinc/48/05/46/945480546.db2.gz INMRXJUDHVNGEU-LLVKDONJSA-N 0 0 361.348 3.702 20 5 FHBDRN O=C(N[C@H]1CCCC(F)(F)C1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000438037042 945481830 /nfs/dbraw/zinc/48/18/30/945481830.db2.gz QERJAIBHRRQGHX-ZDUSSCGKSA-N 0 0 353.369 3.847 20 5 FHBDRN Cc1cc(C)c(C[S@@](=O)CCC(=O)Nc2ccccc2[N+](=O)[O-])c(C)c1 ZINC000507711162 945484147 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20 5 FHBDRN Cc1c(Cl)ccc2c1N(S(=O)(=O)c1ccccc1[N+](=O)[O-])CCC2 ZINC000522968911 946176119 /nfs/dbraw/zinc/17/61/19/946176119.db2.gz NRIYXSICBIMQRZ-UHFFFAOYSA-N 0 0 366.826 3.698 20 5 FHBDRN Cc1cc2c(cc1NC(=O)c1ccc3[nH]c4ccccc4c(=O)c3c1)OCO2 ZINC000444299555 946185340 /nfs/dbraw/zinc/18/53/40/946185340.db2.gz CDDKZHCAKSDYFP-UHFFFAOYSA-N 0 0 372.380 3.971 20 5 FHBDRN O=C(c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12)N1CC[C@@H](C2CC2)C1 ZINC000444299456 946185440 /nfs/dbraw/zinc/18/54/40/946185440.db2.gz VINFZNASXCUWRK-GFCCVEGCSA-N 0 0 368.383 3.832 20 5 FHBDRN O=C(N[C@@H]1CCCc2sccc21)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000136608352 946186182 /nfs/dbraw/zinc/18/61/82/946186182.db2.gz JGQHYURAMRGQAZ-MRXNPFEDSA-N 0 0 357.435 3.802 20 5 FHBDRN CC(C)Nc1ccc([N+](=O)[O-])cc1NC(=O)c1nnc(C(C)(C)C)s1 ZINC000456158356 946200134 /nfs/dbraw/zinc/20/01/34/946200134.db2.gz FOCKSIMYMBQUHQ-UHFFFAOYSA-N 0 0 363.443 3.816 20 5 FHBDRN C[C@@](CO)(NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1)C1CCCCC1 ZINC000444308271 946200912 /nfs/dbraw/zinc/20/09/12/946200912.db2.gz CUCIYSWOVBGUND-SFHVURJKSA-N 0 0 362.451 3.871 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCN(c3ccc(Cl)cn3)CC2)c(Cl)c1 ZINC000109260899 946218600 /nfs/dbraw/zinc/21/86/00/946218600.db2.gz XCVPNJJWHLZBGR-UHFFFAOYSA-N 0 0 353.209 3.623 20 5 FHBDRN CC(C)N(C(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)c1ccccc1 ZINC000109271004 946223513 /nfs/dbraw/zinc/22/35/13/946223513.db2.gz AGXOCZNFDDUCLA-UHFFFAOYSA-N 0 0 350.378 3.836 20 5 FHBDRN Cc1ccccc1CCNc1ccc(C(=O)c2nccn2C)cc1[N+](=O)[O-] ZINC000109306184 946227058 /nfs/dbraw/zinc/22/70/58/946227058.db2.gz BLRBFRBRJPHLIH-UHFFFAOYSA-N 0 0 364.405 3.522 20 5 FHBDRN CC(C)c1nnc2n1CCN(c1ccc(C(F)(F)F)cc1[N+](=O)[O-])[C@H]2C ZINC000302523355 946241760 /nfs/dbraw/zinc/24/17/60/946241760.db2.gz CESPOQBKPHHANR-JTQLQIEISA-N 0 0 369.347 3.910 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])NCC1(c2ccccc2)CCCC1 ZINC000109339320 946244875 /nfs/dbraw/zinc/24/48/75/946244875.db2.gz NXNWFSSXHLDLCP-UHFFFAOYSA-N 0 0 353.422 3.635 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CC(c3ncc(C4CC4)cn3)C2)nc1-c1ccccc1 ZINC000894901019 946270583 /nfs/dbraw/zinc/27/05/83/946270583.db2.gz PRCLRRYEDQJRFA-UHFFFAOYSA-N 0 0 373.416 3.928 20 5 FHBDRN CC(C)CN(CC(C)C)C(=O)COC(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000104574523 946272194 /nfs/dbraw/zinc/27/21/94/946272194.db2.gz AUVWVUWKNPWXIA-UHFFFAOYSA-N 0 0 370.833 3.546 20 5 FHBDRN CC[C@H](NC(=O)c1cccc(SC)c1[N+](=O)[O-])c1nc(C)cs1 ZINC000186460997 946281568 /nfs/dbraw/zinc/28/15/68/946281568.db2.gz UTVGHJLKOVALMJ-NSHDSACASA-N 0 0 351.453 3.963 20 5 FHBDRN C[C@@H]1C[C@H](c2cccnc2)N(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000186016914 946286028 /nfs/dbraw/zinc/28/60/28/946286028.db2.gz OXGHNNCXKDVGHC-SJKOYZFVSA-N 0 0 374.828 3.936 20 5 FHBDRN Cc1c(-c2nc([C@H]3CCC[C@@H](C)C3)no2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000545639275 946286825 /nfs/dbraw/zinc/28/68/25/946286825.db2.gz FZEIVVCQMAIEFV-YPMHNXCESA-N 0 0 368.397 3.828 20 5 FHBDRN O=C(CSc1ccccc1Cl)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088232081 946291375 /nfs/dbraw/zinc/29/13/75/946291375.db2.gz YVXJOLIZYFXEDA-UHFFFAOYSA-N 0 0 362.838 3.925 20 5 FHBDRN CC[C@@H](Oc1cccc(C)c1)C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088230752 946292402 /nfs/dbraw/zinc/29/24/02/946292402.db2.gz WJNFKXMYFQQOMC-LJQANCHMSA-N 0 0 354.406 3.646 20 5 FHBDRN CSc1ccc(OC[C@@H](O)COc2cccc(Cl)c2[N+](=O)[O-])cc1 ZINC000840768254 946292756 /nfs/dbraw/zinc/29/27/56/946292756.db2.gz MRZYGNQHJGEYMK-LLVKDONJSA-N 0 0 369.826 3.789 20 5 FHBDRN C[C@H](C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)c1ccc(Cl)s1 ZINC000088231159 946293308 /nfs/dbraw/zinc/29/33/08/946293308.db2.gz DGLBHWHYAZABGN-JTQLQIEISA-N 0 0 350.827 3.998 20 5 FHBDRN CO[C@@H](C)CCNC(=O)c1ccc(SCCC(C)C)c([N+](=O)[O-])c1 ZINC000549550220 946296759 /nfs/dbraw/zinc/29/67/59/946296759.db2.gz INCPGZROYVGORV-ZDUSSCGKSA-N 0 0 354.472 3.888 20 5 FHBDRN O=C(Nc1cccc(-c2noc(C3CC3)n2)c1)c1ccc([N+](=O)[O-])cc1 ZINC000088233290 946297442 /nfs/dbraw/zinc/29/74/42/946297442.db2.gz LIAKHJDTOGZUGB-UHFFFAOYSA-N 0 0 350.334 3.775 20 5 FHBDRN C[C@@H]1CN2CCCC[C@@H]2CN1C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000408182666 946301227 /nfs/dbraw/zinc/30/12/27/946301227.db2.gz LIIKEDAYXZGWRK-IUODEOHRSA-N 0 0 359.451 3.508 20 5 FHBDRN CC(C)CCNC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 ZINC000052931058 946310059 /nfs/dbraw/zinc/31/00/59/946310059.db2.gz HCHRDQILMMGRDX-CQSZACIVSA-N 0 0 356.426 3.939 20 5 FHBDRN CSc1cccc(C(=O)N(C)CCOc2ccccc2C)c1[N+](=O)[O-] ZINC000186019939 946323385 /nfs/dbraw/zinc/32/33/85/946323385.db2.gz HPWYYZLWZJPLOJ-UHFFFAOYSA-N 0 0 360.435 3.776 20 5 FHBDRN C[C@@H]1CCC[C@@H](NC(=O)CN(Cc2ccccc2[N+](=O)[O-])C2CC2)[C@H]1C ZINC000441238598 946329239 /nfs/dbraw/zinc/32/92/39/946329239.db2.gz YWPZVKNNZFNYBZ-RVKKMQEKSA-N 0 0 359.470 3.500 20 5 FHBDRN C[C@H](NC(=O)c1cnn(-c2ccccc2Cl)c1)c1cccc([N+](=O)[O-])c1 ZINC000109559492 946332581 /nfs/dbraw/zinc/33/25/81/946332581.db2.gz QSZKGPRJUJENJP-LBPRGKRZSA-N 0 0 370.796 3.925 20 5 FHBDRN Cc1ccc(-c2noc(-c3cccc([N+](=O)[O-])c3C)n2)c(N2CCCC2)n1 ZINC000545661625 946334061 /nfs/dbraw/zinc/33/40/61/946334061.db2.gz QTJIRXDURNGYNM-UHFFFAOYSA-N 0 0 365.393 3.924 20 5 FHBDRN C[C@@H](NC(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1)[C@H]1CCOC1 ZINC000438497168 946365240 /nfs/dbraw/zinc/36/52/40/946365240.db2.gz ZVMIWAYRLYIERA-KGLIPLIRSA-N 0 0 371.393 3.934 20 5 FHBDRN O=C(Cc1csc(-c2cccc(F)c2)n1)NCc1ccccc1[N+](=O)[O-] ZINC000046148761 946373490 /nfs/dbraw/zinc/37/34/90/946373490.db2.gz TWEYLTYXBFQAFQ-UHFFFAOYSA-N 0 0 371.393 3.716 20 5 FHBDRN Cc1nc(Cc2ccccc2)sc1C(=O)NCc1ccccc1[N+](=O)[O-] ZINC000046148149 946374467 /nfs/dbraw/zinc/37/44/67/946374467.db2.gz QCDPHZWUMZZLMJ-UHFFFAOYSA-N 0 0 367.430 3.881 20 5 FHBDRN Cc1c(CC(=O)Nc2nc3c(cccc3Cl)n2C)cccc1[N+](=O)[O-] ZINC000184427602 946376929 /nfs/dbraw/zinc/37/69/29/946376929.db2.gz XXGGJTKREQOUBX-UHFFFAOYSA-N 0 0 358.785 3.625 20 5 FHBDRN Cc1nn([C@@H](C)C(=O)N[C@@H](C)c2ccc3c(c2)CCCC3)c(C)c1[N+](=O)[O-] ZINC000111175316 946378608 /nfs/dbraw/zinc/37/86/08/946378608.db2.gz VNGHVUOICOZBHJ-WFASDCNBSA-N 0 0 370.453 3.725 20 5 FHBDRN Cn1cc(C(=O)Nc2cccc([N+](=O)[O-])c2)c(-c2ccc(Cl)s2)n1 ZINC000475476684 946390107 /nfs/dbraw/zinc/39/01/07/946390107.db2.gz BQXYVWYNTQLANV-UHFFFAOYSA-N 0 0 362.798 3.963 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])N1CC2(CCC2)[C@H]1c1ccco1 ZINC000456580630 946391423 /nfs/dbraw/zinc/39/14/23/946391423.db2.gz YGBVEIXUZVEBRL-GOSISDBHSA-N 0 0 356.378 3.711 20 5 FHBDRN COc1ccc(C(=O)N2CCc3ccc([N+](=O)[O-])cc32)c(OCC(C)C)c1 ZINC000475483534 946393875 /nfs/dbraw/zinc/39/38/75/946393875.db2.gz VJXMGLBGECDINN-UHFFFAOYSA-N 0 0 370.405 3.841 20 5 FHBDRN COC(=O)c1ccc(/C=C\C(=O)Oc2cc([N+](=O)[O-])c(Cl)cc2C)o1 ZINC001126120565 946405677 /nfs/dbraw/zinc/40/56/77/946405677.db2.gz WBICRFVQLLDRCG-XQRVVYSFSA-N 0 0 365.725 3.555 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]cc(-c3nc(-c4cccc(-n5cccn5)c4)no3)c2c1 ZINC000545693600 946408216 /nfs/dbraw/zinc/40/82/16/946408216.db2.gz AESLGIOCIXQSDN-UHFFFAOYSA-N 0 0 372.344 3.979 20 5 FHBDRN Cc1cccc(CC2(O)CCN(Cc3ccc([N+](=O)[O-])cc3F)CC2)c1 ZINC000475487614 946410201 /nfs/dbraw/zinc/41/02/01/946410201.db2.gz PMKJSSUDBSLXIJ-UHFFFAOYSA-N 0 0 358.413 3.612 20 5 FHBDRN Cc1nc2ccccc2n1CCCNC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000047707029 946413406 /nfs/dbraw/zinc/41/34/06/946413406.db2.gz HWUMQVHFSQBKFF-UHFFFAOYSA-N 0 0 367.409 3.773 20 5 FHBDRN O=[N+]([O-])c1cccc(N2CCN(Cc3cc(F)cc4cccnc43)CC2)c1 ZINC000047745679 946418450 /nfs/dbraw/zinc/41/84/50/946418450.db2.gz VTWOOPHODMKZEJ-UHFFFAOYSA-N 0 0 366.396 3.604 20 5 FHBDRN O=C(COc1ccccc1[N+](=O)[O-])N[C@@H]1CCC[C@@H]1Cc1ccccc1 ZINC000121368350 946425881 /nfs/dbraw/zinc/42/58/81/946425881.db2.gz YAJWDUVYLXXDPS-IAGOWNOFSA-N 0 0 354.406 3.501 20 5 FHBDRN Cc1ccccc1CS(=O)(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000111332542 946428690 /nfs/dbraw/zinc/42/86/90/946428690.db2.gz FKDYSMKVFSXQQA-UHFFFAOYSA-N 0 0 362.451 3.644 20 5 FHBDRN COCCOc1cc(C)ccc1NC(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000047855838 946443943 /nfs/dbraw/zinc/44/39/43/946443943.db2.gz WUNXFTBKQXDZFE-CQSZACIVSA-N 0 0 373.409 3.811 20 5 FHBDRN O=[N+]([O-])c1cc(Br)nc(N[C@@H]2C[C@H]2c2ccc(F)c(F)c2)c1 ZINC001168068120 946447012 /nfs/dbraw/zinc/44/70/12/946447012.db2.gz NLXJSJIYULRTHJ-JOYOIKCWSA-N 0 0 370.153 3.999 20 5 FHBDRN O=C(c1cccc(-n2ccnc2)c1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000129500372 946448905 /nfs/dbraw/zinc/44/89/05/946448905.db2.gz SDIHCBDSWDWAIL-UHFFFAOYSA-N 0 0 362.389 3.585 20 5 FHBDRN O=C(NCc1ncc(-c2ccccc2)o1)c1ccc([N+](=O)[O-])cc1Cl ZINC000047927347 946455176 /nfs/dbraw/zinc/45/51/76/946455176.db2.gz JOTFIPCXYPIFID-UHFFFAOYSA-N 0 0 357.753 3.833 20 5 FHBDRN CCc1c(NC(=O)c2cccc(OC)c2[N+](=O)[O-])cnn1CCC(C)C ZINC000444399876 946458726 /nfs/dbraw/zinc/45/87/26/946458726.db2.gz BTWYVMJFLBUZSI-UHFFFAOYSA-N 0 0 360.414 3.661 20 5 FHBDRN CC(=O)c1ccc(OC[C@@H](O)c2ccccc2C(F)(F)F)c([N+](=O)[O-])c1 ZINC000179064732 946490418 /nfs/dbraw/zinc/49/04/18/946490418.db2.gz FVOVQOIUABUJAU-OAHLLOKOSA-N 0 0 369.295 3.929 20 5 FHBDRN Cc1c(NC(=O)Cc2ccc(Br)s2)cccc1[N+](=O)[O-] ZINC000074400546 946502105 /nfs/dbraw/zinc/50/21/05/946502105.db2.gz PEOWBZMOUGJSKE-UHFFFAOYSA-N 0 0 355.213 3.908 20 5 FHBDRN COCc1ccc([C@H]2CCCN2C(=O)c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000137449752 946501951 /nfs/dbraw/zinc/50/19/51/946501951.db2.gz VIOGPZBLTXHFIO-CQSZACIVSA-N 0 0 364.785 3.965 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](C)C[C@@H](O)c2ccc(F)cc2)c1C ZINC000897035251 946504945 /nfs/dbraw/zinc/50/49/45/946504945.db2.gz SCJJFDAJMCVGMU-YVEFUNNKSA-N 0 0 360.385 3.593 20 5 FHBDRN O=[N+]([O-])c1cccc(OCc2nc(CSCc3ccccc3)no2)c1 ZINC000545736926 946510248 /nfs/dbraw/zinc/51/02/48/946510248.db2.gz BGQPTRVABWZADY-UHFFFAOYSA-N 0 0 357.391 3.990 20 5 FHBDRN C[C@@H](Oc1nc(Cl)ccc1[N+](=O)[O-])c1ccc(Br)nc1 ZINC001226364758 946511023 /nfs/dbraw/zinc/51/10/23/946511023.db2.gz SUMLWPVOURQHRD-SSDOTTSWSA-N 0 0 358.579 3.941 20 5 FHBDRN C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH+]1CCC(CO)(C(F)(F)F)CC1 ZINC000897038002 946512440 /nfs/dbraw/zinc/51/24/40/946512440.db2.gz YRGVXWHUQOHTJY-LCYFTJDESA-N 0 0 358.360 3.635 20 5 FHBDRN CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)/C=C/c1ccnc(Cl)c1 ZINC000179069983 946514001 /nfs/dbraw/zinc/51/40/01/946514001.db2.gz KGPZJSSCHMTMLW-GORDUTHDSA-N 0 0 366.204 3.968 20 5 FHBDRN COc1ccc(Cl)cc1CNC(=O)c1cccc(SC)c1[N+](=O)[O-] ZINC000186152175 946517876 /nfs/dbraw/zinc/51/78/76/946517876.db2.gz QBNQBTAPZHWVGX-UHFFFAOYSA-N 0 0 366.826 3.909 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc(Nc2ncccn2)cc1 ZINC000444423580 946518054 /nfs/dbraw/zinc/51/80/54/946518054.db2.gz ROQYRNFPOYXUML-UHFFFAOYSA-N 0 0 363.377 3.700 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)Nc2c(C)c(C(F)(F)F)nn2C)c1 ZINC000186134014 946524234 /nfs/dbraw/zinc/52/42/34/946524234.db2.gz AYROOHHUKQDARZ-UHFFFAOYSA-N 0 0 374.344 3.630 20 5 FHBDRN O=[N+]([O-])c1ccc2c(ccn2Cc2nc(-c3ccc4nc[nH]c4c3)no2)c1 ZINC000545753140 946528608 /nfs/dbraw/zinc/52/86/08/946528608.db2.gz SXRZKDNYHADBPE-UHFFFAOYSA-N 0 0 360.333 3.524 20 5 FHBDRN C[C@@H](CNC(=O)N1CC(C)(C)[C@@H]1c1cccnc1)c1ccccc1[N+](=O)[O-] ZINC000897058027 946544742 /nfs/dbraw/zinc/54/47/42/946544742.db2.gz LOHTZPZGDPDHIW-KSSFIOAISA-N 0 0 368.437 3.886 20 5 FHBDRN Cc1csc(CCCCNC(=O)c2c(C)c(F)ccc2[N+](=O)[O-])n1 ZINC000843785400 946546572 /nfs/dbraw/zinc/54/65/72/946546572.db2.gz FGPFPBNOPQAFKP-UHFFFAOYSA-N 0 0 351.403 3.560 20 5 FHBDRN O=C(c1cc(F)c(Cl)c([N+](=O)[O-])c1Cl)N(CC(F)F)C1CC1 ZINC000897072929 946552340 /nfs/dbraw/zinc/55/23/40/946552340.db2.gz CDFVXNZFDCVPRH-UHFFFAOYSA-N 0 0 357.115 3.910 20 5 FHBDRN C[C@@H](CNC(=O)N1CCC[C@H]1c1ccncc1)c1ccccc1[N+](=O)[O-] ZINC000897074243 946552964 /nfs/dbraw/zinc/55/29/64/946552964.db2.gz BIPSNKVSTCTODC-YOEHRIQHSA-N 0 0 354.410 3.640 20 5 FHBDRN C[C@H](CNC(=O)N(C)Cc1cc(Cl)cn1C)c1ccccc1[N+](=O)[O-] ZINC000897067835 946562440 /nfs/dbraw/zinc/56/24/40/946562440.db2.gz OJWNFYKPHDFIEW-GFCCVEGCSA-N 0 0 364.833 3.532 20 5 FHBDRN C[C@H](c1cccc(O)c1)N(C)C(=O)NC[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000897070973 946567727 /nfs/dbraw/zinc/56/77/27/946567727.db2.gz KUGOAPFDYHAXOM-ZIAGYGMSSA-N 0 0 357.410 3.807 20 5 FHBDRN C[C@@H](Cc1ccncc1)NC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000475182461 946571590 /nfs/dbraw/zinc/57/15/90/946571590.db2.gz GCWPJMGPEDQNOW-JTQLQIEISA-N 0 0 368.315 3.761 20 5 FHBDRN CSc1cccc(C(=O)NC[C@H](C)Cc2cccs2)c1[N+](=O)[O-] ZINC000186582496 946576394 /nfs/dbraw/zinc/57/63/94/946576394.db2.gz OOFLGQJBAONGSQ-LLVKDONJSA-N 0 0 350.465 3.987 20 5 FHBDRN O=C(N[C@H]1COc2ccc(Cl)cc21)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000475519010 946580237 /nfs/dbraw/zinc/58/02/37/946580237.db2.gz NDPRGYGJVNDLGZ-HNNXBMFYSA-N 0 0 357.753 3.593 20 5 FHBDRN C[C@H](c1ccccc1[N+](=O)[O-])N1CCN(Cc2ccc(Cl)cc2)C(=O)C1 ZINC000441407597 946585836 /nfs/dbraw/zinc/58/58/36/946585836.db2.gz UTMQMDHUUZOQGK-CQSZACIVSA-N 0 0 373.840 3.654 20 5 FHBDRN CC[C@H](C)Oc1ccc(-c2nc(Cc3ccc([N+](=O)[O-])cn3)no2)cc1 ZINC000545780735 946595155 /nfs/dbraw/zinc/59/51/55/946595155.db2.gz LVGNXKJOYNHMKU-LBPRGKRZSA-N 0 0 354.366 3.808 20 5 FHBDRN C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000728808934 946597972 /nfs/dbraw/zinc/59/79/72/946597972.db2.gz HLXUBDNXGFROJW-SNVBAGLBSA-N 0 0 367.317 3.841 20 5 FHBDRN CC(C)COc1ccc(Cc2nc(Cc3ccc([N+](=O)[O-])cn3)no2)cc1 ZINC000545779840 946598008 /nfs/dbraw/zinc/59/80/08/946598008.db2.gz QGCZNGQVAIMWMS-UHFFFAOYSA-N 0 0 368.393 3.589 20 5 FHBDRN CCc1ccc(NC(=O)[C@@H]2C[C@H]2c2cccc([N+](=O)[O-])c2)c(C(=O)OC)c1 ZINC001126142528 946600295 /nfs/dbraw/zinc/60/02/95/946600295.db2.gz GAXSKUZNEGGCGD-JKSUJKDBSA-N 0 0 368.389 3.686 20 5 FHBDRN CSc1cccc(C(=O)N[C@H](c2nc(C)cs2)C2CC2)c1[N+](=O)[O-] ZINC000186584269 946613740 /nfs/dbraw/zinc/61/37/40/946613740.db2.gz RXADGLMNRPWTCS-ZDUSSCGKSA-N 0 0 363.464 3.963 20 5 FHBDRN Cc1cc(NC(=O)COC2CCC(C)CC2)n(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000475534684 946613916 /nfs/dbraw/zinc/61/39/16/946613916.db2.gz VZQSTLIYGXDFKK-UHFFFAOYSA-N 0 0 372.425 3.623 20 5 FHBDRN COCCOCc1noc(-c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)n1 ZINC000545775593 946616518 /nfs/dbraw/zinc/61/65/18/946616518.db2.gz YKDCPHIMLMUMJL-UHFFFAOYSA-N 0 0 370.365 3.551 20 5 FHBDRN CSc1cccc(C(=O)NC[C@H](C)Oc2ccc(C)cc2)c1[N+](=O)[O-] ZINC000186594044 946633843 /nfs/dbraw/zinc/63/38/43/946633843.db2.gz XBLBIOZKXISGBS-ZDUSSCGKSA-N 0 0 360.435 3.822 20 5 FHBDRN Cc1ccc(N2CCC[C@H](n3ccc(C(F)(F)F)n3)C2)c([N+](=O)[O-])c1 ZINC000302169298 946636875 /nfs/dbraw/zinc/63/68/75/946636875.db2.gz LRJZFMLSEVGBPH-LBPRGKRZSA-N 0 0 354.332 3.960 20 5 FHBDRN Cc1cn2cc(NC(=O)[C@@H](C)Sc3ccc([N+](=O)[O-])cc3)ccc2n1 ZINC000523009466 946637149 /nfs/dbraw/zinc/63/71/49/946637149.db2.gz LDSCZSMNYFMHKB-GFCCVEGCSA-N 0 0 356.407 3.670 20 5 FHBDRN COC[C@@H](Cc1ccccc1)NC(=O)Nc1cc(C)c([N+](=O)[O-])cc1C ZINC000475556845 946641231 /nfs/dbraw/zinc/64/12/31/946641231.db2.gz UKSVHMPZQYNNCR-MRXNPFEDSA-N 0 0 357.410 3.591 20 5 FHBDRN C[C@H]1C[C@H](c2noc(-c3ccc(OC(F)F)c([N+](=O)[O-])c3)n2)CCO1 ZINC000545798591 946646593 /nfs/dbraw/zinc/64/65/93/946646593.db2.gz JHKPBHUQEOGBDU-DTWKUNHWSA-N 0 0 355.297 3.529 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)NC2(Cc3cccc(Cl)c3)CC2)c1[N+](=O)[O-] ZINC000456719845 946648510 /nfs/dbraw/zinc/64/85/10/946648510.db2.gz DZTFBUAUOFSRKI-UHFFFAOYSA-N 0 0 362.817 3.600 20 5 FHBDRN Cc1ccc(NC(=O)C2CC2)cc1NC(=O)c1c(C)c(F)ccc1[N+](=O)[O-] ZINC000843766402 946651442 /nfs/dbraw/zinc/65/14/42/946651442.db2.gz QTQUYGWLRMMTEK-UHFFFAOYSA-N 0 0 371.368 3.952 20 5 FHBDRN Cc1ccc(NCCCNC(=O)N(C)[C@@H](C)c2cccnc2)c([N+](=O)[O-])c1 ZINC000121399380 946656389 /nfs/dbraw/zinc/65/63/89/946656389.db2.gz MQVWPEGBVBTKSI-HNNXBMFYSA-N 0 0 371.441 3.503 20 5 FHBDRN COc1cccc(F)c1NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000184443117 946657690 /nfs/dbraw/zinc/65/76/90/946657690.db2.gz FTRBPLJLDOZMIT-UHFFFAOYSA-N 0 0 373.384 3.598 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NC[C@@H](C)N(C)c1ccccc1 ZINC000475563399 946657854 /nfs/dbraw/zinc/65/78/54/946657854.db2.gz FYMWYMVXHCIPQJ-OAHLLOKOSA-N 0 0 356.426 3.858 20 5 FHBDRN O=C(COc1ccc(F)cc1Br)c1ccc([N+](=O)[O-])cc1 ZINC000048403638 946665628 /nfs/dbraw/zinc/66/56/28/946665628.db2.gz SAGUAROAXSQYEO-UHFFFAOYSA-N 0 0 354.131 3.758 20 5 FHBDRN CCOC(=O)c1ccnc(Sc2nc(-c3ccccc3)c[nH]2)c1[N+](=O)[O-] ZINC000609961005 946697220 /nfs/dbraw/zinc/69/72/20/946697220.db2.gz SQFJERREPMYBDC-UHFFFAOYSA-N 0 0 370.390 3.708 20 5 FHBDRN Cc1cccc2[nH]c(CNC(=O)Nc3cc(C)c([N+](=O)[O-])cc3C)nc21 ZINC000475568794 946698972 /nfs/dbraw/zinc/69/89/72/946698972.db2.gz BJAFNNJNJKWFBC-UHFFFAOYSA-N 0 0 353.382 3.718 20 5 FHBDRN CC[C@@H](C[C@@H](C)CO)NC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000475218406 946718419 /nfs/dbraw/zinc/71/84/19/946718419.db2.gz WJMHYOSSIKJPIR-ZJUUUORDSA-N 0 0 363.336 3.532 20 5 FHBDRN Cc1cc(C)n(-c2ccc(C(=O)Nc3ccc([N+](=O)[O-])cc3)cc2F)n1 ZINC000112164292 946733418 /nfs/dbraw/zinc/73/34/18/946733418.db2.gz VODWUFRLFWCKJW-UHFFFAOYSA-N 0 0 354.341 3.789 20 5 FHBDRN O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])NC[C@@H]1C[C@H]1C1CC1 ZINC000456908841 946744501 /nfs/dbraw/zinc/74/45/01/946744501.db2.gz QSJNNHFFWLGVPX-JQWIXIFHSA-N 0 0 374.384 3.868 20 5 FHBDRN COc1cc(S(=O)(=O)N(C)c2ccc(C(C)C)cc2)ccc1[N+](=O)[O-] ZINC000150765985 946758942 /nfs/dbraw/zinc/75/89/42/946758942.db2.gz ILQIXNCQZRCSCY-UHFFFAOYSA-N 0 0 364.423 3.552 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)c1csc(Br)c1C ZINC000186641544 946769515 /nfs/dbraw/zinc/76/95/15/946769515.db2.gz HWCIYFYCXUNYSU-UHFFFAOYSA-N 0 0 371.212 3.988 20 5 FHBDRN COc1ccc2cc(CNC(=O)c3ccc([N+](=O)[O-])c(OC)c3)ccc2c1 ZINC000134025105 946769726 /nfs/dbraw/zinc/76/97/26/946769726.db2.gz JCLKVTOMBBRIKV-UHFFFAOYSA-N 0 0 366.373 3.695 20 5 FHBDRN CCCCn1cc(C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)c(C)n1 ZINC000186285008 946769935 /nfs/dbraw/zinc/76/99/35/946769935.db2.gz PHFHCCHUTOLAOY-UHFFFAOYSA-N 0 0 356.426 3.705 20 5 FHBDRN C[C@H](Sc1nc2cc3ccccc3cc2c(=O)n1C)C(=O)OC(C)(C)C ZINC000523112658 946775976 /nfs/dbraw/zinc/77/59/76/946775976.db2.gz VHPUYDQHKTYMBH-LBPRGKRZSA-N 0 0 370.474 3.909 20 5 FHBDRN C[C@H](NC(=O)Nc1cccc([N+](=O)[O-])c1)c1ccc(Br)cn1 ZINC000475250683 946778780 /nfs/dbraw/zinc/77/87/80/946778780.db2.gz SKBRADDMGATKDX-VIFPVBQESA-N 0 0 365.187 3.635 20 5 FHBDRN O=[N+]([O-])c1ccc(OCCOc2ccccc2F)c(Br)c1 ZINC000523109867 946778844 /nfs/dbraw/zinc/77/88/44/946778844.db2.gz BFKUUDZXOAHIDU-UHFFFAOYSA-N 0 0 356.147 3.954 20 5 FHBDRN COC(=O)c1sc(C)cc1OCc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000536274481 946779342 /nfs/dbraw/zinc/77/93/42/946779342.db2.gz FYYZPSKUZMUQQJ-UHFFFAOYSA-N 0 0 374.374 3.985 20 5 FHBDRN CCOC(=O)c1ccnc(NCc2oc3ccc(F)cc3c2C)c1[N+](=O)[O-] ZINC000523114438 946798352 /nfs/dbraw/zinc/79/83/52/946798352.db2.gz IDTWXKBXIDKGFO-UHFFFAOYSA-N 0 0 373.340 3.972 20 5 FHBDRN CCOc1ccc(-c2noc(CNc3cc([N+](=O)[O-])ccc3OC)n2)cc1 ZINC000025908806 946821819 /nfs/dbraw/zinc/82/18/19/946821819.db2.gz HKACOOQZXYOJHT-UHFFFAOYSA-N 0 0 370.365 3.664 20 5 FHBDRN C[C@H]1CCN(C(=O)CCOc2ccccc2[N+](=O)[O-])c2c(O)cccc21 ZINC000186304857 946830330 /nfs/dbraw/zinc/83/03/30/946830330.db2.gz VBJPRPBMXYPZAE-ZDUSSCGKSA-N 0 0 356.378 3.610 20 5 FHBDRN C/C=C\C[C@@H](CO)NC(=O)c1cc([N+](=O)[O-])ccc1SC1CCCC1 ZINC000613847718 946831525 /nfs/dbraw/zinc/83/15/25/946831525.db2.gz BLWSAVBJSXRYCX-ZRMMWKCHSA-N 0 0 364.467 3.686 20 5 FHBDRN O=C(c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12)N1CC2(C1)CCCC2 ZINC000444336606 946832143 /nfs/dbraw/zinc/83/21/43/946832143.db2.gz OMJREKANYWXCKS-UHFFFAOYSA-N 0 0 368.383 3.976 20 5 FHBDRN Cc1csc([C@@H](C)NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)n1 ZINC000546535343 946834066 /nfs/dbraw/zinc/83/40/66/946834066.db2.gz SNQBEJCOSGVDGO-SNVBAGLBSA-N 0 0 351.403 3.654 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCc2ccc(Br)cc21 ZINC000112265879 946835764 /nfs/dbraw/zinc/83/57/64/946835764.db2.gz TUJRQNFRURXHHP-UHFFFAOYSA-N 0 0 361.195 3.869 20 5 FHBDRN CCCC[C@@H](CC)CNC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000048570970 946836321 /nfs/dbraw/zinc/83/63/21/946836321.db2.gz NADDUXQPGSOZTR-LLVKDONJSA-N 0 0 355.822 3.519 20 5 FHBDRN C[C@@H]1CC[C@@H](CNC(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC000475303775 946845885 /nfs/dbraw/zinc/84/58/85/946845885.db2.gz NYPGUATZSJGVQV-HUUCEWRRSA-N 0 0 361.442 3.584 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)N[C@H]1CCC[C@@H]1Cc1ccccc1 ZINC000610013763 946854879 /nfs/dbraw/zinc/85/48/79/946854879.db2.gz AOVZIDTXWXXVHT-MJGOQNOKSA-N 0 0 353.422 3.805 20 5 FHBDRN O=C(CCC1CCCCC1)N1CCN(Cc2csc([N+](=O)[O-])c2)CC1 ZINC000054292830 946856737 /nfs/dbraw/zinc/85/67/37/946856737.db2.gz NSUQFCQFWYMFAW-UHFFFAOYSA-N 0 0 365.499 3.661 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCCc1ccc2c(c1)CCO2 ZINC000184484453 946871528 /nfs/dbraw/zinc/87/15/28/946871528.db2.gz UIUAREZFIDLWFS-UHFFFAOYSA-N 0 0 355.394 3.511 20 5 FHBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)Nc1cccc(OC(F)(F)F)c1 ZINC000536281728 946876695 /nfs/dbraw/zinc/87/66/95/946876695.db2.gz WVYFWCQAWPWNQN-UHFFFAOYSA-N 0 0 369.299 3.858 20 5 FHBDRN CCc1ccc([C@@H](C)CC(=O)NCCNc2ccc([N+](=O)[O-])cc2)cc1 ZINC000523124449 946885147 /nfs/dbraw/zinc/88/51/47/946885147.db2.gz MVGKVCOJLKREOY-HNNXBMFYSA-N 0 0 355.438 3.879 20 5 FHBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N[C@@H](C)c1cccc(O)c1 ZINC000444453847 946885201 /nfs/dbraw/zinc/88/52/01/946885201.db2.gz FITUBOIFFHHFAF-WDEREUQCSA-N 0 0 364.785 3.599 20 5 FHBDRN CCCc1[nH]nc(C(=O)Nc2ccc(Oc3ccccn3)cc2)c1[N+](=O)[O-] ZINC000523137644 946890045 /nfs/dbraw/zinc/89/00/45/946890045.db2.gz ISWNEXQWSMAZIT-UHFFFAOYSA-N 0 0 367.365 3.710 20 5 FHBDRN CN(Cc1ccnn1C)Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000475333404 946896677 /nfs/dbraw/zinc/89/66/77/946896677.db2.gz CBUQZAZUKCWIIB-UHFFFAOYSA-N 0 0 370.384 3.892 20 5 FHBDRN COc1cccc([C@@H]2C[C@@H](C)CN2C(=O)c2cc([N+](=O)[O-])cnc2C)c1 ZINC000544323746 946906386 /nfs/dbraw/zinc/90/63/86/946906386.db2.gz ZKTFRKCDRVCUHW-XIKOKIGWSA-N 0 0 355.394 3.530 20 5 FHBDRN CC(C)(C(=O)NCCc1cc(F)cc(F)c1)c1ccc([N+](=O)[O-])cc1F ZINC000546537848 946908827 /nfs/dbraw/zinc/90/88/27/946908827.db2.gz YGCDOMJYXUDZED-UHFFFAOYSA-N 0 0 366.339 3.649 20 5 FHBDRN CSc1cccc(C(=O)Nc2cnn(-c3ccccc3)c2)c1[N+](=O)[O-] ZINC000186325180 946913681 /nfs/dbraw/zinc/91/36/81/946913681.db2.gz RICGQOQJGRZNOP-UHFFFAOYSA-N 0 0 354.391 3.755 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(Oc2ncc(Br)cc2[N+](=O)[O-])c1 ZINC000048760163 946916633 /nfs/dbraw/zinc/91/66/33/946916633.db2.gz WBLXOHRAFWWKRK-UHFFFAOYSA-N 0 0 354.116 3.761 20 5 FHBDRN Cc1ccc(Sc2ccc(C(=O)NCC3(C)COC3)cc2[N+](=O)[O-])cc1 ZINC000112616499 946918946 /nfs/dbraw/zinc/91/89/46/946918946.db2.gz YTRKAFWONKLQMG-UHFFFAOYSA-N 0 0 372.446 3.821 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@H]1C[C@@H]1c1ccc(F)c(F)c1 ZINC000186331576 946919051 /nfs/dbraw/zinc/91/90/51/946919051.db2.gz AFBYXNZHBFLSJP-OLZOCXBDSA-N 0 0 366.751 3.946 20 5 FHBDRN Cc1cccc(CNC(=O)Cc2ccc([N+](=O)[O-])cc2Br)c1 ZINC000087061185 946919163 /nfs/dbraw/zinc/91/91/63/946919163.db2.gz BTZOJIOCGSHALX-UHFFFAOYSA-N 0 0 363.211 3.525 20 5 FHBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CC[C@@H](C)[C@@H](C)C1 ZINC000550396387 946923404 /nfs/dbraw/zinc/92/34/04/946923404.db2.gz IAIZRRZRSKKPLW-ZJUUUORDSA-N 0 0 355.232 3.784 20 5 FHBDRN Cc1nn(Cc2csc(-c3ccccn3)n2)c2ccc([N+](=O)[O-])cc12 ZINC000432244416 946927061 /nfs/dbraw/zinc/92/70/61/946927061.db2.gz BPOSIDHIQGXMNO-UHFFFAOYSA-N 0 0 351.391 3.820 20 5 FHBDRN Cc1ccc(C(=O)CCC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000186336587 946950099 /nfs/dbraw/zinc/95/00/99/946950099.db2.gz XPJRDCRQNCWLMS-UHFFFAOYSA-N 0 0 360.797 3.836 20 5 FHBDRN Cc1cc(Cl)cc2c1N(C(=O)c1cc3c(cc1[N+](=O)[O-])OCO3)CCC2 ZINC000609789050 946960145 /nfs/dbraw/zinc/96/01/45/946960145.db2.gz VRLWKCQIWIPGGA-UHFFFAOYSA-N 0 0 374.780 3.878 20 5 FHBDRN CC(C)[C@H]1CCCN(C(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000444524076 946974311 /nfs/dbraw/zinc/97/43/11/946974311.db2.gz PERGVILFKGEMSD-HNNXBMFYSA-N 0 0 356.426 3.504 20 5 FHBDRN CCn1c2cccc(F)c2nc1Cn1nc(C)c2cc([N+](=O)[O-])ccc21 ZINC000432254885 946979728 /nfs/dbraw/zinc/97/97/28/946979728.db2.gz WSRSEIFMYVFLNT-UHFFFAOYSA-N 0 0 353.357 3.810 20 5 FHBDRN Nc1cccc([N+](=O)[O-])c1C(=O)N1C[C@H](c2ccccc2)c2ccccc21 ZINC000444510527 946982090 /nfs/dbraw/zinc/98/20/90/946982090.db2.gz NGUUVENHKQQEFB-MRXNPFEDSA-N 0 0 359.385 3.969 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NC[C@@H]1Cc2ccccc2N(C)C1 ZINC000444543254 946985271 /nfs/dbraw/zinc/98/52/71/946985271.db2.gz JRBBUEWNORRBRW-INIZCTEOSA-N 0 0 367.449 3.559 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCc1ccc2c(n1)CCCC2 ZINC000444549819 946990414 /nfs/dbraw/zinc/99/04/14/946990414.db2.gz LOPNKASRDPMSLD-CYBMUJFWSA-N 0 0 371.462 3.666 20 5 FHBDRN C[C@H](NC(=O)c1ccccc1[N+](=O)[O-])c1ccc(Br)s1 ZINC000444550147 946991423 /nfs/dbraw/zinc/99/14/23/946991423.db2.gz QJVBNVXOKMQOGZ-QMMMGPOBSA-N 0 0 355.213 3.910 20 5 FHBDRN CN(Cc1cc[nH]n1)C(=O)c1ccccc1Sc1ccccc1[N+](=O)[O-] ZINC000440458084 947001007 /nfs/dbraw/zinc/00/10/07/947001007.db2.gz GEKNKYZKRXHFAN-UHFFFAOYSA-N 0 0 368.418 3.741 20 5 FHBDRN CCc1ccc([C@H](NC(=O)CCn2nc(C)c([N+](=O)[O-])c2C)C(C)C)cc1 ZINC000523227917 947010821 /nfs/dbraw/zinc/01/08/21/947010821.db2.gz XGTPSQJVKMZGER-LJQANCHMSA-N 0 0 372.469 3.874 20 5 FHBDRN Cc1nn(CCC(=O)N(Cc2ccco2)c2ccccc2)c(C)c1[N+](=O)[O-] ZINC000523228223 947010950 /nfs/dbraw/zinc/01/09/50/947010950.db2.gz NUBQMADFYKTCTR-UHFFFAOYSA-N 0 0 368.393 3.625 20 5 FHBDRN Cc1ncc([N+](=O)[O-])n1Cc1nnc(-c2c(Cl)cccc2Cl)o1 ZINC000523227490 947011438 /nfs/dbraw/zinc/01/14/38/947011438.db2.gz WJFNWJWRVCLDGH-UHFFFAOYSA-N 0 0 354.153 3.505 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]c(CN3CCC(COc4ccccc4)CC3)nc2c1 ZINC000444588693 947015509 /nfs/dbraw/zinc/01/55/09/947015509.db2.gz FYBBWKHHFOWTMT-UHFFFAOYSA-N 0 0 366.421 3.762 20 5 FHBDRN CCCN([C@H]1CCc2ccccc2C1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000511927513 947017341 /nfs/dbraw/zinc/01/73/41/947017341.db2.gz QLXCTHKTACSLPM-SFHVURJKSA-N 0 0 374.462 3.553 20 5 FHBDRN CSc1cccc(C(=O)NCc2cccc(OC(F)F)c2)c1[N+](=O)[O-] ZINC000186345046 947020796 /nfs/dbraw/zinc/02/07/96/947020796.db2.gz YGEKKKROKIGKND-UHFFFAOYSA-N 0 0 368.361 3.848 20 5 FHBDRN Cc1cc(C(=O)N2C[C@@H](c3ccc(F)cc3)O[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000152013376 947022497 /nfs/dbraw/zinc/02/24/97/947022497.db2.gz DJAZXFQIZSNLSU-UGSOOPFHSA-N 0 0 358.369 3.645 20 5 FHBDRN COc1ccc(CCC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)cc1F ZINC000186349501 947025930 /nfs/dbraw/zinc/02/59/30/947025930.db2.gz ZECRGBSALVXXOH-UHFFFAOYSA-N 0 0 366.776 3.645 20 5 FHBDRN COc1cc(C)c(NC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)cc1C ZINC000444617225 947033146 /nfs/dbraw/zinc/03/31/46/947033146.db2.gz PWMNUZIFBOACRZ-UHFFFAOYSA-N 0 0 367.361 3.726 20 5 FHBDRN Cc1ccc(SCCC(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000444628620 947059085 /nfs/dbraw/zinc/05/90/85/947059085.db2.gz DFZVRXKGCXDTLU-UHFFFAOYSA-N 0 0 370.434 3.578 20 5 FHBDRN CC(C)(C)C(=O)c1ccc(NCc2ccc(C(N)=O)cc2[N+](=O)[O-])cc1 ZINC000487372023 947062106 /nfs/dbraw/zinc/06/21/06/947062106.db2.gz TVSVDNXPRVDTLO-UHFFFAOYSA-N 0 0 355.394 3.535 20 5 FHBDRN CC[C@H](NC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)c1ccc(OC)cc1 ZINC000088479743 947066752 /nfs/dbraw/zinc/06/67/52/947066752.db2.gz PDLLFTCCIOOBNA-IBGZPJMESA-N 0 0 369.421 3.822 20 5 FHBDRN CCSc1cc(CNC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)ccn1 ZINC000186364377 947067798 /nfs/dbraw/zinc/06/77/98/947067798.db2.gz AAXHPNSQXAOFFT-GFCCVEGCSA-N 0 0 360.439 3.662 20 5 FHBDRN Cc1ccc(OC2CCN(Cc3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)cc1 ZINC000444652323 947072474 /nfs/dbraw/zinc/07/24/74/947072474.db2.gz IYQQIKZBDLKYSC-UHFFFAOYSA-N 0 0 366.421 3.823 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]c(CN3CC[C@H](Oc4ccccc4Cl)C3)nc2c1 ZINC000444657852 947076185 /nfs/dbraw/zinc/07/61/85/947076185.db2.gz ACTIDXQKXASYKI-ZDUSSCGKSA-N 0 0 372.812 3.778 20 5 FHBDRN COc1ccc2c(c1)CCC[C@H]2N(C)C(=O)c1ccc([N+](=O)[O-])c(OC)c1 ZINC000511945819 947081481 /nfs/dbraw/zinc/08/14/81/947081481.db2.gz WUCOADVCZWZMHY-QGZVFWFLSA-N 0 0 370.405 3.762 20 5 FHBDRN C[C@H]1C[C@H](CC(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)CC(C)(C)C1 ZINC000444640286 947082537 /nfs/dbraw/zinc/08/25/37/947082537.db2.gz REKAJWVLSXPIAI-QWHCGFSZSA-N 0 0 358.442 3.940 20 5 FHBDRN COc1ccc(CNc2cccc(OC)c2[N+](=O)[O-])cc1Br ZINC000475429176 947083036 /nfs/dbraw/zinc/08/30/36/947083036.db2.gz PJQCPYVEDOEJTR-UHFFFAOYSA-N 0 0 367.199 3.987 20 5 FHBDRN CN(C)c1ccc(NC(=O)NCCc2cccc([N+](=O)[O-])c2)cc1Cl ZINC000759928193 947086392 /nfs/dbraw/zinc/08/63/92/947086392.db2.gz SVEABIUXUJHZKE-UHFFFAOYSA-N 0 0 362.817 3.678 20 5 FHBDRN CCCCOC(=O)c1ccc(OC(=O)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000897269138 947088167 /nfs/dbraw/zinc/08/81/67/947088167.db2.gz YAHXTUMARIUUTQ-UHFFFAOYSA-N 0 0 357.362 3.700 20 5 FHBDRN CC(C)COC[C@H](NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccco1 ZINC000444670251 947095481 /nfs/dbraw/zinc/09/54/81/947095481.db2.gz GGZJQXASACCLGE-INIZCTEOSA-N 0 0 358.398 3.568 20 5 FHBDRN CSc1ccc(C(=O)N(C)Cc2c(F)cccc2F)cc1[N+](=O)[O-] ZINC000511948798 947098968 /nfs/dbraw/zinc/09/89/68/947098968.db2.gz OHIRYRYOMUMYPX-UHFFFAOYSA-N 0 0 352.362 3.867 20 5 FHBDRN CCN(C(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)c1cccc(F)c1 ZINC000049656679 947107782 /nfs/dbraw/zinc/10/77/82/947107782.db2.gz CDWRBRFPBPIVOD-UHFFFAOYSA-N 0 0 354.341 3.586 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N(C)Cc2ccc(F)c(Cl)c2)c1[N+](=O)[O-] ZINC000432287877 947107854 /nfs/dbraw/zinc/10/78/54/947107854.db2.gz XRQMYMODZQJWHG-UHFFFAOYSA-N 0 0 354.769 3.506 20 5 FHBDRN CC[C@@](C)(O)CN(Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)Cc1ccccc1 ZINC000444683974 947108164 /nfs/dbraw/zinc/10/81/64/947108164.db2.gz HESZVGQEQCAMNB-HXUWFJFHSA-N 0 0 368.437 3.634 20 5 FHBDRN C[C@H](c1nc(COCc2ccccc2)no1)c1ccc([N+](=O)[O-])cc1F ZINC000544382439 947113779 /nfs/dbraw/zinc/11/37/79/947113779.db2.gz GZPILFXDGVWLDI-LBPRGKRZSA-N 0 0 357.341 3.986 20 5 FHBDRN Cc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)n1 ZINC000027655581 947114519 /nfs/dbraw/zinc/11/45/19/947114519.db2.gz JXCAIBWAKNFDTA-UHFFFAOYSA-N 0 0 354.410 3.787 20 5 FHBDRN C[C@H](CCNC(=O)c1cc([N+](=O)[O-])ccc1SCCO)c1ccccc1 ZINC000467723431 947123705 /nfs/dbraw/zinc/12/37/05/947123705.db2.gz ORNIPVHAOLODSA-CQSZACIVSA-N 0 0 374.462 3.603 20 5 FHBDRN COc1cccc(F)c1NC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000184518608 947157399 /nfs/dbraw/zinc/15/73/99/947157399.db2.gz POAFUAMWXVVRRL-UHFFFAOYSA-N 0 0 369.146 3.757 20 5 FHBDRN CCOC(=O)[C@@H]1CCN(CCc2ccc([N+](=O)[O-])cc2)c2ccccc21 ZINC000444719423 947160915 /nfs/dbraw/zinc/16/09/15/947160915.db2.gz RAZJREIDEBNJKI-GOSISDBHSA-N 0 0 354.406 3.694 20 5 FHBDRN C[C@H](N[C@@H](c1ccco1)c1ccccc1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000049974190 947179601 /nfs/dbraw/zinc/17/96/01/947179601.db2.gz IADOAGCYFBJMHG-IFXJQAMLSA-N 0 0 365.389 3.894 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H](C)c1csc(CC)n1 ZINC000439870090 947184362 /nfs/dbraw/zinc/18/43/62/947184362.db2.gz LCOFPJVGFPTGQP-JTQLQIEISA-N 0 0 364.427 3.895 20 5 FHBDRN CC(C)N(C)C(=O)[C@@H](C)Sc1ccc(Br)cc1[N+](=O)[O-] ZINC000088501654 947185070 /nfs/dbraw/zinc/18/50/70/947185070.db2.gz TVTOBQJCFYXWHF-SECBINFHSA-N 0 0 361.261 3.705 20 5 FHBDRN C[C@H]1CCc2nc(NC(=O)N3CCc4ccc([N+](=O)[O-])cc4C3)sc2C1 ZINC000408202751 947188598 /nfs/dbraw/zinc/18/85/98/947188598.db2.gz JOSDABZCXYSCID-NSHDSACASA-N 0 0 372.450 3.766 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)NCCc1c[nH]c2ccccc12 ZINC000021182679 947212563 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Cc1csc(Sc2ccc(C(=O)Nc3ncccn3)cc2[N+](=O)[O-])n1 ZINC000021210231 947252550 /nfs/dbraw/zinc/25/25/50/947252550.db2.gz MBMIARSEFNCNFY-UHFFFAOYSA-N 0 0 373.419 3.553 20 5 FHBDRN CC(=O)c1cccc(NC(=O)c2sc(Br)cc2[N+](=O)[O-])c1 ZINC000444848607 947259568 /nfs/dbraw/zinc/25/95/68/947259568.db2.gz MALWMQKQJCVAPL-UHFFFAOYSA-N 0 0 369.196 3.874 20 5 FHBDRN Cc1ccc([C@H](NC(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)c2ccccc2)cc1 ZINC000444849583 947262047 /nfs/dbraw/zinc/26/20/47/947262047.db2.gz NMVMWQDDMBWCPA-GOSISDBHSA-N 0 0 363.373 3.523 20 5 FHBDRN O=C(c1cccc2c(=O)c3ccccc3[nH]c12)N1CCc2ccccc2C1 ZINC000444830510 947262943 /nfs/dbraw/zinc/26/29/43/947262943.db2.gz WNHUEPXWCJTYNX-UHFFFAOYSA-N 0 0 354.409 3.880 20 5 FHBDRN COc1ccc(NC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)cc1OC ZINC000444830794 947262933 /nfs/dbraw/zinc/26/29/33/947262933.db2.gz YKYMSXLLEYLCGZ-UHFFFAOYSA-N 0 0 374.396 3.951 20 5 FHBDRN CCCN(C(=O)c1ccc2nc(C)n(C)c2c1)c1cccc([N+](=O)[O-])c1 ZINC000441436609 947272764 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20 5 FHBDRN Cc1cccc(CN(C)C(=O)c2cccc3c(=O)c4ccccc4[nH]c23)n1 ZINC000445024465 947446532 /nfs/dbraw/zinc/44/65/32/947446532.db2.gz WNGQDHTXGJFBLO-UHFFFAOYSA-N 0 0 357.413 3.657 20 5 FHBDRN CCCC[C@@H]1CCC[C@H]1NC(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000445028034 947450680 /nfs/dbraw/zinc/45/06/80/947450680.db2.gz GUYUKJQFELPZHX-TZMCWYRMSA-N 0 0 359.430 3.629 20 5 FHBDRN O=C(O[C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)[C@H]1CSc2ccccc21 ZINC000759931187 947458212 /nfs/dbraw/zinc/45/82/12/947458212.db2.gz LARVGOVMMAWCPJ-SOUVJXGZSA-N 0 0 373.434 3.708 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N(C)[C@@H](C)Cc1ccccc1C ZINC000445061670 947464356 /nfs/dbraw/zinc/46/43/56/947464356.db2.gz CRNPQBHSGLCKPB-HNNXBMFYSA-N 0 0 371.437 3.684 20 5 FHBDRN O=C(COc1ccccc1[N+](=O)[O-])Nc1ccc(Nc2ccccc2)nc1 ZINC000523673516 947500684 /nfs/dbraw/zinc/50/06/84/947500684.db2.gz LWDGVYADEQFRRT-UHFFFAOYSA-N 0 0 364.361 3.751 20 5 FHBDRN COc1ccccc1[C@@H]1CCCN1c1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1 ZINC000367726364 947507138 /nfs/dbraw/zinc/50/71/38/947507138.db2.gz BYHAQLPKMXPFQU-INIZCTEOSA-N 0 0 366.377 3.594 20 5 FHBDRN Cc1[nH]nc(C(=O)Nc2nc(-c3c(C)cc(C)cc3C)cs2)c1[N+](=O)[O-] ZINC000523684120 947513776 /nfs/dbraw/zinc/51/37/76/947513776.db2.gz OGCSNJZZTBYEEO-UHFFFAOYSA-N 0 0 371.422 3.927 20 5 FHBDRN CCn1c(Sc2ccccc2[N+](=O)[O-])nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000152074685 947520382 /nfs/dbraw/zinc/52/03/82/947520382.db2.gz KTEWFRMNXRVBOD-UHFFFAOYSA-N 0 0 371.378 3.933 20 5 FHBDRN O=C(NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)c1cc(O)ccc1Cl ZINC000508518540 947521779 /nfs/dbraw/zinc/52/17/79/947521779.db2.gz GXAWMFDGAMIPAJ-UHFFFAOYSA-N 0 0 374.702 3.903 20 5 FHBDRN CSCc1ccccc1NC(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000445117761 947526787 /nfs/dbraw/zinc/52/67/87/947526787.db2.gz QFZZFXWTDMASLG-UHFFFAOYSA-N 0 0 371.422 3.656 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)Nc1ccccc1OC(F)F ZINC000128518987 947536691 /nfs/dbraw/zinc/53/66/91/947536691.db2.gz KUNPKLNBXBKRFE-UHFFFAOYSA-N 0 0 361.304 3.859 20 5 FHBDRN O=C(NCCCCC1CCCC1)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000445149357 947540031 /nfs/dbraw/zinc/54/00/31/947540031.db2.gz KKRNUVQWWQXRHY-UHFFFAOYSA-N 0 0 359.430 3.631 20 5 FHBDRN C[C@@H]1CCCC[C@H]1CNC(=O)c1sc(Br)cc1[N+](=O)[O-] ZINC000445169888 947566954 /nfs/dbraw/zinc/56/69/54/947566954.db2.gz AKJFREPKXXUGFF-BDAKNGLRSA-N 0 0 361.261 3.975 20 5 FHBDRN C[C@H]1CCCC[C@@H]1CNC(=O)c1sc(Br)cc1[N+](=O)[O-] ZINC000445169889 947567122 /nfs/dbraw/zinc/56/71/22/947567122.db2.gz AKJFREPKXXUGFF-DTWKUNHWSA-N 0 0 361.261 3.975 20 5 FHBDRN C[C@H]1CCCC[C@H]1CNC(=O)c1sc(Br)cc1[N+](=O)[O-] ZINC000445169890 947567168 /nfs/dbraw/zinc/56/71/68/947567168.db2.gz AKJFREPKXXUGFF-IUCAKERBSA-N 0 0 361.261 3.975 20 5 FHBDRN C[C@@H](c1nnc(-c2ccccc2)o1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088606561 947571572 /nfs/dbraw/zinc/57/15/72/947571572.db2.gz ZEXMGFAVWKKHEL-ZDUSSCGKSA-N 0 0 350.378 3.764 20 5 FHBDRN C[C@@H]1CCC[C@@H](CNC(=O)c2sc(Br)cc2[N+](=O)[O-])C1 ZINC000445189151 947580766 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20 5 FHBDRN Cc1ccccc1[C@@H](C)CC(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000523817392 947635863 /nfs/dbraw/zinc/63/58/63/947635863.db2.gz ZCMMYMDRDUPNKS-KRWDZBQOSA-N 0 0 367.449 3.746 20 5 FHBDRN CCOc1ccccc1-c1noc(COc2ccc([N+](=O)[O-])c(C)c2)n1 ZINC000021481647 947636102 /nfs/dbraw/zinc/63/61/02/947636102.db2.gz WDFBSXSOYQZTFX-UHFFFAOYSA-N 0 0 355.350 3.931 20 5 FHBDRN O=C(N[C@H]1C[C@H]1c1c(F)cccc1F)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000523822297 947640097 /nfs/dbraw/zinc/64/00/97/947640097.db2.gz OLGBYXAJEYXTPY-WBMJQRKESA-N 0 0 373.359 3.733 20 5 FHBDRN COc1ccc(C)cc1NC(=O)c1sc(Br)cc1[N+](=O)[O-] ZINC000445248442 947644919 /nfs/dbraw/zinc/64/49/19/947644919.db2.gz KXSDUXIHAUGMSS-UHFFFAOYSA-N 0 0 371.212 3.988 20 5 FHBDRN Cc1ccc(NC(=O)COC(=O)c2c(C)cccc2[N+](=O)[O-])c(Cl)c1 ZINC000026113661 947655861 /nfs/dbraw/zinc/65/58/61/947655861.db2.gz XCJJPHPFSNGTOZ-UHFFFAOYSA-N 0 0 362.769 3.661 20 5 FHBDRN C[C@@H](C(=O)N(C)Cc1c(F)cccc1F)c1ccc([N+](=O)[O-])cc1F ZINC000511966776 947679581 /nfs/dbraw/zinc/67/95/81/947679581.db2.gz CJXAXTKKPKHHBG-SNVBAGLBSA-N 0 0 352.312 3.774 20 5 FHBDRN C[C@H](CNC(=O)c1cc([N+](=O)[O-])cn1C)c1c(Cl)cccc1Cl ZINC000523857389 947688244 /nfs/dbraw/zinc/68/82/44/947688244.db2.gz LSZVQSMAPWLJLE-SECBINFHSA-N 0 0 356.209 3.774 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CC2(CCC2)[C@H]1c1ccccc1 ZINC000432305727 947690785 /nfs/dbraw/zinc/69/07/85/947690785.db2.gz JQIODHCKFGNLAX-GOSISDBHSA-N 0 0 372.446 3.819 20 5 FHBDRN Cc1c(Cl)cc(S(=O)(=O)NC(C)(C)c2cccs2)cc1[N+](=O)[O-] ZINC000523880576 947705680 /nfs/dbraw/zinc/70/56/80/947705680.db2.gz LJOAKZWEDHYZAQ-UHFFFAOYSA-N 0 0 374.871 3.832 20 5 FHBDRN Cn1c(C(=O)O[C@@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)cc2ccccc21 ZINC000759937123 947709155 /nfs/dbraw/zinc/70/91/55/947709155.db2.gz GVCBULOBGQTYGY-DOTOQJQBSA-N 0 0 368.393 3.624 20 5 FHBDRN CC[C@H](C)COc1cc([N+](=O)[O-])c(COC(=O)C2(C)CC2)cc1OC ZINC000781665124 947710461 /nfs/dbraw/zinc/71/04/61/947710461.db2.gz YBOWQNRFHVIRJB-LBPRGKRZSA-N 0 0 351.399 3.872 20 5 FHBDRN COc1ccc(CNC(=O)N2CCC[C@H](C(C)(C)C)CC2)cc1[N+](=O)[O-] ZINC000523917793 947715218 /nfs/dbraw/zinc/71/52/18/947715218.db2.gz BVUOELAFGOTMRS-HNNXBMFYSA-N 0 0 363.458 3.961 20 5 FHBDRN O=C(Nc1ncc(Cc2ccccc2Cl)s1)c1cc([N+](=O)[O-])c[nH]1 ZINC000053896408 947719217 /nfs/dbraw/zinc/71/92/17/947719217.db2.gz GBWYHGOYSXMYAJ-UHFFFAOYSA-N 0 0 362.798 3.876 20 5 FHBDRN Cc1cc(CNC(=O)c2ccccc2Sc2ccccc2[N+](=O)[O-])on1 ZINC000440722525 947724477 /nfs/dbraw/zinc/72/44/77/947724477.db2.gz QHLFQUFXSKYKNO-UHFFFAOYSA-N 0 0 369.402 3.972 20 5 FHBDRN Cc1c(C[S@@](C)=O)cccc1NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000121555885 947747467 /nfs/dbraw/zinc/74/74/67/947747467.db2.gz CQHBOZKYHLQLBC-DEOSSOPVSA-N 0 0 366.826 3.687 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N2CC[C@H](c3ccccc3)C2)cc1OC ZINC000121558764 947747847 /nfs/dbraw/zinc/74/78/47/947747847.db2.gz XVSBKFBUSRHVII-HNNXBMFYSA-N 0 0 370.405 3.632 20 5 FHBDRN C[C@@H](c1nccs1)N1CCN(Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000184585946 947753090 /nfs/dbraw/zinc/75/30/90/947753090.db2.gz FMIQTNQQUBJXJO-LBPRGKRZSA-N 0 0 366.874 3.584 20 5 FHBDRN Cc1nc(-c2cnn(C)c2)sc1C(=O)Nc1c(C)ccc([N+](=O)[O-])c1C ZINC000129526676 947775293 /nfs/dbraw/zinc/77/52/93/947775293.db2.gz RVYZHYZQRHSQOP-UHFFFAOYSA-N 0 0 371.422 3.629 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NCc1coc(-c2ccccc2)n1 ZINC001126229102 947778505 /nfs/dbraw/zinc/77/85/05/947778505.db2.gz OGKQIBQWFUJLSG-UHFFFAOYSA-N 0 0 351.362 3.797 20 5 FHBDRN CCO[C@@H]1C[C@H](NC(=O)CCc2ccc([N+](=O)[O-])cc2Cl)C12CCC2 ZINC001126229288 947779186 /nfs/dbraw/zinc/77/91/86/947779186.db2.gz MFZHZOZMLIJQEF-JKSUJKDBSA-N 0 0 366.845 3.645 20 5 FHBDRN Cc1ccccc1[C@H]1CN(CCOc2ccc([N+](=O)[O-])cc2)[C@H](C)CO1 ZINC000441472393 947791880 /nfs/dbraw/zinc/79/18/80/947791880.db2.gz XKPZOYOJJCRRPD-OXQOHEQNSA-N 0 0 356.422 3.744 20 5 FHBDRN COc1ccc([C@@H]2CCN(C(=O)Nc3ccc([N+](=O)[O-])c(C)c3)C2)cc1 ZINC000184601182 947803075 /nfs/dbraw/zinc/80/30/75/947803075.db2.gz AWJBXUUMCFPNGT-OAHLLOKOSA-N 0 0 355.394 3.933 20 5 FHBDRN O=[N+]([O-])c1ccc(NC[C@H]2CN(Cc3ccccc3)CCO2)c(Cl)c1 ZINC000015171192 947804754 /nfs/dbraw/zinc/80/47/54/947804754.db2.gz NCCJPJGXBJHFRT-INIZCTEOSA-N 0 0 361.829 3.561 20 5 FHBDRN Cc1ccc(CC(=O)O[C@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)cc1C ZINC000759943552 947831786 /nfs/dbraw/zinc/83/17/86/947831786.db2.gz RYZYUZPKMJDXOI-IRXDYDNUSA-N 0 0 357.410 3.678 20 5 FHBDRN CCOC(=O)CC1(Nc2cccc(OC)c2[N+](=O)[O-])Cc2ccccc2C1 ZINC001167801486 947833840 /nfs/dbraw/zinc/83/38/40/947833840.db2.gz NAPFOIMZDOLZBO-UHFFFAOYSA-N 0 0 370.405 3.506 20 5 FHBDRN Cc1cc(NC(=O)N[C@H](c2ccccc2)[C@@H]2CCCO2)ccc1[N+](=O)[O-] ZINC000184608195 947843653 /nfs/dbraw/zinc/84/36/53/947843653.db2.gz VISWCFCEGIULLW-ZWKOTPCHSA-N 0 0 355.394 3.945 20 5 FHBDRN Cc1ccc(C(=O)NC2CCC(C(=O)OC(C)(C)C)CC2)cc1[N+](=O)[O-] ZINC000094123978 947958488 /nfs/dbraw/zinc/95/84/88/947958488.db2.gz NGVAQJKNEKULDD-UHFFFAOYSA-N 0 0 362.426 3.534 20 5 FHBDRN Cc1ccc([C@H]2CCCCN2C(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)cc1 ZINC001126271011 947961409 /nfs/dbraw/zinc/96/14/09/947961409.db2.gz HMJMPTPJEXAOTN-MRXNPFEDSA-N 0 0 368.389 3.999 20 5 FHBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)N1CCO[C@@H](c2ccccc2Cl)C1 ZINC000728875989 947989236 /nfs/dbraw/zinc/98/92/36/947989236.db2.gz NERZGIXXABZIGU-IEODJVTJSA-N 0 0 372.808 3.862 20 5 FHBDRN CCCCCNC(=O)C1CCN(c2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000432318334 947990801 /nfs/dbraw/zinc/99/08/01/947990801.db2.gz AYWXOYRIIURJJA-UHFFFAOYSA-N 0 0 353.850 3.771 20 5 FHBDRN CN(Cc1ccc([S@](C)=O)cc1)c1ccnc2c1cccc2[N+](=O)[O-] ZINC000432319756 948002440 /nfs/dbraw/zinc/00/24/40/948002440.db2.gz IJMPIYHGCWTMAZ-VWLOTQADSA-N 0 0 355.419 3.517 20 5 FHBDRN CCS[C@H](C(=O)O[C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1)C(C)C ZINC000759944418 948004051 /nfs/dbraw/zinc/00/40/51/948004051.db2.gz GKXNUEPNOHUVOJ-IPYPFGDCSA-N 0 0 355.460 3.596 20 5 FHBDRN CC(C)(CCC(=O)OCc1cc(F)c(C(F)(F)F)cc1F)[N+](=O)[O-] ZINC000837925900 948010577 /nfs/dbraw/zinc/01/05/77/948010577.db2.gz AVQIZLDQGBJZKM-UHFFFAOYSA-N 0 0 355.259 3.862 20 5 FHBDRN CCc1nn(C)c(N[C@@H](C)c2ccc(SCCOC)cc2)c1[N+](=O)[O-] ZINC000094155876 948015955 /nfs/dbraw/zinc/01/59/55/948015955.db2.gz ACFOYJWNDOVPRD-LBPRGKRZSA-N 0 0 364.471 3.802 20 5 FHBDRN COC(=O)COc1ccc(CNc2ccc3ccoc3c2)cc1[N+](=O)[O-] ZINC000473990211 948027786 /nfs/dbraw/zinc/02/77/86/948027786.db2.gz OAALAZHLQBZLQN-UHFFFAOYSA-N 0 0 356.334 3.505 20 5 FHBDRN CCc1nn(C)c(N2CCC[C@H](c3nc(C(C)C)cs3)C2)c1[N+](=O)[O-] ZINC000094167894 948028282 /nfs/dbraw/zinc/02/82/82/948028282.db2.gz OOYASVBDUHJXHV-LBPRGKRZSA-N 0 0 363.487 3.855 20 5 FHBDRN C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCc2ccc(Cl)cc2C1 ZINC000536416488 948033776 /nfs/dbraw/zinc/03/37/76/948033776.db2.gz JRLHCKLHILQILJ-GFCCVEGCSA-N 0 0 359.813 3.634 20 5 FHBDRN CC(C)n1cc(Br)cc1C(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000314955309 948053238 /nfs/dbraw/zinc/05/32/38/948053238.db2.gz WLNJUQYZWAKJHZ-UHFFFAOYSA-N 0 0 366.215 3.670 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCN([C@@H](C)c2nccs2)CC1 ZINC000184644283 948060755 /nfs/dbraw/zinc/06/07/55/948060755.db2.gz MVWARZGECNHRNW-GJZGRUSLSA-N 0 0 360.483 3.800 20 5 FHBDRN O=C1C[C@H](CNc2c(Cl)cccc2[N+](=O)[O-])CN1Cc1ccccc1 ZINC000432325776 948062667 /nfs/dbraw/zinc/06/26/67/948062667.db2.gz NBLKYQXWHWZFDU-CQSZACIVSA-N 0 0 359.813 3.709 20 5 FHBDRN COc1cc(C(=O)N2CCSC[C@H]2c2cccs2)ccc1[N+](=O)[O-] ZINC000075351645 948078418 /nfs/dbraw/zinc/07/84/18/948078418.db2.gz LLABVXQXKOEIPE-ZDUSSCGKSA-N 0 0 364.448 3.595 20 5 FHBDRN COC(=O)c1cc(CNc2ccnc3c2cccc3[N+](=O)[O-])ccc1OC ZINC000432326833 948079323 /nfs/dbraw/zinc/07/93/23/948079323.db2.gz QYPSUMVWKJGFGP-UHFFFAOYSA-N 0 0 367.361 3.550 20 5 FHBDRN Nc1c(F)c(N2CCC[C@@H](c3nc4ccccc4o3)C2)ccc1[N+](=O)[O-] ZINC000613919387 948090770 /nfs/dbraw/zinc/09/07/70/948090770.db2.gz QBGYSPUMQZLQHZ-LLVKDONJSA-N 0 0 356.357 3.841 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)Nc1ccc(C(F)(F)F)nc1 ZINC000536430743 948109781 /nfs/dbraw/zinc/10/97/81/948109781.db2.gz BVYISGMZTAYIMO-UHFFFAOYSA-N 0 0 364.283 3.602 20 5 FHBDRN CSc1ccc(C(=O)Oc2ccc3c(c2)OC(=O)C[C@H]3C)cc1[N+](=O)[O-] ZINC000785362356 948126763 /nfs/dbraw/zinc/12/67/63/948126763.db2.gz LPIUYESNGWLKED-SNVBAGLBSA-N 0 0 373.386 3.949 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1)c1ccc(OCC(F)(F)C(F)F)nc1 ZINC000511996251 948138980 /nfs/dbraw/zinc/13/89/80/948138980.db2.gz GNHFNDOCUWQFGJ-UHFFFAOYSA-N 0 0 373.262 3.521 20 5 FHBDRN CC1(C)CN(C(=O)c2cc(F)cc([N+](=O)[O-])c2)C[C@]2(C[C@@H]3CC[C@H]2C3)O1 ZINC000507770358 948154064 /nfs/dbraw/zinc/15/40/64/948154064.db2.gz LLMGSLMKEWMYRH-UHYGZKCKSA-N 0 0 362.401 3.544 20 5 FHBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)Nc1c(O)cccc1F ZINC000585701374 948184038 /nfs/dbraw/zinc/18/40/38/948184038.db2.gz GDZLSJDOVKTQFU-UHFFFAOYSA-N 0 0 369.146 3.763 20 5 FHBDRN CN(CCc1ccccc1)c1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1 ZINC000520517173 948218747 /nfs/dbraw/zinc/21/87/47/948218747.db2.gz IGMVNNDYLISVEO-UHFFFAOYSA-N 0 0 353.422 3.510 20 5 FHBDRN CCNc1ccc(C(=O)Nc2nccc(-c3ccccc3)n2)cc1[N+](=O)[O-] ZINC000585709535 948227089 /nfs/dbraw/zinc/22/70/89/948227089.db2.gz XKYFNYCKDPCSPR-UHFFFAOYSA-N 0 0 363.377 3.736 20 5 FHBDRN O=C(CSc1nc2ccccc2s1)NCCc1cccc([N+](=O)[O-])c1 ZINC000125936321 948227951 /nfs/dbraw/zinc/22/79/51/948227951.db2.gz JGWJEEGAHMIZFF-UHFFFAOYSA-N 0 0 373.459 3.656 20 5 FHBDRN CC(C)(CC(=O)NCc1ccc([N+](=O)[O-])cc1)CC(=O)c1ccccc1 ZINC000441539463 948236063 /nfs/dbraw/zinc/23/60/63/948236063.db2.gz IKTPIQVUNCUMOX-UHFFFAOYSA-N 0 0 354.406 3.900 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)N(C)C(C)(C)c2ccccc2)cc1C ZINC000585740158 948246332 /nfs/dbraw/zinc/24/63/32/948246332.db2.gz JINFPWNGMWUTPM-UHFFFAOYSA-N 0 0 362.451 3.767 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1nc2c(s1)CCCCCC2 ZINC000427593515 948253352 /nfs/dbraw/zinc/25/33/52/948253352.db2.gz KXPJCSCDZSPIDC-UHFFFAOYSA-N 0 0 361.423 3.971 20 5 FHBDRN O=C(Nc1cc2c(cc1F)NC(=O)CC2)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000163042496 948263422 /nfs/dbraw/zinc/26/34/22/948263422.db2.gz WAXHXDBAWJCKBV-UHFFFAOYSA-N 0 0 363.732 3.524 20 5 FHBDRN Cc1ccc([C@H]2C[C@@H](C)N(S(=O)(=O)c3cccc([N+](=O)[O-])c3C)C2)cc1 ZINC001211698935 948270236 /nfs/dbraw/zinc/27/02/36/948270236.db2.gz BFMUEMGISAUWTB-PBHICJAKSA-N 0 0 374.462 3.778 20 5 FHBDRN CC(C)C(NC(=O)C(=O)Nc1ccc(C(C)(C)C)c([N+](=O)[O-])c1)C(C)C ZINC000585760725 948270330 /nfs/dbraw/zinc/27/03/30/948270330.db2.gz HVDWVIVKZKYBTP-UHFFFAOYSA-N 0 0 363.458 3.628 20 5 FHBDRN O=C(Nc1cc(Cl)cc(F)c1F)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000441565014 948272979 /nfs/dbraw/zinc/27/29/79/948272979.db2.gz BFYMHJRALWJBAU-UHFFFAOYSA-N 0 0 356.668 3.507 20 5 FHBDRN C[C@H](NC(=O)Cc1cscc1Br)c1cccc([N+](=O)[O-])c1 ZINC000432383837 948294982 /nfs/dbraw/zinc/29/49/82/948294982.db2.gz BKOHAXYIZJILQS-VIFPVBQESA-N 0 0 369.240 3.839 20 5 FHBDRN Cc1cccc(NC(=O)[C@H](C)OC(=O)c2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000005508605 948328552 /nfs/dbraw/zinc/32/85/52/948328552.db2.gz OIZXFEMADNZLJM-NSHDSACASA-N 0 0 362.769 3.741 20 5 FHBDRN Cc1c(Cl)cc(F)c(NC(=O)CN(C)c2ccccc2[N+](=O)[O-])c1F ZINC000536443203 948349528 /nfs/dbraw/zinc/34/95/28/948349528.db2.gz ZSUIDWBUFVYXQQ-UHFFFAOYSA-N 0 0 369.755 3.910 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCc1ccnc(OC(C)C)c1 ZINC000129573663 948365713 /nfs/dbraw/zinc/36/57/13/948365713.db2.gz VZCQNPVKUFGKBG-UHFFFAOYSA-N 0 0 358.398 3.716 20 5 FHBDRN COc1cc2c(cc1F)CC[C@@H]2NC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000512087885 948391333 /nfs/dbraw/zinc/39/13/33/948391333.db2.gz HCTCNFYVYCEITI-GTNSWQLSSA-N 0 0 373.384 3.790 20 5 FHBDRN COc1ccc(NC(=O)N[C@H]2CCCc3ccc(F)cc32)cc1[N+](=O)[O-] ZINC000432428151 948396905 /nfs/dbraw/zinc/39/69/05/948396905.db2.gz IQTXTKKIGVJXHF-HNNXBMFYSA-N 0 0 359.357 3.942 20 5 FHBDRN O=[N+]([O-])c1ccc(F)cc1CSc1cccc(Cl)c1-c1nn[nH]n1 ZINC000826498378 948413317 /nfs/dbraw/zinc/41/33/17/948413317.db2.gz SETODZNNAIHNJH-UHFFFAOYSA-N 0 0 365.777 3.860 20 5 FHBDRN CCON(CC1CCCCC1)C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC001299176640 948420118 /nfs/dbraw/zinc/42/01/18/948420118.db2.gz JFRMZTQSSNCWLA-UHFFFAOYSA-N 0 0 359.426 3.979 20 5 FHBDRN O=[N+]([O-])c1cccc(F)c1OC[C@@H](O)Cc1ccc(C(F)(F)F)cc1 ZINC000184777460 948428398 /nfs/dbraw/zinc/42/83/98/948428398.db2.gz WGWYTSUHKVBEMG-LBPRGKRZSA-N 0 0 359.275 3.735 20 5 FHBDRN C[C@@H](CC(C)(C)c1ccccc1)NS(=O)(=O)c1ccc([N+](=O)[O-])s1 ZINC000520629019 948443591 /nfs/dbraw/zinc/44/35/91/948443591.db2.gz QFUVBCQSSRLQOI-LBPRGKRZSA-N 0 0 368.480 3.691 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[C@@](C)(c2ccc(F)cc2)C1 ZINC000432450206 948456028 /nfs/dbraw/zinc/45/60/28/948456028.db2.gz WZIMGTNQKJJAJE-LJQANCHMSA-N 0 0 373.384 3.938 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1CCC[C@@H]1Cc1ccc(F)cc1 ZINC000427610267 948458397 /nfs/dbraw/zinc/45/83/97/948458397.db2.gz UAGBLKGDOQZQRZ-OAHLLOKOSA-N 0 0 358.369 3.590 20 5 FHBDRN C[C@H](C(=O)Oc1ccc2c(c1)OC(=O)C[C@@H]2C)c1cccc([N+](=O)[O-])c1 ZINC000785375133 948468196 /nfs/dbraw/zinc/46/81/96/948468196.db2.gz IHXQESDMFXIVTI-RYUDHWBXSA-N 0 0 355.346 3.717 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)NC(C)(C)c2ccccc2)cc1OC ZINC000520651986 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374.871 3.566 20 5 FHBDRN Cc1ccc(NC(=O)NCCc2cccc(C(F)(F)F)n2)cc1[N+](=O)[O-] ZINC000432483726 948551505 /nfs/dbraw/zinc/55/15/05/948551505.db2.gz QKWFOUNHUVUSFF-UHFFFAOYSA-N 0 0 368.315 3.681 20 5 FHBDRN CC1(C)C[C@@H](NCc2ncnn2-c2ccccc2)c2cc([N+](=O)[O-])ccc21 ZINC000279146001 948556024 /nfs/dbraw/zinc/55/60/24/948556024.db2.gz SGCZIIXSSOREAB-GOSISDBHSA-N 0 0 363.421 3.688 20 5 FHBDRN CCOC(=O)c1ccccc1N(C)C(=O)c1cc(SC)ccc1[N+](=O)[O-] ZINC000520681628 948575279 /nfs/dbraw/zinc/57/52/79/948575279.db2.gz QRKLSXGCLQKUHJ-UHFFFAOYSA-N 0 0 374.418 3.770 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1cccc(-c2cn3cccnc3n2)c1 ZINC000520684826 948582640 /nfs/dbraw/zinc/58/26/40/948582640.db2.gz XYIFDIUFNDLDAG-UHFFFAOYSA-N 0 0 373.372 3.865 20 5 FHBDRN CCOc1ccc(CNC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)cc1F ZINC000520690474 948589730 /nfs/dbraw/zinc/58/97/30/948589730.db2.gz ORGJUHPWHRVLAH-UHFFFAOYSA-N 0 0 357.341 3.544 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N(C)[C@H]1CCCC[C@H]1C(F)(F)F ZINC000485067776 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ZINC000006235737 210085313 /nfs/dbraw/zinc/08/53/13/210085313.db2.gz WXEZIAGBCPRRRN-UHFFFAOYSA-N 0 0 369.377 3.516 20 5 FHBDRN Cc1nn(CC(=O)N[C@@H](C)c2ccc(Cl)c(Cl)c2)c(C)c1[N+](=O)[O-] ZINC000004548771 210081391 /nfs/dbraw/zinc/08/13/91/210081391.db2.gz OVWJBJHDNYHXNS-QMMMGPOBSA-N 0 0 371.224 3.592 20 5 FHBDRN O=[N+]([O-])c1c(N2CCC(COc3ccccc3)CC2)nc2sccn21 ZINC000054981382 210068099 /nfs/dbraw/zinc/06/80/99/210068099.db2.gz NIEKVIWJHVEYSL-UHFFFAOYSA-N 0 0 358.423 3.599 20 5 FHBDRN COc1ccc(C(=O)Nc2ccc(Br)c(C)c2)cc1[N+](=O)[O-] ZINC000005540261 219687922 /nfs/dbraw/zinc/68/79/22/219687922.db2.gz VRFNVZJOIZZIDW-UHFFFAOYSA-N 0 0 365.183 3.927 20 5 FHBDRN CSc1nc(C)c(CCC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)c(C)n1 ZINC000055466034 211949928 /nfs/dbraw/zinc/94/99/28/211949928.db2.gz YKJLHERIZGABHT-LLVKDONJSA-N 0 0 374.466 3.534 20 5 FHBDRN CCc1cccc(NC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)c1 ZINC000052936584 211913825 /nfs/dbraw/zinc/91/38/25/211913825.db2.gz DVMGDTWUAHZRJG-UHFFFAOYSA-N 0 0 350.378 3.810 20 5 FHBDRN CCN(Cc1cccc(NC(=O)c2ccc(C)c([N+](=O)[O-])c2)c1)C(C)=O ZINC000027037990 211457824 /nfs/dbraw/zinc/45/78/24/211457824.db2.gz SFMYXPVOOIMOJZ-UHFFFAOYSA-N 0 0 355.394 3.524 20 5 FHBDRN C[C@@H](NC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2)c1cccc2ccccc21 ZINC000025387135 211430822 /nfs/dbraw/zinc/43/08/22/211430822.db2.gz UQOCNVYCPZLACT-GFCCVEGCSA-N 0 0 364.357 3.968 20 5 FHBDRN COc1cc(C(=O)N[C@H](C)c2ccccc2Cl)c([N+](=O)[O-])cc1OC ZINC000023654160 211393164 /nfs/dbraw/zinc/39/31/64/211393164.db2.gz NBQIGMONBMTJMJ-SNVBAGLBSA-N 0 0 364.785 3.756 20 5 FHBDRN O=C(NCCOc1ccc(Cl)cc1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000021931190 211330583 /nfs/dbraw/zinc/33/05/83/211330583.db2.gz BGUMFXBURNZZPY-UHFFFAOYSA-N 0 0 355.177 3.710 20 5 FHBDRN O=C(CSc1ccc(C(F)(F)F)cn1)Nc1cccc([N+](=O)[O-])c1 ZINC000021635748 211318480 /nfs/dbraw/zinc/31/84/80/211318480.db2.gz KMHLDJAMXIKSBR-UHFFFAOYSA-N 0 0 357.313 3.739 20 5 FHBDRN C[C@@H](Oc1ccccc1Br)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000021126267 211307022 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Cc1c([N+](=O)[O-])cc(C(=O)Nc2nc3ccccc3s2)cc1[N+](=O)[O-] ZINC000005749148 210640293 /nfs/dbraw/zinc/64/02/93/210640293.db2.gz NABKRTTWXRJUCP-UHFFFAOYSA-N 0 0 358.335 3.673 20 5 FHBDRN COc1ccc2[nH]cc(CCNc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])c2c1 ZINC000005141301 210603239 /nfs/dbraw/zinc/60/32/39/210603239.db2.gz ODQMCTXUHFTMIE-UHFFFAOYSA-N 0 0 356.338 3.648 20 5 FHBDRN Cc1nc(S[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)oc1C ZINC000055237235 221063449 /nfs/dbraw/zinc/06/34/49/221063449.db2.gz KWUFIGBLZTZNBK-SECBINFHSA-N 0 0 355.803 3.972 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)Nc2cccc(Br)c2)c1 ZINC000067294948 221250820 /nfs/dbraw/zinc/25/08/20/221250820.db2.gz MSKLHGMNYBXKLD-UHFFFAOYSA-N 0 0 351.156 3.618 20 5 FHBDRN O=[N+]([O-])c1ccc(NCc2cccnc2N2CCCCC2)c([N+](=O)[O-])c1 ZINC000109218813 132244679 /nfs/dbraw/zinc/24/46/79/132244679.db2.gz MHURNQYJAKTMSY-UHFFFAOYSA-N 0 0 357.370 3.500 20 5 FHBDRN O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CCN(Cc2ccccc2)CC1 ZINC000068838917 132376657 /nfs/dbraw/zinc/37/66/57/132376657.db2.gz UZMLFPPGLJGZAT-UHFFFAOYSA-N 0 0 365.355 3.936 20 5 FHBDRN Cc1ccc2c(c1)CCCN2C(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000045765950 132952120 /nfs/dbraw/zinc/95/21/20/132952120.db2.gz HDODMQQNAGEVGV-UHFFFAOYSA-N 0 0 362.389 3.682 20 5 FHBDRN C[C@H](CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1)c1ccc(F)cc1 ZINC000041110870 136120800 /nfs/dbraw/zinc/12/08/00/136120800.db2.gz UUMAFMUVIDMDJD-OAHLLOKOSA-N 0 0 371.412 3.576 20 5 FHBDRN C[C@H]1CCN(C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)c2ccccc21 ZINC000041968508 136121102 /nfs/dbraw/zinc/12/11/02/136121102.db2.gz QNCWTRQZCDSTDF-AWEZNQCLSA-N 0 0 362.389 3.935 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCN(Cc3coc(-c4ccccc4)n3)CC2)cc1 ZINC000066864750 136136950 /nfs/dbraw/zinc/13/69/50/136136950.db2.gz SCLSWPKGCLBMIV-UHFFFAOYSA-N 0 0 364.405 3.572 20 5 FHBDRN CCC(CC)C(=O)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000079457565 136151058 /nfs/dbraw/zinc/15/10/58/136151058.db2.gz XEYAWPLVNQXZEM-UHFFFAOYSA-N 0 0 373.375 3.698 20 5 FHBDRN COC(=O)c1cc(C(=O)N2CCC[C@H]2c2ccc(C)cc2)cc([N+](=O)[O-])c1 ZINC000105729701 222373803 /nfs/dbraw/zinc/37/38/03/222373803.db2.gz ACEJGGZTLDIPKY-SFHVURJKSA-N 0 0 368.389 3.667 20 5 FHBDRN COC(=O)c1cc(C(=O)N[C@H](c2ccccc2)C(C)(C)C)cc([N+](=O)[O-])c1 ZINC000106217839 222385070 /nfs/dbraw/zinc/38/50/70/222385070.db2.gz GYJAGXSPMAIHGL-QGZVFWFLSA-N 0 0 370.405 3.899 20 5 FHBDRN CCn1c(SCc2cccc(C)n2)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000481364928 567822737 /nfs/dbraw/zinc/82/27/37/567822737.db2.gz CISBNPGIISXJHX-UHFFFAOYSA-N 0 0 355.423 3.869 20 5 FHBDRN COCCOc1cc(C)ccc1NC(=O)Nc1ccc([N+](=O)[O-])cc1F ZINC000541786389 567823424 /nfs/dbraw/zinc/82/34/24/567823424.db2.gz OHSBPNUTMNGVOD-UHFFFAOYSA-N 0 0 363.345 3.712 20 5 FHBDRN O=C([C@@H]1CC12CCSCC2)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452869533 567834187 /nfs/dbraw/zinc/83/41/87/567834187.db2.gz RCTBUAJUWAINRP-WBVHZDCISA-N 0 0 360.479 3.834 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)ccn1 ZINC000452867099 567835880 /nfs/dbraw/zinc/83/58/80/567835880.db2.gz YBVDREPJIIDZKN-KRWDZBQOSA-N 0 0 369.421 3.797 20 5 FHBDRN O=C([C@H]1CC12CCSCC2)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452869527 567837465 /nfs/dbraw/zinc/83/74/65/567837465.db2.gz RCTBUAJUWAINRP-DOTOQJQBSA-N 0 0 360.479 3.834 20 5 FHBDRN CCCCn1nnnc1COc1ccc([N+](=O)[O-])cc1-c1cccs1 ZINC000025592791 567841053 /nfs/dbraw/zinc/84/10/53/567841053.db2.gz NGIHIDWRDACUGH-UHFFFAOYSA-N 0 0 359.411 3.689 20 5 FHBDRN CCCO[C@H]1CCCN(c2nnc(-c3ccc([N+](=O)[O-])cc3)n2CC)CC1 ZINC000290940116 567868597 /nfs/dbraw/zinc/86/85/97/567868597.db2.gz FNAMULODNXHDIU-KRWDZBQOSA-N 0 0 373.457 3.659 20 5 FHBDRN CC[C@H](CNC(=O)NCc1ccc(OC)c([N+](=O)[O-])c1)c1ccccc1 ZINC000521407412 567871705 /nfs/dbraw/zinc/87/17/05/567871705.db2.gz DUPYPWPEPHOOEP-OAHLLOKOSA-N 0 0 357.410 3.596 20 5 FHBDRN O=C(c1cnc2ccccc2n1)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452876766 567874240 /nfs/dbraw/zinc/87/42/40/567874240.db2.gz LSPTYBSCMWKBOI-OAHLLOKOSA-N 0 0 362.389 3.558 20 5 FHBDRN O=C(COc1cccc(F)c1)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452879909 567876160 /nfs/dbraw/zinc/87/61/60/567876160.db2.gz NNFZBACURVHBKC-OAHLLOKOSA-N 0 0 358.369 3.519 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2nnc(N3CCc4ccsc4C3)n2C2CC2)cc1 ZINC000568104224 567885691 /nfs/dbraw/zinc/88/56/91/567885691.db2.gz HGWQPMMKNHFMFH-UHFFFAOYSA-N 0 0 367.434 3.812 20 5 FHBDRN Cc1cccc(OCC(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000452884461 567896032 /nfs/dbraw/zinc/89/60/32/567896032.db2.gz QBHPEZFQSFAEQZ-QGZVFWFLSA-N 0 0 354.406 3.688 20 5 FHBDRN CS(=O)(=O)c1ccc(N[C@@H]2CCc3sc(Cl)cc32)c([N+](=O)[O-])c1 ZINC000568123972 567900387 /nfs/dbraw/zinc/90/03/87/567900387.db2.gz JDXWMJZHQBCCFC-SNVBAGLBSA-N 0 0 372.855 3.813 20 5 FHBDRN CC(C)[C@H]1C[C@H](CNC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CCO1 ZINC000452891674 567911193 /nfs/dbraw/zinc/91/11/93/567911193.db2.gz OOOLWEYNMMHXEY-IUODEOHRSA-N 0 0 362.451 3.991 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)N1CCCn2c(cc3ccccc32)C1 ZINC000481437895 567938489 /nfs/dbraw/zinc/93/84/89/567938489.db2.gz HQJGMTIPGPYHQA-UHFFFAOYSA-N 0 0 350.378 3.987 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NS(=O)(=O)c1ccc2c(c1)C(=O)CCC2 ZINC000290995868 567944556 /nfs/dbraw/zinc/94/45/56/567944556.db2.gz UOXXXHKOHVSGFS-UHFFFAOYSA-N 0 0 374.418 3.531 20 5 FHBDRN CC[C@H]1[C@@H](CO)CCN1C(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000452924197 567959621 /nfs/dbraw/zinc/95/96/21/567959621.db2.gz KTWXIPVWQFGHPC-QAPCUYQASA-N 0 0 369.421 3.571 20 5 FHBDRN Cc1ccc(OC[C@H](O)Cn2ccnc2-c2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000051451941 567961039 /nfs/dbraw/zinc/96/10/39/567961039.db2.gz LAIZORMMZRCTPR-GOSISDBHSA-N 0 0 367.405 3.515 20 5 FHBDRN Cc1c(CNC(=O)c2ncoc2-c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000481465694 567965574 /nfs/dbraw/zinc/96/55/74/567965574.db2.gz LJANILYLIIFIMO-UHFFFAOYSA-N 0 0 355.325 3.627 20 5 FHBDRN Cc1c(CNC(=O)c2ccc(N3CCCC3)c(F)c2)cccc1[N+](=O)[O-] ZINC000481471114 567965807 /nfs/dbraw/zinc/96/58/07/567965807.db2.gz FEALIZRMKAKNOY-UHFFFAOYSA-N 0 0 357.385 3.573 20 5 FHBDRN Cc1c(CNC(=O)c2cnn(-c3ccc(Cl)cc3)c2)cccc1[N+](=O)[O-] ZINC000481468946 567967644 /nfs/dbraw/zinc/96/76/44/567967644.db2.gz ULOCDBMMHRDYMY-UHFFFAOYSA-N 0 0 370.796 3.672 20 5 FHBDRN COc1ccc(S[C@H](C)c2nc(CCC(C)(C)[N+](=O)[O-])no2)cc1 ZINC000291073741 568000397 /nfs/dbraw/zinc/00/03/97/568000397.db2.gz MFACBUJNTMDQST-LLVKDONJSA-N 0 0 351.428 3.919 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)Nc1cc(F)ccc1OC(F)F ZINC000159217284 568008174 /nfs/dbraw/zinc/00/81/74/568008174.db2.gz VYABSWWXIVJXGA-UHFFFAOYSA-N 0 0 354.284 3.907 20 5 FHBDRN Cc1oc(-c2cccs2)nc1Cc1nc(CCC(C)(C)[N+](=O)[O-])no1 ZINC000291080223 568011323 /nfs/dbraw/zinc/01/13/23/568011323.db2.gz NHHBWEKQBXVTDE-UHFFFAOYSA-N 0 0 362.411 3.673 20 5 FHBDRN CN(C)[C@@H](CNC(=O)c1cc(Cl)cc(Cl)c1[N+](=O)[O-])c1ccco1 ZINC000291080204 568011773 /nfs/dbraw/zinc/01/17/73/568011773.db2.gz GMRVBXUHRICASZ-LBPRGKRZSA-N 0 0 372.208 3.527 20 5 FHBDRN CCOc1cc(O)ccc1NC(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000481528684 568015339 /nfs/dbraw/zinc/01/53/39/568015339.db2.gz MWCWHJWFJZAHFM-NSHDSACASA-N 0 0 362.407 3.818 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(OCC(=O)Nc2cccc(Cl)c2Cl)n1 ZINC000568313319 568019321 /nfs/dbraw/zinc/01/93/21/568019321.db2.gz IWAFEUJGPKBKRR-UHFFFAOYSA-N 0 0 370.192 3.931 20 5 FHBDRN Cc1ccc([C@H](C)NS(=O)(=O)Cc2cccc(Cl)c2)cc1[N+](=O)[O-] ZINC000568317599 568023852 /nfs/dbraw/zinc/02/38/52/568023852.db2.gz BLWXDTLVONAAEQ-LBPRGKRZSA-N 0 0 368.842 3.737 20 5 FHBDRN Cc1c(CNC(=O)NCCc2ccc(OC(C)C)cc2)cccc1[N+](=O)[O-] ZINC000568461968 568040246 /nfs/dbraw/zinc/04/02/46/568040246.db2.gz ZMIYWSXOVFDXIT-UHFFFAOYSA-N 0 0 371.437 3.732 20 5 FHBDRN Cc1ocnc1-c1noc(-c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)n1 ZINC000568470575 568041514 /nfs/dbraw/zinc/04/15/14/568041514.db2.gz LFIVXNDFATVSKO-UHFFFAOYSA-N 0 0 369.381 3.845 20 5 FHBDRN CC[C@@H](N[C@H](Cc1ccc(C)cc1)C(=O)OC)c1cccc([N+](=O)[O-])c1 ZINC000481578067 568059200 /nfs/dbraw/zinc/05/92/00/568059200.db2.gz BTHAMHQWEQGOLU-RTBURBONSA-N 0 0 356.422 3.728 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N(C)Cc1cnn(CC)c1 ZINC000541880648 568061161 /nfs/dbraw/zinc/06/11/61/568061161.db2.gz YMJGZFIDPZFUMG-UHFFFAOYSA-N 0 0 362.455 3.586 20 5 FHBDRN CC(C)(CCc1noc(/C=C/c2c(Cl)nc3sccn23)n1)[N+](=O)[O-] ZINC000291140804 568063228 /nfs/dbraw/zinc/06/32/28/568063228.db2.gz XVHFXRLHARXDCR-ONEGZZNKSA-N 0 0 367.818 3.591 20 5 FHBDRN COC(=O)c1cc(NC(=O)c2ccc([N+](=O)[O-])cc2C)cc(Cl)c1F ZINC000481611771 568064968 /nfs/dbraw/zinc/06/49/68/568064968.db2.gz SHENHPUGYNEXSS-UHFFFAOYSA-N 0 0 366.732 3.735 20 5 FHBDRN O=C(Nc1c2c(ccc1F)OCO2)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000603152166 568065015 /nfs/dbraw/zinc/06/50/15/568065015.db2.gz CDJVRFZWLQAWOT-UHFFFAOYSA-N 0 0 373.340 3.659 20 5 FHBDRN O=C(NC[C@H]1CCO[C@@H]1c1ccccc1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000481613405 568068689 /nfs/dbraw/zinc/06/86/89/568068689.db2.gz IUSLUCZMRVFORE-CXAGYDPISA-N 0 0 360.797 3.756 20 5 FHBDRN O=C(NC[C@H]1CCC2(CCCCC2)O1)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000481631911 568070484 /nfs/dbraw/zinc/07/04/84/568070484.db2.gz UYQUAUDRZXOZKE-CQSZACIVSA-N 0 0 369.421 3.755 20 5 FHBDRN O=C(NCCc1c[nH]c2cc(Cl)cc(Cl)c12)c1ccc([N+](=O)[O-])o1 ZINC000481641449 568075046 /nfs/dbraw/zinc/07/50/46/568075046.db2.gz MWYQPOVQIHYDKW-UHFFFAOYSA-N 0 0 368.176 3.948 20 5 FHBDRN O=C(Nc1ccc(Cl)cc1)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000051559825 568079951 /nfs/dbraw/zinc/07/99/51/568079951.db2.gz FPYFSAUVSMAKIW-UHFFFAOYSA-N 0 0 360.801 3.602 20 5 FHBDRN O=C(Nc1ccnn1-c1ccc([N+](=O)[O-])cc1)[C@H]1C[C@H]1c1ccc(F)cc1 ZINC000068103696 568086309 /nfs/dbraw/zinc/08/63/09/568086309.db2.gz BVFMUSIVFMQCNW-IRXDYDNUSA-N 0 0 366.352 3.662 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)NCc1cccc(OC(F)F)c1 ZINC000051582221 568090052 /nfs/dbraw/zinc/09/00/52/568090052.db2.gz ASUYYYDTFBWQFB-UHFFFAOYSA-N 0 0 367.308 3.527 20 5 FHBDRN CN(Cc1ccc(F)cc1Br)C(=O)c1ccccc1[N+](=O)[O-] ZINC000481710049 568091031 /nfs/dbraw/zinc/09/10/31/568091031.db2.gz XBXKLWKXCUCSJG-UHFFFAOYSA-N 0 0 367.174 3.769 20 5 FHBDRN COc1cc(OC[C@@H](O)Cc2ccc3ccccc3c2)ccc1[N+](=O)[O-] ZINC000481702484 568092135 /nfs/dbraw/zinc/09/21/35/568092135.db2.gz HVVHSLSRXUESFX-KRWDZBQOSA-N 0 0 353.374 3.739 20 5 FHBDRN COc1cc(OC[C@@H](O)Cc2ccccc2C(F)(F)F)ccc1[N+](=O)[O-] ZINC000481700159 568092278 /nfs/dbraw/zinc/09/22/78/568092278.db2.gz BIKATOZGQSZTKE-LBPRGKRZSA-N 0 0 371.311 3.605 20 5 FHBDRN O=c1c(Cl)cc([N+](=O)[O-])cn1Cc1csc(-c2ccsc2)n1 ZINC000481759251 568114117 /nfs/dbraw/zinc/11/41/17/568114117.db2.gz FUNSFSPLLHKLST-UHFFFAOYSA-N 0 0 353.812 3.643 20 5 FHBDRN C[C@]1(NC(=O)c2cc(Cl)cc(Cl)c2[N+](=O)[O-])CCO[C@@H]1C1CC1 ZINC000291344406 568118572 /nfs/dbraw/zinc/11/85/72/568118572.db2.gz ABDFOPKFYKPHDJ-HIFRSBDPSA-N 0 0 359.209 3.589 20 5 FHBDRN O=C(Nc1ccc2c(c1)OCCO2)c1c([N+](=O)[O-])cccc1C(F)(F)F ZINC000568681924 568120513 /nfs/dbraw/zinc/12/05/13/568120513.db2.gz FPPAQBKMAYUOGA-UHFFFAOYSA-N 0 0 368.267 3.637 20 5 FHBDRN C[C@]1(NC(=O)c2cc(Cl)cc(Cl)c2[N+](=O)[O-])CCO[C@H]1C1CC1 ZINC000291344414 568121173 /nfs/dbraw/zinc/12/11/73/568121173.db2.gz ABDFOPKFYKPHDJ-ZFWWWQNUSA-N 0 0 359.209 3.589 20 5 FHBDRN CN(CCC1CCOCC1)C(=O)c1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000291349102 568121451 /nfs/dbraw/zinc/12/14/51/568121451.db2.gz NTDSVMKRIGXJRG-UHFFFAOYSA-N 0 0 361.225 3.790 20 5 FHBDRN CCOc1ccc(C(=O)N[C@H](c2ccccc2)C(F)F)cc1[N+](=O)[O-] ZINC000481825810 568138979 /nfs/dbraw/zinc/13/89/79/568138979.db2.gz QBDUNLXNHYFRMS-OAHLLOKOSA-N 0 0 350.321 3.730 20 5 FHBDRN O=C(NC[C@@H]1CCC2(CCCCC2)O1)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000481863214 568144774 /nfs/dbraw/zinc/14/47/74/568144774.db2.gz RAJJPDJYMVRXQM-AWEZNQCLSA-N 0 0 357.410 3.688 20 5 FHBDRN CCn1c(Sc2cc(C(C)C)ncn2)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000481846143 568159378 /nfs/dbraw/zinc/15/93/78/568159378.db2.gz WXBWXHNXUWVWNA-UHFFFAOYSA-N 0 0 370.438 3.938 20 5 FHBDRN Cc1cc(Br)ccc1CSCc1c([N+](=O)[O-])ncn1C ZINC000481902970 568160788 /nfs/dbraw/zinc/16/07/88/568160788.db2.gz VOMIFIAQJLWMMU-UHFFFAOYSA-N 0 0 356.245 3.833 20 5 FHBDRN C[C@H]1CN(c2nnc(-c3cccc([N+](=O)[O-])c3)n2C2CC2)C[C@H](C)S1 ZINC000568757815 568181869 /nfs/dbraw/zinc/18/18/69/568181869.db2.gz GXBDWUWWVHMKTQ-RYUDHWBXSA-N 0 0 359.455 3.518 20 5 FHBDRN COc1cc(C)c([N-]S(=O)(=O)c2ccc(C)cc2[N+](=O)[O-])c(C)c1C ZINC000584676654 568184539 /nfs/dbraw/zinc/18/45/39/568184539.db2.gz QTFBQPWUHCQIQJ-UHFFFAOYSA-N 0 0 364.423 3.638 20 5 FHBDRN CS[C@@H]1CCC[C@H](Nc2ccc([N+](=O)[O-])c(N3CCOCC3)c2F)C1 ZINC000568768232 568195965 /nfs/dbraw/zinc/19/59/65/568195965.db2.gz JZARSXAPBLBKIC-QWHCGFSZSA-N 0 0 369.462 3.657 20 5 FHBDRN CCOCc1ccc(NS(=O)(=O)c2c(C)cc([N+](=O)[O-])cc2C)cc1 ZINC000481954516 568196859 /nfs/dbraw/zinc/19/68/59/568196859.db2.gz BHZIDKPDUXRMQX-UHFFFAOYSA-N 0 0 364.423 3.549 20 5 FHBDRN Cc1ccc([C@H](C)NS(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000604040080 568202812 /nfs/dbraw/zinc/20/28/12/568202812.db2.gz FPDAYJGFNZOIHU-NSHDSACASA-N 0 0 354.815 3.596 20 5 FHBDRN Cc1ccc(NC(=O)c2ccc(N3CCO[C@H](C)[C@@H]3C)c([N+](=O)[O-])c2)cc1 ZINC000481980950 568213255 /nfs/dbraw/zinc/21/32/55/568213255.db2.gz ZDFLKFUYNHUMBC-LSDHHAIUSA-N 0 0 369.421 3.769 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N1CCC[C@H]1c1cccs1 ZINC000481985830 568215694 /nfs/dbraw/zinc/21/56/94/568215694.db2.gz ZFZAYGAVDMFTIL-AWEZNQCLSA-N 0 0 366.464 3.799 20 5 FHBDRN C[C@@H](NC(=O)N1CC(C)(C)[C@H]1c1cccnc1)c1cccc([N+](=O)[O-])c1 ZINC000291590232 568217036 /nfs/dbraw/zinc/21/70/36/568217036.db2.gz HKJBTXDDJXHHEX-CXAGYDPISA-N 0 0 354.410 3.844 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])N[C@H]1CCCC[C@H]1CC(F)(F)F ZINC000453004992 568217628 /nfs/dbraw/zinc/21/76/28/568217628.db2.gz GIMQFEMHZJYHSZ-RYUDHWBXSA-N 0 0 359.348 3.634 20 5 FHBDRN C[C@H](c1ccccc1)[C@H](O)COc1c(Br)cccc1[N+](=O)[O-] ZINC000453006203 568219959 /nfs/dbraw/zinc/21/99/59/568219959.db2.gz JHJSBPKXFUNWKC-IAQYHMDHSA-N 0 0 366.211 3.901 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)N2CCc3sccc3C2)cc1SC ZINC000482023115 568228745 /nfs/dbraw/zinc/22/87/45/568228745.db2.gz AUTPOFHTOWIJCV-UHFFFAOYSA-N 0 0 364.448 3.585 20 5 FHBDRN COc1ccc2c(c1NC(=O)Cn1ccc3cc([N+](=O)[O-])ccc31)CCC2 ZINC000482034528 568234966 /nfs/dbraw/zinc/23/49/66/568234966.db2.gz RPQKCNBCUWAHMP-UHFFFAOYSA-N 0 0 365.389 3.686 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(N[C@@H](CO)c2cccc(Br)c2)c1 ZINC000482035051 568235033 /nfs/dbraw/zinc/23/50/33/568235033.db2.gz LQENPMSAXBCQTE-AWEZNQCLSA-N 0 0 351.200 3.811 20 5 FHBDRN O=C(NCCNc1ccccc1[N+](=O)[O-])c1ccc(Oc2ccccc2)o1 ZINC000482043814 568238096 /nfs/dbraw/zinc/23/80/96/568238096.db2.gz HBKDRBAPKVGQQP-UHFFFAOYSA-N 0 0 367.361 3.822 20 5 FHBDRN CCCc1ccc([C@]2(C)NC(=O)N(Cc3cccc([N+](=O)[O-])c3)C2=O)cc1 ZINC000015572967 568249560 /nfs/dbraw/zinc/24/95/60/568249560.db2.gz DJUZBCBQZKKQRG-FQEVSTJZSA-N 0 0 367.405 3.515 20 5 FHBDRN Cc1cnc([C@@H](C)NC(=O)c2c([N+](=O)[O-])cccc2C(F)(F)F)s1 ZINC000568897051 568249615 /nfs/dbraw/zinc/24/96/15/568249615.db2.gz RTYKGAACICRELB-MRVPVSSYSA-N 0 0 359.329 3.870 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(NCCOc2ncccc2C(F)(F)F)n1 ZINC000541933470 568251276 /nfs/dbraw/zinc/25/12/76/568251276.db2.gz PRZMKBMZEUMWOL-UHFFFAOYSA-N 0 0 356.304 3.511 20 5 FHBDRN Cc1nc(N[C@@H](CCO)c2ccccc2Br)ccc1[N+](=O)[O-] ZINC000541932946 568252308 /nfs/dbraw/zinc/25/23/08/568252308.db2.gz AIRZQUSGXKMJNS-ZDUSSCGKSA-N 0 0 366.215 3.596 20 5 FHBDRN COC(=O)c1cc(C(=O)N2CCCC3(C2)CCCCCC3)cc([N+](=O)[O-])c1 ZINC000464677241 568252887 /nfs/dbraw/zinc/25/28/87/568252887.db2.gz KQUJFSOURQWASQ-UHFFFAOYSA-N 0 0 374.437 3.958 20 5 FHBDRN Cc1c(NC(=O)c2ccc3c(c2)NC(=O)[C@H](C)S3)cccc1[N+](=O)[O-] ZINC000015790971 568253816 /nfs/dbraw/zinc/25/38/16/568253816.db2.gz KKNKCRXMWBEQKM-JTQLQIEISA-N 0 0 357.391 3.588 20 5 FHBDRN Cc1cc(O)c(C(C)C)cc1C(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000436667425 568260979 /nfs/dbraw/zinc/26/09/79/568260979.db2.gz YAQVZYAXUYKMCB-UHFFFAOYSA-N 0 0 368.393 3.539 20 5 FHBDRN C[C@@H]1C[C@H](CNC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)[C@H](C)O1 ZINC000412670858 568262637 /nfs/dbraw/zinc/26/26/37/568262637.db2.gz BMFPMSKCSVZXEZ-QLFBSQMISA-N 0 0 370.405 3.930 20 5 FHBDRN C[C@@H]1C[C@H](CNC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)[C@@H](C)O1 ZINC000412670863 568262726 /nfs/dbraw/zinc/26/27/26/568262726.db2.gz BMFPMSKCSVZXEZ-RBSFLKMASA-N 0 0 370.405 3.930 20 5 FHBDRN CC[C@@H]1Cc2ccccc2CN1c1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1 ZINC000568994142 568265433 /nfs/dbraw/zinc/26/54/33/568265433.db2.gz ZAKBMTOEKDSPCH-CQSZACIVSA-N 0 0 350.378 3.585 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)[C@H]1OCCc2ccccc21 ZINC000181956826 568269014 /nfs/dbraw/zinc/26/90/14/568269014.db2.gz YHAAVXAWFYKDHR-HNNXBMFYSA-N 0 0 366.295 3.866 20 5 FHBDRN CC1(C)CN(c2nc3ccc([N+](=O)[O-])cc3c(=O)[nH]2)Cc2ccccc21 ZINC000569015358 568269515 /nfs/dbraw/zinc/26/95/15/568269515.db2.gz HHUOBKUGWJCXHD-UHFFFAOYSA-N 0 0 350.378 3.541 20 5 FHBDRN COc1ccc(NC(=O)CNc2ccc(Cl)cc2Cl)c([N+](=O)[O-])c1 ZINC000007972320 568269587 /nfs/dbraw/zinc/26/95/87/568269587.db2.gz HQKDEWHXNPLAJE-UHFFFAOYSA-N 0 0 370.192 3.961 20 5 FHBDRN COc1ccc2cc([C@H](C)C(=O)N(C)c3ccc([N+](=O)[O-])nc3)ccc2c1 ZINC000569031417 568269859 /nfs/dbraw/zinc/26/98/59/568269859.db2.gz SJDVXRYXFXPANU-ZDUSSCGKSA-N 0 0 365.389 3.918 20 5 FHBDRN COc1ccc2c(c1)[C@H](c1nc(Cc3ccccc3[N+](=O)[O-])no1)CC2 ZINC000584685696 568273921 /nfs/dbraw/zinc/27/39/21/568273921.db2.gz LSLQQUFIMJSMCO-OAHLLOKOSA-N 0 0 351.362 3.655 20 5 FHBDRN O=[N+]([O-])c1cnc2ccccc2c1N1CCC[C@H](c2nnc3ccccn32)C1 ZINC000291716958 568274579 /nfs/dbraw/zinc/27/45/79/568274579.db2.gz WFXHPJCQSVEXFV-AWEZNQCLSA-N 0 0 374.404 3.570 20 5 FHBDRN C[C@@H]1C[C@@H](c2ccc(C(F)(F)F)cc2)N(c2c([N+](=O)[O-])ncn2C)C1 ZINC000482105446 568274983 /nfs/dbraw/zinc/27/49/83/568274983.db2.gz ZEOVUJLXIABCGD-MFKMUULPSA-N 0 0 354.332 3.935 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)NC[C@H]2CC3CCC2CC3)cc1SC ZINC000569104474 568277190 /nfs/dbraw/zinc/27/71/90/568277190.db2.gz IUORBXDTBWCELW-WXRRBKDZSA-N 0 0 364.467 3.881 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(OCC(=O)N[C@H](C)c2ccccc2Cl)n1 ZINC000541982962 568277230 /nfs/dbraw/zinc/27/72/30/568277230.db2.gz CZLWUSIIBOOKRE-GFCCVEGCSA-N 0 0 363.801 3.516 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)NCCc1ccc(OC)cc1OC ZINC000569040757 568278267 /nfs/dbraw/zinc/27/82/67/568278267.db2.gz KEQCAMBOVVBHEM-UHFFFAOYSA-N 0 0 373.409 3.539 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(OCC(=O)Nc2ccc(C(C)(C)C)cc2)n1 ZINC000541984101 568278448 /nfs/dbraw/zinc/27/84/48/568278448.db2.gz JZOAPHYIDLADPM-UHFFFAOYSA-N 0 0 357.410 3.922 20 5 FHBDRN CC(=O)[C@H](C)CCCCC(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000569046628 568280212 /nfs/dbraw/zinc/28/02/12/568280212.db2.gz XPDWHPANSYULJA-CYBMUJFWSA-N 0 0 359.426 3.520 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1nc(-c2ccccc2F)co1 ZINC000482119319 568280492 /nfs/dbraw/zinc/28/04/92/568280492.db2.gz KXJLUGVHUKCAMT-UHFFFAOYSA-N 0 0 357.297 3.650 20 5 FHBDRN CC1(C)CN(C(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])[C@H]1[C@H]1CCCO1 ZINC000291736507 568286709 /nfs/dbraw/zinc/28/67/09/568286709.db2.gz XGTMMHOYQHCTPS-KGLIPLIRSA-N 0 0 372.343 3.643 20 5 FHBDRN CCN(Cc1ccc(Cl)s1)C(=O)c1cc([N+](=O)[O-])ccc1OC ZINC000026859495 568291086 /nfs/dbraw/zinc/29/10/86/568291086.db2.gz AIBRIUDRVBYEEJ-UHFFFAOYSA-N 0 0 354.815 3.981 20 5 FHBDRN Cc1ccccc1OCCCN(C)C(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000569053307 568291398 /nfs/dbraw/zinc/29/13/98/568291398.db2.gz MLRGSTVRDDKBEN-INIZCTEOSA-N 0 0 356.422 3.934 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)NC1(c2ccc(Cl)cc2)CC1 ZINC000482202991 568308452 /nfs/dbraw/zinc/30/84/52/568308452.db2.gz XJIMGMSUWFHRRX-UHFFFAOYSA-N 0 0 366.826 3.524 20 5 FHBDRN COc1ccc(C(=O)NC[C@@H]2CCCC[C@H]2C(F)(F)F)cc1[N+](=O)[O-] ZINC000482211539 568312985 /nfs/dbraw/zinc/31/29/85/568312985.db2.gz JVQPTKKYKDTJJN-NWDGAFQWSA-N 0 0 360.332 3.702 20 5 FHBDRN CCc1coc(NC(=O)c2ccc(N3C[C@@H](C)C[C@H](C)C3)c([N+](=O)[O-])c2)n1 ZINC000569234489 568317084 /nfs/dbraw/zinc/31/70/84/568317084.db2.gz ANUXYVTUTBXGID-STQMWFEESA-N 0 0 372.425 3.880 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)NCCCCc2ccccc2)c1 ZINC000031593690 568334349 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20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])NC[C@H]1CCCC[C@@H]1C(F)(F)F ZINC000482226173 568370281 /nfs/dbraw/zinc/37/02/81/568370281.db2.gz WISMNHPREJNARX-OLZOCXBDSA-N 0 0 373.375 3.882 20 5 FHBDRN COc1ccc2[nH]c(SCc3cc([N+](=O)[O-])cc4c3OCOC4)nc2c1 ZINC000003534809 568370514 /nfs/dbraw/zinc/37/05/14/568370514.db2.gz KOFQTBGRWHNTQH-UHFFFAOYSA-N 0 0 373.390 3.639 20 5 FHBDRN COc1ccc(OCC(=O)Nc2ccc(Cl)c(Cl)c2)c([N+](=O)[O-])c1 ZINC000005051427 568377813 /nfs/dbraw/zinc/37/78/13/568377813.db2.gz XOUJSSNGGKWGCC-UHFFFAOYSA-N 0 0 371.176 3.928 20 5 FHBDRN Cc1csc(Sc2ccc(C(=O)NC[C@@H]3C[C@@H]3C)cc2[N+](=O)[O-])n1 ZINC000032382055 568388367 /nfs/dbraw/zinc/38/83/67/568388367.db2.gz GAUJVUBUWADVSE-CABZTGNLSA-N 0 0 363.464 3.897 20 5 FHBDRN CCOC(=O)c1ccc(NC(=O)c2ccc(SC)c([N+](=O)[O-])c2)cc1 ZINC000005636810 568388686 /nfs/dbraw/zinc/38/86/86/568388686.db2.gz NDGGRQLXPARUAQ-UHFFFAOYSA-N 0 0 360.391 3.746 20 5 FHBDRN C[C@@H]1CCCN(c2ccc(C(=O)NCCc3ccccc3)cc2[N+](=O)[O-])C1 ZINC000006124601 568395857 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FHBDRN Cc1ccc(SC[C@@H](C)Nc2nc3ccc([N+](=O)[O-])cc3c(=O)[nH]2)cc1 ZINC000569637837 568407142 /nfs/dbraw/zinc/40/71/42/568407142.db2.gz ZBNFEZAIUPRPOH-GFCCVEGCSA-N 0 0 370.434 3.567 20 5 FHBDRN COc1ccc2c(c1)C1(CC1)CN(c1cc(OC)c(F)cc1[N+](=O)[O-])C2 ZINC000569656444 568416259 /nfs/dbraw/zinc/41/62/59/568416259.db2.gz KEONQXQYVHISGO-UHFFFAOYSA-N 0 0 358.369 3.803 20 5 FHBDRN C[C@H](C(=O)N1CCN(CC2CC2)c2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000569771345 568422888 /nfs/dbraw/zinc/42/28/88/568422888.db2.gz AUDIUCNWVKMULE-HNNXBMFYSA-N 0 0 365.433 3.962 20 5 FHBDRN CC(C)[C@@H](CNc1nccc(C(N)=O)c1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000569775832 568423815 /nfs/dbraw/zinc/42/38/15/568423815.db2.gz SFPNWGRTILLTDW-CQSZACIVSA-N 0 0 362.817 3.594 20 5 FHBDRN COCCOc1ccc(NC(=O)[C@H](C)c2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000569778238 568423923 /nfs/dbraw/zinc/42/39/23/568423923.db2.gz BXZAOIMXGOYZGO-CQSZACIVSA-N 0 0 358.394 3.671 20 5 FHBDRN O=C(Nc1ccc2c(c1)C(=O)NCC2)c1cc2ccccc2c2cccnc12 ZINC000604969589 568431881 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350.378 3.582 20 5 FHBDRN C[C@H](C(=O)Nc1ccc(-n2cccn2)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000570025934 568441820 /nfs/dbraw/zinc/44/18/20/568441820.db2.gz BOKNGAUUNBFOAS-LBPRGKRZSA-N 0 0 354.341 3.662 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])N1CCC(c2ccccc2F)CC1 ZINC000569965990 568444991 /nfs/dbraw/zinc/44/49/91/568444991.db2.gz XLGGMJBEYWHELG-UHFFFAOYSA-N 0 0 357.385 3.823 20 5 FHBDRN C[C@H](C(=O)NC1(c2ccccc2)CCOCC1)c1cccc([N+](=O)[O-])c1 ZINC000569998494 568448132 /nfs/dbraw/zinc/44/81/32/568448132.db2.gz IEWGGOAOWDKJFI-HNNXBMFYSA-N 0 0 354.406 3.520 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)[C@@H]1C[C@@H]1c1c(F)cccc1F ZINC000570113369 568451653 /nfs/dbraw/zinc/45/16/53/568451653.db2.gz JHJVABGDTSHZNB-UONOGXRCSA-N 0 0 360.360 3.678 20 5 FHBDRN Cc1ccccc1-n1cc(CN(Cc2cccc([N+](=O)[O-])c2)C2CC2)nn1 ZINC000570127863 568453060 /nfs/dbraw/zinc/45/30/60/568453060.db2.gz JZIRMAGNIJZDRG-UHFFFAOYSA-N 0 0 363.421 3.649 20 5 FHBDRN COC(=O)c1ccc(OCC(=O)Nc2ccc(C(C)C)cc2)c([N+](=O)[O-])c1 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FHBDRN O=C(N[C@@H]1CCO[C@H](C2CC2)C1)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000278055085 937087844 /nfs/dbraw/zinc/08/78/44/937087844.db2.gz MLIXKELJIYUCAR-KUHUBIRLSA-N 0 0 362.429 3.781 20 5 FHBDRN CCCCCNC(=O)C1CCN(c2ccc([N+](=O)[O-])c3cccnc32)CC1 ZINC000052077714 937088123 /nfs/dbraw/zinc/08/81/23/937088123.db2.gz VBCYFCOPWCITQF-UHFFFAOYSA-N 0 0 370.453 3.666 20 5 FHBDRN CN(C)c1cc(-c2nc(-c3ccc([N+](=O)[O-])cc3)no2)nc2ccccc21 ZINC000514819808 937090047 /nfs/dbraw/zinc/09/00/47/937090047.db2.gz BXGOOHAWVRNOSX-UHFFFAOYSA-N 0 0 361.361 3.926 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1C(=O)NCc1nc2ccccc2n1C(C)C ZINC000278062637 937097438 /nfs/dbraw/zinc/09/74/38/937097438.db2.gz UXWVBGZNNTULNC-UHFFFAOYSA-N 0 0 352.394 3.764 20 5 FHBDRN CC(C)(CCCO)CNC(=O)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000278079491 937124463 /nfs/dbraw/zinc/12/44/63/937124463.db2.gz OVIXTINJNZWZLX-UHFFFAOYSA-N 0 0 352.434 3.622 20 5 FHBDRN Cc1ccc(NC(=O)[C@@H](C)OC(=O)c2ccc([N+](=O)[O-])s2)c(Cl)c1 ZINC000023344307 927038820 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FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)N(c1ccccn1)C1CCCC1 ZINC000430256113 928781095 /nfs/dbraw/zinc/78/10/95/928781095.db2.gz JVZGHYOZVFHKKS-UHFFFAOYSA-N 0 0 364.405 3.920 20 5 FHBDRN C[C@H](C(=O)N1CC2(CCOCC2)[C@@H]2CCC[C@@H]21)c1cccc([N+](=O)[O-])c1 ZINC000583245486 937276310 /nfs/dbraw/zinc/27/63/10/937276310.db2.gz GVSKPXCLSKGMDN-QGTPRVQTSA-N 0 0 358.438 3.506 20 5 FHBDRN Cc1cccc(OCC(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)c1 ZINC000755370783 937277825 /nfs/dbraw/zinc/27/78/25/937277825.db2.gz QESOZZNTWXXRJV-UHFFFAOYSA-N 0 0 365.183 3.683 20 5 FHBDRN COc1cc(C(=O)Nc2cccc(C(C)(C)C)c2O)c([N+](=O)[O-])cc1OC ZINC000274830090 928833529 /nfs/dbraw/zinc/83/35/29/928833529.db2.gz SAXDONDDMPHACZ-UHFFFAOYSA-N 0 0 374.393 3.867 20 5 FHBDRN COc1ccccc1N1CCC(Nc2ncc(Cl)cc2[N+](=O)[O-])CC1 ZINC000178835212 937281430 /nfs/dbraw/zinc/28/14/30/937281430.db2.gz MMAWLPJHNSWBOZ-UHFFFAOYSA-N 0 0 362.817 3.733 20 5 FHBDRN COc1cc(C(=O)N[C@H](CC2CC2)c2ccccc2)c([N+](=O)[O-])cc1OC ZINC000610236087 928871651 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CCOc1cc([N+](=O)[O-])c(C(=O)NCCc2c(C)cccc2C)cc1OC ZINC000165160193 929159782 /nfs/dbraw/zinc/15/97/82/929159782.db2.gz QNCGZDLWFFKPCY-UHFFFAOYSA-N 0 0 372.421 3.591 20 5 FHBDRN C[C@H](NC(=O)c1csc([N+](=O)[O-])c1)c1nc(-c2ccncc2)cs1 ZINC000609523520 929199404 /nfs/dbraw/zinc/19/94/04/929199404.db2.gz PCSHNSXXKISJRW-VIFPVBQESA-N 0 0 360.420 3.666 20 5 FHBDRN C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1Cl)c1cnn(CC2CCC2)c1 ZINC000890677282 929231143 /nfs/dbraw/zinc/23/11/43/929231143.db2.gz NBKSIZGFXQYMSQ-NSHDSACASA-N 0 0 362.817 3.736 20 5 FHBDRN COC(=O)C1CCC(Nc2ccc([N+](=O)[O-])cc2Br)CC1 ZINC000134781893 929238376 /nfs/dbraw/zinc/23/83/76/929238376.db2.gz APBGKYHYWULVTJ-UHFFFAOYSA-N 0 0 357.204 3.501 20 5 FHBDRN Cc1cc(NCc2cccc(NC(=O)[C@H]3CCCO3)c2)ccc1[N+](=O)[O-] ZINC000060081702 929304328 /nfs/dbraw/zinc/30/43/28/929304328.db2.gz IVVAHXSBRVTKFW-GOSISDBHSA-N 0 0 355.394 3.633 20 5 FHBDRN CN(C(=O)c1cc(N2CCCC2=O)ccc1Cl)c1ccc([N+](=O)[O-])cc1 ZINC000134822115 929304909 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CCNC(=O)c1ccc(NC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)cc1 ZINC000187297326 929677607 /nfs/dbraw/zinc/67/76/07/929677607.db2.gz LXSSTXBNYMAODZ-UHFFFAOYSA-N 0 0 355.394 3.720 20 5 FHBDRN O=C(NCc1nc2ccccc2[nH]1)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000044514381 937351114 /nfs/dbraw/zinc/35/11/14/937351114.db2.gz UFHNQJPDXCVVHG-UHFFFAOYSA-N 0 0 352.375 3.616 20 5 FHBDRN CC(C)n1cc([C@@H](C)NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])cn1 ZINC000610294896 929697262 /nfs/dbraw/zinc/69/72/62/929697262.db2.gz RWZONZZEGZIWOL-SNVBAGLBSA-N 0 0 370.331 3.882 20 5 FHBDRN O=C(c1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CC[C@@H](c2ccco2)C1 ZINC000610293670 929699853 /nfs/dbraw/zinc/69/98/53/929699853.db2.gz MBVKJFPLJREYEP-SNVBAGLBSA-N 0 0 354.284 3.836 20 5 FHBDRN O=C(Nc1cc2c(cc1Cl)OCCCO2)c1ccc(F)cc1[N+](=O)[O-] ZINC000160317166 929722815 /nfs/dbraw/zinc/72/28/15/929722815.db2.gz COJPCYTUOPFLNB-UHFFFAOYSA-N 0 0 366.732 3.801 20 5 FHBDRN Cc1nn(C)c(NCc2ccc(OCc3ccccc3)cc2)c1[N+](=O)[O-] ZINC000052283216 937355774 /nfs/dbraw/zinc/35/57/74/937355774.db2.gz MKHYJWPNVCAKBJ-UHFFFAOYSA-N 0 0 352.394 3.828 20 5 FHBDRN CC(C)C[C@H]1OCCC[C@H]1NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000187307476 929767079 /nfs/dbraw/zinc/76/70/79/929767079.db2.gz UOXGEQQKMMOPJT-HZPDHXFCSA-N 0 0 354.834 3.501 20 5 FHBDRN C[C@@H](NC(=O)Cc1ccccc1[N+](=O)[O-])c1nc(-c2ccncc2)cs1 ZINC000109906721 929771273 /nfs/dbraw/zinc/77/12/73/929771273.db2.gz ACGYYXSXPWCLPX-GFCCVEGCSA-N 0 0 368.418 3.533 20 5 FHBDRN O=[N+]([O-])c1cccc(F)c1N1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1 ZINC000579987083 929774355 /nfs/dbraw/zinc/77/43/55/929774355.db2.gz LLQSJSCLPKBMHJ-SNVBAGLBSA-N 0 0 358.295 3.791 20 5 FHBDRN CCOc1cc(C(=O)NC[C@@H](C)c2ccc(C)cc2)c([N+](=O)[O-])cc1OC ZINC000127137654 929791243 /nfs/dbraw/zinc/79/12/43/929791243.db2.gz HKSPHALLKVQNNI-CQSZACIVSA-N 0 0 372.421 3.844 20 5 FHBDRN CC[C@@H](NC(=O)N1CCOC[C@@H]1CC1CCC1)c1cccc([N+](=O)[O-])c1 ZINC000458485397 937359668 /nfs/dbraw/zinc/35/96/68/937359668.db2.gz CDZGLPZKKZVIGC-ZWKOTPCHSA-N 0 0 361.442 3.647 20 5 FHBDRN CO[C@H](CNC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1)C(C)(C)C ZINC000275676195 929833415 /nfs/dbraw/zinc/83/34/15/929833415.db2.gz BRTVAYQCDHPWSF-GOSISDBHSA-N 0 0 352.434 3.885 20 5 FHBDRN COCC[C@@H](C)NC(=O)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12 ZINC000275679676 929857849 /nfs/dbraw/zinc/85/78/49/929857849.db2.gz ZTHIXZQKGLTJNC-SNVBAGLBSA-N 0 0 360.360 3.527 20 5 FHBDRN CC(C)c1[nH]nc(C(=O)Nc2n[nH]cc2-c2ccc(Cl)cc2)c1[N+](=O)[O-] ZINC001167329378 929908917 /nfs/dbraw/zinc/90/89/17/929908917.db2.gz QBGSIBOCJMPFSS-UHFFFAOYSA-N 0 0 374.788 3.737 20 5 FHBDRN C[C@@H](NC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1)C1CCOCC1 ZINC000275684706 929911984 /nfs/dbraw/zinc/91/19/84/929911984.db2.gz PSGRQHQZWVPACL-CYBMUJFWSA-N 0 0 350.418 3.639 20 5 FHBDRN CCOc1ccccc1N1CCN([C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000023697259 929915848 /nfs/dbraw/zinc/91/58/48/929915848.db2.gz KODVTQPHCFYGRP-MRXNPFEDSA-N 0 0 355.438 3.877 20 5 FHBDRN O=C(NCC(C1CC1)C1CC1)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000610321998 929927743 /nfs/dbraw/zinc/92/77/43/929927743.db2.gz MSEPZCFBAZOBNJ-UHFFFAOYSA-N 0 0 355.341 3.754 20 5 FHBDRN CN1CCN(C(=O)c2c(Cl)cccc2[N+](=O)[O-])c2cc(Cl)ccc21 ZINC000471485725 929935470 /nfs/dbraw/zinc/93/54/70/929935470.db2.gz RMUGBQOLKUGYDC-UHFFFAOYSA-N 0 0 366.204 3.998 20 5 FHBDRN CC[C@@H](C)[C@H](O)CNC(=O)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12 ZINC000275695947 929937437 /nfs/dbraw/zinc/93/74/37/929937437.db2.gz RPMRZVXELWMQHH-BMLIUANNSA-N 0 0 374.387 3.509 20 5 FHBDRN CCOc1c(Cl)cccc1NC(=O)c1ccc([N+](=O)[O-])cc1OC ZINC001125401484 929942993 /nfs/dbraw/zinc/94/29/93/929942993.db2.gz MKYGDKQPQVBKMP-UHFFFAOYSA-N 0 0 350.758 3.908 20 5 FHBDRN O=C(C=Cc1ccnc2ccccc12)Nc1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000255141679 929959893 /nfs/dbraw/zinc/95/98/93/929959893.db2.gz XDPCLZULDIBXAE-YVMONPNESA-N 0 0 359.345 3.671 20 5 FHBDRN CN(CCOCC1CC1)C(=O)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000278215532 937374764 /nfs/dbraw/zinc/37/47/64/937374764.db2.gz RNCXNWSOXQVWLF-UHFFFAOYSA-N 0 0 350.418 3.592 20 5 FHBDRN Cc1sc(C(=O)N(C)Cc2ccc(Br)o2)cc1[N+](=O)[O-] ZINC000041381947 929974165 /nfs/dbraw/zinc/97/41/65/929974165.db2.gz XLGQZGIHDLGZHE-UHFFFAOYSA-N 0 0 359.201 3.592 20 5 FHBDRN C[C@H](C(=O)OCc1cncn1Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000784992102 929974242 /nfs/dbraw/zinc/97/42/42/929974242.db2.gz MMVDGLRKUNILDX-HNNXBMFYSA-N 0 0 365.389 3.687 20 5 FHBDRN O=[N+]([O-])c1cc(F)c(N[C@H](CO)c2cccc(Br)c2)c(F)c1 ZINC000178871513 937375332 /nfs/dbraw/zinc/37/53/32/937375332.db2.gz QVYFWQGSYBCHLY-CYBMUJFWSA-N 0 0 373.153 3.781 20 5 FHBDRN Cc1nn(CCC(=O)N2c3ccccc3S[C@H](C)[C@@H]2C)c(C)c1[N+](=O)[O-] ZINC000176698767 937379403 /nfs/dbraw/zinc/37/94/03/937379403.db2.gz ODMIHRAIJMAVTE-GXTWGEPZSA-N 0 0 374.466 3.714 20 5 FHBDRN Cc1c(C(=O)Nc2ccc3cc([N+](=O)[O-])ccc3n2)cnn1-c1ccccc1 ZINC000176697562 937379410 /nfs/dbraw/zinc/37/94/10/937379410.db2.gz DJMBKDZPNPLDCL-UHFFFAOYSA-N 0 0 373.372 3.889 20 5 FHBDRN CN(Cc1nc(Cc2ccccc2Cl)no1)c1ccccc1[N+](=O)[O-] ZINC000610336427 930018834 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/nfs/dbraw/zinc/24/46/50/930244650.db2.gz UQNNWMCIWFMYKC-UHFFFAOYSA-N 0 0 356.350 3.950 20 5 FHBDRN CCCOc1cc(OC)ccc1C(=O)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000560991947 930265619 /nfs/dbraw/zinc/26/56/19/930265619.db2.gz UJPWJBAJVJOGKZ-UHFFFAOYSA-N 0 0 372.421 3.707 20 5 FHBDRN Cc1cccc(C)c1OC[C@@H](C)NC(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000510318594 930266505 /nfs/dbraw/zinc/26/65/05/930266505.db2.gz HTOBNLARCLBAKV-OAHLLOKOSA-N 0 0 374.462 3.887 20 5 FHBDRN CC(C)[C@@H]1N(C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)CC12CCC2 ZINC000560999033 930269827 /nfs/dbraw/zinc/26/98/27/930269827.db2.gz OWGKROPJHOXDHU-AWEZNQCLSA-N 0 0 354.353 3.847 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1[N+](=O)[O-] ZINC000175902160 930273654 /nfs/dbraw/zinc/27/36/54/930273654.db2.gz RHHNTUVECSLGOA-QWHCGFSZSA-N 0 0 372.381 3.933 20 5 FHBDRN CNC(=O)c1ccc(N2CCC(Cc3cccc(F)c3)CC2)c([N+](=O)[O-])c1 ZINC000064914668 930311541 /nfs/dbraw/zinc/31/15/41/930311541.db2.gz SFVWOQUWEURUQI-UHFFFAOYSA-N 0 0 371.412 3.553 20 5 FHBDRN CCOc1ccccc1CNc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1 ZINC000064915294 930312126 /nfs/dbraw/zinc/31/21/26/930312126.db2.gz KCPZRPWURUJUMP-UHFFFAOYSA-N 0 0 369.421 3.842 20 5 FHBDRN COc1ccc(OC)c(CCNc2ccc3ncccc3c2[N+](=O)[O-])c1 ZINC000064916197 930315467 /nfs/dbraw/zinc/31/54/67/930315467.db2.gz HDXCYVXKBYVGCS-UHFFFAOYSA-N 0 0 353.378 3.815 20 5 FHBDRN COc1cc(COc2cc(C=O)ccc2[N+](=O)[O-])ccc1OC(F)F ZINC000748153827 930325533 /nfs/dbraw/zinc/32/55/33/930325533.db2.gz BVOAUTSBMIUJSP-UHFFFAOYSA-N 0 0 353.277 3.596 20 5 FHBDRN COc1cc(C(=O)NCC2CC(c3ccccc3)C2)cc([N+](=O)[O-])c1OC ZINC000583393420 937403585 /nfs/dbraw/zinc/40/35/85/937403585.db2.gz CFHSZIBQHFNFPB-UHFFFAOYSA-N 0 0 370.405 3.536 20 5 FHBDRN Cc1cccc2[nH]c(CCC(=O)N[C@@H](C)c3ccc(C)c([N+](=O)[O-])c3)nc21 ZINC000177728017 930337537 /nfs/dbraw/zinc/33/75/37/930337537.db2.gz IIXWJCGWCIFWFO-AWEZNQCLSA-N 0 0 366.421 3.898 20 5 FHBDRN CC(C)Oc1nc(N2CCC(F)(c3ccccn3)CC2)ccc1[N+](=O)[O-] ZINC000572855796 930348290 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CCc1cccc2c1N(C(=O)c1cc3c(cc1[N+](=O)[O-])OCCCO3)CC2 ZINC001125440132 930505207 /nfs/dbraw/zinc/50/52/07/930505207.db2.gz SHVWOOANUVNPER-UHFFFAOYSA-N 0 0 368.389 3.521 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[C@@H](c2ccc(C)cc2)C1 ZINC000548079977 930512145 /nfs/dbraw/zinc/51/21/45/930512145.db2.gz RJKOEOXLVTWVJE-OAHLLOKOSA-N 0 0 355.394 3.933 20 5 FHBDRN COC(=O)COc1ccc([C@@H](C)Nc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000471558349 930514281 /nfs/dbraw/zinc/51/42/81/930514281.db2.gz FFPZHFJHUWIPGA-LLVKDONJSA-N 0 0 364.785 3.973 20 5 FHBDRN CCc1cnc(CNCc2ccc(Br)cc2[N+](=O)[O-])s1 ZINC000234231907 930521443 /nfs/dbraw/zinc/52/14/43/930521443.db2.gz CHRNIHNXQOYEAB-UHFFFAOYSA-N 0 0 356.245 3.666 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(=O)n1Cc1ccc(Br)c(Cl)c1 ZINC000471560795 930529610 /nfs/dbraw/zinc/52/96/10/930529610.db2.gz RYENHFWPHYNNNV-UHFFFAOYSA-N 0 0 357.591 3.529 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)NCc1ccc(OC2CCCC2)cc1 ZINC000580339134 930532167 /nfs/dbraw/zinc/53/21/67/930532167.db2.gz 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CC(C)(C(=O)N1CC[C@@](F)(c2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000580474442 930721999 /nfs/dbraw/zinc/72/19/99/930721999.db2.gz DBBPYZYFNWJGST-FQEVSTJZSA-N 0 0 356.397 3.970 20 5 FHBDRN O=C(NCc1csc(-c2ccco2)n1)c1cc([N+](=O)[O-])ccc1Cl ZINC000160516206 930728686 /nfs/dbraw/zinc/72/86/86/930728686.db2.gz ANAZGBOUIJIIBJ-UHFFFAOYSA-N 0 0 363.782 3.895 20 5 FHBDRN COc1ccccc1CNC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000050257235 930746988 /nfs/dbraw/zinc/74/69/88/930746988.db2.gz RLRYOQACDDIPHG-UHFFFAOYSA-N 0 0 369.402 3.657 20 5 FHBDRN O=C(Nc1cnn(Cc2ccccc2)c1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000119148948 930754424 /nfs/dbraw/zinc/75/44/24/930754424.db2.gz SKGGZJSTRQNHPP-UHFFFAOYSA-N 0 0 356.769 3.745 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CCC(c2cc(C)cc(C)c2)CC1 ZINC000891291564 930784174 /nfs/dbraw/zinc/78/41/74/930784174.db2.gz VMUNNGCEDCNJFJ-UHFFFAOYSA-N 0 0 370.453 3.513 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N[C@H]1CCO[C@@H](C(C)(C)C)C1 ZINC000275900723 930784520 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FHBDRN O=C(NCC[C@@H]1CCCCO1)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000275984221 931156007 /nfs/dbraw/zinc/15/60/07/931156007.db2.gz PGBFJAGNFQOJRN-HNNXBMFYSA-N 0 0 350.418 3.783 20 5 FHBDRN Cc1c(CC(=O)N2Cc3ccccc3OC(C)(C)C2)cccc1[N+](=O)[O-] ZINC000580798923 931158371 /nfs/dbraw/zinc/15/83/71/931158371.db2.gz TZXALHYFWCWQNC-UHFFFAOYSA-N 0 0 354.406 3.646 20 5 FHBDRN C[C@H](NC(=O)C1CC(OCc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000610466397 931251259 /nfs/dbraw/zinc/25/12/59/931251259.db2.gz PRCHZCKVIDFKQV-STJZUHDESA-N 0 0 354.406 3.767 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCCC[C@H]([C@H]2CCOC2)C1 ZINC000891334402 931253420 /nfs/dbraw/zinc/25/34/20/931253420.db2.gz IRTDCOCQILZVDV-QYZOEREBSA-N 0 0 374.481 3.829 20 5 FHBDRN O=C(c1c(Cl)cccc1[N+](=O)[O-])N1CCCC[C@@H]([C@@H]2CCOC2)C1 ZINC000891335403 931262962 /nfs/dbraw/zinc/26/29/62/931262962.db2.gz NETCKEDWUBMRPN-CHWSQXEVSA-N 0 0 352.818 3.527 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)CCCc2nc(C(C)(C)C)no2)cc1[N+](=O)[O-] ZINC000177835481 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372.450 3.741 20 5 FHBDRN COC(=O)c1ccc(OCc2nc(Cl)ccc2Cl)c([N+](=O)[O-])c1 ZINC000785027830 931340221 /nfs/dbraw/zinc/34/02/21/931340221.db2.gz DFJDEBXJGBSEBW-UHFFFAOYSA-N 0 0 357.149 3.662 20 5 FHBDRN COc1cc(C(=O)N[C@H](C)c2cc(C)cc(C)c2)cc([N+](=O)[O-])c1OC ZINC000610179759 931355592 /nfs/dbraw/zinc/35/55/92/931355592.db2.gz IIYMCVRBAHQJJI-CYBMUJFWSA-N 0 0 358.394 3.720 20 5 FHBDRN CC(=O)c1ccc(NCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)cc1C ZINC000135083443 931369108 /nfs/dbraw/zinc/36/91/08/931369108.db2.gz NYOAMCRBACKQHY-UHFFFAOYSA-N 0 0 352.350 3.768 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)Oc2ccccc2-c2nnco2)c1 ZINC000156727208 931394390 /nfs/dbraw/zinc/39/43/90/931394390.db2.gz XBOIISYMLUNGJY-UHFFFAOYSA-N 0 0 357.347 3.586 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)c2cccc(-n3ccnc3)c2)cc1[N+](=O)[O-] ZINC000177869816 931394769 /nfs/dbraw/zinc/39/47/69/931394769.db2.gz XVLQZNGNQAEJMK-AWEZNQCLSA-N 0 0 350.378 3.580 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)c2cnn(Cc3ccccc3)c2)cc1[N+](=O)[O-] ZINC000177870860 931395644 /nfs/dbraw/zinc/39/56/44/931395644.db2.gz SAXKLCLCDNBVFG-HNNXBMFYSA-N 0 0 364.405 3.639 20 5 FHBDRN O=C(NC1CC(F)(F)C1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000430530077 931414074 /nfs/dbraw/zinc/41/40/74/931414074.db2.gz KDASZNGJYDLJPA-UHFFFAOYSA-N 0 0 361.348 3.734 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1-c1noc(CCC(=O)c2ccc(Cl)cn2)n1 ZINC000580977029 931437942 /nfs/dbraw/zinc/43/79/42/931437942.db2.gz FCUOCAJBUHWKGC-UHFFFAOYSA-N 0 0 372.768 3.817 20 5 FHBDRN COc1cccc([C@@H]2CN(Cc3cc([N+](=O)[O-])ccc3Cl)CCO2)c1 ZINC000177915285 931575803 /nfs/dbraw/zinc/57/58/03/931575803.db2.gz RPOYJKVMPGZYCA-SFHVURJKSA-N 0 0 362.813 3.830 20 5 FHBDRN O=[N+]([O-])c1cnccc1N1CCO[C@@H](c2cccc(C(F)(F)F)c2)C1 ZINC000610480097 931578777 /nfs/dbraw/zinc/57/87/77/931578777.db2.gz MWNJOQPCZCJBHC-OAHLLOKOSA-N 0 0 353.300 3.587 20 5 FHBDRN Cc1nc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)ccc1-c1ccccc1 ZINC000581135401 931611029 /nfs/dbraw/zinc/61/10/29/931611029.db2.gz OFWODCHLONUIQV-UHFFFAOYSA-N 0 0 366.352 3.939 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])N1CCCCC[C@H]1[C@@H]1CCCCC1=O ZINC000126259130 931685755 /nfs/dbraw/zinc/68/57/55/931685755.db2.gz NLCADPSAAIZILI-RDJZCZTQSA-N 0 0 373.453 3.537 20 5 FHBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N2C[C@H](c3ccccc3)[C@@H]3CCC[C@H]32)c1 ZINC000510370445 931717686 /nfs/dbraw/zinc/71/76/86/931717686.db2.gz ZHMBDXWVQGXXLT-IPMKNSEASA-N 0 0 372.446 3.552 20 5 FHBDRN C[C@@H]1CC(CCNC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C[C@@H](C)O1 ZINC000581256585 931743693 /nfs/dbraw/zinc/74/36/93/931743693.db2.gz DYUZFJBAJMNQEI-GHMZBOCLSA-N 0 0 355.822 3.963 20 5 FHBDRN C[C@H]1CC(CCNC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C[C@H](C)O1 ZINC000581256586 931743818 /nfs/dbraw/zinc/74/38/18/931743818.db2.gz DYUZFJBAJMNQEI-QWRGUYRKSA-N 0 0 355.822 3.963 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)N1CCCCC[C@H]1[C@H]1CCCCC1=O ZINC000126402058 931802934 /nfs/dbraw/zinc/80/29/34/931802934.db2.gz CRVWHPZNSNCROX-MSOLQXFVSA-N 0 0 358.438 3.668 20 5 FHBDRN Cc1nc(C)c([C@H](C)N(C)C(=O)COc2ccc([N+](=O)[O-])c(C)c2)s1 ZINC000430554188 931818440 /nfs/dbraw/zinc/81/84/40/931818440.db2.gz PUFIRBUNJWSDPR-LBPRGKRZSA-N 0 0 363.439 3.575 20 5 FHBDRN Cc1nc(C)c([C@@H](C)N(C)C(=O)COc2ccc([N+](=O)[O-])c(C)c2)s1 ZINC000430554187 931818635 /nfs/dbraw/zinc/81/86/35/931818635.db2.gz PUFIRBUNJWSDPR-GFCCVEGCSA-N 0 0 363.439 3.575 20 5 FHBDRN CC[C@@](C)(NC(=O)Nc1ccc([N+](=O)[O-])cc1OC)c1nccs1 ZINC000156130649 931819501 /nfs/dbraw/zinc/81/95/01/931819501.db2.gz IMXXIDQSPCXWBI-OAHLLOKOSA-N 0 0 350.400 3.507 20 5 FHBDRN COc1ccc(NC(=O)N2CC[C@H](C(F)(F)F)C2(C)C)cc1[N+](=O)[O-] ZINC000276131665 931825188 /nfs/dbraw/zinc/82/51/88/931825188.db2.gz CQCKRHIMWATZFH-LBPRGKRZSA-N 0 0 361.320 3.798 20 5 FHBDRN O=C(CSc1ccccc1[N+](=O)[O-])NC[C@H]1CCO[C@@H]1c1ccccc1 ZINC000430558422 931837971 /nfs/dbraw/zinc/83/79/71/931837971.db2.gz AQSFJJKYPRXBIZ-DNVCBOLYSA-N 0 0 372.446 3.581 20 5 FHBDRN Cc1cc(C(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)c2nccc(C)c2c1 ZINC000581324156 931839613 /nfs/dbraw/zinc/83/96/13/931839613.db2.gz PXJDKCNRZRORDV-UHFFFAOYSA-N 0 0 361.401 3.958 20 5 FHBDRN Cc1cc(NC(=O)C2CCC(F)(F)CC2)n(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000127177133 931863803 /nfs/dbraw/zinc/86/38/03/931863803.db2.gz SJFUCHXPXUGROS-UHFFFAOYSA-N 0 0 364.352 3.853 20 5 FHBDRN COc1ccc(CSCc2cc([N+](=O)[O-])ccc2C(F)(F)F)nn1 ZINC000581360160 931894692 /nfs/dbraw/zinc/89/46/92/931894692.db2.gz VNOWDPGTRCKPKS-UHFFFAOYSA-N 0 0 359.329 3.846 20 5 FHBDRN Cc1ccc(Sc2ccc(C(=O)N(C)C[C@H](C)O)cc2[N+](=O)[O-])cc1 ZINC000126504211 931904872 /nfs/dbraw/zinc/90/48/72/931904872.db2.gz ICPNPSMJHFCUMA-ZDUSSCGKSA-N 0 0 360.435 3.507 20 5 FHBDRN CSc1ccc(NC(=O)COc2c(Cl)cccc2[N+](=O)[O-])cc1 ZINC000177989061 931939239 /nfs/dbraw/zinc/93/92/39/931939239.db2.gz UAEXMYQXUBKLDQ-UHFFFAOYSA-N 0 0 352.799 3.988 20 5 FHBDRN COc1cc(OCC(=O)N2CCCCC[C@H]2c2ccco2)ccc1[N+](=O)[O-] ZINC000135136300 931958385 /nfs/dbraw/zinc/95/83/85/931958385.db2.gz HWPDTJWGYARRLQ-HNNXBMFYSA-N 0 0 374.393 3.719 20 5 FHBDRN CC[C@@H](Cc1ccccc1)N(C)S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1 ZINC000467079693 931975580 /nfs/dbraw/zinc/97/55/80/931975580.db2.gz PYBXBNNIHKMQPE-AWEZNQCLSA-N 0 0 368.480 3.607 20 5 FHBDRN O=C(COC(=O)c1ccc(Cl)cc1[N+](=O)[O-])NC1CCCCCCC1 ZINC000003386758 931985810 /nfs/dbraw/zinc/98/58/10/931985810.db2.gz HKHNUMMUOQZDHC-UHFFFAOYSA-N 0 0 368.817 3.634 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1)N(CCCO)Cc1cccc(Cl)c1 ZINC000135161914 932006184 /nfs/dbraw/zinc/00/61/84/932006184.db2.gz LKTKHEQQWXDKPV-UHFFFAOYSA-N 0 0 363.801 3.665 20 5 FHBDRN C[C@H]1CN(C(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)C[C@H](C(F)(F)F)O1 ZINC000610398213 932011278 /nfs/dbraw/zinc/01/12/78/932011278.db2.gz ARRFHEYDAMRGJI-IINYFYTJSA-N 0 0 374.359 3.684 20 5 FHBDRN Cc1nn(C)c(C(=O)O[C@@H](C)c2ccc(C(F)(F)F)cc2)c1[N+](=O)[O-] ZINC000728334155 932012929 /nfs/dbraw/zinc/01/29/29/932012929.db2.gz NUSRLBXFOPZLOM-VIFPVBQESA-N 0 0 357.288 3.574 20 5 FHBDRN Cc1c(NC(=O)[C@H](C)N2CC[C@@H]2c2cccc(F)c2)cccc1[N+](=O)[O-] ZINC000610505225 932014860 /nfs/dbraw/zinc/01/48/60/932014860.db2.gz CSNIKBSYPWVEAI-SCLBCKFNSA-N 0 0 357.385 3.816 20 5 FHBDRN COc1ccc(NC(=O)[C@@H](C)N2CC[C@@H]2c2cccc(F)c2)c([N+](=O)[O-])c1 ZINC000610505307 932016134 /nfs/dbraw/zinc/01/61/34/932016134.db2.gz GHVQNPVLEUNBSC-SJKOYZFVSA-N 0 0 373.384 3.517 20 5 FHBDRN CC(C)(C)[C@H]1OCCC[C@@H]1CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000135169095 932021390 /nfs/dbraw/zinc/02/13/90/932021390.db2.gz CACNMAMQXTWPPK-YJYMSZOUSA-N 0 0 373.453 3.576 20 5 FHBDRN C[C@@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@H]1COc2ccccc21 ZINC000165691878 932037837 /nfs/dbraw/zinc/03/78/37/932037837.db2.gz ILZFFKVMTOIILD-ZWNOBZJWSA-N 0 0 361.785 3.934 20 5 FHBDRN Cc1cc([C@@H](C)NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3F)n2)c(C)o1 ZINC001125501052 932041532 /nfs/dbraw/zinc/04/15/32/932041532.db2.gz AXULMLHZUAPDAB-LLVKDONJSA-N 0 0 372.356 3.620 20 5 FHBDRN Cc1cccc(C)c1NCC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000135185591 932042257 /nfs/dbraw/zinc/04/22/57/932042257.db2.gz QQPDFMGEOKVIPK-UHFFFAOYSA-N 0 0 353.422 3.815 20 5 FHBDRN CCOc1ccc(C(=O)N2CC[C@@H](Cc3ccc(F)cc3)C2)cc1[N+](=O)[O-] ZINC000135195585 932048021 /nfs/dbraw/zinc/04/80/21/932048021.db2.gz RUYWROFNVXCXPY-HNNXBMFYSA-N 0 0 372.396 3.837 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)NC1(c2ccccc2F)CC1 ZINC000135218596 932055004 /nfs/dbraw/zinc/05/50/04/932055004.db2.gz RDUHTPRRERMVPB-UHFFFAOYSA-N 0 0 353.353 3.563 20 5 FHBDRN C[C@@H]1CCCN(c2ccc(C(=O)N3CCC[C@@H]3C(F)F)cc2[N+](=O)[O-])C1 ZINC000561378180 932058278 /nfs/dbraw/zinc/05/82/78/932058278.db2.gz XYIXJRXVUCYVRX-IUODEOHRSA-N 0 0 367.396 3.701 20 5 FHBDRN CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)c1c(F)ccc(F)c1F ZINC000121376160 932075827 /nfs/dbraw/zinc/07/58/27/932075827.db2.gz BKDHWLTUSHHHLL-UHFFFAOYSA-N 0 0 358.703 3.938 20 5 FHBDRN O=[N+]([O-])c1ccc(OC(F)F)c(NCc2nnc(-c3ccccc3)o2)c1 ZINC000178018840 932095101 /nfs/dbraw/zinc/09/51/01/932095101.db2.gz UQDUGFLDFCNKEE-UHFFFAOYSA-N 0 0 362.292 3.858 20 5 FHBDRN COc1cc(C(=O)N2C[C@@H](c3ccc(F)cc3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000135246548 932096734 /nfs/dbraw/zinc/09/67/34/932096734.db2.gz IWTLLMDTCPCIOV-DOMZBBRYSA-N 0 0 358.369 3.761 20 5 FHBDRN CC1(C)[C@@H](C(F)(F)F)CCN1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000276228657 932115066 /nfs/dbraw/zinc/11/50/66/932115066.db2.gz KBFQMFSNHZCDLH-LBPRGKRZSA-N 0 0 370.331 3.808 20 5 FHBDRN COc1cccc(-c2cc(NC(=O)c3ccc([N+](=O)[O-])cc3C)n(C)n2)c1 ZINC000119365802 932122912 /nfs/dbraw/zinc/12/29/12/932122912.db2.gz ZRZDSLGDGBUNFK-UHFFFAOYSA-N 0 0 366.377 3.565 20 5 FHBDRN Cn1cc(NC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)c(-c2ccccc2)n1 ZINC001266745373 932140489 /nfs/dbraw/zinc/14/04/89/932140489.db2.gz VDLBFHMXNLHPCW-DLBZAZTESA-N 0 0 362.389 3.738 20 5 FHBDRN CS(=O)(=O)c1cc([N+](=O)[O-])ccc1N[C@@H]1CCCc2sccc21 ZINC000276307897 932162471 /nfs/dbraw/zinc/16/24/71/932162471.db2.gz OAUQTISROYDDJS-GFCCVEGCSA-N 0 0 352.437 3.549 20 5 FHBDRN Cc1nc(-c2ccccc2)sc1[C@@H](C)OC(=O)c1nn(C)cc1[N+](=O)[O-] ZINC000780371584 932172487 /nfs/dbraw/zinc/17/24/87/932172487.db2.gz VTZDMNDTQCHLCR-LLVKDONJSA-N 0 0 372.406 3.678 20 5 FHBDRN CC(C)[C@H](NC(=O)COc1ccccc1[N+](=O)[O-])c1ccc(F)cc1F ZINC000119386913 932177968 /nfs/dbraw/zinc/17/79/68/932177968.db2.gz ZMIGHURHAXJMIO-SFHVURJKSA-N 0 0 364.348 3.765 20 5 FHBDRN O=C(c1csc(-c2ccc([N+](=O)[O-])cc2)n1)N1CCCc2occc2C1 ZINC000581512157 932189431 /nfs/dbraw/zinc/18/94/31/932189431.db2.gz PMGVLKKPDOHPDX-UHFFFAOYSA-N 0 0 369.402 3.900 20 5 FHBDRN COc1ccc(-c2nc(Cc3csc(C(C)C)n3)no2)cc1[N+](=O)[O-] ZINC000581520165 932197837 /nfs/dbraw/zinc/19/78/37/932197837.db2.gz KEKVMMWETRPGDH-UHFFFAOYSA-N 0 0 360.395 3.824 20 5 FHBDRN C[C@H]1C[C@H](C)CN(c2ccc(C(=O)Nc3ccncc3)cc2[N+](=O)[O-])C1 ZINC000022260350 932231642 /nfs/dbraw/zinc/23/16/42/932231642.db2.gz YQRVKPIPSOQQPL-KBPBESRZSA-N 0 0 354.410 3.724 20 5 FHBDRN COC(=O)c1cc(NC(=O)CSc2ccc([N+](=O)[O-])cc2)c(C)cc1C ZINC000471672050 932245534 /nfs/dbraw/zinc/24/55/34/932245534.db2.gz RXRHGBAXTDTUNZ-UHFFFAOYSA-N 0 0 374.418 3.729 20 5 FHBDRN C[C@]1(C(=O)OCC(=O)c2ccc([N+](=O)[O-])cc2)CCCc2ccccc21 ZINC000728343623 932253029 /nfs/dbraw/zinc/25/30/29/932253029.db2.gz UEZAELUTEUSZQP-FQEVSTJZSA-N 0 0 353.374 3.615 20 5 FHBDRN O=C(NCc1cccc([N+](=O)[O-])c1)NC[C@@H]1CCCC[C@@H]1C(F)(F)F ZINC000610509879 932255410 /nfs/dbraw/zinc/25/54/10/932255410.db2.gz VVEVHQDGUTYFBA-JSGCOSHPSA-N 0 0 359.348 3.763 20 5 FHBDRN CCCc1ccccc1NC(=O)C(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000178064943 932265822 /nfs/dbraw/zinc/26/58/22/932265822.db2.gz SCIJZJMRMDFWIS-CQSZACIVSA-N 0 0 369.421 3.672 20 5 FHBDRN Cc1cc(Br)ccc1NC(=O)c1cccc([N+](=O)[O-])c1N ZINC000157279524 932286230 /nfs/dbraw/zinc/28/62/30/932286230.db2.gz MKSVAVQSHYCMDL-UHFFFAOYSA-N 0 0 350.172 3.500 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@@H]2CCCOc3ccccc32)c1 ZINC000157273103 932286425 /nfs/dbraw/zinc/28/64/25/932286425.db2.gz ANZQVQZYHHRTJQ-MRXNPFEDSA-N 0 0 370.405 3.702 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)c2ccc(C(=O)NC(C)C)cc2)cc1[N+](=O)[O-] ZINC000119402859 932295940 /nfs/dbraw/zinc/29/59/40/932295940.db2.gz ZWGBYSLDIADTST-CQSZACIVSA-N 0 0 369.421 3.532 20 5 FHBDRN CC(C)n1nc2c(c1NC(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F)CCC2 ZINC000471674839 932297930 /nfs/dbraw/zinc/29/79/30/932297930.db2.gz XKWXKFGTSAJAMN-LLVKDONJSA-N 0 0 360.389 3.742 20 5 FHBDRN CC1CCN(c2ccc(C(=O)Nc3ccccc3N)cc2[N+](=O)[O-])CC1 ZINC000119404836 932299298 /nfs/dbraw/zinc/29/92/98/932299298.db2.gz UAYBEJKQQKWDPO-UHFFFAOYSA-N 0 0 354.410 3.666 20 5 FHBDRN C[C@@H](Nc1ccc([N+](=O)[O-])c(OC(F)F)c1)c1ccc2[nH]c(=O)[nH]c2c1 ZINC000610514871 932328798 /nfs/dbraw/zinc/32/87/98/932328798.db2.gz INUXSIGWYQORGF-MRVPVSSYSA-N 0 0 364.308 3.951 20 5 FHBDRN CCOc1cc(N(C)Cc2ccc(C(=O)NC3CC3)cc2)ccc1[N+](=O)[O-] ZINC000610514652 932329257 /nfs/dbraw/zinc/32/92/57/932329257.db2.gz UNJHFMYOALUSRM-UHFFFAOYSA-N 0 0 369.421 3.522 20 5 FHBDRN Cc1ccc(C(=O)Nc2c(-c3ccncc3)nc3ccccn32)cc1[N+](=O)[O-] ZINC000430619606 932342727 /nfs/dbraw/zinc/34/27/27/932342727.db2.gz ABOAGYRZLFSSNT-UHFFFAOYSA-N 0 0 373.372 3.865 20 5 FHBDRN COc1ccc(N(C)C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)c(OC)c1 ZINC000127199910 932343773 /nfs/dbraw/zinc/34/37/73/932343773.db2.gz VQMAKMYHDPONOQ-UHFFFAOYSA-N 0 0 350.758 3.542 20 5 FHBDRN CC(=O)Nc1cccc(NC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)c1 ZINC000157839491 932349279 /nfs/dbraw/zinc/34/92/79/932349279.db2.gz JCOPLEOVDGUQMH-UHFFFAOYSA-N 0 0 370.409 3.698 20 5 FHBDRN Cc1c(NC(=O)N(C)CCCCCO)cc([N+](=O)[O-])cc1C(F)(F)F ZINC000933342371 932353599 /nfs/dbraw/zinc/35/35/99/932353599.db2.gz FURJGADGQCWUPN-UHFFFAOYSA-N 0 0 363.336 3.548 20 5 FHBDRN Cc1nn(C)c(C(=O)NCC2(C3CCCCC3)CCCCC2)c1[N+](=O)[O-] ZINC000126687676 932355726 /nfs/dbraw/zinc/35/57/26/932355726.db2.gz VPWGQMIHBGDAIJ-UHFFFAOYSA-N 0 0 362.474 3.897 20 5 FHBDRN Cc1c(NC(=O)N2CCCOC[C@@H]2C)cc([N+](=O)[O-])cc1C(F)(F)F ZINC000933344111 932361269 /nfs/dbraw/zinc/36/12/69/932361269.db2.gz XLQAKRUIAMPHKS-VIFPVBQESA-N 0 0 361.320 3.565 20 5 FHBDRN COc1ccc([C@H]2CCN(C(=O)Nc3ccc(C)c([N+](=O)[O-])c3)C2)cc1 ZINC000157850655 932365007 /nfs/dbraw/zinc/36/50/07/932365007.db2.gz XEFASTSSENGURV-HNNXBMFYSA-N 0 0 355.394 3.933 20 5 FHBDRN COc1ccc(CN(C)C(=O)c2ccc(Cl)cc2[N+](=O)[O-])c(OC)c1 ZINC000023057813 932371861 /nfs/dbraw/zinc/37/18/61/932371861.db2.gz QGIBFCADISMHKZ-UHFFFAOYSA-N 0 0 364.785 3.538 20 5 FHBDRN CCO[C@H]1CCN(C(=O)Nc2cc([N+](=O)[O-])cc(C(F)(F)F)c2C)C1 ZINC000933346869 932379771 /nfs/dbraw/zinc/37/97/71/932379771.db2.gz ZVXCZLYDCVVQQV-NSHDSACASA-N 0 0 361.320 3.565 20 5 FHBDRN Cc1ncsc1CN(C)Cc1cccc([N+](=O)[O-])c1Br ZINC000234322306 932430147 /nfs/dbraw/zinc/43/01/47/932430147.db2.gz QWBHASHIAHLLGZ-UHFFFAOYSA-N 0 0 356.245 3.754 20 5 FHBDRN COC1(CNC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)CCC(C)CC1 ZINC000477298467 932456838 /nfs/dbraw/zinc/45/68/38/932456838.db2.gz UJSMDOQFWJLFDE-TXKKKEFDSA-N 0 0 366.483 3.787 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1C(=O)NCc1c(F)cccc1OC(F)F ZINC000477302418 932456946 /nfs/dbraw/zinc/45/69/46/932456946.db2.gz MJGHZVLTSRHRBM-UHFFFAOYSA-N 0 0 354.284 3.574 20 5 FHBDRN C[C@H](CNC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)c1ccncc1 ZINC000610526583 932483636 /nfs/dbraw/zinc/48/36/36/932483636.db2.gz PKEPKTIIQYQBPR-GFCCVEGCSA-N 0 0 368.418 3.647 20 5 FHBDRN CCc1ccc(C(=O)Nc2cccc(Oc3cccnn3)c2)cc1[N+](=O)[O-] ZINC000175917928 932499180 /nfs/dbraw/zinc/49/91/80/932499180.db2.gz NCGJZWDDJUDJIE-UHFFFAOYSA-N 0 0 364.361 3.992 20 5 FHBDRN CCS[C@@H]1CCC[C@@H]1NC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000178106136 932509676 /nfs/dbraw/zinc/50/96/76/932509676.db2.gz QNGPQEUSKDXGRZ-QWHCGFSZSA-N 0 0 373.272 3.761 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)Nc2cc(C)cnc2Cl)cc1OC ZINC000276506420 932509984 /nfs/dbraw/zinc/50/99/84/932509984.db2.gz QHWILJVBYRJJTR-UHFFFAOYSA-N 0 0 365.773 3.611 20 5 FHBDRN COc1cc(OC)cc(-c2noc([C@H](C)c3cccc([N+](=O)[O-])c3)n2)c1 ZINC000581692763 932511279 /nfs/dbraw/zinc/51/12/79/932511279.db2.gz PQYOVHIJUNTQAI-LLVKDONJSA-N 0 0 355.350 3.814 20 5 FHBDRN CCOCCC1(C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)CCC1 ZINC000157415637 932511497 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20 5 FHBDRN C[C@@H](C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)N1C2CCC1CC2 ZINC000610538543 932682649 /nfs/dbraw/zinc/68/26/49/932682649.db2.gz QWWFATQHOGTVGX-XGNXJENSSA-N 0 0 372.450 3.672 20 5 FHBDRN C[C@@H](c1ccccc1[N+](=O)[O-])N1CCC[C@H](NC(=O)c2ccccc2)C1 ZINC001167483650 932698655 /nfs/dbraw/zinc/69/86/55/932698655.db2.gz YCDOGCPFUSRFFU-RDJZCZTQSA-N 0 0 353.422 3.550 20 5 FHBDRN CC(=O)Nc1ccc(C)c(NCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)c1 ZINC000098040920 932716116 /nfs/dbraw/zinc/71/61/16/932716116.db2.gz GFLQMWHQMDLEKI-UHFFFAOYSA-N 0 0 367.365 3.524 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)NCCc1cc(F)cc(F)c1 ZINC000477611801 932733145 /nfs/dbraw/zinc/73/31/45/932733145.db2.gz UNULKWYRBBKQGN-UHFFFAOYSA-N 0 0 354.740 3.807 20 5 FHBDRN CC(=O)Nc1cccc2c1CCCN2CCCOc1ccc([N+](=O)[O-])cc1 ZINC000055905964 932739156 /nfs/dbraw/zinc/73/91/56/932739156.db2.gz JEAXBMGUMVVRMU-UHFFFAOYSA-N 0 0 369.421 3.775 20 5 FHBDRN CC[C@@H](C(=O)O[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000003446451 932760721 /nfs/dbraw/zinc/76/07/21/932760721.db2.gz JHRALTZMKKAFDP-SUMWQHHRSA-N 0 0 356.378 3.659 20 5 FHBDRN Cc1cc(F)ccc1OS(=O)(=O)c1cc([N+](=O)[O-])c(C)cc1Cl ZINC000754808224 932769472 /nfs/dbraw/zinc/76/94/72/932769472.db2.gz KEPLCGVQZKUEJP-UHFFFAOYSA-N 0 0 359.762 3.772 20 5 FHBDRN CC1(C)[C@H](NC(=O)c2ccccc2[N+](=O)[O-])C[C@H]1OCc1ccccc1 ZINC000187435373 932776398 /nfs/dbraw/zinc/77/63/98/932776398.db2.gz GGDDTXFMQFTNEA-QZTJIDSGSA-N 0 0 354.406 3.709 20 5 FHBDRN O=C(c1csc([N+](=O)[O-])c1)N1CCN(C2CC2)c2cc(Cl)ccc21 ZINC000548273695 932791138 /nfs/dbraw/zinc/79/11/38/932791138.db2.gz OTHKPWYSCFJOKD-UHFFFAOYSA-N 0 0 363.826 3.939 20 5 FHBDRN O=C(Cc1cccc2cnccc21)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001266834839 932812942 /nfs/dbraw/zinc/81/29/42/932812942.db2.gz FOCXCYZUCFHVAP-UHFFFAOYSA-N 0 0 361.401 3.877 20 5 FHBDRN COc1ccc(N(C)C(=O)c2ccc(Cl)cc2[N+](=O)[O-])c(OC)c1 ZINC000127334929 932857859 /nfs/dbraw/zinc/85/78/59/932857859.db2.gz SAGIXJJKNVAUKZ-UHFFFAOYSA-N 0 0 350.758 3.542 20 5 FHBDRN O=[N+]([O-])c1c(NCCc2nc3cc(F)ccc3[nH]2)ccc2ncccc21 ZINC000178212082 932877332 /nfs/dbraw/zinc/87/73/32/932877332.db2.gz NMELUSVXBJUSOS-UHFFFAOYSA-N 0 0 351.341 3.813 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1CNc1ccc2c(c1)CN(C)C(=O)N2 ZINC000187469089 932894224 /nfs/dbraw/zinc/89/42/24/932894224.db2.gz ATVWSVCWKOWCTA-UHFFFAOYSA-N 0 0 356.382 3.583 20 5 FHBDRN COCCC1(CNC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)CCCCC1 ZINC000187470421 932896405 /nfs/dbraw/zinc/89/64/05/932896405.db2.gz HYGDIKBNCBIYOD-UHFFFAOYSA-N 0 0 368.861 3.894 20 5 FHBDRN Cc1sc(C(=O)NCCc2cn(C)c3cc(F)ccc23)cc1[N+](=O)[O-] ZINC000187481667 932916077 /nfs/dbraw/zinc/91/60/77/932916077.db2.gz OGQSQKMAJXNREB-UHFFFAOYSA-N 0 0 361.398 3.568 20 5 FHBDRN Cc1c2ccccc2oc1CNC(=O)COc1ccc([N+](=O)[O-])c(C)c1 ZINC000430683491 932918354 /nfs/dbraw/zinc/91/83/54/932918354.db2.gz KGRVJHPFPLLITH-UHFFFAOYSA-N 0 0 354.362 3.653 20 5 FHBDRN CC(C)NC(=O)CCCC(=O)Oc1ccc(-c2ccccc2)cc1[N+](=O)[O-] ZINC000121516731 932920782 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FHBDRN CCc1ccc(C(=O)NCCCn2c(C)nc3ccccc32)cc1[N+](=O)[O-] ZINC000471812047 933001069 /nfs/dbraw/zinc/00/10/69/933001069.db2.gz UOLXCWGFHZVRHU-UHFFFAOYSA-N 0 0 366.421 3.635 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CC[C@H](n3cnc4c3CCCC4)C2)c2ncccc12 ZINC000548334286 933008164 /nfs/dbraw/zinc/00/81/64/933008164.db2.gz WXHXCVPHTRQTNL-AWEZNQCLSA-N 0 0 363.421 3.670 20 5 FHBDRN CC(C)(CNC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)[C@H]1CCCCO1 ZINC000610960465 933011692 /nfs/dbraw/zinc/01/16/92/933011692.db2.gz IRKUUFDKBYTEQY-CQSZACIVSA-N 0 0 374.359 3.939 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)N2C[C@@H]3CCCC[C@@H]3C2)cc1SC ZINC000178276037 933021091 /nfs/dbraw/zinc/02/10/91/933021091.db2.gz CDHHPBBJLIKSRF-TXEJJXNPSA-N 0 0 350.440 3.588 20 5 FHBDRN CC[C@@H](NC(=O)c1ccc(Br)cc1[N+](=O)[O-])c1nccs1 ZINC000175992149 933029686 /nfs/dbraw/zinc/02/96/86/933029686.db2.gz WCHRQWXHXGQXII-SNVBAGLBSA-N 0 0 370.228 3.695 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)NC1CCN(c2ccccc2)CC1 ZINC000588438322 933055680 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CC(C)Cc1ncc(CN2CCN(c3cccc([N+](=O)[O-])c3)CC2)s1 ZINC000510535482 933196116 /nfs/dbraw/zinc/19/61/16/933196116.db2.gz BJAQMNYMHIRBQE-UHFFFAOYSA-N 0 0 360.483 3.572 20 5 FHBDRN C[C@@H](c1ccccc1)N(C1CC1)S(=O)(=O)CCc1ccccc1[N+](=O)[O-] ZINC000510540846 933203568 /nfs/dbraw/zinc/20/35/68/933203568.db2.gz WVMQXRGKTUAOJC-HNNXBMFYSA-N 0 0 374.462 3.693 20 5 FHBDRN COc1cc(CNC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)ccc1C ZINC000178328545 933224216 /nfs/dbraw/zinc/22/42/16/933224216.db2.gz BDOAUGUZWLLXPQ-UHFFFAOYSA-N 0 0 369.421 3.786 20 5 FHBDRN Cc1oc2ccccc2c1CNC(=O)COc1ccc([N+](=O)[O-])c(C)c1 ZINC000430793281 933243187 /nfs/dbraw/zinc/24/31/87/933243187.db2.gz VWEWCFIHVAORLZ-UHFFFAOYSA-N 0 0 354.362 3.653 20 5 FHBDRN CC(=O)c1ccc(Cl)c(NC(=O)COc2ccc([N+](=O)[O-])c(C)c2)c1 ZINC000430797729 933245739 /nfs/dbraw/zinc/24/57/39/933245739.db2.gz PVPUINHFYYILKM-UHFFFAOYSA-N 0 0 362.769 3.777 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)NCc1c(F)cc(F)c(F)c1F ZINC000430811700 933248087 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20 5 FHBDRN C[C@@H]1CCCC[C@@H]1CCNC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000510611049 933282579 /nfs/dbraw/zinc/28/25/79/933282579.db2.gz MQEYMRCQVDTACM-HUUCEWRRSA-N 0 0 370.453 3.942 20 5 FHBDRN Cc1cc(OCC(=O)N[C@@H]2CC[C@H](c3ccccc3F)C2)ccc1[N+](=O)[O-] ZINC000430838700 933287967 /nfs/dbraw/zinc/28/79/67/933287967.db2.gz PMGFOSXUMTWRIO-LSDHHAIUSA-N 0 0 372.396 3.874 20 5 FHBDRN C[C@H]1CO[C@H](c2ccccc2)CN1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610581372 933301452 /nfs/dbraw/zinc/30/14/52/933301452.db2.gz LNHNYIXWXDRVJY-UGSOOPFHSA-N 0 0 353.378 3.698 20 5 FHBDRN Cc1cc(OCC(=O)N2CCCc3c(F)ccc(F)c32)ccc1[N+](=O)[O-] ZINC000430842331 933302635 /nfs/dbraw/zinc/30/26/35/933302635.db2.gz ZPIPQVLUEGDPKJ-UHFFFAOYSA-N 0 0 362.332 3.540 20 5 FHBDRN C[C@@H](c1ccc([S@@](C)=O)cc1)N(C)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610582292 933330324 /nfs/dbraw/zinc/33/03/24/933330324.db2.gz BWQLQIPDGYHDLL-GWQKEKGPSA-N 0 0 373.434 3.666 20 5 FHBDRN Cc1cc(C)cc([C@@H]2NC(=O)N([C@H](C)c3cccc([N+](=O)[O-])c3)C2=O)c1 ZINC000430878174 933342872 /nfs/dbraw/zinc/34/28/72/933342872.db2.gz MCARNYQKCSEZMA-DYVFJYSZSA-N 0 0 353.378 3.566 20 5 FHBDRN COc1cc(CN2CC(C)=C[C@@H](C)C2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000430882218 933355276 /nfs/dbraw/zinc/35/52/76/933355276.db2.gz IPSVRRIWLMRQSM-LLVKDONJSA-N 0 0 374.359 3.943 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)N[C@@H]2C[C@@H]2c2cccc(F)c2)cc1[N+](=O)[O-] ZINC000176018428 933358427 /nfs/dbraw/zinc/35/84/27/933358427.db2.gz WPEHRUGVPYEPHT-JCURWCKSSA-N 0 0 357.385 3.959 20 5 FHBDRN CN(C(=O)CCc1ncc(-c2ccc(F)cc2)o1)c1cccc([N+](=O)[O-])c1 ZINC000158003606 933359452 /nfs/dbraw/zinc/35/94/52/933359452.db2.gz JKLCKHQZFYEEPA-UHFFFAOYSA-N 0 0 369.352 3.985 20 5 FHBDRN C[C@H](c1cccc([N+](=O)[O-])c1)N1C(=O)[C@@H]2C[C@H](C3CCCCC3)CN2C1=O ZINC000430884950 933363370 /nfs/dbraw/zinc/36/33/70/933363370.db2.gz YNWOPGRBBVPGAF-SKDZVZGDSA-N 0 0 371.437 3.889 20 5 FHBDRN COc1ccc(CNC(=O)Nc2cccc(Cl)c2OC)cc1[N+](=O)[O-] ZINC000510663855 933380375 /nfs/dbraw/zinc/38/03/75/933380375.db2.gz GTQAGKSNADCUHN-UHFFFAOYSA-N 0 0 365.773 3.587 20 5 FHBDRN CC[C@@H](OC(=O)CCn1nc(C)c([N+](=O)[O-])c1C)c1ccc(C)c(F)c1 ZINC001266902059 933417729 /nfs/dbraw/zinc/41/77/29/933417729.db2.gz DJTURUSUVUIWIP-MRXNPFEDSA-N 0 0 363.389 3.940 20 5 FHBDRN O=C(N[C@@H]1C[C@@H]1c1cccc(F)c1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000178344646 933436926 /nfs/dbraw/zinc/43/69/26/933436926.db2.gz SYGSJTYFQJZQCV-RTBURBONSA-N 0 0 369.396 3.964 20 5 FHBDRN O=[N+]([O-])c1cnc(N2C[C@@H](C(F)(F)F)[C@H](C(F)(F)F)C2)c(Cl)c1 ZINC000610587758 933439344 /nfs/dbraw/zinc/43/93/44/933439344.db2.gz XKYKTYFUQGMCAL-RNFRBKRXSA-N 0 0 363.645 3.820 20 5 FHBDRN CCOC(=O)c1ccc(CNc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)o1 ZINC000610588700 933443854 /nfs/dbraw/zinc/44/38/54/933443854.db2.gz FEPIXLGMNMLOOB-UHFFFAOYSA-N 0 0 358.272 3.995 20 5 FHBDRN CCCc1n[nH]c(C(=O)N(CC)Cc2ccccc2Cl)c1[N+](=O)[O-] ZINC000135386708 933444937 /nfs/dbraw/zinc/44/49/37/933444937.db2.gz LYXYLYSCLVTUGS-UHFFFAOYSA-N 0 0 350.806 3.586 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)NCc2cccnc2OC(C)C)cc1[N+](=O)[O-] ZINC000610593324 933457219 /nfs/dbraw/zinc/45/72/19/933457219.db2.gz QXRIKQHEVYURKP-AWEZNQCLSA-N 0 0 372.425 3.646 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)N2CCOc3ccccc3C2)cc1[N+](=O)[O-] ZINC000610597083 933482660 /nfs/dbraw/zinc/48/26/60/933482660.db2.gz DQDUCGVKGDELAQ-CQSZACIVSA-N 0 0 355.394 3.568 20 5 FHBDRN CC[C@H](NC(=O)COc1cccc([N+](=O)[O-])c1)c1ccc(Cl)s1 ZINC000510709434 933496067 /nfs/dbraw/zinc/49/60/67/933496067.db2.gz MZMUXHXAWGPBHV-LBPRGKRZSA-N 0 0 354.815 3.956 20 5 FHBDRN Cc1cc(C(=O)N2C[C@@H](C(F)(F)F)[C@H](C(F)(F)F)C2)ccc1[N+](=O)[O-] ZINC000610598093 933496993 /nfs/dbraw/zinc/49/69/93/933496993.db2.gz SBLDMACQCOBJLR-NXEZZACHSA-N 0 0 370.249 3.716 20 5 FHBDRN C[C@@H]1Oc2ccccc2[C@H]1Nc1ncc([N+](=O)[O-])cc1Br ZINC000561701737 933502381 /nfs/dbraw/zinc/50/23/81/933502381.db2.gz PIENOAMEVFILLC-SDBXPKJASA-N 0 0 350.172 3.686 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CN1C[C@H](C(F)(F)F)[C@@H](C(F)(F)F)C1 ZINC000610605053 933514203 /nfs/dbraw/zinc/51/42/03/933514203.db2.gz WGLPZDIKISOKGM-QWRGUYRKSA-N 0 0 372.265 3.776 20 5 FHBDRN CC(C)Oc1ccc(F)cc1NCC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000178362894 933519884 /nfs/dbraw/zinc/51/98/84/933519884.db2.gz SLMFCBLHDBPVTK-UHFFFAOYSA-N 0 0 373.384 3.522 20 5 FHBDRN O=C(NCc1c(F)c(F)cc(F)c1F)c1c(Cl)cccc1[N+](=O)[O-] ZINC000610624385 933544075 /nfs/dbraw/zinc/54/40/75/933544075.db2.gz UOGYAQWGHNYACU-UHFFFAOYSA-N 0 0 362.666 3.735 20 5 FHBDRN Cc1ccccc1[C@H]1CN(C(=O)Nc2cc(F)cc([N+](=O)[O-])c2)CCO1 ZINC000548416316 933560092 /nfs/dbraw/zinc/56/00/92/933560092.db2.gz FBVWMYTWPNWRJN-QGZVFWFLSA-N 0 0 359.357 3.648 20 5 FHBDRN CC(C)CCC[C@@H](C)NC(=O)COc1ccc([N+](=O)[O-])c2ncccc12 ZINC000471897871 933561603 /nfs/dbraw/zinc/56/16/03/933561603.db2.gz IKGYJMPDDJIHBQ-CQSZACIVSA-N 0 0 359.426 3.853 20 5 FHBDRN Cc1cccnc1/C=C\C(=O)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC000588453947 933570461 /nfs/dbraw/zinc/57/04/61/933570461.db2.gz IJSVUIXVGFIAHW-SREVYHEPSA-N 0 0 362.183 3.713 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)CCCn2cnc3ccccc32)cc1[N+](=O)[O-] ZINC000610636106 933580641 /nfs/dbraw/zinc/58/06/41/933580641.db2.gz VZFQFRDJJBCVEQ-OAHLLOKOSA-N 0 0 366.421 3.911 20 5 FHBDRN COC(=O)[C@@H](C)Cc1ccc(NC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)cc1 ZINC000588454620 933582634 /nfs/dbraw/zinc/58/26/34/933582634.db2.gz XPLIKSXHSZMOSK-VDBIKXPHSA-N 0 0 368.389 3.598 20 5 FHBDRN CC(C)(NC(=O)N[C@@H]1C[C@@]1(C)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000610643672 933584486 /nfs/dbraw/zinc/58/44/86/933584486.db2.gz VRZYABLUWXKSNP-XLIONFOSSA-N 0 0 353.422 3.859 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1C[C@H]1c1ccccc1F ZINC000458043245 933607857 /nfs/dbraw/zinc/60/78/57/933607857.db2.gz PXNAXMVPFBLCCB-XNJJOIOASA-N 0 0 360.410 3.887 20 5 FHBDRN Cc1nn(C)c(C(=O)Nc2cccc(Oc3ccccc3)c2)c1[N+](=O)[O-] ZINC000098094282 933639385 /nfs/dbraw/zinc/63/93/85/933639385.db2.gz FJMKSRWKXYETAY-UHFFFAOYSA-N 0 0 352.350 3.681 20 5 FHBDRN CCCOc1ccc(NC(=O)NCc2ccc(OC)c([N+](=O)[O-])c2)cc1 ZINC000510748800 933640729 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FHBDRN O=C(NC[C@H]1CCO[C@@H]1c1ccccc1)c1c[nH]c2cccc([N+](=O)[O-])c21 ZINC000431037604 933726588 /nfs/dbraw/zinc/72/65/88/933726588.db2.gz KUDCOVQFHSOFKA-AUUYWEPGSA-N 0 0 365.389 3.584 20 5 FHBDRN COc1ccc(S[C@H](C)C(=O)N(C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000512954352 933760334 /nfs/dbraw/zinc/76/03/34/933760334.db2.gz GRXXMUNVJJUPIM-CQSZACIVSA-N 0 0 374.462 3.785 20 5 FHBDRN CCOC(=O)c1ccc(NC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000431073384 933783980 /nfs/dbraw/zinc/78/39/80/933783980.db2.gz XJUQSMOMALBGKM-UHFFFAOYSA-N 0 0 371.393 3.828 20 5 FHBDRN COc1ccc(N(CC(C)C)C(=O)COc2ccc([N+](=O)[O-])c(C)c2)cc1 ZINC000510817061 933805072 /nfs/dbraw/zinc/80/50/72/933805072.db2.gz VFSOGIQHHMKAFQ-UHFFFAOYSA-N 0 0 372.421 3.980 20 5 FHBDRN O=C(NC[C@H]1CCC(F)(F)C1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000431093815 933826073 /nfs/dbraw/zinc/82/60/73/933826073.db2.gz NROWZEKCBXWJBE-JTQLQIEISA-N 0 0 367.377 3.884 20 5 FHBDRN Cc1ccc(CNC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)cc1F ZINC000510839867 933840848 /nfs/dbraw/zinc/84/08/48/933840848.db2.gz YQSQOSUDSLKUFX-UHFFFAOYSA-N 0 0 369.299 3.965 20 5 FHBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])NC[C@@H]1CCC(F)(F)C1 ZINC000431110816 933851536 /nfs/dbraw/zinc/85/15/36/933851536.db2.gz VRTHWJZWNMZZIA-SECBINFHSA-N 0 0 364.801 3.892 20 5 FHBDRN Cc1nn(-c2ccccc2)cc1NC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000510847676 933854171 /nfs/dbraw/zinc/85/41/71/933854171.db2.gz SZAQPCIDWBLCJV-UHFFFAOYSA-N 0 0 361.361 3.823 20 5 FHBDRN COc1ccc(CNC(=O)N2CC(C)(C)c3ccccc32)cc1[N+](=O)[O-] ZINC000610706491 933856111 /nfs/dbraw/zinc/85/61/11/933856111.db2.gz CEVTWUQHJKCTSZ-UHFFFAOYSA-N 0 0 355.394 3.611 20 5 FHBDRN CC(C)Oc1ccccc1CNC(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000510851179 933866262 /nfs/dbraw/zinc/86/62/62/933866262.db2.gz GKUKBHDGOINHAQ-UHFFFAOYSA-N 0 0 371.437 3.766 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N[C@@H]1COc2c1cccc2Cl ZINC000610709754 933877942 /nfs/dbraw/zinc/87/79/42/933877942.db2.gz PEHAITXYALJQSX-CQSZACIVSA-N 0 0 367.188 3.694 20 5 FHBDRN CN(C[C@H]1CCCO[C@@H]1c1ccccc1)C(=O)c1ccc(F)cc1[N+](=O)[O-] ZINC000610712014 933893735 /nfs/dbraw/zinc/89/37/35/933893735.db2.gz KXKLDDCUQDNYLX-DNVCBOLYSA-N 0 0 372.396 3.974 20 5 FHBDRN CCCC(=O)Nc1ccc(CNC(=O)c2ccc([N+](=O)[O-])cc2C)cc1 ZINC000510876391 933917400 /nfs/dbraw/zinc/91/74/00/933917400.db2.gz JLHNBHHCNCXKBK-UHFFFAOYSA-N 0 0 355.394 3.572 20 5 FHBDRN COc1cc(O)cc(NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)c1 ZINC000510874378 933921873 /nfs/dbraw/zinc/92/18/73/933921873.db2.gz JXZNPXRKUOQFTL-UHFFFAOYSA-N 0 0 371.374 3.685 20 5 FHBDRN CCOc1cc(N2CCC(OC(=O)[C@H]3C[C@@H]3C3CC3)CC2)ccc1[N+](=O)[O-] ZINC000176150856 933926548 /nfs/dbraw/zinc/92/65/48/933926548.db2.gz QOCBCNNXFJOZIB-SJORKVTESA-N 0 0 374.437 3.552 20 5 FHBDRN C[C@H]1CN(C(=O)c2ccc(Sc3ccc([N+](=O)[O-])cc3)cc2)CCO1 ZINC000510879386 933928477 /nfs/dbraw/zinc/92/84/77/933928477.db2.gz QMVPPEMLWAILGD-ZDUSSCGKSA-N 0 0 358.419 3.607 20 5 FHBDRN CCOC(=O)c1cc(N[C@@H]2CCOc3cc(OC)ccc32)ccc1[N+](=O)[O-] ZINC000610717204 933932542 /nfs/dbraw/zinc/93/25/42/933932542.db2.gz CKOJLXXSVILGSL-MRXNPFEDSA-N 0 0 372.377 3.716 20 5 FHBDRN CC(C)(C)C(=O)CNC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000535663016 933946323 /nfs/dbraw/zinc/94/63/23/933946323.db2.gz ZJAYWBFFVXPIGM-UHFFFAOYSA-N 0 0 355.394 3.683 20 5 FHBDRN C/C(=C/c1nc(-c2ccc3c(c2)OCO3)no1)c1ccc([N+](=O)[O-])cc1 ZINC000544982401 933949743 /nfs/dbraw/zinc/94/97/43/933949743.db2.gz ADNBRXUDYHHNES-FLIBITNWSA-N 0 0 351.318 3.934 20 5 FHBDRN O=C(CSc1nccc2ccccc21)N1CCc2c1cccc2[N+](=O)[O-] ZINC000178404049 933958755 /nfs/dbraw/zinc/95/87/55/933958755.db2.gz BLIFSFKEMTZZTG-UHFFFAOYSA-N 0 0 365.414 3.824 20 5 FHBDRN CCCCc1nc(COc2ccc(C(=O)OC)cc2[N+](=O)[O-])cs1 ZINC000510891607 933963988 /nfs/dbraw/zinc/96/39/88/933963988.db2.gz AWGOHIDWMKTJSF-UHFFFAOYSA-N 0 0 350.396 3.760 20 5 FHBDRN C[C@@H](CC(=O)N1CCS[C@@H]1c1ccc([N+](=O)[O-])cc1)c1ccncc1 ZINC000610723589 933974965 /nfs/dbraw/zinc/97/49/65/933974965.db2.gz VQGQYKBMSUIZPT-SCLBCKFNSA-N 0 0 357.435 3.758 20 5 FHBDRN CCCOc1ccc(CNC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000510900301 933987930 /nfs/dbraw/zinc/98/79/30/933987930.db2.gz WVGJJRAAWWWJCP-UHFFFAOYSA-N 0 0 371.437 3.768 20 5 FHBDRN Cc1c(NC(=O)[C@@H]2C[C@@H](C)O[C@@H](C)C2)cc(Br)cc1[N+](=O)[O-] ZINC000431182989 934052513 /nfs/dbraw/zinc/05/25/13/934052513.db2.gz WFDKCBJSHXYDCV-DOFRTFSJSA-N 0 0 371.231 3.808 20 5 FHBDRN O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)N1CC(CC(F)(F)F)C1 ZINC000610743004 934058140 /nfs/dbraw/zinc/05/81/40/934058140.db2.gz SPGRWVHFNNVEEA-UHFFFAOYSA-N 0 0 369.246 3.612 20 5 FHBDRN C[C@H](c1ccccc1)n1ccc(=NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])[nH]1 ZINC000610746337 934068535 /nfs/dbraw/zinc/06/85/35/934068535.db2.gz ZNVDXTQLFJUSRZ-GFCCVEGCSA-N 0 0 370.796 3.728 20 5 FHBDRN C[C@H]1CCCN(C(=O)COc2ccc([N+](=O)[O-])cc2Cc2ccccc2)C1 ZINC000016458758 934101929 /nfs/dbraw/zinc/10/19/29/934101929.db2.gz HVIBIRCTVIIPNK-INIZCTEOSA-N 0 0 368.433 3.823 20 5 FHBDRN Cc1nc(-c2ccccc2)ccc1C(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000065124063 934112399 /nfs/dbraw/zinc/11/23/99/934112399.db2.gz UFMPYRFGGRXKNA-UHFFFAOYSA-N 0 0 361.401 3.938 20 5 FHBDRN CC(C)(CNc1ncc(Br)cc1[N+](=O)[O-])[C@@H]1CCCCO1 ZINC000610770254 934135499 /nfs/dbraw/zinc/13/54/99/934135499.db2.gz RJMJPPXMWPSODR-LBPRGKRZSA-N 0 0 358.236 3.760 20 5 FHBDRN COC(=O)c1cc(N2CCCO[C@@H](c3ccccc3)C2)cc(C)c1[N+](=O)[O-] ZINC000610769693 934137519 /nfs/dbraw/zinc/13/75/19/934137519.db2.gz GLWCCGNCYKOOPW-GOSISDBHSA-N 0 0 370.405 3.658 20 5 FHBDRN COC(=O)c1cc(N2CCCO[C@H](c3ccccc3)C2)cc(C)c1[N+](=O)[O-] ZINC000610769695 934137694 /nfs/dbraw/zinc/13/76/94/934137694.db2.gz GLWCCGNCYKOOPW-SFHVURJKSA-N 0 0 370.405 3.658 20 5 FHBDRN O=C(Cc1cccc([N+](=O)[O-])c1)NC[C@@H](c1ccccc1)C(F)(F)F ZINC000187669123 934138306 /nfs/dbraw/zinc/13/83/06/934138306.db2.gz ADDWLNSTEFFPSV-HNNXBMFYSA-N 0 0 352.312 3.600 20 5 FHBDRN COc1ccc([C@H](NC(=O)c2ccc([N+](=O)[O-])cn2)c2ccccc2)cc1 ZINC000610769411 934138591 /nfs/dbraw/zinc/13/85/91/934138591.db2.gz GVCSNEVNSHXDJQ-LJQANCHMSA-N 0 0 363.373 3.518 20 5 FHBDRN CC[C@H](C)c1nnc([C@H](C)NC(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)[nH]1 ZINC000276966630 934155676 /nfs/dbraw/zinc/15/56/76/934155676.db2.gz PVIIIAZJLBGZIK-CABZTGNLSA-N 0 0 360.418 3.726 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)N2CC[C@H](C(F)(F)F)[C@@H]2C)cc1[N+](=O)[O-] ZINC000471972083 934160300 /nfs/dbraw/zinc/16/03/00/934160300.db2.gz DXPJSWPRJYHAPU-GVXVVHGQSA-N 0 0 359.348 3.947 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)N2CC[C@@H](C(F)(F)F)[C@@H]2C)cc1[N+](=O)[O-] ZINC000471972082 934160536 /nfs/dbraw/zinc/16/05/36/934160536.db2.gz DXPJSWPRJYHAPU-GMXVVIOVSA-N 0 0 359.348 3.947 20 5 FHBDRN CO[C@H](CNC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)c1ccccc1Cl ZINC000610791094 934206594 /nfs/dbraw/zinc/20/65/94/934206594.db2.gz XFLNLZNRGBOHSG-MRXNPFEDSA-N 0 0 373.796 3.847 20 5 FHBDRN Cc1nn(CCC(=O)N2CCc3ccccc3[C@@H]2C(C)C)c(C)c1[N+](=O)[O-] ZINC000610790689 934211908 /nfs/dbraw/zinc/21/19/08/934211908.db2.gz BCLRQMCUKLDCOF-IBGZPJMESA-N 0 0 370.453 3.580 20 5 FHBDRN CCCN(Cc1cc([N+](=O)[O-])ccc1OC)C[C@H]1COc2ccccc2O1 ZINC000610795967 934223198 /nfs/dbraw/zinc/22/31/98/934223198.db2.gz NKBYIQRKOBQPJU-KRWDZBQOSA-N 0 0 372.421 3.655 20 5 FHBDRN Cc1c(NC(=O)COC2CCCC2)cc(Br)cc1[N+](=O)[O-] ZINC000431237200 934240696 /nfs/dbraw/zinc/24/06/96/934240696.db2.gz NWIQSQXYYBSNBA-UHFFFAOYSA-N 0 0 357.204 3.563 20 5 FHBDRN COc1ccc(C[C@@H](C)CNC(=O)Nc2cccc([N+](=O)[O-])c2)cc1OC ZINC000535679559 934259112 /nfs/dbraw/zinc/25/91/12/934259112.db2.gz GZQCBOJKCHCVAO-CYBMUJFWSA-N 0 0 373.409 3.612 20 5 FHBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1scnc1C1CC1 ZINC000535681919 934273943 /nfs/dbraw/zinc/27/39/43/934273943.db2.gz VOUPTSXQHLTCKX-MRVPVSSYSA-N 0 0 367.814 3.988 20 5 FHBDRN COc1ccc(CN(C)C(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)cc1C ZINC000535697858 934293297 /nfs/dbraw/zinc/29/32/97/934293297.db2.gz DOLVGISQCXKCLK-UHFFFAOYSA-N 0 0 353.378 3.665 20 5 FHBDRN CC(C)[C@]1(C)C[C@H]1NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000458104928 934304459 /nfs/dbraw/zinc/30/44/59/934304459.db2.gz MOENSOQYZLXUBZ-HIFRSBDPSA-N 0 0 360.332 3.700 20 5 FHBDRN C[C@@H](NC(=O)c1ccc([N+](=O)[O-])cn1)[C@H](C)c1ccccc1C(F)(F)F ZINC000535748449 934336950 /nfs/dbraw/zinc/33/69/50/934336950.db2.gz HMIANUQOFFMXAT-WDEREUQCSA-N 0 0 367.327 3.931 20 5 FHBDRN O=C(NC1CCC(C(F)F)CC1)c1cc(-c2ccc([N+](=O)[O-])cc2)n[nH]1 ZINC000458170414 934341996 /nfs/dbraw/zinc/34/19/96/934341996.db2.gz RCLMKYIPZPQBMD-UHFFFAOYSA-N 0 0 364.352 3.539 20 5 FHBDRN CC(C)(C(=O)NC1CCC(C(F)F)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000458178099 934348986 /nfs/dbraw/zinc/34/89/86/934348986.db2.gz ISNLFFZPKPCHCW-UHFFFAOYSA-N 0 0 358.360 3.952 20 5 FHBDRN O=C(NC1(C2CCC2)CCC1)c1sc(Br)cc1[N+](=O)[O-] ZINC000458190717 934364746 /nfs/dbraw/zinc/36/47/46/934364746.db2.gz AMJVEPDFKVXHFU-UHFFFAOYSA-N 0 0 359.245 3.871 20 5 FHBDRN CCC1(c2ccccc2)CN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1 ZINC000458210444 934379882 /nfs/dbraw/zinc/37/98/82/934379882.db2.gz FAMWUWANSLLBCA-UHFFFAOYSA-N 0 0 366.417 3.748 20 5 FHBDRN CCc1ccc(O)c(C(=O)N2CCS[C@H]2c2ccc([N+](=O)[O-])cc2)c1 ZINC000535793024 934384843 /nfs/dbraw/zinc/38/48/43/934384843.db2.gz UGPGHBVWCDRISC-SFHVURJKSA-N 0 0 358.419 3.751 20 5 FHBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCO[C@H](C)C1 ZINC000535798757 934391113 /nfs/dbraw/zinc/39/11/13/934391113.db2.gz XRDYBVBEZJFYIP-OLZOCXBDSA-N 0 0 352.456 3.640 20 5 FHBDRN C[C@@H]1c2ccc(F)cc2C[C@H](C)N1C(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000535804888 934411605 /nfs/dbraw/zinc/41/16/05/934411605.db2.gz AXSSLDNSTRHUNI-QWHCGFSZSA-N 0 0 358.369 3.647 20 5 FHBDRN O=C(NC[C@H](c1ccccc1)C(F)(F)F)c1ccc(F)cc1[N+](=O)[O-] ZINC000187675930 934425907 /nfs/dbraw/zinc/42/59/07/934425907.db2.gz UQSSQDQTTNYFDA-CYBMUJFWSA-N 0 0 356.275 3.810 20 5 FHBDRN CSCC[C@@H]([NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C(=O)[O-] ZINC000277004425 934430917 /nfs/dbraw/zinc/43/09/17/934430917.db2.gz LVKLNTZOXYMINK-CYBMUJFWSA-N 0 0 366.464 3.619 20 5 FHBDRN CN(Cc1nc2c(s1)CCCC2)C(=O)[C@H]1C[C@H]1c1cccc([N+](=O)[O-])c1 ZINC000934047632 934444860 /nfs/dbraw/zinc/44/48/60/934444860.db2.gz ULQZWAXXZYQEOR-GJZGRUSLSA-N 0 0 371.462 3.692 20 5 FHBDRN O=C1[C@H](Nc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCN1C1CCCCC1 ZINC000610808423 934450446 /nfs/dbraw/zinc/45/04/46/934450446.db2.gz KDXPKPROGQFHTP-CQSZACIVSA-N 0 0 371.359 3.959 20 5 FHBDRN Cc1cc(C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2C)ns1 ZINC000431260495 934465357 /nfs/dbraw/zinc/46/53/57/934465357.db2.gz VOTICMHLDBJUJM-UHFFFAOYSA-N 0 0 356.201 3.683 20 5 FHBDRN CCc1c(NC(=O)c2cc(OC)ccc2[N+](=O)[O-])cnn1CCC(C)C ZINC000277096447 934488896 /nfs/dbraw/zinc/48/88/96/934488896.db2.gz LXFXENPEXWAVML-UHFFFAOYSA-N 0 0 360.414 3.661 20 5 FHBDRN Cc1ccc(C[C@@H]2CCCN(C(=O)CNc3ccccc3[N+](=O)[O-])C2)cc1 ZINC000065162227 934517023 /nfs/dbraw/zinc/51/70/23/934517023.db2.gz AOVLPMATNPRYKM-SFHVURJKSA-N 0 0 367.449 3.796 20 5 FHBDRN COC1CCC(C)(CNC(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000471982720 934519096 /nfs/dbraw/zinc/51/90/96/934519096.db2.gz YSJHSTWNMQJREX-ASFAAARLSA-N 0 0 363.458 3.859 20 5 FHBDRN CCc1cc(NC(=O)c2ccc(Sc3ccc([N+](=O)[O-])cc3)cc2)no1 ZINC000610860798 934533206 /nfs/dbraw/zinc/53/32/06/934533206.db2.gz IWKFAIHRXJJGOI-UHFFFAOYSA-N 0 0 369.402 3.971 20 5 FHBDRN O=[N+]([O-])c1sccc1NC[C@@H](CO)Cc1ccccc1C(F)(F)F ZINC000610864754 934539302 /nfs/dbraw/zinc/53/93/02/934539302.db2.gz GNJFOTKFUMHPLQ-JTQLQIEISA-N 0 0 360.357 3.938 20 5 FHBDRN CSc1ccccc1CN(C)C(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000471984212 934542785 /nfs/dbraw/zinc/54/27/85/934542785.db2.gz MPKRFXBZTMAHMN-UHFFFAOYSA-N 0 0 359.451 3.701 20 5 FHBDRN O=[N+]([O-])c1ccccc1-c1nc(Cc2ccc(C(F)(F)F)cn2)no1 ZINC000544998041 934549903 /nfs/dbraw/zinc/54/99/03/934549903.db2.gz YUFODLIWFSGSGZ-UHFFFAOYSA-N 0 0 350.256 3.649 20 5 FHBDRN C[C@]1(c2ccccc2)C[C@@H]1NC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000610880723 934553490 /nfs/dbraw/zinc/55/34/90/934553490.db2.gz NKDQJIDPXQYIFA-PZJWPPBQSA-N 0 0 365.433 3.999 20 5 FHBDRN O=C(c1c[nH]c2cc([N+](=O)[O-])ccc12)N1CCC[C@@H]1c1ccc(O)cc1 ZINC000610887324 934564681 /nfs/dbraw/zinc/56/46/81/934564681.db2.gz PTRGMGTWNOUEOD-GOSISDBHSA-N 0 0 351.362 3.759 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N1CCC[C@H]1c1ccc(O)cc1 ZINC000610887364 934565046 /nfs/dbraw/zinc/56/50/46/934565046.db2.gz XLGJJCANFFIHNM-KRWDZBQOSA-N 0 0 360.797 3.860 20 5 FHBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)O[C@@H](c1ncccn1)C1CCCC1 ZINC000255420864 934567682 /nfs/dbraw/zinc/56/76/82/934567682.db2.gz SEJJPKJNTSIEIY-IBWPDUFMSA-N 0 0 353.378 3.873 20 5 FHBDRN CCCc1[nH]nc(C(=O)Nc2nc(CC)c(C(C)(C)C)s2)c1[N+](=O)[O-] ZINC000458277066 934578740 /nfs/dbraw/zinc/57/87/40/934578740.db2.gz QFLYDCKJZAAIHR-UHFFFAOYSA-N 0 0 365.459 3.839 20 5 FHBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)N[C@H]1CCCC[C@@H]1c1ccccc1 ZINC000146450439 934622447 /nfs/dbraw/zinc/62/24/47/934622447.db2.gz UVXOOIFUAINWNK-CVEARBPZSA-N 0 0 360.435 3.600 20 5 FHBDRN Cc1cc(N2CCc3sc(Br)cc3C2)ncc1[N+](=O)[O-] ZINC000610929684 934626313 /nfs/dbraw/zinc/62/63/13/934626313.db2.gz KADNLCSBNNPPGB-UHFFFAOYSA-N 0 0 354.229 3.685 20 5 FHBDRN Cc1ccnc(N2CCc3sc(Br)cc3C2)c1[N+](=O)[O-] ZINC000610929775 934626448 /nfs/dbraw/zinc/62/64/48/934626448.db2.gz LYOXTHZQJDKXHN-UHFFFAOYSA-N 0 0 354.229 3.685 20 5 FHBDRN O=[N+]([O-])c1cc2c(cc1CN(Cc1ccc(F)cc1)C1CC1)OCCO2 ZINC000610930365 934626449 /nfs/dbraw/zinc/62/64/49/934626449.db2.gz DEVJWELTMUKORC-UHFFFAOYSA-N 0 0 358.369 3.670 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N2CCc3ccccc3[C@@H]2C(C)C)c1[N+](=O)[O-] ZINC000610925760 934628669 /nfs/dbraw/zinc/62/86/69/934628669.db2.gz SKQUAORXEZTONG-KRWDZBQOSA-N 0 0 356.426 3.837 20 5 FHBDRN O=C(c1c[nH]c2cc([N+](=O)[O-])ccc12)N1Cc2ccccc2C(F)(F)C1 ZINC000610927223 934629610 /nfs/dbraw/zinc/62/96/10/934629610.db2.gz ADCBZIPZZJWXGG-UHFFFAOYSA-N 0 0 357.316 3.824 20 5 FHBDRN Cc1c(CO)cc([N+](=O)[O-])c(NCCc2ccccc2Cl)c1[N+](=O)[O-] ZINC000065199190 934637936 /nfs/dbraw/zinc/63/79/36/934637936.db2.gz WKQUCURGXFSYIW-UHFFFAOYSA-N 0 0 365.773 3.612 20 5 FHBDRN CCCc1ccccc1NC(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000044079235 934650736 /nfs/dbraw/zinc/65/07/36/934650736.db2.gz NNFSKPDTWDJRPS-UHFFFAOYSA-N 0 0 368.437 3.901 20 5 FHBDRN Cc1cc(C(=O)N2CCC[C@]3(C2)OCc2ccccc23)cc([N+](=O)[O-])c1 ZINC000548504178 934669227 /nfs/dbraw/zinc/66/92/27/934669227.db2.gz OSYNNIIQOZBCEM-HXUWFJFHSA-N 0 0 352.390 3.565 20 5 FHBDRN COc1ccc(CN(C)C(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)cn1 ZINC000610975984 934675721 /nfs/dbraw/zinc/67/57/21/934675721.db2.gz KTFMOWFBWSFDIE-UHFFFAOYSA-N 0 0 357.410 3.568 20 5 FHBDRN O=C(NC[C@@H](O)c1ccc2ccccc2c1)c1cccc(Cl)c1[N+](=O)[O-] ZINC000176314032 934707574 /nfs/dbraw/zinc/70/75/74/934707574.db2.gz DTUHLWHDAQWXFM-QGZVFWFLSA-N 0 0 370.792 3.865 20 5 FHBDRN CC[C@H](NC(=O)NCC1(C)CCC(OC)CC1)c1cccc([N+](=O)[O-])c1 ZINC000471992131 934733220 /nfs/dbraw/zinc/73/32/20/934733220.db2.gz MSBZHIFHTIBPKU-HFCFLWKCSA-N 0 0 363.458 3.940 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCCC[C@@H]1Cc1ccccc1 ZINC000109999874 934803822 /nfs/dbraw/zinc/80/38/22/934803822.db2.gz QMLAOIQTINATQO-QGZVFWFLSA-N 0 0 374.462 3.689 20 5 FHBDRN C[C@@]1(Cc2ccccc2)CCCN1C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000548519518 934807037 /nfs/dbraw/zinc/80/70/37/934807037.db2.gz IQTVMDWBKMYNQX-FQEVSTJZSA-N 0 0 368.389 3.561 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])N1CC=C(c2c(F)cccc2F)CC1 ZINC000472006169 934813515 /nfs/dbraw/zinc/81/35/15/934813515.db2.gz FOTKVMKRXPOVPL-UHFFFAOYSA-N 0 0 358.344 3.731 20 5 FHBDRN Cc1cc(C(=O)Nc2ccc(Br)nc2C)ccc1[N+](=O)[O-] ZINC000091100811 934814106 /nfs/dbraw/zinc/81/41/06/934814106.db2.gz XCTJVJANUVCFGT-UHFFFAOYSA-N 0 0 350.172 3.621 20 5 FHBDRN COc1ccccc1[C@H](O)CNc1cc(Br)ccc1[N+](=O)[O-] ZINC000121278272 934818579 /nfs/dbraw/zinc/81/85/79/934818579.db2.gz UFMCZGUYULENGB-CQSZACIVSA-N 0 0 367.199 3.511 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N(C)CCOCc1ccccc1 ZINC000465060838 934824268 /nfs/dbraw/zinc/82/42/68/934824268.db2.gz NIUSOMRTLKICSZ-OAHLLOKOSA-N 0 0 374.462 3.751 20 5 FHBDRN C[C@@H](NC(=O)N1CCO[C@](C)(c2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000119463913 934826286 /nfs/dbraw/zinc/82/62/86/934826286.db2.gz LRVVGXQGTQSTGC-QRWLVFNGSA-N 0 0 369.421 3.613 20 5 FHBDRN Cn1ccnc1[C@H](NCC(C)(C)[C@H]1CCCCO1)c1ccc([N+](=O)[O-])cc1 ZINC000611560792 934844652 /nfs/dbraw/zinc/84/46/52/934844652.db2.gz XMNJMNCOYKUTFO-QZTJIDSGSA-N 0 0 372.469 3.603 20 5 FHBDRN Cc1cc(S(=O)(=O)N2C[C@@H](C)C[C@@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000511004089 934856845 /nfs/dbraw/zinc/85/68/45/934856845.db2.gz QAJLLRKIVMMFAZ-SCLBCKFNSA-N 0 0 360.435 3.675 20 5 FHBDRN C[C@@H]1CCN(C(=O)CNc2ccccc2[N+](=O)[O-])[C@@H]1c1cccc(F)c1 ZINC000472036676 934867901 /nfs/dbraw/zinc/86/79/01/934867901.db2.gz DZOIATZYUKKTNT-YJYMSZOUSA-N 0 0 357.385 3.756 20 5 FHBDRN C[C@H]1CC[C@@H](C(F)(F)F)CN1C(=O)c1c[nH]c2ccc([N+](=O)[O-])cc21 ZINC000611561839 934868211 /nfs/dbraw/zinc/86/82/11/934868211.db2.gz VMKAUBQOPZNRBK-VHSXEESVSA-N 0 0 355.316 3.879 20 5 FHBDRN O=C([O-])[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CC1CCC(C(F)(F)F)CC1 ZINC000277280975 934873454 /nfs/dbraw/zinc/87/34/54/934873454.db2.gz LXWVKGWBDKARQC-PIMMBPRGSA-N 0 0 374.359 3.549 20 5 FHBDRN Cc1cc(NC(=O)c2cc(C)ccc2[N+](=O)[O-])nn1-c1cccc(Cl)c1 ZINC000538589076 934873967 /nfs/dbraw/zinc/87/39/67/934873967.db2.gz VDRLVMIOULUTEF-UHFFFAOYSA-N 0 0 370.796 3.725 20 5 FHBDRN O=C(NC[C@H](c1ccccc1)C(F)(F)F)c1ccc([N+](=O)[O-])cc1F ZINC000187713798 934875625 /nfs/dbraw/zinc/87/56/25/934875625.db2.gz JFCMHDKTGRJICZ-CYBMUJFWSA-N 0 0 356.275 3.810 20 5 FHBDRN C[C@@H](c1ccccc1F)N(C)S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000119570108 934886623 /nfs/dbraw/zinc/88/66/23/934886623.db2.gz OKTZRSLSWNFRCJ-JTQLQIEISA-N 0 0 372.805 3.769 20 5 FHBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1C[C@@H](C)C[C@@H]1c1ccccc1 ZINC000511014709 934888298 /nfs/dbraw/zinc/88/82/98/934888298.db2.gz QQLLKXVBQBABGG-SUMWQHHRSA-N 0 0 360.435 3.675 20 5 FHBDRN COc1ccc(CNC(=O)N[C@@H](c2ccccc2)C2CCC2)cc1[N+](=O)[O-] ZINC000511014335 934889870 /nfs/dbraw/zinc/88/98/70/934889870.db2.gz MMFFILIUKQUXEK-IBGZPJMESA-N 0 0 369.421 3.944 20 5 FHBDRN CCNc1nc(Sc2nc3ccccn3c2[N+](=O)[O-])nc2ccccc21 ZINC000071836360 934895096 /nfs/dbraw/zinc/89/50/96/934895096.db2.gz SUYNSMNTOSGTRM-UHFFFAOYSA-N 0 0 366.406 3.769 20 5 FHBDRN CCCN1Cc2cccc(NC(=O)Cc3cccc([N+](=O)[O-])c3C)c2C1 ZINC000119593813 934907123 /nfs/dbraw/zinc/90/71/23/934907123.db2.gz MFWAZDWBRPSVJR-UHFFFAOYSA-N 0 0 353.422 3.810 20 5 FHBDRN COc1ccc(CSCC(=O)NCC2(C3CC3)CCC2)cc1[N+](=O)[O-] ZINC000119604287 934915432 /nfs/dbraw/zinc/91/54/32/934915432.db2.gz XOMBTVGKZYQFOH-UHFFFAOYSA-N 0 0 364.467 3.533 20 5 FHBDRN CCOc1ccc(C(=O)Nc2c(C)cnn2-c2ccccc2)cc1[N+](=O)[O-] ZINC000084564161 934919708 /nfs/dbraw/zinc/91/97/08/934919708.db2.gz XHPJXNFMRILALJ-UHFFFAOYSA-N 0 0 366.377 3.740 20 5 FHBDRN COc1ccccc1CC(=O)Nc1ccc([N+](=O)[O-])c(Br)c1 ZINC000119619872 934928248 /nfs/dbraw/zinc/92/82/48/934928248.db2.gz OJUDLWOBMQEFFM-UHFFFAOYSA-N 0 0 365.183 3.547 20 5 FHBDRN C[C@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1)c1ccc(OCC2CC2)c(F)c1 ZINC000119631776 934934598 /nfs/dbraw/zinc/93/45/98/934934598.db2.gz GAJCKGMBPRNFLP-ZDUSSCGKSA-N 0 0 372.396 3.943 20 5 FHBDRN O=c1oc2ccc([N+](=O)[O-])cc2n1Cc1coc(-c2cccc(Cl)c2)n1 ZINC000046487015 934944345 /nfs/dbraw/zinc/94/43/45/934944345.db2.gz HPOASXFIJUTYCL-UHFFFAOYSA-N 0 0 371.736 3.859 20 5 FHBDRN C[C@@H]1C[C@H](c2ccccc2)N(S(=O)(=O)CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000511026297 934953493 /nfs/dbraw/zinc/95/34/93/934953493.db2.gz HHQXMITZAVKDQQ-DNVCBOLYSA-N 0 0 374.462 3.550 20 5 FHBDRN Cc1ccc(Cl)cc1S(=O)(=O)Oc1ccc([N+](=O)[O-])cc1Cl ZINC000071887268 934956370 /nfs/dbraw/zinc/95/63/70/934956370.db2.gz ABXFQNDZTFNJMN-UHFFFAOYSA-N 0 0 362.190 3.978 20 5 FHBDRN Cc1cncc(/C=C\C(=O)OCc2cnc(-c3ccc([N+](=O)[O-])cc3)o2)c1 ZINC000255460431 934996769 /nfs/dbraw/zinc/99/67/69/934996769.db2.gz UWCPOZSDRJWNRM-UQCOIBPSSA-N 0 0 365.345 3.710 20 5 FHBDRN CCCn1ccnc1CCCN(C)C(=O)N[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000277356474 935016418 /nfs/dbraw/zinc/01/64/18/935016418.db2.gz ALZMUZWJWNSNHQ-OAHLLOKOSA-N 0 0 373.457 3.537 20 5 FHBDRN 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ZINC000439894765 945077612 /nfs/dbraw/zinc/07/76/12/945077612.db2.gz DLPCZNVYXIELPK-LBPRGKRZSA-N 0 0 359.382 3.924 20 5 FHBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])[C@H]1C[C@@H]1c1ccc(F)cc1 ZINC000539261201 935117699 /nfs/dbraw/zinc/11/76/99/935117699.db2.gz LZEBAJMZVSUQFG-CVEARBPZSA-N 0 0 362.788 3.850 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N[C@@H](C)c2c(F)cccc2F)c1C ZINC000511056770 935131868 /nfs/dbraw/zinc/13/18/68/935131868.db2.gz QBFJHKZTRGVSDI-NSHDSACASA-N 0 0 370.377 3.529 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)Nc1ccc(Cn2cccn2)cc1 ZINC000519053633 945079215 /nfs/dbraw/zinc/07/92/15/945079215.db2.gz LMOZIOWMCAXTKI-UHFFFAOYSA-N 0 0 365.393 3.504 20 5 FHBDRN Cn1ncc([N+](=O)[O-])c1NC(=O)/C=C\c1ccc(-c2ccc(F)cc2)s1 ZINC000588495628 935143448 /nfs/dbraw/zinc/14/34/48/935143448.db2.gz WCRWBKGHHPZDMR-CLFYSBASSA-N 0 0 372.381 3.848 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H](c1cccnc1)C1CC1 ZINC000439898215 945079835 /nfs/dbraw/zinc/07/98/35/945079835.db2.gz 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CCOc1ccc([N+](=O)[O-])cc1NC(=O)N(C)Cc1cc(Cl)cn1C ZINC000439900816 945082691 /nfs/dbraw/zinc/08/26/91/945082691.db2.gz MIJBANIKAZYKKJ-UHFFFAOYSA-N 0 0 366.805 3.649 20 5 FHBDRN COc1cc(C(=O)NCc2cc3c(s2)CCCC3)c([N+](=O)[O-])cc1F ZINC000519076039 945083302 /nfs/dbraw/zinc/08/33/02/945083302.db2.gz GGFNXJKKKWAFMZ-UHFFFAOYSA-N 0 0 364.398 3.613 20 5 FHBDRN CC(C)CCSc1ccc(C(=O)OCc2ccn(C)n2)cc1[N+](=O)[O-] ZINC000780500114 935205468 /nfs/dbraw/zinc/20/54/68/935205468.db2.gz DEKUPYBROITGRI-UHFFFAOYSA-N 0 0 363.439 3.824 20 5 FHBDRN O=C(N[C@H]1C[C@@H]1c1ccccc1)c1sc(Br)cc1[N+](=O)[O-] ZINC000431346720 935213134 /nfs/dbraw/zinc/21/31/34/935213134.db2.gz DPPCZOMSYHESAJ-ZJUUUORDSA-N 0 0 367.224 3.705 20 5 FHBDRN COc1ccc(NC(=O)[C@H](C)Sc2ccc(Cl)cn2)c([N+](=O)[O-])c1 ZINC000119789664 935223198 /nfs/dbraw/zinc/22/31/98/935223198.db2.gz OCLSEIXRMDSKQL-VIFPVBQESA-N 0 0 367.814 3.771 20 5 FHBDRN CO[C@H](c1noc(-c2ccc(N3CCC[C@H](C)C3)c([N+](=O)[O-])c2)n1)C1CC1 ZINC000551256618 935230316 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COc1cc(C(=O)Nc2ccc3occ(C)c3c2)cc([N+](=O)[O-])c1OC ZINC000479076374 935783924 /nfs/dbraw/zinc/78/39/24/935783924.db2.gz YYLXDKCRLGKHIV-UHFFFAOYSA-N 0 0 356.334 3.919 20 5 FHBDRN Cc1ccc(SCCc2nc(Cc3ccc([N+](=O)[O-])cn3)no2)cc1 ZINC000545076146 935788811 /nfs/dbraw/zinc/78/88/11/935788811.db2.gz WJOANHQTQXKKPJ-UHFFFAOYSA-N 0 0 356.407 3.607 20 5 FHBDRN COc1cc(C(=O)N2CC(Cc3ccccc3Cl)C2)cc([N+](=O)[O-])c1C ZINC000479142006 935803481 /nfs/dbraw/zinc/80/34/81/935803481.db2.gz PQBDVMPPQCBXCJ-UHFFFAOYSA-N 0 0 374.824 3.880 20 5 FHBDRN CN(C(=O)c1ccc(CNC(=O)C(C)(C)C)cc1)c1cccc([N+](=O)[O-])c1 ZINC000158449400 935806003 /nfs/dbraw/zinc/80/60/03/935806003.db2.gz JDDLUUJQAMSEIW-UHFFFAOYSA-N 0 0 369.421 3.534 20 5 FHBDRN COC(=O)c1ccc(C)c(NC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000047351463 945125562 /nfs/dbraw/zinc/12/55/62/945125562.db2.gz APUGHTUPPMONHI-LBPRGKRZSA-N 0 0 357.366 3.573 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CCN(c2ccccc2F)CC1 ZINC000127809722 935810911 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3.682 20 5 FHBDRN CN(CC(=O)OC(C)(C)C)C(=O)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000277688521 935817660 /nfs/dbraw/zinc/81/76/60/935817660.db2.gz JKLNEPOTAZJJBH-UHFFFAOYSA-N 0 0 366.417 3.507 20 5 FHBDRN COc1cccc(NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)c1 ZINC000050256148 935821436 /nfs/dbraw/zinc/82/14/36/935821436.db2.gz LGCOCOLZVAKFIK-UHFFFAOYSA-N 0 0 355.375 3.979 20 5 FHBDRN Cc1cn(-c2ccc(F)cc2)nc1-c1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000511159974 935823510 /nfs/dbraw/zinc/82/35/10/935823510.db2.gz ZZFSIXXMASPZIU-UHFFFAOYSA-N 0 0 365.324 3.945 20 5 FHBDRN C[C@H](Sc1ncccc1[N+](=O)[O-])C(=O)NC12CC3CC(CC(C3)C1)C2 ZINC000127869087 935828295 /nfs/dbraw/zinc/82/82/95/935828295.db2.gz OYPBRUWCDLDGSK-IWERZKIRSA-N 0 0 361.467 3.555 20 5 FHBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])c1ccn(C2CCCC2)n1 ZINC000479395637 935835474 /nfs/dbraw/zinc/83/54/74/935835474.db2.gz VAUNUBKKDHMINB-UHFFFAOYSA-N 0 0 362.817 3.532 20 5 FHBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])c1scnc1C1CC1 ZINC000479418963 935838021 /nfs/dbraw/zinc/83/80/21/935838021.db2.gz GQAFNLYUNMSZAV-UHFFFAOYSA-N 0 0 351.815 3.555 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@H]1CC=C(c2ccc(F)cc2)CC1 ZINC000479418066 935838168 /nfs/dbraw/zinc/83/81/68/935838168.db2.gz GDTLRSPOSPBZIE-INIZCTEOSA-N 0 0 355.369 3.803 20 5 FHBDRN COC[C@H](C)n1c(C)cc(C(=O)COc2ccc([N+](=O)[O-])cc2F)c1C ZINC000047355180 945131039 /nfs/dbraw/zinc/13/10/39/945131039.db2.gz PLYPAMXDBYTQBT-LBPRGKRZSA-N 0 0 364.373 3.621 20 5 FHBDRN O=C(NCc1cscn1)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 ZINC000050404360 935843134 /nfs/dbraw/zinc/84/31/34/935843134.db2.gz NDPAWVUGOKAKDS-UHFFFAOYSA-N 0 0 355.375 3.774 20 5 FHBDRN O=C(CCc1ccc([N+](=O)[O-])cc1Cl)Oc1ccc2nccnc2c1 ZINC001267147664 935847866 /nfs/dbraw/zinc/84/78/66/935847866.db2.gz FKAMAUAUTMIZKB-UHFFFAOYSA-N 0 0 357.753 3.730 20 5 FHBDRN CC[C@H](C)Oc1ccc(-c2noc(CCn3cc([N+](=O)[O-])nc3C)n2)cc1 ZINC000277717449 935851874 /nfs/dbraw/zinc/85/18/74/935851874.db2.gz ANSLZZNDCHLLQS-LBPRGKRZSA-N 0 0 371.397 3.570 20 5 FHBDRN C[C@@H](CCc1ccc(O)cc1)NC(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000158609695 935861849 /nfs/dbraw/zinc/86/18/49/935861849.db2.gz CRUQNCHEYDYDGP-ZDUSSCGKSA-N 0 0 365.389 3.600 20 5 FHBDRN CN(C(=O)c1cc(F)cc(Br)c1)c1cccc([N+](=O)[O-])c1 ZINC000158610545 935862255 /nfs/dbraw/zinc/86/22/55/935862255.db2.gz NDMQKZCURUEGHL-UHFFFAOYSA-N 0 0 353.147 3.773 20 5 FHBDRN CN(C(=O)c1cccc(OCc2cccnc2)c1)c1cccc([N+](=O)[O-])c1 ZINC000158612410 935867274 /nfs/dbraw/zinc/86/72/74/935867274.db2.gz SWKBZCGZIKZQMJ-UHFFFAOYSA-N 0 0 363.373 3.845 20 5 FHBDRN COCC1CCN(C(=O)c2cccc3c(=O)c4ccccc4[nH]c23)CC1 ZINC000277736041 935867927 /nfs/dbraw/zinc/86/79/27/935867927.db2.gz OQPWPQBLHOYMAZ-UHFFFAOYSA-N 0 0 350.418 3.592 20 5 FHBDRN CCc1ccccc1N(C(C)=O)c1nc(Cn2nccc2[N+](=O)[O-])cs1 ZINC000127979643 935873354 /nfs/dbraw/zinc/87/33/54/935873354.db2.gz KFYUWBBMDAPWIE-UHFFFAOYSA-N 0 0 371.422 3.543 20 5 FHBDRN Cc1ccc(C(=O)NCc2ccc(OC(F)F)c(F)c2)cc1[N+](=O)[O-] ZINC000511173832 935874731 /nfs/dbraw/zinc/87/47/31/935874731.db2.gz QAAHCQYQCIVWEP-UHFFFAOYSA-N 0 0 354.284 3.574 20 5 FHBDRN C[C@H](c1ccncc1)N(C)C(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000127990976 935876907 /nfs/dbraw/zinc/87/69/07/935876907.db2.gz VCFQHYOATSZXGX-SNVBAGLBSA-N 0 0 353.300 3.842 20 5 FHBDRN CCc1cc(N(C)[C@@H](C)c2nc(C)no2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000582616276 935877644 /nfs/dbraw/zinc/87/76/44/935877644.db2.gz KRWPJUHMXPYNQY-NSHDSACASA-N 0 0 368.397 3.503 20 5 FHBDRN Cc1c(CNC(=O)N[C@H](C)[C@@H]2Oc3ccccc3[C@H]2C)cccc1[N+](=O)[O-] ZINC000479701952 935880968 /nfs/dbraw/zinc/88/09/68/935880968.db2.gz BORYIYGTHMOKMN-PJIJBLCYSA-N 0 0 369.421 3.656 20 5 FHBDRN CC(=O)c1cccc(NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)c1 ZINC000024006785 935884301 /nfs/dbraw/zinc/88/43/01/935884301.db2.gz VKZWRUKTGCTGRQ-UHFFFAOYSA-N 0 0 367.405 3.653 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC[C@@H](C(F)(F)F)[C@@H]1C ZINC000479772600 935890777 /nfs/dbraw/zinc/89/07/77/935890777.db2.gz CFBIKCNAPWKSBA-GXSJLCMTSA-N 0 0 361.320 3.798 20 5 FHBDRN COC(=O)c1cc(C(=O)Nc2c(C)cccc2SC)cc([N+](=O)[O-])c1 ZINC000472236143 935893366 /nfs/dbraw/zinc/89/33/66/935893366.db2.gz DELVZYJASCTFMC-UHFFFAOYSA-N 0 0 360.391 3.664 20 5 FHBDRN Cc1c(NC(=O)c2cc(Br)cnc2Cl)cccc1[N+](=O)[O-] ZINC000050044897 935903020 /nfs/dbraw/zinc/90/30/20/935903020.db2.gz CQPWWPFQDBWQMQ-UHFFFAOYSA-N 0 0 370.590 3.966 20 5 FHBDRN O=C(Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1)c1cc2[nH]ccc2s1 ZINC000479858588 935906179 /nfs/dbraw/zinc/90/61/79/935906179.db2.gz JPUKFOIWAIKLKT-UHFFFAOYSA-N 0 0 353.363 3.780 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@H](c1ccccc1)C(C)C ZINC000562140225 935908520 /nfs/dbraw/zinc/90/85/20/935908520.db2.gz USPBTFVGASDYQG-SFHVURJKSA-N 0 0 369.421 3.609 20 5 FHBDRN C[C@@H](OC(=O)c1cccc(N2CCCC2=O)c1)c1cccc([N+](=O)[O-])c1 ZINC000024196823 935915615 /nfs/dbraw/zinc/91/56/15/935915615.db2.gz DVRLAIZVMZETTG-CYBMUJFWSA-N 0 0 354.362 3.640 20 5 FHBDRN CC(C)N(C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2)[C@@H](C)c1ccsc1 ZINC000582659763 935917413 /nfs/dbraw/zinc/91/74/13/935917413.db2.gz MQSQKKRDKYUHMV-NSHDSACASA-N 0 0 362.407 3.997 20 5 FHBDRN COc1c(O)ccc(CNc2cccc(COCC3CC3)c2)c1[N+](=O)[O-] ZINC000892278493 935925531 /nfs/dbraw/zinc/92/55/31/935925531.db2.gz UAUZQOXKIWXSMH-UHFFFAOYSA-N 0 0 358.394 3.848 20 5 FHBDRN COCCOc1ccc(Nc2ncnc3ccc([N+](=O)[O-])cc32)c(C)c1 ZINC000611702783 935941542 /nfs/dbraw/zinc/94/15/42/935941542.db2.gz YHAQPUCCOZIDQF-UHFFFAOYSA-N 0 0 354.366 3.615 20 5 FHBDRN CC[C@@H](NC(=O)c1cc(OC)c(C)c([N+](=O)[O-])c1)c1nc2ccccc2[nH]1 ZINC000480041978 935945609 /nfs/dbraw/zinc/94/56/09/935945609.db2.gz RXGTWZPAPUGSLO-CYBMUJFWSA-N 0 0 368.393 3.669 20 5 FHBDRN CCN(Cc1c(F)cccc1F)C(=O)c1cc(OC)c(C)c([N+](=O)[O-])c1 ZINC000480030909 935946574 /nfs/dbraw/zinc/94/65/74/935946574.db2.gz STIZOPJFOPSRAA-UHFFFAOYSA-N 0 0 364.348 3.852 20 5 FHBDRN O=[N+]([O-])c1cc(CN2CCC[C@@H](O)C2)ccc1Oc1ccccc1Cl ZINC000158746849 935953959 /nfs/dbraw/zinc/95/39/59/935953959.db2.gz IHNNVSUTMSSNHK-CQSZACIVSA-N 0 0 362.813 3.997 20 5 FHBDRN COc1ccccc1[C@@H]1CCCN1c1ncnc2ccc([N+](=O)[O-])cc21 ZINC000611709655 935955892 /nfs/dbraw/zinc/95/58/92/935955892.db2.gz JYJJPDHAWGOILP-KRWDZBQOSA-N 0 0 350.378 3.888 20 5 FHBDRN COc1ccccc1[C@H]1CCCN1c1ncnc2ccc([N+](=O)[O-])cc21 ZINC000611709659 935955926 /nfs/dbraw/zinc/95/59/26/935955926.db2.gz JYJJPDHAWGOILP-QGZVFWFLSA-N 0 0 350.378 3.888 20 5 FHBDRN CC[C@H]1Cc2ccccc2CN1C(=O)NCc1cccc([N+](=O)[O-])c1C ZINC000480070641 935956931 /nfs/dbraw/zinc/95/69/31/935956931.db2.gz PGXAKYVYXRLPRD-SFHVURJKSA-N 0 0 353.422 3.950 20 5 FHBDRN CCn1nc(C)c([N+](=O)[O-])c1N1CCc2cc(Cl)cc(Cl)c2C1 ZINC000480071155 935957621 /nfs/dbraw/zinc/95/76/21/935957621.db2.gz PQCFETWVTOQIKE-UHFFFAOYSA-N 0 0 355.225 3.989 20 5 FHBDRN COc1cc(OCC(=O)Nc2c(C)cccc2SC)ccc1[N+](=O)[O-] ZINC000472242984 935960582 /nfs/dbraw/zinc/96/05/82/935960582.db2.gz PRSYSQOPMXNBOI-UHFFFAOYSA-N 0 0 362.407 3.651 20 5 FHBDRN Cc1cc(F)cc(C(=O)NCCCCOc2ccc(F)cc2)c1[N+](=O)[O-] ZINC000176736372 935963264 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FHBDRN C[C@H](Nc1ncnc2ccc([N+](=O)[O-])cc21)c1noc(-c2ccccc2)n1 ZINC000611710929 935991943 /nfs/dbraw/zinc/99/19/43/935991943.db2.gz IVHQYXOYMBLXSD-NSHDSACASA-N 0 0 362.349 3.761 20 5 FHBDRN O=[N+]([O-])c1cnc(NC2(Cc3cccc(F)c3)CCOCC2)c(Cl)c1 ZINC000582729036 935999979 /nfs/dbraw/zinc/99/99/79/935999979.db2.gz JJJYNXZNGJFPIR-UHFFFAOYSA-N 0 0 365.792 3.986 20 5 FHBDRN O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1cccc2cnccc21 ZINC000075082977 936000134 /nfs/dbraw/zinc/00/01/34/936000134.db2.gz NWOYJNBJQSVZPO-UHFFFAOYSA-N 0 0 359.288 3.997 20 5 FHBDRN O=C(Cc1ccc(F)cc1[N+](=O)[O-])NCCCc1ccc(Cl)cc1 ZINC001125622839 936008935 /nfs/dbraw/zinc/00/89/35/936008935.db2.gz XMWDTPCKLBFVJD-UHFFFAOYSA-N 0 0 350.777 3.679 20 5 FHBDRN CNc1ccc(C(=O)Nc2ccc(Br)cc2)cc1[N+](=O)[O-] ZINC000004895937 936012988 /nfs/dbraw/zinc/01/29/88/936012988.db2.gz HJIWDQLZAOELMF-UHFFFAOYSA-N 0 0 350.172 3.651 20 5 FHBDRN Cc1cccc([C@H](C)CNC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)c1 ZINC000135603536 936015427 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COc1ccc(NC(=O)Cc2c(C)nc3ccccc3c2C)cc1[N+](=O)[O-] ZINC000611777567 938305220 /nfs/dbraw/zinc/30/52/20/938305220.db2.gz CGCUKODUZGVPAB-UHFFFAOYSA-N 0 0 365.389 3.950 20 5 FHBDRN O=[N+]([O-])c1cnccc1NCc1nc2c(s1)C[C@H](c1ccccc1)CC2 ZINC000613430317 938309192 /nfs/dbraw/zinc/30/91/92/938309192.db2.gz JBZCCAYHWYSQMK-CQSZACIVSA-N 0 0 366.446 3.753 20 5 FHBDRN O=C(NCc1ccco1)c1cccc(CNc2ccccc2[N+](=O)[O-])c1 ZINC000052453634 938309855 /nfs/dbraw/zinc/30/98/55/938309855.db2.gz OQXQUXMTPQXOHQ-UHFFFAOYSA-N 0 0 351.362 3.730 20 5 FHBDRN COc1cccc(CCNc2ccc([N+](=O)[O-])c3cccnc23)c1OC ZINC000052455649 938312635 /nfs/dbraw/zinc/31/26/35/938312635.db2.gz WKPXKISUAKROND-UHFFFAOYSA-N 0 0 353.378 3.815 20 5 FHBDRN Cc1cc(F)cc(C(=O)Nc2nc3cc(Cl)ccc3n2C)c1[N+](=O)[O-] ZINC000176792111 938320648 /nfs/dbraw/zinc/32/06/48/938320648.db2.gz IZQCKIYNIPGSGV-UHFFFAOYSA-N 0 0 362.748 3.835 20 5 FHBDRN CC(C)c1nn(C)cc1-c1noc(C(C)(C)c2ccccc2[N+](=O)[O-])n1 ZINC000426211281 945164602 /nfs/dbraw/zinc/16/46/02/945164602.db2.gz AWASDBFJOWHRIA-UHFFFAOYSA-N 0 0 355.398 3.828 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N[C@H](c1ccccc1F)[C@@H](C)O ZINC000583634253 938329329 /nfs/dbraw/zinc/32/93/29/938329329.db2.gz PJYMEUIVIDECCC-PXAZEXFGSA-N 0 0 361.373 3.594 20 5 FHBDRN COc1ccc(NC(=O)c2cc(-c3ccccc3F)on2)cc1[N+](=O)[O-] ZINC000611780470 938330825 /nfs/dbraw/zinc/33/08/25/938330825.db2.gz GYJWZIHVEFESET-UHFFFAOYSA-N 0 0 357.297 3.650 20 5 FHBDRN O=C(c1cnc(Cl)c(Cl)c1)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000161806946 938335555 /nfs/dbraw/zinc/33/55/55/938335555.db2.gz PTUBAYFUKDOUJL-UHFFFAOYSA-N 0 0 352.177 3.890 20 5 FHBDRN O=C(Nc1cccc(CNc2ccc([N+](=O)[O-])cc2F)c1)c1ccccn1 ZINC000052489134 938339251 /nfs/dbraw/zinc/33/92/51/938339251.db2.gz PUURGNJVKNQCAN-UHFFFAOYSA-N 0 0 366.352 3.993 20 5 FHBDRN C[C@H]1c2cc(F)cc(F)c2CCN1C(=O)c1ccc([N+](=O)[O-])cc1F ZINC000468341860 938340665 /nfs/dbraw/zinc/34/06/65/938340665.db2.gz WYFXIZWZJMOKAO-VIFPVBQESA-N 0 0 350.296 3.772 20 5 FHBDRN Cc1cc(C)c(NC(=O)CN2CCc3c2cccc3[N+](=O)[O-])c(Cl)c1 ZINC000178949971 938341653 /nfs/dbraw/zinc/34/16/53/938341653.db2.gz BYPHKROUFYBPHN-UHFFFAOYSA-N 0 0 359.813 3.866 20 5 FHBDRN O=C1OC(c2cc3ccccc3[nH]2)=N/C1=C\c1cc([N+](=O)[O-])c(F)cc1F ZINC000255575780 938354274 /nfs/dbraw/zinc/35/42/74/938354274.db2.gz FSZLHIGQETXIBH-UUASQNMZSA-N 0 0 369.283 3.699 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(C)c1ccccc1C(C)C ZINC000583685400 938357617 /nfs/dbraw/zinc/35/76/17/938357617.db2.gz AKZLFLXFHIMKCI-UHFFFAOYSA-N 0 0 364.423 3.552 20 5 FHBDRN CC(C)CN1CC(=O)N[C@H]1c1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000077474464 938374791 /nfs/dbraw/zinc/37/47/91/938374791.db2.gz LPEWVPRFJYMEFR-QGZVFWFLSA-N 0 0 363.801 3.595 20 5 FHBDRN O=C(c1csc([N+](=O)[O-])c1)N1CCCCC[C@H]1C[C@@H](O)c1ccco1 ZINC000178964229 938376299 /nfs/dbraw/zinc/37/62/99/938376299.db2.gz DEKYMRAPOSGSDF-UONOGXRCSA-N 0 0 364.423 3.758 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)C(F)(F)F)cc1NCc1nccs1 ZINC000278393203 938380770 /nfs/dbraw/zinc/38/07/70/938380770.db2.gz FZROEFKSSMDWIK-UHFFFAOYSA-N 0 0 354.260 3.713 20 5 FHBDRN C[C@@H](NCc1c(F)cc([N+](=O)[O-])cc1F)c1cnn(Cc2ccccc2)c1 ZINC000509582408 945170164 /nfs/dbraw/zinc/17/01/64/945170164.db2.gz HEOFHPYVOMNMOH-CYBMUJFWSA-N 0 0 372.375 3.969 20 5 FHBDRN CCCc1n[nH]c(C(=O)NC(C)(C)c2cccc(Cl)c2F)c1[N+](=O)[O-] ZINC000583763278 938395258 /nfs/dbraw/zinc/39/52/58/938395258.db2.gz VMGUBMMQZVQGHM-UHFFFAOYSA-N 0 0 368.796 3.728 20 5 FHBDRN C[C@@H](C(=O)Nc1cc(Cl)ccc1F)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000046599479 938396411 /nfs/dbraw/zinc/39/64/11/938396411.db2.gz UWBUKSJIEGQZFN-NSHDSACASA-N 0 0 365.792 3.846 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)N(Cc2ccc3ccccc3c2)C2CC2)n1 ZINC000427201141 945171649 /nfs/dbraw/zinc/17/16/49/945171649.db2.gz XGIQYLLNSSUAOU-UHFFFAOYSA-N 0 0 364.405 3.769 20 5 FHBDRN CCS[C@H]1CCCC[C@@H]1NC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000427208126 945177697 /nfs/dbraw/zinc/17/76/97/945177697.db2.gz BBYKXGHCQPFPRN-YOEHRIQHSA-N 0 0 374.466 3.575 20 5 FHBDRN O=C(NCc1cccc(COCc2ccccc2)c1)c1ccc([N+](=O)[O-])[nH]1 ZINC000480210219 938429489 /nfs/dbraw/zinc/42/94/89/938429489.db2.gz BZKKHMIHNACIMI-UHFFFAOYSA-N 0 0 365.389 3.570 20 5 FHBDRN O=C(N[C@@H](c1ccccc1)c1ccccn1)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000052609521 938436570 /nfs/dbraw/zinc/43/65/70/938436570.db2.gz WQFSKGJPJFIPEC-FQEVSTJZSA-N 0 0 372.384 3.991 20 5 FHBDRN O=C(COc1c(Br)cccc1[N+](=O)[O-])c1ccc(F)c(F)c1 ZINC000178983876 938437452 /nfs/dbraw/zinc/43/74/52/938437452.db2.gz XBSLJGOMNKIITC-UHFFFAOYSA-N 0 0 372.121 3.897 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CCCc2cc(F)c(F)cc21 ZINC000178991345 938442640 /nfs/dbraw/zinc/44/26/40/938442640.db2.gz KZKTZTRXRUXNSJ-UHFFFAOYSA-N 0 0 371.343 3.876 20 5 FHBDRN C[C@H](NC(=O)N[C@@H]1CCCc2c(O)cccc21)c1ccc([N+](=O)[O-])cc1 ZINC000458695973 938443582 /nfs/dbraw/zinc/44/35/82/938443582.db2.gz KXKJSZKHFOPQTA-YVEFUNNKSA-N 0 0 355.394 3.738 20 5 FHBDRN C[C@H](Nc1cc(C(F)(F)F)ncc1[N+](=O)[O-])c1ccc([S@](C)=O)cc1 ZINC000278453635 938444908 /nfs/dbraw/zinc/44/49/08/938444908.db2.gz RZGDDRFUAQNSMI-USOBGDSLSA-N 0 0 373.356 3.919 20 5 FHBDRN COc1ccc([C@H](C)NC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc32)cc1F ZINC000052615746 938447273 /nfs/dbraw/zinc/44/72/73/938447273.db2.gz DZXHJSMIHIPHNX-JTQLQIEISA-N 0 0 357.341 3.715 20 5 FHBDRN CCN(C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)c1ccc(OC)cc1 ZINC000536148780 938455638 /nfs/dbraw/zinc/45/56/38/938455638.db2.gz DQKLYAZTELGFJT-UHFFFAOYSA-N 0 0 353.378 3.680 20 5 FHBDRN O=c1c([N+](=O)[O-])cc(Cl)cn1Cc1c(Cl)ccc2cccnc21 ZINC000124213953 945176455 /nfs/dbraw/zinc/17/64/55/945176455.db2.gz HFQZYRJGBDCCNF-UHFFFAOYSA-N 0 0 350.161 3.660 20 5 FHBDRN CCO[C@H](C)c1nc(COc2ccc([N+](=O)[O-])cc2C(C)=O)cs1 ZINC000536155360 938472169 /nfs/dbraw/zinc/47/21/69/938472169.db2.gz RMSVJQVBXXHLCY-LLVKDONJSA-N 0 0 350.396 3.930 20 5 FHBDRN COc1ccc([C@@H](O)CNc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)cc1 ZINC000080568658 938478772 /nfs/dbraw/zinc/47/87/72/938478772.db2.gz UUQAVCOVATZREP-HNNXBMFYSA-N 0 0 356.300 3.768 20 5 FHBDRN O=[N+]([O-])c1cnc2ccc(NCCCO[C@@H]3CCCc4ccccc43)nn21 ZINC000302003482 938499351 /nfs/dbraw/zinc/49/93/51/938499351.db2.gz RIMYFAHMBFQQCP-MRXNPFEDSA-N 0 0 367.409 3.534 20 5 FHBDRN Cc1cc(NCc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])ccc1C(=O)NC(C)C ZINC000278524590 938502904 /nfs/dbraw/zinc/50/29/04/938502904.db2.gz SXRLTOCXJVVDMJ-UHFFFAOYSA-N 0 0 372.381 3.562 20 5 FHBDRN Cc1cc(NCc2ccc(C[NH+]3C[C@H](C)O[C@@H](C)C3)cc2)ncc1[N+](=O)[O-] ZINC000080598127 938514503 /nfs/dbraw/zinc/51/45/03/938514503.db2.gz LZTKMJCLQASQNA-HOTGVXAUSA-N 0 0 370.453 3.520 20 5 FHBDRN COc1ccc(Nc2ccc([N+](=O)[O-])c3cnccc23)cc1NC(C)=O ZINC000247941971 938517653 /nfs/dbraw/zinc/51/76/53/938517653.db2.gz NPSOSTRJVNDQJP-UHFFFAOYSA-N 0 0 352.350 3.854 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1-c1noc(-c2cc(COC(C)(C)C)on2)n1 ZINC000583985482 938519471 /nfs/dbraw/zinc/51/94/71/938519471.db2.gz XXZYANDIQZJQLQ-UHFFFAOYSA-N 0 0 358.354 3.923 20 5 FHBDRN CC(C)(C(=O)NC[C@H]1CCC2(CCCCC2)O1)c1ccccc1[N+](=O)[O-] ZINC000506423621 945182112 /nfs/dbraw/zinc/18/21/12/945182112.db2.gz SWMOKUNJXHMQTN-OAHLLOKOSA-N 0 0 360.454 3.871 20 5 FHBDRN Cc1c(F)ccc(Cl)c1NC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000583988344 938522283 /nfs/dbraw/zinc/52/22/83/938522283.db2.gz OEHCUTNUJCBRLP-UHFFFAOYSA-N 0 0 352.705 3.677 20 5 FHBDRN C[C@H](NC(=O)N[C@H]1c2ccc(F)cc2O[C@@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000458769036 938544881 /nfs/dbraw/zinc/54/48/81/938544881.db2.gz PFKPVQQACCYPLF-WVQJBOLRSA-N 0 0 359.357 3.616 20 5 FHBDRN CCc1n[nH]c(C(=O)N2CC=C(c3cccc4ccccc43)C2)c1[N+](=O)[O-] ZINC000507366898 945185723 /nfs/dbraw/zinc/18/57/23/945185723.db2.gz DLPGRYPXSVBUAD-UHFFFAOYSA-N 0 0 362.389 3.573 20 5 FHBDRN CN(Cc1c(F)cccc1Cl)C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000536202620 938564141 /nfs/dbraw/zinc/56/41/41/938564141.db2.gz FYSUKSVLWQFSEG-UHFFFAOYSA-N 0 0 365.792 3.771 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)c2cn(C)nc2-c2cccs2)cc1[N+](=O)[O-] ZINC000158809375 938586848 /nfs/dbraw/zinc/58/68/48/938586848.db2.gz BMQNVZNXZXFICO-LBPRGKRZSA-N 0 0 370.434 3.856 20 5 FHBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)Cn1ccc(=O)c2ccccc21 ZINC000135500217 938599376 /nfs/dbraw/zinc/59/93/76/938599376.db2.gz IEXDXFYDDPOLQX-UHFFFAOYSA-N 0 0 371.780 3.510 20 5 FHBDRN O=C(NC[C@H]1CCO[C@H]1c1ccccc1)c1c[nH]c2ccc([N+](=O)[O-])cc21 ZINC000584145283 938616701 /nfs/dbraw/zinc/61/67/01/938616701.db2.gz QZMIBMWLWHIILP-KUHUBIRLSA-N 0 0 365.389 3.584 20 5 FHBDRN O=C(Cc1cccc(OC(F)(F)F)c1)Nc1ccc([N+](=O)[O-])cc1F ZINC000440050392 945190687 /nfs/dbraw/zinc/19/06/87/945190687.db2.gz KKMQIYNCUVKAQE-UHFFFAOYSA-N 0 0 358.247 3.814 20 5 FHBDRN Cn1ccc2ccc(N[C@H](Cc3ccccc3[N+](=O)[O-])C3CC3)cc2c1=O ZINC000584175649 938626791 /nfs/dbraw/zinc/62/67/91/938626791.db2.gz HIWRAGWMMCCWGA-LJQANCHMSA-N 0 0 363.417 3.880 20 5 FHBDRN O=[N+]([O-])c1ccc(NCCO)c(NCc2c(Cl)cccc2Cl)c1 ZINC000052892635 938645051 /nfs/dbraw/zinc/64/50/51/938645051.db2.gz UMORWLGTTYMMMS-UHFFFAOYSA-N 0 0 356.209 3.918 20 5 FHBDRN C[C@H](Nc1ccc(C(=O)NCc2ccco2)cc1[N+](=O)[O-])c1ccccn1 ZINC000052916456 938661979 /nfs/dbraw/zinc/66/19/79/938661979.db2.gz NMEIIEGSOPCKGK-ZDUSSCGKSA-N 0 0 366.377 3.686 20 5 FHBDRN CCCNC(=O)c1ccc(NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000065656521 938664160 /nfs/dbraw/zinc/66/41/60/938664160.db2.gz CINMZICORNVWMR-UHFFFAOYSA-N 0 0 361.785 3.640 20 5 FHBDRN O=C(OCc1noc(-c2cccc(Cl)c2)n1)c1csc([N+](=O)[O-])c1 ZINC000176814225 938667518 /nfs/dbraw/zinc/66/75/18/938667518.db2.gz LPGBLYXFZTURCG-UHFFFAOYSA-N 0 0 365.754 3.717 20 5 FHBDRN Cc1oc(-c2cccs2)nc1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000584283342 938670056 /nfs/dbraw/zinc/67/00/56/938670056.db2.gz RVICJSWEMVIRMJ-UHFFFAOYSA-N 0 0 357.391 3.825 20 5 FHBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)NC1(C(F)F)CCCC1 ZINC000685281692 938676293 /nfs/dbraw/zinc/67/62/93/938676293.db2.gz JCKDUVAGZDNQSY-UHFFFAOYSA-N 0 0 370.399 3.849 20 5 FHBDRN O=C(OC[C@@H]1CC1(Cl)Cl)c1ccc(Br)cc1[N+](=O)[O-] ZINC000176818909 938679347 /nfs/dbraw/zinc/67/93/47/938679347.db2.gz OZCKFIYJBRWMHJ-LURJTMIESA-N 0 0 368.998 3.708 20 5 FHBDRN Cc1ccc(CN(CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C2CC2)o1 ZINC000052993932 938692806 /nfs/dbraw/zinc/69/28/06/938692806.db2.gz DXHVLJBSVXLLEG-UHFFFAOYSA-N 0 0 363.801 3.753 20 5 FHBDRN Cc1ccc(CN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C2CC2)o1 ZINC000052994582 938692825 /nfs/dbraw/zinc/69/28/25/938692825.db2.gz RAFPCITZYXBITF-UHFFFAOYSA-N 0 0 354.366 3.711 20 5 FHBDRN CCOc1cc(CNc2cc(C)c([N+](=O)[O-])cn2)ccc1OC(F)F ZINC000074741612 938704034 /nfs/dbraw/zinc/70/40/34/938704034.db2.gz LGOVOUMSTHWJQV-UHFFFAOYSA-N 0 0 353.325 3.910 20 5 FHBDRN Cc1cc(OCC(=O)N[C@H](C)c2cccs2)c(Cl)cc1[N+](=O)[O-] ZINC000506424745 945197356 /nfs/dbraw/zinc/19/73/56/945197356.db2.gz XXBLOTVASSAVIS-SNVBAGLBSA-N 0 0 354.815 3.874 20 5 FHBDRN CCc1nn(C)cc1-c1noc(-c2ccc3[nH]c4ccccc4c(=O)c3c2)n1 ZINC000426557133 945199491 /nfs/dbraw/zinc/19/94/91/945199491.db2.gz QBJVFBWCTGVEQI-UHFFFAOYSA-N 0 0 371.400 3.694 20 5 FHBDRN CCOc1ccc(C(=O)N[C@H]2CCCC[C@@H]2SCC)cc1[N+](=O)[O-] ZINC000427225224 945199938 /nfs/dbraw/zinc/19/99/38/945199938.db2.gz FOKSMJJVUGXZFE-BBRMVZONSA-N 0 0 352.456 3.788 20 5 FHBDRN CCn1cc([C@@H](C)NCc2csc(-c3cccc([N+](=O)[O-])c3)n2)cn1 ZINC000294890222 945200084 /nfs/dbraw/zinc/20/00/84/945200084.db2.gz QTHWOMFWJQBMAQ-GFCCVEGCSA-N 0 0 357.439 3.786 20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])N[C@@H]1C[C@H]1c1cccc(Cl)c1 ZINC000437287194 945202370 /nfs/dbraw/zinc/20/23/70/945202370.db2.gz DGDHMHDYFOWGFG-GOEBONIOSA-N 0 0 359.813 3.723 20 5 FHBDRN Cc1cc(Br)oc1C(=O)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000162189863 938777567 /nfs/dbraw/zinc/77/75/67/938777567.db2.gz NRGOGQRKJPCKAJ-UHFFFAOYSA-N 0 0 365.183 3.852 20 5 FHBDRN CC(C)(C)OCCNc1cc(C(F)(F)C(F)(F)F)ncc1[N+](=O)[O-] ZINC000584390458 938796128 /nfs/dbraw/zinc/79/61/28/938796128.db2.gz CLARQZHSYYDJEU-UHFFFAOYSA-N 0 0 357.279 3.871 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]c(N3CCC[C@H]3c3ccc4c(c3)OCCO4)nc2c1 ZINC000584387178 938796303 /nfs/dbraw/zinc/79/63/03/938796303.db2.gz GRHDTSPWLBZSSQ-INIZCTEOSA-N 0 0 366.377 3.584 20 5 FHBDRN O=C(NCCOc1ccc([N+](=O)[O-])cc1)c1c(Cl)cccc1Cl ZINC000081714496 938797582 /nfs/dbraw/zinc/79/75/82/938797582.db2.gz FMFHRWTXPJGVJH-UHFFFAOYSA-N 0 0 355.177 3.710 20 5 FHBDRN Cc1ccc(NCCCNC(=O)c2cc(F)c(F)cc2F)c([N+](=O)[O-])c1 ZINC000437292232 945206773 /nfs/dbraw/zinc/20/67/73/945206773.db2.gz UTBBATHANZXKOD-UHFFFAOYSA-N 0 0 367.327 3.553 20 5 FHBDRN CC(C)(C)Oc1cc(NCc2nc(C(F)(F)F)n[nH]2)ccc1[N+](=O)[O-] ZINC000480300391 938824720 /nfs/dbraw/zinc/82/47/20/938824720.db2.gz ITZHPKUPQAYMHA-UHFFFAOYSA-N 0 0 359.308 3.521 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)CCCOc1ccc2c(c1)CCC2 ZINC000480311021 938830933 /nfs/dbraw/zinc/83/09/33/938830933.db2.gz XPYWTAMRHCGFPZ-UHFFFAOYSA-N 0 0 368.433 3.901 20 5 FHBDRN COC(=O)c1cc(N2CCC[C@@H](C(F)(F)F)[C@H]2C)cc(C)c1[N+](=O)[O-] ZINC000480307374 938831434 /nfs/dbraw/zinc/83/14/34/938831434.db2.gz VCTGAODNWISPEA-ZWNOBZJWSA-N 0 0 360.332 3.857 20 5 FHBDRN C[C@H]1[C@H](C(F)(F)F)CCCN1c1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-] ZINC000480310726 938831567 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COC(=O)c1ccc(Cl)c(NC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])c1 ZINC000065668826 938868551 /nfs/dbraw/zinc/86/85/51/938868551.db2.gz PUFNFOVZXXEXJD-UHFFFAOYSA-N 0 0 370.695 3.565 20 5 FHBDRN COc1ccc([C@H](C)NC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])cc1F ZINC000065669071 938871828 /nfs/dbraw/zinc/87/18/28/938871828.db2.gz VJJHZKNFSJKXGF-QMMMGPOBSA-N 0 0 354.284 3.512 20 5 FHBDRN COc1ccc2cc(CNC(=O)c3cc(F)c(F)cc3[N+](=O)[O-])ccc2c1 ZINC000065669137 938872323 /nfs/dbraw/zinc/87/23/23/938872323.db2.gz QIEXETCRCSWXBN-UHFFFAOYSA-N 0 0 372.327 3.965 20 5 FHBDRN C/C(=C\C(=O)N1CC[C@H](Oc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000843618859 938874015 /nfs/dbraw/zinc/87/40/15/938874015.db2.gz GJZNZSMGFHLDBN-LLLGYDHXSA-N 0 0 352.390 3.678 20 5 FHBDRN Cc1cccc(C(=O)N[C@@H]2CC(C)(C)Oc3ccc(N)cc32)c1[N+](=O)[O-] ZINC000289904966 938885793 /nfs/dbraw/zinc/88/57/93/938885793.db2.gz UMQWPMIHOMBUDT-OAHLLOKOSA-N 0 0 355.394 3.518 20 5 FHBDRN O=C(c1cncn1-c1ccc(F)cc1)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000179096097 938890418 /nfs/dbraw/zinc/89/04/18/938890418.db2.gz HBGSMDVQOOSULZ-UHFFFAOYSA-N 0 0 366.352 3.513 20 5 FHBDRN CCS[C@H]1CCCCN(C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000480381755 938900159 /nfs/dbraw/zinc/90/01/59/938900159.db2.gz ZKKUOXYZYCUDEC-INIZCTEOSA-N 0 0 374.466 3.528 20 5 FHBDRN CC(C)c1ccc(CN2CCC[C@@H]2C(=O)NCc2ccco2)cc1[N+](=O)[O-] ZINC000128207069 938901755 /nfs/dbraw/zinc/90/17/55/938901755.db2.gz ZKBUGRIMMJXHOF-GOSISDBHSA-N 0 0 371.437 3.592 20 5 FHBDRN CC[C@@H](OC(=O)Cc1c(OC)cccc1OC)c1cccc([N+](=O)[O-])c1 ZINC001267374675 938905094 /nfs/dbraw/zinc/90/50/94/938905094.db2.gz RDJYLELFAPRENS-MRXNPFEDSA-N 0 0 359.378 3.849 20 5 FHBDRN CCc1ccc(C(=O)Nc2ccc3nc(OC)ccc3c2)cc1[N+](=O)[O-] ZINC001125711908 938912174 /nfs/dbraw/zinc/91/21/74/938912174.db2.gz CTIDMBRLQINKAT-UHFFFAOYSA-N 0 0 351.362 3.966 20 5 FHBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)Nc1c(F)cccc1NC(C)C ZINC000158866905 938922086 /nfs/dbraw/zinc/92/20/86/938922086.db2.gz QWRYPJULHIZBGF-UHFFFAOYSA-N 0 0 367.402 3.663 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)NC1CCC(C(=O)OC(C)(C)C)CC1 ZINC000094123433 938935170 /nfs/dbraw/zinc/93/51/70/938935170.db2.gz ANSPZIZFCGAOGV-UHFFFAOYSA-N 0 0 362.426 3.534 20 5 FHBDRN O=C(c1ccc(N2CCCC2)c([N+](=O)[O-])c1)N1CC[C@H]1c1ccccc1 ZINC000053081042 938953976 /nfs/dbraw/zinc/95/39/76/938953976.db2.gz ZHSBLYSVEUNKBY-KRWDZBQOSA-N 0 0 351.406 3.782 20 5 FHBDRN CCOC(=O)c1ccnc(NCc2c(C)c3ccccc3n2C)c1[N+](=O)[O-] ZINC000480499111 938965097 /nfs/dbraw/zinc/96/50/97/938965097.db2.gz IQJCQMQWOVRXAU-UHFFFAOYSA-N 0 0 368.393 3.579 20 5 FHBDRN Cc1nc(NC(=O)C2(CCOCc3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000472326036 938968016 /nfs/dbraw/zinc/96/80/16/938968016.db2.gz LVYBDGAWMFOTJL-UHFFFAOYSA-N 0 0 355.394 3.624 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1Sc1ccccc1)N1CC(F)(F)C1 ZINC000611906521 938976145 /nfs/dbraw/zinc/97/61/45/938976145.db2.gz COMAHUPVMBJJBE-UHFFFAOYSA-N 0 0 350.346 3.837 20 5 FHBDRN COc1ccc2c(c1OC)CCN(c1ccnc3c1cccc3[N+](=O)[O-])C2 ZINC000432156286 945219589 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3.505 20 5 FHBDRN Cc1cc(N[C@@H](CO)c2ccccc2)c(Br)cc1[N+](=O)[O-] ZINC000235834167 939011471 /nfs/dbraw/zinc/01/14/71/939011471.db2.gz YBMNVYBOTPJKRD-AWEZNQCLSA-N 0 0 351.200 3.811 20 5 FHBDRN O=[N+]([O-])c1cc(-c2noc(/C=C\C3CCCCC3)n2)ccc1-n1cncn1 ZINC000453198012 939011678 /nfs/dbraw/zinc/01/16/78/939011678.db2.gz NYILOWNIEOQNBQ-TWGQIWQCSA-N 0 0 366.381 3.819 20 5 FHBDRN O=C(COc1ccccc1[N+](=O)[O-])Nc1cc(Cl)ccc1NC1CC1 ZINC000136178462 939013503 /nfs/dbraw/zinc/01/35/03/939013503.db2.gz IEJUMHJCWWWOLC-UHFFFAOYSA-N 0 0 361.785 3.840 20 5 FHBDRN CCSc1cc(CNC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)ccn1 ZINC000188108638 939018696 /nfs/dbraw/zinc/01/86/96/939018696.db2.gz MWQHEELJVJIYON-UHFFFAOYSA-N 0 0 374.466 3.836 20 5 FHBDRN CC(C)c1ccc(C(=O)Nc2cc3c(cc2F)NC(=O)CC3)cc1[N+](=O)[O-] ZINC000188139632 939019408 /nfs/dbraw/zinc/01/94/08/939019408.db2.gz HAPJULUIAGAUHJ-UHFFFAOYSA-N 0 0 371.368 3.994 20 5 FHBDRN Cc1c(C(=O)N2CCC(OCc3ccccc3F)CC2)cccc1[N+](=O)[O-] ZINC000092056043 945220986 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371.780 3.735 20 5 FHBDRN O=C(Nc1nc2c(s1)CCCC2)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000179617937 939895763 /nfs/dbraw/zinc/89/57/63/939895763.db2.gz KDFHBXQDJVHXCC-UHFFFAOYSA-N 0 0 354.391 3.731 20 5 FHBDRN C[C@H](C(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1)n1cnc2ccccc21 ZINC000179616884 939895950 /nfs/dbraw/zinc/89/59/50/939895950.db2.gz LKVNFHVNMOOLBD-CQSZACIVSA-N 0 0 364.405 3.697 20 5 FHBDRN CNC(=O)c1cc(NC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)ccc1Cl ZINC000179620233 939896756 /nfs/dbraw/zinc/89/67/56/939896756.db2.gz KBLUMFHITRKSLW-UHFFFAOYSA-N 0 0 368.176 3.514 20 5 FHBDRN O=C(NC[C@@H]1CCCC(F)(F)C1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000410263777 939905064 /nfs/dbraw/zinc/90/50/64/939905064.db2.gz COMFBOZMVVUCDT-CYBMUJFWSA-N 0 0 367.396 3.750 20 5 FHBDRN CCc1nc([C@@H]2CCCN(C(=O)Nc3c(C)ccc([N+](=O)[O-])c3C)C2)no1 ZINC000364089264 939907869 /nfs/dbraw/zinc/90/78/69/939907869.db2.gz FPOVIIXJVMCSIZ-CYBMUJFWSA-N 0 0 373.413 3.569 20 5 FHBDRN Cc1noc(C)c1CSCc1nc(Cc2ccccc2[N+](=O)[O-])no1 ZINC000516821984 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367.405 3.521 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1Cl)N1CCC[C@H](C[C@H]2CCOC2)C1 ZINC000375837680 939954934 /nfs/dbraw/zinc/95/49/34/939954934.db2.gz CVIOSEDRGXWTBJ-CHWSQXEVSA-N 0 0 352.818 3.527 20 5 FHBDRN COc1cc(C(=O)N(C)[C@H](C)Cc2ccccc2C)c([N+](=O)[O-])cc1F ZINC000410778523 939957227 /nfs/dbraw/zinc/95/72/27/939957227.db2.gz YWNMNTZLSACMAF-CYBMUJFWSA-N 0 0 360.385 3.754 20 5 FHBDRN C[C@@H](N(C)C(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)C1(C)CC1 ZINC000426253615 945285061 /nfs/dbraw/zinc/28/50/61/945285061.db2.gz AQZUCGOBQJYXJI-SNVBAGLBSA-N 0 0 359.348 3.944 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N(C)C2CCN(c3ccccc3)CC2)c1 ZINC000410803880 939960742 /nfs/dbraw/zinc/96/07/42/939960742.db2.gz BBGYBQMUJXLQLF-UHFFFAOYSA-N 0 0 353.422 3.644 20 5 FHBDRN CC1(C)CN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])[C@@H]1[C@@H]1CCCO1 ZINC000410871353 939964238 /nfs/dbraw/zinc/96/42/38/939964238.db2.gz HKNREFMQURECPS-UONOGXRCSA-N 0 0 372.343 3.643 20 5 FHBDRN CCc1ccc(NC(=O)C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)cc1CC ZINC000179831906 939967233 /nfs/dbraw/zinc/96/72/33/939967233.db2.gz NQLYOTSVNHXKJC-CYBMUJFWSA-N 0 0 369.421 3.536 20 5 FHBDRN O=[N+]([O-])c1cc(CN(Cc2ccccc2)C[C@@H](O)c2ccco2)cs1 ZINC000177153384 939970552 /nfs/dbraw/zinc/97/05/52/939970552.db2.gz WKZXRPGIBJEZMY-MRXNPFEDSA-N 0 0 358.419 3.985 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Cn1ccc2ccccc21 ZINC000065864660 939985113 /nfs/dbraw/zinc/98/51/13/939985113.db2.gz LLYLMEJPIBVFLY-UHFFFAOYSA-N 0 0 351.406 3.987 20 5 FHBDRN CCc1ccc(CN(C(=O)CNc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000065865943 939988304 /nfs/dbraw/zinc/98/83/04/939988304.db2.gz RAPUOWAJOBVAAV-UHFFFAOYSA-N 0 0 353.422 3.760 20 5 FHBDRN COc1ccc(CSCC(=O)N2[C@H](C)CCC2(C)C)cc1[N+](=O)[O-] ZINC000411085762 939995366 /nfs/dbraw/zinc/99/53/66/939995366.db2.gz LUGYZZQXRHENHW-GFCCVEGCSA-N 0 0 352.456 3.626 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc2c(n1)CCCC2=O ZINC000411074348 939998156 /nfs/dbraw/zinc/99/81/56/939998156.db2.gz MQIUQWBHYVHJRI-LLVKDONJSA-N 0 0 371.418 3.628 20 5 FHBDRN CCOC[C@H]1CCCCN1C(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC000411108474 939998574 /nfs/dbraw/zinc/99/85/74/939998574.db2.gz JQHPLSLXRYDCIF-GFCCVEGCSA-N 0 0 360.332 3.645 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N1CC2CC1(C(F)(F)F)C2 ZINC000411110196 939998647 /nfs/dbraw/zinc/99/86/47/939998647.db2.gz CUVRKSNFSGHLPN-UHFFFAOYSA-N 0 0 368.233 3.781 20 5 FHBDRN CCOc1ccccc1CN(C)C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000065873310 940003858 /nfs/dbraw/zinc/00/38/58/940003858.db2.gz HMBYEBCQLZBFIZ-UHFFFAOYSA-N 0 0 367.405 3.607 20 5 FHBDRN Cc1cccc([C@@H](C)NC(=O)C(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)c1C ZINC000411236898 940017061 /nfs/dbraw/zinc/01/70/61/940017061.db2.gz JBOQGWBGBKHCEF-OAHLLOKOSA-N 0 0 369.421 3.644 20 5 FHBDRN COc1ccc2c(c1)CC[C@H](NC(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1)C2 ZINC000612360213 940021948 /nfs/dbraw/zinc/02/19/48/940021948.db2.gz JGXRVFUGHOWHJP-DYVFJYSZSA-N 0 0 369.421 3.521 20 5 FHBDRN Cc1cccc([C@H]2CCCN2C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)n1 ZINC000364889879 940022260 /nfs/dbraw/zinc/02/22/60/940022260.db2.gz WORXANOTRSLRPP-MRXNPFEDSA-N 0 0 361.348 3.754 20 5 FHBDRN C[C@H]1N(C(=O)/C=C/c2ccc(Cl)c([N+](=O)[O-])c2)CCC12CCOCC2 ZINC000364967954 940029815 /nfs/dbraw/zinc/02/98/15/940029815.db2.gz WNKSJAYCSBJQGB-MASHWEEQSA-N 0 0 364.829 3.679 20 5 FHBDRN CCN(c1ccc(C(=O)N(C)CCc2cccc([N+](=O)[O-])c2)cn1)C(C)C ZINC000548924458 940030386 /nfs/dbraw/zinc/03/03/86/940030386.db2.gz CYQJFLIVOGVCTN-UHFFFAOYSA-N 0 0 370.453 3.539 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)C[C@@H](c1ccc(O)cc1)C1CC1 ZINC000411372555 940032910 /nfs/dbraw/zinc/03/29/10/940032910.db2.gz VNAADZUZKCEDBM-GOSISDBHSA-N 0 0 354.406 3.843 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)C(=O)N[C@@H](C)c1c(C)cccc1C ZINC000411354140 940035904 /nfs/dbraw/zinc/03/59/04/940035904.db2.gz MLWDUKBCNZRZEB-HNNXBMFYSA-N 0 0 369.421 3.644 20 5 FHBDRN Cc1ccc([C@@H]2CCCN2C(=O)CNc2ccccc2[N+](=O)[O-])cc1C ZINC000065897540 940038365 /nfs/dbraw/zinc/03/83/65/940038365.db2.gz FGOPVHNMVVWRNN-SFHVURJKSA-N 0 0 353.422 3.987 20 5 FHBDRN CC[C@@H]1CCCC[C@H]1N(C)C(=O)C(=O)Nc1cc(C)c([N+](=O)[O-])cc1C ZINC000411418515 940040810 /nfs/dbraw/zinc/04/08/10/940040810.db2.gz RNODAAZOOWGLDF-GDBMZVCRSA-N 0 0 361.442 3.577 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)C(=O)Nc1ccc(C(C)C)cc1 ZINC000411388258 940041117 /nfs/dbraw/zinc/04/11/17/940041117.db2.gz UTRNYQOJIJGLHF-UHFFFAOYSA-N 0 0 355.394 3.912 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N(C)[C@@H]2CCCc3cccnc32)c1 ZINC000365040805 940042910 /nfs/dbraw/zinc/04/29/10/940042910.db2.gz QRLVBSGIDROPNN-MRXNPFEDSA-N 0 0 357.435 3.861 20 5 FHBDRN O=C(c1c(Cl)cccc1[N+](=O)[O-])N1CCC(c2ccccc2CO)CC1 ZINC000365031898 940045502 /nfs/dbraw/zinc/04/55/02/940045502.db2.gz YLUXZCNJKHTODL-UHFFFAOYSA-N 0 0 374.824 3.760 20 5 FHBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1C[C@@H]2CCCC[C@@H]2C1 ZINC000427353237 945292723 /nfs/dbraw/zinc/29/27/23/945292723.db2.gz XIHRSWWYRBKHSI-RWMBFGLXSA-N 0 0 352.818 3.664 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCCC[C@H]1c1cc[nH]n1 ZINC000375925194 940069502 /nfs/dbraw/zinc/06/95/02/940069502.db2.gz RVKUHQIJMWAKSI-YJBOKZPZSA-N 0 0 356.426 3.640 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CC[C@@H](Oc2cccnc2C)C1 ZINC000365211763 940082125 /nfs/dbraw/zinc/08/21/25/940082125.db2.gz CMDWEOOTUFEMNR-OAHLLOKOSA-N 0 0 370.409 3.600 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N(CCCO)[C@H]1CCc2ccccc21 ZINC000085545558 940087511 /nfs/dbraw/zinc/08/75/11/940087511.db2.gz WDIUSBIXDJQHJJ-IBGZPJMESA-N 0 0 369.421 3.807 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N[C@H]1CCc2cnn(C(C)C)c2C1 ZINC000365225578 940088056 /nfs/dbraw/zinc/08/80/56/940088056.db2.gz GCOOQZKGRRRKCX-HNNXBMFYSA-N 0 0 371.441 3.668 20 5 FHBDRN CC(C)(C)CN(Cc1ccccc1)S(=O)(=O)c1ccccc1[N+](=O)[O-] ZINC000507536490 945295460 /nfs/dbraw/zinc/29/54/60/945295460.db2.gz RXAQYTQYPUGMAO-UHFFFAOYSA-N 0 0 362.451 3.832 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NS(=O)(=O)c1cccc(C(F)(F)F)c1 ZINC000005598818 940104104 /nfs/dbraw/zinc/10/41/04/940104104.db2.gz HZZWBXAEZKZALR-UHFFFAOYSA-N 0 0 360.313 3.723 20 5 FHBDRN CC(C)(NCC(=O)N1CCC[C@@H]2CCCC[C@H]21)c1ccccc1[N+](=O)[O-] ZINC000411759089 940113149 /nfs/dbraw/zinc/11/31/49/940113149.db2.gz PAJWDOUAFCCBTF-DOTOQJQBSA-N 0 0 359.470 3.601 20 5 FHBDRN O=C(Nc1ccc(OC(=O)c2cccc([N+](=O)[O-])c2)cc1)c1ccco1 ZINC000051036558 940116252 /nfs/dbraw/zinc/11/62/52/940116252.db2.gz BWDDDIWHAAVRSW-UHFFFAOYSA-N 0 0 352.302 3.659 20 5 FHBDRN Cc1ccc(C(=O)Oc2ccc(NC(=O)c3ccco3)cc2)cc1[N+](=O)[O-] ZINC000051035871 940124789 /nfs/dbraw/zinc/12/47/89/940124789.db2.gz HSACVCXSRQFUED-UHFFFAOYSA-N 0 0 366.329 3.968 20 5 FHBDRN Cc1cc(NC(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)c2ccccc2n1 ZINC000612530855 940127167 /nfs/dbraw/zinc/12/71/67/940127167.db2.gz WGMBYAMBAIFBGI-GFCCVEGCSA-N 0 0 353.353 3.755 20 5 FHBDRN O=C(c1ccccc1[N+](=O)[O-])N1CCC(c2nc3c(cccc3F)[nH]2)CC1 ZINC000365384504 940144553 /nfs/dbraw/zinc/14/45/53/940144553.db2.gz AILPENABJXIVFF-UHFFFAOYSA-N 0 0 368.368 3.630 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc(OC(F)F)c1 ZINC000548940644 940146111 /nfs/dbraw/zinc/14/61/11/940146111.db2.gz LXVDOIXYUSJZOU-UHFFFAOYSA-N 0 0 365.336 3.903 20 5 FHBDRN CCC(CC)(CC(=O)OC)NC(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000473858347 945298986 /nfs/dbraw/zinc/29/89/86/945298986.db2.gz VQRMNHFJTOVPFN-UHFFFAOYSA-N 0 0 350.415 3.570 20 5 FHBDRN C[C@@H](NC(=O)c1nc2ccccc2nc1C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000448733755 940170412 /nfs/dbraw/zinc/17/04/12/940170412.db2.gz FXBWTITUBLOEAK-GFCCVEGCSA-N 0 0 362.389 3.906 20 5 FHBDRN C[C@@H](c1cccc([N+](=O)[O-])c1)N1CC[C@@]2(C1)CC(=O)c1ccccc1O2 ZINC000411982040 940173205 /nfs/dbraw/zinc/17/32/05/940173205.db2.gz KUMIJYHXKLWWAS-XOBRGWDASA-N 0 0 352.390 3.766 20 5 FHBDRN O=[N+]([O-])c1cc(CN2CCC[C@H](Oc3ccccc3)C2)c2c(c1)COCO2 ZINC000411985373 940173357 /nfs/dbraw/zinc/17/33/57/940173357.db2.gz PEJWLHBXIPUGOT-IBGZPJMESA-N 0 0 370.405 3.505 20 5 FHBDRN Cc1ccc(CN(C(C)C)S(=O)(=O)c2ccc([N+](=O)[O-])cc2C)s1 ZINC000066002059 940175832 /nfs/dbraw/zinc/17/58/32/940175832.db2.gz ZMPBOBIQAMIURY-UHFFFAOYSA-N 0 0 368.480 3.872 20 5 FHBDRN CSc1ccccc1CC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000540893815 940177270 /nfs/dbraw/zinc/17/72/70/940177270.db2.gz HZNILOHZVPNLJC-UHFFFAOYSA-N 0 0 364.854 3.872 20 5 FHBDRN COc1ccc(CN(C)C(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)cc1C ZINC000411998009 940180250 /nfs/dbraw/zinc/18/02/50/940180250.db2.gz KAQDRVAKXUYUTL-UHFFFAOYSA-N 0 0 372.421 3.971 20 5 FHBDRN CCOc1cc(OCc2nc([C@H](C)SCC)no2)ccc1[N+](=O)[O-] ZINC000188584807 940180311 /nfs/dbraw/zinc/18/03/11/940180311.db2.gz QSDIVZNIXRTSKQ-JTQLQIEISA-N 0 0 353.400 3.770 20 5 FHBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])c1cc(-c2ccccc2)on1 ZINC000540892205 940182286 /nfs/dbraw/zinc/18/22/86/940182286.db2.gz DSUSZPFRYLKKHV-UHFFFAOYSA-N 0 0 371.780 3.876 20 5 FHBDRN C[C@H](C(=O)N(C)CCCOCc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000545255339 940185644 /nfs/dbraw/zinc/18/56/44/940185644.db2.gz DWYKQTJPZHBBAF-INIZCTEOSA-N 0 0 356.422 3.764 20 5 FHBDRN COc1cc(OCC(=O)N[C@@H](C)c2ccc(C(C)C)cc2)ccc1[N+](=O)[O-] ZINC000066016344 940188712 /nfs/dbraw/zinc/18/87/12/940188712.db2.gz DVPCZKNXTWERRG-AWEZNQCLSA-N 0 0 372.421 3.983 20 5 FHBDRN C[C@@H](CNC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1)Oc1ccccc1 ZINC000431664012 940198625 /nfs/dbraw/zinc/19/86/25/940198625.db2.gz JWLRASZYXIXOKO-AWEZNQCLSA-N 0 0 357.410 3.597 20 5 FHBDRN COc1cc(OCC(=O)Nc2ccc(OC(C)C)cc2C)ccc1[N+](=O)[O-] ZINC000066025237 940204264 /nfs/dbraw/zinc/20/42/64/940204264.db2.gz QOEUZWRGSSSIRB-UHFFFAOYSA-N 0 0 374.393 3.717 20 5 FHBDRN O=[N+]([O-])c1cnc2ccc(Br)cc2c1OC[C@@H]1CCCOC1 ZINC000612661320 940208099 /nfs/dbraw/zinc/20/80/99/940208099.db2.gz YOILVSVDSGTEES-SNVBAGLBSA-N 0 0 367.199 3.711 20 5 FHBDRN CC1(C)CN(S(=O)(=O)Cc2ccccc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000612672336 940211954 /nfs/dbraw/zinc/21/19/54/940211954.db2.gz ATYYBIZKMAFLOJ-KRWDZBQOSA-N 0 0 360.435 3.508 20 5 FHBDRN CC[C@@H](C)NC(=O)c1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000066035113 940212749 /nfs/dbraw/zinc/21/27/49/940212749.db2.gz ZHTGOSSRDXNIHB-CYBMUJFWSA-N 0 0 355.394 3.684 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)Nc1cc(-c2cccs2)[nH]n1 ZINC000066049959 940230711 /nfs/dbraw/zinc/23/07/11/940230711.db2.gz KJZUTMVANBJSQV-UHFFFAOYSA-N 0 0 367.390 3.640 20 5 FHBDRN O=C(c1cc2c(s1)CCCCC2)N1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000376046336 940235979 /nfs/dbraw/zinc/23/59/79/940235979.db2.gz QCROMNNOSROWST-UHFFFAOYSA-N 0 0 374.466 3.599 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CC[C@H](n3ncc4ccccc43)C2)c2ccncc21 ZINC000511370281 940240887 /nfs/dbraw/zinc/24/08/87/940240887.db2.gz RQPJLTWBVYOLFM-HNNXBMFYSA-N 0 0 359.389 3.944 20 5 FHBDRN O=[N+]([O-])c1cccc([C@H]([NH2+]CCCOC[C@H]2CCCO2)c2ccccc2)c1 ZINC000180022271 940250034 /nfs/dbraw/zinc/25/00/34/940250034.db2.gz QTOJHNMSDJAKQO-NHCUHLMSSA-N 0 0 370.449 3.860 20 5 FHBDRN CCC(=O)c1ccc(OC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)cc1 ZINC000066062028 940251195 /nfs/dbraw/zinc/25/11/95/940251195.db2.gz GTQKYTSITXQERY-UHFFFAOYSA-N 0 0 365.345 3.592 20 5 FHBDRN COc1ccc(OCCNc2ccc([N+](=O)[O-])cc2OC(F)F)cc1 ZINC000612778451 940271832 /nfs/dbraw/zinc/27/18/32/940271832.db2.gz RIYWMORMHVTKCI-UHFFFAOYSA-N 0 0 354.309 3.696 20 5 FHBDRN CCCN(C(=O)Cc1ccccc1[N+](=O)[O-])[C@H]1CCc2ccccc2C1 ZINC000511382504 940288708 /nfs/dbraw/zinc/28/87/08/940288708.db2.gz LSRCDXPBTMGHOH-IBGZPJMESA-N 0 0 352.434 3.933 20 5 FHBDRN CCOc1ccc([C@@H](C)NCc2nn(C)c3ccccc23)cc1[N+](=O)[O-] ZINC000612829284 940300248 /nfs/dbraw/zinc/30/02/48/940300248.db2.gz OCPLOEFTHWXVRQ-CYBMUJFWSA-N 0 0 354.410 3.731 20 5 FHBDRN O=C(CSc1ccccc1[N+](=O)[O-])N[C@H]1COc2ccc(Cl)cc21 ZINC000544085865 940301315 /nfs/dbraw/zinc/30/13/15/940301315.db2.gz YSLMLMRLBXZTTA-LBPRGKRZSA-N 0 0 364.810 3.590 20 5 FHBDRN Cc1ccc(-c2noc(CN(C)c3ccc(Cl)cn3)n2)cc1[N+](=O)[O-] ZINC000612895062 940327543 /nfs/dbraw/zinc/32/75/43/940327543.db2.gz ONRXOIUUJIEDMZ-UHFFFAOYSA-N 0 0 359.773 3.638 20 5 FHBDRN Cc1ccc(-c2noc(-c3csc(-c4ncccn4)n3)n2)cc1[N+](=O)[O-] ZINC000612895070 940327670 /nfs/dbraw/zinc/32/76/70/940327670.db2.gz UBOVKXZLUIFBEL-UHFFFAOYSA-N 0 0 366.362 3.534 20 5 FHBDRN COc1ccc2c(ccn2Cc2nc(-c3ccc(C)c([N+](=O)[O-])c3)no2)c1 ZINC000612896516 940328508 /nfs/dbraw/zinc/32/85/08/940328508.db2.gz KFOKCGGXWRBQTO-UHFFFAOYSA-N 0 0 364.361 3.965 20 5 FHBDRN COCc1ccccc1-c1noc(Cn2ccc3cc([N+](=O)[O-])ccc32)n1 ZINC000612902850 940335496 /nfs/dbraw/zinc/33/54/96/940335496.db2.gz YABUNNDAONPTQB-UHFFFAOYSA-N 0 0 364.361 3.794 20 5 FHBDRN CCO[C@@H]1C[C@@H](NC(=O)c2cccc(Cl)c2[N+](=O)[O-])C12CCCC2 ZINC000177653459 940338337 /nfs/dbraw/zinc/33/83/37/940338337.db2.gz DXLSVYNHRVZEIB-ZIAGYGMSSA-N 0 0 352.818 3.716 20 5 FHBDRN CCO[C@H]1C[C@@H](NC(=O)c2cccc(Cl)c2[N+](=O)[O-])C12CCCC2 ZINC000177653472 940338344 /nfs/dbraw/zinc/33/83/44/940338344.db2.gz DXLSVYNHRVZEIB-KGLIPLIRSA-N 0 0 352.818 3.716 20 5 FHBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)c1nc([C@H]2CCCC[C@H]2C)no1 ZINC000612928330 940341438 /nfs/dbraw/zinc/34/14/38/940341438.db2.gz SXKNCMUQBKWJEB-XUJVJEKNSA-N 0 0 358.398 3.763 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1-c1noc(CN(C)c2ccc(Cl)cn2)n1 ZINC000612934150 940344641 /nfs/dbraw/zinc/34/46/41/940344641.db2.gz IDVAJABYHNZSEE-UHFFFAOYSA-N 0 0 359.773 3.638 20 5 FHBDRN Cc1noc(C)c1[C@H](C)c1nc(Cc2c[nH]c3ccc([N+](=O)[O-])cc23)no1 ZINC000612960190 940362126 /nfs/dbraw/zinc/36/21/26/940362126.db2.gz KAUYXWRVFOPEJQ-VIFPVBQESA-N 0 0 367.365 3.807 20 5 FHBDRN COc1cccc(Cc2nnc(SCc3ccccc3[N+](=O)[O-])o2)c1 ZINC000066257224 940370826 /nfs/dbraw/zinc/37/08/26/940370826.db2.gz WFNWJCKOHAMFGI-UHFFFAOYSA-N 0 0 357.391 3.870 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)N2CCc3cc(Cl)ccc32)cc1C ZINC000507555646 945312682 /nfs/dbraw/zinc/31/26/82/945312682.db2.gz XTLWIWGMAREDKJ-UHFFFAOYSA-N 0 0 366.826 3.616 20 5 FHBDRN Cc1cc(C)c(NC(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)c(Cl)c1 ZINC000066270175 940380836 /nfs/dbraw/zinc/38/08/36/940380836.db2.gz ZSNIBQXEAVNZEC-UHFFFAOYSA-N 0 0 362.769 3.889 20 5 FHBDRN CSc1ccc(CSc2nc3cc([N+](=O)[O-])ccc3c(=O)n2C)cc1 ZINC000613000097 940383494 /nfs/dbraw/zinc/38/34/94/940383494.db2.gz DIATZAHVBWAFSQ-UHFFFAOYSA-N 0 0 373.459 3.856 20 5 FHBDRN Cc1nsc(C)c1-c1noc(Cc2c[nH]c3ccc([N+](=O)[O-])cc23)n1 ZINC000426600086 945314056 /nfs/dbraw/zinc/31/40/56/945314056.db2.gz CWUFYCNYCKRQKN-UHFFFAOYSA-N 0 0 355.379 3.790 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NCc2ncc(-c3ccccc3)o2)c1 ZINC000548973084 940395372 /nfs/dbraw/zinc/39/53/72/940395372.db2.gz ATXARFWBAPJUMY-UHFFFAOYSA-N 0 0 367.361 3.579 20 5 FHBDRN CCOc1cc(OCC2CCN(C(=O)C(C)(C)C)CC2)ccc1[N+](=O)[O-] ZINC000188612521 940404616 /nfs/dbraw/zinc/40/46/16/940404616.db2.gz DVJFSCGQJGUERV-UHFFFAOYSA-N 0 0 364.442 3.657 20 5 FHBDRN O=C(NCCNc1ccccc1[N+](=O)[O-])c1cc2ccc(F)cc2s1 ZINC000024320788 940410532 /nfs/dbraw/zinc/41/05/32/940410532.db2.gz XHQJDQLNFPRHPZ-UHFFFAOYSA-N 0 0 359.382 3.791 20 5 FHBDRN CCNc1ccc(C(=O)Nc2cc(F)cc(F)c2OC)cc1[N+](=O)[O-] ZINC000472492188 940411508 /nfs/dbraw/zinc/41/15/08/940411508.db2.gz BKEJVUQYDPUBAJ-UHFFFAOYSA-N 0 0 351.309 3.566 20 5 FHBDRN COC(=O)c1ccccc1C(=O)c1ccc(NC[C@H]2C[C@@H]2C)c([N+](=O)[O-])c1 ZINC000579896562 940413072 /nfs/dbraw/zinc/41/30/72/940413072.db2.gz NJMASMMUYZYIIA-GXTWGEPZSA-N 0 0 368.389 3.680 20 5 FHBDRN O=c1oc2ccc([N+](=O)[O-])cc2n1CCCN1CCc2cc(Cl)ccc21 ZINC000511859455 945319266 /nfs/dbraw/zinc/31/92/66/945319266.db2.gz NTDXHERBUDDYMW-UHFFFAOYSA-N 0 0 373.796 3.609 20 5 FHBDRN CCOc1cc(OCC(=O)Nc2cc(Cl)ccc2F)ccc1[N+](=O)[O-] ZINC000188618548 940429918 /nfs/dbraw/zinc/42/99/18/940429918.db2.gz CDIGUFFMIRPJBV-UHFFFAOYSA-N 0 0 368.748 3.804 20 5 FHBDRN Cc1oc(NC(=O)c2ccc([N+](=O)[O-])cc2Br)nc1C1CC1 ZINC000892519231 940432727 /nfs/dbraw/zinc/43/27/27/940432727.db2.gz NIJYUKLRLZNZOP-UHFFFAOYSA-N 0 0 366.171 3.783 20 5 FHBDRN CCO[C@@H]1C[C@@H](NC(=O)c2c(C)cc(Cl)cc2[N+](=O)[O-])C12CCC2 ZINC000613072683 940435338 /nfs/dbraw/zinc/43/53/38/940435338.db2.gz NSMPJPRYBQSMEO-ZIAGYGMSSA-N 0 0 352.818 3.634 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N2CCC(c3ccccn3)CC2)c1 ZINC000376193338 940446808 /nfs/dbraw/zinc/44/68/08/940446808.db2.gz DTROJDYBNJWZBU-UHFFFAOYSA-N 0 0 357.435 3.732 20 5 FHBDRN COC(=O)c1ccc(OCC(=O)c2ccc(C(C)C)cc2)cc1[N+](=O)[O-] ZINC000613110132 940452286 /nfs/dbraw/zinc/45/22/86/940452286.db2.gz GYTZGWYAZAPTNS-UHFFFAOYSA-N 0 0 357.362 3.767 20 5 FHBDRN Cc1cc(C)c(NS(=O)(=O)c2c(C)cccc2[N+](=O)[O-])c(Cl)c1 ZINC000613112132 940455810 /nfs/dbraw/zinc/45/58/10/940455810.db2.gz REKXNARWTCKCKI-UHFFFAOYSA-N 0 0 354.815 3.974 20 5 FHBDRN COCC(C)(C)N(Cc1ccccc1)C(=O)c1cc(F)cc([N+](=O)[O-])c1 ZINC000472509690 940456788 /nfs/dbraw/zinc/45/67/88/940456788.db2.gz YOEQSNSELGSGQO-UHFFFAOYSA-N 0 0 360.385 3.801 20 5 FHBDRN CC(=O)c1cc(NC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)ccc1F ZINC000580108052 940458814 /nfs/dbraw/zinc/45/88/14/940458814.db2.gz CHIJQHKAVJVORH-UHFFFAOYSA-N 0 0 350.733 3.771 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])o1)N1CCc2cc(Cl)cc(Br)c21 ZINC000548996936 940462235 /nfs/dbraw/zinc/46/22/35/940462235.db2.gz ISNVHZDRQNGQDV-UHFFFAOYSA-N 0 0 371.574 3.807 20 5 FHBDRN COc1ccc(COCc2cccc(Nc3c([N+](=O)[O-])ncn3C)c2)cc1 ZINC000066373459 940468268 /nfs/dbraw/zinc/46/82/68/940468268.db2.gz QLPVTFKHECUAQV-UHFFFAOYSA-N 0 0 368.393 3.797 20 5 FHBDRN CC(C)[C@@H](CC(=O)OCc1ccc(C(N)=O)cc1[N+](=O)[O-])c1ccccc1 ZINC000728640636 940470233 /nfs/dbraw/zinc/47/02/33/940470233.db2.gz XDDGHKHJZXVHCY-QGZVFWFLSA-N 0 0 370.405 3.567 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)c2ccc(Br)nc2)cc1[N+](=O)[O-] ZINC000177865993 940471654 /nfs/dbraw/zinc/47/16/54/940471654.db2.gz TZUUOAZGXURDEG-SNVBAGLBSA-N 0 0 364.199 3.552 20 5 FHBDRN COc1cc(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)ccc1[N+](=O)[O-] ZINC000580352803 940473770 /nfs/dbraw/zinc/47/37/70/940473770.db2.gz LFUZDRLUHYCJCS-HNNXBMFYSA-N 0 0 367.405 3.623 20 5 FHBDRN COc1ccc(/C=C2\N=C(c3ccc(Cl)c([N+](=O)[O-])c3)OC2=O)s1 ZINC000177887851 940474680 /nfs/dbraw/zinc/47/46/80/940474680.db2.gz CAHDSGPXGGQIQB-XFFZJAGNSA-N 0 0 364.766 3.663 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccnc1N1CCCC1 ZINC000613175527 940476213 /nfs/dbraw/zinc/47/62/13/940476213.db2.gz HMBUIJGPPMZBCP-INIZCTEOSA-N 0 0 368.437 3.797 20 5 FHBDRN C[C@H]1[C@H](c2nc(-c3ccc(N)c([N+](=O)[O-])c3)no2)CCN1c1ccccc1 ZINC000580481065 940476524 /nfs/dbraw/zinc/47/65/24/940476524.db2.gz NLXCTTIGYCRPJW-SWLSCSKDSA-N 0 0 365.393 3.609 20 5 FHBDRN Cc1c(NC(=O)CCc2cncs2)cc(Br)cc1[N+](=O)[O-] ZINC000511442945 940477013 /nfs/dbraw/zinc/47/70/13/940477013.db2.gz GRUKSORMIXXPTE-UHFFFAOYSA-N 0 0 370.228 3.694 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1cc(-c2ccccc2C)nn1C ZINC000427397871 945324143 /nfs/dbraw/zinc/32/41/43/945324143.db2.gz IYFHTGITVLBWAY-UHFFFAOYSA-N 0 0 366.377 3.565 20 5 FHBDRN CO[C@@H]1CCCC[C@H]1C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000511448318 940481922 /nfs/dbraw/zinc/48/19/22/940481922.db2.gz WOBPTYGQKUZOEN-BXUZGUMPSA-N 0 0 371.231 3.809 20 5 FHBDRN CO[C@H]1CCCC[C@@H]1C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000511448319 940481982 /nfs/dbraw/zinc/48/19/82/940481982.db2.gz WOBPTYGQKUZOEN-FZMZJTMJSA-N 0 0 371.231 3.809 20 5 FHBDRN COc1cccc2c1OCC[C@@H]2Nc1ncnc2sc([N+](=O)[O-])cc21 ZINC000376221478 940484863 /nfs/dbraw/zinc/48/48/63/940484863.db2.gz MZNGOUZAUIHKCJ-NSHDSACASA-N 0 0 358.379 3.544 20 5 FHBDRN C[C@@H](C(=O)N1CC(C)(C)O[C@@](C)(C(F)(F)F)C1)c1cccc([N+](=O)[O-])c1 ZINC000580793007 940487438 /nfs/dbraw/zinc/48/74/38/940487438.db2.gz RAMDORZAVNZLPT-BDJLRTHQSA-N 0 0 374.359 3.657 20 5 FHBDRN Cn1ccc2c1cccc2NC(=O)N1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000581041087 940493940 /nfs/dbraw/zinc/49/39/40/940493940.db2.gz BBYLIRLZGVPUCV-UHFFFAOYSA-N 0 0 366.377 3.513 20 5 FHBDRN C[C@H](C(=O)N1CCN([C@@H](C)c2ccsc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000581166118 940494709 /nfs/dbraw/zinc/49/47/09/940494709.db2.gz PBPRVMJANIFVQN-GJZGRUSLSA-N 0 0 373.478 3.665 20 5 FHBDRN Cc1sc(Br)c(C(=O)NCc2cccc([N+](=O)[O-])c2)c1C ZINC000581110504 940495605 /nfs/dbraw/zinc/49/56/05/940495605.db2.gz WDHXHQABAPYGMM-UHFFFAOYSA-N 0 0 369.240 3.966 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2nc(CC3CCCCC3)no2)c1N1CCOCC1 ZINC000581335742 940499625 /nfs/dbraw/zinc/49/96/25/940499625.db2.gz BSAQNODBNQPCJM-UHFFFAOYSA-N 0 0 372.425 3.604 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000427398952 945326345 /nfs/dbraw/zinc/32/63/45/945326345.db2.gz KYFURSMLSYUPTF-KBXCAEBGSA-N 0 0 370.405 3.501 20 5 FHBDRN CC(C)n1ncc2cc(NC(=O)[C@@H]3C[C@H]3c3ccc([N+](=O)[O-])cc3)cnc21 ZINC000581415543 940501799 /nfs/dbraw/zinc/50/17/99/940501799.db2.gz SLMZFJLBUSEAAR-DLBZAZTESA-N 0 0 365.393 3.663 20 5 FHBDRN Cc1nc(Cc2nnc(Sc3c(F)cccc3[N+](=O)[O-])o2)cs1 ZINC000581446318 940504043 /nfs/dbraw/zinc/50/40/43/940504043.db2.gz OXYYLUOWCLGWIS-UHFFFAOYSA-N 0 0 352.372 3.624 20 5 FHBDRN CC1(C)COc2ccc(C(=O)N3CCCc4ccc([N+](=O)[O-])cc43)cc21 ZINC000581462758 940504480 /nfs/dbraw/zinc/50/44/80/940504480.db2.gz IUCLDWFMLNALQT-UHFFFAOYSA-N 0 0 352.390 3.858 20 5 FHBDRN C[C@H](NC(=O)NCc1ccc([N+](=O)[O-])cc1Cl)c1ccc2n[nH]cc2c1 ZINC000581540213 940506037 /nfs/dbraw/zinc/50/60/37/940506037.db2.gz QGWKVCPJJLPPLL-JTQLQIEISA-N 0 0 373.800 3.685 20 5 FHBDRN CS(=O)(=O)c1ccc(N2CCCC3(CCCCC3)C2)c([N+](=O)[O-])c1 ZINC000408122971 945328354 /nfs/dbraw/zinc/32/83/54/945328354.db2.gz CCMRLNFFKQXUTG-UHFFFAOYSA-N 0 0 352.456 3.549 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1C[C@@H](c2ccccc2C)OC[C@H]1C ZINC000427386120 945332565 /nfs/dbraw/zinc/33/25/65/945332565.db2.gz CVASWLQQPYVDGB-KUHUBIRLSA-N 0 0 370.405 3.514 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])s1)N1CC[C@@H](Oc2ccc(Cl)cc2)C1 ZINC000581686192 940588685 /nfs/dbraw/zinc/58/86/85/940588685.db2.gz DUJZNNJDPPGQBH-GFCCVEGCSA-N 0 0 352.799 3.603 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)N2CC[C@H](Cc3ccc(C(C)C)cc3)C2)n1 ZINC000427388875 945334583 /nfs/dbraw/zinc/33/45/83/945334583.db2.gz CHWMDXJMPSRLCS-MRXNPFEDSA-N 0 0 370.453 3.639 20 5 FHBDRN Cc1cc(C(=O)N2C[C@H](c3ccccc3)OCC2(C)C)ccc1[N+](=O)[O-] ZINC000066512872 940593106 /nfs/dbraw/zinc/59/31/06/940593106.db2.gz LIOPQDVGBYVVKA-GOSISDBHSA-N 0 0 354.406 3.896 20 5 FHBDRN CC[C@H](NC(=O)CCOc1ccccc1[N+](=O)[O-])c1nc2ccccc2[nH]1 ZINC000066523069 940608051 /nfs/dbraw/zinc/60/80/51/940608051.db2.gz IOSRTVNJQZVNJL-ZDUSSCGKSA-N 0 0 368.393 3.508 20 5 FHBDRN CCOc1ccccc1CS(=O)(=O)[C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000180129785 940608515 /nfs/dbraw/zinc/60/85/15/940608515.db2.gz IWYZNTJHUIWRAO-CQSZACIVSA-N 0 0 363.435 3.978 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)OCc2cc(F)ccc2F)cc1SC ZINC000728649494 940609089 /nfs/dbraw/zinc/60/90/89/940609089.db2.gz LELXUEVRLSYVCV-UHFFFAOYSA-N 0 0 369.345 3.961 20 5 FHBDRN CCOc1ccc(CNC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000438004059 945334855 /nfs/dbraw/zinc/33/48/55/945334855.db2.gz POTBYMGKADSJLH-UHFFFAOYSA-N 0 0 369.421 3.868 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccc(F)cc1OCC(F)F ZINC000427391320 945335347 /nfs/dbraw/zinc/33/53/47/945335347.db2.gz QARFKRHSAJPYHO-UHFFFAOYSA-N 0 0 370.283 3.639 20 5 FHBDRN Cc1c(CC(=O)N[C@@H]2C[C@@H]2c2c(F)cccc2Cl)cccc1[N+](=O)[O-] ZINC000124902254 945335878 /nfs/dbraw/zinc/33/58/78/945335878.db2.gz QBKZHBZHBKZYOE-SWLSCSKDSA-N 0 0 362.788 3.911 20 5 FHBDRN COc1ccccc1C1(NC(=O)/C(C)=C/c2ccc([N+](=O)[O-])cc2)CC1 ZINC000843670328 945336554 /nfs/dbraw/zinc/33/65/54/945336554.db2.gz OVDGOGLXGBKYTP-BUHFOSPRSA-N 0 0 352.390 3.812 20 5 FHBDRN COc1cc(-c2noc(C(C)(C)c3ccc([N+](=O)[O-])cc3F)n2)ccn1 ZINC000581968338 940635894 /nfs/dbraw/zinc/63/58/94/940635894.db2.gz DBZXXPIJQJVCLV-UHFFFAOYSA-N 0 0 358.329 3.513 20 5 FHBDRN O=[N+]([O-])c1ccccc1Cc1noc(/C=C/c2ccccc2-n2cccn2)n1 ZINC000581936185 940639678 /nfs/dbraw/zinc/63/96/78/940639678.db2.gz CYUWMVVYSKOLSG-ZHACJKMWSA-N 0 0 373.372 3.925 20 5 FHBDRN CSc1ccc(NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)nc1 ZINC000582084942 940639771 /nfs/dbraw/zinc/63/97/71/940639771.db2.gz MXDNKXCXGYQUOR-UHFFFAOYSA-N 0 0 372.450 3.567 20 5 FHBDRN CCCc1[nH]nc(C(=O)Nc2cccc(Oc3ccccn3)c2)c1[N+](=O)[O-] ZINC000173580267 940640569 /nfs/dbraw/zinc/64/05/69/940640569.db2.gz UUBHVHIKYYFMNF-UHFFFAOYSA-N 0 0 367.365 3.710 20 5 FHBDRN Cc1nn(CCC(=O)Nc2cccc(SC(F)F)c2)c(C)c1[N+](=O)[O-] ZINC000066554290 940646641 /nfs/dbraw/zinc/64/66/41/940646641.db2.gz NWXRTEIXZLPCKW-UHFFFAOYSA-N 0 0 370.381 3.752 20 5 FHBDRN Nc1ccc(-c2noc(C3(Cc4ccc(F)cc4)CC3)n2)cc1[N+](=O)[O-] ZINC000582087765 940652444 /nfs/dbraw/zinc/65/24/44/940652444.db2.gz ZPKLULLPBQCUCF-UHFFFAOYSA-N 0 0 354.341 3.640 20 5 FHBDRN CCCCN(Cc1ccccc1Cl)C(=O)Nc1ccncc1[N+](=O)[O-] ZINC000543764932 945338179 /nfs/dbraw/zinc/33/81/79/945338179.db2.gz QHTIYSWTTYWZPY-UHFFFAOYSA-N 0 0 362.817 3.899 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC(C)(C)[C@@H]2COC[C@@H]21 ZINC000582303899 940664332 /nfs/dbraw/zinc/66/43/32/940664332.db2.gz SAQZTTVKIWWHJS-CABCVRRESA-N 0 0 364.467 3.594 20 5 FHBDRN C[C@@H]1CN(C(=O)c2ccc(Cl)cc2[N+](=O)[O-])[C@@H](c2ccccc2)CO1 ZINC000173726722 940664671 /nfs/dbraw/zinc/66/46/71/940664671.db2.gz VFGJQGAOFXJEGT-SJKOYZFVSA-N 0 0 360.797 3.850 20 5 FHBDRN CCN(c1cccc(C)c1C)S(=O)(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000582438146 940671299 /nfs/dbraw/zinc/67/12/99/940671299.db2.gz YLTHYPPUCXIRPN-UHFFFAOYSA-N 0 0 352.387 3.566 20 5 FHBDRN C[C@@H]1CCc2ccccc2[C@H]1NC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000582443742 940671729 /nfs/dbraw/zinc/67/17/29/940671729.db2.gz BZPSWMNBPBAMLT-WYRIXSBYSA-N 0 0 360.360 3.855 20 5 FHBDRN CCOc1ncccc1-c1nc(Cc2c[nH]c3ccc([N+](=O)[O-])cc23)no1 ZINC000582512478 940688391 /nfs/dbraw/zinc/68/83/91/940688391.db2.gz ILRHMFKYYVURFT-UHFFFAOYSA-N 0 0 365.349 3.511 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2noc(-c3ncccc3Br)n2)s1 ZINC000582513126 940688482 /nfs/dbraw/zinc/68/84/82/940688482.db2.gz PAPGYIJHQAVPAG-UHFFFAOYSA-N 0 0 353.157 3.531 20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])N1CCCc2c(F)ccc(F)c21 ZINC000472541289 940714068 /nfs/dbraw/zinc/71/40/68/940714068.db2.gz MIBGZZNTXKIYDV-UHFFFAOYSA-N 0 0 361.348 3.654 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)NCCc2cccc3[nH]ccc32)cc1[N+](=O)[O-] ZINC000507587139 945342932 /nfs/dbraw/zinc/34/29/32/945342932.db2.gz HXYJUQZXZWFSGB-CQSZACIVSA-N 0 0 366.421 3.987 20 5 FHBDRN Cn1ccnc1[C@H]([NH2+]C1CCC(C(F)F)CC1)c1cccc([N+](=O)[O-])c1 ZINC000414183969 940725183 /nfs/dbraw/zinc/72/51/83/940725183.db2.gz NOOQGCTVFJDPFC-LDZOIKDWSA-N 0 0 364.396 3.831 20 5 FHBDRN COc1ccc(CSCC(=O)N(C)c2ccsc2)cc1[N+](=O)[O-] ZINC000892548709 940727994 /nfs/dbraw/zinc/72/79/94/940727994.db2.gz RMZRVXNYDVHVME-UHFFFAOYSA-N 0 0 352.437 3.561 20 5 FHBDRN CC(=O)c1csc(C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)c1 ZINC000106618284 945343548 /nfs/dbraw/zinc/34/35/48/945343548.db2.gz KMSUVCNSPBTWCX-UHFFFAOYSA-N 0 0 356.306 3.713 20 5 FHBDRN Cc1sc(S(=O)(=O)N2CCC(C3CCCC3)CC2)cc1[N+](=O)[O-] ZINC000613476314 940745353 /nfs/dbraw/zinc/74/53/53/940745353.db2.gz FHQGUOLNSXSONO-UHFFFAOYSA-N 0 0 358.485 3.556 20 5 FHBDRN COc1ccc(NC(=O)c2ccc(N3CCCC3)c(F)c2)c([N+](=O)[O-])c1 ZINC000106600565 945346370 /nfs/dbraw/zinc/34/63/70/945346370.db2.gz VKCHPYLYPYIBAA-UHFFFAOYSA-N 0 0 359.357 3.595 20 5 FHBDRN Cc1oc(-c2cccs2)nc1CN1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000365512621 940771932 /nfs/dbraw/zinc/77/19/32/940771932.db2.gz MGFWAJHGUHMBGU-UHFFFAOYSA-N 0 0 373.438 3.653 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H]1CCc2cnn(C(C)C)c2C1 ZINC000582636339 940779643 /nfs/dbraw/zinc/77/96/43/940779643.db2.gz JGDSPYNUCUPWII-HNNXBMFYSA-N 0 0 371.441 3.614 20 5 FHBDRN Cc1nsc(C)c1-c1noc(-c2ccc(N3CCCC3)c([N+](=O)[O-])c2)n1 ZINC000426617859 945349642 /nfs/dbraw/zinc/34/96/42/945349642.db2.gz KADHMXJVGLFKQV-UHFFFAOYSA-N 0 0 371.422 3.985 20 5 FHBDRN CN1Cc2c(cccc2N[C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)C1=O ZINC000414230157 940802570 /nfs/dbraw/zinc/80/25/70/940802570.db2.gz SXNQJNLQBHKGKZ-GOSISDBHSA-N 0 0 351.406 3.614 20 5 FHBDRN O=C(NCc1nccc2ccccc21)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000180205344 940813424 /nfs/dbraw/zinc/81/34/24/940813424.db2.gz PRYJGIOUVUJXSS-UHFFFAOYSA-N 0 0 373.315 3.674 20 5 FHBDRN CC1(C)C[C@@H](NCc2nccc(C(F)(F)F)n2)c2cc([N+](=O)[O-])ccc21 ZINC000414237802 940818145 /nfs/dbraw/zinc/81/81/45/940818145.db2.gz JSRBFEIZTHCACJ-CYBMUJFWSA-N 0 0 366.343 3.916 20 5 FHBDRN C[C@H](NC(=O)c1ccc(Br)cc1[N+](=O)[O-])c1cccc(O)c1 ZINC000175214311 940827275 /nfs/dbraw/zinc/82/72/75/940827275.db2.gz VDGKRRFNHPUPRX-VIFPVBQESA-N 0 0 365.183 3.554 20 5 FHBDRN O=C(N[C@@H]1CCO[C@@H]1c1ccc(Cl)c(F)c1)c1ccc([N+](=O)[O-])s1 ZINC000180223604 940847950 /nfs/dbraw/zinc/84/79/50/940847950.db2.gz REULIZCTPBOSDK-BXUZGUMPSA-N 0 0 370.789 3.709 20 5 FHBDRN O=C(c1ccn(-c2ccccc2[N+](=O)[O-])n1)N1CCSC12CCCCC2 ZINC000582747199 940851456 /nfs/dbraw/zinc/85/14/56/940851456.db2.gz HXYXFWXOSIAQSL-UHFFFAOYSA-N 0 0 372.450 3.630 20 5 FHBDRN O=C(Nc1cc([N+](=O)[O-])ccc1F)c1c(F)cccc1Br ZINC000175371909 940856567 /nfs/dbraw/zinc/85/65/67/940856567.db2.gz JTHUQAGYTAZWER-UHFFFAOYSA-N 0 0 357.110 3.888 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCC[C@@H]2OCC[C@@H]21 ZINC000180247753 940875668 /nfs/dbraw/zinc/87/56/68/940875668.db2.gz WCLZZZCBFDFZGW-BMFZPTHFSA-N 0 0 364.467 3.783 20 5 FHBDRN Cc1nn(C)c(-c2nc(-c3ccc(C(F)(F)F)c(F)c3)no2)c1[N+](=O)[O-] ZINC000545615252 945359681 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FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NCCc2c[nH]c3c2cccc3C)c1 ZINC000549059468 940936794 /nfs/dbraw/zinc/93/67/94/940936794.db2.gz ASEUFMPDFUUSRB-UHFFFAOYSA-N 0 0 367.405 3.756 20 5 FHBDRN C[S@](=O)Cc1ccccc1NCc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000186084337 940948267 /nfs/dbraw/zinc/94/82/67/940948267.db2.gz LINLYPYUINHFJC-SANMLTNESA-N 0 0 371.418 3.740 20 5 FHBDRN CC(C)(CNC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)C(F)(F)F ZINC000549061810 940949661 /nfs/dbraw/zinc/94/96/61/940949661.db2.gz BHFUKSYZZXIMLI-UHFFFAOYSA-N 0 0 358.238 3.932 20 5 FHBDRN Cc1cccnc1COC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000180314482 940959754 /nfs/dbraw/zinc/95/97/54/940959754.db2.gz NYRPCFHXTVEZFX-UHFFFAOYSA-N 0 0 355.375 3.779 20 5 FHBDRN O=C1NCCc2c(N[C@@H]3CCC[C@H]3Cc3ccccc3[N+](=O)[O-])cccc21 ZINC000414322031 940968014 /nfs/dbraw/zinc/96/80/14/940968014.db2.gz RUSKZNYSZOYCNU-KBXCAEBGSA-N 0 0 365.433 3.704 20 5 FHBDRN Cc1cc(OCC(=O)N2CCC[C@H]2c2cccc(F)c2)ccc1[N+](=O)[O-] ZINC000431827882 940968312 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FHBDRN O=C(CSCc1ccccn1)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000180466758 941023997 /nfs/dbraw/zinc/02/39/97/941023997.db2.gz KOIDMDVVOZOQBD-UHFFFAOYSA-N 0 0 371.340 3.881 20 5 FHBDRN COc1ccc(C[C@@H](C)C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)cc1OC ZINC000180503843 941034731 /nfs/dbraw/zinc/03/47/31/941034731.db2.gz RMSZPYLCKAMIBP-ZIAGYGMSSA-N 0 0 372.421 3.668 20 5 FHBDRN C[C@H](c1nnc(-c2ccc(Cl)cc2Cl)o1)n1cc([N+](=O)[O-])cn1 ZINC000180505894 941035087 /nfs/dbraw/zinc/03/50/87/941035087.db2.gz SJABOTDZSCWEJN-SSDOTTSWSA-N 0 0 354.153 3.757 20 5 FHBDRN O=C(Nc1ccncc1[N+](=O)[O-])N1CCCCC[C@@H]1/C=C\c1ccccc1 ZINC000540980964 941050261 /nfs/dbraw/zinc/05/02/61/941050261.db2.gz WFOAQUUDBSSQRY-QXPKXGMISA-N 0 0 366.421 3.902 20 5 FHBDRN COc1cccc([C@H]2C[C@H]2C(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000176505773 941053597 /nfs/dbraw/zinc/05/35/97/941053597.db2.gz WSZVPWDGFKSOFH-QZTJIDSGSA-N 0 0 354.406 3.758 20 5 FHBDRN COc1cc(CCC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)cc(OC)c1 ZINC000176496601 941055335 /nfs/dbraw/zinc/05/53/35/941055335.db2.gz ARJVQMSGYYKXRV-UHFFFAOYSA-N 0 0 372.421 3.596 20 5 FHBDRN CN(Cc1c2ccccc2cc2ccccc21)C(=O)[C@H]1CCCS1(=O)=O ZINC001143474795 941057222 /nfs/dbraw/zinc/05/72/22/941057222.db2.gz PNIJWQNHSAPSEO-HXUWFJFHSA-N 0 0 367.470 3.529 20 5 FHBDRN O=C(N[C@H]1CC12CCCCC2)c1ccc([N+](=O)[O-])cc1Br ZINC000180653038 941058828 /nfs/dbraw/zinc/05/88/28/941058828.db2.gz PJNLJMUJSLZDKV-ZDUSSCGKSA-N 0 0 353.216 3.810 20 5 FHBDRN Nc1cccc([N+](=O)[O-])c1C(=O)Nc1ncc(Cc2ccccc2F)s1 ZINC000180675442 941063119 /nfs/dbraw/zinc/06/31/19/941063119.db2.gz WABNTLLKLZIBSF-UHFFFAOYSA-N 0 0 372.381 3.616 20 5 FHBDRN Cc1cncn1C1CCN(c2ccc([N+](=O)[O-])cc2Br)CC1 ZINC000376475180 941067193 /nfs/dbraw/zinc/06/71/93/941067193.db2.gz QLRNJHLVKYHIII-UHFFFAOYSA-N 0 0 365.231 3.704 20 5 FHBDRN Cn1cc([C@H](Nc2ncnc3sc([N+](=O)[O-])cc32)c2ccccc2)cn1 ZINC000376479773 941068631 /nfs/dbraw/zinc/06/86/31/941068631.db2.gz YWYGOAKYODEMJK-OAHLLOKOSA-N 0 0 366.406 3.535 20 5 FHBDRN 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/nfs/dbraw/zinc/08/98/60/941089860.db2.gz HXQBJTYTARUXPN-UHFFFAOYSA-N 0 0 356.397 3.929 20 5 FHBDRN CCN(CC)C(=O)c1ccccc1NC(=O)c1cc(C)cc([N+](=O)[O-])c1 ZINC000122150147 941090063 /nfs/dbraw/zinc/09/00/63/941090063.db2.gz QMVICBRSCMDTND-UHFFFAOYSA-N 0 0 355.394 3.638 20 5 FHBDRN O=[N+]([O-])c1ccc2oc(CN3CCN(c4ccccc4Cl)CC3)nc2c1 ZINC000176981477 941093218 /nfs/dbraw/zinc/09/32/18/941093218.db2.gz SDMFGVXDGPOUNO-UHFFFAOYSA-N 0 0 372.812 3.712 20 5 FHBDRN Nc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc2oc(C(F)(F)F)nc2c1 ZINC000180981212 941098575 /nfs/dbraw/zinc/09/85/75/941098575.db2.gz UXFXRNJFHYEXPP-UHFFFAOYSA-N 0 0 366.255 3.589 20 5 FHBDRN Cc1nc(NC(=O)c2cccc(Br)c2Cl)ccc1[N+](=O)[O-] ZINC000180983887 941099497 /nfs/dbraw/zinc/09/94/97/941099497.db2.gz IAYMTOPMDVURME-UHFFFAOYSA-N 0 0 370.590 3.966 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H](c1ccccc1)[C@H]1CCCO1 ZINC000188834187 941106648 /nfs/dbraw/zinc/10/66/48/941106648.db2.gz LYFWTIQLDMUFTL-MSOLQXFVSA-N 0 0 355.394 3.945 20 5 FHBDRN CC[C@H](CSC)NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000181181723 941112081 /nfs/dbraw/zinc/11/20/81/941112081.db2.gz CJPLRATZWGPWKK-LLVKDONJSA-N 0 0 351.453 3.590 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1[C@H](C)S(=O)(=O)Cc1nnc(C(C)C)s1 ZINC000414424533 941125447 /nfs/dbraw/zinc/12/54/47/941125447.db2.gz GHRBRWQRVHMWJH-NSHDSACASA-N 0 0 369.468 3.554 20 5 FHBDRN C[C@@H](CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCC(C)CC1)CC(F)F ZINC000843634211 941126064 /nfs/dbraw/zinc/12/60/64/941126064.db2.gz RRJUBCORSPVTEH-CYBMUJFWSA-N 0 0 369.412 3.852 20 5 FHBDRN CC(C)n1cnnc1-c1ccccc1NC(=O)c1ccc([N+](=O)[O-])s1 ZINC000177497597 941131502 /nfs/dbraw/zinc/13/15/02/941131502.db2.gz INPGJEWRCXVXJS-UHFFFAOYSA-N 0 0 357.395 3.748 20 5 FHBDRN O=C(Cc1ccoc1)Nc1ccc(OCc2ccccc2)cc1[N+](=O)[O-] ZINC000188958129 941134118 /nfs/dbraw/zinc/13/41/18/941134118.db2.gz SQWCSMHBHKZWBD-UHFFFAOYSA-N 0 0 352.346 3.948 20 5 FHBDRN O=C(CC[C@H]1CCOC1)Nc1ccc(OCc2ccccc2)cc1[N+](=O)[O-] ZINC000188969932 941135469 /nfs/dbraw/zinc/13/54/69/941135469.db2.gz ITUNDFWDRJFNJX-INIZCTEOSA-N 0 0 370.405 3.929 20 5 FHBDRN O=c1ccc(-c2cccc([N+](=O)[O-])c2)nn1Cc1cc(Cl)ccc1F ZINC000188985958 941140641 /nfs/dbraw/zinc/14/06/41/941140641.db2.gz USDSHTDUOARTRI-UHFFFAOYSA-N 0 0 359.744 3.659 20 5 FHBDRN O=c1c(Br)cn(C/C=C/c2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000189080247 941146611 /nfs/dbraw/zinc/14/66/11/941146611.db2.gz LAICUKWJLQKCEC-OWOJBTEDSA-N 0 0 369.602 3.886 20 5 FHBDRN COc1ccc(CC(C)(C)NC(=O)Cc2cccc([N+](=O)[O-])c2C)cc1 ZINC000189147153 941147638 /nfs/dbraw/zinc/14/76/38/941147638.db2.gz OUHHAPURMIVLAR-UHFFFAOYSA-N 0 0 356.422 3.592 20 5 FHBDRN C[C@H](C(=O)N1CC2(CCCC2)OC(C)(C)C1)c1ccc([N+](=O)[O-])cc1F ZINC000189192983 941151146 /nfs/dbraw/zinc/15/11/46/941151146.db2.gz YWJMZSSJOUMCIV-ZDUSSCGKSA-N 0 0 364.417 3.788 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)Nc1ccc2c(c1)C(=O)CCC2 ZINC000177962798 941154673 /nfs/dbraw/zinc/15/46/73/941154673.db2.gz BKZNPZPXTCYVRD-UHFFFAOYSA-N 0 0 367.405 3.945 20 5 FHBDRN CC(C)c1nnc2ccc(NC(=O)Cc3ccc([N+](=O)[O-])cc3Cl)cn21 ZINC000189271884 941155041 /nfs/dbraw/zinc/15/50/41/941155041.db2.gz LZBAOCSGLHFQTK-UHFFFAOYSA-N 0 0 373.800 3.596 20 5 FHBDRN CC[C@H](C)Oc1ccc(NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 ZINC000189293024 941155627 /nfs/dbraw/zinc/15/56/27/941155627.db2.gz MUDGXHCYYHBTSY-ZDUSSCGKSA-N 0 0 371.393 3.658 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)Nc1ccc2c(c1)C(=O)CCC2 ZINC000177970575 941156157 /nfs/dbraw/zinc/15/61/57/941156157.db2.gz SQSGWPFLALHNFW-UHFFFAOYSA-N 0 0 358.781 3.948 20 5 FHBDRN COC(=O)c1cnc(NC[C@@H](c2ccccc2)C(F)(F)F)c([N+](=O)[O-])c1 ZINC000189393769 941156982 /nfs/dbraw/zinc/15/69/82/941156982.db2.gz YATWIWCXRUTNHS-LBPRGKRZSA-N 0 0 369.299 3.534 20 5 FHBDRN COc1ccc2[nH]c(C(=O)NC(C)(C)c3ccc([N+](=O)[O-])cc3)cc2c1 ZINC000189411810 941157293 /nfs/dbraw/zinc/15/72/93/941157293.db2.gz BATFJSRVVLPACT-UHFFFAOYSA-N 0 0 353.378 3.750 20 5 FHBDRN C[C@H](CCNC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)CC(C)(C)C ZINC000189480233 941158833 /nfs/dbraw/zinc/15/88/33/941158833.db2.gz YWUXYRNMPRBDAZ-GFCCVEGCSA-N 0 0 359.426 3.629 20 5 FHBDRN CC(C)c1ccc(C(=O)Nc2cnn(Cc3ccncc3)c2)cc1[N+](=O)[O-] ZINC000189548146 941161104 /nfs/dbraw/zinc/16/11/04/941161104.db2.gz FLWTVEMGDAFRRP-UHFFFAOYSA-N 0 0 365.393 3.610 20 5 FHBDRN CC[C@@H](CNC(=O)N(C)CCc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000549101728 941214758 /nfs/dbraw/zinc/21/47/58/941214758.db2.gz UJLIOHPFGGMHRV-KRWDZBQOSA-N 0 0 355.438 3.973 20 5 FHBDRN COCc1cc([N+](=O)[O-])ccc1NC[C@](C)(Cc1ccccc1)[C@H](C)O ZINC000189648477 941240404 /nfs/dbraw/zinc/24/04/04/941240404.db2.gz YCJYPFKSNYQRJO-YWZLYKJASA-N 0 0 358.438 3.783 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](C)c2ccc(Cl)cn2)c1 ZINC000189747698 941271094 /nfs/dbraw/zinc/27/10/94/941271094.db2.gz ONBLBUIRFACDKQ-VIFPVBQESA-N 0 0 351.815 3.856 20 5 FHBDRN Cc1ccc(Cl)cc1NC(=O)c1cc([N+](=O)[O-])ccc1SCCO ZINC000136074119 941289208 /nfs/dbraw/zinc/28/92/08/941289208.db2.gz LIZGCBCXZJDCCM-UHFFFAOYSA-N 0 0 366.826 3.893 20 5 FHBDRN CCn1c(SCc2cncc(C)c2)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000189858506 941289924 /nfs/dbraw/zinc/28/99/24/941289924.db2.gz KALOIWIKYOREAM-UHFFFAOYSA-N 0 0 355.423 3.869 20 5 FHBDRN COC[C@H](Cc1ccccc1)N(C)C(=O)Nc1ccc([N+](=O)[O-])c(C)c1 ZINC000189858089 941289955 /nfs/dbraw/zinc/28/99/55/941289955.db2.gz YUQZBUAFEULJRI-KRWDZBQOSA-N 0 0 357.410 3.625 20 5 FHBDRN Cc1ccc(C)c(S(=O)(=O)N(C)[C@H](C)c2cccs2)c1[N+](=O)[O-] ZINC000189863305 941290587 /nfs/dbraw/zinc/29/05/87/941290587.db2.gz AKQSIZDJJLZBRY-GFCCVEGCSA-N 0 0 354.453 3.655 20 5 FHBDRN Cc1c(CC(=O)N(Cc2ccco2)c2ccccn2)cccc1[N+](=O)[O-] ZINC000178679912 941294565 /nfs/dbraw/zinc/29/45/65/941294565.db2.gz UGFZMFGSAVBCKH-UHFFFAOYSA-N 0 0 351.362 3.667 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)Nc1cnn(CC2CC2)c1 ZINC000181474458 941328868 /nfs/dbraw/zinc/32/88/68/941328868.db2.gz LIQYRMZZBNLGMD-UHFFFAOYSA-N 0 0 360.439 3.954 20 5 FHBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CCS[C@@H](C)[C@@H]1C ZINC000408004561 941338197 /nfs/dbraw/zinc/33/81/97/941338197.db2.gz YEWHIIMXGIMKHH-UWVGGRQHSA-N 0 0 373.272 3.632 20 5 FHBDRN C[C@@H]1CN(c2c3cc(Br)ccc3ncc2[N+](=O)[O-])CCCO1 ZINC000408007481 941349883 /nfs/dbraw/zinc/34/98/83/941349883.db2.gz IIXBYAHOAOIHIH-SNVBAGLBSA-N 0 0 366.215 3.521 20 5 FHBDRN C[C@H](NC(=O)[C@@H]1C[C@@]12CCOc1ccccc12)c1ccc([N+](=O)[O-])cc1 ZINC000452182802 941363646 /nfs/dbraw/zinc/36/36/46/941363646.db2.gz LRABMBRXTZJOKN-QKMWGZLOSA-N 0 0 352.390 3.512 20 5 FHBDRN C[C@@H]1CCC[C@@H](C)N1C(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000103366419 941367330 /nfs/dbraw/zinc/36/73/30/941367330.db2.gz FHGDJVYWPHCWFM-GHMZBOCLSA-N 0 0 360.332 3.939 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2ccc(CNCc3nnc(C4CC4)s3)o2)cc1 ZINC000414561344 941374388 /nfs/dbraw/zinc/37/43/88/941374388.db2.gz YUQKBEJBDSEHEK-UHFFFAOYSA-N 0 0 356.407 3.874 20 5 FHBDRN CC(C)(NC(=O)c1cc([N+](=O)[O-])ccc1Br)C(C)(F)F ZINC000407205540 941406742 /nfs/dbraw/zinc/40/67/42/941406742.db2.gz IZWIOLONJZOHOX-UHFFFAOYSA-N 0 0 351.147 3.521 20 5 FHBDRN O=C(c1cccc([N+](=O)[O-])c1F)N1CCO[C@@H](c2ccccc2Cl)C1 ZINC000376741815 941407333 /nfs/dbraw/zinc/40/73/33/941407333.db2.gz JPELZSXVJWDTAO-OAHLLOKOSA-N 0 0 364.760 3.601 20 5 FHBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])N1CCc2cc(F)ccc21 ZINC000549122437 941410039 /nfs/dbraw/zinc/41/00/39/941410039.db2.gz KFVBFKBPDNLVPU-UHFFFAOYSA-N 0 0 363.776 3.702 20 5 FHBDRN C[C@H](C[N@H+](C)Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1)C(=O)[O-] ZINC000414658025 941429136 /nfs/dbraw/zinc/42/91/36/941429136.db2.gz PPTWLGDXOQOWMB-CQSZACIVSA-N 0 0 357.410 3.515 20 5 FHBDRN CCn1c(C)nc([N+](=O)[O-])c1N(C)Cc1ccc(F)cc1Br ZINC000563267125 941431303 /nfs/dbraw/zinc/43/13/03/941431303.db2.gz FKEBCDAEGKVQRB-UHFFFAOYSA-N 0 0 371.210 3.658 20 5 FHBDRN Cc1nc(-c2ccccc2NC(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)no1 ZINC000376880375 941457110 /nfs/dbraw/zinc/45/71/10/941457110.db2.gz PPEPGEZYPAVHBF-UHFFFAOYSA-N 0 0 374.303 3.684 20 5 FHBDRN O=C(c1c[nH]c2cc([N+](=O)[O-])ccc12)N1CC[C@@](F)(c2ccccc2F)C1 ZINC000549141889 941517816 /nfs/dbraw/zinc/51/78/16/941517816.db2.gz MBLYDPOYISEJLH-IBGZPJMESA-N 0 0 371.343 3.926 20 5 FHBDRN CCn1c(SCc2cc(F)ccc2[N+](=O)[O-])nnc1-c1ccccn1 ZINC000178294071 941521354 /nfs/dbraw/zinc/52/13/54/941521354.db2.gz JIGJZEGSDAYUAR-UHFFFAOYSA-N 0 0 359.386 3.700 20 5 FHBDRN Cc1cc(NCCCNC(=O)C2CCC2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000549142982 941522043 /nfs/dbraw/zinc/52/20/43/941522043.db2.gz RLEVBGDTAAOCLN-UHFFFAOYSA-N 0 0 359.348 3.640 20 5 FHBDRN O=C(NCc1ccc(OC2CCCC2)cc1)NCc1ccccc1[N+](=O)[O-] ZINC000549144315 941522880 /nfs/dbraw/zinc/52/28/80/941522880.db2.gz VRJTWUFMBNILRZ-UHFFFAOYSA-N 0 0 369.421 3.916 20 5 FHBDRN C[C@@H](N[C@H](C)c1cccc(O)c1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000181534900 941530856 /nfs/dbraw/zinc/53/08/56/941530856.db2.gz SEVMWRIXGMCKFW-VXGBXAGGSA-N 0 0 354.366 3.762 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NCc1noc2c1CCCC2 ZINC000377170647 941535194 /nfs/dbraw/zinc/53/51/94/941535194.db2.gz APAFZWUKBDBQOV-UHFFFAOYSA-N 0 0 361.423 3.504 20 5 FHBDRN O=C(Cc1cccc2cnccc21)Nc1ccnn1-c1ccc([N+](=O)[O-])cc1 ZINC001125856957 941570625 /nfs/dbraw/zinc/57/06/25/941570625.db2.gz FDIZVDYCJQIWHN-UHFFFAOYSA-N 0 0 373.372 3.510 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(N[C@@H](C)c2cc(OC)c(OC)cc2C)c1 ZINC000541113165 941594303 /nfs/dbraw/zinc/59/43/03/941594303.db2.gz MPLPJFQMQWSQOC-LBPRGKRZSA-N 0 0 374.393 3.880 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc2ncsc2c1 ZINC000549178743 941597260 /nfs/dbraw/zinc/59/72/60/941597260.db2.gz OPMVPMYQWJYSJZ-UHFFFAOYSA-N 0 0 356.407 3.911 20 5 FHBDRN COc1ccc(NC(=O)N2CC[C@H](c3ccccc3C)C2)cc1[N+](=O)[O-] ZINC000541107341 941598050 /nfs/dbraw/zinc/59/80/50/941598050.db2.gz PBZYOSOBFFKVPV-AWEZNQCLSA-N 0 0 355.394 3.933 20 5 FHBDRN O=C(Nc1ccnn1-c1ccc([N+](=O)[O-])cc1)c1ccc2ccncc2c1 ZINC001125857702 941602716 /nfs/dbraw/zinc/60/27/16/941602716.db2.gz ODTLYBXPWPKVGW-UHFFFAOYSA-N 0 0 359.345 3.581 20 5 FHBDRN CC1CCC(OC2CCN(C(=O)Cc3ccccc3[N+](=O)[O-])CC2)CC1 ZINC000377284047 941618207 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CN(C)C(=O)Sc1cccc(NC(=O)Cc2ccccc2[N+](=O)[O-])c1 ZINC000729243493 941700269 /nfs/dbraw/zinc/70/02/69/941700269.db2.gz XHDUPYPQZCNZQJ-UHFFFAOYSA-N 0 0 359.407 3.550 20 5 FHBDRN COc1cccc(C2(NC(=O)c3c[nH]c4ccc([N+](=O)[O-])cc34)CC2)c1 ZINC000122370091 941703919 /nfs/dbraw/zinc/70/39/19/941703919.db2.gz QWINLLYCDIFXDW-UHFFFAOYSA-N 0 0 351.362 3.504 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CCSc3ccncc32)ccc1[N+](=O)[O-] ZINC000415263207 941710074 /nfs/dbraw/zinc/71/00/74/941710074.db2.gz HORQQEHLGLJMIM-UHFFFAOYSA-N 0 0 359.407 3.530 20 5 FHBDRN C[C@@H](OC(=O)C[C@@H](C)n1cccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000729291517 941711338 /nfs/dbraw/zinc/71/13/38/941711338.db2.gz SZIDXMLJBNUZDL-CHWSQXEVSA-N 0 0 370.365 3.702 20 5 FHBDRN CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)c1cnc(C2CC2)s1 ZINC000729307757 941713569 /nfs/dbraw/zinc/71/35/69/941713569.db2.gz YMGVRDZSCVCOQX-UHFFFAOYSA-N 0 0 351.815 3.854 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1F)N1CCCC[C@H]1c1nnc(C2CCC2)o1 ZINC000377445886 941725811 /nfs/dbraw/zinc/72/58/11/941725811.db2.gz CUTFTTHVICGUHG-HNNXBMFYSA-N 0 0 374.372 3.752 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)Nc2cc(OC)c(Cl)cc2OC)c1 ZINC000067299566 941738321 /nfs/dbraw/zinc/73/83/21/941738321.db2.gz UOODEJUZDHRRIZ-UHFFFAOYSA-N 0 0 366.757 3.526 20 5 FHBDRN O=C(N[C@H](c1ccc(F)cc1)C1CCC1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000729380159 941739248 /nfs/dbraw/zinc/73/92/48/941739248.db2.gz NSNDJCRFFMHLGQ-KRWDZBQOSA-N 0 0 373.340 3.913 20 5 FHBDRN COC[C@H](Cc1ccccc1)NC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000472774989 941746002 /nfs/dbraw/zinc/74/60/02/941746002.db2.gz RPDFBEOGOJJQAL-ZDUSSCGKSA-N 0 0 363.801 3.627 20 5 FHBDRN Nc1ccc(C(=O)N2CCCC[C@H]2Cc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000729419788 941749218 /nfs/dbraw/zinc/74/92/18/941749218.db2.gz NLIFUKALOGWHFU-INIZCTEOSA-N 0 0 357.385 3.554 20 5 FHBDRN O=C(CCCCc1nc(Cc2ccc([N+](=O)[O-])cn2)no1)c1ccccc1 ZINC000472783215 941773365 /nfs/dbraw/zinc/77/33/65/941773365.db2.gz DETBICJTFFLWOX-UHFFFAOYSA-N 0 0 366.377 3.559 20 5 FHBDRN CN(C(=O)c1ccnc(-c2ccc(Cl)cc2)n1)c1cccc([N+](=O)[O-])c1 ZINC000377522478 941783508 /nfs/dbraw/zinc/78/35/08/941783508.db2.gz FAUGIXVVWAPGIA-UHFFFAOYSA-N 0 0 368.780 3.982 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1Oc1ccccc1)N1CCC[C@@H](CO)CC1 ZINC000294547764 941791650 /nfs/dbraw/zinc/79/16/50/941791650.db2.gz MMIOKFFWHVJFEZ-OAHLLOKOSA-N 0 0 370.405 3.622 20 5 FHBDRN Cc1nc(CC2CC2)sc1C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000616166387 941793670 /nfs/dbraw/zinc/79/36/70/941793670.db2.gz CPJXHKCGNJGCPL-UHFFFAOYSA-N 0 0 357.435 3.511 20 5 FHBDRN CCC(=O)c1ccc(Sc2nc(C(=O)OC)cs2)c([N+](=O)[O-])c1 ZINC000549266827 941794021 /nfs/dbraw/zinc/79/40/21/941794021.db2.gz GZYCVUMVDRGPKI-UHFFFAOYSA-N 0 0 352.393 3.582 20 5 FHBDRN O=C(NCC1(c2cccc(F)c2)CC1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412118316 941794049 /nfs/dbraw/zinc/79/40/49/941794049.db2.gz DVMZRMNVWJTQSD-ZWKOTPCHSA-N 0 0 354.381 3.685 20 5 FHBDRN Cn1cc(C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)c(C2CCC2)n1 ZINC000415390566 941794671 /nfs/dbraw/zinc/79/46/71/941794671.db2.gz HHVZJEASCWKUKN-UHFFFAOYSA-N 0 0 368.315 3.867 20 5 FHBDRN CS[C@@H]1CCC[C@H](NC(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)C1 ZINC000412113542 941794815 /nfs/dbraw/zinc/79/48/15/941794815.db2.gz DALKJEPVXNCUJY-UONOGXRCSA-N 0 0 352.456 3.786 20 5 FHBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NC[C@@H]1C[C@H]1c1ccccc1 ZINC000509921852 941806066 /nfs/dbraw/zinc/80/60/66/941806066.db2.gz BCAZEJRXOZMNFC-INWMFGNUSA-N 0 0 374.824 3.935 20 5 FHBDRN Cc1ncsc1CCC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000415408469 941810300 /nfs/dbraw/zinc/81/03/00/941810300.db2.gz RMUIBTAJGIJXSZ-UHFFFAOYSA-N 0 0 359.329 3.950 20 5 FHBDRN CC(C)N(CC(=O)N1CCCCCC1)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000513253121 941818927 /nfs/dbraw/zinc/81/89/27/941818927.db2.gz UMOAGLSSONIYEB-UHFFFAOYSA-N 0 0 367.877 3.861 20 5 FHBDRN C[C@H](Sc1ccc(N)cc1Cl)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000513255021 941819935 /nfs/dbraw/zinc/81/99/35/941819935.db2.gz CKYHTEKWRVLCCD-VIFPVBQESA-N 0 0 351.815 3.950 20 5 FHBDRN COc1ccccc1[C@@]1(C)C[C@H]1NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412134789 941828831 /nfs/dbraw/zinc/82/88/31/941828831.db2.gz MEMRYYBYMINZGC-VXIWKAIFSA-N 0 0 366.417 3.553 20 5 FHBDRN O=C(NCc1cccc([N+](=O)[O-])c1)N1CC[C@@](F)(c2ccccc2F)C1 ZINC000549280645 941829881 /nfs/dbraw/zinc/82/98/81/941829881.db2.gz OAPLBCPUIRIRPN-SFHVURJKSA-N 0 0 361.348 3.514 20 5 FHBDRN Cc1nn(Cc2ccc(C(=O)Oc3cccc(F)c3)cc2)c(C)c1[N+](=O)[O-] ZINC000019677252 941836317 /nfs/dbraw/zinc/83/63/17/941836317.db2.gz AFUURSJSHJFNQP-UHFFFAOYSA-N 0 0 369.352 3.815 20 5 FHBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)N1CC[C@@H](c2ccco2)C1 ZINC000377612370 941840455 /nfs/dbraw/zinc/84/04/55/941840455.db2.gz VBRNPOVSEHAJMU-MRXNPFEDSA-N 0 0 372.424 3.764 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)c1ccc(OC(F)F)c(F)c1 ZINC000513303793 941844860 /nfs/dbraw/zinc/84/48/60/941844860.db2.gz NXNAWULAFOZUNF-UHFFFAOYSA-N 0 0 368.311 3.650 20 5 FHBDRN O=C(Nc1ccc2nccnc2c1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000129335230 941863286 /nfs/dbraw/zinc/86/32/86/941863286.db2.gz XKVYVNHKCSTGSA-UHFFFAOYSA-N 0 0 362.267 3.809 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)c2cccc(F)c2F)c1 ZINC000549294574 941867688 /nfs/dbraw/zinc/86/76/88/941867688.db2.gz RMNXJZZUEDQRDD-SNVBAGLBSA-N 0 0 350.321 3.763 20 5 FHBDRN CCCc1ccc(NC(=O)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)cc1 ZINC000119173198 941871718 /nfs/dbraw/zinc/87/17/18/941871718.db2.gz DINSOMYPAKRVCB-UHFFFAOYSA-N 0 0 361.785 3.778 20 5 FHBDRN CC(C)N1CC[C@H](Nc2cc([N+](=O)[O-])ccc2Nc2ccccc2)C1=O ZINC000433761357 941880046 /nfs/dbraw/zinc/88/00/46/941880046.db2.gz AGWCDMOCLBPEQO-KRWDZBQOSA-N 0 0 354.410 3.760 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N[C@H](C)c2nc(C(C)(C)C)cs2)c1[N+](=O)[O-] ZINC000433763724 941881036 /nfs/dbraw/zinc/88/10/36/941881036.db2.gz FIOHMPBNHDUFIX-SECBINFHSA-N 0 0 365.459 3.686 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N[C@@H]2CCC[C@H]2Cc2ccccc2)c1[N+](=O)[O-] ZINC000433763966 941881396 /nfs/dbraw/zinc/88/13/96/941881396.db2.gz FMSZYHQLNVVUGB-LSDHHAIUSA-N 0 0 356.426 3.583 20 5 FHBDRN C[C@@]1(CNC(=O)c2ccc(Cl)cc2[N+](=O)[O-])OCCc2sccc21 ZINC000290315717 941885837 /nfs/dbraw/zinc/88/58/37/941885837.db2.gz HRAPOZNXFDHLBO-INIZCTEOSA-N 0 0 366.826 3.528 20 5 FHBDRN O=C(C[C@H]1COCCN1Cc1c(Cl)cccc1[N+](=O)[O-])c1ccccc1 ZINC000119548365 941887137 /nfs/dbraw/zinc/88/71/37/941887137.db2.gz WOBBLAZZOJDSLH-HNNXBMFYSA-N 0 0 374.824 3.722 20 5 FHBDRN CC(C)c1[nH]nc(C(=O)Nc2cccc(N3CCC(C)CC3)c2)c1[N+](=O)[O-] ZINC000433773544 941892036 /nfs/dbraw/zinc/89/20/36/941892036.db2.gz JDZVENGEPLMBHN-UHFFFAOYSA-N 0 0 371.441 3.930 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)NCCc2cccc3ccccc32)c1[N+](=O)[O-] ZINC000433774232 941892153 /nfs/dbraw/zinc/89/21/53/941892153.db2.gz KRYQAJLCVNVUJF-UHFFFAOYSA-N 0 0 352.394 3.567 20 5 FHBDRN CC(C)c1[nH]nc(C(=O)Nc2cc(C3CCCCCC3)[nH]n2)c1[N+](=O)[O-] ZINC000433774801 941892341 /nfs/dbraw/zinc/89/23/41/941892341.db2.gz NTHPANKCCBMMDF-UHFFFAOYSA-N 0 0 360.418 3.855 20 5 FHBDRN CCN(CC(=O)OC)Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000513400917 941896923 /nfs/dbraw/zinc/89/69/23/941896923.db2.gz HRYSJMRKKQGCOV-UHFFFAOYSA-N 0 0 362.357 3.521 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CCc3c(F)cccc3C2)ccc1[N+](=O)[O-] ZINC000412208534 941908429 /nfs/dbraw/zinc/90/84/29/941908429.db2.gz AULZMZNXLLRJSM-UHFFFAOYSA-N 0 0 358.369 3.720 20 5 FHBDRN CC(C)Oc1cc(C(=O)N[C@@H](C)[C@H]2COc3ccccc32)ccc1[N+](=O)[O-] ZINC000412210459 941909097 /nfs/dbraw/zinc/90/90/97/941909097.db2.gz HCSSBIPITBPFRC-XJKSGUPXSA-N 0 0 370.405 3.677 20 5 FHBDRN COc1ccccc1O[C@@H]1CCCN(Cc2ccc([N+](=O)[O-])c(OC)c2)C1 ZINC000513410530 941909122 /nfs/dbraw/zinc/90/91/22/941909122.db2.gz CYVKQAOMBYDARP-MRXNPFEDSA-N 0 0 372.421 3.655 20 5 FHBDRN O=C([C@H]1C[C@@]1(F)c1ccccc1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000412212842 941921228 /nfs/dbraw/zinc/92/12/28/941921228.db2.gz SZRABDZVVCDZPT-UYAOXDASSA-N 0 0 354.381 3.971 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)NCC2(c3ccc(F)cc3)CCCC2)c1[N+](=O)[O-] ZINC000433824613 941921288 /nfs/dbraw/zinc/92/12/88/941921288.db2.gz BDQLKRUNODDKMW-UHFFFAOYSA-N 0 0 374.416 3.822 20 5 FHBDRN Cc1c(C(=O)N[C@@H]2CCO[C@@H]2c2ccc(Cl)cc2)cccc1[N+](=O)[O-] ZINC000182460915 941926991 /nfs/dbraw/zinc/92/69/91/941926991.db2.gz QQMABALSXXMTOF-NVXWUHKLSA-N 0 0 360.797 3.817 20 5 FHBDRN C[C@H](NC(=O)N(C)CCc1cccc([N+](=O)[O-])c1)c1ccc(F)cc1F ZINC000511529538 941927613 /nfs/dbraw/zinc/92/76/13/941927613.db2.gz CKDZOHXVVRTGCM-LBPRGKRZSA-N 0 0 363.364 3.818 20 5 FHBDRN C[C@@H]1c2c(F)cccc2CCN1C(=O)CCc1cc(F)ccc1[N+](=O)[O-] ZINC001126393302 941933756 /nfs/dbraw/zinc/93/37/56/941933756.db2.gz DHUZADCIXBECCN-GFCCVEGCSA-N 0 0 360.360 3.952 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@H]1CCO[C@@H]1c1ccc(Cl)cc1 ZINC000182485228 941934353 /nfs/dbraw/zinc/93/43/53/941934353.db2.gz RUEROVZOWQDWNQ-DLBZAZTESA-N 0 0 360.797 3.817 20 5 FHBDRN Cc1ccc(SC[C@H](C)NC(=O)NCc2ccccc2[N+](=O)[O-])cc1 ZINC000472847314 941935908 /nfs/dbraw/zinc/93/59/08/941935908.db2.gz IXSUGSOJSHXITD-AWEZNQCLSA-N 0 0 359.451 3.883 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N2Cc3ccccc3C(C)(C)C2)c1F ZINC000412221914 941938907 /nfs/dbraw/zinc/93/89/07/941938907.db2.gz RIFAVJHIIDCFEQ-UHFFFAOYSA-N 0 0 372.396 3.605 20 5 FHBDRN Cc1cn([C@H](C)c2ccccc2)[nH]c1=NC(=O)c1ccc(C)c([N+](=O)[O-])c1 ZINC000472846832 941939095 /nfs/dbraw/zinc/93/90/95/941939095.db2.gz JCJXROBRWIKFAV-OAHLLOKOSA-N 0 0 364.405 3.692 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CCC(Cc2cccnc2)CC1 ZINC000412235043 941949952 /nfs/dbraw/zinc/94/99/52/941949952.db2.gz WNLGFLOVPZTVAD-VQTJNVASSA-N 0 0 365.433 3.575 20 5 FHBDRN Cc1cn([C@H](C)c2ccccc2)[nH]c1=NC(=O)c1cccc([N+](=O)[O-])c1C ZINC000472855199 941953761 /nfs/dbraw/zinc/95/37/61/941953761.db2.gz UFLXLWNURUMIRT-OAHLLOKOSA-N 0 0 364.405 3.692 20 5 FHBDRN COc1ccc([C@H](NC(=O)CNc2cc([N+](=O)[O-])ccc2C)C2CC2)cc1 ZINC000025597001 941964536 /nfs/dbraw/zinc/96/45/36/941964536.db2.gz GOZVBFUGRBZUEM-HXUWFJFHSA-N 0 0 369.421 3.591 20 5 FHBDRN Cc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)nc(C(C)C)n1 ZINC000182744347 941964575 /nfs/dbraw/zinc/96/45/75/941964575.db2.gz SPEDZSJGFKFGAJ-UHFFFAOYSA-N 0 0 366.324 3.670 20 5 FHBDRN Cc1cccc(N(C)C(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])n1 ZINC000182744069 941964786 /nfs/dbraw/zinc/96/47/86/941964786.db2.gz HJGGUOIKMVLKPP-UHFFFAOYSA-N 0 0 351.815 3.707 20 5 FHBDRN Cc1cc(NC(=O)N2C[C@@H](c3ccccc3)O[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000182765041 941966243 /nfs/dbraw/zinc/96/62/43/941966243.db2.gz IJECKKOFEAGIML-KSSFIOAISA-N 0 0 355.394 3.897 20 5 FHBDRN COC1(C(F)(F)F)CCN(c2c3cc(F)ccc3ncc2[N+](=O)[O-])CC1 ZINC000894229180 941974620 /nfs/dbraw/zinc/97/46/20/941974620.db2.gz OKCRAQZXCLTSNW-UHFFFAOYSA-N 0 0 373.306 3.830 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N2C[C@H](C)C[C@@H]2c2cccnc2)c1 ZINC000182838926 941978402 /nfs/dbraw/zinc/97/84/02/941978402.db2.gz QXWDNYPAQIDPMD-SJKOYZFVSA-N 0 0 357.435 3.935 20 5 FHBDRN CCCN(C(=O)c1ccc([N+](=O)[O-])cc1C)[C@@H](C)C(=O)Nc1ccccc1 ZINC000101516539 941980285 /nfs/dbraw/zinc/98/02/85/941980285.db2.gz SYNGPFHRCCOHML-HNNXBMFYSA-N 0 0 369.421 3.783 20 5 FHBDRN COc1c(C)cc(CN(C)Cc2cc([N+](=O)[O-])cc3c2OCOC3)cc1C ZINC000101566445 941981705 /nfs/dbraw/zinc/98/17/05/941981705.db2.gz ZVVPFQNLYRIBOI-UHFFFAOYSA-N 0 0 372.421 3.719 20 5 FHBDRN COc1cc(C(=O)N(C)Cc2cc(C)c(OC)c(C)c2)ccc1[N+](=O)[O-] ZINC000101529576 941983334 /nfs/dbraw/zinc/98/33/34/941983334.db2.gz BFDWNPRMPYPAOL-UHFFFAOYSA-N 0 0 358.394 3.501 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2Cc3ccccc3OC[C@H]2C)ccc1[N+](=O)[O-] ZINC000412255404 941991098 /nfs/dbraw/zinc/99/10/98/941991098.db2.gz ZDEDVPPMJSHDIK-CQSZACIVSA-N 0 0 370.405 3.805 20 5 FHBDRN O=C(c1cc2c(c([N+](=O)[O-])c1)OCO2)N(c1ccccc1)C1CCCC1 ZINC000182895703 941991928 /nfs/dbraw/zinc/99/19/28/941991928.db2.gz KQGZMPJKXVQFNY-UHFFFAOYSA-N 0 0 354.362 3.913 20 5 FHBDRN Cc1ccc(OCCNC(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)cc1 ZINC000549336017 941992772 /nfs/dbraw/zinc/99/27/72/941992772.db2.gz ZLBBZOUPEBNWGA-UHFFFAOYSA-N 0 0 368.311 3.731 20 5 FHBDRN C[C@@H]1CCCN(c2ccc(C(=O)Nc3ccncc3F)cc2[N+](=O)[O-])C1 ZINC000122645087 941994983 /nfs/dbraw/zinc/99/49/83/941994983.db2.gz MYFBXCUYNVMDTF-GFCCVEGCSA-N 0 0 358.373 3.618 20 5 FHBDRN Cc1cc(N2CC[C@@H](C3CCOCC3)C2)c(Br)cc1[N+](=O)[O-] ZINC000473531290 942013001 /nfs/dbraw/zinc/01/30/01/942013001.db2.gz LCGQPUPEVPGPTN-CYBMUJFWSA-N 0 0 369.259 3.919 20 5 FHBDRN CC1(C)CN(C(=O)Nc2cccc([N+](=O)[O-])c2Cl)[C@H]1[C@H]1CCCO1 ZINC000377822598 942015282 /nfs/dbraw/zinc/01/52/82/942015282.db2.gz YQVKCYVXHQOEGW-OCCSQVGLSA-N 0 0 353.806 3.670 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccnn1[C@@H](C)C1CC1 ZINC000072575125 942017010 /nfs/dbraw/zinc/01/70/10/942017010.db2.gz OBVARJZAOUZWHZ-RYUDHWBXSA-N 0 0 360.439 3.882 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccnn1[C@H](C)C1CC1 ZINC000072575122 942017029 /nfs/dbraw/zinc/01/70/29/942017029.db2.gz OBVARJZAOUZWHZ-VXGBXAGGSA-N 0 0 360.439 3.882 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@@](C)(c3ccc(C)cc3)C2)c1 ZINC000433960166 942018200 /nfs/dbraw/zinc/01/82/00/942018200.db2.gz XEHHXZUWPVHXPD-HXUWFJFHSA-N 0 0 354.406 3.716 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)Nc2ncsc2C(C)C)c1F ZINC000415711348 942018590 /nfs/dbraw/zinc/01/85/90/942018590.db2.gz PFMZAKTZHARPCT-UHFFFAOYSA-N 0 0 353.375 3.504 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N[C@@H]2CCCc3sccc32)c1F ZINC000412272452 942021252 /nfs/dbraw/zinc/02/12/52/942021252.db2.gz QJHDFCZYTWGYMB-GFCCVEGCSA-N 0 0 364.398 3.540 20 5 FHBDRN CC[C@H]1Cc2ccccc2CN1C(=O)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC000412276564 942023018 /nfs/dbraw/zinc/02/30/18/942023018.db2.gz UOTCARMNZMYJEK-HNNXBMFYSA-N 0 0 372.396 3.649 20 5 FHBDRN CCCc1n[nH]c(C(=O)N2CC[C@@H](c3ccc(C)cc3C)C2)c1[N+](=O)[O-] ZINC000473531162 942024783 /nfs/dbraw/zinc/02/47/83/942024783.db2.gz PEZUDCRGZZTXEJ-CQSZACIVSA-N 0 0 356.426 3.517 20 5 FHBDRN Cc1sc(C(=O)NC[C@H]2CCCN(c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000433986886 942025442 /nfs/dbraw/zinc/02/54/42/942025442.db2.gz YWZXQCBOLJJIMD-CQSZACIVSA-N 0 0 359.451 3.611 20 5 FHBDRN Cc1cc(C)cc(CN(C)C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)c1 ZINC000433989947 942027142 /nfs/dbraw/zinc/02/71/42/942027142.db2.gz IXLBNTKHBDLBBV-UHFFFAOYSA-N 0 0 364.405 3.670 20 5 FHBDRN Cc1nc2cccc(C(=O)N(Cc3ccc([N+](=O)[O-])cc3)C3CC3)c2[nH]1 ZINC000549346344 942028739 /nfs/dbraw/zinc/02/87/39/942028739.db2.gz CJDSAGVORADDCF-UHFFFAOYSA-N 0 0 350.378 3.584 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCCCc1nc2ccccc2[nH]1 ZINC000085621097 942029171 /nfs/dbraw/zinc/02/91/71/942029171.db2.gz CWJAVEQBJRKCED-UHFFFAOYSA-N 0 0 367.409 3.842 20 5 FHBDRN Cc1ccccc1C[C@@H]1CCCN1C(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000513592109 942031158 /nfs/dbraw/zinc/03/11/58/942031158.db2.gz MJHRBJIZMGXTEO-SFHVURJKSA-N 0 0 368.433 3.906 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N[C@@H](C)c1nc2ccccc2[nH]1 ZINC000085620272 942031201 /nfs/dbraw/zinc/03/12/01/942031201.db2.gz WRHUNRIXEHSLAW-LBPRGKRZSA-N 0 0 353.382 3.971 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N[C@H](C)c1nc2ccccc2[nH]1 ZINC000085620275 942034830 /nfs/dbraw/zinc/03/48/30/942034830.db2.gz WRHUNRIXEHSLAW-GFCCVEGCSA-N 0 0 353.382 3.971 20 5 FHBDRN CC1(F)CC(NC(=O)c2cc(OCc3ccccc3)ccc2[N+](=O)[O-])C1 ZINC000452274003 942038618 /nfs/dbraw/zinc/03/86/18/942038618.db2.gz FCHBCCWXFDIUOH-UHFFFAOYSA-N 0 0 358.369 3.794 20 5 FHBDRN Cc1cc(C)cc(CN(C)C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)c1 ZINC000434011662 942039208 /nfs/dbraw/zinc/03/92/08/942039208.db2.gz MYKPDCLJBPIPLQ-UHFFFAOYSA-N 0 0 364.405 3.670 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)NC[C@@H]2CCC[C@H](C(F)(F)F)C2)c1[N+](=O)[O-] ZINC000434012389 942039226 /nfs/dbraw/zinc/03/92/26/942039226.db2.gz OMXMHEXHROYXMH-ZJUUUORDSA-N 0 0 362.352 3.540 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1Cl)N1CCOC[C@H]1c1ccccc1 ZINC000377872597 942044776 /nfs/dbraw/zinc/04/47/76/942044776.db2.gz FSBIDYRMRWWYCV-HNNXBMFYSA-N 0 0 361.785 3.854 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1Cl)N1CC[C@H](O)c2ccccc2C1 ZINC000377874412 942045470 /nfs/dbraw/zinc/04/54/70/942045470.db2.gz NMMRVCITWQGARH-HNNXBMFYSA-N 0 0 361.785 3.719 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N2CC[C@@H](Cc3ccccc3)[C@@H]2C)c1[N+](=O)[O-] ZINC000434033776 942047998 /nfs/dbraw/zinc/04/79/98/942047998.db2.gz YDMPVDGFKIELSM-ZFWWWQNUSA-N 0 0 356.426 3.535 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)c1ccn(Cc2ccccc2)c1 ZINC000513669925 942066069 /nfs/dbraw/zinc/06/60/69/942066069.db2.gz QVVXDRCQHNHNBS-UHFFFAOYSA-N 0 0 351.362 3.706 20 5 FHBDRN Cc1ccc(CN(C(=O)COc2ccc(F)cc2[N+](=O)[O-])C2CC2)cc1 ZINC000102599566 942072408 /nfs/dbraw/zinc/07/24/08/942072408.db2.gz CIQXJVCMXTUZJW-UHFFFAOYSA-N 0 0 358.369 3.612 20 5 FHBDRN CC(C)[C@@H]1C[C@H](CC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)CCO1 ZINC000513680735 942074103 /nfs/dbraw/zinc/07/41/03/942074103.db2.gz SFJIAAPJDILQMW-ABAIWWIYSA-N 0 0 372.368 3.976 20 5 FHBDRN CCCCN(Cc1ccccc1Cl)C(=O)c1c([N+](=O)[O-])c(C)nn1C ZINC000102613790 942074472 /nfs/dbraw/zinc/07/44/72/942074472.db2.gz JDVJTYYYULYHLL-UHFFFAOYSA-N 0 0 364.833 3.733 20 5 FHBDRN Cc1ccnc(Nc2ccc3c(c2)CN(CC(F)(F)F)C3)c1[N+](=O)[O-] ZINC000413361830 942098419 /nfs/dbraw/zinc/09/84/19/942098419.db2.gz AIRYWWDBNVUBDX-UHFFFAOYSA-N 0 0 352.316 3.920 20 5 FHBDRN O=C(Nc1ccc2c(c1)CCN2)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000415875500 942098530 /nfs/dbraw/zinc/09/85/30/942098530.db2.gz DMFPCQWDJZNEJW-INIZCTEOSA-N 0 0 366.421 3.974 20 5 FHBDRN Cc1ccnc(N2CCC[C@@H]2c2ccc(Br)cn2)c1[N+](=O)[O-] ZINC000413363875 942098986 /nfs/dbraw/zinc/09/89/86/942098986.db2.gz BGHQKOBYLRUKBN-CYBMUJFWSA-N 0 0 363.215 3.797 20 5 FHBDRN C[C@H]1CN(C(=O)c2cccc3c(=O)c4ccccc4[nH]c23)C[C@@H](C2CC2)O1 ZINC000280085821 942099419 /nfs/dbraw/zinc/09/94/19/942099419.db2.gz QLMSSKJGKCEUFT-DJJJIMSYSA-N 0 0 362.429 3.733 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])N[C@H](C[C@H]1CCOC1)c1ccccc1 ZINC000163827696 942116764 /nfs/dbraw/zinc/11/67/64/942116764.db2.gz AIEBXDHZZIOGHO-CRAIPNDOSA-N 0 0 369.421 3.562 20 5 FHBDRN O=c1oc2ccc([N+](=O)[O-])cc2n1Cc1csc(-c2ccccc2F)n1 ZINC000102847057 942117334 /nfs/dbraw/zinc/11/73/34/942117334.db2.gz BYIXJCGVLKVDTD-UHFFFAOYSA-N 0 0 371.349 3.814 20 5 FHBDRN Cc1ccc([C@@H]2OCCC[C@H]2CNc2c(C(N)=O)cccc2[N+](=O)[O-])cc1 ZINC000420593524 942120724 /nfs/dbraw/zinc/12/07/24/942120724.db2.gz BUQFKEKWNHGZJE-KXBFYZLASA-N 0 0 369.421 3.582 20 5 FHBDRN Cc1cnc(Nc2ccc3c(c2)CN(CC(F)(F)F)C3)c([N+](=O)[O-])c1 ZINC000413371544 942121255 /nfs/dbraw/zinc/12/12/55/942121255.db2.gz NCQSVAXETDYMDK-UHFFFAOYSA-N 0 0 352.316 3.920 20 5 FHBDRN Cc1nn(C)c2nccc(N3CCC[C@H](c4ccc([N+](=O)[O-])cc4)C3)c12 ZINC000420626551 942126066 /nfs/dbraw/zinc/12/60/66/942126066.db2.gz JTUAKOGFTHHZPV-HNNXBMFYSA-N 0 0 351.410 3.569 20 5 FHBDRN CN(c1ncc([N+](=O)[O-])cc1Br)C1CC(OC(C)(C)C)C1 ZINC000420630252 942128676 /nfs/dbraw/zinc/12/86/76/942128676.db2.gz SQQVUXWOORPDPI-UHFFFAOYSA-N 0 0 358.236 3.535 20 5 FHBDRN COc1ccccc1C(C)(C)NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000413390338 942128793 /nfs/dbraw/zinc/12/87/93/942128793.db2.gz ZVZZVSAJDPBTPR-JKSUJKDBSA-N 0 0 354.406 3.758 20 5 FHBDRN CC(C)NC(=O)c1ccc(N2CCC[C@H](CC(F)(F)F)C2)c([N+](=O)[O-])c1 ZINC000420634157 942131460 /nfs/dbraw/zinc/13/14/60/942131460.db2.gz SUGYEDMIDUJVFJ-GFCCVEGCSA-N 0 0 373.375 3.902 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(-n2cnnc2)cc1 ZINC001269021261 942133000 /nfs/dbraw/zinc/13/30/00/942133000.db2.gz IPFWWFFRTWESFF-UHFFFAOYSA-N 0 0 369.406 3.540 20 5 FHBDRN CSc1ccc(C(=O)Nc2ccccc2N2CCCC2=O)cc1[N+](=O)[O-] ZINC000016105748 942135235 /nfs/dbraw/zinc/13/52/35/942135235.db2.gz ROODGUJCWWLIGT-UHFFFAOYSA-N 0 0 371.418 3.696 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@H]1c1ccc2c(c1)OCO2 ZINC000102915030 942145248 /nfs/dbraw/zinc/14/52/48/942145248.db2.gz FSAWGHUGUGHUQT-INIZCTEOSA-N 0 0 354.362 3.609 20 5 FHBDRN O=C(NC1CC1)c1ccc(N2CCC[C@@H](CC(F)(F)F)C2)c([N+](=O)[O-])c1 ZINC000420640565 942148420 /nfs/dbraw/zinc/14/84/20/942148420.db2.gz YUIAFRFKOFKCLS-NSHDSACASA-N 0 0 371.359 3.656 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(N2CC[C@H](C(F)(F)F)C3(CCOCC3)C2)c1 ZINC000413402904 942152750 /nfs/dbraw/zinc/15/27/50/942152750.db2.gz WFQYEDOGMODNSB-HNNXBMFYSA-N 0 0 374.359 3.789 20 5 FHBDRN O=C(NCc1cc2ccccc2o1)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000122735457 942155599 /nfs/dbraw/zinc/15/55/99/942155599.db2.gz DQZITYMHIRQRGQ-UHFFFAOYSA-N 0 0 351.362 3.609 20 5 FHBDRN CCc1nc([C@@H](C)NC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])cs1 ZINC000280306677 942162486 /nfs/dbraw/zinc/16/24/86/942162486.db2.gz XNDDFUXFLPSPQQ-MRVPVSSYSA-N 0 0 371.821 3.826 20 5 FHBDRN C[C@@H](C(=O)Nc1c[nH]nc1-c1ccccc1)c1ccc([N+](=O)[O-])cc1F ZINC000183383598 942164744 /nfs/dbraw/zinc/16/47/44/942164744.db2.gz OJLNYDDZFKAKGB-LLVKDONJSA-N 0 0 354.341 3.866 20 5 FHBDRN C[C@H](C(=O)NCCc1cccc2[nH]ccc21)c1ccc([N+](=O)[O-])cc1F ZINC000502008908 942167077 /nfs/dbraw/zinc/16/70/77/942167077.db2.gz WHBGIOOFDNLJHA-LBPRGKRZSA-N 0 0 355.369 3.678 20 5 FHBDRN CCOC(=O)c1ccc(C(=O)Nc2ccc(C(C)(C)C)c([N+](=O)[O-])c2)nc1 ZINC000513727925 942169775 /nfs/dbraw/zinc/16/97/75/942169775.db2.gz CGVXIIAUCDDGNY-UHFFFAOYSA-N 0 0 371.393 3.716 20 5 FHBDRN CC1(C)Oc2ccsc2[C@@H](Nc2ccnc3c2cccc3[N+](=O)[O-])[C@@H]1O ZINC000413427427 942169860 /nfs/dbraw/zinc/16/98/60/942169860.db2.gz ZPBGXULKGRGAON-WBVHZDCISA-N 0 0 371.418 3.890 20 5 FHBDRN Cc1cc(N(C)C)ccc1NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513694539 942175608 /nfs/dbraw/zinc/17/56/08/942175608.db2.gz RQXZRBCLOQROKS-UHFFFAOYSA-N 0 0 365.336 3.823 20 5 FHBDRN O=C(NC[C@H]1CCC(F)(F)C1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000280426904 942176841 /nfs/dbraw/zinc/17/68/41/942176841.db2.gz AWUAUGRBDIJLAA-ZDUSSCGKSA-N 0 0 353.369 3.704 20 5 FHBDRN NC(=O)c1ccnc(N2CC3(CCCCC3)[C@@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000413434093 942183560 /nfs/dbraw/zinc/18/35/60/942183560.db2.gz KVVBZVGEROLSMQ-KRWDZBQOSA-N 0 0 366.421 3.601 20 5 FHBDRN C[C@@H](C(=O)NCc1ccc(Br)cc1)c1cccc([N+](=O)[O-])c1 ZINC000319653088 942189042 /nfs/dbraw/zinc/18/90/42/942189042.db2.gz PVOSAOXICCZYLN-LLVKDONJSA-N 0 0 363.211 3.777 20 5 FHBDRN CN(C(=O)COc1ccccc1[N+](=O)[O-])[C@@H](c1ccccc1)C(F)(F)F ZINC000103051052 942192561 /nfs/dbraw/zinc/19/25/61/942192561.db2.gz GWLCWXZXSSJRPA-INIZCTEOSA-N 0 0 368.311 3.736 20 5 FHBDRN COc1cc(C(=O)N(C)[C@@H](c2ccccc2)C(F)(F)F)ccc1[N+](=O)[O-] ZINC000103049485 942197772 /nfs/dbraw/zinc/19/77/72/942197772.db2.gz FBWIIYVGJHDFGO-HNNXBMFYSA-N 0 0 368.311 3.979 20 5 FHBDRN CC[C@@H](Sc1ccccc1)C(=O)NCc1cc([N+](=O)[O-])ccc1OC ZINC000110236370 942203635 /nfs/dbraw/zinc/20/36/35/942203635.db2.gz ZVOIVMLYFCOUMQ-QGZVFWFLSA-N 0 0 360.435 3.791 20 5 FHBDRN CC(C)(C(=O)NC[C@H]1CCO[C@@H]1c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000502081188 942208913 /nfs/dbraw/zinc/20/89/13/942208913.db2.gz AHAWIYHBWHDQIT-VQIMIIECSA-N 0 0 368.433 3.766 20 5 FHBDRN CC(C)CCC[C@@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1SCCO ZINC000136279256 942221353 /nfs/dbraw/zinc/22/13/53/942221353.db2.gz SMNWFMRXJBCBDY-CYBMUJFWSA-N 0 0 354.472 3.624 20 5 FHBDRN C[C@H](c1ccccc1)[C@H](C)NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000473542277 942230235 /nfs/dbraw/zinc/23/02/35/942230235.db2.gz ASZJEDHWUHJUMH-GJZGRUSLSA-N 0 0 364.405 3.703 20 5 FHBDRN C[C@H](NC(=O)N1CC[C@H](c2ccccc2F)C1)c1cccc([N+](=O)[O-])c1 ZINC000502123875 942233675 /nfs/dbraw/zinc/23/36/75/942233675.db2.gz JJFXIZKGXWPCQR-ZFWWWQNUSA-N 0 0 357.385 3.994 20 5 FHBDRN Cc1c(NC(=O)c2ccnn2C(C)C)cc(Br)cc1[N+](=O)[O-] ZINC000280702775 942235819 /nfs/dbraw/zinc/23/58/19/942235819.db2.gz LPBZUGKHPYNYKI-UHFFFAOYSA-N 0 0 367.203 3.695 20 5 FHBDRN CCS(=O)(=O)c1cc(Cl)cc(CNc2c(C)cccc2[N+](=O)[O-])c1 ZINC000413484518 942238079 /nfs/dbraw/zinc/23/80/79/942238079.db2.gz DMJLZYQVCFPLMP-UHFFFAOYSA-N 0 0 368.842 3.962 20 5 FHBDRN O=C(Nc1ccc2c(c1)CCCO2)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513731139 942240535 /nfs/dbraw/zinc/24/05/35/942240535.db2.gz RYYHXCCCYSJTJY-UHFFFAOYSA-N 0 0 364.304 3.774 20 5 FHBDRN C[C@H](NC(=O)N[C@@H]1c2ccc(F)cc2O[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000480970582 942246296 /nfs/dbraw/zinc/24/62/96/942246296.db2.gz YQVAHKOCVCWUDP-DINDLPBHSA-N 0 0 359.357 3.616 20 5 FHBDRN Cc1nc(Cc2nnc(SCc3c(F)cccc3[N+](=O)[O-])o2)cs1 ZINC000103349248 942246316 /nfs/dbraw/zinc/24/63/16/942246316.db2.gz OAEMWOJWTLUABE-UHFFFAOYSA-N 0 0 366.399 3.765 20 5 FHBDRN CCCc1ccc([C@]2(C)NC(=O)N(Cc3ccccc3[N+](=O)[O-])C2=O)cc1 ZINC000015573132 942246514 /nfs/dbraw/zinc/24/65/14/942246514.db2.gz CEKWOYNSAQVIAG-FQEVSTJZSA-N 0 0 367.405 3.515 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)OCC(=O)Nc2cc(C)cc(C)c2)c1 ZINC000016195913 942248006 /nfs/dbraw/zinc/24/80/06/942248006.db2.gz RUFHLTHCNPZVQK-UHFFFAOYSA-N 0 0 374.418 3.729 20 5 FHBDRN COc1ccc(CCC(=O)N2c3ccc([N+](=O)[O-])cc3C[C@@H]2C)cc1F ZINC000103376653 942248110 /nfs/dbraw/zinc/24/81/10/942248110.db2.gz WJXODMPRINRECV-LBPRGKRZSA-N 0 0 358.369 3.653 20 5 FHBDRN C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)Cc1csc(C(C)(C)C)n1 ZINC000103375287 942248174 /nfs/dbraw/zinc/24/81/74/942248174.db2.gz HNDKRDGFCLNNGA-LLVKDONJSA-N 0 0 359.451 3.869 20 5 FHBDRN COc1cc(CCC(=O)N2c3ccc([N+](=O)[O-])cc3C[C@H]2C)cc(OC)c1 ZINC000103376810 942248251 /nfs/dbraw/zinc/24/82/51/942248251.db2.gz UTXOGQYPXDDWSN-CYBMUJFWSA-N 0 0 370.405 3.522 20 5 FHBDRN O=[N+]([O-])c1cnc(NCC2(c3cccc(Cl)c3)CCOCC2)c(F)c1 ZINC000413063622 942248527 /nfs/dbraw/zinc/24/85/27/942248527.db2.gz AVYCGQYKPRGKRT-UHFFFAOYSA-N 0 0 365.792 3.943 20 5 FHBDRN C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)Cc1ccc(OC(F)F)cc1 ZINC000103376971 942248706 /nfs/dbraw/zinc/24/87/06/942248706.db2.gz HJWCHKOYCGAICV-LLVKDONJSA-N 0 0 362.332 3.717 20 5 FHBDRN C[S@](=O)c1cccc(NC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000159047876 942249731 /nfs/dbraw/zinc/24/97/31/942249731.db2.gz BRCABGDVJPOBTA-AREMUKBSSA-N 0 0 373.434 3.529 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)NCc1cccc(OC(C)(C)C)n1 ZINC000502155281 942250811 /nfs/dbraw/zinc/25/08/11/942250811.db2.gz LMYAFABUGFIYER-UHFFFAOYSA-N 0 0 372.425 3.509 20 5 FHBDRN CCNC(=O)c1ccc(Cl)cc1NC(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000046718844 942252732 /nfs/dbraw/zinc/25/27/32/942252732.db2.gz CWPFQYSZGYCEHJ-UHFFFAOYSA-N 0 0 361.785 3.559 20 5 FHBDRN C[C@@H](Nc1ncc([N+](=O)[O-])cc1F)c1ccc(NC(=O)NC2CC2)cc1 ZINC000413071652 942259390 /nfs/dbraw/zinc/25/93/90/942259390.db2.gz ZYWXOGDMRUBLMZ-SNVBAGLBSA-N 0 0 359.361 3.586 20 5 FHBDRN COCCOc1ccccc1CNc1ncc([N+](=O)[O-])cc1C(F)(F)F ZINC000413074005 942259705 /nfs/dbraw/zinc/25/97/05/942259705.db2.gz RHULRDLWBRYICO-UHFFFAOYSA-N 0 0 371.315 3.646 20 5 FHBDRN CC(C)c1ccc(C(=O)Nc2ccc(C(=O)N(C)C)cc2F)cc1[N+](=O)[O-] ZINC000416013527 942261901 /nfs/dbraw/zinc/26/19/01/942261901.db2.gz MRHLXCBCVIBMSG-UHFFFAOYSA-N 0 0 373.384 3.811 20 5 FHBDRN Cc1sc(S(=O)(=O)N(C)Cc2ccc(Cl)s2)cc1[N+](=O)[O-] ZINC000122845940 942264381 /nfs/dbraw/zinc/26/43/81/942264381.db2.gz XPZJUAFBOMFSAB-UHFFFAOYSA-N 0 0 366.873 3.500 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)NCc1cc(F)ccc1Br ZINC000502175672 942265639 /nfs/dbraw/zinc/26/56/39/942265639.db2.gz HLGNUNAITRUGHY-UHFFFAOYSA-N 0 0 367.174 3.735 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1cccc(O)c1)N1CCS[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000413507728 942281350 /nfs/dbraw/zinc/28/13/50/942281350.db2.gz CGSYHQWYRZOSQW-SCTDSRPQSA-N 0 0 370.430 3.678 20 5 FHBDRN COc1ccc2c(c1)N(C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)C[C@H](C)O2 ZINC000413509703 942282703 /nfs/dbraw/zinc/28/27/03/942282703.db2.gz HREDSMPQXXBJQH-AFAVFJNCSA-N 0 0 368.389 3.521 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)c1cc[nH]c(=O)c1 ZINC000502209390 942283736 /nfs/dbraw/zinc/28/37/36/942283736.db2.gz ROOUYPYHADLRDM-LLVKDONJSA-N 0 0 361.423 3.687 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCCCn1cnc2ccccc21 ZINC000085635006 942285411 /nfs/dbraw/zinc/28/54/11/942285411.db2.gz MDSUKNQJTYHHMK-UHFFFAOYSA-N 0 0 367.409 3.773 20 5 FHBDRN Cc1ccc(CCNC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)c(C)c1 ZINC000513704816 942286965 /nfs/dbraw/zinc/28/69/65/942286965.db2.gz GDBAEYXWAOBKOK-UHFFFAOYSA-N 0 0 364.348 3.786 20 5 FHBDRN CCN(Cc1c(F)cccc1F)C(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000122852675 942287483 /nfs/dbraw/zinc/28/74/83/942287483.db2.gz ZYGHIMRFVAFOLR-UHFFFAOYSA-N 0 0 365.336 3.936 20 5 FHBDRN O=C(Nc1cccc(-c2cc[nH]n2)c1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513735730 942291348 /nfs/dbraw/zinc/29/13/48/942291348.db2.gz RMFIITCBRKBEQZ-UHFFFAOYSA-N 0 0 374.303 3.839 20 5 FHBDRN CN(C(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@H]1CCC[C@@H]1C(C)(C)C ZINC000419530308 942292429 /nfs/dbraw/zinc/29/24/29/942292429.db2.gz ZBFYJEHSVSJDMZ-BBRMVZONSA-N 0 0 373.457 3.827 20 5 FHBDRN CCC[C@@H](C)NC(=O)[C@H]1CCCN(c2nccc3ccc([N+](=O)[O-])cc32)C1 ZINC000413108944 942293304 /nfs/dbraw/zinc/29/33/04/942293304.db2.gz SCNNXYQDVFQFAL-ZBFHGGJFSA-N 0 0 370.453 3.664 20 5 FHBDRN CCOc1cc(NC(=O)NCCCC(C)C)c([N+](=O)[O-])cc1OCC ZINC000501073778 942295424 /nfs/dbraw/zinc/29/54/24/942295424.db2.gz BOFGLEXNMCMFTD-UHFFFAOYSA-N 0 0 353.419 3.950 20 5 FHBDRN C[C@@H]1C[C@H](C)CCN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000502217211 942295663 /nfs/dbraw/zinc/29/56/63/942295663.db2.gz CPOOSSJJWPWBSQ-GHMZBOCLSA-N 0 0 355.232 3.866 20 5 FHBDRN CC[C@H](c1ccncc1)N(CC)C(=O)c1cc(OC)c(C)c([N+](=O)[O-])c1 ZINC000187983957 942297705 /nfs/dbraw/zinc/29/77/05/942297705.db2.gz WMMQEPVSIQRLQK-MRXNPFEDSA-N 0 0 357.410 3.920 20 5 FHBDRN Cc1nn(CCC(=O)N[C@H](C)c2ccc(C3CC3)cc2)c(C)c1[N+](=O)[O-] ZINC000416051644 942302860 /nfs/dbraw/zinc/30/28/60/942302860.db2.gz BCPQPJVGGMKERI-GFCCVEGCSA-N 0 0 356.426 3.553 20 5 FHBDRN O=C(N[C@H]1COCc2ccccc21)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000419558788 942303187 /nfs/dbraw/zinc/30/31/87/942303187.db2.gz OIPULAUTTOOQTC-IBGZPJMESA-N 0 0 367.405 3.540 20 5 FHBDRN COC(=O)Cc1cccc(NC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)c1 ZINC000188014252 942305317 /nfs/dbraw/zinc/30/53/17/942305317.db2.gz ZNAWHOIQHBVEJZ-UHFFFAOYSA-N 0 0 356.378 3.686 20 5 FHBDRN CO[C@H]1CCC[C@@H](C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000513737145 942308887 /nfs/dbraw/zinc/30/88/87/942308887.db2.gz VLWIIFWJVLVPQN-RNCFNFMXSA-N 0 0 357.204 3.501 20 5 FHBDRN CN(Cc1ccoc1)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000501105424 942309901 /nfs/dbraw/zinc/30/99/01/942309901.db2.gz AJRCJUXJARRSDX-UHFFFAOYSA-N 0 0 354.160 3.614 20 5 FHBDRN COc1cccc(N2CC[C@H](Nc3nccc4ccc([N+](=O)[O-])cc43)C2)c1 ZINC000413121815 942317801 /nfs/dbraw/zinc/31/78/01/942317801.db2.gz XCOQICYMJLKKES-HNNXBMFYSA-N 0 0 364.405 3.842 20 5 FHBDRN C[C@H](Nc1ccc(C(=O)NC[C@@H]2CC23CC3)cc1[N+](=O)[O-])c1ccccn1 ZINC000416071896 942318483 /nfs/dbraw/zinc/31/84/83/942318483.db2.gz MKQSMGLYCHYMLF-ZFWWWQNUSA-N 0 0 366.421 3.693 20 5 FHBDRN Cc1nn(Cc2ccc(C(=O)N3C[C@H](C)[C@@H](C)[C@@H]3C)cc2)c(C)c1[N+](=O)[O-] ZINC000416079029 942318706 /nfs/dbraw/zinc/31/87/06/942318706.db2.gz TTWHXZVPYPKGEZ-GUTXKFCHSA-N 0 0 370.453 3.573 20 5 FHBDRN COc1cc(C(=O)N2CC[C@H](Cc3ccccc3)C2)cc([N+](=O)[O-])c1C ZINC000188046643 942320030 /nfs/dbraw/zinc/32/00/30/942320030.db2.gz YNLVARAWLHKLTA-MRXNPFEDSA-N 0 0 354.406 3.617 20 5 FHBDRN CSc1cccc(C(=O)NC[C@@H](C)N(C)c2ccccc2)c1[N+](=O)[O-] ZINC000188057750 942322867 /nfs/dbraw/zinc/32/28/67/942322867.db2.gz MWYHGBWACSHFHV-CYBMUJFWSA-N 0 0 359.451 3.571 20 5 FHBDRN Cc1cnn(CC2CCN(c3ccc([N+](=O)[O-])c4ncccc34)CC2)c1 ZINC000413127655 942324690 /nfs/dbraw/zinc/32/46/90/942324690.db2.gz MUNBDMOYQWTDNI-UHFFFAOYSA-N 0 0 351.410 3.565 20 5 FHBDRN C[C@@H]1C[C@@H](CNc2cc(C(F)(F)C(F)(F)F)ncc2[N+](=O)[O-])[C@H](C)O1 ZINC000413535943 942325823 /nfs/dbraw/zinc/32/58/23/942325823.db2.gz QLTZFSWBNIBMCS-VGMNWLOBSA-N 0 0 369.290 3.869 20 5 FHBDRN C[C@@H]1C[C@H](CNc2cc(C(F)(F)C(F)(F)F)ncc2[N+](=O)[O-])[C@H](C)O1 ZINC000413535941 942325917 /nfs/dbraw/zinc/32/59/17/942325917.db2.gz QLTZFSWBNIBMCS-HRDYMLBCSA-N 0 0 369.290 3.869 20 5 FHBDRN CCc1nccn1[C@@H]1CCCN(c2ccc([N+](=O)[O-])c3ncccc23)C1 ZINC000413130053 942326099 /nfs/dbraw/zinc/32/60/99/942326099.db2.gz QLCUGZKWGUUAJJ-CQSZACIVSA-N 0 0 351.410 3.743 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)N[C@@H](C)c2cccc(F)c2F)cc1C ZINC000501153515 942328539 /nfs/dbraw/zinc/32/85/39/942328539.db2.gz CIEYPAXKOMGIEO-NSHDSACASA-N 0 0 370.377 3.529 20 5 FHBDRN Cc1cc(C(=O)O[C@H](C)C(=O)Nc2c(C)cccc2C)ccc1[N+](=O)[O-] ZINC000015699068 942331744 /nfs/dbraw/zinc/33/17/44/942331744.db2.gz XGPAYHMYCYPERZ-CQSZACIVSA-N 0 0 356.378 3.704 20 5 FHBDRN CC[C@@H](NC(=O)c1cc(OC)c(OC(F)F)cc1[N+](=O)[O-])[C@H]1CC1(C)C ZINC000416087773 942334764 /nfs/dbraw/zinc/33/47/64/942334764.db2.gz ZDQKRDXMLCVPJU-GHMZBOCLSA-N 0 0 372.368 3.759 20 5 FHBDRN CC(C)c1ccc(C(=O)NC[C@](C)(CO)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000481102881 942335234 /nfs/dbraw/zinc/33/52/34/942335234.db2.gz FAYGRUIRIZGEBF-OAQYLSRUSA-N 0 0 370.449 3.689 20 5 FHBDRN Cc1cc(Cc2noc(C[C@H]3OCCc4ccccc43)n2)ccc1[N+](=O)[O-] ZINC000274075156 942339232 /nfs/dbraw/zinc/33/92/32/942339232.db2.gz WWMFNTVRUWBITL-GOSISDBHSA-N 0 0 365.389 3.734 20 5 FHBDRN Cc1cc(F)cc([C@]2(F)CCN(C(=O)c3ccc(F)cc3[N+](=O)[O-])C2)c1 ZINC000501175498 942341423 /nfs/dbraw/zinc/34/14/23/942341423.db2.gz NLTGNFMOUGRHMU-SFHVURJKSA-N 0 0 364.323 3.892 20 5 FHBDRN CC(C)NC(=O)[C@H]1CCC[C@@H](Nc2ncc([N+](=O)[O-])cc2C(F)(F)F)C1 ZINC000413150507 942344365 /nfs/dbraw/zinc/34/43/65/942344365.db2.gz VEVABCPLUVXXOI-WDEREUQCSA-N 0 0 374.363 3.504 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)Nc1csc(-c2ccncc2)n1 ZINC001268825021 942346110 /nfs/dbraw/zinc/34/61/10/942346110.db2.gz JQJMXHGUFMAXFM-UHFFFAOYSA-N 0 0 372.431 3.844 20 5 FHBDRN C[C@@H](C(=O)N1CCSC[C@H]1C1CCC1)c1ccc([N+](=O)[O-])cc1F ZINC000416101233 942346145 /nfs/dbraw/zinc/34/61/45/942346145.db2.gz BAOCIWYDIPJWDX-BZNIZROVSA-N 0 0 352.431 3.582 20 5 FHBDRN CC(C)(C)c1ncc(C(=O)Nc2ccnn2-c2ccc([N+](=O)[O-])cc2)s1 ZINC000103931573 942346335 /nfs/dbraw/zinc/34/63/35/942346335.db2.gz REJIHGLWFWJDKP-UHFFFAOYSA-N 0 0 371.422 3.787 20 5 FHBDRN O=C(NCc1ccc(-n2ccnc2)c(F)c1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000110248605 942348074 /nfs/dbraw/zinc/34/80/74/942348074.db2.gz XXSKHUVUHDQGBC-UHFFFAOYSA-N 0 0 374.759 3.503 20 5 FHBDRN CCCCCn1cc(CNC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)c(C)n1 ZINC000502290932 942348787 /nfs/dbraw/zinc/34/87/87/942348787.db2.gz HEPLODAHNBDXLS-CQSZACIVSA-N 0 0 373.457 3.850 20 5 FHBDRN Cc1cc(CNC(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)cc(C)n1 ZINC000421082312 942348834 /nfs/dbraw/zinc/34/88/34/942348834.db2.gz BZQWKPYMYCVHMJ-UHFFFAOYSA-N 0 0 368.315 3.947 20 5 FHBDRN O=[N+]([O-])c1cnc(Nc2ccc(NC[C@H]3CCCO3)c(F)c2)c(F)c1 ZINC000413154474 942352256 /nfs/dbraw/zinc/35/22/56/942352256.db2.gz NZZWQQCPRKSCKM-GFCCVEGCSA-N 0 0 350.325 3.603 20 5 FHBDRN O=C(Nc1cnn(-c2ccccc2)c1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513710458 942352612 /nfs/dbraw/zinc/35/26/12/942352612.db2.gz SUCMDMSBLDUFBC-UHFFFAOYSA-N 0 0 374.303 3.634 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[C@@](F)(c2ccccc2C)C1 ZINC000501241862 942357682 /nfs/dbraw/zinc/35/76/82/942357682.db2.gz DJAXRCIQDGIFBM-IBGZPJMESA-N 0 0 358.369 3.623 20 5 FHBDRN C[C@H](Sc1cc(C(F)(F)F)ncc1[N+](=O)[O-])C(=O)OC(C)(C)C ZINC000481118908 942359209 /nfs/dbraw/zinc/35/92/09/942359209.db2.gz YFSQTJNGIBGQJV-ZETCQYMHSA-N 0 0 352.334 3.831 20 5 FHBDRN CCc1ccc(NC(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)cc1F ZINC000501232591 942362487 /nfs/dbraw/zinc/36/24/87/942362487.db2.gz AIVVWKJQZZLBGA-UHFFFAOYSA-N 0 0 372.400 3.650 20 5 FHBDRN CCc1n[nH]c(C(=O)N[C@@H]2CCc3c2ccc(Cl)c3Cl)c1[N+](=O)[O-] ZINC000501264790 942370367 /nfs/dbraw/zinc/37/03/67/942370367.db2.gz RQTBIGPJWKDXAS-LLVKDONJSA-N 0 0 369.208 3.604 20 5 FHBDRN Cc1cccc(OCCCNC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)c1 ZINC000016278304 942372988 /nfs/dbraw/zinc/37/29/88/942372988.db2.gz OZFVUKUQYNUGNO-HNNXBMFYSA-N 0 0 374.462 3.969 20 5 FHBDRN COCc1ccsc1C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000501291975 942380882 /nfs/dbraw/zinc/38/08/82/942380882.db2.gz ZGBALBAGHKDACV-UHFFFAOYSA-N 0 0 371.212 3.818 20 5 FHBDRN Cc1cccc(N2CCN(C(=O)c3cc(Cl)ccc3[N+](=O)[O-])CC2)c1 ZINC000016297571 942398148 /nfs/dbraw/zinc/39/81/48/942398148.db2.gz IKMPZKDARHMVPQ-UHFFFAOYSA-N 0 0 359.813 3.519 20 5 FHBDRN Cc1c(NC(=O)CNC(=O)c2ccc(C(C)(C)C)cc2)cccc1[N+](=O)[O-] ZINC000015790585 942402734 /nfs/dbraw/zinc/40/27/34/942402734.db2.gz JMNXJDMZEYGABV-UHFFFAOYSA-N 0 0 369.421 3.569 20 5 FHBDRN COc1ccccc1OCCC(=O)Nc1ccc([N+](=O)[O-])c2ncccc12 ZINC001268848509 942404688 /nfs/dbraw/zinc/40/46/88/942404688.db2.gz ACIPNTMHMYZAOK-UHFFFAOYSA-N 0 0 367.361 3.559 20 5 FHBDRN CC[C@H](NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)c1nc(C)cs1 ZINC000513744241 942408753 /nfs/dbraw/zinc/40/87/53/942408753.db2.gz IQXNVJIOZFMTDR-JTQLQIEISA-N 0 0 371.365 3.842 20 5 FHBDRN CO[C@H](CNc1ncc([N+](=O)[O-])cc1C(F)(F)F)c1ccc(F)cc1 ZINC000413181206 942409377 /nfs/dbraw/zinc/40/93/77/942409377.db2.gz ZVBCEJBJLIQCIM-CYBMUJFWSA-N 0 0 359.279 3.947 20 5 FHBDRN O=C(COc1cccc([N+](=O)[O-])c1)NC1(c2ccccc2)CCCCC1 ZINC000505244666 942414661 /nfs/dbraw/zinc/41/46/61/942414661.db2.gz LIYWKOQUPPUALC-UHFFFAOYSA-N 0 0 354.406 3.949 20 5 FHBDRN CC(=Cc1cccc([N+](=O)[O-])c1)CNc1cc(C)n(CC(F)(F)F)n1 ZINC000419836520 942414976 /nfs/dbraw/zinc/41/49/76/942414976.db2.gz XXYWNOUIOVUSSR-IZZDOVSWSA-N 0 0 354.332 3.599 20 5 FHBDRN Cc1cc(NC(=O)Cc2ccccc2Cl)c2cc([N+](=O)[O-])ccc2n1 ZINC001268853960 942415009 /nfs/dbraw/zinc/41/50/09/942415009.db2.gz PKXOSCXCSHVVDB-UHFFFAOYSA-N 0 0 355.781 3.708 20 5 FHBDRN Cc1c(NC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)cnn1CC(C)C ZINC000501342571 942420241 /nfs/dbraw/zinc/42/02/41/942420241.db2.gz VTTUXPBEAAKLBD-CYBMUJFWSA-N 0 0 362.455 3.875 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1-c1nc(-c2ccnc(N3CCCC3)c2)no1 ZINC000421239606 942430871 /nfs/dbraw/zinc/43/08/71/942430871.db2.gz FZJYXLTWKMETIM-UHFFFAOYSA-N 0 0 365.393 3.924 20 5 FHBDRN CCNc1ccc(C(=O)N(CC)Cc2ccc(OC)cc2)cc1[N+](=O)[O-] ZINC000502416019 942433162 /nfs/dbraw/zinc/43/31/62/942433162.db2.gz PLBJDQIMXVMLEM-UHFFFAOYSA-N 0 0 357.410 3.698 20 5 FHBDRN COc1ccc([C@@H]2CCCN2C(=O)Cc2ccc([N+](=O)[O-])cc2)c(OC)c1 ZINC000015829501 942435807 /nfs/dbraw/zinc/43/58/07/942435807.db2.gz DEPDXIHIGUNIMO-SFHVURJKSA-N 0 0 370.405 3.518 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CCC[C@@H]2[C@@H]2CCCCC2=O)ccc1[N+](=O)[O-] ZINC000413612019 942439034 /nfs/dbraw/zinc/43/90/34/942439034.db2.gz SXXGZFNZIKAMRQ-JKSUJKDBSA-N 0 0 374.437 3.746 20 5 FHBDRN Cc1noc(C2CCC(Nc3nccc4ccc([N+](=O)[O-])cc43)CC2)n1 ZINC000413187917 942439177 /nfs/dbraw/zinc/43/91/77/942439177.db2.gz STFNDBRIQOJOEG-UHFFFAOYSA-N 0 0 353.382 3.973 20 5 FHBDRN COc1cccc(C2(NC(=O)[C@@H]3C[C@H]3c3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000413616986 942441293 /nfs/dbraw/zinc/44/12/93/942441293.db2.gz JMPGNALLEGJPSF-ZWKOTPCHSA-N 0 0 352.390 3.512 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)C(F)(F)F)cc1N[C@@H]1CCC[C@H](CO)C1 ZINC000413620996 942441999 /nfs/dbraw/zinc/44/19/99/942441999.db2.gz XWXQFQGUSRUPAJ-DTWKUNHWSA-N 0 0 369.290 3.607 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NCc1nnc(-c2ccccc2OC)o1 ZINC000366828507 942442386 /nfs/dbraw/zinc/44/23/86/942442386.db2.gz DBLSTSUUDIHFMP-UHFFFAOYSA-N 0 0 370.365 3.664 20 5 FHBDRN C[C@H](NC(=O)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1)c1nccs1 ZINC000413643925 942452147 /nfs/dbraw/zinc/45/21/47/942452147.db2.gz SFUGTTFJSNSORE-JSGCOSHPSA-N 0 0 360.439 3.702 20 5 FHBDRN O=C(Nc1ccccc1O[C@@H]1CCOC1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000413631822 942454008 /nfs/dbraw/zinc/45/40/08/942454008.db2.gz YLLMAJWXOGCXNG-IXDOHACOSA-N 0 0 368.389 3.505 20 5 FHBDRN C[C@H](Nc1ncc([N+](=O)[O-])cc1C(F)(F)F)[C@@H]1COc2ccccc21 ZINC000413199669 942459906 /nfs/dbraw/zinc/45/99/06/942459906.db2.gz ISTLQXLPYKUEGJ-CABZTGNLSA-N 0 0 353.300 3.985 20 5 FHBDRN COc1cccc(COCCNc2ncc([N+](=O)[O-])cc2C(F)(F)F)c1 ZINC000413194402 942459974 /nfs/dbraw/zinc/45/99/74/942459974.db2.gz BHHYGCFWUGZFDM-UHFFFAOYSA-N 0 0 371.315 3.646 20 5 FHBDRN C[C@@H](O)C[C@H](CNc1ncc([N+](=O)[O-])cc1C(F)(F)F)c1ccccc1 ZINC000413197610 942460849 /nfs/dbraw/zinc/46/08/49/942460849.db2.gz SABMBQQQIHEASN-DGCLKSJQSA-N 0 0 369.343 3.975 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(Cc2noc(C3(Oc4ccccc4)CC3)n2)c1 ZINC000421273271 942463838 /nfs/dbraw/zinc/46/38/38/942463838.db2.gz YQNGEUYUEYVIJS-UHFFFAOYSA-N 0 0 367.361 3.645 20 5 FHBDRN COc1ccccc1[C@H](NC(=O)c1cccc([N+](=O)[O-])c1F)c1ccco1 ZINC000366490102 942465344 /nfs/dbraw/zinc/46/53/44/942465344.db2.gz NCGBNIJACWFFPV-SFHVURJKSA-N 0 0 370.336 3.855 20 5 FHBDRN O=[N+]([O-])c1ccc2ccnc(N3CCO[C@@]4(CCc5ccccc54)C3)c2c1 ZINC000413204980 942477204 /nfs/dbraw/zinc/47/72/04/942477204.db2.gz PCCDHDNEGWVUOI-NRFANRHFSA-N 0 0 361.401 3.821 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCO[C@@H](c3ccccc3F)C2)c2ncccc12 ZINC000066814348 942498199 /nfs/dbraw/zinc/49/81/99/942498199.db2.gz WMDIYAVZUGJYGS-GOSISDBHSA-N 0 0 353.353 3.860 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CCC(F)(c2cccnc2)CC1 ZINC000412336535 942502013 /nfs/dbraw/zinc/50/20/13/942502013.db2.gz INBKIPVGAXSJJK-ZWKOTPCHSA-N 0 0 369.396 3.581 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC[C@@H]1c1cc(C)on1 ZINC000366903225 942509721 /nfs/dbraw/zinc/50/97/21/942509721.db2.gz NRODXSFPGMRBQJ-OAHLLOKOSA-N 0 0 360.370 3.659 20 5 FHBDRN CSCc1ccc(CNC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)cc1 ZINC000412339687 942514412 /nfs/dbraw/zinc/51/44/12/942514412.db2.gz QBGCMFNJTRPRCG-ZWKOTPCHSA-N 0 0 356.447 3.878 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1C(F)(F)F)N1CCC[C@H](OCC2CC2)C1 ZINC000501522279 942523432 /nfs/dbraw/zinc/52/34/32/942523432.db2.gz YRVQRHGJHSNUDL-ZDUSSCGKSA-N 0 0 372.343 3.645 20 5 FHBDRN Cc1cccc2nc(C3CCN(c4ncc([N+](=O)[O-])cc4F)CC3)oc21 ZINC000413235160 942539198 /nfs/dbraw/zinc/53/91/98/942539198.db2.gz APUAODTWYKPLRR-UHFFFAOYSA-N 0 0 356.357 3.963 20 5 FHBDRN CC[C@H](NC(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-])c1cc(F)ccc1F ZINC000434246494 942545516 /nfs/dbraw/zinc/54/55/16/942545516.db2.gz SVDPZINHIDMHEE-LBPRGKRZSA-N 0 0 352.341 3.601 20 5 FHBDRN COc1cccc(C2=CCN(C(=O)c3ccc(Cl)cc3[N+](=O)[O-])C2)c1 ZINC000501551876 942545958 /nfs/dbraw/zinc/54/59/58/942545958.db2.gz IAWXCTIOAZLACM-UHFFFAOYSA-N 0 0 358.781 3.796 20 5 FHBDRN CCOc1ccc(OC)cc1NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000120212361 942546307 /nfs/dbraw/zinc/54/63/07/942546307.db2.gz RWMJASPVEWRNKB-UHFFFAOYSA-N 0 0 350.758 3.908 20 5 FHBDRN Cc1ccccc1C1=CCN(C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)C1 ZINC000501555149 942546379 /nfs/dbraw/zinc/54/63/79/942546379.db2.gz NLVXECQCEPULLL-UHFFFAOYSA-N 0 0 374.400 3.628 20 5 FHBDRN COc1ccc(CCCc2nc(-c3cccc([N+](=O)[O-])c3)no2)c(OC)c1 ZINC000513831985 942547149 /nfs/dbraw/zinc/54/71/49/942547149.db2.gz BKOVUHSOBFHJGW-UHFFFAOYSA-N 0 0 369.377 3.837 20 5 FHBDRN O=C(Cc1csc(-c2ccoc2)n1)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000513832245 942547468 /nfs/dbraw/zinc/54/74/68/942547468.db2.gz GDJLTEVTQBTXBG-UHFFFAOYSA-N 0 0 369.402 3.833 20 5 FHBDRN CCO[C@@H](C)c1ncc(C(=O)N2CCCc3c([N+](=O)[O-])cccc32)s1 ZINC000513841091 942553100 /nfs/dbraw/zinc/55/31/00/942553100.db2.gz LXDOMLCBELZSCL-NSHDSACASA-N 0 0 361.423 3.742 20 5 FHBDRN C[C@H](CNC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1)CC(F)(F)F ZINC000413750202 942554135 /nfs/dbraw/zinc/55/41/35/942554135.db2.gz RQWZBNWMWINEKD-NSHDSACASA-N 0 0 359.348 3.857 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)Nc1ccc(N2CCCCC2)nc1 ZINC000421415416 942561572 /nfs/dbraw/zinc/56/15/72/942561572.db2.gz CCFOZIYGGUBICY-UHFFFAOYSA-N 0 0 354.410 3.849 20 5 FHBDRN CCCc1c(C(=O)NCCc2cccc([N+](=O)[O-])c2)cnn1C1CCCC1 ZINC000541298013 942561703 /nfs/dbraw/zinc/56/17/03/942561703.db2.gz PWGWRNFEWUUZQL-UHFFFAOYSA-N 0 0 370.453 3.831 20 5 FHBDRN CN(C)c1ccc(COC(=O)C2(Cc3ccccc3)CC2)cc1[N+](=O)[O-] ZINC001268937755 942572608 /nfs/dbraw/zinc/57/26/08/942572608.db2.gz WJZHOJARORKPBV-UHFFFAOYSA-N 0 0 354.406 3.727 20 5 FHBDRN O=[N+]([O-])c1ccc(NC2CCN(c3nccs3)CC2)c2cccnc21 ZINC000413262776 942574502 /nfs/dbraw/zinc/57/45/02/942574502.db2.gz GIBPXDQQTBCSHH-UHFFFAOYSA-N 0 0 355.423 3.680 20 5 FHBDRN CN(C)c1ccc(COC(=O)c2ccc(OC3CCC3)cc2)cc1[N+](=O)[O-] ZINC001268943404 942576887 /nfs/dbraw/zinc/57/68/87/942576887.db2.gz ZMAJDVRXLQBXRW-UHFFFAOYSA-N 0 0 370.405 3.949 20 5 FHBDRN Cc1nc(-c2ccccc2)sc1[C@H](C)NC(=O)c1ccc([N+](=O)[O-])n1C ZINC000501633667 942582684 /nfs/dbraw/zinc/58/26/84/942582684.db2.gz XCSVGZYATIBDAW-NSHDSACASA-N 0 0 370.434 3.856 20 5 FHBDRN COc1cccc2c1CCCCN2C(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000513900899 942588775 /nfs/dbraw/zinc/58/87/75/942588775.db2.gz IOWNWQVXTJGRCU-UHFFFAOYSA-N 0 0 354.406 3.906 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNc1ccccc1C(=O)NC(C)(C)C ZINC000063468566 942592821 /nfs/dbraw/zinc/59/28/21/942592821.db2.gz JOANQJWKRGKTOJ-UHFFFAOYSA-N 0 0 357.410 3.744 20 5 FHBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc2ccsc21 ZINC000501662605 942592981 /nfs/dbraw/zinc/59/29/81/942592981.db2.gz FCXPTNRHXWFKDX-LLVKDONJSA-N 0 0 369.402 3.567 20 5 FHBDRN CC(C)n1ncc2c1C[C@H](Nc1ncc([N+](=O)[O-])cc1C(F)(F)F)CC2 ZINC000413271612 942595077 /nfs/dbraw/zinc/59/50/77/942595077.db2.gz WYWSUUMOVNYWSJ-LLVKDONJSA-N 0 0 369.347 3.755 20 5 FHBDRN O=C(c1cc(-n2cccc2)ccn1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000501671926 942603423 /nfs/dbraw/zinc/60/34/23/942603423.db2.gz IVAFDEANZIGSPA-UHFFFAOYSA-N 0 0 362.389 3.585 20 5 FHBDRN O=[N+]([O-])c1cnc(N[C@@H](c2cncc(Br)c2)C2CC2)c(F)c1 ZINC000413284849 942604602 /nfs/dbraw/zinc/60/46/02/942604602.db2.gz BOZWRNHBVLWRQK-CYBMUJFWSA-N 0 0 367.178 3.850 20 5 FHBDRN C[C@H](NC(=O)Nc1ccncc1[N+](=O)[O-])c1ccc(OC(F)(F)F)cc1 ZINC000183575210 942619337 /nfs/dbraw/zinc/61/93/37/942619337.db2.gz RRRDHVMWTXKKEM-VIFPVBQESA-N 0 0 370.287 3.771 20 5 FHBDRN O=C(c1cc(F)cc([N+](=O)[O-])c1)N(Cc1ccco1)Cc1ccc(O)cc1 ZINC000502657182 942622951 /nfs/dbraw/zinc/62/29/51/942622951.db2.gz ZLNHCWKIIUGUPS-UHFFFAOYSA-N 0 0 370.336 3.875 20 5 FHBDRN Cc1n[nH]c(C(=O)N2CCc3cc(Cl)cc(Cl)c3[C@@H]2C)c1[N+](=O)[O-] ZINC000434373141 942627349 /nfs/dbraw/zinc/62/73/49/942627349.db2.gz YPIFCVJEGJCCEA-QMMMGPOBSA-N 0 0 369.208 3.693 20 5 FHBDRN COC(=O)c1ccc(C(F)(F)F)cc1NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000501707315 942631570 /nfs/dbraw/zinc/63/15/70/942631570.db2.gz GVPMAYFTKSGHNM-UHFFFAOYSA-N 0 0 368.267 3.653 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCC[C@]2(C1)OCc1ccccc12 ZINC000421540445 942635038 /nfs/dbraw/zinc/63/50/38/942635038.db2.gz ZRRAYINRSAKYGP-OAQYLSRUSA-N 0 0 366.417 3.873 20 5 FHBDRN C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])c(F)cc2N)CC[C@H]1c1ccccc1 ZINC000366980909 942642303 /nfs/dbraw/zinc/64/23/03/942642303.db2.gz IIBZYVLFFRDIBM-TZMCWYRMSA-N 0 0 357.385 3.582 20 5 FHBDRN C[C@H](NC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1)C(C)(F)F ZINC000452466165 942643029 /nfs/dbraw/zinc/64/30/29/942643029.db2.gz SOBOPTJDFKYJRQ-LBPRGKRZSA-N 0 0 355.385 3.605 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)NC(C)(C)c2ccccc2C)c1F ZINC000413822992 942649449 /nfs/dbraw/zinc/64/94/49/942649449.db2.gz YROBLGNIAVUFSA-UHFFFAOYSA-N 0 0 360.385 3.645 20 5 FHBDRN COc1cccc(C2(F)CCN(C(=O)c3ccc([N+](=O)[O-])s3)CC2)c1 ZINC000366991698 942652370 /nfs/dbraw/zinc/65/23/70/942652370.db2.gz UFIZHRWAASOBSE-UHFFFAOYSA-N 0 0 364.398 3.766 20 5 FHBDRN O=[N+]([O-])c1ccc(N[C@@H]2CCO[C@H](c3ccncc3)C2)c2cccnc21 ZINC000413319172 942658783 /nfs/dbraw/zinc/65/87/83/942658783.db2.gz OFKCRQLUIHQZKY-KDOFPFPSSA-N 0 0 350.378 3.870 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CC2(CCC2)[C@@H]1[C@H]1CCCO1 ZINC000365778547 942660888 /nfs/dbraw/zinc/66/08/88/942660888.db2.gz ANLMEKYHGRIVEL-QRQLOZEOSA-N 0 0 372.465 3.724 20 5 FHBDRN O=C(N[C@@H]1CCOc2c(F)ccc(F)c21)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412358979 942663053 /nfs/dbraw/zinc/66/30/53/942663053.db2.gz QAQLHMWQVKXQMQ-WOSRLPQWSA-N 0 0 374.343 3.617 20 5 FHBDRN O=[N+]([O-])c1cnc(N[C@@H]2CCO[C@H](c3ccncc3)C2)c(C(F)(F)F)c1 ZINC000413325487 942664901 /nfs/dbraw/zinc/66/49/01/942664901.db2.gz VSONDPDGQAZWFD-RISCZKNCSA-N 0 0 368.315 3.736 20 5 FHBDRN O=C(N[C@H](CO)CC1CCCCC1)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000416326769 942665146 /nfs/dbraw/zinc/66/51/46/942665146.db2.gz NFWZVMCUEZFJAD-LBPRGKRZSA-N 0 0 374.359 3.675 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N[C@H](C)[C@H]1OCCc2sccc21 ZINC000421574072 942666562 /nfs/dbraw/zinc/66/65/62/942666562.db2.gz KNNJZNCLKZGXBI-SJKOYZFVSA-N 0 0 360.435 3.705 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCO[C@H](c3cccc(F)c3)C2)c2ccncc21 ZINC000066815085 942667831 /nfs/dbraw/zinc/66/78/31/942667831.db2.gz LESYESFHIYPEIC-IBGZPJMESA-N 0 0 353.353 3.860 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N[C@@H](CO)CC1CCCCC1 ZINC000416327988 942668499 /nfs/dbraw/zinc/66/84/99/942668499.db2.gz QYJHDANVZCKLAJ-CQSZACIVSA-N 0 0 354.834 3.618 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)NCc1oc2ccc(F)cc2c1C ZINC000501788584 942673199 /nfs/dbraw/zinc/67/31/99/942673199.db2.gz IAZMDRWZDHPCLA-UHFFFAOYSA-N 0 0 358.325 3.727 20 5 FHBDRN O=C(NC[C@@H]1CC12CCSCC2)c1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC000421597351 942678963 /nfs/dbraw/zinc/67/89/63/942678963.db2.gz VAFPKRBWLWKDOF-NSHDSACASA-N 0 0 374.384 3.877 20 5 FHBDRN C[C@H]1CN(C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)Cc2ccccc2O1 ZINC000412370622 942683296 /nfs/dbraw/zinc/68/32/96/942683296.db2.gz XJKRYQJKQLLHRH-DOPJRALCSA-N 0 0 352.390 3.508 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N1CC2(CCCC2)c2c1cccc2F ZINC000501803357 942684230 /nfs/dbraw/zinc/68/42/30/942684230.db2.gz DHPBPGQENXLNJX-UHFFFAOYSA-N 0 0 370.380 3.971 20 5 FHBDRN O=C(NC[C@@H]1CC12CCSCC2)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000421588426 942684685 /nfs/dbraw/zinc/68/46/85/942684685.db2.gz JFUBQVDFYHHIFR-LBPRGKRZSA-N 0 0 374.384 3.877 20 5 FHBDRN O=C(N[C@H]1CCCOc2c(F)cccc21)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000183317450 942695940 /nfs/dbraw/zinc/69/59/40/942695940.db2.gz GZRGTAIRSIIYJM-KRWDZBQOSA-N 0 0 369.352 3.859 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1C[S@@](C)=O ZINC000183619713 942698219 /nfs/dbraw/zinc/69/82/19/942698219.db2.gz SMHWOESYOTZYTO-PVPMGCCUSA-N 0 0 374.462 3.681 20 5 FHBDRN C[C@H](C(=O)N[C@@H]1c2ccc(F)cc2O[C@@H]1C)c1ccc([N+](=O)[O-])cc1F ZINC000519021546 942699559 /nfs/dbraw/zinc/69/95/59/942699559.db2.gz OOFMVHCMVKVZEV-GBNMTWHSSA-N 0 0 362.332 3.615 20 5 FHBDRN CC(=O)Nc1ccc(C)cc1NC(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1 ZINC000413345838 942701991 /nfs/dbraw/zinc/70/19/91/942701991.db2.gz GPSOJPLKYUWJFD-UHFFFAOYSA-N 0 0 371.393 3.901 20 5 FHBDRN Cc1nc(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)c2n1CCCC2 ZINC000378393559 942702373 /nfs/dbraw/zinc/70/23/73/942702373.db2.gz HNKGGPMIWTXCEI-UHFFFAOYSA-N 0 0 366.421 3.986 20 5 FHBDRN COc1cc(NC(=O)Nc2ccc([N+](=O)[O-])c(C)c2)cc(OC)c1OC ZINC000514069034 942713920 /nfs/dbraw/zinc/71/39/20/942713920.db2.gz UOZODGOBLXTPQJ-UHFFFAOYSA-N 0 0 361.354 3.573 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1Cc1nc([C@H]2CCC(C)(C)c3ccccc32)no1 ZINC000420512150 942716969 /nfs/dbraw/zinc/71/69/69/942716969.db2.gz VSUQFNJOCVRJHU-AWEZNQCLSA-N 0 0 367.409 3.734 20 5 FHBDRN O=[N+]([O-])c1c2cccnc2ccc1N1CCc2c(cnn2-c2ccccc2)C1 ZINC000502756578 942720895 /nfs/dbraw/zinc/72/08/95/942720895.db2.gz LVLOONLSOAYJJO-UHFFFAOYSA-N 0 0 371.400 3.891 20 5 FHBDRN CC(C)(CNC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1)c1cccnc1 ZINC000413887977 942725293 /nfs/dbraw/zinc/72/52/93/942725293.db2.gz JKHIQSNCFBEDPM-UHFFFAOYSA-N 0 0 356.426 3.502 20 5 FHBDRN CC[C@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2SC(C)C)CCO1 ZINC000421673023 942736650 /nfs/dbraw/zinc/73/66/50/942736650.db2.gz WHPMVUAFCUSIEC-JSGCOSHPSA-N 0 0 352.456 3.783 20 5 FHBDRN O=[N+]([O-])c1ccc(N[C@H](CO)c2ccc(Br)cc2)c(F)c1 ZINC000502792594 942745916 /nfs/dbraw/zinc/74/59/16/942745916.db2.gz HUZTYNBIQAESKC-CQSZACIVSA-N 0 0 355.163 3.642 20 5 FHBDRN Cc1nn(CCC(=O)N(C(C)C)[C@H](C)c2ccsc2)c(C)c1[N+](=O)[O-] ZINC000421689211 942746570 /nfs/dbraw/zinc/74/65/70/942746570.db2.gz JJZDRTLFXMSSGE-CYBMUJFWSA-N 0 0 364.471 3.858 20 5 FHBDRN Cn1ccnc1[C@@H](NCCc1c(F)cccc1F)c1cccc([N+](=O)[O-])c1 ZINC000514104374 942748256 /nfs/dbraw/zinc/74/82/56/942748256.db2.gz JKBKONHSAHYSRE-SFHVURJKSA-N 0 0 372.375 3.528 20 5 FHBDRN CCn1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2SC(C)C)c1=O ZINC000413900287 942756550 /nfs/dbraw/zinc/75/65/50/942756550.db2.gz ZFQHVSYSKARJCX-UHFFFAOYSA-N 0 0 361.423 3.529 20 5 FHBDRN COc1ccc(NC(=O)[C@@H](C)N2C[C@@H](C)c3ccccc32)c([N+](=O)[O-])c1 ZINC000434569262 942762039 /nfs/dbraw/zinc/76/20/39/942762039.db2.gz FLEWQXOYXBRVLI-CHWSQXEVSA-N 0 0 355.394 3.554 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1ccc([C@@H]2CCCOC2)cc1 ZINC000502808989 942762134 /nfs/dbraw/zinc/76/21/34/942762134.db2.gz IGAUJJUGQCMGOV-GOSISDBHSA-N 0 0 354.406 3.761 20 5 FHBDRN Cc1cc(NC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)cn2ccnc12 ZINC000502810116 942762733 /nfs/dbraw/zinc/76/27/33/942762733.db2.gz FPJPZTZOAJAJTQ-UHFFFAOYSA-N 0 0 368.396 3.890 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1F)Nc1ccc2c(c1)C(=O)CCCC2 ZINC000421711168 942763568 /nfs/dbraw/zinc/76/35/68/942763568.db2.gz AMARKMAXOOVMGR-UHFFFAOYSA-N 0 0 356.353 3.824 20 5 FHBDRN O=C(c1ccc2[nH]c3ccccc3c(=O)c2c1)N1CCCC[C@H]1C(F)F ZINC000505430905 942767098 /nfs/dbraw/zinc/76/70/98/942767098.db2.gz KNDYJGZDUGUCDS-KRWDZBQOSA-N 0 0 356.372 3.941 20 5 FHBDRN O=C(c1ccc2[nH]c3ccccc3c(=O)c2c1)N1CCCC[C@@H]1C(F)F ZINC000505430906 942767150 /nfs/dbraw/zinc/76/71/50/942767150.db2.gz KNDYJGZDUGUCDS-QGZVFWFLSA-N 0 0 356.372 3.941 20 5 FHBDRN CCOC(=O)c1ccc(F)c(C)c1NC(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000505434635 942778226 /nfs/dbraw/zinc/77/82/26/942778226.db2.gz NYCGRAXDZULKEE-UHFFFAOYSA-N 0 0 374.368 3.790 20 5 FHBDRN COc1cc(CN2CCCC[C@@H]2C(F)F)c([N+](=O)[O-])cc1OC(F)F ZINC000502831087 942784451 /nfs/dbraw/zinc/78/44/51/942784451.db2.gz QKGHJQGNWZMNOJ-SNVBAGLBSA-N 0 0 366.311 3.824 20 5 FHBDRN CCn1c2ccccc2c2cc(NC(=O)Cn3nccc3[N+](=O)[O-])ccc21 ZINC000502854354 942798861 /nfs/dbraw/zinc/79/88/61/942798861.db2.gz DWSSLBZVASYHKI-UHFFFAOYSA-N 0 0 363.377 3.558 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H](O)[C@H]1c1ccc(Cl)cc1 ZINC000425107248 942800940 /nfs/dbraw/zinc/80/09/40/942800940.db2.gz MWYVZFJTILJJRS-IAGOWNOFSA-N 0 0 360.797 3.505 20 5 FHBDRN Cc1ccc(N[C@@H](CO)c2cccc(Br)c2)c([N+](=O)[O-])c1 ZINC000514176551 942802403 /nfs/dbraw/zinc/80/24/03/942802403.db2.gz RKCOEUXUTBRUHM-AWEZNQCLSA-N 0 0 351.200 3.811 20 5 FHBDRN Cc1ccc(C[C@H](C)NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)s1 ZINC000514178622 942804242 /nfs/dbraw/zinc/80/42/42/942804242.db2.gz OLYDMVOOEAMMIH-VIFPVBQESA-N 0 0 370.377 3.927 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N(C)Cc1nc2c(s1)CCCC2 ZINC000421777715 942805651 /nfs/dbraw/zinc/80/56/51/942805651.db2.gz BFGAZUYLLFEFJD-UHFFFAOYSA-N 0 0 359.451 3.819 20 5 FHBDRN O=C(c1ccc(OC2CCCC2)nc1)N1CCc2c1cccc2[N+](=O)[O-] ZINC000514195490 942806939 /nfs/dbraw/zinc/80/69/39/942806939.db2.gz QZCBUTXINCIHGK-UHFFFAOYSA-N 0 0 353.378 3.514 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NC[C@@H](c1ccccc1)C(C)(C)CO ZINC000421785893 942810150 /nfs/dbraw/zinc/81/01/50/942810150.db2.gz ONMPUUIMOGOCEX-SFHVURJKSA-N 0 0 370.449 3.744 20 5 FHBDRN COc1cc(OC)cc(N2CCCN(c3ccc([N+](=O)[O-])c(C)c3)CC2)c1 ZINC000514187766 942813731 /nfs/dbraw/zinc/81/37/31/942813731.db2.gz VKYWTLKJROBNQC-UHFFFAOYSA-N 0 0 371.437 3.637 20 5 FHBDRN CO[C@@](C)([C@H](C)NC(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-])C1CC1 ZINC000413958002 942819568 /nfs/dbraw/zinc/81/95/68/942819568.db2.gz OBVXAFQVCXOIIJ-RBZFPXEDSA-N 0 0 369.421 3.590 20 5 FHBDRN CCO[C@H](C(=O)Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1)c1ccccc1 ZINC000104874600 942820112 /nfs/dbraw/zinc/82/01/12/942820112.db2.gz GTOBYTUJLHVHQP-SFHVURJKSA-N 0 0 366.377 3.701 20 5 FHBDRN Cc1nn(Cc2nc3cc(Cl)ccc3n2C)c2ccc([N+](=O)[O-])cc12 ZINC000502898025 942825855 /nfs/dbraw/zinc/82/58/55/942825855.db2.gz DCHWUSQEHXHEGA-UHFFFAOYSA-N 0 0 355.785 3.841 20 5 FHBDRN O=C(N[C@H]1C[C@H]1C1CCCCC1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514218924 942827389 /nfs/dbraw/zinc/82/73/89/942827389.db2.gz PDSZMTXKMPDFKT-STQMWFEESA-N 0 0 354.353 3.895 20 5 FHBDRN CCS[C@@H]1CCCCN(C(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)C1 ZINC000514219826 942828241 /nfs/dbraw/zinc/82/82/41/942828241.db2.gz VRURJFVEHDJPIK-GFCCVEGCSA-N 0 0 374.409 3.944 20 5 FHBDRN O=[N+]([O-])c1cc(F)c(CS(=O)(=O)c2ccc3c(c2)CCCC3)c(F)c1 ZINC000421813666 942842243 /nfs/dbraw/zinc/84/22/43/942842243.db2.gz OLWZKKQRNFGNTD-UHFFFAOYSA-N 0 0 367.373 3.726 20 5 FHBDRN O=C(Nc1ccc(-c2ccccn2)cn1)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000367096770 942842938 /nfs/dbraw/zinc/84/29/38/942842938.db2.gz RLRGDLGWQQJPLJ-UHFFFAOYSA-N 0 0 354.753 3.958 20 5 FHBDRN CCc1cccc(CSc2ccc([N+](=O)[O-])c(S(C)(=O)=O)c2)c1 ZINC000190185111 942849016 /nfs/dbraw/zinc/84/90/16/942849016.db2.gz DBOBIIIFKLNTCL-UHFFFAOYSA-N 0 0 351.449 3.853 20 5 FHBDRN COc1ccc(OCC(=O)Nc2c(C)cc(C)cc2Cl)cc1[N+](=O)[O-] ZINC000190188299 942849896 /nfs/dbraw/zinc/84/98/96/942849896.db2.gz XHSNLFIJKUJIHX-UHFFFAOYSA-N 0 0 364.785 3.891 20 5 FHBDRN COc1ccc(-c2nc(COc3ccc(OC)c([N+](=O)[O-])c3)co2)cc1 ZINC000190190295 942849982 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20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1OC(=O)c1cc(-c2ccc3c(c2)CCO3)no1 ZINC000760016236 942867273 /nfs/dbraw/zinc/86/72/73/942867273.db2.gz KMFKHPBZDLJQJP-UHFFFAOYSA-N 0 0 366.329 3.712 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc([C@H](C)C(=O)OC)cc1 ZINC000413992945 942873449 /nfs/dbraw/zinc/87/34/49/942873449.db2.gz PSSVQEGPGASPPV-LBPRGKRZSA-N 0 0 372.377 3.522 20 5 FHBDRN Cc1ccc(NC(=O)N(C)C)cc1NC(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC000421895027 942875485 /nfs/dbraw/zinc/87/54/85/942875485.db2.gz VICIYIHIUUIQKL-UHFFFAOYSA-N 0 0 370.409 3.866 20 5 FHBDRN COc1ccc(C(=O)OCc2ccc(C(F)(F)F)cc2)cc1[N+](=O)[O-] ZINC000016583527 942880280 /nfs/dbraw/zinc/88/02/80/942880280.db2.gz ABERAVUOEMDZNN-UHFFFAOYSA-N 0 0 355.268 3.979 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CCC[C@@H](CC(F)(F)F)C1 ZINC000421941819 942897301 /nfs/dbraw/zinc/89/73/01/942897301.db2.gz CAEOCFQJRJVJQK-TUKIKUTGSA-N 0 0 356.344 3.889 20 5 FHBDRN CC(C)c1ccc2nc(CCNc3ccccc3[N+](=O)[O-])[nH]c(=O)c2c1 ZINC000122957045 942920987 /nfs/dbraw/zinc/92/09/87/942920987.db2.gz KIOFJAUVTFYCSF-UHFFFAOYSA-N 0 0 352.394 3.609 20 5 FHBDRN CC[C@H]1CN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])C[C@H](CC)O1 ZINC000421990010 942922640 /nfs/dbraw/zinc/92/26/40/942922640.db2.gz WNCZBWFONSQFNO-RYUDHWBXSA-N 0 0 360.332 3.643 20 5 FHBDRN CN([C@H]1CCC[C@H]1c1ccccc1)S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000416547669 942937716 /nfs/dbraw/zinc/93/77/16/942937716.db2.gz WBYABGROCWPYJH-OALUTQOASA-N 0 0 374.462 3.693 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2nc(Cn3ccc(-c4nccs4)n3)co2)cc1 ZINC000434737134 942942677 /nfs/dbraw/zinc/94/26/77/942942677.db2.gz JKBCABWPYAXHRT-UHFFFAOYSA-N 0 0 353.363 3.618 20 5 FHBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1COc1ccc(-c2ncnn2C)cc1 ZINC000190218184 942948616 /nfs/dbraw/zinc/94/86/16/942948616.db2.gz AMNVJCPUTDDHAZ-UHFFFAOYSA-N 0 0 368.393 3.757 20 5 FHBDRN Cc1cc(S(=O)(=O)N(C)Cc2cc(Cl)ccc2F)ccc1[N+](=O)[O-] ZINC000434780422 942957007 /nfs/dbraw/zinc/95/70/07/942957007.db2.gz YGIOWYBJTAAMRF-UHFFFAOYSA-N 0 0 372.805 3.516 20 5 FHBDRN Cc1cn(C2CCCCC2)nc1NC(=O)Nc1ccc([N+](=O)[O-])cc1F ZINC000434788201 942966043 /nfs/dbraw/zinc/96/60/43/942966043.db2.gz WHHHHSKVBFGWSS-UHFFFAOYSA-N 0 0 361.377 3.810 20 5 FHBDRN O=C(NCCCC1CCCC1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000514383864 942974673 /nfs/dbraw/zinc/97/46/73/942974673.db2.gz JXVLBSCNPPAGDU-UHFFFAOYSA-N 0 0 359.470 3.898 20 5 FHBDRN O=C(Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1)[C@@H]1[C@@H]2CCCO[C@H]12 ZINC000503135946 943003453 /nfs/dbraw/zinc/00/34/53/943003453.db2.gz ZVKYVJZAXLVHQR-KSZLIROESA-N 0 0 354.362 3.751 20 5 FHBDRN O=C(NCCCO[C@H]1CCCc2ccccc21)c1ccc([N+](=O)[O-])s1 ZINC000505544857 943003714 /nfs/dbraw/zinc/00/37/14/943003714.db2.gz JQPBWHATLAFPFI-HNNXBMFYSA-N 0 0 360.435 3.870 20 5 FHBDRN O=C(Nc1ncc(C2CCOCC2)s1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412385508 943020065 /nfs/dbraw/zinc/02/00/65/943020065.db2.gz RBCNCZFYNYWTJP-LSDHHAIUSA-N 0 0 373.434 3.688 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CC(c2cccc(Cl)c2)C1 ZINC000412390077 943021764 /nfs/dbraw/zinc/02/17/64/943021764.db2.gz UJMJMLOSDKMDQZ-ZWKOTPCHSA-N 0 0 356.809 3.978 20 5 FHBDRN COc1cc(C(=O)N2CC(c3cccc(Cl)c3)C2)cc([N+](=O)[O-])c1C ZINC000412390998 943023266 /nfs/dbraw/zinc/02/32/66/943023266.db2.gz XELRPPYMNSUJQN-UHFFFAOYSA-N 0 0 360.797 3.805 20 5 FHBDRN CCc1ncncc1C(=O)Nc1nc(-c2ccc(C)c([N+](=O)[O-])c2)cs1 ZINC000514454077 943029682 /nfs/dbraw/zinc/02/96/82/943029682.db2.gz AHKQAKGDLWMVAX-UHFFFAOYSA-N 0 0 369.406 3.631 20 5 FHBDRN Cc1cc(NC(=O)c2cnn(CC(C)C)c2)c2cc([N+](=O)[O-])ccc2n1 ZINC000183692483 943034766 /nfs/dbraw/zinc/03/47/66/943034766.db2.gz ABBOSGZFAQCYNS-UHFFFAOYSA-N 0 0 353.382 3.556 20 5 FHBDRN CC(C)[C@H]1CCC[C@H](NC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)CC1 ZINC000183886657 943065370 /nfs/dbraw/zinc/06/53/70/943065370.db2.gz VOAQVYNZNCEJAY-KBPBESRZSA-N 0 0 371.437 3.771 20 5 FHBDRN CSc1ccc(C(=O)Nc2ccnn2-c2cccc(F)c2)cc1[N+](=O)[O-] ZINC000183889484 943069341 /nfs/dbraw/zinc/06/93/41/943069341.db2.gz YJXDIOWWCUCCEQ-UHFFFAOYSA-N 0 0 372.381 3.894 20 5 FHBDRN COc1ccccc1CN(C)Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000505584739 943075069 /nfs/dbraw/zinc/07/50/69/943075069.db2.gz IRQXWANPOPQSAL-UHFFFAOYSA-N 0 0 352.337 3.837 20 5 FHBDRN C[C@H](Cn1ccc2ccccc21)C(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000505586763 943087893 /nfs/dbraw/zinc/08/78/93/943087893.db2.gz VMOSESVZEJZAKY-OAHLLOKOSA-N 0 0 351.406 3.844 20 5 FHBDRN Cc1cc(Nc2ccc(C(N)=O)cc2[N+](=O)[O-])cnc1N1CCCC[C@H]1C ZINC000503279139 943096999 /nfs/dbraw/zinc/09/69/99/943096999.db2.gz HKCXSJKSONMZHR-CYBMUJFWSA-N 0 0 369.425 3.520 20 5 FHBDRN O=C(NCc1ncc(-c2ccccc2)cn1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000183915342 943097098 /nfs/dbraw/zinc/09/70/98/943097098.db2.gz VHTVTXXFHWYQAD-UHFFFAOYSA-N 0 0 368.780 3.635 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1Cl)N1C[C@H]2CCCN2c2ccccc21 ZINC000514559049 943102620 /nfs/dbraw/zinc/10/26/20/943102620.db2.gz QUJQSOSSWZJKKM-CYBMUJFWSA-N 0 0 357.797 3.877 20 5 FHBDRN CCC1CCN(C(=O)c2cc([N+](=O)[O-])ccc2SCCOC)CC1 ZINC000137205478 943103152 /nfs/dbraw/zinc/10/31/52/943103152.db2.gz VNEMYAQBAZZXHV-UHFFFAOYSA-N 0 0 352.456 3.596 20 5 FHBDRN O=[N+]([O-])c1ccc(CSC[C@H](O)COc2ccc(Cl)cc2)cc1 ZINC000513786732 943109373 /nfs/dbraw/zinc/10/93/73/943109373.db2.gz MKRIVRQKIWXLJG-OAHLLOKOSA-N 0 0 353.827 3.921 20 5 FHBDRN Cc1[nH]c2ccccc2c1CC(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000183749589 943110152 /nfs/dbraw/zinc/11/01/52/943110152.db2.gz ZRJHWWWOQHKEKP-UHFFFAOYSA-N 0 0 357.797 3.897 20 5 FHBDRN NC(=O)c1ccc(CSc2ccc(Br)cc2)c([N+](=O)[O-])c1 ZINC000016750845 943113397 /nfs/dbraw/zinc/11/33/97/943113397.db2.gz JGSAIXRHZZLZFX-UHFFFAOYSA-N 0 0 367.224 3.749 20 5 FHBDRN C[C@@H](NC(=O)N(C)CCc1cccc([N+](=O)[O-])c1)c1ccc(F)cc1F ZINC000511584024 943117977 /nfs/dbraw/zinc/11/79/77/943117977.db2.gz CKDZOHXVVRTGCM-GFCCVEGCSA-N 0 0 363.364 3.818 20 5 FHBDRN CC(C)N(Cc1cnn(C)c1C(F)(F)F)Cc1ccc([N+](=O)[O-])cc1 ZINC000133665263 943120125 /nfs/dbraw/zinc/12/01/25/943120125.db2.gz VSJNTSPRAVQZLA-UHFFFAOYSA-N 0 0 356.348 3.758 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CC(=O)c1cc(N2CC[C@@H](O)[C@H]2c2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000425286539 943205182 /nfs/dbraw/zinc/20/51/82/943205182.db2.gz UNKGAWGXRYKVAI-QZTJIDSGSA-N 0 0 360.797 3.763 20 5 FHBDRN O=[N+]([O-])c1cccc2c1CC[C@H]2Nc1cc(F)cc(N2CCOCC2)c1 ZINC000514738841 943251781 /nfs/dbraw/zinc/25/17/81/943251781.db2.gz LHHFDUUZUMGCCC-GOSISDBHSA-N 0 0 357.385 3.670 20 5 FHBDRN CCc1ccc([C@@H]2CCN(C(=O)NCCc3ccccc3[N+](=O)[O-])C2)cc1 ZINC000431912150 943253793 /nfs/dbraw/zinc/25/37/93/943253793.db2.gz LMNZBQGRXXQBLA-LJQANCHMSA-N 0 0 367.449 3.899 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1C[C@H](O)C[C@@H]1c1ccccc1 ZINC000416996166 943279781 /nfs/dbraw/zinc/27/97/81/943279781.db2.gz IXIARAYEDNXGEB-CRAIPNDOSA-N 0 0 355.394 3.551 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N([C@H](C)C(=O)OC(C)(C)C)C1CC1 ZINC000416995667 943281173 /nfs/dbraw/zinc/28/11/73/943281173.db2.gz LRTXHYNZEXXQJO-GFCCVEGCSA-N 0 0 363.414 3.630 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N[C@H]1CCN(c2ccc(F)cc2)C1 ZINC000417005681 943285914 /nfs/dbraw/zinc/28/59/14/943285914.db2.gz QREOGQRXVSXFTB-HNNXBMFYSA-N 0 0 372.400 3.751 20 5 FHBDRN CCCCCn1cc(CNC(=O)Nc2cc([N+](=O)[O-])ccc2C)c(C)n1 ZINC000503625568 943297430 /nfs/dbraw/zinc/29/74/30/943297430.db2.gz CKLONHNVGVIZHD-UHFFFAOYSA-N 0 0 359.430 3.920 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC(C)(C)[C@@H]1C ZINC000503616744 943302654 /nfs/dbraw/zinc/30/26/54/943302654.db2.gz IJLVFBCEYXAOOL-LBPRGKRZSA-N 0 0 352.456 3.736 20 5 FHBDRN CCN(C(=O)Nc1cc(C(=O)OC)cc([N+](=O)[O-])c1C)C1CC(C)(C)C1 ZINC000417054043 943314119 /nfs/dbraw/zinc/31/41/19/943314119.db2.gz UDLUJLDPXSPBJA-UHFFFAOYSA-N 0 0 363.414 3.732 20 5 FHBDRN CS[C@@H]1CCCCN(C(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000435300805 943320659 /nfs/dbraw/zinc/32/06/59/943320659.db2.gz URELBSSFMSVRGJ-CYBMUJFWSA-N 0 0 372.874 3.761 20 5 FHBDRN Cc1c(NC(=O)NC(C2CC2)C2CC2)cc(Br)cc1[N+](=O)[O-] ZINC000435324955 943325685 /nfs/dbraw/zinc/32/56/85/943325685.db2.gz XYEARYIPBXJFIE-UHFFFAOYSA-N 0 0 368.231 3.976 20 5 FHBDRN COc1cc(C(=O)N[C@H]2c3cc(C)ccc3C[C@H]2C)cc([N+](=O)[O-])c1OC ZINC000503669056 943330827 /nfs/dbraw/zinc/33/08/27/943330827.db2.gz DDNMQXKVZSYJHU-KZULUSFZSA-N 0 0 370.405 3.584 20 5 FHBDRN CSC[C@@H](C)NC(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000435330657 943334045 /nfs/dbraw/zinc/33/40/45/943334045.db2.gz VDLSACJLAUJPCK-SSDOTTSWSA-N 0 0 362.249 3.539 20 5 FHBDRN C[C@@H](OC(=O)/C=C\c1ccccc1Cl)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000215113151 943341521 /nfs/dbraw/zinc/34/15/21/943341521.db2.gz XECPGYCPPPYIOJ-ZWLSGLHFSA-N 0 0 374.780 3.832 20 5 FHBDRN Cn1ncc2c1CCCN(C(=O)Nc1ccc(C(C)(C)C)c([N+](=O)[O-])c1)C2 ZINC000417102014 943350622 /nfs/dbraw/zinc/35/06/22/943350622.db2.gz AGSWXNDVRLVTGB-UHFFFAOYSA-N 0 0 371.441 3.606 20 5 FHBDRN COc1ccccc1[C@@H]1CCCCN1C(=O)c1ccc([N+](=O)[O-])cc1OC ZINC000617375678 943355135 /nfs/dbraw/zinc/35/51/35/943355135.db2.gz WHXDBTVXJPMUJP-KRWDZBQOSA-N 0 0 370.405 3.979 20 5 FHBDRN CCC(C)(C)c1ccc(CNC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)cc1 ZINC000505678407 943365436 /nfs/dbraw/zinc/36/54/36/943365436.db2.gz PTSJGMAVPQQLHE-UHFFFAOYSA-N 0 0 358.442 3.530 20 5 FHBDRN CCCOc1ccc2c(c1)CCN(C(=O)c1cc([N+](=O)[O-])c(C)s1)C2 ZINC000435383442 943370896 /nfs/dbraw/zinc/37/08/96/943370896.db2.gz GQKKAEJRHNSNMJ-UHFFFAOYSA-N 0 0 360.435 3.952 20 5 FHBDRN C[C@H](NC(=O)N[C@@H]1CCCc2cc(N)ccc21)c1cccc([N+](=O)[O-])c1 ZINC000417136909 943374411 /nfs/dbraw/zinc/37/44/11/943374411.db2.gz LNEGHVXIANHRJQ-KPZWWZAWSA-N 0 0 354.410 3.615 20 5 FHBDRN O=C(Nc1ncc(C(F)(F)F)s1)[C@H]1C[C@H]1c1cccc([N+](=O)[O-])c1 ZINC001269446137 943376384 /nfs/dbraw/zinc/37/63/84/943376384.db2.gz WZFODTJSHVRSEP-UWVGGRQHSA-N 0 0 357.313 3.812 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N1Cc2ccc(C(C)=O)cc2C1 ZINC000417155049 943377247 /nfs/dbraw/zinc/37/72/47/943377247.db2.gz QYQMHSATRLJOAK-UHFFFAOYSA-N 0 0 353.378 3.908 20 5 FHBDRN O=C(c1ccc(-c2cc[nH]n2)s1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000431925671 943385272 /nfs/dbraw/zinc/38/52/72/943385272.db2.gz LCKZGWSRWAEGJL-UHFFFAOYSA-N 0 0 368.418 3.851 20 5 FHBDRN CCCc1ccc(C(=O)CCC(=O)NCCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000053217537 943385949 /nfs/dbraw/zinc/38/59/49/943385949.db2.gz LIEMCIKCNDEDCI-UHFFFAOYSA-N 0 0 368.433 3.869 20 5 FHBDRN CCCNC(=O)CNCc1ccc(Sc2ccc(C)cc2)c([N+](=O)[O-])c1 ZINC000236854702 943391271 /nfs/dbraw/zinc/39/12/71/943391271.db2.gz AIEBIBQSCZLCJY-UHFFFAOYSA-N 0 0 373.478 3.670 20 5 FHBDRN Cc1ncccc1OC[C@@H]1CCCN1C(=O)Nc1ccc([N+](=O)[O-])cc1F ZINC000417170688 943393137 /nfs/dbraw/zinc/39/31/37/943393137.db2.gz FVRWTASNVGOIEZ-AWEZNQCLSA-N 0 0 374.372 3.513 20 5 FHBDRN O=C(c1ccc(NC2CC2)c([N+](=O)[O-])c1)N1CCSC2(CCC2)CC1 ZINC000412455169 943398972 /nfs/dbraw/zinc/39/89/72/943398972.db2.gz SKPDCHCLBDPGRC-UHFFFAOYSA-N 0 0 361.467 3.671 20 5 FHBDRN CCNc1ccc(C(=O)N2CCC[C@H]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000514929486 943399874 /nfs/dbraw/zinc/39/98/74/943399874.db2.gz RQGCCBWAPRKRIT-KRWDZBQOSA-N 0 0 353.422 3.874 20 5 FHBDRN Cc1ccc2c(CCNC(=O)c3c[nH]c4cc([N+](=O)[O-])ccc34)c[nH]c2c1 ZINC000503889359 943404498 /nfs/dbraw/zinc/40/44/98/943404498.db2.gz DXCFPYDENFKTEU-UHFFFAOYSA-N 0 0 362.389 3.838 20 5 FHBDRN Cc1ccc(NCCCNC(=O)[C@@H](c2cccnc2)C(C)C)c([N+](=O)[O-])c1 ZINC000435451846 943411014 /nfs/dbraw/zinc/41/10/14/943411014.db2.gz LMRBTGBLLUTFLH-LJQANCHMSA-N 0 0 370.453 3.656 20 5 FHBDRN C[C@@H](c1cccc(Cl)c1)N(C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000053233717 943416452 /nfs/dbraw/zinc/41/64/52/943416452.db2.gz GZCWLQOLZCQSGT-ZDUSSCGKSA-N 0 0 361.829 3.904 20 5 FHBDRN Cc1c(CC(=O)N[C@@H](c2ccccc2)C2CCOCC2)cccc1[N+](=O)[O-] ZINC000366627173 943419874 /nfs/dbraw/zinc/41/98/74/943419874.db2.gz LBWMSVGBWKAZBR-NRFANRHFSA-N 0 0 368.433 3.730 20 5 FHBDRN COc1cc(NC(C)=O)ccc1NC(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000435446233 943422334 /nfs/dbraw/zinc/42/23/34/943422334.db2.gz ARPLJCWUXSCDGS-UHFFFAOYSA-N 0 0 369.333 3.560 20 5 FHBDRN CCC(=O)c1ccc(NCc2ccc(C[S@@](C)=O)cc2)c([N+](=O)[O-])c1 ZINC000514958190 943422405 /nfs/dbraw/zinc/42/24/05/943422405.db2.gz UZEXXZNNGSUVNS-RUZDIDTESA-N 0 0 360.435 3.678 20 5 FHBDRN Cc1cccc(O[C@H]2CCCC[C@H]2NC(=O)c2cc([N+](=O)[O-])cnc2C)c1 ZINC000435458372 943423640 /nfs/dbraw/zinc/42/36/40/943423640.db2.gz PAQWDJQTAKIDOB-MOPGFXCFSA-N 0 0 369.421 3.727 20 5 FHBDRN COc1ccccc1Nc1ncccc1C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000514977811 943428832 /nfs/dbraw/zinc/42/88/32/943428832.db2.gz SHUCQVIYEODMDE-UHFFFAOYSA-N 0 0 364.361 3.994 20 5 FHBDRN CC(C)(NS(=O)(=O)c1cc(F)ccc1Cl)c1ccc([N+](=O)[O-])cc1 ZINC000431928537 943433919 /nfs/dbraw/zinc/43/39/19/943433919.db2.gz WBUNWXHTOMICRP-UHFFFAOYSA-N 0 0 372.805 3.601 20 5 FHBDRN O=[N+]([O-])c1cc(F)c(CSc2n[nH]c(Cc3cccs3)n2)c(F)c1 ZINC000505700127 943437720 /nfs/dbraw/zinc/43/77/20/943437720.db2.gz MSZPBBZSGOJJGC-UHFFFAOYSA-N 0 0 368.390 3.936 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])N1CCC[C@H]1/C=C\c1ccccc1 ZINC000503960712 943439992 /nfs/dbraw/zinc/43/99/92/943439992.db2.gz KYTWLTFPEWANBD-SQVRQVGWSA-N 0 0 351.406 3.982 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1)[C@@H](NCc1n[nH]cc1Br)CCCC2 ZINC000515003837 943445007 /nfs/dbraw/zinc/44/50/07/943445007.db2.gz CMSFACBNMKLFDU-AWEZNQCLSA-N 0 0 365.231 3.638 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N(C)c2ccc(Cl)cc2F)c1C ZINC000435491002 943446127 /nfs/dbraw/zinc/44/61/27/943446127.db2.gz RRHMTNWZIIQDSN-UHFFFAOYSA-N 0 0 372.805 3.829 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(C)c1ccc(Cl)cc1F ZINC000435476925 943447535 /nfs/dbraw/zinc/44/75/35/943447535.db2.gz KRBQBYJQEJAKAF-UHFFFAOYSA-N 0 0 372.805 3.775 20 5 FHBDRN COCC[C@H](C)CNC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 ZINC000412471747 943449555 /nfs/dbraw/zinc/44/95/55/943449555.db2.gz LMFPUDOLRJUYCP-AWEZNQCLSA-N 0 0 358.394 3.790 20 5 FHBDRN C[C@@H](NC(=O)N1CC[C@@H](COc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000503981350 943451157 /nfs/dbraw/zinc/45/11/57/943451157.db2.gz IRQQRUMPNAORPC-HZPDHXFCSA-N 0 0 369.421 3.766 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)N1C[C@H]2CCCN2c2ccccc21 ZINC000515051898 943475214 /nfs/dbraw/zinc/47/52/14/943475214.db2.gz DJHCZKIRISQALE-OAHLLOKOSA-N 0 0 369.446 3.703 20 5 FHBDRN CCC1(CC)CN(C(=O)c2ccc(Cn3nc(C)c([N+](=O)[O-])c3C)cc2)C1 ZINC000504054259 943481279 /nfs/dbraw/zinc/48/12/79/943481279.db2.gz ACKUTGKMOKTXST-UHFFFAOYSA-N 0 0 370.453 3.719 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N(C)Cc1cscn1 ZINC000504088792 943494961 /nfs/dbraw/zinc/49/49/61/943494961.db2.gz KZNLVQQHHUMMJC-UHFFFAOYSA-N 0 0 351.453 3.826 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)c1cc2ccccc2c(=O)o1 ZINC000435580137 943499494 /nfs/dbraw/zinc/49/94/94/943499494.db2.gz RZXMHNFDTGCCCA-UHFFFAOYSA-N 0 0 366.373 3.752 20 5 FHBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(N[C@H]2C[C@H](c3ccccc3F)C2)s1 ZINC000435583808 943501919 /nfs/dbraw/zinc/50/19/19/943501919.db2.gz IFRCMQAAKRFOMS-MGCOHNPYSA-N 0 0 370.427 3.557 20 5 FHBDRN COc1ccc(NC(=O)c2cc([N+](=O)[O-])c(F)cc2C)c2ncccc12 ZINC001269499567 943507645 /nfs/dbraw/zinc/50/76/45/943507645.db2.gz WBYWCKIWTUENEW-UHFFFAOYSA-N 0 0 355.325 3.851 20 5 FHBDRN C[C@H](C1CC1)n1cc(N[C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)cn1 ZINC000584736033 943510247 /nfs/dbraw/zinc/51/02/47/943510247.db2.gz JJOYCADLHPAEJU-ACJLOTCBSA-N 0 0 366.425 3.697 20 5 FHBDRN O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1CC[C@H](COc2ccccc2)C1 ZINC000504147247 943514578 /nfs/dbraw/zinc/51/45/78/943514578.db2.gz ZCPSKXUMCOAGCU-ZDUSSCGKSA-N 0 0 360.797 3.789 20 5 FHBDRN Cc1cc(C)cc([C@H]2NC(=O)N([C@@H](C)c3ccc(C)c([N+](=O)[O-])c3)C2=O)c1 ZINC000431940506 943550108 /nfs/dbraw/zinc/55/01/08/943550108.db2.gz VAAHHZCMHLCAAU-KBXCAEBGSA-N 0 0 367.405 3.874 20 5 FHBDRN COc1cccc(C(=O)N[C@@H](c2ccccc2)c2ccccn2)c1[N+](=O)[O-] ZINC000435669207 943550246 /nfs/dbraw/zinc/55/02/46/943550246.db2.gz JIGOEAYVAJDDPR-SFHVURJKSA-N 0 0 363.373 3.518 20 5 FHBDRN CN(C)c1nc2ccc(NC(=O)c3c(Cl)cccc3[N+](=O)[O-])cc2o1 ZINC000150715217 943551742 /nfs/dbraw/zinc/55/17/42/943551742.db2.gz WHAWKLPHDLIZLY-UHFFFAOYSA-N 0 0 360.757 3.708 20 5 FHBDRN CCN(C(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1)c1ccccc1F ZINC000515202744 943564433 /nfs/dbraw/zinc/56/44/33/943564433.db2.gz IXVNRVKSSJNHFR-UHFFFAOYSA-N 0 0 354.341 3.586 20 5 FHBDRN COc1cc(NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])c(C)c(OC)c1 ZINC000504265716 943574048 /nfs/dbraw/zinc/57/40/48/943574048.db2.gz PGTAETMHWNEBPD-UHFFFAOYSA-N 0 0 350.758 3.826 20 5 FHBDRN CC(C)COCCC(=O)Nc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1 ZINC000515216024 943576311 /nfs/dbraw/zinc/57/63/11/943576311.db2.gz IBDAPNIFJICEMI-UHFFFAOYSA-N 0 0 370.405 3.827 20 5 FHBDRN COc1cc(NC(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)c(C)c(OC)c1 ZINC000504297255 943577957 /nfs/dbraw/zinc/57/79/57/943577957.db2.gz XZSRAXMGTOQRKH-UHFFFAOYSA-N 0 0 355.350 3.654 20 5 FHBDRN O=C(N[C@H]1C[C@H](c2ccc(C(F)(F)F)cc2)C1)c1cc([N+](=O)[O-])c[nH]1 ZINC000435734072 943586571 /nfs/dbraw/zinc/58/65/71/943586571.db2.gz XUBFPJQPEORLMY-UMSPYCQHSA-N 0 0 353.300 3.618 20 5 FHBDRN COc1cc(C)c(NS(=O)(=O)c2c(C)cc([N+](=O)[O-])cc2C)cc1C ZINC000435736049 943588169 /nfs/dbraw/zinc/58/81/69/943588169.db2.gz STROCBGVJWSGTI-UHFFFAOYSA-N 0 0 364.423 3.638 20 5 FHBDRN CCN(C(=O)NCCc1ccccc1[N+](=O)[O-])[C@@H](C)c1cccc(OC)c1 ZINC000074764395 943595407 /nfs/dbraw/zinc/59/54/07/943595407.db2.gz VEZMIMDEZSLWME-HNNXBMFYSA-N 0 0 371.437 3.939 20 5 FHBDRN CC[C@H](CC(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1)c1ccccc1 ZINC000504328397 943596111 /nfs/dbraw/zinc/59/61/11/943596111.db2.gz HEDFUMZVOHODBJ-QGZVFWFLSA-N 0 0 367.449 3.827 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(C(=O)OCc2cc(Br)ccc2F)n1 ZINC001126417188 943600531 /nfs/dbraw/zinc/60/05/31/943600531.db2.gz WVRPKFUKAWFWAU-UHFFFAOYSA-N 0 0 369.146 3.557 20 5 FHBDRN COc1ccc2oc(C(=O)NCc3cccc([N+](=O)[O-])c3C)c(C)c2c1 ZINC000515268037 943601684 /nfs/dbraw/zinc/60/16/84/943601684.db2.gz JIPPFBTTZQHVJN-UHFFFAOYSA-N 0 0 354.362 3.896 20 5 FHBDRN Cc1ccc([C@@H](C)N2C(=O)[C@@H](c3ccccc3)N(C)C2=O)cc1[N+](=O)[O-] ZINC000431950286 943639495 /nfs/dbraw/zinc/63/94/95/943639495.db2.gz LNFMGILOYLYIQO-CXAGYDPISA-N 0 0 353.378 3.600 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2cnn(Cc3ccc(Br)cn3)c2)cc1 ZINC000504503260 943647317 /nfs/dbraw/zinc/64/73/17/943647317.db2.gz KUGKVUAEVNFNNS-UHFFFAOYSA-N 0 0 359.183 3.664 20 5 FHBDRN CC[C@]1(c2ccc(Cl)cc2)NC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O ZINC000504551928 943674895 /nfs/dbraw/zinc/67/48/95/943674895.db2.gz HSPGGPCHQPWMNL-QGZVFWFLSA-N 0 0 359.769 3.610 20 5 FHBDRN COc1cc(C)c(Br)cc1C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000504559754 943678012 /nfs/dbraw/zinc/67/80/12/943678012.db2.gz UFJUTGMBKZIEDQ-UHFFFAOYSA-N 0 0 365.183 3.927 20 5 FHBDRN Nc1cccc(C2CCN(C(=O)CCc3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000424034160 943696948 /nfs/dbraw/zinc/69/69/48/943696948.db2.gz NJDIFJWDHOFNHT-UHFFFAOYSA-N 0 0 353.422 3.516 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)c1cc(-c2cccc(F)c2)no1 ZINC000041775970 943707927 /nfs/dbraw/zinc/70/79/27/943707927.db2.gz UIZAARLIERFZQP-UHFFFAOYSA-N 0 0 357.297 3.650 20 5 FHBDRN Cc1c(C(=O)NC(CC(C)C)CC(C)C)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000504619167 943709073 /nfs/dbraw/zinc/70/90/73/943709073.db2.gz GVSTUUJYCYPURA-UHFFFAOYSA-N 0 0 373.457 3.675 20 5 FHBDRN C[C@H]1[C@H](C(=O)NC(C)(C)c2ccccc2[N+](=O)[O-])CCN1c1ccccc1 ZINC000584830996 943711211 /nfs/dbraw/zinc/71/12/11/943711211.db2.gz DPKBRTMPHZIUGA-DOTOQJQBSA-N 0 0 367.449 3.861 20 5 FHBDRN Cc1ccc([C@H](C)N2C(=O)CN(Cc3ccc(F)cc3)C2=O)cc1[N+](=O)[O-] ZINC000431957365 943736038 /nfs/dbraw/zinc/73/60/38/943736038.db2.gz WMSAGAHNGMTZJH-ZDUSSCGKSA-N 0 0 371.368 3.568 20 5 FHBDRN CCn1c([C@H]2CCCS2)nnc1N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000424164490 943769431 /nfs/dbraw/zinc/76/94/31/943769431.db2.gz XEOMWQYXIKXTTR-MRXNPFEDSA-N 0 0 373.482 3.943 20 5 FHBDRN C[C@@H]1C[C@@H](c2ccccc2)N(c2ccc([N+](=O)[O-])cc2S(C)(=O)=O)C1 ZINC000828194705 943772769 /nfs/dbraw/zinc/77/27/69/943772769.db2.gz SACPFOHFKJDRJJ-DYVFJYSZSA-N 0 0 360.435 3.586 20 5 FHBDRN C[C@H]1C[C@@H](c2ccccc2)N(c2ccc([N+](=O)[O-])cc2S(C)(=O)=O)C1 ZINC000828194706 943774035 /nfs/dbraw/zinc/77/40/35/943774035.db2.gz SACPFOHFKJDRJJ-GUYCJALGSA-N 0 0 360.435 3.586 20 5 FHBDRN COC(=O)c1cccc(NC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)c1 ZINC000435819005 943775021 /nfs/dbraw/zinc/77/50/21/943775021.db2.gz RCFKDOAVZGGFNE-UHFFFAOYSA-N 0 0 372.380 3.720 20 5 FHBDRN O=[N+]([O-])c1ccc(OC[C@@H](O)COc2ccc(Cl)cc2)c(Cl)c1 ZINC000584851975 943775665 /nfs/dbraw/zinc/77/56/65/943775665.db2.gz GXZONUHTHRELST-LBPRGKRZSA-N 0 0 358.177 3.720 20 5 FHBDRN CC[C@H](CSc1ccccc1)NC(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-] ZINC000504753527 943782623 /nfs/dbraw/zinc/78/26/23/943782623.db2.gz FOVYFGVNRVFIBK-GFCCVEGCSA-N 0 0 362.455 3.742 20 5 FHBDRN C[C@@H]1COCC[C@H]1C(=O)N(Cc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000435809330 943785704 /nfs/dbraw/zinc/78/57/04/943785704.db2.gz PGUPZORAMQYSLW-DNVCBOLYSA-N 0 0 354.406 3.801 20 5 FHBDRN O=C(N[C@H]1C[C@H](c2ccccc2)C1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000437412549 943785898 /nfs/dbraw/zinc/78/58/98/943785898.db2.gz PLHBGXHNYNPMGP-HDJSIYSDSA-N 0 0 362.332 3.872 20 5 FHBDRN CN(Cc1ccco1)C(=O)c1cc(F)cc2c(=O)c3cccc(F)c3[nH]c12 ZINC000435835131 943790143 /nfs/dbraw/zinc/79/01/43/943790143.db2.gz MMJMULQDNBSIBS-UHFFFAOYSA-N 0 0 368.339 3.825 20 5 FHBDRN COc1cccc(CNC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)c1 ZINC000435823060 943795424 /nfs/dbraw/zinc/79/54/24/943795424.db2.gz XXWHNYJMCWOTEN-UHFFFAOYSA-N 0 0 358.397 3.620 20 5 FHBDRN CC[C@@H](C(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1)[N@H+](C)Cc1ccccc1 ZINC000516897920 943814526 /nfs/dbraw/zinc/81/45/26/943814526.db2.gz KMQXBXIYIMGSNI-APWZRJJASA-N 0 0 369.465 3.991 20 5 FHBDRN Cc1n[nH]c(C(=O)NCc2ccc(Sc3ccccc3)cc2)c1[N+](=O)[O-] ZINC000437460989 943831596 /nfs/dbraw/zinc/83/15/96/943831596.db2.gz IRAVYNGYVBYKMP-UHFFFAOYSA-N 0 0 368.418 3.708 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(CCC(C)C)C1CCCC1 ZINC000437465508 943834142 /nfs/dbraw/zinc/83/41/42/943834142.db2.gz FTXWSUURCNIVHC-UHFFFAOYSA-N 0 0 361.442 3.659 20 5 FHBDRN Cn1cc(-c2cccc(N[C@@H](Cc3ccccc3[N+](=O)[O-])C3CC3)c2)nn1 ZINC000566503274 943840934 /nfs/dbraw/zinc/84/09/34/943840934.db2.gz IXYSIEIZNNSCMU-SFHVURJKSA-N 0 0 363.421 3.824 20 5 FHBDRN CSc1ccc(CCNC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)cc1 ZINC000437473035 943844321 /nfs/dbraw/zinc/84/43/21/943844321.db2.gz LEUYNUUCKVURKO-UHFFFAOYSA-N 0 0 369.446 3.699 20 5 FHBDRN O=C(N[C@H]1C[C@H](c2cccc(F)c2)C1)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000437474057 943845342 /nfs/dbraw/zinc/84/53/42/943845342.db2.gz QFOCBGOQEHPDPN-CTYIDZIISA-N 0 0 365.364 3.958 20 5 FHBDRN C[C@@H](NC(=O)COc1cccc(C(F)(F)F)c1)c1cccc([N+](=O)[O-])c1 ZINC000053337040 943845548 /nfs/dbraw/zinc/84/55/48/943845548.db2.gz SWFUWYCYCXHGGM-LLVKDONJSA-N 0 0 368.311 3.870 20 5 FHBDRN CCOc1ccc(C(=O)NCCc2ccc(SC)cc2)cc1[N+](=O)[O-] ZINC000437476380 943845651 /nfs/dbraw/zinc/84/56/51/943845651.db2.gz RVBVUOWROSIWFF-UHFFFAOYSA-N 0 0 360.435 3.688 20 5 FHBDRN Cc1nn(CCC(=O)N2c3ccccc3C(C)(C)C[C@@H]2C)c(C)c1[N+](=O)[O-] ZINC000504855713 943846193 /nfs/dbraw/zinc/84/61/93/943846193.db2.gz BFGXYCIKFUEWFH-ZDUSSCGKSA-N 0 0 370.453 3.901 20 5 FHBDRN Cc1nn(CCC(=O)N2c3ccccc3C(C)(C)C[C@H]2C)c(C)c1[N+](=O)[O-] ZINC000504855712 943846418 /nfs/dbraw/zinc/84/64/18/943846418.db2.gz BFGXYCIKFUEWFH-CYBMUJFWSA-N 0 0 370.453 3.901 20 5 FHBDRN CN(C[C@H]1OCCc2ccccc21)C(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000515444373 943878065 /nfs/dbraw/zinc/87/80/65/943878065.db2.gz BOIWGJAEYBRNCG-LJQANCHMSA-N 0 0 368.433 3.645 20 5 FHBDRN CN(Cc1nc(C2(c3ccc(F)cc3)CC2)no1)c1ccccc1[N+](=O)[O-] ZINC000424365248 943879027 /nfs/dbraw/zinc/87/90/27/943879027.db2.gz SRSVMBYXPVGPLR-UHFFFAOYSA-N 0 0 368.368 3.833 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)[C@H]1CCCOC1 ZINC000504895889 943893683 /nfs/dbraw/zinc/89/36/83/943893683.db2.gz AXYPBSVJXKEBRV-OLZOCXBDSA-N 0 0 352.456 3.642 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)[C@H]1CCCOC1 ZINC000504895891 943895219 /nfs/dbraw/zinc/89/52/19/943895219.db2.gz AXYPBSVJXKEBRV-STQMWFEESA-N 0 0 352.456 3.642 20 5 FHBDRN CC(=O)N(c1ccc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2)cc1)[C@@H]1C[C@@H]1C ZINC000516991580 943895858 /nfs/dbraw/zinc/89/58/58/943895858.db2.gz XRARVGXMQPFQFT-BBATYDOGSA-N 0 0 371.368 3.748 20 5 FHBDRN Cc1ccc(NC(=O)N[C@@H]2CCC[N@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000504912942 943909324 /nfs/dbraw/zinc/90/93/24/943909324.db2.gz ABZCELBBFXOUGX-GOSISDBHSA-N 0 0 368.437 3.689 20 5 FHBDRN COCC[C@@H](NCc1ccc(Br)cc1[N+](=O)[O-])c1ccco1 ZINC000425433015 943909851 /nfs/dbraw/zinc/90/98/51/943909851.db2.gz MQXKYPLRIIEMJV-CYBMUJFWSA-N 0 0 369.215 3.818 20 5 FHBDRN Cc1oc(Br)cc1C(=O)N1c2ccc([N+](=O)[O-])cc2C[C@H]1C ZINC000425437555 943919739 /nfs/dbraw/zinc/91/97/39/943919739.db2.gz ZWXYOUYNEUKXNV-MRVPVSSYSA-N 0 0 365.183 3.850 20 5 FHBDRN COc1ccc([C@H]2CCN(C(=O)c3ccc(Cl)cc3[N+](=O)[O-])C2)cc1 ZINC000504943213 943921612 /nfs/dbraw/zinc/92/16/12/943921612.db2.gz MPQJILWAYBYNBJ-ZDUSSCGKSA-N 0 0 360.797 3.887 20 5 FHBDRN CCc1nc(C(C)C)ccc1C(=O)N1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000517021110 943922301 /nfs/dbraw/zinc/92/23/01/943922301.db2.gz JFTKZXWSPWFGKV-UHFFFAOYSA-N 0 0 369.421 3.710 20 5 FHBDRN Cc1ccc(OCCCNC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)cc1 ZINC000504959107 943937172 /nfs/dbraw/zinc/93/71/72/943937172.db2.gz HETMEEKCZFAMTI-OAHLLOKOSA-N 0 0 374.462 3.969 20 5 FHBDRN CCCN(C(=O)c1cccc(OC)c1[N+](=O)[O-])[C@H]1CCCc2cccnc21 ZINC000436014985 943953213 /nfs/dbraw/zinc/95/32/13/943953213.db2.gz GFBRKESLIHEGKI-INIZCTEOSA-N 0 0 369.421 3.928 20 5 FHBDRN CCOC1(C)CCN(Cc2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000425443973 943957510 /nfs/dbraw/zinc/95/75/10/943957510.db2.gz KXZHTZSLZNCUIV-UHFFFAOYSA-N 0 0 357.248 3.748 20 5 FHBDRN CC(=O)c1cccc(O[C@@H](C)c2nc(-c3cccc([N+](=O)[O-])c3)no2)c1 ZINC000505018807 943971734 /nfs/dbraw/zinc/97/17/34/943971734.db2.gz OPQINDBOCBFMDO-LBPRGKRZSA-N 0 0 353.334 3.987 20 5 FHBDRN COCC[C@@H](NC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)c1ccco1 ZINC000505018225 943972202 /nfs/dbraw/zinc/97/22/02/943972202.db2.gz HETUWRLOCMKVPW-CYBMUJFWSA-N 0 0 372.299 3.714 20 5 FHBDRN COc1cc(-c2nc(-c3cccc([N+](=O)[O-])c3)no2)ccc1OC(F)F ZINC000505018282 943972382 /nfs/dbraw/zinc/97/23/82/943972382.db2.gz IGAMTMNNOVAEHA-UHFFFAOYSA-N 0 0 363.276 3.922 20 5 FHBDRN CC1(C)CC[C@H](CNC(=O)c2c(N)cccc2[N+](=O)[O-])c2ccccc21 ZINC000500031338 943976013 /nfs/dbraw/zinc/97/60/13/943976013.db2.gz RGNTYHSPTBWXOL-CYBMUJFWSA-N 0 0 353.422 3.762 20 5 FHBDRN CCOc1ccc([C@@H]2C[C@H]2NC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000437631715 943978210 /nfs/dbraw/zinc/97/82/10/943978210.db2.gz DBDMYMORACWUAU-ZNZDAUKMSA-N 0 0 369.421 3.910 20 5 FHBDRN COCC1(C)CCN(Cc2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000425456095 943980923 /nfs/dbraw/zinc/98/09/23/943980923.db2.gz IUQWINUXIGTHKZ-UHFFFAOYSA-N 0 0 357.248 3.606 20 5 FHBDRN O=C(Nc1ccc2nccnc2c1)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000436061771 943983039 /nfs/dbraw/zinc/98/30/39/943983039.db2.gz VBORQQDDDNFNOF-UHFFFAOYSA-N 0 0 366.380 3.877 20 5 FHBDRN Cc1c(-c2nc(-c3cccc([N+](=O)[O-])c3)no2)cnn1-c1ccccc1F ZINC000505029374 943986236 /nfs/dbraw/zinc/98/62/36/943986236.db2.gz GDZOSIWXYOZPTO-UHFFFAOYSA-N 0 0 365.324 3.945 20 5 FHBDRN COc1ccc(SCCCC(=O)NCc2ccccc2[N+](=O)[O-])cc1 ZINC000436066785 943988216 /nfs/dbraw/zinc/98/82/16/943988216.db2.gz OMMFUSBIWPPDCW-UHFFFAOYSA-N 0 0 360.435 3.792 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2noc(-c3ccc(OC[C@@H]4CCCO4)cc3)n2)c1 ZINC000505036279 943993238 /nfs/dbraw/zinc/99/32/38/943993238.db2.gz QDUKYFFGSYWKFB-KRWDZBQOSA-N 0 0 367.361 3.870 20 5 FHBDRN CCOc1ccc(OC)cc1NC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000110299172 943993810 /nfs/dbraw/zinc/99/38/10/943993810.db2.gz XRQMUSXHJHNKOB-UHFFFAOYSA-N 0 0 350.758 3.908 20 5 FHBDRN COc1cccc(C(=O)N2[C@H](C)Cc3cc(F)ccc3[C@H]2C)c1[N+](=O)[O-] ZINC000436054380 943995188 /nfs/dbraw/zinc/99/51/88/943995188.db2.gz VJYKMRLRFWCZKM-VXGBXAGGSA-N 0 0 358.369 3.891 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N[C@]2(c3ccc(Cl)cc3)C[C@@H]2C)c1[N+](=O)[O-] ZINC000505750095 943996467 /nfs/dbraw/zinc/99/64/67/943996467.db2.gz OJROSGLIOFDWBP-DYZYQPBXSA-N 0 0 362.817 3.760 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)Nc1cccc(CSC)c1 ZINC000544247971 944002892 /nfs/dbraw/zinc/00/28/92/944002892.db2.gz LODLUUCBHXNSCV-UHFFFAOYSA-N 0 0 361.423 3.788 20 5 FHBDRN CCC[C@@H](NC(=O)NCCNc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000505062105 944005752 /nfs/dbraw/zinc/00/57/52/944005752.db2.gz PPNFLMMFMRIFJH-GOSISDBHSA-N 0 0 356.426 3.847 20 5 FHBDRN O=C(N[C@@H]1CCC[C@H]1OC(F)F)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000506089056 944007704 /nfs/dbraw/zinc/00/77/04/944007704.db2.gz GGMXQAPFHZSIMC-IAGOWNOFSA-N 0 0 372.371 3.571 20 5 FHBDRN O=c1[nH]cnc2cc(N3CCC[C@H](c4ccccc4)C3)c([N+](=O)[O-])cc12 ZINC000515582526 944016298 /nfs/dbraw/zinc/01/62/98/944016298.db2.gz FZSIDTRCJMBXIA-AWEZNQCLSA-N 0 0 350.378 3.628 20 5 FHBDRN O=C([O-])[C@@H]1CC[C@H]([NH2+]Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)C1 ZINC000424624245 944017498 /nfs/dbraw/zinc/01/74/98/944017498.db2.gz RPAPVOQYMVBDSO-HIFRSBDPSA-N 0 0 374.368 3.869 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NCCc1ccc(F)c(F)c1F ZINC000544123995 944022364 /nfs/dbraw/zinc/02/23/64/944022364.db2.gz XFNWNCDUEQFZEE-UHFFFAOYSA-N 0 0 366.339 3.910 20 5 FHBDRN COc1ccc(C(=O)N2CCC(Cc3cccc(F)c3)CC2)cc1[N+](=O)[O-] ZINC000515579562 944027740 /nfs/dbraw/zinc/02/77/40/944027740.db2.gz CHNSBOHYJUUFED-UHFFFAOYSA-N 0 0 372.396 3.837 20 5 FHBDRN Cc1cc(-c2nc(-c3ccc([N+](=O)[O-])cc3)no2)c2cnn(C(C)C)c2n1 ZINC000505093908 944033570 /nfs/dbraw/zinc/03/35/70/944033570.db2.gz KNYDBZVNHQMYGY-UHFFFAOYSA-N 0 0 364.365 3.946 20 5 FHBDRN O=C(c1cscc1Br)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000505098978 944038068 /nfs/dbraw/zinc/03/80/68/944038068.db2.gz PCTIKYNWELHWKF-UHFFFAOYSA-N 0 0 353.197 3.622 20 5 FHBDRN O=C(NC1CC(OCc2ccccc2)C1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000545949281 944041272 /nfs/dbraw/zinc/04/12/72/944041272.db2.gz QLXCHSFFADCWDN-UHFFFAOYSA-N 0 0 360.797 3.726 20 5 FHBDRN Cc1oc(Br)cc1C(=O)N1CCCc2ccc([N+](=O)[O-])cc21 ZINC000424681396 944044676 /nfs/dbraw/zinc/04/46/76/944044676.db2.gz OBSPSWKFCZWDNN-UHFFFAOYSA-N 0 0 365.183 3.852 20 5 FHBDRN CCC[C@H](NS(=O)(=O)Cc1ccccc1[N+](=O)[O-])C1CCCCC1 ZINC000546065730 944049891 /nfs/dbraw/zinc/04/98/91/944049891.db2.gz LANUIWFNZUSUFR-INIZCTEOSA-N 0 0 354.472 3.763 20 5 FHBDRN Cc1ccc(NC(=O)NCC2(c3ccccc3)CCOCC2)cc1[N+](=O)[O-] ZINC000505105639 944054331 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372.874 3.900 20 5 FHBDRN Cc1ccc(C(=O)NCc2ccccc2OCC(F)(F)F)cc1[N+](=O)[O-] ZINC000515725916 944156534 /nfs/dbraw/zinc/15/65/34/944156534.db2.gz CMQMLHKCQVMNHQ-UHFFFAOYSA-N 0 0 368.311 3.774 20 5 FHBDRN COc1ccc(CCCN(C)C(=O)Nc2ccc([N+](=O)[O-])cc2OC)cc1 ZINC000123125448 944163891 /nfs/dbraw/zinc/16/38/91/944163891.db2.gz WJRRCZDPNXAOMA-UHFFFAOYSA-N 0 0 373.409 3.709 20 5 FHBDRN Cc1cc([N+](=O)[O-])cnc1N1C[C@@H](CCN2CCCC2=O)c2ccccc21 ZINC000092669198 944191396 /nfs/dbraw/zinc/19/13/96/944191396.db2.gz JDSQNEWRAMUYKJ-OAHLLOKOSA-N 0 0 366.421 3.546 20 5 FHBDRN COc1ccc(CNC(=O)Nc2ccc3nc(C)sc3c2)cc1[N+](=O)[O-] ZINC000515776101 944200897 /nfs/dbraw/zinc/20/08/97/944200897.db2.gz JPEJSAUERNONLN-UHFFFAOYSA-N 0 0 372.406 3.843 20 5 FHBDRN CCCN(CC(=O)OC(C)(C)C)c1cc(C(F)(F)F)ncc1[N+](=O)[O-] ZINC000436332186 944211359 /nfs/dbraw/zinc/21/13/59/944211359.db2.gz OTDQDEVBFHIZNT-UHFFFAOYSA-N 0 0 363.336 3.567 20 5 FHBDRN CCCN(C(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1)[C@H](C)C(=O)OCC ZINC000436339561 944216258 /nfs/dbraw/zinc/21/62/58/944216258.db2.gz YVZAWMCYKFGBNR-CYBMUJFWSA-N 0 0 364.442 3.696 20 5 FHBDRN O=[N+]([O-])c1cc(CN2CCN(c3cccc(C(F)(F)F)c3)CC2)cs1 ZINC000515780034 944221274 /nfs/dbraw/zinc/22/12/74/944221274.db2.gz DPTCXCRLNOFHOL-UHFFFAOYSA-N 0 0 371.384 3.997 20 5 FHBDRN CCC[C@]1(C(=O)OCC)CCCN1C(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000436348095 944231014 /nfs/dbraw/zinc/23/10/14/944231014.db2.gz VFSJGGSCTAMEDZ-LJQANCHMSA-N 0 0 374.393 3.679 20 5 FHBDRN CC(C)Oc1ccc(F)cc1N[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000518283343 944234553 /nfs/dbraw/zinc/23/45/53/944234553.db2.gz RRQZWHWMNOHGPP-MRXNPFEDSA-N 0 0 373.384 3.739 20 5 FHBDRN O=C(Nc1ccc(OC[C@@H]2CCCO2)cc1)c1cc(F)cc([N+](=O)[O-])c1 ZINC000518284445 944235121 /nfs/dbraw/zinc/23/51/21/944235121.db2.gz PLLYVOKXQUDODW-KRWDZBQOSA-N 0 0 360.341 3.544 20 5 FHBDRN Cc1sc(C(=O)N2CCC[C@]3(C2)OCc2ccccc23)cc1[N+](=O)[O-] ZINC000364290120 944240741 /nfs/dbraw/zinc/24/07/41/944240741.db2.gz KZAWTTOFWYGIAK-GOSISDBHSA-N 0 0 358.419 3.626 20 5 FHBDRN CC1(C)C(CNC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])C1(C)C ZINC001270425786 944255413 /nfs/dbraw/zinc/25/54/13/944255413.db2.gz NDTSQRSMZVKLCM-UHFFFAOYSA-N 0 0 354.834 3.816 20 5 FHBDRN COc1ccc(-c2ccc(CNCc3ncccc3C)o2)c([N+](=O)[O-])c1 ZINC000106481075 944256714 /nfs/dbraw/zinc/25/67/14/944256714.db2.gz SPYSDDFFMQXWHU-UHFFFAOYSA-N 0 0 353.378 3.857 20 5 FHBDRN Cc1cccc(N(C(C)C)S(=O)(=O)c2c(F)cccc2[N+](=O)[O-])c1 ZINC000518317042 944262421 /nfs/dbraw/zinc/26/24/21/944262421.db2.gz CSEQBMIIUKSWFR-UHFFFAOYSA-N 0 0 352.387 3.646 20 5 FHBDRN C[C@@H]1CCCN(C(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)[C@H]1C ZINC000426259623 944266047 /nfs/dbraw/zinc/26/60/47/944266047.db2.gz ZKCKVFKGVFEKNU-MNOVXSKESA-N 0 0 359.348 3.944 20 5 FHBDRN CC[C@H](C)[C@H](C(=O)NCCOc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000518309536 944271480 /nfs/dbraw/zinc/27/14/80/944271480.db2.gz RGAOLDXIWQFWBV-KXBFYZLASA-N 0 0 356.422 3.920 20 5 FHBDRN CCc1n[nH]c(C(=O)NCC(C)(C)c2ccc(C(C)(C)C)cc2)c1[N+](=O)[O-] ZINC000550138457 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3.500 20 5 FHBDRN CCCc1n[nH]c(C(=O)NCC2(c3ccc(F)cc3)CCCC2)c1[N+](=O)[O-] ZINC000518335196 944282556 /nfs/dbraw/zinc/28/25/56/944282556.db2.gz ACTSXHQVBGZZEB-UHFFFAOYSA-N 0 0 374.416 3.651 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)N(C)[C@@H]2CCCc3ccccc32)cc1C ZINC000518334492 944282988 /nfs/dbraw/zinc/28/29/88/944282988.db2.gz UQVFTGNRBHFUGO-QGZVFWFLSA-N 0 0 374.462 3.910 20 5 FHBDRN C[C@H](NC(=O)N[C@H]1CCCc2cc(N)ccc21)c1ccc([N+](=O)[O-])cc1 ZINC000418230587 944287900 /nfs/dbraw/zinc/28/79/00/944287900.db2.gz JQMKTXZJFHZNBL-SGTLLEGYSA-N 0 0 354.410 3.615 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)c2ccnc(N3CC[C@@H](C)C3)c2)cc1[N+](=O)[O-] ZINC000438026558 944294547 /nfs/dbraw/zinc/29/45/47/944294547.db2.gz GTGRWBYZBOYFTO-HIFRSBDPSA-N 0 0 368.437 3.635 20 5 FHBDRN CC(C)c1nnc(NC(=O)c2ccnc(-c3ccccc3)c2[N+](=O)[O-])s1 ZINC000550167163 944313517 /nfs/dbraw/zinc/31/35/17/944313517.db2.gz RNGXTYOKIJROQH-UHFFFAOYSA-N 0 0 369.406 3.884 20 5 FHBDRN C[C@@H](SCc1ccc(C(N)=O)cc1[N+](=O)[O-])c1ccc(F)cc1F ZINC000105633713 944321266 /nfs/dbraw/zinc/32/12/66/944321266.db2.gz JHLAPIVDJSFPIR-SECBINFHSA-N 0 0 352.362 3.966 20 5 FHBDRN Cc1cc(N2CCO[C@@]3(CCSC3)C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000518367713 944321401 /nfs/dbraw/zinc/32/14/01/944321401.db2.gz LBZLXEZGDVHJFT-AWEZNQCLSA-N 0 0 362.373 3.634 20 5 FHBDRN NC(=O)c1ccc(CSCc2cccc(OC(F)F)c2)c([N+](=O)[O-])c1 ZINC000105635431 944322061 /nfs/dbraw/zinc/32/20/61/944322061.db2.gz AGTYYXMFSDYBBF-UHFFFAOYSA-N 0 0 368.361 3.729 20 5 FHBDRN C[C@@H]1CCC[C@H](c2noc(-c3ccc(-n4cncn4)c([N+](=O)[O-])c3)n2)C1 ZINC000544284963 944327293 /nfs/dbraw/zinc/32/72/93/944327293.db2.gz QACJBAXFRHFNHN-NEPJUHHUSA-N 0 0 354.370 3.519 20 5 FHBDRN Cc1cc(OCC(=O)NCCCO[C@@H](C)c2ccccc2)ccc1[N+](=O)[O-] ZINC000053541289 944327562 /nfs/dbraw/zinc/32/75/62/944327562.db2.gz FYSPUZOYLUXTSI-INIZCTEOSA-N 0 0 372.421 3.566 20 5 FHBDRN CCOC(=O)[C@H](Cc1ccccc1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC001167975539 944330826 /nfs/dbraw/zinc/33/08/26/944330826.db2.gz GFXSGDXKIKDGNW-FQEVSTJZSA-N 0 0 368.433 3.734 20 5 FHBDRN O=[N+]([O-])c1ccc(NCc2ncn(Cc3cccc(F)c3)n2)c(Cl)c1 ZINC000436463898 944330898 /nfs/dbraw/zinc/33/08/98/944330898.db2.gz LRVHPLJUFFQGHC-UHFFFAOYSA-N 0 0 361.764 3.639 20 5 FHBDRN CN(C(=O)CN1CCC[C@@H]1/C=C/c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000505825146 944331770 /nfs/dbraw/zinc/33/17/70/944331770.db2.gz KGFKFIKRCDUBNY-JBVUFVISSA-N 0 0 365.433 3.735 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccn2ccnc2c1 ZINC000506851016 944332429 /nfs/dbraw/zinc/33/24/29/944332429.db2.gz KQFOADXMYQCIJT-UHFFFAOYSA-N 0 0 356.407 3.995 20 5 FHBDRN CN(Cc1ccoc1)C(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000426283383 944338786 /nfs/dbraw/zinc/33/87/86/944338786.db2.gz NNGFQMHVYJIJLR-UHFFFAOYSA-N 0 0 357.288 3.548 20 5 FHBDRN CNc1ccc([N+](=O)[O-])cc1C(=O)NCC(C)(C)c1ccccc1Cl ZINC001143565336 944342010 /nfs/dbraw/zinc/34/20/10/944342010.db2.gz LNHCFILTTASTFI-UHFFFAOYSA-N 0 0 361.829 3.998 20 5 FHBDRN C[C@H]1CN(C(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C(C)(C)C1 ZINC000426283479 944342244 /nfs/dbraw/zinc/34/22/44/944342244.db2.gz OXFVFKNEBVRQRW-SNVBAGLBSA-N 0 0 359.348 3.944 20 5 FHBDRN Cc1c(CNC(=O)Cc2c[nH]c3cccc(Cl)c23)cccc1[N+](=O)[O-] ZINC000506178162 944343205 /nfs/dbraw/zinc/34/32/05/944343205.db2.gz IHFCAJNOADRSDU-UHFFFAOYSA-N 0 0 357.797 3.897 20 5 FHBDRN Cn1cc([C@H](NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)C(C)(C)C)cn1 ZINC000473572919 944344409 /nfs/dbraw/zinc/34/44/09/944344409.db2.gz WOABLVNHUTXPNM-INIZCTEOSA-N 0 0 356.382 3.592 20 5 FHBDRN C/C=C\c1ccc(OC[C@@H](O)COc2ccc(C)c([N+](=O)[O-])c2)c(OC)c1 ZINC000550175988 944345568 /nfs/dbraw/zinc/34/55/68/944345568.db2.gz XNBBOSQQINWIND-AWFCHZOYSA-N 0 0 373.405 3.764 20 5 FHBDRN Cc1cc(C)cc(OC[C@@H](O)COc2c(Cl)cccc2[N+](=O)[O-])c1 ZINC000550175568 944346939 /nfs/dbraw/zinc/34/69/39/944346939.db2.gz BMNDIHWQHOFEPB-CYBMUJFWSA-N 0 0 351.786 3.684 20 5 FHBDRN Cc1cccc2oc(CCNC(=O)Nc3ccc([N+](=O)[O-])cc3F)nc21 ZINC000500257636 944347803 /nfs/dbraw/zinc/34/78/03/944347803.db2.gz GNOJEOGRNFSMHI-UHFFFAOYSA-N 0 0 358.329 3.548 20 5 FHBDRN Cc1nn(Cc2csc(COc3ccc(Cl)cc3)n2)cc1[N+](=O)[O-] ZINC000436473320 944353587 /nfs/dbraw/zinc/35/35/87/944353587.db2.gz GPBCJLTVNYJPDP-UHFFFAOYSA-N 0 0 364.814 3.837 20 5 FHBDRN Cc1nn([C@H](C(=O)Nc2cc(C)ccc2C)c2ccccc2)cc1[N+](=O)[O-] ZINC000436473429 944353778 /nfs/dbraw/zinc/35/37/78/944353778.db2.gz JACAAHKKZFYTLW-IBGZPJMESA-N 0 0 364.405 3.945 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)NCCSc1ccc(C)cc1 ZINC000505833319 944354204 /nfs/dbraw/zinc/35/42/04/944354204.db2.gz SOZCLWRVWBNBDT-UHFFFAOYSA-N 0 0 361.423 3.826 20 5 FHBDRN CCCOc1ccc([C@@H](C)NC(=O)Cc2ccccc2[N+](=O)[O-])cc1OC ZINC000048504456 944358759 /nfs/dbraw/zinc/35/87/59/944358759.db2.gz WJYXDDCRQWFYPV-CQSZACIVSA-N 0 0 372.421 3.812 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1NCCCO[C@H]1CCCCO1 ZINC000439128170 944363623 /nfs/dbraw/zinc/36/36/23/944363623.db2.gz DIWYHQKRCYIHPH-AWEZNQCLSA-N 0 0 359.220 3.703 20 5 FHBDRN Cc1c(C(=O)N(Cc2cccc(F)c2)C2CC2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000123475441 944365103 /nfs/dbraw/zinc/36/51/03/944365103.db2.gz BEPMEBUYFYWRCV-UHFFFAOYSA-N 0 0 373.340 3.755 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N1CCC2(C1)Oc1ccccc1O2 ZINC000518436495 944365999 /nfs/dbraw/zinc/36/59/99/944365999.db2.gz JFRUTVNURHFBGU-UHFFFAOYSA-N 0 0 368.389 3.534 20 5 FHBDRN Cc1c(NC(=O)N[C@@H](c2cccs2)C(C)(C)CO)cccc1[N+](=O)[O-] ZINC000436498068 944366460 /nfs/dbraw/zinc/36/64/60/944366460.db2.gz RHLSBDJDUKEXMQ-HNNXBMFYSA-N 0 0 363.439 3.846 20 5 FHBDRN CC[C@@H]1C[C@]1(NC(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-])c1cccc(C)c1 ZINC000506181867 944370217 /nfs/dbraw/zinc/37/02/17/944370217.db2.gz BYQPKMYFFFYXLK-BFUOFWGJSA-N 0 0 356.426 3.805 20 5 FHBDRN COc1cc(C)c(S(=O)(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)cc1C ZINC000473760257 944370711 /nfs/dbraw/zinc/37/07/11/944370711.db2.gz AZIUBTACRWFCQV-UHFFFAOYSA-N 0 0 364.423 3.638 20 5 FHBDRN Cc1c2ccccc2oc1[C@H](C)NS(=O)(=O)Cc1ccccc1[N+](=O)[O-] ZINC000184264698 944370829 /nfs/dbraw/zinc/37/08/29/944370829.db2.gz MSPRMYNZRPRZGW-ZDUSSCGKSA-N 0 0 374.418 3.830 20 5 FHBDRN CCOc1ccc(C(=O)N[C@H](C)[C@@H]2Oc3ccccc3[C@H]2C)cc1[N+](=O)[O-] ZINC000438147081 944379271 /nfs/dbraw/zinc/37/92/71/944379271.db2.gz XTYNAOGUENJBAH-VLXJIEOASA-N 0 0 370.405 3.677 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)N[C@@H]1C[C@H]1c1cccc(Cl)c1 ZINC000437890113 944380837 /nfs/dbraw/zinc/38/08/37/944380837.db2.gz PCRMEKLVYODLKX-JKSUJKDBSA-N 0 0 359.813 3.946 20 5 FHBDRN C[C@H](NC(=O)[C@H](c1cccc(Cl)c1)N(C)C)c1cccc([N+](=O)[O-])c1 ZINC000518443807 944381298 /nfs/dbraw/zinc/38/12/98/944381298.db2.gz SDVIFEVQONEKIO-SJCJKPOMSA-N 0 0 361.829 3.728 20 5 FHBDRN C[C@@H](NC(=O)[C@H](c1cccc(Cl)c1)N(C)C)c1cccc([N+](=O)[O-])c1 ZINC000518443806 944381580 /nfs/dbraw/zinc/38/15/80/944381580.db2.gz SDVIFEVQONEKIO-PXAZEXFGSA-N 0 0 361.829 3.728 20 5 FHBDRN CC(C)(CNc1ncc([N+](=O)[O-])cn1)c1ccccc1Br ZINC000302210369 944382209 /nfs/dbraw/zinc/38/22/09/944382209.db2.gz GMHLRBIGANMGBY-UHFFFAOYSA-N 0 0 351.204 3.537 20 5 FHBDRN C[C@@]1(CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])CCOC2(CCC2)C1 ZINC000894661810 944384683 /nfs/dbraw/zinc/38/46/83/944384683.db2.gz CJBWISXODCLEMD-MRXNPFEDSA-N 0 0 352.818 3.717 20 5 FHBDRN O=C1[C@H](Sc2cc(F)ccc2F)CCN1c1cccc([N+](=O)[O-])c1 ZINC000517554595 944387312 /nfs/dbraw/zinc/38/73/12/944387312.db2.gz BFNGCEQXTDBHGW-CQSZACIVSA-N 0 0 350.346 3.771 20 5 FHBDRN CCOc1ccc([C@@H](C)NC(=O)c2cc(F)cc([N+](=O)[O-])c2)cc1OC ZINC000517559499 944390558 /nfs/dbraw/zinc/39/05/58/944390558.db2.gz BXEXCAKSITZWBV-LLVKDONJSA-N 0 0 362.357 3.632 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)NC[C@@H]1CCCO[C@H]1C(C)C ZINC000439169293 944391484 /nfs/dbraw/zinc/39/14/84/944391484.db2.gz NGLOETPVIFIGCP-LRDDRELGSA-N 0 0 354.834 3.738 20 5 FHBDRN O=C(NCc1cccc2cc[nH]c21)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000466883868 944392033 /nfs/dbraw/zinc/39/20/33/944392033.db2.gz SIQWCIWZRGMMCG-UHFFFAOYSA-N 0 0 364.405 3.950 20 5 FHBDRN COc1ccccc1[C@]1(C)C[C@H]1NC(=O)Nc1ccc([N+](=O)[O-])c(C)c1 ZINC000473765630 944392151 /nfs/dbraw/zinc/39/21/51/944392151.db2.gz BKCONBWWFBXPHP-MJGOQNOKSA-N 0 0 355.394 3.764 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@@H]1CCC[C@@H]1c1ccccc1 ZINC000518440236 944392292 /nfs/dbraw/zinc/39/22/92/944392292.db2.gz FBLAIHICLKIYOZ-IAGOWNOFSA-N 0 0 360.435 3.518 20 5 FHBDRN CC[C@H](NC(=O)Nc1ccc([N+](=O)[O-])c(C)c1)c1ccc2c(c1)OCCO2 ZINC000473765845 944393572 /nfs/dbraw/zinc/39/35/72/944393572.db2.gz PZCBVIVJUOSKRX-HNNXBMFYSA-N 0 0 371.393 3.947 20 5 FHBDRN Cc1sc(C(=O)N2CCN(c3cccc(C)c3C)CC2)cc1[N+](=O)[O-] ZINC000043732985 944402087 /nfs/dbraw/zinc/40/20/87/944402087.db2.gz DICPSKHHUPSWRF-UHFFFAOYSA-N 0 0 359.451 3.544 20 5 FHBDRN COc1cc(CNc2ccc(C(=O)NC(C)C)cc2[N+](=O)[O-])ccc1C ZINC000053583014 944402422 /nfs/dbraw/zinc/40/24/22/944402422.db2.gz BZCBIMHASWFUJO-UHFFFAOYSA-N 0 0 357.410 3.662 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N[C@H]1CCCc2c(O)cccc21 ZINC000190254897 944402523 /nfs/dbraw/zinc/40/25/23/944402523.db2.gz SXMVWVCCFAXNTQ-INIZCTEOSA-N 0 0 360.797 3.690 20 5 FHBDRN CN(C(=O)CCNc1ccccc1[N+](=O)[O-])c1ccc(Cl)cc1F ZINC000439181944 944406068 /nfs/dbraw/zinc/40/60/68/944406068.db2.gz QODAVODFELJPQY-UHFFFAOYSA-N 0 0 351.765 3.852 20 5 FHBDRN CC(=O)Nc1cc(Cl)ccc1NC(=O)c1ccc([N+](=O)[O-])cc1F ZINC000105970926 944406562 /nfs/dbraw/zinc/40/65/62/944406562.db2.gz LEDKYDFLVZATPW-UHFFFAOYSA-N 0 0 351.721 3.598 20 5 FHBDRN Cc1ccc([C@H](C)N(C)C(=O)NCCOc2ccc([N+](=O)[O-])cc2)cc1 ZINC000517590411 944421016 /nfs/dbraw/zinc/42/10/16/944421016.db2.gz WTBOQSHAUZBYMP-HNNXBMFYSA-N 0 0 357.410 3.685 20 5 FHBDRN CO[C@H](c1ccccc1F)[C@H](C)NC(=O)Nc1ccc([N+](=O)[O-])c(C)c1 ZINC000473776321 944422624 /nfs/dbraw/zinc/42/26/24/944422624.db2.gz NAPXZGXNPPTOIK-SJCJKPOMSA-N 0 0 361.373 3.940 20 5 FHBDRN CC1(C)C[C@H]1CNC(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000426309635 944424378 /nfs/dbraw/zinc/42/43/78/944424378.db2.gz KLULFBBBSKQTIT-HNNXBMFYSA-N 0 0 354.406 3.950 20 5 FHBDRN O=C(Nc1ccnn1-c1ccc([N+](=O)[O-])cc1)[C@H]1CCCc2sccc21 ZINC000123812655 944427216 /nfs/dbraw/zinc/42/72/16/944427216.db2.gz BDGQEDYPVIMXBI-HNNXBMFYSA-N 0 0 368.418 3.901 20 5 FHBDRN Cc1cc(NC(=O)NCCc2ccc3ccccc3n2)ccc1[N+](=O)[O-] ZINC000473775383 944431295 /nfs/dbraw/zinc/43/12/95/944431295.db2.gz LFAQZNBYXGOXHD-UHFFFAOYSA-N 0 0 350.378 3.816 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)C[C@H]1CCCO1 ZINC000506192765 944436746 /nfs/dbraw/zinc/43/67/46/944436746.db2.gz POKZRNWJIDSHKV-GXTWGEPZSA-N 0 0 352.456 3.784 20 5 FHBDRN COc1cc(C(=O)N2CCC[C@@H](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000518502635 944437214 /nfs/dbraw/zinc/43/72/14/944437214.db2.gz NGQNEFOMWYORSG-INIZCTEOSA-N 0 0 354.406 3.698 20 5 FHBDRN COc1cc(C(=O)N2CCC[C@H](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000518502636 944437363 /nfs/dbraw/zinc/43/73/63/944437363.db2.gz NGQNEFOMWYORSG-MRXNPFEDSA-N 0 0 354.406 3.698 20 5 FHBDRN Cc1cc(NC(=O)N2CCO[C@H](CCc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000473779402 944442489 /nfs/dbraw/zinc/44/24/89/944442489.db2.gz PBFGSTDDBKKPIC-GOSISDBHSA-N 0 0 369.421 3.769 20 5 FHBDRN COc1cc(C(=O)N[C@H]2CCSc3ccc(F)cc32)ccc1[N+](=O)[O-] ZINC000133895404 944451156 /nfs/dbraw/zinc/45/11/56/944451156.db2.gz GJCLSCYASUZCBC-ZDUSSCGKSA-N 0 0 362.382 3.709 20 5 FHBDRN COc1cc(C)c([C@@H](C)NC(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1OC ZINC000046816646 944458195 /nfs/dbraw/zinc/45/81/95/944458195.db2.gz CAFPZZYHYOGUEA-CYBMUJFWSA-N 0 0 358.394 3.720 20 5 FHBDRN CCN(C(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])c1cccnc1C ZINC000439233255 944460170 /nfs/dbraw/zinc/46/01/70/944460170.db2.gz GSVYIQAXVFMLHJ-GFCCVEGCSA-N 0 0 363.801 3.772 20 5 FHBDRN Cc1cc(NC(=O)Cc2cc(C)ccc2C)n(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000517652267 944466678 /nfs/dbraw/zinc/46/66/78/944466678.db2.gz KEFWZGIXRLXCQR-UHFFFAOYSA-N 0 0 364.405 3.887 20 5 FHBDRN Cc1ccc([C@H](C)N(C)C(=O)C(=O)Nc2cccc([N+](=O)[O-])c2C)c(C)c1 ZINC000516084391 944475539 /nfs/dbraw/zinc/47/55/39/944475539.db2.gz ZVXWZDDQQPVHCG-HNNXBMFYSA-N 0 0 369.421 3.678 20 5 FHBDRN O=C([C@@H]1COc2ccccc2O1)N(c1cccc([N+](=O)[O-])c1)C1CCCC1 ZINC000517645206 944476134 /nfs/dbraw/zinc/47/61/34/944476134.db2.gz AVKPYEHIOQJQFR-IBGZPJMESA-N 0 0 368.389 3.710 20 5 FHBDRN O=C(Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1)[C@@H]1CCC[C@H](O)C1 ZINC000439261661 944477667 /nfs/dbraw/zinc/47/76/67/944477667.db2.gz VZPSIOXDUUBRTR-CJNGLKHVSA-N 0 0 356.378 3.877 20 5 FHBDRN C[C@H]1Sc2ccccc2N(S(=O)(=O)c2ccc([N+](=O)[O-])s2)[C@@H]1C ZINC000123879098 944477836 /nfs/dbraw/zinc/47/78/36/944477836.db2.gz LEYVMWINSPBGHY-NXEZZACHSA-N 0 0 370.477 3.734 20 5 FHBDRN Cc1ccc(-c2nc(SCc3nc4cc([N+](=O)[O-])ccc4[nH]3)n[nH]2)cc1 ZINC000473787092 944482790 /nfs/dbraw/zinc/48/27/90/944482790.db2.gz MDOSDRSEZKBKHS-UHFFFAOYSA-N 0 0 366.406 3.857 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]([C@@H]2CCCO2)C1 ZINC000894710132 944485194 /nfs/dbraw/zinc/48/51/94/944485194.db2.gz HLLXOCZSYVHPQU-BBRMVZONSA-N 0 0 364.467 3.738 20 5 FHBDRN C[C@@H](CCn1cc(Br)c([N+](=O)[O-])n1)OCc1ccccc1 ZINC000473787631 944485490 /nfs/dbraw/zinc/48/54/90/944485490.db2.gz NQNJDVXBRZTFPQ-NSHDSACASA-N 0 0 354.204 3.549 20 5 FHBDRN O=C(NC1CC1)c1ccc(NCc2coc3ccccc23)c([N+](=O)[O-])c1 ZINC000511658120 944499638 /nfs/dbraw/zinc/49/96/38/944499638.db2.gz IEFWXCAGMQWHOP-UHFFFAOYSA-N 0 0 351.362 3.845 20 5 FHBDRN Cc1cc(=O)n(Cc2ccc([N+](=O)[O-])cc2Cl)cc1Br ZINC000519569513 944500889 /nfs/dbraw/zinc/50/08/89/944500889.db2.gz RQBBBKDSBKXZPY-UHFFFAOYSA-N 0 0 357.591 3.529 20 5 FHBDRN Cc1ccccc1Oc1ccccc1CNC(=O)c1cc([N+](=O)[O-])c[nH]1 ZINC000518571292 944510662 /nfs/dbraw/zinc/51/06/62/944510662.db2.gz MCZZSJYFUHBEPJ-UHFFFAOYSA-N 0 0 351.362 3.954 20 5 FHBDRN Cc1ccc(OC(F)F)c(CNC(=O)[C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000516128015 944514125 /nfs/dbraw/zinc/51/41/25/944514125.db2.gz MWESYSIJWDKPNU-GFCCVEGCSA-N 0 0 364.348 3.925 20 5 FHBDRN O=C(NC[C@H](CO)Cc1ccco1)c1cc2ccccc2c2cccnc12 ZINC000643154531 944523275 /nfs/dbraw/zinc/52/32/75/944523275.db2.gz PLALCLJAVGWPHX-OAHLLOKOSA-N 0 0 360.413 3.562 20 5 FHBDRN Cc1cccc(C)c1-n1nnnc1COc1cc(C)c([N+](=O)[O-])cc1Cl ZINC000506548864 944530807 /nfs/dbraw/zinc/53/08/07/944530807.db2.gz XOBMPZYGFKUFTO-UHFFFAOYSA-N 0 0 373.800 3.728 20 5 FHBDRN CCc1nn(C)c(NCc2ccnc(Oc3ccc(F)cc3)c2)c1[N+](=O)[O-] ZINC000092829422 944532756 /nfs/dbraw/zinc/53/27/56/944532756.db2.gz RBWXXDUOXRXRPA-UHFFFAOYSA-N 0 0 371.372 3.829 20 5 FHBDRN CC(C)c1ccc(C(=O)N2CCO[C@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000439336479 944533303 /nfs/dbraw/zinc/53/33/03/944533303.db2.gz JSVLTOODTFPLRL-IBGZPJMESA-N 0 0 354.406 3.932 20 5 FHBDRN CNc1ccc(C(=O)N2CC[C@H](c3ccc(Cl)cc3)C2)cc1[N+](=O)[O-] ZINC000517719564 944533510 /nfs/dbraw/zinc/53/35/10/944533510.db2.gz ZNUROYWMXHCVQW-AWEZNQCLSA-N 0 0 359.813 3.920 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N[C@@H](c1ccccc1)C(C)C ZINC000543171716 944544177 /nfs/dbraw/zinc/54/41/77/944544177.db2.gz BKJOKSWYYODRBH-GOSISDBHSA-N 0 0 357.410 3.800 20 5 FHBDRN C[C@H](c1ccc(F)c(Cl)c1)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000516157312 944544461 /nfs/dbraw/zinc/54/44/61/944544461.db2.gz MMQTZBLVKJHMLY-GFCCVEGCSA-N 0 0 364.808 3.666 20 5 FHBDRN COc1cc(C(=O)N[C@@H]2CCC[C@H]2c2ccccc2)c([N+](=O)[O-])cc1OC ZINC000110572492 944546417 /nfs/dbraw/zinc/54/64/17/944546417.db2.gz HNPCNGNZKWLELZ-GOEBONIOSA-N 0 0 370.405 3.678 20 5 FHBDRN Cc1cc(NC[C@H](C(C)C)[NH+]2CCC(C)CC2)c(C(=O)[O-])cc1[N+](=O)[O-] ZINC000516185000 944551987 /nfs/dbraw/zinc/55/19/87/944551987.db2.gz NJBFZLAKUIWWJT-GOSISDBHSA-N 0 0 363.458 3.770 20 5 FHBDRN O=C(NCc1cc(Cl)cc2c1OCC2)[C@H]1C[C@H]1c1cccc([N+](=O)[O-])c1 ZINC001267966275 944561352 /nfs/dbraw/zinc/56/13/52/944561352.db2.gz AHEUZZSYXUXLCH-IRXDYDNUSA-N 0 0 372.808 3.603 20 5 FHBDRN COC(=O)c1cc(C)nc(N2CC[C@H](C)C[C@@H]2c2ccco2)c1[N+](=O)[O-] ZINC000516198579 944570364 /nfs/dbraw/zinc/57/03/64/944570364.db2.gz YLHRXIBAKKKJKK-SMDDNHRTSA-N 0 0 359.382 3.655 20 5 FHBDRN CCc1ccc(NCC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])cc1Cl ZINC000506220228 944575899 /nfs/dbraw/zinc/57/58/99/944575899.db2.gz PHJJVMCDUWCNBV-UHFFFAOYSA-N 0 0 363.801 3.870 20 5 FHBDRN CC[N@H+](Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)C1CCC(C(=O)[O-])CC1 ZINC000517758916 944580080 /nfs/dbraw/zinc/58/00/80/944580080.db2.gz GHXRHYIBRFNZLT-UHFFFAOYSA-N 0 0 373.409 3.715 20 5 FHBDRN CN(Cc1nc(CSCc2ccco2)no1)c1ccccc1[N+](=O)[O-] ZINC000516220489 944583646 /nfs/dbraw/zinc/58/36/46/944583646.db2.gz UOMIHOHTKJTLDH-UHFFFAOYSA-N 0 0 360.395 3.641 20 5 FHBDRN Cc1c(F)ccc([N+](=O)[O-])c1C(=O)N1CCC(c2ccc(O)cc2)CC1 ZINC000843758802 944585182 /nfs/dbraw/zinc/58/51/82/944585182.db2.gz AHICGRHXIPJKPW-UHFFFAOYSA-N 0 0 358.369 3.768 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)NCCCc2c[nH]c3ccc(F)cc23)c1 ZINC000506223071 944585549 /nfs/dbraw/zinc/58/55/49/944585549.db2.gz HTOLHNSXRIAIIN-UHFFFAOYSA-N 0 0 355.369 3.886 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CNc1cccc(C(F)(F)F)c1 ZINC000015289758 944585745 /nfs/dbraw/zinc/58/57/45/944585745.db2.gz CVENDUGTDSRKMV-UHFFFAOYSA-N 0 0 353.300 3.973 20 5 FHBDRN CC(C)C[C@H](C)Oc1cc(CNc2ccc(C(N)=O)cc2[N+](=O)[O-])ccn1 ZINC000110593629 944599883 /nfs/dbraw/zinc/59/98/83/944599883.db2.gz LPUQROYRBAUWJW-ZDUSSCGKSA-N 0 0 372.425 3.514 20 5 FHBDRN COc1ccccc1C[C@H](C)N(C)C(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000541581697 944601245 /nfs/dbraw/zinc/60/12/45/944601245.db2.gz QSPLRWFVQFMFRB-UONOGXRCSA-N 0 0 374.412 3.936 20 5 FHBDRN COc1ccc(CNCC(C)(F)F)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000550258971 944604628 /nfs/dbraw/zinc/60/46/28/944604628.db2.gz LAHVWQPQKDYIIN-UHFFFAOYSA-N 0 0 366.364 3.927 20 5 FHBDRN Cc1nn(Cc2ccc(C(=O)N(C)[C@@H](C)C3(C)CC3)cc2)c(C)c1[N+](=O)[O-] ZINC000438449519 944614411 /nfs/dbraw/zinc/61/44/11/944614411.db2.gz SJFRSCLVLOMQIO-HNNXBMFYSA-N 0 0 370.453 3.717 20 5 FHBDRN CC(C)C[C@@H](C)Oc1cc(CNc2ccc(C(N)=O)cc2[N+](=O)[O-])ccn1 ZINC000110593626 944616225 /nfs/dbraw/zinc/61/62/25/944616225.db2.gz LPUQROYRBAUWJW-CYBMUJFWSA-N 0 0 372.425 3.514 20 5 FHBDRN O=[N+]([O-])c1cncc(Cl)c1OCc1noc(-c2ccc(Cl)cc2)n1 ZINC000506578483 944617046 /nfs/dbraw/zinc/61/70/46/944617046.db2.gz MDRXRQZQWXITDX-UHFFFAOYSA-N 0 0 367.148 3.926 20 5 FHBDRN O=c1c2ccccc2n(Cc2nc(-c3ccc(O)cc3)no2)c2ccccc12 ZINC000436769051 944619555 /nfs/dbraw/zinc/61/95/55/944619555.db2.gz MPCYYUABTJPYHL-UHFFFAOYSA-N 0 0 369.380 3.959 20 5 FHBDRN CCn1nc(C)c([N+](=O)[O-])c1Nc1cnn(Cc2ccc(Cl)cc2)c1 ZINC000519577663 944624157 /nfs/dbraw/zinc/62/41/57/944624157.db2.gz HZTRUHHLGSMRFS-UHFFFAOYSA-N 0 0 360.805 3.761 20 5 FHBDRN CC[C@](C)(NC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12)c1nc(C)cs1 ZINC000150741527 944627560 /nfs/dbraw/zinc/62/75/60/944627560.db2.gz HBCUGCSIDPUEDX-KRWDZBQOSA-N 0 0 358.423 3.896 20 5 FHBDRN CCc1cc(N[C@@H](CCO)c2ccco2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000184346844 944630487 /nfs/dbraw/zinc/63/04/87/944630487.db2.gz UFVHSVJVAPJEHK-INIZCTEOSA-N 0 0 368.393 3.743 20 5 FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCCC[C@@H]1C ZINC000133914496 944630494 /nfs/dbraw/zinc/63/04/94/944630494.db2.gz ITKKRASCQQOJOW-WFASDCNBSA-N 0 0 352.456 3.642 20 5 FHBDRN COc1ccc(CSCC(=O)N[C@H]2CCCCC2(C)C)cc1[N+](=O)[O-] ZINC000466882507 944643712 /nfs/dbraw/zinc/64/37/12/944643712.db2.gz BWEKXTPJADRPJW-INIZCTEOSA-N 0 0 366.483 3.922 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)N[C@H]1CCCc2c(O)cccc21 ZINC000190262818 944656422 /nfs/dbraw/zinc/65/64/22/944656422.db2.gz ZUUPZZANNHJKRW-SFHVURJKSA-N 0 0 369.421 3.686 20 5 FHBDRN Cc1c(F)cc(Cl)c2c1CCCN2C(=O)c1ccc([N+](=O)[O-])n1C ZINC000425632540 944656596 /nfs/dbraw/zinc/65/65/96/944656596.db2.gz RFCMBTGOFFKMHD-UHFFFAOYSA-N 0 0 351.765 3.627 20 5 FHBDRN Cc1cccc(OCC(=O)Nc2ccc(N3CCCCC3)cc2)c1[N+](=O)[O-] ZINC000123948124 944656990 /nfs/dbraw/zinc/65/69/90/944656990.db2.gz NPVBKKIPHMKMKJ-UHFFFAOYSA-N 0 0 369.421 3.911 20 5 FHBDRN COc1ccc(C[C@H](C)CNC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)cc1 ZINC000759875026 944665959 /nfs/dbraw/zinc/66/59/59/944665959.db2.gz PTOWKSYPGRMDPG-XCHKQJEOSA-N 0 0 354.406 3.612 20 5 FHBDRN COc1ccc(CN(C(=O)c2ccccc2[N+](=O)[O-])c2ccncc2)cc1 ZINC000151194902 944671740 /nfs/dbraw/zinc/67/17/40/944671740.db2.gz VJISPZBOOLJDCS-UHFFFAOYSA-N 0 0 363.373 3.845 20 5 FHBDRN CC(C)N(C)c1ccccc1CNC(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000438477572 944678490 /nfs/dbraw/zinc/67/84/90/944678490.db2.gz SOWJDFOAAYSQMT-UHFFFAOYSA-N 0 0 370.453 3.558 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CC[C@](C)(c2ccccc2)C1 ZINC000438490622 944682555 /nfs/dbraw/zinc/68/25/55/944682555.db2.gz LBRIZIWQKLYCNL-FQEVSTJZSA-N 0 0 353.422 3.505 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)c2ccc3c(c2)C(C)(C)C(=O)N3)cc1[N+](=O)[O-] ZINC000426675741 944689755 /nfs/dbraw/zinc/68/97/55/944689755.db2.gz VTGRQQNMFMMARY-LBPRGKRZSA-N 0 0 367.405 3.624 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)N1CCCc2c1cccc2C(F)(F)F ZINC000425636808 944696730 /nfs/dbraw/zinc/69/67/30/944696730.db2.gz UATMCAAIJOATFX-UHFFFAOYSA-N 0 0 365.311 3.910 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CC(Cc2ccc(F)c(F)c2)C1 ZINC000438500826 944697259 /nfs/dbraw/zinc/69/72/59/944697259.db2.gz KEXCSZUSHZRPKM-UHFFFAOYSA-N 0 0 361.348 3.888 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)NC[C@H]2CCC[C@H](C(F)(F)F)C2)c1 ZINC000438512389 944703393 /nfs/dbraw/zinc/70/33/93/944703393.db2.gz XCYVAYGUANFEDV-QWRGUYRKSA-N 0 0 360.332 3.702 20 5 FHBDRN CCOC(=O)N1CCC(Nc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000015129537 944712817 /nfs/dbraw/zinc/71/28/17/944712817.db2.gz SPJWSMUVQOJZAQ-UHFFFAOYSA-N 0 0 361.320 3.646 20 5 FHBDRN O=C([O-])Cc1ccccc1C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000426715741 944716448 /nfs/dbraw/zinc/71/64/48/944716448.db2.gz STDPABXFDRIZPP-UHFFFAOYSA-N 0 0 366.373 3.772 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1CNc1cc(Br)ccc1OC ZINC000429802070 944720146 /nfs/dbraw/zinc/72/01/46/944720146.db2.gz NGIWITUMPQKQLK-UHFFFAOYSA-N 0 0 367.199 3.987 20 5 FHBDRN COc1ccccc1[C@@H]1CC[C@H](C)CN1C(=O)c1ccc([N+](=O)[O-])cc1[O-] ZINC000436860963 944724903 /nfs/dbraw/zinc/72/49/03/944724903.db2.gz RMUDMKKZGMSBFC-GUYCJALGSA-N 0 0 370.405 3.922 20 5 FHBDRN O=C(Nc1nc(C(F)(F)F)c[nH]1)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000506917508 944745211 /nfs/dbraw/zinc/74/52/11/944745211.db2.gz NYQFBJKNYMVQOZ-UHFFFAOYSA-N 0 0 356.285 3.804 20 5 FHBDRN COc1cc(-c2noc(-c3cccc(SC)c3[N+](=O)[O-])n2)ccc1O ZINC000436877165 944745645 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363.443 3.546 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N(C)[C@@H](C)c2c(F)cccc2F)c1 ZINC000517872018 944751347 /nfs/dbraw/zinc/75/13/47/944751347.db2.gz XDQJZKNIOABUOS-JTQLQIEISA-N 0 0 350.321 3.715 20 5 FHBDRN CC[C@@H](c1ccccc1)S(=O)(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000506925393 944757583 /nfs/dbraw/zinc/75/75/83/944757583.db2.gz IFJKIMAMFNQABC-INIZCTEOSA-N 0 0 355.362 3.939 20 5 FHBDRN COc1cc(-c2noc([C@H](C)c3ccc([N+](=O)[O-])cc3F)n2)ccc1O ZINC000436891603 944767875 /nfs/dbraw/zinc/76/78/75/944767875.db2.gz XUSXCVCMRFMJLV-SECBINFHSA-N 0 0 359.313 3.650 20 5 FHBDRN CC[C@H]1CCCC[C@H]1NC(=O)CSCc1ccc(OC)c([N+](=O)[O-])c1 ZINC000027705665 944772036 /nfs/dbraw/zinc/77/20/36/944772036.db2.gz BQMGSNLBYLXHOW-LSDHHAIUSA-N 0 0 366.483 3.922 20 5 FHBDRN CCOC(=O)c1ccnc(N[C@H](C)[C@@H]2Oc3ccccc3[C@H]2C)c1[N+](=O)[O-] ZINC000439591313 944796957 /nfs/dbraw/zinc/79/69/57/944796957.db2.gz BJUQWYVSHIOVIV-PSTGCABASA-N 0 0 371.393 3.532 20 5 FHBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)N1CC[C@H](CC2CC2)C1 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3.611 20 5 FHBDRN CCNc1ccc(C(=O)Nc2cc(-n3cccn3)ccc2C)cc1[N+](=O)[O-] ZINC000475086016 946350070 /nfs/dbraw/zinc/35/00/70/946350070.db2.gz BXSPVTDMFIKZSK-UHFFFAOYSA-N 0 0 365.393 3.773 20 5 FHBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H]1C[C@@H](C)O ZINC000125505478 946351058 /nfs/dbraw/zinc/35/10/58/946351058.db2.gz YLUUQPYRDZIDPN-ZIAGYGMSSA-N 0 0 366.483 3.718 20 5 FHBDRN CCOc1ccc(CN2CCN([C@H](C)c3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000441242995 946352373 /nfs/dbraw/zinc/35/23/73/946352373.db2.gz GRJUDVHBTGMJLK-QGZVFWFLSA-N 0 0 369.465 3.872 20 5 FHBDRN Cc1cc(F)cc(C(=O)Nc2ccc(Br)c(C)n2)c1[N+](=O)[O-] ZINC000121288952 946358086 /nfs/dbraw/zinc/35/80/86/946358086.db2.gz MMYXKCNIUVHJKT-UHFFFAOYSA-N 0 0 368.162 3.761 20 5 FHBDRN C[C@H](NC(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1)[C@@H]1CCOC1 ZINC000438497169 946365149 /nfs/dbraw/zinc/36/51/49/946365149.db2.gz ZVMIWAYRLYIERA-UONOGXRCSA-N 0 0 371.393 3.934 20 5 FHBDRN Cc1ccc(-c2cnc(CCC(=O)NCc3ccccc3[N+](=O)[O-])o2)cc1 ZINC000046149204 946374080 /nfs/dbraw/zinc/37/40/80/946374080.db2.gz QIUCAJXLFQYGTF-UHFFFAOYSA-N 0 0 365.389 3.807 20 5 FHBDRN Cc1nn([C@H](C)C(=O)N[C@H](C)c2ccc3c(c2)CCCC3)c(C)c1[N+](=O)[O-] ZINC000111175324 946377574 /nfs/dbraw/zinc/37/75/74/946377574.db2.gz VNGHVUOICOZBHJ-IUODEOHRSA-N 0 0 370.453 3.725 20 5 FHBDRN Cc1cc([N+](=O)[O-])cnc1NCCc1ccc(F)c(Br)c1 ZINC000111177521 946379004 /nfs/dbraw/zinc/37/90/04/946379004.db2.gz XQORREVLJKPZHB-UHFFFAOYSA-N 0 0 354.179 3.854 20 5 FHBDRN CC(C)[C@@H]1C[C@@H](Cc2nc(CCNc3ccccc3[N+](=O)[O-])no2)CCO1 ZINC000545670368 946379972 /nfs/dbraw/zinc/37/99/72/946379972.db2.gz VXQYETZXXBHNMT-YOEHRIQHSA-N 0 0 374.441 3.626 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1-c1noc(CCSCc2ccccn2)n1 ZINC000545693709 946391786 /nfs/dbraw/zinc/39/17/86/946391786.db2.gz GVLUJTDXBQZIQR-UHFFFAOYSA-N 0 0 356.407 3.824 20 5 FHBDRN O=C(COc1ccccc1[N+](=O)[O-])N[C@@H]1CCC[C@H]1Cc1ccccc1 ZINC000121368205 946423657 /nfs/dbraw/zinc/42/36/57/946423657.db2.gz YAJWDUVYLXXDPS-DLBZAZTESA-N 0 0 354.406 3.501 20 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/nfs/dbraw/zinc/44/42/43/946444243.db2.gz BRBBTDXZGSNCMN-UHFFFAOYSA-N 0 0 368.237 3.645 20 5 FHBDRN Cn1cc([N+](=O)[O-])cc1C(=O)N[C@@H](c1cccs1)c1ccc(F)cc1 ZINC000025812455 946446715 /nfs/dbraw/zinc/44/67/15/946446715.db2.gz KABHCBSLOZRVKJ-MRXNPFEDSA-N 0 0 359.382 3.653 20 5 FHBDRN COC[C@@H](Sc1c([N+](=O)[O-])c(C(F)(F)F)nn1C)c1ccccc1 ZINC000897003575 946450001 /nfs/dbraw/zinc/45/00/01/946450001.db2.gz RTXMYKDTIWDVND-SNVBAGLBSA-N 0 0 361.345 3.827 20 5 FHBDRN COC(=O)C(C)(C)c1ccc(NC(=O)Cc2cccc([N+](=O)[O-])c2C)cc1 ZINC000125523566 946458958 /nfs/dbraw/zinc/45/89/58/946458958.db2.gz HLHGGGXBZLDPGE-UHFFFAOYSA-N 0 0 370.405 3.535 20 5 FHBDRN COC(=O)[C@H](C[C@H]1CCCc2ccccc21)NCc1csc([N+](=O)[O-])c1 ZINC000475146826 946472980 /nfs/dbraw/zinc/47/29/80/946472980.db2.gz ZDRBRUVADUGIMC-WBVHZDCISA-N 0 0 374.462 3.798 20 5 FHBDRN Cc1ccc(C(=O)N(Cc2ccccc2)CC2(O)CCCC2)cc1[N+](=O)[O-] ZINC000475499287 946498917 /nfs/dbraw/zinc/49/89/17/946498917.db2.gz SZVNMTYRLIHIOG-UHFFFAOYSA-N 0 0 368.433 3.851 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](C)C[C@H](O)c2ccc(F)cc2)c1C ZINC000897035247 946504263 /nfs/dbraw/zinc/50/42/63/946504263.db2.gz SCJJFDAJMCVGMU-SJCJKPOMSA-N 0 0 360.385 3.593 20 5 FHBDRN COc1cc(F)c([C@H](C)NC(=O)c2cc([N+](=O)[O-])ccc2C)cc1OC ZINC000074611336 946519047 /nfs/dbraw/zinc/51/90/47/946519047.db2.gz JOKIERJHANLDAD-NSHDSACASA-N 0 0 362.357 3.551 20 5 FHBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NCc1cc(F)ccc1F ZINC000104562124 946519207 /nfs/dbraw/zinc/51/92/07/946519207.db2.gz VPKDLIUMNQGHIV-SECBINFHSA-N 0 0 370.739 3.610 20 5 FHBDRN CCCCCc1nnc(NC(=O)N(C)Cc2ccccc2[N+](=O)[O-])s1 ZINC000043405629 946536692 /nfs/dbraw/zinc/53/66/92/946536692.db2.gz IYIBEANYXBVNCE-UHFFFAOYSA-N 0 0 363.443 3.843 20 5 FHBDRN C[C@@H](CNC(=O)N(C)C[C@H](C)c1nccs1)c1ccccc1[N+](=O)[O-] ZINC000897061342 946548084 /nfs/dbraw/zinc/54/80/84/946548084.db2.gz IJRMAXWBPGRFLP-STQMWFEESA-N 0 0 362.455 3.600 20 5 FHBDRN C[C@H](CNC(=O)N1CCC[C@H]1c1ccncc1)c1ccccc1[N+](=O)[O-] ZINC000897074240 946553128 /nfs/dbraw/zinc/55/31/28/946553128.db2.gz BIPSNKVSTCTODC-PBHICJAKSA-N 0 0 354.410 3.640 20 5 FHBDRN CCN(C(=O)COc1cccc([N+](=O)[O-])c1)c1ccc(Cl)c(F)c1 ZINC000441397938 946554307 /nfs/dbraw/zinc/55/43/07/946554307.db2.gz BCWZYKHAIFJJHU-UHFFFAOYSA-N 0 0 352.749 3.819 20 5 FHBDRN CC(=O)c1ccc2c(c1)CN(C(=O)NC[C@@H](C)c1ccccc1[N+](=O)[O-])C2 ZINC000897064480 946556925 /nfs/dbraw/zinc/55/69/25/946556925.db2.gz YUDUFHGGZZUWKJ-CYBMUJFWSA-N 0 0 367.405 3.626 20 5 FHBDRN C[C@H](CNC(=O)N(C)[C@@H](C)c1cccc(O)c1)c1ccccc1[N+](=O)[O-] ZINC000897070970 946567381 /nfs/dbraw/zinc/56/73/81/946567381.db2.gz KUGOAPFDYHAXOM-KGLIPLIRSA-N 0 0 357.410 3.807 20 5 FHBDRN O=C(N[C@H]1CCO[C@@H](c2ccc(F)cc2)C1)c1cc(F)cc([N+](=O)[O-])c1 ZINC000541631124 946571917 /nfs/dbraw/zinc/57/19/17/946571917.db2.gz MISDLOZZTACNOX-DOTOQJQBSA-N 0 0 362.332 3.523 20 5 FHBDRN CCON(CC1CCCCC1)C(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC001141992944 946575986 /nfs/dbraw/zinc/57/59/86/946575986.db2.gz KARPUOOVQQSPCP-UHFFFAOYSA-N 0 0 372.425 3.755 20 5 FHBDRN O=C(NCc1ccccc1Br)Nc1ccc([N+](=O)[O-])cc1 ZINC000048334124 946579063 /nfs/dbraw/zinc/57/90/63/946579063.db2.gz IMOLLJSYJDQHLA-UHFFFAOYSA-N 0 0 350.172 3.679 20 5 FHBDRN COc1cc(Cc2noc([C@@H](C)c3ccccc3F)n2)ccc1[N+](=O)[O-] ZINC000545765967 946586148 /nfs/dbraw/zinc/58/61/48/946586148.db2.gz FVJXIEFKDDXQJR-NSHDSACASA-N 0 0 357.341 3.868 20 5 FHBDRN CSc1cccc(C(=O)Nc2ccc(-n3cccn3)c(F)c2)c1[N+](=O)[O-] ZINC000186188905 946588417 /nfs/dbraw/zinc/58/84/17/946588417.db2.gz QNUMLXAMMJDWMC-UHFFFAOYSA-N 0 0 372.381 3.894 20 5 FHBDRN COc1cc2nc(C)sc2cc1NC(=O)c1cccc([N+](=O)[O-])c1OC ZINC000475527110 946589151 /nfs/dbraw/zinc/58/91/51/946589151.db2.gz ZHULFFIPMWSGCM-UHFFFAOYSA-N 0 0 373.390 3.782 20 5 FHBDRN Cc1ccc(C)c(CN(C)C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)c1 ZINC000469874721 946592554 /nfs/dbraw/zinc/59/25/54/946592554.db2.gz XXKXZZIOVPJVNH-UHFFFAOYSA-N 0 0 351.406 3.894 20 5 FHBDRN COc1ccc(Cl)cc1CCNC(=O)[C@H]1C[C@H]1c1cccc([N+](=O)[O-])c1 ZINC001126141822 946596304 /nfs/dbraw/zinc/59/63/04/946596304.db2.gz QAYMWRNJWHFDPD-IRXDYDNUSA-N 0 0 374.824 3.719 20 5 FHBDRN C[C@@H]1CC[C@H](NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)[C@@H](C)C1 ZINC001126139345 946597162 /nfs/dbraw/zinc/59/71/62/946597162.db2.gz OUSCPGLMKCVUIT-BFVZDQMLSA-N 0 0 355.232 3.912 20 5 FHBDRN CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)C1C[C@H]2CCC[C@@H](C1)C2=O ZINC000053335381 946603723 /nfs/dbraw/zinc/60/37/23/946603723.db2.gz ZJLTZYYJYQAUTC-FUNVUKJBSA-N 0 0 364.829 3.602 20 5 FHBDRN CC(C)N(Cc1c([N+](=O)[O-])ncn1C)Cc1cccc(Br)c1 ZINC000475531960 946608198 /nfs/dbraw/zinc/60/81/98/946608198.db2.gz QVKPBNLSHIAZAJ-UHFFFAOYSA-N 0 0 367.247 3.501 20 5 FHBDRN COc1cc(C(=O)OCc2ccc(C(C)(C)C)cn2)cc([N+](=O)[O-])c1C ZINC001271440704 946609667 /nfs/dbraw/zinc/60/96/67/946609667.db2.gz LPYBIGGPFPWURJ-UHFFFAOYSA-N 0 0 358.394 3.961 20 5 FHBDRN COc1ccc(-c2nc(CN[C@@H](C)c3ccc(C)c([N+](=O)[O-])c3)no2)cc1 ZINC000181807830 946609929 /nfs/dbraw/zinc/60/99/29/946609929.db2.gz GBKJICYOQNBKIZ-ZDUSSCGKSA-N 0 0 368.393 3.813 20 5 FHBDRN COc1ccc(-c2nc(CN[C@H](C)c3ccc(C)c([N+](=O)[O-])c3)no2)cc1 ZINC000181807813 946610037 /nfs/dbraw/zinc/61/00/37/946610037.db2.gz GBKJICYOQNBKIZ-CYBMUJFWSA-N 0 0 368.393 3.813 20 5 FHBDRN Cc1ccccc1[C@@H]1C[C@H](C)N(C(=O)COc2ccc([N+](=O)[O-])cc2)C1 ZINC000523099291 946611736 /nfs/dbraw/zinc/61/17/36/946611736.db2.gz OYXYXQDHMZAHCQ-JKSUJKDBSA-N 0 0 354.406 3.687 20 5 FHBDRN CCc1ccc(C(=O)NC2(c3ccccc3OC)CCC2)cc1[N+](=O)[O-] ZINC001126142816 946613518 /nfs/dbraw/zinc/61/35/18/946613518.db2.gz KEYSBWPLHOZNCT-UHFFFAOYSA-N 0 0 354.406 3.975 20 5 FHBDRN CCC(=O)CCCOC(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000759589418 946613893 /nfs/dbraw/zinc/61/38/93/946613893.db2.gz DJXJXNDSPRLKFB-UHFFFAOYSA-N 0 0 358.188 3.582 20 5 FHBDRN CSc1cccc(C(=O)N[C@@H](c2ncc(C)s2)C2CC2)c1[N+](=O)[O-] ZINC000186585242 946615354 /nfs/dbraw/zinc/61/53/54/946615354.db2.gz QAFXGMOYJIQNDF-CYBMUJFWSA-N 0 0 363.464 3.963 20 5 FHBDRN C/C(=C\c1ccccc1)CN(C)C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000427560885 946616706 /nfs/dbraw/zinc/61/67/06/946616706.db2.gz WZHUSZXJQSOVGF-JLHYYAGUSA-N 0 0 350.378 3.647 20 5 FHBDRN O=[N+]([O-])c1ccc(Cc2noc([C@H]3C[C@@H]3c3cccc(F)c3F)n2)nc1 ZINC000545781347 946617789 /nfs/dbraw/zinc/61/77/89/946617789.db2.gz QGVOJSJERWFEMV-OLZOCXBDSA-N 0 0 358.304 3.513 20 5 FHBDRN Cc1c(NC(=O)[C@H](C)N2Cc3ccccc3C3(CC3)C2)cccc1[N+](=O)[O-] ZINC000186205711 946619103 /nfs/dbraw/zinc/61/91/03/946619103.db2.gz ZDDYIJLZVVILCP-HNNXBMFYSA-N 0 0 365.433 3.778 20 5 FHBDRN CCOc1ccc(C(=O)N2CCCC[C@@H](SCC)C2)cc1[N+](=O)[O-] ZINC000112039164 946619177 /nfs/dbraw/zinc/61/91/77/946619177.db2.gz JLDBDFOTJSJFFO-CQSZACIVSA-N 0 0 352.456 3.741 20 5 FHBDRN O=C(CN1CCc2cc(Cl)ccc21)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000511896066 946627472 /nfs/dbraw/zinc/62/74/72/946627472.db2.gz MQPQVUSGNSVADJ-UHFFFAOYSA-N 0 0 366.204 3.903 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NCc1cccc(-n2ccnc2)c1 ZINC000475556754 946629815 /nfs/dbraw/zinc/62/98/15/946629815.db2.gz SHKIDXFLHHBPSU-UHFFFAOYSA-N 0 0 365.393 3.719 20 5 FHBDRN COc1cccc(F)c1NC(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186230366 946635996 /nfs/dbraw/zinc/63/59/96/946635996.db2.gz DPWURKGRMBSNNI-UHFFFAOYSA-N 0 0 353.737 3.718 20 5 FHBDRN COc1ccc(O[C@@H](C)CNC(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)cc1 ZINC000475553191 946637123 /nfs/dbraw/zinc/63/71/23/946637123.db2.gz FJTVIJXCPIYVHX-AWEZNQCLSA-N 0 0 373.409 3.809 20 5 FHBDRN C[C@@H]1CCN2[C@@H](C1)C(=O)N[C@@H]2c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000186596518 946637276 /nfs/dbraw/zinc/63/72/76/946637276.db2.gz UZWMHHPZTJUTBE-WHCBVINPSA-N 0 0 357.435 3.552 20 5 FHBDRN COCCOc1cc(Nc2ccc3ncccc3c2[N+](=O)[O-])ccc1OC ZINC000112074059 946655967 /nfs/dbraw/zinc/65/59/67/946655967.db2.gz ICXRVVALNXLOAE-UHFFFAOYSA-N 0 0 369.377 3.920 20 5 FHBDRN Cc1ccc(OCCCCNC(=O)c2c(C)c(F)ccc2[N+](=O)[O-])cc1 ZINC000843767713 946669042 /nfs/dbraw/zinc/66/90/42/946669042.db2.gz NFXGVAREAWKEQU-UHFFFAOYSA-N 0 0 360.385 3.940 20 5 FHBDRN Cc1ccc(NCCCNC(=O)N(C)Cc2ccsc2)c([N+](=O)[O-])c1 ZINC000121407590 946672722 /nfs/dbraw/zinc/67/27/22/946672722.db2.gz FTOKKFKXEDOZOM-UHFFFAOYSA-N 0 0 362.455 3.608 20 5 FHBDRN C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)CCc1nnc(C2CCCC2)o1 ZINC000121417347 946680815 /nfs/dbraw/zinc/68/08/15/946680815.db2.gz NBRAUNWLTYAXMJ-GFCCVEGCSA-N 0 0 370.409 3.546 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NCCN(C)c1ccccc1 ZINC000123409971 946685461 /nfs/dbraw/zinc/68/54/61/946685461.db2.gz RAXNQPYBDYRQNI-UHFFFAOYSA-N 0 0 359.451 3.573 20 5 FHBDRN CC(C)(C)C[C@@H](CO)NC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000475196133 946695004 /nfs/dbraw/zinc/69/50/04/946695004.db2.gz ZOYVLFYMUNUYMG-JTQLQIEISA-N 0 0 363.336 3.532 20 5 FHBDRN Cc1nn(CC(=O)c2ccc(OC(F)F)cc2)c2ccc([N+](=O)[O-])cc12 ZINC000432233687 946707110 /nfs/dbraw/zinc/70/71/10/946707110.db2.gz AWGOMAICFBWACL-UHFFFAOYSA-N 0 0 361.304 3.737 20 5 FHBDRN CC(C)OCCCN(C)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000475210519 946725835 /nfs/dbraw/zinc/72/58/35/946725835.db2.gz PABQIHXMVJTTHH-UHFFFAOYSA-N 0 0 363.336 3.892 20 5 FHBDRN CS[C@@H]1CC[C@H](NC(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)C1 ZINC000125573946 946735303 /nfs/dbraw/zinc/73/53/03/946735303.db2.gz ZTWVSICKBYGIIG-WDEREUQCSA-N 0 0 373.272 3.680 20 5 FHBDRN O=C(CSc1nc2ccc([N+](=O)[O-])cc2s1)Nc1ccc(O)cc1 ZINC000760108177 946741683 /nfs/dbraw/zinc/74/16/83/946741683.db2.gz GHPWQKOEZVTPRL-UHFFFAOYSA-N 0 0 361.404 3.641 20 5 FHBDRN CSc1cccc(C(=O)N2C[C@@H](C)OC[C@@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000186630978 946746992 /nfs/dbraw/zinc/74/69/92/946746992.db2.gz MXSXHENDEYGJQQ-CZUORRHYSA-N 0 0 372.446 3.919 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)c2coc(=O)c3ccccc23)cc1[N+](=O)[O-] ZINC001126610676 946749813 /nfs/dbraw/zinc/74/98/13/946749813.db2.gz GXUMGRFPBLZPHU-LBPRGKRZSA-N 0 0 352.346 3.501 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)NC[C@@H](c1ccccc1)C(F)(F)F ZINC000186626794 946752583 /nfs/dbraw/zinc/75/25/83/946752583.db2.gz MNELBGUGDDYSPH-HNNXBMFYSA-N 0 0 367.327 3.740 20 5 FHBDRN CO[C@@H](c1noc(Cc2cccc([N+](=O)[O-])c2C)n1)c1ccc(F)cc1 ZINC000546508388 946754297 /nfs/dbraw/zinc/75/42/97/946754297.db2.gz XUZRCGFNJJDOHM-QGZVFWFLSA-N 0 0 357.341 3.752 20 5 FHBDRN COc1ccc(CC(=O)N[C@H](C)CSc2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000546020661 946759987 /nfs/dbraw/zinc/75/99/87/946759987.db2.gz PSGTWPRECBCZOR-CQSZACIVSA-N 0 0 374.462 3.751 20 5 FHBDRN COc1ccc(C(=O)NCc2ccccc2[N+](=O)[O-])c(OCC(C)C)c1 ZINC000475257115 946767586 /nfs/dbraw/zinc/76/75/86/946767586.db2.gz RAZNPBQMFCKSHV-UHFFFAOYSA-N 0 0 358.394 3.568 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)c1cn(C)c2ccccc12 ZINC000186641682 946769646 /nfs/dbraw/zinc/76/96/46/946769646.db2.gz UPBZXCFLUNACMX-LBPRGKRZSA-N 0 0 353.378 3.837 20 5 FHBDRN CC(C)c1ccc(CNCc2ncnn2-c2ccccc2)cc1[N+](=O)[O-] ZINC000475292104 946810447 /nfs/dbraw/zinc/81/04/47/946810447.db2.gz DGICMHXDAJZKNP-UHFFFAOYSA-N 0 0 351.410 3.589 20 5 FHBDRN O=C(c1cc(F)c(Cl)c([N+](=O)[O-])c1Cl)N1CC2(CC(F)C2)C1 ZINC000897174732 946814507 /nfs/dbraw/zinc/81/45/07/946814507.db2.gz UGRBCGBVYPUUKB-UHFFFAOYSA-N 0 0 351.136 3.615 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NCC(=O)N[C@H](C)c1ccc(C)c(C)c1 ZINC000025907961 946822670 /nfs/dbraw/zinc/82/26/70/946822670.db2.gz HEAJTRZQCNUUHT-CQSZACIVSA-N 0 0 357.410 3.510 20 5 FHBDRN Cc1nc(NC(=O)CCc2ccc(-c3ccccc3)[nH]2)ccc1[N+](=O)[O-] ZINC000475295777 946833901 /nfs/dbraw/zinc/83/39/01/946833901.db2.gz SHEOERJBACRSJJ-UHFFFAOYSA-N 0 0 350.378 3.865 20 5 FHBDRN CCOc1ccccc1CNC(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000184480693 946833965 /nfs/dbraw/zinc/83/39/65/946833965.db2.gz FGWPCNLPHWJNKD-UHFFFAOYSA-N 0 0 363.801 3.646 20 5 FHBDRN C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)CC[C@H]1O ZINC000186685430 946862453 /nfs/dbraw/zinc/86/24/53/946862453.db2.gz JEGRPJMZKUBKLF-CXAGYDPISA-N 0 0 372.446 3.589 20 5 FHBDRN CCCCC[C@H](NC(=O)c1ccnc(-n2ccc([N+](=O)[O-])n2)c1)C(C)(C)C ZINC001126162620 946867650 /nfs/dbraw/zinc/86/76/50/946867650.db2.gz TZFOCAVBORSBSS-HNNXBMFYSA-N 0 0 373.457 3.900 20 5 FHBDRN CSc1ccc(CNC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000184483678 946871576 /nfs/dbraw/zinc/87/15/76/946871576.db2.gz OMYPTCOMNCGRJB-UHFFFAOYSA-N 0 0 365.842 3.970 20 5 FHBDRN Cc1ccc(-c2noc(-c3cccc(NC(=O)N(C)C)c3)n2)cc1[N+](=O)[O-] ZINC000546273827 946875176 /nfs/dbraw/zinc/87/51/76/946875176.db2.gz LOFMNPOLRRTKRL-UHFFFAOYSA-N 0 0 367.365 3.714 20 5 FHBDRN C[C@@H](NC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1cccc(O)c1 ZINC000112420079 946876543 /nfs/dbraw/zinc/87/65/43/946876543.db2.gz WVCBDOOSQYLCQM-SECBINFHSA-N 0 0 367.308 3.785 20 5 FHBDRN O=[N+]([O-])c1ccccc1NCCNc1nc(C(F)F)nc2ccccc21 ZINC000111106029 946879883 /nfs/dbraw/zinc/87/98/83/946879883.db2.gz QPAQBRVAFCEPOQ-UHFFFAOYSA-N 0 0 359.336 4.000 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1sccc1Br ZINC000048698872 946884209 /nfs/dbraw/zinc/88/42/09/946884209.db2.gz DQKGSHQMBSVNSP-UHFFFAOYSA-N 0 0 355.213 3.691 20 5 FHBDRN O=[N+]([O-])c1cc(-c2nc(-c3cccc4[nH]ccc43)no2)cc2c1OCO2 ZINC000546273967 946887796 /nfs/dbraw/zinc/88/77/96/946887796.db2.gz JEJABDUUGAJUAX-UHFFFAOYSA-N 0 0 350.290 3.522 20 5 FHBDRN C[C@H]1CC[C@@H](NC(=O)c2cc(F)cc3c(=O)c4cccc(F)c4[nH]c23)C1 ZINC000444468758 946890321 /nfs/dbraw/zinc/89/03/21/946890321.db2.gz RIJXERGFVLKURF-CMPLNLGQSA-N 0 0 356.372 3.878 20 5 FHBDRN CCCOCc1ccccc1CNC(=O)c1c(C)c(F)ccc1[N+](=O)[O-] ZINC000843769086 946896289 /nfs/dbraw/zinc/89/62/89/946896289.db2.gz TVEFRLVPTUXMEW-UHFFFAOYSA-N 0 0 360.385 3.899 20 5 FHBDRN COCCOc1ccc(C(=O)Nc2ccc([N+](=O)[O-])c(C)c2)c(Cl)c1 ZINC000186697674 946896402 /nfs/dbraw/zinc/89/64/02/946896402.db2.gz PNBNEVYNSRIUFC-UHFFFAOYSA-N 0 0 364.785 3.834 20 5 FHBDRN CCNc1ccc(C(=O)Nc2c(F)ccc(OCC)c2F)cc1[N+](=O)[O-] ZINC000536282511 946916497 /nfs/dbraw/zinc/91/64/97/946916497.db2.gz YNRPYAHTHKPTLF-UHFFFAOYSA-N 0 0 365.336 3.956 20 5 FHBDRN COc1cc(C(=O)NC2(c3nc(C)cs3)CCCC2)ccc1[N+](=O)[O-] ZINC000112598016 946917532 /nfs/dbraw/zinc/91/75/32/946917532.db2.gz MVEVVFMVWYXTIA-UHFFFAOYSA-N 0 0 361.423 3.568 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2nc(COc3nnc(-c4ccccc4)o3)co2)cc1 ZINC000134048630 946922802 /nfs/dbraw/zinc/92/28/02/946922802.db2.gz LUIPFKRKAVWMGE-UHFFFAOYSA-N 0 0 364.317 3.879 20 5 FHBDRN C[C@@H]1CCN(C(=O)c2c[nH]c3ccc([N+](=O)[O-])cc32)c2c(O)cccc21 ZINC000186328436 946923301 /nfs/dbraw/zinc/92/33/01/946923301.db2.gz MMZXTEJLRQQXMG-LLVKDONJSA-N 0 0 351.362 3.936 20 5 FHBDRN COc1ccc(CN(C)c2cccc(OC)c2[N+](=O)[O-])cc1OC(F)F ZINC000475347334 946928611 /nfs/dbraw/zinc/92/86/11/946928611.db2.gz HTDIKKFDTIJLKS-UHFFFAOYSA-N 0 0 368.336 3.850 20 5 FHBDRN O=C(CCSc1ccccn1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000129733840 946941296 /nfs/dbraw/zinc/94/12/96/946941296.db2.gz JIJQMXITBIUTGA-UHFFFAOYSA-N 0 0 357.435 3.663 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(C)[C@@H](c1ccccc1)C(C)C ZINC000112754807 946944483 /nfs/dbraw/zinc/94/44/83/946944483.db2.gz XSUHXHDXPOZZDM-GOSISDBHSA-N 0 0 369.421 3.697 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)c1ncccc1C(F)(F)F ZINC000186335588 946948843 /nfs/dbraw/zinc/94/88/43/946948843.db2.gz GNUWHIOPXJVDTO-UHFFFAOYSA-N 0 0 359.691 3.592 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N2CC3(CCC3)c3c2cccc3F)c1 ZINC000523178824 946968663 /nfs/dbraw/zinc/96/86/63/946968663.db2.gz LPTFHLNZOSZIDL-UHFFFAOYSA-N 0 0 356.353 3.825 20 5 FHBDRN CCOC(C)(C)CNC(=O)c1cc(F)cc2c(=O)c3cccc(F)c3[nH]c12 ZINC000444519561 946972040 /nfs/dbraw/zinc/97/20/40/946972040.db2.gz MPNDVGCOGYZPRK-UHFFFAOYSA-N 0 0 374.387 3.504 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCc1ccc2c(n1)CCCC2 ZINC000444549820 946990171 /nfs/dbraw/zinc/99/01/71/946990171.db2.gz LOPNKASRDPMSLD-ZDUSSCGKSA-N 0 0 371.462 3.666 20 5 FHBDRN CC(C)OC(=O)C[C@@H](NCc1c(F)cccc1[N+](=O)[O-])c1ccccc1 ZINC000181820755 947001529 /nfs/dbraw/zinc/00/15/29/947001529.db2.gz LBHHAUSFHGGLRP-QGZVFWFLSA-N 0 0 360.385 3.907 20 5 FHBDRN CN(C(=O)c1ccccc1Sc1ccccc1[N+](=O)[O-])[C@H]1CCOC1 ZINC000440455931 947003140 /nfs/dbraw/zinc/00/31/40/947003140.db2.gz BVOKFIBXWSKWQF-ZDUSSCGKSA-N 0 0 358.419 3.607 20 5 FHBDRN O=C(NCC(C1CC1)C1CC1)c1cc([N+](=O)[O-])ccc1Br ZINC000088456084 947005373 /nfs/dbraw/zinc/00/53/73/947005373.db2.gz KPENJCQTTNNEMS-UHFFFAOYSA-N 0 0 353.216 3.523 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N[C@H]1CCc2c1cccc2Cl ZINC000511924780 947010531 /nfs/dbraw/zinc/01/05/31/947010531.db2.gz WDBHVDBKXDIFTB-AWEZNQCLSA-N 0 0 366.826 3.522 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2nc(Cc3c[nH]c4cc(Cl)ccc34)no2)nc1 ZINC000545685151 947018164 /nfs/dbraw/zinc/01/81/64/947018164.db2.gz LUOGHPDBCYQEPS-UHFFFAOYSA-N 0 0 355.741 3.765 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(Cc1cccc(F)c1)C(C)C ZINC000511926591 947020340 /nfs/dbraw/zinc/02/03/40/947020340.db2.gz LOQDSZMAPBFAIN-UHFFFAOYSA-N 0 0 366.414 3.642 20 5 FHBDRN COc1cc(C)c(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)cc1OC ZINC000186348532 947024832 /nfs/dbraw/zinc/02/48/32/947024832.db2.gz ZHTMBBLTURWCKY-UHFFFAOYSA-N 0 0 364.785 3.504 20 5 FHBDRN CC(C)c1ccc(C(=O)N2CCN[C@@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000457011818 947026832 /nfs/dbraw/zinc/02/68/32/947026832.db2.gz FYQHXRNPMWCIME-GOSISDBHSA-N 0 0 353.422 3.505 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(O)cc1CCOC ZINC000444587803 947028586 /nfs/dbraw/zinc/02/85/86/947028586.db2.gz CLULZWOCWQIUDJ-HNNXBMFYSA-N 0 0 372.421 3.697 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)c1ccn(-c2ccc(F)cc2)n1 ZINC000186353067 947029152 /nfs/dbraw/zinc/02/91/52/947029152.db2.gz VDLNLLBMXPQBGW-UHFFFAOYSA-N 0 0 374.759 3.503 20 5 FHBDRN COc1ccccc1[C@H]1CCCN1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444606807 947033115 /nfs/dbraw/zinc/03/31/15/947033115.db2.gz HFRWGTXGUOBIDG-QGZVFWFLSA-N 0 0 352.394 3.817 20 5 FHBDRN Cc1sc(C(=O)NCc2ccc(F)cc2Br)cc1[N+](=O)[O-] ZINC000054263624 947039163 /nfs/dbraw/zinc/03/91/63/947039163.db2.gz FNQQOBFILIILAV-UHFFFAOYSA-N 0 0 373.203 3.796 20 5 FHBDRN CC(C)(C(=O)N1CC2(CCCC2)c2c1cccc2F)n1cc([N+](=O)[O-])cn1 ZINC000523279911 947047639 /nfs/dbraw/zinc/04/76/39/947047639.db2.gz VGPXRRROEJRGDN-UHFFFAOYSA-N 0 0 372.400 3.524 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])N1CCCC[C@@H]1Cc1ccccc1 ZINC000523282843 947050855 /nfs/dbraw/zinc/05/08/55/947050855.db2.gz FZBCMUFAPCBJAM-QGZVFWFLSA-N 0 0 353.422 3.631 20 5 FHBDRN Cc1ccc(S[C@@H](C)C(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000444629277 947060141 /nfs/dbraw/zinc/06/01/41/947060141.db2.gz CCYUTTCRPQZNQQ-LBPRGKRZSA-N 0 0 370.434 3.577 20 5 FHBDRN C[C@@H]1c2cc(F)cc(F)c2CCN1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444649958 947070763 /nfs/dbraw/zinc/07/07/63/947070763.db2.gz RFIBWFASNRGZPU-SNVBAGLBSA-N 0 0 358.348 3.869 20 5 FHBDRN Cc1ccc(C(=O)NCc2ccc(OC(F)(F)F)cc2)cc1[N+](=O)[O-] ZINC000021121605 947075143 /nfs/dbraw/zinc/07/51/43/947075143.db2.gz NYPCGWQJFWQJBN-UHFFFAOYSA-N 0 0 354.284 3.732 20 5 FHBDRN CC(C)(CCC(=O)N[C@@H]1CCC[C@H](c2nc3ccccc3[nH]2)C1)[N+](=O)[O-] ZINC000843683579 947079716 /nfs/dbraw/zinc/07/97/16/947079716.db2.gz AAKPSTWBXTXAFR-UONOGXRCSA-N 0 0 358.442 3.541 20 5 FHBDRN CCc1ccc([C@@H](C)CC(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000444638688 947080488 /nfs/dbraw/zinc/08/04/88/947080488.db2.gz LJFBDLJDCHIPDS-ZDUSSCGKSA-N 0 0 366.421 3.844 20 5 FHBDRN C[C@H](Cc1ccc(Cl)cc1)C(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444639855 947081674 /nfs/dbraw/zinc/08/16/74/947081674.db2.gz BPXQXARQPBHAQA-LLVKDONJSA-N 0 0 372.812 3.620 20 5 FHBDRN O=C(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@H]1C[C@H]1c1ccccc1Cl ZINC000444639210 947081737 /nfs/dbraw/zinc/08/17/37/947081737.db2.gz YHVUHSAYXLKCHF-STQMWFEESA-N 0 0 370.796 3.544 20 5 FHBDRN O=C(Cc1csc2ccccc12)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444640679 947082498 /nfs/dbraw/zinc/08/24/98/947082498.db2.gz DLCRAKJWBMUDOM-UHFFFAOYSA-N 0 0 366.402 3.545 20 5 FHBDRN C[C@@H]1C[C@H](CC(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)CC(C)(C)C1 ZINC000444640284 947083083 /nfs/dbraw/zinc/08/30/83/947083083.db2.gz REKAJWVLSXPIAI-CHWSQXEVSA-N 0 0 358.442 3.940 20 5 FHBDRN CN(C(=O)CCCNc1ccc([N+](=O)[O-])cc1)[C@@H]1CCc2ccccc2C1 ZINC000511950303 947110998 /nfs/dbraw/zinc/11/09/98/947110998.db2.gz XOZGEECLDOGICC-HXUWFJFHSA-N 0 0 367.449 3.803 20 5 FHBDRN Cc1c(Cl)cc(S(=O)(=O)N2CC3(CCC3)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000432291718 947120903 /nfs/dbraw/zinc/12/09/03/947120903.db2.gz NBCRGANSRQXUKU-JTQLQIEISA-N 0 0 358.847 3.510 20 5 FHBDRN CCc1ccc(NC(=O)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)cc1C ZINC000785314996 947134730 /nfs/dbraw/zinc/13/47/30/947134730.db2.gz KYHGCHNQRJZNDW-UHFFFAOYSA-N 0 0 361.785 3.696 20 5 FHBDRN CCOC(=O)[C@@H]1CCN(Cc2ccc([N+](=O)[O-])cc2F)c2ccccc21 ZINC000444708649 947136284 /nfs/dbraw/zinc/13/62/84/947136284.db2.gz RTTDMIGVXMHCTA-MRXNPFEDSA-N 0 0 358.369 3.791 20 5 FHBDRN COC(=O)c1cc(NC(=O)c2cccc3scnc32)c(C)c([N+](=O)[O-])c1 ZINC001271457665 947137917 /nfs/dbraw/zinc/13/79/17/947137917.db2.gz SNSLBOVPWPBRHC-UHFFFAOYSA-N 0 0 371.374 3.552 20 5 FHBDRN O=C(Nc1ccc2nc[nH]c(=O)c2c1)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000523337055 947139664 /nfs/dbraw/zinc/13/96/64/947139664.db2.gz XHJJIRJNKPQWOR-UHFFFAOYSA-N 0 0 366.358 3.711 20 5 FHBDRN CCCN(C(=O)[C@H]1Oc2ccccc2O[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000441433721 947144831 /nfs/dbraw/zinc/14/48/31/947144831.db2.gz GZZQVYSHNCXDQJ-ACJLOTCBSA-N 0 0 356.378 3.566 20 5 FHBDRN CCc1nc(C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)nn1-c1ccccc1 ZINC000444732486 947147447 /nfs/dbraw/zinc/14/74/47/947147447.db2.gz WAYWTDBCWFSAGQ-UHFFFAOYSA-N 0 0 365.393 3.607 20 5 FHBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N(Cc1cccc(F)c1)C(C)C ZINC000511957474 947152342 /nfs/dbraw/zinc/15/23/42/947152342.db2.gz XCEZBDRMCRLUEO-UHFFFAOYSA-N 0 0 366.414 3.642 20 5 FHBDRN Cc1cccc(CCNC(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000523339580 947154971 /nfs/dbraw/zinc/15/49/71/947154971.db2.gz DBJBLGWDZIJATO-ZDUSSCGKSA-N 0 0 362.813 3.683 20 5 FHBDRN COc1cccc(F)c1NC(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000184521669 947158843 /nfs/dbraw/zinc/15/88/43/947158843.db2.gz BBLGEJIVGCVQDZ-JTQLQIEISA-N 0 0 350.371 3.862 20 5 FHBDRN Cc1ccc(C(=O)NCc2ccc(OC3CCCCC3)nc2)cc1[N+](=O)[O-] ZINC000523364837 947186541 /nfs/dbraw/zinc/18/65/41/947186541.db2.gz UFVHVAVAQVDQJA-UHFFFAOYSA-N 0 0 369.421 3.940 20 5 FHBDRN COc1ccc(CN2C[C@]3(C[C@@H]4CC[C@H]3C4)OC(C)(C)C2)cc1[N+](=O)[O-] ZINC000440539181 947187890 /nfs/dbraw/zinc/18/78/90/947187890.db2.gz NMRWIMMITUUMFV-IIMJZQEZSA-N 0 0 360.454 3.773 20 5 FHBDRN CCO[C@@H](C)c1nc(CN(C)c2ncnc3cccc([N+](=O)[O-])c32)cs1 ZINC000544393383 947188095 /nfs/dbraw/zinc/18/80/95/947188095.db2.gz MFWFORKVKCADJN-NSHDSACASA-N 0 0 373.438 3.728 20 5 FHBDRN CCCN(C(=O)c1ccc2c(c1)C(C)(C)C(=O)N2)c1cccc([N+](=O)[O-])c1 ZINC000441434739 947203333 /nfs/dbraw/zinc/20/33/33/947203333.db2.gz KSIMALNSERDDMK-UHFFFAOYSA-N 0 0 367.405 3.881 20 5 FHBDRN O=C1CCc2cc([N+](=O)[O-])c(NCCc3ccc4[nH]ccc4c3)cc2N1 ZINC000440560515 947217547 /nfs/dbraw/zinc/21/75/47/947217547.db2.gz RSEHPXAEHMOJHI-UHFFFAOYSA-N 0 0 350.378 3.615 20 5 FHBDRN COc1ccc(CNC(=O)N(C)[C@@H](C)Cc2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000523410361 947219868 /nfs/dbraw/zinc/21/98/68/947219868.db2.gz MXVCQLANUMFKTJ-HNNXBMFYSA-N 0 0 371.437 3.684 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CCCc3c(O)cccc32)c1 ZINC000190278994 947237221 /nfs/dbraw/zinc/23/72/21/947237221.db2.gz FGVCWTSOYIYABC-HNNXBMFYSA-N 0 0 358.419 3.830 20 5 FHBDRN O=[N+]([O-])c1cc(CN2C[C@@H](O)C3(CC3)C2)ccc1Oc1ccccc1Cl ZINC000428379686 947237269 /nfs/dbraw/zinc/23/72/69/947237269.db2.gz KGUQOWSLAWGGIU-GOSISDBHSA-N 0 0 374.824 3.997 20 5 FHBDRN Cc1cc(NCc2ccc(N)nc2C)c([N+](=O)[O-])cc1Br ZINC001167787227 947244968 /nfs/dbraw/zinc/24/49/68/947244968.db2.gz VFCCCIAAOIHVLG-UHFFFAOYSA-N 0 0 351.204 3.563 20 5 FHBDRN Cc1ccc(C)c([C@@H](C)N(C)S(=O)(=O)c2c(F)cccc2[N+](=O)[O-])c1 ZINC000523416754 947247285 /nfs/dbraw/zinc/24/72/85/947247285.db2.gz BUIUWTPWAJYYTN-CYBMUJFWSA-N 0 0 366.414 3.732 20 5 FHBDRN O=C(c1ccccc1Cl)C1CCN(c2ncc([N+](=O)[O-])s2)CC1 ZINC000897331365 947265721 /nfs/dbraw/zinc/26/57/21/947265721.db2.gz QOXSLBXTENPRBT-UHFFFAOYSA-N 0 0 351.815 3.804 20 5 FHBDRN COC(=O)c1cc(C)cc(C(=O)Oc2cc([N+](=O)[O-])c(Cl)cc2C)c1 ZINC001126196026 947276242 /nfs/dbraw/zinc/27/62/42/947276242.db2.gz QAIBGWDCQCMDAP-UHFFFAOYSA-N 0 0 363.753 3.871 20 5 FHBDRN CC[C@](C)(O)CNC(=O)c1ccc(Sc2ccc(C)cc2)c([N+](=O)[O-])c1 ZINC000440581560 947286730 /nfs/dbraw/zinc/28/67/30/947286730.db2.gz WFCKNMNRSIWJMO-IBGZPJMESA-N 0 0 374.462 3.945 20 5 FHBDRN CCO[C@H](CNc1cc(C)c([N+](=O)[O-])c(C(=O)OC)c1)c1ccccc1 ZINC000444867624 947293961 /nfs/dbraw/zinc/29/39/61/947293961.db2.gz CPPNMFDNYGMAGW-QGZVFWFLSA-N 0 0 358.394 3.880 20 5 FHBDRN CC(C)[C@H]1CCCN(C(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000444364371 947300977 /nfs/dbraw/zinc/30/09/77/947300977.db2.gz MONHUOAXUHDCRG-STQMWFEESA-N 0 0 354.834 3.910 20 5 FHBDRN CC(C)(C)[C@@H]1CCCC[C@@H]1NC(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444885137 947310787 /nfs/dbraw/zinc/31/07/87/947310787.db2.gz MXVXUSLYVXLEHV-KGLIPLIRSA-N 0 0 373.457 3.875 20 5 FHBDRN COc1ccc(NC(=O)N(C)CC2(c3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000444923558 947342699 /nfs/dbraw/zinc/34/26/99/947342699.db2.gz LGADWQVGMSHOQK-UHFFFAOYSA-N 0 0 355.394 3.799 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H](C1CCCC1)C(F)(F)F ZINC000444925415 947343502 /nfs/dbraw/zinc/34/35/02/947343502.db2.gz SGHGRAJABJAZJU-ZDUSSCGKSA-N 0 0 361.320 3.846 20 5 FHBDRN CCC1(CC)CN(C(=O)Nc2ccc([N+](=O)[O-])cc2OC)CCS1 ZINC000444918240 947353108 /nfs/dbraw/zinc/35/31/08/947353108.db2.gz GWCYCCJJTUBDMA-UHFFFAOYSA-N 0 0 353.444 3.743 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@@H](C)Oc1ccccc1C ZINC000444917049 947353494 /nfs/dbraw/zinc/35/34/94/947353494.db2.gz CTODPZFZIOBTFI-CYBMUJFWSA-N 0 0 359.382 3.501 20 5 FHBDRN CC(C)Oc1cc(C(=O)OCc2cccc(N(C)C)c2)ccc1[N+](=O)[O-] ZINC001126503481 947358547 /nfs/dbraw/zinc/35/85/47/947358547.db2.gz CKCHVDYLVVBMAR-UHFFFAOYSA-N 0 0 358.394 3.805 20 5 FHBDRN CCc1cccc2c1N(C(=O)c1ccc(NC3CC3)c([N+](=O)[O-])c1)CC2 ZINC000519921931 947360429 /nfs/dbraw/zinc/36/04/29/947360429.db2.gz NXMLDPCYIKIDEE-UHFFFAOYSA-N 0 0 351.406 3.934 20 5 FHBDRN NC(=O)c1ccc(N2CCc3c(Cl)c(Cl)ccc3C2)c([N+](=O)[O-])c1 ZINC000523539112 947370628 /nfs/dbraw/zinc/37/06/28/947370628.db2.gz IDQIDFMBSBXPCN-UHFFFAOYSA-N 0 0 366.204 3.563 20 5 FHBDRN Cc1ccsc1CNC(=O)NCCCNc1ccc(C)cc1[N+](=O)[O-] ZINC000523567831 947377886 /nfs/dbraw/zinc/37/78/86/947377886.db2.gz IXIMYLGZBLFZCH-UHFFFAOYSA-N 0 0 362.455 3.575 20 5 FHBDRN C[C@H](SCc1ccccc1)C(=O)Nc1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000440623276 947387718 /nfs/dbraw/zinc/38/77/18/947387718.db2.gz JQIUSRLKJKLPSP-ZDUSSCGKSA-N 0 0 367.430 3.825 20 5 FHBDRN COc1cc(C(=O)N(C)c2cccc(SC)c2)c([N+](=O)[O-])cc1OC ZINC000523562355 947388208 /nfs/dbraw/zinc/38/82/08/947388208.db2.gz HBPILXGEBHBGJY-UHFFFAOYSA-N 0 0 362.407 3.611 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)NCc1cccc(COC(C)(C)C)c1 ZINC000523589672 947408086 /nfs/dbraw/zinc/40/80/86/947408086.db2.gz YUGVMVXNRRIKJR-UHFFFAOYSA-N 0 0 372.421 3.849 20 5 FHBDRN O=C(NCCOCc1ccccc1)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000444998200 947410841 /nfs/dbraw/zinc/41/08/41/947410841.db2.gz QSGRHLFQZIMERK-UHFFFAOYSA-N 0 0 372.424 3.628 20 5 FHBDRN Cc1cnc([C@H](C)NC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)s1 ZINC000445019820 947420853 /nfs/dbraw/zinc/42/08/53/947420853.db2.gz MHDHSTUPLAXOGO-LBPRGKRZSA-N 0 0 363.442 3.937 20 5 FHBDRN O=C(Nc1nc(C=Cc2ccccc2)cs1)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC000445003437 947425525 /nfs/dbraw/zinc/42/55/25/947425525.db2.gz HTIQQEQFTZFATQ-VOTSOKGWSA-N 0 0 368.374 3.575 20 5 FHBDRN COCCN(Cc1cc(OC)c(OC)cc1[N+](=O)[O-])[C@@H](C)c1ccccc1 ZINC000508516003 947440879 /nfs/dbraw/zinc/44/08/79/947440879.db2.gz HZLFLICITFJGRI-HNNXBMFYSA-N 0 0 374.437 3.822 20 5 FHBDRN C[C@@H](Oc1cccnc1[N+](=O)[O-])C(=O)Nc1ccc(Cl)cc1Cl ZINC000005970768 947441266 /nfs/dbraw/zinc/44/12/66/947441266.db2.gz PRUXLHYAJQATTL-MRVPVSSYSA-N 0 0 356.165 3.703 20 5 FHBDRN COc1ccc(CNC(=O)N(Cc2ccccc2)C(C)C)cc1[N+](=O)[O-] ZINC000523617481 947446684 /nfs/dbraw/zinc/44/66/84/947446684.db2.gz OTUHDBBYIFBACQ-UHFFFAOYSA-N 0 0 357.410 3.724 20 5 FHBDRN CCN(C(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)c1ccc(F)c(F)c1 ZINC000120325337 947485989 /nfs/dbraw/zinc/48/59/89/947485989.db2.gz YEQBXVYKTMOEDR-UHFFFAOYSA-N 0 0 372.331 3.725 20 5 FHBDRN Cc1ccccc1C[C@H](C)N(C)C(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000445073403 947488256 /nfs/dbraw/zinc/48/82/56/947488256.db2.gz KBNXZDIGMZJRFX-INIZCTEOSA-N 0 0 355.438 3.718 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CC2(CCC2)[C@H]1c1ccccc1 ZINC000432301254 947506850 /nfs/dbraw/zinc/50/68/50/947506850.db2.gz IJTMZALADCFUFS-GOSISDBHSA-N 0 0 372.446 3.819 20 5 FHBDRN C[C@@H]1CN(C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)[C@@H]2CCCC[C@H]21 ZINC000248386389 947507643 /nfs/dbraw/zinc/50/76/43/947507643.db2.gz MKLFQWANFNOJAI-BPQIPLTHSA-N 0 0 371.481 3.848 20 5 FHBDRN CCc1ccc(-c2csc(NC(=O)c3n[nH]c(C)c3[N+](=O)[O-])n2)s1 ZINC000523683629 947512385 /nfs/dbraw/zinc/51/23/85/947512385.db2.gz HZNIMBMZQBEEFW-UHFFFAOYSA-N 0 0 363.424 3.626 20 5 FHBDRN C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)[C@H](C)CO1 ZINC000120339591 947561986 /nfs/dbraw/zinc/56/19/86/947561986.db2.gz BQYSVHQBUBXPBF-ZIAGYGMSSA-N 0 0 356.378 3.637 20 5 FHBDRN CO[C@H]1CCN(c2ccc([N+](=O)[O-])c(OCc3ccccc3)n2)[C@@H](C)C1 ZINC000440669332 947566004 /nfs/dbraw/zinc/56/60/04/947566004.db2.gz FAUJYEHSVFIONW-HOCLYGCPSA-N 0 0 357.410 3.573 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])c1cc(-c2cccc(Cl)c2)on1 ZINC000053868486 947570200 /nfs/dbraw/zinc/57/02/00/947570200.db2.gz HVEKXFAKTCASGD-UHFFFAOYSA-N 0 0 357.753 3.833 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000445185565 947576749 /nfs/dbraw/zinc/57/67/49/947576749.db2.gz QKBFHWVLRSDMNM-UHFFFAOYSA-N 0 0 373.368 3.520 20 5 FHBDRN CN(C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)[C@@H]1CCc2ccccc21 ZINC000027818200 947578521 /nfs/dbraw/zinc/57/85/21/947578521.db2.gz UPCPABIMYMJUMP-GOSISDBHSA-N 0 0 365.433 3.955 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)OCc1ncc(-c2ccc(F)cc2)o1 ZINC000027820322 947591992 /nfs/dbraw/zinc/59/19/92/947591992.db2.gz GSIUFLZLVIHEOQ-UHFFFAOYSA-N 0 0 372.308 3.755 20 5 FHBDRN O=C(NCCCNc1ccccc1)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000445195956 947594933 /nfs/dbraw/zinc/59/49/33/947594933.db2.gz WQBGVPXSOLGWCC-UHFFFAOYSA-N 0 0 371.440 3.913 20 5 FHBDRN COc1cc(CNC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)ccc1C ZINC000445197936 947595415 /nfs/dbraw/zinc/59/54/15/947595415.db2.gz UQHGFWNBLKCUNA-UHFFFAOYSA-N 0 0 372.424 3.928 20 5 FHBDRN O=C(NC[C@@H]1CCCOC1)c1ccccc1Sc1ccccc1[N+](=O)[O-] ZINC000440678229 947598304 /nfs/dbraw/zinc/59/83/04/947598304.db2.gz DWPBPODQJOZYKS-AWEZNQCLSA-N 0 0 372.446 3.902 20 5 FHBDRN COc1ccc(NC(=O)Cc2csc(-c3ccc(C)o3)n2)c([N+](=O)[O-])c1 ZINC000120905664 947601493 /nfs/dbraw/zinc/60/14/93/947601493.db2.gz UIAIPSXHGMDNQL-UHFFFAOYSA-N 0 0 373.390 3.810 20 5 FHBDRN C[C@H]1CC(=O)CC[C@@H]1c1nc(Cc2c[nH]c3ccc([N+](=O)[O-])cc23)no1 ZINC000445232659 947612404 /nfs/dbraw/zinc/61/24/04/947612404.db2.gz BPGSJUKKMAHWKH-HZMBPMFUSA-N 0 0 354.366 3.523 20 5 FHBDRN O=C(NC1Cc2ccccc2C1)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000445221759 947622456 /nfs/dbraw/zinc/62/24/56/947622456.db2.gz XVTMEQQQGTYQAY-UHFFFAOYSA-N 0 0 354.409 3.579 20 5 FHBDRN O=C(NC1(c2nccs2)CCCC1)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000523816972 947635731 /nfs/dbraw/zinc/63/57/31/947635731.db2.gz KXJJTRSFMSLPQF-UHFFFAOYSA-N 0 0 356.407 3.732 20 5 FHBDRN O=C(N[C@H]1CCc2ccccc2C1)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000445249256 947646002 /nfs/dbraw/zinc/64/60/02/947646002.db2.gz LXGKKADQBRPOHB-KRWDZBQOSA-N 0 0 368.436 3.969 20 5 FHBDRN C[C@@H]1CCC[C@@H](NC(=O)c2sc(Br)cc2[N+](=O)[O-])[C@H]1C ZINC000445248174 947646010 /nfs/dbraw/zinc/64/60/10/947646010.db2.gz IZEPGWCCWOLWLT-HRDYMLBCSA-N 0 0 361.261 3.973 20 5 FHBDRN CCNc1ccc(C(=O)N[C@H]2C[C@H]2c2c(F)cccc2F)cc1[N+](=O)[O-] ZINC000523829518 947646811 /nfs/dbraw/zinc/64/68/11/947646811.db2.gz NDDUELCCZWQULD-ABAIWWIYSA-N 0 0 361.348 3.591 20 5 FHBDRN Cc1cnc(Cl)c(NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)c1 ZINC000276481626 947662206 /nfs/dbraw/zinc/66/22/06/947662206.db2.gz LPRRZBQDGKLZEG-UHFFFAOYSA-N 0 0 360.801 3.804 20 5 FHBDRN COc1cccc(N2CCN(Cc3ccc(Cl)cc3[N+](=O)[O-])CC2)c1 ZINC000523842047 947663124 /nfs/dbraw/zinc/66/31/24/947663124.db2.gz AXQBHKBXODJCGF-UHFFFAOYSA-N 0 0 361.829 3.579 20 5 FHBDRN COC(=O)[C@H](NCc1ccc([N+](=O)[O-])cc1Cl)c1cc(C)cc(C)c1 ZINC000428396983 947689099 /nfs/dbraw/zinc/68/90/99/947689099.db2.gz FIXZTHVNJDYZDU-QGZVFWFLSA-N 0 0 362.813 3.869 20 5 FHBDRN COc1ccccc1C[C@H](C)CC(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000536355710 947689672 /nfs/dbraw/zinc/68/96/72/947689672.db2.gz SMYQCSKRRRUYEP-LBPRGKRZSA-N 0 0 368.393 3.687 20 5 FHBDRN CCOc1cnc(-c2noc([C@H](C)Sc3ccc([N+](=O)[O-])cc3)n2)cn1 ZINC000445307689 947693627 /nfs/dbraw/zinc/69/36/27/947693627.db2.gz OLSBPYNOAVYTDO-JTQLQIEISA-N 0 0 373.394 3.687 20 5 FHBDRN O=[N+]([O-])c1cccc(OCc2nc(Cc3ccc4c(c3)CCC4)no2)c1 ZINC000445307425 947693750 /nfs/dbraw/zinc/69/37/50/947693750.db2.gz KVOGJMGWAUWCBB-UHFFFAOYSA-N 0 0 351.362 3.636 20 5 FHBDRN CN(C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](CCO)c1ccccc1 ZINC000440721375 947706850 /nfs/dbraw/zinc/70/68/50/947706850.db2.gz HHAJGVUGAOXVBM-INIZCTEOSA-N 0 0 363.801 3.836 20 5 FHBDRN Cn1c(C(=O)O[C@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)cc2ccccc21 ZINC000759937135 947708911 /nfs/dbraw/zinc/70/89/11/947708911.db2.gz GVCBULOBGQTYGY-WBVHZDCISA-N 0 0 368.393 3.624 20 5 FHBDRN Cc1cccc([C@H](C)C(=O)O[C@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)c1 ZINC000759936796 947710455 /nfs/dbraw/zinc/71/04/55/947710455.db2.gz VQPQGGJXAPXWHJ-UAGQMJEPSA-N 0 0 357.410 3.930 20 5 FHBDRN CCOC(=O)c1cc(C(=O)N2CCCc3cccc(C)c32)cc([N+](=O)[O-])c1 ZINC000053896283 947719428 /nfs/dbraw/zinc/71/94/28/947719428.db2.gz KKZIDQSOEBENFF-UHFFFAOYSA-N 0 0 368.389 3.673 20 5 FHBDRN C[C@@H](NC(=O)N1Cc2ccccc2OC[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000543909092 947721584 /nfs/dbraw/zinc/72/15/84/947721584.db2.gz YMXZQQIRKXFAPB-ZIAGYGMSSA-N 0 0 355.394 3.649 20 5 FHBDRN Cc1ccc2c(COC(=O)c3c(C)cccc3[N+](=O)[O-])cc(=O)oc2c1C ZINC000026116651 947725037 /nfs/dbraw/zinc/72/50/37/947725037.db2.gz HXNHUHGXRVCEAL-UHFFFAOYSA-N 0 0 367.357 3.983 20 5 FHBDRN CCc1ccc(NC(=O)Cc2noc(-c3ccc([N+](=O)[O-])c(C)c3)n2)cc1 ZINC000445323297 947727479 /nfs/dbraw/zinc/72/74/79/947727479.db2.gz XBROUGASPJVVIL-UHFFFAOYSA-N 0 0 366.377 3.697 20 5 FHBDRN O=[N+]([O-])c1cccc2c(N3CCC[C@H](c4nnc5ccccn54)C3)ccnc21 ZINC000432305879 947735156 /nfs/dbraw/zinc/73/51/56/947735156.db2.gz FIIVTZSSRUMOMC-AWEZNQCLSA-N 0 0 374.404 3.570 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1C(=O)OCc1c(F)c(F)c(F)c(F)c1F ZINC000026118718 947754532 /nfs/dbraw/zinc/75/45/32/947754532.db2.gz PMMSTYYIEDIWGC-UHFFFAOYSA-N 0 0 361.222 3.956 20 5 FHBDRN O=C1C[C@H](c2nc(-c3ncc(F)cc3[N+](=O)[O-])no2)c2ccc(Cl)cc21 ZINC001211864174 947777782 /nfs/dbraw/zinc/77/77/82/947777782.db2.gz WYQWDLIOIFPSAM-NSHDSACASA-N 0 0 374.715 3.551 20 5 FHBDRN Cc1ccccc1CCC(=O)O[C@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1 ZINC000759940097 947790890 /nfs/dbraw/zinc/79/08/90/947790890.db2.gz NWTSYPLIHFYJAY-IRXDYDNUSA-N 0 0 357.410 3.759 20 5 FHBDRN O=C(c1ccc(F)c(F)c1F)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000129525749 947796145 /nfs/dbraw/zinc/79/61/45/947796145.db2.gz WVLMENVBUSGCEJ-UHFFFAOYSA-N 0 0 350.296 3.817 20 5 FHBDRN CC[C@H](CSC)NC(=O)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000454766700 947799850 /nfs/dbraw/zinc/79/98/50/947799850.db2.gz RBSXFKFYQPKHOI-HUUCEWRRSA-N 0 0 351.472 3.625 20 5 FHBDRN Cc1cc(NC(=O)NC(C)(C)c2nc3ccccc3n2C)ccc1[N+](=O)[O-] ZINC000184609711 947855113 /nfs/dbraw/zinc/85/51/13/947855113.db2.gz QJZWBENMVWRSEC-UHFFFAOYSA-N 0 0 367.409 3.847 20 5 FHBDRN CC(C)NC(=O)[C@@H]1CCC[C@H](Nc2ccnc3c2cccc3[N+](=O)[O-])C1 ZINC000432310476 947863487 /nfs/dbraw/zinc/86/34/87/947863487.db2.gz BKXDSKLXQYFBLB-KGLIPLIRSA-N 0 0 356.426 3.638 20 5 FHBDRN CCOc1ccc2c(c1)[C@H](Nc1ncnc3ccc([N+](=O)[O-])cc31)CCO2 ZINC000613898852 947870242 /nfs/dbraw/zinc/87/02/42/947870242.db2.gz RAUOROTURFOSJW-QGZVFWFLSA-N 0 0 366.377 3.872 20 5 FHBDRN CC(C)c1nc2n(n1)CCC[C@@H]2Nc1ccnc2c1cccc2[N+](=O)[O-] ZINC000432311415 947872249 /nfs/dbraw/zinc/87/22/49/947872249.db2.gz LAZJDQHJCBPYJU-AWEZNQCLSA-N 0 0 352.398 3.805 20 5 FHBDRN Cc1ccc([C@H](Cn2ccnc2)NC(=O)c2ccc([N+](=O)[O-])s2)c(C)c1 ZINC000441480967 947903650 /nfs/dbraw/zinc/90/36/50/947903650.db2.gz LQVIBTITSYYXSL-HNNXBMFYSA-N 0 0 370.434 3.641 20 5 FHBDRN O=C(NCc1cccc2cccnc21)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000129534108 947903757 /nfs/dbraw/zinc/90/37/57/947903757.db2.gz DVRPGJGJKYKLPN-UHFFFAOYSA-N 0 0 358.357 3.621 20 5 FHBDRN O=C(COc1ccccc1[N+](=O)[O-])OCc1ccc(C(F)(F)F)cc1 ZINC000105216171 947922631 /nfs/dbraw/zinc/92/26/31/947922631.db2.gz UZPCEUTWLLOOIN-UHFFFAOYSA-N 0 0 355.268 3.736 20 5 FHBDRN CSCCCNC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000136777447 947922694 /nfs/dbraw/zinc/92/26/94/947922694.db2.gz CAZGSAOIYVGLCJ-UHFFFAOYSA-N 0 0 359.451 3.690 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N[C@H](C)c1nc(C(F)(F)F)cs1 ZINC000278874419 947934232 /nfs/dbraw/zinc/93/42/32/947934232.db2.gz HIZHCPZPEQZDTD-MRVPVSSYSA-N 0 0 359.329 3.870 20 5 FHBDRN Cc1sc(C(=O)N2CCC(c3ncc4n3CCCC4)CC2)cc1[N+](=O)[O-] ZINC000278874786 947938212 /nfs/dbraw/zinc/93/82/12/947938212.db2.gz CGJQRAJAVUPGHB-UHFFFAOYSA-N 0 0 374.466 3.517 20 5 FHBDRN C[C@H]1CCCN(C(=O)C2CCN(c3c(Cl)cccc3[N+](=O)[O-])CC2)C1 ZINC000432315635 947941545 /nfs/dbraw/zinc/94/15/45/947941545.db2.gz RSOFDEFEHYVZGT-ZDUSSCGKSA-N 0 0 365.861 3.723 20 5 FHBDRN CO[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2SCC(C)C)[C@H](C)C1 ZINC000441486036 947968111 /nfs/dbraw/zinc/96/81/11/947968111.db2.gz MIMJSKCAQYZEJC-UKRRQHHQSA-N 0 0 366.483 3.982 20 5 FHBDRN CC(C)Cn1cc(NC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)cn1 ZINC000125835868 947969080 /nfs/dbraw/zinc/96/90/80/947969080.db2.gz SGCYZTFGSFFIFA-UHFFFAOYSA-N 0 0 357.414 3.644 20 5 FHBDRN CC1(C)CN(C(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])[C@@H]1C1CC1 ZINC000427580637 947972190 /nfs/dbraw/zinc/97/21/90/947972190.db2.gz ZUYOTKGGSQOCGF-CQSZACIVSA-N 0 0 372.343 3.797 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)C2=Cc3cc(F)ccc3OC2)cc1[N+](=O)[O-] ZINC000536393984 947989260 /nfs/dbraw/zinc/98/92/60/947989260.db2.gz FJJOIKNKWDVDHF-GFCCVEGCSA-N 0 0 356.353 3.696 20 5 FHBDRN CCC(=O)Nc1cccc(C(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)c1 ZINC000129547794 947999336 /nfs/dbraw/zinc/99/93/36/947999336.db2.gz TXULKSCYHKMNSB-UHFFFAOYSA-N 0 0 367.405 3.748 20 5 FHBDRN CCOC(=O)[C@@H](C)N(Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C1CC1 ZINC000549610959 948008357 /nfs/dbraw/zinc/00/83/57/948008357.db2.gz RRZITNCEHUMSJC-SNVBAGLBSA-N 0 0 360.332 3.530 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)NCc1cccnc1OC1CCCC1 ZINC000087104248 948019885 /nfs/dbraw/zinc/01/98/85/948019885.db2.gz CCVLLOOIBFKNQH-UHFFFAOYSA-N 0 0 369.421 3.560 20 5 FHBDRN Cc1ccc([C@@H](Cn2ccnc2)NC(=O)c2csc([N+](=O)[O-])c2)c(C)c1 ZINC000441492717 948026535 /nfs/dbraw/zinc/02/65/35/948026535.db2.gz RNEVSQPKPPXNHS-MRXNPFEDSA-N 0 0 370.434 3.641 20 5 FHBDRN O=C(/C=C/c1nc2ccccc2s1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000105427293 948029862 /nfs/dbraw/zinc/02/98/62/948029862.db2.gz QMMOLODDLSHHMI-BQYQJAHWSA-N 0 0 351.387 3.807 20 5 FHBDRN CCSc1ccccc1OS(=O)(=O)CCc1ccccc1[N+](=O)[O-] ZINC000162954678 948035614 /nfs/dbraw/zinc/03/56/14/948035614.db2.gz OFQQDNGHELVFEP-UHFFFAOYSA-N 0 0 367.448 3.658 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCN([C@@H](C)c2nccs2)CC1 ZINC000184644267 948060737 /nfs/dbraw/zinc/06/07/37/948060737.db2.gz MVWARZGECNHRNW-CABCVRRESA-N 0 0 360.483 3.800 20 5 FHBDRN Cc1noc(C)c1CC(=O)N(Cc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000075352061 948078512 /nfs/dbraw/zinc/07/85/12/948078512.db2.gz NHKPVZMKLNTOIS-UHFFFAOYSA-N 0 0 365.389 3.976 20 5 FHBDRN CCOCc1ccc(NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)cc1 ZINC000075356991 948078517 /nfs/dbraw/zinc/07/85/17/948078517.db2.gz UARVAAUPPATJNW-UHFFFAOYSA-N 0 0 355.394 3.958 20 5 FHBDRN O=C(Cc1cccc([N+](=O)[O-])c1)N1CCCCC[C@@H]1[C@@H]1CCCCC1=O ZINC000164528777 948084366 /nfs/dbraw/zinc/08/43/66/948084366.db2.gz NGTMCPMAZRDHHP-ZWKOTPCHSA-N 0 0 358.438 3.668 20 5 FHBDRN O=[N+]([O-])c1cc(CN2CCN(c3ncc(Cl)cc3Cl)CC2)cs1 ZINC000054176446 948093029 /nfs/dbraw/zinc/09/30/29/948093029.db2.gz FRFIMFPYWHRGCL-UHFFFAOYSA-N 0 0 373.265 3.680 20 5 FHBDRN CC(=O)Nc1cccc(OCCNc2ccnc3c2cccc3[N+](=O)[O-])c1 ZINC000432330738 948093628 /nfs/dbraw/zinc/09/36/28/948093628.db2.gz FCWMAVNXRNIEJD-UHFFFAOYSA-N 0 0 366.377 3.592 20 5 FHBDRN O=C(CCc1c(Cl)cccc1[N+](=O)[O-])N[C@@H]1C[C@H]1Cc1ccccc1 ZINC001126288663 948105720 /nfs/dbraw/zinc/10/57/20/948105720.db2.gz HEJLGQZQBNQGSD-RHSMWYFYSA-N 0 0 358.825 3.928 20 5 FHBDRN COc1cccc([C@@H](CNc2ccnc3c2cccc3[N+](=O)[O-])[NH+](C)C)c1 ZINC000432332533 948122436 /nfs/dbraw/zinc/12/24/36/948122436.db2.gz ZBUZAORTHIEVHJ-LJQANCHMSA-N 0 0 366.421 3.866 20 5 FHBDRN CCNC(=O)Nc1cccc(NC(=O)c2ccc(CC)c([N+](=O)[O-])c2)c1C ZINC000278922397 948124101 /nfs/dbraw/zinc/12/41/01/948124101.db2.gz IRMJWJVUMBMCSX-UHFFFAOYSA-N 0 0 370.409 3.859 20 5 FHBDRN CC(C)n1cc2c(n1)C[C@H](Nc1ccnc3c1cccc3[N+](=O)[O-])CC2 ZINC000432333451 948134017 /nfs/dbraw/zinc/13/40/17/948134017.db2.gz GVDIFWJACUJUIA-CQSZACIVSA-N 0 0 351.410 3.890 20 5 FHBDRN CCCN(CC)C(=O)c1ccc(C(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000511996180 948138857 /nfs/dbraw/zinc/13/88/57/948138857.db2.gz GEDCHPVYYPVWKA-UHFFFAOYSA-N 0 0 355.394 3.719 20 5 FHBDRN COc1cc(OC)c(CNc2ccnc3c2cccc3[N+](=O)[O-])c(OC)c1 ZINC000432335083 948144726 /nfs/dbraw/zinc/14/47/26/948144726.db2.gz IGUGPTSMEPTAAJ-UHFFFAOYSA-N 0 0 369.377 3.781 20 5 FHBDRN O=C(CC1CCCC1)NC1CCN(c2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000432340827 948166410 /nfs/dbraw/zinc/16/64/10/948166410.db2.gz PQIAWHIZCLWOEY-UHFFFAOYSA-N 0 0 365.861 3.914 20 5 FHBDRN O=C(CC[S@](=O)CCCCc1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000507771742 948167964 /nfs/dbraw/zinc/16/79/64/948167964.db2.gz GUNMUYWQSPVPDN-AREMUKBSSA-N 0 0 374.462 3.695 20 5 FHBDRN COc1ccc(CCNc2ccnc3c2cccc3[N+](=O)[O-])cc1OC ZINC000432342755 948168794 /nfs/dbraw/zinc/16/87/94/948168794.db2.gz NEBRPGOSWYKBFV-UHFFFAOYSA-N 0 0 353.378 3.815 20 5 FHBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N(C)CCCOC(C)C ZINC000585699816 948173213 /nfs/dbraw/zinc/17/32/13/948173213.db2.gz PSSSLESJJGXKBR-UHFFFAOYSA-N 0 0 373.247 3.553 20 5 FHBDRN CC(=O)N1CCN(c2ccnc3c2cccc3[N+](=O)[O-])CC12CCCCC2 ZINC000432349643 948189995 /nfs/dbraw/zinc/18/99/95/948189995.db2.gz WODMNDCCJKZOOL-UHFFFAOYSA-N 0 0 368.437 3.514 20 5 FHBDRN Cc1sc(C(=O)Nc2ccc(OCc3nccn3C)cc2)cc1[N+](=O)[O-] ZINC000054021873 948215373 /nfs/dbraw/zinc/21/53/73/948215373.db2.gz ZIVLKPWVOXYJPJ-UHFFFAOYSA-N 0 0 372.406 3.530 20 5 FHBDRN COC(=O)c1cc(NC(=O)c2cccc3c2CCCCC3)cc([N+](=O)[O-])c1 ZINC001126300852 948216475 /nfs/dbraw/zinc/21/64/75/948216475.db2.gz VTZBYAYJAQCNKW-UHFFFAOYSA-N 0 0 368.389 3.903 20 5 FHBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)c1cccc(OCC(F)F)n1 ZINC000125934898 948224280 /nfs/dbraw/zinc/22/42/80/948224280.db2.gz GORATBUQPXGTHU-UHFFFAOYSA-N 0 0 371.727 3.848 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1CCCc2cc(Cl)cc(F)c21 ZINC000427593947 948242785 /nfs/dbraw/zinc/24/27/85/948242785.db2.gz MZIDHGZDVWOJDM-UHFFFAOYSA-N 0 0 364.760 3.989 20 5 FHBDRN Cc1ccc(OCC(=O)O[C@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)c(C)c1 ZINC000759953290 948253998 /nfs/dbraw/zinc/25/39/98/948253998.db2.gz XLRBTNCGMCEEBX-WBVHZDCISA-N 0 0 373.409 3.514 20 5 FHBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N(Cc1cccs1)C(C)C ZINC000512037237 948256868 /nfs/dbraw/zinc/25/68/68/948256868.db2.gz PHNRDHXMKWRTDL-UHFFFAOYSA-N 0 0 354.453 3.564 20 5 FHBDRN CC(C)(CC(=O)NCCc1ccc([N+](=O)[O-])cc1)CC(=O)c1ccccc1 ZINC000441553425 948258285 /nfs/dbraw/zinc/25/82/85/948258285.db2.gz CFNRWBHEMIGZFG-UHFFFAOYSA-N 0 0 368.433 3.943 20 5 FHBDRN CC(C)(C)c1ccc(NC(=O)c2ccc3[nH]c(=O)oc3c2)cc1[N+](=O)[O-] ZINC000585753322 948259860 /nfs/dbraw/zinc/25/98/60/948259860.db2.gz CWRHVBGGSIWIRA-UHFFFAOYSA-N 0 0 355.350 3.991 20 5 FHBDRN C[C@@H]1C[C@H]1NC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000585753210 948260553 /nfs/dbraw/zinc/26/05/53/948260553.db2.gz SHVKEVOJEBXLNC-BDJLRTHQSA-N 0 0 359.813 3.999 20 5 FHBDRN CC(C)(C(=O)N1CC(C)(C)O[C@@H]2CCC[C@H]21)c1ccc([N+](=O)[O-])cc1F ZINC000441568799 948266971 /nfs/dbraw/zinc/26/69/71/948266971.db2.gz QZBSSRLAHYHGQB-HZPDHXFCSA-N 0 0 364.417 3.570 20 5 FHBDRN CCOc1ccc2c(c1)[C@H](NC(=O)c1ccc(CC)c([N+](=O)[O-])c1)CCO2 ZINC000613943720 948268307 /nfs/dbraw/zinc/26/83/07/948268307.db2.gz LVVPXUJZLJYXDW-QGZVFWFLSA-N 0 0 370.405 3.810 20 5 FHBDRN O=C(O[C@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)c1cccc2cc[nH]c21 ZINC000759954178 948270633 /nfs/dbraw/zinc/27/06/33/948270633.db2.gz YEUMGMYRGIHLSO-GJZGRUSLSA-N 0 0 354.366 3.613 20 5 FHBDRN O=[N+]([O-])c1cc2c(cc1CN1CCC=C(c3ccccc3)C1)OCCO2 ZINC000585767898 948278442 /nfs/dbraw/zinc/27/84/42/948278442.db2.gz AHKJWHAQPMZMSN-UHFFFAOYSA-N 0 0 352.390 3.655 20 5 FHBDRN Cn1cc(C(F)(F)F)nc1[C@H]1CCCN(c2ccccc2[N+](=O)[O-])C1 ZINC000585783352 948285123 /nfs/dbraw/zinc/28/51/23/948285123.db2.gz SPNOPTUSAWPOPX-NSHDSACASA-N 0 0 354.332 3.731 20 5 FHBDRN CC(C)CCSc1ccc(C(=O)N(C)[C@@H]2CCOC2)cc1[N+](=O)[O-] ZINC000106843643 948319380 /nfs/dbraw/zinc/31/93/80/948319380.db2.gz KTRVDYNYRKJDSN-CQSZACIVSA-N 0 0 352.456 3.594 20 5 FHBDRN Cc1nn(C)c(C(=O)N(CC(C)C)[C@@H](C)c2ccccc2C)c1[N+](=O)[O-] ZINC000585810408 948338592 /nfs/dbraw/zinc/33/85/92/948338592.db2.gz SVKMPLCVYLOIIX-HNNXBMFYSA-N 0 0 358.442 3.805 20 5 FHBDRN C[C@H](CC(=O)Nc1cc(Br)cc([N+](=O)[O-])c1)c1ccncc1 ZINC000585810363 948338661 /nfs/dbraw/zinc/33/86/61/948338661.db2.gz IGJNUNTYRHXFLC-SNVBAGLBSA-N 0 0 364.199 3.885 20 5 FHBDRN COc1ccc(NC(C)=O)cc1N(C(=O)c1ccccc1[N+](=O)[O-])C(C)C ZINC000441609037 948360366 /nfs/dbraw/zinc/36/03/66/948360366.db2.gz JWICKPGAWSXLOJ-UHFFFAOYSA-N 0 0 371.393 3.617 20 5 FHBDRN O=[N+]([O-])c1cc(Br)cnc1N1CC[C@@](F)(c2ccccc2)C1 ZINC000520614720 948399035 /nfs/dbraw/zinc/39/90/35/948399035.db2.gz HUSZPCMQNFLDGK-HNNXBMFYSA-N 0 0 366.190 3.827 20 5 FHBDRN O=[N+]([O-])c1cccc(F)c1CSc1cccc(Cl)c1-c1nn[nH]n1 ZINC000826499376 948415071 /nfs/dbraw/zinc/41/50/71/948415071.db2.gz GOYHSZBHPYOLOQ-UHFFFAOYSA-N 0 0 365.777 3.860 20 5 FHBDRN C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)[C@@H](C)CN1C ZINC000512101887 948418696 /nfs/dbraw/zinc/41/86/96/948418696.db2.gz VTRKPMVQFRRXRA-CABCVRRESA-N 0 0 369.421 3.552 20 5 FHBDRN Cc1ccc(OCCCNC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000512111227 948445930 /nfs/dbraw/zinc/44/59/30/948445930.db2.gz FLWVLWBJKFFUNM-UHFFFAOYSA-N 0 0 371.437 3.556 20 5 FHBDRN CCOC(=O)c1cc(NC2CCC(c3nc(C)no3)CC2)ccc1[N+](=O)[O-] ZINC000467798979 948455985 /nfs/dbraw/zinc/45/59/85/948455985.db2.gz LOLZUENVVOPXBM-UHFFFAOYSA-N 0 0 374.397 3.601 20 5 FHBDRN CCOC(=O)c1ccnc(SCc2cc(C)ccc2OC)c1[N+](=O)[O-] ZINC000467798673 948456959 /nfs/dbraw/zinc/45/69/59/948456959.db2.gz YPPCNHGXFXIXOO-UHFFFAOYSA-N 0 0 362.407 3.776 20 5 FHBDRN CCc1ccc(NC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000107468587 948536176 /nfs/dbraw/zinc/53/61/76/948536176.db2.gz QHXOWVOBMNCTGK-UHFFFAOYSA-N 0 0 354.410 3.511 20 5 FHBDRN Cc1cc(C(=O)N(Cc2cccc(F)c2)C[C@@H]2CCCO2)ccc1[N+](=O)[O-] ZINC000050380234 948544037 /nfs/dbraw/zinc/54/40/37/948544037.db2.gz YZHZPZSWBYJUKA-SFHVURJKSA-N 0 0 372.396 3.864 20 5 FHBDRN COc1ccc(NC(=O)NC(C)(C)c2ccccc2[N+](=O)[O-])cc1OC ZINC000432481785 948548708 /nfs/dbraw/zinc/54/87/08/948548708.db2.gz CSYYQJNRCUYDBB-UHFFFAOYSA-N 0 0 359.382 3.669 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N(C)[C@H](c1ncc[nH]1)c1ccccc1 ZINC000432484822 948557022 /nfs/dbraw/zinc/55/70/22/948557022.db2.gz HNPUQLUCXJAGSC-KRWDZBQOSA-N 0 0 365.393 3.880 20 5 FHBDRN C[C@@H](O)CCCNC(=O)c1cc([N+](=O)[O-])ccc1SCC1CCCC1 ZINC000279161909 948564106 /nfs/dbraw/zinc/56/41/06/948564106.db2.gz QLQOLGRDLLEHKZ-CYBMUJFWSA-N 0 0 366.483 3.768 20 5 FHBDRN O=C(/C=C/c1ccccc1[N+](=O)[O-])O[C@@H]([C@@H]1CCCOC1)C(F)(F)F ZINC000279175155 948581646 /nfs/dbraw/zinc/58/16/46/948581646.db2.gz HVWOITMPEJBRGQ-UJOIQMEZSA-N 0 0 359.300 3.509 20 5 FHBDRN Cc1cccc(Cn2nccc2NC(=O)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000087137016 948593773 /nfs/dbraw/zinc/59/37/73/948593773.db2.gz JGBFKVRJWMZTCR-UHFFFAOYSA-N 0 0 364.405 3.719 20 5 FHBDRN Cc1cc(C)c(C(=O)[C@@H](C)OC(=O)COc2ccc([N+](=O)[O-])cc2)cc1C ZINC000005676505 948604881 /nfs/dbraw/zinc/60/48/81/948604881.db2.gz PHIUSFMCVYJREG-OAHLLOKOSA-N 0 0 371.389 3.713 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCOCC2(CCCC2)C1 ZINC000613961769 948627768 /nfs/dbraw/zinc/62/77/68/948627768.db2.gz DSKSTZYNNZKLTH-QGZVFWFLSA-N 0 0 360.454 3.583 20 5 FHBDRN CCO[C@@H]1CCCC[C@H]1NC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000459141527 948661456 /nfs/dbraw/zinc/66/14/56/948661456.db2.gz GVSLNJWILCYURB-QZTJIDSGSA-N 0 0 363.458 3.863 20 5 FHBDRN O=C(Cc1cc(F)c(Cl)cc1[N+](=O)[O-])N(Cc1ccccn1)C1CC1 ZINC000279246386 948662695 /nfs/dbraw/zinc/66/26/95/948662695.db2.gz HNYLLGVZDGVUCT-UHFFFAOYSA-N 0 0 363.776 3.516 20 5 FHBDRN CC[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)C[C@H]1O ZINC000536467729 948687087 /nfs/dbraw/zinc/68/70/87/948687087.db2.gz MIUOGGBVSRNIAI-CXAGYDPISA-N 0 0 372.446 3.589 20 5 FHBDRN C[C@H]1C[C@H](c2cccnc2)N(C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000182109231 948698333 /nfs/dbraw/zinc/69/83/33/948698333.db2.gz DKUMSOGUVPAEQC-ORAYPTAESA-N 0 0 364.405 3.623 20 5 FHBDRN Cc1cccc(OCCN(C)Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)c1 ZINC000728899507 948704639 /nfs/dbraw/zinc/70/46/39/948704639.db2.gz IEWXVGWTKWZPCX-UHFFFAOYSA-N 0 0 366.421 3.735 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccc(Oc2cc(C)[nH]n2)cc1 ZINC000427629173 948706021 /nfs/dbraw/zinc/70/60/21/948706021.db2.gz LHFXATVYCIBHAC-UHFFFAOYSA-N 0 0 368.349 3.680 20 5 FHBDRN CC(C)COc1ccc(C(C)(C)CNC(=O)c2ccc([N+](=O)[O-])o2)cc1 ZINC000520729185 948731097 /nfs/dbraw/zinc/73/10/97/948731097.db2.gz ZVSUQFDQQUTNJQ-UHFFFAOYSA-N 0 0 360.410 3.930 20 5 FHBDRN CC(C)COc1ccc(C(C)(C)CNC(=O)c2cc([N+](=O)[O-])cn2C)cc1 ZINC000520729540 948733484 /nfs/dbraw/zinc/73/34/84/948733484.db2.gz NDLUJHBSMVECSR-UHFFFAOYSA-N 0 0 373.453 3.676 20 5 FHBDRN C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N(C)Cc1ccc(Cl)c(F)c1 ZINC000536488136 948737541 /nfs/dbraw/zinc/73/75/41/948737541.db2.gz MBTIRJKRROIEFE-LLVKDONJSA-N 0 0 365.792 3.846 20 5 FHBDRN COc1cc(C(C)=O)ccc1O[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000021572942 948745840 /nfs/dbraw/zinc/74/58/40/948745840.db2.gz VFEWCIKKTNFAJE-ZDUSSCGKSA-N 0 0 372.377 3.520 20 5 FHBDRN COc1cc(C(C)=O)ccc1O[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000021572944 948746214 /nfs/dbraw/zinc/74/62/14/948746214.db2.gz VFEWCIKKTNFAJE-CYBMUJFWSA-N 0 0 372.377 3.520 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1C(=O)OCC(=O)c1ccc2c(c1)CCCC2 ZINC000026119300 948753474 /nfs/dbraw/zinc/75/34/74/948753474.db2.gz FOPCZVUGFTXZQC-UHFFFAOYSA-N 0 0 353.374 3.822 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2cc(C(F)(F)F)ccn2)c1 ZINC000549640169 948765439 /nfs/dbraw/zinc/76/54/39/948765439.db2.gz YZTMPYRPWJNPNX-UHFFFAOYSA-N 0 0 355.272 3.660 20 5 FHBDRN COc1ccc(-c2nc(Cc3ccc4c(c3)CCC4)no2)cc1[N+](=O)[O-] ZINC000445398016 948766628 /nfs/dbraw/zinc/76/66/28/948766628.db2.gz OTRZQLYJYHVWNV-UHFFFAOYSA-N 0 0 351.362 3.733 20 5 FHBDRN Cc1cc(NCCCC[NH+]2C[C@@H](C)C[C@H](C)C2)cc(C(=O)[O-])c1[N+](=O)[O-] ZINC000574881206 948791358 /nfs/dbraw/zinc/79/13/58/948791358.db2.gz STUNASVPJTZDDF-KBPBESRZSA-N 0 0 363.458 3.771 20 5 FHBDRN CCOc1cc(-c2noc(Cc3cccc([N+](=O)[O-])c3C)n2)ccc1O ZINC000445429626 948791809 /nfs/dbraw/zinc/79/18/09/948791809.db2.gz AYKOJZQVDVZKCY-UHFFFAOYSA-N 0 0 355.350 3.648 20 5 FHBDRN Cc1cc(Cc2noc(-c3cc([N+](=O)[O-])cc(C(F)(F)F)c3)n2)no1 ZINC000546432876 948802962 /nfs/dbraw/zinc/80/29/62/948802962.db2.gz GIDGJAMGPNSNOY-UHFFFAOYSA-N 0 0 354.244 3.551 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCC(=O)Nc2ccccc2Br)c1 ZINC000021614360 948818061 /nfs/dbraw/zinc/81/80/61/948818061.db2.gz SUOWWIYHLVPGPA-UHFFFAOYSA-N 0 0 365.183 3.683 20 5 FHBDRN O=C(Nc1cccc(Cn2cccn2)c1)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000031968870 210246313 /nfs/dbraw/zinc/24/63/13/210246313.db2.gz BDTHTTRPDXQLFE-UHFFFAOYSA-N 0 0 356.769 3.745 20 5 FHBDRN CCNc1ccc(C(=O)Nc2ccccc2OC(F)F)cc1[N+](=O)[O-] ZINC000015993711 210233399 /nfs/dbraw/zinc/23/33/99/210233399.db2.gz PQHONRJCSHFGFJ-UHFFFAOYSA-N 0 0 351.309 3.880 20 5 FHBDRN O=C(Nc1cnn(Cc2ccccc2)c1)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000071970309 210231991 /nfs/dbraw/zinc/23/19/91/210231991.db2.gz ZREACLVKMAXFGH-UHFFFAOYSA-N 0 0 356.769 3.745 20 5 FHBDRN O=C(c1cc(F)c([N+](=O)[O-])cc1F)N1CCS[C@@H](c2ccccc2)C1 ZINC000359864367 210191488 /nfs/dbraw/zinc/19/14/88/210191488.db2.gz BCPXHLRLLMJTSG-MRXNPFEDSA-N 0 0 364.373 3.803 20 5 FHBDRN CCOC(=O)c1cc(C(=O)Nc2ccc3c(c2)CCC3)cc([N+](=O)[O-])c1 ZINC000007802099 210091998 /nfs/dbraw/zinc/09/19/98/210091998.db2.gz WGOXKXDHWHJESJ-UHFFFAOYSA-N 0 0 354.362 3.513 20 5 FHBDRN CC(=O)Nc1ccc(S[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000006585809 210090734 /nfs/dbraw/zinc/09/07/34/210090734.db2.gz KNFPRUJYVLGFJA-NSHDSACASA-N 0 0 359.407 3.673 20 5 FHBDRN Cc1nn(CC(=O)N(C2CCCCC2)C2CCCCC2)c(C)c1[N+](=O)[O-] ZINC000008985967 219873050 /nfs/dbraw/zinc/87/30/50/219873050.db2.gz TZBRVIZWTCNHGB-UHFFFAOYSA-N 0 0 362.474 3.902 20 5 FHBDRN CCOc1ccccc1C(=O)Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1 ZINC000060859534 212023475 /nfs/dbraw/zinc/02/34/75/212023475.db2.gz BLQQKALWGJDNRN-UHFFFAOYSA-N 0 0 352.350 3.636 20 5 FHBDRN O=C(Nc1cc(-c2cccs2)[nH]n1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000059889049 212017896 /nfs/dbraw/zinc/01/78/96/212017896.db2.gz BITDYGNATGTQEI-UHFFFAOYSA-N 0 0 369.406 3.873 20 5 FHBDRN CN1C(=O)Cc2cc(-c3csc(-c4cccc([N+](=O)[O-])c4)n3)ccc21 ZINC000055050708 211933743 /nfs/dbraw/zinc/93/37/43/211933743.db2.gz BXIMGQGYMGRPBE-UHFFFAOYSA-N 0 0 351.387 3.904 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])Nc1ncc(Cc2ccccc2F)s1 ZINC000046027635 211829599 /nfs/dbraw/zinc/82/95/99/211829599.db2.gz IRBMFNWWKXPIAU-UHFFFAOYSA-N 0 0 371.393 3.962 20 5 FHBDRN O=C(NC[C@@H]1CCN(c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1Cl ZINC000024814622 211414277 /nfs/dbraw/zinc/41/42/77/211414277.db2.gz JJTABZDBHKJTBT-ZDUSSCGKSA-N 0 0 359.813 3.505 20 5 FHBDRN C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1N(C)C)c1cc2ccccc2o1 ZINC000023928303 211398758 /nfs/dbraw/zinc/39/87/58/211398758.db2.gz AUUHEDYHGPIHLV-LBPRGKRZSA-N 0 0 353.378 3.898 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N(C)Cc1ccc(C(F)(F)F)cc1 ZINC000021915245 211331009 /nfs/dbraw/zinc/33/10/09/211331009.db2.gz ZUWFTTICFSNKTH-UHFFFAOYSA-N 0 0 368.311 3.894 20 5 FHBDRN Cc1nn([C@@H](C)C(=O)Nc2c(C)cc(C)cc2Cl)c(C)c1[N+](=O)[O-] ZINC000021549705 211317608 /nfs/dbraw/zinc/31/76/08/211317608.db2.gz KCGCJNUUBXFYFV-LBPRGKRZSA-N 0 0 350.806 3.878 20 5 FHBDRN COC(=O)c1sccc1NC(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000021589350 211316936 /nfs/dbraw/zinc/31/69/36/211316936.db2.gz SKNVFRJIJTZLSL-UHFFFAOYSA-N 0 0 362.407 3.993 20 5 FHBDRN O=C(CSc1ccc2ccccc2n1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000016743565 211168353 /nfs/dbraw/zinc/16/83/53/211168353.db2.gz AOLUIKQGGJKWKH-UHFFFAOYSA-N 0 0 365.414 3.824 20 5 FHBDRN Cc1nc2cc(NC(=O)c3ccc(NC4CC4)c([N+](=O)[O-])c3)ccc2o1 ZINC000015593524 211131916 /nfs/dbraw/zinc/13/19/16/211131916.db2.gz ODJLWZRCHQCADP-UHFFFAOYSA-N 0 0 352.350 3.871 20 5 FHBDRN COc1ccc(C(=O)NCCc2ccc(C(F)(F)F)cc2)cc1[N+](=O)[O-] ZINC000015440001 211130964 /nfs/dbraw/zinc/13/09/64/211130964.db2.gz KLOGKAKAYRULPT-UHFFFAOYSA-N 0 0 368.311 3.595 20 5 FHBDRN Cc1ccc(C(=O)NCCc2ccc(C(F)(F)F)cc2)cc1[N+](=O)[O-] ZINC000015439760 211130096 /nfs/dbraw/zinc/13/00/96/211130096.db2.gz NLSHNPSKOLNMAV-UHFFFAOYSA-N 0 0 352.312 3.895 20 5 FHBDRN CCCCN(c1ccccc1)S(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-] ZINC000071826228 221380361 /nfs/dbraw/zinc/38/03/61/221380361.db2.gz PDYCFQHWCLFQHQ-UHFFFAOYSA-N 0 0 364.423 3.599 20 5 FHBDRN CCOc1ccc(OCC)c(N[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)c1 ZINC000071808403 221378339 /nfs/dbraw/zinc/37/83/39/221378339.db2.gz SLPDLIGHUWYEPV-CYBMUJFWSA-N 0 0 373.409 3.831 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](CC(=O)OC(C)C)c1ccccc1 ZINC000072042911 221399085 /nfs/dbraw/zinc/39/90/85/221399085.db2.gz IFJPQIOBQVBOPX-GOSISDBHSA-N 0 0 370.405 3.716 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)Nc1nc2c(s1)CCCCCC2 ZINC000072021166 221397183 /nfs/dbraw/zinc/39/71/83/221397183.db2.gz KWZAGKGUPQYQIA-UHFFFAOYSA-N 0 0 361.423 3.728 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(N3CCCCC3)cc2)c1 ZINC000096634359 132225553 /nfs/dbraw/zinc/22/55/53/132225553.db2.gz LSSSCJKFGLWGPG-UHFFFAOYSA-N 0 0 355.394 3.846 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1N1CCO[C@@H](c2ccccc2)C1 ZINC000097286504 132228394 /nfs/dbraw/zinc/22/83/94/132228394.db2.gz VBSCQEAXRIPROL-MRXNPFEDSA-N 0 0 363.211 3.935 20 5 FHBDRN CC(=O)c1ccc(N2CCN(Cc3ccc(Cl)cc3)CC2)c([N+](=O)[O-])c1 ZINC000015129117 132373728 /nfs/dbraw/zinc/37/37/28/132373728.db2.gz SOSCAYCNUIRJFG-UHFFFAOYSA-N 0 0 373.840 3.773 20 5 FHBDRN CCCc1n[nH]c(C(=O)N[C@@H]2CCC(C)(C)c3ccccc32)c1[N+](=O)[O-] ZINC000078593405 221667884 /nfs/dbraw/zinc/66/78/84/221667884.db2.gz AYACCTCLPRVYIQ-CQSZACIVSA-N 0 0 356.426 3.813 20 5 FHBDRN O=C(COc1cccc([N+](=O)[O-])c1)N(Cc1ccco1)c1ccccc1 ZINC000105203443 222366060 /nfs/dbraw/zinc/36/60/60/222366060.db2.gz UMTVKFSMVSDMIQ-UHFFFAOYSA-N 0 0 352.346 3.800 20 5 FHBDRN Cc1ccc([C@H](NS(=O)(=O)c2cccc([N+](=O)[O-])c2C)C2CC2)cc1 ZINC000105809365 222376566 /nfs/dbraw/zinc/37/65/66/222376566.db2.gz XWUAXLWGNWMFSG-SFHVURJKSA-N 0 0 360.435 3.641 20 5 FHBDRN Cc1cccc(C(=O)N2CCO[C@H](c3ccc(Cl)cc3)C2)c1[N+](=O)[O-] ZINC000131243832 222539625 /nfs/dbraw/zinc/53/96/25/222539625.db2.gz WZHFZFNCHYCFNU-INIZCTEOSA-N 0 0 360.797 3.770 20 5 FHBDRN CCOc1ccc(C(=O)Nc2ccc(-c3cnco3)cc2)cc1[N+](=O)[O-] ZINC000133175031 222540181 /nfs/dbraw/zinc/54/01/81/222540181.db2.gz PDKDEXCSHXDPRS-UHFFFAOYSA-N 0 0 353.334 3.901 20 5 FHBDRN CC(C)(C)OC(=O)N1CC[C@H](Oc2ccc([N+](=O)[O-])cc2)C(F)(F)C1 ZINC000504815776 263773491 /nfs/dbraw/zinc/77/34/91/263773491.db2.gz MTMVXQYPKBHJBW-ZDUSSCGKSA-N 0 0 358.341 3.618 20 5 FHBDRN C[C@H](Oc1ccccc1F)C(=O)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452866908 567836283 /nfs/dbraw/zinc/83/62/83/567836283.db2.gz HACPXLMPIYRWBR-HOCLYGCPSA-N 0 0 372.396 3.907 20 5 FHBDRN CCCc1nc(C)c(C(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)o1 ZINC000452862810 567837345 /nfs/dbraw/zinc/83/73/45/567837345.db2.gz VEBYEVAAOYUREL-HNNXBMFYSA-N 0 0 357.410 3.864 20 5 FHBDRN O=C(c1c(F)ccc(O)c1F)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452864462 567837503 /nfs/dbraw/zinc/83/75/03/567837503.db2.gz WNJFQYZEFIBQRV-LBPRGKRZSA-N 0 0 362.332 3.598 20 5 FHBDRN Cc1cc(C(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)nn1C(F)F ZINC000452866208 567837656 /nfs/dbraw/zinc/83/76/56/567837656.db2.gz XPYSTKSATCCAHA-ZDUSSCGKSA-N 0 0 364.352 3.515 20 5 FHBDRN CC(=O)c1ccc(C(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)s1 ZINC000452873682 567853637 /nfs/dbraw/zinc/85/36/37/567853637.db2.gz JXWQYQCAFUNLQT-CQSZACIVSA-N 0 0 358.419 3.879 20 5 FHBDRN Cc1cc(NC(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)nn1[C@@H](C)C1CC1 ZINC000481376873 567860963 /nfs/dbraw/zinc/86/09/63/567860963.db2.gz RWIAAOQKMBPBCI-ZDUSSCGKSA-N 0 0 357.414 3.753 20 5 FHBDRN C[C@H](Oc1ccccc1)C(=O)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452872837 567869892 /nfs/dbraw/zinc/86/98/92/567869892.db2.gz JQKCUGLQLVWBAK-DOTOQJQBSA-N 0 0 354.406 3.768 20 5 FHBDRN C[C@@H]1C[C@@H](CNC(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)[C@H](C)O1 ZINC000412637971 567881212 /nfs/dbraw/zinc/88/12/12/567881212.db2.gz HQHZPOCARGSVAS-YCPHGPKFSA-N 0 0 369.421 3.882 20 5 FHBDRN CC[C@@H](CNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21)CC(F)(F)F ZINC000412635208 567882844 /nfs/dbraw/zinc/88/28/44/567882844.db2.gz KCHBQCKNBOHGQZ-LLVKDONJSA-N 0 0 357.332 3.644 20 5 FHBDRN CC[C@H](CNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21)CC(F)(F)F ZINC000412635211 567882907 /nfs/dbraw/zinc/88/29/07/567882907.db2.gz KCHBQCKNBOHGQZ-NSHDSACASA-N 0 0 357.332 3.644 20 5 FHBDRN COc1ccc(C(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)c(OC)c1 ZINC000452881890 567888882 /nfs/dbraw/zinc/88/88/82/567888882.db2.gz ORLITWRPARLACU-OAHLLOKOSA-N 0 0 370.405 3.632 20 5 FHBDRN O=[N+]([O-])c1cc2c(c(-c3nc(-c4ccccc4Cl)no3)c1)OCCO2 ZINC000517905289 567892556 /nfs/dbraw/zinc/89/25/56/567892556.db2.gz QPZYPPNWEMQHRK-UHFFFAOYSA-N 0 0 359.725 3.736 20 5 FHBDRN C[C@@H](OC[C@H](O)CSc1ccc([N+](=O)[O-])cn1)c1ccc(Cl)cc1 ZINC000159189957 567900527 /nfs/dbraw/zinc/90/05/27/567900527.db2.gz SVCJRYVBALBXMU-ABAIWWIYSA-N 0 0 368.842 3.874 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(Br)c(C)c1 ZINC000008076770 567912727 /nfs/dbraw/zinc/91/27/27/567912727.db2.gz SEFSIQYNSLAPIZ-UHFFFAOYSA-N 0 0 365.183 3.927 20 5 FHBDRN CC[C@@H]1[C@@H](C)CC[N@@H+]1Cc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-] ZINC000481414151 567913554 /nfs/dbraw/zinc/91/35/54/567913554.db2.gz OEVMLQBTLVJKSX-WCQYABFASA-N 0 0 358.385 3.868 20 5 FHBDRN O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)Nc1cncc(Cl)c1Cl ZINC000568132936 567921969 /nfs/dbraw/zinc/92/19/69/567921969.db2.gz DCQFLLQTVXYSIO-UHFFFAOYSA-N 0 0 362.119 3.756 20 5 FHBDRN CC(C)CCSc1ccc(C(=O)N(C)CC(C)(C)CO)cc1[N+](=O)[O-] ZINC000452903379 567931553 /nfs/dbraw/zinc/93/15/53/567931553.db2.gz AGJDLEMRFNSFCK-UHFFFAOYSA-N 0 0 368.499 3.824 20 5 FHBDRN O=C1[C@@H]2CC[C@@H](c3ccccc3)N2C(=O)N1c1ccc([N+](=O)[O-])cc1Cl ZINC000366012497 567932775 /nfs/dbraw/zinc/93/27/75/567932775.db2.gz UWKBGVOZFAYBLS-HOCLYGCPSA-N 0 0 371.780 3.921 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N2CC=C(c3ccccc3C)C2)c1C ZINC000541830013 567938615 /nfs/dbraw/zinc/93/86/15/567938615.db2.gz NVCHGJQKPQBVRU-UHFFFAOYSA-N 0 0 372.446 3.608 20 5 FHBDRN CC[C@@H](Oc1ccccc1F)C(=O)N1CCCc2ccc([N+](=O)[O-])cc21 ZINC000481438332 567940198 /nfs/dbraw/zinc/94/01/98/567940198.db2.gz QWVFUWPFJPWEAR-QGZVFWFLSA-N 0 0 358.369 3.871 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H](C)c1ccc2c(c1)OCO2 ZINC000568145681 567941418 /nfs/dbraw/zinc/94/14/18/567941418.db2.gz IOFCOTXGAMDGHL-LLVKDONJSA-N 0 0 357.366 3.769 20 5 FHBDRN COc1cc(C)cc(C(=O)N2CCS[C@@H]2c2ccc([N+](=O)[O-])cc2)c1O ZINC000436588683 567946499 /nfs/dbraw/zinc/94/64/99/567946499.db2.gz IUJYRFCOZBJTAT-GOSISDBHSA-N 0 0 374.418 3.505 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)Nc1nc2cccnc2[nH]1 ZINC000541834477 567954697 /nfs/dbraw/zinc/95/46/97/567954697.db2.gz JFUKLEFGFDPPHC-UHFFFAOYSA-N 0 0 357.395 3.619 20 5 FHBDRN COc1ccc2cccc(CC(=O)NCc3cccc([N+](=O)[O-])c3C)c2c1 ZINC000481461006 567957720 /nfs/dbraw/zinc/95/77/20/567957720.db2.gz CQSJVKAMNRXPCG-UHFFFAOYSA-N 0 0 364.401 3.924 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2nccn2C[C@@H](O)COc2ccc(Cl)cc2)cc1 ZINC000051451933 567958661 /nfs/dbraw/zinc/95/86/61/567958661.db2.gz VNKBRPWWMSTBCJ-MRXNPFEDSA-N 0 0 373.796 3.552 20 5 FHBDRN COc1ccc(C(C)(C)C(=O)NCc2cccc([N+](=O)[O-])c2C)cc1OC ZINC000481470168 567964916 /nfs/dbraw/zinc/96/49/16/567964916.db2.gz WSHBCVJVJJTFGX-UHFFFAOYSA-N 0 0 372.421 3.514 20 5 FHBDRN Cc1oc(-c2ccsc2)nc1CC(=O)NCc1cccc([N+](=O)[O-])c1C ZINC000481465300 567966378 /nfs/dbraw/zinc/96/63/78/567966378.db2.gz OBKICEZTQSCNAI-UHFFFAOYSA-N 0 0 371.418 3.787 20 5 FHBDRN Cc1ccc(C(=O)CCC(=O)NCc2cccc([N+](=O)[O-])c2C)cc1C ZINC000481469785 567967675 /nfs/dbraw/zinc/96/76/75/567967675.db2.gz ZWAKKTBGFLZDNB-UHFFFAOYSA-N 0 0 354.406 3.799 20 5 FHBDRN COc1ccc2nc(C)cc(C(=O)NCc3cccc([N+](=O)[O-])c3C)c2c1 ZINC000481464527 567967802 /nfs/dbraw/zinc/96/78/02/567967802.db2.gz IDLKZRLWNAUZRL-UHFFFAOYSA-N 0 0 365.389 3.698 20 5 FHBDRN Cc1ccc2c(CCC(=O)NCc3cccc([N+](=O)[O-])c3C)c[nH]c2c1 ZINC000481475408 567977827 /nfs/dbraw/zinc/97/78/27/567977827.db2.gz DIOHAFADFUDBRY-UHFFFAOYSA-N 0 0 351.406 3.942 20 5 FHBDRN CCc1cccc2c(CC(=O)NCc3cccc([N+](=O)[O-])c3C)c[nH]c21 ZINC000481475302 567979943 /nfs/dbraw/zinc/97/99/43/567979943.db2.gz SBTMTUROGINUNQ-UHFFFAOYSA-N 0 0 351.406 3.806 20 5 FHBDRN Cc1c(CNC(=O)[C@@H](C)c2cn(C)c3ccccc23)cccc1[N+](=O)[O-] ZINC000481489269 567986831 /nfs/dbraw/zinc/98/68/31/567986831.db2.gz HNYFYORQFQERBG-AWEZNQCLSA-N 0 0 351.406 3.815 20 5 FHBDRN Cc1c(CNC(=O)COc2ccc3ccccc3c2)cccc1[N+](=O)[O-] ZINC000481483857 567988494 /nfs/dbraw/zinc/98/84/94/567988494.db2.gz SICYCPWPSCTCFT-UHFFFAOYSA-N 0 0 350.374 3.752 20 5 FHBDRN O=[N+]([O-])c1ccc2oc(CNCc3ccccc3OCC3CC3)nc2c1 ZINC000602552208 567990860 /nfs/dbraw/zinc/99/08/60/567990860.db2.gz GTNMXSFUTYANFO-UHFFFAOYSA-N 0 0 353.378 3.815 20 5 FHBDRN CC(C)(CCc1noc(C[C@@H](c2ccccc2)C(F)(F)F)n1)[N+](=O)[O-] ZINC000291051827 567991027 /nfs/dbraw/zinc/99/10/27/567991027.db2.gz IINUUAXBXJQFOZ-LBPRGKRZSA-N 0 0 357.332 3.946 20 5 FHBDRN Cc1cccc(C)c1Oc1ccccc1NC(=O)c1cc([N+](=O)[O-])nn1C ZINC000481515141 568005650 /nfs/dbraw/zinc/00/56/50/568005650.db2.gz AZDCTNMXESFWJM-UHFFFAOYSA-N 0 0 366.377 3.990 20 5 FHBDRN CCN(Cc1ccoc1)C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000120366903 568020551 /nfs/dbraw/zinc/02/05/51/568020551.db2.gz KDBPWSJFLAMXQT-UHFFFAOYSA-N 0 0 353.172 3.613 20 5 FHBDRN O=C(Nc1nnc(C2CC2)s1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000064867436 568027195 /nfs/dbraw/zinc/02/71/95/568027195.db2.gz GJZDFXGWDIRAAZ-UHFFFAOYSA-N 0 0 373.419 3.700 20 5 FHBDRN CCCn1ncc(NC(=O)c2ccc(OCC)c([N+](=O)[O-])c2)c1C1CC1 ZINC000452941960 568030835 /nfs/dbraw/zinc/03/08/35/568030835.db2.gz SSHONWJNTXFMIX-UHFFFAOYSA-N 0 0 358.398 3.730 20 5 FHBDRN CCOC(=O)c1cccc(NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)c1 ZINC000008097697 568034193 /nfs/dbraw/zinc/03/41/93/568034193.db2.gz KNKKZRYBFJXNPZ-UHFFFAOYSA-N 0 0 369.377 3.598 20 5 FHBDRN O=C(c1cc2c(c([N+](=O)[O-])c1)OCO2)N1CC[C@H]1c1ccc(Cl)cc1 ZINC000568425297 568034699 /nfs/dbraw/zinc/03/46/99/568034699.db2.gz YSAYKRNNYVWNRP-ZDUSSCGKSA-N 0 0 360.753 3.564 20 5 FHBDRN C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)N3CCC[C@H]3CF)cc2[N+](=O)[O-])C1 ZINC000568552317 568050493 /nfs/dbraw/zinc/05/04/93/568050493.db2.gz VSWGQBDZTCWFGA-LZWOXQAQSA-N 0 0 363.433 3.651 20 5 FHBDRN COc1cc(CN2CC(C3CCC3)C2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000568564456 568050614 /nfs/dbraw/zinc/05/06/14/568050614.db2.gz XUDOVKUQCYOTKK-UHFFFAOYSA-N 0 0 374.359 3.776 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)Nc2c(O)cccc2Cl)c1 ZINC000568567259 568053111 /nfs/dbraw/zinc/05/31/11/568053111.db2.gz TXCGKZHPOZYUIK-UHFFFAOYSA-N 0 0 350.758 3.670 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@H]1c1cccn1C ZINC000072905998 568057116 /nfs/dbraw/zinc/05/71/16/568057116.db2.gz VNXJJEKAJSIGPP-DYVFJYSZSA-N 0 0 359.451 3.778 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CCc1ccccc1O2 ZINC000568572583 568058445 /nfs/dbraw/zinc/05/84/45/568058445.db2.gz PRJCIPZHOIFAJT-FQEVSTJZSA-N 0 0 352.390 3.513 20 5 FHBDRN CC(C)(CCc1noc(Cc2ccc(OC(F)(F)F)cc2)n1)[N+](=O)[O-] ZINC000291128975 568060379 /nfs/dbraw/zinc/06/03/79/568060379.db2.gz VZUIAOQEDASAOH-UHFFFAOYSA-N 0 0 359.304 3.547 20 5 FHBDRN C[C@H](C(=O)NC[C@H]1CCO[C@@H]1c1ccccc1)c1ccc([N+](=O)[O-])cc1F ZINC000481597748 568061499 /nfs/dbraw/zinc/06/14/99/568061499.db2.gz TXNVSAUMGSTEOR-ZBQZNYHESA-N 0 0 372.396 3.731 20 5 FHBDRN Cc1cc(C(=O)CCc2nc(CCC(C)(C)[N+](=O)[O-])no2)c(C)s1 ZINC000291141834 568063207 /nfs/dbraw/zinc/06/32/07/568063207.db2.gz XZANMZURONSUSA-UHFFFAOYSA-N 0 0 351.428 3.551 20 5 FHBDRN COCCC1(C)CN(C(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)C1 ZINC000291168200 568066387 /nfs/dbraw/zinc/06/63/87/568066387.db2.gz IOSCNYLIUWQZDG-UHFFFAOYSA-N 0 0 370.405 3.886 20 5 FHBDRN CSc1ccc(C(=O)NC[C@@H]2CCC3(CCCCC3)O2)cc1[N+](=O)[O-] ZINC000481620291 568068603 /nfs/dbraw/zinc/06/86/03/568068603.db2.gz BEBLEOPVWQXRDA-AWEZNQCLSA-N 0 0 364.467 3.928 20 5 FHBDRN Cc1ccc2[nH]c3c(c2c1)CN(C(=O)Nc1cccc([N+](=O)[O-])c1)CC3 ZINC000024745679 568069506 /nfs/dbraw/zinc/06/95/06/568069506.db2.gz HXNVGFJVMSTRKA-UHFFFAOYSA-N 0 0 350.378 3.975 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)NC[C@@H]1CCC2(CCCCC2)O1 ZINC000481631018 568070572 /nfs/dbraw/zinc/07/05/72/568070572.db2.gz RKJFFIGOQWAWGW-INIZCTEOSA-N 0 0 371.437 3.617 20 5 FHBDRN Cc1cnc(-c2cccc(NC(=O)NCc3cccc([N+](=O)[O-])c3)c2)o1 ZINC000066957822 568072322 /nfs/dbraw/zinc/07/23/22/568072322.db2.gz CBPRIVCCCOZWRP-UHFFFAOYSA-N 0 0 352.350 3.880 20 5 FHBDRN COc1ccc([C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])c(OC)c2)cc1 ZINC000159288063 568097742 /nfs/dbraw/zinc/09/77/42/568097742.db2.gz FFVXSTHADXVLSP-INIZCTEOSA-N 0 0 356.378 3.589 20 5 FHBDRN CCO[C@H]1C[C@H](N(C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1(C)C ZINC000481724935 568098407 /nfs/dbraw/zinc/09/84/07/568098407.db2.gz CUTSDFSECJQLFF-KBPBESRZSA-N 0 0 355.822 3.916 20 5 FHBDRN COc1cc(CSCCC(C)(C)O)c([N+](=O)[O-])cc1OC(F)F ZINC000568648629 568106996 /nfs/dbraw/zinc/10/69/96/568106996.db2.gz ZEHSZXMDIOCARK-UHFFFAOYSA-N 0 0 351.371 3.599 20 5 FHBDRN CS[C@H](CN[C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1)C(C)(C)C ZINC000568671654 568116939 /nfs/dbraw/zinc/11/69/39/568116939.db2.gz ITDBALRHUQSPBM-HZPDHXFCSA-N 0 0 362.499 3.785 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2noc(-c3ncsc3Br)n2)c1 ZINC000490362401 568118503 /nfs/dbraw/zinc/11/85/03/568118503.db2.gz FLBGSQLLHQRMBO-UHFFFAOYSA-N 0 0 353.157 3.531 20 5 FHBDRN Cn1c(C(=O)N[C@@H](c2ccccc2)c2ccc(F)cc2)ccc1[N+](=O)[O-] ZINC000481771275 568119782 /nfs/dbraw/zinc/11/97/82/568119782.db2.gz QSTNFOKYRZLOGG-SFHVURJKSA-N 0 0 353.353 3.592 20 5 FHBDRN O=C(N[C@H]1C[C@H](c2ccc(F)cc2)C1)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000481786514 568128653 /nfs/dbraw/zinc/12/86/53/568128653.db2.gz ZGFDTSMVAFJFOP-MQMHXKEQSA-N 0 0 353.353 3.891 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(NCc2ccc3c(c2)nc(C2CC2)n3C)n1 ZINC000584665678 568129497 /nfs/dbraw/zinc/12/94/97/568129497.db2.gz VVVFAPLMAJNTKE-UHFFFAOYSA-N 0 0 351.410 3.983 20 5 FHBDRN O=[N+]([O-])c1cc(C(F)(F)F)c(Cl)cc1NC[C@H](O)c1ccncc1 ZINC000128666448 568134409 /nfs/dbraw/zinc/13/44/09/568134409.db2.gz HWTADZXJMDLYEK-ZDUSSCGKSA-N 0 0 361.707 3.808 20 5 FHBDRN Cc1noc(C)c1C[C@@H](C)NC(=O)c1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000291402500 568136668 /nfs/dbraw/zinc/13/66/68/568136668.db2.gz DRZCTZHFVREHOT-SSDOTTSWSA-N 0 0 372.208 3.867 20 5 FHBDRN O=C(NC[C@H]1CCC2(CCCCC2)O1)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000481867508 568144694 /nfs/dbraw/zinc/14/46/94/568144694.db2.gz OVUAQHOCDQKKJS-CYBMUJFWSA-N 0 0 357.410 3.688 20 5 FHBDRN O=C(Nc1cc2c(cc1Cl)OCCO2)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000128676108 568149842 /nfs/dbraw/zinc/14/98/42/568149842.db2.gz SUMDQJXZKAWDHN-UHFFFAOYSA-N 0 0 369.160 3.925 20 5 FHBDRN Cc1ccc(C(=O)N[C@H](C[C@@H]2CCOC2)c2ccccc2)cc1[N+](=O)[O-] ZINC000159350094 568158084 /nfs/dbraw/zinc/15/80/84/568158084.db2.gz RGXANZAZLOWXMP-MAUKXSAKSA-N 0 0 354.406 3.801 20 5 FHBDRN COC(=O)c1cc(OCC(=O)c2ccc(C(C)C)cc2)ccc1[N+](=O)[O-] ZINC000481898450 568159056 /nfs/dbraw/zinc/15/90/56/568159056.db2.gz KFOWIAMNDWCESB-UHFFFAOYSA-N 0 0 357.362 3.767 20 5 FHBDRN C[C@H]1CN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)c2cccc(F)c2O1 ZINC000481847470 568159644 /nfs/dbraw/zinc/15/96/44/568159644.db2.gz ZGOYYROQNMJNAS-NSHDSACASA-N 0 0 370.340 3.571 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)C1(c2ccccc2)CCOCC1 ZINC000291491109 568160706 /nfs/dbraw/zinc/16/07/06/568160706.db2.gz SWUGKCKKIQPGTF-UHFFFAOYSA-N 0 0 354.406 3.844 20 5 FHBDRN COC(=O)c1cc(OCc2sccc2Br)ccc1[N+](=O)[O-] ZINC000481904046 568177793 /nfs/dbraw/zinc/17/77/93/568177793.db2.gz YIRHKKTWUAROEL-UHFFFAOYSA-N 0 0 372.196 3.784 20 5 FHBDRN CSCC1CCC(NC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000452990734 568180056 /nfs/dbraw/zinc/18/00/56/568180056.db2.gz ZDWVCEXWDRUCPM-UHFFFAOYSA-N 0 0 356.875 3.829 20 5 FHBDRN COC(=O)c1cc(OCc2csc(Br)c2)ccc1[N+](=O)[O-] ZINC000481925056 568187011 /nfs/dbraw/zinc/18/70/11/568187011.db2.gz QIIQTXBWYDCMEH-UHFFFAOYSA-N 0 0 372.196 3.784 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N1CCc2sccc2[C@@H]1C ZINC000481959880 568196917 /nfs/dbraw/zinc/19/69/17/568196917.db2.gz WTLVILQQNFTDTL-LBPRGKRZSA-N 0 0 366.464 3.581 20 5 FHBDRN NC(=O)c1ccc(COc2ccc(Cc3ccccc3)cc2[N+](=O)[O-])cc1 ZINC000481960011 568196927 /nfs/dbraw/zinc/19/69/27/568196927.db2.gz BKEKNJUJXBLITJ-UHFFFAOYSA-N 0 0 362.385 3.864 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N1CCc2sccc2[C@H]1C ZINC000481959879 568196928 /nfs/dbraw/zinc/19/69/28/568196928.db2.gz WTLVILQQNFTDTL-GFCCVEGCSA-N 0 0 366.464 3.581 20 5 FHBDRN COC(=O)c1cc(OCc2ccc(Br)cc2)ccc1[N+](=O)[O-] ZINC000481961854 568196980 /nfs/dbraw/zinc/19/69/80/568196980.db2.gz NJLGGMLRTXIGDQ-UHFFFAOYSA-N 0 0 366.167 3.723 20 5 FHBDRN C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000481981472 568213414 /nfs/dbraw/zinc/21/34/14/568213414.db2.gz CLBNORRROISBNF-JOYOIKCWSA-N 0 0 364.751 3.980 20 5 FHBDRN CCN(c1ccc(F)cc1)S(=O)(=O)c1c(C)cc([N+](=O)[O-])cc1C ZINC000481983593 568215392 /nfs/dbraw/zinc/21/53/92/568215392.db2.gz RGJHFFQDPZDJIF-UHFFFAOYSA-N 0 0 352.387 3.566 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(N2CCC(CN3CCc4ccccc43)CC2)n1 ZINC000481993015 568216072 /nfs/dbraw/zinc/21/60/72/568216072.db2.gz QQUYNBHBBHFVPN-UHFFFAOYSA-N 0 0 352.438 3.577 20 5 FHBDRN Cc1ccc(S(=O)(=O)N(Cc2ccccc2)[C@@H](C)C2CC2)cc1[N+](=O)[O-] ZINC000007213420 568216292 /nfs/dbraw/zinc/21/62/92/568216292.db2.gz SWNYLRIZZFZBJW-HNNXBMFYSA-N 0 0 374.462 3.893 20 5 FHBDRN COc1cc(C(=O)N[C@@H](C)C2CCCC2)c([N+](=O)[O-])cc1OC(F)F ZINC000265035764 568220934 /nfs/dbraw/zinc/22/09/34/568220934.db2.gz CFNJBOKKBWYWPB-VIFPVBQESA-N 0 0 358.341 3.513 20 5 FHBDRN O=[N+]([O-])c1cc(S(=O)(=O)N2CCCCC2)ccc1NC1CCCCC1 ZINC000006923043 568226477 /nfs/dbraw/zinc/22/64/77/568226477.db2.gz XONPYDGWMJIYII-UHFFFAOYSA-N 0 0 367.471 3.514 20 5 FHBDRN C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000482010693 568226818 /nfs/dbraw/zinc/22/68/18/568226818.db2.gz RFLNILLIXDPMLR-RYUDHWBXSA-N 0 0 360.332 3.553 20 5 FHBDRN CCn1c(SC[C@@H]2CCC[C@H](O)C2)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000291639656 568236457 /nfs/dbraw/zinc/23/64/57/568236457.db2.gz MJTKREIGKXARER-DOMZBBRYSA-N 0 0 362.455 3.516 20 5 FHBDRN CCn1c(SC[C@H]2CCC[C@H](O)C2)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000291639664 568236473 /nfs/dbraw/zinc/23/64/73/568236473.db2.gz MJTKREIGKXARER-WFASDCNBSA-N 0 0 362.455 3.516 20 5 FHBDRN C[C@H](C(=O)N[C@@H](c1ccccc1)C(F)F)c1ccc([N+](=O)[O-])cc1F ZINC000482048378 568238628 /nfs/dbraw/zinc/23/86/28/568238628.db2.gz YHYFWUSKYXLXIF-BONVTDFDSA-N 0 0 352.312 3.960 20 5 FHBDRN C[C@@H](CNC(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1)CC(F)(F)F ZINC000412652921 568246920 /nfs/dbraw/zinc/24/69/20/568246920.db2.gz JJISBQJNDWPNST-NXEZZACHSA-N 0 0 350.362 3.780 20 5 FHBDRN COc1ccc([C@H]2CCCN2C(=O)c2ccc(C)c([N+](=O)[O-])c2)c(OC)c1 ZINC000015829888 568252584 /nfs/dbraw/zinc/25/25/84/568252584.db2.gz GGRBDEAFTIONPH-QGZVFWFLSA-N 0 0 370.405 3.898 20 5 FHBDRN COc1ccc([C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])cc2)c(OC)c1 ZINC000015829192 568252593 /nfs/dbraw/zinc/25/25/93/568252593.db2.gz RQOBGWOOLNGCGE-KRWDZBQOSA-N 0 0 356.378 3.589 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1)c1cccc(OCc2cscn2)c1 ZINC000016199902 568253227 /nfs/dbraw/zinc/25/32/27/568253227.db2.gz CGGJXJUKQVRXHZ-UHFFFAOYSA-N 0 0 355.375 3.883 20 5 FHBDRN Cc1ccc(-c2noc(-c3cccnc3OCC(F)F)n2)cc1[N+](=O)[O-] ZINC000568915237 568254361 /nfs/dbraw/zinc/25/43/61/568254361.db2.gz WEOMMINCUBMIEU-UHFFFAOYSA-N 0 0 362.292 3.659 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(N2CCO[C@@H](c3ccc(F)c(Cl)c3)C2)n1 ZINC000541935554 568257710 /nfs/dbraw/zinc/25/77/10/568257710.db2.gz YBAPHSGTMLOXSZ-OAHLLOKOSA-N 0 0 365.792 3.977 20 5 FHBDRN COc1ccc2c(c1)C[C@H](C)N(C(=O)c1cc([N+](=O)[O-])ccc1OC)[C@H]2C ZINC000541934490 568259178 /nfs/dbraw/zinc/25/91/78/568259178.db2.gz QKLNIVINGMKFRU-STQMWFEESA-N 0 0 370.405 3.760 20 5 FHBDRN Cc1noc([C@@H](C)N(C)Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)n1 ZINC000569001869 568263011 /nfs/dbraw/zinc/26/30/11/568263011.db2.gz NFYBRZIRANPIOM-SNVBAGLBSA-N 0 0 359.411 3.603 20 5 FHBDRN O=C(c1nc2ccccc2cc1Cl)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000584691302 568264426 /nfs/dbraw/zinc/26/44/26/568264426.db2.gz ANOIZEKDLPXLEY-UHFFFAOYSA-N 0 0 367.792 3.995 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)Nc1nc(-c2ccccc2F)co1 ZINC000482129687 568269416 /nfs/dbraw/zinc/26/94/16/568269416.db2.gz SRKCQAFXRMZGAE-UHFFFAOYSA-N 0 0 355.325 3.960 20 5 FHBDRN C[C@H]1CC[C@]2(CCN(CC(=O)Nc3ccc([N+](=O)[O-])cc3Cl)C2)C1 ZINC000541949699 568270799 /nfs/dbraw/zinc/27/07/99/568270799.db2.gz VBOZPAFPNUHIDU-SJCJKPOMSA-N 0 0 351.834 3.699 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1N[C@H]1CCN([C@H](C)c2ccc(F)cc2)C1=O ZINC000453059196 568275900 /nfs/dbraw/zinc/27/59/00/568275900.db2.gz LYKYKUSBKRGZNG-WBMJQRKESA-N 0 0 373.384 3.517 20 5 FHBDRN C[C@@]1(c2ccccc2)CCCN(c2cccc(C(N)=O)c2[N+](=O)[O-])CC1 ZINC000569133015 568285790 /nfs/dbraw/zinc/28/57/90/568285790.db2.gz AJOCCEOXDIKVKF-HXUWFJFHSA-N 0 0 353.422 3.642 20 5 FHBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc2c(c1)CCO2 ZINC000604442292 568288874 /nfs/dbraw/zinc/28/88/74/568288874.db2.gz FGLLJBONEZHOHW-JTQLQIEISA-N 0 0 362.769 3.589 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1NC(=O)CN(C)Cc1c(F)cccc1Cl ZINC000008065020 568290501 /nfs/dbraw/zinc/29/05/01/568290501.db2.gz IHCRLNDPNSONSK-UHFFFAOYSA-N 0 0 365.792 3.766 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)NCc2cccc(Cl)c2)cc1SC ZINC000482155242 568292433 /nfs/dbraw/zinc/29/24/33/568292433.db2.gz SFSBWHVQYINVOL-UHFFFAOYSA-N 0 0 366.826 3.909 20 5 FHBDRN C[C@H]1C[C@H](C)CN(c2ccc(C(=O)N[C@@H]3CCC[C@@H]3F)cc2[N+](=O)[O-])C1 ZINC000569145223 568293209 /nfs/dbraw/zinc/29/32/09/568293209.db2.gz ICMXDZJDAQVHOW-DARAHFNDSA-N 0 0 363.433 3.698 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)N2CCOC[C@@H]2CC2CCC2)cc1[N+](=O)[O-] ZINC000569146278 568293330 /nfs/dbraw/zinc/29/33/30/568293330.db2.gz GYSASUWGCPMVSN-INIZCTEOSA-N 0 0 360.454 3.924 20 5 FHBDRN C[C@@H](C1CC1)N(Cc1ccccc1)C(=O)CNc1ccccc1[N+](=O)[O-] ZINC000569155347 568299796 /nfs/dbraw/zinc/29/97/96/568299796.db2.gz DORBIKPTUYUSRS-HNNXBMFYSA-N 0 0 353.422 3.834 20 5 FHBDRN O=[N+]([O-])c1cc(I)cc(CNc2ccc(F)cc2)c1 ZINC000569158084 568300270 /nfs/dbraw/zinc/30/02/70/568300270.db2.gz NXIDMSRJHWHTRH-UHFFFAOYSA-N 0 0 372.137 3.951 20 5 FHBDRN C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000482172068 568300474 /nfs/dbraw/zinc/30/04/74/568300474.db2.gz BTIMGJOGGYSATI-GWCFXTLKSA-N 0 0 362.373 3.876 20 5 FHBDRN CN(CC(=O)NC[C@H]1CCCC[C@H]1C(F)(F)F)c1ccccc1[N+](=O)[O-] ZINC000482204786 568312037 /nfs/dbraw/zinc/31/20/37/568312037.db2.gz CDUHXVQACGEKMQ-CHWSQXEVSA-N 0 0 373.375 3.516 20 5 FHBDRN COc1ccc(Cc2noc(-c3c[nH]c4cc([N+](=O)[O-])ccc43)n2)cc1 ZINC000609475031 568318449 /nfs/dbraw/zinc/31/84/49/568318449.db2.gz XSBRTFKGXHRRLP-UHFFFAOYSA-N 0 0 350.334 3.726 20 5 FHBDRN CN(Cc1ccccc1OC(F)(F)F)C(=O)c1ccccc1[N+](=O)[O-] ZINC000031089887 568323418 /nfs/dbraw/zinc/32/34/18/568323418.db2.gz GTMQVFVVWFNRFF-UHFFFAOYSA-N 0 0 354.284 3.766 20 5 FHBDRN CC(C)c1ccc(CN2C(=O)N[C@](C)(c3cccc([N+](=O)[O-])c3)C2=O)cc1 ZINC000031660041 568338233 /nfs/dbraw/zinc/33/82/33/568338233.db2.gz LJBURPDPUAJUJM-HXUWFJFHSA-N 0 0 367.405 3.685 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@H]1CC[C@@H](c2ccccc2)O1 ZINC000569294283 568342451 /nfs/dbraw/zinc/34/24/51/568342451.db2.gz ODEPCAFYJXNJEW-WBVHZDCISA-N 0 0 371.393 3.645 20 5 FHBDRN CC(C)n1cc(NC(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cn1 ZINC000584703446 568349978 /nfs/dbraw/zinc/34/99/78/568349978.db2.gz OPEFBZQZMYLMBC-HNNXBMFYSA-N 0 0 357.414 3.784 20 5 FHBDRN O=C(Nc1ccc2ccoc2c1)N1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000584711238 568362728 /nfs/dbraw/zinc/36/27/28/568362728.db2.gz LEHYYBAISSCXEA-UHFFFAOYSA-N 0 0 353.334 3.768 20 5 FHBDRN Cc1cc([C@@H](C)NC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)c(C)s1 ZINC000032167181 568368413 /nfs/dbraw/zinc/36/84/13/568368413.db2.gz YHHPGXBAQDSFCB-GFCCVEGCSA-N 0 0 370.434 3.950 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)N2CCC[C@]3(CCCOC3)C2)cc1[N+](=O)[O-] ZINC000408298646 568368818 /nfs/dbraw/zinc/36/88/18/568368818.db2.gz PZOJRKQTDXDMIT-FQEVSTJZSA-N 0 0 360.454 3.925 20 5 FHBDRN CC(=O)c1cc(Cl)ccc1OCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000004283324 568376410 /nfs/dbraw/zinc/37/64/10/568376410.db2.gz UFEYNGVNRZGQIH-UHFFFAOYSA-N 0 0 362.769 3.777 20 5 FHBDRN COc1ccc([C@@H]2CCCN2C(=O)c2ccccc2[N+](=O)[O-])c(OC)c1 ZINC000072960946 568381294 /nfs/dbraw/zinc/38/12/94/568381294.db2.gz ROSQOCFWLWOLHY-INIZCTEOSA-N 0 0 356.378 3.589 20 5 FHBDRN COc1cc(CN(C)Cc2ccc([N+](=O)[O-])cc2Cl)cc(OC)c1 ZINC000541996428 568386597 /nfs/dbraw/zinc/38/65/97/568386597.db2.gz LWNQMTKROGLVPS-UHFFFAOYSA-N 0 0 350.802 3.897 20 5 FHBDRN Cc1ncc([N+](=O)[O-])c(OCC(=O)Nc2cccc(C(F)(F)F)c2)c1C ZINC000569356599 568396105 /nfs/dbraw/zinc/39/61/05/568396105.db2.gz GXCIZBSOPSQTPT-UHFFFAOYSA-N 0 0 369.299 3.643 20 5 FHBDRN COc1cc(Cc2noc([C@H]3C[C@]3(C)C(C)C)n2)c([N+](=O)[O-])c(OC)c1 ZINC000569373711 568396808 /nfs/dbraw/zinc/39/68/08/568396808.db2.gz UDCTWAMCLDUBPQ-FZKQIMNGSA-N 0 0 361.398 3.735 20 5 FHBDRN CN(c1ccc([N+](=O)[O-])c(N2CCOCC2)c1F)[C@@H]1CCc2ccccc21 ZINC000569408355 568401123 /nfs/dbraw/zinc/40/11/23/568401123.db2.gz JAOXMFKIHFUJNG-MRXNPFEDSA-N 0 0 371.412 3.694 20 5 FHBDRN CC(C)(C)C[C@@H](NC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F)C(F)(F)F ZINC000569528497 568405693 /nfs/dbraw/zinc/40/56/93/568405693.db2.gz TUQNIYRNRYIBKK-GFCCVEGCSA-N 0 0 368.302 3.899 20 5 FHBDRN CC(C)c1nc2cc(NC[C@H](O)COc3cccc([N+](=O)[O-])c3)ccc2o1 ZINC000569687255 568411856 /nfs/dbraw/zinc/41/18/56/568411856.db2.gz QEHCTQUFCDYQPJ-HNNXBMFYSA-N 0 0 371.393 3.711 20 5 FHBDRN Cc1c[nH]c(=O)n1-c1cccc(-c2noc(-c3cccc([N+](=O)[O-])c3)n2)c1 ZINC000569654712 568416031 /nfs/dbraw/zinc/41/60/31/568416031.db2.gz FMIXMAOTBXTHPO-UHFFFAOYSA-N 0 0 363.333 3.512 20 5 FHBDRN Cc1ccc(-c2nc(CC(=O)Nc3ccccc3Cl)no2)cc1[N+](=O)[O-] ZINC000569756375 568421413 /nfs/dbraw/zinc/42/14/13/568421413.db2.gz GCKAGDASZFVAKE-UHFFFAOYSA-N 0 0 372.768 3.788 20 5 FHBDRN CCCN(c1nccc(C(N)=O)c1[N+](=O)[O-])[C@H](C)c1cc2ccccc2o1 ZINC000569866169 568431941 /nfs/dbraw/zinc/43/19/41/568431941.db2.gz GMAMNEFYXNFRKZ-GFCCVEGCSA-N 0 0 368.393 3.813 20 5 FHBDRN COc1ccc([C@@H]2CCN(C(=O)[C@H](C)c3cccc([N+](=O)[O-])c3)C2)cc1 ZINC000569898819 568434755 /nfs/dbraw/zinc/43/47/55/568434755.db2.gz PNVTXKLBDFRSJR-RHSMWYFYSA-N 0 0 354.406 3.723 20 5 FHBDRN COc1ccccc1[C@H](CO)N[C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000569908213 568435762 /nfs/dbraw/zinc/43/57/62/568435762.db2.gz SLRKULOYJYWWDY-ROUUACIJSA-N 0 0 356.422 3.649 20 5 FHBDRN CSc1nc(C(F)F)cc(N(C)CCc2cccc([N+](=O)[O-])c2)n1 ZINC000569941876 568437473 /nfs/dbraw/zinc/43/74/73/568437473.db2.gz VBGPKAGBIIEAJN-UHFFFAOYSA-N 0 0 354.382 3.723 20 5 FHBDRN Cc1ncsc1-c1nnc(N(C)Cc2ccccc2[N+](=O)[O-])n1C1CC1 ZINC000570053574 568443536 /nfs/dbraw/zinc/44/35/36/568443536.db2.gz QAYXYLGUNVLQEK-UHFFFAOYSA-N 0 0 370.438 3.590 20 5 FHBDRN Cc1cc(Cc2noc(CCc3nc4ccccc4[nH]3)n2)ccc1[N+](=O)[O-] ZINC000569978526 568445549 /nfs/dbraw/zinc/44/55/49/568445549.db2.gz AKGIXTVVHJVWKI-UHFFFAOYSA-N 0 0 363.377 3.539 20 5 FHBDRN O=c1[nH]c(N2CCC(c3ccccc3F)CC2)nc2ccc([N+](=O)[O-])cc12 ZINC000569995588 568447937 /nfs/dbraw/zinc/44/79/37/568447937.db2.gz HKHLDZPNFXTCSH-UHFFFAOYSA-N 0 0 368.368 3.767 20 5 FHBDRN CNc1ccc([N+](=O)[O-])cc1NC(=O)CO[C@@H]1CCCc2ccccc21 ZINC000570096171 568450655 /nfs/dbraw/zinc/45/06/55/568450655.db2.gz GTZHLBVAYZWTRZ-GOSISDBHSA-N 0 0 355.394 3.669 20 5 FHBDRN COC(=O)c1ccc(OCC(=O)Nc2ccccc2C(C)C)c([N+](=O)[O-])c1 ZINC000007128047 568453283 /nfs/dbraw/zinc/45/32/83/568453283.db2.gz XSWAYSYVJDFKPH-UHFFFAOYSA-N 0 0 372.377 3.522 20 5 FHBDRN C[C@@H](SC(=S)N1CCCC1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000007113237 568456515 /nfs/dbraw/zinc/45/65/15/568456515.db2.gz VYECPURPJRGPFF-SNVBAGLBSA-N 0 0 364.452 3.820 20 5 FHBDRN COc1ccc(OCc2nc(-c3cccc(Cl)c3)no2)c([N+](=O)[O-])c1 ZINC000007151411 568459373 /nfs/dbraw/zinc/45/93/73/568459373.db2.gz BXKUZSDYFZJOMT-UHFFFAOYSA-N 0 0 361.741 3.886 20 5 FHBDRN Cc1c(CNC(=O)Nc2cccc3c2OC(C)(C)C3)cccc1[N+](=O)[O-] ZINC000570260225 568459779 /nfs/dbraw/zinc/45/97/79/568459779.db2.gz OCNZITJDFKEQHG-UHFFFAOYSA-N 0 0 355.394 3.938 20 5 FHBDRN COc1ccc([C@@H](C)NCc2nc(-c3cccc([N+](=O)[O-])c3)no2)cc1F ZINC000182018392 568462390 /nfs/dbraw/zinc/46/23/90/568462390.db2.gz QIZZWJZGMNZFJI-LLVKDONJSA-N 0 0 372.356 3.643 20 5 FHBDRN COc1ccc(Nc2nnc(Sc3ccc([N+](=O)[O-])nc3)s2)cc1 ZINC000570552527 568486687 /nfs/dbraw/zinc/48/66/87/568486687.db2.gz YWELZUDHJZMNNK-UHFFFAOYSA-N 0 0 361.408 3.745 20 5 FHBDRN Cc1ccccc1[C@H](C(=O)[O-])[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000570577125 568487384 /nfs/dbraw/zinc/48/73/84/568487384.db2.gz SYKIMBDKGITQCY-LJQANCHMSA-N 0 0 370.405 3.572 20 5 FHBDRN CC(C)(C)c1ccccc1NC(=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000007264414 568489464 /nfs/dbraw/zinc/48/94/64/568489464.db2.gz XNSDHIFBFBYEAM-UHFFFAOYSA-N 0 0 369.421 3.651 20 5 FHBDRN COc1cc(-c2nc(-c3ccc(F)c(OC)c3)no2)cc([N+](=O)[O-])c1C ZINC000570758176 568515028 /nfs/dbraw/zinc/51/50/28/568515028.db2.gz QAQCJHYBYAEFTA-UHFFFAOYSA-N 0 0 359.313 3.777 20 5 FHBDRN COC(=O)c1ccc(Cl)c(CNCc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000482249317 568528004 /nfs/dbraw/zinc/52/80/04/568528004.db2.gz XYZYNGWAKVRBKY-UHFFFAOYSA-N 0 0 369.204 3.978 20 5 FHBDRN C[C@@H](NC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1)[C@H](C)c1ccccc1 ZINC000482250118 568528403 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FHBDRN O=C(c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)N1CCCc2cc(F)ccc21 ZINC000049682682 568566222 /nfs/dbraw/zinc/56/62/22/568566222.db2.gz NCCMCGHITJZPJX-UHFFFAOYSA-N 0 0 366.352 3.513 20 5 FHBDRN CCN(CC)C(=O)c1ccc(NC(=O)[C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000570917240 568686121 /nfs/dbraw/zinc/68/61/21/568686121.db2.gz SBQQWTMCAIACSO-CQSZACIVSA-N 0 0 369.421 3.819 20 5 FHBDRN O=[N+]([O-])c1ccc(NCC2(c3cccc(Cl)c3)CC2)c(-c2nn[nH]n2)c1 ZINC000738368372 598855768 /nfs/dbraw/zinc/85/57/68/598855768.db2.gz CRWYYONAOFFDQZ-UHFFFAOYSA-N 0 0 370.800 3.572 20 5 FHBDRN CC(C)Oc1ccc(-c2nn[nH]n2)cc1N[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000820151691 599154883 /nfs/dbraw/zinc/15/48/83/599154883.db2.gz MWERBMLIQAWZOE-GFCCVEGCSA-N 0 0 368.397 3.735 20 5 FHBDRN CCCCCc1ccc(Oc2ncc([N+](=O)[O-])cc2-c2nn[nH]n2)cc1 ZINC000821060366 599195102 /nfs/dbraw/zinc/19/51/02/599195102.db2.gz CAAQUPJUPWQGJP-UHFFFAOYSA-N 0 0 354.370 3.695 20 5 FHBDRN O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1N1CCC[C@@H](c2ccccc2)CC1 ZINC000738360296 598459591 /nfs/dbraw/zinc/45/95/91/598459591.db2.gz VGJVAYAIRBANQD-OAHLLOKOSA-N 0 0 364.409 3.549 20 5 FHBDRN O=[N+]([O-])c1c(Oc2ccc(-c3nn[nH]n3)cc2Cl)ccc2ncccc21 ZINC000738359499 598744494 /nfs/dbraw/zinc/74/44/94/598744494.db2.gz SFBCLJOQFFOQBF-UHFFFAOYSA-N 0 0 368.740 3.769 20 5 FHBDRN O=[N+]([O-])c1cnc(Oc2ccc(Cl)c3ccccc23)c(-c2nn[nH]n2)c1 ZINC000823650779 599363530 /nfs/dbraw/zinc/36/35/30/599363530.db2.gz AQVRUZJIXCPHRG-UHFFFAOYSA-N 0 0 368.740 3.769 20 5 FHBDRN Cc1cccc([C@@H]2CCCN2c2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])c1C ZINC000822299599 599578176 /nfs/dbraw/zinc/57/81/76/599578176.db2.gz OJFUOQHYYINVSI-INIZCTEOSA-N 0 0 364.409 3.733 20 5 FHBDRN O=C([O-])N1CCC[C@@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000739926470 599860605 /nfs/dbraw/zinc/86/06/05/599860605.db2.gz JFHIIFDHQWPBCU-CYBMUJFWSA-N 0 0 361.423 3.555 20 5 FHBDRN C[C@@H]([NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)[C@@H]1CCCN(C(=O)[O-])C1 ZINC000739032394 602270572 /nfs/dbraw/zinc/27/05/72/602270572.db2.gz WYIKLLBJGJDCDR-UKRRQHHQSA-N 0 0 373.409 3.723 20 5 FHBDRN Cc1c([C@@H](C)[NH2+]Cc2ccc(CCNC(=O)[O-])cc2)cccc1[N+](=O)[O-] ZINC000829860372 604943655 /nfs/dbraw/zinc/94/36/55/604943655.db2.gz YBBVSNRNJJNYFY-CQSZACIVSA-N 0 0 357.410 3.564 20 5 FHBDRN CC[C@@H](Nc1ccc(-c2nn[nH]n2)c([N+](=O)[O-])c1)c1ccc(Cl)cc1 ZINC000820925128 606644688 /nfs/dbraw/zinc/64/46/88/606644688.db2.gz DSGGHZSRCGOBSO-CQSZACIVSA-N 0 0 358.789 3.992 20 5 FHBDRN O=[N+]([O-])c1cc(CNc2ccc(Cl)c(-c3nn[nH]n3)c2)ccc1Cl ZINC000823635473 606984531 /nfs/dbraw/zinc/98/45/31/606984531.db2.gz XLYBJKUZVQNLGU-UHFFFAOYSA-N 0 0 365.180 3.694 20 5 FHBDRN CC(C)Cc1ccc([C@@H](C)Nc2nccc(-c3nn[nH]n3)c2[N+](=O)[O-])cc1 ZINC000820107832 607161825 /nfs/dbraw/zinc/16/18/25/607161825.db2.gz CRQZPCWNXVZMGP-GFCCVEGCSA-N 0 0 367.413 3.542 20 5 FHBDRN Cc1ccc([C@H](C)N[C@@H](C)c2ccc(-c3nn[nH]n3)cc2F)cc1[N+](=O)[O-] ZINC000826283222 609342957 /nfs/dbraw/zinc/34/29/57/609342957.db2.gz MZIBYNMEWSTVMP-RYUDHWBXSA-N 0 0 370.388 3.634 20 5 FHBDRN O=[N+]([O-])c1cc(C(F)(F)N2CC[C@@H](c3ccncc3)C2)cnc1Cl ZINC001165044253 721926660 /nfs/dbraw/zinc/92/66/60/721926660.db2.gz TYNQWXLMFNCPKM-LLVKDONJSA-N 0 0 354.744 3.577 20 5 FHBDRN Cc1csc([C@H](NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C2CC2)n1 ZINC000135885655 936317260 /nfs/dbraw/zinc/31/72/60/936317260.db2.gz BFAOCAOILZOSNY-QGZVFWFLSA-N 0 0 370.434 3.651 20 5 FHBDRN COCc1ccc([C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])c(Cl)c2)o1 ZINC000161894846 936318518 /nfs/dbraw/zinc/31/85/18/936318518.db2.gz LSMLHTAWQIJOPF-HNNXBMFYSA-N 0 0 364.785 3.965 20 5 FHBDRN C[C@H](NC(=O)N[C@H]1CCOc2c(F)cccc21)c1cccc([N+](=O)[O-])c1 ZINC000187881451 936332434 /nfs/dbraw/zinc/33/24/34/936332434.db2.gz VJUWINXAGZYKPR-ZBEGNZNMSA-N 0 0 359.357 3.618 20 5 FHBDRN O=C(c1cc(Br)cs1)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000161473027 936333658 /nfs/dbraw/zinc/33/36/58/936333658.db2.gz YAIKUULDRXGUTB-UHFFFAOYSA-N 0 0 367.224 3.617 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1COC(=O)/C=C/c1ccc2ccccc2n1 ZINC000024221987 936337580 /nfs/dbraw/zinc/33/75/80/936337580.db2.gz SVCPZSZMALURRV-DHZHZOJOSA-N 0 0 364.357 3.908 20 5 FHBDRN CC[C@](C)(CO)NC(=O)c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1 ZINC000543850972 936337756 /nfs/dbraw/zinc/33/77/56/936337756.db2.gz KLRVXSAMHBDXRK-GOSISDBHSA-N 0 0 360.435 3.637 20 5 FHBDRN C[C@@H]1CCCC[C@@H]1CNC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC001125640078 936338686 /nfs/dbraw/zinc/33/86/86/936338686.db2.gz YJPLGQDRIVYMBI-GHMZBOCLSA-N 0 0 355.232 3.913 20 5 FHBDRN COCc1ccc([C@@H]2CCCN2C(=O)c2cc(F)c([N+](=O)[O-])cc2F)o1 ZINC000162065976 936342837 /nfs/dbraw/zinc/34/28/37/936342837.db2.gz VJBAKADWEPUJSY-AWEZNQCLSA-N 0 0 366.320 3.590 20 5 FHBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1CC[C@H]1c1ccc(Cl)cc1 ZINC000511224667 936369227 /nfs/dbraw/zinc/36/92/27/936369227.db2.gz QFSSEFYACWWDRX-HNNXBMFYSA-N 0 0 366.826 3.692 20 5 FHBDRN CCCCN(CCOC)C(=O)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000278022585 936373736 /nfs/dbraw/zinc/37/37/36/936373736.db2.gz QDVULVFRQLUYPJ-UHFFFAOYSA-N 0 0 352.434 3.982 20 5 FHBDRN CCN(Cc1c[nH]c2ccccc12)C(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000187887285 936373966 /nfs/dbraw/zinc/37/39/66/936373966.db2.gz BKPUDPDPOBZMKD-UHFFFAOYSA-N 0 0 366.421 3.850 20 5 FHBDRN COC(=O)c1ccc(Oc2ncncc2-c2ccccc2)cc1[N+](=O)[O-] ZINC000613114335 936377581 /nfs/dbraw/zinc/37/75/81/936377581.db2.gz YXNREDQVLPCICE-UHFFFAOYSA-N 0 0 351.318 3.631 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H]1CCC[C@@H](SC)C1 ZINC000439903743 945068662 /nfs/dbraw/zinc/06/86/62/945068662.db2.gz QTVTWKDNJJADKW-WCQYABFASA-N 0 0 353.444 3.789 20 5 FHBDRN C[C@@H](NC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1)[C@H]1Oc2ccccc2[C@@H]1C ZINC000516616407 945069126 /nfs/dbraw/zinc/06/91/26/945069126.db2.gz VZBJREDWLXDEPP-PJHJGJPPSA-N 0 0 354.406 3.768 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)cnc1NC[C@H](O)c1cccc(C(F)(F)F)c1 ZINC000153738682 937079963 /nfs/dbraw/zinc/07/99/63/937079963.db2.gz UDHQKLOIVBFELN-LBPRGKRZSA-N 0 0 361.707 3.808 20 5 FHBDRN CC1(C)[C@H](NC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)[C@H]2CCO[C@H]21 ZINC000278052927 937085750 /nfs/dbraw/zinc/08/57/50/937085750.db2.gz DJZDZSWDGZYPDL-CDHQVMDDSA-N 0 0 362.429 3.637 20 5 FHBDRN CCc1nc(C)c([C@@H](C)N(C)C(=O)c2cc(OC)ccc2[N+](=O)[O-])s1 ZINC000120092161 937086159 /nfs/dbraw/zinc/08/61/59/937086159.db2.gz DDUJMTVBSPAUTG-LLVKDONJSA-N 0 0 363.439 3.764 20 5 FHBDRN Cc1ccccc1CN(C)c1ccc([N+](=O)[O-])c(N2CCOCC2)c1F ZINC000572925071 937098515 /nfs/dbraw/zinc/09/85/15/937098515.db2.gz VGUXTKOGYXFGRF-UHFFFAOYSA-N 0 0 359.401 3.515 20 5 FHBDRN Cc1ncc(CN(C)C(=O)c2ccnc(-c3ccccc3)c2[N+](=O)[O-])s1 ZINC000583097612 937113338 /nfs/dbraw/zinc/11/33/38/937113338.db2.gz QGFWZPBYHZLAKU-UHFFFAOYSA-N 0 0 368.418 3.694 20 5 FHBDRN CCO[C@@H](CCNC(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1)C(C)C ZINC000176396596 937126946 /nfs/dbraw/zinc/12/69/46/937126946.db2.gz XXRNRUXRQNNBIN-PBHICJAKSA-N 0 0 351.447 3.715 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NCc2c(F)cccc2SC)c1 ZINC000557365628 937127040 /nfs/dbraw/zinc/12/70/40/937127040.db2.gz JQUFDYIJKXQGPT-UHFFFAOYSA-N 0 0 364.398 3.785 20 5 FHBDRN Cc1cccnc1OC1CCN(Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000583112937 937133403 /nfs/dbraw/zinc/13/34/03/937133403.db2.gz MZQLOWBGYOJONQ-UHFFFAOYSA-N 0 0 361.829 3.995 20 5 FHBDRN COC(=O)c1cc(C)nc(N[C@@H](c2ccccc2C)C2CC2)c1[N+](=O)[O-] ZINC000557567839 927063039 /nfs/dbraw/zinc/06/30/39/927063039.db2.gz MYFRAGRLVYXEAS-MRXNPFEDSA-N 0 0 355.394 3.956 20 5 FHBDRN CCc1cnc(CN(C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)s1 ZINC000083074862 927089895 /nfs/dbraw/zinc/08/98/95/927089895.db2.gz GYHIVQWWTCXGSN-UHFFFAOYSA-N 0 0 354.819 3.931 20 5 FHBDRN Cc1ccc(C(C)(C)CN(C)c2nc3ccc([N+](=O)[O-])cc3c(=O)[nH]2)cc1 ZINC000557583710 927094845 /nfs/dbraw/zinc/09/48/45/927094845.db2.gz VEWLLQCGMZAUMJ-UHFFFAOYSA-N 0 0 366.421 3.966 20 5 FHBDRN C[C@@H](c1ccccc1)[C@@](C)(O)C(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000176411448 937136524 /nfs/dbraw/zinc/13/65/24/937136524.db2.gz QJLXPGLRDIQMSI-HRAATJIYSA-N 0 0 370.449 3.588 20 5 FHBDRN CC[C@H](c1ccncc1)N(CC)C(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000157481671 927172669 /nfs/dbraw/zinc/17/26/69/927172669.db2.gz OFRGIFKRXGXURC-OAHLLOKOSA-N 0 0 373.409 3.620 20 5 FHBDRN C[C@H](NS(=O)(=O)c1cccc2c1CCCC2)c1cccc([N+](=O)[O-])c1 ZINC000748054487 927261500 /nfs/dbraw/zinc/26/15/00/927261500.db2.gz KOROVJVVTOTCPT-ZDUSSCGKSA-N 0 0 360.435 3.513 20 5 FHBDRN Cc1cnc([C@H](C)NC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)s1 ZINC000153887731 927290270 /nfs/dbraw/zinc/29/02/70/927290270.db2.gz VVHMZCVTORQZAZ-LBPRGKRZSA-N 0 0 360.439 3.795 20 5 FHBDRN CC(C)(C)CCOc1cnccc1CNC(=O)c1ccc([N+](=O)[O-])s1 ZINC000579761618 927318544 /nfs/dbraw/zinc/31/85/44/927318544.db2.gz BXOBBHOKLKVILW-UHFFFAOYSA-N 0 0 363.439 3.796 20 5 FHBDRN O=c1cc(CSc2ccc([N+](=O)[O-])cn2)c2cc3c(cc2o1)CCC3 ZINC000160211417 927340708 /nfs/dbraw/zinc/34/07/08/927340708.db2.gz XCVUNBUZTDHFQQ-UHFFFAOYSA-N 0 0 354.387 3.877 20 5 FHBDRN Cc1c(OC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cccc1[N+](=O)[O-] ZINC000120134479 927380732 /nfs/dbraw/zinc/38/07/32/927380732.db2.gz SIKJKXFXWGJQHS-CQSZACIVSA-N 0 0 374.418 3.565 20 5 FHBDRN CCN(CC)c1ccc(CNC(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)cn1 ZINC000120137727 927391658 /nfs/dbraw/zinc/39/16/58/927391658.db2.gz BGNKAAPHFDEWFE-UHFFFAOYSA-N 0 0 371.441 3.775 20 5 FHBDRN COc1ccccc1[C@]1(C)C[C@@H]1NC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000610181640 927400401 /nfs/dbraw/zinc/40/04/01/927400401.db2.gz GHIUPULTRBGZOP-RXVVDRJESA-N 0 0 368.433 3.727 20 5 FHBDRN CCC(CC)c1cc(CNC(=O)NCCc2cccc([N+](=O)[O-])c2)on1 ZINC000120148160 927426418 /nfs/dbraw/zinc/42/64/18/927426418.db2.gz SIYVBQYHSJPQTK-UHFFFAOYSA-N 0 0 360.414 3.528 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1)N1CCC[C@H](OCc2ccccc2F)C1 ZINC000471116468 927464693 /nfs/dbraw/zinc/46/46/93/927464693.db2.gz NKOFOYDXLHASTE-KRWDZBQOSA-N 0 0 373.384 3.947 20 5 FHBDRN COCCOc1ccc(CNC(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)cc1 ZINC000120179555 927538442 /nfs/dbraw/zinc/53/84/42/927538442.db2.gz ISZJZNCLFNRXLZ-UHFFFAOYSA-N 0 0 373.409 3.559 20 5 FHBDRN O=C(c1c(Cl)cccc1[N+](=O)[O-])N1CC[C@@]2(C1)OCc1ccccc12 ZINC000186913227 927573739 /nfs/dbraw/zinc/57/37/39/927573739.db2.gz CXCVZHRHUBZBAB-SFHVURJKSA-N 0 0 358.781 3.520 20 5 FHBDRN COc1ccc(-c2ccc(CNCc3csc(C)n3)o2)c([N+](=O)[O-])c1 ZINC000608835997 927584412 /nfs/dbraw/zinc/58/44/12/927584412.db2.gz BVCQKDTWNZPELE-UHFFFAOYSA-N 0 0 359.407 3.918 20 5 FHBDRN C[C@H](Sc1ccc(C(F)(F)F)nn1)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000186932655 927590919 /nfs/dbraw/zinc/59/09/19/927590919.db2.gz GYRLUCXGBBUIEA-QMMMGPOBSA-N 0 0 372.328 3.523 20 5 FHBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N[C@H]1C[C@@H]1Cc1ccccc1 ZINC000610186603 927674253 /nfs/dbraw/zinc/67/42/53/927674253.db2.gz YBEDNYGECSSDJB-NOLJZWGESA-N 0 0 374.824 3.763 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)N[C@H]2C[C@]2(C)c2ccccc2)cc1SC ZINC000610190998 927785229 /nfs/dbraw/zinc/78/52/29/927785229.db2.gz WHLHBBGAPBWTPM-PKOBYXMFSA-N 0 0 372.446 3.785 20 5 FHBDRN C[C@]1(c2ccccc2)C[C@H]1NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000610190385 927823232 /nfs/dbraw/zinc/82/32/32/927823232.db2.gz LKOBRPDNFJPNJT-TZIWHRDSSA-N 0 0 365.433 3.655 20 5 FHBDRN Cc1ccc(O[C@H](C)C(=O)Nc2cc(-c3cccc([N+](=O)[O-])c3)[nH]n2)cc1 ZINC000248042774 937198324 /nfs/dbraw/zinc/19/83/24/937198324.db2.gz VLTYCXCNQTVEEO-CYBMUJFWSA-N 0 0 366.377 3.699 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1CN1CCC(Nc2ccc(F)cc2)CC1 ZINC000430194767 927853924 /nfs/dbraw/zinc/85/39/24/927853924.db2.gz KWFJYXWMIBDGOX-UHFFFAOYSA-N 0 0 359.401 3.819 20 5 FHBDRN COc1ccc(CSc2nnc(-c3cccc(C)c3)n2C)cc1[N+](=O)[O-] ZINC000097363174 927886914 /nfs/dbraw/zinc/88/69/14/927886914.db2.gz PQKIMTKFPLMXMZ-UHFFFAOYSA-N 0 0 370.434 4.000 20 5 FHBDRN CSc1cccc(C(=O)N(C)C[C@H](C)c2nccs2)c1[N+](=O)[O-] ZINC000187050076 927887055 /nfs/dbraw/zinc/88/70/55/927887055.db2.gz YXVQVQKVIBLBMQ-JTQLQIEISA-N 0 0 351.453 3.649 20 5 FHBDRN CSc1cccc(C(=O)Nc2ncn(C3CCCCC3)n2)c1[N+](=O)[O-] ZINC000187067887 927895932 /nfs/dbraw/zinc/89/59/32/927895932.db2.gz DJSAHIRHKSPAAR-UHFFFAOYSA-N 0 0 361.427 3.666 20 5 FHBDRN C[C@@H]1CO[C@H](c2cccc(Cl)c2)CN1C(=O)Cc1ccccc1[N+](=O)[O-] ZINC000187070041 927896116 /nfs/dbraw/zinc/89/61/16/927896116.db2.gz AJLIKCLYMAPLQS-ACJLOTCBSA-N 0 0 374.824 3.779 20 5 FHBDRN COc1cc(C(=O)N2CCCC3(CCCCC3)C2)cc([N+](=O)[O-])c1OC ZINC000610197773 927919322 /nfs/dbraw/zinc/91/93/22/927919322.db2.gz DLQQPVJOZKPKFR-UHFFFAOYSA-N 0 0 362.426 3.799 20 5 FHBDRN CSc1cccc(C(=O)N[C@@H]2CCCO[C@H]2CC(C)C)c1[N+](=O)[O-] ZINC000187109759 927919339 /nfs/dbraw/zinc/91/93/39/927919339.db2.gz WVVAMQROTWXHKY-KGLIPLIRSA-N 0 0 352.456 3.640 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1CN1CCC[C@@H]1c1nc2ccccc2n1C ZINC000430202367 927961933 /nfs/dbraw/zinc/96/19/33/927961933.db2.gz CIADQFYJBFUVPW-GOSISDBHSA-N 0 0 366.421 3.827 20 5 FHBDRN O=C(CCC(=O)c1cccs1)OCCSc1ccc([N+](=O)[O-])cc1 ZINC000784932890 927995855 /nfs/dbraw/zinc/99/58/55/927995855.db2.gz ARYCSFMAMOCMLK-UHFFFAOYSA-N 0 0 365.432 3.955 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCc1ccn(C2CCCC2)n1 ZINC000120286302 928002326 /nfs/dbraw/zinc/00/23/26/928002326.db2.gz BMGVFCAJAQIXGG-UHFFFAOYSA-N 0 0 357.414 3.845 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CCN(Cc2ccccc2)CC1 ZINC000120301704 928020112 /nfs/dbraw/zinc/02/01/12/928020112.db2.gz ISEGGSJDIPSBEV-UHFFFAOYSA-N 0 0 368.437 3.561 20 5 FHBDRN CCC[C@H]1C[C@H](C(=O)OCCSc2ccc([N+](=O)[O-])cc2)CCO1 ZINC000784935155 928020355 /nfs/dbraw/zinc/02/03/55/928020355.db2.gz ICWFTAXMGJCFEJ-HIFRSBDPSA-N 0 0 353.440 3.825 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)cc1 ZINC000049653340 928027480 /nfs/dbraw/zinc/02/74/80/928027480.db2.gz TUICDVVRMSSBTC-CQSZACIVSA-N 0 0 350.378 3.580 20 5 FHBDRN CCCN(C(=O)c1ccc([N+](=O)[O-])[nH]1)[C@@H]1C[C@H](OCC)C12CCCCC2 ZINC000610205168 928032177 /nfs/dbraw/zinc/03/21/77/928032177.db2.gz FBKWNUUSMXXABW-CVEARBPZSA-N 0 0 363.458 3.903 20 5 FHBDRN C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1CC(=O)N[C@H](c1ccccc1)C1CC1 ZINC000728200728 928067299 /nfs/dbraw/zinc/06/72/99/928067299.db2.gz AACTUOLVEJCULU-SPLOXXLWSA-N 0 0 365.433 3.613 20 5 FHBDRN Cc1ccccc1[C@H]1CN(C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)CCO1 ZINC000610208700 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CC(C)CCSc1ccc(C(=O)N2CCOCC2(C)C)cc1[N+](=O)[O-] ZINC000064812863 928143431 /nfs/dbraw/zinc/14/34/31/928143431.db2.gz YLUWLICEPUMPNN-UHFFFAOYSA-N 0 0 366.483 3.984 20 5 FHBDRN O=c1cc(C(F)(F)F)ccn1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000583191708 937222998 /nfs/dbraw/zinc/22/29/98/937222998.db2.gz IWEJPLCKWBAOJR-UHFFFAOYSA-N 0 0 366.217 3.842 20 5 FHBDRN COc1ccc(NC(=O)N2CC3(CCCC3)OC(C)(C)C2)cc1[N+](=O)[O-] ZINC000408435548 937223053 /nfs/dbraw/zinc/22/30/53/937223053.db2.gz OBGXHNDVIRUUDC-UHFFFAOYSA-N 0 0 363.414 3.559 20 5 FHBDRN COc1cc(C(=O)N2CCC[C@H]2c2cccs2)c([N+](=O)[O-])cc1OC ZINC000070751807 928164198 /nfs/dbraw/zinc/16/41/98/928164198.db2.gz ZYVJHSKAVXAXBE-LBPRGKRZSA-N 0 0 362.407 3.651 20 5 FHBDRN COc1ccc2[nH]c(SCc3nc4cc([N+](=O)[O-])ccc4o3)nc2c1 ZINC000083090309 928167640 /nfs/dbraw/zinc/16/76/40/928167640.db2.gz HSAWAMAVWUTOBK-UHFFFAOYSA-N 0 0 356.363 3.913 20 5 FHBDRN Cc1cc(Cl)ccc1NC(=O)CN1c2ccc([N+](=O)[O-])cc2C[C@H]1C ZINC000728202057 928168867 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O=C(OCCSc1ccc([N+](=O)[O-])cc1)[C@@H]1Cc2ccccc2S1 ZINC000784938766 928313249 /nfs/dbraw/zinc/31/32/49/928313249.db2.gz PYZDYSKGRBZIPM-INIZCTEOSA-N 0 0 361.444 3.947 20 5 FHBDRN O=C(Cc1cccc([N+](=O)[O-])c1)NCCc1ccccc1C(F)(F)F ZINC000610225467 928322503 /nfs/dbraw/zinc/32/25/03/928322503.db2.gz ZWXVRDUEIKPRDA-UHFFFAOYSA-N 0 0 352.312 3.515 20 5 FHBDRN Cc1ccccc1-c1cc(NC(=O)Cc2cccc([N+](=O)[O-])c2C)n(C)n1 ZINC000126989916 928363939 /nfs/dbraw/zinc/36/39/39/928363939.db2.gz NQBYOTBNIGDFFF-UHFFFAOYSA-N 0 0 364.405 3.793 20 5 FHBDRN C[C@@H]1CCC[C@@H](OCc2cccc(NC(=O)c3cc([N+](=O)[O-])nn3C)c2)C1 ZINC000476354071 928370268 /nfs/dbraw/zinc/37/02/68/928370268.db2.gz JRLBAVOKNZORPJ-CZUORRHYSA-N 0 0 372.425 3.676 20 5 FHBDRN Cc1nc(CC(C)C)c(NC(=O)NCCc2ccccc2[N+](=O)[O-])s1 ZINC000467977800 928398019 /nfs/dbraw/zinc/39/80/19/928398019.db2.gz DQBJYBNPQNFTQU-UHFFFAOYSA-N 0 0 362.455 3.922 20 5 FHBDRN C[C@@H]1CCCN(c2ccc(C(=O)NCCc3ccsc3)cc2[N+](=O)[O-])C1 ZINC000510115250 928451048 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20 5 FHBDRN CCOc1cc(C(=O)N2CCCc3cccc(F)c32)c([N+](=O)[O-])cc1OC ZINC000248148180 937264113 /nfs/dbraw/zinc/26/41/13/937264113.db2.gz YCMLKZLNAXOPDX-UHFFFAOYSA-N 0 0 374.368 3.734 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc(-c2nncs2)cc1 ZINC000535842879 928709401 /nfs/dbraw/zinc/70/94/01/928709401.db2.gz CMQJACNTQGOKKT-UHFFFAOYSA-N 0 0 354.391 3.685 20 5 FHBDRN O=C(N[C@@H](c1ccccc1)c1ccncc1)c1cc(F)c([N+](=O)[O-])cc1F ZINC000154986044 937271587 /nfs/dbraw/zinc/27/15/87/937271587.db2.gz YTEYJQKHTOTZJA-SFHVURJKSA-N 0 0 369.327 3.787 20 5 FHBDRN O=C(CCCc1ccccn1)N1CCS[C@@H]1c1ccc([N+](=O)[O-])cc1 ZINC000610235007 928797509 /nfs/dbraw/zinc/79/75/09/928797509.db2.gz CAGXPOQYTKYXOH-GOSISDBHSA-N 0 0 357.435 3.587 20 5 FHBDRN O=C(C1CCN(Cc2cc(Cl)ccc2[N+](=O)[O-])CC1)C(F)(F)F ZINC000274821697 928819166 /nfs/dbraw/zinc/81/91/66/928819166.db2.gz BJBNHESCFOQVQT-UHFFFAOYSA-N 0 0 350.724 3.592 20 5 FHBDRN Cc1c([N+](=O)[O-])cc(C(=O)N2CC[C@@H](c3ccccc3)[C@H]2C)cc1[N+](=O)[O-] ZINC000175764877 928827129 /nfs/dbraw/zinc/82/71/29/928827129.db2.gz DTNBSIKWBJHSFN-CZUORRHYSA-N 0 0 369.377 3.830 20 5 FHBDRN CCOc1ccc(NC(=O)CN(C)c2ccc(C)cc2C)c([N+](=O)[O-])c1 ZINC001167085180 928845505 /nfs/dbraw/zinc/84/55/05/928845505.db2.gz QKDCCJMFBREQBV-UHFFFAOYSA-N 0 0 357.410 3.685 20 5 FHBDRN C[C@@H]1c2cccn2CCN1C(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000178835898 937281769 /nfs/dbraw/zinc/28/17/69/937281769.db2.gz SNCOAHUQQQSBLG-SNVBAGLBSA-N 0 0 353.300 3.632 20 5 FHBDRN CC(C)Cc1ncc(NC(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)cn1 ZINC000510130366 928898140 /nfs/dbraw/zinc/89/81/40/928898140.db2.gz FBZMBHJVQBGKSS-UHFFFAOYSA-N 0 0 368.315 3.854 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)cnc1N[C@@H](CO)c1cccc(Br)c1 ZINC000178839656 937285082 /nfs/dbraw/zinc/28/50/82/937285082.db2.gz QYPPHRIRCMJDIO-NSHDSACASA-N 0 0 372.606 3.551 20 5 FHBDRN COc1ccc([C@H](C)N(C)C(=O)CSc2ccc([N+](=O)[O-])cc2)cc1 ZINC000248181138 937289388 /nfs/dbraw/zinc/28/93/88/937289388.db2.gz DNANEWKUSOYQIN-ZDUSSCGKSA-N 0 0 360.435 3.915 20 5 FHBDRN Cc1cc(NC(=O)c2csc(C(C)C)n2)n(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000608962712 928919775 /nfs/dbraw/zinc/91/97/75/928919775.db2.gz SUWDTYGWSBVDNY-UHFFFAOYSA-N 0 0 371.422 3.921 20 5 FHBDRN CCC[C@H](Cc1ccccc1)NC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000609036781 928955510 /nfs/dbraw/zinc/95/55/10/928955510.db2.gz XMTPVLBOXLAWNF-CQSZACIVSA-N 0 0 352.394 3.612 20 5 FHBDRN O=C(N[C@H]1CCc2c1cccc2Br)c1csc([N+](=O)[O-])c1 ZINC000609022948 928963084 /nfs/dbraw/zinc/96/30/84/928963084.db2.gz VUMIQKAPJSNZRA-LBPRGKRZSA-N 0 0 367.224 3.836 20 5 FHBDRN O=C(NCCc1ccccc1[N+](=O)[O-])c1ccccc1Oc1cccnc1 ZINC000610237082 928978835 /nfs/dbraw/zinc/97/88/35/928978835.db2.gz IJTAGJJUMHSKOX-UHFFFAOYSA-N 0 0 363.373 3.755 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CCOc3ccccc3[C@H]2C)ccc1[N+](=O)[O-] ZINC000598567803 928980216 /nfs/dbraw/zinc/98/02/16/928980216.db2.gz GFIKXIXQIQGQMG-CQSZACIVSA-N 0 0 370.405 3.978 20 5 FHBDRN O=C(NCCc1ccccc1[N+](=O)[O-])Nc1ccc(OC(F)(F)F)cc1 ZINC000547726650 928998233 /nfs/dbraw/zinc/99/82/33/928998233.db2.gz FCQVRZZTMSXFNU-UHFFFAOYSA-N 0 0 369.299 3.858 20 5 FHBDRN O=[N+]([O-])c1cccc(F)c1CN1CCN(c2ccc3ccccc3n2)CC1 ZINC000471203596 929009501 /nfs/dbraw/zinc/00/95/01/929009501.db2.gz SISCRXHNLPKYKK-UHFFFAOYSA-N 0 0 366.396 3.604 20 5 FHBDRN COc1cccc(C(=O)CCCC(=O)Nc2cc(F)cc([N+](=O)[O-])c2)c1 ZINC000509834787 929032800 /nfs/dbraw/zinc/03/28/00/929032800.db2.gz WRRAFQMSRHDDLD-UHFFFAOYSA-N 0 0 360.341 3.734 20 5 FHBDRN COc1cccc([C@@H](C)CC(=O)NCc2cc([N+](=O)[O-])c(F)cc2F)c1 ZINC001143376429 929043399 /nfs/dbraw/zinc/04/33/99/929043399.db2.gz DUHLKENCDXSRRF-NSHDSACASA-N 0 0 364.348 3.692 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@H](c1cccc(F)c1)C1CCCC1 ZINC000165013657 929056615 /nfs/dbraw/zinc/05/66/15/929056615.db2.gz CASWQWJDZVEODF-IBGZPJMESA-N 0 0 374.416 3.677 20 5 FHBDRN COc1cc(OC)c(NC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)cc1F ZINC000120600419 929063995 /nfs/dbraw/zinc/06/39/95/929063995.db2.gz YDFLLNPXCUYBBF-UHFFFAOYSA-N 0 0 368.748 3.586 20 5 FHBDRN C[C@H](NC(=O)N1CCCO[C@H](c2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000609239837 929081403 /nfs/dbraw/zinc/08/14/03/929081403.db2.gz BOEALRRLSQHNNW-KXBFYZLASA-N 0 0 369.421 3.829 20 5 FHBDRN CC[C@@H](C)c1ccc(NC(=O)Cn2c(=O)oc3ccc([N+](=O)[O-])cc32)cc1 ZINC000248200657 937300725 /nfs/dbraw/zinc/30/07/25/937300725.db2.gz VOCLUDBBLIZKCJ-GFCCVEGCSA-N 0 0 369.377 3.655 20 5 FHBDRN COc1ccc(F)cc1NC(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000510140419 929109498 /nfs/dbraw/zinc/10/94/98/929109498.db2.gz RPHCBIUCLVCDGX-UHFFFAOYSA-N 0 0 361.373 3.887 20 5 FHBDRN CN(C[C@H]1CCCO[C@@H]1c1ccccc1)C(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000610239196 929134321 /nfs/dbraw/zinc/13/43/21/929134321.db2.gz JDFRLAIJXXTGHJ-WIYYLYMNSA-N 0 0 368.433 3.764 20 5 FHBDRN COc1ccc2c(c1)CCCCN2C(=O)/C=C/c1ccc([N+](=O)[O-])cc1 ZINC001266340823 929156976 /nfs/dbraw/zinc/15/69/76/929156976.db2.gz OGRFOXXQNNADBS-KPKJPENVSA-N 0 0 352.390 3.986 20 5 FHBDRN CCn1c(CCNC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)nc2ccccc21 ZINC000134704182 929164165 /nfs/dbraw/zinc/16/41/65/929164165.db2.gz CXJXINIWBWLYHA-UHFFFAOYSA-N 0 0 372.812 3.590 20 5 FHBDRN COc1cc(NCc2cc(COC(C)(C)C)on2)c(F)cc1[N+](=O)[O-] ZINC000275019795 929169542 /nfs/dbraw/zinc/16/95/42/929169542.db2.gz SPDUMMVJTZBBGZ-UHFFFAOYSA-N 0 0 353.350 3.658 20 5 FHBDRN O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(Br)c(F)c1 ZINC000134751232 929210080 /nfs/dbraw/zinc/21/00/80/929210080.db2.gz NKJLSVYELTZXRA-UHFFFAOYSA-N 0 0 353.147 3.678 20 5 FHBDRN Cc1cc(F)cc(C(=O)N[C@@H](C)c2cnn(CC3CCC3)c2)c1[N+](=O)[O-] ZINC000890676633 929225329 /nfs/dbraw/zinc/22/53/29/929225329.db2.gz ZHCGOVJAARWRRN-LBPRGKRZSA-N 0 0 360.389 3.530 20 5 FHBDRN COc1ccc(Cl)cc1N(C)C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000134782271 929242386 /nfs/dbraw/zinc/24/23/86/929242386.db2.gz DYMOUXPWJOZXHF-UHFFFAOYSA-N 0 0 373.796 3.944 20 5 FHBDRN COc1cc(C(=O)N(c2ccccn2)C2CCCC2)c([N+](=O)[O-])cc1OC ZINC000154756833 929273210 /nfs/dbraw/zinc/27/32/10/929273210.db2.gz IDIVHWJAHRUFRF-UHFFFAOYSA-N 0 0 371.393 3.596 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)NCC(C)(C)Oc1ccccc1 ZINC000609634945 929280253 /nfs/dbraw/zinc/28/02/53/929280253.db2.gz CUVHCAZMXFJQBW-UHFFFAOYSA-N 0 0 357.410 3.594 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])c[nH]1)N1CCSC[C@@H]1c1ccc(Cl)cc1 ZINC000609703467 929331945 /nfs/dbraw/zinc/33/19/45/929331945.db2.gz NGAFWIJKNVCKFZ-CQSZACIVSA-N 0 0 351.815 3.507 20 5 FHBDRN Cc1sc(C(=O)N2CCO[C@@H](c3ccc(F)c(C)c3)C2)cc1[N+](=O)[O-] ZINC000134843379 929334725 /nfs/dbraw/zinc/33/47/25/929334725.db2.gz RBFUXZJHMYDKQQ-OAHLLOKOSA-N 0 0 364.398 3.626 20 5 FHBDRN CCOc1cc(C(=O)N(CCC(C)C)C2CC2)c([N+](=O)[O-])cc1OC ZINC000248240813 937321994 /nfs/dbraw/zinc/32/19/94/937321994.db2.gz DZJNYVOQUQTRTA-UHFFFAOYSA-N 0 0 350.415 3.653 20 5 FHBDRN C[C@H]1CCC[C@H](C)C1NC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000609723098 929349116 /nfs/dbraw/zinc/34/91/16/929349116.db2.gz LYCPKUBNYBHGTI-RYUDHWBXSA-N 0 0 354.834 3.958 20 5 FHBDRN Cc1cc([C@@H]2CN(C(=O)c3ccc([N+](=O)[O-])c(C)c3)CCO2)ccc1F ZINC000134853281 929378811 /nfs/dbraw/zinc/37/88/11/929378811.db2.gz JIRPIODUOBDDRF-SFHVURJKSA-N 0 0 358.369 3.564 20 5 FHBDRN COc1ccc(CC(=O)N2C[C@@H](C)C[C@@H]2c2cccc(F)c2)cc1[N+](=O)[O-] ZINC000610244132 929469121 /nfs/dbraw/zinc/46/91/21/929469121.db2.gz ANIBUYZDHMQZID-SUMWQHHRSA-N 0 0 372.396 3.895 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])c(F)c1)Nc1ccccc1OCC1CC1 ZINC000133769847 929470387 /nfs/dbraw/zinc/47/03/87/929470387.db2.gz YUWAUGVCWSPTAQ-UHFFFAOYSA-N 0 0 360.341 3.540 20 5 FHBDRN O=C(NC[C@@H]1CCCCN1Cc1c(F)cccc1[N+](=O)[O-])c1ccccc1 ZINC000472285585 937336031 /nfs/dbraw/zinc/33/60/31/937336031.db2.gz XKUJKJPWJFBRDX-INIZCTEOSA-N 0 0 371.412 3.518 20 5 FHBDRN C[C@@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1)c1noc(Cc2ccccc2)n1 ZINC000165337968 929509022 /nfs/dbraw/zinc/50/90/22/929509022.db2.gz OZTUDQDCUCOFEY-UONOGXRCSA-N 0 0 352.394 3.980 20 5 FHBDRN Cc1nc([C@H]2CCCN2C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)cs1 ZINC000275092916 929539930 /nfs/dbraw/zinc/53/99/30/929539930.db2.gz RJQLPBBEXKKMHA-CQSZACIVSA-N 0 0 367.377 3.815 20 5 FHBDRN O=C(CSc1ccccc1[N+](=O)[O-])N[C@H]1C[C@@H]1c1c(F)cccc1F ZINC000116223432 929580190 /nfs/dbraw/zinc/58/01/90/929580190.db2.gz SWTGGMZFWKIULY-GWCFXTLKSA-N 0 0 364.373 3.637 20 5 FHBDRN CN(Cc1ccc(Cl)c(Cl)c1)C(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000180595381 929583960 /nfs/dbraw/zinc/58/39/60/929583960.db2.gz CCQQZPBPQXHHFF-UHFFFAOYSA-N 0 0 354.193 3.756 20 5 FHBDRN CC(C)C[C@H](NC(=O)c1c[nH]nc1[N+](=O)[O-])c1cccc(C(F)(F)F)c1 ZINC000547764079 929587658 /nfs/dbraw/zinc/58/76/58/929587658.db2.gz CCCQFSPXPXEMKI-ZDUSSCGKSA-N 0 0 370.331 3.854 20 5 FHBDRN O=C(N[C@H]1C[C@@H]1c1c(F)cccc1Cl)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000120743374 929604177 /nfs/dbraw/zinc/60/41/77/929604177.db2.gz JWVJHJIRSHGQDQ-CPFSXVBKSA-N 0 0 370.714 3.951 20 5 FHBDRN COc1cc(C(=O)N2C[C@H](C)CCC[C@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000134023010 929639724 /nfs/dbraw/zinc/63/97/24/929639724.db2.gz DFAAHOJBRUPREH-GHMZBOCLSA-N 0 0 372.368 3.856 20 5 FHBDRN C[C@@H](CC(=O)OCCn1ccc([N+](=O)[O-])n1)c1ccc(C(F)(F)F)cc1 ZINC000748122900 929641458 /nfs/dbraw/zinc/64/14/58/929641458.db2.gz RMASNBDZVSACLZ-NSHDSACASA-N 0 0 371.315 3.547 20 5 FHBDRN C[C@H]1CCCCCN1S(=O)(=O)c1c(Cl)ccc([N+](=O)[O-])c1Cl ZINC001211573817 937349225 /nfs/dbraw/zinc/34/92/25/937349225.db2.gz XVIKOFMBMQYTSO-VIFPVBQESA-N 0 0 367.254 3.855 20 5 FHBDRN O=C(c1cccc([N+](=O)[O-])c1)N1CCN(CC(F)(F)F)c2ccccc21 ZINC000471450301 929687606 /nfs/dbraw/zinc/68/76/06/929687606.db2.gz IVEPEWAUVNZFPJ-UHFFFAOYSA-N 0 0 365.311 3.624 20 5 FHBDRN CNc1ccc(C(=O)NCCc2c[nH]c3ccc(Cl)cc23)cc1[N+](=O)[O-] ZINC000610294774 929697370 /nfs/dbraw/zinc/69/73/70/929697370.db2.gz GFKHLDDLVRIEAR-UHFFFAOYSA-N 0 0 372.812 3.744 20 5 FHBDRN O=C(c1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CC[C@H](c2ccco2)C1 ZINC000610293669 929698468 /nfs/dbraw/zinc/69/84/68/929698468.db2.gz MBVKJFPLJREYEP-JTQLQIEISA-N 0 0 354.284 3.836 20 5 FHBDRN CC(C)n1cc([C@H](C)NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])cn1 ZINC000610294895 929700900 /nfs/dbraw/zinc/70/09/00/929700900.db2.gz RWZONZZEGZIWOL-JTQLQIEISA-N 0 0 370.331 3.882 20 5 FHBDRN C[C@@H](c1ccc(NC(=O)Nc2ccc([N+](=O)[O-])cc2)cc1)N1CCOCC1 ZINC000109846648 929714037 /nfs/dbraw/zinc/71/40/37/929714037.db2.gz VHKDYDCYROAFEF-AWEZNQCLSA-N 0 0 370.409 3.632 20 5 FHBDRN Cn1cc([N+](=O)[O-])c(C(=O)Nc2cc(-c3ccccc3)ccc2Cl)n1 ZINC000471456542 929726774 /nfs/dbraw/zinc/72/67/74/929726774.db2.gz BSIHUFPYCNQSFW-UHFFFAOYSA-N 0 0 356.769 3.901 20 5 FHBDRN CCC[C@@H](CCO)CNC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000275661403 929763739 /nfs/dbraw/zinc/76/37/39/929763739.db2.gz MVZWKEOAPNJHKI-AWEZNQCLSA-N 0 0 352.434 3.622 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)N1CC[C@@H]1c1cccc(F)c1 ZINC000610305289 929770485 /nfs/dbraw/zinc/77/04/85/929770485.db2.gz SYQMDWKNKNNFEY-GOSISDBHSA-N 0 0 353.353 3.662 20 5 FHBDRN CCS[C@H]1CCC[C@@H]1NC(=O)c1cc([N+](=O)[O-])ccc1Br ZINC000175823251 929773489 /nfs/dbraw/zinc/77/34/89/929773489.db2.gz MCDAVIJCHFKXCZ-STQMWFEESA-N 0 0 373.272 3.761 20 5 FHBDRN COc1cc(C[NH2+]C[C@H]2CCCC[C@H]2C(F)(F)F)c([N+](=O)[O-])cc1O ZINC000579050823 929781801 /nfs/dbraw/zinc/78/18/01/929781801.db2.gz ANEFMTBRLXUIOY-ZYHUDNBSSA-N 0 0 362.348 3.767 20 5 FHBDRN CCC(CC)c1nnc(NC(=O)c2cc([N+](=O)[O-])ccc2OC)s1 ZINC000022975313 929783367 /nfs/dbraw/zinc/78/33/67/929783367.db2.gz ZTCPXCNPYCPJDW-UHFFFAOYSA-N 0 0 350.400 3.611 20 5 FHBDRN COC(=O)c1cc(NC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)ccc1C ZINC000471474725 929855828 /nfs/dbraw/zinc/85/58/28/929855828.db2.gz DRAVILKFIVAGTE-UHFFFAOYSA-N 0 0 362.769 3.524 20 5 FHBDRN O=C(c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12)N1CCCSCC1 ZINC000275679886 929856955 /nfs/dbraw/zinc/85/69/55/929856955.db2.gz OBDUOZOXZXNPPX-UHFFFAOYSA-N 0 0 374.412 3.951 20 5 FHBDRN Cc1ccc([C@@H]2C[C@@H](C)CCN2S(=O)(=O)c2ccccc2[N+](=O)[O-])o1 ZINC000610316778 929874789 /nfs/dbraw/zinc/87/47/89/929874789.db2.gz CKJJINCEZWPCHN-WFASDCNBSA-N 0 0 364.423 3.658 20 5 FHBDRN CC[C@H]1CCc2ccccc2N1C(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000177658324 929887449 /nfs/dbraw/zinc/88/74/49/929887449.db2.gz VEKKLYGWUYLVFC-AWEZNQCLSA-N 0 0 370.405 3.984 20 5 FHBDRN O=C(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1scnc1C1CCCC1 ZINC000278213143 937371962 /nfs/dbraw/zinc/37/19/62/937371962.db2.gz TVURRQURIHYMCB-UHFFFAOYSA-N 0 0 371.422 3.515 20 5 FHBDRN Cc1nc(-c2ccccc2)c(C(=O)Nc2ccc([N+](=O)[O-])c(C)n2)s1 ZINC000177667094 929998348 /nfs/dbraw/zinc/99/83/48/929998348.db2.gz IKWCQXAEIMHRTA-UHFFFAOYSA-N 0 0 354.391 3.982 20 5 FHBDRN CCNc1ccc(C(=O)NCc2ccc3ncccc3c2)cc1[N+](=O)[O-] ZINC000471498853 930022685 /nfs/dbraw/zinc/02/26/85/930022685.db2.gz GRISKAMLMBCFDD-UHFFFAOYSA-N 0 0 350.378 3.505 20 5 FHBDRN Cc1nn(CCC(=O)N[C@H](C)[C@H](C)C2CCCCC2)c(C)c1[N+](=O)[O-] ZINC000176695414 937379096 /nfs/dbraw/zinc/37/90/96/937379096.db2.gz NUZDYJOFOVYPFQ-QWHCGFSZSA-N 0 0 350.463 3.519 20 5 FHBDRN CSc1ccc(C(=O)OCc2c(C)nn(C(F)F)c2C)cc1[N+](=O)[O-] ZINC000784996619 930036298 /nfs/dbraw/zinc/03/62/98/930036298.db2.gz JPVLOKHDIRFMQU-UHFFFAOYSA-N 0 0 371.365 3.882 20 5 FHBDRN CCCOc1cc(O)ccc1NC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000430475025 930050800 /nfs/dbraw/zinc/05/08/00/930050800.db2.gz QPDMVYKBUZXSPR-UHFFFAOYSA-N 0 0 355.350 3.823 20 5 FHBDRN Cc1ccccc1-c1csc(NC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)n1 ZINC000102229126 937384851 /nfs/dbraw/zinc/38/48/51/937384851.db2.gz WFPYUBSKBUHJKS-UHFFFAOYSA-N 0 0 371.422 3.597 20 5 FHBDRN COc1ccc(C(=O)NCc2ccc(OC(C)(C)C)cc2)cc1[N+](=O)[O-] ZINC000146144205 930061817 /nfs/dbraw/zinc/06/18/17/930061817.db2.gz IGHUQPOVEMYPOW-UHFFFAOYSA-N 0 0 358.394 3.711 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)c1cc(Cl)c2ccccc2n1 ZINC001266555681 930064258 /nfs/dbraw/zinc/06/42/58/930064258.db2.gz QZNGTWCWPIIROK-UHFFFAOYSA-N 0 0 371.780 3.735 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)N[C@@H](CC1CC1)c1ccccc1 ZINC000610349096 930065605 /nfs/dbraw/zinc/06/56/05/930065605.db2.gz UVEPFGCZIFNMHP-IBGZPJMESA-N 0 0 353.422 3.978 20 5 FHBDRN O=C(Nc1ccc2cc([N+](=O)[O-])ccc2n1)C(=O)c1ccc(Cl)cc1 ZINC000176702339 937380478 /nfs/dbraw/zinc/38/04/78/937380478.db2.gz OMABSDXJRYDXMN-UHFFFAOYSA-N 0 0 355.737 3.618 20 5 FHBDRN O=C(NCC1(c2cccc(Cl)c2)CC1)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000610068620 930099890 /nfs/dbraw/zinc/09/98/90/930099890.db2.gz OVFJHRZFXVSNRN-UHFFFAOYSA-N 0 0 370.796 3.586 20 5 FHBDRN CN(C[C@@H]1CCCOC1)C(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000275746848 930106662 /nfs/dbraw/zinc/10/66/62/930106662.db2.gz CMKPRHWQYJWIQK-AWEZNQCLSA-N 0 0 350.418 3.592 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CC[C@H](c3ccc(F)cc3)C2)c1 ZINC000471514876 930112591 /nfs/dbraw/zinc/11/25/91/930112591.db2.gz NTGZEGAGMDKYBY-DZGCQCFKSA-N 0 0 358.369 3.809 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CC[C@H](c3ccc(F)cc3)C2)c1 ZINC000471514879 930112721 /nfs/dbraw/zinc/11/27/21/930112721.db2.gz NTGZEGAGMDKYBY-ZFWWWQNUSA-N 0 0 358.369 3.809 20 5 FHBDRN CCN(C[C@H]1CCN(c2ccc(Cl)cc2[N+](=O)[O-])C1)CC(F)(F)F ZINC000471519517 930127672 /nfs/dbraw/zinc/12/76/72/930127672.db2.gz HZJNEKRSEKZZNE-LLVKDONJSA-N 0 0 365.783 3.959 20 5 FHBDRN O=C(N[C@@H]1CCOc2ccc(F)cc21)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000548052137 930167849 /nfs/dbraw/zinc/16/78/49/930167849.db2.gz KUKRRUBBJRDVFW-CQSZACIVSA-N 0 0 356.309 3.734 20 5 FHBDRN C[C@H](NC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2)c1ccc(C2CC2)cc1 ZINC000580051819 930183963 /nfs/dbraw/zinc/18/39/63/930183963.db2.gz CBIIQGSPEVACRD-NSHDSACASA-N 0 0 354.362 3.692 20 5 FHBDRN O=C(Nc1ccc(F)cc1OCC(F)(F)F)c1ccc([N+](=O)[O-])cc1 ZINC000070868315 930190018 /nfs/dbraw/zinc/19/00/18/930190018.db2.gz DWTACLUMJNSUNN-UHFFFAOYSA-N 0 0 358.247 3.927 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)NCCCOc1ccc(C)cc1 ZINC000536099200 930194181 /nfs/dbraw/zinc/19/41/81/930194181.db2.gz MIDOAJISOWJCBK-UHFFFAOYSA-N 0 0 358.394 3.501 20 5 FHBDRN O=C(Nc1cccc2c[nH]nc21)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000064906355 930195728 /nfs/dbraw/zinc/19/57/28/930195728.db2.gz HVIMPSGTIOKZGO-UHFFFAOYSA-N 0 0 365.374 3.847 20 5 FHBDRN CNC(=O)c1ccc(NCCOc2ccc(C(C)(C)C)cc2)c([N+](=O)[O-])c1 ZINC000064905030 930197207 /nfs/dbraw/zinc/19/72/07/930197207.db2.gz NZTTWGZXDBJECN-UHFFFAOYSA-N 0 0 371.437 3.743 20 5 FHBDRN COc1ccc(NC(=O)c2ccn(-c3ccccc3Cl)n2)c([N+](=O)[O-])c1 ZINC000064896875 930205088 /nfs/dbraw/zinc/20/50/88/930205088.db2.gz HBCSGDAOGPJOPS-UHFFFAOYSA-N 0 0 372.768 3.695 20 5 FHBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N[C@H]1CCC[C@H](F)C1 ZINC000580077542 930218062 /nfs/dbraw/zinc/21/80/62/930218062.db2.gz UVWAFFAHUKHNEC-UWVGGRQHSA-N 0 0 359.195 3.676 20 5 FHBDRN O=C(N[C@H]1CC[C@H](c2ccc(F)cc2)C1)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000471538558 930240959 /nfs/dbraw/zinc/24/09/59/930240959.db2.gz PCILSHFLHPVALF-WFASDCNBSA-N 0 0 372.352 3.529 20 5 FHBDRN O=C(CCc1cccs1)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000556469371 930240969 /nfs/dbraw/zinc/24/09/69/930240969.db2.gz OQWAGGYVHYDHAQ-UHFFFAOYSA-N 0 0 355.213 3.990 20 5 FHBDRN CC[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1C)c1ccc(OC)c(OC)c1 ZINC000580107328 930257156 /nfs/dbraw/zinc/25/71/56/930257156.db2.gz WHPLPXHLCZTJPE-MRXNPFEDSA-N 0 0 358.394 3.802 20 5 FHBDRN C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCN2c2ccc3cc([N+](=O)[O-])ccc3n2)C1 ZINC000580113581 930262834 /nfs/dbraw/zinc/26/28/34/930262834.db2.gz PWZUPARBOFBFHT-HQJJXPTPSA-N 0 0 355.438 3.909 20 5 FHBDRN C[C@H]1CN(C)c2ccccc2N(C(=O)c2cccc(Cl)c2[N+](=O)[O-])C1 ZINC000175899777 930263129 /nfs/dbraw/zinc/26/31/29/930263129.db2.gz ZWSBIHLENOSTBY-LBPRGKRZSA-N 0 0 359.813 3.981 20 5 FHBDRN O=C(CNc1cc(F)cc([N+](=O)[O-])c1)Nc1ccc(Br)cc1 ZINC000480159287 937405277 /nfs/dbraw/zinc/40/52/77/937405277.db2.gz BDLRDQGTLALLSU-UHFFFAOYSA-N 0 0 368.162 3.547 20 5 FHBDRN CCCN(C[C@H]1COc2ccccc2O1)C(=O)c1ccc(C)c([N+](=O)[O-])c1 ZINC000049957968 930286801 /nfs/dbraw/zinc/28/68/01/930286801.db2.gz SMWGSBQQIBRBAI-INIZCTEOSA-N 0 0 370.405 3.595 20 5 FHBDRN COCC1(CN[C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)CCCCC1 ZINC000564426659 930300323 /nfs/dbraw/zinc/30/03/23/930300323.db2.gz CGKPODGUKBVBRB-GOSISDBHSA-N 0 0 372.469 3.604 20 5 FHBDRN COc1ccc(OCCN2CCCSc3ccccc32)c([N+](=O)[O-])c1 ZINC000610389681 930301360 /nfs/dbraw/zinc/30/13/60/930301360.db2.gz JZTSDDFYSQZKOY-UHFFFAOYSA-N 0 0 360.435 3.985 20 5 FHBDRN CCc1c(C(=O)N(Cc2ccc([N+](=O)[O-])cc2)c2ccccc2)cnn1C ZINC000610389533 930306466 /nfs/dbraw/zinc/30/64/66/930306466.db2.gz SGZCHNKZJQJWFJ-UHFFFAOYSA-N 0 0 364.405 3.738 20 5 FHBDRN CCN(CC(F)(F)F)C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000064908140 930309995 /nfs/dbraw/zinc/30/99/95/930309995.db2.gz BDIMTOROFACKMX-UHFFFAOYSA-N 0 0 359.329 3.743 20 5 FHBDRN CN(C(=O)c1cc([N+](=O)[O-])ccc1Br)c1ccccc1F ZINC000050008584 930338354 /nfs/dbraw/zinc/33/83/54/930338354.db2.gz ZHRWRYFQRQOHTQ-UHFFFAOYSA-N 0 0 353.147 3.773 20 5 FHBDRN COc1cccc(-c2nc(CCCOc3ccc(F)cc3)no2)c1[N+](=O)[O-] ZINC000580207589 930361052 /nfs/dbraw/zinc/36/10/52/930361052.db2.gz KNKPBIODLHCJDM-UHFFFAOYSA-N 0 0 373.340 3.804 20 5 FHBDRN O=C1Nc2cc(Cl)c([N+](=O)[O-])cc2/C1=C/c1cc(F)c([O-])c(F)c1 ZINC000255181139 930368762 /nfs/dbraw/zinc/36/87/62/930368762.db2.gz CJRRIZSNTCSKAV-QPIMQUGISA-N 0 0 352.680 3.725 20 5 FHBDRN CC1=C(c2ccco2)CN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC1 ZINC000579498154 930392158 /nfs/dbraw/zinc/39/21/58/930392158.db2.gz APSMXQAHNKNLHL-UHFFFAOYSA-N 0 0 366.377 3.917 20 5 FHBDRN O=[N+]([O-])c1ccccc1NCCc1noc(-c2ccoc2C(F)(F)F)n1 ZINC000583410854 937415470 /nfs/dbraw/zinc/41/54/70/937415470.db2.gz IXUDBYDNEOZAJS-UHFFFAOYSA-N 0 0 368.271 3.911 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)NCc1ccc(Br)s1 ZINC000070937621 930444695 /nfs/dbraw/zinc/44/46/95/930444695.db2.gz FZXANFFSDRGNTO-UHFFFAOYSA-N 0 0 355.213 3.657 20 5 FHBDRN CCOc1ccc(NC(=O)CNc2ccccc2SC)c([N+](=O)[O-])c1 ZINC000070945011 930445464 /nfs/dbraw/zinc/44/54/64/930445464.db2.gz KUAJYZBSJAUHMG-UHFFFAOYSA-N 0 0 361.423 3.766 20 5 FHBDRN O=[N+]([O-])c1cn(CN2CCSC3(CCCCC3)C2)nc1-c1ccncc1 ZINC000175926827 930485022 /nfs/dbraw/zinc/48/50/22/930485022.db2.gz XLFYZFSQIOSFFJ-UHFFFAOYSA-N 0 0 373.482 3.563 20 5 FHBDRN CCc1ccc(C(=O)Nc2cccc(C(=O)OC)c2Cl)cc1[N+](=O)[O-] ZINC000579531460 930490495 /nfs/dbraw/zinc/49/04/95/930490495.db2.gz ZGGHNPSPJOGTSA-UHFFFAOYSA-N 0 0 362.769 3.850 20 5 FHBDRN C[C@@]1(CNc2ccc([N+](=O)[O-])cc2N2CCOC2=O)CC1(Cl)Cl ZINC000828798693 930504216 /nfs/dbraw/zinc/50/42/16/930504216.db2.gz QWJCKEWGMOHFOT-ZDUSSCGKSA-N 0 0 360.197 3.547 20 5 FHBDRN CCOc1ccc(NC(=O)CN2CCCc3c(C)cccc32)c([N+](=O)[O-])c1 ZINC001167380328 930509194 /nfs/dbraw/zinc/50/91/94/930509194.db2.gz GDVICDQDZCJCSI-UHFFFAOYSA-N 0 0 369.421 3.693 20 5 FHBDRN C[C@H]1C(=O)CC[C@H](C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)C1(C)C ZINC000275844089 930524069 /nfs/dbraw/zinc/52/40/69/930524069.db2.gz WCOLHTNALVSLGU-WMLDXEAASA-N 0 0 360.454 3.675 20 5 FHBDRN CSc1cc2c(cc1NC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1)OCCO2 ZINC000579547635 930530469 /nfs/dbraw/zinc/53/04/69/930530469.db2.gz JJNDVQLCIGTRMK-LLVKDONJSA-N 0 0 374.418 3.830 20 5 FHBDRN CCc1ccc(C(=O)Nc2ccc(Cl)c(C(=O)OC)c2)cc1[N+](=O)[O-] ZINC000610434029 930534887 /nfs/dbraw/zinc/53/48/87/930534887.db2.gz VRJIHPKVJNQFCG-UHFFFAOYSA-N 0 0 362.769 3.850 20 5 FHBDRN CCOC[C@H]1CCN(C(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)C1 ZINC000275847728 930536660 /nfs/dbraw/zinc/53/66/60/930536660.db2.gz WUSWXARWLXMMMD-AWEZNQCLSA-N 0 0 350.418 3.592 20 5 FHBDRN CCOC[C@@H]1CCN(C(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)C1 ZINC000275847736 930536764 /nfs/dbraw/zinc/53/67/64/930536764.db2.gz WUSWXARWLXMMMD-CQSZACIVSA-N 0 0 350.418 3.592 20 5 FHBDRN NC(=O)C1CCN(c2cccc(Nc3ccc(Cl)cc3[N+](=O)[O-])c2)CC1 ZINC000471564268 930559447 /nfs/dbraw/zinc/55/94/47/930559447.db2.gz VOQLGXUYMWKBMX-UHFFFAOYSA-N 0 0 374.828 3.694 20 5 FHBDRN CCN(c1ccc2[nH]ccc2c1)S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-] ZINC000471567697 930590810 /nfs/dbraw/zinc/59/08/10/930590810.db2.gz RODIWFGGTNFTQQ-UHFFFAOYSA-N 0 0 373.434 3.908 20 5 FHBDRN Cc1cc(NC(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)ncc1Br ZINC000319538178 930614796 /nfs/dbraw/zinc/61/47/96/930614796.db2.gz KNYJIIRZQBKYRR-JTQLQIEISA-N 0 0 364.199 3.803 20 5 FHBDRN C[C@H](C(=O)Nc1nc2c(s1)C(=O)CC(C)(C)C2)c1cccc([N+](=O)[O-])c1 ZINC000580393738 930619833 /nfs/dbraw/zinc/61/98/33/930619833.db2.gz OYIRZDQZCOJPTB-JTQLQIEISA-N 0 0 373.434 3.949 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])Nc1ccc2[nH]c(C3CCC3)nc2c1 ZINC000109894353 930626749 /nfs/dbraw/zinc/62/67/49/930626749.db2.gz CTHUNVZGQJORBJ-UHFFFAOYSA-N 0 0 365.393 3.789 20 5 FHBDRN COc1cc(OCC(=O)N([C@H](C)c2ccccc2)C2CC2)ccc1[N+](=O)[O-] ZINC000561106995 930647634 /nfs/dbraw/zinc/64/76/34/930647634.db2.gz JUQKYMKVBLKIQT-CQSZACIVSA-N 0 0 370.405 3.734 20 5 FHBDRN Cc1cc(C)n(-c2ccc(CC(=O)Nc3cc(F)cc([N+](=O)[O-])c3)cc2)n1 ZINC000548094004 930648633 /nfs/dbraw/zinc/64/86/33/930648633.db2.gz KRRVLROWHUKXCL-UHFFFAOYSA-N 0 0 368.368 3.718 20 5 FHBDRN O=C(Nc1cc(F)cc([N+](=O)[O-])c1)c1ccc2[nH]c(C(F)F)nc2c1 ZINC000548094315 930664812 /nfs/dbraw/zinc/66/48/12/930664812.db2.gz DSDWHMOZBVNBHI-UHFFFAOYSA-N 0 0 350.256 3.800 20 5 FHBDRN CC[C@H]1c2ccccc2CCN1C(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000074644968 930682881 /nfs/dbraw/zinc/68/28/81/930682881.db2.gz HWUSVKUNFRNLMS-INIZCTEOSA-N 0 0 370.405 3.762 20 5 FHBDRN CC(=O)c1ccc(OS(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])c(C)c1 ZINC000728296487 930683611 /nfs/dbraw/zinc/68/36/11/930683611.db2.gz IVNOAKNQIULCTQ-UHFFFAOYSA-N 0 0 369.782 3.527 20 5 FHBDRN O=C(Nc1cc2c(cc1[N+](=O)[O-])OCCCO2)c1cc2c(s1)CCCC2 ZINC000119121712 930698684 /nfs/dbraw/zinc/69/86/84/930698684.db2.gz RVYPKDMTJMNVDA-UHFFFAOYSA-N 0 0 374.418 3.949 20 5 FHBDRN Cc1cc(C)cc(C2=CCN(C(=O)c3cc([N+](=O)[O-])cnc3C)CC2)c1 ZINC000091823229 930736757 /nfs/dbraw/zinc/73/67/57/930736757.db2.gz NVHSZVIDGAWTBC-UHFFFAOYSA-N 0 0 351.406 3.845 20 5 FHBDRN CC(=O)c1ccc(OCc2nc(-c3ccc(F)cc3)no2)c([N+](=O)[O-])c1 ZINC000119144371 930747855 /nfs/dbraw/zinc/74/78/55/930747855.db2.gz APIJHUWNCQUFPM-UHFFFAOYSA-N 0 0 357.297 3.566 20 5 FHBDRN CC(=O)c1ccc(OCC(=O)N2c3ccccc3CC[C@H]2C)c([N+](=O)[O-])c1 ZINC000119148384 930748677 /nfs/dbraw/zinc/74/86/77/930748677.db2.gz MLVSPRAKFSZJDK-CYBMUJFWSA-N 0 0 368.389 3.544 20 5 FHBDRN COc1ccc2cc(C(=O)N(C)Cc3ccccc3[N+](=O)[O-])c(C)nc2c1 ZINC000046361861 930783912 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FHBDRN COc1cc2ccc(NC(=O)c3cccc([N+](=O)[O-])c3N)cc2cc1OC ZINC001167421287 930899041 /nfs/dbraw/zinc/89/90/41/930899041.db2.gz WEHXYICESXZNLI-UHFFFAOYSA-N 0 0 367.361 3.600 20 5 FHBDRN COc1cc(-c2nc(COc3ccccc3C)no2)cc([N+](=O)[O-])c1C ZINC000580601514 930911153 /nfs/dbraw/zinc/91/11/53/930911153.db2.gz NOASFFBFPXYANE-UHFFFAOYSA-N 0 0 355.350 3.849 20 5 FHBDRN O=[N+]([O-])c1ccccc1NCCc1noc(C2=Cc3ccccc3OC2)n1 ZINC000580607439 930919283 /nfs/dbraw/zinc/91/92/83/930919283.db2.gz QRMJKDSQGUCQLP-UHFFFAOYSA-N 0 0 364.361 3.565 20 5 FHBDRN O=[N+]([O-])c1ccc(CNc2ccc3nccnc3c2Br)cc1 ZINC000319845622 930921303 /nfs/dbraw/zinc/92/13/03/930921303.db2.gz FCSYDKPOFGWGNP-UHFFFAOYSA-N 0 0 359.183 3.913 20 5 FHBDRN Cc1ccc(-c2c[nH]cc2C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)s1 ZINC000580666052 930990330 /nfs/dbraw/zinc/99/03/30/930990330.db2.gz ZGBNULABSXABIY-UHFFFAOYSA-N 0 0 367.390 3.510 20 5 FHBDRN CC(=O)c1cc(N[C@@H](C)CCc2ccc3c(c2)OCO3)ccc1[N+](=O)[O-] ZINC000561158894 931036396 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360.797 3.519 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H](CC)c1c(C)noc1C ZINC000439905724 945070213 /nfs/dbraw/zinc/07/02/13/945070213.db2.gz WQBHFMXBRZUDIP-ZDUSSCGKSA-N 0 0 362.386 3.871 20 5 FHBDRN Cn1cc([N+](=O)[O-])cc1C(=O)OCc1csc(-c2ccccc2F)n1 ZINC000728320901 931688015 /nfs/dbraw/zinc/68/80/15/931688015.db2.gz OYFJBVWYTMWONY-UHFFFAOYSA-N 0 0 361.354 3.553 20 5 FHBDRN COc1ccc2c(c1)CCN2C(=O)c1c([N+](=O)[O-])cccc1C(F)(F)F ZINC000581217805 931692825 /nfs/dbraw/zinc/69/28/25/931692825.db2.gz KTWABFMADYUYHD-UHFFFAOYSA-N 0 0 366.295 3.825 20 5 FHBDRN Cn1nccc1CCC(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000477031914 931699071 /nfs/dbraw/zinc/69/90/71/931699071.db2.gz QJJVPVPNBCRMDN-UHFFFAOYSA-N 0 0 366.377 3.692 20 5 FHBDRN C[C@@H]1CO[C@H](c2ccccc2)CN1C(=O)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000156932358 931720526 /nfs/dbraw/zinc/72/05/26/931720526.db2.gz CMMRARQWRYPEMO-PXAZEXFGSA-N 0 0 360.797 3.850 20 5 FHBDRN O=C(NCc1ccccc1OCC(F)(F)F)c1ccc([N+](=O)[O-])cc1F ZINC000126316991 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CCCN1Cc2cccc(NC(=O)COc3ccc([N+](=O)[O-])c(C)c3)c2C1 ZINC000430556331 931827143 /nfs/dbraw/zinc/82/71/43/931827143.db2.gz YVXDPNSICYQDMM-UHFFFAOYSA-N 0 0 369.421 3.646 20 5 FHBDRN Cc1cc(OCC(=O)NC[C@@H]2CCCc3ccccc32)ccc1[N+](=O)[O-] ZINC000510384503 931829593 /nfs/dbraw/zinc/82/95/93/931829593.db2.gz MSBFGNOQQVJUAW-INIZCTEOSA-N 0 0 354.406 3.518 20 5 FHBDRN Cc1ccc(NC(=O)c2ccc(N[C@@H](C)[C@H](C)CO)c([N+](=O)[O-])c2)cc1 ZINC000077227487 931835237 /nfs/dbraw/zinc/83/52/37/931835237.db2.gz QJJODJRIUZKITK-KGLIPLIRSA-N 0 0 357.410 3.584 20 5 FHBDRN CCO[C@H](C)c1nc(CN(C)c2cc(OC)c(F)cc2[N+](=O)[O-])cs1 ZINC000127181901 931863682 /nfs/dbraw/zinc/86/36/82/931863682.db2.gz CNYSILMAQWIHNC-SNVBAGLBSA-N 0 0 369.418 3.933 20 5 FHBDRN CCC[C@H](C)NC(=O)[C@@H]1CCCN(c2ccc([N+](=O)[O-])c3cccnc32)C1 ZINC000050933950 931865415 /nfs/dbraw/zinc/86/54/15/931865415.db2.gz VGZZEIDFNLYXIO-LSDHHAIUSA-N 0 0 370.453 3.664 20 5 FHBDRN C[C@H](c1ncc(-c2ccccc2)o1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000477082245 931869900 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Cc1cc([N+](=O)[O-])cc(C(=O)Nc2c(-c3ccccc3)ncn2C2CC2)n1 ZINC001125496185 931953677 /nfs/dbraw/zinc/95/36/77/931953677.db2.gz RSVNZDUWYKFTRE-UHFFFAOYSA-N 0 0 363.377 3.749 20 5 FHBDRN COc1ccc(CSCC(=O)N2CCCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000510418369 931986644 /nfs/dbraw/zinc/98/66/44/931986644.db2.gz VWKYUWYUXNPKEM-CYBMUJFWSA-N 0 0 352.456 3.628 20 5 FHBDRN CCCc1nc(COC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)cs1 ZINC000728332002 931994200 /nfs/dbraw/zinc/99/42/00/931994200.db2.gz GYMZXWHAKKICNY-UHFFFAOYSA-N 0 0 372.406 3.547 20 5 FHBDRN Cc1c(NC(=O)[C@@H](C)N2CC[C@H]2c2cccc(F)c2)cccc1[N+](=O)[O-] ZINC000610505223 932015190 /nfs/dbraw/zinc/01/51/90/932015190.db2.gz CSNIKBSYPWVEAI-ACJLOTCBSA-N 0 0 357.385 3.816 20 5 FHBDRN CCOc1ccc(NC(=O)CN2CC[C@H]2c2cccc(F)c2)c([N+](=O)[O-])c1 ZINC000610505524 932026760 /nfs/dbraw/zinc/02/67/60/932026760.db2.gz NLFFYAIVFZIPBA-KRWDZBQOSA-N 0 0 373.384 3.518 20 5 FHBDRN COc1cc(C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)ccc1F ZINC000154517691 932030407 /nfs/dbraw/zinc/03/04/07/932030407.db2.gz BGLXOJXJGKSEMB-UHFFFAOYSA-N 0 0 356.256 3.596 20 5 FHBDRN O=C(NCCNc1ccc([N+](=O)[O-])cc1)C1(c2cccc(Cl)c2)CC1 ZINC000033180738 932039738 /nfs/dbraw/zinc/03/97/38/932039738.db2.gz ZSWVKLZOGNYRAU-UHFFFAOYSA-N 0 0 359.813 3.508 20 5 FHBDRN CCCc1nc(COC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)cs1 ZINC000728335609 932040445 /nfs/dbraw/zinc/04/04/45/932040445.db2.gz ASTORUVBIKKKJD-UHFFFAOYSA-N 0 0 359.407 3.702 20 5 FHBDRN COc1ccccc1CNc1ncc([N+](=O)[O-])c(C)c1Br ZINC000165710468 932042764 /nfs/dbraw/zinc/04/27/64/932042764.db2.gz GAJKLYHBWBAPSU-UHFFFAOYSA-N 0 0 352.188 3.681 20 5 FHBDRN CCOc1cc(/C=C\C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)ccc1O ZINC000588412362 932072937 /nfs/dbraw/zinc/07/29/37/932072937.db2.gz WUAUESMXCFJGAH-KJJQSCHISA-N 0 0 356.378 3.590 20 5 FHBDRN CC(C)CO[C@@H](C)c1noc(CN(Cc2ccccc2[N+](=O)[O-])C2CC2)n1 ZINC000135232403 932076521 /nfs/dbraw/zinc/07/65/21/932076521.db2.gz UMFIRWZDPMWWAC-AWEZNQCLSA-N 0 0 374.441 3.876 20 5 FHBDRN Cc1cc2c(s1)N(c1nccc(N)c1[N+](=O)[O-])c1ccccc1NC2=N ZINC001167463446 932076836 /nfs/dbraw/zinc/07/68/36/932076836.db2.gz QPSLGUZQPQVADN-UHFFFAOYSA-N 0 0 366.406 3.762 20 5 FHBDRN CCOC(=O)/C=C\c1ccc(NC(=O)c2ccc(F)cc2[N+](=O)[O-])cc1 ZINC000255309535 932139382 /nfs/dbraw/zinc/13/93/82/932139382.db2.gz MKIVZIASPGSAKP-YHYXMXQVSA-N 0 0 358.325 3.563 20 5 FHBDRN C[C@@H](NCCOc1ccc([N+](=O)[O-])cc1)c1ncc(Br)s1 ZINC000537968114 932174984 /nfs/dbraw/zinc/17/49/84/932174984.db2.gz RBNFCILUOAQGCB-SECBINFHSA-N 0 0 372.244 3.543 20 5 FHBDRN O=C(Nc1cc(-c2cccc(F)c2F)[nH]n1)c1csc([N+](=O)[O-])c1 ZINC000178043855 932213327 /nfs/dbraw/zinc/21/33/27/932213327.db2.gz HXODEKABZOZOED-UHFFFAOYSA-N 0 0 350.306 3.577 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)N[C@H]2CCCO[C@H]2CC(C)C)cc1[N+](=O)[O-] ZINC000477095733 932221533 /nfs/dbraw/zinc/22/15/33/932221533.db2.gz ZDTNJCKKZDHAQB-ZVZYQTTQSA-N 0 0 363.458 3.857 20 5 FHBDRN Cc1c(C(=O)N2CCCc3ccc([N+](=O)[O-])cc32)oc2c1C(=O)CCC2 ZINC000074017840 932247466 /nfs/dbraw/zinc/24/74/66/932247466.db2.gz XFSXKGDYFAEULB-UHFFFAOYSA-N 0 0 354.362 3.608 20 5 FHBDRN CCc1cccc(CC)c1NS(=O)(=O)CCc1ccccc1[N+](=O)[O-] ZINC000157209473 932251509 /nfs/dbraw/zinc/25/15/09/932251509.db2.gz WOZLWPXFPCIFIM-UHFFFAOYSA-N 0 0 362.451 3.704 20 5 FHBDRN CC(=O)c1ccc(OCC(=O)Nc2c(C)cccc2Cl)c([N+](=O)[O-])c1 ZINC000157201548 932251776 /nfs/dbraw/zinc/25/17/76/932251776.db2.gz JKNLAXJNAULVRY-UHFFFAOYSA-N 0 0 362.769 3.777 20 5 FHBDRN Cc1ccc(Cl)c(S(=O)(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000126593516 932266418 /nfs/dbraw/zinc/26/64/18/932266418.db2.gz ATMYBSHIDPAQFG-LLVKDONJSA-N 0 0 354.815 3.596 20 5 FHBDRN CC(C)CCSc1ccc(C(=O)N(C)CCCCO)cc1[N+](=O)[O-] ZINC000276367923 932274583 /nfs/dbraw/zinc/27/45/83/932274583.db2.gz BHPLYRICFOSUNP-UHFFFAOYSA-N 0 0 354.472 3.578 20 5 FHBDRN Cn1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2SC2CCCC2)c1=O ZINC000157306338 932321937 /nfs/dbraw/zinc/32/19/37/932321937.db2.gz NOKMLLWYOBHILO-UHFFFAOYSA-N 0 0 373.434 3.581 20 5 FHBDRN Cc1ccc(CN(c2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)C2CC2)o1 ZINC000610515045 932324332 /nfs/dbraw/zinc/32/43/32/932324332.db2.gz XPRLOTHWGGVELO-UHFFFAOYSA-N 0 0 369.421 3.901 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CCc2c1cccc2Cl ZINC000126670328 932325532 /nfs/dbraw/zinc/32/55/32/932325532.db2.gz VNJWINREGKIJSF-UHFFFAOYSA-N 0 0 355.781 3.861 20 5 FHBDRN O=C(Nc1ccc(O[C@@H]2CCOC2)cc1)[C@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1 ZINC000933334337 932333308 /nfs/dbraw/zinc/33/33/08/932333308.db2.gz HBLVKAAZPDPBJE-QRVBRYPASA-N 0 0 368.389 3.505 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)NCc1ccc(Cl)cc1F ZINC000581625607 932338881 /nfs/dbraw/zinc/33/88/81/932338881.db2.gz QIUWKFBJUDUGST-UHFFFAOYSA-N 0 0 365.792 3.771 20 5 FHBDRN COc1c(C(=O)N[C@@H]2CC[C@@H](c3ccc(F)cc3)C2)cccc1[N+](=O)[O-] ZINC000477149621 932353304 /nfs/dbraw/zinc/35/33/04/932353304.db2.gz GGADJHUOAYNFNR-UKRRQHHQSA-N 0 0 358.369 3.809 20 5 FHBDRN O=C(/C=C\c1ccnc(Cl)c1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000255337990 932360392 /nfs/dbraw/zinc/36/03/92/932360392.db2.gz VGFNHHCIFDOTNC-YVMONPNESA-N 0 0 357.797 3.848 20 5 FHBDRN CCOc1cc(NC(=O)C[C@H](C)c2ccncc2)c([N+](=O)[O-])cc1OCC ZINC000610723345 932371288 /nfs/dbraw/zinc/37/12/88/932371288.db2.gz XCTDVITTWNAWMA-ZDUSSCGKSA-N 0 0 373.409 3.920 20 5 FHBDRN Nc1c(C(=O)N2CCC[C@@H](c3cc4ccccc4[nH]3)C2)cccc1[N+](=O)[O-] ZINC000610520128 932375527 /nfs/dbraw/zinc/37/55/27/932375527.db2.gz FZQQMXOBFMAZDH-CQSZACIVSA-N 0 0 364.405 3.678 20 5 FHBDRN CO[C@@H]1CC[C@@H]1N(C)C(=O)Nc1cc([N+](=O)[O-])cc(C(F)(F)F)c1C ZINC000933345658 932375789 /nfs/dbraw/zinc/37/57/89/932375789.db2.gz MJZNGDOGTCWETC-QWHCGFSZSA-N 0 0 361.320 3.563 20 5 FHBDRN O=C1OC(c2ccccc2OC(F)F)=N/C1=C/c1ccc([N+](=O)[O-])s1 ZINC000588421361 932388836 /nfs/dbraw/zinc/38/88/36/932388836.db2.gz RUTKHJQBFZHUQQ-JXMROGBWSA-N 0 0 366.301 3.602 20 5 FHBDRN Cc1cccc(N2C(=O)C(=Cc3ccc([N+](=O)[O-])s3)NC2=S)c1C ZINC000588421083 932390009 /nfs/dbraw/zinc/39/00/09/932390009.db2.gz ISEQOWGXFWCFAX-WQLSENKSSA-N 0 0 359.432 3.535 20 5 FHBDRN CO[C@@H](C)c1nc(CNC(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)cs1 ZINC000276439943 932424266 /nfs/dbraw/zinc/42/42/66/932424266.db2.gz RGXPOPFVFGRVLK-NSHDSACASA-N 0 0 364.427 3.697 20 5 FHBDRN C[C@@H](NC(=O)CN(C)c1ccccc1[N+](=O)[O-])c1c(F)cccc1Cl ZINC000477259573 932435407 /nfs/dbraw/zinc/43/54/07/932435407.db2.gz NWEZCTZHERBRRA-LLVKDONJSA-N 0 0 365.792 3.701 20 5 FHBDRN COc1cc(C(=O)N2c3ccccc3SC[C@@H]2C)c([N+](=O)[O-])cc1OC ZINC000430634202 932444553 /nfs/dbraw/zinc/44/45/53/932444553.db2.gz CURMMIGIHIXDEJ-NSHDSACASA-N 0 0 374.418 3.753 20 5 FHBDRN Cn1ccc2cccc(NC(=O)c3ccc(OC(F)F)c([N+](=O)[O-])c3)c21 ZINC000471679336 932467098 /nfs/dbraw/zinc/46/70/98/932467098.db2.gz NZKGPOCYWXZROG-UHFFFAOYSA-N 0 0 361.304 3.940 20 5 FHBDRN C[C@@H](NC(=O)NCc1ccccc1[N+](=O)[O-])c1c(F)cccc1Cl ZINC000175920588 932500593 /nfs/dbraw/zinc/50/05/93/932500593.db2.gz LBDVSDUJNIOZLJ-SNVBAGLBSA-N 0 0 351.765 3.948 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)Nc1cncc(Br)c1 ZINC000477411544 932541046 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CC(C)[C@H]1CC[C@@H](C)C[C@@H]1CNC(=O)CN(C)c1ccccc1[N+](=O)[O-] ZINC001125532536 932607396 /nfs/dbraw/zinc/60/73/96/932607396.db2.gz QQGWNKXDVJUIKD-BRWVUGGUSA-N 0 0 361.486 3.856 20 5 FHBDRN COc1ccc(OC)c(NC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)c1 ZINC000023132288 932615768 /nfs/dbraw/zinc/61/57/68/932615768.db2.gz QBAWTHGIPUVNOS-LLVKDONJSA-N 0 0 362.407 3.731 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)N[C@H]1CC[C@H](c2ccc(F)cc2)C1 ZINC000471687651 932617995 /nfs/dbraw/zinc/61/79/95/932617995.db2.gz YERNMIBITCCXCR-RDJZCZTQSA-N 0 0 357.385 3.869 20 5 FHBDRN Cc1cnc(OCCCc2nc(-c3ccc(C)c(F)c3)no2)c([N+](=O)[O-])c1 ZINC000157929761 932632192 /nfs/dbraw/zinc/63/21/92/932632192.db2.gz TUSHPSWDNQWKEV-UHFFFAOYSA-N 0 0 372.356 3.807 20 5 FHBDRN CC1(C)[C@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2)C[C@H]1OCc1ccccc1 ZINC000471705714 932663006 /nfs/dbraw/zinc/66/30/06/932663006.db2.gz LYCMVDYHKBMFQI-RTBURBONSA-N 0 0 368.433 3.637 20 5 FHBDRN Cc1c(C(=O)Nc2c(-c3ccncc3)nc3ccccn32)cccc1[N+](=O)[O-] ZINC000430659072 932665228 /nfs/dbraw/zinc/66/52/28/932665228.db2.gz KTTDJXHDXZYKEN-UHFFFAOYSA-N 0 0 373.372 3.865 20 5 FHBDRN CC(C)n1nc2c(c1NC(=O)c1cc3cc([N+](=O)[O-])ccc3o1)CCC2 ZINC000471709772 932679078 /nfs/dbraw/zinc/67/90/78/932679078.db2.gz TZJHGNJCOYMVPJ-UHFFFAOYSA-N 0 0 354.366 3.859 20 5 FHBDRN C[C@H]1CCc2c(F)cccc2[C@@H]1NC(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000430660962 932689510 /nfs/dbraw/zinc/68/95/10/932689510.db2.gz FFPRQGSEOUWSLV-HXPMCKFVSA-N 0 0 358.369 3.553 20 5 FHBDRN CNC(=O)c1ccc(N[C@@H](C[C@H]2CCOC2)c2ccccc2)c([N+](=O)[O-])c1 ZINC000157957987 932700683 /nfs/dbraw/zinc/70/06/83/932700683.db2.gz NBDIKXAZNVSINH-KDOFPFPSSA-N 0 0 369.421 3.534 20 5 FHBDRN C[C@@H]1C[C@@H]1c1ccc(CN(C(=O)c2cccc([N+](=O)[O-])c2N)C2CC2)o1 ZINC000178164798 932727390 /nfs/dbraw/zinc/72/73/90/932727390.db2.gz ICTDREBMSNIBBP-ABAIWWIYSA-N 0 0 355.394 3.698 20 5 FHBDRN CSc1ccc(NC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)cc1Cl ZINC000081093654 932734856 /nfs/dbraw/zinc/73/48/56/932734856.db2.gz YJBNKMLCFJWPTB-UHFFFAOYSA-N 0 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ZINC000175966529 932885418 /nfs/dbraw/zinc/88/54/18/932885418.db2.gz BPQIRODNWKSYPR-LBPRGKRZSA-N 0 0 365.336 3.660 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H](CC)c1c(C)noc1C ZINC000439905723 945070332 /nfs/dbraw/zinc/07/03/32/945070332.db2.gz WQBHFMXBRZUDIP-CYBMUJFWSA-N 0 0 362.386 3.871 20 5 FHBDRN COc1ccc(CN(Cn2nc(C)c([N+](=O)[O-])c2C)[C@@H](C)C2CC2)cc1 ZINC000098051734 932934551 /nfs/dbraw/zinc/93/45/51/932934551.db2.gz XAJLDFXHHTVAJQ-AWEZNQCLSA-N 0 0 358.442 3.675 20 5 FHBDRN COc1ccc(NC(=O)/C(C)=C\c2ccc([N+](=O)[O-])cc2)c([N+](=O)[O-])c1 ZINC000588435783 932935535 /nfs/dbraw/zinc/93/55/35/932935535.db2.gz ALTBPTHWTSFVQS-LUAWRHEFSA-N 0 0 357.322 3.554 20 5 FHBDRN COc1ccc(-c2nc(COc3ccc([N+](=O)[O-])cc3Cl)no2)cc1 ZINC000023947869 932946851 /nfs/dbraw/zinc/94/68/51/932946851.db2.gz ZTDUXHBGLBWVKV-UHFFFAOYSA-N 0 0 361.741 3.886 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(N2CCOC2=O)c1 ZINC000588436827 932953924 /nfs/dbraw/zinc/95/39/24/932953924.db2.gz UPKZCUDUFNBORH-QBFSEMIESA-N 0 0 367.361 3.593 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000588436780 932959416 /nfs/dbraw/zinc/95/94/16/932959416.db2.gz NTWVETQOUUQMRN-QBFSEMIESA-N 0 0 355.350 3.565 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc2oc(=O)ccc2c1 ZINC000588437210 932964023 /nfs/dbraw/zinc/96/40/23/932964023.db2.gz AEEWIJOQKLWYKJ-BENRWUELSA-N 0 0 350.330 3.743 20 5 FHBDRN Cn1cnc([N+](=O)[O-])c1N1CCC(Sc2ccc(Cl)cc2)CC1 ZINC000610946654 932995091 /nfs/dbraw/zinc/99/50/91/932995091.db2.gz ZHFSVOGZIUXCSK-UHFFFAOYSA-N 0 0 352.847 3.743 20 5 FHBDRN CS[C@@H]1CCC[C@H](NC(=O)c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000175982641 933010947 /nfs/dbraw/zinc/01/09/47/933010947.db2.gz ZKZXEZVNNNVDDW-WDEREUQCSA-N 0 0 373.272 3.761 20 5 FHBDRN C[C@@H](Sc1nccn2ccnc12)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000187600981 933023109 /nfs/dbraw/zinc/02/31/09/933023109.db2.gz WXNFNANAJJTPOT-SNVBAGLBSA-N 0 0 368.378 3.541 20 5 FHBDRN 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/nfs/dbraw/zinc/12/52/61/933125261.db2.gz QITKXODBJRNKKU-GJZGRUSLSA-N 0 0 374.437 3.850 20 5 FHBDRN Cn1ncc([N+](=O)[O-])c1NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 ZINC000891761417 933136892 /nfs/dbraw/zinc/13/68/92/933136892.db2.gz BUDXBLRNGGBIOS-RNFRBKRXSA-N 0 0 360.258 3.650 20 5 FHBDRN O=[N+]([O-])c1ccc(OCc2noc(-c3cccs3)n2)c2cccnc21 ZINC000471854454 933152435 /nfs/dbraw/zinc/15/24/35/933152435.db2.gz ABOOAWUTPCCUIF-UHFFFAOYSA-N 0 0 354.347 3.834 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N1CCO[C@H](c2cccs2)C1 ZINC000588446583 933157809 /nfs/dbraw/zinc/15/78/09/933157809.db2.gz QXPPPEYKXIPURA-KVNDZABWSA-N 0 0 358.419 3.660 20 5 FHBDRN CCc1ccc(-c2cc(C(=O)NCCc3cccc([N+](=O)[O-])c3)no2)cc1 ZINC001266875690 933165256 /nfs/dbraw/zinc/16/52/56/933165256.db2.gz VTNJPYVFELDTDD-UHFFFAOYSA-N 0 0 365.389 3.785 20 5 FHBDRN C[C@@H]1CC[C@@H](c2ccccc2)N(S(=O)(=O)c2ccc([N+](=O)[O-])s2)C1 ZINC000510557408 933223200 /nfs/dbraw/zinc/22/32/00/933223200.db2.gz DPXCRZOADKZFPP-OCCSQVGLSA-N 0 0 366.464 3.818 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N([C@@H](C)c1ccccc1)C1CC1 ZINC000510557642 933224701 /nfs/dbraw/zinc/22/47/01/933224701.db2.gz FVLDAYGUAIHJSJ-AWEZNQCLSA-N 0 0 360.435 3.818 20 5 FHBDRN C[C@H](C1CCCCC1)N(C)S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000510566853 933234922 /nfs/dbraw/zinc/23/49/22/933234922.db2.gz WJSXNOWXFHTIKE-LLVKDONJSA-N 0 0 360.863 3.838 20 5 FHBDRN COc1ccc(NC(=O)CO[C@@H]2CCCc3ccccc32)cc1[N+](=O)[O-] ZINC000430789754 933239525 /nfs/dbraw/zinc/23/95/25/933239525.db2.gz XIPDKQWWDFJBKN-QGZVFWFLSA-N 0 0 356.378 3.636 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)S(=O)(=O)c1ccc2ccccc2c1 ZINC000510573886 933239733 /nfs/dbraw/zinc/23/97/33/933239733.db2.gz ZRKMHARYBUXCEW-UHFFFAOYSA-N 0 0 370.430 3.611 20 5 FHBDRN COc1cc(NC[C@](C)(Cc2ccccc2)[C@@H](C)O)c([N+](=O)[O-])cc1F ZINC000477719884 933240367 /nfs/dbraw/zinc/24/03/67/933240367.db2.gz QKJWRGJDPKMRSS-YJYMSZOUSA-N 0 0 362.401 3.784 20 5 FHBDRN COc1ccc(NC(=O)NCCc2ccccc2[N+](=O)[O-])c2ncccc12 ZINC000548383459 933252788 /nfs/dbraw/zinc/25/27/88/933252788.db2.gz RFWHCALLCPYEHZ-UHFFFAOYSA-N 0 0 366.377 3.516 20 5 FHBDRN COC(=O)c1cnc(N[C@H](c2ccc(F)c(C)c2)C2CC2)c([N+](=O)[O-])c1 ZINC000477729198 933253483 /nfs/dbraw/zinc/25/34/83/933253483.db2.gz FHMGWCSPXOFYNE-INIZCTEOSA-N 0 0 359.357 3.787 20 5 FHBDRN CCc1ccc(C(=O)NCc2c(F)cc(F)c(F)c2F)cc1[N+](=O)[O-] ZINC000430813648 933256672 /nfs/dbraw/zinc/25/66/72/933256672.db2.gz JEVJPMKXWHQKLH-UHFFFAOYSA-N 0 0 356.275 3.644 20 5 FHBDRN Cc1cc(OCC(=O)N[C@@H]2CC[C@@H](c3cccc(F)c3)C2)ccc1[N+](=O)[O-] ZINC000430831970 933281912 /nfs/dbraw/zinc/28/19/12/933281912.db2.gz FBXZZWLRGUFBOW-NVXWUHKLSA-N 0 0 372.396 3.874 20 5 FHBDRN Cc1cc(OCC(=O)N[C@H]2CC[C@@H](c3cccc(F)c3)C2)ccc1[N+](=O)[O-] ZINC000430831972 933282007 /nfs/dbraw/zinc/28/20/07/933282007.db2.gz FBXZZWLRGUFBOW-WBVHZDCISA-N 0 0 372.396 3.874 20 5 FHBDRN C[C@@H](c1cccc([N+](=O)[O-])c1)N1C(=O)CN(Cc2ccc(Cl)cc2)C1=O ZINC000430849532 933315340 /nfs/dbraw/zinc/31/53/40/933315340.db2.gz GVTCFBJUQCJCRZ-LBPRGKRZSA-N 0 0 373.796 3.774 20 5 FHBDRN CCOC(=O)c1csc([C@H]2CCCN2c2ccc(F)cc2[N+](=O)[O-])n1 ZINC000276774818 933329097 /nfs/dbraw/zinc/32/90/97/933329097.db2.gz HOHHLGPENOFEQG-CYBMUJFWSA-N 0 0 365.386 3.709 20 5 FHBDRN CN(Cc1nc(-c2cccs2)no1)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000510632641 933333310 /nfs/dbraw/zinc/33/33/10/933333310.db2.gz HXQJYUOXVBRBHQ-UHFFFAOYSA-N 0 0 364.814 3.992 20 5 FHBDRN Cc1nc2c(s1)[C@@H](NC(=O)N(C)Cc1ccccc1[N+](=O)[O-])CCC2 ZINC000780860318 933341661 /nfs/dbraw/zinc/34/16/61/933341661.db2.gz CMCLMQTZFBLORB-AWEZNQCLSA-N 0 0 360.439 3.579 20 5 FHBDRN CCOc1ccc([C@@H]2CCCN2C(=O)c2cc([N+](=O)[O-])cnc2C)cc1 ZINC000178343015 933433484 /nfs/dbraw/zinc/43/34/84/933433484.db2.gz ASKFHHIZYSXCSW-SFHVURJKSA-N 0 0 355.394 3.674 20 5 FHBDRN Cc1c(C(=O)N[C@H](C)c2ccc(Br)cn2)cccc1[N+](=O)[O-] ZINC000477791898 933442321 /nfs/dbraw/zinc/44/23/21/933442321.db2.gz LLYVYLSZZGGHKC-SNVBAGLBSA-N 0 0 364.199 3.552 20 5 FHBDRN Cc1cccc(C(C)C)c1NC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000060776178 933448539 /nfs/dbraw/zinc/44/85/39/933448539.db2.gz FRQWUPZYPKKAIL-UHFFFAOYSA-N 0 0 365.393 3.860 20 5 FHBDRN Cc1ccc(CNC(=O)Cc2ccc([N+](=O)[O-])cc2Br)s1 ZINC000121588845 933461758 /nfs/dbraw/zinc/46/17/58/933461758.db2.gz RYTROBURNWEBNH-UHFFFAOYSA-N 0 0 369.240 3.586 20 5 FHBDRN C[C@@H](NC(=O)COc1ccc([N+](=O)[O-])c2ncccc12)c1ccc(F)cc1 ZINC000471890690 933506491 /nfs/dbraw/zinc/50/64/91/933506491.db2.gz SEBNGEZGXPEYDS-GFCCVEGCSA-N 0 0 369.352 3.538 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)NCc1c(F)c(F)cc(F)c1F ZINC000610603622 933511050 /nfs/dbraw/zinc/51/10/50/933511050.db2.gz YHOQQIDHUYZJGH-UHFFFAOYSA-N 0 0 374.315 3.560 20 5 FHBDRN COc1cc(CN(CC(F)F)C(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000135403390 933521620 /nfs/dbraw/zinc/52/16/20/933521620.db2.gz GQRWFHJJYWCJIL-UHFFFAOYSA-N 0 0 354.300 3.680 20 5 FHBDRN CCC(=O)c1cccc(NC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)c1 ZINC000178359197 933526395 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20 5 FHBDRN CN(C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)[C@@H]1CCC[C@@H]1c1ccccc1 ZINC000458092083 934291444 /nfs/dbraw/zinc/29/14/44/934291444.db2.gz PPIDLQPVLHYCBQ-CRAIPNDOSA-N 0 0 364.405 3.879 20 5 FHBDRN CC[C@@H](C)n1ncc(N[C@@H](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2)c1C ZINC000477918504 934293809 /nfs/dbraw/zinc/29/38/09/934293809.db2.gz JGGPNGKRIMDIPJ-QWHCGFSZSA-N 0 0 359.430 3.900 20 5 FHBDRN Cc1nc(C)c([C@H](C)N(C)C(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)s1 ZINC000535702019 934296529 /nfs/dbraw/zinc/29/65/29/934296529.db2.gz USLFHZZNCVGCKD-JTQLQIEISA-N 0 0 358.423 3.983 20 5 FHBDRN C[C@@H]1CN(C)c2ccccc2N(C(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)C1 ZINC000535705485 934302056 /nfs/dbraw/zinc/30/20/56/934302056.db2.gz PSEQVQUNJMKCSP-CYBMUJFWSA-N 0 0 364.405 3.809 20 5 FHBDRN CC[C@H](C)n1ncc(NC(=O)c2cc([N+](=O)[O-])ccc2OC)c1C1CC1 ZINC000535710746 934308036 /nfs/dbraw/zinc/30/80/36/934308036.db2.gz AHGNZFRTNFUETR-NSHDSACASA-N 0 0 358.398 3.901 20 5 FHBDRN 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0 0 370.405 3.574 20 5 FHBDRN COC(=O)c1ccc(Cl)c(NC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)c1C ZINC000588475412 934502700 /nfs/dbraw/zinc/50/27/00/934502700.db2.gz OLXMCSJDVYRAIR-YHYXMXQVSA-N 0 0 374.780 3.995 20 5 FHBDRN O=C(Nc1ccc(NC2CCOCC2)cc1)c1ccc([N+](=O)[O-])cc1F ZINC000101681827 934506458 /nfs/dbraw/zinc/50/64/58/934506458.db2.gz CWFLSUXNWUFGAO-UHFFFAOYSA-N 0 0 359.357 3.577 20 5 FHBDRN COC(=O)[C@H](C)[C@@H](NCc1cc([N+](=O)[O-])ccc1Cl)c1ccccc1 ZINC000176225456 934533542 /nfs/dbraw/zinc/53/35/42/934533542.db2.gz MBMNHNKDVJRYEF-SJKOYZFVSA-N 0 0 362.813 3.888 20 5 FHBDRN Nc1c(C(=O)Nc2ccc3oc(C(F)(F)F)nc3c2)cccc1[N+](=O)[O-] ZINC000176203898 934605444 /nfs/dbraw/zinc/60/54/44/934605444.db2.gz WPTWXOLWDUIDDQ-UHFFFAOYSA-N 0 0 366.255 3.589 20 5 FHBDRN Cc1ccc(C(=O)N2CCC[C@H]2CC(=O)c2cccs2)cc1[N+](=O)[O-] ZINC000176211909 934605807 /nfs/dbraw/zinc/60/58/07/934605807.db2.gz RGRWWSBBYDGUKX-AWEZNQCLSA-N 0 0 358.419 3.842 20 5 FHBDRN CCOC(=O)c1cc(C(=O)N(CC2CC2)c2ccccc2)cc([N+](=O)[O-])c1 ZINC000084242184 934607346 /nfs/dbraw/zinc/60/73/46/934607346.db2.gz INOLUEAOZUHSJC-UHFFFAOYSA-N 0 0 368.389 3.828 20 5 FHBDRN O=C(N[C@H]1CCC[C@@H]2C[C@@H]21)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000458299943 934608998 /nfs/dbraw/zinc/60/89/98/934608998.db2.gz OBXGBOTVDZCFPA-PJQXDXOGSA-N 0 0 350.393 3.739 20 5 FHBDRN O=[N+]([O-])c1cc(CN(CC2CCC2)CC(F)(F)F)c2c(c1)COCO2 ZINC000178459957 934612964 /nfs/dbraw/zinc/61/29/64/934612964.db2.gz QQYIVLRCOZNMMS-UHFFFAOYSA-N 0 0 360.332 3.626 20 5 FHBDRN COc1cc(CNc2ccc3c(cnn3C(C)C)c2)c([N+](=O)[O-])cc1O ZINC000610910918 934615064 /nfs/dbraw/zinc/61/50/64/934615064.db2.gz KNFQYTZKRGHAJF-UHFFFAOYSA-N 0 0 356.382 3.852 20 5 FHBDRN Cc1c(CC(=O)N2CCS[C@@H](c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000610970596 934667037 /nfs/dbraw/zinc/66/70/37/934667037.db2.gz HFJRUAONEJILFT-GOSISDBHSA-N 0 0 356.447 3.762 20 5 FHBDRN COc1cc(F)c(NC(=O)c2cccc(Cl)c2[N+](=O)[O-])cc1OC ZINC000176305055 934671112 /nfs/dbraw/zinc/67/11/12/934671112.db2.gz LQUISPPYLFAZNF-UHFFFAOYSA-N 0 0 354.721 3.657 20 5 FHBDRN COc1ccc(C(=O)N(C)CCc2cccc([N+](=O)[O-])c2)cc1C1CC1 ZINC000512979908 934697114 /nfs/dbraw/zinc/69/71/14/934697114.db2.gz RPJXEEJWJLOISR-UHFFFAOYSA-N 0 0 354.406 3.796 20 5 FHBDRN Cc1ccc([C@@H]2CCN(C(=O)NCCc3ccccc3[N+](=O)[O-])C2)c(C)c1 ZINC000471989918 934705290 /nfs/dbraw/zinc/70/52/90/934705290.db2.gz VWGACZAPOKPPOA-GOSISDBHSA-N 0 0 367.449 3.953 20 5 FHBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)N1CC[C@@H](c2c(F)cccc2F)C1 ZINC000588484327 934709815 /nfs/dbraw/zinc/70/98/15/934709815.db2.gz JXRJVNHMWPRFBT-DEBLGDTFSA-N 0 0 358.344 3.902 20 5 FHBDRN CCC[C@@H](NC(=O)c1cc(OC)c(OC)c([N+](=O)[O-])c1)C1CCCC1 ZINC000458342909 934717390 /nfs/dbraw/zinc/71/73/90/934717390.db2.gz PELJARXFPNDPPT-CQSZACIVSA-N 0 0 350.415 3.701 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@@H](O)[C@H](C2CCCC2)C1 ZINC000458342103 934725920 /nfs/dbraw/zinc/72/59/20/934725920.db2.gz WVYLAYJEMIBHJL-FFZOFVMBSA-N 0 0 374.481 3.563 20 5 FHBDRN C[C@H]1CC(C)(C)CC[C@@H]1NC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000176282344 934735137 /nfs/dbraw/zinc/73/51/37/934735137.db2.gz UEAWGMGAYIWNHQ-GWCFXTLKSA-N 0 0 367.833 3.518 20 5 FHBDRN CN1CC[C@H](C(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)c2ccccc21 ZINC000611011323 934752846 /nfs/dbraw/zinc/75/28/46/934752846.db2.gz URQCLKLKQGPQCC-KRWDZBQOSA-N 0 0 353.422 3.570 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N1C[C@@H](C(F)(F)F)CC[C@H]1C ZINC000611555547 934802183 /nfs/dbraw/zinc/80/21/83/934802183.db2.gz IQVDAIPLOCFROX-ZJUUUORDSA-N 0 0 361.320 3.798 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCCC[C@H]1Cc1ccccc1 ZINC000109999878 934804506 /nfs/dbraw/zinc/80/45/06/934804506.db2.gz QMLAOIQTINATQO-KRWDZBQOSA-N 0 0 374.462 3.689 20 5 FHBDRN Cc1cc2c(cc1C)[C@@H](C(=O)NCc1ccc([N+](=O)[O-])cc1Cl)CO2 ZINC000472005661 934815426 /nfs/dbraw/zinc/81/54/26/934815426.db2.gz MXDSCAUCDIPEFH-HNNXBMFYSA-N 0 0 360.797 3.657 20 5 FHBDRN Cc1cc2c(cc1C)[C@H](C(=O)NCc1ccc([N+](=O)[O-])cc1Cl)CO2 ZINC000472005662 934815536 /nfs/dbraw/zinc/81/55/36/934815536.db2.gz MXDSCAUCDIPEFH-OAHLLOKOSA-N 0 0 360.797 3.657 20 5 FHBDRN CSc1cccc(NC(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)c1C ZINC000538246194 934817554 /nfs/dbraw/zinc/81/75/54/934817554.db2.gz KBSDNQMPPNDKEO-UHFFFAOYSA-N 0 0 360.391 3.649 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCCc1ccc(CO)cc1 ZINC000611559564 934822560 /nfs/dbraw/zinc/82/25/60/934822560.db2.gz CFQMLMDTEQKGCU-UHFFFAOYSA-N 0 0 374.462 3.562 20 5 FHBDRN COc1cccc2c1CC[C@@H]2NC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000119466779 934826326 /nfs/dbraw/zinc/82/63/26/934826326.db2.gz NMWJMSHZVQLULA-SJCJKPOMSA-N 0 0 355.394 3.651 20 5 FHBDRN CC[C@H](C)NC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000014049051 934834577 /nfs/dbraw/zinc/83/45/77/934834577.db2.gz VKUMTZSZOCULTK-NSHDSACASA-N 0 0 373.375 3.745 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)NCc2ccc3ccccc3n2)c1 ZINC000538401515 934837525 /nfs/dbraw/zinc/83/75/25/934837525.db2.gz HTVMZHNNJUAVQC-UHFFFAOYSA-N 0 0 365.389 3.537 20 5 FHBDRN CCNc1ccc(C(=O)N[C@@H]2C[C@@H]2c2cccc(OCC)c2)cc1[N+](=O)[O-] ZINC000538411041 934839425 /nfs/dbraw/zinc/83/94/25/934839425.db2.gz OMCALLBVCJGIBJ-SJLPKXTDSA-N 0 0 369.421 3.711 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)c1coc(-c2ccccc2Cl)n1 ZINC000538445810 934850143 /nfs/dbraw/zinc/85/01/43/934850143.db2.gz RJMGEYGRVJSAPP-UHFFFAOYSA-N 0 0 371.780 3.876 20 5 FHBDRN Cc1cc(Cl)c(S(=O)(=O)N(C)[C@H](C)c2ccccc2)cc1[N+](=O)[O-] ZINC000176642174 934863408 /nfs/dbraw/zinc/86/34/08/934863408.db2.gz VLRMFYGHSFJHDC-GFCCVEGCSA-N 0 0 368.842 3.938 20 5 FHBDRN C[C@@H](c1ccc(F)cc1)N(C)S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000119521985 934864709 /nfs/dbraw/zinc/86/47/09/934864709.db2.gz BMURJIDPGUZWHH-JTQLQIEISA-N 0 0 372.805 3.769 20 5 FHBDRN O=C(O[C@@H]1CCc2cccnc21)c1sc(Br)cc1[N+](=O)[O-] ZINC000785105890 934866754 /nfs/dbraw/zinc/86/67/54/934866754.db2.gz BAXYRRDBFOATME-SECBINFHSA-N 0 0 369.196 3.658 20 5 FHBDRN O=C(O[C@H]1CCc2cccnc21)c1sc(Br)cc1[N+](=O)[O-] ZINC000785105892 934866771 /nfs/dbraw/zinc/86/67/71/934866771.db2.gz BAXYRRDBFOATME-VIFPVBQESA-N 0 0 369.196 3.658 20 5 FHBDRN Cc1cc(=O)n(Cc2ccc(Br)cc2Cl)cc1[N+](=O)[O-] ZINC000128603617 934885547 /nfs/dbraw/zinc/88/55/47/934885547.db2.gz GMWKZIKQCPMHKH-UHFFFAOYSA-N 0 0 357.591 3.529 20 5 FHBDRN C[C@@H]1CCN(C(=O)CN(C)c2ccccc2[N+](=O)[O-])[C@@H]1c1cccc(F)c1 ZINC000472046588 934891206 /nfs/dbraw/zinc/89/12/06/934891206.db2.gz AQTPCLAFXKHGPM-VLIAUNLRSA-N 0 0 371.412 3.780 20 5 FHBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N1CCC[C@@H]1C1CCCC1 ZINC000119578761 934895642 /nfs/dbraw/zinc/89/56/42/934895642.db2.gz DIMBAMQNEFPJRJ-CYBMUJFWSA-N 0 0 358.847 3.592 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N(CC)Cc1c(F)cccc1F ZINC000538831767 934919915 /nfs/dbraw/zinc/91/99/15/934919915.db2.gz VINKYJMGIKNGSU-UHFFFAOYSA-N 0 0 364.348 3.934 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1CCSc2ccccc21 ZINC000538857458 934927155 /nfs/dbraw/zinc/92/71/55/934927155.db2.gz YFHFHANDFPJZES-ZDUSSCGKSA-N 0 0 358.419 3.960 20 5 FHBDRN CO[C@@H](c1ccc(F)cc1)[C@@H](C)NC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000538901446 934940636 /nfs/dbraw/zinc/94/06/36/934940636.db2.gz MYZZTIFCJDBWQT-QLJPJBMISA-N 0 0 366.776 3.893 20 5 FHBDRN C[C@@H](C1CC1)n1nccc1NC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000156789177 934945073 /nfs/dbraw/zinc/94/50/73/934945073.db2.gz VQGZXOMFJASGTC-ZDUSSCGKSA-N 0 0 369.425 3.959 20 5 FHBDRN O=[N+]([O-])c1cc(F)cc(Oc2ccc3nnc(-c4ccccc4F)n3n2)c1 ZINC000538936529 934962732 /nfs/dbraw/zinc/96/27/32/934962732.db2.gz HOPUGYHYILDHOL-UHFFFAOYSA-N 0 0 369.287 3.770 20 5 FHBDRN CC[C@@H](NC(=O)c1ccncc1Br)c1cccc([N+](=O)[O-])c1 ZINC000119647233 934968460 /nfs/dbraw/zinc/96/84/60/934968460.db2.gz UVGHAPWHLKSTQG-CQSZACIVSA-N 0 0 364.199 3.633 20 5 FHBDRN C[C@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)c1nn(C)cc1[N+](=O)[O-] ZINC000539026744 934995424 /nfs/dbraw/zinc/99/54/24/934995424.db2.gz XXRMHFIUBREVJR-CQSZACIVSA-N 0 0 364.405 3.829 20 5 FHBDRN C[C@H](NC(=O)N1CCCC[C@@H]([C@@H]2CCOC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000892109451 935013992 /nfs/dbraw/zinc/01/39/92/935013992.db2.gz ANHKDKSYEIKGAJ-USXIJHARSA-N 0 0 361.442 3.504 20 5 FHBDRN O=C(N=c1[nH]c2ccccc2n1-c1ccccc1)c1ccc([N+](=O)[O-])s1 ZINC000071933982 935017768 /nfs/dbraw/zinc/01/77/68/935017768.db2.gz QEHJWPAVZAFHMV-UHFFFAOYSA-N 0 0 364.386 3.669 20 5 FHBDRN Cc1cncn1C1CCN(C(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)CC1 ZINC000375654772 935029638 /nfs/dbraw/zinc/02/96/38/935029638.db2.gz AVROONSRYVOPEK-UHFFFAOYSA-N 0 0 356.426 3.700 20 5 FHBDRN CCCC[C@@H]1CCC[C@H]1NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000110722925 945071166 /nfs/dbraw/zinc/07/11/66/945071166.db2.gz MYURSQNZYDZUTA-RDTXWAMCSA-N 0 0 356.426 3.869 20 5 FHBDRN CCN(C(=O)COc1ccc([N+](=O)[O-])c(OC)c1)c1cccc(C)c1C ZINC000519061862 945071707 /nfs/dbraw/zinc/07/17/07/945071707.db2.gz SEYDPRNDPBGYEP-UHFFFAOYSA-N 0 0 358.394 3.652 20 5 FHBDRN CCCN(C[C@H]1CCCCO1)C(=O)Nc1cc([N+](=O)[O-])ccc1OCC ZINC000439911136 945074184 /nfs/dbraw/zinc/07/41/84/945074184.db2.gz IPCFHXPJRLCGDE-OAHLLOKOSA-N 0 0 365.430 3.807 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H](C)Cc1cccc(OC)c1 ZINC000439910501 945074569 /nfs/dbraw/zinc/07/45/69/945074569.db2.gz QSDDCNKGSKUFKJ-CYBMUJFWSA-N 0 0 373.409 3.755 20 5 FHBDRN CSC[C@H]1CCCN1C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000157468947 935075491 /nfs/dbraw/zinc/07/54/91/935075491.db2.gz OKWGZWVTKMDFBM-CYBMUJFWSA-N 0 0 363.464 3.686 20 5 FHBDRN CCOC(=O)[C@@H](Cc1ccccc1)N(C)Cc1ccc([N+](=O)[O-])cc1C ZINC000548640855 935094587 /nfs/dbraw/zinc/09/45/87/935094587.db2.gz JXIYGYUEQMBHEW-LJQANCHMSA-N 0 0 356.422 3.509 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N(CCOC)Cc1ccccc1 ZINC000439895111 945076544 /nfs/dbraw/zinc/07/65/44/945076544.db2.gz FBVQTSNYMIRQDY-UHFFFAOYSA-N 0 0 373.409 3.674 20 5 FHBDRN COc1ccc(C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)c(OCC2CC2)c1 ZINC000472129052 935107603 /nfs/dbraw/zinc/10/76/03/935107603.db2.gz XMOQYSBNBCNMNO-CYBMUJFWSA-N 0 0 370.405 3.883 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H]1CCCc2c(O)cccc21 ZINC000439900361 945081286 /nfs/dbraw/zinc/08/12/86/945081286.db2.gz LIHAXKGSEVUWFI-OAHLLOKOSA-N 0 0 371.393 3.898 20 5 FHBDRN CCCNc1nnc(SCCCOc2ccc([N+](=O)[O-])cc2)s1 ZINC000071971190 935138346 /nfs/dbraw/zinc/13/83/46/935138346.db2.gz XCDBSOZRUHTAOQ-UHFFFAOYSA-N 0 0 354.457 3.829 20 5 FHBDRN CO[C@@H](CNC(=O)c1cc([N+](=O)[O-])c(C)s1)c1ccccc1Cl ZINC000121759447 935139931 /nfs/dbraw/zinc/13/99/31/935139931.db2.gz SJZXESDSLIUAGR-ZDUSSCGKSA-N 0 0 354.815 3.736 20 5 FHBDRN Cc1cc(NC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)c(Cl)cc1F ZINC000582027116 935148343 /nfs/dbraw/zinc/14/83/43/935148343.db2.gz JLXSXLHCSHNLGU-UHFFFAOYSA-N 0 0 352.705 3.677 20 5 FHBDRN Cc1c(NC(=O)NC[C@]2(C)OCCc3sccc32)cccc1[N+](=O)[O-] ZINC000582032035 935152283 /nfs/dbraw/zinc/15/22/83/935152283.db2.gz NWBSDDTTYXUKRF-KRWDZBQOSA-N 0 0 361.423 3.574 20 5 FHBDRN Cc1ccc(NCCCNC(=O)C2CCC(F)(F)CC2)c([N+](=O)[O-])c1 ZINC000135492241 935162643 /nfs/dbraw/zinc/16/26/43/935162643.db2.gz DTDCDLJGORCFKT-UHFFFAOYSA-N 0 0 355.385 3.647 20 5 FHBDRN O=C(C[C@H]1OCCc2ccccc21)Nc1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000084776631 935169950 /nfs/dbraw/zinc/16/99/50/935169950.db2.gz GZXIYBBBALYQRH-GOSISDBHSA-N 0 0 363.373 3.786 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N1CC[C@H](CC(F)(F)F)C1 ZINC000277438549 935174768 /nfs/dbraw/zinc/17/47/68/935174768.db2.gz NCAVLNULVKBDII-SECBINFHSA-N 0 0 350.724 3.971 20 5 FHBDRN Cc1cc(NC(=O)c2cc(C)cc([N+](=O)[O-])c2)n(-c2ccccc2F)n1 ZINC000519075096 945084204 /nfs/dbraw/zinc/08/42/04/945084204.db2.gz MPINBVVKMZAIOQ-UHFFFAOYSA-N 0 0 354.341 3.789 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCCCC[C@@H]1/C=C/c1ccccc1 ZINC000084839025 935217311 /nfs/dbraw/zinc/21/73/11/935217311.db2.gz OJPYDVLEQLVMDH-IENJSVCTSA-N 0 0 368.437 3.584 20 5 FHBDRN CCCN(C(=O)COc1ccc([N+](=O)[O-])cc1)[C@H]1CCc2ccccc2C1 ZINC000072024148 935217977 /nfs/dbraw/zinc/21/79/77/935217977.db2.gz KCWLTHIOSODHIY-IBGZPJMESA-N 0 0 368.433 3.770 20 5 FHBDRN CCOc1cc2c(cc1CNC(=O)c1ccc([N+](=O)[O-])cc1C)O[C@@H](C)C2 ZINC000511067085 935220194 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FHBDRN CN(CCc1ccccc1[N+](=O)[O-])Cc1cn(-c2ccc(Cl)cc2)nn1 ZINC000511111756 935633229 /nfs/dbraw/zinc/63/32/29/935633229.db2.gz ZJLRXBQVGLXXJF-UHFFFAOYSA-N 0 0 371.828 3.503 20 5 FHBDRN C[C@@H]1CN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[S@](=O)C1 ZINC000277578170 935633634 /nfs/dbraw/zinc/63/36/34/935633634.db2.gz TVRZYRSUDFKFLR-OZAJXLCCSA-N 0 0 364.492 3.524 20 5 FHBDRN C[C@H]1CN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[S@](=O)C1 ZINC000277578180 935633702 /nfs/dbraw/zinc/63/37/02/935633702.db2.gz TVRZYRSUDFKFLR-RZFZLAGVSA-N 0 0 364.492 3.524 20 5 FHBDRN Cc1cc(C(=O)N[C@H](CO)c2c(Cl)cccc2Cl)cc([N+](=O)[O-])c1 ZINC000478477765 935634574 /nfs/dbraw/zinc/63/45/74/935634574.db2.gz CYUYMPUORPZPFY-CQSZACIVSA-N 0 0 369.204 3.673 20 5 FHBDRN Cc1c([C@H](C)NCc2cccc([N+](=O)[O-])c2C)nnn1-c1ccc(C)cc1 ZINC000478510861 935639042 /nfs/dbraw/zinc/63/90/42/935639042.db2.gz ZSVVSDSQBYBWEK-HNNXBMFYSA-N 0 0 365.437 3.952 20 5 FHBDRN COc1cc(C(=O)NCC2C(C)(C)C2(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000478499670 935643771 /nfs/dbraw/zinc/64/37/71/935643771.db2.gz GWTZCEAVYHIYEU-UHFFFAOYSA-N 0 0 372.368 3.617 20 5 FHBDRN Cc1ccc2c(c1)N(C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)C[C@H](C)O2 ZINC000582401135 935653545 /nfs/dbraw/zinc/65/35/45/935653545.db2.gz IKEADCLQFJQNSC-AWEZNQCLSA-N 0 0 368.389 3.680 20 5 FHBDRN C[C@H](NC(=O)NC(C)(C)COCc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000507300256 945115732 /nfs/dbraw/zinc/11/57/32/945115732.db2.gz BLQJDPJTZRLQLC-HNNXBMFYSA-N 0 0 371.437 3.950 20 5 FHBDRN Cc1c(CNC(=O)NCc2nc(C(C)(C)C)cs2)cccc1[N+](=O)[O-] ZINC000478620216 935671491 /nfs/dbraw/zinc/67/14/91/935671491.db2.gz IVLGYKXVPGIPPE-UHFFFAOYSA-N 0 0 362.455 3.657 20 5 FHBDRN CC(C)c1ncc(NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)cn1 ZINC000478651851 935675751 /nfs/dbraw/zinc/67/57/51/935675751.db2.gz LDRYGEWYKUDQRL-UHFFFAOYSA-N 0 0 369.406 3.884 20 5 FHBDRN Cn1cnc([N+](=O)[O-])c1CN(Cc1ccc(F)cc1Cl)CC1CC1 ZINC000511119616 935676381 /nfs/dbraw/zinc/67/63/81/935676381.db2.gz GDKRHFIYWBFOCO-UHFFFAOYSA-N 0 0 352.797 3.533 20 5 FHBDRN O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1CCO[C@@]2(CCc3ccccc32)C1 ZINC000158289230 935678958 /nfs/dbraw/zinc/67/89/58/935678958.db2.gz DCIYFBDSMOKHDG-IBGZPJMESA-N 0 0 372.808 3.562 20 5 FHBDRN O=C(Nc1ccc(O[C@@H]2CCOC2)cc1)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000158306737 935697148 /nfs/dbraw/zinc/69/71/48/935697148.db2.gz UKUCKHUSGAVJFR-CQSZACIVSA-N 0 0 362.769 3.668 20 5 FHBDRN N#CN(CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21)c1cccc(Cl)c1 ZINC000478759442 935709817 /nfs/dbraw/zinc/70/98/17/935709817.db2.gz XWHGBSCMOBBLJO-UHFFFAOYSA-N 0 0 372.768 3.534 20 5 FHBDRN CC[C@H](CN(CC)S(=O)(=O)c1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000478766406 935714980 /nfs/dbraw/zinc/71/49/80/935714980.db2.gz CTOMUQNIZUOPKA-OAHLLOKOSA-N 0 0 362.451 3.799 20 5 FHBDRN C[C@H](SCc1ccc2c(c1)OCO2)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000478770069 935718472 /nfs/dbraw/zinc/71/84/72/935718472.db2.gz RZNWYQREZFTPJC-NSHDSACASA-N 0 0 360.391 3.584 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1)N[C@H]1CC[C@H](Nc2ccccn2)CC1 ZINC000582446151 935719094 /nfs/dbraw/zinc/71/90/94/935719094.db2.gz BNJSRTOTZVZQIP-HDJSIYSDSA-N 0 0 355.398 3.535 20 5 FHBDRN COCCN(C[C@H]1CC=CCC1)C(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000478800656 935725112 /nfs/dbraw/zinc/72/51/12/935725112.db2.gz VGHYETHZFYJIMZ-HOTGVXAUSA-N 0 0 361.442 3.670 20 5 FHBDRN Cc1c(F)cccc1NC(=O)CCn1cc(-c2cccc([N+](=O)[O-])c2)cn1 ZINC000478820059 935734391 /nfs/dbraw/zinc/73/43/91/935734391.db2.gz DFIGVQCGOUXNGF-UHFFFAOYSA-N 0 0 368.368 3.935 20 5 FHBDRN COc1cc(C(=O)NCc2ccc(-c3ccccc3)o2)ccc1[N+](=O)[O-] ZINC000511788868 945120368 /nfs/dbraw/zinc/12/03/68/945120368.db2.gz SKRXVWZFBVSXQW-UHFFFAOYSA-N 0 0 352.346 3.793 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccccc1N1CCCCC1 ZINC000427129220 945120456 /nfs/dbraw/zinc/12/04/56/945120456.db2.gz VCXGTLKTLMUNHD-UHFFFAOYSA-N 0 0 355.394 3.846 20 5 FHBDRN Cc1c(Cc2noc(-c3ccnc(OC(C)C)c3)n2)cccc1[N+](=O)[O-] ZINC000545073185 935745181 /nfs/dbraw/zinc/74/51/81/935745181.db2.gz QBXBBLUUQUUVJG-UHFFFAOYSA-N 0 0 354.366 3.726 20 5 FHBDRN CCO[C@@H]1C[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2F)C12CCCCC2 ZINC000478861478 935745822 /nfs/dbraw/zinc/74/58/22/935745822.db2.gz VMIALQNEGDTHMN-JKSUJKDBSA-N 0 0 350.390 3.592 20 5 FHBDRN Cc1c(CNC(=O)N[C@@H](c2ccccc2)[C@H]2CCCO2)cccc1[N+](=O)[O-] ZINC000478866999 935746752 /nfs/dbraw/zinc/74/67/52/935746752.db2.gz HYAQBYSFDKBZBZ-MOPGFXCFSA-N 0 0 369.421 3.623 20 5 FHBDRN COc1ccccc1C[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000478897682 935753101 /nfs/dbraw/zinc/75/31/01/935753101.db2.gz OWUTUGGZWFTIDZ-QGZVFWFLSA-N 0 0 354.406 3.759 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)Nc1ccc(-c2ccccc2)nn1 ZINC000127728067 935759742 /nfs/dbraw/zinc/75/97/42/935759742.db2.gz WUGLBDVHXUFRLY-UHFFFAOYSA-N 0 0 373.372 3.714 20 5 FHBDRN Cc1nccc(-c2cccc(NC(=O)Cc3cccc([N+](=O)[O-])c3C)c2)n1 ZINC000178583579 935761057 /nfs/dbraw/zinc/76/10/57/935761057.db2.gz PDHVICKYRQQTQT-UHFFFAOYSA-N 0 0 362.389 3.850 20 5 FHBDRN NC(=O)c1cccc(N2CCc3c(Cl)cc(Cl)cc3C2)c1[N+](=O)[O-] ZINC000582478428 935763659 /nfs/dbraw/zinc/76/36/59/935763659.db2.gz PNBUAUVUONAUTR-UHFFFAOYSA-N 0 0 366.204 3.563 20 5 FHBDRN COc1cc(C(=O)NCCc2c[nH]c3ccc(F)cc23)cc([N+](=O)[O-])c1C ZINC000479082373 935783910 /nfs/dbraw/zinc/78/39/10/935783910.db2.gz CFCSZJMBSINMEB-UHFFFAOYSA-N 0 0 371.368 3.505 20 5 FHBDRN Cc1c(C(=O)N(C)c2cccc([N+](=O)[O-])c2)cnn1-c1ccccc1F ZINC000158434492 935795858 /nfs/dbraw/zinc/79/58/58/935795858.db2.gz WWFRZBKIZQGTNC-UHFFFAOYSA-N 0 0 354.341 3.505 20 5 FHBDRN COc1ccc(CNC(=O)c2nc3ccccc3cc2Cl)cc1[N+](=O)[O-] ZINC000562076176 935809010 /nfs/dbraw/zinc/80/90/10/935809010.db2.gz CIKIUVCXQWYYQP-UHFFFAOYSA-N 0 0 371.780 3.735 20 5 FHBDRN COc1ccccc1NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000050256161 935821463 /nfs/dbraw/zinc/82/14/63/935821463.db2.gz XFMVICQXAHWYIP-UHFFFAOYSA-N 0 0 355.375 3.979 20 5 FHBDRN CCO[C@@H]1C[C@@H](N(C)C(=O)c2cc(SC)ccc2[N+](=O)[O-])C1(C)C ZINC000127852983 935824453 /nfs/dbraw/zinc/82/44/53/935824453.db2.gz DEGGXIHJXCKBDI-HUUCEWRRSA-N 0 0 352.456 3.592 20 5 FHBDRN Cc1c(C(=O)Nc2ccn(-c3ccccc3Cl)n2)cccc1[N+](=O)[O-] ZINC000158502292 935824569 /nfs/dbraw/zinc/82/45/69/935824569.db2.gz UGLXEWKUODEWDA-UHFFFAOYSA-N 0 0 356.769 3.995 20 5 FHBDRN CCO[C@H]1C[C@@H](N(C)C(=O)c2cc(SC)ccc2[N+](=O)[O-])C1(C)C ZINC000127853192 935824625 /nfs/dbraw/zinc/82/46/25/935824625.db2.gz DEGGXIHJXCKBDI-CABCVRRESA-N 0 0 352.456 3.592 20 5 FHBDRN COc1ccc(Cl)cc1NC(=O)[C@@H](C)Sc1ncccc1[N+](=O)[O-] ZINC000127861109 935826999 /nfs/dbraw/zinc/82/69/99/935826999.db2.gz RDFYXTIZXOHTDG-SECBINFHSA-N 0 0 367.814 3.771 20 5 FHBDRN C[C@@H](O)C[C@H]1CCCN1C(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000155859953 935829386 /nfs/dbraw/zinc/82/93/86/935829386.db2.gz ZJXVMOKYDCLAAW-RHSMWYFYSA-N 0 0 369.421 3.714 20 5 FHBDRN CCCN(C(=O)c1ccc([N+](=O)[O-])c(OC)c1)[C@@H]1CCCc2cccnc21 ZINC000479361455 935830881 /nfs/dbraw/zinc/83/08/81/935830881.db2.gz HHHSINONZVQPQV-QGZVFWFLSA-N 0 0 369.421 3.928 20 5 FHBDRN O=C(NCCCc1c[nH]c2ccc(F)cc12)NCc1ccc([N+](=O)[O-])cc1 ZINC000507314409 945127017 /nfs/dbraw/zinc/12/70/17/945127017.db2.gz GWIZDTVKONJSDN-UHFFFAOYSA-N 0 0 370.384 3.647 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)N2CC[C@@H]2Cc2ccccc2)cc1SC ZINC000479381667 935835746 /nfs/dbraw/zinc/83/57/46/935835746.db2.gz KXDIQERLHZSQSF-CQSZACIVSA-N 0 0 372.446 3.783 20 5 FHBDRN Cc1ccc(CN(C)S(=O)(=O)c2cc([N+](=O)[O-])c(C)cc2Cl)s1 ZINC000176692439 935854426 /nfs/dbraw/zinc/85/44/26/935854426.db2.gz FJGXVWQSQNYNIR-UHFFFAOYSA-N 0 0 374.871 3.747 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)NC[C@@H](c1ccccc1)C(F)(F)F ZINC000187761967 935855342 /nfs/dbraw/zinc/85/53/42/935855342.db2.gz YCGQGOHGHBANIF-HNNXBMFYSA-N 0 0 352.312 3.600 20 5 FHBDRN CCCn1ccnc1CCCN(C)C(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000277722354 935856233 /nfs/dbraw/zinc/85/62/33/935856233.db2.gz ZIWDXOHUPBLVFU-UHFFFAOYSA-N 0 0 364.833 3.560 20 5 FHBDRN Cc1ccc(CN(C)C(=O)c2ccc([N+](=O)[O-])cc2Br)o1 ZINC000158598185 935858179 /nfs/dbraw/zinc/85/81/79/935858179.db2.gz KYOZZNZQGYOIDE-UHFFFAOYSA-N 0 0 353.172 3.531 20 5 FHBDRN Cc1sc(C(=O)N[C@@H]2c3ccccc3CC23CCOCC3)cc1[N+](=O)[O-] ZINC000516692393 945129842 /nfs/dbraw/zinc/12/98/42/945129842.db2.gz OMYPKWHHRIPQDG-QGZVFWFLSA-N 0 0 372.446 3.789 20 5 FHBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)N1CCC[C@@H](c2ccccc2)C1 ZINC000431462254 935871821 /nfs/dbraw/zinc/87/18/21/935871821.db2.gz ZPBMIDVFGGLBEP-GOSISDBHSA-N 0 0 353.422 3.727 20 5 FHBDRN COc1cc(C(=O)N2CCC[C@H]2Cc2ccc(F)cc2)cc([N+](=O)[O-])c1C ZINC000479662606 935872454 /nfs/dbraw/zinc/87/24/54/935872454.db2.gz OTIAAKKKGIIUCL-KRWDZBQOSA-N 0 0 372.396 3.898 20 5 FHBDRN Cc1ncc([N+](=O)[O-])n1CCN1CCc2sccc2[C@H]1c1cccs1 ZINC000611658566 935880063 /nfs/dbraw/zinc/88/00/63/935880063.db2.gz LSJXBYMSJOBEFY-KRWDZBQOSA-N 0 0 374.491 3.870 20 5 FHBDRN O=C(CSc1ccccc1[N+](=O)[O-])N1CCc2cc(F)c(F)cc21 ZINC000479741495 935885863 /nfs/dbraw/zinc/88/58/63/935885863.db2.gz HDRWVTUFNOWBJW-UHFFFAOYSA-N 0 0 350.346 3.554 20 5 FHBDRN CC[C@H](C)COc1cc([N+](=O)[O-])c(CN2CCCOC[C@H]2C)cc1OC ZINC000611668205 935890583 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936150612 /nfs/dbraw/zinc/15/06/12/936150612.db2.gz JFYPRVRAZQNDBT-UHFFFAOYSA-N 0 0 364.295 3.894 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cn1)N1CC[C@@H](C(F)(F)F)c2ccccc21 ZINC000548773537 936153902 /nfs/dbraw/zinc/15/39/02/936153902.db2.gz MQXJILDKCYYRCI-GFCCVEGCSA-N 0 0 351.284 3.686 20 5 FHBDRN CCOc1ccc([C@@H]2C[C@H]2NC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000437220909 945147075 /nfs/dbraw/zinc/14/70/75/945147075.db2.gz RSQVMCUAWBBAQO-FUHWJXTLSA-N 0 0 374.824 3.862 20 5 FHBDRN Cc1ccc([C@@H](C)N[C@@H](C(=O)NC2CC2)c2ccccc2)cc1[N+](=O)[O-] ZINC000178680536 936172695 /nfs/dbraw/zinc/17/26/95/936172695.db2.gz VAKGDHRDRKBIMI-AUUYWEPGSA-N 0 0 353.422 3.574 20 5 FHBDRN O=C(Nc1ccccc1)NC1CCN(c2cccc(F)c2[N+](=O)[O-])CC1 ZINC000091458482 936174670 /nfs/dbraw/zinc/17/46/70/936174670.db2.gz SGQBSOIGUSHDKL-UHFFFAOYSA-N 0 0 358.373 3.524 20 5 FHBDRN COc1cccc(CC2CCN(C(=O)Cc3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000612217939 936198593 /nfs/dbraw/zinc/19/85/93/936198593.db2.gz MZJNPEIMTYAEHZ-UHFFFAOYSA-N 0 0 368.433 3.627 20 5 FHBDRN Cc1ccccc1C1CCN(S(=O)(=O)Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000178686064 936202555 /nfs/dbraw/zinc/20/25/55/936202555.db2.gz IOIVGFPDZLUZPP-UHFFFAOYSA-N 0 0 374.462 3.613 20 5 FHBDRN CCOc1cc(C(=O)Nc2c(F)cccc2F)c([N+](=O)[O-])cc1OC ZINC000061196664 936202840 /nfs/dbraw/zinc/20/28/40/936202840.db2.gz RQROAQITQQBQTB-UHFFFAOYSA-N 0 0 352.293 3.533 20 5 FHBDRN COc1ccc2c(c1)CC[C@@H](NC(=O)Nc1ccc(C)c([N+](=O)[O-])c1)C2 ZINC000612291177 936212783 /nfs/dbraw/zinc/21/27/83/936212783.db2.gz YMIDVEZAHRZETP-OAHLLOKOSA-N 0 0 355.394 3.591 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)Nc2cccc([S@@](C)=O)c2)cc1[N+](=O)[O-] ZINC000078584892 936212793 /nfs/dbraw/zinc/21/27/93/936212793.db2.gz NWSCCXKXWCCQGG-YDBLSZJJSA-N 0 0 361.423 3.523 20 5 FHBDRN O=[N+]([O-])c1sc(NCCC(F)(F)F)nc1NCCC(F)(F)F ZINC000078591843 936215759 /nfs/dbraw/zinc/21/57/59/936215759.db2.gz RUBDIPDMZOMNGY-UHFFFAOYSA-N 0 0 352.260 3.780 20 5 FHBDRN Cc1cnc(Sc2nnc(C3CC3)n2-c2ccccc2)c([N+](=O)[O-])c1 ZINC000078628549 936222315 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20 5 FHBDRN Cc1ccc(Oc2ccc([N+](=O)[O-])cc2)c(I)n1 ZINC000091505217 936295159 /nfs/dbraw/zinc/29/51/59/936295159.db2.gz VFZGEKZHGUZLGB-UHFFFAOYSA-N 0 0 356.119 3.695 20 5 FHBDRN CC1(C)CCC[C@@H]1N(Cc1ccccc1)C(=O)CCn1cc([N+](=O)[O-])cn1 ZINC000427174541 945158772 /nfs/dbraw/zinc/15/87/72/945158772.db2.gz LEROIBIQSBSUFB-SFHVURJKSA-N 0 0 370.453 3.789 20 5 FHBDRN CCc1nn(C)c(N[C@H](c2cccc(C)c2)c2ccccn2)c1[N+](=O)[O-] ZINC000091680095 938254052 /nfs/dbraw/zinc/25/40/52/938254052.db2.gz BRQZHZJLVINDDR-QGZVFWFLSA-N 0 0 351.410 3.796 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1)CN(Cc1csc(-c3ccco3)n1)CCO2 ZINC000583448269 938258511 /nfs/dbraw/zinc/25/85/11/938258511.db2.gz RSHQHXGEAUEKPB-UHFFFAOYSA-N 0 0 357.391 3.706 20 5 FHBDRN Cn1c(C(=O)N[C@@H](c2cccc(Cl)c2)c2ccccn2)ccc1[N+](=O)[O-] ZINC000472287005 938258709 /nfs/dbraw/zinc/25/87/09/938258709.db2.gz LHXUJKRCBAWJKW-KRWDZBQOSA-N 0 0 370.796 3.501 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)Nc1ccc(Oc2cccnc2)cc1 ZINC000583463538 938262076 /nfs/dbraw/zinc/26/20/76/938262076.db2.gz FSJHNYHJZYSDEJ-UHFFFAOYSA-N 0 0 365.345 3.800 20 5 FHBDRN COc1ccc2c(c1)CCC[C@@H]2CNC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000583474792 938269401 /nfs/dbraw/zinc/26/94/01/938269401.db2.gz XYQFZPLVETZOBJ-WMLDXEAASA-N 0 0 368.433 3.943 20 5 FHBDRN Cc1cc(NC(=O)c2cccc(-n3cccn3)c2)c2cc([N+](=O)[O-])ccc2n1 ZINC000161739655 938271730 /nfs/dbraw/zinc/27/17/30/938271730.db2.gz JKKBEXFBXBICRS-UHFFFAOYSA-N 0 0 373.372 3.889 20 5 FHBDRN Cc1sc(C(=O)N=c2ccccn2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000255569161 938284379 /nfs/dbraw/zinc/28/43/79/938284379.db2.gz HHYIMMNLVDQNBA-UHFFFAOYSA-N 0 0 353.403 3.556 20 5 FHBDRN COC(=O)c1ccc(COc2ccc(Br)cc2[N+](=O)[O-])cc1 ZINC000303872757 938291218 /nfs/dbraw/zinc/29/12/18/938291218.db2.gz IBTMWKNQHGHNHK-UHFFFAOYSA-N 0 0 366.167 3.723 20 5 FHBDRN C[C@H](O)CCCNC(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000278838923 945163185 /nfs/dbraw/zinc/16/31/85/945163185.db2.gz PKAQMEYCZFSFMJ-ZDUSSCGKSA-N 0 0 359.382 3.670 20 5 FHBDRN Cn1cc(C(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)c(C2CCCCC2)n1 ZINC000536064679 938297446 /nfs/dbraw/zinc/29/74/46/938297446.db2.gz HFGCAWIAHCPGDS-UHFFFAOYSA-N 0 0 368.437 3.575 20 5 FHBDRN Cc1c(C(=O)Nc2cc(C)nc3ccc([N+](=O)[O-])cc32)cnn1C(C)(C)C ZINC000161780071 938306114 /nfs/dbraw/zinc/30/61/14/938306114.db2.gz JQSMRSQAUIQQJB-UHFFFAOYSA-N 0 0 367.409 3.964 20 5 FHBDRN C[C@@H](C(=O)N(C)CCc1ccccc1[N+](=O)[O-])c1cn(C)c2ccccc12 ZINC000583581180 938309020 /nfs/dbraw/zinc/30/90/20/938309020.db2.gz BWEVCWKUJHZHQI-OAHLLOKOSA-N 0 0 365.433 3.891 20 5 FHBDRN O=C(c1cccn1Cc1cccs1)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000536076656 938309271 /nfs/dbraw/zinc/30/92/71/938309271.db2.gz KKXLLLYKPNWNMN-UHFFFAOYSA-N 0 0 367.430 3.705 20 5 FHBDRN CS(=O)(=O)c1ccc(N2CCC[C@@H]2CCc2ccccc2)c([N+](=O)[O-])c1 ZINC000052454232 938309842 /nfs/dbraw/zinc/30/98/42/938309842.db2.gz NTXAZBVSPLCZBY-MRXNPFEDSA-N 0 0 374.462 3.600 20 5 FHBDRN COc1cccc(CO[C@H](C)c2nc(-c3ccc([N+](=O)[O-])s3)no2)c1 ZINC000278335411 938311972 /nfs/dbraw/zinc/31/19/72/938311972.db2.gz ZYBCXGUUITYAPJ-SNVBAGLBSA-N 0 0 361.379 3.993 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(OCc2cccc(OC(C)(C)C)n2)c1 ZINC000507350614 945164252 /nfs/dbraw/zinc/16/42/52/945164252.db2.gz UYGNGMQHOGEEHW-UHFFFAOYSA-N 0 0 360.366 3.533 20 5 FHBDRN CS(=O)(=O)c1ccc(N2CCC[C@H]2C2CCCCC2)c([N+](=O)[O-])c1 ZINC000052469260 938322011 /nfs/dbraw/zinc/32/20/11/938322011.db2.gz MJUKIKXFYNUFHU-HNNXBMFYSA-N 0 0 352.456 3.547 20 5 FHBDRN CS(=O)(=O)c1ccc(N2CCC[C@@H]2C2CCCCC2)c([N+](=O)[O-])c1 ZINC000052469257 938322633 /nfs/dbraw/zinc/32/26/33/938322633.db2.gz MJUKIKXFYNUFHU-OAHLLOKOSA-N 0 0 352.456 3.547 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)F)cc1N1CCO[C@H](c2ccsc2)C1 ZINC000278351900 938329795 /nfs/dbraw/zinc/32/97/95/938329795.db2.gz JRWFBPGCVZKSAX-LBPRGKRZSA-N 0 0 359.329 3.648 20 5 FHBDRN O=C(CN1CCc2c1cccc2[N+](=O)[O-])Nc1c(Cl)cccc1Cl ZINC000178951277 938342963 /nfs/dbraw/zinc/34/29/63/938342963.db2.gz NRUKKDUEZUCMBI-UHFFFAOYSA-N 0 0 366.204 3.903 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)Nc1cc(Cl)cc(Cl)c1[O-] ZINC000536095144 938344368 /nfs/dbraw/zinc/34/43/68/938344368.db2.gz OACFKOAWAKGMEI-UHFFFAOYSA-N 0 0 357.149 3.625 20 5 FHBDRN O=[N+]([O-])c1cc(F)ccc1-c1nc(Cc2cccc3cccnc32)no1 ZINC000161824679 938355701 /nfs/dbraw/zinc/35/57/01/938355701.db2.gz NRDRATCAFFQTIF-UHFFFAOYSA-N 0 0 350.309 3.923 20 5 FHBDRN O=[N+]([O-])c1ccccc1/C=C\CNc1ccccc1CN1CCOCC1 ZINC000536101279 938358273 /nfs/dbraw/zinc/35/82/73/938358273.db2.gz QOWXTOIBQXOQRW-YVMONPNESA-N 0 0 353.422 3.552 20 5 FHBDRN C[C@H](NCc1c(F)cc([N+](=O)[O-])cc1F)c1cnn(Cc2ccccc2)c1 ZINC000509582409 945170019 /nfs/dbraw/zinc/17/00/19/945170019.db2.gz HEOFHPYVOMNMOH-ZDUSSCGKSA-N 0 0 372.375 3.969 20 5 FHBDRN Cc1sc(S(=O)(=O)N2CCCCC[C@@H]2c2ccco2)cc1[N+](=O)[O-] ZINC000124186181 945171541 /nfs/dbraw/zinc/17/15/41/945171541.db2.gz RIXBQZCCVDVHDN-GFCCVEGCSA-N 0 0 370.452 3.864 20 5 FHBDRN CCO[C@H]1C[C@H](NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C12CCC2 ZINC000437246604 945177614 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CCc1nccn1[C@@H]1CCCN(c2cc(C(F)(F)F)ncc2[N+](=O)[O-])C1 ZINC000278443599 938436445 /nfs/dbraw/zinc/43/64/45/938436445.db2.gz QYNWCDLISMQREF-LLVKDONJSA-N 0 0 369.347 3.609 20 5 FHBDRN CCNc1cnc(-c2noc([C@H](CC)Cc3ccc([N+](=O)[O-])cc3)n2)cn1 ZINC000583842340 938445992 /nfs/dbraw/zinc/44/59/92/938445992.db2.gz PAYDQQAVSWTULN-CYBMUJFWSA-N 0 0 368.397 3.603 20 5 FHBDRN Cc1cc(C(=O)OCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)c(C)s1 ZINC000050807333 938446552 /nfs/dbraw/zinc/44/65/52/938446552.db2.gz UOQXJJJOOSVUOT-UHFFFAOYSA-N 0 0 359.363 3.680 20 5 FHBDRN Cc1ccc(N(C)C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3F)n2)cc1 ZINC001125691717 938446855 /nfs/dbraw/zinc/44/68/55/938446855.db2.gz LYRXCOARTMCKPZ-UHFFFAOYSA-N 0 0 354.341 3.505 20 5 FHBDRN C[C@H]1CCC[C@H]1CNC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000536143250 938449623 /nfs/dbraw/zinc/44/96/23/938449623.db2.gz ZZJAENYRJRCYRU-QWRGUYRKSA-N 0 0 360.332 3.702 20 5 FHBDRN C[C@H]1CCC[C@@H]1CNC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000536143251 938449739 /nfs/dbraw/zinc/44/97/39/938449739.db2.gz ZZJAENYRJRCYRU-WDEREUQCSA-N 0 0 360.332 3.702 20 5 FHBDRN Cc1c2ccccc2oc1CNC(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000536143233 938450011 /nfs/dbraw/zinc/45/00/11/938450011.db2.gz XRDPUQFJDPNDIX-UHFFFAOYSA-N 0 0 353.378 3.691 20 5 FHBDRN CN(C)c1ccc(C(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cc1F ZINC000583853966 938451964 /nfs/dbraw/zinc/45/19/64/938451964.db2.gz FLJFYCRNSBVVFH-MRXNPFEDSA-N 0 0 371.412 3.820 20 5 FHBDRN CCN(CC)C(=O)c1ccc(CNc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000278463344 938453527 /nfs/dbraw/zinc/45/35/27/938453527.db2.gz MUOGVEZNBMFCJP-UHFFFAOYSA-N 0 0 367.409 3.565 20 5 FHBDRN CN(C)c1c(Cl)cccc1NC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000124219864 945176409 /nfs/dbraw/zinc/17/64/09/945176409.db2.gz SCMXGJOGWDQIES-UHFFFAOYSA-N 0 0 374.828 3.904 20 5 FHBDRN COc1ccc(NC(=O)[C@H](C)Cc2cncc3ccccc32)c([N+](=O)[O-])c1 ZINC000583893293 938470010 /nfs/dbraw/zinc/47/00/10/938470010.db2.gz RHYDVOBKPKEZDP-CYBMUJFWSA-N 0 0 365.389 3.969 20 5 FHBDRN CCCC[C@H](NC(=O)c1cccc2c(=O)c3ccccc3[nH]c12)C(=O)OC ZINC000278490205 938473702 /nfs/dbraw/zinc/47/37/02/938473702.db2.gz JUJLGKVGZZFTIL-KRWDZBQOSA-N 0 0 366.417 3.555 20 5 FHBDRN COc1cccc(CCNC(=O)c2c([N+](=O)[O-])cccc2C(F)(F)F)c1 ZINC000583899620 938474166 /nfs/dbraw/zinc/47/41/66/938474166.db2.gz YELYAOLWDUTQQJ-UHFFFAOYSA-N 0 0 368.311 3.595 20 5 FHBDRN CC(C)(NC(=O)c1ccc(-c2ccco2)[nH]c1=O)c1ccccc1[N+](=O)[O-] ZINC000583923345 938487603 /nfs/dbraw/zinc/48/76/03/938487603.db2.gz HSCHFUWGPUQWAR-UHFFFAOYSA-N 0 0 367.361 3.621 20 5 FHBDRN O=C(CSc1ccccc1[N+](=O)[O-])N[C@@H](c1ccccc1)[C@H]1CCOC1 ZINC000544055872 938488674 /nfs/dbraw/zinc/48/86/74/938488674.db2.gz IYIGJTNCNRCZBJ-KXBFYZLASA-N 0 0 372.446 3.581 20 5 FHBDRN COC(=O)[C@H](C)CSc1cc(C(F)(F)C(F)(F)F)ncc1[N+](=O)[O-] ZINC000278513416 938494234 /nfs/dbraw/zinc/49/42/34/938494234.db2.gz RQRSJZKKZJICOP-ZCFIWIBFSA-N 0 0 374.287 3.545 20 5 FHBDRN CCn1cc([C@@H]2CN(c3c(Cl)cc(Cl)cc3[N+](=O)[O-])CCO2)cn1 ZINC000583950034 938497262 /nfs/dbraw/zinc/49/72/62/938497262.db2.gz IMMCHWXEAIOCMV-AWEZNQCLSA-N 0 0 371.224 3.696 20 5 FHBDRN Cc1ccc([C@@H](NC(=O)NCCc2cccc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000536169457 938502098 /nfs/dbraw/zinc/50/20/98/938502098.db2.gz LSGDPIHOGIFMSQ-LJQANCHMSA-N 0 0 353.422 3.896 20 5 FHBDRN C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1Cc2ccccc2C(C)(C)C1 ZINC000536181077 938520377 /nfs/dbraw/zinc/52/03/77/938520377.db2.gz UCHGVIPPLSTKBE-AWEZNQCLSA-N 0 0 353.422 3.715 20 5 FHBDRN CC(C)(C(=O)NC[C@@H]1CCC2(CCCCC2)O1)c1ccccc1[N+](=O)[O-] ZINC000506423620 945182436 /nfs/dbraw/zinc/18/24/36/945182436.db2.gz SWMOKUNJXHMQTN-HNNXBMFYSA-N 0 0 360.454 3.871 20 5 FHBDRN CCN([C@H](C)Cc1ccsc1)S(=O)(=O)c1cc(C)sc1[N+](=O)[O-] ZINC001211606299 938536097 /nfs/dbraw/zinc/53/60/97/938536097.db2.gz SCJXQRUQNLSGND-SNVBAGLBSA-N 0 0 374.509 3.668 20 5 FHBDRN O=[N+]([O-])c1c(NCc2cc(Br)ccn2)ccc2ncccc21 ZINC000432142390 945184677 /nfs/dbraw/zinc/18/46/77/945184677.db2.gz DXBITRCNRLRWSN-UHFFFAOYSA-N 0 0 359.183 3.913 20 5 FHBDRN C[C@H]1C[C@H](Nc2cc(C(F)(F)C(F)(F)F)ncc2[N+](=O)[O-])CCO1 ZINC000278582839 938553714 /nfs/dbraw/zinc/55/37/14/938553714.db2.gz YFYBPIVBQNAEMT-JGVFFNPUSA-N 0 0 355.263 3.623 20 5 FHBDRN CCn1c(-c2cccc([N+](=O)[O-])c2)nnc1N1CC[C@@H](C)C2(CCC2)C1 ZINC000584059768 938575786 /nfs/dbraw/zinc/57/57/86/938575786.db2.gz JGCCGDPUNAJMLI-CQSZACIVSA-N 0 0 355.442 3.890 20 5 FHBDRN CC[C@H](C)[C@H](NC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1)C(F)(F)F ZINC000584092852 938594759 /nfs/dbraw/zinc/59/47/59/938594759.db2.gz MMCUIQCWDMNQRJ-HZMBPMFUSA-N 0 0 359.348 3.640 20 5 FHBDRN COc1ccc(CNCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)cc1O ZINC000278627986 938597247 /nfs/dbraw/zinc/59/72/47/938597247.db2.gz FDHSVPHTLFJMMJ-UHFFFAOYSA-N 0 0 356.300 3.618 20 5 FHBDRN O=C(Nc1nc2c(s1)CCC2)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000584095789 938599787 /nfs/dbraw/zinc/59/97/87/938599787.db2.gz QGOZQVKINQFNAY-CYBMUJFWSA-N 0 0 372.450 3.952 20 5 FHBDRN CCn1c(C)nc([N+](=O)[O-])c1NCCC(=O)Nc1cccc(Cl)c1C ZINC000584134413 938613697 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C[C@H](NC(=O)CN(C)c1nc2ccccc2s1)c1cccc([N+](=O)[O-])c1 ZINC000507391926 945192886 /nfs/dbraw/zinc/19/28/86/945192886.db2.gz XZMUJSSWDWRCJX-LBPRGKRZSA-N 0 0 370.434 3.518 20 5 FHBDRN COc1ccc(OCCSCCOc2cccc(F)c2)c([N+](=O)[O-])c1 ZINC000437269247 945194241 /nfs/dbraw/zinc/19/42/41/945194241.db2.gz OTSIRKVJVWACOL-UHFFFAOYSA-N 0 0 367.398 3.934 20 5 FHBDRN Cc1cc(F)cc(C(=O)NC[C@@H](O)c2ccc(C(C)(C)C)cc2)c1[N+](=O)[O-] ZINC000176813472 938666277 /nfs/dbraw/zinc/66/62/77/938666277.db2.gz DQMUBGSGLLLMSU-QGZVFWFLSA-N 0 0 374.412 3.803 20 5 FHBDRN Cc1ccc(CN(C)C(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)cc1 ZINC000052956801 938681357 /nfs/dbraw/zinc/68/13/57/938681357.db2.gz BLYGJEOLKHZQTH-UHFFFAOYSA-N 0 0 364.405 3.576 20 5 FHBDRN COc1ccc(NC(=O)N(C)Cc2ccc(Cl)s2)cc1[N+](=O)[O-] ZINC000584343445 938692798 /nfs/dbraw/zinc/69/27/98/938692798.db2.gz VFAVBYQPICEZTC-UHFFFAOYSA-N 0 0 355.803 3.982 20 5 FHBDRN COc1ccc(NC(=O)N2CCS[C@@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000611824615 938698450 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CCOc1c(OC)cc(CN(C)Cc2ccccc2[N+](=O)[O-])cc1OC ZINC000179316468 939080303 /nfs/dbraw/zinc/08/03/03/939080303.db2.gz AGEACHVNPMHJKD-UHFFFAOYSA-N 0 0 360.410 3.643 20 5 FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@H](C)[C@@H]1C ZINC000179329641 939086255 /nfs/dbraw/zinc/08/62/55/939086255.db2.gz LXYASHPMMUEDLH-STQMWFEESA-N 0 0 352.456 3.594 20 5 FHBDRN C[C@H](C[C@H](O)c1ccco1)NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000179325222 939086314 /nfs/dbraw/zinc/08/63/14/939086314.db2.gz PPYVDCURTFNBFS-MFKMUULPSA-N 0 0 360.391 3.645 20 5 FHBDRN CC[C@H](CNC(=O)c1cc([N+](=O)[O-])c[nH]1)Oc1ccccc1C(F)(F)F ZINC000440091116 945226312 /nfs/dbraw/zinc/22/63/12/945226312.db2.gz JQHRCPIVQJGKJX-LLVKDONJSA-N 0 0 371.315 3.529 20 5 FHBDRN COc1ccc(CNc2cc(C)c(Br)cn2)cc1[N+](=O)[O-] ZINC000179363577 939096999 /nfs/dbraw/zinc/09/69/99/939096999.db2.gz NPWUQYQOFKAVDT-UHFFFAOYSA-N 0 0 352.188 3.681 20 5 FHBDRN Cc1nc(NCc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)nn1C ZINC000427249234 945227502 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FHBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(C)[C@@H](C)c1ccccc1F ZINC000065792322 939143618 /nfs/dbraw/zinc/14/36/18/939143618.db2.gz OZKUTZQRIGDXKW-LBPRGKRZSA-N 0 0 366.414 3.678 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]cc(Cc3nc(COc4ccccc4F)no3)c2c1 ZINC000188296129 939150413 /nfs/dbraw/zinc/15/04/13/939150413.db2.gz JJTFIDGPBMBGIG-UHFFFAOYSA-N 0 0 368.324 3.768 20 5 FHBDRN COc1ccc(C(=O)N[C@@H](c2cccc(C)c2)C(F)(F)F)cc1[N+](=O)[O-] ZINC000511829346 945231159 /nfs/dbraw/zinc/23/11/59/945231159.db2.gz ZVWRMEABJFWDRZ-HNNXBMFYSA-N 0 0 368.311 3.945 20 5 FHBDRN CC(=O)c1ccc(OC(=O)c2cc([N+](=O)[O-])c(N(C)C)cc2F)c(C)c1 ZINC001125783878 939161908 /nfs/dbraw/zinc/16/19/08/939161908.db2.gz MJLSJFPKBKBDLI-UHFFFAOYSA-N 0 0 360.341 3.530 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)NCC1(Cc2ccccc2)CC1 ZINC000179443592 939163823 /nfs/dbraw/zinc/16/38/23/939163823.db2.gz UNGPCMYDBCZWRU-UHFFFAOYSA-N 0 0 363.417 3.758 20 5 FHBDRN O=C(NCc1ccc(-c2nc3ccccc3s2)o1)c1ccc([N+](=O)[O-])[nH]1 ZINC000518222428 945232676 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373.434 3.516 20 5 FHBDRN Cn1c2ccccc2nc1[C@H]1CCCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000065810821 939225127 /nfs/dbraw/zinc/22/51/27/939225127.db2.gz WHJWUJVRPCXSKB-CQSZACIVSA-N 0 0 370.434 3.910 20 5 FHBDRN C[C@H](CCc1ccco1)NC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000426235951 945239164 /nfs/dbraw/zinc/23/91/64/945239164.db2.gz FXEYTIPCIODSFM-CQSZACIVSA-N 0 0 357.410 3.883 20 5 FHBDRN COc1ccc(C2CCN(C(=O)Cc3cccc([N+](=O)[O-])c3C)CC2)cc1 ZINC000438938114 945242339 /nfs/dbraw/zinc/24/23/39/945242339.db2.gz NGPNGTOXNFKMME-UHFFFAOYSA-N 0 0 368.433 3.861 20 5 FHBDRN CC[C@H](C)N(Cc1ccccc1)S(=O)(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000151346477 945256003 /nfs/dbraw/zinc/25/60/03/945256003.db2.gz BTHGELKJLCUXKN-HNNXBMFYSA-N 0 0 362.451 3.725 20 5 FHBDRN O=[N+]([O-])c1cccc(Cl)c1NCc1ccncc1OC[C@H]1CCOC1 ZINC000432175557 945259903 /nfs/dbraw/zinc/25/99/03/945259903.db2.gz GYMHAGUSTLVTTJ-LBPRGKRZSA-N 0 0 363.801 3.671 20 5 FHBDRN CC(=O)c1ccc(NCc2cc(Br)ccn2)c([N+](=O)[O-])c1 ZINC000432176625 945260503 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FHBDRN O=C(c1cccc2ccc(=O)[nH]c21)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000516809001 945274201 /nfs/dbraw/zinc/27/42/01/945274201.db2.gz ROHMRLFHMMSOSO-UHFFFAOYSA-N 0 0 363.373 3.653 20 5 FHBDRN O=[N+]([O-])c1ccc(NC[C@H](O)COc2cccc(C(F)(F)F)c2)c(F)c1 ZINC000516810396 945274404 /nfs/dbraw/zinc/27/44/04/945274404.db2.gz VBWLROPLRGIQEP-LBPRGKRZSA-N 0 0 374.290 3.605 20 5 FHBDRN CCSc1ccc([C@@H](C)NS(=O)(=O)c2ccc([N+](=O)[O-])s2)cc1 ZINC000507488121 945274560 /nfs/dbraw/zinc/27/45/60/945274560.db2.gz TXLMJDTUMSZXJR-SNVBAGLBSA-N 0 0 372.493 3.808 20 5 FHBDRN O=C(c1scnc1C1CCCC1)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000188451726 939878107 /nfs/dbraw/zinc/87/81/07/939878107.db2.gz QCAIRHNSLFNMAR-UHFFFAOYSA-N 0 0 373.434 3.612 20 5 FHBDRN Cc1cc(C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)nc(C(F)(F)F)n1 ZINC000188453513 939878444 /nfs/dbraw/zinc/87/84/44/939878444.db2.gz ABTRYIUCBUNIHA-SNVBAGLBSA-N 0 0 368.315 3.511 20 5 FHBDRN O=C1CCCN1C[C@@H](NCc1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1 ZINC000179554283 939887826 /nfs/dbraw/zinc/88/78/26/939887826.db2.gz KPULKANEZZUQKM-QGZVFWFLSA-N 0 0 373.840 3.702 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N[C@H]1CCOc2ccc(F)cc21 ZINC000179558011 939888321 /nfs/dbraw/zinc/88/83/21/939888321.db2.gz DGYKUXBPKARGQW-HNNXBMFYSA-N 0 0 358.369 3.913 20 5 FHBDRN O=C(N[C@@H](Cc1ccc(Cl)cc1)c1ccccc1)c1[nH]ncc1[N+](=O)[O-] ZINC000179588392 939892508 /nfs/dbraw/zinc/89/25/08/939892508.db2.gz MHMVPBLZVHAGPU-HNNXBMFYSA-N 0 0 370.796 3.685 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@@H]1c1cccnc1 ZINC000364023214 939899852 /nfs/dbraw/zinc/89/98/52/939899852.db2.gz QKHPYGZKXPIGRP-VQIMIIECSA-N 0 0 353.422 3.922 20 5 FHBDRN O=C(Cc1ccc(O)cc1Cl)Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1 ZINC000136232356 939901409 /nfs/dbraw/zinc/90/14/09/939901409.db2.gz IVJIZQRKAGPKBE-UHFFFAOYSA-N 0 0 372.768 3.525 20 5 FHBDRN O=[N+]([O-])c1ccc(NS(=O)(=O)Cc2cccc(C(F)(F)F)c2)cc1 ZINC000179643064 939906972 /nfs/dbraw/zinc/90/69/72/939906972.db2.gz DQSIZBGCWAMEEM-UHFFFAOYSA-N 0 0 360.313 3.556 20 5 FHBDRN CSc1cccc(C(=O)NC[C@@H]2CCc3ccccc3C2)c1[N+](=O)[O-] ZINC000614414870 939911729 /nfs/dbraw/zinc/91/17/29/939911729.db2.gz ARTBNHNBOCZNAC-CYBMUJFWSA-N 0 0 356.447 3.852 20 5 FHBDRN CC[C@@H](Cc1ccccc1)N(C)C(=O)c1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000410525358 939919099 /nfs/dbraw/zinc/91/90/99/939919099.db2.gz GVSRORRJUMOHRR-AWEZNQCLSA-N 0 0 360.385 3.836 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)Nc1c[nH]nc1-c1ccccc1 ZINC000179704573 939924235 /nfs/dbraw/zinc/92/42/35/939924235.db2.gz MRHKBWUOESAIFM-UHFFFAOYSA-N 0 0 356.769 3.820 20 5 FHBDRN O=[N+]([O-])c1cccc(F)c1CN[C@@H](c1ccc2c(c1)OCCO2)C1CC1 ZINC000179737706 939928378 /nfs/dbraw/zinc/92/83/78/939928378.db2.gz CVGZPIULAASNBO-LJQANCHMSA-N 0 0 358.369 3.746 20 5 FHBDRN COc1ccc(-c2nnc(NC(=O)c3cccc(C)c3[N+](=O)[O-])s2)cc1 ZINC000136353989 939937402 /nfs/dbraw/zinc/93/74/02/939937402.db2.gz VWTAYPMEIIUPHK-UHFFFAOYSA-N 0 0 370.390 3.683 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]cc(Cc3nc(-c4ccc(F)c(F)c4)no3)c2c1 ZINC000136359879 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0 0 360.797 3.850 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N1CCC[C@]2(CCCCO2)C1 ZINC000365197875 940080357 /nfs/dbraw/zinc/08/03/57/940080357.db2.gz LLVWFCUCHYHVDW-MRXNPFEDSA-N 0 0 353.806 3.815 20 5 FHBDRN CO[C@H](CNC(=O)c1ccccc1Sc1ccccc1[N+](=O)[O-])C1CC1 ZINC000511351383 940085023 /nfs/dbraw/zinc/08/50/23/940085023.db2.gz ONGAJZNHZFXGCY-MRXNPFEDSA-N 0 0 372.446 3.901 20 5 FHBDRN C[C@H](C(=O)N1CCCO[C@@H](c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000612469756 940088786 /nfs/dbraw/zinc/08/87/86/940088786.db2.gz WWKQOHUXZZXDSX-IFXJQAMLSA-N 0 0 372.396 3.828 20 5 FHBDRN C[C@H](C(=O)NCc1ccccc1N1CCCC1)c1ccc([N+](=O)[O-])cc1F ZINC000612482766 940094057 /nfs/dbraw/zinc/09/40/57/940094057.db2.gz OCLXSQPTDSJSGO-AWEZNQCLSA-N 0 0 371.412 3.754 20 5 FHBDRN COc1ccc(NC(=O)c2ccc(-n3cccc3)c(F)c2)c([N+](=O)[O-])c1 ZINC000110177671 940095852 /nfs/dbraw/zinc/09/58/52/940095852.db2.gz JLCFKNXJQLOXLK-UHFFFAOYSA-N 0 0 355.325 3.786 20 5 FHBDRN Cc1ccc(NC(=O)CN(C)CCc2cccc([N+](=O)[O-])c2)c(Cl)c1 ZINC000548934995 940099939 /nfs/dbraw/zinc/09/99/39/940099939.db2.gz ZSHQQFJITUPWHW-UHFFFAOYSA-N 0 0 361.829 3.670 20 5 FHBDRN CC(C)N(C(=O)CN(C)CCc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000548935760 940101192 /nfs/dbraw/zinc/10/11/92/940101192.db2.gz WOXZOJGAAMXPQD-UHFFFAOYSA-N 0 0 355.438 3.511 20 5 FHBDRN O=C(NCCc1c[nH]c2cc(F)ccc12)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000411804367 940123797 /nfs/dbraw/zinc/12/37/97/940123797.db2.gz VOOWCLSBXQXTFU-ZWKOTPCHSA-N 0 0 367.380 3.678 20 5 FHBDRN C[C@H](CNC(=O)c1cccc(Cl)c1[N+](=O)[O-])Oc1cccc(F)c1 ZINC000177337276 940125782 /nfs/dbraw/zinc/12/57/82/940125782.db2.gz UBYUUUKJCLZQDZ-SNVBAGLBSA-N 0 0 352.749 3.585 20 5 FHBDRN Cc1ccccc1CC1CN(C(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000612552432 940136069 /nfs/dbraw/zinc/13/60/69/940136069.db2.gz BICPQAPCOQDRHT-AWEZNQCLSA-N 0 0 356.397 3.847 20 5 FHBDRN COc1cc(C)cc(CNC(=O)c2c([N+](=O)[O-])cccc2C(F)(F)F)c1 ZINC000612556191 940143061 /nfs/dbraw/zinc/14/30/61/940143061.db2.gz KSRUKKCOJUJRBS-UHFFFAOYSA-N 0 0 368.311 3.861 20 5 FHBDRN CC(C)CSCCNC(=O)c1c([N+](=O)[O-])cccc1C(F)(F)F ZINC000612556732 940143979 /nfs/dbraw/zinc/14/39/79/940143979.db2.gz STZGKNQLPUNHRV-UHFFFAOYSA-N 0 0 350.362 3.733 20 5 FHBDRN CN(Cc1ccccc1F)C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000179940354 940147233 /nfs/dbraw/zinc/14/72/33/940147233.db2.gz LPAUHIBJKUFWAK-UHFFFAOYSA-N 0 0 354.284 3.608 20 5 FHBDRN Cc1ccc(NC(=O)[C@H]2CCC(=O)N(C)[C@H]2c2cccs2)cc1[N+](=O)[O-] ZINC000365411860 940150516 /nfs/dbraw/zinc/15/05/16/940150516.db2.gz KRPPHIOEXGHEEH-SUMWQHHRSA-N 0 0 373.434 3.513 20 5 FHBDRN COc1ccc(CN(C)c2ccc(C(=O)NC(C)(C)C)cc2)cc1[N+](=O)[O-] ZINC000411900109 940153630 /nfs/dbraw/zinc/15/36/30/940153630.db2.gz MHOJVEMIMLTRCJ-UHFFFAOYSA-N 0 0 371.437 3.768 20 5 FHBDRN Cc1ccccc1C1(CNC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)CC1 ZINC000411888214 940154630 /nfs/dbraw/zinc/15/46/30/940154630.db2.gz PYUOSQYHRGKXOJ-ZWKOTPCHSA-N 0 0 350.418 3.855 20 5 FHBDRN O=C(N[C@H](c1ccccc1)[C@H]1CCCO1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000411885991 940154833 /nfs/dbraw/zinc/15/48/33/940154833.db2.gz ZKJDGQQJSKJBAT-MTQWCTHYSA-N 0 0 366.417 3.735 20 5 FHBDRN Cn1cc([N+](=O)[O-])cc1C(=O)Nc1ccc(-n2cnc3ccccc32)cc1 ZINC000612578655 940159335 /nfs/dbraw/zinc/15/93/35/940159335.db2.gz CALVKVSVAJABGB-UHFFFAOYSA-N 0 0 361.361 3.525 20 5 FHBDRN COc1ccc(F)cc1[C@H](C)NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000179949469 940160172 /nfs/dbraw/zinc/16/01/72/940160172.db2.gz FBFOPXZVAAFHTO-NSHDSACASA-N 0 0 372.356 3.643 20 5 FHBDRN CC(C)(C)N(CC(=O)Nc1ccc(F)cc1)Cc1ccccc1[N+](=O)[O-] ZINC000506778229 945300339 /nfs/dbraw/zinc/30/03/39/945300339.db2.gz POJPTPLWBPHCJC-UHFFFAOYSA-N 0 0 359.401 3.973 20 5 FHBDRN Cc1ccccc1[C@H](NC(=O)c1c[nH]nc1[N+](=O)[O-])[C@H]1CCC[C@H](C)C1 ZINC000548942945 940168161 /nfs/dbraw/zinc/16/81/61/940168161.db2.gz GBIVDQXFRDNBPA-RVSPLBMKSA-N 0 0 356.426 3.924 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)NCc1ccc(OC(C)(C)C)nc1 ZINC000179957016 940169534 /nfs/dbraw/zinc/16/95/34/940169534.db2.gz RLMYRVQGYJTVHQ-UHFFFAOYSA-N 0 0 358.398 3.797 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CN1CC2(CCOCC2)[C@H]1c1ccccc1 ZINC000411983834 940173162 /nfs/dbraw/zinc/17/31/62/940173162.db2.gz GSEAITACAWFWAR-HXUWFJFHSA-N 0 0 368.433 3.957 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1F)N(C[C@@H]1CCCO1)C1CCCC1 ZINC000612614305 940177766 /nfs/dbraw/zinc/17/77/66/940177766.db2.gz PZIBHRXAGHKOND-AWEZNQCLSA-N 0 0 351.378 3.689 20 5 FHBDRN CC(C)c1nc(C(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])cs1 ZINC000540891758 940180154 /nfs/dbraw/zinc/18/01/54/940180154.db2.gz DZDULIMILXCPLJ-UHFFFAOYSA-N 0 0 353.831 3.801 20 5 FHBDRN Cc1ccc([C@H](Nc2ccc(C(N)=O)cc2[N+](=O)[O-])c2ccccn2)cc1 ZINC000376009262 940184580 /nfs/dbraw/zinc/18/45/80/940184580.db2.gz WKOQROJVVRBXQB-IBGZPJMESA-N 0 0 362.389 3.599 20 5 FHBDRN CC(C)(O)CN(Cc1ccccc1)C(=O)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000124481665 945302085 /nfs/dbraw/zinc/30/20/85/945302085.db2.gz KQWXCFDJRQBCQD-UHFFFAOYSA-N 0 0 362.813 3.662 20 5 FHBDRN Cc1cccc(C2=CCN(S(=O)(=O)Cc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000179984268 940197308 /nfs/dbraw/zinc/19/73/08/940197308.db2.gz PHKRTDQPIIVYIB-UHFFFAOYSA-N 0 0 372.446 3.522 20 5 FHBDRN O=[N+]([O-])c1cnc2ccc(Br)cc2c1OC[C@H]1CCCOC1 ZINC000612661318 940208113 /nfs/dbraw/zinc/20/81/13/940208113.db2.gz YOILVSVDSGTEES-JTQLQIEISA-N 0 0 367.199 3.711 20 5 FHBDRN CCOCCCOc1c2cc(Br)ccc2ncc1[N+](=O)[O-] ZINC000612660807 940208368 /nfs/dbraw/zinc/20/83/68/940208368.db2.gz BNIMRCXBDUFBRG-UHFFFAOYSA-N 0 0 355.188 3.711 20 5 FHBDRN CC[C@H](C)Oc1cccc(NC(=O)COc2ccc([N+](=O)[O-])c(OC)c2)c1 ZINC000066027954 940212407 /nfs/dbraw/zinc/21/24/07/940212407.db2.gz UENFXAWULYORIG-ZDUSSCGKSA-N 0 0 374.393 3.798 20 5 FHBDRN Cn1nc(CNC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)c2ccccc21 ZINC000612713104 940235024 /nfs/dbraw/zinc/23/50/24/940235024.db2.gz CDEPQBFYUMVENI-UHFFFAOYSA-N 0 0 366.402 3.626 20 5 FHBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)N[C@@H](c1ccccc1)c1cccnc1 ZINC000255869284 940237090 /nfs/dbraw/zinc/23/70/90/940237090.db2.gz WXBCRXNTNJBACK-DGDFFNOKSA-N 0 0 359.385 3.909 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)Sc1nnnn1Cc1cccs1 ZINC000180019310 940249338 /nfs/dbraw/zinc/24/93/38/940249338.db2.gz GPCWGTIPTCGTMR-LLVKDONJSA-N 0 0 361.452 3.853 20 5 FHBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)N1CCCCC[C@@H]1/C=C/c1cccs1 ZINC000612758657 940260332 /nfs/dbraw/zinc/26/03/32/940260332.db2.gz QLKUGKNRAOJMFO-SBDDDAINSA-N 0 0 372.450 3.732 20 5 FHBDRN C[C@@H](Nc1ncc([N+](=O)[O-])cc1Br)c1cccc([N+](=O)[O-])c1 ZINC000177544292 940268954 /nfs/dbraw/zinc/26/89/54/940268954.db2.gz NSTWWRJIHSNENS-MRVPVSSYSA-N 0 0 367.159 3.834 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CC[C@H](n3ncc4ccccc43)C2)cc1OC(F)F ZINC000511376470 940269603 /nfs/dbraw/zinc/26/96/03/940269603.db2.gz GWFNZXJTZSJARW-AWEZNQCLSA-N 0 0 374.347 3.997 20 5 FHBDRN O=[N+]([O-])c1cnc(N[C@H]2C[C@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)nc1 ZINC000612778522 940271746 /nfs/dbraw/zinc/27/17/46/940271746.db2.gz SCDITIKWSAPRKV-JIGDXULJSA-N 0 0 358.242 3.706 20 5 FHBDRN O=C(NCC1(c2cccc(F)c2)CC1)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000124640536 945308488 /nfs/dbraw/zinc/30/84/88/945308488.db2.gz DMNVSNFAZGDLJJ-UHFFFAOYSA-N 0 0 369.396 3.533 20 5 FHBDRN COc1cc(C(=O)N(C)c2ccc(SC)cc2)cc([N+](=O)[O-])c1OC ZINC000584501592 940294233 /nfs/dbraw/zinc/29/42/33/940294233.db2.gz KHBSHIJFMOBVDF-UHFFFAOYSA-N 0 0 362.407 3.611 20 5 FHBDRN COCCC[C@H](C)C(=O)N(C)c1nc(-c2ccccc2[N+](=O)[O-])cs1 ZINC000180033707 940296843 /nfs/dbraw/zinc/29/68/43/940296843.db2.gz SNYPFLLUTCSATJ-LBPRGKRZSA-N 0 0 363.439 3.744 20 5 FHBDRN COc1cc(Cl)c(C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1OC ZINC000124586903 945310510 /nfs/dbraw/zinc/31/05/10/945310510.db2.gz QBXAQTBDEBNVEZ-UHFFFAOYSA-N 0 0 350.758 3.826 20 5 FHBDRN O=[N+]([O-])c1cccc(/C=C\c2nc(Cc3ccc4c(c3)OCCO4)no2)c1 ZINC000612893910 940331242 /nfs/dbraw/zinc/33/12/42/940331242.db2.gz LAFUBAKPEWGCOR-ALCCZGGFSA-N 0 0 365.345 3.510 20 5 FHBDRN CC[C@@H](CNC(=O)c1cc(F)c(F)cc1[N+](=O)[O-])Oc1ccccc1F ZINC000177646523 940333033 /nfs/dbraw/zinc/33/30/33/940333033.db2.gz SLHNVLMDMPSHDF-JTQLQIEISA-N 0 0 368.311 3.600 20 5 FHBDRN COc1cccc([C@H](C)c2noc(COc3ccc([N+](=O)[O-])cc3)n2)c1 ZINC000612918336 940336208 /nfs/dbraw/zinc/33/62/08/940336208.db2.gz ZPKZVNVLXCVCFP-LBPRGKRZSA-N 0 0 355.350 3.717 20 5 FHBDRN CC(C)(c1nc(Cc2ccc3c(c2)CCO3)no1)c1ccc([N+](=O)[O-])cc1 ZINC000612911831 940337223 /nfs/dbraw/zinc/33/72/23/940337223.db2.gz IBOXUOGWHYCAIF-UHFFFAOYSA-N 0 0 365.389 3.829 20 5 FHBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)c1nc([C@H]2CCC[C@@H](C)C2)no1 ZINC000612911189 940337339 /nfs/dbraw/zinc/33/73/39/940337339.db2.gz PCYHJRZWLRJDFY-AGIUHOORSA-N 0 0 358.398 3.763 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)cc(-c2nc(Cc3ccc4c(c3)CCO4)no2)c1 ZINC000612911986 940337496 /nfs/dbraw/zinc/33/74/96/940337496.db2.gz KVDWHHGRBZVSSH-UHFFFAOYSA-N 0 0 357.753 3.824 20 5 FHBDRN Cn1nccc1C1=C[C@H]2CC[C@@H](C1)N2c1ccc2ncccc2c1[N+](=O)[O-] ZINC000548964127 940339683 /nfs/dbraw/zinc/33/96/83/940339683.db2.gz IZDBHLXJCMWNPH-CABCVRRESA-N 0 0 361.405 3.701 20 5 FHBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)c1nc([C@@H]2CCCC[C@@H]2C)no1 ZINC000612928328 940341399 /nfs/dbraw/zinc/34/13/99/940341399.db2.gz SXKNCMUQBKWJEB-SLEUVZQESA-N 0 0 358.398 3.763 20 5 FHBDRN O=C(NC1(c2ccc(Br)cc2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000511399508 940355135 /nfs/dbraw/zinc/35/51/35/940355135.db2.gz QZBLBZDJOXCLPQ-UHFFFAOYSA-N 0 0 361.195 3.776 20 5 FHBDRN CSc1ccc(-c2nc(Cc3c[nH]c4ncccc34)no2)cc1[N+](=O)[O-] ZINC000612949963 940356113 /nfs/dbraw/zinc/35/61/13/940356113.db2.gz JEDBFIUESZIKHT-UHFFFAOYSA-N 0 0 367.390 3.834 20 5 FHBDRN CNc1ccc(-c2nc([C@@H]3CCc4ccccc4C3)no2)cc1[N+](=O)[O-] ZINC000612951855 940356190 /nfs/dbraw/zinc/35/61/90/940356190.db2.gz OUGYDVJZRGCLNH-CQSZACIVSA-N 0 0 350.378 3.959 20 5 FHBDRN COc1cc(-c2nc([C@@H]3CCc4ccccc4C3)no2)ccc1[N+](=O)[O-] ZINC000612952242 940356869 /nfs/dbraw/zinc/35/68/69/940356869.db2.gz ZXTGJLPIAVFEDP-CQSZACIVSA-N 0 0 351.362 3.926 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]nc(-c3nc([C@H]4CCc5ccccc5C4)no3)c2c1 ZINC000612952190 940356907 /nfs/dbraw/zinc/35/69/07/940356907.db2.gz XUIQPQNQXAHOBG-ZDUSSCGKSA-N 0 0 361.361 3.794 20 5 FHBDRN COc1ccc(COCc2nc(Cc3ccc([N+](=O)[O-])c(C)c3)no2)cc1 ZINC000612958013 940361006 /nfs/dbraw/zinc/36/10/06/940361006.db2.gz KHVUAXZYDHWJAX-UHFFFAOYSA-N 0 0 369.377 3.602 20 5 FHBDRN COc1cc(Cc2noc(C[C@@H]3CCc4ccccc43)n2)ccc1[N+](=O)[O-] ZINC000612967917 940364924 /nfs/dbraw/zinc/36/49/24/940364924.db2.gz QVKFYPAOBAOREW-HNNXBMFYSA-N 0 0 365.389 3.850 20 5 FHBDRN O=[N+]([O-])c1ccc(Cc2noc(-c3cc4cc(Cl)ccc4[nH]3)n2)nc1 ZINC000612967602 940366060 /nfs/dbraw/zinc/36/60/60/940366060.db2.gz WHFDCIUFLHDCIM-UHFFFAOYSA-N 0 0 355.741 3.765 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N[C@H]2CCCC[C@@H]2CC)cc1OC ZINC000124618966 945312972 /nfs/dbraw/zinc/31/29/72/945312972.db2.gz ZVPLOOWBROXTMC-JSGCOSHPSA-N 0 0 350.415 3.701 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])cc2c1OCCO2)N1CCCSc2ccccc21 ZINC000066273808 940380399 /nfs/dbraw/zinc/38/03/99/940380399.db2.gz OSZCJECSXIGQHC-UHFFFAOYSA-N 0 0 372.402 3.509 20 5 FHBDRN Cc1cc(C)c(NS(=O)(=O)c2cc(Cl)c(C)c([N+](=O)[O-])c2)cc1O ZINC000612997873 940386402 /nfs/dbraw/zinc/38/64/02/940386402.db2.gz OTZSHMMKNPJWMS-UHFFFAOYSA-N 0 0 370.814 3.680 20 5 FHBDRN CCOc1cc(OCC(=O)Nc2cccc(Cl)c2C)ccc1[N+](=O)[O-] ZINC000188605236 940389013 /nfs/dbraw/zinc/38/90/13/940389013.db2.gz SOKAPNNHMGIZLY-UHFFFAOYSA-N 0 0 364.785 3.973 20 5 FHBDRN O=C(OCCn1cc([N+](=O)[O-])cn1)c1sc2ccccc2c1Cl ZINC000177739149 940394445 /nfs/dbraw/zinc/39/44/45/940394445.db2.gz XZWVZWVRXHMROU-UHFFFAOYSA-N 0 0 351.771 3.516 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(OCC(F)F)cc2)c1 ZINC000548974424 940400612 /nfs/dbraw/zinc/40/06/12/940400612.db2.gz MQMGJHGBWVWNNV-UHFFFAOYSA-N 0 0 366.320 3.890 20 5 FHBDRN Cc1cc(C)c(NC(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])cc1O ZINC000613031673 940401369 /nfs/dbraw/zinc/40/13/69/940401369.db2.gz LWDITLYEACLJGN-LLVKDONJSA-N 0 0 364.785 3.977 20 5 FHBDRN CCOc1cc(OCc2nnc(-c3ccccc3OC)o2)ccc1[N+](=O)[O-] ZINC000188612812 940404629 /nfs/dbraw/zinc/40/46/29/940404629.db2.gz XKHKJWMTMDJRFC-UHFFFAOYSA-N 0 0 371.349 3.631 20 5 FHBDRN CCN(Cc1ccc(Cl)s1)S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-] ZINC000507538638 945314997 /nfs/dbraw/zinc/31/49/97/945314997.db2.gz ZQGKKEPJIHAUES-UHFFFAOYSA-N 0 0 374.871 3.829 20 5 FHBDRN O=[N+]([O-])c1ccc([C@@H](NC[C@H]2COc3ccccc32)C(F)(F)F)cc1 ZINC000579966487 940425875 /nfs/dbraw/zinc/42/58/75/940425875.db2.gz IYHIVICFODJHTH-BLLLJJGKSA-N 0 0 352.312 3.964 20 5 FHBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1CN[C@H](C)c1nnc2n1CCCCC2 ZINC000613062665 940430497 /nfs/dbraw/zinc/43/04/97/940430497.db2.gz LPYIBQGTTPPDHE-CQSZACIVSA-N 0 0 373.457 3.551 20 5 FHBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H](CO)[C@H]1C ZINC000414032348 940430940 /nfs/dbraw/zinc/43/09/40/940430940.db2.gz KSMRLYFPAAHJDJ-KGLIPLIRSA-N 0 0 366.483 3.720 20 5 FHBDRN C[C@@H](O)C[C@@H](C)CNC(=O)c1cc([N+](=O)[O-])ccc1SC1CCCC1 ZINC000124695443 945319987 /nfs/dbraw/zinc/31/99/87/945319987.db2.gz ZSZPUTNXRCYZIN-CHWSQXEVSA-N 0 0 366.483 3.766 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H]1CCCO[C@@H]1c1ccc(C)cc1 ZINC000427369911 945320837 /nfs/dbraw/zinc/32/08/37/945320837.db2.gz LTPKYJTVJPGSSM-IEBWSBKVSA-N 0 0 370.405 3.562 20 5 FHBDRN COC(=O)c1ccc(OCc2cccc(OC(C)(C)C)n2)cc1[N+](=O)[O-] ZINC000613109365 940451878 /nfs/dbraw/zinc/45/18/78/940451878.db2.gz FRNKAMUDTDEMPY-UHFFFAOYSA-N 0 0 360.366 3.533 20 5 FHBDRN COC(=O)c1ccc(OCc2csc(-c3ccco3)n2)cc1[N+](=O)[O-] ZINC000613110498 940452560 /nfs/dbraw/zinc/45/25/60/940452560.db2.gz PJVBYHCILZPFAU-UHFFFAOYSA-N 0 0 360.347 3.677 20 5 FHBDRN CC[C@@H]1CN(c2ccccc2)CCN1c1ncnc2ccc([N+](=O)[O-])cc21 ZINC000613114162 940457194 /nfs/dbraw/zinc/45/71/94/940457194.db2.gz HJCPOFQTCCGLIH-OAHLLOKOSA-N 0 0 363.421 3.643 20 5 FHBDRN COc1cc(-c2nc(-c3ccc4c(c3)CCO4)no2)cc([N+](=O)[O-])c1C ZINC000580124954 940461883 /nfs/dbraw/zinc/46/18/83/940461883.db2.gz KSFAFSHCVOMINM-UHFFFAOYSA-N 0 0 353.334 3.564 20 5 FHBDRN CCc1nc(CN(C)C(=O)c2c([N+](=O)[O-])cccc2C(F)(F)F)cs1 ZINC000580127444 940463133 /nfs/dbraw/zinc/46/31/33/940463133.db2.gz MDRPKKHJTQMFLH-UHFFFAOYSA-N 0 0 373.356 3.905 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CN[C@H](C)c1nc2ccc(Cl)cc2n1C ZINC000180094268 940467980 /nfs/dbraw/zinc/46/79/80/940467980.db2.gz UKVBYNBQYFCVOQ-LLVKDONJSA-N 0 0 374.828 3.994 20 5 FHBDRN C[C@@H](C(=O)NCCc1nc2ccccc2s1)c1cccc([N+](=O)[O-])c1 ZINC000580147390 940469064 /nfs/dbraw/zinc/46/90/64/940469064.db2.gz IUBVJUNKRZCXJE-GFCCVEGCSA-N 0 0 355.419 3.667 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CCCc3ccc(F)cc32)c1 ZINC000548997289 940469770 /nfs/dbraw/zinc/46/97/70/940469770.db2.gz XZILUXBJUKNFOD-QGZVFWFLSA-N 0 0 358.369 3.940 20 5 FHBDRN Cc1cc(Br)ccc1-c1noc(-c2ccc([N+](=O)[O-])cn2)n1 ZINC000580274412 940471548 /nfs/dbraw/zinc/47/15/48/940471548.db2.gz GFQRMQOIXKHNNI-UHFFFAOYSA-N 0 0 361.155 3.778 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1-c1nc(CC(=O)Nc2ccc(Cl)cc2)no1 ZINC000580360528 940473928 /nfs/dbraw/zinc/47/39/28/940473928.db2.gz XNVDOAQZOWHADK-UHFFFAOYSA-N 0 0 372.768 3.788 20 5 FHBDRN C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)N(C)Cc1ccc(F)cc1 ZINC000003542034 940475673 /nfs/dbraw/zinc/47/56/73/940475673.db2.gz KNWXKBWWEYSWRD-NSHDSACASA-N 0 0 365.792 3.846 20 5 FHBDRN CC[C@@]1(CNC(=O)Nc2cccc([N+](=O)[O-])c2C)OCCc2ccccc21 ZINC000580499800 940477219 /nfs/dbraw/zinc/47/72/19/940477219.db2.gz MIPXFRHVTVYNGY-FQEVSTJZSA-N 0 0 369.421 3.903 20 5 FHBDRN CC(C)n1cc(NC(=O)c2ccc(N3CCC[C@H](C)C3)c([N+](=O)[O-])c2)cn1 ZINC000066389860 940478094 /nfs/dbraw/zinc/47/80/94/940478094.db2.gz FPINFYWTEGECET-AWEZNQCLSA-N 0 0 371.441 3.861 20 5 FHBDRN COc1ccc(CC(=O)N2Cc3cc(C)ccc3CC2(C)C)cc1[N+](=O)[O-] ZINC000580593236 940480148 /nfs/dbraw/zinc/48/01/48/940480148.db2.gz HWLLEOGZPZLWLJ-UHFFFAOYSA-N 0 0 368.433 3.818 20 5 FHBDRN CO[C@@H]1CCC[C@H](C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2C)C1 ZINC000511444610 940480406 /nfs/dbraw/zinc/48/04/06/940480406.db2.gz KYNZTGSIBBTUHG-CMPLNLGQSA-N 0 0 371.231 3.809 20 5 FHBDRN CO[C@H]1CCC[C@H](C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2C)C1 ZINC000511444611 940480459 /nfs/dbraw/zinc/48/04/59/940480459.db2.gz KYNZTGSIBBTUHG-JQWIXIFHSA-N 0 0 371.231 3.809 20 5 FHBDRN CCc1csc(NC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])n1 ZINC000580672678 940481822 /nfs/dbraw/zinc/48/18/22/940481822.db2.gz NNANPXNSLJBWLM-UHFFFAOYSA-N 0 0 355.803 3.675 20 5 FHBDRN Cc1nsc(C)c1C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000511448371 940481848 /nfs/dbraw/zinc/48/18/48/940481848.db2.gz XEXVTWJSTVLGAV-UHFFFAOYSA-N 0 0 370.228 3.991 20 5 FHBDRN Cc1cc(NC(=O)[C@@H]2CC[C@@H](C(F)(F)F)C2)c2cc([N+](=O)[O-])ccc2n1 ZINC000580673552 940481967 /nfs/dbraw/zinc/48/19/67/940481967.db2.gz YGWMTMXGYJKIJJ-GHMZBOCLSA-N 0 0 367.327 3.790 20 5 FHBDRN O=C(N[C@H]1CCCc2occc21)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000431763714 940482254 /nfs/dbraw/zinc/48/22/54/940482254.db2.gz CPCPUFQLJBONTC-ZDUSSCGKSA-N 0 0 365.183 3.758 20 5 FHBDRN Cc1ccccc1[C@@H](C(=O)[O-])[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000580726592 940482915 /nfs/dbraw/zinc/48/29/15/940482915.db2.gz XCWMZCWWCJYDRQ-LPHOPBHVSA-N 0 0 354.406 3.909 20 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FHBDRN CCCn1ncc(NC(=O)Nc2cc([N+](=O)[O-])ccc2OC)c1C1CC1 ZINC000454140415 945326433 /nfs/dbraw/zinc/32/64/33/945326433.db2.gz WAEJXEGWWAUZGW-UHFFFAOYSA-N 0 0 359.386 3.731 20 5 FHBDRN Cc1cccc(C)c1NC(=O)CNc1nc2c(cc1[N+](=O)[O-])CCCC2 ZINC000581366667 940502390 /nfs/dbraw/zinc/50/23/90/940502390.db2.gz PLECOZZZDKYPBH-UHFFFAOYSA-N 0 0 354.410 3.536 20 5 FHBDRN C[C@H](C(=O)N1CC[C@@H](Cc2ccc(F)cc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000581522940 940505746 /nfs/dbraw/zinc/50/57/46/940505746.db2.gz LDMNWGQAWSZEHZ-HOCLYGCPSA-N 0 0 356.397 3.929 20 5 FHBDRN COc1ccc2c(c1)OCC[C@@H]2NC(=O)Nc1cc([N+](=O)[O-])c(C)cc1C ZINC000613300702 940508806 /nfs/dbraw/zinc/50/88/06/940508806.db2.gz WSPHPPALZKJCQR-HNNXBMFYSA-N 0 0 371.393 3.866 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)c1cccc(Br)c1C ZINC000173012012 940509671 /nfs/dbraw/zinc/50/96/71/940509671.db2.gz GXRXHCNPCJYSNO-UHFFFAOYSA-N 0 0 365.183 3.927 20 5 FHBDRN COc1ccccc1OC[C@H](C)CNC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000581760491 940511887 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Cc1ccc([C@@H](C)NC(=O)c2ccc(-c3cc[nH]n3)s2)cc1[N+](=O)[O-] ZINC000431816021 940643169 /nfs/dbraw/zinc/64/31/69/940643169.db2.gz YJNRUUDXZNZLBP-LLVKDONJSA-N 0 0 356.407 3.846 20 5 FHBDRN COc1ccc2c(c1)[C@H](C(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)CC2 ZINC000431815576 940644482 /nfs/dbraw/zinc/64/44/82/940644482.db2.gz WKUDAPUHOWYWQA-SUMWQHHRSA-N 0 0 354.406 3.819 20 5 FHBDRN O=[N+]([O-])c1ccc2c(ccnc2N2CCC[C@H](OCC(F)(F)F)C2)c1 ZINC000582103066 940646632 /nfs/dbraw/zinc/64/66/32/940646632.db2.gz CBKUWROWMQDUCL-ZDUSSCGKSA-N 0 0 355.316 3.691 20 5 FHBDRN CCc1ccc([C@H](NCCc2nnc(C)s2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000582127956 940648818 /nfs/dbraw/zinc/64/88/18/940648818.db2.gz QPTSHHHAOVGCQG-GOSISDBHSA-N 0 0 372.450 3.832 20 5 FHBDRN CNc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(N2CCC(C)CC2)nc1 ZINC000582183132 940659169 /nfs/dbraw/zinc/65/91/69/940659169.db2.gz BCUOMJWJMNVYSL-UHFFFAOYSA-N 0 0 369.425 3.520 20 5 FHBDRN COc1ccc(OCCSCc2noc(C(C)(C)C)n2)c([N+](=O)[O-])c1 ZINC000173781834 940667772 /nfs/dbraw/zinc/66/77/72/940667772.db2.gz IJIBMRGBGAWDJM-UHFFFAOYSA-N 0 0 367.427 3.596 20 5 FHBDRN CCS[C@H]1CCC[C@H]1NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000178109136 940678730 /nfs/dbraw/zinc/67/87/30/940678730.db2.gz KEMJAIKQRAEQTM-WBVHZDCISA-N 0 0 363.483 3.599 20 5 FHBDRN CCc1ccc(C[NH2+]Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)s1 ZINC000237146748 945340620 /nfs/dbraw/zinc/34/06/20/945340620.db2.gz PJDZLBXJNOSZCU-UHFFFAOYSA-N 0 0 356.451 3.909 20 5 FHBDRN O=[N+]([O-])c1cnccc1N1CCN(c2c(Cl)cccc2Cl)CC1 ZINC000613433374 940703907 /nfs/dbraw/zinc/70/39/07/940703907.db2.gz RAQVHGDOGPKALS-UHFFFAOYSA-N 0 0 353.209 3.623 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)OCc2ccc(F)c(F)c2)cc1SC ZINC000728650151 940709591 /nfs/dbraw/zinc/70/95/91/940709591.db2.gz DFAUCCZRNRWMNC-UHFFFAOYSA-N 0 0 369.345 3.961 20 5 FHBDRN C/C=C\c1ccc(NC(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)cc1 ZINC000582566885 940737910 /nfs/dbraw/zinc/73/79/10/940737910.db2.gz RPXNVQHSMUNTGZ-RQOWECAXSA-N 0 0 367.405 3.717 20 5 FHBDRN CSc1ccc(C(=O)N2CCN(C)c3cc(F)ccc32)cc1[N+](=O)[O-] ZINC000174441723 940738115 /nfs/dbraw/zinc/73/81/15/940738115.db2.gz GGSHYFDAFCPFBZ-UHFFFAOYSA-N 0 0 361.398 3.552 20 5 FHBDRN COc1cc(CN2CCC[C@@H](CC(=O)OC(C)(C)C)C2)ccc1[N+](=O)[O-] ZINC000540907719 940743912 /nfs/dbraw/zinc/74/39/12/940743912.db2.gz LPEQLMCEUWXUIM-AWEZNQCLSA-N 0 0 364.442 3.547 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCC(c3nnco3)CC2)nc1-c1ccc(F)cc1 ZINC000582607936 940751565 /nfs/dbraw/zinc/75/15/65/940751565.db2.gz APUNNYWJNHSQSU-UHFFFAOYSA-N 0 0 369.356 3.563 20 5 FHBDRN Cn1ccc2c1cccc2NC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000540910631 940755822 /nfs/dbraw/zinc/75/58/22/940755822.db2.gz RGABUYZKNNCTIC-UHFFFAOYSA-N 0 0 361.304 3.940 20 5 FHBDRN CC(C)[C@@H]1C[C@]([NH2+]Cc2cccc([N+](=O)[O-])c2)(C(=O)[O-])c2ccccc21 ZINC000582621654 940757361 /nfs/dbraw/zinc/75/73/61/940757361.db2.gz OBMGICPJRQPHAP-FXAWDEMLSA-N 0 0 354.406 3.808 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])c1nnc(Cc2ccsc2)n1C1CC1 ZINC000582613088 940759527 /nfs/dbraw/zinc/75/95/27/940759527.db2.gz JKBSXTGHJKEMPP-UHFFFAOYSA-N 0 0 369.450 3.810 20 5 FHBDRN COc1cccc(C2(c3noc(-c4cc([N+](=O)[O-])cnc4C)n3)CCC2)c1 ZINC000582633419 940767228 /nfs/dbraw/zinc/76/72/28/940767228.db2.gz RWFMMYFTUHMDMY-UHFFFAOYSA-N 0 0 366.377 3.827 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)OCc2nc3ccccc3o2)cc1SC ZINC000728651670 940776722 /nfs/dbraw/zinc/77/67/22/940776722.db2.gz WWQMJDPEZJJCSV-UHFFFAOYSA-N 0 0 374.374 3.824 20 5 FHBDRN C[C@H](c1ccc(F)cc1)N1CC[C@@H](Sc2ncccc2[N+](=O)[O-])C1=O ZINC000292783550 940785648 /nfs/dbraw/zinc/78/56/48/940785648.db2.gz YSQBKFRCUUJTQG-IAQYHMDHSA-N 0 0 361.398 3.583 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCN(c2nccc(C(C)C)n2)CC1 ZINC000613498661 940787316 /nfs/dbraw/zinc/78/73/16/940787316.db2.gz RTSUWNDIFNCHSZ-INIZCTEOSA-N 0 0 369.469 3.700 20 5 FHBDRN O=C1CCCc2ccc(NCc3nc(-c4ccc([N+](=O)[O-])cc4)no3)cc21 ZINC000175152782 940817804 /nfs/dbraw/zinc/81/78/04/940817804.db2.gz SQZJRRJZEYXFCY-UHFFFAOYSA-N 0 0 364.361 3.776 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1cccc(CN2CCCC2=O)c1 ZINC000170817116 940830496 /nfs/dbraw/zinc/83/04/96/940830496.db2.gz GLJYUBAQQNPNAO-UHFFFAOYSA-N 0 0 367.405 3.586 20 5 FHBDRN O=C(Nc1c(F)cc(Br)cc1F)c1csc([N+](=O)[O-])c1 ZINC000175246626 940836199 /nfs/dbraw/zinc/83/61/99/940836199.db2.gz SSLJMDUBZAVEKE-UHFFFAOYSA-N 0 0 363.139 3.949 20 5 FHBDRN Cc1cc(NCc2nnc(C3CC3)o2)c(Br)cc1[N+](=O)[O-] ZINC000278802963 940862125 /nfs/dbraw/zinc/86/21/25/940862125.db2.gz RKPZOMVKJBAKOD-UHFFFAOYSA-N 0 0 353.176 3.538 20 5 FHBDRN O=C(NCCc1ccccc1F)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000120126057 940874392 /nfs/dbraw/zinc/87/43/92/940874392.db2.gz RBYCNROYFBGECQ-UHFFFAOYSA-N 0 0 357.385 3.651 20 5 FHBDRN CC(C)(C)[C@H](NC(=O)C(=O)Nc1cc(F)cc([N+](=O)[O-])c1)c1ccccc1 ZINC000472571127 940874922 /nfs/dbraw/zinc/87/49/22/940874922.db2.gz XRXHUFMIFJDXBG-MRXNPFEDSA-N 0 0 373.384 3.576 20 5 FHBDRN O=C(Cc1cccc([N+](=O)[O-])c1)Nc1c(F)cccc1Br ZINC000175520465 940883125 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FHBDRN CCC(CC)(OC)c1noc(-c2ccc(N3CCCC3)c([N+](=O)[O-])c2)n1 ZINC000582934567 940949230 /nfs/dbraw/zinc/94/92/30/940949230.db2.gz BFNDHRFWJXGIGF-UHFFFAOYSA-N 0 0 360.414 3.907 20 5 FHBDRN CCc1cnc(NC(=O)c2ccc(Br)cc2[N+](=O)[O-])s1 ZINC000176019012 940968030 /nfs/dbraw/zinc/96/80/30/940968030.db2.gz PYSHPDBVOAIQCH-UHFFFAOYSA-N 0 0 356.201 3.629 20 5 FHBDRN COc1ccc(C[C@H](C)C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)cc1OC ZINC000180328343 940973157 /nfs/dbraw/zinc/97/31/57/940973157.db2.gz LWKZGEZUSMENRY-ZDUSSCGKSA-N 0 0 358.394 3.738 20 5 FHBDRN O=C(c1ccc(Br)c([N+](=O)[O-])c1)N1C[C@H]2CCCC[C@@H]2C1 ZINC000176092607 940983078 /nfs/dbraw/zinc/98/30/78/940983078.db2.gz GHJCOHDWQLGFKM-VXGBXAGGSA-N 0 0 353.216 3.620 20 5 FHBDRN C[C@H]([NH2+]CC(=O)Nc1cccc(C(F)(F)F)c1)c1cccc([N+](=O)[O-])c1 ZINC000180453428 941021817 /nfs/dbraw/zinc/02/18/17/941021817.db2.gz NPHATSJWQZVTFV-NSHDSACASA-N 0 0 367.327 3.903 20 5 FHBDRN CCc1cc(NC(=O)[C@H](C)n2nc(C)cc2C)c2cc([N+](=O)[O-])ccc2n1 ZINC000180504378 941034999 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FHBDRN CC(=O)Nc1ccc(C)c(C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1 ZINC000188961019 941134007 /nfs/dbraw/zinc/13/40/07/941134007.db2.gz LJDWZQSANZABCF-UHFFFAOYSA-N 0 0 367.405 3.666 20 5 FHBDRN CCOCc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)c1 ZINC000181378612 941141142 /nfs/dbraw/zinc/14/11/42/941141142.db2.gz QFBMSYBTNWDAOY-UHFFFAOYSA-N 0 0 366.320 3.985 20 5 FHBDRN CCSc1cc(CNC(=O)c2ccc([N+](=O)[O-])cc2Cl)ccn1 ZINC000189097671 941145489 /nfs/dbraw/zinc/14/54/89/941145489.db2.gz FZJMFXLTAPESIN-UHFFFAOYSA-N 0 0 351.815 3.685 20 5 FHBDRN Cc1cnc([C@@H](C)NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)s1 ZINC000177911973 941152881 /nfs/dbraw/zinc/15/28/81/941152881.db2.gz IECXEOKJCWHGAA-SNVBAGLBSA-N 0 0 374.447 3.974 20 5 FHBDRN COc1ccc(Cn2ccc(NCc3ccc([N+](=O)[O-])cc3C)n2)cc1 ZINC000189264021 941154406 /nfs/dbraw/zinc/15/44/06/941154406.db2.gz KLILFSYBVQEVBI-UHFFFAOYSA-N 0 0 352.394 3.769 20 5 FHBDRN Cc1ccc(NS(=O)(=O)c2ccc(CC(F)(F)F)cc2)cc1[N+](=O)[O-] ZINC000189224375 941154952 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3.672 20 5 FHBDRN CCOC1CC(CCNC(=O)c2cc([N+](=O)[O-])ccc2SCC)C1 ZINC000189423303 941157355 /nfs/dbraw/zinc/15/73/55/941157355.db2.gz QLRAQWNSFLEKNO-UHFFFAOYSA-N 0 0 352.456 3.642 20 5 FHBDRN COC[C@@H](Cc1ccccc1)N(C)C(=O)c1ccc(SC)c([N+](=O)[O-])c1 ZINC000189466515 941158551 /nfs/dbraw/zinc/15/85/51/941158551.db2.gz CHEFVRYIBUQGMD-MRXNPFEDSA-N 0 0 374.462 3.646 20 5 FHBDRN CC[C@](C)(O)CN(Cc1ccccc1)C(=O)c1cc([N+](=O)[O-])c(C)s1 ZINC000189506461 941159306 /nfs/dbraw/zinc/15/93/06/941159306.db2.gz KUNDWJNUACXRLT-SFHVURJKSA-N 0 0 362.451 3.768 20 5 FHBDRN COc1ccc2[nH]c(C(=O)N(Cc3ccccc3[N+](=O)[O-])C3CC3)cc2c1 ZINC000189522270 941159543 /nfs/dbraw/zinc/15/95/43/941159543.db2.gz SWOBVKUCINABKY-UHFFFAOYSA-N 0 0 365.389 3.890 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCC(C)(C)O1 ZINC000189608866 941221495 /nfs/dbraw/zinc/22/14/95/941221495.db2.gz SAIBKYAPKYMVNJ-ZDUSSCGKSA-N 0 0 352.456 3.783 20 5 FHBDRN C[C@H](Nc1ccc(C(=O)Nc2ccncc2)cc1[N+](=O)[O-])c1ccccn1 ZINC000053140204 941234957 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CN(Cc1ccccc1[N+](=O)[O-])C(=O)Cc1cccc(OC(F)(F)F)c1 ZINC000178582435 941280790 /nfs/dbraw/zinc/28/07/90/941280790.db2.gz HTYZQXVNUZHXPA-UHFFFAOYSA-N 0 0 368.311 3.695 20 5 FHBDRN Cc1c(CC(=O)Nc2ccc(OC[C@H]3CCCO3)cc2)cccc1[N+](=O)[O-] ZINC000178596036 941284838 /nfs/dbraw/zinc/28/48/38/941284838.db2.gz KPKDKDBREPGDRY-GOSISDBHSA-N 0 0 370.405 3.642 20 5 FHBDRN Cc1cc(-n2cccn2)ccc1N[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000189827660 941285829 /nfs/dbraw/zinc/28/58/29/941285829.db2.gz JHFULDLCARDSKE-CQSZACIVSA-N 0 0 365.393 3.528 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1N1CC[C@H](C2CCOCC2)C1 ZINC000407989218 941286555 /nfs/dbraw/zinc/28/65/55/941286555.db2.gz GIVGWEWMTXEMOK-LBPRGKRZSA-N 0 0 355.232 3.610 20 5 FHBDRN CO[C@@H](C)CNC(=O)c1cc([N+](=O)[O-])ccc1SCC1CCCC1 ZINC000189845006 941288263 /nfs/dbraw/zinc/28/82/63/941288263.db2.gz XASVXPOHQVAMPU-LBPRGKRZSA-N 0 0 352.456 3.642 20 5 FHBDRN O=C(Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1)c1cc2sccc2[nH]1 ZINC000189891705 941294413 /nfs/dbraw/zinc/29/44/13/941294413.db2.gz CBGAZIWGRMHMOI-UHFFFAOYSA-N 0 0 353.363 3.780 20 5 FHBDRN C[C@H]1C[C@@H]1N(c1ccccc1)S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000414473033 941298467 /nfs/dbraw/zinc/29/84/67/941298467.db2.gz PRJBCPUZRQIMFE-NHYWBVRUSA-N 0 0 366.826 3.852 20 5 FHBDRN CCCN(c1cccc([N+](=O)[O-])c1)S(=O)(=O)CCc1cccc(F)c1 ZINC001211646404 941305638 /nfs/dbraw/zinc/30/56/38/941305638.db2.gz SOQKJQJCSXDIRD-UHFFFAOYSA-N 0 0 366.414 3.523 20 5 FHBDRN CCCN1CCN(C(=O)c2ccc([N+](=O)[O-])c(OC)c2)c2cc(F)ccc21 ZINC000189966990 941317054 /nfs/dbraw/zinc/31/70/54/941317054.db2.gz NMQSGWGPUKWJEA-UHFFFAOYSA-N 0 0 373.384 3.619 20 5 FHBDRN O=C(Nc1scnc1-c1ccccc1)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000181488825 941335834 /nfs/dbraw/zinc/33/58/34/941335834.db2.gz OMMQLDONBFZCKY-UHFFFAOYSA-N 0 0 369.358 3.699 20 5 FHBDRN O=C(c1n[nH]c2ccc([N+](=O)[O-])cc21)N(Cc1c(F)cccc1F)C1CC1 ZINC000190012950 941342363 /nfs/dbraw/zinc/34/23/63/941342363.db2.gz RJHSTSYKFAOFAG-UHFFFAOYSA-N 0 0 372.331 3.554 20 5 FHBDRN CC[C@@](C)(NC(=O)Nc1ccc(OC)c([N+](=O)[O-])c1)c1nc(C)cs1 ZINC000541103434 941345209 /nfs/dbraw/zinc/34/52/09/941345209.db2.gz YIIWWQLQRFWZSP-MRXNPFEDSA-N 0 0 364.427 3.815 20 5 FHBDRN Cc1c(Br)cc(C(=O)N2CCSCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000190018225 941345890 /nfs/dbraw/zinc/34/58/90/941345890.db2.gz DWARVKXCQTVINT-VIFPVBQESA-N 0 0 373.272 3.633 20 5 FHBDRN C[C@H](NC(=O)c1cccc(NC(=O)[C@H]2C[C@@H]2C)c1)c1ccc([N+](=O)[O-])cc1 ZINC000452183344 941366675 /nfs/dbraw/zinc/36/66/75/941366675.db2.gz ORXLUEXUGGZWIM-LXIYXOSZSA-N 0 0 367.405 3.680 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@H](C)Oc2ccc(Cl)cc21 ZINC000072530987 941367966 /nfs/dbraw/zinc/36/79/66/941367966.db2.gz AZYUZVVMSABAFJ-JTQLQIEISA-N 0 0 362.769 3.685 20 5 FHBDRN COc1cc(C(=O)N(C)c2ccc(F)c(Cl)c2)cc([N+](=O)[O-])c1C ZINC000190025115 941367999 /nfs/dbraw/zinc/36/79/99/941367999.db2.gz FJGVZXMWKMVYLJ-UHFFFAOYSA-N 0 0 352.749 3.981 20 5 FHBDRN CC(C)c1ccc(CNc2cccc(O[C@H]3CC(=O)N3)c2)cc1[N+](=O)[O-] ZINC000414554540 941378314 /nfs/dbraw/zinc/37/83/14/941378314.db2.gz SKAKFEHVERVRGQ-IBGZPJMESA-N 0 0 355.394 3.555 20 5 FHBDRN C[C@H](NC(=O)N1CCC(F)(c2cccnc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000376715244 941387924 /nfs/dbraw/zinc/38/79/24/941387924.db2.gz ITWKAGSWHWJSEF-AWEZNQCLSA-N 0 0 372.400 3.721 20 5 FHBDRN COCCSc1ccc([C@@H](C)NC(=O)c2ccccc2[N+](=O)[O-])cc1 ZINC000103406060 941392754 /nfs/dbraw/zinc/39/27/54/941392754.db2.gz XYLAATYZMVHICF-CYBMUJFWSA-N 0 0 360.435 3.824 20 5 FHBDRN COCCSc1ccc([C@H](C)NC(=O)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000103406011 941392831 /nfs/dbraw/zinc/39/28/31/941392831.db2.gz TYPWRYQTZYKLIU-AWEZNQCLSA-N 0 0 374.462 3.753 20 5 FHBDRN C[N@H+](CCCC(=O)[O-])Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000414638306 941422005 /nfs/dbraw/zinc/42/20/05/941422005.db2.gz NVEHXWKUKYDPGD-UHFFFAOYSA-N 0 0 352.774 3.805 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])c2cccnc12)N1CC[C@@H](c2ccc(F)cc2)C1 ZINC000376821646 941438699 /nfs/dbraw/zinc/43/86/99/941438699.db2.gz FXVBCTVEXMUSJH-CQSZACIVSA-N 0 0 365.364 3.912 20 5 FHBDRN COc1ccc([C@H](C)NC(=O)c2c(Cl)cccc2[N+](=O)[O-])cc1F ZINC000110182887 941449415 /nfs/dbraw/zinc/44/94/15/941449415.db2.gz XSLKHHLYOMWQQU-VIFPVBQESA-N 0 0 352.749 3.887 20 5 FHBDRN CC(C)CCC[C@@H](C)NC(=O)COC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000008070335 941465546 /nfs/dbraw/zinc/46/55/46/941465546.db2.gz GSHQPBAFKZWHJC-GFCCVEGCSA-N 0 0 370.833 3.736 20 5 FHBDRN Cc1cccc([C@@H]2CCCN2C(=O)COc2ccc([N+](=O)[O-])c(C)c2)c1 ZINC000431837870 941481901 /nfs/dbraw/zinc/48/19/01/941481901.db2.gz YSQZZSKOYBIFSW-IBGZPJMESA-N 0 0 354.406 3.954 20 5 FHBDRN COc1ccc(CCNC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)c(Cl)c1 ZINC000472655542 941497050 /nfs/dbraw/zinc/49/70/50/941497050.db2.gz KMROHEFFMBZFSZ-UHFFFAOYSA-N 0 0 373.796 3.711 20 5 FHBDRN CCOc1cc(NC(=O)C2(c3ccccc3)CCOCC2)ccc1[N+](=O)[O-] ZINC000892748339 941510267 /nfs/dbraw/zinc/51/02/67/941510267.db2.gz XFDQGTWWIKCOPN-UHFFFAOYSA-N 0 0 370.405 3.680 20 5 FHBDRN O=C(NCCNc1ccc([N+](=O)[O-])cc1)Nc1c(F)cccc1Cl ZINC000549141629 941513980 /nfs/dbraw/zinc/51/39/80/941513980.db2.gz SKTVKPHSBUSLNO-UHFFFAOYSA-N 0 0 352.753 3.621 20 5 FHBDRN CC[C@H](NC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)c1nc2ccccc2[nH]1 ZINC000066766573 941515658 /nfs/dbraw/zinc/51/56/58/941515658.db2.gz BDFJKZLREVUSCJ-LBPRGKRZSA-N 0 0 363.377 3.834 20 5 FHBDRN O=C(c1n[nH]c2ccc([N+](=O)[O-])cc21)N1CCC[C@H](c2ccccc2)CC1 ZINC000066763924 941515956 /nfs/dbraw/zinc/51/59/56/941515956.db2.gz RMLYHQRYVNCBSW-HNNXBMFYSA-N 0 0 364.405 3.881 20 5 FHBDRN CC(=O)c1ccc([N+](=O)[O-])cc1N[C@@H]1CCN(C(C)=O)c2ccccc21 ZINC000377175316 941541801 /nfs/dbraw/zinc/54/18/01/941541801.db2.gz LPOCYOCGKMBFPQ-QGZVFWFLSA-N 0 0 353.378 3.707 20 5 FHBDRN Cc1cc(NC(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)nc(C(C)C)n1 ZINC000415017832 941543764 /nfs/dbraw/zinc/54/37/64/941543764.db2.gz AOOWMMJFQKPMNR-UHFFFAOYSA-N 0 0 358.398 3.856 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCCC[C@H]1c1cccc(Cl)c1 ZINC000377200325 941554491 /nfs/dbraw/zinc/55/44/91/941554491.db2.gz XVABWGLYLAGYHD-HNNXBMFYSA-N 0 0 362.817 3.507 20 5 FHBDRN Cc1cc(N2CCC[C@H](c3cc[nH]n3)C2)c(Br)cc1[N+](=O)[O-] ZINC000302658945 941557298 /nfs/dbraw/zinc/55/72/98/941557298.db2.gz HWJQFOSDMPYVFY-NSHDSACASA-N 0 0 365.231 3.773 20 5 FHBDRN Cc1cccc(C2(NS(=O)(=O)Cc3ccccc3[N+](=O)[O-])CCCC2)c1 ZINC000545356327 941563162 /nfs/dbraw/zinc/56/31/62/941563162.db2.gz VNAQVNPBNPZZND-UHFFFAOYSA-N 0 0 374.462 3.792 20 5 FHBDRN CCn1ccnc1[C@@H]1CCCCN1C(=O)/C=C/c1cccc([N+](=O)[O-])c1 ZINC000377220096 941575225 /nfs/dbraw/zinc/57/52/25/941575225.db2.gz DGWRRKVCEBEPOK-FVNWOWOISA-N 0 0 354.410 3.578 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)Nc1cc(-c2ccccc2)on1 ZINC000085605220 941608784 /nfs/dbraw/zinc/60/87/84/941608784.db2.gz BFEVRBWMAXQZHA-UHFFFAOYSA-N 0 0 352.350 3.914 20 5 FHBDRN CCCO[C@@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)CC1 ZINC000412061558 941617741 /nfs/dbraw/zinc/61/77/41/941617741.db2.gz AWRXYHPVQBBUHN-MRXNPFEDSA-N 0 0 364.442 3.803 20 5 FHBDRN CO[C@@H]1CCC[C@@H](C(=O)N(Cc2ccccc2[N+](=O)[O-])CC(F)(F)F)C1 ZINC000565555153 941617853 /nfs/dbraw/zinc/61/78/53/941617853.db2.gz KQMCJFDRCQEVHE-TZMCWYRMSA-N 0 0 374.359 3.691 20 5 FHBDRN Cc1nc(-c2ccccc2)sc1CNC(=O)c1ccc(N)c([N+](=O)[O-])c1 ZINC000066782424 941619940 /nfs/dbraw/zinc/61/99/40/941619940.db2.gz AANLOCVQQQOUGO-UHFFFAOYSA-N 0 0 368.418 3.539 20 5 FHBDRN CCC[C@H](Cc1ccccc1)N(CCC)C(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC001143491407 941626746 /nfs/dbraw/zinc/62/67/46/941626746.db2.gz MSQRNGPJPBXDPK-QGZVFWFLSA-N 0 0 371.437 3.959 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc2ccn(C)c2c1 ZINC000549207640 941647255 /nfs/dbraw/zinc/64/72/55/941647255.db2.gz DBTCPFKVBASHMC-UHFFFAOYSA-N 0 0 352.394 3.793 20 5 FHBDRN COC(=O)C1(Nc2cc(C)c(Br)cc2[N+](=O)[O-])CCCC1 ZINC001167715723 941649272 /nfs/dbraw/zinc/64/92/72/941649272.db2.gz FPOPZYKGEYJQIA-UHFFFAOYSA-N 0 0 357.204 3.563 20 5 FHBDRN O=[N+]([O-])c1ccc(C(F)(F)c2nc(COc3ccccc3F)no2)cc1 ZINC000436019935 941651379 /nfs/dbraw/zinc/65/13/79/941651379.db2.gz YBUKAIIXSUHYEM-UHFFFAOYSA-N 0 0 365.267 3.836 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](C)c2ccc(OC)c(F)c2)c1 ZINC000549211205 941652960 /nfs/dbraw/zinc/65/29/60/941652960.db2.gz OOFHOMLPNVDQQL-NSHDSACASA-N 0 0 362.357 3.632 20 5 FHBDRN Cn1cc([N+](=O)[O-])cc1C(=O)Nc1nc(-c2ccc3c(c2)CCC3)cs1 ZINC000024465201 941660193 /nfs/dbraw/zinc/66/01/93/941660193.db2.gz VCKFTEPMGYLWRU-UHFFFAOYSA-N 0 0 368.418 3.798 20 5 FHBDRN Cc1cc(C(=O)N[C@H](C)CC(C)(C)c2ccccc2)c(N)c([N+](=O)[O-])c1 ZINC000729284814 941708882 /nfs/dbraw/zinc/70/88/82/941708882.db2.gz NPVBIQYMQUOHNP-CQSZACIVSA-N 0 0 355.438 3.972 20 5 FHBDRN Nc1ccc([N+](=O)[O-])cc1-c1noc([C@H]2CCCN2c2ccccc2)n1 ZINC000377420403 941709072 /nfs/dbraw/zinc/70/90/72/941709072.db2.gz OGBWTUIYSRDGNT-MRXNPFEDSA-N 0 0 351.366 3.569 20 5 FHBDRN COc1ccc(NC(=O)c2[nH]c(C)c(C(C)=O)c2C(C)C)cc1[N+](=O)[O-] ZINC000541143935 941712159 /nfs/dbraw/zinc/71/21/59/941712159.db2.gz OFXKLYLPRQELKU-UHFFFAOYSA-N 0 0 359.382 3.818 20 5 FHBDRN CC(C)(C)O[C@@H]1C[C@H](NCc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1(C)C ZINC000412088080 941714362 /nfs/dbraw/zinc/71/43/62/941714362.db2.gz XITISQZQDBJACZ-LSDHHAIUSA-N 0 0 374.441 3.717 20 5 FHBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1C[C@@H](C)Sc2ccccc21 ZINC000469079072 941716885 /nfs/dbraw/zinc/71/68/85/941716885.db2.gz VUPDTESTTQWVKF-LLVKDONJSA-N 0 0 364.448 3.593 20 5 FHBDRN O=[N+]([O-])C[C@H](Oc1ccc(Br)c(Cl)c1)c1cccnc1 ZINC001225444329 941717462 /nfs/dbraw/zinc/71/74/62/941717462.db2.gz MSCJNKPZHGZTKF-ZDUSSCGKSA-N 0 0 357.591 3.894 20 5 FHBDRN C[C@H]1CCSCCN1C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000190056118 941725281 /nfs/dbraw/zinc/72/52/81/941725281.db2.gz VDGRNMYXAGWJBT-NSHDSACASA-N 0 0 363.464 3.686 20 5 FHBDRN O=[N+]([O-])c1cccc(CN2CCN(c3nc4ccccc4s3)CC2)c1 ZINC000052915413 941728538 /nfs/dbraw/zinc/72/85/38/941728538.db2.gz OAWMIGKBMQJMKB-UHFFFAOYSA-N 0 0 354.435 3.527 20 5 FHBDRN CC[C@@H](OC)c1noc([C@H]2Cc3cc([N+](=O)[O-])ccc3N3CCCC[C@H]23)n1 ZINC000377457831 941738267 /nfs/dbraw/zinc/73/82/67/941738267.db2.gz CMYNRAGFZVQHEG-USXIJHARSA-N 0 0 372.425 3.774 20 5 FHBDRN CC[C@H](OC)c1noc([C@H]2Cc3cc([N+](=O)[O-])ccc3N3CCCC[C@H]23)n1 ZINC000377457830 941738471 /nfs/dbraw/zinc/73/84/71/941738471.db2.gz CMYNRAGFZVQHEG-UAGQMJEPSA-N 0 0 372.425 3.774 20 5 FHBDRN CC(=O)c1ccccc1OCCSCCOc1ccc([N+](=O)[O-])cc1 ZINC000518146772 941756356 /nfs/dbraw/zinc/75/63/56/941756356.db2.gz ICNCBZLQIXHBNI-UHFFFAOYSA-N 0 0 361.419 3.988 20 5 FHBDRN CN(C(=O)c1ccc([N+](=O)[O-])cc1Br)c1cc(F)ccc1F ZINC000151151854 941764088 /nfs/dbraw/zinc/76/40/88/941764088.db2.gz JFSTUTOXLCFISA-UHFFFAOYSA-N 0 0 371.137 3.912 20 5 FHBDRN CCOCCC1(CNC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)CCCC1 ZINC000472781433 941765705 /nfs/dbraw/zinc/76/57/05/941765705.db2.gz BOCPIPUIIGXCPI-UHFFFAOYSA-N 0 0 359.426 3.793 20 5 FHBDRN CN(C(=O)c1csc(-c2ncccc2F)n1)c1cccc([N+](=O)[O-])c1 ZINC000513173712 941765830 /nfs/dbraw/zinc/76/58/30/941765830.db2.gz LTXHSZAVEPNRMB-UHFFFAOYSA-N 0 0 358.354 3.529 20 5 FHBDRN O=[N+]([O-])c1ccc(NC[C@@H](O)COc2ccc(C(F)(F)F)cc2)c(F)c1 ZINC000513173407 941766153 /nfs/dbraw/zinc/76/61/53/941766153.db2.gz JHSJYOAAFVNXAS-GFCCVEGCSA-N 0 0 374.290 3.605 20 5 FHBDRN O=C(c1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCc2ccc(F)cc2C1 ZINC000433574880 941776569 /nfs/dbraw/zinc/77/65/69/941776569.db2.gz PUKFSZMDULEQKW-UHFFFAOYSA-N 0 0 368.286 3.951 20 5 FHBDRN C[C@@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)c1n[nH]cc1[N+](=O)[O-] ZINC000122505148 941785899 /nfs/dbraw/zinc/78/58/99/941785899.db2.gz GOOOIWGOQGZZKO-ZDUSSCGKSA-N 0 0 350.378 3.818 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)c1nc2c(s1)CCC2 ZINC000415390116 941794755 /nfs/dbraw/zinc/79/47/55/941794755.db2.gz GRCMDRYIIMZNEY-UHFFFAOYSA-N 0 0 357.313 3.811 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2cc(-c3ccsc3)nn2C)c1 ZINC000549272065 941810231 /nfs/dbraw/zinc/81/02/31/941810231.db2.gz YKNNHIIXJOLVQU-UHFFFAOYSA-N 0 0 372.406 3.708 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2noc(N3CCC(OCC4CCCC4)CC3)n2)cc1 ZINC000433635419 941813747 /nfs/dbraw/zinc/81/37/47/941813747.db2.gz KNAPGOYEINTURB-UHFFFAOYSA-N 0 0 372.425 3.820 20 5 FHBDRN Cc1cc(NCc2nccn2CCCc2ccccc2)ncc1[N+](=O)[O-] ZINC000433647051 941820757 /nfs/dbraw/zinc/82/07/57/941820757.db2.gz BKUBMWVIODYPLW-UHFFFAOYSA-N 0 0 351.410 3.740 20 5 FHBDRN Nc1ccc(SCc2cc([N+](=O)[O-])cc3c2OCOC3)c(Cl)c1 ZINC000513277079 941826366 /nfs/dbraw/zinc/82/63/66/941826366.db2.gz MOTDPTGGDYRURS-UHFFFAOYSA-N 0 0 352.799 3.989 20 5 FHBDRN COc1cc2c(cc1F)CC[C@H]2NC(=O)C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000513285948 941829736 /nfs/dbraw/zinc/82/97/36/941829736.db2.gz GTVRVVXMVOSQNX-MRXNPFEDSA-N 0 0 372.396 3.824 20 5 FHBDRN CCN(Cc1cccc(Cl)c1)C(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-] ZINC000433677441 941830180 /nfs/dbraw/zinc/83/01/80/941830180.db2.gz AEFWXKMNXQJFRG-UHFFFAOYSA-N 0 0 350.806 3.757 20 5 FHBDRN CC(C)(C)[C@H]1OCCC[C@@H]1CNC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412133889 941831158 /nfs/dbraw/zinc/83/11/58/941831158.db2.gz ZFBHDRBUQPHADU-SPUZQDLCSA-N 0 0 360.454 3.656 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N[C@H](c2ccc(Cl)cc2)C2CC2)c1[N+](=O)[O-] ZINC000433682832 941832679 /nfs/dbraw/zinc/83/26/79/941832679.db2.gz AKDUHQJYFTXENI-AWEZNQCLSA-N 0 0 362.817 3.976 20 5 FHBDRN CC1(C)CC(Nc2nc(C3CC3)nc(Cl)c2[N+](=O)[O-])CC(C)(C)N1O ZINC001167719443 941839980 /nfs/dbraw/zinc/83/99/80/941839980.db2.gz MHIHZEQDPSWBOJ-UHFFFAOYSA-N 0 0 369.853 3.738 20 5 FHBDRN Cc1ccc(NCCCNC(=O)[C@@H]2CC[C@@H](C(F)(F)F)C2)c([N+](=O)[O-])c1 ZINC000513312233 941840197 /nfs/dbraw/zinc/84/01/97/941840197.db2.gz MQUOIKMPRCHQOY-CHWSQXEVSA-N 0 0 373.375 3.800 20 5 FHBDRN O=C(NC[C@@H]1CCO[C@@H]1c1ccccc1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412142607 941840997 /nfs/dbraw/zinc/84/09/97/941840997.db2.gz YEWQZNIBTJTHRJ-IJXRJRJASA-N 0 0 366.417 3.592 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)c1cnc2c(F)cccc2c1 ZINC000513298510 941842366 /nfs/dbraw/zinc/84/23/66/941842366.db2.gz LZIHXKVDFSSCKF-UHFFFAOYSA-N 0 0 353.353 3.597 20 5 FHBDRN Cn1ccnc1[C@H]1CCN(c2c3cc(Cl)ccc3ncc2[N+](=O)[O-])C1 ZINC000892984681 941842759 /nfs/dbraw/zinc/84/27/59/941842759.db2.gz FLOGCKSLNAIIFH-NSHDSACASA-N 0 0 357.801 3.524 20 5 FHBDRN CCO[C@H]1C[C@H](NC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)C12CCCC2 ZINC000412149529 941845843 /nfs/dbraw/zinc/84/58/43/941845843.db2.gz JUOIYFLKZCKDSS-MHORFTMASA-N 0 0 358.438 3.552 20 5 FHBDRN CO[C@H](C(=O)Nc1ccc(OCc2ccccc2)cc1[N+](=O)[O-])C1CC1 ZINC000415484708 941850121 /nfs/dbraw/zinc/85/01/21/941850121.db2.gz IEXVFJKKFCPCSJ-SFHVURJKSA-N 0 0 356.378 3.537 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2cccc3c2OC(C)(C)C3)c1 ZINC000549290166 941853224 /nfs/dbraw/zinc/85/32/24/941853224.db2.gz NPSOVBHUJSKICN-UHFFFAOYSA-N 0 0 356.378 3.959 20 5 FHBDRN C[C@H](c1ccccc1[N+](=O)[O-])N1CCCN(C(=O)c2ccccc2)CC1 ZINC000433722015 941855479 /nfs/dbraw/zinc/85/54/79/941855479.db2.gz APUWUIKBBJWCLV-MRXNPFEDSA-N 0 0 353.422 3.504 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCc1cccc2c1CCCN2 ZINC000415490383 941856991 /nfs/dbraw/zinc/85/69/91/941856991.db2.gz YFPOHVJIYCUCKC-UHFFFAOYSA-N 0 0 354.410 3.891 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CCC(c2cccc(N)c2)CC1 ZINC000415498234 941859940 /nfs/dbraw/zinc/85/99/40/941859940.db2.gz IQIWCFIFFUPQQJ-UHFFFAOYSA-N 0 0 354.410 3.897 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N[C@@H](C)c2ccc(F)c(C)c2)c1F ZINC000412178282 941860592 /nfs/dbraw/zinc/86/05/92/941860592.db2.gz MYCDIISPRPEXQX-NSHDSACASA-N 0 0 364.348 3.610 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)CCC(=O)c1ccc(Cl)cc1 ZINC000513349082 941860613 /nfs/dbraw/zinc/86/06/13/941860613.db2.gz RPICCKIKDLXTQD-UHFFFAOYSA-N 0 0 374.824 3.912 20 5 FHBDRN CCOc1cc(NC[C@](C)(C(=O)OC)c2ccccc2)ccc1[N+](=O)[O-] ZINC000468608497 941861161 /nfs/dbraw/zinc/86/11/61/941861161.db2.gz NDAVMUCTCMUVIB-IBGZPJMESA-N 0 0 358.394 3.536 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CCCc3c(F)ccc(F)c32)c1 ZINC000549293806 941862990 /nfs/dbraw/zinc/86/29/90/941862990.db2.gz MCUFGCSFKRYYPF-UHFFFAOYSA-N 0 0 362.332 3.865 20 5 FHBDRN CCOc1cc(C)ccc1CNC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412174883 941864004 /nfs/dbraw/zinc/86/40/04/941864004.db2.gz PXWAUEWUEQAQLY-ZWKOTPCHSA-N 0 0 354.406 3.722 20 5 FHBDRN C[C@@H](CC(=O)N(C)CCc1cccc([N+](=O)[O-])c1)C(=O)c1cccc(F)c1 ZINC000513343050 941864506 /nfs/dbraw/zinc/86/45/06/941864506.db2.gz MANILLIDDICHOK-AWEZNQCLSA-N 0 0 372.396 3.644 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2nc3cc(C)ccc3n2CC)c1 ZINC000549295082 941866143 /nfs/dbraw/zinc/86/61/43/941866143.db2.gz SNKCNHJDQWXJIA-UHFFFAOYSA-N 0 0 368.393 3.924 20 5 FHBDRN C[C@@H]1CCC[C@@H](c2nc(-c3ccc(-n4cncn4)c([N+](=O)[O-])c3)no2)C1 ZINC000453204693 941867127 /nfs/dbraw/zinc/86/71/27/941867127.db2.gz WFWHJMZFHMJUKH-DGCLKSJQSA-N 0 0 354.370 3.519 20 5 FHBDRN Cc1cn([C@H](C)c2ccccc2)[nH]c1=NC(=O)c1cccc(C)c1[N+](=O)[O-] ZINC000472824554 941880481 /nfs/dbraw/zinc/88/04/81/941880481.db2.gz LYAQNOSFSSFJFV-OAHLLOKOSA-N 0 0 364.405 3.692 20 5 FHBDRN Cc1c(NC(=O)[C@@H](C)Cc2cnc3ccccc3n2)cccc1[N+](=O)[O-] ZINC000549300308 941882995 /nfs/dbraw/zinc/88/29/95/941882995.db2.gz QXMSGTOGJRXHJF-LBPRGKRZSA-N 0 0 350.378 3.664 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)[C@H](C)Cc1cnc2ccccc2n1 ZINC000549299287 941885362 /nfs/dbraw/zinc/88/53/62/941885362.db2.gz GEVXFJKORMIQBZ-CQSZACIVSA-N 0 0 364.405 3.972 20 5 FHBDRN COCCC1(CNC(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)CCCC1 ZINC000412189618 941888250 /nfs/dbraw/zinc/88/82/50/941888250.db2.gz VFHAZVVBGHTWJK-UHFFFAOYSA-N 0 0 364.442 3.709 20 5 FHBDRN O=C(CSc1ccccc1[N+](=O)[O-])N1CC[C@H](Cc2ccc(F)cc2)C1 ZINC000119540997 941890434 /nfs/dbraw/zinc/89/04/34/941890434.db2.gz TXLOEZPGENIUMA-OAHLLOKOSA-N 0 0 374.437 3.917 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CC[C@@H](c3ccccc3)C2)c(F)c1N1CCOCC1 ZINC000565224068 941890826 /nfs/dbraw/zinc/89/08/26/941890826.db2.gz ZGZWDWUCXSYKGZ-MRXNPFEDSA-N 0 0 371.412 3.564 20 5 FHBDRN CC(C)N(CC(=O)Nc1c(F)cccc1F)Cc1ccc([N+](=O)[O-])cc1 ZINC000513386135 941893136 /nfs/dbraw/zinc/89/31/36/941893136.db2.gz GRYVHWYFQJULLO-UHFFFAOYSA-N 0 0 363.364 3.722 20 5 FHBDRN CC(C)(C)OC(=O)CCCCCNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000182370218 941896327 /nfs/dbraw/zinc/89/63/27/941896327.db2.gz ZFPQMFMPPFFEJD-UHFFFAOYSA-N 0 0 370.833 3.880 20 5 FHBDRN CCO[C@@H]1C[C@H](N(C)C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)C12CCC2 ZINC000412195465 941898043 /nfs/dbraw/zinc/89/80/43/941898043.db2.gz PUGHEXZOPNITEG-XWTMOSNGSA-N 0 0 358.438 3.504 20 5 FHBDRN Cn1cnc([N+](=O)[O-])c1N1CC2(CCC2)c2cc(Br)ccc21 ZINC000433789715 941898049 /nfs/dbraw/zinc/89/80/49/941898049.db2.gz PRCJXDBPLXSICU-UHFFFAOYSA-N 0 0 363.215 3.664 20 5 FHBDRN CC(C)N(CC(=O)Nc1ccc2c(c1)CCC2)Cc1ccc([N+](=O)[O-])cc1 ZINC000513406297 941900345 /nfs/dbraw/zinc/90/03/45/941900345.db2.gz PGHUPBDSRABZCA-UHFFFAOYSA-N 0 0 367.449 3.933 20 5 FHBDRN Cc1ccc(NC(=O)Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)c(C)c1 ZINC000103463511 941901581 /nfs/dbraw/zinc/90/15/81/941901581.db2.gz ARCRWFVCVUWRNP-UHFFFAOYSA-N 0 0 350.378 3.714 20 5 FHBDRN Cn1ccnc1C(=O)c1ccc(NC2CCC3(CC3)CC2)c([N+](=O)[O-])c1 ZINC000433807189 941903317 /nfs/dbraw/zinc/90/33/17/941903317.db2.gz DKMFEBDUPJSCQP-UHFFFAOYSA-N 0 0 354.410 3.694 20 5 FHBDRN CSC[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1 ZINC000517518665 941915916 /nfs/dbraw/zinc/91/59/16/941915916.db2.gz QXFBVOADIMPZJD-LBPRGKRZSA-N 0 0 358.419 3.763 20 5 FHBDRN O=C(Nc1ccc(O[C@@H]2CCCC[C@H]2O)cc1)Nc1ccc([N+](=O)[O-])cc1 ZINC000513430562 941917985 /nfs/dbraw/zinc/91/79/85/941917985.db2.gz VMPIYTJACVQADD-QZTJIDSGSA-N 0 0 371.393 3.921 20 5 FHBDRN Cc1ccc(F)c(-c2cc(NC(=O)c3ccc([N+](=O)[O-])cc3F)n[nH]2)c1 ZINC000190093847 941925109 /nfs/dbraw/zinc/92/51/09/941925109.db2.gz GIOBDDPOSYYSHL-UHFFFAOYSA-N 0 0 358.304 3.824 20 5 FHBDRN Cc1ncc(-c2ccc(NC(=O)c3n[nH]c(C(C)C)c3[N+](=O)[O-])cc2)o1 ZINC000433830159 941925823 /nfs/dbraw/zinc/92/58/23/941925823.db2.gz VUYYGPPMAYUUOO-UHFFFAOYSA-N 0 0 355.354 3.657 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)NCCc2ccc3ccccc3c2)c1[N+](=O)[O-] ZINC000433831299 941926489 /nfs/dbraw/zinc/92/64/89/941926489.db2.gz CNXREGJFEJJELJ-UHFFFAOYSA-N 0 0 352.394 3.567 20 5 FHBDRN Cc1c(C(=O)N[C@H]2CCO[C@@H]2c2ccc(Cl)cc2)cccc1[N+](=O)[O-] ZINC000182460935 941927157 /nfs/dbraw/zinc/92/71/57/941927157.db2.gz QQMABALSXXMTOF-DOTOQJQBSA-N 0 0 360.797 3.817 20 5 FHBDRN COc1cc(CSc2ccccn2)c([N+](=O)[O-])cc1OCC(F)F ZINC000182392609 941927353 /nfs/dbraw/zinc/92/73/53/941927353.db2.gz ANWDTZACWVKUBH-UHFFFAOYSA-N 0 0 356.350 3.935 20 5 FHBDRN COc1ccc2ccccc2c1-c1cc(Cn2cc([N+](=O)[O-])c(C)n2)on1 ZINC000181836054 941927398 /nfs/dbraw/zinc/92/73/98/941927398.db2.gz RZOYSMARCZZEPO-UHFFFAOYSA-N 0 0 364.361 3.965 20 5 FHBDRN COc1cc(F)c(NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)cc1F ZINC000182388952 941927493 /nfs/dbraw/zinc/92/74/93/941927493.db2.gz YRKYEOHGHQZVGO-UHFFFAOYSA-N 0 0 374.246 3.735 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)NCCC1C[C@H](C)O[C@@H](C)C1 ZINC000549316027 941929781 /nfs/dbraw/zinc/92/97/81/941929781.db2.gz DKTNFKIALSFPFX-RYUDHWBXSA-N 0 0 354.834 3.880 20 5 FHBDRN CC(C)c1csc(CNC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)n1 ZINC000182468445 941932135 /nfs/dbraw/zinc/93/21/35/941932135.db2.gz QEFPEKSHKNJANB-UHFFFAOYSA-N 0 0 371.365 3.706 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)c1cc(=O)[nH]c2c(F)cc(C)cc12 ZINC000182492744 941934325 /nfs/dbraw/zinc/93/43/25/941934325.db2.gz HNVTXGSWHZBPFS-UHFFFAOYSA-N 0 0 371.324 3.557 20 5 FHBDRN Cc1ccc(SC[C@@H](C)NC(=O)NCc2ccccc2[N+](=O)[O-])cc1 ZINC000472847315 941935674 /nfs/dbraw/zinc/93/56/74/941935674.db2.gz IXSUGSOJSHXITD-CQSZACIVSA-N 0 0 359.451 3.883 20 5 FHBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])[C@H]1C[C@@]1(F)c1ccccc1 ZINC000412242652 941953634 /nfs/dbraw/zinc/95/36/34/941953634.db2.gz MZTVGFAMSHLFEP-CRAIPNDOSA-N 0 0 362.788 3.792 20 5 FHBDRN CCN(Cc1nc2ccccc2c(=O)[nH]1)[C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000182636662 941956493 /nfs/dbraw/zinc/95/64/93/941956493.db2.gz ANEQLPIVYNNFFQ-CQSZACIVSA-N 0 0 366.421 3.723 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N[C@@H](C)c2c(C)cccc2C)c1F ZINC000412245340 941956713 /nfs/dbraw/zinc/95/67/13/941956713.db2.gz HXGBQOHWPJYCNN-ZDUSSCGKSA-N 0 0 360.385 3.779 20 5 FHBDRN CC[C@H](C)[C@@H](C)C(=O)N[C@@H](CC(=O)OC(C)C)c1ccccc1[N+](=O)[O-] ZINC000182774339 941959352 /nfs/dbraw/zinc/95/93/52/941959352.db2.gz DVDJJJIYVHGLIF-LZWOXQAQSA-N 0 0 364.442 3.776 20 5 FHBDRN Cc1cc(NC(=O)N2C[C@@H](C)O[C@@H](c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000182765100 941966346 /nfs/dbraw/zinc/96/63/46/941966346.db2.gz IJECKKOFEAGIML-RDTXWAMCSA-N 0 0 355.394 3.897 20 5 FHBDRN COc1c(C(=O)N2CC[C@H](C(F)(F)F)C3(CCC3)C2)cccc1[N+](=O)[O-] ZINC000513501122 941974165 /nfs/dbraw/zinc/97/41/65/941974165.db2.gz QXOYJZLLOJXGKV-ZDUSSCGKSA-N 0 0 372.343 3.798 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2noc(C[NH2+][C@@H](Cc3ccccc3)C3CC3)n2)cc1 ZINC000181553748 941979627 /nfs/dbraw/zinc/97/96/27/941979627.db2.gz ODZWCKJRUWNIJY-SFHVURJKSA-N 0 0 364.405 3.756 20 5 FHBDRN CCCN(C(=O)c1ccc([N+](=O)[O-])cc1C)[C@H](C)C(=O)Nc1ccccc1 ZINC000101516540 941980256 /nfs/dbraw/zinc/98/02/56/941980256.db2.gz SYNGPFHRCCOHML-OAHLLOKOSA-N 0 0 369.421 3.783 20 5 FHBDRN Cc1cc(C(=O)N2CC[C@@H](Oc3cccc(Cl)c3)C2)cc([N+](=O)[O-])c1 ZINC000536250389 941985717 /nfs/dbraw/zinc/98/57/17/941985717.db2.gz PNWWVEMZXIKBAX-QGZVFWFLSA-N 0 0 360.797 3.850 20 5 FHBDRN CCCc1nc(C)c(NC(=O)Cc2c(F)c(OC)ccc2[N+](=O)[O-])s1 ZINC000412258678 941988446 /nfs/dbraw/zinc/98/84/46/941988446.db2.gz KLRVRWXUUIXJOB-UHFFFAOYSA-N 0 0 367.402 3.641 20 5 FHBDRN Cc1cc(Br)c(O)c(NC(=O)c2csc([N+](=O)[O-])c2)c1 ZINC000182903435 941992490 /nfs/dbraw/zinc/99/24/90/941992490.db2.gz DAHRRJGZOIMWEW-UHFFFAOYSA-N 0 0 357.185 3.685 20 5 FHBDRN CC(=O)c1cc(N[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)ccc1C ZINC000584537704 941995419 /nfs/dbraw/zinc/99/54/19/941995419.db2.gz QYMUYKDXQJWBLD-CYBMUJFWSA-N 0 0 355.394 3.853 20 5 FHBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)N1CC[C@H](CC(F)(F)F)C1 ZINC000433923300 941998746 /nfs/dbraw/zinc/99/87/46/941998746.db2.gz YKGVAMCMEZWKFU-CQSZACIVSA-N 0 0 373.375 3.901 20 5 FHBDRN CCc1nc(C(C)C)ccc1Cn1c(=O)onc1-c1ccc([N+](=O)[O-])cc1 ZINC000549337087 941999416 /nfs/dbraw/zinc/99/94/16/941999416.db2.gz SVIOSZZADAMZSM-UHFFFAOYSA-N 0 0 368.393 3.541 20 5 FHBDRN CCOc1cccc(CCNC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000433929336 942002126 /nfs/dbraw/zinc/00/21/26/942002126.db2.gz DVJWDFRIMHFCAP-UHFFFAOYSA-N 0 0 371.437 3.771 20 5 FHBDRN COc1cc(C(=O)Nc2ccc(-n3ccnc3)c(Cl)c2)ccc1[N+](=O)[O-] ZINC000101665760 942003535 /nfs/dbraw/zinc/00/35/35/942003535.db2.gz CLZCMLTXONHSPK-UHFFFAOYSA-N 0 0 372.768 3.695 20 5 FHBDRN CSc1cccc(N(C)C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)c1 ZINC000101832665 942017846 /nfs/dbraw/zinc/01/78/46/942017846.db2.gz ZMJNCONWXHMNKI-UHFFFAOYSA-N 0 0 368.418 3.779 20 5 FHBDRN CN(C(=O)Nc1cccc([N+](=O)[O-])c1Cl)[C@@H]1CCCc2c1cnn2C ZINC000377827411 942018123 /nfs/dbraw/zinc/01/81/23/942018123.db2.gz WIELQHOYJMXTHX-GFCCVEGCSA-N 0 0 363.805 3.523 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CC[C@@H](c2c(F)cccc2F)C1 ZINC000412274193 942022105 /nfs/dbraw/zinc/02/21/05/942022105.db2.gz RPKKZYPFCSMSSW-VNQPRFMTSA-N 0 0 372.371 3.993 20 5 FHBDRN COc1ccc(Cl)cc1NC(=O)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000513578483 942022286 /nfs/dbraw/zinc/02/22/86/942022286.db2.gz OTVSHKPBUMRSQP-UHFFFAOYSA-N 0 0 363.801 3.963 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N2CCC[C@@H]2CCc2ccccc2)c1[N+](=O)[O-] ZINC000433985179 942024481 /nfs/dbraw/zinc/02/44/81/942024481.db2.gz UHPUGBRLNSJSJO-OAHLLOKOSA-N 0 0 356.426 3.679 20 5 FHBDRN Cc1cc(NC(=O)Nc2cc([N+](=O)[O-])ccc2C)nn1C1CCCCC1 ZINC000517580640 942024765 /nfs/dbraw/zinc/02/47/65/942024765.db2.gz AQEWVNJYHNIQKO-UHFFFAOYSA-N 0 0 357.414 3.979 20 5 FHBDRN C[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000182963267 942029865 /nfs/dbraw/zinc/02/98/65/942029865.db2.gz MDOLVNTWPFCWTO-GYSYKLTISA-N 0 0 354.353 3.989 20 5 FHBDRN CCOC(=O)c1ccnc(N[C@@H]2CCO[C@H](C(CC)CC)C2)c1[N+](=O)[O-] ZINC000182969736 942032276 /nfs/dbraw/zinc/03/22/76/942032276.db2.gz PDHYNYCDYADTES-HIFRSBDPSA-N 0 0 365.430 3.562 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C[C@H]1CCOC1)c1ccccc1 ZINC000158999981 942036776 /nfs/dbraw/zinc/03/67/76/942036776.db2.gz CMICBUURRKOPMT-BEFAXECRSA-N 0 0 354.406 3.801 20 5 FHBDRN C[Si](C)(C)c1ccc(CC(=O)Nc2ccc([N+](=O)[O-])c(Cl)c2)cc1 ZINC001125863556 942036783 /nfs/dbraw/zinc/03/67/83/942036783.db2.gz AQRPERKVWTURHH-UHFFFAOYSA-N 0 0 362.889 3.975 20 5 FHBDRN CCN(C(=O)CCn1nc(C)c([N+](=O)[O-])c1C)C12CC3CC(CC(C3)C1)C2 ZINC000102216656 942045917 /nfs/dbraw/zinc/04/59/17/942045917.db2.gz VJPWTPHXOCVAPE-UHFFFAOYSA-N 0 0 374.485 3.616 20 5 FHBDRN CN(CC(=O)N1CCC(F)(c2ccccc2)CC1)c1ccccc1[N+](=O)[O-] ZINC000434032330 942046707 /nfs/dbraw/zinc/04/67/07/942046707.db2.gz RBIXYIPUUNBEKU-UHFFFAOYSA-N 0 0 371.412 3.518 20 5 FHBDRN C[C@@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)c1cc([N+](=O)[O-])n[nH]1 ZINC000513634184 942047701 /nfs/dbraw/zinc/04/77/01/942047701.db2.gz XGFWAFLPFWNLHT-ZDUSSCGKSA-N 0 0 350.378 3.818 20 5 FHBDRN Cc1c(CC(=O)N2CCC(F)(c3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000434026495 942053861 /nfs/dbraw/zinc/05/38/61/942053861.db2.gz FRXIDVLXZYNMDA-UHFFFAOYSA-N 0 0 356.397 3.933 20 5 FHBDRN CC(C)(C)c1nnc(NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)s1 ZINC000513653460 942057132 /nfs/dbraw/zinc/05/71/32/942057132.db2.gz RLZQUXVEBDWULM-UHFFFAOYSA-N 0 0 372.353 3.598 20 5 FHBDRN Cc1cccc(CCN[C@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)c1 ZINC000513654024 942057642 /nfs/dbraw/zinc/05/76/42/942057642.db2.gz GVRKVEXBTFNQIW-IBGZPJMESA-N 0 0 350.422 3.558 20 5 FHBDRN COc1cc(C)ccc1NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513675768 942069175 /nfs/dbraw/zinc/06/91/75/942069175.db2.gz WDYYQHLQCSCWAN-UHFFFAOYSA-N 0 0 352.293 3.766 20 5 FHBDRN Cc1c(NC(=O)NCc2cccc(OCC(F)F)c2)cccc1[N+](=O)[O-] ZINC000102524367 942070794 /nfs/dbraw/zinc/07/07/94/942070794.db2.gz IRPAXIRBBUFYAX-UHFFFAOYSA-N 0 0 365.336 3.869 20 5 FHBDRN C[C@H](NC(=O)COc1ccc(F)cc1[N+](=O)[O-])c1ccccc1Cl ZINC000102600012 942072340 /nfs/dbraw/zinc/07/23/40/942072340.db2.gz CZJMPSXLYYHGJG-JTQLQIEISA-N 0 0 352.749 3.644 20 5 FHBDRN C[C@@H](NC(=O)COc1ccc(F)cc1[N+](=O)[O-])c1ccccc1Cl ZINC000102600015 942072702 /nfs/dbraw/zinc/07/27/02/942072702.db2.gz CZJMPSXLYYHGJG-SNVBAGLBSA-N 0 0 352.749 3.644 20 5 FHBDRN COc1ccc(NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)cc1F ZINC000513685648 942075610 /nfs/dbraw/zinc/07/56/10/942075610.db2.gz PUTNEJCPQRJWSV-UHFFFAOYSA-N 0 0 356.256 3.596 20 5 FHBDRN CON1CCC(c2noc(-c3cc4cc([N+](=O)[O-])ccc4s3)n2)CC1 ZINC000420517639 942077240 /nfs/dbraw/zinc/07/72/40/942077240.db2.gz TYSWPMKKGHKBJF-UHFFFAOYSA-N 0 0 360.395 3.600 20 5 FHBDRN CC(=O)c1ccc2c(c1)CCN(c1nc3ccccc3cc1[N+](=O)[O-])CC2 ZINC000473534695 942078635 /nfs/dbraw/zinc/07/86/35/942078635.db2.gz VSBMKAAHKACPKQ-UHFFFAOYSA-N 0 0 361.401 3.951 20 5 FHBDRN Cc1cccc(O)c1NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000183076222 942080284 /nfs/dbraw/zinc/08/02/84/942080284.db2.gz KWGHLTAEKUZSAL-UHFFFAOYSA-N 0 0 355.375 3.985 20 5 FHBDRN O=C(Nc1ccc2c(c1)CCN2)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000415842838 942082056 /nfs/dbraw/zinc/08/20/56/942082056.db2.gz RBIFJQQUGVJQIP-UHFFFAOYSA-N 0 0 352.394 3.759 20 5 FHBDRN C[C@H]1COCC[C@@H]1c1noc(-c2ccnc(-c3ccccc3)c2[N+](=O)[O-])n1 ZINC000420503736 942086152 /nfs/dbraw/zinc/08/61/52/942086152.db2.gz LZMJSUCLQSNJPS-JSGCOSHPSA-N 0 0 366.377 3.847 20 5 FHBDRN COc1ccc(NC(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cc1N ZINC000415857768 942091226 /nfs/dbraw/zinc/09/12/26/942091226.db2.gz RVJJKEVYHNEJEI-AWEZNQCLSA-N 0 0 370.409 3.597 20 5 FHBDRN C[C@@H](C1CCCCC1)N(C)S(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC001211650899 942092608 /nfs/dbraw/zinc/09/26/08/942092608.db2.gz BUUVDFBCFZCFSX-NSHDSACASA-N 0 0 360.863 3.838 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N[C@H](C)c1ccc2c(c1)CCC(=O)N2 ZINC001125864197 942095288 /nfs/dbraw/zinc/09/52/88/942095288.db2.gz MGTJHZBUIWHENW-CYBMUJFWSA-N 0 0 367.405 3.587 20 5 FHBDRN COc1c(O)ccc(CN[C@H]2CC3(CCC3)Oc3ccccc32)c1[N+](=O)[O-] ZINC000893133412 942095412 /nfs/dbraw/zinc/09/54/12/942095412.db2.gz DNVDZZDXZYOOGS-HNNXBMFYSA-N 0 0 370.405 3.845 20 5 FHBDRN Cc1cnc(C(C)(C)NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)s1 ZINC000183087662 942096407 /nfs/dbraw/zinc/09/64/07/942096407.db2.gz ZRXKWFJJMCWIFA-UHFFFAOYSA-N 0 0 371.365 3.626 20 5 FHBDRN CO[C@@H]1CCC[C@@H](CC(=O)N(C)Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000280083011 942098720 /nfs/dbraw/zinc/09/87/20/942098720.db2.gz YNEWQOHFGKBAFX-IUODEOHRSA-N 0 0 354.834 3.802 20 5 FHBDRN Cc1cc(Nc2ccc3c(c2)CN(CC(F)(F)F)C3)ncc1[N+](=O)[O-] ZINC000413365912 942099756 /nfs/dbraw/zinc/09/97/56/942099756.db2.gz GTNUXHSLXOTNJN-UHFFFAOYSA-N 0 0 352.316 3.920 20 5 FHBDRN COc1ccc(COC(=O)c2nc(-c3ccccc3)[nH]c2C)cc1[N+](=O)[O-] ZINC000728726594 942101089 /nfs/dbraw/zinc/10/10/89/942101089.db2.gz YPZLORUKJGWAOE-UHFFFAOYSA-N 0 0 367.361 3.659 20 5 FHBDRN Cc1cc([N+](=O)[O-])cnc1Nc1ccc2c(c1)CN(CC(F)(F)F)C2 ZINC000413377196 942113675 /nfs/dbraw/zinc/11/36/75/942113675.db2.gz WIPDJLLFOUKQRF-UHFFFAOYSA-N 0 0 352.316 3.920 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CCC[C@@H]2c2ccc(Br)cn2)c(F)c1 ZINC000413378936 942114361 /nfs/dbraw/zinc/11/43/61/942114361.db2.gz QQFUOLVALQYLPM-CYBMUJFWSA-N 0 0 367.178 3.628 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])N[C@@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000163827573 942114826 /nfs/dbraw/zinc/11/48/26/942114826.db2.gz AIEBXDHZZIOGHO-YJBOKZPZSA-N 0 0 369.421 3.562 20 5 FHBDRN COC(=O)c1nc([C@@H]2CCCN2c2ccc([N+](=O)[O-])cc2F)sc1C ZINC000280160149 942120121 /nfs/dbraw/zinc/12/01/21/942120121.db2.gz CTTYVWBFZRCWCX-ZDUSSCGKSA-N 0 0 365.386 3.627 20 5 FHBDRN Cc1ccc([C@H]2OCCC[C@@H]2CNc2c(C(N)=O)cccc2[N+](=O)[O-])cc1 ZINC000420593522 942120512 /nfs/dbraw/zinc/12/05/12/942120512.db2.gz BUQFKEKWNHGZJE-DNVCBOLYSA-N 0 0 369.421 3.582 20 5 FHBDRN CC[C@@H](C)[C@@H](C)N(C(=O)Cc1c(F)c(OC)ccc1[N+](=O)[O-])C1CC1 ZINC000413372525 942122056 /nfs/dbraw/zinc/12/20/56/942122056.db2.gz OPDJJVITKROLIF-VXGBXAGGSA-N 0 0 352.406 3.711 20 5 FHBDRN CCOC(=O)c1cc(C(=O)N(c2ccccc2)[C@H]2C[C@H]2C)cc([N+](=O)[O-])c1 ZINC000415899191 942125218 /nfs/dbraw/zinc/12/52/18/942125218.db2.gz WBIRRURXACGLJJ-ACJLOTCBSA-N 0 0 368.389 3.827 20 5 FHBDRN CC(C)CC[C@H](C)Nc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCCC1 ZINC000513690733 942151875 /nfs/dbraw/zinc/15/18/75/942151875.db2.gz LNGJADMVWBIAAS-AWEZNQCLSA-N 0 0 369.487 3.616 20 5 FHBDRN C[C@@H](CCCc1cccnc1)Nc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-] ZINC000413404219 942152742 /nfs/dbraw/zinc/15/27/42/942152742.db2.gz XAJXLWMOAHYQLZ-AWEZNQCLSA-N 0 0 368.437 3.705 20 5 FHBDRN C[C@H](CCCc1cccnc1)Nc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-] ZINC000413404222 942152894 /nfs/dbraw/zinc/15/28/94/942152894.db2.gz XAJXLWMOAHYQLZ-CQSZACIVSA-N 0 0 368.437 3.705 20 5 FHBDRN O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)N1CCC[C@@H]1C1CCC1 ZINC000102953395 942153897 /nfs/dbraw/zinc/15/38/97/942153897.db2.gz XHALJCSYFXHQLN-CYBMUJFWSA-N 0 0 355.341 3.993 20 5 FHBDRN CC1(C)Oc2ccsc2[C@@H](Nc2ccc([N+](=O)[O-])c3ncccc23)[C@@H]1O ZINC000413419628 942162409 /nfs/dbraw/zinc/16/24/09/942162409.db2.gz HKQRKQZNQKZEKC-WBVHZDCISA-N 0 0 371.418 3.890 20 5 FHBDRN CCOc1ccc([C@@H]2CCCN2C(=O)c2ccc(OC)c([N+](=O)[O-])c2)cc1 ZINC000016141477 942162770 /nfs/dbraw/zinc/16/27/70/942162770.db2.gz BFBHUGHDOKJGQR-KRWDZBQOSA-N 0 0 370.405 3.979 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)N(C)c2ccc(F)cc2)cc1SC ZINC000102995525 942165908 /nfs/dbraw/zinc/16/59/08/942165908.db2.gz CMAFZMZRROYIDV-UHFFFAOYSA-N 0 0 350.371 3.741 20 5 FHBDRN O=C(NCc1ccccc1N1CCCCC1)c1ccc(F)cc1[N+](=O)[O-] ZINC000183142930 942169722 /nfs/dbraw/zinc/16/97/22/942169722.db2.gz QHWFRSUMKRXYON-UHFFFAOYSA-N 0 0 357.385 3.654 20 5 FHBDRN CN(C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2)c1cc(Cl)cc(Cl)c1 ZINC000181895488 942173409 /nfs/dbraw/zinc/17/34/09/942173409.db2.gz UHZPKACDYVEPEX-UHFFFAOYSA-N 0 0 369.160 3.907 20 5 FHBDRN O=C(NC[C@H]1CCC(F)(F)C1)c1ccc([N+](=O)[O-])cc1Br ZINC000280449766 942183072 /nfs/dbraw/zinc/18/30/72/942183072.db2.gz COVJRSLPYVBLCQ-QMMMGPOBSA-N 0 0 363.158 3.523 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1F)c1cc(-c2ccc3c(c2)CCO3)no1 ZINC000434097925 942185888 /nfs/dbraw/zinc/18/58/88/942185888.db2.gz NQUKBRIOZJJZBB-UHFFFAOYSA-N 0 0 369.308 3.576 20 5 FHBDRN CCS[C@@H]1CCCCN(S(=O)(=O)c2cc([N+](=O)[O-])cc(C)c2C)C1 ZINC000480908496 942186282 /nfs/dbraw/zinc/18/62/82/942186282.db2.gz FJJIQEYEEOITSJ-OAHLLOKOSA-N 0 0 372.512 3.508 20 5 FHBDRN CCn1ccnc1[C@@H]1CCCCN1C(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000280464803 942187379 /nfs/dbraw/zinc/18/73/79/942187379.db2.gz ASBZFRCXHPCQNS-INIZCTEOSA-N 0 0 357.414 3.879 20 5 FHBDRN COC(=O)Cc1ccc(NC(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)cc1 ZINC000502059243 942191949 /nfs/dbraw/zinc/19/19/49/942191949.db2.gz CDUJUTWEHIQSIV-UHFFFAOYSA-N 0 0 370.405 3.860 20 5 FHBDRN CN(C(=O)Cc1ccccc1[N+](=O)[O-])[C@H](c1ccccc1)C(F)(F)F ZINC000103050799 942193499 /nfs/dbraw/zinc/19/34/99/942193499.db2.gz RAUADMRZFRVHCA-MRXNPFEDSA-N 0 0 352.312 3.899 20 5 FHBDRN CCN(CCOc1ccccc1C)C(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000420782386 942195359 /nfs/dbraw/zinc/19/53/59/942195359.db2.gz QRJRYCAVNIFCFP-UHFFFAOYSA-N 0 0 357.410 3.514 20 5 FHBDRN CCn1cc(C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c(C(F)(F)F)n1 ZINC000280521902 942196197 /nfs/dbraw/zinc/19/61/97/942196197.db2.gz BDTFCCZLINOKRJ-SNVBAGLBSA-N 0 0 370.331 3.629 20 5 FHBDRN O=C(c1c(Cl)cccc1[N+](=O)[O-])N1CCCN(c2ccccc2)CC1 ZINC000110236157 942205137 /nfs/dbraw/zinc/20/51/37/942205137.db2.gz NWHAKRGGHRMFQI-UHFFFAOYSA-N 0 0 359.813 3.601 20 5 FHBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NCC1(C2CC2)CCC1 ZINC000502069314 942211528 /nfs/dbraw/zinc/21/15/28/942211528.db2.gz GAOIBOBBPDBTTJ-NSHDSACASA-N 0 0 352.818 3.712 20 5 FHBDRN CCOc1ccc(C(=O)NCCc2c[nH]c3cccc(C)c23)cc1[N+](=O)[O-] ZINC000103129975 942212732 /nfs/dbraw/zinc/21/27/32/942212732.db2.gz CZMPQIIFRGCTQQ-UHFFFAOYSA-N 0 0 367.405 3.756 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N(C)Cc2ccc(Cl)cc2)c1C ZINC000480938857 942217723 /nfs/dbraw/zinc/21/77/23/942217723.db2.gz RPDUPQXETLWSPL-UHFFFAOYSA-N 0 0 368.842 3.686 20 5 FHBDRN Cc1nn(CCC(=O)N2CCC[C@@H](C)c3ccccc32)c(C)c1[N+](=O)[O-] ZINC000183179833 942217932 /nfs/dbraw/zinc/21/79/32/942217932.db2.gz OQOHTVUPYIRYAB-CYBMUJFWSA-N 0 0 356.426 3.729 20 5 FHBDRN O=C(NC1CCC2(CCOCC2)CC1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000378054283 942220695 /nfs/dbraw/zinc/22/06/95/942220695.db2.gz WZQPOLXIOZRNRL-UHFFFAOYSA-N 0 0 352.818 3.717 20 5 FHBDRN Cc1cc([C@H]2CN(Cc3nc4cc([N+](=O)[O-])ccc4o3)CCO2)ccc1F ZINC000129368474 942222572 /nfs/dbraw/zinc/22/25/72/942222572.db2.gz HRFLCVHKKFYFLW-GOSISDBHSA-N 0 0 371.368 3.757 20 5 FHBDRN CCC(CC)[C@H]1C[C@@H](NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)CCO1 ZINC000183438282 942226222 /nfs/dbraw/zinc/22/62/22/942226222.db2.gz DVLYUQLOPFEFET-GOEBONIOSA-N 0 0 354.834 3.962 20 5 FHBDRN CCOc1ccc(C(=O)N[C@H]2CCO[C@H](C(CC)CC)C2)cc1[N+](=O)[O-] ZINC000183429780 942226402 /nfs/dbraw/zinc/22/64/02/942226402.db2.gz FGSDERSQTFKTSJ-YJBOKZPZSA-N 0 0 364.442 3.707 20 5 FHBDRN Cc1cc(CNC(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cc(C)n1 ZINC000420844946 942227324 /nfs/dbraw/zinc/22/73/24/942227324.db2.gz HNUIPQHNLNCEQI-SFHVURJKSA-N 0 0 368.437 3.696 20 5 FHBDRN CC(C)c1nn(C)cc1NC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000280674342 942228569 /nfs/dbraw/zinc/22/85/69/942228569.db2.gz FHXZKLGVDPQPIT-UHFFFAOYSA-N 0 0 357.414 3.648 20 5 FHBDRN CC[C@H]1C[C@@H](C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2C)CCO1 ZINC000280698890 942231393 /nfs/dbraw/zinc/23/13/93/942231393.db2.gz LFBKMLSGQGXUPZ-JQWIXIFHSA-N 0 0 371.231 3.809 20 5 FHBDRN COc1cc(C(=O)N2CC[C@H](Cc3ccc(F)cc3)C2)cc([N+](=O)[O-])c1C ZINC000187835942 942232974 /nfs/dbraw/zinc/23/29/74/942232974.db2.gz LLLRLFXYWOBFSH-OAHLLOKOSA-N 0 0 372.396 3.756 20 5 FHBDRN Cc1cnc(OCc2ccc(OCc3cccnc3)cc2)c([N+](=O)[O-])c1 ZINC000502129065 942235595 /nfs/dbraw/zinc/23/55/95/942235595.db2.gz WQJKDCCQQDKXOP-UHFFFAOYSA-N 0 0 351.362 3.851 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N(C)[C@@H]2CCc3ccccc32)c1C ZINC000480960698 942238498 /nfs/dbraw/zinc/23/84/98/942238498.db2.gz YDWNJUBFLAPCOU-MRXNPFEDSA-N 0 0 360.435 3.520 20 5 FHBDRN CC(C)[C@H]1CCCC[C@H]1NC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000103326279 942244302 /nfs/dbraw/zinc/24/43/02/942244302.db2.gz KPNONADDNNUHSP-TZMCWYRMSA-N 0 0 367.833 3.518 20 5 FHBDRN CCCc1ccc([C@@]2(C)NC(=O)N(Cc3ccccc3[N+](=O)[O-])C2=O)cc1 ZINC000015573131 942246560 /nfs/dbraw/zinc/24/65/60/942246560.db2.gz CEKWOYNSAQVIAG-HXUWFJFHSA-N 0 0 367.405 3.515 20 5 FHBDRN Cc1nn(Cc2ccc(C(=O)N3[C@@H](C)CCC[C@@H]3C)cc2)c(C)c1[N+](=O)[O-] ZINC000103369066 942246666 /nfs/dbraw/zinc/24/66/66/942246666.db2.gz PLHDPYBRGVPMSW-KBPBESRZSA-N 0 0 370.453 3.860 20 5 FHBDRN COc1ccc(CSCC(=O)N2[C@H](C)CCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000103367135 942246773 /nfs/dbraw/zinc/24/67/73/942246773.db2.gz HWMZWHNCIYVAIH-BETUJISGSA-N 0 0 352.456 3.626 20 5 FHBDRN CC(C)(C)C(=O)N1CCOc2ccc(Nc3ncc([N+](=O)[O-])cc3F)cc21 ZINC000413062095 942248449 /nfs/dbraw/zinc/24/84/49/942248449.db2.gz DFGPCBYRRZOSRP-UHFFFAOYSA-N 0 0 374.372 3.644 20 5 FHBDRN C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)Cc1c[nH]c2cc(F)ccc12 ZINC000103375389 942248487 /nfs/dbraw/zinc/24/84/87/942248487.db2.gz ZIUNVPGURQNBIM-LLVKDONJSA-N 0 0 353.353 3.736 20 5 FHBDRN CC(=O)c1cccc(O[C@@H](C)C(=O)N2c3ccc([N+](=O)[O-])cc3C[C@H]2C)c1 ZINC000103375433 942249156 /nfs/dbraw/zinc/24/91/56/942249156.db2.gz CQOOKWBFTZVPRK-OCCSQVGLSA-N 0 0 368.389 3.543 20 5 FHBDRN CC(C)OC1CC(SCCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)C1 ZINC000419408410 942251220 /nfs/dbraw/zinc/25/12/20/942251220.db2.gz LLGGNASSSVKTPC-UHFFFAOYSA-N 0 0 366.439 3.582 20 5 FHBDRN Cc1sc(S(=O)(=O)N2CCC[C@@H]2c2cccs2)cc1[N+](=O)[O-] ZINC000122841655 942251837 /nfs/dbraw/zinc/25/18/37/942251837.db2.gz DVQLOQQCMJLSAV-SNVBAGLBSA-N 0 0 358.466 3.552 20 5 FHBDRN Cc1cc(NC(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)ccc1C(N)=O ZINC000103409218 942251930 /nfs/dbraw/zinc/25/19/30/942251930.db2.gz KYRIPYSBUQUYKC-UHFFFAOYSA-N 0 0 355.394 3.552 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)N2C[C@H]3CCCCC[C@H]32)cc1SC ZINC000378082394 942256985 /nfs/dbraw/zinc/25/69/85/942256985.db2.gz GPVUKIOQQCRLSL-DGCLKSJQSA-N 0 0 350.440 3.730 20 5 FHBDRN Cn1c(=O)c([N+](=O)[O-])c(N2CCC[C@H](CC(F)(F)F)C2)c2ccccc21 ZINC000894243057 942258659 /nfs/dbraw/zinc/25/86/59/942258659.db2.gz CLSZNWIYENKNMS-LLVKDONJSA-N 0 0 369.343 3.616 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1N1C[C@@H](O)C[C@@H]1c1ccccc1 ZINC000413498640 942258825 /nfs/dbraw/zinc/25/88/25/942258825.db2.gz HMPYAHQFBKBSGF-DZGCQCFKSA-N 0 0 363.211 3.670 20 5 FHBDRN COCCOc1cccc(Nc2ncc([N+](=O)[O-])cc2C(F)(F)F)c1 ZINC000413075674 942260244 /nfs/dbraw/zinc/26/02/44/942260244.db2.gz UGBMIUMFTIPIRR-UHFFFAOYSA-N 0 0 357.288 3.777 20 5 FHBDRN COc1ccc(COCCC(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)cc1 ZINC000128406472 942260706 /nfs/dbraw/zinc/26/07/06/942260706.db2.gz BBXMPAUPGOYUNM-UHFFFAOYSA-N 0 0 358.394 3.766 20 5 FHBDRN Cc1cc(C)cc([C@@H](C)NC(=O)NCCNc2ccc([N+](=O)[O-])cc2)c1 ZINC000502172607 942263027 /nfs/dbraw/zinc/26/30/27/942263027.db2.gz PHLVYELIZIQUHI-OAHLLOKOSA-N 0 0 356.426 3.684 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2noc(CN3CCC[C@H](CC(F)(F)F)C3)n2)c1 ZINC000420940310 942265381 /nfs/dbraw/zinc/26/53/81/942265381.db2.gz DBJXQPQTMXMACU-LLVKDONJSA-N 0 0 370.331 3.809 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCC[C@@H](CC(F)(F)F)C1 ZINC000420951875 942272720 /nfs/dbraw/zinc/27/27/20/942272720.db2.gz RIEYPCOLPVGQQI-LBPRGKRZSA-N 0 0 359.348 3.506 20 5 FHBDRN CCOC(=O)c1csc(CSCc2c(F)cc([N+](=O)[O-])cc2F)n1 ZINC000419476613 942273198 /nfs/dbraw/zinc/27/31/98/942273198.db2.gz JQMOUEOJNFEWCZ-UHFFFAOYSA-N 0 0 374.390 3.940 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)Nc1cccc(CN2CCCCC2=O)c1 ZINC000051235863 942279557 /nfs/dbraw/zinc/27/95/57/942279557.db2.gz JOIDMOJEJAQASY-UHFFFAOYSA-N 0 0 368.393 3.751 20 5 FHBDRN O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CC[C@H](C2CC2)C1 ZINC000481022340 942280621 /nfs/dbraw/zinc/28/06/21/942280621.db2.gz YTKVRGNZYXARAF-LBPRGKRZSA-N 0 0 371.359 3.674 20 5 FHBDRN Cc1nc(C(C)(C)NC(=O)Nc2ccc(C(C)(C)C)c([N+](=O)[O-])c2)no1 ZINC000501070928 942288631 /nfs/dbraw/zinc/28/86/31/942288631.db2.gz FRUXGEMWHVMIKB-UHFFFAOYSA-N 0 0 361.402 3.641 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2C[C@@H](C)Oc3cc(F)ccc32)ccc1[N+](=O)[O-] ZINC000413513745 942289967 /nfs/dbraw/zinc/28/99/67/942289967.db2.gz IPSKWKJTPPVGOZ-GFCCVEGCSA-N 0 0 374.368 3.949 20 5 FHBDRN CC(C)(NS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1)c1cccc(Cl)c1 ZINC000159070279 942291563 /nfs/dbraw/zinc/29/15/63/942291563.db2.gz WNIUELNPHAIITM-UHFFFAOYSA-N 0 0 368.842 3.603 20 5 FHBDRN CCOc1cc(Cl)ccc1CNC(=O)c1ccc(OC)c([N+](=O)[O-])c1 ZINC000501087522 942291858 /nfs/dbraw/zinc/29/18/58/942291858.db2.gz CLEDGWBGYUPANP-UHFFFAOYSA-N 0 0 364.785 3.586 20 5 FHBDRN COc1ccc(CCNC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc1 ZINC000103594474 942296005 /nfs/dbraw/zinc/29/60/05/942296005.db2.gz HYAWVDQPQBUYKU-UHFFFAOYSA-N 0 0 371.437 3.766 20 5 FHBDRN C[C@H]1CCN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)C[C@H](C)C1 ZINC000502217215 942296173 /nfs/dbraw/zinc/29/61/73/942296173.db2.gz CPOOSSJJWPWBSQ-WDEREUQCSA-N 0 0 355.232 3.866 20 5 FHBDRN CCN(C(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-])c1ccccc1Cl ZINC000501080920 942299753 /nfs/dbraw/zinc/29/97/53/942299753.db2.gz WAHRPYVHHAWXNM-UHFFFAOYSA-N 0 0 364.785 3.932 20 5 FHBDRN O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1C[C@H](O)C[C@@H]1c1ccccc1 ZINC000413512909 942300272 /nfs/dbraw/zinc/30/02/72/942300272.db2.gz YABCGRCTSXWABE-UKRRQHHQSA-N 0 0 352.312 3.926 20 5 FHBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)NCc1nccs1 ZINC000136287504 942300535 /nfs/dbraw/zinc/30/05/35/942300535.db2.gz GGLKJLSVOURHSD-UHFFFAOYSA-N 0 0 351.453 3.729 20 5 FHBDRN COc1ccc2[nH]cc(CC(=O)NCc3ccc([N+](=O)[O-])cc3Cl)c2c1 ZINC000183747474 942301781 /nfs/dbraw/zinc/30/17/81/942301781.db2.gz SYPNRGZMXPOOTK-UHFFFAOYSA-N 0 0 373.796 3.597 20 5 FHBDRN C[C@@H](OC(=O)/C=C/c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1Cl ZINC000015654999 942306630 /nfs/dbraw/zinc/30/66/30/942306630.db2.gz HUZIBGOKBKEBOU-JATZPVMKSA-N 0 0 374.780 3.832 20 5 FHBDRN CO[C@H]1CCC[C@H](C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000513737147 942308425 /nfs/dbraw/zinc/30/84/25/942308425.db2.gz VLWIIFWJVLVPQN-ZANVPECISA-N 0 0 357.204 3.501 20 5 FHBDRN C[C@@H]1CN(C(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])[C@@H](C)[C@H]1C ZINC000416070319 942316530 /nfs/dbraw/zinc/31/65/30/942316530.db2.gz KVHDDVZIUFJCIE-VWYCJHECSA-N 0 0 360.332 3.652 20 5 FHBDRN CCN(Cc1cccc(-c2ccncc2)c1)C(=O)c1ccc([N+](=O)[O-])cn1 ZINC000378139007 942317594 /nfs/dbraw/zinc/31/75/94/942317594.db2.gz IVIWOCUBZIMEGJ-UHFFFAOYSA-N 0 0 362.389 3.714 20 5 FHBDRN C[C@@H](NC(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)c1ccc(C2CC2)cc1 ZINC000416071719 942318526 /nfs/dbraw/zinc/31/85/26/942318526.db2.gz XSNQADNFDDKSAH-GFCCVEGCSA-N 0 0 368.389 3.734 20 5 FHBDRN CC(C)c1ccccc1OCCC(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000501143931 942327544 /nfs/dbraw/zinc/32/75/44/942327544.db2.gz UGXYROLWELYTQH-UHFFFAOYSA-N 0 0 356.422 3.846 20 5 FHBDRN CC1(C)CN(C(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)[C@H]1[C@@H]1CCCO1 ZINC000290646810 942330332 /nfs/dbraw/zinc/33/03/32/942330332.db2.gz QPBYKXCPDZAJOT-KBPBESRZSA-N 0 0 372.343 3.643 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N(Cc1ccccc1)CC(F)F ZINC000413538190 942331134 /nfs/dbraw/zinc/33/11/34/942331134.db2.gz XQKFQFXSWKZOFL-DLBZAZTESA-N 0 0 360.360 3.992 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NC[C@H](C)Oc1ccccc1F ZINC000085637879 942332745 /nfs/dbraw/zinc/33/27/45/942332745.db2.gz RJETVUYTDZUTFF-LBPRGKRZSA-N 0 0 361.373 3.940 20 5 FHBDRN CC[C@@H](NC(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-])[C@H]1CC1(C)C ZINC000416086910 942334303 /nfs/dbraw/zinc/33/43/03/942334303.db2.gz WPCUWLHAQMDCAA-VXGBXAGGSA-N 0 0 352.456 3.880 20 5 FHBDRN CC(C)c1ccc(C(=O)N2CC[C@@H](C(=O)OC(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000188125695 942336177 /nfs/dbraw/zinc/33/61/77/942336177.db2.gz CPVTVPXCBXVRTE-CQSZACIVSA-N 0 0 362.426 3.522 20 5 FHBDRN Cc1ccccc1[C@@]1(F)CCN(C(=O)Cc2cccc([N+](=O)[O-])c2C)C1 ZINC000501183641 942336813 /nfs/dbraw/zinc/33/68/13/942336813.db2.gz AOHIHUXMKSLXAQ-HXUWFJFHSA-N 0 0 356.397 3.851 20 5 FHBDRN O=C(c1cc(C(F)(F)F)ccc1[N+](=O)[O-])N1CCSC[C@H]1C1CCC1 ZINC000416096546 942338829 /nfs/dbraw/zinc/33/88/29/942338829.db2.gz SCRZVWCKFVEFIX-AWEZNQCLSA-N 0 0 374.384 3.971 20 5 FHBDRN C[C@H](OC(=O)c1ccc([N+](=O)[O-])cc1Cl)C(=O)Nc1cccc(F)c1 ZINC000015709968 942340063 /nfs/dbraw/zinc/34/00/63/942340063.db2.gz KYDHIMHGWCNVHM-VIFPVBQESA-N 0 0 366.732 3.571 20 5 FHBDRN Cc1cc(F)cc2c1CN(C(=O)Cc1ccc([N+](=O)[O-])cc1Cl)CC2 ZINC000501188567 942343668 /nfs/dbraw/zinc/34/36/68/942343668.db2.gz QHXRPSLYQDTFSQ-UHFFFAOYSA-N 0 0 362.788 3.823 20 5 FHBDRN CCOc1cc(C(=O)NCC2CCC(F)(F)CC2)c([N+](=O)[O-])cc1OC ZINC000501188289 942343915 /nfs/dbraw/zinc/34/39/15/942343915.db2.gz PVJDYBAZXXTTMZ-UHFFFAOYSA-N 0 0 372.368 3.557 20 5 FHBDRN O=C(NC[C@H]1CC[C@@H](c2ccccc2)O1)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000584441141 942345485 /nfs/dbraw/zinc/34/54/85/942345485.db2.gz ADCIJHHTYBLBDI-SJORKVTESA-N 0 0 366.373 3.991 20 5 FHBDRN CC(C)Oc1ncccc1NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513709466 942348425 /nfs/dbraw/zinc/34/84/25/942348425.db2.gz HFUPINYZYAQTHH-UHFFFAOYSA-N 0 0 367.308 3.631 20 5 FHBDRN Cc1ccccc1[C@]1(F)CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000501221251 942350576 /nfs/dbraw/zinc/35/05/76/942350576.db2.gz IISLDZJHYZBOJN-IBGZPJMESA-N 0 0 360.360 3.682 20 5 FHBDRN CCC(CC)[C@@H]1C[C@@H](NC(=O)Nc2ccc([N+](=O)[O-])cc2OC)CCO1 ZINC000122876885 942354273 /nfs/dbraw/zinc/35/42/73/942354273.db2.gz GVKRFTGTWXNGAU-BBRMVZONSA-N 0 0 365.430 3.709 20 5 FHBDRN CC(C)Oc1cc(C(=O)NCCc2cccc3[nH]ccc32)ccc1[N+](=O)[O-] ZINC000412321784 942356304 /nfs/dbraw/zinc/35/63/04/942356304.db2.gz QERNAROTUKFFJV-UHFFFAOYSA-N 0 0 367.405 3.836 20 5 FHBDRN CC(C)(C)c1ccc(NC(=O)N2CC[C@H](O)CC23CCC3)cc1[N+](=O)[O-] ZINC000421104961 942361111 /nfs/dbraw/zinc/36/11/11/942361111.db2.gz AIHSPRFKRRCPMI-AWEZNQCLSA-N 0 0 361.442 3.804 20 5 FHBDRN CC(C)(C)c1ccc(NC(=O)N2CC[C@@H](O)CC23CCC3)cc1[N+](=O)[O-] ZINC000421104962 942361238 /nfs/dbraw/zinc/36/12/38/942361238.db2.gz AIHSPRFKRRCPMI-CQSZACIVSA-N 0 0 361.442 3.804 20 5 FHBDRN CC(C)Oc1cc(C(=O)Nc2ccc(OC(F)F)nc2)ccc1[N+](=O)[O-] ZINC000412328337 942368974 /nfs/dbraw/zinc/36/89/74/942368974.db2.gz GPZSNGCHZXCVGK-UHFFFAOYSA-N 0 0 367.308 3.631 20 5 FHBDRN C[C@H](CC(=O)NCCNc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1F ZINC000502343143 942371158 /nfs/dbraw/zinc/37/11/58/942371158.db2.gz DHWFWICTRWRSSU-GFCCVEGCSA-N 0 0 363.364 3.595 20 5 FHBDRN O=C(N[C@@H](COc1ccccc1)c1ccccc1)c1ccc([N+](=O)[O-])o1 ZINC000502346737 942373440 /nfs/dbraw/zinc/37/34/40/942373440.db2.gz QYACAADNHOSJCK-INIZCTEOSA-N 0 0 352.346 3.738 20 5 FHBDRN Cc1ccc(NC(=O)c2cc([N+](=O)[O-])cc(Br)c2C)cc1O ZINC000518801403 942382811 /nfs/dbraw/zinc/38/28/11/942382811.db2.gz NCBOPDPSKSFGMN-UHFFFAOYSA-N 0 0 365.183 3.932 20 5 FHBDRN COCc1cc(CNC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)ccc1F ZINC000502348495 942384259 /nfs/dbraw/zinc/38/42/59/942384259.db2.gz ZWXURQAXNPRWAS-UHFFFAOYSA-N 0 0 358.325 3.557 20 5 FHBDRN CCC[C@H]1C[C@@H](C(=O)Nc2cc(-c3cccc([N+](=O)[O-])c3)[nH]n2)CCO1 ZINC000183527790 942384641 /nfs/dbraw/zinc/38/46/41/942384641.db2.gz UTNNKAJNNGOHIA-ZFWWWQNUSA-N 0 0 358.398 3.519 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(C)[C@H]1CCC[C@H]1C(C)(C)C ZINC000419799485 942385407 /nfs/dbraw/zinc/38/54/07/942385407.db2.gz XGGIYJPEVOUDID-ZBFHGGJFSA-N 0 0 361.442 3.515 20 5 FHBDRN CC[C@H]1CN(c2ccc3ncc([N+](=O)[O-])n3n2)CC[C@H]1c1ccccc1 ZINC000302008797 942386558 /nfs/dbraw/zinc/38/65/58/942386558.db2.gz VKNXZSDCWQHFOC-GOEBONIOSA-N 0 0 351.410 3.658 20 5 FHBDRN CC(C)(C)OC(=O)CC[C@@H]1CCCN(c2ncc([N+](=O)[O-])cc2Cl)C1 ZINC000413586831 942394032 /nfs/dbraw/zinc/39/40/32/942394032.db2.gz DVGOCNVBHDENQA-LBPRGKRZSA-N 0 0 369.849 3.982 20 5 FHBDRN CNc1ccc(C(=O)N[C@@H]2CCSc3c(F)cccc32)cc1[N+](=O)[O-] ZINC000016300800 942398161 /nfs/dbraw/zinc/39/81/61/942398161.db2.gz BRICOIHAJPRGFG-CYBMUJFWSA-N 0 0 361.398 3.743 20 5 FHBDRN CNc1ccc(C(=O)N[C@H]2CCSc3c(F)cccc32)cc1[N+](=O)[O-] ZINC000016300801 942398579 /nfs/dbraw/zinc/39/85/79/942398579.db2.gz BRICOIHAJPRGFG-ZDUSSCGKSA-N 0 0 361.398 3.743 20 5 FHBDRN CC(=O)c1cccc(C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)c1 ZINC000501319559 942399105 /nfs/dbraw/zinc/39/91/05/942399105.db2.gz VFHJNZGCTRHVHJ-UHFFFAOYSA-N 0 0 363.167 3.812 20 5 FHBDRN CC(C)c1cc(C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)no1 ZINC000501307229 942403184 /nfs/dbraw/zinc/40/31/84/942403184.db2.gz KXVHVOMMGRQORQ-UHFFFAOYSA-N 0 0 354.160 3.721 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NC[C@@H](O)c1ccc(Cl)cc1 ZINC000085637397 942405549 /nfs/dbraw/zinc/40/55/49/942405549.db2.gz OVFYCYDDGREEJR-OAHLLOKOSA-N 0 0 363.801 3.720 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NC[C@H](O)c1ccc(Cl)cc1 ZINC000085637394 942405709 /nfs/dbraw/zinc/40/57/09/942405709.db2.gz OVFYCYDDGREEJR-HNNXBMFYSA-N 0 0 363.801 3.720 20 5 FHBDRN O=C(C[C@@H]1CCCN1C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)c1ccco1 ZINC000413610320 942410035 /nfs/dbraw/zinc/41/00/35/942410035.db2.gz CLLVZKIEPPZHOP-YESZJQIVSA-N 0 0 368.389 3.555 20 5 FHBDRN O=C(C1CCCCC1)N1CCC[C@H]1c1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000366469179 942412978 /nfs/dbraw/zinc/41/29/78/942412978.db2.gz TYZJIANAEINDMT-INIZCTEOSA-N 0 0 370.409 3.889 20 5 FHBDRN Cc1cc(NC(=O)CC(C)(C)CC(F)F)c2cc([N+](=O)[O-])ccc2n1 ZINC001268853751 942414089 /nfs/dbraw/zinc/41/40/89/942414089.db2.gz HXSDYLUXUWUUBF-UHFFFAOYSA-N 0 0 351.353 3.883 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc([N+](=O)[O-])c3ncccc23)c1C ZINC001268854177 942415936 /nfs/dbraw/zinc/41/59/36/942415936.db2.gz SQHQZDGGNAFUTQ-UHFFFAOYSA-N 0 0 366.333 3.920 20 5 FHBDRN Cc1cc(NC(=O)Cc2ccc(F)cc2Cl)c2cc([N+](=O)[O-])ccc2n1 ZINC001268854166 942416858 /nfs/dbraw/zinc/41/68/58/942416858.db2.gz SMLUZOOMOMCUHO-UHFFFAOYSA-N 0 0 373.771 3.847 20 5 FHBDRN C[C@@H](OCCc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])c2ncccc12 ZINC001268854698 942420365 /nfs/dbraw/zinc/42/03/65/942420365.db2.gz ZYFCGJZICXUDPU-CQSZACIVSA-N 0 0 365.389 3.729 20 5 FHBDRN CN(Cc1noc(C2CC2)n1)c1ccc([N+](=O)[O-])c(-c2ccc(F)cc2)n1 ZINC000413602563 942425811 /nfs/dbraw/zinc/42/58/11/942425811.db2.gz FPIMXOJQNRHWHM-UHFFFAOYSA-N 0 0 369.356 3.693 20 5 FHBDRN Cc1ccc([C@@H](C)NCc2nnc(-c3ccncc3F)s2)cc1[N+](=O)[O-] ZINC000366833106 942427133 /nfs/dbraw/zinc/42/71/33/942427133.db2.gz YTOAWWKWBHQZTR-LLVKDONJSA-N 0 0 373.413 3.807 20 5 FHBDRN COc1ccc([C@H]2CCCN2C(=O)Cc2ccc([N+](=O)[O-])cc2)c(OC)c1 ZINC000015829503 942435150 /nfs/dbraw/zinc/43/51/50/942435150.db2.gz DEPDXIHIGUNIMO-GOSISDBHSA-N 0 0 370.405 3.518 20 5 FHBDRN CCn1cc(CCSc2nc3cc4ccccc4cc3c(=O)n2C)cn1 ZINC000502426073 942439610 /nfs/dbraw/zinc/43/96/10/942439610.db2.gz IJBBOJZDOKILRP-UHFFFAOYSA-N 0 0 364.474 3.638 20 5 FHBDRN O=C(Nc1ccc(Nc2ccccc2)nc1)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000502425757 942440513 /nfs/dbraw/zinc/44/05/13/942440513.db2.gz POIPOQUMQOCGAB-UHFFFAOYSA-N 0 0 374.360 3.862 20 5 FHBDRN Cn1c(=O)c2cc3ccccc3cc2nc1SCC1CCC(=O)CC1 ZINC000502427956 942442413 /nfs/dbraw/zinc/44/24/13/942442413.db2.gz QOHVIFCWWUDQHO-UHFFFAOYSA-N 0 0 352.459 3.938 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])Nc1ccc(Br)cc1F ZINC000104199394 942450820 /nfs/dbraw/zinc/45/08/20/942450820.db2.gz YAQSQSAXYJXCAF-UHFFFAOYSA-N 0 0 368.162 3.547 20 5 FHBDRN CC[C@H](NS(=O)(=O)c1ccccc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000014099715 942454276 /nfs/dbraw/zinc/45/42/76/942454276.db2.gz AGNSSNLZAHGMFZ-ZDUSSCGKSA-N 0 0 354.815 3.678 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CC(=O)c2ccccc21 ZINC000416190180 942454439 /nfs/dbraw/zinc/45/44/39/942454439.db2.gz BIHJJIZQASTJCO-KSSFIOAISA-N 0 0 352.390 3.607 20 5 FHBDRN O=C(NCCc1ccccc1Cl)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513745017 942455029 /nfs/dbraw/zinc/45/50/29/942455029.db2.gz SXIXNCSYRAUYFR-UHFFFAOYSA-N 0 0 370.739 3.822 20 5 FHBDRN CC(C)Oc1cc(C(=O)N(Cc2cccnc2)C(C)C)ccc1[N+](=O)[O-] ZINC000413194773 942459725 /nfs/dbraw/zinc/45/97/25/942459725.db2.gz IQWUGCGGYOMYHI-UHFFFAOYSA-N 0 0 357.410 3.828 20 5 FHBDRN CC(C)n1cc2c(n1)C[C@H](Nc1ncc([N+](=O)[O-])cc1C(F)(F)F)CC2 ZINC000413199566 942464691 /nfs/dbraw/zinc/46/46/91/942464691.db2.gz LYAHGHRJDSCOSR-LLVKDONJSA-N 0 0 369.347 3.755 20 5 FHBDRN Cc1ccc([C@H]2NC(=O)N([C@@H](C)c3ccc([N+](=O)[O-])cc3)C2=O)cc1C ZINC000419964271 942468283 /nfs/dbraw/zinc/46/82/83/942468283.db2.gz IPWPQXJFXLTXJO-SUMWQHHRSA-N 0 0 353.378 3.566 20 5 FHBDRN CCN(C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)c1cccc(OC)c1 ZINC000501420913 942468468 /nfs/dbraw/zinc/46/84/68/942468468.db2.gz PXWKQYAQYBBVDJ-UHFFFAOYSA-N 0 0 369.421 3.870 20 5 FHBDRN Cc1ccc2c(c1)CCCN2S(=O)(=O)c1cc([N+](=O)[O-])cc(C)c1C ZINC000014101059 942470221 /nfs/dbraw/zinc/47/02/21/942470221.db2.gz RGIJEGATMMYUKR-UHFFFAOYSA-N 0 0 360.435 3.662 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H](CC(C)C)C(=O)OC(C)(C)C)c1 ZINC000424956575 942470387 /nfs/dbraw/zinc/47/03/87/942470387.db2.gz RELHUTMNQDWOQO-CQSZACIVSA-N 0 0 364.442 3.637 20 5 FHBDRN O=C(c1ccc(F)c2ccccc12)N1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000366859767 942470947 /nfs/dbraw/zinc/47/09/47/942470947.db2.gz VUGBTOCWDJKHJA-UHFFFAOYSA-N 0 0 368.368 3.561 20 5 FHBDRN CCN(C(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-])c1cccc(C)c1C ZINC000501430008 942474626 /nfs/dbraw/zinc/47/46/26/942474626.db2.gz BKKAKUOJWFBMDQ-UHFFFAOYSA-N 0 0 358.394 3.896 20 5 FHBDRN CC(C)(C(=O)N[C@H]1C[C@@]1(F)c1ccccc1)c1ccc([N+](=O)[O-])cc1F ZINC000424993170 942477471 /nfs/dbraw/zinc/47/74/71/942477471.db2.gz HJAHBCPKGMPYCO-QFBILLFUSA-N 0 0 360.360 3.765 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CCC[C@@H](c3nc4ccc(F)cc4o3)C2)c(F)c1 ZINC000413207619 942478791 /nfs/dbraw/zinc/47/87/91/942478791.db2.gz QYHPIBWZRVGIII-SNVBAGLBSA-N 0 0 360.320 3.793 20 5 FHBDRN C[C@H]1[C@H](Cc2ccccc2)CCN1C(=O)NCc1ccccc1[N+](=O)[O-] ZINC000472949583 942481921 /nfs/dbraw/zinc/48/19/21/942481921.db2.gz JBTKIOLBZXTZNO-RDJZCZTQSA-N 0 0 353.422 3.758 20 5 FHBDRN CN(Cc1cn(C)nc1C(F)(F)F)c1ccc([N+](=O)[O-])c2ncccc12 ZINC000413201806 942484519 /nfs/dbraw/zinc/48/45/19/942484519.db2.gz KMWIQGXSFFXYBP-UHFFFAOYSA-N 0 0 365.315 3.532 20 5 FHBDRN CN1CC[C@H](Nc2ncc([N+](=O)[O-])cc2F)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000413212430 942487527 /nfs/dbraw/zinc/48/75/27/942487527.db2.gz YSKZOARHPCJHPV-GJZGRUSLSA-N 0 0 368.771 3.779 20 5 FHBDRN O=[N+]([O-])c1ccc2ccnc(N3CCC[C@H](c4nnc(C5CC5)[nH]4)C3)c2c1 ZINC000413217106 942490746 /nfs/dbraw/zinc/49/07/46/942490746.db2.gz XIQGIYDNFVCSFI-AWEZNQCLSA-N 0 0 364.409 3.523 20 5 FHBDRN COc1cc(C(=O)N2CCC[C@H]2/C=C/c2ccccc2)ccc1[N+](=O)[O-] ZINC000505354089 942497131 /nfs/dbraw/zinc/49/71/31/942497131.db2.gz UIALUPRBIGCEQN-KAMXEHQASA-N 0 0 352.390 3.921 20 5 FHBDRN Cc1ccc2c(c1)CN(C(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1)CCO2 ZINC000412333964 942497235 /nfs/dbraw/zinc/49/72/35/942497235.db2.gz HNFOQKWCPDAEMZ-UHFFFAOYSA-N 0 0 370.405 3.725 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N1CCC[C@H]1/C=C/c1ccccc1 ZINC000505367216 942505367 /nfs/dbraw/zinc/50/53/67/942505367.db2.gz UCRAAHFRZNGJBO-IJDCCNJMSA-N 0 0 352.390 3.678 20 5 FHBDRN Cc1ccncc1NC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 ZINC000104451493 942516484 /nfs/dbraw/zinc/51/64/84/942516484.db2.gz IZUXIBOSGNLJMJ-UHFFFAOYSA-N 0 0 354.410 3.787 20 5 FHBDRN Cn1ccnc1[C@@H](NC[C@@H]1CC12CCSCC2)c1cccc([N+](=O)[O-])c1 ZINC000421375365 942526936 /nfs/dbraw/zinc/52/69/36/942526936.db2.gz IMHQIFUOUCTJCP-RDJZCZTQSA-N 0 0 372.494 3.541 20 5 FHBDRN COc1ccc(S(=O)(=O)N(C)c2cccc([N+](=O)[O-])c2)c2ccccc12 ZINC000513814204 942532753 /nfs/dbraw/zinc/53/27/53/942532753.db2.gz UJSDTCPBUGKDAO-UHFFFAOYSA-N 0 0 372.402 3.582 20 5 FHBDRN O=C(c1ccc(F)c2ccccc12)N1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1 ZINC000366528684 942533647 /nfs/dbraw/zinc/53/36/47/942533647.db2.gz GAPAPBXQSFAPGF-CYBMUJFWSA-N 0 0 368.368 3.561 20 5 FHBDRN C[C@@H]1CN(C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)c2cccc(F)c2O1 ZINC000413726043 942535103 /nfs/dbraw/zinc/53/51/03/942535103.db2.gz OTQMUIADPQXYGZ-BYCMXARLSA-N 0 0 356.353 3.652 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)Nc2cc(C)c(O)c(C)c2C)c1F ZINC000413727875 942535118 /nfs/dbraw/zinc/53/51/18/942535118.db2.gz RKOJQAOXZLHCSD-UHFFFAOYSA-N 0 0 362.357 3.555 20 5 FHBDRN Cc1sc(C(=O)NCCc2nc(C(C)(C)C)cs2)cc1[N+](=O)[O-] ZINC000104577768 942537793 /nfs/dbraw/zinc/53/77/93/942537793.db2.gz NDESSDCRXMWGEX-UHFFFAOYSA-N 0 0 353.469 3.691 20 5 FHBDRN CC(C)(C)c1csc(CNC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)n1 ZINC000104580031 942538036 /nfs/dbraw/zinc/53/80/36/942538036.db2.gz SQKXNNUNVONNSO-UHFFFAOYSA-N 0 0 358.423 3.760 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N2C[C@@H](C)C[C@H]2c2ccccc2F)c1[N+](=O)[O-] ZINC000434242289 942542518 /nfs/dbraw/zinc/54/25/18/942542518.db2.gz LHCIKUMHKBCWQC-FZMZJTMJSA-N 0 0 360.389 3.804 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N[C@@H](c2ccc(F)cc2F)C(C)C)c1[N+](=O)[O-] ZINC000434250042 942549250 /nfs/dbraw/zinc/54/92/50/942549250.db2.gz OTYYLTHILGOQSX-CYBMUJFWSA-N 0 0 366.368 3.847 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)N1CCCCC[C@H]1CC(=O)c1ccco1 ZINC000434255126 942551729 /nfs/dbraw/zinc/55/17/29/942551729.db2.gz UEVUCWQMUYYSBR-AWEZNQCLSA-N 0 0 371.393 3.549 20 5 FHBDRN C[C@H](CCOc1ccccc1)C(=O)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000513843432 942553528 /nfs/dbraw/zinc/55/35/28/942553528.db2.gz ZNEOBZCOBPEASX-OAHLLOKOSA-N 0 0 354.406 3.979 20 5 FHBDRN C[C@@H](CCOc1ccccc1)C(=O)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000513843431 942553681 /nfs/dbraw/zinc/55/36/81/942553681.db2.gz ZNEOBZCOBPEASX-HNNXBMFYSA-N 0 0 354.406 3.979 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)Nc1ccc(NC(=O)C2CC2)cc1 ZINC000421426776 942554472 /nfs/dbraw/zinc/55/44/72/942554472.db2.gz TUCMEZRVLXYSDS-UHFFFAOYSA-N 0 0 353.378 3.812 20 5 FHBDRN CCOC(=O)c1ccccc1N(C)C(=O)CSc1ccccc1[N+](=O)[O-] ZINC000541284490 942565950 /nfs/dbraw/zinc/56/59/50/942565950.db2.gz JOWOGZAHJIGFOY-UHFFFAOYSA-N 0 0 374.418 3.527 20 5 FHBDRN O=C(c1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCC(OC2CCC2)CC1 ZINC000416257849 942566266 /nfs/dbraw/zinc/56/62/66/942566266.db2.gz KPIIXMGXKSNQBO-UHFFFAOYSA-N 0 0 372.343 3.787 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)N2CCOc3c(F)cccc3C2)cc1[N+](=O)[O-] ZINC000434277164 942567571 /nfs/dbraw/zinc/56/75/71/942567571.db2.gz AIOSSZDGUJDSKJ-CYBMUJFWSA-N 0 0 373.384 3.708 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCC[C@@H](Oc3ncccc3F)C2)c2cccnc21 ZINC000413257024 942568839 /nfs/dbraw/zinc/56/88/39/942568839.db2.gz ADZNESPVQMXJKN-CYBMUJFWSA-N 0 0 368.368 3.725 20 5 FHBDRN CC[C@@H]1C[C@@]1(NC(=O)c1cc(OC)ccc1[N+](=O)[O-])c1cccc(C)c1 ZINC000501595342 942568873 /nfs/dbraw/zinc/56/88/73/942568873.db2.gz SFERKPVBPHWMMW-VLIAUNLRSA-N 0 0 354.406 3.967 20 5 FHBDRN C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)[C@H](C)CO1 ZINC000501597641 942570192 /nfs/dbraw/zinc/57/01/92/942570192.db2.gz NMRHWNGCYMUYOF-ZIAGYGMSSA-N 0 0 372.446 3.995 20 5 FHBDRN COc1cccc(C(=O)NC[C@H]2CCC[C@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000452399323 942571124 /nfs/dbraw/zinc/57/11/24/942571124.db2.gz PJKNDVQCGXSWBK-CVEARBPZSA-N 0 0 354.406 3.917 20 5 FHBDRN Cn1c(C(=O)NCC(C)(C)c2ccc(Cl)c(Cl)c2)ccc1[N+](=O)[O-] ZINC000502598875 942572288 /nfs/dbraw/zinc/57/22/88/942572288.db2.gz GQCZWLGDTFLOKQ-UHFFFAOYSA-N 0 0 370.236 3.948 20 5 FHBDRN Cc1cn(-c2ccc(F)cc2)nc1C(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000509541397 942573003 /nfs/dbraw/zinc/57/30/03/942573003.db2.gz JVYKDEXJCCPRHG-ZDUSSCGKSA-N 0 0 368.368 3.719 20 5 FHBDRN CN(C)c1ccc(COC(=O)C[C@@H]2CCc3ccccc32)cc1[N+](=O)[O-] ZINC001268940931 942574010 /nfs/dbraw/zinc/57/40/10/942574010.db2.gz CQFKUJUDKDZGCI-INIZCTEOSA-N 0 0 354.406 3.824 20 5 FHBDRN COc1cccc(-n2ccnc2SCC(=O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000501611879 942574020 /nfs/dbraw/zinc/57/40/20/942574020.db2.gz KXPGLUBBSPETGY-UHFFFAOYSA-N 0 0 369.402 3.764 20 5 FHBDRN C[C@H](NC(=O)CSc1ccccc1[N+](=O)[O-])[C@@H]1Oc2ccccc2[C@H]1C ZINC000541301353 942578063 /nfs/dbraw/zinc/57/80/63/942578063.db2.gz TWELCWJMOIKVEW-QHRIQVFBSA-N 0 0 372.446 3.756 20 5 FHBDRN O=C(CSc1ccccc1[N+](=O)[O-])NC1(Cc2ccccc2)CCC1 ZINC000541295027 942578111 /nfs/dbraw/zinc/57/81/11/942578111.db2.gz NSZUUNCQBFGYEY-UHFFFAOYSA-N 0 0 356.447 3.969 20 5 FHBDRN Cc1cc(C(=O)N2CCC(c3ccnc(C(C)C)n3)CC2)cc([N+](=O)[O-])c1 ZINC000378314306 942578724 /nfs/dbraw/zinc/57/87/24/942578724.db2.gz VEAUYFGFDKEOFA-UHFFFAOYSA-N 0 0 368.437 3.836 20 5 FHBDRN COc1cc(OC)cc(N(C)C(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)c1 ZINC000413765073 942580386 /nfs/dbraw/zinc/58/03/86/942580386.db2.gz ZENZIJBTCQUNFM-UHFFFAOYSA-N 0 0 374.393 3.676 20 5 FHBDRN COC[C@H](C)Nc1ccccc1NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000413766903 942580911 /nfs/dbraw/zinc/58/09/11/942580911.db2.gz MBMAQKPFHGTARA-RRQGHBQHSA-N 0 0 369.421 3.784 20 5 FHBDRN CCCn1ccnc1CCCN(C)c1ccc([N+](=O)[O-])c2ncccc12 ZINC000413268115 942585535 /nfs/dbraw/zinc/58/55/35/942585535.db2.gz RNFPEHCTLQUMJN-UHFFFAOYSA-N 0 0 353.426 3.819 20 5 FHBDRN C[C@@H](C(=O)N1CCC[C@@H](Oc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000416272467 942587203 /nfs/dbraw/zinc/58/72/03/942587203.db2.gz WLLYOYPJRQOPCX-RHSMWYFYSA-N 0 0 372.396 3.907 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]2[C@H]1[C@H]2C(F)(F)F ZINC000378322316 942587901 /nfs/dbraw/zinc/58/79/01/942587901.db2.gz VUHBCHFEYDLNPT-XDTLVQLUSA-N 0 0 360.357 3.730 20 5 FHBDRN CC(C)[C@H](NC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2)c1ccc(F)cc1 ZINC000501657526 942589297 /nfs/dbraw/zinc/58/92/97/942589297.db2.gz SCMMYCVHWWBDBQ-INIZCTEOSA-N 0 0 360.341 3.590 20 5 FHBDRN O=C(NCCc1ccccc1[N+](=O)[O-])C1(c2c(F)cccc2F)CCC1 ZINC000421470301 942589766 /nfs/dbraw/zinc/58/97/66/942589766.db2.gz CGTCPLVHBLLMHR-UHFFFAOYSA-N 0 0 360.360 3.654 20 5 FHBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])N1C[C@H]2CCCC[C@@H]2C1 ZINC000541304409 942590727 /nfs/dbraw/zinc/59/07/27/942590727.db2.gz ZPNCAFIYUIVHRQ-VXGBXAGGSA-N 0 0 354.859 3.989 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N[C@@H]1CCCC[C@H]1OC(F)F ZINC000501658745 942591101 /nfs/dbraw/zinc/59/11/01/942591101.db2.gz WXROKZKLTVSZTF-ZYHUDNBSSA-N 0 0 362.760 3.837 20 5 FHBDRN CC1(C)[C@H](Nc2ccc([N+](=O)[O-])cc2Br)[C@@H]2CCCO[C@@H]21 ZINC000085673911 942593276 /nfs/dbraw/zinc/59/32/76/942593276.db2.gz DMLAAYGNNKVUQK-GDLCADMTSA-N 0 0 355.232 3.973 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H](OC)[C@@H](C)CC ZINC000452417512 942593593 /nfs/dbraw/zinc/59/35/93/942593593.db2.gz RZQKNOZTBLQNSG-SWLSCSKDSA-N 0 0 354.472 3.888 20 5 FHBDRN COc1ccc2cccc(CC(=O)NCCc3ccccc3[N+](=O)[O-])c2c1 ZINC000513923181 942597978 /nfs/dbraw/zinc/59/79/78/942597978.db2.gz BEAHDJGHPFALSP-UHFFFAOYSA-N 0 0 364.401 3.658 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(-c2nc(-c3cccc(-c4cscn4)c3)no2)n1 ZINC000584436256 942598514 /nfs/dbraw/zinc/59/85/14/942598514.db2.gz XPAOBWXIZBYQMH-UHFFFAOYSA-N 0 0 368.378 3.652 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NC[C@H]1CCO[C@@H]1c1ccccc1 ZINC000421486275 942602536 /nfs/dbraw/zinc/60/25/36/942602536.db2.gz XEOOEHPCWLRHNI-VQIMIIECSA-N 0 0 354.406 3.719 20 5 FHBDRN O=C(Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1)Nc1cccc(Cl)c1 ZINC000501676886 942606899 /nfs/dbraw/zinc/60/68/99/942606899.db2.gz UGVCXWARCBDOHM-UHFFFAOYSA-N 0 0 356.769 3.750 20 5 FHBDRN O=[N+]([O-])c1ccc(NC[C@@]2(Cc3ccc(F)cc3)CCC[C@H]2O)s1 ZINC000617482899 942608624 /nfs/dbraw/zinc/60/86/24/942608624.db2.gz NQYNAQNUGAJSHT-PBHICJAKSA-N 0 0 350.415 3.981 20 5 FHBDRN COc1cccc(C2=CCN(C(=O)c3c[nH]c4cc([N+](=O)[O-])ccc34)C2)c1 ZINC000501687901 942612060 /nfs/dbraw/zinc/61/20/60/942612060.db2.gz LBFSKIZLWPMZAF-UHFFFAOYSA-N 0 0 363.373 3.624 20 5 FHBDRN Cc1ccc(NC(=O)c2ccc(NCC[C@H]3CCOC3)c([N+](=O)[O-])c2)cc1 ZINC000541347168 942623308 /nfs/dbraw/zinc/62/33/08/942623308.db2.gz WOJADTPUEXPRLV-HNNXBMFYSA-N 0 0 369.421 3.994 20 5 FHBDRN O=C(c1ccc(Oc2cccnc2)cc1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000063285701 942627976 /nfs/dbraw/zinc/62/79/76/942627976.db2.gz FFNLVUSDLAGGNN-UHFFFAOYSA-N 0 0 361.357 3.985 20 5 FHBDRN O=C(NCCSc1ccccc1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513749959 942628143 /nfs/dbraw/zinc/62/81/43/942628143.db2.gz YRXLWWSELQQONY-UHFFFAOYSA-N 0 0 368.361 3.718 20 5 FHBDRN COc1cc(C(=O)Nc2cn(-c3ccccc3)nc2C)cc([N+](=O)[O-])c1C ZINC000190105594 942629384 /nfs/dbraw/zinc/62/93/84/942629384.db2.gz JQZISASAEFJZOT-UHFFFAOYSA-N 0 0 366.377 3.658 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NCc1ccc([C@@H](C)O)cc1 ZINC000171436957 942637692 /nfs/dbraw/zinc/63/76/92/942637692.db2.gz KKEGZLYWSUEBEF-OAHLLOKOSA-N 0 0 371.437 3.768 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCSC[C@H]1c1nccs1 ZINC000421525558 942637861 /nfs/dbraw/zinc/63/78/61/942637861.db2.gz GHOMDMZJGKPTPT-AWEZNQCLSA-N 0 0 363.464 3.598 20 5 FHBDRN CC1(C)CN(c2nccc3ccc([N+](=O)[O-])cc32)C[C@H](C(F)(F)F)O1 ZINC000413303334 942638378 /nfs/dbraw/zinc/63/83/78/942638378.db2.gz NYKDHNNVKRQJQT-CYBMUJFWSA-N 0 0 355.316 3.689 20 5 FHBDRN Cn1cc(-c2ccccc2CNC(=O)c2ccc([N+](=O)[O-])cc2Cl)cn1 ZINC000366981849 942642231 /nfs/dbraw/zinc/64/22/31/942642231.db2.gz MQGFQJBPJWJBMX-UHFFFAOYSA-N 0 0 370.796 3.579 20 5 FHBDRN O=[N+]([O-])c1cnc(N[C@@H]2CCO[C@@H](c3cccnc3)C2)c(C(F)(F)F)c1 ZINC000413309096 942642741 /nfs/dbraw/zinc/64/27/41/942642741.db2.gz AZNQHBCCZOMZLN-BXUZGUMPSA-N 0 0 368.315 3.736 20 5 FHBDRN COc1ccccc1-c1noc([C@H](C)NCc2ccc([N+](=O)[O-])c(F)c2)n1 ZINC000366984696 942643913 /nfs/dbraw/zinc/64/39/13/942643913.db2.gz XSKQWROTXFYDSL-NSHDSACASA-N 0 0 372.356 3.643 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)c1c(C)onc1-c1ccccn1 ZINC000366985365 942644294 /nfs/dbraw/zinc/64/42/94/942644294.db2.gz ZSHCAKXYDNUIPO-UHFFFAOYSA-N 0 0 368.349 3.604 20 5 FHBDRN COc1cc(C(=O)Nc2cccc(-c3ncco3)c2)cc([N+](=O)[O-])c1OC 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372.446 3.541 20 5 FHBDRN Cc1ccccc1[C@]1(F)CCN(CC(=O)Nc2c(C)cccc2[N+](=O)[O-])C1 ZINC000502944816 942862390 /nfs/dbraw/zinc/86/23/90/942862390.db2.gz UFAISEZECJVZAR-FQEVSTJZSA-N 0 0 371.412 3.721 20 5 FHBDRN Cc1ccccc1[C@@]1(F)CCN(CC(=O)Nc2c(C)cccc2[N+](=O)[O-])C1 ZINC000502944817 942862646 /nfs/dbraw/zinc/86/26/46/942862646.db2.gz UFAISEZECJVZAR-HXUWFJFHSA-N 0 0 371.412 3.721 20 5 FHBDRN COc1ccc(CN[C@H](c2cc(F)ccc2F)C(F)F)cc1[N+](=O)[O-] ZINC000434689679 942866098 /nfs/dbraw/zinc/86/60/98/942866098.db2.gz XIQWIAJTGPKYGF-OAHLLOKOSA-N 0 0 358.291 3.978 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc([C@@H](C)C(=O)OC)cc1 ZINC000413992944 942873718 /nfs/dbraw/zinc/87/37/18/942873718.db2.gz PSSVQEGPGASPPV-GFCCVEGCSA-N 0 0 372.377 3.522 20 5 FHBDRN COC[C@H](C)Nc1ccccc1NC(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC000421892580 942874973 /nfs/dbraw/zinc/87/49/73/942874973.db2.gz RLKCSJUEZHVGSH-AWEZNQCLSA-N 0 0 357.410 3.911 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1)[C@H](Nc1cccc(N3CCOCC3)c1)CCC2 ZINC000584569652 942875052 /nfs/dbraw/zinc/87/50/52/942875052.db2.gz BNVXDRSRAHCCKJ-HXUWFJFHSA-N 0 0 353.422 3.921 20 5 FHBDRN C[C@H]1C[C@@H](C(F)(F)F)CCN1C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412379345 942876801 /nfs/dbraw/zinc/87/68/01/942876801.db2.gz GMYCVDAUDRARAT-HQRZJTNHSA-N 0 0 356.344 3.888 20 5 FHBDRN CCNC(=O)Nc1c(C)cccc1NC(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC000421904749 942879918 /nfs/dbraw/zinc/87/99/18/942879918.db2.gz ZLFTXCJCGNMXMZ-UHFFFAOYSA-N 0 0 370.409 3.914 20 5 FHBDRN C[C@H](NC(=O)c1ccc([C@@H]2CCCOC2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000502966301 942880386 /nfs/dbraw/zinc/88/03/86/942880386.db2.gz TYONDTGIYHWMAJ-KBXCAEBGSA-N 0 0 354.406 3.980 20 5 FHBDRN CCCN(C(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-])[C@H]1CCc2ccccc2C1 ZINC000434184040 942900111 /nfs/dbraw/zinc/90/01/11/942900111.db2.gz QHSGCGBATYSNRC-INIZCTEOSA-N 0 0 370.453 3.851 20 5 FHBDRN O=C(c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)N1CC[C@@H](C2CCCC2)C1 ZINC000421954266 942904810 /nfs/dbraw/zinc/90/48/10/942904810.db2.gz VDRWIVAPPGPPFF-CYBMUJFWSA-N 0 0 355.394 3.501 20 5 FHBDRN O=[N+]([O-])c1ccc(NCc2ccc3c(c2)OCCCO3)c2ccncc21 ZINC000066818922 942910326 /nfs/dbraw/zinc/91/03/26/942910326.db2.gz PNTVPIDYCVMBSB-UHFFFAOYSA-N 0 0 351.362 3.916 20 5 FHBDRN O=C(Cc1ccc(Cl)cc1Cl)NCCNc1ccc([N+](=O)[O-])cc1 ZINC000008174981 942916293 /nfs/dbraw/zinc/91/62/93/942916293.db2.gz UOBXRDZZEYLVPE-UHFFFAOYSA-N 0 0 368.220 3.672 20 5 FHBDRN CCC[C@H](Cc1ccccc1)N(CCC)C(=O)c1nn(C)cc1[N+](=O)[O-] ZINC000503029727 942921365 /nfs/dbraw/zinc/92/13/65/942921365.db2.gz SUPCPHQWNCIBFF-MRXNPFEDSA-N 0 0 358.442 3.592 20 5 FHBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@H](C)C[C@H](CO)C1 ZINC000421990895 942926879 /nfs/dbraw/zinc/92/68/79/942926879.db2.gz WBUQHJKORCLNAM-KGLIPLIRSA-N 0 0 366.483 3.578 20 5 FHBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)NCCCC1(O)CCC1 ZINC000421995923 942929427 /nfs/dbraw/zinc/92/94/27/942929427.db2.gz SMDJBWJAUCBZQU-UHFFFAOYSA-N 0 0 366.483 3.768 20 5 FHBDRN CC1(C)Cc2cccc(Cn3cnc(-c4ccc([N+](=O)[O-])cc4)n3)c2O1 ZINC000430118093 942930236 /nfs/dbraw/zinc/93/02/36/942930236.db2.gz CTKFAIBAQMAPNB-UHFFFAOYSA-N 0 0 350.378 3.615 20 5 FHBDRN COc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2OC)c(C(F)(F)F)c1 ZINC000503054951 942952769 /nfs/dbraw/zinc/95/27/69/942952769.db2.gz ALXHYEXENAXAMU-UHFFFAOYSA-N 0 0 370.283 3.883 20 5 FHBDRN CC(C)c1ccccc1OCC(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000536254026 942953778 /nfs/dbraw/zinc/95/37/78/942953778.db2.gz YCFISNJJLKGVGY-UHFFFAOYSA-N 0 0 354.366 3.612 20 5 FHBDRN Cc1ccc(Sc2ccc(C(=O)N3C[C@H](O)C[C@H]3C)cc2[N+](=O)[O-])cc1 ZINC000473003164 942962234 /nfs/dbraw/zinc/96/22/34/942962234.db2.gz UTIWEAKIXCYKCA-UKRRQHHQSA-N 0 0 372.446 3.650 20 5 FHBDRN O=C(c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1)N1CC[C@]12CCOC2 ZINC000422076152 942972634 /nfs/dbraw/zinc/97/26/34/942972634.db2.gz STKNCQWYKUGDLD-LJQANCHMSA-N 0 0 370.430 3.751 20 5 FHBDRN Cc1cc(-n2cccn2)ccc1NC(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000190214610 942974618 /nfs/dbraw/zinc/97/46/18/942974618.db2.gz XHVGYECGVWOOOI-UHFFFAOYSA-N 0 0 350.378 3.660 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H](CCO)CC1 ZINC000422081623 942976953 /nfs/dbraw/zinc/97/69/53/942976953.db2.gz XYFVXILHANYPOX-CQSZACIVSA-N 0 0 366.483 3.722 20 5 FHBDRN Cc1c(CNC(=O)c2csc(Br)c2)cccc1[N+](=O)[O-] ZINC000231862752 942981887 /nfs/dbraw/zinc/98/18/87/942981887.db2.gz NTFXTQOOYPITMF-UHFFFAOYSA-N 0 0 355.213 3.657 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H](CCO)CC1 ZINC000422071438 942983462 /nfs/dbraw/zinc/98/34/62/942983462.db2.gz KRHXLPHCVKBISZ-CQSZACIVSA-N 0 0 366.483 3.720 20 5 FHBDRN O=C(CN1CC[C@H]1c1ccc(Cl)cc1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000511572392 943003289 /nfs/dbraw/zinc/00/32/89/943003289.db2.gz DLDKONZVVNVDTD-KRWDZBQOSA-N 0 0 371.824 3.584 20 5 FHBDRN O=C(NCCCO[C@H]1CCCc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000505554609 943013394 /nfs/dbraw/zinc/01/33/94/943013394.db2.gz ANRPGJMGGFYPLW-IBGZPJMESA-N 0 0 354.406 3.809 20 5 FHBDRN Cc1nc2ccc(C(=O)N3CCc4ccc([N+](=O)[O-])cc4C3)cc2s1 ZINC000431893149 943017218 /nfs/dbraw/zinc/01/72/18/943017218.db2.gz BQEODBMMLPSHCT-UHFFFAOYSA-N 0 0 353.403 3.711 20 5 FHBDRN COCc1ccccc1C(=O)Nc1cc(C)nc2ccc([N+](=O)[O-])cc21 ZINC000183690290 943020600 /nfs/dbraw/zinc/02/06/00/943020600.db2.gz SDWILGXWHKQHPA-UHFFFAOYSA-N 0 0 351.362 3.850 20 5 FHBDRN COC(=O)c1cccc(Cl)c1COc1ccc([N+](=O)[O-])cc1OC ZINC000505560606 943033235 /nfs/dbraw/zinc/03/32/35/943033235.db2.gz UZYHHGOQHNKYGJ-UHFFFAOYSA-N 0 0 351.742 3.622 20 5 FHBDRN Cc1cc(NC(=O)c2cccc([N+](=O)[O-])c2)cnc1N1CCCC[C@@H]1C ZINC000503186146 943034516 /nfs/dbraw/zinc/03/45/16/943034516.db2.gz WHVAYORWWLUCBB-AWEZNQCLSA-N 0 0 354.410 3.929 20 5 FHBDRN C[C@@H](C(=O)NC[C@H]1CCOc2ccccc21)c1ccc([N+](=O)[O-])cc1F ZINC000183866018 943044002 /nfs/dbraw/zinc/04/40/02/943044002.db2.gz NMWUBGXIZQCVJA-CHWSQXEVSA-N 0 0 358.369 3.520 20 5 FHBDRN Cc1cc(OCC(=O)N2CC(c3ccc(Cl)cc3)C2)ccc1[N+](=O)[O-] ZINC000412400543 943051352 /nfs/dbraw/zinc/05/13/52/943051352.db2.gz OLGXEVSBKPOBEY-UHFFFAOYSA-N 0 0 360.797 3.561 20 5 FHBDRN COc1cccc(C(=O)CCCC(=O)N(C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000431896058 943056607 /nfs/dbraw/zinc/05/66/07/943056607.db2.gz KQESLBXNOXKZGA-UHFFFAOYSA-N 0 0 370.405 3.615 20 5 FHBDRN CCO[C@H]1C[C@@H](N(C)C(=O)c2ccc(OC)c([N+](=O)[O-])c2)C1(CC)CC ZINC000434171458 943065910 /nfs/dbraw/zinc/06/59/10/943065910.db2.gz CRBTYJAPBALMFG-SJORKVTESA-N 0 0 364.442 3.659 20 5 FHBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])N1CC2(C1)CCCCC2 ZINC000503225089 943066839 /nfs/dbraw/zinc/06/68/39/943066839.db2.gz JFDVMOKGRMQWPS-UHFFFAOYSA-N 0 0 352.818 3.810 20 5 FHBDRN Cc1c(CNC(=O)N2CCC[C@@H](c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000431899091 943071558 /nfs/dbraw/zinc/07/15/58/943071558.db2.gz PGRFELUMPYFBCC-GOSISDBHSA-N 0 0 353.422 3.992 20 5 FHBDRN Cn1ccnc1[C@H](Nc1ncc(Cl)cc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000434957536 943072423 /nfs/dbraw/zinc/07/24/23/943072423.db2.gz FUAHJDSZWLUMCT-CQSZACIVSA-N 0 0 361.764 3.717 20 5 FHBDRN C[C@H](CC(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc21)c1ccc(F)cc1F ZINC000536253551 943072906 /nfs/dbraw/zinc/07/29/06/943072906.db2.gz NGMBOXKYMJEBBU-SECBINFHSA-N 0 0 360.320 3.882 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)cnc1N1CCN(c2ccc3ccccc3n2)CC1 ZINC000434958630 943073033 /nfs/dbraw/zinc/07/30/33/943073033.db2.gz OHOZRACEFNQJHE-UHFFFAOYSA-N 0 0 369.812 3.518 20 5 FHBDRN COC(=O)c1cc(N2CC[C@@H](COc3ccccc3)C2)cc(C)c1[N+](=O)[O-] ZINC000503257627 943089402 /nfs/dbraw/zinc/08/94/02/943089402.db2.gz XBVSWWIQPPVBCI-OAHLLOKOSA-N 0 0 370.405 3.595 20 5 FHBDRN COCC[C@H](Nc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1)c1ccco1 ZINC000503258452 943089684 /nfs/dbraw/zinc/08/96/84/943089684.db2.gz YOLMZURRJOIQSC-INIZCTEOSA-N 0 0 373.409 3.614 20 5 FHBDRN O=C(NCc1ncc(-c2ccccc2)cn1)c1cc([N+](=O)[O-])ccc1Cl ZINC000183906852 943091867 /nfs/dbraw/zinc/09/18/67/943091867.db2.gz JTMCQXVPGZAKOC-UHFFFAOYSA-N 0 0 368.780 3.635 20 5 FHBDRN CCCN(C(=O)c1cc([N+](=O)[O-])cnc1C)[C@@H](C)c1ccccc1OC ZINC000514535533 943092384 /nfs/dbraw/zinc/09/23/84/943092384.db2.gz UWISFLRGTGYKIO-AWEZNQCLSA-N 0 0 357.410 3.920 20 5 FHBDRN CCCN(C(=O)c1cc([N+](=O)[O-])cnc1C)[C@H](C)c1ccccc1OC ZINC000514535534 943092418 /nfs/dbraw/zinc/09/24/18/943092418.db2.gz UWISFLRGTGYKIO-CQSZACIVSA-N 0 0 357.410 3.920 20 5 FHBDRN C[C@H](NC(=O)c1ccc([N+](=O)[O-])[nH]1)c1cccc(OCc2ccccc2)c1 ZINC000434190945 943100783 /nfs/dbraw/zinc/10/07/83/943100783.db2.gz LBKFZONLSVBSNH-AWEZNQCLSA-N 0 0 365.389 3.993 20 5 FHBDRN CC(=O)Nc1cccc([C@@H](C)NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)c1 ZINC000514557455 943101180 /nfs/dbraw/zinc/10/11/80/943101180.db2.gz MUQZUXMCHYYDPS-LLVKDONJSA-N 0 0 367.361 3.790 20 5 FHBDRN O=C(NCc1cc2ccccc2o1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000514574704 943108668 /nfs/dbraw/zinc/10/86/68/943108668.db2.gz SELAGHXLBZTOJI-UHFFFAOYSA-N 0 0 351.362 3.845 20 5 FHBDRN COc1ccc(OC)c([C@@H]2CCCN2C(=O)c2csc([N+](=O)[O-])c2)c1 ZINC000514568540 943115910 /nfs/dbraw/zinc/11/59/10/943115910.db2.gz JTKMVUMRKZYRHF-AWEZNQCLSA-N 0 0 362.407 3.651 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2ccc(CN3C[C@@H](O)Cc4ccccc43)o2)cc1 ZINC000435050756 943123606 /nfs/dbraw/zinc/12/36/06/943123606.db2.gz NBQFKLMVPWUQOI-KRWDZBQOSA-N 0 0 350.374 3.778 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2ccc(CN3C[C@H](O)Cc4ccccc43)o2)cc1 ZINC000435050757 943123767 /nfs/dbraw/zinc/12/37/67/943123767.db2.gz NBQFKLMVPWUQOI-QGZVFWFLSA-N 0 0 350.374 3.778 20 5 FHBDRN CCC(=O)Nc1cccc(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000183759301 943127740 /nfs/dbraw/zinc/12/77/40/943127740.db2.gz OWKQTKSNFLQYPV-UHFFFAOYSA-N 0 0 361.785 3.527 20 5 FHBDRN COc1ccc(OC)c(CN(Cc2c(F)cccc2[N+](=O)[O-])C2CC2)c1 ZINC000505595293 943130859 /nfs/dbraw/zinc/13/08/59/943130859.db2.gz CDPPCFNBWPTSCD-UHFFFAOYSA-N 0 0 360.385 3.916 20 5 FHBDRN O=[N+]([O-])c1ccc(CSC[C@@H](O)COc2ccccc2Cl)cc1 ZINC000513787283 943142016 /nfs/dbraw/zinc/14/20/16/943142016.db2.gz WLHSUUJCWODYHF-AWEZNQCLSA-N 0 0 353.827 3.921 20 5 FHBDRN CC(C)[C@H](CNC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F)c1ccccc1 ZINC000514629642 943161730 /nfs/dbraw/zinc/16/17/30/943161730.db2.gz UIUYMXPSZCRVTB-INIZCTEOSA-N 0 0 362.376 3.972 20 5 FHBDRN Cn1cc([N+](=O)[O-])c(C(=O)N(Cc2ccccc2)[C@H]2CCCC2(C)C)n1 ZINC000503418506 943174762 /nfs/dbraw/zinc/17/47/62/943174762.db2.gz BBABMDMZRWXCIC-INIZCTEOSA-N 0 0 356.426 3.549 20 5 FHBDRN O=[N+]([O-])c1cccc(F)c1CN1c2cccc3cccc(c23)S1(=O)=O ZINC000505607157 943175685 /nfs/dbraw/zinc/17/56/85/943175685.db2.gz GCPWLVBNQUITGY-UHFFFAOYSA-N 0 0 358.350 3.596 20 5 FHBDRN Cc1cnc(OCc2nc3cc(Br)ccc3[nH]2)c([N+](=O)[O-])c1 ZINC000185560710 943185855 /nfs/dbraw/zinc/18/58/55/943185855.db2.gz NKOKZPSHVCFARJ-UHFFFAOYSA-N 0 0 363.171 3.516 20 5 FHBDRN C[C@H](C(=O)Nc1cccc(C(=O)N2CCCC2)c1)c1cccc([N+](=O)[O-])c1 ZINC000514647475 943191672 /nfs/dbraw/zinc/19/16/72/943191672.db2.gz CNTKJRBTGKKVLL-AWEZNQCLSA-N 0 0 367.405 3.573 20 5 FHBDRN CCCOc1cc(NC(=O)[C@H]2CCCCO2)c([N+](=O)[O-])cc1OCCC ZINC000435150654 943193479 /nfs/dbraw/zinc/19/34/79/943193479.db2.gz CNWIWPZDDSNBAO-OAHLLOKOSA-N 0 0 366.414 3.680 20 5 FHBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)N(CC2CC2)C2CCCCC2)cc1 ZINC000503446800 943195839 /nfs/dbraw/zinc/19/58/39/943195839.db2.gz IOIXEZVQEVXEOW-UHFFFAOYSA-N 0 0 366.483 3.512 20 5 FHBDRN Cc1ccc(NC(=O)[C@H](C)OC(=O)c2ccc(C)c([N+](=O)[O-])c2)c(C)c1 ZINC000016862096 943198087 /nfs/dbraw/zinc/19/80/87/943198087.db2.gz RMOAWWSQWFRVAS-AWEZNQCLSA-N 0 0 356.378 3.704 20 5 FHBDRN COc1ccccc1C1(CNC(=O)c2ccc(SC)c([N+](=O)[O-])c2)CC1 ZINC000503474270 943205321 /nfs/dbraw/zinc/20/53/21/943205321.db2.gz BYJXDCLLKWJTSO-UHFFFAOYSA-N 0 0 372.446 3.787 20 5 FHBDRN CCc1ccc(N(CC)S(=O)(=O)CCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000503512084 943217954 /nfs/dbraw/zinc/21/79/54/943217954.db2.gz ZTGSZPYUUMFMGI-UHFFFAOYSA-N 0 0 362.451 3.556 20 5 FHBDRN O=C(N[C@@H]1CCCC(F)(F)C1)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000514708094 943236645 /nfs/dbraw/zinc/23/66/45/943236645.db2.gz PYAYDOSXXVVTEA-GFCCVEGCSA-N 0 0 356.372 3.989 20 5 FHBDRN Cn1c(C(=O)Nc2nc(-c3ccc(F)c(F)c3)cs2)ccc1[N+](=O)[O-] ZINC000514712523 943240873 /nfs/dbraw/zinc/24/08/73/943240873.db2.gz IRPRGPSYMWKLAI-UHFFFAOYSA-N 0 0 364.333 3.587 20 5 FHBDRN Cc1[nH]c2c(cc(C)cc2CNC(=O)c2cccc([N+](=O)[O-])c2N)c1C ZINC000468692045 943257955 /nfs/dbraw/zinc/25/79/55/943257955.db2.gz ANCYTQRWJIQAJG-UHFFFAOYSA-N 0 0 352.394 3.514 20 5 FHBDRN CCn1ccc(CN(C)C(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)c1 ZINC000616482819 943260149 /nfs/dbraw/zinc/26/01/49/943260149.db2.gz MDQWECMTMPSJIS-UHFFFAOYSA-N 0 0 370.434 3.812 20 5 FHBDRN Cc1cc(NC(=O)N2CCC[C@H]2COc2cccnc2C)ccc1[N+](=O)[O-] ZINC000416971541 943265036 /nfs/dbraw/zinc/26/50/36/943265036.db2.gz DKGIABSBLAPGDI-INIZCTEOSA-N 0 0 370.409 3.682 20 5 FHBDRN COc1cc(CSc2nnc(-c3ccccc3)n2C)c([N+](=O)[O-])cc1F ZINC000183829271 943268095 /nfs/dbraw/zinc/26/80/95/943268095.db2.gz XKDBBQVNFLPHOP-UHFFFAOYSA-N 0 0 374.397 3.830 20 5 FHBDRN Cc1cc(N2CCCC2)ccc1NC(=O)COc1ccc([N+](=O)[O-])c(C)c1 ZINC000019428868 943270870 /nfs/dbraw/zinc/27/08/70/943270870.db2.gz UNRQZRHQNQVAQN-UHFFFAOYSA-N 0 0 369.421 3.829 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)NCC(F)(F)c1ccccc1 ZINC000514761474 943273331 /nfs/dbraw/zinc/27/33/31/943273331.db2.gz SXTYMTZHMNRYOU-UHFFFAOYSA-N 0 0 359.332 3.527 20 5 FHBDRN O=C(NCC1(C(F)(F)F)CC1)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000514744780 943275068 /nfs/dbraw/zinc/27/50/68/943275068.db2.gz SXUUNZXEBMQICM-UHFFFAOYSA-N 0 0 356.222 3.686 20 5 FHBDRN O=C(Nc1c[nH]nc1-c1ccccc1F)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000513793549 943279124 /nfs/dbraw/zinc/27/91/24/943279124.db2.gz AABOHXKHBXYOPW-UHFFFAOYSA-N 0 0 365.324 3.858 20 5 FHBDRN CN1C(=O)Cc2cc(Nc3ccc([N+](=O)[O-])cc3Br)ccc21 ZINC000503597035 943282212 /nfs/dbraw/zinc/28/22/12/943282212.db2.gz FCDPIDDHYYNAIN-UHFFFAOYSA-N 0 0 362.183 3.620 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1ccccc1N1CCCCC1 ZINC000505642798 943283681 /nfs/dbraw/zinc/28/36/81/943283681.db2.gz XMOJDRCFHLNUFH-UHFFFAOYSA-N 0 0 353.422 3.857 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N[C@@H]1CCN(c2ccc(F)cc2)C1 ZINC000417005682 943286049 /nfs/dbraw/zinc/28/60/49/943286049.db2.gz QREOGQRXVSXFTB-OAHLLOKOSA-N 0 0 372.400 3.751 20 5 FHBDRN C[C@H]1CCN(C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)CC12CCC2 ZINC000408086429 943289254 /nfs/dbraw/zinc/28/92/54/943289254.db2.gz IXFYIPDJYUKUGJ-INIZCTEOSA-N 0 0 371.481 3.850 20 5 FHBDRN O=C(NCCc1ccccc1[N+](=O)[O-])N1CCC[C@@H](c2ccccc2)C1 ZINC000431916745 943299061 /nfs/dbraw/zinc/29/90/61/943299061.db2.gz PJRGWVWNPQDWGL-GOSISDBHSA-N 0 0 353.422 3.727 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](CC)[C@@H]1CCCO1 ZINC000503616787 943302442 /nfs/dbraw/zinc/30/24/42/943302442.db2.gz IXUAFLUWUIPEEG-CABCVRRESA-N 0 0 352.456 3.784 20 5 FHBDRN O=[N+]([O-])c1ccccc1CN(CCO)Cc1ccc(Cl)c(Cl)c1 ZINC000503643147 943306959 /nfs/dbraw/zinc/30/69/59/943306959.db2.gz NYMNPNBUDRYERK-UHFFFAOYSA-N 0 0 355.221 3.896 20 5 FHBDRN CCc1ccc(C(=O)NCCc2cc(F)c(F)c(F)c2)cc1[N+](=O)[O-] ZINC000503665943 943319317 /nfs/dbraw/zinc/31/93/17/943319317.db2.gz IOROMLCGDWYEAQ-UHFFFAOYSA-N 0 0 352.312 3.547 20 5 FHBDRN COc1cc(NCc2ccc([N+](=O)[O-])c(OC)c2)cc(OC)c1Cl ZINC000417050115 943319452 /nfs/dbraw/zinc/31/94/52/943319452.db2.gz IUWHGIDWHFTVJE-UHFFFAOYSA-N 0 0 352.774 3.886 20 5 FHBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NCc1ccc(Cl)cc1 ZINC000016987424 943320621 /nfs/dbraw/zinc/32/06/21/943320621.db2.gz FIIFBPWLYCZBDV-SNVBAGLBSA-N 0 0 369.204 3.985 20 5 FHBDRN Cc1c(NC(=O)N[C@@H]2CC=CCC2)cc(Br)cc1[N+](=O)[O-] ZINC000435323501 943323726 /nfs/dbraw/zinc/32/37/26/943323726.db2.gz MZCCYJQVGGJXHM-LLVKDONJSA-N 0 0 354.204 3.896 20 5 FHBDRN Cc1c(NC(=O)N[C@H]2CS[C@H](C)C2)cc(Br)cc1[N+](=O)[O-] ZINC000417075070 943328959 /nfs/dbraw/zinc/32/89/59/943328959.db2.gz LPBSUDIXTLQCIZ-GMSGAONNSA-N 0 0 374.260 3.681 20 5 FHBDRN Cc1c(NC(=O)N2C[C@H](C)C[C@H]2C)cc(Br)cc1[N+](=O)[O-] ZINC000435328240 943332517 /nfs/dbraw/zinc/33/25/17/943332517.db2.gz KKSZUGOZRDXXGM-RKDXNWHRSA-N 0 0 356.220 3.928 20 5 FHBDRN Cc1c(NC(=O)NCc2ccoc2)cc(Br)cc1[N+](=O)[O-] ZINC000435330969 943335072 /nfs/dbraw/zinc/33/50/72/943335072.db2.gz XTHLNYDDMDNUFD-UHFFFAOYSA-N 0 0 354.160 3.580 20 5 FHBDRN CC[C@@H](OC1CCCCC1)C(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000514888692 943363670 /nfs/dbraw/zinc/36/36/70/943363670.db2.gz VXDVYFFLOXZGAY-LJQANCHMSA-N 0 0 373.453 3.863 20 5 FHBDRN C[C@@H](NC(=O)NCc1ccc2c(c1)CCCN2)c1cccc([N+](=O)[O-])c1 ZINC000417144766 943379224 /nfs/dbraw/zinc/37/92/24/943379224.db2.gz WEGFKIBELHSGOM-CYBMUJFWSA-N 0 0 354.410 3.513 20 5 FHBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)N2CCC[C@H]2/C=C\c2ccccc2)cc1 ZINC000503835633 943380187 /nfs/dbraw/zinc/38/01/87/943380187.db2.gz ZDMQDCCHXNGODD-YFWYWMRJSA-N 0 0 372.446 3.602 20 5 FHBDRN Cc1oc(-c2cccs2)nc1CC(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000053217748 943381313 /nfs/dbraw/zinc/38/13/13/943381313.db2.gz HNVIVIWMESKGHA-UHFFFAOYSA-N 0 0 371.418 3.521 20 5 FHBDRN O=C(c1ccc(OC(F)F)c([N+](=O)[O-])c1)N1CCSC2(CCC2)CC1 ZINC000412463109 943392191 /nfs/dbraw/zinc/39/21/91/943392191.db2.gz MIGGQQUSRIWUHY-UHFFFAOYSA-N 0 0 372.393 3.698 20 5 FHBDRN C[C@H](c1cccc(Cl)c1)N(C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000053233720 943422790 /nfs/dbraw/zinc/42/27/90/943422790.db2.gz GZCWLQOLZCQSGT-CYBMUJFWSA-N 0 0 361.829 3.904 20 5 FHBDRN Cc1cc(NC[C@@H](CO)Cc2ccco2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000549467069 943456918 /nfs/dbraw/zinc/45/69/18/943456918.db2.gz OSPXGHADFHZDDV-NSHDSACASA-N 0 0 358.316 3.778 20 5 FHBDRN CC(C)C1CN(C(=O)c2cc(OCc3ccccc3)ccc2[N+](=O)[O-])C1 ZINC000618856083 943464175 /nfs/dbraw/zinc/46/41/75/943464175.db2.gz ZMFRNGUACPZGAD-UHFFFAOYSA-N 0 0 354.406 3.902 20 5 FHBDRN CCCOCc1ccccc1CNC(=O)COc1ccc([N+](=O)[O-])cc1C ZINC000131433177 943466614 /nfs/dbraw/zinc/46/66/14/943466614.db2.gz NKGSMXARILBVCD-UHFFFAOYSA-N 0 0 372.421 3.525 20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])NCCc1ccc2ccccc2c1 ZINC000515049018 943473491 /nfs/dbraw/zinc/47/34/91/943473491.db2.gz VRTKGKMVWFILGR-UHFFFAOYSA-N 0 0 363.417 3.909 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)N1C[C@@H]2CCCN2c2ccccc21 ZINC000515051897 943475326 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3.546 20 5 FHBDRN Cn1cnc([N+](=O)[O-])c1NCc1ccc(-c2ccc3c(c2)CCCO3)cc1 ZINC000504174385 943536434 /nfs/dbraw/zinc/53/64/34/943536434.db2.gz LAUFDEYUXIQMNQ-UHFFFAOYSA-N 0 0 364.405 3.932 20 5 FHBDRN CCc1ccc(C(=O)N2CC[C@@H](COc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000504187812 943540613 /nfs/dbraw/zinc/54/06/13/943540613.db2.gz OUNLPTTUMCNUJL-OAHLLOKOSA-N 0 0 354.406 3.698 20 5 FHBDRN O=C(NCCCNc1ccc([N+](=O)[O-])cc1C(F)(F)F)c1ccccc1 ZINC000504218559 943553491 /nfs/dbraw/zinc/55/34/91/943553491.db2.gz JVDMRXAVKSASKW-UHFFFAOYSA-N 0 0 367.327 3.846 20 5 FHBDRN CCc1cnc(NC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])s1 ZINC000543119150 943554210 /nfs/dbraw/zinc/55/42/10/943554210.db2.gz PHDOZMBBTQTUML-UHFFFAOYSA-N 0 0 357.844 3.998 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2noc(CN3CCSc4ccccc43)n2)cc1 ZINC000051320904 943558236 /nfs/dbraw/zinc/55/82/36/943558236.db2.gz PPGWTKLAQGIMNK-UHFFFAOYSA-N 0 0 354.391 3.757 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)NCC1(Cc2ccccc2)CC1 ZINC000435690225 943559184 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0 0 362.389 3.680 20 5 FHBDRN Cc1ccc(C)c(CC(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)c1 ZINC000515249976 943584566 /nfs/dbraw/zinc/58/45/66/943584566.db2.gz UCVRZDKEFHMBQR-UHFFFAOYSA-N 0 0 351.406 3.594 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCCc1c[nH]c2ccccc12 ZINC000017295769 943590103 /nfs/dbraw/zinc/59/01/03/943590103.db2.gz JGLNUWOOIHACFZ-CYBMUJFWSA-N 0 0 369.446 3.916 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NCc1cccc2c1CCCN2 ZINC000423648805 943591260 /nfs/dbraw/zinc/59/12/60/943591260.db2.gz ONTIUADSRSTBKP-UHFFFAOYSA-N 0 0 353.422 3.808 20 5 FHBDRN CCCCCn1cc(CNC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)c(C)n1 ZINC000504323791 943591521 /nfs/dbraw/zinc/59/15/21/943591521.db2.gz DVGKEAVQIVNLMV-UHFFFAOYSA-N 0 0 369.425 3.701 20 5 FHBDRN CC1=NN(c2ccc(C(=O)N3c4ccc([N+](=O)[O-])cc4C[C@@H]3C)cc2)CC1 ZINC000504334464 943598547 /nfs/dbraw/zinc/59/85/47/943598547.db2.gz MZPWHTRFOJPSBP-AWEZNQCLSA-N 0 0 364.405 3.772 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CCC[C@H]1c1nncn1CC(C)C ZINC000364116286 943599233 /nfs/dbraw/zinc/59/92/33/943599233.db2.gz IDSUZKSLJQPAMO-INIZCTEOSA-N 0 0 372.429 3.520 20 5 FHBDRN C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1ccccc1OCC1CC1 ZINC000504352711 943602762 /nfs/dbraw/zinc/60/27/62/943602762.db2.gz DOCQSCJMXNQUMX-ZDUSSCGKSA-N 0 0 352.390 3.975 20 5 FHBDRN C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)CCCOc1cccc(F)c1 ZINC000504393750 943614541 /nfs/dbraw/zinc/61/45/41/943614541.db2.gz JOEKRGCLTKKUAM-CYBMUJFWSA-N 0 0 358.369 3.871 20 5 FHBDRN O=c1[nH]c(-c2ccc([N+](=O)[O-])cc2)nc2cc(Br)c(F)cc12 ZINC000504506493 943647677 /nfs/dbraw/zinc/64/76/77/943647677.db2.gz BQRRGUOCHDCMQL-UHFFFAOYSA-N 0 0 364.130 3.812 20 5 FHBDRN CCOc1cc2c(cc1[C@@H]1C[C@@H]1Nc1ccc([N+](=O)[O-])nc1)O[C@@H](C)C2 ZINC000584804561 943649286 /nfs/dbraw/zinc/64/92/86/943649286.db2.gz TYNGZDVUJQQASV-PJODQICGSA-N 0 0 355.394 3.680 20 5 FHBDRN COc1ccc(-c2nnc(SCc3c(F)cccc3[N+](=O)[O-])n2C)cc1 ZINC000504518451 943652850 /nfs/dbraw/zinc/65/28/50/943652850.db2.gz LXJRVVAFCGREDK-UHFFFAOYSA-N 0 0 374.397 3.830 20 5 FHBDRN CC(C)n1ncc2cc(Cn3cc(-c4ccc([N+](=O)[O-])cc4)cn3)cnc21 ZINC000504546346 943669206 /nfs/dbraw/zinc/66/92/06/943669206.db2.gz JFXLHFZLQIYFFC-UHFFFAOYSA-N 0 0 362.393 3.832 20 5 FHBDRN O=C(NCCNc1ccccc1[N+](=O)[O-])[C@@H]1C[C@@H]1c1ccccc1Cl ZINC000105376315 943686983 /nfs/dbraw/zinc/68/69/83/943686983.db2.gz WWAGGWNNNXXVMP-ZIAGYGMSSA-N 0 0 359.813 3.580 20 5 FHBDRN Nc1cccc(C2CCN(C(=O)c3ccc(Cl)cc3[N+](=O)[O-])CC2)c1 ZINC000424038261 943699870 /nfs/dbraw/zinc/69/98/70/943699870.db2.gz WDHFLSJBHUDKFY-UHFFFAOYSA-N 0 0 359.813 3.850 20 5 FHBDRN CC(C)n1cc([C@H](C)NC(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)cn1 ZINC000584829921 943708393 /nfs/dbraw/zinc/70/83/93/943708393.db2.gz BUNQJRXFRKSFBA-JTQLQIEISA-N 0 0 370.331 3.882 20 5 FHBDRN O=[N+]([O-])c1ccc(-n2cc(-c3nc(Cc4ccc(F)cc4)no3)cn2)cc1 ZINC000504652815 943718035 /nfs/dbraw/zinc/71/80/35/943718035.db2.gz OMCLDQIQWGJNKC-UHFFFAOYSA-N 0 0 365.324 3.560 20 5 FHBDRN COc1cc(C)c([S@](C)=O)cc1OCc1c(Cl)cccc1[N+](=O)[O-] ZINC000424102312 943719651 /nfs/dbraw/zinc/71/96/51/943719651.db2.gz LDMJIRJRAMPWRI-DEOSSOPVSA-N 0 0 369.826 3.882 20 5 FHBDRN Cc1cc(OC[C@@H](O)COc2ccccc2F)c(Cl)cc1[N+](=O)[O-] ZINC000504672992 943739049 /nfs/dbraw/zinc/73/90/49/943739049.db2.gz IEEFOFUVEAOEGX-NSHDSACASA-N 0 0 355.749 3.514 20 5 FHBDRN CCC1CCC2(CC1)NC(=O)N([C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)C2=O ZINC000431955831 943739479 /nfs/dbraw/zinc/73/94/79/943739479.db2.gz WCHSKKSZSGUJQA-CDJWAVJASA-N 0 0 359.426 3.855 20 5 FHBDRN Cc1cc(OC[C@H](O)COCc2ccccc2F)c(Cl)cc1[N+](=O)[O-] ZINC000504674043 943739735 /nfs/dbraw/zinc/73/97/35/943739735.db2.gz UOTBAJVEOYKAGD-CYBMUJFWSA-N 0 0 369.776 3.652 20 5 FHBDRN CCOc1ccccc1[C@@H](CC)NC(=O)COc1cccc([N+](=O)[O-])c1 ZINC000053323722 943745345 /nfs/dbraw/zinc/74/53/45/943745345.db2.gz NXTORLBPNKMZDG-QGZVFWFLSA-N 0 0 358.394 3.640 20 5 FHBDRN C[C@@H]([NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)[C@@H](C)C(=O)[O-] ZINC000417618620 943754513 /nfs/dbraw/zinc/75/45/13/943754513.db2.gz XYGJNUZEHPTJEZ-VXGBXAGGSA-N 0 0 362.357 3.725 20 5 FHBDRN CCOC1(C)CCN(C(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000293767307 943757964 /nfs/dbraw/zinc/75/79/64/943757964.db2.gz XZTYSSDLWJWUPP-UHFFFAOYSA-N 0 0 372.874 3.758 20 5 FHBDRN CCOc1cc(NC(=O)[C@@H]2CCC[C@H](F)C2)c([N+](=O)[O-])cc1OCC ZINC000425409559 943761474 /nfs/dbraw/zinc/76/14/74/943761474.db2.gz AWQUKGLQXDYFFF-NEPJUHHUSA-N 0 0 354.378 3.859 20 5 FHBDRN Cc1[nH]c2c(cccc2C(=O)NCCNc2ccccc2[N+](=O)[O-])c1C ZINC000024624882 943765490 /nfs/dbraw/zinc/76/54/90/943765490.db2.gz IFBIPUPIMIZOPV-UHFFFAOYSA-N 0 0 352.394 3.535 20 5 FHBDRN Cc1ccc(C[NH2+][C@H](CCSc2ccccc2)C(=O)[O-])cc1[N+](=O)[O-] ZINC000417630278 943768784 /nfs/dbraw/zinc/76/87/84/943768784.db2.gz XUOLLHOYGVDPJM-MRXNPFEDSA-N 0 0 360.435 3.628 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1OC(=O)c1ccc(N2CCCCCC2)nc1 ZINC000760018220 943770761 /nfs/dbraw/zinc/77/07/61/943770761.db2.gz NXRQSGAMVGOUAJ-UHFFFAOYSA-N 0 0 355.394 3.898 20 5 FHBDRN COc1cc(C(=O)N[C@H]2C[C@H](c3cccc(F)c3)C2)cc([N+](=O)[O-])c1C ZINC000437404129 943780443 /nfs/dbraw/zinc/78/04/43/943780443.db2.gz JGQXEQGTDKXWKI-SAZUREKKSA-N 0 0 358.369 3.727 20 5 FHBDRN Cc1ccc(NC(=O)C(=O)N(CCC(C)C)C2CCCC2)cc1[N+](=O)[O-] ZINC000437429979 943785844 /nfs/dbraw/zinc/78/58/44/943785844.db2.gz QVJHHMMUSXOTKX-UHFFFAOYSA-N 0 0 361.442 3.659 20 5 FHBDRN Cn1cc(CN[C@@H]2C[C@@]2(F)c2ccccc2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000424203741 943787369 /nfs/dbraw/zinc/78/73/69/943787369.db2.gz UTJNCOJBPHFRBU-UYAOXDASSA-N 0 0 366.396 3.722 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2C[C@@H]2c2ccccc2OC(F)F)c1 ZINC000437414113 943787426 /nfs/dbraw/zinc/78/74/26/943787426.db2.gz VEZJJRZPLKJPCV-OCCSQVGLSA-N 0 0 362.332 3.791 20 5 FHBDRN COC(=O)c1cnc([C@H](C)NCc2ccc(C(C)C)c([N+](=O)[O-])c2)s1 ZINC000424208450 943788622 /nfs/dbraw/zinc/78/86/22/943788622.db2.gz ZPQKRGALRYBUNO-NSHDSACASA-N 0 0 363.439 3.812 20 5 FHBDRN C[C@H](NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1)[C@@H]1OCCc2sccc21 ZINC000516885637 943794848 /nfs/dbraw/zinc/79/48/48/943794848.db2.gz YVVWMNQMUXWJCY-VFZGTOFNSA-N 0 0 366.826 3.742 20 5 FHBDRN COc1cccc(C(=O)N[C@H]2CCCO[C@H]2c2ccc(C)cc2)c1[N+](=O)[O-] ZINC000435824270 943795890 /nfs/dbraw/zinc/79/58/90/943795890.db2.gz CPJKABWRFHIJBL-LPHOPBHVSA-N 0 0 370.405 3.562 20 5 FHBDRN O=[N+]([O-])c1ccc(CN2CCN(c3nccc4sccc43)CC2)cc1 ZINC000516890607 943798395 /nfs/dbraw/zinc/79/83/95/943798395.db2.gz HNVCYIMVIXWWGL-UHFFFAOYSA-N 0 0 354.435 3.527 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)N[C@H]1C[C@H](c2ccccc2)C1 ZINC000437447854 943806156 /nfs/dbraw/zinc/80/61/56/943806156.db2.gz NYSFFRXBMGQBOH-SAABIXHNSA-N 0 0 353.422 3.849 20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])N[C@H]1C[C@H](c2ccccc2F)C1 ZINC000437447885 943806214 /nfs/dbraw/zinc/80/62/14/943806214.db2.gz OEDNDHOTJINZSD-HDJSIYSDSA-N 0 0 357.385 3.598 20 5 FHBDRN CN(C(=O)COc1cccc([N+](=O)[O-])c1)[C@H]1CC[C@@H](C(F)(F)F)CC1 ZINC000584865121 943813161 /nfs/dbraw/zinc/81/31/61/943813161.db2.gz NNLUXPFZPMTPBT-TXEJJXNPSA-N 0 0 360.332 3.553 20 5 FHBDRN CCOc1ccc(CNC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)cc1 ZINC000515368359 943814310 /nfs/dbraw/zinc/81/43/10/943814310.db2.gz VKHLVZWEUIIMOU-UHFFFAOYSA-N 0 0 369.421 3.524 20 5 FHBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NC1CC(C(C)(C)C)C1 ZINC000504802579 943817569 /nfs/dbraw/zinc/81/75/69/943817569.db2.gz IREDXAQLDTWCRF-ZBOXLXRLSA-N 0 0 354.834 3.956 20 5 FHBDRN CCC(=O)c1ccc(C(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000437466520 943819301 /nfs/dbraw/zinc/81/93/01/943819301.db2.gz AEHBMHXODODQKX-UHFFFAOYSA-N 0 0 352.390 3.992 20 5 FHBDRN O=[N+]([O-])c1cccc(OCc2nc(-c3cc(F)c(F)c(F)c3)no2)c1 ZINC000133789889 943821779 /nfs/dbraw/zinc/82/17/79/943821779.db2.gz NTOPSDLSVGLUPG-UHFFFAOYSA-N 0 0 351.240 3.641 20 5 FHBDRN COc1cccc(C(=O)N[C@@H]2C[C@@H]2c2c(F)cccc2Cl)c1[N+](=O)[O-] ZINC000435878314 943830093 /nfs/dbraw/zinc/83/00/93/943830093.db2.gz ZBLOCZAKCDCZAN-GXFFZTMASA-N 0 0 364.760 3.682 20 5 FHBDRN COc1cc(CNc2cc(C)n(-c3cccc(F)c3)n2)c([N+](=O)[O-])cc1F ZINC000184019932 943837414 /nfs/dbraw/zinc/83/74/14/943837414.db2.gz WPJZDCBSYXUAII-UHFFFAOYSA-N 0 0 374.347 3.988 20 5 FHBDRN O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@H]1Nc1ccc(COCCO)cc1 ZINC000424311483 943855248 /nfs/dbraw/zinc/85/52/48/943855248.db2.gz FJSVWVFPAJOXFO-YLJYHZDGSA-N 0 0 370.449 3.927 20 5 FHBDRN CSc1ccc(CCNC(=O)c2ccc([N+](=O)[O-])c3cccnc23)cc1 ZINC000437498419 943862552 /nfs/dbraw/zinc/86/25/52/943862552.db2.gz QYYHASNQCOOIDF-UHFFFAOYSA-N 0 0 367.430 3.837 20 5 FHBDRN Cn1cccc1[C@H]1CCCN1C(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000435936284 943868959 /nfs/dbraw/zinc/86/89/59/943868959.db2.gz OKPFURRNBHPEQH-OAQYLSRUSA-N 0 0 371.440 3.997 20 5 FHBDRN Cc1ccc(CN(C(=O)COc2ccc(C)cc2[N+](=O)[O-])C2CC2)cc1 ZINC000515425348 943868971 /nfs/dbraw/zinc/86/89/71/943868971.db2.gz ZXCDHVPDCUVYHY-UHFFFAOYSA-N 0 0 354.406 3.782 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])N[C@H]1CC[C@H](c2ccccc2F)C1 ZINC000435938047 943871502 /nfs/dbraw/zinc/87/15/02/943871502.db2.gz QJDGQFNAGYCPOL-KBPBESRZSA-N 0 0 357.385 3.598 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1CN1CCc2ccc(O)cc2C1 ZINC000425422584 943879409 /nfs/dbraw/zinc/87/94/09/943879409.db2.gz XNFVOBCMOYJCLE-UHFFFAOYSA-N 0 0 363.211 3.621 20 5 FHBDRN C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)N(C)CCC3CC3)cc2[N+](=O)[O-])C1 ZINC000437507750 943886652 /nfs/dbraw/zinc/88/66/52/943886652.db2.gz XGXKRCKDNOCTCE-GASCZTMLSA-N 0 0 359.470 3.949 20 5 FHBDRN CCN(C(=O)COc1cc(F)ccc1[N+](=O)[O-])[C@@H](C)c1ccc(F)cc1 ZINC000053367329 943889509 /nfs/dbraw/zinc/88/95/09/943889509.db2.gz AUAZSQBMPRITIE-LBPRGKRZSA-N 0 0 364.348 3.862 20 5 FHBDRN CCCc1n[nH]c(C(=O)N[C@@H]2C[C@H]2c2cccc3ccccc32)c1[N+](=O)[O-] ZINC000435972794 943895872 /nfs/dbraw/zinc/89/58/72/943895872.db2.gz RBTJQUFWJCMKCO-DOTOQJQBSA-N 0 0 364.405 3.710 20 5 FHBDRN O=C(NC[C@@H]1CCCOC1)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000515465993 943903502 /nfs/dbraw/zinc/90/35/02/943903502.db2.gz WZJDWOYOEUIDQJ-AWEZNQCLSA-N 0 0 371.393 3.935 20 5 FHBDRN CN(Cc1cccc(Cl)c1)C(=O)CSc1ccccc1[N+](=O)[O-] ZINC000517018697 943913780 /nfs/dbraw/zinc/91/37/80/943913780.db2.gz NZPKONSHMCXTHP-UHFFFAOYSA-N 0 0 350.827 3.999 20 5 FHBDRN CCSc1cccc(F)c1NS(=O)(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000517002122 943918185 /nfs/dbraw/zinc/91/81/85/943918185.db2.gz GJOYBYBUDPGHQW-UHFFFAOYSA-N 0 0 370.427 3.955 20 5 FHBDRN CN(Cc1cc(Br)cs1)c1nc2sccn2c1[N+](=O)[O-] ZINC000515496608 943924829 /nfs/dbraw/zinc/92/48/29/943924829.db2.gz YOEAVNCBVIKRHL-UHFFFAOYSA-N 0 0 373.257 3.764 20 5 FHBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC(OC(F)F)C1 ZINC000437592318 943935561 /nfs/dbraw/zinc/93/55/61/943935561.db2.gz QUMSOMNETNITLC-UHFFFAOYSA-N 0 0 360.382 3.551 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2noc(CCCOCCc3ccccc3)n2)c1 ZINC000504969596 943944218 /nfs/dbraw/zinc/94/42/18/943944218.db2.gz QNGBXWRSISBXJY-UHFFFAOYSA-N 0 0 353.378 3.837 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)NCCCOc2ccc(C)cc2)c1 ZINC000504971116 943945269 /nfs/dbraw/zinc/94/52/69/943945269.db2.gz NKZDOZRBTKTFOB-UHFFFAOYSA-N 0 0 360.435 3.824 20 5 FHBDRN COC[C@@H](C)Nc1ccccc1NC(=O)c1cc(OC)c(C)c([N+](=O)[O-])c1 ZINC000437615260 943953825 /nfs/dbraw/zinc/95/38/25/943953825.db2.gz OTWTZOVZBRCPDL-GFCCVEGCSA-N 0 0 373.409 3.611 20 5 FHBDRN COc1ccccc1CC(C)(C)NC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000515504058 943954119 /nfs/dbraw/zinc/95/41/19/943954119.db2.gz HVBPHPWFYFVCFW-AWEZNQCLSA-N 0 0 356.422 3.844 20 5 FHBDRN COC[C@H](C)Nc1ccccc1NC(=O)c1cc(OC)c(C)c([N+](=O)[O-])c1 ZINC000437615261 943954275 /nfs/dbraw/zinc/95/42/75/943954275.db2.gz OTWTZOVZBRCPDL-LBPRGKRZSA-N 0 0 373.409 3.611 20 5 FHBDRN COCc1ccc([C@H]2CCCN2C(=O)[C@H](C)c2cccc([N+](=O)[O-])c2)o1 ZINC000515506164 943955622 /nfs/dbraw/zinc/95/56/22/943955622.db2.gz CMPWOFUAQCQEJF-CXAGYDPISA-N 0 0 358.394 3.801 20 5 FHBDRN COc1ccc(F)c2[nH]c(-c3nc(-c4ccc(N)c([N+](=O)[O-])c4)no3)cc21 ZINC000566526534 943963139 /nfs/dbraw/zinc/96/31/39/943963139.db2.gz CZVJKDCXEASTQX-UHFFFAOYSA-N 0 0 369.312 3.523 20 5 FHBDRN O=[N+]([O-])c1cccc(-n2cc(-c3nc(-c4ccccc4Cl)no3)nn2)c1 ZINC000505009513 943966418 /nfs/dbraw/zinc/96/64/18/943966418.db2.gz UADACSSLUSCDFH-UHFFFAOYSA-N 0 0 368.740 3.546 20 5 FHBDRN Cc1cc(OCc2noc(-c3ccc(F)cc3F)n2)c(F)cc1[N+](=O)[O-] ZINC000436044039 943967859 /nfs/dbraw/zinc/96/78/59/943967859.db2.gz AXJSXKCELZDGPP-UHFFFAOYSA-N 0 0 365.267 3.950 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2cnn(Cc3cncn3Cc3ccccc3)c2)cc1 ZINC000437611451 943969205 /nfs/dbraw/zinc/96/92/05/943969205.db2.gz GEXWHQYHHMRSSI-UHFFFAOYSA-N 0 0 359.389 3.751 20 5 FHBDRN CCN(CCCNc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2)c1ccccc1 ZINC000515539954 943973848 /nfs/dbraw/zinc/97/38/48/943973848.db2.gz GOGGMXZBZGGGCB-UHFFFAOYSA-N 0 0 368.437 3.808 20 5 FHBDRN CCOc1cc(CN2CCC[C@@H](OCC(F)(F)F)C2)ccc1[N+](=O)[O-] ZINC000515544686 943979618 /nfs/dbraw/zinc/97/96/18/943979618.db2.gz FGVNJTZKORWCRW-CYBMUJFWSA-N 0 0 362.348 3.537 20 5 FHBDRN COc1cccc([C@H](C)Nc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])c1 ZINC000515550800 943985075 /nfs/dbraw/zinc/98/50/75/943985075.db2.gz LVVGNXYZZITNBF-LBPRGKRZSA-N 0 0 355.394 3.669 20 5 FHBDRN COc1cccc2c1OCC(c1nc(-c3cccc([N+](=O)[O-])c3)no1)=C2 ZINC000505031083 943988616 /nfs/dbraw/zinc/98/86/16/943988616.db2.gz SFWWLFNVXYCCBT-UHFFFAOYSA-N 0 0 351.318 3.586 20 5 FHBDRN CCOC(=O)c1cc(C(=O)N(C)c2ccc3cc[nH]c3c2)cc([N+](=O)[O-])c1 ZINC000473560998 944007042 /nfs/dbraw/zinc/00/70/42/944007042.db2.gz LCNIWDOUXLWTGP-UHFFFAOYSA-N 0 0 367.361 3.529 20 5 FHBDRN Cn1c(C(=O)Nc2ccc(-c3cnc(C4CC4)o3)cc2)ccc1[N+](=O)[O-] ZINC000500046202 944010479 /nfs/dbraw/zinc/01/04/79/944010479.db2.gz CQSDESSCHMTQJW-UHFFFAOYSA-N 0 0 352.350 3.718 20 5 FHBDRN O=c1[nH]cnc2cc(N3CCC[C@@H](c4ccccc4)C3)c([N+](=O)[O-])cc12 ZINC000515582527 944016124 /nfs/dbraw/zinc/01/61/24/944016124.db2.gz FZSIDTRCJMBXIA-CQSZACIVSA-N 0 0 350.378 3.628 20 5 FHBDRN O=C(N[C@@H](c1ccc(F)c(Cl)c1)C(F)(F)F)c1cc([N+](=O)[O-])c[nH]1 ZINC000436101750 944017260 /nfs/dbraw/zinc/01/72/60/944017260.db2.gz LWRYMRWKIKLNRD-NSHDSACASA-N 0 0 365.670 3.749 20 5 FHBDRN Cc1nc(NC(=O)NCCc2ccccc2[N+](=O)[O-])sc1C(F)(F)F ZINC000557694491 944020785 /nfs/dbraw/zinc/02/07/85/944020785.db2.gz OIFDYRATXKKNPD-UHFFFAOYSA-N 0 0 374.344 3.743 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F ZINC000424615152 944028042 /nfs/dbraw/zinc/02/80/42/944028042.db2.gz XNFYMIWLOMRSFI-BGHVQYPCSA-N 0 0 370.371 3.868 20 5 FHBDRN Cc1cc([N+](=O)[O-])cnc1Sc1nnc(-c2ccccc2Cl)n1C ZINC000092584239 944033207 /nfs/dbraw/zinc/03/32/07/944033207.db2.gz OLVPCGBQFCHROS-UHFFFAOYSA-N 0 0 361.814 3.898 20 5 FHBDRN CN1CC(=O)N[C@@H]1c1ccc(Oc2ccc(C(C)(C)C)cc2)c([N+](=O)[O-])c1 ZINC000515597323 944033999 /nfs/dbraw/zinc/03/39/99/944033999.db2.gz RMJQUMZHADNHTE-IBGZPJMESA-N 0 0 369.421 3.745 20 5 FHBDRN Cc1cc(Br)cc(C)c1CNC(=O)c1csc([N+](=O)[O-])c1 ZINC000500066701 944038930 /nfs/dbraw/zinc/03/89/30/944038930.db2.gz WBDWRPLVYYCWOK-UHFFFAOYSA-N 0 0 369.240 3.966 20 5 FHBDRN O=[N+]([O-])c1ccccc1Oc1ccc2nnc(-c3ccccc3F)n2n1 ZINC000092581493 944045135 /nfs/dbraw/zinc/04/51/35/944045135.db2.gz IOXZSBOFAZOWRT-UHFFFAOYSA-N 0 0 351.297 3.631 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)NC1(c2ccc(Cl)cc2)CCOCC1 ZINC000505119236 944049147 /nfs/dbraw/zinc/04/91/47/944049147.db2.gz ZLWKYYGLYKNIOG-UHFFFAOYSA-N 0 0 374.824 3.613 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@H](c2ccccc2Cl)C1 ZINC000505123838 944052422 /nfs/dbraw/zinc/05/24/22/944052422.db2.gz HQPICXFRDHJIIZ-QGZVFWFLSA-N 0 0 360.797 3.770 20 5 FHBDRN COc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2Br)cc1F ZINC000150724884 944064802 /nfs/dbraw/zinc/06/48/02/944064802.db2.gz LVFIUIDIOVWNOS-UHFFFAOYSA-N 0 0 369.146 3.757 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CSCc1cn(-c2ccccc2)nn1 ZINC000517174879 944066035 /nfs/dbraw/zinc/06/60/35/944066035.db2.gz FOVHCCBOYCDZCD-UHFFFAOYSA-N 0 0 356.407 3.618 20 5 FHBDRN CC(C)[C@@]1(CO)CCCN(Cc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000425478212 944075646 /nfs/dbraw/zinc/07/56/46/944075646.db2.gz MJNNKROBAVQWKE-INIZCTEOSA-N 0 0 371.275 3.588 20 5 FHBDRN CCOc1cc(N2CC[C@@](CO)(Cc3ccc(F)cc3)C2)ccc1[N+](=O)[O-] ZINC000517197572 944081163 /nfs/dbraw/zinc/08/11/63/944081163.db2.gz QPWGJBFQBMZWEC-HXUWFJFHSA-N 0 0 374.412 3.564 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N(C)CCCOc1ccccc1 ZINC000123084412 944085174 /nfs/dbraw/zinc/08/51/74/944085174.db2.gz UTZRJFWGLGLYSC-UHFFFAOYSA-N 0 0 359.382 3.536 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)N1CC[C@@H](c2ccccc2F)C1 ZINC000500093239 944085712 /nfs/dbraw/zinc/08/57/12/944085712.db2.gz YUOWCBNCPOIGMV-OAHLLOKOSA-N 0 0 371.412 3.942 20 5 FHBDRN CCOc1ccc(Oc2ccccc2NC(=O)c2cc([N+](=O)[O-])n[nH]2)cc1 ZINC000505148307 944093102 /nfs/dbraw/zinc/09/31/02/944093102.db2.gz HFBHIMDGEAWHOZ-UHFFFAOYSA-N 0 0 368.349 3.761 20 5 FHBDRN CCOC(=O)c1cc(NCCCn2cnc3ccccc32)ccc1[N+](=O)[O-] ZINC000436195548 944106771 /nfs/dbraw/zinc/10/67/71/944106771.db2.gz FOWPBBGSXGXANK-UHFFFAOYSA-N 0 0 368.393 3.623 20 5 FHBDRN O=[N+]([O-])c1cn(CC[S@](=O)c2cc(Cl)ccc2Cl)nc1C1CC1 ZINC000436199473 944109327 /nfs/dbraw/zinc/10/93/27/944109327.db2.gz RZPFTMRBYGCDGL-QHCPKHFHSA-N 0 0 374.249 3.783 20 5 FHBDRN O=C(NCc1ccsc1Br)Nc1ccc([N+](=O)[O-])cc1 ZINC000388525140 944131936 /nfs/dbraw/zinc/13/19/36/944131936.db2.gz DJULZPYJAUVCMD-UHFFFAOYSA-N 0 0 356.201 3.741 20 5 FHBDRN CCc1noc(-c2ccn(-c3c(Cl)cc([N+](=O)[O-])cc3Cl)n2)n1 ZINC000545524135 944134785 /nfs/dbraw/zinc/13/47/85/944134785.db2.gz QVTPRNSIWWMCOC-UHFFFAOYSA-N 0 0 354.153 3.700 20 5 FHBDRN C[C@@H](Nc1ccc([N+](=O)[O-])c(OC(F)F)c1)[C@H](O)c1ccc(F)cc1 ZINC000092653342 944137425 /nfs/dbraw/zinc/13/74/25/944137425.db2.gz QJKWKTFGCOOGIU-PSLIRLAXSA-N 0 0 356.300 3.869 20 5 FHBDRN C[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1F)c1ccc(-n2cccn2)c(F)c1 ZINC000505212225 944140770 /nfs/dbraw/zinc/14/07/70/944140770.db2.gz YTQKQQGIMNMKGT-LLVKDONJSA-N 0 0 372.331 3.550 20 5 FHBDRN Cc1nc2ccccc2n1CCC(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000500126839 944141186 /nfs/dbraw/zinc/14/11/86/944141186.db2.gz YDOMOMCFIAUKDA-CQSZACIVSA-N 0 0 366.421 3.829 20 5 FHBDRN Cc1ccc(-c2ccnn2C)cc1NC(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000500126850 944141317 /nfs/dbraw/zinc/14/13/17/944141317.db2.gz VCUSXZWWTSYIMP-UHFFFAOYSA-N 0 0 351.366 3.948 20 5 FHBDRN Cc1c(NC(=O)N2CC[C@@]3(C2)CCc2ccccc2O3)cccc1[N+](=O)[O-] ZINC000517264137 944144339 /nfs/dbraw/zinc/14/43/39/944144339.db2.gz ORZBCRPRKVCVKF-HXUWFJFHSA-N 0 0 367.405 3.905 20 5 FHBDRN CC(C)(C)[C@@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1F)c1ccccc1 ZINC000515713230 944144971 /nfs/dbraw/zinc/14/49/71/944144971.db2.gz KKXILMGFQNXPIR-INIZCTEOSA-N 0 0 366.414 3.800 20 5 FHBDRN O=C(COc1ccccc1[N+](=O)[O-])NC1(c2ccccc2)CCCCC1 ZINC000505218785 944145766 /nfs/dbraw/zinc/14/57/66/944145766.db2.gz XPEKBUCJBAVADZ-UHFFFAOYSA-N 0 0 354.406 3.949 20 5 FHBDRN CCOc1ccc([C@@H]2C[C@H]2NC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 ZINC000436261792 944153724 /nfs/dbraw/zinc/15/37/24/944153724.db2.gz KTXRUVPYHPFQDA-FUHWJXTLSA-N 0 0 355.394 3.980 20 5 FHBDRN Cc1ccc(C[C@@H]2CCCN2S(=O)(=O)c2cccc([N+](=O)[O-])c2C)cc1 ZINC000500143381 944156932 /nfs/dbraw/zinc/15/69/32/944156932.db2.gz PXKADSDFTCOORL-KRWDZBQOSA-N 0 0 374.462 3.607 20 5 FHBDRN CN(CCOc1ccc(F)cc1)c1cc(C(F)(F)F)ncc1[N+](=O)[O-] ZINC000436269825 944169487 /nfs/dbraw/zinc/16/94/87/944169487.db2.gz ZUXXAIOXCACTIA-UHFFFAOYSA-N 0 0 359.279 3.663 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)F)cc1NCc1cn2cc(Cl)ccc2n1 ZINC000436271538 944169651 /nfs/dbraw/zinc/16/96/51/944169651.db2.gz DUORYLYUEXPWEI-UHFFFAOYSA-N 0 0 371.706 3.922 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@@H](c1ccc(F)cc1)C(C)C ZINC000544124495 944172902 /nfs/dbraw/zinc/17/29/02/944172902.db2.gz VEAQUQGLSPQSHW-GOSISDBHSA-N 0 0 360.385 3.799 20 5 FHBDRN CNC(=O)c1ccc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)cc1Cl ZINC000515735005 944173559 /nfs/dbraw/zinc/17/35/59/944173559.db2.gz BWMFNXMJRBBSGO-UHFFFAOYSA-N 0 0 373.752 3.606 20 5 FHBDRN Cc1ccc(S(=O)(=O)N2CCC[C@](C)(c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000500152369 944175272 /nfs/dbraw/zinc/17/52/72/944175272.db2.gz XPALGYLTEJVDFB-IBGZPJMESA-N 0 0 374.462 3.646 20 5 FHBDRN CC(C)[C@@H]1CCC[C@H](NC(=O)c2cc3c(cc2[N+](=O)[O-])OCCCO3)C1 ZINC001125929074 944198675 /nfs/dbraw/zinc/19/86/75/944198675.db2.gz KAAFQZARYBKUKX-KGLIPLIRSA-N 0 0 362.426 3.701 20 5 FHBDRN Cc1c(Br)cc(C(=O)N2CC[C@H](C)[C@H](C)C2)cc1[N+](=O)[O-] ZINC000500169075 944205183 /nfs/dbraw/zinc/20/51/83/944205183.db2.gz PSKWWUAINFPGOU-VHSXEESVSA-N 0 0 355.232 3.784 20 5 FHBDRN COC(=O)c1sc(N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)nc1Cl ZINC000092667558 944206128 /nfs/dbraw/zinc/20/61/28/944206128.db2.gz WUUDUZGRSWCQER-QMMMGPOBSA-N 0 0 355.803 3.973 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)N1CCC[C@@H](Cc2ccccc2)C1 ZINC000517318053 944207092 /nfs/dbraw/zinc/20/70/92/944207092.db2.gz DRKSWVVOPDHETO-SFHVURJKSA-N 0 0 353.422 3.759 20 5 FHBDRN Cc1nn(Cc2ccc(C(=O)N3C[C@@H](C)CC[C@@H]3C)cc2)c(C)c1[N+](=O)[O-] ZINC000436333467 944211324 /nfs/dbraw/zinc/21/13/24/944211324.db2.gz JRXLRWUKQDVAAX-KBPBESRZSA-N 0 0 370.453 3.717 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CCC[C@@](C)(c2ccccc2)C1 ZINC000500182724 944219346 /nfs/dbraw/zinc/21/93/46/944219346.db2.gz KMFXSATVYCZTAN-OAQYLSRUSA-N 0 0 367.449 3.895 20 5 FHBDRN COCC[C@@H](Cc1ccco1)Nc1cc(C(F)(F)F)ncc1[N+](=O)[O-] ZINC000436357259 944225168 /nfs/dbraw/zinc/22/51/68/944225168.db2.gz HTMSHKRVFHYCJB-JTQLQIEISA-N 0 0 359.304 3.661 20 5 FHBDRN Cc1cc(NC(=O)CSc2ccccc2)n(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000105585386 944227595 /nfs/dbraw/zinc/22/75/95/944227595.db2.gz CFFFQYPOFUXKTQ-UHFFFAOYSA-N 0 0 368.418 3.820 20 5 FHBDRN COCCN(C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CCC[C@H]1C ZINC000518287161 944237233 /nfs/dbraw/zinc/23/72/33/944237233.db2.gz VGVJOJFUDXXTID-IAQYHMDHSA-N 0 0 355.822 3.917 20 5 FHBDRN Cc1ccc(C)c(CC(=O)Nc2ccnn2-c2ccc([N+](=O)[O-])cc2)c1 ZINC000518299007 944245269 /nfs/dbraw/zinc/24/52/69/944245269.db2.gz QGMZGBLZDUQXLY-UHFFFAOYSA-N 0 0 350.378 3.579 20 5 FHBDRN Cc1noc(-c2ccc(C)c(NC(=O)c3ccc([N+](=O)[O-])cc3F)c2)n1 ZINC000518299409 944246141 /nfs/dbraw/zinc/24/61/41/944246141.db2.gz FWRLVPXYXQPBIX-UHFFFAOYSA-N 0 0 356.313 3.653 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1F)c1ccc2[nH]c(C(F)F)nc2c1 ZINC000517365321 944247010 /nfs/dbraw/zinc/24/70/10/944247010.db2.gz SQICAPMWKSSIHM-UHFFFAOYSA-N 0 0 350.256 3.800 20 5 FHBDRN CCCOc1ccc(CNc2cc(C(F)(F)F)ncc2[N+](=O)[O-])cn1 ZINC000436380877 944250649 /nfs/dbraw/zinc/25/06/49/944250649.db2.gz DXGUHVUEVXOFFB-UHFFFAOYSA-N 0 0 356.304 3.805 20 5 FHBDRN Cc1cc(NCCc2cccc(C(N)=O)c2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000549490215 944252514 /nfs/dbraw/zinc/25/25/14/944252514.db2.gz NYOVSEHUHKOTKF-UHFFFAOYSA-N 0 0 367.327 3.676 20 5 FHBDRN CCOC1(CNC(=O)c2ccnc(-c3ccccc3)c2[N+](=O)[O-])CCCC1 ZINC000506462758 944256477 /nfs/dbraw/zinc/25/64/77/944256477.db2.gz JQISJNBQBZRICD-UHFFFAOYSA-N 0 0 369.421 3.736 20 5 FHBDRN Cc1cc(NC(=O)N[C@@H]2C[C@H]2c2cc(F)c(F)c(F)c2)ccc1[N+](=O)[O-] ZINC000436379320 944265826 /nfs/dbraw/zinc/26/58/26/944265826.db2.gz PWIGOQRFENSMOH-SMDDNHRTSA-N 0 0 365.311 3.998 20 5 FHBDRN C[C@H](Sc1ccc(Cl)nn1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000010653488 944267253 /nfs/dbraw/zinc/26/72/53/944267253.db2.gz CQYBQURPORJRNF-ZETCQYMHSA-N 0 0 373.221 3.811 20 5 FHBDRN COc1ccc(CNC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)c(F)c1 ZINC000437986153 944269276 /nfs/dbraw/zinc/26/92/76/944269276.db2.gz KYDXJIRFUKXKAR-UHFFFAOYSA-N 0 0 373.384 3.617 20 5 FHBDRN Cc1ccc(CCCCC(=O)NCCOc2ccc([N+](=O)[O-])cc2)cc1 ZINC000518309585 944271741 /nfs/dbraw/zinc/27/17/41/944271741.db2.gz VXEQSAWTLDVUKS-UHFFFAOYSA-N 0 0 356.422 3.811 20 5 FHBDRN CC[S@](=O)[C@@H]1CCC[C@H](Nc2cc(C(F)(F)F)ncc2[N+](=O)[O-])C1 ZINC000436401318 944277556 /nfs/dbraw/zinc/27/75/56/944277556.db2.gz ORLRGQQODMCDKE-ROXXKOOQSA-N 0 0 365.377 3.500 20 5 FHBDRN CCc1nc2cc(NC(=O)c3cc(OC)c(OC)cc3[N+](=O)[O-])ccc2o1 ZINC000517410184 944278679 /nfs/dbraw/zinc/27/86/79/944278679.db2.gz FCLQUKOPLYPXLA-UHFFFAOYSA-N 0 0 371.349 3.568 20 5 FHBDRN COc1ccc(CCCNC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)cc1 ZINC000515871303 944288126 /nfs/dbraw/zinc/28/81/26/944288126.db2.gz HRPCJOQRLKYNSX-AWEZNQCLSA-N 0 0 374.462 3.833 20 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944316045 /nfs/dbraw/zinc/31/60/45/944316045.db2.gz KGZDMEQCSPSTQL-PKOBYXMFSA-N 0 0 365.433 3.999 20 5 FHBDRN O=C(N[C@@H]1CCC[C@@H]1OCc1ccccc1)c1ccc([N+](=O)[O-])cc1F ZINC000123266416 944322344 /nfs/dbraw/zinc/32/23/44/944322344.db2.gz RDQPCKJLZOFRBY-MSOLQXFVSA-N 0 0 358.369 3.602 20 5 FHBDRN COC(=O)c1ccc(NC(=O)c2c(C)cc(Cl)cc2[N+](=O)[O-])cc1C ZINC000439111290 944338819 /nfs/dbraw/zinc/33/88/19/944338819.db2.gz VSRNCWMXLHKKCG-UHFFFAOYSA-N 0 0 362.769 3.904 20 5 FHBDRN CNC(=O)c1ccc(NCc2ccc(C(F)(F)F)cc2)c([N+](=O)[O-])c1 ZINC000053554160 944344028 /nfs/dbraw/zinc/34/40/28/944344028.db2.gz VFCSIIFAJNYAKJ-UHFFFAOYSA-N 0 0 353.300 3.585 20 5 FHBDRN Cc1oc2ccccc2c1CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000184043953 944351626 /nfs/dbraw/zinc/35/16/26/944351626.db2.gz RYPZFUNSMUUHGN-UHFFFAOYSA-N 0 0 363.373 3.990 20 5 FHBDRN CN(Cc1ccccc1OC(F)(F)F)C(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000105722490 944362223 /nfs/dbraw/zinc/36/22/23/944362223.db2.gz ZESNBTGODDNOBZ-UHFFFAOYSA-N 0 0 368.311 3.695 20 5 FHBDRN COc1ccc2ccc(C(=O)NCc3cccc([N+](=O)[O-])c3C)cc2c1 ZINC000506180934 944365928 /nfs/dbraw/zinc/36/59/28/944365928.db2.gz XEGUNNWIAJWYHK-UHFFFAOYSA-N 0 0 350.374 3.995 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)N1CCC[C@H]1c1cccnc1 ZINC000467215885 944380714 /nfs/dbraw/zinc/38/07/14/944380714.db2.gz HISMOQSQEOEWMF-INIZCTEOSA-N 0 0 360.801 3.690 20 5 FHBDRN Cc1cc(F)cc(C(=O)O[C@H](C)c2cn(-c3ccccc3)nn2)c1[N+](=O)[O-] ZINC000123586183 944385839 /nfs/dbraw/zinc/38/58/39/944385839.db2.gz GYMSLKFNPLXGPF-GFCCVEGCSA-N 0 0 370.340 3.541 20 5 FHBDRN C[C@H](OC(=O)c1c(Cl)cccc1[N+](=O)[O-])c1cn(-c2ccccc2)nn1 ZINC000123585106 944385945 /nfs/dbraw/zinc/38/59/45/944385945.db2.gz BWEHLYOKWKJZSX-NSHDSACASA-N 0 0 372.768 3.747 20 5 FHBDRN C[C@H]1CN(c2ccccc2NC(=O)c2cc(F)cc([N+](=O)[O-])c2)C[C@H](C)O1 ZINC000517557828 944390330 /nfs/dbraw/zinc/39/03/30/944390330.db2.gz RIMWUNSKYDKBKK-STQMWFEESA-N 0 0 373.384 3.600 20 5 FHBDRN Cc1cccc(OCCc2nc(Cc3ccccc3[N+](=O)[O-])no2)c1C ZINC000545533645 944391340 /nfs/dbraw/zinc/39/13/40/944391340.db2.gz FLGQAMPSZPILHG-UHFFFAOYSA-N 0 0 353.378 3.807 20 5 FHBDRN Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)c1cc(F)cc([N+](=O)[O-])c1 ZINC000517561469 944391926 /nfs/dbraw/zinc/39/19/26/944391926.db2.gz HTEKDZWWIBQLHW-UHFFFAOYSA-N 0 0 371.368 3.531 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@@H]1CCC[C@H]1c1ccccc1 ZINC000518440231 944392149 /nfs/dbraw/zinc/39/21/49/944392149.db2.gz FBLAIHICLKIYOZ-DLBZAZTESA-N 0 0 360.435 3.518 20 5 FHBDRN CCOc1ccc([C@@H]2C[C@H]2NC(=O)N(C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000437891898 944392165 /nfs/dbraw/zinc/39/21/65/944392165.db2.gz WEYBDGGWMJIUTL-ZWKOTPCHSA-N 0 0 369.421 3.691 20 5 FHBDRN Cc1cc(NC(=O)Nc2cccc([N+](=O)[O-])c2C)nn1C1CCCCC1 ZINC000518443122 944395593 /nfs/dbraw/zinc/39/55/93/944395593.db2.gz BCUPNLUZBVXUQP-UHFFFAOYSA-N 0 0 357.414 3.979 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)c2cccc3ccc(=O)[nH]c32)cc1[N+](=O)[O-] ZINC000519567111 944398844 /nfs/dbraw/zinc/39/88/44/944398844.db2.gz YTZZBEKYXAYQOB-GFCCVEGCSA-N 0 0 351.362 3.648 20 5 FHBDRN Cc1nn(CN2CCC(c3ccc(F)c(F)c3)CC2)c(C)c1[N+](=O)[O-] ZINC000729466061 944400235 /nfs/dbraw/zinc/40/02/35/944400235.db2.gz MAVJEZUXRHQPTL-UHFFFAOYSA-N 0 0 350.369 3.523 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@](C)(O)[C@@H](C)CC ZINC000506500597 944400803 /nfs/dbraw/zinc/40/08/03/944400803.db2.gz QTISGIBQAXNRHM-SJCJKPOMSA-N 0 0 354.472 3.624 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)NCc2ccc(C)cc2C)cc1OC ZINC000105910669 944401401 /nfs/dbraw/zinc/40/14/01/944401401.db2.gz HWSJIYJFECQDFP-UHFFFAOYSA-N 0 0 358.394 3.549 20 5 FHBDRN C[C@H](C1CC1)N(C)C(=O)c1ccc(N2C[C@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000500278370 944404453 /nfs/dbraw/zinc/40/44/53/944404453.db2.gz HEMZWWXROYEVJF-QLFBSQMISA-N 0 0 359.470 3.948 20 5 FHBDRN COC(=O)c1cc(NC(=O)C/C=C/c2ccccc2F)cc([N+](=O)[O-])c1 ZINC000426299370 944406019 /nfs/dbraw/zinc/40/60/19/944406019.db2.gz VKBYBNXZTOLKGQ-GQCTYLIASA-N 0 0 358.325 3.563 20 5 FHBDRN O=C(Nc1ccnn1Cc1ccccc1F)c1ccc([N+](=O)[O-])cc1Cl ZINC000105974086 944406356 /nfs/dbraw/zinc/40/63/56/944406356.db2.gz BQGYYRLIWYBHEU-UHFFFAOYSA-N 0 0 374.759 3.884 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)CCSc1ccc(C)cc1 ZINC000544125329 944408222 /nfs/dbraw/zinc/40/82/22/944408222.db2.gz HMMBBHMIVHSOHB-UHFFFAOYSA-N 0 0 360.435 3.710 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])o1)N1CC[C@H](Oc2ccc(Cl)c(Cl)c2)C1 ZINC000154086575 944412134 /nfs/dbraw/zinc/41/21/34/944412134.db2.gz UDUPBQQVQVJVKF-JTQLQIEISA-N 0 0 371.176 3.788 20 5 FHBDRN Cc1ccc([C@H]2CCCN2C(=O)NCCOc2ccc([N+](=O)[O-])cc2)cc1 ZINC000517589672 944421252 /nfs/dbraw/zinc/42/12/52/944421252.db2.gz NCLAGWZUMVWTDJ-LJQANCHMSA-N 0 0 369.421 3.829 20 5 FHBDRN Cc1cc(NC(=O)NCc2cccc(OC(F)F)c2)ccc1[N+](=O)[O-] ZINC000473776082 944428815 /nfs/dbraw/zinc/42/88/15/944428815.db2.gz AOAMASDDYXTSEE-UHFFFAOYSA-N 0 0 351.309 3.826 20 5 FHBDRN O=C(c1cccc([N+](=O)[O-])c1Br)N1CCC[C@@H]2CCC[C@H]21 ZINC000159127949 944428785 /nfs/dbraw/zinc/42/87/85/944428785.db2.gz LCGCNHYEVWESCP-CMPLNLGQSA-N 0 0 353.216 3.762 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])Nc1cccc(Cl)c1-n1cccn1 ZINC000046777454 944436093 /nfs/dbraw/zinc/43/60/93/944436093.db2.gz NNHZMFPGXIXJGO-UHFFFAOYSA-N 0 0 356.769 3.615 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)NCc1ccccc1OC1CCCC1 ZINC000046780547 944436170 /nfs/dbraw/zinc/43/61/70/944436170.db2.gz IVGKQMDZPNGFDA-UHFFFAOYSA-N 0 0 355.394 3.550 20 5 FHBDRN CCOc1ccccc1[C@H](CC)NC(=O)c1ccc([N+](=O)[O-])c(OC)c1 ZINC000505848842 944437233 /nfs/dbraw/zinc/43/72/33/944437233.db2.gz AGJPBXJKTKZWMI-HNNXBMFYSA-N 0 0 358.394 3.883 20 5 FHBDRN CO[C@@H]1Cc2ccccc2N(C(=O)c2ccc(SC)c([N+](=O)[O-])c2)C1 ZINC000500294783 944438153 /nfs/dbraw/zinc/43/81/53/944438153.db2.gz AFRACBSXKDKVLK-CQSZACIVSA-N 0 0 358.419 3.535 20 5 FHBDRN CC(=O)c1cnc(NC(=O)c2c([N+](=O)[O-])cccc2C(F)(F)F)s1 ZINC000517626743 944442908 /nfs/dbraw/zinc/44/29/08/944442908.db2.gz JULYYOHLEUSMAV-UHFFFAOYSA-N 0 0 359.285 3.525 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1COC(=O)c1nc(C)oc1-c1ccccc1 ZINC000759824061 944443729 /nfs/dbraw/zinc/44/37/29/944443729.db2.gz JRXFKCFMFRSMHI-UHFFFAOYSA-N 0 0 368.345 3.924 20 5 FHBDRN Cc1ccc2c(c1)[C@@H](NC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1)CO2 ZINC000123845053 944444583 /nfs/dbraw/zinc/44/45/83/944444583.db2.gz TZUAZTUOOOGAMG-KRWDZBQOSA-N 0 0 367.405 3.711 20 5 FHBDRN CC[C@@H]1CCCCN1C(=O)[C@@H](C)OC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000011028876 944458010 /nfs/dbraw/zinc/45/80/10/944458010.db2.gz RBTGPXHNPJQECX-VXGBXAGGSA-N 0 0 368.817 3.585 20 5 FHBDRN O=C(N[C@H]1C[C@@H]1c1ccccc1C(F)(F)F)c1cc([O-])cc([N+](=O)[O-])c1 ZINC000506198792 944459429 /nfs/dbraw/zinc/45/94/29/944459429.db2.gz KWTOEIXCNFNOOH-HIFRSBDPSA-N 0 0 366.295 3.605 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CC[C@H](C)C[C@@H]1c1ccco1 ZINC000439233538 944460443 /nfs/dbraw/zinc/46/04/43/944460443.db2.gz ZFZPQGMUWLVPRC-SWLSCSKDSA-N 0 0 364.423 3.658 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)NC[C@@H]2CCc3ccccc32)cc1SC ZINC000110377507 944467508 /nfs/dbraw/zinc/46/75/08/944467508.db2.gz DBYFQUQKGLFOBT-ZDUSSCGKSA-N 0 0 372.446 3.785 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1CC[C@H](C)C[C@H]1c1ccco1 ZINC000439238981 944468485 /nfs/dbraw/zinc/46/84/85/944468485.db2.gz QKNYWKGPNVNIIE-WFASDCNBSA-N 0 0 364.423 3.658 20 5 FHBDRN CCn1c(SCCOc2cccc([N+](=O)[O-])c2)nnc1-c1ccco1 ZINC000046875472 944477305 /nfs/dbraw/zinc/47/73/05/944477305.db2.gz SYCJAFYSLPVNMR-UHFFFAOYSA-N 0 0 360.395 3.637 20 5 FHBDRN O=[N+]([O-])c1ccc(NC(=S)NCc2ccccc2OC(F)(F)F)cc1 ZINC000017517386 944479320 /nfs/dbraw/zinc/47/93/20/944479320.db2.gz WRKNRMSGFXSIJS-UHFFFAOYSA-N 0 0 371.340 3.980 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)N[C@@H](C)c2ccc3n[nH]cc3c2)cc1[N+](=O)[O-] ZINC000516103574 944485208 /nfs/dbraw/zinc/48/52/08/944485208.db2.gz UGQDLGUQIMNHTE-QWHCGFSZSA-N 0 0 367.409 3.901 20 5 FHBDRN Cc1cc(Nc2ccc([N+](=O)[O-])c(OC(F)F)c2)nn1[C@H](C)C1CC1 ZINC000544128047 944492439 /nfs/dbraw/zinc/49/24/39/944492439.db2.gz BMQFPYLUQQAFCN-SNVBAGLBSA-N 0 0 352.341 3.838 20 5 FHBDRN CCC[C@H](NC(=O)CN(C)CCc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000516094317 944492714 /nfs/dbraw/zinc/49/27/14/944492714.db2.gz XWWKECWNCPJUJN-FQEVSTJZSA-N 0 0 369.465 3.727 20 5 FHBDRN C[C@@H](C1CC1)n1nccc1NC(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000072753161 944495784 /nfs/dbraw/zinc/49/57/84/944495784.db2.gz DEKAXRXMAQPRIZ-ZDUSSCGKSA-N 0 0 357.414 3.593 20 5 FHBDRN O=C(c1c[nH]c2cc([N+](=O)[O-])ccc12)N1C[C@@H]2CCCN2c2ccccc21 ZINC000517673275 944497552 /nfs/dbraw/zinc/49/75/52/944497552.db2.gz NVNRLIXOVRQKKV-AWEZNQCLSA-N 0 0 362.389 3.705 20 5 FHBDRN CCOC(=O)[C@@H](Cc1ccccc1)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000438315619 944498418 /nfs/dbraw/zinc/49/84/18/944498418.db2.gz TZBSNMQVCZFDOT-MAUKXSAKSA-N 0 0 356.422 3.728 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCCc1cccc(O)c1 ZINC000506207544 944501038 /nfs/dbraw/zinc/50/10/38/944501038.db2.gz FOFHFAXMWARLBS-UHFFFAOYSA-N 0 0 360.435 3.775 20 5 FHBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)NC2(Cc3ccccc3)CCCC2)cc1 ZINC000519569698 944502953 /nfs/dbraw/zinc/50/29/53/944502953.db2.gz UJWPEWNAXJRTSM-UHFFFAOYSA-N 0 0 374.462 3.570 20 5 FHBDRN CCc1cccc2c(CCNC(=O)c3ccc([N+](=O)[O-])cc3C)c[nH]c21 ZINC000517678061 944505439 /nfs/dbraw/zinc/50/54/39/944505439.db2.gz SBDOBINXQBXGTH-UHFFFAOYSA-N 0 0 351.406 3.919 20 5 FHBDRN Cc1nc(-c2ccccc2)sc1C(=O)N(C)c1ccc([N+](=O)[O-])nc1 ZINC000439303194 944505862 /nfs/dbraw/zinc/50/58/62/944505862.db2.gz WPWDLCCQEXBXGG-UHFFFAOYSA-N 0 0 354.391 3.698 20 5 FHBDRN Nc1c(C(=O)Nc2ccc3c4c(cccc42)CC3)cc(F)cc1[N+](=O)[O-] ZINC000110481674 944506740 /nfs/dbraw/zinc/50/67/40/944506740.db2.gz FDSUDZNHOCLKCP-UHFFFAOYSA-N 0 0 351.337 3.820 20 5 FHBDRN COc1ccccc1Cc1noc(C(C)(C)c2ccccc2[N+](=O)[O-])n1 ZINC000426340989 944510713 /nfs/dbraw/zinc/51/07/13/944510713.db2.gz XSUZMKDCBWHVQO-UHFFFAOYSA-N 0 0 353.378 3.903 20 5 FHBDRN CN(CCC1CCCCC1)S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000509727603 944511194 /nfs/dbraw/zinc/51/11/94/944511194.db2.gz FKBQKUFCOWQSLU-UHFFFAOYSA-N 0 0 360.863 3.839 20 5 FHBDRN COc1ccc(NC(=O)NCc2nc(C(C)(C)C)cs2)cc1[N+](=O)[O-] ZINC000543890516 944512355 /nfs/dbraw/zinc/51/23/55/944512355.db2.gz SUCZNNPUALZEBJ-UHFFFAOYSA-N 0 0 364.427 3.679 20 5 FHBDRN O=[N+]([O-])c1ccn(C2CCN(Cc3cc(F)cc(C(F)(F)F)c3)CC2)n1 ZINC000425980715 944512550 /nfs/dbraw/zinc/51/25/50/944512550.db2.gz LZLKPVMXCLCLFO-UHFFFAOYSA-N 0 0 372.322 3.786 20 5 FHBDRN O=C(Nc1nccc2sccc21)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000162692767 944527696 /nfs/dbraw/zinc/52/76/96/944527696.db2.gz OCOBVQLDQZEJGM-UHFFFAOYSA-N 0 0 365.374 3.643 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]c(Cn3c4ccccc4nc3C(F)(F)F)nc2c1 ZINC000473794821 944527914 /nfs/dbraw/zinc/52/79/14/944527914.db2.gz FQHTXUKGUULCTF-UHFFFAOYSA-N 0 0 361.283 3.888 20 5 FHBDRN CC(C)c1ccc(C(=O)N(C)[C@H](CCO)c2ccccc2)cc1[N+](=O)[O-] ZINC000439333055 944531636 /nfs/dbraw/zinc/53/16/36/944531636.db2.gz WBGMEGCWRFMXDC-GOSISDBHSA-N 0 0 356.422 3.914 20 5 FHBDRN Cc1ccc(NC(=O)N[C@@H](CO)c2cccc(Cl)c2F)cc1[N+](=O)[O-] ZINC000439335352 944532443 /nfs/dbraw/zinc/53/24/43/944532443.db2.gz ZUTFVAVIDOHQFQ-ZDUSSCGKSA-N 0 0 367.764 3.551 20 5 FHBDRN CC(C)c1ccc(C(=O)N2CCO[C@@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000439336480 944533152 /nfs/dbraw/zinc/53/31/52/944533152.db2.gz JSVLTOODTFPLRL-LJQANCHMSA-N 0 0 354.406 3.932 20 5 FHBDRN COc1cc(OC2CC2)ccc1-c1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000518613405 944535860 /nfs/dbraw/zinc/53/58/60/944535860.db2.gz XFABAPCQWIGGRE-UHFFFAOYSA-N 0 0 353.334 3.862 20 5 FHBDRN Cc1ccc(NC(=O)N(C)C)cc1NC(=O)c1cc([N+](=O)[O-])ccc1C ZINC000437905885 944546284 /nfs/dbraw/zinc/54/62/84/944546284.db2.gz GDRBHAYMPUMPCI-UHFFFAOYSA-N 0 0 356.382 3.557 20 5 FHBDRN O=[N+]([O-])c1ccccc1OCCSc1ccc(Br)cn1 ZINC000516171894 944555071 /nfs/dbraw/zinc/55/50/71/944555071.db2.gz OAGPINBBGVFGMY-UHFFFAOYSA-N 0 0 355.213 3.923 20 5 FHBDRN Cc1cc(N2CC[C@]3(C2)c2ccccc2NC3=O)c2cccc([N+](=O)[O-])c2n1 ZINC000614524750 944555241 /nfs/dbraw/zinc/55/52/41/944555241.db2.gz UYUCYXNSBRVWSI-NRFANRHFSA-N 0 0 374.400 3.552 20 5 FHBDRN Cc1cc(NC(=O)N(C)CCCOCc2ccccc2)ccc1[N+](=O)[O-] ZINC000439371643 944558647 /nfs/dbraw/zinc/55/86/47/944558647.db2.gz ATHUOADIOQCFPC-UHFFFAOYSA-N 0 0 357.410 3.974 20 5 FHBDRN CCCN(C[C@H]1CCCCO1)C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000181633903 944561812 /nfs/dbraw/zinc/56/18/12/944561812.db2.gz DXXXOKWQLVZBFR-CYBMUJFWSA-N 0 0 372.368 3.618 20 5 FHBDRN CSCc1cccc(CNC(=O)CCCNc2ccc([N+](=O)[O-])cc2)c1 ZINC000438411924 944578617 /nfs/dbraw/zinc/57/86/17/944578617.db2.gz CCFLUQPLGQNHCI-UHFFFAOYSA-N 0 0 373.478 3.966 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2ncn(Cc3csc(-c4ccoc4)n3)n2)cc1 ZINC000518653850 944579934 /nfs/dbraw/zinc/57/99/34/944579934.db2.gz KMMKMIARVMSEOJ-UHFFFAOYSA-N 0 0 353.363 3.618 20 5 FHBDRN Cn1ccc(C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)c1C1CCC1 ZINC000517764224 944583162 /nfs/dbraw/zinc/58/31/62/944583162.db2.gz YNVFWIDKQJEQAE-UHFFFAOYSA-N 0 0 355.438 3.954 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)N=c1cc(C2CCCCC2)[nH][nH]1 ZINC000426672045 944584201 /nfs/dbraw/zinc/58/42/01/944584201.db2.gz PKYLOMGATBDAPT-UHFFFAOYSA-N 0 0 360.439 3.518 20 5 FHBDRN CCc1ccc(C(=O)N2CCC[C@@H]2[C@@H]2C[C@@H](C)CC[C@H]2O)cc1[N+](=O)[O-] ZINC000500350247 944587769 /nfs/dbraw/zinc/58/77/69/944587769.db2.gz STWHTGOHUCMTDX-CKNFYHOISA-N 0 0 360.454 3.559 20 5 FHBDRN O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)N[C@H]1CCC[C@@H]1c1ccccc1 ZINC000516209543 944589777 /nfs/dbraw/zinc/58/97/77/944589777.db2.gz BLVSRAOTYYNSRO-KDOFPFPSSA-N 0 0 360.360 3.868 20 5 FHBDRN COc1ccc(C(=O)N(Cc2ccccc2[N+](=O)[O-])CC(F)(F)F)cc1 ZINC000120738169 944589862 /nfs/dbraw/zinc/58/98/62/944589862.db2.gz OPQGZTZNMPGBGH-UHFFFAOYSA-N 0 0 368.311 3.808 20 5 FHBDRN COc1ccc(Br)cc1COc1c(Cl)cncc1[N+](=O)[O-] ZINC000506569033 944590002 /nfs/dbraw/zinc/59/00/02/944590002.db2.gz VXAQKMYJGBBLCA-UHFFFAOYSA-N 0 0 373.590 3.993 20 5 FHBDRN O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)N[C@@H]1CCC[C@@H]1c1ccccc1 ZINC000516209545 944590285 /nfs/dbraw/zinc/59/02/85/944590285.db2.gz BLVSRAOTYYNSRO-RDTXWAMCSA-N 0 0 360.360 3.868 20 5 FHBDRN O=C(NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)c1csc2c1CCCC2 ZINC000517777599 944599257 /nfs/dbraw/zinc/59/92/57/944599257.db2.gz JYXYYDUCVIBXSG-UHFFFAOYSA-N 0 0 369.446 3.989 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)Nc1ccc(-c2cc[nH]n2)cc1 ZINC000518678311 944605395 /nfs/dbraw/zinc/60/53/95/944605395.db2.gz SACZNYMPCQJUFJ-UHFFFAOYSA-N 0 0 365.393 3.816 20 5 FHBDRN CSc1cccc(-c2nc([C@@H](C)C(=O)OC(C)(C)C)no2)c1[N+](=O)[O-] ZINC000517781483 944607412 /nfs/dbraw/zinc/60/74/12/944607412.db2.gz OLYHPCVGRHCSRD-SECBINFHSA-N 0 0 365.411 3.812 20 5 FHBDRN C[C@@H](CO)NC(=O)c1cccc(Sc2ccc(Cl)cc2)c1[N+](=O)[O-] ZINC000184345651 944624065 /nfs/dbraw/zinc/62/40/65/944624065.db2.gz FHKNDYXJFKMCCM-JTQLQIEISA-N 0 0 366.826 3.510 20 5 FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCCC[C@@H]1C ZINC000133914869 944630582 /nfs/dbraw/zinc/63/05/82/944630582.db2.gz ITKKRASCQQOJOW-SWLSCSKDSA-N 0 0 352.456 3.642 20 5 FHBDRN CC/C(=C/C(=O)NCCc1cccc([N+](=O)[O-])c1)c1ccc(OC)cc1 ZINC000759869997 944643470 /nfs/dbraw/zinc/64/34/70/944643470.db2.gz JXYIBBIHEKSLOI-PEZBUJJGSA-N 0 0 354.406 3.756 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCCc2c(O)cccc21 ZINC000190262439 944646314 /nfs/dbraw/zinc/64/63/14/944646314.db2.gz GYTXFOBTXISSJP-SJKOYZFVSA-N 0 0 372.446 3.975 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)N1CCCc2c(C)c(F)cc(Cl)c21 ZINC000425628393 944649703 /nfs/dbraw/zinc/64/97/03/944649703.db2.gz KGIWTOBKUULPCH-UHFFFAOYSA-N 0 0 363.776 3.992 20 5 FHBDRN O=c1c2cc([N+](=O)[O-])ccc2nc2n1CC/C2=C/c1cc(F)ccc1F ZINC000044025514 944649973 /nfs/dbraw/zinc/64/99/73/944649973.db2.gz PJHLQJVBLHWFMJ-YFHOEESVSA-N 0 0 355.300 3.527 20 5 FHBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000759870053 944654008 /nfs/dbraw/zinc/65/40/08/944654008.db2.gz LWBSGGWOTZWVLC-UHFFFAOYSA-N 0 0 371.374 3.690 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1F)NCCCc1c[nH]c2ccc(F)cc12 ZINC000506240070 944654754 /nfs/dbraw/zinc/65/47/54/944654754.db2.gz YXIXWLIRAZVYOE-UHFFFAOYSA-N 0 0 373.359 3.646 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1[C@@H]1Nc2cc(Cl)ccc2C(=O)N1C ZINC000500378212 944685099 /nfs/dbraw/zinc/68/50/99/944685099.db2.gz JTHJUAVAAUWGLQ-MRXNPFEDSA-N 0 0 361.785 3.843 20 5 FHBDRN CC(C)C[C@H]([NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1)C(=O)[O-] ZINC000426675842 944689979 /nfs/dbraw/zinc/68/99/79/944689979.db2.gz WNVDNZCOPMBPPK-KRWDZBQOSA-N 0 0 371.437 3.952 20 5 FHBDRN CC(C)c1ccc(C(=O)N2CCC(Oc3ccccn3)CC2)cc1[N+](=O)[O-] ZINC000439505345 944690034 /nfs/dbraw/zinc/69/00/34/944690034.db2.gz BEZXDSCHFDXIKA-UHFFFAOYSA-N 0 0 369.421 3.797 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CC1(CC(=O)[O-])CCCCC1 ZINC000426680914 944695142 /nfs/dbraw/zinc/69/51/42/944695142.db2.gz SAYWMOVZEDFTEU-UHFFFAOYSA-N 0 0 350.415 3.508 20 5 FHBDRN Cn1cc([N+](=O)[O-])cc1C(=O)N(Cc1c(F)cccc1F)C1CCCC1 ZINC000517841130 944703340 /nfs/dbraw/zinc/70/33/40/944703340.db2.gz HZADUWXQQGBKJA-UHFFFAOYSA-N 0 0 363.364 3.797 20 5 FHBDRN CCc1ccc(-c2nc(CCNc3ccccc3[N+](=O)[O-])no2)c(O)c1 ZINC000436856997 944703752 /nfs/dbraw/zinc/70/37/52/944703752.db2.gz BNRVRFIVNXMNKC-UHFFFAOYSA-N 0 0 354.366 3.567 20 5 FHBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)NC1(c2ccccc2)CCCC1 ZINC000506257477 944704685 /nfs/dbraw/zinc/70/46/85/944704685.db2.gz YSGXNYMDMHLHJH-UHFFFAOYSA-N 0 0 360.435 3.651 20 5 FHBDRN Cc1ccccc1SCC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2 ZINC000053706640 944710104 /nfs/dbraw/zinc/71/01/04/944710104.db2.gz AFESFVURWSNAKR-UHFFFAOYSA-N 0 0 374.418 3.795 20 5 FHBDRN O=C([O-])c1cccc(CC[NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)c1 ZINC000426690444 944711023 /nfs/dbraw/zinc/71/10/23/944711023.db2.gz ATYMWQNCHJWZDB-UHFFFAOYSA-N 0 0 366.373 3.885 20 5 FHBDRN Cc1c(NCC(=O)Nc2ccccc2C(F)(F)F)cccc1[N+](=O)[O-] ZINC000015124437 944713740 /nfs/dbraw/zinc/71/37/40/944713740.db2.gz OWLVSQSAQLOZKB-UHFFFAOYSA-N 0 0 353.300 3.973 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CC[C@@](C)(c2ccccc2)C1 ZINC000438508001 944718198 /nfs/dbraw/zinc/71/81/98/944718198.db2.gz XFEBNAPMSXPRSW-HXUWFJFHSA-N 0 0 353.422 3.505 20 5 FHBDRN COc1ccccc1[C@H]1CC[C@H](C)CN1C(=O)c1ccc([N+](=O)[O-])cc1[O-] ZINC000436860964 944725091 /nfs/dbraw/zinc/72/50/91/944725091.db2.gz RMUDMKKZGMSBFC-SUMWQHHRSA-N 0 0 370.405 3.922 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N(C)C[C@@H]2OCCc3ccccc32)c1 ZINC000506264498 944736104 /nfs/dbraw/zinc/73/61/04/944736104.db2.gz QMBYTZYFAIZABJ-SFHVURJKSA-N 0 0 372.446 3.703 20 5 FHBDRN O=C(Nc1ncc(C2CCOCC2)s1)c1c[nH]c2cccc([N+](=O)[O-])c21 ZINC000452661155 944742487 /nfs/dbraw/zinc/74/24/87/944742487.db2.gz IVPJNIBCWLHBPX-UHFFFAOYSA-N 0 0 372.406 3.679 20 5 FHBDRN O=C(N[C@@H]1COc2ccc(F)cc21)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000500395151 944743775 /nfs/dbraw/zinc/74/37/75/944743775.db2.gz KIMJEPUANCWODA-CYBMUJFWSA-N 0 0 370.258 3.616 20 5 FHBDRN COc1ccc(OC)c(/C=C\c2nc(-c3ccc([N+](=O)[O-])cc3)no2)c1 ZINC000545552914 944744022 /nfs/dbraw/zinc/74/40/22/944744022.db2.gz FGCOPWBJXLCAIP-YHYXMXQVSA-N 0 0 353.334 3.832 20 5 FHBDRN Cc1nc(C(F)(F)F)ccc1OCc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000506273437 944750033 /nfs/dbraw/zinc/75/00/33/944750033.db2.gz QTDWZECEHDGOCN-UHFFFAOYSA-N 0 0 370.283 3.763 20 5 FHBDRN Cc1cccc(OCCN(C)[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)c1 ZINC000027702956 944755133 /nfs/dbraw/zinc/75/51/33/944755133.db2.gz NAHHXUHKWLUAAZ-INIZCTEOSA-N 0 0 371.437 3.549 20 5 FHBDRN C[C@@]1(C(=O)[O-])CCCC[C@@H]1[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000426749827 944768935 /nfs/dbraw/zinc/76/89/35/944768935.db2.gz IUDQMBONDIBWIW-PKOBYXMFSA-N 0 0 358.394 3.978 20 5 FHBDRN C[C@H](NC(=O)c1csc(-c2ncccc2F)n1)c1cccc([N+](=O)[O-])c1 ZINC000506963931 944802928 /nfs/dbraw/zinc/80/29/28/944802928.db2.gz SYIHLRNWBWCCQA-JTQLQIEISA-N 0 0 372.381 3.743 20 5 FHBDRN CNc1ccc(C(=O)NCc2cccc(OCC(C)C)c2)cc1[N+](=O)[O-] ZINC000516395085 944814926 /nfs/dbraw/zinc/81/49/26/944814926.db2.gz VFXODHSORDFMJN-UHFFFAOYSA-N 0 0 357.410 3.601 20 5 FHBDRN O=C(Nc1ccccc1Cl)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000007092111 944816995 /nfs/dbraw/zinc/81/69/95/944816995.db2.gz GIXSIWUHFLLEDM-UHFFFAOYSA-N 0 0 360.801 3.602 20 5 FHBDRN CCOc1ccccc1[C@H](CC)NC(=O)c1ccc(OC)c([N+](=O)[O-])c1 ZINC000505904616 944819487 /nfs/dbraw/zinc/81/94/87/944819487.db2.gz TUWHAEKOQAMWBY-HNNXBMFYSA-N 0 0 358.394 3.883 20 5 FHBDRN Cc1ccc(-c2nc(CCNc3ccccc3[N+](=O)[O-])no2)c(O)c1C ZINC000436934797 944822376 /nfs/dbraw/zinc/82/23/76/944822376.db2.gz UIERYZORKVBXHU-UHFFFAOYSA-N 0 0 354.366 3.622 20 5 FHBDRN O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CCN(Cc2ccsc2)CC1 ZINC000015143437 944828078 /nfs/dbraw/zinc/82/80/78/944828078.db2.gz DAQFIRGFUHOGMR-UHFFFAOYSA-N 0 0 371.384 3.997 20 5 FHBDRN CCn1ncnc1-c1ccc(C(=O)Nc2c(C)c([N+](=O)[O-])ccc2F)cc1 ZINC001270143838 944829481 /nfs/dbraw/zinc/82/94/81/944829481.db2.gz GQUWPFPLGKRFCY-UHFFFAOYSA-N 0 0 369.356 3.573 20 5 FHBDRN O=C([O-])[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1cc2ccccc2s1 ZINC000426810691 944832052 /nfs/dbraw/zinc/83/20/52/944832052.db2.gz QBMRWDLVIVMUSM-HNNXBMFYSA-N 0 0 356.403 3.595 20 5 FHBDRN COc1ccc(OCc2noc(C(C)(C)c3ccccc3[N+](=O)[O-])n2)cc1 ZINC000426448848 944833197 /nfs/dbraw/zinc/83/31/97/944833197.db2.gz GYQXNMSNVVQGIL-UHFFFAOYSA-N 0 0 369.377 3.891 20 5 FHBDRN CC[C@H](NC(=O)Nc1cccc2c1OCCC2=O)c1cccc([N+](=O)[O-])c1 ZINC000506986665 944834811 /nfs/dbraw/zinc/83/48/11/944834811.db2.gz MWSNUGCNPDBGMJ-HNNXBMFYSA-N 0 0 369.377 3.833 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(Sc2nnc(-c3ccc(Cl)cc3)n2C)n1 ZINC000120714204 944842252 /nfs/dbraw/zinc/84/22/52/944842252.db2.gz SBVWZRNVMPUUJC-UHFFFAOYSA-N 0 0 361.814 3.898 20 5 FHBDRN CC(C)(C(=O)Nc1ccc(CCC(F)(F)F)cc1)n1cc([N+](=O)[O-])cn1 ZINC000439651592 944850484 /nfs/dbraw/zinc/85/04/84/944850484.db2.gz RSRPGBYYJLUXSA-UHFFFAOYSA-N 0 0 370.331 3.660 20 5 FHBDRN CCc1cccc2c1OCC[C@@H]2NC(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000506999311 944852283 /nfs/dbraw/zinc/85/22/83/944852283.db2.gz DDRGLYKWEWQTIN-INIZCTEOSA-N 0 0 369.421 3.599 20 5 FHBDRN CC(C)[C@H](CC(F)(F)F)NC(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000438620065 944852602 /nfs/dbraw/zinc/85/26/02/944852602.db2.gz FSLSYQRXHZCUDS-ZANVPECISA-N 0 0 350.312 3.931 20 5 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/nfs/dbraw/zinc/27/50/18/946275018.db2.gz CTTYMUSGDHFJPZ-UHFFFAOYSA-N 0 0 361.361 3.526 20 5 FHBDRN CC1CCC(c2noc(Cc3cc4c(cc3[N+](=O)[O-])OCCO4)n2)CC1 ZINC000545644144 946281640 /nfs/dbraw/zinc/28/16/40/946281640.db2.gz VNYQXFCMRNFUCW-UHFFFAOYSA-N 0 0 359.382 3.634 20 5 FHBDRN O=C(Nc1nc2c(s1)CC1(CCOCC1)CC2)c1ccc([N+](=O)[O-])cc1 ZINC000456533576 946286877 /nfs/dbraw/zinc/28/68/77/946286877.db2.gz HWGKFVMXHZDLPP-UHFFFAOYSA-N 0 0 373.434 3.589 20 5 FHBDRN O=[N+]([O-])c1cccc(Cc2nc(CCCOc3ccc(F)cc3)no2)c1 ZINC000545643960 946287059 /nfs/dbraw/zinc/28/70/59/946287059.db2.gz QRRPVGXIEXNJOZ-UHFFFAOYSA-N 0 0 357.341 3.719 20 5 FHBDRN C[C@H](Oc1cccc(Cl)c1)C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088231008 946294690 /nfs/dbraw/zinc/29/46/90/946294690.db2.gz OTVHAQFYKBIIHA-LBPRGKRZSA-N 0 0 360.797 3.600 20 5 FHBDRN CC(C)[C@H](Cc1ccccc1)C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088231786 946296319 /nfs/dbraw/zinc/29/63/19/946296319.db2.gz MVHKGJHEJBMOBQ-FQEVSTJZSA-N 0 0 352.434 3.994 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cnn([C@H](C)C2CC2)c1 ZINC000186464812 946327345 /nfs/dbraw/zinc/32/73/45/946327345.db2.gz GVJXQVGBQUZYPO-UKRRQHHQSA-N 0 0 356.426 3.970 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)NCc1nc2ccccc2s1 ZINC000042815857 946328372 /nfs/dbraw/zinc/32/83/72/946328372.db2.gz JGHZCGGYHWUKFZ-UHFFFAOYSA-N 0 0 356.407 3.546 20 5 FHBDRN Cc1nn(C)c(C(=O)N2CCC[C@@H](C)[C@@H]2c2ccc(C)cc2)c1[N+](=O)[O-] ZINC000151397210 946363280 /nfs/dbraw/zinc/36/32/80/946363280.db2.gz WPPFWDIGQQHCPU-CZUORRHYSA-N 0 0 356.426 3.559 20 5 FHBDRN Cc1nc(-c2ccco2)ccc1C(=O)OCC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000728342248 946377425 /nfs/dbraw/zinc/37/74/25/946377425.db2.gz IHIIJOMYTPIIMR-UHFFFAOYSA-N 0 0 366.329 3.598 20 5 FHBDRN C[C@H](NC(=O)COc1cccc([N+](=O)[O-])c1)c1cc2cccc(F)c2o1 ZINC000475101070 946380803 /nfs/dbraw/zinc/38/08/03/946380803.db2.gz SKCGMIUECNYGIK-NSHDSACASA-N 0 0 358.325 3.736 20 5 FHBDRN CCOCCC1(c2nc(CCNc3ccccc3[N+](=O)[O-])no2)CCCC1 ZINC000545668672 946383563 /nfs/dbraw/zinc/38/35/63/946383563.db2.gz JGWBMLMUVHKYCS-UHFFFAOYSA-N 0 0 374.441 3.871 20 5 FHBDRN CC[C@H](CC(=O)OCC(=O)Nc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000728825473 946399232 /nfs/dbraw/zinc/39/92/32/946399232.db2.gz ACBHOBDEKJWJAZ-CQSZACIVSA-N 0 0 356.378 3.660 20 5 FHBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1OC(=O)c1ccc2c(c1)OCCCO2 ZINC001126121160 946399271 /nfs/dbraw/zinc/39/92/71/946399271.db2.gz RTKZSJIZDZYXET-UHFFFAOYSA-N 0 0 363.753 3.937 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])Nc1ccc(Br)cc1 ZINC000047687351 946402240 /nfs/dbraw/zinc/40/22/40/946402240.db2.gz STDXFKOBBCYESP-UHFFFAOYSA-N 0 0 350.172 3.679 20 5 FHBDRN COc1cc(C(=O)N2CC3(CCC3)[C@@H]2c2ccco2)cc([N+](=O)[O-])c1OC ZINC000456583067 946402519 /nfs/dbraw/zinc/40/25/19/946402519.db2.gz ZSMBVMBLUXPFOZ-KRWDZBQOSA-N 0 0 372.377 3.572 20 5 FHBDRN C[C@H](C[C@H]1CCOC1)NC(=O)c1cc(F)c(Cl)c([N+](=O)[O-])c1Cl ZINC000896974438 946405708 /nfs/dbraw/zinc/40/57/08/946405708.db2.gz AJNHUUVWTQBINT-HTQZYQBOSA-N 0 0 365.188 3.586 20 5 FHBDRN Cc1nn(CCc2nc(-c3ccc4sccc4c3)no2)c(C)c1[N+](=O)[O-] ZINC000545692777 946408121 /nfs/dbraw/zinc/40/81/21/946408121.db2.gz DUPKRMHQZVGZKQ-UHFFFAOYSA-N 0 0 369.406 3.916 20 5 FHBDRN CCNc1ccc(C(=O)NC[C@H](C)c2ccc(F)cc2F)cc1[N+](=O)[O-] ZINC000441295080 946413141 /nfs/dbraw/zinc/41/31/41/946413141.db2.gz IZRZNUCRZFUOOY-NSHDSACASA-N 0 0 363.364 3.838 20 5 FHBDRN COCCOc1ccc(NC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000047762945 946421259 /nfs/dbraw/zinc/42/12/59/946421259.db2.gz PGITZENUAPGMNA-CQSZACIVSA-N 0 0 373.409 3.811 20 5 FHBDRN Cc1cc(Br)c(F)cc1NC(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000186507004 946421647 /nfs/dbraw/zinc/42/16/47/946421647.db2.gz FOCVZONAKDZTBN-UHFFFAOYSA-N 0 0 368.162 3.639 20 5 FHBDRN COc1ccc(Br)c(NC(=O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000111324585 946427970 /nfs/dbraw/zinc/42/79/70/946427970.db2.gz NCIPJUXYHYNGEN-UHFFFAOYSA-N 0 0 351.156 3.618 20 5 FHBDRN COC[C@H](Sc1c([N+](=O)[O-])c(C(F)(F)F)nn1C)c1ccccc1 ZINC000897003574 946450204 /nfs/dbraw/zinc/45/02/04/946450204.db2.gz RTXMYKDTIWDVND-JTQLQIEISA-N 0 0 361.345 3.827 20 5 FHBDRN Cc1cccc(CNC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])c1 ZINC000047924199 946451995 /nfs/dbraw/zinc/45/19/95/946451995.db2.gz YDUXSBWILLHJOK-UHFFFAOYSA-N 0 0 368.311 3.774 20 5 FHBDRN COC(=O)[C@@H](NCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)C1CC1 ZINC000475140985 946466680 /nfs/dbraw/zinc/46/66/80/946466680.db2.gz SIKCJGCDUJLMEW-SFHVURJKSA-N 0 0 374.368 3.567 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N2CCCCc3ccccc32)cc1OC ZINC000047975648 946474049 /nfs/dbraw/zinc/47/40/49/946474049.db2.gz RUYYNMZFHHOXIT-UHFFFAOYSA-N 0 0 370.405 3.985 20 5 FHBDRN Cc1nc2sccn2c1CN(C)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783556575 946474381 /nfs/dbraw/zinc/47/43/81/946474381.db2.gz FNAZZHDHGPYYHQ-UHFFFAOYSA-N 0 0 350.831 3.898 20 5 FHBDRN CN(C(=O)CCSc1ccc2c(c1)OCCO2)c1ccc([N+](=O)[O-])cc1 ZINC000523085121 946474487 /nfs/dbraw/zinc/47/44/87/946474487.db2.gz JEIHBHPXUCLKDL-UHFFFAOYSA-N 0 0 374.418 3.511 20 5 FHBDRN O=C(NCc1ccc2ccccc2c1)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000111560601 946478672 /nfs/dbraw/zinc/47/86/72/946478672.db2.gz RWNUWFHQJMZPHM-UHFFFAOYSA-N 0 0 373.368 3.520 20 5 FHBDRN CCO[C@H](C)c1nc(CN(C)c2cccc(OC)c2[N+](=O)[O-])cs1 ZINC000475502808 946488893 /nfs/dbraw/zinc/48/88/93/946488893.db2.gz LNRNDSIKDKQIOG-LLVKDONJSA-N 0 0 351.428 3.794 20 5 FHBDRN Cn1cc(N2CCC[C@@H](Nc3c(Cl)cc([N+](=O)[O-])cc3Cl)C2)cn1 ZINC000475499078 946499177 /nfs/dbraw/zinc/49/91/77/946499177.db2.gz RVIVBIFBFPGVKC-SNVBAGLBSA-N 0 0 370.240 3.716 20 5 FHBDRN COCc1ccc([C@@H]2CCCN2C(=O)c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000137449680 946501717 /nfs/dbraw/zinc/50/17/17/946501717.db2.gz VIOGPZBLTXHFIO-AWEZNQCLSA-N 0 0 364.785 3.965 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)C[C@@H](O)c2ccc(F)cc2)c1C ZINC000897035249 946504588 /nfs/dbraw/zinc/50/45/88/946504588.db2.gz SCJJFDAJMCVGMU-SJKOYZFVSA-N 0 0 360.385 3.593 20 5 FHBDRN Cc1cc(C)cc([C@@H](C)NC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)c1 ZINC000111616144 946504843 /nfs/dbraw/zinc/50/48/43/946504843.db2.gz OZJMHEMOKMWGRA-CYBMUJFWSA-N 0 0 365.389 3.544 20 5 FHBDRN CSc1cccc(C(=O)NC[C@@H]2CCCO[C@H]2C(C)(C)C)c1[N+](=O)[O-] ZINC000186524218 946504928 /nfs/dbraw/zinc/50/49/28/946504928.db2.gz OZHHTTQXFYCDDI-BLLLJJGKSA-N 0 0 366.483 3.888 20 5 FHBDRN CN(C)c1cc(-c2noc(-c3ccccc3[N+](=O)[O-])n2)c2ccccc2n1 ZINC000545738430 946505640 /nfs/dbraw/zinc/50/56/40/946505640.db2.gz HWCKEMWBSXJMPC-UHFFFAOYSA-N 0 0 361.361 3.926 20 5 FHBDRN Cc1sc(C(=O)Nc2ccc(Nc3ncccn3)cc2)cc1[N+](=O)[O-] ZINC000444422147 946513645 /nfs/dbraw/zinc/51/36/45/946513645.db2.gz KGPPGRBLJKPSTG-UHFFFAOYSA-N 0 0 355.379 3.751 20 5 FHBDRN CCNC(=O)c1ccc(C)c(NC(=O)c2cccc(SC)c2[N+](=O)[O-])c1 ZINC000186151150 946517986 /nfs/dbraw/zinc/51/79/86/946517986.db2.gz JIHWIMJIRYFHQA-UHFFFAOYSA-N 0 0 373.434 3.627 20 5 FHBDRN COc1cc(F)c([C@@H](C)NC(=O)c2ccc([N+](=O)[O-])cc2C)cc1OC ZINC000074609493 946518582 /nfs/dbraw/zinc/51/85/82/946518582.db2.gz FAIYKMXDOZZCBD-LLVKDONJSA-N 0 0 362.357 3.551 20 5 FHBDRN COc1ccc(Cl)cc1N(C)C(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000074608574 946519087 /nfs/dbraw/zinc/51/90/87/946519087.db2.gz OMYPDCVCWHRHHK-UHFFFAOYSA-N 0 0 364.785 3.689 20 5 FHBDRN COc1ccc(Cl)cc1N(C)C(=O)c1ccc([N+](=O)[O-])c(OC)c1 ZINC000074608355 946519348 /nfs/dbraw/zinc/51/93/48/946519348.db2.gz JZIHKDYKVPAWLE-UHFFFAOYSA-N 0 0 350.758 3.542 20 5 FHBDRN CCC[C@H](O)CNC(=O)c1ccc(SCCC(C)C)c([N+](=O)[O-])c1 ZINC000475167963 946546021 /nfs/dbraw/zinc/54/60/21/946546021.db2.gz ZDYIDXPZVXJSRI-AWEZNQCLSA-N 0 0 354.472 3.624 20 5 FHBDRN C[C@H](CNC(=O)N1CC[C@@](C)(C(F)(F)F)C1)c1ccccc1[N+](=O)[O-] ZINC000897050241 946549778 /nfs/dbraw/zinc/54/97/78/946549778.db2.gz POPKUGYFNKCUPP-IAQYHMDHSA-N 0 0 359.348 3.682 20 5 FHBDRN C[C@H](CNC(=O)N[C@H](c1ccncc1)C1CC1)c1ccccc1[N+](=O)[O-] ZINC000897050336 946549930 /nfs/dbraw/zinc/54/99/30/946549930.db2.gz NNFVUDIJRZNMLC-ACJLOTCBSA-N 0 0 354.410 3.544 20 5 FHBDRN CC(C)CC(=O)Nc1ccc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)cc1 ZINC000048246443 946551334 /nfs/dbraw/zinc/55/13/34/946551334.db2.gz XCGJZCXJZZTRIY-UHFFFAOYSA-N 0 0 374.372 3.553 20 5 FHBDRN Cc1c(CC(=O)Nc2nc3cccc(Cl)c3n2C)cccc1[N+](=O)[O-] ZINC000186566806 946553790 /nfs/dbraw/zinc/55/37/90/946553790.db2.gz VSKGAQMVHFDXAF-UHFFFAOYSA-N 0 0 358.785 3.625 20 5 FHBDRN C[C@H](CNC(=O)N1CCC[C@H]1c1cccnc1)c1ccccc1[N+](=O)[O-] ZINC000897075616 946554421 /nfs/dbraw/zinc/55/44/21/946554421.db2.gz OQMJNPRUMGBMAZ-PBHICJAKSA-N 0 0 354.410 3.640 20 5 FHBDRN CC(C)N(Cc1ccccn1)C(=O)NC[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000897062438 946555683 /nfs/dbraw/zinc/55/56/83/946555683.db2.gz VKXMGLYWJISSNS-OAHLLOKOSA-N 0 0 356.426 3.714 20 5 FHBDRN COc1ccc(F)cc1[C@H](C)NC(=O)c1cccc(SC)c1[N+](=O)[O-] ZINC000186165468 946557886 /nfs/dbraw/zinc/55/78/86/946557886.db2.gz VRBJZSJZFYEDRF-JTQLQIEISA-N 0 0 364.398 3.955 20 5 FHBDRN C[C@H](CNC(=O)N1CC[C@@H](C(F)(F)F)[C@H]1C)c1ccccc1[N+](=O)[O-] ZINC000897064730 946558388 /nfs/dbraw/zinc/55/83/88/946558388.db2.gz WNIZINAQBPJWII-NQBHXWOUSA-N 0 0 359.348 3.681 20 5 FHBDRN CCCO[C@H]1CCCN(C(=O)NC[C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000897070222 946566309 /nfs/dbraw/zinc/56/63/09/946566309.db2.gz BPSXTELBTQHVHS-CVEARBPZSA-N 0 0 363.458 3.689 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N[C@H]1CCc2c1cccc2Cl ZINC000520421592 946570035 /nfs/dbraw/zinc/57/00/35/946570035.db2.gz OZDUOIIQLAHEQT-HNNXBMFYSA-N 0 0 366.826 3.522 20 5 FHBDRN COc1ccc(Cl)cc1CCNC(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC001126134834 946571890 /nfs/dbraw/zinc/57/18/90/946571890.db2.gz PQSNNFHCWNEKDX-UHFFFAOYSA-N 0 0 362.813 3.846 20 5 FHBDRN CN(c1ccccc1NC(=O)COc1cccc([N+](=O)[O-])c1)C1CCCC1 ZINC000475179240 946583618 /nfs/dbraw/zinc/58/36/18/946583618.db2.gz BMTCBVOMPOXIDW-UHFFFAOYSA-N 0 0 369.421 3.991 20 5 FHBDRN Cc1cccc2c1N[C@@H](c1ccc(Br)c([N+](=O)[O-])c1)NC2=O ZINC000027577751 946588697 /nfs/dbraw/zinc/58/86/97/946588697.db2.gz AEVYNMVQLHQWHJ-CQSZACIVSA-N 0 0 362.183 3.520 20 5 FHBDRN CCOc1cc(CNC(=O)c2cc(Cl)ccc2[N+](=O)[O-])ccc1OC ZINC000074628572 946614141 /nfs/dbraw/zinc/61/41/41/946614141.db2.gz PNPSSYBQJHBMGA-UHFFFAOYSA-N 0 0 364.785 3.586 20 5 FHBDRN CC[C@H](C)Oc1cc(-c2noc(CNc3ccccc3[N+](=O)[O-])n2)ccn1 ZINC000545780684 946614310 /nfs/dbraw/zinc/61/43/10/946614310.db2.gz KHCCCOAEYBMKSA-LBPRGKRZSA-N 0 0 369.381 3.829 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@@H](Oc3cccc(Cl)c3)C2)c1 ZINC000536263523 946616154 /nfs/dbraw/zinc/61/61/54/946616154.db2.gz LQQJADYGXLYHNW-OAHLLOKOSA-N 0 0 360.797 3.850 20 5 FHBDRN CCc1ccc(NC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)c(C(=O)OC)c1 ZINC001126143139 946619387 /nfs/dbraw/zinc/61/93/87/946619387.db2.gz QHSJCIODCIZBEI-JKSUJKDBSA-N 0 0 368.389 3.686 20 5 FHBDRN CO[C@@H](c1noc(-c2cc([N+](=O)[O-])cnc2C)n1)c1cccc(Cl)c1 ZINC000545775910 946622126 /nfs/dbraw/zinc/62/21/26/946622126.db2.gz ZWAHKGQLEBHAAY-CQSZACIVSA-N 0 0 360.757 3.737 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)N[C@H]1CCO[C@@H](c2ccccc2)C1 ZINC000184438454 946625799 /nfs/dbraw/zinc/62/57/99/946625799.db2.gz MLZHYGIRPYUFKW-PKOBYXMFSA-N 0 0 369.421 3.657 20 5 FHBDRN COc1c(F)cc(NC(=O)c2cccc(SC)c2[N+](=O)[O-])cc1F ZINC000186216642 946630059 /nfs/dbraw/zinc/63/00/59/946630059.db2.gz RQAWZWKLJQVGPU-UHFFFAOYSA-N 0 0 354.334 3.856 20 5 FHBDRN O=C1[C@@H](Nc2ncccc2[N+](=O)[O-])CCN1c1ccc(Cl)cc1Cl ZINC000473909173 946633511 /nfs/dbraw/zinc/63/35/11/946633511.db2.gz AGLXIGJQVWBCQC-NSHDSACASA-N 0 0 367.192 3.514 20 5 FHBDRN CC[C@H](NS(=O)(=O)Cc1cccc([N+](=O)[O-])c1)c1cccc(Cl)c1 ZINC000151781735 946641055 /nfs/dbraw/zinc/64/10/55/946641055.db2.gz SAAHOXNKUJDLOP-INIZCTEOSA-N 0 0 368.842 3.819 20 5 FHBDRN CSc1cccc(C(=O)NC[C@H](C)COCc2ccccc2)c1[N+](=O)[O-] ZINC000186248937 946645299 /nfs/dbraw/zinc/64/52/99/946645299.db2.gz DMCOCAICJKFUJX-AWEZNQCLSA-N 0 0 374.462 3.899 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1CN[C@H](CO)c1ccccc1OC(F)(F)F ZINC000475563854 946655655 /nfs/dbraw/zinc/65/56/55/946655655.db2.gz WQAZFODMRHNTFR-OAHLLOKOSA-N 0 0 370.327 3.625 20 5 FHBDRN O=[N+]([O-])c1ccc(COc2cccc(I)c2)cc1 ZINC000005407797 946665760 /nfs/dbraw/zinc/66/57/60/946665760.db2.gz VVJPGFNWUZYTKU-UHFFFAOYSA-N 0 0 355.131 3.778 20 5 FHBDRN COc1ccc(OCCCNC(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)cc1 ZINC000475567613 946683778 /nfs/dbraw/zinc/68/37/78/946683778.db2.gz DNURFMSNTSOBRC-UHFFFAOYSA-N 0 0 373.409 3.811 20 5 FHBDRN COCCNc1ccc(CNC(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)cc1 ZINC000475569816 946689743 /nfs/dbraw/zinc/68/97/43/946689743.db2.gz QUBJQFQXIFGIAW-UHFFFAOYSA-N 0 0 372.425 3.592 20 5 FHBDRN CC(C)(C)C[C@H](CO)NC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000475196134 946694971 /nfs/dbraw/zinc/69/49/71/946694971.db2.gz ZOYVLFYMUNUYMG-SNVBAGLBSA-N 0 0 363.336 3.532 20 5 FHBDRN CCOc1ccc(NC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)c(C)c1 ZINC000088363670 946707939 /nfs/dbraw/zinc/70/79/39/946707939.db2.gz XZZHNALOGHHYAQ-UHFFFAOYSA-N 0 0 355.394 3.892 20 5 FHBDRN CCCN(CC(C)(C)O)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000475199229 946710517 /nfs/dbraw/zinc/71/05/17/946710517.db2.gz SWRMEFVDYPQWDF-UHFFFAOYSA-N 0 0 363.336 3.628 20 5 FHBDRN CS[C@H]1CC[C@@H](NC(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)C1 ZINC000125573376 946727684 /nfs/dbraw/zinc/72/76/84/946727684.db2.gz ZTWVSICKBYGIIG-MNOVXSKESA-N 0 0 373.272 3.680 20 5 FHBDRN CCOC(=O)c1ccnc(N(C)Cc2ccc(F)cc2Cl)c1[N+](=O)[O-] ZINC000609963786 946732455 /nfs/dbraw/zinc/73/24/55/946732455.db2.gz OOVSTRDPCNSQSY-UHFFFAOYSA-N 0 0 367.764 3.595 20 5 FHBDRN C[C@@H](NC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)[C@@H]1CCCCO1 ZINC000475221237 946742577 /nfs/dbraw/zinc/74/25/77/946742577.db2.gz UPZAZYIMWCZMEG-RNCFNFMXSA-N 0 0 361.320 3.693 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)Nc1cnn(-c2ccccc2F)c1 ZINC000121449027 946744568 /nfs/dbraw/zinc/74/45/68/946744568.db2.gz FANUKGZLGOCKLR-UHFFFAOYSA-N 0 0 374.759 3.754 20 5 FHBDRN Cc1ccc(CNC(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)cn1 ZINC000475225627 946747465 /nfs/dbraw/zinc/74/74/65/946747465.db2.gz WMFNAAARLBTWRY-UHFFFAOYSA-N 0 0 354.288 3.639 20 5 FHBDRN COc1ccc(F)c(NC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)c1 ZINC000088406758 946748665 /nfs/dbraw/zinc/74/86/65/946748665.db2.gz XFHCLSVGIQARRC-UHFFFAOYSA-N 0 0 361.373 3.887 20 5 FHBDRN NC(=O)Nc1ccc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)cc1 ZINC000025882930 946777078 /nfs/dbraw/zinc/77/70/78/946777078.db2.gz HHIQFRDAXKFLJH-UHFFFAOYSA-N 0 0 356.363 3.552 20 5 FHBDRN Cc1c(F)ccc([N+](=O)[O-])c1C(=O)NCc1cccnc1OC1CCCC1 ZINC000843766802 946779020 /nfs/dbraw/zinc/77/90/20/946779020.db2.gz SZWDUJSKKBDXOE-UHFFFAOYSA-N 0 0 373.384 3.689 20 5 FHBDRN COc1c(C(=O)NC2(c3ccc(F)cc3)CCCC2)cccc1[N+](=O)[O-] ZINC000475591383 946802597 /nfs/dbraw/zinc/80/25/97/946802597.db2.gz PIACZMQFPADJGL-UHFFFAOYSA-N 0 0 358.369 3.942 20 5 FHBDRN N=C(N)N(c1ccc(F)cc1)c1nc(-c2ccccc2)ccc1[N+](=O)[O-] ZINC001167993477 946812213 /nfs/dbraw/zinc/81/22/13/946812213.db2.gz RTDMCCFVVLEVLC-UHFFFAOYSA-N 0 0 351.341 3.827 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)Nc1ccc2c(c1)OC(C)(C)O2 ZINC000048546550 946820557 /nfs/dbraw/zinc/82/05/57/946820557.db2.gz QGCNYQNVQXZRPI-UHFFFAOYSA-N 0 0 357.366 3.766 20 5 FHBDRN COc1cccc2[nH]cc(CC(=O)NCc3ccc([N+](=O)[O-])cc3Cl)c21 ZINC000186304834 946830501 /nfs/dbraw/zinc/83/05/01/946830501.db2.gz WJSJPBAXOKZHBN-UHFFFAOYSA-N 0 0 373.796 3.597 20 5 FHBDRN CC(C)(C)c1coc(CNc2ncc([N+](=O)[O-])cc2Br)n1 ZINC000897173013 946832131 /nfs/dbraw/zinc/83/21/31/946832131.db2.gz FPARJACUVFRIFK-UHFFFAOYSA-N 0 0 355.192 3.650 20 5 FHBDRN CSc1cccc(C(=O)NCCc2cc(F)ccc2F)c1[N+](=O)[O-] ZINC000186672630 946836818 /nfs/dbraw/zinc/83/68/18/946836818.db2.gz XUORVHIZQGUWDQ-UHFFFAOYSA-N 0 0 352.362 3.567 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@H]1Cc1ccc(C)cc1 ZINC000113136758 946840061 /nfs/dbraw/zinc/84/00/61/946840061.db2.gz NXILZYCIZJSRJN-INIZCTEOSA-N 0 0 354.406 3.759 20 5 FHBDRN C[C@H]1CC[C@H](CNC(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC000475303774 946845418 /nfs/dbraw/zinc/84/54/18/946845418.db2.gz NYPGUATZSJGVQV-GJZGRUSLSA-N 0 0 361.442 3.584 20 5 FHBDRN Cc1ccccc1CN(Cc1ccccn1)C(=O)c1ccc([N+](=O)[O-])o1 ZINC000112288462 946845715 /nfs/dbraw/zinc/84/57/15/946845715.db2.gz YFOCQICHRHWMTF-UHFFFAOYSA-N 0 0 351.362 3.734 20 5 FHBDRN C[C@H]1CCN(C(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])CC1(F)F ZINC000427565865 946866317 /nfs/dbraw/zinc/86/63/17/946866317.db2.gz PKWNUHRGOHTNAW-JTQLQIEISA-N 0 0 362.760 3.521 20 5 FHBDRN Cc1cc([C@@H](NC(=O)COc2ccc([N+](=O)[O-])cc2)C2CC2)ccc1F ZINC000536281154 946874294 /nfs/dbraw/zinc/87/42/94/946874294.db2.gz OKQUMNAXGWRKGI-IBGZPJMESA-N 0 0 358.369 3.689 20 5 FHBDRN C[C@H](NC(=O)NC(C)(C)COCc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000458883582 946875753 /nfs/dbraw/zinc/87/57/53/946875753.db2.gz CULXIUOZKWPTMX-HNNXBMFYSA-N 0 0 371.437 3.950 20 5 FHBDRN C[C@H](NC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1cccc(O)c1 ZINC000112420078 946876154 /nfs/dbraw/zinc/87/61/54/946876154.db2.gz WVCBDOOSQYLCQM-VIFPVBQESA-N 0 0 367.308 3.785 20 5 FHBDRN C[C@H](Cc1ccc(O)cc1)N(C)C(=O)N[C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000458884637 946877834 /nfs/dbraw/zinc/87/78/34/946877834.db2.gz FAUHHDIKNQRXEC-KGLIPLIRSA-N 0 0 357.410 3.634 20 5 FHBDRN COc1ccc(Cl)cc1CC(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186319387 946880517 /nfs/dbraw/zinc/88/05/17/946880517.db2.gz HGIINLWXNXBVNL-UHFFFAOYSA-N 0 0 369.204 3.769 20 5 FHBDRN CCOC[C@H](NC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C)C(C)C ZINC000473956757 946881010 /nfs/dbraw/zinc/88/10/10/946881010.db2.gz AEMOODGVUURMOO-KRWDZBQOSA-N 0 0 351.447 3.576 20 5 FHBDRN CN(Cc1ccnn1C)Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000475328641 946888895 /nfs/dbraw/zinc/88/88/95/946888895.db2.gz JGQSDJUMUCXPRH-UHFFFAOYSA-N 0 0 365.437 3.728 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)c1cnc(-c2ccccn2)s1 ZINC000186323784 946890816 /nfs/dbraw/zinc/89/08/16/946890816.db2.gz WGGBQOCCZHKTQS-UHFFFAOYSA-N 0 0 374.809 3.697 20 5 FHBDRN CN(Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)Cc1ccnn1C ZINC000475330995 946892801 /nfs/dbraw/zinc/89/28/01/946892801.db2.gz GJCHSNCACKKQPQ-UHFFFAOYSA-N 0 0 360.801 3.874 20 5 FHBDRN COc1ccc(CS(=O)(=O)Cc2c(F)cccc2Cl)cc1[N+](=O)[O-] ZINC000048720701 946897733 /nfs/dbraw/zinc/89/77/33/946897733.db2.gz SAWKCEMGHQGANK-UHFFFAOYSA-N 0 0 373.789 3.511 20 5 FHBDRN CN(Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)Cc1ccc(F)cc1F ZINC000025940604 946905314 /nfs/dbraw/zinc/90/53/14/946905314.db2.gz IICFRFMHPLGZQP-UHFFFAOYSA-N 0 0 360.320 3.555 20 5 FHBDRN Cc1nn(CC(=O)c2cccc(OC(F)F)c2)c2ccc([N+](=O)[O-])cc12 ZINC000432241220 946909621 /nfs/dbraw/zinc/90/96/21/946909621.db2.gz OKOAPWALSLOXHJ-UHFFFAOYSA-N 0 0 361.304 3.737 20 5 FHBDRN O=C(N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1)C1(C(F)(F)F)CCC1 ZINC000295037629 946911660 /nfs/dbraw/zinc/91/16/60/946911660.db2.gz RVQLCPSZMGUQSH-UHFFFAOYSA-N 0 0 372.343 3.697 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2noc(-c3cn(-c4cccc(Cl)c4)nn3)n2)cc1 ZINC000614806120 946914834 /nfs/dbraw/zinc/91/48/34/946914834.db2.gz OOQAFHGDOFUGHN-UHFFFAOYSA-N 0 0 368.740 3.546 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1C[C@@H]1c1ccc(F)c(F)c1 ZINC000186331613 946918939 /nfs/dbraw/zinc/91/89/39/946918939.db2.gz AFBYXNZHBFLSJP-CHWSQXEVSA-N 0 0 366.751 3.946 20 5 FHBDRN C[C@@H]1CCC[C@@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2Br)C1 ZINC000087067730 946919788 /nfs/dbraw/zinc/91/97/88/946919788.db2.gz BKTMGDLZAQFTBQ-ZYHUDNBSSA-N 0 0 355.232 3.595 20 5 FHBDRN O=C(Cc1ccccc1OC(F)F)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186331958 946920284 /nfs/dbraw/zinc/92/02/84/946920284.db2.gz UBGZNBLKAKBSPK-UHFFFAOYSA-N 0 0 370.739 3.709 20 5 FHBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CC[C@H](C)[C@H](C)C1 ZINC000550396386 946923746 /nfs/dbraw/zinc/92/37/46/946923746.db2.gz IAIZRRZRSKKPLW-VHSXEESVSA-N 0 0 355.232 3.784 20 5 FHBDRN COc1ccc([C@H](NC(=O)c2ccc([N+](=O)[O-])cc2C)C(F)(F)F)cc1 ZINC000182613140 946926105 /nfs/dbraw/zinc/92/61/05/946926105.db2.gz CVYNFXPNEGRNOF-HNNXBMFYSA-N 0 0 368.311 3.945 20 5 FHBDRN O=[N+]([O-])c1c(NCc2ccccc2Br)nc2sccn21 ZINC000048820966 946929680 /nfs/dbraw/zinc/92/96/80/946929680.db2.gz ZHRWQQRHQMFURK-UHFFFAOYSA-N 0 0 353.201 3.679 20 5 FHBDRN C[C@@H]1CCC[C@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2Br)C1 ZINC000087067725 946936604 /nfs/dbraw/zinc/93/66/04/946936604.db2.gz BKTMGDLZAQFTBQ-PWSUYJOCSA-N 0 0 355.232 3.595 20 5 FHBDRN COc1ccc2cc(NC(=O)NCCc3cccc([N+](=O)[O-])c3)ccc2n1 ZINC000536285639 946939979 /nfs/dbraw/zinc/93/99/79/946939979.db2.gz MRSGJUUCBMQOGC-UHFFFAOYSA-N 0 0 366.377 3.516 20 5 FHBDRN Cc1nc(C(C)(C)NC(=O)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)sc1C ZINC000458888527 946940333 /nfs/dbraw/zinc/94/03/33/946940333.db2.gz LRHZRDYHVQKCJF-NSHDSACASA-N 0 0 362.455 3.964 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CSc1nccn1Cc1ccccn1 ZINC000112772778 946942079 /nfs/dbraw/zinc/94/20/79/946942079.db2.gz CXIOYDXBEBFLHR-UHFFFAOYSA-N 0 0 356.407 3.536 20 5 FHBDRN CCOc1ccccc1[C@@H](CC)NC(=O)COc1ccccc1[N+](=O)[O-] ZINC000053318636 946953957 /nfs/dbraw/zinc/95/39/57/946953957.db2.gz FEXQNGQQTRUNHM-OAHLLOKOSA-N 0 0 358.394 3.640 20 5 FHBDRN COc1cccc([C@H]2C[C@@H]2C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000186341613 946960239 /nfs/dbraw/zinc/96/02/39/946960239.db2.gz HJRVMJQWKVYOFW-CVEARBPZSA-N 0 0 360.797 3.677 20 5 FHBDRN COc1cc(C2(C(=O)N3CCc4c3cccc4[N+](=O)[O-])CCC2)ccc1C ZINC000523167028 946965225 /nfs/dbraw/zinc/96/52/25/946965225.db2.gz FCMLMZVXGXPFBM-UHFFFAOYSA-N 0 0 366.417 3.923 20 5 FHBDRN CC(C)[C@@H]1CCCN(C(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000444524078 946974055 /nfs/dbraw/zinc/97/40/55/946974055.db2.gz PERGVILFKGEMSD-OAHLLOKOSA-N 0 0 356.426 3.504 20 5 FHBDRN Cc1cccc(C)c1OC[C@H](C)NC(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000523189249 946977449 /nfs/dbraw/zinc/97/74/49/946977449.db2.gz VOZAATZVVYGULN-INIZCTEOSA-N 0 0 371.437 3.521 20 5 FHBDRN Nc1cccc([N+](=O)[O-])c1C(=O)N1C[C@@H](c2ccccc2)c2ccccc21 ZINC000444510526 946982488 /nfs/dbraw/zinc/98/24/88/946982488.db2.gz NGUUVENHKQQEFB-INIZCTEOSA-N 0 0 359.385 3.969 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@H](CC(C)C)c1ccccc1 ZINC000048975673 946985137 /nfs/dbraw/zinc/98/51/37/946985137.db2.gz QVJLAAORHRVCLQ-GOSISDBHSA-N 0 0 369.421 3.745 20 5 FHBDRN CC[C@@H](C)[C@@H](NC(=O)CCCNc1ccc([N+](=O)[O-])cc1)C(F)(F)F ZINC000444560407 947001495 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O=C(NCc1ccnc(N2CCCCC2)c1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000129742042 947014354 /nfs/dbraw/zinc/01/43/54/947014354.db2.gz BJHRSLAABPUHKO-UHFFFAOYSA-N 0 0 374.828 3.564 20 5 FHBDRN O=C(c1cc(F)c2ccccc2c1)N1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000508500637 947019263 /nfs/dbraw/zinc/01/92/63/947019263.db2.gz OSMUAIWKAHFBHQ-UHFFFAOYSA-N 0 0 368.368 3.561 20 5 FHBDRN CSc1cccc(C(=O)Nc2ccc(-c3n[nH]c(C)n3)cc2)c1[N+](=O)[O-] ZINC000186345969 947020650 /nfs/dbraw/zinc/02/06/50/947020650.db2.gz UPLJOQYJIKNZPQ-UHFFFAOYSA-N 0 0 369.406 3.663 20 5 FHBDRN C[C@]1(CNC(=O)c2ccccc2Sc2ccccc2[N+](=O)[O-])CCOC1 ZINC000440469048 947023650 /nfs/dbraw/zinc/02/36/50/947023650.db2.gz OLVQTXAPNAEUSU-LJQANCHMSA-N 0 0 372.446 3.902 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)c1coc(Br)c1 ZINC000186349890 947035703 /nfs/dbraw/zinc/03/57/03/947035703.db2.gz MEAUDVLUSIRKTQ-UHFFFAOYSA-N 0 0 359.563 3.534 20 5 FHBDRN O=C(Cn1ccc([N+](=O)[O-])n1)Nc1ccc(CCCc2ccccc2)cc1 ZINC000523259123 947036128 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3.552 20 5 FHBDRN C[C@H](NC(=O)NCc1ccc(Cl)cc1F)c1cccc([N+](=O)[O-])c1 ZINC000186364264 947067902 /nfs/dbraw/zinc/06/79/02/947067902.db2.gz PZDTUNSGDZPAOO-JTQLQIEISA-N 0 0 351.765 3.948 20 5 FHBDRN CC(C)C[C@H](C(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccccc1 ZINC000444648520 947068999 /nfs/dbraw/zinc/06/89/99/947068999.db2.gz XZHNGJYVOKJQPZ-INIZCTEOSA-N 0 0 366.421 3.917 20 5 FHBDRN CC(C)(C)CCNc1cnn(-c2ccc([N+](=O)[O-])cc2)c(=O)c1Cl ZINC000523298510 947076352 /nfs/dbraw/zinc/07/63/52/947076352.db2.gz NZNASHHDYNLVIF-UHFFFAOYSA-N 0 0 350.806 3.642 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]c(CN3CC(c4nc5ccccc5s4)C3)nc2c1 ZINC000444657977 947076498 /nfs/dbraw/zinc/07/64/98/947076498.db2.gz AJCLAZZPAFHDCK-UHFFFAOYSA-N 0 0 365.418 3.680 20 5 FHBDRN COc1cc(C)c([C@@H](C)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1OC ZINC000444673586 947097525 /nfs/dbraw/zinc/09/75/25/947097525.db2.gz NFQKADJIWWHJNZ-GFCCVEGCSA-N 0 0 370.409 3.648 20 5 FHBDRN Cc1cc(C)cc(CN(C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)c1 ZINC000444694369 947119886 /nfs/dbraw/zinc/11/98/86/947119886.db2.gz JNOQLSXAQCJTSY-UHFFFAOYSA-N 0 0 352.394 3.894 20 5 FHBDRN Cc1nn(CC(=O)N[C@@H](c2ccccc2)C2CCCCC2)cc1[N+](=O)[O-] ZINC000181826095 947121708 /nfs/dbraw/zinc/12/17/08/947121708.db2.gz BBNALCFQGISSKZ-IBGZPJMESA-N 0 0 356.426 3.538 20 5 FHBDRN O=C(Nc1cc2c(cc1Cl)OCO2)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000536295988 947123116 /nfs/dbraw/zinc/12/31/16/947123116.db2.gz ZQDQUBBIMAFPEL-UHFFFAOYSA-N 0 0 359.725 3.711 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)c1ccnc(N2CC[C@H](C)C2)c1 ZINC000444725368 947169287 /nfs/dbraw/zinc/16/92/87/947169287.db2.gz GNGFQTVQKGIOEW-LBPRGKRZSA-N 0 0 354.410 3.705 20 5 FHBDRN O=C(NCc1cccc([N+](=O)[O-])c1)c1cc(Br)ccc1Cl ZINC000049947187 947175085 /nfs/dbraw/zinc/17/50/85/947175085.db2.gz VDZHRVXWOXDGCO-UHFFFAOYSA-N 0 0 369.602 3.941 20 5 FHBDRN O=C1CCN1c1cccc(CNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 ZINC000440541622 947182125 /nfs/dbraw/zinc/18/21/25/947182125.db2.gz UKKFRDFCYUYXDR-UHFFFAOYSA-N 0 0 365.311 3.962 20 5 FHBDRN CC(C)N(C)C(=O)[C@H](C)Sc1ccc(Br)cc1[N+](=O)[O-] ZINC000088501655 947185328 /nfs/dbraw/zinc/18/53/28/947185328.db2.gz TVTOBQJCFYXWHF-VIFPVBQESA-N 0 0 361.261 3.705 20 5 FHBDRN O=C(CCOc1ccc(F)cc1)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000121282231 947185770 /nfs/dbraw/zinc/18/57/70/947185770.db2.gz NUTVHVYJGCJUJL-UHFFFAOYSA-N 0 0 370.283 3.743 20 5 FHBDRN O=C(NCc1ccc(OC2CCCCC2)nc1)c1ccc([N+](=O)[O-])cc1F ZINC000523366358 947187848 /nfs/dbraw/zinc/18/78/48/947187848.db2.gz HBEWJRLHWIWGHO-UHFFFAOYSA-N 0 0 373.384 3.770 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccnn1CCc1ccccc1 ZINC000523412248 947221339 /nfs/dbraw/zinc/22/13/39/947221339.db2.gz ZUAWRQDQVFPHHH-UHFFFAOYSA-N 0 0 350.378 3.595 20 5 FHBDRN Cc1ccccc1[C@H]1C[C@H](C)N(C(=O)NCc2ccccc2[N+](=O)[O-])C1 ZINC000523413352 947222546 /nfs/dbraw/zinc/22/25/46/947222546.db2.gz IDASKZJQQHKTGJ-RDJZCZTQSA-N 0 0 353.422 3.991 20 5 FHBDRN CN(Cc1ccccc1F)C(=O)c1sc(Br)cc1[N+](=O)[O-] ZINC000444828617 947244137 /nfs/dbraw/zinc/24/41/37/947244137.db2.gz ORYGRIWQCGQUBA-UHFFFAOYSA-N 0 0 373.203 3.830 20 5 FHBDRN CSc1cccc(NC(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)c1 ZINC000444817471 947252357 /nfs/dbraw/zinc/25/23/57/947252357.db2.gz MHJUEUIZESWMKF-UHFFFAOYSA-N 0 0 357.395 3.515 20 5 FHBDRN CSCC1CCC(NC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)CC1 ZINC000458926607 947253275 /nfs/dbraw/zinc/25/32/75/947253275.db2.gz FGTMYVSFPNZJLY-UHFFFAOYSA-N 0 0 365.499 3.701 20 5 FHBDRN Cc1cc(C)n(-c2ccccc2CNC(=O)Nc2ccc([N+](=O)[O-])cc2)n1 ZINC000151821991 947253515 /nfs/dbraw/zinc/25/35/15/947253515.db2.gz CFTHNOICPWRYNI-UHFFFAOYSA-N 0 0 365.393 3.719 20 5 FHBDRN CC(C)Oc1ccc(NC(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000444845780 947256420 /nfs/dbraw/zinc/25/64/20/947256420.db2.gz GZEHNNLGTPTONG-UHFFFAOYSA-N 0 0 369.381 3.580 20 5 FHBDRN COCCc1nsc(Nc2cccc(Oc3ccc([N+](=O)[O-])cc3)c2)n1 ZINC000444830524 947262539 /nfs/dbraw/zinc/26/25/39/947262539.db2.gz WPZOVJGXCRVFMN-UHFFFAOYSA-N 0 0 372.406 3.593 20 5 FHBDRN Cc1c(Br)c(N[C@@H]2[C@H]3CCCO[C@H]3C2(C)C)ncc1[N+](=O)[O-] ZINC000544393460 947276748 /nfs/dbraw/zinc/27/67/48/947276748.db2.gz QRPFINKHQKXUQL-OASPWFOLSA-N 0 0 370.247 3.676 20 5 FHBDRN CCOCc1ccc(CNC(=O)Nc2cc([N+](=O)[O-])ccc2OCC)cc1 ZINC000439900831 947286084 /nfs/dbraw/zinc/28/60/84/947286084.db2.gz LQXQMIIXFYUHAS-UHFFFAOYSA-N 0 0 373.409 3.852 20 5 FHBDRN CC(C)(C)OC(=O)CCSCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000440581687 947288719 /nfs/dbraw/zinc/28/87/19/947288719.db2.gz FSMGXCJEMIJMHI-UHFFFAOYSA-N 0 0 365.411 3.610 20 5 FHBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1OC(=O)c1c2c(ccc1F)OCO2 ZINC001126196618 947302740 /nfs/dbraw/zinc/30/27/40/947302740.db2.gz VQLNHEPZAAEUPX-UHFFFAOYSA-N 0 0 353.689 3.644 20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])N1CCc2c(Cl)cccc2C1 ZINC000523487248 947303710 /nfs/dbraw/zinc/30/37/10/947303710.db2.gz RPJMJQUKADVUPI-UHFFFAOYSA-N 0 0 359.813 3.635 20 5 FHBDRN CCO[C@@H](CCNC(=O)Nc1ccc([N+](=O)[O-])cc1OC)C1CCCC1 ZINC000444901542 947322106 /nfs/dbraw/zinc/32/21/06/947322106.db2.gz UWTFGBVYBRRIGP-INIZCTEOSA-N 0 0 365.430 3.710 20 5 FHBDRN Cc1ccc(NCCCNC(=O)C2(c3ccccc3F)CC2)c([N+](=O)[O-])c1 ZINC000523510850 947323684 /nfs/dbraw/zinc/32/36/84/947323684.db2.gz FCUOTDUREXXIDV-UHFFFAOYSA-N 0 0 371.412 3.692 20 5 FHBDRN COc1cccc(C(C)(C)CNC(=O)Nc2ccc([N+](=O)[O-])cc2OC)c1 ZINC000444904171 947324195 /nfs/dbraw/zinc/32/41/95/947324195.db2.gz ZMRXAGYYYFTYRM-UHFFFAOYSA-N 0 0 373.409 3.711 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[C@@H](c2ccccc2C)C1 ZINC000444893553 947333412 /nfs/dbraw/zinc/33/34/12/947333412.db2.gz GDXUUXROUXWMCE-CQSZACIVSA-N 0 0 355.394 3.933 20 5 FHBDRN Cc1ccc(/C=C\CC(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000440584405 947336444 /nfs/dbraw/zinc/33/64/44/947336444.db2.gz ZYRYEUCAEVUFQQ-RQOWECAXSA-N 0 0 365.433 3.655 20 5 FHBDRN Cc1ccc(S(=O)(=O)N(C)Cc2ccc(F)c(Cl)c2)cc1[N+](=O)[O-] ZINC000432299843 947336631 /nfs/dbraw/zinc/33/66/31/947336631.db2.gz RABKXFHKCMGSCG-UHFFFAOYSA-N 0 0 372.805 3.516 20 5 FHBDRN Cc1c(NC(=O)[C@H](C)SCCC(=O)OC(C)(C)C)cccc1[N+](=O)[O-] ZINC000440590770 947336958 /nfs/dbraw/zinc/33/69/58/947336958.db2.gz LQXOWFZDUMDFEJ-LBPRGKRZSA-N 0 0 368.455 3.695 20 5 FHBDRN COC(=O)c1ccc(NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)cc1C ZINC000523505791 947337529 /nfs/dbraw/zinc/33/75/29/947337529.db2.gz IKHFYEOJBVETAM-UHFFFAOYSA-N 0 0 356.378 3.606 20 5 FHBDRN CCOc1cccc([C@H]2C[C@@H]2NC(=O)Nc2ccc([N+](=O)[O-])cc2OC)c1 ZINC000444919493 947337866 /nfs/dbraw/zinc/33/78/66/947337866.db2.gz DLTBEGOLYDJENQ-WBVHZDCISA-N 0 0 371.393 3.680 20 5 FHBDRN C[C@H](NC(=O)Nc1ccncc1[N+](=O)[O-])c1ccc(Cl)cc1Cl ZINC000444946170 947365525 /nfs/dbraw/zinc/36/55/25/947365525.db2.gz WRXHWQSUIMOCMZ-QMMMGPOBSA-N 0 0 355.181 3.601 20 5 FHBDRN Cc1ccc(Sc2ccc(C(=O)NC[C@@H]3CCCO3)cc2[N+](=O)[O-])cc1 ZINC000021298850 947366514 /nfs/dbraw/zinc/36/65/14/947366514.db2.gz KRRJEJCQPOYTKQ-HNNXBMFYSA-N 0 0 372.446 3.963 20 5 FHBDRN Cc1ccc(Oc2ccccc2)c(NC(=O)Cn2ccc([N+](=O)[O-])n2)c1 ZINC000440623985 947373599 /nfs/dbraw/zinc/37/35/99/947373599.db2.gz LDBOWFDQPPWFAF-UHFFFAOYSA-N 0 0 352.350 3.531 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)Nc1cc2[nH]ccc2cc1C ZINC000444969334 947376362 /nfs/dbraw/zinc/37/63/62/947376362.db2.gz RWTUTINGZPSJBE-UHFFFAOYSA-N 0 0 354.366 3.715 20 5 FHBDRN C[C@@H](Cc1cccc(O)c1)NC(=O)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000444963233 947389851 /nfs/dbraw/zinc/38/98/51/947389851.db2.gz GCFJNJCCGUAACZ-AWEZNQCLSA-N 0 0 372.424 3.748 20 5 FHBDRN O=[N+]([O-])c1cc2ccccc2nc1N1CCCN(c2ccccc2F)CC1 ZINC000574644425 947391181 /nfs/dbraw/zinc/39/11/81/947391181.db2.gz IQGUZVNAXYCGSM-UHFFFAOYSA-N 0 0 366.396 3.999 20 5 FHBDRN CO[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2SC(C)C)[C@H](C)C1 ZINC000441439795 947392208 /nfs/dbraw/zinc/39/22/08/947392208.db2.gz VCAZIRJNSCXSJP-TZMCWYRMSA-N 0 0 352.456 3.735 20 5 FHBDRN CC(C)N(Cc1ccccn1)C(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000054301295 947401821 /nfs/dbraw/zinc/40/18/21/947401821.db2.gz BUTSMSQTYMGZHG-CQSZACIVSA-N 0 0 359.451 3.908 20 5 FHBDRN COc1ccc(C(=O)NCc2cccc(COC(C)(C)C)c2)cc1[N+](=O)[O-] ZINC000523585894 947404066 /nfs/dbraw/zinc/40/40/66/947404066.db2.gz HXKLQWYYDHISLH-UHFFFAOYSA-N 0 0 372.421 3.849 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N[C@H]1CCCc2c(O)cccc21 ZINC000190290352 947412691 /nfs/dbraw/zinc/41/26/91/947412691.db2.gz ZLECSEUUXPLWSH-SFHVURJKSA-N 0 0 365.389 3.518 20 5 FHBDRN CC(C)Oc1ccccc1CC(=O)Nc1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000440631126 947429437 /nfs/dbraw/zinc/42/94/37/947429437.db2.gz WAJPXRXYTXZVII-UHFFFAOYSA-N 0 0 365.389 3.533 20 5 FHBDRN Cc1nc(CNC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)sc1C ZINC000074918914 947475031 /nfs/dbraw/zinc/47/50/31/947475031.db2.gz KJGVTMYWDHDVHX-UHFFFAOYSA-N 0 0 362.455 3.788 20 5 FHBDRN Cc1ccccc1[C@@H]1CN(CCOc2cccc([N+](=O)[O-])c2)[C@H](C)CO1 ZINC000441447944 947486232 /nfs/dbraw/zinc/48/62/32/947486232.db2.gz FIPLZFSSYGSQPV-UZLBHIALSA-N 0 0 356.422 3.744 20 5 FHBDRN CCCN(C(=O)COc1ccc(OC)c(C)c1)c1cccc([N+](=O)[O-])c1 ZINC000441449873 947487937 /nfs/dbraw/zinc/48/79/37/947487937.db2.gz JXEHLGOHHMVNFE-UHFFFAOYSA-N 0 0 358.394 3.734 20 5 FHBDRN Cc1cc(C)cc([C@H](C)NC(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)c1 ZINC000445102700 947496794 /nfs/dbraw/zinc/49/67/94/947496794.db2.gz NMOAOOTYYPWOSO-ZDUSSCGKSA-N 0 0 367.409 3.648 20 5 FHBDRN CC(C)[C@H](NC(=O)c1nn(C)cc1[N+](=O)[O-])c1ccc(C(C)(C)C)cc1 ZINC000511962075 947500115 /nfs/dbraw/zinc/50/01/15/947500115.db2.gz ABXWOEIWXGDDRO-INIZCTEOSA-N 0 0 358.442 3.753 20 5 FHBDRN Cc1c(C(=O)N2C[C@@H](c3ccc(F)cc3)O[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000152074746 947520028 /nfs/dbraw/zinc/52/00/28/947520028.db2.gz ZRHQJOXBOVLDRM-SGTLLEGYSA-N 0 0 358.369 3.645 20 5 FHBDRN CCn1c(C)cc(C(=O)O[C@@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)c1C ZINC000759932137 947522192 /nfs/dbraw/zinc/52/21/92/947522192.db2.gz MRKHGDYHBUPQCD-JKSUJKDBSA-N 0 0 360.414 3.570 20 5 FHBDRN O=C(O[C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1)c1cccc(F)c1Cl ZINC000759932182 947522268 /nfs/dbraw/zinc/52/22/68/947522268.db2.gz MXXYSAYPNDVVHV-OLZOCXBDSA-N 0 0 367.764 3.925 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)N1CCC[C@@H]1C[C@@H](O)c1ccc(F)cc1 ZINC000162830105 947524097 /nfs/dbraw/zinc/52/40/97/947524097.db2.gz QWPGGTLMQBXXEN-QZTJIDSGSA-N 0 0 373.384 3.854 20 5 FHBDRN Cc1ncc2c(n1)CC[C@@H](Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C2 ZINC000523695264 947524282 /nfs/dbraw/zinc/52/42/82/947524282.db2.gz BFLPWAJEGGJHTP-GFCCVEGCSA-N 0 0 352.316 3.681 20 5 FHBDRN COc1cc(F)c(NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)cc1OC ZINC000120338495 947552319 /nfs/dbraw/zinc/55/23/19/947552319.db2.gz KHRFMYIZAIWKJW-UHFFFAOYSA-N 0 0 354.721 3.657 20 5 FHBDRN CCCN(C(=O)c1cn(C)c(=O)c2ccccc12)c1cccc([N+](=O)[O-])c1 ZINC000441457054 947558146 /nfs/dbraw/zinc/55/81/46/947558146.db2.gz IUOPYNLMFNERRQ-UHFFFAOYSA-N 0 0 365.389 3.504 20 5 FHBDRN Cc1cc(S(=O)(=O)N[C@@H]2CCc3c2cccc3Cl)ccc1[N+](=O)[O-] ZINC000523757416 947574594 /nfs/dbraw/zinc/57/45/94/947574594.db2.gz ISOPZJFJOQEXRM-OAHLLOKOSA-N 0 0 366.826 3.522 20 5 FHBDRN C[C@H](c1nc(Cc2ccccc2)no1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088605783 947574624 /nfs/dbraw/zinc/57/46/24/947574624.db2.gz CNAKPTOEROLPJH-CQSZACIVSA-N 0 0 364.405 3.688 20 5 FHBDRN Cc1ccc(S(=O)(=O)N[C@@H]2CCCCc3ccccc32)c([N+](=O)[O-])c1 ZINC000523765381 947581925 /nfs/dbraw/zinc/58/19/25/947581925.db2.gz CWTPWIPJEGYIGN-MRXNPFEDSA-N 0 0 360.435 3.649 20 5 FHBDRN C[C@H]1C[C@H](c2ccccc2)CN1c1cc2nc[nH]c(=O)c2cc1[N+](=O)[O-] ZINC000523752704 947587629 /nfs/dbraw/zinc/58/76/29/947587629.db2.gz NNZNYTGBBBPXQE-JSGCOSHPSA-N 0 0 350.378 3.626 20 5 FHBDRN O=C(N[C@@H](C1CCCC1)C(F)(F)F)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000127917847 947628993 /nfs/dbraw/zinc/62/89/93/947628993.db2.gz HOLBYHDUSPVJQM-HNNXBMFYSA-N 0 0 371.359 3.784 20 5 FHBDRN O=C(O[C@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)c1ccc(Cl)cc1F ZINC000759934873 947664034 /nfs/dbraw/zinc/66/40/34/947664034.db2.gz QPPYFEBHOPAZPJ-KBPBESRZSA-N 0 0 367.764 3.925 20 5 FHBDRN C[C@H](C(=O)N(C)Cc1c(F)cccc1F)c1ccc([N+](=O)[O-])cc1F ZINC000511966775 947679441 /nfs/dbraw/zinc/67/94/41/947679441.db2.gz CJXAXTKKPKHHBG-JTQLQIEISA-N 0 0 352.312 3.774 20 5 FHBDRN COc1ccccc1C1(NC(=O)CCc2cc(F)ccc2[N+](=O)[O-])CCC1 ZINC001126219603 947687091 /nfs/dbraw/zinc/68/70/91/947687091.db2.gz IONWMRAQPQRBRJ-UHFFFAOYSA-N 0 0 372.396 3.871 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1[C@H]2CCO[C@@H]2C12CCCC2 ZINC000248392349 947698789 /nfs/dbraw/zinc/69/87/89/947698789.db2.gz KIMJCHNZDBAWRB-OWYHZJEWSA-N 0 0 372.465 3.627 20 5 FHBDRN COc1ccc(/C=C\C(=O)O[C@@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)cc1 ZINC000759937311 947709997 /nfs/dbraw/zinc/70/99/97/947709997.db2.gz WMDQAIKYYXSBMB-RIDHJDLKSA-N 0 0 371.393 3.540 20 5 FHBDRN Cc1cc(C)n(-c2ccc(CNc3ncc(F)c(C)c3[N+](=O)[O-])cc2)n1 ZINC001167796971 947711450 /nfs/dbraw/zinc/71/14/50/947711450.db2.gz GMVUUMUKTXWEMZ-UHFFFAOYSA-N 0 0 355.373 3.852 20 5 FHBDRN CCOc1ccccc1[C@H](CC)NC(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000523905710 947721266 /nfs/dbraw/zinc/72/12/66/947721266.db2.gz UPODQLVXJJNOEA-SFHVURJKSA-N 0 0 371.437 3.987 20 5 FHBDRN O=[N+]([O-])c1ccc(OC[C@H](O)COc2ccc(Cl)cc2)c2cccnc21 ZINC000184582939 947724276 /nfs/dbraw/zinc/72/42/76/947724276.db2.gz WDXBGVPHPSZLJY-CYBMUJFWSA-N 0 0 374.780 3.615 20 5 FHBDRN C[C@H](Cc1ccccc1)C(=O)O[C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1 ZINC000759938646 947725721 /nfs/dbraw/zinc/72/57/21/947725721.db2.gz LIRMMXAZSMIUDA-HYVNUMGLSA-N 0 0 357.410 3.697 20 5 FHBDRN Cc1cc(C)c(NC(=O)Cc2noc(-c3ccc([N+](=O)[O-])cc3)n2)c(C)c1 ZINC000445330360 947730199 /nfs/dbraw/zinc/73/01/99/947730199.db2.gz AGQOTQRDQDJUIB-UHFFFAOYSA-N 0 0 366.377 3.751 20 5 FHBDRN Cc1ccc(OCC(=O)O[C@@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)cc1C ZINC000759937792 947742309 /nfs/dbraw/zinc/74/23/09/947742309.db2.gz IXLWWHXJQQGZBE-DLBZAZTESA-N 0 0 373.409 3.514 20 5 FHBDRN Cc1ccc(NC(=O)Cc2noc(-c3ccc([N+](=O)[O-])s3)n2)c(C)c1 ZINC000445355706 947750508 /nfs/dbraw/zinc/75/05/08/947750508.db2.gz FRSHLJKDRQDFMO-UHFFFAOYSA-N 0 0 358.379 3.504 20 5 FHBDRN CNc1ccc(C(=O)N(CCc2ccc(F)cc2)C2CC2)cc1[N+](=O)[O-] ZINC000523949892 947753999 /nfs/dbraw/zinc/75/39/99/947753999.db2.gz DWUHJLXPDFRYCR-UHFFFAOYSA-N 0 0 357.385 3.623 20 5 FHBDRN CCO[C@H]1C[C@H](NC(=O)CCc2ccc([N+](=O)[O-])cc2Cl)C12CCC2 ZINC001126229283 947779530 /nfs/dbraw/zinc/77/95/30/947779530.db2.gz MFZHZOZMLIJQEF-HOTGVXAUSA-N 0 0 366.845 3.645 20 5 FHBDRN O=C(O[C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)c1nccc2ccccc21 ZINC000759940340 947788673 /nfs/dbraw/zinc/78/86/73/947788673.db2.gz DXFBJAPNHRSQRO-JKSUJKDBSA-N 0 0 366.377 3.680 20 5 FHBDRN CCOc1ccccc1-c1noc(CN(C)c2ccccc2[N+](=O)[O-])n1 ZINC000546287979 947799799 /nfs/dbraw/zinc/79/97/99/947799799.db2.gz HANGVNQMMQKPBG-UHFFFAOYSA-N 0 0 354.366 3.680 20 5 FHBDRN O=C(Cc1c[nH]c2ccccc12)O[C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000759942311 947805800 /nfs/dbraw/zinc/80/58/00/947805800.db2.gz CCTOXTRLAJJEIN-SJORKVTESA-N 0 0 368.393 3.542 20 5 FHBDRN Cc1cc(S(=O)(=O)N(C)Cc2ccc(F)c(Cl)c2)ccc1[N+](=O)[O-] ZINC000432309727 947830573 /nfs/dbraw/zinc/83/05/73/947830573.db2.gz YRSRUXQNAZUOKR-UHFFFAOYSA-N 0 0 372.805 3.516 20 5 FHBDRN O=C(O[C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1)c1ccc(Cl)s1 ZINC000759943435 947836507 /nfs/dbraw/zinc/83/65/07/947836507.db2.gz DWMAKKNSJUCLID-ZJUUUORDSA-N 0 0 355.803 3.847 20 5 FHBDRN CC(C)[C@H](C)NC(=O)C1CCN(c2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000432312182 947884341 /nfs/dbraw/zinc/88/43/41/947884341.db2.gz GARQXWOAFZJUOO-LBPRGKRZSA-N 0 0 353.850 3.625 20 5 FHBDRN O=[N+]([O-])c1cccc2c(NCc3cccc(Cn4cccn4)c3)ccnc21 ZINC000432313760 947896044 /nfs/dbraw/zinc/89/60/44/947896044.db2.gz SNUDXCHXBQWEJN-UHFFFAOYSA-N 0 0 359.389 4.000 20 5 FHBDRN C[C@H](Nc1ccc([N+](=O)[O-])c(N)c1F)c1nc(C(F)(F)F)cs1 ZINC000278875784 947937623 /nfs/dbraw/zinc/93/76/23/947937623.db2.gz VSOFYQBWNOHQCY-YFKPBYRVSA-N 0 0 350.297 3.965 20 5 FHBDRN CN(Cc1cn(C)nc1C(F)(F)F)c1ccnc2c1cccc2[N+](=O)[O-] ZINC000432313964 947937877 /nfs/dbraw/zinc/93/78/77/947937877.db2.gz PHEPZALHMDUAGW-UHFFFAOYSA-N 0 0 365.315 3.532 20 5 FHBDRN CC(C)C1CCC(N(C)S(=O)(=O)Cc2ccccc2[N+](=O)[O-])CC1 ZINC000432315122 947957833 /nfs/dbraw/zinc/95/78/33/947957833.db2.gz TUDISIOFTBVGQR-UHFFFAOYSA-N 0 0 354.472 3.571 20 5 FHBDRN C[C@@H]1CC(=O)Oc2cc(OC(=O)c3cc(Cl)ccc3[N+](=O)[O-])ccc21 ZINC000785352076 948010432 /nfs/dbraw/zinc/01/04/32/948010432.db2.gz WMXZXHADGBMLGV-SECBINFHSA-N 0 0 361.737 3.880 20 5 FHBDRN CC(C)[C@@H]1C[C@H](CNC(=O)NC(C)(C)c2ccccc2[N+](=O)[O-])CCO1 ZINC000459063884 948010586 /nfs/dbraw/zinc/01/05/86/948010586.db2.gz NDTQLRQLBJCGNR-PBHICJAKSA-N 0 0 363.458 3.580 20 5 FHBDRN CC(C)(C)C(=O)NC[C@@H]1CCCN(c2ccnc3c2cccc3[N+](=O)[O-])C1 ZINC000432319793 948021760 /nfs/dbraw/zinc/02/17/60/948021760.db2.gz ITPBGVDYLDERLA-AWEZNQCLSA-N 0 0 370.453 3.522 20 5 FHBDRN CC[C@@H]1CCCCCN1C(=O)COc1ccc([N+](=O)[O-])c2cccnc12 ZINC000432321733 948024879 /nfs/dbraw/zinc/02/48/79/948024879.db2.gz HNIUUEWDCQWWBC-CQSZACIVSA-N 0 0 357.410 3.703 20 5 FHBDRN O=C(Cc1cccc(Cl)c1)O[C@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1 ZINC000759944776 948024929 /nfs/dbraw/zinc/02/49/29/948024929.db2.gz SISQCKAVNMQUAW-GJZGRUSLSA-N 0 0 363.801 3.714 20 5 FHBDRN CCCCCNC(=O)C1CCN(c2ccnc3c2cccc3[N+](=O)[O-])CC1 ZINC000432321458 948026659 /nfs/dbraw/zinc/02/66/59/948026659.db2.gz UVJFIMUMKJPAEV-UHFFFAOYSA-N 0 0 370.453 3.666 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(NC[C@H]2CCCO2)c(F)c1 ZINC000129555130 948030242 /nfs/dbraw/zinc/03/02/42/948030242.db2.gz BWQFNRPGJOPPOP-OAHLLOKOSA-N 0 0 373.384 3.886 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N[C@H](c2ccccc2)C2CC2)cc1OC ZINC000025879861 948079399 /nfs/dbraw/zinc/07/93/99/948079399.db2.gz OEJIHHQLSJVFAK-LJQANCHMSA-N 0 0 370.405 3.883 20 5 FHBDRN C[C@H]1CC(=O)Oc2cc(OC(=O)/C=C\c3ccc([N+](=O)[O-])cc3)ccc21 ZINC000785360567 948099432 /nfs/dbraw/zinc/09/94/32/948099432.db2.gz CBSJEAQIFBCRET-REPPVQDKSA-N 0 0 353.330 3.626 20 5 FHBDRN C[C@H]1CC(=O)Oc2cc(OC(=O)/C=C/c3ccc([N+](=O)[O-])cc3)ccc21 ZINC000785360565 948099871 /nfs/dbraw/zinc/09/98/71/948099871.db2.gz CBSJEAQIFBCRET-KFRNIWOLSA-N 0 0 353.330 3.626 20 5 FHBDRN CC(C)(C(=O)NCc1ccn(C2CCCC2)n1)c1ccc([N+](=O)[O-])cc1 ZINC000432331795 948105338 /nfs/dbraw/zinc/10/53/38/948105338.db2.gz QKZSBYDESHJITN-UHFFFAOYSA-N 0 0 356.426 3.500 20 5 FHBDRN COc1ccc(CSCc2nc(-c3cc(C)ccn3)no2)cc1[N+](=O)[O-] ZINC000546296146 948121545 /nfs/dbraw/zinc/12/15/45/948121545.db2.gz VBNFZGMCFXGDDW-UHFFFAOYSA-N 0 0 372.406 3.790 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H](OC)c1ccccc1 ZINC000184668509 948124037 /nfs/dbraw/zinc/12/40/37/948124037.db2.gz YDATWMIHZJAQGP-APWZRJJASA-N 0 0 356.422 3.667 20 5 FHBDRN COC(=O)COc1ccc(CNc2csc3ccccc23)cc1[N+](=O)[O-] ZINC000473992165 948137066 /nfs/dbraw/zinc/13/70/66/948137066.db2.gz GUCMEDLEFFINTI-UHFFFAOYSA-N 0 0 372.402 3.973 20 5 FHBDRN COc1cc(C(=O)N[C@@H]2CCC[C@H](C)[C@@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000585690209 948138837 /nfs/dbraw/zinc/13/88/37/948138837.db2.gz RTXGCTULSSTJJM-JBLDHEPKSA-N 0 0 372.368 3.759 20 5 FHBDRN O=[N+]([O-])c1cc(-c2nc([C@@H]3C[C@H]3c3ccccc3)no2)cc2c1OCO2 ZINC000511999056 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DTMRNGJJVYBDTD-UHFFFAOYSA-N 0 0 355.375 3.883 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCCO[C@@H]1CCCC[C@H]1C ZINC000481354341 567819173 /nfs/dbraw/zinc/81/91/73/567819173.db2.gz XMSNAEWPEOFCCA-JKIFEVAISA-N 0 0 366.483 3.787 20 5 FHBDRN CC[C@H](CNC(=O)Nc1ccc([N+](=O)[O-])cc1F)Oc1ccccc1F ZINC000541785699 567832810 /nfs/dbraw/zinc/83/28/10/567832810.db2.gz ZKMQFCHKETYNCR-GFCCVEGCSA-N 0 0 365.336 3.852 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)NCCCc1ccc(OC)cc1 ZINC000568069096 567835194 /nfs/dbraw/zinc/83/51/94/567835194.db2.gz FUATXCXRNOYEQF-UHFFFAOYSA-N 0 0 357.410 3.920 20 5 FHBDRN Cc1cc(C(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)nn1C(C)C ZINC000452860341 567835519 /nfs/dbraw/zinc/83/55/19/567835519.db2.gz IIDPVMYVHUXOLJ-INIZCTEOSA-N 0 0 356.426 3.700 20 5 FHBDRN CCO[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)C[C@H]1C ZINC000452865675 567836875 /nfs/dbraw/zinc/83/68/75/567836875.db2.gz NWIDLOLRADQNAQ-QMTHXVAHSA-N 0 0 360.332 3.501 20 5 FHBDRN Cc1c(NC(=O)Cc2cccc(OC(F)(F)F)c2)cccc1[N+](=O)[O-] ZINC000159174385 567846009 /nfs/dbraw/zinc/84/60/09/567846009.db2.gz MERIQNCCUXSJMY-UHFFFAOYSA-N 0 0 354.284 3.983 20 5 FHBDRN O=C(COc1cccc(F)c1)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452879907 567865503 /nfs/dbraw/zinc/86/55/03/567865503.db2.gz NNFZBACURVHBKC-HNNXBMFYSA-N 0 0 358.369 3.519 20 5 FHBDRN CCO[C@H]1CCN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])C[C@H]1C ZINC000452875745 567873159 /nfs/dbraw/zinc/87/31/59/567873159.db2.gz SNMIQPQPNVKVTN-YGRLFVJLSA-N 0 0 360.332 3.501 20 5 FHBDRN CC[NH+](CC)[C@@H](CNc1cc(C)c([N+](=O)[O-])cc1C(=O)[O-])CC(C)C ZINC000568095055 567879144 /nfs/dbraw/zinc/87/91/44/567879144.db2.gz XNSIZEMVGCWOKP-CQSZACIVSA-N 0 0 351.447 3.770 20 5 FHBDRN CC[C@H](CNC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)CC(F)(F)F ZINC000412639242 567881905 /nfs/dbraw/zinc/88/19/05/567881905.db2.gz RXRAOUDTAPTRMH-QMMMGPOBSA-N 0 0 370.274 3.905 20 5 FHBDRN CC1(C)CN(c2nnc(-c3cccc([N+](=O)[O-])c3)n2C2CC2)CCS1 ZINC000568104496 567885828 /nfs/dbraw/zinc/88/58/28/567885828.db2.gz TZUGPGFSWTVIIJ-UHFFFAOYSA-N 0 0 359.455 3.520 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)N(C)Cc2cc3ccccc3o2)c1 ZINC000541817839 567904371 /nfs/dbraw/zinc/90/43/71/567904371.db2.gz YTLBBGOHLUMUFR-UHFFFAOYSA-N 0 0 374.418 3.779 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H]1c2ccc(F)cc2O[C@@H]1C ZINC000517910418 567909114 /nfs/dbraw/zinc/90/91/14/567909114.db2.gz FTRBLLZEOYAKPC-BMLIUANNSA-N 0 0 359.357 3.940 20 5 FHBDRN CC(C)[C@@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1F)c1nc(C2CC2)no1 ZINC000541834531 567950865 /nfs/dbraw/zinc/95/08/65/567950865.db2.gz LEYSXCKBQKQXNJ-CYBMUJFWSA-N 0 0 363.349 3.513 20 5 FHBDRN O=C(c1ccn(-c2cccc([N+](=O)[O-])c2)n1)N1CC2(CCC2)c2ccccc21 ZINC000481444351 567953870 /nfs/dbraw/zinc/95/38/70/567953870.db2.gz YYIKOAVZZPYUMQ-UHFFFAOYSA-N 0 0 374.400 3.863 20 5 FHBDRN Cc1c(CNC(=O)[C@H]2C[C@@]23CCCc2ccccc23)cccc1[N+](=O)[O-] ZINC000481465715 567965110 /nfs/dbraw/zinc/96/51/10/567965110.db2.gz LKNPKVCQLSYWCW-WIYYLYMNSA-N 0 0 350.418 3.814 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN[C@@H](C(C)(C)C)C(F)(F)F ZINC000541846216 567970079 /nfs/dbraw/zinc/97/00/79/567970079.db2.gz CQLDTOFWPSZCTP-AWEZNQCLSA-N 0 0 361.364 3.798 20 5 FHBDRN Cc1c(CNC(=O)c2csc(-c3ccccc3)n2)cccc1[N+](=O)[O-] ZINC000481471810 567970208 /nfs/dbraw/zinc/97/02/08/567970208.db2.gz BEIOQKKYXCFPBK-UHFFFAOYSA-N 0 0 353.403 3.957 20 5 FHBDRN CC(C)(C)[C@@H]1CCCN(S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000481474421 567972241 /nfs/dbraw/zinc/97/22/41/567972241.db2.gz PLUNYDYHLYTNJQ-LLVKDONJSA-N 0 0 360.863 3.695 20 5 FHBDRN CCc1c(C(=O)NCc2cccc([N+](=O)[O-])c2C)cnn1-c1ccccc1 ZINC000481477512 567974285 /nfs/dbraw/zinc/97/42/85/567974285.db2.gz NYEZJNNHCMEVFW-UHFFFAOYSA-N 0 0 364.405 3.581 20 5 FHBDRN Cc1c(CNC(=O)C2=Cc3cc(Cl)ccc3OC2)cccc1[N+](=O)[O-] ZINC000481473911 567975994 /nfs/dbraw/zinc/97/59/94/567975994.db2.gz GXDXZJIREKHAHV-UHFFFAOYSA-N 0 0 358.781 3.649 20 5 FHBDRN Cc1c(C(=O)NCc2cccc([N+](=O)[O-])c2C)cnn1-c1ccccc1C ZINC000481479762 567976718 /nfs/dbraw/zinc/97/67/18/567976718.db2.gz QRCGVJBTFWGQRJ-UHFFFAOYSA-N 0 0 364.405 3.636 20 5 FHBDRN Cc1c(CNC(=O)c2ccc(OC(F)(F)F)cc2)cccc1[N+](=O)[O-] ZINC000481493039 567992291 /nfs/dbraw/zinc/99/22/91/567992291.db2.gz OUMZQNWCBUTUKX-UHFFFAOYSA-N 0 0 354.284 3.732 20 5 FHBDRN O=C(N1CCC2(CC2(F)F)CC1)C1(c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000601654645 568011702 /nfs/dbraw/zinc/01/17/02/568011702.db2.gz PPHQSSKEMWUMGS-UHFFFAOYSA-N 0 0 350.365 3.664 20 5 FHBDRN CCc1nn(C)c(N2CCC(c3noc4cc(F)ccc43)CC2)c1[N+](=O)[O-] ZINC000291064029 568012789 /nfs/dbraw/zinc/01/27/89/568012789.db2.gz GCFHJGKVTMLGJS-UHFFFAOYSA-N 0 0 373.388 3.555 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)c1nc(CCC(C)(C)[N+](=O)[O-])no1 ZINC000291077063 568013959 /nfs/dbraw/zinc/01/39/59/568013959.db2.gz MTACPHBTNPRTGK-JTQLQIEISA-N 0 0 366.399 3.819 20 5 FHBDRN Cc1cc(CNCc2cc(Br)c([N+](=O)[O-])s2)cc(C)n1 ZINC000602695650 568016188 /nfs/dbraw/zinc/01/61/88/568016188.db2.gz BUNLKAAJUAWZAT-UHFFFAOYSA-N 0 0 356.245 3.720 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1F)N1CC[C@H](Oc2ccc(Cl)cc2)C1 ZINC000568312710 568019351 /nfs/dbraw/zinc/01/93/51/568019351.db2.gz BSTINXJFMQQIGI-AWEZNQCLSA-N 0 0 364.760 3.681 20 5 FHBDRN O=C(Nc1ccc2[nH]c(-c3ccc(F)cc3)nc2c1)c1ccc([N+](=O)[O-])[nH]1 ZINC000481506907 568021137 /nfs/dbraw/zinc/02/11/37/568021137.db2.gz RDFMXVRTDXOUGA-UHFFFAOYSA-N 0 0 365.324 3.858 20 5 FHBDRN Cc1sc(C(=O)N[C@H]2CCO[C@H]2c2ccc(F)c(F)c2)cc1[N+](=O)[O-] ZINC000181863561 568029236 /nfs/dbraw/zinc/02/92/36/568029236.db2.gz JGYMCVZOTDUUBC-WFASDCNBSA-N 0 0 368.361 3.503 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NCC1CCSCC1 ZINC000264995637 568030628 /nfs/dbraw/zinc/03/06/28/568030628.db2.gz IBASKAZPPOJGSG-UHFFFAOYSA-N 0 0 351.472 3.658 20 5 FHBDRN O=[N+]([O-])c1cc2c(nc1N1CC[C@H](n3ncc4ccccc43)C1)CCCC2 ZINC000568505494 568042851 /nfs/dbraw/zinc/04/28/51/568042851.db2.gz ZZZSHYKPDXSKSG-INIZCTEOSA-N 0 0 363.421 3.670 20 5 FHBDRN COC(=O)CCC(=O)Nc1c2ccccc2n2c1c1ccccc1nc2C ZINC000603018221 568052074 /nfs/dbraw/zinc/05/20/74/568052074.db2.gz SYJIIFVEZFUPSA-UHFFFAOYSA-N 0 0 361.401 3.841 20 5 FHBDRN C[C@H]1CCN(CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)[C@H](c2ccco2)C1 ZINC000072905304 568057076 /nfs/dbraw/zinc/05/70/76/568057076.db2.gz ZHMDCCQKQKDIMR-YOEHRIQHSA-N 0 0 357.410 3.624 20 5 FHBDRN CC(=O)c1cc(NCc2cc(C)nc(N3CCCC3)c2)ccc1[N+](=O)[O-] ZINC000291114935 568057988 /nfs/dbraw/zinc/05/79/88/568057988.db2.gz LUKUQNJRVSKXJB-UHFFFAOYSA-N 0 0 354.410 3.713 20 5 FHBDRN COC(=O)[C@H](Cc1ccc(C)cc1)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000481581805 568060437 /nfs/dbraw/zinc/06/04/37/568060437.db2.gz OQKSXYLKIZMRBJ-YJBOKZPZSA-N 0 0 356.422 3.647 20 5 FHBDRN COC(=O)c1cc(NC(=O)c2cc([N+](=O)[O-])c(C)s2)cc(Cl)c1F ZINC000481574105 568060449 /nfs/dbraw/zinc/06/04/49/568060449.db2.gz SNXBWOMMPANMAN-UHFFFAOYSA-N 0 0 372.761 3.796 20 5 FHBDRN CC[C@@H](N[C@@H](Cc1ccc(C)cc1)C(=O)OC)c1cccc([N+](=O)[O-])c1 ZINC000481578063 568061460 /nfs/dbraw/zinc/06/14/60/568061460.db2.gz BTHAMHQWEQGOLU-MOPGFXCFSA-N 0 0 356.422 3.728 20 5 FHBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])Nc1ccc(F)cc1F ZINC000481594777 568061502 /nfs/dbraw/zinc/06/15/02/568061502.db2.gz GENHAZQUSCUMBB-UHFFFAOYSA-N 0 0 355.728 3.891 20 5 FHBDRN CC(C)(CCc1noc(-c2csc(-c3cccs3)n2)n1)[N+](=O)[O-] ZINC000291138399 568063330 /nfs/dbraw/zinc/06/33/30/568063330.db2.gz XMHKSIXUTHXRGI-UHFFFAOYSA-N 0 0 350.425 3.910 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])Nc1ccccc1OCC(F)(F)F ZINC000065859245 568063410 /nfs/dbraw/zinc/06/34/10/568063410.db2.gz XZGYXICCVCNIMV-UHFFFAOYSA-N 0 0 369.299 3.587 20 5 FHBDRN COCc1nc(C)c(C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)s1 ZINC000159250765 568064204 /nfs/dbraw/zinc/06/42/04/568064204.db2.gz HCDPGRJLPRFGTC-UHFFFAOYSA-N 0 0 363.439 3.557 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CN(C)Cc1cc(OC)c(OC)cc1C ZINC000024744787 568065041 /nfs/dbraw/zinc/06/50/41/568065041.db2.gz FDZNZVQIIWPCCV-UHFFFAOYSA-N 0 0 360.410 3.561 20 5 FHBDRN COc1ccc(CN2CCC[C@H]2c2ccc3c(c2)OCCO3)cc1[N+](=O)[O-] ZINC000051560136 568079883 /nfs/dbraw/zinc/07/98/83/568079883.db2.gz GQXHOLCGHXYDEM-INIZCTEOSA-N 0 0 370.405 3.712 20 5 FHBDRN CCCn1ncc(NC(=O)C(C)(C)c2ccccc2[N+](=O)[O-])c1C1CC1 ZINC000452979670 568082857 /nfs/dbraw/zinc/08/28/57/568082857.db2.gz IKMYAMDXVZNFRQ-UHFFFAOYSA-N 0 0 356.426 3.995 20 5 FHBDRN CN(Cc1ccc(Br)cc1Cl)C(=O)c1ccc([N+](=O)[O-])o1 ZINC000481680959 568084937 /nfs/dbraw/zinc/08/49/37/568084937.db2.gz BXXZBGPFKZADGT-UHFFFAOYSA-N 0 0 373.590 3.876 20 5 FHBDRN O=C(Nc1ccnn1-c1ccc([N+](=O)[O-])cc1)[C@@H]1C[C@@H]1c1ccc(F)cc1 ZINC000068103704 568086298 /nfs/dbraw/zinc/08/62/98/568086298.db2.gz BVFMUSIVFMQCNW-IAGOWNOFSA-N 0 0 366.352 3.662 20 5 FHBDRN CN(Cc1ccc(F)cc1Br)C(=O)c1csc([N+](=O)[O-])c1 ZINC000481722933 568093812 /nfs/dbraw/zinc/09/38/12/568093812.db2.gz BUMUFOQWLIGTKT-UHFFFAOYSA-N 0 0 373.203 3.830 20 5 FHBDRN Cn1nc([N+](=O)[O-])cc1C(=O)Nc1ccc(F)cc1Nc1ccccc1F ZINC000481719672 568094345 /nfs/dbraw/zinc/09/43/45/568094345.db2.gz RHCOAZXTHGQMQF-UHFFFAOYSA-N 0 0 373.319 3.602 20 5 FHBDRN COc1ccc(OC[C@@H](O)Cc2ccc3ccccc3c2)cc1[N+](=O)[O-] ZINC000481727901 568098203 /nfs/dbraw/zinc/09/82/03/568098203.db2.gz RAPRBJVYJXAJOR-KRWDZBQOSA-N 0 0 353.374 3.739 20 5 FHBDRN COCCCCc1cccnc1NC(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000291298003 568099596 /nfs/dbraw/zinc/09/95/96/568099596.db2.gz QGXMLZNDJRKQRP-UHFFFAOYSA-N 0 0 369.377 3.957 20 5 FHBDRN CCCO[C@H]1CCCN(c2nnc(-c3cccc([N+](=O)[O-])c3)n2CC)CC1 ZINC000291314088 568103246 /nfs/dbraw/zinc/10/32/46/568103246.db2.gz PXPDTUZLBHGSIH-KRWDZBQOSA-N 0 0 373.457 3.659 20 5 FHBDRN CC[C@H](C)N(C(=O)c1cc([N+](=O)[O-])cc(C)c1F)c1ccc(C(N)=O)cc1 ZINC000291316362 568109353 /nfs/dbraw/zinc/10/93/53/568109353.db2.gz MAXHSDNLPSTVDH-LBPRGKRZSA-N 0 0 373.384 3.587 20 5 FHBDRN CC[C@@H](C)N(C(=O)c1cc([N+](=O)[O-])cc(C)c1F)c1ccc(C(N)=O)cc1 ZINC000291316360 568109601 /nfs/dbraw/zinc/10/96/01/568109601.db2.gz MAXHSDNLPSTVDH-GFCCVEGCSA-N 0 0 373.384 3.587 20 5 FHBDRN Cn1ccnc1[C@H](N[C@@H]1C[C@H]1Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000568660948 568113046 /nfs/dbraw/zinc/11/30/46/568113046.db2.gz ZALFKGOGCOWKCQ-MISYRCLQSA-N 0 0 362.433 3.639 20 5 FHBDRN O=C(CSc1ncc2ccccn21)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000024794531 568113443 /nfs/dbraw/zinc/11/34/43/568113443.db2.gz IKPXMUFVURZRLH-UHFFFAOYSA-N 0 0 362.798 3.627 20 5 FHBDRN COc1cc(CCNC(=O)CCc2cccc([N+](=O)[O-])c2)ccc1Cl ZINC000568672114 568116947 /nfs/dbraw/zinc/11/69/47/568116947.db2.gz AXDBKSKDMLAXHT-UHFFFAOYSA-N 0 0 362.813 3.548 20 5 FHBDRN CCc1noc(CC)c1CNC(=O)c1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000291337027 568116982 /nfs/dbraw/zinc/11/69/82/568116982.db2.gz MBYZXYSBLOOROE-UHFFFAOYSA-N 0 0 372.208 3.944 20 5 FHBDRN CC[C@H](Oc1ccccc1F)C(=O)N1c2ccc([N+](=O)[O-])cc2C[C@H]1C ZINC000481773978 568122907 /nfs/dbraw/zinc/12/29/07/568122907.db2.gz CMYQYDKFOMNXFE-PXAZEXFGSA-N 0 0 358.369 3.869 20 5 FHBDRN O=C(N[C@H]1CCOC2(CCC2)C1)c1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000291365863 568126693 /nfs/dbraw/zinc/12/66/93/568126693.db2.gz PYBULDKYUKRIIW-JTQLQIEISA-N 0 0 359.209 3.733 20 5 FHBDRN CSC1CCN(C(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)CC1 ZINC000601694649 568135224 /nfs/dbraw/zinc/13/52/24/568135224.db2.gz YHTYEILMBREIOW-UHFFFAOYSA-N 0 0 373.272 3.633 20 5 FHBDRN Cc1c2ccccc2oc1[C@@H](C)NC(=O)CNc1ccccc1[N+](=O)[O-] ZINC000481821554 568136855 /nfs/dbraw/zinc/13/68/55/568136855.db2.gz RXPUFDHBXVRFRA-CYBMUJFWSA-N 0 0 353.378 3.939 20 5 FHBDRN CC(C)Oc1ccccc1[C@H](C)NC(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000057004746 568137533 /nfs/dbraw/zinc/13/75/33/568137533.db2.gz FCZBGTJTZBBRNN-AWEZNQCLSA-N 0 0 357.410 3.942 20 5 FHBDRN O=C(c1cc(Cl)cc(Cl)c1[N+](=O)[O-])N1CCC[C@@H](c2ncc[nH]2)C1 ZINC000291471865 568140398 /nfs/dbraw/zinc/14/03/98/568140398.db2.gz JHNCIRMPYNESMK-SECBINFHSA-N 0 0 369.208 3.645 20 5 FHBDRN O=C(N[C@H]1c2ccccc2CC12CCOCC2)c1cc(F)ccc1[N+](=O)[O-] ZINC000291454724 568144570 /nfs/dbraw/zinc/14/45/70/568144570.db2.gz OIPNLGQIVGRGLB-SFHVURJKSA-N 0 0 370.380 3.558 20 5 FHBDRN CC[C@H]1CCC[C@H](NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C1 ZINC000128691119 568145545 /nfs/dbraw/zinc/14/55/45/568145545.db2.gz SYAHCTQEJLDRIB-RDJZCZTQSA-N 0 0 359.470 3.896 20 5 FHBDRN O=C(NCc1ccc(C2CC2)cc1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000481896025 568168371 /nfs/dbraw/zinc/16/83/71/568168371.db2.gz QKBOLCRRDDXBJN-UHFFFAOYSA-N 0 0 362.389 3.588 20 5 FHBDRN CCOc1ccc(C(C)=O)cc1COc1ccc([N+](=O)[O-])c(C(=O)OC)c1 ZINC000481962276 568196996 /nfs/dbraw/zinc/19/69/96/568196996.db2.gz OTDKBBQTKFNKGX-UHFFFAOYSA-N 0 0 373.361 3.562 20 5 FHBDRN COC(=O)c1cc(OCC(=O)c2ccc(CC(C)C)cc2)ccc1[N+](=O)[O-] ZINC000481965353 568200143 /nfs/dbraw/zinc/20/01/43/568200143.db2.gz XCFZZYFTGSNUIC-UHFFFAOYSA-N 0 0 371.389 3.842 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N(Cc1cccs1)C1CC1 ZINC000481972383 568202705 /nfs/dbraw/zinc/20/27/05/568202705.db2.gz WFSJBDUXSRLTFV-UHFFFAOYSA-N 0 0 366.464 3.626 20 5 FHBDRN COc1ccc(NS(=O)(=O)c2c(C)cc([N+](=O)[O-])cc2C)cc1Cl ZINC000481972702 568202904 /nfs/dbraw/zinc/20/29/04/568202904.db2.gz NOPBYZGOBRMRHH-UHFFFAOYSA-N 0 0 370.814 3.674 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1N[C@H]1CCN(C(=O)CCc2ccccc2)C1 ZINC000128725878 568218579 /nfs/dbraw/zinc/21/85/79/568218579.db2.gz UWYYZCHVPYZGAN-KRWDZBQOSA-N 0 0 353.422 3.549 20 5 FHBDRN Cc1cc(=NC(=O)NCc2cccc([N+](=O)[O-])c2C)[nH]n1C1CCCCC1 ZINC000568807801 568229283 /nfs/dbraw/zinc/22/92/83/568229283.db2.gz SGPPKZRJUYKDQX-UHFFFAOYSA-N 0 0 371.441 3.657 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)COc1ccccc1C(C)(C)C ZINC000043839271 568230726 /nfs/dbraw/zinc/23/07/26/568230726.db2.gz VFPXMPNANJRYQO-UHFFFAOYSA-N 0 0 356.422 3.930 20 5 FHBDRN Cc1cc(Cl)ccc1O[C@H](C)C(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000043841124 568230812 /nfs/dbraw/zinc/23/08/12/568230812.db2.gz VMQAEFUJXOGATN-CYBMUJFWSA-N 0 0 362.813 3.983 20 5 FHBDRN CCC(=O)c1ccc([O-])c(NC(=O)CSc2ccc([N+](=O)[O-])cc2)c1 ZINC000436652489 568231861 /nfs/dbraw/zinc/23/18/61/568231861.db2.gz NUSYQTHVZSGQAD-UHFFFAOYSA-N 0 0 360.391 3.624 20 5 FHBDRN O=C(N[C@H]1CCO[C@@H](C2CC2)C1)c1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000291631040 568232502 /nfs/dbraw/zinc/23/25/02/568232502.db2.gz FOSULOLKQUKVRX-GXFFZTMASA-N 0 0 359.209 3.589 20 5 FHBDRN C[C@@H]1C[C@H](c2ccccc2)N(C(=O)NCCc2cccc([N+](=O)[O-])c2)C1 ZINC000568851525 568236385 /nfs/dbraw/zinc/23/63/85/568236385.db2.gz VMFPGCQGTFKBSQ-DNVCBOLYSA-N 0 0 353.422 3.930 20 5 FHBDRN CC(C)OCc1cccc(NCCC(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000568859759 568237336 /nfs/dbraw/zinc/23/73/36/568237336.db2.gz UCWVRUQVGNJRMR-UHFFFAOYSA-N 0 0 357.410 3.961 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])N[C@@]1(C(F)(F)F)CCc2ccccc21 ZINC000568906207 568251787 /nfs/dbraw/zinc/25/17/87/568251787.db2.gz HDOAYOMCJOPZNO-KRWDZBQOSA-N 0 0 364.323 3.658 20 5 FHBDRN COc1ccc([C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])c(C)c2)c(OC)c1 ZINC000015829320 568252591 /nfs/dbraw/zinc/25/25/91/568252591.db2.gz MEUZEJLEFRRLKF-SFHVURJKSA-N 0 0 370.405 3.898 20 5 FHBDRN CN(C(=O)CCOc1cccc(Cl)c1Cl)c1ccc([N+](=O)[O-])nc1 ZINC000568929067 568253430 /nfs/dbraw/zinc/25/34/30/568253430.db2.gz OWCWFJQYNMFPSZ-UHFFFAOYSA-N 0 0 370.192 3.729 20 5 FHBDRN CC[C@@H](Oc1ccccc1Cl)C(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000482070377 568253761 /nfs/dbraw/zinc/25/37/61/568253761.db2.gz PTTHWFCCPVPYNY-MRXNPFEDSA-N 0 0 362.813 3.765 20 5 FHBDRN CCc1ccc([C@H]2COCCN2C(=O)c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000120388948 568254422 /nfs/dbraw/zinc/25/44/22/568254422.db2.gz FUTMLKLYAXTCOS-OAHLLOKOSA-N 0 0 364.785 3.617 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1Cc1ccccc1)N1CCCCC1 ZINC000016458773 568256489 /nfs/dbraw/zinc/25/64/89/568256489.db2.gz LTLKLIITIAPIIU-UHFFFAOYSA-N 0 0 354.406 3.577 20 5 FHBDRN COc1ccc2c(c1)C[C@H](C)N(C(=O)Cc1ccccc1[N+](=O)[O-])[C@H]2C ZINC000541934609 568258310 /nfs/dbraw/zinc/25/83/10/568258310.db2.gz RCGGSGOLASMRBF-KBPBESRZSA-N 0 0 354.406 3.680 20 5 FHBDRN C[C@H](c1ccc(F)cc1)N(C)C(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000049618200 568259156 /nfs/dbraw/zinc/25/91/56/568259156.db2.gz DOHXQTNGVICVFT-CYBMUJFWSA-N 0 0 368.368 3.753 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)N2CC[C@]3(CC[C@@H](C)C3)C2)cc1SC ZINC000541937146 568259407 /nfs/dbraw/zinc/25/94/07/568259407.db2.gz JWYNBDFPAJYTBE-XIKOKIGWSA-N 0 0 364.467 3.978 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)N2CC[C@]3(CC[C@H](C)C3)C2)cc1SC ZINC000541937145 568260055 /nfs/dbraw/zinc/26/00/55/568260055.db2.gz JWYNBDFPAJYTBE-SGTLLEGYSA-N 0 0 364.467 3.978 20 5 FHBDRN C[C@](NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)(C1CC1)C(F)(F)F ZINC000541945630 568273588 /nfs/dbraw/zinc/27/35/88/568273588.db2.gz KXDSWVMHEBXBHD-ZDUSSCGKSA-N 0 0 368.258 3.657 20 5 FHBDRN Cn1nc(C2CC2)nc1COc1ccc(Cc2ccccc2)cc1[N+](=O)[O-] ZINC000569119006 568275116 /nfs/dbraw/zinc/27/51/16/568275116.db2.gz KDOVPZHEHYMGAH-UHFFFAOYSA-N 0 0 364.405 3.771 20 5 FHBDRN COc1c(C(=O)NCC(F)(F)c2ccc(Cl)cc2)cccc1[N+](=O)[O-] ZINC000569029364 568275737 /nfs/dbraw/zinc/27/57/37/568275737.db2.gz JIFXHRCHPKCPTM-UHFFFAOYSA-N 0 0 370.739 3.779 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N1CCO[C@@](C)(c2ccccc2)C1 ZINC000569041317 568278366 /nfs/dbraw/zinc/27/83/66/568278366.db2.gz RLHZUVGWELRKJT-HXUWFJFHSA-N 0 0 369.421 3.937 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)cc(Cl)c1N1CCN(c2ncccc2F)CC1 ZINC000569113247 568278442 /nfs/dbraw/zinc/27/84/42/568278442.db2.gz CONXWEYKOVXWCT-UHFFFAOYSA-N 0 0 371.199 3.762 20 5 FHBDRN CO[C@H](C)C(=O)Nc1cccc(N[C@@H]2CCc3c2cccc3[N+](=O)[O-])c1 ZINC000569138030 568285115 /nfs/dbraw/zinc/28/51/15/568285115.db2.gz KAAHCUOBENLCTP-SJKOYZFVSA-N 0 0 355.394 3.668 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@H](C)Oc1cccc(OC)c1 ZINC000584690289 568286413 /nfs/dbraw/zinc/28/64/13/568286413.db2.gz DRAIWEKEIVARIV-CYBMUJFWSA-N 0 0 373.409 3.755 20 5 FHBDRN Cc1c(CC(=O)N(C)Cc2ccc(OC(F)F)cc2)cccc1[N+](=O)[O-] ZINC000159427966 568292098 /nfs/dbraw/zinc/29/20/98/568292098.db2.gz UJEFMDQNEJZMFW-UHFFFAOYSA-N 0 0 364.348 3.706 20 5 FHBDRN CCc1nn(C)c(Nc2cnn(-c3ccc(Cl)cc3)c2C)c1[N+](=O)[O-] ZINC000569146386 568293446 /nfs/dbraw/zinc/29/34/46/568293446.db2.gz HYVUYUYLJREVHE-UHFFFAOYSA-N 0 0 360.805 3.782 20 5 FHBDRN CCC(=O)Nc1ccc(C)c(NC(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000569063496 568296020 /nfs/dbraw/zinc/29/60/20/568296020.db2.gz RKYADGWXQFKVTC-ZDUSSCGKSA-N 0 0 355.394 3.994 20 5 FHBDRN CCCc1nc(C)c(CNCc2cc([N+](=O)[O-])ccc2OC(F)F)o1 ZINC000291746844 568296071 /nfs/dbraw/zinc/29/60/71/568296071.db2.gz PRLAHFBCPQFYSB-UHFFFAOYSA-N 0 0 355.341 3.735 20 5 FHBDRN Cc1nc(C2(NCCCOc3ccc([N+](=O)[O-])cc3)CCCCC2)no1 ZINC000604467042 568297219 /nfs/dbraw/zinc/29/72/19/568297219.db2.gz FDEBMEWXWKNGAV-UHFFFAOYSA-N 0 0 360.414 3.504 20 5 FHBDRN O=C(N[C@@H](c1ccccc1)C(F)F)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000482160307 568297449 /nfs/dbraw/zinc/29/74/49/568297449.db2.gz SSYJEDXJROAVGU-INIZCTEOSA-N 0 0 372.331 3.517 20 5 FHBDRN COc1cc(Cc2noc(C(C)(C)c3c(C)noc3C)n2)ccc1[N+](=O)[O-] ZINC000569170733 568299436 /nfs/dbraw/zinc/29/94/36/568299436.db2.gz WXZILOXAVFATJT-UHFFFAOYSA-N 0 0 372.381 3.508 20 5 FHBDRN C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000482172070 568300436 /nfs/dbraw/zinc/30/04/36/568300436.db2.gz BTIMGJOGGYSATI-MFKMUULPSA-N 0 0 362.373 3.876 20 5 FHBDRN COc1ccc(C(=O)N(C)[C@H]2CCCC[C@H]2C(F)(F)F)cc1[N+](=O)[O-] ZINC000291769816 568304484 /nfs/dbraw/zinc/30/44/84/568304484.db2.gz SPJKEMAANDWQFU-NEPJUHHUSA-N 0 0 360.332 3.797 20 5 FHBDRN Cc1sc(NC(=O)c2cc([N+](=O)[O-])cnc2C)nc1-c1ccccc1 ZINC000604561578 568311590 /nfs/dbraw/zinc/31/15/90/568311590.db2.gz IOMZFNRSDMHWAW-UHFFFAOYSA-N 0 0 354.391 3.982 20 5 FHBDRN CC[C@H](C)COc1cc([N+](=O)[O-])c(C[NH2+]C(C)(C)C(C)(C)O)cc1OC ZINC000541989112 568313477 /nfs/dbraw/zinc/31/34/77/568313477.db2.gz RVBVCVXIGGJBRK-ZDUSSCGKSA-N 0 0 368.474 3.667 20 5 FHBDRN CCOc1cc(C(=O)Nc2ncsc2C(C)C)c([N+](=O)[O-])cc1OC ZINC000569230997 568315941 /nfs/dbraw/zinc/31/59/41/568315941.db2.gz WRVVTTGJDQOHCX-UHFFFAOYSA-N 0 0 365.411 3.834 20 5 FHBDRN O=C(Nc1cc(F)c(Br)c(F)c1)c1csc([N+](=O)[O-])c1 ZINC000181975145 568318874 /nfs/dbraw/zinc/31/88/74/568318874.db2.gz UACMQDSEGUANFH-UHFFFAOYSA-N 0 0 363.139 3.949 20 5 FHBDRN CO[C@@H]1CCN(C(=O)c2ccc(Sc3ccc(C)cc3)c([N+](=O)[O-])c2)C1 ZINC000482220124 568321087 /nfs/dbraw/zinc/32/10/87/568321087.db2.gz MGOAXQJFGDHCOU-OAHLLOKOSA-N 0 0 372.446 3.915 20 5 FHBDRN Cc1c(CNC(=O)NC[C@H]2CC[C@H](c3ccccc3)O2)cccc1[N+](=O)[O-] ZINC000569266313 568323013 /nfs/dbraw/zinc/32/30/13/568323013.db2.gz SZMMQARNTIRHKW-IEBWSBKVSA-N 0 0 369.421 3.623 20 5 FHBDRN COC(=O)c1ccc(-c2noc(-c3ccc(SC)c([N+](=O)[O-])c3)n2)cc1 ZINC000609476416 568323507 /nfs/dbraw/zinc/32/35/07/568323507.db2.gz XCKKXLDJNSVZBU-UHFFFAOYSA-N 0 0 371.374 3.820 20 5 FHBDRN O=C(NCCCCc1ccccc1)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000031225991 568327021 /nfs/dbraw/zinc/32/70/21/568327021.db2.gz ZCDJGAVXTDSESX-UHFFFAOYSA-N 0 0 364.405 3.533 20 5 FHBDRN COc1cc(C(=O)NC[C@@H]2CCCC[C@H]2C(F)(F)F)ccc1[N+](=O)[O-] ZINC000482224105 568360004 /nfs/dbraw/zinc/36/00/04/568360004.db2.gz IMVSVQCFSBUQMZ-NWDGAFQWSA-N 0 0 360.332 3.702 20 5 FHBDRN Cc1cc(N2CC[C@@H]([C@H]3CCOC3)C2)c(Br)cc1[N+](=O)[O-] ZINC000408297859 568367663 /nfs/dbraw/zinc/36/76/63/568367663.db2.gz MBJARZBHYZCYAD-NEPJUHHUSA-N 0 0 355.232 3.529 20 5 FHBDRN CCCc1c(C(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)[nH]c(C)c1C(C)=O ZINC000542003190 568377591 /nfs/dbraw/zinc/37/75/91/568377591.db2.gz RFRFUUORXQOJDI-UHFFFAOYSA-N 0 0 359.382 3.647 20 5 FHBDRN CC(C)(CNC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)C(F)(F)F ZINC000569329864 568389628 /nfs/dbraw/zinc/38/96/28/568389628.db2.gz OZPWGGMGIQTLIE-UHFFFAOYSA-N 0 0 373.375 3.516 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)Nc1cccc(Cn2cccn2)c1 ZINC000032466922 568391127 /nfs/dbraw/zinc/39/11/27/568391127.db2.gz VKDLLFNDKLYRLN-UHFFFAOYSA-N 0 0 368.418 3.570 20 5 FHBDRN COc1ccc(NC(=O)CCSc2ccccc2F)cc1[N+](=O)[O-] ZINC000542001152 568395110 /nfs/dbraw/zinc/39/51/10/568395110.db2.gz HUMLMJKKXSZYOQ-UHFFFAOYSA-N 0 0 350.371 3.863 20 5 FHBDRN O=C(c1ccccc1N1CCCCC1)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000569362211 568396144 /nfs/dbraw/zinc/39/61/44/568396144.db2.gz KTBGLKJBOKIOEZ-UHFFFAOYSA-N 0 0 365.433 3.784 20 5 FHBDRN COc1cc(Cc2noc([C@H]3C[C@@]3(C)C(C)C)n2)c([N+](=O)[O-])c(OC)c1 ZINC000569373710 568396779 /nfs/dbraw/zinc/39/67/79/568396779.db2.gz UDCTWAMCLDUBPQ-ACJLOTCBSA-N 0 0 361.398 3.735 20 5 FHBDRN COc1cccc([N+](=O)[O-])c1NCc1ccc(C)cc1O[C@H]1CCOC1 ZINC000569398374 568400748 /nfs/dbraw/zinc/40/07/48/568400748.db2.gz ZESFNICKPVBFRP-HNNXBMFYSA-N 0 0 358.394 3.692 20 5 FHBDRN Cc1noc(C)c1CO[C@@H]1CCN(c2nccc3cc([N+](=O)[O-])ccc32)C1 ZINC000569425692 568402034 /nfs/dbraw/zinc/40/20/34/568402034.db2.gz GBSDFOJMDIKZCE-MRXNPFEDSA-N 0 0 368.393 3.543 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)Nc1cnn(C)c1-c1ccccc1 ZINC000569486872 568403310 /nfs/dbraw/zinc/40/33/10/568403310.db2.gz NGQITONILHQANT-UHFFFAOYSA-N 0 0 351.366 3.948 20 5 FHBDRN COC(=O)c1cc(NCc2ccc3ccccc3n2)cc(C)c1[N+](=O)[O-] ZINC000569516378 568404659 /nfs/dbraw/zinc/40/46/59/568404659.db2.gz DBGNIQDRKDDHNM-UHFFFAOYSA-N 0 0 351.362 3.850 20 5 FHBDRN C[C@H](Nc1ccc(C(=O)N2CCC[C@H](F)C2)cc1[N+](=O)[O-])c1ccccn1 ZINC000569586386 568408640 /nfs/dbraw/zinc/40/86/40/568408640.db2.gz NMYILHOYLKKONJ-ZFWWWQNUSA-N 0 0 372.400 3.737 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H](C)c1nnc([C@H](C)CC)[nH]1 ZINC000569652537 568415016 /nfs/dbraw/zinc/41/50/16/568415016.db2.gz AJFINNQYWBKVBL-GHMZBOCLSA-N 0 0 360.418 3.672 20 5 FHBDRN O=C(NCCc1ccc(F)c(F)c1)c1c([N+](=O)[O-])cccc1C(F)(F)F ZINC000569659286 568416411 /nfs/dbraw/zinc/41/64/11/568416411.db2.gz NCIXVOHUTMYRPM-UHFFFAOYSA-N 0 0 374.265 3.864 20 5 FHBDRN O=C(NCC1(c2ccccc2)CCCCC1)c1cc([O-])ccc1[N+](=O)[O-] ZINC000569679823 568418327 /nfs/dbraw/zinc/41/83/27/568418327.db2.gz SNAOIWQFZGUTCR-UHFFFAOYSA-N 0 0 354.406 3.932 20 5 FHBDRN CCN(Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)Cc1ccc(OC)c(OC)c1 ZINC000569754814 568421246 /nfs/dbraw/zinc/42/12/46/568421246.db2.gz PMUWZRMYYATFIZ-UHFFFAOYSA-N 0 0 370.409 3.510 20 5 FHBDRN Cc1sc(NC(=O)CN(C)CCc2cccc([N+](=O)[O-])c2)c(C)c1C ZINC000569791581 568425077 /nfs/dbraw/zinc/42/50/77/568425077.db2.gz VGZLGTDXQMTZHN-UHFFFAOYSA-N 0 0 361.467 3.695 20 5 FHBDRN CCOc1ccc(CCNc2c([N+](=O)[O-])nc(C)n2CC)cc1OCC ZINC000569844253 568427128 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568475378 /nfs/dbraw/zinc/47/53/78/568475378.db2.gz JBEZQKAHGOYVEB-UHFFFAOYSA-N 0 0 367.203 3.765 20 5 FHBDRN Cc1cc(F)ccc1Cc1noc(CCNc2ccccc2[N+](=O)[O-])n1 ZINC000570473676 568483075 /nfs/dbraw/zinc/48/30/75/568483075.db2.gz QDTLDEVNQPWQOP-UHFFFAOYSA-N 0 0 356.357 3.671 20 5 FHBDRN C[C@@H](CNC(=O)c1ccc(Br)cc1[N+](=O)[O-])CC(F)(F)F ZINC000412681089 568484732 /nfs/dbraw/zinc/48/47/32/568484732.db2.gz RBHOGVLGAFOMJC-SSDOTTSWSA-N 0 0 369.137 3.676 20 5 FHBDRN Cn1cc(C(F)(F)F)nc1[C@@H]1CCCN(c2c(F)cccc2[N+](=O)[O-])C1 ZINC000570538072 568485484 /nfs/dbraw/zinc/48/54/84/568485484.db2.gz TUJLJJNOPITPIX-SNVBAGLBSA-N 0 0 372.322 3.870 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H](COC(F)F)C1 ZINC000570538955 568485551 /nfs/dbraw/zinc/48/55/51/568485551.db2.gz VAQXZGZBTWNQTQ-NSHDSACASA-N 0 0 374.409 3.798 20 5 FHBDRN CCS[C@H]1CCC[C@H](NC(=O)CCNc2ccccc2[N+](=O)[O-])C1 ZINC000482233750 568487249 /nfs/dbraw/zinc/48/72/49/568487249.db2.gz ZAJCGGZYXPZQPP-KBPBESRZSA-N 0 0 351.472 3.577 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H]2SCCc3ccccc32)c1 ZINC000570699637 568500194 /nfs/dbraw/zinc/50/01/94/568500194.db2.gz MEMZWQXHYIHHQE-SFHVURJKSA-N 0 0 372.446 3.754 20 5 FHBDRN Cc1ccc(SCCNc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])cc1 ZINC000007365217 568502944 /nfs/dbraw/zinc/50/29/44/568502944.db2.gz WVJBINVCJCCALJ-UHFFFAOYSA-N 0 0 366.464 3.511 20 5 FHBDRN COc1ccc(OCc2ccc(OC(F)F)c(OC)c2)c([N+](=O)[O-])c1 ZINC000007393625 568509019 /nfs/dbraw/zinc/50/90/19/568509019.db2.gz KHZQOSGIZZCLIU-UHFFFAOYSA-N 0 0 355.293 3.792 20 5 FHBDRN COC(=O)c1ccc(NC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)cc1 ZINC000007401469 568510500 /nfs/dbraw/zinc/51/05/00/568510500.db2.gz WYDDHEMKZLVHGP-NSHDSACASA-N 0 0 360.391 3.501 20 5 FHBDRN COCCOCc1ccc(C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000291820895 568517365 /nfs/dbraw/zinc/51/73/65/568517365.db2.gz AKHSTIYHPKCGMO-OAHLLOKOSA-N 0 0 372.421 3.557 20 5 FHBDRN Cc1ccc(OCc2cc3c(cc2Br)OCO3)c([N+](=O)[O-])c1 ZINC000007465026 568519502 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C[C@H](Nc1nc2ccc([N+](=O)[O-])cc2s1)c1ccc(-c2nn[nH]n2)cc1 ZINC000736136605 598536103 /nfs/dbraw/zinc/53/61/03/598536103.db2.gz HYNADDUHDWHTOQ-VIFPVBQESA-N 0 0 367.394 3.558 20 5 FHBDRN C[C@@H](c1cccc(Cl)c1)N(C)c1ccc([N+](=O)[O-])cc1-c1nn[nH]n1 ZINC000736202315 598814776 /nfs/dbraw/zinc/81/47/76/598814776.db2.gz ZYZQDZSNBSPQLC-JTQLQIEISA-N 0 0 358.789 3.626 20 5 FHBDRN O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1N[C@@H]1CCSc2ccc(F)cc21 ZINC000823629670 599321269 /nfs/dbraw/zinc/32/12/69/599321269.db2.gz DTROJYRELYJAQU-GFCCVEGCSA-N 0 0 372.385 3.563 20 5 FHBDRN O=[N+]([O-])c1ccc(Nc2ccc(CC(F)(F)F)cc2)c(-c2nn[nH]n2)c1 ZINC000823643861 599580547 /nfs/dbraw/zinc/58/05/47/599580547.db2.gz CWSWJEYHQWJUHX-UHFFFAOYSA-N 0 0 364.287 3.623 20 5 FHBDRN O=C([O-])[C@@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)c1ccccc1C(F)(F)F ZINC000739500059 599792031 /nfs/dbraw/zinc/79/20/31/599792031.db2.gz NOORMQISKQPRRW-AWEZNQCLSA-N 0 0 354.284 3.529 20 5 FHBDRN C[C@@H](C[N@H+](Cc1ccccc1)Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)[O-] ZINC000736584095 600402066 /nfs/dbraw/zinc/40/20/66/600402066.db2.gz PBDYVEUAYBDPOU-ZDUSSCGKSA-N 0 0 362.813 3.971 20 5 FHBDRN CC(C)(CC(=O)[O-])[NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000593948268 600800092 /nfs/dbraw/zinc/80/00/92/600800092.db2.gz VYMNTILFSHZBLB-UHFFFAOYSA-N 0 0 362.357 3.869 20 5 FHBDRN O=[N+]([O-])c1ccccc1-c1nc(-c2cccc(-c3nn[nH]n3)c2)cs1 ZINC000826500156 607647226 /nfs/dbraw/zinc/64/72/26/607647226.db2.gz NEGDBQHTABWJBY-UHFFFAOYSA-N 0 0 350.363 3.565 20 5 FHBDRN C[C@@H](Oc1ccc(C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1)C(=O)[O-] ZINC000833537060 604534930 /nfs/dbraw/zinc/53/49/30/604534930.db2.gz HAIWRJMDZDNMFB-CQSZACIVSA-N 0 0 370.405 3.611 20 5 FHBDRN O=[N+]([O-])c1ccc2oc(C(Cl)=Cc3cc(-c4nn[nH]n4)cs3)nc2c1 ZINC000823643879 606339949 /nfs/dbraw/zinc/33/99/49/606339949.db2.gz DQSISXJJHWPYRJ-YHYXMXQVSA-N 0 0 374.769 3.715 20 5 FHBDRN O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1NC[C@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000823629908 606596242 /nfs/dbraw/zinc/59/62/42/606596242.db2.gz LOVBGPLVEBZNLL-GXSJLCMTSA-N 0 0 370.335 3.556 20 5 FHBDRN CC(C)Cc1ccc([C@H](C)Nc2nccc(-c3nn[nH]n3)c2[N+](=O)[O-])cc1 ZINC000820107835 607161726 /nfs/dbraw/zinc/16/17/26/607161726.db2.gz CRQZPCWNXVZMGP-LBPRGKRZSA-N 0 0 367.413 3.542 20 5 FHBDRN COc1ccc(CSCc2cccc([N+](=O)[O-])c2C)cc1-c1nn[nH]n1 ZINC000826207924 607984464 /nfs/dbraw/zinc/98/44/64/607984464.db2.gz KVYHGYIGPVSAGY-UHFFFAOYSA-N 0 0 371.422 3.525 20 5 FHBDRN CCC(CC)(CC)C(=O)Nc1cc(-c2nn[nH]n2)cc([N+](=O)[O-])c1Cl ZINC000825089851 608162724 /nfs/dbraw/zinc/16/27/24/608162724.db2.gz MVHHYKFKECKXNQ-UHFFFAOYSA-N 0 0 366.809 3.583 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)cnc1N1CCO[C@@H](c2ccc(Cl)cc2)C1 ZINC000153606741 936313604 /nfs/dbraw/zinc/31/36/04/936313604.db2.gz KRDOAQHTKSGUON-CQSZACIVSA-N 0 0 354.193 3.875 20 5 FHBDRN CCc1ccc([C@H]2CCN(c3nc(C)cc(C(=O)OC)c3[N+](=O)[O-])C2)cc1 ZINC000431509773 936325629 /nfs/dbraw/zinc/32/56/29/936325629.db2.gz DPLQGHDVEDEWAR-INIZCTEOSA-N 0 0 369.421 3.641 20 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/nfs/dbraw/zinc/36/75/17/936367517.db2.gz JBBHPHRIBJDVTN-UHFFFAOYSA-N 0 0 352.434 3.886 20 5 FHBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1CC[C@@H]1c1ccc(Cl)cc1 ZINC000511224669 936368437 /nfs/dbraw/zinc/36/84/37/936368437.db2.gz QFSSEFYACWWDRX-OAHLLOKOSA-N 0 0 366.826 3.692 20 5 FHBDRN CN(C(=O)C1CC1)c1ccccc1-c1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000573136580 936368735 /nfs/dbraw/zinc/36/87/35/936368735.db2.gz FSOVRMPFCOBRBM-UHFFFAOYSA-N 0 0 364.361 3.685 20 5 FHBDRN COC(=O)c1ccc(OCc2nc(-c3cccs3)oc2C)cc1[N+](=O)[O-] ZINC000613110204 936374162 /nfs/dbraw/zinc/37/41/62/936374162.db2.gz ILPKWQKXHMLDQG-UHFFFAOYSA-N 0 0 374.374 3.985 20 5 FHBDRN COC(=O)c1cc(NC(=O)c2c(Cl)cccc2Cl)cc([N+](=O)[O-])c1 ZINC000176353277 936371596 /nfs/dbraw/zinc/37/15/96/936371596.db2.gz XWCMNPBIDBYDAN-UHFFFAOYSA-N 0 0 369.160 3.941 20 5 FHBDRN Cc1cc(C)c(NS(=O)(=O)c2ccc([N+](=O)[O-])c(C)c2)c(Cl)c1 ZINC000613112156 936377390 /nfs/dbraw/zinc/37/73/90/936377390.db2.gz UEEQPOVGSUKBFB-UHFFFAOYSA-N 0 0 354.815 3.974 20 5 FHBDRN COc1ccc(C(=O)Nc2cc(C)nc3ccc([N+](=O)[O-])cc32)c(Cl)c1 ZINC000613198154 936385707 /nfs/dbraw/zinc/38/57/07/936385707.db2.gz VKMSXZOLFKCWLG-UHFFFAOYSA-N 0 0 371.780 3.788 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(O[C@@H]2CCCC[C@H]2O)cc1 ZINC000278042122 936389243 /nfs/dbraw/zinc/38/92/43/936389243.db2.gz SFZMVHLCEPSTKV-QZTJIDSGSA-N 0 0 370.405 3.838 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc([C@@H](C)N2CCOCC2)cc1 ZINC000110720996 945065830 /nfs/dbraw/zinc/06/58/30/945065830.db2.gz SYRXAHNSVGNYLD-OAHLLOKOSA-N 0 0 369.421 3.549 20 5 FHBDRN CCCC[C@H]1CCC[C@H]1NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000110722928 945068604 /nfs/dbraw/zinc/06/86/04/945068604.db2.gz MYURSQNZYDZUTA-KBXCAEBGSA-N 0 0 356.426 3.869 20 5 FHBDRN C[C@@H](NC(=O)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1)c1cccc(O)c1 ZINC000458373608 937085462 /nfs/dbraw/zinc/08/54/62/937085462.db2.gz CAFHQYMIOXEPEV-RHSMWYFYSA-N 0 0 369.421 3.951 20 5 FHBDRN O=C(N[C@H]1CCO[C@H](C2CC2)C1)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000278055088 937087849 /nfs/dbraw/zinc/08/78/49/937087849.db2.gz MLIXKELJIYUCAR-LIRRHRJNSA-N 0 0 362.429 3.781 20 5 FHBDRN CCOc1ccc(OCCCC(=O)N2CCc3cc([N+](=O)[O-])ccc32)cc1 ZINC000514849029 937096198 /nfs/dbraw/zinc/09/61/98/937096198.db2.gz LXGTYLJCPKDFDX-UHFFFAOYSA-N 0 0 370.405 3.742 20 5 FHBDRN CC(C)[C@@H](CNC(=O)CSc1ccc([N+](=O)[O-])cn1)c1ccccc1 ZINC000178764111 937096817 /nfs/dbraw/zinc/09/68/17/937096817.db2.gz CZAAPXAZTHHSES-MRXNPFEDSA-N 0 0 359.451 3.638 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)Nc2cccc(NC(C)=O)c2C)c1 ZINC000247951423 937114603 /nfs/dbraw/zinc/11/46/03/937114603.db2.gz QSAJDDVOMKTUDY-UHFFFAOYSA-N 0 0 359.407 3.836 20 5 FHBDRN COC(=O)c1cccc(NC2CCN(c3c(F)cccc3[N+](=O)[O-])CC2)c1 ZINC000583100822 937118139 /nfs/dbraw/zinc/11/81/39/937118139.db2.gz YKRSQROGRIRSON-UHFFFAOYSA-N 0 0 373.384 3.601 20 5 FHBDRN COc1ccc([C@H]2CCCN2CC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 ZINC000025414805 937118273 /nfs/dbraw/zinc/11/82/73/937118273.db2.gz VOAVPZIJWASFRQ-LJQANCHMSA-N 0 0 369.421 3.687 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H]1CCO[C@@H](c2ccccc2)C1 ZINC000162476410 937127749 /nfs/dbraw/zinc/12/77/49/937127749.db2.gz BDPKKJMELMTUFH-CRAIPNDOSA-N 0 0 355.394 3.945 20 5 FHBDRN Cc1nn(C)c(NCc2ccc(COc3ccccc3)cc2)c1[N+](=O)[O-] ZINC000052106089 937129387 /nfs/dbraw/zinc/12/93/87/937129387.db2.gz ZHGANLSCELYEHU-UHFFFAOYSA-N 0 0 352.394 3.828 20 5 FHBDRN O=C(c1cc(Cl)ccc1[N+](=O)[O-])N(CCc1ccccc1)[C@H]1CCOC1 ZINC000175259926 927053103 /nfs/dbraw/zinc/05/31/03/927053103.db2.gz CSCTXVPHGUADDK-INIZCTEOSA-N 0 0 374.824 3.722 20 5 FHBDRN Cc1nc2ccc(N[C@@H]3CCN(c4cccc([N+](=O)[O-])c4)C3=O)cc2s1 ZINC000261410294 927062349 /nfs/dbraw/zinc/06/23/49/927062349.db2.gz SDAZQMBNLFPVAH-MRXNPFEDSA-N 0 0 368.418 3.730 20 5 FHBDRN COC(=O)[C@H](CNc1ccc([N+](=O)[O-])nc1)Cc1ccc2ccccc2c1 ZINC000583107635 937130093 /nfs/dbraw/zinc/13/00/93/937130093.db2.gz BCACNHQOVYAXMR-KRWDZBQOSA-N 0 0 365.389 3.587 20 5 FHBDRN CC1(C)CN(C(=O)CSc2ccccc2[N+](=O)[O-])CC2(CCCC2)O1 ZINC000468284914 937130920 /nfs/dbraw/zinc/13/09/20/937130920.db2.gz IAXFJMLNHYKZFX-UHFFFAOYSA-N 0 0 364.467 3.637 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])NCc1cc(Cl)ccc1OC(F)F ZINC000175267058 927145397 /nfs/dbraw/zinc/14/53/97/927145397.db2.gz LHNYZIKTJPGVES-UHFFFAOYSA-N 0 0 370.739 3.709 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1Cl)N(CCc1ccccc1)[C@H]1CCOC1 ZINC000175268570 927145420 /nfs/dbraw/zinc/14/54/20/927145420.db2.gz WETBYEVNZPGGRO-INIZCTEOSA-N 0 0 374.824 3.722 20 5 FHBDRN O=C(c1cc(F)cc([N+](=O)[O-])c1Br)N1CCCC2(CC2)C1 ZINC000274566071 927150209 /nfs/dbraw/zinc/15/02/09/927150209.db2.gz DZNHRLFYWRPISP-UHFFFAOYSA-N 0 0 357.179 3.513 20 5 FHBDRN COC(=O)c1cc(C)nc(N2C[C@@H](c3ccc(F)cc3)C[C@H]2C)c1[N+](=O)[O-] ZINC000557602828 927163493 /nfs/dbraw/zinc/16/34/93/927163493.db2.gz LYRLKNOWOVHDAH-OCCSQVGLSA-N 0 0 373.384 3.606 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NC[C@H]1[C@@H]2c3ccccc3C[C@H]12 ZINC000246846832 927166143 /nfs/dbraw/zinc/16/61/43/927166143.db2.gz SADBZYYHFWGDIC-ZHALLVOQSA-N 0 0 350.418 3.836 20 5 FHBDRN COc1cc(C(=O)N[C@H]2CCC[C@@H](C(C)C)C2)cc([N+](=O)[O-])c1OC ZINC000610174582 927193601 /nfs/dbraw/zinc/19/36/01/927193601.db2.gz REWWEMCFCHKTSR-OCCSQVGLSA-N 0 0 350.415 3.557 20 5 FHBDRN COc1cc(C(=O)NC(C)(C)c2cccc(C)c2)cc([N+](=O)[O-])c1OC ZINC000610175894 927213029 /nfs/dbraw/zinc/21/30/29/927213029.db2.gz WHUMMABOEZFHDX-UHFFFAOYSA-N 0 0 358.394 3.586 20 5 FHBDRN COc1cc(C(=O)N2CCC[C@@H](C(C)C)CC2)cc([N+](=O)[O-])c1OC ZINC000610175545 927215343 /nfs/dbraw/zinc/21/53/43/927215343.db2.gz GVKXLRWSZKTNPO-CYBMUJFWSA-N 0 0 350.415 3.510 20 5 FHBDRN O=C(Cc1cccc([N+](=O)[O-])c1)NCc1cc(Cl)ccc1OC(F)F ZINC000175276592 927244607 /nfs/dbraw/zinc/24/46/07/927244607.db2.gz ATMQWMAUSAQMNL-UHFFFAOYSA-N 0 0 370.739 3.709 20 5 FHBDRN Cc1ccc(NC(=O)N(CCO)[C@H]2CCCc3ccccc32)cc1[N+](=O)[O-] ZINC000175279962 927254601 /nfs/dbraw/zinc/25/46/01/927254601.db2.gz HKBNLSVQQWWBMA-SFHVURJKSA-N 0 0 369.421 3.807 20 5 FHBDRN Cc1nc(CC2CC2)sc1C(=O)OCc1ccc([N+](=O)[O-])c(F)c1 ZINC000784903843 927281307 /nfs/dbraw/zinc/28/13/07/927281307.db2.gz HUNXJUXHESKHBJ-UHFFFAOYSA-N 0 0 350.371 3.808 20 5 FHBDRN Cc1nn(Cc2ccc(C(=O)N3CCC[C@H](C)[C@H]3C)cc2)c(C)c1[N+](=O)[O-] ZINC000610178471 927320906 /nfs/dbraw/zinc/32/09/06/927320906.db2.gz CDLJICRECJIYKK-DZGCQCFKSA-N 0 0 370.453 3.717 20 5 FHBDRN O=C(/C=C/c1ccc([N+](=O)[O-])cc1)O[C@H](c1ccccn1)C(F)(F)F ZINC000160218749 927364721 /nfs/dbraw/zinc/36/47/21/927364721.db2.gz JAJAZLVWCOBZQA-RZIFZGNASA-N 0 0 352.268 3.850 20 5 FHBDRN Cc1cc(C(=O)N(CC(=O)Nc2ccc(F)cc2)C(C)C)ccc1[N+](=O)[O-] ZINC000247994077 937156615 /nfs/dbraw/zinc/15/66/15/937156615.db2.gz OKWYIXHBDJGPLF-UHFFFAOYSA-N 0 0 373.384 3.532 20 5 FHBDRN Cc1c(C(=O)Nc2cc(Br)ccc2O)cccc1[N+](=O)[O-] ZINC000176437968 937162967 /nfs/dbraw/zinc/16/29/67/937162967.db2.gz CXCJUDMOTBYPAJ-UHFFFAOYSA-N 0 0 351.156 3.624 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N1C[C@@H](C)[C@@H]1c1ccccc1 ZINC000175290283 927457635 /nfs/dbraw/zinc/45/76/35/927457635.db2.gz HFHGIRKLBFKGOQ-FZKQIMNGSA-N 0 0 355.394 3.506 20 5 FHBDRN CC(C)(C)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)cc1 ZINC000610184215 927504856 /nfs/dbraw/zinc/50/48/56/927504856.db2.gz ZDKPWAOAMMZGFG-UHFFFAOYSA-N 0 0 372.377 3.796 20 5 FHBDRN C[C@H]1c2ccsc2CCN1C(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000049623974 927541886 /nfs/dbraw/zinc/54/18/86/927541886.db2.gz RDYPMHDBUZCYPL-LBPRGKRZSA-N 0 0 368.418 3.602 20 5 FHBDRN COc1ccc(S(=O)(=O)Oc2ccc(C(C)C)c(C)c2)c([N+](=O)[O-])c1 ZINC000023390500 927543204 /nfs/dbraw/zinc/54/32/04/927543204.db2.gz HJEKKUYZJALMRM-UHFFFAOYSA-N 0 0 365.407 3.803 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NCCCc2c[nH]c3ccccc23)c1 ZINC000558829333 927610041 /nfs/dbraw/zinc/61/00/41/927610041.db2.gz GZTMUYPEMBUEGE-UHFFFAOYSA-N 0 0 367.405 3.837 20 5 FHBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N[C@@H]1C[C@H]1Cc1ccccc1 ZINC000610186602 927660499 /nfs/dbraw/zinc/66/04/99/927660499.db2.gz YBEDNYGECSSDJB-JGGQBBKZSA-N 0 0 374.824 3.763 20 5 FHBDRN Cc1c(CN2CCC[C@@H]2c2nnc3n2CCCCC3)cccc1[N+](=O)[O-] ZINC000154198125 937183640 /nfs/dbraw/zinc/18/36/40/937183640.db2.gz AFUSCFYQDSDZBB-QGZVFWFLSA-N 0 0 355.442 3.558 20 5 FHBDRN Cn1cc(C(=O)NCC(C)(C)C2CCCC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000510074004 927684627 /nfs/dbraw/zinc/68/46/27/927684627.db2.gz SYSYLSGWYMPVLG-UHFFFAOYSA-N 0 0 370.453 3.942 20 5 FHBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])N[C@@H]1C[C@@H]1Cc1ccccc1 ZINC000610186479 927693105 /nfs/dbraw/zinc/69/31/05/927693105.db2.gz SCWFPOGDYBRVSW-GOEBONIOSA-N 0 0 374.824 3.765 20 5 FHBDRN C[C@@](NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)(C1CC1)C(F)(F)F ZINC000471136333 927715371 /nfs/dbraw/zinc/71/53/71/927715371.db2.gz JXMNNXYUEDAZIA-OAHLLOKOSA-N 0 0 357.332 3.630 20 5 FHBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N[C@H]1C[C@]1(C)c1ccccc1 ZINC000610190081 927752729 /nfs/dbraw/zinc/75/27/29/927752729.db2.gz CRQGWZUYGDDOFN-OYYNGEPBSA-N 0 0 374.824 3.862 20 5 FHBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N1CCCc2ccc(F)cc21 ZINC000145993519 937191092 /nfs/dbraw/zinc/19/10/92/937191092.db2.gz CUGOZVYRCVNQPX-UHFFFAOYSA-N 0 0 370.789 3.529 20 5 FHBDRN Cc1cccc2c1CC[C@H]2NC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000120220459 927769642 /nfs/dbraw/zinc/76/96/42/927769642.db2.gz YLVGXQGRHLJBEL-GOSISDBHSA-N 0 0 351.406 3.658 20 5 FHBDRN Cc1cccc2c1CC[C@@H]2NC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000120220299 927769737 /nfs/dbraw/zinc/76/97/37/927769737.db2.gz YLVGXQGRHLJBEL-SFHVURJKSA-N 0 0 351.406 3.658 20 5 FHBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1Cc2ccccc2C[C@H]1C ZINC000610189196 927776148 /nfs/dbraw/zinc/77/61/48/927776148.db2.gz WYMVSIHCFHMQSR-OLZOCXBDSA-N 0 0 374.824 3.989 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2C[C@@]2(C)c2ccccc2)cc1SC ZINC000610190996 927792873 /nfs/dbraw/zinc/79/28/73/927792873.db2.gz WHLHBBGAPBWTPM-MJGOQNOKSA-N 0 0 372.446 3.785 20 5 FHBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])NCCCc1cccs1 ZINC000535811862 927816902 /nfs/dbraw/zinc/81/69/02/927816902.db2.gz VEHSOURVKAWVRV-UHFFFAOYSA-N 0 0 368.842 3.828 20 5 FHBDRN O=C(c1cscc1Br)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000583165875 937197010 /nfs/dbraw/zinc/19/70/10/937197010.db2.gz XVUBVMHZRYJVPG-UHFFFAOYSA-N 0 0 353.197 3.622 20 5 FHBDRN COc1cccc2c1CCN(C(=O)c1cccc(SC)c1[N+](=O)[O-])C2 ZINC000187042018 927862499 /nfs/dbraw/zinc/86/24/99/927862499.db2.gz AOQJYRNFAUKWCT-UHFFFAOYSA-N 0 0 358.419 3.524 20 5 FHBDRN C[C@H]1CO[C@@H](c2cccc(Cl)c2)CN1C(=O)c1cccc([N+](=O)[O-])c1 ZINC000187062652 927878733 /nfs/dbraw/zinc/87/87/33/927878733.db2.gz VPFKGPZGVIWNGD-YVEFUNNKSA-N 0 0 360.797 3.850 20 5 FHBDRN COc1ccccc1CCN(C)C(=O)Nc1cc([N+](=O)[O-])c(C)cc1C ZINC000120255273 927891679 /nfs/dbraw/zinc/89/16/79/927891679.db2.gz LFZDUPMMOFVIRB-UHFFFAOYSA-N 0 0 357.410 3.927 20 5 FHBDRN CSc1cccc(C(=O)NC[C@@H](C)c2nc(C)cs2)c1[N+](=O)[O-] ZINC000187068834 927896018 /nfs/dbraw/zinc/89/60/18/927896018.db2.gz IZGKFGJYBGMEBF-SECBINFHSA-N 0 0 351.453 3.615 20 5 FHBDRN CSc1cccc(C(=O)N[C@H]2CCO[C@@H](c3ccccc3)C2)c1[N+](=O)[O-] ZINC000187083254 927902071 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FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(C(=O)NC(C)C)cc2C)c1C ZINC001125302357 928673832 /nfs/dbraw/zinc/67/38/32/928673832.db2.gz FKSQJABXHHCDMW-UHFFFAOYSA-N 0 0 369.421 3.911 20 5 FHBDRN CCN(Cc1cccc(F)c1)C(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000120511038 928694131 /nfs/dbraw/zinc/69/41/31/928694131.db2.gz MCMNOPRMEQGFOZ-UHFFFAOYSA-N 0 0 368.368 3.582 20 5 FHBDRN Cc1c([N+](=O)[O-])cc(C(=O)N2CC[C@H](c3ccccc3)[C@H]2C)cc1[N+](=O)[O-] ZINC000175764853 928825111 /nfs/dbraw/zinc/82/51/11/928825111.db2.gz DTNBSIKWBJHSFN-CJNGLKHVSA-N 0 0 369.377 3.830 20 5 FHBDRN O=C(N[C@@H]1CCCN(c2ccccc2)C1)c1cccc(Cl)c1[N+](=O)[O-] ZINC000176585262 937278887 /nfs/dbraw/zinc/27/88/87/937278887.db2.gz SJZRNRMEPMBYIF-CYBMUJFWSA-N 0 0 359.813 3.647 20 5 FHBDRN CN(Cc1cccc(O)c1)C(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000547715339 928841269 /nfs/dbraw/zinc/84/12/69/928841269.db2.gz CKNFMEWANJSPKP-UHFFFAOYSA-N 0 0 358.397 3.659 20 5 FHBDRN C[C@H]1CN(C(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)CC[C@H]1c1ccccc1 ZINC000610235256 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Cc1nn(Cc2ccc(C(=O)N(C)C[C@@H]3CC3(C)C)cc2)c(C)c1[N+](=O)[O-] ZINC000598566385 928961399 /nfs/dbraw/zinc/96/13/99/928961399.db2.gz VISCZMFDMBJJCZ-KRWDZBQOSA-N 0 0 370.453 3.575 20 5 FHBDRN Cc1nc(NC(=O)c2ccc(Oc3ccccc3)nc2)ccc1[N+](=O)[O-] ZINC000133744195 928962826 /nfs/dbraw/zinc/96/28/26/928962826.db2.gz TVDLNNDVPZGDRO-UHFFFAOYSA-N 0 0 350.334 3.738 20 5 FHBDRN Cc1cc(C)n([C@H](C)C(=O)N(c2cccc([N+](=O)[O-])c2)C2CCCC2)n1 ZINC000120564051 928964757 /nfs/dbraw/zinc/96/47/57/928964757.db2.gz BAXWHFZBQLWMTL-OAHLLOKOSA-N 0 0 356.426 3.945 20 5 FHBDRN COC(=O)c1cc(C(=O)N[C@@H](CC2CC2)c2ccccc2)cc([N+](=O)[O-])c1 ZINC000610236370 929026594 /nfs/dbraw/zinc/02/65/94/929026594.db2.gz SAAJPQYNWGGEKI-SFHVURJKSA-N 0 0 368.389 3.653 20 5 FHBDRN C[C@@H](SCc1ccccc1)C(=O)NCc1cc([N+](=O)[O-])c(F)cc1F ZINC001143376409 929041817 /nfs/dbraw/zinc/04/18/17/929041817.db2.gz CVCGYCMHJFSNPH-LLVKDONJSA-N 0 0 366.389 3.811 20 5 FHBDRN O=[N+]([O-])c1cnc(NCc2ccc(-c3ncon3)cc2)c(C(F)(F)F)c1 ZINC001167090562 929044470 /nfs/dbraw/zinc/04/44/70/929044470.db2.gz WQLIWXFBLOHGFO-UHFFFAOYSA-N 0 0 365.271 3.671 20 5 FHBDRN C[C@@H](Oc1cccc(Cl)c1)C(=O)NCc1cc([N+](=O)[O-])c(F)cc1F ZINC001143376444 929061277 /nfs/dbraw/zinc/06/12/77/929061277.db2.gz FFTLQMDSBOOYRM-SECBINFHSA-N 0 0 370.739 3.610 20 5 FHBDRN O=C(c1cc2ccccc2c2cccnc12)N1CCCN(CC(F)F)CC1 ZINC000179812410 929067489 /nfs/dbraw/zinc/06/74/89/929067489.db2.gz SYFKSFJJPNDKID-UHFFFAOYSA-N 0 0 369.415 3.801 20 5 FHBDRN CC1(NC(=O)CCc2c(Cl)cccc2[N+](=O)[O-])Cc2ccccc2C1 ZINC001266334866 929087569 /nfs/dbraw/zinc/08/75/69/929087569.db2.gz YNWBJHBFPRMZFJ-UHFFFAOYSA-N 0 0 358.825 3.855 20 5 FHBDRN Cc1cc(NC(=O)c2cccc([N+](=O)[O-])c2N)c(F)cc1Br ZINC000319042031 929089118 /nfs/dbraw/zinc/08/91/18/929089118.db2.gz CXSITFWYYBESJA-UHFFFAOYSA-N 0 0 368.162 3.639 20 5 FHBDRN O=C(NCCc1ccccc1[N+](=O)[O-])N1CCc2cccc(Cl)c2C1 ZINC000458460415 937305868 /nfs/dbraw/zinc/30/58/68/937305868.db2.gz QDAOOBHVGSNJPO-UHFFFAOYSA-N 0 0 359.813 3.559 20 5 FHBDRN CC(C)[C@@H]1CCCN(C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)CC1 ZINC000134685631 929149608 /nfs/dbraw/zinc/14/96/08/929149608.db2.gz YSNOESBYIOQHST-OAHLLOKOSA-N 0 0 356.426 3.679 20 5 FHBDRN CSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)c1cnn(CC2CCC2)c1 ZINC000890668014 929152405 /nfs/dbraw/zinc/15/24/05/929152405.db2.gz XRRUQRMRSNNOHK-GFCCVEGCSA-N 0 0 374.466 3.804 20 5 FHBDRN C[C@@H]1CCc2c(sc(=O)n2Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000134697624 929159622 /nfs/dbraw/zinc/15/96/22/929159622.db2.gz LQZNUFSPKDDUSW-LLVKDONJSA-N 0 0 371.418 3.646 20 5 FHBDRN Cc1c(NC(=O)c2cc(N3CCCC3=O)ccc2Cl)cccc1[N+](=O)[O-] ZINC000134709837 929163759 /nfs/dbraw/zinc/16/37/59/929163759.db2.gz OMPYGBJFWIQVOA-UHFFFAOYSA-N 0 0 373.796 3.936 20 5 FHBDRN COc1cccc(Cc2cnc(NC(=O)c3ccccc3[N+](=O)[O-])s2)c1 ZINC000023488609 929200818 /nfs/dbraw/zinc/20/08/18/929200818.db2.gz XVVPHFKNHVPYCU-UHFFFAOYSA-N 0 0 369.402 3.903 20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])N[C@H]1CCC[C@H]1c1ccccc1 ZINC000609511388 929202560 /nfs/dbraw/zinc/20/25/60/929202560.db2.gz WPHGQPUNXPBELP-IRXDYDNUSA-N 0 0 353.422 3.849 20 5 FHBDRN C[C@H](NC(=O)CSc1ccc([N+](=O)[O-])cc1)c1cnn(CC2CCC2)c1 ZINC000890676222 929222458 /nfs/dbraw/zinc/22/24/58/929222458.db2.gz DFMSKJXLKBDYMC-ZDUSSCGKSA-N 0 0 374.466 3.561 20 5 FHBDRN C[C@H](NC(=O)c1cc(Cl)ccc1[N+](=O)[O-])c1cnn(CC2CCC2)c1 ZINC000890677204 929231780 /nfs/dbraw/zinc/23/17/80/929231780.db2.gz LQAQCZKYHHLTAV-NSHDSACASA-N 0 0 362.817 3.736 20 5 FHBDRN Cc1csc(CCCCNC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)n1 ZINC000134773710 929242909 /nfs/dbraw/zinc/24/29/09/929242909.db2.gz DJNHPUIZUJRMMU-UHFFFAOYSA-N 0 0 353.831 3.766 20 5 FHBDRN Cc1ccc(NC(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)c(C)n1 ZINC000178845969 937316186 /nfs/dbraw/zinc/31/61/86/937316186.db2.gz HREYNHPDYBMEME-UHFFFAOYSA-N 0 0 364.199 3.930 20 5 FHBDRN Cc1cc(C(=O)Nc2ccc(Br)c(C)n2)cc([N+](=O)[O-])c1 ZINC000134820362 929304713 /nfs/dbraw/zinc/30/47/13/929304713.db2.gz XYYHHDZZASJLFN-UHFFFAOYSA-N 0 0 350.172 3.621 20 5 FHBDRN CC(=O)[C@@H](C)CCCCc1nc(CCNc2ccccc2[N+](=O)[O-])no1 ZINC000275054141 929329799 /nfs/dbraw/zinc/32/97/99/929329799.db2.gz PKESZBQXNLAXQU-ZDUSSCGKSA-N 0 0 360.414 3.570 20 5 FHBDRN Cc1ncc(-c2ccc(NC(=O)c3cc4c(c([N+](=O)[O-])c3)OCO4)cc2)o1 ZINC000180212488 929422870 /nfs/dbraw/zinc/42/28/70/929422870.db2.gz IJTFJHNRTAHRJH-UHFFFAOYSA-N 0 0 367.317 3.539 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)c1ncc(C(F)(F)F)cc1Cl ZINC001125311728 929444289 /nfs/dbraw/zinc/44/42/89/929444289.db2.gz RMTALCQXMJIWMG-UHFFFAOYSA-N 0 0 373.718 3.635 20 5 FHBDRN CC1(CNC(=O)[C@H]2C[C@@H]2c2cccc([N+](=O)[O-])c2)Cc2ccccc2C1 ZINC001266353901 929448919 /nfs/dbraw/zinc/44/89/19/929448919.db2.gz GVYIVCOTCAFITF-MOPGFXCFSA-N 0 0 350.418 3.620 20 5 FHBDRN COC[C@H](C)n1c(C)cc(C(=O)COc2cc(F)cc([N+](=O)[O-])c2)c1C ZINC000135344525 937337366 /nfs/dbraw/zinc/33/73/66/937337366.db2.gz JEXLUBRFYRUBJI-LBPRGKRZSA-N 0 0 364.373 3.621 20 5 FHBDRN O=C(N[C@@H]1C[C@H]1c1cccc(F)c1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000178861697 937339772 /nfs/dbraw/zinc/33/97/72/937339772.db2.gz PAFZAIQHOXVAED-ZWKOTPCHSA-N 0 0 369.396 3.964 20 5 FHBDRN COCCCOc1ccc(C(=O)N2CCCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000176672358 937342222 /nfs/dbraw/zinc/34/22/22/937342222.db2.gz TUEGNDFUWKNTRG-UHFFFAOYSA-N 0 0 370.405 3.603 20 5 FHBDRN O=C(NC[C@H]1CCCO[C@H]1c1ccccc1)Nc1cccc([N+](=O)[O-])c1 ZINC000146220915 937346032 /nfs/dbraw/zinc/34/60/32/937346032.db2.gz OFCRYQYIPOQIMW-QAPCUYQASA-N 0 0 355.394 3.884 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N2CCC[C@@]2(C)Cc2ccccc2)c1 ZINC000187291076 929634209 /nfs/dbraw/zinc/63/42/09/929634209.db2.gz WEFLGWNBCRBBEI-FQEVSTJZSA-N 0 0 354.406 3.841 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)N[C@H](Cc1ccccc1)C1CC1 ZINC000134958069 929636430 /nfs/dbraw/zinc/63/64/30/929636430.db2.gz KQFABQHVYFOLHS-GOSISDBHSA-N 0 0 356.447 3.824 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1COC(=O)c1cc(F)c(F)cc1Cl ZINC000011401169 929662298 /nfs/dbraw/zinc/66/22/98/929662298.db2.gz RQYPPJLZSOXMBJ-UHFFFAOYSA-N 0 0 357.696 3.892 20 5 FHBDRN CC[C@H]1c2ccccc2CCN1C(=O)CN(C)c1ccccc1[N+](=O)[O-] ZINC000610294022 929686634 /nfs/dbraw/zinc/68/66/34/929686634.db2.gz FLSUNVYLWWOWRO-KRWDZBQOSA-N 0 0 353.422 3.567 20 5 FHBDRN CN(Cc1ccc(Cl)c(Cl)c1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000027352444 929690277 /nfs/dbraw/zinc/69/02/77/929690277.db2.gz FNVIZHPKMSHWOL-UHFFFAOYSA-N 0 0 368.220 3.633 20 5 FHBDRN C[C@H](c1ccc(NC(=O)Nc2ccc([N+](=O)[O-])cc2)cc1)N1CCOCC1 ZINC000109846651 929699565 /nfs/dbraw/zinc/69/95/65/929699565.db2.gz VHKDYDCYROAFEF-CQSZACIVSA-N 0 0 370.409 3.632 20 5 FHBDRN CCCCO[C@H]1C[C@H](NC(=O)c2c(Cl)cccc2[N+](=O)[O-])C1(C)C ZINC000177642442 929727917 /nfs/dbraw/zinc/72/79/17/929727917.db2.gz FQRHQKDLSQIQKN-KBPBESRZSA-N 0 0 354.834 3.962 20 5 FHBDRN C[C@H](NC(=O)c1ccn(-c2ccc(Cl)cc2)n1)c1cccc([N+](=O)[O-])c1 ZINC000535997724 937354893 /nfs/dbraw/zinc/35/48/93/937354893.db2.gz CIMWHTMLJUIBLD-LBPRGKRZSA-N 0 0 370.796 3.925 20 5 FHBDRN CC[C@H](NC(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1)c1ccc(F)cc1 ZINC001266530846 929755146 /nfs/dbraw/zinc/75/51/46/929755146.db2.gz FZZMLAIFBDZUJX-INIZCTEOSA-N 0 0 368.368 3.801 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])cc2c1OCCO2)N1CCCC2(C1)CCCCCC2 ZINC000610303510 929770323 /nfs/dbraw/zinc/77/03/23/929770323.db2.gz LBEZMFIFYXCBHL-UHFFFAOYSA-N 0 0 374.437 3.943 20 5 FHBDRN O=C(NCC(C1CC1)C1CC1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000610302880 929773435 /nfs/dbraw/zinc/77/34/35/929773435.db2.gz CYONFAJTQIFLLG-UHFFFAOYSA-N 0 0 357.435 3.884 20 5 FHBDRN COC(=O)c1c(C)csc1NC(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000579037131 929775945 /nfs/dbraw/zinc/77/59/45/929775945.db2.gz REEGBYATAMWMRR-UHFFFAOYSA-N 0 0 360.347 3.750 20 5 FHBDRN Nc1c(C(=O)Nc2ccc3c(Cl)cccc3n2)cc(F)cc1[N+](=O)[O-] ZINC000579990215 929785673 /nfs/dbraw/zinc/78/56/73/929785673.db2.gz SGVPUIYMAXCDQO-UHFFFAOYSA-N 0 0 360.732 3.770 20 5 FHBDRN O=C(CC1CCC(c2ccccc2)CC1)OCCn1ccc([N+](=O)[O-])n1 ZINC000748125960 929786466 /nfs/dbraw/zinc/78/64/66/929786466.db2.gz VBHRXXWOKCPVBB-UHFFFAOYSA-N 0 0 357.410 3.699 20 5 FHBDRN CC[C@@H](NC(=O)N1CC[C@H](Nc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000176683748 937366654 /nfs/dbraw/zinc/36/66/54/937366654.db2.gz ADFLFYDDTYPSMV-PKOBYXMFSA-N 0 0 368.437 3.942 20 5 FHBDRN C[C@H](C(=O)Nc1cccc(Nc2cnn(C)c2)c1)c1cccc([N+](=O)[O-])c1 ZINC000579067425 929821955 /nfs/dbraw/zinc/82/19/55/929821955.db2.gz JFAJODKPZWOHBL-ZDUSSCGKSA-N 0 0 365.393 3.814 20 5 FHBDRN Cn1ccnc1[C@H](N[C@H]1C[C@H](c2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000560533573 929875704 /nfs/dbraw/zinc/87/57/04/929875704.db2.gz QCQPHZFNAKONFE-QWFCFKBJSA-N 0 0 362.433 3.954 20 5 FHBDRN CCOC(=O)c1c(C)oc2ncnc(N[C@H](C)c3cccc([N+](=O)[O-])c3)c21 ZINC000178869055 937369724 /nfs/dbraw/zinc/36/97/24/937369724.db2.gz INTSFURPDQNWME-SNVBAGLBSA-N 0 0 370.365 3.789 20 5 FHBDRN C[C@@H]1Oc2ccccc2[C@@H]1NC(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000579150064 929943787 /nfs/dbraw/zinc/94/37/87/929943787.db2.gz ABYXQDWFPKOMQQ-BJOHPYRUSA-N 0 0 366.295 3.866 20 5 FHBDRN C[C@@H]1Oc2ccccc2[C@H]1NC(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000579150067 929943906 /nfs/dbraw/zinc/94/39/06/929943906.db2.gz ABYXQDWFPKOMQQ-VFZGTOFNSA-N 0 0 366.295 3.866 20 5 FHBDRN Cc1ccc([C@@H](C)N(C)C(=O)C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)cc1 ZINC000121107899 929945383 /nfs/dbraw/zinc/94/53/83/929945383.db2.gz GOISLLAJPGPJMT-OAHLLOKOSA-N 0 0 369.421 3.678 20 5 FHBDRN CN(Cc1ccc(F)c(F)c1)C(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000044543920 937373438 /nfs/dbraw/zinc/37/34/38/937373438.db2.gz FHMRJZHZRRDQJX-UHFFFAOYSA-N 0 0 363.364 3.724 20 5 FHBDRN O=[N+]([O-])c1ncccc1CN(CCCO)Cc1ccc(Cl)c(Cl)c1 ZINC001167332772 929958155 /nfs/dbraw/zinc/95/81/55/929958155.db2.gz RRFYXDZQTJMQOV-UHFFFAOYSA-N 0 0 370.236 3.681 20 5 FHBDRN C[C@]1(CNC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)CCCC[C@@H]1O ZINC000275714899 929965289 /nfs/dbraw/zinc/96/52/89/929965289.db2.gz HOYQDNIEVNOMEX-SIKLNZKXSA-N 0 0 364.445 3.765 20 5 FHBDRN O=[N+]([O-])c1cc(F)c(N[C@@H](CO)c2cccc(Br)c2)c(F)c1 ZINC000178871522 937375672 /nfs/dbraw/zinc/37/56/72/937375672.db2.gz QVYFWQGSYBCHLY-ZDUSSCGKSA-N 0 0 373.153 3.781 20 5 FHBDRN C[C@H]1CCC[C@H](C)N1CC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC001167337638 929993399 /nfs/dbraw/zinc/99/33/99/929993399.db2.gz VCKMQOODHUPGPS-STQMWFEESA-N 0 0 374.466 3.920 20 5 FHBDRN O=C(CCc1nc2ccccc2o1)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000610046935 930000866 /nfs/dbraw/zinc/00/08/66/930000866.db2.gz PGCWRJDWDATREO-UHFFFAOYSA-N 0 0 367.405 3.808 20 5 FHBDRN Cc1c(NC(=O)C[C@@H](NC(=O)OC(C)(C)C)C2CC2)cccc1[N+](=O)[O-] ZINC000784993951 930006926 /nfs/dbraw/zinc/00/69/26/930006926.db2.gz WDSHGBPVFMEXHW-CQSZACIVSA-N 0 0 363.414 3.535 20 5 FHBDRN Cc1ccc(CCCNC(=O)NCCc2ccccc2[N+](=O)[O-])c(C)c1 ZINC000610345749 930050286 /nfs/dbraw/zinc/05/02/86/930050286.db2.gz LAYHHLNLLSQDHL-UHFFFAOYSA-N 0 0 355.438 3.686 20 5 FHBDRN COC(=O)c1cc(O[C@H](C)c2nnc(-c3ccccc3)o2)ccc1[N+](=O)[O-] ZINC000177674019 930057611 /nfs/dbraw/zinc/05/76/11/930057611.db2.gz WETVLQHOGDXTAX-LLVKDONJSA-N 0 0 369.333 3.571 20 5 FHBDRN CO[C@@H]1C[C@@H](N(C)C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)C12CCC2 ZINC000458496615 937386025 /nfs/dbraw/zinc/38/60/25/937386025.db2.gz IHHPMFNLAAAYKI-KBRIMQKVSA-N 0 0 361.442 3.563 20 5 FHBDRN Cc1nn(CCC(=O)N2c3ccccc3S[C@H](C)[C@H]2C)c(C)c1[N+](=O)[O-] ZINC000176698794 937379540 /nfs/dbraw/zinc/37/95/40/937379540.db2.gz ODMIHRAIJMAVTE-TZMCWYRMSA-N 0 0 374.466 3.714 20 5 FHBDRN O=C(Nc1ccc2cc([N+](=O)[O-])ccc2n1)c1occc1Br ZINC000176702284 937380553 /nfs/dbraw/zinc/38/05/53/937380553.db2.gz UZTUWFVGTLDSLR-UHFFFAOYSA-N 0 0 362.139 3.751 20 5 FHBDRN COc1cc(C(=O)O[C@H]2c3ccccc3OC[C@H]2C)c([N+](=O)[O-])cc1F ZINC001266558363 930088550 /nfs/dbraw/zinc/08/85/50/930088550.db2.gz NQTBLHWOKSBALF-BMLIUANNSA-N 0 0 361.325 3.669 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CC[C@@H](c3ccc(F)cc3)C2)c1 ZINC000471514878 930112474 /nfs/dbraw/zinc/11/24/74/930112474.db2.gz NTGZEGAGMDKYBY-UKRRQHHQSA-N 0 0 358.369 3.809 20 5 FHBDRN Cc1ccc(S(=O)(=O)C[C@@H](C)Nc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000471526692 930158720 /nfs/dbraw/zinc/15/87/20/930158720.db2.gz GVNZMEIERMJDTA-GFCCVEGCSA-N 0 0 368.842 3.831 20 5 FHBDRN C[C@@H](OC(=O)[C@@H](C)C1CC1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000748143484 930179606 /nfs/dbraw/zinc/17/96/06/930179606.db2.gz NXVWNLPGZPZWRM-DTWKUNHWSA-N 0 0 374.315 3.530 20 5 FHBDRN CC(=O)Nc1ccc(C)c2c1CCCN2C(=O)c1cc(C)cc([N+](=O)[O-])c1 ZINC000275763553 930189952 /nfs/dbraw/zinc/18/99/52/930189952.db2.gz FZJXOPKNGJDGHV-UHFFFAOYSA-N 0 0 367.405 3.763 20 5 FHBDRN O=C(Nc1ccc(F)cc1OCC(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000070868513 930190051 /nfs/dbraw/zinc/19/00/51/930190051.db2.gz CJUOLYYTXQGGHQ-UHFFFAOYSA-N 0 0 358.247 3.927 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)NCc1ccc(OC2CCCC2)cc1 ZINC000560824409 930213603 /nfs/dbraw/zinc/21/36/03/930213603.db2.gz ZPLRSRGSPHOUID-UHFFFAOYSA-N 0 0 354.406 3.775 20 5 FHBDRN COc1ccc(N(C)C(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)cc1OC ZINC000579445129 930223088 /nfs/dbraw/zinc/22/30/88/930223088.db2.gz OHADSTLWNWWKMN-UHFFFAOYSA-N 0 0 359.382 3.897 20 5 FHBDRN O=C(c1cc2cccn2cn1)N(CC1CC1)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC001125420294 930232305 /nfs/dbraw/zinc/23/23/05/930232305.db2.gz HRYNLLLSZGOQAJ-UHFFFAOYSA-N 0 0 370.796 3.953 20 5 FHBDRN CC(=O)c1cc(N(C)CCc2nc(-c3ccccc3)no2)ccc1[N+](=O)[O-] ZINC000579457090 930246060 /nfs/dbraw/zinc/24/60/60/930246060.db2.gz DMCWYEZYDAHORX-UHFFFAOYSA-N 0 0 366.377 3.526 20 5 FHBDRN CCc1ccc([C@@H]2CCN(C(=O)COc3cccc([N+](=O)[O-])c3)C2)cc1 ZINC000580111088 930261429 /nfs/dbraw/zinc/26/14/29/930261429.db2.gz QTLWPAXUMGJRHM-QGZVFWFLSA-N 0 0 354.406 3.552 20 5 FHBDRN CN(C(=O)c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1)c1cnccn1 ZINC000580120821 930269642 /nfs/dbraw/zinc/26/96/42/930269642.db2.gz DSSPNRZVKNVSLP-UHFFFAOYSA-N 0 0 366.402 3.813 20 5 FHBDRN CCc1ccc(C(=O)Nc2ccnn2-c2cccc(F)c2)cc1[N+](=O)[O-] ZINC000472286535 937400391 /nfs/dbraw/zinc/40/03/91/937400391.db2.gz JCIWRFRCLXZVPT-UHFFFAOYSA-N 0 0 354.341 3.734 20 5 FHBDRN Cc1cccc2c1[C@@H](C)C[C@@H]2Cc1nc(-c2c([N+](=O)[O-])ncn2C)no1 ZINC000580127150 930287231 /nfs/dbraw/zinc/28/72/31/930287231.db2.gz YTEWOVJWDVSCSH-NWDGAFQWSA-N 0 0 353.382 3.520 20 5 FHBDRN CCC[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)Cc1ccc(OC)cc1 ZINC000610390266 930297330 /nfs/dbraw/zinc/29/73/30/930297330.db2.gz OXFFLJXPBLCUKL-UHFFFAOYSA-N 0 0 371.437 3.763 20 5 FHBDRN CNC(=O)c1ccc(NCC(C)(C)c2ccc(Cl)cc2)c([N+](=O)[O-])c1 ZINC000064915124 930310610 /nfs/dbraw/zinc/31/06/10/930310610.db2.gz ZXLDRGAWVIHUCL-UHFFFAOYSA-N 0 0 361.829 3.998 20 5 FHBDRN COc1ccc(OC)c(CCNc2ccc([N+](=O)[O-])c3cccnc23)c1 ZINC000064916198 930313128 /nfs/dbraw/zinc/31/31/28/930313128.db2.gz XJLCGXBJGUIPPD-UHFFFAOYSA-N 0 0 353.378 3.815 20 5 FHBDRN C[C@@H](CNC(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1)Oc1ccccc1 ZINC000070898485 930364793 /nfs/dbraw/zinc/36/47/93/930364793.db2.gz SVALFMZKYOYMIB-KBPBESRZSA-N 0 0 360.435 3.659 20 5 FHBDRN CCCc1coc(NC(=O)c2cc([N+](=O)[O-])ccc2SCCOC)n1 ZINC000579488965 930368596 /nfs/dbraw/zinc/36/85/96/930368596.db2.gz DAFAXIGOEHRVEY-UHFFFAOYSA-N 0 0 365.411 3.526 20 5 FHBDRN CCCc1ccc([C@H](C)N(CC(N)=O)Cc2cc(F)ccc2[N+](=O)[O-])cc1 ZINC000728287493 930378214 /nfs/dbraw/zinc/37/82/14/930378214.db2.gz DWUNMPGCDIZXJP-AWEZNQCLSA-N 0 0 373.428 3.735 20 5 FHBDRN CC[C@@H]1c2ccccc2CCN1C(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000610405187 930391766 /nfs/dbraw/zinc/39/17/66/930391766.db2.gz QVCWVLFWRBETSY-GOSISDBHSA-N 0 0 353.422 3.856 20 5 FHBDRN O=C(NCCc1ccccc1[N+](=O)[O-])N1CCS[C@@H](c2ccccc2)C1 ZINC000610405189 930391811 /nfs/dbraw/zinc/39/18/11/930391811.db2.gz RUJVLFJJUTVHCP-GOSISDBHSA-N 0 0 371.462 3.637 20 5 FHBDRN O=C1COc2c(NCc3ccc([N+](=O)[O-])cc3Cl)cc(Cl)cc2N1 ZINC000580251540 930404673 /nfs/dbraw/zinc/40/46/73/930404673.db2.gz KFACKGBLURMQFH-UHFFFAOYSA-N 0 0 368.176 3.845 20 5 FHBDRN CC(C)N(Cc1ccc(-c2cccc(F)c2)s1)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001125434312 930434842 /nfs/dbraw/zinc/43/48/42/930434842.db2.gz UNGMBQPXKCTPRL-HZPDHXFCSA-N 0 0 362.426 3.956 20 5 FHBDRN Cc1noc(C)c1[C@@H](C)CC(=O)NCCCNc1ccc(C)cc1[N+](=O)[O-] ZINC000155640481 930437181 /nfs/dbraw/zinc/43/71/81/930437181.db2.gz VSKMJLJMPXYSCM-ZDUSSCGKSA-N 0 0 374.441 3.620 20 5 FHBDRN O=C(COc1cccc([N+](=O)[O-])c1)N[C@@H]1CC[C@@H](c2ccc(F)cc2)C1 ZINC000471550367 930447272 /nfs/dbraw/zinc/44/72/72/930447272.db2.gz XXBZSPJDEJLAHS-GDBMZVCRSA-N 0 0 358.369 3.565 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1NC(=O)CN1c2ccccc2SC[C@@H]1C ZINC000134183288 930471160 /nfs/dbraw/zinc/47/11/60/930471160.db2.gz MXNLROFVGQNPJA-ZDUSSCGKSA-N 0 0 357.435 3.843 20 5 FHBDRN CC[C@H](Cc1ccccc1)N(C)C(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000175801081 930472471 /nfs/dbraw/zinc/47/24/71/930472471.db2.gz CQFTVNVTFPVDAI-GOSISDBHSA-N 0 0 355.438 3.800 20 5 FHBDRN CC(C)OCCCN(C)C(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000275822214 930480675 /nfs/dbraw/zinc/48/06/75/930480675.db2.gz SJRQKNUQMIPTOZ-UHFFFAOYSA-N 0 0 352.434 3.981 20 5 FHBDRN COc1cc(C)c(C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1OC ZINC000118973177 930484538 /nfs/dbraw/zinc/48/45/38/930484538.db2.gz XTSGXEUZQGPZOE-ZDUSSCGKSA-N 0 0 358.394 3.720 20 5 FHBDRN COc1cc(C(=O)N[C@@H](C)[C@H]2CC3CCC2CC3)c([N+](=O)[O-])cc1OC ZINC000580317821 930492752 /nfs/dbraw/zinc/49/27/52/930492752.db2.gz FIMUCJCMEVXQEM-GFJIZPEISA-N 0 0 362.426 3.557 20 5 FHBDRN C[C@@H]1C[C@@H](CNC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)CCO1 ZINC000275834653 930510920 /nfs/dbraw/zinc/51/09/20/930510920.db2.gz BKEJWOVMUCWJAD-KGLIPLIRSA-N 0 0 350.418 3.639 20 5 FHBDRN Cc1noc(C(F)F)c1C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000610431399 930524356 /nfs/dbraw/zinc/52/43/56/930524356.db2.gz KCMDQTLPAMSHKQ-UHFFFAOYSA-N 0 0 363.223 3.683 20 5 FHBDRN CC(=O)c1ccc(OCC(=O)Nc2ccc(C)c(Cl)c2)c([N+](=O)[O-])c1 ZINC000119047557 930574739 /nfs/dbraw/zinc/57/47/39/930574739.db2.gz NHTIKSGLOPELHB-UHFFFAOYSA-N 0 0 362.769 3.777 20 5 FHBDRN COc1cc(C(=O)Nc2cccc(C(C)(F)F)c2)c([N+](=O)[O-])cc1OC ZINC000187346896 930586942 /nfs/dbraw/zinc/58/69/42/930586942.db2.gz CMKCZEJDBBIZJU-UHFFFAOYSA-N 0 0 366.320 3.976 20 5 FHBDRN CCOCCC1(CNC(=O)CSc2ccccc2[N+](=O)[O-])CCCC1 ZINC000121211868 930608573 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CCOc1cccc([N+](=O)[O-])c1C(=O)Nc1nc(-c2cccnc2)cs1 ZINC000548093772 930650519 /nfs/dbraw/zinc/65/05/19/930650519.db2.gz RQWIMUYQQOCNNL-UHFFFAOYSA-N 0 0 370.390 3.764 20 5 FHBDRN O=C(CSc1ccc(Br)cc1[N+](=O)[O-])Nc1nccs1 ZINC000119098962 930661199 /nfs/dbraw/zinc/66/11/99/930661199.db2.gz YMNDQDHSFBFLRZ-UHFFFAOYSA-N 0 0 374.241 3.545 20 5 FHBDRN CC[C@@H]1c2ccccc2CCN1C(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000074644965 930681721 /nfs/dbraw/zinc/68/17/21/930681721.db2.gz HWUSVKUNFRNLMS-MRXNPFEDSA-N 0 0 370.405 3.762 20 5 FHBDRN O=c1[nH]c(N2CCC[C@H]2CCc2ccccc2)nc2ccc([N+](=O)[O-])cc21 ZINC000561122842 930688645 /nfs/dbraw/zinc/68/86/45/930688645.db2.gz WZYYRLJCKCKQCQ-HNNXBMFYSA-N 0 0 364.405 3.845 20 5 FHBDRN O=C(Nc1ccnn1Cc1ccccc1F)c1cccc(Cl)c1[N+](=O)[O-] ZINC000175814793 930719937 /nfs/dbraw/zinc/71/99/37/930719937.db2.gz FJICZDPOSDALPZ-UHFFFAOYSA-N 0 0 374.759 3.884 20 5 FHBDRN CC(C)CC1(C(=O)N2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)CCCC1 ZINC000119141052 930728723 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20 5 FHBDRN COc1ccc2c(c1)CCC[C@@H]2c1noc(-c2ccc([N+](=O)[O-])cn2)n1 ZINC000580504868 930777681 /nfs/dbraw/zinc/77/76/81/930777681.db2.gz PRFMMMJNQSOYKB-HNNXBMFYSA-N 0 0 352.350 3.517 20 5 FHBDRN O=C(Nc1nc2c(s1)CSCC2)c1c[nH]c2ccc([N+](=O)[O-])cc21 ZINC000561135835 930788813 /nfs/dbraw/zinc/78/88/13/930788813.db2.gz ISTZBSFQXYWAOR-UHFFFAOYSA-N 0 0 360.420 3.574 20 5 FHBDRN CC[C@@H](NC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(OC)c(OC)c1 ZINC000579693110 930788985 /nfs/dbraw/zinc/78/89/85/930788985.db2.gz AUTOGZOUBNYXOL-CXAGYDPISA-N 0 0 372.421 3.983 20 5 FHBDRN CC[C@H](C)[C@@](C)(O)CNC(=O)c1cc([N+](=O)[O-])ccc1SC(C)C ZINC000537150536 930836376 /nfs/dbraw/zinc/83/63/76/930836376.db2.gz BPMOOAKKJPBBMV-SJCJKPOMSA-N 0 0 354.472 3.622 20 5 FHBDRN O=C(NC1(CF)CCC1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000579717413 930840523 /nfs/dbraw/zinc/84/05/23/930840523.db2.gz YOEFAMPRSKMVEL-UHFFFAOYSA-N 0 0 357.385 3.829 20 5 FHBDRN Cc1ccc(OCC(=O)c2sccc2Br)cc1[N+](=O)[O-] ZINC000380065884 930894871 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3.634 20 5 FHBDRN O=c1ccn(CCCCOc2cccc(C(F)(F)F)c2)cc1[N+](=O)[O-] ZINC000131090643 931743826 /nfs/dbraw/zinc/74/38/26/931743826.db2.gz PPKBFFKGBNBTNB-UHFFFAOYSA-N 0 0 356.300 3.635 20 5 FHBDRN O=C(Nc1cc([N+](=O)[O-])ccc1Cl)C(=O)N1CCCC12CCCCC2 ZINC000785038165 931748928 /nfs/dbraw/zinc/74/89/28/931748928.db2.gz CTYDCGLTKDMZKE-UHFFFAOYSA-N 0 0 365.817 3.512 20 5 FHBDRN Cc1ccn(-c2ccc(C(=O)NC(C)(C)c3ccc([N+](=O)[O-])cc3)cc2)n1 ZINC000430550822 931791759 /nfs/dbraw/zinc/79/17/59/931791759.db2.gz KZLDRSLTZLDSPT-UHFFFAOYSA-N 0 0 364.405 3.754 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H](c1nc(C)cs1)C1CC1 ZINC000156136510 931825345 /nfs/dbraw/zinc/82/53/45/931825345.db2.gz RONVUDCVOAFSTP-CQSZACIVSA-N 0 0 362.411 3.641 20 5 FHBDRN COc1ccc(OC(C)C)c(NC(=O)COc2ccc([N+](=O)[O-])c(C)c2)c1 ZINC000430562956 931864918 /nfs/dbraw/zinc/86/49/18/931864918.db2.gz GZDJHWQQJIIERW-UHFFFAOYSA-N 0 0 374.393 3.717 20 5 FHBDRN CCC[C@H](C)NC(=O)[C@H]1CCCN(c2ccc([N+](=O)[O-])c3cccnc32)C1 ZINC000050933952 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ZINC000933282883 932037195 /nfs/dbraw/zinc/03/71/95/932037195.db2.gz BMMIKBUIEIQFEM-OAHLLOKOSA-N 0 0 372.396 3.691 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N(C)CCOc2ccc(F)cc2)c1 ZINC000033232125 932068571 /nfs/dbraw/zinc/06/85/71/932068571.db2.gz OYLYFSHSNMGPIJ-UHFFFAOYSA-N 0 0 364.398 3.607 20 5 FHBDRN O=C(c1ccc2ccc(Cl)cc2n1)N1CCc2c1cccc2[N+](=O)[O-] ZINC000084112699 932089863 /nfs/dbraw/zinc/08/98/63/932089863.db2.gz RIMVWDDNZDYTNV-UHFFFAOYSA-N 0 0 353.765 3.999 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc2[nH]c(=O)oc21 ZINC000581460674 932093556 /nfs/dbraw/zinc/09/35/56/932093556.db2.gz AYJIJCNCJFUHDE-SECBINFHSA-N 0 0 359.363 3.561 20 5 FHBDRN O=[N+]([O-])c1cc(CN2CCn3c(nnc3-c3ccccc3)C2)ccc1Cl ZINC000178023319 932130487 /nfs/dbraw/zinc/13/04/87/932130487.db2.gz NOVZEFMTOWVQGG-UHFFFAOYSA-N 0 0 369.812 3.523 20 5 FHBDRN O=C(c1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCC([C@H]2CCCO2)CC1 ZINC000276296976 932147269 /nfs/dbraw/zinc/14/72/69/932147269.db2.gz QSAWCNHWENZHSC-OAHLLOKOSA-N 0 0 372.343 3.645 20 5 FHBDRN Cc1nn(C(C)(C)C)cc1[C@@H](C)NC(=O)c1cc(F)c([N+](=O)[O-])cc1F ZINC000156236896 932166862 /nfs/dbraw/zinc/16/68/62/932166862.db2.gz MTIMHZDSBRZXTL-SECBINFHSA-N 0 0 366.368 3.624 20 5 FHBDRN CC[C@H](c1cccc(OC)c1)N(C)C(=O)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000581508538 932185348 /nfs/dbraw/zinc/18/53/48/932185348.db2.gz SCOMNTDHXLARGM-QGZVFWFLSA-N 0 0 372.421 3.764 20 5 FHBDRN CCn1c(=O)c2cc3ccccc3cc2nc1SCCc1cncn1C ZINC000581535052 932220560 /nfs/dbraw/zinc/22/05/60/932220560.db2.gz CHWMOLICNXZGKC-UHFFFAOYSA-N 0 0 364.474 3.638 20 5 FHBDRN O=C(Nc1ccccc1O[C@@H]1CCOC1)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000160947115 932247359 /nfs/dbraw/zinc/24/73/59/932247359.db2.gz KDIFWQMCCGRLKV-GFCCVEGCSA-N 0 0 362.769 3.668 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCC(C)(C)[C@@H]1CCCCO1 ZINC000610718809 932273035 /nfs/dbraw/zinc/27/30/35/932273035.db2.gz MYPDPCNOSPLDJL-CJNGLKHVSA-N 0 0 366.483 3.787 20 5 FHBDRN Cc1cc(Nc2ncnc3sc([N+](=O)[O-])cc32)nn1C1CCCCC1 ZINC000581580679 932274984 /nfs/dbraw/zinc/27/49/84/932274984.db2.gz MZVSVVWJACELLM-UHFFFAOYSA-N 0 0 358.427 3.775 20 5 FHBDRN CNC(=O)c1ccc(N[C@@H]2CCc3sc(Cl)cc32)c([N+](=O)[O-])c1 ZINC000581580569 932275440 /nfs/dbraw/zinc/27/54/40/932275440.db2.gz HJCIFXDAHAHXNA-SNVBAGLBSA-N 0 0 351.815 3.769 20 5 FHBDRN COCCOc1ccccc1NC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000126617181 932278125 /nfs/dbraw/zinc/27/81/25/932278125.db2.gz ONLYZZQORIEZHX-UHFFFAOYSA-N 0 0 365.773 3.917 20 5 FHBDRN COc1cccc(-c2cc(NC(=O)c3cccc(C)c3[N+](=O)[O-])n(C)n2)c1 ZINC000119410400 932293002 /nfs/dbraw/zinc/29/30/02/932293002.db2.gz SWOFFVARDVGMLM-UHFFFAOYSA-N 0 0 366.377 3.565 20 5 FHBDRN O=C(Nc1nc2ccccc2s1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000126633669 932295225 /nfs/dbraw/zinc/29/52/25/932295225.db2.gz TYVGTYKNLXWNBR-UHFFFAOYSA-N 0 0 365.374 3.643 20 5 FHBDRN C[C@@H]1CN(c2ccc([N+](=O)[O-])c(OCc3ccccc3)n2)CC2(CCC2)O1 ZINC000581605142 932305129 /nfs/dbraw/zinc/30/51/29/932305129.db2.gz PDMWMYIDYWYIEC-OAHLLOKOSA-N 0 0 369.421 3.717 20 5 FHBDRN O=C(Nc1ccc(O[C@@H]2CCOC2)cc1)[C@@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1 ZINC000933334333 932333445 /nfs/dbraw/zinc/33/34/45/932333445.db2.gz HBLVKAAZPDPBJE-GUDVDZBRSA-N 0 0 368.389 3.505 20 5 FHBDRN C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000477179017 932374096 /nfs/dbraw/zinc/37/40/96/932374096.db2.gz FMLRUMGAJXTTCZ-SMDDNHRTSA-N 0 0 359.348 3.510 20 5 FHBDRN Cc1c(CN2CCc3c(ncn3-c3ccc(F)cc3)C2)cccc1[N+](=O)[O-] ZINC000510444189 932412836 /nfs/dbraw/zinc/41/28/36/932412836.db2.gz NWJNDZYATSTESF-UHFFFAOYSA-N 0 0 366.396 3.786 20 5 FHBDRN CCC(O)(CC)CCNC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000276439135 932428603 /nfs/dbraw/zinc/42/86/03/932428603.db2.gz LAAFBZRHSFWJNW-UHFFFAOYSA-N 0 0 352.434 3.765 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1Oc1ccccc1)N1CCc2cccnc21 ZINC001266785632 932430181 /nfs/dbraw/zinc/43/01/81/932430181.db2.gz OFOPXRZWCAYRNJ-UHFFFAOYSA-N 0 0 361.357 3.985 20 5 FHBDRN CC(=O)N1CCc2cc(NC(=O)c3c(C)cc(Cl)cc3[N+](=O)[O-])ccc21 ZINC000477292583 932452984 /nfs/dbraw/zinc/45/29/84/932452984.db2.gz NXWLZRGALKAUHC-UHFFFAOYSA-N 0 0 373.796 3.718 20 5 FHBDRN COc1ccccc1C[C@H](NC(=O)c1ccc([N+](=O)[O-])c(OC)c1)C(C)C ZINC000477302039 932456470 /nfs/dbraw/zinc/45/64/70/932456470.db2.gz NBFHGLFYUYPZBP-INIZCTEOSA-N 0 0 372.421 3.609 20 5 FHBDRN C[C@H](CNC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1ccncc1 ZINC000610526253 932477005 /nfs/dbraw/zinc/47/70/05/932477005.db2.gz KOOSSIHPQCKLPJ-SNVBAGLBSA-N 0 0 353.300 3.542 20 5 FHBDRN Cc1cc(OCC(=O)Nc2ccccc2N2CCCC2)ccc1[N+](=O)[O-] ZINC000581682884 932486148 /nfs/dbraw/zinc/48/61/48/932486148.db2.gz QUTADMZGQQMETE-UHFFFAOYSA-N 0 0 355.394 3.521 20 5 FHBDRN Cc1nc(NC(=O)c2c(Cl)cccc2[N+](=O)[O-])ccc1Br ZINC000097992231 932489114 /nfs/dbraw/zinc/48/91/14/932489114.db2.gz FDSHACQFMUMQEX-UHFFFAOYSA-N 0 0 370.590 3.966 20 5 FHBDRN C[C@@H](NC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F)c1ccccc1Cl ZINC000581690125 932501974 /nfs/dbraw/zinc/50/19/74/932501974.db2.gz WZKAAGAETWMPDV-SECBINFHSA-N 0 0 354.740 3.946 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1nc2cccnc2n1CC ZINC000477361820 932503199 /nfs/dbraw/zinc/50/31/99/932503199.db2.gz SOGMAYUSDGYZFD-AWEZNQCLSA-N 0 0 367.409 3.567 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(-c2nc(-c3ccc4nccnc4c3)no2)c1 ZINC000581692340 932505716 /nfs/dbraw/zinc/50/57/16/932505716.db2.gz UTWNUAQPJBLSOJ-UHFFFAOYSA-N 0 0 363.333 3.654 20 5 FHBDRN CN(Cc1nc(-c2ccccc2)c[nH]1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000178109416 932513243 /nfs/dbraw/zinc/51/32/43/932513243.db2.gz NEDVJQFSAMQVMW-UHFFFAOYSA-N 0 0 351.366 3.649 20 5 FHBDRN CCC[C@H](C)[C@@H]1CCCN1C(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000178110092 932513758 /nfs/dbraw/zinc/51/37/58/932513758.db2.gz WTNACHJGKXAPDK-HOCLYGCPSA-N 0 0 356.426 3.821 20 5 FHBDRN COCCCC[C@@H](NC(=O)NCc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000471682064 932556440 /nfs/dbraw/zinc/55/64/40/932556440.db2.gz DKIANIANXDAPEW-LJQANCHMSA-N 0 0 371.437 3.952 20 5 FHBDRN COc1ccc([C@@H]2CCN(C(=O)Nc3cccc([N+](=O)[O-])c3C)C2)cc1 ZINC000157913811 932576845 /nfs/dbraw/zinc/57/68/45/932576845.db2.gz GGZAZQWCSZNIJZ-OAHLLOKOSA-N 0 0 355.394 3.933 20 5 FHBDRN Cc1c([C@@H](C)[NH2+]CCc2cccc([N+](=O)[O-])c2)nnn1-c1ccc(F)cc1 ZINC000090909999 932609237 /nfs/dbraw/zinc/60/92/37/932609237.db2.gz DMNBHFGXMDYXMH-CYBMUJFWSA-N 0 0 369.400 3.516 20 5 FHBDRN COC(=O)c1ccc(NC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000157478306 932612453 /nfs/dbraw/zinc/61/24/53/932612453.db2.gz HORAOKWLXZAOLX-UHFFFAOYSA-N 0 0 369.377 3.578 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N[C@@H](CCCO)c1ccccc1 ZINC000477446538 932617248 /nfs/dbraw/zinc/61/72/48/932617248.db2.gz VHUSTZGNPJDAOZ-HNNXBMFYSA-N 0 0 362.813 3.800 20 5 FHBDRN CC(C)n1nc2c(c1NC(=O)CSc1ccc([N+](=O)[O-])cc1)CCC2 ZINC000471691219 932623738 /nfs/dbraw/zinc/62/37/38/932623738.db2.gz FNWKDJMKEKOJCV-UHFFFAOYSA-N 0 0 360.439 3.592 20 5 FHBDRN CC1(C)[C@H](NC(=O)Cc2cccc([N+](=O)[O-])c2)C[C@H]1OCc1ccccc1 ZINC000471692894 932631192 /nfs/dbraw/zinc/63/11/92/932631192.db2.gz LCIZQXJPJDWKTK-RTBURBONSA-N 0 0 368.433 3.637 20 5 FHBDRN CC1(C)[C@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2)C[C@@H]1OCc1ccccc1 ZINC000471705711 932663198 /nfs/dbraw/zinc/66/31/98/932663198.db2.gz LYCMVDYHKBMFQI-MOPGFXCFSA-N 0 0 368.433 3.637 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)O[C@H](C)c1nc2ccc(Cl)cc2n1C ZINC000176026712 932669323 /nfs/dbraw/zinc/66/93/23/932669323.db2.gz ZBJJQPFRKXYKAY-SNVBAGLBSA-N 0 0 374.784 3.756 20 5 FHBDRN COC(=O)c1ccccc1CCc1nc(-c2ccc(C)c([N+](=O)[O-])c2)no1 ZINC000544944014 932687422 /nfs/dbraw/zinc/68/74/22/932687422.db2.gz NKBNRWMLBPRDPY-UHFFFAOYSA-N 0 0 367.361 3.525 20 5 FHBDRN CCc1c(C(=O)NCc2ccc([N+](=O)[O-])cc2)cnn1-c1ccccc1C ZINC000471722589 932711616 /nfs/dbraw/zinc/71/16/16/932711616.db2.gz BWNGTIHCOFPGEP-UHFFFAOYSA-N 0 0 364.405 3.581 20 5 FHBDRN C[C@@H](NC(=O)Nc1nccn1-c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000581831628 932713529 /nfs/dbraw/zinc/71/35/29/932713529.db2.gz QGDQBWBEXKVMDE-CYBMUJFWSA-N 0 0 351.366 3.663 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1)N1CC[C@](F)(c2cc(F)cc(F)c2)C1 ZINC000581839668 932720131 /nfs/dbraw/zinc/72/01/31/932720131.db2.gz SPAQYGORCCPUNB-QGZVFWFLSA-N 0 0 350.296 3.584 20 5 FHBDRN COc1cc(C)ccc1NC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000477619957 932734754 /nfs/dbraw/zinc/73/47/54/932734754.db2.gz BTKAVTQJUUJRSM-UHFFFAOYSA-N 0 0 363.801 3.929 20 5 FHBDRN CCc1csc(NC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])n1 ZINC000477619898 932734865 /nfs/dbraw/zinc/73/48/65/932734865.db2.gz BLGFQGZZEALLIW-UHFFFAOYSA-N 0 0 354.819 3.631 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)NCCN1c2ccccc2C[C@@H]1C ZINC000477618951 932735423 /nfs/dbraw/zinc/73/54/23/932735423.db2.gz BCUBDBWSANUHHN-ZDUSSCGKSA-N 0 0 373.840 3.738 20 5 FHBDRN CC(C)c1ccc(C(=O)N2CCS[C@H]2c2ccc([N+](=O)[O-])cc2)c(=O)[nH]1 ZINC000933505609 932739559 /nfs/dbraw/zinc/73/95/59/932739559.db2.gz ZBUXNWJJRZAZLX-SFHVURJKSA-N 0 0 373.434 3.707 20 5 FHBDRN C[C@@H](NCCOc1cccc([N+](=O)[O-])c1)c1nc(C(F)(F)F)cs1 ZINC000490053596 932753607 /nfs/dbraw/zinc/75/36/07/932753607.db2.gz KJLMRLXMKMLRFA-SECBINFHSA-N 0 0 361.345 3.800 20 5 FHBDRN COc1ccc([C@H]2CCCN2Cc2ccc(OC)c([N+](=O)[O-])c2)c(OC)c1 ZINC000051260306 932760347 /nfs/dbraw/zinc/76/03/47/932760347.db2.gz FSRWMAXGKIKVOZ-QGZVFWFLSA-N 0 0 372.421 3.958 20 5 FHBDRN COc1ccc(N(C(=O)c2cccc([N+](=O)[O-])c2N)[C@H](C)C2CC2)cc1 ZINC000178184098 932798785 /nfs/dbraw/zinc/79/87/85/932798785.db2.gz KNMCCUJCJCWXAQ-GFCCVEGCSA-N 0 0 355.394 3.631 20 5 FHBDRN CC[C@H](OC(=O)C1CCN(CC(F)F)CC1)c1cccc([N+](=O)[O-])c1 ZINC001266835535 932810920 /nfs/dbraw/zinc/81/09/20/932810920.db2.gz HAZZHHUQGNIHTK-HNNXBMFYSA-N 0 0 356.369 3.566 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])C1(CCOCc2ccccc2)CC1 ZINC000471762550 932831021 /nfs/dbraw/zinc/83/10/21/932831021.db2.gz XBXQNDKYQZTWHI-UHFFFAOYSA-N 0 0 354.406 3.598 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(N2CCC([C@@H](O)c3ccc(Cl)cc3)CC2)n1 ZINC000178220849 932908477 /nfs/dbraw/zinc/90/84/77/932908477.db2.gz ZLMQAXNBYMNIKB-KRWDZBQOSA-N 0 0 361.829 3.902 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)NCCc1cn(C)c2cc(F)ccc12 ZINC000187476556 932910080 /nfs/dbraw/zinc/91/00/80/932910080.db2.gz IZUIOCMTKSQZOK-UHFFFAOYSA-N 0 0 355.369 3.507 20 5 FHBDRN Cc1c(C(=O)N(C)Cc2ccccc2[N+](=O)[O-])cnn1-c1ccccc1C ZINC000043770423 932922597 /nfs/dbraw/zinc/92/25/97/932922597.db2.gz WSJFARZIMRWMCZ-UHFFFAOYSA-N 0 0 364.405 3.670 20 5 FHBDRN COc1ccc(NC(C)=O)cc1NC(=O)/C(C)=C\c1ccc([N+](=O)[O-])cc1 ZINC000588435478 932930655 /nfs/dbraw/zinc/93/06/55/932930655.db2.gz SPQKPAFYWIQJGR-BENRWUELSA-N 0 0 369.377 3.604 20 5 FHBDRN C[C@@H]1COCC[C@@H]1c1noc(CCc2c(Cl)cccc2[N+](=O)[O-])n1 ZINC000924052649 932933447 /nfs/dbraw/zinc/93/34/47/932933447.db2.gz MZXQEEGPLFSQEH-MNOVXSKESA-N 0 0 351.790 3.556 20 5 FHBDRN O=C(NCc1cccc([N+](=O)[O-])c1)N1CC[C@H](CSc2ccccc2)C1 ZINC000175974779 932941586 /nfs/dbraw/zinc/94/15/86/932941586.db2.gz IADBWGNWGYWJQP-INIZCTEOSA-N 0 0 371.462 3.919 20 5 FHBDRN COc1ccccc1[C@@H]1CCCCN1C(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-] ZINC000610922387 932948878 /nfs/dbraw/zinc/94/88/78/932948878.db2.gz RZDCSTBEYJQHJV-AWEZNQCLSA-N 0 0 372.425 3.817 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc2c(c1)CCC(=O)N2 ZINC000588436694 932958533 /nfs/dbraw/zinc/95/85/33/932958533.db2.gz ADDGVBDCFOFTAW-BENRWUELSA-N 0 0 351.362 3.522 20 5 FHBDRN O=c1c2cc3ccccc3cc2ncn1C[C@H](O)c1cc(F)ccc1F ZINC000051288509 932969463 /nfs/dbraw/zinc/96/94/63/932969463.db2.gz HGEPKAJXNUFZQG-IBGZPJMESA-N 0 0 352.340 3.562 20 5 FHBDRN Cc1cc(OCC(=O)N(C)Cc2cc3ccccc3o2)ccc1[N+](=O)[O-] ZINC000430689346 932976727 /nfs/dbraw/zinc/97/67/27/932976727.db2.gz BXMCDFQLKHXGDA-UHFFFAOYSA-N 0 0 354.362 3.687 20 5 FHBDRN O=[N+]([O-])c1cnn(CCSCc2cc(Cl)ccc2OC(F)F)c1 ZINC000610946678 932995148 /nfs/dbraw/zinc/99/51/48/932995148.db2.gz RZELQHDRGYOOLX-UHFFFAOYSA-N 0 0 363.773 3.980 20 5 FHBDRN Cc1ccc(NC(=O)c2ccc(N3CCCOC[C@H]3C)c([N+](=O)[O-])c2)cc1 ZINC000610946615 932997955 /nfs/dbraw/zinc/99/79/55/932997955.db2.gz QKROZZZBRDVMSQ-OAHLLOKOSA-N 0 0 369.421 3.771 20 5 FHBDRN Cc1cccc(N(CCC(N)=O)C(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)c1 ZINC000187553695 933001148 /nfs/dbraw/zinc/00/11/48/933001148.db2.gz LRJJGMKMIIBLQH-UHFFFAOYSA-N 0 0 369.421 3.549 20 5 FHBDRN CC(C)c1ccc(C(=O)Nc2nc3c(s2)C(=O)CCC3)cc1[N+](=O)[O-] ZINC000187554263 933002504 /nfs/dbraw/zinc/00/25/04/933002504.db2.gz VTCFRMCMGIBUDN-UHFFFAOYSA-N 0 0 359.407 3.946 20 5 FHBDRN CC(F)(F)c1cccc(NCC(=O)N2CCc3cc([N+](=O)[O-])ccc32)c1 ZINC000187576751 933010283 /nfs/dbraw/zinc/01/02/83/933010283.db2.gz OZTIIFJPMHXLFB-UHFFFAOYSA-N 0 0 361.348 3.708 20 5 FHBDRN CCOCCC1(CNC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)CCCC1 ZINC000471822612 933050343 /nfs/dbraw/zinc/05/03/43/933050343.db2.gz OIRXYNMRCQHBJX-UHFFFAOYSA-N 0 0 373.453 3.653 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)Nc1sccc1C(=O)NC1CC1 ZINC000588437569 933052447 /nfs/dbraw/zinc/05/24/47/933052447.db2.gz CWCAYKZPNYGIAD-KHPPLWFESA-N 0 0 371.418 3.591 20 5 FHBDRN CCCNC(=O)c1ccc(NC(=O)/C(C)=C\c2ccc([N+](=O)[O-])cc2)cc1 ZINC000588437595 933053432 /nfs/dbraw/zinc/05/34/32/933053432.db2.gz CLRZTMHCGGAVTI-YPKPFQOOSA-N 0 0 367.405 3.777 20 5 FHBDRN CCOc1cc(N2CCC[C@H]2c2nc3c([nH]2)CCCC3)ccc1[N+](=O)[O-] ZINC000548346104 933056268 /nfs/dbraw/zinc/05/62/68/933056268.db2.gz AEWQKJMNVOPIJY-KRWDZBQOSA-N 0 0 356.426 3.937 20 5 FHBDRN CCNC(=O)c1ccc(NC(=O)/C(C)=C\c2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000588438035 933057050 /nfs/dbraw/zinc/05/70/50/933057050.db2.gz IQEJZEZTIJSGHC-KAMYIIQDSA-N 0 0 367.405 3.695 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(C[S@@](C)=O)c1 ZINC000588438759 933057612 /nfs/dbraw/zinc/05/76/12/933057612.db2.gz LEQACDBMCGUJIU-RPIOBPNHSA-N 0 0 358.419 3.515 20 5 FHBDRN CCc1ccc([C@H]2COCCN2C(=O)/C(C)=C\c2ccc([N+](=O)[O-])cc2)o1 ZINC000588439065 933061490 /nfs/dbraw/zinc/06/14/90/933061490.db2.gz GNHOSVFRMOGJGZ-RXXLQFRUSA-N 0 0 370.405 3.754 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(C)c(C(=O)N(C)C)c1 ZINC000588439963 933068468 /nfs/dbraw/zinc/06/84/68/933068468.db2.gz KQAUZAAXUAXBAD-KAMYIIQDSA-N 0 0 367.405 3.647 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N(C)Cc1cccc(N(C)C)c1 ZINC000588440693 933071458 /nfs/dbraw/zinc/07/14/58/933071458.db2.gz OMIMNYLJGARKGO-QINSGFPZSA-N 0 0 353.422 3.723 20 5 FHBDRN CC(C)(C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)c1cccnc1 ZINC000581963444 933121974 /nfs/dbraw/zinc/12/19/74/933121974.db2.gz BGGCFKLJJUXVHC-UHFFFAOYSA-N 0 0 353.300 3.925 20 5 FHBDRN CSCc1ccccc1NC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000581966875 933132466 /nfs/dbraw/zinc/13/24/66/933132466.db2.gz UUCFGVSRNOSWDD-UHFFFAOYSA-N 0 0 352.362 3.917 20 5 FHBDRN CCN(C[C@H](O)c1ccc(C)cc1)C(=O)/C(C)=C\c1ccc([N+](=O)[O-])cc1 ZINC000588446322 933154921 /nfs/dbraw/zinc/15/49/21/933154921.db2.gz XFJRHKBYWXBLDO-JDQHYLEWSA-N 0 0 368.433 3.889 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H](C[C@@H](C)O)c1ccccc1 ZINC000588446563 933162888 /nfs/dbraw/zinc/16/28/88/933162888.db2.gz NLRSXJILUDJXSF-ODZJZLKASA-N 0 0 368.433 3.669 20 5 FHBDRN COc1ccc(CCC(=O)N2CCS[C@H]2c2ccc([N+](=O)[O-])cc2)cc1 ZINC000581976097 933167408 /nfs/dbraw/zinc/16/74/08/933167408.db2.gz OTECYOFSUAQYTF-IBGZPJMESA-N 0 0 372.446 3.810 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)NCc1nc2cccc(C)c2n1C ZINC000588446790 933169009 /nfs/dbraw/zinc/16/90/09/933169009.db2.gz UYQYWZMZKRIKFC-KAMYIIQDSA-N 0 0 364.405 3.510 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N1CC[C@@H](c2ccccc2C)C1 ZINC000510545723 933210504 /nfs/dbraw/zinc/21/05/04/933210504.db2.gz MJRCLRRLEKQUMQ-OAHLLOKOSA-N 0 0 369.421 3.611 20 5 FHBDRN Cc1cc(OCC(=O)N[C@H](C)c2ccc3ncsc3c2)ccc1[N+](=O)[O-] ZINC000430787792 933231064 /nfs/dbraw/zinc/23/10/64/933231064.db2.gz JEFUMKPPHOBTRG-GFCCVEGCSA-N 0 0 371.418 3.769 20 5 FHBDRN O=C(NCCc1ccccc1[N+](=O)[O-])N[C@H](c1ccccc1)C(F)(F)F ZINC000548383377 933231174 /nfs/dbraw/zinc/23/11/74/933231174.db2.gz YAPHRBZXUUZISL-OAHLLOKOSA-N 0 0 367.327 3.740 20 5 FHBDRN C[C@@H]1CCCC[C@@H]1CCNC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000510574231 933239098 /nfs/dbraw/zinc/23/90/98/933239098.db2.gz RYHNXSOBYVJYCI-HUUCEWRRSA-N 0 0 356.426 3.727 20 5 FHBDRN Cc1noc(-c2ccccc2)c1NC(=O)COc1ccc([N+](=O)[O-])c(C)c1 ZINC000430789418 933239582 /nfs/dbraw/zinc/23/95/82/933239582.db2.gz UEAMVAKAVMYCFI-UHFFFAOYSA-N 0 0 367.361 3.884 20 5 FHBDRN Cc1cc(OCC(=O)Nc2ccc(C(=O)C3CCC3)cc2)ccc1[N+](=O)[O-] ZINC000430797749 933245784 /nfs/dbraw/zinc/24/57/84/933245784.db2.gz QAJFJJIGQOSSOO-UHFFFAOYSA-N 0 0 368.389 3.904 20 5 FHBDRN CCOc1cc(C(=O)NCC[C@H]2CCCC[C@H]2C)c([N+](=O)[O-])cc1OC ZINC000510587496 933249872 /nfs/dbraw/zinc/24/98/72/933249872.db2.gz HBXZZJUQRYXXQI-ZIAGYGMSSA-N 0 0 364.442 3.948 20 5 FHBDRN Cc1cc(OCC(=O)Nc2cc(C3CCCCC3)nn2C)ccc1[N+](=O)[O-] ZINC000430814639 933257305 /nfs/dbraw/zinc/25/73/05/933257305.db2.gz JNGQHTMPHMCBFG-UHFFFAOYSA-N 0 0 372.425 3.702 20 5 FHBDRN O=C(CSc1ccccc1[N+](=O)[O-])NCc1c(F)cc(F)c(F)c1F ZINC000430815462 933257899 /nfs/dbraw/zinc/25/78/99/933257899.db2.gz QGFCGCPJFPBRJW-UHFFFAOYSA-N 0 0 374.315 3.560 20 5 FHBDRN Cc1c(CNC(=O)CO[C@H]2CCCc3ccccc32)cccc1[N+](=O)[O-] ZINC000430830105 933275772 /nfs/dbraw/zinc/27/57/72/933275772.db2.gz KTWWAOIJZNDPCY-IBGZPJMESA-N 0 0 354.406 3.614 20 5 FHBDRN O=C(Nc1cccc2c1CCO2)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000477737363 933280441 /nfs/dbraw/zinc/28/04/41/933280441.db2.gz FXTFWANMDCCIFB-UHFFFAOYSA-N 0 0 367.386 3.906 20 5 FHBDRN Cc1cc(OCC(=O)N[C@H]2CC[C@H](c3ccccc3F)C2)ccc1[N+](=O)[O-] ZINC000430838696 933287916 /nfs/dbraw/zinc/28/79/16/933287916.db2.gz PMGFOSXUMTWRIO-GJZGRUSLSA-N 0 0 372.396 3.874 20 5 FHBDRN Cc1cc(OCC(=O)N2C[C@H](C)Sc3ccccc32)ccc1[N+](=O)[O-] ZINC000430838219 933297705 /nfs/dbraw/zinc/29/77/05/933297705.db2.gz JRROYAHMEFZPFG-ZDUSSCGKSA-N 0 0 358.419 3.809 20 5 FHBDRN CCc1cc(NCCCc2nccs2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000510624355 933311882 /nfs/dbraw/zinc/31/18/82/933311882.db2.gz ZAQVVYLIMXCDIZ-UHFFFAOYSA-N 0 0 369.450 3.537 20 5 FHBDRN C[C@H](c1cccc([N+](=O)[O-])c1)N1C(=O)CN(Cc2ccc(Cl)cc2)C1=O ZINC000430849531 933315133 /nfs/dbraw/zinc/31/51/33/933315133.db2.gz GVTCFBJUQCJCRZ-GFCCVEGCSA-N 0 0 373.796 3.774 20 5 FHBDRN O=C(Nc1cccc2c1CCO2)c1ccc(Br)cc1[N+](=O)[O-] ZINC000477749489 933321099 /nfs/dbraw/zinc/32/10/99/933321099.db2.gz ZGTSEFVJXWLYOE-UHFFFAOYSA-N 0 0 363.167 3.545 20 5 FHBDRN C[C@H](c1ccccc1)N1CC(=O)N([C@H](C)c2cccc([N+](=O)[O-])c2)C1=O ZINC000430856608 933326962 /nfs/dbraw/zinc/32/69/62/933326962.db2.gz GPZSEUVWFXGYIQ-ZIAGYGMSSA-N 0 0 353.378 3.681 20 5 FHBDRN COc1ccc(-c2ccc(CN3CCO[C@H]4CCC[C@H]43)o2)c([N+](=O)[O-])c1 ZINC000430876945 933343920 /nfs/dbraw/zinc/34/39/20/933343920.db2.gz UBQRXOPFDIWEES-APWZRJJASA-N 0 0 358.394 3.617 20 5 FHBDRN CN(C(=O)c1csc(Cc2ccccc2)n1)c1cccc([N+](=O)[O-])c1 ZINC000158006389 933359350 /nfs/dbraw/zinc/35/93/50/933359350.db2.gz FHFNUIZYURBRSS-UHFFFAOYSA-N 0 0 353.403 3.919 20 5 FHBDRN CC1(c2ccccc2)CCN(C(=O)CCOc2ccccc2[N+](=O)[O-])CC1 ZINC000510660815 933377386 /nfs/dbraw/zinc/37/73/86/933377386.db2.gz ZZQNULULCMQRFT-UHFFFAOYSA-N 0 0 368.433 3.944 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N(Cc1ccccc1)CC(C)(C)O ZINC000588448488 933434959 /nfs/dbraw/zinc/43/49/59/933434959.db2.gz NRNWWVROBXOCMH-SSZFMOIBSA-N 0 0 368.433 3.798 20 5 FHBDRN CC1(c2ccccc2)CCN(C(=O)COc2ccc([N+](=O)[O-])cc2)CC1 ZINC000510696486 933435626 /nfs/dbraw/zinc/43/56/26/933435626.db2.gz AQRNGWCCTFRAII-UHFFFAOYSA-N 0 0 354.406 3.554 20 5 FHBDRN CN(C(=O)CSc1ccc([N+](=O)[O-])cc1)[C@@H]1CCc2ccccc2C1 ZINC000510700902 933459085 /nfs/dbraw/zinc/45/90/85/933459085.db2.gz FEOVDTLMSRAKCH-QGZVFWFLSA-N 0 0 356.447 3.703 20 5 FHBDRN Cc1ccc(-c2nc(C(=O)Nc3cc([N+](=O)[O-])ccc3C)cs2)n1C ZINC000121584488 933466166 /nfs/dbraw/zinc/46/61/66/933466166.db2.gz FFOJAKGFNJPYDM-UHFFFAOYSA-N 0 0 356.407 3.926 20 5 FHBDRN CC(=O)c1cccc(O[C@@H](C)C(=O)NC(C)(C)c2ccccc2[N+](=O)[O-])c1 ZINC000561693777 933475883 /nfs/dbraw/zinc/47/58/83/933475883.db2.gz TURJFKHQBJCSDI-AWEZNQCLSA-N 0 0 370.405 3.616 20 5 FHBDRN Cc1cc(C(=O)N2C[C@@H](C(F)(F)F)[C@H](C(F)(F)F)C2)cc([N+](=O)[O-])c1 ZINC000610597980 933484099 /nfs/dbraw/zinc/48/40/99/933484099.db2.gz NDPKMNKVLHUGDD-GHMZBOCLSA-N 0 0 370.249 3.716 20 5 FHBDRN Cc1cccc(C(=O)N2C[C@H](C(F)(F)F)[C@H](C(F)(F)F)C2)c1[N+](=O)[O-] ZINC000610597892 933484342 /nfs/dbraw/zinc/48/43/42/933484342.db2.gz JHCMPBIJONXWFF-AOOOYVTPSA-N 0 0 370.249 3.716 20 5 FHBDRN CCOc1cc(CNC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)ccc1OC ZINC000510709504 933496158 /nfs/dbraw/zinc/49/61/58/933496158.db2.gz NQZRCZXHWQKBQH-UHFFFAOYSA-N 0 0 370.361 3.678 20 5 FHBDRN CC1=C(C)CN(C(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CC1 ZINC000430961435 933507850 /nfs/dbraw/zinc/50/78/50/933507850.db2.gz DFOHBVPTRCOAIL-UHFFFAOYSA-N 0 0 357.332 3.865 20 5 FHBDRN CN(C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)[C@H]1CCc2ccccc2C1 ZINC000510721611 933527340 /nfs/dbraw/zinc/52/73/40/933527340.db2.gz ZQGNGCVTOHRANS-SFHVURJKSA-N 0 0 365.433 3.799 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)c2cc3c([nH]c2=O)CCCCC3)cc1[N+](=O)[O-] ZINC000610620909 933539641 /nfs/dbraw/zinc/53/96/41/933539641.db2.gz ZURLINVBOSGHQA-ZDUSSCGKSA-N 0 0 369.421 3.764 20 5 FHBDRN Cc1nn(C(C)(C)C)c(C)c1C(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000610625680 933546072 /nfs/dbraw/zinc/54/60/72/933546072.db2.gz GSTDJRBQYBMWOP-GFCCVEGCSA-N 0 0 358.442 3.963 20 5 FHBDRN O=C(NCCc1ccccc1[N+](=O)[O-])C1(c2ccc(F)cc2F)CCC1 ZINC000548418390 933573706 /nfs/dbraw/zinc/57/37/06/933573706.db2.gz UIRLYHWYDZXAKR-UHFFFAOYSA-N 0 0 360.360 3.654 20 5 FHBDRN Cc1ccccc1CC1CN(C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000610640182 933588491 /nfs/dbraw/zinc/58/84/91/933588491.db2.gz IBZVDLQBGYIYPB-OAHLLOKOSA-N 0 0 353.422 3.848 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N[C@H]1COc2c1cccc2Cl ZINC000611153672 933599319 /nfs/dbraw/zinc/59/93/19/933599319.db2.gz VUMYFGDEBNTYTN-INIZCTEOSA-N 0 0 371.780 3.522 20 5 FHBDRN CCc1ccc(C(=O)N[C@H](c2ccccc2)[C@H]2CCCO2)cc1[N+](=O)[O-] ZINC000471904886 933601986 /nfs/dbraw/zinc/60/19/86/933601986.db2.gz IDMQBZRSCBMBER-RTBURBONSA-N 0 0 354.406 3.807 20 5 FHBDRN C[C@@H](C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)N1[C@H](C)C[C@H]1C ZINC000548424984 933621718 /nfs/dbraw/zinc/62/17/18/933621718.db2.gz 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O=C(NCc1ccc(OC2CCCC2)cc1)c1ccc(F)cc1[N+](=O)[O-] ZINC000551357857 935264863 /nfs/dbraw/zinc/26/48/63/935264863.db2.gz NCKXPWQEEQGMOH-UHFFFAOYSA-N 0 0 358.369 3.985 20 5 FHBDRN COc1ccc(COc2nc(-c3ccccc3Cl)no2)cc1[N+](=O)[O-] ZINC000072068244 935270684 /nfs/dbraw/zinc/27/06/84/935270684.db2.gz WUECMMIZHINKRW-UHFFFAOYSA-N 0 0 361.741 3.886 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)NC1(c2ccc(OC)cc2)CC1 ZINC000439916591 945089159 /nfs/dbraw/zinc/08/91/59/945089159.db2.gz QMCMKCZSEMUZSY-UHFFFAOYSA-N 0 0 371.393 3.813 20 5 FHBDRN Cc1cc(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)n(C)n1 ZINC000551585208 935313479 /nfs/dbraw/zinc/31/34/79/935313479.db2.gz RCPZJSSMWOIXFO-UHFFFAOYSA-N 0 0 360.801 3.840 20 5 FHBDRN CCO[C@@H]1C[C@H](NC(=O)C(C)(C)c2ccccc2[N+](=O)[O-])C12CCCC2 ZINC000551598961 935317359 /nfs/dbraw/zinc/31/73/59/935317359.db2.gz JFPDKPZIGBEVNM-DLBZAZTESA-N 0 0 360.454 3.726 20 5 FHBDRN O=C(Cc1cccc([N+](=O)[O-])c1)Nc1cc(F)c(OC(F)F)cc1F ZINC000468216583 935322476 /nfs/dbraw/zinc/32/24/76/935322476.db2.gz SQMAWXJHMPHKKV-UHFFFAOYSA-N 0 0 358.247 3.656 20 5 FHBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CC[C@H]1Cc1ccccc1 ZINC000472178776 935325602 /nfs/dbraw/zinc/32/56/02/935325602.db2.gz ZPNSCIWJMRALIY-BBRMVZONSA-N 0 0 374.824 3.859 20 5 FHBDRN O=[N+]([O-])c1ccc([C@H](NCc2cnc3n2CCCC3)C(F)(F)F)cc1 ZINC000563263421 935326162 /nfs/dbraw/zinc/32/61/62/935326162.db2.gz FURPHOHSPAQNDO-HNNXBMFYSA-N 0 0 354.332 3.521 20 5 FHBDRN Cc1oc2ccccc2c1CC(=O)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000582138352 935329547 /nfs/dbraw/zinc/32/95/47/935329547.db2.gz JINYYJFMZNPESK-UHFFFAOYSA-N 0 0 352.390 3.893 20 5 FHBDRN CC(C)(NC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2)c1ccc(Cl)cc1 ZINC000551695734 935331137 /nfs/dbraw/zinc/33/11/37/935331137.db2.gz DPQXANTURZXYAT-UHFFFAOYSA-N 0 0 362.769 3.642 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)C(C)(C)c2ccc3c(c2)OCO3)cc1[N+](=O)[O-] ZINC000551739423 935335674 /nfs/dbraw/zinc/33/56/74/935335674.db2.gz AZWRFVKWFXBJDU-ZDUSSCGKSA-N 0 0 370.405 3.787 20 5 FHBDRN CCCOc1ccccc1NC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000124061158 945095645 /nfs/dbraw/zinc/09/56/45/945095645.db2.gz NCDGBVDYZDIFOJ-UHFFFAOYSA-N 0 0 355.394 3.974 20 5 FHBDRN Cc1cc(C(=O)N2CCC[C@@H](n3ccnc3C(C)C)C2)ccc1[N+](=O)[O-] ZINC000370873310 935381628 /nfs/dbraw/zinc/38/16/28/935381628.db2.gz UMCIKEJGRCXZMY-MRXNPFEDSA-N 0 0 356.426 3.700 20 5 FHBDRN O=C(Nc1cc(Br)cc([N+](=O)[O-])c1)c1cnc(C2CC2)s1 ZINC000551969809 935386449 /nfs/dbraw/zinc/38/64/49/935386449.db2.gz FOUCYPGVCDXXJI-UHFFFAOYSA-N 0 0 368.212 3.944 20 5 FHBDRN Cc1sc(C(=O)N2CCC[C@H](n3ccnc3C(C)C)C2)cc1[N+](=O)[O-] ZINC000370877213 935392635 /nfs/dbraw/zinc/39/26/35/935392635.db2.gz RHFCSUADUJGXLL-ZDUSSCGKSA-N 0 0 362.455 3.762 20 5 FHBDRN Cc1cccc(Oc2ccc(NC(=O)c3cc([N+](=O)[O-])nn3C)cc2)c1 ZINC000478044923 935423505 /nfs/dbraw/zinc/42/35/05/935423505.db2.gz ZSCKMMSHSTYRTB-UHFFFAOYSA-N 0 0 352.350 3.681 20 5 FHBDRN COc1ccc2c(c1)N(C(=O)[C@H](C)c1cccc([N+](=O)[O-])c1)C[C@@H](C)O2 ZINC000582278415 935474683 /nfs/dbraw/zinc/47/46/83/935474683.db2.gz KACLWRVJLCPLKT-CHWSQXEVSA-N 0 0 356.378 3.521 20 5 FHBDRN C[C@H](Cc1ccc(O)cc1)N(C)C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000120046778 935493494 /nfs/dbraw/zinc/49/34/94/935493494.db2.gz AYSLYWWZNUJFSE-CYBMUJFWSA-N 0 0 369.421 3.578 20 5 FHBDRN Cc1c(Cl)cc(S(=O)(=O)N(C(C)C)C2CCCC2)cc1[N+](=O)[O-] ZINC000110794647 945104727 /nfs/dbraw/zinc/10/47/27/945104727.db2.gz MSSYFBDFBIRAAZ-UHFFFAOYSA-N 0 0 360.863 3.898 20 5 FHBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N(C)CC[C@@H]1CCCO1 ZINC000468228277 935535655 /nfs/dbraw/zinc/53/56/55/935535655.db2.gz UJRVNVIYWASZQH-HNNXBMFYSA-N 0 0 366.483 3.984 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CC2(CCC2)[C@H]1c1ccco1 ZINC000451849653 935538968 /nfs/dbraw/zinc/53/89/68/935538968.db2.gz HQNBQWGZPMBTCG-GOSISDBHSA-N 0 0 355.394 3.662 20 5 FHBDRN COc1ccccc1C[C@H](C)N(C)C(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000582337804 935539137 /nfs/dbraw/zinc/53/91/37/935539137.db2.gz GGDDHEXWMZCYOT-GJZGRUSLSA-N 0 0 356.422 3.797 20 5 FHBDRN CCN(CCc1ccc(C(F)(F)F)cc1)C(=O)c1ccc([N+](=O)[O-])cn1 ZINC000582356325 935562018 /nfs/dbraw/zinc/56/20/18/935562018.db2.gz NQRIATCYQKGMHY-UHFFFAOYSA-N 0 0 367.327 3.713 20 5 FHBDRN Cc1ccc(C2(C(=O)N(C)c3cccc([N+](=O)[O-])c3)CCOCC2)cc1 ZINC000158445587 935568729 /nfs/dbraw/zinc/56/87/29/935568729.db2.gz DRCKMBMJAOHENG-UHFFFAOYSA-N 0 0 354.406 3.614 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)NCCCc1ccccc1F ZINC000478119187 935571241 /nfs/dbraw/zinc/57/12/41/935571241.db2.gz DNVCKOVRIGWNGB-UHFFFAOYSA-N 0 0 355.369 3.507 20 5 FHBDRN Cc1ccc(C)c(S(=O)(=O)N(C)Cc2ccc(Cl)s2)c1[N+](=O)[O-] ZINC000478162419 935581772 /nfs/dbraw/zinc/58/17/72/935581772.db2.gz INHONKREBNNSRA-UHFFFAOYSA-N 0 0 374.871 3.747 20 5 FHBDRN O=C(N[C@@H]1C[C@H]1c1ccc(OC(F)F)cc1)c1csc([N+](=O)[O-])c1 ZINC000478181949 935583782 /nfs/dbraw/zinc/58/37/82/935583782.db2.gz LVFJSCOIFGUMBV-NWDGAFQWSA-N 0 0 354.334 3.544 20 5 FHBDRN CN(C(=O)CCc1cccc(Br)c1)c1cccc([N+](=O)[O-])c1 ZINC000158135305 935588653 /nfs/dbraw/zinc/58/86/53/935588653.db2.gz CIMULMQYSIXZNY-UHFFFAOYSA-N 0 0 363.211 3.953 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1F)N[C@@H]1CC[C@@H](c2cccc(F)c2)C1 ZINC000478227099 935589307 /nfs/dbraw/zinc/58/93/07/935589307.db2.gz LVHRSJMYAPYCDX-CZUORRHYSA-N 0 0 360.360 3.868 20 5 FHBDRN COC(=O)c1cnc(NCCCSc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000478251574 935597120 /nfs/dbraw/zinc/59/71/20/935597120.db2.gz DITFETCOGZTCFF-UHFFFAOYSA-N 0 0 365.386 3.510 20 5 FHBDRN Nc1cccc([N+](=O)[O-])c1C(=O)N1CCC(c2cccc(Cl)c2)CC1 ZINC000478246118 935597183 /nfs/dbraw/zinc/59/71/83/935597183.db2.gz CZMDARXWWVTSOK-UHFFFAOYSA-N 0 0 359.813 3.850 20 5 FHBDRN CCn1c2cccc(F)c2nc1CN(C)CCc1ccccc1[N+](=O)[O-] ZINC000511108168 935599863 /nfs/dbraw/zinc/59/98/63/935599863.db2.gz MBLBJKBZSAATRI-UHFFFAOYSA-N 0 0 356.401 3.778 20 5 FHBDRN O=C(Nc1ccc2nc(-c3ccc(F)cc3)oc2c1)c1cc([N+](=O)[O-])n[nH]1 ZINC000511786563 945112280 /nfs/dbraw/zinc/11/22/80/945112280.db2.gz MYFZKAOWEKTCST-UHFFFAOYSA-N 0 0 367.296 3.518 20 5 FHBDRN COC(=O)c1coc(/C=C(/c2ccncc2)c2ccc([N+](=O)[O-])cc2)c1 ZINC000478338942 935615920 /nfs/dbraw/zinc/61/59/20/935615920.db2.gz AXQHEIZVJSJYRF-WOJGMQOQSA-N 0 0 350.330 3.958 20 5 FHBDRN Cc1ccccc1-c1noc(=O)n1Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000511111815 935621596 /nfs/dbraw/zinc/62/15/96/935621596.db2.gz ZZLMPVWGXVYIEB-UHFFFAOYSA-N 0 0 369.377 3.555 20 5 FHBDRN CO[C@H](c1noc(Cc2cccc([N+](=O)[O-])c2)n1)c1cccc(Cl)c1 ZINC000545066727 935628387 /nfs/dbraw/zinc/62/83/87/935628387.db2.gz XIJSQVLLUSSSQB-INIZCTEOSA-N 0 0 359.769 3.958 20 5 FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)NCC1C(C)(C)C1(C)C ZINC000478459276 935629982 /nfs/dbraw/zinc/62/99/82/935629982.db2.gz YNVMNVLPKGXUHO-UHFFFAOYSA-N 0 0 366.483 3.745 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CNc1ccccc1NC(C)(C)C ZINC000277577518 935631170 /nfs/dbraw/zinc/63/11/70/935631170.db2.gz UGXGQFPTUNIEES-UHFFFAOYSA-N 0 0 372.425 3.864 20 5 FHBDRN NC(=O)c1cccc(NC[C@H](Cc2ccccc2)C(F)(F)F)c1[N+](=O)[O-] ZINC000582393290 935633630 /nfs/dbraw/zinc/63/36/30/935633630.db2.gz WGLCRILZPOUXDR-LBPRGKRZSA-N 0 0 367.327 3.527 20 5 FHBDRN C[C@@H](C(=O)N[C@@H](C)CCc1ccc2c(c1)OCO2)c1cccc([N+](=O)[O-])c1 ZINC000582394651 935636029 /nfs/dbraw/zinc/63/60/29/935636029.db2.gz KULXHTOTPIGVMI-UONOGXRCSA-N 0 0 370.405 3.565 20 5 FHBDRN O=C(c1cc(N2CCC[C@@H]2c2ccccn2)ccc1[N+](=O)[O-])N1CCCC1 ZINC000582395865 935637288 /nfs/dbraw/zinc/63/72/88/935637288.db2.gz QEYOOSQVWQMJMS-LJQANCHMSA-N 0 0 366.421 3.567 20 5 FHBDRN C[C@H](NC(=O)NCCc1cccc2[nH]ccc21)c1cccc([N+](=O)[O-])c1 ZINC000507295532 945113746 /nfs/dbraw/zinc/11/37/46/945113746.db2.gz IAOOTMYEZUHWBS-ZDUSSCGKSA-N 0 0 352.394 3.679 20 5 FHBDRN O=C(c1cc2cc([N+](=O)[O-])ccc2o1)N(C[C@@H]1CCCO1)c1ccncc1 ZINC000511114404 935643812 /nfs/dbraw/zinc/64/38/12/935643812.db2.gz ICTATOOGCKBTPR-INIZCTEOSA-N 0 0 367.361 3.562 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)Nc2cc(F)c(F)c(F)c2)cc1OC ZINC000127600623 935647266 /nfs/dbraw/zinc/64/72/66/935647266.db2.gz UFZHPDDKDQJMRR-UHFFFAOYSA-N 0 0 370.283 3.672 20 5 FHBDRN CN(CC(=O)N[C@H]1C[C@H](c2ccc(Cl)cc2)C1)c1ccccc1[N+](=O)[O-] ZINC000478542127 935649766 /nfs/dbraw/zinc/64/97/66/935649766.db2.gz XLZTWKVZDVDHNO-KOMQPUFPSA-N 0 0 373.840 3.747 20 5 FHBDRN CCOC(=O)C1(N(C)C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)CCCCC1 ZINC000478640240 935669485 /nfs/dbraw/zinc/66/94/85/935669485.db2.gz JHSKLXAOOFQGPC-UHFFFAOYSA-N 0 0 368.817 3.586 20 5 FHBDRN CC(C)CCSc1ccc(C(=O)N(C)c2ccn(C)n2)cc1[N+](=O)[O-] ZINC000478651650 935675343 /nfs/dbraw/zinc/67/53/43/935675343.db2.gz WWCICJUPANPVGP-UHFFFAOYSA-N 0 0 362.455 3.743 20 5 FHBDRN COc1cccc(F)c1NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000478649899 935675910 /nfs/dbraw/zinc/67/59/10/935675910.db2.gz KRYLYHAZZMZRJO-UHFFFAOYSA-N 0 0 356.256 3.596 20 5 FHBDRN CC(C)c1ncc(NC(=O)c2ccc([N+](=O)[O-])cc2Br)cn1 ZINC000478659720 935677527 /nfs/dbraw/zinc/67/75/27/935677527.db2.gz BUKPHQAGHLXYBC-UHFFFAOYSA-N 0 0 365.187 3.523 20 5 FHBDRN CC(C)(C)OC(=O)CCCCOC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000785128806 935692123 /nfs/dbraw/zinc/69/21/23/935692123.db2.gz JEADXNOSMQPKOR-UHFFFAOYSA-N 0 0 362.382 3.745 20 5 FHBDRN O=[N+]([O-])c1ccc(Cc2noc(-c3cccc(C(F)(F)F)c3)n2)nc1 ZINC000545070030 935692147 /nfs/dbraw/zinc/69/21/47/935692147.db2.gz IYHQIIPLDZRRIH-UHFFFAOYSA-N 0 0 350.256 3.649 20 5 FHBDRN COc1ccc(NC(=O)[C@@H](C)SCCC(F)(F)F)c([N+](=O)[O-])c1 ZINC000478761038 935707770 /nfs/dbraw/zinc/70/77/70/935707770.db2.gz MBRBMQBHZACEPY-MRVPVSSYSA-N 0 0 352.334 3.616 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@@H]2COc3c2ccc(C)c3C)c1 ZINC000478777590 935717144 /nfs/dbraw/zinc/71/71/44/935717144.db2.gz YSFKVVYQQAGNHZ-MRXNPFEDSA-N 0 0 370.405 3.539 20 5 FHBDRN COc1ccncc1CNc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000431416237 935733420 /nfs/dbraw/zinc/73/34/20/935733420.db2.gz DDUTZVASHDVFRE-UHFFFAOYSA-N 0 0 363.373 3.842 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)N2CCC(C)(C3CC3)CC2)cc1SC ZINC000582457741 935734464 /nfs/dbraw/zinc/73/44/64/935734464.db2.gz DATZKLQTZAXHMQ-UHFFFAOYSA-N 0 0 364.467 3.978 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)OCc1cccc(OC)c1 ZINC000582454326 935734823 /nfs/dbraw/zinc/73/48/23/935734823.db2.gz VNLSZZQABUKBSG-ZDUSSCGKSA-N 0 0 374.393 3.546 20 5 FHBDRN C[C@@H](NC(=O)NC[C@H]1CCC2(CCCCC2)O1)c1cccc([N+](=O)[O-])c1 ZINC000478829073 935736181 /nfs/dbraw/zinc/73/61/81/935736181.db2.gz VRLIEZFAWZZLJP-RHSMWYFYSA-N 0 0 361.442 3.837 20 5 FHBDRN CN(C(=O)c1cccc(NC(=O)c2ccco2)c1)c1cccc([N+](=O)[O-])c1 ZINC000158346868 935744073 /nfs/dbraw/zinc/74/40/73/935744073.db2.gz ZZRGGTRIKKDKEV-UHFFFAOYSA-N 0 0 365.345 3.717 20 5 FHBDRN CC[C@@H](C)NC(=O)c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1 ZINC000127700906 935746305 /nfs/dbraw/zinc/74/63/05/935746305.db2.gz JRLUWCNHNVVPCA-MRVPVSSYSA-N 0 0 357.197 3.616 20 5 FHBDRN Cc1c2ccccc2oc1CNC(=O)NCc1cccc([N+](=O)[O-])c1C ZINC000478869371 935746763 /nfs/dbraw/zinc/74/67/63/935746763.db2.gz QNTYOYLYLUGTOT-UHFFFAOYSA-N 0 0 353.378 3.957 20 5 FHBDRN Cc1cc(C)n(-c2ccc(C(=O)N(C)c3cccc([N+](=O)[O-])c3)cc2F)n1 ZINC000158358061 935751115 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FHBDRN CC(C)CCOC1CCN(C(=O)c2cc(F)c([N+](=O)[O-])cc2F)CC1 ZINC000158963628 935776419 /nfs/dbraw/zinc/77/64/19/935776419.db2.gz JVXVWJLJHVLMDG-UHFFFAOYSA-N 0 0 356.369 3.540 20 5 FHBDRN O=C(NCc1cccnc1Oc1cccc(F)c1)c1ccc([N+](=O)[O-])s1 ZINC000479047952 935779087 /nfs/dbraw/zinc/77/90/87/935779087.db2.gz MNTSRLQNBOZWQU-UHFFFAOYSA-N 0 0 373.365 3.913 20 5 FHBDRN Cc1ccc(C)c(NC(=O)[C@@H](C)N(C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000511146017 935786183 /nfs/dbraw/zinc/78/61/83/935786183.db2.gz XPLBKCWZVCFFIS-MRXNPFEDSA-N 0 0 355.438 3.713 20 5 FHBDRN O=C(Nc1ccc(OCc2cccnc2)cc1)c1cc([N+](=O)[O-])ccc1F ZINC000728495213 935786406 /nfs/dbraw/zinc/78/64/06/935786406.db2.gz PNNGIZNMAAKLBV-UHFFFAOYSA-N 0 0 367.336 3.960 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(C(=O)Nc2ccc(C)c(C(=O)NC(C)C)c2)c1F ZINC000277656908 935787524 /nfs/dbraw/zinc/78/75/24/935787524.db2.gz LIOBZOAEFGBZBS-UHFFFAOYSA-N 0 0 373.384 3.741 20 5 FHBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)c1ccc2c(c1)CCC(=O)N2C ZINC000135113681 935790820 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FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1F)Nc1cnn(-c2ccc(Cl)cc2)c1 ZINC000479298970 935823707 /nfs/dbraw/zinc/82/37/07/935823707.db2.gz XGZCOFBIVNEPJM-UHFFFAOYSA-N 0 0 374.759 3.754 20 5 FHBDRN C[C@@H](CNC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12)COCc1ccccc1 ZINC000509574064 945126645 /nfs/dbraw/zinc/12/66/45/945126645.db2.gz IBUOQAHQBJVDGT-AWEZNQCLSA-N 0 0 367.405 3.659 20 5 FHBDRN CCn1nc(C)c([N+](=O)[O-])c1N(C)CCOc1ccc(C(F)(F)F)cc1 ZINC000479311616 935824602 /nfs/dbraw/zinc/82/46/02/935824602.db2.gz FBGADQUOWKCSNH-UHFFFAOYSA-N 0 0 372.347 3.654 20 5 FHBDRN COc1cc(CNCc2ccc(-c3ccccc3)o2)c([N+](=O)[O-])cc1O ZINC000509574426 945126740 /nfs/dbraw/zinc/12/67/40/945126740.db2.gz YARIWZZQJCTPRE-UHFFFAOYSA-N 0 0 354.362 3.859 20 5 FHBDRN CCCN(C(=O)c1ccc([N+](=O)[O-])c(OC)c1)[C@H]1CCCc2cccnc21 ZINC000479361453 935830657 /nfs/dbraw/zinc/83/06/57/935830657.db2.gz HHHSINONZVQPQV-KRWDZBQOSA-N 0 0 369.421 3.928 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N(Cc1ncc[nH]1)c1cccc(F)c1 ZINC000479381804 935833166 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FHBDRN CC(C)CN1CCN(C(=O)c2cccc3c(=O)c4ccccc4[nH]c23)CC1 ZINC000277729554 935864268 /nfs/dbraw/zinc/86/42/68/935864268.db2.gz HACBTUPHCJHNGI-UHFFFAOYSA-N 0 0 363.461 3.507 20 5 FHBDRN CO[C@@H](CNC(=O)CCc1cccc([N+](=O)[O-])c1)c1ccccc1Cl ZINC000121827939 935864798 /nfs/dbraw/zinc/86/47/98/935864798.db2.gz YHXAVBIPFFFCDH-KRWDZBQOSA-N 0 0 362.813 3.685 20 5 FHBDRN O=C(NC[C@@H](Cc1ccccc1)C(F)(F)F)c1ccc(F)cc1[N+](=O)[O-] ZINC000516692223 945129619 /nfs/dbraw/zinc/12/96/19/945129619.db2.gz GDELHHYCPHBGTA-GFCCVEGCSA-N 0 0 370.302 3.885 20 5 FHBDRN C[C@@H](C1CC1)N(C(=O)c1sc(Br)cc1[N+](=O)[O-])C1CC1 ZINC000277735397 935867499 /nfs/dbraw/zinc/86/74/99/935867499.db2.gz BNHXTEVLEWCUAM-ZETCQYMHSA-N 0 0 359.245 3.822 20 5 FHBDRN Cc1c(CC(=O)N[C@H]2CCOc3c(Cl)cccc32)cccc1[N+](=O)[O-] ZINC000178615217 935870343 /nfs/dbraw/zinc/87/03/43/935870343.db2.gz ZQTQOYYWLOOSER-HNNXBMFYSA-N 0 0 360.797 3.739 20 5 FHBDRN Cc1nc2c(s1)[C@H](N(C)c1ncnc3sc([N+](=O)[O-])cc31)CCC2 ZINC000582611362 935874293 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FHBDRN Cc1c(CNC(=O)N[C@H]2CCCOc3c(F)cccc32)cccc1[N+](=O)[O-] ZINC000479741337 935885884 /nfs/dbraw/zinc/88/58/84/935885884.db2.gz GWBPCZDQUVUBMJ-INIZCTEOSA-N 0 0 373.384 3.755 20 5 FHBDRN CC(C)(C(=O)NC[C@H]1[C@@H]2c3ccccc3C[C@H]12)c1ccccc1[N+](=O)[O-] ZINC000479780457 935889731 /nfs/dbraw/zinc/88/97/31/935889731.db2.gz JYUGBQVZURRLHL-GPMSIDNRSA-N 0 0 350.418 3.575 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1)N1CCC[C@@]2(C1)OCc1ccccc12 ZINC000479781950 935889901 /nfs/dbraw/zinc/88/99/01/935889901.db2.gz UZJDWDHVBFLKKN-IBGZPJMESA-N 0 0 353.378 3.648 20 5 FHBDRN O=C(COc1ccccc1[N+](=O)[O-])N[C@@H]1CC[C@@H](Cc2ccccc2)C1 ZINC000187771189 935894875 /nfs/dbraw/zinc/89/48/75/935894875.db2.gz BXHDMVJQAJNWJY-DLBZAZTESA-N 0 0 354.406 3.501 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)c1ccc(Cl)c2ncccc12 ZINC000509578278 945133109 /nfs/dbraw/zinc/13/31/09/945133109.db2.gz FMIHODULORUYJQ-UHFFFAOYSA-N 0 0 355.781 3.769 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccn(-c2ccccc2Cl)n1 ZINC000158702724 935920659 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FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CCC[C@@H]1Cc1ccccc1 ZINC000128073631 935938539 /nfs/dbraw/zinc/93/85/39/935938539.db2.gz KYGSKDZVYOQVJO-QGZVFWFLSA-N 0 0 363.417 3.852 20 5 FHBDRN Cc1ncc(C(=O)NCCc2ccccc2[N+](=O)[O-])c(Cl)c1Cl ZINC000548751486 935938850 /nfs/dbraw/zinc/93/88/50/935938850.db2.gz CEPAESJDRBAZHT-UHFFFAOYSA-N 0 0 354.193 3.578 20 5 FHBDRN CC1CCN(c2ccc(C(=O)N3CCC4(CCC4)C3)cc2[N+](=O)[O-])CC1 ZINC000158721622 935938870 /nfs/dbraw/zinc/93/88/70/935938870.db2.gz MTTSJWGIJSHCSK-UHFFFAOYSA-N 0 0 357.454 3.847 20 5 FHBDRN C[C@@H](OCCCNc1ncnc2ccc([N+](=O)[O-])cc21)c1ccccc1 ZINC000611700762 935939931 /nfs/dbraw/zinc/93/99/31/935939931.db2.gz VMOXRXAHGAVPQT-CQSZACIVSA-N 0 0 352.394 3.540 20 5 FHBDRN C[C@]1(CCc2ccccc2)CCN(CC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC001167599244 935945783 /nfs/dbraw/zinc/94/57/83/935945783.db2.gz RGPWVSPRXQBQDW-NRFANRHFSA-N 0 0 367.449 3.878 20 5 FHBDRN Cc1cc(F)cc(C(=O)Nc2cccc(NC(=O)C3CC3)c2)c1[N+](=O)[O-] ZINC000176733344 935951602 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FHBDRN CC[C@@H](NC(=O)CCc1nc(C2CCCC2)no1)c1cccc([N+](=O)[O-])c1 ZINC000135566000 935979062 /nfs/dbraw/zinc/97/90/62/935979062.db2.gz YVZLXORPLIOEMH-MRXNPFEDSA-N 0 0 372.425 3.836 20 5 FHBDRN CCOC(=O)c1cc(C(=O)N([C@H](C)[C@@H](C)CC)C2CC2)cc([N+](=O)[O-])c1 ZINC000519115771 945137718 /nfs/dbraw/zinc/13/77/18/945137718.db2.gz NDSNVMFOAVSFGM-QWHCGFSZSA-N 0 0 362.426 3.811 20 5 FHBDRN COc1ccc(C)cc1C1(CNc2cc(C)c([N+](=O)[O-])cn2)CCOCC1 ZINC000074742945 935987538 /nfs/dbraw/zinc/98/75/38/935987538.db2.gz XDOPSQDHEXZIIM-UHFFFAOYSA-N 0 0 371.437 3.776 20 5 FHBDRN COc1c(O)ccc(CNc2ccc(OCC(F)F)cc2)c1[N+](=O)[O-] ZINC000892290096 936003586 /nfs/dbraw/zinc/00/35/86/936003586.db2.gz JGRGKOHBROLHTH-UHFFFAOYSA-N 0 0 354.309 3.565 20 5 FHBDRN COC[C@H](NC(=O)c1ccc(Cl)cc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000075368038 936010169 /nfs/dbraw/zinc/01/01/69/936010169.db2.gz OUXIEFDWMVFRGG-AWEZNQCLSA-N 0 0 352.749 3.505 20 5 FHBDRN O=C1CCCCN1c1cccc(Nc2ncnc3ccc([N+](=O)[O-])cc32)c1 ZINC000611704178 936028531 /nfs/dbraw/zinc/02/85/31/936028531.db2.gz ZNTPHBCUZSSRMM-UHFFFAOYSA-N 0 0 363.377 3.799 20 5 FHBDRN COc1ccc([C@@H](OC)[C@@H](C)Nc2ncnc3ccc([N+](=O)[O-])cc32)cc1 ZINC000611714737 936032388 /nfs/dbraw/zinc/03/23/88/936032388.db2.gz ZPKDMZVDRDEXJL-XIKOKIGWSA-N 0 0 368.393 3.735 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2noc(-c3ccc(O[C@@H]4CCOC4)cc3)n2)s1 ZINC000516684154 945140611 /nfs/dbraw/zinc/14/06/11/945140611.db2.gz WIWLWSCFGMVTIN-GFCCVEGCSA-N 0 0 359.363 3.541 20 5 FHBDRN O=[N+]([O-])c1ccccc1OCCOc1ccc(OCC(F)(F)F)cc1 ZINC000611754432 936039080 /nfs/dbraw/zinc/03/90/80/936039080.db2.gz XVVMUZKNJGFSKC-UHFFFAOYSA-N 0 0 357.284 3.994 20 5 FHBDRN O=[N+]([O-])c1ccc2ncnc(N[C@H]3CCCN(c4ccccc4F)C3)c2c1 ZINC000611713212 936058475 /nfs/dbraw/zinc/05/84/75/936058475.db2.gz ZZHLUDNABMVMTM-ZDUSSCGKSA-N 0 0 367.384 3.758 20 5 FHBDRN Cc1ccncc1[C@H](C)N[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000611938876 936096653 /nfs/dbraw/zinc/09/66/53/936096653.db2.gz ASWMUDSAUAIFSL-STQMWFEESA-N 0 0 353.382 3.760 20 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/nfs/dbraw/zinc/16/39/07/936163907.db2.gz IEWYUNZZQFNFKP-UHFFFAOYSA-N 0 0 352.350 3.947 20 5 FHBDRN O=C([C@@H]1C[C@@]12CCc1ccccc12)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000178677367 936166840 /nfs/dbraw/zinc/16/68/40/936166840.db2.gz QKZZYPUNBWAAQU-SIKLNZKXSA-N 0 0 362.429 3.990 20 5 FHBDRN O=C([C@@H]1C[C@]12CCc1ccccc12)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000178677379 936167109 /nfs/dbraw/zinc/16/71/09/936167109.db2.gz QKZZYPUNBWAAQU-UGKGYDQZSA-N 0 0 362.429 3.990 20 5 FHBDRN CC[S@](=O)[C@H]1CCC[C@H](NC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000187838503 936170116 /nfs/dbraw/zinc/17/01/16/936170116.db2.gz BPVQMWUDFUPCHQ-XHQUFGICSA-N 0 0 366.483 3.528 20 5 FHBDRN O=[N+]([O-])c1cccc2c1ccnc2N1CCC[C@H](OCC(F)(F)F)C1 ZINC000582826357 936178627 /nfs/dbraw/zinc/17/86/27/936178627.db2.gz PNWSZIQFHWVMTG-NSHDSACASA-N 0 0 355.316 3.691 20 5 FHBDRN O=[N+]([O-])c1cccc2c1ccnc2N1CCC[C@@H](OCC(F)(F)F)C1 ZINC000582826356 936178770 /nfs/dbraw/zinc/17/87/70/936178770.db2.gz PNWSZIQFHWVMTG-LLVKDONJSA-N 0 0 355.316 3.691 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(N2C[C@@H](C)O[C@H](C)C2)cc1 ZINC000277922314 936185416 /nfs/dbraw/zinc/18/54/16/936185416.db2.gz FFRYZVRYTBRTDO-HUUCEWRRSA-N 0 0 369.421 3.769 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)Nc2cccc([S@@](C)=O)c2)cc1[N+](=O)[O-] ZINC000078584897 936212561 /nfs/dbraw/zinc/21/25/61/936212561.db2.gz NWSCCXKXWCCQGG-VDBVYFBLSA-N 0 0 361.423 3.523 20 5 FHBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])N1CC2(C1)CC(F)(F)C2 ZINC000612307960 936220851 /nfs/dbraw/zinc/22/08/51/936220851.db2.gz ICKLVZVQCNNTAX-UHFFFAOYSA-N 0 0 362.785 3.598 20 5 FHBDRN COc1cccc(CC2CCN(C(=O)Cc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000612335611 936226249 /nfs/dbraw/zinc/22/62/49/936226249.db2.gz ZFTXHZYCSGCGLF-UHFFFAOYSA-N 0 0 368.433 3.627 20 5 FHBDRN COc1ccc(-c2nnc(Sc3ncc(Cl)cc3[N+](=O)[O-])o2)cc1 ZINC000153524201 936239964 /nfs/dbraw/zinc/23/99/64/936239964.db2.gz SZDHDFYBTQYYML-UHFFFAOYSA-N 0 0 364.770 3.853 20 5 FHBDRN O=[N+]([O-])c1cccc2ncnc(NC[C@H]3CCCC[C@@H]3C(F)(F)F)c21 ZINC000612446897 936241490 /nfs/dbraw/zinc/24/14/90/936241490.db2.gz DUOVYYMBXLGRQM-MNOVXSKESA-N 0 0 354.332 3.741 20 5 FHBDRN COc1cc(C)c(CN(C)c2ncc(Cl)cc2[N+](=O)[O-])cc1OC ZINC000153528409 936243158 /nfs/dbraw/zinc/24/31/58/936243158.db2.gz YMRMXJKDNZOEAB-UHFFFAOYSA-N 0 0 351.790 3.605 20 5 FHBDRN Cc1ccc(CCNC(=O)CCCNc2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000065613853 936249627 /nfs/dbraw/zinc/24/96/27/936249627.db2.gz CHCIVVKVIBZOPD-UHFFFAOYSA-N 0 0 355.438 3.763 20 5 FHBDRN C[C@@H](C(=O)N(Cc1ccccc1)C[C@H]1CCCO1)c1cccc([N+](=O)[O-])c1 ZINC000582879702 936252067 /nfs/dbraw/zinc/25/20/67/936252067.db2.gz SDDYCLCHHPAJRF-OXQOHEQNSA-N 0 0 368.433 3.906 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])N1CCn2c(cc3cc(Cl)ccc32)C1 ZINC000427187993 945153213 /nfs/dbraw/zinc/15/32/13/945153213.db2.gz VLOIJGDAEOCQLT-UHFFFAOYSA-N 0 0 369.808 3.788 20 5 FHBDRN C[C@H](c1nnc(-c2ccccc2)o1)N1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000572891639 936276470 /nfs/dbraw/zinc/27/64/70/936276470.db2.gz LJEGGRSZJODKIF-CYBMUJFWSA-N 0 0 366.377 3.600 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)Nc1c[nH]nc1-c1ccccc1 ZINC000178703173 936277132 /nfs/dbraw/zinc/27/71/32/936277132.db2.gz DGXFMMZBDRIXRS-UHFFFAOYSA-N 0 0 365.393 3.816 20 5 FHBDRN Cc1nc2ccc(NC(=O)N3CCc4c(cccc4[N+](=O)[O-])C3)cc2o1 ZINC000124122130 945153552 /nfs/dbraw/zinc/15/35/52/945153552.db2.gz GNTPEMIZSLDMMC-UHFFFAOYSA-N 0 0 352.350 3.635 20 5 FHBDRN COc1ccc(C(=O)N2CCC[C@@]2(C)Cc2cccc(F)c2)cc1[N+](=O)[O-] ZINC000582907058 936280928 /nfs/dbraw/zinc/28/09/28/936280928.db2.gz SCPCVIFATOQOFT-FQEVSTJZSA-N 0 0 372.396 3.980 20 5 FHBDRN Cc1cn2c(n1)CN(c1cc(Cl)c(C(F)(F)F)cc1[N+](=O)[O-])CC2 ZINC000782374262 936297248 /nfs/dbraw/zinc/29/72/48/936297248.db2.gz NMZCLKAYFYBUGR-UHFFFAOYSA-N 0 0 360.723 3.792 20 5 FHBDRN C[C@H](C(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1)n1cnc2ccccc21 ZINC000178716264 936303692 /nfs/dbraw/zinc/30/36/92/936303692.db2.gz FRHIGNARUWTKMT-CQSZACIVSA-N 0 0 364.405 3.697 20 5 FHBDRN CC(C)CCn1nccc1NC(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000612676924 936305729 /nfs/dbraw/zinc/30/57/29/936305729.db2.gz QYERKFGOVLNLPD-CYBMUJFWSA-N 0 0 362.455 3.957 20 5 FHBDRN COc1cc(Nc2nc3c(cc2[N+](=O)[O-])CCCC3)ccc1NC(C)=O ZINC000519601193 945159564 /nfs/dbraw/zinc/15/95/64/945159564.db2.gz VIOKCNILGJUGGL-UHFFFAOYSA-N 0 0 356.382 3.579 20 5 FHBDRN Cc1nc(NC(=O)NCc2cccc([N+](=O)[O-])c2)sc1C(F)(F)F ZINC000583453191 938259762 /nfs/dbraw/zinc/25/97/62/938259762.db2.gz FMLYPVPKEMBMQM-UHFFFAOYSA-N 0 0 360.317 3.700 20 5 FHBDRN CCC[C@@]1(C(F)(F)F)CCCN1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000536035696 938262430 /nfs/dbraw/zinc/26/24/30/938262430.db2.gz MIANGMRBFWKDFH-INIZCTEOSA-N 0 0 373.375 3.755 20 5 FHBDRN Cc1c2cc(F)ccc2oc1C(=O)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000536041696 938268020 /nfs/dbraw/zinc/26/80/20/938268020.db2.gz JKABDJJIRQRKBX-UHFFFAOYSA-N 0 0 354.337 3.987 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N1CC(C)(C)CCC1(C)C ZINC001213169873 938268767 /nfs/dbraw/zinc/26/87/67/938268767.db2.gz QFGQRFPAYMERAE-UHFFFAOYSA-N 0 0 354.472 3.801 20 5 FHBDRN COc1cc(CN(Cc2ccccc2F)C2CC2)c([N+](=O)[O-])cc1OC ZINC000506734886 945161841 /nfs/dbraw/zinc/16/18/41/945161841.db2.gz LKLLLDKOZVWDKP-UHFFFAOYSA-N 0 0 360.385 3.916 20 5 FHBDRN CC[C@@H](NC(=O)c1cc2cnn(CC)c2nc1C)c1cccc([N+](=O)[O-])c1 ZINC000507349256 945162353 /nfs/dbraw/zinc/16/23/53/945162353.db2.gz PDPVUGWZIFKSOO-QGZVFWFLSA-N 0 0 367.409 3.549 20 5 FHBDRN O=C(CN1CCc2c1cccc2[N+](=O)[O-])Nc1cccc(Cl)c1Cl ZINC000536050899 938279696 /nfs/dbraw/zinc/27/96/96/938279696.db2.gz QOIRUEQGLLPKLZ-UHFFFAOYSA-N 0 0 366.204 3.903 20 5 FHBDRN COc1ccc(CN(C)Cc2ccc([N+](=O)[O-])cc2Cl)c(OC)c1 ZINC000611772987 938286101 /nfs/dbraw/zinc/28/61/01/938286101.db2.gz LRMVYCMDZBAQHZ-UHFFFAOYSA-N 0 0 350.802 3.897 20 5 FHBDRN CC(C)C[C@@H](CCO)CNC(=O)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000278292042 938287123 /nfs/dbraw/zinc/28/71/23/938287123.db2.gz ZXUZIPOFBGYVPM-OAHLLOKOSA-N 0 0 366.461 3.868 20 5 FHBDRN C[C@H](Nc1ccc([N+](=O)[O-])cc1F)c1ccc(OCC(=O)NC2CC2)cc1 ZINC000052411580 938289672 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FHBDRN O=[N+]([O-])c1cnc(C(F)(F)F)cc1Sc1nnc(NC2CC2)s1 ZINC000278337295 938316581 /nfs/dbraw/zinc/31/65/81/938316581.db2.gz ITGJSLAVDZBHND-UHFFFAOYSA-N 0 0 363.346 3.586 20 5 FHBDRN C[C@H](NS(=O)(=O)CCc1ccc([N+](=O)[O-])cc1)c1cc2ccccc2o1 ZINC000178934934 938319490 /nfs/dbraw/zinc/31/94/90/938319490.db2.gz QQDGKCZDTWSLLA-ZDUSSCGKSA-N 0 0 374.418 3.564 20 5 FHBDRN C[C@H](NS(=O)(=O)CCc1ccccc1[N+](=O)[O-])c1cc2ccccc2o1 ZINC000178934916 938319530 /nfs/dbraw/zinc/31/95/30/938319530.db2.gz YLFWITVTMVHWMR-ZDUSSCGKSA-N 0 0 374.418 3.564 20 5 FHBDRN COCc1ccc([C@H]2CCCN2c2cc(OC)c([N+](=O)[O-])cc2F)o1 ZINC000161709582 938328590 /nfs/dbraw/zinc/32/85/90/938328590.db2.gz QTVIKJBQLSJQMU-CYBMUJFWSA-N 0 0 350.346 3.823 20 5 FHBDRN COc1ccc([C@H](C)N(C)C(=O)NCCc2ccccc2[N+](=O)[O-])cc1 ZINC000075109368 938336547 /nfs/dbraw/zinc/33/65/47/938336547.db2.gz ISMXKKGUHLYDHF-AWEZNQCLSA-N 0 0 357.410 3.549 20 5 FHBDRN COc1ccccc1-c1cccc(NC(=O)c2c([N+](=O)[O-])c(C)nn2C)c1 ZINC000110925258 945167187 /nfs/dbraw/zinc/16/71/87/945167187.db2.gz XQEWHXZPENBVRB-UHFFFAOYSA-N 0 0 366.377 3.565 20 5 FHBDRN Cc1nccn1-c1ccc(CNc2ccc([N+](=O)[O-])c3cnccc23)cn1 ZINC000052510393 938353572 /nfs/dbraw/zinc/35/35/72/938353572.db2.gz GCJFDQZDJUGRKW-UHFFFAOYSA-N 0 0 360.377 3.644 20 5 FHBDRN COCc1ccccc1CNC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000163383945 938361669 /nfs/dbraw/zinc/36/16/69/938361669.db2.gz PLTYJSDPDBFKSO-UHFFFAOYSA-N 0 0 369.421 3.615 20 5 FHBDRN Cc1cc(NC(=O)[C@@H]2CCOc3ccccc32)c2cc([N+](=O)[O-])ccc2n1 ZINC000161843556 938370306 /nfs/dbraw/zinc/37/03/06/938370306.db2.gz UOMUZDOVAZIUAE-OAHLLOKOSA-N 0 0 363.373 3.956 20 5 FHBDRN COc1ccccc1N(C(C)C)S(=O)(=O)c1cccc([N+](=O)[O-])c1C ZINC000583722458 938375757 /nfs/dbraw/zinc/37/57/57/938375757.db2.gz XTYNEEXNVAVEPS-UHFFFAOYSA-N 0 0 364.423 3.516 20 5 FHBDRN CC[C@@H](CCO)NC(=O)c1cc([N+](=O)[O-])ccc1SC1CCCC1 ZINC000161854436 938379459 /nfs/dbraw/zinc/37/94/59/938379459.db2.gz ZDBUVADPBZDMON-LBPRGKRZSA-N 0 0 352.456 3.520 20 5 FHBDRN COc1cccc(C)c1NC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000583732401 938383479 /nfs/dbraw/zinc/38/34/79/938383479.db2.gz QQMQCEMRTOSTSR-UHFFFAOYSA-N 0 0 363.801 3.929 20 5 FHBDRN C[C@H](C(=O)Nc1cc(Cl)ccc1F)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000046599481 938396454 /nfs/dbraw/zinc/39/64/54/938396454.db2.gz UWBUKSJIEGQZFN-LLVKDONJSA-N 0 0 365.792 3.846 20 5 FHBDRN Cc1cnc(C2CCN(Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])CC2)s1 ZINC000278412166 938397726 /nfs/dbraw/zinc/39/77/26/938397726.db2.gz QEKUXVLOGRIEMZ-UHFFFAOYSA-N 0 0 362.411 3.648 20 5 FHBDRN COc1cc(Cl)c(NC(=O)NCCc2ccccc2[N+](=O)[O-])cc1C ZINC000583776514 938402564 /nfs/dbraw/zinc/40/25/64/938402564.db2.gz IONMKRRHAOJYDG-UHFFFAOYSA-N 0 0 363.801 3.929 20 5 FHBDRN CS[C@@H]1CCCCN([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000246979521 938424871 /nfs/dbraw/zinc/42/48/71/938424871.db2.gz VVIFPAPWOLEHKK-WCQYABFASA-N 0 0 371.890 3.793 20 5 FHBDRN Cc1c(CNC(=O)N(C)[C@@H](C)Cc2cccc(F)c2)cccc1[N+](=O)[O-] ZINC000458685959 938426597 /nfs/dbraw/zinc/42/65/97/938426597.db2.gz HNTVCNQLEKVOHY-ZDUSSCGKSA-N 0 0 359.401 3.815 20 5 FHBDRN CCc1ccc(C(=O)N2CCC(Oc3ccncc3C)CC2)cc1[N+](=O)[O-] ZINC000278436838 938427878 /nfs/dbraw/zinc/42/78/78/938427878.db2.gz VOBPBLFQUOVFIR-UHFFFAOYSA-N 0 0 369.421 3.544 20 5 FHBDRN CCS[C@@H]1CCCC[C@@H]1NC(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000427204046 945174079 /nfs/dbraw/zinc/17/40/79/945174079.db2.gz LNQSBJOCMGLAST-LSDHHAIUSA-N 0 0 354.497 3.867 20 5 FHBDRN O=[N+]([O-])c1cc(F)ccc1Nc1cnn(-c2cnc3ccccc3n2)c1 ZINC000536139077 938434626 /nfs/dbraw/zinc/43/46/26/938434626.db2.gz BTEZRJFQIDWIIZ-UHFFFAOYSA-N 0 0 350.313 3.606 20 5 FHBDRN COc1ccc(OC)c([C@H](C)NC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)c1 ZINC000052610654 938434918 /nfs/dbraw/zinc/43/49/18/938434918.db2.gz OYIDBROIZAPQBW-NSHDSACASA-N 0 0 369.377 3.584 20 5 FHBDRN C[C@H]1[C@@H](Cc2ccccc2)CCN1C(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000583835682 938441395 /nfs/dbraw/zinc/44/13/95/938441395.db2.gz PPMOVHJXQPUKTL-DZGCQCFKSA-N 0 0 374.387 3.895 20 5 FHBDRN CCOC(=O)[C@]1(NCc2ccc([N+](=O)[O-])cc2Cl)CCc2ccccc21 ZINC000611791375 938449135 /nfs/dbraw/zinc/44/91/35/938449135.db2.gz MKKSIIOTDVUKHC-IBGZPJMESA-N 0 0 374.824 3.743 20 5 FHBDRN O=[N+]([O-])c1ccc(CN2CCO[C@]3(CCc4ccccc43)C2)c(Cl)c1 ZINC000611792710 938454545 /nfs/dbraw/zinc/45/45/45/938454545.db2.gz NCUQPJLKINKFDY-LJQANCHMSA-N 0 0 358.825 3.922 20 5 FHBDRN O=C(c1ccc(F)cc1OC(F)F)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000161921988 938463260 /nfs/dbraw/zinc/46/32/60/938463260.db2.gz IGZYXECHCLVDKH-UHFFFAOYSA-N 0 0 366.295 3.928 20 5 FHBDRN COc1cc(N[C@@H](CO)c2ccc(C(F)(F)F)cc2)ccc1[N+](=O)[O-] ZINC000536154087 938463579 /nfs/dbraw/zinc/46/35/79/938463579.db2.gz CMFRANOFNGXXSY-ZDUSSCGKSA-N 0 0 356.300 3.768 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2CNc2ncccn2)cc1 ZINC000187932033 938480322 /nfs/dbraw/zinc/48/03/22/938480322.db2.gz QWIVBOOSNPDKKK-UHFFFAOYSA-N 0 0 372.388 3.850 20 5 FHBDRN C[C@H](CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)c1ccc(F)cc1 ZINC000536160305 938484590 /nfs/dbraw/zinc/48/45/90/938484590.db2.gz KSVVXWDOHLAOPT-GFCCVEGCSA-N 0 0 355.369 3.678 20 5 FHBDRN O=C(CCc1c(Cl)cccc1[N+](=O)[O-])N1CCC[C@H]1[C@H]1CCCC1=O ZINC000935142648 938501105 /nfs/dbraw/zinc/50/11/05/938501105.db2.gz MPJMRMGOTMPRSM-HIFRSBDPSA-N 0 0 364.829 3.541 20 5 FHBDRN O=C1CCCN1c1ccc(CNc2ccc([N+](=O)[O-])c3cnccc23)cc1 ZINC000052719898 938511678 /nfs/dbraw/zinc/51/16/78/938511678.db2.gz NDSBNSHKOQCERZ-UHFFFAOYSA-N 0 0 362.389 3.882 20 5 FHBDRN Cc1cc(OCC(=O)N2CCc3sccc3C2)c(Cl)cc1[N+](=O)[O-] ZINC000506423556 945182338 /nfs/dbraw/zinc/18/23/38/945182338.db2.gz RQTLBLMZIYBTAS-UHFFFAOYSA-N 0 0 366.826 3.582 20 5 FHBDRN O=[N+]([O-])c1c(NCc2cccc(N3CCOCC3)c2)ccc2ncccc21 ZINC000432141088 945182450 /nfs/dbraw/zinc/18/24/50/945182450.db2.gz UGHHIBCUYIODNE-UHFFFAOYSA-N 0 0 364.405 3.592 20 5 FHBDRN CCOc1cc(Nc2ccc(OCCC(=O)OC)cc2)ccc1[N+](=O)[O-] ZINC000536187948 938533823 /nfs/dbraw/zinc/53/38/23/938533823.db2.gz KYPZGIFFPSUJMO-UHFFFAOYSA-N 0 0 360.366 3.679 20 5 FHBDRN Cc1nc(-c2ccc(CNC(=O)Cc3ccc([N+](=O)[O-])cc3)cc2)cs1 ZINC000052736551 938534493 /nfs/dbraw/zinc/53/44/93/938534493.db2.gz ORKKOZHNEYDCIB-UHFFFAOYSA-N 0 0 367.430 3.886 20 5 FHBDRN Cc1cc(F)cc(C(=O)N[C@H]2CCOC3(CCCCC3)C2)c1[N+](=O)[O-] ZINC000124224255 945185617 /nfs/dbraw/zinc/18/56/17/945185617.db2.gz HBRQCLQGXZNSNU-AWEZNQCLSA-N 0 0 350.390 3.654 20 5 FHBDRN Cc1cc(-c2noc(Cc3c[nH]c4ccc([N+](=O)[O-])cc34)n2)ccc1O ZINC000584032760 938559017 /nfs/dbraw/zinc/55/90/17/938559017.db2.gz QGYFKCQWMQQOTC-UHFFFAOYSA-N 0 0 350.334 3.731 20 5 FHBDRN COc1ccc(C[C@@H](C)CNc2ncnc3sc([N+](=O)[O-])cc32)cc1 ZINC000584044596 938568530 /nfs/dbraw/zinc/56/85/30/938568530.db2.gz JHVKYQUUXPNEDM-LLVKDONJSA-N 0 0 358.423 3.899 20 5 FHBDRN CCc1ccc([C@@H]2CCN(C(=O)c3cc4c(c([N+](=O)[O-])c3)OCO4)C2)cc1 ZINC000584045100 938569306 /nfs/dbraw/zinc/56/93/06/938569306.db2.gz SGXJIJUPFCTVEV-OAHLLOKOSA-N 0 0 368.389 3.516 20 5 FHBDRN O=C(Cc1cccc([N+](=O)[O-])c1)Nc1cc(CCc2ccccc2)ccn1 ZINC000427197608 945186844 /nfs/dbraw/zinc/18/68/44/945186844.db2.gz QNOSMKMXUOSBBO-UHFFFAOYSA-N 0 0 361.401 3.956 20 5 FHBDRN CC(C)(C)OC(=O)CC1(C(=O)Nc2ccc([N+](=O)[O-])cc2F)CCC1 ZINC000584054044 938574491 /nfs/dbraw/zinc/57/44/91/938574491.db2.gz CRPATQRJCOHODI-UHFFFAOYSA-N 0 0 352.362 3.575 20 5 FHBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@]1(O)CCC[C@H]1C ZINC000584073724 938581416 /nfs/dbraw/zinc/58/14/16/938581416.db2.gz MACBIXUOXVWIJY-FZKQIMNGSA-N 0 0 366.483 3.624 20 5 FHBDRN C[C@H](C(=O)N[C@@H](c1nccs1)C(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000584072284 938584292 /nfs/dbraw/zinc/58/42/92/938584292.db2.gz FPZGGZFVOMSLOW-KWQFWETISA-N 0 0 359.329 3.575 20 5 FHBDRN Cc1cc(OCC(=O)NC(C)(C)c2ccccc2[N+](=O)[O-])ccc1Cl ZINC000573033395 938595795 /nfs/dbraw/zinc/59/57/95/938595795.db2.gz CKHQYHKZISETIP-UHFFFAOYSA-N 0 0 362.813 3.987 20 5 FHBDRN O=C(NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CCC[C@@H]2CCC[C@H]21 ZINC000584146607 938616815 /nfs/dbraw/zinc/61/68/15/938616815.db2.gz SNJJPPJVCZZWHA-SCLBCKFNSA-N 0 0 356.426 3.593 20 5 FHBDRN O=C(c1c(Cl)cc(F)cc1Cl)N1CCc2ncc([N+](=O)[O-])cc2C1 ZINC000432142862 945192104 /nfs/dbraw/zinc/19/21/04/945192104.db2.gz JOLXVGLWAXTNJE-UHFFFAOYSA-N 0 0 370.167 3.634 20 5 FHBDRN Cc1ccc([C@@H](C)N(C)C(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000278684294 938648323 /nfs/dbraw/zinc/64/83/23/938648323.db2.gz MHJQELSFBQJUKI-CYBMUJFWSA-N 0 0 367.409 3.682 20 5 FHBDRN C[C@H](CNC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)Oc1ccccc1 ZINC000437269717 945193068 /nfs/dbraw/zinc/19/30/68/945193068.db2.gz RFHLOIHPIPHBJY-LLVKDONJSA-N 0 0 368.311 3.811 20 5 FHBDRN CC1(C)CCC[C@H](C[NH2+][C@@H](Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C(=O)[O-])C1 ZINC000584268217 938662715 /nfs/dbraw/zinc/66/27/15/938662715.db2.gz QYHIGBRFAKCCBY-UGSOOPFHSA-N 0 0 373.453 3.878 20 5 FHBDRN O=C(N[C@@H]1C[C@H]1c1ccc(Br)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000437270366 945195164 /nfs/dbraw/zinc/19/51/64/945195164.db2.gz DTCUFGAYBRQWRR-LSDHHAIUSA-N 0 0 361.195 3.643 20 5 FHBDRN O=C(Cc1cscc1Br)N1CCc2c1cccc2[N+](=O)[O-] ZINC000584306203 938679476 /nfs/dbraw/zinc/67/94/76/938679476.db2.gz XACQOSQLMFZKDP-UHFFFAOYSA-N 0 0 367.224 3.551 20 5 FHBDRN COc1cc(C)c(NS(=O)(=O)c2cccc([N+](=O)[O-])c2C)c(C)c1C ZINC000584313340 938683350 /nfs/dbraw/zinc/68/33/50/938683350.db2.gz MXBROTSTMUFMIJ-UHFFFAOYSA-N 0 0 364.423 3.638 20 5 FHBDRN CCc1cc(C2CC2)nc(NC(=O)c2cccc(SC)c2[N+](=O)[O-])n1 ZINC000584314985 938683573 /nfs/dbraw/zinc/68/35/73/938683573.db2.gz FEIJFVGOPLCFER-UHFFFAOYSA-N 0 0 358.423 3.799 20 5 FHBDRN COc1ccc([C@@H](Cc2ccccc2)Nc2ncc([N+](=O)[O-])cn2)cc1 ZINC000584323892 938686422 /nfs/dbraw/zinc/68/64/22/938686422.db2.gz MRFDGGGFLCIVRI-GOSISDBHSA-N 0 0 350.378 3.789 20 5 FHBDRN COc1ccc([C@H](Cc2ccccc2)Nc2ncc([N+](=O)[O-])cn2)cc1 ZINC000584323893 938686730 /nfs/dbraw/zinc/68/67/30/938686730.db2.gz MRFDGGGFLCIVRI-SFHVURJKSA-N 0 0 350.378 3.789 20 5 FHBDRN CS[C@@H](CNC(=O)N(C)CCc1cccc([N+](=O)[O-])c1)C(C)(C)C ZINC000511817470 945196489 /nfs/dbraw/zinc/19/64/89/945196489.db2.gz NQPMYKZZNPEWHZ-HNNXBMFYSA-N 0 0 353.488 3.556 20 5 FHBDRN Cc1nn(C(C)(C)C)cc1[C@@H](C)NC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000584344188 938693786 /nfs/dbraw/zinc/69/37/86/938693786.db2.gz SBTOOWUZMDXWKN-CHWSQXEVSA-N 0 0 358.442 3.836 20 5 FHBDRN CCCOCc1ccccc1CNC(=O)Nc1ccc(OC)c([N+](=O)[O-])c1 ZINC000611828773 938702684 /nfs/dbraw/zinc/70/26/84/938702684.db2.gz RUTDDBPZIWNVTM-UHFFFAOYSA-N 0 0 373.409 3.852 20 5 FHBDRN CCOc1ccc(-c2noc(COc3c(C)c(C)ncc3[N+](=O)[O-])n2)cc1 ZINC000584362375 938703966 /nfs/dbraw/zinc/70/39/66/938703966.db2.gz WYDXFZCJFGAWQV-UHFFFAOYSA-N 0 0 370.365 3.634 20 5 FHBDRN Cc1cnccc1OC1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2C)CC1 ZINC000278738083 938709371 /nfs/dbraw/zinc/70/93/71/938709371.db2.gz SJVCTOMIEYCFBW-UHFFFAOYSA-N 0 0 370.409 3.682 20 5 FHBDRN CC(C)(C(=O)N[C@@H]1C[C@H]1c1c(F)cccc1F)c1ccc([N+](=O)[O-])cc1 ZINC000437283500 945198120 /nfs/dbraw/zinc/19/81/20/945198120.db2.gz GFQATRTUKFYDNQ-CZUORRHYSA-N 0 0 360.360 3.823 20 5 FHBDRN Cn1c(-c2cccc([N+](=O)[O-])c2)nnc1N1CCc2ccc(Cl)cc2C1 ZINC000584379260 938782006 /nfs/dbraw/zinc/78/20/06/938782006.db2.gz SSJCLTIRBYUUTD-UHFFFAOYSA-N 0 0 369.812 3.606 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCC(C)(C)CCCO ZINC000507383120 945203111 /nfs/dbraw/zinc/20/31/11/945203111.db2.gz QKNJAZJGEJPTJI-UHFFFAOYSA-N 0 0 354.472 3.625 20 5 FHBDRN CCc1ccc(C(=O)N(CC)Cc2ccc(OC)c(OC)c2)cc1[N+](=O)[O-] ZINC000081822311 938804245 /nfs/dbraw/zinc/80/42/45/938804245.db2.gz FHHZKPSUVZPDEP-UHFFFAOYSA-N 0 0 372.421 3.837 20 5 FHBDRN Cc1ccc(NC(=O)c2ccc(NC[C@H](CO)C(C)C)c([N+](=O)[O-])c2)cc1 ZINC000573232269 938823163 /nfs/dbraw/zinc/82/31/63/938823163.db2.gz YJCFVNOZLVJSLJ-MRXNPFEDSA-N 0 0 371.437 3.832 20 5 FHBDRN CC(C)NC(=O)c1ccc(N2CCC[C@H](C(F)(F)F)[C@@H]2C)c([N+](=O)[O-])c1 ZINC000480312851 938831288 /nfs/dbraw/zinc/83/12/88/938831288.db2.gz YKOJCCOXDROJHY-AAEUAGOBSA-N 0 0 373.375 3.900 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)CN1c2ccccc2CCCC1=O ZINC000086625224 938840492 /nfs/dbraw/zinc/84/04/92/938840492.db2.gz GUDYYMOKALMRED-UHFFFAOYSA-N 0 0 367.405 3.520 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2nnc(N3CCC[C@@H]4CCC[C@@H]43)n2C2CC2)cc1 ZINC000584416405 938843847 /nfs/dbraw/zinc/84/38/47/938843847.db2.gz CMRBJYMBKKWTJJ-GUYCJALGSA-N 0 0 353.426 3.957 20 5 FHBDRN COc1cc(C(=O)N2CC(C)(C)[C@@H]2C(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000480321106 938845092 /nfs/dbraw/zinc/84/50/92/938845092.db2.gz UEZHIEZHNSJJGO-AWEZNQCLSA-N 0 0 372.368 3.711 20 5 FHBDRN O=C(NCc1ccc(Br)cc1)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000065668173 938866561 /nfs/dbraw/zinc/86/65/61/938866561.db2.gz ZBQRMWLZWAUSSO-UHFFFAOYSA-N 0 0 371.137 3.566 20 5 FHBDRN O=C(Nc1ccc(OC(F)F)c(F)c1)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000065668732 938867342 /nfs/dbraw/zinc/86/73/42/938867342.db2.gz AXUQIJMKBZWSKO-UHFFFAOYSA-N 0 0 362.210 3.866 20 5 FHBDRN CCOC(=O)Nc1ccc(NC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])cc1 ZINC000065669419 938874331 /nfs/dbraw/zinc/87/43/31/938874331.db2.gz ANGAHNMFVNKLGX-UHFFFAOYSA-N 0 0 365.292 3.694 20 5 FHBDRN CC[C@H](NC(=O)c1cc(F)c(F)cc1[N+](=O)[O-])c1ccc(OC)cc1 ZINC000065669446 938874373 /nfs/dbraw/zinc/87/43/73/938874373.db2.gz HDSJHBOVOJIOIQ-HNNXBMFYSA-N 0 0 350.321 3.763 20 5 FHBDRN C[C@H]1CC(=O)c2c1c(F)ccc2OCc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000015396454 945213285 /nfs/dbraw/zinc/21/32/85/945213285.db2.gz AIUWNXBBXMXPMG-JTQLQIEISA-N 0 0 373.336 3.869 20 5 FHBDRN CSc1cccc(F)c1CNc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 ZINC000563895380 938909968 /nfs/dbraw/zinc/90/99/68/938909968.db2.gz WZFMOTWAPPPXIL-UHFFFAOYSA-N 0 0 361.398 3.953 20 5 FHBDRN O=[N+]([O-])c1cnccc1N1CC[C@H](Cc2ccc(Br)cc2)C1 ZINC000432156658 945216861 /nfs/dbraw/zinc/21/68/61/945216861.db2.gz JBHVQEPGABWLGL-CYBMUJFWSA-N 0 0 362.227 3.821 20 5 FHBDRN CCc1ccc(CN(C)S(=O)(=O)c2cc([N+](=O)[O-])ccc2CC)cc1 ZINC000065684909 938938594 /nfs/dbraw/zinc/93/85/94/938938594.db2.gz FRCBTMALJJXRIZ-UHFFFAOYSA-N 0 0 362.451 3.540 20 5 FHBDRN C[C@@H]1C[C@@]1(NC(=O)NCc1cccc([N+](=O)[O-])c1)c1ccc(Cl)cc1 ZINC000548831589 938949860 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FHBDRN C/C(=C/C(=O)NC[C@@H](O)c1ccc(Cl)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000785185646 939010212 /nfs/dbraw/zinc/01/02/12/939010212.db2.gz NQGSQLSOGHLWKE-XSLBHYSZSA-N 0 0 360.797 3.501 20 5 FHBDRN Cc1ncc(NC(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)s1 ZINC000511319467 939013818 /nfs/dbraw/zinc/01/38/18/939013818.db2.gz KSHDTQMGKUNILC-UHFFFAOYSA-N 0 0 356.201 3.683 20 5 FHBDRN Cc1nn(C)c(C(=O)N2CCCCC[C@H]2/C=C\c2cccs2)c1[N+](=O)[O-] ZINC000611988352 939016038 /nfs/dbraw/zinc/01/60/38/939016038.db2.gz NBKUSGCDOVLQHA-CMUBDUJZSA-N 0 0 374.466 3.796 20 5 FHBDRN CNc1ccc(C(=O)NCCCc2c[nH]c3ccc(F)cc23)cc1[N+](=O)[O-] ZINC000548855906 939016586 /nfs/dbraw/zinc/01/65/86/939016586.db2.gz RNOLYDDBPMSEEE-UHFFFAOYSA-N 0 0 370.384 3.620 20 5 FHBDRN Cc1cccc(N(C)C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)c1C ZINC000179257867 939017769 /nfs/dbraw/zinc/01/77/69/939017769.db2.gz ZCLIOYMTISHWLN-UHFFFAOYSA-N 0 0 350.378 3.674 20 5 FHBDRN CSc1cccc(C(=O)N2CC[C@@H](Nc3ccccc3)C2)c1[N+](=O)[O-] ZINC000188115593 939019101 /nfs/dbraw/zinc/01/91/01/939019101.db2.gz NLXKXYZVCDNBSN-CQSZACIVSA-N 0 0 357.435 3.643 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)c2c[nH]nc2-c2ccsc2)cc1[N+](=O)[O-] ZINC000188137646 939019359 /nfs/dbraw/zinc/01/93/59/939019359.db2.gz UXLQOQUPWAJBIO-LLVKDONJSA-N 0 0 356.407 3.846 20 5 FHBDRN CC(C)n1cc(NC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])cn1 ZINC000612040501 939023590 /nfs/dbraw/zinc/02/35/90/939023590.db2.gz KRQSRZZPHYMVLJ-UHFFFAOYSA-N 0 0 354.819 3.756 20 5 FHBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])Nc1ccc2nccn2c1 ZINC000612041912 939023720 /nfs/dbraw/zinc/02/37/20/939023720.db2.gz ANXHIHCKAWCTJZ-UHFFFAOYSA-N 0 0 362.798 3.627 20 5 FHBDRN COc1ccc2c(c1)CC[C@@H](NC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1)C2 ZINC000612084948 939047091 /nfs/dbraw/zinc/04/70/91/939047091.db2.gz PYFKJDDIXKHDGT-QGZVFWFLSA-N 0 0 368.433 3.555 20 5 FHBDRN C[C@@H](c1ccc(Cl)cc1Cl)N(C)C(=O)CCn1cc([N+](=O)[O-])cn1 ZINC000065776381 939051990 /nfs/dbraw/zinc/05/19/90/939051990.db2.gz UYLSUCGHXLLOQA-JTQLQIEISA-N 0 0 371.224 3.708 20 5 FHBDRN Cc1cccc([C@@H]2CCCN2C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)n1 ZINC000179296039 939077416 /nfs/dbraw/zinc/07/74/16/939077416.db2.gz UHZGCLXIJKROHC-IBGZPJMESA-N 0 0 364.405 3.686 20 5 FHBDRN CN(Cc1ccc(Cl)c(F)c1)C(=O)NCc1ccccc1[N+](=O)[O-] ZINC000179315306 939079663 /nfs/dbraw/zinc/07/96/63/939079663.db2.gz GVMKRVUYJFHWGM-UHFFFAOYSA-N 0 0 351.765 3.729 20 5 FHBDRN COc1cccc(CN(C)Cc2ccccc2[N+](=O)[O-])c1OC(F)F ZINC000179315922 939080204 /nfs/dbraw/zinc/08/02/04/939080204.db2.gz PMVGKCMDLYAIFY-UHFFFAOYSA-N 0 0 352.337 3.837 20 5 FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)C1CCCC1 ZINC000179317420 939080263 /nfs/dbraw/zinc/08/02/63/939080263.db2.gz ICXMHBQNQHKUMU-GFCCVEGCSA-N 0 0 352.456 3.642 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)NC12CC3CC(CC(C3)C1)C2 ZINC000179315641 939080791 /nfs/dbraw/zinc/08/07/91/939080791.db2.gz WWHPOMOBJNLBQO-UHFFFAOYSA-N 0 0 353.422 3.704 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1cnc2ccccc2n1 ZINC000179346494 939084111 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Cc1cc(F)cc(C(=O)N2CCc3sc(Cl)cc3C2)c1[N+](=O)[O-] ZINC000843620808 939124906 /nfs/dbraw/zinc/12/49/06/939124906.db2.gz OSYMHWWLXZNFIM-UHFFFAOYSA-N 0 0 354.790 3.956 20 5 FHBDRN Cc1cc(N[C@H](C)C[N@H+](C)Cc2ccccc2)cc(C(=O)[O-])c1[N+](=O)[O-] ZINC000516773361 945228829 /nfs/dbraw/zinc/22/88/29/945228829.db2.gz QEPBYWKOJPUWLP-CQSZACIVSA-N 0 0 357.410 3.534 20 5 FHBDRN O=C(c1ccn(-c2ccccc2[N+](=O)[O-])n1)N1CCC[C@H]2CCCC[C@@H]21 ZINC000179374487 939130588 /nfs/dbraw/zinc/13/05/88/939130588.db2.gz CZRBVMVXMDTNDZ-ZBFHGGJFSA-N 0 0 354.410 3.575 20 5 FHBDRN C[C@@H](NC(=O)Nc1cccc(NC(=O)C2CC2)c1)c1cccc([N+](=O)[O-])c1 ZINC000047487683 945230120 /nfs/dbraw/zinc/23/01/20/945230120.db2.gz ZQNRJPLSYPXVLG-GFCCVEGCSA-N 0 0 368.393 3.826 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(C1CC1)C1CCCCC1 ZINC000065791694 939151894 /nfs/dbraw/zinc/15/18/94/939151894.db2.gz WRBKRUYPARAWDI-UHFFFAOYSA-N 0 0 352.456 3.643 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC[C@H]1c1cccc(C)c1 ZINC000065792629 939152264 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O=[N+]([O-])c1cccc(-c2nc(CN3CCC([C@H]4CCOC4)CC3)cs2)c1 ZINC000612402110 940048014 /nfs/dbraw/zinc/04/80/14/940048014.db2.gz JVQLOOZEHOJLEJ-INIZCTEOSA-N 0 0 373.478 3.967 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1C[C@H](C)CSc2ccccc21 ZINC000427357368 945296343 /nfs/dbraw/zinc/29/63/43/945296343.db2.gz MPEFMXKLBXJJMF-LBPRGKRZSA-N 0 0 358.419 3.992 20 5 FHBDRN CSc1ccccc1NC(=O)[C@@H](C)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000548928350 940053071 /nfs/dbraw/zinc/05/30/71/940053071.db2.gz OWCSDINCXLJILW-CQSZACIVSA-N 0 0 373.478 3.818 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N(C)CCCCc2ccccc2)c1F ZINC000411494051 940053915 /nfs/dbraw/zinc/05/39/15/940053915.db2.gz ZKQRGHDOIKXLKP-UHFFFAOYSA-N 0 0 374.412 3.766 20 5 FHBDRN COc1ccc(CSCC(=O)Nc2ncccc2Cl)cc1[N+](=O)[O-] ZINC000179880253 940067559 /nfs/dbraw/zinc/06/75/59/940067559.db2.gz ANGIHDVCGHVERN-UHFFFAOYSA-N 0 0 367.814 3.524 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCCC[C@H]1c1cc[nH]n1 ZINC000375925193 940069459 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FHBDRN C[C@@H](C(=O)NC[C@H]1CCc2ccccc2C1)c1ccc([N+](=O)[O-])cc1F ZINC000612473419 940086560 /nfs/dbraw/zinc/08/65/60/940086560.db2.gz ZGFUHCGHSQEKCD-KGLIPLIRSA-N 0 0 356.397 3.759 20 5 FHBDRN Cc1nc(CC(C)C)oc1C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000188565142 940089746 /nfs/dbraw/zinc/08/97/46/940089746.db2.gz ZRLGRPATFAUTFH-UHFFFAOYSA-N 0 0 369.324 3.943 20 5 FHBDRN C[C@H](C(=O)NCC(C)(C)[C@H]1CCCCO1)c1ccc([N+](=O)[O-])cc1F ZINC000612478911 940090444 /nfs/dbraw/zinc/09/04/44/940090444.db2.gz SXDKJYZNPNNLAY-BLLLJJGKSA-N 0 0 352.406 3.549 20 5 FHBDRN Cc1ccc(F)cc1NC(=O)[C@@H](C)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000548935141 940106328 /nfs/dbraw/zinc/10/63/28/940106328.db2.gz DKCRVUMOOHZXID-CQSZACIVSA-N 0 0 359.401 3.544 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1CCCC[C@@H]1c1ncc(C)s1 ZINC000365278482 940107474 /nfs/dbraw/zinc/10/74/74/940107474.db2.gz OYDQIZQSQKTAMN-CQSZACIVSA-N 0 0 361.423 3.736 20 5 FHBDRN Cc1ccnc(Oc2ccc(NC(=O)c3cc(F)ccc3[N+](=O)[O-])cc2)n1 ZINC000177336942 940125869 /nfs/dbraw/zinc/12/58/69/940125869.db2.gz JWHIRPWSMKLIDA-UHFFFAOYSA-N 0 0 368.324 3.877 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)NCC[C@@H](C)c2ccccc2)c1F ZINC000411816078 940126672 /nfs/dbraw/zinc/12/66/72/940126672.db2.gz HUAYXHORYNVYQG-CYBMUJFWSA-N 0 0 360.385 3.595 20 5 FHBDRN Cn1c(C(=O)N2CCC(c3nc4ccccc4s3)CC2)ccc1[N+](=O)[O-] ZINC000612531058 940126831 /nfs/dbraw/zinc/12/68/31/940126831.db2.gz ZMSRTHHOWVALAX-UHFFFAOYSA-N 0 0 370.434 3.563 20 5 FHBDRN COc1cccc(CCCNC(=O)c2ccc([N+](=O)[O-])c3cccnc23)c1 ZINC000133952749 945298157 /nfs/dbraw/zinc/29/81/57/945298157.db2.gz JTHGJYPZFIQSLG-UHFFFAOYSA-N 0 0 365.389 3.514 20 5 FHBDRN O=C(OCc1coc(-c2ccc(F)c(F)c2)n1)c1ccc([N+](=O)[O-])cc1 ZINC000728619380 940130067 /nfs/dbraw/zinc/13/00/67/940130067.db2.gz LNFWYKLBACKLJO-UHFFFAOYSA-N 0 0 360.272 3.885 20 5 FHBDRN Cc1cc(C)c(NC(=O)CCCNc2ccc([N+](=O)[O-])cc2)cc1CO ZINC000615895187 940134725 /nfs/dbraw/zinc/13/47/25/940134725.db2.gz WRDCSNSHOPZADR-UHFFFAOYSA-N 0 0 357.410 3.535 20 5 FHBDRN COc1ccc(C(=O)N(C)c2ccc([N+](=O)[O-])cc2)c(Br)c1 ZINC000102833073 940138723 /nfs/dbraw/zinc/13/87/23/940138723.db2.gz QJQJFSJYZOODNC-UHFFFAOYSA-N 0 0 365.183 3.643 20 5 FHBDRN COc1ccccc1SCC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000124446310 945298610 /nfs/dbraw/zinc/29/86/10/945298610.db2.gz QGLXGMMUKVIRGM-UHFFFAOYSA-N 0 0 372.446 3.887 20 5 FHBDRN COc1ccc(CNC(=O)c2c([N+](=O)[O-])cccc2C(F)(F)F)c(C)c1 ZINC000612555271 940142617 /nfs/dbraw/zinc/14/26/17/940142617.db2.gz OPLDFKMEOSSIPK-UHFFFAOYSA-N 0 0 368.311 3.861 20 5 FHBDRN COc1ccc(CSCC(=O)N[C@H](C)C2CCCCC2)cc1[N+](=O)[O-] ZINC000517217933 940150452 /nfs/dbraw/zinc/15/04/52/940150452.db2.gz BQENVBYUKLNYPQ-CYBMUJFWSA-N 0 0 366.483 3.922 20 5 FHBDRN C[C@H]1C[C@H](C(C)(C)C)CCN1C(=O)c1cc([N+](=O)[O-])cc2c1OCCO2 ZINC000570126159 940153189 /nfs/dbraw/zinc/15/31/89/940153189.db2.gz FWRZIDPDTBPMEL-QWHCGFSZSA-N 0 0 362.426 3.653 20 5 FHBDRN CN(Cc1ccc(Br)s1)C(=O)c1ccc(F)cc1[N+](=O)[O-] ZINC000159849439 940155539 /nfs/dbraw/zinc/15/55/39/940155539.db2.gz WHUYGQPAVVSEIY-UHFFFAOYSA-N 0 0 373.203 3.830 20 5 FHBDRN CC[C@H](NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2[nH]1 ZINC000411931851 940164120 /nfs/dbraw/zinc/16/41/20/940164120.db2.gz AOSOAYKLNGBZQN-XHSDSOJGSA-N 0 0 364.405 3.842 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1C(=O)NC1CCN(c2ccc(Cl)cc2)CC1 ZINC000365480323 940172271 /nfs/dbraw/zinc/17/22/71/940172271.db2.gz GXESJTZOHPFNOQ-UHFFFAOYSA-N 0 0 373.840 3.955 20 5 FHBDRN Cc1ccc(NC(=O)N2CCC[C@H]2c2nncn2CC(C)C)cc1[N+](=O)[O-] ZINC000365483289 940172320 /nfs/dbraw/zinc/17/23/20/940172320.db2.gz UHOKNXHZWOAHTG-HNNXBMFYSA-N 0 0 372.429 3.520 20 5 FHBDRN COc1ccccc1NC1CCN(C(=O)c2c(C)cccc2[N+](=O)[O-])CC1 ZINC000365487721 940172976 /nfs/dbraw/zinc/17/29/76/940172976.db2.gz WFDXRDZWTXOUNA-UHFFFAOYSA-N 0 0 369.421 3.629 20 5 FHBDRN CCN([C@@H](C)c1ccc(F)cc1)S(=O)(=O)c1ccc([N+](=O)[O-])s1 ZINC000066000932 940175699 /nfs/dbraw/zinc/17/56/99/940175699.db2.gz YRYXVXOFUKBJHE-JTQLQIEISA-N 0 0 358.416 3.567 20 5 FHBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N(Cc2ccccc2)CC2CCC2)s1 ZINC000066001942 940176160 /nfs/dbraw/zinc/17/61/60/940176160.db2.gz UMGKVLIYJVLRJU-UHFFFAOYSA-N 0 0 366.464 3.647 20 5 FHBDRN COc1ccc(-c2nc(S/C=C/c3ccc([N+](=O)[O-])o3)n[nH]2)c(OC)c1 ZINC000066006008 940182394 /nfs/dbraw/zinc/18/23/94/940182394.db2.gz ZKZSQDPVJJURTR-BQYQJAHWSA-N 0 0 374.378 3.753 20 5 FHBDRN CC(=O)Nc1ccc(C)c(NC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000047545726 945301744 /nfs/dbraw/zinc/30/17/44/945301744.db2.gz HHIBSJODGLILED-LBPRGKRZSA-N 0 0 356.382 3.744 20 5 FHBDRN CC[C@H](CNc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2)Oc1cccc(F)c1 ZINC000440198483 945304149 /nfs/dbraw/zinc/30/41/49/945304149.db2.gz OPWCYVOTUXEKGF-CQSZACIVSA-N 0 0 373.384 3.888 20 5 FHBDRN O=C(c1cc(Cl)ccc1[N+](=O)[O-])N1CCC(c2ccc(O)cc2)CC1 ZINC000124523711 945304737 /nfs/dbraw/zinc/30/47/37/945304737.db2.gz MKEGNBRQOSNHPY-UHFFFAOYSA-N 0 0 360.797 3.974 20 5 FHBDRN Cc1ccc(NC(=O)NCc2nc3ccccc3n2C2CC2)cc1[N+](=O)[O-] ZINC000612775099 940268482 /nfs/dbraw/zinc/26/84/82/940268482.db2.gz ITDYWKIATLGFQX-UHFFFAOYSA-N 0 0 365.393 3.910 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1C[C@@H](C)Oc2c(Cl)cccc21 ZINC000427352421 945307675 /nfs/dbraw/zinc/30/76/75/945307675.db2.gz OOQSBKWSXDLJMR-SNVBAGLBSA-N 0 0 362.769 3.685 20 5 FHBDRN Cc1ccc(Cl)c(OCc2nc(-c3ccc(N)c([N+](=O)[O-])c3)no2)c1 ZINC000612856643 940315273 /nfs/dbraw/zinc/31/52/73/940315273.db2.gz CJRPCRPAADYSEB-UHFFFAOYSA-N 0 0 360.757 3.768 20 5 FHBDRN Cc1c(C(=O)N(C)Cc2ccc(Br)s2)cccc1[N+](=O)[O-] ZINC000018107833 945311323 /nfs/dbraw/zinc/31/13/23/945311323.db2.gz ILVLRWQKMKCWLC-UHFFFAOYSA-N 0 0 369.240 3.999 20 5 FHBDRN Cc1nsc(C)c1-c1noc(-c2ccc(OC(F)F)c([N+](=O)[O-])c2)n1 ZINC000426593515 945311754 /nfs/dbraw/zinc/31/17/54/945311754.db2.gz OPZOUXMJJIFWHK-UHFFFAOYSA-N 0 0 368.321 3.987 20 5 FHBDRN O=[N+]([O-])c1ccccc1/C=C/c1nc(Cc2ccc3c(c2)OCCO3)no1 ZINC000612894004 940332012 /nfs/dbraw/zinc/33/20/12/940332012.db2.gz MPKAWMYZUGNUNR-SOFGYWHQSA-N 0 0 365.345 3.510 20 5 FHBDRN C[C@@H]1CCC[C@@H](c2noc(Cc3cc4c(cc3[N+](=O)[O-])OCCO4)n2)C1 ZINC000612911164 940337391 /nfs/dbraw/zinc/33/73/91/940337391.db2.gz BMUFYRIHNGPMAN-VXGBXAGGSA-N 0 0 359.382 3.634 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2nc(Cc3ccc4c(c3)CCO4)no2)c(Cl)c1 ZINC000612912177 940337456 /nfs/dbraw/zinc/33/74/56/940337456.db2.gz RNFMEXJDYMRYGY-UHFFFAOYSA-N 0 0 357.753 3.824 20 5 FHBDRN O=[N+]([O-])c1ccc(-n2ccc(-c3nc([C@@H]4CCc5ccccc54)no3)n2)cc1 ZINC000612932859 940343549 /nfs/dbraw/zinc/34/35/49/940343549.db2.gz GCMXDFIRVPGFLE-QGZVFWFLSA-N 0 0 373.372 3.909 20 5 FHBDRN O=[N+]([O-])c1ccccc1NCCc1nc([C@H]2CCc3ccccc32)no1 ZINC000612933252 940344243 /nfs/dbraw/zinc/34/42/43/940344243.db2.gz PLXTUWPBOJLMOX-HNNXBMFYSA-N 0 0 350.378 3.711 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1-c1noc(CCCn2cnc3ccccc32)n1 ZINC000612934146 940344602 /nfs/dbraw/zinc/34/46/02/940344602.db2.gz GEJQBESHSMRIBE-UHFFFAOYSA-N 0 0 363.377 3.936 20 5 FHBDRN CN(Cc1nc([C@@H]2CCc3ccccc3C2)no1)c1ccccc1[N+](=O)[O-] ZINC000612951586 940356258 /nfs/dbraw/zinc/35/62/58/940356258.db2.gz JRZRKPKOWDEHHI-MRXNPFEDSA-N 0 0 364.405 3.887 20 5 FHBDRN COc1cc(Cc2noc(-c3cc4ccsc4[nH]3)n2)ccc1[N+](=O)[O-] ZINC000612963471 940364474 /nfs/dbraw/zinc/36/44/74/940364474.db2.gz RTWZQELOBOMXJL-UHFFFAOYSA-N 0 0 356.363 3.787 20 5 FHBDRN Cc1c(Cc2noc(C[C@H]3CCO[C@@H](C(C)C)C3)n2)cccc1[N+](=O)[O-] ZINC000612967342 940366064 /nfs/dbraw/zinc/36/60/64/940366064.db2.gz LKBIOBLUAOIDKA-WMLDXEAASA-N 0 0 359.426 3.871 20 5 FHBDRN Cc1c2cccc(F)c2oc1-c1nc(Cc2ccc([N+](=O)[O-])cn2)no1 ZINC000612968506 940366953 /nfs/dbraw/zinc/36/69/53/940366953.db2.gz PBMLLIDGQQRTSW-UHFFFAOYSA-N 0 0 354.297 3.824 20 5 FHBDRN O=[N+]([O-])c1cccc(OCCSc2nnc(Cc3cccs3)o2)c1 ZINC000066261391 940370437 /nfs/dbraw/zinc/37/04/37/940370437.db2.gz HIWSTNATBLABPQ-UHFFFAOYSA-N 0 0 363.420 3.801 20 5 FHBDRN COc1cccc(Cc2nnc(SCc3csc([N+](=O)[O-])c3)o2)c1 ZINC000066256861 940370822 /nfs/dbraw/zinc/37/08/22/940370822.db2.gz KZADHCVCUZVCAJ-UHFFFAOYSA-N 0 0 363.420 3.931 20 5 FHBDRN COc1cc(C(=O)N[C@H]2CC[C@@H](c3ccccc3)C2)c([N+](=O)[O-])cc1OC ZINC000376148503 940371695 /nfs/dbraw/zinc/37/16/95/940371695.db2.gz IOVNXVUTLGKWFC-CABCVRRESA-N 0 0 370.405 3.678 20 5 FHBDRN COc1ccc(C)cc1CNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F ZINC000612992040 940378229 /nfs/dbraw/zinc/37/82/29/940378229.db2.gz SZNXTXDKUUMVAQ-UHFFFAOYSA-N 0 0 360.385 3.645 20 5 FHBDRN O=C(CCCSc1ccc(Cl)cc1)OCCn1cc([N+](=O)[O-])cn1 ZINC000177735963 940393557 /nfs/dbraw/zinc/39/35/57/940393557.db2.gz ZRSRUTLFXREFPR-UHFFFAOYSA-N 0 0 369.830 3.560 20 5 FHBDRN O=C(CC(c1ccccc1)c1ccccc1)OCCn1cc([N+](=O)[O-])cn1 ZINC000177742808 940398691 /nfs/dbraw/zinc/39/86/91/940398691.db2.gz GVAIXPDGZBGNTB-UHFFFAOYSA-N 0 0 365.389 3.557 20 5 FHBDRN CCOc1cccc(CSCc2cc([N+](=O)[O-])cc3c2OCOC3)n1 ZINC000544087356 940404209 /nfs/dbraw/zinc/40/42/09/940404209.db2.gz IZKGCWFEMKWEBH-UHFFFAOYSA-N 0 0 362.407 3.688 20 5 FHBDRN CCOc1cccc(N2CCO[C@H](CCc3ccccc3)C2)c1[N+](=O)[O-] ZINC000613050053 940421300 /nfs/dbraw/zinc/42/13/00/940421300.db2.gz JSYQRGLYRRNVBC-QGZVFWFLSA-N 0 0 356.422 3.832 20 5 FHBDRN CNc1ccc([N+](=O)[O-])cc1NC(=O)CCCOc1ccc(C(C)=O)cc1 ZINC000579963917 940425494 /nfs/dbraw/zinc/42/54/94/940425494.db2.gz JEBRNQBZDFVBBO-UHFFFAOYSA-N 0 0 371.393 3.637 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1)CN(c1nnc([C@H]3CCCS3)n1C1CC1)CC2 ZINC000579965344 940425873 /nfs/dbraw/zinc/42/58/73/940425873.db2.gz YEHAYQJPAMWFRS-MRXNPFEDSA-N 0 0 371.466 3.652 20 5 FHBDRN Cc1nccc(NC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)c1Cl ZINC000124739190 945319959 /nfs/dbraw/zinc/31/99/59/945319959.db2.gz OULIKYFEERYFMK-UHFFFAOYSA-N 0 0 364.745 3.729 20 5 FHBDRN CC(C)CCn1nccc1NC(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000548984449 940434941 /nfs/dbraw/zinc/43/49/41/940434941.db2.gz OOOYBTNATANGDX-UHFFFAOYSA-N 0 0 359.430 3.544 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1N[C@@H]1CCc2nnc(-c3ccc(F)cc3)n2C1 ZINC000472499136 940439055 /nfs/dbraw/zinc/43/90/55/940439055.db2.gz MHDNTQSMHUYOPR-OAHLLOKOSA-N 0 0 367.384 3.728 20 5 FHBDRN CC[C@H](CSc1ccccc1)NC(=O)c1ccc([N+](=O)[O-])cc1OC ZINC000427369961 945320822 /nfs/dbraw/zinc/32/08/22/945320822.db2.gz MHQFYOCIQBZTAU-CYBMUJFWSA-N 0 0 360.435 3.904 20 5 FHBDRN CC(C)NC(=O)c1ccc(NCCC2C[C@@H](C)O[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000548988177 940446660 /nfs/dbraw/zinc/44/66/60/940446660.db2.gz VGWOEWNTYSFGOS-ZIAGYGMSSA-N 0 0 363.458 3.739 20 5 FHBDRN COC(=O)c1ccc(OCc2cc(-c3ccc(F)cc3)no2)cc1[N+](=O)[O-] ZINC000613109085 940451643 /nfs/dbraw/zinc/45/16/43/940451643.db2.gz JLTGOJBXCWXTJH-UHFFFAOYSA-N 0 0 372.308 3.755 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)Nc1nc(C(F)(F)F)cs1 ZINC000472508292 940454319 /nfs/dbraw/zinc/45/43/19/940454319.db2.gz WOTLXLJSCRXVHV-UHFFFAOYSA-N 0 0 374.344 3.901 20 5 FHBDRN COc1ccc(/C=C/C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1OC ZINC000177843916 940462014 /nfs/dbraw/zinc/46/20/14/940462014.db2.gz ROBWOQOSMXEYER-DNGMOHDESA-N 0 0 370.405 3.811 20 5 FHBDRN CCOc1ccc(C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1[N+](=O)[O-] ZINC000177850357 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362.389 3.737 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)c1nc(CC(=O)OC(C)(C)C)no1 ZINC000580377194 940475466 /nfs/dbraw/zinc/47/54/66/940475466.db2.gz SBGIUIBKYWWIOS-CYBMUJFWSA-N 0 0 361.398 3.598 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)NCC(F)(F)c1ccccc1 ZINC000580384917 940475677 /nfs/dbraw/zinc/47/56/77/940475677.db2.gz PBIGTMMDZCYACC-UHFFFAOYSA-N 0 0 363.364 3.695 20 5 FHBDRN C[C@@H](OCCCNC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000580393507 940475776 /nfs/dbraw/zinc/47/57/76/940475776.db2.gz IIAFZPRUMUTEFZ-JKSUJKDBSA-N 0 0 356.422 3.982 20 5 FHBDRN CO[C@@H]1CCCN(c2ccc([N+](=O)[O-])c(OCc3ccccc3)n2)CC1 ZINC000613183128 940478687 /nfs/dbraw/zinc/47/86/87/940478687.db2.gz UHUPQWKUEONEBY-MRXNPFEDSA-N 0 0 357.410 3.574 20 5 FHBDRN O=C(NC[C@H]1CC[C@H](c2ccccc2)O1)c1ccc([N+](=O)[O-])cc1Cl ZINC000580537202 940478744 /nfs/dbraw/zinc/47/87/44/940478744.db2.gz CMDSLDGNHMOBIV-RHSMWYFYSA-N 0 0 360.797 3.898 20 5 FHBDRN CN(C(=O)c1cc(Cl)cc(Br)c1)c1ccc([N+](=O)[O-])nc1 ZINC000580598425 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Cc1ccc([N+](=O)[O-])cc1NS(=O)(=O)c1ccc(OCC(C)C)cc1 ZINC000506795089 945333527 /nfs/dbraw/zinc/33/35/27/945333527.db2.gz JPNIORDVCSDMDB-UHFFFAOYSA-N 0 0 364.423 3.739 20 5 FHBDRN CC(C)CCSc1ccc(C(=O)NC[C@](C)(O)C(C)C)cc1[N+](=O)[O-] ZINC000440220227 945333706 /nfs/dbraw/zinc/33/37/06/945333706.db2.gz UZHAXSKNZOCCIU-SFHVURJKSA-N 0 0 368.499 3.870 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCCC1Cc2ccccc2C1 ZINC000550288334 945335188 /nfs/dbraw/zinc/33/51/88/945335188.db2.gz XADXHVJCJAZIEM-CQSZACIVSA-N 0 0 370.474 3.997 20 5 FHBDRN Nc1ccc(-c2noc([C@H]3C[C@H]3c3cc(F)ccc3F)n2)cc1[N+](=O)[O-] ZINC000581915608 940625374 /nfs/dbraw/zinc/62/53/74/940625374.db2.gz KWUPUTZRFUNFDO-JQWIXIFHSA-N 0 0 358.304 3.776 20 5 FHBDRN O=[N+]([O-])c1cncc(Cl)c1OCc1cc2c(cc1Cl)OCCO2 ZINC000581964849 940635490 /nfs/dbraw/zinc/63/54/90/940635490.db2.gz GRTXSRGPBQKVLA-UHFFFAOYSA-N 0 0 357.149 3.647 20 5 FHBDRN Cc1ccc([C@H]2CCC[C@@H]2N(C)C(=O)Nc2ccncc2[N+](=O)[O-])cc1 ZINC000543765798 945336703 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C[C@@H]1CN(C(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)[C@H](c2ccccc2)CO1 ZINC000173724455 940664242 /nfs/dbraw/zinc/66/42/42/940664242.db2.gz PENGFPNWZLQRHP-YJYMSZOUSA-N 0 0 365.389 3.678 20 5 FHBDRN C[C@H](C(=O)N(Cc1ccco1)Cc1cccnc1)c1cccc([N+](=O)[O-])c1 ZINC000582397325 940669459 /nfs/dbraw/zinc/66/94/59/940669459.db2.gz AENCLGNJVUGTIR-HNNXBMFYSA-N 0 0 365.389 3.915 20 5 FHBDRN Cc1c(NC(=O)N2CCC(n3cc(Cl)cn3)CC2)cccc1[N+](=O)[O-] ZINC000376270599 940670258 /nfs/dbraw/zinc/67/02/58/940670258.db2.gz QDKBJHAHPJUXSO-UHFFFAOYSA-N 0 0 363.805 3.622 20 5 FHBDRN CC(C)[C@@H](c1noc(Cn2ccc([N+](=O)[O-])n2)n1)c1ccc(Cl)cc1 ZINC000582453128 940672460 /nfs/dbraw/zinc/67/24/60/940672460.db2.gz UMKFSNQAZDOTFG-OAHLLOKOSA-N 0 0 361.789 3.664 20 5 FHBDRN COc1ccccc1CCN(C)C(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1 ZINC000412013595 940685628 /nfs/dbraw/zinc/68/56/28/940685628.db2.gz OSUZQHRSRFSGFM-UHFFFAOYSA-N 0 0 372.421 3.705 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])s1)N1CCC(CN2CCc3ccccc32)CC1 ZINC000111106075 945340348 /nfs/dbraw/zinc/34/03/48/945340348.db2.gz FPRQMGUOXDBDRM-UHFFFAOYSA-N 0 0 371.462 3.571 20 5 FHBDRN CCS[C@H]1CCC[C@H]1NC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C ZINC000178127362 940695976 /nfs/dbraw/zinc/69/59/76/940695976.db2.gz XGPNCVBTNSJUOV-OCCSQVGLSA-N 0 0 367.427 3.524 20 5 FHBDRN CCOC(=O)CCc1ccc(Nc2nc3sccn3c2[N+](=O)[O-])cc1 ZINC000582515969 940696776 /nfs/dbraw/zinc/69/67/76/940696776.db2.gz QGPJWVFTHCFEKK-UHFFFAOYSA-N 0 0 360.395 3.543 20 5 FHBDRN Cc1cc(C(=O)Nc2ccc(Br)cc2C)c(N)c([N+](=O)[O-])c1 ZINC000178148096 940717257 /nfs/dbraw/zinc/71/72/57/940717257.db2.gz BGSHVNDIANUNQC-UHFFFAOYSA-N 0 0 364.199 3.809 20 5 FHBDRN Cc1c([C@H](C)N[C@H]2c3sccc3OC(C)(C)[C@@H]2O)cccc1[N+](=O)[O-] ZINC000414179613 940721170 /nfs/dbraw/zinc/72/11/70/940721170.db2.gz KYAWBYQIYNCGLH-XNJJOIOASA-N 0 0 362.451 3.889 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(NC[C@@H]2CCC[C@H](C(F)(F)F)C2)n1 ZINC000582562195 940723677 /nfs/dbraw/zinc/72/36/77/940723677.db2.gz LQSURUWOEMNLBT-ZJUUUORDSA-N 0 0 361.320 3.557 20 5 FHBDRN COc1cc(NC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)c(C)cc1C ZINC000549023428 940724456 /nfs/dbraw/zinc/72/44/56/940724456.db2.gz QUMHCEMVCOPOCM-UHFFFAOYSA-N 0 0 357.410 3.927 20 5 FHBDRN Cn1ccnc1[C@@H]([NH2+]C1CCC(C(F)F)CC1)c1cccc([N+](=O)[O-])c1 ZINC000414183970 940725206 /nfs/dbraw/zinc/72/52/06/940725206.db2.gz NOOQGCTVFJDPFC-PXCJXSSVSA-N 0 0 364.396 3.831 20 5 FHBDRN Cc1c(Cl)cccc1NC(=S)NCCNc1ccccc1[N+](=O)[O-] ZINC000007369589 940751097 /nfs/dbraw/zinc/75/10/97/940751097.db2.gz FPEVLVGEVHIMHG-UHFFFAOYSA-N 0 0 364.858 3.955 20 5 FHBDRN Cc1c(NC(=O)[C@H](C)OC(=O)c2ccc3c(c2)CCC3)cccc1[N+](=O)[O-] ZINC000024339723 940751751 /nfs/dbraw/zinc/75/17/51/940751751.db2.gz MMPZNKFPEUACSW-ZDUSSCGKSA-N 0 0 368.389 3.576 20 5 FHBDRN CCN(Cc1ccccc1)C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000180176457 940763285 /nfs/dbraw/zinc/76/32/85/940763285.db2.gz QVMPYVHKVCSQHV-UHFFFAOYSA-N 0 0 350.321 3.859 20 5 FHBDRN COc1ccc(NC(=O)c2[nH]c3c(c2C)C(=O)CC(C)(C)C3)cc1[N+](=O)[O-] ZINC000582626876 940765934 /nfs/dbraw/zinc/76/59/34/940765934.db2.gz HCGPUMMELAXPKB-UHFFFAOYSA-N 0 0 371.393 3.647 20 5 FHBDRN COC(=O)c1sccc1NC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000175078811 940807896 /nfs/dbraw/zinc/80/78/96/940807896.db2.gz OVMDPLZYXRDNDS-UHFFFAOYSA-N 0 0 374.296 3.714 20 5 FHBDRN O=C(NCCCc1cccc(F)c1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000609454135 940809642 /nfs/dbraw/zinc/80/96/42/940809642.db2.gz PQYIHRCDZTVDRW-UHFFFAOYSA-N 0 0 357.385 3.671 20 5 FHBDRN CCn1c(-c2ccc([N+](=O)[O-])cc2)nnc1N(C)CCc1ccccc1 ZINC000549042346 940818955 /nfs/dbraw/zinc/81/89/55/940818955.db2.gz BJSNBYSPPJDVBC-UHFFFAOYSA-N 0 0 351.410 3.552 20 5 FHBDRN Cn1cc([C@H](NCc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)cn1 ZINC000376352016 940822077 /nfs/dbraw/zinc/82/20/77/940822077.db2.gz OBUQHKJJTMMASE-GOSISDBHSA-N 0 0 356.813 3.861 20 5 FHBDRN CC(C)(C)OC(=O)[C@@H](NC(=O)c1cc(F)cc([N+](=O)[O-])c1)c1ccccc1 ZINC000427428549 945352398 /nfs/dbraw/zinc/35/23/98/945352398.db2.gz OBJGIYFSQAFBPD-INIZCTEOSA-N 0 0 374.368 3.547 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](C)c2ccc(-n3cccn3)cc2)c1 ZINC000175429250 940863306 /nfs/dbraw/zinc/86/33/06/940863306.db2.gz DRLXWKXVZHIPMB-AWEZNQCLSA-N 0 0 350.378 3.580 20 5 FHBDRN O=C(N[C@@H]1CCO[C@H]1c1ccc(Cl)c(F)c1)c1csc([N+](=O)[O-])c1 ZINC000180244967 940875099 /nfs/dbraw/zinc/87/50/99/940875099.db2.gz GOKQRKRBSKXPSL-OCCSQVGLSA-N 0 0 370.789 3.709 20 5 FHBDRN O=C(N[C@@H]1CCO[C@@H]1c1ccc(Cl)c(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000180246441 940875223 /nfs/dbraw/zinc/87/52/23/940875223.db2.gz RQWFYSYAJCICOU-HZPDHXFCSA-N 0 0 364.760 3.647 20 5 FHBDRN Cc1cc(NS(=O)(=O)c2c(C)cccc2[N+](=O)[O-])c(Cl)cc1F ZINC000507596286 945356493 /nfs/dbraw/zinc/35/64/93/945356493.db2.gz NRKKEFYHPCJFJW-UHFFFAOYSA-N 0 0 358.778 3.805 20 5 FHBDRN Cc1c(NC(=O)[C@@H](C)Nc2ccc3c(c2)C(=O)CCC3)cccc1[N+](=O)[O-] ZINC000175517224 940882519 /nfs/dbraw/zinc/88/25/19/940882519.db2.gz APTQPBNZIXRGKE-CYBMUJFWSA-N 0 0 367.405 3.861 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1CNc1cc(COC)cc(C(=O)OC)c1 ZINC000427420141 945357276 /nfs/dbraw/zinc/35/72/76/945357276.db2.gz JBWMMTMXVYFXSU-UHFFFAOYSA-N 0 0 374.393 3.539 20 5 FHBDRN C[C@H]1CSc2ccccc2N1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000472574663 940891680 /nfs/dbraw/zinc/89/16/80/940891680.db2.gz QQXZCGUVMMFDKM-ZDUSSCGKSA-N 0 0 357.435 3.558 20 5 FHBDRN CC(C)(CNC(=O)NCc1ccc([N+](=O)[O-])cc1Cl)C(F)(F)F ZINC000549054205 940898024 /nfs/dbraw/zinc/89/80/24/940898024.db2.gz SIPBOEBGOQPFDL-UHFFFAOYSA-N 0 0 353.728 3.636 20 5 FHBDRN CCCOc1ccc(C(=O)Nc2ccc([N+](=O)[O-])c(C)n2)cc1OCC ZINC000175677304 940907697 /nfs/dbraw/zinc/90/76/97/940907697.db2.gz UIDVPJFRKGJBDK-UHFFFAOYSA-N 0 0 359.382 3.738 20 5 FHBDRN C[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1F)c1nc(C(C)(C)C)cs1 ZINC000106677295 945360080 /nfs/dbraw/zinc/36/00/80/945360080.db2.gz BDZQYYPXDDCEAM-SECBINFHSA-N 0 0 351.403 3.979 20 5 FHBDRN C[C@@H](CC(=O)c1ccc(Cl)cc1)C(=O)NCc1ccccc1[N+](=O)[O-] ZINC000186231260 940961678 /nfs/dbraw/zinc/96/16/78/940961678.db2.gz WUOMWMHWKNKHGZ-LBPRGKRZSA-N 0 0 360.797 3.774 20 5 FHBDRN C[C@@H](CCc1ccccc1[N+](=O)[O-])Nc1cccc([C@H]2CCC(=O)N2)c1 ZINC000414320774 940966023 /nfs/dbraw/zinc/96/60/23/940966023.db2.gz SYNGZXLBGDVGNT-KBXCAEBGSA-N 0 0 353.422 3.979 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)c1cnc(-c2ccccc2)nc1 ZINC000186303563 940972371 /nfs/dbraw/zinc/97/23/71/940972371.db2.gz DAVUZJKHIJXXHZ-UHFFFAOYSA-N 0 0 368.780 3.635 20 5 FHBDRN CCOC(=O)c1ccc(CNC(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)cc1 ZINC000176213603 941004643 /nfs/dbraw/zinc/00/46/43/941004643.db2.gz GCZJKKLKYOWDBR-UHFFFAOYSA-N 0 0 371.393 3.710 20 5 FHBDRN O=[N+]([O-])c1cc(C(F)(F)F)cc([N+](=O)[O-])c1NCc1cccc(O)c1 ZINC000180418010 941011129 /nfs/dbraw/zinc/01/11/29/941011129.db2.gz QAJSVVSAPKBCCX-UHFFFAOYSA-N 0 0 357.244 3.840 20 5 FHBDRN CN(CCCc1ccccc1)C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000180484441 941027844 /nfs/dbraw/zinc/02/78/44/941027844.db2.gz HUMNWHZFICWLBC-UHFFFAOYSA-N 0 0 364.348 3.901 20 5 FHBDRN O=[N+]([O-])c1cc2c(ncnc2NCc2ncoc2-c2ccccc2)s1 ZINC000376448512 941028664 /nfs/dbraw/zinc/02/86/64/941028664.db2.gz JKJSSFHGEROIQQ-UHFFFAOYSA-N 0 0 353.363 3.867 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CC(C)(C)OC1(C)C ZINC000180529228 941037364 /nfs/dbraw/zinc/03/73/64/941037364.db2.gz YSDUJAKEDAUWNW-RISCZKNCSA-N 0 0 352.456 3.538 20 5 FHBDRN COc1ccccc1[C@@H](C)CC(=O)OCc1ccc(OC)c([N+](=O)[O-])c1 ZINC000728662530 941041359 /nfs/dbraw/zinc/04/13/59/941041359.db2.gz PMLBZHRJDJQNQH-ZDUSSCGKSA-N 0 0 359.378 3.849 20 5 FHBDRN O=C(Nc1cc(C(F)(F)F)ccn1)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000180569341 941044677 /nfs/dbraw/zinc/04/46/77/941044677.db2.gz GQRZLVQXFAUQTD-UHFFFAOYSA-N 0 0 362.267 3.809 20 5 FHBDRN Cc1cccc(OCCNC(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)c1 ZINC000549073627 941044893 /nfs/dbraw/zinc/04/48/93/941044893.db2.gz HXHVXDBMNRCPJI-UHFFFAOYSA-N 0 0 368.311 3.731 20 5 FHBDRN O=C(N[C@@H]1CCc2ccccc2C1)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000549074146 941048068 /nfs/dbraw/zinc/04/80/68/941048068.db2.gz VTDPCBPILFCTMZ-CYBMUJFWSA-N 0 0 364.323 3.901 20 5 FHBDRN O=C(Nc1ccc2cc([N+](=O)[O-])ccc2n1)c1cccc(Br)n1 ZINC000180575241 941051464 /nfs/dbraw/zinc/05/14/64/941051464.db2.gz XZYBTYZEYPMIFS-UHFFFAOYSA-N 0 0 373.166 3.553 20 5 FHBDRN CN(Cc1c2ccccc2cc2ccccc21)C(=O)[C@@H]1CCCS1(=O)=O ZINC001143474794 941057102 /nfs/dbraw/zinc/05/71/02/941057102.db2.gz PNIJWQNHSAPSEO-FQEVSTJZSA-N 0 0 367.470 3.529 20 5 FHBDRN CCCn1cc(C(=O)Nc2nc(-c3ccc(C)c([N+](=O)[O-])c3)cs2)cn1 ZINC000180629252 941057207 /nfs/dbraw/zinc/05/72/07/941057207.db2.gz QYNNTRDEVYULSD-UHFFFAOYSA-N 0 0 371.422 3.886 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)Nc1c(F)cc(Cl)cc1F ZINC000180663761 941061384 /nfs/dbraw/zinc/06/13/84/941061384.db2.gz ZQIRXZRNTGFGBM-UHFFFAOYSA-N 0 0 362.741 3.636 20 5 FHBDRN COc1ccccc1[C@H](C)CC(=O)OCC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000728664905 941066566 /nfs/dbraw/zinc/06/65/66/941066566.db2.gz UHVQYBQNBNNPHT-CYBMUJFWSA-N 0 0 357.362 3.523 20 5 FHBDRN C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1occc1Br ZINC000176688036 941068773 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FHBDRN CCOc1cccc2cc([C@@H](C)NC(=O)c3c(N)cccc3[N+](=O)[O-])oc21 ZINC000180891376 941088491 /nfs/dbraw/zinc/08/84/91/941088491.db2.gz TZXUGPVRXRKHJJ-LLVKDONJSA-N 0 0 369.377 3.813 20 5 FHBDRN COCc1nc2cc(NC(=O)Nc3cccc([N+](=O)[O-])c3C)ccc2o1 ZINC000176958387 941088598 /nfs/dbraw/zinc/08/85/98/941088598.db2.gz BHXRZIMCUURPKP-UHFFFAOYSA-N 0 0 356.338 3.835 20 5 FHBDRN COCCOc1ccc(NC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000177000619 941092621 /nfs/dbraw/zinc/09/26/21/941092621.db2.gz QVBVPZPFUZJCIA-UHFFFAOYSA-N 0 0 373.409 3.677 20 5 FHBDRN CN(Cc1ccc(Br)o1)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000177008365 941092856 /nfs/dbraw/zinc/09/28/56/941092856.db2.gz HCOAXDZYVHHRDG-UHFFFAOYSA-N 0 0 366.171 3.724 20 5 FHBDRN COc1ccc(C(=O)N2C[C@H](c3ccccc3)C(C)(C)C2)cc1[N+](=O)[O-] ZINC000122160605 941094223 /nfs/dbraw/zinc/09/42/23/941094223.db2.gz OJIRPNBTPYLVRQ-MRXNPFEDSA-N 0 0 354.406 3.869 20 5 FHBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)c1ccc(C(=O)NC2CC2)cc1 ZINC000122159098 941094317 /nfs/dbraw/zinc/09/43/17/941094317.db2.gz JVKLQYBSKNFFBU-UHFFFAOYSA-N 0 0 373.796 3.701 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@@H]1CCO[C@H]1c1ccccc1 ZINC000188821324 941096089 /nfs/dbraw/zinc/09/60/89/941096089.db2.gz CFTXCSLSJGIIAS-YJBOKZPZSA-N 0 0 355.394 3.803 20 5 FHBDRN C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)N(C)Cc3ccco3)cc2[N+](=O)[O-])C1 ZINC000255945353 941096985 /nfs/dbraw/zinc/09/69/85/941096985.db2.gz DUFNWPXRNJAZCO-HUUCEWRRSA-N 0 0 371.437 3.942 20 5 FHBDRN Nc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc2[nH]c(-c3ccco3)nc2c1 ZINC000180955752 941096989 /nfs/dbraw/zinc/09/69/89/941096989.db2.gz KQRXWNUEURLQLM-UHFFFAOYSA-N 0 0 363.333 3.566 20 5 FHBDRN O=C(NCc1ccc(OC(F)(F)F)cc1)c1ccc(F)cc1[N+](=O)[O-] ZINC000177072632 941098087 /nfs/dbraw/zinc/09/80/87/941098087.db2.gz ARYFZQPXGVEEAZ-UHFFFAOYSA-N 0 0 358.247 3.563 20 5 FHBDRN COc1ccc(-c2ccc(C)c(NC(=O)c3ccc([N+](=O)[O-])cn3)c2)cn1 ZINC000549088294 941101425 /nfs/dbraw/zinc/10/14/25/941101425.db2.gz BQILQVAKRXRSMV-UHFFFAOYSA-N 0 0 364.361 3.621 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(N2CC[C@@H](C)[N@@H+](Cc3ccccc3)CC2)n1 ZINC000541006388 941101489 /nfs/dbraw/zinc/10/14/89/941101489.db2.gz PREBHFRWWWHEBT-QGZVFWFLSA-N 0 0 354.454 3.707 20 5 FHBDRN Cc1ccccc1-c1csc(NC(=O)c2c(N)cccc2[N+](=O)[O-])n1 ZINC000181057994 941106247 /nfs/dbraw/zinc/10/62/47/941106247.db2.gz XAEUBBMLUJUFDT-UHFFFAOYSA-N 0 0 354.391 3.861 20 5 FHBDRN O=C(N[C@@H]1C[C@H]1c1cccc(F)c1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000181077653 941107530 /nfs/dbraw/zinc/10/75/30/941107530.db2.gz HVDNOHRVFNHYJY-GXTWGEPZSA-N 0 0 366.295 3.621 20 5 FHBDRN O=C(c1cc2c(c([N+](=O)[O-])c1)OCO2)N(C1CC1)[C@H]1CCc2ccccc21 ZINC000181091513 941108039 /nfs/dbraw/zinc/10/80/39/941108039.db2.gz CKYDDMJTJRNCOG-INIZCTEOSA-N 0 0 366.373 3.616 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])Nc1ccc(OCc2cccnc2)cc1 ZINC000103047693 941108427 /nfs/dbraw/zinc/10/84/27/941108427.db2.gz WWNVMVMWTOGWOF-UHFFFAOYSA-N 0 0 363.373 3.750 20 5 FHBDRN CC(C)(CNC(=O)c1c(N)cccc1[N+](=O)[O-])Cc1cccc(Cl)c1 ZINC000181182883 941112124 /nfs/dbraw/zinc/11/21/24/941112124.db2.gz GYVCJOMPJIFGKC-UHFFFAOYSA-N 0 0 361.829 3.829 20 5 FHBDRN C[C@H](Cc1ccccc1C(F)(F)F)NC(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000181202363 941112713 /nfs/dbraw/zinc/11/27/13/941112713.db2.gz QNONSUYMBMXISU-GFCCVEGCSA-N 0 0 366.339 3.904 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)N[C@H](CCO)C2CCCCC2)cc1[N+](=O)[O-] ZINC000120142644 941114122 /nfs/dbraw/zinc/11/41/22/941114122.db2.gz KNQNPQDHLSSEKA-RHSMWYFYSA-N 0 0 363.458 3.595 20 5 FHBDRN O=C(Nc1ccc(-c2ncc[nH]2)cc1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000181220892 941114613 /nfs/dbraw/zinc/11/46/13/941114613.db2.gz XUMQUPFEMIOWSC-UHFFFAOYSA-N 0 0 374.303 3.839 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H](C)c1cccc(OC(F)(F)F)c1 ZINC000177320166 941116539 /nfs/dbraw/zinc/11/65/39/941116539.db2.gz KFLNVAJSOPZOLD-VIFPVBQESA-N 0 0 369.299 3.688 20 5 FHBDRN C[C@@H](NCc1cc(F)ccc1[N+](=O)[O-])c1ccc(N2CCOC2=O)cc1 ZINC000181274345 941118687 /nfs/dbraw/zinc/11/86/87/941118687.db2.gz MTTGVOKOSZODGH-GFCCVEGCSA-N 0 0 359.357 3.541 20 5 FHBDRN COc1ccc(C[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])c(C)c2)cc1OC ZINC000181271998 941118989 /nfs/dbraw/zinc/11/89/89/941118989.db2.gz POHPMKZDCPAKMG-CYBMUJFWSA-N 0 0 358.394 3.738 20 5 FHBDRN COc1ccc(C[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])c(C)c2)cc1OC ZINC000181271980 941119052 /nfs/dbraw/zinc/11/90/52/941119052.db2.gz POHPMKZDCPAKMG-ZDUSSCGKSA-N 0 0 358.394 3.738 20 5 FHBDRN COc1cccc([C@@H]2C[C@H]2CNC(=O)Nc2ccc([N+](=O)[O-])cc2F)c1 ZINC000414419913 941121714 /nfs/dbraw/zinc/12/17/14/941121714.db2.gz VJSXOMQPXKUSPR-WFASDCNBSA-N 0 0 359.357 3.668 20 5 FHBDRN CC(C)n1cnnc1-c1ccccc1NC(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000177482870 941128845 /nfs/dbraw/zinc/12/88/45/941128845.db2.gz PHHPITUPUXUHDI-UHFFFAOYSA-N 0 0 365.393 3.615 20 5 FHBDRN CSc1cccc(C(=O)N[C@H](C)CC(=O)c2ccccc2)c1[N+](=O)[O-] ZINC000188971764 941135759 /nfs/dbraw/zinc/13/57/59/941135759.db2.gz SOWRWESTNWIDFC-GFCCVEGCSA-N 0 0 358.419 3.708 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CCO[C@H](c2ccccc2F)C1 ZINC000066691035 941145100 /nfs/dbraw/zinc/14/51/00/941145100.db2.gz KKKDXJOXAWKHHB-INIZCTEOSA-N 0 0 364.760 3.601 20 5 FHBDRN O=[N+]([O-])c1ccccc1CN(Cc1nc(-c2ccccc2F)no1)C1CC1 ZINC000189126911 941146950 /nfs/dbraw/zinc/14/69/50/941146950.db2.gz JCRYXYDDDCJOQF-UHFFFAOYSA-N 0 0 368.368 3.949 20 5 FHBDRN O=C(c1cc(Cl)ccc1[N+](=O)[O-])N1CCO[C@@H](c2cccc(F)c2)C1 ZINC000066694597 941150714 /nfs/dbraw/zinc/15/07/14/941150714.db2.gz NKUDVEUQRWZRMS-MRXNPFEDSA-N 0 0 364.760 3.601 20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])Nc1ccc2c(c1)C(=O)CCC2 ZINC000177963828 941154901 /nfs/dbraw/zinc/15/49/01/941154901.db2.gz SBNGUYYBKNQUFV-UHFFFAOYSA-N 0 0 353.378 3.555 20 5 FHBDRN C[C@H]1CCC[C@H](NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)CC1 ZINC000189247392 941155309 /nfs/dbraw/zinc/15/53/09/941155309.db2.gz OKFPEKDCGDTFML-RDJZCZTQSA-N 0 0 359.470 3.896 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN(C)CC1(c2ccccc2)CC1 ZINC000189286849 941155375 /nfs/dbraw/zinc/15/53/75/941155375.db2.gz VPQBIYWCMMZWPJ-UHFFFAOYSA-N 0 0 353.422 3.505 20 5 FHBDRN C[C@H](C1CC1)n1cc(NC(=O)CCCNc2ccc([N+](=O)[O-])cc2)cn1 ZINC000189326182 941156369 /nfs/dbraw/zinc/15/63/69/941156369.db2.gz MGAMJZQSFHWOEL-CYBMUJFWSA-N 0 0 357.414 3.593 20 5 FHBDRN CC[C@@]1(C)CN(C(=O)c2cc([N+](=O)[O-])ccc2SC(C)C)CCO1 ZINC000189330308 941156376 /nfs/dbraw/zinc/15/63/76/941156376.db2.gz HPGGMZASQOMSLL-KRWDZBQOSA-N 0 0 352.456 3.736 20 5 FHBDRN CC(C)CCSc1ccc(C(=O)N2CC[C@@H](C)[C@@H]2CO)cc1[N+](=O)[O-] ZINC000189492478 941159049 /nfs/dbraw/zinc/15/90/49/941159049.db2.gz FFRXZFCTSXNTRQ-CJNGLKHVSA-N 0 0 366.483 3.576 20 5 FHBDRN COC[C@@H](Cc1ccccc1)N(C)C(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000189499814 941159355 /nfs/dbraw/zinc/15/93/55/941159355.db2.gz LTBLTUGOZOZLCV-WMLDXEAASA-N 0 0 374.412 3.554 20 5 FHBDRN CCN(Cc1c[nH]c2ccccc12)C(=O)c1cc([N+](=O)[O-])ccc1OC ZINC000189570892 941161312 /nfs/dbraw/zinc/16/13/12/941161312.db2.gz SIUKIWICRFDCDO-UHFFFAOYSA-N 0 0 353.378 3.747 20 5 FHBDRN COc1cc(NCc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)ccc1F ZINC000189573684 941161338 /nfs/dbraw/zinc/16/13/38/941161338.db2.gz YUXJHKRZWTXDFD-UHFFFAOYSA-N 0 0 356.357 3.755 20 5 FHBDRN O=C(Nc1ccc2c(c1)CCO2)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000178284841 941221991 /nfs/dbraw/zinc/22/19/91/941221991.db2.gz OYWYRLOLRCLYLW-UHFFFAOYSA-N 0 0 363.167 3.545 20 5 FHBDRN Cc1ccc(NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)c(C)n1 ZINC000178330301 941226574 /nfs/dbraw/zinc/22/65/74/941226574.db2.gz HGZDHQCXXUZOCF-UHFFFAOYSA-N 0 0 350.172 3.621 20 5 FHBDRN O=C(N[C@H]1CCOc2c(F)cccc21)c1ccc([N+](=O)[O-])cc1Cl ZINC000189626225 941232087 /nfs/dbraw/zinc/23/20/87/941232087.db2.gz SKBXEOPTUVMVRX-AWEZNQCLSA-N 0 0 350.733 3.641 20 5 FHBDRN CCOC(=O)[C@@H](NCc1ccc(OC)c([N+](=O)[O-])c1)c1cccc(C)c1C ZINC000189664108 941245684 /nfs/dbraw/zinc/24/56/84/941245684.db2.gz OYQGZAVAUFDGAF-IBGZPJMESA-N 0 0 372.421 3.614 20 5 FHBDRN CCCN(CCc1ccccn1)c1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-] ZINC000189682772 941254881 /nfs/dbraw/zinc/25/48/81/941254881.db2.gz GHWZCRLOPOWPHK-UHFFFAOYSA-N 0 0 370.453 3.587 20 5 FHBDRN CCN(Cc1ccc(C(=O)N(C)C)cc1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000189702951 941263470 /nfs/dbraw/zinc/26/34/70/941263470.db2.gz YCSLXTIYBSTMTB-UHFFFAOYSA-N 0 0 361.829 3.977 20 5 FHBDRN C[C@H]1CO[C@@H](c2ccccc2)CN1C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000066710090 941265869 /nfs/dbraw/zinc/26/58/69/941265869.db2.gz FMSFDZQLHLAITD-SCLBCKFNSA-N 0 0 365.389 3.678 20 5 FHBDRN COc1cc(C(=O)Nc2cnccc2OC(C)(C)C)cc([N+](=O)[O-])c1C ZINC000189720245 941267719 /nfs/dbraw/zinc/26/77/19/941267719.db2.gz STQUHZGESRPTTH-UHFFFAOYSA-N 0 0 359.382 3.736 20 5 FHBDRN C[C@@H]1CO[C@H](c2ccccc2)CN1C(=O)/C=C/c1ccc([N+](=O)[O-])cc1 ZINC000066712809 941270130 /nfs/dbraw/zinc/27/01/30/941270130.db2.gz AKNBCAUMHXIHQH-DSOXVULWSA-N 0 0 352.390 3.597 20 5 FHBDRN Cc1c(CC(=O)Nc2ccc(OC[C@@H]3CCCO3)cc2)cccc1[N+](=O)[O-] ZINC000178596021 941284921 /nfs/dbraw/zinc/28/49/21/941284921.db2.gz KPKDKDBREPGDRY-SFHVURJKSA-N 0 0 370.405 3.642 20 5 FHBDRN CS(=O)(=O)c1cc([N+](=O)[O-])ccc1Nc1ccc(OCC2CC2)cc1 ZINC000189859248 941289963 /nfs/dbraw/zinc/28/99/63/941289963.db2.gz GYYREQHAUMQRHD-UHFFFAOYSA-N 0 0 362.407 3.531 20 5 FHBDRN COCCc1cc(NC(=O)c2cc3ccccc3c3cccnc23)n(C)n1 ZINC000178746068 941300551 /nfs/dbraw/zinc/30/05/51/941300551.db2.gz RDJMWLJABPNLGX-UHFFFAOYSA-N 0 0 360.417 3.563 20 5 FHBDRN Cc1cccc(-n2nnnc2SCc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000543862968 941328063 /nfs/dbraw/zinc/32/80/63/941328063.db2.gz AHFKOLNMTDKZPF-UHFFFAOYSA-N 0 0 361.814 3.825 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)Nc1ccc2c(c1)CCCN2 ZINC000179038486 941332394 /nfs/dbraw/zinc/33/23/94/941332394.db2.gz GLJSWCRMVYOBMS-UHFFFAOYSA-N 0 0 354.410 3.784 20 5 FHBDRN Cc1ccccc1[C@@H](NC(=O)c1c([N+](=O)[O-])cnn1C)C1CCC(C)CC1 ZINC000122257869 941335793 /nfs/dbraw/zinc/33/57/93/941335793.db2.gz XANXWTMMJMFGOW-RWKZGTHUSA-N 0 0 370.453 3.934 20 5 FHBDRN COc1ccc(CNCc2cc(C)ccc2Br)cc1[N+](=O)[O-] ZINC000414514167 941370486 /nfs/dbraw/zinc/37/04/86/941370486.db2.gz LCFQSXDSZZPFCH-UHFFFAOYSA-N 0 0 365.227 3.964 20 5 FHBDRN C[C@@H](NC(=O)Nc1ccc(N2CCCCC2)nc1)c1cccc([N+](=O)[O-])c1 ZINC000077675297 941379842 /nfs/dbraw/zinc/37/98/42/941379842.db2.gz CSHPHRWRLHBPBJ-CQSZACIVSA-N 0 0 369.425 3.863 20 5 FHBDRN Cc1cc(C(=O)Nc2ccccc2CN2CCSCC2)cc([N+](=O)[O-])c1 ZINC000128322335 941393879 /nfs/dbraw/zinc/39/38/79/941393879.db2.gz QIZBFFXVQJROND-UHFFFAOYSA-N 0 0 371.462 3.704 20 5 FHBDRN CCOC1CC(CCNC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C1 ZINC000190043310 941408654 /nfs/dbraw/zinc/40/86/54/941408654.db2.gz RBXAOXDVWRAWNW-UHFFFAOYSA-N 0 0 360.332 3.549 20 5 FHBDRN Cc1csc(Sc2ccc(C(=O)N3CCCCO3)cc2[N+](=O)[O-])n1 ZINC000190048471 941479344 /nfs/dbraw/zinc/47/93/44/941479344.db2.gz NGRFICGFASGHIB-UHFFFAOYSA-N 0 0 365.436 3.679 20 5 FHBDRN COC(=O)c1cc(NC(=O)[C@H]2CCC[C@H](C(F)(F)F)C2)cc([N+](=O)[O-])c1 ZINC000136148098 941529512 /nfs/dbraw/zinc/52/95/12/941529512.db2.gz LHAKSKDKPULANL-ONGXEEELSA-N 0 0 374.315 3.689 20 5 FHBDRN C[C@@H](NC(=O)c1ccc(Br)s1)c1cccc([N+](=O)[O-])c1 ZINC000040222917 941584943 /nfs/dbraw/zinc/58/49/43/941584943.db2.gz SCMVSRGXCOSHDT-MRVPVSSYSA-N 0 0 355.213 3.910 20 5 FHBDRN CN(Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@H]1CCCc2cccnc21 ZINC000377248016 941590062 /nfs/dbraw/zinc/59/00/62/941590062.db2.gz DIECYWGWGJHRDB-INIZCTEOSA-N 0 0 365.393 3.549 20 5 FHBDRN CCN(C(=O)c1ccc([N+](=O)[O-])c(OC)c1)[C@H]1CCCc2cccnc21 ZINC000377253336 941597946 /nfs/dbraw/zinc/59/79/46/941597946.db2.gz UENZETHSDONPBK-INIZCTEOSA-N 0 0 355.394 3.538 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)Nc1cnc2c(c1)CCCC2 ZINC000541109722 941598204 /nfs/dbraw/zinc/59/82/04/941598204.db2.gz MYBJMFHJIUDMLL-UHFFFAOYSA-N 0 0 350.378 3.531 20 5 FHBDRN Cc1cc(N[C@H]2c3ccccc3C[C@H]2O)c(Br)cc1[N+](=O)[O-] ZINC000302657871 941621027 /nfs/dbraw/zinc/62/10/27/941621027.db2.gz HQVCLKCZJHCEBL-CVEARBPZSA-N 0 0 363.211 3.736 20 5 FHBDRN CC(=O)Nc1ccc(C(=O)N2CCCCc3cc([N+](=O)[O-])ccc32)cc1 ZINC000892862342 941627207 /nfs/dbraw/zinc/62/72/07/941627207.db2.gz XRNXYBWPJFXYDH-UHFFFAOYSA-N 0 0 353.378 3.536 20 5 FHBDRN COc1cccc([C@@H](Nc2cc(F)ccc2[N+](=O)[O-])c2nccn2C)c1 ZINC000365552304 941632402 /nfs/dbraw/zinc/63/24/02/941632402.db2.gz AHEOKIFLKCPVLW-QGZVFWFLSA-N 0 0 356.357 3.678 20 5 FHBDRN O=C(Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)[C@H]1C[C@@H]1c1cccnc1 ZINC000377307808 941634505 /nfs/dbraw/zinc/63/45/05/941634505.db2.gz ZLOCKCFHNBGTPA-CABCVRRESA-N 0 0 366.402 3.856 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N(C)[C@H](C)c2ccc(OC)cc2)c1 ZINC000549212738 941650271 /nfs/dbraw/zinc/65/02/71/941650271.db2.gz ZJQRMXPZERAUJE-CYBMUJFWSA-N 0 0 358.394 3.835 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)Nc1cc(-c2ccccc2F)no1 ZINC000729271095 941706314 /nfs/dbraw/zinc/70/63/14/941706314.db2.gz UXVHXZOGWQADMI-UHFFFAOYSA-N 0 0 357.297 3.650 20 5 FHBDRN C[C@H](Oc1c(Cl)nccc1[N+](=O)[O-])c1ccc(Br)nc1 ZINC001225430504 941713242 /nfs/dbraw/zinc/71/32/42/941713242.db2.gz COACKLJVRINPTN-ZETCQYMHSA-N 0 0 358.579 3.941 20 5 FHBDRN O=C(Cc1cnc2ccccc2c1)Nc1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000190061275 941725695 /nfs/dbraw/zinc/72/56/95/941725695.db2.gz RCWKVSCRVIAZFV-UHFFFAOYSA-N 0 0 358.357 3.872 20 5 FHBDRN Cc1sc(C(=O)Nc2ccnn2CCc2ccccc2)cc1[N+](=O)[O-] ZINC000123322939 941729377 /nfs/dbraw/zinc/72/93/77/941729377.db2.gz QFCQHIWLKIVEFW-UHFFFAOYSA-N 0 0 356.407 3.656 20 5 FHBDRN CCC/C=C\C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1 ZINC000729367199 941736562 /nfs/dbraw/zinc/73/65/62/941736562.db2.gz MIOXQHWKIRZTBQ-PLNGDYQASA-N 0 0 371.359 3.619 20 5 FHBDRN CCC/C=C/C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1 ZINC000729367301 941737453 /nfs/dbraw/zinc/73/74/53/941737453.db2.gz MIOXQHWKIRZTBQ-SNAWJCMRSA-N 0 0 371.359 3.619 20 5 FHBDRN Cc1cccc2c1CCN(C(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1)C2 ZINC000729413806 941748244 /nfs/dbraw/zinc/74/82/44/941748244.db2.gz JMTATPSHOWLLAG-UHFFFAOYSA-N 0 0 365.433 3.702 20 5 FHBDRN COc1cccc(C2(NC(=O)[C@@H](C)Sc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000122446176 941748418 /nfs/dbraw/zinc/74/84/18/941748418.db2.gz WKAKYIDGYBVHRO-CYBMUJFWSA-N 0 0 372.446 3.890 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N[C@H](C)c1nccn1-c1ccccc1 ZINC000377483865 941756725 /nfs/dbraw/zinc/75/67/25/941756725.db2.gz YSTYDYUOPVRDJN-CQSZACIVSA-N 0 0 350.378 3.580 20 5 FHBDRN Cc1coc(-c2cc(NC(=O)COc3cccc([N+](=O)[O-])c3)ccc2C)n1 ZINC000120670252 941759454 /nfs/dbraw/zinc/75/94/54/941759454.db2.gz ZCXJKWRHMKXIFR-UHFFFAOYSA-N 0 0 367.361 3.884 20 5 FHBDRN COC(=O)c1cccc(NC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c1C ZINC000047539674 941760046 /nfs/dbraw/zinc/76/00/46/941760046.db2.gz DHPUBVHNCXIMJG-LBPRGKRZSA-N 0 0 357.366 3.573 20 5 FHBDRN CC[C@@H](C)C(=O)N(CCOC)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 ZINC000073439395 941761715 /nfs/dbraw/zinc/76/17/15/941761715.db2.gz QPJJETLIXGFJOO-GFCCVEGCSA-N 0 0 363.439 3.744 20 5 FHBDRN CN(Cc1cnn(-c2ccccc2)c1)c1nc2ccccc2cc1[N+](=O)[O-] ZINC000473526927 941762063 /nfs/dbraw/zinc/76/20/63/941762063.db2.gz ZAFLGUHIAJNMCZ-UHFFFAOYSA-N 0 0 359.389 3.965 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)NC[C@H]1CC[C@H](c2ccccc2)O1 ZINC000377509292 941773410 /nfs/dbraw/zinc/77/34/10/941773410.db2.gz SXTOKEJBKFSNPJ-NVXWUHKLSA-N 0 0 370.405 3.644 20 5 FHBDRN C[C@H]([C@@H]1Cc2ccccc2O1)N(C)C(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000433569744 941773757 /nfs/dbraw/zinc/77/37/57/941773757.db2.gz ISFOKLZYVWPCEE-XIKOKIGWSA-N 0 0 374.824 3.641 20 5 FHBDRN C[C@H]1COC[C@@H](c2ccccc2)N1C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000415363203 941776176 /nfs/dbraw/zinc/77/61/76/941776176.db2.gz RFYUKMKYNYORML-GAZPGATBSA-N 0 0 366.417 3.687 20 5 FHBDRN Cc1cccc(OC[C@@H](O)CNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 ZINC000513201595 941778955 /nfs/dbraw/zinc/77/89/55/941778955.db2.gz OVEGZBIBAZFYED-ZDUSSCGKSA-N 0 0 370.327 3.774 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)c1c(C)onc1-c1cccnc1 ZINC000377520152 941785803 /nfs/dbraw/zinc/78/58/03/941785803.db2.gz QMBUVXLXAIOBOH-UHFFFAOYSA-N 0 0 368.349 3.604 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1Oc1ccccc1)N1CCC[C@H](CO)CC1 ZINC000294547762 941791837 /nfs/dbraw/zinc/79/18/37/941791837.db2.gz MMIOKFFWHVJFEZ-HNNXBMFYSA-N 0 0 370.405 3.622 20 5 FHBDRN CCC(CC)[C@@H]1C[C@@H](NC(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)CCO1 ZINC000190064514 941803119 /nfs/dbraw/zinc/80/31/19/941803119.db2.gz MFVVCYNUGHSADV-YJBOKZPZSA-N 0 0 364.442 3.625 20 5 FHBDRN Cn1c2ccc([N+](=O)[O-])cc2nc1-c1cn(-c2ccc(F)c(Cl)c2)nn1 ZINC000541161374 941803732 /nfs/dbraw/zinc/80/37/32/941803732.db2.gz KYUAPPGWRGTZBC-UHFFFAOYSA-N 0 0 372.747 3.522 20 5 FHBDRN CO[C@@H](C)CN(C)[C@@H](C(=O)Nc1ccc(C)cc1[N+](=O)[O-])c1ccccc1 ZINC000513261804 941814914 /nfs/dbraw/zinc/81/49/14/941814914.db2.gz POCKKXRNSVBWOG-HNAYVOBHSA-N 0 0 371.437 3.550 20 5 FHBDRN C[C@]1(CCc2ccccc2)CCN(c2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000433654610 941815297 /nfs/dbraw/zinc/81/52/97/941815297.db2.gz CQMOSEYESHKHSW-FQEVSTJZSA-N 0 0 353.422 3.543 20 5 FHBDRN COc1ccccc1[C@]1(C)C[C@H]1NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412134786 941828269 /nfs/dbraw/zinc/82/82/69/941828269.db2.gz MEMRYYBYMINZGC-HXQKEGBBSA-N 0 0 366.417 3.553 20 5 FHBDRN O=C(NCCc1c[nH]c2ccc(F)cc12)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412137320 941832722 /nfs/dbraw/zinc/83/27/22/941832722.db2.gz REKLKIQLUZIIEI-FUHWJXTLSA-N 0 0 367.380 3.678 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)C1(C(F)(F)F)CCCC1 ZINC000415459250 941835091 /nfs/dbraw/zinc/83/50/91/941835091.db2.gz WUPJLMMMCVTREV-UHFFFAOYSA-N 0 0 350.724 3.987 20 5 FHBDRN Cc1nn(Cc2ccc(C(=O)OC3CCCCC3)cc2)c(C)c1[N+](=O)[O-] ZINC000019676881 941836609 /nfs/dbraw/zinc/83/66/09/941836609.db2.gz BEGLTRKAOOUTSY-UHFFFAOYSA-N 0 0 357.410 3.946 20 5 FHBDRN CCO[C@@H]1C[C@H](Nc2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)[C@@H]1n1cccn1 ZINC000549284848 941837788 /nfs/dbraw/zinc/83/77/88/941837788.db2.gz CNMVPUXMTSBLDV-QGTPRVQTSA-N 0 0 374.441 3.799 20 5 FHBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)N1CC[C@H](c2ccco2)C1 ZINC000377612369 941839948 /nfs/dbraw/zinc/83/99/48/941839948.db2.gz VBRNPOVSEHAJMU-INIZCTEOSA-N 0 0 372.424 3.764 20 5 FHBDRN CCOc1ccc([C@@H](C)NC(=O)Nc2cccc([N+](=O)[O-])c2)cc1OC ZINC000047611728 941841538 /nfs/dbraw/zinc/84/15/38/941841538.db2.gz PGIFXXOHQRXMSV-GFCCVEGCSA-N 0 0 359.382 3.885 20 5 FHBDRN CCOc1ccc([C@@H](C)NC(=O)Nc2ccc([N+](=O)[O-])cc2)cc1OC ZINC000047611690 941841602 /nfs/dbraw/zinc/84/16/02/941841602.db2.gz UWYPGZUGDBEOEW-GFCCVEGCSA-N 0 0 359.382 3.885 20 5 FHBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)c1cc2ccccc2oc1=O ZINC000118687295 941842263 /nfs/dbraw/zinc/84/22/63/941842263.db2.gz ATSPCMRSISJWLO-UHFFFAOYSA-N 0 0 358.737 3.915 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NCc2oc3ccccc3c2OC)c1 ZINC000549290139 941853140 /nfs/dbraw/zinc/85/31/40/941853140.db2.gz MIPZKUPVVKXBDA-UHFFFAOYSA-N 0 0 370.361 3.678 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N2CCC[C@@H](C(C)C)CC2)cc1OC ZINC000513335405 941859524 /nfs/dbraw/zinc/85/95/24/941859524.db2.gz OWTZPSVRRDVYND-CQSZACIVSA-N 0 0 364.442 3.900 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@@H](CC(F)(F)F)C1 ZINC000433741474 941860491 /nfs/dbraw/zinc/86/04/91/941860491.db2.gz IBWFYOKIMDGLIK-UONOGXRCSA-N 0 0 358.360 3.964 20 5 FHBDRN CCS[C@@H]1CCC[C@@H]1NC(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1 ZINC000412174259 941863351 /nfs/dbraw/zinc/86/33/51/941863351.db2.gz XNZMMNLTMSYPAH-XJKSGUPXSA-N 0 0 352.456 3.786 20 5 FHBDRN CCS[C@H]1CCCC[C@H]1NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1C ZINC000176113168 941864259 /nfs/dbraw/zinc/86/42/59/941864259.db2.gz IFVKOJKEWWWRKW-HIFRSBDPSA-N 0 0 367.427 3.606 20 5 FHBDRN C[C@H](CC(=O)N(C)CCc1cccc([N+](=O)[O-])c1)C(=O)c1cccc(F)c1 ZINC000513343051 941864688 /nfs/dbraw/zinc/86/46/88/941864688.db2.gz MANILLIDDICHOK-CQSZACIVSA-N 0 0 372.396 3.644 20 5 FHBDRN Cc1cn([C@@H](C)c2ccccc2)nc1NC(=O)Cc1ccccc1[N+](=O)[O-] ZINC000472821591 941867019 /nfs/dbraw/zinc/86/70/19/941867019.db2.gz DWSDDFGGFSFXJG-HNNXBMFYSA-N 0 0 364.405 3.890 20 5 FHBDRN CC(C)Oc1cc(C(=O)N[C@@H](c2cnn(C)c2)C(C)(C)C)ccc1[N+](=O)[O-] ZINC000412179580 941867665 /nfs/dbraw/zinc/86/76/65/941867665.db2.gz ALDCFXOEKHGTCK-KRWDZBQOSA-N 0 0 374.441 3.633 20 5 FHBDRN COc1cc(CCNc2ccc(C(F)(F)F)cn2)c([N+](=O)[O-])cc1OC ZINC000052721245 941868189 /nfs/dbraw/zinc/86/81/89/941868189.db2.gz OCNHUVSAFUCTFE-UHFFFAOYSA-N 0 0 371.315 3.680 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@H](c2ccccc2)[C@@H]2CCCO2)c1 ZINC000549295641 941873116 /nfs/dbraw/zinc/87/31/16/941873116.db2.gz XCGGSQAHVUYYSB-RBUKOAKNSA-N 0 0 370.405 3.644 20 5 FHBDRN COC(=O)c1cc(NC(=O)C2(C(F)(F)F)CCCC2)c(C)c([N+](=O)[O-])c1 ZINC000415518106 941873450 /nfs/dbraw/zinc/87/34/50/941873450.db2.gz LPBLMVVZPRAMKJ-UHFFFAOYSA-N 0 0 374.315 3.751 20 5 FHBDRN CCOc1cc(OCc2ccn(-c3cccc(F)c3)n2)ccc1[N+](=O)[O-] ZINC000616230373 941878908 /nfs/dbraw/zinc/87/89/08/941878908.db2.gz REMOCQHICFHCMH-UHFFFAOYSA-N 0 0 357.341 3.897 20 5 FHBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)N2CC3(CCCC3)c3ccccc32)cc1 ZINC000433764858 941881828 /nfs/dbraw/zinc/88/18/28/941881828.db2.gz IMKPUQRIXCVCPR-UHFFFAOYSA-N 0 0 372.446 3.757 20 5 FHBDRN O=C(c1ccc(NC2CC2)c([N+](=O)[O-])c1)N1CCOc2c(Cl)cccc21 ZINC000472826720 941883453 /nfs/dbraw/zinc/88/34/53/941883453.db2.gz CKNGZILHASJTSK-UHFFFAOYSA-N 0 0 373.796 3.862 20 5 FHBDRN O=[N+]([O-])c1cc(F)ccc1N[C@H](CO)c1ccccc1OC(F)(F)F ZINC000480790035 941884894 /nfs/dbraw/zinc/88/48/94/941884894.db2.gz VZNMZWVMBZOHGS-GFCCVEGCSA-N 0 0 360.263 3.778 20 5 FHBDRN Cc1occc1-c1nnc(Sc2ccc([N+](=O)[O-])c(OC(C)C)n2)o1 ZINC000565220033 941887048 /nfs/dbraw/zinc/88/70/48/941887048.db2.gz AQUOKIKAODTMJJ-UHFFFAOYSA-N 0 0 362.367 3.880 20 5 FHBDRN Cc1cccnc1[C@H](NC(=O)NCCc1cccc([N+](=O)[O-])c1)C(C)C ZINC000119537659 941890034 /nfs/dbraw/zinc/89/00/34/941890034.db2.gz JIAJSQICUXZSRV-QGZVFWFLSA-N 0 0 356.426 3.537 20 5 FHBDRN CC(C)O[C@@H]1C[C@H](NC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)C1(C)C ZINC001267677491 941890088 /nfs/dbraw/zinc/89/00/88/941890088.db2.gz VBASOLVOHBDDGQ-VBNZEHGJSA-N 0 0 366.483 3.784 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N2CCS[C@H](C)[C@@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000433774003 941892089 /nfs/dbraw/zinc/89/20/89/941892089.db2.gz JQATXORCOVHWCU-MLGOLLRUSA-N 0 0 374.466 3.760 20 5 FHBDRN CC1(C)CCc2nc(NC(=O)[C@@H]3C[C@H]3c3ccc([N+](=O)[O-])cc3)ncc2C1 ZINC000415543229 941892629 /nfs/dbraw/zinc/89/26/29/941892629.db2.gz XBSBJJHHKZBOQG-JKSUJKDBSA-N 0 0 366.421 3.642 20 5 FHBDRN O=[N+]([O-])c1cc(-c2noc([C@H]3CC4CCC3CC4)n2)ccc1-n1cncn1 ZINC000453204666 941896687 /nfs/dbraw/zinc/89/66/87/941896687.db2.gz WDEOLGZJUVJETG-YIZWMMSDSA-N 0 0 366.381 3.519 20 5 FHBDRN CCO[C@@H]1C[C@@H](N(C)C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)C12CCC2 ZINC000412195456 941897793 /nfs/dbraw/zinc/89/77/93/941897793.db2.gz PUGHEXZOPNITEG-BSDSXHPESA-N 0 0 358.438 3.504 20 5 FHBDRN CCn1c(C)cc(C(=O)Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)c1C ZINC000103463253 941898051 /nfs/dbraw/zinc/89/80/51/941898051.db2.gz JWJRKWUNUPXWDO-UHFFFAOYSA-N 0 0 352.394 3.779 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N(C[C@@H]1CCCO1)C1CCCC1 ZINC000412197177 941898491 /nfs/dbraw/zinc/89/84/91/941898491.db2.gz UZYBZFJFKYXNHY-GBESFXJTSA-N 0 0 358.438 3.649 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CCc2ccc(F)c(F)c2C1 ZINC000412201141 941900589 /nfs/dbraw/zinc/90/05/89/941900589.db2.gz ICFODNBPNSQBJN-LSDHHAIUSA-N 0 0 358.344 3.561 20 5 FHBDRN C[C@@H](Nc1ncc([N+](=O)[O-])c(N)n1)c1cccc(OCc2ccccc2)c1 ZINC000433807596 941904714 /nfs/dbraw/zinc/90/47/14/941904714.db2.gz IZVYPHUNPQLCTC-CYBMUJFWSA-N 0 0 365.393 3.549 20 5 FHBDRN CCN(CC(=O)OC)Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000513412053 941908803 /nfs/dbraw/zinc/90/88/03/941908803.db2.gz TVIVAUNQMAVXPS-UHFFFAOYSA-N 0 0 352.774 3.503 20 5 FHBDRN Cc1cn([C@@H](C)c2ccccc2)nc1NC(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000472838117 941917211 /nfs/dbraw/zinc/91/72/11/941917211.db2.gz LKHCNBKWVZZVMN-HNNXBMFYSA-N 0 0 364.405 3.890 20 5 FHBDRN C[C@@H](NC(=O)Nc1cc(C2(C)CCCC2)on1)c1cccc([N+](=O)[O-])c1 ZINC000433820763 941919319 /nfs/dbraw/zinc/91/93/19/941919319.db2.gz FLYDHVXZNYTGMK-GFCCVEGCSA-N 0 0 358.398 3.719 20 5 FHBDRN O=C(N[C@@H]1CCO[C@@H]1c1ccc(Cl)cc1)c1ccc(F)cc1[N+](=O)[O-] ZINC000182452890 941926110 /nfs/dbraw/zinc/92/61/10/941926110.db2.gz QYZLEDYKKRQNQZ-GDBMZVCRSA-N 0 0 364.760 3.647 20 5 FHBDRN Cc1c(CC(=O)N[C@@H]2CCO[C@H]2c2ccc(Cl)cc2)cccc1[N+](=O)[O-] ZINC000182451194 941926118 /nfs/dbraw/zinc/92/61/18/941926118.db2.gz JVIKJRHQWCXVQS-APWZRJJASA-N 0 0 374.824 3.746 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N[C@H]1CCCc2cc(N)ccc21 ZINC000415585610 941928055 /nfs/dbraw/zinc/92/80/55/941928055.db2.gz UXFAOKYXWILRRF-INIZCTEOSA-N 0 0 354.410 3.993 20 5 FHBDRN Cc1sc(C(=O)N[C@H]2CCO[C@@H]2c2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000182486403 941934172 /nfs/dbraw/zinc/93/41/72/941934172.db2.gz ISZBSJPDMRXQRS-SWLSCSKDSA-N 0 0 366.826 3.878 20 5 FHBDRN Cc1cc(Br)ccc1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000182497161 941935118 /nfs/dbraw/zinc/93/51/18/941935118.db2.gz XEFDRTSRTJALFM-UHFFFAOYSA-N 0 0 363.211 3.871 20 5 FHBDRN O=C(N[C@@H](c1ccccc1)[C@H]1CCOC1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412227222 941936786 /nfs/dbraw/zinc/93/67/86/941936786.db2.gz JFSNAOCWRFCBRD-FFGOWVMKSA-N 0 0 366.417 3.592 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N1CCOc2c(F)cccc2C1 ZINC000433856627 941944010 /nfs/dbraw/zinc/94/40/10/941944010.db2.gz YGTUOEGBPASELF-UHFFFAOYSA-N 0 0 359.357 3.777 20 5 FHBDRN CC(C)N(Cc1ccc(Br)cc1)C(=O)c1cc([N+](=O)[O-])c[nH]1 ZINC000513460054 941948415 /nfs/dbraw/zinc/94/84/15/941948415.db2.gz LODBCIHVROIWJV-UHFFFAOYSA-N 0 0 366.215 3.736 20 5 FHBDRN CO[C@@H](c1ccc(F)cc1)[C@@H](C)NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412235029 941950083 /nfs/dbraw/zinc/95/00/83/941950083.db2.gz WMLUSZZQFKYHKG-YJQAKTFBSA-N 0 0 372.396 3.730 20 5 FHBDRN O=C1Nc2ccccc2[C@@H]1C1CCN(c2ncc([N+](=O)[O-])cc2Cl)CC1 ZINC000377743080 941952492 /nfs/dbraw/zinc/95/24/92/941952492.db2.gz KVKXJFXHJLWQFX-INIZCTEOSA-N 0 0 372.812 3.596 20 5 FHBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1C[C@]1(F)c1ccccc1 ZINC000412242655 941953616 /nfs/dbraw/zinc/95/36/16/941953616.db2.gz MZTVGFAMSHLFEP-YJBOKZPZSA-N 0 0 362.788 3.792 20 5 FHBDRN Cc1cc(NC(=O)c2cc(F)c([N+](=O)[O-])cc2F)ncc1Br ZINC000126307524 941954353 /nfs/dbraw/zinc/95/43/53/941954353.db2.gz ZGHSCMMVUHOJJV-UHFFFAOYSA-N 0 0 372.125 3.591 20 5 FHBDRN CCC(CC)[C@H]1C[C@H](NC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)CCO1 ZINC000412244224 941955781 /nfs/dbraw/zinc/95/57/81/941955781.db2.gz OOKDBEWEOWHMKI-QXCFHYIPSA-N 0 0 360.454 3.798 20 5 FHBDRN CC[C@H](C)[C@H](C)C(=O)N[C@@H](CC(=O)OC(C)C)c1ccccc1[N+](=O)[O-] ZINC000182774378 941959175 /nfs/dbraw/zinc/95/91/75/941959175.db2.gz DVDJJJIYVHGLIF-DZKIICNBSA-N 0 0 364.442 3.776 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]cc(Cc3noc([C@@H]4OC[C@H]5CCC[C@H]45)n3)c2c1 ZINC000377748490 941960769 /nfs/dbraw/zinc/96/07/69/941960769.db2.gz RIJGIWOCMSAFCI-ANTHHZPCSA-N 0 0 354.366 3.538 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]cc(Cc3noc([C@@H]4OC[C@@H]5CCC[C@H]54)n3)c2c1 ZINC000377748491 941961036 /nfs/dbraw/zinc/96/10/36/941961036.db2.gz RIJGIWOCMSAFCI-MNRXQERYSA-N 0 0 354.366 3.538 20 5 FHBDRN Cc1cc(NC(=O)N2CC[C@H](COCc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000182762011 941965729 /nfs/dbraw/zinc/96/57/29/941965729.db2.gz BFTATYLHDJVFKF-KRWDZBQOSA-N 0 0 369.421 3.974 20 5 FHBDRN O=C(NCCCCOc1ccc(F)cc1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000110204607 941976561 /nfs/dbraw/zinc/97/65/61/941976561.db2.gz NLTOGKJJGXWZRT-UHFFFAOYSA-N 0 0 366.776 3.976 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1CNCc1c(F)cc(F)c(F)c1F ZINC000430017606 941987890 /nfs/dbraw/zinc/98/78/90/941987890.db2.gz AOEIQANGGHAHNT-UHFFFAOYSA-N 0 0 358.291 3.840 20 5 FHBDRN O=C(CNC(=O)Nc1cccc([N+](=O)[O-])c1)Nc1cccc2ccccc21 ZINC000101602857 941990017 /nfs/dbraw/zinc/99/00/17/941990017.db2.gz YQFCSKACGKIYJQ-UHFFFAOYSA-N 0 0 364.361 3.508 20 5 FHBDRN CN(Cc1ccc2c(c1)OCO2)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000549336082 941992892 /nfs/dbraw/zinc/99/28/92/941992892.db2.gz YMQXLWTXWFXXSR-UHFFFAOYSA-N 0 0 368.311 3.974 20 5 FHBDRN O=[N+]([O-])c1ccc(CNc2ccn(-c3cccc(C(F)(F)F)c3)n2)cc1 ZINC000541169313 941996269 /nfs/dbraw/zinc/99/62/69/941996269.db2.gz CEQPITVCGYKQOK-UHFFFAOYSA-N 0 0 362.311 3.833 20 5 FHBDRN Cc1cc(Br)c(O)c(NC(=O)Cc2cccc([N+](=O)[O-])c2)c1 ZINC000182923717 941998192 /nfs/dbraw/zinc/99/81/92/941998192.db2.gz JTQISEHZRPMEQX-UHFFFAOYSA-N 0 0 365.183 3.553 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)NCC(C)(C)c2ccccc2Cl)c1[N+](=O)[O-] ZINC000433937640 942003842 /nfs/dbraw/zinc/00/38/42/942003842.db2.gz XAGOJBQSWJSSCZ-UHFFFAOYSA-N 0 0 364.833 3.802 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1COCC[C@@H]1c1ccccc1 ZINC000415703662 942007192 /nfs/dbraw/zinc/00/71/92/942007192.db2.gz GCXGIKMDXKEJKL-QZTJIDSGSA-N 0 0 354.406 3.916 20 5 FHBDRN O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCC(c2nc3ccccc3[nH]2)CC1 ZINC000517564001 942011807 /nfs/dbraw/zinc/01/18/07/942011807.db2.gz RKKNIAZWQQOOFC-UHFFFAOYSA-N 0 0 368.368 3.630 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1Cl)N1CC[C@@H](Cc2ccncc2)C1 ZINC000377820212 942012917 /nfs/dbraw/zinc/01/29/17/942012917.db2.gz BQBKNATZQCMCBZ-ZDUSSCGKSA-N 0 0 360.801 3.740 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CCO[C@H]1c1ccccc1 ZINC000412269856 942016501 /nfs/dbraw/zinc/01/65/01/942016501.db2.gz LYQBYPCJFVUCLI-WBVHZDCISA-N 0 0 360.797 3.642 20 5 FHBDRN Cc1ccccc1C[C@H]1CCCN1C(=O)CNc1ccccc1[N+](=O)[O-] ZINC000513558606 942016569 /nfs/dbraw/zinc/01/65/69/942016569.db2.gz DEZYOCKRGALUKU-QGZVFWFLSA-N 0 0 353.422 3.549 20 5 FHBDRN Cc1cc(C(=O)N(Cc2ccncc2)Cc2cccnc2)ccc1[N+](=O)[O-] ZINC000072576810 942017696 /nfs/dbraw/zinc/01/76/96/942017696.db2.gz OJPRKHHAAREVBL-UHFFFAOYSA-N 0 0 362.389 3.536 20 5 FHBDRN CSc1cccc(N(C)C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)c1 ZINC000101833526 942018165 /nfs/dbraw/zinc/01/81/65/942018165.db2.gz ABDNXDJDYFIZKB-UHFFFAOYSA-N 0 0 368.418 3.779 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N[C@@H](C)CC(C)(C)c2ccccc2)c1[N+](=O)[O-] ZINC000433981596 942023594 /nfs/dbraw/zinc/02/35/94/942023594.db2.gz QWZOWRBCWKYBNC-ZDUSSCGKSA-N 0 0 358.442 3.928 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2cc(Cl)cc(C)c2O)c1 ZINC000549346713 942028137 /nfs/dbraw/zinc/02/81/37/942028137.db2.gz WPMRNHNTSPBJMP-UHFFFAOYSA-N 0 0 350.758 3.913 20 5 FHBDRN CCN(CC)c1ccc(CNC(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)cn1 ZINC000085620112 942029504 /nfs/dbraw/zinc/02/95/04/942029504.db2.gz VKHWNAZPDRINNG-UHFFFAOYSA-N 0 0 371.441 3.775 20 5 FHBDRN O=C(NC1(c2ccccc2F)CC1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000182982429 942037285 /nfs/dbraw/zinc/03/72/85/942037285.db2.gz XUKWYBHKKKTLJE-UHFFFAOYSA-N 0 0 366.295 3.754 20 5 FHBDRN COc1cc(OCC(=O)N2CCC3(CCCCC3)CC2)ccc1[N+](=O)[O-] ZINC000102302323 942047621 /nfs/dbraw/zinc/04/76/21/942047621.db2.gz MGCYWMIEIOAZHS-UHFFFAOYSA-N 0 0 362.426 3.555 20 5 FHBDRN Cc1ccc(-c2nc(CCNC(=O)c3cc(F)ccc3[N+](=O)[O-])co2)cc1 ZINC000102358551 942050483 /nfs/dbraw/zinc/05/04/83/942050483.db2.gz FTCWSTOQLJRRCG-UHFFFAOYSA-N 0 0 369.352 3.670 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N[C@H](C)c2c(F)cccc2Cl)c1[N+](=O)[O-] ZINC000434027929 942053707 /nfs/dbraw/zinc/05/37/07/942053707.db2.gz ODRAOPLASQMIDT-MRVPVSSYSA-N 0 0 354.769 3.725 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)COc1cccc2c1OC(C)(C)C2 ZINC000513648775 942055051 /nfs/dbraw/zinc/05/50/51/942055051.db2.gz TZYOMRMRLGEIJN-UHFFFAOYSA-N 0 0 370.405 3.943 20 5 FHBDRN Cc1nn(-c2ccccc2)cc1CNC(=O)Nc1ccc(C)c([N+](=O)[O-])c1 ZINC000183003615 942062644 /nfs/dbraw/zinc/06/26/44/942062644.db2.gz RBSHEYUTSMMRRP-UHFFFAOYSA-N 0 0 365.393 3.719 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CC[C@@H](CC(F)(F)F)C2)ccc1[N+](=O)[O-] ZINC000412290517 942067265 /nfs/dbraw/zinc/06/72/65/942067265.db2.gz JCMSPSLHAPVMSN-NSHDSACASA-N 0 0 360.332 3.797 20 5 FHBDRN CCNC(=O)N(C)c1cccc(Nc2cc(OC)c(OC)cc2[N+](=O)[O-])c1 ZINC000480836598 942071153 /nfs/dbraw/zinc/07/11/53/942071153.db2.gz BZPRJDZGGPQLEP-UHFFFAOYSA-N 0 0 374.397 3.521 20 5 FHBDRN C[C@H](Cc1ccccc1F)NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513663198 942071530 /nfs/dbraw/zinc/07/15/30/942071530.db2.gz FGHYNRAQYMWBGL-SNVBAGLBSA-N 0 0 368.311 3.696 20 5 FHBDRN O=C(COc1ccc(F)cc1[N+](=O)[O-])Nc1ccccc1C(F)(F)F ZINC000102599738 942072723 /nfs/dbraw/zinc/07/27/23/942072723.db2.gz RFIBSDTWIHUSCL-UHFFFAOYSA-N 0 0 358.247 3.770 20 5 FHBDRN CC(C)Oc1cc(C(=O)N(C)Cc2cc(C(C)(C)C)n[nH]2)ccc1[N+](=O)[O-] ZINC000412295188 942074129 /nfs/dbraw/zinc/07/41/29/942074129.db2.gz UBXOUXJTJQUVJF-UHFFFAOYSA-N 0 0 374.441 3.675 20 5 FHBDRN Cc1csc(C2CCN(C(=O)c3cc([N+](=O)[O-])c(C)s3)CC2)n1 ZINC000102646229 942074326 /nfs/dbraw/zinc/07/43/26/942074326.db2.gz LQNYYSFWMGWRHN-UHFFFAOYSA-N 0 0 351.453 3.749 20 5 FHBDRN CC(C)Oc1cc(C(=O)NCc2ccc3c(n2)CCCC3)ccc1[N+](=O)[O-] ZINC000412295283 942074928 /nfs/dbraw/zinc/07/49/28/942074928.db2.gz UHXPSXZIDKNWJI-UHFFFAOYSA-N 0 0 369.421 3.586 20 5 FHBDRN C[C@H](NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1)[C@@H](C)c1ccccc1 ZINC000473533562 942075943 /nfs/dbraw/zinc/07/59/43/942075943.db2.gz SYIDHNPEGZRJRX-CABCVRRESA-N 0 0 364.405 3.703 20 5 FHBDRN COc1ccc(C(=O)CCCC(=O)OCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000126319883 942081088 /nfs/dbraw/zinc/08/10/88/942081088.db2.gz DOISXVYGZKPYGI-UHFFFAOYSA-N 0 0 357.362 3.700 20 5 FHBDRN C[C@H](Nc1ccc(N2CCCC2)c(F)c1)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000120683623 942081109 /nfs/dbraw/zinc/08/11/09/942081109.db2.gz MHJADRHKXXZXDA-ZDUSSCGKSA-N 0 0 372.400 3.773 20 5 FHBDRN CCN(C(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)c1ncccc1C ZINC000466508453 942081432 /nfs/dbraw/zinc/08/14/32/942081432.db2.gz FQPLGQHESBXDBW-UHFFFAOYSA-N 0 0 353.300 3.984 20 5 FHBDRN O=[N+]([O-])c1cccc(OCCSCc2ccn(CC(F)(F)F)n2)c1 ZINC000419396424 942081583 /nfs/dbraw/zinc/08/15/83/942081583.db2.gz ZPAGIBIBVZAMAX-UHFFFAOYSA-N 0 0 361.345 3.666 20 5 FHBDRN CN(C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)c1c(F)cccc1F ZINC000513685079 942082438 /nfs/dbraw/zinc/08/24/38/942082438.db2.gz KXLQPVBTQVQRKS-UHFFFAOYSA-N 0 0 358.247 3.751 20 5 FHBDRN Cc1cccc(O)c1NC(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000183074023 942084070 /nfs/dbraw/zinc/08/40/70/942084070.db2.gz KTVZKENDWUPVLC-UHFFFAOYSA-N 0 0 365.183 3.932 20 5 FHBDRN Cc1[nH]c(-c2ccccc2)nc1C(=O)OCCOc1cccc([N+](=O)[O-])c1 ZINC000728724683 942088534 /nfs/dbraw/zinc/08/85/34/942088534.db2.gz DMRYHFFFVIIRFO-UHFFFAOYSA-N 0 0 367.361 3.529 20 5 FHBDRN Cc1noc(C)c1Cc1noc(-c2ccc([N+](=O)[O-])c(OC(C)C)c2)n1 ZINC000420507689 942089332 /nfs/dbraw/zinc/08/93/32/942089332.db2.gz YEZPSJOLYOBHSH-UHFFFAOYSA-N 0 0 358.354 3.628 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N2CCCCc3ccccc32)c1F ZINC000413356601 942090671 /nfs/dbraw/zinc/09/06/71/942090671.db2.gz GQROPJNJMSYHGH-UHFFFAOYSA-N 0 0 358.369 3.655 20 5 FHBDRN O=C(Nc1cc([C@H]2CCCOC2)[nH]n1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000280031064 942090730 /nfs/dbraw/zinc/09/07/30/942090730.db2.gz LADIVCYLAZIAFD-VIFPVBQESA-N 0 0 365.777 3.509 20 5 FHBDRN CC(C)C[C@@H]1C[C@H](NC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])CCO1 ZINC000280068794 942101190 /nfs/dbraw/zinc/10/11/90/942101190.db2.gz HLVYXILRDZBCQP-CHWSQXEVSA-N 0 0 372.824 3.640 20 5 FHBDRN C[C@@H](C(=O)NCCCCc1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)OCO2 ZINC000584544440 942109073 /nfs/dbraw/zinc/10/90/73/942109073.db2.gz CKFVCLRUEOWVNN-CQSZACIVSA-N 0 0 370.405 3.566 20 5 FHBDRN CCn1ccnc1[C@H]1CCCCN1C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412309355 942111747 /nfs/dbraw/zinc/11/17/47/942111747.db2.gz KXBIFKKRHGLYPU-RCCFBDPRSA-N 0 0 368.437 3.669 20 5 FHBDRN COc1cc(C(=O)N(c2ccccc2)[C@H]2C[C@@H]2C)cc([N+](=O)[O-])c1OC ZINC000415885965 942115082 /nfs/dbraw/zinc/11/50/82/942115082.db2.gz DDOAJQYLNBZXGN-WFASDCNBSA-N 0 0 356.378 3.667 20 5 FHBDRN CCC(CC)[C@H]1C[C@@H](NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])CCO1 ZINC000183358936 942117975 /nfs/dbraw/zinc/11/79/75/942117975.db2.gz WNYJPJKFPKTIKF-XJKSGUPXSA-N 0 0 354.834 3.962 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)Nc1ccccc1-c1c(F)cccc1F ZINC000366640655 942120221 /nfs/dbraw/zinc/12/02/21/942120221.db2.gz LHHPAXOAROFQBW-UHFFFAOYSA-N 0 0 372.331 3.684 20 5 FHBDRN NC(=O)c1cccc([N+](=O)[O-])c1N1[C@@H]2CC[C@H]1C[C@@H](c1ccccc1)C2 ZINC000420627162 942126144 /nfs/dbraw/zinc/12/61/44/942126144.db2.gz NQLBNJYMHUOGHX-MUJYYYPQSA-N 0 0 351.406 3.609 20 5 FHBDRN CCNc1ccc(C(=O)Nc2cccc([C@@H](C)C(=O)OC)c2)cc1[N+](=O)[O-] ZINC000415907040 942135321 /nfs/dbraw/zinc/13/53/21/942135321.db2.gz MDZHNJVNWWIGPJ-GFCCVEGCSA-N 0 0 371.393 3.555 20 5 FHBDRN COc1ccc2c(c1)OC(C)(C)CN(c1ccc([N+](=O)[O-])c(C(C)=O)c1)C2 ZINC000420644431 942139643 /nfs/dbraw/zinc/13/96/43/942139643.db2.gz YQYHMVPPYVKYNZ-UHFFFAOYSA-N 0 0 370.405 3.984 20 5 FHBDRN C[C@H](Nc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-])c1nc2c(s1)CCC2 ZINC000413401090 942145410 /nfs/dbraw/zinc/14/54/10/942145410.db2.gz URNQTLIBERNUQO-JTQLQIEISA-N 0 0 372.450 3.605 20 5 FHBDRN CC(C)(C)CCOc1cnccc1CNc1c(C(N)=O)cccc1[N+](=O)[O-] ZINC000420640175 942148263 /nfs/dbraw/zinc/14/82/63/942148263.db2.gz RDFLJTWYTCHIFD-UHFFFAOYSA-N 0 0 372.425 3.516 20 5 FHBDRN Cc1cc(C)n([C@@H](C)CC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)n1 ZINC000501979036 942149182 /nfs/dbraw/zinc/14/91/82/942149182.db2.gz NUOKKVLXYNNYDX-INIZCTEOSA-N 0 0 358.442 3.796 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)N(C)c2nc3ccccc3o2)cc1SC ZINC000102982557 942166572 /nfs/dbraw/zinc/16/65/72/942166572.db2.gz RJWGCQKXTPFZQW-UHFFFAOYSA-N 0 0 373.390 3.743 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H](C2CCOCC2)C1 ZINC000366662229 942167581 /nfs/dbraw/zinc/16/75/81/942167581.db2.gz AYAFETCNHZPKRG-CQSZACIVSA-N 0 0 364.467 3.596 20 5 FHBDRN CC(C)C[N@@H+]1Cc2cccc(NC(=O)c3ccc([O-])c([N+](=O)[O-])c3)c2C1 ZINC000183392965 942172721 /nfs/dbraw/zinc/17/27/21/942172721.db2.gz OLSKPTXALGVDGF-UHFFFAOYSA-N 0 0 355.394 3.524 20 5 FHBDRN CC1CCN(c2ccc(C(=O)Nc3ccc(F)cn3)cc2[N+](=O)[O-])CC1 ZINC000103015235 942174631 /nfs/dbraw/zinc/17/46/31/942174631.db2.gz FPCZRUOEIKOIRV-UHFFFAOYSA-N 0 0 358.373 3.618 20 5 FHBDRN CC(C)(NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)c1ccccc1 ZINC000513695031 942187488 /nfs/dbraw/zinc/18/74/88/942187488.db2.gz XVPNQKAWUZEOHM-UHFFFAOYSA-N 0 0 350.321 3.861 20 5 FHBDRN CC[C@H](NS(=O)(=O)CCc1ccc([N+](=O)[O-])cc1)c1ccc(C)cc1 ZINC000183406501 942188510 /nfs/dbraw/zinc/18/85/10/942188510.db2.gz RQQLDKPBHWWZCN-SFHVURJKSA-N 0 0 362.451 3.516 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NCC[C@H](O)c1ccccc1 ZINC000122756717 942199465 /nfs/dbraw/zinc/19/94/65/942199465.db2.gz MJMIDQVVAISPNQ-INIZCTEOSA-N 0 0 360.435 3.560 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)NC[C@H]2CCCC(F)(F)C2)c1 ZINC000502050231 942200241 /nfs/dbraw/zinc/20/02/41/942200241.db2.gz PBPNAAMOQBCFID-ZDUSSCGKSA-N 0 0 356.369 3.614 20 5 FHBDRN CCn1ccnc1[C@H]1CCCCN1C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000280556921 942201632 /nfs/dbraw/zinc/20/16/32/942201632.db2.gz NMFVDHFLENFHJK-MRXNPFEDSA-N 0 0 357.414 3.879 20 5 FHBDRN C[C@@H](N[C@@H](c1ccn(C)n1)c1ccc(F)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000366691967 942204540 /nfs/dbraw/zinc/20/45/40/942204540.db2.gz CLGNLUKWUDKPNN-BFUOFWGJSA-N 0 0 354.385 3.908 20 5 FHBDRN CCNC(=O)c1ccc(NC(=O)c2c(Cl)cccc2[N+](=O)[O-])c(C)c1 ZINC000110234034 942206508 /nfs/dbraw/zinc/20/65/08/942206508.db2.gz VOUXLGZFTLUVQK-UHFFFAOYSA-N 0 0 361.785 3.559 20 5 FHBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NCC1(C2CC2)CCC1 ZINC000502069312 942211306 /nfs/dbraw/zinc/21/13/06/942211306.db2.gz GAOIBOBBPDBTTJ-LLVKDONJSA-N 0 0 352.818 3.712 20 5 FHBDRN C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)N3CC[C@@H](C4CC4)C3)cc2[N+](=O)[O-])C1 ZINC000480943075 942215906 /nfs/dbraw/zinc/21/59/06/942215906.db2.gz BLTQRUAIJLHXOR-RVKKMQEKSA-N 0 0 371.481 3.949 20 5 FHBDRN O=[N+]([O-])c1ccc(CN(C2CC2)S(=O)(=O)c2cc3ccccc3o2)cc1 ZINC000122777626 942223377 /nfs/dbraw/zinc/22/33/77/942223377.db2.gz GOCSJJRJZFYLFK-UHFFFAOYSA-N 0 0 372.402 3.694 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)N(Cc1cccc(F)c1)C[C@@H]1CCCO1 ZINC000051190816 942226369 /nfs/dbraw/zinc/22/63/69/942226369.db2.gz WDVOQELFNNEZNN-SFHVURJKSA-N 0 0 373.384 3.947 20 5 FHBDRN CCn1cc(C(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)c(C(F)(F)F)n1 ZINC000280663455 942226531 /nfs/dbraw/zinc/22/65/31/942226531.db2.gz BRTYEXIMZTZRIG-UHFFFAOYSA-N 0 0 356.304 3.699 20 5 FHBDRN CCS(=O)(=O)c1cc(Cl)cc(CNc2ccc([N+](=O)[O-])c(C)c2)c1 ZINC000413491096 942241435 /nfs/dbraw/zinc/24/14/35/942241435.db2.gz YGYWFHRKTGQKQX-UHFFFAOYSA-N 0 0 368.842 3.962 20 5 FHBDRN Cc1c(NC(=O)C2CCSCC2)cc(Br)cc1[N+](=O)[O-] ZINC000280756479 942243886 /nfs/dbraw/zinc/24/38/86/942243886.db2.gz QIFBQTPHFNIUEJ-UHFFFAOYSA-N 0 0 359.245 3.747 20 5 FHBDRN C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N(C)Cc1ccsc1 ZINC000128399111 942246138 /nfs/dbraw/zinc/24/61/38/942246138.db2.gz JFEZJKCSVDZYRZ-SNVBAGLBSA-N 0 0 353.831 3.769 20 5 FHBDRN O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)N1CC[C@@H](c2ccccc2F)C1 ZINC000502149508 942246476 /nfs/dbraw/zinc/24/64/76/942246476.db2.gz CDGHIMQSZCEGCR-LLVKDONJSA-N 0 0 364.323 3.571 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)OCC(=O)c2ccc3c(c2)CCC3)c1 ZINC000016196871 942247098 /nfs/dbraw/zinc/24/70/98/942247098.db2.gz MJVJMWBZAWALMS-UHFFFAOYSA-N 0 0 371.414 3.845 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)O[C@@H](C)C(=O)c2ccc(F)cc2)c1 ZINC000016196695 942247822 /nfs/dbraw/zinc/24/78/22/942247822.db2.gz MJMPJQZZXYWFED-JTQLQIEISA-N 0 0 363.366 3.884 20 5 FHBDRN CC(=O)c1cccc(O[C@H](C)C(=O)N2c3ccc([N+](=O)[O-])cc3C[C@@H]2C)c1 ZINC000103375431 942247950 /nfs/dbraw/zinc/24/79/50/942247950.db2.gz CQOOKWBFTZVPRK-GXTWGEPZSA-N 0 0 368.389 3.543 20 5 FHBDRN COc1ccc(OC)c(CCC(=O)N2c3ccc([N+](=O)[O-])cc3C[C@H]2C)c1 ZINC000103376251 942249051 /nfs/dbraw/zinc/24/90/51/942249051.db2.gz WFOSKWFDFDCFSW-CYBMUJFWSA-N 0 0 370.405 3.522 20 5 FHBDRN C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1ccn(-c2ccc(F)cc2)n1 ZINC000103375913 942249167 /nfs/dbraw/zinc/24/91/67/942249167.db2.gz IWDSPGVFPGYMQT-LBPRGKRZSA-N 0 0 366.352 3.511 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N2C[C@@H](C)Cc3ccccc32)c1C ZINC000480976787 942250524 /nfs/dbraw/zinc/25/05/24/942250524.db2.gz FQQYEKDYTSOHHE-LBPRGKRZSA-N 0 0 360.435 3.599 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N1CC[C@H](c2ccccc2F)C1 ZINC000502139833 942252551 /nfs/dbraw/zinc/25/25/51/942252551.db2.gz MUSMHGVNJMVFDP-ZDUSSCGKSA-N 0 0 362.788 3.946 20 5 FHBDRN CC(C)(C)[C@H]1CCN(C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C1 ZINC000544106285 942253754 /nfs/dbraw/zinc/25/37/54/942253754.db2.gz DQEGQSDPNJFIHC-INIZCTEOSA-N 0 0 359.470 3.706 20 5 FHBDRN Cc1ccccc1-c1noc([C@@H](C)Oc2ccc([N+](=O)[O-])c(CO)c2)n1 ZINC000431857073 942260007 /nfs/dbraw/zinc/26/00/07/942260007.db2.gz KMECYPLIJKBBRT-GFCCVEGCSA-N 0 0 355.350 3.586 20 5 FHBDRN COc1ccccc1SC[C@H](C)CNC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000103422426 942261668 /nfs/dbraw/zinc/26/16/68/942261668.db2.gz QSCMYZRXZNBTMW-CYBMUJFWSA-N 0 0 360.435 3.762 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2noc(CN3CCC[C@@H](CC(F)(F)F)C3)n2)c1 ZINC000420940315 942264967 /nfs/dbraw/zinc/26/49/67/942264967.db2.gz DBJXQPQTMXMACU-NSHDSACASA-N 0 0 370.331 3.809 20 5 FHBDRN COc1ccc(CN2CCO[C@@H](c3ccccc3Cl)C2)cc1[N+](=O)[O-] ZINC000103490316 942268063 /nfs/dbraw/zinc/26/80/63/942268063.db2.gz LATRJFMUPRLHSH-GOSISDBHSA-N 0 0 362.813 3.830 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(F)c([N+](=O)[O-])c2)c1 ZINC000016205982 942269696 /nfs/dbraw/zinc/26/96/96/942269696.db2.gz PCUANXCGAOKMFR-UHFFFAOYSA-N 0 0 351.315 3.616 20 5 FHBDRN C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCC[C@H](CC(F)(F)F)C1 ZINC000420949639 942271733 /nfs/dbraw/zinc/27/17/33/942271733.db2.gz OWZPVLOTZLHUJE-NWDGAFQWSA-N 0 0 359.348 3.586 20 5 FHBDRN CN(CCc1ccc(F)cc1)C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513705182 942273021 /nfs/dbraw/zinc/27/30/21/942273021.db2.gz IINSOWBMAROIFT-UHFFFAOYSA-N 0 0 368.311 3.650 20 5 FHBDRN C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCC[C@H](CC(F)(F)F)C1 ZINC000420955967 942275373 /nfs/dbraw/zinc/27/53/73/942275373.db2.gz XJDGOGFKXLZOMN-VXGBXAGGSA-N 0 0 359.348 3.586 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)c1csc(-c2ccccc2F)n1 ZINC000502191360 942278056 /nfs/dbraw/zinc/27/80/56/942278056.db2.gz IVUWLCXQKVBTIV-UHFFFAOYSA-N 0 0 357.366 3.787 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N1CCCc2c(F)c(F)cc(F)c21 ZINC000416029231 942278021 /nfs/dbraw/zinc/27/80/21/942278021.db2.gz PGCDGOVTRKLEFQ-UHFFFAOYSA-N 0 0 364.323 3.924 20 5 FHBDRN O=C(c1ccc(OC(F)F)c([N+](=O)[O-])c1)N1CCc2ccc(F)cc21 ZINC000513735587 942281809 /nfs/dbraw/zinc/28/18/09/942281809.db2.gz POMMCUOAMBDGRA-UHFFFAOYSA-N 0 0 352.268 3.538 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)c1cc[nH]c(=O)c1 ZINC000502209391 942283817 /nfs/dbraw/zinc/28/38/17/942283817.db2.gz ROOUYPYHADLRDM-NSHDSACASA-N 0 0 361.423 3.687 20 5 FHBDRN CCC[C@H](C)NC(=O)[C@@H]1CCCN(c2ccc([N+](=O)[O-])c3ncccc23)C1 ZINC000413096385 942284993 /nfs/dbraw/zinc/28/49/93/942284993.db2.gz BCJIZKVBTONSQC-LSDHHAIUSA-N 0 0 370.453 3.664 20 5 FHBDRN CCS(=O)(=O)c1ccc(CSCc2ccccc2[N+](=O)[O-])cc1 ZINC000419509255 942288870 /nfs/dbraw/zinc/28/88/70/942288870.db2.gz DYOXFDHXNJJJEQ-UHFFFAOYSA-N 0 0 351.449 3.822 20 5 FHBDRN C[C@H](SCc1cccc(S(C)(=O)=O)c1)c1ccccc1[N+](=O)[O-] ZINC000419511464 942295315 /nfs/dbraw/zinc/29/53/15/942295315.db2.gz CIAVDDCURYEXFT-LBPRGKRZSA-N 0 0 351.449 3.993 20 5 FHBDRN COc1ccc(CSCC(=O)N2CC[C@@H](C)C[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000502217569 942295700 /nfs/dbraw/zinc/29/57/00/942295700.db2.gz DEVKFNZUNKTTPN-ZIAGYGMSSA-N 0 0 366.483 3.731 20 5 FHBDRN Cc1ccc(S(=O)(=O)N2c3ccccc3SC[C@H]2C)cc1[N+](=O)[O-] ZINC000434138341 942296909 /nfs/dbraw/zinc/29/69/09/942296909.db2.gz WNLLLQFHDZUVAI-GFCCVEGCSA-N 0 0 364.448 3.593 20 5 FHBDRN C[C@H]1CN(C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)c2ccc(F)cc2O1 ZINC000413512027 942299464 /nfs/dbraw/zinc/29/94/64/942299464.db2.gz HIRUQEVUOPSGKF-KNXALSJPSA-N 0 0 356.353 3.652 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1c2ccccc2SC[C@H]1C ZINC000434137702 942299729 /nfs/dbraw/zinc/29/97/29/942299729.db2.gz UNYOSHZJNMKYLS-GFCCVEGCSA-N 0 0 364.448 3.593 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CCC(OC3CCCC3)CC2)c(C(F)(F)F)c1 ZINC000413102213 942302296 /nfs/dbraw/zinc/30/22/96/942302296.db2.gz HMQUKNGKLVZBSR-UHFFFAOYSA-N 0 0 359.348 3.937 20 5 FHBDRN COc1cccc([C@@H](Nc2ccc([N+](=O)[O-])c(C)n2)c2cccnc2)c1 ZINC000378130935 942304815 /nfs/dbraw/zinc/30/48/15/942304815.db2.gz CYUKOIGWCJKVLW-LJQANCHMSA-N 0 0 350.378 3.903 20 5 FHBDRN O=C1CC[C@H](CSCc2cc([N+](=O)[O-])ccc2C(F)(F)F)CCN1 ZINC000419548437 942309164 /nfs/dbraw/zinc/30/91/64/942309164.db2.gz SYGZSCYXRBCMKQ-JTQLQIEISA-N 0 0 362.373 3.763 20 5 FHBDRN C[C@@H](NC(=O)Nc1cc(Br)cc([N+](=O)[O-])c1)c1cccnc1 ZINC000501106856 942310056 /nfs/dbraw/zinc/31/00/56/942310056.db2.gz GMZCVSYBGSMONO-SECBINFHSA-N 0 0 365.187 3.635 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1COCc2ccccc21 ZINC000419554186 942311130 /nfs/dbraw/zinc/31/11/30/942311130.db2.gz GWKYGFVKOHYMKV-LJQANCHMSA-N 0 0 369.421 3.786 20 5 FHBDRN CCC(=O)c1ccc(N2CCC[C@H]2C[C@H](O)c2ccco2)c([N+](=O)[O-])c1 ZINC000366425944 942312721 /nfs/dbraw/zinc/31/27/21/942312721.db2.gz DJMHKCDFERZIEI-KSSFIOAISA-N 0 0 358.394 3.873 20 5 FHBDRN CC[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1SCCOC)[C@H]1CC1(C)C ZINC000416067363 942314673 /nfs/dbraw/zinc/31/46/73/942314673.db2.gz BYHQNIBWJZMBPF-HUUCEWRRSA-N 0 0 366.483 3.888 20 5 FHBDRN O=C1NC(=O)/C(=C\c2ccc(-c3cccc([N+](=O)[O-])c3)o2)c2ccccc21 ZINC000015662005 942317297 /nfs/dbraw/zinc/31/72/97/942317297.db2.gz JHVBUWYEIRAJNN-BOPFTXTBSA-N 0 0 360.325 3.665 20 5 FHBDRN CCOc1cc(N2CC[C@@]3(C2)CC(=O)c2ccccc2O3)ccc1[N+](=O)[O-] ZINC000413530920 942319374 /nfs/dbraw/zinc/31/93/74/942319374.db2.gz LLYVTJMGXWNQJG-FQEVSTJZSA-N 0 0 368.389 3.608 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)N[C@H](C)c2cccc(F)c2F)cc1C ZINC000501153511 942328616 /nfs/dbraw/zinc/32/86/16/942328616.db2.gz CIEYPAXKOMGIEO-LLVKDONJSA-N 0 0 370.377 3.529 20 5 FHBDRN Cc1ccc(S(=O)(=O)CCCSc2ccc([N+](=O)[O-])cc2)cc1 ZINC000419617787 942329034 /nfs/dbraw/zinc/32/90/34/942329034.db2.gz VTRXXGKOWFPBEC-UHFFFAOYSA-N 0 0 351.449 3.859 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1C(F)(F)F)N1CCSC[C@H]1C1CCC1 ZINC000416094610 942338336 /nfs/dbraw/zinc/33/83/36/942338336.db2.gz PKKSIZOSHSISAR-AWEZNQCLSA-N 0 0 374.384 3.971 20 5 FHBDRN O=C(c1cc(C(F)(F)F)ccc1[N+](=O)[O-])N1CCSC[C@@H]1C1CCC1 ZINC000416096547 942338620 /nfs/dbraw/zinc/33/86/20/942338620.db2.gz SCRZVWCKFVEFIX-CQSZACIVSA-N 0 0 374.384 3.971 20 5 FHBDRN COc1cc(C(=O)N2CC[C@@](F)(c3ccccc3C)C2)ccc1[N+](=O)[O-] ZINC000501172231 942339893 /nfs/dbraw/zinc/33/98/93/942339893.db2.gz HVLHFEGGAUWWOE-IBGZPJMESA-N 0 0 358.369 3.623 20 5 FHBDRN Cc1cc(F)cc([C@@]2(F)CCN(C(=O)c3ccc(F)cc3[N+](=O)[O-])C2)c1 ZINC000501175495 942341408 /nfs/dbraw/zinc/34/14/08/942341408.db2.gz NLTGNFMOUGRHMU-GOSISDBHSA-N 0 0 364.323 3.892 20 5 FHBDRN CC(C)CCC(=O)NCC(=O)OCc1nc2ccccc2c2ccccc12 ZINC000728735956 942349726 /nfs/dbraw/zinc/34/97/26/942349726.db2.gz YZYFNHNISNJNAV-UHFFFAOYSA-N 0 0 364.445 3.984 20 5 FHBDRN CC[C@@H]1CC[C@@H](C)N1CC(=O)Nc1ccc([N+](=O)[O-])cc1Br ZINC000330636941 942351384 /nfs/dbraw/zinc/35/13/84/942351384.db2.gz AUCIJIADIOJFCM-GHMZBOCLSA-N 0 0 370.247 3.559 20 5 FHBDRN C[C@H](CCc1ccccc1[N+](=O)[O-])Nc1cccc2c1ccn(C)c2=O ZINC000502323165 942354271 /nfs/dbraw/zinc/35/42/71/942354271.db2.gz UIDNFNITXKKIMI-CQSZACIVSA-N 0 0 351.406 3.880 20 5 FHBDRN O=[N+]([O-])c1ccc(NC[C@@H](CO)c2ccc(F)cc2)cc1OC(F)F ZINC000413556560 942354763 /nfs/dbraw/zinc/35/47/63/942354763.db2.gz ZYZPTKBOMGQPQY-NSHDSACASA-N 0 0 356.300 3.523 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@H]1CC12CCSCC2 ZINC000421117950 942355429 /nfs/dbraw/zinc/35/54/29/942355429.db2.gz JKUOQDWNVQLPKP-LBPRGKRZSA-N 0 0 365.455 3.648 20 5 FHBDRN Cc1c(C(=O)N2CCN([C@@H](C)c3cccc(F)c3)CC2)cccc1[N+](=O)[O-] ZINC000103975220 942358124 /nfs/dbraw/zinc/35/81/24/942358124.db2.gz YYFARSQVEJXMAA-HNNXBMFYSA-N 0 0 371.412 3.561 20 5 FHBDRN CCc1ccc(CNC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)s1 ZINC000513709936 942367895 /nfs/dbraw/zinc/36/78/95/942367895.db2.gz MTKBTMXLTZPSSR-UHFFFAOYSA-N 0 0 356.350 3.750 20 5 FHBDRN COc1cc2c(cc1F)CC[C@H]2NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412326913 942368885 /nfs/dbraw/zinc/36/88/85/942368885.db2.gz JGUJQDQCFKARBT-YXJHDRRASA-N 0 0 370.380 3.650 20 5 FHBDRN COc1cccc(C(=O)Nc2nc3c(s2)CC(C)(C)CC3)c1[N+](=O)[O-] ZINC000416118222 942369982 /nfs/dbraw/zinc/36/99/82/942369982.db2.gz AXQSKNWXMFPUNM-UHFFFAOYSA-N 0 0 361.423 3.827 20 5 FHBDRN Cc1cccc(OCCCNC(=O)CSc2ccc([N+](=O)[O-])cc2)c1 ZINC000016277797 942373102 /nfs/dbraw/zinc/37/31/02/942373102.db2.gz YDZREHYECDOSSN-UHFFFAOYSA-N 0 0 360.435 3.581 20 5 FHBDRN C[C@@H](NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)C1CCCCCC1 ZINC001268837589 942373213 /nfs/dbraw/zinc/37/32/13/942373213.db2.gz YVQIWBSOTDYUEU-CQSZACIVSA-N 0 0 356.426 3.869 20 5 FHBDRN Cc1nn(CC(=O)Nc2ccccc2Oc2ccccc2)cc1[N+](=O)[O-] ZINC000501275739 942377933 /nfs/dbraw/zinc/37/79/33/942377933.db2.gz OHKLGMTWPXTDDR-UHFFFAOYSA-N 0 0 352.350 3.531 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H]1C[C@H]1c1ccccc1 ZINC000509943557 942378976 /nfs/dbraw/zinc/37/89/76/942378976.db2.gz ODLMXQAUAHKWFS-XUWXXGDYSA-N 0 0 356.447 3.995 20 5 FHBDRN CC(C)(C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1)c1cccnc1 ZINC000501280922 942380168 /nfs/dbraw/zinc/38/01/68/942380168.db2.gz CYHRBYTYMARNEJ-UHFFFAOYSA-N 0 0 364.199 3.669 20 5 FHBDRN Cc1cc(=NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)[nH]n1C(C)C ZINC000421174980 942386714 /nfs/dbraw/zinc/38/67/14/942386714.db2.gz ZJVQPIBNOJXEMM-UHFFFAOYSA-N 0 0 359.430 3.545 20 5 FHBDRN Cc1nc(Cl)ccc1C(=O)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC000180618107 942393677 /nfs/dbraw/zinc/39/36/77/942393677.db2.gz IVVJRNMSWMGXQV-UHFFFAOYSA-N 0 0 370.590 3.966 20 5 FHBDRN O=C(OCc1nc(-c2ccsc2)no1)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000015798316 942411256 /nfs/dbraw/zinc/41/12/56/942411256.db2.gz IIEVZJVRXBMEJA-UHFFFAOYSA-N 0 0 365.754 3.717 20 5 FHBDRN Cc1cccc(C)c1NC(=O)[C@H](C)OC(=O)c1cccc([N+](=O)[O-])c1C ZINC000015800750 942411345 /nfs/dbraw/zinc/41/13/45/942411345.db2.gz RJEUFJMORBAHAQ-AWEZNQCLSA-N 0 0 356.378 3.704 20 5 FHBDRN CC(C)Oc1cc(C(=O)N[C@H](C)CC(=O)c2ccccc2)ccc1[N+](=O)[O-] ZINC000413621684 942431585 /nfs/dbraw/zinc/43/15/85/942431585.db2.gz RIDBAWWTYWLEPW-CQSZACIVSA-N 0 0 370.405 3.773 20 5 FHBDRN O=C(NCCOc1ccccc1Cl)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000501362222 942432999 /nfs/dbraw/zinc/43/29/99/942432999.db2.gz PFVVFSYITOADMM-UHFFFAOYSA-N 0 0 355.177 3.710 20 5 FHBDRN COc1ccc(OC)c([C@H]2CCCN2C(=O)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000015828153 942435254 /nfs/dbraw/zinc/43/52/54/942435254.db2.gz BNJJYRBPRVQZLM-QGZVFWFLSA-N 0 0 370.405 3.898 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CCc3c2cc(F)cc3F)ccc1[N+](=O)[O-] ZINC000413181878 942436610 /nfs/dbraw/zinc/43/66/10/942436610.db2.gz FQMBLYFSWBOEPK-UHFFFAOYSA-N 0 0 362.332 3.863 20 5 FHBDRN CN(C)C(=O)[C@H]1CCC[C@H](Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)C1 ZINC000513745413 942442100 /nfs/dbraw/zinc/44/21/00/942442100.db2.gz YOBJTZBHEPVWFJ-QWRGUYRKSA-N 0 0 359.348 3.673 20 5 FHBDRN Cc1ccc(NC(=O)CN(C)Cc2cc([N+](=O)[O-])ccc2Cl)c(F)c1 ZINC000016312847 942442802 /nfs/dbraw/zinc/44/28/02/942442802.db2.gz PHAMTOJSSZYGFJ-UHFFFAOYSA-N 0 0 365.792 3.766 20 5 FHBDRN Cc1cc(C)cc(NC(=O)CN(C)Cc2cc([N+](=O)[O-])ccc2Cl)c1 ZINC000016312719 942442867 /nfs/dbraw/zinc/44/28/67/942442867.db2.gz PPAFBZZYDSKZIZ-UHFFFAOYSA-N 0 0 361.829 3.936 20 5 FHBDRN CC[C@@H](NC(=O)N1CCOc2ccc([N+](=O)[O-])cc2C1)c1ccccc1 ZINC000413639890 942454854 /nfs/dbraw/zinc/45/48/54/942454854.db2.gz IOFNBFXBCJTPSM-QGZVFWFLSA-N 0 0 355.394 3.650 20 5 FHBDRN C[C@H](NC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1)C(F)(F)F ZINC000424950998 942465147 /nfs/dbraw/zinc/46/51/47/942465147.db2.gz HVMZQEPQWVIDBH-NSHDSACASA-N 0 0 359.348 3.512 20 5 FHBDRN Cc1c(Cl)cccc1NC(=O)[C@@H](C)OC(=O)c1ccc([N+](=O)[O-])s1 ZINC000015855688 942466719 /nfs/dbraw/zinc/46/67/19/942466719.db2.gz SLHWOGTWJABPJL-SECBINFHSA-N 0 0 368.798 3.802 20 5 FHBDRN Cc1ccc(Cl)cc1NC(=O)[C@H](C)OC(=O)c1ccc([N+](=O)[O-])s1 ZINC000015855804 942466816 /nfs/dbraw/zinc/46/68/16/942466816.db2.gz VSDFOFCZZFNNIU-VIFPVBQESA-N 0 0 368.798 3.802 20 5 FHBDRN CCn1cnnc1-c1ccccc1NC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000104262585 942468580 /nfs/dbraw/zinc/46/85/80/942468580.db2.gz PCRIALVIKHYNFS-UHFFFAOYSA-N 0 0 371.784 3.779 20 5 FHBDRN O=C(c1c([N+](=O)[O-])cccc1C(F)(F)F)N1CCC2(CCOCC2)CC1 ZINC000501423016 942469532 /nfs/dbraw/zinc/46/95/32/942469532.db2.gz ZMLWJPGOUBMNEH-UHFFFAOYSA-N 0 0 372.343 3.646 20 5 FHBDRN C[C@@H](c1ccccc1)N1CC(=O)N([C@@H](C)c2ccc([N+](=O)[O-])cc2)C1=O ZINC000419966774 942470006 /nfs/dbraw/zinc/47/00/06/942470006.db2.gz MBWCCSUBKURTCQ-KBPBESRZSA-N 0 0 353.378 3.681 20 5 FHBDRN Cc1cc(C)cc([C@@H]2NC(=O)N([C@@H](C)c3ccc([N+](=O)[O-])cc3)C2=O)c1 ZINC000419970318 942471433 /nfs/dbraw/zinc/47/14/33/942471433.db2.gz ULTQUAHIUKWSQR-GUYCJALGSA-N 0 0 353.378 3.566 20 5 FHBDRN CN1CC[C@@H](Nc2ncc([N+](=O)[O-])cc2F)[C@@H]1c1ccc(Cl)cc1 ZINC000413200733 942473224 /nfs/dbraw/zinc/47/32/24/942473224.db2.gz FICWALRATIJNFV-CABCVRRESA-N 0 0 350.781 3.640 20 5 FHBDRN O=[N+]([O-])c1ccc(N[C@H]2CCOC3(CCSCC3)C2)c2cccnc21 ZINC000413208104 942478954 /nfs/dbraw/zinc/47/89/54/942478954.db2.gz SEQZUUGGUSIDFQ-ZDUSSCGKSA-N 0 0 359.451 4.000 20 5 FHBDRN COc1ccc(C2(C(=O)N[C@H](C)c3cccc([N+](=O)[O-])c3)CCC2)cc1 ZINC000502505980 942484116 /nfs/dbraw/zinc/48/41/16/942484116.db2.gz OYJIMKKMVKHMPS-CQSZACIVSA-N 0 0 354.406 3.903 20 5 FHBDRN Cc1csc(Sc2ccc(C(=O)N[C@@H]3CC34CC4)cc2[N+](=O)[O-])n1 ZINC000424983578 942487708 /nfs/dbraw/zinc/48/77/08/942487708.db2.gz JNALNARLBBCAAZ-CYBMUJFWSA-N 0 0 361.448 3.793 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CCCc3cccc(O)c32)ccc1[N+](=O)[O-] ZINC000413672665 942490606 /nfs/dbraw/zinc/49/06/06/942490606.db2.gz RDALMOKPOMVKJJ-UHFFFAOYSA-N 0 0 356.378 3.681 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1nnc(CC)s1 ZINC000502520537 942496650 /nfs/dbraw/zinc/49/66/50/942496650.db2.gz QVIWLHQARFPYKW-UHFFFAOYSA-N 0 0 352.441 3.763 20 5 FHBDRN O=C(Cc1cccc([N+](=O)[O-])c1)Nc1cccc2c1CN(c1ccccn1)C2 ZINC000378276593 942506732 /nfs/dbraw/zinc/50/67/32/942506732.db2.gz JNEOEKNHYPPYFJ-UHFFFAOYSA-N 0 0 374.400 3.691 20 5 FHBDRN C[C@@H]1C[C@H](CO)C[N@H+](Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)C1 ZINC000421361030 942514196 /nfs/dbraw/zinc/51/41/96/942514196.db2.gz KCDPSHXHKFNLCI-ZBFHGGJFSA-N 0 0 374.412 3.977 20 5 FHBDRN COc1ccc(CNc2cnn(C)c2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000237204068 942521224 /nfs/dbraw/zinc/52/12/24/942521224.db2.gz RHOFQMJFKXTSKV-UHFFFAOYSA-N 0 0 368.393 3.528 20 5 FHBDRN CCOc1cc(NC(=O)[C@H](OC)c2ccccc2)c([N+](=O)[O-])cc1OCC ZINC000502544379 942521279 /nfs/dbraw/zinc/52/12/79/942521279.db2.gz FCFHTIKTGYYZKT-GOSISDBHSA-N 0 0 374.393 3.718 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N(C)Cc1cc(F)cc(F)c1 ZINC000434231424 942536356 /nfs/dbraw/zinc/53/63/56/942536356.db2.gz OLIYHAKPPZIQMO-UHFFFAOYSA-N 0 0 351.309 3.546 20 5 FHBDRN CN(c1cccc([N+](=O)[O-])c1)S(=O)(=O)c1ccc(Cl)c(Cl)c1 ZINC000513818173 942536908 /nfs/dbraw/zinc/53/69/08/942536908.db2.gz XJEPOYIAHYFBTK-UHFFFAOYSA-N 0 0 361.206 3.727 20 5 FHBDRN CC(C)c1[nH]nc(C(=O)Nc2ccc(F)c(Br)c2)c1[N+](=O)[O-] ZINC000434237080 942540526 /nfs/dbraw/zinc/54/05/26/942540526.db2.gz XKGBLEXFIHUNSY-UHFFFAOYSA-N 0 0 371.166 3.595 20 5 FHBDRN Cc1ccccc1C1=CCN(C(=O)c2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000501571027 942543875 /nfs/dbraw/zinc/54/38/75/942543875.db2.gz QSBPHOGYFWSWGQ-UHFFFAOYSA-N 0 0 359.385 3.991 20 5 FHBDRN CCC[C@@H](CCc1ccccc1)NC(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-] ZINC000434243300 942544229 /nfs/dbraw/zinc/54/42/29/942544229.db2.gz DICZAGQKOPVMSA-HNNXBMFYSA-N 0 0 358.442 3.973 20 5 FHBDRN CCc1ccc2nc(NC(=O)c3n[nH]c(C(C)C)c3[N+](=O)[O-])sc2c1 ZINC000434245922 942546495 /nfs/dbraw/zinc/54/64/95/942546495.db2.gz ZRTRMFYTYJBIKE-UHFFFAOYSA-N 0 0 359.411 3.866 20 5 FHBDRN Cc1ccc(C(C)(C)CN(C)C(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])cc1 ZINC000434251258 942550045 /nfs/dbraw/zinc/55/00/45/942550045.db2.gz VCBVTPKKLPEXPX-UHFFFAOYSA-N 0 0 358.442 3.800 20 5 FHBDRN COc1ccccc1C(C)(C)C(=O)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000513840200 942552072 /nfs/dbraw/zinc/55/20/72/942552072.db2.gz YSRDGPIXIVQTTG-UHFFFAOYSA-N 0 0 354.406 3.860 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@](C)(COC)C1 ZINC000452362068 942552113 /nfs/dbraw/zinc/55/21/13/942552113.db2.gz NARAVSYIETUXGS-QGZVFWFLSA-N 0 0 352.456 3.596 20 5 FHBDRN C[C@]1(CCc2ccccc2)CCN(C(=O)COc2ccccc2[N+](=O)[O-])C1 ZINC000434256010 942552288 /nfs/dbraw/zinc/55/22/88/942552288.db2.gz KWLQWUSGBBVOKO-NRFANRHFSA-N 0 0 368.433 3.845 20 5 FHBDRN C[C@@H]1[C@@H](c2ccccc2)CCN1C(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000434258033 942552808 /nfs/dbraw/zinc/55/28/08/942552808.db2.gz WOZACBDHGWLVOW-WBVHZDCISA-N 0 0 353.422 3.801 20 5 FHBDRN C[C@@H](CNC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1)CC(F)(F)F ZINC000413754522 942558990 /nfs/dbraw/zinc/55/89/90/942558990.db2.gz ZSODBKYGMCJGNC-LLVKDONJSA-N 0 0 359.348 3.857 20 5 FHBDRN CC(C)c1ccc(CNc2ccccc2O[C@H]2CC(=O)N2)cc1[N+](=O)[O-] ZINC000421412297 942560169 /nfs/dbraw/zinc/56/01/69/942560169.db2.gz SITCPXKNHTXTAG-IBGZPJMESA-N 0 0 355.394 3.555 20 5 FHBDRN Cc1ccc2oc(SCC(=O)N(C)c3ccc([N+](=O)[O-])cc3)nc2c1 ZINC000072626854 942560954 /nfs/dbraw/zinc/56/09/54/942560954.db2.gz HBDFPSXZZOKREF-UHFFFAOYSA-N 0 0 357.391 3.800 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N1CCC(OC2CCC2)CC1 ZINC000416260920 942561581 /nfs/dbraw/zinc/56/15/81/942561581.db2.gz UFHZXTBBPZUVDT-UHFFFAOYSA-N 0 0 352.818 3.730 20 5 FHBDRN O=C(Nc1ccc(F)c(C2CC2)c1)N1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1 ZINC000366931306 942563353 /nfs/dbraw/zinc/56/33/53/942563353.db2.gz ZMWGYXFNDBYCLC-CQSZACIVSA-N 0 0 373.388 3.677 20 5 FHBDRN C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)[C@@H](C)CO1 ZINC000501597638 942570337 /nfs/dbraw/zinc/57/03/37/942570337.db2.gz NMRHWNGCYMUYOF-KBPBESRZSA-N 0 0 372.446 3.995 20 5 FHBDRN Cc1ccc(OCCC(=O)OCc2ccc(N(C)C)c([N+](=O)[O-])c2)c(C)c1 ZINC001268938117 942572621 /nfs/dbraw/zinc/57/26/21/942572621.db2.gz YQNYKIGBXHAAHQ-UHFFFAOYSA-N 0 0 372.421 3.790 20 5 FHBDRN O=C(c1n[nH]c2ccc([N+](=O)[O-])cc21)N1CC2(CCCC2)c2ccccc21 ZINC000434308415 942573069 /nfs/dbraw/zinc/57/30/69/942573069.db2.gz VERLVYFRIZCXIV-UHFFFAOYSA-N 0 0 362.389 3.943 20 5 FHBDRN CC1CCN(c2ccc(C(=O)N3CC[C@H](C)[C@@H](C)C3)cc2[N+](=O)[O-])CC1 ZINC000501613224 942574870 /nfs/dbraw/zinc/57/48/70/942574870.db2.gz BZIDIEAVOBYTMY-HOTGVXAUSA-N 0 0 359.470 3.949 20 5 FHBDRN CN(C)c1cccc(COC(=O)CCc2c(Cl)cccc2[N+](=O)[O-])c1 ZINC001126423596 942581447 /nfs/dbraw/zinc/58/14/47/942581447.db2.gz JVJSSHNAUAHTKI-UHFFFAOYSA-N 0 0 362.813 3.990 20 5 FHBDRN CNC(=O)c1ccc(Nc2cccc(Oc3ccccn3)c2)c([N+](=O)[O-])c1 ZINC000078689970 942583192 /nfs/dbraw/zinc/58/31/92/942583192.db2.gz NUAAKKWUFLDKCF-UHFFFAOYSA-N 0 0 364.361 3.885 20 5 FHBDRN COc1cccc(C2=CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4o3)C2)c1 ZINC000501639906 942583909 /nfs/dbraw/zinc/58/39/09/942583909.db2.gz HTDQKGXZFALLPU-UHFFFAOYSA-N 0 0 364.357 3.889 20 5 FHBDRN COCC1CCC(NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)CC1 ZINC000413778605 942586873 /nfs/dbraw/zinc/58/68/73/942586873.db2.gz DARVZMQSLYMWEK-UHFFFAOYSA-N 0 0 363.458 3.720 20 5 FHBDRN CCNc1ccc(C(=O)N[C@H](C)c2cc(F)ccc2OC)cc1[N+](=O)[O-] ZINC000501658584 942589890 /nfs/dbraw/zinc/58/98/90/942589890.db2.gz NCUUARUKOKFYDE-LLVKDONJSA-N 0 0 361.373 3.665 20 5 FHBDRN CC[C@H]1CCCC[C@@H]1CNC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000452417015 942594400 /nfs/dbraw/zinc/59/44/00/942594400.db2.gz IQYMJKJVUSIUDI-QWHCGFSZSA-N 0 0 357.410 3.795 20 5 FHBDRN CCOC(=O)Cc1cccc(NC(=O)c2cc([N+](=O)[O-])c(C)cc2C)c1 ZINC000421487847 942602545 /nfs/dbraw/zinc/60/25/45/942602545.db2.gz ZVOIJQVAELPTJW-UHFFFAOYSA-N 0 0 356.378 3.570 20 5 FHBDRN O=C(c1ccc(F)cc1C(F)(F)F)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000120233208 942607006 /nfs/dbraw/zinc/60/70/06/942607006.db2.gz MDEKDLIJWPCCHI-UHFFFAOYSA-N 0 0 354.259 3.956 20 5 FHBDRN COc1ccc(CNC(=O)[C@@H]2C[C@@H]2c2cccc(Cl)c2)cc1[N+](=O)[O-] ZINC000501678702 942607483 /nfs/dbraw/zinc/60/74/83/942607483.db2.gz MHXHQPSCBYCIBY-HUUCEWRRSA-N 0 0 360.797 3.677 20 5 FHBDRN O=C(Nc1cccc2c1CN(c1nccs1)C2)c1cccc([N+](=O)[O-])c1 ZINC000366976941 942620317 /nfs/dbraw/zinc/62/03/17/942620317.db2.gz KMBWNMUZRRSXOZ-UHFFFAOYSA-N 0 0 366.402 3.824 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1OC(=O)Cc1ccc(C(F)(F)F)cc1 ZINC000016444643 942632541 /nfs/dbraw/zinc/63/25/41/942632541.db2.gz PRPUYWSLRASJEO-UHFFFAOYSA-N 0 0 355.268 3.770 20 5 FHBDRN C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])c(F)cc2N)CC[C@H]1c1ccccc1 ZINC000366980903 942642301 /nfs/dbraw/zinc/64/23/01/942642301.db2.gz IIBZYVLFFRDIBM-GXTWGEPZSA-N 0 0 357.385 3.582 20 5 FHBDRN O=C(CCCc1ccccn1)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000181945995 942645505 /nfs/dbraw/zinc/64/55/05/942645505.db2.gz NGNVOIXQHVHXOK-UHFFFAOYSA-N 0 0 353.300 3.970 20 5 FHBDRN CC(C)c1[nH]nc(C(=O)N2C[C@@H](C(C)C)Nc3ccccc32)c1[N+](=O)[O-] ZINC000434395522 942646021 /nfs/dbraw/zinc/64/60/21/942646021.db2.gz PDWVDRZSQMGWED-ZDUSSCGKSA-N 0 0 357.414 3.538 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N2CCOC3(C2)CCCCCC3)c1 ZINC000120246888 942647688 /nfs/dbraw/zinc/64/76/88/942647688.db2.gz DCKXALAEEMAUKJ-UHFFFAOYSA-N 0 0 364.467 3.882 20 5 FHBDRN CC(C)c1nc([C@@H]2COCCN2Cc2ccc(C(C)C)c([N+](=O)[O-])c2)no1 ZINC000501753657 942652724 /nfs/dbraw/zinc/65/27/24/942652724.db2.gz QMGCLFDNIFGMJZ-KRWDZBQOSA-N 0 0 374.441 3.798 20 5 FHBDRN COC(=O)c1c(C)c(C)sc1NC(=S)Nc1ccc([N+](=O)[O-])cc1 ZINC000006960949 942656902 /nfs/dbraw/zinc/65/69/02/942656902.db2.gz LKHZLBGIRZGNTB-UHFFFAOYSA-N 0 0 365.436 3.869 20 5 FHBDRN O=[N+]([O-])c1ccc(N[C@@H]2CCO[C@@H](c3ccncc3)C2)c2cccnc21 ZINC000413319177 942658553 /nfs/dbraw/zinc/65/85/53/942658553.db2.gz OFKCRQLUIHQZKY-RDTXWAMCSA-N 0 0 350.378 3.870 20 5 FHBDRN Cc1ccc(C)c(S(=O)(=O)N2CCc3cccc(Cl)c32)c1[N+](=O)[O-] ZINC000616410128 942662218 /nfs/dbraw/zinc/66/22/18/942662218.db2.gz ZCXMOWRMJFSVMX-UHFFFAOYSA-N 0 0 366.826 3.616 20 5 FHBDRN O=[N+]([O-])c1ccc(N[C@@H]2[C@H]3CCO[C@@H]3C23CCC3)c(Br)c1 ZINC000513983391 942662645 /nfs/dbraw/zinc/66/26/45/942662645.db2.gz OPFSKICKWVGYLM-HONMWMINSA-N 0 0 353.216 3.727 20 5 FHBDRN O=C(N[C@@H](c1nccs1)C(F)(F)F)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412360349 942662870 /nfs/dbraw/zinc/66/28/70/942662870.db2.gz JFPGMTLHCBOOTO-TUAOUCFPSA-N 0 0 371.340 3.575 20 5 FHBDRN COc1cc(C(=O)NC2(Cc3ccccc3)CCC2)cc([N+](=O)[O-])c1OC ZINC000472972344 942664007 /nfs/dbraw/zinc/66/40/07/942664007.db2.gz YRUSPJPKTCTCFT-UHFFFAOYSA-N 0 0 370.405 3.507 20 5 FHBDRN O=C(N[C@@H](CO)CC1CCCCC1)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000416326768 942664577 /nfs/dbraw/zinc/66/45/77/942664577.db2.gz NFWZVMCUEZFJAD-GFCCVEGCSA-N 0 0 374.359 3.675 20 5 FHBDRN O=[N+]([O-])c1cnc(N[C@H]2CCO[C@@H](c3ccncc3)C2)c(C(F)(F)F)c1 ZINC000413325488 942665280 /nfs/dbraw/zinc/66/52/80/942665280.db2.gz VSONDPDGQAZWFD-SMDDNHRTSA-N 0 0 368.315 3.736 20 5 FHBDRN COCCOc1ccc(F)cc1NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000413330838 942667524 /nfs/dbraw/zinc/66/75/24/942667524.db2.gz GWXSWUSQEZXOMY-JKSUJKDBSA-N 0 0 374.368 3.501 20 5 FHBDRN O=C(N[C@@H]1CCC[C@H]1OC(F)F)c1c([N+](=O)[O-])cccc1C(F)(F)F ZINC000501776886 942668135 /nfs/dbraw/zinc/66/81/35/942668135.db2.gz BSKXLKXKHRXBOJ-PSASIEDQSA-N 0 0 368.258 3.504 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(N2CCC3(CC2)OCCc2ccccc23)c1 ZINC000413338101 942675181 /nfs/dbraw/zinc/67/51/81/942675181.db2.gz SOFNPXYXMLHKOR-UHFFFAOYSA-N 0 0 354.406 3.672 20 5 FHBDRN Cc1cc(F)c(S(=O)(=O)Cc2ccc(Cl)cc2[N+](=O)[O-])cc1F ZINC000549425206 942678060 /nfs/dbraw/zinc/67/80/60/942678060.db2.gz MQXPGPZPKQKMIL-UHFFFAOYSA-N 0 0 361.753 3.809 20 5 FHBDRN O=[N+]([O-])c1ccc([C@@H]2C[C@H]2c2nc(Cc3ccc4c(c3)OCO4)no2)cc1 ZINC000420477411 942678935 /nfs/dbraw/zinc/67/89/35/942678935.db2.gz MNTWYHVZNSEOLY-LSDHHAIUSA-N 0 0 365.345 3.568 20 5 FHBDRN CC[C@H](C(=O)N1CCC(Nc2ccncc2[N+](=O)[O-])CC1)c1ccccc1 ZINC000066811630 942679067 /nfs/dbraw/zinc/67/90/67/942679067.db2.gz ONIBEYALQNFKQZ-KRWDZBQOSA-N 0 0 368.437 3.587 20 5 FHBDRN CCc1nc(C(C)C)ccc1C(=O)NCCNc1ccccc1[N+](=O)[O-] ZINC000549425059 942680551 /nfs/dbraw/zinc/68/05/51/942680551.db2.gz AOZGWUNCSJDISM-UHFFFAOYSA-N 0 0 356.426 3.518 20 5 FHBDRN CSc1cccc(C(=O)NC[C@@H]2CC23CCSCC3)c1[N+](=O)[O-] ZINC000421590217 942686538 /nfs/dbraw/zinc/68/65/38/942686538.db2.gz MQFGHELXUFQKEJ-NSHDSACASA-N 0 0 352.481 3.580 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H](c1ccccc1)[C@H]1CCOC1 ZINC000378380758 942688007 /nfs/dbraw/zinc/68/80/07/942688007.db2.gz WCNOQFDWWYBDKN-YJBOKZPZSA-N 0 0 355.394 3.803 20 5 FHBDRN O=[N+]([O-])c1ccc2nc(N3CCO[C@H](c4ccc(F)c(F)c4)C3)ccc2c1 ZINC000066815290 942695382 /nfs/dbraw/zinc/69/53/82/942695382.db2.gz JLEAJBLLNAXKPU-SFHVURJKSA-N 0 0 371.343 3.999 20 5 FHBDRN CC(C)(CNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])C1=CCCC1 ZINC000413341637 942696465 /nfs/dbraw/zinc/69/64/65/942696465.db2.gz ULAGJUNJSMHKLM-UHFFFAOYSA-N 0 0 373.453 3.616 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(Cc2noc([C@@H]3C[C@]3(F)c3ccccc3)n2)c1 ZINC000420491072 942697066 /nfs/dbraw/zinc/69/70/66/942697066.db2.gz DQVQALZHQQBAOJ-KXBFYZLASA-N 0 0 369.352 3.930 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(Cc2noc([C@@H]3C[C@H]3c3cccc(O)c3)n2)c1 ZINC000420491133 942697239 /nfs/dbraw/zinc/69/72/39/942697239.db2.gz FOQUZDLFJLTMFZ-JKSUJKDBSA-N 0 0 367.361 3.554 20 5 FHBDRN O=C(N[C@H](c1ccccc1)[C@@H]1CCOC1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000378387803 942699557 /nfs/dbraw/zinc/69/95/57/942699557.db2.gz LIXCBDCRTZRYAY-CXAGYDPISA-N 0 0 360.797 3.756 20 5 FHBDRN Cc1cnc(-c2cccc(NC(=O)CCNc3ccccc3[N+](=O)[O-])c2)o1 ZINC000066809560 942701511 /nfs/dbraw/zinc/70/15/11/942701511.db2.gz HAHOLGLWPITNFN-UHFFFAOYSA-N 0 0 366.377 3.999 20 5 FHBDRN C[C@@H]1CCCN(c2ccc(C(=O)N3CC(CC(F)F)C3)cc2[N+](=O)[O-])C1 ZINC000425084676 942702047 /nfs/dbraw/zinc/70/20/47/942702047.db2.gz IUWRIRNYFMFLQA-GFCCVEGCSA-N 0 0 367.396 3.558 20 5 FHBDRN O=[N+]([O-])c1ccccc1NCCc1noc([C@@H]2C[C@H]2c2cccc(O)c2)n1 ZINC000420507237 942709534 /nfs/dbraw/zinc/70/95/34/942709534.db2.gz VLZWTMLRSHTOMJ-LSDHHAIUSA-N 0 0 366.377 3.609 20 5 FHBDRN CC1(C)CC[C@@H](c2noc(CCn3cc([N+](=O)[O-])cn3)n2)c2ccccc21 ZINC000420512332 942716910 /nfs/dbraw/zinc/71/69/10/942716910.db2.gz WJHGYWHOSLJYLM-OAHLLOKOSA-N 0 0 367.409 3.620 20 5 FHBDRN O=C(c1cc2cc([N+](=O)[O-])ccc2o1)N1CCO[C@@H](c2ccccc2)C1 ZINC000514074793 942719769 /nfs/dbraw/zinc/71/97/69/942719769.db2.gz UVRYIJPBVQUCHK-GOSISDBHSA-N 0 0 352.346 3.555 20 5 FHBDRN Cc1cc(NC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)cn2ccnc12 ZINC000502773639 942733430 /nfs/dbraw/zinc/73/34/30/942733430.db2.gz LFEPOEGEOXHZAR-UHFFFAOYSA-N 0 0 368.396 3.890 20 5 FHBDRN O=[N+]([O-])c1cc(CN2CCOC[C@@H]2c2nc3ccccc3s2)cs1 ZINC000502791199 942745033 /nfs/dbraw/zinc/74/50/33/942745033.db2.gz SCOLDQWSCSRCJQ-CYBMUJFWSA-N 0 0 361.448 3.840 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)cnc1N[C@H](CO)c1ccc(Br)cc1 ZINC000502794744 942747126 /nfs/dbraw/zinc/74/71/26/942747126.db2.gz VPPYNOYMFGZILA-LLVKDONJSA-N 0 0 372.606 3.551 20 5 FHBDRN CC(C)N(C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2)[C@@H](C)c1ccsc1 ZINC000421694151 942748384 /nfs/dbraw/zinc/74/83/84/942748384.db2.gz UIUQZZWKFMRTHC-NSHDSACASA-N 0 0 362.407 3.997 20 5 FHBDRN CC(C)(C)Oc1cccc(CNc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)n1 ZINC000502799321 942751571 /nfs/dbraw/zinc/75/15/71/942751571.db2.gz KBMPFCCAJNRXSJ-UHFFFAOYSA-N 0 0 370.409 3.664 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N(c1ccccc1)[C@@H](C)c1ccccc1 ZINC000502781307 942754526 /nfs/dbraw/zinc/75/45/26/942754526.db2.gz PNMGTJXSPBHHMA-HNNXBMFYSA-N 0 0 364.405 3.894 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)NCCC1Cc2ccccc2C1 ZINC000511548339 942755060 /nfs/dbraw/zinc/75/50/60/942755060.db2.gz UYIHRCMSBPWJPM-UHFFFAOYSA-N 0 0 367.449 3.584 20 5 FHBDRN COc1cccc([C@@H]2C[C@@H](O)CN2Cc2c(Cl)cccc2[N+](=O)[O-])c1 ZINC000502806423 942759344 /nfs/dbraw/zinc/75/93/44/942759344.db2.gz YPDUQJJCWMZZFT-ACJLOTCBSA-N 0 0 362.813 3.565 20 5 FHBDRN COc1ccc([C@@H]2CCN(C(=O)c3c(Cl)cccc3[N+](=O)[O-])C2)cc1 ZINC000110265517 942761053 /nfs/dbraw/zinc/76/10/53/942761053.db2.gz RFSUKVKIOCEWHK-CYBMUJFWSA-N 0 0 360.797 3.887 20 5 FHBDRN Cc1cc(NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)cn2ccnc12 ZINC000502808252 942761059 /nfs/dbraw/zinc/76/10/59/942761059.db2.gz DZXLROUMSRZIFO-UHFFFAOYSA-N 0 0 364.283 3.822 20 5 FHBDRN COc1cc(C(=O)Nc2ccc3c(c2)C(=O)CCCC3)c([N+](=O)[O-])cc1F ZINC000421715027 942766550 /nfs/dbraw/zinc/76/65/50/942766550.db2.gz LPAHQMSDCHMTCH-UHFFFAOYSA-N 0 0 372.352 3.904 20 5 FHBDRN C[C@@]1(CCc2ccccc2)CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2N)C1 ZINC000434590541 942772946 /nfs/dbraw/zinc/77/29/46/942772946.db2.gz ADQODDUYAFYAQO-HXUWFJFHSA-N 0 0 371.412 3.801 20 5 FHBDRN Cc1c(C(=O)N(C)c2ccc(C(=O)NC(C)(C)C)cc2)cccc1[N+](=O)[O-] ZINC000413919684 942778647 /nfs/dbraw/zinc/77/86/47/942778647.db2.gz GHIZMHSDQSEYIP-UHFFFAOYSA-N 0 0 369.421 3.708 20 5 FHBDRN CC[C@H]1C[C@@H](CC(=O)Nc2cc(C)nn2-c2ccc([N+](=O)[O-])cc2)CCO1 ZINC000514156753 942789890 /nfs/dbraw/zinc/78/98/90/942789890.db2.gz WTSDBUBLMTVLRH-YOEHRIQHSA-N 0 0 372.425 3.623 20 5 FHBDRN O=C(c1ccc(OC(F)F)c([N+](=O)[O-])c1)N1CCSc2ccccc21 ZINC000514170459 942798232 /nfs/dbraw/zinc/79/82/32/942798232.db2.gz RABKIQMZDXTUCA-UHFFFAOYSA-N 0 0 366.345 3.949 20 5 FHBDRN CN1Cc2c(cccc2NC(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)C1=O ZINC000413934738 942804731 /nfs/dbraw/zinc/80/47/31/942804731.db2.gz SOWNNZPJUYXQLG-UHFFFAOYSA-N 0 0 367.405 3.730 20 5 FHBDRN CC(C)c1ccc(C(=O)N2C[C@H](O)C[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000413936197 942805236 /nfs/dbraw/zinc/80/52/36/942805236.db2.gz HKEWJYJCCSPNJP-AEFFLSMTSA-N 0 0 354.406 3.666 20 5 FHBDRN C[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514195699 942807099 /nfs/dbraw/zinc/80/70/99/942807099.db2.gz SJCRGTNNBORIIH-WZRBSPASSA-N 0 0 354.353 3.989 20 5 FHBDRN CCCOc1ccc(C(=O)Oc2ccc(OC)c([N+](=O)[O-])c2)c(OC)c1 ZINC001269176463 942809592 /nfs/dbraw/zinc/80/95/92/942809592.db2.gz RWJTWPTUSHFYEV-UHFFFAOYSA-N 0 0 361.350 3.620 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCO[C@@H](c2ccccc2F)C1 ZINC000421763894 942810869 /nfs/dbraw/zinc/81/08/69/942810869.db2.gz SCGKPWLGVVAJPE-GOSISDBHSA-N 0 0 358.369 3.564 20 5 FHBDRN CCN(C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)[C@@H](C)c1cccnc1 ZINC000514190390 942817382 /nfs/dbraw/zinc/81/73/82/942817382.db2.gz RQVAREDNMHYEIB-NSHDSACASA-N 0 0 365.336 3.815 20 5 FHBDRN Cn1ncc([N+](=O)[O-])c1NC(=O)c1ccc(Oc2ccc(F)c(F)c2)cc1 ZINC001269828022 942824959 /nfs/dbraw/zinc/82/49/59/942824959.db2.gz MMCIRBSRYGPWFJ-UHFFFAOYSA-N 0 0 374.303 3.651 20 5 FHBDRN O=C([C@H]1CCc2ccccc2O1)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000412374353 942828323 /nfs/dbraw/zinc/82/83/23/942828323.db2.gz DRYUSXGTYUEUJU-YLJYHZDGSA-N 0 0 366.417 3.695 20 5 FHBDRN Cn1c(SCc2c(F)cc([N+](=O)[O-])cc2F)nnc1-c1ccco1 ZINC000505456237 942831595 /nfs/dbraw/zinc/83/15/95/942831595.db2.gz XKACLDGDJSRMAR-UHFFFAOYSA-N 0 0 352.322 3.554 20 5 FHBDRN Cc1ccccc1[C@@]1(F)CCN(Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000502908777 942832646 /nfs/dbraw/zinc/83/26/46/942832646.db2.gz IHMBJXPGMAOHLU-LJQANCHMSA-N 0 0 354.385 3.850 20 5 FHBDRN C[C@H]1Cc2ccccc2[C@@H]1NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514221265 942833164 /nfs/dbraw/zinc/83/31/64/942833164.db2.gz BUWKKBKOLKBEEC-MGPLVRAMSA-N 0 0 362.332 3.860 20 5 FHBDRN CCC(CC)c1cc(CNC(=O)Nc2ccc([N+](=O)[O-])cc2OC)on1 ZINC000122949739 942836875 /nfs/dbraw/zinc/83/68/75/942836875.db2.gz ILUPKAXPUKKWKN-UHFFFAOYSA-N 0 0 362.386 3.817 20 5 FHBDRN Nc1cccc([N+](=O)[O-])c1C(=O)N1CC[C@@](F)(c2cccc(Cl)c2)C1 ZINC000514229911 942840724 /nfs/dbraw/zinc/84/07/24/942840724.db2.gz UPGHLHXCNFAKGX-KRWDZBQOSA-N 0 0 363.776 3.541 20 5 FHBDRN Cc1cc(NC(=O)c2ccnc(-c3ccccc3)c2[N+](=O)[O-])cn2ccnc12 ZINC000502899172 942841126 /nfs/dbraw/zinc/84/11/26/942841126.db2.gz LWGNKFCTZWAKBE-UHFFFAOYSA-N 0 0 373.372 3.865 20 5 FHBDRN O=C(N[C@@H]1C[C@@H]1c1ccccc1C(F)(F)F)c1csc([N+](=O)[O-])c1 ZINC000505460318 942841914 /nfs/dbraw/zinc/84/19/14/942841914.db2.gz MNQUWRHDHLCTDL-ZYHUDNBSSA-N 0 0 356.325 3.961 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1Oc1ccccc1)N1CCO[C@H]2CCC[C@@H]21 ZINC000514234434 942846182 /nfs/dbraw/zinc/84/61/82/942846182.db2.gz OCFDULZGYMELGH-HKUYNNGSSA-N 0 0 368.389 3.781 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]c(CN[C@H](c3cc(F)ccc3F)C(F)F)nc2c1 ZINC000434680118 942849912 /nfs/dbraw/zinc/84/99/12/942849912.db2.gz HHJXORWAMTWGEB-OAHLLOKOSA-N 0 0 368.290 3.845 20 5 FHBDRN CC(C)Oc1cc(C(=O)NC[C@H]2CCO[C@@H](C(C)C)C2)ccc1[N+](=O)[O-] ZINC000412378036 942852031 /nfs/dbraw/zinc/85/20/31/942852031.db2.gz LFJLEFPYEPKELO-WMLDXEAASA-N 0 0 364.442 3.563 20 5 FHBDRN CC(C)Oc1cc(C(=O)NC[C@@H]2CCO[C@H](C(C)C)C2)ccc1[N+](=O)[O-] ZINC000412378034 942852141 /nfs/dbraw/zinc/85/21/41/942852141.db2.gz LFJLEFPYEPKELO-PBHICJAKSA-N 0 0 364.442 3.563 20 5 FHBDRN O=C(Nc1cc(F)ccc1OC[C@H]1CCCO1)c1csc([N+](=O)[O-])c1 ZINC000170972426 942854374 /nfs/dbraw/zinc/85/43/74/942854374.db2.gz CNOFGCYQXUWYOP-GFCCVEGCSA-N 0 0 366.370 3.606 20 5 FHBDRN O=C(NC[C@@H]1CCO[C@H]1c1ccccc1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000190212323 942858738 /nfs/dbraw/zinc/85/87/38/942858738.db2.gz NGAMDDIQCWVFAR-GUYCJALGSA-N 0 0 360.797 3.756 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@@H](O)c2ccccc2C1 ZINC000378525499 942861566 /nfs/dbraw/zinc/86/15/66/942861566.db2.gz FTMTZVDVIDCLCI-SCLBCKFNSA-N 0 0 372.446 3.541 20 5 FHBDRN O=[N+]([O-])c1cc(CN[C@H](CCO)c2ccccc2Br)cs1 ZINC000514246421 942862242 /nfs/dbraw/zinc/86/22/42/942862242.db2.gz LFMHIDXPTXPPEX-CYBMUJFWSA-N 0 0 371.256 3.632 20 5 FHBDRN C[C@H](Nc1ccc(C(=O)N[C@@H]2C[C@H]3C[C@H]3C2)cc1[N+](=O)[O-])c1ccccn1 ZINC000425133938 942865149 /nfs/dbraw/zinc/86/51/49/942865149.db2.gz FHPNGDJHTSKMLI-HNKHHVNMSA-N 0 0 366.421 3.691 20 5 FHBDRN CC[C@@H](CNC(=O)CCOc1cc(C)ccc1[N+](=O)[O-])CC(F)(F)F ZINC000413997190 942875499 /nfs/dbraw/zinc/87/54/99/942875499.db2.gz BISLZXUFAALSLO-GFCCVEGCSA-N 0 0 362.348 3.767 20 5 FHBDRN CC(C)(C)[C@H]1CCC[C@H]1NC(=O)c1cc([N+](=O)[O-])ccc1SCCO ZINC000413997617 942875968 /nfs/dbraw/zinc/87/59/68/942875968.db2.gz WFEFLVBOVGQESN-LSDHHAIUSA-N 0 0 366.483 3.624 20 5 FHBDRN C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N(C)Cc1cccs1 ZINC000016586886 942880901 /nfs/dbraw/zinc/88/09/01/942880901.db2.gz BJVXYQNOJMQGQM-JTQLQIEISA-N 0 0 353.831 3.769 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)CO[C@@H]1CCCc2ccccc21 ZINC000430088094 942882742 /nfs/dbraw/zinc/88/27/42/942882742.db2.gz GKLJLLUSESINGV-QGZVFWFLSA-N 0 0 356.378 3.636 20 5 FHBDRN O=[N+]([O-])c1cc(CNc2ccc(Cl)c(CN3CCOCC3)c2)cs1 ZINC000430087761 942882794 /nfs/dbraw/zinc/88/27/94/942882794.db2.gz VABCSEUQBKFTAX-UHFFFAOYSA-N 0 0 367.858 3.754 20 5 FHBDRN O=C(Cc1cccc([N+](=O)[O-])c1)N[C@H]1CCCc2cn(C3CCCC3)nc21 ZINC000378552974 942883891 /nfs/dbraw/zinc/88/38/91/942883891.db2.gz NSOROAPIVMFWHX-SFHVURJKSA-N 0 0 368.437 3.643 20 5 FHBDRN Cc1c(C(=O)Nc2ccc([N+](=O)[O-])c(C)n2)cnn1-c1ccccc1Cl ZINC000133613511 942884244 /nfs/dbraw/zinc/88/42/44/942884244.db2.gz UWIZKYABIGVCGG-UHFFFAOYSA-N 0 0 371.784 3.698 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2CCC[C@@H](CC(F)(F)F)C2)c1 ZINC000421940426 942897362 /nfs/dbraw/zinc/89/73/62/942897362.db2.gz MTFAPUXKQHHFQT-ZDUSSCGKSA-N 0 0 374.359 3.863 20 5 FHBDRN NC(=O)c1ccc(CN(C/C=C/c2ccccc2[N+](=O)[O-])C2CC2)c(F)c1 ZINC000430092110 942903777 /nfs/dbraw/zinc/90/37/77/942903777.db2.gz WWLPNIXJCGEXCB-HWKANZROSA-N 0 0 369.396 3.511 20 5 FHBDRN COc1cc(C(=O)N2CCC[C@@H](CC(F)(F)F)C2)cc([N+](=O)[O-])c1C ZINC000421952542 942904757 /nfs/dbraw/zinc/90/47/57/942904757.db2.gz DTALXWJHASAAHY-NSHDSACASA-N 0 0 360.332 3.716 20 5 FHBDRN C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1cncc(-c2ccccn2)c1 ZINC000378574761 942905633 /nfs/dbraw/zinc/90/56/33/942905633.db2.gz CRURODSEFSBXSI-ZDUSSCGKSA-N 0 0 360.373 3.643 20 5 FHBDRN CCOc1ccc(C(=O)N2C[C@@H]3CCC(=O)c4cccc2c43)cc1[N+](=O)[O-] ZINC000183840240 942909974 /nfs/dbraw/zinc/90/99/74/942909974.db2.gz LUTZRIMQWWBLRG-ZDUSSCGKSA-N 0 0 366.373 3.714 20 5 FHBDRN CC[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)C[C@@H](CC)O1 ZINC000421973988 942911595 /nfs/dbraw/zinc/91/15/95/942911595.db2.gz LDKJSMGMVBCXEO-VXGBXAGGSA-N 0 0 360.332 3.643 20 5 FHBDRN CCc1occc1C(=O)N[C@@H](CC(=O)OC(C)C)c1ccccc1[N+](=O)[O-] ZINC000430120822 942919032 /nfs/dbraw/zinc/91/90/32/942919032.db2.gz HXYGBJVEVGOCOC-HNNXBMFYSA-N 0 0 374.393 3.563 20 5 FHBDRN CC[C@H]1CN(C(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C[C@H](CC)O1 ZINC000421989986 942922657 /nfs/dbraw/zinc/92/26/57/942922657.db2.gz WLKUSKRXPHIHIE-KBPBESRZSA-N 0 0 360.332 3.643 20 5 FHBDRN Cc1nn(CCC(=O)N2CCC[C@H]2/C=C/c2ccccc2)c(C)c1[N+](=O)[O-] ZINC000378589615 942925351 /nfs/dbraw/zinc/92/53/51/942925351.db2.gz OQKHPFNNVBUVAJ-ZGKFYVQTSA-N 0 0 368.437 3.503 20 5 FHBDRN COc1cc(CSc2nccc(C(F)(F)F)n2)c([N+](=O)[O-])cc1F ZINC000183848330 942928153 /nfs/dbraw/zinc/92/81/53/942928153.db2.gz YEAHMOVLNMJMTO-UHFFFAOYSA-N 0 0 363.292 3.844 20 5 FHBDRN CN([C@@H]1CCC[C@@H]1c1ccccc1)S(=O)(=O)c1ccc([N+](=O)[O-])s1 ZINC000416539557 942929799 /nfs/dbraw/zinc/92/97/99/942929799.db2.gz DMWUGGLWPNIOKO-ZIAGYGMSSA-N 0 0 366.464 3.613 20 5 FHBDRN CC(C)Cn1c(-c2cccc([N+](=O)[O-])c2)nnc1N1CC[C@@H](C2CC2)C1 ZINC000549445640 942932932 /nfs/dbraw/zinc/93/29/32/942932932.db2.gz BXVKISRFKNGMEW-MRXNPFEDSA-N 0 0 355.442 3.746 20 5 FHBDRN Cc1cc(F)c([N+](=O)[O-])cc1C(=O)N[C@@H]1CCO[C@@H](c2ccccc2)C1 ZINC001269854058 942935079 /nfs/dbraw/zinc/93/50/79/942935079.db2.gz NOJQJFQIEUEPSS-RDTXWAMCSA-N 0 0 358.369 3.692 20 5 FHBDRN O=C(c1ccccc1)N1CCC(CNc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000078021352 942946420 /nfs/dbraw/zinc/94/64/20/942946420.db2.gz ICJGRHVUHRRUOW-UHFFFAOYSA-N 0 0 357.385 3.698 20 5 FHBDRN Cc1ccc(NC(=O)NCCCc2nc3ccccc3[nH]2)cc1[N+](=O)[O-] ZINC000104970029 942966700 /nfs/dbraw/zinc/96/67/00/942966700.db2.gz BIABKXRMZDMGHT-UHFFFAOYSA-N 0 0 353.382 3.534 20 5 FHBDRN CC(=O)c1ccc(Nc2ccc(N3CCOC[C@@H]3C)cc2)c([N+](=O)[O-])c1 ZINC000078019899 942969545 /nfs/dbraw/zinc/96/95/45/942969545.db2.gz LSMCVECHBWFBKM-ZDUSSCGKSA-N 0 0 355.394 3.766 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N1CCc2cccc(F)c2C1 ZINC000503119563 942987635 /nfs/dbraw/zinc/98/76/35/942987635.db2.gz NAAIXBNKPMCMEV-UHFFFAOYSA-N 0 0 368.286 3.951 20 5 FHBDRN CCCCCn1cc(CNC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)c(C)n1 ZINC000503121476 942989454 /nfs/dbraw/zinc/98/94/54/942989454.db2.gz WRGPXIMIARDUQI-UHFFFAOYSA-N 0 0 364.833 3.873 20 5 FHBDRN CN(C(=O)c1cc(F)cc(Br)c1)c1ccc([N+](=O)[O-])cc1 ZINC000514433208 943013293 /nfs/dbraw/zinc/01/32/93/943013293.db2.gz HZUCLESLGJMGSH-UHFFFAOYSA-N 0 0 353.147 3.773 20 5 FHBDRN Cc1cc(NC(=O)c2cc3c(s2)CCOC3)c2cc([N+](=O)[O-])ccc2n1 ZINC000183687223 943013925 /nfs/dbraw/zinc/01/39/25/943013925.db2.gz YNYJMQIYEYEKRL-UHFFFAOYSA-N 0 0 369.402 3.838 20 5 FHBDRN CCC[C@@H](NC(=O)NCCNc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000514458932 943021568 /nfs/dbraw/zinc/02/15/68/943021568.db2.gz JLKDHLSNOCPQAW-MRXNPFEDSA-N 0 0 356.426 3.847 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)Nc1cc(OC)c(C)cc1C ZINC000434890770 943022500 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O=C(NCc1cccc(COCc2ccco2)c1)c1ccc([N+](=O)[O-])s1 ZINC000514791441 943293824 /nfs/dbraw/zinc/29/38/24/943293824.db2.gz JTWKLEKOVIWWJY-UHFFFAOYSA-N 0 0 372.402 3.896 20 5 FHBDRN O=C(OCc1ccc([N+](=O)[O-])cc1Br)[C@@H]1CCCCS1 ZINC000783388558 943302708 /nfs/dbraw/zinc/30/27/08/943302708.db2.gz SKFFDGGMQDEOBG-LBPRGKRZSA-N 0 0 360.229 3.686 20 5 FHBDRN CS[C@H]1CCCCN(C(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000435290397 943307103 /nfs/dbraw/zinc/30/71/03/943307103.db2.gz QJHPWFWPTLZWKI-YPMHNXCESA-N 0 0 372.874 3.760 20 5 FHBDRN CO[C@H]1c2ccccc2C[C@H]1NC(=O)Nc1cc(C)c([N+](=O)[O-])cc1C ZINC000417041680 943307538 /nfs/dbraw/zinc/30/75/38/943307538.db2.gz MPVFRXTUEVIKSB-AEFFLSMTSA-N 0 0 355.394 3.646 20 5 FHBDRN CSc1cc(C)ccc1NCC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000417052269 943312816 /nfs/dbraw/zinc/31/28/16/943312816.db2.gz CIQMCHHAAYCTAM-UHFFFAOYSA-N 0 0 357.435 3.626 20 5 FHBDRN Cc1c(NC(=O)N[C@H](C)CC2CC2)cc(Br)cc1[N+](=O)[O-] ZINC000435326031 943326184 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FHBDRN C[C@@H](NC(=O)N[C@@H]1CCCc2cc(N)ccc21)c1cccc([N+](=O)[O-])c1 ZINC000417136914 943374265 /nfs/dbraw/zinc/37/42/65/943374265.db2.gz LNEGHVXIANHRJQ-KZULUSFZSA-N 0 0 354.410 3.615 20 5 FHBDRN Cc1cccc(O[C@H]2CCCC[C@H]2NC(=O)Cc2ccccc2[N+](=O)[O-])c1 ZINC000435407662 943383172 /nfs/dbraw/zinc/38/31/72/943383172.db2.gz MCVQGEIQCDEINS-QUCCMNQESA-N 0 0 368.433 3.952 20 5 FHBDRN Cc1ccc2c(CCNC(=O)CSc3ccc([N+](=O)[O-])cc3)c[nH]c2c1 ZINC000503854972 943386755 /nfs/dbraw/zinc/38/67/55/943386755.db2.gz BZGUMSPTGRDWCM-UHFFFAOYSA-N 0 0 369.446 3.836 20 5 FHBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1OC1CC1 ZINC000503885292 943401893 /nfs/dbraw/zinc/40/18/93/943401893.db2.gz NOEVTPVXXMHVOK-UHFFFAOYSA-N 0 0 360.797 3.762 20 5 FHBDRN CCOC(=O)C1CCC(CC(=O)N2c3ccc([N+](=O)[O-])cc3C[C@H]2C)CC1 ZINC000514937647 943405857 /nfs/dbraw/zinc/40/58/57/943405857.db2.gz ADRSAVUHNAZIIN-WLYUNCDWSA-N 0 0 374.437 3.632 20 5 FHBDRN COC[C@@H](NCc1cc(OC)c(F)cc1[N+](=O)[O-])c1cccc(Cl)c1 ZINC000514966890 943412866 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FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])NCCc1ccccc1C(F)(F)F ZINC000053235633 943468965 /nfs/dbraw/zinc/46/89/65/943468965.db2.gz FHMVGTFKESZIEW-UHFFFAOYSA-N 0 0 352.312 3.515 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000123000392 943478773 /nfs/dbraw/zinc/47/87/73/943478773.db2.gz PWZFLLOOQODWBH-LLVKDONJSA-N 0 0 374.353 3.703 20 5 FHBDRN COc1cc(C(=O)N2CC[C@H](C)[C@@H]3CCCC[C@@H]32)c([N+](=O)[O-])cc1OC ZINC000515061545 943481168 /nfs/dbraw/zinc/48/11/68/943481168.db2.gz FKRHMYHMBLJNKW-YDHLFZDLSA-N 0 0 362.426 3.653 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2noc([C@@H]3COCC[C@@H]3c3ccccc3)n2)c1 ZINC000417277099 943481817 /nfs/dbraw/zinc/48/18/17/943481817.db2.gz FNCMJBRXOBEGQQ-IAGOWNOFSA-N 0 0 351.362 3.933 20 5 FHBDRN Cc1ccc(CCOC(=O)c2ccc(Cn3cc([N+](=O)[O-])cn3)cc2)cc1 ZINC001126414662 943485623 /nfs/dbraw/zinc/48/56/23/943485623.db2.gz YHPCSJOHZVYSCR-UHFFFAOYSA-N 0 0 365.389 3.548 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)OCc1ccc2c(c1)CCO2 ZINC000728772517 943485945 /nfs/dbraw/zinc/48/59/45/943485945.db2.gz UGRNTSAJHSXWSC-LBPRGKRZSA-N 0 0 359.403 3.754 20 5 FHBDRN CCOc1ccc2c(c1)CCN(C(=O)Nc1cccc([N+](=O)[O-])c1C)C2 ZINC000434216921 943486203 /nfs/dbraw/zinc/48/62/03/943486203.db2.gz OFVLBHYMTDHCDR-UHFFFAOYSA-N 0 0 355.394 3.892 20 5 FHBDRN O=[N+]([O-])c1c(N[C@H]2C[C@@H]2c2ccccc2OC(F)F)nc2sccn21 ZINC000435572382 943493024 /nfs/dbraw/zinc/49/30/24/943493024.db2.gz FDTHZDRQZNUTMP-ZJUUUORDSA-N 0 0 366.349 3.873 20 5 FHBDRN NC(=O)c1ccc(C(=O)OCc2nc3ccccc3c3ccccc23)cc1 ZINC000017163261 943493890 /nfs/dbraw/zinc/49/38/90/943493890.db2.gz MNBKZAQDAWFEFQ-UHFFFAOYSA-N 0 0 356.381 3.844 20 5 FHBDRN Cc1cc(C)c(CNC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)c(C)c1 ZINC000515088540 943495474 /nfs/dbraw/zinc/49/54/74/943495474.db2.gz OZPSKWFOFXXGRL-UHFFFAOYSA-N 0 0 364.405 3.636 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)OCCOC2CCCCC2)cc1SC ZINC000728772213 943495969 /nfs/dbraw/zinc/49/59/69/943495969.db2.gz RRAXCJGURJQTOZ-UHFFFAOYSA-N 0 0 369.439 3.831 20 5 FHBDRN CCNC(=O)c1ccc(C[NH2+][C@H]2CCCCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000417319871 943513558 /nfs/dbraw/zinc/51/35/58/943513558.db2.gz IMMDUZJBAURKMO-FQEVSTJZSA-N 0 0 367.449 3.902 20 5 FHBDRN Cc1cc(F)c([N+](=O)[O-])cc1C(=O)N1CCCO[C@H](c2ccccc2)C1 ZINC001125902200 943520051 /nfs/dbraw/zinc/52/00/51/943520051.db2.gz HJJMQXYZJIJFES-SFHVURJKSA-N 0 0 358.369 3.646 20 5 FHBDRN COc1cccc(C(=O)N(C)[C@H](C)c2c(F)cccc2F)c1[N+](=O)[O-] ZINC000435638799 943522305 /nfs/dbraw/zinc/52/23/05/943522305.db2.gz ULURDYYNZKUBSI-SNVBAGLBSA-N 0 0 350.321 3.715 20 5 FHBDRN Cc1nn(CC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1-c1ccccc1 ZINC000435637756 943522454 /nfs/dbraw/zinc/52/24/54/943522454.db2.gz OGYKRCAJJHYEME-UHFFFAOYSA-N 0 0 350.378 3.714 20 5 FHBDRN O=C(NCCCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1ccccc1 ZINC000504165672 943527509 /nfs/dbraw/zinc/52/75/09/943527509.db2.gz OOAWNFAOBDPXRX-UHFFFAOYSA-N 0 0 367.327 3.846 20 5 FHBDRN O=C(Nc1ccc2ncccc2c1)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000515161858 943530216 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FHBDRN COc1cccc(C(=O)N2CCC(OC3CCCCC3)CC2)c1[N+](=O)[O-] ZINC000435755345 943605208 /nfs/dbraw/zinc/60/52/08/943605208.db2.gz ISZZXQBUPYCAOQ-UHFFFAOYSA-N 0 0 362.426 3.557 20 5 FHBDRN Cc1cc(OCC(=O)Nc2c(F)cccc2NC2CC2)ccc1[N+](=O)[O-] ZINC000435756662 943605335 /nfs/dbraw/zinc/60/53/35/943605335.db2.gz TYQKDGGNSCZKGF-UHFFFAOYSA-N 0 0 359.357 3.634 20 5 FHBDRN CCOc1ccc(CCC(=O)N2c3ccc([N+](=O)[O-])cc3C[C@H]2C)cc1 ZINC000504377002 943609060 /nfs/dbraw/zinc/60/90/60/943609060.db2.gz SPKNDLVEIMQIHI-CQSZACIVSA-N 0 0 354.406 3.904 20 5 FHBDRN COC(=O)[C@@H](C)c1ccc(NC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000417444569 943615623 /nfs/dbraw/zinc/61/56/23/943615623.db2.gz YPFDDOLTASZGEA-QWHCGFSZSA-N 0 0 371.393 3.754 20 5 FHBDRN NC(=O)c1ccnc(N2CCCCC[C@H]2/C=C\c2ccccc2)c1[N+](=O)[O-] ZINC000584788869 943618011 /nfs/dbraw/zinc/61/80/11/943618011.db2.gz NYAJRGRODRCQLX-SNGWPZLWSA-N 0 0 366.421 3.551 20 5 FHBDRN Cc1c(N[C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])cnn1-c1ccccc1 ZINC000126406457 943636314 /nfs/dbraw/zinc/63/63/14/943636314.db2.gz BDSZOILIKNBHII-CYBMUJFWSA-N 0 0 365.393 3.528 20 5 FHBDRN COc1cc(C(=O)NCC2CCC(C)(C)CC2)cc([N+](=O)[O-])c1OC ZINC000536256792 943642836 /nfs/dbraw/zinc/64/28/36/943642836.db2.gz HRASCHINYUEKGC-UHFFFAOYSA-N 0 0 350.415 3.558 20 5 FHBDRN Cn1c(SCc2c(F)cccc2[N+](=O)[O-])nnc1-c1ccccc1F ZINC000504502164 943646849 /nfs/dbraw/zinc/64/68/49/943646849.db2.gz HYYYPHWREMZVPQ-UHFFFAOYSA-N 0 0 362.361 3.961 20 5 FHBDRN C[C@H](OC(=O)Cc1ccc([N+](=O)[O-])cc1Br)c1cccnc1 ZINC000756530785 943694880 /nfs/dbraw/zinc/69/48/80/943694880.db2.gz VWXACMBMIUUWMZ-JTQLQIEISA-N 0 0 365.183 3.599 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@@](C)(c1ccccc1)C(F)(F)F ZINC000504586446 943698295 /nfs/dbraw/zinc/69/82/95/943698295.db2.gz UIVSIWGWUFNRFU-HNNXBMFYSA-N 0 0 353.300 3.506 20 5 FHBDRN COc1cc(C(=O)N[C@](C)(c2ccccc2)C(F)(F)F)ccc1[N+](=O)[O-] ZINC000504586519 943698351 /nfs/dbraw/zinc/69/83/51/943698351.db2.gz UVKDFEZGTUKWFA-MRXNPFEDSA-N 0 0 368.311 3.811 20 5 FHBDRN COc1cnccc1[C@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000504665879 943735542 /nfs/dbraw/zinc/73/55/42/943735542.db2.gz NBUQDYOVDASPGX-VIFPVBQESA-N 0 0 369.299 3.508 20 5 FHBDRN O=C([O-])[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1ccc(C2CCC2)cc1 ZINC000417588675 943736936 /nfs/dbraw/zinc/73/69/36/943736936.db2.gz UXYAECUPPBBVAH-IBGZPJMESA-N 0 0 354.406 3.648 20 5 FHBDRN CCN(CCc1ccc(C(F)(F)F)cc1)C(=O)c1cc([N+](=O)[O-])c[nH]1 ZINC000424114701 943739062 /nfs/dbraw/zinc/73/90/62/943739062.db2.gz RZLRZMNFKWVDFH-UHFFFAOYSA-N 0 0 355.316 3.647 20 5 FHBDRN CCc1ccc(CNC(=O)COc2ccc([N+](=O)[O-])cc2Cl)s1 ZINC000053324652 943744069 /nfs/dbraw/zinc/74/40/69/943744069.db2.gz QGQBIHXURNFPHL-UHFFFAOYSA-N 0 0 354.815 3.567 20 5 FHBDRN Cc1cc(N2CCOC[C@H]2CC2CCC2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000584845867 943756011 /nfs/dbraw/zinc/75/60/11/943756011.db2.gz BSSBXFNNQMRRLP-GOSISDBHSA-N 0 0 368.437 3.756 20 5 FHBDRN CC(C)=CCSC[C@@H]([NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1)C(=O)[O-] ZINC000417621859 943756801 /nfs/dbraw/zinc/75/68/01/943756801.db2.gz GNKBHSVNSBVTEX-MRXNPFEDSA-N 0 0 366.483 3.960 20 5 FHBDRN CC(C)(NC(=O)N[C@@H]1[C@@H]2CCc3ccccc3[C@@H]21)c1ccc([N+](=O)[O-])cc1 ZINC000435790839 943759573 /nfs/dbraw/zinc/75/95/73/943759573.db2.gz NZKYGGHYLJHDIO-CEXWTWQISA-N 0 0 365.433 3.858 20 5 FHBDRN COc1cc(CN(C(=O)[C@H](C)c2cccc([N+](=O)[O-])c2)C2CC2)ccc1O ZINC000516860460 943773058 /nfs/dbraw/zinc/77/30/58/943773058.db2.gz XQZJJFKKMGUFJQ-CYBMUJFWSA-N 0 0 370.405 3.604 20 5 FHBDRN O=C(CO[C@@H]1CCCc2ccccc21)Nc1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000435799626 943776611 /nfs/dbraw/zinc/77/66/11/943776611.db2.gz MJIPTIOVYARKDP-QGZVFWFLSA-N 0 0 366.377 3.504 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])N[C@H]1C[C@H](c2ccccc2F)C1 ZINC000437400718 943776779 /nfs/dbraw/zinc/77/67/79/943776779.db2.gz OVLNNUROMUYKEJ-HDJSIYSDSA-N 0 0 358.369 3.565 20 5 FHBDRN CC(C)CCn1nccc1NC(=O)NC(C)(C)c1ccccc1[N+](=O)[O-] ZINC000515295942 943780503 /nfs/dbraw/zinc/78/05/03/943780503.db2.gz CYQJYHLPFAJTAA-UHFFFAOYSA-N 0 0 359.430 3.894 20 5 FHBDRN COc1ccc(C2CCN(C(=O)c3cccc(OC)c3[N+](=O)[O-])CC2)cc1 ZINC000435806626 943782747 /nfs/dbraw/zinc/78/27/47/943782747.db2.gz GDFPYCVQZPSQRO-UHFFFAOYSA-N 0 0 370.405 3.632 20 5 FHBDRN C[C@@H]([C@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C(=O)[O-])C1CC1 ZINC000417639318 943788804 /nfs/dbraw/zinc/78/88/04/943788804.db2.gz LUHKNOSPKGROGF-DIFFPNOSSA-N 0 0 360.435 3.912 20 5 FHBDRN C[C@H](NC(=O)c1cccc2c(=O)c3cccc(F)c3[nH]c12)c1ccccn1 ZINC000435837452 943791936 /nfs/dbraw/zinc/79/19/36/943791936.db2.gz SYSMYZPZOAWKEK-LBPRGKRZSA-N 0 0 361.376 3.706 20 5 FHBDRN COc1ccc(OCCSCc2sc(C)nc2C)c([N+](=O)[O-])c1 ZINC000437422711 943793941 /nfs/dbraw/zinc/79/39/41/943793941.db2.gz BEUQRJNUPCIZIC-UHFFFAOYSA-N 0 0 354.453 3.989 20 5 FHBDRN CC[C@@H](CSc1ccccc1)NC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000504787475 943795065 /nfs/dbraw/zinc/79/50/65/943795065.db2.gz TXXIBCWBKPXUKM-LBPRGKRZSA-N 0 0 370.434 3.772 20 5 FHBDRN CC[C@H](CSc1ccccc1)NC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000504787474 943795315 /nfs/dbraw/zinc/79/53/15/943795315.db2.gz TXXIBCWBKPXUKM-GFCCVEGCSA-N 0 0 370.434 3.772 20 5 FHBDRN O=C(c1ccc2[nH]c3ccccc3c(=O)c2c1)N1CCc2ccccc2C1 ZINC000435823359 943796847 /nfs/dbraw/zinc/79/68/47/943796847.db2.gz BONCXFCWDSYXTK-UHFFFAOYSA-N 0 0 354.409 3.880 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCC[C@@H](CO)C1 ZINC000516888319 943797701 /nfs/dbraw/zinc/79/77/01/943797701.db2.gz ULKOJKINBXZVQE-UONOGXRCSA-N 0 0 366.483 3.624 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)N[C@H]1C[C@H](c2cccc(F)c2)C1 ZINC000437425148 943797914 /nfs/dbraw/zinc/79/79/14/943797914.db2.gz XNOLTNFAZDOSJB-RZDIXWSQSA-N 0 0 371.412 3.988 20 5 FHBDRN O=C(N[C@H]1C[C@@H]1c1ccccc1OC(F)F)c1ccc([N+](=O)[O-])s1 ZINC000437441368 943801307 /nfs/dbraw/zinc/80/13/07/943801307.db2.gz XCGALGSQWXXBIO-ZJUUUORDSA-N 0 0 354.334 3.544 20 5 FHBDRN CCOc1ccc(/C=C\c2nc(Cc3ccc([N+](=O)[O-])cn3)no2)cc1C ZINC000516893092 943809716 /nfs/dbraw/zinc/80/97/16/943809716.db2.gz SYTCSVDHPTVWNY-UITAMQMPSA-N 0 0 366.377 3.841 20 5 FHBDRN COc1ccc(OC(C)C)c(NC(=O)c2cccc(OC)c2[N+](=O)[O-])c1 ZINC000435855691 943810672 /nfs/dbraw/zinc/81/06/72/943810672.db2.gz KEFFGBLSZLOGAT-UHFFFAOYSA-N 0 0 360.366 3.652 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N1CCc2cc(F)cc(C)c2C1 ZINC000504837418 943824035 /nfs/dbraw/zinc/82/40/35/943824035.db2.gz RUXZZZDMDOUTAF-UHFFFAOYSA-N 0 0 359.357 3.641 20 5 FHBDRN Cc1ccccc1-c1nnc(N(Cc2cccc([N+](=O)[O-])c2)C2CC2)n1C ZINC000584867242 943826653 /nfs/dbraw/zinc/82/66/53/943826653.db2.gz SGWDHOQJYDHPBY-UHFFFAOYSA-N 0 0 363.421 3.868 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N2CCc3c(F)cc(F)cc3C2)c1 ZINC000123013032 943829950 /nfs/dbraw/zinc/82/99/50/943829950.db2.gz TVWWXTQMOIJWGC-UHFFFAOYSA-N 0 0 364.373 3.793 20 5 FHBDRN CCOc1ccc(OC)cc1NCc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000105396830 943831669 /nfs/dbraw/zinc/83/16/69/943831669.db2.gz CTJOXBBLKSSFMQ-UHFFFAOYSA-N 0 0 370.365 3.664 20 5 FHBDRN COc1ccc(Cc2noc(-c3cc4cc([N+](=O)[O-])ccc4o3)n2)cc1 ZINC000504826742 943832513 /nfs/dbraw/zinc/83/25/13/943832513.db2.gz ARAKVQDQMXBEMR-UHFFFAOYSA-N 0 0 351.318 3.990 20 5 FHBDRN CCc1ccccc1CCSc1ccc([N+](=O)[O-])c(S(C)(=O)=O)c1 ZINC000435902483 943837407 /nfs/dbraw/zinc/83/74/07/943837407.db2.gz NZSLNICCHQMYAR-UHFFFAOYSA-N 0 0 365.476 3.896 20 5 FHBDRN CCCN(CC)c1ccc(C(=O)N(C)CCc2ccccc2[N+](=O)[O-])cn1 ZINC000515391659 943837626 /nfs/dbraw/zinc/83/76/26/943837626.db2.gz WVKUSYZKOGGASU-UHFFFAOYSA-N 0 0 370.453 3.541 20 5 FHBDRN C[C@H](NC(=O)COc1ccc(F)c(Cl)c1)c1cccc([N+](=O)[O-])c1 ZINC000053339035 943845007 /nfs/dbraw/zinc/84/50/07/943845007.db2.gz UESORGPRVQZUQL-JTQLQIEISA-N 0 0 352.749 3.644 20 5 FHBDRN O=c1oc2ccc([N+](=O)[O-])cc2n1CCCN(CC1CC1)c1ccccc1 ZINC000437493711 943858053 /nfs/dbraw/zinc/85/80/53/943858053.db2.gz GLUMKPXNMOKMBW-UHFFFAOYSA-N 0 0 367.405 3.809 20 5 FHBDRN Cc1ccc(-c2cc(C(=O)N3CCc4ccc([N+](=O)[O-])cc43)n[nH]2)cc1C ZINC000435942630 943859954 /nfs/dbraw/zinc/85/99/54/943859954.db2.gz CEEXFKWNANHNJA-UHFFFAOYSA-N 0 0 362.389 3.805 20 5 FHBDRN C[C@@H]1CN(C(=O)c2ccc(N3C[C@H](C)C[C@H](C)C3)c([N+](=O)[O-])c2)C[C@H]1C ZINC000435932256 943867073 /nfs/dbraw/zinc/86/70/73/943867073.db2.gz ASOUQHLVQLVZOX-QKPAOTATSA-N 0 0 359.470 3.805 20 5 FHBDRN O=C(c1ccc2[nH]c3ccccc3c(=O)c2c1)N1CCc2sccc2C1 ZINC000435934960 943868836 /nfs/dbraw/zinc/86/88/36/943868836.db2.gz KQKCWYMFUGFIAP-UHFFFAOYSA-N 0 0 360.438 3.941 20 5 FHBDRN Cc1cnc(NC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)c(Br)c1 ZINC000162475580 943869837 /nfs/dbraw/zinc/86/98/37/943869837.db2.gz QZECAPCWSSQHGF-UHFFFAOYSA-N 0 0 370.590 3.966 20 5 FHBDRN COc1cc(C(=O)N[C@H]2C[C@H](c3cc(F)cc(F)c3)C2)ccc1[N+](=O)[O-] ZINC000437512341 943872490 /nfs/dbraw/zinc/87/24/90/943872490.db2.gz CQQIRYDGONPHND-NNUKFRKNSA-N 0 0 362.332 3.558 20 5 FHBDRN CCOc1ccc(C(=O)NCCSc2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000014803977 943875682 /nfs/dbraw/zinc/87/56/82/943875682.db2.gz QXYWLVDZLGWPGR-UHFFFAOYSA-N 0 0 360.435 3.824 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)NCCc1cc(F)c(F)c(F)c1 ZINC000504904353 943902458 /nfs/dbraw/zinc/90/24/58/943902458.db2.gz WVZSHTZJMUMCGV-UHFFFAOYSA-N 0 0 372.730 3.567 20 5 FHBDRN Cc1ccc(NC(=O)N[C@H]2CCC[N@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000504912943 943909588 /nfs/dbraw/zinc/90/95/88/943909588.db2.gz ABZCELBBFXOUGX-SFHVURJKSA-N 0 0 368.437 3.689 20 5 FHBDRN Cc1cc(Cc2noc([C@@H]3CCC(=O)c4ccccc43)n2)ccc1[N+](=O)[O-] ZINC000515479033 943918150 /nfs/dbraw/zinc/91/81/50/943918150.db2.gz VMOFMFQEFMZDPU-MRXNPFEDSA-N 0 0 363.373 3.985 20 5 FHBDRN Cc1cc(Cn2cc([N+](=O)[O-])cc(C)c2=O)nc(-c2ccc(Cl)cc2)n1 ZINC000120272688 943919892 /nfs/dbraw/zinc/91/98/92/943919892.db2.gz HUGLHFKUBLONSI-UHFFFAOYSA-N 0 0 370.796 3.532 20 5 FHBDRN Cc1c(NC(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cnn1CC(C)C ZINC000500000887 943925100 /nfs/dbraw/zinc/92/51/00/943925100.db2.gz PKZQCXDPSBZCHX-ZDUSSCGKSA-N 0 0 359.430 3.947 20 5 FHBDRN CCOc1ccc([C@@H](C)NCc2cc(OC)ccc2OC)cc1[N+](=O)[O-] ZINC000504928772 943925841 /nfs/dbraw/zinc/92/58/41/943925841.db2.gz DJSUINBRFWNADZ-CYBMUJFWSA-N 0 0 360.410 3.862 20 5 FHBDRN COc1cc(NC(=O)N(C)Cc2ccccc2[N+](=O)[O-])c(C)c(OC)c1 ZINC000504950462 943931182 /nfs/dbraw/zinc/93/11/82/943931182.db2.gz RYFAVQZPGZGYOM-UHFFFAOYSA-N 0 0 359.382 3.584 20 5 FHBDRN COc1ccc2c(c1)C[C@@H](C)N(C(=O)c1cccc(OC)c1[N+](=O)[O-])[C@@H]2C ZINC000436020918 943940906 /nfs/dbraw/zinc/94/09/06/943940906.db2.gz MOIHZSGAGJYNHQ-CHWSQXEVSA-N 0 0 370.405 3.760 20 5 FHBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)N1CCN(C2CC2)c2cc(F)ccc21 ZINC001269653542 943950147 /nfs/dbraw/zinc/95/01/47/943950147.db2.gz DVBWPXVFMMHECF-KMKOMSMNSA-N 0 0 367.380 3.763 20 5 FHBDRN COC[C@@H](C)Nc1ccccc1NC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000437588368 943950575 /nfs/dbraw/zinc/95/05/75/943950575.db2.gz HSAKXPNDUAGRIH-GFCCVEGCSA-N 0 0 368.393 3.775 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(OCc2cc3c(cc2Cl)OCCO3)n1 ZINC000517050923 943953257 /nfs/dbraw/zinc/95/32/57/943953257.db2.gz NBMSGRYNYWTHHU-UHFFFAOYSA-N 0 0 350.758 3.610 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2noc(CCc3nc(-c4cccs4)no3)n2)c1 ZINC000505002389 943954909 /nfs/dbraw/zinc/95/49/09/943954909.db2.gz GRAMNMMAYSCUQE-UHFFFAOYSA-N 0 0 369.362 3.542 20 5 FHBDRN O=C(COc1cccc([N+](=O)[O-])c1)N1CCCCc2c(Cl)cccc21 ZINC001267894284 943955562 /nfs/dbraw/zinc/95/55/62/943955562.db2.gz ARVGJOUQAYJANQ-UHFFFAOYSA-N 0 0 360.797 3.997 20 5 FHBDRN COCc1ccc([C@H]2CCCN2C(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)o1 ZINC000515506167 943955773 /nfs/dbraw/zinc/95/57/73/943955773.db2.gz CMPWOFUAQCQEJF-SUMWQHHRSA-N 0 0 358.394 3.801 20 5 FHBDRN COc1cccc(C(=O)Nc2cnn(-c3ccc(Cl)cc3)c2)c1[N+](=O)[O-] ZINC000436018177 943956074 /nfs/dbraw/zinc/95/60/74/943956074.db2.gz DMSHHVJUDGVDFI-UHFFFAOYSA-N 0 0 372.768 3.695 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2noc(/C=C\c3ccc4c(c3)OCCO4)n2)c1 ZINC000504985940 943956889 /nfs/dbraw/zinc/95/68/89/943956889.db2.gz JOMRLVQVLXRRAK-ALCCZGGFSA-N 0 0 351.318 3.586 20 5 FHBDRN COc1cc(NC(=O)c2cccc(OC)c2[N+](=O)[O-])cc(OC)c1C(C)C ZINC000436035732 943960537 /nfs/dbraw/zinc/96/05/37/943960537.db2.gz DSXARLIRDJOODX-UHFFFAOYSA-N 0 0 374.393 3.996 20 5 FHBDRN O=[N+]([O-])c1cc(F)cc(OCc2noc(-c3ccc(F)cc3F)n2)c1 ZINC000436036153 943960637 /nfs/dbraw/zinc/96/06/37/943960637.db2.gz HNKDENGEYZCHFU-UHFFFAOYSA-N 0 0 351.240 3.641 20 5 FHBDRN CC(C)[C@@H](CC(F)(F)F)NC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000566525924 943963653 /nfs/dbraw/zinc/96/36/53/943963653.db2.gz ZIRHCYQDRSPDQY-GFCCVEGCSA-N 0 0 354.275 3.509 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@H](c1ncccc1C)C(C)C ZINC000123040608 943967541 /nfs/dbraw/zinc/96/75/41/943967541.db2.gz RFLXQQBXIUAFQM-INIZCTEOSA-N 0 0 358.398 3.826 20 5 FHBDRN Cc1cc(Br)cc(C)c1CNC(=O)c1ccc([N+](=O)[O-])s1 ZINC000500026038 943969322 /nfs/dbraw/zinc/96/93/22/943969322.db2.gz PAJOYHAFOYBIJW-UHFFFAOYSA-N 0 0 369.240 3.966 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](CCOC)c1ccco1 ZINC000505022456 943974909 /nfs/dbraw/zinc/97/49/09/943974909.db2.gz AYSKQZMGEHDRHS-AWEZNQCLSA-N 0 0 364.423 3.807 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000436070792 943991790 /nfs/dbraw/zinc/99/17/90/943991790.db2.gz WLCGLTSOWSYENO-UHFFFAOYSA-N 0 0 373.368 3.520 20 5 FHBDRN Cc1cc(CN(C)C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)ccc1F ZINC000436081664 943999140 /nfs/dbraw/zinc/99/91/40/943999140.db2.gz KQABNNOPDSFTFA-UHFFFAOYSA-N 0 0 371.412 3.915 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1CN1CCCC[C@@H]1c1cc[nH]n1 ZINC000425460310 944006966 /nfs/dbraw/zinc/00/69/66/944006966.db2.gz RGGHJZCRRZLUNV-CQSZACIVSA-N 0 0 365.231 3.808 20 5 FHBDRN COCCn1cc(-c2nc(-c3ccc([N+](=O)[O-])cc3)no2)c2ccccc21 ZINC000505078258 944021784 /nfs/dbraw/zinc/02/17/84/944021784.db2.gz LDGLGQJRIGBLKB-UHFFFAOYSA-N 0 0 364.361 3.913 20 5 FHBDRN COc1ccc(CSc2nc3nc(C)cc(C)c3c(=O)[nH]2)cc1[N+](=O)[O-] ZINC000515594874 944032119 /nfs/dbraw/zinc/03/21/19/944032119.db2.gz UPJHJGLJKFMFKE-UHFFFAOYSA-N 0 0 372.406 3.556 20 5 FHBDRN C[C@@H](NC(=O)NCc1ccc2c(c1)CCCN2)c1ccccc1[N+](=O)[O-] ZINC000417985109 944038177 /nfs/dbraw/zinc/03/81/77/944038177.db2.gz PKJBPWXAIKZIHY-CYBMUJFWSA-N 0 0 354.410 3.513 20 5 FHBDRN CCN(C(=O)COc1ccc(C=O)cc1[N+](=O)[O-])[C@H](C)c1ccc(F)cc1 ZINC000053441624 944039761 /nfs/dbraw/zinc/03/97/61/944039761.db2.gz TWLQWJSMJYAPOS-CYBMUJFWSA-N 0 0 374.368 3.535 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1ncsc1-c1ccccc1 ZINC000437709341 944050696 /nfs/dbraw/zinc/05/06/96/944050696.db2.gz OYULIRLBEHSQAC-UHFFFAOYSA-N 0 0 353.403 3.991 20 5 FHBDRN CCOC(=O)c1ccccc1NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000014908764 944050724 /nfs/dbraw/zinc/05/07/24/944050724.db2.gz MNHQNJMFQXSGGR-UHFFFAOYSA-N 0 0 369.377 3.598 20 5 FHBDRN CCC[C@]1(C)CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000437709725 944050968 /nfs/dbraw/zinc/05/09/68/944050968.db2.gz MEKPMPKVILKQKA-OAHLLOKOSA-N 0 0 360.863 3.839 20 5 FHBDRN CCOc1cc(NCc2ccccc2CN2CCCC2=O)ccc1[N+](=O)[O-] ZINC000092605921 944053100 /nfs/dbraw/zinc/05/31/00/944053100.db2.gz ZBRNANCQDFVPHS-UHFFFAOYSA-N 0 0 369.421 3.728 20 5 FHBDRN CCOc1cc(C(=O)NCc2ccc([C@H]3C[C@H]3C)o2)c([N+](=O)[O-])cc1OC ZINC000515620383 944054827 /nfs/dbraw/zinc/05/48/27/944054827.db2.gz SUOPGFSDPNOUJA-YPMHNXCESA-N 0 0 374.393 3.649 20 5 FHBDRN C[C@@H]1CCC[C@H](c2noc(-c3cccc([N+](=O)[O-])c3N3CCOCC3)n2)C1 ZINC000566553996 944060437 /nfs/dbraw/zinc/06/04/37/944060437.db2.gz GZHXTNRMQADKGA-KGLIPLIRSA-N 0 0 372.425 3.775 20 5 FHBDRN CN(C)C(=O)Cc1ccc(Nc2ccc([N+](=O)[O-])c(OC(F)F)c2)cc1 ZINC000092611290 944063043 /nfs/dbraw/zinc/06/30/43/944063043.db2.gz JWIBBWYFJARJAB-UHFFFAOYSA-N 0 0 365.336 3.571 20 5 FHBDRN COC(=O)[C@H](C)Sc1ccccc1C(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000515638669 944071745 /nfs/dbraw/zinc/07/17/45/944071745.db2.gz XQCQNMMDYFNAHW-LBPRGKRZSA-N 0 0 374.418 3.809 20 5 FHBDRN C[C@H]1[C@@H](Cc2ccccc2)CCN1C(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000473040788 944083045 /nfs/dbraw/zinc/08/30/45/944083045.db2.gz FJQBLLZCMRRYNL-QFBILLFUSA-N 0 0 367.449 3.800 20 5 FHBDRN CC[C@@H](C)[C@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl)C(F)(F)F ZINC000436190939 944084452 /nfs/dbraw/zinc/08/44/52/944084452.db2.gz XIRLVHSIHYTAPZ-OQPBUACISA-N 0 0 352.740 3.884 20 5 FHBDRN COc1cc(OC)cc(N(C)C(=O)C(C)(C)c2ccccc2[N+](=O)[O-])c1 ZINC000505144384 944089216 /nfs/dbraw/zinc/08/92/16/944089216.db2.gz ZKMWVWZSGOBOEO-UHFFFAOYSA-N 0 0 358.394 3.553 20 5 FHBDRN CC[C@H](C)[C@@H](NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)C(F)(F)F ZINC000436178807 944091625 /nfs/dbraw/zinc/09/16/25/944091625.db2.gz NDNRPZMNEPUYIY-LKFCYVNXSA-N 0 0 359.348 3.876 20 5 FHBDRN C[C@H](C(=O)N1CCN(C2CC2)c2cc(F)ccc21)c1cccc([N+](=O)[O-])c1 ZINC000517212749 944093124 /nfs/dbraw/zinc/09/31/24/944093124.db2.gz ORTQLAGSPRZSNQ-ZDUSSCGKSA-N 0 0 369.396 3.853 20 5 FHBDRN Cc1cc([N+](=O)[O-])cnc1NCc1ccnc(OC2CCC(C)CC2)c1 ZINC000505771382 944103297 /nfs/dbraw/zinc/10/32/97/944103297.db2.gz DFKYRRIDPNIJJJ-UHFFFAOYSA-N 0 0 356.426 3.685 20 5 FHBDRN COC(=O)c1cc(C(C)C)ccc1NC(=O)c1ccc([N+](=O)[O-])c(OC)c1 ZINC000505180972 944113575 /nfs/dbraw/zinc/11/35/75/944113575.db2.gz ZZKIBPWOWPGFMU-UHFFFAOYSA-N 0 0 372.377 3.766 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N1CCC[C@@H](Nc2ccccc2)C1 ZINC000123108904 944118728 /nfs/dbraw/zinc/11/87/28/944118728.db2.gz IIXYQCZTXJAIAL-OAHLLOKOSA-N 0 0 370.409 3.712 20 5 FHBDRN COC(=O)c1sc2ccccc2c1Cn1cc([N+](=O)[O-])c(C2CC2)n1 ZINC000436212156 944120567 /nfs/dbraw/zinc/12/05/67/944120567.db2.gz TVYKMAPVVWVDOX-UHFFFAOYSA-N 0 0 357.391 3.718 20 5 FHBDRN CC(C)COC[C@@H](NC(=O)c1ccc(Cl)cc1[N+](=O)[O-])c1ccco1 ZINC000505196937 944124531 /nfs/dbraw/zinc/12/45/31/944124531.db2.gz LROBSWYRQRPCPA-CQSZACIVSA-N 0 0 366.801 3.985 20 5 FHBDRN C[C@@]1(Cc2ccccc2)CCCN1C(=O)COc1ccccc1[N+](=O)[O-] ZINC000183993937 944124581 /nfs/dbraw/zinc/12/45/81/944124581.db2.gz JYIRCSXISFZTMW-FQEVSTJZSA-N 0 0 354.406 3.597 20 5 FHBDRN C[C@H](C(=O)NC[C@H]1CC[C@H](c2ccccc2)O1)c1ccc([N+](=O)[O-])cc1F ZINC000515702560 944127231 /nfs/dbraw/zinc/12/72/31/944127231.db2.gz OTVMAPSPGPQIAE-URKNILKWSA-N 0 0 372.396 3.874 20 5 FHBDRN C[C@@H](c1ccncc1)N(C)C(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000436243143 944129768 /nfs/dbraw/zinc/12/97/68/944129768.db2.gz OUTHCCGTEFVHSC-AWEZNQCLSA-N 0 0 357.413 3.910 20 5 FHBDRN CCSCc1ccccc1C(=O)NCCNc1ccccc1[N+](=O)[O-] ZINC000436244852 944131307 /nfs/dbraw/zinc/13/13/07/944131307.db2.gz ZVHLUWISVIDSNE-UHFFFAOYSA-N 0 0 359.451 3.690 20 5 FHBDRN O=C(NCCCC(F)(F)F)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000437811899 944134890 /nfs/dbraw/zinc/13/48/90/944134890.db2.gz UOPHSYNDXBFONR-UHFFFAOYSA-N 0 0 357.235 3.660 20 5 FHBDRN CC(C)(C)OC(=O)[C@@]12CCC[C@H]1CN(c1ncc([N+](=O)[O-])cc1Cl)C2 ZINC000517258568 944153142 /nfs/dbraw/zinc/15/31/42/944153142.db2.gz MYCJWESJZJIBLL-APPDUMDISA-N 0 0 367.833 3.591 20 5 FHBDRN CC(C)CCO[C@@H]1CCCC[C@H]1[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000436272404 944170343 /nfs/dbraw/zinc/17/03/43/944170343.db2.gz SKMRQNWWBXWMMV-SJLPKXTDSA-N 0 0 360.458 3.935 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)NCC(C)(C)c1ccccc1F ZINC000506151327 944180502 /nfs/dbraw/zinc/18/05/02/944180502.db2.gz ZABYAQXWTZAPGS-UHFFFAOYSA-N 0 0 361.373 3.842 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)Nc1cccc(NCC(F)(F)F)c1 ZINC000505789254 944180537 /nfs/dbraw/zinc/18/05/37/944180537.db2.gz FCITYVNMZKRDSG-UHFFFAOYSA-N 0 0 369.299 3.830 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000425919116 944184396 /nfs/dbraw/zinc/18/43/96/944184396.db2.gz AUROSDAWZUVZRP-UHFFFAOYSA-N 0 0 353.378 3.694 20 5 FHBDRN Cc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2SCC(C)C)c[nH]c1=O ZINC000162585981 944187825 /nfs/dbraw/zinc/18/78/25/944187825.db2.gz KLPZBCVAUQZWPA-UHFFFAOYSA-N 0 0 361.423 3.592 20 5 FHBDRN CNC(=O)c1ccc(NCCOc2cccc(C(C)(C)C)c2)c([N+](=O)[O-])c1 ZINC000505792977 944200783 /nfs/dbraw/zinc/20/07/83/944200783.db2.gz OBPZRSXGUYPVBM-UHFFFAOYSA-N 0 0 371.437 3.743 20 5 FHBDRN CC(C)(NC(=O)NCCCc1cccc(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000431972088 944209110 /nfs/dbraw/zinc/20/91/10/944209110.db2.gz VMSRPWFNYYBTDH-UHFFFAOYSA-N 0 0 359.401 3.901 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)c1nc(Cl)ccc1F ZINC000758653579 944209651 /nfs/dbraw/zinc/20/96/51/944209651.db2.gz MBNYLZHZZKHDLD-UHFFFAOYSA-N 0 0 351.765 3.833 20 5 FHBDRN O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2ccc([N+](=O)[O-])[nH]2)c1 ZINC000515786073 944212465 /nfs/dbraw/zinc/21/24/65/944212465.db2.gz HPWUQXHEJDXYQD-UHFFFAOYSA-N 0 0 365.349 3.819 20 5 FHBDRN Cc1cc(Nc2cc(C(F)(F)F)ncc2[N+](=O)[O-])nn1[C@@H](C)C1CC1 ZINC000436349433 944231606 /nfs/dbraw/zinc/23/16/06/944231606.db2.gz CPLJNCHDQUVQIF-VIFPVBQESA-N 0 0 355.320 3.650 20 5 FHBDRN CCC(C)(C)NC(=O)c1ccc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2)cc1 ZINC000518284283 944234252 /nfs/dbraw/zinc/23/42/52/944234252.db2.gz CNKPHQRPNSFODK-UHFFFAOYSA-N 0 0 373.384 3.905 20 5 FHBDRN CC(C)[C@@H](CNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1)c1cccnc1 ZINC000426662974 944234528 /nfs/dbraw/zinc/23/45/28/944234528.db2.gz ZESCEDQQHVXVAF-GOSISDBHSA-N 0 0 355.438 3.823 20 5 FHBDRN CCCN(C[C@@H]1CCCCO1)C(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000517351937 944236786 /nfs/dbraw/zinc/23/67/86/944236786.db2.gz ZLJSLLCPIOYBNY-ZBFHGGJFSA-N 0 0 366.483 3.883 20 5 FHBDRN O=C(N[C@@H](c1ccc(F)cc1)[C@@H]1CCCO1)c1cc(F)cc([N+](=O)[O-])c1 ZINC000518286694 944238059 /nfs/dbraw/zinc/23/80/59/944238059.db2.gz JOOWFWMZBIOGCL-IRXDYDNUSA-N 0 0 362.332 3.523 20 5 FHBDRN CC(C)Oc1ccccc1[C@H](C)NC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000517356848 944240086 /nfs/dbraw/zinc/24/00/86/944240086.db2.gz NPUCSIDZCSPGNE-LBPRGKRZSA-N 0 0 368.393 3.749 20 5 FHBDRN CC(=O)Nc1ccc(CCNc2cc(C(F)(F)F)ncc2[N+](=O)[O-])cc1 ZINC000436384504 944254096 /nfs/dbraw/zinc/25/40/96/944254096.db2.gz DXFNANLNJRDMKR-UHFFFAOYSA-N 0 0 368.315 3.622 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)F)cc1NCCc1c[nH]c2ncccc12 ZINC000436387727 944256747 /nfs/dbraw/zinc/25/67/47/944256747.db2.gz KVQJQHHGJIMXPR-UHFFFAOYSA-N 0 0 351.288 3.540 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)F)cc1N1CC[C@H](Nc2ccccc2)C1 ZINC000436387501 944257312 /nfs/dbraw/zinc/25/73/12/944257312.db2.gz LPRZXBQTUUFQLG-LBPRGKRZSA-N 0 0 352.316 3.699 20 5 FHBDRN CC[C@@H](CC(F)(F)F)C(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000518312549 944258215 /nfs/dbraw/zinc/25/82/15/944258215.db2.gz DDMXQHQQJXDQMJ-JTQLQIEISA-N 0 0 357.332 3.713 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NCCc1ccc(SC)cc1 ZINC000436391420 944261259 /nfs/dbraw/zinc/26/12/59/944261259.db2.gz PHXXABLWBGXZIP-UHFFFAOYSA-N 0 0 361.423 3.690 20 5 FHBDRN COc1ccccc1CCN(C)c1cc(C(F)(F)F)ncc1[N+](=O)[O-] ZINC000436393394 944263759 /nfs/dbraw/zinc/26/37/59/944263759.db2.gz RGOSHEHGJIGQBT-UHFFFAOYSA-N 0 0 355.316 3.696 20 5 FHBDRN COc1cc(C)c(NC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)cc1C ZINC000436397664 944273204 /nfs/dbraw/zinc/27/32/04/944273204.db2.gz PSDJJIQPQIJFCU-UHFFFAOYSA-N 0 0 366.377 3.658 20 5 FHBDRN CN(C[C@H]1OCCc2ccccc21)c1cc(C(F)(F)F)ncc1[N+](=O)[O-] ZINC000436400248 944276870 /nfs/dbraw/zinc/27/68/70/944276870.db2.gz IYTHRGOSPVPMLI-OAHLLOKOSA-N 0 0 367.327 3.759 20 5 FHBDRN C/C=C/C[C@H](CO)NC(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000473710416 944278674 /nfs/dbraw/zinc/27/86/74/944278674.db2.gz OSFUVFGULINXQK-XYBNCVKDSA-N 0 0 371.393 3.836 20 5 FHBDRN COC(=O)c1cc(C(=O)Nc2cc(C(C)(C)C)ccc2O)cc([N+](=O)[O-])c1 ZINC000017360976 944282830 /nfs/dbraw/zinc/28/28/30/944282830.db2.gz YSPROQRHFWCRAN-UHFFFAOYSA-N 0 0 372.377 3.637 20 5 FHBDRN Cc1ccc(NC(=O)c2ccc(NC[C@@H]3CC[C@H](O)C3)c([N+](=O)[O-])c2)cc1 ZINC000473714113 944285648 /nfs/dbraw/zinc/28/56/48/944285648.db2.gz BCKSKPWSKLBIPS-PBHICJAKSA-N 0 0 369.421 3.728 20 5 FHBDRN COc1cc(CN2CCC(OCc3ccccc3)CC2)c([N+](=O)[O-])cc1F ZINC000184224164 944286613 /nfs/dbraw/zinc/28/66/13/944286613.db2.gz JJYDUBLZRAMNOZ-UHFFFAOYSA-N 0 0 374.412 3.924 20 5 FHBDRN COc1cc(CN(C)Cc2nc3c(s2)CCCC3)c([N+](=O)[O-])cc1F ZINC000184228986 944288577 /nfs/dbraw/zinc/28/85/77/944288577.db2.gz JXZWCWSTUMKDIC-UHFFFAOYSA-N 0 0 365.430 3.710 20 5 FHBDRN COc1cccc(COCc2noc(/C=C\c3cccc([N+](=O)[O-])c3)n2)c1 ZINC000518344314 944301758 /nfs/dbraw/zinc/30/17/58/944301758.db2.gz KLTBGLWHIKHKFW-HJWRWDBZSA-N 0 0 367.361 3.874 20 5 FHBDRN O=C(N[C@H]1CCc2ccccc2C1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000426271348 944306532 /nfs/dbraw/zinc/30/65/32/944306532.db2.gz NOLJAQSAWIOLLR-SFHVURJKSA-N 0 0 365.433 3.826 20 5 FHBDRN Cc1cc(N2CCC[C@H]([C@@H]3CCOC3)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000439075508 944307862 /nfs/dbraw/zinc/30/78/62/944307862.db2.gz DBJXYIZLGBQHDA-DLBZAZTESA-N 0 0 368.437 3.613 20 5 FHBDRN Cc1sc(S(=O)(=O)N(Cc2ccco2)C2CCCC2)cc1[N+](=O)[O-] ZINC000123233616 944309312 /nfs/dbraw/zinc/30/93/12/944309312.db2.gz LLTFCKOYAHZQPD-UHFFFAOYSA-N 0 0 370.452 3.691 20 5 FHBDRN O=C(NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)NCC1(C2CC2)CC1 ZINC000425943169 944310313 /nfs/dbraw/zinc/31/03/13/944310313.db2.gz IBEAVUCGUUIFIP-UHFFFAOYSA-N 0 0 357.332 3.603 20 5 FHBDRN Cc1ccc(NC[C@H](CO)Cc2cc(F)c(F)c(F)c2)c([N+](=O)[O-])c1 ZINC000436427211 944311554 /nfs/dbraw/zinc/31/15/54/944311554.db2.gz ZXRDKYVFQOTFDU-GFCCVEGCSA-N 0 0 354.328 3.584 20 5 FHBDRN CNC(=O)c1ccc(N2CC=C(c3cccc(C)c3)CC2)c([N+](=O)[O-])c1 ZINC000092696488 944325869 /nfs/dbraw/zinc/32/58/69/944325869.db2.gz FLDYBMGFJRDDFK-UHFFFAOYSA-N 0 0 351.406 3.557 20 5 FHBDRN CC(C)NC(=O)c1ccc(NC[C@H]2CCc3ccccc32)c([N+](=O)[O-])c1 ZINC000518399985 944338956 /nfs/dbraw/zinc/33/89/56/944338956.db2.gz YXCLAZYNDXGXJP-MRXNPFEDSA-N 0 0 353.422 3.875 20 5 FHBDRN O=[N+]([O-])c1cccnc1N[C@H]1CCCN(Cc2ccc(F)cc2Cl)C1 ZINC000518399569 944339633 /nfs/dbraw/zinc/33/96/33/944339633.db2.gz XZVTZYSAMLYNLC-AWEZNQCLSA-N 0 0 364.808 3.859 20 5 FHBDRN COc1ccc([C@@H](Nc2c([N+](=O)[O-])ncn2C)c2ccc(C)cc2)cc1 ZINC000140067459 944341522 /nfs/dbraw/zinc/34/15/22/944341522.db2.gz XJZANHLAGIQLHO-KRWDZBQOSA-N 0 0 352.394 3.847 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1COC(=O)CCOc1cc(C)ccc1C ZINC000025033965 944344129 /nfs/dbraw/zinc/34/41/29/944344129.db2.gz HIKAIOWWXQBUFQ-UHFFFAOYSA-N 0 0 359.378 3.733 20 5 FHBDRN Cc1ccc(OC[C@H](O)COc2cccc(C(F)(F)F)c2)c([N+](=O)[O-])c1 ZINC000550175772 944346041 /nfs/dbraw/zinc/34/60/41/944346041.db2.gz LLXUAPITBLWHEM-CYBMUJFWSA-N 0 0 371.311 3.741 20 5 FHBDRN CCc1nc(C(=O)Oc2ccc(Cc3ccccc3)cc2[N+](=O)[O-])co1 ZINC000126667186 944351334 /nfs/dbraw/zinc/35/13/34/944351334.db2.gz VWUCKFVQUNJDRX-UHFFFAOYSA-N 0 0 352.346 3.955 20 5 FHBDRN CCc1nc2cc(NC(=O)CCNc3ccccc3[N+](=O)[O-])ccc2o1 ZINC000515933707 944353815 /nfs/dbraw/zinc/35/38/15/944353815.db2.gz OUUBVOFBHNZZGO-UHFFFAOYSA-N 0 0 354.366 3.739 20 5 FHBDRN Cc1ccc(OC[C@@H](O)COc2c(Cl)cccc2[N+](=O)[O-])c(C)c1 ZINC000550177228 944354133 /nfs/dbraw/zinc/35/41/33/944354133.db2.gz SSUHIEYSVOSDCA-CYBMUJFWSA-N 0 0 351.786 3.684 20 5 FHBDRN Cc1ccccc1NCCC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000438132808 944358651 /nfs/dbraw/zinc/35/86/51/944358651.db2.gz MSUBLZRRIXUJNV-UHFFFAOYSA-N 0 0 353.422 3.896 20 5 FHBDRN Cc1c(Nc2cc(F)cc([N+](=O)[O-])c2C)c(=O)n(-c2ccccc2)n1C ZINC001167975751 944359200 /nfs/dbraw/zinc/35/92/00/944359200.db2.gz DEQPDRFIHIHEEC-UHFFFAOYSA-N 0 0 356.357 3.584 20 5 FHBDRN C[C@H](c1cccc([N+](=O)[O-])c1)S(=O)(=O)Cc1coc(-c2ccccc2)n1 ZINC000105714725 944359765 /nfs/dbraw/zinc/35/97/65/944359765.db2.gz LNXSHTUWYSOXBZ-CYBMUJFWSA-N 0 0 372.402 3.926 20 5 FHBDRN Cc1ccc(NC(=O)N[C@H](c2cccs2)C(C)(C)CO)cc1[N+](=O)[O-] ZINC000436492481 944360916 /nfs/dbraw/zinc/36/09/16/944360916.db2.gz ZZIXFVMASZUWKF-OAHLLOKOSA-N 0 0 363.439 3.846 20 5 FHBDRN C[C@H](NC(=O)c1c(Cl)cccc1[N+](=O)[O-])[C@H]1Oc2ccccc2[C@H]1C ZINC000438138954 944363503 /nfs/dbraw/zinc/36/35/03/944363503.db2.gz BUXZAKUNMPHHRB-RLFDGXBXSA-N 0 0 360.797 3.931 20 5 FHBDRN COc1cccc(OC(F)(F)F)c1CNc1nc(C)ccc1[N+](=O)[O-] ZINC000518416705 944363707 /nfs/dbraw/zinc/36/37/07/944363707.db2.gz GTIWPOKFYJQILG-UHFFFAOYSA-N 0 0 357.288 3.818 20 5 FHBDRN CC(C)[C@@H](CNC(=O)NCCc1ccc([N+](=O)[O-])cc1)Nc1ccccc1 ZINC000518417373 944363869 /nfs/dbraw/zinc/36/38/69/944363869.db2.gz NVGYLBQZLHNYKR-LJQANCHMSA-N 0 0 370.453 3.573 20 5 FHBDRN C[C@H]1CN(C(=O)c2ccc(Cl)cc2[N+](=O)[O-])C[C@@H](c2ccccc2)O1 ZINC000140074567 944364221 /nfs/dbraw/zinc/36/42/21/944364221.db2.gz YJOPBTGRVWASQN-SJCJKPOMSA-N 0 0 360.797 3.850 20 5 FHBDRN CC(C)NC(=O)c1ccc(N(C)Cc2ccc(F)c(F)c2)c([N+](=O)[O-])c1 ZINC000105750061 944370904 /nfs/dbraw/zinc/37/09/04/944370904.db2.gz HHRDXMSPOMMECP-UHFFFAOYSA-N 0 0 363.364 3.648 20 5 FHBDRN CCCN(C(=O)Cc1cccc(NC(C)=O)c1)c1cccc([N+](=O)[O-])c1 ZINC000425568870 944372581 /nfs/dbraw/zinc/37/25/81/944372581.db2.gz JOVVNCVHOPFAPQ-UHFFFAOYSA-N 0 0 355.394 3.539 20 5 FHBDRN CN(Cc1ccc(Cl)s1)C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000123569056 944373391 /nfs/dbraw/zinc/37/33/91/944373391.db2.gz VPHVYQZMTPASGO-UHFFFAOYSA-N 0 0 363.826 3.992 20 5 FHBDRN Cc1cc(NC(=O)NC[C@H]2CCO[C@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000473765979 944378373 /nfs/dbraw/zinc/37/83/73/944378373.db2.gz QUIHCIXMVNKSBB-QAPCUYQASA-N 0 0 355.394 3.803 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NS(=O)(=O)c1ccc(Cl)cc1C ZINC000473757272 944381317 /nfs/dbraw/zinc/38/13/17/944381317.db2.gz RAFHXVMWKIXPTO-UHFFFAOYSA-N 0 0 354.815 3.974 20 5 FHBDRN COC[C@H](Cc1ccccc1)NC(=O)c1c(C)cc(Cl)cc1[N+](=O)[O-] ZINC000439164182 944386849 /nfs/dbraw/zinc/38/68/49/944386849.db2.gz UAVRWEOBXGQFSD-HNNXBMFYSA-N 0 0 362.813 3.544 20 5 FHBDRN COC[C@@H](Cc1ccccc1)NC(=O)c1c(C)cc(Cl)cc1[N+](=O)[O-] ZINC000439164183 944387134 /nfs/dbraw/zinc/38/71/34/944387134.db2.gz UAVRWEOBXGQFSD-OAHLLOKOSA-N 0 0 362.813 3.544 20 5 FHBDRN COc1ccccc1SCc1nc(Cc2ccccc2[N+](=O)[O-])no1 ZINC000545534602 944388838 /nfs/dbraw/zinc/38/88/38/944388838.db2.gz WJIMXZQSYJYVGI-UHFFFAOYSA-N 0 0 357.391 3.870 20 5 FHBDRN Cc1ccccc1-c1cc(=NC(=O)c2c(C)cc(Cl)cc2[N+](=O)[O-])[nH][nH]1 ZINC000515978179 944390941 /nfs/dbraw/zinc/39/09/41/944390941.db2.gz XTKSGJGUCDJABW-UHFFFAOYSA-N 0 0 370.796 3.929 20 5 FHBDRN COC(=O)Cc1ccccc1NC(=O)c1c(C)cc(Cl)cc1[N+](=O)[O-] ZINC000439167898 944391497 /nfs/dbraw/zinc/39/14/97/944391497.db2.gz KCUIZERTKWOUND-UHFFFAOYSA-N 0 0 362.769 3.524 20 5 FHBDRN C[C@@]1(CNC(=O)c2cc([N+](=O)[O-])ccc2Cl)CCOC2(CCC2)C1 ZINC000894673706 944391619 /nfs/dbraw/zinc/39/16/19/944391619.db2.gz OZBGQUMZHSTRLD-MRXNPFEDSA-N 0 0 352.818 3.717 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)[C@H](NC(=O)c1ccccc1)C(C)C ZINC000086624562 944392706 /nfs/dbraw/zinc/39/27/06/944392706.db2.gz BEGXVRNNZCHBDJ-QGZVFWFLSA-N 0 0 369.421 3.605 20 5 FHBDRN O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000120701465 944393355 /nfs/dbraw/zinc/39/33/55/944393355.db2.gz QXMQYXQXPTVKHP-UHFFFAOYSA-N 0 0 373.796 3.737 20 5 FHBDRN Cc1c(Nc2cc([N+](=O)[O-])ccc2Cl)c(=O)n(-c2ccccc2)n1C ZINC001167976384 944397787 /nfs/dbraw/zinc/39/77/87/944397787.db2.gz JSEYBSCTCZRQFG-UHFFFAOYSA-N 0 0 358.785 3.790 20 5 FHBDRN C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)Cc1coc(-c2cccs2)n1 ZINC000105948842 944398842 /nfs/dbraw/zinc/39/88/42/944398842.db2.gz FWPVEAKBEAWLAL-NSHDSACASA-N 0 0 369.402 3.832 20 5 FHBDRN C[C@H](c1cccc(Cl)c1)N(C)S(=O)(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000123739453 944407701 /nfs/dbraw/zinc/40/77/01/944407701.db2.gz QEXJGKCDKSLGCV-SNVBAGLBSA-N 0 0 372.805 3.769 20 5 FHBDRN C[C@H](C(=O)Nc1n[nH]c(-c2cccc([N+](=O)[O-])c2)n1)c1cccc(Cl)c1 ZINC000439189338 944412744 /nfs/dbraw/zinc/41/27/44/944412744.db2.gz SSAZPJAAYOYMRY-JTQLQIEISA-N 0 0 371.784 3.776 20 5 FHBDRN C[C@@H](C(=O)Nc1n[nH]c(-c2cccc([N+](=O)[O-])c2)n1)c1cccc(Cl)c1 ZINC000439189340 944412936 /nfs/dbraw/zinc/41/29/36/944412936.db2.gz SSAZPJAAYOYMRY-SNVBAGLBSA-N 0 0 371.784 3.776 20 5 FHBDRN CCCCC1CCC(CNC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)CC1 ZINC000518468048 944420392 /nfs/dbraw/zinc/42/03/92/944420392.db2.gz KTMAVUMPUSOJMM-UHFFFAOYSA-N 0 0 361.442 3.646 20 5 FHBDRN C[C@H]1CN(C(=O)c2ccccc2Sc2ccccc2[N+](=O)[O-])CCC1=O ZINC000505845855 944423796 /nfs/dbraw/zinc/42/37/96/944423796.db2.gz OZQOBYVVKQTUAR-ZDUSSCGKSA-N 0 0 370.430 3.797 20 5 FHBDRN Cc1cc(NC(=O)N[C@H](C)c2ccc([S@](C)=O)cc2)ccc1[N+](=O)[O-] ZINC000473774329 944427101 /nfs/dbraw/zinc/42/71/01/944427101.db2.gz SFJUOEUWEYFWHE-YDBLSZJJSA-N 0 0 361.423 3.523 20 5 FHBDRN Cc1ccc(-c2noc([C@H]3CCCN3c3nccs3)n2)cc1[N+](=O)[O-] ZINC000438230458 944433285 /nfs/dbraw/zinc/43/32/85/944433285.db2.gz ZAUBXATWKUFNKM-GFCCVEGCSA-N 0 0 357.395 3.751 20 5 FHBDRN COC(=O)c1ccc(-c2noc(/C=C/c3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000517619395 944447968 /nfs/dbraw/zinc/44/79/68/944447968.db2.gz CQVDTKHKGTXHBG-NYYWCZLTSA-N 0 0 351.318 3.602 20 5 FHBDRN C[C@@H](OC(=O)c1cc(F)ccc1[N+](=O)[O-])C(=O)c1cccc(Cl)c1 ZINC000783248704 944464831 /nfs/dbraw/zinc/46/48/31/944464831.db2.gz GRXSMPYONCJJLP-SECBINFHSA-N 0 0 351.717 3.816 20 5 FHBDRN C[C@@H]1CCCC[C@@H]1NC(=O)COc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000518522489 944468495 /nfs/dbraw/zinc/46/84/95/944468495.db2.gz ASZANGQCAJBBNY-MFKMUULPSA-N 0 0 360.332 3.687 20 5 FHBDRN CC1(C2CC2)CCN(C(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)CC1 ZINC000566650263 944472039 /nfs/dbraw/zinc/47/20/39/944472039.db2.gz PQCNKXRRBQCMPL-UHFFFAOYSA-N 0 0 354.353 3.849 20 5 FHBDRN CC(C)c1scnc1C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000566650670 944473402 /nfs/dbraw/zinc/47/34/02/944473402.db2.gz XQFVKTKQIUGPLF-UHFFFAOYSA-N 0 0 353.831 3.801 20 5 FHBDRN Cn1cnc2cccc(C(=O)Nc3ccc([N+](=O)[O-])c(C(F)(F)F)c3)c21 ZINC000439258998 944475555 /nfs/dbraw/zinc/47/55/55/944475555.db2.gz MCULCLBXCHNKBD-UHFFFAOYSA-N 0 0 364.283 3.753 20 5 FHBDRN O=C(CN1CCCCCCC1=O)N(c1cccc([N+](=O)[O-])c1)C1CCCC1 ZINC000517645420 944476235 /nfs/dbraw/zinc/47/62/35/944476235.db2.gz PIQKRFYBYWTKNX-UHFFFAOYSA-N 0 0 373.453 3.663 20 5 FHBDRN O=C(Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1)[C@H]1CCC[C@H](O)C1 ZINC000439261658 944477390 /nfs/dbraw/zinc/47/73/90/944477390.db2.gz VZPSIOXDUUBRTR-BBRMVZONSA-N 0 0 356.378 3.877 20 5 FHBDRN O=C(Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1)[C@H]1CCC[C@@H](O)C1 ZINC000439261665 944477773 /nfs/dbraw/zinc/47/77/73/944477773.db2.gz VZPSIOXDUUBRTR-XJKSGUPXSA-N 0 0 356.378 3.877 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N2CCCc3ccc(C)cc32)cc1OC ZINC000110394431 944478200 /nfs/dbraw/zinc/47/82/00/944478200.db2.gz CVFGPUHIWISRBH-UHFFFAOYSA-N 0 0 370.405 3.904 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]([C@@H]2CCCO2)C1 ZINC000894709094 944482988 /nfs/dbraw/zinc/48/29/88/944482988.db2.gz ADIHLSJUUHMDPK-CJNGLKHVSA-N 0 0 364.467 3.736 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC(c2ncc[nH]2)CC1 ZINC000506203771 944483189 /nfs/dbraw/zinc/48/31/89/944483189.db2.gz DWXBWLSGGSFVBH-UHFFFAOYSA-N 0 0 374.466 3.840 20 5 FHBDRN CC(=O)c1cc([N+](=O)[O-])ccc1OCc1cncn1Cc1ccccc1 ZINC000438301693 944485670 /nfs/dbraw/zinc/48/56/70/944485670.db2.gz POBDYPYCXPQQNB-UHFFFAOYSA-N 0 0 351.362 3.621 20 5 FHBDRN CC(=O)Nc1ccc(C(=O)COc2cc(C)c([N+](=O)[O-])cc2Cl)cc1 ZINC000506537136 944495274 /nfs/dbraw/zinc/49/52/74/944495274.db2.gz HUZNNMFBMOTXAJ-UHFFFAOYSA-N 0 0 362.769 3.777 20 5 FHBDRN O=C(NC[C@@H]1C[C@H]1c1ccccc1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000110456415 944501780 /nfs/dbraw/zinc/50/17/80/944501780.db2.gz KATCYSQRNSKPSH-ROUUACIJSA-N 0 0 365.433 3.729 20 5 FHBDRN CN(C(=O)Cc1c(F)cc([N+](=O)[O-])cc1F)[C@@H]1CCCc2ccccc21 ZINC000516109075 944508968 /nfs/dbraw/zinc/50/89/68/944508968.db2.gz ZFWXRTMNXIVSNM-GOSISDBHSA-N 0 0 360.360 3.952 20 5 FHBDRN Cc1ccc(OC(F)F)c(CNC(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000516128016 944513927 /nfs/dbraw/zinc/51/39/27/944513927.db2.gz MWESYSIJWDKPNU-LBPRGKRZSA-N 0 0 364.348 3.925 20 5 FHBDRN CN(C(=O)CCCOc1cccc2ccccc21)c1ccc([N+](=O)[O-])nc1 ZINC000439301339 944517871 /nfs/dbraw/zinc/51/78/71/944517871.db2.gz YWNPTBQXGYUYKL-UHFFFAOYSA-N 0 0 365.389 3.965 20 5 FHBDRN CCc1nn(C)c(NCc2ccc(Oc3cccnc3)c(F)c2)c1[N+](=O)[O-] ZINC000092829144 944519795 /nfs/dbraw/zinc/51/97/95/944519795.db2.gz YTRBNSNYJRSDKC-UHFFFAOYSA-N 0 0 371.372 3.829 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]c(CSc3nc4cc(Cl)cnc4[nH]3)nc2c1 ZINC000473799970 944521498 /nfs/dbraw/zinc/52/14/98/944521498.db2.gz WGEYCPARNOAUGN-UHFFFAOYSA-N 0 0 360.786 3.688 20 5 FHBDRN COc1cc(CNc2ccc(-c3ccccc3)cn2)c([N+](=O)[O-])cc1O ZINC000184288169 944523402 /nfs/dbraw/zinc/52/34/02/944523402.db2.gz ABTGWEVYINKTOG-UHFFFAOYSA-N 0 0 351.362 3.983 20 5 FHBDRN O=C(CCCc1nc2ccccc2[nH]1)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000184291120 944524188 /nfs/dbraw/zinc/52/41/88/944524188.db2.gz ZBPRMYJEFBYFQD-UHFFFAOYSA-N 0 0 372.812 3.764 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)c1ccc(OC(F)F)cc1F ZINC001270116172 944530517 /nfs/dbraw/zinc/53/05/17/944530517.db2.gz WHJHZNNCQOFARL-UHFFFAOYSA-N 0 0 368.311 3.650 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)NCC1(C2CC2)CCC1 ZINC000120732517 944530739 /nfs/dbraw/zinc/53/07/39/944530739.db2.gz ITCRHSBFTGRWJH-UHFFFAOYSA-N 0 0 367.243 3.596 20 5 FHBDRN CCOc1ccc(SCC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000053650753 944531660 /nfs/dbraw/zinc/53/16/60/944531660.db2.gz MNKSVXUTGBJUDB-ZDUSSCGKSA-N 0 0 360.435 3.963 20 5 FHBDRN COc1c(O)ccc(CN[C@H]2CCc3cc(F)c(F)c(F)c32)c1[N+](=O)[O-] ZINC000894745395 944531862 /nfs/dbraw/zinc/53/18/62/944531862.db2.gz LYEPDFWHDDTANI-NSHDSACASA-N 0 0 368.311 3.503 20 5 FHBDRN Cc1nc(-c2ccc(C(=O)Oc3cc([N+](=O)[O-])c(Cl)cc3C)cc2)n[nH]1 ZINC000759844341 944534486 /nfs/dbraw/zinc/53/44/86/944534486.db2.gz PBHUMWBUSOGKEE-UHFFFAOYSA-N 0 0 372.768 3.869 20 5 FHBDRN COc1cc(C(=O)N(C)CCC2CCCCC2)c([N+](=O)[O-])cc1OC ZINC000506212674 944535115 /nfs/dbraw/zinc/53/51/15/944535115.db2.gz OUVVDZUBDSBNIS-UHFFFAOYSA-N 0 0 350.415 3.654 20 5 FHBDRN C[C@@H](Cc1ccc(C(F)(F)F)cc1)NC(=O)Cc1ccccc1[N+](=O)[O-] ZINC000110557328 944541087 /nfs/dbraw/zinc/54/10/87/944541087.db2.gz CXWMBJNBSBVKKP-LBPRGKRZSA-N 0 0 366.339 3.904 20 5 FHBDRN CC(C)OC(=O)C[C@H](NC(=O)C1CC(C)(C)C1)c1ccccc1[N+](=O)[O-] ZINC000505867454 944541265 /nfs/dbraw/zinc/54/12/65/944541265.db2.gz GQYSZAWNHTWCML-HNNXBMFYSA-N 0 0 362.426 3.530 20 5 FHBDRN COc1ccc(-c2ccc(CN3CCc4ncsc4C3)o2)c([N+](=O)[O-])c1 ZINC000438378197 944545920 /nfs/dbraw/zinc/54/59/20/944545920.db2.gz SMTGAEUSJWURMY-UHFFFAOYSA-N 0 0 371.418 3.878 20 5 FHBDRN O=C(NC[C@H]1COc2ccccc21)c1c([N+](=O)[O-])cccc1C(F)(F)F ZINC000518613847 944546044 /nfs/dbraw/zinc/54/60/44/944546044.db2.gz HIWSWVHGDZWUIY-JTQLQIEISA-N 0 0 366.295 3.520 20 5 FHBDRN COc1cc(C(=O)NCC(C)(C)C(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000438386407 944554248 /nfs/dbraw/zinc/55/42/48/944554248.db2.gz QLMQCPKCLKLRHC-UHFFFAOYSA-N 0 0 360.357 3.617 20 5 FHBDRN Cc1noc2ncc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc12 ZINC000505870800 944556784 /nfs/dbraw/zinc/55/67/84/944556784.db2.gz BZAGCKTYWGIMJB-UHFFFAOYSA-N 0 0 354.347 3.906 20 5 FHBDRN C[C@@H](C(=O)N[C@@H]1CCCN(c2cccc(F)c2)C1)c1cccc([N+](=O)[O-])c1 ZINC000518641941 944561136 /nfs/dbraw/zinc/56/11/36/944561136.db2.gz YXMAPAVWWCXQGO-RHSMWYFYSA-N 0 0 371.412 3.623 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H](C)COCc1ccccc1 ZINC000506556230 944563267 /nfs/dbraw/zinc/56/32/67/944563267.db2.gz SAMRHUHZPRGDMC-AWEZNQCLSA-N 0 0 357.410 3.878 20 5 FHBDRN Cc1nnc([C@@H](C)NCc2ccc(N(C)c3ccccc3)c([N+](=O)[O-])c2)[nH]1 ZINC000894771757 944569465 /nfs/dbraw/zinc/56/94/65/944569465.db2.gz UVOCTRZUPOARPN-CYBMUJFWSA-N 0 0 366.425 3.640 20 5 FHBDRN COC(=O)c1cc(C)nc(N2CC[C@@H](C)C[C@H]2c2ccco2)c1[N+](=O)[O-] ZINC000516198578 944570585 /nfs/dbraw/zinc/57/05/85/944570585.db2.gz YLHRXIBAKKKJKK-RISCZKNCSA-N 0 0 359.382 3.655 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N(C)CCCOCc1ccccc1 ZINC000439376832 944570816 /nfs/dbraw/zinc/57/08/16/944570816.db2.gz LPRZNCNVARBBAV-UHFFFAOYSA-N 0 0 373.409 3.674 20 5 FHBDRN C/C=C\c1ccc(OCC(=O)Oc2c(C)cccc2[N+](=O)[O-])c(OC)c1 ZINC000760019882 944584629 /nfs/dbraw/zinc/58/46/29/944584629.db2.gz LUQAASVKSXRAFJ-XQRVVYSFSA-N 0 0 357.362 3.929 20 5 FHBDRN C[C@@H]1CCN(S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])[C@@H]2CCCC[C@H]12 ZINC000518661519 944585593 /nfs/dbraw/zinc/58/55/93/944585593.db2.gz KGJDXXGHTVHFRK-YRGRVCCFSA-N 0 0 372.874 3.838 20 5 FHBDRN C[C@@H]1CCN(S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])[C@@H]2CCCC[C@@H]12 ZINC000518661518 944585723 /nfs/dbraw/zinc/58/57/23/944585723.db2.gz KGJDXXGHTVHFRK-MBNYWOFBSA-N 0 0 372.874 3.838 20 5 FHBDRN CC(C)(C)[C@H]1CCCC[C@@H]1NS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000506223433 944589329 /nfs/dbraw/zinc/58/93/29/944589329.db2.gz LTCPOGHBIHNLMT-HOTGVXAUSA-N 0 0 354.472 3.619 20 5 FHBDRN C[C@H](c1ccccc1)N(C)C(=O)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000103921328 944609131 /nfs/dbraw/zinc/60/91/31/944609131.db2.gz ZZMXMALBBQMRTO-OAHLLOKOSA-N 0 0 364.405 3.678 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCS[C@H]2CCCC[C@@H]21 ZINC000438449892 944614347 /nfs/dbraw/zinc/61/43/47/944614347.db2.gz UFVRSQZDWPSWHO-RCBQFDQVSA-N 0 0 366.508 3.962 20 5 FHBDRN CC(C)[C@@H](CC(F)(F)F)NC(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000549501050 944624712 /nfs/dbraw/zinc/62/47/12/944624712.db2.gz YWZDTYATMATXPM-CQSZACIVSA-N 0 0 361.364 3.756 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N(C)[C@H]2CCC[C@H](C)C2)cc1OC ZINC000031998955 944627827 /nfs/dbraw/zinc/62/78/27/944627827.db2.gz VAEUHSDTJTXKNU-STQMWFEESA-N 0 0 350.415 3.653 20 5 FHBDRN CCNc1ccc(C(=O)N2CCN(C3CC3)c3ccccc32)cc1[N+](=O)[O-] ZINC000426392187 944639616 /nfs/dbraw/zinc/63/96/16/944639616.db2.gz XIFZBZAFEOCMRQ-UHFFFAOYSA-N 0 0 366.421 3.656 20 5 FHBDRN COc1cc(NC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc(OC)c1 ZINC000517804920 944652968 /nfs/dbraw/zinc/65/29/68/944652968.db2.gz PLBFDNXDAAZEKR-UHFFFAOYSA-N 0 0 351.746 3.909 20 5 FHBDRN Cc1cccc2c1CN([C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)CC2 ZINC000759875082 944666508 /nfs/dbraw/zinc/66/65/08/944666508.db2.gz MUUBORKRHCGTDD-CYBMUJFWSA-N 0 0 373.840 3.942 20 5 FHBDRN Cc1cc(NCc2c(F)cc([N+](=O)[O-])cc2F)nn1-c1cccc(F)c1 ZINC000506249168 944670228 /nfs/dbraw/zinc/67/02/28/944670228.db2.gz RUKJIUFAWYOIDJ-UHFFFAOYSA-N 0 0 362.311 3.540 20 5 FHBDRN COc1cc(Cl)c(NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)cc1C ZINC000426028822 944674492 /nfs/dbraw/zinc/67/44/92/944674492.db2.gz IGLSOTKVPSNQNB-UHFFFAOYSA-N 0 0 353.737 3.539 20 5 FHBDRN CCc1ccc(C(=O)N2CCS[C@H]2c2ccc([N+](=O)[O-])cc2)c(O)c1 ZINC000436831003 944677191 /nfs/dbraw/zinc/67/71/91/944677191.db2.gz FCEVJYDJOANQRT-SFHVURJKSA-N 0 0 358.419 3.751 20 5 FHBDRN CCn1c(C)nc([N+](=O)[O-])c1N(C)Cc1cccc(Br)c1 ZINC000518744708 944677491 /nfs/dbraw/zinc/67/74/91/944677491.db2.gz GGQFKCRTQBQFAG-UHFFFAOYSA-N 0 0 353.220 3.519 20 5 FHBDRN Cc1cc(C)n(CCCN[C@@H](c2ccc([N+](=O)[O-])cc2)C(F)(F)F)n1 ZINC000566742598 944680484 /nfs/dbraw/zinc/68/04/84/944680484.db2.gz DCHSCDAVXHFLTL-HNNXBMFYSA-N 0 0 356.348 3.691 20 5 FHBDRN C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CC[C@@](C)(c2ccccc2)C1 ZINC000438505738 944681147 /nfs/dbraw/zinc/68/11/47/944681147.db2.gz OBMQKUJMSDZWIU-MGPUTAFESA-N 0 0 353.422 3.585 20 5 FHBDRN O=C(NCCc1c[nH]c2ncccc12)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000505887978 944700422 /nfs/dbraw/zinc/70/04/22/944700422.db2.gz JOXPTICUFYJPRQ-UHFFFAOYSA-N 0 0 366.402 3.658 20 5 FHBDRN Cc1ccc(N2CCN(C(=O)c3ccc(Cl)cc3[N+](=O)[O-])CC2)cc1C ZINC000759881474 944710869 /nfs/dbraw/zinc/71/08/69/944710869.db2.gz IJNJEZZNFWFTID-UHFFFAOYSA-N 0 0 373.840 3.827 20 5 FHBDRN Cc1ccc(N2CCN(C(=O)/C=C\c3ccc([N+](=O)[O-])cc3)CC2)cc1C ZINC000759882477 944717834 /nfs/dbraw/zinc/71/78/34/944717834.db2.gz OSGCPYHNAWBLLD-POHAHGRESA-N 0 0 365.433 3.574 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])N1C[C@@H]2CCC[C@]2(C(F)(F)F)C1 ZINC000894383597 944718579 /nfs/dbraw/zinc/71/85/79/944718579.db2.gz GCXMBVLYCPABNO-LRDDRELGSA-N 0 0 372.343 3.555 20 5 FHBDRN NC(=O)c1ccc(CSCc2cc(F)ccc2Cl)c([N+](=O)[O-])c1 ZINC000437921089 944731642 /nfs/dbraw/zinc/73/16/42/944731642.db2.gz SRXUAEZTQRLYFP-UHFFFAOYSA-N 0 0 354.790 3.920 20 5 FHBDRN CCOC(=O)c1ccnc(N[C@H]2CCCC[C@@H]2SCC)c1[N+](=O)[O-] ZINC000426421516 944742786 /nfs/dbraw/zinc/74/27/86/944742786.db2.gz RRHBQVIBQPRRGA-STQMWFEESA-N 0 0 353.444 3.643 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1nc(C(F)(F)F)c[nH]1 ZINC000506917193 944746489 /nfs/dbraw/zinc/74/64/89/944746489.db2.gz MMEORGCNLUCJCN-UHFFFAOYSA-N 0 0 360.317 3.701 20 5 FHBDRN COc1ccc([C@H](NC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)C2CC2)cc1 ZINC000053722987 944746606 /nfs/dbraw/zinc/74/66/06/944746606.db2.gz ORROXCQDLKWZJS-LJQANCHMSA-N 0 0 365.389 3.966 20 5 FHBDRN O=C(Nc1ccc(C(=O)NC2CCCC2)cc1)c1cc(F)cc([N+](=O)[O-])c1 ZINC000518793205 944777090 /nfs/dbraw/zinc/77/70/90/944777090.db2.gz DXBBWLRNHAGTRE-UHFFFAOYSA-N 0 0 371.368 3.659 20 5 FHBDRN CCc1ccc([C@H](C)NC(=O)[C@@H](C)Oc2ccc([N+](=O)[O-])cc2C=O)cc1 ZINC000073570659 944789178 /nfs/dbraw/zinc/78/91/78/944789178.db2.gz RAYYYVQLMIITKW-UONOGXRCSA-N 0 0 370.405 3.614 20 5 FHBDRN CC(C)Nc1ccc(C(=O)N2CCS[C@H]2c2ccc([N+](=O)[O-])cc2)cn1 ZINC000426774305 944793723 /nfs/dbraw/zinc/79/37/23/944793723.db2.gz UDSWKRUQLVHQKJ-SFHVURJKSA-N 0 0 372.450 3.698 20 5 FHBDRN Cc1cccc(NC(=O)[C@@H](C)OC(=O)CSc2ccc([N+](=O)[O-])cc2)c1 ZINC000004219402 944794877 /nfs/dbraw/zinc/79/48/77/944794877.db2.gz OTZJTEOOQJUIBI-CYBMUJFWSA-N 0 0 374.418 3.566 20 5 FHBDRN Cc1cccc2oc(CCNC(=O)Nc3cccc([N+](=O)[O-])c3C)nc21 ZINC000500408567 944799677 /nfs/dbraw/zinc/79/96/77/944799677.db2.gz XKZPFHSJDJQOPC-UHFFFAOYSA-N 0 0 354.366 3.717 20 5 FHBDRN O=[N+]([O-])c1cc(F)c(CNc2ccn(-c3ccccc3Cl)n2)c(F)c1 ZINC000506282937 944801714 /nfs/dbraw/zinc/80/17/14/944801714.db2.gz UDMQIRDPDATEGM-UHFFFAOYSA-N 0 0 364.739 3.746 20 5 FHBDRN CC(C)(c1nc([C@H]2COc3ccccc3O2)no1)c1ccccc1[N+](=O)[O-] ZINC000426446687 944826082 /nfs/dbraw/zinc/82/60/82/944826082.db2.gz BATJEIULEXURHX-MRXNPFEDSA-N 0 0 367.361 3.816 20 5 FHBDRN Nc1c(C(=O)Nc2ccc(OCC(F)(F)F)cc2)cc(F)cc1[N+](=O)[O-] ZINC000516434932 944845495 /nfs/dbraw/zinc/84/54/95/944845495.db2.gz YUGULEPBWUUEKH-UHFFFAOYSA-N 0 0 373.262 3.510 20 5 FHBDRN CC(C)C1(CNC(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CC1 ZINC000426078717 944846579 /nfs/dbraw/zinc/84/65/79/944846579.db2.gz SHFKMIFJGYLGNJ-UHFFFAOYSA-N 0 0 359.348 3.849 20 5 FHBDRN CCN(Cc1cc([N+](=O)[O-])cc2c1OCOC2)c1ccc(F)c(F)c1 ZINC000053747348 944851706 /nfs/dbraw/zinc/85/17/06/944851706.db2.gz UWKXCFBRINOMAG-UHFFFAOYSA-N 0 0 350.321 3.766 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)N(Cc1ccccc1)C[C@H]1CCCO1 ZINC000053748793 944853040 /nfs/dbraw/zinc/85/30/40/944853040.db2.gz YPICDSMOOUYYGF-GOSISDBHSA-N 0 0 355.394 3.808 20 5 FHBDRN CCc1cccc2c1OCC[C@@H]2NC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000507015214 944864571 /nfs/dbraw/zinc/86/45/71/944864571.db2.gz KIIKNGRHQMLJKD-HNNXBMFYSA-N 0 0 365.389 3.892 20 5 FHBDRN Cc1ccccc1[C@H]1CCN(c2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])C1 ZINC000507020692 944867296 /nfs/dbraw/zinc/86/72/96/944867296.db2.gz FYHVACKWMLFLTR-INIZCTEOSA-N 0 0 365.433 3.789 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N1CCC[C@H](OCC2CC2)C1 ZINC000426091002 944874675 /nfs/dbraw/zinc/87/46/75/944874675.db2.gz MJMHOGXSYWJJTF-ZDUSSCGKSA-N 0 0 353.806 3.671 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[C@@H](Cc2ccccc2)[C@@H]1C ZINC000426869561 944884044 /nfs/dbraw/zinc/88/40/44/944884044.db2.gz STZDPONWGRMUGP-HOCLYGCPSA-N 0 0 354.406 3.697 20 5 FHBDRN CC(C)COC[C@H](Nc1nc2sccn2c1[N+](=O)[O-])c1ccco1 ZINC000507024031 944891625 /nfs/dbraw/zinc/89/16/25/944891625.db2.gz ZQARYRZQALMFGT-NSHDSACASA-N 0 0 350.400 3.723 20 5 FHBDRN Cn1cnc([N+](=O)[O-])c1N[C@@H](COc1ccccc1F)c1ccccc1 ZINC000426889575 944892592 /nfs/dbraw/zinc/89/25/92/944892592.db2.gz GITIKKYTBWTPRM-HNNXBMFYSA-N 0 0 356.357 3.700 20 5 FHBDRN COc1ccc(CCCC(=O)Oc2c(C)cccc2[N+](=O)[O-])c(OC)c1 ZINC000760021841 944892635 /nfs/dbraw/zinc/89/26/35/944892635.db2.gz FKNWHSCEUZDVLE-UHFFFAOYSA-N 0 0 359.378 3.849 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])N[C@@H](c1ccco1)c1ccccc1 ZINC000426880713 944901351 /nfs/dbraw/zinc/90/13/51/944901351.db2.gz DYPAJXGLJPHDBL-LJQANCHMSA-N 0 0 351.362 3.506 20 5 FHBDRN CCNC(=O)c1ccc(C)c(NC(=O)C(C)(C)c2ccccc2[N+](=O)[O-])c1 ZINC000431996240 944903804 /nfs/dbraw/zinc/90/38/04/944903804.db2.gz UUPKHCOWABTBLA-UHFFFAOYSA-N 0 0 369.421 3.569 20 5 FHBDRN COC(=O)c1sc(NC(=O)c2ccc(SC)c([N+](=O)[O-])c2)cc1C ZINC000507072922 944915673 /nfs/dbraw/zinc/91/56/73/944915673.db2.gz WEGKRVJFINYLTA-UHFFFAOYSA-N 0 0 366.420 3.726 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N[C@@H]1CC[C@@H](Cc2ccccc2)C1 ZINC000438677038 944917489 /nfs/dbraw/zinc/91/74/89/944917489.db2.gz HNAMJCKMWMPPGM-DLBZAZTESA-N 0 0 354.406 3.501 20 5 FHBDRN CCNc1ccc(C(=O)N[C@H](C2CCCC2)C(F)(F)F)cc1[N+](=O)[O-] ZINC000437949554 944918744 /nfs/dbraw/zinc/91/87/44/944918744.db2.gz SERDDYQMAJIBJI-CQSZACIVSA-N 0 0 359.348 3.878 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC[C@@H](Cc2ccccc2)C1 ZINC000517997701 944918894 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CC[C@H](C)Oc1ccc(NS(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000511699032 944943235 /nfs/dbraw/zinc/94/32/35/944943235.db2.gz RKFLCYJRGNSXBH-ZDUSSCGKSA-N 0 0 364.423 3.881 20 5 FHBDRN COC(=O)c1cnc(Oc2cccc(Oc3ccccn3)c2)c([N+](=O)[O-])c1 ZINC000518033203 944953341 /nfs/dbraw/zinc/95/33/41/944953341.db2.gz GBRHOYZHCUKYQU-UHFFFAOYSA-N 0 0 367.317 3.756 20 5 FHBDRN COc1cc(NC(=O)Cc2ccccc2[N+](=O)[O-])ccc1C(F)(F)F ZINC000426940984 944955618 /nfs/dbraw/zinc/95/56/18/944955618.db2.gz TVKZBLPDZUDPFE-UHFFFAOYSA-N 0 0 354.284 3.803 20 5 FHBDRN CCOC(=O)c1cc(NCCC[C@H]2CCCC[C@H]2O)ccc1[N+](=O)[O-] ZINC000432052124 944955622 /nfs/dbraw/zinc/95/56/22/944955622.db2.gz XPRTWYCVBRGHQQ-CXAGYDPISA-N 0 0 350.415 3.515 20 5 FHBDRN Cc1ccc2c(CC(=O)NCCNc3ccc([N+](=O)[O-])cc3)coc2c1C ZINC000008175469 944960302 /nfs/dbraw/zinc/96/03/02/944960302.db2.gz CKWAKBQHHVTVEB-UHFFFAOYSA-N 0 0 367.405 3.729 20 5 FHBDRN Cc1c([N+](=O)[O-])cc(C(=O)N[C@@H](C)c2ccccc2Cl)cc1[N+](=O)[O-] ZINC000017908120 944970254 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CCOC(=O)c1sc(NC(=O)Cc2cccc([N+](=O)[O-])c2C)cc1C ZINC000439846037 945025056 /nfs/dbraw/zinc/02/50/56/945025056.db2.gz BQJGZCMMYGKZST-UHFFFAOYSA-N 0 0 362.407 3.631 20 5 FHBDRN COc1ccc(NC(=O)N(Cc2ccccc2)CC(F)F)cc1[N+](=O)[O-] ZINC000543893058 945029474 /nfs/dbraw/zinc/02/94/74/945029474.db2.gz YHBHSCGEKYQFLU-UHFFFAOYSA-N 0 0 365.336 3.903 20 5 FHBDRN C[C@@H]1CCCN(c2ccc(C(=O)NC[C@H]3CC=CCC3)cc2[N+](=O)[O-])C1 ZINC000519021577 945035519 /nfs/dbraw/zinc/03/55/19/945035519.db2.gz OEFWMCKUZOQOFD-CVEARBPZSA-N 0 0 357.454 3.917 20 5 FHBDRN CCO[C@@H](CC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1)C1=CCCC1 ZINC000437116709 945038959 /nfs/dbraw/zinc/03/89/59/945038959.db2.gz JSEUGSQLSPCYNL-IBGZPJMESA-N 0 0 358.438 3.991 20 5 FHBDRN Cc1c(C(=O)Oc2ccc(C)cc2[N+](=O)[O-])nnn1-c1ccccc1Cl ZINC000728804034 945040518 /nfs/dbraw/zinc/04/05/18/945040518.db2.gz AFXYCLVDVBKBPW-UHFFFAOYSA-N 0 0 372.768 3.665 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CCS[C@H](C(C)C)C1 ZINC000439869175 945042051 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945409999 /nfs/dbraw/zinc/40/99/99/945409999.db2.gz SVWAEHMAWAWNAJ-PIGZYNQJSA-N 0 0 372.368 3.567 20 5 FHBDRN C[C@H](CCC(=O)[O-])C[NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000426635067 945415678 /nfs/dbraw/zinc/41/56/78/945415678.db2.gz UBKQXYFDIJUFGM-OAHLLOKOSA-N 0 0 371.437 3.953 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)Nc1nc(-c2ccccn2)cs1 ZINC000511871594 945419023 /nfs/dbraw/zinc/41/90/23/945419023.db2.gz DTJHSPLVWQYLEG-UHFFFAOYSA-N 0 0 370.390 3.764 20 5 FHBDRN CCc1nn(C)cc1-c1noc([C@H](CC)Cc2ccc([N+](=O)[O-])cc2)n1 ZINC000426635250 945424856 /nfs/dbraw/zinc/42/48/56/945424856.db2.gz VZROXPBPBXMLCM-CYBMUJFWSA-N 0 0 355.398 3.677 20 5 FHBDRN COc1ccc(OC(C)C)c(N[C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000106899214 945429095 /nfs/dbraw/zinc/42/90/95/945429095.db2.gz SCHIUGFNTQCZQG-ZDUSSCGKSA-N 0 0 373.409 3.830 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1csc(-c2ncccc2F)n1 ZINC000506833143 945444363 /nfs/dbraw/zinc/44/43/63/945444363.db2.gz QBIWEJRHKANMET-UHFFFAOYSA-N 0 0 372.381 3.525 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1Cc1nc(=O)c2c3c(sc2[nH]1)CSCC3 ZINC000507682866 945448713 /nfs/dbraw/zinc/44/87/13/945448713.db2.gz GSXZAKIXSNPGRY-UHFFFAOYSA-N 0 0 373.459 3.994 20 5 FHBDRN CCOc1cc2c(cc1NC(=O)CCc1cccc([N+](=O)[O-])c1)O[C@H](C)C2 ZINC000087026088 945456875 /nfs/dbraw/zinc/45/68/75/945456875.db2.gz YBYRAOILNRHWGF-CYBMUJFWSA-N 0 0 370.405 3.888 20 5 FHBDRN C[C@H](C(=O)OC(C)(C)C)c1noc(C(F)(F)c2ccc([N+](=O)[O-])cc2)n1 ZINC000280941434 945470514 /nfs/dbraw/zinc/47/05/14/945470514.db2.gz SMLTXXHLKICXLN-VIFPVBQESA-N 0 0 369.324 3.563 20 5 FHBDRN CCn1ccnc1[C@H]1CCCCN1C(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000280952541 945477833 /nfs/dbraw/zinc/47/78/33/945477833.db2.gz HZETYMNKRRCIGH-OAHLLOKOSA-N 0 0 373.413 3.579 20 5 FHBDRN COc1ccccc1C[C@@H](C)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000107104790 945484543 /nfs/dbraw/zinc/48/45/43/945484543.db2.gz BMHWLOLFSUCUFS-CQSZACIVSA-N 0 0 354.406 3.761 20 5 FHBDRN COc1cc(Cl)c(C)cc1NC(=O)[C@H](C)Oc1ccc([N+](=O)[O-])cc1 ZINC000015330803 945489927 /nfs/dbraw/zinc/48/99/27/945489927.db2.gz MBFXOMMPMAOZHU-NSHDSACASA-N 0 0 364.785 3.971 20 5 FHBDRN CCN(c1ccc(F)cc1)S(=O)(=O)c1cc([N+](=O)[O-])cc(C)c1C ZINC000015333601 945492474 /nfs/dbraw/zinc/49/24/74/945492474.db2.gz YEGIFMCXTSAIBV-UHFFFAOYSA-N 0 0 352.387 3.566 20 5 FHBDRN Cc1c(C(=O)NCc2ccnc(N3CCCCCC3)c2)cccc1[N+](=O)[O-] ZINC000107179056 945512643 /nfs/dbraw/zinc/51/26/43/945512643.db2.gz SURCANISDCCWCB-UHFFFAOYSA-N 0 0 368.437 3.609 20 5 FHBDRN COC(=O)c1cc(NC(=O)CC(C)(C)C(F)(F)F)c(C)c([N+](=O)[O-])c1 ZINC000281067385 945515121 /nfs/dbraw/zinc/51/51/21/945515121.db2.gz QLSZHLUKZFWHKV-UHFFFAOYSA-N 0 0 362.304 3.607 20 5 FHBDRN CC(=O)N1CCC[C@@H](CNC(=O)c2c3ccccc3cc3ccccc32)C1 ZINC000281089184 945517514 /nfs/dbraw/zinc/51/75/14/945517514.db2.gz CPYFYNAWUSORLJ-KRWDZBQOSA-N 0 0 360.457 3.981 20 5 FHBDRN C[C@H](C(=O)Nc1nc(CN2CCCCC2)cs1)c1cccc([N+](=O)[O-])c1 ZINC000519517562 945522762 /nfs/dbraw/zinc/52/27/62/945522762.db2.gz LAMMUIKPJLYHPU-ZDUSSCGKSA-N 0 0 374.466 3.779 20 5 FHBDRN COc1cc(CN(C)Cc2ccsc2)c([N+](=O)[O-])cc1OC(F)F ZINC000053781821 945540051 /nfs/dbraw/zinc/54/00/51/945540051.db2.gz JPAXIWXNOVBNSO-UHFFFAOYSA-N 0 0 358.366 3.898 20 5 FHBDRN C[C@H](Nc1cnn(-c2ccc([N+](=O)[O-])cc2)c(=O)c1Cl)c1ccccc1 ZINC000107295983 945543640 /nfs/dbraw/zinc/54/36/40/945543640.db2.gz WEUFTNPERIZHOW-LBPRGKRZSA-N 0 0 370.796 3.967 20 5 FHBDRN Cc1cc(-n2cccn2)ccc1NC(=O)[C@@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1 ZINC001271234922 945552114 /nfs/dbraw/zinc/55/21/14/945552114.db2.gz HIBWJZIQRCZMPO-QZTJIDSGSA-N 0 0 362.389 3.831 20 5 FHBDRN O=C(Nc1cccc(OCC(F)(F)F)c1)c1ccc(F)cc1[N+](=O)[O-] ZINC000120798968 945564279 /nfs/dbraw/zinc/56/42/79/945564279.db2.gz WIRGCQALTZWWQB-UHFFFAOYSA-N 0 0 358.247 3.927 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)N1CC[C@@H](c2c(F)cccc2F)C1 ZINC000184402989 945566775 /nfs/dbraw/zinc/56/67/75/945566775.db2.gz SFSDPDFVHVURPK-CYBMUJFWSA-N 0 0 361.348 3.572 20 5 FHBDRN C[C@@H]1CCCC[C@H]1Cc1nc(-c2ccc(-n3cncn3)c([N+](=O)[O-])c2)no1 ZINC000519625550 945595404 /nfs/dbraw/zinc/59/54/04/945595404.db2.gz DSFMSYNAIKBCJH-OLZOCXBDSA-N 0 0 368.397 3.594 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])NCCCCc1ccc(Cl)s1 ZINC000519634292 945603505 /nfs/dbraw/zinc/60/35/05/945603505.db2.gz KOVCHVBAPHNIKO-UHFFFAOYSA-N 0 0 367.858 3.861 20 5 FHBDRN COc1cc(CN[C@H](COCC(C)C)c2ccco2)c([N+](=O)[O-])cc1F ZINC000184404568 945613373 /nfs/dbraw/zinc/61/33/73/945613373.db2.gz CDKNWXMHLZOVDQ-OAHLLOKOSA-N 0 0 366.389 3.839 20 5 FHBDRN CCCc1c(C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)[nH]c(C)c1C(C)=O ZINC000055467677 945614564 /nfs/dbraw/zinc/61/45/64/945614564.db2.gz ZFQXFQROXJEMSE-LLVKDONJSA-N 0 0 357.410 3.877 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)O[C@@H]1COc2cc(Cl)ccc21 ZINC001271266902 945617494 /nfs/dbraw/zinc/61/74/94/945617494.db2.gz QNTBPXHJKQLRLM-OAHLLOKOSA-N 0 0 363.753 3.937 20 5 FHBDRN O=c1[nH]cnc2cc(NCc3cccc(-c4ccccn4)c3)c([N+](=O)[O-])cc21 ZINC000164197280 945621076 /nfs/dbraw/zinc/62/10/76/945621076.db2.gz YWOXEKOTRBWASQ-UHFFFAOYSA-N 0 0 373.372 3.505 20 5 FHBDRN CCC(=O)c1ccc(NCc2ccc(N3CCOC3=O)cc2)c([N+](=O)[O-])c1 ZINC000281392481 945621099 /nfs/dbraw/zinc/62/10/99/945621099.db2.gz GKVQNIXUDGORFD-UHFFFAOYSA-N 0 0 369.377 3.756 20 5 FHBDRN Cc1cccc(OCCCNC(=O)[C@H]2C[C@@H]2c2cccc([N+](=O)[O-])c2)c1C ZINC001271275588 945628871 /nfs/dbraw/zinc/62/88/71/945628871.db2.gz WUKVFNXLAFLHLF-MOPGFXCFSA-N 0 0 368.433 3.900 20 5 FHBDRN CCOCCN(CC)C(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 ZINC000107494685 945644700 /nfs/dbraw/zinc/64/47/00/945644700.db2.gz PKRDWVTYAXUHSK-UHFFFAOYSA-N 0 0 358.394 3.886 20 5 FHBDRN CC(=O)c1ccc(OCc2ccnc(-c3ccc(F)cc3)n2)c([N+](=O)[O-])c1 ZINC000120307122 945644897 /nfs/dbraw/zinc/64/48/97/945644897.db2.gz DIEWUQZJJLZFSC-UHFFFAOYSA-N 0 0 367.336 3.973 20 5 FHBDRN O=C(NCCC[C@@H]1CCCC[C@@H]1O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000125161048 945651758 /nfs/dbraw/zinc/65/17/58/945651758.db2.gz DEOMCTAUASOXPU-NHYWBVRUSA-N 0 0 374.359 3.675 20 5 FHBDRN O=C(CCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])N1CCCC[C@H]1C1CCC1 ZINC000843743279 945681103 /nfs/dbraw/zinc/68/11/03/945681103.db2.gz LPRDQUPRHANSMF-INIZCTEOSA-N 0 0 361.398 3.617 20 5 FHBDRN CCSc1cccc(NC(=O)NCCNc2ccc([N+](=O)[O-])cc2)c1 ZINC000506844211 945710814 /nfs/dbraw/zinc/71/08/14/945710814.db2.gz MFCQUNFGYSSZQW-UHFFFAOYSA-N 0 0 360.439 3.940 20 5 FHBDRN COc1cccc(C(=O)NC[C@H](C)Oc2ccc(C(C)C)cc2)c1[N+](=O)[O-] ZINC000519773955 945732600 /nfs/dbraw/zinc/73/26/00/945732600.db2.gz KZGBNTIFQUNPJM-AWEZNQCLSA-N 0 0 372.421 3.924 20 5 FHBDRN C[C@H](NC(=O)[C@H]1CCN(c2ccccc2)[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000473655301 945754928 /nfs/dbraw/zinc/75/49/28/945754928.db2.gz BMCGLSCNPJYJIP-KHYOSLBOSA-N 0 0 353.422 3.687 20 5 FHBDRN Cc1ccc2c(CCNC(=O)Nc3ccc([N+](=O)[O-])cc3F)cn(C)c2c1 ZINC000444058390 945760688 /nfs/dbraw/zinc/76/06/88/945760688.db2.gz XTYCXYGADZFOLM-UHFFFAOYSA-N 0 0 370.384 3.898 20 5 FHBDRN O=[N+]([O-])c1ccc(Sc2nnc(-c3cccs3)o2)c([N+](=O)[O-])c1 ZINC000020667410 945766412 /nfs/dbraw/zinc/76/64/12/945766412.db2.gz NXNLJDIDKLSYBB-UHFFFAOYSA-N 0 0 350.337 3.766 20 5 FHBDRN CN(CCN(C)c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000107721317 945766859 /nfs/dbraw/zinc/76/68/59/945766859.db2.gz FHQJUNDMJIKTDJ-UHFFFAOYSA-N 0 0 362.817 3.848 20 5 FHBDRN Cc1cc(C(=O)Nc2ccc(OCc3ccccc3)cc2[N+](=O)[O-])no1 ZINC000519804652 945769837 /nfs/dbraw/zinc/76/98/37/945769837.db2.gz CIQUTRAEJIHGLY-UHFFFAOYSA-N 0 0 353.334 3.723 20 5 FHBDRN CCCC(=O)Nc1cccc(CNC(=O)c2ccc([N+](=O)[O-])c(C)c2)c1 ZINC000044663927 945783699 /nfs/dbraw/zinc/78/36/99/945783699.db2.gz HVVYBGTVLQIULH-UHFFFAOYSA-N 0 0 355.394 3.572 20 5 FHBDRN COC(=O)c1c(C2CC2)csc1NC(=O)c1cc(F)cc([N+](=O)[O-])c1 ZINC000439674621 945788379 /nfs/dbraw/zinc/78/83/79/945788379.db2.gz QOHQKICVIJEMCH-UHFFFAOYSA-N 0 0 364.354 3.712 20 5 FHBDRN O=C(Nc1ccnn1-c1ccc([N+](=O)[O-])cc1)[C@H]1CCCC(F)(F)C1 ZINC000281729057 945819757 /nfs/dbraw/zinc/81/97/57/945819757.db2.gz ARMRALAPKWROBN-NSHDSACASA-N 0 0 350.325 3.545 20 5 FHBDRN O=C(c1noc2c1CCCCC2)N1CCS[C@@H]1c1ccc([N+](=O)[O-])cc1 ZINC000444082783 945828217 /nfs/dbraw/zinc/82/82/17/945828217.db2.gz ANAVUYAAPLPJSG-GOSISDBHSA-N 0 0 373.434 3.740 20 5 FHBDRN COc1ccc(C(=O)NCCc2cccc(Cl)c2Cl)cc1[N+](=O)[O-] ZINC000107974710 945829529 /nfs/dbraw/zinc/82/95/29/945829529.db2.gz LAVCEDCNDJFKDL-UHFFFAOYSA-N 0 0 369.204 3.883 20 5 FHBDRN COc1ccc(Cc2nc(-c3cccc4ccncc43)no2)c([N+](=O)[O-])c1 ZINC001211852679 945830462 /nfs/dbraw/zinc/83/04/62/945830462.db2.gz XTDVMYBNGBXFBN-UHFFFAOYSA-N 0 0 362.345 3.792 20 5 FHBDRN Cc1cn2nc(Sc3ccc(Br)cc3[N+](=O)[O-])sc2n1 ZINC000444085047 945830637 /nfs/dbraw/zinc/83/06/37/945830637.db2.gz UCEMKRFOAULLHK-UHFFFAOYSA-N 0 0 371.241 3.921 20 5 FHBDRN CCn1ccnc1[C@H]1CCCCN1C(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000281736637 945832769 /nfs/dbraw/zinc/83/27/69/945832769.db2.gz JCGKLYZGMJZRTC-OAHLLOKOSA-N 0 0 362.817 3.832 20 5 FHBDRN O=C(c1cc(F)cc2c(=O)c3cccc(F)c3[nH]c12)N1C[C@@H]2CCC[C@H]21 ZINC000444091387 945845296 /nfs/dbraw/zinc/84/52/96/945845296.db2.gz WVTJGOKZJPNNQZ-MGPLVRAMSA-N 0 0 354.356 3.584 20 5 FHBDRN COCCN(C(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12)[C@H](C)c1ccccc1 ZINC000519882269 945852440 /nfs/dbraw/zinc/85/24/40/945852440.db2.gz LQMSINMHRZHAFZ-CQSZACIVSA-N 0 0 367.405 3.926 20 5 FHBDRN C[C@H](Sc1nccc(C(F)(F)F)n1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000143330741 945855273 /nfs/dbraw/zinc/85/52/73/945855273.db2.gz FTAYHRUMQDZZND-QMMMGPOBSA-N 0 0 372.328 3.523 20 5 FHBDRN CCN(CCc1cccs1)S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000519889638 945859133 /nfs/dbraw/zinc/85/91/33/945859133.db2.gz BQAIYJULLDGCMZ-UHFFFAOYSA-N 0 0 374.871 3.563 20 5 FHBDRN Cn1nc(-c2cc(F)cc(F)c2)cc1NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000487477700 945860079 /nfs/dbraw/zinc/86/00/79/945860079.db2.gz ZBUACNIYRTYKBT-UHFFFAOYSA-N 0 0 358.304 3.526 20 5 FHBDRN CC[C@H](c1ccccc1)N(CC)S(=O)(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000519890713 945861046 /nfs/dbraw/zinc/86/10/46/945861046.db2.gz NDUHUHIMIYNWNY-OAHLLOKOSA-N 0 0 366.414 3.896 20 5 FHBDRN CN(C(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1)c1ccc2cc[nH]c2c1 ZINC001271557136 945862917 /nfs/dbraw/zinc/86/29/17/945862917.db2.gz JUZJUUWTVGNJSM-UHFFFAOYSA-N 0 0 361.361 3.538 20 5 FHBDRN CSc1ccc(C(=O)Nc2nn(C(C)C)cc2Cl)cc1[N+](=O)[O-] ZINC000894887893 945897627 /nfs/dbraw/zinc/89/76/27/945897627.db2.gz JEJJBFUNHXFDLP-UHFFFAOYSA-N 0 0 354.819 4.000 20 5 FHBDRN Cc1nc(CNC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)sc1C ZINC000444116367 945904031 /nfs/dbraw/zinc/90/40/31/945904031.db2.gz GKKNLZRSTOGMDT-UHFFFAOYSA-N 0 0 363.442 3.685 20 5 FHBDRN COc1cc(NCc2ccncc2OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000281887061 945914972 /nfs/dbraw/zinc/91/49/72/945914972.db2.gz OOMUAXLZSUFPKG-UHFFFAOYSA-N 0 0 357.288 3.552 20 5 FHBDRN CC(C)CC[C@](C)(O)CNC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000444118359 945921145 /nfs/dbraw/zinc/92/11/45/945921145.db2.gz NFJLHFPTHGVDFI-QFIPXVFZSA-N 0 0 366.461 3.598 20 5 FHBDRN CN(CCCc1ccccc1)c1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1 ZINC000108312690 945929085 /nfs/dbraw/zinc/92/90/85/945929085.db2.gz ROZPBDJLKXPWNI-UHFFFAOYSA-N 0 0 367.449 3.900 20 5 FHBDRN COc1ccc(S[C@H](C)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])cc1 ZINC000018543844 945930820 /nfs/dbraw/zinc/93/08/20/945930820.db2.gz YNGPTIYTOXONDS-LLVKDONJSA-N 0 0 362.407 3.731 20 5 FHBDRN C[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1)c1cccc(OC(F)(F)F)c1 ZINC000440811002 945935650 /nfs/dbraw/zinc/93/56/50/945935650.db2.gz QRMVZXROSSOCHU-JTQLQIEISA-N 0 0 354.284 3.984 20 5 FHBDRN CNc1ccc(C(=O)NCc2ccc3[nH]c(C)c(C)c3c2)cc1[N+](=O)[O-] ZINC000519942730 945935728 /nfs/dbraw/zinc/93/57/28/945935728.db2.gz KIGNOBPGXUXMNG-UHFFFAOYSA-N 0 0 352.394 3.665 20 5 FHBDRN O=C(NCCC(F)(F)F)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000444124425 945936426 /nfs/dbraw/zinc/93/64/26/945936426.db2.gz GOKYBTOPTYKEDM-UHFFFAOYSA-N 0 0 352.287 3.503 20 5 FHBDRN COc1ccc(OC)c(-c2noc(/C=C/c3cccc([N+](=O)[O-])c3)n2)c1 ZINC000545525196 945948848 /nfs/dbraw/zinc/94/88/48/945948848.db2.gz VDRGFCJTWNXTGL-RMKNXTFCSA-N 0 0 353.334 3.832 20 5 FHBDRN COc1ccc(NC(=O)[C@@H](C)Oc2ccc([N+](=O)[O-])c(Cl)c2)cc1 ZINC000127154795 945967984 /nfs/dbraw/zinc/96/79/84/945967984.db2.gz KONUJLNENFXINO-SNVBAGLBSA-N 0 0 350.758 3.663 20 5 FHBDRN O=C(N[C@@H]1CCSC1)c1ccccc1Sc1ccccc1[N+](=O)[O-] ZINC000440863550 945970085 /nfs/dbraw/zinc/97/00/85/945970085.db2.gz CCFHKMHAVISCMV-GFCCVEGCSA-N 0 0 360.460 3.981 20 5 FHBDRN Cc1nn(CC(=O)Nc2ccccc2Sc2ccccc2)cc1[N+](=O)[O-] ZINC000143188482 945979289 /nfs/dbraw/zinc/97/92/89/945979289.db2.gz IJDAWPDDOTUFNP-UHFFFAOYSA-N 0 0 368.418 3.890 20 5 FHBDRN O=C(N=c1cc(C2CCCCCC2)[nH][nH]1)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000522859693 946007170 /nfs/dbraw/zinc/00/71/70/946007170.db2.gz PTJIWDHURQBLCQ-UHFFFAOYSA-N 0 0 367.409 3.911 20 5 FHBDRN CC(C)(C)c1nc(Cc2nc(-c3ccc(N)c([N+](=O)[O-])c3)no2)cs1 ZINC000545552332 946010211 /nfs/dbraw/zinc/01/02/11/946010211.db2.gz WEFJIGNOEGTBFR-UHFFFAOYSA-N 0 0 359.411 3.572 20 5 FHBDRN CCSCc1ccc(C(=O)Nc2cc(C(=O)OC)cc([N+](=O)[O-])c2)cc1 ZINC000522871942 946035733 /nfs/dbraw/zinc/03/57/33/946035733.db2.gz YCIZUJWTDDCUGH-UHFFFAOYSA-N 0 0 374.418 3.887 20 5 FHBDRN COc1ccc2c(c1)OCC[C@@H]2NC(=O)Nc1ccc([N+](=O)[O-])c(C)c1 ZINC000613784430 946037334 /nfs/dbraw/zinc/03/73/34/946037334.db2.gz VITDQCBDUXFGHV-HNNXBMFYSA-N 0 0 357.366 3.557 20 5 FHBDRN COc1ccc(OCCCC(=O)N2CCCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000522875455 946041638 /nfs/dbraw/zinc/04/16/38/946041638.db2.gz KJTXEIWCCFTJOA-UHFFFAOYSA-N 0 0 370.405 3.742 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)NCCc1nc2ccccc2s1 ZINC000045416667 946043071 /nfs/dbraw/zinc/04/30/71/946043071.db2.gz ILAXCRSWUVFCLY-UHFFFAOYSA-N 0 0 373.459 3.656 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H]1CCOc2ccccc21 ZINC000108743148 946049733 /nfs/dbraw/zinc/04/97/33/946049733.db2.gz PVGRIJIDFHVVOJ-KGLIPLIRSA-N 0 0 372.446 3.758 20 5 FHBDRN CCOc1cc(CCCNC(=O)c2cc(C)cc([N+](=O)[O-])c2)ccc1OC ZINC000522890502 946063552 /nfs/dbraw/zinc/06/35/52/946063552.db2.gz OQUCOMUSEYFJAJ-UHFFFAOYSA-N 0 0 372.421 3.673 20 5 FHBDRN Cc1cc(C(=O)N(C)Cc2nc(-c3ccccc3)c[nH]2)ccc1[N+](=O)[O-] ZINC000121235765 946073725 /nfs/dbraw/zinc/07/37/25/946073725.db2.gz MTVZAJMTNOXESW-UHFFFAOYSA-N 0 0 350.378 3.566 20 5 FHBDRN COc1ccc(COc2ccc(N(C)C(=O)NC(C)C)cc2)cc1[N+](=O)[O-] ZINC000054247556 946081475 /nfs/dbraw/zinc/08/14/75/946081475.db2.gz AUIJAIJXEWRJQM-UHFFFAOYSA-N 0 0 373.409 3.737 20 5 FHBDRN CC[C@@H]1CN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)c2ccccc2O1 ZINC000444215350 946082339 /nfs/dbraw/zinc/08/23/39/946082339.db2.gz SIABLPWVSKQGEA-OAHLLOKOSA-N 0 0 366.377 3.822 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1Br)N(CC(F)(F)F)C1CC1 ZINC000045626620 946088853 /nfs/dbraw/zinc/08/88/53/946088853.db2.gz MFLQTFMMZVAGES-UHFFFAOYSA-N 0 0 367.121 3.524 20 5 FHBDRN CSc1cccc(C(=O)Nc2cccc(N3CCCC3=O)c2)c1[N+](=O)[O-] ZINC000186009543 946089519 /nfs/dbraw/zinc/08/95/19/946089519.db2.gz VUWYVNRSSRQUHK-UHFFFAOYSA-N 0 0 371.418 3.696 20 5 FHBDRN O=C(NCCc1c[nH]c2ccccc12)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186008668 946089725 /nfs/dbraw/zinc/08/97/25/946089725.db2.gz VMXFCPQUMJCMGS-UHFFFAOYSA-N 0 0 372.812 3.771 20 5 FHBDRN CCCOc1cccc(CC(=O)Nc2cc([N+](=O)[O-])ccc2OCC)c1 ZINC000545251110 946090736 /nfs/dbraw/zinc/09/07/36/946090736.db2.gz ZURCTWDKKWKDHF-UHFFFAOYSA-N 0 0 358.394 3.964 20 5 FHBDRN O=C(NC1CCSCC1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000522913735 946091983 /nfs/dbraw/zinc/09/19/83/946091983.db2.gz SUHZEFFEHXRSJV-UHFFFAOYSA-N 0 0 371.462 3.832 20 5 FHBDRN O=C(N[C@H](CCO)c1ccccc1)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000444235504 946107898 /nfs/dbraw/zinc/10/78/98/946107898.db2.gz ITCGPXPMKXHLCU-LJQANCHMSA-N 0 0 372.424 3.535 20 5 FHBDRN O=C(N=c1cc(C2CCCCCC2)[nH][nH]1)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000522924056 946108561 /nfs/dbraw/zinc/10/85/61/946108561.db2.gz STDMCSCQLFAETN-UHFFFAOYSA-N 0 0 367.409 3.911 20 5 FHBDRN CCCCc1nc2cc(NC(=O)COc3ccccc3[N+](=O)[O-])ccc2[nH]1 ZINC000109000157 946110652 /nfs/dbraw/zinc/11/06/52/946110652.db2.gz WIUMGXUZUKJREI-UHFFFAOYSA-N 0 0 368.393 3.831 20 5 FHBDRN Cc1nc(-c2ncccn2)sc1C(=O)O[C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000066876918 946113109 /nfs/dbraw/zinc/11/31/09/946113109.db2.gz FMNSZPKCONQLAW-NSHDSACASA-N 0 0 370.390 3.735 20 5 FHBDRN CCN(C(=O)c1ccc([N+](=O)[O-])c(OC)c1)[C@@H](C)Cc1ccc(OC)cc1 ZINC000108983237 946118254 /nfs/dbraw/zinc/11/82/54/946118254.db2.gz WMJLDCWEOFUCAT-AWEZNQCLSA-N 0 0 372.421 3.705 20 5 FHBDRN COc1ccc(/C=C/C(=O)O[C@H](C)c2ccc([N+](=O)[O-])cc2)cc1OC ZINC000066877959 946119557 /nfs/dbraw/zinc/11/95/57/946119557.db2.gz IXXDYMZSDIAINL-HQIZRNBFSA-N 0 0 357.362 3.930 20 5 FHBDRN Cc1c(Cl)cccc1NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000045763027 946135694 /nfs/dbraw/zinc/13/56/94/946135694.db2.gz DGHHNAJHCJONHP-UHFFFAOYSA-N 0 0 356.769 3.995 20 5 FHBDRN C[C@@H](NC(=O)c1csc(Nc2ccccn2)n1)c1cccc([N+](=O)[O-])c1 ZINC000522936652 946136149 /nfs/dbraw/zinc/13/61/49/946136149.db2.gz VSXOFFQCDBZHER-LLVKDONJSA-N 0 0 369.406 3.681 20 5 FHBDRN Cc1ccc(NC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)c2cccnc12 ZINC000045768506 946139097 /nfs/dbraw/zinc/13/90/97/946139097.db2.gz AEWDCBMEXZAXEE-UHFFFAOYSA-N 0 0 373.372 3.889 20 5 FHBDRN COc1cccc(C(=O)N2CCC(Cc3ccccc3F)CC2)c1[N+](=O)[O-] ZINC000444266126 946149973 /nfs/dbraw/zinc/14/99/73/946149973.db2.gz LCLNXJLQHBCGKM-UHFFFAOYSA-N 0 0 372.396 3.837 20 5 FHBDRN O=C(CCc1c(Cl)cccc1[N+](=O)[O-])Nc1ccc2c(c1)NC(=O)CC2 ZINC001126089250 946159478 /nfs/dbraw/zinc/15/94/78/946159478.db2.gz CIQBCZVPJAOMNW-UHFFFAOYSA-N 0 0 373.796 3.704 20 5 FHBDRN COc1ccc(N(C)C(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1OC ZINC000109134042 946163406 /nfs/dbraw/zinc/16/34/06/946163406.db2.gz WGNZSKPKSWQSBD-UHFFFAOYSA-N 0 0 350.758 3.542 20 5 FHBDRN Cc1c(C(=O)N[C@@H](C)c2cccc(N3CCCC3)c2)cccc1[N+](=O)[O-] ZINC000088218088 946164163 /nfs/dbraw/zinc/16/41/63/946164163.db2.gz YLXAYIMDMZAQNA-HNNXBMFYSA-N 0 0 353.422 3.994 20 5 FHBDRN C[C@H](OC(=O)c1cc(Cl)ccc1F)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000018799900 946168498 /nfs/dbraw/zinc/16/84/98/946168498.db2.gz DHHGKUIIQZBYAW-VIFPVBQESA-N 0 0 366.732 3.571 20 5 FHBDRN CCc1ccc([C@@H](CO)NC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)cc1 ZINC000439746015 946174963 /nfs/dbraw/zinc/17/49/63/946174963.db2.gz MIDJFIONVWLGNS-GOSISDBHSA-N 0 0 356.422 3.744 20 5 FHBDRN C[C@@H](NC(=O)CC1CCCCC1)C(=O)O[C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000159941747 946174972 /nfs/dbraw/zinc/17/49/72/946174972.db2.gz PKLYNNAXFDCVSW-KGLIPLIRSA-N 0 0 362.426 3.674 20 5 FHBDRN CCOc1ccc(NC(=O)c2ccc(SC)c([N+](=O)[O-])c2)cc1OC ZINC000018826856 946179827 /nfs/dbraw/zinc/17/98/27/946179827.db2.gz FFLHKKUMPIVGES-UHFFFAOYSA-N 0 0 362.407 3.976 20 5 FHBDRN C[C@@H]1CCN(C(=O)c2cccc3c(=O)c4cccc(F)c4[nH]c23)C[C@@H]1C ZINC000444297584 946182828 /nfs/dbraw/zinc/18/28/28/946182828.db2.gz KAUJEUAELOGBMW-OLZOCXBDSA-N 0 0 352.409 3.939 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)N[C@H]1CCCN(c2ccccc2F)C1 ZINC000536500707 946185736 /nfs/dbraw/zinc/18/57/36/946185736.db2.gz AZCWZBXPTPCRBI-AWEZNQCLSA-N 0 0 358.373 3.524 20 5 FHBDRN CCc1n[nH]c(C(=O)NCc2ccc(C)cc2OCCC(C)C)c1[N+](=O)[O-] ZINC000444301932 946188035 /nfs/dbraw/zinc/18/80/35/946188035.db2.gz OYJVZFLDPXGUQO-UHFFFAOYSA-N 0 0 374.441 3.544 20 5 FHBDRN CCCOc1ccc(CNC(=O)N(C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000045879969 946209305 /nfs/dbraw/zinc/20/93/05/946209305.db2.gz PZHNWHXWNGZMNF-UHFFFAOYSA-N 0 0 357.410 3.725 20 5 FHBDRN O=C(NCc1cn2ccccc2n1)c1cc2ccccc2c2cccnc12 ZINC000045877294 946210212 /nfs/dbraw/zinc/21/02/12/946210212.db2.gz OTMRVPKKQPSBFA-UHFFFAOYSA-N 0 0 352.397 3.966 20 5 FHBDRN O=C(O[C@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)c1coc2ccccc12 ZINC000759926736 946210363 /nfs/dbraw/zinc/21/03/63/946210363.db2.gz BSKXABRFLYLBCB-HOCLYGCPSA-N 0 0 355.350 3.878 20 5 FHBDRN O=Cc1ccc(Oc2nn3cc(C4CCCC4)nc3s2)c([N+](=O)[O-])c1 ZINC000302390671 946216263 /nfs/dbraw/zinc/21/62/63/946216263.db2.gz BSEUBIMBSQDXOT-UHFFFAOYSA-N 0 0 358.379 3.961 20 5 FHBDRN COc1c(C(=O)Nc2nc3cc(F)c(F)cc3s2)cccc1[N+](=O)[O-] ZINC000475459214 946237974 /nfs/dbraw/zinc/23/79/74/946237974.db2.gz APHVBRIIRDMECU-UHFFFAOYSA-N 0 0 365.317 3.744 20 5 FHBDRN Cn1cc(CNc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)c(C(F)(F)F)n1 ZINC000119050580 946239609 /nfs/dbraw/zinc/23/96/09/946239609.db2.gz DGUZCUHYCAKCMJ-UHFFFAOYSA-N 0 0 368.237 3.978 20 5 FHBDRN CC[C@@H](C)C(=O)Nc1cccc(CNC(=O)c2cccc(C)c2[N+](=O)[O-])c1 ZINC000045939560 946255271 /nfs/dbraw/zinc/25/52/71/946255271.db2.gz PXNUPSHNUGISKE-CYBMUJFWSA-N 0 0 369.421 3.818 20 5 FHBDRN CSc1cccc(C(=O)Nc2cc(C)ccc2NC(C)=O)c1[N+](=O)[O-] ZINC000186453924 946260116 /nfs/dbraw/zinc/26/01/16/946260116.db2.gz LRZNZPBMQCMWAJ-UHFFFAOYSA-N 0 0 359.407 3.836 20 5 FHBDRN CCCC[C@@H](COC)NC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000522996410 946267334 /nfs/dbraw/zinc/26/73/34/946267334.db2.gz MJNDHGUKMPUMLY-INIZCTEOSA-N 0 0 351.447 3.720 20 5 FHBDRN COc1ccccc1-c1cc(NC(=O)c2cc([N+](=O)[O-])c(C)s2)n[nH]1 ZINC000109410064 946273263 /nfs/dbraw/zinc/27/32/63/946273263.db2.gz ZMGQAQGVQSTFAO-UHFFFAOYSA-N 0 0 358.379 3.616 20 5 FHBDRN CC1(C)CC[C@@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2Br)C1 ZINC000508483133 946277331 /nfs/dbraw/zinc/27/73/31/946277331.db2.gz ILDBMIYVKAIUAU-LLVKDONJSA-N 0 0 355.232 3.595 20 5 FHBDRN Cc1ccc([C@H]2C[C@H](C)N(C(=O)COc3ccc([N+](=O)[O-])c(C)c3)C2)cc1 ZINC001270835973 946279371 /nfs/dbraw/zinc/27/93/71/946279371.db2.gz QRJMKUFKOTVSGL-WMZOPIPTSA-N 0 0 368.433 3.995 20 5 FHBDRN CCc1cc(NCc2ccccc2CO)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000109439553 946291778 /nfs/dbraw/zinc/29/17/78/946291778.db2.gz GOOBAOBAIUIGIY-UHFFFAOYSA-N 0 0 364.405 3.719 20 5 FHBDRN COc1cccc([C@@H](C)CC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)c1 ZINC000088231000 946295387 /nfs/dbraw/zinc/29/53/87/946295387.db2.gz BEGRWLZQOUPKRT-AWEZNQCLSA-N 0 0 354.406 3.682 20 5 FHBDRN CCOc1ccc(C(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)cc1OCC ZINC000088232099 946295456 /nfs/dbraw/zinc/29/54/56/946295456.db2.gz DWRHJAKFNNYUFF-UHFFFAOYSA-N 0 0 370.405 3.591 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CC[C@@](C)(c2ccccc2)C1 ZINC000438490623 946304810 /nfs/dbraw/zinc/30/48/10/946304810.db2.gz LBRIZIWQKLYCNL-HXUWFJFHSA-N 0 0 353.422 3.505 20 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/nfs/dbraw/zinc/33/17/55/946331755.db2.gz MOKXSJFNEKLZHD-UHFFFAOYSA-N 0 0 358.394 3.928 20 5 FHBDRN COC1CCC(CC(=O)Nc2cc(C)nn2-c2ccc([N+](=O)[O-])cc2)CC1 ZINC000127177890 946339651 /nfs/dbraw/zinc/33/96/51/946339651.db2.gz VHIATLFSJSFJCE-UHFFFAOYSA-N 0 0 372.425 3.623 20 5 FHBDRN COC(=O)c1ccc(-c2nc(COc3ccc([N+](=O)[O-])c(C)c3)co2)cc1 ZINC000543864408 946343179 /nfs/dbraw/zinc/34/31/79/946343179.db2.gz PTWMMZJYUYKABP-UHFFFAOYSA-N 0 0 368.345 3.924 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)c1csc(Br)c1 ZINC000035222455 946362120 /nfs/dbraw/zinc/36/21/20/946362120.db2.gz AKFWVQGSVYSOOR-UHFFFAOYSA-N 0 0 357.185 3.680 20 5 FHBDRN CCOc1c(Cl)cc(C(=O)NCc2ccccc2[N+](=O)[O-])cc1OC ZINC000046136148 946362490 /nfs/dbraw/zinc/36/24/90/946362490.db2.gz DMVUNKMTODSQKX-UHFFFAOYSA-N 0 0 364.785 3.586 20 5 FHBDRN CN(C(=O)CCc1ccc([N+](=O)[O-])cc1Cl)c1ccc(Cl)nc1 ZINC001270844080 946362813 /nfs/dbraw/zinc/36/28/13/946362813.db2.gz IOCRWHQZPZRKLY-UHFFFAOYSA-N 0 0 354.193 3.892 20 5 FHBDRN O=[N+]([O-])c1ccccc1NCCc1noc([C@H]2CCOc3ccccc32)n1 ZINC000545676610 946373725 /nfs/dbraw/zinc/37/37/25/946373725.db2.gz UWTBZTBODWEMPV-AWEZNQCLSA-N 0 0 366.377 3.547 20 5 FHBDRN CN(Cc1nc(-c2ccccc2)c[nH]1)C(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000121305859 946375311 /nfs/dbraw/zinc/37/53/11/946375311.db2.gz YPTYEHRNTRCNPG-UHFFFAOYSA-N 0 0 370.796 3.911 20 5 FHBDRN Cc1cc(C(=O)N(C)c2nc(-c3ccccc3[N+](=O)[O-])cs2)ccn1 ZINC000448341522 946381520 /nfs/dbraw/zinc/38/15/20/946381520.db2.gz KQFKZQCAODIOTE-UHFFFAOYSA-N 0 0 354.391 3.698 20 5 FHBDRN O=[N+]([O-])c1ccccc1NCCc1noc(-c2cc3c(cccc3F)[nH]2)n1 ZINC000545670619 946384218 /nfs/dbraw/zinc/38/42/18/946384218.db2.gz FKYOOOHHXFGCAK-UHFFFAOYSA-N 0 0 367.340 3.920 20 5 FHBDRN CC(C)c1ccc([S@@](=O)CCC(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000507738156 946385142 /nfs/dbraw/zinc/38/51/42/946385142.db2.gz ANOXPFIDHBXQML-VWLOTQADSA-N 0 0 360.435 3.855 20 5 FHBDRN COc1cc(C)c(NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)cc1F ZINC000186048301 946403014 /nfs/dbraw/zinc/40/30/14/946403014.db2.gz NACLQXBXUIPVGR-UHFFFAOYSA-N 0 0 370.283 3.905 20 5 FHBDRN CC(=O)N[C@@H](CC(=O)Nc1c(C)ccc([N+](=O)[O-])c1C)c1ccc(C)cc1 ZINC000129484801 946405697 /nfs/dbraw/zinc/40/56/97/946405697.db2.gz OBEHOMKAZBUAKJ-KRWDZBQOSA-N 0 0 369.421 3.726 20 5 FHBDRN O=C(CC1CCC(=O)CC1)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000475485585 946407672 /nfs/dbraw/zinc/40/76/72/946407672.db2.gz GXFIFPMHPGWAIK-UHFFFAOYSA-N 0 0 359.407 3.806 20 5 FHBDRN CCOc1ccc(C(=O)O[C@H](c2ccccn2)C(F)(F)F)cc1[N+](=O)[O-] ZINC000159971772 946412810 /nfs/dbraw/zinc/41/28/10/946412810.db2.gz CBPSUKQRCHPTQA-CQSZACIVSA-N 0 0 370.283 3.849 20 5 FHBDRN COCCOc1ccc(NC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000047762943 946421593 /nfs/dbraw/zinc/42/15/93/946421593.db2.gz PGITZENUAPGMNA-AWEZNQCLSA-N 0 0 373.409 3.811 20 5 FHBDRN COc1ccc(OC(C)C)c(NC(=O)Cc2cccc([N+](=O)[O-])c2C)c1 ZINC000121371309 946422232 /nfs/dbraw/zinc/42/22/32/946422232.db2.gz NTTANQRMWSCKDB-UHFFFAOYSA-N 0 0 358.394 3.880 20 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/nfs/dbraw/zinc/46/28/01/946462801.db2.gz QBNSXVSCYQELOF-INIZCTEOSA-N 0 0 365.433 3.948 20 5 FHBDRN CC(C)(NC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2)c1cccc(Cl)c1 ZINC000523093081 946466315 /nfs/dbraw/zinc/46/63/15/946466315.db2.gz GJQZYDKBIWVDSX-UHFFFAOYSA-N 0 0 362.769 3.642 20 5 FHBDRN COCc1cccc(NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)c1 ZINC000025821822 946469799 /nfs/dbraw/zinc/46/97/99/946469799.db2.gz CWKBQMMJPQZGKG-UHFFFAOYSA-N 0 0 355.394 3.594 20 5 FHBDRN COc1cccc(F)c1NC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000186120573 946487420 /nfs/dbraw/zinc/48/74/20/946487420.db2.gz VNELENRFUNEBND-UHFFFAOYSA-N 0 0 359.357 3.939 20 5 FHBDRN O=C(c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)N(CC1CCCCC1)C1CC1 ZINC000111574078 946488027 /nfs/dbraw/zinc/48/80/27/946488027.db2.gz GVSIEWKZVDSZDN-UHFFFAOYSA-N 0 0 369.421 3.621 20 5 FHBDRN Cc1ccc2cccc(NC(=O)c3cc(=O)[nH]c4ccc([N+](=O)[O-])cc43)c2n1 ZINC000111598214 946489807 /nfs/dbraw/zinc/48/98/07/946489807.db2.gz DQUATLLUYYBOLN-UHFFFAOYSA-N 0 0 374.356 3.545 20 5 FHBDRN COC(=O)[C@@H](NCc1ccc(-c2cccc([N+](=O)[O-])c2)o1)c1cccs1 ZINC000475144732 946493502 /nfs/dbraw/zinc/49/35/02/946493502.db2.gz VAOTYCKYRCPTNY-KRWDZBQOSA-N 0 0 372.402 3.920 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)c1sc(C)cc1OC(F)F ZINC000074400448 946501819 /nfs/dbraw/zinc/50/18/19/946501819.db2.gz OJCZPGGXVIOPAS-UHFFFAOYSA-N 0 0 358.322 3.827 20 5 FHBDRN CSc1cccc(C(=O)NC[C@@H]2CCCO[C@@H]2C(C)(C)C)c1[N+](=O)[O-] ZINC000186524199 946504266 /nfs/dbraw/zinc/50/42/66/946504266.db2.gz OZHHTTQXFYCDDI-LRDDRELGSA-N 0 0 366.483 3.888 20 5 FHBDRN CCc1nc([C@H](C)NC(=O)CCOc2cc(C)ccc2[N+](=O)[O-])cs1 ZINC000111672329 946510032 /nfs/dbraw/zinc/51/00/32/946510032.db2.gz SNEGMQMPVIFRID-LBPRGKRZSA-N 0 0 363.439 3.568 20 5 FHBDRN CCc1cnc(N2CCN(Cc3ccc(Cl)cc3[N+](=O)[O-])CC2)s1 ZINC000441367606 946515905 /nfs/dbraw/zinc/51/59/05/946515905.db2.gz XSIDPZSIGUXNJC-UHFFFAOYSA-N 0 0 366.874 3.589 20 5 FHBDRN Cc1ccc2c(CCNC(=O)c3ccc(F)cc3[N+](=O)[O-])cn(C)c2c1 ZINC000186551467 946535140 /nfs/dbraw/zinc/53/51/40/946535140.db2.gz ZNDZCLSKTBWULW-UHFFFAOYSA-N 0 0 355.369 3.507 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)NC1(Cc2ccccc2)CCCCC1 ZINC000186158570 946541031 /nfs/dbraw/zinc/54/10/31/946541031.db2.gz IWQIPTUAIKCECE-UHFFFAOYSA-N 0 0 370.453 3.552 20 5 FHBDRN Cc1oc2ccccc2c1CNC(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000186161745 946541799 /nfs/dbraw/zinc/54/17/99/946541799.db2.gz AZVHBZNNZQXCGD-UHFFFAOYSA-N 0 0 353.378 3.991 20 5 FHBDRN C[C@@H](CNC(=O)N1CC(C)(C)[C@H]1c1cccnc1)c1ccccc1[N+](=O)[O-] ZINC000897058023 946544677 /nfs/dbraw/zinc/54/46/77/946544677.db2.gz LOHTZPZGDPDHIW-KBXCAEBGSA-N 0 0 368.437 3.886 20 5 FHBDRN O=C(Cc1cccc(F)c1[N+](=O)[O-])Nc1cc(CC2CCCCC2)[nH]n1 ZINC001141991903 946546077 /nfs/dbraw/zinc/54/60/77/946546077.db2.gz TYOSSCABVMKEAB-UHFFFAOYSA-N 0 0 360.389 3.761 20 5 FHBDRN CCN(C(=O)NC[C@H](C)c1ccccc1[N+](=O)[O-])[C@H]1CCOC(C)(C)C1 ZINC000897058767 946546083 /nfs/dbraw/zinc/54/60/83/946546083.db2.gz RZZGDZUARGUPJP-GJZGRUSLSA-N 0 0 363.458 3.687 20 5 FHBDRN C[C@H](CNC(=O)N1C[C@H](C)C[C@H]1c1cccnc1)c1ccccc1[N+](=O)[O-] ZINC000897060907 946547544 /nfs/dbraw/zinc/54/75/44/946547544.db2.gz DFAJSVLLMFOPOH-CLCXKQKWSA-N 0 0 368.437 3.886 20 5 FHBDRN C[C@@H](CNC(=O)N1CCC[C@H]1c1cccnc1)c1ccccc1[N+](=O)[O-] ZINC000897075619 946555600 /nfs/dbraw/zinc/55/56/00/946555600.db2.gz OQMJNPRUMGBMAZ-YOEHRIQHSA-N 0 0 354.410 3.640 20 5 FHBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)N1CCc2sccc2C1 ZINC000120892451 946563857 /nfs/dbraw/zinc/56/38/57/946563857.db2.gz MSHVTVNPZSAMBP-UHFFFAOYSA-N 0 0 359.451 3.747 20 5 FHBDRN Cc1cc(Br)cc([N+](=O)[O-])c1OCc1nccn1C(F)F ZINC000567371146 946585430 /nfs/dbraw/zinc/58/54/30/946585430.db2.gz ISBVWNWXJOKGIO-UHFFFAOYSA-N 0 0 362.130 3.836 20 5 FHBDRN CSc1cccc(C(=O)Nc2cccc(-c3nccn3C)c2)c1[N+](=O)[O-] ZINC000186180727 946585558 /nfs/dbraw/zinc/58/55/58/946585558.db2.gz MOYNHPWWRAWBIS-UHFFFAOYSA-N 0 0 368.418 3.970 20 5 FHBDRN C[C@@H](c1ccccc1[N+](=O)[O-])N1CCN(Cc2ccc(Cl)cc2)C(=O)C1 ZINC000441407596 946585409 /nfs/dbraw/zinc/58/54/09/946585409.db2.gz UTMQMDHUUZOQGK-AWEZNQCLSA-N 0 0 373.840 3.654 20 5 FHBDRN CSc1cccc(C(=O)NCCc2c(F)cccc2F)c1[N+](=O)[O-] ZINC000186171726 946585703 /nfs/dbraw/zinc/58/57/03/946585703.db2.gz XWJUJGAVJDAJOV-UHFFFAOYSA-N 0 0 352.362 3.567 20 5 FHBDRN CC[C@H](C)[C@](C)(O)CNC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000475188496 946590859 /nfs/dbraw/zinc/59/08/59/946590859.db2.gz CBUILEBDZFWQGD-LKFCYVNXSA-N 0 0 363.336 3.532 20 5 FHBDRN CCC[C@@H](C)[C@H]1CCCN1C(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000159145537 946608547 /nfs/dbraw/zinc/60/85/47/946608547.db2.gz MCYVEJCUNUINFQ-GDBMZVCRSA-N 0 0 356.426 3.821 20 5 FHBDRN Cc1ccccc1[C@@H]1C[C@@H](C)N(C(=O)COc2ccc([N+](=O)[O-])cc2)C1 ZINC000523099290 946611263 /nfs/dbraw/zinc/61/12/63/946611263.db2.gz OYXYXQDHMZAHCQ-HZPDHXFCSA-N 0 0 354.406 3.687 20 5 FHBDRN O=[N+]([O-])c1ccc(Cc2noc(/C=C/c3ccc(F)c(Cl)c3)n2)nc1 ZINC000545774984 946619309 /nfs/dbraw/zinc/61/93/09/946619309.db2.gz IVDFPJYNAQNVNI-QHHAFSJGSA-N 0 0 360.732 3.927 20 5 FHBDRN C[C@@]1(Cc2ccccc2)CCCN1C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000186218288 946629607 /nfs/dbraw/zinc/62/96/07/946629607.db2.gz DTCLBECRDBEXEZ-FQEVSTJZSA-N 0 0 364.405 3.709 20 5 FHBDRN CC1(C)CC[C@@H](CNC(=O)c2cccc3c(=O)c4cccc(F)c4[nH]c23)O1 ZINC000444329421 946629693 /nfs/dbraw/zinc/62/96/93/946629693.db2.gz KCMRFLFMNFJNHQ-LBPRGKRZSA-N 0 0 368.408 3.508 20 5 FHBDRN CCOc1ccc(C(=O)N2CCCC[C@H](SCC)C2)cc1[N+](=O)[O-] ZINC000112039162 946630676 /nfs/dbraw/zinc/63/06/76/946630676.db2.gz JLDBDFOTJSJFFO-AWEZNQCLSA-N 0 0 352.456 3.741 20 5 FHBDRN CSc1cccc(C(=O)Nc2nnc(C(C)(C)C)s2)c1[N+](=O)[O-] ZINC000186227367 946634249 /nfs/dbraw/zinc/63/42/49/946634249.db2.gz NPVACDHUMMISCY-UHFFFAOYSA-N 0 0 352.441 3.718 20 5 FHBDRN CSc1cccc(C(=O)NC[C@H](C)Oc2ccccc2F)c1[N+](=O)[O-] ZINC000186594316 946635667 /nfs/dbraw/zinc/63/56/67/946635667.db2.gz XPGGJMZQLJBRQI-NSHDSACASA-N 0 0 364.398 3.653 20 5 FHBDRN COCCN(Cc1cccs1)C(=O)Nc1cc(C)c([N+](=O)[O-])cc1C ZINC000475554376 946638155 /nfs/dbraw/zinc/63/81/55/946638155.db2.gz ISRRGQHUFAAPER-UHFFFAOYSA-N 0 0 363.439 3.954 20 5 FHBDRN O=C(COc1ccccc1[N+](=O)[O-])Nc1ccc(Cl)c2ncccc12 ZINC000026071164 946638468 /nfs/dbraw/zinc/63/84/68/946638468.db2.gz RIAHHSCQTVAYGO-UHFFFAOYSA-N 0 0 357.753 3.814 20 5 FHBDRN Cc1c(C(=O)NCC(C)(C)c2cccs2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000074648779 946657702 /nfs/dbraw/zinc/65/77/02/946657702.db2.gz NRSNOAWHFRWABW-UHFFFAOYSA-N 0 0 363.395 3.581 20 5 FHBDRN O=C1[C@@H](Nc2ccc([N+](=O)[O-])nc2)CCN1c1ccc(Cl)cc1Cl ZINC000473911957 946658015 /nfs/dbraw/zinc/65/80/15/946658015.db2.gz RLPPBOAOZZBTQS-LBPRGKRZSA-N 0 0 367.192 3.514 20 5 FHBDRN C[C@@H]1C[C@H](CNC(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CCO1 ZINC000475192361 946661147 /nfs/dbraw/zinc/66/11/47/946661147.db2.gz MPKJTJKUIPUPOF-NXEZZACHSA-N 0 0 361.320 3.550 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)c2cc(COC(C)(C)C)on2)cc1[N+](=O)[O-] ZINC000186259810 946664105 /nfs/dbraw/zinc/66/41/05/946664105.db2.gz PVTLWUHYKAIQKO-LBPRGKRZSA-N 0 0 361.398 3.697 20 5 FHBDRN CC(C)(C)OCc1cc(C(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)no1 ZINC000186613534 946684574 /nfs/dbraw/zinc/68/45/74/946684574.db2.gz UTBKSAIAPXYUJC-UHFFFAOYSA-N 0 0 373.409 3.703 20 5 FHBDRN COCC[C@H](Cc1ccco1)NC(=O)Nc1cc(C)c([N+](=O)[O-])cc1C ZINC000475569165 946695381 /nfs/dbraw/zinc/69/53/81/946695381.db2.gz GGDKPNBXJWJQFM-CQSZACIVSA-N 0 0 361.398 3.574 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCCc2cc(N)ccc21 ZINC000186611101 946701029 /nfs/dbraw/zinc/70/10/29/946701029.db2.gz MASYKVPNKKJTCI-KZULUSFZSA-N 0 0 371.462 3.851 20 5 FHBDRN CO[C@H]1CCC[C@@H]1CNC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000475198128 946707976 /nfs/dbraw/zinc/70/79/76/946707976.db2.gz VUMJYHPBQCEGHG-RNCFNFMXSA-N 0 0 361.320 3.550 20 5 FHBDRN CSc1cccc(C(=O)N2CCN(C)c3cc(F)ccc32)c1[N+](=O)[O-] ZINC000186617733 946718695 /nfs/dbraw/zinc/71/86/95/946718695.db2.gz GXAMDJAOKCUMJJ-UHFFFAOYSA-N 0 0 361.398 3.552 20 5 FHBDRN CCO[C@H]1C[C@@H](NC(=O)c2cccc(SC)c2[N+](=O)[O-])C12CCCC2 ZINC000186617967 946718692 /nfs/dbraw/zinc/71/86/92/946718692.db2.gz DPSBWFSKCMUNML-CABCVRRESA-N 0 0 364.467 3.784 20 5 FHBDRN CCc1ccccc1OCC(=O)Nc1ccc([N+](=O)[O-])c2ncccc12 ZINC000463130323 946720681 /nfs/dbraw/zinc/72/06/81/946720681.db2.gz KUCXMYKQXNWTJJ-UHFFFAOYSA-N 0 0 351.362 3.723 20 5 FHBDRN Cc1ncc(CNC(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)s1 ZINC000475205736 946721614 /nfs/dbraw/zinc/72/16/14/946721614.db2.gz JVSVJXUKYLIJLW-UHFFFAOYSA-N 0 0 360.317 3.700 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)NC1(Cc2ccccc2)CC1 ZINC000186271762 946729353 /nfs/dbraw/zinc/72/93/53/946729353.db2.gz UFHMZBRMOVAGKE-UHFFFAOYSA-N 0 0 353.422 3.678 20 5 FHBDRN O=C(NCCC1CCOCC1)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000475215099 946731761 /nfs/dbraw/zinc/73/17/61/946731761.db2.gz KSUXWMXOVCMUPB-UHFFFAOYSA-N 0 0 361.320 3.552 20 5 FHBDRN CC(C)(C)C[C@@H](O)CNC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000475217598 946732565 /nfs/dbraw/zinc/73/25/65/946732565.db2.gz XKPWCZYLXWBBFG-SNVBAGLBSA-N 0 0 363.336 3.532 20 5 FHBDRN C[C@@H](C[C@H]1CCCO1)NC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000475217518 946732656 /nfs/dbraw/zinc/73/26/56/946732656.db2.gz WYISLUXBJPEVME-GXSJLCMTSA-N 0 0 361.320 3.693 20 5 FHBDRN Cc1ccccc1-n1cc(C(=O)N2c3ccc([N+](=O)[O-])cc3C[C@H]2C)cn1 ZINC000112169289 946733742 /nfs/dbraw/zinc/73/37/42/946733742.db2.gz LEZMMSQDPNIWKI-CQSZACIVSA-N 0 0 362.389 3.680 20 5 FHBDRN Cc1nc(CCNC(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)c(C)o1 ZINC000475226119 946733771 /nfs/dbraw/zinc/73/37/71/946733771.db2.gz XDXDJLMJLLFIHS-UHFFFAOYSA-N 0 0 372.303 3.583 20 5 FHBDRN Cc1c(C(=O)NCc2ccccc2[N+](=O)[O-])cnn1-c1ccccc1Cl ZINC000112170813 946735081 /nfs/dbraw/zinc/73/50/81/946735081.db2.gz UDWWXOJRGJRXRJ-UHFFFAOYSA-N 0 0 370.796 3.672 20 5 FHBDRN CCCCN(CCOC)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000475219711 946742526 /nfs/dbraw/zinc/74/25/26/946742526.db2.gz NNFMGQGHYFXXNO-UHFFFAOYSA-N 0 0 363.336 3.894 20 5 FHBDRN C[C@H](NC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)[C@H]1CCCCO1 ZINC000475221239 946742737 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FHBDRN O=C(c1ccc([N+](=O)[O-])cc1)N1CCO[C@H](c2ccc(F)cc2Cl)C1 ZINC000186321017 946885407 /nfs/dbraw/zinc/88/54/07/946885407.db2.gz BWPZANOVYDGGPX-INIZCTEOSA-N 0 0 364.760 3.601 20 5 FHBDRN Cc1cc([N+](=O)[O-])cnc1N1CCC([C@@H](O)c2ccc(Cl)cc2)CC1 ZINC000067373841 946888320 /nfs/dbraw/zinc/88/83/20/946888320.db2.gz ZVMLDSPMMDGLFW-KRWDZBQOSA-N 0 0 361.829 3.902 20 5 FHBDRN CC(C)COc1ccc(CC(=O)N2CCc3c2cccc3[N+](=O)[O-])cc1 ZINC000523132222 946899674 /nfs/dbraw/zinc/89/96/74/946899674.db2.gz SSGWUIXOCFIPLU-UHFFFAOYSA-N 0 0 354.406 3.761 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2noc(CN3CCC[C@H]3c3ccccc3)n2)c1 ZINC000025934870 946905546 /nfs/dbraw/zinc/90/55/46/946905546.db2.gz VFQHSSKNJBFQCT-KRWDZBQOSA-N 0 0 350.378 3.982 20 5 FHBDRN O=C(NCc1cccc([N+](=O)[O-])c1)c1ccc(SC(F)(F)F)nc1 ZINC001126173109 946909949 /nfs/dbraw/zinc/90/99/49/946909949.db2.gz UUONDGTVDLWPTB-UHFFFAOYSA-N 0 0 357.313 3.532 20 5 FHBDRN O=C(CSc1ccc(F)c(F)c1)N1CCCc2ccc([N+](=O)[O-])cc21 ZINC000112629063 946911167 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ZINC000182629204 946961511 /nfs/dbraw/zinc/96/15/11/946961511.db2.gz IVEQOWWVUDDATH-UHFFFAOYSA-N 0 0 370.274 3.857 20 5 FHBDRN CSc1ccc(C(=O)Nc2cnn(-c3ccccc3F)c2)cc1[N+](=O)[O-] ZINC000121465193 946967326 /nfs/dbraw/zinc/96/73/26/946967326.db2.gz OCUKTBDJLHKWOV-UHFFFAOYSA-N 0 0 372.381 3.894 20 5 FHBDRN O=[N+]([O-])c1ccc(Cc2nc(COc3ccc(F)cc3)no2)c(Cl)c1 ZINC000121470127 946970550 /nfs/dbraw/zinc/97/05/50/946970550.db2.gz JGZIDCXKRVWRGU-UHFFFAOYSA-N 0 0 363.732 3.940 20 5 FHBDRN COc1ccc(NC(=O)NCc2ccccc2C(F)(F)F)cc1[N+](=O)[O-] ZINC000543886071 946976328 /nfs/dbraw/zinc/97/63/28/946976328.db2.gz CJFMDFQSAQEVAQ-UHFFFAOYSA-N 0 0 369.299 3.944 20 5 FHBDRN COc1cccc(N(CC(C)C)C(=O)c2cccc([N+](=O)[O-])c2OC)c1 ZINC000475375884 946986425 /nfs/dbraw/zinc/98/64/25/946986425.db2.gz ZPSZGJFAGDIXHR-UHFFFAOYSA-N 0 0 358.394 3.915 20 5 FHBDRN CC[C@@H](C)[C@H](NC(=O)CCCNc1ccc([N+](=O)[O-])cc1)C(F)(F)F ZINC000444560406 947001910 /nfs/dbraw/zinc/00/19/10/947001910.db2.gz VMKPVUVYPRBWFR-ABAIWWIYSA-N 0 0 361.364 3.880 20 5 FHBDRN CCOc1cc(C(=O)N2CC[C@H](CC(C)(C)C)C2)c([N+](=O)[O-])cc1OC ZINC000457002270 947006963 /nfs/dbraw/zinc/00/69/63/947006963.db2.gz APMREIYQSXIJFY-CYBMUJFWSA-N 0 0 364.442 3.900 20 5 FHBDRN O=C(Nc1ccc(Br)c([N+](=O)[O-])c1)N[C@@H]1CC12CCCC2 ZINC000760112907 947045300 /nfs/dbraw/zinc/04/53/00/947045300.db2.gz KACPBEZBGQPHBK-GFCCVEGCSA-N 0 0 354.204 3.812 20 5 FHBDRN O=C(N[C@@H](c1ccccc1)[C@@H]1CCCO1)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000523272991 947059005 /nfs/dbraw/zinc/05/90/05/947059005.db2.gz OILQDIKLASANKT-HKUYNNGSSA-N 0 0 366.373 3.991 20 5 FHBDRN CC[C@@H](CC(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccc(C)cc1 ZINC000444629641 947060493 /nfs/dbraw/zinc/06/04/93/947060493.db2.gz DSNFWPXFSQPHDD-AWEZNQCLSA-N 0 0 366.421 3.980 20 5 FHBDRN C[C@@H](NC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)c1ccc(F)cc1F ZINC000088478324 947061462 /nfs/dbraw/zinc/06/14/62/947061462.db2.gz UWOONORRTMXVDM-LLVKDONJSA-N 0 0 361.348 3.702 20 5 FHBDRN CC1(C)CN(C(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)CC[C@@H]1O ZINC000438520055 947061431 /nfs/dbraw/zinc/06/14/31/947061431.db2.gz USLODCCDLJKVAL-SFHVURJKSA-N 0 0 369.421 3.571 20 5 FHBDRN CCc1ccc([C@H](C)CC(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000444638687 947080955 /nfs/dbraw/zinc/08/09/55/947080955.db2.gz LJFBDLJDCHIPDS-CYBMUJFWSA-N 0 0 366.421 3.844 20 5 FHBDRN CC(C)c1cccc(C(=O)Nc2cc3c(cc2[N+](=O)[O-])OCCCO3)n1 ZINC000475433992 947085462 /nfs/dbraw/zinc/08/54/62/947085462.db2.gz KSXOIKANQPIKBV-UHFFFAOYSA-N 0 0 357.366 3.527 20 5 FHBDRN C[C@H](Cc1cccc(Cl)c1)C(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444643501 947086051 /nfs/dbraw/zinc/08/60/51/947086051.db2.gz KJBXFWFXJUAUQL-LLVKDONJSA-N 0 0 372.812 3.620 20 5 FHBDRN CNc1ccc(C(=O)Nc2ccc(-n3ccnc3)c(Cl)c2)cc1[N+](=O)[O-] ZINC000523312252 947098664 /nfs/dbraw/zinc/09/86/64/947098664.db2.gz KHOUQYOJQGXQSU-UHFFFAOYSA-N 0 0 371.784 3.728 20 5 FHBDRN COc1ccc2c(c1)C[C@H](C)N(Cc1nc3cc([N+](=O)[O-])ccc3[nH]1)[C@@H]2C ZINC000444679710 947104358 /nfs/dbraw/zinc/10/43/58/947104358.db2.gz BINFIPDSXZQRSB-QWHCGFSZSA-N 0 0 366.421 3.988 20 5 FHBDRN CN(C(=O)CCCNc1ccc([N+](=O)[O-])cc1)[C@H]1CCc2ccccc2C1 ZINC000511950302 947110306 /nfs/dbraw/zinc/11/03/06/947110306.db2.gz XOZGEECLDOGICC-FQEVSTJZSA-N 0 0 367.449 3.803 20 5 FHBDRN CC(C)OC(=O)C[C@@H](NC(=O)C[C@H]1C=CCCC1)c1ccccc1[N+](=O)[O-] ZINC000186375264 947111634 /nfs/dbraw/zinc/11/16/34/947111634.db2.gz FWCYUVQXVZBEPY-DOTOQJQBSA-N 0 0 374.437 3.840 20 5 FHBDRN Cc1ccc(S(=O)(=O)N(C)c2ccc(OC(C)C)cc2)c([N+](=O)[O-])c1 ZINC000428374938 947111901 /nfs/dbraw/zinc/11/19/01/947111901.db2.gz BPWGFQJACJAIFD-UHFFFAOYSA-N 0 0 364.423 3.516 20 5 FHBDRN CCOC(=O)[C@H]1CCN(Cc2ccc([N+](=O)[O-])cc2F)c2ccccc21 ZINC000444708648 947136762 /nfs/dbraw/zinc/13/67/62/947136762.db2.gz RTTDMIGVXMHCTA-INIZCTEOSA-N 0 0 358.369 3.791 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)c1ccn(-c2ccccc2F)n1 ZINC000444732525 947148135 /nfs/dbraw/zinc/14/81/35/947148135.db2.gz WEMYGESUZUZELG-UHFFFAOYSA-N 0 0 354.341 3.789 20 5 FHBDRN Cc1ccc(S(=O)(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc1F ZINC000511956183 947160015 /nfs/dbraw/zinc/16/00/15/947160015.db2.gz QXGIFTNOYWMONA-UHFFFAOYSA-N 0 0 366.414 3.642 20 5 FHBDRN CCC1(Cc2ccccc2)CCN(C(=O)Nc2ccncc2[N+](=O)[O-])CC1 ZINC000432298064 947172452 /nfs/dbraw/zinc/17/24/52/947172452.db2.gz VJEMQZGHPZXIGO-UHFFFAOYSA-N 0 0 368.437 3.679 20 5 FHBDRN Cc1sc(C(=O)NCCc2coc(-c3ccc(C)cc3)n2)cc1[N+](=O)[O-] ZINC000523373730 947173531 /nfs/dbraw/zinc/17/35/31/947173531.db2.gz HHBSLDXLOWJBLA-UHFFFAOYSA-N 0 0 371.418 3.901 20 5 FHBDRN Cc1ccc(F)c(CN(C)[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)c1 ZINC000444742864 947178429 /nfs/dbraw/zinc/17/84/29/947178429.db2.gz HAWXBICYSITNJH-CQSZACIVSA-N 0 0 359.401 3.810 20 5 FHBDRN CCN(CC)C(=O)[C@H](C)Sc1ccc(Br)cc1[N+](=O)[O-] ZINC000088501311 947181190 /nfs/dbraw/zinc/18/11/90/947181190.db2.gz OBJHGEIOECNPIM-VIFPVBQESA-N 0 0 361.261 3.706 20 5 FHBDRN O=[N+]([O-])c1cc(C(F)(F)F)ccc1NCCCc1nnc2ccccn21 ZINC000301132932 947195732 /nfs/dbraw/zinc/19/57/32/947195732.db2.gz URBFXGHIYCHXOG-UHFFFAOYSA-N 0 0 365.315 3.701 20 5 FHBDRN Cc1c(NC(=O)CCCNc2ccc([N+](=O)[O-])cc2)cccc1[N+](=O)[O-] ZINC000021186888 947212557 /nfs/dbraw/zinc/21/25/57/947212557.db2.gz GBNDRTVWJKKTKS-UHFFFAOYSA-N 0 0 358.354 3.642 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H](OC)C[C@H]1C ZINC000441435760 947239946 /nfs/dbraw/zinc/23/99/46/947239946.db2.gz FNTXLWXQQRAUAD-OCCSQVGLSA-N 0 0 352.456 3.736 20 5 FHBDRN Cc1cccc(OCCNC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)c1 ZINC000444825767 947240138 /nfs/dbraw/zinc/24/01/38/947240138.db2.gz KKQQZXMBFZWKMY-UHFFFAOYSA-N 0 0 372.424 3.799 20 5 FHBDRN CC(C)(CNC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1)c1ccccn1 ZINC000458921570 947241710 /nfs/dbraw/zinc/24/17/10/947241710.db2.gz NCAOLBZPTPUGPG-UHFFFAOYSA-N 0 0 356.426 3.502 20 5 FHBDRN Cc1ccccc1CCNC(=O)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000444828068 947242049 /nfs/dbraw/zinc/24/20/49/947242049.db2.gz MKQDGXXSUPFTSV-UHFFFAOYSA-N 0 0 356.425 3.962 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2ncn(Cc3coc(-c4ccc(F)cc4)n3)n2)cc1 ZINC000508510461 947259934 /nfs/dbraw/zinc/25/99/34/947259934.db2.gz FCSRPXIUTFNCAP-UHFFFAOYSA-N 0 0 365.324 3.696 20 5 FHBDRN CCC(=O)c1ccc(OCC(=O)O[C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000021227153 947261374 /nfs/dbraw/zinc/26/13/74/947261374.db2.gz AYQWSYZEBDZBHZ-CYBMUJFWSA-N 0 0 357.362 3.871 20 5 FHBDRN CSc1ccc(NC(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000444835766 947269789 /nfs/dbraw/zinc/26/97/89/947269789.db2.gz KZYGZZAZRNHMHC-UHFFFAOYSA-N 0 0 357.395 3.515 20 5 FHBDRN CCc1nn(C)c(N2CCn3c(cc4c3cccc4Cl)C2)c1[N+](=O)[O-] ZINC000444879606 947306100 /nfs/dbraw/zinc/30/61/00/947306100.db2.gz VWVQVWXFSQOILD-UHFFFAOYSA-N 0 0 359.817 3.519 20 5 FHBDRN CC(C)(C)[C@H]1CCCC[C@@H]1NC(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444885135 947310099 /nfs/dbraw/zinc/31/00/99/947310099.db2.gz MXVXUSLYVXLEHV-KBPBESRZSA-N 0 0 373.457 3.875 20 5 FHBDRN C[C@H](C(=O)O[C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)c1ccccc1F ZINC000759930625 947315809 /nfs/dbraw/zinc/31/58/09/947315809.db2.gz KBUHAQVZPQCNDY-VBNZEHGJSA-N 0 0 361.373 3.761 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[C@@H](c2ccccc2F)C1 ZINC000444901564 947321939 /nfs/dbraw/zinc/32/19/39/947321939.db2.gz MMFNSGBNRJQCLT-GFCCVEGCSA-N 0 0 359.357 3.764 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NCC1(c2ccc(F)cc2)CC1 ZINC000444907076 947327235 /nfs/dbraw/zinc/32/72/35/947327235.db2.gz NXJPBZPRFWPUDL-UHFFFAOYSA-N 0 0 359.357 3.596 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NCc1ccc(C)cc1SC ZINC000444908459 947328758 /nfs/dbraw/zinc/32/87/58/947328758.db2.gz RFSTVPPOGJJSTQ-UHFFFAOYSA-N 0 0 361.423 3.955 20 5 FHBDRN CN(C)c1ccc(C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)cc1F ZINC000523499805 947332368 /nfs/dbraw/zinc/33/23/68/947332368.db2.gz IMOFPDNALAHBOB-UHFFFAOYSA-N 0 0 359.401 3.553 20 5 FHBDRN CCOc1cccc([C@@H]2C[C@@H]2NC(=O)Nc2ccc([N+](=O)[O-])cc2OC)c1 ZINC000444919492 947338270 /nfs/dbraw/zinc/33/82/70/947338270.db2.gz DLTBEGOLYDJENQ-RDJZCZTQSA-N 0 0 371.393 3.680 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NCC1(c2cccc(F)c2)CC1 ZINC000444923158 947340177 /nfs/dbraw/zinc/34/01/77/947340177.db2.gz OLOKYKJPMNUXQJ-UHFFFAOYSA-N 0 0 359.357 3.596 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@H]1COc2ccc(Cl)cc21 ZINC000444925857 947344162 /nfs/dbraw/zinc/34/41/62/947344162.db2.gz AUFWLSIQQQTKDF-ZDUSSCGKSA-N 0 0 363.757 3.512 20 5 FHBDRN CCCCc1ccc(C(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000016058042 947351581 /nfs/dbraw/zinc/35/15/81/947351581.db2.gz LCXMPQJITYBQMI-UHFFFAOYSA-N 0 0 367.449 3.900 20 5 FHBDRN CC[C@@H](COC)NC(=O)c1ccccc1Sc1ccccc1[N+](=O)[O-] ZINC000440611156 947352252 /nfs/dbraw/zinc/35/22/52/947352252.db2.gz NNKAPHCIARFTHX-ZDUSSCGKSA-N 0 0 360.435 3.901 20 5 FHBDRN Cn1ccnc1[C@@H](Nc1c(F)cc([N+](=O)[O-])cc1F)c1ccc(F)cc1 ZINC000440602723 947352284 /nfs/dbraw/zinc/35/22/84/947352284.db2.gz ZFJIWXUHPIUTIO-HNNXBMFYSA-N 0 0 362.311 3.947 20 5 FHBDRN CCc1nnc(-c2cccc(NC(=O)c3cc(C)ccc3[N+](=O)[O-])c2)o1 ZINC000440602273 947352922 /nfs/dbraw/zinc/35/29/22/947352922.db2.gz NBZKDFUAJNEMPE-UHFFFAOYSA-N 0 0 352.350 3.768 20 5 FHBDRN O=C(C=CCc1cccc(F)c1)Nc1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000440607658 947358394 /nfs/dbraw/zinc/35/83/94/947358394.db2.gz BCFBJERDKRWQQQ-RQOWECAXSA-N 0 0 351.337 3.746 20 5 FHBDRN C[C@H](Oc1ccccc1Cl)C(=O)Nc1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000440614019 947359180 /nfs/dbraw/zinc/35/91/80/947359180.db2.gz FHDJJEWCHWFECB-NSHDSACASA-N 0 0 371.780 3.624 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2nc(CN3CCOCC34CCCC4)cs2)c1 ZINC000093840511 947382743 /nfs/dbraw/zinc/38/27/43/947382743.db2.gz DCPRFLVMSGQKMM-UHFFFAOYSA-N 0 0 359.451 3.863 20 5 FHBDRN Cc1cc(Cl)ccc1NC(=O)[C@H](C)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000438535445 947403792 /nfs/dbraw/zinc/40/37/92/947403792.db2.gz YDZVLARZKFYCMT-ZDUSSCGKSA-N 0 0 373.840 3.942 20 5 FHBDRN Cc1noc2ncc(NC(=O)c3cccc4c(=O)c5ccccc5[nH]c34)cc12 ZINC000445012095 947412877 /nfs/dbraw/zinc/41/28/77/947412877.db2.gz RAOZHSRCCLGNEH-UHFFFAOYSA-N 0 0 370.368 3.778 20 5 FHBDRN Cc1ccc(C(=O)N2C[C@@H](C)O[C@@H](c3ccc(F)cc3)C2)cc1[N+](=O)[O-] ZINC000152065353 947417344 /nfs/dbraw/zinc/41/73/44/947417344.db2.gz MFFKXOXWKSGYJT-FZKQIMNGSA-N 0 0 358.369 3.645 20 5 FHBDRN COc1ccc(O)c(NC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)c1 ZINC000445009333 947432906 /nfs/dbraw/zinc/43/29/06/947432906.db2.gz MLPASHLMYCAVAZ-UHFFFAOYSA-N 0 0 360.369 3.648 20 5 FHBDRN Cc1nc(CNC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)sc1C ZINC000445009510 947434444 /nfs/dbraw/zinc/43/44/44/947434444.db2.gz JXUVQRXGXHWDSL-UHFFFAOYSA-N 0 0 363.442 3.685 20 5 FHBDRN Cn1ccnc1-c1cccc(NC(=O)CSc2ccc([N+](=O)[O-])cc2)c1 ZINC000154139842 947467936 /nfs/dbraw/zinc/46/79/36/947467936.db2.gz KMIVGDGNBFQXJE-UHFFFAOYSA-N 0 0 368.418 3.726 20 5 FHBDRN Cc1nnc(-c2cccc(NC(=O)c3c(C)c(F)ccc3[N+](=O)[O-])c2)o1 ZINC001126206698 947473874 /nfs/dbraw/zinc/47/38/74/947473874.db2.gz CDVHYQOOCVBBKH-UHFFFAOYSA-N 0 0 356.313 3.653 20 5 FHBDRN CC(C)CO[C@H](C)c1noc(CN(C)C/C=C/c2ccccc2[N+](=O)[O-])n1 ZINC000093885636 947482818 /nfs/dbraw/zinc/48/28/18/947482818.db2.gz PPXVOBZOPCBFPV-LOWQCSRCSA-N 0 0 374.441 3.857 20 5 FHBDRN CCCN(C(=O)c1nnn(CC2CCCC2)c1C)c1cccc([N+](=O)[O-])c1 ZINC000441446344 947494630 /nfs/dbraw/zinc/49/46/30/947494630.db2.gz KUCAEEPTGSBBPY-UHFFFAOYSA-N 0 0 371.441 3.742 20 5 FHBDRN CCCN(C(=O)C[C@H]1COc2cc(OC)ccc21)c1cccc([N+](=O)[O-])c1 ZINC000441457394 947531633 /nfs/dbraw/zinc/53/16/33/947531633.db2.gz NKCFIZIWPFTRIU-AWEZNQCLSA-N 0 0 370.405 3.913 20 5 FHBDRN O=C(NCc1ccc(Cl)cn1)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000445132056 947543246 /nfs/dbraw/zinc/54/32/46/947543246.db2.gz GGAAJDHUTLFRMR-UHFFFAOYSA-N 0 0 363.804 3.660 20 5 FHBDRN Cc1cc(C(=O)NCc2nc(-c3cccc(Cl)c3)no2)ccc1[N+](=O)[O-] ZINC000523717473 947547345 /nfs/dbraw/zinc/54/73/45/947547345.db2.gz BUFGFMAGNWFGGZ-UHFFFAOYSA-N 0 0 372.768 3.537 20 5 FHBDRN O=C1[C@@H](N2CCC[C@@H]2c2ccsc2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000067377191 947548812 /nfs/dbraw/zinc/54/88/12/947548812.db2.gz IFKCNGGIWUXQIZ-SJORKVTESA-N 0 0 357.435 3.599 20 5 FHBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N(Cc2ccco2)Cc2ccccc2)cc1 ZINC000016086304 947550402 /nfs/dbraw/zinc/55/04/02/947550402.db2.gz GUYJTMNEIUZZPR-UHFFFAOYSA-N 0 0 372.402 3.579 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NCC(=O)N[C@H](c1ccccc1)C(C)C ZINC000053834577 947556462 /nfs/dbraw/zinc/55/64/62/947556462.db2.gz YKTBBKVQOPVNGL-IBGZPJMESA-N 0 0 357.410 3.529 20 5 FHBDRN C[C@H](CNC(=O)c1cccc2c(=O)c3ccccc3[nH]c12)c1nccs1 ZINC000445161626 947558413 /nfs/dbraw/zinc/55/84/13/947558413.db2.gz QDNBXTMCHWRKHG-GFCCVEGCSA-N 0 0 363.442 3.671 20 5 FHBDRN C[C@H]1C[C@@H]1c1ccc(CNc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])o1 ZINC000523745681 947564893 /nfs/dbraw/zinc/56/48/93/947564893.db2.gz HHWJLCUBTPPASK-NHYWBVRUSA-N 0 0 355.394 3.816 20 5 FHBDRN O=C(NCc1ccc(C(F)F)cc1)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000184545888 947571423 /nfs/dbraw/zinc/57/14/23/947571423.db2.gz QIDALTPRGQFYOP-UHFFFAOYSA-N 0 0 372.331 3.648 20 5 FHBDRN CCn1c(CN2CCc3ccc([N+](=O)[O-])cc3C2)nc2c1cccc2F ZINC000088606761 947571426 /nfs/dbraw/zinc/57/14/26/947571426.db2.gz AHFIJDHGGZVZQP-UHFFFAOYSA-N 0 0 354.385 3.662 20 5 FHBDRN Cc1cc(S(=O)(=O)N(C)Cc2ccc(C(C)C)cc2)ccc1[N+](=O)[O-] ZINC000523756908 947575402 /nfs/dbraw/zinc/57/54/02/947575402.db2.gz NUVYLAGSGJVLLF-UHFFFAOYSA-N 0 0 362.451 3.847 20 5 FHBDRN Cc1cc(S(=O)(=O)N(Cc2ccc(F)cc2)C(C)C)ccc1[N+](=O)[O-] ZINC000523757866 947576700 /nfs/dbraw/zinc/57/67/00/947576700.db2.gz BNTMZGNVDANAMT-UHFFFAOYSA-N 0 0 366.414 3.642 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CCN(c2ccc(F)cc2)CC1 ZINC000127647077 947584014 /nfs/dbraw/zinc/58/40/14/947584014.db2.gz XKVYGLRZGKRAPZ-UHFFFAOYSA-N 0 0 372.400 3.705 20 5 FHBDRN C[C@@H]1C[C@H](c2ccccc2)CN1c1cc2nc[nH]c(=O)c2cc1[N+](=O)[O-] ZINC000523752705 947588050 /nfs/dbraw/zinc/58/80/50/947588050.db2.gz NNZNYTGBBBPXQE-OCCSQVGLSA-N 0 0 350.378 3.626 20 5 FHBDRN COc1cnccc1[C@H](C)NC(=O)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000445217280 947617722 /nfs/dbraw/zinc/61/77/22/947617722.db2.gz GHZBMTSHFVXXJU-ZDUSSCGKSA-N 0 0 373.412 3.576 20 5 FHBDRN Cc1csc(CNC(=O)c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)n1 ZINC000021482159 947627782 /nfs/dbraw/zinc/62/77/82/947627782.db2.gz MBLOCJSSEHKJAZ-UHFFFAOYSA-N 0 0 374.466 3.526 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)c1ncccc1Oc1ccccc1 ZINC000440700129 947630122 /nfs/dbraw/zinc/63/01/22/947630122.db2.gz ZFQLQIYGZXDNFN-UHFFFAOYSA-N 0 0 363.373 3.755 20 5 FHBDRN COC(=O)c1ccc(NC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)cc1 ZINC000445244960 947642287 /nfs/dbraw/zinc/64/22/87/947642287.db2.gz AAYJWOFFHCWZFJ-UHFFFAOYSA-N 0 0 372.380 3.720 20 5 FHBDRN CC[C@H](C)c1ccc(NC(=O)Cc2noc(-c3cc([N+](=O)[O-])c[nH]3)n2)cc1 ZINC000445272358 947651745 /nfs/dbraw/zinc/65/17/45/947651745.db2.gz IXMXIKVTMVCEQH-NSHDSACASA-N 0 0 369.381 3.668 20 5 FHBDRN Cc1ccc(-c2ccncc2)cc1NC(=O)COc1cccc([N+](=O)[O-])c1 ZINC000523857034 947666096 /nfs/dbraw/zinc/66/60/96/947666096.db2.gz DKLJOBUDWJLKKI-UHFFFAOYSA-N 0 0 363.373 3.983 20 5 FHBDRN CCCN(C(=O)COc1ccc(OCC)cc1)c1cccc([N+](=O)[O-])c1 ZINC000441464075 947666190 /nfs/dbraw/zinc/66/61/90/947666190.db2.gz HVYFXMLZBIQDFO-UHFFFAOYSA-N 0 0 358.394 3.816 20 5 FHBDRN C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CC[C@@H](C(F)(F)F)C(C)(C)C1 ZINC000248792401 947673046 /nfs/dbraw/zinc/67/30/46/947673046.db2.gz NZWIVKWZLAYMAS-SMDDNHRTSA-N 0 0 373.375 3.832 20 5 FHBDRN COc1cccc(N2C[C@@H](C(F)(F)F)[C@H](C(F)(F)F)C2)c1[N+](=O)[O-] ZINC000613884226 947701271 /nfs/dbraw/zinc/70/12/71/947701271.db2.gz SDIMFQVAAFIKEP-HTQZYQBOSA-N 0 0 358.238 3.780 20 5 FHBDRN Cn1cnc([N+](=O)[O-])c1Nc1cccc(C[S@@](=O)Cc2ccccc2)c1 ZINC000523876019 947701704 /nfs/dbraw/zinc/70/17/04/947701704.db2.gz JWENZEVHYCMHNQ-SANMLTNESA-N 0 0 370.434 3.521 20 5 FHBDRN COCC[C@@H](C)NC(=O)c1ccccc1Sc1ccccc1[N+](=O)[O-] ZINC000440718383 947705836 /nfs/dbraw/zinc/70/58/36/947705836.db2.gz RCGLGJPFICSFJY-CYBMUJFWSA-N 0 0 360.435 3.901 20 5 FHBDRN Cc1cccc(C)c1NC(=O)Cc1noc(-c2cc(F)cc([N+](=O)[O-])c2)n1 ZINC000445326249 947714882 /nfs/dbraw/zinc/71/48/82/947714882.db2.gz XXKPFCKDKWCCRU-UHFFFAOYSA-N 0 0 370.340 3.582 20 5 FHBDRN O=[N+]([O-])c1cccc2c(N3CCC[C@@H](c4nnc5ccccn54)C3)ccnc21 ZINC000432305880 947735005 /nfs/dbraw/zinc/73/50/05/947735005.db2.gz FIIVTZSSRUMOMC-CQSZACIVSA-N 0 0 374.404 3.570 20 5 FHBDRN CCOc1ccc(C(=O)O[C@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)cc1 ZINC000759939418 947743159 /nfs/dbraw/zinc/74/31/59/947743159.db2.gz MITSCPRRNZZVBN-HOTGVXAUSA-N 0 0 359.382 3.531 20 5 FHBDRN Cc1ccc(NC(=O)Cc2noc(-c3ccc([N+](=O)[O-])c(C)c3)n2)c(C)c1 ZINC000445350814 947747695 /nfs/dbraw/zinc/74/76/95/947747695.db2.gz IQWMRQFPBQHBDH-UHFFFAOYSA-N 0 0 366.377 3.751 20 5 FHBDRN CC(=O)CCc1ccc(O[C@@H](C)C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000021557358 947748743 /nfs/dbraw/zinc/74/87/43/947748743.db2.gz UXOXURDFOYJYEF-HNNXBMFYSA-N 0 0 370.405 3.831 20 5 FHBDRN COc1ccc(OC(=O)c2csc(-c3ccc(C)n3C)n2)c([N+](=O)[O-])c1 ZINC000136757721 947770276 /nfs/dbraw/zinc/77/02/76/947770276.db2.gz YQHPTKHEOJWIFQ-UHFFFAOYSA-N 0 0 373.390 3.593 20 5 FHBDRN C[C@@H](C[C@@H](O)c1cccs1)Nc1ncc(Br)cc1[N+](=O)[O-] ZINC000128981138 947791022 /nfs/dbraw/zinc/79/10/22/947791022.db2.gz KFKJKESRAFZKDX-GZMMTYOYSA-N 0 0 372.244 3.738 20 5 FHBDRN CC1(C)CO[C@H](CCC(=O)N2CCS[C@H]2c2ccc([N+](=O)[O-])cc2)C1 ZINC001126235057 947800851 /nfs/dbraw/zinc/80/08/51/947800851.db2.gz UPIVSQKBYOIRTL-WBVHZDCISA-N 0 0 364.467 3.764 20 5 FHBDRN C/C(=C\C(=O)O[C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)c1ccccc1 ZINC000759942303 947805958 /nfs/dbraw/zinc/80/59/58/947805958.db2.gz QVKKORSUXNUUSU-LHMZYYNSSA-N 0 0 355.394 3.922 20 5 FHBDRN O=C(Nc1ncc(Cl)s1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000126801094 947821150 /nfs/dbraw/zinc/82/11/50/947821150.db2.gz YKIAZPNQHJFJDJ-UHFFFAOYSA-N 0 0 362.592 3.720 20 5 FHBDRN CC(=O)c1ccc([N+](=O)[O-])cc1N1C[C@]2(C[C@@H]3CC[C@H]2C3)OC(C)(C)C1 ZINC000518824270 947821820 /nfs/dbraw/zinc/82/18/20/947821820.db2.gz QCGPWBMFLWWXEP-SIFCLUCFSA-N 0 0 358.438 3.971 20 5 FHBDRN O=C(O[C@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)c1ccc(Cl)s1 ZINC000759943430 947836068 /nfs/dbraw/zinc/83/60/68/947836068.db2.gz DWMAKKNSJUCLID-UWVGGRQHSA-N 0 0 355.803 3.847 20 5 FHBDRN O=C(NC1(c2cccc(Cl)c2)CC1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000150821770 947851205 /nfs/dbraw/zinc/85/12/05/947851205.db2.gz GNUIATGQRWGPJU-UHFFFAOYSA-N 0 0 361.741 3.576 20 5 FHBDRN CCN(C[C@H](O)C(F)(F)F)C(=O)c1cc2ccccc2c2cccnc12 ZINC000189769191 947856015 /nfs/dbraw/zinc/85/60/15/947856015.db2.gz GILGQMAMLJXVEI-INIZCTEOSA-N 0 0 362.351 3.773 20 5 FHBDRN O=C(c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)N1CCCC2(CCCC2)C1 ZINC000438560399 947866913 /nfs/dbraw/zinc/86/69/13/947866913.db2.gz FUOAAXQPYIKJHE-UHFFFAOYSA-N 0 0 354.410 3.577 20 5 FHBDRN O=C(NCc1cccc([N+](=O)[O-])c1)c1cnc(-c2ccccc2Cl)nc1 ZINC001126249262 947867969 /nfs/dbraw/zinc/86/79/69/947867969.db2.gz IFWFSVQZUICKFW-UHFFFAOYSA-N 0 0 368.780 3.635 20 5 FHBDRN Cc1c(C(=O)N[C@@H](C)c2nc(C(F)(F)F)cs2)cccc1[N+](=O)[O-] ZINC000278867430 947870488 /nfs/dbraw/zinc/87/04/88/947870488.db2.gz YJTOKGFKABHMIA-QMMMGPOBSA-N 0 0 359.329 3.870 20 5 FHBDRN Cc1cc(-c2noc([C@H](C)Oc3ccc([N+](=O)[O-])c(CO)c3)n2)ccc1F ZINC000432311407 947872492 /nfs/dbraw/zinc/87/24/92/947872492.db2.gz DCICLUDZSVFODY-NSHDSACASA-N 0 0 373.340 3.725 20 5 FHBDRN CCCN(C(=O)[C@H]1COc2ccc(OC)cc2C1)c1cccc([N+](=O)[O-])c1 ZINC000441479865 947891756 /nfs/dbraw/zinc/89/17/56/947891756.db2.gz WTBCSZASHIFFMA-OAHLLOKOSA-N 0 0 370.405 3.598 20 5 FHBDRN Cc1ccc([C@H](Cn2ccnc2)NC(=O)c2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000441480283 947897857 /nfs/dbraw/zinc/89/78/57/947897857.db2.gz XWONVFIRKLYCSZ-IBGZPJMESA-N 0 0 364.405 3.579 20 5 FHBDRN C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CC[C@H](CC(F)(F)F)C1 ZINC000278870498 947899303 /nfs/dbraw/zinc/89/93/03/947899303.db2.gz SOFUDTVCHFJJDT-GHMZBOCLSA-N 0 0 370.331 3.980 20 5 FHBDRN CC(C)N(C1CCC1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000163376879 947938191 /nfs/dbraw/zinc/93/81/91/947938191.db2.gz UYDBPZJGBZZDPH-UHFFFAOYSA-N 0 0 366.361 3.565 20 5 FHBDRN CCn1nccc1C1CCN(C(=O)Nc2cc([N+](=O)[O-])ccc2C)CC1 ZINC000278877547 947950599 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FHBDRN CC(F)(F)C1(C(=O)OCc2ccc([N+](=O)[O-])cc2Br)CC1 ZINC001126278287 947993209 /nfs/dbraw/zinc/99/32/09/947993209.db2.gz XTEHHDFQJNOCDP-UHFFFAOYSA-N 0 0 364.142 3.836 20 5 FHBDRN O=[N+]([O-])c1cccc2c(NC[C@@H](CO)Cc3ccc(F)cc3)ccnc21 ZINC000432319700 948001744 /nfs/dbraw/zinc/00/17/44/948001744.db2.gz HUURLAMSQBUNBD-AWEZNQCLSA-N 0 0 355.369 3.545 20 5 FHBDRN Cc1ccc(C(=O)N(C)C)cc1NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000129551221 948007432 /nfs/dbraw/zinc/00/74/32/948007432.db2.gz DRSKQCWQFWDMLY-UHFFFAOYSA-N 0 0 361.785 3.511 20 5 FHBDRN CC(C)[C@H]1C[C@@H](CNC(=O)NC(C)(C)c2ccccc2[N+](=O)[O-])CCO1 ZINC000459063890 948010665 /nfs/dbraw/zinc/01/06/65/948010665.db2.gz NDTQLRQLBJCGNR-WMLDXEAASA-N 0 0 363.458 3.580 20 5 FHBDRN CCOc1c(Cl)cc(CNc2c([N+](=O)[O-])c(CC)nn2C)cc1OC ZINC000094139925 948010748 /nfs/dbraw/zinc/01/07/48/948010748.db2.gz FVQRRBUMOMCHDA-UHFFFAOYSA-N 0 0 368.821 3.564 20 5 FHBDRN CCc1nn(C)c(NCc2ccc(OC)cc2C(F)(F)F)c1[N+](=O)[O-] ZINC000094153769 948016015 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O=C(CCCc1ccccc1)O[C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1 ZINC000759945505 948072712 /nfs/dbraw/zinc/07/27/12/948072712.db2.gz HCLMYNKRXXFIKS-DLBZAZTESA-N 0 0 357.410 3.841 20 5 FHBDRN CC(C)c1ccccc1NC(=O)[C@H](C)Oc1ccc([N+](=O)[O-])c(CO)c1 ZINC000432325985 948073947 /nfs/dbraw/zinc/07/39/47/948073947.db2.gz NYAGVFGGYYIUNP-ZDUSSCGKSA-N 0 0 358.394 3.617 20 5 FHBDRN O=C(CCCn1cccn1)N(Cc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000075352069 948076715 /nfs/dbraw/zinc/07/67/15/948076715.db2.gz AGDZHSTYPKWAKI-UHFFFAOYSA-N 0 0 364.405 3.805 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N[C@@H](c2ccccc2)C2CC2)cc1OC ZINC000025879865 948079232 /nfs/dbraw/zinc/07/92/32/948079232.db2.gz OEJIHHQLSJVFAK-IBGZPJMESA-N 0 0 370.405 3.883 20 5 FHBDRN O=[N+]([O-])c1cccc2c(N3CCO[C@H](c4ccc(F)c(F)c4)C3)ccnc21 ZINC000432328223 948082314 /nfs/dbraw/zinc/08/23/14/948082314.db2.gz VXKUJQWZYICWTR-SFHVURJKSA-N 0 0 371.343 3.999 20 5 FHBDRN O=C(CCc1c(Cl)cccc1[N+](=O)[O-])N[C@H]1C[C@@H]1Cc1ccccc1 ZINC001126288665 948105435 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CC(C)c1ccccc1N(C)C(=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000574674468 948136701 /nfs/dbraw/zinc/13/67/01/948136701.db2.gz NPXJEWCGCAGUAJ-UHFFFAOYSA-N 0 0 369.421 3.501 20 5 FHBDRN COc1cc(-c2nc([C@@H]3C[C@H]3c3ccccc3)no2)cc([N+](=O)[O-])c1OC ZINC000511997783 948140716 /nfs/dbraw/zinc/14/07/16/948140716.db2.gz CUXFUNYNBJNUTD-UONOGXRCSA-N 0 0 367.361 3.933 20 5 FHBDRN COc1cccc([C@H]2CN(c3ccnc4c3cccc4[N+](=O)[O-])CCO2)c1 ZINC000432339542 948155510 /nfs/dbraw/zinc/15/55/10/948155510.db2.gz SPOPCQXCHGSXLE-LJQANCHMSA-N 0 0 365.389 3.730 20 5 FHBDRN CCCCNC(=O)[C@H]1CC[C@H](C)N(c2ccnc3c2cccc3[N+](=O)[O-])C1 ZINC000432340769 948158957 /nfs/dbraw/zinc/15/89/57/948158957.db2.gz PDJHZWHDHYTPRR-GJZGRUSLSA-N 0 0 370.453 3.664 20 5 FHBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N[C@H](C)c1ccccn1 ZINC000585695677 948160028 /nfs/dbraw/zinc/16/00/28/948160028.db2.gz SSSUMKDQYBIJBT-SNVBAGLBSA-N 0 0 364.199 3.552 20 5 FHBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1C[C@H](C)C[C@@H](C)C1 ZINC000585695597 948161092 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FHBDRN O=C(O[C@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)c1cc2ccsc2[nH]1 ZINC000759948888 948212644 /nfs/dbraw/zinc/21/26/44/948212644.db2.gz ZRGJGSURIBKRAK-STQMWFEESA-N 0 0 360.395 3.675 20 5 FHBDRN Cc1cn(-c2cccc([N+](=O)[O-])c2)c(=O)n1Cc1csc(C(C)(C)C)n1 ZINC000585707538 948222689 /nfs/dbraw/zinc/22/26/89/948222689.db2.gz LXTKPOJSTKZNMJ-UHFFFAOYSA-N 0 0 372.450 3.658 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)NC[C@@H]1CCC[C@H](C)[C@H]1C ZINC001211697623 948233979 /nfs/dbraw/zinc/23/39/79/948233979.db2.gz VVGQIJUWPGMWDD-GLQYFDAESA-N 0 0 354.472 3.562 20 5 FHBDRN CN(C(C)(C)c1ccccc1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000585740223 948246460 /nfs/dbraw/zinc/24/64/60/948246460.db2.gz GNLWNTUKFCCBIX-UHFFFAOYSA-N 0 0 368.842 3.804 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)c2ccccc2OC(C)C)c1 ZINC000147090706 948250580 /nfs/dbraw/zinc/25/05/80/948250580.db2.gz JXVUULZKEXVBFE-CYBMUJFWSA-N 0 0 358.394 3.882 20 5 FHBDRN Cc1ccc(OCC(=O)O[C@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)c(C)c1 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FHBDRN O=[N+]([O-])c1cccc(F)c1OC[C@H](O)COc1cccc2ccccc21 ZINC000184776105 948427549 /nfs/dbraw/zinc/42/75/49/948427549.db2.gz LJMBINXQHVBDRY-CQSZACIVSA-N 0 0 357.337 3.706 20 5 FHBDRN Cc1nc(-c2ccc(NC(=O)c3cc(C)cc([N+](=O)[O-])c3N)cc2)co1 ZINC000729518855 948432208 /nfs/dbraw/zinc/43/22/08/948432208.db2.gz VPKQOTHQKOWFOJ-UHFFFAOYSA-N 0 0 352.350 3.701 20 5 FHBDRN CCCOc1cc(NC(=O)C2CCOCC2)c([N+](=O)[O-])cc1OCCC ZINC000279047150 948433079 /nfs/dbraw/zinc/43/30/79/948433079.db2.gz ASQOMOPNSKEGKK-UHFFFAOYSA-N 0 0 366.414 3.538 20 5 FHBDRN CC(C)Oc1cc(O)ccc1NC(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000432447847 948443334 /nfs/dbraw/zinc/44/33/34/948443334.db2.gz GOEGVEIHSMPVGJ-UHFFFAOYSA-N 0 0 359.382 3.528 20 5 FHBDRN O=C(N[C@H]1C[C@H](c2ccc(F)cc2)C1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000432448623 948445347 /nfs/dbraw/zinc/44/53/47/948445347.db2.gz PFVOFYPHBAKRRC-RZDIXWSQSA-N 0 0 369.396 3.748 20 5 FHBDRN O=[N+]([O-])c1cc2c(c(-c3nc(-c4ccc(Cl)cc4)no3)c1)OCCO2 ZINC000585818199 948451915 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COc1ccc(C(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cc1F ZINC000452881068 567885439 /nfs/dbraw/zinc/88/54/39/567885439.db2.gz OONDKHSCPXMTJH-OAHLLOKOSA-N 0 0 358.369 3.762 20 5 FHBDRN CCc1nc(-c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)n[nH]1 ZINC000161309505 567903288 /nfs/dbraw/zinc/90/32/88/567903288.db2.gz RGWUDFQLEFXHFU-UHFFFAOYSA-N 0 0 371.784 3.848 20 5 FHBDRN CCn1nc(C(C)C)cc1C(=O)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452897053 567904590 /nfs/dbraw/zinc/90/45/90/567904590.db2.gz ZMXLRGBWKSENJB-INIZCTEOSA-N 0 0 370.453 3.954 20 5 FHBDRN CCOc1ccc(CC(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000452894438 567904754 /nfs/dbraw/zinc/90/47/54/567904754.db2.gz XXUQWCUOYWPUKC-GOSISDBHSA-N 0 0 368.433 3.942 20 5 FHBDRN COc1cnccc1-c1noc(-c2cc([N+](=O)[O-])ccc2C(F)(F)F)n1 ZINC000568131474 567911540 /nfs/dbraw/zinc/91/15/40/567911540.db2.gz CGRHBQQYISJWNG-UHFFFAOYSA-N 0 0 366.255 3.734 20 5 FHBDRN CC(C)CC(=O)N1CCC(Nc2ccc3cc([N+](=O)[O-])ccc3n2)CC1 ZINC000264966567 567916811 /nfs/dbraw/zinc/91/68/11/567916811.db2.gz YCXRAJIBWLJXKA-UHFFFAOYSA-N 0 0 356.426 3.592 20 5 FHBDRN CCOCc1nc([C@@H](C)NCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)no1 ZINC000290982840 567918962 /nfs/dbraw/zinc/91/89/62/567918962.db2.gz UHCZRRMVAZASIL-GFCCVEGCSA-N 0 0 372.381 3.625 20 5 FHBDRN Cc1c(CNC(=O)c2cccc([C@@H]3CCCOC3)c2)cccc1[N+](=O)[O-] ZINC000481472505 567965602 /nfs/dbraw/zinc/96/56/02/567965602.db2.gz KQFGBTFCGBEDDB-GOSISDBHSA-N 0 0 354.406 3.727 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1)N1CCN(Cc2ccccc2Cl)CC1 ZINC000481463567 567967766 /nfs/dbraw/zinc/96/77/66/567967766.db2.gz HIIFJNPTGWGRGI-UHFFFAOYSA-N 0 0 374.828 3.598 20 5 FHBDRN CC(C)(CCc1noc(Cc2cccc(OCC(F)(F)F)c2)n1)[N+](=O)[O-] ZINC000291032123 567970076 /nfs/dbraw/zinc/97/00/76/567970076.db2.gz FHFARGROKGBEOK-UHFFFAOYSA-N 0 0 373.331 3.589 20 5 FHBDRN Cc1c(CNC(=O)c2ccc(N3CCCCC3)cc2)cccc1[N+](=O)[O-] ZINC000481466450 567970194 /nfs/dbraw/zinc/97/01/94/567970194.db2.gz PUAKSGJFSDKPLQ-UHFFFAOYSA-N 0 0 353.422 3.824 20 5 FHBDRN Cc1c(CNC(=O)c2cc3c(C(C)C)nn(C)c3s2)cccc1[N+](=O)[O-] ZINC000481480421 567972381 /nfs/dbraw/zinc/97/23/81/567972381.db2.gz SDPAWWOSXSMBDC-UHFFFAOYSA-N 0 0 372.450 3.905 20 5 FHBDRN CC(C)(C)[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F)C(F)(F)F ZINC000541846551 567975329 /nfs/dbraw/zinc/97/53/29/567975329.db2.gz NQMDKWPZZAXSDA-LLVKDONJSA-N 0 0 370.274 3.903 20 5 FHBDRN C[C@H](Sc1ccc(N)cc1Cl)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000502109110 567989154 /nfs/dbraw/zinc/98/91/54/567989154.db2.gz JGKHDVSCPMCTLS-VIFPVBQESA-N 0 0 351.815 3.950 20 5 FHBDRN Cc1c(CNC(=O)CCCOc2ccc(F)cc2F)cccc1[N+](=O)[O-] ZINC000481494300 567997035 /nfs/dbraw/zinc/99/70/35/567997035.db2.gz QMXDOMFONSGPGD-UHFFFAOYSA-N 0 0 364.348 3.657 20 5 FHBDRN Cc1c(CNC(=O)Cc2ccc(OC(F)(F)F)cc2)cccc1[N+](=O)[O-] ZINC000481494049 567997997 /nfs/dbraw/zinc/99/79/97/567997997.db2.gz QLVHIBUHMCFQAC-UHFFFAOYSA-N 0 0 368.311 3.661 20 5 FHBDRN COc1cc(C(=O)Nc2ccc(C(=O)C(C)C)cc2)c([N+](=O)[O-])cc1OC ZINC000452939990 568005518 /nfs/dbraw/zinc/00/55/18/568005518.db2.gz PGMPQUFALPNKTL-UHFFFAOYSA-N 0 0 372.377 3.703 20 5 FHBDRN CCCOc1cc(OC)ccc1C(=O)NCc1cccc([N+](=O)[O-])c1C ZINC000481501243 568007524 /nfs/dbraw/zinc/00/75/24/568007524.db2.gz IHVRFAKACQIBLR-UHFFFAOYSA-N 0 0 358.394 3.631 20 5 FHBDRN COc1ccc(-c2nc(CCC(C)(C)[N+](=O)[O-])no2)cc1-c1ccccn1 ZINC000291074877 568011421 /nfs/dbraw/zinc/01/14/21/568011421.db2.gz MJOAFPWFHRYTBS-UHFFFAOYSA-N 0 0 368.393 3.795 20 5 FHBDRN COCCOCc1ccc(-c2nc(-c3ccc([N+](=O)[O-])s3)no2)cc1 ZINC000291079024 568011500 /nfs/dbraw/zinc/01/15/00/568011500.db2.gz NEGUICZTCDDPTA-UHFFFAOYSA-N 0 0 361.379 3.536 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N[C@@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000159213540 568012984 /nfs/dbraw/zinc/01/29/84/568012984.db2.gz ZJJYSIQWRKYQLU-PXNSSMCTSA-N 0 0 368.433 3.812 20 5 FHBDRN CC(C)(CCc1noc(-c2cnc(OCC3CC3)c(Cl)c2)n1)[N+](=O)[O-] ZINC000291085617 568018171 /nfs/dbraw/zinc/01/81/71/568018171.db2.gz OHKXBARFQDMBNJ-UHFFFAOYSA-N 0 0 366.805 3.562 20 5 FHBDRN C[C@H](C(=O)N1c2ccccc2N(C)CC[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000568348068 568024143 /nfs/dbraw/zinc/02/41/43/568024143.db2.gz PXMWLLWYEUEWFI-GJZGRUSLSA-N 0 0 353.422 3.960 20 5 FHBDRN Cc1c(Cc2noc([C@@H]3CCC(=O)[C@H](C)C3(C)C)n2)cccc1[N+](=O)[O-] ZINC000568325940 568024777 /nfs/dbraw/zinc/02/47/77/568024777.db2.gz CQDLKYRJFUKAGN-JSGCOSHPSA-N 0 0 357.410 3.986 20 5 FHBDRN C[C@@H]1CCC[C@@H](N(C)C(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000568341542 568026417 /nfs/dbraw/zinc/02/64/17/568026417.db2.gz SEBOIMODGBALPH-UKRRQHHQSA-N 0 0 358.442 3.839 20 5 FHBDRN Cc1cccnc1C(C)(C)CNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-] ZINC000568340553 568026438 /nfs/dbraw/zinc/02/64/38/568026438.db2.gz QDUPVLSZSZREQF-UHFFFAOYSA-N 0 0 368.437 3.580 20 5 FHBDRN O=C(Nc1ccccc1N1CCCC1=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000128566372 568031755 /nfs/dbraw/zinc/03/17/55/568031755.db2.gz VNYRMSNURMMGTF-UHFFFAOYSA-N 0 0 359.769 3.627 20 5 FHBDRN CCn1c(C)nc([N+](=O)[O-])c1N[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1 ZINC000568436509 568037959 /nfs/dbraw/zinc/03/79/59/568037959.db2.gz PJRPUUYCBWVHJR-LLVKDONJSA-N 0 0 367.812 3.603 20 5 FHBDRN CC(C)[C@@H]1CN(C(=O)c2c([N+](=O)[O-])cccc2C(F)(F)F)CCCO1 ZINC000568437195 568038124 /nfs/dbraw/zinc/03/81/24/568038124.db2.gz TTXIOMBWQIHNSQ-ZDUSSCGKSA-N 0 0 360.332 3.501 20 5 FHBDRN O=C(c1cc(-c2ccc(F)cc2)on1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000128581090 568043680 /nfs/dbraw/zinc/04/36/80/568043680.db2.gz FGXKPVFXFQKIOV-UHFFFAOYSA-N 0 0 353.309 3.592 20 5 FHBDRN C[C@H](NC(=O)c1cnc2c(F)ccc(F)c2c1)c1cccc([N+](=O)[O-])c1 ZINC000568537384 568048532 /nfs/dbraw/zinc/04/85/32/568048532.db2.gz PNYMUSUMMMGSBZ-JTQLQIEISA-N 0 0 357.316 3.912 20 5 FHBDRN CCCn1ncc(NC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)c1C1CC1 ZINC000452957710 568051866 /nfs/dbraw/zinc/05/18/66/568051866.db2.gz BKFXPDSDRPFASG-UHFFFAOYSA-N 0 0 362.817 3.913 20 5 FHBDRN CN(CC(C)(C)CO)C(=O)c1ccccc1Sc1ccccc1[N+](=O)[O-] ZINC000452952348 568054144 /nfs/dbraw/zinc/05/41/44/568054144.db2.gz YVLUWSBRAKNOCJ-UHFFFAOYSA-N 0 0 374.462 3.837 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@@H]1c1cccn1C ZINC000072905993 568057121 /nfs/dbraw/zinc/05/71/21/568057121.db2.gz VNXJJEKAJSIGPP-CXAGYDPISA-N 0 0 359.451 3.778 20 5 FHBDRN O=C(CCn1cc([N+](=O)[O-])cn1)Nc1ccccc1Nc1ccccc1 ZINC000128590920 568060808 /nfs/dbraw/zinc/06/08/08/568060808.db2.gz NEPUVPHXXJFQGC-UHFFFAOYSA-N 0 0 351.366 3.564 20 5 FHBDRN O=[N+]([O-])c1cccc(CN2CCO[C@H](c3ccc(F)cc3Cl)C2)c1 ZINC000481607181 568064978 /nfs/dbraw/zinc/06/49/78/568064978.db2.gz CEUPMJDYGKLWRZ-KRWDZBQOSA-N 0 0 350.777 3.961 20 5 FHBDRN O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)N[C@H]1C[C@H](c2ccc(F)cc2)C1 ZINC000481612108 568064984 /nfs/dbraw/zinc/06/49/84/568064984.db2.gz MHBSPFWVKJSAQF-AULYBMBSSA-N 0 0 364.323 3.617 20 5 FHBDRN Cc1ccc2c(c1)CN(S(=O)(=O)c1cc(Cl)c(C)c([N+](=O)[O-])c1)C2 ZINC000481603796 568065007 /nfs/dbraw/zinc/06/50/07/568065007.db2.gz WNXPXKSUKWXZIQ-UHFFFAOYSA-N 0 0 366.826 3.570 20 5 FHBDRN CCN(CCOC)C(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000481629224 568070535 /nfs/dbraw/zinc/07/05/35/568070535.db2.gz TXPORQUYUCCCSS-UHFFFAOYSA-N 0 0 360.435 3.855 20 5 FHBDRN O=C(NC[C@H]1CCC2(CCCCC2)O1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000481637799 568074955 /nfs/dbraw/zinc/07/49/55/568074955.db2.gz ZFSTUGZREUWEEN-CYBMUJFWSA-N 0 0 352.818 3.860 20 5 FHBDRN CN(Cc1cccs1)C(=O)COc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000067650183 568080138 /nfs/dbraw/zinc/08/01/38/568080138.db2.gz ZZBQDSVZZFLHGX-UHFFFAOYSA-N 0 0 374.340 3.713 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1cn(C)nc1-c1cccs1 ZINC000128619313 568083134 /nfs/dbraw/zinc/08/31/34/568083134.db2.gz NERKRIWRMRQMFR-UHFFFAOYSA-N 0 0 356.407 3.926 20 5 FHBDRN CN(CCOc1ccccc1F)C(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000128618461 568083209 /nfs/dbraw/zinc/08/32/09/568083209.db2.gz NLPTVGYVHBJQKG-UHFFFAOYSA-N 0 0 352.749 3.538 20 5 FHBDRN O=C(NCc1cc2c([nH]c1=O)CCC2)c1cc2ccccc2c2cccnc12 ZINC000603357238 568090293 /nfs/dbraw/zinc/09/02/93/568090293.db2.gz WUVDFAYQISRFMT-UHFFFAOYSA-N 0 0 369.424 3.907 20 5 FHBDRN Cc1c(CC(=O)N2CCC[C@H]2C[C@@H](O)c2cccs2)cccc1[N+](=O)[O-] ZINC000128639497 568096993 /nfs/dbraw/zinc/09/69/93/568096993.db2.gz PZQDOIPWUKYQMI-DOTOQJQBSA-N 0 0 374.462 3.622 20 5 FHBDRN O=C(NCCCSc1ccc(F)cc1)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000481737104 568099639 /nfs/dbraw/zinc/09/96/39/568099639.db2.gz CJTIUWNSPDPXQY-UHFFFAOYSA-N 0 0 374.397 3.522 20 5 FHBDRN CCOc1ccc(C2=CCN(c3c([N+](=O)[O-])nc(C)n3CC)CC2)cc1 ZINC000568673753 568118431 /nfs/dbraw/zinc/11/84/31/568118431.db2.gz WHCGXEDYLGVMLJ-UHFFFAOYSA-N 0 0 356.426 3.812 20 5 FHBDRN Cc1cc(NC(=O)C[C@H](C)c2ccncc2)n(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000159301604 568123646 /nfs/dbraw/zinc/12/36/46/568123646.db2.gz OJPCORSYTWYUQF-ZDUSSCGKSA-N 0 0 365.393 3.616 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)N[C@@H](c1ccccc1)C(F)F ZINC000481874130 568140789 /nfs/dbraw/zinc/14/07/89/568140789.db2.gz SFTAXVVJRFONJX-KRWDZBQOSA-N 0 0 363.364 3.910 20 5 FHBDRN CC(C)Oc1ccccc1[C@@H](C)NC(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000057004745 568141429 /nfs/dbraw/zinc/14/14/29/568141429.db2.gz FCZBGTJTZBBRNN-CQSZACIVSA-N 0 0 357.410 3.942 20 5 FHBDRN Cn1nc([N+](=O)[O-])cc1C(=O)Nc1c(F)cccc1Oc1ccccc1 ZINC000481865271 568144331 /nfs/dbraw/zinc/14/43/31/568144331.db2.gz IODLYHAGJKJFEM-UHFFFAOYSA-N 0 0 356.313 3.512 20 5 FHBDRN Cn1nc([N+](=O)[O-])cc1C(=O)N[C@@H](c1ccc(Cl)cc1)C1CCCC1 ZINC000481883900 568145576 /nfs/dbraw/zinc/14/55/76/568145576.db2.gz SYKSGVYQHBBAKO-MRXNPFEDSA-N 0 0 362.817 3.643 20 5 FHBDRN Cc1nn(C)c(C(=O)N(C)[C@H](C)c2ccc(Cl)cc2Cl)c1[N+](=O)[O-] ZINC000128678657 568153528 /nfs/dbraw/zinc/15/35/28/568153528.db2.gz DJYKOOBMEQQJOW-SECBINFHSA-N 0 0 371.224 3.777 20 5 FHBDRN Cc1noc(C)c1[C@H](C)CNC(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000159347892 568157869 /nfs/dbraw/zinc/15/78/69/568157869.db2.gz SQQOUWLRXQYWDS-NEPJUHHUSA-N 0 0 360.414 3.672 20 5 FHBDRN CCc1c(NC(=O)c2ccc([N+](=O)[O-])c3cccnc23)cnn1CC(C)C ZINC000159343217 568161072 /nfs/dbraw/zinc/16/10/72/568161072.db2.gz CHTJLFDJTSSDRY-UHFFFAOYSA-N 0 0 367.409 3.810 20 5 FHBDRN Cc1ccccc1CCNC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000481924479 568186603 /nfs/dbraw/zinc/18/66/03/568186603.db2.gz PTJKNVFSHKTHKP-UHFFFAOYSA-N 0 0 361.829 3.641 20 5 FHBDRN CCC1CCC(N(C2CC2)S(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000604031512 568201560 /nfs/dbraw/zinc/20/15/60/568201560.db2.gz GOBZUSPLUYFCRI-UHFFFAOYSA-N 0 0 352.456 3.717 20 5 FHBDRN CCOc1cn(-c2ccccc2)nc1C(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000481972928 568202906 /nfs/dbraw/zinc/20/29/06/568202906.db2.gz ITXWAYFUXCYFDV-UHFFFAOYSA-N 0 0 366.377 3.740 20 5 FHBDRN C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)CSc1ccccc1[N+](=O)[O-] ZINC000481982759 568213518 /nfs/dbraw/zinc/21/35/18/568213518.db2.gz HAPDZEWZUGHTBM-GHMZBOCLSA-N 0 0 362.373 3.876 20 5 FHBDRN CCN(CCNC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccccc1C ZINC000604131170 568215453 /nfs/dbraw/zinc/21/54/53/568215453.db2.gz YTAWFKBVTRIYSY-INIZCTEOSA-N 0 0 370.453 3.790 20 5 FHBDRN O=C(N[C@H]1CCCOc2c(F)cccc21)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000481991267 568215960 /nfs/dbraw/zinc/21/59/60/568215960.db2.gz REJJLURUMICNLV-AWEZNQCLSA-N 0 0 369.352 3.859 20 5 FHBDRN CC(C)CO[C@H](C)c1noc(COc2ccc([N+](=O)[O-])cc2Cl)n1 ZINC000072919337 568217577 /nfs/dbraw/zinc/21/75/77/568217577.db2.gz OAUXLESWCLECSG-SNVBAGLBSA-N 0 0 355.778 3.944 20 5 FHBDRN COc1cc(C(=O)N[C@H](C)C2CCCC2)c([N+](=O)[O-])cc1OC(F)F ZINC000265035760 568223980 /nfs/dbraw/zinc/22/39/80/568223980.db2.gz CFNJBOKKBWYWPB-SECBINFHSA-N 0 0 358.341 3.513 20 5 FHBDRN COc1ccc2c(c1NC(=O)CSc1ccccc1[N+](=O)[O-])CCC2 ZINC000482012498 568226945 /nfs/dbraw/zinc/22/69/45/568226945.db2.gz DHWCSJFTBINSSC-UHFFFAOYSA-N 0 0 358.419 3.823 20 5 FHBDRN C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1c[nH]c2cc([N+](=O)[O-])ccc21 ZINC000482021625 568228630 /nfs/dbraw/zinc/22/86/30/568228630.db2.gz NOMVZCIQPJSQST-NOZJJQNGSA-N 0 0 355.316 3.879 20 5 FHBDRN CCN(C(=O)Cc1ccc([N+](=O)[O-])cc1Cl)[C@H]1CCOC(C)(C)C1 ZINC000291622429 568230572 /nfs/dbraw/zinc/23/05/72/568230572.db2.gz NHFUYMWJTLHFJZ-AWEZNQCLSA-N 0 0 354.834 3.597 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCCSc2ccccc21 ZINC000007274496 568230936 /nfs/dbraw/zinc/23/09/36/568230936.db2.gz KPUYOLJUBJFPEB-UHFFFAOYSA-N 0 0 373.434 3.544 20 5 FHBDRN C[C@H](C(=O)N1CC[C@H](c2c(F)cccc2F)C1)c1cccc([N+](=O)[O-])c1 ZINC000568818766 568231063 /nfs/dbraw/zinc/23/10/63/568231063.db2.gz OYYMFIMLCMSKTB-JSGCOSHPSA-N 0 0 360.360 3.993 20 5 FHBDRN CC(C)[C@H]1C[C@@H](NC(=O)c2cc(Cl)cc(Cl)c2[N+](=O)[O-])CCO1 ZINC000291650833 568241826 /nfs/dbraw/zinc/24/18/26/568241826.db2.gz GXQBBVUGDJQFSI-GXFFZTMASA-N 0 0 361.225 3.835 20 5 FHBDRN COc1ccc2c(c1)C[C@@H](C)N(C(=O)Cc1cccc([N+](=O)[O-])c1C)[C@@H]2C ZINC000541933596 568246135 /nfs/dbraw/zinc/24/61/35/568246135.db2.gz SMHUCMNMSANEBF-UKRRQHHQSA-N 0 0 368.433 3.989 20 5 FHBDRN CC[C@@]1(CO)CCCN(C(=O)c2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000291669670 568252518 /nfs/dbraw/zinc/25/25/18/568252518.db2.gz LTHJFEXGLIHJHZ-OAHLLOKOSA-N 0 0 361.225 3.526 20 5 FHBDRN O=C(c1ccc(OC(F)F)c([N+](=O)[O-])c1)N1CCCc2c(F)cccc21 ZINC000541932601 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20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1[O-])N1CCc2cc(Cl)cc(Cl)c2C1 ZINC000436679016 568275857 /nfs/dbraw/zinc/27/58/57/568275857.db2.gz ITYNYISENQIXQY-UHFFFAOYSA-N 0 0 367.188 3.806 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CCOC3(CCCC3)C2)c1 ZINC000159411287 568277528 /nfs/dbraw/zinc/27/75/28/568277528.db2.gz URPXSEUXNRSYGW-GFCCVEGCSA-N 0 0 350.440 3.538 20 5 FHBDRN Cc1ccc(-c2cccc(CNc3nccc(C(N)=O)c3[N+](=O)[O-])c2)cc1 ZINC000569058999 568294762 /nfs/dbraw/zinc/29/47/62/568294762.db2.gz ZBVHTXFOQFTJTC-UHFFFAOYSA-N 0 0 362.389 3.676 20 5 FHBDRN CCS(=O)(=O)c1ccc2oc(/C=C/c3cccc([N+](=O)[O-])c3)nc2c1 ZINC000008321074 568300743 /nfs/dbraw/zinc/30/07/43/568300743.db2.gz PODVRBKYPMSQFX-RMKNXTFCSA-N 0 0 358.375 3.700 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)[C@H]2CCN(c3ccccc3F)C2)cc1[N+](=O)[O-] ZINC000569160817 568300854 /nfs/dbraw/zinc/30/08/54/568300854.db2.gz ZQOAXMMBKHKFGC-ZBFHGGJFSA-N 0 0 371.412 3.746 20 5 FHBDRN C[C@@H](C(=O)Nc1ccnn1CCc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000569182215 568304967 /nfs/dbraw/zinc/30/49/67/568304967.db2.gz LMMPKZIHNCMXAG-OAHLLOKOSA-N 0 0 364.405 3.776 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)NC[C@H]2CCCC[C@@H]2C(F)(F)F)c1 ZINC000482210697 568312773 /nfs/dbraw/zinc/31/27/73/568312773.db2.gz NHXXMSDGFZFIKV-MFKMUULPSA-N 0 0 360.332 3.702 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N1CCC=C(c2ccncc2)C1 ZINC000482211004 568312779 /nfs/dbraw/zinc/31/27/79/568312779.db2.gz NDPMCAOZQASFNH-UHFFFAOYSA-N 0 0 352.394 3.928 20 5 FHBDRN C[C@H](O)C(C)(C)NC(=O)c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1 ZINC000541993079 568313404 /nfs/dbraw/zinc/31/34/04/568313404.db2.gz CUZZJUGOMZSCSX-LBPRGKRZSA-N 0 0 360.435 3.635 20 5 FHBDRN COc1cc(C(=O)NCCc2c[nH]c3cc(Cl)ccc23)ccc1[N+](=O)[O-] ZINC000604573545 568315273 /nfs/dbraw/zinc/31/52/73/568315273.db2.gz UBXWNHFSCJZJHC-UHFFFAOYSA-N 0 0 373.796 3.711 20 5 FHBDRN Nc1ccc2c(c1)CC[C@@H]2NC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000569236812 568317236 /nfs/dbraw/zinc/31/72/36/568317236.db2.gz DBZTWYFKZUZOHW-IBGZPJMESA-N 0 0 366.421 3.539 20 5 FHBDRN CO[C@@H]1CCN(C(=O)c2ccc(SCCC(C)C)c([N+](=O)[O-])c2)C1 ZINC000482214195 568317326 /nfs/dbraw/zinc/31/73/26/568317326.db2.gz UGBSJUCDHOHAMD-CQSZACIVSA-N 0 0 352.456 3.594 20 5 FHBDRN COc1ccc(NC(=O)c2cnn(-c3ccccc3Cl)c2)cc1[N+](=O)[O-] ZINC000541992240 568320207 /nfs/dbraw/zinc/32/02/07/568320207.db2.gz VLSRTCVCBNINTR-UHFFFAOYSA-N 0 0 372.768 3.695 20 5 FHBDRN O=C(c1cc(F)ccc1[N+](=O)[O-])N1CC=C(c2ccc(Cl)nc2)CC1 ZINC000367763637 568329706 /nfs/dbraw/zinc/32/97/06/568329706.db2.gz OQDAQXMDTZBVEQ-UHFFFAOYSA-N 0 0 361.760 3.712 20 5 FHBDRN C[C@]1(c2ccc(F)cc2)CCN(C(=O)NCc2cccc([N+](=O)[O-])c2)C1 ZINC000584695696 568347327 /nfs/dbraw/zinc/34/73/27/568347327.db2.gz DKTWVZZCLIIWOJ-IBGZPJMESA-N 0 0 357.385 3.607 20 5 FHBDRN CCOc1ccccc1NC(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-] ZINC000482223295 568353098 /nfs/dbraw/zinc/35/30/98/568353098.db2.gz SMFHJQUWEQAHLH-UHFFFAOYSA-N 0 0 362.407 3.976 20 5 FHBDRN Cc1cc(N2CCC3(C2)CCOCC3)c(Br)cc1[N+](=O)[O-] ZINC000408296602 568362775 /nfs/dbraw/zinc/36/27/75/568362775.db2.gz FEBXTPVOPALXMS-UHFFFAOYSA-N 0 0 355.232 3.673 20 5 FHBDRN Cc1nc2ccccc2c(SCC(=O)Nc2ccc([N+](=O)[O-])cc2C)n1 ZINC000004221281 568370277 /nfs/dbraw/zinc/37/02/77/568370277.db2.gz MJABBINLMYWUBX-UHFFFAOYSA-N 0 0 368.418 3.886 20 5 FHBDRN CCSc1nnc(NC(=O)c2ccc(SC)c([N+](=O)[O-])c2)s1 ZINC000005443109 568385276 /nfs/dbraw/zinc/38/52/76/568385276.db2.gz XIMIYQUBXVROSS-UHFFFAOYSA-N 0 0 356.454 3.533 20 5 FHBDRN COc1ccc(OCCOc2ccc(Br)cc2)c([N+](=O)[O-])c1 ZINC000005453794 568385674 /nfs/dbraw/zinc/38/56/74/568385674.db2.gz UBNNMAXEAXSAPA-UHFFFAOYSA-N 0 0 368.183 3.824 20 5 FHBDRN CCOC(=O)c1cc(C(=O)Nc2ccccc2OC(C)C)cc([N+](=O)[O-])c1 ZINC000032285435 568385717 /nfs/dbraw/zinc/38/57/17/568385717.db2.gz SVCQBNFELAQMNR-UHFFFAOYSA-N 0 0 372.377 3.811 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)NC[C@@]2(C)CCCc3ccccc32)c1 ZINC000182010553 568389067 /nfs/dbraw/zinc/38/90/67/568389067.db2.gz FPXLMKNRWZBHDS-HXUWFJFHSA-N 0 0 354.406 3.627 20 5 FHBDRN Cc1sc(C(=O)NCc2ccc(OCC(F)(F)F)cc2)cc1[N+](=O)[O-] ZINC000032613118 568397842 /nfs/dbraw/zinc/39/78/42/568397842.db2.gz ZYTGYVBFDYHMNS-UHFFFAOYSA-N 0 0 374.340 3.836 20 5 FHBDRN O=C([O-])c1cccc(OCC[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000569502262 568403842 /nfs/dbraw/zinc/40/38/42/568403842.db2.gz JGIDSAFJXUIQOT-QGZVFWFLSA-N 0 0 370.405 3.551 20 5 FHBDRN C[C@@H](CCc1ccco1)NC(=O)c1c([N+](=O)[O-])cccc1C(F)(F)F ZINC000569649356 568407141 /nfs/dbraw/zinc/40/71/41/568407141.db2.gz LIEGMNIZLLTHHB-JTQLQIEISA-N 0 0 356.300 3.958 20 5 FHBDRN CC1CCN(c2ccc(C(=O)N(C)Cc3ccco3)cc2[N+](=O)[O-])CC1 ZINC000006910266 568410470 /nfs/dbraw/zinc/41/04/70/568410470.db2.gz LXOCYLRMGVFLNB-UHFFFAOYSA-N 0 0 357.410 3.696 20 5 FHBDRN C[C@@H]1CN(c2cc(F)cc(NCc3cccc([N+](=O)[O-])c3)c2)C[C@H](C)O1 ZINC000569734174 568414826 /nfs/dbraw/zinc/41/48/26/568414826.db2.gz ZRYIRYFKOURLMO-OKILXGFUSA-N 0 0 359.401 3.960 20 5 FHBDRN Cn1ncc([N+](=O)[O-])c1C(=O)N[C@H](c1c(Cl)cccc1Cl)C1CC1 ZINC000569655687 568416257 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C[C@H](NC(=O)C1(CC(=O)OC(C)(C)C)CCC1)c1cccc([N+](=O)[O-])c1 ZINC000569929319 568437831 /nfs/dbraw/zinc/43/78/31/568437831.db2.gz OIPQVJCKFQAXAW-ZDUSSCGKSA-N 0 0 362.426 3.674 20 5 FHBDRN C[C@@H](NC(=O)C1(CC(=O)OC(C)(C)C)CCC1)c1cccc([N+](=O)[O-])c1 ZINC000569929318 568437866 /nfs/dbraw/zinc/43/78/66/568437866.db2.gz OIPQVJCKFQAXAW-CYBMUJFWSA-N 0 0 362.426 3.674 20 5 FHBDRN COc1ccc([C@H](C)NC(=O)CSc2ccc([N+](=O)[O-])cc2)cc1F ZINC000007074465 568441911 /nfs/dbraw/zinc/44/19/11/568441911.db2.gz FTGCWSVQVYUNBZ-NSHDSACASA-N 0 0 364.398 3.712 20 5 FHBDRN C[C@@H](NC(=O)NCCC1Cc2ccccc2C1)c1cccc([N+](=O)[O-])c1 ZINC000569945434 568444031 /nfs/dbraw/zinc/44/40/31/568444031.db2.gz OTAMRJGTNAKNOO-CQSZACIVSA-N 0 0 353.422 3.760 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)CCCc1ccc(F)c(F)c1 ZINC000569949935 568444125 /nfs/dbraw/zinc/44/41/25/568444125.db2.gz CFQPOFCHSRKEQX-UHFFFAOYSA-N 0 0 362.376 3.897 20 5 FHBDRN C[C@@H](N[C@@H]1CCc2c1cccc2[N+](=O)[O-])c1noc(-c2ccccc2)n1 ZINC000570105916 568451327 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20 5 FHBDRN CCS[C@H]1CCC[C@@H](NC(=O)CCNc2ccccc2[N+](=O)[O-])C1 ZINC000482233751 568487262 /nfs/dbraw/zinc/48/72/62/568487262.db2.gz ZAJCGGZYXPZQPP-KGLIPLIRSA-N 0 0 351.472 3.577 20 5 FHBDRN COc1cc(C(=O)N[C@H]2CCC(C)(C)C[C@H]2C)cc([N+](=O)[O-])c1OC ZINC000482233953 568487487 /nfs/dbraw/zinc/48/74/87/568487487.db2.gz IPKDEQYQCKMGQQ-YPMHNXCESA-N 0 0 350.415 3.557 20 5 FHBDRN CSCCCCCNC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000482235054 568487708 /nfs/dbraw/zinc/48/77/08/568487708.db2.gz PNWSGKCDWKFEEQ-UHFFFAOYSA-N 0 0 361.261 3.620 20 5 FHBDRN Cc1c(C(=O)N2CC3(CCC3)[C@H]2C2CC2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000291815016 568495502 /nfs/dbraw/zinc/49/55/02/568495502.db2.gz BXVKNMOYGSOTKO-MRXNPFEDSA-N 0 0 359.382 3.525 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)NC[C@@H]2CCCC2(C)C)cc1SC ZINC000570702901 568500564 /nfs/dbraw/zinc/50/05/64/568500564.db2.gz ZELVPWPRYZIKDD-NSHDSACASA-N 0 0 352.456 3.881 20 5 FHBDRN CC[C@@H](CN(CC)C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2)c1ccccc1 ZINC000482250008 568528413 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COC(=O)c1ccc(C)c(NC(=O)CCCNc2ccc([N+](=O)[O-])cc2)c1 ZINC000020916153 568709436 /nfs/dbraw/zinc/70/94/36/568709436.db2.gz PMYZGDVLEONLJQ-UHFFFAOYSA-N 0 0 371.393 3.521 20 5 FHBDRN COc1cc(NCc2ccn(Cc3ccccc3)n2)c([N+](=O)[O-])cc1F ZINC000570931904 568726973 /nfs/dbraw/zinc/72/69/73/568726973.db2.gz AOJFJDCOZAVFAO-UHFFFAOYSA-N 0 0 356.357 3.599 20 5 FHBDRN O=[N+]([O-])c1ccc(Sc2ccc(-c3nn[nH]n3)cc2F)c(Cl)c1 ZINC000823645102 599058795 /nfs/dbraw/zinc/05/87/95/599058795.db2.gz NVTVNKRXLVVMLV-UHFFFAOYSA-N 0 0 351.750 3.719 20 5 FHBDRN Cc1cc(C(C)(C)C)ccc1Oc1ncc([N+](=O)[O-])cc1-c1nn[nH]n1 ZINC000822191588 599137194 /nfs/dbraw/zinc/13/71/94/599137194.db2.gz KZLKPBRYYCEGKD-UHFFFAOYSA-N 0 0 354.370 3.568 20 5 FHBDRN CC(C)c1ccc(CSc2ncc([N+](=O)[O-])cc2-c2nn[nH]n2)cc1 ZINC000735928214 598499877 /nfs/dbraw/zinc/49/98/77/598499877.db2.gz ITWUREAPYKZSCL-UHFFFAOYSA-N 0 0 356.411 3.586 20 5 FHBDRN O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1NCC1(Sc2ccccc2)CC1 ZINC000738357644 598594302 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FHBDRN C[C@@H]1CCCN(c2ccc(C(=O)N(C)c3cccnc3)cc2[N+](=O)[O-])C1 ZINC000511230516 937093924 /nfs/dbraw/zinc/09/39/24/937093924.db2.gz NAHDUFPGDIQRIS-CQSZACIVSA-N 0 0 354.410 3.503 20 5 FHBDRN Cc1cc(C)c(CNC(=O)N2CCOc3ccc([N+](=O)[O-])cc3C2)c(C)c1 ZINC000583077134 937101747 /nfs/dbraw/zinc/10/17/47/937101747.db2.gz BWOKVRCGJLZGNF-UHFFFAOYSA-N 0 0 369.421 3.624 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@H]1CCO[C@@H](c2ccccc2)C1 ZINC000162476527 937127854 /nfs/dbraw/zinc/12/78/54/937127854.db2.gz BDPKKJMELMTUFH-MAUKXSAKSA-N 0 0 355.394 3.945 20 5 FHBDRN Cc1ccccc1C(=O)NC1CCN(c2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000052106094 937129627 /nfs/dbraw/zinc/12/96/27/937129627.db2.gz GJYTVWVLTYOVLO-UHFFFAOYSA-N 0 0 373.840 3.955 20 5 FHBDRN O=[N+]([O-])c1cc(S(=O)(=O)Nc2cc(Cl)ccc2Cl)cs1 ZINC000120079105 927080589 /nfs/dbraw/zinc/08/05/89/927080589.db2.gz LZQUSOVDVHPKAZ-UHFFFAOYSA-N 0 0 353.208 3.764 20 5 FHBDRN C[C@@H](c1ccccc1)S(=O)(=O)N(C)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000583113164 937132181 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COc1cc(C(=O)N(C)[C@@H](C)Cc2ccc(C)cc2)cc([N+](=O)[O-])c1OC ZINC000610175620 927213231 /nfs/dbraw/zinc/21/32/31/927213231.db2.gz OWWRIRQWJHOTTC-AWEZNQCLSA-N 0 0 372.421 3.624 20 5 FHBDRN COc1cc(C(=O)N[C@H](c2ccccc2C)C2CC2)cc([N+](=O)[O-])c1OC ZINC000610175208 927229526 /nfs/dbraw/zinc/22/95/26/927229526.db2.gz KOOIEHWKGOXEFM-SFHVURJKSA-N 0 0 370.405 3.802 20 5 FHBDRN Cc1cc(CNCc2ccc(C(C)C)c([N+](=O)[O-])c2)nc(N2CCCC2)n1 ZINC000430143332 927235644 /nfs/dbraw/zinc/23/56/44/927235644.db2.gz XHBVZYHYDVBEDP-UHFFFAOYSA-N 0 0 369.469 3.707 20 5 FHBDRN CC[C@@H](NC(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])c1ccncc1 ZINC000610176873 927237554 /nfs/dbraw/zinc/23/75/54/927237554.db2.gz MOZJJMQUNYEQMX-SMDDNHRTSA-N 0 0 363.801 3.678 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)Nc1nc2ccc(F)cc2n1CC ZINC000471109228 927243222 /nfs/dbraw/zinc/24/32/22/927243222.db2.gz WCVHNTAVAJCQDK-UHFFFAOYSA-N 0 0 372.356 3.755 20 5 FHBDRN COc1ccc2c(c1)CCC[C@H]2CC(=O)Nc1ccc([N+](=O)[O-])c(C)n1 ZINC000133648252 927281346 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Cc1ccc(C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)c(C)n1 ZINC000126841832 927397744 /nfs/dbraw/zinc/39/77/44/927397744.db2.gz DTDSFIAMRDTAGL-UHFFFAOYSA-N 0 0 354.391 3.982 20 5 FHBDRN O=C(OCc1ccc(Cl)nc1)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000023382102 927414120 /nfs/dbraw/zinc/41/41/20/927414120.db2.gz YQFNGGRWMVSLPD-UHFFFAOYSA-N 0 0 361.785 3.600 20 5 FHBDRN CSc1cccc(C(=O)N[C@@H](C)[C@H]2COc3ccccc32)c1[N+](=O)[O-] ZINC000186890825 927468678 /nfs/dbraw/zinc/46/86/78/927468678.db2.gz LACVIWXMXGSMJT-SMDDNHRTSA-N 0 0 358.419 3.611 20 5 FHBDRN CC(C)Oc1cccc(CN(C)C(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])c1 ZINC000535941155 937166992 /nfs/dbraw/zinc/16/69/92/937166992.db2.gz YFUINORKVQAGIX-UHFFFAOYSA-N 0 0 360.414 3.501 20 5 FHBDRN C[C@@]1(c2ccccc2)CCCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2N)CC1 ZINC000583146485 937167855 /nfs/dbraw/zinc/16/78/55/937167855.db2.gz AAJWIXVHMVFZDK-HXUWFJFHSA-N 0 0 371.412 3.900 20 5 FHBDRN CCOc1ccc(NC(=O)CN2C[C@H](C)c3ccccc32)c([N+](=O)[O-])c1 ZINC000510055337 927496158 /nfs/dbraw/zinc/49/61/58/927496158.db2.gz NFQLPHUCWHBRKO-ZDUSSCGKSA-N 0 0 355.394 3.556 20 5 FHBDRN CCOc1ccc(NC(=O)CN2C[C@@H](C)c3ccccc32)c([N+](=O)[O-])c1 ZINC000510055335 927496185 /nfs/dbraw/zinc/49/61/85/927496185.db2.gz NFQLPHUCWHBRKO-CYBMUJFWSA-N 0 0 355.394 3.556 20 5 FHBDRN CC[C@H](C)CN(C)c1nnc(-c2ccc([N+](=O)[O-])cc2)n1C[C@@H]1CCCO1 ZINC000577758099 927498825 /nfs/dbraw/zinc/49/88/25/927498825.db2.gz RHFIERSNDNFKKE-YOEHRIQHSA-N 0 0 373.457 3.515 20 5 FHBDRN COCCC[C@@H](Cc1ccccc1)NC(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000471117663 927507123 /nfs/dbraw/zinc/50/71/23/927507123.db2.gz WMFFGAZPIQDBSN-INIZCTEOSA-N 0 0 357.410 3.754 20 5 FHBDRN CCCc1c(NC(=O)c2ccc([N+](=O)[O-])[nH]2)cnn1-c1ccccc1C ZINC000430171107 927512902 /nfs/dbraw/zinc/51/29/02/927512902.db2.gz SBEVVHABFVWDHT-UHFFFAOYSA-N 0 0 353.382 3.622 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)cnc1N1CCC[C@@H]1C[C@H](O)c1cccs1 ZINC000153916777 927513571 /nfs/dbraw/zinc/51/35/71/927513571.db2.gz RPBUKGANMJXZKH-YPMHNXCESA-N 0 0 353.831 3.797 20 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3.579 20 5 FHBDRN CC[C@H](NC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1ccncc1 ZINC000175306019 927818690 /nfs/dbraw/zinc/81/86/90/927818690.db2.gz SUGKYURZJQJXOG-LBPRGKRZSA-N 0 0 366.324 3.864 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCc1ccc(OCC2CC2)nc1 ZINC000120252586 927891761 /nfs/dbraw/zinc/89/17/61/927891761.db2.gz BFEAPCUXBZVOHE-UHFFFAOYSA-N 0 0 370.409 3.717 20 5 FHBDRN COCc1cccc(CC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1 ZINC000187075935 927895565 /nfs/dbraw/zinc/89/55/65/927895565.db2.gz GWIASPPXLALKMJ-UHFFFAOYSA-N 0 0 356.422 3.721 20 5 FHBDRN CSc1cccc(C(=O)NC[C@H](C)c2nc(C)cs2)c1[N+](=O)[O-] ZINC000187068813 927896423 /nfs/dbraw/zinc/89/64/23/927896423.db2.gz IZGKFGJYBGMEBF-VIFPVBQESA-N 0 0 351.453 3.615 20 5 FHBDRN CSc1cccc(C(=O)Nc2ccnn2-c2cccc(F)c2)c1[N+](=O)[O-] ZINC000187093608 927907003 /nfs/dbraw/zinc/90/70/03/927907003.db2.gz HIWFHLRXZXMQSP-UHFFFAOYSA-N 0 0 372.381 3.894 20 5 FHBDRN Cc1coc2ccc(NS(=O)(=O)CCc3ccccc3[N+](=O)[O-])cc12 ZINC000187077634 927912699 /nfs/dbraw/zinc/91/26/99/927912699.db2.gz KACQZNYIOWOXJH-UHFFFAOYSA-N 0 0 360.391 3.634 20 5 FHBDRN CSc1cccc(C(=O)N[C@@H]2CCCO[C@@H]2CC(C)C)c1[N+](=O)[O-] ZINC000187109738 927919996 /nfs/dbraw/zinc/91/99/96/927919996.db2.gz WVVAMQROTWXHKY-ZIAGYGMSSA-N 0 0 352.456 3.640 20 5 FHBDRN Cc1nc([C@H]2CCCN2C(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)cs1 ZINC000187111173 927921380 /nfs/dbraw/zinc/92/13/80/927921380.db2.gz FHOQDPYFQAYDLJ-MGPLVRAMSA-N 0 0 363.414 3.966 20 5 FHBDRN CCN(C(=O)c1cc(OC)ccc1[N+](=O)[O-])c1nc2ccccc2s1 ZINC000145866076 927976977 /nfs/dbraw/zinc/97/69/77/927976977.db2.gz ZLCIHLPLBAIZQW-UHFFFAOYSA-N 0 0 357.391 3.880 20 5 FHBDRN O=[N+]([O-])c1ccc(Cc2noc([C@H]3CCSc4ccccc43)n2)nc1 ZINC000583175962 937211828 /nfs/dbraw/zinc/21/18/28/937211828.db2.gz ABHVTTOLLLZRIH-AWEZNQCLSA-N 0 0 354.391 3.591 20 5 FHBDRN Cc1ncc(C(=O)OCCSc2ccc([N+](=O)[O-])cc2)c(C(C)C)n1 ZINC000784935559 928019359 /nfs/dbraw/zinc/01/93/59/928019359.db2.gz LCIXTFHDAYYRDP-UHFFFAOYSA-N 0 0 361.423 3.766 20 5 FHBDRN O=C(OCCSc1ccc([N+](=O)[O-])cc1)c1scnc1C1CC1 ZINC000784933881 928019900 /nfs/dbraw/zinc/01/99/00/928019900.db2.gz DNHCSGKOHGMQPD-UHFFFAOYSA-N 0 0 350.421 3.878 20 5 FHBDRN CCC[C@@H]1C[C@H](C(=O)OCCSc2ccc([N+](=O)[O-])cc2)CCO1 ZINC000784935156 928020590 /nfs/dbraw/zinc/02/05/90/928020590.db2.gz ICWFTAXMGJCFEJ-UKRRQHHQSA-N 0 0 353.440 3.825 20 5 FHBDRN CC(=O)c1ccc(C(=O)OCCSc2ccc([N+](=O)[O-])cc2)s1 ZINC000784935020 928021796 /nfs/dbraw/zinc/02/17/96/928021796.db2.gz JUUAMRGCFXNIBX-UHFFFAOYSA-N 0 0 351.405 3.808 20 5 FHBDRN CNc1ccc(C(=O)NCC[C@H](C)c2ccc(OC)cc2)cc1[N+](=O)[O-] ZINC000610203292 928028057 /nfs/dbraw/zinc/02/80/57/928028057.db2.gz IQNDKPICUSNIKU-ZDUSSCGKSA-N 0 0 357.410 3.569 20 5 FHBDRN CN1CCc2ccc(NC(=O)C(C)(C)c3ccc([N+](=O)[O-])cc3F)cc21 ZINC000545119421 937216854 /nfs/dbraw/zinc/21/68/54/937216854.db2.gz IREOLNYQQJTXQU-UHFFFAOYSA-N 0 0 357.385 3.643 20 5 FHBDRN O=C(CCC1CCCCC1)N1CCN(c2sccc2[N+](=O)[O-])CC1 ZINC000302008116 928095466 /nfs/dbraw/zinc/09/54/66/928095466.db2.gz WXAXNMCLTVOFCU-UHFFFAOYSA-N 0 0 351.472 3.665 20 5 FHBDRN CCCc1ncc(C(=O)OCCSc2ccc([N+](=O)[O-])cc2)s1 ZINC000784936778 928103879 /nfs/dbraw/zinc/10/38/79/928103879.db2.gz KMWZXUPWNHUSNP-UHFFFAOYSA-N 0 0 352.437 3.953 20 5 FHBDRN C/C(=C/C(=O)NCc1ccccc1[N+](=O)[O-])c1ccccc1OC(F)F ZINC000254913008 928151772 /nfs/dbraw/zinc/15/17/72/928151772.db2.gz VNCMYYOYYNNCLR-BENRWUELSA-N 0 0 362.332 3.916 20 5 FHBDRN O=[N+]([O-])c1ccc(NCc2cc(F)cc3c2OCOC3)c2ncccc12 ZINC000608831721 928177137 /nfs/dbraw/zinc/17/71/37/928177137.db2.gz JOAIJJZWWIPBDF-UHFFFAOYSA-N 0 0 355.325 3.761 20 5 FHBDRN C[C@@H](NC(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])c1cccc(O)c1 ZINC000430216543 928211300 /nfs/dbraw/zinc/21/13/00/928211300.db2.gz FITUBOIFFHHFAF-MNOVXSKESA-N 0 0 364.785 3.599 20 5 FHBDRN COC1(C)CCN(C(=O)c2cccc3c(=O)c4ccccc4[nH]c23)CC1 ZINC000278126750 937229098 /nfs/dbraw/zinc/22/90/98/937229098.db2.gz UBMGLRKSBHNYGG-UHFFFAOYSA-N 0 0 350.418 3.735 20 5 FHBDRN C[C@@H](COc1ccc(F)cc1)NC(=O)C(C)(C)c1ccccc1[N+](=O)[O-] ZINC001125295354 928243330 /nfs/dbraw/zinc/24/33/30/928243330.db2.gz DJXIGVWPLBVAQQ-ZDUSSCGKSA-N 0 0 360.385 3.595 20 5 FHBDRN COc1ccc(NC(=O)[C@H](C)Sc2ccccc2F)c([N+](=O)[O-])c1 ZINC000014929682 928248022 /nfs/dbraw/zinc/24/80/22/928248022.db2.gz XYVZVYTWJALRCR-JTQLQIEISA-N 0 0 350.371 3.862 20 5 FHBDRN CC(C)C[C@H](C)N(C)C(=O)COc1ccc(Br)cc1[N+](=O)[O-] ZINC000610219639 928267631 /nfs/dbraw/zinc/26/76/31/928267631.db2.gz YBKJLCTVFYDOTG-NSHDSACASA-N 0 0 373.247 3.629 20 5 FHBDRN COc1cc(C)c(CN(C)C(=O)c2cc(C)ccc2[N+](=O)[O-])cc1OC ZINC000610221354 928288624 /nfs/dbraw/zinc/28/86/24/928288624.db2.gz GOJLHQOKBGGAQL-UHFFFAOYSA-N 0 0 358.394 3.501 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1CN1CCO[C@@H](c2ccccc2Cl)C1 ZINC000430224754 928309232 /nfs/dbraw/zinc/30/92/32/928309232.db2.gz LGPKNFUWZDUSSQ-GOSISDBHSA-N 0 0 362.813 3.830 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)NCC2(c3ccccc3C)CCOCC2)c1 ZINC000610226291 928343352 /nfs/dbraw/zinc/34/33/52/928343352.db2.gz VAHYWQATVKSUDA-UHFFFAOYSA-N 0 0 368.433 3.690 20 5 FHBDRN O=C(OCCSc1ccc([N+](=O)[O-])cc1)c1ccc(C(F)(F)F)nc1 ZINC000784940042 928353034 /nfs/dbraw/zinc/35/30/34/928353034.db2.gz WDDWFKJAZGFDJY-UHFFFAOYSA-N 0 0 372.324 3.958 20 5 FHBDRN COc1ccccc1[C@H]1CCCCN1C(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000610227782 928355296 /nfs/dbraw/zinc/35/52/96/928355296.db2.gz LKLYICVHISTQTH-GOSISDBHSA-N 0 0 354.406 3.900 20 5 FHBDRN COc1cc(CN(Cc2cccc([N+](=O)[O-])c2)C2CC2)cc(OC)c1OC ZINC000126978438 928361739 /nfs/dbraw/zinc/36/17/39/928361739.db2.gz PNBVGHIWGVHNOV-UHFFFAOYSA-N 0 0 372.421 3.785 20 5 FHBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1nc(C2CC2)cs1 ZINC000120432572 928379661 /nfs/dbraw/zinc/37/96/61/928379661.db2.gz ZTJWMIILZHCCCW-MRVPVSSYSA-N 0 0 367.814 3.988 20 5 FHBDRN NC(=O)c1cc(NC(=O)c2cc3ccccc3c3cccnc23)ccc1F ZINC000049677115 928384563 /nfs/dbraw/zinc/38/45/63/928384563.db2.gz RXXLJAUAGQQTKN-UHFFFAOYSA-N 0 0 359.360 3.878 20 5 FHBDRN CN(Cc1cccc(OC(F)(F)F)c1)C(=O)Cc1ccccc1[N+](=O)[O-] ZINC000127040353 928422746 /nfs/dbraw/zinc/42/27/46/928422746.db2.gz CQPCJKKLVMSAAV-UHFFFAOYSA-N 0 0 368.311 3.695 20 5 FHBDRN Cc1cc(F)c([N+](=O)[O-])cc1C(=O)N[C@@H](C[C@H]1CCOC1)c1ccccc1 ZINC001266296149 928436778 /nfs/dbraw/zinc/43/67/78/928436778.db2.gz IKOIYBILYGVVQI-KDOFPFPSSA-N 0 0 372.396 3.940 20 5 FHBDRN C[C@H](Sc1ncccc1[N+](=O)[O-])C(=O)N1CCSc2ccccc21 ZINC000120460687 928454497 /nfs/dbraw/zinc/45/44/97/928454497.db2.gz JLBBCYHJQHBAAV-NSHDSACASA-N 0 0 361.448 3.609 20 5 FHBDRN CC1(C)C[C@H](NC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)CCO1 ZINC000278140615 937248745 /nfs/dbraw/zinc/24/87/45/937248745.db2.gz VUEPADQDUIVCFF-CYBMUJFWSA-N 0 0 350.418 3.781 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])s1)N1CCCCC[C@@H]1C[C@H](O)c1ccco1 ZINC000127066327 928507165 /nfs/dbraw/zinc/50/71/65/928507165.db2.gz DAKXWNPLDPQDHV-OLZOCXBDSA-N 0 0 364.423 3.758 20 5 FHBDRN O=C(Nc1ccc([C@H]2CCOC2)cc1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000583223355 937254406 /nfs/dbraw/zinc/25/44/06/937254406.db2.gz BDSLPQAGTRNUFT-HNNXBMFYSA-N 0 0 367.405 3.925 20 5 FHBDRN CCn1c(C)nc([N+](=O)[O-])c1N1CCC[C@@H]1c1nc2ccccc2n1CC ZINC000583224066 937255405 /nfs/dbraw/zinc/25/54/05/937255405.db2.gz LAUHZEFIWPOIKL-MRXNPFEDSA-N 0 0 368.441 3.831 20 5 FHBDRN C[C@H]1CN(Cc2c(F)cc([N+](=O)[O-])cc2F)C[C@@H](c2ccsc2)O1 ZINC000509360353 928561638 /nfs/dbraw/zinc/56/16/38/928561638.db2.gz VWPXCPOQBQCKEL-QFYYESIMSA-N 0 0 354.378 3.897 20 5 FHBDRN O=C(N[C@H](c1ccccc1)c1ccccn1)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000161607303 937265378 /nfs/dbraw/zinc/26/53/78/937265378.db2.gz FHVKNIIQVYQJDC-HXUWFJFHSA-N 0 0 372.384 3.991 20 5 FHBDRN O=[N+]([O-])c1c(Cl)c2ccccc2nc1N1CCO[C@@H](C(F)(F)F)C1 ZINC001167083108 928717551 /nfs/dbraw/zinc/71/75/51/928717551.db2.gz YKYONAHYWXRLQM-SNVBAGLBSA-N 0 0 361.707 3.564 20 5 FHBDRN CCOC[C@@H]1CCCCN1C(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000458445357 937273311 /nfs/dbraw/zinc/27/33/11/937273311.db2.gz YPVZAHHXLOFDFA-SFHVURJKSA-N 0 0 363.458 3.518 20 5 FHBDRN COc1ccc2c(c1)OCC[C@@H]2NC(=O)c1ccc(SC)c([N+](=O)[O-])c1 ZINC000610234245 928788178 /nfs/dbraw/zinc/78/81/78/928788178.db2.gz PFYRCBDFVHMZJT-AWEZNQCLSA-N 0 0 374.418 3.579 20 5 FHBDRN CCN(Cc1ccc(C(=O)N(C)C)cc1)c1ccc(C(C)=O)cc1[N+](=O)[O-] ZINC000154414344 928816643 /nfs/dbraw/zinc/81/66/43/928816643.db2.gz TVZORHCPDDOKED-UHFFFAOYSA-N 0 0 369.421 3.526 20 5 FHBDRN Cc1c(C(=O)Nc2ccc(C)c(Cl)c2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000248164838 937283030 /nfs/dbraw/zinc/28/30/30/937283030.db2.gz QUGWLRNROAUGPY-UHFFFAOYSA-N 0 0 371.784 3.698 20 5 FHBDRN O=C(NC[C@H]1CCCCS1)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000547719330 928895651 /nfs/dbraw/zinc/89/56/51/928895651.db2.gz MYTZWOKJUPDTRU-CQSZACIVSA-N 0 0 352.459 3.697 20 5 FHBDRN Cc1cc(C(=O)Nc2ccc(-n3cccn3)c(Cl)c2)ccc1[N+](=O)[O-] ZINC000608946066 928912868 /nfs/dbraw/zinc/91/28/68/928912868.db2.gz WPCVAUIOGVSILV-UHFFFAOYSA-N 0 0 356.769 3.995 20 5 FHBDRN Cc1c(NC(=O)N[C@@H](C)c2noc(-c3ccccc3)n2)cccc1[N+](=O)[O-] ZINC000134479073 928945899 /nfs/dbraw/zinc/94/58/99/928945899.db2.gz BWASGTHOWKQUFN-LBPRGKRZSA-N 0 0 367.365 3.836 20 5 FHBDRN Cc1ccc([C@@H](NS(=O)(=O)c2c(C)cccc2[N+](=O)[O-])C2CC2)cc1 ZINC000059745945 928964674 /nfs/dbraw/zinc/96/46/74/928964674.db2.gz HOMAMUBPYTWCMS-QGZVFWFLSA-N 0 0 360.435 3.641 20 5 FHBDRN O=C(c1ccc(F)cc1[N+](=O)[O-])N1CCC[C@@H](c2nc3ccccc3o2)C1 ZINC000134527306 928977861 /nfs/dbraw/zinc/97/78/61/928977861.db2.gz HKWDZMYFCHANSQ-GFCCVEGCSA-N 0 0 369.352 3.895 20 5 FHBDRN O=C(OC[C@H]1CCCO1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000021729637 929089756 /nfs/dbraw/zinc/08/97/56/929089756.db2.gz HRCLRLXVNALZPM-MRXNPFEDSA-N 0 0 356.378 3.543 20 5 FHBDRN O=C(Nc1ccc2ncccc2c1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000134593523 929093403 /nfs/dbraw/zinc/09/34/03/929093403.db2.gz XDMNMYBGUKBBAR-UHFFFAOYSA-N 0 0 359.345 3.581 20 5 FHBDRN CN(Cc1ccc(Br)o1)C(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000134596473 929094480 /nfs/dbraw/zinc/09/44/80/929094480.db2.gz UHGUGDSNVFYBRR-UHFFFAOYSA-N 0 0 373.590 3.876 20 5 FHBDRN CN(C[C@@H]1CCCO[C@@H]1c1ccccc1)C(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000610239193 929134953 /nfs/dbraw/zinc/13/49/53/929134953.db2.gz JDFRLAIJXXTGHJ-GHTZIAJQSA-N 0 0 368.433 3.764 20 5 FHBDRN COc1ccc(CC(=O)N[C@H](C)Cc2cc(C)cc(C)c2)cc1[N+](=O)[O-] ZINC000610238515 929172480 /nfs/dbraw/zinc/17/24/80/929172480.db2.gz KSEIMLFBFMOHPS-OAHLLOKOSA-N 0 0 356.422 3.510 20 5 FHBDRN Cc1c2ccccc2n(C)c1CNC(=O)Cc1cccc([N+](=O)[O-])c1C ZINC000471220151 929228544 /nfs/dbraw/zinc/22/85/44/929228544.db2.gz UXHVORJCRJOOSJ-UHFFFAOYSA-N 0 0 351.406 3.562 20 5 FHBDRN C[C@@H](NC(=O)c1ccc(Cl)cc1[N+](=O)[O-])c1cnn(CC2CCC2)c1 ZINC000890678183 929239704 /nfs/dbraw/zinc/23/97/04/929239704.db2.gz WEAQCBLLZITDDN-LLVKDONJSA-N 0 0 362.817 3.736 20 5 FHBDRN CN(CCC1CCOCC1)C(=O)/C=C/c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000154722625 929240349 /nfs/dbraw/zinc/24/03/49/929240349.db2.gz KHSSOSLWUGOZDS-HWKANZROSA-N 0 0 352.818 3.537 20 5 FHBDRN COc1ccc2[nH]cc(CCNc3ccc(C(C)=O)cc3[N+](=O)[O-])c2c1 ZINC000609586406 929245201 /nfs/dbraw/zinc/24/52/01/929245201.db2.gz DHEXIZKESRIDBY-UHFFFAOYSA-N 0 0 353.378 3.942 20 5 FHBDRN CC[C@H]1c2ccccc2CCN1S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-] ZINC000609626026 929267176 /nfs/dbraw/zinc/26/71/76/929267176.db2.gz LXONWPCLDVYPSD-KRWDZBQOSA-N 0 0 374.462 3.910 20 5 FHBDRN Cc1cc(NCc2cccc(NC(=O)[C@@H]3CCCO3)c2)ccc1[N+](=O)[O-] ZINC000060081698 929304006 /nfs/dbraw/zinc/30/40/06/929304006.db2.gz IVVAHXSBRVTKFW-SFHVURJKSA-N 0 0 355.394 3.633 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNc1cccc(-c2nccc(C)n2)c1 ZINC000609671216 929308448 /nfs/dbraw/zinc/30/84/48/929308448.db2.gz OWNLPQYVVDTDNK-UHFFFAOYSA-N 0 0 350.378 3.981 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(N2CCS[C@@H](c3ccccc3)C2)c1 ZINC000611762116 937322852 /nfs/dbraw/zinc/32/28/52/937322852.db2.gz NBKXMXNTNRXWKL-QGZVFWFLSA-N 0 0 358.419 3.676 20 5 FHBDRN CCOc1ccc(C(=O)NCc2c(C)c3ccccc3n2C)cc1[N+](=O)[O-] ZINC000471235372 929431959 /nfs/dbraw/zinc/43/19/59/929431959.db2.gz SLMMNSCKLFTMNC-UHFFFAOYSA-N 0 0 367.405 3.724 20 5 FHBDRN O=C(Nc1cc(F)cc([N+](=O)[O-])c1)NC1CC(OCc2ccccc2)C1 ZINC000547760635 929439994 /nfs/dbraw/zinc/43/99/94/929439994.db2.gz OAAJOBHKNRFDFH-UHFFFAOYSA-N 0 0 359.357 3.603 20 5 FHBDRN CC1(CCNC(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000471235887 929457869 /nfs/dbraw/zinc/45/78/69/929457869.db2.gz PISUWZAXHLKTAL-UHFFFAOYSA-N 0 0 359.348 3.722 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)NCCc1cccc2cccnc21 ZINC000609783625 929469353 /nfs/dbraw/zinc/46/93/53/929469353.db2.gz VVZNXGAKMWQBCP-UHFFFAOYSA-N 0 0 369.808 3.698 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)Nc1cccc(-n2cccn2)c1 ZINC000609783992 929470542 /nfs/dbraw/zinc/47/05/42/929470542.db2.gz OKGSODQLHORBNX-UHFFFAOYSA-N 0 0 356.769 3.615 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)C1(c2ccnc3ccccc32)CC1 ZINC001125311951 929499543 /nfs/dbraw/zinc/49/95/43/929499543.db2.gz ZWNNETQFPVMOET-UHFFFAOYSA-N 0 0 361.401 3.534 20 5 FHBDRN O=C(Nc1cc(F)cc(Cl)c1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000134887804 929536208 /nfs/dbraw/zinc/53/62/08/929536208.db2.gz VSCROBYHNBBRNN-UHFFFAOYSA-N 0 0 360.732 3.825 20 5 FHBDRN Cc1cnn(Cc2ccccc2F)c1NC(=O)c1ccc([N+](=O)[O-])s1 ZINC000187215436 929588486 /nfs/dbraw/zinc/58/84/86/929588486.db2.gz YAMSEVWXDFJDET-UHFFFAOYSA-N 0 0 360.370 3.601 20 5 FHBDRN Cc1cnn(Cc2ccccc2F)c1NC(=O)c1ccccc1[N+](=O)[O-] ZINC000187219113 929590452 /nfs/dbraw/zinc/59/04/52/929590452.db2.gz ROCKMUDCMQVDPB-UHFFFAOYSA-N 0 0 354.341 3.539 20 5 FHBDRN O=C(NCC1CCOCC1)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12 ZINC000275637233 929664373 /nfs/dbraw/zinc/66/43/73/929664373.db2.gz URWFVJGWEPIQEI-UHFFFAOYSA-N 0 0 372.371 3.528 20 5 FHBDRN Cc1ccc(C)c(N(C(C)C)S(=O)(=O)c2c(F)cccc2[N+](=O)[O-])c1 ZINC000109839754 929668951 /nfs/dbraw/zinc/66/89/51/929668951.db2.gz CYSZQDINBREOFR-UHFFFAOYSA-N 0 0 366.414 3.954 20 5 FHBDRN CNc1ccc(C(=O)N2C[C@H](C)C[C@H]2c2ccccc2F)cc1[N+](=O)[O-] ZINC000610296007 929706831 /nfs/dbraw/zinc/70/68/31/929706831.db2.gz PVVCELRUPIDTQX-PXAZEXFGSA-N 0 0 357.385 3.999 20 5 FHBDRN C[C@H](C[C@H](O)c1ccc(F)cc1)Nc1ncnc2ccc([N+](=O)[O-])cc21 ZINC000782151134 929711803 /nfs/dbraw/zinc/71/18/03/929711803.db2.gz WCUPYYGPQQTCST-DIFFPNOSSA-N 0 0 356.357 3.601 20 5 FHBDRN CCOc1cc(C(=O)N[C@@H]2CCC(C)(C)C[C@H]2C)c([N+](=O)[O-])cc1OC ZINC000177636449 929722643 /nfs/dbraw/zinc/72/26/43/929722643.db2.gz LRICBWQPTKZJNQ-TZMCWYRMSA-N 0 0 364.442 3.947 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2C[C@H]2c2c(F)cccc2Cl)c1 ZINC000121062366 929730238 /nfs/dbraw/zinc/73/02/38/929730238.db2.gz HWCTWBTWJIONAU-YGRLFVJLSA-N 0 0 364.760 3.682 20 5 FHBDRN C[C@H](N[C@@H](C)c1ccc([N+](=O)[O-])cc1)c1noc(Cc2ccccc2)n1 ZINC000165432913 929736427 /nfs/dbraw/zinc/73/64/27/929736427.db2.gz ARVRTBZZZFLXNX-KBPBESRZSA-N 0 0 352.394 3.980 20 5 FHBDRN CC(C)C[C@@H]1OCCC[C@@H]1NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000187307539 929763193 /nfs/dbraw/zinc/76/31/93/929763193.db2.gz UOXGEQQKMMOPJT-HOTGVXAUSA-N 0 0 354.834 3.501 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@H](Cc3ccccc3)[C@H]2C)c1 ZINC000471462454 929763762 /nfs/dbraw/zinc/76/37/62/929763762.db2.gz NFVNUBXZNSRNSK-GDBMZVCRSA-N 0 0 354.406 3.697 20 5 FHBDRN COc1ccc(CCc2nnc(NCc3ccc([N+](=O)[O-])cc3C)o2)cc1 ZINC000185895277 929764796 /nfs/dbraw/zinc/76/47/96/929764796.db2.gz HDGABWKNUQIQIB-UHFFFAOYSA-N 0 0 368.393 3.692 20 5 FHBDRN Cc1ccc(SCCNC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)cc1 ZINC000109869227 929768033 /nfs/dbraw/zinc/76/80/33/929768033.db2.gz CTLKALIIUMLBJZ-UHFFFAOYSA-N 0 0 355.419 3.907 20 5 FHBDRN O=C(c1ccc(NC2CC2)c([N+](=O)[O-])c1)N1CC[C@H]1c1cccc(F)c1 ZINC000610304527 929775351 /nfs/dbraw/zinc/77/53/51/929775351.db2.gz BMKXUKDCQNIDPU-KRWDZBQOSA-N 0 0 355.369 3.895 20 5 FHBDRN CC(C)(C)OC(=O)Cc1cccc(NC(=O)Cc2ccccc2[N+](=O)[O-])c1 ZINC000610305824 929776171 /nfs/dbraw/zinc/77/61/71/929776171.db2.gz AOOJWOLREUVIBR-UHFFFAOYSA-N 0 0 370.405 3.660 20 5 FHBDRN CC(C)(C)OC(=O)Cc1cccc(NC(=O)c2ccc([N+](=O)[O-])cc2F)c1 ZINC000610307023 929777275 /nfs/dbraw/zinc/77/72/75/929777275.db2.gz RFMWXEGSEQPACR-UHFFFAOYSA-N 0 0 374.368 3.870 20 5 FHBDRN O=C(c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)N1CC[C@H]1c1cccc(F)c1 ZINC000610304852 929779163 /nfs/dbraw/zinc/77/91/63/929779163.db2.gz UMKYARASIWFKLR-SFHVURJKSA-N 0 0 366.352 3.507 20 5 FHBDRN O=C(c1ccc(N2CCCC2)c([N+](=O)[O-])c1)N1CC[C@@H]1c1cccc(F)c1 ZINC000610304886 929779405 /nfs/dbraw/zinc/77/94/05/929779405.db2.gz XRAKJKNAIHWYEA-QGZVFWFLSA-N 0 0 369.396 3.921 20 5 FHBDRN O=C(c1ccc(N2CCCC2)c([N+](=O)[O-])c1)N1CC[C@H]1c1cccc(F)c1 ZINC000610304885 929779512 /nfs/dbraw/zinc/77/95/12/929779512.db2.gz XRAKJKNAIHWYEA-KRWDZBQOSA-N 0 0 369.396 3.921 20 5 FHBDRN COc1ccc(C(=O)N[C@@H](C)CSc2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000472285108 937359821 /nfs/dbraw/zinc/35/98/21/937359821.db2.gz WNLLXXRPYWJCNT-ZDUSSCGKSA-N 0 0 360.435 3.822 20 5 FHBDRN Cn1cc(Br)cc1C(=O)Nc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000076741498 929797268 /nfs/dbraw/zinc/79/72/68/929797268.db2.gz HFNVNROQIOFJAZ-UHFFFAOYSA-N 0 0 358.579 3.602 20 5 FHBDRN CC[C@@H](NC(=O)N1CCC[C@@]2(CCSC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000458485376 937360163 /nfs/dbraw/zinc/36/01/63/937360163.db2.gz CAEAZIGXFFYPEX-SJLPKXTDSA-N 0 0 363.483 3.975 20 5 FHBDRN C[C@H](c1ccccc1)[N@@H+]1CC[C@@H](Nc2cc(C(=O)[O-])ccc2[N+](=O)[O-])C1 ZINC000572845320 929798474 /nfs/dbraw/zinc/79/84/74/929798474.db2.gz NAXVIOVERNATAF-CZUORRHYSA-N 0 0 355.394 3.540 20 5 FHBDRN CCN(C(=O)c1cc([N+](=O)[O-])cn1C)[C@@H](Cc1ccc(F)cc1)C(C)C ZINC000610309996 929799265 /nfs/dbraw/zinc/79/92/65/929799265.db2.gz PIVLBXLWUPGQCT-KRWDZBQOSA-N 0 0 361.417 3.802 20 5 FHBDRN CC[C@H](NC(=O)N1CCC[C@]2(CCSC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000458485377 937360326 /nfs/dbraw/zinc/36/03/26/937360326.db2.gz CAEAZIGXFFYPEX-WMZOPIPTSA-N 0 0 363.483 3.975 20 5 FHBDRN Cc1cccc(C)c1OC[C@@H](O)COc1ccc([N+](=O)[O-])c2ncccc12 ZINC000471470618 929831677 /nfs/dbraw/zinc/83/16/77/929831677.db2.gz IWYVUFZXEZFFFV-HNNXBMFYSA-N 0 0 368.389 3.579 20 5 FHBDRN CC(C)Oc1cc(C(=O)N[C@@H]2c3ccccc3O[C@H]2C)ccc1[N+](=O)[O-] ZINC000412363756 929859789 /nfs/dbraw/zinc/85/97/89/929859789.db2.gz RRNLRRRDGPGSIK-SGTLLEGYSA-N 0 0 356.378 3.634 20 5 FHBDRN COc1cc(C(=O)Nc2cn(CC(C)C)nc2C(F)F)ccc1[N+](=O)[O-] ZINC000535639967 929862929 /nfs/dbraw/zinc/86/29/29/929862929.db2.gz IAEZYMAZBAFTDU-UHFFFAOYSA-N 0 0 368.340 3.646 20 5 FHBDRN Cc1ccc([C@H]2C[C@@H](C)CCN2S(=O)(=O)c2ccccc2[N+](=O)[O-])o1 ZINC000610316777 929874927 /nfs/dbraw/zinc/87/49/27/929874927.db2.gz CKJJINCEZWPCHN-SWLSCSKDSA-N 0 0 364.423 3.658 20 5 FHBDRN Cn1c(-c2ccc(Cl)cc2)nnc1N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000583349625 937367684 /nfs/dbraw/zinc/36/76/84/937367684.db2.gz PNVFWLFGUHODEP-UHFFFAOYSA-N 0 0 369.812 3.606 20 5 FHBDRN COc1ccc(NC(=O)C2(c3ccnc4ccccc43)CC2)cc1[N+](=O)[O-] ZINC001266541544 929920063 /nfs/dbraw/zinc/92/00/63/929920063.db2.gz MAVGPEXATIOZNT-UHFFFAOYSA-N 0 0 363.373 3.822 20 5 FHBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccnn1C(C)(C)C ZINC000121107996 929942442 /nfs/dbraw/zinc/94/24/42/929942442.db2.gz JKURZWZOLQWGHS-JTQLQIEISA-N 0 0 366.805 3.606 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3F)n2)s1 ZINC001125402089 929953305 /nfs/dbraw/zinc/95/33/05/929953305.db2.gz SXCSNMQCKYWMCO-LLVKDONJSA-N 0 0 374.397 3.781 20 5 FHBDRN Cc1ccccc1OCCCC(=O)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000560725975 929958639 /nfs/dbraw/zinc/95/86/39/929958639.db2.gz PDINNCIPQYBIEZ-UHFFFAOYSA-N 0 0 356.422 3.763 20 5 FHBDRN Cc1nc(-c2c[nH]c(C(=O)N(C)CCc3ccccc3[N+](=O)[O-])c2)cs1 ZINC000560723993 929963085 /nfs/dbraw/zinc/96/30/85/929963085.db2.gz XZVSZYJJDLDYJQ-UHFFFAOYSA-N 0 0 370.434 3.670 20 5 FHBDRN CO[C@H](C)c1nc(COC(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)cs1 ZINC000784993728 929981881 /nfs/dbraw/zinc/98/18/81/929981881.db2.gz SNBCTIALQPRQRZ-WDEREUQCSA-N 0 0 350.396 3.606 20 5 FHBDRN CCN(Cc1ccccc1C)C(=O)C(=O)Nc1c(C)ccc([N+](=O)[O-])c1C ZINC000121114350 929987378 /nfs/dbraw/zinc/98/73/78/929987378.db2.gz WZZZAYVNPPCNGS-UHFFFAOYSA-N 0 0 369.421 3.507 20 5 FHBDRN COc1ccccc1C1(CNC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000610043510 930036347 /nfs/dbraw/zinc/03/63/47/930036347.db2.gz MBEDYZDFLKUEFN-UHFFFAOYSA-N 0 0 368.433 3.729 20 5 FHBDRN COC(=O)[C@@H](NCc1ccccc1[N+](=O)[O-])c1ccc(Cl)cc1Cl ZINC000610341792 930038265 /nfs/dbraw/zinc/03/82/65/930038265.db2.gz ZFZCCCRUOYOIGK-HNNXBMFYSA-N 0 0 369.204 3.906 20 5 FHBDRN C[C@@H](Nc1ccc(C(=O)Nc2ccccn2)cc1[N+](=O)[O-])c1ccccn1 ZINC000053263985 930058889 /nfs/dbraw/zinc/05/88/89/930058889.db2.gz JSVFQXMONXFQJT-CYBMUJFWSA-N 0 0 363.377 3.810 20 5 FHBDRN C[C@@]1(c2ccccc2)C[C@H]1NC(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000610352621 930097216 /nfs/dbraw/zinc/09/72/16/930097216.db2.gz NIWQVFOMTJLKLI-CTNGQTDRSA-N 0 0 367.449 3.947 20 5 FHBDRN C[C@H]1CN(C(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)C[C@H](C)S1 ZINC000548039222 930110300 /nfs/dbraw/zinc/11/03/00/930110300.db2.gz XNBAUVHPJYEZNK-STQMWFEESA-N 0 0 352.459 3.647 20 5 FHBDRN COCCC1(C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)CCC1 ZINC000177691616 930118919 /nfs/dbraw/zinc/11/89/19/930118919.db2.gz DTRLAPXIXVAWKF-UHFFFAOYSA-N 0 0 361.423 3.864 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N[C@H]1CC[C@H](c2ccc(F)cc2)C1 ZINC000471519870 930129735 /nfs/dbraw/zinc/12/97/35/930129735.db2.gz AERBXEKFQWHEJX-HOCLYGCPSA-N 0 0 358.369 3.565 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[C@@H](c2ccc(F)cc2)C1 ZINC000471522601 930147807 /nfs/dbraw/zinc/14/78/07/930147807.db2.gz XXXBBSOYMRNBFN-HIFRSBDPSA-N 0 0 358.369 3.809 20 5 FHBDRN CC(C)OCC[C@H](O)COc1ccc([N+](=O)[O-])cc1Cc1ccccc1 ZINC000471526431 930162843 /nfs/dbraw/zinc/16/28/43/930162843.db2.gz DZTOHIWYKVOZFU-IBGZPJMESA-N 0 0 359.422 3.740 20 5 FHBDRN CNC(=O)c1ccc(Nc2ccc(N3CCC(C)CC3)cc2)c([N+](=O)[O-])c1 ZINC000064905094 930190056 /nfs/dbraw/zinc/19/00/56/930190056.db2.gz LYGMKKIVFZQHFF-UHFFFAOYSA-N 0 0 368.437 3.934 20 5 FHBDRN CNC(=O)c1ccc(NCCSc2ccc(Cl)cc2)c([N+](=O)[O-])c1 ZINC000064905077 930194936 /nfs/dbraw/zinc/19/49/36/930194936.db2.gz FBWNKFVOSUXAJL-UHFFFAOYSA-N 0 0 365.842 3.812 20 5 FHBDRN CC[C@@H](C)Oc1cccc(NC(=O)C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000275774396 930208093 /nfs/dbraw/zinc/20/80/93/930208093.db2.gz VJCBHFFODHVIFR-CYBMUJFWSA-N 0 0 371.393 3.658 20 5 FHBDRN CC[C@@H](COC)NC(=O)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12 ZINC000275773260 930210852 /nfs/dbraw/zinc/21/08/52/930210852.db2.gz MGOLFRKLWAMDNE-LBPRGKRZSA-N 0 0 360.360 3.527 20 5 FHBDRN CC(C)(NS(=O)(=O)C1=Cc2ccccc2CC1)c1ccc([N+](=O)[O-])cc1 ZINC000175892332 930211118 /nfs/dbraw/zinc/21/11/18/930211118.db2.gz CRLFFSRFXHBTQU-UHFFFAOYSA-N 0 0 372.446 3.737 20 5 FHBDRN C[C@@H]1C(=O)CC[C@@H](C(=O)N(C)Cc2cc([N+](=O)[O-])ccc2Cl)C1(C)C ZINC000275776887 930214610 /nfs/dbraw/zinc/21/46/10/930214610.db2.gz UEMTXAMZGMUUNS-RISCZKNCSA-N 0 0 366.845 3.848 20 5 FHBDRN CCCn1nc(C)c(C(=O)N(C)Cc2cc([N+](=O)[O-])ccc2Cl)c1C ZINC000161689526 937398235 /nfs/dbraw/zinc/39/82/35/937398235.db2.gz XEPVCVBXSQBHMH-UHFFFAOYSA-N 0 0 364.833 3.744 20 5 FHBDRN Cc1cccc(CN(C)C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)c1C ZINC000560957315 930254497 /nfs/dbraw/zinc/25/44/97/930254497.db2.gz NRJKIDXIQNCDBT-UHFFFAOYSA-N 0 0 364.405 3.670 20 5 FHBDRN O=C(c1cccc(Cl)c1[N+](=O)[O-])N1CCOc2ccc(Cl)cc21 ZINC000175901014 930270456 /nfs/dbraw/zinc/27/04/56/930270456.db2.gz DXGNGVZZWZAZFA-UHFFFAOYSA-N 0 0 353.161 3.941 20 5 FHBDRN CNC(=O)c1cc([N+](=O)[O-])ccc1N[C@@H]1CCc2sc(Cl)cc21 ZINC000580138519 930293597 /nfs/dbraw/zinc/29/35/97/930293597.db2.gz ZFRNXGRJBFUUAN-LLVKDONJSA-N 0 0 351.815 3.769 20 5 FHBDRN O=[N+]([O-])c1ccccc1OC[C@@H](O)CSCc1c(F)cccc1F ZINC000580140278 930297877 /nfs/dbraw/zinc/29/78/77/930297877.db2.gz HEHYQTBKYSTORD-LLVKDONJSA-N 0 0 355.362 3.546 20 5 FHBDRN CCOC(=O)C1CCC(Cc2nc(-c3cccc([N+](=O)[O-])c3C)no2)CC1 ZINC000579472457 930320418 /nfs/dbraw/zinc/32/04/18/930320418.db2.gz VNYKCGYSGWTPGR-UHFFFAOYSA-N 0 0 373.409 3.865 20 5 FHBDRN C[C@@H]1C[C@@H]1c1ccc(CNC(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)o1 ZINC000536011140 937408566 /nfs/dbraw/zinc/40/85/66/937408566.db2.gz IOTBTIVPWRDOMB-WBMJQRKESA-N 0 0 355.394 3.579 20 5 FHBDRN CC(C)C[C@H]1CCCCN1C(=O)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000785010655 930362384 /nfs/dbraw/zinc/36/23/84/930362384.db2.gz XYTTUIQQXAUCDQ-CYBMUJFWSA-N 0 0 367.833 3.614 20 5 FHBDRN CSc1cccc(NC(=O)c2sc(Br)cc2[N+](=O)[O-])n1 ZINC000583401327 937410507 /nfs/dbraw/zinc/41/05/07/937410507.db2.gz KVEDOKYZCCIGQG-UHFFFAOYSA-N 0 0 374.241 3.788 20 5 FHBDRN Cc1noc(C)c1[C@H](C)CC(=O)NCCCNc1ccc(C)cc1[N+](=O)[O-] ZINC000155640352 930435879 /nfs/dbraw/zinc/43/58/79/930435879.db2.gz VSKMJLJMPXYSCM-CYBMUJFWSA-N 0 0 374.441 3.620 20 5 FHBDRN O=C(/C=C\c1cccc(F)c1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000255191773 930459972 /nfs/dbraw/zinc/45/99/72/930459972.db2.gz AOVYUASNSDWESR-WTKPLQERSA-N 0 0 370.380 3.817 20 5 FHBDRN CCc1cc(C2CC2)nc(NC(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)n1 ZINC000579521120 930465415 /nfs/dbraw/zinc/46/54/15/930465415.db2.gz SYERWUSPIKEXNB-JTQLQIEISA-N 0 0 358.373 3.706 20 5 FHBDRN CO[C@H](C)CCNC(=O)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12 ZINC000275827575 930494692 /nfs/dbraw/zinc/49/46/92/930494692.db2.gz NUVOOIXAVOURNO-SNVBAGLBSA-N 0 0 360.360 3.527 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)N[C@@H](C)c2nc3c(s2)CCC3)cc1[N+](=O)[O-] ZINC000458513614 937423865 /nfs/dbraw/zinc/42/38/65/937423865.db2.gz QPRLMDWMZNMCJW-RYUDHWBXSA-N 0 0 374.466 3.970 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N[C@H]1CCCOc2ccc(F)cc21 ZINC001125440792 930510716 /nfs/dbraw/zinc/51/07/16/930510716.db2.gz ASPFIKAPMQVBDQ-HNNXBMFYSA-N 0 0 358.369 3.994 20 5 FHBDRN C[C@@H]1C[C@H](CNC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)CCO1 ZINC000275834665 930510733 /nfs/dbraw/zinc/51/07/33/930510733.db2.gz BKEJWOVMUCWJAD-ZIAGYGMSSA-N 0 0 350.418 3.639 20 5 FHBDRN C[C@H]1C(=O)CC[C@@H](C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)C1(C)C ZINC000275844100 930523885 /nfs/dbraw/zinc/52/38/85/930523885.db2.gz WCOLHTNALVSLGU-YOEHRIQHSA-N 0 0 360.454 3.675 20 5 FHBDRN CCc1ccc(C(=O)N2CCCO[C@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000610434168 930536906 /nfs/dbraw/zinc/53/69/06/930536906.db2.gz FBJVWWZRTOOQLP-IBGZPJMESA-N 0 0 354.406 3.761 20 5 FHBDRN CCc1ccc(C(=O)Nc2nnc(Cc3ccccc3)s2)cc1[N+](=O)[O-] ZINC000610433806 930541694 /nfs/dbraw/zinc/54/16/94/930541694.db2.gz OSSBXQQWEWWYIK-UHFFFAOYSA-N 0 0 368.418 3.852 20 5 FHBDRN CCOC(=O)c1sc2ncncc2c1Nc1ccc(F)cc1[N+](=O)[O-] ZINC001210952330 930549374 /nfs/dbraw/zinc/54/93/74/930549374.db2.gz DRKBHPISYKZYSV-UHFFFAOYSA-N 0 0 362.342 3.659 20 5 FHBDRN O=C(N[C@H](c1cccs1)c1ccc(Cl)cc1)c1c[nH]nc1[N+](=O)[O-] ZINC000548083395 930557860 /nfs/dbraw/zinc/55/78/60/930557860.db2.gz WYLQYWYACHWJRJ-ZDUSSCGKSA-N 0 0 362.798 3.552 20 5 FHBDRN CO[C@H](c1ccc(F)cc1)[C@H](C)NC(=O)[C@@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1 ZINC001266606563 930587711 /nfs/dbraw/zinc/58/77/11/930587711.db2.gz XIDWIWSADYONSL-FTNBBQJZSA-N 0 0 372.396 3.730 20 5 FHBDRN CCO[C@@H]1C[C@H](NC(=O)c2c(Cl)cccc2[N+](=O)[O-])C1(CC)CC ZINC000119059246 930593062 /nfs/dbraw/zinc/59/30/62/930593062.db2.gz UYDLNDAIUBNUNY-UONOGXRCSA-N 0 0 354.834 3.962 20 5 FHBDRN O=C(Nc1ccc(NCc2ccccc2)c(Cl)c1)c1c[nH]nc1[N+](=O)[O-] ZINC000548091704 930629444 /nfs/dbraw/zinc/62/94/44/930629444.db2.gz LXPXAEIYVVJIGI-UHFFFAOYSA-N 0 0 371.784 3.836 20 5 FHBDRN C[C@H](C(=O)NCc1ccccc1Br)c1cccc([N+](=O)[O-])c1 ZINC000319543627 930630226 /nfs/dbraw/zinc/63/02/26/930630226.db2.gz LBZCDEFPBBHPDV-NSHDSACASA-N 0 0 363.211 3.777 20 5 FHBDRN COc1ccc(CCNc2nc(C)ccc2[N+](=O)[O-])c(Cl)c1OC ZINC000579619637 930631473 /nfs/dbraw/zinc/63/14/73/930631473.db2.gz YKPFGXKLEPRSTF-UHFFFAOYSA-N 0 0 351.790 3.623 20 5 FHBDRN Cc1c2ccccc2n(C)c1CNC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000548100464 930719550 /nfs/dbraw/zinc/71/95/50/930719550.db2.gz AEQMPSPAOQYMFD-ZDUSSCGKSA-N 0 0 351.406 3.815 20 5 FHBDRN Cc1ccc(NC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)cc1C(=O)N(C)C ZINC000160521095 930761489 /nfs/dbraw/zinc/76/14/89/930761489.db2.gz PHCBGFUTPBTHMS-UHFFFAOYSA-N 0 0 361.785 3.511 20 5 FHBDRN Cc1n[nH]c2cc(NC(=O)[C@H](C)Sc3ccc([N+](=O)[O-])cc3)ccc12 ZINC000091827129 930774591 /nfs/dbraw/zinc/77/45/91/930774591.db2.gz JMZGFFMRXRKUEK-NSHDSACASA-N 0 0 356.407 3.899 20 5 FHBDRN CC(C)(C)OC(=O)CCCCOC(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000785019237 930775821 /nfs/dbraw/zinc/77/58/21/930775821.db2.gz HWQQNYCUOBRNPL-UHFFFAOYSA-N 0 0 357.790 3.917 20 5 FHBDRN COc1ccc2c(c1)CCC[C@H]2c1noc(-c2ccc([N+](=O)[O-])cn2)n1 ZINC000580504869 930778122 /nfs/dbraw/zinc/77/81/22/930778122.db2.gz PRFMMMJNQSOYKB-OAHLLOKOSA-N 0 0 352.350 3.517 20 5 FHBDRN CCN(c1ccc2[nH]ccc2c1)S(=O)(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000471586402 930780340 /nfs/dbraw/zinc/78/03/40/930780340.db2.gz PLZLAMNCGHSKDE-UHFFFAOYSA-N 0 0 359.407 3.600 20 5 FHBDRN NC(=O)c1ccc(CSc2ccc(Br)cc2[N+](=O)[O-])cc1 ZINC000119169386 930796469 /nfs/dbraw/zinc/79/64/69/930796469.db2.gz MXRWLWOIMDVGIH-UHFFFAOYSA-N 0 0 367.224 3.749 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(N[C@H]2C[C@H](c3ccccc3Cl)C2)n1 ZINC000580576411 930872263 /nfs/dbraw/zinc/87/22/63/930872263.db2.gz SPQAYLTZXOTWDY-XYPYZODXSA-N 0 0 361.785 3.788 20 5 FHBDRN CO[C@@H](c1ccccc1F)[C@@H](C)NC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000537245118 930883299 /nfs/dbraw/zinc/88/32/99/930883299.db2.gz VTZOLKJNLBJZGZ-SJKOYZFVSA-N 0 0 361.373 3.940 20 5 FHBDRN COC(=O)c1cc(C)nc(N(C)Cc2cc(Cl)ccc2F)c1[N+](=O)[O-] ZINC000580589508 930891915 /nfs/dbraw/zinc/89/19/15/930891915.db2.gz GBQIZDSAAOBQST-UHFFFAOYSA-N 0 0 367.764 3.514 20 5 FHBDRN COc1ccc(Cc2noc(/C=C\c3cccc([N+](=O)[O-])c3)n2)cc1OC ZINC000255624938 930899774 /nfs/dbraw/zinc/89/97/74/930899774.db2.gz NRRVCKPWVICIAZ-CLFYSBASSA-N 0 0 367.361 3.756 20 5 FHBDRN CCOC(=O)c1cc(C(=O)N2CCCCc3ccccc32)cc([N+](=O)[O-])c1 ZINC000047975584 930948607 /nfs/dbraw/zinc/94/86/07/930948607.db2.gz SSYYNXVBTBUYFS-UHFFFAOYSA-N 0 0 368.389 3.755 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)NCCc1ccc(Br)cc1 ZINC000319877146 930956346 /nfs/dbraw/zinc/95/63/46/930956346.db2.gz IQUPJHWXYADAKJ-UHFFFAOYSA-N 0 0 363.211 3.638 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)c1ccc(C(=O)NC(C)C)cc1 ZINC000155809283 930960292 /nfs/dbraw/zinc/96/02/92/930960292.db2.gz HUDKKTFJJBVLJC-UHFFFAOYSA-N 0 0 355.394 3.602 20 5 FHBDRN Cc1cc(N[C@@H]2CC[N@@H+]([C@H](C)c3ccccc3)C2)cc(C(=O)[O-])c1[N+](=O)[O-] ZINC000580650798 930971948 /nfs/dbraw/zinc/97/19/48/930971948.db2.gz ZKUDUZCUIKQDJX-GDBMZVCRSA-N 0 0 369.421 3.849 20 5 FHBDRN NC(=O)c1ccnc(N2CCCCC[C@@H]2/C=C\c2cccs2)c1[N+](=O)[O-] ZINC000580663540 930986802 /nfs/dbraw/zinc/98/68/02/930986802.db2.gz OTCOZOHYMAAEFK-MEJMFZKBSA-N 0 0 372.450 3.613 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2C[C@@H](Oc3ccccc3)C2(C)C)c1 ZINC000580671088 930995193 /nfs/dbraw/zinc/99/51/93/930995193.db2.gz QETZGQBAFLQHTL-ZWKOTPCHSA-N 0 0 354.406 3.879 20 5 FHBDRN C[C@@H](NC(=O)c1c[nH]nc1[N+](=O)[O-])c1ccccc1Oc1ccccc1 ZINC000579809654 931064707 /nfs/dbraw/zinc/06/47/07/931064707.db2.gz ZELZFLVFKJZBFZ-GFCCVEGCSA-N 0 0 352.350 3.601 20 5 FHBDRN CN1CCCc2cc(COC(=O)C(C)(C)c3ccccc3[N+](=O)[O-])ccc21 ZINC001266642298 931076958 /nfs/dbraw/zinc/07/69/58/931076958.db2.gz ISLWDUOWQUZQEE-UHFFFAOYSA-N 0 0 368.433 3.998 20 5 FHBDRN CC(C)c1ccc(C(=O)Nc2cc(C3CCOCC3)[nH]n2)cc1[N+](=O)[O-] ZINC000275949916 931093552 /nfs/dbraw/zinc/09/35/52/931093552.db2.gz ZOHOYQSWAIXASI-UHFFFAOYSA-N 0 0 358.398 3.588 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)ccc1N1CCC[C@H](c2nnc3ccccn32)C1 ZINC000247306707 931148719 /nfs/dbraw/zinc/14/87/19/931148719.db2.gz GZYYXNCSBKRWRH-LBPRGKRZSA-N 0 0 357.801 3.675 20 5 FHBDRN CSCC[C@H](C)N(C)C(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000134314892 931163630 /nfs/dbraw/zinc/16/36/30/931163630.db2.gz RFDHQXCQOYXVMU-QWRGUYRKSA-N 0 0 360.863 3.616 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H](Cn1cccn1)c1ccccc1 ZINC000610162957 931216754 /nfs/dbraw/zinc/21/67/54/931216754.db2.gz AACAAYZZUFWSLP-SFHVURJKSA-N 0 0 365.393 3.663 20 5 FHBDRN O=[N+]([O-])c1cc2c(ncnc2NCc2coc(-c3ccccc3)n2)s1 ZINC000561201761 931228966 /nfs/dbraw/zinc/22/89/66/931228966.db2.gz JHJFBYZUWDOGNP-UHFFFAOYSA-N 0 0 353.363 3.867 20 5 FHBDRN Cc1ccc(NC(=O)C2CCC(OC[C@@H]3CCCO3)CC2)cc1[N+](=O)[O-] ZINC000580846369 931261436 /nfs/dbraw/zinc/26/14/36/931261436.db2.gz ZUWRYSOODPRVNO-PREGVCBESA-N 0 0 362.426 3.596 20 5 FHBDRN Cc1noc(-c2ccccc2C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)n1 ZINC000177836804 931265500 /nfs/dbraw/zinc/26/55/00/931265500.db2.gz FJMBJTCOBSHRQE-LBPRGKRZSA-N 0 0 366.377 3.753 20 5 FHBDRN O=C(c1ccc2ccc(Cl)cc2n1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000084072981 931266616 /nfs/dbraw/zinc/26/66/16/931266616.db2.gz RRIPASWFUAOMCN-UHFFFAOYSA-N 0 0 353.765 3.999 20 5 FHBDRN CCc1nc2ccccc2n1CC(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000177839333 931268455 /nfs/dbraw/zinc/26/84/55/931268455.db2.gz CLODEJRPZBROOU-CQSZACIVSA-N 0 0 366.421 3.693 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)[C@@H](C)n2cnc3ccccc32)cc1[N+](=O)[O-] ZINC000177850055 931290961 /nfs/dbraw/zinc/29/09/61/931290961.db2.gz GVWSGLMDCSWFTC-ZIAGYGMSSA-N 0 0 352.394 3.691 20 5 FHBDRN COCCCOc1cccc(C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000177847648 931293012 /nfs/dbraw/zinc/29/30/12/931293012.db2.gz JMBCWYITABVFKO-OAHLLOKOSA-N 0 0 372.421 3.810 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)c2c(F)c(F)cc(F)c2F)cc1[N+](=O)[O-] ZINC000177852683 931294710 /nfs/dbraw/zinc/29/47/10/931294710.db2.gz KRVLYVJATDRKHY-QMMMGPOBSA-N 0 0 356.275 3.951 20 5 FHBDRN O=C(c1cc2cc([N+](=O)[O-])ccc2o1)N1CCCC[C@H]([C@@H]2CCOC2)C1 ZINC000891337757 931301310 /nfs/dbraw/zinc/30/13/10/931301310.db2.gz TWHFIFXMARSAEW-UONOGXRCSA-N 0 0 358.394 3.620 20 5 FHBDRN COc1ccc(OCCC(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000177859217 931330236 /nfs/dbraw/zinc/33/02/36/931330236.db2.gz LXJOOMCILHSPEY-CQSZACIVSA-N 0 0 358.394 3.558 20 5 FHBDRN COC(=O)c1cc(C)nc(N[C@@H](C)c2ccc(F)cc2F)c1[N+](=O)[O-] ZINC000561236690 931332509 /nfs/dbraw/zinc/33/25/09/931332509.db2.gz WRJMYTGOEOPTKK-VIFPVBQESA-N 0 0 351.309 3.536 20 5 FHBDRN Cc1ccc(C(=O)N[C@@H]2c3ccccc3CC23CCOCC3)cc1[N+](=O)[O-] ZINC000580922858 931351396 /nfs/dbraw/zinc/35/13/96/931351396.db2.gz FACVVEUTXQFLBT-LJQANCHMSA-N 0 0 366.417 3.727 20 5 FHBDRN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CN[C@H]([C@@H]1CCOC1)C(F)(F)F ZINC000933009689 931356101 /nfs/dbraw/zinc/35/61/01/931356101.db2.gz SIYZPXWCIRNLIY-JMCQJSRRSA-N 0 0 373.158 3.959 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1C(=O)NCc1coc(-c2cccs2)n1 ZINC001125479421 931373279 /nfs/dbraw/zinc/37/32/79/931373279.db2.gz ZOWLBRSZDSUYFT-UHFFFAOYSA-N 0 0 357.391 3.858 20 5 FHBDRN Cc1ccc(-c2nc(CSCc3c([N+](=O)[O-])ncn3C)cs2)o1 ZINC000477001086 931375941 /nfs/dbraw/zinc/37/59/41/931375941.db2.gz ZWUUQWGOKDQPJX-UHFFFAOYSA-N 0 0 350.425 3.787 20 5 FHBDRN CCc1c(C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)[nH]c(C)c1C(C)=O ZINC000177866802 931389915 /nfs/dbraw/zinc/38/99/15/931389915.db2.gz UIPCCTGLNCGYLD-LLVKDONJSA-N 0 0 357.410 3.796 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)c2c[nH]nc2-c2ccccc2)cc1[N+](=O)[O-] ZINC000177865330 931393137 /nfs/dbraw/zinc/39/31/37/931393137.db2.gz FMIOOEGMXUCGQP-CYBMUJFWSA-N 0 0 350.378 3.784 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)c2cc(F)c(F)c(F)c2F)cc1[N+](=O)[O-] ZINC000177872301 931397559 /nfs/dbraw/zinc/39/75/59/931397559.db2.gz ZQYRLWZHZUYJQB-QMMMGPOBSA-N 0 0 356.275 3.951 20 5 FHBDRN C[C@@H]1C[C@@H](COC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)CCO1 ZINC000785031524 931399854 /nfs/dbraw/zinc/39/98/54/931399854.db2.gz KYSKSGHVOLQDOL-KGLIPLIRSA-N 0 0 351.402 3.653 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2nc(CN3CCC=C(c4cccnc4)C3)co2)cc1 ZINC000580980686 931442017 /nfs/dbraw/zinc/44/20/17/931442017.db2.gz VUSZIPBEMRBSSK-UHFFFAOYSA-N 0 0 362.389 3.934 20 5 FHBDRN Cc1cccc(C)c1OCCCNC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000580988933 931449738 /nfs/dbraw/zinc/44/97/38/931449738.db2.gz UXYVTDWYGAQXIS-MRXNPFEDSA-N 0 0 356.422 3.900 20 5 FHBDRN Cn1cnc([N+](=O)[O-])c1CSCc1csc(-c2ccsc2)n1 ZINC000477008962 931520395 /nfs/dbraw/zinc/52/03/95/931520395.db2.gz CJYZSWOBIUACGW-UHFFFAOYSA-N 0 0 352.466 3.947 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(N[C@@H]2CC[C@@H](c3cccc(F)c3)C2)n1 ZINC000561309188 931533268 /nfs/dbraw/zinc/53/32/68/931533268.db2.gz YEAKYYPSLJMPLW-TZMCWYRMSA-N 0 0 359.357 3.664 20 5 FHBDRN O=C(C=Cc1ccc([N+](=O)[O-])cc1)OCc1cc2ccccc2[nH]c1=O ZINC000255266147 931556711 /nfs/dbraw/zinc/55/67/11/931556711.db2.gz BRWOWRLHIPOCFY-YFHOEESVSA-N 0 0 350.330 3.605 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)Nc1cc(-c2ccccc2)on1 ZINC000127159792 931589586 /nfs/dbraw/zinc/58/95/86/931589586.db2.gz IMLGGVUKRURMSN-UHFFFAOYSA-N 0 0 352.350 3.614 20 5 FHBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])c1cnc(CC2CC2)s1 ZINC001266677928 931609545 /nfs/dbraw/zinc/60/95/45/931609545.db2.gz REJVECJCDKHKTK-UHFFFAOYSA-N 0 0 365.842 3.630 20 5 FHBDRN COc1ccc2c(c1)C1(CC1)CN(C(=O)Nc1cccc([N+](=O)[O-])c1)C2 ZINC000581197980 931666521 /nfs/dbraw/zinc/66/65/21/931666521.db2.gz AUZOEZYKJAPGHO-UHFFFAOYSA-N 0 0 353.378 3.683 20 5 FHBDRN O=C(c1c([N+](=O)[O-])cccc1C(F)(F)F)N1Cc2ccccc2CO1 ZINC000581214607 931683448 /nfs/dbraw/zinc/68/34/48/931683448.db2.gz IHLDECQZEANOCG-UHFFFAOYSA-N 0 0 352.268 3.701 20 5 FHBDRN CC(C)c1ccc(C(=O)Nc2cn(C)nc2C(F)(F)F)cc1[N+](=O)[O-] ZINC000477028423 931699579 /nfs/dbraw/zinc/69/95/79/931699579.db2.gz FIPPLODEZFPGRH-UHFFFAOYSA-N 0 0 356.304 3.723 20 5 FHBDRN CC(=O)c1cccc(NC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)c1O ZINC000581267143 931764539 /nfs/dbraw/zinc/76/45/39/931764539.db2.gz SMIZMHLMPARFAT-NSHDSACASA-N 0 0 360.391 3.622 20 5 FHBDRN O=C(N[C@H]1CCCN(c2ccccc2Cl)C1)c1ccccc1[N+](=O)[O-] ZINC000126389709 931781418 /nfs/dbraw/zinc/78/14/18/931781418.db2.gz YXULGUMJFNCJRU-ZDUSSCGKSA-N 0 0 359.813 3.647 20 5 FHBDRN CC(C)(NC(=O)[C@@H]1COc2ccc(Cl)cc2C1)c1ccc([N+](=O)[O-])cc1 ZINC000430550748 931799355 /nfs/dbraw/zinc/79/93/55/931799355.db2.gz ZQGUWZQCGNVGNG-ZDUSSCGKSA-N 0 0 374.824 3.851 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)N1CCCCC[C@H]1[C@@H]1CCCCC1=O ZINC000126401599 931803259 /nfs/dbraw/zinc/80/32/59/931803259.db2.gz CRVWHPZNSNCROX-ROUUACIJSA-N 0 0 358.438 3.668 20 5 FHBDRN Cc1cc(C(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)nn1-c1ccccc1 ZINC000430555231 931822545 /nfs/dbraw/zinc/82/25/45/931822545.db2.gz HVCCZHSSNLOUOZ-UHFFFAOYSA-N 0 0 364.405 3.754 20 5 FHBDRN CC(C)Oc1ccccc1Cc1nc(-c2ccc(N)c([N+](=O)[O-])c2)no1 ZINC000544931549 931827084 /nfs/dbraw/zinc/82/70/84/931827084.db2.gz RNPAZTQKQXQUTB-UHFFFAOYSA-N 0 0 354.366 3.605 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@H](C)COc1c(C)cccc1C ZINC000561334612 931839447 /nfs/dbraw/zinc/83/94/47/931839447.db2.gz PQHHNDCBKOKIHK-OAHLLOKOSA-N 0 0 372.421 3.808 20 5 FHBDRN CSc1cc(CNC(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])ccn1 ZINC001266702929 931843973 /nfs/dbraw/zinc/84/39/73/931843973.db2.gz WVIPEPSBGWKICU-UHFFFAOYSA-N 0 0 371.340 3.661 20 5 FHBDRN Cc1ccc(S(=O)(=O)N[C@H]2CCc3sc(Cl)cc32)c([N+](=O)[O-])c1 ZINC000581337805 931854419 /nfs/dbraw/zinc/85/44/19/931854419.db2.gz ALIQXORLVYOENR-JTQLQIEISA-N 0 0 372.855 3.584 20 5 FHBDRN O=C(NCc1ccc(-c2ccccc2)cc1F)c1ccc([N+](=O)[O-])cn1 ZINC000561336329 931868340 /nfs/dbraw/zinc/86/83/40/931868340.db2.gz BIDQWQUEUJGOAX-UHFFFAOYSA-N 0 0 351.337 3.726 20 5 FHBDRN Cc1noc(-c2cccnc2NCCc2ccc(Cl)cc2[N+](=O)[O-])n1 ZINC000477080572 931870040 /nfs/dbraw/zinc/87/00/40/931870040.db2.gz DBMZYLTZIMUBDI-UHFFFAOYSA-N 0 0 359.773 3.656 20 5 FHBDRN O=[N+]([O-])c1ccc(S(=O)(=O)Cc2c(Cl)ccc3cccnc32)cc1 ZINC000477077897 931870067 /nfs/dbraw/zinc/87/00/67/931870067.db2.gz SKZZAMKGLUPMFI-UHFFFAOYSA-N 0 0 362.794 3.770 20 5 FHBDRN C[C@H]1CN(C(=O)c2c[nH]c3ccc([N+](=O)[O-])cc32)C[C@H](c2ccsc2)O1 ZINC000156170946 931900710 /nfs/dbraw/zinc/90/07/10/931900710.db2.gz RYGSGKGZVXIFIX-APPDUMDISA-N 0 0 371.418 3.740 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2noc(CN3CCc4cc(Cl)ccc43)n2)c1 ZINC000511836824 931953506 /nfs/dbraw/zinc/95/35/06/931953506.db2.gz AYOVUBCXXUFLSE-UHFFFAOYSA-N 0 0 356.769 3.861 20 5 FHBDRN CCc1ccc(C(C)(C)CNC(=O)c2cc(OC)ccc2[N+](=O)[O-])cc1 ZINC000430583834 931959348 /nfs/dbraw/zinc/95/93/48/931959348.db2.gz NMXYYMNQWIEZDL-UHFFFAOYSA-N 0 0 356.422 3.873 20 5 FHBDRN Cc1cc(OCC(=O)N2CC[C@@H](c3ccc(Cl)cc3)C2)ccc1[N+](=O)[O-] ZINC000430587157 931972273 /nfs/dbraw/zinc/97/22/73/931972273.db2.gz UVLMVQVKCGSCAG-OAHLLOKOSA-N 0 0 374.824 3.952 20 5 FHBDRN CC[C@H](C)c1ccc(NC(=O)COC(=O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000003383865 931975887 /nfs/dbraw/zinc/97/58/87/931975887.db2.gz KIVCAUZBDWNSGA-ZDUSSCGKSA-N 0 0 356.378 3.904 20 5 FHBDRN CNc1ccc(C(=O)NC[C@@H]2CCCC[C@H]2C(F)(F)F)cc1[N+](=O)[O-] ZINC000610503529 931998670 /nfs/dbraw/zinc/99/86/70/931998670.db2.gz HGODOHXMVXTPGT-NWDGAFQWSA-N 0 0 359.348 3.735 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)N1CC[C@H]1c1cccc(F)c1 ZINC000610505432 932012480 /nfs/dbraw/zinc/01/24/80/932012480.db2.gz LKJQLBAYGRSQEJ-PXAZEXFGSA-N 0 0 373.384 3.517 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)N(Cc2ccccc2)C(C)C)cc1C ZINC000060496487 932014234 /nfs/dbraw/zinc/01/42/34/932014234.db2.gz FMDXUWZRTWASOS-UHFFFAOYSA-N 0 0 362.451 3.811 20 5 FHBDRN Cc1c(NC(=O)[C@@H](C)N2CC[C@@H]2c2cccc(F)c2)cccc1[N+](=O)[O-] ZINC000610505224 932014526 /nfs/dbraw/zinc/01/45/26/932014526.db2.gz CSNIKBSYPWVEAI-FZKQIMNGSA-N 0 0 357.385 3.816 20 5 FHBDRN C[C@@H](SCC(=O)Nc1ccc([N+](=O)[O-])cc1)c1nc2ccccc2[nH]1 ZINC000060515500 932037443 /nfs/dbraw/zinc/03/74/43/932037443.db2.gz NTQLIMHFRWZIER-LLVKDONJSA-N 0 0 356.407 3.904 20 5 FHBDRN COc1cccc(CNc2ncc([N+](=O)[O-])c(C)c2Br)c1 ZINC000165725878 932046271 /nfs/dbraw/zinc/04/62/71/932046271.db2.gz CWELOGVYQFYTQE-UHFFFAOYSA-N 0 0 352.188 3.681 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2noc(CN3CC[C@H]3c3cccc(F)c3)n2)c1 ZINC000610505651 932052124 /nfs/dbraw/zinc/05/21/24/932052124.db2.gz QABJBMITZXQPTK-INIZCTEOSA-N 0 0 354.341 3.731 20 5 FHBDRN O=C(CN1CC[C@@H]1c1cccc(F)c1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000610505712 932052349 /nfs/dbraw/zinc/05/23/49/932052349.db2.gz SNOWHORKMOGTON-OAHLLOKOSA-N 0 0 363.776 3.773 20 5 FHBDRN C[C@@H](COCC(F)(F)F)NC(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000561378211 932054816 /nfs/dbraw/zinc/05/48/16/932054816.db2.gz ZLNLVBVNIVWQHF-JTQLQIEISA-N 0 0 362.348 3.590 20 5 FHBDRN O=C(Nc1ccc(F)cc1-c1nc(C2CC2)no1)c1ccccc1[N+](=O)[O-] ZINC000471656953 932054936 /nfs/dbraw/zinc/05/49/36/932054936.db2.gz VICRMDIVIVSBCE-UHFFFAOYSA-N 0 0 368.324 3.914 20 5 FHBDRN COCCN(Cc1nc2cc([N+](=O)[O-])ccc2o1)[C@H](C)c1ccccc1 ZINC000610581527 932073263 /nfs/dbraw/zinc/07/32/63/932073263.db2.gz PDTCYVNIFJTDPV-CQSZACIVSA-N 0 0 355.394 3.946 20 5 FHBDRN COc1cc(C(=O)N2C[C@@H](c3ccc(F)cc3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000135246570 932096694 /nfs/dbraw/zinc/09/66/94/932096694.db2.gz IWTLLMDTCPCIOV-WFASDCNBSA-N 0 0 358.369 3.761 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N2C[C@@H](C)c3ccccc32)cc1OC ZINC000060599717 932097229 /nfs/dbraw/zinc/09/72/29/932097229.db2.gz GSGUQOVTUJNMSV-GFCCVEGCSA-N 0 0 356.378 3.766 20 5 FHBDRN COCCN(Cc1ccc(C)cc1C)C(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000610665555 932097558 /nfs/dbraw/zinc/09/75/58/932097558.db2.gz BDFFRAJUGFUSQY-UHFFFAOYSA-N 0 0 370.449 3.819 20 5 FHBDRN COc1ccccc1[C@H](CNC(=O)c1ccc([N+](=O)[O-])c(C)c1)OC(C)C ZINC000187416617 932172394 /nfs/dbraw/zinc/17/23/94/932172394.db2.gz MWZMUMYYCAYAIQ-IBGZPJMESA-N 0 0 372.421 3.808 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)/C=C\c1nc2ccccc2s1 ZINC000255317729 932177064 /nfs/dbraw/zinc/17/70/64/932177064.db2.gz IZOLZYLLBJPTDR-KHPPLWFESA-N 0 0 353.403 3.876 20 5 FHBDRN COc1ccc([C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)cc1OC ZINC000073434053 932215143 /nfs/dbraw/zinc/21/51/43/932215143.db2.gz FFPBAKRAWGVTIV-LBPRGKRZSA-N 0 0 362.407 3.651 20 5 FHBDRN Cc1ccc(NC(=O)c2c[nH]nc2[N+](=O)[O-])cc1OCC1CCCCC1 ZINC000558758290 932252603 /nfs/dbraw/zinc/25/26/03/932252603.db2.gz UAVAKFKSUAQTTA-UHFFFAOYSA-N 0 0 358.398 3.838 20 5 FHBDRN CN(CCc1ccccc1)C(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000126572455 932254569 /nfs/dbraw/zinc/25/45/69/932254569.db2.gz JWUZHMHRLYZYHH-UHFFFAOYSA-N 0 0 352.312 3.928 20 5 FHBDRN CC(C)Oc1ccc(Oc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)cc1 ZINC000276377181 932292201 /nfs/dbraw/zinc/29/22/01/932292201.db2.gz YCMJZDGUYZSEKT-UHFFFAOYSA-N 0 0 351.380 3.578 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NCCc1ccc(Cl)nc1 ZINC000160965109 932303545 /nfs/dbraw/zinc/30/35/45/932303545.db2.gz SFDIIXZQBKJRPQ-UHFFFAOYSA-N 0 0 365.842 3.728 20 5 FHBDRN Cc1ccc(CN(c2ncc([N+](=O)[O-])cc2Br)C2CC2)o1 ZINC000610512788 932314513 /nfs/dbraw/zinc/31/45/13/932314513.db2.gz OWOIOEMEYOBPNN-UHFFFAOYSA-N 0 0 352.188 3.823 20 5 FHBDRN CN(C(=O)C1(C(F)F)CC1)c1nc(-c2ccccc2[N+](=O)[O-])cs1 ZINC000843570209 932316366 /nfs/dbraw/zinc/31/63/66/932316366.db2.gz GTHNHPZJXWNTCR-UHFFFAOYSA-N 0 0 353.350 3.726 20 5 FHBDRN Cc1cc(NC(=O)c2ccc([N+](=O)[O-])cc2Br)ccc1O ZINC000157318234 932327838 /nfs/dbraw/zinc/32/78/38/932327838.db2.gz XVPDUNPRKACGSZ-UHFFFAOYSA-N 0 0 351.156 3.624 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)NC[C@@H](C)c2ccc(C)cc2)cc1OC ZINC000127201125 932343764 /nfs/dbraw/zinc/34/37/64/932343764.db2.gz QJDNYQDTBXSYGU-CQSZACIVSA-N 0 0 372.421 3.844 20 5 FHBDRN COc1c(C(=O)NCc2ccc(-c3ccco3)cc2F)cccc1[N+](=O)[O-] ZINC000477141432 932349320 /nfs/dbraw/zinc/34/93/20/932349320.db2.gz FTWBRWGHTYSTJR-UHFFFAOYSA-N 0 0 370.336 3.933 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N[C@H](Cc1ccccc1)C1CC1 ZINC000135265059 932367422 /nfs/dbraw/zinc/36/74/22/932367422.db2.gz PCUVPLLLYQLABS-HXUWFJFHSA-N 0 0 363.417 3.756 20 5 FHBDRN CC(C)C[C@@H]1OCCC[C@H]1NC(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000477175881 932374213 /nfs/dbraw/zinc/37/42/13/932374213.db2.gz NGBCWEYKJPUECJ-CVEARBPZSA-N 0 0 369.849 3.641 20 5 FHBDRN Cc1nc(-c2ccc(NC(=O)c3cccc([N+](=O)[O-])c3N)cc2)oc1C ZINC000610520216 932374824 /nfs/dbraw/zinc/37/48/24/932374824.db2.gz CEZDUGKSHFGNGG-UHFFFAOYSA-N 0 0 352.350 3.701 20 5 FHBDRN O=C(/C=C\c1cncc(F)c1)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000588422336 932409097 /nfs/dbraw/zinc/40/90/97/932409097.db2.gz VAEHZJMOAKLJRY-RJRFIUFISA-N 0 0 355.247 3.800 20 5 FHBDRN COCCC1(CNC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)CCCCC1 ZINC000477247474 932433158 /nfs/dbraw/zinc/43/31/58/932433158.db2.gz IJPUQLLARWYVOR-UHFFFAOYSA-N 0 0 373.453 3.653 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])OCc1cc(F)ccc1Cl ZINC000782256529 932452259 /nfs/dbraw/zinc/45/22/59/932452259.db2.gz XPMFOSZPTHCDQR-UHFFFAOYSA-N 0 0 353.733 3.900 20 5 FHBDRN CC(C)C[C@@H]1OCCC[C@@H]1NC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000477299874 932456541 /nfs/dbraw/zinc/45/65/41/932456541.db2.gz WUNVMWBPHJETKC-GJZGRUSLSA-N 0 0 374.359 3.937 20 5 FHBDRN COc1ccccc1C[C@@H](NC(=O)c1ccc([N+](=O)[O-])c(OC)c1)C(C)C ZINC000477302040 932456720 /nfs/dbraw/zinc/45/67/20/932456720.db2.gz NBFHGLFYUYPZBP-MRXNPFEDSA-N 0 0 372.421 3.609 20 5 FHBDRN C[C@H](c1cccc([N+](=O)[O-])c1)N1CCN(C(=O)CCC2CCCC2)CC1 ZINC000097205617 932495765 /nfs/dbraw/zinc/49/57/65/932495765.db2.gz GUDODJLYDNYWGD-MRXNPFEDSA-N 0 0 359.470 3.770 20 5 FHBDRN CN(C(=O)c1csc([N+](=O)[O-])c1)[C@@H]1C[C@H](Oc2ccccc2)C1(C)C ZINC000581687111 932497440 /nfs/dbraw/zinc/49/74/40/932497440.db2.gz RJERTEGRHGRRDO-CABCVRRESA-N 0 0 360.435 3.974 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)NC[C@H](C)Oc1cccc(F)c1 ZINC000477372507 932520226 /nfs/dbraw/zinc/52/02/26/932520226.db2.gz LWQDUXSICMLFLN-NSHDSACASA-N 0 0 366.776 3.893 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)Nc1n[nH]c2c1cccc2Cl ZINC000477421549 932574950 /nfs/dbraw/zinc/57/49/50/932574950.db2.gz RJKFJPHTUQFFQL-UHFFFAOYSA-N 0 0 365.176 3.761 20 5 FHBDRN Cc1ccc(C(=O)NCCc2cn(C)c3cc(F)ccc23)cc1[N+](=O)[O-] ZINC000471693253 932629369 /nfs/dbraw/zinc/62/93/69/932629369.db2.gz OLFRVHPHNSDKLD-UHFFFAOYSA-N 0 0 355.369 3.507 20 5 FHBDRN Cc1cnc(NC(=O)c2c(C)c(F)ccc2[N+](=O)[O-])c(Br)c1 ZINC001266818661 932651120 /nfs/dbraw/zinc/65/11/20/932651120.db2.gz HQLPEDWCOQADKG-UHFFFAOYSA-N 0 0 368.162 3.761 20 5 FHBDRN CCC[C@H]1[C@@H](C)CCCN1C(=O)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000785068841 932656964 /nfs/dbraw/zinc/65/69/64/932656964.db2.gz ZPNDHCCTBISJAR-FZMZJTMJSA-N 0 0 367.833 3.614 20 5 FHBDRN CCOc1ccc(NC(=O)CNc2cc(F)cc(Cl)c2)c([N+](=O)[O-])c1 ZINC000477520558 932664455 /nfs/dbraw/zinc/66/44/55/932664455.db2.gz OMBJSRAHRDJHNK-UHFFFAOYSA-N 0 0 367.764 3.837 20 5 FHBDRN CCOc1cc2c(cc1OCC)CN(c1nc(C)ccc1[N+](=O)[O-])CC2 ZINC000178153924 932702196 /nfs/dbraw/zinc/70/21/96/932702196.db2.gz KNHYITNBSLJORN-UHFFFAOYSA-N 0 0 357.410 3.658 20 5 FHBDRN COc1ccc(OCc2cc(Br)ccc2OC)c([N+](=O)[O-])c1 ZINC000008202179 932712825 /nfs/dbraw/zinc/71/28/25/932712825.db2.gz IBJQBZZERPGXGK-UHFFFAOYSA-N 0 0 368.183 3.954 20 5 FHBDRN Nc1c(C(=O)N(Cc2ccco2)Cc2cccs2)cccc1[N+](=O)[O-] ZINC000178163919 932727354 /nfs/dbraw/zinc/72/73/54/932727354.db2.gz ZZJHQBWYCJTDMI-UHFFFAOYSA-N 0 0 357.391 3.674 20 5 FHBDRN COc1cc(NC2CCN(c3ccc([N+](=O)[O-])s3)CC2)cc(OC)c1 ZINC000610542245 932729109 /nfs/dbraw/zinc/72/91/09/932729109.db2.gz JENGTXINCGVPOR-UHFFFAOYSA-N 0 0 363.439 3.754 20 5 FHBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)NCCC1(F)CCC1 ZINC000581845272 932733530 /nfs/dbraw/zinc/73/35/30/932733530.db2.gz RGEVBZQFPVTESH-UHFFFAOYSA-N 0 0 352.409 3.553 20 5 FHBDRN Cc1ncc([N+](=O)[O-])n1CC(=O)Nc1cccc(CSC(C)C)c1C ZINC000933500862 932735554 /nfs/dbraw/zinc/73/55/54/932735554.db2.gz QPVKCTHNJWTXTA-UHFFFAOYSA-N 0 0 362.455 3.688 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)N[C@H]1CC[C@@H](c2ccc(F)cc2)C1 ZINC000471735446 932741193 /nfs/dbraw/zinc/74/11/93/932741193.db2.gz JFZOWLXBAPQYOU-AEFFLSMTSA-N 0 0 371.412 3.912 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)Nc1ccc(CC(F)(F)F)cc1 ZINC000127324725 932741203 /nfs/dbraw/zinc/74/12/03/932741203.db2.gz FNCHLBYBDOAGMT-UHFFFAOYSA-N 0 0 354.284 3.717 20 5 FHBDRN COc1cc(C(=O)N(C)Cc2ccc(Cl)s2)c([N+](=O)[O-])cc1OC ZINC000045905334 932743087 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0 0 362.813 3.799 20 5 FHBDRN CC[C@H](OC(=O)[C@H](C)OC[C@H]1CCCCO1)c1cccc([N+](=O)[O-])c1 ZINC001266835576 932811267 /nfs/dbraw/zinc/81/12/67/932811267.db2.gz IQGZKMNFNZFKER-XKQJLSEDSA-N 0 0 351.399 3.563 20 5 FHBDRN CC[C@H](OC(=O)c1cccc2c1CC(=O)CC2)c1cccc([N+](=O)[O-])c1 ZINC001266835974 932811790 /nfs/dbraw/zinc/81/17/90/932811790.db2.gz VIROAVCAQAMECV-IBGZPJMESA-N 0 0 353.374 3.961 20 5 FHBDRN CC[C@H](OC(=O)c1ccc2c(c1)NC(=O)CS2)c1cccc([N+](=O)[O-])c1 ZINC001266834763 932813116 /nfs/dbraw/zinc/81/31/16/932813116.db2.gz BYRNKVJAHUZTJV-HNNXBMFYSA-N 0 0 372.402 3.947 20 5 FHBDRN COc1cc(C(=O)N2CC[C@@H](c3ccccc3OC)C2)cc([N+](=O)[O-])c1C ZINC000276644441 932816550 /nfs/dbraw/zinc/81/65/50/932816550.db2.gz MYKOROKFALQPJY-CQSZACIVSA-N 0 0 370.405 3.550 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)Nc1ccc(F)c(Br)c1 ZINC000135308988 932836628 /nfs/dbraw/zinc/83/66/28/932836628.db2.gz XXIUJYKMBGLRJP-UHFFFAOYSA-N 0 0 353.147 3.678 20 5 FHBDRN C[C@H]1C[C@H](NC(=O)OC(C)(C)C)CCN1Cc1c(F)cccc1[N+](=O)[O-] ZINC000134661388 932837652 /nfs/dbraw/zinc/83/76/52/932837652.db2.gz DLVIPOHQEJKRMR-QWHCGFSZSA-N 0 0 367.421 3.612 20 5 FHBDRN Nc1c(C(=O)NC(c2cccs2)c2cccs2)cccc1[N+](=O)[O-] ZINC000178202330 932842310 /nfs/dbraw/zinc/84/23/10/932842310.db2.gz AMKIOIZEXUPWHA-UHFFFAOYSA-N 0 0 359.432 3.819 20 5 FHBDRN Nc1c(C(=O)Nc2ccc(F)cc2OCC(F)(F)F)cccc1[N+](=O)[O-] ZINC000178200205 932845837 /nfs/dbraw/zinc/84/58/37/932845837.db2.gz LRGBCCPCGUWJTM-UHFFFAOYSA-N 0 0 373.262 3.510 20 5 FHBDRN Cc1cc(OCC(=O)N[C@H](C)c2c(F)cccc2Cl)ccc1[N+](=O)[O-] ZINC000430681046 932871733 /nfs/dbraw/zinc/87/17/33/932871733.db2.gz AWHIIOLEAMSYQS-LLVKDONJSA-N 0 0 366.776 3.952 20 5 FHBDRN CCN(C(=O)Cc1ccc(OC)c([N+](=O)[O-])c1)[C@@H](C)Cc1ccsc1 ZINC000548300670 932889382 /nfs/dbraw/zinc/88/93/82/932889382.db2.gz CVTGPWDISZDZQN-ZDUSSCGKSA-N 0 0 362.451 3.687 20 5 FHBDRN CC(C)c1[nH]nc(C(=O)Nc2cccnc2Oc2ccccc2)c1[N+](=O)[O-] ZINC000610918312 932912024 /nfs/dbraw/zinc/91/20/24/932912024.db2.gz BWGFZGNZLXOFKN-UHFFFAOYSA-N 0 0 367.365 3.881 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])Nc1ccn(-c2ccccc2Cl)n1 ZINC000178229191 932919488 /nfs/dbraw/zinc/91/94/88/932919488.db2.gz SXAJNGZZTBIIIG-UHFFFAOYSA-N 0 0 371.784 3.756 20 5 FHBDRN Cc1cc(C(=O)N2CC[C@@](F)(c3cc(F)cc(F)c3)C2)cc([N+](=O)[O-])c1 ZINC000581899513 932927108 /nfs/dbraw/zinc/92/71/08/932927108.db2.gz WRRNMBAAIJRNJY-SFHVURJKSA-N 0 0 364.323 3.892 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1F)c1ccc2nc(C(F)(F)F)cn2c1 ZINC000471796045 932942437 /nfs/dbraw/zinc/94/24/37/932942437.db2.gz AZHNEHXUCUDPKB-UHFFFAOYSA-N 0 0 368.246 3.653 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(Nc2ccc(OCc3noc(C4CC4)n3)cc2)n1 ZINC000178236602 932945702 /nfs/dbraw/zinc/94/57/02/932945702.db2.gz YUTJKPQPECDUJL-UHFFFAOYSA-N 0 0 367.365 3.881 20 5 FHBDRN CC(=O)Nc1cccc([C@@H](C)NC(=O)/C(C)=C\c2ccc([N+](=O)[O-])cc2)c1 ZINC000588436539 932954183 /nfs/dbraw/zinc/95/41/83/932954183.db2.gz ZJBIDONBTXRMNM-YBEMTRGBSA-N 0 0 367.405 3.834 20 5 FHBDRN Cc1cc(OCC(=O)N2CC[C@H](Cc3ccc(F)cc3)C2)ccc1[N+](=O)[O-] ZINC000430688687 932955410 /nfs/dbraw/zinc/95/54/10/932955410.db2.gz ZFUHLOIKQMTAST-MRXNPFEDSA-N 0 0 372.396 3.512 20 5 FHBDRN COC(=O)/C=C\c1ccc(NC[C@@H](C)c2ncc(C)s2)c([N+](=O)[O-])c1 ZINC000588436669 932958489 /nfs/dbraw/zinc/95/84/89/932958489.db2.gz WVQFQZXDYFUTTF-JPVGGKMYSA-N 0 0 361.423 3.762 20 5 FHBDRN O=[N+]([O-])c1cc(NCCCS(=O)(=O)c2ccccc2)ccc1Cl ZINC000178240663 932964616 /nfs/dbraw/zinc/96/46/16/932964616.db2.gz JCFRPYUJZFPNFQ-UHFFFAOYSA-N 0 0 354.815 3.524 20 5 FHBDRN O=C(Nc1cccc(-n2ccnn2)c1)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000178243039 932965958 /nfs/dbraw/zinc/96/59/58/932965958.db2.gz YLZOOPNFGBZRMG-UHFFFAOYSA-N 0 0 365.374 3.643 20 5 FHBDRN CC(C)CCn1nccc1NC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000548322529 932970105 /nfs/dbraw/zinc/97/01/05/932970105.db2.gz YJQVZTLOUHMEDL-UHFFFAOYSA-N 0 0 359.430 3.894 20 5 FHBDRN CCc1ccc(OS(=O)(=O)c2cc(Cl)ccc2OC)c([N+](=O)[O-])c1 ZINC000785076972 932978239 /nfs/dbraw/zinc/97/82/39/932978239.db2.gz GBSOIAFVHPIIKC-UHFFFAOYSA-N 0 0 371.798 3.587 20 5 FHBDRN CC[C@@H]1c2ccsc2CCN1c1nnc(-c2ccc([N+](=O)[O-])cc2)n1C ZINC000581912083 932996517 /nfs/dbraw/zinc/99/65/17/932996517.db2.gz WIXUPPUFKKNELI-OAHLLOKOSA-N 0 0 369.450 3.966 20 5 FHBDRN COc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)ccc1F ZINC000187540907 932997950 /nfs/dbraw/zinc/99/79/50/932997950.db2.gz FLWDAXGUWIAEKO-UHFFFAOYSA-N 0 0 356.256 3.596 20 5 FHBDRN O=C(Nc1ccccc1Oc1ccccc1)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC000187542962 932998456 /nfs/dbraw/zinc/99/84/56/932998456.db2.gz CDQPECKLWDBOCK-UHFFFAOYSA-N 0 0 351.318 3.740 20 5 FHBDRN CC(C)c1ccc(C(=O)NCc2cc(F)cc3c2OCOC3)cc1[N+](=O)[O-] ZINC000187561895 933002622 /nfs/dbraw/zinc/00/26/22/933002622.db2.gz YUMSYQSDDVKAIT-UHFFFAOYSA-N 0 0 374.368 3.654 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)c1cccc(OC(F)(F)F)c1 ZINC000178291309 933046253 /nfs/dbraw/zinc/04/62/53/933046253.db2.gz RCUGZVAOYMDANO-UHFFFAOYSA-N 0 0 356.256 3.754 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N(CC(F)(F)F)c1ccccn1 ZINC000588437565 933052619 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FHBDRN O=C(Nc1ccc([N+](=O)[O-])c2ncccc12)c1csc(C(F)(F)F)n1 ZINC000430707911 933160060 /nfs/dbraw/zinc/16/00/60/933160060.db2.gz QYTUZWGMVAGZDW-UHFFFAOYSA-N 0 0 368.296 3.871 20 5 FHBDRN CC(C)(C)c1ncc(CN2CCN(c3cccc([N+](=O)[O-])c3)CC2)s1 ZINC000510524446 933179470 /nfs/dbraw/zinc/17/94/70/933179470.db2.gz PCKZZMPIKXUCNQ-UHFFFAOYSA-N 0 0 360.483 3.671 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc3nc(C)oc3c2)cc1OC ZINC000127347195 933180283 /nfs/dbraw/zinc/18/02/83/933180283.db2.gz GFRCAIJTYZLICV-UHFFFAOYSA-N 0 0 371.349 3.704 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)NCC[C@H]2CCCC[C@H]2C)cc1OC ZINC000510547249 933211191 /nfs/dbraw/zinc/21/11/91/933211191.db2.gz OKAYIQAWFHCHSB-ZIAGYGMSSA-N 0 0 364.442 3.948 20 5 FHBDRN COC(=O)c1ccc(Oc2ccc([N+](=O)[O-])c3cnccc23)cc1OC ZINC000477712291 933224169 /nfs/dbraw/zinc/22/41/69/933224169.db2.gz APNUVERDMFNOBM-UHFFFAOYSA-N 0 0 354.318 3.731 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N([C@@H](C)c1ccccc1)C1CC1 ZINC000510560727 933226740 /nfs/dbraw/zinc/22/67/40/933226740.db2.gz SMGFAHBDQNTLMQ-AWEZNQCLSA-N 0 0 360.435 3.818 20 5 FHBDRN C[C@@H](c1ccccc1)N(C1CC1)S(=O)(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000510562083 933227345 /nfs/dbraw/zinc/22/73/45/933227345.db2.gz ZETKIOXIYNHZGX-LBPRGKRZSA-N 0 0 364.398 3.648 20 5 FHBDRN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1C[C@H](C)O[C@]2(CCO[C@@H](C)C2)C1 ZINC000430780866 933233364 /nfs/dbraw/zinc/23/33/64/933233364.db2.gz PPTJTRAFSDEPFE-XHUQVCHSSA-N 0 0 360.454 3.657 20 5 FHBDRN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1C[C@H](C)O[C@]2(CCO[C@@H](C)C2)C1 ZINC000430780864 933233620 /nfs/dbraw/zinc/23/36/20/933233620.db2.gz PPTJTRAFSDEPFE-MKSDAICUSA-N 0 0 360.454 3.657 20 5 FHBDRN COc1cc(NC[C@@](C)(Cc2ccccc2)[C@H](C)O)c([N+](=O)[O-])cc1F ZINC000477719882 933240170 /nfs/dbraw/zinc/24/01/70/933240170.db2.gz QKJWRGJDPKMRSS-ORAYPTAESA-N 0 0 362.401 3.784 20 5 FHBDRN C[C@H]1[C@@H](c2ccccc2)[C@H]1C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000430801447 933248581 /nfs/dbraw/zinc/24/85/81/933248581.db2.gz CHVYLCPAOKHWQI-IGNZVWTISA-N 0 0 358.825 3.957 20 5 FHBDRN Cc1cc(OCC(=O)N(CC(F)F)c2ccc(F)cc2)ccc1[N+](=O)[O-] ZINC000430803304 933249822 /nfs/dbraw/zinc/24/98/22/933249822.db2.gz SDHNXASHOAOCGE-UHFFFAOYSA-N 0 0 368.311 3.719 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1CN(C)Cc1nc(-c2cccs2)no1 ZINC000510587992 933251311 /nfs/dbraw/zinc/25/13/11/933251311.db2.gz APVZWVNZQMLYHV-UHFFFAOYSA-N 0 0 374.422 3.737 20 5 FHBDRN Cc1cc(OCC(=O)Nc2ncccc2-c2ccccc2)ccc1[N+](=O)[O-] ZINC000430815118 933256451 /nfs/dbraw/zinc/25/64/51/933256451.db2.gz LSJCLLMTHDGFRT-UHFFFAOYSA-N 0 0 363.373 3.983 20 5 FHBDRN O=C1N[C@@H](C[C@@H]2CCCc3ccccc32)C(=O)N1c1cccc([N+](=O)[O-])c1 ZINC000430911452 933396609 /nfs/dbraw/zinc/39/66/09/933396609.db2.gz CFWHUQLIRLTZKL-KSSFIOAISA-N 0 0 365.389 3.530 20 5 FHBDRN C[C@@H](Nc1ccc(NC(=O)c2c([N+](=O)[O-])cnn2C)cc1)c1ccccc1 ZINC000165941636 933412663 /nfs/dbraw/zinc/41/26/63/933412663.db2.gz DYPCJPDUTQSEAH-CYBMUJFWSA-N 0 0 365.393 3.754 20 5 FHBDRN O=C(N[C@H]1C[C@@H]1c1cccc(F)c1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000178344661 933439150 /nfs/dbraw/zinc/43/91/50/933439150.db2.gz SYGSJTYFQJZQCV-MOPGFXCFSA-N 0 0 369.396 3.964 20 5 FHBDRN COc1ccc(C)cc1CNC(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000610592304 933446812 /nfs/dbraw/zinc/44/68/12/933446812.db2.gz UVAZDOACIKGLKB-AWEZNQCLSA-N 0 0 357.410 3.781 20 5 FHBDRN CCc1ccc(C(=O)NCCCOCc2ccc(OC)cc2)cc1[N+](=O)[O-] ZINC000471882321 933466992 /nfs/dbraw/zinc/46/69/92/933466992.db2.gz HPHWIQBXIDRMHM-UHFFFAOYSA-N 0 0 372.421 3.503 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)N2CCOc3ccccc3C2)cc1[N+](=O)[O-] ZINC000610597082 933482385 /nfs/dbraw/zinc/48/23/85/933482385.db2.gz DQDUCGVKGDELAQ-AWEZNQCLSA-N 0 0 355.394 3.568 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H](C(F)(F)F)[C@H](C(F)(F)F)C1 ZINC000610598262 933495013 /nfs/dbraw/zinc/49/50/13/933495013.db2.gz ZSPJIMQPTWYFLI-GHMZBOCLSA-N 0 0 370.249 3.716 20 5 FHBDRN CC(C)Oc1ncccc1CNC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000610639813 933588707 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FHBDRN CCc1ccc(C(=O)N2CCN(Cc3ccccc3)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000471910753 933675281 /nfs/dbraw/zinc/67/52/81/933675281.db2.gz JGWWPLDKUGNONZ-INIZCTEOSA-N 0 0 367.449 3.504 20 5 FHBDRN O=C(COc1cccc([N+](=O)[O-])c1)N1CCCCC[C@H]1[C@H]1CCCCC1=O ZINC000610664410 933681777 /nfs/dbraw/zinc/68/17/77/933681777.db2.gz IHYFXOOROCDGKT-MSOLQXFVSA-N 0 0 374.437 3.504 20 5 FHBDRN CN(CCCOCc1ccccc1)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000510768759 933689360 /nfs/dbraw/zinc/68/93/60/933689360.db2.gz ZKKUPTQTJSGUBB-UHFFFAOYSA-N 0 0 350.365 3.912 20 5 FHBDRN CCc1ccc(C(=O)Nc2nc3cc(Cl)ccc3n2C)cc1[N+](=O)[O-] ZINC000471913574 933701196 /nfs/dbraw/zinc/70/11/96/933701196.db2.gz WVFUUFUPFQMWRK-UHFFFAOYSA-N 0 0 358.785 3.950 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1C(F)(F)F)c1ccc2c(c1)CCO2 ZINC000060823452 933706595 /nfs/dbraw/zinc/70/65/95/933706595.db2.gz CEBYICCJEILSLV-UHFFFAOYSA-N 0 0 367.279 3.810 20 5 FHBDRN Cn1cc(Oc2ccccc2C(=O)Nc2cc(F)cc([N+](=O)[O-])c2)cn1 ZINC000510779495 933715845 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FHBDRN CC(C)Oc1ccc(CNC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000510853214 933856862 /nfs/dbraw/zinc/85/68/62/933856862.db2.gz MIOQFENRDNFTMU-UHFFFAOYSA-N 0 0 371.437 3.766 20 5 FHBDRN O=C(C[C@@H]1CC[C@H](C2CC2)O1)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC001266937736 933863985 /nfs/dbraw/zinc/86/39/85/933863985.db2.gz AQWOAYDTKJVSQX-SMDDNHRTSA-N 0 0 369.215 3.644 20 5 FHBDRN CNC(=O)c1cc([N+](=O)[O-])ccc1NCCCO[C@@H](C)c1ccccc1 ZINC000510848914 933864631 /nfs/dbraw/zinc/86/46/31/933864631.db2.gz CSFBCAPHOOIBHQ-AWEZNQCLSA-N 0 0 357.410 3.534 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)N1CCc2ccc(C(C)(C)C)cc2C1 ZINC000510850497 933864729 /nfs/dbraw/zinc/86/47/29/933864729.db2.gz HPOYYWKFVXTMJA-UHFFFAOYSA-N 0 0 353.422 3.794 20 5 FHBDRN O=C(Nc1ccc2c(c1)COC2)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000091670812 933871937 /nfs/dbraw/zinc/87/19/37/933871937.db2.gz SAIOZSZJGPWQIT-UHFFFAOYSA-N 0 0 363.167 3.640 20 5 FHBDRN Nc1c(C(=O)Nc2ncc(Cc3ccccc3F)s2)cccc1[N+](=O)[O-] ZINC000176053275 933911612 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3.503 20 5 FHBDRN Cc1c(NC(=O)C2C[C@@H](C)O[C@H](C)C2)cc(Br)cc1[N+](=O)[O-] ZINC000431182998 934052620 /nfs/dbraw/zinc/05/26/20/934052620.db2.gz WFDKCBJSHXYDCV-RKDXNWHRSA-N 0 0 371.231 3.808 20 5 FHBDRN CC[C@@H](C)[C@H](OC)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000431182709 934055017 /nfs/dbraw/zinc/05/50/17/934055017.db2.gz VPCGYSPMZKBZIP-OQPBUACISA-N 0 0 359.220 3.665 20 5 FHBDRN COC(=O)c1cc(C(=O)N(CC2CCCCC2)C2CC2)cc([N+](=O)[O-])c1 ZINC000055825931 934090567 /nfs/dbraw/zinc/09/05/67/934090567.db2.gz UPGIDADLUWLOJP-UHFFFAOYSA-N 0 0 360.410 3.566 20 5 FHBDRN CCOCc1ccc(NC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)cc1 ZINC000134785322 934103351 /nfs/dbraw/zinc/10/33/51/934103351.db2.gz NYRBUXLILSVMOY-UHFFFAOYSA-N 0 0 366.377 3.569 20 5 FHBDRN O=C(Nc1ccc(F)cc1)c1ccc(CNc2cccnc2[N+](=O)[O-])cc1 ZINC000610755894 934107355 /nfs/dbraw/zinc/10/73/55/934107355.db2.gz LVKKPXJBHAIODJ-UHFFFAOYSA-N 0 0 366.352 3.993 20 5 FHBDRN C[C@@H]1CCCN(c2ccc(C(=O)N[C@@H]3CCC(F)(F)C3)cc2[N+](=O)[O-])C1 ZINC000610791229 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367.405 3.974 20 5 FHBDRN Cc1nn(CCC(=O)N(C)[C@@H]2CCC[C@H]2c2ccccc2)c(C)c1[N+](=O)[O-] ZINC000458093858 934292935 /nfs/dbraw/zinc/29/29/35/934292935.db2.gz QPUGJLKIAYSKEK-ZWKOTPCHSA-N 0 0 370.453 3.593 20 5 FHBDRN Cc1nn(Cc2ccc(C(=O)N[C@@H]3C[C@@]3(C)C(C)C)cc2)c(C)c1[N+](=O)[O-] ZINC000458148543 934321914 /nfs/dbraw/zinc/32/19/14/934321914.db2.gz OSBKYVUAXUAKRV-XLIONFOSSA-N 0 0 370.453 3.621 20 5 FHBDRN O=C(NC1CCC(C(F)F)CC1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000458140132 934328206 /nfs/dbraw/zinc/32/82/06/934328206.db2.gz BNNJWZVDNRBFRY-UHFFFAOYSA-N 0 0 364.295 3.750 20 5 FHBDRN COc1ccnc2c(NC(=O)Cc3ccc([N+](=O)[O-])cc3Cl)cccc12 ZINC000535769193 934359435 /nfs/dbraw/zinc/35/94/35/934359435.db2.gz KQMKJEHJAOLUQD-UHFFFAOYSA-N 0 0 371.780 3.986 20 5 FHBDRN C[C@@H]1c2ccc(F)cc2C[C@H](C)N1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000535793854 934387335 /nfs/dbraw/zinc/38/73/35/934387335.db2.gz XKAQGGQKQBSIBD-UONOGXRCSA-N 0 0 371.412 3.705 20 5 FHBDRN O=C(NC[C@@H](c1ccccc1)C(F)(F)F)c1ccc(F)cc1[N+](=O)[O-] ZINC000187675947 934425916 /nfs/dbraw/zinc/42/59/16/934425916.db2.gz UQSSQDQTTNYFDA-ZDUSSCGKSA-N 0 0 356.275 3.810 20 5 FHBDRN COc1cc(CN2Cc3ccccc3C3(CC3)C2)c([N+](=O)[O-])cc1OC ZINC000187677735 934425949 /nfs/dbraw/zinc/42/59/49/934425949.db2.gz XDNSHHMPQHLHMH-UHFFFAOYSA-N 0 0 354.406 3.659 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2Cc3ccc(Cl)cc3C2)c1 ZINC000458248418 934445002 /nfs/dbraw/zinc/44/50/02/934445002.db2.gz ISTWAPIVOSUOAH-UHFFFAOYSA-N 0 0 360.797 3.868 20 5 FHBDRN Cc1cc(C(=O)N(Cc2ccc(F)cc2)C2CCOCC2)cc([N+](=O)[O-])c1 ZINC000277044050 934464731 /nfs/dbraw/zinc/46/47/31/934464731.db2.gz HMMBYAYIQHQPRP-UHFFFAOYSA-N 0 0 372.396 3.864 20 5 FHBDRN O=[N+]([O-])c1ccn(CCSc2nc(-c3ccc(F)cc3)cs2)n1 ZINC000178447335 934477446 /nfs/dbraw/zinc/47/74/46/934477446.db2.gz GDTDBNPZQBHNCT-UHFFFAOYSA-N 0 0 350.400 3.846 20 5 FHBDRN C[C@@H]1c2ccc(F)cc2C[C@H](C)N1C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000535819043 934479395 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0 0 353.216 3.584 20 5 FHBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1C2CCCC1CCC2 ZINC000610906226 934611139 /nfs/dbraw/zinc/61/11/39/934611139.db2.gz BFJBZKHMYRJLSM-UHFFFAOYSA-N 0 0 353.216 3.905 20 5 FHBDRN COC(=O)CCN(Cc1ccccc1)c1ccc([N+](=O)[O-])c2cnccc21 ZINC000610909935 934613734 /nfs/dbraw/zinc/61/37/34/934613734.db2.gz QJHRBRBQOUARFK-UHFFFAOYSA-N 0 0 365.389 3.713 20 5 FHBDRN O=[N+]([O-])c1ncccc1N1CCC[C@H](c2nc(C(F)(F)F)cs2)C1 ZINC000610929898 934626198 /nfs/dbraw/zinc/62/61/98/934626198.db2.gz RTVHZCBPACISNR-VIFPVBQESA-N 0 0 358.345 3.849 20 5 FHBDRN O=[N+]([O-])c1cnccc1N1CCC[C@@H](c2nc(C(F)(F)F)cs2)C1 ZINC000610929856 934626469 /nfs/dbraw/zinc/62/64/69/934626469.db2.gz KCXZETCEGGSWDF-SECBINFHSA-N 0 0 358.345 3.849 20 5 FHBDRN Cc1sc(C(=O)NC[C@H]2CCCO[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000145700695 934639768 /nfs/dbraw/zinc/63/97/68/934639768.db2.gz PXXYDWWMUHZEND-PBHICJAKSA-N 0 0 360.435 3.862 20 5 FHBDRN C[C@@H](CNC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)c1ccncc1 ZINC000610960542 934658341 /nfs/dbraw/zinc/65/83/41/934658341.db2.gz NYKYFCSAORHBHE-JTQLQIEISA-N 0 0 353.300 3.542 20 5 FHBDRN O=C(CCOc1cccc(F)c1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000610961836 934658480 /nfs/dbraw/zinc/65/84/80/934658480.db2.gz RDPONXOTOLNEQH-UHFFFAOYSA-N 0 0 358.369 3.694 20 5 FHBDRN C[C@H](NS(=O)(=O)/C=C\c1cccc(Cl)c1)c1cccc([N+](=O)[O-])c1 ZINC000588480973 934660196 /nfs/dbraw/zinc/66/01/96/934660196.db2.gz GXTKVGPBYYKBPW-LAUAKBEESA-N 0 0 366.826 3.900 20 5 FHBDRN C[C@]1(c2ccccc2)C[C@@H]1NC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000610964164 934662723 /nfs/dbraw/zinc/66/27/23/934662723.db2.gz OCIXERKKFVJLJG-PZJWPPBQSA-N 0 0 365.433 3.999 20 5 FHBDRN COc1cc(Cl)c(C(=O)COc2ccc(C)c([N+](=O)[O-])c2)cc1OC ZINC000535890988 934719153 /nfs/dbraw/zinc/71/91/53/934719153.db2.gz GAFRSECMWWIQKR-UHFFFAOYSA-N 0 0 365.769 3.836 20 5 FHBDRN Cn1nc(CC(C)(C)C)cc1NC(=O)c1cccc(Cl)c1[N+](=O)[O-] ZINC000176324263 934747948 /nfs/dbraw/zinc/74/79/48/934747948.db2.gz HICNJTVHGXZODU-UHFFFAOYSA-N 0 0 350.806 3.823 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FHBDRN COc1cc(C(=O)NC2CCC3(CC3)CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000277300008 934909279 /nfs/dbraw/zinc/90/92/79/934909279.db2.gz BNAWZDKJUNNVKN-UHFFFAOYSA-N 0 0 370.352 3.657 20 5 FHBDRN C[C@@H]1CCC[C@@H](OC(=O)c2ccc(Cn3cc([N+](=O)[O-])cn3)cc2)[C@@H]1C ZINC001267053597 934936112 /nfs/dbraw/zinc/93/61/12/934936112.db2.gz UEQHMWPJUQJUOQ-HBUWYVDXSA-N 0 0 357.410 3.821 20 5 FHBDRN O=C(c1cc2cccc([N+](=O)[O-])c2[nH]1)N1CCC(Cc2cccnc2)CC1 ZINC000538893922 934941051 /nfs/dbraw/zinc/94/10/51/934941051.db2.gz QBFIPTOIACIZFK-UHFFFAOYSA-N 0 0 364.405 3.566 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)cc(-c2nc(-c3cccc(-n4cccn4)n3)no2)c1 ZINC000545022700 934941138 /nfs/dbraw/zinc/94/11/38/934941138.db2.gz YZJARHJKUJCIHU-UHFFFAOYSA-N 0 0 368.740 3.546 20 5 FHBDRN O=[N+]([O-])c1c[nH]c(-c2nc(CCc3ccccc3Br)no2)c1 ZINC000545024876 934953282 /nfs/dbraw/zinc/95/32/82/934953282.db2.gz LBQKQRZQEWTFTH-UHFFFAOYSA-N 0 0 363.171 3.521 20 5 FHBDRN O=C(Cc1ccc2c(c1)CCC2)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000178506680 934965111 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CC(C)(C)N(Cc1ccccc1)C(=O)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000140499591 945089008 /nfs/dbraw/zinc/08/90/08/945089008.db2.gz XWEAPJLKDPKQHF-UHFFFAOYSA-N 0 0 366.421 3.772 20 5 FHBDRN Cc1ccc(CN2CCC[C@H]2c2nc3c(n2C)CCCC3)cc1[N+](=O)[O-] ZINC000548676895 935274215 /nfs/dbraw/zinc/27/42/15/935274215.db2.gz UBHBTYXYJIHZLE-SFHVURJKSA-N 0 0 354.454 3.853 20 5 FHBDRN C/C(=C/C(=O)NCc1cn2cc(Cl)ccc2n1)c1ccc([N+](=O)[O-])cc1 ZINC000785116775 935277716 /nfs/dbraw/zinc/27/77/16/935277716.db2.gz MKCUACNVUIAGTE-WQLSENKSSA-N 0 0 370.796 3.616 20 5 FHBDRN COC(=O)[C@H](C)[C@@H](NC(=O)Nc1ccc(C)c([N+](=O)[O-])c1)c1ccccc1 ZINC000119846563 935280086 /nfs/dbraw/zinc/28/00/86/935280086.db2.gz MUCPICBSFCNOED-CXAGYDPISA-N 0 0 371.393 3.575 20 5 FHBDRN COc1ccc(-c2cnc(CN(C)CCc3ccccc3[N+](=O)[O-])o2)cc1 ZINC000511076920 935280998 /nfs/dbraw/zinc/28/09/98/935280998.db2.gz ZYTRITFFGLSEIC-UHFFFAOYSA-N 0 0 367.405 3.933 20 5 FHBDRN COc1ccc([C@H](NC(=O)c2ccc([N+](=O)[O-])cc2OC)C(C)C)cc1 ZINC000427116283 945090267 /nfs/dbraw/zinc/09/02/67/945090267.db2.gz FUIOHCDYYSNIHJ-GOSISDBHSA-N 0 0 358.394 3.739 20 5 FHBDRN CSc1ccc(NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)cn1 ZINC000072088860 935295495 /nfs/dbraw/zinc/29/54/95/935295495.db2.gz LTQOIQLGEAZXJJ-UHFFFAOYSA-N 0 0 358.423 3.564 20 5 FHBDRN Cc1ccc(Br)cc1CNC(=O)c1ccc(C)c([N+](=O)[O-])c1 ZINC001279569529 935300471 /nfs/dbraw/zinc/30/04/71/935300471.db2.gz UWUMFYMLBAOZLL-UHFFFAOYSA-N 0 0 363.211 3.904 20 5 FHBDRN CN(Cc1ccc(O)cc1)C(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000551545741 935305265 /nfs/dbraw/zinc/30/52/65/935305265.db2.gz ZWHTWCSDJMOKNI-UHFFFAOYSA-N 0 0 354.284 3.591 20 5 FHBDRN O=c1c2ccc([N+](=O)[O-])cc2ncn1Cc1ccc(Cl)cc1Cl ZINC000072105676 935309067 /nfs/dbraw/zinc/30/90/67/935309067.db2.gz OOAXLZMSVJRZKG-UHFFFAOYSA-N 0 0 350.161 3.660 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2ncn(Cc3cc(-c4ccc(F)cc4)no3)n2)c1 ZINC000551625217 935322370 /nfs/dbraw/zinc/32/23/70/935322370.db2.gz FGAXJEKTGGPDKL-UHFFFAOYSA-N 0 0 365.324 3.696 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)Nc2c(C)cnc3c(OC)cccc32)c1 ZINC000551652294 935325067 /nfs/dbraw/zinc/32/50/67/935325067.db2.gz HLVBDCBNAZPTMC-UHFFFAOYSA-N 0 0 367.361 3.721 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)Nc1ccc(F)c(Br)c1 ZINC000437193060 945092800 /nfs/dbraw/zinc/09/28/00/945092800.db2.gz FANAREODKNRIFN-UHFFFAOYSA-N 0 0 369.146 3.514 20 5 FHBDRN COc1ccc(CCNC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000119927575 935338046 /nfs/dbraw/zinc/33/80/46/935338046.db2.gz NRELGADFQLLEKA-UHFFFAOYSA-N 0 0 369.421 3.520 20 5 FHBDRN C[C@H]1SCCN(C(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@H]1C ZINC000118283608 935338965 /nfs/dbraw/zinc/33/89/65/935338965.db2.gz QHLQNDXWNQWWRE-WDEREUQCSA-N 0 0 363.464 3.684 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)c1cccc2ccc(=O)[nH]c21 ZINC000582144259 935341227 /nfs/dbraw/zinc/34/12/27/935341227.db2.gz DQKLFVLRKKPSPN-UHFFFAOYSA-N 0 0 365.389 3.899 20 5 FHBDRN CCN(c1ccc2[nH]ccc2c1)S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-] ZINC000472185165 935348426 /nfs/dbraw/zinc/34/84/26/935348426.db2.gz AVQJSVLYNDDRPB-UHFFFAOYSA-N 0 0 373.434 3.908 20 5 FHBDRN CC1(C)[C@H](C(F)(F)F)CCN1C(=O)c1cc(F)c([N+](=O)[O-])cc1F ZINC000276156582 935348668 /nfs/dbraw/zinc/34/86/68/935348668.db2.gz DWANMQAJHOAJRU-LLVKDONJSA-N 0 0 352.259 3.676 20 5 FHBDRN O=C(NCCCc1ccccc1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000119956345 935361445 /nfs/dbraw/zinc/36/14/45/935361445.db2.gz KNFVLNCPQHTXFF-UHFFFAOYSA-N 0 0 353.422 3.902 20 5 FHBDRN CCO[C@@H]1C[C@@H](N(C)C(=O)c2ccc([N+](=O)[O-])c(Cl)c2)C12CCC2 ZINC000161170003 935362794 /nfs/dbraw/zinc/36/27/94/935362794.db2.gz BGIDLRJREZFLFS-HUUCEWRRSA-N 0 0 352.818 3.668 20 5 FHBDRN CCC1(CNC(=O)c2cc(F)cc3c(=O)c4cc(F)ccc4[nH]c23)CC1 ZINC000548698813 935365883 /nfs/dbraw/zinc/36/58/83/935365883.db2.gz NNAUOIUEIBJRRJ-UHFFFAOYSA-N 0 0 356.372 3.880 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)NCCc1cccc(-c2ccccc2)c1 ZINC000472188713 935373563 /nfs/dbraw/zinc/37/35/63/935373563.db2.gz FBGDTKLWCPVFQM-UHFFFAOYSA-N 0 0 361.401 3.938 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])Cc1nnc(-c2cccc(Cl)c2)o1 ZINC000511089927 935374473 /nfs/dbraw/zinc/37/44/73/935374473.db2.gz HOYZFAFIMPAVIK-UHFFFAOYSA-N 0 0 372.812 3.973 20 5 FHBDRN CC(C)C1CCC(N2CCN(C(=O)c3ccc([N+](=O)[O-])s3)CC2)CC1 ZINC000513183491 935375740 /nfs/dbraw/zinc/37/57/40/935375740.db2.gz LCOUBGKSSSDVOU-UHFFFAOYSA-N 0 0 365.499 3.629 20 5 FHBDRN Cc1c(NC(=O)N(C)C[C@@H]2OCCc3ccccc32)cccc1[N+](=O)[O-] ZINC000263664348 935383061 /nfs/dbraw/zinc/38/30/61/935383061.db2.gz FQYJZCQDKKORSJ-SFHVURJKSA-N 0 0 355.394 3.681 20 5 FHBDRN CC(C)(C)c1nnc(CNc2cc(C(F)(F)F)ncc2[N+](=O)[O-])s1 ZINC000277510823 935388481 /nfs/dbraw/zinc/38/84/81/935388481.db2.gz ACVGAVCYWPWTGX-UHFFFAOYSA-N 0 0 361.349 3.770 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN(Cc1ccco1)Cc1ccco1 ZINC000119991033 935409307 /nfs/dbraw/zinc/40/93/07/935409307.db2.gz RNVDZQWYAALYBT-UHFFFAOYSA-N 0 0 369.377 3.730 20 5 FHBDRN Cc1c(C[S@@](C)=O)cccc1NC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000582215476 935409793 /nfs/dbraw/zinc/40/97/93/935409793.db2.gz AAJRFDHIPFBXSX-ZJWNCGCPSA-N 0 0 360.435 3.524 20 5 FHBDRN Cc1cccc2c1CC[C@H]2Nc1cc(CN2CCOCC2)ccc1[N+](=O)[O-] ZINC000582221364 935416176 /nfs/dbraw/zinc/41/61/76/935416176.db2.gz YQNQAKWGPNUBHS-LJQANCHMSA-N 0 0 367.449 3.835 20 5 FHBDRN O=C(Nc1cc(C(F)(F)F)ccc1N1CCCC1)c1cc([N+](=O)[O-])c[nH]1 ZINC000051528208 935431737 /nfs/dbraw/zinc/43/17/37/935431737.db2.gz RQCAVMSLJMDPNC-UHFFFAOYSA-N 0 0 368.315 3.794 20 5 FHBDRN O=[N+]([O-])c1nn(CC2CCC(C(F)(F)F)CC2)cc1Br ZINC000472206300 935471584 /nfs/dbraw/zinc/47/15/84/935471584.db2.gz IOLMAJZQELVBBS-UHFFFAOYSA-N 0 0 356.142 3.923 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1OCc1noc(-c2ccc(F)cc2F)n1 ZINC000187727993 935478609 /nfs/dbraw/zinc/47/86/09/935478609.db2.gz RPPOBYOPRYFVBD-UHFFFAOYSA-N 0 0 363.276 3.511 20 5 FHBDRN Cc1ccc(C(C)(C)CNC(=O)c2cc([N+](=O)[O-])ccc2N(C)C)cc1 ZINC000728484913 935485170 /nfs/dbraw/zinc/48/51/70/935485170.db2.gz PCGXQGZSSFXZDO-UHFFFAOYSA-N 0 0 355.438 3.677 20 5 FHBDRN COc1ccccc1[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000158289145 935487710 /nfs/dbraw/zinc/48/77/10/935487710.db2.gz VBAFMLAVHKIGPK-CYBMUJFWSA-N 0 0 360.797 3.887 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc2c(c1)CN(C)C(=O)N2 ZINC000588511007 935496306 /nfs/dbraw/zinc/49/63/06/935496306.db2.gz PYSDHSLZGHLKRR-XFXZXTDPSA-N 0 0 366.377 3.614 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(NC[C@@H](c2ccccc2)C(F)(F)F)n1 ZINC000516657346 945104578 /nfs/dbraw/zinc/10/45/78/945104578.db2.gz YCCJOLJMZLWNFT-NSHDSACASA-N 0 0 369.299 3.534 20 5 FHBDRN Cc1ccc(NC(=O)NCc2cccc(OC(F)F)c2)cc1[N+](=O)[O-] ZINC000051582503 935501528 /nfs/dbraw/zinc/50/15/28/935501528.db2.gz LWLPNSJLFDBASD-UHFFFAOYSA-N 0 0 351.309 3.826 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)NCCc1c[nH]c2cc(F)ccc12 ZINC000051582555 935502067 /nfs/dbraw/zinc/50/20/67/935502067.db2.gz WXIHJVDMNLAGOW-UHFFFAOYSA-N 0 0 356.357 3.888 20 5 FHBDRN Cc1cccc(C(C)C)c1NC(=O)Cc1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000467106875 935521744 /nfs/dbraw/zinc/52/17/44/935521744.db2.gz WRRBJSBSARHYML-UHFFFAOYSA-N 0 0 370.405 3.979 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N[C@H](C)c1ccc2c(c1)CC(=O)N2 ZINC000120063997 935526289 /nfs/dbraw/zinc/52/62/89/935526289.db2.gz CSYHMDNGAXQTTA-GFCCVEGCSA-N 0 0 368.393 3.589 20 5 FHBDRN Cc1ccc(C(C)(C)CNC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2C)cc1 ZINC000728485578 935535708 /nfs/dbraw/zinc/53/57/08/935535708.db2.gz VOYNTEAGAXFAHV-UHFFFAOYSA-N 0 0 371.393 3.827 20 5 FHBDRN C[C@H]1CCCN(c2ccc(C(=O)Nc3ccc(F)nc3)cc2[N+](=O)[O-])C1 ZINC000135035006 935541947 /nfs/dbraw/zinc/54/19/47/935541947.db2.gz GEOVMESFFRVOJK-LBPRGKRZSA-N 0 0 358.373 3.618 20 5 FHBDRN CCC[C@H](NC(=O)c1cc([N+](=O)[O-])nn1C)c1ccc(Cl)c(Cl)c1 ZINC000478062290 935557886 /nfs/dbraw/zinc/55/78/86/935557886.db2.gz NXYMICNTUGMPEX-LBPRGKRZSA-N 0 0 371.224 3.906 20 5 FHBDRN Cc1cc2sc(NC(=O)COc3ccc([N+](=O)[O-])cc3)nc2cc1F ZINC000478079763 935565036 /nfs/dbraw/zinc/56/50/36/935565036.db2.gz ILEJAMUDTCXEEV-UHFFFAOYSA-N 0 0 361.354 3.670 20 5 FHBDRN O=[N+]([O-])c1ccc(NC[C@H]2CC[C@@H](c3nc(C4CC4)no3)O2)c(Cl)c1 ZINC000431387680 935568055 /nfs/dbraw/zinc/56/80/55/935568055.db2.gz SNPNGUBNCCKKDX-RISCZKNCSA-N 0 0 364.789 3.841 20 5 FHBDRN COc1cc(C(=O)N[C@H](C)c2c(F)cccc2F)cc([N+](=O)[O-])c1C ZINC000478096647 935569581 /nfs/dbraw/zinc/56/95/81/935569581.db2.gz NNOFZJMVZXDYJZ-SNVBAGLBSA-N 0 0 350.321 3.681 20 5 FHBDRN O=[N+]([O-])c1cc(CN2CCO[C@@H](c3cccc(OC(F)F)c3)C2)cs1 ZINC000127467437 935570423 /nfs/dbraw/zinc/57/04/23/935570423.db2.gz LJEUXIAUXKFDFX-CQSZACIVSA-N 0 0 370.377 3.831 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N(C)[C@H](C)Cc1ccc(O)cc1 ZINC000439935398 945109220 /nfs/dbraw/zinc/10/92/20/945109220.db2.gz UOTFADZOSWINPK-CYBMUJFWSA-N 0 0 373.409 3.794 20 5 FHBDRN CC(C)CCSc1ccc(C(=O)N2CCC[C@](C)(O)C2)cc1[N+](=O)[O-] ZINC000152409989 935571805 /nfs/dbraw/zinc/57/18/05/935571805.db2.gz KUFLFHHZJJEOOP-SFHVURJKSA-N 0 0 366.483 3.720 20 5 FHBDRN CC(C)(C)c1ccc(OCC(=O)N2CCc3cc([N+](=O)[O-])ccc32)cc1 ZINC000478109253 935573991 /nfs/dbraw/zinc/57/39/91/935573991.db2.gz IWTNIGBNDBLARX-UHFFFAOYSA-N 0 0 354.406 3.860 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1Cc2ccccc2OC[C@@H]1C ZINC000439936481 945109970 /nfs/dbraw/zinc/10/99/70/945109970.db2.gz XFDYFQLWLLVDHP-ZDUSSCGKSA-N 0 0 371.393 3.809 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N(C)[C@@H](C)Cc1ccc(O)cc1 ZINC000120085010 935578684 /nfs/dbraw/zinc/57/86/84/935578684.db2.gz FLLTUOHFABZHDZ-KBPBESRZSA-N 0 0 374.462 3.871 20 5 FHBDRN Cc1nn(Cc2ccc(C(=O)NC[C@@H]3CC[C@@H](C)C3)cc2)c(C)c1[N+](=O)[O-] ZINC000478159280 935581299 /nfs/dbraw/zinc/58/12/99/935581299.db2.gz RZFMZLNWEUCDCU-CXAGYDPISA-N 0 0 370.453 3.622 20 5 FHBDRN CC(C)[C@@H]1CN(C(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])CCS1 ZINC000437202734 945114622 /nfs/dbraw/zinc/11/46/22/945114622.db2.gz XLKWYQLXABETGR-ABAIWWIYSA-N 0 0 372.874 3.616 20 5 FHBDRN Cc1ccc(C(=O)N[C@@H](C(=O)OC(C)(C)C)c2ccccc2)cc1[N+](=O)[O-] ZINC000478161624 935581392 /nfs/dbraw/zinc/58/13/92/935581392.db2.gz DSMFFEZGGBPIHH-QGZVFWFLSA-N 0 0 370.405 3.716 20 5 FHBDRN O=C(Nc1ccc(-n2cccn2)c(Cl)c1)c1ccc(F)cc1[N+](=O)[O-] ZINC000127499654 935583649 /nfs/dbraw/zinc/58/36/49/935583649.db2.gz POBZPJBGDSDKLX-UHFFFAOYSA-N 0 0 360.732 3.825 20 5 FHBDRN Cc1cc(C(=O)N[C@@H]2C[C@H]2c2ccc(OC(F)F)cc2)ccc1[N+](=O)[O-] ZINC000478190775 935585673 /nfs/dbraw/zinc/58/56/73/935585673.db2.gz DMOISOHSSYZDDK-LSDHHAIUSA-N 0 0 362.332 3.791 20 5 FHBDRN CN(C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)[C@H]1CCC(C)(C)C1 ZINC000478210616 935592399 /nfs/dbraw/zinc/59/23/99/935592399.db2.gz KJXHFIURZMYOAV-INIZCTEOSA-N 0 0 359.470 3.848 20 5 FHBDRN CCc1nc2c(s1)[C@@H](N(C)C(=O)c1cc(F)cc([N+](=O)[O-])c1)CCC2 ZINC000478292748 935608141 /nfs/dbraw/zinc/60/81/41/935608141.db2.gz PXNLNHYIMJFDNX-AWEZNQCLSA-N 0 0 363.414 3.902 20 5 FHBDRN C[C@@H](NC(=O)/C=C\c1ccc([N+](=O)[O-])cc1)c1ccc(-n2cccn2)cc1 ZINC000255503381 935608151 /nfs/dbraw/zinc/60/81/51/935608151.db2.gz GFPDDQGGSTXKFA-HYMFSAHRSA-N 0 0 362.389 3.671 20 5 FHBDRN CN(C(=O)c1ccc(Br)cc1F)c1cccc([N+](=O)[O-])c1 ZINC000158190013 935616943 /nfs/dbraw/zinc/61/69/43/935616943.db2.gz RGJOJRLDOSQZKS-UHFFFAOYSA-N 0 0 353.147 3.773 20 5 FHBDRN CCS(=O)(=O)c1c(Cl)cccc1/C=C/c1ccc([N+](=O)[O-])cn1 ZINC000478371940 935619721 /nfs/dbraw/zinc/61/97/21/935619721.db2.gz BIRCWIBIJZZUKU-VOTSOKGWSA-N 0 0 352.799 3.607 20 5 FHBDRN O=[N+]([O-])c1ccccc1OC[C@H](O)CSCc1ccccc1Cl ZINC000478391338 935625760 /nfs/dbraw/zinc/62/57/60/935625760.db2.gz QURJIYALZXTOPQ-ZDUSSCGKSA-N 0 0 353.827 3.921 20 5 FHBDRN Cc1cc(C(=O)N[C@@H](CO)c2c(Cl)cccc2Cl)cc([N+](=O)[O-])c1 ZINC000478477764 935634484 /nfs/dbraw/zinc/63/44/84/935634484.db2.gz CYUYMPUORPZPFY-AWEZNQCLSA-N 0 0 369.204 3.673 20 5 FHBDRN COC(=O)c1cc(N2CCSC3(CCC3)CC2)cc(C)c1[N+](=O)[O-] ZINC000413480899 935638410 /nfs/dbraw/zinc/63/84/10/935638410.db2.gz LLSQOEJUCNJOPE-UHFFFAOYSA-N 0 0 350.440 3.556 20 5 FHBDRN Cc1c(CNC(=O)NCc2c(F)cccc2Cl)cccc1[N+](=O)[O-] ZINC000478532016 935641825 /nfs/dbraw/zinc/64/18/25/935641825.db2.gz UWRVLMTZXPKYKL-UHFFFAOYSA-N 0 0 351.765 3.695 20 5 FHBDRN O=C(CCc1ccc([N+](=O)[O-])cc1Cl)N[C@@H]1[C@H]2Cc3cc(F)ccc3[C@@H]12 ZINC001167571050 935647155 /nfs/dbraw/zinc/64/71/55/935647155.db2.gz NQCYAAZLUFAILU-KFKAGJAMSA-N 0 0 374.799 3.774 20 5 FHBDRN Cc1cc2c(o1)CC(C)(C)C[C@@H]2NC(=O)COc1cccc([N+](=O)[O-])c1 ZINC000509563102 945114402 /nfs/dbraw/zinc/11/44/02/945114402.db2.gz CKGDYDPAFVEHFN-INIZCTEOSA-N 0 0 358.394 3.705 20 5 FHBDRN CCc1noc(CC)c1CNC(=O)CCc1c(Cl)cccc1[N+](=O)[O-] ZINC000934453112 935660552 /nfs/dbraw/zinc/66/05/52/935660552.db2.gz IXEJZWDKNJYFMP-UHFFFAOYSA-N 0 0 365.817 3.610 20 5 FHBDRN O=C(c1ccc(N2CCCC2)c([N+](=O)[O-])c1)N(CC1CC1)CC1CCC1 ZINC000478610669 935664997 /nfs/dbraw/zinc/66/49/97/935664997.db2.gz WUJLHYZRLAZOBF-UHFFFAOYSA-N 0 0 357.454 3.847 20 5 FHBDRN Cn1c(C(=O)Nc2ccc(Br)c(Cl)c2)ccc1[N+](=O)[O-] ZINC000227606520 935671478 /nfs/dbraw/zinc/67/14/78/935671478.db2.gz HMLMGSXQYANIEM-UHFFFAOYSA-N 0 0 358.579 3.602 20 5 FHBDRN Cc1cc(OC[C@H](O)COCc2ccccc2Cl)c(F)cc1[N+](=O)[O-] ZINC000478665875 935677928 /nfs/dbraw/zinc/67/79/28/935677928.db2.gz LNACBRNZVUPYLZ-CYBMUJFWSA-N 0 0 369.776 3.652 20 5 FHBDRN COc1cc(NS(=O)(=O)c2c(C)cc([N+](=O)[O-])cc2C)c(C)cc1C ZINC000478699930 935681008 /nfs/dbraw/zinc/68/10/08/935681008.db2.gz LETCCZCOQZNGSU-UHFFFAOYSA-N 0 0 364.423 3.638 20 5 FHBDRN Cc1c(CC(=O)N2CCc3[nH]c4ccc(F)cc4c3C2)cccc1[N+](=O)[O-] ZINC000178580398 935690491 /nfs/dbraw/zinc/69/04/91/935690491.db2.gz NHZYHSJFEGKAFY-UHFFFAOYSA-N 0 0 367.380 3.651 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N1CCc2cccc(F)c2[C@H]1C ZINC000548736016 935697634 /nfs/dbraw/zinc/69/76/34/935697634.db2.gz LALZTTDREGSNFG-LLVKDONJSA-N 0 0 359.357 3.894 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1cc(NC(=O)C2CC2)ccc1C ZINC000277605504 935715545 /nfs/dbraw/zinc/71/55/45/935715545.db2.gz PGGDSBYOUMSNEJ-UHFFFAOYSA-N 0 0 369.377 3.513 20 5 FHBDRN CC(C)[C@H]1C[C@H](NC(=O)c2c([N+](=O)[O-])cccc2C(F)(F)F)CCO1 ZINC000582447920 935720373 /nfs/dbraw/zinc/72/03/73/935720373.db2.gz JSPZTXQWRFIHEC-ZWNOBZJWSA-N 0 0 360.332 3.547 20 5 FHBDRN C[C@@H](NC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F)c1cccc(F)c1F ZINC000582449666 935724012 /nfs/dbraw/zinc/72/40/12/935724012.db2.gz LJFASCYHBSFAAJ-MRVPVSSYSA-N 0 0 356.275 3.571 20 5 FHBDRN C[C@H](NC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F)c1cccc(F)c1F ZINC000582449667 935724188 /nfs/dbraw/zinc/72/41/88/935724188.db2.gz LJFASCYHBSFAAJ-QMMMGPOBSA-N 0 0 356.275 3.571 20 5 FHBDRN CCc1ncc(-c2nc(Cc3c[nH]c4ccc([N+](=O)[O-])cc34)no2)s1 ZINC000545072732 935725321 /nfs/dbraw/zinc/72/53/21/935725321.db2.gz JHVYDSQSHZGDAR-UHFFFAOYSA-N 0 0 355.379 3.736 20 5 FHBDRN CCOc1cc2c(cc1NC(=O)/C=C/c1ccc([N+](=O)[O-])cc1)O[C@H](C)C2 ZINC000018238105 945119363 /nfs/dbraw/zinc/11/93/63/945119363.db2.gz CCBOPQALWCYDCC-YSKGHYERSA-N 0 0 368.389 3.969 20 5 FHBDRN CC(C)(C)C[C@@H](O)CNC(=O)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000277622533 935738551 /nfs/dbraw/zinc/73/85/51/935738551.db2.gz AOUASUZJIASCOX-CYBMUJFWSA-N 0 0 352.434 3.621 20 5 FHBDRN COc1cc(N[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)ccc1F ZINC000187744552 935741923 /nfs/dbraw/zinc/74/19/23/935741923.db2.gz LAXOABCFIFGEKE-VIFPVBQESA-N 0 0 367.764 3.835 20 5 FHBDRN Cc1cccnc1[C@@H](NC(=O)NCc1cccc([N+](=O)[O-])c1C)C(C)C ZINC000478861539 935745782 /nfs/dbraw/zinc/74/57/82/935745782.db2.gz GIMNILJXBVNJQT-KRWDZBQOSA-N 0 0 356.426 3.803 20 5 FHBDRN CCO[C@@H]1C[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2F)C12CCCCC2 ZINC000478861477 935748910 /nfs/dbraw/zinc/74/89/10/935748910.db2.gz VMIALQNEGDTHMN-HZPDHXFCSA-N 0 0 350.390 3.592 20 5 FHBDRN Cc1ccc(CSc2ncn(CCOc3cccc([N+](=O)[O-])c3)n2)cc1 ZINC000478922251 935750721 /nfs/dbraw/zinc/75/07/21/935750721.db2.gz DSCYRNMCOJHYGP-UHFFFAOYSA-N 0 0 370.434 3.866 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1COC(=O)[C@H]1CCCN1c1ccccc1 ZINC000785129112 935750906 /nfs/dbraw/zinc/75/09/06/935750906.db2.gz XGEYOYLPUNVOQZ-GOSISDBHSA-N 0 0 370.405 3.706 20 5 FHBDRN Cc1cc(C)nc(NC(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)c1 ZINC000478886039 935752226 /nfs/dbraw/zinc/75/22/26/935752226.db2.gz GNJOFQJKUQPYTD-UHFFFAOYSA-N 0 0 368.315 3.947 20 5 FHBDRN Cc1noc([C@@H](OC(=O)c2cc([N+](=O)[O-])ccc2Cl)c2ccccc2)n1 ZINC000176672696 935752233 /nfs/dbraw/zinc/75/22/33/935752233.db2.gz BUQQJJGEWPNQPD-HNNXBMFYSA-N 0 0 373.752 3.886 20 5 FHBDRN Cc1nn(C)c(C(=O)Nc2ccccc2SCC(F)(F)F)c1[N+](=O)[O-] ZINC000127717653 935755434 /nfs/dbraw/zinc/75/54/34/935755434.db2.gz PVXIFSRZPYKIRA-UHFFFAOYSA-N 0 0 374.344 3.543 20 5 FHBDRN CC(C)c1ccc(C(=O)Nc2cnn(CC(F)(F)F)c2)cc1[N+](=O)[O-] ZINC000187747062 935761008 /nfs/dbraw/zinc/76/10/08/935761008.db2.gz IYKRBVZSCCSXJT-UHFFFAOYSA-N 0 0 356.304 3.729 20 5 FHBDRN Cc1cc(N[C@@H]2CCC[C@@H](NC(=O)OC(C)(C)C)C2)ncc1[N+](=O)[O-] ZINC000127741342 935765330 /nfs/dbraw/zinc/76/53/30/935765330.db2.gz BYJJNMFHCYXCPG-CHWSQXEVSA-N 0 0 350.419 3.546 20 5 FHBDRN CC(C)[C@H](NC(=O)CN(C)CCc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000511138584 935772263 /nfs/dbraw/zinc/77/22/63/935772263.db2.gz OEPQUGMLWUPUFC-NRFANRHFSA-N 0 0 369.465 3.583 20 5 FHBDRN CC(=O)c1ccc(NC(=O)N(C)CCc2ccccc2[N+](=O)[O-])cc1C ZINC000479062131 935780342 /nfs/dbraw/zinc/78/03/42/935780342.db2.gz YASGRGFLYJALSA-UHFFFAOYSA-N 0 0 355.394 3.812 20 5 FHBDRN COc1ccc(CSCC(=O)Nc2cc(Cl)ccn2)cc1[N+](=O)[O-] ZINC000511143918 935784677 /nfs/dbraw/zinc/78/46/77/935784677.db2.gz IIKLFMPJIIKSKH-UHFFFAOYSA-N 0 0 367.814 3.524 20 5 FHBDRN CCN(CC)C(=O)c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1 ZINC000127782204 935788413 /nfs/dbraw/zinc/78/84/13/935788413.db2.gz WWDQDLLZSMSLED-UHFFFAOYSA-N 0 0 357.197 3.569 20 5 FHBDRN COc1cccc([C@@H](Nc2nc(C)cc(C)c2[N+](=O)[O-])c2nccn2C)c1 ZINC000611615572 935788490 /nfs/dbraw/zinc/78/84/90/935788490.db2.gz CULXODJXRXIEPS-MRXNPFEDSA-N 0 0 367.409 3.550 20 5 FHBDRN Cc1noc([C@@H](OC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)c2ccccc2)n1 ZINC000176679968 935802637 /nfs/dbraw/zinc/80/26/37/935802637.db2.gz ORPHQKAFCWCVJN-PEKVBPLLSA-N 0 0 365.345 3.632 20 5 FHBDRN Cc1cc(OCC(=O)N(Cc2ccccc2)C(C)C)c(F)cc1[N+](=O)[O-] ZINC000479181725 935815532 /nfs/dbraw/zinc/81/55/32/935815532.db2.gz FSYLIRNTGRTYHT-UHFFFAOYSA-N 0 0 360.385 3.858 20 5 FHBDRN CC(C)(CNC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)[C@H]1CCCCO1 ZINC000611618303 935820092 /nfs/dbraw/zinc/82/00/92/935820092.db2.gz NKZNQZQGSASFHK-CQSZACIVSA-N 0 0 372.368 3.521 20 5 FHBDRN C[C@@H](NC(=O)N[C@@H]1CCCc2c(O)cccc21)c1ccccc1[N+](=O)[O-] ZINC000479265318 935822196 /nfs/dbraw/zinc/82/21/96/935822196.db2.gz IAVSKAVMMMQXFP-MLGOLLRUSA-N 0 0 355.394 3.738 20 5 FHBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])NC1(Cc2ccccc2)CC1 ZINC000479267564 935822215 /nfs/dbraw/zinc/82/22/15/935822215.db2.gz VQULKXRLIZWBFQ-UHFFFAOYSA-N 0 0 374.824 3.909 20 5 FHBDRN O=C(CSCc1c(F)cc([N+](=O)[O-])cc1F)Nc1ccc(F)cc1 ZINC000506403615 945126542 /nfs/dbraw/zinc/12/65/42/945126542.db2.gz OLCVQPVWJFBWFN-UHFFFAOYSA-N 0 0 356.325 3.884 20 5 FHBDRN C[C@]1(CO)CCCN1C(=O)c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1 ZINC000546116595 945126624 /nfs/dbraw/zinc/12/66/24/945126624.db2.gz ZIVJTEDDUNBUSN-LJQANCHMSA-N 0 0 372.446 3.733 20 5 FHBDRN C[C@H](CNC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12)COCc1ccccc1 ZINC000509574065 945126884 /nfs/dbraw/zinc/12/68/84/945126884.db2.gz IBUOQAHQBJVDGT-CQSZACIVSA-N 0 0 367.405 3.659 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)NCc1cccc(NC(=O)C2CCC2)c1 ZINC000511161498 935829320 /nfs/dbraw/zinc/82/93/20/935829320.db2.gz RFAUSNLNRFUAHY-UHFFFAOYSA-N 0 0 367.405 3.572 20 5 FHBDRN CCCN(C(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-])[C@H]1CCCc2cccnc21 ZINC000479357838 935830438 /nfs/dbraw/zinc/83/04/38/935830438.db2.gz ZHIDOYBALBDYMS-AWEZNQCLSA-N 0 0 371.441 3.766 20 5 FHBDRN CCn1nc(C)c([N+](=O)[O-])c1N1CCC(C(=O)c2ccc(C)cc2)CC1 ZINC000479369528 935831317 /nfs/dbraw/zinc/83/13/17/935831317.db2.gz ZWVUIILEDQBFFR-UHFFFAOYSA-N 0 0 356.426 3.527 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccn(-c2ccccc2Cl)n1 ZINC000158551574 935836177 /nfs/dbraw/zinc/83/61/77/935836177.db2.gz QVWXIZBPQGQQFU-UHFFFAOYSA-N 0 0 356.769 3.995 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[C@@H](OCCCc2ccccc2)C1 ZINC000176340961 935836336 /nfs/dbraw/zinc/83/63/36/935836336.db2.gz KWFTZVUGCFLHMM-LJQANCHMSA-N 0 0 368.433 3.767 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[C@H](OCCCc2ccccc2)C1 ZINC000176340947 935836363 /nfs/dbraw/zinc/83/63/63/935836363.db2.gz KWFTZVUGCFLHMM-IBGZPJMESA-N 0 0 368.433 3.767 20 5 FHBDRN COc1ccc(NC(=O)[C@H](Sc2ncccc2[N+](=O)[O-])C(C)C)cc1 ZINC000127903984 935836381 /nfs/dbraw/zinc/83/63/81/935836381.db2.gz LGISKGBJRBGWCZ-OAHLLOKOSA-N 0 0 361.423 3.754 20 5 FHBDRN O=C(c1cc2cc([N+](=O)[O-])ccc2o1)N1CCC(c2ccncc2)CC1 ZINC000277707540 935842688 /nfs/dbraw/zinc/84/26/88/935842688.db2.gz YKLWUWSUZFKXFY-UHFFFAOYSA-N 0 0 351.362 3.756 20 5 FHBDRN C[C@H](CCc1ccco1)NC(=O)c1sc(Br)cc1[N+](=O)[O-] ZINC000277714334 935846114 /nfs/dbraw/zinc/84/61/14/935846114.db2.gz FMTXWBDJVQWFID-MRVPVSSYSA-N 0 0 373.228 3.763 20 5 FHBDRN Cc1cc(Cl)c(S(=O)(=O)N2CCC[C@H]2C2CCC2)cc1[N+](=O)[O-] ZINC000176692637 935855046 /nfs/dbraw/zinc/85/50/46/935855046.db2.gz XZCKBMNHIRAJEQ-ZDUSSCGKSA-N 0 0 358.847 3.510 20 5 FHBDRN CC(C)(C)C(=O)Nc1ccc(C(=O)COc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000047355132 945131094 /nfs/dbraw/zinc/13/10/94/945131094.db2.gz DPYSVUODMAJKOF-UHFFFAOYSA-N 0 0 374.368 3.980 20 5 FHBDRN COc1ccc(C(=O)Nc2ccn(-c3ccccc3Cl)n2)cc1[N+](=O)[O-] ZINC000158593418 935858163 /nfs/dbraw/zinc/85/81/63/935858163.db2.gz VKCMWBQMZNJJOG-UHFFFAOYSA-N 0 0 372.768 3.695 20 5 FHBDRN CCC[C@@H](NC(=O)c1cc([O-])cc([N+](=O)[O-])c1)c1ccc(F)cc1F ZINC000507301138 945129136 /nfs/dbraw/zinc/12/91/36/945129136.db2.gz GHJCOVLYQDTTHP-MRXNPFEDSA-N 0 0 350.321 3.850 20 5 FHBDRN CCCC(C)(C)NC(=O)c1ccc(Cn2nc(C)c([N+](=O)[O-])c2C)cc1 ZINC000050498323 935871374 /nfs/dbraw/zinc/87/13/74/935871374.db2.gz NULPLJQIRLRICE-UHFFFAOYSA-N 0 0 358.442 3.765 20 5 FHBDRN Cc1ccc([C@H]2CCCN2C(=O)COc2ccc([N+](=O)[O-])c(C)c2)cc1 ZINC000431464597 935884380 /nfs/dbraw/zinc/88/43/80/935884380.db2.gz MXUDBSYTRUEERX-LJQANCHMSA-N 0 0 354.406 3.954 20 5 FHBDRN C[C@@H](NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)c1ccccn1 ZINC000050551549 935888616 /nfs/dbraw/zinc/88/86/16/935888616.db2.gz ZJEJNAXLGUPFLZ-LLVKDONJSA-N 0 0 354.391 3.604 20 5 FHBDRN Cc1nn(C)c(NCc2ccc(OCc3cccc(F)c3)cc2)c1[N+](=O)[O-] ZINC000051798205 935890169 /nfs/dbraw/zinc/89/01/69/935890169.db2.gz VFHBHSSMWVHDNJ-UHFFFAOYSA-N 0 0 370.384 3.967 20 5 FHBDRN CC[C@@H](C)COc1cc([N+](=O)[O-])c(CN2CCC[C@H]2COC)cc1OC ZINC000611668880 935891703 /nfs/dbraw/zinc/89/17/03/935891703.db2.gz UTCYMVVILXLYCA-ZBFHGGJFSA-N 0 0 366.458 3.639 20 5 FHBDRN CCc1ccc(-c2nc(-c3cn(C)nc3C(F)(F)F)no2)cc1[N+](=O)[O-] ZINC000426198155 945131860 /nfs/dbraw/zinc/13/18/60/945131860.db2.gz ZAAWZKPULFLKDL-UHFFFAOYSA-N 0 0 367.287 3.627 20 5 FHBDRN C[C@@H]1c2cccn2CCN1C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000050560499 935893162 /nfs/dbraw/zinc/89/31/62/935893162.db2.gz QRGHSWJYXZNXAT-GFCCVEGCSA-N 0 0 368.418 3.737 20 5 FHBDRN C[C@@H](c1nc(-c2ccccc2-n2cccn2)no1)c1cccc([N+](=O)[O-])c1 ZINC000582630712 935893584 /nfs/dbraw/zinc/89/35/84/935893584.db2.gz DFHQGUTUTLJADO-CYBMUJFWSA-N 0 0 361.361 3.982 20 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COc1ccc([N+](=O)[O-])c(NCCOc2cccc(C(F)(F)F)n2)c1 ZINC000536086153 938320974 /nfs/dbraw/zinc/32/09/74/938320974.db2.gz BTGBJMGYTRXUMK-UHFFFAOYSA-N 0 0 357.288 3.508 20 5 FHBDRN O=C(NC1CC(F)(F)C1)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000278368377 938352269 /nfs/dbraw/zinc/35/22/69/938352269.db2.gz KAMRESHRNVMVBJ-UHFFFAOYSA-N 0 0 362.332 3.701 20 5 FHBDRN COCCN(Cc1cccs1)Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000506004481 945167597 /nfs/dbraw/zinc/16/75/97/945167597.db2.gz AEYXGFZGASSQDD-UHFFFAOYSA-N 0 0 372.393 3.906 20 5 FHBDRN Cc1nn(Cc2ccc(C(=O)N3CCCCC[C@H]3C)cc2)c(C)c1[N+](=O)[O-] ZINC000074650216 938359577 /nfs/dbraw/zinc/35/95/77/938359577.db2.gz PYHFDVAIABFNOV-CQSZACIVSA-N 0 0 370.453 3.861 20 5 FHBDRN O=C(Cc1c[nH]c2ccc(Cl)cc12)NCCNc1ccc([N+](=O)[O-])cc1 ZINC000158786564 938375119 /nfs/dbraw/zinc/37/51/19/938375119.db2.gz WKWVDLHPBCYYRB-UHFFFAOYSA-N 0 0 372.812 3.500 20 5 FHBDRN CCC(CC)c1cc(CNC(=O)CSc2ccccc2[N+](=O)[O-])on1 ZINC000544052558 938376595 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367.405 3.817 20 5 FHBDRN Cc1nn(Cc2ccc(C(=O)N3C[C@H](C)C[C@H](C)C3)cc2)c(C)c1[N+](=O)[O-] ZINC000018037777 945173587 /nfs/dbraw/zinc/17/35/87/945173587.db2.gz WGVUJRGUAOYBSG-OKILXGFUSA-N 0 0 370.453 3.575 20 5 FHBDRN Cc1ccc(C)c([C@@H](C)OC(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)c1 ZINC001267301373 938429964 /nfs/dbraw/zinc/42/99/64/938429964.db2.gz UOTUBHPKNKMIOG-CYBMUJFWSA-N 0 0 357.362 3.901 20 5 FHBDRN COc1ccc(OC)c([C@@H](C)NC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)c1 ZINC000052610656 938436467 /nfs/dbraw/zinc/43/64/67/938436467.db2.gz OYIDBROIZAPQBW-LLVKDONJSA-N 0 0 369.377 3.584 20 5 FHBDRN COc1ccc(CC[C@H](C)NC(=O)CCNc2ccccc2[N+](=O)[O-])cc1 ZINC000519150235 945174336 /nfs/dbraw/zinc/17/43/36/945174336.db2.gz MQDFXACDAJLYAX-HNNXBMFYSA-N 0 0 371.437 3.543 20 5 FHBDRN CCS[C@H]1CCCC[C@@H]1NC(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000427204040 945174365 /nfs/dbraw/zinc/17/43/65/945174365.db2.gz LNQSBJOCMGLAST-GJZGRUSLSA-N 0 0 354.497 3.867 20 5 FHBDRN O=[N+]([O-])c1cc2c(ncnc2NC[C@H]2CC[C@@H](c3ccccc3)O2)s1 ZINC000583845150 938444567 /nfs/dbraw/zinc/44/45/67/938444567.db2.gz ZHLYZNKEYYVGKK-OCCSQVGLSA-N 0 0 356.407 3.932 20 5 FHBDRN COc1cccc(C[C@@H]2CCCN2c2nc3cc([N+](=O)[O-])ccc3[nH]2)c1 ZINC000583851858 938450743 /nfs/dbraw/zinc/45/07/43/938450743.db2.gz KXYRLCQXCHASGV-AWEZNQCLSA-N 0 0 352.394 3.691 20 5 FHBDRN CN(C)c1ccc(C(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cc1F ZINC000583853965 938451927 /nfs/dbraw/zinc/45/19/27/938451927.db2.gz FLJFYCRNSBVVFH-INIZCTEOSA-N 0 0 371.412 3.820 20 5 FHBDRN C[C@H](CNC(=O)NCCc1cccc([N+](=O)[O-])c1)c1ccc(F)cc1F ZINC000536148408 938456365 /nfs/dbraw/zinc/45/63/65/938456365.db2.gz AQJUTSKUBPWEPE-GFCCVEGCSA-N 0 0 363.364 3.518 20 5 FHBDRN CNc1ccc(C(=O)N2CCc3sc(Cl)cc3C2)cc1[N+](=O)[O-] ZINC000583874299 938463045 /nfs/dbraw/zinc/46/30/45/938463045.db2.gz OVUMIRHKROPPIK-UHFFFAOYSA-N 0 0 351.815 3.550 20 5 FHBDRN O=C(Nc1cc(-c2cccnc2)[nH]n1)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000179001140 938465011 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Cc1ccc(CNC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000544055575 938499063 /nfs/dbraw/zinc/49/90/63/938499063.db2.gz XIVJQXSZIKNPJL-UHFFFAOYSA-N 0 0 350.827 3.965 20 5 FHBDRN Cc1ccc(C)c(S(=O)(=O)N2C[C@H](C)Cc3ccccc32)c1[N+](=O)[O-] ZINC000480230260 938499591 /nfs/dbraw/zinc/49/95/91/938499591.db2.gz VDMRWBABQDECSR-GFCCVEGCSA-N 0 0 360.435 3.599 20 5 FHBDRN CC1(C)CCc2nc(NC(=O)c3cc(Cl)ccc3[N+](=O)[O-])ncc2C1 ZINC000278521973 938501438 /nfs/dbraw/zinc/50/14/38/938501438.db2.gz OXQAVPSTIUJHRU-UHFFFAOYSA-N 0 0 360.801 3.805 20 5 FHBDRN CC1(C)[C@H](NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)[C@H]2CCCO[C@H]21 ZINC000437250405 945180688 /nfs/dbraw/zinc/18/06/88/945180688.db2.gz XSXIQRBXZXERMP-MGPQQGTHSA-N 0 0 372.343 3.547 20 5 FHBDRN CO[C@H](C)[C@@H](C)Nc1ccc(C(=O)Nc2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000583967286 938507260 /nfs/dbraw/zinc/50/72/60/938507260.db2.gz WVGZECDAIFFRGY-ZIAGYGMSSA-N 0 0 357.410 3.991 20 5 FHBDRN Cc1cc(CNc2cc(C(F)(F)C(F)(F)F)ncc2[N+](=O)[O-])on1 ZINC000278549415 938525052 /nfs/dbraw/zinc/52/50/52/938525052.db2.gz VQPRVNMKUABOJE-UHFFFAOYSA-N 0 0 352.219 3.552 20 5 FHBDRN O=[N+]([O-])c1cccc2c(N3CCC[C@@](CO)(c4ccccc4)C3)ccnc21 ZINC000432141101 945182517 /nfs/dbraw/zinc/18/25/17/945182517.db2.gz YMGMFZIWDOKXTK-OAQYLSRUSA-N 0 0 363.417 3.674 20 5 FHBDRN Cc1cc(F)cc(C(=O)NCc2nc(C(C)(C)C)cs2)c1[N+](=O)[O-] ZINC000176805728 938546068 /nfs/dbraw/zinc/54/60/68/938546068.db2.gz LHDIZNXRUFYATG-UHFFFAOYSA-N 0 0 351.403 3.726 20 5 FHBDRN O=[N+]([O-])c1ccc(NCCCCc2nc(-c3cccnc3)cs2)cn1 ZINC000584018137 938546943 /nfs/dbraw/zinc/54/69/43/938546943.db2.gz ULYHWAMZLZCVCF-UHFFFAOYSA-N 0 0 355.423 3.943 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N(C)[C@@H](C)c1c(F)cccc1F ZINC000427195352 945184711 /nfs/dbraw/zinc/18/47/11/945184711.db2.gz DGQZMTCKTIESBI-JTQLQIEISA-N 0 0 350.321 3.715 20 5 FHBDRN C[C@@H]1C[C@@H](Nc2cc(C(F)(F)C(F)(F)F)ncc2[N+](=O)[O-])CCO1 ZINC000278582841 938554063 /nfs/dbraw/zinc/55/40/63/938554063.db2.gz YFYBPIVBQNAEMT-SFYZADRCSA-N 0 0 355.263 3.623 20 5 FHBDRN CCS(=O)(=O)c1ccc(CNc2ccnc3c2cccc3[N+](=O)[O-])cc1 ZINC000432141933 945185661 /nfs/dbraw/zinc/18/56/61/945185661.db2.gz GMPXDSDXJBKKPG-UHFFFAOYSA-N 0 0 371.418 3.549 20 5 FHBDRN CC(=O)CCc1ccc(O[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000039501926 938573277 /nfs/dbraw/zinc/57/32/77/938573277.db2.gz PZBRPMNFIMZAPY-CQSZACIVSA-N 0 0 356.378 3.522 20 5 FHBDRN CCO[C@@H]1C[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2SCC)C12CCC2 ZINC000158803592 938589793 /nfs/dbraw/zinc/58/97/93/938589793.db2.gz VJTQOVOWHGPFCW-JKSUJKDBSA-N 0 0 364.467 3.784 20 5 FHBDRN CCO[C@H](C)c1nc(CN(C)c2ccc([N+](=O)[O-])c(C(C)=O)c2)cs1 ZINC000573032933 938596331 /nfs/dbraw/zinc/59/63/31/938596331.db2.gz HUJHWPXDGIAZKW-GFCCVEGCSA-N 0 0 363.439 3.988 20 5 FHBDRN O=C(Nc1nc2c(s1)CCC2)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000584095790 938599805 /nfs/dbraw/zinc/59/98/05/938599805.db2.gz QGOZQVKINQFNAY-ZDUSSCGKSA-N 0 0 372.450 3.952 20 5 FHBDRN CC(=O)c1cc(N2CCCN(c3ccccc3F)CC2)ccc1[N+](=O)[O-] ZINC000584104935 938602594 /nfs/dbraw/zinc/60/25/94/938602594.db2.gz TUUILIZBMRBDRS-UHFFFAOYSA-N 0 0 357.385 3.653 20 5 FHBDRN CC(C)(C)C[C@H](CO)NC(=O)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000278629850 938602716 /nfs/dbraw/zinc/60/27/16/938602716.db2.gz MIGMWHDGHSDVJQ-CYBMUJFWSA-N 0 0 352.434 3.621 20 5 FHBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)N1C[C@H](c2ccccc2)[C@H]2CCC[C@@H]21 ZINC000584128974 938609522 /nfs/dbraw/zinc/60/95/22/938609522.db2.gz PRJSGZALHPSAME-ZACQAIPSSA-N 0 0 372.446 3.552 20 5 FHBDRN CC(C)c1ccoc1-c1noc([C@@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)n1 ZINC000426220371 945190593 /nfs/dbraw/zinc/19/05/93/945190593.db2.gz OZKAHTWWYUGCCM-LLVKDONJSA-N 0 0 370.365 3.852 20 5 FHBDRN COc1cc(CNc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])ccc1OC(F)F ZINC000018058179 945192830 /nfs/dbraw/zinc/19/28/30/945192830.db2.gz SUTOFDPRUXBUOT-UHFFFAOYSA-N 0 0 369.280 3.725 20 5 FHBDRN Cc1ccn2c(=O)cc(CS[C@H](C)c3ccccc3[N+](=O)[O-])nc2c1 ZINC000437267951 945193060 /nfs/dbraw/zinc/19/30/60/945193060.db2.gz OJLTZWXSDSBRJQ-CYBMUJFWSA-N 0 0 355.419 3.906 20 5 FHBDRN O=C(NCCc1cccc(F)c1F)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000437271735 945196230 /nfs/dbraw/zinc/19/62/30/945196230.db2.gz WGTKMBNWCQWQPS-UHFFFAOYSA-N 0 0 374.265 3.864 20 5 FHBDRN CSc1ccc(C(=O)Nc2cccnc2C(F)(F)F)cc1[N+](=O)[O-] ZINC000584257438 938658494 /nfs/dbraw/zinc/65/84/94/938658494.db2.gz QUHQRDMRHAZQRD-UHFFFAOYSA-N 0 0 357.313 3.983 20 5 FHBDRN O=[N+]([O-])c1ccc(CNc2cc(F)c(Cl)cc2N2CCOCC2)cc1 ZINC000584256723 938662018 /nfs/dbraw/zinc/66/20/18/938662018.db2.gz JAUZUJDQPQHDQM-UHFFFAOYSA-N 0 0 365.792 3.836 20 5 FHBDRN Cn1cc(C(=O)NCc2ccccc2Cl)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000052932952 938662658 /nfs/dbraw/zinc/66/26/58/938662658.db2.gz OITVNXHQVYQKCP-UHFFFAOYSA-N 0 0 370.796 3.579 20 5 FHBDRN CC(=O)c1ccc([N+](=O)[O-])cc1N1CC[C@]2(C1)CCc1ccccc1O2 ZINC000584264866 938664491 /nfs/dbraw/zinc/66/44/91/938664491.db2.gz XPYUPKHNUHUYBC-FQEVSTJZSA-N 0 0 352.390 3.772 20 5 FHBDRN Cc1cc(F)cc(C(=O)N2CCCc3c([N+](=O)[O-])cccc32)c1[N+](=O)[O-] ZINC000162122543 938668110 /nfs/dbraw/zinc/66/81/10/938668110.db2.gz OSKBVTJWCDKTHR-UHFFFAOYSA-N 0 0 359.313 3.544 20 5 FHBDRN Cc1ccc([C@H]2C[C@@H](C)N(C(=O)c3cc4c(cc3[N+](=O)[O-])OCO4)C2)cc1 ZINC000573182159 938678962 /nfs/dbraw/zinc/67/89/62/938678962.db2.gz KIMRIQZFAVSRQC-HIFRSBDPSA-N 0 0 368.389 3.650 20 5 FHBDRN O=C(c1c[nH]c2ccc([N+](=O)[O-])cc12)N1CCC(F)(c2ccccn2)CC1 ZINC000584313493 938683392 /nfs/dbraw/zinc/68/33/92/938683392.db2.gz SIBHNDNBJXQTJI-UHFFFAOYSA-N 0 0 368.368 3.572 20 5 FHBDRN COc1cccc(-c2nc(-c3ccccc3-n3cccn3)no2)c1[N+](=O)[O-] ZINC000584316706 938683815 /nfs/dbraw/zinc/68/38/15/938683815.db2.gz BVDQNTMUSXULJF-UHFFFAOYSA-N 0 0 363.333 3.506 20 5 FHBDRN Cc1ccc(C(=O)N(C)Cc2cc([N+](=O)[O-])ccc2Cl)cc1[N+](=O)[O-] ZINC000052991216 938695829 /nfs/dbraw/zinc/69/58/29/938695829.db2.gz XOWRXLQURVVGCF-UHFFFAOYSA-N 0 0 363.757 3.737 20 5 FHBDRN COc1ccc(NC(=O)N2CC(Cc3cccc(C)c3)C2)cc1[N+](=O)[O-] ZINC000611827012 938702385 /nfs/dbraw/zinc/70/23/85/938702385.db2.gz LPKKAMWROYRHMP-UHFFFAOYSA-N 0 0 355.394 3.618 20 5 FHBDRN Cc1cc(NCc2ccc(COCC(F)(F)F)cc2)ncc1[N+](=O)[O-] ZINC000074738754 938707675 /nfs/dbraw/zinc/70/76/75/938707675.db2.gz WQVBYXPWFPKCQG-UHFFFAOYSA-N 0 0 355.316 3.989 20 5 FHBDRN O=[N+]([O-])c1cccc(F)c1OCc1noc(-c2ccc(F)cc2F)n1 ZINC000187973977 938708374 /nfs/dbraw/zinc/70/83/74/938708374.db2.gz KQMKRGUDGBWBEQ-UHFFFAOYSA-N 0 0 351.240 3.641 20 5 FHBDRN Cc1c2cccc(C)c2oc1C(=O)NCCNc1ccc([N+](=O)[O-])cc1 ZINC000053010251 938717380 /nfs/dbraw/zinc/71/73/80/938717380.db2.gz WPKOWDOMTAYCIN-UHFFFAOYSA-N 0 0 353.378 3.800 20 5 FHBDRN CCOc1cc(NCc2cc(Br)ccn2)ccc1[N+](=O)[O-] ZINC000432144734 945198475 /nfs/dbraw/zinc/19/84/75/945198475.db2.gz KMTGSEFSLWKVMP-UHFFFAOYSA-N 0 0 352.188 3.763 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2C[C@H]2c2c(F)cccc2F)c1 ZINC000437283784 945200087 /nfs/dbraw/zinc/20/00/87/945200087.db2.gz IQJXCEVKSQHHSE-QMTHXVAHSA-N 0 0 364.373 3.881 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC2(CCCC2)c2c1cccc2F ZINC000194722985 945200535 /nfs/dbraw/zinc/20/05/35/945200535.db2.gz RLYICMYBIDKZBB-UHFFFAOYSA-N 0 0 355.369 3.910 20 5 FHBDRN C[C@H](NC(=O)N1CCOc2ccc([N+](=O)[O-])cc2C1)[C@@H](C)c1ccccc1 ZINC000584383632 938786920 /nfs/dbraw/zinc/78/69/20/938786920.db2.gz IUDJMIHRGNWOTH-CABCVRRESA-N 0 0 369.421 3.691 20 5 FHBDRN CCC[C@@]1(NC(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CCOC1 ZINC000480269136 938794892 /nfs/dbraw/zinc/79/48/92/938794892.db2.gz KALWCTMOZHAOEE-CQSZACIVSA-N 0 0 361.320 3.694 20 5 FHBDRN CC[C@H]1c2ccsc2CCN1S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-] ZINC000507383495 945204551 /nfs/dbraw/zinc/20/45/51/945204551.db2.gz SWKKUNVNYICXFO-ZDUSSCGKSA-N 0 0 366.464 3.663 20 5 FHBDRN Cc1ccn(C(=O)c2cc([N+](=O)[O-])ccc2C)c(=NC2CCCCC2)c1 ZINC000255589270 938800931 /nfs/dbraw/zinc/80/09/31/938800931.db2.gz CVIDUKOVOKITJC-UHFFFAOYSA-N 0 0 353.422 3.935 20 5 FHBDRN Nc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl ZINC000437290516 945205490 /nfs/dbraw/zinc/20/54/90/945205490.db2.gz JZBQYHJBYAUQDI-GXFFZTMASA-N 0 0 366.204 3.770 20 5 FHBDRN CCS[C@H]1CCCC[C@@H]1NC(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000427212923 945206374 /nfs/dbraw/zinc/20/63/74/945206374.db2.gz OFIRKTABLPFSRP-HOCLYGCPSA-N 0 0 351.472 3.577 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2nnc(N3CCC[C@H]4CCC[C@H]43)n2C2CC2)cc1 ZINC000584416403 938843713 /nfs/dbraw/zinc/84/37/13/938843713.db2.gz CMRBJYMBKKWTJJ-CXAGYDPISA-N 0 0 353.426 3.957 20 5 FHBDRN COC[C@@H](NC(=O)/C=C\c1ccc([N+](=O)[O-])cc1)c1ccc(Cl)cc1 ZINC000588602393 938852663 /nfs/dbraw/zinc/85/26/63/938852663.db2.gz DUSLJHJSZCNYGN-IAQFLPNQSA-N 0 0 360.797 3.765 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(Oc2ccc(C)cc2Br)n1 ZINC000318254346 938862929 /nfs/dbraw/zinc/86/29/29/938862929.db2.gz HVCLUSOZQRSVKP-UHFFFAOYSA-N 0 0 367.155 3.640 20 5 FHBDRN O=C(Nc1ccc(N2CCCC2)c(F)c1)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000065668774 938868097 /nfs/dbraw/zinc/86/80/97/938868097.db2.gz YLCLSDZNBLYPQF-UHFFFAOYSA-N 0 0 365.311 3.865 20 5 FHBDRN C[C@H](NC(=O)c1cc(F)c(F)cc1[N+](=O)[O-])c1cccc(OC(F)F)c1 ZINC000065669253 938872710 /nfs/dbraw/zinc/87/27/10/938872710.db2.gz MOBAXFHOHSQGNC-QMMMGPOBSA-N 0 0 372.274 3.965 20 5 FHBDRN CCS[C@@H]1CCCC[C@@H]1NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000427236804 945213141 /nfs/dbraw/zinc/21/31/41/945213141.db2.gz ANDXVDDPKFQUEJ-DOTOQJQBSA-N 0 0 363.483 3.963 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H](C)c1c(C)cccc1C ZINC000573255867 938901380 /nfs/dbraw/zinc/90/13/80/938901380.db2.gz NXBZUCUNZYIDGF-AWEZNQCLSA-N 0 0 369.421 3.590 20 5 FHBDRN O=[N+]([O-])c1cnccc1N1CC[C@@H](Cc2ccc(Br)cc2)C1 ZINC000432156659 945216591 /nfs/dbraw/zinc/21/65/91/945216591.db2.gz JBHVQEPGABWLGL-ZDUSSCGKSA-N 0 0 362.227 3.821 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(C)Cc1ccc(Cl)cc1 ZINC000065684945 938941434 /nfs/dbraw/zinc/94/14/34/938941434.db2.gz VMHFDXIEXWUTTA-UHFFFAOYSA-N 0 0 368.842 3.631 20 5 FHBDRN O=C(CSc1ncc2ccccn21)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000024276535 938961170 /nfs/dbraw/zinc/96/11/70/938961170.db2.gz FYQLZGSNBYENHQ-UHFFFAOYSA-N 0 0 362.798 3.627 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1NCC1CCN(c3ccccc3)CC1)CCN2 ZINC000480501182 938965147 /nfs/dbraw/zinc/96/51/47/938965147.db2.gz NDVJIACRNXOMNE-UHFFFAOYSA-N 0 0 352.438 3.891 20 5 FHBDRN O=[N+]([O-])c1ccc(N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)cn1 ZINC000480529592 938968021 /nfs/dbraw/zinc/96/80/21/938968021.db2.gz UVTFRAJHMIAVAC-GFCCVEGCSA-N 0 0 352.316 3.699 20 5 FHBDRN O=[N+]([O-])c1ccc(NC[C@@]2(CO)C[C@H]2c2ccccc2)c(OC(F)F)c1 ZINC000562911149 938970984 /nfs/dbraw/zinc/97/09/84/938970984.db2.gz GXESEVUYMRNRCD-KBXCAEBGSA-N 0 0 364.348 3.774 20 5 FHBDRN CC(=O)OCCCc1cccc(NC(=O)Cc2cccc([N+](=O)[O-])c2C)c1 ZINC000135570074 938975081 /nfs/dbraw/zinc/97/50/81/938975081.db2.gz QEEAOQFLTNDWHZ-UHFFFAOYSA-N 0 0 370.405 3.580 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)N[C@H](CC(C)(C)C)c2ccc(F)cc2)n1 ZINC000427244483 945219331 /nfs/dbraw/zinc/21/93/31/945219331.db2.gz CUCIWEVZOYWTMU-CQSZACIVSA-N 0 0 362.405 3.858 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1)N1CC[C@@H](Oc2ccccc2Cl)C1 ZINC000179123163 938976782 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COc1cc(N2CCC[C@H](c3ncc4n3CCCC4)C2)c([N+](=O)[O-])cc1F ZINC000409653327 938984809 /nfs/dbraw/zinc/98/48/09/938984809.db2.gz TTZIAXUICDPULX-ZDUSSCGKSA-N 0 0 374.416 3.659 20 5 FHBDRN CCCn1nccc1C1CCN(c2cc(OC)c([N+](=O)[O-])cc2F)CC1 ZINC000409657853 938985684 /nfs/dbraw/zinc/98/56/84/938985684.db2.gz VRBWSUVQVPITOE-UHFFFAOYSA-N 0 0 362.405 3.733 20 5 FHBDRN Cc1cc(C(=O)Nc2ccc(O[C@H]3CCCC[C@H]3O)cc2)cc([N+](=O)[O-])c1 ZINC000135655702 938986131 /nfs/dbraw/zinc/98/61/31/938986131.db2.gz WBHZIOBTWRXARW-MOPGFXCFSA-N 0 0 370.405 3.838 20 5 FHBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)c1cccnc1Br ZINC000135654415 938986141 /nfs/dbraw/zinc/98/61/41/938986141.db2.gz GYEVCULAFTZNNU-UHFFFAOYSA-N 0 0 370.590 3.966 20 5 FHBDRN CCN(C(=O)c1cc2c(cc1[N+](=O)[O-])OCCCO2)[C@@H]1CCCC[C@H]1C ZINC001125732242 938986243 /nfs/dbraw/zinc/98/62/43/938986243.db2.gz CDEVKNHNCKQHMD-UKRRQHHQSA-N 0 0 362.426 3.797 20 5 FHBDRN CCC[C@@H](C)[C@@H]1CCCN1C(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000785180642 938991487 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3.897 20 5 FHBDRN COc1c(O)ccc(CNCc2ccc(F)cc2CSC)c1[N+](=O)[O-] ZINC000892401594 938997119 /nfs/dbraw/zinc/99/71/19/938997119.db2.gz FIWVFLZCQSPEPD-UHFFFAOYSA-N 0 0 366.414 3.601 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)Nc1nccn1-c1ccccc1 ZINC000511307764 938999940 /nfs/dbraw/zinc/99/99/40/938999940.db2.gz SNUBFHKSCDRJIO-UHFFFAOYSA-N 0 0 356.769 3.995 20 5 FHBDRN Cc1sc(S(=O)(=O)N2CCC[C@@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000431615120 939003851 /nfs/dbraw/zinc/00/38/51/939003851.db2.gz UFKOLUKJRYGGKH-CQSZACIVSA-N 0 0 366.464 3.533 20 5 FHBDRN Cc1ccc(S(=O)(=O)N2CC[C@H]2c2ccc(Cl)cc2)c([N+](=O)[O-])c1 ZINC000511313233 939004127 /nfs/dbraw/zinc/00/41/27/939004127.db2.gz GYANCRMKWKTXRZ-AWEZNQCLSA-N 0 0 366.826 3.692 20 5 FHBDRN COc1ccc([C@H](C)N(C)C(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)cc1 ZINC000065723320 939007111 /nfs/dbraw/zinc/00/71/11/939007111.db2.gz SCTUFSLHWLECCJ-AWEZNQCLSA-N 0 0 367.405 3.778 20 5 FHBDRN Cc1ccc(SCCNC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)cc1 ZINC000065719866 939007380 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O=C(/C=C/c1ccc(Cl)nc1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000179365914 939104448 /nfs/dbraw/zinc/10/44/48/939104448.db2.gz RRMIPHQNOGJFRL-WEVVVXLNSA-N 0 0 357.797 3.848 20 5 FHBDRN Cc1ccc(OCCNC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1 ZINC000179385096 939139333 /nfs/dbraw/zinc/13/93/33/939139333.db2.gz FHCQQCMEINFGEK-UHFFFAOYSA-N 0 0 369.421 3.656 20 5 FHBDRN CCc1nc(C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)c(C)o1 ZINC000511829511 945231233 /nfs/dbraw/zinc/23/12/33/945231233.db2.gz JQCFXXZPTSWGOT-UHFFFAOYSA-N 0 0 358.379 3.829 20 5 FHBDRN O=C(N[C@H]1CCCC[C@@H]1O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000179458896 939162941 /nfs/dbraw/zinc/16/29/41/939162941.db2.gz XWNYIKKDWUXJGR-IRXDYDNUSA-N 0 0 372.446 3.779 20 5 FHBDRN COc1ccc(NC(=O)NCc2csc(-c3ccco3)n2)cc1[N+](=O)[O-] ZINC000543890882 945232628 /nfs/dbraw/zinc/23/26/28/945232628.db2.gz POSOWOROVPHYNO-UHFFFAOYSA-N 0 0 374.378 3.642 20 5 FHBDRN C/C(=C/C(=O)NC[C@@H]1CCN(c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000785226541 939185786 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372.396 3.731 20 5 FHBDRN O=[N+]([O-])c1cc(Br)cnc1NCCCOc1ccccc1 ZINC000052092455 940036016 /nfs/dbraw/zinc/03/60/16/940036016.db2.gz NBQIUEJXFMSYEV-UHFFFAOYSA-N 0 0 352.188 3.633 20 5 FHBDRN O=C(Nc1c(F)cccc1Cl)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000612391589 940038104 /nfs/dbraw/zinc/03/81/04/940038104.db2.gz YPCWUEWAHHSLAK-UHFFFAOYSA-N 0 0 360.732 3.825 20 5 FHBDRN CCCOc1cccc(NC(=O)C(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)c1 ZINC000411386333 940041222 /nfs/dbraw/zinc/04/12/22/940041222.db2.gz HUQGOYKPNIYLRC-UHFFFAOYSA-N 0 0 371.393 3.578 20 5 FHBDRN CCOc1ccccc1CN(C)C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000411515300 940056995 /nfs/dbraw/zinc/05/69/95/940056995.db2.gz VJDWOTKUKPGPAG-ZWKOTPCHSA-N 0 0 354.406 3.756 20 5 FHBDRN Cc1sc(C(=O)N[C@H]2CCCOc3c(F)cccc32)cc1[N+](=O)[O-] ZINC000179878448 940061655 /nfs/dbraw/zinc/06/16/55/940061655.db2.gz CLKKHCVNYVDMFH-LBPRGKRZSA-N 0 0 350.371 3.748 20 5 FHBDRN CCOc1ccc(NC(=O)Cc2c(F)c(OC)ccc2[N+](=O)[O-])c(C)c1 ZINC000411532349 940063347 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FHBDRN C[C@H]1CN(C(=O)c2c(Cl)cccc2[N+](=O)[O-])C[C@@H](c2ccccc2)O1 ZINC000136651313 940075715 /nfs/dbraw/zinc/07/57/15/940075715.db2.gz REXOQIJSGVEWSG-LRDDRELGSA-N 0 0 360.797 3.850 20 5 FHBDRN CCOc1cc(CN2CCC[C@@H]2c2nncn2CC(C)C)ccc1[N+](=O)[O-] ZINC000365190312 940079757 /nfs/dbraw/zinc/07/97/57/940079757.db2.gz NRAXBQMFDQJCQD-QGZVFWFLSA-N 0 0 373.457 3.578 20 5 FHBDRN COC(=O)c1ccc(NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1 ZINC000136657850 940086177 /nfs/dbraw/zinc/08/61/77/940086177.db2.gz VDZAOPGSXRDRQM-UHFFFAOYSA-N 0 0 369.377 3.578 20 5 FHBDRN CCN(Cc1cnn(C)c1)c1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000065945187 940087541 /nfs/dbraw/zinc/08/75/41/940087541.db2.gz BLIMDNGJBYOVLX-UHFFFAOYSA-N 0 0 364.405 3.586 20 5 FHBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N(C)C[C@@H]1CCC[C@@H]1O ZINC000124425070 945295229 /nfs/dbraw/zinc/29/52/29/945295229.db2.gz SOWLPWVLJQPDGF-BBRMVZONSA-N 0 0 366.483 3.576 20 5 FHBDRN O=[N+]([O-])c1ccc(I)c(OCCC(F)(F)F)c1 ZINC000780354411 940092460 /nfs/dbraw/zinc/09/24/60/940092460.db2.gz QJVLZKPHQCSACF-UHFFFAOYSA-N 0 0 361.057 3.531 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])N[C@H]1CCCOc2c(F)cccc21 ZINC000179898588 940093315 /nfs/dbraw/zinc/09/33/15/940093315.db2.gz AWVWPDXGZYRLDH-HNNXBMFYSA-N 0 0 374.368 3.533 20 5 FHBDRN O=[N+]([O-])c1ccc2nc(N3CC[C@H](n4ncc5ccccc54)C3)ccc2c1 ZINC000511352642 940095091 /nfs/dbraw/zinc/09/50/91/940095091.db2.gz VEKYTQCVOMFKNR-KRWDZBQOSA-N 0 0 359.389 3.944 20 5 FHBDRN O=C(c1cccc([N+](=O)[O-])c1Br)N1CC[C@@H](c2ccco2)C1 ZINC000365296840 940115110 /nfs/dbraw/zinc/11/51/10/940115110.db2.gz QJXMRSUKBDGUHP-SNVBAGLBSA-N 0 0 365.183 3.580 20 5 FHBDRN C[C@@H](c1ccc(F)cc1)N(C)C(=O)COc1cc([N+](=O)[O-])ccc1Cl ZINC000177327989 940117295 /nfs/dbraw/zinc/11/72/95/940117295.db2.gz SFWRJGSEVABHDZ-NSHDSACASA-N 0 0 366.776 3.986 20 5 FHBDRN C[C@@H]1C[C@]1(C(=O)Nc1ccc([N+](=O)[O-])c(Cl)c1)C(=O)OC(C)(C)C ZINC001125796789 940122727 /nfs/dbraw/zinc/12/27/27/940122727.db2.gz WERQYZAHHQUCCE-ABKXIKBNSA-N 0 0 354.790 3.555 20 5 FHBDRN O=C([C@@H]1CCC[C@H](C(F)(F)F)C1)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000615875792 940129222 /nfs/dbraw/zinc/12/92/22/940129222.db2.gz PGKZFCXDBTXMSA-NEPJUHHUSA-N 0 0 372.343 3.553 20 5 FHBDRN CC(C)c1cc(CNC(=O)c2c([N+](=O)[O-])cccc2C(F)(F)F)on1 ZINC000612545676 940137504 /nfs/dbraw/zinc/13/75/04/940137504.db2.gz LRYDJZOQMDKQHY-UHFFFAOYSA-N 0 0 357.288 3.655 20 5 FHBDRN O=C(N[C@@H]1CCCC(F)(F)C1)c1c([N+](=O)[O-])cccc1C(F)(F)F ZINC000612556008 940143054 /nfs/dbraw/zinc/14/30/54/940143054.db2.gz QEGUJENSQWNEOO-MRVPVSSYSA-N 0 0 352.259 3.921 20 5 FHBDRN Cc1oc(NC(=O)c2ccc(Br)c([N+](=O)[O-])c2)nc1C1CC1 ZINC000892504724 940144560 /nfs/dbraw/zinc/14/45/60/940144560.db2.gz ZVGOBVNTVZLJSS-UHFFFAOYSA-N 0 0 366.171 3.783 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1CCCSc2ccc(F)cc21 ZINC000427342262 945299793 /nfs/dbraw/zinc/29/97/93/945299793.db2.gz MYEXYWJUJKYRKO-UHFFFAOYSA-N 0 0 362.382 3.885 20 5 FHBDRN COc1ccc(N(Cc2ccccc2)C(=O)c2cc([N+](=O)[O-])cn2C)cc1 ZINC000612584740 940162684 /nfs/dbraw/zinc/16/26/84/940162684.db2.gz YFXZGPRHKKJJQV-UHFFFAOYSA-N 0 0 365.389 3.789 20 5 FHBDRN Cc1oc(-c2ccccc2)nc1CCNC(=O)c1c(C)cccc1[N+](=O)[O-] ZINC000365466340 940167770 /nfs/dbraw/zinc/16/77/70/940167770.db2.gz UKCMDONUOJSVRZ-UHFFFAOYSA-N 0 0 365.389 3.839 20 5 FHBDRN Cc1ccc(NC(=O)N(Cc2ccccc2)[C@H](CO)C2CC2)cc1[N+](=O)[O-] ZINC000179956814 940169443 /nfs/dbraw/zinc/16/94/43/940169443.db2.gz ZDLYBBSVOJXXTL-LJQANCHMSA-N 0 0 369.421 3.708 20 5 FHBDRN Cc1ccc(-c2ncco2)cc1NC(=O)COc1ccc([N+](=O)[O-])c(C)c1 ZINC000376002423 940170330 /nfs/dbraw/zinc/17/03/30/940170330.db2.gz CESQKFFWPHCIGS-UHFFFAOYSA-N 0 0 367.361 3.884 20 5 FHBDRN Cc1ccc(S(=O)(=O)N(Cc2ccccc2)CC2CCC2)cc1[N+](=O)[O-] ZINC000066001827 940175824 /nfs/dbraw/zinc/17/58/24/940175824.db2.gz OTFDVYNMQJJBSA-UHFFFAOYSA-N 0 0 374.462 3.894 20 5 FHBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1Cc2ccccc2S1 ZINC000540894012 940176153 /nfs/dbraw/zinc/17/61/53/940176153.db2.gz NNBYDUBIDCZMGF-INIZCTEOSA-N 0 0 362.838 3.624 20 5 FHBDRN CCC(=O)Nc1ccc(NC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000047549014 945301696 /nfs/dbraw/zinc/30/16/96/945301696.db2.gz ZSPCWZDIXCOAFT-GFCCVEGCSA-N 0 0 356.382 3.826 20 5 FHBDRN CC[NH+](CC)Cc1ccc(C(=O)Nc2cc(Cl)cc([N+](=O)[O-])c2[O-])o1 ZINC000612628191 940189689 /nfs/dbraw/zinc/18/96/89/940189689.db2.gz YQVMJJVYECRTGG-UHFFFAOYSA-N 0 0 367.789 3.641 20 5 FHBDRN COc1ccc(CNC(=O)N[C@@H]2CC(C)(C)c3ccccc32)cc1[N+](=O)[O-] ZINC000431663380 940196455 /nfs/dbraw/zinc/19/64/55/940196455.db2.gz UMGZGGMQSLMJLF-MRXNPFEDSA-N 0 0 369.421 3.825 20 5 FHBDRN COC(=O)[C@@H](Cc1ccc(Cl)cc1)Sc1ccc([N+](=O)[O-])cn1 ZINC000612656993 940206033 /nfs/dbraw/zinc/20/60/33/940206033.db2.gz LCFKXBDPNIQGDT-CYBMUJFWSA-N 0 0 352.799 3.520 20 5 FHBDRN COc1cc2c(cc1OC)CN(Cc1ccc(Cl)cc1[N+](=O)[O-])CC2 ZINC000135927128 940206745 /nfs/dbraw/zinc/20/67/45/940206745.db2.gz RDGLPXMOJIWQRS-UHFFFAOYSA-N 0 0 362.813 3.824 20 5 FHBDRN Cc1cc(NC(=O)c2cc(F)c([N+](=O)[O-])cc2F)nn1-c1ccc(C)cc1 ZINC000124496244 945303221 /nfs/dbraw/zinc/30/32/21/945303221.db2.gz WNLJBJMPYPMPMB-UHFFFAOYSA-N 0 0 372.331 3.928 20 5 FHBDRN CC[C@@H](C)NC(=O)c1ccc(NC(=O)c2cccc(C)c2[N+](=O)[O-])c(C)c1 ZINC000066035327 940212933 /nfs/dbraw/zinc/21/29/33/940212933.db2.gz NREOFZMVUCYGCJ-CQSZACIVSA-N 0 0 369.421 3.992 20 5 FHBDRN Cc1nsc(C)c1-c1noc(-c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)n1 ZINC000426595347 945304928 /nfs/dbraw/zinc/30/49/28/945304928.db2.gz YBBVTEXAMSVZRE-UHFFFAOYSA-N 0 0 368.378 3.571 20 5 FHBDRN O=[N+]([O-])c1cnc(NC2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)nc1 ZINC000612778523 940271891 /nfs/dbraw/zinc/27/18/91/940271891.db2.gz SCDITIKWSAPRKV-RNFRBKRXSA-N 0 0 358.242 3.706 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CCSc3ccccc32)c1 ZINC000548959093 940275732 /nfs/dbraw/zinc/27/57/32/940275732.db2.gz JTUMHIMHJIWRCL-OAHLLOKOSA-N 0 0 358.419 3.960 20 5 FHBDRN Cc1ccc(NC(=O)NCc2ncc(-c3ccccc3)cn2)cc1[N+](=O)[O-] ZINC000184379867 945310171 /nfs/dbraw/zinc/31/01/71/945310171.db2.gz MBZBHQKRBPYSEI-UHFFFAOYSA-N 0 0 363.377 3.682 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)NCCc2cccc(Cl)c2)c1 ZINC000018106228 945310711 /nfs/dbraw/zinc/31/07/11/945310711.db2.gz MZUXSOMXAGZLIB-UHFFFAOYSA-N 0 0 350.827 3.943 20 5 FHBDRN O=[N+]([O-])c1ccc2sc(-c3nc(COCC(F)(F)F)no3)cc2c1 ZINC000612874385 940321985 /nfs/dbraw/zinc/32/19/85/940321985.db2.gz RWLISPBTFJZGDH-UHFFFAOYSA-N 0 0 359.285 3.938 20 5 FHBDRN O=[N+]([O-])c1cccc(OCC[N@@H+]2CC3(CCOCC3)[C@@H]2c2ccccc2)c1 ZINC000412003159 940328598 /nfs/dbraw/zinc/32/85/98/940328598.db2.gz WMYZZZHIILWDEL-FQEVSTJZSA-N 0 0 368.433 3.827 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@H](C)c1ccc(OC(F)F)cc1 ZINC000511393052 940330076 /nfs/dbraw/zinc/33/00/76/940330076.db2.gz YOCAVELDBCBATM-LLVKDONJSA-N 0 0 350.321 3.996 20 5 FHBDRN COc1cccc([C@@H](C)c2noc(-c3cc4c(c([N+](=O)[O-])c3)OCO4)n2)c1 ZINC000612918315 940336101 /nfs/dbraw/zinc/33/61/01/940336101.db2.gz YZTAQBCYAWUFNF-SNVBAGLBSA-N 0 0 369.333 3.534 20 5 FHBDRN COc1cccc([C@@H](C)c2noc(CN(C)c3ccccc3[N+](=O)[O-])n2)c1 ZINC000612918226 940336222 /nfs/dbraw/zinc/33/62/22/940336222.db2.gz YJASUEAAKNIGJU-CYBMUJFWSA-N 0 0 368.393 3.775 20 5 FHBDRN Cc1cccc(-c2noc(-c3ccc([N+](=O)[O-])cc3Br)n2)n1 ZINC000612910791 940336839 /nfs/dbraw/zinc/33/68/39/940336839.db2.gz KCEVETOXAIRUGB-UHFFFAOYSA-N 0 0 361.155 3.778 20 5 FHBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)c1nc([C@@H]2CCC[C@@H](C)C2)no1 ZINC000612911191 940337494 /nfs/dbraw/zinc/33/74/94/940337494.db2.gz PCYHJRZWLRJDFY-JHJVBQTASA-N 0 0 358.398 3.763 20 5 FHBDRN O=[N+]([O-])c1ccccc1NCCc1noc(-c2cc3ccsc3[nH]2)n1 ZINC000612928368 940341520 /nfs/dbraw/zinc/34/15/20/940341520.db2.gz NPUOGPANPVBIIL-UHFFFAOYSA-N 0 0 355.379 3.842 20 5 FHBDRN Cc1cc(C)cc(-c2noc([C@H](C)NC(=O)c3cccc([N+](=O)[O-])c3)n2)c1 ZINC000612932975 940343943 /nfs/dbraw/zinc/34/39/43/940343943.db2.gz NXBDBVGMBHCMGF-ZDUSSCGKSA-N 0 0 366.377 3.753 20 5 FHBDRN Cc1ccsc1C(=O)Nc1ccc(Oc2c([N+](=O)[O-])ncn2C)cc1 ZINC000511397394 940344625 /nfs/dbraw/zinc/34/46/25/940344625.db2.gz WHOLOYOZTHVGKJ-UHFFFAOYSA-N 0 0 358.379 3.743 20 5 FHBDRN COc1ccc2c(c1)OC[C@H](c1nc(-c3ccc([N+](=O)[O-])cc3C)no1)C2 ZINC000612935441 940344860 /nfs/dbraw/zinc/34/48/60/940344860.db2.gz PFMBZPPOYVWZEE-CYBMUJFWSA-N 0 0 367.361 3.681 20 5 FHBDRN Cc1ccc(-c2nnc([C@@H](C)Oc3ccc([N+](=O)[O-])cc3C=O)o2)cc1 ZINC000177668016 940348814 /nfs/dbraw/zinc/34/88/14/940348814.db2.gz ARFQJIAJXWVGPR-GFCCVEGCSA-N 0 0 353.334 3.906 20 5 FHBDRN C[C@H]1CCCC[C@H]1NC(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000086971289 945316865 /nfs/dbraw/zinc/31/68/65/945316865.db2.gz KQHHDKFNVBXUOJ-IINYFYTJSA-N 0 0 355.232 3.595 20 5 FHBDRN O=[N+]([O-])c1ccccc1OCc1nc([C@@H]2CCc3ccccc3C2)no1 ZINC000612951727 940356144 /nfs/dbraw/zinc/35/61/44/940356144.db2.gz MBOSUOVGWBFYTJ-OAHLLOKOSA-N 0 0 351.362 3.829 20 5 FHBDRN Cc1cc(Cc2noc([C@@H]3Cc4cc(F)ccc4O3)n2)ccc1[N+](=O)[O-] ZINC000612958004 940360621 /nfs/dbraw/zinc/36/06/21/940360621.db2.gz JSXMANKPGVOBHB-INIZCTEOSA-N 0 0 355.325 3.692 20 5 FHBDRN CC(C)(C)c1cc(-c2nc(Cc3c[nH]c4ccc([N+](=O)[O-])cc34)no2)n[nH]1 ZINC000612961981 940363638 /nfs/dbraw/zinc/36/36/38/940363638.db2.gz CURSWEYWSFFYOO-UHFFFAOYSA-N 0 0 366.381 3.738 20 5 FHBDRN O=[N+]([O-])c1ccc(Cc2noc(C3(c4ccc(F)cc4)CCC3)n2)nc1 ZINC000612969223 940367496 /nfs/dbraw/zinc/36/74/96/940367496.db2.gz OKVIYVGMJDFWNC-UHFFFAOYSA-N 0 0 354.341 3.573 20 5 FHBDRN Cc1cc(OCC(=O)N2CCC[C@H]2Cc2cccc(F)c2)ccc1[N+](=O)[O-] ZINC000431710408 940370117 /nfs/dbraw/zinc/37/01/17/940370117.db2.gz RWSNVBHVKXIKQV-KRWDZBQOSA-N 0 0 372.396 3.655 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CCCC[C@H]2CC)cc1OC ZINC000124619211 945312838 /nfs/dbraw/zinc/31/28/38/945312838.db2.gz ZVPLOOWBROXTMC-TZMCWYRMSA-N 0 0 350.415 3.701 20 5 FHBDRN CC[C@H](C)[C@@H](NC(=O)c1nn(CC)cc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000427358999 945313891 /nfs/dbraw/zinc/31/38/91/945313891.db2.gz TVVYYAVFCLAPBT-XHDPSFHLSA-N 0 0 364.833 3.982 20 5 FHBDRN CCOc1cccc(N(C)Cc2ccc(C(=O)NC3CC3)cc2)c1[N+](=O)[O-] ZINC000613041637 940412540 /nfs/dbraw/zinc/41/25/40/940412540.db2.gz 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O=C(c1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CC[C@H](c2cccnc2)C1 ZINC000580077194 940452016 /nfs/dbraw/zinc/45/20/16/940452016.db2.gz PJPNXYYCIQKKCS-LBPRGKRZSA-N 0 0 365.311 3.638 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])N1CC[C@@](F)(c2ccccc2F)C1 ZINC000548991641 940453242 /nfs/dbraw/zinc/45/32/42/940453242.db2.gz LLXAVXQFRWEFCZ-SFHVURJKSA-N 0 0 361.348 3.514 20 5 FHBDRN Cc1ccc(C(=O)NCCc2ccc([N+](=O)[O-])cc2)c(Br)c1 ZINC000162153200 940454468 /nfs/dbraw/zinc/45/44/68/940454468.db2.gz BEXRSJKMOMRMAD-UHFFFAOYSA-N 0 0 363.211 3.638 20 5 FHBDRN CCOc1ccc([C@H](C)NCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1 ZINC000124829818 945322257 /nfs/dbraw/zinc/32/22/57/945322257.db2.gz JQHDBXXAYQEIOS-ZDUSSCGKSA-N 0 0 368.393 3.894 20 5 FHBDRN Cc1ccc(CS(=O)(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1C ZINC000580237748 940470268 /nfs/dbraw/zinc/47/02/68/940470268.db2.gz DKLGZVGMPGDKJE-OAHLLOKOSA-N 0 0 362.451 3.701 20 5 FHBDRN CC(C)c1cc(C(=O)N(C)c2ccc([N+](=O)[O-])nc2)c2ccccc2n1 ZINC000580373496 940472301 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CCCC(=O)N1CCCC[C@H]1c1nc(-c2ccc(C)c([N+](=O)[O-])c2)no1 ZINC000290189900 940677114 /nfs/dbraw/zinc/67/71/14/940677114.db2.gz TUEMTRMWKWTJLE-AWEZNQCLSA-N 0 0 358.398 3.807 20 5 FHBDRN O=C(Cc1cccc([N+](=O)[O-])c1)Nc1nc(-c2cccc(O)c2)cs1 ZINC000173871674 940680479 /nfs/dbraw/zinc/68/04/79/940680479.db2.gz WSHSNXBVZHXCLQ-UHFFFAOYSA-N 0 0 355.375 3.605 20 5 FHBDRN O=[N+]([O-])c1cc(NS(=O)(=O)/C=C/c2ccccc2Cl)ccc1F ZINC000066577143 940684990 /nfs/dbraw/zinc/68/49/90/940684990.db2.gz HGTCCUIKWVJWDE-BQYQJAHWSA-N 0 0 356.762 3.800 20 5 FHBDRN COc1cc(CN2CC3(CCOCC3)[C@@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000412015862 940690072 /nfs/dbraw/zinc/69/00/72/940690072.db2.gz UILNKANSFWLGRB-FQEVSTJZSA-N 0 0 368.433 3.957 20 5 FHBDRN O=C(Nc1ccc(NC(=O)c2ccc(F)cc2[N+](=O)[O-])cc1)c1ccco1 ZINC000160646817 940693698 /nfs/dbraw/zinc/69/36/98/940693698.db2.gz OMONETHZQIWPQF-UHFFFAOYSA-N 0 0 369.308 3.832 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(F)c(Br)c2)c1 ZINC000174110520 940703493 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COc1ccc(NC(=O)Cc2ccc(OCC(C)C)cc2)c([N+](=O)[O-])c1 ZINC000106600558 945345598 /nfs/dbraw/zinc/34/55/98/945345598.db2.gz XKIZZFRVAFNXIJ-UHFFFAOYSA-N 0 0 358.394 3.819 20 5 FHBDRN CC(C)CCSc1ccc(C(=O)N[C@@H]2CCCOC2)cc1[N+](=O)[O-] ZINC000111129482 945346843 /nfs/dbraw/zinc/34/68/43/945346843.db2.gz PLXQLLKVTFPTRD-CQSZACIVSA-N 0 0 352.456 3.642 20 5 FHBDRN CC(C)(C(=O)Nc1cnn(-c2ccccc2F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000426616475 945347725 /nfs/dbraw/zinc/34/77/25/945347725.db2.gz WFJXNCBCCVNYER-UHFFFAOYSA-N 0 0 368.368 3.836 20 5 FHBDRN CN(C[C@@H]1CCCO1)C(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000170679102 940779183 /nfs/dbraw/zinc/77/91/83/940779183.db2.gz BRAHAJKAHBFFPE-INIZCTEOSA-N 0 0 355.394 3.589 20 5 FHBDRN Cn1ccnc1COc1ccc(NC(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC000170697179 940783533 /nfs/dbraw/zinc/78/35/33/940783533.db2.gz PVFJMLGSSIIZIX-UHFFFAOYSA-N 0 0 367.365 3.551 20 5 FHBDRN Cc1cc(S(=O)(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)sc1Cl ZINC000473862001 945348674 /nfs/dbraw/zinc/34/86/74/945348674.db2.gz YCFGVWQMJCZIRQ-JTQLQIEISA-N 0 0 374.871 3.966 20 5 FHBDRN COC(=O)c1cccc(-c2noc(-c3c[nH]c4ccc([N+](=O)[O-])cc43)n2)c1 ZINC000174882571 940789203 /nfs/dbraw/zinc/78/92/03/940789203.db2.gz ZBRRYEWBHFKIAG-UHFFFAOYSA-N 0 0 364.317 3.580 20 5 FHBDRN CSc1cccc(C(=O)N2CCC(c3ccccn3)CC2)c1[N+](=O)[O-] ZINC000376336295 940794396 /nfs/dbraw/zinc/79/43/96/940794396.db2.gz VIXLJHQHNJWZCM-UHFFFAOYSA-N 0 0 357.435 3.732 20 5 FHBDRN Cc1nc(CCC(=O)NCc2cccc([N+](=O)[O-])c2)oc1-c1ccccc1 ZINC000106635446 945349141 /nfs/dbraw/zinc/34/91/41/945349141.db2.gz NKUJBRNOWMFYFH-UHFFFAOYSA-N 0 0 365.389 3.807 20 5 FHBDRN Cc1nc(-c2ccc(CNC(=O)c3c(N)cccc3[N+](=O)[O-])cc2)cs1 ZINC000540928897 940800665 /nfs/dbraw/zinc/80/06/65/940800665.db2.gz IUXRAZXKWHMPBV-UHFFFAOYSA-N 0 0 368.418 3.539 20 5 FHBDRN O=C(Cc1cc2ccccc2o1)Nc1ccnn1-c1ccc([N+](=O)[O-])cc1 ZINC000609453462 940805933 /nfs/dbraw/zinc/80/59/33/940805933.db2.gz QRXUXGMQTAWUMZ-UHFFFAOYSA-N 0 0 362.345 3.708 20 5 FHBDRN CC(C)N(C)c1cccc(NC(=O)CCNc2ccccc2[N+](=O)[O-])c1 ZINC000609454913 940812633 /nfs/dbraw/zinc/81/26/33/940812633.db2.gz WDHOKFDVADVLLI-UHFFFAOYSA-N 0 0 356.426 3.880 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)Nc2cccc(OCCF)c2)c1 ZINC000470137542 940828440 /nfs/dbraw/zinc/82/84/40/940828440.db2.gz UNCFOJMXFDQJBC-UHFFFAOYSA-N 0 0 350.371 3.917 20 5 FHBDRN CCS[C@H]1CCCC[C@@H]1NC(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000175246670 940836193 /nfs/dbraw/zinc/83/61/93/940836193.db2.gz BCEBJWPWOCDHNK-BBRMVZONSA-N 0 0 352.456 3.544 20 5 FHBDRN C[C@@H](CCc1ccc(O)cc1)NC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000175338638 940848414 /nfs/dbraw/zinc/84/84/14/940848414.db2.gz INMMCZQIGQYSCY-AWEZNQCLSA-N 0 0 371.437 3.856 20 5 FHBDRN O=C(N[C@@H]1CCCc2occc21)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000180251802 940876375 /nfs/dbraw/zinc/87/63/75/940876375.db2.gz WTUXHAYZSFGZFC-GFCCVEGCSA-N 0 0 352.293 3.597 20 5 FHBDRN O=C(COc1cccc([N+](=O)[O-])c1)Nc1c(F)cccc1Br ZINC000175526487 940877014 /nfs/dbraw/zinc/87/70/14/940877014.db2.gz ZUSFRHAYXRSLQT-UHFFFAOYSA-N 0 0 369.146 3.514 20 5 FHBDRN CSc1ccccc1N(C)C(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000582807864 940885986 /nfs/dbraw/zinc/88/59/86/940885986.db2.gz KNEMDGAYXCSUQY-UHFFFAOYSA-N 0 0 352.362 3.800 20 5 FHBDRN Cc1cc(NCc2ccc(C(N)=O)cc2[N+](=O)[O-])ccc1-c1ccncc1 ZINC000427420037 945357752 /nfs/dbraw/zinc/35/77/52/945357752.db2.gz IMVBETVBFOBBQZ-UHFFFAOYSA-N 0 0 362.389 3.676 20 5 FHBDRN CN(c1ccccc1)c1ccc(CNc2cccc(CO)n2)cc1[N+](=O)[O-] ZINC000472580183 940938208 /nfs/dbraw/zinc/93/82/08/940938208.db2.gz KKWHWPYTMWOPKF-UHFFFAOYSA-N 0 0 364.405 3.862 20 5 FHBDRN COc1cc(CNc2ccccc2F)c([N+](=O)[O-])cc1OCC(F)F ZINC000180311283 940945517 /nfs/dbraw/zinc/94/55/17/940945517.db2.gz KSRYYPKVLJZWNS-UHFFFAOYSA-N 0 0 356.300 3.999 20 5 FHBDRN C[C@@H](NC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1cccc(O)c1 ZINC000175887891 940947242 /nfs/dbraw/zinc/94/72/42/940947242.db2.gz OXKNGCSYZHLBBL-SECBINFHSA-N 0 0 354.284 3.810 20 5 FHBDRN O=C1NCCc2c(N[C@H]3CCC[C@@H]3Cc3ccccc3[N+](=O)[O-])cccc21 ZINC000414322032 940968049 /nfs/dbraw/zinc/96/80/49/940968049.db2.gz RUSKZNYSZOYCNU-KDOFPFPSSA-N 0 0 365.433 3.704 20 5 FHBDRN Cc1ccc(NC(=O)Cc2ccc([N+](=O)[O-])cc2Br)c(C)n1 ZINC000176186806 940997643 /nfs/dbraw/zinc/99/76/43/940997643.db2.gz BQPNISZPEJHWGE-UHFFFAOYSA-N 0 0 364.199 3.550 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1cccc(Br)n1 ZINC000180391677 941002623 /nfs/dbraw/zinc/00/26/23/941002623.db2.gz HCBYQOUSUOLYFR-UHFFFAOYSA-N 0 0 350.172 3.621 20 5 FHBDRN Cc1cc(C(=O)N2CCC[C@H]2CC(=O)c2cccs2)ccc1[N+](=O)[O-] ZINC000176211560 941004280 /nfs/dbraw/zinc/00/42/80/941004280.db2.gz SHVIDOMQEFGEFO-AWEZNQCLSA-N 0 0 358.419 3.842 20 5 FHBDRN Cc1c([C@H](C)NCc2ccc([N+](=O)[O-])cc2)nnn1-c1cccc(Cl)c1 ZINC000180417589 941004625 /nfs/dbraw/zinc/00/46/25/941004625.db2.gz PKQJMQDHPANWNP-LBPRGKRZSA-N 0 0 371.828 3.988 20 5 FHBDRN Cc1ccccc1Cc1nnc(CN[C@@H](C)c2cccc([N+](=O)[O-])c2)o1 ZINC000180407156 941005848 /nfs/dbraw/zinc/00/58/48/941005848.db2.gz QJNOZNCREFTZJY-AWEZNQCLSA-N 0 0 352.394 3.728 20 5 FHBDRN Cc1ccccc1Cc1nnc(CN[C@H](C)c2cccc([N+](=O)[O-])c2)o1 ZINC000180407174 941005937 /nfs/dbraw/zinc/00/59/37/941005937.db2.gz QJNOZNCREFTZJY-CQSZACIVSA-N 0 0 352.394 3.728 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)Nc2cncnc2N2CCCC2)cc1[N+](=O)[O-] ZINC000180489990 941028594 /nfs/dbraw/zinc/02/85/94/941028594.db2.gz FXMSLKXCPHOEAM-UHFFFAOYSA-N 0 0 369.425 3.535 20 5 FHBDRN CS[C@@H]1CCC[C@H](NC(=O)c2cccc([N+](=O)[O-])c2Br)C1 ZINC000180568128 941043958 /nfs/dbraw/zinc/04/39/58/941043958.db2.gz KGZLOQNLIJSQBE-VHSXEESVSA-N 0 0 373.272 3.761 20 5 FHBDRN COc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)cc1F ZINC000180559331 941047318 /nfs/dbraw/zinc/04/73/18/941047318.db2.gz HUTBPYYNPKBOLD-UHFFFAOYSA-N 0 0 356.256 3.596 20 5 FHBDRN O=C(C[C@H]1CCC2(CCOCC2)CO1)Oc1cc(Cl)ccc1[N+](=O)[O-] ZINC000892635427 941048963 /nfs/dbraw/zinc/04/89/63/941048963.db2.gz FSVSVEZILZFGBM-CYBMUJFWSA-N 0 0 369.801 3.520 20 5 FHBDRN Nc1cccc([N+](=O)[O-])c1C(=O)NCC(c1ccccc1)c1ccccc1 ZINC000180653321 941059865 /nfs/dbraw/zinc/05/98/65/941059865.db2.gz WFRZWZBZDCMJAQ-UHFFFAOYSA-N 0 0 361.401 3.739 20 5 FHBDRN O=C(Nc1ccccc1Nc1ccc(F)cc1F)c1n[nH]cc1[N+](=O)[O-] ZINC000180672735 941061611 /nfs/dbraw/zinc/06/16/11/941061611.db2.gz VJCCHYXSXNIYNH-UHFFFAOYSA-N 0 0 359.292 3.592 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1COC(=O)C[C@@H](C)c1ccccc1OC ZINC000728663844 941063730 /nfs/dbraw/zinc/06/37/30/941063730.db2.gz OCIJVKVZGIPGOU-CYBMUJFWSA-N 0 0 359.378 3.849 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1COC(=O)C[C@H](C)c1ccccc1OC ZINC000728663846 941063996 /nfs/dbraw/zinc/06/39/96/941063996.db2.gz OCIJVKVZGIPGOU-ZDUSSCGKSA-N 0 0 359.378 3.849 20 5 FHBDRN CCC[C@@H]1CCc2nc(NC(=O)c3c(N)cccc3[N+](=O)[O-])sc2C1 ZINC000180728728 941069517 /nfs/dbraw/zinc/06/95/17/941069517.db2.gz ZWMOPTKVANSQJW-SNVBAGLBSA-N 0 0 360.439 3.791 20 5 FHBDRN Nc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc2[nH]c(C3CCC3)nc2c1 ZINC000180729451 941069680 /nfs/dbraw/zinc/06/96/80/941069680.db2.gz UZWBEZRLUMWJEV-UHFFFAOYSA-N 0 0 351.366 3.573 20 5 FHBDRN O=C(Cc1ccc(-n2cccn2)cc1)Nc1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000176703903 941070296 /nfs/dbraw/zinc/07/02/96/941070296.db2.gz GPNNRSOAIRTGDS-UHFFFAOYSA-N 0 0 373.372 3.510 20 5 FHBDRN CC(C)NC(=O)c1ccc(NC[C@H](c2cccnc2)C(C)C)c([N+](=O)[O-])c1 ZINC000176746387 941072867 /nfs/dbraw/zinc/07/28/67/941072867.db2.gz OLFOKTRTZFJLNO-KRWDZBQOSA-N 0 0 370.453 3.980 20 5 FHBDRN Cc1ccc(C(C)(C)C(=O)OCC(=O)Nc2ccc([N+](=O)[O-])cc2C)cc1 ZINC000728665552 941077932 /nfs/dbraw/zinc/07/79/32/941077932.db2.gz GEIRLPFWQCUZFV-UHFFFAOYSA-N 0 0 370.405 3.671 20 5 FHBDRN CCS[C@H]1CCC[C@@H](NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)C1 ZINC000540998538 941084405 /nfs/dbraw/zinc/08/44/05/941084405.db2.gz XHYLNRNRVLUGLL-NEPJUHHUSA-N 0 0 374.409 3.990 20 5 FHBDRN CN(c1ccccc1)C1CCN(Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000177025699 941094725 /nfs/dbraw/zinc/09/47/25/941094725.db2.gz FNACMSYIEWXDKW-UHFFFAOYSA-N 0 0 366.421 3.837 20 5 FHBDRN CCCS(=O)(=O)Nc1ccc(Nc2nc(C)cc(C)c2[N+](=O)[O-])cc1 ZINC000541007452 941096608 /nfs/dbraw/zinc/09/66/08/941096608.db2.gz RJEGMHZKBVJOKL-UHFFFAOYSA-N 0 0 364.427 3.502 20 5 FHBDRN CO[C@@H](CNC(=O)c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1)C1CC1 ZINC000511512273 941100199 /nfs/dbraw/zinc/10/01/99/941100199.db2.gz BKQTZGJRHHENIH-SFHVURJKSA-N 0 0 372.446 3.901 20 5 FHBDRN COc1ccccc1-c1csc(NC(=O)c2c(N)cccc2[N+](=O)[O-])n1 ZINC000181058070 941106134 /nfs/dbraw/zinc/10/61/34/941106134.db2.gz VGCCKTIPZJHZQD-UHFFFAOYSA-N 0 0 370.390 3.561 20 5 FHBDRN CC[C@H]1CN(C(=O)c2c(N)cccc2[N+](=O)[O-])CC[C@@H]1c1ccccc1 ZINC000181148589 941109094 /nfs/dbraw/zinc/10/90/94/941109094.db2.gz XVNBSYGXJLDQDB-HOCLYGCPSA-N 0 0 353.422 3.833 20 5 FHBDRN C[C@@H](Cc1ccccc1C(F)(F)F)NC(=O)c1ccccc1[N+](=O)[O-] ZINC000181203663 941110705 /nfs/dbraw/zinc/11/07/05/941110705.db2.gz CXALQWHNHQCICI-NSHDSACASA-N 0 0 352.312 3.975 20 5 FHBDRN Nc1cccc([N+](=O)[O-])c1C(=O)NCCc1ccc(-c2ccccc2)cc1 ZINC000181217939 941114830 /nfs/dbraw/zinc/11/48/30/941114830.db2.gz UCEBXEMDUHDFGZ-UHFFFAOYSA-N 0 0 361.401 3.817 20 5 FHBDRN CCCCc1nc(CS(=O)(=O)Cc2ccccc2[N+](=O)[O-])cs1 ZINC000414415059 941118219 /nfs/dbraw/zinc/11/82/19/941118219.db2.gz OMTWBEJCIMKZOP-UHFFFAOYSA-N 0 0 354.453 3.509 20 5 FHBDRN C[C@H]1c2nnc(C3CCCC3)n2CCN1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000376534509 941119449 /nfs/dbraw/zinc/11/94/49/941119449.db2.gz USMQKXXRWWTCCX-LBPRGKRZSA-N 0 0 359.405 3.560 20 5 FHBDRN CCOc1ccc(C2=CCN(C(=O)c3c(N)cccc3[N+](=O)[O-])CC2)cc1 ZINC000181302502 941120480 /nfs/dbraw/zinc/12/04/80/941120480.db2.gz BSSZQMOFAXPDFT-UHFFFAOYSA-N 0 0 367.405 3.505 20 5 FHBDRN Cc1c(CS(=O)(=O)CCc2ccc(Cl)cc2)cccc1[N+](=O)[O-] ZINC000414420766 941122371 /nfs/dbraw/zinc/12/23/71/941122371.db2.gz WVLSQDURMJHYOC-UHFFFAOYSA-N 0 0 353.827 3.714 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CCOc3c(F)cccc32)c1 ZINC000188960946 941134030 /nfs/dbraw/zinc/13/40/30/941134030.db2.gz LNXGQHLKZOBIPR-AWEZNQCLSA-N 0 0 362.382 3.709 20 5 FHBDRN O=C(Nc1ccc(OCc2ccccc2)cc1[N+](=O)[O-])[C@@H]1CCCCO1 ZINC000188970720 941135552 /nfs/dbraw/zinc/13/55/52/941135552.db2.gz RKHNSGVEJCGAFR-SFHVURJKSA-N 0 0 356.378 3.681 20 5 FHBDRN COc1cc(C(=O)Nc2cccc3ccc(C)nc32)c([N+](=O)[O-])cc1F ZINC001125837137 941145007 /nfs/dbraw/zinc/14/50/07/941145007.db2.gz LVZVFHNSJCXDHS-UHFFFAOYSA-N 0 0 355.325 3.851 20 5 FHBDRN CCC1CCC(N(C(=O)C(=O)Nc2cccc([N+](=O)[O-])c2C)C2CC2)CC1 ZINC000189058975 941145983 /nfs/dbraw/zinc/14/59/83/941145983.db2.gz WLLLCVQCGYHLCP-UHFFFAOYSA-N 0 0 373.453 3.802 20 5 FHBDRN O=C(Cc1cccc([N+](=O)[O-])c1)Nc1cc(F)cc(F)c1Br ZINC000189064987 941146071 /nfs/dbraw/zinc/14/60/71/941146071.db2.gz QKPVFTPGWYOBIC-UHFFFAOYSA-N 0 0 371.137 3.817 20 5 FHBDRN COc1ccc(CC(C)(C)NC(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)cc1 ZINC000189158316 941148069 /nfs/dbraw/zinc/14/80/69/941148069.db2.gz TUPBSGRSHVQRLS-ZDUSSCGKSA-N 0 0 374.412 3.984 20 5 FHBDRN Cc1ccc([C@H](C)NCc2nc(-c3ccccc3F)no2)cc1[N+](=O)[O-] ZINC000189170241 941149361 /nfs/dbraw/zinc/14/93/61/941149361.db2.gz CVDYEIFOFRFTEB-LBPRGKRZSA-N 0 0 356.357 3.943 20 5 FHBDRN Cc1cnc([C@@H](C)NC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)s1 ZINC000177918502 941153123 /nfs/dbraw/zinc/15/31/23/941153123.db2.gz BEKPRQSJRNXBGI-MNOVXSKESA-N 0 0 351.453 3.718 20 5 FHBDRN CN(CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)CC1(c2ccccc2)CC1 ZINC000189289054 941155468 /nfs/dbraw/zinc/15/54/68/941155468.db2.gz PYWXDJOZKDDRBQ-UHFFFAOYSA-N 0 0 373.840 3.850 20 5 FHBDRN O=C(Nc1ccsc1Cl)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000189331817 941156339 /nfs/dbraw/zinc/15/63/39/941156339.db2.gz JKAKNSPAAIGXRM-UHFFFAOYSA-N 0 0 366.830 3.664 20 5 FHBDRN COc1cc(C(=O)Nc2ccccc2-n2ccc(C)n2)cc([N+](=O)[O-])c1C ZINC000189338073 941156383 /nfs/dbraw/zinc/15/63/83/941156383.db2.gz SUYOAFQFJGJCLM-UHFFFAOYSA-N 0 0 366.377 3.658 20 5 FHBDRN CCCOc1ccc(NC(=O)C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)c(C)c1 ZINC000189282815 941156754 /nfs/dbraw/zinc/15/67/54/941156754.db2.gz RUQMAQYDMYOIHY-UHFFFAOYSA-N 0 0 371.393 3.578 20 5 FHBDRN Cc1c(NC(=O)NCCc2ccccc2OC(F)F)cccc1[N+](=O)[O-] ZINC000189448092 941158197 /nfs/dbraw/zinc/15/81/97/941158197.db2.gz NEZHMYOZVCHUAJ-UHFFFAOYSA-N 0 0 365.336 3.869 20 5 FHBDRN COC[C@@H](Cc1ccccc1)N(C)C(=O)c1cc(SC)ccc1[N+](=O)[O-] ZINC000189502228 941159212 /nfs/dbraw/zinc/15/92/12/941159212.db2.gz GDWJKEZTRKSLMY-OAHLLOKOSA-N 0 0 374.462 3.646 20 5 FHBDRN CC[C@@](C)(O)CN(Cc1ccccc1)C(=O)c1ccc([N+](=O)[O-])cc1C ZINC000189496113 941159234 /nfs/dbraw/zinc/15/92/34/941159234.db2.gz OJVCYBVQFHUFPF-HXUWFJFHSA-N 0 0 356.422 3.707 20 5 FHBDRN CC[C@](C)(O)CN(Cc1ccccc1)C(=O)c1cc(C)cc([N+](=O)[O-])c1 ZINC000189496562 941159292 /nfs/dbraw/zinc/15/92/92/941159292.db2.gz JJYZWPUEXYEUAB-FQEVSTJZSA-N 0 0 356.422 3.707 20 5 FHBDRN COc1cnccc1[C@@H](C)NCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000189544339 941161097 /nfs/dbraw/zinc/16/10/97/941161097.db2.gz RSHVDCZHIHAAMU-GFCCVEGCSA-N 0 0 370.434 3.973 20 5 FHBDRN O=[N+]([O-])c1ccc(F)cc1OCc1cn(-c2ccc(F)c(Cl)c2)nn1 ZINC000782892744 941165551 /nfs/dbraw/zinc/16/55/51/941165551.db2.gz TYIGDWVKYZZXPJ-UHFFFAOYSA-N 0 0 366.711 3.686 20 5 FHBDRN CN(C(=O)Cc1ccc([N+](=O)[O-])cc1Br)c1ccc(F)cc1 ZINC000124019221 941211897 /nfs/dbraw/zinc/21/18/97/941211897.db2.gz RGCORFMRWSRJHJ-UHFFFAOYSA-N 0 0 367.174 3.702 20 5 FHBDRN COc1ccc(F)cc1[C@H](C)NC(=O)C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000431833459 941262479 /nfs/dbraw/zinc/26/24/79/941262479.db2.gz OQIVNJZVDPHUCV-LBPRGKRZSA-N 0 0 360.385 3.898 20 5 FHBDRN CC(C)c1ccc(C(=O)NCCCCNc2ccccn2)cc1[N+](=O)[O-] ZINC000189712489 941264816 /nfs/dbraw/zinc/26/48/16/941264816.db2.gz MNMRDUIRBWWRFU-UHFFFAOYSA-N 0 0 356.426 3.735 20 5 FHBDRN Cc1ccc(OCCNC(=O)CCCNc2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000024388794 941274247 /nfs/dbraw/zinc/27/42/47/941274247.db2.gz AUHNQSHMCOVXQA-UHFFFAOYSA-N 0 0 371.437 3.599 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)NCCc1ccccc1OC(F)F ZINC000189784961 941277536 /nfs/dbraw/zinc/27/75/36/941277536.db2.gz XKGGOBSAVKYCLX-UHFFFAOYSA-N 0 0 365.336 3.869 20 5 FHBDRN CC1(C)CN(C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)CC(C)(C)O1 ZINC000189793638 941281019 /nfs/dbraw/zinc/28/10/19/941281019.db2.gz UVXVABRQELMEGW-UHFFFAOYSA-N 0 0 373.356 3.618 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H](C)Oc3c(Cl)cccc32)c1 ZINC000189840634 941287348 /nfs/dbraw/zinc/28/73/48/941287348.db2.gz XEMULDXXVNGKHB-SNVBAGLBSA-N 0 0 362.769 3.685 20 5 FHBDRN COc1ccc(C(=O)N2C[C@@H](C)Oc3c(Cl)cccc32)cc1[N+](=O)[O-] ZINC000189847815 941288378 /nfs/dbraw/zinc/28/83/78/941288378.db2.gz FYLAMZXQCWDEBP-SNVBAGLBSA-N 0 0 362.769 3.685 20 5 FHBDRN COC[C@@H](Cc1ccccc1)N(C)C(=O)Nc1cc([N+](=O)[O-])c(C)cc1C ZINC000189896036 941296271 /nfs/dbraw/zinc/29/62/71/941296271.db2.gz KJAJWYIUMCVHMJ-QGZVFWFLSA-N 0 0 371.437 3.933 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)NCC1(Cc2ccccc2)CC1 ZINC000511514893 941308470 /nfs/dbraw/zinc/30/84/70/941308470.db2.gz UGHDWIJYBQCEJH-UHFFFAOYSA-N 0 0 367.449 3.802 20 5 FHBDRN O=C(CCOc1ccc(Cl)cc1)OCc1ccc([N+](=O)[O-])c(F)c1 ZINC000782941814 941315673 /nfs/dbraw/zinc/31/56/73/941315673.db2.gz KAICADZLISKUSV-UHFFFAOYSA-N 0 0 353.733 3.900 20 5 FHBDRN Cc1cccc(CN(CC[NH+](C)C)C(=O)c2cc([N+](=O)[O-])c(F)cc2C)c1 ZINC001125847358 941324426 /nfs/dbraw/zinc/32/44/26/941324426.db2.gz LKZWOJDVKHVSLQ-UHFFFAOYSA-N 0 0 373.428 3.555 20 5 FHBDRN COc1ccccc1C(=O)COc1c(Br)cccc1[N+](=O)[O-] ZINC000178983859 941326773 /nfs/dbraw/zinc/32/67/73/941326773.db2.gz CFUAPVIDRXNJTE-UHFFFAOYSA-N 0 0 366.167 3.628 20 5 FHBDRN COc1ccc(C(=O)N(Cc2c(F)cccc2F)C2CC2)cc1[N+](=O)[O-] ZINC000189987187 941328323 /nfs/dbraw/zinc/32/83/23/941328323.db2.gz YATCWXGFJUXJLD-UHFFFAOYSA-N 0 0 362.332 3.686 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)N[C@H]1CSc2ccccc21 ZINC000549110309 941329117 /nfs/dbraw/zinc/32/91/17/941329117.db2.gz GFPKFOKKKIXTFW-INIZCTEOSA-N 0 0 357.435 3.626 20 5 FHBDRN CC[C@@H](O)CN(Cc1ccccc1)C(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000179179430 941338915 /nfs/dbraw/zinc/33/89/15/941338915.db2.gz PHVNPJFBKFZGOI-HNAYVOBHSA-N 0 0 371.437 3.639 20 5 FHBDRN Cc1c(CC(=O)N(Cc2c(F)cccc2F)C2CC2)cccc1[N+](=O)[O-] ZINC000190015775 941347120 /nfs/dbraw/zinc/34/71/20/941347120.db2.gz DGAIPVSEIPRJMT-UHFFFAOYSA-N 0 0 360.360 3.915 20 5 FHBDRN O=C(CCc1c(Cl)cccc1[N+](=O)[O-])NCC1(C(F)(F)F)CC1 ZINC000935950629 941351945 /nfs/dbraw/zinc/35/19/45/941351945.db2.gz LPBHPPCPTYHKAN-UHFFFAOYSA-N 0 0 350.724 3.640 20 5 FHBDRN O=C(N[C@@H]1CCc2c1cccc2O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000122270467 941364863 /nfs/dbraw/zinc/36/48/63/941364863.db2.gz DCBKJWAPDITSPP-GOSISDBHSA-N 0 0 367.405 3.662 20 5 FHBDRN C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1cnn(-c2ccccc2F)c1 ZINC000103375544 941380008 /nfs/dbraw/zinc/38/00/08/941380008.db2.gz UHRPVIXADDRYIQ-GFCCVEGCSA-N 0 0 366.352 3.511 20 5 FHBDRN COc1ccc(NC(=O)[C@H](C)N2CC=C(C(C)(C)C)CC2)c([N+](=O)[O-])c1 ZINC000533926712 941393915 /nfs/dbraw/zinc/39/39/15/941393915.db2.gz QPFUNWQUPUIANO-ZDUSSCGKSA-N 0 0 361.442 3.609 20 5 FHBDRN CC(=O)Nc1cc(N[C@@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)ccc1C ZINC000472649207 941471166 /nfs/dbraw/zinc/47/11/66/941471166.db2.gz TXDKLCBDQRMWNC-WBVHZDCISA-N 0 0 357.414 3.654 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N[C@@H]1C[C@H](CO)c2ccccc21 ZINC000376956283 941477268 /nfs/dbraw/zinc/47/72/68/941477268.db2.gz FTUSOYCLRZAIMN-CZUORRHYSA-N 0 0 355.394 3.554 20 5 FHBDRN Cc1nc([C@@H]2CCCCN2C(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)no1 ZINC000377011579 941491471 /nfs/dbraw/zinc/49/14/71/941491471.db2.gz ZSNDZPOVRMKTAV-HNNXBMFYSA-N 0 0 358.398 3.777 20 5 FHBDRN Cc1cccnc1C(C)(C)CNC(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000583233490 941495426 /nfs/dbraw/zinc/49/54/26/941495426.db2.gz DKKDNLMQDBSLRF-UHFFFAOYSA-N 0 0 353.378 3.752 20 5 FHBDRN CCCN(C)c1nnc(-c2ccc([N+](=O)[O-])cc2)n1Cc1ccccc1 ZINC000549134987 941503717 /nfs/dbraw/zinc/50/37/17/941503717.db2.gz STUBRTLDURFVAJ-UHFFFAOYSA-N 0 0 351.410 3.748 20 5 FHBDRN COc1cccc(C2(NC(=O)c3ccc(SC)c([N+](=O)[O-])c3)CC2)c1 ZINC000122314771 941504465 /nfs/dbraw/zinc/50/44/65/941504465.db2.gz SFXVNHANWMGMJJ-UHFFFAOYSA-N 0 0 358.419 3.744 20 5 FHBDRN CC(C)Oc1cc(C(=O)N(C)CCN(C)c2ccccc2)ccc1[N+](=O)[O-] ZINC000412051466 941530917 /nfs/dbraw/zinc/53/09/17/941530917.db2.gz CFHZORRNSVWKBW-UHFFFAOYSA-N 0 0 371.437 3.590 20 5 FHBDRN COc1ccc(COCCOc2ccc([N+](=O)[O-])c3ncccc23)cc1 ZINC000613643474 941535221 /nfs/dbraw/zinc/53/52/21/941535221.db2.gz JHDSHGQRCARPPX-UHFFFAOYSA-N 0 0 354.362 3.747 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCCC[C@H]1c1cc[nH]n1 ZINC000377163352 941537530 /nfs/dbraw/zinc/53/75/30/941537530.db2.gz ADVMQHOGZBPYFT-LRDDRELGSA-N 0 0 360.439 3.552 20 5 FHBDRN Cc1cc(C(=O)N2CCC[C@@H]2c2cccc3c2OCCO3)ccc1[N+](=O)[O-] ZINC000066771180 941540707 /nfs/dbraw/zinc/54/07/07/941540707.db2.gz CENAPNKGHXPUCC-QGZVFWFLSA-N 0 0 368.389 3.652 20 5 FHBDRN O=C(CCn1cc([N+](=O)[O-])cn1)N1CCCC[C@H]1c1cccc(Cl)c1 ZINC000365542826 941562708 /nfs/dbraw/zinc/56/27/08/941562708.db2.gz BKYPGMRNRASSAQ-INIZCTEOSA-N 0 0 362.817 3.589 20 5 FHBDRN O=C(CCn1cc([N+](=O)[O-])cn1)N1CCCC[C@@H]1c1cccc(Cl)c1 ZINC000365542827 941562903 /nfs/dbraw/zinc/56/29/03/941562903.db2.gz BKYPGMRNRASSAQ-MRXNPFEDSA-N 0 0 362.817 3.589 20 5 FHBDRN CN(Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@@H]1CCCc2cccnc21 ZINC000377248017 941590146 /nfs/dbraw/zinc/59/01/46/941590146.db2.gz DIECYWGWGJHRDB-MRXNPFEDSA-N 0 0 365.393 3.549 20 5 FHBDRN Cc1cnccc1C(=O)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F ZINC000274382070 941594959 /nfs/dbraw/zinc/59/49/59/941594959.db2.gz AKUWVBVONITZRZ-UHFFFAOYSA-N 0 0 353.300 3.503 20 5 FHBDRN COc1ccc([C@H](C)CCNC(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)cc1 ZINC000541105742 941599520 /nfs/dbraw/zinc/59/95/20/941599520.db2.gz DZZYGCMXXHHXKJ-CYBMUJFWSA-N 0 0 373.409 3.927 20 5 FHBDRN CC(=O)Nc1ccc(CNc2cc(C)c(C(F)(F)F)cc2[N+](=O)[O-])cn1 ZINC000549183492 941603744 /nfs/dbraw/zinc/60/37/44/941603744.db2.gz NVAVKFLJXCWBHY-UHFFFAOYSA-N 0 0 368.315 3.888 20 5 FHBDRN C[C@H](NC(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)c1cccc(C2CC2)c1 ZINC000452196028 941616402 /nfs/dbraw/zinc/61/64/02/941616402.db2.gz QNTGCFVMEJFSSX-LBPRGKRZSA-N 0 0 368.389 3.734 20 5 FHBDRN CC(C)(C)c1ccc(NC(=O)C(=O)Nc2cc(F)cc([N+](=O)[O-])c2)cc1 ZINC000472717588 941628259 /nfs/dbraw/zinc/62/82/59/941628259.db2.gz XRJMYNQIBMLRDN-UHFFFAOYSA-N 0 0 359.357 3.609 20 5 FHBDRN O=C(Nc1ccsc1Cl)N1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000565686434 941639647 /nfs/dbraw/zinc/63/96/47/941639647.db2.gz IGNYEHHDJOVFIL-UHFFFAOYSA-N 0 0 353.787 3.736 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NCCc2nc3ccccc3s2)c1 ZINC000549214097 941654999 /nfs/dbraw/zinc/65/49/99/941654999.db2.gz QURKDNZOJGRBCN-UHFFFAOYSA-N 0 0 371.418 3.576 20 5 FHBDRN CS(=O)(=O)c1cccc(NC[C@@H]2C[C@H]2C2CCCCC2)c1[N+](=O)[O-] ZINC000549220525 941664755 /nfs/dbraw/zinc/66/47/55/941664755.db2.gz IORGOQCPMFBRAV-KBPBESRZSA-N 0 0 352.456 3.627 20 5 FHBDRN O=[N+]([O-])c1c(N2CC[C@H](OCCCc3ccccc3)C2)nc2sccn21 ZINC000431842025 941670873 /nfs/dbraw/zinc/67/08/73/941670873.db2.gz SFTLGZFJAZZEHG-HNNXBMFYSA-N 0 0 372.450 3.532 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)Nc1cnc2c(c1)CCCC2 ZINC000549223818 941673542 /nfs/dbraw/zinc/67/35/42/941673542.db2.gz JFERJBNWVIAGIA-UHFFFAOYSA-N 0 0 354.410 3.575 20 5 FHBDRN C/C(=C\c1cccc(Cl)c1)C(=O)OCC(=O)Nc1cccc([N+](=O)[O-])c1 ZINC001125859110 941689187 /nfs/dbraw/zinc/68/91/87/941689187.db2.gz LJDBVOXBUCKNTH-XYOKQWHBSA-N 0 0 374.780 3.833 20 5 FHBDRN Cn1cc([N+](=O)[O-])cc1C(=O)Nc1ccc(-c2nc3ccccc3[nH]2)cc1 ZINC000024477109 941690135 /nfs/dbraw/zinc/69/01/35/941690135.db2.gz DZJCMIVRDHUDSJ-UHFFFAOYSA-N 0 0 361.361 3.729 20 5 FHBDRN Cc1nc([C@H]2CCCOC2)sc1C(=O)Nc1ccc(C)c([N+](=O)[O-])c1 ZINC000377399972 941692792 /nfs/dbraw/zinc/69/27/92/941692792.db2.gz LOVMXENSBKTQKY-LBPRGKRZSA-N 0 0 361.423 3.814 20 5 FHBDRN CC(=O)c1cc(F)cc(F)c1OCCCOc1ccc([N+](=O)[O-])cc1 ZINC000729239904 941698708 /nfs/dbraw/zinc/69/87/08/941698708.db2.gz MIHBFHZYGOSVQB-UHFFFAOYSA-N 0 0 351.305 3.924 20 5 FHBDRN C[C@H]1Oc2cc(F)ccc2[C@@H]1NC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000377418161 941711612 /nfs/dbraw/zinc/71/16/12/941711612.db2.gz GQUMPLWLZUYBGJ-ANRSDYALSA-N 0 0 350.733 3.639 20 5 FHBDRN CN(Cc1cc(Cl)ccc1F)C(=O)NCc1ccccc1[N+](=O)[O-] ZINC000433554138 941722330 /nfs/dbraw/zinc/72/23/30/941722330.db2.gz NBXFVDRMYLGJLM-UHFFFAOYSA-N 0 0 351.765 3.729 20 5 FHBDRN COc1cc(OC)cc(N(C)C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)c1 ZINC000190055376 941722559 /nfs/dbraw/zinc/72/25/59/941722559.db2.gz PIRFBTBIXFZLJB-UHFFFAOYSA-N 0 0 350.758 3.542 20 5 FHBDRN Cc1noc(C)c1CSCC(=O)O[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000729358208 941731255 /nfs/dbraw/zinc/73/12/55/941731255.db2.gz KOFBBYUEZYCFAF-NSHDSACASA-N 0 0 350.396 3.737 20 5 FHBDRN Cn1cc([N+](=O)[O-])cc1C(=O)Nc1ccc(Oc2ccc(F)cc2)cn1 ZINC000729382353 941743795 /nfs/dbraw/zinc/74/37/95/941743795.db2.gz RDNPKWLXPHKSQR-UHFFFAOYSA-N 0 0 356.313 3.512 20 5 FHBDRN CC(=O)c1ccc(NCc2nc(-c3cccc(F)c3)no2)c([N+](=O)[O-])c1 ZINC000377465351 941748056 /nfs/dbraw/zinc/74/80/56/941748056.db2.gz QIMZPQUXUCVKGJ-UHFFFAOYSA-N 0 0 356.313 3.599 20 5 FHBDRN CCN(CC)C(=O)CCCNc1cc(C)c([N+](=O)[O-])cc1Br ZINC000473522044 941760129 /nfs/dbraw/zinc/76/01/29/941760129.db2.gz RXJILYGARSYRKM-UHFFFAOYSA-N 0 0 372.263 3.726 20 5 FHBDRN Cc1ccc(NC(=O)COc2ccc(Br)cc2[N+](=O)[O-])cc1 ZINC000151146287 941761111 /nfs/dbraw/zinc/76/11/11/941761111.db2.gz RWRBGGNFUZVLSG-UHFFFAOYSA-N 0 0 365.183 3.683 20 5 FHBDRN C[C@@H]1CCC[C@H](C)N1C(=O)COc1ccc(Br)cc1[N+](=O)[O-] ZINC000151149412 941761680 /nfs/dbraw/zinc/76/16/80/941761680.db2.gz QMSKEFICTWNTCS-PHIMTYICSA-N 0 0 371.231 3.526 20 5 FHBDRN CC[C@H](C)C(=O)N(CCOC)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 ZINC000073439398 941761754 /nfs/dbraw/zinc/76/17/54/941761754.db2.gz QPJJETLIXGFJOO-LBPRGKRZSA-N 0 0 363.439 3.744 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)NCCc1coc(-c2ccc(F)cc2)n1 ZINC000377488535 941763727 /nfs/dbraw/zinc/76/37/27/941763727.db2.gz LMSRNMPNRFOMGX-UHFFFAOYSA-N 0 0 369.352 3.670 20 5 FHBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H](C)N(C)[C@@H](C)C1 ZINC000513189481 941768308 /nfs/dbraw/zinc/76/83/08/941768308.db2.gz JZDVZNKXAOMFDR-OKILXGFUSA-N 0 0 365.499 3.508 20 5 FHBDRN CCCOc1nc(C(=O)NCc2ccccc2[N+](=O)[O-])cc2ccccc21 ZINC000513216667 941781613 /nfs/dbraw/zinc/78/16/13/941781613.db2.gz GNCLXHDAZRLGRD-UHFFFAOYSA-N 0 0 365.389 3.862 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1F)N[C@@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000122548217 941791671 /nfs/dbraw/zinc/79/16/71/941791671.db2.gz PGUJDTYFWPFCFM-LIRRHRJNSA-N 0 0 372.396 3.561 20 5 FHBDRN O=[N+]([O-])c1c(N2CC[C@@](F)(c3ccccc3F)C2)nc2sccn21 ZINC000549265077 941791693 /nfs/dbraw/zinc/79/16/93/941791693.db2.gz AYEQAVYPNATEBF-HNNXBMFYSA-N 0 0 350.350 3.518 20 5 FHBDRN O=[N+]([O-])c1ccc(NC2CCN(Cc3cscn3)CC2)c2ccncc21 ZINC000377539974 941796423 /nfs/dbraw/zinc/79/64/23/941796423.db2.gz LGNCMBLDXPVPSM-UHFFFAOYSA-N 0 0 369.450 3.676 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N(Cc2ccccc2)CC(C)C)c1F ZINC000412117541 941797128 /nfs/dbraw/zinc/79/71/28/941797128.db2.gz DDRPTSXVWRDGOI-UHFFFAOYSA-N 0 0 374.412 3.970 20 5 FHBDRN CCOc1nccc(C)c1C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000433614884 941798774 /nfs/dbraw/zinc/79/87/74/941798774.db2.gz FEIYUHVZYWONRA-UHFFFAOYSA-N 0 0 367.308 3.551 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N(Cc1cccc(O)c1)CC1CC1 ZINC000412119386 941802021 /nfs/dbraw/zinc/80/20/21/941802021.db2.gz MZADURPSNVHGRA-VQTJNVASSA-N 0 0 366.417 3.843 20 5 FHBDRN CCC(CC)[C@@H]1C[C@H](NC(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)CCO1 ZINC000190064490 941803254 /nfs/dbraw/zinc/80/32/54/941803254.db2.gz MFVVCYNUGHSADV-QAPCUYQASA-N 0 0 364.442 3.625 20 5 FHBDRN Cn1ccnc1[C@@H]1CCCN(C(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)C1 ZINC000365596578 941803715 /nfs/dbraw/zinc/80/37/15/941803715.db2.gz YQDTYBPGNQHUHC-OAHLLOKOSA-N 0 0 370.453 3.646 20 5 FHBDRN O=[N+]([O-])c1cc2ccccc2nc1N1CCN(c2cc(F)ccc2F)CC1 ZINC000473526216 941804600 /nfs/dbraw/zinc/80/46/00/941804600.db2.gz QSGSGIIXOGEPGB-UHFFFAOYSA-N 0 0 370.359 3.748 20 5 FHBDRN CNc1cc(C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc(Cl)n1 ZINC000118319388 941806129 /nfs/dbraw/zinc/80/61/29/941806129.db2.gz CBRJQGGGUDXCDC-UHFFFAOYSA-N 0 0 362.817 3.736 20 5 FHBDRN CC(C)Oc1ccc(Br)cc1NC(=O)c1cc([N+](=O)[O-])c[nH]1 ZINC000433634251 941813207 /nfs/dbraw/zinc/81/32/07/941813207.db2.gz HMASIWLESRNACD-UHFFFAOYSA-N 0 0 368.187 3.725 20 5 FHBDRN COc1ccc(CNC(=O)c2nc(-c3ccccc3)cs2)cc1[N+](=O)[O-] ZINC000513251925 941818087 /nfs/dbraw/zinc/81/80/87/941818087.db2.gz UVZIVYFVJUNENP-UHFFFAOYSA-N 0 0 369.402 3.657 20 5 FHBDRN CC(C)CC(=O)Nc1ccc(C(=O)COc2cc(F)cc([N+](=O)[O-])c2)cc1 ZINC000433663347 941824939 /nfs/dbraw/zinc/82/49/39/941824939.db2.gz IOGKRGAWRUENRM-UHFFFAOYSA-N 0 0 374.368 3.980 20 5 FHBDRN COC(=O)c1ccc(OCc2ccc(OC)c(Cl)c2)c([N+](=O)[O-])c1 ZINC000513276039 941826112 /nfs/dbraw/zinc/82/61/12/941826112.db2.gz BCTMOCFIEOGBLD-UHFFFAOYSA-N 0 0 351.742 3.622 20 5 FHBDRN COc1ccc(NC(=O)CN2C[C@@H](C)C[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000513277449 941826854 /nfs/dbraw/zinc/82/68/54/941826854.db2.gz YCHKSOCQJOHJCD-KBXCAEBGSA-N 0 0 369.421 3.625 20 5 FHBDRN COc1ccc(NC(=O)CN2C[C@H](C)C[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000513277452 941827166 /nfs/dbraw/zinc/82/71/66/941827166.db2.gz YCHKSOCQJOHJCD-RDTXWAMCSA-N 0 0 369.421 3.625 20 5 FHBDRN CCN(Cc1ccc(Cl)cc1)C(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-] ZINC000433671991 941827961 /nfs/dbraw/zinc/82/79/61/941827961.db2.gz YKJQXQQGGXKQFK-UHFFFAOYSA-N 0 0 350.806 3.757 20 5 FHBDRN O=C(NCc1cccc([N+](=O)[O-])c1)N1CC[C@](F)(c2ccccc2F)C1 ZINC000549280643 941829980 /nfs/dbraw/zinc/82/99/80/941829980.db2.gz OAPLBCPUIRIRPN-GOSISDBHSA-N 0 0 361.348 3.514 20 5 FHBDRN CC1(C)CC(Nc2ncc([N+](=O)[O-])cc2C(F)(F)F)CC(C)(C)N1O ZINC001167718585 941831577 /nfs/dbraw/zinc/83/15/77/941831577.db2.gz VSCIXAFDXFUMOE-UHFFFAOYSA-N 0 0 362.352 3.831 20 5 FHBDRN Cc1cnc([C@H](NC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)C2CC2)s1 ZINC000412139651 941834148 /nfs/dbraw/zinc/83/41/48/941834148.db2.gz SJVIPTWKJNGZPB-ARFHVFGLSA-N 0 0 357.435 3.731 20 5 FHBDRN Cc1ccc(O[C@@H](C)CNC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)cc1 ZINC000412143623 941841446 /nfs/dbraw/zinc/84/14/46/941841446.db2.gz DSKCKKGRJUHZKP-ZOCIIQOWSA-N 0 0 354.406 3.590 20 5 FHBDRN C[C@@]1(c2ccccc2)CCN(C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)C1 ZINC000412172278 941861492 /nfs/dbraw/zinc/86/14/92/941861492.db2.gz MNYJFIVWPNYNND-QKNQBKEWSA-N 0 0 350.418 3.889 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NCc2ccc(OC)c(Cl)c2)c1 ZINC000549293699 941863402 /nfs/dbraw/zinc/86/34/02/941863402.db2.gz FIQWZPBGYYKNLR-UHFFFAOYSA-N 0 0 364.785 3.586 20 5 FHBDRN COCc1nc2cc(NC(=O)[C@@H]3C[C@H]3c3ccc([N+](=O)[O-])cc3)ccc2o1 ZINC000412180770 941868336 /nfs/dbraw/zinc/86/83/36/941868336.db2.gz PJVSFUGMZPKDIX-LSDHHAIUSA-N 0 0 367.361 3.625 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N(CC)Cc2c(F)cccc2F)c1 ZINC000549295761 941872279 /nfs/dbraw/zinc/87/22/79/941872279.db2.gz GEEHLNLBEGBVTN-UHFFFAOYSA-N 0 0 364.348 3.934 20 5 FHBDRN COC(=O)c1cc(NC(=O)[C@H]2C[C@@]2(F)c2ccccc2)c(C)c([N+](=O)[O-])c1 ZINC000415519447 941873667 /nfs/dbraw/zinc/87/36/67/941873667.db2.gz PASLGPMTSNWDRT-AUUYWEPGSA-N 0 0 372.352 3.513 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NC1Cc2ccccc2C1 ZINC000545831606 941875327 /nfs/dbraw/zinc/87/53/27/941875327.db2.gz BUWYFCLYUFAQNL-UHFFFAOYSA-N 0 0 356.447 3.994 20 5 FHBDRN CC[C@@H](Cc1ccc(Cl)cc1)NC(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-] ZINC000433768643 941875794 /nfs/dbraw/zinc/87/57/94/941875794.db2.gz KTRATUORBVNPBB-ZDUSSCGKSA-N 0 0 364.833 3.846 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N2CC[C@H](c3ccccc3)[C@@H]2C)c1F ZINC000412182237 941881771 /nfs/dbraw/zinc/88/17/71/941881771.db2.gz ZGHHTKJCNYENLR-ZFWWWQNUSA-N 0 0 372.396 3.690 20 5 FHBDRN CC(=O)c1c(C)[nH]c(C(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)c1C(C)C ZINC000119424817 941884255 /nfs/dbraw/zinc/88/42/55/941884255.db2.gz GVFKMKDCDWPYFP-UHFFFAOYSA-N 0 0 369.421 3.756 20 5 FHBDRN CC(C)O[C@@H]1C[C@H](NC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)C1(C)C ZINC001267677490 941890166 /nfs/dbraw/zinc/89/01/66/941890166.db2.gz VBASOLVOHBDDGQ-UHOFOFEASA-N 0 0 366.483 3.784 20 5 FHBDRN Nc1c(F)c(N[C@@H]2C[C@H]2c2ccc(OC(F)F)cc2)ccc1[N+](=O)[O-] ZINC000480791643 941891405 /nfs/dbraw/zinc/89/14/05/941891405.db2.gz TUGKGBBCTJAXEP-CMPLNLGQSA-N 0 0 353.300 3.886 20 5 FHBDRN Cc1c(C(=O)N[C@H]2CCC[C@@H]2OCc2ccccc2)cccc1[N+](=O)[O-] ZINC000119638102 941892011 /nfs/dbraw/zinc/89/20/11/941892011.db2.gz BWKMBBMTAHGUNA-HKUYNNGSSA-N 0 0 354.406 3.771 20 5 FHBDRN COC(=O)c1cnc(N[C@H]2CC[C@H](c3cccc(F)c3)C2)c([N+](=O)[O-])c1 ZINC000480785421 941895148 /nfs/dbraw/zinc/89/51/48/941895148.db2.gz IGEHKFAOURPFFY-WFASDCNBSA-N 0 0 359.357 3.664 20 5 FHBDRN C[C@H](CNc1ccc([N+](=O)[O-])c(NC[C@@H](C)C(F)(F)F)n1)C(F)(F)F ZINC000433786484 941895724 /nfs/dbraw/zinc/89/57/24/941895724.db2.gz XPOPWNHPHRFLSB-HTQZYQBOSA-N 0 0 374.285 3.632 20 5 FHBDRN CC(C)Oc1cc(C(=O)Nc2cccc3c2OCCC3)ccc1[N+](=O)[O-] ZINC000412199152 941899493 /nfs/dbraw/zinc/89/94/93/941899493.db2.gz XQYVENKIICOHDV-UHFFFAOYSA-N 0 0 356.378 3.959 20 5 FHBDRN CCOc1cccc(CCNC(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000433792465 941900624 /nfs/dbraw/zinc/90/06/24/941900624.db2.gz NKTLYKOJNPIWHU-HNNXBMFYSA-N 0 0 371.437 3.905 20 5 FHBDRN Cc1nn(Cc2ncc(-c3ccccc3Br)o2)cc1[N+](=O)[O-] ZINC000181832248 941902466 /nfs/dbraw/zinc/90/24/66/941902466.db2.gz MSLPMNNVDINCTO-UHFFFAOYSA-N 0 0 363.171 3.566 20 5 FHBDRN CC(C)[C@@H](CNC(=O)COc1ccc(F)cc1[N+](=O)[O-])c1ccccc1 ZINC000549306073 941904722 /nfs/dbraw/zinc/90/47/22/941904722.db2.gz NHMOLPWSZBASPB-MRXNPFEDSA-N 0 0 360.385 3.669 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCC[C@@H]([C@H](O)C(F)(F)F)C2)cc1C(F)(F)F ZINC000433799414 941909339 /nfs/dbraw/zinc/90/93/39/941909339.db2.gz RFKZDRLFGFYWAY-PELKAZGASA-N 0 0 372.265 3.753 20 5 FHBDRN CCc1[nH]nc(C(=O)Nc2ccc(-c3ncc(C(C)C)o3)cc2)c1[N+](=O)[O-] ZINC000377700197 941910378 /nfs/dbraw/zinc/91/03/78/941910378.db2.gz KATGMJPZWMPTOT-UHFFFAOYSA-N 0 0 369.381 3.911 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CCSc1ccccc1F ZINC000052736315 941919480 /nfs/dbraw/zinc/91/94/80/941919480.db2.gz PLWWYCQBZLXIJO-UHFFFAOYSA-N 0 0 350.371 3.863 20 5 FHBDRN Cc1noc(C)c1[C@@H](C)CNC(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1 ZINC000412212927 941921049 /nfs/dbraw/zinc/92/10/49/941921049.db2.gz WFMYLOOOBTZJIR-NSHDSACASA-N 0 0 361.398 3.520 20 5 FHBDRN Cc1cc(C(=O)N[C@H]2CCO[C@H]2c2ccc(Cl)cc2)cc([N+](=O)[O-])c1 ZINC000182442522 941924869 /nfs/dbraw/zinc/92/48/69/941924869.db2.gz WZQBBUFWCLSHCP-IRXDYDNUSA-N 0 0 360.797 3.817 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)c1noc2c1C[C@H](C)CC2 ZINC000433830789 941927180 /nfs/dbraw/zinc/92/71/80/941927180.db2.gz YZWAHQAPQNXPQJ-CYBMUJFWSA-N 0 0 357.410 3.758 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)NCCC1C[C@@H](C)O[C@H](C)C1 ZINC000549316028 941929827 /nfs/dbraw/zinc/92/98/27/941929827.db2.gz DKTNFKIALSFPFX-VXGBXAGGSA-N 0 0 354.834 3.880 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCO[C@@H]1c1ccc(Cl)cc1 ZINC000182467930 941932382 /nfs/dbraw/zinc/93/23/82/941932382.db2.gz XMWRLYNIABBBLN-IAGOWNOFSA-N 0 0 360.797 3.817 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1OC(F)F)N1CCCc2cccc(F)c21 ZINC000182512441 941936810 /nfs/dbraw/zinc/93/68/10/941936810.db2.gz WCJUGPGXVOAPLD-UHFFFAOYSA-N 0 0 366.295 3.928 20 5 FHBDRN O=C(NCC1(c2ccncc2)CCCC1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412223673 941939447 /nfs/dbraw/zinc/93/94/47/941939447.db2.gz DGDYNZKBMIJOLW-RBUKOAKNSA-N 0 0 365.433 3.722 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)NCCc2ccc(Cl)cc2Cl)c1[N+](=O)[O-] ZINC000433855249 941942304 /nfs/dbraw/zinc/94/23/04/941942304.db2.gz SCYDDCIHNSOYQS-UHFFFAOYSA-N 0 0 371.224 3.721 20 5 FHBDRN COc1ccc([C@H](NC(=O)c2ccccc2[N+](=O)[O-])C(F)(F)F)cc1 ZINC000182609947 941947453 /nfs/dbraw/zinc/94/74/53/941947453.db2.gz MTIAOXKXLJRWGQ-AWEZNQCLSA-N 0 0 354.284 3.637 20 5 FHBDRN O=C(N[C@@H]1CCCc2occc21)c1cccc([N+](=O)[O-])c1Br ZINC000182660955 941949610 /nfs/dbraw/zinc/94/96/10/941949610.db2.gz WKVZHIMPVFVMSL-LLVKDONJSA-N 0 0 365.183 3.758 20 5 FHBDRN COc1cccc2c1CCN(C(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1)C2 ZINC000412241575 941953108 /nfs/dbraw/zinc/95/31/08/941953108.db2.gz IDDTWIORMKSOOI-UHFFFAOYSA-N 0 0 370.405 3.589 20 5 FHBDRN CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F)c1c(F)cccc1F ZINC000182701348 941954359 /nfs/dbraw/zinc/95/43/59/941954359.db2.gz SKVQBWYCEMIFRT-UHFFFAOYSA-N 0 0 358.247 3.751 20 5 FHBDRN Cc1cc(NC(=O)N2C[C@@H](C)O[C@H](c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000182765063 941966404 /nfs/dbraw/zinc/96/64/04/941966404.db2.gz IJECKKOFEAGIML-KDOFPFPSSA-N 0 0 355.394 3.897 20 5 FHBDRN CC(C)n1nc(-c2ccco2)cc1NC(=O)NCc1ccccc1[N+](=O)[O-] ZINC000433899211 941971432 /nfs/dbraw/zinc/97/14/32/941971432.db2.gz WZYMKNYXJQYYOF-UHFFFAOYSA-N 0 0 369.381 3.954 20 5 FHBDRN CS(=O)(=O)c1cccc(N[C@H]2CCC[C@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000122634764 941979475 /nfs/dbraw/zinc/97/94/75/941979475.db2.gz OCJXYWRKDDDYLM-GJZGRUSLSA-N 0 0 360.435 3.747 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CN1CCC(Nc2ccc(F)cc2)CC1 ZINC000101561538 941987111 /nfs/dbraw/zinc/98/71/11/941987111.db2.gz SILIGLPBQPTVFW-UHFFFAOYSA-N 0 0 359.401 3.819 20 5 FHBDRN C[C@H]1CCCN(c2ccc(C(=O)Nc3ccncc3F)cc2[N+](=O)[O-])C1 ZINC000122645232 941994933 /nfs/dbraw/zinc/99/49/33/941994933.db2.gz MYFBXCUYNVMDTF-LBPRGKRZSA-N 0 0 358.373 3.618 20 5 FHBDRN Cc1cc(C(=O)N2CCC[C@@H]2Cn2ccnc2C(C)C)ccc1[N+](=O)[O-] ZINC000377794763 941998917 /nfs/dbraw/zinc/99/89/17/941998917.db2.gz MAXHACLGVVTFFH-MRXNPFEDSA-N 0 0 356.426 3.528 20 5 FHBDRN C[C@H](c1cccs1)N(Cc1ccccc1)C(=O)c1c([N+](=O)[O-])cnn1C ZINC000500982144 942009115 /nfs/dbraw/zinc/00/91/15/942009115.db2.gz JXXYQQYBCFJKNA-CYBMUJFWSA-N 0 0 370.434 3.793 20 5 FHBDRN Cc1nn(-c2ccccc2)cc1CCCNC(=O)c1csc([N+](=O)[O-])c1 ZINC000052748202 942009175 /nfs/dbraw/zinc/00/91/75/942009175.db2.gz OABGGJWEQZLCEW-UHFFFAOYSA-N 0 0 370.434 3.513 20 5 FHBDRN Cc1cc(Br)c(O)c(NC(=O)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC000182931460 942009775 /nfs/dbraw/zinc/00/97/75/942009775.db2.gz RSBCCKDIVCSBOI-UHFFFAOYSA-N 0 0 365.183 3.553 20 5 FHBDRN CCN(Cc1c(F)cccc1F)C(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000101734930 942011827 /nfs/dbraw/zinc/01/18/27/942011827.db2.gz QVSCLZOXRXKQSK-UHFFFAOYSA-N 0 0 365.336 3.936 20 5 FHBDRN CCn1nccc1NC(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000513569437 942012652 /nfs/dbraw/zinc/01/26/52/942012652.db2.gz ZCWAFWPYULAKPL-UHFFFAOYSA-N 0 0 366.377 3.643 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1Cl)N1CC[C@@]2(C1)OCc1ccccc12 ZINC000377820673 942018554 /nfs/dbraw/zinc/01/85/54/942018554.db2.gz GTGOVEUJTOEOEP-SFHVURJKSA-N 0 0 373.796 3.912 20 5 FHBDRN CSc1cccc(N(C)S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000101849896 942018865 /nfs/dbraw/zinc/01/88/65/942018865.db2.gz DASHZBUZHLXXKL-UHFFFAOYSA-N 0 0 372.855 3.795 20 5 FHBDRN COCCC[C@H](CNC(=O)c1cc([N+](=O)[O-])c[nH]1)c1ccc(Cl)cc1 ZINC000513563272 942018861 /nfs/dbraw/zinc/01/88/61/942018861.db2.gz JTOPCUDMVKHBHS-CYBMUJFWSA-N 0 0 365.817 3.517 20 5 FHBDRN CCn1nccc1NC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 ZINC000513562725 942018870 /nfs/dbraw/zinc/01/88/70/942018870.db2.gz LZWAIDGTJDERGR-UHFFFAOYSA-N 0 0 352.350 3.856 20 5 FHBDRN Cc1ccccc1C[C@@H]1CCCN1C(=O)COc1cccc([N+](=O)[O-])c1 ZINC000513579943 942023214 /nfs/dbraw/zinc/02/32/14/942023214.db2.gz JREUEFBWLXFWTD-KRWDZBQOSA-N 0 0 354.406 3.516 20 5 FHBDRN Cc1ccccc1C[C@H]1CCCN1C(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000513580943 942023466 /nfs/dbraw/zinc/02/34/66/942023466.db2.gz SOQWIUKWQJOIFT-GOSISDBHSA-N 0 0 367.449 3.939 20 5 FHBDRN CCn1nccc1NC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 ZINC000513572555 942027305 /nfs/dbraw/zinc/02/73/05/942027305.db2.gz PEMXOBGGQWMBGV-UHFFFAOYSA-N 0 0 365.393 3.676 20 5 FHBDRN Cc1cc(C(=O)NC[C@@H]2CCCN(c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000433998690 942035038 /nfs/dbraw/zinc/03/50/38/942035038.db2.gz HXTQVBOMTWLLRK-INIZCTEOSA-N 0 0 353.422 3.550 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N[C@@H](C2CCCCC2)C(F)(F)F)c1[N+](=O)[O-] ZINC000434013177 942039490 /nfs/dbraw/zinc/03/94/90/942039490.db2.gz RWNLXBUMTZWULV-ZDUSSCGKSA-N 0 0 362.352 3.682 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)NC[C@H]2CCCC[C@@H]2C(F)(F)F)c1[N+](=O)[O-] ZINC000434012720 942039514 /nfs/dbraw/zinc/03/95/14/942039514.db2.gz QJNPBDQINQIMMD-ZJUUUORDSA-N 0 0 362.352 3.540 20 5 FHBDRN O=c1c([N+](=O)[O-])cccn1Cc1ccc(OCc2ccc(F)cc2)cc1 ZINC000102203185 942043187 /nfs/dbraw/zinc/04/31/87/942043187.db2.gz TWLSLHLTEQTGGQ-UHFFFAOYSA-N 0 0 354.337 3.523 20 5 FHBDRN O=c1ccc(-c2cccc([N+](=O)[O-])c2)nn1C[C@H]1CCc2ccccc2C1 ZINC000513607105 942044764 /nfs/dbraw/zinc/04/47/64/942044764.db2.gz ACQZTKQZZXSOHI-HNNXBMFYSA-N 0 0 361.401 3.624 20 5 FHBDRN CC[C@@H](C)Oc1ccc(NC(=O)CCn2nc(C)c([N+](=O)[O-])c2C)cc1 ZINC000102239584 942047133 /nfs/dbraw/zinc/04/71/33/942047133.db2.gz JJTAKSHHKZVBEM-GFCCVEGCSA-N 0 0 360.414 3.614 20 5 FHBDRN CC[C@@H](C)COc1cc([N+](=O)[O-])c(COc2cc(C)n(C)n2)cc1OC ZINC000513639922 942051204 /nfs/dbraw/zinc/05/12/04/942051204.db2.gz HNQXJHGNGMJKNT-GFCCVEGCSA-N 0 0 363.414 3.649 20 5 FHBDRN CC(C)(CNC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12)Oc1ccccc1 ZINC000513649174 942055027 /nfs/dbraw/zinc/05/50/27/942055027.db2.gz BYXYABQEXANTHF-UHFFFAOYSA-N 0 0 353.378 3.664 20 5 FHBDRN CC[C@@](C)(OC)c1noc(-c2ccc([N+](=O)[O-])cc2Br)n1 ZINC000290371137 942064441 /nfs/dbraw/zinc/06/44/41/942064441.db2.gz FDXKWGMAHWHMAC-CYBMUJFWSA-N 0 0 356.176 3.679 20 5 FHBDRN CCC(=O)c1cccc(NC(=O)NCc2ccc(OC)c([N+](=O)[O-])c2)c1 ZINC000434067850 942064500 /nfs/dbraw/zinc/06/45/00/942064500.db2.gz KTIWOMJWJUJJOJ-UHFFFAOYSA-N 0 0 357.366 3.518 20 5 FHBDRN COc1cc(CN[C@@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)ccc1C ZINC000513666983 942064899 /nfs/dbraw/zinc/06/48/99/942064899.db2.gz OUJAHVPIIPIONR-LJQANCHMSA-N 0 0 366.421 3.525 20 5 FHBDRN COc1cccc(-n2ccnc2SCC(=O)c2cccc([N+](=O)[O-])c2)c1 ZINC000517587078 942067832 /nfs/dbraw/zinc/06/78/32/942067832.db2.gz DBYBDFGFUTWQQS-UHFFFAOYSA-N 0 0 369.402 3.764 20 5 FHBDRN COc1cccc(Cl)c1CNC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412292255 942071653 /nfs/dbraw/zinc/07/16/53/942071653.db2.gz PEHQTPRJIQROGM-UONOGXRCSA-N 0 0 360.797 3.677 20 5 FHBDRN O=C(COc1ccc(F)cc1[N+](=O)[O-])Nc1ccc(C(F)(F)F)cc1 ZINC000102599896 942072751 /nfs/dbraw/zinc/07/27/51/942072751.db2.gz TVBPSAHXTLGTKN-UHFFFAOYSA-N 0 0 358.247 3.770 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CCc3sc(Cl)cc32)c1 ZINC000574246145 942073683 /nfs/dbraw/zinc/07/36/83/942073683.db2.gz QNYLRKSZUXKMMT-LLVKDONJSA-N 0 0 352.799 3.736 20 5 FHBDRN CC1(C)CN(C(=O)COc2cccc([N+](=O)[O-])c2)C[C@H]1c1ccccc1 ZINC000434086386 942075513 /nfs/dbraw/zinc/07/55/13/942075513.db2.gz CDJNEWITVIYDPL-SFHVURJKSA-N 0 0 354.406 3.626 20 5 FHBDRN O=C(Nc1ccc2c(c1)CCN2)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000415839487 942075859 /nfs/dbraw/zinc/07/58/59/942075859.db2.gz KCHANUBRVDNHII-UHFFFAOYSA-N 0 0 352.394 3.759 20 5 FHBDRN COc1ccc(Cl)cc1C1(c2noc(-c3cc([N+](=O)[O-])c[nH]3)n2)CC1 ZINC000420516940 942076931 /nfs/dbraw/zinc/07/69/31/942076931.db2.gz ZUHAFKLPEHEEHA-UHFFFAOYSA-N 0 0 360.757 3.715 20 5 FHBDRN CCCC1(c2noc([C@H](C)NC(=O)c3cccc([N+](=O)[O-])c3)n2)CCC1 ZINC000420518749 942078473 /nfs/dbraw/zinc/07/84/73/942078473.db2.gz UORVPTOBXKSUBW-LBPRGKRZSA-N 0 0 358.398 3.691 20 5 FHBDRN O=C(COc1cccc([N+](=O)[O-])c1)N1CC2(CCCC2)c2c1cccc2F ZINC000501855548 942082814 /nfs/dbraw/zinc/08/28/14/942082814.db2.gz HRHWTQYOMINONW-UHFFFAOYSA-N 0 0 370.380 3.971 20 5 FHBDRN C[C@H]1COCC[C@H]1c1noc(-c2ccnc(-c3ccccc3)c2[N+](=O)[O-])n1 ZINC000420503734 942086067 /nfs/dbraw/zinc/08/60/67/942086067.db2.gz LZMJSUCLQSNJPS-GXTWGEPZSA-N 0 0 366.377 3.847 20 5 FHBDRN COc1cc(Cc2noc(C(C)(C)CC(F)F)n2)c([N+](=O)[O-])c(OC)c1 ZINC000420507766 942088657 /nfs/dbraw/zinc/08/86/57/942088657.db2.gz YMGZEWCYWITESY-UHFFFAOYSA-N 0 0 371.340 3.519 20 5 FHBDRN CC(C)Oc1cc(O)ccc1NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412307307 942111111 /nfs/dbraw/zinc/11/11/11/942111111.db2.gz SBQCYZXITNXIBP-JKSUJKDBSA-N 0 0 356.378 3.830 20 5 FHBDRN Cc1cc(N2CCC[C@@H]2c2ccc(Br)cn2)ncc1[N+](=O)[O-] ZINC000413378406 942113551 /nfs/dbraw/zinc/11/35/51/942113551.db2.gz PSNKRCYFYULLEP-CYBMUJFWSA-N 0 0 363.215 3.797 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1OC(=O)c1cccc(NC(=O)[C@H]2C[C@H]2C)c1 ZINC000760015690 942114067 /nfs/dbraw/zinc/11/40/67/942114067.db2.gz HFTVVQIRBZQXRK-DOMZBBRYSA-N 0 0 354.362 3.717 20 5 FHBDRN COc1cc(C(=O)N(c2ccccc2)[C@H]2C[C@H]2C)cc([N+](=O)[O-])c1OC ZINC000415885960 942114947 /nfs/dbraw/zinc/11/49/47/942114947.db2.gz DDOAJQYLNBZXGN-DOMZBBRYSA-N 0 0 356.378 3.667 20 5 FHBDRN Cc1cnc([C@H](C)NC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])s1 ZINC000280171450 942116688 /nfs/dbraw/zinc/11/66/88/942116688.db2.gz OANYLMIDTCBCMG-QMMMGPOBSA-N 0 0 357.794 3.572 20 5 FHBDRN O=C(N[C@H]1CCc2c1cccc2F)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513689083 942117173 /nfs/dbraw/zinc/11/71/73/942117173.db2.gz PTSBQQKEZNNAPS-ZDUSSCGKSA-N 0 0 366.295 3.753 20 5 FHBDRN O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)[C@H]1CCOc2ccccc21 ZINC000102850992 942120995 /nfs/dbraw/zinc/12/09/95/942120995.db2.gz BULQEZLJUYHWGG-LBPRGKRZSA-N 0 0 364.304 3.701 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(Nc2ccc3c(c2)CN(CC(F)(F)F)C3)n1 ZINC000413373664 942121962 /nfs/dbraw/zinc/12/19/62/942121962.db2.gz QGELCBYVWQORQU-UHFFFAOYSA-N 0 0 352.316 3.920 20 5 FHBDRN O=C(Nc1ccc2c(c1)CCCN2)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000415897786 942125118 /nfs/dbraw/zinc/12/51/18/942125118.db2.gz SIXVTUOUMBTVHK-UHFFFAOYSA-N 0 0 352.394 3.543 20 5 FHBDRN O=[N+]([O-])c1cc(Br)cnc1N1CCC[C@@H](CC(F)(F)F)C1 ZINC000420625598 942125466 /nfs/dbraw/zinc/12/54/66/942125466.db2.gz LSXDZFPDZXAHHQ-QMMMGPOBSA-N 0 0 368.153 3.921 20 5 FHBDRN COC(=O)c1cc(N[C@@H](C)c2nc3c(s2)CCC3)cc(C)c1[N+](=O)[O-] ZINC000413388954 942125915 /nfs/dbraw/zinc/12/59/15/942125915.db2.gz ABGHAYUWHIWIHW-JTQLQIEISA-N 0 0 361.423 3.808 20 5 FHBDRN Cc1cc(C(=O)N(C)C2CCN(c3ccc(F)cc3)CC2)cc([N+](=O)[O-])c1 ZINC000102909757 942143253 /nfs/dbraw/zinc/14/32/53/942143253.db2.gz QDMPFJYCOSHAPS-UHFFFAOYSA-N 0 0 371.412 3.783 20 5 FHBDRN CCOc1ccccc1CN[C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000513690801 942144611 /nfs/dbraw/zinc/14/46/11/942144611.db2.gz MKEFWZDEXHHPFY-IBGZPJMESA-N 0 0 366.421 3.606 20 5 FHBDRN COc1cccc(-c2nsc(NC(=O)c3cc(C)cc([N+](=O)[O-])c3)n2)c1 ZINC000102910777 942145288 /nfs/dbraw/zinc/14/52/88/942145288.db2.gz SPLCCOLLLIIOAZ-UHFFFAOYSA-N 0 0 370.390 3.683 20 5 FHBDRN Cc1cccc(C(=O)N(C)C2CCN(c3ccc(F)cc3)CC2)c1[N+](=O)[O-] ZINC000102910730 942145555 /nfs/dbraw/zinc/14/55/55/942145555.db2.gz VKWXVCCGHOJWBK-UHFFFAOYSA-N 0 0 371.412 3.783 20 5 FHBDRN CN(Cc1cccc(C(F)(F)F)c1)C(=O)COc1ccccc1[N+](=O)[O-] ZINC000046713109 942145908 /nfs/dbraw/zinc/14/59/08/942145908.db2.gz BYBWLVYUAQGNHC-UHFFFAOYSA-N 0 0 368.311 3.651 20 5 FHBDRN CC(C)NC(=O)c1ccc(N[C@H](C)CCCc2cccnc2)c([N+](=O)[O-])c1 ZINC000413404913 942152784 /nfs/dbraw/zinc/15/27/84/942152784.db2.gz XOESRJPQZKICHP-OAHLLOKOSA-N 0 0 370.453 3.951 20 5 FHBDRN CCOc1ccc([C@@H]2C[C@H]2NC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)cc1 ZINC000412312438 942161309 /nfs/dbraw/zinc/16/13/09/942161309.db2.gz PIKDTPNWFWKBGM-VNTMZGSJSA-N 0 0 366.417 3.769 20 5 FHBDRN CCc1nc([C@H](C)NC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])cs1 ZINC000280306680 942162510 /nfs/dbraw/zinc/16/25/10/942162510.db2.gz XNDDFUXFLPSPQQ-QMMMGPOBSA-N 0 0 371.821 3.826 20 5 FHBDRN CCOCCC1(CNC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])CCC1 ZINC000280332707 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355.369 3.507 20 5 FHBDRN Cc1c(NC(=O)c2ccn(C(C)C)n2)cc(Br)cc1[N+](=O)[O-] ZINC000280420879 942180289 /nfs/dbraw/zinc/18/02/89/942180289.db2.gz AMLWXLOEJKRTDC-UHFFFAOYSA-N 0 0 367.203 3.695 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)NCc2ccccc2N2CCCCC2)c1 ZINC000183143630 942182755 /nfs/dbraw/zinc/18/27/55/942182755.db2.gz PJEOKWFZKQALLS-UHFFFAOYSA-N 0 0 369.421 3.524 20 5 FHBDRN CC(C)[C@@H]1N(C(=O)N[C@H](C)c2ccccc2[N+](=O)[O-])CC12CCOCC2 ZINC000413438158 942185684 /nfs/dbraw/zinc/18/56/84/942185684.db2.gz POHWNSVZJQXLLW-PBHICJAKSA-N 0 0 361.442 3.502 20 5 FHBDRN CCS[C@@H]1CCCCN(S(=O)(=O)c2cc(C)c(C)cc2[N+](=O)[O-])C1 ZINC000480921713 942187860 /nfs/dbraw/zinc/18/78/60/942187860.db2.gz QAADKFRXFGFBKN-CQSZACIVSA-N 0 0 372.512 3.508 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N(C)[C@H](c1ccccc1)C(F)(F)F ZINC000103050508 942192272 /nfs/dbraw/zinc/19/22/72/942192272.db2.gz UOWDLVVJCVNJPC-OAHLLOKOSA-N 0 0 368.311 3.979 20 5 FHBDRN COc1cc(C(=O)N(C)[C@H](c2ccccc2)C(F)(F)F)ccc1[N+](=O)[O-] 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CCC(=O)c1ccc(NCCc2cccc(C(=O)N(C)C)c2)c([N+](=O)[O-])c1 ZINC000280748929 942243052 /nfs/dbraw/zinc/24/30/52/942243052.db2.gz PKCFDWCERLRQJD-UHFFFAOYSA-N 0 0 369.421 3.544 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)OCC(=O)Nc2ccc(C)c(C)c2)c1 ZINC000016195798 942247909 /nfs/dbraw/zinc/24/79/09/942247909.db2.gz KVTWWMQRRVZXHL-UHFFFAOYSA-N 0 0 374.418 3.729 20 5 FHBDRN C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1cc2c(c(Cl)c1)OCO2 ZINC000103377141 942248105 /nfs/dbraw/zinc/24/81/05/942248105.db2.gz VCWVWTCGRIVZAU-SECBINFHSA-N 0 0 360.753 3.568 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)O[C@@H](C)C(=O)Nc2ccccc2)c1 ZINC000016196553 942248496 /nfs/dbraw/zinc/24/84/96/942248496.db2.gz HURQITIMUKVVAX-NSHDSACASA-N 0 0 360.391 3.501 20 5 FHBDRN CC(=O)c1cccc(O[C@H](C)C(=O)N2c3ccc([N+](=O)[O-])cc3C[C@H]2C)c1 ZINC000103375429 942249037 /nfs/dbraw/zinc/24/90/37/942249037.db2.gz CQOOKWBFTZVPRK-TZMCWYRMSA-N 0 0 368.389 3.543 20 5 FHBDRN C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)Cc1c[nH]c2cc(F)ccc12 ZINC000103375391 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/nfs/dbraw/zinc/30/12/24/942301224.db2.gz RSOMVBOGQVRKTG-UHFFFAOYSA-N 0 0 365.476 3.864 20 5 FHBDRN COc1ccc2c(c1)OC(C)(C)CN(C(=O)Nc1cccc([N+](=O)[O-])c1)C2 ZINC000421031526 942302780 /nfs/dbraw/zinc/30/27/80/942302780.db2.gz FXKMKYIWCMPVJD-UHFFFAOYSA-N 0 0 371.393 3.809 20 5 FHBDRN COC(=O)CC1(CC(=O)Nc2ccc3cc([N+](=O)[O-])ccc3n2)CCCC1 ZINC000187997444 942303057 /nfs/dbraw/zinc/30/30/57/942303057.db2.gz PGHVEPXTKODTJD-UHFFFAOYSA-N 0 0 371.393 3.595 20 5 FHBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1CSc1nnc2n1CCCCC2 ZINC000103718295 942303610 /nfs/dbraw/zinc/30/36/10/942303610.db2.gz QGHKCIJLBRZEFO-UHFFFAOYSA-N 0 0 362.455 3.992 20 5 FHBDRN COc1cc(OCC(=O)N[C@@H](C)c2ccc(C3CC3)cc2)ccc1[N+](=O)[O-] ZINC000416058778 942303925 /nfs/dbraw/zinc/30/39/25/942303925.db2.gz JCFHGLKZODCLEO-ZDUSSCGKSA-N 0 0 370.405 3.737 20 5 FHBDRN O=C(c1ccc2[nH]c3ccccc3c(=O)c2c1)N1CCCc2occc2C1 ZINC000378133189 942306669 /nfs/dbraw/zinc/30/66/69/942306669.db2.gz GQGSFISWHJUHIY-UHFFFAOYSA-N 0 0 358.397 3.863 20 5 FHBDRN Cc1ccc(C)c(NC(=O)[C@H](C)OC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)c1 ZINC000015655012 942306681 /nfs/dbraw/zinc/30/66/81/942306681.db2.gz FWDRZHFGJUGEMP-SHQCLWGWSA-N 0 0 368.389 3.795 20 5 FHBDRN Cc1c(Cl)cccc1NC(=O)[C@@H](C)OC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000015652896 942306756 /nfs/dbraw/zinc/30/67/56/942306756.db2.gz FDJNAYHPVWHSAW-LLVKDONJSA-N 0 0 362.769 3.741 20 5 FHBDRN COc1ccc(NC(=O)Cc2ccccc2Br)c([N+](=O)[O-])c1 ZINC000103736373 942307432 /nfs/dbraw/zinc/30/74/32/942307432.db2.gz QKRODGWESBHTOZ-UHFFFAOYSA-N 0 0 365.183 3.547 20 5 FHBDRN CC[C@@](C)(NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)c1nc(C)cs1 ZINC000413523880 942309816 /nfs/dbraw/zinc/30/98/16/942309816.db2.gz ZCWVRJPCANZKSW-HDMKZQKVSA-N 0 0 359.451 3.905 20 5 FHBDRN CCCCCc1ccc(NC(=O)C(=O)NCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000159073205 942311748 /nfs/dbraw/zinc/31/17/48/942311748.db2.gz VXVOKSJHSWLLBW-UHFFFAOYSA-N 0 0 369.421 3.582 20 5 FHBDRN CC(C)(C)c1ccc(NC(=O)N2CCc3ncsc3C2)cc1[N+](=O)[O-] ZINC000501126896 942313182 /nfs/dbraw/zinc/31/31/82/942313182.db2.gz FVQXZBSYIGELTJ-UHFFFAOYSA-N 0 0 360.439 3.939 20 5 FHBDRN CN(Cc1ccc(OC(F)F)cc1)C(=O)Cc1ccc([N+](=O)[O-])cc1F ZINC000122869795 942313175 /nfs/dbraw/zinc/31/31/75/942313175.db2.gz ITZFSHKGVZDTCN-UHFFFAOYSA-N 0 0 368.311 3.536 20 5 FHBDRN CC(C)c1ccc(C(=O)Nc2cccc(-n3ccnn3)c2)cc1[N+](=O)[O-] ZINC000188053150 942321415 /nfs/dbraw/zinc/32/14/15/942321415.db2.gz SPWLUJGPHAMACK-UHFFFAOYSA-N 0 0 351.366 3.551 20 5 FHBDRN COc1cc(C(=O)Nc2ccc(-c3cc[nH]n3)cc2)cc([N+](=O)[O-])c1C ZINC000188077785 942327649 /nfs/dbraw/zinc/32/76/49/942327649.db2.gz XZQRODSYJQDULH-UHFFFAOYSA-N 0 0 352.350 3.554 20 5 FHBDRN CO[C@@H](CNC(=O)Nc1c(C)ccc([N+](=O)[O-])c1C)c1ccc(F)cc1 ZINC000085637176 942329215 /nfs/dbraw/zinc/32/92/15/942329215.db2.gz MHDLERGMFJAXAE-INIZCTEOSA-N 0 0 361.373 3.860 20 5 FHBDRN CCOc1cc(Cl)ccc1CNC(=O)c1cc([N+](=O)[O-])ccc1OC ZINC000501162035 942331655 /nfs/dbraw/zinc/33/16/55/942331655.db2.gz GBZDOGCAHKFVCU-UHFFFAOYSA-N 0 0 364.785 3.586 20 5 FHBDRN CC[C@@H](NC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)[C@@H]1CC1(C)C ZINC000416085726 942333081 /nfs/dbraw/zinc/33/30/81/942333081.db2.gz SBDLXACYSNBKBD-JKSUJKDBSA-N 0 0 356.426 3.550 20 5 FHBDRN O=[N+]([O-])c1cc2c(ncnc2N2CCC[C@H](Oc3ccccc3)C2)s1 ZINC000413542113 942340491 /nfs/dbraw/zinc/34/04/91/942340491.db2.gz LJNSCVAVVGMKDF-ZDUSSCGKSA-N 0 0 356.407 3.647 20 5 FHBDRN C[C@@H]1CCN(S(=O)(=O)c2c(Cl)cc(Cl)cc2[N+](=O)[O-])C[C@@H]1C ZINC000501177879 942342439 /nfs/dbraw/zinc/34/24/39/942342439.db2.gz LBCCVKBQGSLVJW-BDAKNGLRSA-N 0 0 367.254 3.568 20 5 FHBDRN CC[C@@H]1CN(C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)C[C@@H](CC)O1 ZINC000421092743 942342620 /nfs/dbraw/zinc/34/26/20/942342620.db2.gz NSSDOVOUKWOITR-VXGBXAGGSA-N 0 0 373.356 3.618 20 5 FHBDRN Cc1ccccc1[C@@]1(F)CCN(C(=O)CCNc2ccccc2[N+](=O)[O-])C1 ZINC000501189783 942344064 /nfs/dbraw/zinc/34/40/64/942344064.db2.gz VXLMYFAACPRXSN-HXUWFJFHSA-N 0 0 371.412 3.803 20 5 FHBDRN Cc1nc(CC(C)C)oc1C(=O)Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1 ZINC000188139522 942346087 /nfs/dbraw/zinc/34/60/87/942346087.db2.gz SVAFVOAKYSJLGI-UHFFFAOYSA-N 0 0 369.381 3.732 20 5 FHBDRN O=C(Nc1ccnn1-c1ccc([N+](=O)[O-])cc1)c1cc(Cl)ccc1F ZINC000103930732 942346353 /nfs/dbraw/zinc/34/63/53/942346353.db2.gz MTXIOOZPWTVQDD-UHFFFAOYSA-N 0 0 360.732 3.825 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NC[C@@H](C)Oc1cccc(F)c1 ZINC000085635954 942347626 /nfs/dbraw/zinc/34/76/26/942347626.db2.gz ZXWZAGVFNJRRNI-GFCCVEGCSA-N 0 0 361.373 3.940 20 5 FHBDRN O=C(Cc1ccccc1Cl)Nc1ccnn1-c1ccc([N+](=O)[O-])cc1 ZINC000103931480 942347784 /nfs/dbraw/zinc/34/77/84/942347784.db2.gz HLTRMFONKLUKRZ-UHFFFAOYSA-N 0 0 356.769 3.615 20 5 FHBDRN O=C(NCC1CCC(F)(F)CC1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000501186481 942348645 /nfs/dbraw/zinc/34/86/45/942348645.db2.gz DHZWSMSQZNJJCC-UHFFFAOYSA-N 0 0 367.396 3.750 20 5 FHBDRN C[C@@H](Cc1cccs1)NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513710417 942352638 /nfs/dbraw/zinc/35/26/38/942352638.db2.gz SHSRRTYYOSNKFU-VIFPVBQESA-N 0 0 356.350 3.619 20 5 FHBDRN Cn1ccnc1[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(Cl)cc1 ZINC000016261689 942354183 /nfs/dbraw/zinc/35/41/83/942354183.db2.gz WXJBJCBAVSWEDL-MRXNPFEDSA-N 0 0 370.796 3.501 20 5 FHBDRN CC(C)Oc1cc(C(=O)NC[C@@H]2CCCC(F)(F)C2)ccc1[N+](=O)[O-] ZINC000412321436 942354672 /nfs/dbraw/zinc/35/46/72/942354672.db2.gz PFHRBOOXKJLJBO-GFCCVEGCSA-N 0 0 356.369 3.937 20 5 FHBDRN CO[C@@H]1CCCC[C@@H]1C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000513741744 942354759 /nfs/dbraw/zinc/35/47/59/942354759.db2.gz PPHFRXLQQSKDEX-QWHCGFSZSA-N 0 0 357.204 3.501 20 5 FHBDRN CC(C)(C)Oc1cc(N2CC(CO)(c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000413557461 942355220 /nfs/dbraw/zinc/35/52/20/942355220.db2.gz UVMKDYATLIIFTA-UHFFFAOYSA-N 0 0 356.422 3.522 20 5 FHBDRN O=[N+]([O-])c1ccc(CN2CCC(N3CCc4ccccc43)CC2)c(F)c1 ZINC000502330568 942364298 /nfs/dbraw/zinc/36/42/98/942364298.db2.gz FXPBJPYMHAYICJ-UHFFFAOYSA-N 0 0 355.413 3.761 20 5 FHBDRN CC[C@H](Cc1ccccc1)N(CC)C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000501283162 942372170 /nfs/dbraw/zinc/37/21/70/942372170.db2.gz LCBSFHWPBXWXOT-OAHLLOKOSA-N 0 0 366.421 3.955 20 5 FHBDRN COCCOc1ccc(Sc2ncnc3ccc([N+](=O)[O-])cc32)cc1 ZINC000613689606 942373406 /nfs/dbraw/zinc/37/34/06/942373406.db2.gz YAWZPDYDDNWGEW-UHFFFAOYSA-N 0 0 357.391 3.714 20 5 FHBDRN Cc1cc(NC(=O)C(=O)N(C)[C@H]2CCC[C@@H]2C(C)(C)C)ccc1[N+](=O)[O-] ZINC000419788734 942391616 /nfs/dbraw/zinc/39/16/16/942391616.db2.gz QNSRYWAZJFWERL-HOCLYGCPSA-N 0 0 361.442 3.515 20 5 FHBDRN CCNc1ccc(C(=O)NCc2ccc(C(F)(F)F)cc2)cc1[N+](=O)[O-] ZINC000016301159 942398505 /nfs/dbraw/zinc/39/85/05/942398505.db2.gz IMHDXFKYAACLKI-UHFFFAOYSA-N 0 0 367.327 3.975 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2C[C@H](C)C[C@@H]2c2cccnc2)c1 ZINC000366812455 942400596 /nfs/dbraw/zinc/40/05/96/942400596.db2.gz XGSFUQASHFPZKW-CRAIPNDOSA-N 0 0 369.421 3.677 20 5 FHBDRN O=[N+]([O-])c1cnccc1Sc1nnc(COc2ccc(Cl)cc2)o1 ZINC000066797383 942404039 /nfs/dbraw/zinc/40/40/39/942404039.db2.gz BWHXEVLKWYKIAD-UHFFFAOYSA-N 0 0 364.770 3.756 20 5 FHBDRN CC[S@](=O)[C@@H]1CCC[C@@H](Nc2ncc([N+](=O)[O-])cc2C(F)(F)F)C1 ZINC000413177061 942409064 /nfs/dbraw/zinc/40/90/64/942409064.db2.gz LKPZNVOPDDUBPV-MMQQVTTLSA-N 0 0 365.377 3.500 20 5 FHBDRN O=C(C1CCCCC1)N1CCC[C@@H]1c1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000366469180 942413300 /nfs/dbraw/zinc/41/33/00/942413300.db2.gz TYZJIANAEINDMT-MRXNPFEDSA-N 0 0 370.409 3.889 20 5 FHBDRN Cc1cc(NCc2ccc(C(C)C)c([N+](=O)[O-])c2)nn1CC(F)(F)F ZINC000419839025 942416220 /nfs/dbraw/zinc/41/62/20/942416220.db2.gz GUWYDMRCGABOLK-UHFFFAOYSA-N 0 0 356.348 3.819 20 5 FHBDRN CCOc1ccc(C(=O)N2CC=C(c3ccc(O)cc3)CC2)cc1[N+](=O)[O-] ZINC000183534825 942416837 /nfs/dbraw/zinc/41/68/37/942416837.db2.gz HVFOMNHKZPPNKD-UHFFFAOYSA-N 0 0 368.389 3.629 20 5 FHBDRN CCN(C(=O)c1cc(F)ccc1[N+](=O)[O-])[C@@H](C)Cc1ccc(OC)cc1 ZINC000066805825 942417985 /nfs/dbraw/zinc/41/79/85/942417985.db2.gz VXMRDJZFXVEHHW-ZDUSSCGKSA-N 0 0 360.385 3.836 20 5 FHBDRN O=C(c1ccc2ccncc2n1)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000424879449 942426118 /nfs/dbraw/zinc/42/61/18/942426118.db2.gz VRFNRFBYEUHGLL-MRXNPFEDSA-N 0 0 362.389 3.558 20 5 FHBDRN Cc1c(NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)cnn1CC(C)C ZINC000501354805 942429735 /nfs/dbraw/zinc/42/97/35/942429735.db2.gz MNKVFWSMIIXBSE-UHFFFAOYSA-N 0 0 357.414 3.582 20 5 FHBDRN C[C@@H](CCc1ccc(O)cc1)NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000413625332 942431702 /nfs/dbraw/zinc/43/17/02/942431702.db2.gz NKXCSYDDSRFNMP-FASAQXTFSA-N 0 0 354.406 3.541 20 5 FHBDRN CCO[C@H](C(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1)c1ccccc1 ZINC000413621516 942431754 /nfs/dbraw/zinc/43/17/54/942431754.db2.gz CMYXIRBVMQHCSW-IBGZPJMESA-N 0 0 354.406 3.864 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CCCOC2 ZINC000501341816 942432997 /nfs/dbraw/zinc/43/29/97/942432997.db2.gz RQAURRBMGZJSDG-SFHVURJKSA-N 0 0 364.467 3.740 20 5 FHBDRN Cc1ccc(CNc2ncc([N+](=O)[O-])cc2F)c(OCC(F)(F)F)c1 ZINC000413188462 942439232 /nfs/dbraw/zinc/43/92/32/942439232.db2.gz UORZVHZFDYHXSO-UHFFFAOYSA-N 0 0 359.279 3.991 20 5 FHBDRN Cc1n[nH]c(C(=O)N2CCCC[C@@H]2CCCc2ccccc2)c1[N+](=O)[O-] ZINC000502428178 942441176 /nfs/dbraw/zinc/44/11/76/942441176.db2.gz CNQXKGBZZQBJBI-MRXNPFEDSA-N 0 0 356.426 3.644 20 5 FHBDRN O=[N+]([O-])c1ccc(Cc2noc(C3(c4c(F)cccc4F)CCC3)n2)nc1 ZINC000421252660 942443870 /nfs/dbraw/zinc/44/38/70/942443870.db2.gz QSTPJBCJLYJDQH-UHFFFAOYSA-N 0 0 372.331 3.712 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H](C)c1ccccc1OC(C)C ZINC000617368900 942454915 /nfs/dbraw/zinc/45/49/15/942454915.db2.gz IIXWSDYPQRHUIJ-ZDUSSCGKSA-N 0 0 358.394 3.882 20 5 FHBDRN CC(C)(C)OC(=O)C(C)(C)CCNC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000424943873 942456652 /nfs/dbraw/zinc/45/66/52/942456652.db2.gz SKASPSYOUVBMQH-UHFFFAOYSA-N 0 0 370.833 3.736 20 5 FHBDRN Cc1c(Cl)cccc1NC(=O)[C@H](C)OC(=O)c1ccc([N+](=O)[O-])s1 ZINC000015855689 942466914 /nfs/dbraw/zinc/46/69/14/942466914.db2.gz SLHWOGTWJABPJL-VIFPVBQESA-N 0 0 368.798 3.802 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N(Cc1ccsc1)c1ccccc1 ZINC000505308515 942468997 /nfs/dbraw/zinc/46/89/97/942468997.db2.gz RBJOMKSRXLVWSY-UHFFFAOYSA-N 0 0 370.434 3.785 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1)N(S(=O)(=O)c1cc(Cl)ccc1Cl)CC2 ZINC000014099060 942469566 /nfs/dbraw/zinc/46/95/66/942469566.db2.gz LHWFUCREINMDMT-UHFFFAOYSA-N 0 0 373.217 3.653 20 5 FHBDRN CC(C)(C(=O)N[C@@H]1C[C@@]1(F)c1ccccc1)c1ccc([N+](=O)[O-])cc1F ZINC000424993172 942477430 /nfs/dbraw/zinc/47/74/30/942477430.db2.gz HJAHBCPKGMPYCO-VQIMIIECSA-N 0 0 360.360 3.765 20 5 FHBDRN CCOCCOc1ccccc1C(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000502506248 942484147 /nfs/dbraw/zinc/48/41/47/942484147.db2.gz GLNUVFLAYPSOIY-CQSZACIVSA-N 0 0 358.394 3.501 20 5 FHBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)N2CCCc3cc(Cl)ccc32)cc1 ZINC000501490711 942499821 /nfs/dbraw/zinc/49/98/21/942499821.db2.gz KGUZXBKSDSOEAP-UHFFFAOYSA-N 0 0 366.826 3.531 20 5 FHBDRN CCOC(=O)CSc1nc2cc([N+](=O)[O-])ccc2n1-c1ccccc1 ZINC000501491037 942500070 /nfs/dbraw/zinc/50/00/70/942500070.db2.gz LLLSTCXETZBXOZ-UHFFFAOYSA-N 0 0 357.391 3.589 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N(CC)c2cccc(OC)c2)cc1OC ZINC000501480923 942504083 /nfs/dbraw/zinc/50/40/83/942504083.db2.gz UHXGEMVXNIOSPH-UHFFFAOYSA-N 0 0 374.393 3.677 20 5 FHBDRN O=C(c1ccccc1[N+](=O)[O-])N1CCC(c2nc3c(s2)CCCC3)CC1 ZINC000425018958 942504509 /nfs/dbraw/zinc/50/45/09/942504509.db2.gz KDXGHLUELRMNPG-UHFFFAOYSA-N 0 0 371.462 3.950 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CCN(C2CC2)c2ccccc21 ZINC000413705765 942513199 /nfs/dbraw/zinc/51/31/99/942513199.db2.gz VKHHCCBZBPDUEZ-ZWKOTPCHSA-N 0 0 363.417 3.714 20 5 FHBDRN Cc1sc(C(=O)N2CCC[C@H](C)[C@@H]2C(=O)OC(C)(C)C)cc1[N+](=O)[O-] ZINC000425037820 942514396 /nfs/dbraw/zinc/51/43/96/942514396.db2.gz KXTJLAHBRUXBMD-IINYFYTJSA-N 0 0 368.455 3.547 20 5 FHBDRN Cc1sc(C(=O)N2CCC[C@@H](C)[C@@H]2C(=O)OC(C)(C)C)cc1[N+](=O)[O-] ZINC000425037821 942514647 /nfs/dbraw/zinc/51/46/47/942514647.db2.gz KXTJLAHBRUXBMD-QMTHXVAHSA-N 0 0 368.455 3.547 20 5 FHBDRN CCO[C@H]1C[C@@H](Nc2ccc([N+](=O)[O-])c3ncccc23)C12CCOCC2 ZINC000413228216 942516182 /nfs/dbraw/zinc/51/61/82/942516182.db2.gz KIDRFGMXSTZPRR-SJORKVTESA-N 0 0 357.410 3.529 20 5 FHBDRN C[C@H]1C[C@H](c2cccnc2)N(c2ncc([N+](=O)[O-])cc2C(F)(F)F)C1 ZINC000413236149 942538819 /nfs/dbraw/zinc/53/88/19/942538819.db2.gz QHQNRMVTTHLKRW-IINYFYTJSA-N 0 0 352.316 3.991 20 5 FHBDRN CC[C@@H](NC(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-])C(C)(C)c1ccccc1 ZINC000434244284 942544238 /nfs/dbraw/zinc/54/42/38/942544238.db2.gz RNLQSYGBLUBPCT-CQSZACIVSA-N 0 0 358.442 3.928 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N[C@H]2C[C@H]2c2c(F)cccc2Cl)c1[N+](=O)[O-] ZINC000434252402 942550016 /nfs/dbraw/zinc/55/00/16/942550016.db2.gz ZVTOUAWRSOISEI-KCJUWKMLSA-N 0 0 366.780 3.520 20 5 FHBDRN O=C(CCCOc1ccc(F)cc1)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000513838594 942550350 /nfs/dbraw/zinc/55/03/50/942550350.db2.gz UHTITBPQBYLHJZ-UHFFFAOYSA-N 0 0 358.369 3.872 20 5 FHBDRN CO[C@@H](C)C(=O)Nc1cccc(NC(=O)Nc2cc([N+](=O)[O-])ccc2C)c1 ZINC000502587542 942550900 /nfs/dbraw/zinc/55/09/00/942550900.db2.gz ILXXCVXEXJWHCQ-LBPRGKRZSA-N 0 0 372.381 3.521 20 5 FHBDRN CC[C@H](C)Oc1cc(C)ccc1CNC(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-] ZINC000434253793 942551222 /nfs/dbraw/zinc/55/12/22/942551222.db2.gz NBMCWKYQIDFCSG-ZDUSSCGKSA-N 0 0 374.441 3.857 20 5 FHBDRN COc1ccc(CNCc2cc(F)ccc2Br)cc1[N+](=O)[O-] ZINC000237215060 942551385 /nfs/dbraw/zinc/55/13/85/942551385.db2.gz GMIGVVDJXBZWAL-UHFFFAOYSA-N 0 0 369.190 3.795 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N(Cc2cccs2)C(C)C)c1F ZINC000413241966 942558225 /nfs/dbraw/zinc/55/82/25/942558225.db2.gz WNIGWGJQGRCZIU-UHFFFAOYSA-N 0 0 366.414 3.784 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CCO[C@H](c3ccccc3C(F)(F)F)C2)c(F)c1 ZINC000413244890 942559630 /nfs/dbraw/zinc/55/96/30/942559630.db2.gz NPEZVWBZGKUSPH-AWEZNQCLSA-N 0 0 371.290 3.726 20 5 FHBDRN CC[C@@H]1C[C@@]1(NC(=O)CCn1nc(C)c([N+](=O)[O-])c1C)c1cccc(C)c1 ZINC000501608022 942566342 /nfs/dbraw/zinc/56/63/42/942566342.db2.gz OFGVKNMVIQCXCQ-UZLBHIALSA-N 0 0 370.453 3.548 20 5 FHBDRN CC(C)n1ncc2c1C[C@H](Nc1ccc([N+](=O)[O-])c3ncccc13)CC2 ZINC000413258367 942569489 /nfs/dbraw/zinc/56/94/89/942569489.db2.gz GOZOOOMQKWKTQR-CQSZACIVSA-N 0 0 351.410 3.890 20 5 FHBDRN COc1cccc2c1CCCCN2C(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000513880432 942573081 /nfs/dbraw/zinc/57/30/81/942573081.db2.gz XJUPVGKRDDKXJG-UHFFFAOYSA-N 0 0 370.405 3.742 20 5 FHBDRN O=[N+]([O-])c1ccc2ccnc(NC3CCN(c4nccs4)CC3)c2c1 ZINC000413262306 942574001 /nfs/dbraw/zinc/57/40/01/942574001.db2.gz FUCIXGGHHGLTFB-UHFFFAOYSA-N 0 0 355.423 3.680 20 5 FHBDRN Cc1ccc2cc(C(=O)OCc3ccc(N(C)C)c([N+](=O)[O-])c3)ccc2n1 ZINC001268940843 942574538 /nfs/dbraw/zinc/57/45/38/942574538.db2.gz ADTSJHKHFHWGPR-UHFFFAOYSA-N 0 0 365.389 3.874 20 5 FHBDRN CN(C)c1ccc(COC(=O)c2cc(F)c(Cl)cc2F)cc1[N+](=O)[O-] ZINC001268941384 942575208 /nfs/dbraw/zinc/57/52/08/942575208.db2.gz PIRWTJIRPYOVBZ-UHFFFAOYSA-N 0 0 370.739 3.949 20 5 FHBDRN Nc1c(C(=O)N2CC3(CCCC3)c3ccccc32)cc(F)cc1[N+](=O)[O-] ZINC000434286009 942577419 /nfs/dbraw/zinc/57/74/19/942577419.db2.gz HPBLYOHRRIWVLO-UHFFFAOYSA-N 0 0 355.369 3.788 20 5 FHBDRN Cc1c(NC(=O)[C@H](C)CC(F)F)cc(Br)cc1[N+](=O)[O-] ZINC000413767400 942580806 /nfs/dbraw/zinc/58/08/06/942580806.db2.gz NCTXDSJXKJKVEI-ZCFIWIBFSA-N 0 0 351.147 3.896 20 5 FHBDRN COc1ccc(CCCNC(=O)c2cc([N+](=O)[O-])c(C)cc2C)cc1OC ZINC000421448977 942581042 /nfs/dbraw/zinc/58/10/42/942581042.db2.gz VMOZSTJBJXFEQI-UHFFFAOYSA-N 0 0 372.421 3.591 20 5 FHBDRN CC[C@H]1C[C@]1(NC(=O)COc1ccccc1[N+](=O)[O-])c1cccc(C)c1 ZINC000501632157 942581465 /nfs/dbraw/zinc/58/14/65/942581465.db2.gz RUOZJGHCPDEWMC-MGPUTAFESA-N 0 0 354.406 3.724 20 5 FHBDRN COCCN(CCc1ccccc1)C(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC000421450266 942581733 /nfs/dbraw/zinc/58/17/33/942581733.db2.gz JIWSEGQKOMEOCN-UHFFFAOYSA-N 0 0 356.422 3.543 20 5 FHBDRN O=C(c1c[nH]c2cccc([N+](=O)[O-])c21)N1CCC[C@@H](Oc2ccccc2)C1 ZINC000416272735 942586601 /nfs/dbraw/zinc/58/66/01/942586601.db2.gz XDZJNCYUIPZAHU-OAHLLOKOSA-N 0 0 365.389 3.760 20 5 FHBDRN COc1ccccc1[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])c(C)cc2C)C1 ZINC000421475071 942592697 /nfs/dbraw/zinc/59/26/97/942592697.db2.gz MIXVUPKJTXPORI-HNNXBMFYSA-N 0 0 354.406 3.850 20 5 FHBDRN COCc1nccc([C@H]2CCCN(c3c(Cl)cccc3[N+](=O)[O-])C2)n1 ZINC000366566870 942594264 /nfs/dbraw/zinc/59/42/64/942594264.db2.gz CMKSSQQYWUOAMC-LBPRGKRZSA-N 0 0 362.817 3.569 20 5 FHBDRN CC[C@H]1CCCC[C@H]1CNC(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000452426252 942594631 /nfs/dbraw/zinc/59/46/31/942594631.db2.gz TUHRJYWBNINDQU-STQMWFEESA-N 0 0 350.415 3.558 20 5 FHBDRN COCc1nc(CNc2cccc(Oc3ccc([N+](=O)[O-])cc3)c2)no1 ZINC000502612045 942594661 /nfs/dbraw/zinc/59/46/61/942594661.db2.gz CDMLEJRJAVVKPY-UHFFFAOYSA-N 0 0 356.338 3.529 20 5 FHBDRN C[C@@]1(CNC(=O)CCNc2ccccc2[N+](=O)[O-])C[C@H]1c1ccccc1 ZINC000501666684 942599154 /nfs/dbraw/zinc/59/91/54/942599154.db2.gz HVHPTLSZQDEONK-JXFKEZNVSA-N 0 0 353.422 3.707 20 5 FHBDRN CCOC(=O)c1cc(C(=O)Nc2cccc(C(=O)CC)c2)cc([N+](=O)[O-])c1 ZINC000434334130 942600630 /nfs/dbraw/zinc/60/06/30/942600630.db2.gz NCEFYGJEZGPIPS-UHFFFAOYSA-N 0 0 370.361 3.617 20 5 FHBDRN O=C(Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1)Nc1ccc(F)c(Cl)c1 ZINC000501671202 942602377 /nfs/dbraw/zinc/60/23/77/942602377.db2.gz AKTBPPXHLMQQNE-UHFFFAOYSA-N 0 0 374.759 3.890 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2cnn(CCCOc3ccc4c(c3)OCO4)c2)c1 ZINC000501674515 942604593 /nfs/dbraw/zinc/60/45/93/942604593.db2.gz MIGSDVOVZNUOKQ-UHFFFAOYSA-N 0 0 367.361 3.656 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NCCc1nc(C(F)(F)F)cs1 ZINC000421499972 942610822 /nfs/dbraw/zinc/61/08/22/942610822.db2.gz JXTPGCDQTYJPEL-UHFFFAOYSA-N 0 0 373.356 3.659 20 5 FHBDRN O=[N+]([O-])c1ccc2ccnc(N[C@H]3CCCN(CC(F)(F)F)C3)c2c1 ZINC000413294592 942613825 /nfs/dbraw/zinc/61/38/25/942613825.db2.gz GNUUSZLFKGDXPM-LBPRGKRZSA-N 0 0 354.332 3.582 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)Nc1nc2c(s1)CN(C(C)C)CC2 ZINC000421514343 942620977 /nfs/dbraw/zinc/62/09/77/942620977.db2.gz QWWGQDNQZMSIGW-UHFFFAOYSA-N 0 0 374.466 3.687 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N2C[C@H](C)C[C@@H]2c2ccccc2)c1F ZINC000412347150 942621232 /nfs/dbraw/zinc/62/12/32/942621232.db2.gz NZBQWXVDZLSIJD-CXAGYDPISA-N 0 0 372.396 3.895 20 5 FHBDRN COc1ccc(CNC(=O)c2occc2-c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000501713861 942623699 /nfs/dbraw/zinc/62/36/99/942623699.db2.gz DNKNPGJZFJSGFV-UHFFFAOYSA-N 0 0 370.336 3.933 20 5 FHBDRN COc1ccc(NC(=O)C2(c3c(F)cccc3F)CCC2)cc1[N+](=O)[O-] ZINC000421519705 942624828 /nfs/dbraw/zinc/62/48/28/942624828.db2.gz WOXAITFJLZQPSR-UHFFFAOYSA-N 0 0 362.332 3.942 20 5 FHBDRN CCN(C(=O)c1cc(OC)c(OC)c([N+](=O)[O-])c1)c1ccc2[nH]ccc2c1 ZINC000472966913 942631344 /nfs/dbraw/zinc/63/13/44/942631344.db2.gz KIDWZDGCDCQXNO-UHFFFAOYSA-N 0 0 369.377 3.760 20 5 FHBDRN CC[C@@H](CSc1ccccc1)NC(=O)c1ccc(OC)c([N+](=O)[O-])c1 ZINC000501708754 942632264 /nfs/dbraw/zinc/63/22/64/942632264.db2.gz MYLZFLXSSDSVMC-AWEZNQCLSA-N 0 0 360.435 3.904 20 5 FHBDRN COC(=O)c1cc(C(=O)N(C)[C@@H]2CCC[C@H]2C(C)(C)C)cc([N+](=O)[O-])c1 ZINC000416308547 942635327 /nfs/dbraw/zinc/63/53/27/942635327.db2.gz MHLJKXZHVBTYGS-HZPDHXFCSA-N 0 0 362.426 3.668 20 5 FHBDRN Cc1c(C(=O)N2CCS[C@H]2c2ccc([N+](=O)[O-])cc2)cnn1CC(C)C ZINC000501728448 942635999 /nfs/dbraw/zinc/63/59/99/942635999.db2.gz IEQFOODRIYARLP-SFHVURJKSA-N 0 0 374.466 3.644 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N[C@H](C)[C@@H](c1ccccc1)[NH+](C)C ZINC000421526889 942637690 /nfs/dbraw/zinc/63/76/90/942637690.db2.gz XPFLPZBVZDGTBJ-BEFAXECRSA-N 0 0 355.438 3.633 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCSC[C@@H]1c1nccs1 ZINC000421525560 942637854 /nfs/dbraw/zinc/63/78/54/942637854.db2.gz GHOMDMZJGKPTPT-CQSZACIVSA-N 0 0 363.464 3.598 20 5 FHBDRN CSCC1CCC(NC(=O)c2ccc(SC)c([N+](=O)[O-])c2)CC1 ZINC000452483889 942645614 /nfs/dbraw/zinc/64/56/14/942645614.db2.gz ZYMOUGDAXBXDNU-UHFFFAOYSA-N 0 0 354.497 3.968 20 5 FHBDRN C[C@@H]1C[C@@H](NC(=O)CSc2ccccc2[N+](=O)[O-])c2ccccc2O1 ZINC000452480269 942646881 /nfs/dbraw/zinc/64/68/81/942646881.db2.gz JKMPGKCFGLHCAG-TZMCWYRMSA-N 0 0 358.419 3.715 20 5 FHBDRN CC(C)(C(=O)Nc1cc2c(cc1F)NC(=O)CC2)c1ccccc1[N+](=O)[O-] ZINC000501746225 942648930 /nfs/dbraw/zinc/64/89/30/942648930.db2.gz FWOQBPVUINTABG-UHFFFAOYSA-N 0 0 371.368 3.535 20 5 FHBDRN Cc1nc(NC(=O)c2cc(F)c(C(F)(F)F)c(F)c2)ccc1[N+](=O)[O-] ZINC000617511399 942649040 /nfs/dbraw/zinc/64/90/40/942649040.db2.gz BIUAOQKUKPIETE-UHFFFAOYSA-N 0 0 361.226 3.848 20 5 FHBDRN Cn1cc(C(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)c(C2CCC2)n1 ZINC000413830236 942650465 /nfs/dbraw/zinc/65/04/65/942650465.db2.gz FERVWXBSQHLUHK-INIZCTEOSA-N 0 0 368.437 3.616 20 5 FHBDRN CCN(Cc1ccc(OC)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000122914293 942653376 /nfs/dbraw/zinc/65/33/76/942653376.db2.gz UESTYZQQFDFSIN-UHFFFAOYSA-N 0 0 359.382 3.666 20 5 FHBDRN COc1cc2c(c(OC)c1)N(C(=O)c1cc([N+](=O)[O-])c(C)cc1C)CCC2 ZINC000421556351 942658884 /nfs/dbraw/zinc/65/88/84/942658884.db2.gz LKGSPABMUUFGIE-UHFFFAOYSA-N 0 0 370.405 3.822 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CCn2c(cc3ccccc32)C1 ZINC000412355008 942661844 /nfs/dbraw/zinc/66/18/44/942661844.db2.gz KUZXOEDHPJTYAM-RBUKOAKNSA-N 0 0 361.401 3.695 20 5 FHBDRN COCCN(C(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1)c1ccccc1 ZINC000413844641 942664236 /nfs/dbraw/zinc/66/42/36/942664236.db2.gz MNUOANXXOOTHJS-UHFFFAOYSA-N 0 0 358.394 3.675 20 5 FHBDRN O=[N+]([O-])c1ccc(N[C@@H]2CCO[C@@H](c3cccnc3)C2)c2cccnc21 ZINC000413322964 942664311 /nfs/dbraw/zinc/66/43/11/942664311.db2.gz SGSMINMOODZERM-RDTXWAMCSA-N 0 0 350.378 3.870 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NCCc1cccc(C(F)(F)F)n1 ZINC000421576243 942667068 /nfs/dbraw/zinc/66/70/68/942667068.db2.gz OZTVFPVKGOOTDT-UHFFFAOYSA-N 0 0 367.327 3.598 20 5 FHBDRN COc1cc(NC(=O)Nc2cccc([N+](=O)[O-])c2C)cc(OC)c1OC ZINC000502702471 942669823 /nfs/dbraw/zinc/66/98/23/942669823.db2.gz BTMRSQFZNNXRRH-UHFFFAOYSA-N 0 0 361.354 3.573 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N2CC=C(c3cccnc3)CC2)c1 ZINC000378375208 942674677 /nfs/dbraw/zinc/67/46/77/942674677.db2.gz GNARKKGLDZSBEF-UHFFFAOYSA-N 0 0 355.419 3.641 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)NC[C@@H]1CC12CCSCC2 ZINC000421594279 942677127 /nfs/dbraw/zinc/67/71/27/942677127.db2.gz YMHRYDRGQRAXGA-NSHDSACASA-N 0 0 354.859 3.820 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1CN1CCCC[C@@H]1c1noc(C2CC2)n1 ZINC000366612204 942679491 /nfs/dbraw/zinc/67/94/91/942679491.db2.gz YBYZOYFKRLBUNK-OAHLLOKOSA-N 0 0 358.398 3.591 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H](c1ccccc1)[C@@H]1CCOC1 ZINC000378380757 942687653 /nfs/dbraw/zinc/68/76/53/942687653.db2.gz WCNOQFDWWYBDKN-QAPCUYQASA-N 0 0 355.394 3.803 20 5 FHBDRN COCC1(c2nc(Cc3c[nH]c4ccc([N+](=O)[O-])cc34)no2)CCCC1 ZINC000420486978 942691259 /nfs/dbraw/zinc/69/12/59/942691259.db2.gz IIURAIXGBJBLEY-UHFFFAOYSA-N 0 0 356.382 3.508 20 5 FHBDRN C[C@@H]1CCCN(c2ccc(C(=O)NC[C@@H]3CC=CCC3)cc2[N+](=O)[O-])C1 ZINC000519021579 942699446 /nfs/dbraw/zinc/69/94/46/942699446.db2.gz OEFWMCKUZOQOFD-HZPDHXFCSA-N 0 0 357.454 3.917 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2noc(-c3nc4c(s3)CCC4)n2)c2c1NCCC2 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366.320 3.872 20 5 FHBDRN O=C(NCc1csc(CCc2ccccc2)n1)c1ccccc1[N+](=O)[O-] ZINC000434556484 942753930 /nfs/dbraw/zinc/75/39/30/942753930.db2.gz LQBRASPXAJMNPS-UHFFFAOYSA-N 0 0 367.430 3.767 20 5 FHBDRN O=C(COc1cccc([N+](=O)[O-])c1)Nc1ccc2c(c1)C(=O)CCCC2 ZINC000421715689 942767896 /nfs/dbraw/zinc/76/78/96/942767896.db2.gz NMXFHRSQRXGVAG-UHFFFAOYSA-N 0 0 354.362 3.521 20 5 FHBDRN CC(C)n1cc(C(C)(C)NC(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)nn1 ZINC000421737571 942773376 /nfs/dbraw/zinc/77/33/76/942773376.db2.gz LPLWDHCAVHPPHT-UHFFFAOYSA-N 0 0 373.457 3.730 20 5 FHBDRN CN(C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)c1nc2ccccc2o1 ZINC000514135993 942774696 /nfs/dbraw/zinc/77/46/96/942774696.db2.gz JLMUVMTVOISUCL-UHFFFAOYSA-N 0 0 363.276 3.614 20 5 FHBDRN CCN(Cc1cccc(F)c1)C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514139496 942777527 /nfs/dbraw/zinc/77/75/27/942777527.db2.gz BFFNCKMZFWKADA-UHFFFAOYSA-N 0 0 368.311 3.998 20 5 FHBDRN CCOC(=O)c1ccc(F)c(C)c1NC(=O)c1csc([N+](=O)[O-])c1 ZINC000505435604 942778756 /nfs/dbraw/zinc/77/87/56/942778756.db2.gz XFMLURDJOOYGNB-UHFFFAOYSA-N 0 0 352.343 3.533 20 5 FHBDRN Cn1ncc([N+](=O)[O-])c1NC(=O)c1cc2c(s1)CC[C@H](C(C)(C)C)C2 ZINC001269819214 942788287 /nfs/dbraw/zinc/78/82/87/942788287.db2.gz GCBBXNGMNODHID-NSHDSACASA-N 0 0 362.455 3.793 20 5 FHBDRN COC(=O)CCCOc1ccc(CNc2ccc(C)cc2[N+](=O)[O-])cc1 ZINC000514181297 942791021 /nfs/dbraw/zinc/79/10/21/942791021.db2.gz AVQGLWBWTULYSX-UHFFFAOYSA-N 0 0 358.394 3.847 20 5 FHBDRN CSCc1nc2ccccc2n1CC(=O)OCc1ccc([N+](=O)[O-])cc1 ZINC000016540970 942791762 /nfs/dbraw/zinc/79/17/62/942791762.db2.gz DTUCRVKKNBQJRI-UHFFFAOYSA-N 0 0 371.418 3.551 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1F)Nc1ccc2cccc(Cl)c2n1 ZINC000505447013 942795608 /nfs/dbraw/zinc/79/56/08/942795608.db2.gz ZXKGYJDOYPOEIG-UHFFFAOYSA-N 0 0 359.744 3.539 20 5 FHBDRN CCOC(=O)CC[C@H](C)Sc1nc2cc3ccccc3cc2c(=O)n1C ZINC000505443562 942800449 /nfs/dbraw/zinc/80/04/49/942800449.db2.gz JVLTXSGCEDOBBL-ZDUSSCGKSA-N 0 0 370.474 3.911 20 5 FHBDRN CCN(CC(F)(F)F)C(=O)[C@H]1CCCN(c2ccc([N+](=O)[O-])c(C)c2)C1 ZINC000514176406 942802674 /nfs/dbraw/zinc/80/26/74/942802674.db2.gz PETJPKXQWOSKAD-ZDUSSCGKSA-N 0 0 373.375 3.530 20 5 FHBDRN C[C@@H](c1ccccc1Br)N(C)C(=O)c1cc([N+](=O)[O-])c[nH]1 ZINC000502861603 942804382 /nfs/dbraw/zinc/80/43/82/942804382.db2.gz MCMBJVQBFXVOBK-VIFPVBQESA-N 0 0 352.188 3.519 20 5 FHBDRN C[C@H]1CCCC[C@@H]1OCCNC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000431871693 942805034 /nfs/dbraw/zinc/80/50/34/942805034.db2.gz MPJUTFLZAVAVCD-YOEHRIQHSA-N 0 0 363.458 3.724 20 5 FHBDRN Cc1ccc(NCc2nnc3ccc(C(F)(F)F)cn32)c([N+](=O)[O-])c1 ZINC000514201934 942811455 /nfs/dbraw/zinc/81/14/55/942811455.db2.gz OPIXDQYFZIZJPQ-UHFFFAOYSA-N 0 0 351.288 3.577 20 5 FHBDRN Cc1cc(Br)c(=O)n(Cc2cc([N+](=O)[O-])ccc2Cl)c1 ZINC000783123134 942812204 /nfs/dbraw/zinc/81/22/04/942812204.db2.gz AFROGKOJENREOC-UHFFFAOYSA-N 0 0 357.591 3.529 20 5 FHBDRN COCC1CCC(NC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000413947807 942813231 /nfs/dbraw/zinc/81/32/31/942813231.db2.gz ALCZMOPQAJTJOJ-UHFFFAOYSA-N 0 0 372.874 3.662 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)N1CC2(CCOCC2)[C@H]1c1ccccc1 ZINC000413955952 942819719 /nfs/dbraw/zinc/81/97/19/942819719.db2.gz NIKRWXLRYXHPKN-HXUWFJFHSA-N 0 0 366.417 3.518 20 5 FHBDRN C[C@H]1c2ccccc2CCN1C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514216996 942824942 /nfs/dbraw/zinc/82/49/42/942824942.db2.gz ACBXCGJTDNXNQB-NSHDSACASA-N 0 0 362.332 3.956 20 5 FHBDRN CC(C)c1ccc(C(=O)N2CCO[C@H](c3cccs3)C2)cc1[N+](=O)[O-] ZINC000190122305 942825353 /nfs/dbraw/zinc/82/53/53/942825353.db2.gz BYAAMKYOLPPPDO-INIZCTEOSA-N 0 0 360.435 3.993 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N(C)c1ccc(OC)c(OC)c1 ZINC000545903896 942829403 /nfs/dbraw/zinc/82/94/03/942829403.db2.gz XVZUGIAVHXOWCW-HNNXBMFYSA-N 0 0 372.421 3.844 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(CCc3ccccc32)C1 ZINC000421792336 942829413 /nfs/dbraw/zinc/82/94/13/942829413.db2.gz OAFVMKYRCFHNNP-NRFANRHFSA-N 0 0 366.417 3.526 20 5 FHBDRN CCOc1cc(CS(=O)(=O)C/C=C/c2ccccc2)ccc1[N+](=O)[O-] ZINC000434639049 942829603 /nfs/dbraw/zinc/82/96/03/942829603.db2.gz WPKZMUMDNIGNFM-RMKNXTFCSA-N 0 0 361.419 3.622 20 5 FHBDRN Cc1nn(Cc2nc(Cc3ccccc3C)no2)c2ccc([N+](=O)[O-])cc12 ZINC000502901627 942842086 /nfs/dbraw/zinc/84/20/86/942842086.db2.gz IIPQZOZWMDWMHS-UHFFFAOYSA-N 0 0 363.377 3.583 20 5 FHBDRN CCCCN(CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)CC(F)(F)F ZINC000502905168 942845462 /nfs/dbraw/zinc/84/54/62/942845462.db2.gz XVWFSZFVCVADQE-UHFFFAOYSA-N 0 0 361.364 3.896 20 5 FHBDRN COC[C@@H](Cc1ccccc1)N(C)C(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000190192672 942849688 /nfs/dbraw/zinc/84/96/88/942849688.db2.gz PKWYXITUDQXJLG-HNAYVOBHSA-N 0 0 371.437 3.555 20 5 FHBDRN CN(Cc1cccc(O)c1)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000047866312 942851542 /nfs/dbraw/zinc/85/15/42/942851542.db2.gz JZIWQCXFXCJIKB-UHFFFAOYSA-N 0 0 367.308 3.566 20 5 FHBDRN C[C@H](O)[C@@H]1CCCCN1C(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000181611190 942857097 /nfs/dbraw/zinc/85/70/97/942857097.db2.gz JINPAYRYIMKTPP-KSSFIOAISA-N 0 0 369.421 3.714 20 5 FHBDRN Cc1cc([C@@H](C)NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)c(C)o1 ZINC000514245878 942860902 /nfs/dbraw/zinc/86/09/02/942860902.db2.gz DOOMTAKSRNRWRC-SECBINFHSA-N 0 0 354.309 3.897 20 5 FHBDRN COc1cccc(C2=CCN(C(=O)Nc3cc([N+](=O)[O-])ccc3C)C2)c1 ZINC000378528828 942864617 /nfs/dbraw/zinc/86/46/17/942864617.db2.gz LQFOSTRZWSBFRO-UHFFFAOYSA-N 0 0 353.378 3.843 20 5 FHBDRN CN(Cc1cccc(O)c1)c1ccc([N+](=O)[O-])c(OCc2ccccc2)n1 ZINC000545903971 942867934 /nfs/dbraw/zinc/86/79/34/942867934.db2.gz NFEAIUMWHWDZRY-UHFFFAOYSA-N 0 0 365.389 3.911 20 5 FHBDRN Nc1cccc([N+](=O)[O-])c1C(=O)N1C[C@H](c2ccccc2)C2(CCC2)C1 ZINC000413985106 942867983 /nfs/dbraw/zinc/86/79/83/942867983.db2.gz LZNIENQDNDPUDX-OAHLLOKOSA-N 0 0 351.406 3.587 20 5 FHBDRN CCn1ccnc1[C@@H]1CCCCN1C(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC000421870925 942870335 /nfs/dbraw/zinc/87/03/35/942870335.db2.gz AURRZEPHVDLWHB-INIZCTEOSA-N 0 0 356.426 3.795 20 5 FHBDRN O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N[C@@H]1C[C@H]2C[C@H]2C1 ZINC000425149249 942874244 /nfs/dbraw/zinc/87/42/44/942874244.db2.gz ZHMMEQXDHDYPSA-DOFRTFSJSA-N 0 0 360.357 3.620 20 5 FHBDRN CC[C@@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)Nc1cccc2ccsc21 ZINC000502955342 942874989 /nfs/dbraw/zinc/87/49/89/942874989.db2.gz KIJGWTBAXWVFNC-GFCCVEGCSA-N 0 0 373.438 3.681 20 5 FHBDRN C[C@H]1C[C@@H](c2ccccc2)C[C@@H](NC(=O)c2c(N)cccc2[N+](=O)[O-])C1 ZINC000413995313 942875003 /nfs/dbraw/zinc/87/50/03/942875003.db2.gz STXXGWMMUGVSSW-IMJJTQAJSA-N 0 0 353.422 3.879 20 5 FHBDRN Cc1ccc(C(=O)OCc2cccc([N+](=O)[O-])c2C)c(Br)n1 ZINC000756426654 942884552 /nfs/dbraw/zinc/88/45/52/942884552.db2.gz QTPDJWOIPBNAAN-UHFFFAOYSA-N 0 0 365.183 3.726 20 5 FHBDRN COc1cc(C(=O)N[C@H](C)c2ccc(F)c(C)c2)cc([N+](=O)[O-])c1OC ZINC000434164068 942886765 /nfs/dbraw/zinc/88/67/65/942886765.db2.gz POFSAHSAEBRMAS-LLVKDONJSA-N 0 0 362.357 3.551 20 5 FHBDRN COc1cc(C(=O)N2CCC[C@H](CC(F)(F)F)C2)c([N+](=O)[O-])cc1F ZINC000421965414 942896754 /nfs/dbraw/zinc/89/67/54/942896754.db2.gz OHOALASHHBIQQS-SECBINFHSA-N 0 0 364.295 3.547 20 5 FHBDRN CCO[C@H]1C[C@H](N(C)C(=O)c2ccc([N+](=O)[O-])c(OC)c2)C1(CC)CC ZINC000434184155 942898385 /nfs/dbraw/zinc/89/83/85/942898385.db2.gz REJSHVYERHAEGL-IRXDYDNUSA-N 0 0 364.442 3.659 20 5 FHBDRN CCO[C@@H]1C[C@H](N(C)C(=O)c2ccc([N+](=O)[O-])c(OC)c2)C1(CC)CC ZINC000434184153 942898692 /nfs/dbraw/zinc/89/86/92/942898692.db2.gz REJSHVYERHAEGL-DLBZAZTESA-N 0 0 364.442 3.659 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N(C)c1ccc(OC)nc1 ZINC000502997562 942900040 /nfs/dbraw/zinc/90/00/40/942900040.db2.gz YDNXOLBYRRVUIW-UHFFFAOYSA-N 0 0 361.423 3.777 20 5 FHBDRN COc1ccc(C(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1-c1ccnn1C ZINC000510003107 942901988 /nfs/dbraw/zinc/90/19/88/942901988.db2.gz QSUWCVRVHNLCDT-UHFFFAOYSA-N 0 0 366.377 3.565 20 5 FHBDRN O=C(c1cc(N2CCC3(CCCC3)CC2)ccc1[N+](=O)[O-])N1CCCC1 ZINC000078022271 942913511 /nfs/dbraw/zinc/91/35/11/942913511.db2.gz KIBPJOFJCBCZLX-UHFFFAOYSA-N 0 0 357.454 3.991 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)c1csc(-c2ncccc2F)n1 ZINC000510001907 942915081 /nfs/dbraw/zinc/91/50/81/942915081.db2.gz IRPSCIZTAFUTPX-UHFFFAOYSA-N 0 0 358.354 3.813 20 5 FHBDRN Cc1c(NC(=O)c2csc(-c3ncccc3F)n2)cccc1[N+](=O)[O-] ZINC000510007848 942919680 /nfs/dbraw/zinc/91/96/80/942919680.db2.gz NXGYZAZWPSEWDK-UHFFFAOYSA-N 0 0 358.354 3.813 20 5 FHBDRN CC[C@@H]1CN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])C[C@H](CC)O1 ZINC000421990012 942922591 /nfs/dbraw/zinc/92/25/91/942922591.db2.gz WNCZBWFONSQFNO-TXEJJXNPSA-N 0 0 360.332 3.643 20 5 FHBDRN CC[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C[C@@H](CC)O1 ZINC000421989989 942922615 /nfs/dbraw/zinc/92/26/15/942922615.db2.gz WLKUSKRXPHIHIE-ZIAGYGMSSA-N 0 0 360.332 3.643 20 5 FHBDRN CC[C@@H]1CN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])C[C@@H](CC)O1 ZINC000421990013 942922699 /nfs/dbraw/zinc/92/26/99/942922699.db2.gz WNCZBWFONSQFNO-VXGBXAGGSA-N 0 0 360.332 3.643 20 5 FHBDRN COc1cc(CSc2ncn(-c3ccccc3)n2)c([N+](=O)[O-])cc1F ZINC000183847899 942928190 /nfs/dbraw/zinc/92/81/90/942928190.db2.gz YRSPQXLMNKQCJL-UHFFFAOYSA-N 0 0 360.370 3.616 20 5 FHBDRN Cc1ccc(-c2nnc([C@H](C)Oc3ccc([N+](=O)[O-])c(CO)c3)o2)cc1C ZINC000431884509 942930818 /nfs/dbraw/zinc/93/08/18/942930818.db2.gz PQYRFZBTPBXLKO-ZDUSSCGKSA-N 0 0 369.377 3.894 20 5 FHBDRN COc1ccc(C(=O)Nc2c(C)cnc3c(OC)cccc32)cc1[N+](=O)[O-] ZINC000430119542 942931302 /nfs/dbraw/zinc/93/13/02/942931302.db2.gz DLUBXBGPWODXDU-UHFFFAOYSA-N 0 0 367.361 3.721 20 5 FHBDRN Cc1cc(F)c([N+](=O)[O-])cc1C(=O)N[C@@H]1CCO[C@H](c2ccccc2)C1 ZINC001269854056 942935056 /nfs/dbraw/zinc/93/50/56/942935056.db2.gz NOJQJFQIEUEPSS-KDOFPFPSSA-N 0 0 358.369 3.692 20 5 FHBDRN CCCN(CC)c1ccc(C(=O)NCc2ccc(OC)c([N+](=O)[O-])c2)cc1 ZINC000503062729 942945325 /nfs/dbraw/zinc/94/53/25/942945325.db2.gz DQQXYOBJSPSNGB-UHFFFAOYSA-N 0 0 371.437 3.770 20 5 FHBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N(C)Cc1cc(Cl)ccc1F ZINC000434755723 942946323 /nfs/dbraw/zinc/94/63/23/942946323.db2.gz LJGPLCOSPKLFCN-UHFFFAOYSA-N 0 0 372.805 3.516 20 5 FHBDRN Cc1ccc(S(=O)(=O)N(C)Cc2cc(Cl)ccc2F)c([N+](=O)[O-])c1 ZINC000434775006 942952029 /nfs/dbraw/zinc/95/20/29/942952029.db2.gz NKNSRQHQKMCDIO-UHFFFAOYSA-N 0 0 372.805 3.516 20 5 FHBDRN CCCN(CC(=O)Nc1ccc([N+](=O)[O-])cc1C)Cc1ccc(F)cc1 ZINC000434750608 942952090 /nfs/dbraw/zinc/95/20/90/942952090.db2.gz XOHZVXOUAJYIHK-UHFFFAOYSA-N 0 0 359.401 3.893 20 5 FHBDRN Cc1ccc(C(=O)NCc2cccc([N+](=O)[O-])c2C)cc1-c1cnn(C)c1 ZINC001269215458 942958887 /nfs/dbraw/zinc/95/88/87/942958887.db2.gz NSFRWSVSYXNZNB-UHFFFAOYSA-N 0 0 364.405 3.542 20 5 FHBDRN O=[N+]([O-])c1cc(F)c(CSc2nccn2Cc2ccccn2)c(F)c1 ZINC000505518388 942968970 /nfs/dbraw/zinc/96/89/70/942968970.db2.gz CNVGRXPHVWNPCO-UHFFFAOYSA-N 0 0 362.361 3.805 20 5 FHBDRN COc1ccc(C(=O)NCCc2ccc(Cl)cc2Cl)cc1[N+](=O)[O-] ZINC000016636210 942969075 /nfs/dbraw/zinc/96/90/75/942969075.db2.gz DEKDMIJBDFORSP-UHFFFAOYSA-N 0 0 369.204 3.883 20 5 FHBDRN CC(C)(CCC(=O)NCc1ccc(COc2cccc(F)c2)cc1)[N+](=O)[O-] ZINC000843661746 942978248 /nfs/dbraw/zinc/97/82/48/942978248.db2.gz UDZZBGVYENTUCD-UHFFFAOYSA-N 0 0 374.412 3.856 20 5 FHBDRN CS(=O)(=O)c1ccc(SCc2c(F)cc([N+](=O)[O-])cc2F)cc1 ZINC000505528155 942980479 /nfs/dbraw/zinc/98/04/79/942980479.db2.gz ZBYAGYRJXSMBBR-UHFFFAOYSA-N 0 0 359.375 3.569 20 5 FHBDRN COC(=O)[C@@H]1CC[C@@H](c2ccccc2)N1Cc1cccc([N+](=O)[O-])c1C ZINC000434798452 942981166 /nfs/dbraw/zinc/98/11/66/942981166.db2.gz ICDZFBJCLPGFQL-OALUTQOASA-N 0 0 354.406 3.782 20 5 FHBDRN CCc1ccc(C(=O)Nc2cc(C)nc3ccc([N+](=O)[O-])cc32)c(C)n1 ZINC000183683408 942987597 /nfs/dbraw/zinc/98/75/97/942987597.db2.gz HCBGTECNZFMQDH-UHFFFAOYSA-N 0 0 350.378 3.970 20 5 FHBDRN O=C(Nc1ccc(C(=O)N2CCCCCC2)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000014836110 942999016 /nfs/dbraw/zinc/99/90/16/942999016.db2.gz YOFXQTBZILVPPA-UHFFFAOYSA-N 0 0 367.405 3.863 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N1C[C@@H]2CCC(=O)c3cccc1c32 ZINC000183860253 943002730 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CN(C(=O)CCc1ncc(-c2ccccc2)o1)c1ccc([N+](=O)[O-])cc1 ZINC000514489340 943048941 /nfs/dbraw/zinc/04/89/41/943048941.db2.gz RWYMTIMUZCEMJX-UHFFFAOYSA-N 0 0 351.362 3.845 20 5 FHBDRN COc1cc(CN2CCN(c3ccccc3[N+](=O)[O-])CC2)ccc1SC ZINC000505571191 943051255 /nfs/dbraw/zinc/05/12/55/943051255.db2.gz WDXVWHHGSFXFPU-UHFFFAOYSA-N 0 0 373.478 3.648 20 5 FHBDRN Cc1cc(NC(=O)c2ccc([N+](=O)[O-])s2)cnc1N1CCCC[C@H]1C ZINC000503211783 943053143 /nfs/dbraw/zinc/05/31/43/943053143.db2.gz UIOAXFXGNJMVEK-GFCCVEGCSA-N 0 0 360.439 3.991 20 5 FHBDRN Cc1ccccc1-c1nc(C(=O)Nc2ccc([N+](=O)[O-])c(C)n2)cs1 ZINC000133650340 943053270 /nfs/dbraw/zinc/05/32/70/943053270.db2.gz NDBHOPVEXYJXOH-UHFFFAOYSA-N 0 0 354.391 3.982 20 5 FHBDRN CC(C)(NC(=O)NC[C@@H]1CC12CCSCC2)c1ccc([N+](=O)[O-])cc1 ZINC000422229631 943053795 /nfs/dbraw/zinc/05/37/95/943053795.db2.gz QSUBLDFONIUMKP-AWEZNQCLSA-N 0 0 363.483 3.662 20 5 FHBDRN O=C(NC1CCc2ccccc2CC1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412393103 943057230 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3.756 20 5 FHBDRN C[C@H](CCNC(=O)[C@@H]1CC(c2ccccc2[N+](=O)[O-])=NO1)CC(C)(C)C ZINC001269251915 943097970 /nfs/dbraw/zinc/09/79/70/943097970.db2.gz WVTLXZMBNYMNOH-DYVFJYSZSA-N 0 0 361.442 3.666 20 5 FHBDRN C[C@@H](CCNC(=O)[C@H]1CC(c2ccccc2[N+](=O)[O-])=NO1)CC(C)(C)C ZINC001269251917 943098110 /nfs/dbraw/zinc/09/81/10/943098110.db2.gz WVTLXZMBNYMNOH-SUMWQHHRSA-N 0 0 361.442 3.666 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1OC(F)F)N1CCc2c1cccc2F ZINC000183738951 943100232 /nfs/dbraw/zinc/10/02/32/943100232.db2.gz FQZVZLLGYBKAOI-UHFFFAOYSA-N 0 0 352.268 3.538 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)c1cnc(-c2ccco2)s1 ZINC000183744742 943105775 /nfs/dbraw/zinc/10/57/75/943105775.db2.gz VEQVZJCRSCNNHU-UHFFFAOYSA-N 0 0 363.782 3.895 20 5 FHBDRN CCc1c(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)[nH]c(C)c1C(C)=O ZINC000183749783 943111313 /nfs/dbraw/zinc/11/13/13/943111313.db2.gz PGBDCMYHMBGWGN-UHFFFAOYSA-N 0 0 363.801 3.580 20 5 FHBDRN CCOC(=O)c1ccnc(N2CCC[C@H]2/C=C/c2ccccc2)c1[N+](=O)[O-] ZINC000503316555 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CCCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H](OC)C(C)(C)C ZINC000503407623 943167748 /nfs/dbraw/zinc/16/77/48/943167748.db2.gz QTSZMVTXDGXTIV-HNNXBMFYSA-N 0 0 354.472 3.888 20 5 FHBDRN CC(C)c1[nH]nc(C(=O)Nc2cnccc2Oc2ccccc2)c1[N+](=O)[O-] ZINC000434194733 943174479 /nfs/dbraw/zinc/17/44/79/943174479.db2.gz SOTSXJLCAIXBKK-UHFFFAOYSA-N 0 0 367.365 3.881 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1cccc2nccn21 ZINC000503419219 943174818 /nfs/dbraw/zinc/17/48/18/943174818.db2.gz NIQHTENYCLZMFB-UHFFFAOYSA-N 0 0 356.407 3.997 20 5 FHBDRN COc1ccc(N(C(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])[C@@H](C)C2CC2)cc1 ZINC000434176932 943175676 /nfs/dbraw/zinc/17/56/76/943175676.db2.gz JAWTTWONVZYPAJ-LBPRGKRZSA-N 0 0 372.425 3.895 20 5 FHBDRN CC(C)[C@H](CNC(=O)c1cc2cc([N+](=O)[O-])ccc2o1)c1cccnc1 ZINC000434177569 943178264 /nfs/dbraw/zinc/17/82/64/943178264.db2.gz PLJOBYQUMFRDHP-INIZCTEOSA-N 0 0 353.378 3.906 20 5 FHBDRN Cn1cc([C@@H]2OCC[C@H]2Nc2c(Cl)cc(Cl)cc2[N+](=O)[O-])cn1 ZINC000425283100 943184944 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ZINC000511599903 943323509 /nfs/dbraw/zinc/32/35/09/943323509.db2.gz QQWYWHIKFQUMKR-UHFFFAOYSA-N 0 0 371.437 3.686 20 5 FHBDRN CS[C@H](C)CNC(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000435327028 943326756 /nfs/dbraw/zinc/32/67/56/943326756.db2.gz FTZVCTSVQWXJOP-SSDOTTSWSA-N 0 0 362.249 3.539 20 5 FHBDRN Cc1c(NC(=O)N(C)CC2CCC2)cc(Br)cc1[N+](=O)[O-] ZINC000435328942 943333230 /nfs/dbraw/zinc/33/32/30/943333230.db2.gz NOWWTHRAGPMVGE-UHFFFAOYSA-N 0 0 356.220 3.930 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1F)N1CCC[C@@H](Oc2ccccc2)C1 ZINC000417138798 943367200 /nfs/dbraw/zinc/36/72/00/943367200.db2.gz NYYOEFCNDDJREL-OAHLLOKOSA-N 0 0 359.357 3.809 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@H](c2ccccc2F)C1 ZINC000503750202 943367759 /nfs/dbraw/zinc/36/77/59/943367759.db2.gz VERJKSGJCMBYCT-LBPRGKRZSA-N 0 0 359.357 3.764 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)COc1ccc(C(C)(C)C)cc1 ZINC000514903821 943372856 /nfs/dbraw/zinc/37/28/56/943372856.db2.gz NESSJNMYULYCBK-UHFFFAOYSA-N 0 0 356.422 3.930 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)NC[C@]1(O)CCCC1(C)C ZINC000503798863 943374154 /nfs/dbraw/zinc/37/41/54/943374154.db2.gz KPIHZQZVGKPFFF-GOSISDBHSA-N 0 0 366.483 3.766 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@]1(O)CCCC1(C)C ZINC000503798864 943374190 /nfs/dbraw/zinc/37/41/90/943374190.db2.gz KPIHZQZVGKPFFF-SFHVURJKSA-N 0 0 366.483 3.766 20 5 FHBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)N2CCC[C@@H]2/C=C/c2ccccc2)cc1 ZINC000503835631 943379892 /nfs/dbraw/zinc/37/98/92/943379892.db2.gz ZDMQDCCHXNGODD-VEGGFIAOSA-N 0 0 372.446 3.602 20 5 FHBDRN Cc1oc(-c2ccccc2)nc1C(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000053217310 943379941 /nfs/dbraw/zinc/37/99/41/943379941.db2.gz DREMVFXWHBOWIK-UHFFFAOYSA-N 0 0 351.362 3.531 20 5 FHBDRN CCCOc1ccc2c(c1)CCN(C(=O)c1ccc(C)c([N+](=O)[O-])c1)C2 ZINC000435392866 943379922 /nfs/dbraw/zinc/37/99/22/943379922.db2.gz HTRKCOSUDAHPIN-UHFFFAOYSA-N 0 0 354.406 3.891 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCSC2(CCC2)CC1 ZINC000412452310 943398089 /nfs/dbraw/zinc/39/80/89/943398089.db2.gz LQHJQVFJIXVEHQ-CYBMUJFWSA-N 0 0 366.508 3.964 20 5 FHBDRN O=C1[C@H](N2CC[C@@H]2c2ccc(Cl)cc2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000511608985 943413127 /nfs/dbraw/zinc/41/31/27/943413127.db2.gz FEAZSLNULLREAI-QZTJIDSGSA-N 0 0 371.824 3.801 20 5 FHBDRN CCc1ccc(C(=O)Nc2cnn(-c3ccccc3)c2C)cc1[N+](=O)[O-] ZINC000129380987 943420556 /nfs/dbraw/zinc/42/05/56/943420556.db2.gz MOKSLUKXQUXLQG-UHFFFAOYSA-N 0 0 350.378 3.904 20 5 FHBDRN Cc1nc2ccccc2n1CCC(=O)N[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000503945721 943429624 /nfs/dbraw/zinc/42/96/24/943429624.db2.gz MCUCWMHXCPSDTE-CYBMUJFWSA-N 0 0 352.394 3.520 20 5 FHBDRN COCC(=O)Nc1cc([N+](=O)[O-])ccc1Nc1cccc(C(F)(F)F)c1 ZINC000514981793 943431301 /nfs/dbraw/zinc/43/13/01/943431301.db2.gz BNORUKODGHQTRF-UHFFFAOYSA-N 0 0 369.299 3.942 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1OC(=O)[C@H]1CC(=O)N(c2ccccc2Cl)C1 ZINC000760018430 943431572 /nfs/dbraw/zinc/43/15/72/943431572.db2.gz QLWBGBRPXYXQNJ-LBPRGKRZSA-N 0 0 374.780 3.515 20 5 FHBDRN CC[C@@](C)(COc1ncccc1Cl)NC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000435456173 943435503 /nfs/dbraw/zinc/43/55/03/943435503.db2.gz FGJAYHQSHOBNBH-KRWDZBQOSA-N 0 0 363.801 3.621 20 5 FHBDRN CC(C)(C)n1ncnc1CN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000503952957 943436557 /nfs/dbraw/zinc/43/65/57/943436557.db2.gz LTNSOJWCOIUGAF-IBGZPJMESA-N 0 0 365.437 3.821 20 5 FHBDRN CCOC(=O)c1cc(NCc2ccccc2-n2cccn2)ccc1[N+](=O)[O-] ZINC000511612027 943440934 /nfs/dbraw/zinc/44/09/34/943440934.db2.gz LREWLDSKMPWBTF-UHFFFAOYSA-N 0 0 366.377 3.569 20 5 FHBDRN COCc1nc(CNc2cc(Br)ccc2[N+](=O)[O-])cs1 ZINC000290744683 943458202 /nfs/dbraw/zinc/45/82/02/943458202.db2.gz RVWHQVOQTXMPPZ-UHFFFAOYSA-N 0 0 358.217 3.572 20 5 FHBDRN C[C@H](c1ccccc1Cl)N(C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000053235924 943465362 /nfs/dbraw/zinc/46/53/62/943465362.db2.gz BYWBVPMHNQUOBE-CYBMUJFWSA-N 0 0 361.829 3.904 20 5 FHBDRN CCOc1ccc2c(c1)CCN(C(=O)Nc1ccc(C)c([N+](=O)[O-])c1)C2 ZINC000434214668 943466766 /nfs/dbraw/zinc/46/67/66/943466766.db2.gz RJLKGJCKRINMCH-UHFFFAOYSA-N 0 0 355.394 3.892 20 5 FHBDRN CCOC(=O)c1cc(C(=O)N2CC[C@H](C)[C@@H]3CCCC[C@H]32)cc([N+](=O)[O-])c1 ZINC000515058550 943479920 /nfs/dbraw/zinc/47/99/20/943479920.db2.gz QQEXPQFYQULVGF-DOPJRALCSA-N 0 0 374.437 3.812 20 5 FHBDRN CCOC(=O)c1ccnc(N[C@@H]2C[C@H]2c2cccc(OCC)c2)c1[N+](=O)[O-] ZINC000435563831 943486609 /nfs/dbraw/zinc/48/66/09/943486609.db2.gz ATSSAGYHQVCROD-JKSUJKDBSA-N 0 0 371.393 3.533 20 5 FHBDRN Cc1nn(Cc2ccc(C(=O)N3C[C@H](C)C[C@@H](C)C3)cc2)c(C)c1[N+](=O)[O-] ZINC000017167250 943493895 /nfs/dbraw/zinc/49/38/95/943493895.db2.gz WGVUJRGUAOYBSG-ZIAGYGMSSA-N 0 0 370.453 3.575 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1)[C@@H](NCc1nccn1CC(F)(F)F)CCCC2 ZINC000417301683 943495166 /nfs/dbraw/zinc/49/51/66/943495166.db2.gz BUERSPVTBQLDLC-HNNXBMFYSA-N 0 0 368.359 3.911 20 5 FHBDRN CCOc1cc(NC(=O)c2ccc(C)c(C)n2)c([N+](=O)[O-])cc1OCC ZINC000414739568 943495352 /nfs/dbraw/zinc/49/53/52/943495352.db2.gz IWXDQRNFBLYXSD-UHFFFAOYSA-N 0 0 359.382 3.656 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCc1cccc(C(C)=O)c1 ZINC000566459756 943500133 /nfs/dbraw/zinc/50/01/33/943500133.db2.gz CLZSGIDPKHYKSQ-KRWDZBQOSA-N 0 0 354.406 3.683 20 5 FHBDRN O=C1CCc2cc([N+](=O)[O-])c(N[C@H]3C[C@H](c4ccccc4F)C3)cc2N1 ZINC000435597718 943509518 /nfs/dbraw/zinc/50/95/18/943509518.db2.gz NMNWXXCBZGCDQT-JOCQHMNTSA-N 0 0 355.369 3.977 20 5 FHBDRN Nc1c(F)c(N[C@H]2C[C@@H]2c2ccccc2OC(F)F)ccc1[N+](=O)[O-] ZINC000435577683 943510673 /nfs/dbraw/zinc/51/06/73/943510673.db2.gz KHAGQFWCWQXENK-KOLCDFICSA-N 0 0 353.300 3.886 20 5 FHBDRN CCOC(=O)c1ccnc(N[C@H]2C[C@H](c3cccc(F)c3)C2)c1[N+](=O)[O-] ZINC000435605824 943512942 /nfs/dbraw/zinc/51/29/42/943512942.db2.gz JALJOFOLGJNCRK-MQMHXKEQSA-N 0 0 359.357 3.664 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)NCCOc1cccc(C(C)(C)C)c1 ZINC000504160032 943524917 /nfs/dbraw/zinc/52/49/17/943524917.db2.gz AAODTDDYKWQSBU-UHFFFAOYSA-N 0 0 372.421 3.710 20 5 FHBDRN CC[C@H](C)n1c(Sc2c([N+](=O)[O-])ncn2C)nnc1-c1ccccc1 ZINC000504174147 943535843 /nfs/dbraw/zinc/53/58/43/943535843.db2.gz JSHVPYVKLMDCKC-NSHDSACASA-N 0 0 358.427 3.709 20 5 FHBDRN O=[N+]([O-])c1ccccc1/C=C\c1nc(-c2cccc(OCC(F)F)n2)no1 ZINC000584753258 943541405 /nfs/dbraw/zinc/54/14/05/943541405.db2.gz ODQMCCMYZVZVDM-HJWRWDBZSA-N 0 0 374.303 3.854 20 5 FHBDRN CCOCCOc1ccccc1-c1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000504223239 943555129 /nfs/dbraw/zinc/55/51/29/943555129.db2.gz NQMPOWYAGSYZAS-UHFFFAOYSA-N 0 0 355.350 3.727 20 5 FHBDRN CSc1cnn(-c2ccccc2)c1NC(=O)c1ccc([N+](=O)[O-])s1 ZINC000150718101 943556963 /nfs/dbraw/zinc/55/69/63/943556963.db2.gz PTLPRHLIKWNVNL-UHFFFAOYSA-N 0 0 360.420 3.816 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1CN(C)C[C@@H]1OCCc2ccccc21 ZINC000511621934 943563980 /nfs/dbraw/zinc/56/39/80/943563980.db2.gz BOXLNFRSVITPFV-FQEVSTJZSA-N 0 0 356.422 3.739 20 5 FHBDRN C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)[C@@H]1COc2ccc(Cl)cc2C1 ZINC000504278674 943569947 /nfs/dbraw/zinc/56/99/47/943569947.db2.gz DYJMQKJPJKNVKX-RISCZKNCSA-N 0 0 372.808 3.777 20 5 FHBDRN CC(C)Oc1cccc(CC(=O)N2c3ccc([N+](=O)[O-])cc3C[C@H]2C)c1 ZINC000504280111 943570159 /nfs/dbraw/zinc/57/01/59/943570159.db2.gz ONEDVWDYRSYQHS-CQSZACIVSA-N 0 0 354.406 3.902 20 5 FHBDRN C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1cccc(NC(=O)C2CC2)c1 ZINC000504293751 943576629 /nfs/dbraw/zinc/57/66/29/943576629.db2.gz SOTYZCYBIXOPCF-GFCCVEGCSA-N 0 0 365.389 3.535 20 5 FHBDRN C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)CSc1ccc(F)c(F)c1 ZINC000504293143 943576666 /nfs/dbraw/zinc/57/66/66/943576666.db2.gz KMTKXRMQUHWDJY-JTQLQIEISA-N 0 0 364.373 3.943 20 5 FHBDRN C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)CCCOc1ccc(F)cc1 ZINC000504298148 943577710 /nfs/dbraw/zinc/57/77/10/943577710.db2.gz COZDHUPGOJQOAQ-ZDUSSCGKSA-N 0 0 358.369 3.871 20 5 FHBDRN CC(C)(C)[C@H]1CN(S(=O)(=O)c2ccccc2[N+](=O)[O-])c2ccccc21 ZINC000435721407 943579715 /nfs/dbraw/zinc/57/97/15/943579715.db2.gz CJYSRVPUFZYGBN-AWEZNQCLSA-N 0 0 360.435 3.933 20 5 FHBDRN Nc1cccc(-c2noc(-c3ccc4[nH]c5ccccc5c(=O)c4c3)n2)c1 ZINC000780355454 943583631 /nfs/dbraw/zinc/58/36/31/943583631.db2.gz ARDFPBZHNRZZFO-UHFFFAOYSA-N 0 0 354.369 3.981 20 5 FHBDRN COc1ccc(CNc2cc(NC(=O)N(C)C)ccc2C)cc1[N+](=O)[O-] ZINC000435738090 943589234 /nfs/dbraw/zinc/58/92/34/943589234.db2.gz OPBKVZTUUBYVCQ-UHFFFAOYSA-N 0 0 358.398 3.617 20 5 FHBDRN Cc1cc(C(=O)Nc2n[nH]c(-c3ccccc3Cl)n2)ccc1[N+](=O)[O-] ZINC000515243898 943592973 /nfs/dbraw/zinc/59/29/73/943592973.db2.gz LJRIFHFTKQLBAV-UHFFFAOYSA-N 0 0 357.757 3.594 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2noc(CSc3ccc4c(c3)OCCO4)n2)cc1 ZINC000515244440 943594173 /nfs/dbraw/zinc/59/41/73/943594173.db2.gz GJHFLECWOSKCII-UHFFFAOYSA-N 0 0 371.374 3.708 20 5 FHBDRN CC(C)n1ncc2cc(C(=O)N3c4ccc([N+](=O)[O-])cc4C[C@H]3C)cnc21 ZINC000504328834 943596404 /nfs/dbraw/zinc/59/64/04/943596404.db2.gz MAOBOIKRBPFZNU-GFCCVEGCSA-N 0 0 365.393 3.512 20 5 FHBDRN CC(=O)c1cc(N[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)ccc1F ZINC000504417161 943622922 /nfs/dbraw/zinc/62/29/22/943622922.db2.gz YPFTUPKABVBAKW-NSHDSACASA-N 0 0 359.357 3.684 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)NCCc1cccc2[nH]ccc21 ZINC000504444349 943627485 /nfs/dbraw/zinc/62/74/85/943627485.db2.gz UKQTZDNECRMUFJ-UHFFFAOYSA-N 0 0 366.421 3.503 20 5 FHBDRN Cc1c(C(=O)Nc2cc([N+](=O)[O-])ccc2C)nnn1-c1ccccc1Cl ZINC000504445582 943628013 /nfs/dbraw/zinc/62/80/13/943628013.db2.gz KDUDXSYTOYCVRG-UHFFFAOYSA-N 0 0 371.784 3.698 20 5 FHBDRN Cn1c(SCc2c(F)cccc2[N+](=O)[O-])nnc1-c1ccc(F)cc1 ZINC000504503252 943647323 /nfs/dbraw/zinc/64/73/23/943647323.db2.gz QHGGKAAHGXVNPT-UHFFFAOYSA-N 0 0 362.361 3.961 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CCn2nc(C(C)(C)C)cc2C1 ZINC000930863752 943649873 /nfs/dbraw/zinc/64/98/73/943649873.db2.gz QODMZIUZDXZVIZ-UHFFFAOYSA-N 0 0 371.441 3.753 20 5 FHBDRN C[C@@](NC(=O)COc1ccccc1[N+](=O)[O-])(c1ccccc1)C(F)(F)F ZINC000504547079 943669922 /nfs/dbraw/zinc/66/99/22/943669922.db2.gz MHTCCJWCQVRDGM-MRXNPFEDSA-N 0 0 368.311 3.568 20 5 FHBDRN CNc1ccc(C(=O)N(C)Cc2ccc(F)c(Cl)c2)cc1[N+](=O)[O-] ZINC000584817032 943672904 /nfs/dbraw/zinc/67/29/04/943672904.db2.gz WDICPBBZHJMWBK-UHFFFAOYSA-N 0 0 351.765 3.701 20 5 FHBDRN Nc1cccc(C2CCN(C(=O)c3cc(Cl)cc([N+](=O)[O-])c3)CC2)c1 ZINC000424033707 943697175 /nfs/dbraw/zinc/69/71/75/943697175.db2.gz LYENPFLERWIQGF-UHFFFAOYSA-N 0 0 359.813 3.850 20 5 FHBDRN Cc1ccc(NC(=O)[C@](C)(O)CSc2cccc(F)c2)cc1[N+](=O)[O-] ZINC000504594928 943704411 /nfs/dbraw/zinc/70/44/11/943704411.db2.gz ZLIXKYBLIJNDBF-QGZVFWFLSA-N 0 0 364.398 3.524 20 5 FHBDRN CCSCCCNC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000504620123 943709858 /nfs/dbraw/zinc/70/98/58/943709858.db2.gz HRVQGFDSMCFMHN-UHFFFAOYSA-N 0 0 351.350 3.878 20 5 FHBDRN Cc1ccc(C(=O)COc2c(Br)cccc2[N+](=O)[O-])s1 ZINC000133750044 943709872 /nfs/dbraw/zinc/70/98/72/943709872.db2.gz HFLDPATUMKFHPJ-UHFFFAOYSA-N 0 0 356.197 3.989 20 5 FHBDRN CC[C@H](CSc1ccc(C)c(C)c1)NC(=O)c1[nH]nc(C)c1[N+](=O)[O-] ZINC000504655437 943718534 /nfs/dbraw/zinc/71/85/34/943718534.db2.gz RLOBVJCCFUNDNK-CYBMUJFWSA-N 0 0 362.455 3.544 20 5 FHBDRN O=C(CSc1ccccc1[N+](=O)[O-])N1CCOc2ccc(Cl)cc21 ZINC000543123960 943731834 /nfs/dbraw/zinc/73/18/34/943731834.db2.gz IQTOSDMPNVLPEK-UHFFFAOYSA-N 0 0 364.810 3.766 20 5 FHBDRN O=C1CC[C@@H](CSCc2ccc(Br)cc2[N+](=O)[O-])CCN1 ZINC000424119748 943742405 /nfs/dbraw/zinc/74/24/05/943742405.db2.gz GBIXJFXEPQDDEI-SNVBAGLBSA-N 0 0 373.272 3.507 20 5 FHBDRN CCOc1ccccc1[C@@H](CC)NC(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000053318288 943751839 /nfs/dbraw/zinc/75/18/39/943751839.db2.gz RTDDABXVDJKXNS-QGZVFWFLSA-N 0 0 358.394 3.640 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)N[C@@H]1CCCOc2ccccc21 ZINC000504691631 943757827 /nfs/dbraw/zinc/75/78/27/943757827.db2.gz WBQQRQSGQBSCPM-MRXNPFEDSA-N 0 0 358.419 3.717 20 5 FHBDRN CC[C@@H](C)[C@H](C)N(C(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-])C1CC1 ZINC000105380757 943761191 /nfs/dbraw/zinc/76/11/91/943761191.db2.gz FAOHLGSWVCIBRZ-NEPJUHHUSA-N 0 0 350.415 3.651 20 5 FHBDRN Cc1cccc(N2CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4o3)CC2)c1 ZINC000515286448 943762208 /nfs/dbraw/zinc/76/22/08/943762208.db2.gz BMYWEXYRKBKXDW-UHFFFAOYSA-N 0 0 365.389 3.612 20 5 FHBDRN CCOc1ccc(C(=O)NC[C@@H]2C[C@H]2c2cccc(OC)c2)cc1[N+](=O)[O-] ZINC000414006375 943771600 /nfs/dbraw/zinc/77/16/00/943771600.db2.gz DYDIBCLMFRDLRG-RDJZCZTQSA-N 0 0 370.405 3.536 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000435818221 943773027 /nfs/dbraw/zinc/77/30/27/943773027.db2.gz LVUQUKCGYPFUPR-UHFFFAOYSA-N 0 0 359.341 3.842 20 5 FHBDRN CCCCO[C@H]1C[C@@H](N(C)C(=O)c2cccc(OC)c2[N+](=O)[O-])C1(C)C ZINC000435818148 943774403 /nfs/dbraw/zinc/77/44/03/943774403.db2.gz LKVALOABUCQFTG-CVEARBPZSA-N 0 0 364.442 3.659 20 5 FHBDRN CCSc1cc(CNC(=O)C2(c3ccc([N+](=O)[O-])cc3)CCC2)ccn1 ZINC001270013766 943779617 /nfs/dbraw/zinc/77/96/17/943779617.db2.gz TYMAMKWBKMZOEY-UHFFFAOYSA-N 0 0 371.462 3.840 20 5 FHBDRN CCO[C@H]1C[C@@H](N(C)C(=O)c2cccc(OC)c2[N+](=O)[O-])C1(CC)CC ZINC000435807296 943783986 /nfs/dbraw/zinc/78/39/86/943783986.db2.gz IQVLWFTZHPETKO-CVEARBPZSA-N 0 0 364.442 3.659 20 5 FHBDRN C[C@@H]1COCC[C@@H]1C(=O)N(Cc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000435809328 943785319 /nfs/dbraw/zinc/78/53/19/943785319.db2.gz PGUPZORAMQYSLW-BEFAXECRSA-N 0 0 354.406 3.801 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1C(F)(F)F)N1CC[C@H](c2ccncc2)C1 ZINC000516877270 943787525 /nfs/dbraw/zinc/78/75/25/943787525.db2.gz SKTSBRXFMHQIDD-LBPRGKRZSA-N 0 0 365.311 3.638 20 5 FHBDRN COc1ccc(CNC(=O)CNc2ccc(C(C)(C)C)c([N+](=O)[O-])c2)cc1 ZINC000516881463 943791840 /nfs/dbraw/zinc/79/18/40/943791840.db2.gz CPYAXLNMAGFLKF-UHFFFAOYSA-N 0 0 371.437 3.629 20 5 FHBDRN O=C(NCc1ccc(F)cc1)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000435827139 943798025 /nfs/dbraw/zinc/79/80/25/943798025.db2.gz OKRVAFCJUKSUAB-UHFFFAOYSA-N 0 0 364.351 3.890 20 5 FHBDRN CC[C@@H](CC[NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1)C(=O)[O-] ZINC000417651472 943798678 /nfs/dbraw/zinc/79/86/78/943798678.db2.gz PNAVNRJEDGTERD-INIZCTEOSA-N 0 0 371.437 3.953 20 5 FHBDRN COc1ccc2c(c1)N(C(=O)c1cccc(OC)c1[N+](=O)[O-])CCCC2 ZINC000435828181 943798973 /nfs/dbraw/zinc/79/89/73/943798973.db2.gz SHPMKTWRWZZADL-UHFFFAOYSA-N 0 0 356.378 3.595 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N(CC1CCC1)[C@H](C)CO ZINC000435857739 943812080 /nfs/dbraw/zinc/81/20/80/943812080.db2.gz XMTOQWIOLJBQRO-CYBMUJFWSA-N 0 0 366.483 3.718 20 5 FHBDRN O=C(CCc1cccc(Cl)c1)N1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000515361007 943825470 /nfs/dbraw/zinc/82/54/70/943825470.db2.gz RSFNMZGPUZQBEA-UHFFFAOYSA-N 0 0 360.797 3.602 20 5 FHBDRN O=C(c1ccc(F)c2cccnc12)N1CCCc2ccc([N+](=O)[O-])cc21 ZINC001125911655 943826630 /nfs/dbraw/zinc/82/66/30/943826630.db2.gz ZLDCVGPADFYJGZ-UHFFFAOYSA-N 0 0 351.337 3.875 20 5 FHBDRN COc1cccc(C(=O)N[C@H]2C[C@@H]2c2c(F)cccc2Cl)c1[N+](=O)[O-] ZINC000435878313 943830023 /nfs/dbraw/zinc/83/00/23/943830023.db2.gz ZBLOCZAKCDCZAN-GWCFXTLKSA-N 0 0 364.760 3.682 20 5 FHBDRN C[C@@H](NC(=O)COc1ccc(F)c(Cl)c1)c1cccc([N+](=O)[O-])c1 ZINC000053339037 943833507 /nfs/dbraw/zinc/83/35/07/943833507.db2.gz UESORGPRVQZUQL-SNVBAGLBSA-N 0 0 352.749 3.644 20 5 FHBDRN Cc1cc(NCCCN2CCCCC2=O)c([N+](=O)[O-])cc1C(F)(F)F ZINC000515389382 943834051 /nfs/dbraw/zinc/83/40/51/943834051.db2.gz DBRWAVZMZNHZOJ-UHFFFAOYSA-N 0 0 359.348 3.737 20 5 FHBDRN COc1cc(CN2CC[C@@](F)(c3cc(F)cc(F)c3)C2)ccc1[N+](=O)[O-] ZINC000584484862 943851141 /nfs/dbraw/zinc/85/11/41/943851141.db2.gz AUWIAORRDOJQLL-SFHVURJKSA-N 0 0 366.339 3.952 20 5 FHBDRN O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@@H]1Nc1ccc(COCCO)cc1 ZINC000424311480 943855089 /nfs/dbraw/zinc/85/50/89/943855089.db2.gz FJSVWVFPAJOXFO-XLIONFOSSA-N 0 0 370.449 3.927 20 5 FHBDRN COC(=O)CCSCc1cccc(NC(=O)c2cccc([N+](=O)[O-])c2)c1 ZINC000504870138 943859888 /nfs/dbraw/zinc/85/98/88/943859888.db2.gz LSIWHHJPBXGPTB-UHFFFAOYSA-N 0 0 374.418 3.643 20 5 FHBDRN Cc1ccc(OCCCNC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)cc1 ZINC000504900720 943877456 /nfs/dbraw/zinc/87/74/56/943877456.db2.gz BJAIEMMGFCBJCV-UHFFFAOYSA-N 0 0 354.362 3.848 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1CN(CC(F)(F)F)C1CC1 ZINC000425424364 943887407 /nfs/dbraw/zinc/88/74/07/943887407.db2.gz RXQXJQHTCMMJMM-UHFFFAOYSA-N 0 0 353.138 3.884 20 5 FHBDRN O=[N+]([O-])c1cc(-c2nc(COc3cccc(F)c3)no2)ccc1NC1CC1 ZINC000435971231 943893666 /nfs/dbraw/zinc/89/36/66/943893666.db2.gz LAIJGSMFKJEAOJ-UHFFFAOYSA-N 0 0 370.340 3.937 20 5 FHBDRN O=C(N[C@H]1CCCOc2ccc(F)cc21)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000053369811 943895345 /nfs/dbraw/zinc/89/53/45/943895345.db2.gz DRVPNQRXNUOXEJ-AWEZNQCLSA-N 0 0 369.352 3.859 20 5 FHBDRN O=C(c1n[nH]c2ccc([N+](=O)[O-])cc21)N1CCCC[C@H]1c1ccccc1 ZINC000504913660 943909571 /nfs/dbraw/zinc/90/95/71/943909571.db2.gz GIADIPBOPRVSEN-KRWDZBQOSA-N 0 0 350.378 3.839 20 5 FHBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)[C@H]1CCCOC1 ZINC000504913268 943909575 /nfs/dbraw/zinc/90/95/75/943909575.db2.gz DOXWDTNYASYXLV-KGLIPLIRSA-N 0 0 366.483 3.888 20 5 FHBDRN COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N2CC[C@H](C)C2)cc1 ZINC000504936943 943917231 /nfs/dbraw/zinc/91/72/31/943917231.db2.gz OSVDLVRXVASRRD-ZDUSSCGKSA-N 0 0 356.378 3.878 20 5 FHBDRN Cc1cn(C2CCCCC2)nc1NC(=O)COc1cccc([N+](=O)[O-])c1 ZINC000541496060 943917988 /nfs/dbraw/zinc/91/79/88/943917988.db2.gz FAGLQPUPHKITMT-UHFFFAOYSA-N 0 0 358.398 3.622 20 5 FHBDRN O=C(N[C@@H]1C[C@H]1c1ccccc1)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000511639894 943918029 /nfs/dbraw/zinc/91/80/29/943918029.db2.gz KAYFIZUCXUYJPY-SWLSCSKDSA-N 0 0 350.296 3.900 20 5 FHBDRN O=[N+]([O-])c1ccc(COc2ccc(Br)cc2CCO)c(F)c1 ZINC000504942594 943919691 /nfs/dbraw/zinc/91/96/91/943919691.db2.gz MCZNBZDULYCKLE-UHFFFAOYSA-N 0 0 370.174 3.610 20 5 FHBDRN O=C(c1c([N+](=O)[O-])cccc1C(F)(F)F)N1CCCc2occc2C1 ZINC000584495662 943921973 /nfs/dbraw/zinc/92/19/73/943921973.db2.gz QZFVBEXXHDPWOZ-UHFFFAOYSA-N 0 0 354.284 3.795 20 5 FHBDRN CCc1ccc(C(=O)N2CCCC[C@H]2c2nccn2CC)cc1[N+](=O)[O-] ZINC000436006434 943939023 /nfs/dbraw/zinc/93/90/23/943939023.db2.gz YUCGTZDWJLGZTJ-INIZCTEOSA-N 0 0 356.426 3.741 20 5 FHBDRN O=C(/C=C/c1ccc([N+](=O)[O-])cc1)N1CCN(C2CC2)c2cc(F)ccc21 ZINC001269653544 943950383 /nfs/dbraw/zinc/95/03/83/943950383.db2.gz DVBWPXVFMMHECF-XCVCLJGOSA-N 0 0 367.380 3.763 20 5 FHBDRN COc1ccc(/C=C\c2nc(-c3cccc([N+](=O)[O-])c3)no2)c(OC)c1 ZINC000504990440 943960716 /nfs/dbraw/zinc/96/07/16/943960716.db2.gz FXIOMXSLTDNMKK-CLFYSBASSA-N 0 0 353.334 3.832 20 5 FHBDRN Cc1ccc(NC(=O)c2cc([N+](=O)[O-])cc(Br)c2C)c(O)c1 ZINC000515532815 943967810 /nfs/dbraw/zinc/96/78/10/943967810.db2.gz FLISGESNHFVYQZ-UHFFFAOYSA-N 0 0 365.183 3.932 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2cnn(Cc3ccn(-c4ccccc4F)n3)c2)cc1 ZINC000437614092 943971118 /nfs/dbraw/zinc/97/11/18/943971118.db2.gz DDIZZEQLWAXWRS-UHFFFAOYSA-N 0 0 363.352 3.831 20 5 FHBDRN COCC[C@H](NC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)c1ccco1 ZINC000505018226 943972287 /nfs/dbraw/zinc/97/22/87/943972287.db2.gz HETUWRLOCMKVPW-ZDUSSCGKSA-N 0 0 372.299 3.714 20 5 FHBDRN CC(C)n1ncc2cc(-c3nc(-c4cccc([N+](=O)[O-])c4)no3)cnc21 ZINC000505018278 943972370 /nfs/dbraw/zinc/97/23/70/943972370.db2.gz ICJUCXIFJDYYEU-UHFFFAOYSA-N 0 0 350.338 3.637 20 5 FHBDRN CC(C)[C@H](C)N(C)C(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000517083363 943978143 /nfs/dbraw/zinc/97/81/43/943978143.db2.gz QMMDFAGLXRZDOL-NSHDSACASA-N 0 0 361.364 3.919 20 5 FHBDRN CCc1ccc(-c2noc(COc3ccc([N+](=O)[O-])c(OC)c3)n2)cc1 ZINC000505043653 943979286 /nfs/dbraw/zinc/97/92/86/943979286.db2.gz FWGPMDOTLBMRSJ-UHFFFAOYSA-N 0 0 355.350 3.795 20 5 FHBDRN Cc1cc(-c2nc(-c3cccc([N+](=O)[O-])c3)no2)c2cnn(C(C)C)c2n1 ZINC000505035536 943992328 /nfs/dbraw/zinc/99/23/28/943992328.db2.gz LFPVAFINPBOLHI-UHFFFAOYSA-N 0 0 364.365 3.946 20 5 FHBDRN CCOc1ccc(C(=O)N[C@@H]2CCCc3c(O)cccc32)cc1[N+](=O)[O-] ZINC000190247778 943996864 /nfs/dbraw/zinc/99/68/64/943996864.db2.gz XDBOGSXKNGZRBX-OAHLLOKOSA-N 0 0 356.378 3.507 20 5 FHBDRN C[C@H](CNC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N1CCc2ccccc21 ZINC000505058285 944002256 /nfs/dbraw/zinc/00/22/56/944002256.db2.gz RZFNYJNPZKYJHY-GFCCVEGCSA-N 0 0 374.828 3.821 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1CN1CCCC[C@H]1c1cc[nH]n1 ZINC000425460308 944006574 /nfs/dbraw/zinc/00/65/74/944006574.db2.gz RGGHJZCRRZLUNV-AWEZNQCLSA-N 0 0 365.231 3.808 20 5 FHBDRN Cc1cccc(CN(C)C(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)n1 ZINC000437656078 944012756 /nfs/dbraw/zinc/01/27/56/944012756.db2.gz NGXFLQBMBDMWJC-UHFFFAOYSA-N 0 0 353.300 3.589 20 5 FHBDRN COc1ccc2[nH]cc(Cc3nc(-c4ccc([N+](=O)[O-])cc4)no3)c2c1 ZINC000505083416 944024780 /nfs/dbraw/zinc/02/47/80/944024780.db2.gz HGGRSTNOTRVLTC-UHFFFAOYSA-N 0 0 350.334 3.726 20 5 FHBDRN COc1ccc(CC(=O)N[C@H](CC(F)F)c2ccccc2)cc1[N+](=O)[O-] ZINC000517120517 944025460 /nfs/dbraw/zinc/02/54/60/944025460.db2.gz BBUXBFPBEMMVEB-CQSZACIVSA-N 0 0 364.348 3.659 20 5 FHBDRN CC(C)[C@@H]1CCC[C@@H](NC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000505067439 944026308 /nfs/dbraw/zinc/02/63/08/944026308.db2.gz CAYKAVIBSQVEFD-HUUCEWRRSA-N 0 0 356.426 3.725 20 5 FHBDRN O=C(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)Nc1ccc(F)c(Cl)c1 ZINC000436094695 944026557 /nfs/dbraw/zinc/02/65/57/944026557.db2.gz VNRNJPUNSOGOBL-UHFFFAOYSA-N 0 0 363.736 3.585 20 5 FHBDRN Cc1cc([N+](=O)[O-])cnc1Sc1nnc(NCc2ccccc2)s1 ZINC000092583199 944030591 /nfs/dbraw/zinc/03/05/91/944030591.db2.gz AKHTZERGJAYLJL-UHFFFAOYSA-N 0 0 359.436 3.913 20 5 FHBDRN CCOc1cc(N(C)[C@@H](C)c2ccc(-n3cncn3)cc2)ccc1[N+](=O)[O-] ZINC000092583523 944030678 /nfs/dbraw/zinc/03/06/78/944030678.db2.gz ORRSHCYNDILXPF-AWEZNQCLSA-N 0 0 367.409 3.772 20 5 FHBDRN O=C(NCCNc1ccc([N+](=O)[O-])cc1)N[C@H](c1cccs1)C1CC1 ZINC000505091396 944033099 /nfs/dbraw/zinc/03/30/99/944033099.db2.gz VZKXDXWCMBLTSK-INIZCTEOSA-N 0 0 360.439 3.519 20 5 FHBDRN CC(C)(C(=O)Nc1cc2c(cc1F)CCC(=O)N2)c1ccccc1[N+](=O)[O-] ZINC000431966710 944033288 /nfs/dbraw/zinc/03/32/88/944033288.db2.gz WRTGESLUNOADRX-UHFFFAOYSA-N 0 0 371.368 3.535 20 5 FHBDRN CCNc1ccc(C(=O)NCC(C)(C)c2ccccc2F)cc1[N+](=O)[O-] ZINC000505098285 944038009 /nfs/dbraw/zinc/03/80/09/944038009.db2.gz KOWNASKEBOQESF-UHFFFAOYSA-N 0 0 359.401 3.873 20 5 FHBDRN Cc1c(Br)cc(C(=O)NC(C)(C)COC(C)C)cc1[N+](=O)[O-] ZINC000414002157 944043628 /nfs/dbraw/zinc/04/36/28/944043628.db2.gz SVITVAVCHIKQMA-UHFFFAOYSA-N 0 0 373.247 3.599 20 5 FHBDRN CO[C@@]1(C)C[C@H](N(C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1(C)C ZINC000436138404 944049151 /nfs/dbraw/zinc/04/91/51/944049151.db2.gz BUDMQLLRMVMOLW-BBRMVZONSA-N 0 0 355.822 3.916 20 5 FHBDRN C[C@H](NC(=O)N(C)Cc1ccccc1[N+](=O)[O-])[C@H]1Oc2ccccc2[C@@H]1C ZINC000437720548 944052815 /nfs/dbraw/zinc/05/28/15/944052815.db2.gz BXLDANNSSIJBDS-NJSLBKSFSA-N 0 0 369.421 3.689 20 5 FHBDRN CC(C)c1nnc(NC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)s1 ZINC000436154454 944058433 /nfs/dbraw/zinc/05/84/33/944058433.db2.gz LMFQRUKUIAZHSH-UHFFFAOYSA-N 0 0 364.430 3.909 20 5 FHBDRN CN(c1ccccc1)c1ccc(C(=O)NCc2ccc([N+](=O)[O-])cc2)cn1 ZINC000515626065 944058454 /nfs/dbraw/zinc/05/84/54/944058454.db2.gz NSJWUQKBRRBBHP-UHFFFAOYSA-N 0 0 362.389 3.688 20 5 FHBDRN CCC[C@H](NC(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-])c1ccccc1 ZINC000024595927 944061867 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C[C@@H]1CC[C@@H](C)N(S(=O)(=O)c2c(Cl)cc(Cl)cc2[N+](=O)[O-])C1 ZINC000436188478 944081947 /nfs/dbraw/zinc/08/19/47/944081947.db2.gz UPOOMSOKLPYBME-RKDXNWHRSA-N 0 0 367.254 3.711 20 5 FHBDRN CS(=O)(=O)c1ccc(Sc2ccc([N+](=O)[O-])c3cccnc23)cc1 ZINC000092634609 944084574 /nfs/dbraw/zinc/08/45/74/944084574.db2.gz KNLXSQCVHYLMDG-UHFFFAOYSA-N 0 0 360.416 3.698 20 5 FHBDRN CCC(CC)[C@H](CCNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1)OC ZINC000437759873 944090314 /nfs/dbraw/zinc/09/03/14/944090314.db2.gz PSTSWTWCSUAJKF-KRWDZBQOSA-N 0 0 350.459 3.830 20 5 FHBDRN Cc1cc(Cc2noc(CCc3cccc(N(C)C)c3)n2)ccc1[N+](=O)[O-] ZINC000517202303 944100582 /nfs/dbraw/zinc/10/05/82/944100582.db2.gz VIYIIQIDXGMRCH-UHFFFAOYSA-N 0 0 366.421 3.728 20 5 FHBDRN Cn1c(CCNc2ccc([N+](=O)[O-])c3cccnc23)nc2ccc(F)cc21 ZINC000092656004 944106021 /nfs/dbraw/zinc/10/60/21/944106021.db2.gz HBSVBBFGKGYPIO-UHFFFAOYSA-N 0 0 365.368 3.823 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc2oc(CO)cc2c1 ZINC000515684289 944111994 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FHBDRN CCOc1ccc([N+](=O)[O-])cc1CN1CCC(OC)(C(F)(F)F)CC1 ZINC000418088220 944141153 /nfs/dbraw/zinc/14/11/53/944141153.db2.gz GETPXMOEZOZLLM-UHFFFAOYSA-N 0 0 362.348 3.537 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H](c1cnn(C)c1)C(C)(C)C ZINC000515716698 944147127 /nfs/dbraw/zinc/14/71/27/944147127.db2.gz OMXFBGDJSMYNAK-INIZCTEOSA-N 0 0 359.430 3.800 20 5 FHBDRN COCCN(C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)[C@@H](C)c1ccccc1 ZINC000500136009 944153069 /nfs/dbraw/zinc/15/30/69/944153069.db2.gz LJIKJSRWTCJHJX-AWEZNQCLSA-N 0 0 367.405 3.926 20 5 FHBDRN COc1ccc(CNC(=O)[C@H](C)c2ccc(Cl)s2)cc1[N+](=O)[O-] ZINC000425916914 944154998 /nfs/dbraw/zinc/15/49/98/944154998.db2.gz LBAOMZSVVLBUNU-SECBINFHSA-N 0 0 354.815 3.738 20 5 FHBDRN Cc1ccc(C[C@H]2CCCN2S(=O)(=O)c2c(C)cccc2[N+](=O)[O-])cc1 ZINC000500138575 944159429 /nfs/dbraw/zinc/15/94/29/944159429.db2.gz BXXCMHKQTKJRFE-QGZVFWFLSA-N 0 0 374.462 3.607 20 5 FHBDRN CCC[C@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1F)c1ccccc1 ZINC000515730498 944166701 /nfs/dbraw/zinc/16/67/01/944166701.db2.gz HADXOZIZQVFNCC-HNNXBMFYSA-N 0 0 352.387 3.554 20 5 FHBDRN CCN(Cc1ccc2c(c1)OCO2)c1cc(C(F)(F)F)ncc1[N+](=O)[O-] ZINC000436275687 944172649 /nfs/dbraw/zinc/17/26/49/944172649.db2.gz PRWQYTXSVYIVQG-UHFFFAOYSA-N 0 0 369.299 3.764 20 5 FHBDRN O=C(NC[C@@H]1CC=CCC1)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000436304929 944188810 /nfs/dbraw/zinc/18/88/10/944188810.db2.gz FKGZVXPEVDMBLW-CYBMUJFWSA-N 0 0 350.393 3.907 20 5 FHBDRN CCCN(C(=O)c1cc2cc([N+](=O)[O-])ccc2s1)[C@@H](C)C(=O)OCC ZINC000436338108 944215454 /nfs/dbraw/zinc/21/54/54/944215454.db2.gz FXPISSFJUVMUNR-NSHDSACASA-N 0 0 364.423 3.613 20 5 FHBDRN Cc1ccc(NC(=O)c2ccc(N3CCC(=O)[C@@H](C)C3)c([N+](=O)[O-])c2)cc1 ZINC000436342081 944219025 /nfs/dbraw/zinc/21/90/25/944219025.db2.gz WNQLDMZEAZWKOY-AWEZNQCLSA-N 0 0 367.405 3.571 20 5 FHBDRN Cc1cc(NC(=O)c2ccc(C)c(C)c2)n(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000105583439 944226878 /nfs/dbraw/zinc/22/68/78/944226878.db2.gz IGEOPOUBJVXWIC-UHFFFAOYSA-N 0 0 350.378 3.958 20 5 FHBDRN C[C@]1(Cc2ccccc2)CCCN1C(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000469304854 944229372 /nfs/dbraw/zinc/22/93/72/944229372.db2.gz UEDMUWCTLKRSON-HXUWFJFHSA-N 0 0 354.406 3.597 20 5 FHBDRN COCCN(C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CCC[C@@H]1C ZINC000518287163 944236982 /nfs/dbraw/zinc/23/69/82/944236982.db2.gz VGVJOJFUDXXTID-XHDPSFHLSA-N 0 0 355.822 3.917 20 5 FHBDRN CCCN(C[C@@H]1CCCCO1)C(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000517351935 944237240 /nfs/dbraw/zinc/23/72/40/944237240.db2.gz ZLJSLLCPIOYBNY-HOCLYGCPSA-N 0 0 366.483 3.883 20 5 FHBDRN O=C(Nc1cccc(OC[C@@H]2CCCO2)c1)c1cc(F)cc([N+](=O)[O-])c1 ZINC000518286498 944238080 /nfs/dbraw/zinc/23/80/80/944238080.db2.gz BTHMCMJZVACIED-KRWDZBQOSA-N 0 0 360.341 3.544 20 5 FHBDRN C[C@@H](C(=O)NC[C@H](c1ccccc1)C(C)(C)CO)c1cccc([N+](=O)[O-])c1 ZINC000566598344 944241198 /nfs/dbraw/zinc/24/11/98/944241198.db2.gz XEOYBNKJUTZNEZ-DNVCBOLYSA-N 0 0 370.449 3.617 20 5 FHBDRN C[C@@H](OC(=O)C1CCCCC1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000010626726 944244493 /nfs/dbraw/zinc/24/44/93/944244493.db2.gz MWCKKRQRRVEDOK-SNVBAGLBSA-N 0 0 354.790 3.699 20 5 FHBDRN Cc1nc(NC(=O)CCNc2ccccc2[N+](=O)[O-])sc1C(F)(F)F ZINC000518298659 944244551 /nfs/dbraw/zinc/24/45/51/944244551.db2.gz VMVBXHFQVMSZIX-UHFFFAOYSA-N 0 0 374.344 3.819 20 5 FHBDRN C[C@@](CO)(CNc1cc(C(F)(F)F)ncc1[N+](=O)[O-])Cc1ccccc1 ZINC000436380666 944249285 /nfs/dbraw/zinc/24/92/85/944249285.db2.gz ZPCIPMUFZDAWNA-INIZCTEOSA-N 0 0 369.343 3.662 20 5 FHBDRN CCCc1n[nH]c(C(=O)NCC2(c3ccccc3)CCCC2)c1[N+](=O)[O-] ZINC000518312992 944258539 /nfs/dbraw/zinc/25/85/39/944258539.db2.gz AQPLMLQQQBKPQW-UHFFFAOYSA-N 0 0 356.426 3.512 20 5 FHBDRN C[S@](=O)Cc1cccc(Nc2cc(C(F)(F)F)ncc2[N+](=O)[O-])c1 ZINC000436389788 944258641 /nfs/dbraw/zinc/25/86/41/944258641.db2.gz OGUCPKCLTUYMOX-DEOSSOPVSA-N 0 0 359.329 3.631 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)F)cc1N[C@@H]1CCN(c2ccccc2)C1 ZINC000436390337 944259546 /nfs/dbraw/zinc/25/95/46/944259546.db2.gz PSTNLCQJXOIONJ-LLVKDONJSA-N 0 0 352.316 3.699 20 5 FHBDRN COc1ccc(NC(=O)N[C@H]2C[C@H](c3ccccc3F)C2)cc1[N+](=O)[O-] ZINC000436392787 944261694 /nfs/dbraw/zinc/26/16/94/944261694.db2.gz RDJDWGWXQOVOAE-AULYBMBSSA-N 0 0 359.357 3.810 20 5 FHBDRN COc1ccc(CN(C)c2cc(C(F)(F)F)ncc2[N+](=O)[O-])cc1C ZINC000436393465 944263690 /nfs/dbraw/zinc/26/36/90/944263690.db2.gz SDTOTCTUJZPUHD-UHFFFAOYSA-N 0 0 355.316 3.962 20 5 FHBDRN CC[C@H]1CCc2nc(NC(=O)c3ccc(NC)c([N+](=O)[O-])c3)sc2C1 ZINC000515828964 944265400 /nfs/dbraw/zinc/26/54/00/944265400.db2.gz JERKXGQEPMPFIL-JTQLQIEISA-N 0 0 360.439 3.860 20 5 FHBDRN C[C@@H](O)C[C@H](CNc1cc(C(F)(F)F)ncc1[N+](=O)[O-])c1ccccc1 ZINC000436394020 944269818 /nfs/dbraw/zinc/26/98/18/944269818.db2.gz VEHHOOOIFUZGIZ-DGCLKSJQSA-N 0 0 369.343 3.975 20 5 FHBDRN Cc1cc([C@@H](C)NC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)c(C)s1 ZINC000025015391 944272326 /nfs/dbraw/zinc/27/23/26/944272326.db2.gz UBIORIOGHLRCJX-GFCCVEGCSA-N 0 0 370.434 3.950 20 5 FHBDRN CCc1nc(CCNc2cc(C(F)(F)F)ncc2[N+](=O)[O-])sc1C ZINC000436396092 944272734 /nfs/dbraw/zinc/27/27/34/944272734.db2.gz IFRXBLBZJUELCK-UHFFFAOYSA-N 0 0 360.361 3.991 20 5 FHBDRN CSCc1cccc(NS(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000518311647 944273319 /nfs/dbraw/zinc/27/33/19/944273319.db2.gz YGDOFGYJFAVETB-UHFFFAOYSA-N 0 0 352.437 3.567 20 5 FHBDRN C[C@@H]1CCCN(C(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CC1 ZINC000426261696 944273709 /nfs/dbraw/zinc/27/37/09/944273709.db2.gz SMIGINPHAMEXAZ-LLVKDONJSA-N 0 0 359.348 3.945 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)F)cc1NC[C@@H]1CCOc2ccccc21 ZINC000436402792 944278785 /nfs/dbraw/zinc/27/87/85/944278785.db2.gz BBFFOKKZLGJGGL-JTQLQIEISA-N 0 0 353.300 3.987 20 5 FHBDRN C/C=C\C[C@@H](CO)NC(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000473710414 944279100 /nfs/dbraw/zinc/27/91/00/944279100.db2.gz OSFUVFGULINXQK-GWQWAINWSA-N 0 0 371.393 3.836 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)F)cc1NCC[C@@H]1COc2ccccc2O1 ZINC000436402548 944279373 /nfs/dbraw/zinc/27/93/73/944279373.db2.gz YAGZCVLZPZFZJD-SNVBAGLBSA-N 0 0 369.299 3.651 20 5 FHBDRN O=C([O-])c1cc(F)ccc1C[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000515869612 944285407 /nfs/dbraw/zinc/28/54/07/944285407.db2.gz CXSMAEYWSWONMC-CQSZACIVSA-N 0 0 358.369 3.812 20 5 FHBDRN C[C@]1(O)CCCC[C@@H]1[C@@H]1CCCN1C(=O)Nc1cc(F)cc([N+](=O)[O-])c1 ZINC000500224422 944291056 /nfs/dbraw/zinc/29/10/56/944291056.db2.gz RIEGOIGJVVBVFC-RYRKJORJSA-N 0 0 365.405 3.671 20 5 FHBDRN N#CN(Cc1cc([N+](=O)[O-])ccc1Br)c1ccc(F)cc1 ZINC001307342037 944291855 /nfs/dbraw/zinc/29/18/55/944291855.db2.gz PROWDGZDUXAXFY-UHFFFAOYSA-N 0 0 350.147 3.984 20 5 FHBDRN NC(=O)c1ccc(CSCCOc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000105621870 944294619 /nfs/dbraw/zinc/29/46/19/944294619.db2.gz KTELOMRSUWPIHT-UHFFFAOYSA-N 0 0 366.826 3.659 20 5 FHBDRN Nc1nc(CSCCCOc2ccc([N+](=O)[O-])cc2)nc2ccccc12 ZINC000105624586 944294756 /nfs/dbraw/zinc/29/47/56/944294756.db2.gz YFQVAROEHCAIAY-UHFFFAOYSA-N 0 0 370.434 3.823 20 5 FHBDRN C[C@]1(CNC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)CCCS1 ZINC000467344667 944296284 /nfs/dbraw/zinc/29/62/84/944296284.db2.gz CNDBRJJKPJHSHF-MRXNPFEDSA-N 0 0 363.464 3.734 20 5 FHBDRN C[C@@H](c1ccccc1[N+](=O)[O-])N(C)[C@H]1CCN(c2ccccc2F)C1=O ZINC000436423831 944296845 /nfs/dbraw/zinc/29/68/45/944296845.db2.gz AWKXFHNJLKFFNQ-UGSOOPFHSA-N 0 0 357.385 3.532 20 5 FHBDRN Cc1cc(NC[C@H](CO)Cc2cc(F)c(F)c(F)c2)ccc1[N+](=O)[O-] ZINC000436426111 944310994 /nfs/dbraw/zinc/31/09/94/944310994.db2.gz VRSDAVNMILWTEG-GFCCVEGCSA-N 0 0 354.328 3.584 20 5 FHBDRN Cc1cccc(C)c1-n1nnnc1CSCc1ccccc1[N+](=O)[O-] ZINC000105633881 944319358 /nfs/dbraw/zinc/31/93/58/944319358.db2.gz NMZDQRJWNCKEAB-UHFFFAOYSA-N 0 0 355.423 3.621 20 5 FHBDRN O=C(NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N1Cc2ccccc2C1 ZINC000426278306 944322604 /nfs/dbraw/zinc/32/26/04/944322604.db2.gz PMXIWUXHSVZWOI-UHFFFAOYSA-N 0 0 365.311 3.839 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC(c2cn[nH]c2)CC1 ZINC000506485327 944324462 /nfs/dbraw/zinc/32/44/62/944324462.db2.gz HNFVFBPPYYYMTN-UHFFFAOYSA-N 0 0 374.466 3.840 20 5 FHBDRN COc1cccc(Cl)c1CNC(=O)C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000506174513 944325202 /nfs/dbraw/zinc/32/52/02/944325202.db2.gz LYWDWAUUARCGRF-UHFFFAOYSA-N 0 0 362.813 3.851 20 5 FHBDRN C[C@H](CC[NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1)CC(=O)[O-] ZINC000426666049 944332640 /nfs/dbraw/zinc/33/26/40/944332640.db2.gz NJVPOQUITKFHMF-OAHLLOKOSA-N 0 0 371.437 3.953 20 5 FHBDRN O=C(NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N1CC[C@@H]2CCC[C@@H]21 ZINC000426277003 944335305 /nfs/dbraw/zinc/33/53/05/944335305.db2.gz IQLSCBCRAOEKDI-FZMZJTMJSA-N 0 0 357.332 3.698 20 5 FHBDRN CCOc1cc(N2CCC(Oc3ncccc3C)CC2)ccc1[N+](=O)[O-] ZINC000517476670 944336171 /nfs/dbraw/zinc/33/61/71/944336171.db2.gz UMSSQWVAAGOOAM-UHFFFAOYSA-N 0 0 357.410 3.745 20 5 FHBDRN COc1c(-c2nc(CCCOc3ccc(F)cc3)no2)cccc1[N+](=O)[O-] ZINC000515915217 944340843 /nfs/dbraw/zinc/34/08/43/944340843.db2.gz WGOUGEDURIHKAM-UHFFFAOYSA-N 0 0 373.340 3.804 20 5 FHBDRN CNC(=O)c1ccc(NCCOc2ccccc2C(C)C)c([N+](=O)[O-])c1 ZINC000518387261 944342811 /nfs/dbraw/zinc/34/28/11/944342811.db2.gz CMKQCLSBMZJVIT-UHFFFAOYSA-N 0 0 357.410 3.569 20 5 FHBDRN CNC(=O)c1ccc(Nc2ccc(N3CCCCC3)cc2)c([N+](=O)[O-])c1 ZINC000053548461 944343671 /nfs/dbraw/zinc/34/36/71/944343671.db2.gz VPPFPXCOGUHEQH-UHFFFAOYSA-N 0 0 354.410 3.688 20 5 FHBDRN O=C(NCc1ccc(F)cc1F)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000426280386 944345830 /nfs/dbraw/zinc/34/58/30/944345830.db2.gz LKWUWTAQFLWNNW-UHFFFAOYSA-N 0 0 361.348 3.747 20 5 FHBDRN O=C(N[C@@H]1CCCOc2ccccc21)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000123344040 944346212 /nfs/dbraw/zinc/34/62/12/944346212.db2.gz UPNPVHIDGIPSTG-QGZVFWFLSA-N 0 0 367.405 3.576 20 5 FHBDRN O=C(NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N1CC[C@@H](C2CC2)C1 ZINC000426280146 944346660 /nfs/dbraw/zinc/34/66/60/944346660.db2.gz SMRJNFJLWRSSKA-GFCCVEGCSA-N 0 0 357.332 3.555 20 5 FHBDRN CNC(=O)c1ccc(CSCc2cc(OC)c(F)cc2[N+](=O)[O-])cc1 ZINC000184046013 944352407 /nfs/dbraw/zinc/35/24/07/944352407.db2.gz FYMQRINKBRLBDQ-UHFFFAOYSA-N 0 0 364.398 3.536 20 5 FHBDRN COc1cc(Nc2ncc([N+](=O)[O-])c(C)c2Br)ccc1F ZINC000436472017 944352815 /nfs/dbraw/zinc/35/28/15/944352815.db2.gz XPNUKVBATYWUTG-UHFFFAOYSA-N 0 0 356.151 3.952 20 5 FHBDRN CSc1ccc(C(=O)Nc2cc(Br)ccn2)cc1[N+](=O)[O-] ZINC000123408921 944357217 /nfs/dbraw/zinc/35/72/17/944357217.db2.gz YBYSTWMOGGJRBT-UHFFFAOYSA-N 0 0 368.212 3.727 20 5 FHBDRN CCOc1ccc(NC(=O)CN2CCCc3cc(F)ccc32)c([N+](=O)[O-])c1 ZINC000506178272 944359248 /nfs/dbraw/zinc/35/92/48/944359248.db2.gz PHWOGUUCIPXGTG-UHFFFAOYSA-N 0 0 373.384 3.524 20 5 FHBDRN CNC(=O)c1ccc(N[C@@H](C)c2ccc(OC(F)F)cc2)c([N+](=O)[O-])c1 ZINC000053557197 944368733 /nfs/dbraw/zinc/36/87/33/944368733.db2.gz GGDBWAJGAOKPDT-JTQLQIEISA-N 0 0 365.336 3.729 20 5 FHBDRN CNC(=O)c1ccc(N2CCC[C@@H]2c2ccc(Cl)cc2)c([N+](=O)[O-])c1 ZINC000053557716 944368804 /nfs/dbraw/zinc/36/88/04/944368804.db2.gz HDXOYSIKJQRACZ-OAHLLOKOSA-N 0 0 359.813 3.949 20 5 FHBDRN CC[C@H]1C[C@]1(NC(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-])c1cccc(C)c1 ZINC000506181869 944370470 /nfs/dbraw/zinc/37/04/70/944370470.db2.gz BYQPKMYFFFYXLK-ORAYPTAESA-N 0 0 356.426 3.805 20 5 FHBDRN C[C@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1Oc2ccccc2[C@H]1C ZINC000438159100 944371060 /nfs/dbraw/zinc/37/10/60/944371060.db2.gz SGNZQCNZULCERY-UYSIFFEZSA-N 0 0 374.824 3.860 20 5 FHBDRN Cc1nn(C)c(C(=O)N[C@H](C)c2ccc(Cl)c3ccccc32)c1[N+](=O)[O-] ZINC000184268773 944372325 /nfs/dbraw/zinc/37/23/25/944372325.db2.gz CQGPMEGPIUITDX-SNVBAGLBSA-N 0 0 372.812 3.934 20 5 FHBDRN CCC(CC)n1nccc1C(=O)Nc1ccnn1-c1ccc([N+](=O)[O-])cc1 ZINC000123523759 944374135 /nfs/dbraw/zinc/37/41/35/944374135.db2.gz HEIBNBFKBOUZNX-UHFFFAOYSA-N 0 0 368.397 3.590 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@](C(=O)[O-])(c2ccccc2)C1 ZINC000566625667 944375433 /nfs/dbraw/zinc/37/54/33/944375433.db2.gz DRIFRMGXIOFNCW-MGPUTAFESA-N 0 0 354.406 3.693 20 5 FHBDRN COCCOc1c(Cl)cccc1NCc1ccc(OC)c([N+](=O)[O-])c1 ZINC000123545075 944377348 /nfs/dbraw/zinc/37/73/48/944377348.db2.gz BDUSRNLWOXAPGY-UHFFFAOYSA-N 0 0 366.801 3.894 20 5 FHBDRN Cc1ccc(-c2[nH]nc(NC(=O)Nc3ccc([N+](=O)[O-])c(C)c3)c2C)o1 ZINC000436506998 944378263 /nfs/dbraw/zinc/37/82/63/944378263.db2.gz DZDGIDAIAYHLKI-UHFFFAOYSA-N 0 0 355.354 3.569 20 5 FHBDRN Cc1cc(F)cc(C(=O)O[C@@H](C)c2cn(-c3ccccc3)nn2)c1[N+](=O)[O-] ZINC000123585978 944385939 /nfs/dbraw/zinc/38/59/39/944385939.db2.gz GYMSLKFNPLXGPF-LBPRGKRZSA-N 0 0 370.340 3.541 20 5 FHBDRN Cc1ccc(OCC(=O)NCc2cccc(COC(C)C)c2)c([N+](=O)[O-])c1 ZINC000053571802 944387642 /nfs/dbraw/zinc/38/76/42/944387642.db2.gz WACDJPHBLCSITF-UHFFFAOYSA-N 0 0 372.421 3.523 20 5 FHBDRN O=C(NC[C@@H]1C[C@H]1C1CCC1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000425580902 944389749 /nfs/dbraw/zinc/38/97/49/944389749.db2.gz YXINHVJUPYKINW-KXBFYZLASA-N 0 0 373.453 3.584 20 5 FHBDRN CC(C)c1nccn1Cc1cc(I)cc([N+](=O)[O-])c1 ZINC000518442888 944395958 /nfs/dbraw/zinc/39/59/58/944395958.db2.gz BQDLQTYYEYQACP-UHFFFAOYSA-N 0 0 371.178 3.568 20 5 FHBDRN COCCc1ccc(OCCCC(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000105942829 944398824 /nfs/dbraw/zinc/39/88/24/944398824.db2.gz KYSPMFVYMPTVCJ-UHFFFAOYSA-N 0 0 358.394 3.581 20 5 FHBDRN CCOCc1ccccc1CNC(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000105927048 944403348 /nfs/dbraw/zinc/40/33/48/944403348.db2.gz PSNRDEVJTLTRHK-CQSZACIVSA-N 0 0 374.462 3.928 20 5 FHBDRN O=[N+]([O-])c1ccc(Sc2nnc(N3CCCC3)s2)c2ccncc21 ZINC000053580593 944403467 /nfs/dbraw/zinc/40/34/67/944403467.db2.gz CYBVJBDTTFAGLW-UHFFFAOYSA-N 0 0 359.436 3.746 20 5 FHBDRN COC(=O)c1cc(NC(=O)C/C=C\c2ccccc2F)cc([N+](=O)[O-])c1 ZINC000426299371 944406179 /nfs/dbraw/zinc/40/61/79/944406179.db2.gz VKBYBNXZTOLKGQ-XQRVVYSFSA-N 0 0 358.325 3.563 20 5 FHBDRN COc1ccc2c(c1)CN(C(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1)CC2 ZINC000473773198 944409550 /nfs/dbraw/zinc/40/95/50/944409550.db2.gz BTGBBQCCACFQJU-UHFFFAOYSA-N 0 0 354.406 3.925 20 5 FHBDRN COc1ccc(CSCC(=O)N(C)C2CCCCC2)cc1[N+](=O)[O-] ZINC000105966146 944413124 /nfs/dbraw/zinc/41/31/24/944413124.db2.gz OIYVZUHCLGUVGO-UHFFFAOYSA-N 0 0 352.456 3.628 20 5 FHBDRN O=C(Nc1cc(Br)ccn1)c1ccc([N+](=O)[O-])cc1Cl ZINC000123760424 944416598 /nfs/dbraw/zinc/41/65/98/944416598.db2.gz CFPIXYJWEHSENZ-UHFFFAOYSA-N 0 0 356.563 3.658 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N1CC2(CCOCC2)[C@H]1C(C)C ZINC000518490269 944422091 /nfs/dbraw/zinc/42/20/91/944422091.db2.gz YRCYCEOZWHQSMT-MRXNPFEDSA-N 0 0 366.845 3.834 20 5 FHBDRN O=C(Nc1cnc(-c2ccccc2)nc1)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000053599208 944427157 /nfs/dbraw/zinc/42/71/57/944427157.db2.gz JDKZTOGAQFKVOF-UHFFFAOYSA-N 0 0 359.345 3.785 20 5 FHBDRN Cc1cccc2oc(CCNC(=O)Nc3ccc([N+](=O)[O-])c(C)c3)nc21 ZINC000473777181 944433473 /nfs/dbraw/zinc/43/34/73/944433473.db2.gz GLUGXPWMXAFOFZ-UHFFFAOYSA-N 0 0 354.366 3.717 20 5 FHBDRN Cc1cc(NC(=O)NCc2c(F)cccc2OC(F)F)ccc1[N+](=O)[O-] ZINC000473780289 944437346 /nfs/dbraw/zinc/43/73/46/944437346.db2.gz AVSNDQHTAJRDIP-UHFFFAOYSA-N 0 0 369.299 3.965 20 5 FHBDRN CSc1cccc(NCc2csc(-c3cccc([N+](=O)[O-])c3)n2)n1 ZINC000517602725 944437596 /nfs/dbraw/zinc/43/75/96/944437596.db2.gz MDFVHBPBTWPYDI-UHFFFAOYSA-N 0 0 358.448 3.869 20 5 FHBDRN O=[N+]([O-])c1ccn(C2CCN(Cc3ccccc3OC(F)(F)F)CC2)n1 ZINC000425970710 944454942 /nfs/dbraw/zinc/45/49/42/944454942.db2.gz IKGAQOMMNWODTE-UHFFFAOYSA-N 0 0 370.331 3.527 20 5 FHBDRN CCN(CC)S(=O)(=O)c1ccc(Sc2cccs2)c([N+](=O)[O-])c1 ZINC000517637924 944460114 /nfs/dbraw/zinc/46/01/14/944460114.db2.gz QQFSASOBFXICSD-UHFFFAOYSA-N 0 0 372.493 3.838 20 5 FHBDRN O=[N+]([O-])c1c[nH]c(-c2nc(-c3cccc(OCc4cccnc4)c3)no2)c1 ZINC000517628767 944464256 /nfs/dbraw/zinc/46/42/56/944464256.db2.gz VOLGLVMQMIFKHX-UHFFFAOYSA-N 0 0 363.333 3.614 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)NC[C@H]2CCc3ccccc32)cc1SC ZINC000110377510 944467536 /nfs/dbraw/zinc/46/75/36/944467536.db2.gz DBYFQUQKGLFOBT-CYBMUJFWSA-N 0 0 372.446 3.785 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1CC[C@H](C)C[C@@H]1c1ccco1 ZINC000439238980 944468845 /nfs/dbraw/zinc/46/88/45/944468845.db2.gz QKNYWKGPNVNIIE-SWLSCSKDSA-N 0 0 364.423 3.658 20 5 FHBDRN CC[C@@H](Sc1ccccc1)C(=O)NCc1ccc(OC)c([N+](=O)[O-])c1 ZINC000517654028 944469353 /nfs/dbraw/zinc/46/93/53/944469353.db2.gz GSJWXNZBPOMXKI-QGZVFWFLSA-N 0 0 360.435 3.791 20 5 FHBDRN CO[C@@H]1Cc2ccccc2N(C(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)C1 ZINC000500308374 944472520 /nfs/dbraw/zinc/47/25/20/944472520.db2.gz NYQDFSKMBMHNLK-XJKSGUPXSA-N 0 0 372.446 3.680 20 5 FHBDRN Cc1cc(NCC[C@@H](C)[N@H+](C)Cc2ccccc2)cc(C(=O)[O-])c1[N+](=O)[O-] ZINC000518540544 944476528 /nfs/dbraw/zinc/47/65/28/944476528.db2.gz RLOHZCHKROIZKR-OAHLLOKOSA-N 0 0 371.437 3.924 20 5 FHBDRN CCOc1ccc(-c2noc(COc3ccc([N+](=O)[O-])cc3F)n2)cc1 ZINC000046877425 944477470 /nfs/dbraw/zinc/47/74/70/944477470.db2.gz CVFRHBSECKNZSV-UHFFFAOYSA-N 0 0 359.313 3.762 20 5 FHBDRN O=C(NCc1cc(F)c(C(F)(F)F)cc1F)c1csc([N+](=O)[O-])c1 ZINC000516103311 944485990 /nfs/dbraw/zinc/48/59/90/944485990.db2.gz ICCUXGNJTYDVAV-UHFFFAOYSA-N 0 0 366.267 3.883 20 5 FHBDRN Cc1nc2cc(CNc3ncnc4cc(F)c([N+](=O)[O-])cc43)ccc2o1 ZINC001167758239 944494061 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FHBDRN COc1ccc(F)cc1[C@H](C)NC(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000046985258 944506386 /nfs/dbraw/zinc/50/63/86/944506386.db2.gz UVNXILJRPRPLAM-LBPRGKRZSA-N 0 0 361.373 3.645 20 5 FHBDRN COC(=O)[C@H](Sc1cccc([N+](=O)[O-])c1)c1cc(OC)cc(OC)c1 ZINC000509725839 944507900 /nfs/dbraw/zinc/50/79/00/944507900.db2.gz GEEHYEIGVDPIIK-MRXNPFEDSA-N 0 0 363.391 3.618 20 5 FHBDRN COc1cccc(CCC(=O)N2c3ccc([N+](=O)[O-])cc3C[C@@H]2C)c1F ZINC000516109488 944510670 /nfs/dbraw/zinc/51/06/70/944510670.db2.gz JGCQPRUBKJDRKH-LBPRGKRZSA-N 0 0 358.369 3.653 20 5 FHBDRN Cc1n[nH]c(C(=O)NCc2ccccc2Oc2ccccc2C)c1[N+](=O)[O-] ZINC000518571533 944511113 /nfs/dbraw/zinc/51/11/13/944511113.db2.gz XALIRIYKFKMIRS-UHFFFAOYSA-N 0 0 366.377 3.657 20 5 FHBDRN COc1ccc(C(=O)COc2cc(C)c([N+](=O)[O-])cc2Cl)cc1OC ZINC000506540130 944516489 /nfs/dbraw/zinc/51/64/89/944516489.db2.gz SCMSKPBPJXLNKS-UHFFFAOYSA-N 0 0 365.769 3.836 20 5 FHBDRN C[C@@H](Cn1ncc2ccccc21)C(=O)NC(C)(C)c1ccccc1[N+](=O)[O-] ZINC000518587660 944518651 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FHBDRN COc1cccc(O[C@@H](C)CNc2cc(C(F)(F)F)ncc2[N+](=O)[O-])c1 ZINC000436397436 944688652 /nfs/dbraw/zinc/68/86/52/944688652.db2.gz NJDZGYYFYNJZGA-JTQLQIEISA-N 0 0 371.315 3.897 20 5 FHBDRN Cc1cc(O)c(C(C)C)cc1C(=O)N1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000436822915 944691558 /nfs/dbraw/zinc/69/15/58/944691558.db2.gz XYDDZQCJPDMGPO-UHFFFAOYSA-N 0 0 370.405 3.767 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C[NH2+]C[C@H](Cc1ccc(Cl)cc1)C(=O)[O-] ZINC000426696566 944696779 /nfs/dbraw/zinc/69/67/79/944696779.db2.gz PDFLGIVBNHIEJD-HNNXBMFYSA-N 0 0 362.813 3.590 20 5 FHBDRN Cc1ccc(C[NH2+]C[C@@H](Cc2ccccc2Cl)C(=O)[O-])cc1[N+](=O)[O-] ZINC000426702168 944701841 /nfs/dbraw/zinc/70/18/41/944701841.db2.gz FHAQLILUINEMTQ-OAHLLOKOSA-N 0 0 362.813 3.590 20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])NC[C@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000438515592 944707950 /nfs/dbraw/zinc/70/79/50/944707950.db2.gz IBZSLWZRDFWELU-QWHCGFSZSA-N 0 0 373.375 3.882 20 5 FHBDRN CCOc1ccc(NC(=O)CNc2ccc(F)cc2Cl)c([N+](=O)[O-])c1 ZINC000015122616 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FHBDRN Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](C(=O)[O-])c1ccc(Cl)c(F)c1 ZINC000426754950 944775156 /nfs/dbraw/zinc/77/51/56/944775156.db2.gz VJUSOIQNOGTBDL-OAHLLOKOSA-N 0 0 352.749 3.611 20 5 FHBDRN Cc1cc(C)n(-c2ccc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)cc2F)n1 ZINC000518793388 944776999 /nfs/dbraw/zinc/77/69/99/944776999.db2.gz JOILCGPUCHRSGX-UHFFFAOYSA-N 0 0 372.331 3.928 20 5 FHBDRN CCOc1ccc(OC(C)(C)C(=O)OCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000017760266 944777246 /nfs/dbraw/zinc/77/72/46/944777246.db2.gz PQDAOCKWXXSSNH-UHFFFAOYSA-N 0 0 359.378 3.894 20 5 FHBDRN O=C(Nc1ccccc1C(=O)N1CCCCC1)c1cc(F)cc([N+](=O)[O-])c1 ZINC000518794102 944778793 /nfs/dbraw/zinc/77/87/93/944778793.db2.gz MCXKCBLYMNWWAY-UHFFFAOYSA-N 0 0 371.368 3.612 20 5 FHBDRN CC(C)(CNC(=O)c1c(Br)cccc1[N+](=O)[O-])CC(F)F ZINC000893371320 944779451 /nfs/dbraw/zinc/77/94/51/944779451.db2.gz QIHTYJAQJBYQLI-UHFFFAOYSA-N 0 0 365.174 3.769 20 5 FHBDRN Cc1ccc([C@H]2CCCN2S(=O)(=O)c2ccccc2[N+](=O)[O-])cc1C ZINC000516379006 944782555 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3.895 20 5 FHBDRN CN(Cc1nc(C(F)(F)F)cs1)C(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000154407639 944804745 /nfs/dbraw/zinc/80/47/45/944804745.db2.gz WRWFJNUBWHTVJK-UHFFFAOYSA-N 0 0 373.356 3.661 20 5 FHBDRN CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N(C)Cc2ccco2)CC1 ZINC000017790212 944807781 /nfs/dbraw/zinc/80/77/81/944807781.db2.gz LWIXGZRFQDBDTK-UHFFFAOYSA-N 0 0 357.410 3.696 20 5 FHBDRN Cc1c(NC(=O)c2ccc([N+](=O)[O-])cc2)cnn1-c1cc(C)ccc1C ZINC000154073187 944810618 /nfs/dbraw/zinc/81/06/18/944810618.db2.gz CNYKBKUDNCHSOB-UHFFFAOYSA-N 0 0 350.378 3.958 20 5 FHBDRN Cc1sc(C(=O)Nc2cc(NC(=O)N(C)C)ccc2C)cc1[N+](=O)[O-] ZINC000437929644 944812669 /nfs/dbraw/zinc/81/26/69/944812669.db2.gz VKODGFOFAOAWRC-UHFFFAOYSA-N 0 0 362.411 3.619 20 5 FHBDRN COc1cccc2c1[C@H](C(=O)NCc1ccc([N+](=O)[O-])cc1Cl)CC2 ZINC000500410665 944814871 /nfs/dbraw/zinc/81/48/71/944814871.db2.gz ODLXRIACDMJXJE-CQSZACIVSA-N 0 0 360.797 3.603 20 5 FHBDRN O=C(NC1CC1)c1ccc(NC2CCC3(CCOCC3)CC2)c([N+](=O)[O-])c1 ZINC000439617786 944816090 /nfs/dbraw/zinc/81/60/90/944816090.db2.gz ZQRFWYMSYOKMDH-UHFFFAOYSA-N 0 0 373.453 3.638 20 5 FHBDRN O=C(c1cc(OCc2ccccc2)ccc1[N+](=O)[O-])N1CCC12CCC2 ZINC000426795467 944818781 /nfs/dbraw/zinc/81/87/81/944818781.db2.gz XZSCTZGWTAQZOB-UHFFFAOYSA-N 0 0 352.390 3.942 20 5 FHBDRN O=C([O-])[C@@H](NCc1ccc(-c2cccc([N+](=O)[O-])c2)o1)c1cccs1 ZINC000426798453 944820976 /nfs/dbraw/zinc/82/09/76/944820976.db2.gz IXXRYXHJOVRBLJ-INIZCTEOSA-N 0 0 358.375 3.832 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccc(C)c(Br)c1 ZINC000388525522 944824120 /nfs/dbraw/zinc/82/41/20/944824120.db2.gz JSNNPMHYRZFBEY-UHFFFAOYSA-N 0 0 365.183 3.927 20 5 FHBDRN CN(C)C(=O)c1ccc(Cl)cc1NCc1c(F)cc([N+](=O)[O-])cc1F ZINC000506295395 944829701 /nfs/dbraw/zinc/82/97/01/944829701.db2.gz QHBFFGKXEVQXMQ-UHFFFAOYSA-N 0 0 369.755 3.840 20 5 FHBDRN O=C(Cc1cccc(Cl)c1F)Nc1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000518846302 944838781 /nfs/dbraw/zinc/83/87/81/944838781.db2.gz OIWBVPOHLDHXIP-UHFFFAOYSA-N 0 0 359.744 3.539 20 5 FHBDRN CC(C)(C)[C@H]1CCC[C@H]1NC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000412829312 944844395 /nfs/dbraw/zinc/84/43/95/944844395.db2.gz UGYMAHYPDCGZDX-GOEBONIOSA-N 0 0 357.410 3.793 20 5 FHBDRN CCCOc1cccc(NC(=O)NCCOc2ccc([N+](=O)[O-])cc2)c1 ZINC000518837122 944846003 /nfs/dbraw/zinc/84/60/03/944846003.db2.gz FFQKAMIKSDEWEC-UHFFFAOYSA-N 0 0 359.382 3.584 20 5 FHBDRN COc1cc(-c2noc(C(C)(C)c3ccc([N+](=O)[O-])cc3)n2)ccc1O ZINC000436952130 944847385 /nfs/dbraw/zinc/84/73/85/944847385.db2.gz VAIZAMDAFBRTID-UHFFFAOYSA-N 0 0 355.350 3.685 20 5 FHBDRN CC(C)[C@H](CC(F)(F)F)NC(=O)CSc1ccccc1[N+](=O)[O-] ZINC000438615143 944848997 /nfs/dbraw/zinc/84/89/97/944848997.db2.gz RDCKPKXLTVSJRN-JTQLQIEISA-N 0 0 350.362 3.780 20 5 FHBDRN O=C([O-])[C@H](Cc1ccco1)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000426826039 944850024 /nfs/dbraw/zinc/85/00/24/944850024.db2.gz SHWKKEZIMBYGRX-HNNXBMFYSA-N 0 0 372.402 3.702 20 5 FHBDRN Cc1ccc(NC(=O)N2CC[C@H](COc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000506300990 944852369 /nfs/dbraw/zinc/85/23/69/944852369.db2.gz MMVLUARQGYVBJB-HNNXBMFYSA-N 0 0 355.394 3.836 20 5 FHBDRN CC(C)C[N@@H+]1Cc2cccc(NC(=O)c3cc([N+](=O)[O-])ccc3[O-])c2C1 ZINC000436958562 944855127 /nfs/dbraw/zinc/85/51/27/944855127.db2.gz IPPLFGYGLREHOI-UHFFFAOYSA-N 0 0 355.394 3.524 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)NCc1ccc(F)c(Cl)c1 ZINC000507013226 944861793 /nfs/dbraw/zinc/86/17/93/944861793.db2.gz GAFRAXWRLJYCJO-UHFFFAOYSA-N 0 0 354.790 3.796 20 5 FHBDRN CCN(CCNC(=O)c1cc(SC)ccc1[N+](=O)[O-])c1cccc(C)c1 ZINC000017841445 944861856 /nfs/dbraw/zinc/86/18/56/944861856.db2.gz OBLFWPNFJIGYTJ-UHFFFAOYSA-N 0 0 373.478 3.881 20 5 FHBDRN CCCc1n[nH]c(C(=O)N[C@@H](C)c2ccc(SCC)cc2)c1[N+](=O)[O-] ZINC000518852066 944864471 /nfs/dbraw/zinc/86/44/71/944864471.db2.gz NYIVGZVZIISHJC-NSHDSACASA-N 0 0 362.455 3.873 20 5 FHBDRN COc1cc(OCC(=O)O[C@H](C)c2ccc(F)c(F)c2)ccc1[N+](=O)[O-] ZINC000123986932 944865134 /nfs/dbraw/zinc/86/51/34/944865134.db2.gz IPAQFUWQQSUYHY-SNVBAGLBSA-N 0 0 367.304 3.565 20 5 FHBDRN CCN(CC)c1ccc(NC(=O)CSc2ccc([N+](=O)[O-])cc2)cn1 ZINC000506303381 944872215 /nfs/dbraw/zinc/87/22/15/944872215.db2.gz BDWGROWHRSOAJV-UHFFFAOYSA-N 0 0 360.439 3.567 20 5 FHBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCCC[C@H]1c1ccnn1C ZINC000500428517 944885113 /nfs/dbraw/zinc/88/51/13/944885113.db2.gz KDEBWSMEARLCCB-SFHVURJKSA-N 0 0 358.442 3.843 20 5 FHBDRN O=C(CNc1c(Cl)cc([N+](=O)[O-])cc1Cl)NCc1ccccc1 ZINC000303687312 944895078 /nfs/dbraw/zinc/89/50/78/944895078.db2.gz HKHSPSVMKBCZGK-UHFFFAOYSA-N 0 0 354.193 3.630 20 5 FHBDRN O=C(Nc1cnccc1-n1cccn1)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000518894770 944898547 /nfs/dbraw/zinc/89/85/47/944898547.db2.gz YKAKOICPLJPZSN-UHFFFAOYSA-N 0 0 365.374 3.643 20 5 FHBDRN O=C(CSc1ccccc1[N+](=O)[O-])Nc1nc2c(s1)CSCC2 ZINC000517979309 944903227 /nfs/dbraw/zinc/90/32/27/944903227.db2.gz BWDZSDFBKWWFML-UHFFFAOYSA-N 0 0 367.477 3.571 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NS(=O)(=O)Cc1cccc(Cl)c1 ZINC000566819838 944904487 /nfs/dbraw/zinc/90/44/87/944904487.db2.gz GSIDCMCHJDVLHW-UHFFFAOYSA-N 0 0 354.815 3.807 20 5 FHBDRN CC[C@H](CNc1ccc(C(=O)NC)cc1[N+](=O)[O-])Oc1ccccc1C ZINC000426890035 944909036 /nfs/dbraw/zinc/90/90/36/944909036.db2.gz PWDYSSYLVQWGJM-OAHLLOKOSA-N 0 0 357.410 3.532 20 5 FHBDRN O=C(COc1cccc([N+](=O)[O-])c1)N[C@H]1CC[C@@H](Cc2ccccc2)C1 ZINC000438686303 944911313 /nfs/dbraw/zinc/91/13/13/944911313.db2.gz CUOMICHANMDFDY-IRXDYDNUSA-N 0 0 354.406 3.501 20 5 FHBDRN COc1ccc(C(=O)N[C@@H](Cc2ccc(F)cc2)C(C)C)cc1[N+](=O)[O-] ZINC000437011093 944911834 /nfs/dbraw/zinc/91/18/34/944911834.db2.gz UAZRKESFEDGJGN-INIZCTEOSA-N 0 0 360.385 3.740 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H]1CCO[C@@H]1c1ccccc1 ZINC000432006279 944919285 /nfs/dbraw/zinc/91/92/85/944919285.db2.gz IUJDGHAXVDYTHP-CRAIPNDOSA-N 0 0 355.394 3.803 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])c2cccnc12)NCCC1=CCCCC1 ZINC000137384869 944923053 /nfs/dbraw/zinc/92/30/53/944923053.db2.gz HTGQCOYRQZTUOX-UHFFFAOYSA-N 0 0 355.394 3.529 20 5 FHBDRN C[C@H](Nc1ncnc2sc([N+](=O)[O-])cc21)c1noc(-c2ccccc2)n1 ZINC000516481503 944927279 /nfs/dbraw/zinc/92/72/79/944927279.db2.gz CSTBMQYZLMCPLH-VIFPVBQESA-N 0 0 368.378 3.823 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])N[C@@H]1CC[C@H](Cc2ccccc2)C1 ZINC000438688335 944927515 /nfs/dbraw/zinc/92/75/15/944927515.db2.gz VMYAZQLIDBNTPR-QZTJIDSGSA-N 0 0 368.433 3.891 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H](C)O[C@@H](CC)C1 ZINC000506329310 944932869 /nfs/dbraw/zinc/93/28/69/944932869.db2.gz FLBLCRXMAAABNK-OCCSQVGLSA-N 0 0 352.456 3.736 20 5 FHBDRN O=[N+]([O-])c1cc(F)c(CSCc2ncn(-c3ccccc3)n2)c(F)c1 ZINC000507080807 944936028 /nfs/dbraw/zinc/93/60/28/944936028.db2.gz DJVJTHFQQPTLRJ-UHFFFAOYSA-N 0 0 362.361 3.887 20 5 FHBDRN CCC(CC)[C@H](CCNC(=O)c1cc(SC)ccc1[N+](=O)[O-])OC ZINC000437026842 944943134 /nfs/dbraw/zinc/94/31/34/944943134.db2.gz WXFKFGLBJATHMR-INIZCTEOSA-N 0 0 354.472 3.888 20 5 FHBDRN C[C@@H](c1ccccc1)N1CC(=O)N(Cc2ccc([N+](=O)[O-])cc2Cl)C1=O ZINC000432049484 944950889 /nfs/dbraw/zinc/95/08/89/944950889.db2.gz NCQIJRCQEATPEQ-LBPRGKRZSA-N 0 0 373.796 3.774 20 5 FHBDRN CC[C@@H]1CN(c2c(Cl)cc(Cl)cc2[N+](=O)[O-])C[C@@]2(CCOC2)O1 ZINC000408103391 944963526 /nfs/dbraw/zinc/96/35/26/944963526.db2.gz ALAQDOMMDFDMCY-IAQYHMDHSA-N 0 0 361.225 3.676 20 5 FHBDRN CCN(c1cccc(Cl)c1)S(=O)(=O)c1c(C)cccc1[N+](=O)[O-] ZINC000511733147 944966515 /nfs/dbraw/zinc/96/65/15/944966515.db2.gz CUIZGCZWISWAFW-UHFFFAOYSA-N 0 0 354.815 3.772 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N(CC)C[C@H]1CCCO1 ZINC000505954233 944978444 /nfs/dbraw/zinc/97/84/44/944978444.db2.gz SYKMHHJMAFROFD-CQSZACIVSA-N 0 0 352.456 3.738 20 5 FHBDRN Cc1nc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3SC(C)C)cn2n1 ZINC000507142899 944978652 /nfs/dbraw/zinc/97/86/52/944978652.db2.gz KMLNYPMRQXUIMK-UHFFFAOYSA-N 0 0 371.422 3.699 20 5 FHBDRN CSc1cc2c(cc1CN(C)Cc1ccccc1[N+](=O)[O-])OCCO2 ZINC000507144703 944980857 /nfs/dbraw/zinc/98/08/57/944980857.db2.gz QNDPYYBYGLXMQB-UHFFFAOYSA-N 0 0 360.435 3.720 20 5 FHBDRN COc1cc(CN(C)Cc2ccc(F)cc2F)c([N+](=O)[O-])cc1OC ZINC000506339665 944988562 /nfs/dbraw/zinc/98/85/62/944988562.db2.gz DXXDQRNTZAIPAT-UHFFFAOYSA-N 0 0 352.337 3.522 20 5 FHBDRN C[C@@H](NC(=O)c1cc([N+](=O)[O-])n[nH]1)c1ccc(Oc2ccccc2)c(F)c1 ZINC000507160812 944993908 /nfs/dbraw/zinc/99/39/08/944993908.db2.gz NJQQICREHMLQHC-LLVKDONJSA-N 0 0 370.340 3.740 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N[C@H](c2ccco2)c2ccccc2)c1[N+](=O)[O-] ZINC000427000455 945002169 /nfs/dbraw/zinc/00/21/69/945002169.db2.gz OKRZZEXRROWRBP-HNNXBMFYSA-N 0 0 354.366 3.554 20 5 FHBDRN O=[N+]([O-])c1ccc(OC(F)F)c(CN2CCOc3ccc(F)cc3C2)c1 ZINC000426498582 945007023 /nfs/dbraw/zinc/00/70/23/945007023.db2.gz VCJUDTDTIHYKQN-UHFFFAOYSA-N 0 0 368.311 3.730 20 5 FHBDRN CC(=O)N1C[C@@H]2CCC[C@H](Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)[C@@H]2C1 ZINC000516558179 945008275 /nfs/dbraw/zinc/00/82/75/945008275.db2.gz ORWTYRDKKNKBCF-LNSITVRQSA-N 0 0 371.359 3.673 20 5 FHBDRN O=[N+]([O-])c1cc2c(nc1N1Cc3ccc(O)cc3C3(CC3)C1)CCCC2 ZINC000516565448 945015969 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3.779 20 5 FHBDRN Cc1cnc([C@@H](C)NC(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])s1 ZINC000427062976 945049787 /nfs/dbraw/zinc/04/97/87/945049787.db2.gz VJRJFHFDGJKZKV-ZJUUUORDSA-N 0 0 369.830 3.658 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)Nc1cnn([C@H](C)C2CC2)c1 ZINC000439889662 945051694 /nfs/dbraw/zinc/05/16/94/945051694.db2.gz BZSXYJOBJXKTMC-LLVKDONJSA-N 0 0 359.386 3.805 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)NCCc1cccc(F)c1F ZINC000439880710 945058984 /nfs/dbraw/zinc/05/89/84/945058984.db2.gz TXRWUTPMDTWVSS-UHFFFAOYSA-N 0 0 365.336 3.636 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)NCc1nccc2ccccc21 ZINC000439880677 945059428 /nfs/dbraw/zinc/05/94/28/945059428.db2.gz SVVPDGXGKLZVSW-UHFFFAOYSA-N 0 0 366.377 3.863 20 5 FHBDRN COC(=O)c1cc([N+](=O)[O-])c(N[C@@H](C)c2cccc(O)c2)cc1Cl ZINC000124036630 945062378 /nfs/dbraw/zinc/06/23/78/945062378.db2.gz XGNSSLFXADHTNW-VIFPVBQESA-N 0 0 350.758 3.914 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H]1C[C@@H]1c1cccc(F)c1 ZINC000439893077 945062993 /nfs/dbraw/zinc/06/29/93/945062993.db2.gz VRWQQUWDILKTFZ-CABCVRRESA-N 0 0 359.357 3.810 20 5 FHBDRN Cc1cc(NC(=O)COc2ccc([N+](=O)[O-])c(Cl)c2)n(C(C)(C)C)n1 ZINC000124936082 945376007 /nfs/dbraw/zinc/37/60/07/945376007.db2.gz QWXUKNNSNPBEPD-UHFFFAOYSA-N 0 0 366.805 3.526 20 5 FHBDRN Cc1ccc(CN(C(=O)COc2ccc([N+](=O)[O-])c(Cl)c2)C2CC2)o1 ZINC000124938238 945379650 /nfs/dbraw/zinc/37/96/50/945379650.db2.gz VNWUBFZBXHMGSL-UHFFFAOYSA-N 0 0 364.785 3.720 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)NCCSCc2ccccc2)c1 ZINC000018150258 945379831 /nfs/dbraw/zinc/37/98/31/945379831.db2.gz GMZOPABCHOIRFU-UHFFFAOYSA-N 0 0 362.476 3.980 20 5 FHBDRN COC(=O)[C@H](C)CC(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000475045826 945385703 /nfs/dbraw/zinc/38/57/03/945385703.db2.gz IMQVCEYZZUWMOV-GFCCVEGCSA-N 0 0 358.350 3.525 20 5 FHBDRN CN(C)c1nc2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4o3)cc2o1 ZINC000426624161 945385967 /nfs/dbraw/zinc/38/59/67/945385967.db2.gz UAVYUBYWVCZBRA-UHFFFAOYSA-N 0 0 366.333 3.801 20 5 FHBDRN COc1ccccc1[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])cc1OC ZINC000427453053 945393239 /nfs/dbraw/zinc/39/32/39/945393239.db2.gz WWIWZXIKYOLIDQ-INIZCTEOSA-N 0 0 356.378 3.589 20 5 FHBDRN O=C(N[C@@H](c1nccs1)C(F)(F)F)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000507647053 945398179 /nfs/dbraw/zinc/39/81/79/945398179.db2.gz NKJMHUXRRNHHMJ-NSHDSACASA-N 0 0 370.312 3.566 20 5 FHBDRN CCN(C(=O)NCc1ccc([N+](=O)[O-])cc1Cl)[C@@H](C)c1cccnc1 ZINC000185999543 945409136 /nfs/dbraw/zinc/40/91/36/945409136.db2.gz VUKSIIDBXZBHOY-LBPRGKRZSA-N 0 0 362.817 3.936 20 5 FHBDRN O=C(N[C@@H]1CCc2ccccc2C1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000438015110 945412261 /nfs/dbraw/zinc/41/22/61/945412261.db2.gz DYNPKOUMAVQLLN-GOSISDBHSA-N 0 0 365.433 3.826 20 5 FHBDRN O=C(N[C@H]1CC2CCC1CC2)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000426634903 945417394 /nfs/dbraw/zinc/41/73/94/945417394.db2.gz REXYVRSGMSLSHJ-ZOJXTTQQSA-N 0 0 373.453 3.726 20 5 FHBDRN Cn1cnc([N+](=O)[O-])c1N1CCC[C@H](Oc2ccc(Cl)c(Cl)c2)C1 ZINC000440319366 945417470 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FHBDRN O=C(NCCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccccc1 ZINC000018174098 945444394 /nfs/dbraw/zinc/44/43/94/945444394.db2.gz JGRDRNSPTFMRPE-UHFFFAOYSA-N 0 0 368.315 3.847 20 5 FHBDRN CCOc1ccc(CCNC(=O)Nc2cccc([N+](=O)[O-])c2)cc1OCC ZINC000018177955 945445221 /nfs/dbraw/zinc/44/52/21/945445221.db2.gz KNXYJTGRHSZZRJ-UHFFFAOYSA-N 0 0 373.409 3.756 20 5 FHBDRN COc1cccc([C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])cc2OC)c1 ZINC000427511854 945452771 /nfs/dbraw/zinc/45/27/71/945452771.db2.gz OEMRNODHSZUBHL-KRWDZBQOSA-N 0 0 356.378 3.589 20 5 FHBDRN Cc1ccc2sc(C(=O)N3CCC(n4ccc([N+](=O)[O-])n4)CC3)cc2c1 ZINC000519488232 945459393 /nfs/dbraw/zinc/45/93/93/945459393.db2.gz ASMHREMGFAPBQE-UHFFFAOYSA-N 0 0 370.434 3.792 20 5 FHBDRN O=C(CSc1ccccc1[N+](=O)[O-])NC[C@H]1CCCc2ccccc21 ZINC000506834761 945466970 /nfs/dbraw/zinc/46/69/70/945466970.db2.gz AMABZESHFNDYJF-OAHLLOKOSA-N 0 0 356.447 3.923 20 5 FHBDRN C[C@@H]1CCN(C(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)CC1(F)F ZINC000427542915 945473838 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5 FHBDRN CCn1ccnc1[C@H]1CCCCN1C(=O)N[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000281320191 945598482 /nfs/dbraw/zinc/59/84/82/945598482.db2.gz YBNVCTWARAJVBG-WMLDXEAASA-N 0 0 371.441 3.809 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)CCC(=O)OC(C)C ZINC000473620722 945609472 /nfs/dbraw/zinc/60/94/72/945609472.db2.gz UCKCKNPYHRAPEX-LBPRGKRZSA-N 0 0 368.455 3.557 20 5 FHBDRN CC(C)(C)OC(=O)CCSc1ncc([N+](=O)[O-])cc1Br ZINC000440533962 945614759 /nfs/dbraw/zinc/61/47/59/945614759.db2.gz KHCONTIBPLAOBK-UHFFFAOYSA-N 0 0 363.233 3.576 20 5 FHBDRN COc1cc(N2CCC[C@@H]2c2nc3c(n2C)CCCC3)ccc1[N+](=O)[O-] ZINC000281392458 945620638 /nfs/dbraw/zinc/62/06/38/945620638.db2.gz GKBURKBGUVYVDL-QGZVFWFLSA-N 0 0 356.426 3.557 20 5 FHBDRN COc1ccc(CCNC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)cc1F ZINC000473623706 945622517 /nfs/dbraw/zinc/62/25/17/945622517.db2.gz HTMFQVVRJJMETQ-UHFFFAOYSA-N 0 0 360.385 3.838 20 5 FHBDRN CC(=O)c1ccc(OCc2ccn(-c3c(F)cccc3F)n2)c([N+](=O)[O-])c1 ZINC000120306568 945622602 /nfs/dbraw/zinc/62/26/02/945622602.db2.gz CNXCIXOBHQTKBF-UHFFFAOYSA-N 0 0 373.315 3.840 20 5 FHBDRN C[C@H]1CN(C(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)CC(C)(C)C1 ZINC000519676890 945628785 /nfs/dbraw/zinc/62/87/85/945628785.db2.gz HCPUXDRTWFVOTR-CYBMUJFWSA-N 0 0 358.442 3.696 20 5 FHBDRN Cc1ccc(CNc2nnc([C@@H]3Cc4ccccc4O3)o2)cc1[N+](=O)[O-] ZINC000181749742 945633893 /nfs/dbraw/zinc/63/38/93/945633893.db2.gz QSULKPGVFCLPST-INIZCTEOSA-N 0 0 352.350 3.575 20 5 FHBDRN CCc1nn(C)c(CC)c1CC(=O)Nc1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000519663297 945635211 /nfs/dbraw/zinc/63/52/11/945635211.db2.gz VLQQZIXJTRFHFC-UHFFFAOYSA-N 0 0 372.469 3.932 20 5 FHBDRN CC(C)(CNC(=O)[C@@H]1C[C@H]1c1cccc([N+](=O)[O-])c1)c1cccc(F)c1 ZINC001126019838 945636299 /nfs/dbraw/zinc/63/62/99/945636299.db2.gz PZBUZMXACBBGMZ-ZWKOTPCHSA-N 0 0 356.397 3.931 20 5 FHBDRN O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC[C@@H]1[C@H]1CCCOC1 ZINC000519662662 945636560 /nfs/dbraw/zinc/63/65/60/945636560.db2.gz ZXGSKIKVROXVKC-SWLSCSKDSA-N 0 0 360.435 3.841 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1cc(F)ccc1OC[C@H]1CCCO1 ZINC000107499396 945644862 /nfs/dbraw/zinc/64/48/62/945644862.db2.gz PZGVBJZWSIBQII-OAHLLOKOSA-N 0 0 374.368 3.852 20 5 FHBDRN Cc1cc(C(=O)Nc2cc(F)ccc2OC[C@@H]2CCCO2)cc([N+](=O)[O-])c1 ZINC000107498490 945644922 /nfs/dbraw/zinc/64/49/22/945644922.db2.gz OVCSORIKNSTWRK-INIZCTEOSA-N 0 0 374.368 3.852 20 5 FHBDRN CCn1ccnc1[C@H]1CCCCN1C(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000281481526 945646757 /nfs/dbraw/zinc/64/67/57/945646757.db2.gz DCNNJNLJTZRLNN-OAHLLOKOSA-N 0 0 368.393 3.925 20 5 FHBDRN O=C(NCCC[C@@H]1CCCC[C@H]1O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000125161483 945652166 /nfs/dbraw/zinc/65/21/66/945652166.db2.gz DEOMCTAUASOXPU-XHDPSFHLSA-N 0 0 374.359 3.675 20 5 FHBDRN CCN(C(=O)CCOc1cc(C)ccc1[N+](=O)[O-])[C@@H](C)c1cccnc1 ZINC000281503338 945655672 /nfs/dbraw/zinc/65/56/72/945655672.db2.gz IBGDYEIQZNWYSV-HNNXBMFYSA-N 0 0 357.410 3.677 20 5 FHBDRN COCC[C@@H](Cc1ccco1)Nc1ccc([N+](=O)[O-])cc1OC(F)F ZINC000546181012 945661051 /nfs/dbraw/zinc/66/10/51/945661051.db2.gz PXZYVSMEUBQIDF-NSHDSACASA-N 0 0 356.325 3.849 20 5 FHBDRN COc1cc(Cc2noc(CC(C)(C)C3CC3)n2)c([N+](=O)[O-])c(OC)c1 ZINC000519717010 945669489 /nfs/dbraw/zinc/66/94/89/945669489.db2.gz SOWIHNPEOYZQDB-UHFFFAOYSA-N 0 0 361.398 3.565 20 5 FHBDRN CCCO[C@@H]1CCCN(c2cc(Cl)c(C(=O)OC)cc2[N+](=O)[O-])CC1 ZINC000125224745 945678747 /nfs/dbraw/zinc/67/87/47/945678747.db2.gz CCFRDPZBZSSVIF-GFCCVEGCSA-N 0 0 370.833 3.820 20 5 FHBDRN CCCc1ccc(CN2C(=O)N[C@](C)(c3cccc([N+](=O)[O-])c3)C2=O)cc1 ZINC000519727478 945679557 /nfs/dbraw/zinc/67/95/57/945679557.db2.gz QABVABSVTGWAGP-HXUWFJFHSA-N 0 0 367.405 3.515 20 5 FHBDRN CCOc1ccc(N(C)C(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)cc1 ZINC000125201003 945680554 /nfs/dbraw/zinc/68/05/54/945680554.db2.gz WHOITXAFISHPFT-UHFFFAOYSA-N 0 0 369.421 3.870 20 5 FHBDRN Nc1c(C(=O)N[C@H]2CC[C@@H](c3ccc(F)cc3)C2)cc(F)cc1[N+](=O)[O-] ZINC000473641800 945683634 /nfs/dbraw/zinc/68/36/34/945683634.db2.gz 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FHBDRN COc1ccc([N+](=O)[O-])cc1CSCc1cc2ccccc2[nH]c1=O ZINC000111381305 946446759 /nfs/dbraw/zinc/44/67/59/946446759.db2.gz ZBCMGINVDDUYIU-UHFFFAOYSA-N 0 0 356.403 3.878 20 5 FHBDRN C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)Cc1csc(-c2ccoc2)n1 ZINC000151903805 946456742 /nfs/dbraw/zinc/45/67/42/946456742.db2.gz PVEDKUYVNPJOAS-LLVKDONJSA-N 0 0 369.402 3.832 20 5 FHBDRN CCc1c(NC(=O)c2cccc(OC)c2[N+](=O)[O-])cnn1C(CC)CC ZINC000444401547 946458986 /nfs/dbraw/zinc/45/89/86/946458986.db2.gz HKSMXOQATZINGE-UHFFFAOYSA-N 0 0 360.414 3.976 20 5 FHBDRN CCOc1ccccc1[C@@H](CC)NC(=O)c1ccc(NC)c([N+](=O)[O-])c1 ZINC000523093775 946466396 /nfs/dbraw/zinc/46/63/96/946466396.db2.gz PWYXYAGAPDUHRQ-OAHLLOKOSA-N 0 0 357.410 3.916 20 5 FHBDRN CC[C@@H](C)[C@H]1CCCCN1C(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000523094689 946467690 /nfs/dbraw/zinc/46/76/90/946467690.db2.gz WGARMUZGXRWTEA-RDTXWAMCSA-N 0 0 356.426 3.821 20 5 FHBDRN COC(=O)[C@@H](NCc1ccc(-c2ccccc2[N+](=O)[O-])o1)c1cccs1 ZINC000475148074 946474552 /nfs/dbraw/zinc/47/45/52/946474552.db2.gz XGYZTNMWJPEHTO-KRWDZBQOSA-N 0 0 372.402 3.920 20 5 FHBDRN CCOC(=O)c1ccnc(Nc2cccc(COC(C)C)c2)c1[N+](=O)[O-] ZINC000523085519 946475281 /nfs/dbraw/zinc/47/52/81/946475281.db2.gz GSVMCDSHXSJKNO-UHFFFAOYSA-N 0 0 359.382 3.835 20 5 FHBDRN Cc1ccc([C@H](C)N(C)C(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)cc1 ZINC000111560945 946481133 /nfs/dbraw/zinc/48/11/33/946481133.db2.gz MQSPEHUXHHALLG-ZDUSSCGKSA-N 0 0 365.389 3.578 20 5 FHBDRN CCNC(=O)c1ccc(NC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000048117199 946502882 /nfs/dbraw/zinc/50/28/82/946502882.db2.gz OCLLEDAPJXKMNX-CYBMUJFWSA-N 0 0 370.409 3.536 20 5 FHBDRN CSc1cccc(C(=O)Nc2ccc(-n3cccn3)cc2)c1[N+](=O)[O-] ZINC000186131459 946506955 /nfs/dbraw/zinc/50/69/55/946506955.db2.gz VFKNRYLBFSGGEK-UHFFFAOYSA-N 0 0 354.391 3.755 20 5 FHBDRN O=[N+]([O-])c1ccccc1NCc1nc(Cc2c[nH]c3ccc(F)cc23)no1 ZINC000545752783 946530183 /nfs/dbraw/zinc/53/01/83/946530183.db2.gz WWXQSHUAYBWGKG-UHFFFAOYSA-N 0 0 367.340 3.801 20 5 FHBDRN CCC(=O)Nc1ccc(NC(=O)c2cccc(SC)c2[N+](=O)[O-])cc1 ZINC000186155614 946538246 /nfs/dbraw/zinc/53/82/46/946538246.db2.gz JYSGOJVVNOSUBO-UHFFFAOYSA-N 0 0 359.407 3.918 20 5 FHBDRN COc1c(C(=O)NC[C@H]2CCCO[C@@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000475163113 946538274 /nfs/dbraw/zinc/53/82/74/946538274.db2.gz FPLUBOSTDYJJLD-CRAIPNDOSA-N 0 0 370.405 3.501 20 5 FHBDRN O=[N+]([O-])c1cccc([C@H](N[C@H](CCO)c2ccco2)c2ccccc2)c1 ZINC000186555443 946551858 /nfs/dbraw/zinc/55/18/58/946551858.db2.gz WLBFKOJPMWUXPS-UYAOXDASSA-N 0 0 352.390 3.991 20 5 FHBDRN Cc1ccc2c(CCNC(=O)c3cccc(C)c3[N+](=O)[O-])cn(C)c2c1 ZINC000186556513 946552202 /nfs/dbraw/zinc/55/22/02/946552202.db2.gz XQJMSNWFGKHNKN-UHFFFAOYSA-N 0 0 351.406 3.676 20 5 FHBDRN CC(C)c1ncc(CN(C)C(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)cn1 ZINC000441403787 946554274 /nfs/dbraw/zinc/55/42/74/946554274.db2.gz LYAMXGQVWCOISK-CYBMUJFWSA-N 0 0 374.466 3.647 20 5 FHBDRN C[C@H](CNC(=O)N1CCC(c2ccccn2)CC1)c1ccccc1[N+](=O)[O-] ZINC000897062386 946555759 /nfs/dbraw/zinc/55/57/59/946555759.db2.gz UJHHJVNICUOFDX-OAHLLOKOSA-N 0 0 368.437 3.683 20 5 FHBDRN C[C@H](CNC(=O)N1CC[C@H](C(F)(F)F)[C@H]1C)c1ccccc1[N+](=O)[O-] ZINC000897064732 946557728 /nfs/dbraw/zinc/55/77/28/946557728.db2.gz WNIZINAQBPJWII-WZRBSPASSA-N 0 0 359.348 3.681 20 5 FHBDRN Cc1csc(C(C)(C)NC(=O)NC[C@H](C)c2ccccc2[N+](=O)[O-])n1 ZINC000897068425 946562166 /nfs/dbraw/zinc/56/21/66/946562166.db2.gz MWWNYQBCALBQQV-NSHDSACASA-N 0 0 362.455 3.698 20 5 FHBDRN C[C@@H](CNC(=O)N(C)[C@@H](C)c1cccc(O)c1)c1ccccc1[N+](=O)[O-] ZINC000897070968 946566907 /nfs/dbraw/zinc/56/69/07/946566907.db2.gz KUGOAPFDYHAXOM-KBPBESRZSA-N 0 0 357.410 3.807 20 5 FHBDRN Cc1cn(-c2cccc(NCC=Cc3ccccc3[N+](=O)[O-])c2)c(=O)[nH]1 ZINC000475517177 946568256 /nfs/dbraw/zinc/56/82/56/946568256.db2.gz RNRKCXIQOPYCAH-FNORWQNLSA-N 0 0 350.378 3.920 20 5 FHBDRN O=[N+]([O-])c1sc(CN[C@H]2CCCc3cccnc32)cc1Br ZINC000897072494 946569937 /nfs/dbraw/zinc/56/99/37/946569937.db2.gz QPZOGVKXDRWGIM-LBPRGKRZSA-N 0 0 368.256 3.981 20 5 FHBDRN CC(C)N(Cc1c([N+](=O)[O-])ncn1C)Cc1ccc(Br)cc1 ZINC000475524160 946576109 /nfs/dbraw/zinc/57/61/09/946576109.db2.gz GKVCBICFKYIJQR-UHFFFAOYSA-N 0 0 367.247 3.501 20 5 FHBDRN C[C@@H]1CC[C@@H](NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)[C@H](C)C1 ZINC001126139346 946596915 /nfs/dbraw/zinc/59/69/15/946596915.db2.gz OUSCPGLMKCVUIT-GPCCPHFNSA-N 0 0 355.232 3.912 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)CCc1cccn1C ZINC000159147746 946600002 /nfs/dbraw/zinc/60/00/02/946600002.db2.gz WUISWVPTIUKIET-ZDUSSCGKSA-N 0 0 361.467 3.796 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N1CCO[C@H](c2cccc(Cl)c2)C1 ZINC000186209875 946610227 /nfs/dbraw/zinc/61/02/27/946610227.db2.gz OIIOIOLRERMOQO-KRWDZBQOSA-N 0 0 360.797 3.770 20 5 FHBDRN CSc1cccc(C(=O)N2CCC(OCC(C)C)CC2)c1[N+](=O)[O-] ZINC000186212074 946610353 /nfs/dbraw/zinc/61/03/53/946610353.db2.gz WBKRQXQHECAILE-UHFFFAOYSA-N 0 0 352.456 3.594 20 5 FHBDRN O=C(N[C@@H](c1ccccc1)C1(CO)CCCC1)c1cc(F)cc([N+](=O)[O-])c1 ZINC001143517744 946620555 /nfs/dbraw/zinc/62/05/55/946620555.db2.gz WGIDXZWPJFWKAW-SFHVURJKSA-N 0 0 372.396 3.758 20 5 FHBDRN CSc1cccc(C(=O)NC[C@@H](C)Oc2ccc(C)cc2)c1[N+](=O)[O-] ZINC000186594066 946635377 /nfs/dbraw/zinc/63/53/77/946635377.db2.gz XBLBIOZKXISGBS-CYBMUJFWSA-N 0 0 360.435 3.822 20 5 FHBDRN CSc1ccc(Cl)cc1NC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 ZINC000102242234 946636378 /nfs/dbraw/zinc/63/63/78/946636378.db2.gz LIFBXMOWZIHIBY-UHFFFAOYSA-N 0 0 354.819 3.540 20 5 FHBDRN COc1c(C(=O)Nc2ccc(Br)cc2)cccc1[N+](=O)[O-] ZINC000137551739 946649381 /nfs/dbraw/zinc/64/93/81/946649381.db2.gz ZJPOZZDZWSANBU-UHFFFAOYSA-N 0 0 351.156 3.618 20 5 FHBDRN O=C(O[C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1)c1cc2ccccc2o1 ZINC000759927268 946673034 /nfs/dbraw/zinc/67/30/34/946673034.db2.gz CTXSKXXNJAHHOK-UKRRQHHQSA-N 0 0 355.350 3.878 20 5 FHBDRN COc1ccccc1CC(C)(C)C(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000112575385 946674674 /nfs/dbraw/zinc/67/46/74/946674674.db2.gz RFNFSYWPJIOOOR-UHFFFAOYSA-N 0 0 356.422 3.531 20 5 FHBDRN Cc1cccc(F)c1S(=O)(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000475565620 946677940 /nfs/dbraw/zinc/67/79/40/946677940.db2.gz DXCPCFCOGLOYKR-UHFFFAOYSA-N 0 0 366.414 3.642 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N(C)Cc2cc(Cl)ccc2OC)c1 ZINC000067541530 946709089 /nfs/dbraw/zinc/70/90/89/946709089.db2.gz RTKRVGCDEKBNAR-UHFFFAOYSA-N 0 0 364.785 3.538 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)N2CC[C@@H](c3nccs3)C2)cc1[N+](=O)[O-] ZINC000893523182 946715554 /nfs/dbraw/zinc/71/55/54/946715554.db2.gz IYOSKFVJFGAFSB-CYBMUJFWSA-N 0 0 359.451 3.979 20 5 FHBDRN CCO[C@@H]1C[C@@H](NC(=O)c2cccc(SC)c2[N+](=O)[O-])C12CCCC2 ZINC000186617950 946718582 /nfs/dbraw/zinc/71/85/82/946718582.db2.gz DPSBWFSKCMUNML-HUUCEWRRSA-N 0 0 364.467 3.784 20 5 FHBDRN CCc1ccc([C@H](Nc2cnn(CCOC)c2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000544386439 946722782 /nfs/dbraw/zinc/72/27/82/946722782.db2.gz POKMIZALUQXFMF-LJQANCHMSA-N 0 0 370.409 3.795 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(N3CCCC3)c(C)c2)c1 ZINC000067542809 946737048 /nfs/dbraw/zinc/73/70/48/946737048.db2.gz NAVYFTMRYKTSMV-UHFFFAOYSA-N 0 0 355.394 3.764 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)c2cc(-c3ccccc3)nn2C)cc1[N+](=O)[O-] ZINC001126610449 946737090 /nfs/dbraw/zinc/73/70/90/946737090.db2.gz AYWFMJRXLKHGGH-CQSZACIVSA-N 0 0 364.405 3.795 20 5 FHBDRN CCc1nc2cc(NC(=O)N3CCc4ccc([N+](=O)[O-])cc4C3)ccc2o1 ZINC000088389461 946738150 /nfs/dbraw/zinc/73/81/50/946738150.db2.gz BMZOXCHSYODOGL-UHFFFAOYSA-N 0 0 366.377 3.889 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N(C)CCCC(=O)OC(C)(C)C ZINC000475581781 946747295 /nfs/dbraw/zinc/74/72/95/946747295.db2.gz HAPKUHJLGQKTGH-UHFFFAOYSA-N 0 0 365.430 3.797 20 5 FHBDRN COc1cc(OC)c(NC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1F ZINC000088402668 946748464 /nfs/dbraw/zinc/74/84/64/946748464.db2.gz HBQQJXGAQHBBDQ-JTQLQIEISA-N 0 0 363.345 3.634 20 5 FHBDRN Cc1ccc(-c2cnc(NC(=O)c3cc([N+](=O)[O-])cn3C)s2)c(C)c1 ZINC000546010527 946748623 /nfs/dbraw/zinc/74/86/23/946748623.db2.gz QTXJVMJTPMBNRX-UHFFFAOYSA-N 0 0 356.407 3.926 20 5 FHBDRN O=C(Nc1ccc2nccnc2c1Br)c1ccc([N+](=O)[O-])cc1 ZINC000323639497 946748927 /nfs/dbraw/zinc/74/89/27/946748927.db2.gz RNMNVUXAVIJRPB-UHFFFAOYSA-N 0 0 373.166 3.553 20 5 FHBDRN Cc1c2ccccc2oc1[C@H](NC(=O)CCn1cc([N+](=O)[O-])cn1)C(C)C ZINC000112187108 946758337 /nfs/dbraw/zinc/75/83/37/946758337.db2.gz UQDRUCYFFJUGBY-GOSISDBHSA-N 0 0 370.409 3.750 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)c2cnc(N(C)C)c(Cl)c2)cc1[N+](=O)[O-] ZINC001126610877 946758729 /nfs/dbraw/zinc/75/87/29/946758729.db2.gz MECNCMSGGQWIPH-NSHDSACASA-N 0 0 362.817 3.509 20 5 FHBDRN CN(C(=O)CNc1cc([N+](=O)[O-])ccc1Sc1cccs1)C1CC1 ZINC000151998221 946771041 /nfs/dbraw/zinc/77/10/41/946771041.db2.gz HIWUECKDIOLODB-UHFFFAOYSA-N 0 0 363.464 3.840 20 5 FHBDRN Cc1cccc(C(=O)N2C[C@@H](C)O[C@@H](c3ccc(F)cc3)C2)c1[N+](=O)[O-] ZINC000151994049 946771322 /nfs/dbraw/zinc/77/13/22/946771322.db2.gz ZTFYUHSKODAQNE-CXAGYDPISA-N 0 0 358.369 3.645 20 5 FHBDRN CCN(Cc1ccc(OC)cc1OC)C(=O)Nc1ccc(C)c([N+](=O)[O-])c1 ZINC000519905629 946774986 /nfs/dbraw/zinc/77/49/86/946774986.db2.gz YACUWIFJQHIXMI-UHFFFAOYSA-N 0 0 373.409 3.974 20 5 FHBDRN O=C1C(=CC=Cc2ccccc2[N+](=O)[O-])NC(=S)N1c1ccccc1F ZINC000208914095 946776206 /nfs/dbraw/zinc/77/62/06/946776206.db2.gz ZLGOROYLCRPRCK-DBGNTTOUSA-N 0 0 369.377 3.552 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](c2nc3ccccc3[nH]2)C(C)C)c1 ZINC000067548585 946827974 /nfs/dbraw/zinc/82/79/74/946827974.db2.gz SLUAXGUFAJTUGL-QGZVFWFLSA-N 0 0 368.393 3.607 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](C)c2cccc(OC(C)C)c2)c1 ZINC000067548835 946829160 /nfs/dbraw/zinc/82/91/60/946829160.db2.gz ZLZFTABHMGCDGP-ZDUSSCGKSA-N 0 0 358.394 3.882 20 5 FHBDRN Cc1ccccc1N1C(=O)C(=CC=Cc2ccccc2[N+](=O)[O-])NC1=S ZINC000208924240 946833438 /nfs/dbraw/zinc/83/34/38/946833438.db2.gz SIVBOTWXNCWWPK-ZLRVCTSNSA-N 0 0 365.414 3.722 20 5 FHBDRN COc1c(C)cnc(CN(C)C(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)c1C ZINC000184482434 946834691 /nfs/dbraw/zinc/83/46/91/946834691.db2.gz IYMNKTQTVCTHDM-UHFFFAOYSA-N 0 0 372.425 3.896 20 5 FHBDRN Cc1sc(C(=O)N2CCc3ccc(Br)cc32)cc1[N+](=O)[O-] ZINC000112265896 946835279 /nfs/dbraw/zinc/83/52/79/946835279.db2.gz XRISQYVILBHKGW-UHFFFAOYSA-N 0 0 367.224 3.930 20 5 FHBDRN O=[N+]([O-])c1ccc(S(=O)(=O)Nc2c(F)cc(Cl)cc2Cl)s1 ZINC000186672147 946835268 /nfs/dbraw/zinc/83/52/68/946835268.db2.gz AIDKLBWAPYRJCF-UHFFFAOYSA-N 0 0 371.198 3.903 20 5 FHBDRN COc1cc(NCc2cn(C)nc2-c2ccccc2)c([N+](=O)[O-])cc1F ZINC000302161193 946861158 /nfs/dbraw/zinc/86/11/58/946861158.db2.gz JUCJMCGHTCESSM-UHFFFAOYSA-N 0 0 356.357 3.755 20 5 FHBDRN C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)CC[C@@H]1O ZINC000186685393 946862232 /nfs/dbraw/zinc/86/22/32/946862232.db2.gz JEGRPJMZKUBKLF-DYVFJYSZSA-N 0 0 372.446 3.589 20 5 FHBDRN C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)CC[C@H]1O ZINC000186685447 946862439 /nfs/dbraw/zinc/86/24/39/946862439.db2.gz JEGRPJMZKUBKLF-SUMWQHHRSA-N 0 0 372.446 3.589 20 5 FHBDRN CCOC[C@@H](NC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C)C(C)C ZINC000473956758 946880652 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372.711 3.867 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1)N1CCC[C@@H](C(=O)c2ccc(F)cc2)C1 ZINC000121294572 947299229 /nfs/dbraw/zinc/29/92/29/947299229.db2.gz KLZDBYCXQZSLGS-CQSZACIVSA-N 0 0 371.368 3.861 20 5 FHBDRN CCN(CCNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1)c1cccc(C)c1 ZINC000523484425 947301226 /nfs/dbraw/zinc/30/12/26/947301226.db2.gz GSSAYWBVGBPYRW-UHFFFAOYSA-N 0 0 369.465 3.824 20 5 FHBDRN CC(C)(C(=O)Nc1cccc(N2CCCC2=O)c1)c1ccc([N+](=O)[O-])cc1 ZINC000523485268 947302340 /nfs/dbraw/zinc/30/23/40/947302340.db2.gz OOHXJCJKVMUHGB-UHFFFAOYSA-N 0 0 367.405 3.638 20 5 FHBDRN CCOc1ccc(C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)cc1OC ZINC000523498997 947306051 /nfs/dbraw/zinc/30/60/51/947306051.db2.gz QIANPBNRQUNODR-UHFFFAOYSA-N 0 0 372.421 3.755 20 5 FHBDRN COc1ccccc1[C@H]1CCN(C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000523489124 947306520 /nfs/dbraw/zinc/30/65/20/947306520.db2.gz SERXBQXYLVSFOZ-HNNXBMFYSA-N 0 0 368.433 3.897 20 5 FHBDRN COc1c(F)cc(-n2c3ccccc3cc3c(=O)c(N)ccc2-3)cc1F ZINC001211687136 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COCc1nc(CNc2ncccc2[N+](=O)[O-])c(-c2ccccc2)s1 ZINC000440644321 947504686 /nfs/dbraw/zinc/50/46/86/947504686.db2.gz OBOWBEPFVNBXBP-UHFFFAOYSA-N 0 0 356.407 3.872 20 5 FHBDRN Cn1cc(-c2ccnc(/C=C/c3cc([N+](=O)[O-])ccc3OC(F)F)n2)cn1 ZINC000093902932 947512309 /nfs/dbraw/zinc/51/23/09/947512309.db2.gz IFGJBCXXGMCIQI-GORDUTHDSA-N 0 0 373.319 3.557 20 5 FHBDRN CC[C@H](C)[C@H](CNC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C)OC ZINC000458959110 947526518 /nfs/dbraw/zinc/52/65/18/947526518.db2.gz FSEVOAMHFZNQMU-YOEHRIQHSA-N 0 0 351.447 3.576 20 5 FHBDRN CC(C)c1ccc([C@@H]2CCCN2C(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)cc1 ZINC000445145250 947536758 /nfs/dbraw/zinc/53/67/58/947536758.db2.gz UHEKGMQEUQYXBZ-INIZCTEOSA-N 0 0 355.394 3.796 20 5 FHBDRN Cc1ccccc1[C@H]1CN(CCOc2ccccc2[N+](=O)[O-])[C@H](C)CO1 ZINC000441454445 947537459 /nfs/dbraw/zinc/53/74/59/947537459.db2.gz SSARTGNJSQMQOW-OXQOHEQNSA-N 0 0 356.422 3.744 20 5 FHBDRN Cc1ccccc1[C@@H]1CN(CCOc2ccccc2[N+](=O)[O-])[C@@H](C)CO1 ZINC000441454435 947537551 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FHBDRN CCCC1(CNC(=O)Cc2ccc([N+](=O)[O-])cc2Br)CC1 ZINC000152081460 947621574 /nfs/dbraw/zinc/62/15/74/947621574.db2.gz NCOMOZMSUPIBBN-UHFFFAOYSA-N 0 0 355.232 3.596 20 5 FHBDRN COc1ccc(Br)c(OCCOc2ccccc2[N+](=O)[O-])c1 ZINC000432302810 947623830 /nfs/dbraw/zinc/62/38/30/947623830.db2.gz OJPUVGZWPYFYFX-UHFFFAOYSA-N 0 0 368.183 3.824 20 5 FHBDRN CCc1nc(CN(C)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)cs1 ZINC000536353361 947666478 /nfs/dbraw/zinc/66/64/78/947666478.db2.gz IQIYMDQZUVZREM-UHFFFAOYSA-N 0 0 358.423 3.901 20 5 FHBDRN Cc1c(NC(=O)C(=O)Nc2cccc(OCC(C)C)c2)cccc1[N+](=O)[O-] ZINC000125753138 947676414 /nfs/dbraw/zinc/67/64/14/947676414.db2.gz NUHONBSLNUQYLX-UHFFFAOYSA-N 0 0 371.393 3.515 20 5 FHBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])NCc1ccccc1Cl ZINC000523884599 947709520 /nfs/dbraw/zinc/70/95/20/947709520.db2.gz WDQXWTOZEWFLNW-UHFFFAOYSA-N 0 0 369.204 3.987 20 5 FHBDRN CCc1ccc(-c2nc(CC(=O)Nc3ccccc3F)no2)cc1[N+](=O)[O-] ZINC000445303551 947710358 /nfs/dbraw/zinc/71/03/58/947710358.db2.gz RPHFRRSNZICVPN-UHFFFAOYSA-N 0 0 370.340 3.528 20 5 FHBDRN Cc1cccc(NC(=O)Cc2noc(/C=C/c3ccc([N+](=O)[O-])cc3)n2)c1 ZINC000445326044 947715057 /nfs/dbraw/zinc/71/50/57/947715057.db2.gz ATUNPWPEGRDSLH-JXMROGBWSA-N 0 0 364.361 3.638 20 5 FHBDRN COc1ccc(CNC(=O)N2CCC[C@@H](C(C)(C)C)CC2)cc1[N+](=O)[O-] ZINC000523917794 947715378 /nfs/dbraw/zinc/71/53/78/947715378.db2.gz BVUOELAFGOTMRS-OAHLLOKOSA-N 0 0 363.458 3.961 20 5 FHBDRN Cc1cccc(NC(=O)Cc2noc(/C=C\c3cccc([N+](=O)[O-])c3)n2)c1 ZINC000445328111 947716406 /nfs/dbraw/zinc/71/64/06/947716406.db2.gz NBVLLAUMZLYCPY-HJWRWDBZSA-N 0 0 364.361 3.638 20 5 FHBDRN Cc1cc(Br)cc(C(=O)N(C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000184580967 947723682 /nfs/dbraw/zinc/72/36/82/947723682.db2.gz HVDDHANOHCKQLO-UHFFFAOYSA-N 0 0 363.211 3.938 20 5 FHBDRN CC(C)(NC(=O)Nc1ccncc1[N+](=O)[O-])c1cccc(Cl)c1F ZINC000184581414 947724402 /nfs/dbraw/zinc/72/44/02/947724402.db2.gz LJHYRYHSVQVDRS-UHFFFAOYSA-N 0 0 352.753 3.839 20 5 FHBDRN Cc1cc(-c2nc(CC(=O)Nc3c(C)cccc3C)no2)cc([N+](=O)[O-])c1 ZINC000445320100 947724461 /nfs/dbraw/zinc/72/44/61/947724461.db2.gz MFKDVIUAHQVSQM-UHFFFAOYSA-N 0 0 366.377 3.751 20 5 FHBDRN C[C@H](Cc1ccccc1)C(=O)O[C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000759938643 947725280 /nfs/dbraw/zinc/72/52/80/947725280.db2.gz LIRMMXAZSMIUDA-DJIMGWMZSA-N 0 0 357.410 3.697 20 5 FHBDRN Cc1cccc(C)c1NC(=O)Cc1noc(-c2ccc([N+](=O)[O-])s2)n1 ZINC000445332513 947731248 /nfs/dbraw/zinc/73/12/48/947731248.db2.gz IHICJCNSBNSIPW-UHFFFAOYSA-N 0 0 358.379 3.504 20 5 FHBDRN Cc1c(Cl)cccc1NC(=O)Cc1noc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000445332012 947732595 /nfs/dbraw/zinc/73/25/95/947732595.db2.gz NBBNDQUCYIYLJL-UHFFFAOYSA-N 0 0 372.768 3.788 20 5 FHBDRN Cc1ccc(NC(=O)Cc2noc(-c3cc(C)cc([N+](=O)[O-])c3)n2)c(C)c1 ZINC000445357309 947751381 /nfs/dbraw/zinc/75/13/81/947751381.db2.gz OWJFRHGTGUBARK-UHFFFAOYSA-N 0 0 366.377 3.751 20 5 FHBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(Oc2cccc(C(F)(F)F)c2)s1 ZINC000302157189 947770715 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3.741 20 5 FHBDRN Cc1ccc(NC(=O)[C@@H](C)OC(=O)c2ccc([N+](=O)[O-])cc2C)cc1F ZINC000725986640 947829973 /nfs/dbraw/zinc/82/99/73/947829973.db2.gz APISXWVPQGXMDQ-GFCCVEGCSA-N 0 0 360.341 3.535 20 5 FHBDRN Cc1cc(C(=O)O[C@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)c(F)cc1F ZINC000759943271 947842725 /nfs/dbraw/zinc/84/27/25/947842725.db2.gz QYQMGLWDERUCGQ-GJZGRUSLSA-N 0 0 365.336 3.719 20 5 FHBDRN COc1ccc([C@@H]2CCCN2C(=O)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)nc1 ZINC000895067797 947865069 /nfs/dbraw/zinc/86/50/69/947865069.db2.gz VQSWFRWIGDPPRT-UGSOOPFHSA-N 0 0 370.409 3.606 20 5 FHBDRN Cc1c(C(=O)N[C@H](C)c2nc(C(F)(F)F)cs2)cccc1[N+](=O)[O-] ZINC000278867428 947870016 /nfs/dbraw/zinc/87/00/16/947870016.db2.gz YJTOKGFKABHMIA-MRVPVSSYSA-N 0 0 359.329 3.870 20 5 FHBDRN C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CC[C@@H](CC(F)(F)F)C1 ZINC000278870507 947898920 /nfs/dbraw/zinc/89/89/20/947898920.db2.gz SOFUDTVCHFJJDT-MNOVXSKESA-N 0 0 370.331 3.980 20 5 FHBDRN C[C@H]1CN(C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC(C)(C)O1 ZINC000184615599 947902123 /nfs/dbraw/zinc/90/21/23/947902123.db2.gz LVORRCZYCJNIMN-VIFPVBQESA-N 0 0 361.320 3.645 20 5 FHBDRN Cc1c(CC(=O)NCC2(Cc3ccc(F)cc3)CC2)cccc1[N+](=O)[O-] ZINC000536388544 947949303 /nfs/dbraw/zinc/94/93/03/947949303.db2.gz YMUREWDCRLGYSW-UHFFFAOYSA-N 0 0 356.397 3.724 20 5 FHBDRN CC(C)(C)OC(=O)CCC(C)(C)NC(=O)Nc1ccc([N+](=O)[O-])cc1F ZINC000544626290 947969096 /nfs/dbraw/zinc/96/90/96/947969096.db2.gz MBJBPTQQSXXJMR-UHFFFAOYSA-N 0 0 369.393 3.756 20 5 FHBDRN Cc1sc(S(=O)(=O)Oc2c(F)cccc2Cl)cc1[N+](=O)[O-] ZINC000125843624 947994899 /nfs/dbraw/zinc/99/48/99/947994899.db2.gz SXTRWSPXCUENPJ-UHFFFAOYSA-N 0 0 351.764 3.525 20 5 FHBDRN O=[N+]([O-])c1cccc2c(NCCc3nnc(-c4ccccc4)o3)ccnc21 ZINC000432317896 947996645 /nfs/dbraw/zinc/99/66/45/947996645.db2.gz MVQLRVZOAJBNLQ-UHFFFAOYSA-N 0 0 361.361 3.848 20 5 FHBDRN COc1ccc(Cn2cc([N+](=O)[O-])c(C)cc2=O)cc1SC(F)(F)F ZINC000128718046 948033697 /nfs/dbraw/zinc/03/36/97/948033697.db2.gz FFUWODUULOSDGP-UHFFFAOYSA-N 0 0 374.340 3.734 20 5 FHBDRN CCOc1ccc([C@@H](C)NC(=O)c2ccc(OCC)c([N+](=O)[O-])c2)cc1 ZINC000025877689 948036800 /nfs/dbraw/zinc/03/68/00/948036800.db2.gz AKLSLCBFRNSGPH-CYBMUJFWSA-N 0 0 358.394 3.883 20 5 FHBDRN O=C(Nc1cc(C2CCC2)nn1-c1ccccc1)c1ccc([N+](=O)[O-])o1 ZINC000120912100 948040239 /nfs/dbraw/zinc/04/02/39/948040239.db2.gz XNADYOSUQZMOFW-UHFFFAOYSA-N 0 0 352.350 3.893 20 5 FHBDRN O=C(c1ccc(Br)cc1[N+](=O)[O-])N1CCc2cccc(F)c21 ZINC000427582166 948043799 /nfs/dbraw/zinc/04/37/99/948043799.db2.gz DGASNZGFVXNADX-UHFFFAOYSA-N 0 0 365.158 3.699 20 5 FHBDRN C[C@H](Nc1ccnc2c1cccc2[N+](=O)[O-])c1ccc2c(c1)NC(=O)CO2 ZINC000432323498 948047765 /nfs/dbraw/zinc/04/77/65/948047765.db2.gz QVPVLJVJKOHPMY-NSHDSACASA-N 0 0 364.361 3.647 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])Nc1ccc(F)c(Br)c1 ZINC000438588739 948064931 /nfs/dbraw/zinc/06/49/31/948064931.db2.gz QAGVRXOMQVZXIT-UHFFFAOYSA-N 0 0 368.162 3.818 20 5 FHBDRN O=C(Cc1cccc([N+](=O)[O-])c1)N1CCCCC[C@H]1[C@@H]1CCCCC1=O ZINC000164528885 948084350 /nfs/dbraw/zinc/08/43/50/948084350.db2.gz NGTMCPMAZRDHHP-ROUUACIJSA-N 0 0 358.438 3.668 20 5 FHBDRN CCc1ccc(CC)c(NC(=O)c2cn(-c3cccc([N+](=O)[O-])c3)nn2)c1 ZINC000075365725 948116414 /nfs/dbraw/zinc/11/64/14/948116414.db2.gz RSRCIWSHYCVKBA-UHFFFAOYSA-N 0 0 365.393 3.553 20 5 FHBDRN COc1cc(C(=O)N[C@@H]2CCC[C@@H](C)[C@@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000585690210 948138814 /nfs/dbraw/zinc/13/88/14/948138814.db2.gz RTXGCTULSSTJJM-JFGNBEQYSA-N 0 0 372.368 3.759 20 5 FHBDRN COc1cc(OC)c(CNc2c(Cl)cccc2[N+](=O)[O-])c(OC)c1 ZINC000432334318 948142078 /nfs/dbraw/zinc/14/20/78/948142078.db2.gz FSTMFQFIRGAQSG-UHFFFAOYSA-N 0 0 352.774 3.886 20 5 FHBDRN C[C@H]1CC(=O)Oc2cc(OC(=O)C(C)(C)c3ccc([N+](=O)[O-])cc3)ccc21 ZINC000785364349 948144666 /nfs/dbraw/zinc/14/46/66/948144666.db2.gz HOZLCFXFHHWPNN-LBPRGKRZSA-N 0 0 369.373 3.891 20 5 FHBDRN CCCCN(C)C(=O)C1CCN(c2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000432336767 948148046 /nfs/dbraw/zinc/14/80/46/948148046.db2.gz PYQYSGKVMKGYPM-UHFFFAOYSA-N 0 0 353.850 3.723 20 5 FHBDRN CSC(C)(C)CNC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000075364412 948149129 /nfs/dbraw/zinc/14/91/29/948149129.db2.gz IVVREJZQKMRJMK-UHFFFAOYSA-N 0 0 351.453 3.590 20 5 FHBDRN O=[N+]([O-])c1cccc2c(N[C@@H](CO)Cc3c[nH]c4ccccc34)ccnc21 ZINC000432339657 948154130 /nfs/dbraw/zinc/15/41/30/948154130.db2.gz JEGMBQOZTQNJQG-CQSZACIVSA-N 0 0 362.389 3.640 20 5 FHBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NC1CCC(F)(F)CC1 ZINC000536436352 948156781 /nfs/dbraw/zinc/15/67/81/948156781.db2.gz OPQPXARHKSDQPY-VIFPVBQESA-N 0 0 362.760 3.710 20 5 FHBDRN COc1cc(OC)cc(OCCNc2ccnc3c2cccc3[N+](=O)[O-])c1 ZINC000432340460 948158947 /nfs/dbraw/zinc/15/89/47/948158947.db2.gz YSRVNHITXASMPC-UHFFFAOYSA-N 0 0 369.377 3.651 20 5 FHBDRN COc1ccc(OCc2noc(/C=C/c3cccc([N+](=O)[O-])c3)n2)cc1 ZINC000546296430 948163691 /nfs/dbraw/zinc/16/36/91/948163691.db2.gz WFAMXEXWOZHAEO-BJMVGYQFSA-N 0 0 353.334 3.736 20 5 FHBDRN CC[C@@H]1CCCCN1C(=O)c1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000585696874 948164430 /nfs/dbraw/zinc/16/44/30/948164430.db2.gz HHPHFHQWIBRMMK-SNVBAGLBSA-N 0 0 358.341 3.610 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(NCc2ccsc2Br)c1 ZINC000388553582 948170437 /nfs/dbraw/zinc/17/04/37/948170437.db2.gz UMVWJINTONIJII-UHFFFAOYSA-N 0 0 371.212 3.818 20 5 FHBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N[C@H]1CCC(F)(F)C1 ZINC000585701251 948183833 /nfs/dbraw/zinc/18/38/33/948183833.db2.gz ZKHUWTDRIAALCH-QMMMGPOBSA-N 0 0 363.158 3.583 20 5 FHBDRN O=C(NCc1coc(-c2ccccc2)n1)[C@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1 ZINC001126298608 948204803 /nfs/dbraw/zinc/20/48/03/948204803.db2.gz PFHBOJBZQLXFDJ-MSOLQXFVSA-N 0 0 363.373 3.670 20 5 FHBDRN COc1cc(C(=O)Nc2cnn(-c3ccccc3Cl)c2)ccc1[N+](=O)[O-] ZINC000106671230 948213648 /nfs/dbraw/zinc/21/36/48/948213648.db2.gz SSJXRIMLFCHSCI-UHFFFAOYSA-N 0 0 372.768 3.695 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(Cc1cccs1)C(C)C ZINC000512031892 948235965 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FHBDRN COc1ccc(Cl)cc1NC(=O)COc1ccc([N+](=O)[O-])cc1C ZINC000001284412 219394065 /nfs/dbraw/zinc/39/40/65/219394065.db2.gz ZPEVNJAITOYHLF-UHFFFAOYSA-N 0 0 350.758 3.583 20 5 FHBDRN CCOC(=O)c1cc(CC)sc1NC(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000001946318 219423045 /nfs/dbraw/zinc/42/30/45/219423045.db2.gz FFTWRQUWFLDWHI-UHFFFAOYSA-N 0 0 362.407 3.956 20 5 FHBDRN COc1ccc(Cl)c(NC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)c1 ZINC000064829159 212045002 /nfs/dbraw/zinc/04/50/02/212045002.db2.gz GXXFJDYYGMFTNV-UHFFFAOYSA-N 0 0 372.768 3.695 20 5 FHBDRN C[C@@H](Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C(=O)NCc1ccccc1 ZINC000069147099 212029643 /nfs/dbraw/zinc/02/96/43/212029643.db2.gz ZGPYUWGAANQARN-LLVKDONJSA-N 0 0 367.327 3.730 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)Nc1cccc(-c2nccs2)c1 ZINC000047480697 211853621 /nfs/dbraw/zinc/85/36/21/211853621.db2.gz ZLFIKZGWGYPHPD-UHFFFAOYSA-N 0 0 355.375 3.979 20 5 FHBDRN COc1ccc(Br)c(C(=O)Nc2cc([N+](=O)[O-])ccc2C)c1 ZINC000019160911 220238882 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CC(C)c1ccc(NC(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])cc1 ZINC000015509065 211131172 /nfs/dbraw/zinc/13/11/72/211131172.db2.gz HSJVZUJXLZYBJD-UHFFFAOYSA-N 0 0 373.434 3.548 20 5 FHBDRN Cc1cc(C(=O)NCCc2ccc(C(F)(F)F)cc2)ccc1[N+](=O)[O-] ZINC000015439966 211130658 /nfs/dbraw/zinc/13/06/58/211130658.db2.gz UWMKUJYCDSFNOM-UHFFFAOYSA-N 0 0 352.312 3.895 20 5 FHBDRN CC(C)(C)NC(=O)c1ccc(NC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)cc1 ZINC000014836860 211103049 /nfs/dbraw/zinc/10/30/49/211103049.db2.gz RUGPVLDIWBENHS-AWNIVKPZSA-N 0 0 367.405 3.775 20 5 FHBDRN COc1ccc(Cl)cc1NC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1 ZINC000014463172 211093409 /nfs/dbraw/zinc/09/34/09/211093409.db2.gz VKOVLYMNOIOPER-UHFFFAOYSA-N 0 0 365.729 3.726 20 5 FHBDRN CCOC(=O)c1c(C2CC2)csc1NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000014687341 211097577 /nfs/dbraw/zinc/09/75/77/211097577.db2.gz OLPXKCRAMMVZND-UHFFFAOYSA-N 0 0 360.391 3.963 20 5 FHBDRN COC(=O)c1ccsc1NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000004281371 210520557 /nfs/dbraw/zinc/52/05/57/210520557.db2.gz GZUVVYGKMSNUEM-UHFFFAOYSA-N 0 0 362.388 3.910 20 5 FHBDRN Cc1cc(OCC(=O)c2ccc(Br)cc2)ccc1[N+](=O)[O-] ZINC000021587477 220360777 /nfs/dbraw/zinc/36/07/77/220360777.db2.gz JYROIJNCRPJPKR-UHFFFAOYSA-N 0 0 350.168 3.927 20 5 FHBDRN CSc1ccc(C(=O)Nc2ccc(F)c(NC(C)=O)c2)cc1[N+](=O)[O-] ZINC000025472598 220489264 /nfs/dbraw/zinc/48/92/64/220489264.db2.gz LQBZOBNEERNQHV-UHFFFAOYSA-N 0 0 363.370 3.667 20 5 FHBDRN CSc1ccccc1NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000042201076 220936209 /nfs/dbraw/zinc/93/62/09/220936209.db2.gz CAKPYKUBIYCPAC-UHFFFAOYSA-N 0 0 354.391 3.755 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1F)c1ccc(Br)cc1F ZINC000043474478 220948468 /nfs/dbraw/zinc/94/84/68/220948468.db2.gz LARGBPSVCAXHQN-UHFFFAOYSA-N 0 0 357.110 3.888 20 5 FHBDRN Cc1nc(S[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)oc1C ZINC000055236838 221063726 /nfs/dbraw/zinc/06/37/26/221063726.db2.gz NBFZMNCCHDNNLI-VIFPVBQESA-N 0 0 355.803 3.972 20 5 FHBDRN COc1ccc(C(=O)Nc2nc3c(s2)CCCCCC3)cc1[N+](=O)[O-] ZINC000072021157 221397437 /nfs/dbraw/zinc/39/74/37/221397437.db2.gz RZOXNYONGUKNBG-UHFFFAOYSA-N 0 0 361.423 3.971 20 5 FHBDRN C[C@H]1C[C@H](C)CN(c2ccc(C(=O)Nc3nccs3)cc2[N+](=O)[O-])C1 ZINC000025966584 132306941 /nfs/dbraw/zinc/30/69/41/132306941.db2.gz ORIXZZAQUACVSA-RYUDHWBXSA-N 0 0 360.439 3.786 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCCc2cc(C)ccc21 ZINC000072043237 136141690 /nfs/dbraw/zinc/14/16/90/136141690.db2.gz KRYOSDWSTLBRKN-UHFFFAOYSA-N 0 0 360.435 3.607 20 5 FHBDRN Cc1nc2ccccc2c(S[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)n1 ZINC000097605448 222198946 /nfs/dbraw/zinc/19/89/46/222198946.db2.gz HVPBGPCLDSDLCC-LLVKDONJSA-N 0 0 368.418 3.966 20 5 FHBDRN O=C(NCc1nnc(-c2ccccc2)s1)Nc1ccc([N+](=O)[O-])cc1F ZINC000541784960 567820905 /nfs/dbraw/zinc/82/09/05/567820905.db2.gz OLJJTBKKKCCNBB-UHFFFAOYSA-N 0 0 373.369 3.574 20 5 FHBDRN CCOc1cccc([C@H]2C[C@H]2NC(=O)Nc2ccc([N+](=O)[O-])cc2F)c1 ZINC000541785531 567823511 /nfs/dbraw/zinc/82/35/11/567823511.db2.gz VVDJMWUYJWDLJL-RHSMWYFYSA-N 0 0 359.357 3.810 20 5 FHBDRN C[C@@H](CC(=O)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1)c1cccnc1 ZINC000452866251 567830048 /nfs/dbraw/zinc/83/00/48/567830048.db2.gz XTCMYYOMNVDDFN-YJBOKZPZSA-N 0 0 353.422 3.890 20 5 FHBDRN CO[C@@H]1CCN(C(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)C[C@H]1C ZINC000452863221 567833930 /nfs/dbraw/zinc/83/39/30/567833930.db2.gz DVWRARPUNSRONS-AUUYWEPGSA-N 0 0 369.421 3.835 20 5 FHBDRN CC(C)(C)c1nnsc1C(=O)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452861729 567835091 /nfs/dbraw/zinc/83/50/91/567835091.db2.gz UJJIZERSDTYZBN-ZDUSSCGKSA-N 0 0 374.466 3.764 20 5 FHBDRN O=C(c1csc(C2CC2)n1)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452863678 567838815 /nfs/dbraw/zinc/83/88/15/567838815.db2.gz VTXPEIAKNHZCJG-AWEZNQCLSA-N 0 0 357.435 3.949 20 5 FHBDRN O=C(NCC1([C@@H]2CCCCO2)CCC1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000601857101 567853171 /nfs/dbraw/zinc/85/31/71/567853171.db2.gz OMYUZRCYZNOZFG-AWEZNQCLSA-N 0 0 352.818 3.717 20 5 FHBDRN O=C(Cc1cccc([N+](=O)[O-])c1)NCc1cc(F)c(C(F)(F)F)cc1F ZINC000568094993 567879121 /nfs/dbraw/zinc/87/91/21/567879121.db2.gz RMKZUKRWYMHJKX-UHFFFAOYSA-N 0 0 374.265 3.751 20 5 FHBDRN CCCN1CCN(C(=O)c2ccc([N+](=O)[O-])c(C)c2)c2ccc(F)cc21 ZINC000481385863 567881789 /nfs/dbraw/zinc/88/17/89/567881789.db2.gz FSQLBGJVHVNETH-UHFFFAOYSA-N 0 0 357.385 3.919 20 5 FHBDRN CC(C)(C)c1ccc(NC(=O)[C@H]2CCN(CC(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000568121087 567884615 /nfs/dbraw/zinc/88/46/15/567884615.db2.gz HTZILUNAYQBXME-NSHDSACASA-N 0 0 373.375 3.715 20 5 FHBDRN COc1ccc(C(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cc1F ZINC000452881067 567885183 /nfs/dbraw/zinc/88/51/83/567885183.db2.gz OONDKHSCPXMTJH-HNNXBMFYSA-N 0 0 358.369 3.762 20 5 FHBDRN Cc1noc(C)c1CCC(=O)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452884412 567885465 /nfs/dbraw/zinc/88/54/65/567885465.db2.gz PWLLDULCRUMRSV-MRXNPFEDSA-N 0 0 357.410 3.538 20 5 FHBDRN COc1ccc(CC(=O)NCc2cc3ccccc3s2)cc1[N+](=O)[O-] ZINC000568116641 567890624 /nfs/dbraw/zinc/89/06/24/567890624.db2.gz KLVPDYDOOJXVJR-UHFFFAOYSA-N 0 0 356.403 3.677 20 5 FHBDRN Cc1cc(C(=O)N[C@@H](C[C@@H]2CCOC2)c2ccccc2)cc([N+](=O)[O-])c1 ZINC000159186612 567907083 /nfs/dbraw/zinc/90/70/83/567907083.db2.gz WZVMZCBEHRLHDE-KXBFYZLASA-N 0 0 354.406 3.801 20 5 FHBDRN O=[N+]([O-])c1ccc(SC[C@H](O)CO[C@@H]2CCCc3ccccc32)nc1 ZINC000159187830 567907657 /nfs/dbraw/zinc/90/76/57/567907657.db2.gz ZYIXJZABAWCNMO-NVXWUHKLSA-N 0 0 360.435 3.537 20 5 FHBDRN C/C=C\c1ccc(OCC(=O)Nc2cccc([N+](=O)[O-])c2C)c(OC)c1 ZINC000213210967 567930190 /nfs/dbraw/zinc/93/01/90/567930190.db2.gz ZDXABXQFSJFLKX-XQRVVYSFSA-N 0 0 356.378 3.962 20 5 FHBDRN C[C@@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])s2)c2ccccc21 ZINC000541826579 567938458 /nfs/dbraw/zinc/93/84/58/567938458.db2.gz ZQXNHUBAXUIYES-LLVKDONJSA-N 0 0 352.437 3.749 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)N2CCC[C@@H](C3CC3)C2)cc1SC ZINC000290993553 567940678 /nfs/dbraw/zinc/94/06/78/567940678.db2.gz VLRCCSKBCNMTKH-GFCCVEGCSA-N 0 0 350.440 3.588 20 5 FHBDRN CCOc1ccc(C(=O)NCc2cccc([N+](=O)[O-])c2C)cc1OCC ZINC000481462694 567957544 /nfs/dbraw/zinc/95/75/44/567957544.db2.gz CVBHWMGYMKKXRR-UHFFFAOYSA-N 0 0 358.394 3.631 20 5 FHBDRN COCc1c2ccccc2oc1C(=O)NCc1cccc([N+](=O)[O-])c1C ZINC000481464219 567964721 /nfs/dbraw/zinc/96/47/21/567964721.db2.gz JBZBDTMVSYEIFQ-UHFFFAOYSA-N 0 0 354.362 3.726 20 5 FHBDRN Cc1c(CNC(=O)CCC(=O)c2ccc3c(c2)CCC3)cccc1[N+](=O)[O-] ZINC000481468938 567966218 /nfs/dbraw/zinc/96/62/18/567966218.db2.gz XMBIHZFBAKAQLW-UHFFFAOYSA-N 0 0 366.417 3.671 20 5 FHBDRN Cc1c(CNC(=O)[C@@H]2C[C@]23CCCc2ccccc23)cccc1[N+](=O)[O-] ZINC000481465713 567967649 /nfs/dbraw/zinc/96/76/49/567967649.db2.gz LKNPKVCQLSYWCW-RXVVDRJESA-N 0 0 350.418 3.814 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)N[C@H]1C[C@H](c2ccc(F)cc2)C1 ZINC000481476537 567972333 /nfs/dbraw/zinc/97/23/33/567972333.db2.gz AGTFKKZYNIAETR-RZDIXWSQSA-N 0 0 371.412 3.988 20 5 FHBDRN CC(C)(CCc1noc([C@@H]2C[C@@H]2c2cc(F)c(F)c(F)c2)n1)[N+](=O)[O-] ZINC000291030664 567972914 /nfs/dbraw/zinc/97/29/14/567972914.db2.gz DYIGPUYNHFISJR-NXEZZACHSA-N 0 0 355.316 3.746 20 5 FHBDRN C[C@H](CNC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)CC(F)(F)F ZINC000412645401 567975244 /nfs/dbraw/zinc/97/52/44/567975244.db2.gz AEHCKVIJLJSXDQ-LBPRGKRZSA-N 0 0 373.375 3.516 20 5 FHBDRN Cc1oc(-c2ccccc2)nc1C(=O)NCc1cccc([N+](=O)[O-])c1C ZINC000481480869 567980302 /nfs/dbraw/zinc/98/03/02/567980302.db2.gz NVHXDBLSXKUUJT-UHFFFAOYSA-N 0 0 351.362 3.797 20 5 FHBDRN Cc1ccc(-c2cc(C(=O)NCc3cccc([N+](=O)[O-])c3C)on2)cc1 ZINC000481477583 567980379 /nfs/dbraw/zinc/98/03/79/567980379.db2.gz HIOJRXAYYHJXDU-UHFFFAOYSA-N 0 0 351.362 3.797 20 5 FHBDRN C[C@@H](CNC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)CC(F)(F)F ZINC000412649025 567982968 /nfs/dbraw/zinc/98/29/68/567982968.db2.gz BWMUVEPIKFGCAS-SSDOTTSWSA-N 0 0 358.238 3.932 20 5 FHBDRN O=C(c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)N1CCC[C@H]1c1ccccc1 ZINC000521423336 567995474 /nfs/dbraw/zinc/99/54/74/567995474.db2.gz NPGABNHSZYCNRQ-IBGZPJMESA-N 0 0 362.389 3.758 20 5 FHBDRN Cc1c(CNC(=O)Cc2coc(-c3ccc(F)cc3)n2)cccc1[N+](=O)[O-] ZINC000481495928 568002461 /nfs/dbraw/zinc/00/24/61/568002461.db2.gz VWYOFTAUDIBTBJ-UHFFFAOYSA-N 0 0 369.352 3.556 20 5 FHBDRN Cc1c(CNC(=O)Cn2ccc3ccc(Cl)cc32)cccc1[N+](=O)[O-] ZINC000481493287 568003123 /nfs/dbraw/zinc/00/31/23/568003123.db2.gz POSNQIVOVMZNOG-UHFFFAOYSA-N 0 0 357.797 3.828 20 5 FHBDRN COc1ccccc1C[C@@H](C)CC(=O)NCc1cccc([N+](=O)[O-])c1C ZINC000481503144 568004323 /nfs/dbraw/zinc/00/43/23/568004323.db2.gz SJNMKZBYACIBEZ-CQSZACIVSA-N 0 0 356.422 3.797 20 5 FHBDRN CC(C)(CCc1noc(COc2ccc(C(F)(F)F)cc2)n1)[N+](=O)[O-] ZINC000291080512 568011603 /nfs/dbraw/zinc/01/16/03/568011603.db2.gz NLWBQNBRDZIQJF-UHFFFAOYSA-N 0 0 359.304 3.655 20 5 FHBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])Nc1ccc2c(c1)COC2 ZINC000481525093 568016563 /nfs/dbraw/zinc/01/65/63/568016563.db2.gz AOZLNBOYHQPFNU-UHFFFAOYSA-N 0 0 361.785 3.643 20 5 FHBDRN C[C@@H](O)C[C@H](CNC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000159229624 568018657 /nfs/dbraw/zinc/01/86/57/568018657.db2.gz FWRUFHYSKAEMCP-TZMCWYRMSA-N 0 0 362.813 3.533 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1F)N1CC[C@@H](Oc2ccc(Cl)cc2)C1 ZINC000568312711 568019326 /nfs/dbraw/zinc/01/93/26/568019326.db2.gz BSTINXJFMQQIGI-CQSZACIVSA-N 0 0 364.760 3.681 20 5 FHBDRN C[C@@H](O)C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000159229319 568023655 /nfs/dbraw/zinc/02/36/55/568023655.db2.gz FWRUFHYSKAEMCP-OCCSQVGLSA-N 0 0 362.813 3.533 20 5 FHBDRN CCOc1ccc(NC(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)cc1F ZINC000568318490 568023977 /nfs/dbraw/zinc/02/39/77/568023977.db2.gz OSMYYFITYXSJGY-UHFFFAOYSA-N 0 0 354.284 3.592 20 5 FHBDRN C[C@@H](C(=O)N1c2ccccc2N(C)CC[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000568348069 568024129 /nfs/dbraw/zinc/02/41/29/568024129.db2.gz PXMWLLWYEUEWFI-HUUCEWRRSA-N 0 0 353.422 3.960 20 5 FHBDRN Cc1c(CNC(=O)[C@H]2C[C@H]2c2cc(F)c(F)c(F)c2)cccc1[N+](=O)[O-] ZINC000481504436 568028612 /nfs/dbraw/zinc/02/86/12/568028612.db2.gz WLSZBKOQEASAFV-STQMWFEESA-N 0 0 364.323 3.740 20 5 FHBDRN CCCCCN1CC(=O)N[C@H]1c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000602759444 568032548 /nfs/dbraw/zinc/03/25/48/568032548.db2.gz UYUOWNZGNYGYNL-GOSISDBHSA-N 0 0 359.451 3.944 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)Nc1ccc(-c2ccccc2)nn1 ZINC000150829114 568033231 /nfs/dbraw/zinc/03/32/31/568033231.db2.gz FPLBAEUSYIHKDZ-UHFFFAOYSA-N 0 0 368.780 3.886 20 5 FHBDRN Cc1cccc(CCSCCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)n1 ZINC000568393494 568036667 /nfs/dbraw/zinc/03/66/67/568036667.db2.gz CZPZLZAYXMAQBF-UHFFFAOYSA-N 0 0 373.434 3.572 20 5 FHBDRN CCOC(=O)c1ccc(-c2nc(-c3ccc([N+](=O)[O-])cc3C)no2)cc1 ZINC000568451176 568039282 /nfs/dbraw/zinc/03/92/82/568039282.db2.gz LQZVRLPTCBDUPV-UHFFFAOYSA-N 0 0 353.334 3.797 20 5 FHBDRN COc1ccc(N(C)C(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)cc1OC ZINC000568483147 568042633 /nfs/dbraw/zinc/04/26/33/568042633.db2.gz NCOVUTZCQPDUDA-UHFFFAOYSA-N 0 0 359.382 3.897 20 5 FHBDRN O=C(Cc1ccc(F)cc1)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000568492997 568043390 /nfs/dbraw/zinc/04/33/90/568043390.db2.gz BWQLJHOZHROMNY-UHFFFAOYSA-N 0 0 353.147 3.678 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(N(C)Cc2cccc3ccccc32)n1 ZINC000568545263 568050210 /nfs/dbraw/zinc/05/02/10/568050210.db2.gz GCVWTMNBJBUVIH-UHFFFAOYSA-N 0 0 351.362 3.566 20 5 FHBDRN CCc1onc(-c2ccccc2)c1-c1nc(CCC(C)(C)[N+](=O)[O-])no1 ZINC000291122255 568057851 /nfs/dbraw/zinc/05/78/51/568057851.db2.gz VAGZSVQUZUILCB-UHFFFAOYSA-N 0 0 356.382 3.942 20 5 FHBDRN COC(=O)[C@@H](Cc1ccc(C)cc1)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000481581803 568060409 /nfs/dbraw/zinc/06/04/09/568060409.db2.gz OQKSXYLKIZMRBJ-MAUKXSAKSA-N 0 0 356.422 3.647 20 5 FHBDRN CC(C)c1ccc([C@@H]2CCCCN2C(=O)c2nn(C)cc2[N+](=O)[O-])cc1 ZINC000541877435 568060846 /nfs/dbraw/zinc/06/08/46/568060846.db2.gz APBBMTRQAPMVFE-INIZCTEOSA-N 0 0 356.426 3.819 20 5 FHBDRN COc1ccc([C@@H](O)C2CCN(Cc3csc([N+](=O)[O-])c3)CC2)cc1 ZINC000291192679 568072838 /nfs/dbraw/zinc/07/28/38/568072838.db2.gz GSWCNJFWCZDFFR-GOSISDBHSA-N 0 0 362.451 3.611 20 5 FHBDRN O=C(CSc1ncccc1[N+](=O)[O-])Nc1ccccc1C(F)(F)F ZINC000067648411 568080153 /nfs/dbraw/zinc/08/01/53/568080153.db2.gz NEUQSMPNCLQNOG-UHFFFAOYSA-N 0 0 357.313 3.739 20 5 FHBDRN COc1ccc(Br)c(CNc2nc(C)ccc2[N+](=O)[O-])c1 ZINC000481668800 568080831 /nfs/dbraw/zinc/08/08/31/568080831.db2.gz LPABNUAYBAADLA-UHFFFAOYSA-N 0 0 352.188 3.681 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(NCc2ccc(C[N@@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)n1 ZINC000481682909 568085743 /nfs/dbraw/zinc/08/57/43/568085743.db2.gz BKBFMDLUBQGCGE-IYBDPMFKSA-N 0 0 370.453 3.520 20 5 FHBDRN COc1cccc(CCC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)c1F ZINC000568613375 568087674 /nfs/dbraw/zinc/08/76/74/568087674.db2.gz XWOXDBMPDRGORL-UHFFFAOYSA-N 0 0 366.776 3.645 20 5 FHBDRN Cn1nc([N+](=O)[O-])cc1C(=O)Nc1ccccc1NCC1CCCCC1 ZINC000481707869 568090670 /nfs/dbraw/zinc/09/06/70/568090670.db2.gz QOWQAYAZDHYDEQ-UHFFFAOYSA-N 0 0 357.414 3.573 20 5 FHBDRN COc1cc(OC[C@H](O)Cc2ccccc2C(F)(F)F)ccc1[N+](=O)[O-] ZINC000481700157 568092299 /nfs/dbraw/zinc/09/22/99/568092299.db2.gz BIKATOZGQSZTKE-GFCCVEGCSA-N 0 0 371.311 3.605 20 5 FHBDRN Cc1cc2sc(NC(=O)c3n[nH]c4ccc([N+](=O)[O-])cc43)nc2c(C)c1 ZINC000603483884 568105900 /nfs/dbraw/zinc/10/59/00/568105900.db2.gz DAMNIUYRIFDLAJ-UHFFFAOYSA-N 0 0 367.390 3.950 20 5 FHBDRN C[C@@H](c1cn(C)c2ccccc12)c1nc(Cc2ccc([N+](=O)[O-])cn2)no1 ZINC000568679714 568120314 /nfs/dbraw/zinc/12/03/14/568120314.db2.gz NWEMTDXYYTXYOW-LBPRGKRZSA-N 0 0 363.377 3.607 20 5 FHBDRN CCN(C(=O)c1cc([N+](=O)[O-])nn1C)C(c1ccccc1)c1ccccc1 ZINC000481775097 568123583 /nfs/dbraw/zinc/12/35/83/568123583.db2.gz GVVLBUAJGGZZAG-UHFFFAOYSA-N 0 0 364.405 3.580 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)c1cc(C)nc(C(F)(F)F)n1 ZINC000291369235 568126681 /nfs/dbraw/zinc/12/66/81/568126681.db2.gz CTGGACDEGAOVAV-UHFFFAOYSA-N 0 0 354.288 3.527 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)NCc1cc(F)c(C(F)(F)F)cc1F ZINC000568694120 568127141 /nfs/dbraw/zinc/12/71/41/568127141.db2.gz WBVZUSAELRQHKF-UHFFFAOYSA-N 0 0 374.265 3.751 20 5 FHBDRN O=C(CN1CC=C(c2cccc(Cl)c2)CC1)Nc1ccccc1[N+](=O)[O-] ZINC000481787691 568128812 /nfs/dbraw/zinc/12/88/12/568128812.db2.gz XYYVBJPHYINJBV-UHFFFAOYSA-N 0 0 371.824 3.976 20 5 FHBDRN CC(=O)[C@@H]1C[C@H](c2nc(-c3ccc([N+](=O)[O-])c4c3CCCN4)no2)C1(C)C ZINC000568721741 568160789 /nfs/dbraw/zinc/16/07/89/568160789.db2.gz GSPKEBGBFJWOFM-UONOGXRCSA-N 0 0 370.409 3.722 20 5 FHBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])Nc1ccc(Cl)cn1 ZINC000481919621 568187435 /nfs/dbraw/zinc/18/74/35/568187435.db2.gz GYVXENNZMBXJKI-UHFFFAOYSA-N 0 0 355.181 3.661 20 5 FHBDRN Cc1cc(S(=O)(=O)N[C@@H]2CCc3sc(Cl)cc32)ccc1[N+](=O)[O-] ZINC000584683093 568193008 /nfs/dbraw/zinc/19/30/08/568193008.db2.gz XCGYHDQQOHTJRU-LLVKDONJSA-N 0 0 372.855 3.584 20 5 FHBDRN COC(=O)c1cc(OCC(=O)Nc2ccc(C(C)C)cc2)ccc1[N+](=O)[O-] ZINC000481947382 568195277 /nfs/dbraw/zinc/19/52/77/568195277.db2.gz XYJIXZCPLFQNRB-UHFFFAOYSA-N 0 0 372.377 3.522 20 5 FHBDRN CC[C@H](Cc1ccc(C)cc1)N(CC)C(=O)Nc1ccncc1[N+](=O)[O-] ZINC000541907457 568196593 /nfs/dbraw/zinc/19/65/93/568196593.db2.gz QAMDEMSMWJFPRA-MRXNPFEDSA-N 0 0 356.426 3.595 20 5 FHBDRN Cc1csc(=O)n1CCOc1ccc(Cc2ccccc2)cc1[N+](=O)[O-] ZINC000481982120 568213455 /nfs/dbraw/zinc/21/34/55/568213455.db2.gz NTFPIURFIJFIFU-UHFFFAOYSA-N 0 0 370.430 3.796 20 5 FHBDRN COc1cc2[nH]c(CCCNc3nc(C)ccc3[N+](=O)[O-])cc2c(OC)c1 ZINC000482002061 568220639 /nfs/dbraw/zinc/22/06/39/568220639.db2.gz OPUYVBBQDRGDMW-UHFFFAOYSA-N 0 0 370.409 3.841 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(N2C[C@@H](CC(=O)N(C)C)c3cc(Cl)ccc32)n1 ZINC000482007142 568226415 /nfs/dbraw/zinc/22/64/15/568226415.db2.gz OFEKFDGCPYTTEY-GFCCVEGCSA-N 0 0 374.828 3.665 20 5 FHBDRN C[C@H]1C[C@H](c2ccccc2)N(C(=O)NCCc2cccc([N+](=O)[O-])c2)C1 ZINC000568851526 568236416 /nfs/dbraw/zinc/23/64/16/568236416.db2.gz VMFPGCQGTFKBSQ-HNAYVOBHSA-N 0 0 353.422 3.930 20 5 FHBDRN C[C@H](C(=O)N[C@H](c1ccccc1)C(F)F)c1ccc([N+](=O)[O-])cc1F ZINC000482048380 568238651 /nfs/dbraw/zinc/23/86/51/568238651.db2.gz YHYFWUSKYXLXIF-ZUZCIYMTSA-N 0 0 352.312 3.960 20 5 FHBDRN CC(=O)N(c1nc(CNC(C)(C)c2ccccc2[N+](=O)[O-])cs1)C1CC1 ZINC000291644850 568240315 /nfs/dbraw/zinc/24/03/15/568240315.db2.gz BZPKEUWMLNSCEE-UHFFFAOYSA-N 0 0 374.466 3.592 20 5 FHBDRN Cc1cc(C)cc([C@H]2CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3N)C2)c1 ZINC000181944623 568243143 /nfs/dbraw/zinc/24/31/43/568243143.db2.gz USLJDZWFTUCQRF-ZDUSSCGKSA-N 0 0 357.385 3.563 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1C[C@@H](C)O[C@H]1C ZINC000412659745 568250530 /nfs/dbraw/zinc/25/05/30/568250530.db2.gz SJGGVYHBRHMXFX-FRRDWIJNSA-N 0 0 352.456 3.639 20 5 FHBDRN CC(C)(C)c1ccc(NC(=O)CCNC(=O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000007669607 568251548 /nfs/dbraw/zinc/25/15/48/568251548.db2.gz UMYQLESDXAPTJQ-UHFFFAOYSA-N 0 0 369.421 3.651 20 5 FHBDRN O=C(NCCOc1ccc(F)cc1)c1c([N+](=O)[O-])cccc1C(F)(F)F ZINC000568917705 568252137 /nfs/dbraw/zinc/25/21/37/568252137.db2.gz CGAIMAZNNCQCFE-UHFFFAOYSA-N 0 0 372.274 3.562 20 5 FHBDRN COc1ccc(OC)c([C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])c(C)c2)c1 ZINC000015827549 568252568 /nfs/dbraw/zinc/25/25/68/568252568.db2.gz NJHXJOZPPCZOEB-GOSISDBHSA-N 0 0 370.405 3.898 20 5 FHBDRN Cc1cc(C(=O)N[C@@H](CC(=O)OC(C)C)c2ccccc2)ccc1[N+](=O)[O-] ZINC000016139776 568253178 /nfs/dbraw/zinc/25/31/78/568253178.db2.gz YTPLAXXYXQNPNU-KRWDZBQOSA-N 0 0 370.405 3.716 20 5 FHBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NC[C@@H](C)CC(F)(F)F ZINC000412664550 568254742 /nfs/dbraw/zinc/25/47/42/568254742.db2.gz WEHGCHHGCUZIHY-DTWKUNHWSA-N 0 0 368.739 3.720 20 5 FHBDRN CCS[C@@H](C)c1noc(CN(C)c2ccc([N+](=O)[O-])c3cccnc32)n1 ZINC000482080746 568254990 /nfs/dbraw/zinc/25/49/90/568254990.db2.gz VRUZMLKKZPFVNO-NSHDSACASA-N 0 0 373.438 3.977 20 5 FHBDRN COc1ccc2c(c1)C[C@H](C)N(C(=O)c1cc([N+](=O)[O-])ccc1OC)[C@@H]2C ZINC000541934489 568257209 /nfs/dbraw/zinc/25/72/09/568257209.db2.gz QKLNIVINGMKFRU-QWHCGFSZSA-N 0 0 370.405 3.760 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N2CC[C@@]3(CC[C@@H](C)C3)C2)cc1OC ZINC000541937546 568259668 /nfs/dbraw/zinc/25/96/68/568259668.db2.gz SPCAJCPENSVQJU-BFUOFWGJSA-N 0 0 362.426 3.654 20 5 FHBDRN CCC(CC)[C@@H]1C[C@H](NC(=O)N(C)Cc2ccccc2[N+](=O)[O-])CCO1 ZINC000181959903 568260813 /nfs/dbraw/zinc/26/08/13/568260813.db2.gz LGBOKBOSLPTKEI-AEFFLSMTSA-N 0 0 363.458 3.720 20 5 FHBDRN CCS[C@@H](C)c1noc(CN(C)c2ccc3cc([N+](=O)[O-])ccc3n2)n1 ZINC000482095745 568263346 /nfs/dbraw/zinc/26/33/46/568263346.db2.gz FBSNINQPLRVVCJ-NSHDSACASA-N 0 0 373.438 3.977 20 5 FHBDRN O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@@H+]1CC2(CCC2)[C@@H]1c1ccccc1 ZINC000453031509 568265196 /nfs/dbraw/zinc/26/51/96/568265196.db2.gz YWAUTTYYEWLCQW-PXNSSMCTSA-N 0 0 368.433 3.562 20 5 FHBDRN COc1cc(C(=O)N(C)[C@H](C)Cc2ccc(C)cc2)c([N+](=O)[O-])cc1OC ZINC000128758402 568266144 /nfs/dbraw/zinc/26/61/44/568266144.db2.gz INBCWMCFJBNMKG-CQSZACIVSA-N 0 0 372.421 3.624 20 5 FHBDRN COC(=O)CC(C)(C)CC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000181955810 568267821 /nfs/dbraw/zinc/26/78/21/568267821.db2.gz GHVQEHXTHHZDBR-UHFFFAOYSA-N 0 0 362.304 3.532 20 5 FHBDRN COc1c(C(=O)Nc2nc(-c3ccccc3F)co2)cccc1[N+](=O)[O-] ZINC000482127906 568268741 /nfs/dbraw/zinc/26/87/41/568268741.db2.gz PSTUCBCPXWKERK-UHFFFAOYSA-N 0 0 357.297 3.650 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N[C@H]1c2ccc(F)cc2O[C@@H]1C ZINC000482131601 568269916 /nfs/dbraw/zinc/26/99/16/568269916.db2.gz PAWLVPFXZDNKCD-PIGZYNQJSA-N 0 0 359.357 3.994 20 5 FHBDRN C[C@@H]1CC[C@@]2(CCN(CC(=O)Nc3ccc([N+](=O)[O-])cc3Cl)C2)C1 ZINC000541949700 568272797 /nfs/dbraw/zinc/27/27/97/568272797.db2.gz VBOZPAFPNUHIDU-SJKOYZFVSA-N 0 0 351.834 3.699 20 5 FHBDRN COc1ccc2c(c1)C[C@H](C)N(CC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H]2C ZINC000541952790 568272830 /nfs/dbraw/zinc/27/28/30/568272830.db2.gz UANVYMOOIMNJHI-UONOGXRCSA-N 0 0 369.421 3.550 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1N[C@@H]1CCN([C@@H](C)c2ccc(F)cc2)C1=O ZINC000453059193 568277902 /nfs/dbraw/zinc/27/79/02/568277902.db2.gz LYKYKUSBKRGZNG-BLLLJJGKSA-N 0 0 373.384 3.517 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1F)Nc1nc(-c2ccccc2F)co1 ZINC000482133847 568278321 /nfs/dbraw/zinc/27/83/21/568278321.db2.gz KLOATQMBPDCYGC-UHFFFAOYSA-N 0 0 359.288 3.709 20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])Nc1nc(-c2ccccc2F)co1 ZINC000482133693 568278345 /nfs/dbraw/zinc/27/83/45/568278345.db2.gz BAVBVSMWEWSZFF-UHFFFAOYSA-N 0 0 370.340 3.830 20 5 FHBDRN O=[N+]([O-])c1cccc(CS(=O)(=O)C2CCC(C(F)(F)F)CC2)c1 ZINC000453052088 568281269 /nfs/dbraw/zinc/28/12/69/568281269.db2.gz VLWILLKKQVVXRA-UHFFFAOYSA-N 0 0 351.346 3.631 20 5 FHBDRN CC(C)N(CCCn1cc([N+](=O)[O-])c(=O)c2ccccc21)CC(F)(F)F ZINC000291729126 568282964 /nfs/dbraw/zinc/28/29/64/568282964.db2.gz XOGBYTOZWNLDGW-UHFFFAOYSA-N 0 0 371.359 3.573 20 5 FHBDRN O=C(Cc1cccc2cccnc21)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000569047358 568285209 /nfs/dbraw/zinc/28/52/09/568285209.db2.gz POHMTZRVRSSLAW-UHFFFAOYSA-N 0 0 374.400 3.526 20 5 FHBDRN CNC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccc(OC(C)(C)C)cc1 ZINC000604439479 568294061 /nfs/dbraw/zinc/29/40/61/568294061.db2.gz IKUNUVSVEICVLH-UHFFFAOYSA-N 0 0 357.410 3.744 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N[C@@H](CC(C)(C)C)C(F)(F)F)c1[N+](=O)[O-] ZINC000482160600 568297419 /nfs/dbraw/zinc/29/74/19/568297419.db2.gz UBUYSRLXGLLHIF-QMMMGPOBSA-N 0 0 350.341 3.538 20 5 FHBDRN Cc1nnc(SCCOc2ccc([N+](=O)[O-])cc2)n1-c1ccccc1C ZINC000604468892 568297607 /nfs/dbraw/zinc/29/76/07/568297607.db2.gz JXIICERKDWIDQE-UHFFFAOYSA-N 0 0 370.434 3.963 20 5 FHBDRN C[C@@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1F)[C@@H]1OCCc2sccc21 ZINC000291761755 568298221 /nfs/dbraw/zinc/29/82/21/568298221.db2.gz LRABUPHCLBNLFB-PSLIRLAXSA-N 0 0 365.386 3.619 20 5 FHBDRN C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1c[nH]c2cccc([N+](=O)[O-])c21 ZINC000482171655 568300381 /nfs/dbraw/zinc/30/03/81/568300381.db2.gz BEOJYTJURCZTLS-ONGXEEELSA-N 0 0 355.316 3.879 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)[C@@H]2CCN(c3ccccc3F)C2)cc1[N+](=O)[O-] ZINC000569160815 568300856 /nfs/dbraw/zinc/30/08/56/568300856.db2.gz ZQOAXMMBKHKFGC-GOEBONIOSA-N 0 0 371.412 3.746 20 5 FHBDRN O=C(CSc1ccccc1[N+](=O)[O-])N1Cc2ccccc2C2(CC2)C1 ZINC000482182092 568302516 /nfs/dbraw/zinc/30/25/16/568302516.db2.gz SBQDIGXUNVSEID-UHFFFAOYSA-N 0 0 354.431 3.761 20 5 FHBDRN C[C@@H](O)C(C)(C)NC(=O)c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1 ZINC000541993072 568302545 /nfs/dbraw/zinc/30/25/45/568302545.db2.gz CUZZJUGOMZSCSX-GFCCVEGCSA-N 0 0 360.435 3.635 20 5 FHBDRN CC[C@H](C)CN(CC)c1cnn(-c2ccc([N+](=O)[O-])cc2)c(=O)c1Cl ZINC000569178651 568304938 /nfs/dbraw/zinc/30/49/38/568304938.db2.gz HGJJXYOEBXWOMN-LBPRGKRZSA-N 0 0 364.833 3.667 20 5 FHBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)NC1(c2ccc(Cl)cc2)CC1 ZINC000482183964 568304939 /nfs/dbraw/zinc/30/49/39/568304939.db2.gz IQTANMGVFDYXSG-UHFFFAOYSA-N 0 0 366.826 3.524 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)Nc1ccc2c(c1)OC(F)(F)O2 ZINC000043850996 568316060 /nfs/dbraw/zinc/31/60/60/568316060.db2.gz YJYCPPPSHLHPLL-UHFFFAOYSA-N 0 0 365.292 3.580 20 5 FHBDRN Cc1cc(OCC(=O)Nc2ccc(OC(C)C)cc2F)ccc1[N+](=O)[O-] ZINC000569263087 568317841 /nfs/dbraw/zinc/31/78/41/568317841.db2.gz QKQXWNINJAVVCS-UHFFFAOYSA-N 0 0 362.357 3.847 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N1CCC(Sc2ccccn2)CC1 ZINC000365207445 568318980 /nfs/dbraw/zinc/31/89/80/568318980.db2.gz YJPFTAITMDMUJT-UHFFFAOYSA-N 0 0 357.435 3.695 20 5 FHBDRN Cc1cc(C(=O)Nc2ccc(NC(=O)NC(C)C)cc2)ccc1[N+](=O)[O-] ZINC000031002183 568324685 /nfs/dbraw/zinc/32/46/85/568324685.db2.gz ALPWZVPFHCQHOM-UHFFFAOYSA-N 0 0 356.382 3.685 20 5 FHBDRN Cc1c(NC(=O)CCCc2nc(-c3cccs3)no2)cccc1[N+](=O)[O-] ZINC000031702156 568336001 /nfs/dbraw/zinc/33/60/01/568336001.db2.gz NIQLCLVIADXMDK-UHFFFAOYSA-N 0 0 372.406 3.976 20 5 FHBDRN CC(C)[C@H](NCc1c(F)cccc1[N+](=O)[O-])c1ccc2c(c1)OCCO2 ZINC000181984212 568343420 /nfs/dbraw/zinc/34/34/20/568343420.db2.gz WJXXOMPMUXAPEZ-IBGZPJMESA-N 0 0 360.385 3.992 20 5 FHBDRN COc1cc(C(=O)NC[C@@H]2CCCC[C@@H]2C(F)(F)F)ccc1[N+](=O)[O-] ZINC000482224107 568356057 /nfs/dbraw/zinc/35/60/57/568356057.db2.gz IMVSVQCFSBUQMZ-RYUDHWBXSA-N 0 0 360.332 3.702 20 5 FHBDRN C/C=C/c1ccc(OCC(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)c(OC)c1 ZINC000542003289 568377346 /nfs/dbraw/zinc/37/73/46/568377346.db2.gz ZQHFDALRFCRQSC-SNAWJCMRSA-N 0 0 372.377 3.663 20 5 FHBDRN COc1ccc(NC(=O)Cc2c[nH]c3cc(Cl)ccc23)cc1[N+](=O)[O-] ZINC000542000117 568382531 /nfs/dbraw/zinc/38/25/31/568382531.db2.gz MKEAPHJKVRHLHE-UHFFFAOYSA-N 0 0 359.769 3.919 20 5 FHBDRN C[C@@H]1CN(C(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)CC2(CCC2)O1 ZINC000569342618 568395429 /nfs/dbraw/zinc/39/54/29/568395429.db2.gz FHEOREIRMXXXRR-GFCCVEGCSA-N 0 0 373.434 3.502 20 5 FHBDRN COc1cc(Cc2noc([C@@H]3C[C@]3(C)C(C)C)n2)c([N+](=O)[O-])c(OC)c1 ZINC000569373712 568396789 /nfs/dbraw/zinc/39/67/89/568396789.db2.gz UDCTWAMCLDUBPQ-SCLBCKFNSA-N 0 0 361.398 3.735 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1ccc2c(c1)CCCCC2=O ZINC000569412960 568401246 /nfs/dbraw/zinc/40/12/46/568401246.db2.gz RTFYBGXZTSVOCH-UHFFFAOYSA-N 0 0 352.390 3.776 20 5 FHBDRN C[C@H](CN(C(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1)[C@@H](C)CO)c1ccccc1 ZINC000569423638 568401824 /nfs/dbraw/zinc/40/18/24/568401824.db2.gz KAXORHGCIUMXAW-IKGGRYGDSA-N 0 0 370.449 3.711 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)[C@H]1CCc2cccc(O)c21 ZINC000569427181 568402070 /nfs/dbraw/zinc/40/20/70/568402070.db2.gz HSLOMTVSFLCXKQ-KRWDZBQOSA-N 0 0 354.406 3.767 20 5 FHBDRN C[C@@H](Cc1cnc2ccccc2n1)c1nc(-c2ccc([N+](=O)[O-])s2)no1 ZINC000569480057 568402706 /nfs/dbraw/zinc/40/27/06/568402706.db2.gz MMLIPXKKRCQZJQ-JTQLQIEISA-N 0 0 367.390 3.996 20 5 FHBDRN O=C(Nc1ccc2c(c1)CCO2)c1c([N+](=O)[O-])cccc1C(F)(F)F ZINC000569445502 568402741 /nfs/dbraw/zinc/40/27/41/568402741.db2.gz ZSZLOWKZXUUTEQ-UHFFFAOYSA-N 0 0 352.268 3.801 20 5 FHBDRN CC1CCC(N(C)C(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)CC1 ZINC000569519900 568404719 /nfs/dbraw/zinc/40/47/19/568404719.db2.gz CQXZPAYKTVBNMS-UHFFFAOYSA-N 0 0 358.442 3.839 20 5 FHBDRN CN(Cc1ccc(Br)cc1)C(=O)c1ccc([N+](=O)[O-])s1 ZINC000023490930 568405020 /nfs/dbraw/zinc/40/50/20/568405020.db2.gz LEWFHBSFOVWYBX-UHFFFAOYSA-N 0 0 355.213 3.691 20 5 FHBDRN COC(=O)c1csc(NC(=O)c2c([N+](=O)[O-])cccc2C(F)(F)F)c1 ZINC000569650857 568407421 /nfs/dbraw/zinc/40/74/21/568407421.db2.gz VHFHKVSBAKRPIH-UHFFFAOYSA-N 0 0 374.296 3.714 20 5 FHBDRN CCc1cc(NC(=O)c2nc(C(C)C)oc2C)c2cc([N+](=O)[O-])ccc2n1 ZINC000569647360 568411268 /nfs/dbraw/zinc/41/12/68/568411268.db2.gz MIWCZZUPXKNSCQ-UHFFFAOYSA-N 0 0 368.393 3.799 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)ccc1N1CC[C@](CO)(Cc2ccc(F)cc2)C1 ZINC000569731708 568414450 /nfs/dbraw/zinc/41/44/50/568414450.db2.gz UNPZANSUMWMVGV-SFHVURJKSA-N 0 0 364.804 3.819 20 5 FHBDRN C[C@H](NC(=O)N1CCOC2(C1)CCCCCC2)c1ccc([N+](=O)[O-])cc1 ZINC000569680338 568418260 /nfs/dbraw/zinc/41/82/60/568418260.db2.gz ZCPPEFULOKVYEW-HNNXBMFYSA-N 0 0 361.442 3.791 20 5 FHBDRN O=[N+]([O-])c1ccc(NCc2cccc3cc[nH]c32)c(F)c1N1CCOCC1 ZINC000569824282 568427788 /nfs/dbraw/zinc/42/77/88/568427788.db2.gz GEIQJGLESPHJIR-UHFFFAOYSA-N 0 0 370.384 3.664 20 5 FHBDRN C[C@H](Cc1ccccc1F)C(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000569847944 568428844 /nfs/dbraw/zinc/42/88/44/568428844.db2.gz MHHWTZTVXFCGSD-CYBMUJFWSA-N 0 0 369.396 3.753 20 5 FHBDRN Cc1cc(N[C@H]2CCCN([C@@H](C)c3ccc(F)cc3)C2=O)ncc1[N+](=O)[O-] ZINC000569749758 568429487 /nfs/dbraw/zinc/42/94/87/568429487.db2.gz MOEXZOFWZTUOMK-BBRMVZONSA-N 0 0 372.400 3.601 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CCC[C@@H](c3nnc(C4CCCCC4)[nH]3)C2)c(F)c1 ZINC000570057389 568440425 /nfs/dbraw/zinc/44/04/25/568440425.db2.gz DTMQRXNJLUZAFG-CYBMUJFWSA-N 0 0 374.420 3.679 20 5 FHBDRN O=C(NCCc1ccccc1[N+](=O)[O-])c1nc2ccccc2cc1Cl ZINC000570018823 568440844 /nfs/dbraw/zinc/44/08/44/568440844.db2.gz PVASQKYTCTVJNA-UHFFFAOYSA-N 0 0 355.781 3.769 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(N2CCCn3c(cc4ccccc43)C2)c1 ZINC000570001563 568448402 /nfs/dbraw/zinc/44/84/02/568448402.db2.gz BMDMYPFWJUVASI-UHFFFAOYSA-N 0 0 365.389 3.746 20 5 FHBDRN C[C@H]1C[C@@H](C(C)(C)C)CCN1C(=O)c1cc([N+](=O)[O-])cc2c1OCCO2 ZINC000570126162 568453010 /nfs/dbraw/zinc/45/30/10/568453010.db2.gz FWRZIDPDTBPMEL-STQMWFEESA-N 0 0 362.426 3.653 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCCOCC1CCC1 ZINC000570256287 568459221 /nfs/dbraw/zinc/45/92/21/568459221.db2.gz PPMUTSYRQLQBBV-UHFFFAOYSA-N 0 0 352.456 3.643 20 5 FHBDRN O=C(Nc1cc(F)cc([N+](=O)[O-])c1)[C@@H]1CCN(c2ccccc2Cl)C1 ZINC000570209400 568461748 /nfs/dbraw/zinc/46/17/48/568461748.db2.gz MNZRNZPBWARCAM-LLVKDONJSA-N 0 0 363.776 3.852 20 5 FHBDRN Cc1nn(Cc2ccc(C(=O)N[C@@H]3CCC[C@@H](C)C3)cc2)c(C)c1[N+](=O)[O-] ZINC000033183292 568470049 /nfs/dbraw/zinc/47/00/49/568470049.db2.gz VXLYWQQRCALRJJ-FZKQIMNGSA-N 0 0 370.453 3.765 20 5 FHBDRN Cc1nn(Cc2ccc(C(=O)N[C@@H]3CCC[C@H](C)C3)cc2)c(C)c1[N+](=O)[O-] ZINC000033183293 568470066 /nfs/dbraw/zinc/47/00/66/568470066.db2.gz VXLYWQQRCALRJJ-SCLBCKFNSA-N 0 0 370.453 3.765 20 5 FHBDRN O=C(Nc1ccc(C2CCC2)cn1)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000570311541 568475116 /nfs/dbraw/zinc/47/51/16/568475116.db2.gz PSMYUIBPEDQIMI-UHFFFAOYSA-N 0 0 363.377 3.695 20 5 FHBDRN C/C=C\c1ccc(NS(=O)(=O)c2cc(F)c(OC)c([N+](=O)[O-])c2)cc1 ZINC000570426810 568475773 /nfs/dbraw/zinc/47/57/73/568475773.db2.gz BRNHXYYWEZAIRL-ARJAWSKDSA-N 0 0 366.370 3.576 20 5 FHBDRN O=[N+]([O-])c1ccc(NCc2cccc(Cn3ccnc3)c2)c2ncccc12 ZINC000051856285 568477635 /nfs/dbraw/zinc/47/76/35/568477635.db2.gz OIBKHNOMGYFYJA-UHFFFAOYSA-N 0 0 359.389 4.000 20 5 FHBDRN Cc1nc(C2CCCCC2)sc1-c1nc(-c2c([N+](=O)[O-])ncn2C)no1 ZINC000570473656 568483084 /nfs/dbraw/zinc/48/30/84/568483084.db2.gz GTFWMBZOZGTPBO-UHFFFAOYSA-N 0 0 374.426 3.858 20 5 FHBDRN Cc1ccnc(N(C)CCOc2ccc(Br)cc2)c1[N+](=O)[O-] ZINC000570714722 568503883 /nfs/dbraw/zinc/50/38/83/568503883.db2.gz HBDMXQWOIUWSFA-UHFFFAOYSA-N 0 0 366.215 3.576 20 5 FHBDRN Cc1cccc(NS(=O)(=O)c2cc(Cl)c(C)c([N+](=O)[O-])c2)c1C ZINC000007417104 568505482 /nfs/dbraw/zinc/50/54/82/568505482.db2.gz GXULEQIIYIYWSS-UHFFFAOYSA-N 0 0 354.815 3.974 20 5 FHBDRN Cc1ccc(OCC(=O)N(C)[C@@H]2CCCc3ccccc32)c([N+](=O)[O-])c1 ZINC000007466009 568519596 /nfs/dbraw/zinc/51/95/96/568519596.db2.gz OTUVTIGDKJOMOH-QGZVFWFLSA-N 0 0 354.406 3.818 20 5 FHBDRN CCN(C(=O)[C@H](C)c1cccc([N+](=O)[O-])c1)[C@@H](COC)Cc1ccccc1 ZINC000570778858 568525950 /nfs/dbraw/zinc/52/59/50/568525950.db2.gz NDLLSQXXJLHOGY-OXQOHEQNSA-N 0 0 370.449 3.805 20 5 FHBDRN CCCc1n[nH]c(C(=O)N(CC)C[C@@H](CC)c2ccccc2)c1[N+](=O)[O-] ZINC000482254510 568536556 /nfs/dbraw/zinc/53/65/56/568536556.db2.gz UAAHVBWZITWFMR-CQSZACIVSA-N 0 0 358.442 3.926 20 5 FHBDRN Cc1cc(Cl)c(C(=O)N2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1C ZINC000182028320 568559061 /nfs/dbraw/zinc/55/90/61/568559061.db2.gz TUYRDSIFNZKPRO-CYBMUJFWSA-N 0 0 374.828 3.587 20 5 FHBDRN O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1N[C@@H](CC1CC1)c1ccccc1 ZINC000823630516 599053439 /nfs/dbraw/zinc/05/34/39/599053439.db2.gz ZHRSFGAFGVYTBG-INIZCTEOSA-N 0 0 350.382 3.728 20 5 FHBDRN C[C@H]1C[C@@H](c2cccc(F)c2)N(c2ccc([N+](=O)[O-])cc2-c2nn[nH]n2)C1 ZINC000820668312 599060319 /nfs/dbraw/zinc/06/03/19/599060319.db2.gz RNDDRPHLWKVWNV-GTNSWQLSSA-N 0 0 368.372 3.502 20 5 FHBDRN CC[C@@H](Nc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-])c1cccc(Cl)c1 ZINC000820925484 599095721 /nfs/dbraw/zinc/09/57/21/599095721.db2.gz IUTQLCJOPCCYGG-CYBMUJFWSA-N 0 0 358.789 3.992 20 5 FHBDRN O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1N[C@@H]1CCCCc2ccccc21 ZINC000738358631 598245766 /nfs/dbraw/zinc/24/57/66/598245766.db2.gz NTXWSVRQPGMOJV-OAHLLOKOSA-N 0 0 350.382 3.655 20 5 FHBDRN O=[N+]([O-])c1cnc(Oc2ccc(Cc3ccccc3)cc2)c(-c2nn[nH]n2)c1 ZINC000738373750 598501240 /nfs/dbraw/zinc/50/12/40/598501240.db2.gz GRFJWWDGPOGCCM-UHFFFAOYSA-N 0 0 374.360 3.553 20 5 FHBDRN O=[N+]([O-])c1ccc2nc(Sc3ccc(-c4nn[nH]n4)cc3)sc2c1 ZINC000738367624 598537303 /nfs/dbraw/zinc/53/73/03/598537303.db2.gz WNUJEHVKYYSGKD-UHFFFAOYSA-N 0 0 356.392 3.536 20 5 FHBDRN O=[N+]([O-])c1ccc(N[C@H](c2ccc(F)cc2)C2CCC2)c(-c2nn[nH]n2)c1 ZINC000738368346 598796728 /nfs/dbraw/zinc/79/67/28/598796728.db2.gz COSPBWQXXUWLTO-KRWDZBQOSA-N 0 0 368.372 3.867 20 5 FHBDRN CC[C@@]([NH2+]Cc1cc([N+](=O)[O-])ccc1OC(C)C)(C(=O)[O-])c1ccccc1 ZINC000736918292 600130094 /nfs/dbraw/zinc/13/00/94/600130094.db2.gz SUUUZYDPNGDDJJ-FQEVSTJZSA-N 0 0 372.421 3.862 20 5 FHBDRN C[NH+](C)[C@H](CNc1cc(Cl)c(C(=O)[O-])cc1[N+](=O)[O-])c1ccsc1 ZINC000830584927 602250693 /nfs/dbraw/zinc/25/06/93/602250693.db2.gz HHRGCDGSZBRNHC-CQSZACIVSA-N 0 0 369.830 3.723 20 5 FHBDRN C[C@H]([NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)[C@@H]1CCCN(C(=O)[O-])C1 ZINC000739032389 602270498 /nfs/dbraw/zinc/27/04/98/602270498.db2.gz WYIKLLBJGJDCDR-DZGCQCFKSA-N 0 0 373.409 3.723 20 5 FHBDRN C[C@@H]([NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)[C@H]1CCCN(C(=O)[O-])C1 ZINC000739032346 602270631 /nfs/dbraw/zinc/27/06/31/602270631.db2.gz WHSNVLAXSAATKW-KGLIPLIRSA-N 0 0 373.409 3.723 20 5 FHBDRN O=C([O-])NC1CC[NH+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 ZINC000834189509 605484095 /nfs/dbraw/zinc/48/40/95/605484095.db2.gz MQNKQDQRTUYQQB-UHFFFAOYSA-N 0 0 361.423 3.555 20 5 FHBDRN 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FHBDRN O=C(NC[C@@H]1CCCCS1)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000547719329 928895603 /nfs/dbraw/zinc/89/56/03/928895603.db2.gz MYTZWOKJUPDTRU-AWEZNQCLSA-N 0 0 352.459 3.697 20 5 FHBDRN CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1N[C@H](C)c1ccncc1F ZINC000509451393 928903023 /nfs/dbraw/zinc/90/30/23/928903023.db2.gz SYLNVAWAZLOIMS-SECBINFHSA-N 0 0 351.309 3.618 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)cnc1N[C@H](CO)c1cccc(Br)c1 ZINC000178839647 937285012 /nfs/dbraw/zinc/28/50/12/937285012.db2.gz QYPPHRIRCMJDIO-LLVKDONJSA-N 0 0 372.606 3.551 20 5 FHBDRN O=C(NC[C@@H](CO)C1CCCCC1)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000509721374 928974811 /nfs/dbraw/zinc/97/48/11/928974811.db2.gz MWHRRDVYFPDDOX-AWEZNQCLSA-N 0 0 362.451 3.728 20 5 FHBDRN Cc1ccc([C@@H]2OCCC[C@H]2NC(=O)NCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000074857232 928995186 /nfs/dbraw/zinc/99/51/86/928995186.db2.gz HBOOTMHNBBVFDA-MOPGFXCFSA-N 0 0 369.421 3.623 20 5 FHBDRN O=[N+]([O-])c1cccc(CS(=O)(=O)[C@@H]2CCc3c2cccc3Cl)c1 ZINC000154578993 929007256 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3.511 20 5 FHBDRN Cc1cc(Br)c(O)c(NC(=O)c2cc([N+](=O)[O-])ccc2C)c1 ZINC000182934252 929412371 /nfs/dbraw/zinc/41/23/71/929412371.db2.gz VDINYQVKDDAQMH-UHFFFAOYSA-N 0 0 365.183 3.932 20 5 FHBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)c1c[nH]nc1-c1ccsc1 ZINC000187199675 929424177 /nfs/dbraw/zinc/42/41/77/929424177.db2.gz LPPZXPFREIEDAT-UHFFFAOYSA-N 0 0 370.434 3.799 20 5 FHBDRN C[C@@H](C(=O)N1C[C@@H]2CCCN2c2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000583299831 937331154 /nfs/dbraw/zinc/33/11/54/937331154.db2.gz BJEFCLXOAYSHSZ-PBHICJAKSA-N 0 0 351.406 3.714 20 5 FHBDRN Cc1cccnc1[C@@H](NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)C(C)C ZINC000134873431 929454281 /nfs/dbraw/zinc/45/42/81/929454281.db2.gz RJNFACIWOGHTDB-IBGZPJMESA-N 0 0 366.421 3.836 20 5 FHBDRN C[C@@H](NC(=O)c1cccc(Cl)c1[N+](=O)[O-])c1nc2ccccc2n1C ZINC000176651439 937335994 /nfs/dbraw/zinc/33/59/94/937335994.db2.gz NGTUPIQEIPPHMG-SNVBAGLBSA-N 0 0 358.785 3.626 20 5 FHBDRN O=C(c1cc2cccc([N+](=O)[O-])c2[nH]1)N(C[C@@H]1CCCO1)C1CCCC1 ZINC000610243297 929529867 /nfs/dbraw/zinc/52/98/67/929529867.db2.gz XEWFWUHZBOXPRM-HNNXBMFYSA-N 0 0 357.410 3.640 20 5 FHBDRN CC(=O)N(C)c1ccccc1NC(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000609818898 929531397 /nfs/dbraw/zinc/53/13/97/929531397.db2.gz YUXCYBXMWMGTRP-UHFFFAOYSA-N 0 0 353.334 3.576 20 5 FHBDRN O=C(NCc1ccc(OCC(F)(F)F)cc1)c1ccc([N+](=O)[O-])s1 ZINC000023510203 929560529 /nfs/dbraw/zinc/56/05/29/929560529.db2.gz FTKNPLZVYRRANB-UHFFFAOYSA-N 0 0 360.313 3.527 20 5 FHBDRN O=[N+]([O-])c1cccc([C@@H](O)COc2ccc(-c3noc(C4CC4)n3)cc2)c1 ZINC000154975225 929602423 /nfs/dbraw/zinc/60/24/23/929602423.db2.gz GHGCNRALCYZFJV-KRWDZBQOSA-N 0 0 367.361 3.635 20 5 FHBDRN Cc1nc(CNC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])sc1C ZINC000175351174 929625615 /nfs/dbraw/zinc/62/56/15/929625615.db2.gz RJYPIYHMDNKYBL-UHFFFAOYSA-N 0 0 359.329 3.617 20 5 FHBDRN O=[N+]([O-])c1ccc(CN2CCO[C@@H](c3ccc(F)cc3F)C2)c(F)c1 ZINC000547973246 929655344 /nfs/dbraw/zinc/65/53/44/929655344.db2.gz ANNMYUPTPHLVRD-QGZVFWFLSA-N 0 0 352.312 3.586 20 5 FHBDRN CCN(C(=O)c1cc([N+](=O)[O-])ccc1C)[C@H](COC)Cc1ccccc1 ZINC000471448643 929676658 /nfs/dbraw/zinc/67/66/58/929676658.db2.gz IGYQVLBHROTVOD-SFHVURJKSA-N 0 0 356.422 3.623 20 5 FHBDRN Cc1c(NC(=O)Nc2ccccc2O[C@H]2CCOC2)cccc1[N+](=O)[O-] ZINC000155473557 929689345 /nfs/dbraw/zinc/68/93/45/929689345.db2.gz OXZDHUNBTBUHNX-ZDUSSCGKSA-N 0 0 357.366 3.715 20 5 FHBDRN CC(C)C[C@H](C)N(C)C(=O)COc1ccc([N+](=O)[O-])cc1Br ZINC000609961745 929734364 /nfs/dbraw/zinc/73/43/64/929734364.db2.gz CMJNPKBUZCJQKZ-NSHDSACASA-N 0 0 373.247 3.629 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(Oc2ncnc3c4ccccc4oc32)c1 ZINC000052279178 937356059 /nfs/dbraw/zinc/35/60/59/937356059.db2.gz SXGQAQUOQHGFBF-UHFFFAOYSA-N 0 0 365.301 3.863 20 5 FHBDRN CCc1cccc2c1OCC[C@H]2NC(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000510304167 929764680 /nfs/dbraw/zinc/76/46/80/929764680.db2.gz AOIAEGMBRLXMPB-QGZVFWFLSA-N 0 0 369.421 3.822 20 5 FHBDRN COc1ccc(CC(=O)Nc2cccc(CC(F)(F)F)c2)cc1[N+](=O)[O-] ZINC000610302959 929773264 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FHBDRN CN(CC1(c2ccc(Br)cc2)CC1)c1ccc([N+](=O)[O-])nc1 ZINC000580503664 930777784 /nfs/dbraw/zinc/77/77/84/930777784.db2.gz SVEWRTLGDMYICY-UHFFFAOYSA-N 0 0 362.227 3.920 20 5 FHBDRN O=C(c1cc2cc([N+](=O)[O-])ccc2o1)N1CC[C@]2(C1)OCc1ccccc12 ZINC000471586389 930780378 /nfs/dbraw/zinc/78/03/78/930780378.db2.gz PFJIWIRUBXUBSA-HXUWFJFHSA-N 0 0 364.357 3.613 20 5 FHBDRN Cn1ccnc1[C@H](NC(=O)c1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1 ZINC000023773764 930842662 /nfs/dbraw/zinc/84/26/62/930842662.db2.gz WFMRZSJKAAWIAQ-MRXNPFEDSA-N 0 0 370.796 3.501 20 5 FHBDRN Cc1nc(COC(C)(C)C)oc1-c1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000580571504 930865140 /nfs/dbraw/zinc/86/51/40/930865140.db2.gz MDBUPNADTLBUOX-UHFFFAOYSA-N 0 0 358.354 3.923 20 5 FHBDRN CC(C)[C@@H]1C[C@@H](NC(=O)c2ccnc(-c3ccccc3)c2[N+](=O)[O-])CCO1 ZINC001266623284 930871500 /nfs/dbraw/zinc/87/15/00/930871500.db2.gz LBFBDYBUNYTNRT-RDJZCZTQSA-N 0 0 369.421 3.590 20 5 FHBDRN O=[N+]([O-])c1cc2c(ncnc2NC[C@@H]2CCN(c3ccc(F)cc3)C2)s1 ZINC000561153112 930893711 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FHBDRN Cc1cc(NC(=O)[C@H]2CC[C@@H](C(F)(F)F)C2)c2cc([N+](=O)[O-])ccc2n1 ZINC000580673555 931000019 /nfs/dbraw/zinc/00/00/19/931000019.db2.gz YGWMTMXGYJKIJJ-WDEREUQCSA-N 0 0 367.327 3.790 20 5 FHBDRN O=C(/C=C\c1cccnc1)O[C@H](c1cccnc1)c1ccccc1[N+](=O)[O-] ZINC000588386224 931008585 /nfs/dbraw/zinc/00/85/85/931008585.db2.gz ZKXCTURHLRABDD-GDCKJWNLSA-N 0 0 361.357 3.731 20 5 FHBDRN CC[C@@H](NC(=O)COc1ccc(C)cc1OC)c1cccc([N+](=O)[O-])c1 ZINC000177811774 931058349 /nfs/dbraw/zinc/05/83/49/931058349.db2.gz CZEWEMIPZJOCOI-MRXNPFEDSA-N 0 0 358.394 3.558 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NCc2cc(-c3ccccc3)on2)c1 ZINC000580726886 931062637 /nfs/dbraw/zinc/06/26/37/931062637.db2.gz BOVSGFTUOCZINA-UHFFFAOYSA-N 0 0 367.361 3.579 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1Nc1cccc(Oc2ccnc(C(N)=O)c2)c1 ZINC001211290227 931082323 /nfs/dbraw/zinc/08/23/23/931082323.db2.gz UGOFMJIATWJYQQ-UHFFFAOYSA-N 0 0 364.361 3.933 20 5 FHBDRN CCOc1c(Cl)cccc1NC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC001125472091 931109803 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C[C@@H](c1cccnc1)N(C)C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000119334243 931215282 /nfs/dbraw/zinc/21/52/82/931215282.db2.gz OFOWXLNNJOUMTC-JTQLQIEISA-N 0 0 364.199 3.586 20 5 FHBDRN CC(C)(C(=O)N1CCCC[C@@H]([C@H]2CCOC2)C1)c1ccccc1[N+](=O)[O-] ZINC000891328132 931220104 /nfs/dbraw/zinc/22/01/04/931220104.db2.gz IQSJADDUEOTBCC-CVEARBPZSA-N 0 0 360.454 3.538 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)[C@H](C)Oc2ccc(F)c(F)c2)cc1[N+](=O)[O-] ZINC000177846847 931286609 /nfs/dbraw/zinc/28/66/09/931286609.db2.gz WWEHWFLLKZTSTD-RYUDHWBXSA-N 0 0 364.348 3.826 20 5 FHBDRN Cc1c(C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)oc2c1C(=O)CCC2 ZINC000177850792 931295313 /nfs/dbraw/zinc/29/53/13/931295313.db2.gz QTMJOFAONZHUFT-GFCCVEGCSA-N 0 0 356.378 3.815 20 5 FHBDRN O=C(c1cc(Cl)ccc1[N+](=O)[O-])N1CCCC[C@@H]([C@@H]2CCOC2)C1 ZINC000891337573 931296742 /nfs/dbraw/zinc/29/67/42/931296742.db2.gz HHWYIXRLRKFOEV-CHWSQXEVSA-N 0 0 352.818 3.527 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CCCC[C@H]([C@H]2CCOC2)C1 ZINC000891340421 931320805 /nfs/dbraw/zinc/32/08/05/931320805.db2.gz QMZZGZICSHQPMO-STQMWFEESA-N 0 0 352.818 3.527 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CCCC[C@H]([C@@H]2CCOC2)C1 ZINC000891340419 931320831 /nfs/dbraw/zinc/32/08/31/931320831.db2.gz QMZZGZICSHQPMO-QWHCGFSZSA-N 0 0 352.818 3.527 20 5 FHBDRN C[C@H](NC(=O)N1CCC[C@H](Nc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000177853371 931323882 /nfs/dbraw/zinc/32/38/82/931323882.db2.gz GPKGFPOBZFBQPR-YJBOKZPZSA-N 0 0 368.437 3.942 20 5 FHBDRN Cc1oc(-c2ccsc2)nc1CSCc1c([N+](=O)[O-])ncn1C ZINC000476992319 931346421 /nfs/dbraw/zinc/34/64/21/931346421.db2.gz FOKWUWCEKPGXPC-UHFFFAOYSA-N 0 0 350.425 3.787 20 5 FHBDRN Cc1cc(C(=O)COc2cccc([N+](=O)[O-])c2)c(C)n1CC(F)(F)F ZINC000060383340 931366708 /nfs/dbraw/zinc/36/67/08/931366708.db2.gz DSMDECBNXQLLBS-UHFFFAOYSA-N 0 0 356.300 3.837 20 5 FHBDRN CO[C@@H](C)c1nc(C)c(C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)s1 ZINC000177870665 931394656 /nfs/dbraw/zinc/39/46/56/931394656.db2.gz NHCMIFRULHOICA-PWSUYJOCSA-N 0 0 363.439 3.867 20 5 FHBDRN COc1ccc(OCCCC(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000177872667 931397648 /nfs/dbraw/zinc/39/76/48/931397648.db2.gz LHIFVUVPZIYVFH-HNNXBMFYSA-N 0 0 372.421 3.948 20 5 FHBDRN CC(C)(C(=O)N1CCC(F)(c2ccccn2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000580955964 931410234 /nfs/dbraw/zinc/41/02/34/931410234.db2.gz JLXQOTPDBVAMOD-UHFFFAOYSA-N 0 0 371.412 3.755 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)c2nc(C(C)C)ncc2Cl)cc1[N+](=O)[O-] ZINC000177874516 931429976 /nfs/dbraw/zinc/42/99/76/931429976.db2.gz VWDMIVVQRWPTGC-NSHDSACASA-N 0 0 362.817 3.961 20 5 FHBDRN C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCC(c2ccccc2F)CC1 ZINC001167443306 931511071 /nfs/dbraw/zinc/51/10/71/931511071.db2.gz RWROKCXXTIPGMH-AWEZNQCLSA-N 0 0 371.412 3.941 20 5 FHBDRN CN(C)c1ccccc1NC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000156781247 931511177 /nfs/dbraw/zinc/51/11/77/931511177.db2.gz GBATUQADQPNDEW-UHFFFAOYSA-N 0 0 354.410 3.857 20 5 FHBDRN CC[C@H](C)[C@@H](O)CNC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000177902139 931524650 /nfs/dbraw/zinc/52/46/50/931524650.db2.gz UUMLFEXWKVVOKF-GUYCJALGSA-N 0 0 374.462 3.883 20 5 FHBDRN COc1cc(C(=O)N2CC[C@H](C)[C@H]3CCCC[C@@H]32)c([N+](=O)[O-])cc1F ZINC000581057948 931532125 /nfs/dbraw/zinc/53/21/25/931532125.db2.gz ZVHDBMFGLLXKOL-ZOWXZIJZSA-N 0 0 350.390 3.783 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1CN1CCCC[C@H]1c1noc(CC)n1 ZINC000610476225 931540125 /nfs/dbraw/zinc/54/01/25/931540125.db2.gz HQQLKZBKSDKDCF-HNNXBMFYSA-N 0 0 360.414 3.666 20 5 FHBDRN Cc1cnc(-c2cccc(NC(=O)COc3ccc([N+](=O)[O-])c(C)c3)c2)o1 ZINC000430533122 931542267 /nfs/dbraw/zinc/54/22/67/931542267.db2.gz UIJKAPFVWAHVFQ-UHFFFAOYSA-N 0 0 367.361 3.884 20 5 FHBDRN O=C(c1cc(OCc2ccccc2)ccc1[N+](=O)[O-])N1CCC[C@H](F)C1 ZINC000581078029 931544044 /nfs/dbraw/zinc/54/40/44/931544044.db2.gz RCDZMATWZJTADV-HNNXBMFYSA-N 0 0 358.369 3.748 20 5 FHBDRN O=C(c1ccc(Cl)cc1[N+](=O)[O-])N1CCC[C@H](Nc2ccccc2)C1 ZINC000126172897 931545804 /nfs/dbraw/zinc/54/58/04/931545804.db2.gz 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CN(CCCCO)C(=O)c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1 ZINC000276510262 932517335 /nfs/dbraw/zinc/51/73/35/932517335.db2.gz WEDDVHUYDURBRF-UHFFFAOYSA-N 0 0 360.435 3.591 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)NCc1ccccc1C[NH+](C)C ZINC000477370826 932523540 /nfs/dbraw/zinc/52/35/40/932523540.db2.gz BRTMEZWJMUWYOQ-UHFFFAOYSA-N 0 0 361.829 3.548 20 5 FHBDRN CCc1ccc(C(=O)N(Cc2ccc(O)c(OC)c2)C2CC2)cc1[N+](=O)[O-] ZINC000157439297 932532261 /nfs/dbraw/zinc/53/22/61/932532261.db2.gz HCTQMXWMUFVSKT-UHFFFAOYSA-N 0 0 370.405 3.676 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)NCC2(C)CCC(C)CC2)cc1OC ZINC000477390087 932538261 /nfs/dbraw/zinc/53/82/61/932538261.db2.gz CTZXSSPFEBBNCR-UHFFFAOYSA-N 0 0 364.442 3.948 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)OCCCC(=O)OC(C)(C)C)c1 ZINC000785066005 932548637 /nfs/dbraw/zinc/54/86/37/932548637.db2.gz PBBDZXMAPKFVBD-UHFFFAOYSA-N 0 0 355.412 3.595 20 5 FHBDRN CC[C@@H]1C[C@@H](C)CN1C(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000510458451 932574625 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FHBDRN O=[N+]([O-])c1ccc(CNc2ccc([N+](=O)[O-])cc2Br)cc1 ZINC000037131084 933688458 /nfs/dbraw/zinc/68/84/58/933688458.db2.gz KKALWGGFELFWMH-UHFFFAOYSA-N 0 0 352.144 3.878 20 5 FHBDRN CC(C)(C(=O)NC1CCN(c2cccs2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000610671460 933706617 /nfs/dbraw/zinc/70/66/17/933706617.db2.gz XVOWPTRJWNGUNB-UHFFFAOYSA-N 0 0 373.478 3.719 20 5 FHBDRN Cc1ccc(-c2nnc(NC(=O)c3ccc([N+](=O)[O-])cc3)s2)c(C)c1 ZINC000065082894 933749467 /nfs/dbraw/zinc/74/94/67/933749467.db2.gz IRUHFVDAYFYVHQ-UHFFFAOYSA-N 0 0 354.391 3.982 20 5 FHBDRN CCCc1nc(C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2C)co1 ZINC000510807745 933757208 /nfs/dbraw/zinc/75/72/08/933757208.db2.gz VDZWFXTZGDIKQF-UHFFFAOYSA-N 0 0 368.187 3.859 20 5 FHBDRN Cc1cc(OCC(=O)NCc2ccc3ccccc3c2)ccc1[N+](=O)[O-] ZINC000510803510 933760990 /nfs/dbraw/zinc/76/09/90/933760990.db2.gz KLQZXNQPYTYJMJ-UHFFFAOYSA-N 0 0 350.374 3.752 20 5 FHBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])Nc1ncc(Cl)s1 ZINC000610684845 933778080 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3.667 20 5 FHBDRN C[C@@H](c1ccccc1)n1ccc(=NC(=O)c2c(Cl)cccc2[N+](=O)[O-])[nH]1 ZINC000610749124 934082280 /nfs/dbraw/zinc/08/22/80/934082280.db2.gz IUWAQYDGLAYUSM-LBPRGKRZSA-N 0 0 370.796 3.728 20 5 FHBDRN CCOc1cccc(/C=C\C(=O)N2CCCc3c([N+](=O)[O-])cccc32)c1 ZINC001266961765 934108079 /nfs/dbraw/zinc/10/80/79/934108079.db2.gz JWDVVTJVMYFIMC-QXMHVHEDSA-N 0 0 352.390 3.986 20 5 FHBDRN O=C(COc1ccc2c(c1)CCCC2)N1CCCc2c([N+](=O)[O-])cccc21 ZINC001266962688 934116860 /nfs/dbraw/zinc/11/68/60/934116860.db2.gz VBHQUDYORCZTGF-UHFFFAOYSA-N 0 0 366.417 3.832 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(OCc2cc(-c3ccccc3)on2)c1 ZINC000043927271 934118275 /nfs/dbraw/zinc/11/82/75/934118275.db2.gz ADDPBMJWPHEEKY-UHFFFAOYSA-N 0 0 354.318 3.615 20 5 FHBDRN COc1ccc([C@@H](NC(=O)c2ccc([N+](=O)[O-])cn2)c2ccccc2)cc1 ZINC000610769410 934138287 /nfs/dbraw/zinc/13/82/87/934138287.db2.gz GVCSNEVNSHXDJQ-IBGZPJMESA-N 0 0 363.373 3.518 20 5 FHBDRN C[C@@H]1c2ccccc2OCCN1c1ncc(Br)cc1[N+](=O)[O-] ZINC000610769843 934145731 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O=C(c1cc([N+](=O)[O-])ccc1Oc1ccccc1)N1CCO[C@H]2CCC[C@H]21 ZINC000431238375 934242353 /nfs/dbraw/zinc/24/23/53/934242353.db2.gz OCFDULZGYMELGH-MJGOQNOKSA-N 0 0 368.389 3.781 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNc1cc(Cl)ccc1C(=O)N(C)C ZINC000098127188 934264933 /nfs/dbraw/zinc/26/49/33/934264933.db2.gz QTLJPAJYUZRJTH-UHFFFAOYSA-N 0 0 363.801 3.571 20 5 FHBDRN Cc1ccc(N(C(=O)[C@H]2CC(c3ccccc3[N+](=O)[O-])=NO2)C(C)C)cc1 ZINC001125555017 934269701 /nfs/dbraw/zinc/26/97/01/934269701.db2.gz KLLHTAFAFCGBJI-LJQANCHMSA-N 0 0 367.405 3.838 20 5 FHBDRN Cc1ccccc1O[C@H](C)CNC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000535695379 934288199 /nfs/dbraw/zinc/28/81/99/934288199.db2.gz YQKFVGRQRDLTNJ-CYBMUJFWSA-N 0 0 353.378 3.582 20 5 FHBDRN Cc1ccc(-c2nnco2)cc1NC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000535697996 934292964 /nfs/dbraw/zinc/29/29/64/934292964.db2.gz DOLLHELVJICXSW-UHFFFAOYSA-N 0 0 363.333 3.687 20 5 FHBDRN CC(C)[C@@]1(C)C[C@@H]1NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000458104926 934304165 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Cc1nc(C)c(CNc2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)s1 ZINC000277023145 934456928 /nfs/dbraw/zinc/45/69/28/934456928.db2.gz CSEODTBHAKDEGE-UHFFFAOYSA-N 0 0 360.439 3.516 20 5 FHBDRN CC(C)c1cc(C(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)cc(=O)[nH]1 ZINC000121660700 934479443 /nfs/dbraw/zinc/47/94/43/934479443.db2.gz QMNXUNHGFPQNCG-UHFFFAOYSA-N 0 0 355.394 3.624 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)OCC(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000003514807 934479999 /nfs/dbraw/zinc/47/99/99/934479999.db2.gz JVTOTAMNCNKOLU-UHFFFAOYSA-N 0 0 356.378 3.688 20 5 FHBDRN COC(=O)C(C)(C)[C@H](NC(=O)c1cc(C)cc([N+](=O)[O-])c1)c1ccccc1 ZINC000610824361 934499369 /nfs/dbraw/zinc/49/93/69/934499369.db2.gz REIQHEQJNRLKGI-QGZVFWFLSA-N 0 0 370.405 3.574 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN[C@H](C)c1ccccc1OC(C)C ZINC000538124057 934525148 /nfs/dbraw/zinc/52/51/48/934525148.db2.gz AORCCAFRAPCWQR-OAHLLOKOSA-N 0 0 371.437 3.980 20 5 FHBDRN COc1ccccc1C(C)(C)NC(=O)N[C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000458256526 934532312 /nfs/dbraw/zinc/53/23/12/934532312.db2.gz CCHOGEPGWOCHJL-ZDUSSCGKSA-N 0 0 357.410 3.899 20 5 FHBDRN CCOc1ccc(C(=O)N(C)[C@H](C)Cc2cccc(F)c2)cc1[N+](=O)[O-] ZINC000458266250 934561126 /nfs/dbraw/zinc/56/11/26/934561126.db2.gz GTNUCCGZXQIUSC-CYBMUJFWSA-N 0 0 360.385 3.836 20 5 FHBDRN CCOc1ccc(C(=O)N2CCC[C@@H]2c2ccc(O)cc2)cc1[N+](=O)[O-] ZINC000610887370 934565114 /nfs/dbraw/zinc/56/51/14/934565114.db2.gz XNZKPKVCERMPLQ-MRXNPFEDSA-N 0 0 356.378 3.676 20 5 FHBDRN O=C(c1cc2c(cc1[N+](=O)[O-])OCO2)N1CCC[C@@H]1CCC1CCCC1 ZINC000610896382 934566804 /nfs/dbraw/zinc/56/68/04/934566804.db2.gz PBSKFFUZBZCHPQ-CQSZACIVSA-N 0 0 360.410 3.899 20 5 FHBDRN CCN(CCC(F)(F)F)C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000610904364 934607439 /nfs/dbraw/zinc/60/74/39/934607439.db2.gz CXARYKDMYBKSLZ-UHFFFAOYSA-N 0 0 369.137 3.772 20 5 FHBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CC[C@H](c2ccco2)C1 ZINC000610905464 934608054 /nfs/dbraw/zinc/60/80/54/934608054.db2.gz PIRRPPBRRBSUAC-JTQLQIEISA-N 0 0 365.183 3.580 20 5 FHBDRN CC(C)n1ncc2cc(NCc3cc4c(cc3[N+](=O)[O-])OCCO4)ccc21 ZINC000610911018 934611882 /nfs/dbraw/zinc/61/18/82/934611882.db2.gz ZHMHDOBTTUQZOE-UHFFFAOYSA-N 0 0 368.393 3.909 20 5 FHBDRN CCCN(C(=O)c1cccs1)C1CCN(c2ccncc2[N+](=O)[O-])CC1 ZINC000610909421 934614099 /nfs/dbraw/zinc/61/40/99/934614099.db2.gz KWJMPMIPEDFBNB-UHFFFAOYSA-N 0 0 374.466 3.573 20 5 FHBDRN COc1ccc(C(C)(C)C)cc1NC(=O)c1n[nH]c(C(C)C)c1[N+](=O)[O-] ZINC000610916315 934623678 /nfs/dbraw/zinc/62/36/78/934623678.db2.gz LYGDBRPSNJRIIR-UHFFFAOYSA-N 0 0 360.414 4.000 20 5 FHBDRN C[C@H](C1CC1)N(C(=O)c1cc(Br)cc([N+](=O)[O-])c1)C1CC1 ZINC000178458962 934637716 /nfs/dbraw/zinc/63/77/16/934637716.db2.gz HPCDOQXVFLVAEM-SECBINFHSA-N 0 0 353.216 3.760 20 5 FHBDRN COc1ccccc1[C@H]1CCCCN1CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000610944771 934637850 /nfs/dbraw/zinc/63/78/50/934637850.db2.gz YSDNIPRRHIMKKK-QGZVFWFLSA-N 0 0 369.421 3.769 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N[C@@H]1CCOc2ccc(F)cc21 ZINC000176225514 934644691 /nfs/dbraw/zinc/64/46/91/934644691.db2.gz XMTXAXNGKGSLJD-CQSZACIVSA-N 0 0 359.357 3.996 20 5 FHBDRN CN(c1ccc([N+](=O)[O-])s1)[C@@H]1CCN(c2ccccc2Cl)C1=O ZINC000610952696 934649231 /nfs/dbraw/zinc/64/92/31/934649231.db2.gz JRHSWBCMCZRBTA-GFCCVEGCSA-N 0 0 351.815 3.551 20 5 FHBDRN Cc1c(CC(=O)Nc2ccc3c(cnn3C(F)F)c2)cccc1[N+](=O)[O-] ZINC000610972492 934670350 /nfs/dbraw/zinc/67/03/50/934670350.db2.gz BPKOCHRWCHZHRT-UHFFFAOYSA-N 0 0 360.320 3.829 20 5 FHBDRN CC(C)c1cc(C(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)cc(=O)[nH]1 ZINC000121676559 934689411 /nfs/dbraw/zinc/68/94/11/934689411.db2.gz UOPYOWPXBHQGRF-UHFFFAOYSA-N 0 0 355.394 3.624 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)Nc1ccc(-c2ccccc2)nn1 ZINC000178464474 934693057 /nfs/dbraw/zinc/69/30/57/934693057.db2.gz MOGUKOHGEGFNSO-UHFFFAOYSA-N 0 0 363.377 3.716 20 5 FHBDRN C[C@H]1CC(C)(C)CC[C@H]1NC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000176282373 934735195 /nfs/dbraw/zinc/73/51/95/934735195.db2.gz UEAWGMGAYIWNHQ-GXFFZTMASA-N 0 0 367.833 3.518 20 5 FHBDRN Cc1ccc(C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2C)cn1 ZINC000431265119 934743439 /nfs/dbraw/zinc/74/34/39/934743439.db2.gz VDRYJCBEYAKBBD-UHFFFAOYSA-N 0 0 350.172 3.621 20 5 FHBDRN CCOC(=O)c1cnc2ccccc2c1NCc1ccccc1[N+](=O)[O-] ZINC000065227744 934750673 /nfs/dbraw/zinc/75/06/73/934750673.db2.gz JDRPGTKSTVUUNF-UHFFFAOYSA-N 0 0 351.362 3.932 20 5 FHBDRN Cc1ccc(S(=O)(=O)N2C[C@@H](C)C[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000510994823 934803029 /nfs/dbraw/zinc/80/30/29/934803029.db2.gz HWPFJLAZQURCFQ-UGSOOPFHSA-N 0 0 360.435 3.675 20 5 FHBDRN Cc1ccc(-c2nc(CCNC(=O)c3ccc([N+](=O)[O-])c(C)c3)co2)cc1 ZINC000110011826 934813498 /nfs/dbraw/zinc/81/34/98/934813498.db2.gz QERLZPZJTUIEBU-UHFFFAOYSA-N 0 0 365.389 3.839 20 5 FHBDRN Cn1ccnc1[C@H](NCC(C)(C)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000611560343 934826670 /nfs/dbraw/zinc/82/66/70/934826670.db2.gz TXLHHWPOZRAOGS-LJQANCHMSA-N 0 0 364.449 3.985 20 5 FHBDRN Cc1ccc(N2C[C@H](C(=O)O[C@H](C)c3cccc([N+](=O)[O-])c3)CC2=O)cc1 ZINC000024077131 934827287 /nfs/dbraw/zinc/82/72/87/934827287.db2.gz ZKGVKARDMSGSGX-GDBMZVCRSA-N 0 0 368.389 3.561 20 5 FHBDRN COc1ccc(C(=O)N2CC=C(c3c(F)cccc3F)CC2)cc1[N+](=O)[O-] ZINC000472014377 934829411 /nfs/dbraw/zinc/82/94/11/934829411.db2.gz VPFJIXVFFKHNKT-UHFFFAOYSA-N 0 0 374.343 3.811 20 5 FHBDRN CO[C@H](c1ccccc1F)[C@H](C)NC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000538337426 934830228 /nfs/dbraw/zinc/83/02/28/934830228.db2.gz NAAAAHLVRSKEIG-QFYYESIMSA-N 0 0 366.776 3.893 20 5 FHBDRN Cc1noc(C)c1[C@@H](C)CC(=O)Nc1ccnn1-c1ccc([N+](=O)[O-])cc1 ZINC000156660411 934838201 /nfs/dbraw/zinc/83/82/01/934838201.db2.gz ROFBTNHAMKPKKI-NSHDSACASA-N 0 0 369.381 3.518 20 5 FHBDRN Cn1ccnc1[C@@H](NCC(C)(C)[C@@H]1CCCCO1)c1ccc([N+](=O)[O-])cc1 ZINC000611560793 934846067 /nfs/dbraw/zinc/84/60/67/934846067.db2.gz XMNJMNCOYKUTFO-ROUUACIJSA-N 0 0 372.469 3.603 20 5 FHBDRN COc1ccc(C[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2F)cc1OC ZINC000511000469 934846784 /nfs/dbraw/zinc/84/67/84/934846784.db2.gz HAVNSRPZXVQBJP-NSHDSACASA-N 0 0 362.357 3.568 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@@H]2[C@H]3CCc4ccccc4[C@@H]23)c1 ZINC000538420598 934846940 /nfs/dbraw/zinc/84/69/40/934846940.db2.gz TXGYSQZKJOYCHU-ZLGUVYLKSA-N 0 0 366.417 3.517 20 5 FHBDRN CCN(Cc1cccs1)S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000119510124 934851342 /nfs/dbraw/zinc/85/13/42/934851342.db2.gz ZSSYLWJJSDTOPU-UHFFFAOYSA-N 0 0 360.844 3.521 20 5 FHBDRN CCc1ccc(C(=O)N2CCc3[nH]c4ccc(F)cc4c3C2)cc1[N+](=O)[O-] ZINC000472031993 934859504 /nfs/dbraw/zinc/85/95/04/934859504.db2.gz MUMUEQMPHSCDPD-UHFFFAOYSA-N 0 0 367.380 3.976 20 5 FHBDRN O=[N+]([O-])/C=C/c1ccc(Cl)cc1NCc1cc(Br)no1 ZINC001167503343 934861645 /nfs/dbraw/zinc/86/16/45/934861645.db2.gz SHGRWZGBZLFZBL-ONEGZZNKSA-N 0 0 358.579 3.950 20 5 FHBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N1CCCc2cc(F)ccc21 ZINC000119549760 934875223 /nfs/dbraw/zinc/87/52/23/934875223.db2.gz JOCPKLJGFFDYSO-UHFFFAOYSA-N 0 0 370.789 3.529 20 5 FHBDRN COc1ccc(CNC(=O)NCC[C@@H](C)c2ccccc2)cc1[N+](=O)[O-] ZINC000538635443 934878218 /nfs/dbraw/zinc/87/82/18/934878218.db2.gz UCLOAEHHKNWQQR-CQSZACIVSA-N 0 0 357.410 3.596 20 5 FHBDRN CSc1cccc(NC(=O)Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)c1 ZINC000538657243 934887028 /nfs/dbraw/zinc/88/70/28/934887028.db2.gz GBARTLHALYHQQR-UHFFFAOYSA-N 0 0 368.418 3.819 20 5 FHBDRN C[C@@H]1CCN(C(=O)CN(C)c2ccccc2[N+](=O)[O-])[C@H]1c1cccc(F)c1 ZINC000472046586 934890498 /nfs/dbraw/zinc/89/04/98/934890498.db2.gz AQTPCLAFXKHGPM-JLTOFOAXSA-N 0 0 371.412 3.780 20 5 FHBDRN Cc1cnc(C2CCN([C@H](C)C(=O)Nc3ccccc3[N+](=O)[O-])CC2)s1 ZINC000277294405 934893863 /nfs/dbraw/zinc/89/38/63/934893863.db2.gz BYDYNFKGVIBBLW-CYBMUJFWSA-N 0 0 374.466 3.566 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)c1ccc(N2CCCCC2)cc1 ZINC000513034685 934902778 /nfs/dbraw/zinc/90/27/78/934902778.db2.gz BHQQXZRYKWWRNH-UHFFFAOYSA-N 0 0 367.449 3.900 20 5 FHBDRN COC(=O)c1ccoc1COC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000024104379 934946247 /nfs/dbraw/zinc/94/62/47/934946247.db2.gz QCLKHDRVYUPTCC-UHFFFAOYSA-N 0 0 361.331 3.546 20 5 FHBDRN CCC(CC)C(=O)N1CCC(Nc2ccc([N+](=O)[O-])cc2COC)CC1 ZINC000156793317 934946980 /nfs/dbraw/zinc/94/69/80/934946980.db2.gz DHGCGVIZJTZGJV-UHFFFAOYSA-N 0 0 363.458 3.580 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)Oc1ccc(Cl)cc1Cl ZINC000071895850 934947455 /nfs/dbraw/zinc/94/74/55/934947455.db2.gz BMLHHCQZJJNISP-UHFFFAOYSA-N 0 0 362.190 3.978 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@@H]1[C@@H]1CCCOC1 ZINC000563187401 934955211 /nfs/dbraw/zinc/95/52/11/934955211.db2.gz WHPILAFGBHKUIL-ZHALLVOQSA-N 0 0 360.454 3.581 20 5 FHBDRN COC(=O)c1ccc(C(C)C)c(NC(=O)c2cc(OC)ccc2[N+](=O)[O-])c1 ZINC000468190651 935014090 /nfs/dbraw/zinc/01/40/90/935014090.db2.gz BYMQSRMUGKPYMW-UHFFFAOYSA-N 0 0 372.377 3.766 20 5 FHBDRN C[C@H](NC(=O)N1CCCC[C@H]([C@@H]2CCOC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000892109427 935014123 /nfs/dbraw/zinc/01/41/23/935014123.db2.gz ANHKDKSYEIKGAJ-BHYGNILZSA-N 0 0 361.442 3.504 20 5 FHBDRN COc1ccc([C@@H]2CCCN2C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)nc1 ZINC000892111096 935016607 /nfs/dbraw/zinc/01/66/07/935016607.db2.gz IYBNJTRMSWIARM-ACJLOTCBSA-N 0 0 370.409 3.606 20 5 FHBDRN O=C(c1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCC[C@H]([C@@H]2CCOC2)C1 ZINC000439907639 945071025 /nfs/dbraw/zinc/07/10/25/945071025.db2.gz FUSABGOKCVYOER-NWDGAFQWSA-N 0 0 372.343 3.502 20 5 FHBDRN Cn1cc([N+](=O)[O-])cc1C(=O)N1CCC[C@]1(c1ccccc1)C(F)(F)F ZINC000548618656 935033226 /nfs/dbraw/zinc/03/32/26/935033226.db2.gz PSQBSSXBUMJZEA-INIZCTEOSA-N 0 0 367.327 3.627 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@](C)(CC)c1nccs1 ZINC000439907400 945071766 /nfs/dbraw/zinc/07/17/66/945071766.db2.gz AVSRFQHXYPPOJM-INIZCTEOSA-N 0 0 364.427 3.897 20 5 FHBDRN O=C(N=c1[nH]c2ccccc2n1-c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000046497683 935069924 /nfs/dbraw/zinc/06/99/24/935069924.db2.gz VCXNFJHWGZPFAG-UHFFFAOYSA-N 0 0 358.357 3.608 20 5 FHBDRN COc1cccc(C(=O)NCCc2cc3ccccc3s2)c1[N+](=O)[O-] ZINC000506713662 945076716 /nfs/dbraw/zinc/07/67/16/945076716.db2.gz JAETWGAMCJWSDP-UHFFFAOYSA-N 0 0 356.403 3.791 20 5 FHBDRN CC(C)(C(=O)Nc1cc(C(F)(F)F)c[nH]c1=O)c1ccccc1[N+](=O)[O-] ZINC000431331854 935100576 /nfs/dbraw/zinc/10/05/76/935100576.db2.gz JQWWVEYEUCCAIK-UHFFFAOYSA-N 0 0 369.299 3.631 20 5 FHBDRN O=C(Nc1cc(C2CC2)[nH]n1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000051380470 935134877 /nfs/dbraw/zinc/13/48/77/935134877.db2.gz DSJSNMNKKSNCAC-UHFFFAOYSA-N 0 0 355.379 3.571 20 5 FHBDRN CC1(C)CCc2cccc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3N)c2O1 ZINC001167531467 935141197 /nfs/dbraw/zinc/14/11/97/935141197.db2.gz OUZSPJWKBVIDHP-UHFFFAOYSA-N 0 0 359.357 3.672 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCCc2c1cnn2C ZINC000539339847 935172536 /nfs/dbraw/zinc/17/25/36/935172536.db2.gz JIEJXAIQLUEKSA-HNNXBMFYSA-N 0 0 374.466 3.636 20 5 FHBDRN Cn1cc(CCNC(=O)Nc2ccc([N+](=O)[O-])cc2F)c2ccc(F)cc21 ZINC000472143561 935174909 /nfs/dbraw/zinc/17/49/09/935174909.db2.gz DQNQCCNTJTWFON-UHFFFAOYSA-N 0 0 374.347 3.729 20 5 FHBDRN Cc1ccc2c(c1)N(C(=O)Cc1c[nH]c3ccc([N+](=O)[O-])cc13)C[C@@H](C)O2 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XKMFVCIFSLTBNF-DZGCQCFKSA-N 0 0 370.331 3.598 20 5 FHBDRN CCOC(=O)c1ccc(NC(=O)c2ccc([N+](=O)[O-])c3cccnc23)cc1 ZINC000119777837 935214107 /nfs/dbraw/zinc/21/41/07/935214107.db2.gz JDMCBDQCMYZRAT-UHFFFAOYSA-N 0 0 365.345 3.572 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N(C)CCCCc1ccccc1 ZINC000511070280 935236913 /nfs/dbraw/zinc/23/69/13/935236913.db2.gz UFGBUQPGKJHZLG-UHFFFAOYSA-N 0 0 362.451 3.547 20 5 FHBDRN CCC[C@H](NC(=O)CN(C)CCc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000511072935 935240219 /nfs/dbraw/zinc/24/02/19/935240219.db2.gz NBYZEARSIHOBAO-IBGZPJMESA-N 0 0 369.465 3.727 20 5 FHBDRN Cc1oc(-c2cccs2)nc1CC(=O)OCc1csc([N+](=O)[O-])c1 ZINC000051429899 935245571 /nfs/dbraw/zinc/24/55/71/935245571.db2.gz FXYOBIMENLHPHE-UHFFFAOYSA-N 0 0 364.404 3.967 20 5 FHBDRN C[C@H](C(=O)Nc1ccccc1Cl)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000511073660 935250963 /nfs/dbraw/zinc/25/09/63/935250963.db2.gz PZEFYCIKMFMFNG-CYBMUJFWSA-N 0 0 361.829 3.750 20 5 FHBDRN COc1cccc(C(=O)Nc2ccc(CN(C)C)c(Cl)c2)c1[N+](=O)[O-] ZINC000478035185 935254020 /nfs/dbraw/zinc/25/40/20/935254020.db2.gz TUVJOYLDWKUCCY-UHFFFAOYSA-N 0 0 363.801 3.571 20 5 FHBDRN O=C(CC1CCSCC1)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000551336080 935258230 /nfs/dbraw/zinc/25/82/30/935258230.db2.gz MYGCGXVFAGIFLK-UHFFFAOYSA-N 0 0 359.245 3.829 20 5 FHBDRN O=C(Nc1cc(Br)cc([N+](=O)[O-])c1)c1ccc2c(c1)CCO2 ZINC000551334876 935258293 /nfs/dbraw/zinc/25/82/93/935258293.db2.gz HQBDHCDTZOTPIT-UHFFFAOYSA-N 0 0 363.167 3.545 20 5 FHBDRN Cc1[nH]nc(C(=O)Nc2cccc(CO[C@H]3CCC[C@@H](C)C3)c2)c1[N+](=O)[O-] ZINC000072061724 935267665 /nfs/dbraw/zinc/26/76/65/935267665.db2.gz XTPQFSVIHGTVCD-WBMJQRKESA-N 0 0 372.425 3.974 20 5 FHBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])c1nc(Cc2cccnc2)no1 ZINC000551397110 935268367 /nfs/dbraw/zinc/26/83/67/935268367.db2.gz GQKLYIANABZREN-SNVBAGLBSA-N 0 0 360.757 3.757 20 5 FHBDRN Cc1cc(C(=O)N2CCC(C(=O)c3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000014412032 935270871 /nfs/dbraw/zinc/27/08/71/935270871.db2.gz OTDKULWEWDJJNU-UHFFFAOYSA-N 0 0 352.390 3.638 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1OCC(=O)Nc1ccc(C(F)(F)F)cc1 ZINC000072068154 935279602 /nfs/dbraw/zinc/27/96/02/935279602.db2.gz MJCIGOHKHFHZDT-UHFFFAOYSA-N 0 0 370.283 3.640 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1cccc(-c2n[nH]c(C3CC3)n2)c1 ZINC000072085121 935289464 /nfs/dbraw/zinc/28/94/64/935289464.db2.gz PYDBLDXWHBPTJK-UHFFFAOYSA-N 0 0 363.377 3.818 20 5 FHBDRN CCCCCc1nnc(NC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])s1 ZINC000119868527 935306303 /nfs/dbraw/zinc/30/63/03/935306303.db2.gz PCFRIPNMZDMABR-UHFFFAOYSA-N 0 0 356.354 3.710 20 5 FHBDRN CCOCc1ccccc1CNC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000119862533 935306785 /nfs/dbraw/zinc/30/67/85/935306785.db2.gz YSJNYQZNVTZXTL-UHFFFAOYSA-N 0 0 353.378 3.543 20 5 FHBDRN CCc1nc(C(C)C)ccc1C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000551556633 935309900 /nfs/dbraw/zinc/30/99/00/935309900.db2.gz QIBNBRDHAWGTAF-UHFFFAOYSA-N 0 0 353.422 3.874 20 5 FHBDRN C[C@@H](CCc1ccccc1[N+](=O)[O-])Nc1ccc2ccn(C)c(=O)c2c1 ZINC000551569544 935311598 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FHBDRN CC(C)(C(=O)N[C@H]1CCO[C@H]1c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000551684376 935329456 /nfs/dbraw/zinc/32/94/56/935329456.db2.gz CLACEAHFCWDHDK-WMZOPIPTSA-N 0 0 354.406 3.519 20 5 FHBDRN C[C@H]1SCCN(C(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@@H]1C ZINC000118283604 935338751 /nfs/dbraw/zinc/33/87/51/935338751.db2.gz QHLQNDXWNQWWRE-GHMZBOCLSA-N 0 0 363.464 3.684 20 5 FHBDRN CSc1ccccc1NC(=O)CN(C)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000051472993 935343898 /nfs/dbraw/zinc/34/38/98/935343898.db2.gz VLEAEAPVNLBLKO-UHFFFAOYSA-N 0 0 363.414 3.526 20 5 FHBDRN CCN(CCc1nccs1)C(=O)c1c([N+](=O)[O-])cccc1C(F)(F)F ZINC000582149525 935348912 /nfs/dbraw/zinc/34/89/12/935348912.db2.gz OYUJOFUFQAHEJX-UHFFFAOYSA-N 0 0 373.356 3.775 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CCC[C@H]1C[C@H](O)c1ccco1 ZINC000119945868 935357706 /nfs/dbraw/zinc/35/77/06/935357706.db2.gz ZUWPWAPXRLBQJR-YOEHRIQHSA-N 0 0 373.409 3.925 20 5 FHBDRN C[C@@H](C(=O)NCCc1c[nH]c2cc(F)ccc12)c1cccc([N+](=O)[O-])c1 ZINC000582156256 935358653 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O=C(O[C@H]([C@@H]1CCCO1)C(F)(F)F)c1ccc([N+](=O)[O-])cc1Cl ZINC000158233434 935461345 /nfs/dbraw/zinc/46/13/45/935461345.db2.gz UWGYHIMNSHZAOM-WDEREUQCSA-N 0 0 353.680 3.515 20 5 FHBDRN C[C@H](CCc1ccco1)NC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000463466161 935474718 /nfs/dbraw/zinc/47/47/18/935474718.db2.gz HUGBPPBJNNIXKG-SNVBAGLBSA-N 0 0 356.300 3.958 20 5 FHBDRN CC(C)CCSc1ccc(C(=O)N[C@H](C)C[C@@H](C)O)cc1[N+](=O)[O-] ZINC000544028068 935481226 /nfs/dbraw/zinc/48/12/26/935481226.db2.gz AZPZPCMLJFQKNF-CHWSQXEVSA-N 0 0 354.472 3.622 20 5 FHBDRN Cc1ccc(C(=O)N2CCC[C@H]2c2ccc3c(c2)OCO3)cc1[N+](=O)[O-] ZINC000077328108 935494146 /nfs/dbraw/zinc/49/41/46/935494146.db2.gz ZGMUQUOVRKBNGG-HNNXBMFYSA-N 0 0 354.362 3.609 20 5 FHBDRN Cc1c(NC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)cnn1-c1ccccc1 ZINC000120060778 935509995 /nfs/dbraw/zinc/50/99/95/935509995.db2.gz RSNACUSNXQHEKO-UHFFFAOYSA-N 0 0 361.361 3.823 20 5 FHBDRN Cc1sc(NC(=O)CN(C)CCc2ccccc2[N+](=O)[O-])c(C)c1C ZINC000511097154 935511801 /nfs/dbraw/zinc/51/18/01/935511801.db2.gz TVIXNJSZDVRJBM-UHFFFAOYSA-N 0 0 361.467 3.695 20 5 FHBDRN CCc1nc(C)c([C@@H](C)N(C)C(=O)COc2ccc([N+](=O)[O-])cc2)s1 ZINC000120059285 935514639 /nfs/dbraw/zinc/51/46/39/935514639.db2.gz BMBWJULGLONEBD-GFCCVEGCSA-N 0 0 363.439 3.521 20 5 FHBDRN CSc1ccc(C(=O)NCCc2cc3ccccc3[nH]2)cc1[N+](=O)[O-] ZINC000120068188 935526163 /nfs/dbraw/zinc/52/61/63/935526163.db2.gz NSPDYXUCKYLTAE-UHFFFAOYSA-N 0 0 355.419 3.771 20 5 FHBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)c1nc(C)no1 ZINC000540732859 935545650 /nfs/dbraw/zinc/54/56/50/935545650.db2.gz GWHKMWXDOLISTM-SNVBAGLBSA-N 0 0 364.427 3.669 20 5 FHBDRN O=C(CSCc1ccco1)Nc1ccc([N+](=O)[O-])cc1Br ZINC000120073631 935547814 /nfs/dbraw/zinc/54/78/14/935547814.db2.gz KBVYQBVSVLNLJT-UHFFFAOYSA-N 0 0 371.212 3.822 20 5 FHBDRN CC(C)(c1ccc(NC(=O)Nc2ccncc2[N+](=O)[O-])cc1)C(F)(F)F ZINC000429611545 945107954 /nfs/dbraw/zinc/10/79/54/945107954.db2.gz NXLJLTHWMOOWCX-UHFFFAOYSA-N 0 0 368.315 3.896 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N(C)[C@@H](C)Cc1ccc(O)cc1 ZINC000439935401 945108931 /nfs/dbraw/zinc/10/89/31/945108931.db2.gz UOTFADZOSWINPK-ZDUSSCGKSA-N 0 0 373.409 3.794 20 5 FHBDRN Cc1[nH]c2ccccc2c1C(=O)CN(C)CCc1ccccc1[N+](=O)[O-] ZINC000511104956 935577289 /nfs/dbraw/zinc/57/72/89/935577289.db2.gz INTMWGLVZKNCDO-UHFFFAOYSA-N 0 0 351.406 3.742 20 5 FHBDRN Cc1ccc(C)c(S(=O)(=O)N2c3ccccc3CC[C@H]2C)c1[N+](=O)[O-] ZINC000478149448 935580098 /nfs/dbraw/zinc/58/00/98/935580098.db2.gz MHLXWRAELVSAEJ-CQSZACIVSA-N 0 0 360.435 3.742 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)Nc1ccccc1N1CCCC1 ZINC000287742779 935586681 /nfs/dbraw/zinc/58/66/81/935586681.db2.gz PTYPFOQHFWGNTF-UHFFFAOYSA-N 0 0 368.437 3.901 20 5 FHBDRN COc1ccc(CNC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1Cl ZINC000178571774 935590785 /nfs/dbraw/zinc/59/07/85/935590785.db2.gz ULPTYACCABTHGM-NSHDSACASA-N 0 0 363.801 3.817 20 5 FHBDRN COc1ccc(CSCC(=O)N(C)[C@H]2CCC(C)(C)C2)cc1[N+](=O)[O-] ZINC000478208358 935592287 /nfs/dbraw/zinc/59/22/87/935592287.db2.gz LIHMCKFTPJDPDK-AWEZNQCLSA-N 0 0 366.483 3.874 20 5 FHBDRN C[C@H]1CCN(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)CC12CCC2 ZINC000467225834 945111474 /nfs/dbraw/zinc/11/14/74/945111474.db2.gz AFBAKIBXKLYOGJ-LBPRGKRZSA-N 0 0 351.834 3.970 20 5 FHBDRN CCOc1cc(C(=O)Nc2cnc([C@H](C)CC)nc2)c([N+](=O)[O-])cc1OC ZINC000478299620 935601105 /nfs/dbraw/zinc/60/11/05/935601105.db2.gz BHFKDEHEUUPUOX-LLVKDONJSA-N 0 0 374.397 3.558 20 5 FHBDRN COc1cc(CNc2cnn(CC(C)C)c2C(F)F)c([N+](=O)[O-])cc1O ZINC000478279493 935606118 /nfs/dbraw/zinc/60/61/18/935606118.db2.gz VIJZCMGMZIUFSZ-UHFFFAOYSA-N 0 0 370.356 3.711 20 5 FHBDRN Cc1ccc([C@H]2COCCN2C(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)o1 ZINC000187743629 935630539 /nfs/dbraw/zinc/63/05/39/935630539.db2.gz GIOXBEVXQOTVJO-QGZVFWFLSA-N 0 0 358.394 3.833 20 5 FHBDRN O=C(c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])N1CCC2(CCC2)C1 ZINC000158205696 935633050 /nfs/dbraw/zinc/63/30/50/935633050.db2.gz OTEVRICHNGHQDV-UHFFFAOYSA-N 0 0 358.316 3.552 20 5 FHBDRN C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000582394652 935636126 /nfs/dbraw/zinc/63/61/26/935636126.db2.gz KULXHTOTPIGVMI-ZIAGYGMSSA-N 0 0 370.405 3.565 20 5 FHBDRN COc1ccc(OC)c(CCNC(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)c1 ZINC000127600810 935644896 /nfs/dbraw/zinc/64/48/96/935644896.db2.gz OKVHLRKJKWKABD-UHFFFAOYSA-N 0 0 373.409 3.593 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@H]1Cc1ccccc1 ZINC000478559285 935646628 /nfs/dbraw/zinc/64/66/28/935646628.db2.gz XGNUPDVVGZUQNP-PBHICJAKSA-N 0 0 356.447 3.919 20 5 FHBDRN Cc1ccc(OCCNC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)c(C)c1 ZINC000519107328 945114414 /nfs/dbraw/zinc/11/44/14/945114414.db2.gz GWJGBZKNYZGIEZ-UHFFFAOYSA-N 0 0 354.362 3.767 20 5 FHBDRN COc1cc(C(=O)N[C@H]2C[C@H](c3ccc(Cl)cc3)C2)ccc1[N+](=O)[O-] ZINC000478580324 935653487 /nfs/dbraw/zinc/65/34/87/935653487.db2.gz NIETVZXBXMGQHG-CTYIDZIISA-N 0 0 360.797 3.933 20 5 FHBDRN CN(C)c1nc2cc(NC(=O)C(C)(C)c3ccccc3[N+](=O)[O-])ccc2o1 ZINC000478588384 935655600 /nfs/dbraw/zinc/65/56/00/935655600.db2.gz HPXPMLKCJSFGSK-UHFFFAOYSA-N 0 0 368.393 3.718 20 5 FHBDRN CS[C@@H]1CCC[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2Br)C1 ZINC000152473961 935660015 /nfs/dbraw/zinc/66/00/15/935660015.db2.gz CWRFGMDKOGIUII-MWLCHTKSSA-N 0 0 373.272 3.761 20 5 FHBDRN CCOC(=O)C1(N(C)C(=O)c2ccc([N+](=O)[O-])cc2Cl)CCCCC1 ZINC000478617329 935671336 /nfs/dbraw/zinc/67/13/36/935671336.db2.gz VDPIFAZTISAUPM-UHFFFAOYSA-N 0 0 368.817 3.586 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N[C@H]1CCCC[C@@H]1n1cccn1 ZINC000127635495 935673315 /nfs/dbraw/zinc/67/33/15/935673315.db2.gz KKHVOZWTVXXETL-HOCLYGCPSA-N 0 0 357.414 3.714 20 5 FHBDRN Cc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2C)cc1NC(=O)N(C)C ZINC000478652785 935675259 /nfs/dbraw/zinc/67/52/59/935675259.db2.gz RFWUERSEALTPII-UHFFFAOYSA-N 0 0 356.382 3.557 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)Cc1c(C)noc1C ZINC000158274437 935676405 /nfs/dbraw/zinc/67/64/05/935676405.db2.gz GZPUJQKITYQNQA-SNVBAGLBSA-N 0 0 363.439 3.673 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N2CCC(O)(c3ccccc3Cl)CC2)c1 ZINC000277592964 935679635 /nfs/dbraw/zinc/67/96/35/935679635.db2.gz NMJWFOLVIPCCEE-UHFFFAOYSA-N 0 0 374.824 3.680 20 5 FHBDRN O=C(OCc1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1CCCN1c1ccccc1 ZINC000785127025 935684986 /nfs/dbraw/zinc/68/49/86/935684986.db2.gz PFEBVYPHKAESGY-INIZCTEOSA-N 0 0 360.797 3.960 20 5 FHBDRN CC(=O)c1ccccc1NC(=O)CCCN(C)Cc1ccccc1[N+](=O)[O-] ZINC000563353748 935686050 /nfs/dbraw/zinc/68/60/50/935686050.db2.gz FTUOFMLELIHNAG-UHFFFAOYSA-N 0 0 369.421 3.648 20 5 FHBDRN CCOc1cc(OCC(=O)N2c3ccccc3CC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000478731765 935687743 /nfs/dbraw/zinc/68/77/43/935687743.db2.gz JAAQVNFXAHIHQV-AWEZNQCLSA-N 0 0 370.405 3.740 20 5 FHBDRN CCNc1ccc(C(=O)N[C@@H]2CCCOc3c(F)cccc32)cc1[N+](=O)[O-] ZINC000478727573 935687864 /nfs/dbraw/zinc/68/78/64/935687864.db2.gz UPEQUIQKTJBYHW-OAHLLOKOSA-N 0 0 373.384 3.809 20 5 FHBDRN O=[N+]([O-])c1ccccc1-n1ccc(-c2nc(-c3cccc(F)c3)no2)n1 ZINC000478729527 935687965 /nfs/dbraw/zinc/68/79/65/935687965.db2.gz ZWDHWVAYOCJAJI-UHFFFAOYSA-N 0 0 351.297 3.637 20 5 FHBDRN COc1cc(Br)ccc1C(=O)N(C)c1cccc([N+](=O)[O-])c1 ZINC000158304085 935689824 /nfs/dbraw/zinc/68/98/24/935689824.db2.gz BCOYWKPLMHUVMZ-UHFFFAOYSA-N 0 0 365.183 3.643 20 5 FHBDRN CC(=O)c1cc([N+](=O)[O-])ccc1OCc1ccc(Cl)cc1-n1cncn1 ZINC000478790907 935722906 /nfs/dbraw/zinc/72/29/06/935722906.db2.gz FCQUVRKZYMYBSI-UHFFFAOYSA-N 0 0 372.768 3.611 20 5 FHBDRN Cc1ccccc1CN(C)C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000023599109 935732152 /nfs/dbraw/zinc/73/21/52/935732152.db2.gz SIARNMHCZBSDEI-UHFFFAOYSA-N 0 0 353.422 3.776 20 5 FHBDRN O=C(NC[C@H](O)C1CCCCC1)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000277615997 935732949 /nfs/dbraw/zinc/73/29/49/935732949.db2.gz BIHCQCJBTTVMQZ-IBGZPJMESA-N 0 0 364.445 3.765 20 5 FHBDRN Cc1cc(OCC(=O)N[C@@H](C)c2ccccc2Cl)c(F)cc1[N+](=O)[O-] ZINC000478889415 935752185 /nfs/dbraw/zinc/75/21/85/935752185.db2.gz PKVAAADRTPXSKG-NSHDSACASA-N 0 0 366.776 3.952 20 5 FHBDRN CCc1ccc([C@H](C)NC(=O)COc2cc(C)c([N+](=O)[O-])cc2F)cc1 ZINC000478911899 935753747 /nfs/dbraw/zinc/75/37/47/935753747.db2.gz VJGJZZOFRIAQRX-ZDUSSCGKSA-N 0 0 360.385 3.861 20 5 FHBDRN COc1cc(C(=O)N2CCC[C@@H]2CCC(C)C)c([N+](=O)[O-])cc1OC ZINC000158364726 935754761 /nfs/dbraw/zinc/75/47/61/935754761.db2.gz FZYZOMBYWVWKKY-CYBMUJFWSA-N 0 0 350.415 3.653 20 5 FHBDRN Cc1nn(C)c(C(=O)Nc2ccccc2Oc2ccc(C)cc2)c1[N+](=O)[O-] ZINC000127732317 935759329 /nfs/dbraw/zinc/75/93/29/935759329.db2.gz LDLUAXHCMPCUFB-UHFFFAOYSA-N 0 0 366.377 3.990 20 5 FHBDRN Cc1c(CNC(=O)NCc2ccccc2OC(C)C)cccc1[N+](=O)[O-] ZINC000478936816 935759432 /nfs/dbraw/zinc/75/94/32/935759432.db2.gz MGZITRMNBJLRGB-UHFFFAOYSA-N 0 0 357.410 3.690 20 5 FHBDRN Nc1c(C(=O)Nc2ccc(Br)c(Cl)c2)cccc1[N+](=O)[O-] ZINC000227614349 935761154 /nfs/dbraw/zinc/76/11/54/935761154.db2.gz CSPIEFLGFBWWAG-UHFFFAOYSA-N 0 0 370.590 3.845 20 5 FHBDRN CC[C@@]1(c2ccc(C)cc2)CC(=O)N(Cc2ccccc2[N+](=O)[O-])C1=O ZINC000158382161 935765768 /nfs/dbraw/zinc/76/57/68/935765768.db2.gz LNUBSRNDSNYHSM-FQEVSTJZSA-N 0 0 352.390 3.510 20 5 FHBDRN Cc1c(OC(=O)CCCc2nc(-c3cccs3)no2)cccc1[N+](=O)[O-] ZINC000051706068 935768707 /nfs/dbraw/zinc/76/87/07/935768707.db2.gz ZUKWIZGZDQILPU-UHFFFAOYSA-N 0 0 373.390 3.943 20 5 FHBDRN O=C(/C=C/c1ccc([N+](=O)[O-])cc1)Oc1ccc(NC(=O)C2CC2)cc1 ZINC000051706641 935769461 /nfs/dbraw/zinc/76/94/61/935769461.db2.gz IDXXVQOZJAHTCO-KGVSQERTSA-N 0 0 352.346 3.562 20 5 FHBDRN CN(Cc1cc(F)cc(F)c1)c1ncc(Br)cc1[N+](=O)[O-] ZINC000431425229 935770515 /nfs/dbraw/zinc/77/05/15/935770515.db2.gz BQDGPMBUMLDHBH-UHFFFAOYSA-N 0 0 358.142 3.667 20 5 FHBDRN CCOc1cccc([C@@H]2C[C@H]2NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000437210575 945123338 /nfs/dbraw/zinc/12/33/38/945123338.db2.gz RZAVFGRZTGYVEA-RBUKOAKNSA-N 0 0 368.433 3.943 20 5 FHBDRN O=C(N[C@@H]1CCO[C@H](c2ccccc2)C1)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000158422548 935786163 /nfs/dbraw/zinc/78/61/63/935786163.db2.gz XVOMAZQIAFVLIS-KUHUBIRLSA-N 0 0 365.389 3.726 20 5 FHBDRN CC(C)(CNC(=O)c1ccc([N+](=O)[O-])o1)c1cccc(Br)c1 ZINC000158422667 935786471 /nfs/dbraw/zinc/78/64/71/935786471.db2.gz MCKZKSBXERINRL-UHFFFAOYSA-N 0 0 367.199 3.658 20 5 FHBDRN COc1ccc(CCCN(C)C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000050153203 935788354 /nfs/dbraw/zinc/78/83/54/935788354.db2.gz IWLHVJMDBRJTLM-HNNXBMFYSA-N 0 0 371.437 3.939 20 5 FHBDRN CC[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1Br)c1ccncc1 ZINC000158435435 935795800 /nfs/dbraw/zinc/79/58/00/935795800.db2.gz WHFKPVQUHKYTCY-AWEZNQCLSA-N 0 0 364.199 3.633 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@H](c2ccc(F)cc2)C1 ZINC000431435865 935797697 /nfs/dbraw/zinc/79/76/97/935797697.db2.gz QTGUZBYYKCEIGP-ZDUSSCGKSA-N 0 0 359.357 3.764 20 5 FHBDRN COc1cc(COc2nc(C)cc(C)c2[N+](=O)[O-])ccc1OC(F)F ZINC000479158599 935811300 /nfs/dbraw/zinc/81/13/00/935811300.db2.gz HKMDJJOOOOHHLJ-UHFFFAOYSA-N 0 0 354.309 3.796 20 5 FHBDRN CC[C@H](NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)c1ccncc1 ZINC000158460267 935813754 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FHBDRN COc1cc(Cc2noc([C@@H]3CCCCS3)n2)c([N+](=O)[O-])c(OC)c1 ZINC000277944986 936230094 /nfs/dbraw/zinc/23/00/94/936230094.db2.gz FFLHWJKAUDBFTF-ZDUSSCGKSA-N 0 0 365.411 3.544 20 5 FHBDRN NC(=O)c1ccc(COc2cc(C(F)(F)F)ccc2Cl)c([N+](=O)[O-])c1 ZINC000612390902 936234983 /nfs/dbraw/zinc/23/49/83/936234983.db2.gz TURNZYFUOOGXQF-UHFFFAOYSA-N 0 0 374.702 3.945 20 5 FHBDRN CCc1ccc([C@H](NCc2cnn(CC)c2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000612411597 936236493 /nfs/dbraw/zinc/23/64/93/936236493.db2.gz BQMLSRPIEGKTST-LJQANCHMSA-N 0 0 354.410 3.846 20 5 FHBDRN Cc1cc(F)cc(C(=O)Nc2ccc(C(=O)NC(C)(C)C)cc2)c1[N+](=O)[O-] ZINC000121973197 936239844 /nfs/dbraw/zinc/23/98/44/936239844.db2.gz JEWDKIQVAFMOHZ-UHFFFAOYSA-N 0 0 373.384 3.823 20 5 FHBDRN C[C@H]1CN(C(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)CC(C)(C)O1 ZINC000065610652 936250287 /nfs/dbraw/zinc/25/02/87/936250287.db2.gz HLFOAJCFCXZWOZ-AWEZNQCLSA-N 0 0 369.421 3.978 20 5 FHBDRN O=[N+]([O-])c1cccc(OCC[NH+]2CCC(COc3ccccc3)CC2)c1 ZINC000065612615 936250374 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O=C(Nc1cc2c(cn1)CCC2)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000582926370 936299367 /nfs/dbraw/zinc/29/93/67/936299367.db2.gz YJXFHHARSLEHOL-UHFFFAOYSA-N 0 0 355.397 3.817 20 5 FHBDRN C[C@@H](C(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1)n1cnc2ccccc21 ZINC000178716255 936303816 /nfs/dbraw/zinc/30/38/16/936303816.db2.gz FRHIGNARUWTKMT-AWEZNQCLSA-N 0 0 364.405 3.697 20 5 FHBDRN CCCC(=O)Nc1ccc(CNC(=O)Cc2cccc([N+](=O)[O-])c2C)cc1 ZINC000161782864 936305810 /nfs/dbraw/zinc/30/58/10/936305810.db2.gz FMVIBNJXLDRNQK-UHFFFAOYSA-N 0 0 369.421 3.501 20 5 FHBDRN CC1(C)CCC[C@H]1N(Cc1ccccc1)C(=O)CCn1cc([N+](=O)[O-])cn1 ZINC000427174540 945158544 /nfs/dbraw/zinc/15/85/44/945158544.db2.gz LEROIBIQSBSUFB-GOSISDBHSA-N 0 0 370.453 3.789 20 5 FHBDRN CCc1cnccc1[C@H](C)NC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F ZINC000545140783 938249505 /nfs/dbraw/zinc/24/95/05/938249505.db2.gz NRDKISDACPLCEQ-LBPRGKRZSA-N 0 0 359.401 3.846 20 5 FHBDRN O=C(NCc1ccccc1COCc1ccccc1)c1ccc([N+](=O)[O-])o1 ZINC000046595033 938257054 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O=C(NC[C@H]1CC[C@H](c2ccccc2)O1)c1c[nH]c2cc([N+](=O)[O-])ccc21 ZINC000583507322 938284042 /nfs/dbraw/zinc/28/40/42/938284042.db2.gz QAPWWKTUDUCPSP-DNVCBOLYSA-N 0 0 365.389 3.726 20 5 FHBDRN CC1(C)Cc2cc(NC(=O)N3CCc4c(cccc4[N+](=O)[O-])C3)ccc2O1 ZINC000536058858 938289069 /nfs/dbraw/zinc/28/90/69/938289069.db2.gz DTOZLANPAPFFAV-UHFFFAOYSA-N 0 0 367.405 3.899 20 5 FHBDRN CCC(CC)[C@H](CCNC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1)OC ZINC000536065775 938297795 /nfs/dbraw/zinc/29/77/95/938297795.db2.gz VTGPVBDGHSLUMS-SFHVURJKSA-N 0 0 363.458 3.504 20 5 FHBDRN O=C(CC[C@@H]1CCCCO1)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000278308652 938299172 /nfs/dbraw/zinc/29/91/72/938299172.db2.gz DENUUTOLQGROJM-AWEZNQCLSA-N 0 0 360.332 3.579 20 5 FHBDRN Cc1cc(N2CCC(C(=O)NCc3ccc(F)cc3)CC2)ccc1[N+](=O)[O-] ZINC000052427960 938300613 /nfs/dbraw/zinc/30/06/13/938300613.db2.gz RNHGZGBDLYGFFA-UHFFFAOYSA-N 0 0 371.412 3.575 20 5 FHBDRN C[C@H](NC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1)c1cn[nH]c1 ZINC000536069750 938301268 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0 0 353.378 3.581 20 5 FHBDRN COc1cc(N2CC[C@@]3(C2)CCc2ccccc2O3)c(F)cc1[N+](=O)[O-] ZINC000583623535 938323979 /nfs/dbraw/zinc/32/39/79/938323979.db2.gz OUKKVMHXXDIIGR-LJQANCHMSA-N 0 0 358.369 3.717 20 5 FHBDRN COc1cc(CNc2ncccn2)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000187922616 938326350 /nfs/dbraw/zinc/32/63/50/938326350.db2.gz RPUCFWAIRDEKPI-UHFFFAOYSA-N 0 0 366.377 3.585 20 5 FHBDRN CCN(C(=O)c1cc(OC)c(OC(F)F)cc1[N+](=O)[O-])C1CCCCC1 ZINC000514935447 938328353 /nfs/dbraw/zinc/32/83/53/938328353.db2.gz CLUTYAUNGPOSDE-UHFFFAOYSA-N 0 0 372.368 4.000 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)N[C@H]2[C@H](C)CCC[C@@H]2C)cc1SC ZINC000246038493 938331925 /nfs/dbraw/zinc/33/19/25/938331925.db2.gz WZOXJAXMRCQBCR-CDMJZVDBSA-N 0 0 352.456 3.880 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCO[C@H](c3ccc(Cl)cc3)C2)c([N+](=O)[O-])c1 ZINC000052489657 938338908 /nfs/dbraw/zinc/33/89/08/938338908.db2.gz OUDZDSCRCZFEGQ-INIZCTEOSA-N 0 0 363.757 3.734 20 5 FHBDRN C[C@@H]1c2cc(F)cc(F)c2CCN1C(=O)c1ccc([N+](=O)[O-])cc1F 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FHBDRN CC[NH+](CC)[C@H](CNc1ccc([N+](=O)[O-])c(C(=O)[O-])c1)c1ccsc1 ZINC000583712730 938371694 /nfs/dbraw/zinc/37/16/94/938371694.db2.gz WANAKUVCPMJGQI-MRXNPFEDSA-N 0 0 363.439 3.850 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](C)c2nccn2-c2ccccc2)c1 ZINC000583713618 938371938 /nfs/dbraw/zinc/37/19/38/938371938.db2.gz FWCXKWAJJFXCAE-AWEZNQCLSA-N 0 0 350.378 3.580 20 5 FHBDRN Cc1csc(-c2cccc(C(=O)N(C)c3ccc([N+](=O)[O-])nc3)c2)n1 ZINC000583716441 938374738 /nfs/dbraw/zinc/37/47/38/938374738.db2.gz BJYFTNHOVJMWOV-UHFFFAOYSA-N 0 0 354.391 3.698 20 5 FHBDRN C[C@]12CN(C(=O)c3ccc([N+](=O)[O-])c4cccnc34)C[C@H]1[C@@H]1CC[C@H]2C1 ZINC000583737056 938382478 /nfs/dbraw/zinc/38/24/78/938382478.db2.gz AIWVKOYHQPELIY-AFTNEDFKSA-N 0 0 351.406 3.651 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(NCc2ccc(C(C)(F)F)cc2)n1 ZINC000432134844 945170232 /nfs/dbraw/zinc/17/02/32/945170232.db2.gz WHXWQMWAAPZJAJ-UHFFFAOYSA-N 0 0 351.309 3.500 20 5 FHBDRN C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N(C)Cc1cc2ccccc2o1 ZINC000472300972 938391699 /nfs/dbraw/zinc/39/16/99/938391699.db2.gz ZARFGEVWDAYWBB-ZDUSSCGKSA-N 0 0 353.378 3.800 20 5 FHBDRN CCc1cccnc1NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000506006713 945172900 /nfs/dbraw/zinc/17/29/00/945172900.db2.gz FDKBWQFDTAKMJH-UHFFFAOYSA-N 0 0 354.391 3.928 20 5 FHBDRN CCc1cnccc1CNC(=O)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000458689499 938432381 /nfs/dbraw/zinc/43/23/81/938432381.db2.gz SUMJTLVMNYIXMT-SFHVURJKSA-N 0 0 368.437 3.641 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000161899193 938433153 /nfs/dbraw/zinc/43/31/53/938433153.db2.gz BUAFVJSYZKZBFJ-UHFFFAOYSA-N 0 0 361.741 3.749 20 5 FHBDRN Cc1cccc(C)c1NC(=O)CNc1cc(C(F)(F)F)ncc1[N+](=O)[O-] ZINC000278445158 938434089 /nfs/dbraw/zinc/43/40/89/938434089.db2.gz RBWULKHFHOIARF-UHFFFAOYSA-N 0 0 368.315 3.676 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CCC(Oc2ncccc2F)CC1 ZINC000278443277 938435788 /nfs/dbraw/zinc/43/57/88/938435788.db2.gz FKXKRXXADRQCCG-UHFFFAOYSA-N 0 0 374.372 3.513 20 5 FHBDRN O=[N+]([O-])c1ccc(CN2CCO[C@@]3(CCc4ccccc43)C2)c(Cl)c1 ZINC000611792709 938454549 /nfs/dbraw/zinc/45/45/49/938454549.db2.gz NCUQPJLKINKFDY-IBGZPJMESA-N 0 0 358.825 3.922 20 5 FHBDRN C[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)c1cc2c(cc1[N+](=O)[O-])OCCCO2 ZINC001126454604 945176361 /nfs/dbraw/zinc/17/63/61/945176361.db2.gz RSNHRHMWNQKMSS-NFAWXSAZSA-N 0 0 360.410 3.549 20 5 FHBDRN C[C@]1(NC(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CC=CCC1 ZINC000458709478 938460957 /nfs/dbraw/zinc/46/09/57/938460957.db2.gz UBXDLUAMKSNKPE-HNNXBMFYSA-N 0 0 357.332 3.912 20 5 FHBDRN Cn1cc(C(=O)N2CC(C3CCCCC3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000583891774 938469864 /nfs/dbraw/zinc/46/98/64/938469864.db2.gz JNCFCJVUDZOPBF-UHFFFAOYSA-N 0 0 368.437 3.648 20 5 FHBDRN Cc1ccncc1N1CCN(c2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)CC1 ZINC000573005826 938471142 /nfs/dbraw/zinc/47/11/42/938471142.db2.gz CXGBBWBLLSPKES-UHFFFAOYSA-N 0 0 370.453 3.802 20 5 FHBDRN CC(=O)c1cc([N+](=O)[O-])ccc1OCC(=O)N[C@H](C)c1ccc(C)c(C)c1 ZINC000536156203 938473815 /nfs/dbraw/zinc/47/38/15/938473815.db2.gz WQIVZMGFUGRXRF-CQSZACIVSA-N 0 0 370.405 3.670 20 5 FHBDRN CCc1ccnc(CNC(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000458719238 938475844 /nfs/dbraw/zinc/47/58/44/938475844.db2.gz AUHWRDWRIHETTH-QGZVFWFLSA-N 0 0 368.437 3.641 20 5 FHBDRN COc1ccc(C(=O)N2CCc3c(F)cc(F)cc3[C@H]2C)cc1[N+](=O)[O-] ZINC000468359093 938480319 /nfs/dbraw/zinc/48/03/19/938480319.db2.gz PWFIGVZCBFKPOJ-SNVBAGLBSA-N 0 0 362.332 3.641 20 5 FHBDRN Cc1cc2c(cc1C)[C@H](C(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1)CO2 ZINC000472306759 938484816 /nfs/dbraw/zinc/48/48/16/938484816.db2.gz UMBYQWONAUZZJE-QGZVFWFLSA-N 0 0 354.406 3.739 20 5 FHBDRN C[C@@H]1CCC[C@@H](NC(=O)COc2ccc([N+](=O)[O-])cc2C(F)(F)F)[C@@H]1C ZINC000516715118 945179817 /nfs/dbraw/zinc/17/98/17/945179817.db2.gz OIHNQXNPTPQRAF-JTNHKYCSSA-N 0 0 374.359 3.933 20 5 FHBDRN COC(=O)[C@@H](C)CSc1cc(C(F)(F)C(F)(F)F)ncc1[N+](=O)[O-] ZINC000278513414 938493927 /nfs/dbraw/zinc/49/39/27/938493927.db2.gz RQRSJZKKZJICOP-LURJTMIESA-N 0 0 374.287 3.545 20 5 FHBDRN Cc1c(Br)c(N2CCCc3occc3C2)ncc1[N+](=O)[O-] ZINC000583956755 938501011 /nfs/dbraw/zinc/50/10/11/938501011.db2.gz VICTXVNQSYGZRC-UHFFFAOYSA-N 0 0 352.188 3.607 20 5 FHBDRN Cc1ccc(N(C)C(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)nc1 ZINC000573014984 938518716 /nfs/dbraw/zinc/51/87/16/938518716.db2.gz KCMVXPQRGDXRMV-UHFFFAOYSA-N 0 0 364.199 3.646 20 5 FHBDRN Cc1c(Br)cc(C(=O)N[C@@H]2CCC[C@H](F)C2)cc1[N+](=O)[O-] ZINC000583996418 938526183 /nfs/dbraw/zinc/52/61/83/938526183.db2.gz QULHGDKMCMHCQH-WDEREUQCSA-N 0 0 359.195 3.676 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@H]1CCc2ccc(C(C)C)cc21 ZINC001211606801 938538622 /nfs/dbraw/zinc/53/86/22/938538622.db2.gz YITZBJBICVDENU-SFHVURJKSA-N 0 0 374.462 3.992 20 5 FHBDRN Cc1ccc([C@H]2CCCN2C(=O)NCCc2cccc([N+](=O)[O-])c2)cc1 ZINC000536201430 938565807 /nfs/dbraw/zinc/56/58/07/938565807.db2.gz VGCKYLZQWXMPRQ-LJQANCHMSA-N 0 0 353.422 3.992 20 5 FHBDRN CCc1ccc(C(=O)N2Cc3ccc(OC)cc3C3(CC3)C2)cc1[N+](=O)[O-] ZINC000584059720 938575483 /nfs/dbraw/zinc/57/54/83/938575483.db2.gz FPIXCTRRDWMSFQ-UHFFFAOYSA-N 0 0 366.417 3.853 20 5 FHBDRN Cc1ccccc1C[C@H]1CCCN1C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000536207210 938582723 /nfs/dbraw/zinc/58/27/23/938582723.db2.gz PMLBACJMJVCPJF-LJQANCHMSA-N 0 0 367.449 3.862 20 5 FHBDRN Cc1ccccc1C[C@@H]1CCCN1C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000536207209 938582744 /nfs/dbraw/zinc/58/27/44/938582744.db2.gz PMLBACJMJVCPJF-IBGZPJMESA-N 0 0 367.449 3.862 20 5 FHBDRN Cc1cc(C(=O)Nc2cncc(Cl)c2Br)ccc1[N+](=O)[O-] ZINC000584077502 938584926 /nfs/dbraw/zinc/58/49/26/938584926.db2.gz RZHHUPBGKGRKAE-UHFFFAOYSA-N 0 0 370.590 3.966 20 5 FHBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)c1cccc(-n2cccn2)c1 ZINC000135499678 938599054 /nfs/dbraw/zinc/59/90/54/938599054.db2.gz LPAFNILVIIBHED-UHFFFAOYSA-N 0 0 356.769 3.995 20 5 FHBDRN COc1cc(-c2noc(C(C)(C)c3ccc([N+](=O)[O-])cc3)n2)cc(C)n1 ZINC000584101344 938601591 /nfs/dbraw/zinc/60/15/91/938601591.db2.gz IFRWXDRNUMKART-UHFFFAOYSA-N 0 0 354.366 3.683 20 5 FHBDRN CSc1ccc(-c2nc(-c3cn(C)nc3C(C)C)no2)cc1[N+](=O)[O-] ZINC000426219771 945189485 /nfs/dbraw/zinc/18/94/85/945189485.db2.gz ZLWMMVIUAOKCOA-UHFFFAOYSA-N 0 0 359.411 3.891 20 5 FHBDRN COC(=O)c1cc(C)nc(Oc2ccc(Br)cc2)c1[N+](=O)[O-] ZINC000584164308 938623108 /nfs/dbraw/zinc/62/31/08/938623108.db2.gz OTAPEYHWXNVPLT-UHFFFAOYSA-N 0 0 367.155 3.640 20 5 FHBDRN Cc1csc([C@@H](C)NCc2cccc([N+](=O)[O-])c2Br)n1 ZINC000235189668 938630422 /nfs/dbraw/zinc/63/04/22/938630422.db2.gz XPHQKFVTMKSEIY-SECBINFHSA-N 0 0 356.245 3.973 20 5 FHBDRN Cc1cnc([C@@H](C)NCc2cccc([N+](=O)[O-])c2Br)s1 ZINC000235189708 938630514 /nfs/dbraw/zinc/63/05/14/938630514.db2.gz JZNSEAOKUBDCAT-SECBINFHSA-N 0 0 356.245 3.973 20 5 FHBDRN Cc1ncc([N+](=O)[O-])c(OCC(=O)NC[C@@H](c2ccccc2)C(C)C)c1C ZINC000584183452 938631378 /nfs/dbraw/zinc/63/13/78/938631378.db2.gz IWTPTKZIUVRTIW-QGZVFWFLSA-N 0 0 371.437 3.541 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@H](CSC)C1 ZINC000584190110 938636580 /nfs/dbraw/zinc/63/65/80/938636580.db2.gz KKJNGJGGQNMZHG-LBPRGKRZSA-N 0 0 354.497 3.922 20 5 FHBDRN CS(=O)(=O)Cc1ccc(N[C@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000278673139 938640445 /nfs/dbraw/zinc/64/04/45/938640445.db2.gz JIUUEVAJZHWSIF-SFHVURJKSA-N 0 0 360.435 3.629 20 5 FHBDRN Cn1cc(CNc2cccc(-c3cc[nH]n3)c2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000179070921 938648132 /nfs/dbraw/zinc/64/81/32/938648132.db2.gz JTRDGZJDOYRZHT-UHFFFAOYSA-N 0 0 374.404 3.998 20 5 FHBDRN O=c1[nH]c(N[C@H]2CC[C@H](c3ccc(F)cc3)C2)nc2ccc([N+](=O)[O-])cc12 ZINC000573155044 938654739 /nfs/dbraw/zinc/65/47/39/938654739.db2.gz XSVRPMAXPILTOV-JSGCOSHPSA-N 0 0 368.368 3.553 20 5 FHBDRN Cc1ccc(I)c(Oc2ncccc2[N+](=O)[O-])c1 ZINC000080680419 938657291 /nfs/dbraw/zinc/65/72/91/938657291.db2.gz ISOQRCJCGXNVLS-UHFFFAOYSA-N 0 0 356.119 3.695 20 5 FHBDRN CCc1nc(Cc2noc(-c3cc(OC)c(C)c([N+](=O)[O-])c3)n2)cs1 ZINC000584257460 938658579 /nfs/dbraw/zinc/65/85/79/938658579.db2.gz RRHXSPZFSVKRCL-UHFFFAOYSA-N 0 0 360.395 3.572 20 5 FHBDRN CCS[C@@H]1CCC[C@H](Nc2nc(C)cc(C(=O)OC)c2[N+](=O)[O-])C1 ZINC000584249105 938658663 /nfs/dbraw/zinc/65/86/63/938658663.db2.gz ULHUJKDIPGRMKT-NWDGAFQWSA-N 0 0 353.444 3.561 20 5 FHBDRN Cc1ccc(C)c(NC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)c1 ZINC000052916394 938661667 /nfs/dbraw/zinc/66/16/67/938661667.db2.gz DDNGQAMHDDHZLH-UHFFFAOYSA-N 0 0 350.378 3.864 20 5 FHBDRN CC1(C)CCC[C@H](C[NH2+][C@H](Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C(=O)[O-])C1 ZINC000584268216 938662619 /nfs/dbraw/zinc/66/26/19/938662619.db2.gz QYHIGBRFAKCCBY-SCLBCKFNSA-N 0 0 373.453 3.878 20 5 FHBDRN O=[N+]([O-])c1ccccc1NCCNc1ccc([N+](=O)[O-])c2cnccc12 ZINC000018060468 945194120 /nfs/dbraw/zinc/19/41/20/945194120.db2.gz ZOMIZDHUNYVSFY-UHFFFAOYSA-N 0 0 353.338 3.575 20 5 FHBDRN CC(C)CCSc1ccc(C(=O)NCC2(CCO)CC2)cc1[N+](=O)[O-] ZINC000187955820 938664749 /nfs/dbraw/zinc/66/47/49/938664749.db2.gz HMWLESBIUQELCW-UHFFFAOYSA-N 0 0 366.483 3.625 20 5 FHBDRN COc1ccc2c(c1)C1(CC1)CN(C(=O)c1cccc(C)c1[N+](=O)[O-])C2 ZINC000573173164 938670084 /nfs/dbraw/zinc/67/00/84/938670084.db2.gz YQJCGKLZKZSFJG-UHFFFAOYSA-N 0 0 352.390 3.599 20 5 FHBDRN Cc1cc(OCC(=O)N[C@@H](C)c2cccs2)c(Cl)cc1[N+](=O)[O-] ZINC000506424743 945197507 /nfs/dbraw/zinc/19/75/07/945197507.db2.gz XXBLOTVASSAVIS-JTQLQIEISA-N 0 0 354.815 3.874 20 5 FHBDRN CCCCN(CCCO)C(=O)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000278738321 938710358 /nfs/dbraw/zinc/71/03/58/938710358.db2.gz SKWZSMMHIQZVRE-UHFFFAOYSA-N 0 0 352.434 3.718 20 5 FHBDRN COc1ccccc1C[C@H](C)N(C)C(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000080997323 938713061 /nfs/dbraw/zinc/71/30/61/938713061.db2.gz BSGWWJYAVYADOY-LBPRGKRZSA-N 0 0 362.813 3.960 20 5 FHBDRN CCOc1ccc(C(=O)N[C@@H]2CCCC[C@H]2SCC)cc1[N+](=O)[O-] ZINC000427225226 945199955 /nfs/dbraw/zinc/19/99/55/945199955.db2.gz FOKSMJJVUGXZFE-CZUORRHYSA-N 0 0 352.456 3.788 20 5 FHBDRN CCOC1(CNC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)CCCC1 ZINC000506425430 945201857 /nfs/dbraw/zinc/20/18/57/945201857.db2.gz AGFNIKUORDOWJV-CYBMUJFWSA-N 0 0 352.456 3.541 20 5 FHBDRN CC(C)(CNC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1)c1cccs1 ZINC000124266605 945202663 /nfs/dbraw/zinc/20/26/63/945202663.db2.gz XVSFWLZHCNOJKL-UHFFFAOYSA-N 0 0 359.451 3.702 20 5 FHBDRN C[C@H]1C[C@H](c2cccs2)CN1C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000371002443 945203439 /nfs/dbraw/zinc/20/34/39/945203439.db2.gz ZRNANUZVUDBYIN-JQWIXIFHSA-N 0 0 361.379 3.583 20 5 FHBDRN COc1cc(-c2nc(-c3ccc(OC(C)(C)C)cn3)no2)ccc1[N+](=O)[O-] ZINC000426564019 945204010 /nfs/dbraw/zinc/20/40/10/945204010.db2.gz AEMRLQMHXMDSLA-UHFFFAOYSA-N 0 0 370.365 3.893 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1OC(=O)c1ccc(OC[C@@H]2CCCO2)cc1 ZINC000760022720 945204175 /nfs/dbraw/zinc/20/41/75/945204175.db2.gz PEJPRASTXKDWOA-INIZCTEOSA-N 0 0 357.362 3.680 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1C(=O)NCc1cc(Br)cs1 ZINC000070212719 938801349 /nfs/dbraw/zinc/80/13/49/938801349.db2.gz UFETVKWQKSPONY-UHFFFAOYSA-N 0 0 355.213 3.657 20 5 FHBDRN CCc1c(NC(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)cnn1CCC(C)C ZINC000427212283 945205706 /nfs/dbraw/zinc/20/57/06/945205706.db2.gz OGRYAUPMBKEYJD-UHFFFAOYSA-N 0 0 374.441 3.969 20 5 FHBDRN Cc1cc(OCC(=O)N2CCc3ccccc3C2)c(Cl)cc1[N+](=O)[O-] ZINC000506432131 945205972 /nfs/dbraw/zinc/20/59/72/945205972.db2.gz JQCNBESBOYQIDP-UHFFFAOYSA-N 0 0 360.797 3.520 20 5 FHBDRN O=C(Nc1ccccc1NC(=O)c1cccs1)c1ccc([N+](=O)[O-])o1 ZINC000102306350 938838686 /nfs/dbraw/zinc/83/86/86/938838686.db2.gz MTPVDHGQZZNMNE-UHFFFAOYSA-N 0 0 357.347 3.754 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CC2(CCC2)[C@H]1[C@H]1CCCO1 ZINC000289878230 938866507 /nfs/dbraw/zinc/86/65/07/938866507.db2.gz SMLDQMXVMNUCII-IAGOWNOFSA-N 0 0 359.426 3.777 20 5 FHBDRN CC(C)COC[C@H](NC(=O)[C@H]1C[C@H]1c1cccc([N+](=O)[O-])c1)c1ccco1 ZINC001125707718 938868754 /nfs/dbraw/zinc/86/87/54/938868754.db2.gz DRLWGJDVFDRPKA-BZSNNMDCSA-N 0 0 372.421 3.821 20 5 FHBDRN C[C@@H](Nc1ccc([N+](=O)[O-])c(-c2ccccc2)n1)c1nnc2ccccn21 ZINC000090068948 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FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)N[C@H](c1ccccc1)C1CCC1 ZINC000511255667 938920154 /nfs/dbraw/zinc/92/01/54/938920154.db2.gz AOKJBZCSPXEWAT-LJQANCHMSA-N 0 0 353.422 3.978 20 5 FHBDRN CCC[C@H](C)NC(=O)[C@H]1CCCN(c2ccc3ncccc3c2[N+](=O)[O-])C1 ZINC000050933879 938954875 /nfs/dbraw/zinc/95/48/75/938954875.db2.gz GMPQATPZDBTXAX-GJZGRUSLSA-N 0 0 370.453 3.664 20 5 FHBDRN C[C@@H](NC(=O)Cn1c2ccccc2c(=O)c2ccccc21)c1cccc(O)c1 ZINC000171383427 938969600 /nfs/dbraw/zinc/96/96/00/938969600.db2.gz PDTMHYUFSLORJI-OAHLLOKOSA-N 0 0 372.424 3.738 20 5 FHBDRN C[C@@H](Sc1ncccc1[N+](=O)[O-])C(=O)N1CCSc2ccccc21 ZINC000065692815 938972899 /nfs/dbraw/zinc/97/28/99/938972899.db2.gz JLBBCYHJQHBAAV-LLVKDONJSA-N 0 0 361.448 3.609 20 5 FHBDRN Cc1ccccc1[C@@]1(F)CCN(C(=O)NCc2cccc([N+](=O)[O-])c2C)C1 ZINC000409629426 938973975 /nfs/dbraw/zinc/97/39/75/938973975.db2.gz HNEVCIACNKIFTN-HXUWFJFHSA-N 0 0 371.412 3.992 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)[C@@H]1COc2ccccc2C1 ZINC000543853972 938976528 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CC(C)c1ccc([C@@H]2CCCCN2C(=O)Cn2cc([N+](=O)[O-])cn2)cc1 ZINC000179352574 939084274 /nfs/dbraw/zinc/08/42/74/939084274.db2.gz BIHNMJXCHIDLQD-SFHVURJKSA-N 0 0 356.426 3.669 20 5 FHBDRN O=C(NC[C@H]1CCC[C@@H](C(F)(F)F)C1)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000438923180 945227368 /nfs/dbraw/zinc/22/73/68/945227368.db2.gz XTQFTCJPZRJABA-VHSXEESVSA-N 0 0 370.331 3.570 20 5 FHBDRN COc1ccc(C(=O)Nc2cnn(-c3ccc(C)cc3C)c2)cc1[N+](=O)[O-] ZINC000188266163 939126162 /nfs/dbraw/zinc/12/61/62/939126162.db2.gz GAKQWXZWHSNJIG-UHFFFAOYSA-N 0 0 366.377 3.658 20 5 FHBDRN C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CCc2ccc(F)cc21 ZINC000179390531 939139949 /nfs/dbraw/zinc/13/99/49/939139949.db2.gz ITSGYONQBZDQJC-LLVKDONJSA-N 0 0 354.341 3.908 20 5 FHBDRN CC(C)(C)N1C[C@@H](NC(=O)c2cc3ccccc3c3cccnc23)CC1=O ZINC000472367436 939140410 /nfs/dbraw/zinc/14/04/10/939140410.db2.gz JEXUUZSJQWUYIT-HNNXBMFYSA-N 0 0 361.445 3.517 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCCCc2ccccc21 ZINC000065791596 939151825 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372.396 3.691 20 5 FHBDRN CC1(C)CN(C(=O)CSc2ccc([N+](=O)[O-])cc2)c2ccccc2O1 ZINC000427264019 945238771 /nfs/dbraw/zinc/23/87/71/945238771.db2.gz BIVXABILTICSEX-UHFFFAOYSA-N 0 0 358.419 3.891 20 5 FHBDRN CC(C)N(Cc1ccccc1[N+](=O)[O-])Cc1nc2ccccc2c(=O)[nH]1 ZINC000507442627 945238907 /nfs/dbraw/zinc/23/89/07/945238907.db2.gz SJASNHKHWINQQG-UHFFFAOYSA-N 0 0 352.394 3.654 20 5 FHBDRN Cc1ccsc1CCCC(=O)Nc1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000438938029 945241703 /nfs/dbraw/zinc/24/17/03/945241703.db2.gz AIKKORZMEHBGLO-UHFFFAOYSA-N 0 0 355.419 3.896 20 5 FHBDRN C[C@H](N(C)S(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-])C1(C)CC1 ZINC000437308716 945243201 /nfs/dbraw/zinc/24/32/01/945243201.db2.gz SHRDQOPZLKKADY-QMMMGPOBSA-N 0 0 367.254 3.711 20 5 FHBDRN CCCCn1ncc(N[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)c1C ZINC000126636946 945244860 /nfs/dbraw/zinc/24/48/60/945244860.db2.gz ZGAVLKCBHIRBCR-CYBMUJFWSA-N 0 0 359.430 3.647 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](CO)[C@@H](C)CCC ZINC000516777802 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COc1ccc2c(c1)[C@@H](C(=O)NCc1ccc([N+](=O)[O-])cc1Cl)CC2 ZINC000432172027 945252948 /nfs/dbraw/zinc/25/29/48/945252948.db2.gz JGILLZOZTFDANN-HNNXBMFYSA-N 0 0 360.797 3.603 20 5 FHBDRN COCC[C@H](NC(=O)c1c(C)cc(Cl)cc1[N+](=O)[O-])c1ccco1 ZINC000438956591 945254922 /nfs/dbraw/zinc/25/49/22/945254922.db2.gz WWYGQTFKIABHAF-LBPRGKRZSA-N 0 0 352.774 3.657 20 5 FHBDRN Cc1c(F)ccc([N+](=O)[O-])c1C(=O)OCc1ncc(C(F)(F)F)s1 ZINC001270581498 945262057 /nfs/dbraw/zinc/26/20/57/945262057.db2.gz DCPUKDFDEKVNEA-UHFFFAOYSA-N 0 0 364.276 3.875 20 5 FHBDRN CC[C@H](NS(=O)(=O)c1ccc(C)cc1[N+](=O)[O-])c1cccc(Cl)c1 ZINC000507479423 945262717 /nfs/dbraw/zinc/26/27/17/945262717.db2.gz GGQSOZMFQSWREZ-AWEZNQCLSA-N 0 0 368.842 3.986 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)c1ccc(-c2cc[nH]n2)s1 ZINC000432172941 945262815 /nfs/dbraw/zinc/26/28/15/945262815.db2.gz RANDHMOLVAZEJH-UHFFFAOYSA-N 0 0 362.798 3.630 20 5 FHBDRN O=[N+]([O-])c1cccc2c(NC3CCN(c4nccs4)CC3)ccnc21 ZINC000432172767 945263215 /nfs/dbraw/zinc/26/32/15/945263215.db2.gz AKTKKULXUONSAK-UHFFFAOYSA-N 0 0 355.423 3.680 20 5 FHBDRN CC[C@@H]1CN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C[C@H](C)[S@@]1=O ZINC000516815515 945264604 /nfs/dbraw/zinc/26/46/04/945264604.db2.gz UNIZQBAWJDVQQW-VPXKQDMUSA-N 0 0 362.451 3.586 20 5 FHBDRN CN(C(=O)OC(C)(C)C)[C@@H]1CCN(c2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000140639217 945273443 /nfs/dbraw/zinc/27/34/43/945273443.db2.gz PYZMENOJZNWMSI-GFCCVEGCSA-N 0 0 355.822 3.694 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NCc1ccccc1[N+](=O)[O-] ZINC000179522541 939881248 /nfs/dbraw/zinc/88/12/48/939881248.db2.gz LTMAZDWQJXTBCX-UHFFFAOYSA-N 0 0 361.379 3.545 20 5 FHBDRN O=C(NCc1ccc(OC(F)F)cc1)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000179549524 939884312 /nfs/dbraw/zinc/88/43/12/939884312.db2.gz ZJRHPZNCVXLGKP-UHFFFAOYSA-N 0 0 373.315 3.674 20 5 FHBDRN CCS[C@@H]1CC[C@H](N(C)C(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)C1 ZINC000188461377 939885171 /nfs/dbraw/zinc/88/51/71/939885171.db2.gz IQZVAKDHPBLCRC-UONOGXRCSA-N 0 0 352.456 3.658 20 5 FHBDRN COc1ccc(CN(C)C(=O)c2c(Cl)cccc2[N+](=O)[O-])c(OC)c1 ZINC000110170965 939887075 /nfs/dbraw/zinc/88/70/75/939887075.db2.gz GXZNNUNFQQSTDG-UHFFFAOYSA-N 0 0 364.785 3.538 20 5 FHBDRN Cc1cccc(OC[C@H](C)NC(=O)CCCNc2ccc([N+](=O)[O-])cc2)c1 ZINC000065818811 939887089 /nfs/dbraw/zinc/88/70/89/939887089.db2.gz DIONRPFTFJSIJI-INIZCTEOSA-N 0 0 371.437 3.679 20 5 FHBDRN CCc1nn(C)c(NCc2cccc(COCC(F)(F)F)c2)c1[N+](=O)[O-] ZINC000179611893 939894373 /nfs/dbraw/zinc/89/43/73/939894373.db2.gz ISLQHBXDJWLCRH-UHFFFAOYSA-N 0 0 372.347 3.582 20 5 FHBDRN CC(C)(C(=O)NCCc1c[nH]c2cc(F)ccc12)c1ccccc1[N+](=O)[O-] ZINC000550287895 945280149 /nfs/dbraw/zinc/28/01/49/945280149.db2.gz PLHIQSHVOCMUFS-UHFFFAOYSA-N 0 0 369.396 3.852 20 5 FHBDRN O=C(Nc1ccnn1-c1ccc([N+](=O)[O-])cc1)[C@H]1C[C@@]1(F)c1ccccc1 ZINC001125792077 939898833 /nfs/dbraw/zinc/89/88/33/939898833.db2.gz YJEBUXKCAVXHJY-VQIMIIECSA-N 0 0 366.352 3.604 20 5 FHBDRN O=C(Nc1ccnn1-c1ccc([N+](=O)[O-])cc1)c1ccc2cnccc2c1 ZINC001125792095 939899911 /nfs/dbraw/zinc/89/99/11/939899911.db2.gz YYKQCNHSVWKYBF-UHFFFAOYSA-N 0 0 359.345 3.581 20 5 FHBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])Nc1cccc2[nH]cnc21 ZINC000136238601 939903395 /nfs/dbraw/zinc/90/33/95/939903395.db2.gz WHEZDYHWYFYXDU-UHFFFAOYSA-N 0 0 360.757 3.532 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)NCCSc1ccc(Cl)cc1 ZINC000008125160 939908070 /nfs/dbraw/zinc/90/80/70/939908070.db2.gz VLPQCKWPIXQMMD-UHFFFAOYSA-N 0 0 350.827 3.699 20 5 FHBDRN O=C(NCCOc1cccc(Cl)c1)Nc1ccc([N+](=O)[O-])cc1F ZINC000584462508 939909239 /nfs/dbraw/zinc/90/92/39/939909239.db2.gz KXMJZOKRMSHWNR-UHFFFAOYSA-N 0 0 353.737 3.588 20 5 FHBDRN CSc1cccc(C(=O)NCC(C)(C)[C@H]2CCCCO2)c1[N+](=O)[O-] ZINC000614417247 939911681 /nfs/dbraw/zinc/91/16/81/939911681.db2.gz VJGBNHKYYPVZFL-CQSZACIVSA-N 0 0 352.456 3.642 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1CC[C@H]1c1ccc(Cl)cc1 ZINC000511331207 939914021 /nfs/dbraw/zinc/91/40/21/939914021.db2.gz CXEWXWRHTLLAHO-AWEZNQCLSA-N 0 0 366.826 3.692 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CCO[C@@H](c2ccc(F)c(C)c2)C1 ZINC000136302428 939915089 /nfs/dbraw/zinc/91/50/89/939915089.db2.gz FWMXKVRKTIUKGA-GOSISDBHSA-N 0 0 373.384 3.956 20 5 FHBDRN Cc1cc([C@@H]2CCCN2C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)no1 ZINC000364288736 939917491 /nfs/dbraw/zinc/91/74/91/939917491.db2.gz TXZDFRCQOQMJTB-CJNGLKHVSA-N 0 0 358.398 3.807 20 5 FHBDRN C[C@H]1C[C@]1(NC(=O)Cc1ccc([N+](=O)[O-])cc1F)c1ccc(Cl)cc1 ZINC000410383051 939918760 /nfs/dbraw/zinc/91/87/60/939918760.db2.gz PVTIOOLQWQDROC-BBATYDOGSA-N 0 0 362.788 3.981 20 5 FHBDRN Cc1cc(N2CCC3(C[C@H]3c3nnc(C(C)C)o3)CC2)ncc1[N+](=O)[O-] ZINC000364345791 939921561 /nfs/dbraw/zinc/92/15/61/939921561.db2.gz MRJBKIQUHMPNHO-ZDUSSCGKSA-N 0 0 357.414 3.579 20 5 FHBDRN CCOc1ccc(C(=O)Nc2c[nH]nc2-c2ccccc2)cc1[N+](=O)[O-] ZINC000179700090 939927114 /nfs/dbraw/zinc/92/71/14/939927114.db2.gz LHLGIEIJBMRSNW-UHFFFAOYSA-N 0 0 352.350 3.636 20 5 FHBDRN O=C(COc1cccc([N+](=O)[O-])c1)Nc1ccc(Cc2ccncc2)cc1 ZINC000046642534 939953078 /nfs/dbraw/zinc/95/30/78/939953078.db2.gz VPPWSCKSILZHSI-UHFFFAOYSA-N 0 0 363.373 3.598 20 5 FHBDRN COCCN(C(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-])[C@@H]1CC[C@@H](C)C1 ZINC000410757956 939953565 /nfs/dbraw/zinc/95/35/65/939953565.db2.gz APSASMNTQDPFKS-DGCLKSJQSA-N 0 0 374.359 3.891 20 5 FHBDRN COc1ccccc1COC1CCN(c2cccc(F)c2[N+](=O)[O-])CC1 ZINC000091980244 939955320 /nfs/dbraw/zinc/95/53/20/939955320.db2.gz BPWGDSYRSMCLEK-UHFFFAOYSA-N 0 0 360.385 3.928 20 5 FHBDRN O=C(OCc1ncc(C(F)(F)F)s1)[C@@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1 ZINC001270582414 945284948 /nfs/dbraw/zinc/28/49/48/945284948.db2.gz MONLQZVUZFSEIC-GHMZBOCLSA-N 0 0 372.324 3.917 20 5 FHBDRN CCN(Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)Cc1ccc(OC)cc1 ZINC000053087436 939958099 /nfs/dbraw/zinc/95/80/99/939958099.db2.gz NEQXQVOFVLMVQR-UHFFFAOYSA-N 0 0 368.393 3.676 20 5 FHBDRN CCCN(C(=O)C[C@@H]1COc2ccccc2O1)c1cccc([N+](=O)[O-])c1 ZINC000410822217 939962736 /nfs/dbraw/zinc/96/27/36/939962736.db2.gz NBUKGIGXDLTATJ-MRXNPFEDSA-N 0 0 356.378 3.568 20 5 FHBDRN O=C(N[C@@H]1CCC[C@H]1OC(F)F)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000410823641 939962855 /nfs/dbraw/zinc/96/28/55/939962855.db2.gz ARJMUYCVNCFFRT-GHMZBOCLSA-N 0 0 368.258 3.504 20 5 FHBDRN CCCN(C(=O)C[C@@H](CNC(C)=O)CC(C)C)c1cccc([N+](=O)[O-])c1 ZINC000410822652 939962871 /nfs/dbraw/zinc/96/28/71/939962871.db2.gz OJRAPDOWZAZFPS-INIZCTEOSA-N 0 0 363.458 3.526 20 5 FHBDRN CC1(C)CN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])[C@H]1[C@H]1CCCO1 ZINC000410871351 939964007 /nfs/dbraw/zinc/96/40/07/939964007.db2.gz HKNREFMQURECPS-KGLIPLIRSA-N 0 0 372.343 3.643 20 5 FHBDRN CNC(=O)c1ccc(N2CC=C(c3cccc(Cl)c3)CC2)c([N+](=O)[O-])c1 ZINC000480619743 939964731 /nfs/dbraw/zinc/96/47/31/939964731.db2.gz BCLVDRZHPUORBL-UHFFFAOYSA-N 0 0 371.824 3.902 20 5 FHBDRN CCc1c(C(=O)NC(C)(C)c2ccccc2[N+](=O)[O-])cnn1CC(C)C ZINC000410922260 939972573 /nfs/dbraw/zinc/97/25/73/939972573.db2.gz CCKJDTFIOCSRRP-UHFFFAOYSA-N 0 0 358.442 3.675 20 5 FHBDRN CC[C@@H](Oc1ccccc1F)C(=O)NC(C)(C)c1ccccc1[N+](=O)[O-] ZINC000410926317 939972651 /nfs/dbraw/zinc/97/26/51/939972651.db2.gz PBHMYQPHKPVCSA-MRXNPFEDSA-N 0 0 360.385 3.943 20 5 FHBDRN CCN(C(=O)c1ccc2c(c1[N+](=O)[O-])OCCCO2)[C@H]1CCCC[C@H]1C ZINC001125794262 939983762 /nfs/dbraw/zinc/98/37/62/939983762.db2.gz MWKZBBOWNCPOAV-HIFRSBDPSA-N 0 0 362.426 3.797 20 5 FHBDRN CCN(C(=O)c1ccc2c(c1[N+](=O)[O-])OCCCO2)[C@H]1CCCC[C@@H]1C ZINC001125794267 939983867 /nfs/dbraw/zinc/98/38/67/939983867.db2.gz MWKZBBOWNCPOAV-ZFWWWQNUSA-N 0 0 362.426 3.797 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)Nc2cccnc2N2CCCCC2)c1 ZINC000065862931 939984620 /nfs/dbraw/zinc/98/46/20/939984620.db2.gz RCIFZOMIEKBIIT-UHFFFAOYSA-N 0 0 372.450 3.954 20 5 FHBDRN O=C(c1c(Cl)cccc1[N+](=O)[O-])N1CC[C@H](n2ncc3ccccc32)C1 ZINC000364699182 939985429 /nfs/dbraw/zinc/98/54/29/939985429.db2.gz IOBKSGDHJBYDPE-ZDUSSCGKSA-N 0 0 370.796 3.685 20 5 FHBDRN COc1cccc(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)c1[N+](=O)[O-] ZINC000411014521 939985909 /nfs/dbraw/zinc/98/59/09/939985909.db2.gz PITSJDFXXAKUQG-AWEZNQCLSA-N 0 0 367.405 3.623 20 5 FHBDRN CCOc1ncc(C)cc1NC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000411010125 939989160 /nfs/dbraw/zinc/98/91/60/939989160.db2.gz BBYYSSFXUPBVRS-UHFFFAOYSA-N 0 0 369.299 3.968 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N[C@@H]1COc2cc(F)cc(F)c21 ZINC000612314075 939991497 /nfs/dbraw/zinc/99/14/97/939991497.db2.gz WNBHNGJBYOFCNK-GFCCVEGCSA-N 0 0 363.320 3.745 20 5 FHBDRN Cc1nnc([C@H](Nc2ccc(Cl)cc2[N+](=O)[O-])c2ccccc2)n1C ZINC000364727107 939993485 /nfs/dbraw/zinc/99/34/85/939993485.db2.gz CSIADCBWOJSHES-MRXNPFEDSA-N 0 0 357.801 3.887 20 5 FHBDRN CCCCc1cnc(NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)nc1 ZINC000411068674 939996401 /nfs/dbraw/zinc/99/64/01/939996401.db2.gz IOIVUIMEUCQYFK-UHFFFAOYSA-N 0 0 369.425 3.580 20 5 FHBDRN CN(Cc1nc2ccccc2s1)C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000411183072 940008442 /nfs/dbraw/zinc/00/84/42/940008442.db2.gz IJMMNPJWGSSUKZ-LSDHHAIUSA-N 0 0 367.430 3.967 20 5 FHBDRN O=C(Nc1cccc(C(F)(F)F)c1)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000179859879 940010716 /nfs/dbraw/zinc/01/07/16/940010716.db2.gz FVBMPRDSFUPOHZ-UHFFFAOYSA-N 0 0 354.240 3.595 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)Nc1nc(-c2nccn2C)cs1 ZINC000179861782 940014091 /nfs/dbraw/zinc/01/40/91/940014091.db2.gz PGSBGRHUWPWBTC-UHFFFAOYSA-N 0 0 371.422 3.629 20 5 FHBDRN C[C@H]1CCN(C(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)CC12CCC2 ZINC000516826147 945289442 /nfs/dbraw/zinc/28/94/42/945289442.db2.gz SHOJXLZKZPXDRE-AWEZNQCLSA-N 0 0 370.453 3.840 20 5 FHBDRN CC(C)c1ccc(C(=O)N2C[C@H](C(F)(F)F)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000615246105 940017792 /nfs/dbraw/zinc/01/77/92/940017792.db2.gz HUFBWVZXBUAJIN-IINYFYTJSA-N 0 0 360.332 3.510 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CCC[C@@H]2c2ccncc2)ccc1[N+](=O)[O-] ZINC000411262815 940019951 /nfs/dbraw/zinc/01/99/51/940019951.db2.gz TYVXNJDDJKWSNW-MRXNPFEDSA-N 0 0 355.394 3.754 20 5 FHBDRN Cc1cccc(C(=O)N2CC=C(c3cc4cccnc4[nH]3)CC2)c1[N+](=O)[O-] ZINC000364908504 940020871 /nfs/dbraw/zinc/02/08/71/940020871.db2.gz VJIJNPGGIXQFPU-UHFFFAOYSA-N 0 0 362.389 3.709 20 5 FHBDRN CCn1c(COC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)nc2c1cccc2F ZINC000728613452 940021768 /nfs/dbraw/zinc/02/17/68/940021768.db2.gz IUOZXQZKDDEWQO-FLIBITNWSA-N 0 0 369.352 3.860 20 5 FHBDRN CC(C)[C@@H](CNC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)Nc1ccccc1 ZINC000411252847 940023131 /nfs/dbraw/zinc/02/31/31/940023131.db2.gz FPTDIRGRLUJBIJ-XUVXKRRUSA-N 0 0 367.449 3.951 20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])N[C@@H]1C[C@H]1c1ccc(Cl)cc1 ZINC000437364652 945290990 /nfs/dbraw/zinc/29/09/90/945290990.db2.gz POJGOLDYYGCCEX-GOEBONIOSA-N 0 0 359.813 3.723 20 5 FHBDRN CC(C)C(=O)Nc1cccc(NC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)c1 ZINC000411363853 940036480 /nfs/dbraw/zinc/03/64/80/940036480.db2.gz FHVKAWGESCLQCS-ZWKOTPCHSA-N 0 0 367.405 3.932 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)C(=O)Nc1cccc(C(C)C)c1 ZINC000411392848 940037375 /nfs/dbraw/zinc/03/73/75/940037375.db2.gz 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CC(=O)N1CCSc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3C)cc21 ZINC000365080649 940053120 /nfs/dbraw/zinc/05/31/20/940053120.db2.gz YDDKHDDSUJSPDL-UHFFFAOYSA-N 0 0 371.418 3.614 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])N[C@@H](c1ccc(F)cc1)c1cccnc1 ZINC000365187955 940075050 /nfs/dbraw/zinc/07/50/50/940075050.db2.gz PLZVUEQDNDUUHY-FQEVSTJZSA-N 0 0 365.364 3.577 20 5 FHBDRN Cc1ccc(C(=O)N[C@@H]2C[C@H]2c2cc(F)c(F)c(F)c2)cc1[N+](=O)[O-] ZINC000437390200 945295276 /nfs/dbraw/zinc/29/52/76/945295276.db2.gz YMRRLYYBYDPILQ-SMDDNHRTSA-N 0 0 350.296 3.606 20 5 FHBDRN Cc1ccccc1Cc1noc(CN(C)CCc2cccc([N+](=O)[O-])c2)n1 ZINC000548933326 940093711 /nfs/dbraw/zinc/09/37/11/940093711.db2.gz CJCZZCHIUKVZCC-UHFFFAOYSA-N 0 0 366.421 3.552 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])OCc1coc(-c2ccc(F)c(F)c2)n1 ZINC000728616564 940108977 /nfs/dbraw/zinc/10/89/77/940108977.db2.gz PVNHSDMYMOMZRN-UHFFFAOYSA-N 0 0 374.299 3.814 20 5 FHBDRN Cc1ccc(C2(C(=O)Nc3ccc(C)c([N+](=O)[O-])c3)CCOCC2)cc1 ZINC000110177746 940119096 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FHBDRN COc1cccc([C@H](C)c2noc(-c3n[nH]c4ccc([N+](=O)[O-])cc43)n2)c1 ZINC000612917145 940339144 /nfs/dbraw/zinc/33/91/44/940339144.db2.gz FRCPZBWOSBDCNG-JTQLQIEISA-N 0 0 365.349 3.682 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)NCC(C)(C)c1cccc(F)c1 ZINC000511404545 940377770 /nfs/dbraw/zinc/37/77/70/940377770.db2.gz KTBBLAWMQZUZGY-UHFFFAOYSA-N 0 0 373.428 3.896 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H](C)c1c(F)cccc1Cl ZINC000427382784 945313239 /nfs/dbraw/zinc/31/32/39/945313239.db2.gz OLERUDAEVMQCTP-SECBINFHSA-N 0 0 352.749 3.887 20 5 FHBDRN Cc1cc(=NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1[C@@H](C)C1CC1 ZINC000544087874 940384035 /nfs/dbraw/zinc/38/40/35/940384035.db2.gz ASNMICBRNYCHRF-NSHDSACASA-N 0 0 370.434 3.960 20 5 FHBDRN CCOc1cc(OCc2nc(-c3ccccc3F)no2)ccc1[N+](=O)[O-] ZINC000188605904 940388017 /nfs/dbraw/zinc/38/80/17/940388017.db2.gz VXHUIUYXRQVCJD-UHFFFAOYSA-N 0 0 359.313 3.762 20 5 FHBDRN CC(=O)Nc1cc(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])c(F)cc1F ZINC000066285244 940388632 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5 FHBDRN CC(C)c1nccn1[C@@H]1CCCN(c2ncnc3sc([N+](=O)[O-])cc32)C1 ZINC000376188063 940439047 /nfs/dbraw/zinc/43/90/47/940439047.db2.gz NPZYDNBWFRPYLB-GFCCVEGCSA-N 0 0 372.454 3.761 20 5 FHBDRN CC(C)COc1ccccc1NC(=O)c1cc([N+](=O)[O-])cc2c1OCCO2 ZINC000066330083 940439089 /nfs/dbraw/zinc/43/90/89/940439089.db2.gz NPWPAFOGJAGXQO-UHFFFAOYSA-N 0 0 372.377 3.653 20 5 FHBDRN CC(C)[C@@H](CC(=O)OCC(=O)Nc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000728637709 940439628 /nfs/dbraw/zinc/43/96/28/940439628.db2.gz FFIKSYVWVUFKNT-MRXNPFEDSA-N 0 0 370.405 3.906 20 5 FHBDRN O=C(Nc1cc(-c2ccccc2)on1)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000124818680 945321354 /nfs/dbraw/zinc/32/13/54/945321354.db2.gz WUAFWJCSPPWXDF-UHFFFAOYSA-N 0 0 364.361 3.840 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)N1CCC[C@@H](C(F)(F)F)C1 ZINC000186001642 940449314 /nfs/dbraw/zinc/44/93/14/940449314.db2.gz UMQHFYDLGXVTIP-SNVBAGLBSA-N 0 0 365.739 3.732 20 5 FHBDRN CCCCc1nc(COc2ccc(C(=O)OC)c([N+](=O)[O-])c2)cs1 ZINC000613109452 940451868 /nfs/dbraw/zinc/45/18/68/940451868.db2.gz JTPMLXICYXERMA-UHFFFAOYSA-N 0 0 350.396 3.760 20 5 FHBDRN COC(=O)c1ccc(OCC(=O)Nc2cccc(C(C)C)c2)cc1[N+](=O)[O-] ZINC000613109873 940452408 /nfs/dbraw/zinc/45/24/08/940452408.db2.gz BZDAQPKIGRZRMK-UHFFFAOYSA-N 0 0 372.377 3.522 20 5 FHBDRN COC(=O)c1ccc(OCC(=O)Nc2ccccc2C(C)C)cc1[N+](=O)[O-] ZINC000613110669 940452591 /nfs/dbraw/zinc/45/25/91/940452591.db2.gz STKPUPACTLQEBO-UHFFFAOYSA-N 0 0 372.377 3.522 20 5 FHBDRN COC(=O)c1ccc(Oc2ncnc3sc(C)c(C)c32)cc1[N+](=O)[O-] ZINC000613114278 940453883 /nfs/dbraw/zinc/45/38/83/940453883.db2.gz SILJFNDNCDIGCY-UHFFFAOYSA-N 0 0 359.363 3.795 20 5 FHBDRN CO[C@@H](CNC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1)C1CC1 ZINC000511432254 940460364 /nfs/dbraw/zinc/46/03/64/940460364.db2.gz LOIAXFKKRWVLHZ-KRWDZBQOSA-N 0 0 372.446 3.901 20 5 FHBDRN Cc1ccc(NC2CCN(C(=O)c3cc(Cl)c[nH]3)CC2)c([N+](=O)[O-])c1 ZINC000376205440 940465629 /nfs/dbraw/zinc/46/56/29/940465629.db2.gz ASYGKANAPABLER-UHFFFAOYSA-N 0 0 362.817 3.601 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)NCC[C@@H]1COc2ccccc2O1 ZINC000580368286 940474148 /nfs/dbraw/zinc/47/41/48/940474148.db2.gz GZFRVIMPFIBLSU-OAHLLOKOSA-N 0 0 371.393 3.509 20 5 FHBDRN C[C@@H]1C[C@H](c2ccsc2)CN1c1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1 ZINC000376212650 940474676 /nfs/dbraw/zinc/47/46/76/940474676.db2.gz OLKYUVAWJCBFNA-PWSUYJOCSA-N 0 0 356.407 3.688 20 5 FHBDRN CCc1nc(C)c(C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2C)o1 ZINC000511440796 940474704 /nfs/dbraw/zinc/47/47/04/940474704.db2.gz AXHFNLMQDNADGI-UHFFFAOYSA-N 0 0 368.187 3.777 20 5 FHBDRN O=C(CSc1ccccc1[N+](=O)[O-])NCC1(c2cccc(F)c2)CC1 ZINC000124834034 945323733 /nfs/dbraw/zinc/32/37/33/945323733.db2.gz SOFYTBWPQCEVGU-UHFFFAOYSA-N 0 0 360.410 3.674 20 5 FHBDRN CCc1nn(C)c(Nc2cnn(Cc3ccc(Cl)cc3)c2)c1[N+](=O)[O-] ZINC000580474115 940476076 /nfs/dbraw/zinc/47/60/76/940476076.db2.gz PVVBMHGAPPSXSH-UHFFFAOYSA-N 0 0 360.805 3.533 20 5 FHBDRN COc1cc(C(=O)NCCC(C)(C)C2CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000580487859 940476759 /nfs/dbraw/zinc/47/67/59/940476759.db2.gz PQWSEUZVNQFWAC-UHFFFAOYSA-N 0 0 372.368 3.761 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)NCC1(Cc2ccccc2)CC1 ZINC000580466363 940478388 /nfs/dbraw/zinc/47/83/88/940478388.db2.gz YINAPJMESZBOEU-UHFFFAOYSA-N 0 0 367.449 3.802 20 5 FHBDRN COCc1cncc(C(=O)N(c2cccc([N+](=O)[O-])c2)C2CCCC2)c1 ZINC000613183733 940479029 /nfs/dbraw/zinc/47/90/29/940479029.db2.gz GYFFSUFAQHHLDF-UHFFFAOYSA-N 0 0 355.394 3.726 20 5 FHBDRN CC(C)(C(=O)Nc1cccc(OCC(F)F)n1)c1ccccc1[N+](=O)[O-] ZINC000580558441 940479155 /nfs/dbraw/zinc/47/91/55/940479155.db2.gz CXUIWNMWOROJMW-UHFFFAOYSA-N 0 0 365.336 3.550 20 5 FHBDRN C[C@@H](C(=O)Nc1nc(C2CCOCC2)cs1)c1cccc([N+](=O)[O-])c1 ZINC000580594309 940480173 /nfs/dbraw/zinc/48/01/73/940480173.db2.gz OQXMQOUZXWBPEK-LLVKDONJSA-N 0 0 361.423 3.688 20 5 FHBDRN CO[C@@H]1CCC[C@@H](C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2C)C1 ZINC000511444613 940480431 /nfs/dbraw/zinc/48/04/31/940480431.db2.gz KYNZTGSIBBTUHG-ZYHUDNBSSA-N 0 0 371.231 3.809 20 5 FHBDRN O=c1c([N+](=O)[O-])cc(Br)cn1C/C=C\c1ccc(Cl)cc1 ZINC000468484649 940481315 /nfs/dbraw/zinc/48/13/15/940481315.db2.gz SNCNJKZDRLOPBQ-UPHRSURJSA-N 0 0 369.602 3.886 20 5 FHBDRN C[C@@H]1[C@H](CO)CCCN1C(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000414076737 940482659 /nfs/dbraw/zinc/48/26/59/940482659.db2.gz QCRIEBOQCLFRFF-ZBFHGGJFSA-N 0 0 369.421 3.571 20 5 FHBDRN COCCOc1ccc(NC(=O)c2cc(F)cc(C)c2[N+](=O)[O-])c(C)c1 ZINC000177916277 940482960 /nfs/dbraw/zinc/48/29/60/940482960.db2.gz IHOJDYJJCWBBFX-UHFFFAOYSA-N 0 0 362.357 3.628 20 5 FHBDRN O=[N+]([O-])c1cc(CN2CCO[C@H](c3ccc(F)cc3)C2)ccc1Cl ZINC000177942467 940486179 /nfs/dbraw/zinc/48/61/79/940486179.db2.gz RHFDASLHHIWNCK-KRWDZBQOSA-N 0 0 350.777 3.961 20 5 FHBDRN Cc1cc(C(=O)N2CC[C@H](Oc3ccc(Cl)cc3)C2)ccc1[N+](=O)[O-] ZINC000580793739 940487467 /nfs/dbraw/zinc/48/74/67/940487467.db2.gz OMKOFLDXTNPNPG-INIZCTEOSA-N 0 0 360.797 3.850 20 5 FHBDRN Cc1cccc(NC(=O)CN(C)Cc2ccc(Cl)c([N+](=O)[O-])c2)c1C ZINC000177941710 940488213 /nfs/dbraw/zinc/48/82/13/940488213.db2.gz BIXFCIOILWNLKV-UHFFFAOYSA-N 0 0 361.829 3.936 20 5 FHBDRN CC(=O)c1ccc(Nc2cccc([C@H](C)N3CCOCC3)c2)c([N+](=O)[O-])c1 ZINC000511456407 940488592 /nfs/dbraw/zinc/48/85/92/940488592.db2.gz XSVRTAOARSFODC-AWEZNQCLSA-N 0 0 369.421 3.934 20 5 FHBDRN COc1cc(F)c(F)cc1NC(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000581223169 940496928 /nfs/dbraw/zinc/49/69/28/940496928.db2.gz NMCOVXKDLJVAJX-QMMMGPOBSA-N 0 0 354.284 3.763 20 5 FHBDRN O=C(N[C@@H](C1CC1)C(F)(F)F)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000581271530 940498076 /nfs/dbraw/zinc/49/80/76/940498076.db2.gz HMSYZWSZSPNNQV-LBPRGKRZSA-N 0 0 371.340 3.789 20 5 FHBDRN CC(C)Oc1ccccc1[C@H](C)Nc1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1 ZINC000581327077 940499286 /nfs/dbraw/zinc/49/92/86/940499286.db2.gz JXSDRXJSOPBXIR-LBPRGKRZSA-N 0 0 368.393 3.626 20 5 FHBDRN CSCc1cc(F)ccc1CNC(=O)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000124754830 945326218 /nfs/dbraw/zinc/32/62/18/945326218.db2.gz UNLWMRSVVYBBMJ-UHFFFAOYSA-N 0 0 370.352 3.805 20 5 FHBDRN Cc1cc(NC(=O)c2nc(C(C)C)oc2C)n(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000511473443 940505106 /nfs/dbraw/zinc/50/51/06/940505106.db2.gz OTFHAXYTZPHFTB-UHFFFAOYSA-N 0 0 369.381 3.761 20 5 FHBDRN C[C@@H]1c2cc(F)cc(F)c2CCN1c1ncnc2ccc([N+](=O)[O-])cc21 ZINC000613284620 940505130 /nfs/dbraw/zinc/50/51/30/940505130.db2.gz TXRWJTJJSFMFMA-SNVBAGLBSA-N 0 0 356.332 3.940 20 5 FHBDRN Cc1cc2cc(CNC(=O)N3CCc4c(cccc4[N+](=O)[O-])C3)ccc2[nH]1 ZINC000581567485 940506705 /nfs/dbraw/zinc/50/67/05/940506705.db2.gz UVMYYSBVOUYOFZ-UHFFFAOYSA-N 0 0 364.405 3.652 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N[C@@H]1COc2cc(F)cc(F)c21 ZINC000613300207 940506986 /nfs/dbraw/zinc/50/69/86/940506986.db2.gz NYDZAULMOZENET-CYBMUJFWSA-N 0 0 363.320 3.745 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@@]3(C2)CCc2ccccc2O3)c1 ZINC000581580413 940509476 /nfs/dbraw/zinc/50/94/76/940509476.db2.gz YEUBYKJQVNXYHH-HXUWFJFHSA-N 0 0 352.390 3.513 20 5 FHBDRN COc1ccccc1OC[C@@H](C)CNC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000581760494 940511766 /nfs/dbraw/zinc/51/17/66/940511766.db2.gz NCJICASZLWMJNQ-LSDHHAIUSA-N 0 0 372.421 3.538 20 5 FHBDRN Cn1nc(Nc2ccc([N+](=O)[O-])c(-c3ccc(F)cc3)n2)cc1C1CC1 ZINC000581758682 940511843 /nfs/dbraw/zinc/51/18/43/940511843.db2.gz WSMUFHMWYJGFGI-UHFFFAOYSA-N 0 0 353.357 3.572 20 5 FHBDRN CC(=O)Nc1cc(Cl)ccc1NC(=O)[C@H]1C[C@H]1c1cccc([N+](=O)[O-])c1 ZINC001125810090 940512008 /nfs/dbraw/zinc/51/20/08/940512008.db2.gz MFRVGGIAMVSCJP-GJZGRUSLSA-N 0 0 373.796 3.949 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])s1)N1CC[C@H](Oc2ccc(Cl)cc2)C1 ZINC000581686193 940588552 /nfs/dbraw/zinc/58/85/52/940588552.db2.gz DUJZNNJDPPGQBH-LBPRGKRZSA-N 0 0 352.799 3.603 20 5 FHBDRN CC(C)(NC(=O)NCc1cc2ccccc2[nH]1)c1ccc([N+](=O)[O-])cc1 ZINC000431798089 940594106 /nfs/dbraw/zinc/59/41/06/940594106.db2.gz PMNNHLXLJUZLPE-UHFFFAOYSA-N 0 0 352.394 3.811 20 5 FHBDRN Cc1cc(NC(=O)c2nc(C3CC3)oc2C)n(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000511482670 940613862 /nfs/dbraw/zinc/61/38/62/940613862.db2.gz QJCYOCVXWHFYQS-UHFFFAOYSA-N 0 0 367.365 3.515 20 5 FHBDRN Cc1cccc([C@@H](O)CNC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)c1 ZINC000178059891 940617526 /nfs/dbraw/zinc/61/75/26/940617526.db2.gz XIIBMNWQBMPXGV-HNNXBMFYSA-N 0 0 356.403 3.581 20 5 FHBDRN COCc1cc(OCCOc2ccc([N+](=O)[O-])cc2)c2cc(F)ccc2n1 ZINC000581912901 940632716 /nfs/dbraw/zinc/63/27/16/940632716.db2.gz HLBUVLUGKRJZGE-UHFFFAOYSA-N 0 0 372.352 3.886 20 5 FHBDRN COc1ccc(C[C@H](C)NC(=O)Nc2cccc([N+](=O)[O-])c2C)cc1OC ZINC000106579233 945336310 /nfs/dbraw/zinc/33/63/10/945336310.db2.gz ALMQIFAHXKYCIJ-LBPRGKRZSA-N 0 0 373.409 3.673 20 5 FHBDRN Cc1ccc([C@@H]2C[C@H](C)CCN2C(=O)COc2cccc([N+](=O)[O-])c2)o1 ZINC000173574830 940637330 /nfs/dbraw/zinc/63/73/30/940637330.db2.gz WMBBFHCHKDRHAE-DYVFJYSZSA-N 0 0 358.394 3.875 20 5 FHBDRN COc1cc(C(=O)Nc2ccc(CSC)cc2)c([N+](=O)[O-])cc1OC ZINC000066551907 940646622 /nfs/dbraw/zinc/64/66/22/940646622.db2.gz YXYYBCMIKKGXBQ-UHFFFAOYSA-N 0 0 362.407 3.727 20 5 FHBDRN COc1ccc2c(c1)[C@H](C(=O)NCCCCc1ccc([N+](=O)[O-])cc1)CC2 ZINC000431819998 940659148 /nfs/dbraw/zinc/65/91/48/940659148.db2.gz ABWGZRPHOYAMBL-LJQANCHMSA-N 0 0 368.433 3.772 20 5 FHBDRN C[C@H]1CN(C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)[C@@H](c2ccccc2)CO1 ZINC000173718837 940663345 /nfs/dbraw/zinc/66/33/45/940663345.db2.gz KBEMCFHIFRXQDJ-SCLBCKFNSA-N 0 0 374.824 3.779 20 5 FHBDRN COc1ccc(CS(=O)(=O)[C@H](C)c2cc([N+](=O)[O-])ccc2C)cc1F ZINC000180135702 940679186 /nfs/dbraw/zinc/67/91/86/940679186.db2.gz LCUQGHQDXQXTDN-GFCCVEGCSA-N 0 0 367.398 3.727 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1nc(-c2cccc(O)c2)cs1 ZINC000173878351 940681629 /nfs/dbraw/zinc/68/16/29/940681629.db2.gz BUDPUKRVALVEAE-UHFFFAOYSA-N 0 0 355.375 3.985 20 5 FHBDRN O=C1CCCN1Cc1ccccc1CNCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000892546762 940714348 /nfs/dbraw/zinc/71/43/48/940714348.db2.gz NALKVXUCIFLPNO-UHFFFAOYSA-N 0 0 373.840 3.660 20 5 FHBDRN COc1ccccc1[C@@H]1CCCN1c1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000427414339 945343885 /nfs/dbraw/zinc/34/38/85/945343885.db2.gz LWWBPKWSDFLIBI-INIZCTEOSA-N 0 0 366.377 3.995 20 5 FHBDRN Cc1sc(S(=O)(=O)N2CC(C)(C)[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000613471785 940739087 /nfs/dbraw/zinc/73/90/87/940739087.db2.gz BVTALKOXEJDMPU-HNNXBMFYSA-N 0 0 366.464 3.737 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1nc2cc(F)ccc2n1C ZINC000174610717 940749655 /nfs/dbraw/zinc/74/96/55/940749655.db2.gz JHKJCDNQALRZHE-JTQLQIEISA-N 0 0 374.397 3.740 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(N2CCCC2)c(F)c1 ZINC000106600542 945345919 /nfs/dbraw/zinc/34/59/19/945345919.db2.gz OXDLGSIUCHEKGE-UHFFFAOYSA-N 0 0 359.357 3.595 20 5 FHBDRN Cc1cc(C=C2CCN(C(=O)Nc3ccc([N+](=O)[O-])c(C)c3)CC2)no1 ZINC000376320132 940765547 /nfs/dbraw/zinc/76/55/47/940765547.db2.gz SHEPKIXBQYMFQE-UHFFFAOYSA-N 0 0 356.382 3.911 20 5 FHBDRN CCC1(CC)[C@@H](NC(=O)c2c([N+](=O)[O-])cccc2C(F)(F)F)C[C@@H]1OC ZINC000582633830 940768655 /nfs/dbraw/zinc/76/86/55/940768655.db2.gz ZMNPJNDINMBIHA-STQMWFEESA-N 0 0 374.359 3.937 20 5 FHBDRN CCc1nccn1C[C@H]1CCCN1C(=O)Nc1cc([N+](=O)[O-])ccc1CC ZINC000582635775 940774563 /nfs/dbraw/zinc/77/45/63/940774563.db2.gz CWNHIMOCAVUGED-MRXNPFEDSA-N 0 0 371.441 3.613 20 5 FHBDRN CC[C@H]1CN(C(=O)Cn2c3ccccc3c(=O)c3ccccc32)CCS1 ZINC000174788423 940776343 /nfs/dbraw/zinc/77/63/43/940776343.db2.gz HODAURPLSBQKJU-HNNXBMFYSA-N 0 0 366.486 3.509 20 5 FHBDRN Cc1csc(CCCCNc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)n1 ZINC000170710442 940788489 /nfs/dbraw/zinc/78/84/89/940788489.db2.gz VDUHUWJLRVXJSK-UHFFFAOYSA-N 0 0 360.439 3.679 20 5 FHBDRN CN(CC(=O)N[C@@H](c1ccco1)c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000175033906 940803324 /nfs/dbraw/zinc/80/33/24/940803324.db2.gz YHZACYCDWWEVFG-HXUWFJFHSA-N 0 0 365.389 3.530 20 5 FHBDRN CC(C)=C[C@@H]1[C@@H](C(=O)Nc2ccnn2-c2ccc([N+](=O)[O-])cc2)C1(C)C ZINC000609453458 940805717 /nfs/dbraw/zinc/80/57/17/940805717.db2.gz QNMHTIPVSKGEDB-WBVHZDCISA-N 0 0 354.410 3.957 20 5 FHBDRN O=[N+]([O-])c1cccc([C@@H](N[C@@H]2c3ccccc3C[C@@H]2O)c2ccccc2)c1 ZINC000180220930 940828986 /nfs/dbraw/zinc/82/89/86/940828986.db2.gz KDCCAAGZNJHBGZ-FDFHNCONSA-N 0 0 360.413 3.932 20 5 FHBDRN O=[N+]([O-])c1cccc([C@H](N[C@@H]2c3ccccc3C[C@@H]2O)c2ccccc2)c1 ZINC000180220945 940829132 /nfs/dbraw/zinc/82/91/32/940829132.db2.gz KDCCAAGZNJHBGZ-BHDDXSALSA-N 0 0 360.413 3.932 20 5 FHBDRN CSc1ccc(C(=O)NC[C@@H](c2cccnc2)C(C)C)cc1[N+](=O)[O-] ZINC000175297047 940837701 /nfs/dbraw/zinc/83/77/01/940837701.db2.gz XDCSPLWQWCEELJ-OAHLLOKOSA-N 0 0 359.451 3.881 20 5 FHBDRN CCOc1ccc(C(=O)NC[C@@H](c2cccnc2)C(C)C)cc1[N+](=O)[O-] ZINC000175334437 940854010 /nfs/dbraw/zinc/85/40/10/940854010.db2.gz BAQMUCUGBYVTHZ-MRXNPFEDSA-N 0 0 357.410 3.558 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)Nc2ccnn2-c2ccc(Cl)cc2)c1 ZINC000175405742 940865413 /nfs/dbraw/zinc/86/54/13/940865413.db2.gz DOVQLMUCJAHTFT-UHFFFAOYSA-N 0 0 372.768 3.695 20 5 FHBDRN CC(C)(C)OC(=O)c1cccc(C(=O)N2CCc3cc([N+](=O)[O-])ccc32)c1 ZINC000091847311 940891656 /nfs/dbraw/zinc/89/16/56/940891656.db2.gz UZCSPIHQSHVSCS-UHFFFAOYSA-N 0 0 368.389 3.753 20 5 FHBDRN CN(C(=O)c1cccc(C(=O)OC(C)(C)C)c1)c1ccc([N+](=O)[O-])cc1 ZINC000091847348 940893985 /nfs/dbraw/zinc/89/39/85/940893985.db2.gz RENQQOBVINMBPH-UHFFFAOYSA-N 0 0 356.378 3.827 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)Nc1ccc(-c2ccccc2)nn1 ZINC000175660494 940904893 /nfs/dbraw/zinc/90/48/93/940904893.db2.gz CPHNFQZSKYJEJR-UHFFFAOYSA-N 0 0 366.402 3.783 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)NCc1ccc(OC(F)F)cc1 ZINC000043779188 940907713 /nfs/dbraw/zinc/90/77/13/940907713.db2.gz PIELSAMUUGMROT-UHFFFAOYSA-N 0 0 365.336 3.538 20 5 FHBDRN CC(=O)c1cc(N2CCC3(CC2)OCc2ccccc23)ccc1[N+](=O)[O-] ZINC000376398150 940912607 /nfs/dbraw/zinc/91/26/07/940912607.db2.gz URKNOPCYUYXDGC-UHFFFAOYSA-N 0 0 352.390 3.823 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1F)C(=O)Nc1ccc2c(c1)OCO2 ZINC000613527003 940916764 /nfs/dbraw/zinc/91/67/64/940916764.db2.gz RKNABVACHBCKIU-SECBINFHSA-N 0 0 364.354 3.582 20 5 FHBDRN COc1ccc(NC(=O)c2ccc(Br)cc2[N+](=O)[O-])c(C)c1 ZINC000175744657 940918261 /nfs/dbraw/zinc/91/82/61/940918261.db2.gz GTCRLTQANPRSGA-UHFFFAOYSA-N 0 0 365.183 3.927 20 5 FHBDRN C[C@H]1C[C@H]1C(=O)Nc1ccc(C(=O)OCc2ccc([N+](=O)[O-])c(F)c2)cc1 ZINC000782782908 940952054 /nfs/dbraw/zinc/95/20/54/940952054.db2.gz ITPRHIKUHJUKSW-XHDPSFHLSA-N 0 0 372.352 3.685 20 5 FHBDRN O=C1NCCc2c(N[C@@H]3CCC[C@@H]3Cc3ccccc3[N+](=O)[O-])cccc21 ZINC000414322034 940967942 /nfs/dbraw/zinc/96/79/42/940967942.db2.gz RUSKZNYSZOYCNU-RDTXWAMCSA-N 0 0 365.433 3.704 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N1c2ccccc2[C@H](C)CC1(C)C ZINC000180325559 940972714 /nfs/dbraw/zinc/97/27/14/940972714.db2.gz YKXKJPZFSCRXJW-CYBMUJFWSA-N 0 0 356.426 3.809 20 5 FHBDRN Cc1ccccc1Cc1noc(CN[C@@H](C)c2cccc([N+](=O)[O-])c2)n1 ZINC000180406715 941005836 /nfs/dbraw/zinc/00/58/36/941005836.db2.gz MZXOVFUINRUCBL-AWEZNQCLSA-N 0 0 352.394 3.728 20 5 FHBDRN O=C1OC(c2cccc([N+](=O)[O-])c2)=N/C1=C/c1cc([N+](=O)[O-])ccc1Cl ZINC000255910267 941018950 /nfs/dbraw/zinc/01/89/50/941018950.db2.gz WIKLDEJOBVCDCV-RIYZIHGNSA-N 0 0 373.708 3.501 20 5 FHBDRN Cc1noc(C)c1[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000180467001 941019828 /nfs/dbraw/zinc/01/98/28/941019828.db2.gz ZSUIMSXYXVVRNR-SSDOTTSWSA-N 0 0 357.288 3.961 20 5 FHBDRN CCn1c(-c2cccc([N+](=O)[O-])c2)nnc1N(C)[C@@H]1CCc2ccccc21 ZINC000460247877 941029242 /nfs/dbraw/zinc/02/92/42/941029242.db2.gz VTYSQHQFSWQXPL-GOSISDBHSA-N 0 0 363.421 3.997 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1nnc(Cc2ccc(F)cc2)s1 ZINC000106704312 945369161 /nfs/dbraw/zinc/36/91/61/945369161.db2.gz GRRLFGCRPPTPRY-UHFFFAOYSA-N 0 0 372.381 3.737 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)Nc2cc(C(F)(F)F)ccn2)c1 ZINC000180548198 941046294 /nfs/dbraw/zinc/04/62/94/941046294.db2.gz MQZAXANTIMZNER-UHFFFAOYSA-N 0 0 357.313 3.983 20 5 FHBDRN C[C@@H](NC(=O)c1c(N)cccc1[N+](=O)[O-])c1ccc(Cl)cc1Cl ZINC000180595853 941049620 /nfs/dbraw/zinc/04/96/20/941049620.db2.gz FMPINTJFWYHAQB-MRVPVSSYSA-N 0 0 354.193 3.975 20 5 FHBDRN C[C@@H](NC(=O)c1ccc(Br)c(O)c1)c1cccc([N+](=O)[O-])c1 ZINC000136768952 941054697 /nfs/dbraw/zinc/05/46/97/941054697.db2.gz XCFGDFSZKRHZDW-SECBINFHSA-N 0 0 365.183 3.554 20 5 FHBDRN Cc1csc([C@@H](C)CNC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)n1 ZINC000186797483 941056922 /nfs/dbraw/zinc/05/69/22/941056922.db2.gz YKZMJTIZIJGLOT-LBPRGKRZSA-N 0 0 374.466 3.837 20 5 FHBDRN CCS[C@@H]1CCC[C@@H]1NC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000176536734 941058410 /nfs/dbraw/zinc/05/84/10/941058410.db2.gz XKGCCXOMZFGFRT-WCQYABFASA-N 0 0 373.272 3.761 20 5 FHBDRN C[C@H](c1ccccc1)S(=O)(=O)N(C)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000583113163 941059449 /nfs/dbraw/zinc/05/94/49/941059449.db2.gz ZBPZLRJXNZNWKQ-GFCCVEGCSA-N 0 0 368.842 3.771 20 5 FHBDRN O=[N+]([O-])c1ccc(Cl)cc1N1CCC(c2noc(C(F)F)n2)CC1 ZINC000376468863 941060056 /nfs/dbraw/zinc/06/00/56/941060056.db2.gz WUTMFSRXXWMGRD-UHFFFAOYSA-N 0 0 358.732 3.953 20 5 FHBDRN Cc1nc(Br)ccc1NC(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000180689147 941065476 /nfs/dbraw/zinc/06/54/76/941065476.db2.gz HBOVEFGBQDZZLJ-UHFFFAOYSA-N 0 0 370.590 3.966 20 5 FHBDRN COc1ccccc1[C@@H](C)CC(=O)OCCOc1ccccc1[N+](=O)[O-] ZINC000728663610 941065497 /nfs/dbraw/zinc/06/54/97/941065497.db2.gz VAPZYCDZEFWILD-AWEZNQCLSA-N 0 0 359.378 3.719 20 5 FHBDRN Cc1cnc(OCC(=O)N[C@H](c2cccs2)C(C)(C)C)c([N+](=O)[O-])c1 ZINC000176704425 941070389 /nfs/dbraw/zinc/07/03/89/941070389.db2.gz LJLFISRYNLJOJT-OAHLLOKOSA-N 0 0 363.439 3.642 20 5 FHBDRN O=C(Nc1ccc2cc([N+](=O)[O-])ccc2n1)c1ccn(-c2ccccc2)n1 ZINC000176705871 941070560 /nfs/dbraw/zinc/07/05/60/941070560.db2.gz LDVQLTSLSDFEQE-UHFFFAOYSA-N 0 0 359.345 3.581 20 5 FHBDRN O=C(Nc1ncc(-c2ccccc2)s1)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000180770459 941073437 /nfs/dbraw/zinc/07/34/37/941073437.db2.gz HQUOSKMFNUOHBP-UHFFFAOYSA-N 0 0 369.358 3.699 20 5 FHBDRN C[C@H](C(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1)n1cnc2ccccc21 ZINC000176882390 941082738 /nfs/dbraw/zinc/08/27/38/941082738.db2.gz VSNFFDULMFINPS-CYBMUJFWSA-N 0 0 352.394 3.557 20 5 FHBDRN COc1ccc(C(=O)NC(C)(C)c2ccc(F)c(F)c2)cc1[N+](=O)[O-] ZINC000176891798 941084198 /nfs/dbraw/zinc/08/41/98/941084198.db2.gz JRYIRNRAJYDQMD-UHFFFAOYSA-N 0 0 350.321 3.547 20 5 FHBDRN CN(Cc1ccc(Br)o1)C(=O)c1cccc(Cl)c1[N+](=O)[O-] ZINC000149148756 941085332 /nfs/dbraw/zinc/08/53/32/941085332.db2.gz CWSADFLSAQYPPM-UHFFFAOYSA-N 0 0 373.590 3.876 20 5 FHBDRN CCCCc1nc2cc(NC(=O)c3c(N)cccc3[N+](=O)[O-])ccc2[nH]1 ZINC000180855382 941085860 /nfs/dbraw/zinc/08/58/60/941085860.db2.gz DGPSLZWNPZYDQH-UHFFFAOYSA-N 0 0 353.382 3.648 20 5 FHBDRN COc1ccc2c(c1)C[C@H](C)N(C(=O)c1cc(F)cc([N+](=O)[O-])c1)[C@H]2C ZINC000541002699 941086302 /nfs/dbraw/zinc/08/63/02/941086302.db2.gz SFZXEFVPXWNZDY-RYUDHWBXSA-N 0 0 358.369 3.891 20 5 FHBDRN CCOc1ccccc1CNC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000180880839 941086475 /nfs/dbraw/zinc/08/64/75/941086475.db2.gz XVKVFDPVCYEWMD-UHFFFAOYSA-N 0 0 366.320 3.525 20 5 FHBDRN COc1ccc(-c2ccc(C)c(NC(=O)c3cc([N+](=O)[O-])cn3C)c2)cn1 ZINC000549085557 941086959 /nfs/dbraw/zinc/08/69/59/941086959.db2.gz QGTXCHZAVIUPMY-UHFFFAOYSA-N 0 0 366.377 3.565 20 5 FHBDRN CC[C@H](CNc1c([N+](=O)[O-])ncn1C)Oc1cccc(C(F)(F)F)c1 ZINC000431829853 941090157 /nfs/dbraw/zinc/09/01/57/941090157.db2.gz YSXUUAPVQFUYMT-LLVKDONJSA-N 0 0 358.320 3.617 20 5 FHBDRN Nc1cccc([N+](=O)[O-])c1C(=O)N1Cc2ccccc2[C@@H](c2ccccc2)C1 ZINC000180903181 941090532 /nfs/dbraw/zinc/09/05/32/941090532.db2.gz FFYADJIAQVIAHR-GOSISDBHSA-N 0 0 373.412 3.965 20 5 FHBDRN COc1cc(C)c(CN(C)Cc2nc3cc([N+](=O)[O-])ccc3o2)cc1OC ZINC000176990178 941091991 /nfs/dbraw/zinc/09/19/91/941091991.db2.gz AVBBDMWSBOSDSP-UHFFFAOYSA-N 0 0 371.393 3.694 20 5 FHBDRN CCS[C@H]1CCCC[C@H]1NC(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000511512474 941093980 /nfs/dbraw/zinc/09/39/80/941093980.db2.gz LBTVUELSEKZKKS-SJORKVTESA-N 0 0 365.499 3.843 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2cnn(CN3CCO[C@@H](c4ccsc4)C3)c2)cc1 ZINC000122155946 941094575 /nfs/dbraw/zinc/09/45/75/941094575.db2.gz CFYGUJIUBYHPGN-GOSISDBHSA-N 0 0 370.434 3.551 20 5 FHBDRN CC(C)(NC(=O)Nc1ccc2c(c1)CCCO2)c1ccc([N+](=O)[O-])cc1 ZINC000177064417 941097171 /nfs/dbraw/zinc/09/71/71/941097171.db2.gz BRGRQVLRPDGLPB-UHFFFAOYSA-N 0 0 355.394 3.977 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CCc2[nH]c3ccccc3c2C1 ZINC000188829243 941098314 /nfs/dbraw/zinc/09/83/14/941098314.db2.gz PYBKYKPBMHWXLQ-UHFFFAOYSA-N 0 0 350.378 3.975 20 5 FHBDRN Cc1cc(C(=O)N(c2cccc(F)c2)C2CCOCC2)cc([N+](=O)[O-])c1 ZINC000180987711 941099184 /nfs/dbraw/zinc/09/91/84/941099184.db2.gz XPIDHLVRZRHWAP-UHFFFAOYSA-N 0 0 358.369 3.868 20 5 FHBDRN CC(C)CCSc1ccc(C(=O)N2CC[C@@H]([C@@H](C)O)C2)cc1[N+](=O)[O-] ZINC000180994929 941101529 /nfs/dbraw/zinc/10/15/29/941101529.db2.gz SBTJGVJFZZACJT-UKRRQHHQSA-N 0 0 366.483 3.576 20 5 FHBDRN CC(C)CCSc1ccc(C(=O)N2CC[C@@H]([C@H](C)O)C2)cc1[N+](=O)[O-] ZINC000180994962 941101563 /nfs/dbraw/zinc/10/15/63/941101563.db2.gz SBTJGVJFZZACJT-DZGCQCFKSA-N 0 0 366.483 3.576 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N[C@@H](C)c1nc2ccccc2[nH]1 ZINC000091846238 941108097 /nfs/dbraw/zinc/10/80/97/941108097.db2.gz GBWGUWLJUJDKRA-ZDUSSCGKSA-N 0 0 352.394 3.887 20 5 FHBDRN O=C(NCc1ccc(Sc2ccc(F)cc2)cc1)c1[nH]ncc1[N+](=O)[O-] ZINC000181118539 941109909 /nfs/dbraw/zinc/10/99/09/941109909.db2.gz HZJSMNQJKPECQA-UHFFFAOYSA-N 0 0 372.381 3.538 20 5 FHBDRN CC(C)[C@H]1C[C@@H](CC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)CCO1 ZINC000541028597 941114975 /nfs/dbraw/zinc/11/49/75/941114975.db2.gz CDYNXFNTMOJQHO-HNAYVOBHSA-N 0 0 360.454 3.927 20 5 FHBDRN C[C@]1(c2ccccc2)CCCN(C(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)C1 ZINC000181239162 941115432 /nfs/dbraw/zinc/11/54/32/941115432.db2.gz BBTCZLJMEXMJQH-FQEVSTJZSA-N 0 0 368.389 3.517 20 5 FHBDRN Cc1cc(Br)c(C(=O)OCC(C)(C)[N+](=O)[O-])cc1Cl ZINC000851130615 941123400 /nfs/dbraw/zinc/12/34/00/941123400.db2.gz ZNCMIINWLVXSJZ-UHFFFAOYSA-N 0 0 350.596 3.623 20 5 FHBDRN NC(=O)[C@@H]1CCC[C@@H](Nc2cc(Cl)c(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000150901336 941123740 /nfs/dbraw/zinc/12/37/40/941123740.db2.gz LTWMNTCHZXSYGA-HTQZYQBOSA-N 0 0 365.739 3.723 20 5 FHBDRN C[C@@]1(C(=O)N2CCc3c(Br)ccc([N+](=O)[O-])c3C2)C=CCC1 ZINC000935875391 941127045 /nfs/dbraw/zinc/12/70/45/941127045.db2.gz KYFBBILMORNRIU-MRXNPFEDSA-N 0 0 365.227 3.598 20 5 FHBDRN COC(=O)c1c(C2CC2)csc1NC(=O)c1cccc([N+](=O)[O-])c1C ZINC000177520889 941132254 /nfs/dbraw/zinc/13/22/54/941132254.db2.gz OCEMYJLSAYUTTQ-UHFFFAOYSA-N 0 0 360.391 3.881 20 5 FHBDRN COCc1ccc(CS(=O)(=O)[C@@H](C)c2cc([N+](=O)[O-])ccc2C)cc1 ZINC000414428114 941133084 /nfs/dbraw/zinc/13/30/84/941133084.db2.gz NJXWNYLERHFACY-AWEZNQCLSA-N 0 0 363.435 3.726 20 5 FHBDRN Cc1cnc(C(=O)Nc2ccc(OCc3ccccc3)cc2[N+](=O)[O-])cn1 ZINC000188955777 941133809 /nfs/dbraw/zinc/13/38/09/941133809.db2.gz UBUGPFJJPNGYGB-UHFFFAOYSA-N 0 0 364.361 3.525 20 5 FHBDRN O=C(Nc1ccc(OCc2ccccc2)cc1[N+](=O)[O-])c1cscn1 ZINC000188956128 941134104 /nfs/dbraw/zinc/13/41/04/941134104.db2.gz VZAOGTUHVKWYLB-UHFFFAOYSA-N 0 0 355.375 3.883 20 5 FHBDRN O=C(Nc1ccc(OCc2ccccc2)cc1[N+](=O)[O-])[C@@H]1CCCOC1 ZINC000188960704 941134111 /nfs/dbraw/zinc/13/41/11/941134111.db2.gz VBUKTSGMVKFOAX-OAHLLOKOSA-N 0 0 356.378 3.539 20 5 FHBDRN Cc1cc(CC(=O)Nc2ccc(OCc3ccccc3)cc2[N+](=O)[O-])no1 ZINC000188960876 941134117 /nfs/dbraw/zinc/13/41/17/941134117.db2.gz SUAYZFSKXJZYPD-UHFFFAOYSA-N 0 0 367.361 3.651 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1-c1nc(Cc2cc(C(F)(F)F)ccn2)no1 ZINC000463175377 941134901 /nfs/dbraw/zinc/13/49/01/941134901.db2.gz BERCYVXVQXAGAP-UHFFFAOYSA-N 0 0 364.283 3.958 20 5 FHBDRN COCCCCC(=O)Nc1ccc(OCc2ccccc2)cc1[N+](=O)[O-] ZINC000188969111 941135548 /nfs/dbraw/zinc/13/55/48/941135548.db2.gz QYJKDQXZHUPZRQ-UHFFFAOYSA-N 0 0 358.394 3.929 20 5 FHBDRN O=C(Nc1ccc(OCc2ccccc2)cc1[N+](=O)[O-])c1ccc(F)cn1 ZINC000188973080 941135708 /nfs/dbraw/zinc/13/57/08/941135708.db2.gz BZZLSDQQPIYYHA-UHFFFAOYSA-N 0 0 367.336 3.960 20 5 FHBDRN CC[C@@H](C)OCC(=O)Nc1ccc(OCc2ccccc2)cc1[N+](=O)[O-] ZINC000188974802 941137399 /nfs/dbraw/zinc/13/73/99/941137399.db2.gz XKBZZSUKABBHKW-CQSZACIVSA-N 0 0 358.394 3.927 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CS(=O)(=O)Cc1c(C)cccc1Cl ZINC000414431208 941137551 /nfs/dbraw/zinc/13/75/51/941137551.db2.gz QXMQIIXATBFOTL-UHFFFAOYSA-N 0 0 369.826 3.680 20 5 FHBDRN Cc1nnc(-c2ccccc2NC(=O)c2cc([N+](=O)[O-])cc(C)c2F)o1 ZINC000376555433 941144845 /nfs/dbraw/zinc/14/48/45/941144845.db2.gz ZCRYAXGRNSKSOW-UHFFFAOYSA-N 0 0 356.313 3.653 20 5 FHBDRN Cc1nc(CC2CC2)sc1C(=O)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000189079867 941144965 /nfs/dbraw/zinc/14/49/65/941144965.db2.gz PJGARNFNUNADCK-UHFFFAOYSA-N 0 0 357.435 3.905 20 5 FHBDRN Cc1ccc2c(n1)OCCN2C(=O)c1cc([N+](=O)[O-])ccc1SC(C)C ZINC000189135939 941147248 /nfs/dbraw/zinc/14/72/48/941147248.db2.gz NDXVFTGSQFEMKB-UHFFFAOYSA-N 0 0 373.434 3.838 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)NC[C@@H](C)c1ccc(C(F)(F)F)cc1 ZINC000189163964 941148058 /nfs/dbraw/zinc/14/80/58/941148058.db2.gz CIYFTTXZNJKILD-SNVBAGLBSA-N 0 0 367.327 3.851 20 5 FHBDRN CC(C)c1nnc2ccc(NC(=O)c3cc(Cl)cc([N+](=O)[O-])c3)cn21 ZINC000189235053 941155074 /nfs/dbraw/zinc/15/50/74/941155074.db2.gz XANPGICYTZTNLI-UHFFFAOYSA-N 0 0 359.773 3.667 20 5 FHBDRN C[C@H]1CCC[C@@H](NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)CC1 ZINC000189247446 941155288 /nfs/dbraw/zinc/15/52/88/941155288.db2.gz OKFPEKDCGDTFML-DOTOQJQBSA-N 0 0 359.470 3.896 20 5 FHBDRN COc1cc(NC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)ccc1F ZINC000189421176 941157222 /nfs/dbraw/zinc/15/72/22/941157222.db2.gz AWJLRQJLWZBHNS-SNVBAGLBSA-N 0 0 350.371 3.862 20 5 FHBDRN O=[N+]([O-])c1ccc(CNCc2cnn(Cc3ccc(F)cc3)c2)c(Cl)c1 ZINC000189410945 941157249 /nfs/dbraw/zinc/15/72/49/941157249.db2.gz XOSSLDYSIPNSBK-UHFFFAOYSA-N 0 0 374.803 3.922 20 5 FHBDRN COC[C@@H](Cc1ccccc1)N(C)C(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000189482416 941158975 /nfs/dbraw/zinc/15/89/75/941158975.db2.gz WIAGWBQEPIFYPP-OAHLLOKOSA-N 0 0 362.813 3.578 20 5 FHBDRN COC[C@H](Cc1ccccc1)N(C)C(=O)c1cc(SC)ccc1[N+](=O)[O-] ZINC000189502209 941159242 /nfs/dbraw/zinc/15/92/42/941159242.db2.gz GDWJKEZTRKSLMY-HNNXBMFYSA-N 0 0 374.462 3.646 20 5 FHBDRN CCOC[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1SC(C)C)C(C)C ZINC000189563305 941161293 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O=C(NCC1(c2ccc(C(F)(F)F)cc2)CC1)c1ccc([N+](=O)[O-])o1 ZINC000189622390 941227545 /nfs/dbraw/zinc/22/75/45/941227545.db2.gz RLFAEADTMPCYQB-UHFFFAOYSA-N 0 0 354.284 3.668 20 5 FHBDRN CC(C)(NC(=O)c1ccc([N+](=O)[O-])o1)c1ccc(OC(F)(F)F)cc1 ZINC000189649282 941240297 /nfs/dbraw/zinc/24/02/97/941240297.db2.gz QFJFRFKKSNTINK-UHFFFAOYSA-N 0 0 358.272 3.752 20 5 FHBDRN O=[N+]([O-])c1ccc(CNCc2csc(-c3ccc4c(c3)OCO4)n2)cc1 ZINC000103170475 941247431 /nfs/dbraw/zinc/24/74/31/941247431.db2.gz LCVGPMLMJFBWEY-UHFFFAOYSA-N 0 0 369.402 3.737 20 5 FHBDRN CN(Cc1cnn(Cc2ccc(F)cc2)c1)Cc1ccccc1[N+](=O)[O-] ZINC000189667059 941250434 /nfs/dbraw/zinc/25/04/34/941250434.db2.gz UCJDISXECUIUQE-UHFFFAOYSA-N 0 0 354.385 3.611 20 5 FHBDRN Cc1ncsc1C(=O)Nc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1 ZINC000128310663 941256319 /nfs/dbraw/zinc/25/63/19/941256319.db2.gz DLMCPDBJDOSGRG-UHFFFAOYSA-N 0 0 367.386 3.843 20 5 FHBDRN C[C@@H](C1CC1)n1cc(NC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)cn1 ZINC000189757000 941273249 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FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N2C[C@H](n3cccn3)Cc3ccccc32)c1 ZINC000072527090 941326028 /nfs/dbraw/zinc/32/60/28/941326028.db2.gz WUMCSWGBVJEGMN-MRXNPFEDSA-N 0 0 362.389 3.544 20 5 FHBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1C[C@H]2CCCC[C@@H]2C1 ZINC000408001761 941332830 /nfs/dbraw/zinc/33/28/30/941332830.db2.gz ACPLGUYRBAOTJM-VXGBXAGGSA-N 0 0 367.243 3.928 20 5 FHBDRN O=C(C[C@@H]1CCC[C@H](C(F)(F)F)O1)N1CCCc2ccc([N+](=O)[O-])cc21 ZINC001125848651 941341474 /nfs/dbraw/zinc/34/14/74/941341474.db2.gz VOYADFFIQXWZQI-DZGCQCFKSA-N 0 0 372.343 3.764 20 5 FHBDRN C[C@H]1CCC[C@H](C)N1C(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000103366417 941367281 /nfs/dbraw/zinc/36/72/81/941367281.db2.gz FHGDJVYWPHCWFM-QWRGUYRKSA-N 0 0 360.332 3.939 20 5 FHBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CCS[C@H](C)CC1 ZINC000408021973 941394046 /nfs/dbraw/zinc/39/40/46/941394046.db2.gz KOSQZRSMNNFMPD-SECBINFHSA-N 0 0 373.272 3.633 20 5 FHBDRN COc1ccc(CCNC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc32)c(Cl)c1 ZINC000472648284 941472811 /nfs/dbraw/zinc/47/28/11/941472811.db2.gz GLMNUQBUGJWOPE-UHFFFAOYSA-N 0 0 373.796 3.711 20 5 FHBDRN C/C=C/C[C@H](CO)Nc1ccc(C(=O)Nc2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000472652111 941487420 /nfs/dbraw/zinc/48/74/20/941487420.db2.gz SIEXCLARLFONPO-REMYHPOOSA-N 0 0 369.421 3.895 20 5 FHBDRN CO[C@H](CC(C)C)C(=O)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F ZINC000414887437 941502021 /nfs/dbraw/zinc/50/20/21/941502021.db2.gz IUAOJYLMIXKKBZ-CQSZACIVSA-N 0 0 362.348 3.547 20 5 FHBDRN Cc1nn(CCC(=O)N2CCC[C@H](c3ccccc3)CC2)c(C)c1[N+](=O)[O-] ZINC000066762584 941515915 /nfs/dbraw/zinc/51/59/15/941515915.db2.gz XJQYIHQRHOIJCL-SFHVURJKSA-N 0 0 370.453 3.595 20 5 FHBDRN CC(=O)Nc1cccc([C@@H](C)NC(=O)c2c(Cl)cccc2[N+](=O)[O-])c1 ZINC000110198264 941526288 /nfs/dbraw/zinc/52/62/88/941526288.db2.gz DWDRMASHCBVUNK-SNVBAGLBSA-N 0 0 361.785 3.698 20 5 FHBDRN CCCN(CC)c1ccc(C(=O)N(C)CCc2cccc([N+](=O)[O-])c2)cn1 ZINC000549145163 941529889 /nfs/dbraw/zinc/52/98/89/941529889.db2.gz OMXBDGGZKZOUIA-UHFFFAOYSA-N 0 0 370.453 3.541 20 5 FHBDRN Cc1nc(-c2cccc(NC(=O)c3ccc(Cl)cc3[N+](=O)[O-])c2)n[nH]1 ZINC000377169091 941535281 /nfs/dbraw/zinc/53/52/81/941535281.db2.gz UBRRAJJFYDACNI-UHFFFAOYSA-N 0 0 357.757 3.594 20 5 FHBDRN Cc1c(C(=O)N2CCC[C@H]2c2cccc3c2OCCO3)cccc1[N+](=O)[O-] ZINC000066772167 941540990 /nfs/dbraw/zinc/54/09/90/941540990.db2.gz YPUBQDQKVFJEBP-KRWDZBQOSA-N 0 0 368.389 3.652 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(Nc2cn(CC(C)C)nc2C(F)F)c1 ZINC000541113626 941585899 /nfs/dbraw/zinc/58/58/99/941585899.db2.gz JTYBFCIMVQKQKP-UHFFFAOYSA-N 0 0 368.340 3.915 20 5 FHBDRN O=C(c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)N1CC[C@@H](CC2CCCC2)C1 ZINC000377247956 941592944 /nfs/dbraw/zinc/59/29/44/941592944.db2.gz CUMMUXDOWYFIBC-AWEZNQCLSA-N 0 0 369.421 3.891 20 5 FHBDRN CCO[C@@H](CCNC(=O)Nc1ccc(OC)c([N+](=O)[O-])c1)C1CCCC1 ZINC000541105303 941594954 /nfs/dbraw/zinc/59/49/54/941594954.db2.gz JNHLJMSBRBCTKZ-INIZCTEOSA-N 0 0 365.430 3.710 20 5 FHBDRN C[C@@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)c1c[nH]nc1[N+](=O)[O-] ZINC000549183272 941604275 /nfs/dbraw/zinc/60/42/75/941604275.db2.gz DLYNQSJWXSDYAY-ZDUSSCGKSA-N 0 0 350.378 3.818 20 5 FHBDRN CCCCc1ccc(NC(=O)C(=O)Nc2cc(F)cc([N+](=O)[O-])c2)cc1 ZINC000472706717 941609702 /nfs/dbraw/zinc/60/97/02/941609702.db2.gz JDLNCMPJUMEZDV-UHFFFAOYSA-N 0 0 359.357 3.654 20 5 FHBDRN CCn1cc(C(=O)N2CCCCc3cc([N+](=O)[O-])ccc32)c(C2CC2)n1 ZINC000892853549 941620623 /nfs/dbraw/zinc/62/06/23/941620623.db2.gz LESCSXYNOSVMLX-UHFFFAOYSA-N 0 0 354.410 3.672 20 5 FHBDRN C[C@H](NS(=O)(=O)Cc1ccccc1[N+](=O)[O-])[C@@H](C)C1CCCCC1 ZINC000545365952 941643255 /nfs/dbraw/zinc/64/32/55/941643255.db2.gz AFKIFECPLUBLLH-KGLIPLIRSA-N 0 0 354.472 3.619 20 5 FHBDRN C[C@@H](C(=O)N1CC2(CCOCC2)[C@@H]2CCC[C@@H]21)c1cccc([N+](=O)[O-])c1 ZINC000583245485 941643696 /nfs/dbraw/zinc/64/36/96/941643696.db2.gz GVSKPXCLSKGMDN-OLMNPRSZSA-N 0 0 358.438 3.506 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N(CCOC)[C@H](C)c2ccccc2)c1 ZINC000549208264 941644680 /nfs/dbraw/zinc/64/46/80/941644680.db2.gz 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941811703 /nfs/dbraw/zinc/81/17/03/941811703.db2.gz LANPWEGDXAGJJJ-UHFFFAOYSA-N 0 0 350.094 3.621 20 5 FHBDRN COC(=O)[C@@H](C)[C@H](NCc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000182348119 941811887 /nfs/dbraw/zinc/81/18/87/941811887.db2.gz WTRCOSTVWJYSQT-SJCJKPOMSA-N 0 0 362.813 3.888 20 5 FHBDRN O=C(Nc1cccc(O)c1F)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000129328939 941815443 /nfs/dbraw/zinc/81/54/43/941815443.db2.gz FGNJWMFJTKYPNW-UHFFFAOYSA-N 0 0 359.338 3.815 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1ccc(OC(F)F)c(F)c1 ZINC000549278506 941823785 /nfs/dbraw/zinc/82/37/85/941823785.db2.gz BHADLRIEHCCSDT-UHFFFAOYSA-N 0 0 354.284 3.608 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N[C@H](c2ccccc2C)C2CC2)c1F ZINC000412131630 941824749 /nfs/dbraw/zinc/82/47/49/941824749.db2.gz WHYQWIZZVDKQKX-FQEVSTJZSA-N 0 0 372.396 3.861 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N[C@@H](c2ccccc2)C2CCC2)c1F ZINC000412131375 941824798 /nfs/dbraw/zinc/82/47/98/941824798.db2.gz WHVGWCXJMTZGLN-FQEVSTJZSA-N 0 0 372.396 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FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@@H](CC(F)(F)F)C1 ZINC000433741472 941860670 /nfs/dbraw/zinc/86/06/70/941860670.db2.gz IBWFYOKIMDGLIK-KBPBESRZSA-N 0 0 358.360 3.964 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](C)c2cccc(F)c2F)c1 ZINC000549294573 941867704 /nfs/dbraw/zinc/86/77/04/941867704.db2.gz RMNXJZZUEDQRDD-JTQLQIEISA-N 0 0 350.321 3.763 20 5 FHBDRN CC[C@@H]1CCC[C@@H]1c1nc(-c2ccc(-n3cncn3)c([N+](=O)[O-])c2)no1 ZINC000453204703 941868524 /nfs/dbraw/zinc/86/85/24/941868524.db2.gz WGUHFCDSZSIPDX-YPMHNXCESA-N 0 0 354.370 3.519 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N[C@H]2CCCC[C@@H]2Cc2ccccc2)c1[N+](=O)[O-] ZINC000433760364 941879263 /nfs/dbraw/zinc/87/92/63/941879263.db2.gz UUMYPMACVAVLFX-CVEARBPZSA-N 0 0 370.453 3.973 20 5 FHBDRN CCCC[C@@H](NC(=O)Cc1c(F)c(OC)ccc1[N+](=O)[O-])C1CCC1 ZINC000412183674 941882591 /nfs/dbraw/zinc/88/25/91/941882591.db2.gz MODJZOYJBMOYBY-CQSZACIVSA-N 0 0 352.406 3.760 20 5 FHBDRN CO[C@H]1CC[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2SCC(C)C)C1 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354.406 3.818 20 5 FHBDRN Cc1ccc(-c2noc(Cn3cc(-c4ccc([N+](=O)[O-])cc4)cn3)n2)cc1 ZINC000103463331 941897507 /nfs/dbraw/zinc/89/75/07/941897507.db2.gz WFULSUMYGGOVJC-UHFFFAOYSA-N 0 0 361.361 3.865 20 5 FHBDRN O=C(Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1)Nc1cc(Cl)ccc1F ZINC000103463299 941897962 /nfs/dbraw/zinc/89/79/62/941897962.db2.gz FLIDTFBDCFCLNG-UHFFFAOYSA-N 0 0 374.759 3.890 20 5 FHBDRN Cc1cn([C@@H](C)c2ccccc2)[nH]c1=NC(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000472843141 941926109 /nfs/dbraw/zinc/92/61/09/941926109.db2.gz ZOMRSZAUVBSGRW-HNNXBMFYSA-N 0 0 364.405 3.692 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N(C)Cc2ccccc2C(F)(F)F)c1[N+](=O)[O-] ZINC000433830563 941927428 /nfs/dbraw/zinc/92/74/28/941927428.db2.gz XVHATXXPOFTXNF-UHFFFAOYSA-N 0 0 370.331 3.732 20 5 FHBDRN CC(C)CCSc1ccc(C(=O)N[C@@H](C)c2ncon2)cc1[N+](=O)[O-] ZINC000182545320 941941726 /nfs/dbraw/zinc/94/17/26/941941726.db2.gz XHFDLYZPCOCYCG-NSHDSACASA-N 0 0 364.427 3.607 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N2CCC(Cc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000433856210 941942770 /nfs/dbraw/zinc/94/27/70/941942770.db2.gz WOFQRXNSKZNBJZ-UHFFFAOYSA-N 0 0 356.426 3.536 20 5 FHBDRN CC[C@H](NC(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-])C(F)F ZINC000452267302 941948427 /nfs/dbraw/zinc/94/84/27/941948427.db2.gz VAYCESQZXLTLCH-HNNXBMFYSA-N 0 0 364.348 3.947 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N2CC=C(c3ccc(F)cc3)CC2)c1[N+](=O)[O-] ZINC000433873044 941950008 /nfs/dbraw/zinc/95/00/08/941950008.db2.gz ONUBAPGMOYPGJD-UHFFFAOYSA-N 0 0 358.373 3.510 20 5 FHBDRN Cc1ccc([C@@H]2CCCN2C(=O)NCCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000517551037 941952652 /nfs/dbraw/zinc/95/26/52/941952652.db2.gz JQNWJOYSNHKQKO-IBGZPJMESA-N 0 0 353.422 3.992 20 5 FHBDRN C[C@@H]1CCc2onc(C(=O)N3CCS[C@@H]3c3ccc([N+](=O)[O-])cc3)c2C1 ZINC000433865103 941953056 /nfs/dbraw/zinc/95/30/56/941953056.db2.gz NQIFJZBJSQJDLK-ADLMAVQZSA-N 0 0 373.434 3.595 20 5 FHBDRN CC[C@@H](C)Oc1cc(CNC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)ccn1 ZINC000412244656 941955807 /nfs/dbraw/zinc/95/58/07/941955807.db2.gz PBKXNMNJXSZSBZ-JEBQAFNWSA-N 0 0 369.421 3.587 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1OC(F)F)N1CCc2cc(F)ccc2C1 ZINC000182777394 941959437 /nfs/dbraw/zinc/95/94/37/941959437.db2.gz FBHSZNOCQDSLGY-UHFFFAOYSA-N 0 0 366.295 3.534 20 5 FHBDRN O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC(c2cn[nH]c2)CC1 ZINC000377749300 941960990 /nfs/dbraw/zinc/96/09/90/941960990.db2.gz VOOVDFGBWRDRDQ-UHFFFAOYSA-N 0 0 356.407 3.552 20 5 FHBDRN C[C@H](O)C[C@H]1CCCCCN1C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000513497462 941963645 /nfs/dbraw/zinc/96/36/45/941963645.db2.gz XFMVUOOEKPPTRV-NWDGAFQWSA-N 0 0 355.822 3.796 20 5 FHBDRN C[C@H]1C[C@H](c2cccnc2)N(C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000182814280 941972022 /nfs/dbraw/zinc/97/20/22/941972022.db2.gz PQRHKDDOGNSAKB-YVEFUNNKSA-N 0 0 359.813 3.795 20 5 FHBDRN CS(=O)(=O)c1cccc(N[C@@H]2CCC[C@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000122634563 941973512 /nfs/dbraw/zinc/97/35/12/941973512.db2.gz OCJXYWRKDDDYLM-LSDHHAIUSA-N 0 0 360.435 3.747 20 5 FHBDRN CS(=O)(=O)c1cc(SCc2c(F)cccc2F)ccc1[N+](=O)[O-] ZINC000182861873 941982830 /nfs/dbraw/zinc/98/28/30/941982830.db2.gz FFGJBTDRSDMMMG-UHFFFAOYSA-N 0 0 359.375 3.569 20 5 FHBDRN Cc1nn(C)c(C(=O)NCC2(c3ccccc3C)CCCCC2)c1[N+](=O)[O-] ZINC000101520654 941983387 /nfs/dbraw/zinc/98/33/87/941983387.db2.gz CABKCSPSEBBHIL-UHFFFAOYSA-N 0 0 370.453 3.577 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CC=C(c2ccccc2F)C1 ZINC000412256431 941992287 /nfs/dbraw/zinc/99/22/87/941992287.db2.gz QYOUXNQJKXGTEU-ZWKOTPCHSA-N 0 0 352.365 3.763 20 5 FHBDRN CCOCCOCc1cccc(NC(=O)c2cccc([N+](=O)[O-])c2C)c1 ZINC000046686873 941995371 /nfs/dbraw/zinc/99/53/71/941995371.db2.gz YNGMSRXGBXJMTG-UHFFFAOYSA-N 0 0 358.394 3.709 20 5 FHBDRN Cc1cc(N2CC[C@H](C3CCOCC3)C2)c(Br)cc1[N+](=O)[O-] ZINC000473531294 942013056 /nfs/dbraw/zinc/01/30/56/942013056.db2.gz LCGQPUPEVPGPTN-ZDUSSCGKSA-N 0 0 369.259 3.919 20 5 FHBDRN O=C(NCc1c(F)cccc1N1CCCC1)Nc1ccc([N+](=O)[O-])cc1 ZINC000513559271 942016308 /nfs/dbraw/zinc/01/63/08/942016308.db2.gz VQGHAAAYLUYGOR-UHFFFAOYSA-N 0 0 358.373 3.656 20 5 FHBDRN COc1ccc(F)c(OC)c1C(=O)Nc1ccc([N+](=O)[O-])c(Cl)c1 ZINC001125863297 942016678 /nfs/dbraw/zinc/01/66/78/942016678.db2.gz TUUMOCSTQDEXJT-UHFFFAOYSA-N 0 0 354.721 3.657 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1Cl)N1CC[C@]2(C1)OCc1ccccc12 ZINC000377820672 942018380 /nfs/dbraw/zinc/01/83/80/942018380.db2.gz GTGOVEUJTOEOEP-GOSISDBHSA-N 0 0 373.796 3.912 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N[C@H]2CCCc3sccc32)c1F ZINC000412272453 942021143 /nfs/dbraw/zinc/02/11/43/942021143.db2.gz QJHDFCZYTWGYMB-LBPRGKRZSA-N 0 0 364.398 3.540 20 5 FHBDRN CCN(C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F)[C@H](C)c1cccnc1 ZINC000182955159 942029827 /nfs/dbraw/zinc/02/98/27/942029827.db2.gz RQOTUVHQUCYGQV-LLVKDONJSA-N 0 0 365.336 3.815 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)NCC(C)(C)c2ccc(Cl)cc2)c1[N+](=O)[O-] ZINC000433991705 942031675 /nfs/dbraw/zinc/03/16/75/942031675.db2.gz GGKZRERLYSEWON-UHFFFAOYSA-N 0 0 364.833 3.802 20 5 FHBDRN COC(=O)C[C@@H]1CN(C(=O)c2ccc(Cl)cc2[N+](=O)[O-])c2ccccc21 ZINC000377862420 942039569 /nfs/dbraw/zinc/03/95/69/942039569.db2.gz WWRGQAKCRUTMBC-LLVKDONJSA-N 0 0 374.780 3.555 20 5 FHBDRN CCCCC1CCC(NC(=O)CCn2nc(C)c([N+](=O)[O-])c2C)CC1 ZINC000102241213 942045088 /nfs/dbraw/zinc/04/50/88/942045088.db2.gz WVWKIVPNPSDWIC-UHFFFAOYSA-N 0 0 350.463 3.663 20 5 FHBDRN O=C(c1ccc(OC(F)F)c([N+](=O)[O-])c1)N1CCCc2ccc(F)cc21 ZINC000513651510 942055712 /nfs/dbraw/zinc/05/57/12/942055712.db2.gz BBTAKMHIGAKVOP-UHFFFAOYSA-N 0 0 366.295 3.928 20 5 FHBDRN COc1cc(CN[C@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)ccc1C ZINC000513666979 942064938 /nfs/dbraw/zinc/06/49/38/942064938.db2.gz OUJAHVPIIPIONR-IBGZPJMESA-N 0 0 366.421 3.525 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N(C)C/C(C)=C/c2ccccc2)c1F ZINC000412287556 942065987 /nfs/dbraw/zinc/06/59/87/942065987.db2.gz OZWGRFJBQYKDIL-SDNWHVSQSA-N 0 0 372.396 3.847 20 5 FHBDRN C[C@@H]1C[C@H](c2ccccc2)[C@H](C)N1C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000183031239 942069399 /nfs/dbraw/zinc/06/93/99/942069399.db2.gz ZIMHQLRQNSCGQD-WWGRRREGSA-N 0 0 368.389 3.730 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)Nc2nc(C3CCC3)cs2)c1F ZINC000412291947 942072002 /nfs/dbraw/zinc/07/20/02/942072002.db2.gz LLHCSDHXAXKZHC-UHFFFAOYSA-N 0 0 365.386 3.648 20 5 FHBDRN Cc1cc(C(=O)Nc2cccc(-c3n[nH]c(C4CC4)n3)c2)cc([N+](=O)[O-])c1 ZINC000102626045 942075738 /nfs/dbraw/zinc/07/57/38/942075738.db2.gz AEYPOMYWNCXNAF-UHFFFAOYSA-N 0 0 363.377 3.818 20 5 FHBDRN Cc1c(NC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)cnn1C1CCCC1 ZINC000412293514 942076751 /nfs/dbraw/zinc/07/67/51/942076751.db2.gz OVBVTBRKGVKOBI-DLBZAZTESA-N 0 0 354.410 3.957 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])c(F)c1)NCCCc1ccc(Cl)cc1 ZINC000122720637 942092010 /nfs/dbraw/zinc/09/20/10/942092010.db2.gz OZUUUVOWSWQIOC-UHFFFAOYSA-N 0 0 366.776 3.515 20 5 FHBDRN CCC(=O)c1ccc(N[C@@H]2CCO[C@]3(CCSC3)C2)c([N+](=O)[O-])c1 ZINC000280037818 942092655 /nfs/dbraw/zinc/09/26/55/942092655.db2.gz AMCPNNAJDMVVJD-CXAGYDPISA-N 0 0 350.440 3.654 20 5 FHBDRN Cc1cnc([C@@H]2CCCN(C(=O)Cc3cccc([N+](=O)[O-])c3C)C2)s1 ZINC000366628962 942098646 /nfs/dbraw/zinc/09/86/46/942098646.db2.gz PPIJJMFZJQFGGL-OAHLLOKOSA-N 0 0 359.451 3.617 20 5 FHBDRN CC(C)C[C@H]1C[C@H](NC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])CCO1 ZINC000280068797 942101122 /nfs/dbraw/zinc/10/11/22/942101122.db2.gz HLVYXILRDZBCQP-OLZOCXBDSA-N 0 0 372.824 3.640 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N[C@H](CC)c2ccccc2)cc1OC ZINC000415889658 942110493 /nfs/dbraw/zinc/11/04/93/942110493.db2.gz CAOUUQQCHLDXKR-OAHLLOKOSA-N 0 0 358.394 3.883 20 5 FHBDRN Cc1cnc(N2CCC[C@@H]2c2ccc(Br)cn2)c([N+](=O)[O-])c1 ZINC000413380524 942114184 /nfs/dbraw/zinc/11/41/84/942114184.db2.gz SSMHMBXQMOXDNN-CYBMUJFWSA-N 0 0 363.215 3.797 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1OC(=O)c1cccc(NC(=O)[C@@H]2C[C@@H]2C)c1 ZINC000760015696 942115479 /nfs/dbraw/zinc/11/54/79/942115479.db2.gz HFTVVQIRBZQXRK-SWLSCSKDSA-N 0 0 354.362 3.717 20 5 FHBDRN COC(=O)c1cc(N[C@H](C)c2nc3c(s2)CCC3)cc(C)c1[N+](=O)[O-] ZINC000413388959 942125952 /nfs/dbraw/zinc/12/59/52/942125952.db2.gz ABGHAYUWHIWIHW-SNVBAGLBSA-N 0 0 361.423 3.808 20 5 FHBDRN CC1(C)[C@@H](c2ccccc2)CCN1c1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000420633918 942129930 /nfs/dbraw/zinc/12/99/30/942129930.db2.gz COBYIMKFOKHGCI-MRXNPFEDSA-N 0 0 374.462 3.771 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)NCCOc1ccc(C(F)(F)F)cc1 ZINC000501935132 942134134 /nfs/dbraw/zinc/13/41/34/942134134.db2.gz MAFBHSFZWKLSKR-UHFFFAOYSA-N 0 0 368.311 3.731 20 5 FHBDRN CC(=O)c1cc(N2C[C@@H](C)C[C@H](C(=O)OC(C)(C)C)C2)ccc1[N+](=O)[O-] ZINC000420643450 942138769 /nfs/dbraw/zinc/13/87/69/942138769.db2.gz UJIDGEXOGXEREY-JSGCOSHPSA-N 0 0 362.426 3.602 20 5 FHBDRN C[C@@H](CCCc1cccnc1)Nc1ncc([N+](=O)[O-])cc1Br ZINC000413393409 942141748 /nfs/dbraw/zinc/14/17/48/942141748.db2.gz KPQSLUGCIQEODT-NSHDSACASA-N 0 0 365.231 3.971 20 5 FHBDRN O=C(c1ccc(OC(F)F)c([N+](=O)[O-])c1)N1CC2C[C@@H]3CC1C[C@H](C2)C3 ZINC000513725833 942156302 /nfs/dbraw/zinc/15/63/02/942156302.db2.gz SDBKDNPPEWUVHT-KCXRBIIJSA-N 0 0 366.364 3.847 20 5 FHBDRN CC1CN(C(=O)c2cc([N+](=O)[O-])ccc2NCc2ccccc2Cl)C1 ZINC000513692124 942159456 /nfs/dbraw/zinc/15/94/56/942159456.db2.gz JJRUTFZHEDQUBQ-UHFFFAOYSA-N 0 0 359.813 3.952 20 5 FHBDRN Cc1c(C(=O)NCCCc2c[nH]c3ccc(F)cc23)cccc1[N+](=O)[O-] ZINC000501998455 942161525 /nfs/dbraw/zinc/16/15/25/942161525.db2.gz YPUWNIRISNENQR-UHFFFAOYSA-N 0 0 355.369 3.886 20 5 FHBDRN COc1ccc(C)cc1[C@H](C)Nc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 ZINC000413419491 942162018 /nfs/dbraw/zinc/16/20/18/942162018.db2.gz ZCNOJWZGOWNOPF-LBPRGKRZSA-N 0 0 355.394 3.970 20 5 FHBDRN O=C(CSc1ccc(F)c(F)c1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000016133399 942162488 /nfs/dbraw/zinc/16/24/88/942162488.db2.gz FMEGVIVUOWLYNJ-UHFFFAOYSA-N 0 0 350.346 3.554 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)Nc2ccccc2N(C)C)cc1SC ZINC000102986460 942166724 /nfs/dbraw/zinc/16/67/24/942166724.db2.gz SNNCVABVBWQTOH-UHFFFAOYSA-N 0 0 361.423 3.644 20 5 FHBDRN C[C@@H](C(=O)NCCc1cccc2[nH]ccc21)c1ccc([N+](=O)[O-])cc1F ZINC000502008907 942166889 /nfs/dbraw/zinc/16/68/89/942166889.db2.gz WHBGIOOFDNLJHA-GFCCVEGCSA-N 0 0 355.369 3.678 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)Nc2ccc(F)c(C3CC3)c2)c1F ZINC000412315319 942167093 /nfs/dbraw/zinc/16/70/93/942167093.db2.gz LIYJGMBKPSUWPT-UHFFFAOYSA-N 0 0 362.332 3.940 20 5 FHBDRN CN1Cc2cc(Oc3ccc([N+](=O)[O-])cc3Br)ccc2C1=O ZINC000501993919 942167522 /nfs/dbraw/zinc/16/75/22/942167522.db2.gz KLAKAWBMTNFXBU-UHFFFAOYSA-N 0 0 363.167 3.735 20 5 FHBDRN Cc1cccc(OCCN(C)C(=O)CSc2ccc([N+](=O)[O-])cc2)c1 ZINC000016148167 942168499 /nfs/dbraw/zinc/16/84/99/942168499.db2.gz PHSVIOZVOOWNFJ-UHFFFAOYSA-N 0 0 360.435 3.533 20 5 FHBDRN CC1(C)Oc2ccsc2[C@@H](Nc2nc3ccccc3cc2[N+](=O)[O-])[C@@H]1O ZINC000413427372 942169680 /nfs/dbraw/zinc/16/96/80/942169680.db2.gz ZGVHKBUUBIVMLM-ZBFHGGJFSA-N 0 0 371.418 3.890 20 5 FHBDRN Cc1ccc2c(c1)[C@@H](NC(=O)N(C)Cc1ccccc1[N+](=O)[O-])[C@H](C)C2 ZINC000181895963 942173329 /nfs/dbraw/zinc/17/33/29/942173329.db2.gz MMCWJYNDAVGAFQ-KUHUBIRLSA-N 0 0 353.422 3.978 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)[C@@H](C)Oc1ccccc1F ZINC000502016352 942173299 /nfs/dbraw/zinc/17/32/99/942173299.db2.gz ZBTPEHZSFBFTKY-CQSZACIVSA-N 0 0 360.385 3.938 20 5 FHBDRN CC(C)(C)[C@H]1CCCN(C(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)C1 ZINC000280394527 942174212 /nfs/dbraw/zinc/17/42/12/942174212.db2.gz DVQWPEBPTNEAMQ-LBPRGKRZSA-N 0 0 357.410 3.747 20 5 FHBDRN O=C(Cc1cc(Br)ccc1F)Nc1ccc([N+](=O)[O-])cc1F ZINC000434096837 942183751 /nfs/dbraw/zinc/18/37/51/942183751.db2.gz AKSURONAYKBVBC-UHFFFAOYSA-N 0 0 371.137 3.817 20 5 FHBDRN Cc1c(NCc2nnc(C(C)C)o2)cc(Br)cc1[N+](=O)[O-] ZINC000280432325 942184281 /nfs/dbraw/zinc/18/42/81/942184281.db2.gz SFZRQKIDNAWETF-UHFFFAOYSA-N 0 0 355.192 3.784 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@H](CC(F)F)c1ccccc1 ZINC000420739128 942187288 /nfs/dbraw/zinc/18/72/88/942187288.db2.gz OQXYBEIXYLAXDQ-CQSZACIVSA-N 0 0 370.377 3.578 20 5 FHBDRN CN(C(=O)Cc1ccccc1[N+](=O)[O-])[C@@H](c1ccccc1)C(F)(F)F ZINC000103050797 942193620 /nfs/dbraw/zinc/19/36/20/942193620.db2.gz RAUADMRZFRVHCA-INIZCTEOSA-N 0 0 352.312 3.899 20 5 FHBDRN O=C(Cc1cc(F)ccc1Br)Nc1ccc([N+](=O)[O-])cc1F ZINC000434099086 942201056 /nfs/dbraw/zinc/20/10/56/942201056.db2.gz WHYXXVFOBAYHMU-UHFFFAOYSA-N 0 0 371.137 3.817 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)Nc2cnn(C(C)(C)C)c2)cc1SC ZINC000103075948 942204417 /nfs/dbraw/zinc/20/44/17/942204417.db2.gz HRJKGKNEFIEMLF-UHFFFAOYSA-N 0 0 364.427 3.529 20 5 FHBDRN Cc1cccc2nc(CNC(=O)c3ccc(C(C)C)c([N+](=O)[O-])c3)cn21 ZINC000473542635 942205748 /nfs/dbraw/zinc/20/57/48/942205748.db2.gz LXNVTVOVZWURFU-UHFFFAOYSA-N 0 0 352.394 3.604 20 5 FHBDRN CCn1c(-c2ccc([N+](=O)[O-])cc2)nnc1N(C)Cc1ccc(F)cc1 ZINC000549393545 942205913 /nfs/dbraw/zinc/20/59/13/942205913.db2.gz XZDYNJCUJGXDCQ-UHFFFAOYSA-N 0 0 355.373 3.649 20 5 FHBDRN O=C(NC[C@@H]1CCC(F)(F)C1)c1cccc([N+](=O)[O-])c1Br ZINC000280577736 942206213 /nfs/dbraw/zinc/20/62/13/942206213.db2.gz KYQYYSWDZLYMNP-MRVPVSSYSA-N 0 0 363.158 3.523 20 5 FHBDRN CCNc1ccc(C(=O)Nc2ccc(OC)c(OCC)c2)cc1[N+](=O)[O-] ZINC000502079231 942207357 /nfs/dbraw/zinc/20/73/57/942207357.db2.gz PMZAKQPVEBJRMW-UHFFFAOYSA-N 0 0 359.382 3.686 20 5 FHBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)N1CCC[C@@H](CC(F)(F)F)C1 ZINC000420821422 942213294 /nfs/dbraw/zinc/21/32/94/942213294.db2.gz RGXIRZPCLICVTD-ZDUSSCGKSA-N 0 0 359.348 3.511 20 5 FHBDRN CN1CC[C@@H](CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])c2ccccc21 ZINC000110239745 942215206 /nfs/dbraw/zinc/21/52/06/942215206.db2.gz XVWSNJIIZRIUPI-LBPRGKRZSA-N 0 0 359.813 3.602 20 5 FHBDRN C[C@@H](NC(=O)c1c(Cl)cccc1[N+](=O)[O-])c1nc2ccccc2n1C ZINC000137156040 942217133 /nfs/dbraw/zinc/21/71/33/942217133.db2.gz CBBQKDSANTWSLA-SNVBAGLBSA-N 0 0 358.785 3.626 20 5 FHBDRN Cc1c(CNC(=O)N2CCC[C@@H](CC(F)(F)F)C2)cccc1[N+](=O)[O-] ZINC000420834999 942218732 /nfs/dbraw/zinc/21/87/32/942218732.db2.gz ICHOHQDVGZUEMK-LBPRGKRZSA-N 0 0 359.348 3.777 20 5 FHBDRN C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)c1ccon1 ZINC000502098523 942219730 /nfs/dbraw/zinc/21/97/30/942219730.db2.gz PATBUZGCZQUSIC-GFCCVEGCSA-N 0 0 353.334 3.866 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N1CC[C@H](c2ccccc2F)C1 ZINC000502115339 942223263 /nfs/dbraw/zinc/22/32/63/942223263.db2.gz GPRNYIMGDLKXKU-ZDUSSCGKSA-N 0 0 358.369 3.762 20 5 FHBDRN C[C@@H](Nc1c2cc(Br)ccc2ncc1[N+](=O)[O-])c1ccccn1 ZINC000502099311 942225521 /nfs/dbraw/zinc/22/55/21/942225521.db2.gz QJOSVPAMNPIQMZ-SNVBAGLBSA-N 0 0 373.210 3.896 20 5 FHBDRN C[C@H](Nc1c2cc(Br)ccc2ncc1[N+](=O)[O-])c1ccccn1 ZINC000502099310 942225681 /nfs/dbraw/zinc/22/56/81/942225681.db2.gz QJOSVPAMNPIQMZ-JTQLQIEISA-N 0 0 373.210 3.896 20 5 FHBDRN CN([C@@H](c1ccccc1)C(F)(F)F)S(=O)(=O)c1ccccc1[N+](=O)[O-] ZINC000103163070 942228832 /nfs/dbraw/zinc/22/88/32/942228832.db2.gz ADSOQBWWBQPSEF-AWEZNQCLSA-N 0 0 374.340 3.519 20 5 FHBDRN Cc1cc(N2CCCc3c(cnn3C)C2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000413474926 942232080 /nfs/dbraw/zinc/23/20/80/942232080.db2.gz BYXOAZPULUIQBK-UHFFFAOYSA-N 0 0 354.332 3.608 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N1CCC[C@@H]1Cc1cccc(F)c1 ZINC000122791682 942232499 /nfs/dbraw/zinc/23/24/99/942232499.db2.gz IKQWIMGJDQSRQX-OAHLLOKOSA-N 0 0 373.384 3.982 20 5 FHBDRN COc1cc(C(=O)N2CC[C@@H](Cc3ccc(F)cc3)C2)cc([N+](=O)[O-])c1C ZINC000187835969 942233013 /nfs/dbraw/zinc/23/30/13/942233013.db2.gz LLLRLFXYWOBFSH-HNNXBMFYSA-N 0 0 372.396 3.756 20 5 FHBDRN O=C(NC[C@H]1CCC(F)(F)C1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000280704561 942236306 /nfs/dbraw/zinc/23/63/06/942236306.db2.gz LSBLERQHCIUYDN-QMMMGPOBSA-N 0 0 363.158 3.523 20 5 FHBDRN O=[N+]([O-])c1cc(COc2c(Br)cccc2[N+](=O)[O-])cs1 ZINC000122811463 942236915 /nfs/dbraw/zinc/23/69/15/942236915.db2.gz MODMFCCSOFSZTH-UHFFFAOYSA-N 0 0 359.157 3.906 20 5 FHBDRN COCC[C@H](C)CNc1cc(C(F)(F)C(F)(F)F)ncc1[N+](=O)[O-] ZINC000413489818 942240850 /nfs/dbraw/zinc/24/08/50/942240850.db2.gz HQWFPHBCBYDFAM-QMMMGPOBSA-N 0 0 357.279 3.728 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H]1CCSc2ccccc21 ZINC000122799980 942241048 /nfs/dbraw/zinc/24/10/48/942241048.db2.gz MNRMWJHDFXVNAD-CYBMUJFWSA-N 0 0 359.407 3.962 20 5 FHBDRN C[C@@H](CCc1ccccc1)NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513731039 942241083 /nfs/dbraw/zinc/24/10/83/942241083.db2.gz QQMNGWFTYSMOHQ-LBPRGKRZSA-N 0 0 364.348 3.947 20 5 FHBDRN COc1ccc(NC(=O)COc2cccc(Cl)c2C)c([N+](=O)[O-])c1 ZINC000128393508 942241482 /nfs/dbraw/zinc/24/14/82/942241482.db2.gz KZJGXHBQJUJTMB-UHFFFAOYSA-N 0 0 350.758 3.583 20 5 FHBDRN COc1ccccc1-c1nnc(SCc2c(F)cccc2[N+](=O)[O-])n1C ZINC000103349592 942246324 /nfs/dbraw/zinc/24/63/24/942246324.db2.gz HUIUOSQVMPRZAG-UHFFFAOYSA-N 0 0 374.397 3.830 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)OCC(=O)c2c[nH]c3ccccc32)c1 ZINC000016196344 942247646 /nfs/dbraw/zinc/24/76/46/942247646.db2.gz UFGLOOSKFZVHSB-UHFFFAOYSA-N 0 0 370.386 3.838 20 5 FHBDRN C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1ccc(Br)o1 ZINC000103377437 942248500 /nfs/dbraw/zinc/24/85/00/942248500.db2.gz PKRVTYRKWRYRSX-QMMMGPOBSA-N 0 0 351.156 3.542 20 5 FHBDRN Cc1c(Br)cc(C(=O)N2CC[C@@H](C3CC3)C2)cc1[N+](=O)[O-] ZINC000480986690 942251706 /nfs/dbraw/zinc/25/17/06/942251706.db2.gz UFYBUGIKRFENRF-LLVKDONJSA-N 0 0 353.216 3.538 20 5 FHBDRN CCCC1CCC(N(C(=O)Cn2cc([N+](=O)[O-])nc2C)C(C)C)CC1 ZINC000103413092 942255703 /nfs/dbraw/zinc/25/57/03/942255703.db2.gz RUKNNEJFETWWQC-UHFFFAOYSA-N 0 0 350.463 3.696 20 5 FHBDRN Cc1cc(C)c(CCNC(=O)CCOc2ccccc2[N+](=O)[O-])c(C)c1 ZINC000502170713 942261499 /nfs/dbraw/zinc/26/14/99/942261499.db2.gz SGDQVYCRXDZPQU-UHFFFAOYSA-N 0 0 356.422 3.648 20 5 FHBDRN CCN(C(=O)c1cc(OC)c(OC(F)F)cc1[N+](=O)[O-])C1CC(C)(C)C1 ZINC000416015283 942261751 /nfs/dbraw/zinc/26/17/51/942261751.db2.gz PQQQJZQIFOOSTM-UHFFFAOYSA-N 0 0 372.368 3.856 20 5 FHBDRN COc1cc(CN2CCC[C@@H](CC(F)(F)F)C2)c([N+](=O)[O-])cc1F ZINC000420940514 942265628 /nfs/dbraw/zinc/26/56/28/942265628.db2.gz DJYGKVXLFGQHPF-JTQLQIEISA-N 0 0 350.312 3.907 20 5 FHBDRN CCCN(CC(=O)Nc1ccccc1C)Cc1c(F)cccc1[N+](=O)[O-] ZINC000103464958 942273387 /nfs/dbraw/zinc/27/33/87/942273387.db2.gz NYYNYZOWDXDSAF-UHFFFAOYSA-N 0 0 359.401 3.893 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N2CCC3(CCCC3)CC2)c1C ZINC000481012227 942274607 /nfs/dbraw/zinc/27/46/07/942274607.db2.gz UCBGKWSXRKBTER-UHFFFAOYSA-N 0 0 352.456 3.557 20 5 FHBDRN COc1cc2c(c(OC)c1)N(C(=O)c1cc(C)cc([N+](=O)[O-])c1)CCC2 ZINC000416041490 942286274 /nfs/dbraw/zinc/28/62/74/942286274.db2.gz IZRAZQHDFYRANY-UHFFFAOYSA-N 0 0 356.378 3.513 20 5 FHBDRN O=C(OCc1cc(F)cc2c1OCOC2)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000016218480 942287093 /nfs/dbraw/zinc/28/70/93/942287093.db2.gz LXNAYQRTNNKCBI-UHFFFAOYSA-N 0 0 367.716 3.611 20 5 FHBDRN Cc1c2ccccc2sc1C(=O)COC(=O)c1ccc(N)c([N+](=O)[O-])c1 ZINC000016218808 942287992 /nfs/dbraw/zinc/28/79/92/942287992.db2.gz GGWONNWFUZGWFS-UHFFFAOYSA-N 0 0 370.386 3.740 20 5 FHBDRN Cn1ccnc1[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)c1ccc(Cl)cc1 ZINC000015640346 942288132 /nfs/dbraw/zinc/28/81/32/942288132.db2.gz KWRXXXQOHDWQJH-INIZCTEOSA-N 0 0 370.796 3.501 20 5 FHBDRN Cc1ccc(Cc2noc(-c3ccn(-c4ccccc4[N+](=O)[O-])n3)n2)s1 ZINC000584556202 942290790 /nfs/dbraw/zinc/29/07/90/942290790.db2.gz SELLAKCRSRJCEL-UHFFFAOYSA-N 0 0 367.390 3.791 20 5 FHBDRN Cc1c(Cl)cccc1NC(=O)[C@H](C)OC(=O)c1cccc([N+](=O)[O-])c1 ZINC000015644381 942291852 /nfs/dbraw/zinc/29/18/52/942291852.db2.gz GZTSSODJHNZISU-NSHDSACASA-N 0 0 362.769 3.741 20 5 FHBDRN C[C@H](OC(=O)c1cc([N+](=O)[O-])ccc1Cl)C(=O)Nc1cccc(F)c1 ZINC000015650770 942292237 /nfs/dbraw/zinc/29/22/37/942292237.db2.gz WWTAMJDKLCBOLR-VIFPVBQESA-N 0 0 366.732 3.571 20 5 FHBDRN Cc1cc(S(=O)(=O)N2CCC[C@H](C(C)(C)C)C2)c(C)cc1[N+](=O)[O-] ZINC001211651468 942293606 /nfs/dbraw/zinc/29/36/06/942293606.db2.gz VPNRYXFTOLBALN-AWEZNQCLSA-N 0 0 354.472 3.658 20 5 FHBDRN C[C@H](SCc1ccc(C(N)=O)cc1[N+](=O)[O-])c1nc2ccccc2o1 ZINC000183472033 942295026 /nfs/dbraw/zinc/29/50/26/942295026.db2.gz OPUWVTRPWKVCIP-JTQLQIEISA-N 0 0 357.391 3.829 20 5 FHBDRN COCc1ccc(CNC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc1 ZINC000103602989 942297108 /nfs/dbraw/zinc/29/71/08/942297108.db2.gz RMNHUQFQNCANCI-UHFFFAOYSA-N 0 0 371.437 3.861 20 5 FHBDRN CN(C(=O)C[NH2+]C(C)(C)c1ccc(Cl)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000103482087 942299515 /nfs/dbraw/zinc/29/95/15/942299515.db2.gz DBKDYDZATQLPIY-UHFFFAOYSA-N 0 0 361.829 3.736 20 5 FHBDRN O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1C[C@H](O)C[C@H]1c1ccccc1 ZINC000413512906 942300064 /nfs/dbraw/zinc/30/00/64/942300064.db2.gz YABCGRCTSXWABE-HIFRSBDPSA-N 0 0 352.312 3.926 20 5 FHBDRN CC(C)[C@H](C)NC(=O)C1CCN(c2nccc3ccc([N+](=O)[O-])cc32)CC1 ZINC000413101336 942302257 /nfs/dbraw/zinc/30/22/57/942302257.db2.gz INHJZKBPPDNWKM-AWEZNQCLSA-N 0 0 370.453 3.520 20 5 FHBDRN O=[N+]([O-])c1cnc(NCCCCNc2ccccn2)c(C(F)(F)F)c1 ZINC000413118668 942302986 /nfs/dbraw/zinc/30/29/86/942302986.db2.gz URPSGFBNLJBMGW-UHFFFAOYSA-N 0 0 355.320 3.708 20 5 FHBDRN CSc1cccc(C(=O)NCCc2c[nH]c3ccccc23)c1[N+](=O)[O-] ZINC000188014389 942305310 /nfs/dbraw/zinc/30/53/10/942305310.db2.gz MWUUYXZBTWBVGG-UHFFFAOYSA-N 0 0 355.419 3.771 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)Nc1ccc(Br)c(F)c1 ZINC000304017561 942305348 /nfs/dbraw/zinc/30/53/48/942305348.db2.gz LPFLIOZMXSMSQY-UHFFFAOYSA-N 0 0 369.146 3.514 20 5 FHBDRN CCOc1cc(F)ccc1N[C@H](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000502248216 942305491 /nfs/dbraw/zinc/30/54/91/942305491.db2.gz KUNNUXBSDPWAOG-GFCCVEGCSA-N 0 0 361.373 3.962 20 5 FHBDRN CC(C)OCCCN(C)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000501103753 942309257 /nfs/dbraw/zinc/30/92/57/942309257.db2.gz CYGHZQPMCLNTTD-UHFFFAOYSA-N 0 0 374.235 3.636 20 5 FHBDRN Cc1nc([C@H](NCc2ccc([N+](=O)[O-])cc2C)c2ccccc2F)no1 ZINC000183480515 942309520 /nfs/dbraw/zinc/30/95/20/942309520.db2.gz RJOYGRJJWIPMRE-QGZVFWFLSA-N 0 0 356.357 3.613 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CC[C@H](Nc3ccccc3)C2)c(C(F)(F)F)c1 ZINC000413115480 942311041 /nfs/dbraw/zinc/31/10/41/942311041.db2.gz NRHBEXNJPRKSGH-LBPRGKRZSA-N 0 0 352.316 3.699 20 5 FHBDRN CSc1cccc(C(=O)N2CCc3[nH]c4ccccc4c3C2)c1[N+](=O)[O-] ZINC000188027642 942313583 /nfs/dbraw/zinc/31/35/83/942313583.db2.gz AVQMHACANSKHHQ-UHFFFAOYSA-N 0 0 367.430 3.997 20 5 FHBDRN CSc1cccc(C(=O)NCc2nccc3ccccc32)c1[N+](=O)[O-] ZINC000188029830 942313931 /nfs/dbraw/zinc/31/39/31/942313931.db2.gz RNQHMLLLKIZMAP-UHFFFAOYSA-N 0 0 353.403 3.795 20 5 FHBDRN O=C(NCCC1=CCCCCC1)c1ccc(Cn2cc([N+](=O)[O-])cn2)cc1 ZINC001268814658 942314111 /nfs/dbraw/zinc/31/41/11/942314111.db2.gz DQTTZWMNRYDINI-UHFFFAOYSA-N 0 0 368.437 3.850 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)N2CCCC[C@@H]2c2cn[nH]c2)cc1[N+](=O)[O-] ZINC000183214024 942314199 /nfs/dbraw/zinc/31/41/99/942314199.db2.gz WDIOJXYGPVLAJL-XJKSGUPXSA-N 0 0 357.414 3.624 20 5 FHBDRN Cc1nc(CCNC(=O)Nc2ccc(C(C)(C)C)c([N+](=O)[O-])c2)c(C)o1 ZINC000501131045 942315119 /nfs/dbraw/zinc/31/51/19/942315119.db2.gz XFIKVAJKQOYQGB-UHFFFAOYSA-N 0 0 360.414 3.861 20 5 FHBDRN CC[C@H](CC(=O)NCCc1ccccc1[N+](=O)[O-])c1ccc(OC)cc1 ZINC000501135956 942323782 /nfs/dbraw/zinc/32/37/82/942323782.db2.gz AIQVZAGKXQCIRI-OAHLLOKOSA-N 0 0 356.422 3.846 20 5 FHBDRN CO[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2SC(C)C)CC[C@H]1C ZINC000188071591 942325855 /nfs/dbraw/zinc/32/58/55/942325855.db2.gz JEFDQQUHALUTGF-DOMZBBRYSA-N 0 0 352.456 3.592 20 5 FHBDRN CC[C@H]1CC[C@@H](C)N1CC(=O)Nc1ccc([N+](=O)[O-])cc1Br ZINC000330636942 942326890 /nfs/dbraw/zinc/32/68/90/942326890.db2.gz AUCIJIADIOJFCM-MNOVXSKESA-N 0 0 370.247 3.559 20 5 FHBDRN Cc1cc(C(=O)O[C@@H](C)C(=O)Nc2c(C)cccc2C)ccc1[N+](=O)[O-] ZINC000015699070 942331677 /nfs/dbraw/zinc/33/16/77/942331677.db2.gz XGPAYHMYCYPERZ-AWEZNQCLSA-N 0 0 356.378 3.704 20 5 FHBDRN CC[C@H]1C[C@@H](NC(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CCO1 ZINC000421085767 942338086 /nfs/dbraw/zinc/33/80/86/942338086.db2.gz IPRFBRJXDMSLNT-QWRGUYRKSA-N 0 0 361.320 3.693 20 5 FHBDRN Cc1cccc(N2CCC(Nc3nccc4ccc([N+](=O)[O-])cc43)CC2)n1 ZINC000413139661 942338335 /nfs/dbraw/zinc/33/83/35/942338335.db2.gz FDXIDPSWDCEHJJ-UHFFFAOYSA-N 0 0 363.421 3.927 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@](F)(c2ccccc2C)C1 ZINC000501171141 942339061 /nfs/dbraw/zinc/33/90/61/942339061.db2.gz DVSIQEAUTZRQLE-IBGZPJMESA-N 0 0 358.369 3.623 20 5 FHBDRN CC(C)(C)C(=O)NC[C@@H]1CCCN(c2ccc([N+](=O)[O-])c3ncccc23)C1 ZINC000413132398 942342310 /nfs/dbraw/zinc/34/23/10/942342310.db2.gz GJFWWMMOJRXZIM-AWEZNQCLSA-N 0 0 370.453 3.522 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)NCC2CCC(F)(F)CC2)cc1OC ZINC000501185854 942343234 /nfs/dbraw/zinc/34/32/34/942343234.db2.gz AAUAZPDRENWEMJ-UHFFFAOYSA-N 0 0 372.368 3.557 20 5 FHBDRN C[C@@H](COc1ccc(F)cc1F)NC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000110246120 942343330 /nfs/dbraw/zinc/34/33/30/942343330.db2.gz OOQABWKEYPMKSQ-VIFPVBQESA-N 0 0 370.739 3.724 20 5 FHBDRN CCNc1ccc(C(=O)N2CCCC[C@@H](SCC)C2)cc1[N+](=O)[O-] ZINC000481109800 942343462 /nfs/dbraw/zinc/34/34/62/942343462.db2.gz OKBSSCRRYZKMSW-CQSZACIVSA-N 0 0 351.472 3.774 20 5 FHBDRN COCc1ccccc1NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513709353 942343674 /nfs/dbraw/zinc/34/36/74/942343674.db2.gz GEASFCBWWXWYGD-UHFFFAOYSA-N 0 0 352.293 3.595 20 5 FHBDRN C[C@H](C(=O)N1CCSC[C@@H]1C1CCC1)c1ccc([N+](=O)[O-])cc1F ZINC000416101235 942345913 /nfs/dbraw/zinc/34/59/13/942345913.db2.gz BAOCIWYDIPJWDX-MEDUHNTESA-N 0 0 352.431 3.582 20 5 FHBDRN CC(C)c1ccc(C(=O)Nc2ccc(OC3COC3)cc2)cc1[N+](=O)[O-] ZINC000188140547 942346712 /nfs/dbraw/zinc/34/67/12/942346712.db2.gz UABKDUSOYZDXAQ-UHFFFAOYSA-N 0 0 356.378 3.748 20 5 FHBDRN Cn1cnc([N+](=O)[O-])c1N[C@H](c1ccccc1)c1ccc2c(c1)CCCO2 ZINC000501198855 942347186 /nfs/dbraw/zinc/34/71/86/942347186.db2.gz PNKGFENYWMMGSH-GOSISDBHSA-N 0 0 364.405 3.855 20 5 FHBDRN CC(C)n1cnnc1[C@@H]1CCCN(c2ccc([N+](=O)[O-])c3ncccc23)C1 ZINC000413146624 942349179 /nfs/dbraw/zinc/34/91/79/942349179.db2.gz NIHSXRNIADWCQD-CQSZACIVSA-N 0 0 366.425 3.699 20 5 FHBDRN COc1ccc(CNC(=O)Nc2ccc([N+](=O)[O-])cc2OC)cc1Cl ZINC000122879843 942350208 /nfs/dbraw/zinc/35/02/08/942350208.db2.gz IWKZBCWXTDESTN-UHFFFAOYSA-N 0 0 365.773 3.587 20 5 FHBDRN CSc1cccc(C(=O)N2CCSC[C@H]2C2CCC2)c1[N+](=O)[O-] ZINC000416105863 942352426 /nfs/dbraw/zinc/35/24/26/942352426.db2.gz GCHPQVVFBWSIGA-ZDUSSCGKSA-N 0 0 352.481 3.674 20 5 FHBDRN Cc1c(CC(=O)N2CCC[C@H]2COc2ccccc2)cccc1[N+](=O)[O-] ZINC000122881820 942354147 /nfs/dbraw/zinc/35/41/47/942354147.db2.gz IMDIEDCTTVYFPG-KRWDZBQOSA-N 0 0 354.406 3.516 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H]1CC12CCSCC2 ZINC000421117947 942355329 /nfs/dbraw/zinc/35/53/29/942355329.db2.gz JKUOQDWNVQLPKP-GFCCVEGCSA-N 0 0 365.455 3.648 20 5 FHBDRN O=C(c1ccc(NC2CC2)c([N+](=O)[O-])c1)N1CCSC[C@H]1C1CCC1 ZINC000416115742 942359976 /nfs/dbraw/zinc/35/99/76/942359976.db2.gz QUAPMBUWKVYPPI-KRWDZBQOSA-N 0 0 361.467 3.527 20 5 FHBDRN C[C@H]1CCCC[C@H]1CNC(=O)c1cccc([N+](=O)[O-])c1Br ZINC000159093160 942362079 /nfs/dbraw/zinc/36/20/79/942362079.db2.gz LDVXWZHHKSBYCN-QWRGUYRKSA-N 0 0 355.232 3.913 20 5 FHBDRN NC(=O)c1ccnc(N[C@@H](c2ccc(Cl)cc2)C2CCC2)c1[N+](=O)[O-] ZINC000290686846 942363762 /nfs/dbraw/zinc/36/37/62/942363762.db2.gz TUUALGCHWNBHOA-CQSZACIVSA-N 0 0 360.801 3.695 20 5 FHBDRN CC(C)OCc1nc([C@@H](C)Nc2ccc([N+](=O)[O-])c3cnccc23)no1 ZINC000290686535 942364148 /nfs/dbraw/zinc/36/41/48/942364148.db2.gz JEYUDZNUVRWXHR-LLVKDONJSA-N 0 0 357.370 3.624 20 5 FHBDRN CC(C)CCN(CCC(C)C)S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000502334016 942365350 /nfs/dbraw/zinc/36/53/50/942365350.db2.gz ROFBPBUHMSSLLO-UHFFFAOYSA-N 0 0 356.488 3.819 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])Nc1ccc2c(c1)C(=O)CCCC2 ZINC000421138472 942369471 /nfs/dbraw/zinc/36/94/71/942369471.db2.gz IDEXPCZCFXXCEY-UHFFFAOYSA-N 0 0 353.378 3.826 20 5 FHBDRN Cc1nc2cc(CNC(=O)c3cc(F)cc([N+](=O)[O-])c3)ccc2n1C1CC1 ZINC000412330666 942370431 /nfs/dbraw/zinc/37/04/31/942370431.db2.gz MHENQKLFKMSXTH-UHFFFAOYSA-N 0 0 368.368 3.657 20 5 FHBDRN COCc1ccccc1C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000501283052 942372104 /nfs/dbraw/zinc/37/21/04/942372104.db2.gz IKNFRCUPUVAHJQ-UHFFFAOYSA-N 0 0 365.183 3.756 20 5 FHBDRN Cc1cccc(OCCCNC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)c1 ZINC000016278067 942373361 /nfs/dbraw/zinc/37/33/61/942373361.db2.gz XPXNNWXKSLXNLD-UHFFFAOYSA-N 0 0 369.421 3.676 20 5 FHBDRN CC(C)(C(=O)N1Cc2ccccc2C2(CC2)C1)c1ccccc1[N+](=O)[O-] ZINC000501270002 942374752 /nfs/dbraw/zinc/37/47/52/942374752.db2.gz HGDYPVMTYNIKCY-UHFFFAOYSA-N 0 0 350.418 3.946 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(C)[C@@H]1CCC[C@H]1C(C)(C)C ZINC000419799482 942385456 /nfs/dbraw/zinc/38/54/56/942385456.db2.gz XGGIYJPEVOUDID-GDBMZVCRSA-N 0 0 361.442 3.515 20 5 FHBDRN Cc1ccc(N2CCC(Nc3ccc([N+](=O)[O-])c4ncccc34)CC2)nc1 ZINC000413170292 942393336 /nfs/dbraw/zinc/39/33/36/942393336.db2.gz ZBNQKSXDERAQFU-UHFFFAOYSA-N 0 0 363.421 3.927 20 5 FHBDRN C[C@H](NC(=O)COc1cccnc1[N+](=O)[O-])c1ccc(Cl)c(Cl)c1 ZINC000005970715 942399047 /nfs/dbraw/zinc/39/90/47/942399047.db2.gz QGBKAQPETDSFRU-VIFPVBQESA-N 0 0 370.192 3.553 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2C[C@@H](C)C[C@H]2c2cccnc2)c1 ZINC000366812460 942400620 /nfs/dbraw/zinc/40/06/20/942400620.db2.gz XGSFUQASHFPZKW-YJBOKZPZSA-N 0 0 369.421 3.677 20 5 FHBDRN COc1ccc(N(C)C(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)cc1F ZINC000413607990 942408262 /nfs/dbraw/zinc/40/82/62/942408262.db2.gz AKTHQNKXHCHFSB-UHFFFAOYSA-N 0 0 362.357 3.806 20 5 FHBDRN Cc1cc(NC(=O)CCc2ccc(F)cc2F)c2cc([N+](=O)[O-])ccc2n1 ZINC001268853920 942415116 /nfs/dbraw/zinc/41/51/16/942415116.db2.gz OIEAHUINOMVBIA-UHFFFAOYSA-N 0 0 371.343 3.723 20 5 FHBDRN Cc1cc([C@H]2CCCN2C(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)no1 ZINC000378220067 942425328 /nfs/dbraw/zinc/42/53/28/942425328.db2.gz DGSJFKOTWWKGQE-CQSZACIVSA-N 0 0 369.299 3.887 20 5 FHBDRN CC(=O)c1ccc(NCc2noc(-c3cccc(F)c3)n2)c([N+](=O)[O-])c1 ZINC000366832203 942427531 /nfs/dbraw/zinc/42/75/31/942427531.db2.gz IMKJEYRCPRBURY-UHFFFAOYSA-N 0 0 356.313 3.599 20 5 FHBDRN CCc1ccc(C(=O)N[C@H]2C[C@H](c3ccc(OC)c(F)c3)C2)cc1[N+](=O)[O-] ZINC000501356132 942429467 /nfs/dbraw/zinc/42/94/67/942429467.db2.gz HNIVHXVDUSRRQH-WKILWMFISA-N 0 0 372.396 3.981 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N(Cc1ccc(O)cc1)CC1CC1 ZINC000413621901 942431520 /nfs/dbraw/zinc/43/15/20/942431520.db2.gz GVNBRDPDQBBLAL-VQTJNVASSA-N 0 0 366.417 3.843 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCC(Oc3ccccn3)CC2)c2cccnc21 ZINC000413182396 942436599 /nfs/dbraw/zinc/43/65/99/942436599.db2.gz GKUORACHMAGIDX-UHFFFAOYSA-N 0 0 350.378 3.586 20 5 FHBDRN CCOc1cccc(CNc2ncc([N+](=O)[O-])cc2F)c1OC(F)F ZINC000413188524 942439336 /nfs/dbraw/zinc/43/93/36/942439336.db2.gz UXZLVIMYYJYDJV-UHFFFAOYSA-N 0 0 357.288 3.741 20 5 FHBDRN Cc1cc(Cc2noc(C3(Oc4ccccc4)CC3)n2)ccc1[N+](=O)[O-] ZINC000421254972 942445478 /nfs/dbraw/zinc/44/54/78/942445478.db2.gz XAEOBSMXLAPKKF-UHFFFAOYSA-N 0 0 351.362 3.945 20 5 FHBDRN CC(C)C(=O)Nc1ccc(NC(=O)NCc2ccccc2[N+](=O)[O-])cc1 ZINC000047776678 942446205 /nfs/dbraw/zinc/44/62/05/942446205.db2.gz CCNKXYGFOPBSIX-UHFFFAOYSA-N 0 0 356.382 3.511 20 5 FHBDRN CC(C)C[C@@H](C)Oc1cc(CNC(=O)c2cccc([N+](=O)[O-])c2)ccn1 ZINC000518438847 942452702 /nfs/dbraw/zinc/45/27/02/942452702.db2.gz YGLNKTSBSDVOAT-CQSZACIVSA-N 0 0 357.410 3.733 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1)N(S(=O)(=O)/C=C/c1ccc(Cl)cc1)CC2 ZINC000014099089 942453120 /nfs/dbraw/zinc/45/31/20/942453120.db2.gz SBVXJIZPARQVCZ-CSKARUKUSA-N 0 0 364.810 3.611 20 5 FHBDRN COc1ccc(NC(=O)CSc2ccccc2[N+](=O)[O-])cc1Cl ZINC000015840370 942454175 /nfs/dbraw/zinc/45/41/75/942454175.db2.gz ULWJXRSRFBHSJM-UHFFFAOYSA-N 0 0 352.799 3.988 20 5 FHBDRN COCCOc1cccc(-c2noc(-c3cc([N+](=O)[O-])c(C)cc3C)n2)c1 ZINC000421248695 942455170 /nfs/dbraw/zinc/45/51/70/942455170.db2.gz RVGMNVLPHPMYBM-UHFFFAOYSA-N 0 0 369.377 3.954 20 5 FHBDRN COc1ccccc1-c1cnc(COc2ccc([N+](=O)[O-])c(OC)c2)o1 ZINC000366856361 942459107 /nfs/dbraw/zinc/45/91/07/942459107.db2.gz HVTSIIVCXUTNMP-UHFFFAOYSA-N 0 0 356.334 3.846 20 5 FHBDRN C[C@@H](Nc1ncc([N+](=O)[O-])cc1C(F)(F)F)[C@H]1COc2ccccc21 ZINC000413199309 942461711 /nfs/dbraw/zinc/46/17/11/942461711.db2.gz ISTLQXLPYKUEGJ-BXKDBHETSA-N 0 0 353.300 3.985 20 5 FHBDRN C[C@H](c1ccccc1)N1CC(=O)N([C@@H](C)c2ccc([N+](=O)[O-])cc2)C1=O ZINC000419966775 942470317 /nfs/dbraw/zinc/47/03/17/942470317.db2.gz MBWCCSUBKURTCQ-KGLIPLIRSA-N 0 0 353.378 3.681 20 5 FHBDRN CN1CC[C@H](Nc2ncc([N+](=O)[O-])cc2F)[C@H]1c1ccc(Cl)cc1 ZINC000413200739 942473207 /nfs/dbraw/zinc/47/32/07/942473207.db2.gz FICWALRATIJNFV-LSDHHAIUSA-N 0 0 350.781 3.640 20 5 FHBDRN O=C(Cc1coc(-c2ccc(Cl)cc2)n1)NCc1ccccc1[N+](=O)[O-] ZINC000104274460 942473903 /nfs/dbraw/zinc/47/39/03/942473903.db2.gz VIQMBDLXDIVTKK-UHFFFAOYSA-N 0 0 371.780 3.762 20 5 FHBDRN CCc1cccc(OC)c1COC(=O)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC001269113639 942474115 /nfs/dbraw/zinc/47/41/15/942474115.db2.gz GDCQSPKABUURQN-UHFFFAOYSA-N 0 0 351.305 3.801 20 5 FHBDRN CC[C@H](Nc1ncc([N+](=O)[O-])cc1F)[C@H](c1ccc(C)cc1)n1cncn1 ZINC000413205284 942477343 /nfs/dbraw/zinc/47/73/43/942477343.db2.gz JQZXSNYVIXAQSQ-IRXDYDNUSA-N 0 0 370.388 3.509 20 5 FHBDRN O=[N+]([O-])c1ccccc1CSc1nnc2ccc(Br)cn21 ZINC000549409312 942483141 /nfs/dbraw/zinc/48/31/41/942483141.db2.gz QQSSKJCQSOJMDO-UHFFFAOYSA-N 0 0 365.212 3.692 20 5 FHBDRN COc1ccc2c(c1OC)CCN(c1ccc([N+](=O)[O-])c3ncccc13)C2 ZINC000413217708 942490848 /nfs/dbraw/zinc/49/08/48/942490848.db2.gz DEEUIEYLTYKCRT-UHFFFAOYSA-N 0 0 365.389 3.723 20 5 FHBDRN CCCNc1ccccc1NC(=O)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC000413680283 942491406 /nfs/dbraw/zinc/49/14/06/942491406.db2.gz BWLVJWVQCLUDQW-UHFFFAOYSA-N 0 0 361.373 3.746 20 5 FHBDRN COc1ccc(C(=O)N2CCC[C@@H]2/C=C\c2ccccc2)cc1[N+](=O)[O-] ZINC000505373167 942491912 /nfs/dbraw/zinc/49/19/12/942491912.db2.gz QLFZGBGSEHIOMB-FPISAVPCSA-N 0 0 352.390 3.921 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CC[C@](F)(c2ccccc2F)C1 ZINC000412331911 942491936 /nfs/dbraw/zinc/49/19/36/942491936.db2.gz OTLLSSWDSIKRCW-RZQQEMMASA-N 0 0 372.371 3.935 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)Nc1ccc2c(c1)CCCC2=O ZINC000452308946 942495090 /nfs/dbraw/zinc/49/50/90/942495090.db2.gz ZZYYVHKNYBNPGU-UHFFFAOYSA-N 0 0 367.405 3.945 20 5 FHBDRN CO[C@](C)([C@@H](C)NC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F)C1CC1 ZINC000413702444 942513251 /nfs/dbraw/zinc/51/32/51/942513251.db2.gz XPWWLEYDNVAMDC-JDNHERCYSA-N 0 0 373.356 3.521 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)Nc1cc(Cl)ccc1SC(C)C ZINC000104484540 942513556 /nfs/dbraw/zinc/51/35/56/942513556.db2.gz MDIAASSGWRTKFF-UHFFFAOYSA-N 0 0 368.846 3.892 20 5 FHBDRN COc1cc(Cl)ccc1CNC(=O)c1ccc(SC)c([N+](=O)[O-])c1 ZINC000502538374 942514974 /nfs/dbraw/zinc/51/49/74/942514974.db2.gz BUZYQSWMORPPOY-UHFFFAOYSA-N 0 0 366.826 3.909 20 5 FHBDRN COc1ccc([C@H](NC(=O)c2ccc([N+](=O)[O-])c(C)c2)C(F)(F)F)cc1 ZINC000505386760 942517476 /nfs/dbraw/zinc/51/74/76/942517476.db2.gz JJDRQDLTWWDHRN-HNNXBMFYSA-N 0 0 368.311 3.945 20 5 FHBDRN COc1ccc([C@@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2)C(F)(F)F)cc1 ZINC000505404680 942529799 /nfs/dbraw/zinc/52/97/99/942529799.db2.gz VHSNUMHNQWLJMB-CQSZACIVSA-N 0 0 372.274 3.776 20 5 FHBDRN Cc1nc2cc(NC(=O)CSc3ccccc3[N+](=O)[O-])ccc2n1C ZINC000541262118 942531676 /nfs/dbraw/zinc/53/16/76/942531676.db2.gz SMKHLHGAOBAHAV-UHFFFAOYSA-N 0 0 356.407 3.521 20 5 FHBDRN O=[N+]([O-])c1cnc(Nc2ccc(OC3COC3)cc2)c(C(F)(F)F)c1 ZINC000413241058 942532634 /nfs/dbraw/zinc/53/26/34/942532634.db2.gz GJUGNYPQUQPTPN-UHFFFAOYSA-N 0 0 355.272 3.530 20 5 FHBDRN CCCOc1ccc(CNC(=O)CSCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000513817834 942536254 /nfs/dbraw/zinc/53/62/54/942536254.db2.gz PWRNADZSQHBHOG-UHFFFAOYSA-N 0 0 374.462 3.933 20 5 FHBDRN CCOc1ccc(C(=O)N2CC=C(c3ccccc3C)C2)cc1[N+](=O)[O-] ZINC000501544961 942540449 /nfs/dbraw/zinc/54/04/49/942540449.db2.gz TVFDKZNDSSEPEO-UHFFFAOYSA-N 0 0 352.390 3.841 20 5 FHBDRN CCOc1ccc2c(c1)CCN(C(=O)c1c(Cl)cccc1[N+](=O)[O-])C2 ZINC000434245325 942545001 /nfs/dbraw/zinc/54/50/01/942545001.db2.gz WSIPUMXGYOVIBZ-UHFFFAOYSA-N 0 0 360.797 3.845 20 5 FHBDRN C[C@H](Oc1cccc(Cl)c1)C(=O)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000513832021 942547433 /nfs/dbraw/zinc/54/74/33/942547433.db2.gz BSEPLCGUXNWWBG-LBPRGKRZSA-N 0 0 360.797 3.995 20 5 FHBDRN O=C([C@@H]1Cc2cc(Cl)ccc2O1)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000513839952 942552366 /nfs/dbraw/zinc/55/23/66/942552366.db2.gz UIXCJMBKQWABGB-KRWDZBQOSA-N 0 0 358.781 3.531 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NCc1nc(C(C)(C)C)cs1 ZINC000122902523 942552518 /nfs/dbraw/zinc/55/25/18/942552518.db2.gz FFOBFYBLQOXISY-UHFFFAOYSA-N 0 0 364.427 3.679 20 5 FHBDRN CS[C@H](CNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-])C(C)(C)C ZINC000541276285 942554688 /nfs/dbraw/zinc/55/46/88/942554688.db2.gz IXBMCXDMUXUMDL-OAHLLOKOSA-N 0 0 351.472 3.677 20 5 FHBDRN COC(=O)c1c(C)sc(C)c1NC(=O)c1c(C)c(C)ccc1[N+](=O)[O-] ZINC000893196681 942556266 /nfs/dbraw/zinc/55/62/66/942556266.db2.gz DWXQHDIQEOOMEN-UHFFFAOYSA-N 0 0 362.407 3.929 20 5 FHBDRN O=[N+]([O-])c1ccccc1CN1CCN(Cc2ccc(Cl)s2)CC1 ZINC000016394576 942556634 /nfs/dbraw/zinc/55/66/34/942556634.db2.gz KJRVALIUHHKTQQ-UHFFFAOYSA-N 0 0 351.859 3.628 20 5 FHBDRN O=C(C[C@H]1CCCCCN1C(=O)c1cc(F)cc([N+](=O)[O-])c1)c1ccco1 ZINC000434264051 942560819 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CC[C@H]1C[C@]1(NC(=O)c1cc(OC)ccc1[N+](=O)[O-])c1cccc(C)c1 ZINC000501595338 942568985 /nfs/dbraw/zinc/56/89/85/942568985.db2.gz SFERKPVBPHWMMW-VBKZILBWSA-N 0 0 354.406 3.967 20 5 FHBDRN Cn1cc(-c2ccccc2CNC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)cn1 ZINC000536252363 942569155 /nfs/dbraw/zinc/56/91/55/942569155.db2.gz DNPYKFCFRQLDRL-UHFFFAOYSA-N 0 0 370.796 3.579 20 5 FHBDRN CC[C@@H](CSc1ccccc1)NC(=O)COc1cccc([N+](=O)[O-])c1 ZINC000501600593 942570108 /nfs/dbraw/zinc/57/01/08/942570108.db2.gz DPFGQWTWYYUMNS-AWEZNQCLSA-N 0 0 360.435 3.661 20 5 FHBDRN CN(C)c1ccc(COC(=O)c2ccccc2-n2cccc2)cc1[N+](=O)[O-] ZINC001268940915 942574494 /nfs/dbraw/zinc/57/44/94/942574494.db2.gz BYMGSESZVWGKFA-UHFFFAOYSA-N 0 0 365.389 3.809 20 5 FHBDRN C[C@H](CNC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)COCc1ccccc1 ZINC000501613193 942575138 /nfs/dbraw/zinc/57/51/38/942575138.db2.gz BNENAKFSVKNYJD-CQSZACIVSA-N 0 0 367.405 3.659 20 5 FHBDRN CCOc1ccc(C(=O)NC[C@@H](C)COCc2ccccc2)cc1[N+](=O)[O-] ZINC000501615789 942576807 /nfs/dbraw/zinc/57/68/07/942576807.db2.gz DZIUPMKITGIETE-OAHLLOKOSA-N 0 0 372.421 3.576 20 5 FHBDRN CN(Cc1cc(C(C)(C)C)n[nH]1)c1ncc([N+](=O)[O-])cc1C(F)(F)F ZINC000413269675 942579308 /nfs/dbraw/zinc/57/93/08/942579308.db2.gz SVYCVQCXTBXFDG-UHFFFAOYSA-N 0 0 357.336 3.666 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NC1CCN(c2ccccc2)CC1 ZINC000421461154 942582890 /nfs/dbraw/zinc/58/28/90/942582890.db2.gz RGWAJXRGNBCOJZ-UHFFFAOYSA-N 0 0 353.422 3.610 20 5 FHBDRN CCOc1ccc(NC(=O)COc2ccc([N+](=O)[O-])cc2)cc1Cl ZINC000502618663 942583953 /nfs/dbraw/zinc/58/39/53/942583953.db2.gz ODSHFEAENHMFLX-UHFFFAOYSA-N 0 0 350.758 3.664 20 5 FHBDRN O=C(c1c[nH]c2ccc([N+](=O)[O-])cc21)N1CCC[C@@H](Oc2ccccc2)C1 ZINC000416269882 942584020 /nfs/dbraw/zinc/58/40/20/942584020.db2.gz IDTGOBIZMRKFTA-MRXNPFEDSA-N 0 0 365.389 3.760 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N[C@@H](COCC(C)C)c1ccco1 ZINC000421473069 942592163 /nfs/dbraw/zinc/59/21/63/942592163.db2.gz VOOKZXAYTOBYSR-INIZCTEOSA-N 0 0 360.410 3.948 20 5 FHBDRN CC[C@@H](NC(=O)c1cc([N+](=O)[O-])c(C)cc1C)c1nc2ccccc2[nH]1 ZINC000421477669 942593594 /nfs/dbraw/zinc/59/35/94/942593594.db2.gz ZFARKMTYYGWJSW-CQSZACIVSA-N 0 0 352.394 3.969 20 5 FHBDRN C[C@@H](Sc1ncc([N+](=O)[O-])cc1C(F)(F)F)C(=O)OC(C)(C)C ZINC000413275980 942595662 /nfs/dbraw/zinc/59/56/62/942595662.db2.gz VPXXXEOXGQBVBY-SSDOTTSWSA-N 0 0 352.334 3.831 20 5 FHBDRN CC(=O)N1CC[C@H](NC(=O)Nc2cccc([N+](=O)[O-])c2C)c2ccccc21 ZINC000366964087 942598867 /nfs/dbraw/zinc/59/88/67/942598867.db2.gz XOPXJGPCLGKFGL-INIZCTEOSA-N 0 0 368.393 3.523 20 5 FHBDRN CCOC(=O)CN(C(=O)c1cc(F)cc([N+](=O)[O-])c1)[C@@H](C)c1ccccc1 ZINC000513913598 942604828 /nfs/dbraw/zinc/60/48/28/942604828.db2.gz SEXLKPCSBXUEPN-ZDUSSCGKSA-N 0 0 374.368 3.500 20 5 FHBDRN COc1ccc(CNC(=O)CCCCOc2cccc(C)c2)cc1[N+](=O)[O-] ZINC000501678509 942607028 /nfs/dbraw/zinc/60/70/28/942607028.db2.gz XBHBLHMNJNEQGP-UHFFFAOYSA-N 0 0 372.421 3.777 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NC(C)(C)c1nc2ccccc2n1C ZINC000421499236 942611554 /nfs/dbraw/zinc/61/15/54/942611554.db2.gz ARPITJSABTUOFX-UHFFFAOYSA-N 0 0 366.421 3.763 20 5 FHBDRN COC(=O)CC[C@@H](NC(=O)c1cc([N+](=O)[O-])c(C)cc1C)c1ccccc1 ZINC000421480687 942613031 /nfs/dbraw/zinc/61/30/31/942613031.db2.gz ZVGJYXUHKIKIIF-QGZVFWFLSA-N 0 0 370.405 3.636 20 5 FHBDRN CCCOc1cccc(CCNC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)c1 ZINC000434360666 942613814 /nfs/dbraw/zinc/61/38/14/942613814.db2.gz SADGWABRYKPRIF-UHFFFAOYSA-N 0 0 367.405 3.837 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N[C@@H](c1nc(C2CC2)no1)C(C)C ZINC000421480587 942613976 /nfs/dbraw/zinc/61/39/76/942613976.db2.gz ZSVYYBCLSGWMJN-OAHLLOKOSA-N 0 0 358.398 3.599 20 5 FHBDRN COCCCOc1cccc(NC(=O)c2cc([N+](=O)[O-])c(C)cc2C)c1 ZINC000421481862 942613988 /nfs/dbraw/zinc/61/39/88/942613988.db2.gz JPADDQPXHUYZOR-UHFFFAOYSA-N 0 0 358.394 3.879 20 5 FHBDRN CC1(C)CN(c2ccc([N+](=O)[O-])c3ncccc32)C[C@H](C(F)(F)F)O1 ZINC000413293609 942614306 /nfs/dbraw/zinc/61/43/06/942614306.db2.gz AQCADZKODYIIKR-CYBMUJFWSA-N 0 0 355.316 3.689 20 5 FHBDRN COc1cc(C(=O)N(C)[C@@H]2CCC[C@@H]2C(C)(C)C)cc([N+](=O)[O-])c1OC ZINC000416292910 942617340 /nfs/dbraw/zinc/61/73/40/942617340.db2.gz QEWIDYKDDOCYII-UONOGXRCSA-N 0 0 364.442 3.899 20 5 FHBDRN CCc1ccc(NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)cc1F ZINC000501695773 942618179 /nfs/dbraw/zinc/61/81/79/942618179.db2.gz YAQLGBSWJKQIFQ-UHFFFAOYSA-N 0 0 354.341 3.734 20 5 FHBDRN CO[C@@H](c1ccccc1F)[C@@H](C)NC(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC000421513409 942619268 /nfs/dbraw/zinc/61/92/68/942619268.db2.gz QADSCMCBWUOUJF-FZKQIMNGSA-N 0 0 360.385 3.857 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CC[C@H](COc2ccccc2)C1 ZINC000421518505 942623489 /nfs/dbraw/zinc/62/34/89/942623489.db2.gz VPDSSJAIKWIAEU-INIZCTEOSA-N 0 0 354.406 3.753 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CCCCC[C@@H]2C[C@H](C)O)ccc1[N+](=O)[O-] ZINC000413802399 942624956 /nfs/dbraw/zinc/62/49/56/942624956.db2.gz HICYAVLNNOFQMM-GOEBONIOSA-N 0 0 364.442 3.538 20 5 FHBDRN Cc1cccc2oc(CCNC(=O)c3cc([N+](=O)[O-])c(C)cc3C)nc21 ZINC000421504394 942630230 /nfs/dbraw/zinc/63/02/30/942630230.db2.gz NVYFWXCOPIHOJC-UHFFFAOYSA-N 0 0 353.378 3.634 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CC(C)(C)OC1(C)C ZINC000183578796 942634285 /nfs/dbraw/zinc/63/42/85/942634285.db2.gz FNPKVMCQOVNKJH-INIZCTEOSA-N 0 0 363.458 3.861 20 5 FHBDRN COC(=O)c1cc(C(=O)N(C)[C@H]2CCC[C@@H]2C(C)(C)C)cc([N+](=O)[O-])c1 ZINC000416308546 942635678 /nfs/dbraw/zinc/63/56/78/942635678.db2.gz MHLJKXZHVBTYGS-HOTGVXAUSA-N 0 0 362.426 3.668 20 5 FHBDRN O=C(NCc1ccc(Oc2cccc(F)c2)nc1)c1ccccc1[N+](=O)[O-] ZINC000501729484 942636855 /nfs/dbraw/zinc/63/68/55/942636855.db2.gz HJORVPXETNSTSG-UHFFFAOYSA-N 0 0 367.336 3.851 20 5 FHBDRN O=[N+]([O-])c1ccc2nc(N3CCO[C@H](c4cccc(F)c4)C3)ccc2c1 ZINC000066814788 942637993 /nfs/dbraw/zinc/63/79/93/942637993.db2.gz DBMXBWGEKKHDBF-SFHVURJKSA-N 0 0 353.353 3.860 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCOC[C@H]1c1ccc(F)cc1 ZINC000421547246 942653059 /nfs/dbraw/zinc/65/30/59/942653059.db2.gz BASTWHRBBHPSBM-SFHVURJKSA-N 0 0 358.369 3.564 20 5 FHBDRN Cc1cc(NC(=O)CCCNc2ccc([N+](=O)[O-])cc2)cc2n[nH]cc21 ZINC000501753619 942653827 /nfs/dbraw/zinc/65/38/27/942653827.db2.gz USXVSZLSLPTDSD-UHFFFAOYSA-N 0 0 353.382 3.610 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(-c3cc[nH]n3)cc2)c1 ZINC000366994283 942654035 /nfs/dbraw/zinc/65/40/35/942654035.db2.gz HILFGUSOHQTJHX-UHFFFAOYSA-N 0 0 352.350 3.636 20 5 FHBDRN COC(=O)[C@H](C)c1cccc(NC(=O)c2cc([N+](=O)[O-])c(C)cc2C)c1 ZINC000421550879 942654461 /nfs/dbraw/zinc/65/44/61/942654461.db2.gz DJIQXQLXUFKCNE-CYBMUJFWSA-N 0 0 356.378 3.740 20 5 FHBDRN CCn1nc(C)c(CNc2cc(C)nc(-c3ccc([N+](=O)[O-])cc3)n2)c1C ZINC000066816849 942656529 /nfs/dbraw/zinc/65/65/29/942656529.db2.gz NTQBBXWXWJKPAK-UHFFFAOYSA-N 0 0 366.425 3.806 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCCN(c2ccccc2)C1 ZINC000421553278 942656716 /nfs/dbraw/zinc/65/67/16/942656716.db2.gz JYXJDMWXHZHBGV-KRWDZBQOSA-N 0 0 367.449 3.858 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NC[C@H]1CCCN(c2ccccc2)C1 ZINC000421553282 942656785 /nfs/dbraw/zinc/65/67/85/942656785.db2.gz JYXJDMWXHZHBGV-QGZVFWFLSA-N 0 0 367.449 3.858 20 5 FHBDRN O=[N+]([O-])c1ccc2nc(N3CCO[C@@H](c4cccc(F)c4)C3)ccc2c1 ZINC000066814789 942660470 /nfs/dbraw/zinc/66/04/70/942660470.db2.gz DBMXBWGEKKHDBF-GOSISDBHSA-N 0 0 353.353 3.860 20 5 FHBDRN COC(=O)[C@]1(C)CN(C(=O)c2cc3ccccc3c3cccnc23)C[C@H]1C ZINC000501775512 942667608 /nfs/dbraw/zinc/66/76/08/942667608.db2.gz LHCSVJBAFDOYRM-JLCFBVMHSA-N 0 0 362.429 3.659 20 5 FHBDRN CN(C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)[C@@H](CO)c1ccc(Cl)cc1 ZINC000413832357 942668047 /nfs/dbraw/zinc/66/80/47/942668047.db2.gz LYZKUUYMONCNHU-KSZLIROESA-N 0 0 374.824 3.544 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1Cc1ccccc1)N1CCCCCC1 ZINC000016458648 942675143 /nfs/dbraw/zinc/67/51/43/942675143.db2.gz KLOIKKLMRJIJDY-UHFFFAOYSA-N 0 0 368.433 3.967 20 5 FHBDRN COc1ccc(NC(=O)Cc2cscc2Br)c([N+](=O)[O-])c1 ZINC000501813293 942683868 /nfs/dbraw/zinc/68/38/68/942683868.db2.gz BRZBAOJSOIXLEH-UHFFFAOYSA-N 0 0 371.212 3.609 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N(C(C)C)C2CC(C)(C)C2)c1F ZINC000413861229 942684764 /nfs/dbraw/zinc/68/47/64/942684764.db2.gz NXHLVWSWTBKTKB-UHFFFAOYSA-N 0 0 352.406 3.711 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)NC[C@H]2CC23CCSCC3)c1 ZINC000421591123 942686650 /nfs/dbraw/zinc/68/66/50/942686650.db2.gz OWNFTOBTRSJRMJ-LLVKDONJSA-N 0 0 352.481 3.580 20 5 FHBDRN O=C(NC[C@@H]1CC12CCSCC2)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000421591266 942687237 /nfs/dbraw/zinc/68/72/37/942687237.db2.gz PGVIRBGKZWNOOY-NSHDSACASA-N 0 0 374.384 3.877 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H](c1ccccc1)[C@@H]1CCOC1 ZINC000378380755 942688062 /nfs/dbraw/zinc/68/80/62/942688062.db2.gz WCNOQFDWWYBDKN-CRAIPNDOSA-N 0 0 355.394 3.803 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)NCCC[C@H]2CCCC[C@@H]2O)cc1[N+](=O)[O-] ZINC000434469975 942690495 /nfs/dbraw/zinc/69/04/95/942690495.db2.gz LTLKNLVFZUVBBX-KDOFPFPSSA-N 0 0 362.470 3.953 20 5 FHBDRN Cc1c(Cc2noc(-c3cc(COC(C)(C)C)on3)n2)cccc1[N+](=O)[O-] ZINC000420488536 942693854 /nfs/dbraw/zinc/69/38/54/942693854.db2.gz QVLCRJZUYIRSHB-UHFFFAOYSA-N 0 0 372.381 3.847 20 5 FHBDRN COc1ccc(CNC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)cc1 ZINC000047864422 942699439 /nfs/dbraw/zinc/69/94/39/942699439.db2.gz XYYSUKCVDWPKMG-UHFFFAOYSA-N 0 0 367.308 3.527 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2CCc3cc(F)cc(C)c3C2)c1 ZINC000501830819 942700498 /nfs/dbraw/zinc/70/04/98/942700498.db2.gz OJJITEVNYBYCOA-UHFFFAOYSA-N 0 0 372.396 3.705 20 5 FHBDRN CCn1c(-c2cccc([N+](=O)[O-])c2)nnc1N1CC[C@]2(CC[C@H](C)C2)C1 ZINC000549427712 942704178 /nfs/dbraw/zinc/70/41/78/942704178.db2.gz NRNRCWQCEUVRER-LIRRHRJNSA-N 0 0 355.442 3.890 20 5 FHBDRN O=[N+]([O-])c1ccccc1NCCc1noc([C@H]2C[C@@]2(F)c2ccccc2)n1 ZINC000420498653 942706374 /nfs/dbraw/zinc/70/63/74/942706374.db2.gz DGCAXUQYVDSWCN-AUUYWEPGSA-N 0 0 368.368 3.985 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]c(CNCc3ccc(CSC(F)F)o3)nc2c1 ZINC000278825185 942714125 /nfs/dbraw/zinc/71/41/25/942714125.db2.gz ZUWGAJFXDDDDOQ-UHFFFAOYSA-N 0 0 368.365 3.810 20 5 FHBDRN Cc1cc(CN[C@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)ccc1F ZINC000514083047 942734409 /nfs/dbraw/zinc/73/44/09/942734409.db2.gz JKJUJMFWWBXKKD-SFHVURJKSA-N 0 0 354.385 3.655 20 5 FHBDRN COc1ccc2c(c1)OC[C@@H](Nc1ccc3ncccc3c1[N+](=O)[O-])C2 ZINC000502788893 942743484 /nfs/dbraw/zinc/74/34/84/942743484.db2.gz IGUQEVSCKNWVML-ZDUSSCGKSA-N 0 0 351.362 3.567 20 5 FHBDRN CCOC(=O)c1ccc(F)c(C)c1NC(=O)Cc1cccc([N+](=O)[O-])c1C ZINC000505441233 942790434 /nfs/dbraw/zinc/79/04/34/942790434.db2.gz ZWYRCHSAOLHKPE-UHFFFAOYSA-N 0 0 374.368 3.709 20 5 FHBDRN CCn1c(-c2ccc([N+](=O)[O-])cc2)nnc1N1CC[C@@H](C)C2(CCC2)C1 ZINC000549437230 942794952 /nfs/dbraw/zinc/79/49/52/942794952.db2.gz KUUUHUNYEQORHK-CQSZACIVSA-N 0 0 355.442 3.890 20 5 FHBDRN CC[C@@H](NCc1nc(-c2cccc(OC)c2)no1)c1cccc([N+](=O)[O-])c1 ZINC000378465477 942796653 /nfs/dbraw/zinc/79/66/53/942796653.db2.gz WNMBUKMEJLXIKA-QGZVFWFLSA-N 0 0 368.393 3.894 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)N2C[C@H](O)C[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000413930051 942800389 /nfs/dbraw/zinc/80/03/89/942800389.db2.gz BMBJAVGNNYVKOH-SJLPKXTDSA-N 0 0 368.433 3.840 20 5 FHBDRN CCc1c(C)sc2[nH]c(CC(=O)c3ccc(C)c([N+](=O)[O-])c3)nc(=O)c12 ZINC000416411390 942801753 /nfs/dbraw/zinc/80/17/53/942801753.db2.gz JKVRZQNXNMROIH-UHFFFAOYSA-N 0 0 371.418 3.910 20 5 FHBDRN O=C(N[C@H]1CSc2ccccc21)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514177294 942803089 /nfs/dbraw/zinc/80/30/89/942803089.db2.gz BZDIKXSUXFENEO-NSHDSACASA-N 0 0 366.345 3.773 20 5 FHBDRN Cc1c(CC(=O)Nc2ccc3cccc(Cl)c3n2)cccc1[N+](=O)[O-] ZINC000505450696 942808872 /nfs/dbraw/zinc/80/88/72/942808872.db2.gz HDVMZJKITWYXIS-UHFFFAOYSA-N 0 0 355.781 3.708 20 5 FHBDRN CC[C@](C)(NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)c1nccs1 ZINC000514186567 942812976 /nfs/dbraw/zinc/81/29/76/942812976.db2.gz QVSFHCPMPAAUEC-HNNXBMFYSA-N 0 0 371.365 3.708 20 5 FHBDRN Cc1csc(C(C)(C)NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)n1 ZINC000514188848 942814929 /nfs/dbraw/zinc/81/49/29/942814929.db2.gz HLTBEOLWHFYKCJ-UHFFFAOYSA-N 0 0 371.365 3.626 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NCc1nc(C(F)(F)F)cs1 ZINC000421773465 942816484 /nfs/dbraw/zinc/81/64/84/942816484.db2.gz JJXGLTUEWNIERP-UHFFFAOYSA-N 0 0 359.329 3.617 20 5 FHBDRN Cc1cc(NC(=O)c2c([N+](=O)[O-])cccc2C(F)(F)F)cn2ccnc12 ZINC000502888478 942818639 /nfs/dbraw/zinc/81/86/39/942818639.db2.gz OXSNXRUKNFAMTM-UHFFFAOYSA-N 0 0 364.283 3.822 20 5 FHBDRN COc1cc(C(=O)Nc2cccc(-c3noc(C)n3)c2)cc([N+](=O)[O-])c1C ZINC000190134539 942820823 /nfs/dbraw/zinc/82/08/23/942820823.db2.gz PTFBQJWZFKUNBE-UHFFFAOYSA-N 0 0 368.349 3.523 20 5 FHBDRN O=C(Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1)c1cccc2ncccc21 ZINC000104874788 942820999 /nfs/dbraw/zinc/82/09/99/942820999.db2.gz YBJXJQYDYNXDJI-UHFFFAOYSA-N 0 0 359.345 3.785 20 5 FHBDRN O=C(N[C@@H]1C[C@@H]1Cc1ccccc1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514217706 942825868 /nfs/dbraw/zinc/82/58/68/942825868.db2.gz GSKTUGNFIUMNRN-UONOGXRCSA-N 0 0 362.332 3.557 20 5 FHBDRN Cc1ccccc1[C@]1(F)CCN(Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000502908776 942832852 /nfs/dbraw/zinc/83/28/52/942832852.db2.gz IHMBJXPGMAOHLU-IBGZPJMESA-N 0 0 354.385 3.850 20 5 FHBDRN O=C(Nc1ccc(SCc2ccccc2)cn1)c1cc([N+](=O)[O-])c[nH]1 ZINC000514238748 942853018 /nfs/dbraw/zinc/85/30/18/942853018.db2.gz GYFMGEFFILFSGT-UHFFFAOYSA-N 0 0 354.391 3.863 20 5 FHBDRN C[C@H](O)[C@H]1CCCCN1C(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000181611226 942857171 /nfs/dbraw/zinc/85/71/71/942857171.db2.gz JINPAYRYIMKTPP-KBXCAEBGSA-N 0 0 369.421 3.714 20 5 FHBDRN O=[N+]([O-])c1cc(CN[C@@H](CCO)c2ccccc2Br)cs1 ZINC000514246422 942862151 /nfs/dbraw/zinc/86/21/51/942862151.db2.gz LFMHIDXPTXPPEX-ZDUSSCGKSA-N 0 0 371.256 3.632 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N2CCC[C@]2(C)Cc2ccc(F)cc2)c1[N+](=O)[O-] ZINC000421917032 942874453 /nfs/dbraw/zinc/87/44/53/942874453.db2.gz JKPJOHZJTBQJHA-LJQANCHMSA-N 0 0 374.416 3.818 20 5 FHBDRN C[C@@H](CNC(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-])CC(F)(F)F ZINC000413997887 942876226 /nfs/dbraw/zinc/87/62/26/942876226.db2.gz VUAGTAXQJXMNNE-LLVKDONJSA-N 0 0 367.327 3.975 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N([C@H](C)C(=O)OC(C)(C)C)C1CC1 ZINC000421904775 942879898 /nfs/dbraw/zinc/87/98/98/942879898.db2.gz ZNMORDQALUDGGD-CYBMUJFWSA-N 0 0 362.426 3.546 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N[C@@H](CCO)c1ccc(Cl)cc1 ZINC000421906428 942881039 /nfs/dbraw/zinc/88/10/39/942881039.db2.gz LBFNDRMTZPIBCH-INIZCTEOSA-N 0 0 362.813 3.719 20 5 FHBDRN Cc1cc(OCC(=O)N2CC=C(c3ccc(F)cc3)CC2)ccc1[N+](=O)[O-] ZINC000430087668 942883040 /nfs/dbraw/zinc/88/30/40/942883040.db2.gz DWZAHTVSABYTKX-UHFFFAOYSA-N 0 0 370.380 3.737 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CC2(CCOCC2)[C@@H]2CCC[C@@H]21 ZINC000412379618 942886296 /nfs/dbraw/zinc/88/62/96/942886296.db2.gz OVWMSYGXFOGHPJ-MANSERQUSA-N 0 0 370.449 3.506 20 5 FHBDRN COc1cc(CNc2cc(C(=O)NC3CC3)ccc2C)c([N+](=O)[O-])cc1F ZINC000184004846 942896053 /nfs/dbraw/zinc/89/60/53/942896053.db2.gz YRWUJLPZNLUMRM-UHFFFAOYSA-N 0 0 373.384 3.555 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N1CCC[C@H](CC(F)(F)F)C1 ZINC000421940881 942897378 /nfs/dbraw/zinc/89/73/78/942897378.db2.gz BTFDBSDWLDZDRF-LLVKDONJSA-N 0 0 360.332 3.798 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)COc1ccc(Cl)c(Cl)c1 ZINC000514323912 942899030 /nfs/dbraw/zinc/89/90/30/942899030.db2.gz UEOINDQMJLPPEC-UHFFFAOYSA-N 0 0 369.204 3.939 20 5 FHBDRN Cc1c(Br)cc(C(=O)NCc2ccsc2)cc1[N+](=O)[O-] ZINC000510004267 942902965 /nfs/dbraw/zinc/90/29/65/942902965.db2.gz FIKYGXJTYOPKQK-UHFFFAOYSA-N 0 0 355.213 3.657 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCC[C@@H]2c2cccc3c2OCCO3)c([N+](=O)[O-])c1 ZINC000066818768 942923069 /nfs/dbraw/zinc/92/30/69/942923069.db2.gz OAVDBFWDRKSNRA-CQSZACIVSA-N 0 0 371.349 3.616 20 5 FHBDRN CC[C@H]1C[C@@H](NC(=O)c2cccc3c(=O)c4cccc(F)c4[nH]c23)CCO1 ZINC000421993434 942927433 /nfs/dbraw/zinc/92/74/33/942927433.db2.gz RULAASGYZDMZFE-STQMWFEESA-N 0 0 368.408 3.508 20 5 FHBDRN CN([C@H]1CCC[C@H]1c1ccccc1)S(=O)(=O)Cc1ccccc1[N+](=O)[O-] ZINC000416540145 942931767 /nfs/dbraw/zinc/93/17/67/942931767.db2.gz GRYACHFLCYWGPE-HKUYNNGSSA-N 0 0 374.462 3.693 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H](COCC)C1 ZINC000503067732 942948574 /nfs/dbraw/zinc/94/85/74/942948574.db2.gz TZVYMBJEAFOAPI-CQSZACIVSA-N 0 0 366.483 3.986 20 5 FHBDRN Cc1nc(C2CCC2)sc1CC(=O)NCc1cccc([N+](=O)[O-])c1C ZINC001269216084 942961301 /nfs/dbraw/zinc/96/13/01/942961301.db2.gz SMTFCXSZNLTNOI-UHFFFAOYSA-N 0 0 359.451 3.795 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1nc(COC)cs1 ZINC000503092218 942981740 /nfs/dbraw/zinc/98/17/40/942981740.db2.gz JJYOHWKCSLOTQW-UHFFFAOYSA-N 0 0 367.452 3.952 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(N(C)C)cn1 ZINC000503119269 942987894 /nfs/dbraw/zinc/98/78/94/942987894.db2.gz QMHBFUNTPWNHPN-UHFFFAOYSA-N 0 0 360.439 3.810 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1OC(=O)COc1ccc(Br)cc1 ZINC000760017450 942992878 /nfs/dbraw/zinc/99/28/78/942992878.db2.gz ONCYNOAQRAHPCV-UHFFFAOYSA-N 0 0 366.167 3.650 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1Sc1ccccc1)N1CC[C@]12CCOC2 ZINC000422088883 942994424 /nfs/dbraw/zinc/99/44/24/942994424.db2.gz MFRFFGNMFVRQSK-LJQANCHMSA-N 0 0 370.430 3.751 20 5 FHBDRN O=C(NCCCO[C@@H]1CCCc2ccccc21)c1ccc([N+](=O)[O-])cc1F ZINC000505538046 942997016 /nfs/dbraw/zinc/99/70/16/942997016.db2.gz JOHAKUSHWVUXIW-LJQANCHMSA-N 0 0 372.396 3.948 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N2CCCC[C@H]2Cc2ccccc2)c1[N+](=O)[O-] ZINC000434187040 942998491 /nfs/dbraw/zinc/99/84/91/942998491.db2.gz OVELGCMEVWEZCH-HNNXBMFYSA-N 0 0 356.426 3.679 20 5 FHBDRN CCCN(CC1CC1)C(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000514431691 943001348 /nfs/dbraw/zinc/00/13/48/943001348.db2.gz LKPYOJJNEQZFEW-UHFFFAOYSA-N 0 0 360.332 3.798 20 5 FHBDRN C[C@@H]1CC[C@@H](O)CN1C(=O)c1ccccc1Sc1ccccc1[N+](=O)[O-] ZINC000422112318 943002042 /nfs/dbraw/zinc/00/20/42/943002042.db2.gz IMGHGYZBTQPYFN-ZIAGYGMSSA-N 0 0 372.446 3.731 20 5 FHBDRN Cc1c(CNC(=O)N[C@H](C)CCOCc2ccccc2)cccc1[N+](=O)[O-] ZINC000503137228 943005264 /nfs/dbraw/zinc/00/52/64/943005264.db2.gz NULBXSHTWAGNFL-OAHLLOKOSA-N 0 0 371.437 3.698 20 5 FHBDRN COc1cc(C(=O)NC[C@@H]2CCCCC(F)(F)C2)c([N+](=O)[O-])cc1OC ZINC000293747661 943006861 /nfs/dbraw/zinc/00/68/61/943006861.db2.gz VYPFYMTYKIMBDF-LLVKDONJSA-N 0 0 372.368 3.557 20 5 FHBDRN Cc1ccc(C=Cc2nc(SCCOc3cccc([N+](=O)[O-])c3)n[nH]2)o1 ZINC000514434840 943015914 /nfs/dbraw/zinc/01/59/14/943015914.db2.gz YQOHCVRFTUVGHL-FPLPWBNLSA-N 0 0 372.406 3.956 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@H](C)c1cc(F)ccc1OC ZINC000122970062 943020274 /nfs/dbraw/zinc/02/02/74/943020274.db2.gz ICIFRNBREJIBNB-SNVBAGLBSA-N 0 0 363.345 3.634 20 5 FHBDRN COC(=O)c1cc(Br)ccc1OCc1cccc([N+](=O)[O-])c1 ZINC000505559551 943028059 /nfs/dbraw/zinc/02/80/59/943028059.db2.gz LEJUUETYSNUSRC-UHFFFAOYSA-N 0 0 366.167 3.723 20 5 FHBDRN C[C@@H]1c2c(Cl)cc(Cl)cc2CCN1CCn1ccc([N+](=O)[O-])n1 ZINC000434895380 943032923 /nfs/dbraw/zinc/03/29/23/943032923.db2.gz JUJQYCXOVCMZTP-SNVBAGLBSA-N 0 0 355.225 3.717 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CC[C@@H](c2ccccc2)[C@H]1C ZINC000434901218 943038082 /nfs/dbraw/zinc/03/80/82/943038082.db2.gz TUVNFSYFENRJME-NVXWUHKLSA-N 0 0 353.422 3.720 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CC(c2ccc(Cl)cc2)C1 ZINC000412398422 943050491 /nfs/dbraw/zinc/05/04/91/943050491.db2.gz KQWAXLRHNKHDOT-ZWKOTPCHSA-N 0 0 356.809 3.978 20 5 FHBDRN CSc1ccc(C(=O)OCC(=O)c2ccc(C)c(C)c2)cc1[N+](=O)[O-] ZINC000016685012 943051479 /nfs/dbraw/zinc/05/14/79/943051479.db2.gz XUZKAOBCPJGVRO-UHFFFAOYSA-N 0 0 359.403 3.973 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])N[C@H]1C[C@@H]1c1ccccc1C(F)(F)F ZINC000505567150 943052964 /nfs/dbraw/zinc/05/29/64/943052964.db2.gz WBAPDCVHJKYMFM-HIFRSBDPSA-N 0 0 364.323 3.828 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])N[C@H]1C[C@H]1c1ccccc1C(F)(F)F ZINC000505567152 943053454 /nfs/dbraw/zinc/05/34/54/943053454.db2.gz WBAPDCVHJKYMFM-ZFWWWQNUSA-N 0 0 364.323 3.828 20 5 FHBDRN Cc1c(NC(=O)N([C@H](C)C(=O)OC(C)(C)C)C2CC2)cccc1[N+](=O)[O-] ZINC000416727486 943058650 /nfs/dbraw/zinc/05/86/50/943058650.db2.gz GLEZXFCCJSWLAI-GFCCVEGCSA-N 0 0 363.414 3.630 20 5 FHBDRN Cc1cc(-n2cccn2)ccc1NC(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000190225897 943073161 /nfs/dbraw/zinc/07/31/61/943073161.db2.gz PEINKLMNIAWHJX-UHFFFAOYSA-N 0 0 368.418 3.820 20 5 FHBDRN CO[C@@H](CNC(=O)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1)CC(C)C ZINC000416752615 943076520 /nfs/dbraw/zinc/07/65/20/943076520.db2.gz VVWHFUMAXRNIDU-FUHWJXTLSA-N 0 0 363.458 3.545 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC[C@@H](Oc2ccccc2)C1 ZINC000416742280 943077615 /nfs/dbraw/zinc/07/76/15/943077615.db2.gz ZENHDORSTLWTLF-QGZVFWFLSA-N 0 0 355.394 3.979 20 5 FHBDRN Cc1ccc(NC(=O)N([C@H](C)C(=O)OC(C)(C)C)C2CC2)cc1[N+](=O)[O-] ZINC000416742334 943078061 /nfs/dbraw/zinc/07/80/61/943078061.db2.gz ZNWMJODXQZCLBS-GFCCVEGCSA-N 0 0 363.414 3.630 20 5 FHBDRN CCn1cc([C@H]2OCCC[C@@H]2Nc2ccc([N+](=O)[O-])c3ncccc23)cn1 ZINC000425258870 943081914 /nfs/dbraw/zinc/08/19/14/943081914.db2.gz RVQODJWGCRAWIZ-QFBILLFUSA-N 0 0 367.409 3.692 20 5 FHBDRN CCN(CC)C(=O)CN(C)Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000434977913 943082189 /nfs/dbraw/zinc/08/21/89/943082189.db2.gz KPXOEFFKDOGDQP-UHFFFAOYSA-N 0 0 361.467 3.624 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@@]2(C1)OCc1ccccc12 ZINC000183893892 943082737 /nfs/dbraw/zinc/08/27/37/943082737.db2.gz YLQHERKSVAONJP-IBGZPJMESA-N 0 0 353.378 3.567 20 5 FHBDRN Cc1ccc(C2=CCN(S(=O)(=O)c3ccc(C)c([N+](=O)[O-])c3)CC2)cc1 ZINC000016736899 943100688 /nfs/dbraw/zinc/10/06/88/943100688.db2.gz MEYQIQOCTWUUIM-UHFFFAOYSA-N 0 0 372.446 3.690 20 5 FHBDRN O=C(Nc1ccccc1OC(F)(F)F)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000016724343 943102701 /nfs/dbraw/zinc/10/27/01/943102701.db2.gz PNJQKQVGFQESAA-UHFFFAOYSA-N 0 0 371.227 3.654 20 5 FHBDRN Cc1ccc(C(=O)N[C@@H](CC(=O)OC(C)C)c2ccccc2[N+](=O)[O-])cc1 ZINC000014375984 943110138 /nfs/dbraw/zinc/11/01/38/943110138.db2.gz SBPIBDADTJUBCG-KRWDZBQOSA-N 0 0 370.405 3.716 20 5 FHBDRN O=C(Nc1nc2c(s1)CCCC2)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000014378242 943111645 /nfs/dbraw/zinc/11/16/45/943111645.db2.gz BMVXNWXPOCVVHR-UHFFFAOYSA-N 0 0 358.423 3.757 20 5 FHBDRN CCOc1cc(C(=O)O[C@H]2CC(C)(C)OC2(C)C)c([N+](=O)[O-])cc1OC ZINC000783152747 943113833 /nfs/dbraw/zinc/11/38/33/943113833.db2.gz JKCYDSGVDWSNRP-HNNXBMFYSA-N 0 0 367.398 3.505 20 5 FHBDRN CNC(=O)c1ccc(N2CCC[C@@H]2/C=C/c2ccccc2)c([N+](=O)[O-])c1 ZINC000503294311 943114962 /nfs/dbraw/zinc/11/49/62/943114962.db2.gz DFMNJLFRAKBUHU-QXLXQBSBSA-N 0 0 351.406 3.637 20 5 FHBDRN O=C(N[C@@H]1C[C@H]1c1ccccc1C(F)(F)F)c1ccc([N+](=O)[O-])cc1 ZINC000505592649 943119195 /nfs/dbraw/zinc/11/91/95/943119195.db2.gz HCTDSNGWJROINL-DZGCQCFKSA-N 0 0 350.296 3.900 20 5 FHBDRN Cc1cc(C(=O)Nc2ccnn2CCc2ccccc2)ccc1[N+](=O)[O-] ZINC000503337501 943127011 /nfs/dbraw/zinc/12/70/11/943127011.db2.gz XRWZJHPBMUQNRB-UHFFFAOYSA-N 0 0 350.378 3.595 20 5 FHBDRN CCc1nn(C)c(S[C@H]2CCC[N@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000425276137 943150068 /nfs/dbraw/zinc/15/00/68/943150068.db2.gz CZESELQNPRXDDH-HNNXBMFYSA-N 0 0 360.483 3.647 20 5 FHBDRN CC1(C)C[C@@H](c2ccccc2)N(c2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])C1 ZINC000425276052 943150969 /nfs/dbraw/zinc/15/09/69/943150969.db2.gz CIJGYXOZJPBXDS-SFHVURJKSA-N 0 0 374.462 3.976 20 5 FHBDRN Cc1nc(C(F)(F)F)ccc1C(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000024916342 943154740 /nfs/dbraw/zinc/15/47/40/943154740.db2.gz WSFDFHJUMCUBJA-UHFFFAOYSA-N 0 0 351.284 3.520 20 5 FHBDRN O=C(NCCNc1ncc(Cl)cc1Cl)Nc1ccc([N+](=O)[O-])cc1 ZINC000503406038 943165229 /nfs/dbraw/zinc/16/52/29/943165229.db2.gz KNXWGGANGMWYKQ-UHFFFAOYSA-N 0 0 370.196 3.530 20 5 FHBDRN CC(C)Cc1ncc(CN2CCN(c3ccccc3[N+](=O)[O-])CC2)s1 ZINC000505605433 943168525 /nfs/dbraw/zinc/16/85/25/943168525.db2.gz GXHPQSWQCZYHRL-UHFFFAOYSA-N 0 0 360.483 3.572 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N(C2CC2)[C@@H]2CCc3ccccc32)c1[N+](=O)[O-] ZINC000434194930 943170443 /nfs/dbraw/zinc/17/04/43/943170443.db2.gz UCNXGXMVYUNWQP-OAHLLOKOSA-N 0 0 354.410 3.733 20 5 FHBDRN Cc1c(C[NH+]2CCC(N3CCc4ccccc43)CC2)cccc1[N+](=O)[O-] ZINC000503436562 943183426 /nfs/dbraw/zinc/18/34/26/943183426.db2.gz VIHAERNHGLTXNL-UHFFFAOYSA-N 0 0 351.450 3.930 20 5 FHBDRN CCOc1ccccc1[C@@H](CC)NC(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-] ZINC000434177875 943194440 /nfs/dbraw/zinc/19/44/40/943194440.db2.gz SNGFRTDARJVJRD-CYBMUJFWSA-N 0 0 360.414 3.721 20 5 FHBDRN COC(=O)c1ccc(OC(=O)[C@H](C)c2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC001267796267 943203187 /nfs/dbraw/zinc/20/31/87/943203187.db2.gz ZGVVSZIULLDEAW-SNVBAGLBSA-N 0 0 363.753 3.744 20 5 FHBDRN O=[N+]([O-])c1cccc(F)c1CN1CCC[C@@H]1c1ccc2c(c1)OCCO2 ZINC000505613699 943206691 /nfs/dbraw/zinc/20/66/91/943206691.db2.gz USKIUFDHPPXMMJ-MRXNPFEDSA-N 0 0 358.369 3.842 20 5 FHBDRN Cc1cc(OCC(=O)Nc2ccccc2OC(F)(F)F)ccc1[N+](=O)[O-] ZINC000430126193 943220868 /nfs/dbraw/zinc/22/08/68/943220868.db2.gz VBISQIMJMPAFMV-UHFFFAOYSA-N 0 0 370.283 3.819 20 5 FHBDRN C[C@@H]1C[C@@H](C(C)(C)C)CCN1C(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000503542534 943238640 /nfs/dbraw/zinc/23/86/40/943238640.db2.gz XQNPKGVTRXLHCO-OLZOCXBDSA-N 0 0 373.457 3.827 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1CNc1nnc(CCOc2ccccc2)o1 ZINC000185903084 943241171 /nfs/dbraw/zinc/24/11/71/943241171.db2.gz MYRUHUKWYKYYFX-UHFFFAOYSA-N 0 0 354.366 3.520 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCCSc1ccccn1 ZINC000425296587 943246149 /nfs/dbraw/zinc/24/61/49/943246149.db2.gz MKLVIJPQXZMBEU-INIZCTEOSA-N 0 0 373.478 3.857 20 5 FHBDRN Cc1cc(NC(=O)N2CCC[C@@H]2COc2cccnc2C)ccc1[N+](=O)[O-] ZINC000416971542 943264904 /nfs/dbraw/zinc/26/49/04/943264904.db2.gz DKGIABSBLAPGDI-MRXNPFEDSA-N 0 0 370.409 3.682 20 5 FHBDRN COc1cccc(C2(c3noc(Cc4cccc([N+](=O)[O-])c4)n3)CC2)c1 ZINC000514758069 943270965 /nfs/dbraw/zinc/27/09/65/943270965.db2.gz HWBZNQMKLVHOKB-UHFFFAOYSA-N 0 0 351.362 3.657 20 5 FHBDRN CS(=O)(=O)c1ccc(C(=O)Nc2ccc(C3CCC3)cc2)cc1[N+](=O)[O-] ZINC000513793740 943277813 /nfs/dbraw/zinc/27/78/13/943277813.db2.gz DIXLYHVAIDFKBN-UHFFFAOYSA-N 0 0 374.418 3.518 20 5 FHBDRN COc1ccc(Cc2nc(-c3ccc(C)cc3OC)no2)cc1[N+](=O)[O-] ZINC000514771380 943280435 /nfs/dbraw/zinc/28/04/35/943280435.db2.gz FZFDIPHEXHKJBL-UHFFFAOYSA-N 0 0 355.350 3.561 20 5 FHBDRN C[C@@H]1CCN(C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)CC12CCC2 ZINC000408086430 943289269 /nfs/dbraw/zinc/28/92/69/943289269.db2.gz IXFYIPDJYUKUGJ-MRXNPFEDSA-N 0 0 371.481 3.850 20 5 FHBDRN C[C@H](Cc1ccccc1C(F)(F)F)NC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000503628858 943299555 /nfs/dbraw/zinc/29/95/55/943299555.db2.gz OMKKHXJBHSPYOC-LLVKDONJSA-N 0 0 352.312 3.975 20 5 FHBDRN CS[C@H]1CCCCN(C(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000435290389 943307157 /nfs/dbraw/zinc/30/71/57/943307157.db2.gz QJHPWFWPTLZWKI-AAEUAGOBSA-N 0 0 372.874 3.760 20 5 FHBDRN C[C@@H]1C[C@@H]1c1ccc([C@H]2C[C@H]2c2nc(Cc3ccc([N+](=O)[O-])cn3)no2)o1 ZINC000364006184 943309778 /nfs/dbraw/zinc/30/97/78/943309778.db2.gz YZWUFPPCKGRULT-SDJAHQOYSA-N 0 0 366.377 3.951 20 5 FHBDRN Cc1cc(Cl)c(NCc2c([N+](=O)[O-])ncn2C)cc1Br ZINC000417044261 943314572 /nfs/dbraw/zinc/31/45/72/943314572.db2.gz PZRIMDZOVVLNNJ-UHFFFAOYSA-N 0 0 359.611 3.665 20 5 FHBDRN O=C(NCCc1cc(F)c(F)c(F)c1)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000503661750 943316999 /nfs/dbraw/zinc/31/69/99/943316999.db2.gz BULBFIZYIXCTBO-UHFFFAOYSA-N 0 0 364.279 3.731 20 5 FHBDRN Cc1c(NC(=O)N2CC[C@@H](C)[C@@H]2C)cc(Br)cc1[N+](=O)[O-] ZINC000435322828 943323692 /nfs/dbraw/zinc/32/36/92/943323692.db2.gz HDMASLZEMWBKRX-SCZZXKLOSA-N 0 0 356.220 3.928 20 5 FHBDRN Cc1c(NC(=O)N[C@@H]2[C@@H]3CCC[C@@H]32)cc(Br)cc1[N+](=O)[O-] ZINC000435326515 943325701 /nfs/dbraw/zinc/32/57/01/943325701.db2.gz DDASEJOXMCRTID-DDFAGTSDSA-N 0 0 354.204 3.586 20 5 FHBDRN Cc1ccc(NC(=O)NC2(c3ccc(F)cc3)CCOCC2)cc1[N+](=O)[O-] ZINC000503682990 943329601 /nfs/dbraw/zinc/32/96/01/943329601.db2.gz TVHWVNPERMMASG-UHFFFAOYSA-N 0 0 373.384 3.870 20 5 FHBDRN CC[C@@H]1CCN(C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2C)C1 ZINC000435330694 943333847 /nfs/dbraw/zinc/33/38/47/943333847.db2.gz VLXLTMCIBBDNFI-SNVBAGLBSA-N 0 0 356.220 3.930 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CC[C@@H](COc2ccccc2)C1 ZINC000505679816 943360945 /nfs/dbraw/zinc/36/09/45/943360945.db2.gz FTCHFSXUKIMZJW-CYBMUJFWSA-N 0 0 360.797 3.789 20 5 FHBDRN Cc1c(CNC(=O)Nc2cc(C(F)(F)F)ccn2)cccc1[N+](=O)[O-] ZINC000434209541 943365122 /nfs/dbraw/zinc/36/51/22/943365122.db2.gz XJEITNXUDSYZBF-UHFFFAOYSA-N 0 0 354.288 3.639 20 5 FHBDRN CCCCC[C@H]1CCCN1S(=O)(=O)CCc1ccc([N+](=O)[O-])cc1 ZINC000503782235 943367268 /nfs/dbraw/zinc/36/72/68/943367268.db2.gz CFVDZGZZAUGTNZ-INIZCTEOSA-N 0 0 354.472 3.512 20 5 FHBDRN COc1ccc2oc(C(=O)N(C)Cc3ccccc3[N+](=O)[O-])c(C)c2c1 ZINC000514902097 943372807 /nfs/dbraw/zinc/37/28/07/943372807.db2.gz BXSWNEFAHQFJAT-UHFFFAOYSA-N 0 0 354.362 3.930 20 5 FHBDRN C[C@H](NC(=O)N[C@H]1CCCc2cc(N)ccc21)c1cccc([N+](=O)[O-])c1 ZINC000417136916 943374104 /nfs/dbraw/zinc/37/41/04/943374104.db2.gz LNEGHVXIANHRJQ-SGTLLEGYSA-N 0 0 354.410 3.615 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]c(N3CCC[C@@H]3c3cccc4c3OCCO4)nc2c1 ZINC000514904938 943376119 /nfs/dbraw/zinc/37/61/19/943376119.db2.gz UGDILSAMSRDSNC-MRXNPFEDSA-N 0 0 366.377 3.584 20 5 FHBDRN O=[N+]([O-])c1cccc(CS(=O)(=O)N2CCC[C@H]2/C=C/c2ccccc2)c1 ZINC000503828752 943377412 /nfs/dbraw/zinc/37/74/12/943377412.db2.gz OBKWVZWWANHGQQ-DXRVJIQQSA-N 0 0 372.446 3.602 20 5 FHBDRN Cc1cc(C(=O)CCC(=O)NCCc2ccc([N+](=O)[O-])cc2)c(C)s1 ZINC000053217687 943382054 /nfs/dbraw/zinc/38/20/54/943382054.db2.gz BMXAVGIFUOLFSP-UHFFFAOYSA-N 0 0 360.435 3.595 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)NC[C@@H]2CCC[C@@H]2C2CC2)cc1SC ZINC000412460169 943399294 /nfs/dbraw/zinc/39/92/94/943399294.db2.gz FINJEXFUUNRPHN-QWHCGFSZSA-N 0 0 364.467 3.881 20 5 FHBDRN CSc1ccc(C(=O)Nc2cccc3c2OCCC3=O)cc1[N+](=O)[O-] ZINC000503910427 943416055 /nfs/dbraw/zinc/41/60/55/943416055.db2.gz IOIIVTXHBIJFRM-UHFFFAOYSA-N 0 0 358.375 3.534 20 5 FHBDRN COc1cc(CSc2nc(C)c(C)[nH]2)c([N+](=O)[O-])cc1OC(F)F ZINC000514951363 943417192 /nfs/dbraw/zinc/41/71/92/943417192.db2.gz KENALRJTAXDFLS-UHFFFAOYSA-N 0 0 359.354 3.837 20 5 FHBDRN CCOCc1nc([C@@H](C)Nc2ccc(C(F)(F)F)cc2[N+](=O)[O-])no1 ZINC000290749281 943434668 /nfs/dbraw/zinc/43/46/68/943434668.db2.gz SIORGNJDHWKLJR-MRVPVSSYSA-N 0 0 360.292 3.706 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])N1CCC[C@@H]1/C=C\c1ccccc1 ZINC000503960710 943439378 /nfs/dbraw/zinc/43/93/78/943439378.db2.gz KYTWLTFPEWANBD-MENFKHAKSA-N 0 0 351.406 3.982 20 5 FHBDRN COc1ccc(C(=O)OCc2ccccc2OC(F)F)cc1[N+](=O)[O-] ZINC000014564385 943446214 /nfs/dbraw/zinc/44/62/14/943446214.db2.gz RFDPXPZXKYLDRS-UHFFFAOYSA-N 0 0 353.277 3.562 20 5 FHBDRN CNC(=O)c1ccc(CNc2cc(C)c(C(F)(F)F)cc2[N+](=O)[O-])cc1 ZINC000549465614 943446944 /nfs/dbraw/zinc/44/69/44/943446944.db2.gz PEWYQVPTFCCLGU-UHFFFAOYSA-N 0 0 367.327 3.894 20 5 FHBDRN COCC[C@@H](C)CNC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 ZINC000412471749 943449520 /nfs/dbraw/zinc/44/95/20/943449520.db2.gz LMFPUDOLRJUYCP-CQSZACIVSA-N 0 0 358.394 3.790 20 5 FHBDRN CCOc1ccc2c(c1)CCN(C(=O)Nc1cc([N+](=O)[O-])ccc1C)C2 ZINC000434212853 943466161 /nfs/dbraw/zinc/46/61/61/943466161.db2.gz DBRLGVYQXCCVLV-UHFFFAOYSA-N 0 0 355.394 3.892 20 5 FHBDRN COc1cccc(C(=O)NCc2cc(C)cc3c(C)c(C)[nH]c32)c1[N+](=O)[O-] ZINC000435531226 943470594 /nfs/dbraw/zinc/47/05/94/943470594.db2.gz KYUSSPVOFUMLPC-UHFFFAOYSA-N 0 0 367.405 3.940 20 5 FHBDRN Cc1ccc(COC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)c(C)c1 ZINC001269481317 943474314 /nfs/dbraw/zinc/47/43/14/943474314.db2.gz SWEHGZYXGAMBQY-UHFFFAOYSA-N 0 0 351.362 3.754 20 5 FHBDRN C[C@@H](CCc1ccccc1)NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000017155650 943483965 /nfs/dbraw/zinc/48/39/65/943483965.db2.gz DRWVZSKTVJCPMS-AWEZNQCLSA-N 0 0 353.422 3.920 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCc1cccc2c1OCO2 ZINC000504073436 943488489 /nfs/dbraw/zinc/48/84/89/943488489.db2.gz SIHLTDRCLCOIAL-UHFFFAOYSA-N 0 0 374.418 3.756 20 5 FHBDRN Cc1c(CN2C(=O)N[C@](C)(c3cccc(Cl)c3)C2=O)cccc1[N+](=O)[O-] ZINC000042179886 943491150 /nfs/dbraw/zinc/49/11/50/943491150.db2.gz WTPYGJSUBLGXDM-GOSISDBHSA-N 0 0 373.796 3.524 20 5 FHBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)NCc1ccn(CC)n1 ZINC000412478547 943492304 /nfs/dbraw/zinc/49/23/04/943492304.db2.gz YEIRMLHHIUJFKL-UHFFFAOYSA-N 0 0 362.455 3.633 20 5 FHBDRN CC(C)(C(=O)Nc1cnc(-c2ccccc2)nc1)c1ccccc1[N+](=O)[O-] ZINC000431934602 943498041 /nfs/dbraw/zinc/49/80/41/943498041.db2.gz CZTKTLWZXTXJRB-UHFFFAOYSA-N 0 0 362.389 3.968 20 5 FHBDRN COc1ccc(CC(=O)Nc2ccc(-c3ccccn3)cc2)cc1[N+](=O)[O-] ZINC000515100027 943504783 /nfs/dbraw/zinc/50/47/83/943504783.db2.gz WBYVTXPPNKDDBQ-UHFFFAOYSA-N 0 0 363.373 3.847 20 5 FHBDRN COC[C@@H](NC(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-])C(C)C ZINC000515109620 943510284 /nfs/dbraw/zinc/51/02/84/943510284.db2.gz OBZTYAPZXTUKQO-GOSISDBHSA-N 0 0 372.421 3.575 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N(C)Cc1ccc(F)c(F)c1 ZINC000515114164 943513322 /nfs/dbraw/zinc/51/33/22/943513322.db2.gz JSGUWWFTLSCOAN-UHFFFAOYSA-N 0 0 351.309 3.546 20 5 FHBDRN CCNC(=O)c1ccc(C[NH2+][C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000417319872 943513635 /nfs/dbraw/zinc/51/36/35/943513635.db2.gz IMMDUZJBAURKMO-HXUWFJFHSA-N 0 0 367.449 3.902 20 5 FHBDRN CCc1ccc(C(C)(C)NC(=O)NCc2ccc(OC)c([N+](=O)[O-])c2)cc1 ZINC000435616195 943516915 /nfs/dbraw/zinc/51/69/15/943516915.db2.gz JPMXIDZNCUROTK-UHFFFAOYSA-N 0 0 371.437 3.900 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1)[C@H](NCc1ncnn1-c1ccccc1)CCCC2 ZINC000417333873 943522140 /nfs/dbraw/zinc/52/21/40/943522140.db2.gz QOGAUAUAJBNQSN-LJQANCHMSA-N 0 0 363.421 3.733 20 5 FHBDRN CNc1ccc(C(=O)N[C@@H](C)c2cccc(OC(C)C)c2)cc1[N+](=O)[O-] ZINC000515131466 943526192 /nfs/dbraw/zinc/52/61/92/943526192.db2.gz XYBLJZGRGKZLAW-ZDUSSCGKSA-N 0 0 357.410 3.915 20 5 FHBDRN CCC1(CC)CN(C(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])C1 ZINC000504185828 943532234 /nfs/dbraw/zinc/53/22/34/943532234.db2.gz KXNZONQXMBGMST-UHFFFAOYSA-N 0 0 360.332 3.798 20 5 FHBDRN COc1cccc(C(=O)NCCSCc2ccc(C)cc2)c1[N+](=O)[O-] ZINC000435662602 943532808 /nfs/dbraw/zinc/53/28/08/943532808.db2.gz JTFUNTKCSKUCBH-UHFFFAOYSA-N 0 0 360.435 3.575 20 5 FHBDRN CCNc1ccc(C(=O)N2CC[C@H](COc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000504170374 943534125 /nfs/dbraw/zinc/53/41/25/943534125.db2.gz WDDVLEQHBWMHKD-HNNXBMFYSA-N 0 0 369.421 3.568 20 5 FHBDRN O=C1C[C@@H](Oc2cccc(N[C@H]3CCCCc4ccc([N+](=O)[O-])cc43)c2)N1 ZINC000417358712 943537951 /nfs/dbraw/zinc/53/79/51/943537951.db2.gz IAJQRIFCYNGPCT-AZUAARDMSA-N 0 0 367.405 3.699 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1F)N[C@@H]1C[C@H]1c1cc(F)c(F)c(F)c1 ZINC000435727754 943571484 /nfs/dbraw/zinc/57/14/84/943571484.db2.gz FKFYIPBVXLNHBH-LKFCYVNXSA-N 0 0 369.274 3.829 20 5 FHBDRN O=C(Nc1ccc2ccc(Cl)cc2n1)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000504291154 943576060 /nfs/dbraw/zinc/57/60/60/943576060.db2.gz XXMPQSSQZKDUDK-UHFFFAOYSA-N 0 0 367.752 3.925 20 5 FHBDRN COC(=O)[C@H](C)c1ccc(NC(=O)NCc2cccc([N+](=O)[O-])c2C)cc1 ZINC000417399898 943581929 /nfs/dbraw/zinc/58/19/29/943581929.db2.gz XJGLZSGOTLVDLL-CYBMUJFWSA-N 0 0 371.393 3.501 20 5 FHBDRN C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)COc1ccc(F)cc1Cl ZINC000504311167 943585746 /nfs/dbraw/zinc/58/57/46/943585746.db2.gz GTQHIOPECGJKPE-JTQLQIEISA-N 0 0 364.760 3.744 20 5 FHBDRN C[C@H]1CCCC[C@@H]1OCCNC(=O)CSCc1ccc([N+](=O)[O-])cc1 ZINC000513813210 943585840 /nfs/dbraw/zinc/58/58/40/943585840.db2.gz ZFVQSJSHCBDDCY-YOEHRIQHSA-N 0 0 366.483 3.540 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1cc(C)c(OC)cc1C ZINC000435736612 943589154 /nfs/dbraw/zinc/58/91/54/943589154.db2.gz YMEPWXDPOXCBMQ-UHFFFAOYSA-N 0 0 364.423 3.583 20 5 FHBDRN Cc1ccn(-c2ccc(C(=O)N3c4ccc([N+](=O)[O-])cc4C[C@H]3C)cc2)n1 ZINC000504326012 943595398 /nfs/dbraw/zinc/59/53/98/943595398.db2.gz WTTGAMOPPRTAKL-CQSZACIVSA-N 0 0 362.389 3.680 20 5 FHBDRN Cc1ccc(C)c(OCCC(=O)N2c3ccc([N+](=O)[O-])cc3C[C@@H]2C)c1 ZINC000504327894 943596410 /nfs/dbraw/zinc/59/64/10/943596410.db2.gz ALEQWHFACAPTNS-HNNXBMFYSA-N 0 0 354.406 3.958 20 5 FHBDRN O=C(c1n[nH]c2ccc([N+](=O)[O-])cc21)N1CCC[C@@H]1/C=C/c1ccccc1 ZINC000504336637 943599868 /nfs/dbraw/zinc/59/98/68/943599868.db2.gz OLWIECGOHGMYPB-XVJNWHFHSA-N 0 0 362.389 3.789 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CCO[C@@H](c3cccc(Cl)c3)C2)c(Cl)c1 ZINC000183969549 943600937 /nfs/dbraw/zinc/60/09/37/943600937.db2.gz DOAMJQKFJGXEAZ-CQSZACIVSA-N 0 0 354.193 3.875 20 5 FHBDRN COc1cc(C(=O)N(C(C)C)C2CCCC2)c([N+](=O)[O-])cc1OC(F)F ZINC000504381530 943610223 /nfs/dbraw/zinc/61/02/23/943610223.db2.gz MFEOYCWZYYGZAC-UHFFFAOYSA-N 0 0 372.368 3.998 20 5 FHBDRN C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)CCCOc1ccccc1F ZINC000504387012 943617832 /nfs/dbraw/zinc/61/78/32/943617832.db2.gz FSKCUGKJXGCCQU-CYBMUJFWSA-N 0 0 358.369 3.871 20 5 FHBDRN CN(Cc1ccc(F)cc1Cl)C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000126405272 943631001 /nfs/dbraw/zinc/63/10/01/943631001.db2.gz LZJIPTQFBIYNER-UHFFFAOYSA-N 0 0 365.792 3.771 20 5 FHBDRN O=C(NCc1ncoc1-c1ccccc1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000364128160 943631510 /nfs/dbraw/zinc/63/15/10/943631510.db2.gz BIFGUMXCGPJXTK-UHFFFAOYSA-N 0 0 357.753 3.833 20 5 FHBDRN COC(=O)c1cc(C(=O)Nc2c(C)cc(C)cc2Cl)cc([N+](=O)[O-])c1 ZINC000014669499 943634157 /nfs/dbraw/zinc/63/41/57/943634157.db2.gz MNRZRJDLHZVAAK-UHFFFAOYSA-N 0 0 362.769 3.904 20 5 FHBDRN CC(C)(COCc1ccccc1)NC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000504476619 943640797 /nfs/dbraw/zinc/64/07/97/943640797.db2.gz ZILNLHMRSSPHQG-UHFFFAOYSA-N 0 0 367.405 3.801 20 5 FHBDRN Cc1ccc(-n2nnnc2SCc2c(F)cccc2[N+](=O)[O-])c(C)c1 ZINC000504536866 943651637 /nfs/dbraw/zinc/65/16/37/943651637.db2.gz VGRNJQFZLNWFGA-UHFFFAOYSA-N 0 0 359.386 3.619 20 5 FHBDRN Nc1cccc(C2CCN(C(=O)c3ccc([N+](=O)[O-])cc3Cl)CC2)c1 ZINC000424027995 943677172 /nfs/dbraw/zinc/67/71/72/943677172.db2.gz AUJDOMLLQBCXFR-UHFFFAOYSA-N 0 0 359.813 3.850 20 5 FHBDRN CC(C)CC(CC(C)C)NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000504560181 943678277 /nfs/dbraw/zinc/67/82/77/943678277.db2.gz XGYMWKVMIDBUEQ-UHFFFAOYSA-N 0 0 358.442 3.971 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)[C@H]1CCCCO1 ZINC000504579042 943691341 /nfs/dbraw/zinc/69/13/41/943691341.db2.gz VEKRIMNZMCGEME-SWLSCSKDSA-N 0 0 352.456 3.784 20 5 FHBDRN C[C@](NC(=O)Cc1ccc([N+](=O)[O-])cc1F)(c1ccccc1)C(F)(F)F ZINC000504585442 943697745 /nfs/dbraw/zinc/69/77/45/943697745.db2.gz MVXJEFMWIQSPGX-INIZCTEOSA-N 0 0 370.302 3.870 20 5 FHBDRN C[C@@](NC(=O)c1cc(F)cc([N+](=O)[O-])c1)(c1ccccc1)C(F)(F)F ZINC000504594376 943703993 /nfs/dbraw/zinc/70/39/93/943703993.db2.gz WJBPZAKITREAMK-OAHLLOKOSA-N 0 0 356.275 3.941 20 5 FHBDRN CC(C)n1cc(CSCc2ccc(Br)cc2[N+](=O)[O-])nn1 ZINC000424123415 943743021 /nfs/dbraw/zinc/74/30/21/943743021.db2.gz MFGDNXFHWQGEDR-UHFFFAOYSA-N 0 0 371.260 3.963 20 5 FHBDRN Cc1ccc([C@@H](C)N2C(=O)CN([C@H](C)c3ccccc3)C2=O)cc1[N+](=O)[O-] ZINC000431955493 943743400 /nfs/dbraw/zinc/74/34/00/943743400.db2.gz QULWQYCQKLWIHH-HUUCEWRRSA-N 0 0 367.405 3.990 20 5 FHBDRN C[C@H]([NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1)[C@H](C)C(=O)[O-] ZINC000417619848 943754928 /nfs/dbraw/zinc/75/49/28/943754928.db2.gz ZSEZUGSOTXSAFV-KBPBESRZSA-N 0 0 357.410 3.562 20 5 FHBDRN O=c1oc2ccc([N+](=O)[O-])cc2n1Cc1nc(-c2ccccc2)cs1 ZINC000435788337 943758672 /nfs/dbraw/zinc/75/86/72/943758672.db2.gz BAIUXIPESZTMDA-UHFFFAOYSA-N 0 0 353.359 3.675 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)N[C@@H]1C[C@H]1c1ccc(Cl)cc1 ZINC000437376513 943760282 /nfs/dbraw/zinc/76/02/82/943760282.db2.gz RZLVJIOGSTWFPR-DLBZAZTESA-N 0 0 369.808 3.875 20 5 FHBDRN COc1cccc(C(=O)NC[C@H]2CCCC[C@@H]2C(F)(F)F)c1[N+](=O)[O-] ZINC000435815517 943772669 /nfs/dbraw/zinc/77/26/69/943772669.db2.gz DICQXEXTOQKVDM-PWSUYJOCSA-N 0 0 360.332 3.702 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N[C@H]2C[C@H](c3cccc(Cl)c3)C2)c1[N+](=O)[O-] ZINC000437430395 943785888 /nfs/dbraw/zinc/78/58/88/943785888.db2.gz QFKYPQZWILTQOC-AULYBMBSSA-N 0 0 362.817 3.771 20 5 FHBDRN O=C(NCc1ccccc1F)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000435819906 943793195 /nfs/dbraw/zinc/79/31/95/943793195.db2.gz UUUHIGRHTASEKK-UHFFFAOYSA-N 0 0 364.351 3.890 20 5 FHBDRN Cc1cccc(C(=O)N[C@H]2C[C@@H]2c2ccccc2OC(F)F)c1[N+](=O)[O-] ZINC000437424484 943796946 /nfs/dbraw/zinc/79/69/46/943796946.db2.gz WEEIEDPZYPCTPB-KGLIPLIRSA-N 0 0 362.332 3.791 20 5 FHBDRN C[C@H](c1ccc(F)c(F)c1)N(C)C(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000516888682 943797835 /nfs/dbraw/zinc/79/78/35/943797835.db2.gz CZRMCFXTVNEHNZ-SECBINFHSA-N 0 0 370.302 3.913 20 5 FHBDRN O=C(Nc1ccc2c(c1)OCCO2)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000435828448 943799416 /nfs/dbraw/zinc/79/94/16/943799416.db2.gz WGLSNDRSSIEWOR-UHFFFAOYSA-N 0 0 372.380 3.705 20 5 FHBDRN O=C(NCc1cccs1)c1cc(F)cc2c(=O)c3cccc(F)c3[nH]c12 ZINC000435828324 943799544 /nfs/dbraw/zinc/79/95/44/943799544.db2.gz SHZLVCOVPPMJOL-UHFFFAOYSA-N 0 0 370.380 3.951 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N(CC(=O)Nc1ccc(F)cc1)C(C)C ZINC000504807513 943805562 /nfs/dbraw/zinc/80/55/62/943805562.db2.gz YURUTQKLRTZRDV-UHFFFAOYSA-N 0 0 373.384 3.532 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N(CC1CCC1)[C@@H](C)CO ZINC000435859295 943811979 /nfs/dbraw/zinc/81/19/79/943811979.db2.gz WWOMCSANZHONOM-ZDUSSCGKSA-N 0 0 366.483 3.720 20 5 FHBDRN COc1ccc(C[C@@H]2CCCN(C(=O)c3ccc([N+](=O)[O-])s3)C2)cc1 ZINC000516899834 943814177 /nfs/dbraw/zinc/81/41/77/943814177.db2.gz YLHUIPMBWBGQEM-AWEZNQCLSA-N 0 0 360.435 3.760 20 5 FHBDRN CC(C)c1cccnc1NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000504818861 943814566 /nfs/dbraw/zinc/81/45/66/943814566.db2.gz MZJPWVBRKYIZCD-UHFFFAOYSA-N 0 0 354.410 3.966 20 5 FHBDRN COC(=O)c1cc(C(=O)N(CCC(C)C)C2CCCC2)cc([N+](=O)[O-])c1 ZINC000515371540 943816236 /nfs/dbraw/zinc/81/62/36/943816236.db2.gz NQBMYJMUSVRCDH-UHFFFAOYSA-N 0 0 362.426 3.812 20 5 FHBDRN CN1CCN(C(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)c2ccccc2C1 ZINC000504839837 943827117 /nfs/dbraw/zinc/82/71/17/943827117.db2.gz HXLKWDJFNYJGMS-UHFFFAOYSA-N 0 0 367.449 3.985 20 5 FHBDRN Cc1c(NC(=O)C(=O)N(CCC(C)C)C2CCCC2)cccc1[N+](=O)[O-] ZINC000437457930 943827762 /nfs/dbraw/zinc/82/77/62/943827762.db2.gz GFRZIJZAAVFFDU-UHFFFAOYSA-N 0 0 361.442 3.659 20 5 FHBDRN O=C(COc1ccc(Cc2ccccc2)cc1[N+](=O)[O-])[C@@H]1CCCOC1 ZINC000184017440 943828152 /nfs/dbraw/zinc/82/81/52/943828152.db2.gz GJXLPAJKCDODBP-QGZVFWFLSA-N 0 0 355.390 3.560 20 5 FHBDRN C[C@@H](NC(=O)COc1ccc(F)cc1Cl)c1cccc([N+](=O)[O-])c1 ZINC000053338631 943844665 /nfs/dbraw/zinc/84/46/65/943844665.db2.gz UFQYOAQWLZURJV-SNVBAGLBSA-N 0 0 352.749 3.644 20 5 FHBDRN COc1ccc(C(=O)N[C@H]2C[C@H](c3cc(F)cc(F)c3)C2)cc1[N+](=O)[O-] ZINC000437473414 943844861 /nfs/dbraw/zinc/84/48/61/943844861.db2.gz LZQGZGMSJNPTHA-NNUKFRKNSA-N 0 0 362.332 3.558 20 5 FHBDRN CC(C)c1cccnc1NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000504843075 943854035 /nfs/dbraw/zinc/85/40/35/943854035.db2.gz OCZQHVSHPDJDMB-UHFFFAOYSA-N 0 0 351.366 3.551 20 5 FHBDRN O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1Nc1ccc(COCCO)cc1 ZINC000424311478 943855609 /nfs/dbraw/zinc/85/56/09/943855609.db2.gz FJSVWVFPAJOXFO-FXAWDEMLSA-N 0 0 370.449 3.927 20 5 FHBDRN CN(CCNC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1)c1ccccc1 ZINC000435944175 943860985 /nfs/dbraw/zinc/86/09/85/943860985.db2.gz ROLJJEWUYPJABM-UHFFFAOYSA-N 0 0 371.440 3.548 20 5 FHBDRN CSc1ccc(CCNC(=O)CSc2ccc([N+](=O)[O-])cc2)cc1 ZINC000437500093 943865061 /nfs/dbraw/zinc/86/50/61/943865061.db2.gz UFIALAQBIIQHLW-UHFFFAOYSA-N 0 0 362.476 3.768 20 5 FHBDRN C[C@@H](NC(=O)N1CC2(CCC2)[C@@H]1C1CCOCC1)c1cccc([N+](=O)[O-])c1 ZINC000425420398 943867005 /nfs/dbraw/zinc/86/70/05/943867005.db2.gz SCUZDQKQPZZBHL-KDOFPFPSSA-N 0 0 373.453 3.647 20 5 FHBDRN CC[C@@H](Cc1ccccc1C)c1nc(-c2c([N+](=O)[O-])nc(C)n2C)no1 ZINC000424363043 943868197 /nfs/dbraw/zinc/86/81/97/943868197.db2.gz YRGOLHNFEMCNFC-ZDUSSCGKSA-N 0 0 355.398 3.731 20 5 FHBDRN C[C@H]1CN(C(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[C@H]1C ZINC000435935157 943869335 /nfs/dbraw/zinc/86/93/35/943869335.db2.gz BTHKMBNYXNQBLM-PHIMTYICSA-N 0 0 359.348 3.530 20 5 FHBDRN COc1ccc([C@@H]2CCN(C(=O)c3c[nH]c4cc([N+](=O)[O-])ccc34)C2)cc1 ZINC000504884440 943882779 /nfs/dbraw/zinc/88/27/79/943882779.db2.gz AKMBXOOAQOPGSQ-CQSZACIVSA-N 0 0 365.389 3.714 20 5 FHBDRN C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)N(C)CCC3CC3)cc2[N+](=O)[O-])C1 ZINC000437507755 943887429 /nfs/dbraw/zinc/88/74/29/943887429.db2.gz XGXKRCKDNOCTCE-HUUCEWRRSA-N 0 0 359.470 3.949 20 5 FHBDRN O=C(CN1CCS[C@H]2CCCC[C@H]21)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000437531024 943892323 /nfs/dbraw/zinc/89/23/23/943892323.db2.gz ZFFNEBFILLZDJD-HIFRSBDPSA-N 0 0 369.874 3.547 20 5 FHBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CCCc2occc2C1 ZINC000516992739 943896479 /nfs/dbraw/zinc/89/64/79/943896479.db2.gz KODTVMGUWJXBOZ-UHFFFAOYSA-N 0 0 365.183 3.539 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)NC2CC(C(C)(C)C)C2)cc1OC ZINC000504919067 943898134 /nfs/dbraw/zinc/89/81/34/943898134.db2.gz NNNKFAJJCAILLB-UHFFFAOYSA-N 0 0 350.415 3.557 20 5 FHBDRN Cc1nc([C@@H](C)NCc2ccc(Br)cc2[N+](=O)[O-])cs1 ZINC000425433614 943911811 /nfs/dbraw/zinc/91/18/11/943911811.db2.gz NSVZWSGNDQNMHT-MRVPVSSYSA-N 0 0 356.245 3.973 20 5 FHBDRN CO[C@]1(C)C[C@@H](N(C)C(=O)c2ccc(SC)c([N+](=O)[O-])c2)C1(C)C ZINC000436331814 943916635 /nfs/dbraw/zinc/91/66/35/943916635.db2.gz GESVNWYUDYJEQN-RHSMWYFYSA-N 0 0 352.456 3.592 20 5 FHBDRN CC(C)(C)c1ccc(N2CCC(NC(=O)c3ccc([N+](=O)[O-])o3)CC2)cc1 ZINC000053390928 943927842 /nfs/dbraw/zinc/92/78/42/943927842.db2.gz SJWSTUXYNHGMEA-UHFFFAOYSA-N 0 0 371.437 3.884 20 5 FHBDRN CC1=C[C@@H](C)CN(C(=O)c2ccc(N3CCC[C@H](C)C3)c([N+](=O)[O-])c2)C1 ZINC000436002703 943935724 /nfs/dbraw/zinc/93/57/24/943935724.db2.gz RAMDHTTYBQDMSB-LSDHHAIUSA-N 0 0 357.454 3.869 20 5 FHBDRN COC[C@@H](C)Nc1ccccc1NC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000437592080 943935905 /nfs/dbraw/zinc/93/59/05/943935905.db2.gz KODQGXKYZFBRJX-LLVKDONJSA-N 0 0 363.801 3.947 20 5 FHBDRN COc1ccc(C)cc1CCNc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-] ZINC000105433657 943939336 /nfs/dbraw/zinc/93/93/36/943939336.db2.gz JXILVNJDSXZRRK-UHFFFAOYSA-N 0 0 371.437 3.705 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2noc(-c3ccn(-c4ccccc4F)n3)n2)c1 ZINC000504968293 943943657 /nfs/dbraw/zinc/94/36/57/943943657.db2.gz DHCPXASTOUGXKZ-UHFFFAOYSA-N 0 0 351.297 3.637 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1CN1CCC[C@@H]1[C@H]1CCCO1 ZINC000425444418 943953101 /nfs/dbraw/zinc/95/31/01/943953101.db2.gz NOUKWSQAGZTQKY-UKRRQHHQSA-N 0 0 355.232 3.501 20 5 FHBDRN CCCN(C(=O)c1cccc(OC)c1[N+](=O)[O-])[C@@H]1CCCc2cccnc21 ZINC000436014986 943953336 /nfs/dbraw/zinc/95/33/36/943953336.db2.gz GFBRKESLIHEGKI-MRXNPFEDSA-N 0 0 369.421 3.928 20 5 FHBDRN C/C(=C/c1ccccc1)CN(C)C(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000566527238 943963260 /nfs/dbraw/zinc/96/32/60/943963260.db2.gz UAOKGAXMEDYSBS-JYRVWZFOSA-N 0 0 360.360 3.977 20 5 FHBDRN O=C(N[C@H]1C[C@H]1c1ccccc1)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000436049402 943972494 /nfs/dbraw/zinc/97/24/94/943972494.db2.gz XNJGBGZXPBRSCP-UWJYYQICSA-N 0 0 354.409 3.967 20 5 FHBDRN COc1cccc(C(=O)N2[C@H](C)c3ccc(F)cc3C[C@@H]2C)c1[N+](=O)[O-] ZINC000436054378 943995665 /nfs/dbraw/zinc/99/56/65/943995665.db2.gz VJYKMRLRFWCZKM-NWDGAFQWSA-N 0 0 358.369 3.891 20 5 FHBDRN CC(=O)Nc1cccc(CC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1 ZINC000424606050 944004220 /nfs/dbraw/zinc/00/42/20/944004220.db2.gz IYTWTBWGOFQHEX-UHFFFAOYSA-N 0 0 369.421 3.533 20 5 FHBDRN CCOc1cccc([C@@H]2C[C@H]2NC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000437638558 944005153 /nfs/dbraw/zinc/00/51/53/944005153.db2.gz YKSMUEGHONZZTN-FASAQXTFSA-N 0 0 369.421 3.910 20 5 FHBDRN Cc1ccc(F)c(CN(C)C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)c1 ZINC000436074474 944008615 /nfs/dbraw/zinc/00/86/15/944008615.db2.gz KIBROUKDNDFPKJ-UHFFFAOYSA-N 0 0 368.368 3.500 20 5 FHBDRN COc1ccccc1SC[C@@H](C)CNC(=O)c1ccc([N+](=O)[O-])s1 ZINC000505048139 944010051 /nfs/dbraw/zinc/01/00/51/944010051.db2.gz LTCKRGGTFYWUIA-NSHDSACASA-N 0 0 366.464 3.823 20 5 FHBDRN C[C@H]1CCc2ccccc2N1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000506095589 944014446 /nfs/dbraw/zinc/01/44/46/944014446.db2.gz NTRBNLAYRSBFPV-ZDUSSCGKSA-N 0 0 350.378 3.986 20 5 FHBDRN CC(C)c1cnc(NC(=O)c2cc([N+](=O)[O-])ccc2SCCO)s1 ZINC000137276769 944014682 /nfs/dbraw/zinc/01/46/82/944014682.db2.gz ZHGYPLWLOIOQCP-UHFFFAOYSA-N 0 0 367.452 3.511 20 5 FHBDRN CC(C)[C@H](C(=O)[O-])[C@@H](C)[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000424621540 944016286 /nfs/dbraw/zinc/01/62/86/944016286.db2.gz OBPZEGVGCFXVGU-ABAIWWIYSA-N 0 0 363.439 3.553 20 5 FHBDRN CCOc1ccc(NC(=O)CNc2c(C)cccc2CC)c([N+](=O)[O-])c1 ZINC000506093065 944020524 /nfs/dbraw/zinc/02/05/24/944020524.db2.gz HXOBQRQEVNQJQF-UHFFFAOYSA-N 0 0 357.410 3.915 20 5 FHBDRN CCCc1[nH]nc(-c2nc(-c3nccc4ccccc43)no2)c1[N+](=O)[O-] ZINC000436099451 944028916 /nfs/dbraw/zinc/02/89/16/944028916.db2.gz MDACBERPXPTGFC-UHFFFAOYSA-N 0 0 350.338 3.536 20 5 FHBDRN COc1ccc(CC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)c(F)c1 ZINC000436114123 944029743 /nfs/dbraw/zinc/02/97/43/944029743.db2.gz XXXMDHHDOCIWJT-UHFFFAOYSA-N 0 0 370.283 3.525 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2noc(CN(Cc3ccccc3F)C3CC3)n2)c1 ZINC000506104419 944031111 /nfs/dbraw/zinc/03/11/11/944031111.db2.gz UXKIYWNDPZPNSD-UHFFFAOYSA-N 0 0 368.368 3.949 20 5 FHBDRN Cc1ccc(C(=O)N[C@H](c2nccs2)c2ccccc2)cc1[N+](=O)[O-] ZINC000505092099 944032735 /nfs/dbraw/zinc/03/27/35/944032735.db2.gz FUXOKPPYHNUSCM-INIZCTEOSA-N 0 0 353.403 3.879 20 5 FHBDRN O=C(NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N[C@@H]1CCC[C@@H](F)C1 ZINC000517133952 944033936 /nfs/dbraw/zinc/03/39/36/944033936.db2.gz IUJALNVVUDBGBD-VXGBXAGGSA-N 0 0 363.311 3.694 20 5 FHBDRN O=C(NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N[C@@H]1CCC[C@H](F)C1 ZINC000517133949 944034041 /nfs/dbraw/zinc/03/40/41/944034041.db2.gz IUJALNVVUDBGBD-NWDGAFQWSA-N 0 0 363.311 3.694 20 5 FHBDRN C[C@]1(c2ccccc2)CCCN(c2ccc(C(N)=O)cc2[N+](=O)[O-])CC1 ZINC000566553229 944033971 /nfs/dbraw/zinc/03/39/71/944033971.db2.gz KXESJZLPTYQYDV-FQEVSTJZSA-N 0 0 353.422 3.642 20 5 FHBDRN C[C@@H](c1ccc(F)c(F)c1)N(C)C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000126558445 944039556 /nfs/dbraw/zinc/03/95/56/944039556.db2.gz ZOHDLCOCEGKBAU-LBPRGKRZSA-N 0 0 363.364 3.818 20 5 FHBDRN CCC[C@]1(C)CCCN(S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000437707564 944049493 /nfs/dbraw/zinc/04/94/93/944049493.db2.gz ZOQJYCGNHWVANK-OAHLLOKOSA-N 0 0 360.863 3.839 20 5 FHBDRN O=C1c2ccc([N+](=O)[O-])cc2C(=O)N1Cc1nc(C2CCCCC2)cs1 ZINC000436142689 944053696 /nfs/dbraw/zinc/05/36/96/944053696.db2.gz RJOLTPOYDJWUSZ-UHFFFAOYSA-N 0 0 371.418 3.895 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)ccc1CNCc1ccnc(N2CCCCC2)c1 ZINC000893329932 944055410 /nfs/dbraw/zinc/05/54/10/944055410.db2.gz VIYFLXGZMQTDGM-UHFFFAOYSA-N 0 0 360.845 3.923 20 5 FHBDRN CC(C)NC(=O)c1ccc(NC[C@H](C)Oc2ccccc2)c([N+](=O)[O-])c1 ZINC000505764115 944056004 /nfs/dbraw/zinc/05/60/04/944056004.db2.gz UTTLYSABMXOUEN-AWEZNQCLSA-N 0 0 357.410 3.612 20 5 FHBDRN Cc1ccc(C2CC2)c(C(=O)N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000424671203 944056241 /nfs/dbraw/zinc/05/62/41/944056241.db2.gz GMLWYDZCPUICBO-HNNXBMFYSA-N 0 0 366.421 3.502 20 5 FHBDRN COc1cc(F)c([N+](=O)[O-])c(Nc2ccc(CN3CCCC3=O)cc2)c1 ZINC000092612265 944062413 /nfs/dbraw/zinc/06/24/13/944062413.db2.gz RTPDCEBBQUNLIV-UHFFFAOYSA-N 0 0 359.357 3.609 20 5 FHBDRN CC(C)c1ccccc1OCC(=O)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000515625228 944074851 /nfs/dbraw/zinc/07/48/51/944074851.db2.gz PWKRTNCYZHGRMX-UHFFFAOYSA-N 0 0 356.422 3.798 20 5 FHBDRN C[C@H](c1ccccc1)[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])c(C(=O)[O-])c2)C1 ZINC000515655496 944080192 /nfs/dbraw/zinc/08/01/92/944080192.db2.gz JVXLVCOVDGTSGW-CJNGLKHVSA-N 0 0 355.394 3.540 20 5 FHBDRN C[C@@H]1[C@@H](Cc2ccccc2)CCN1C(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000473040789 944083425 /nfs/dbraw/zinc/08/34/25/944083425.db2.gz FJQBLLZCMRRYNL-VQIMIIECSA-N 0 0 367.449 3.800 20 5 FHBDRN CC[C@H](C)[C@H](NC(=O)CSc1ccccc1[N+](=O)[O-])C(F)(F)F ZINC000436173274 944085669 /nfs/dbraw/zinc/08/56/69/944085669.db2.gz RLLKSSFIQZBBKZ-ZANVPECISA-N 0 0 350.362 3.780 20 5 FHBDRN O=C(NC1(c2ccc(Cl)cc2)CCOCC1)c1ccc([N+](=O)[O-])cc1 ZINC000505161734 944087874 /nfs/dbraw/zinc/08/78/74/944087874.db2.gz DENZDFRMVPWRCP-UHFFFAOYSA-N 0 0 360.797 3.684 20 5 FHBDRN O=C(Cc1nsc2ccccc21)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000424730833 944091505 /nfs/dbraw/zinc/09/15/05/944091505.db2.gz FGVPCFSVPYKUQQ-UHFFFAOYSA-N 0 0 367.430 3.938 20 5 FHBDRN CC[C@@H](C)[C@@H](NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)C(F)(F)F ZINC000436182608 944093469 /nfs/dbraw/zinc/09/34/69/944093469.db2.gz HBNCSZRYLBPOKH-RDDDGLTNSA-N 0 0 370.274 3.903 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CCN(C)C[C@H]1c1ccccc1 ZINC000517214669 944096087 /nfs/dbraw/zinc/09/60/87/944096087.db2.gz AMFOFAWJVRNIBM-SFHVURJKSA-N 0 0 368.437 3.732 20 5 FHBDRN COC(=O)c1ccc(C(=O)COc2ccc([N+](=O)[O-])c3ccccc23)cc1 ZINC000436203925 944098502 /nfs/dbraw/zinc/09/85/02/944098502.db2.gz QHJAVXIQKMQBAT-UHFFFAOYSA-N 0 0 365.341 3.796 20 5 FHBDRN CC(C)[C@H](NC(=O)N1CCOc2ccc([N+](=O)[O-])cc2C1)c1ccccc1 ZINC000517208335 944107490 /nfs/dbraw/zinc/10/74/90/944107490.db2.gz GDBAHTGZCUJTCH-IBGZPJMESA-N 0 0 369.421 3.896 20 5 FHBDRN CCOc1cc(NCCc2nc3ccc(F)cc3n2C)ccc1[N+](=O)[O-] ZINC000092656000 944123599 /nfs/dbraw/zinc/12/35/99/944123599.db2.gz IGEDKGIXJSDGLN-UHFFFAOYSA-N 0 0 358.373 3.674 20 5 FHBDRN C[C@H](Nc1ccc(C(=O)NCC2CCC2)cc1[N+](=O)[O-])c1ccccn1 ZINC000053479102 944124544 /nfs/dbraw/zinc/12/45/44/944124544.db2.gz XQEVJQIUMVWRNI-ZDUSSCGKSA-N 0 0 354.410 3.693 20 5 FHBDRN Cc1ccc([C@H]2CCCN2S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)cc1 ZINC000515709164 944134072 /nfs/dbraw/zinc/13/40/72/944134072.db2.gz PFZGGHZYEBWZTO-MRXNPFEDSA-N 0 0 364.398 3.568 20 5 FHBDRN Cc1ccc(C)c(N(C)S(=O)(=O)c2cc(Cl)c(C)c([N+](=O)[O-])c2)c1 ZINC000515695487 944136517 /nfs/dbraw/zinc/13/65/17/944136517.db2.gz CKSABOHIBUMYGJ-UHFFFAOYSA-N 0 0 368.842 3.999 20 5 FHBDRN Cc1ccc(-c2csc(NC(=O)Cc3cccnc3C)n2)cc1[N+](=O)[O-] ZINC000517257442 944152437 /nfs/dbraw/zinc/15/24/37/944152437.db2.gz PEHKHRJPQLNQNR-UHFFFAOYSA-N 0 0 368.418 3.911 20 5 FHBDRN COCCN(C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)[C@H](C)c1ccccc1 ZINC000500136010 944153007 /nfs/dbraw/zinc/15/30/07/944153007.db2.gz LJIKJSRWTCJHJX-CQSZACIVSA-N 0 0 367.405 3.926 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)CCCc1ccc2c(c1)CC(=O)N2 ZINC000129378376 944154276 /nfs/dbraw/zinc/15/42/76/944154276.db2.gz GTWINCZMSKAGRY-UHFFFAOYSA-N 0 0 367.405 3.668 20 5 FHBDRN CCCSc1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-] ZINC000515724320 944155044 /nfs/dbraw/zinc/15/50/44/944155044.db2.gz YSFSZAUOLGTYKG-UHFFFAOYSA-N 0 0 358.485 3.662 20 5 FHBDRN O=C(Nc1ccc(F)cc1)C1(c2nc(-c3ccc([N+](=O)[O-])s3)no2)CC1 ZINC000517274924 944161712 /nfs/dbraw/zinc/16/17/12/944161712.db2.gz PLBDCPFVNBWKFY-UHFFFAOYSA-N 0 0 374.353 3.516 20 5 FHBDRN CN(C)c1ccc(Cl)cc1NC(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000105553740 944162252 /nfs/dbraw/zinc/16/22/52/944162252.db2.gz JCKDEMBITYNPKF-UHFFFAOYSA-N 0 0 362.817 3.755 20 5 FHBDRN Cc1ccccc1N1CCN(c2cc(C(F)(F)F)ncc2[N+](=O)[O-])CC1 ZINC000436269681 944167649 /nfs/dbraw/zinc/16/76/49/944167649.db2.gz LTIVFZTYCCUYEH-UHFFFAOYSA-N 0 0 366.343 3.644 20 5 FHBDRN C[C@]1(CNC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)OCCc2sccc21 ZINC000517267156 944169981 /nfs/dbraw/zinc/16/99/81/944169981.db2.gz FUUIZEPZHIQRBJ-MRXNPFEDSA-N 0 0 366.826 3.528 20 5 FHBDRN Cc1c(NC(=O)[C@H](C)N2CC[C@@H]2Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000437839594 944171588 /nfs/dbraw/zinc/17/15/88/944171588.db2.gz UZSWBAXAFLOTTN-DOTOQJQBSA-N 0 0 353.422 3.547 20 5 FHBDRN COc1ccc([C@H](C)N(C)C(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)cc1 ZINC000515748693 944176599 /nfs/dbraw/zinc/17/65/99/944176599.db2.gz JULOGHABSTWTCU-LBPRGKRZSA-N 0 0 353.378 3.918 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2ccc(CN3CCN(Cc4ccco4)CC3)o2)c1 ZINC000506151686 944180004 /nfs/dbraw/zinc/18/00/04/944180004.db2.gz RUNSKDIHRGBVGO-UHFFFAOYSA-N 0 0 367.405 3.766 20 5 FHBDRN O=C(NC[C@H]1CC=CCC1)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000436304933 944188729 /nfs/dbraw/zinc/18/87/29/944188729.db2.gz FKGZVXPEVDMBLW-ZDUSSCGKSA-N 0 0 350.393 3.907 20 5 FHBDRN COCCOc1cccc(CNc2cc(C(F)(F)F)ncc2[N+](=O)[O-])c1 ZINC000436312383 944190964 /nfs/dbraw/zinc/19/09/64/944190964.db2.gz ZOHBYZDLYFHMKC-UHFFFAOYSA-N 0 0 371.315 3.646 20 5 FHBDRN O=C(Nc1nnc(C(F)F)s1)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000436307961 944205791 /nfs/dbraw/zinc/20/57/91/944205791.db2.gz ACBOQOKPUULORJ-UHFFFAOYSA-N 0 0 372.356 3.723 20 5 FHBDRN Cc1[nH]nc2ncc(NC(=O)c3ccc4[nH]c5ccccc5c(=O)c4c3)cc12 ZINC000436310233 944206666 /nfs/dbraw/zinc/20/66/66/944206666.db2.gz QTNKWZICHXCUEY-UHFFFAOYSA-N 0 0 369.384 3.513 20 5 FHBDRN Cn1c(CNc2c3c(ccc2[N+](=O)[O-])NCC3)nc2cccc(Cl)c21 ZINC000436344566 944220677 /nfs/dbraw/zinc/22/06/77/944220677.db2.gz LHZKGDGSLQOTDM-UHFFFAOYSA-N 0 0 357.801 3.715 20 5 FHBDRN COc1ccc(NC(=O)c2csc(-c3ccccc3)n2)c([N+](=O)[O-])c1 ZINC000500180551 944223354 /nfs/dbraw/zinc/22/33/54/944223354.db2.gz PGVKZACHRFQUSX-UHFFFAOYSA-N 0 0 355.375 3.979 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(-c2nc([C@H](c3ccccc3C)C(C)C)no2)n1 ZINC000517349297 944235516 /nfs/dbraw/zinc/23/55/16/944235516.db2.gz PABVSKKFYQTICS-HNNXBMFYSA-N 0 0 355.398 3.958 20 5 FHBDRN COc1cc(CN(C)C(=O)c2cc(F)cc([N+](=O)[O-])c2)ccc1SC ZINC000518286201 944236458 /nfs/dbraw/zinc/23/64/58/944236458.db2.gz NSVHEHRTVYRYAL-UHFFFAOYSA-N 0 0 364.398 3.737 20 5 FHBDRN CC(C)N(CC(=O)N[C@@H](C)c1ccc(F)cc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000140801739 944241329 /nfs/dbraw/zinc/24/13/29/944241329.db2.gz RQNVGDMWMLHTHK-HNNXBMFYSA-N 0 0 373.428 3.822 20 5 FHBDRN CC[C@@H](CNc1ncc([N+](=O)[O-])cn1)Oc1cccc(C(F)(F)F)c1 ZINC000515821819 944241905 /nfs/dbraw/zinc/24/19/05/944241905.db2.gz JDUIBJZEGYBNTD-LBPRGKRZSA-N 0 0 356.304 3.673 20 5 FHBDRN Cc1cc(C)cc([C@@H]2CCN(S(=O)(=O)Cc3ccccc3[N+](=O)[O-])C2)c1 ZINC000546073418 944243656 /nfs/dbraw/zinc/24/36/56/944243656.db2.gz LKLXVPLGBNFNNU-MRXNPFEDSA-N 0 0 374.462 3.531 20 5 FHBDRN CC(C)(C)c1ncc(C=CC(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)s1 ZINC000759790508 944247838 /nfs/dbraw/zinc/24/78/38/944247838.db2.gz PXMNHDSPDWZVME-ALCCZGGFSA-N 0 0 371.422 3.877 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)F)cc1NCc1ccc2c(c1)OCCCO2 ZINC000436382423 944251825 /nfs/dbraw/zinc/25/18/25/944251825.db2.gz ADMWZTLZAOQIQZ-UHFFFAOYSA-N 0 0 369.299 3.782 20 5 FHBDRN O=C(Nc1ccc(-n2ccnc2)c(F)c1)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000518294028 944255475 /nfs/dbraw/zinc/25/54/75/944255475.db2.gz QVWUYGRSLOEOGE-UHFFFAOYSA-N 0 0 366.308 3.918 20 5 FHBDRN CCC(=O)Nc1cccc(CNC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000515845997 944263894 /nfs/dbraw/zinc/26/38/94/944263894.db2.gz BJVXFLUSQQVQAB-ZDUSSCGKSA-N 0 0 370.409 3.504 20 5 FHBDRN COc1cc(C)c(NC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)cc1C ZINC000436395261 944271644 /nfs/dbraw/zinc/27/16/44/944271644.db2.gz XQSPXZWSSWJSIT-UHFFFAOYSA-N 0 0 366.377 3.658 20 5 FHBDRN O=C(NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N[C@@H]1CC12CCCC2 ZINC000426263297 944279708 /nfs/dbraw/zinc/27/97/08/944279708.db2.gz KUJWVQOCPSSGQR-CYBMUJFWSA-N 0 0 357.332 3.746 20 5 FHBDRN Cc1cccnc1/C=C\C(=O)OCc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000759795861 944281207 /nfs/dbraw/zinc/28/12/07/944281207.db2.gz HMYPDNUDJBQPND-HJWRWDBZSA-N 0 0 365.345 3.710 20 5 FHBDRN Cc1ccc(NC(=O)c2ccc(NC[C@H]3CC[C@@H](O)C3)c([N+](=O)[O-])c2)cc1 ZINC000473714122 944285478 /nfs/dbraw/zinc/28/54/78/944285478.db2.gz BCKSKPWSKLBIPS-WMLDXEAASA-N 0 0 369.421 3.728 20 5 FHBDRN COc1ccccc1O[C@@H](C)CNc1cc(C(F)(F)F)ncc1[N+](=O)[O-] ZINC000436414433 944285823 /nfs/dbraw/zinc/28/58/23/944285823.db2.gz VBMWRHWHDNNBBI-JTQLQIEISA-N 0 0 371.315 3.897 20 5 FHBDRN O=[N+]([O-])c1cccc(OCCSCc2nc(Cc3ccccc3)no2)c1 ZINC000105628817 944293566 /nfs/dbraw/zinc/29/35/66/944293566.db2.gz AIMDJWJUJORNCU-UHFFFAOYSA-N 0 0 371.418 3.881 20 5 FHBDRN COC(=O)c1ccc(-c2noc(/C=C\c3cccc([N+](=O)[O-])c3)n2)cc1 ZINC000518335710 944294248 /nfs/dbraw/zinc/29/42/48/944294248.db2.gz YBLWIBIQTMGZSU-YHYXMXQVSA-N 0 0 351.318 3.602 20 5 FHBDRN O=C(c1cccc2c(=O)c3cccc(F)c3[nH]c12)N1Cc2ccccc2C1 ZINC000436421724 944294880 /nfs/dbraw/zinc/29/48/80/944294880.db2.gz JWMQQCDJJKOQKO-UHFFFAOYSA-N 0 0 358.372 3.976 20 5 FHBDRN O=[N+]([O-])c1cccc(F)c1CN1CCO[C@H](c2ccc(Cl)cc2)C1 ZINC000505816632 944304961 /nfs/dbraw/zinc/30/49/61/944304961.db2.gz ZHHOATLZEPLIMO-KRWDZBQOSA-N 0 0 350.777 3.961 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)c1ccc(SC2CC2)cc1 ZINC000544307586 944306352 /nfs/dbraw/zinc/30/63/52/944306352.db2.gz GXUGTNQUYIKTMF-UHFFFAOYSA-N 0 0 358.419 3.788 20 5 FHBDRN Cn1cnc([N+](=O)[O-])c1N(Cc1cccc(Br)c1)CC1CC1 ZINC000473721511 944307842 /nfs/dbraw/zinc/30/78/42/944307842.db2.gz KRQWKHPNYNGULK-UHFFFAOYSA-N 0 0 365.231 3.507 20 5 FHBDRN O=C(N[C@H]1C[C@H](c2ccccc2F)C1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000438042997 944308292 /nfs/dbraw/zinc/30/82/92/944308292.db2.gz SBVIXOBDHHKUKU-KOMQPUFPSA-N 0 0 369.396 3.748 20 5 FHBDRN C[C@@H]1CCN(C(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C[C@@H]1C ZINC000426273822 944317906 /nfs/dbraw/zinc/31/79/06/944317906.db2.gz ABMAETVLTLYAMT-MNOVXSKESA-N 0 0 359.348 3.801 20 5 FHBDRN O=C([C@@H]1Cc2ccccc2O1)N(c1cccc([N+](=O)[O-])c1)C1CCCC1 ZINC000518359210 944319928 /nfs/dbraw/zinc/31/99/28/944319928.db2.gz CXOSKNLAEORWEK-IBGZPJMESA-N 0 0 352.390 3.874 20 5 FHBDRN CCCc1nc(CSCc2ccc(C(N)=O)cc2[N+](=O)[O-])cs1 ZINC000105630879 944320422 /nfs/dbraw/zinc/32/04/22/944320422.db2.gz ZMVPLUXOJUDTIA-UHFFFAOYSA-N 0 0 351.453 3.536 20 5 FHBDRN C[C@@H](NC(=O)N1CC=C(c2ccc(O)cc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000515904468 944320656 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C[C@H](NC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)[C@H]1Oc2ccccc2[C@H]1C ZINC000438389415 944556076 /nfs/dbraw/zinc/55/60/76/944556076.db2.gz FOEXIHZDKXFDEX-UFYHVXEKSA-N 0 0 365.389 3.759 20 5 FHBDRN CC[C@@H]1CN(C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CCCO1 ZINC000439383231 944575718 /nfs/dbraw/zinc/57/57/18/944575718.db2.gz HVCZMFXPZGCCMX-LLVKDONJSA-N 0 0 361.320 3.646 20 5 FHBDRN CCc1nc(CN(C)C(=O)c2ccc(SC)c([N+](=O)[O-])c2)cs1 ZINC000518652573 944578248 /nfs/dbraw/zinc/57/82/48/944578248.db2.gz MJQQTXAIWMJHTG-UHFFFAOYSA-N 0 0 351.453 3.608 20 5 FHBDRN COc1ccc(NC(=O)N[C@H]2C[C@H](c3ccccc3C)C2)cc1[N+](=O)[O-] ZINC000439387362 944579020 /nfs/dbraw/zinc/57/90/20/944579020.db2.gz NZGKUEKDNFTWCT-CTYIDZIISA-N 0 0 355.394 3.980 20 5 FHBDRN O=C(Cn1ccc([N+](=O)[O-])n1)Nc1ccccc1Oc1ccc(Cl)cc1 ZINC000518656654 944581108 /nfs/dbraw/zinc/58/11/08/944581108.db2.gz FRBYXKDRJCJUDC-UHFFFAOYSA-N 0 0 372.768 3.876 20 5 FHBDRN CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)c1cc(Br)c[nH]1 ZINC000140240444 944582311 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Cc1c(F)ccc([N+](=O)[O-])c1C(=O)N(C)Cc1ccccc1N1CCCC1 ZINC000843758918 944592250 /nfs/dbraw/zinc/59/22/50/944592250.db2.gz ZAXIWZOOVXPEGN-UHFFFAOYSA-N 0 0 371.412 3.915 20 5 FHBDRN CCOC(=O)CC1CCN(C(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)CC1 ZINC000439421648 944593314 /nfs/dbraw/zinc/59/33/14/944593314.db2.gz OEPJJWNUTNWHMI-UHFFFAOYSA-N 0 0 362.426 3.524 20 5 FHBDRN Cc1ccccc1CN(Cc1cc([N+](=O)[O-])cc2c1OCOC2)C1CC1 ZINC000506570947 944598256 /nfs/dbraw/zinc/59/82/56/944598256.db2.gz OWHCSAZIDLPJOL-UHFFFAOYSA-N 0 0 354.406 3.934 20 5 FHBDRN CC(C)CCN(CCC(C)C)C(=O)COc1c(Cl)cncc1[N+](=O)[O-] ZINC000506568563 944605306 /nfs/dbraw/zinc/60/53/06/944605306.db2.gz PNOCOSRJUHFFLM-UHFFFAOYSA-N 0 0 371.865 3.943 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N(C)[C@@H](C)c1c(F)cccc1F ZINC000518691555 944607666 /nfs/dbraw/zinc/60/76/66/944607666.db2.gz KYWDRALZLKLFID-NSHDSACASA-N 0 0 370.377 3.563 20 5 FHBDRN O=[N+]([O-])c1cncc(Cl)c1OCc1nnc(-c2ccccc2Cl)o1 ZINC000506576244 944611637 /nfs/dbraw/zinc/61/16/37/944611637.db2.gz DDOMRCHQZZPDFM-UHFFFAOYSA-N 0 0 367.148 3.926 20 5 FHBDRN O=C(Nc1c(F)cccc1Br)c1cc(F)cc([N+](=O)[O-])c1 ZINC000438447049 944612912 /nfs/dbraw/zinc/61/29/12/944612912.db2.gz WJDBWBUPABECFI-UHFFFAOYSA-N 0 0 357.110 3.888 20 5 FHBDRN CCCOc1cccc(Cc2nc(-c3ccc(N)c([N+](=O)[O-])c3)no2)c1 ZINC000545549346 944617567 /nfs/dbraw/zinc/61/75/67/944617567.db2.gz DVVYUUKMWFSAPP-UHFFFAOYSA-N 0 0 354.366 3.607 20 5 FHBDRN CCc1cc(N[C@H](CCO)c2ccco2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000184346864 944630038 /nfs/dbraw/zinc/63/00/38/944630038.db2.gz UFVHSVJVAPJEHK-MRXNPFEDSA-N 0 0 368.393 3.743 20 5 FHBDRN CC(C)(C)c1ncc(/C=C\C(=O)NCCc2cccc([N+](=O)[O-])c2)s1 ZINC000759871105 944644694 /nfs/dbraw/zinc/64/46/94/944644694.db2.gz VDTHBCIZNSVATJ-FPLPWBNLSA-N 0 0 359.451 3.721 20 5 FHBDRN CCn1cc(N(CC(C)C)C(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2)cn1 ZINC000909327126 944655963 /nfs/dbraw/zinc/65/59/63/944655963.db2.gz ARIBTEZRXAEWRA-UHFFFAOYSA-N 0 0 368.796 3.907 20 5 FHBDRN CN(CC(=O)NC[C@@H]1CCC[C@@H](C(F)(F)F)C1)c1ccccc1[N+](=O)[O-] ZINC000438478178 944656834 /nfs/dbraw/zinc/65/68/34/944656834.db2.gz VQWFAKMKLZPIND-CHWSQXEVSA-N 0 0 373.375 3.516 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1[C@H](C)NCc1ccncc1OCC(F)F ZINC000519581006 944666805 /nfs/dbraw/zinc/66/68/05/944666805.db2.gz CSSULSRAESHTJY-LBPRGKRZSA-N 0 0 351.353 3.793 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000438474282 944675364 /nfs/dbraw/zinc/67/53/64/944675364.db2.gz UYUFMCJFJFAZNU-GHMZBOCLSA-N 0 0 360.332 3.702 20 5 FHBDRN C[C@H](NC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F)c1ccc2n[nH]cc2c1 ZINC000516300705 944685469 /nfs/dbraw/zinc/68/54/69/944685469.db2.gz HCGSVZBMHXTMGN-NSHDSACASA-N 0 0 370.384 3.765 20 5 FHBDRN CCOc1cc(C(=O)N(CC(C)C)CC(C)C)c([N+](=O)[O-])cc1OC ZINC000073519733 944689489 /nfs/dbraw/zinc/68/94/89/944689489.db2.gz YGEJZZQXYXFLFC-UHFFFAOYSA-N 0 0 352.431 3.756 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)c2ccc3c(c2)C(C)(C)C(=O)N3)cc1[N+](=O)[O-] ZINC000426675740 944690045 /nfs/dbraw/zinc/69/00/45/944690045.db2.gz VTGRQQNMFMMARY-GFCCVEGCSA-N 0 0 367.405 3.624 20 5 FHBDRN O=C([O-])[C@@H](Cc1ccccc1)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000426679851 944693746 /nfs/dbraw/zinc/69/37/46/944693746.db2.gz YGAIJNGVYCXAFJ-GOSISDBHSA-N 0 0 366.373 3.640 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@]1(O)CCCC(C)(C)C1 ZINC000438501733 944697656 /nfs/dbraw/zinc/69/76/56/944697656.db2.gz MFDYYSUDRKHWFA-ACJLOTCBSA-N 0 0 366.483 3.523 20 5 FHBDRN C[C@H]1c2cc(Cl)cc(Cl)c2CCN1CCn1cc([N+](=O)[O-])cn1 ZINC000438513869 944703625 /nfs/dbraw/zinc/70/36/25/944703625.db2.gz LGPLGPKFCYMNTB-JTQLQIEISA-N 0 0 355.225 3.717 20 5 FHBDRN Cc1nc(CC[NH2+]Cc2ccc(C(C)C)c([N+](=O)[O-])c2)sc1C(=O)[O-] ZINC000426702619 944704473 /nfs/dbraw/zinc/70/44/73/944704473.db2.gz BWAMDVXFFBTPLF-UHFFFAOYSA-N 0 0 363.439 3.514 20 5 FHBDRN Cc1ccc(C[NH2+]C[C@@H](CC(=O)[O-])c2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000426714989 944715065 /nfs/dbraw/zinc/71/50/65/944715065.db2.gz OYPLGGWRHNVPCX-OAHLLOKOSA-N 0 0 362.813 3.905 20 5 FHBDRN O=C([O-])c1coc(C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)c1 ZINC000426713260 944715221 /nfs/dbraw/zinc/71/52/21/944715221.db2.gz DDTUUSKDUHTMAK-UHFFFAOYSA-N 0 0 358.375 3.904 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H](C)[C@H]1Oc2ccccc2[C@@H]1C ZINC000438507623 944717145 /nfs/dbraw/zinc/71/71/45/944717145.db2.gz UIPDUIBSXCOBKG-IUUKEHGRSA-N 0 0 371.393 3.678 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])c1cnc(-c2ccccc2F)s1 ZINC000516316549 944719639 /nfs/dbraw/zinc/71/96/39/944719639.db2.gz MNFWCFDOVKIKAU-UHFFFAOYSA-N 0 0 357.366 3.787 20 5 FHBDRN CC(C)Oc1ccc(Cl)cc1NC(=O)c1cc([O-])cc([N+](=O)[O-])c1 ZINC000426724740 944726282 /nfs/dbraw/zinc/72/62/82/944726282.db2.gz VJVDZIWVDRNKHL-UHFFFAOYSA-N 0 0 350.758 3.993 20 5 FHBDRN CC(C)(c1ccccc1)S(=O)(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000506909812 944727124 /nfs/dbraw/zinc/72/71/24/944727124.db2.gz RJEHMYAHTGHGDZ-UHFFFAOYSA-N 0 0 355.362 3.723 20 5 FHBDRN COc1cc(/C=C\c2ccc([N+](=O)[O-])cn2)cc(Br)c1O ZINC000439524363 944727809 /nfs/dbraw/zinc/72/78/09/944727809.db2.gz ZAVQQVFQFOSHFN-IHWYPQMZSA-N 0 0 351.156 3.637 20 5 FHBDRN C[C@]1(C(=O)[O-])CCCC[C@@H]1[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000426729001 944737109 /nfs/dbraw/zinc/73/71/09/944737109.db2.gz ZDKNPURPEBKPFZ-HKUYNNGSSA-N 0 0 358.394 3.978 20 5 FHBDRN O=[N+]([O-])c1c(N2CCCn3c(cc4ccccc43)C2)nc2sccn21 ZINC000516337337 944738688 /nfs/dbraw/zinc/73/86/88/944738688.db2.gz GWXQRUATMIDMRU-UHFFFAOYSA-N 0 0 353.407 3.669 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1CNc1cnn(-c2ccccc2F)c1C ZINC000506267027 944741650 /nfs/dbraw/zinc/74/16/50/944741650.db2.gz CKAZAJGUMHNEDN-UHFFFAOYSA-N 0 0 356.357 3.849 20 5 FHBDRN O=C(Nc1nc(C(F)(F)F)c[nH]1)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000506916032 944745255 /nfs/dbraw/zinc/74/52/55/944745255.db2.gz IFDFKKQWJKEMDN-UHFFFAOYSA-N 0 0 372.306 3.676 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCC[C@@H]1c1cccc(F)c1 ZINC000053717764 944747362 /nfs/dbraw/zinc/74/73/62/944747362.db2.gz PFUHAMHLRCKDJU-QGZVFWFLSA-N 0 0 373.384 3.518 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N(CCc2ccccc2)CC(C)C)c1 ZINC000517871655 944748909 /nfs/dbraw/zinc/74/89/09/944748909.db2.gz QTUOCHMUVHLEMS-UHFFFAOYSA-N 0 0 356.422 3.944 20 5 FHBDRN CC[C@H](C)[C@@H](NC(=O)Cc1ccccc1[N+](=O)[O-])c1nc2ccccc2[nH]1 ZINC000047174021 944757085 /nfs/dbraw/zinc/75/70/85/944757085.db2.gz LQUGESLYSSEOLD-ORAYPTAESA-N 0 0 366.421 3.917 20 5 FHBDRN C[C@H](c1ccc(F)cc1)S(=O)(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000506925662 944757488 /nfs/dbraw/zinc/75/74/88/944757488.db2.gz JCLCIOJATQLGJR-SECBINFHSA-N 0 0 359.325 3.688 20 5 FHBDRN O=[N+]([O-])c1cc(F)ccc1N1CCC(n2cc(Br)cn2)CC1 ZINC000609463941 944766137 /nfs/dbraw/zinc/76/61/37/944766137.db2.gz DQZXQZVBAFGVRK-UHFFFAOYSA-N 0 0 369.194 3.534 20 5 FHBDRN O=C(NCc1ccccc1OCC(F)(F)F)c1cc(F)cc([N+](=O)[O-])c1 ZINC000518788124 944769117 /nfs/dbraw/zinc/76/91/17/944769117.db2.gz MWKYBTAIQSXEKC-UHFFFAOYSA-N 0 0 372.274 3.605 20 5 FHBDRN O=C1[C@H](Oc2ccc(F)c(Cl)c2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000518791488 944772548 /nfs/dbraw/zinc/77/25/48/944772548.db2.gz WPFGGWUUTSMGOX-OAHLLOKOSA-N 0 0 350.733 3.572 20 5 FHBDRN O=C1CCc2cc(NCc3c(F)cc([N+](=O)[O-])cc3F)c(F)cc2N1 ZINC000506279121 944773731 /nfs/dbraw/zinc/77/37/31/944773731.db2.gz IICBJJCCMLWWKW-UHFFFAOYSA-N 0 0 351.284 3.509 20 5 FHBDRN Cc1csc(N(CC(F)(F)F)C(=O)c2cc(F)cc([N+](=O)[O-])c2)n1 ZINC000518793488 944776351 /nfs/dbraw/zinc/77/63/51/944776351.db2.gz MPLATHKQTSQEHR-UHFFFAOYSA-N 0 0 363.292 3.708 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)Nc2cnccc2-n2cccn2)cc1[N+](=O)[O-] ZINC000505900254 944793152 /nfs/dbraw/zinc/79/31/52/944793152.db2.gz XRUWEASTAJAAPH-UHFFFAOYSA-N 0 0 365.393 3.725 20 5 FHBDRN COc1cc(C(=O)N2CC[C@](F)(c3ccccc3)C2)cc([N+](=O)[O-])c1C ZINC000518798782 944795259 /nfs/dbraw/zinc/79/52/59/944795259.db2.gz WENHFATZLLPSQK-LJQANCHMSA-N 0 0 358.369 3.623 20 5 FHBDRN Cc1cc(C(=O)NCc2ccccc2[N+](=O)[O-])c(C)cc1Br ZINC000506959357 944797386 /nfs/dbraw/zinc/79/73/86/944797386.db2.gz AHRAYWKOBNAASB-UHFFFAOYSA-N 0 0 363.211 3.904 20 5 FHBDRN C[C@H]1CCCN(c2ccc(C(=O)N(C)Cc3ccco3)cc2[N+](=O)[O-])C1 ZINC000017790685 944807172 /nfs/dbraw/zinc/80/71/72/944807172.db2.gz FVDPWOCRCRBQOG-AWEZNQCLSA-N 0 0 357.410 3.696 20 5 FHBDRN Cc1nsc(NC2CC2)c1C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000500409776 944811248 /nfs/dbraw/zinc/81/12/48/944811248.db2.gz IFLBGHGVWGCVLO-UHFFFAOYSA-N 0 0 366.830 3.517 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)c1c(Cl)cncc1Cl ZINC000500409855 944811294 /nfs/dbraw/zinc/81/12/94/944811294.db2.gz JOSZVJJXZUDHEB-UHFFFAOYSA-N 0 0 360.584 3.880 20 5 FHBDRN CC(C)OCc1nc([C@@H](C)Nc2ccc([N+](=O)[O-])c3cccnc23)no1 ZINC000290774424 944814755 /nfs/dbraw/zinc/81/47/55/944814755.db2.gz MMMLNBCIDPYJQG-LLVKDONJSA-N 0 0 357.370 3.624 20 5 FHBDRN Cn1cnc2cc(-c3noc(C(C)(C)c4ccccc4[N+](=O)[O-])n3)ccc21 ZINC000426444154 944820306 /nfs/dbraw/zinc/82/03/06/944820306.db2.gz TZNLGVLXFGNJTB-UHFFFAOYSA-N 0 0 363.377 3.857 20 5 FHBDRN O=C([O-])[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1csc2ccccc12 ZINC000426816742 944838452 /nfs/dbraw/zinc/83/84/52/944838452.db2.gz MIKUMVNQSLTFTM-HNNXBMFYSA-N 0 0 356.403 3.595 20 5 FHBDRN COc1ccc(C(=O)NCCOc2ccc([N+](=O)[O-])cc2)c2ccccc12 ZINC000518846725 944838871 /nfs/dbraw/zinc/83/88/71/944838871.db2.gz LELKJIKDNKMKEU-UHFFFAOYSA-N 0 0 366.373 3.565 20 5 FHBDRN CC(C)[C@H](CC(F)(F)F)NC(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000438613581 944839872 /nfs/dbraw/zinc/83/98/72/944839872.db2.gz MONVOWIEKQMFQE-LBPRGKRZSA-N 0 0 350.362 3.780 20 5 FHBDRN CCNc1ccc(C(=O)NCc2coc(-c3cccs3)n2)cc1[N+](=O)[O-] ZINC000518848166 944842254 /nfs/dbraw/zinc/84/22/54/944842254.db2.gz FNMUEABSVUXXLE-UHFFFAOYSA-N 0 0 372.406 3.673 20 5 FHBDRN Cc1ccc(OCCCNc2ccc(C(=O)NC(C)C)cc2[N+](=O)[O-])cc1 ZINC000507013167 944861870 /nfs/dbraw/zinc/86/18/70/944861870.db2.gz BVFFOPYOMVLRPN-UHFFFAOYSA-N 0 0 371.437 3.922 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)NCCCc1cccc(C(F)(F)F)c1 ZINC000507016953 944864151 /nfs/dbraw/zinc/86/41/51/944864151.db2.gz RYECFEMRUAQFBX-UHFFFAOYSA-N 0 0 367.327 3.680 20 5 FHBDRN CCN(C(=O)C(=O)Nc1ccc(C)c([N+](=O)[O-])c1)[C@H](C)c1ccc(F)cc1 ZINC000516443331 944864922 /nfs/dbraw/zinc/86/49/22/944864922.db2.gz VCYPNAUCBJTGGT-CYBMUJFWSA-N 0 0 373.384 3.591 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N(C1CC1)[C@@H]1CCc2ccccc21 ZINC000518858099 944871804 /nfs/dbraw/zinc/87/18/04/944871804.db2.gz ZBNNDIUSPLWGLB-LJQANCHMSA-N 0 0 352.390 3.652 20 5 FHBDRN CCC(CC)Sc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCCC1 ZINC000507028431 944876577 /nfs/dbraw/zinc/87/65/77/944876577.db2.gz WNQCCAKIWCPGPX-UHFFFAOYSA-N 0 0 358.485 3.660 20 5 FHBDRN CO[C@H]1CCOc2c(NCc3c(F)cc([N+](=O)[O-])cc3F)cccc21 ZINC000506311205 944880280 /nfs/dbraw/zinc/88/02/80/944880280.db2.gz UYWSIZFQUATSAB-INIZCTEOSA-N 0 0 350.321 3.955 20 5 FHBDRN O=C(Nc1cccc(F)c1)C1CCN(c2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000507022629 944888819 /nfs/dbraw/zinc/88/88/19/944888819.db2.gz QTBLFWVCEXKIRH-UHFFFAOYSA-N 0 0 361.348 3.728 20 5 FHBDRN Cc1nc2c(s1)CCC[C@@H]2C(=O)N1CCCc2ccc([N+](=O)[O-])cc21 ZINC000426890978 944892550 /nfs/dbraw/zinc/89/25/50/944892550.db2.gz VMTNGJBSJMXILJ-AWEZNQCLSA-N 0 0 357.435 3.759 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N(C)Cc1ccccc1C(F)(F)F ZINC000426889731 944892747 /nfs/dbraw/zinc/89/27/47/944892747.db2.gz OIOJTDPOVBMRGP-UHFFFAOYSA-N 0 0 368.311 3.894 20 5 FHBDRN C[C@H](CSc1ccccc1)C(=O)NCCOc1ccc([N+](=O)[O-])cc1 ZINC000518894755 944898375 /nfs/dbraw/zinc/89/83/75/944898375.db2.gz XCNADRQONUBDOD-CQSZACIVSA-N 0 0 360.435 3.518 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1C[C@@H](c2ccccc2C)C[C@H]1C ZINC000426902104 944911065 /nfs/dbraw/zinc/91/10/65/944911065.db2.gz BBYCAMYPPGFSAX-CABCVRRESA-N 0 0 354.406 3.930 20 5 FHBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N(Cc1ccc(F)cc1)C(C)C ZINC000507071452 944914621 /nfs/dbraw/zinc/91/46/21/944914621.db2.gz NOPFMNLCSKTYLA-UHFFFAOYSA-N 0 0 366.414 3.642 20 5 FHBDRN CCc1cc(N[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)ccc1F ZINC000506662989 944917352 /nfs/dbraw/zinc/91/73/52/944917352.db2.gz UNCCIMGYNUOROU-LLVKDONJSA-N 0 0 361.373 3.744 20 5 FHBDRN C[C@@H](CC(=O)c1ccccc1)NC(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000426908925 944917840 /nfs/dbraw/zinc/91/78/40/944917840.db2.gz IYXCNYCIUMDXDP-LBPRGKRZSA-N 0 0 352.346 3.732 20 5 FHBDRN C[C@@H](CC(=O)c1ccccc1)NC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000426907617 944918085 /nfs/dbraw/zinc/91/80/85/944918085.db2.gz AQVXFNZTMNNSAD-AWEZNQCLSA-N 0 0 354.406 3.650 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N[C@H]2CC[C@H](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000438690198 944929878 /nfs/dbraw/zinc/92/98/78/944929878.db2.gz HYAGBZWQKYPMEF-CABCVRRESA-N 0 0 356.426 3.583 20 5 FHBDRN CCO[C@@H](C)c1noc(CSCc2c(F)cc([N+](=O)[O-])cc2F)n1 ZINC000507092851 944930813 /nfs/dbraw/zinc/93/08/13/944930813.db2.gz FVMFYBKJFCBMJH-QMMMGPOBSA-N 0 0 359.354 3.787 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@H](C)O[C@@H](CC)C1 ZINC000506329309 944932876 /nfs/dbraw/zinc/93/28/76/944932876.db2.gz FLBLCRXMAAABNK-JSGCOSHPSA-N 0 0 352.456 3.736 20 5 FHBDRN Cc1c(NC(=O)[C@@H](C)N2CC[C@@H]2Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000437839595 944939084 /nfs/dbraw/zinc/93/90/84/944939084.db2.gz UZSWBAXAFLOTTN-NVXWUHKLSA-N 0 0 353.422 3.547 20 5 FHBDRN CC(=O)c1ccc(Cl)c(NS(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)c1 ZINC000432045356 944946353 /nfs/dbraw/zinc/94/63/53/944946353.db2.gz AVMMEVACVMTLFN-UHFFFAOYSA-N 0 0 374.827 3.622 20 5 FHBDRN Cc1cc(C)c(CCNC(=O)N(C)Cc2ccccc2[N+](=O)[O-])c(C)c1 ZINC000506673537 944948380 /nfs/dbraw/zinc/94/83/80/944948380.db2.gz JGGWBXGEJHHRDF-UHFFFAOYSA-N 0 0 355.438 3.904 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N2c3ccccc3CC[C@H]2C)cc1OC ZINC000072768376 944958670 /nfs/dbraw/zinc/95/86/70/944958670.db2.gz CDTZQEITSDQIPD-CYBMUJFWSA-N 0 0 370.405 3.984 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)NCc1nc2c(cccc2C)[nH]1 ZINC000516517642 944967291 /nfs/dbraw/zinc/96/72/91/944967291.db2.gz WKRUSGATEABXOJ-UHFFFAOYSA-N 0 0 353.382 3.664 20 5 FHBDRN O=C(NCCc1ccco1)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000017910231 944970356 /nfs/dbraw/zinc/97/03/56/944970356.db2.gz XTGAPQBUGDHAJA-UHFFFAOYSA-N 0 0 351.362 3.904 20 5 FHBDRN CNC(=O)c1ccc(NCC2(c3ccccc3)CCCC2)c([N+](=O)[O-])c1 ZINC000507133405 944973227 /nfs/dbraw/zinc/97/32/27/944973227.db2.gz XXVZUESZOFDQFJ-UHFFFAOYSA-N 0 0 353.422 3.878 20 5 FHBDRN Cn1c(C(=O)N2Cc3ccccc3[C@@H](c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000518963682 944981337 /nfs/dbraw/zinc/98/13/37/944981337.db2.gz KEVRBSLXZKZSDH-GOSISDBHSA-N 0 0 361.401 3.721 20 5 FHBDRN COc1ccc(C)c2c1N(CC(=O)Nc1ccc([N+](=O)[O-])cc1C)CCC2 ZINC000439801339 944988597 /nfs/dbraw/zinc/98/85/97/944988597.db2.gz NHQRJWHBFSOZJG-UHFFFAOYSA-N 0 0 369.421 3.612 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)N2CC[C@H](C)[C@H]3CCCC[C@H]32)cc1C ZINC000516550223 944996314 /nfs/dbraw/zinc/99/63/14/944996314.db2.gz IZXRXBOZOQYOJI-APHBMKBZSA-N 0 0 366.483 3.801 20 5 FHBDRN COc1ccc(CSCC(=O)N(C)[C@H](C)C(C)(C)C)cc1[N+](=O)[O-] ZINC000518973784 944997432 /nfs/dbraw/zinc/99/74/32/944997432.db2.gz PUPKKATXBFTAMK-GFCCVEGCSA-N 0 0 354.472 3.730 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)NCc1ccc(F)c(Cl)c1 ZINC000507157038 945005251 /nfs/dbraw/zinc/00/52/51/945005251.db2.gz NIKODGADMYBAEF-UHFFFAOYSA-N 0 0 361.760 3.658 20 5 FHBDRN CC1=C(C)C[C@@H](c2nc(-c3ccc(-n4cncn4)c([N+](=O)[O-])c3)no2)CC1 ZINC000516569623 945012482 /nfs/dbraw/zinc/01/24/82/945012482.db2.gz XQXNSPGKVCYMMU-AWEZNQCLSA-N 0 0 366.381 3.829 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)Cc1cc(F)c(C)cc1F ZINC001270537522 945017396 /nfs/dbraw/zinc/01/73/96/945017396.db2.gz YROWHHKTTJUEPI-UHFFFAOYSA-N 0 0 350.321 3.761 20 5 FHBDRN O=C(CCc1nc2ccccc2o1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000437105738 945027948 /nfs/dbraw/zinc/02/79/48/945027948.db2.gz KDBWWCAQXZSUNA-UHFFFAOYSA-N 0 0 365.389 3.860 20 5 FHBDRN CC(=O)Nc1ccc(O)c(C(=O)Nc2ccc(C(C)(C)C)c([N+](=O)[O-])c2)c1 ZINC000516576388 945029263 /nfs/dbraw/zinc/02/92/63/945029263.db2.gz KFCHQIARLFLBJO-UHFFFAOYSA-N 0 0 371.393 3.809 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C1CCCCC1)C(F)(F)F ZINC000439854071 945030369 /nfs/dbraw/zinc/03/03/69/945030369.db2.gz RRDVMSUIYXHAJF-CQSZACIVSA-N 0 0 360.332 3.844 20 5 FHBDRN Cc1ccc(Cc2cnc(NC(=O)c3cc([N+](=O)[O-])c[nH]3)s2)cc1F ZINC000519018991 945032805 /nfs/dbraw/zinc/03/28/05/945032805.db2.gz JGJOZQHWZUUCBW-UHFFFAOYSA-N 0 0 360.370 3.670 20 5 FHBDRN O=C([C@H]1Cc2cc(Cl)ccc2O1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000437111986 945034249 /nfs/dbraw/zinc/03/42/49/945034249.db2.gz RXTNMVZCRAVTAV-GOSISDBHSA-N 0 0 372.808 3.743 20 5 FHBDRN COc1ccc(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)cc1[N+](=O)[O-] ZINC000519021090 945035017 /nfs/dbraw/zinc/03/50/17/945035017.db2.gz BNLCEHZEDQKQFT-HNNXBMFYSA-N 0 0 367.405 3.623 20 5 FHBDRN C[C@H](C(=O)N[C@@H]1c2ccc(F)cc2O[C@H]1C)c1ccc([N+](=O)[O-])cc1F ZINC000519021548 945035490 /nfs/dbraw/zinc/03/54/90/945035490.db2.gz OOFMVHCMVKVZEV-YMNVWFMLSA-N 0 0 362.332 3.615 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H](C)c1cc2cccc(F)c2o1 ZINC000427053930 945036432 /nfs/dbraw/zinc/03/64/32/945036432.db2.gz LWYJHVUQCGCCRY-SNVBAGLBSA-N 0 0 358.325 3.980 20 5 FHBDRN Cn1c(Cc2ccsc2)nnc1N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000516604907 945048041 /nfs/dbraw/zinc/04/80/41/945048041.db2.gz JNKBUSLHFUCQHQ-UHFFFAOYSA-N 0 0 369.450 3.545 20 5 FHBDRN Cc1ccc(Cl)cc1N1CC[C@H](CNc2ncc([N+](=O)[O-])cc2C)C1 ZINC000518139954 945050760 /nfs/dbraw/zinc/05/07/60/945050760.db2.gz GUUXCJFDLFMSNA-CQSZACIVSA-N 0 0 360.845 3.620 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@H]1CCOc2ccccc21 ZINC000439891586 945053787 /nfs/dbraw/zinc/05/37/87/945053787.db2.gz PZAOSJOEKZPPRV-ZDUSSCGKSA-N 0 0 371.393 3.681 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H]1[C@@H]2c3ccccc3C[C@H]12 ZINC000439875455 945054231 /nfs/dbraw/zinc/05/42/31/945054231.db2.gz FHJZHRRMFVFRBW-GPMSIDNRSA-N 0 0 367.405 3.701 20 5 FHBDRN CCO[C@@H]1C[C@@H](NC(=O)CSc2ccc([N+](=O)[O-])cc2)C12CCCC2 ZINC000437123630 945054262 /nfs/dbraw/zinc/05/42/62/945054262.db2.gz FHKLYPIPXADMBX-HZPDHXFCSA-N 0 0 364.467 3.541 20 5 FHBDRN CCNc1ccc(C(=O)N[C@@H]2C[C@H]2c2cccc(OCC)c2)cc1[N+](=O)[O-] ZINC000438810941 945055910 /nfs/dbraw/zinc/05/59/10/945055910.db2.gz OMCALLBVCJGIBJ-FUHWJXTLSA-N 0 0 369.421 3.711 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)N1CC[C@H](c2cccc(Cl)c2)C1 ZINC000432091061 945058979 /nfs/dbraw/zinc/05/89/79/945058979.db2.gz UIBPOOLPFSTIFG-HNNXBMFYSA-N 0 0 359.813 3.947 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@@H](C(F)(F)F)[C@H]1C ZINC000439882251 945059579 /nfs/dbraw/zinc/05/95/79/945059579.db2.gz OSYRWTNPSZWCEC-MWLCHTKSSA-N 0 0 361.320 3.798 20 5 FHBDRN O=C(NCc1ccc(Cl)s1)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000184372016 945059881 /nfs/dbraw/zinc/05/98/81/945059881.db2.gz ACEGFOIUGVWDBJ-UHFFFAOYSA-N 0 0 360.222 3.963 20 5 FHBDRN CCc1cc(C(=O)NCc2ccc([N+](=O)[O-])cc2)c2c(n1)onc2C(C)C ZINC000509547626 945060378 /nfs/dbraw/zinc/06/03/78/945060378.db2.gz AJOWDMLSWNELEF-UHFFFAOYSA-N 0 0 368.393 3.747 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H]1CCc2cc(F)ccc21 ZINC000439881442 945061404 /nfs/dbraw/zinc/06/14/04/945061404.db2.gz MWGKQFYRHXIQOU-OAHLLOKOSA-N 0 0 359.357 3.942 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)NCC1(C)Cc2ccccc2C1 ZINC000511866712 945378793 /nfs/dbraw/zinc/37/87/93/945378793.db2.gz FIGKKZBAEWBZJR-UHFFFAOYSA-N 0 0 367.449 3.584 20 5 FHBDRN O=C(Nc1cccc(NC(=O)C2CCCCC2)c1)c1cc([N+](=O)[O-])c[nH]1 ZINC000426625695 945387624 /nfs/dbraw/zinc/38/76/24/945387624.db2.gz NFQYETILSDOUSR-UHFFFAOYSA-N 0 0 356.382 3.694 20 5 FHBDRN Cc1cc2c(cc1C)N(S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-])CC2 ZINC000507646688 945397840 /nfs/dbraw/zinc/39/78/40/945397840.db2.gz ZGIWMIGPWTYPTG-UHFFFAOYSA-N 0 0 360.435 3.580 20 5 FHBDRN COCCc1nc2cc(NC(=O)Nc3ccc([N+](=O)[O-])cc3)ccc2o1 ZINC000440326134 945405087 /nfs/dbraw/zinc/40/50/87/945405087.db2.gz GHLYJVMUTKMXMD-UHFFFAOYSA-N 0 0 356.338 3.569 20 5 FHBDRN CC(C)CCO[C@@H]1CCCC[C@H]1NC(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-] ZINC000438021305 945408067 /nfs/dbraw/zinc/40/80/67/945408067.db2.gz GULCSTULNZZRBN-ZIAGYGMSSA-N 0 0 366.462 3.545 20 5 FHBDRN O=C(c1csc(-c2cccc([N+](=O)[O-])c2)n1)N(CC(F)F)C1CC1 ZINC000106833418 945408204 /nfs/dbraw/zinc/40/82/04/945408204.db2.gz ZCRDDCCJVINLQF-UHFFFAOYSA-N 0 0 353.350 3.588 20 5 FHBDRN CCC(CC)(C(=O)NCCNc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000440351223 945430945 /nfs/dbraw/zinc/43/09/45/945430945.db2.gz CVPWNMADJFLUME-UHFFFAOYSA-N 0 0 355.438 3.881 20 5 FHBDRN C[C@H](Nc1ccc([N+](=O)[O-])c(C(=O)[O-])c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000383417032 945433254 /nfs/dbraw/zinc/43/32/54/945433254.db2.gz OIULWRDJXHEMQR-GOEBONIOSA-N 0 0 369.421 3.616 20 5 FHBDRN CC[C@H](NC(=O)NCc1ccc([N+](=O)[O-])cc1Cl)c1nc(C)cs1 ZINC000186002805 945443010 /nfs/dbraw/zinc/44/30/10/945443010.db2.gz GMYNVJKVSVGHBG-ZDUSSCGKSA-N 0 0 368.846 3.964 20 5 FHBDRN C[C@H]1CC[C@@H](c2ccccc2)N(C(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)C1 ZINC000507680662 945443092 /nfs/dbraw/zinc/44/30/92/945443092.db2.gz WYGWYMJYJZLXBO-KSSFIOAISA-N 0 0 367.405 3.533 20 5 FHBDRN O=C(CC[S@](=O)Cc1cc2ccccc2o1)Nc1ccccc1[N+](=O)[O-] ZINC000507682813 945448132 /nfs/dbraw/zinc/44/81/32/945448132.db2.gz GHTDIJNCTUVCBJ-SANMLTNESA-N 0 0 372.402 3.619 20 5 FHBDRN CSc1ccc(-c2nc(-c3ccc(NC(C)=O)cc3)no2)cc1[N+](=O)[O-] ZINC000545626188 945448558 /nfs/dbraw/zinc/44/85/58/945448558.db2.gz AGBDQPLWLJKQFW-UHFFFAOYSA-N 0 0 370.390 3.992 20 5 FHBDRN O=c1c2cc([N+](=O)[O-])ccc2nc2n1CC/C2=C/c1ccc2c(c1)CCC2 ZINC000255507626 945466346 /nfs/dbraw/zinc/46/63/46/945466346.db2.gz YYYXBRQLZXZXKM-WJDWOHSUSA-N 0 0 359.385 3.738 20 5 FHBDRN COCc1cc([N+](=O)[O-])ccc1NCc1ccncc1OCC(F)(F)F ZINC000280936395 945468122 /nfs/dbraw/zinc/46/81/22/945468122.db2.gz AXDXQUYWGHMVNO-UHFFFAOYSA-N 0 0 371.315 3.689 20 5 FHBDRN C[C@@H](C(=O)OC(C)(C)C)c1noc(C(F)(F)c2ccc([N+](=O)[O-])cc2)n1 ZINC000280941428 945470009 /nfs/dbraw/zinc/47/00/09/945470009.db2.gz SMLTXXHLKICXLN-SECBINFHSA-N 0 0 369.324 3.563 20 5 FHBDRN C[C@H](Oc1cc(F)ccc1[N+](=O)[O-])C(=O)N1CCSc2ccccc21 ZINC000125013890 945478391 /nfs/dbraw/zinc/47/83/91/945478391.db2.gz DHXJYWSGVVFTPR-NSHDSACASA-N 0 0 362.382 3.640 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FHBDRN COc1cccc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])c1 ZINC000048021323 946492422 /nfs/dbraw/zinc/49/24/22/946492422.db2.gz IHUSBHHGMZIKLS-UHFFFAOYSA-N 0 0 370.283 3.797 20 5 FHBDRN Cc1c(C(F)(F)F)nn(C)c1NC(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000186111273 946492560 /nfs/dbraw/zinc/49/25/60/946492560.db2.gz SBYHFATXPOHERZ-SSDOTTSWSA-N 0 0 374.294 3.537 20 5 FHBDRN COc1cc(F)ccc1N1CCN([C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000441382176 946505352 /nfs/dbraw/zinc/50/53/52/946505352.db2.gz NMFIPEWWMHEIBN-AWEZNQCLSA-N 0 0 359.401 3.626 20 5 FHBDRN CCc1cnccc1-c1noc(-c2ccc(N3CCCC3)c([N+](=O)[O-])c2)n1 ZINC000545740380 946506203 /nfs/dbraw/zinc/50/62/03/946506203.db2.gz KDTKZLFQVYYXCU-UHFFFAOYSA-N 0 0 365.393 3.869 20 5 FHBDRN CSc1cccc(C(=O)N2C[C@@H](C)C(=O)Nc3ccccc32)c1[N+](=O)[O-] ZINC000186533513 946507402 /nfs/dbraw/zinc/50/74/02/946507402.db2.gz FQTIEWIVODFRTH-LLVKDONJSA-N 0 0 371.418 3.552 20 5 FHBDRN C[C@H](Oc1nc(Cl)ccc1[N+](=O)[O-])c1ccc(Br)nc1 ZINC001226364760 946510998 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354.410 3.640 20 5 FHBDRN C[C@H](CNC(=O)N1CC[C@@H](C(F)(F)F)[C@@H]1C)c1ccccc1[N+](=O)[O-] ZINC000897064731 946557936 /nfs/dbraw/zinc/55/79/36/946557936.db2.gz WNIZINAQBPJWII-NTZNESFSSA-N 0 0 359.348 3.681 20 5 FHBDRN CC[C@H](c1ccncc1)N(C)C(=O)NC[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000897069559 946563431 /nfs/dbraw/zinc/56/34/31/946563431.db2.gz XTMQELKFHVHDBV-RHSMWYFYSA-N 0 0 356.426 3.886 20 5 FHBDRN CC(=O)N1CCc2cc(N[C@@H]3C[C@H]3c3ccc(F)c(F)c3)cc([N+](=O)[O-])c21 ZINC001168069906 946577318 /nfs/dbraw/zinc/57/73/18/946577318.db2.gz NVKCMUWBIOILHR-WMLDXEAASA-N 0 0 373.359 3.750 20 5 FHBDRN Cc1cc(CN(C)C(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)ccc1F ZINC000444426879 946579859 /nfs/dbraw/zinc/57/98/59/946579859.db2.gz WNQRJSIDYJUKKF-UHFFFAOYSA-N 0 0 369.352 3.568 20 5 FHBDRN CCc1cnccc1CNC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000475189134 946588386 /nfs/dbraw/zinc/58/83/86/946588386.db2.gz HFKGIWUZGQEJMO-UHFFFAOYSA-N 0 0 368.315 3.893 20 5 FHBDRN Cc1ccc(NC(=O)c2cnc(OCc3ccccc3)cn2)cc1[N+](=O)[O-] ZINC000428337937 946588583 /nfs/dbraw/zinc/58/85/83/946588583.db2.gz OQSMNVBEFACIOE-UHFFFAOYSA-N 0 0 364.361 3.525 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NC[C@H]1[C@@H]2c3ccccc3C[C@H]12 ZINC000475546111 946616918 /nfs/dbraw/zinc/61/69/18/946616918.db2.gz FWGUFNFVCXJLAW-GPMSIDNRSA-N 0 0 351.406 3.919 20 5 FHBDRN C[C@]1(Cc2ccccc2)CCCN1C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000186218271 946629469 /nfs/dbraw/zinc/62/94/69/946629469.db2.gz DTCLBECRDBEXEZ-HXUWFJFHSA-N 0 0 364.405 3.709 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N1CCC[C@@H]1C(=O)OC(C)(C)C ZINC000475545306 946629944 /nfs/dbraw/zinc/62/99/44/946629944.db2.gz BHXXLLDOUDPQHM-CQSZACIVSA-N 0 0 363.414 3.550 20 5 FHBDRN CCNc1ccc(C(=O)N(C)CCCOCc2ccccc2)cc1[N+](=O)[O-] ZINC000384170121 946640880 /nfs/dbraw/zinc/64/08/80/946640880.db2.gz PJCKQVKAXGOLNO-UHFFFAOYSA-N 0 0 371.437 3.706 20 5 FHBDRN O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)c1ccc([N+](=O)[O-])o1 ZINC000121397232 946655985 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3.973 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NC[C@H](C)[N@H+](C)Cc1ccccc1 ZINC000475575217 946723416 /nfs/dbraw/zinc/72/34/16/946723416.db2.gz QNJGFUSYSQUCDU-INIZCTEOSA-N 0 0 370.453 3.854 20 5 FHBDRN CO[C@@H](C)c1cccc(NC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)c1 ZINC000088379019 946723519 /nfs/dbraw/zinc/72/35/19/946723519.db2.gz UTDIIGKUMCRSJQ-ZDUSSCGKSA-N 0 0 355.394 3.892 20 5 FHBDRN COc1cccc(C[C@H](C)NC(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)c1 ZINC000475578981 946735977 /nfs/dbraw/zinc/73/59/77/946735977.db2.gz FJTMZUFLESOGHR-AWEZNQCLSA-N 0 0 357.410 3.973 20 5 FHBDRN CCC(=O)Nc1cccc(-c2noc(-c3ccc(OC)c([N+](=O)[O-])c3)n2)c1 ZINC000546269851 946742495 /nfs/dbraw/zinc/74/24/95/946742495.db2.gz JBKYDEHIJZGEGY-UHFFFAOYSA-N 0 0 368.349 3.669 20 5 FHBDRN CCC(CC)[C@@H](O)CNC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000475220652 946743953 /nfs/dbraw/zinc/74/39/53/946743953.db2.gz PUQPXFMVVVYJDS-ZDUSSCGKSA-N 0 0 363.336 3.532 20 5 FHBDRN Cc1ccc(C(C)(C)CNC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)cc1 ZINC000728484911 946745299 /nfs/dbraw/zinc/74/52/99/946745299.db2.gz PAGIPJIXCQYUEA-UHFFFAOYSA-N 0 0 357.366 3.519 20 5 FHBDRN O=C(Nc1c(-c2cccnc2)nc2ccccn21)c1cccc([N+](=O)[O-])c1 ZINC000440409359 946749860 /nfs/dbraw/zinc/74/98/60/946749860.db2.gz NRXYHAWKCMOGHA-UHFFFAOYSA-N 0 0 359.345 3.557 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)C[C@H]2CC(=O)Nc3ccccc32)cc1[N+](=O)[O-] ZINC001126610696 946750922 /nfs/dbraw/zinc/75/09/22/946750922.db2.gz HKVMZFJCHYWUOY-ZFWWWQNUSA-N 0 0 367.405 3.597 20 5 FHBDRN COc1ccc2c(c1)OCC(C(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1)=C2 ZINC001126610802 946754841 /nfs/dbraw/zinc/75/48/41/946754841.db2.gz KLFRSZVBATTWAJ-CYBMUJFWSA-N 0 0 368.389 3.565 20 5 FHBDRN CC(C)C[C@]1(C)CC(=O)N(Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1=O ZINC000536276775 946763158 /nfs/dbraw/zinc/76/31/58/946763158.db2.gz ZCMRIYMFFPTKCI-LJQANCHMSA-N 0 0 371.393 3.561 20 5 FHBDRN C[C@@H]1CCC[C@H](OCc2cccc(NC(=O)Cn3ccc([N+](=O)[O-])n3)c2)C1 ZINC000062923036 946772805 /nfs/dbraw/zinc/77/28/05/946772805.db2.gz CQUNGKUYCDGHBX-PBHICJAKSA-N 0 0 372.425 3.525 20 5 FHBDRN CCOC(=O)c1ccnc(N2CCC[C@H]2CCc2ccccc2)c1[N+](=O)[O-] ZINC000523113087 946775164 /nfs/dbraw/zinc/77/51/64/946775164.db2.gz YKGGXYQUHUBOFI-INIZCTEOSA-N 0 0 369.421 3.768 20 5 FHBDRN COc1ccc(CSc2nccn2Cc2ccccn2)cc1[N+](=O)[O-] ZINC000112771398 946778021 /nfs/dbraw/zinc/77/80/21/946778021.db2.gz PQAPDYOCRMQSKK-UHFFFAOYSA-N 0 0 356.407 3.536 20 5 FHBDRN Cc1ccc(F)c(CN(C)C(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)c1 ZINC000444442363 946778293 /nfs/dbraw/zinc/77/82/93/946778293.db2.gz NBMHLXUDPDIWMB-UHFFFAOYSA-N 0 0 369.352 3.568 20 5 FHBDRN Cc1ccc(C(=O)COc2ccc([N+](=O)[O-])cc2Br)cc1 ZINC000523109627 946778716 /nfs/dbraw/zinc/77/87/16/946778716.db2.gz RXDVGVDEULXOBA-UHFFFAOYSA-N 0 0 350.168 3.927 20 5 FHBDRN CCOC(=O)c1ccnc(NCC(C)(C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000523114456 946798414 /nfs/dbraw/zinc/79/84/14/946798414.db2.gz KGIVHLHTFNUQJI-UHFFFAOYSA-N 0 0 357.410 3.847 20 5 FHBDRN CCOC(=O)c1ccnc(N2CCC[C@@H]2Cc2ccccc2C)c1[N+](=O)[O-] ZINC000523115570 946803751 /nfs/dbraw/zinc/80/37/51/946803751.db2.gz OVFURCSDEORHIV-MRXNPFEDSA-N 0 0 369.421 3.686 20 5 FHBDRN O=C(Nc1ccc(F)c(Br)c1)c1c(F)cccc1[N+](=O)[O-] ZINC001126613499 946813226 /nfs/dbraw/zinc/81/32/26/946813226.db2.gz SCULYAJNOKEHMG-UHFFFAOYSA-N 0 0 357.110 3.888 20 5 FHBDRN C[C@H]1[C@@H](C(F)(F)F)CCN1Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000475279852 946816558 /nfs/dbraw/zinc/81/65/58/946816558.db2.gz OQXSRJZHNBYDLE-KWQFWETISA-N 0 0 354.275 3.969 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1)N1CCC[C@H]1C[C@H](O)c1ccc(F)cc1 ZINC000162818496 946827812 /nfs/dbraw/zinc/82/78/12/946827812.db2.gz KFJQVRCMVMKSQO-WMZOPIPTSA-N 0 0 373.384 3.854 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)Nc2cccc(-n3nc(C)cc3C)c2)c1 ZINC000067548307 946829243 /nfs/dbraw/zinc/82/92/43/946829243.db2.gz DUVFKPIJVXDVBY-UHFFFAOYSA-N 0 0 366.377 3.658 20 5 FHBDRN CCC(CC)(CC(=O)OC)NC(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC001126614817 946836378 /nfs/dbraw/zinc/83/63/78/946836378.db2.gz FHEDCBMZBJYOMY-UHFFFAOYSA-N 0 0 364.442 3.744 20 5 FHBDRN CCOc1ccc(CN(C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)cc1 ZINC000025916296 946843303 /nfs/dbraw/zinc/84/33/03/946843303.db2.gz QYLCQSDIBUJAQF-UHFFFAOYSA-N 0 0 368.393 3.676 20 5 FHBDRN COc1c(C(=O)N(C2CC2)[C@H]2CCc3ccccc32)cccc1[N+](=O)[O-] ZINC000475319097 946853196 /nfs/dbraw/zinc/85/31/96/946853196.db2.gz HKKIVSMZGJBZKK-KRWDZBQOSA-N 0 0 352.390 3.896 20 5 FHBDRN CC[C@@H](O)CN(Cc1ccccc1)C(=O)N[C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000458883556 946876457 /nfs/dbraw/zinc/87/64/57/946876457.db2.gz CFNXZVQHRORMHN-HNAYVOBHSA-N 0 0 371.437 3.639 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1)N1CCO[C@@H](c2ccc(F)cc2Cl)C1 ZINC000186321034 946885317 /nfs/dbraw/zinc/88/53/17/946885317.db2.gz BWPZANOVYDGGPX-MRXNPFEDSA-N 0 0 364.760 3.601 20 5 FHBDRN CCc1ccc([C@@H](C)CC(=O)NCCNc2ccccc2[N+](=O)[O-])cc1 ZINC000523127053 946885797 /nfs/dbraw/zinc/88/57/97/946885797.db2.gz JACZCDLQJJGEJZ-HNNXBMFYSA-N 0 0 355.438 3.879 20 5 FHBDRN COc1c(C(=O)N[C@@H](C)Cc2nc3ccccc3s2)cccc1[N+](=O)[O-] ZINC000475326029 946886565 /nfs/dbraw/zinc/88/65/65/946886565.db2.gz QNCNEBHLXNFBAA-NSHDSACASA-N 0 0 371.418 3.574 20 5 FHBDRN CC1(C)C[C@@H](NC(=O)c2cc(F)c(Cl)c([N+](=O)[O-])c2Cl)CCO1 ZINC000897197753 946887325 /nfs/dbraw/zinc/88/73/25/946887325.db2.gz IMTJBHUHCHVHIJ-ZETCQYMHSA-N 0 0 365.188 3.728 20 5 FHBDRN Cc1nn(CC(=O)c2ccccc2OC(F)F)c2ccc([N+](=O)[O-])cc12 ZINC000432237792 946896191 /nfs/dbraw/zinc/89/61/91/946896191.db2.gz KSVLHQPATNGSPK-UHFFFAOYSA-N 0 0 361.304 3.737 20 5 FHBDRN C[C@@H](CCCC(F)(F)F)NC(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000511905543 946909879 /nfs/dbraw/zinc/90/98/79/946909879.db2.gz ZEWUAZUXOBZCAU-LBPRGKRZSA-N 0 0 361.364 3.900 20 5 FHBDRN CC(C)[C@H](Oc1ccc(Cl)cc1)C(=O)NCc1cccc([N+](=O)[O-])c1 ZINC001126172826 946910029 /nfs/dbraw/zinc/91/00/29/946910029.db2.gz JXQUVCIWTXTTKT-KRWDZBQOSA-N 0 0 362.813 3.968 20 5 FHBDRN O=C(CCc1c[nH]c2ccccc12)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186330220 946928734 /nfs/dbraw/zinc/92/87/34/946928734.db2.gz RTUHYYALTRWOCU-UHFFFAOYSA-N 0 0 357.797 3.979 20 5 FHBDRN CC(C)C(=O)Nc1ccc(NC(=O)NCCc2cccc([N+](=O)[O-])c2)cc1 ZINC000536284812 946937887 /nfs/dbraw/zinc/93/78/87/946937887.db2.gz HGCKRCOHUXBAHL-UHFFFAOYSA-N 0 0 370.409 3.554 20 5 FHBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)Nc1ccc2oc(C3CC3)nc2c1 ZINC000536285279 946939130 /nfs/dbraw/zinc/93/91/30/946939130.db2.gz LXHRHPTVOVYPKU-UHFFFAOYSA-N 0 0 366.377 3.978 20 5 FHBDRN CCS[C@@H]1CC[C@H](N(C)C(=O)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000458890438 946942167 /nfs/dbraw/zinc/94/21/67/946942167.db2.gz PPHKTUYXQOWOIF-VBNZEHGJSA-N 0 0 351.472 3.971 20 5 FHBDRN C[C@H](NC(=O)N1CC[C@@H](Nc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000458892928 946947164 /nfs/dbraw/zinc/94/71/64/946947164.db2.gz VXUBMGGCLZOZAP-WMLDXEAASA-N 0 0 354.410 3.552 20 5 FHBDRN C[C@@H](Oc1ccc(F)cc1Cl)C(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000112798743 946949675 /nfs/dbraw/zinc/94/96/75/946949675.db2.gz WEHHFZYRXWPWMK-LLVKDONJSA-N 0 0 366.776 3.514 20 5 FHBDRN Cc1nn(CC(=O)Nc2cccc(Cl)c2C)c2ccc([N+](=O)[O-])cc12 ZINC000432250159 946954132 /nfs/dbraw/zinc/95/41/32/946954132.db2.gz IYOSMRJSBABJNK-UHFFFAOYSA-N 0 0 358.785 3.853 20 5 FHBDRN Cc1ccc(Cn2nccc2NC(=O)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000087068618 946955653 /nfs/dbraw/zinc/95/56/53/946955653.db2.gz UNUOLXXCYYEPMW-UHFFFAOYSA-N 0 0 364.405 3.719 20 5 FHBDRN CC(C)(C)c1cccc2c1OCCN2C(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000444490596 946957492 /nfs/dbraw/zinc/95/74/92/946957492.db2.gz VFHHZEYENJFGJF-UHFFFAOYSA-N 0 0 354.406 3.860 20 5 FHBDRN COc1cc2c(cc1F)CC[C@@H]2NC(=O)NCc1cccc([N+](=O)[O-])c1C ZINC000511915707 946971562 /nfs/dbraw/zinc/97/15/62/946971562.db2.gz WMVAUQXBSLTPIO-INIZCTEOSA-N 0 0 373.384 3.538 20 5 FHBDRN CCCN(Cc1ccccc1)S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1 ZINC000467256516 946998525 /nfs/dbraw/zinc/99/85/25/946998525.db2.gz UPWQXFIJCGJKAB-UHFFFAOYSA-N 0 0 354.453 3.566 20 5 FHBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)[C@H](c1ccncc1)C1CCCC1 ZINC000897241107 946999073 /nfs/dbraw/zinc/99/90/73/946999073.db2.gz FAOBNFWRSYCMDU-IBGZPJMESA-N 0 0 353.422 3.623 20 5 FHBDRN CN(C(=O)c1ccccc1Sc1ccccc1[N+](=O)[O-])[C@@H]1CCOC1 ZINC000440455930 947003547 /nfs/dbraw/zinc/00/35/47/947003547.db2.gz BVOKFIBXWSKWQF-CYBMUJFWSA-N 0 0 358.419 3.607 20 5 FHBDRN COc1cccc(N2CCC[C@H](Nc3cccc(OC)c3[N+](=O)[O-])C2)c1 ZINC000475392425 947009825 /nfs/dbraw/zinc/00/98/25/947009825.db2.gz RQUBLQURADGKSI-AWEZNQCLSA-N 0 0 357.410 3.693 20 5 FHBDRN C[C@@H](C[C@@H]1CCOC1)NC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000613862154 947010456 /nfs/dbraw/zinc/01/04/56/947010456.db2.gz FVMLDCORRIBUDZ-UWVGGRQHSA-N 0 0 361.320 3.550 20 5 FHBDRN CC[C@@H](C)N(Cc1ccccc1)C(=O)CCn1nc(C)c([N+](=O)[O-])c1C ZINC000523229141 947011594 /nfs/dbraw/zinc/01/15/94/947011594.db2.gz UVFGQZHHUZEXNM-CQSZACIVSA-N 0 0 358.442 3.626 20 5 FHBDRN Cc1cc(C(=O)N[C@H](c2ccc(F)cc2)[C@H]2CCCO2)cc([N+](=O)[O-])c1 ZINC000148256169 947011762 /nfs/dbraw/zinc/01/17/62/947011762.db2.gz SMNKUPWXUONXFU-QZTJIDSGSA-N 0 0 358.369 3.692 20 5 FHBDRN O=[N+]([O-])c1ccc(N[C@@H]2CCOC23CCOCC3)nc1-c1ccc(F)cc1 ZINC000897327080 947012339 /nfs/dbraw/zinc/01/23/39/947012339.db2.gz YWVLRHAVIFZCRR-MRXNPFEDSA-N 0 0 373.384 3.546 20 5 FHBDRN CC(C)(C)OC1CC(CCNC(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)C1 ZINC000432262382 947014523 /nfs/dbraw/zinc/01/45/23/947014523.db2.gz MMKRWSAIDOWGPF-UHFFFAOYSA-N 0 0 359.426 3.790 20 5 FHBDRN O=C(N[C@@H]1C[C@H]2CC[C@@H]1O2)c1ccccc1Sc1ccccc1[N+](=O)[O-] ZINC000440472935 947024449 /nfs/dbraw/zinc/02/44/49/947024449.db2.gz YFMIHXKGHXPTLX-XPKDYRNWSA-N 0 0 370.430 3.796 20 5 FHBDRN Cc1cccc2c1OCC[C@H]2NC(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000511928513 947028052 /nfs/dbraw/zinc/02/80/52/947028052.db2.gz YMTLWMQAUJGYSP-GOSISDBHSA-N 0 0 369.421 3.611 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)NCC(F)(F)c1ccccc1 ZINC000511931058 947034121 /nfs/dbraw/zinc/03/41/21/947034121.db2.gz ULUYUUZHSVFEJY-UHFFFAOYSA-N 0 0 363.364 3.571 20 5 FHBDRN COc1ccccc1CC1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1 ZINC000523261455 947041687 /nfs/dbraw/zinc/04/16/87/947041687.db2.gz WLTCZENCIQKOIV-UHFFFAOYSA-N 0 0 354.406 3.698 20 5 FHBDRN O=C(Nc1ccc(Br)c([N+](=O)[O-])c1)N[C@H]1CC12CCCC2 ZINC000760112910 947045199 /nfs/dbraw/zinc/04/51/99/947045199.db2.gz KACPBEZBGQPHBK-LBPRGKRZSA-N 0 0 354.204 3.812 20 5 FHBDRN O=C(N[C@H]1CCCOC1)c1ccccc1Sc1ccccc1[N+](=O)[O-] ZINC000440488839 947046347 /nfs/dbraw/zinc/04/63/47/947046347.db2.gz RXLRGSHCNOXTEC-ZDUSSCGKSA-N 0 0 358.419 3.655 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)Nc1cc(F)ccc1F ZINC000152023097 947049551 /nfs/dbraw/zinc/04/95/51/947049551.db2.gz IVUCCNUTFKNQLE-UHFFFAOYSA-N 0 0 371.137 3.817 20 5 FHBDRN COc1ccc(-c2noc(COc3cc(Cl)ccc3[N+](=O)[O-])n2)cc1 ZINC000121280810 947058625 /nfs/dbraw/zinc/05/86/25/947058625.db2.gz SWLUMKQSXPIDQI-UHFFFAOYSA-N 0 0 361.741 3.886 20 5 FHBDRN O=C(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccc(SC2CC2)cc1 ZINC000444630532 947061207 /nfs/dbraw/zinc/06/12/07/947061207.db2.gz HGMBTFAYASLQIN-UHFFFAOYSA-N 0 0 368.418 3.656 20 5 FHBDRN COc1cccc(N2CCC(C(=O)Nc3cccc(F)c3)CC2)c1[N+](=O)[O-] ZINC000475424363 947063597 /nfs/dbraw/zinc/06/35/97/947063597.db2.gz NYKPUTGOTDQZGM-UHFFFAOYSA-N 0 0 373.384 3.598 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)NCc1ccc(Br)s1 ZINC000049412566 947064057 /nfs/dbraw/zinc/06/40/57/947064057.db2.gz GHQZULFWVPQROH-UHFFFAOYSA-N 0 0 355.213 3.657 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1CC2(CCC2)[C@@H]1c1ccccc1 ZINC000432279961 947065322 /nfs/dbraw/zinc/06/53/22/947065322.db2.gz LRIMCVAIZZZXCH-SFHVURJKSA-N 0 0 372.446 3.819 20 5 FHBDRN CCCCc1ccc(CC(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000444646239 947068386 /nfs/dbraw/zinc/06/83/86/947068386.db2.gz RPLVLWHOUAUBBW-UHFFFAOYSA-N 0 0 366.421 3.673 20 5 FHBDRN COc1ccc(CNC(=O)Nc2ccc([N+](=O)[O-])cc2)c(C(F)(F)F)c1 ZINC000523297473 947074790 /nfs/dbraw/zinc/07/47/90/947074790.db2.gz VIVSNSCESAWKQC-UHFFFAOYSA-N 0 0 369.299 3.944 20 5 FHBDRN Cc1nc(C2(NCc3nc4cc([N+](=O)[O-])ccc4[nH]3)CCCCCC2)no1 ZINC000444638559 947080543 /nfs/dbraw/zinc/08/05/43/947080543.db2.gz JLFFHFSIVPOBHO-UHFFFAOYSA-N 0 0 370.413 3.502 20 5 FHBDRN Cc1cc(S(=O)(=O)N2CC3(CCC3)[C@@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000432289650 947107037 /nfs/dbraw/zinc/10/70/37/947107037.db2.gz QXYCBSLOJSICMB-SFHVURJKSA-N 0 0 372.446 3.819 20 5 FHBDRN C[C@@H](CCNC(=O)c1cc([N+](=O)[O-])ccc1SCCO)c1ccccc1 ZINC000467723430 947123252 /nfs/dbraw/zinc/12/32/52/947123252.db2.gz ORNIPVHAOLODSA-AWEZNQCLSA-N 0 0 374.462 3.603 20 5 FHBDRN Cc1c(NC(=O)[C@H](C)N(C)Cc2cc(F)cc(F)c2)cccc1[N+](=O)[O-] ZINC000444699742 947124835 /nfs/dbraw/zinc/12/48/35/947124835.db2.gz FPTYGRIRLSTOLH-LBPRGKRZSA-N 0 0 363.364 3.640 20 5 FHBDRN O=C(COc1ccc(F)cc1Br)c1cccc([N+](=O)[O-])c1 ZINC000049900928 947166996 /nfs/dbraw/zinc/16/69/96/947166996.db2.gz NKJZWVNUVZUYPR-UHFFFAOYSA-N 0 0 354.131 3.758 20 5 FHBDRN Cn1c(C(=O)Nc2ncccc2OCC2CCCCC2)ccc1[N+](=O)[O-] ZINC000523348779 947170938 /nfs/dbraw/zinc/17/09/38/947170938.db2.gz RYFOFYAOVBASSK-UHFFFAOYSA-N 0 0 358.398 3.540 20 5 FHBDRN Cc1ccc(F)c(CN(C)[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)c1 ZINC000444742863 947178507 /nfs/dbraw/zinc/17/85/07/947178507.db2.gz HAWXBICYSITNJH-AWEZNQCLSA-N 0 0 359.401 3.810 20 5 FHBDRN CCOc1cc(C(=O)Nc2cnc3ccccc3c2)c([N+](=O)[O-])cc1OC ZINC000198983920 947183782 /nfs/dbraw/zinc/18/37/82/947183782.db2.gz ZORPEJYFBPMYIZ-UHFFFAOYSA-N 0 0 367.361 3.803 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)NCc1ccc(OC2CCCCC2)nc1 ZINC000523364999 947185598 /nfs/dbraw/zinc/18/55/98/947185598.db2.gz NQVFKYFEYCNXSP-UHFFFAOYSA-N 0 0 369.421 3.940 20 5 FHBDRN CC(C)c1csc(CNC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)n1 ZINC000546553650 947191655 /nfs/dbraw/zinc/19/16/55/947191655.db2.gz PPMICBXFQGAZBU-UHFFFAOYSA-N 0 0 365.430 3.908 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1F)Nc1cccc(OC(F)(F)F)c1 ZINC000126767980 947231451 /nfs/dbraw/zinc/23/14/51/947231451.db2.gz LHEWBIWHKYRVRG-UHFFFAOYSA-N 0 0 358.247 3.814 20 5 FHBDRN O=C(Cc1cc2ccccc2o1)O[C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000759929173 947236724 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CCO[C@H](CNC(=O)N[C@H](C)c1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000444959179 947388703 /nfs/dbraw/zinc/38/87/03/947388703.db2.gz LXBWGBVEMKTJLF-RDTXWAMCSA-N 0 0 357.410 3.733 20 5 FHBDRN O=C(COc1ccccc1[N+](=O)[O-])N1CCCC[C@@H]1CCc1ccccc1 ZINC000536321931 947394223 /nfs/dbraw/zinc/39/42/23/947394223.db2.gz YDFPDRZTBJTGPQ-GOSISDBHSA-N 0 0 368.433 3.988 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)N1CCC[C@H](c2cc(F)ccc2F)C1 ZINC000190290062 947414313 /nfs/dbraw/zinc/41/43/13/947414313.db2.gz JXJHUIXAMAXGHD-LBPRGKRZSA-N 0 0 361.348 3.596 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)Nc2cnn(C)c2C(F)(F)F)cc1[N+](=O)[O-] ZINC000445028572 947451112 /nfs/dbraw/zinc/45/11/12/947451112.db2.gz CNPBRCZQSSHTIX-SECBINFHSA-N 0 0 371.319 3.538 20 5 FHBDRN C[C@@H](NC(=O)c1ccccc1Sc1ccccc1[N+](=O)[O-])[C@H]1CCOC1 ZINC000440645986 947495593 /nfs/dbraw/zinc/49/55/93/947495593.db2.gz MMJSTFDUFFVAKK-KGLIPLIRSA-N 0 0 372.446 3.901 20 5 FHBDRN Cn1c(C(=O)NCC(C)(C)c2ccc(C(F)(F)F)cc2)ccc1[N+](=O)[O-] ZINC000469940576 947515056 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ZINC000523758809 947577541 /nfs/dbraw/zinc/57/75/41/947577541.db2.gz SBYUMROLMMWLOC-UHFFFAOYSA-N 0 0 374.462 3.819 20 5 FHBDRN Cc1ccsc1CNC(=O)c1sc(Br)cc1[N+](=O)[O-] ZINC000445172675 947585135 /nfs/dbraw/zinc/58/51/35/947585135.db2.gz LGUDYWPFSCWYRG-UHFFFAOYSA-N 0 0 361.242 3.719 20 5 FHBDRN C[C@@H]1C[C@@H](c2ccccc2)CN1c1cc2nc[nH]c(=O)c2cc1[N+](=O)[O-] ZINC000523752706 947587856 /nfs/dbraw/zinc/58/78/56/947587856.db2.gz NNZNYTGBBBPXQE-TZMCWYRMSA-N 0 0 350.378 3.626 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)c2nc3ccccc3[nH]2)c1 ZINC000327461352 947588549 /nfs/dbraw/zinc/58/85/49/947588549.db2.gz ZUAJDJHWXBTWKI-SNVBAGLBSA-N 0 0 356.407 3.684 20 5 FHBDRN Cc1ccnc(-c2cccc(Nc3nc4sccn4c3[N+](=O)[O-])c2)n1 ZINC000523752869 947588718 /nfs/dbraw/zinc/58/87/18/947588718.db2.gz VGFRNKFNVLYUEA-UHFFFAOYSA-N 0 0 352.379 3.813 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CCc1nc(-c2ccc(OC(C)(C)C)cc2)no1 ZINC000445211763 947591048 /nfs/dbraw/zinc/59/10/48/947591048.db2.gz ROQYETKGHCKLKH-UHFFFAOYSA-N 0 0 371.397 3.570 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)Nc1ccc(Cl)c(Br)c1 ZINC000154417684 947598003 /nfs/dbraw/zinc/59/80/03/947598003.db2.gz BSKZAZLLLGFRHR-UHFFFAOYSA-N 0 0 370.590 3.966 20 5 FHBDRN O=C(N[C@@H]1CCCOc2ccccc21)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000087082211 947624747 /nfs/dbraw/zinc/62/47/47/947624747.db2.gz IULBBRVMSNSLMR-GOSISDBHSA-N 0 0 367.405 3.576 20 5 FHBDRN COc1cc(C)cc(CNc2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)c1 ZINC000128045839 947627183 /nfs/dbraw/zinc/62/71/83/947627183.db2.gz QMKOKOXOCIQGRY-UHFFFAOYSA-N 0 0 369.421 3.760 20 5 FHBDRN CCCN(C(=O)Cc1cc(C(C)=O)ccc1OC)c1cccc([N+](=O)[O-])c1 ZINC000441462201 947644114 /nfs/dbraw/zinc/64/41/14/947644114.db2.gz HUKSAYULHHCGHY-UHFFFAOYSA-N 0 0 370.405 3.792 20 5 FHBDRN CCOc1ccc(C(=O)N[C@H]2C[C@H]2c2c(F)cccc2F)cc1[N+](=O)[O-] ZINC000523828644 947646898 /nfs/dbraw/zinc/64/68/98/947646898.db2.gz ZDXHTIJUVFKSGU-RISCZKNCSA-N 0 0 362.332 3.558 20 5 FHBDRN CC(C)(C)[C@H]1CCCN(S(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000523856991 947665984 /nfs/dbraw/zinc/66/59/84/947665984.db2.gz GIEJHSKBLFYNHI-HNNXBMFYSA-N 0 0 354.472 3.573 20 5 FHBDRN Cc1ccc(-c2ccncc2)cc1NC(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000523861688 947670867 /nfs/dbraw/zinc/67/08/67/947670867.db2.gz DYQAYTLOGROATQ-UHFFFAOYSA-N 0 0 363.373 3.983 20 5 FHBDRN C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CC[C@@H](C(F)(F)F)C(C)(C)C1 ZINC000248792396 947672908 /nfs/dbraw/zinc/67/29/08/947672908.db2.gz NZWIVKWZLAYMAS-BXUZGUMPSA-N 0 0 373.375 3.832 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CSc1cccc(Cl)c1 ZINC000523867088 947678063 /nfs/dbraw/zinc/67/80/63/947678063.db2.gz PSSBAZOAWYTITE-UHFFFAOYSA-N 0 0 352.799 3.988 20 5 FHBDRN CCCCSCCC(=O)O[C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1 ZINC000759936170 947692641 /nfs/dbraw/zinc/69/26/41/947692641.db2.gz TURRAOUZCKLIOC-UONOGXRCSA-N 0 0 355.460 3.742 20 5 FHBDRN CCc1ccc(NC(=O)Cc2noc(-c3cc(F)cc([N+](=O)[O-])c3)n2)cc1 ZINC000445310883 947699702 /nfs/dbraw/zinc/69/97/02/947699702.db2.gz AQPFQAGCKHSXTD-UHFFFAOYSA-N 0 0 370.340 3.528 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1[C@H]2CCO[C@H]2C12CCCC2 ZINC000248392347 947701052 /nfs/dbraw/zinc/70/10/52/947701052.db2.gz KIMJCHNZDBAWRB-NXWXRZEISA-N 0 0 372.465 3.627 20 5 FHBDRN Cc1ccc(C)c(SCC(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)c1 ZINC000536356433 947701419 /nfs/dbraw/zinc/70/14/19/947701419.db2.gz XMARRESNIPHLLR-UHFFFAOYSA-N 0 0 356.407 3.819 20 5 FHBDRN Cc1cccc(C)c1NC(=O)Cc1noc(-c2cccc([N+](=O)[O-])c2C)n1 ZINC000445315053 947719645 /nfs/dbraw/zinc/71/96/45/947719645.db2.gz WQYFXASOYHODJF-UHFFFAOYSA-N 0 0 366.377 3.751 20 5 FHBDRN CCc1ccc(NCc2ccc(OCC(=O)OC)c([N+](=O)[O-])c2)cc1CC ZINC000473985261 947723924 /nfs/dbraw/zinc/72/39/24/947723924.db2.gz DCNSJDIBYSATJD-UHFFFAOYSA-N 0 0 372.421 3.884 20 5 FHBDRN Cc1cc(C)n(-c2ccc(CNc3ccc4c([N+](=O)[O-])c[nH]c4n3)cc2)n1 ZINC001167797474 947732983 /nfs/dbraw/zinc/73/29/83/947732983.db2.gz PPUDXTJOSJBSTM-UHFFFAOYSA-N 0 0 362.393 3.886 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)Nc2cnn(CC(F)F)c2)cc1[N+](=O)[O-] ZINC000523961917 947745633 /nfs/dbraw/zinc/74/56/33/947745633.db2.gz MZIGUQQYICTJSR-UHFFFAOYSA-N 0 0 352.341 3.606 20 5 FHBDRN CNC(=O)COc1cccc(Oc2c(Cl)cc([N+](=O)[O-])cc2Cl)c1 ZINC000128815240 947769601 /nfs/dbraw/zinc/76/96/01/947769601.db2.gz BDYSEUWFDGJRSZ-UHFFFAOYSA-N 0 0 371.176 3.819 20 5 FHBDRN CC(C)Cn1ncc(NC(=O)CCc2cccc([N+](=O)[O-])c2)c1C(F)F ZINC000536365084 947772849 /nfs/dbraw/zinc/77/28/49/947772849.db2.gz IBQVFXNJZPJMKQ-UHFFFAOYSA-N 0 0 366.368 3.956 20 5 FHBDRN O=C(O[C@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)c1nccc2ccccc21 ZINC000759940337 947787362 /nfs/dbraw/zinc/78/73/62/947787362.db2.gz DXFBJAPNHRSQRO-HOTGVXAUSA-N 0 0 366.377 3.680 20 5 FHBDRN Cc1cc(F)c(C(=O)O[C@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)cc1F ZINC000759940085 947790445 /nfs/dbraw/zinc/79/04/45/947790445.db2.gz NUMHHMIJQDFLND-GJZGRUSLSA-N 0 0 365.336 3.719 20 5 FHBDRN Cc1cc(C)n(-c2ccc(CNc3cccc4ncc([N+](=O)[O-])n43)cc2)n1 ZINC001167800183 947795045 /nfs/dbraw/zinc/79/50/45/947795045.db2.gz PYQAHXCTXFRENF-UHFFFAOYSA-N 0 0 362.393 3.657 20 5 FHBDRN Cc1cc(C(=O)N2C[C@H](C)N(Cc3ccccc3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000500441174 947804003 /nfs/dbraw/zinc/80/40/03/947804003.db2.gz XOQSSTCLYBLGGQ-DLBZAZTESA-N 0 0 367.449 3.638 20 5 FHBDRN C[C@H](NC(=O)N1CCCC[C@@H]([C@@H]2CCOC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000895066842 947843691 /nfs/dbraw/zinc/84/36/91/947843691.db2.gz NUEONDNHHRJONI-USXIJHARSA-N 0 0 361.442 3.504 20 5 FHBDRN CC(C)NC(=O)[C@@H]1CCC[C@@H](Nc2ccnc3c2cccc3[N+](=O)[O-])C1 ZINC000432310478 947863164 /nfs/dbraw/zinc/86/31/64/947863164.db2.gz BKXDSKLXQYFBLB-ZIAGYGMSSA-N 0 0 356.426 3.638 20 5 FHBDRN CC(=O)N(c1ccc(NC(=O)c2cc(C)ccc2[N+](=O)[O-])cc1)[C@@H]1C[C@@H]1C ZINC000294305445 947869627 /nfs/dbraw/zinc/86/96/27/947869627.db2.gz XEAFFTDHQFEFEG-ORAYPTAESA-N 0 0 367.405 3.917 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C1CCC(NC(=O)C(C)(C)C)CC1 ZINC000278867292 947871182 /nfs/dbraw/zinc/87/11/82/947871182.db2.gz BMEXAOXJTRBGJM-UHFFFAOYSA-N 0 0 361.442 3.563 20 5 FHBDRN Cc1sc(C(=O)N2C[C@@H](C)N(Cc3ccccc3)C[C@H]2C)cc1[N+](=O)[O-] ZINC000500440477 947879033 /nfs/dbraw/zinc/87/90/33/947879033.db2.gz KQLQBHOQJHJJAA-ZIAGYGMSSA-N 0 0 373.478 3.700 20 5 FHBDRN C[C@H](NC(=O)Cc1ccc(F)cc1[N+](=O)[O-])c1nc2ccccc2s1 ZINC001126259684 947902320 /nfs/dbraw/zinc/90/23/20/947902320.db2.gz MNEUOWYUKGACKT-JTQLQIEISA-N 0 0 359.382 3.764 20 5 FHBDRN O=C(NC[C@@H]1CCOC2(CCC2)C1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000459030442 947921826 /nfs/dbraw/zinc/92/18/26/947921826.db2.gz VGQBYKNGFBXKSL-MRXNPFEDSA-N 0 0 373.453 3.618 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCC[C@H]([C@H]3CCOC3)C2)nc1-c1ccccc1 ZINC000536387315 947924369 /nfs/dbraw/zinc/92/43/69/947924369.db2.gz YLGOYUYTXWRJHP-IRXDYDNUSA-N 0 0 353.422 3.910 20 5 FHBDRN O=C(OCc1cc([N+](=O)[O-])ccc1Cl)c1cnc([C@H]2CCCO2)s1 ZINC000125830602 947942808 /nfs/dbraw/zinc/94/28/08/947942808.db2.gz XACJHZSDNTXJLJ-GFCCVEGCSA-N 0 0 368.798 3.913 20 5 FHBDRN CO[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2SCC(C)C)[C@@H](C)C1 ZINC000441486037 947967833 /nfs/dbraw/zinc/96/78/33/947967833.db2.gz MIMJSKCAQYZEJC-ZFWWWQNUSA-N 0 0 366.483 3.982 20 5 FHBDRN CCN(C(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccccc1C(=O)OC ZINC000520485498 947990353 /nfs/dbraw/zinc/99/03/53/947990353.db2.gz RKWJSTRUNNOPJE-ZDUSSCGKSA-N 0 0 356.378 3.538 20 5 FHBDRN CCS[C@H](C(=O)O[C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)C(C)C ZINC000759944415 948004145 /nfs/dbraw/zinc/00/41/45/948004145.db2.gz GKXNUEPNOHUVOJ-GUTXKFCHSA-N 0 0 355.460 3.596 20 5 FHBDRN CC(C)c1sc(NC(=O)Cn2ccc([N+](=O)[O-])n2)nc1-c1ccccc1 ZINC000053052584 948010927 /nfs/dbraw/zinc/01/09/27/948010927.db2.gz ZQPAQFJGCRVVIN-UHFFFAOYSA-N 0 0 371.422 3.677 20 5 FHBDRN Cc1nn(CC(C)C)c(C)c1CCC(=O)Oc1cccc([N+](=O)[O-])c1C ZINC000051705149 948017139 /nfs/dbraw/zinc/01/71/39/948017139.db2.gz XQLKNVDDYBPVON-UHFFFAOYSA-N 0 0 359.426 3.911 20 5 FHBDRN CC(C)Oc1ccc(F)cc1N[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000066966668 948020881 /nfs/dbraw/zinc/02/08/81/948020881.db2.gz KSCIMSIFKNLJHY-LBPRGKRZSA-N 0 0 361.373 3.960 20 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CCC[C@@H](C)NC(=O)[C@H]1CCCN(c2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000432331903 948129750 /nfs/dbraw/zinc/12/97/50/948129750.db2.gz RQCHGWOLWLRMRE-OLZOCXBDSA-N 0 0 353.850 3.769 20 5 FHBDRN CN(C)c1cccc(CN(C)C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000432333192 948139352 /nfs/dbraw/zinc/13/93/52/948139352.db2.gz AFMGRZOOMVNMSJ-UHFFFAOYSA-N 0 0 355.438 3.597 20 5 FHBDRN O=[N+]([O-])c1cccc2c(N3CCO[C@@H](c4ccc(F)cc4)C3)ccnc21 ZINC000432336521 948148069 /nfs/dbraw/zinc/14/80/69/948148069.db2.gz PXXFWQPTHWFTGH-GOSISDBHSA-N 0 0 353.353 3.860 20 5 FHBDRN CCCCCC(=O)NC1CCN(c2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000432340579 948159000 /nfs/dbraw/zinc/15/90/00/948159000.db2.gz NCCBBNLVCADFKG-UHFFFAOYSA-N 0 0 353.850 3.914 20 5 FHBDRN COc1cc(CN(C)c2ccnc3c2cccc3[N+](=O)[O-])cc(OC)c1 ZINC000432338853 948162060 /nfs/dbraw/zinc/16/20/60/948162060.db2.gz YILCWYRWDQNVIA-UHFFFAOYSA-N 0 0 353.378 3.797 20 5 FHBDRN COc1cc(C(=O)Nc2c(F)cccc2F)c([N+](=O)[O-])cc1OC(F)F ZINC000585698184 948169885 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CCOC[C@H]1CCCCN1C(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000520525076 948231803 /nfs/dbraw/zinc/23/18/03/948231803.db2.gz RPLLQESOBMQGEL-MRXNPFEDSA-N 0 0 364.445 3.713 20 5 FHBDRN COC[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)C1CC1 ZINC000441542014 948238535 /nfs/dbraw/zinc/23/85/35/948238535.db2.gz GWGLRDCGQIUOFN-KRWDZBQOSA-N 0 0 356.378 3.542 20 5 FHBDRN O=[N+]([O-])c1ccccc1NCCc1nc(-c2cccc3ncccc32)no1 ZINC000585731439 948241382 /nfs/dbraw/zinc/24/13/82/948241382.db2.gz HZUDDFNLBDUFKN-UHFFFAOYSA-N 0 0 361.361 3.848 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1OC[C@@H]1COc2ccccc2O1 ZINC000585732228 948241594 /nfs/dbraw/zinc/24/15/94/948241594.db2.gz DQHYDUUNZWTQTK-LLVKDONJSA-N 0 0 366.167 3.576 20 5 FHBDRN O=[N+]([O-])c1cc(-c2nc(-c3cccc4ncccc43)no2)cc2c1OCO2 ZINC000585731582 948241938 /nfs/dbraw/zinc/24/19/38/948241938.db2.gz TZEJMTJAYCOVJL-UHFFFAOYSA-N 0 0 362.301 3.589 20 5 FHBDRN CCSc1ccc(Cl)cc1NC(=O)CCn1cc([N+](=O)[O-])cn1 ZINC000520541499 948249084 /nfs/dbraw/zinc/24/90/84/948249084.db2.gz GMJRRRKQXSSXAN-UHFFFAOYSA-N 0 0 354.819 3.586 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H]1CCC[C@@H]1Cc1ccccc1 ZINC000427593576 948253398 /nfs/dbraw/zinc/25/33/98/948253398.db2.gz LLBXPWVIOVIMPE-CRAIPNDOSA-N 0 0 354.406 3.745 20 5 FHBDRN O=C(O[C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1)c1cccc2cc[nH]c21 ZINC000759954180 948270229 /nfs/dbraw/zinc/27/02/29/948270229.db2.gz YEUMGMYRGIHLSO-HUUCEWRRSA-N 0 0 354.366 3.613 20 5 FHBDRN COC(=O)[C@@H]1CCN(C(=O)c2cccc(Cl)c2[N+](=O)[O-])c2ccccc21 ZINC000759955832 948282910 /nfs/dbraw/zinc/28/29/10/948282910.db2.gz JVBSXFASIGISAY-GFCCVEGCSA-N 0 0 374.780 3.555 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)N2CCC[C@H]2c2ccccc2)c1 ZINC000544661215 948285040 /nfs/dbraw/zinc/28/50/40/948285040.db2.gz LIQUTHJCAFUQAT-INIZCTEOSA-N 0 0 360.435 3.737 20 5 FHBDRN O=C(NCCCC(F)(F)F)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000278964523 948343975 /nfs/dbraw/zinc/34/39/75/948343975.db2.gz GWYHSNDANWMGMY-UHFFFAOYSA-N 0 0 373.253 3.755 20 5 FHBDRN CC(C)(C)OC(=O)CCC(C)(C)NC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000467425810 948380921 /nfs/dbraw/zinc/38/09/21/948380921.db2.gz SKYWOCSFOFKISE-UHFFFAOYSA-N 0 0 351.403 3.617 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1CCC[C@@H]1Cc1ccc(C)cc1 ZINC000427604796 948391622 /nfs/dbraw/zinc/39/16/22/948391622.db2.gz SBLAYCVJXWBAPP-MRXNPFEDSA-N 0 0 354.406 3.759 20 5 FHBDRN Cc1ccc(/C=C/c2nc(N(C)C)ncc2Br)cc1[N+](=O)[O-] ZINC000549626273 948392515 /nfs/dbraw/zinc/39/25/15/948392515.db2.gz MGBBPBVGGSQWIL-VOTSOKGWSA-N 0 0 363.215 3.692 20 5 FHBDRN COc1ccc(CNCc2cscc2Br)cc1[N+](=O)[O-] ZINC000512090495 948396205 /nfs/dbraw/zinc/39/62/05/948396205.db2.gz WMYHYONMRLZFKV-UHFFFAOYSA-N 0 0 357.229 3.717 20 5 FHBDRN O=[N+]([O-])c1cc(Br)cnc1N1CC[C@](F)(c2ccccc2)C1 ZINC000520614721 948399373 /nfs/dbraw/zinc/39/93/73/948399373.db2.gz HUSZPCMQNFLDGK-OAHLLOKOSA-N 0 0 366.190 3.827 20 5 FHBDRN CCc1cnc(CCNC(=O)c2c([N+](=O)[O-])cccc2C(F)(F)F)s1 ZINC000574726839 948400309 /nfs/dbraw/zinc/40/03/09/948400309.db2.gz RQBYQSSEKPHHKT-UHFFFAOYSA-N 0 0 373.356 3.605 20 5 FHBDRN C[C@H](CC(C)(C)c1ccccc1)NC(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000520617000 948410332 /nfs/dbraw/zinc/41/03/32/948410332.db2.gz HIDWFCADWZCTHJ-OAHLLOKOSA-N 0 0 356.422 3.846 20 5 FHBDRN O=[N+]([O-])c1cccc(F)c1OC[C@@H](O)CO[C@H]1CCCc2ccccc21 ZINC000184775434 948425894 /nfs/dbraw/zinc/42/58/94/948425894.db2.gz XZHCCZDENXLKQE-KSSFIOAISA-N 0 0 361.369 3.568 20 5 FHBDRN NC(=O)c1cccc(NCC2(Cc3ccccc3)CCCC2)c1[N+](=O)[O-] ZINC000574744631 948438371 /nfs/dbraw/zinc/43/83/71/948438371.db2.gz HYUAMAMBQFPHBL-UHFFFAOYSA-N 0 0 353.422 3.909 20 5 FHBDRN C[C@H](Nc1ncnc2sc([N+](=O)[O-])cc21)c1ccc(-n2cccn2)cc1 ZINC000520629518 948442439 /nfs/dbraw/zinc/44/24/39/948442439.db2.gz PEUKDGZDJFLSQK-NSHDSACASA-N 0 0 366.406 3.958 20 5 FHBDRN Cc1ccc(C(=O)Nc2ccc(NC[C@H]3CCCO3)c(F)c2)cc1[N+](=O)[O-] ZINC000129578215 948442501 /nfs/dbraw/zinc/44/25/01/948442501.db2.gz BVLZFLUDYVFYAT-OAHLLOKOSA-N 0 0 373.384 3.886 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)N[C@H]1CCc2cc(F)ccc21 ZINC000512115152 948459182 /nfs/dbraw/zinc/45/91/82/948459182.db2.gz WWOFOERFRGDCKS-SFHVURJKSA-N 0 0 357.385 3.605 20 5 FHBDRN O=C(NCC1(c2cccc(F)c2)CC1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000087119853 948476348 /nfs/dbraw/zinc/47/63/48/948476348.db2.gz ZKDQJGRYBRQRQW-UHFFFAOYSA-N 0 0 369.396 3.533 20 5 FHBDRN C[C@H](CNC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)Cc1cccs1 ZINC000087125352 948476712 /nfs/dbraw/zinc/47/67/12/948476712.db2.gz OSIXDZFFXPZUCG-ZDUSSCGKSA-N 0 0 359.451 3.603 20 5 FHBDRN CN(Cc1ccco1)C(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000279092391 948493313 /nfs/dbraw/zinc/49/33/13/948493313.db2.gz TYMAQFJHYZRFQA-UHFFFAOYSA-N 0 0 357.288 3.548 20 5 FHBDRN CSc1ccc(C(=O)Nc2ccc(-n3cccn3)cc2)cc1[N+](=O)[O-] ZINC000032238793 948520143 /nfs/dbraw/zinc/52/01/43/948520143.db2.gz CQOOGVLDSRCBPX-UHFFFAOYSA-N 0 0 354.391 3.755 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)NCc1nc(C)c2ccccc2n1 ZINC000574800653 948520441 /nfs/dbraw/zinc/52/04/41/948520441.db2.gz UPAXAPIMIAUFHR-UHFFFAOYSA-N 0 0 365.393 3.731 20 5 FHBDRN Cc1cc(C(=O)N(C)Cc2csc3ccccc23)c(N)c([N+](=O)[O-])c1 ZINC000729520860 948533363 /nfs/dbraw/zinc/53/33/63/948533363.db2.gz UJJXGCHFUJREMY-UHFFFAOYSA-N 0 0 355.419 3.972 20 5 FHBDRN CCC(C)(C)C1CCC2(C[C@H]2C(=O)NCCn2cc([N+](=O)[O-])cn2)CC1 ZINC000517948137 948540411 /nfs/dbraw/zinc/54/04/11/948540411.db2.gz DIBHVXXPJGUSCC-RCDNUKIMSA-N 0 0 362.474 3.540 20 5 FHBDRN Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)c1csc([N+](=O)[O-])c1 ZINC000050382495 948554831 /nfs/dbraw/zinc/55/48/31/948554831.db2.gz FVRRRFXKFOGBAQ-UHFFFAOYSA-N 0 0 361.423 3.603 20 5 FHBDRN CC[C@](C)(NC(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-])c1ccccc1 ZINC000107512715 948557016 /nfs/dbraw/zinc/55/70/16/948557016.db2.gz XESIBDJSLQZWPG-IBGZPJMESA-N 0 0 358.394 3.667 20 5 FHBDRN Cc1ccc(C(=O)N(CCC(F)(F)F)CC(F)(F)F)cc1[N+](=O)[O-] ZINC000279161156 948562923 /nfs/dbraw/zinc/56/29/23/948562923.db2.gz BLTINAXPKCNJDQ-UHFFFAOYSA-N 0 0 358.238 3.860 20 5 FHBDRN CC(C)n1c(-c2ccc([N+](=O)[O-])cc2)nnc1N1C[C@@H](C)OC2(CCC2)C1 ZINC000571088784 948576940 /nfs/dbraw/zinc/57/69/40/948576940.db2.gz UAYRYJKXHYPTOC-CQSZACIVSA-N 0 0 371.441 3.582 20 5 FHBDRN O=C(NCc1ccc(Br)cc1Cl)c1ccccc1[N+](=O)[O-] ZINC000520684014 948580995 /nfs/dbraw/zinc/58/09/95/948580995.db2.gz MULSMGLTOHLNGJ-UHFFFAOYSA-N 0 0 369.602 3.941 20 5 FHBDRN O=C(/C=C/c1ccccc1[N+](=O)[O-])O[C@@H]([C@H]1CCCOC1)C(F)(F)F ZINC000279175149 948581750 /nfs/dbraw/zinc/58/17/50/948581750.db2.gz HVWOITMPEJBRGQ-AVDDZBROSA-N 0 0 359.300 3.509 20 5 FHBDRN Cc1ccc(C(=O)C2CCN(c3ccc([N+](=O)[O-])cc3[N+](=O)[O-])CC2)cc1 ZINC000054124111 948591982 /nfs/dbraw/zinc/59/19/82/948591982.db2.gz CVEJZKNFPSNPFG-UHFFFAOYSA-N 0 0 369.377 3.911 20 5 FHBDRN Cc1ccccc1C1(C(=O)OCCCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC000727016128 948592390 /nfs/dbraw/zinc/59/23/90/948592390.db2.gz SBEFZUBYYKJLKY-UHFFFAOYSA-N 0 0 355.390 3.947 20 5 FHBDRN Cc1nn(C)c(CN[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1Br ZINC000279183995 948593724 /nfs/dbraw/zinc/59/37/24/948593724.db2.gz SGXYRBJUWOIXOD-JTQLQIEISA-N 0 0 367.247 3.558 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc(OC[C@H]2CCCO2)cc1 ZINC000087134551 948601529 /nfs/dbraw/zinc/60/15/29/948601529.db2.gz BMCRKVGVEHLDLB-LJQANCHMSA-N 0 0 370.405 3.724 20 5 FHBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCC[C@@]3(CC=CCC3)C2)c(Cl)c1 ZINC000512165314 948609183 /nfs/dbraw/zinc/60/91/83/948609183.db2.gz QJXCHNKWVBZIGG-INIZCTEOSA-N 0 0 370.858 3.759 20 5 FHBDRN CC[C@@H](C)[C@H](C(=O)OCC(=O)Nc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000005682609 948629090 /nfs/dbraw/zinc/62/90/90/948629090.db2.gz CQOMHHGHOHPMCE-KUHUBIRLSA-N 0 0 370.405 3.906 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N1CCOc2cc(F)ccc21 ZINC000151434388 948630810 /nfs/dbraw/zinc/63/08/10/948630810.db2.gz NHUXIURWPATJIJ-UHFFFAOYSA-N 0 0 370.258 3.792 20 5 FHBDRN Cc1nn(CCC(=O)N2CC[C@H](c3ccccc3)C[C@@H]2C)c(C)c1[N+](=O)[O-] ZINC000466894574 948634230 /nfs/dbraw/zinc/63/42/30/948634230.db2.gz STYVDPZEUGXRHL-KSSFIOAISA-N 0 0 370.453 3.593 20 5 FHBDRN Cc1cccc(N2CCN(c3nccc4sccc43)CC2)c1[N+](=O)[O-] ZINC000571583901 948638385 /nfs/dbraw/zinc/63/83/85/948638385.db2.gz DRAXFWKNSNZLSH-UHFFFAOYSA-N 0 0 354.435 3.840 20 5 FHBDRN COc1cc(C(=O)Nc2ccc(OC)c3cccnc23)cc([N+](=O)[O-])c1C ZINC000571588008 948648018 /nfs/dbraw/zinc/64/80/18/948648018.db2.gz SSRVVKFJZOMSQA-UHFFFAOYSA-N 0 0 367.361 3.721 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)Nc2cn(CC(C)C)nc2C(F)F)c1 ZINC000536460191 948660532 /nfs/dbraw/zinc/66/05/32/948660532.db2.gz UYKKWQUHPLDTMI-UHFFFAOYSA-N 0 0 368.340 3.646 20 5 FHBDRN Cc1cc(S(=O)(=O)Nc2cccc([N+](=O)[O-])c2C)ccc1OC(C)C ZINC000536461167 948661850 /nfs/dbraw/zinc/66/18/50/948661850.db2.gz WSWFPXXNCWSYDR-UHFFFAOYSA-N 0 0 364.423 3.800 20 5 FHBDRN CC(=O)Nc1cccc(NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)c1C ZINC000129599535 948713588 /nfs/dbraw/zinc/71/35/88/948713588.db2.gz PZJZXFWEIULHHD-UHFFFAOYSA-N 0 0 366.377 3.524 20 5 FHBDRN COc1cc(OC)cc(N2CC[C@@H](Sc3cccc([N+](=O)[O-])c3)C2=O)c1 ZINC000509733268 948715367 /nfs/dbraw/zinc/71/53/67/948715367.db2.gz ZUSSOJPHTNGBEW-QGZVFWFLSA-N 0 0 374.418 3.510 20 5 FHBDRN O=C(N[C@@H](c1ccccc1)[C@H]1CCCO1)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000536483755 948729016 /nfs/dbraw/zinc/72/90/16/948729016.db2.gz XIMQUPOPBVYEMA-MJGOQNOKSA-N 0 0 365.389 3.726 20 5 FHBDRN COc1ccc(CNC(=O)[C@H](C)Cn2ccc3ccccc32)cc1[N+](=O)[O-] ZINC000507809667 948745319 /nfs/dbraw/zinc/74/53/19/948745319.db2.gz VIJVFDBKVFMQSB-CQSZACIVSA-N 0 0 367.405 3.511 20 5 FHBDRN CC(C)Oc1ccc(N[C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)cc1 ZINC000067452383 948759459 /nfs/dbraw/zinc/75/94/59/948759459.db2.gz BTTXCXAVLFXJOM-GOSISDBHSA-N 0 0 355.394 3.599 20 5 FHBDRN CCOc1cc(-c2noc(/C=C\c3ccccc3[N+](=O)[O-])n2)ccc1O ZINC000445426190 948785318 /nfs/dbraw/zinc/78/53/18/948785318.db2.gz IKSQYWXIHNDSKC-NTMALXAHSA-N 0 0 353.334 3.920 20 5 FHBDRN COc1ccc(CC(=O)NCc2oc3ccc(F)cc3c2C)cc1[N+](=O)[O-] ZINC000524018175 948786029 /nfs/dbraw/zinc/78/60/29/948786029.db2.gz HIUYRZWQHGBMEU-UHFFFAOYSA-N 0 0 372.352 3.656 20 5 FHBDRN O=C(Cc1cccc(C2CC2)c1)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2 ZINC000414760739 948801487 /nfs/dbraw/zinc/80/14/87/948801487.db2.gz ZJRLVWNIICLOMI-UHFFFAOYSA-N 0 0 368.389 3.815 20 5 FHBDRN COC(=O)[C@@H](N[C@@H](C)CCc1ccccc1[N+](=O)[O-])c1ccc(F)c(C)c1 ZINC000428403158 948809788 /nfs/dbraw/zinc/80/97/88/948809788.db2.gz JIILFZCIQOPXCR-LIRRHRJNSA-N 0 0 374.412 3.867 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CC(C)(C)O[C@@H]2CCC[C@H]21 ZINC000441767324 948815007 /nfs/dbraw/zinc/81/50/07/948815007.db2.gz QBLIZAUIMWQOSK-GDBMZVCRSA-N 0 0 363.414 3.557 20 5 FHBDRN CC(C)c1ccc(Sc2ccc(S(N)(=O)=O)cc2[N+](=O)[O-])cc1 ZINC000106262626 210161741 /nfs/dbraw/zinc/16/17/41/210161741.db2.gz BTAZCHSSIIGERR-UHFFFAOYSA-N 0 0 352.437 3.517 20 5 FHBDRN CCN(CC)C(=O)c1ccc(Nc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1 ZINC000007271150 210152877 /nfs/dbraw/zinc/15/28/77/210152877.db2.gz TWDNWQLEWOXQSP-UHFFFAOYSA-N 0 0 358.354 3.729 20 5 FHBDRN COc1ccc2[nH]c(S[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3)nc2c1 ZINC000008759447 210098095 /nfs/dbraw/zinc/09/80/95/210098095.db2.gz JJZATXRLLUENMJ-SNVBAGLBSA-N 0 0 372.406 3.599 20 5 FHBDRN O=C1c2ccc([N+](=O)[O-])cc2C(=O)N1Cc1csc(-c2ccsc2)n1 ZINC000007554995 210094283 /nfs/dbraw/zinc/09/42/83/210094283.db2.gz RRZMZZDWQHPSLA-UHFFFAOYSA-N 0 0 371.399 3.576 20 5 FHBDRN CC(=O)Nc1ccc(NC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)cc1 ZINC000007399559 210095338 /nfs/dbraw/zinc/09/53/38/210095338.db2.gz MXNRDDANSNXJHF-LLVKDONJSA-N 0 0 359.407 3.673 20 5 FHBDRN COc1ccc(NC(=O)CSc2ccc3ccccc3n2)c([N+](=O)[O-])c1 ZINC000005627550 210085884 /nfs/dbraw/zinc/08/58/84/210085884.db2.gz BSHSDZHSUCNFQX-UHFFFAOYSA-N 0 0 369.402 3.882 20 5 FHBDRN O=C(CSc1nc2ccccc2[nH]1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000004829999 210079702 /nfs/dbraw/zinc/07/97/02/210079702.db2.gz HAVUBYHGCCKTPB-UHFFFAOYSA-N 0 0 362.798 3.855 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)Sc1ccc(F)cc1 ZINC000003512093 210077736 /nfs/dbraw/zinc/07/77/36/210077736.db2.gz WWBJMUTYZNHTGO-SNVBAGLBSA-N 0 0 350.371 3.862 20 5 FHBDRN CCN(CC)C(=O)CSc1nc2ccccc2c2nc3ccccc3n21 ZINC000003489548 210077398 /nfs/dbraw/zinc/07/73/98/210077398.db2.gz BOAPIQFIHFCIEG-UHFFFAOYSA-N 0 0 364.474 3.996 20 5 FHBDRN Cc1c(C(=O)Nc2ccc(C(=O)NC3CCCC3)cc2)cccc1[N+](=O)[O-] ZINC000055592194 211952132 /nfs/dbraw/zinc/95/21/32/211952132.db2.gz FWUQHPSKUWJOSX-UHFFFAOYSA-N 0 0 367.405 3.828 20 5 FHBDRN Cn1cc(C(=O)Nc2nc(C3CC3)cs2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000053799617 211922730 /nfs/dbraw/zinc/92/27/30/211922730.db2.gz ACSIBMLQXUIKHD-UHFFFAOYSA-N 0 0 369.406 3.582 20 5 FHBDRN C[C@@H]1c2ccsc2CCN1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000052070776 211905370 /nfs/dbraw/zinc/90/53/70/211905370.db2.gz QLRRFWMQYGKXJX-LLVKDONJSA-N 0 0 356.407 3.826 20 5 FHBDRN COc1ccc(Br)c(C(=O)Nc2ccc([N+](=O)[O-])cc2)c1 ZINC000019161335 220239470 /nfs/dbraw/zinc/23/94/70/220239470.db2.gz QAQIFLZYNMHCGL-UHFFFAOYSA-N 0 0 351.156 3.618 20 5 FHBDRN Cc1cccc(CNC(=O)Cn2c3ccccc3c(=O)c3ccccc32)c1 ZINC000026024121 211440316 /nfs/dbraw/zinc/44/03/16/211440316.db2.gz HMTVHMRVORCFAC-UHFFFAOYSA-N 0 0 356.425 3.780 20 5 FHBDRN Cc1cc(C(=O)N(C)Cc2ccccc2N2CCCC2)ccc1[N+](=O)[O-] ZINC000024190885 211402874 /nfs/dbraw/zinc/40/28/74/211402874.db2.gz WRRFFTLTQNZXEG-UHFFFAOYSA-N 0 0 353.422 3.776 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2nnc(CSc3ncc4ccccn43)o2)cc1 ZINC000022616168 211357105 /nfs/dbraw/zinc/35/71/05/211357105.db2.gz HWJBHWFXGGATSN-UHFFFAOYSA-N 0 0 353.363 3.585 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCC(=O)Nc2ccccc2C(F)(F)F)c1 ZINC000021614322 211316690 /nfs/dbraw/zinc/31/66/90/211316690.db2.gz UCYLDPTVSHRYAW-UHFFFAOYSA-N 0 0 354.284 3.940 20 5 FHBDRN O=C(CSc1ccc(C(F)(F)F)cn1)Nc1ccc([N+](=O)[O-])cc1 ZINC000021635826 211319526 /nfs/dbraw/zinc/31/95/26/211319526.db2.gz QHRZSMLWABZSCE-UHFFFAOYSA-N 0 0 357.313 3.739 20 5 FHBDRN C[C@H](Oc1cccnc1[N+](=O)[O-])C(=O)Nc1cc(Cl)ccc1Cl ZINC000020982102 211300553 /nfs/dbraw/zinc/30/05/53/211300553.db2.gz QAOGCYFLWHGDGV-QMMMGPOBSA-N 0 0 356.165 3.703 20 5 FHBDRN C[C@H](Oc1ccccc1Br)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000021126271 211307865 /nfs/dbraw/zinc/30/78/65/211307865.db2.gz BEVKLZRTRFKNGA-JTQLQIEISA-N 0 0 365.183 3.763 20 5 FHBDRN CCOc1ccc([C@@H](C)NC(=O)c2ccccc2[N+](=O)[O-])cc1OCC ZINC000015966450 211151461 /nfs/dbraw/zinc/15/14/61/211151461.db2.gz QXTWXRMNNCLAGK-CYBMUJFWSA-N 0 0 358.394 3.883 20 5 FHBDRN CCOc1cc(C(=O)Nc2ccc(F)cc2F)c([N+](=O)[O-])cc1OC ZINC000015657819 211134081 /nfs/dbraw/zinc/13/40/81/211134081.db2.gz OODLSWGMOPKZOF-UHFFFAOYSA-N 0 0 352.293 3.533 20 5 FHBDRN Cc1ccc(NC(=O)CNc2cccc([N+](=O)[O-])c2)c(Br)c1 ZINC000015085789 211121997 /nfs/dbraw/zinc/12/19/97/211121997.db2.gz GOSRMJQDSBXWPT-UHFFFAOYSA-N 0 0 364.199 3.716 20 5 FHBDRN Cc1ccc(NC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)c(Cl)c1 ZINC000014861205 211102923 /nfs/dbraw/zinc/10/29/23/211102923.db2.gz JDDZAFLFYHLLPC-UHFFFAOYSA-N 0 0 356.769 3.995 20 5 FHBDRN Cc1ccc(C(=O)N(C)Cc2ccccc2Br)cc1[N+](=O)[O-] ZINC000027503073 220534143 /nfs/dbraw/zinc/53/41/43/220534143.db2.gz BHOIWCWYJGCOHT-UHFFFAOYSA-N 0 0 363.211 3.938 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1cc2c(cc1Cl)OCCCO2 ZINC000067032090 221247833 /nfs/dbraw/zinc/24/78/33/221247833.db2.gz URKYRPWMTWKUNX-UHFFFAOYSA-N 0 0 362.769 3.970 20 5 FHBDRN CC(C)c1ccc([C@@]2(C)NC(=O)N(Cc3ccccc3[N+](=O)[O-])C2=O)cc1 ZINC000068951899 221319569 /nfs/dbraw/zinc/31/95/69/221319569.db2.gz ZMZAMWNLUQLHQP-HXUWFJFHSA-N 0 0 367.405 3.685 20 5 FHBDRN CSc1nc(-c2ccco2)nc(C)c1C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000071838897 221381630 /nfs/dbraw/zinc/38/16/30/221381630.db2.gz BKTRFEUZJKEFON-UHFFFAOYSA-N 0 0 370.390 3.927 20 5 FHBDRN CCN(CC(F)(F)F)C(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000071874669 221384633 /nfs/dbraw/zinc/38/46/33/221384633.db2.gz PLCYQWVKCUDICL-UHFFFAOYSA-N 0 0 362.351 3.566 20 5 FHBDRN CC(C)[C@@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)OCCO2 ZINC000071801317 221377615 /nfs/dbraw/zinc/37/76/15/221377615.db2.gz SPDXAINHQGPAJI-GOSISDBHSA-N 0 0 371.393 3.885 20 5 FHBDRN Cc1c(C(=O)Nc2ccccc2NC(=O)NC(C)C)cccc1[N+](=O)[O-] ZINC000072010695 221395792 /nfs/dbraw/zinc/39/57/92/221395792.db2.gz IVSCZUXXSWVIJA-UHFFFAOYSA-N 0 0 356.382 3.685 20 5 FHBDRN Cc1nc2ccccc2c(S[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)n1 ZINC000072205074 221452400 /nfs/dbraw/zinc/45/24/00/221452400.db2.gz NPVZYDFWYDQGFW-LLVKDONJSA-N 0 0 368.418 3.966 20 5 FHBDRN Cc1cc(C)c(NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)c(C)n1 ZINC000097040245 132305328 /nfs/dbraw/zinc/30/53/28/132305328.db2.gz BPIXVOJVLWSYRA-UHFFFAOYSA-N 0 0 368.437 3.770 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)N(CCO)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000097176808 222167311 /nfs/dbraw/zinc/16/73/11/222167311.db2.gz WCFYARUKALJYMS-UHFFFAOYSA-N 0 0 356.422 3.527 20 5 FHBDRN C[C@H](NC(=O)Cc1ccccc1[N+](=O)[O-])c1ccc(OC(F)(F)F)cc1 ZINC000105992202 222380475 /nfs/dbraw/zinc/38/04/75/222380475.db2.gz NIZKYXQTBWZTQE-NSHDSACASA-N 0 0 368.311 3.913 20 5 FHBDRN O=C(Nc1ccc(-n2ccnc2)c(F)c1)c1ccc([N+](=O)[O-])cc1Cl ZINC000108576675 222423963 /nfs/dbraw/zinc/42/39/63/222423963.db2.gz PJKXCUUPEDFKRR-UHFFFAOYSA-N 0 0 360.732 3.825 20 5 FHBDRN CCOc1cccc([C@@H]2C[C@@H]2NC(=O)Nc2ccc([N+](=O)[O-])cc2F)c1 ZINC000541785533 567821046 /nfs/dbraw/zinc/82/10/46/567821046.db2.gz VVDJMWUYJWDLJL-YOEHRIQHSA-N 0 0 359.357 3.810 20 5 FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@H](C2CC2)C1 ZINC000290929592 567823450 /nfs/dbraw/zinc/82/34/50/567823450.db2.gz OTZIKVXAOZPSNX-AWEZNQCLSA-N 0 0 364.467 3.596 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)NCCNc1nc2ccccc2s1 ZINC000043148880 567827920 /nfs/dbraw/zinc/82/79/20/567827920.db2.gz SUGYNYXPSOKJIB-UHFFFAOYSA-N 0 0 371.422 3.747 20 5 FHBDRN CCCCn1ncc(C(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)c1C ZINC000452863667 567829701 /nfs/dbraw/zinc/82/97/01/567829701.db2.gz VTACREXLSBRFKM-QGZVFWFLSA-N 0 0 370.453 3.920 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H](OC)C(C)(C)C1 ZINC000452862078 567834534 /nfs/dbraw/zinc/83/45/34/567834534.db2.gz KNVWHTVMLMISJY-MRXNPFEDSA-N 0 0 366.483 3.984 20 5 FHBDRN CC(C)(C)n1cc(C(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cn1 ZINC000452867130 567834545 /nfs/dbraw/zinc/83/45/45/567834545.db2.gz YEZUTAXNPAHEJB-OAHLLOKOSA-N 0 0 356.426 3.566 20 5 FHBDRN CO[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CC1(C)C ZINC000452862000 567838650 /nfs/dbraw/zinc/83/86/50/567838650.db2.gz JWLWPHCOJYMXOF-CYBMUJFWSA-N 0 0 360.332 3.501 20 5 FHBDRN CC[C@H](c1nnc(SCCn2c(C)ncc2[N+](=O)[O-])o1)c1ccccc1 ZINC000601913564 567872894 /nfs/dbraw/zinc/87/28/94/567872894.db2.gz SHUJWKNKBXPJKC-AWEZNQCLSA-N 0 0 373.438 3.817 20 5 FHBDRN CCCN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2F)c2ccc(F)cc21 ZINC000481384643 567883066 /nfs/dbraw/zinc/88/30/66/567883066.db2.gz AVLJLBOQSFKTTI-UHFFFAOYSA-N 0 0 361.348 3.750 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2nnc(N3C[C@@H]4CCCC[C@@H]4C3)n2C2CC2)cc1 ZINC000568105746 567886194 /nfs/dbraw/zinc/88/61/94/567886194.db2.gz UVMDHZUBRAYQDU-GASCZTMLSA-N 0 0 353.426 3.815 20 5 FHBDRN O=C(c1ccc2nccnc2c1)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452880842 567896555 /nfs/dbraw/zinc/89/65/55/567896555.db2.gz NXDMBJOBFPRQTB-MRXNPFEDSA-N 0 0 362.389 3.558 20 5 FHBDRN COc1cccc(CC(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000452887411 567896759 /nfs/dbraw/zinc/89/67/59/567896759.db2.gz SBSOWYXLIXOGRT-QGZVFWFLSA-N 0 0 354.406 3.552 20 5 FHBDRN CO[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)C[C@H]1C ZINC000452895956 567909352 /nfs/dbraw/zinc/90/93/52/567909352.db2.gz SZOBMZNMZUZMNB-KDOFPFPSSA-N 0 0 370.405 3.884 20 5 FHBDRN C[C@@H](OCc1ccccc1)C(=O)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452892409 567911164 /nfs/dbraw/zinc/91/11/64/567911164.db2.gz VZIRPTFVTAQSJZ-VQIMIIECSA-N 0 0 368.433 3.906 20 5 FHBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCN(C)c2ccccc2C1 ZINC000517908348 567913981 /nfs/dbraw/zinc/91/39/81/567913981.db2.gz UTWXHPBJFJGUCB-UHFFFAOYSA-N 0 0 355.438 3.834 20 5 FHBDRN O=C(C[C@H]1OCCc2ccsc21)Nc1cccc([N+](=O)[O-])c1Cl ZINC000366016617 567927744 /nfs/dbraw/zinc/92/77/44/567927744.db2.gz IBVDCTYUYBBEQF-GFCCVEGCSA-N 0 0 352.799 3.952 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1Cl)c1cncc(-c2ccccn2)c1 ZINC000366017009 567928346 /nfs/dbraw/zinc/92/83/46/567928346.db2.gz KMXPHXKBQCOKEF-UHFFFAOYSA-N 0 0 354.753 3.958 20 5 FHBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N(c2ccccc2F)C2CCCC2)cc1 ZINC000481435741 567937760 /nfs/dbraw/zinc/93/77/60/567937760.db2.gz BBSTUGFAJFMHHQ-UHFFFAOYSA-N 0 0 364.398 3.872 20 5 FHBDRN O=C(c1ccc(Cl)cc1O)N1CCS[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000436586617 567945501 /nfs/dbraw/zinc/94/55/01/567945501.db2.gz BVSSHKJWWKZCAO-INIZCTEOSA-N 0 0 364.810 3.842 20 5 FHBDRN CC[C@H]1[C@H](CO)CCN1C(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000452924199 567956536 /nfs/dbraw/zinc/95/65/36/567956536.db2.gz KTWXIPVWQFGHPC-YJBOKZPZSA-N 0 0 369.421 3.571 20 5 FHBDRN CC(C)(CCc1noc(-c2ccnc(-c3ccc(Cl)cc3)n2)n1)[N+](=O)[O-] ZINC000291020828 567963792 /nfs/dbraw/zinc/96/37/92/567963792.db2.gz CNRHJIVEFSWDMK-UHFFFAOYSA-N 0 0 373.800 3.835 20 5 FHBDRN Cc1c(CNC(=O)c2cn(C)nc2C2CCCCC2)cccc1[N+](=O)[O-] ZINC000481468933 567966158 /nfs/dbraw/zinc/96/61/58/567966158.db2.gz XKQDLZVGWIZRSW-UHFFFAOYSA-N 0 0 356.426 3.614 20 5 FHBDRN Cc1c(CNC(=O)c2c[nH]nc2-c2cccc(Cl)c2)cccc1[N+](=O)[O-] ZINC000481470210 567967297 /nfs/dbraw/zinc/96/72/97/567967297.db2.gz WWVIMQUTLYSOMF-UHFFFAOYSA-N 0 0 370.796 3.877 20 5 FHBDRN CC(C)(CCc1noc(-c2ccc(Oc3cccnc3)cc2)n1)[N+](=O)[O-] ZINC000291030669 567973004 /nfs/dbraw/zinc/97/30/04/567973004.db2.gz DYKSQIPBQQSKPF-UHFFFAOYSA-N 0 0 354.366 3.912 20 5 FHBDRN O=[N+]([O-])c1ccc(Nc2cnn(-c3ccccn3)c2)c(Br)c1 ZINC000541845647 567976738 /nfs/dbraw/zinc/97/67/38/567976738.db2.gz FYXMEMXHXLZIPR-UHFFFAOYSA-N 0 0 360.171 3.682 20 5 FHBDRN Cc1c(CNC(=O)CCCCC(=O)c2ccccc2)cccc1[N+](=O)[O-] ZINC000481475932 567977499 /nfs/dbraw/zinc/97/74/99/567977499.db2.gz LSMNRASCOUNUMV-UHFFFAOYSA-N 0 0 354.406 3.963 20 5 FHBDRN Cc1c(CNC(=O)[C@H]2CCCC[N@@H+]2Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000481479081 567977633 /nfs/dbraw/zinc/97/76/33/567977633.db2.gz PLGBLRBDAQMWJT-HXUWFJFHSA-N 0 0 367.449 3.574 20 5 FHBDRN COc1ccc(C(=O)NCc2cccc([N+](=O)[O-])c2C)c(OCC2CC2)c1 ZINC000481479954 567979366 /nfs/dbraw/zinc/97/93/66/567979366.db2.gz KSTMCXHCNORPQP-UHFFFAOYSA-N 0 0 370.405 3.631 20 5 FHBDRN COc1cc(Cl)c(C(=O)NCc2cccc([N+](=O)[O-])c2C)cc1OC ZINC000481491325 567986762 /nfs/dbraw/zinc/98/67/62/567986762.db2.gz KXEYCLPVCIWYOR-UHFFFAOYSA-N 0 0 364.785 3.504 20 5 FHBDRN Cc1ccc(-c2nc(C(=O)NCc3cccc([N+](=O)[O-])c3C)cs2)o1 ZINC000481485404 567988254 /nfs/dbraw/zinc/98/82/54/567988254.db2.gz ZAEOEUILBVOJII-UHFFFAOYSA-N 0 0 357.391 3.858 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2C[C@H](c3ccc(F)cc3)C2)c1 ZINC000481494562 567999076 /nfs/dbraw/zinc/99/90/76/567999076.db2.gz LQAYMSKONKPMJD-CTYIDZIISA-N 0 0 358.369 3.809 20 5 FHBDRN Cc1cc(C)n(-c2ccc(C(=O)NCc3cccc([N+](=O)[O-])c3C)cc2)n1 ZINC000481495933 568004636 /nfs/dbraw/zinc/00/46/36/568004636.db2.gz UHUVAQLMZVCJGO-UHFFFAOYSA-N 0 0 364.405 3.636 20 5 FHBDRN COc1ccc(C2(C(=O)NCc3cccc([N+](=O)[O-])c3C)CCC2)cc1 ZINC000481502051 568005524 /nfs/dbraw/zinc/00/55/24/568005524.db2.gz NMOOMNAKSUKKOE-UHFFFAOYSA-N 0 0 354.406 3.650 20 5 FHBDRN CCOc1ccc(-c2nc(Cn3cc([N+](=O)[O-])c(C)cc3=O)cs2)cc1 ZINC000128568684 568015621 /nfs/dbraw/zinc/01/56/21/568015621.db2.gz YVCQVGCVLDKULV-UHFFFAOYSA-N 0 0 371.418 3.635 20 5 FHBDRN O=C(Cc1ccccc1Cl)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000568320261 568024029 /nfs/dbraw/zinc/02/40/29/568024029.db2.gz PEPWHUZESZCJIJ-UHFFFAOYSA-N 0 0 357.797 3.631 20 5 FHBDRN O=C(Nc1nnc(C2CC2)s1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000064867433 568027216 /nfs/dbraw/zinc/02/72/16/568027216.db2.gz LWKQJTBYDPJCLU-UHFFFAOYSA-N 0 0 373.419 3.700 20 5 FHBDRN Cc1c(CNC(=O)CCCOCCc2ccccc2)cccc1[N+](=O)[O-] ZINC000481503390 568031754 /nfs/dbraw/zinc/03/17/54/568031754.db2.gz SVRKCYKGQLYJBY-UHFFFAOYSA-N 0 0 356.422 3.559 20 5 FHBDRN CC(C)c1sc(NC(=O)c2cc([N+](=O)[O-])nn2C)nc1-c1ccccc1 ZINC000481511155 568031774 /nfs/dbraw/zinc/03/17/74/568031774.db2.gz OPZWYXBGXOIZMP-UHFFFAOYSA-N 0 0 371.422 3.828 20 5 FHBDRN COc1ccc(CC(=O)N2CC[C@@](F)(c3ccccc3C)C2)cc1[N+](=O)[O-] ZINC000568415627 568032042 /nfs/dbraw/zinc/03/20/42/568032042.db2.gz CIAFZTAYBJBQHE-FQEVSTJZSA-N 0 0 372.396 3.552 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(-c2nc(-c3nccc4[nH]ccc43)no2)c1 ZINC000568376045 568035378 /nfs/dbraw/zinc/03/53/78/568035378.db2.gz BFIWRYSLLZJWGE-UHFFFAOYSA-N 0 0 351.322 3.587 20 5 FHBDRN CC(C)(C(=O)NC[C@]1(C)OCCc2sccc21)c1ccccc1[N+](=O)[O-] ZINC000568376761 568035389 /nfs/dbraw/zinc/03/53/89/568035389.db2.gz KJVRMFTVSXMXQP-IBGZPJMESA-N 0 0 374.462 3.538 20 5 FHBDRN C[C@](O)(C1CCN(c2nccc3cc([N+](=O)[O-])ccc32)CC1)C(F)(F)F ZINC000568474205 568042407 /nfs/dbraw/zinc/04/24/07/568042407.db2.gz SEXIFWVFJGZTGY-INIZCTEOSA-N 0 0 369.343 3.673 20 5 FHBDRN CC(C)(C)c1coc(NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)n1 ZINC000568527947 568047089 /nfs/dbraw/zinc/04/70/89/568047089.db2.gz FXROVBSXCOUCOR-UHFFFAOYSA-N 0 0 358.398 3.733 20 5 FHBDRN C[C@H]1[C@@H](C(F)(F)F)CCCN1c1nnc(-c2ccc([N+](=O)[O-])cc2)n1C ZINC000568566537 568048657 /nfs/dbraw/zinc/04/86/57/568048657.db2.gz FRZWPHZKSPTSMY-GWCFXTLKSA-N 0 0 369.347 3.558 20 5 FHBDRN CC(C)(CCc1noc(Cc2cccc(OC(F)(F)F)c2)n1)[N+](=O)[O-] ZINC000291120867 568053162 /nfs/dbraw/zinc/05/31/62/568053162.db2.gz UXAOUIJLIAAFQI-UHFFFAOYSA-N 0 0 359.304 3.547 20 5 FHBDRN Cc1ncc([N+](=O)[O-])n1CC(=O)N[C@@H](c1ccccc1)C1CCCCC1 ZINC000065693466 568055331 /nfs/dbraw/zinc/05/53/31/568055331.db2.gz RSKWQWJJPZRLOP-IBGZPJMESA-N 0 0 356.426 3.538 20 5 FHBDRN O=C(c1cc2c(cc1[N+](=O)[O-])OCO2)N1CCC[C@H]1/C=C\c1ccccc1 ZINC000541875956 568061321 /nfs/dbraw/zinc/06/13/21/568061321.db2.gz ICVSSEIAPDOCLP-CDNLZTBQSA-N 0 0 366.373 3.642 20 5 FHBDRN O=C(NC1CCN(c2ccccc2)CC1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000120372692 568068422 /nfs/dbraw/zinc/06/84/22/568068422.db2.gz PAUXIAUCPHKQGA-UHFFFAOYSA-N 0 0 359.813 3.647 20 5 FHBDRN O=C(Nc1cccnc1N1CCCCC1)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000541889442 568075777 /nfs/dbraw/zinc/07/57/77/568075777.db2.gz JDRHSOSHORHLRF-UHFFFAOYSA-N 0 0 365.393 3.714 20 5 FHBDRN CC[N@@H+]1CC[C@H](N(C)C(=O)c2cc(Cl)cc(Cl)c2[N+](=O)[O-])[C@H](C)C1 ZINC000291237318 568086754 /nfs/dbraw/zinc/08/67/54/568086754.db2.gz APLDQUXLDWCIIM-YGRLFVJLSA-N 0 0 374.268 3.704 20 5 FHBDRN CCCn1ncc(NC(=O)c2ccc([N+](=O)[O-])c3cccnc23)c1C1CC1 ZINC000452979624 568088151 /nfs/dbraw/zinc/08/81/51/568088151.db2.gz IFXGESCWBLXEGZ-UHFFFAOYSA-N 0 0 365.393 3.879 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(NCc2ccc(NC(=O)c3ccncc3)cc2)n1 ZINC000481689594 568089135 /nfs/dbraw/zinc/08/91/35/568089135.db2.gz OTUWMICGRPNOMK-UHFFFAOYSA-N 0 0 363.377 3.558 20 5 FHBDRN COc1ccc(Nc2nc(C)ccc2[N+](=O)[O-])cc1OCC(F)(F)F ZINC000481703208 568090236 /nfs/dbraw/zinc/09/02/36/568090236.db2.gz KVWWWYWFWIHXCQ-UHFFFAOYSA-N 0 0 357.288 3.992 20 5 FHBDRN CC(C)(O)[C@H]1CCCN1C(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000128627709 568092499 /nfs/dbraw/zinc/09/24/99/568092499.db2.gz IVCPPLKHWDGNNV-GOSISDBHSA-N 0 0 369.421 3.714 20 5 FHBDRN CC[C@@H](C)Oc1cccc(NC(=O)COc2ccc([N+](=O)[O-])c(OC)c2)c1 ZINC000068800023 568092558 /nfs/dbraw/zinc/09/25/58/568092558.db2.gz UENFXAWULYORIG-CYBMUJFWSA-N 0 0 374.393 3.798 20 5 FHBDRN O=C(Oc1cccc([N+](=O)[O-])c1)c1ccccc1COC1CCOCC1 ZINC000128631100 568092705 /nfs/dbraw/zinc/09/27/05/568092705.db2.gz CCWVCICUNMDILN-UHFFFAOYSA-N 0 0 357.362 3.510 20 5 FHBDRN Cc1c2ccccc2oc1[C@H](C)NC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000481710609 568094999 /nfs/dbraw/zinc/09/49/99/568094999.db2.gz XVNJJKZRUCNUNP-NSHDSACASA-N 0 0 368.345 3.869 20 5 FHBDRN O=C(N[C@@H]1CCC[C@H]2OCC[C@@H]21)c1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000291284534 568096176 /nfs/dbraw/zinc/09/61/76/568096176.db2.gz GJXZIJNJJMHMGE-OASPWFOLSA-N 0 0 359.209 3.589 20 5 FHBDRN CSc1ccc(CSC[C@H](O)COc2ccccc2[N+](=O)[O-])cc1 ZINC000481735275 568099875 /nfs/dbraw/zinc/09/98/75/568099875.db2.gz IBVXWBYJQWENLW-CQSZACIVSA-N 0 0 365.476 3.990 20 5 FHBDRN C[C@]1(CN[C@@H](c2ccc([N+](=O)[O-])cc2)C(F)(F)F)CCO[C@H]1C1CC1 ZINC000568641004 568103607 /nfs/dbraw/zinc/10/36/07/568103607.db2.gz BTIGFMVHUYAJOP-HRCADAONSA-N 0 0 358.360 3.993 20 5 FHBDRN C[C@@H](c1cccs1)N(C)S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000603492256 568107521 /nfs/dbraw/zinc/10/75/21/568107521.db2.gz OXVKFCNWLSMQEW-VIFPVBQESA-N 0 0 360.844 3.691 20 5 FHBDRN Cc1nc(Cn2cc([N+](=O)[O-])c(C)cc2=O)oc1-c1ccc(Cl)cc1 ZINC000128643776 568114080 /nfs/dbraw/zinc/11/40/80/568114080.db2.gz MIWKBKIEXBRMOV-UHFFFAOYSA-N 0 0 359.769 3.730 20 5 FHBDRN CC(C)(CNc1ccc([N+](=O)[O-])c(OCc2ccccc2)n1)C(F)(F)F ZINC000568666863 568115497 /nfs/dbraw/zinc/11/54/97/568115497.db2.gz VSBOTMAUOPWTGJ-UHFFFAOYSA-N 0 0 369.343 3.991 20 5 FHBDRN COCCCCc1cccnc1NC(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000291340426 568117132 /nfs/dbraw/zinc/11/71/32/568117132.db2.gz VTQLLXXKWSMWIC-UHFFFAOYSA-N 0 0 357.410 3.530 20 5 FHBDRN Cc1cc(NC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)c(Cl)cc1F ZINC000568676940 568120100 /nfs/dbraw/zinc/12/01/00/568120100.db2.gz FLLLVHKFCISVDG-UHFFFAOYSA-N 0 0 352.705 3.677 20 5 FHBDRN O=[N+]([O-])c1cccc(-n2ccc(-c3nc(-c4ccc5cc[nH]c5c4)no3)n2)c1 ZINC000568690693 568123500 /nfs/dbraw/zinc/12/35/00/568123500.db2.gz FWKXWCCSGISMQI-UHFFFAOYSA-N 0 0 372.344 3.979 20 5 FHBDRN O=C(NCC1(c2ccccc2)CCOCC1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000603626901 568127352 /nfs/dbraw/zinc/12/73/52/568127352.db2.gz ADPVDEGBQXDLHJ-UHFFFAOYSA-N 0 0 374.824 3.726 20 5 FHBDRN COc1cc(C(=O)NCc2cccc([N+](=O)[O-])c2)cc(OC)c1C(C)C ZINC000541894660 568130361 /nfs/dbraw/zinc/13/03/61/568130361.db2.gz NGXQZPQYPREQKY-UHFFFAOYSA-N 0 0 358.394 3.665 20 5 FHBDRN CCN(C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)C1CC(C)(C)C1 ZINC000412839230 568131338 /nfs/dbraw/zinc/13/13/38/568131338.db2.gz LFTYBSGSAXCIID-UHFFFAOYSA-N 0 0 359.470 3.848 20 5 FHBDRN O=C1COc2c(N[C@@H]3CCC[C@H]3Cc3ccccc3[N+](=O)[O-])cccc2N1 ZINC000568699673 568131903 /nfs/dbraw/zinc/13/19/03/568131903.db2.gz CAIUBZJVNBIEMT-DZGCQCFKSA-N 0 0 367.405 3.749 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H](c1nc(C2CC2)no1)C(C)C ZINC000568699889 568132130 /nfs/dbraw/zinc/13/21/30/568132130.db2.gz MGMSYGFFUBHKLL-OAHLLOKOSA-N 0 0 373.413 3.936 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(Sc2nnc(COc3ccccc3)n2C)c1 ZINC000481815310 568136799 /nfs/dbraw/zinc/13/67/99/568136799.db2.gz NDKDEJRXCNKDRS-UHFFFAOYSA-N 0 0 356.407 3.762 20 5 FHBDRN O=C(NC[C@H]1CCC2(CCCCC2)O1)c1ccc([N+](=O)[O-])cc1Cl ZINC000481873892 568140440 /nfs/dbraw/zinc/14/04/40/568140440.db2.gz ZUYDUZRNFRXIMO-CYBMUJFWSA-N 0 0 352.818 3.860 20 5 FHBDRN CCOc1ccc(C(=O)Nc2cc(F)ccc2OC(F)F)cc1[N+](=O)[O-] ZINC000159321048 568144017 /nfs/dbraw/zinc/14/40/17/568144017.db2.gz BHIYZZFGNCXRGE-UHFFFAOYSA-N 0 0 370.283 3.986 20 5 FHBDRN COc1cc(C)cc(CNC(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000159346359 568158357 /nfs/dbraw/zinc/15/83/57/568158357.db2.gz OWGJZDZQGVIFDI-AWEZNQCLSA-N 0 0 357.410 3.781 20 5 FHBDRN Cc1noc(C)c1[C@@H](C)CNC(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000159348032 568158763 /nfs/dbraw/zinc/15/87/63/568158763.db2.gz SQQOUWLRXQYWDS-NWDGAFQWSA-N 0 0 360.414 3.672 20 5 FHBDRN CO[C@H]1CCN(c2nnc(-c3ccc([N+](=O)[O-])cc3)n2CC(C)C)[C@@H](C)C1 ZINC000291449829 568163226 /nfs/dbraw/zinc/16/32/26/568163226.db2.gz FNNJQPFLIMXKLV-YOEHRIQHSA-N 0 0 373.457 3.513 20 5 FHBDRN CC(C)(C(=O)NC[C@H]1CCC2(CCCCC2)O1)c1ccc([N+](=O)[O-])cc1 ZINC000481870199 568164956 /nfs/dbraw/zinc/16/49/56/568164956.db2.gz QESPNNOPMKDVLB-QGZVFWFLSA-N 0 0 360.454 3.871 20 5 FHBDRN COC(=O)c1cc(OCc2ccc(Br)s2)ccc1[N+](=O)[O-] ZINC000481901814 568170589 /nfs/dbraw/zinc/17/05/89/568170589.db2.gz RACGSVAGAYJLSV-UHFFFAOYSA-N 0 0 372.196 3.784 20 5 FHBDRN COC(=O)c1cc(OCc2ccc(SC)c(OC)c2)ccc1[N+](=O)[O-] ZINC000481902891 568171346 /nfs/dbraw/zinc/17/13/46/568171346.db2.gz UOQKYMJPSAKKQQ-UHFFFAOYSA-N 0 0 363.391 3.691 20 5 FHBDRN C[C@@H](Nc1ncc([N+](=O)[O-])c(N)n1)c1ccc(Oc2ccccc2)c(F)c1 ZINC000603871813 568174319 /nfs/dbraw/zinc/17/43/19/568174319.db2.gz VNYJORLBSGGQKM-LLVKDONJSA-N 0 0 369.356 3.902 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(C(=O)NC(C)C)cc1 ZINC000291507372 568181991 /nfs/dbraw/zinc/18/19/91/568181991.db2.gz WAVDUYVOQSPUGB-UHFFFAOYSA-N 0 0 355.394 3.548 20 5 FHBDRN COC(=O)c1cc(OCC(=O)c2c(C)c(C)cc(C)c2C)ccc1[N+](=O)[O-] ZINC000481939407 568193980 /nfs/dbraw/zinc/19/39/80/568193980.db2.gz AJPFCXGYSRHNJK-UHFFFAOYSA-N 0 0 371.389 3.877 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@@H](c2ccccc2)C(F)F)c1 ZINC000481944809 568195180 /nfs/dbraw/zinc/19/51/80/568195180.db2.gz RQGHMJFZORYSFZ-KRWDZBQOSA-N 0 0 364.348 3.795 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCN(Cc2ccccc2Cl)CC1 ZINC000481946075 568195244 /nfs/dbraw/zinc/19/52/44/568195244.db2.gz VESNXPMNUXSPCX-UHFFFAOYSA-N 0 0 373.840 3.515 20 5 FHBDRN Cc1cc(=O)n(CCCCOc2ccccc2C(F)(F)F)cc1[N+](=O)[O-] ZINC000128721391 568201433 /nfs/dbraw/zinc/20/14/33/568201433.db2.gz ICNNCUWBBRIUPN-UHFFFAOYSA-N 0 0 370.327 3.943 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N(C)[C@H]1CCc2ccccc21 ZINC000481968039 568201654 /nfs/dbraw/zinc/20/16/54/568201654.db2.gz TUILQOCGNIFPFF-KRWDZBQOSA-N 0 0 360.435 3.520 20 5 FHBDRN C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)CSc1ccccc1[N+](=O)[O-] ZINC000481982762 568213507 /nfs/dbraw/zinc/21/35/07/568213507.db2.gz HAPDZEWZUGHTBM-WDEREUQCSA-N 0 0 362.373 3.876 20 5 FHBDRN C[C@@H](c1ccccc1)[C@H](O)COc1c(Br)cccc1[N+](=O)[O-] ZINC000453006209 568216878 /nfs/dbraw/zinc/21/68/78/568216878.db2.gz JHJSBPKXFUNWKC-XHDPSFHLSA-N 0 0 366.211 3.901 20 5 FHBDRN C[C@H](c1ccccc1)[C@@H](O)COc1c(Br)cccc1[N+](=O)[O-] ZINC000453006197 568218345 /nfs/dbraw/zinc/21/83/45/568218345.db2.gz JHJSBPKXFUNWKC-ABAIWWIYSA-N 0 0 366.211 3.901 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)N[C@@H](c1ccccc1)C(F)F ZINC000481993885 568221454 /nfs/dbraw/zinc/22/14/54/568221454.db2.gz YONHTBHXJSBSFC-KRWDZBQOSA-N 0 0 359.332 3.672 20 5 FHBDRN COc1cccc([C@@H](C)C(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)c1 ZINC000568795507 568221998 /nfs/dbraw/zinc/22/19/98/568221998.db2.gz RIGDVQXXNBUCMC-CYBMUJFWSA-N 0 0 367.405 3.547 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@@]2(C1)OCc1ccccc12 ZINC000568807459 568229296 /nfs/dbraw/zinc/22/92/96/568229296.db2.gz SAZMTPBKTXYMDB-FQEVSTJZSA-N 0 0 367.405 3.821 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)Nc2cccc(-c3cc[nH]n3)c2)c1 ZINC000024888744 568229939 /nfs/dbraw/zinc/22/99/39/568229939.db2.gz RUBGCHKIVLXGTA-UHFFFAOYSA-N 0 0 354.391 3.959 20 5 FHBDRN CCOc1cc(NC(=O)N[C@@H](C)c2ccccn2)c([N+](=O)[O-])cc1OCC ZINC000043838882 568230669 /nfs/dbraw/zinc/23/06/69/568230669.db2.gz GNJDZEQNXJWALG-LBPRGKRZSA-N 0 0 374.397 3.670 20 5 FHBDRN COCCOc1ccc(F)cc1NC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000568818712 568231026 /nfs/dbraw/zinc/23/10/26/568231026.db2.gz HPKHLUUKDVEJSX-GFCCVEGCSA-N 0 0 362.357 3.501 20 5 FHBDRN CNc1c(C(=O)N2CC[C@H](C(F)(F)F)C(C)(C)C2)cccc1[N+](=O)[O-] ZINC000482043639 568237847 /nfs/dbraw/zinc/23/78/47/568237847.db2.gz PLGCIUWXKUGZLW-LBPRGKRZSA-N 0 0 359.348 3.687 20 5 FHBDRN CC(C)(C)c1ccc(NC(=O)c2ccnc(N3CCCC3)n2)cc1[N+](=O)[O-] ZINC000568870818 568242132 /nfs/dbraw/zinc/24/21/32/568242132.db2.gz HRMGVLIIYJNUOG-UHFFFAOYSA-N 0 0 369.425 3.535 20 5 FHBDRN O=[N+]([O-])c1ccc(NCc2ccnc(OC(F)F)c2)cc1OC(F)F ZINC000568896814 568249596 /nfs/dbraw/zinc/24/95/96/568249596.db2.gz QLTAEOXMQMRZOJ-UHFFFAOYSA-N 0 0 361.251 3.805 20 5 FHBDRN O=C(NCCC[C@H]1CCCCO1)c1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000291659443 568251524 /nfs/dbraw/zinc/25/15/24/568251524.db2.gz HNSBEESSMBEEJU-LLVKDONJSA-N 0 0 361.225 3.981 20 5 FHBDRN COc1ccc2c(c1)C[C@@H](C)N(C(=O)Cc1cccc([N+](=O)[O-])c1C)[C@H]2C ZINC000541933594 568253206 /nfs/dbraw/zinc/25/32/06/568253206.db2.gz SMHUCMNMSANEBF-HIFRSBDPSA-N 0 0 368.433 3.989 20 5 FHBDRN CCCc1n[nH]c(C(=O)N2C[C@@H](c3ccccc3)C3(CCC3)C2)c1[N+](=O)[O-] ZINC000412664042 568254467 /nfs/dbraw/zinc/25/44/67/568254467.db2.gz CIAQUSOIZCAOOS-HNNXBMFYSA-N 0 0 368.437 3.680 20 5 FHBDRN CCc1ccc([C@@H]2COCCN2C(=O)c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000120388785 568256976 /nfs/dbraw/zinc/25/69/76/568256976.db2.gz FUTMLKLYAXTCOS-HNNXBMFYSA-N 0 0 364.785 3.617 20 5 FHBDRN Cc1ccc(C[C@@H]2CCCN2C(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)cc1 ZINC000568970048 568258602 /nfs/dbraw/zinc/25/86/02/568258602.db2.gz AWMSYBMNRXGKRI-HNNXBMFYSA-N 0 0 374.387 3.958 20 5 FHBDRN CCCN1C(=O)c2ccccc2N[C@@H]1c1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000007889762 568260904 /nfs/dbraw/zinc/26/09/04/568260904.db2.gz DGGRBWBHFJVCMG-SFHVURJKSA-N 0 0 371.393 3.589 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NCC(=O)Nc1ccc(Cl)c(Cl)c1 ZINC000007952631 568267184 /nfs/dbraw/zinc/26/71/84/568267184.db2.gz RHBAVPIOIBQBGI-UHFFFAOYSA-N 0 0 370.192 3.961 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)[C@@H]1CCCc2ccccc21 ZINC000008126886 568268622 /nfs/dbraw/zinc/26/86/22/568268622.db2.gz AFXFDGPJCCPRKJ-GOSISDBHSA-N 0 0 369.421 3.551 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)[C@@H]1OCCc2ccccc21 ZINC000181956849 568268947 /nfs/dbraw/zinc/26/89/47/568268947.db2.gz YHAAVXAWFYKDHR-OAHLLOKOSA-N 0 0 366.295 3.866 20 5 FHBDRN CC(C)S(=O)(=O)c1ccc(CN[C@@H](C)c2ccccc2[N+](=O)[O-])cc1 ZINC000541952853 568273425 /nfs/dbraw/zinc/27/34/25/568273425.db2.gz XEGWKKDPURAGGS-AWEZNQCLSA-N 0 0 362.451 3.628 20 5 FHBDRN Cc1cccc([C@@H](C)CNC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)c1 ZINC000482109350 568275447 /nfs/dbraw/zinc/27/54/47/568275447.db2.gz XXQKORLFHYEJOO-HNNXBMFYSA-N 0 0 364.405 3.622 20 5 FHBDRN CSc1cccc(C(=O)N[C@@H]2c3ccc(F)cc3O[C@@H]2C)c1[N+](=O)[O-] ZINC000569027977 568275615 /nfs/dbraw/zinc/27/56/15/568275615.db2.gz XWMJPMYUDRAMHV-PSLIRLAXSA-N 0 0 362.382 3.708 20 5 FHBDRN COc1cc(Cn2cc(C(C)C)cn2)c([N+](=O)[O-])cc1OCC(F)F ZINC000569102689 568275885 /nfs/dbraw/zinc/27/58/85/568275885.db2.gz UUUIHUBETLKMKS-UHFFFAOYSA-N 0 0 355.341 3.616 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1CC(C)(C)[C@@H]1c1ccccc1 ZINC000604374199 568276801 /nfs/dbraw/zinc/27/68/01/568276801.db2.gz PVFHCBICHSTCDK-KRWDZBQOSA-N 0 0 360.435 3.675 20 5 FHBDRN Cc1ccc(S(=O)(=O)N(C)Cc2ccc3ccccc3c2)cc1[N+](=O)[O-] ZINC000008167408 568278347 /nfs/dbraw/zinc/27/83/47/568278347.db2.gz PHGRSDRMJFTZDT-UHFFFAOYSA-N 0 0 370.430 3.877 20 5 FHBDRN Cc1ccc(-c2ccc(C(=O)N3CCc4ncc([N+](=O)[O-])cc4C3)s2)o1 ZINC000541955392 568284635 /nfs/dbraw/zinc/28/46/35/568284635.db2.gz KTCHATYRWQOINE-UHFFFAOYSA-N 0 0 369.402 3.818 20 5 FHBDRN CC1(C)CN(C(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])[C@@H]1[C@H]1CCCO1 ZINC000291736511 568286672 /nfs/dbraw/zinc/28/66/72/568286672.db2.gz XGTMMHOYQHCTPS-ZIAGYGMSSA-N 0 0 372.343 3.643 20 5 FHBDRN CCOc1c(F)cccc1C(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000569049058 568286962 /nfs/dbraw/zinc/28/69/62/568286962.db2.gz VSCYXVBCDBXTPE-UHFFFAOYSA-N 0 0 371.368 3.586 20 5 FHBDRN CCc1ccc(CNC(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])s1 ZINC000604442997 568289154 /nfs/dbraw/zinc/28/91/54/568289154.db2.gz ZMUMAKGFCZMREB-SNVBAGLBSA-N 0 0 368.842 3.956 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)Nc1cc2c(cc1Cl)OCCCO2 ZINC000026980889 568292519 /nfs/dbraw/zinc/29/25/19/568292519.db2.gz AIRDVMBOCYWMKM-UHFFFAOYSA-N 0 0 362.769 3.591 20 5 FHBDRN C[C@H](Sc1nccc(C(F)(F)F)n1)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000026479390 568294375 /nfs/dbraw/zinc/29/43/75/568294375.db2.gz CCAZFWZZIAVFDB-QMMMGPOBSA-N 0 0 372.328 3.523 20 5 FHBDRN Cc1ccccc1[C@@H]1CN(C(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)[C@@H](C)CO1 ZINC000569061352 568295756 /nfs/dbraw/zinc/29/57/56/568295756.db2.gz RZDXDWBBEAXYNZ-FTRWYGJKSA-N 0 0 368.433 3.995 20 5 FHBDRN C[C@@H](C(=O)Nc1cc2c(cc1Cl)OCCO2)c1cccc([N+](=O)[O-])c1 ZINC000569063293 568295867 /nfs/dbraw/zinc/29/58/67/568295867.db2.gz ADTBCXVVOCEZTJ-SNVBAGLBSA-N 0 0 362.769 3.762 20 5 FHBDRN COc1ccc([C@@H](O)C2CCN(Cc3ccc([N+](=O)[O-])c(F)c3)CC2)cc1 ZINC000291749744 568296478 /nfs/dbraw/zinc/29/64/78/568296478.db2.gz KLYUNLBLQVUBSV-HXUWFJFHSA-N 0 0 374.412 3.688 20 5 FHBDRN COc1cccc(C2(NC(=O)N[C@H](C)c3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000482160029 568297366 /nfs/dbraw/zinc/29/73/66/568297366.db2.gz QYADVOJPCGATDJ-CYBMUJFWSA-N 0 0 355.394 3.653 20 5 FHBDRN O=C(N[C@H](c1ccccc1)C(F)F)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000482160308 568297451 /nfs/dbraw/zinc/29/74/51/568297451.db2.gz SSYJEDXJROAVGU-MRXNPFEDSA-N 0 0 372.331 3.517 20 5 FHBDRN COc1ccc(C(=O)NCCc2c[nH]c3cc(Cl)ccc23)cc1[N+](=O)[O-] ZINC000604487580 568298156 /nfs/dbraw/zinc/29/81/56/568298156.db2.gz SWBXHXSORPHMNL-UHFFFAOYSA-N 0 0 373.796 3.711 20 5 FHBDRN C[C@@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1F)[C@H]1OCCc2sccc21 ZINC000291761756 568298207 /nfs/dbraw/zinc/29/82/07/568298207.db2.gz LRABUPHCLBNLFB-RFAUZJTJSA-N 0 0 365.386 3.619 20 5 FHBDRN CC(C)(C)c1nc(CN2CCN(c3sccc3[N+](=O)[O-])CC2)cs1 ZINC000302005976 568301347 /nfs/dbraw/zinc/30/13/47/568301347.db2.gz VFELPXBOJOFZPV-UHFFFAOYSA-N 0 0 366.512 3.733 20 5 FHBDRN CCc1ccc(C(=O)NC[C@@](C)(Cc2ccccc2)[C@H](C)O)cc1[N+](=O)[O-] ZINC000482179439 568302023 /nfs/dbraw/zinc/30/20/23/568302023.db2.gz KDEFAMSUNSITRT-YCRPNKLZSA-N 0 0 370.449 3.517 20 5 FHBDRN CCc1ccc(C(=O)NC[C@](C)(Cc2ccccc2)[C@@H](C)O)cc1[N+](=O)[O-] ZINC000482179438 568302037 /nfs/dbraw/zinc/30/20/37/568302037.db2.gz KDEFAMSUNSITRT-VFNWGFHPSA-N 0 0 370.449 3.517 20 5 FHBDRN CC(C)C[C@@H]1OCCC[C@H]1NC(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000482180731 568302233 /nfs/dbraw/zinc/30/22/33/568302233.db2.gz LQPXGQYRIJHYML-XYPHTWIQSA-N 0 0 366.483 3.785 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CCCO[C@@H]1CC(C)C ZINC000482181732 568302348 /nfs/dbraw/zinc/30/23/48/568302348.db2.gz OBSNORBQXWXBBF-NZSAHSFTSA-N 0 0 362.470 3.873 20 5 FHBDRN O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)NCc1cc2ccccc2s1 ZINC000489623832 568312425 /nfs/dbraw/zinc/31/24/25/568312425.db2.gz OUZGPSGIKTWMMD-UHFFFAOYSA-N 0 0 362.357 3.947 20 5 FHBDRN COc1ccc(C(=O)NC[C@H]2CCCC[C@@H]2C(F)(F)F)cc1[N+](=O)[O-] ZINC000482211537 568312967 /nfs/dbraw/zinc/31/29/67/568312967.db2.gz JVQPTKKYKDTJJN-NEPJUHHUSA-N 0 0 360.332 3.702 20 5 FHBDRN CCCc1coc(NC(=O)c2cc([N+](=O)[O-])cc(Br)c2C)n1 ZINC000569255655 568321029 /nfs/dbraw/zinc/32/10/29/568321029.db2.gz CFIXWFSUQZYYFD-UHFFFAOYSA-N 0 0 368.187 3.859 20 5 FHBDRN CSc1ccc(C(=O)NCc2nc3ccccc3s2)cc1[N+](=O)[O-] ZINC000031098500 568323721 /nfs/dbraw/zinc/32/37/21/568323721.db2.gz SDUVCHNKFRNXIZ-UHFFFAOYSA-N 0 0 359.432 3.856 20 5 FHBDRN CN(C(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1)[C@@H]1CCc2ccccc21 ZINC000031275278 568328229 /nfs/dbraw/zinc/32/82/29/568328229.db2.gz MAULXLXDTWYFCE-LJQANCHMSA-N 0 0 362.389 3.540 20 5 FHBDRN CCSc1ccccc1C(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000031296070 568328482 /nfs/dbraw/zinc/32/84/82/568328482.db2.gz XKDYCFORKGQECX-UHFFFAOYSA-N 0 0 371.462 3.669 20 5 FHBDRN COc1cc(COc2cc(F)ccc2-c2ccnn2C)ccc1[N+](=O)[O-] ZINC000569293281 568335907 /nfs/dbraw/zinc/33/59/07/568335907.db2.gz YENZJPHXFAHEEU-UHFFFAOYSA-N 0 0 357.341 3.722 20 5 FHBDRN CC1(C)CN(C(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)[C@@H]1c1cccs1 ZINC000569289223 568337491 /nfs/dbraw/zinc/33/74/91/568337491.db2.gz PABUDHSQBNIGDH-MRXNPFEDSA-N 0 0 374.418 3.651 20 5 FHBDRN CC(C)c1ccc(CN2C(=O)N[C@@](C)(c3cccc([N+](=O)[O-])c3)C2=O)cc1 ZINC000031660039 568338273 /nfs/dbraw/zinc/33/82/73/568338273.db2.gz LJBURPDPUAJUJM-FQEVSTJZSA-N 0 0 367.405 3.685 20 5 FHBDRN CNc1ccc(C(=O)Nc2cccc(-c3ccnc(C)n3)c2)cc1[N+](=O)[O-] ZINC000031802631 568340190 /nfs/dbraw/zinc/34/01/90/568340190.db2.gz PZXCKHFUMZCRSP-UHFFFAOYSA-N 0 0 363.377 3.654 20 5 FHBDRN COc1ccc(NC(=O)Cc2ccc(Br)s2)cc1[N+](=O)[O-] ZINC000541998255 568377916 /nfs/dbraw/zinc/37/79/16/568377916.db2.gz AEBNSNKHBNRJPG-UHFFFAOYSA-N 0 0 371.212 3.609 20 5 FHBDRN COc1ccc(NC(=O)CCc2c[nH]c3c2cccc3C)cc1[N+](=O)[O-] ZINC000541995473 568386081 /nfs/dbraw/zinc/38/60/81/568386081.db2.gz TXXOZILBBDMLDA-UHFFFAOYSA-N 0 0 353.378 3.964 20 5 FHBDRN O=C(Nc1cnc(-c2ccccc2)nc1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000053598929 568387111 /nfs/dbraw/zinc/38/71/11/568387111.db2.gz UOYDKDFXEXWCEQ-UHFFFAOYSA-N 0 0 354.753 3.958 20 5 FHBDRN COCCn1c2ccccc2nc1Sc1ccc(C(C)=O)cc1[N+](=O)[O-] ZINC000032509701 568393645 /nfs/dbraw/zinc/39/36/45/568393645.db2.gz RWGDUAUPAFQKRP-UHFFFAOYSA-N 0 0 371.418 3.945 20 5 FHBDRN CCc1nc2ccc(C(=O)Nc3ccc([N+](=O)[O-])cc3)cc2nc1CC ZINC000032517320 568393808 /nfs/dbraw/zinc/39/38/08/568393808.db2.gz JTVVPTNLMHOSHM-UHFFFAOYSA-N 0 0 350.378 3.915 20 5 FHBDRN COC[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1F)c1cccc(Cl)c1 ZINC000569341468 568395335 /nfs/dbraw/zinc/39/53/35/568395335.db2.gz ASOLTJXDXXFGOF-HNNXBMFYSA-N 0 0 352.749 3.505 20 5 FHBDRN O=C(Nc1cc2c(cc1[N+](=O)[O-])OCCCO2)[C@@H]1CC[C@H](C(F)(F)F)C1 ZINC000569340926 568395365 /nfs/dbraw/zinc/39/53/65/568395365.db2.gz MRWCMLLYMNHQFY-ZJUUUORDSA-N 0 0 374.315 3.673 20 5 FHBDRN C[C@H](c1ccccc1)N(C)C(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000057467304 568397623 /nfs/dbraw/zinc/39/76/23/568397623.db2.gz YJVWXWVMARGZTJ-CQSZACIVSA-N 0 0 350.378 3.614 20 5 FHBDRN Cc1ccc(NC(=O)COc2cccc(Br)c2)cc1[N+](=O)[O-] ZINC000006216093 568399795 /nfs/dbraw/zinc/39/97/95/568399795.db2.gz UFLUJCJCOCHUJK-UHFFFAOYSA-N 0 0 365.183 3.683 20 5 FHBDRN Cc1cc(NC(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)n(-c2ccccc2F)n1 ZINC000569537269 568406595 /nfs/dbraw/zinc/40/65/95/568406595.db2.gz CIRFICDZHVORPV-ZDUSSCGKSA-N 0 0 368.368 3.970 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc3c(c2)C(=O)CC(C)(C)O3)c1 ZINC000569636488 568411580 /nfs/dbraw/zinc/41/15/80/568411580.db2.gz KFBLOMUEGWKPTN-UHFFFAOYSA-N 0 0 354.362 3.899 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCCCOC1CCCCC1 ZINC000006989166 568411851 /nfs/dbraw/zinc/41/18/51/568411851.db2.gz CUGXKZDFHVZKCP-CQSZACIVSA-N 0 0 366.483 3.931 20 5 FHBDRN O=[N+]([O-])c1cccc(Cl)c1OC[C@@H](O)COc1ccc(Cl)cc1 ZINC000569712334 568413329 /nfs/dbraw/zinc/41/33/29/568413329.db2.gz DCLFFXAVDOOBJW-NSHDSACASA-N 0 0 358.177 3.720 20 5 FHBDRN Cc1c(Br)c(NCc2cc3ccccc3[nH]2)ncc1[N+](=O)[O-] ZINC000569741658 568417358 /nfs/dbraw/zinc/41/73/58/568417358.db2.gz ZNBUQJWXBLQIEI-UHFFFAOYSA-N 0 0 361.199 3.576 20 5 FHBDRN CCn1c(C)nc([N+](=O)[O-])c1N(C)Cc1cc(Br)ccc1F ZINC000569761975 568421608 /nfs/dbraw/zinc/42/16/08/568421608.db2.gz IUGSHPYETHOALU-UHFFFAOYSA-N 0 0 371.210 3.658 20 5 FHBDRN CCn1c(Cc2ccc(F)cc2)nnc1N(C)Cc1ccccc1[N+](=O)[O-] ZINC000569791537 568425037 /nfs/dbraw/zinc/42/50/37/568425037.db2.gz RSWVCJKGYVTZNV-UHFFFAOYSA-N 0 0 369.400 3.573 20 5 FHBDRN C[C@H](CCCC(F)(F)F)NC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000569849438 568429007 /nfs/dbraw/zinc/42/90/07/568429007.db2.gz CRJLBHBJQSALBQ-MRVPVSSYSA-N 0 0 354.275 3.653 20 5 FHBDRN O=[N+]([O-])c1ccc(C(F)(F)c2nc(Cn3cnc4ccccc43)no2)cc1 ZINC000569866160 568431878 /nfs/dbraw/zinc/43/18/78/568431878.db2.gz GBNQRIAEMNURHW-UHFFFAOYSA-N 0 0 371.303 3.516 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CCCC[C@@H]2C(F)(F)F)c1 ZINC000569929748 568437820 /nfs/dbraw/zinc/43/78/20/568437820.db2.gz FVVYNPMUBMALNM-QWHCGFSZSA-N 0 0 360.332 3.844 20 5 FHBDRN CCOc1ccc([C@@H]2C[C@H]2NC(=O)c2cc(OCC)ccc2[N+](=O)[O-])cc1 ZINC000570061898 568442865 /nfs/dbraw/zinc/44/28/65/568442865.db2.gz HXCNNISVUADOQH-FUHWJXTLSA-N 0 0 370.405 3.678 20 5 FHBDRN CC(C)(NC(=O)c1cnc(-c2ccccc2)[nH]1)c1ccc([N+](=O)[O-])cc1 ZINC000569948209 568444130 /nfs/dbraw/zinc/44/41/30/568444130.db2.gz KCYOVPYHZIBVLY-UHFFFAOYSA-N 0 0 350.378 3.650 20 5 FHBDRN CC(=O)c1ccc(NC(=O)NCCc2cccc([N+](=O)[O-])c2)cc1Cl ZINC000569981396 568445622 /nfs/dbraw/zinc/44/56/22/568445622.db2.gz BNQXNSPYPIWENK-UHFFFAOYSA-N 0 0 361.785 3.815 20 5 FHBDRN COc1cc2c(cc1Cl)CN(C(=O)c1ccc([N+](=O)[O-])s1)CC2 ZINC000570121217 568452374 /nfs/dbraw/zinc/45/23/74/568452374.db2.gz NTMPOUHCAMXBGO-UHFFFAOYSA-N 0 0 352.799 3.517 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)N1CCC[C@H](c2ccncc2)C1 ZINC000570121317 568452442 /nfs/dbraw/zinc/45/24/42/568452442.db2.gz CGYOFNQGZUQUNN-KRWDZBQOSA-N 0 0 368.437 3.588 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2noc(-c3cccc(Cn4ccnc4)c3)n2)s1 ZINC000570126400 568453025 /nfs/dbraw/zinc/45/30/25/568453025.db2.gz CZJZUCAAKKCPQT-UHFFFAOYSA-N 0 0 353.363 3.618 20 5 FHBDRN O=C(Nc1ccnn1-c1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)CCC=C2 ZINC000570076231 568457331 /nfs/dbraw/zinc/45/73/31/568457331.db2.gz YPPRAHAJXKJZHE-UHFFFAOYSA-N 0 0 360.373 3.992 20 5 FHBDRN CC1(C)CN(C(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)Cc2ccccc2O1 ZINC000570192120 568460226 /nfs/dbraw/zinc/46/02/26/568460226.db2.gz KFOPMNADQZEEBL-UHFFFAOYSA-N 0 0 365.389 3.890 20 5 FHBDRN CC[C@@H](C)Oc1cccc(NC(=O)NCCOc2ccc([N+](=O)[O-])cc2)c1 ZINC000570232660 568463868 /nfs/dbraw/zinc/46/38/68/568463868.db2.gz DEHXMGSPQMNSQL-CQSZACIVSA-N 0 0 373.409 3.973 20 5 FHBDRN C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)N[C@H]3CC[C@H](F)C3)cc2[N+](=O)[O-])C1 ZINC000570340154 568467538 /nfs/dbraw/zinc/46/75/38/568467538.db2.gz ILINYXGTVPSGNB-XRGAULLZSA-N 0 0 363.433 3.698 20 5 FHBDRN CC[C@]1(CNC(=O)CCc2cccc([N+](=O)[O-])c2)OCCc2ccccc21 ZINC000570324830 568469651 /nfs/dbraw/zinc/46/96/51/568469651.db2.gz WINZWVJPNSYZDK-OAQYLSRUSA-N 0 0 368.433 3.522 20 5 FHBDRN CC[C@@]1(CNC(=O)CCc2cccc([N+](=O)[O-])c2)OCCc2ccccc21 ZINC000570324829 568469679 /nfs/dbraw/zinc/46/96/79/568469679.db2.gz WINZWVJPNSYZDK-NRFANRHFSA-N 0 0 368.433 3.522 20 5 FHBDRN Cc1nc2ccc(-c3nc(Cc4ccc([N+](=O)[O-])cn4)no3)cc2s1 ZINC000570364666 568480910 /nfs/dbraw/zinc/48/09/10/568480910.db2.gz WKULDBAIWIHJDA-UHFFFAOYSA-N 0 0 353.363 3.549 20 5 FHBDRN Cc1cccc(NS(=O)(=O)c2c(C)ccc(C)c2[N+](=O)[O-])c1Cl ZINC000570378037 568481793 /nfs/dbraw/zinc/48/17/93/568481793.db2.gz SHGPAEYQTUGSPX-UHFFFAOYSA-N 0 0 354.815 3.974 20 5 FHBDRN Nc1nccc(C(=O)N[C@H]2CCC[C@@H](c3cccc(Cl)c3)C2)c1[N+](=O)[O-] ZINC000570410616 568483395 /nfs/dbraw/zinc/48/33/95/568483395.db2.gz IMOJVDLLHHPUPQ-OCCSQVGLSA-N 0 0 374.828 3.512 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)NC[C@H]([NH3+])c1ccc(C(C)C)cc1 ZINC000570515906 568483824 /nfs/dbraw/zinc/48/38/24/568483824.db2.gz YBKKZGQHTIJESL-INIZCTEOSA-N 0 0 371.437 3.547 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H](COC(F)F)C1 ZINC000570538954 568485643 /nfs/dbraw/zinc/48/56/43/568485643.db2.gz VAQXZGZBTWNQTQ-LLVKDONJSA-N 0 0 374.409 3.798 20 5 FHBDRN Cc1ccc(NS(=O)(=O)c2cc(Cl)c(C)c([N+](=O)[O-])c2)c(C)c1 ZINC000007417127 568505393 /nfs/dbraw/zinc/50/53/93/568505393.db2.gz FLELSAWIQCOFSO-UHFFFAOYSA-N 0 0 354.815 3.974 20 5 FHBDRN Cc1c(Cl)cc(S(=O)(=O)Nc2ccc(F)cc2F)cc1[N+](=O)[O-] ZINC000007418553 568505503 /nfs/dbraw/zinc/50/55/03/568505503.db2.gz ZYPLTMGDJFBZIB-UHFFFAOYSA-N 0 0 362.741 3.636 20 5 FHBDRN Cc1cc(F)ccc1NS(=O)(=O)c1cc(Cl)c(C)c([N+](=O)[O-])c1 ZINC000007421202 568505954 /nfs/dbraw/zinc/50/59/54/568505954.db2.gz NJUMYXBTXPISHA-UHFFFAOYSA-N 0 0 358.778 3.805 20 5 FHBDRN COC(=O)c1ccc(NC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)cc1 ZINC000007401473 568510420 /nfs/dbraw/zinc/51/04/20/568510420.db2.gz WYDDHEMKZLVHGP-LLVKDONJSA-N 0 0 360.391 3.501 20 5 FHBDRN Cc1ccc(OCC(=O)N2CCC(Cc3ccccc3)CC2)c([N+](=O)[O-])c1 ZINC000007442945 568511365 /nfs/dbraw/zinc/51/13/65/568511365.db2.gz FBQCFQKZLGCPTP-UHFFFAOYSA-N 0 0 368.433 3.763 20 5 FHBDRN Cc1ccc(OCC(=O)Nc2ccc(Br)cc2)c([N+](=O)[O-])c1 ZINC000007442839 568511424 /nfs/dbraw/zinc/51/14/24/568511424.db2.gz XJZFZXNOGPBXGX-UHFFFAOYSA-N 0 0 365.183 3.683 20 5 FHBDRN COCCOCc1ccc(C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000291820891 568517397 /nfs/dbraw/zinc/51/73/97/568517397.db2.gz AKHSTIYHPKCGMO-HNNXBMFYSA-N 0 0 372.421 3.557 20 5 FHBDRN CCOc1ccc(NC(=O)COc2ccc(C)cc2[N+](=O)[O-])cc1OCC ZINC000007464111 568519510 /nfs/dbraw/zinc/51/95/10/568519510.db2.gz FXVPVQTXDYFILP-UHFFFAOYSA-N 0 0 374.393 3.718 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1Cl)N1CCC[C@@H]2CCCC[C@@H]21 ZINC000007489820 568521592 /nfs/dbraw/zinc/52/15/92/568521592.db2.gz BFBOBSNWEVCVHH-WFASDCNBSA-N 0 0 352.818 3.808 20 5 FHBDRN COc1c2ccccc2oc1CNC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000570771099 568523659 /nfs/dbraw/zinc/52/36/59/568523659.db2.gz LDJAGZBFZRENCH-LBPRGKRZSA-N 0 0 354.362 3.770 20 5 FHBDRN COC(=O)c1ccc(-c2nc(COc3ccc([N+](=O)[O-])cc3C)co2)cc1 ZINC000542006518 568545407 /nfs/dbraw/zinc/54/54/07/568545407.db2.gz HGUQGNKWXMCGAG-UHFFFAOYSA-N 0 0 368.345 3.924 20 5 FHBDRN Cc1cc([C@H](C)Nc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])c(C)s1 ZINC000025497804 568563930 /nfs/dbraw/zinc/56/39/30/568563930.db2.gz PHBDWZKGEVBSAF-JTQLQIEISA-N 0 0 354.453 3.850 20 5 FHBDRN Cc1ccc([C@]2(C)NC(=O)N(Cc3ccc([N+](=O)[O-])cc3Cl)C2=O)cc1 ZINC000542009455 568586338 /nfs/dbraw/zinc/58/63/38/568586338.db2.gz UDAYORVLCLVVEH-SFHVURJKSA-N 0 0 373.796 3.524 20 5 FHBDRN COc1ccc(C(=O)N2CCCCC[C@@H]2c2ccncc2)cc1[N+](=O)[O-] ZINC000049764630 568589561 /nfs/dbraw/zinc/58/95/61/568589561.db2.gz RVGPCFRXBNRKTG-MRXNPFEDSA-N 0 0 355.394 3.756 20 5 FHBDRN C[C@H](c1ccccc1Cl)N(C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000055267954 568618206 /nfs/dbraw/zinc/61/82/06/568618206.db2.gz IZQLUXRUKVCCFJ-LLVKDONJSA-N 0 0 354.815 3.630 20 5 FHBDRN CCOc1ccc(CN(C)C(=O)CCCNc2ccc([N+](=O)[O-])cc2)cc1 ZINC000020909960 568657905 /nfs/dbraw/zinc/65/79/05/568657905.db2.gz HMUSCUSAMJXPIB-UHFFFAOYSA-N 0 0 371.437 3.844 20 5 FHBDRN C[C@@H]1C[C@H](c2ccccc2F)N(c2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])C1 ZINC000820667094 599077291 /nfs/dbraw/zinc/07/72/91/599077291.db2.gz LBHLZFHTEKSKLW-BDJLRTHQSA-N 0 0 368.372 3.502 20 5 FHBDRN C[C@H](SCc1ccc(F)cc1-c1nn[nH]n1)c1ccccc1[N+](=O)[O-] ZINC000820548467 599222173 /nfs/dbraw/zinc/22/21/73/599222173.db2.gz AKXIAQFFVIKZEW-JTQLQIEISA-N 0 0 359.386 3.908 20 5 FHBDRN O=C([O-])c1ccc(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)cc1 ZINC000426685072 597137180 /nfs/dbraw/zinc/13/71/80/597137180.db2.gz FUMJJOJFEQIQAR-UHFFFAOYSA-N 0 0 352.346 3.843 20 5 FHBDRN O=[N+]([O-])c1cnc(Sc2c(Cl)cccc2Cl)c(-c2nn[nH]n2)c1 ZINC000823651696 599258172 /nfs/dbraw/zinc/25/81/72/599258172.db2.gz NUEOKBHXTVACQT-UHFFFAOYSA-N 0 0 369.193 3.628 20 5 FHBDRN C[C@H](c1ccc(-c2nn[nH]n2)cc1)N(C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000736196017 599268731 /nfs/dbraw/zinc/26/87/31/599268731.db2.gz IVUYVXMXJGRACE-LLVKDONJSA-N 0 0 372.816 3.621 20 5 FHBDRN C[C@@H](Sc1ncc([N+](=O)[O-])cc1-c1nn[nH]n1)c1ccc(Cl)cc1 ZINC000736190482 598500397 /nfs/dbraw/zinc/50/03/97/598500397.db2.gz FPTSJHFYYALMND-MRVPVSSYSA-N 0 0 362.802 3.677 20 5 FHBDRN O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1N[C@H](c1ccccc1)C1CCC1 ZINC000738360302 598796913 /nfs/dbraw/zinc/79/69/13/598796913.db2.gz VGYNSYIGXUYPTB-QGZVFWFLSA-N 0 0 350.382 3.728 20 5 FHBDRN C[C@H](c1ccc(Cl)cc1)N(C)c1ccc([N+](=O)[O-])cc1-c1nn[nH]n1 ZINC000736198146 598814355 /nfs/dbraw/zinc/81/43/55/598814355.db2.gz GOLLZAIOGIJNMX-SNVBAGLBSA-N 0 0 358.789 3.626 20 5 FHBDRN COc1ccc([C@H](Nc2ccc([N+](=O)[O-])cc2-c2nn[nH]n2)C(C)C)cc1 ZINC000821782677 599300176 /nfs/dbraw/zinc/30/01/76/599300176.db2.gz KEXJZMWAGVRXRV-QGZVFWFLSA-N 0 0 368.397 3.593 20 5 FHBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1Oc1ncc(-c2nn[nH]n2)cc1Cl ZINC000737265072 599305700 /nfs/dbraw/zinc/30/57/00/599305700.db2.gz SILOMBRVOGSRSI-UHFFFAOYSA-N 0 0 367.152 3.577 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CS[C@H](C)c1ccc(-c2nn[nH]n2)cc1 ZINC000737117495 599329598 /nfs/dbraw/zinc/32/95/98/599329598.db2.gz XDFYORNLGSWCKL-LLVKDONJSA-N 0 0 371.422 3.778 20 5 FHBDRN CC(C)c1ccc(CSc2nccc(-c3nn[nH]n3)c2[N+](=O)[O-])cc1 ZINC000820192395 606705905 /nfs/dbraw/zinc/70/59/05/606705905.db2.gz MFYPRHQAEUGMHW-UHFFFAOYSA-N 0 0 356.411 3.586 20 5 FHBDRN O=[N+]([O-])c1ccc(Cl)c(CNc2cc(Cl)ccc2-c2nn[nH]n2)c1 ZINC000823639838 606801422 /nfs/dbraw/zinc/80/14/22/606801422.db2.gz IMHFEOFAGQJNDI-UHFFFAOYSA-N 0 0 365.180 3.694 20 5 FHBDRN O=[N+]([O-])c1ccc(F)cc1CSc1ccc(-c2nn[nH]n2)cc1Cl ZINC000826498103 607844966 /nfs/dbraw/zinc/84/49/66/607844966.db2.gz HQAUXKSGEDPEDQ-UHFFFAOYSA-N 0 0 365.777 3.860 20 5 FHBDRN O=[N+]([O-])c1ccc(C(=Cc2ccccc2-c2nn[nH]n2)c2ccncc2)cc1 ZINC000826498533 607884531 /nfs/dbraw/zinc/88/45/31/607884531.db2.gz ZOXNWPLLRMCPOE-UYRXBGFRSA-N 0 0 370.372 3.759 20 5 FHBDRN COc1ccc(CS[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1-c1nn[nH]n1 ZINC000826207408 607984144 /nfs/dbraw/zinc/98/41/44/607984144.db2.gz NASUCTDLFYWWPZ-NSHDSACASA-N 0 0 371.422 3.778 20 5 FHBDRN CCCC(CCC)C(=O)Nc1cc(-c2nn[nH]n2)cc([N+](=O)[O-])c1Cl ZINC000825242202 608160931 /nfs/dbraw/zinc/16/09/31/608160931.db2.gz KWKMDEYEUVSUMY-UHFFFAOYSA-N 0 0 366.809 3.583 20 5 FHBDRN O=[N+]([O-])c1ccccc1-c1ccc(CNc2ccc(-c3nn[nH]n3)cc2)o1 ZINC000826500354 608869747 /nfs/dbraw/zinc/86/97/47/608869747.db2.gz VMAQCNCPBPCTIL-UHFFFAOYSA-N 0 0 362.349 3.647 20 5 FHBDRN O=[N+]([O-])c1cccc2nc(C=Cc3ccc(F)c(-c4nn[nH]n4)c3)ccc21 ZINC000826500352 608878026 /nfs/dbraw/zinc/87/80/26/608878026.db2.gz VKDPBKZHZZKJGC-XQRVVYSFSA-N 0 0 362.324 3.633 20 5 FHBDRN CC[C@H](Nc1ncc(Cl)c(C)c1-c1nn[nH]n1)c1cccc([N+](=O)[O-])c1 ZINC000825149545 609569375 /nfs/dbraw/zinc/56/93/75/609569375.db2.gz ZYOKKMQWXRXWND-ZDUSSCGKSA-N 0 0 373.804 3.695 20 5 FHBDRN COCc1ccc([C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])c(Cl)c2)o1 ZINC000161894975 936318702 /nfs/dbraw/zinc/31/87/02/936318702.db2.gz LSMLHTAWQIJOPF-OAHLLOKOSA-N 0 0 364.785 3.965 20 5 FHBDRN CC(=O)N(c1nnc(S[C@@H](C)c2ccccc2[N+](=O)[O-])s1)C1CC1 ZINC000078958803 936320576 /nfs/dbraw/zinc/32/05/76/936320576.db2.gz KROHJFNKYQRLRH-VIFPVBQESA-N 0 0 364.452 3.815 20 5 FHBDRN O=C(c1ccc(Cl)cc1[N+](=O)[O-])N1CCO[C@H](c2cccs2)C1 ZINC000161922480 936322385 /nfs/dbraw/zinc/32/23/85/936322385.db2.gz CEMYLXXHDWOASA-ZDUSSCGKSA-N 0 0 352.799 3.523 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NS(=O)(=O)c1ccc(OC)c(C)c1C ZINC000572896908 936325904 /nfs/dbraw/zinc/32/59/04/936325904.db2.gz PYEWIJUSSLIKBG-UHFFFAOYSA-N 0 0 364.423 3.583 20 5 FHBDRN COc1cccc([C@H](C)c2noc(CCc3cccc([N+](=O)[O-])c3)n2)c1 ZINC000612917148 936342679 /nfs/dbraw/zinc/34/26/79/936342679.db2.gz FROBCLOHXCXLDB-ZDUSSCGKSA-N 0 0 353.378 3.923 20 5 FHBDRN C[C@H]1CCCC[C@@H]1CNC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC001125640081 936338641 /nfs/dbraw/zinc/33/86/41/936338641.db2.gz YJPLGQDRIVYMBI-WDEREUQCSA-N 0 0 355.232 3.913 20 5 FHBDRN COCc1ccc([C@H]2CCCN2C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)o1 ZINC000162051529 936341371 /nfs/dbraw/zinc/34/13/71/936341371.db2.gz ZYSHJZBQBRYUBI-CQSZACIVSA-N 0 0 364.785 3.965 20 5 FHBDRN CCN(C[C@@H]1CCCO1)C(=O)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000278003988 936348503 /nfs/dbraw/zinc/34/85/03/936348503.db2.gz XWYDAGUOYFCVRM-AWEZNQCLSA-N 0 0 350.418 3.735 20 5 FHBDRN C[C@@]12CCN(C(=O)c3ccc(Cl)c([N+](=O)[O-])c3)C[C@@H]1C2(Cl)Cl ZINC000283892660 936350146 /nfs/dbraw/zinc/35/01/46/936350146.db2.gz APUPZOWYCDNIBC-WCQYABFASA-N 0 0 363.628 3.904 20 5 FHBDRN COCc1cccc(/C=C2/N=C(c3c(Cl)cccc3[N+](=O)[O-])OC2=O)c1 ZINC000255562422 936372040 /nfs/dbraw/zinc/37/20/40/936372040.db2.gz KZRBJFMONKCCHI-NTEUORMPSA-N 0 0 372.764 3.739 20 5 FHBDRN C[C@@H](Cc1ccccc1F)NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000158769291 936375606 /nfs/dbraw/zinc/37/56/06/936375606.db2.gz YLRWDFQKFIHVOG-LBPRGKRZSA-N 0 0 355.369 3.505 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1)CN(C[C@H](O)c1ccc(Cl)cc1Cl)CC2 ZINC001167648763 936376352 /nfs/dbraw/zinc/37/63/52/936376352.db2.gz XWUPSLADYNDJGE-KRWDZBQOSA-N 0 0 367.232 3.993 20 5 FHBDRN Cc1cc(C)c(NS(=O)(=O)c2cccc([N+](=O)[O-])c2C)c(Cl)c1 ZINC000613112192 936377175 /nfs/dbraw/zinc/37/71/75/936377175.db2.gz XXVDNWWAQSXTJE-UHFFFAOYSA-N 0 0 354.815 3.974 20 5 FHBDRN O=C(Nc1ccc(F)cn1)c1cc(Br)cc([N+](=O)[O-])c1Cl ZINC000135976291 936379221 /nfs/dbraw/zinc/37/92/21/936379221.db2.gz QHWKWXQDORZFJS-UHFFFAOYSA-N 0 0 374.553 3.797 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(O[C@H]2CCCC[C@@H]2O)cc1 ZINC000278042124 936389117 /nfs/dbraw/zinc/38/91/17/936389117.db2.gz SFZMVHLCEPSTKV-ROUUACIJSA-N 0 0 370.405 3.838 20 5 FHBDRN CCCC[C@@H]1CCC[C@H]1NC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000110719704 945065625 /nfs/dbraw/zinc/06/56/25/945065625.db2.gz OCZQVBMYVTUHFN-RHSMWYFYSA-N 0 0 356.426 3.869 20 5 FHBDRN O=C(N[C@@H]1C[C@H]1c1ccccc1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000079439327 937091774 /nfs/dbraw/zinc/09/17/74/937091774.db2.gz DRTJUWDFQLCXOC-UONOGXRCSA-N 0 0 361.195 3.643 20 5 FHBDRN O=C(NCc1cccc([N+](=O)[O-])c1)c1cccc(Br)c1Cl ZINC000136025115 937094081 /nfs/dbraw/zinc/09/40/81/937094081.db2.gz NHCRBNGONOTYKX-UHFFFAOYSA-N 0 0 369.602 3.941 20 5 FHBDRN C[C@H]1CN(c2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)C[C@H](c2ccsc2)O1 ZINC000162405360 937095244 /nfs/dbraw/zinc/09/52/44/937095244.db2.gz LKHDZDLOFVOMOH-APPDUMDISA-N 0 0 373.434 3.507 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N1CCC[C@H]1c1ccsc1 ZINC000056062930 937110004 /nfs/dbraw/zinc/11/00/04/937110004.db2.gz GZFYQYDQOPZJST-LBPRGKRZSA-N 0 0 372.855 3.836 20 5 FHBDRN O=C(Nc1cc2c(cc1F)NC(=O)CC2)c1ccc([N+](=O)[O-])cc1Cl ZINC000122054150 937120668 /nfs/dbraw/zinc/12/06/68/937120668.db2.gz QQRACIGNPGMVNR-UHFFFAOYSA-N 0 0 363.732 3.524 20 5 FHBDRN O=C(CSc1ncccc1[N+](=O)[O-])c1sccc1Br ZINC000049418459 927045787 /nfs/dbraw/zinc/04/57/87/927045787.db2.gz HIDIGMZGOAHPMA-UHFFFAOYSA-N 0 0 359.226 3.789 20 5 FHBDRN O=C(Nc1cnc2ccccc2c1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000023353074 927051820 /nfs/dbraw/zinc/05/18/20/927051820.db2.gz PMTBNBFYAXCGKV-UHFFFAOYSA-N 0 0 362.389 3.996 20 5 FHBDRN NC(=O)c1cccc(N[C@H]2C[C@H]2c2ccccc2C(F)(F)F)c1[N+](=O)[O-] ZINC000557567901 927064579 /nfs/dbraw/zinc/06/45/79/927064579.db2.gz OUMDVBKVOXLWFR-FZMZJTMJSA-N 0 0 365.311 3.681 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])c(Cl)c1)N1CCSC[C@@H]1c1nccs1 ZINC000274527650 927088189 /nfs/dbraw/zinc/08/81/89/927088189.db2.gz YDRNQNXSRANPED-GFCCVEGCSA-N 0 0 369.855 3.635 20 5 FHBDRN Cc1cc(NC(=O)[C@H](C)Oc2cnc3ccccc3c2)ccc1[N+](=O)[O-] ZINC000471103807 927131998 /nfs/dbraw/zinc/13/19/98/927131998.db2.gz JPWRFDLVKBWFFH-ZDUSSCGKSA-N 0 0 351.362 3.857 20 5 FHBDRN O=[N+]([O-])c1cccc(F)c1N1CCO[C@H](c2ccc(OC(F)F)cc2)C1 ZINC000557610461 927156521 /nfs/dbraw/zinc/15/65/21/927156521.db2.gz DMYGMGGCALWJHD-HNNXBMFYSA-N 0 0 368.311 3.913 20 5 FHBDRN O=[N+]([O-])c1ccccc1-c1ccc(N2CCC[C@H]2c2nccs2)nn1 ZINC001167047210 927157138 /nfs/dbraw/zinc/15/71/38/927157138.db2.gz FAUPJUGSXLHSLS-HNNXBMFYSA-N 0 0 353.407 3.850 20 5 FHBDRN COc1cc(C(=O)N[C@H]2CCC[C@H](C(C)C)C2)cc([N+](=O)[O-])c1OC ZINC000610174581 927193788 /nfs/dbraw/zinc/19/37/88/927193788.db2.gz REWWEMCFCHKTSR-JSGCOSHPSA-N 0 0 350.415 3.557 20 5 FHBDRN COC1(C)CCN(C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC1 ZINC000274579733 927198200 /nfs/dbraw/zinc/19/82/00/927198200.db2.gz HHGJZDWAMYKBJC-UHFFFAOYSA-N 0 0 361.320 3.646 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)O[C@H](c1ccccn1)C(F)(F)F ZINC000160203031 927266263 /nfs/dbraw/zinc/26/62/63/927266263.db2.gz PSEMXJJQJZLHSP-CQSZACIVSA-N 0 0 372.324 3.929 20 5 FHBDRN COc1ccc(C(=O)Nc2ccc(F)c([N+](=O)[O-])c2)c(Br)c1 ZINC000133647450 927280477 /nfs/dbraw/zinc/28/04/77/927280477.db2.gz UCDWDERMOVYPAV-UHFFFAOYSA-N 0 0 369.146 3.757 20 5 FHBDRN C/C(=C\C(=O)Oc1ccc2c(c1)CCCC(=O)N2)c1ccc([N+](=O)[O-])cc1 ZINC000784905640 927282435 /nfs/dbraw/zinc/28/24/35/927282435.db2.gz UGXGZPHXVFUOBD-ACCUITESSA-N 0 0 366.373 3.879 20 5 FHBDRN COc1ccc(CN2C[C@H](C)O[C@@H](c3ccc(F)cc3)C2)cc1[N+](=O)[O-] ZINC000126835152 927286713 /nfs/dbraw/zinc/28/67/13/927286713.db2.gz MTEYDZYWHWLJNZ-ORAYPTAESA-N 0 0 360.385 3.705 20 5 FHBDRN C[C@H]1Oc2cc(F)ccc2[C@H]1NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000579749766 927287189 /nfs/dbraw/zinc/28/71/89/927287189.db2.gz UNODTPYBOMLESV-GLEZIHRCSA-N 0 0 350.733 3.639 20 5 FHBDRN C[C@H]1CCCN(C(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])[C@H]1C ZINC000610178769 927316882 /nfs/dbraw/zinc/31/68/82/927316882.db2.gz WXYLKHCKQVNDKQ-QWRGUYRKSA-N 0 0 360.332 3.797 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N1Cc2cccc(Cl)c2C1 ZINC000557864707 927375094 /nfs/dbraw/zinc/37/50/94/927375094.db2.gz VJNBDIWETBFRMH-UHFFFAOYSA-N 0 0 366.826 3.570 20 5 FHBDRN COc1ccccc1[C@]1(C)C[C@H]1NC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000610181639 927400718 /nfs/dbraw/zinc/40/07/18/927400718.db2.gz GHIUPULTRBGZOP-NQIIRXRSSA-N 0 0 368.433 3.727 20 5 FHBDRN Cc1c(Br)cc(C(=O)N2CCCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000475845843 927421671 /nfs/dbraw/zinc/42/16/71/927421671.db2.gz GUQNBWWFBZQOAZ-JTQLQIEISA-N 0 0 355.232 3.928 20 5 FHBDRN Cc1nc2c(cccc2C(=O)Nc2cc(C)nc3ccc([N+](=O)[O-])cc32)o1 ZINC000471115130 927453870 /nfs/dbraw/zinc/45/38/70/927453870.db2.gz HEMCFMNWDCOGHA-UHFFFAOYSA-N 0 0 362.345 3.575 20 5 FHBDRN CCC[C@H]1[C@H](C)CCCN1C(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000175289837 927457503 /nfs/dbraw/zinc/45/75/03/927457503.db2.gz CZWNHOHALLHLGW-OCCSQVGLSA-N 0 0 350.415 3.653 20 5 FHBDRN CN(C(=O)[C@H]1CCN(c2ccccc2Cl)C1)c1ccc([N+](=O)[O-])cc1 ZINC000463290108 927465538 /nfs/dbraw/zinc/46/55/38/927465538.db2.gz IWYXBHBPVGBOQY-ZDUSSCGKSA-N 0 0 359.813 3.738 20 5 FHBDRN Cc1c(NC(=O)NCC2CCN(c3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000471119684 927555883 /nfs/dbraw/zinc/55/58/83/927555883.db2.gz YAGIWPJSOMGVGR-UHFFFAOYSA-N 0 0 368.437 3.941 20 5 FHBDRN CSc1ccc(C(=O)N2CC[C@]3(C2)OCc2ccccc23)cc1[N+](=O)[O-] ZINC000186928644 927588038 /nfs/dbraw/zinc/58/80/38/927588038.db2.gz XXNHLJVXUGAXBG-LJQANCHMSA-N 0 0 370.430 3.588 20 5 FHBDRN C[C@@H](Sc1ccc(C(F)(F)F)nn1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000186934990 927595727 /nfs/dbraw/zinc/59/57/27/927595727.db2.gz RZIDYRFLUGLPOU-MRVPVSSYSA-N 0 0 372.328 3.523 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)NC[C@@H]2[C@@H]3Cc4ccccc4[C@H]23)cc1[N+](=O)[O-] ZINC000246864213 927701281 /nfs/dbraw/zinc/70/12/81/927701281.db2.gz LEUDPBQMVFCBEF-NTCOEUGSSA-N 0 0 365.433 3.849 20 5 FHBDRN CC(C)CSCCNC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000535947430 937187800 /nfs/dbraw/zinc/18/78/00/937187800.db2.gz CSOOPNLUEUUODL-LLVKDONJSA-N 0 0 360.863 3.521 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@](C)(C1CC1)C(F)(F)F ZINC000471137222 927746131 /nfs/dbraw/zinc/74/61/31/927746131.db2.gz OONNHTAWWVOTQC-YMTOWFKASA-N 0 0 362.373 3.923 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H]1CCOC2(CCCCC2)C1 ZINC000120215169 927767752 /nfs/dbraw/zinc/76/77/52/927767752.db2.gz SCPVQSJZRMNWQQ-ZDUSSCGKSA-N 0 0 363.414 3.607 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)N[C@H]2C[C@@]2(C)c2ccccc2)cc1SC ZINC000610190992 927786622 /nfs/dbraw/zinc/78/66/22/927786622.db2.gz WHLHBBGAPBWTPM-HKUYNNGSSA-N 0 0 372.446 3.785 20 5 FHBDRN Cc1c(NC(=O)N(Cc2ccccc2)[C@@H](CO)C(C)C)cccc1[N+](=O)[O-] ZINC000175303227 927817826 /nfs/dbraw/zinc/81/78/26/927817826.db2.gz PEABQKRBGOLSPX-IBGZPJMESA-N 0 0 371.437 3.954 20 5 FHBDRN O=C(Nc1c2c(nn1-c1ccccc1)CCC2)c1ccc([N+](=O)[O-])s1 ZINC000038510713 927871955 /nfs/dbraw/zinc/87/19/55/927871955.db2.gz ZGNMLZJZCAVRTC-UHFFFAOYSA-N 0 0 354.391 3.583 20 5 FHBDRN Cc1cc(F)cc(C(=O)Nc2cnc(-c3ccccc3)nc2)c1[N+](=O)[O-] ZINC000175731408 927876509 /nfs/dbraw/zinc/87/65/09/927876509.db2.gz FFLDQVMNJUNUPZ-UHFFFAOYSA-N 0 0 352.325 3.752 20 5 FHBDRN C[C@H]1CO[C@H](c2cccc(Cl)c2)CN1C(=O)c1ccc([N+](=O)[O-])cc1 ZINC000187060995 927877259 /nfs/dbraw/zinc/87/72/59/927877259.db2.gz XSRYTYRRKZWSSB-SJCJKPOMSA-N 0 0 360.797 3.850 20 5 FHBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)N1C[C@@H](C2CC2)[C@@H]1C1CC1 ZINC000458411777 937200325 /nfs/dbraw/zinc/20/03/25/937200325.db2.gz DPOHHDOCBBBSET-OALUTQOASA-N 0 0 357.454 3.748 20 5 FHBDRN Cc1cc([N-]S(=O)(=O)c2c(C)cccc2[N+](=O)[O-])ccc1OC(C)C ZINC000610194459 927901022 /nfs/dbraw/zinc/90/10/22/927901022.db2.gz HYNBLXHWOSKMNE-UHFFFAOYSA-N 0 0 364.423 3.800 20 5 FHBDRN COc1cc(C(=O)N2CCC[C@@H]2c2ccccc2C)cc([N+](=O)[O-])c1OC ZINC000610195961 927904007 /nfs/dbraw/zinc/90/40/07/927904007.db2.gz CTYJLRONGCKCPO-MRXNPFEDSA-N 0 0 370.405 3.898 20 5 FHBDRN CNc1ccc(C(=O)Nc2ccc(CC(F)(F)F)cc2)cc1[N+](=O)[O-] ZINC000610200301 927952873 /nfs/dbraw/zinc/95/28/73/927952873.db2.gz AQMHOKPSZLWVAO-UHFFFAOYSA-N 0 0 353.300 3.994 20 5 FHBDRN CC(=O)c1ccc(F)cc1OCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000157518379 927973065 /nfs/dbraw/zinc/97/30/65/927973065.db2.gz YSMFNCSQCLGXOV-UHFFFAOYSA-N 0 0 357.297 3.566 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)Nc1ccc(NC(C)=O)c(OC)c1 ZINC000583174118 937208528 /nfs/dbraw/zinc/20/85/28/937208528.db2.gz UVLDAQQQJYTNDE-UHFFFAOYSA-N 0 0 372.381 3.768 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NCCCOCCc1ccccc1 ZINC001125290400 927990441 /nfs/dbraw/zinc/99/04/41/927990441.db2.gz PMVXCNRSOGQHLL-UHFFFAOYSA-N 0 0 356.422 3.591 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1CN1CCC(Oc2ccc(F)cc2)CC1 ZINC000430209575 928084201 /nfs/dbraw/zinc/08/42/01/928084201.db2.gz RURGABIHNSOSAJ-UHFFFAOYSA-N 0 0 360.385 3.786 20 5 FHBDRN Cc1nn(CN2C[C@@H](C)O[C@H](c3ccsc3)C2)c2cc([N+](=O)[O-])ccc12 ZINC000121258933 928087558 /nfs/dbraw/zinc/08/75/58/928087558.db2.gz DSNYEVHFWSBBMI-XIKOKIGWSA-N 0 0 372.450 3.734 20 5 FHBDRN CSc1cnn(-c2ccccc2)c1NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000157521106 928105746 /nfs/dbraw/zinc/10/57/46/928105746.db2.gz UPKMFBVWBNQLRC-UHFFFAOYSA-N 0 0 354.391 3.755 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)Nc1ccc(O[C@@H]2CCOC2)cc1 ZINC000157527785 928143497 /nfs/dbraw/zinc/14/34/97/928143497.db2.gz DWYJASUZUVJOEM-MRXNPFEDSA-N 0 0 357.366 3.715 20 5 FHBDRN CCn1cc(NC(=O)c2cc([N+](=O)[O-])ccc2NCc2ccccc2)cn1 ZINC000109045002 928155196 /nfs/dbraw/zinc/15/51/96/928155196.db2.gz UXCUJNAWDGXNRQ-UHFFFAOYSA-N 0 0 365.393 3.676 20 5 FHBDRN COc1cc(C(=O)N2CCC[C@@H]2c2cccs2)c([N+](=O)[O-])cc1OC ZINC000070751806 928163897 /nfs/dbraw/zinc/16/38/97/928163897.db2.gz ZYVJHSKAVXAXBE-GFCCVEGCSA-N 0 0 362.407 3.651 20 5 FHBDRN CC(C)Sc1c(Cl)cccc1NC(=O)Cn1ccc([N+](=O)[O-])n1 ZINC000157531069 928212454 /nfs/dbraw/zinc/21/24/54/928212454.db2.gz KIGPLKFIMYNHJK-UHFFFAOYSA-N 0 0 354.819 3.584 20 5 FHBDRN O=[N+]([O-])c1ccc(OCc2nc(CC(F)(F)F)no2)c(C(F)(F)F)c1 ZINC000610217712 928219151 /nfs/dbraw/zinc/21/91/51/928219151.db2.gz HBWWIQLTHMQOBB-UHFFFAOYSA-N 0 0 371.193 3.680 20 5 FHBDRN C/C=C/C[C@H](CO)NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000187164120 928226823 /nfs/dbraw/zinc/22/68/23/928226823.db2.gz XOZIGKFJWNBZIO-BAABZTOOSA-N 0 0 372.446 3.803 20 5 FHBDRN COc1ccc(OCCOc2ccc(Cl)cc2C(C)=O)c([N+](=O)[O-])c1 ZINC000610218387 928248087 /nfs/dbraw/zinc/24/80/87/928248087.db2.gz IPYFCBRRTKYUGP-UHFFFAOYSA-N 0 0 365.769 3.917 20 5 FHBDRN Cc1ccc(C[C@@H](C)NC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)s1 ZINC000126909812 928260500 /nfs/dbraw/zinc/26/05/00/928260500.db2.gz FPVYRBVECAWPHZ-GFCCVEGCSA-N 0 0 370.434 3.511 20 5 FHBDRN O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ncc(Cc2ccc(F)cc2)s1 ZINC000610221569 928288393 /nfs/dbraw/zinc/28/83/93/928288393.db2.gz YESQZKNENNBXAU-UHFFFAOYSA-N 0 0 371.393 3.962 20 5 FHBDRN Cc1ccc(NC(=O)CCn2cc([N+](=O)[O-])cn2)cc1OCCC(C)C ZINC000157576125 928294200 /nfs/dbraw/zinc/29/42/00/928294200.db2.gz UCRMMYPJBSFEHN-UHFFFAOYSA-N 0 0 360.414 3.553 20 5 FHBDRN CCOc1ccc([C@@H](C)NC(=O)c2cc(C)ccc2[N+](=O)[O-])cc1OC ZINC000610223643 928303018 /nfs/dbraw/zinc/30/30/18/928303018.db2.gz KOLPRIVMGAWFJH-CYBMUJFWSA-N 0 0 358.394 3.802 20 5 FHBDRN Cc1c(OC(=O)c2ccc(N3CCC(C)CC3)nc2)cccc1[N+](=O)[O-] ZINC001125296804 928303668 /nfs/dbraw/zinc/30/36/68/928303668.db2.gz HAXJAUCJPWYYNW-UHFFFAOYSA-N 0 0 355.394 3.754 20 5 FHBDRN O=C(/C=C/c1ccnc(Cl)c1)OCCSc1ccc([N+](=O)[O-])cc1 ZINC000784939757 928319748 /nfs/dbraw/zinc/31/97/48/928319748.db2.gz SPARFGWOUZAJSS-LZCJLJQNSA-N 0 0 364.810 3.992 20 5 FHBDRN CSc1ccc(C(=O)N2CCc3c([nH]c4ccccc43)C2)cc1[N+](=O)[O-] ZINC000126951487 928326461 /nfs/dbraw/zinc/32/64/61/928326461.db2.gz RNNALAUCWUDCMV-UHFFFAOYSA-N 0 0 367.430 3.997 20 5 FHBDRN Cc1cc(N[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C)cc(C(=O)[O-])c1[N+](=O)[O-] ZINC000583207848 937237639 /nfs/dbraw/zinc/23/76/39/937237639.db2.gz VOZKPPAWKCQDJT-RDTXWAMCSA-N 0 0 369.421 3.534 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)NCc1cc(F)c(Cl)cc1F ZINC000471163538 928339856 /nfs/dbraw/zinc/33/98/56/928339856.db2.gz XVXYPCKOLLFDLZ-UHFFFAOYSA-N 0 0 370.739 3.855 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)N[C@@H]2[C@@H]3Cc4ccccc4[C@@H]32)cc1[N+](=O)[O-] ZINC000248112451 937238197 /nfs/dbraw/zinc/23/81/97/937238197.db2.gz CDUFRJWFOYIQBH-SZUHRMQMSA-N 0 0 351.406 3.602 20 5 FHBDRN CCOc1cc(F)ccc1NC(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000579839076 928365648 /nfs/dbraw/zinc/36/56/48/928365648.db2.gz KKWOEVDNTQYBDG-UHFFFAOYSA-N 0 0 361.373 3.839 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1CN1CC2(CCOCC2)c2ccccc21 ZINC000430239210 928405069 /nfs/dbraw/zinc/40/50/69/928405069.db2.gz JVWJLSDQWSTMPC-UHFFFAOYSA-N 0 0 354.406 3.672 20 5 FHBDRN Cc1ccc(NC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)cc1N1CCOC1=O ZINC000254941959 928408723 /nfs/dbraw/zinc/40/87/23/928408723.db2.gz HUTMXYSPXZDZTH-UITAMQMPSA-N 0 0 367.361 3.512 20 5 FHBDRN C[C@H](c1ccncc1)N(C)C(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000120469449 928519601 /nfs/dbraw/zinc/51/96/01/928519601.db2.gz XSDQBPWVWWJLIP-NEPJUHHUSA-N 0 0 363.801 3.630 20 5 FHBDRN CCOc1ccc([C@H](C)Nc2ccc(C(N)=O)cc2[N+](=O)[O-])cc1OCC ZINC000015170033 928583686 /nfs/dbraw/zinc/58/36/86/928583686.db2.gz VJCVCTRNRLADNB-LBPRGKRZSA-N 0 0 373.409 3.664 20 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/nfs/dbraw/zinc/73/61/91/928736191.db2.gz LMUBHAPEEMSHKG-FPLPWBNLSA-N 0 0 365.311 3.594 20 5 FHBDRN COc1cc(CN(C)CCCOc2ccccc2C)c([N+](=O)[O-])cc1F ZINC001167083648 928750663 /nfs/dbraw/zinc/75/06/63/928750663.db2.gz IDGDMACWGPLIMW-UHFFFAOYSA-N 0 0 362.401 3.952 20 5 FHBDRN Cc1ccc(CNC(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)nc1C ZINC000457989180 928754847 /nfs/dbraw/zinc/75/48/47/928754847.db2.gz AOBOWEIIPHTNTG-UHFFFAOYSA-N 0 0 353.300 3.555 20 5 FHBDRN COc1ccccc1-c1csc(NC(=O)c2cccc([N+](=O)[O-])c2N)n1 ZINC000176565893 937274143 /nfs/dbraw/zinc/27/41/43/937274143.db2.gz OWEGPNNZHDKFAS-UHFFFAOYSA-N 0 0 370.390 3.561 20 5 FHBDRN CC1(C)CCN(C(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])CC1 ZINC000608882661 928798510 /nfs/dbraw/zinc/79/85/10/928798510.db2.gz IOGJOWLYJGUQGL-UHFFFAOYSA-N 0 0 360.332 3.798 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H](C)c1noc(-c2ccccc2)n1 ZINC000134427507 928896602 /nfs/dbraw/zinc/89/66/02/928896602.db2.gz RZJLCFPDAPRUMP-LBPRGKRZSA-N 0 0 367.365 3.836 20 5 FHBDRN C[C@@H]1CO[C@@H](c2ccccc2)CN1C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000066710089 928909657 /nfs/dbraw/zinc/90/96/57/928909657.db2.gz FMSFDZQLHLAITD-FZKQIMNGSA-N 0 0 365.389 3.678 20 5 FHBDRN CC(C)CCN(CCC(C)C)C(=O)c1cc([N+](=O)[O-])cc2c1OCCO2 ZINC000608933883 928910739 /nfs/dbraw/zinc/91/07/39/928910739.db2.gz LIJNRBHXLHYUBI-UHFFFAOYSA-N 0 0 364.442 3.900 20 5 FHBDRN Cc1cccc(C(=O)N2CC[C@H](OCCCc3ccccc3)C2)c1[N+](=O)[O-] ZINC000176596321 937285741 /nfs/dbraw/zinc/28/57/41/937285741.db2.gz JEMCIDTVOUVESB-SFHVURJKSA-N 0 0 368.433 3.767 20 5 FHBDRN COc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])cc3F)CCCC2)cc1 ZINC000609008445 928946552 /nfs/dbraw/zinc/94/65/52/928946552.db2.gz DMLLCAAEBYMDDC-UHFFFAOYSA-N 0 0 358.369 3.942 20 5 FHBDRN Cc1c(C(=O)N(c2ccccn2)C2CCCC2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000154563195 928961894 /nfs/dbraw/zinc/96/18/94/928961894.db2.gz KWEDCGYJNUBALS-UHFFFAOYSA-N 0 0 370.365 3.796 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)CCC(=O)OCC ZINC001266324467 928992834 /nfs/dbraw/zinc/99/28/34/928992834.db2.gz JDQYTTMHHWCWDZ-LBPRGKRZSA-N 0 0 368.455 3.559 20 5 FHBDRN COc1cccc2c1CCN(C(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F)C2 ZINC000545126100 937294194 /nfs/dbraw/zinc/29/41/94/937294194.db2.gz VMNMVZBZCXZLRF-UHFFFAOYSA-N 0 0 372.396 3.605 20 5 FHBDRN C[C@H]1C[C@H](C)CN(c2ccc(C(=O)N(C)c3ccccn3)cc2[N+](=O)[O-])C1 ZINC000134545923 929007886 /nfs/dbraw/zinc/00/78/86/929007886.db2.gz LEDHBACOHCSRLG-GJZGRUSLSA-N 0 0 368.437 3.749 20 5 FHBDRN CC(C)(C)c1csc(CNC(=O)CSc2ccc([N+](=O)[O-])cc2)n1 ZINC000609190291 929039464 /nfs/dbraw/zinc/03/94/64/929039464.db2.gz OFKMGSVAZWDHAG-UHFFFAOYSA-N 0 0 365.480 3.757 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N1CC2(CCC2)[C@@H]1c1ccncc1 ZINC000598572093 929056666 /nfs/dbraw/zinc/05/66/66/929056666.db2.gz JUKVOXVFEDLJNL-IBGZPJMESA-N 0 0 351.406 3.676 20 5 FHBDRN CS[C@H]1CCCCN(c2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)C1 ZINC000154633601 929059093 /nfs/dbraw/zinc/05/90/93/929059093.db2.gz KILUJJDRVNKFOF-HNNXBMFYSA-N 0 0 363.483 3.553 20 5 FHBDRN CS[C@H]1CCCCN([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000134579362 929071274 /nfs/dbraw/zinc/07/12/74/929071274.db2.gz VVIFPAPWOLEHKK-AAEUAGOBSA-N 0 0 371.890 3.793 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)N1CCCO[C@@H](c2ccccc2)C1 ZINC000609231370 929089271 /nfs/dbraw/zinc/08/92/71/929089271.db2.gz ZCAQMNIVHAABQZ-GOSISDBHSA-N 0 0 372.446 3.677 20 5 FHBDRN O=C(N[C@H](CC1CC1)c1ccccc1)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000610237329 929097972 /nfs/dbraw/zinc/09/79/72/929097972.db2.gz RIBKIEYBAWDTTM-OAHLLOKOSA-N 0 0 354.362 3.595 20 5 FHBDRN CC(C)(CNC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1)c1cccs1 ZINC000134682712 929129872 /nfs/dbraw/zinc/12/98/72/929129872.db2.gz GQGVWADPJPJJEU-UHFFFAOYSA-N 0 0 370.434 3.550 20 5 FHBDRN Cc1nc([C@H]2CCCN2c2ncc([N+](=O)[O-])cc2Br)cs1 ZINC000275000021 929144076 /nfs/dbraw/zinc/14/40/76/929144076.db2.gz GILZRFQXTOLUCZ-GFCCVEGCSA-N 0 0 369.244 3.859 20 5 FHBDRN CO[C@H](c1ccc(Cl)cc1)[C@@H](C)NC(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000127105957 929196719 /nfs/dbraw/zinc/19/67/19/929196719.db2.gz WFRSSLZNTUXWCX-XIKOKIGWSA-N 0 0 362.813 3.683 20 5 FHBDRN Cc1ccc(C[C@@H](C)NC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)s1 ZINC000134724554 929196764 /nfs/dbraw/zinc/19/67/64/929196764.db2.gz IWAJDUAZHRSTGN-GFCCVEGCSA-N 0 0 370.434 3.511 20 5 FHBDRN COc1cc([C@H](C)Nc2ccc(C(C)=O)cc2[N+](=O)[O-])cc(OC)c1OC ZINC000052242935 937311612 /nfs/dbraw/zinc/31/16/12/937311612.db2.gz XSTINXNYHPMUPI-NSHDSACASA-N 0 0 374.393 3.996 20 5 FHBDRN CCc1cccc2c1OCC[C@@H]2NC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000514905825 937312350 /nfs/dbraw/zinc/31/23/50/937312350.db2.gz CEFYZFBLEHWIFA-ACJLOTCBSA-N 0 0 354.406 3.901 20 5 FHBDRN CN(C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)[C@@H]1CCc2ccccc2C1 ZINC000134781506 929242055 /nfs/dbraw/zinc/24/20/55/929242055.db2.gz XTJIRCXZAAQFMQ-QGZVFWFLSA-N 0 0 363.417 3.635 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(-c2nc(Cc3c[nH]c4ccc(Cl)cc34)no2)n1 ZINC000583288794 937317958 /nfs/dbraw/zinc/31/79/58/937317958.db2.gz RUBCAGRLKVLWQE-UHFFFAOYSA-N 0 0 372.772 3.587 20 5 FHBDRN O=C(NCCCOc1ccccc1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000178843327 937318391 /nfs/dbraw/zinc/31/83/91/937318391.db2.gz PCASZNHASAMYMY-UHFFFAOYSA-N 0 0 369.421 3.738 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CCS[C@@H]2CCCC[C@H]21 ZINC000123622044 929293349 /nfs/dbraw/zinc/29/33/49/929293349.db2.gz IOZGUGBFUSOWCL-IAGOWNOFSA-N 0 0 359.451 3.505 20 5 FHBDRN C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCc2ccc(Cl)cc2C1 ZINC000535628363 929305172 /nfs/dbraw/zinc/30/51/72/929305172.db2.gz ORKJHNVNPRRUJC-LBPRGKRZSA-N 0 0 359.813 3.634 20 5 FHBDRN Cc1nc([C@H]2CCCN2C(=O)c2cc([N+](=O)[O-])cc(F)c2F)cs1 ZINC000275051326 929309825 /nfs/dbraw/zinc/30/98/25/929309825.db2.gz HPBMQGQCNBRDJG-CYBMUJFWSA-N 0 0 353.350 3.615 20 5 FHBDRN CCS[C@@H]1CCCC[C@H]1NC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000134831591 929313970 /nfs/dbraw/zinc/31/39/70/929313970.db2.gz NZNNFUHYWYTDEI-CXAGYDPISA-N 0 0 374.466 3.575 20 5 FHBDRN CC(=O)[C@H](C)CCCCc1nc(CCNc2ccccc2[N+](=O)[O-])no1 ZINC000275054139 929328955 /nfs/dbraw/zinc/32/89/55/929328955.db2.gz PKESZBQXNLAXQU-CYBMUJFWSA-N 0 0 360.414 3.570 20 5 FHBDRN O=C(NCCc1ccccc1[N+](=O)[O-])Nc1cccc(-n2cccc2)c1 ZINC000467991323 929344784 /nfs/dbraw/zinc/34/47/84/929344784.db2.gz XOACTVJGQLFUGC-UHFFFAOYSA-N 0 0 350.378 3.750 20 5 FHBDRN CCN(CCC(F)(F)F)C(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000609724278 929356338 /nfs/dbraw/zinc/35/63/38/929356338.db2.gz GXFHSOUDKRDAGS-UHFFFAOYSA-N 0 0 368.739 3.818 20 5 FHBDRN COc1cc(N2CCC(OCCc3ccccc3)CC2)c(F)cc1[N+](=O)[O-] ZINC000535628764 929379206 /nfs/dbraw/zinc/37/92/06/929379206.db2.gz GFWKJOZCQJIFRV-UHFFFAOYSA-N 0 0 374.412 3.971 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1c2ccccc2N(C)CC[C@@H]1C ZINC000471233952 929410570 /nfs/dbraw/zinc/41/05/70/929410570.db2.gz GVAZPMGAAGYOSU-HNNXBMFYSA-N 0 0 368.437 3.577 20 5 FHBDRN CCc1ccc(C(=O)Nc2ccc3nnc(C4CCC4)n3c2)cc1[N+](=O)[O-] ZINC000187197504 929421284 /nfs/dbraw/zinc/42/12/84/929421284.db2.gz DIAPCBSIJMICRQ-UHFFFAOYSA-N 0 0 365.393 3.720 20 5 FHBDRN Cc1nc(C2(NC(=O)Nc3cccc([N+](=O)[O-])c3C)CCCCC2)no1 ZINC000275073240 929445044 /nfs/dbraw/zinc/44/50/44/929445044.db2.gz ZPUMUGWAIHOZGP-UHFFFAOYSA-N 0 0 359.386 3.576 20 5 FHBDRN CC1(CNC(=O)[C@@H]2C[C@@H]2c2cccc([N+](=O)[O-])c2)Cc2ccccc2C1 ZINC001266353904 929449617 /nfs/dbraw/zinc/44/96/17/929449617.db2.gz GVYIVCOTCAFITF-RTBURBONSA-N 0 0 350.418 3.620 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)NC[C@H]1CCc2ccccc2C1 ZINC000609771631 929450896 /nfs/dbraw/zinc/45/08/96/929450896.db2.gz SKNFWIGTQUXDSJ-HNNXBMFYSA-N 0 0 353.422 3.541 20 5 FHBDRN Cc1nc([C@@H]2CCCN2C(=O)c2cc(F)c([N+](=O)[O-])cc2F)cs1 ZINC000275079722 929480276 /nfs/dbraw/zinc/48/02/76/929480276.db2.gz NEQYOPPPLADKRH-ZDUSSCGKSA-N 0 0 353.350 3.615 20 5 FHBDRN COc1cccc(F)c1[C@@H](C)NC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc21 ZINC000610243288 929530271 /nfs/dbraw/zinc/53/02/71/929530271.db2.gz VABHQQBICHCAFD-SNVBAGLBSA-N 0 0 357.341 3.715 20 5 FHBDRN O=C(OCC[C@H]1CCCCO1)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000784956250 929535795 /nfs/dbraw/zinc/53/57/95/929535795.db2.gz ORKYUZIXYREALJ-MRXNPFEDSA-N 0 0 362.426 3.701 20 5 FHBDRN O=C(OCC[C@@H]1CCCCO1)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000784956249 929535863 /nfs/dbraw/zinc/53/58/63/929535863.db2.gz ORKYUZIXYREALJ-INIZCTEOSA-N 0 0 362.426 3.701 20 5 FHBDRN Cc1nc(-c2ccc(NC(=O)c3c(N)cccc3[N+](=O)[O-])cc2)cs1 ZINC000180604622 929592522 /nfs/dbraw/zinc/59/25/22/929592522.db2.gz XZTWAGUAILAZPZ-UHFFFAOYSA-N 0 0 354.391 3.861 20 5 FHBDRN Cc1cnn(Cc2ccccc2F)c1NC(=O)c1cccc([N+](=O)[O-])c1C ZINC000187227399 929616067 /nfs/dbraw/zinc/61/60/67/929616067.db2.gz VMVHHNCIIJOWSJ-UHFFFAOYSA-N 0 0 368.368 3.848 20 5 FHBDRN Cc1cnn(Cc2ccccc2F)c1NC(=O)c1cc([N+](=O)[O-])ccc1C ZINC000187228709 929617148 /nfs/dbraw/zinc/61/71/48/929617148.db2.gz OCFOOJJADPMOHG-UHFFFAOYSA-N 0 0 368.368 3.848 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H](C)c1ccc(F)cc1F ZINC000043126957 929617253 /nfs/dbraw/zinc/61/72/53/929617253.db2.gz JQHWLCHXCFISIH-VIFPVBQESA-N 0 0 351.309 3.764 20 5 FHBDRN 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CCN(C(=O)c1cc([N+](=O)[O-])cn1C)[C@H](Cc1ccc(F)cc1)C(C)C ZINC000610309997 929799423 /nfs/dbraw/zinc/79/94/23/929799423.db2.gz PIVLBXLWUPGQCT-QGZVFWFLSA-N 0 0 361.417 3.802 20 5 FHBDRN CC(C)[C@H]1CN(C(=O)c2ccc(Br)cc2[N+](=O)[O-])CCS1 ZINC000331158695 929814935 /nfs/dbraw/zinc/81/49/35/929814935.db2.gz FINUCTOUNCOJID-CYBMUJFWSA-N 0 0 373.272 3.571 20 5 FHBDRN CC[C@H](CNC(=O)c1cc([N+](=O)[O-])ccc1Cl)Oc1ccccc1F ZINC000177645915 929820237 /nfs/dbraw/zinc/82/02/37/929820237.db2.gz HTXYEVZLFPNPAF-GFCCVEGCSA-N 0 0 366.776 3.975 20 5 FHBDRN Cc1cccc(C)c1OC[C@H](O)COc1ccc([N+](=O)[O-])c2ncccc12 ZINC000471470620 929831663 /nfs/dbraw/zinc/83/16/63/929831663.db2.gz IWYVUFZXEZFFFV-OAHLLOKOSA-N 0 0 368.389 3.579 20 5 FHBDRN Cc1nc(NC(=O)[C@H]2C[C@H]2c2ccccc2OC(F)F)ccc1[N+](=O)[O-] ZINC000134066841 929831981 /nfs/dbraw/zinc/83/19/81/929831981.db2.gz FGDPPMIGKXCSJD-RYUDHWBXSA-N 0 0 363.320 3.642 20 5 FHBDRN Cc1ccc(CNC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000064868422 929842185 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3.871 20 5 FHBDRN CN(CC(=O)N[C@@H]1CC[C@H](c2ccc(F)cc2)C1)c1ccccc1[N+](=O)[O-] ZINC000471522011 930138472 /nfs/dbraw/zinc/13/84/72/930138472.db2.gz LPWMSMKXBGGLBT-DOTOQJQBSA-N 0 0 371.412 3.623 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N[C@H](c2nccs2)C(F)(F)F)c1C ZINC000891186621 930141654 /nfs/dbraw/zinc/14/16/54/930141654.db2.gz MKKKZNJKTPKLMN-LLVKDONJSA-N 0 0 359.329 3.702 20 5 FHBDRN COc1ccccc1O[C@@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])cc2C)C1 ZINC000560790845 930173747 /nfs/dbraw/zinc/17/37/47/930173747.db2.gz YFPPHSAFZCISFK-MRXNPFEDSA-N 0 0 370.405 3.595 20 5 FHBDRN CCc1ccc([C@@H]2COCCN2C(=O)c2cccc(Cl)c2[N+](=O)[O-])o1 ZINC000175887688 930196263 /nfs/dbraw/zinc/19/62/63/930196263.db2.gz PIJKGPORSQTEDE-AWEZNQCLSA-N 0 0 364.785 3.617 20 5 FHBDRN Cc1ccc(S(=O)(=O)NCCCCc2ccc([N+](=O)[O-])cc2)cc1C ZINC000610086214 930196430 /nfs/dbraw/zinc/19/64/30/930196430.db2.gz SJAHDSSXSISRPE-UHFFFAOYSA-N 0 0 362.451 3.513 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2C[C@H](C)CN(C)c3ccccc32)c1 ZINC000583385404 937395663 /nfs/dbraw/zinc/39/56/63/937395663.db2.gz FWKIDZOZADMKFA-CQSZACIVSA-N 0 0 369.421 3.726 20 5 FHBDRN O=C(COc1ccccc1[N+](=O)[O-])N[C@H]1CC[C@H](c2ccc(F)cc2)C1 ZINC000471534873 930210782 /nfs/dbraw/zinc/21/07/82/930210782.db2.gz AZTLVHXKMRNWNW-HOCLYGCPSA-N 0 0 358.369 3.565 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)Nc1nc2c(s1)C(=O)CCC2 ZINC000275779241 930212713 /nfs/dbraw/zinc/21/27/13/930212713.db2.gz IDVCJNRXYRHVEW-UHFFFAOYSA-N 0 0 365.798 3.784 20 5 FHBDRN Cc1cc(COC(=O)Cc2cccc(Br)c2)ccc1[N+](=O)[O-] ZINC001266572515 930213186 /nfs/dbraw/zinc/21/31/86/930213186.db2.gz LDFNVHYYVKKBCM-UHFFFAOYSA-N 0 0 364.195 3.952 20 5 FHBDRN Cc1cccc(C[C@H](CO)N[C@H](c2ccc([N+](=O)[O-])cc2)C(F)(F)F)c1 ZINC000580084678 930229320 /nfs/dbraw/zinc/22/93/20/930229320.db2.gz YSJVYZSFGXMRFJ-NVXWUHKLSA-N 0 0 368.355 3.700 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccn2ccnc2c1 ZINC000580089167 930231773 /nfs/dbraw/zinc/23/17/73/930231773.db2.gz MSAAVZUMCZDFMY-UHFFFAOYSA-N 0 0 353.382 3.685 20 5 FHBDRN CCN(CC)C(=O)c1ccc(CNc2c(OC)cccc2[N+](=O)[O-])cc1 ZINC000580095506 930243217 /nfs/dbraw/zinc/24/32/17/930243217.db2.gz WSVWYAWQWMJDJF-UHFFFAOYSA-N 0 0 357.410 3.698 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)[C@@H]1CCSc2ccccc21 ZINC000560991855 930265129 /nfs/dbraw/zinc/26/51/29/930265129.db2.gz CUPQYEPVZQHAPW-MRXNPFEDSA-N 0 0 356.447 3.875 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)[C@]1(C)CCCc2ccccc21 ZINC000560994647 930268873 /nfs/dbraw/zinc/26/88/73/930268873.db2.gz YXBNPFDGUFHJLS-OAQYLSRUSA-N 0 0 352.434 3.890 20 5 FHBDRN CSCc1ccc(CNC(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)cc1 ZINC000580122638 930272644 /nfs/dbraw/zinc/27/26/44/930272644.db2.gz JDCJCZQZHMDNHA-UHFFFAOYSA-N 0 0 366.389 3.595 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1[N+](=O)[O-] ZINC000175902176 930273506 /nfs/dbraw/zinc/27/35/06/930273506.db2.gz RHHNTUVECSLGOA-STQMWFEESA-N 0 0 372.381 3.933 20 5 FHBDRN Cc1ccc2c(c1C)OC[C@@H]2Nc1ccc([N+](=O)[O-])cc1C(=O)NC1CC1 ZINC000728286948 930275191 /nfs/dbraw/zinc/27/51/91/930275191.db2.gz MAHRRWJJOOXFAQ-SFHVURJKSA-N 0 0 367.405 3.649 20 5 FHBDRN O=[N+]([O-])c1ccccc1-c1ccc(CN2CCOC[C@H]2CC(F)F)o1 ZINC000580128533 930283673 /nfs/dbraw/zinc/28/36/73/930283673.db2.gz LIBGVQNNIFQXCE-GFCCVEGCSA-N 0 0 352.337 3.711 20 5 FHBDRN C[C@H](c1ccccc1[N+](=O)[O-])N1CCCN(C(=O)CC2CCCC2)CC1 ZINC000610390868 930308604 /nfs/dbraw/zinc/30/86/04/930308604.db2.gz JKFXLNFDFRUEIZ-MRXNPFEDSA-N 0 0 359.470 3.770 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N(C)c2cc(Cl)ccc2OC)c1 ZINC000583393638 937403670 /nfs/dbraw/zinc/40/36/70/937403670.db2.gz OGFXCEURKLVAFN-UHFFFAOYSA-N 0 0 364.785 3.932 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])N[C@@H]1CC[C@H](c2ccc(F)cc2)C1 ZINC000471545787 930344799 /nfs/dbraw/zinc/34/47/99/930344799.db2.gz CTXPHVROLZYGMZ-DOTOQJQBSA-N 0 0 372.396 3.955 20 5 FHBDRN Cn1cc([C@H](N[C@@H]2CCc3c2cccc3[N+](=O)[O-])c2ccc(F)cc2)cn1 ZINC000580216151 930372630 /nfs/dbraw/zinc/37/26/30/930372630.db2.gz OMGIXFXJQZVHJL-UYAOXDASSA-N 0 0 366.396 3.834 20 5 FHBDRN Cn1cc([C@@H](N[C@H]2CCc3c2cccc3[N+](=O)[O-])c2ccc(F)cc2)cn1 ZINC000580216149 930372829 /nfs/dbraw/zinc/37/28/29/930372829.db2.gz OMGIXFXJQZVHJL-ICSRJNTNSA-N 0 0 366.396 3.834 20 5 FHBDRN O=[N+]([O-])c1ccccc1-c1ccc(CNCc2nccc(C(F)F)n2)o1 ZINC000580238877 930392179 /nfs/dbraw/zinc/39/21/79/930392179.db2.gz AAPHESVGXPBQEB-UHFFFAOYSA-N 0 0 360.320 3.872 20 5 FHBDRN Cc1nccn1-c1ccc([C@@H](C)NC(=O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000175799818 930428859 /nfs/dbraw/zinc/42/88/59/930428859.db2.gz ATRKTORAZKGBLA-CYBMUJFWSA-N 0 0 350.378 3.580 20 5 FHBDRN CS[C@H]1CCC[C@H](Nc2cc(CN3CCOCC3)ccc2[N+](=O)[O-])C1 ZINC000580280209 930433140 /nfs/dbraw/zinc/43/31/40/930433140.db2.gz BYIBRBYSXJAXAZ-HOTGVXAUSA-N 0 0 365.499 3.513 20 5 FHBDRN NC(=O)c1cccc(NC2CCC(c3ccc(F)cc3)CC2)c1[N+](=O)[O-] ZINC000580303670 930454270 /nfs/dbraw/zinc/45/42/70/930454270.db2.gz LCXLLYLUUJGCNM-UHFFFAOYSA-N 0 0 357.385 3.971 20 5 FHBDRN CCc1nn(C)c(Nc2ccc3c(c2)nc2n3CCCCC2)c1[N+](=O)[O-] ZINC000579516399 930456022 /nfs/dbraw/zinc/45/60/22/930456022.db2.gz KAPDKACESRTBQZ-UHFFFAOYSA-N 0 0 354.414 3.710 20 5 FHBDRN C[C@H]1CN(c2ccc(Br)cc2[N+](=O)[O-])C[C@@H](C(F)(F)F)O1 ZINC000610412491 930469930 /nfs/dbraw/zinc/46/99/30/930469930.db2.gz YVPLBNXVFFVYIE-CPCISQLKSA-N 0 0 369.137 3.513 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N(C)[C@H](C)Cc1ccc(O)cc1 ZINC000579534370 930487805 /nfs/dbraw/zinc/48/78/05/930487805.db2.gz QBIIHMCMTCPYQM-CYBMUJFWSA-N 0 0 357.410 3.958 20 5 FHBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)O[C@H](c1ccccn1)C(F)(F)F ZINC000255193788 930490782 /nfs/dbraw/zinc/49/07/82/930490782.db2.gz JAJAZLVWCOBZQA-WUKHSURWSA-N 0 0 352.268 3.850 20 5 FHBDRN O=C(NCCCOc1ccc(F)cc1)c1cccc(Cl)c1[N+](=O)[O-] ZINC000175931762 930493368 /nfs/dbraw/zinc/49/33/68/930493368.db2.gz VWHUQOVZHYLDPA-UHFFFAOYSA-N 0 0 352.749 3.586 20 5 FHBDRN CC(=O)c1cc(N[C@H](C)C2CCN(CC(F)(F)F)CC2)ccc1[N+](=O)[O-] ZINC000579539821 930503243 /nfs/dbraw/zinc/50/32/43/930503243.db2.gz VXOKQROMDHKZNV-LLVKDONJSA-N 0 0 373.375 3.872 20 5 FHBDRN C[C@H](NC(=O)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12)[C@@H]1CCOC1 ZINC000275844393 930524656 /nfs/dbraw/zinc/52/46/56/930524656.db2.gz WFIQILKCQYPXHH-WDEREUQCSA-N 0 0 372.371 3.527 20 5 FHBDRN Cc1cc(N2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)ncc1[N+](=O)[O-] ZINC000610430832 930526261 /nfs/dbraw/zinc/52/62/61/930526261.db2.gz GQAMBTQUIKZREP-IUCAKERBSA-N 0 0 357.254 3.865 20 5 FHBDRN COc1cc(CN2CCSC(C)(C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000083416727 930538718 /nfs/dbraw/zinc/53/87/18/930538718.db2.gz KDSLHGQQAUIUCV-UHFFFAOYSA-N 0 0 362.398 3.532 20 5 FHBDRN O=C(C[C@@H]1COCCN1Cc1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1 ZINC000134193961 930539959 /nfs/dbraw/zinc/53/99/59/930539959.db2.gz GLQNYUFAVAGZDJ-QGZVFWFLSA-N 0 0 374.824 3.722 20 5 FHBDRN COc1cc(C(=O)N2C[C@H]3CCCCN3c3ccccc32)ccc1[N+](=O)[O-] ZINC000580352804 930558107 /nfs/dbraw/zinc/55/81/07/930558107.db2.gz LFUZDRLUHYCJCS-OAHLLOKOSA-N 0 0 367.405 3.623 20 5 FHBDRN CCc1ccc([C@@H]2CN(c3cc([N+](=O)[O-])ccc3C(C)=O)CCO2)cc1 ZINC000580354564 930562864 /nfs/dbraw/zinc/56/28/64/930562864.db2.gz JRTRMVZKHPGMCF-FQEVSTJZSA-N 0 0 354.406 3.938 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCC[C@@H]2c2cc[nH]n2)nc1-c1ccc(F)cc1 ZINC000579575407 930569766 /nfs/dbraw/zinc/56/97/66/930569766.db2.gz CIHPUKQFMRZDTQ-OAHLLOKOSA-N 0 0 353.357 3.861 20 5 FHBDRN CO[C@H](c1ccc(F)cc1)[C@H](C)NC(=O)[C@@H]1C[C@H]1c1cccc([N+](=O)[O-])c1 ZINC001266606564 930587615 /nfs/dbraw/zinc/58/76/15/930587615.db2.gz XIDWIWSADYONSL-RCUQFMMVSA-N 0 0 372.396 3.730 20 5 FHBDRN C[C@@H](OCCCNC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000580393506 930620710 /nfs/dbraw/zinc/62/07/10/930620710.db2.gz IIAFZPRUMUTEFZ-HZPDHXFCSA-N 0 0 356.422 3.982 20 5 FHBDRN Nc1cccc([N+](=O)[O-])c1C(=O)NCC1(Cc2cccc(Cl)c2)CC1 ZINC000458024147 930643893 /nfs/dbraw/zinc/64/38/93/930643893.db2.gz WWQIDLQZAXSIAQ-UHFFFAOYSA-N 0 0 359.813 3.583 20 5 FHBDRN Cc1[nH]c2ccc(CNc3cc4nc[nH]c(=O)c4cc3[N+](=O)[O-])cc2c1C ZINC000064942556 930686701 /nfs/dbraw/zinc/68/67/01/930686701.db2.gz VYAHNGZJGXLGNM-UHFFFAOYSA-N 0 0 363.377 3.542 20 5 FHBDRN CCCN(C(=O)c1cc(F)cc([N+](=O)[O-])c1)[C@@H]1C[C@@H](OCC)C1(C)C ZINC000610122548 930700417 /nfs/dbraw/zinc/70/04/17/930700417.db2.gz RMBZODLXJCWNSJ-HZPDHXFCSA-N 0 0 352.406 3.790 20 5 FHBDRN COc1cc(C2(C(=O)N(C)CCc3ccccc3[N+](=O)[O-])CC2)ccc1C ZINC000580476326 930726394 /nfs/dbraw/zinc/72/63/94/930726394.db2.gz LBHPGRFZKMFABH-UHFFFAOYSA-N 0 0 368.433 3.645 20 5 FHBDRN C[C@@H]1[C@@H](c2nc(-c3ccc(N)c([N+](=O)[O-])c3)no2)CCN1c1ccccc1 ZINC000580481063 930727991 /nfs/dbraw/zinc/72/79/91/930727991.db2.gz NLXCTTIGYCRPJW-DOMZBBRYSA-N 0 0 365.393 3.609 20 5 FHBDRN COc1ccccc1[C@@H]1CCN(C(=O)[C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000579666567 930733653 /nfs/dbraw/zinc/73/36/53/930733653.db2.gz CUOOAIUOGIVDOQ-GDBMZVCRSA-N 0 0 354.406 3.723 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)Nc1nnc(/C=C\c2ccco2)s1 ZINC000255552261 930736261 /nfs/dbraw/zinc/73/62/61/930736261.db2.gz RFWYXNQCYXOSJI-CLFYSBASSA-N 0 0 370.390 3.781 20 5 FHBDRN Cc1ccc(C(C)C)c(O[C@@H](C)C(=O)N(C)c2ccc([N+](=O)[O-])nc2)c1 ZINC000579696020 930805627 /nfs/dbraw/zinc/80/56/27/930805627.db2.gz FMLASQWBMHFFIA-AWEZNQCLSA-N 0 0 357.410 3.852 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC1(c2cccc(Cl)c2)CC1 ZINC000610136900 930821314 /nfs/dbraw/zinc/82/13/14/930821314.db2.gz JVXCVHCFWBRDFY-UHFFFAOYSA-N 0 0 366.826 3.524 20 5 FHBDRN Cc1ccc(-c2csc(NC(=O)[C@@H]3CCC(=O)[C@H](C)C3)n2)cc1[N+](=O)[O-] ZINC000580587832 930894171 /nfs/dbraw/zinc/89/41/71/930894171.db2.gz FYAIQYWRLCHLEK-DGCLKSJQSA-N 0 0 373.434 3.971 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)c1ccc2c(c1)CCOC2 ZINC001266631484 930925399 /nfs/dbraw/zinc/92/53/99/930925399.db2.gz XSKUMBUJOUXAGE-UHFFFAOYSA-N 0 0 366.295 3.939 20 5 FHBDRN COc1ccc(CC2CCN(C(=O)Cc3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000109949944 930949642 /nfs/dbraw/zinc/94/96/42/930949642.db2.gz AZYXVBDGIUGWGE-UHFFFAOYSA-N 0 0 368.433 3.627 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N1CCN(C)C[C@@H]1c1ccccc1 ZINC000580645821 930960251 /nfs/dbraw/zinc/96/02/51/930960251.db2.gz BDZJZFSQFZOVNV-LJQANCHMSA-N 0 0 368.437 3.678 20 5 FHBDRN Cc1ccc(C(=O)N2CCC[C@@H]2c2ccc3c(c2)OCO3)cc1[N+](=O)[O-] ZINC000077328106 930973720 /nfs/dbraw/zinc/97/37/20/930973720.db2.gz ZGMUQUOVRKBNGG-OAHLLOKOSA-N 0 0 354.362 3.609 20 5 FHBDRN COc1cccc(-c2nc(Cc3nccc4ccccc43)no2)c1[N+](=O)[O-] ZINC000579773012 930986166 /nfs/dbraw/zinc/98/61/66/930986166.db2.gz MEELXXMEMUTGCP-UHFFFAOYSA-N 0 0 362.345 3.792 20 5 FHBDRN NC(=O)c1ccnc(N2CCCCC[C@H]2/C=C/c2cccs2)c1[N+](=O)[O-] ZINC000580663539 930987192 /nfs/dbraw/zinc/98/71/92/930987192.db2.gz OTCOZOHYMAAEFK-GWJCSSMESA-N 0 0 372.450 3.613 20 5 FHBDRN Cc1ccc(C(=O)NC2CCN(c3c(F)cccc3[N+](=O)[O-])CC2)s1 ZINC000561157280 930989869 /nfs/dbraw/zinc/98/98/69/930989869.db2.gz ZKPGRKXJDXCHDI-UHFFFAOYSA-N 0 0 363.414 3.503 20 5 FHBDRN CCc1ccc(CC)c(C(=O)Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)c1 ZINC000060370939 930993022 /nfs/dbraw/zinc/99/30/22/930993022.db2.gz NEEMLUIWCYXPPP-UHFFFAOYSA-N 0 0 364.405 3.861 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)NCCc1ccc(Br)cc1 ZINC000319917306 930995047 /nfs/dbraw/zinc/99/50/47/930995047.db2.gz MORQKWRJMOGVID-UHFFFAOYSA-N 0 0 363.211 3.638 20 5 FHBDRN O=C(c1cc(C(F)(F)F)ccc1F)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000119309312 931068670 /nfs/dbraw/zinc/06/86/70/931068670.db2.gz WOPQXXSRQYWQFN-UHFFFAOYSA-N 0 0 354.259 3.956 20 5 FHBDRN Cc1ccccc1C[C@@H]1CCCN1C(=O)NCc1ccccc1[N+](=O)[O-] ZINC000580733888 931072685 /nfs/dbraw/zinc/07/26/85/931072685.db2.gz BAIHSOJNMDAAKX-SFHVURJKSA-N 0 0 353.422 3.820 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])s1)N1CCC(c2cccc(F)c2F)CC1 ZINC000580748930 931097278 /nfs/dbraw/zinc/09/72/78/931097278.db2.gz ASRDIJCIOJAGHK-UHFFFAOYSA-N 0 0 352.362 3.954 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)Nc1ccc([C@@H]2CCOC2)cc1 ZINC000579877601 931176479 /nfs/dbraw/zinc/17/64/79/931176479.db2.gz QUJZBCHJBPOLMV-MRXNPFEDSA-N 0 0 365.389 3.692 20 5 FHBDRN CC(C)Oc1ccc(CCNC(=O)[C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000580810997 931184206 /nfs/dbraw/zinc/18/42/06/931184206.db2.gz OIBVUMDCSXHIME-OAHLLOKOSA-N 0 0 356.422 3.844 20 5 FHBDRN Cc1c([N+](=O)[O-])cc(C(=O)OCc2nc3ccccc3s2)cc1[N+](=O)[O-] ZINC000043702507 931198246 /nfs/dbraw/zinc/19/82/46/931198246.db2.gz GWEIBXVTMCUUPR-UHFFFAOYSA-N 0 0 373.346 3.778 20 5 FHBDRN Cc1cc(C(=O)Nc2ccc(OCC3CCOCC3)cc2)cc([N+](=O)[O-])c1 ZINC000135070021 931209986 /nfs/dbraw/zinc/20/99/86/931209986.db2.gz WITMCFNIQUBDQG-UHFFFAOYSA-N 0 0 370.405 3.961 20 5 FHBDRN CSc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC[C@@H]([C@@H]2CCOC2)C1 ZINC000891326886 931212782 /nfs/dbraw/zinc/21/27/82/931212782.db2.gz WHGMHPFXZIVNPT-ZIAGYGMSSA-N 0 0 364.467 3.596 20 5 FHBDRN O=C(NC1CC1)c1ccc(N2CCC[C@@H]2c2cccs2)c([N+](=O)[O-])c1 ZINC000247316301 931218532 /nfs/dbraw/zinc/21/85/32/931218532.db2.gz KGIOBDKELALLDS-OAHLLOKOSA-N 0 0 357.435 3.890 20 5 FHBDRN CC(C)(C(=O)N1CCCC[C@H]([C@H]2CCOC2)C1)c1ccccc1[N+](=O)[O-] ZINC000891328133 931220482 /nfs/dbraw/zinc/22/04/82/931220482.db2.gz IQSJADDUEOTBCC-HOTGVXAUSA-N 0 0 360.454 3.538 20 5 FHBDRN CCOc1ccc(NC(=O)CN2C[C@@H](C)[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000177828872 931234079 /nfs/dbraw/zinc/23/40/79/931234079.db2.gz GYRNYZAJOCARJG-JLTOFOAXSA-N 0 0 369.421 3.625 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)cc(Cl)c1N1CCCN(CC(F)(F)F)CC1 ZINC000561211284 931243013 /nfs/dbraw/zinc/24/30/13/931243013.db2.gz YWOQOPRBRHOBNF-UHFFFAOYSA-N 0 0 372.174 3.976 20 5 FHBDRN Cc1ccccc1[C@H](CO)NC(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000537784377 931258601 /nfs/dbraw/zinc/25/86/01/931258601.db2.gz LBVNVHZITBZOAH-KRWDZBQOSA-N 0 0 356.422 3.664 20 5 FHBDRN CC(C)(NC(=O)CCc1c(Cl)cccc1[N+](=O)[O-])c1nccs1 ZINC000932986588 931267287 /nfs/dbraw/zinc/26/72/87/931267287.db2.gz OJABMJGTTIXJTO-UHFFFAOYSA-N 0 0 353.831 3.689 20 5 FHBDRN O=C(c1cc(Cl)ccc1[N+](=O)[O-])N1CCCC[C@H]([C@H]2CCOC2)C1 ZINC000891337579 931296749 /nfs/dbraw/zinc/29/67/49/931296749.db2.gz HHWYIXRLRKFOEV-STQMWFEESA-N 0 0 352.818 3.527 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N2CCCC[C@@H]([C@H]3CCOC3)C2)c1 ZINC000891337603 931296891 /nfs/dbraw/zinc/29/68/91/931296891.db2.gz HOAPPWSKAQYPCC-KGLIPLIRSA-N 0 0 364.467 3.596 20 5 FHBDRN O=C(Nc1ccc(F)cc1-c1nc(C2CC2)no1)c1ccc([N+](=O)[O-])s1 ZINC000471627235 931301659 /nfs/dbraw/zinc/30/16/59/931301659.db2.gz LYPMARJMVWVSIF-UHFFFAOYSA-N 0 0 374.353 3.975 20 5 FHBDRN CCc1cc(=O)c2cc(NC(=O)C=Cc3ccc([N+](=O)[O-])cc3)ccc2[nH]1 ZINC000588393182 931319352 /nfs/dbraw/zinc/31/93/52/931319352.db2.gz VMESRIYBGNLCSR-YHYXMXQVSA-N 0 0 363.373 3.651 20 5 FHBDRN CCC(=O)Nc1cccc(C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000177860433 931328291 /nfs/dbraw/zinc/32/82/91/931328291.db2.gz MQOSALCTMKNONH-CYBMUJFWSA-N 0 0 355.394 3.743 20 5 FHBDRN Cc1cccc(CC(=O)NCc2cc([N+](=O)[O-])c(F)cc2F)c1Cl ZINC001143383002 931328343 /nfs/dbraw/zinc/32/83/43/931328343.db2.gz MHMMRASXONUNHC-UHFFFAOYSA-N 0 0 354.740 3.694 20 5 FHBDRN O=C([C@H]1CC12CCCCC2)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000476992649 931335377 /nfs/dbraw/zinc/33/53/77/931335377.db2.gz FMZPKYZKXOVAEN-GOSISDBHSA-N 0 0 358.438 3.935 20 5 FHBDRN O=C(NCc1cc([N+](=O)[O-])c(F)cc1F)c1cc(-c2ccccc2)ccn1 ZINC001143384826 931346203 /nfs/dbraw/zinc/34/62/03/931346203.db2.gz XQAPINGYFPLJRB-UHFFFAOYSA-N 0 0 369.327 3.865 20 5 FHBDRN CSc1ccc(C(=O)N2CCCC[C@@H]([C@@H]3CCOC3)C2)cc1[N+](=O)[O-] ZINC000891343207 931347020 /nfs/dbraw/zinc/34/70/20/931347020.db2.gz SRIMORYTOBPJBX-HUUCEWRRSA-N 0 0 364.467 3.596 20 5 FHBDRN C[C@@H]1CN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C[C@@H](C(F)(F)F)O1 ZINC000610468678 931377047 /nfs/dbraw/zinc/37/70/47/931377047.db2.gz BDBGWDGGXYCJCC-HQJQHLMTSA-N 0 0 358.238 3.770 20 5 FHBDRN CSc1ccc(C(=O)Oc2cccc(N3CCCC3=O)c2)cc1[N+](=O)[O-] ZINC000728311861 931377678 /nfs/dbraw/zinc/37/76/78/931377678.db2.gz YBOCPEWIPZJIAO-UHFFFAOYSA-N 0 0 372.402 3.663 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)NC[C@H]1CCO[C@@H]1c1ccccc1 ZINC000430527217 931382694 /nfs/dbraw/zinc/38/26/94/931382694.db2.gz IYXDPPZOHKEGCU-DNVCBOLYSA-N 0 0 374.824 3.685 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC[C@@H]1c1cccc(C)n1 ZINC000177867540 931391059 /nfs/dbraw/zinc/39/10/59/931391059.db2.gz LVKWZDHRHACUQF-MRXNPFEDSA-N 0 0 356.382 3.676 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)COc2ccc(F)cc2Cl)cc1[N+](=O)[O-] ZINC000177864659 931392091 /nfs/dbraw/zinc/39/20/91/931392091.db2.gz BHHQSUREGBYHQD-LLVKDONJSA-N 0 0 366.776 3.952 20 5 FHBDRN Cc1ccc(CNC(=O)C2CCN(c3c(F)cccc3[N+](=O)[O-])CC2)cc1 ZINC000561263588 931393207 /nfs/dbraw/zinc/39/32/07/931393207.db2.gz WVKYXDXIILFICY-UHFFFAOYSA-N 0 0 371.412 3.575 20 5 FHBDRN CC(=O)c1cc(NCCC2CCN(CC(F)(F)F)CC2)ccc1[N+](=O)[O-] ZINC000561263350 931394573 /nfs/dbraw/zinc/39/45/73/931394573.db2.gz YETJWWFBWFPNJN-UHFFFAOYSA-N 0 0 373.375 3.874 20 5 FHBDRN C[C@H]1C[C@H](COC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)CCO1 ZINC000785031775 931396437 /nfs/dbraw/zinc/39/64/37/931396437.db2.gz KYSKSGHVOLQDOL-UONOGXRCSA-N 0 0 351.402 3.653 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(OCC(=O)NC[C@@H](c2ccccc2)C(C)C)n1 ZINC000548149208 931417284 /nfs/dbraw/zinc/41/72/84/931417284.db2.gz KHEHBKVXTJBKNX-QGZVFWFLSA-N 0 0 371.437 3.541 20 5 FHBDRN CCNc1ccc(C(=O)OCC)cc1NC(=O)c1csc([N+](=O)[O-])c1 ZINC000177881095 931427967 /nfs/dbraw/zinc/42/79/67/931427967.db2.gz XCLJTJMERPFROM-UHFFFAOYSA-N 0 0 363.395 3.517 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)c2ccn(-c3cccc(F)c3)n2)cc1[N+](=O)[O-] ZINC000177875070 931431668 /nfs/dbraw/zinc/43/16/68/931431668.db2.gz ZUKAVJLXELCVRO-CYBMUJFWSA-N 0 0 368.368 3.719 20 5 FHBDRN O=[N+]([O-])c1ccc(NCCc2nc3ccccc3o2)nc1-c1ccccc1 ZINC000581062502 931530690 /nfs/dbraw/zinc/53/06/90/931530690.db2.gz GEPKTKKWXQZCIZ-UHFFFAOYSA-N 0 0 360.373 3.875 20 5 FHBDRN Cc1nn(C)c(C(=O)NCC2(Cc3ccccc3)CCCCC2)c1[N+](=O)[O-] ZINC000187354679 931546708 /nfs/dbraw/zinc/54/67/08/931546708.db2.gz CGBLFAUBCPFISZ-UHFFFAOYSA-N 0 0 370.453 3.560 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)NC[C@H]1CC[C@@H](c2ccccc2)O1 ZINC000581104994 931565010 /nfs/dbraw/zinc/56/50/10/931565010.db2.gz KJCZWFXKXFFCEA-MJGOQNOKSA-N 0 0 369.421 3.657 20 5 FHBDRN COCc1ccc(S[C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)cc1 ZINC000610480453 931578209 /nfs/dbraw/zinc/57/82/09/931578209.db2.gz JNKOPESWHAJCTQ-QGZVFWFLSA-N 0 0 358.419 3.639 20 5 FHBDRN Cc1cc([N+](=O)[O-])cn(CC(=O)c2ccc(Oc3ccccc3)cc2)c1=O ZINC000127160973 931591471 /nfs/dbraw/zinc/59/14/71/931591471.db2.gz QRWNXELIMOUARO-UHFFFAOYSA-N 0 0 364.357 3.740 20 5 FHBDRN Cc1noc(C)c1N(C)C(=O)c1ccc(N2CCC[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000610483349 931603659 /nfs/dbraw/zinc/60/36/59/931603659.db2.gz QALRIPOWZBUULW-LBPRGKRZSA-N 0 0 372.425 3.713 20 5 FHBDRN CCO[C@@H]1CCCC[C@H]1NC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000581175481 931641122 /nfs/dbraw/zinc/64/11/22/931641122.db2.gz BGZQTNLTBOOAAR-WOJBJXKFSA-N 0 0 364.445 3.759 20 5 FHBDRN C[C@H]1C(=O)CC[C@@H](C(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])C1(C)C ZINC000276047640 931644826 /nfs/dbraw/zinc/64/48/26/931644826.db2.gz YLIRJWUIJVPPRA-FZMZJTMJSA-N 0 0 366.845 3.548 20 5 FHBDRN CN(C[C@@H]1CCCC[C@@H]1O)C(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000276054320 931686331 /nfs/dbraw/zinc/68/63/31/931686331.db2.gz ZFXLCZKQTZMGAS-YWZLYKJASA-N 0 0 364.445 3.717 20 5 FHBDRN Cc1cc(C(=O)N2CCc3ccc([N+](=O)[O-])cc32)ccc1Br ZINC000156920887 931707654 /nfs/dbraw/zinc/70/76/54/931707654.db2.gz DXOMACSMKKYMNZ-UHFFFAOYSA-N 0 0 361.195 3.869 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1cc(C)ccc1Br ZINC000317523982 931719619 /nfs/dbraw/zinc/71/96/19/931719619.db2.gz SNYFAPBGYVUNLT-UHFFFAOYSA-N 0 0 365.183 3.927 20 5 FHBDRN CC(C)c1ccc(C(=O)N2CC[C@@H](OCc3ccccn3)C2)cc1[N+](=O)[O-] ZINC000276073374 931721377 /nfs/dbraw/zinc/72/13/77/931721377.db2.gz WOPOWMRUKSIWQY-QGZVFWFLSA-N 0 0 369.421 3.545 20 5 FHBDRN CN(C[C@H]1CCCO[C@@H]1c1ccccc1)C(=O)Cc1ccccc1[N+](=O)[O-] ZINC000050870429 931758829 /nfs/dbraw/zinc/75/88/29/931758829.db2.gz AJMYQLNDSIUJGC-WIYYLYMNSA-N 0 0 368.433 3.764 20 5 FHBDRN COc1ccc(-n2c(C)nnc2SCc2ccccc2[N+](=O)[O-])cc1 ZINC000477057015 931787426 /nfs/dbraw/zinc/78/74/26/931787426.db2.gz IRTVZUYFNPXUHW-UHFFFAOYSA-N 0 0 356.407 3.785 20 5 FHBDRN Cc1c2ccccc2sc1C(=O)Cn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000126400870 931796919 /nfs/dbraw/zinc/79/69/19/931796919.db2.gz DMGKDBGYMTWYRN-UHFFFAOYSA-N 0 0 368.370 3.909 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])N[C@@H]1CCCN(c2ccccc2Cl)C1 ZINC000126393356 931797158 /nfs/dbraw/zinc/79/71/58/931797158.db2.gz HEVDOOQKGZRHKV-OAHLLOKOSA-N 0 0 373.840 3.576 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CCC[C@H]1c1cccc(Cl)c1 ZINC000126397450 931797267 /nfs/dbraw/zinc/79/72/67/931797267.db2.gz VYXSXJOKUIHFJI-HNNXBMFYSA-N 0 0 362.817 3.507 20 5 FHBDRN CCOc1cc(C(=O)N[C@@H]2CCCCC2(C)C)c([N+](=O)[O-])cc1OC ZINC000157060963 931815138 /nfs/dbraw/zinc/81/51/38/931815138.db2.gz HRPOOANXEWLNFK-MRXNPFEDSA-N 0 0 350.415 3.701 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2noc(Cc3cc(Cl)c4c(c3)OCCO4)n2)cc1 ZINC000544932826 931834467 /nfs/dbraw/zinc/83/44/67/931834467.db2.gz TYYHPMKTWOCUAP-UHFFFAOYSA-N 0 0 373.752 3.660 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N1CCCCC[C@H]1[C@@H]1CCCCC1=O ZINC000126459476 931837195 /nfs/dbraw/zinc/83/71/95/931837195.db2.gz HCPGFVASXDGELN-ROUUACIJSA-N 0 0 374.437 3.504 20 5 FHBDRN O=C(NCCc1cccs1)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000754642803 931842289 /nfs/dbraw/zinc/84/22/89/931842289.db2.gz XGVKFLIWPRQCHF-UHFFFAOYSA-N 0 0 373.203 3.530 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(O[C@@H]3CCOC3)cc2)c1C ZINC000889112216 931870782 /nfs/dbraw/zinc/87/07/82/931870782.db2.gz ZWJGOJDKBJWOPO-MRXNPFEDSA-N 0 0 356.378 3.632 20 5 FHBDRN CC(C)(CNC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)c1cccs1 ZINC000510399371 931907448 /nfs/dbraw/zinc/90/74/48/931907448.db2.gz RKWFLYBDTHSMFS-UHFFFAOYSA-N 0 0 359.451 3.938 20 5 FHBDRN Cc1ccccc1C1CCN(C(=O)COc2ccc([N+](=O)[O-])c(C)c2)CC1 ZINC000430582291 931958513 /nfs/dbraw/zinc/95/85/13/931958513.db2.gz PUNIMVNJZPKMDN-UHFFFAOYSA-N 0 0 368.433 3.997 20 5 FHBDRN COc1ccc(NC(=O)[C@H](C)N2CC[C@H]2c2cccc(F)c2)c([N+](=O)[O-])c1 ZINC000610505306 932016532 /nfs/dbraw/zinc/01/65/32/932016532.db2.gz GHVQNPVLEUNBSC-SJCJKPOMSA-N 0 0 373.384 3.517 20 5 FHBDRN CN(C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)c1nc2ccccc2s1 ZINC000121344346 932028774 /nfs/dbraw/zinc/02/87/74/932028774.db2.gz GGHGPAMYFMRWDP-UHFFFAOYSA-N 0 0 366.402 3.891 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N(Cc1cccs1)C(C)C ZINC000512036321 932038326 /nfs/dbraw/zinc/03/83/26/932038326.db2.gz GZVRVBKEHYGHGB-UHFFFAOYSA-N 0 0 354.453 3.564 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2noc(CN3CC[C@H]3c3cccc(F)c3)n2)cc1 ZINC000610505862 932040526 /nfs/dbraw/zinc/04/05/26/932040526.db2.gz ZJZNVDHHVQNNNK-INIZCTEOSA-N 0 0 354.341 3.731 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])N1CC[C@H](Cc2ccc(F)cc2)C1 ZINC000135188235 932041864 /nfs/dbraw/zinc/04/18/64/932041864.db2.gz YVJDAAJNGABLLX-MRXNPFEDSA-N 0 0 372.396 3.594 20 5 FHBDRN CCOc1cc(C(=O)N(C)c2c(F)cccc2F)c([N+](=O)[O-])cc1OC ZINC000060544065 932048414 /nfs/dbraw/zinc/04/84/14/932048414.db2.gz XETDETNGBIHXQR-UHFFFAOYSA-N 0 0 366.320 3.557 20 5 FHBDRN CSc1cccc(NC(=O)CN(Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000135221667 932054589 /nfs/dbraw/zinc/05/45/89/932054589.db2.gz JAAVYJSTGUDYCJ-UHFFFAOYSA-N 0 0 371.462 3.920 20 5 FHBDRN CC(C)N(CC(F)(F)F)C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000610570685 932061969 /nfs/dbraw/zinc/06/19/69/932061969.db2.gz DPQKTHWIVTYGAB-UHFFFAOYSA-N 0 0 369.137 3.770 20 5 FHBDRN C[C@H](CCNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21)c1ccccc1 ZINC000109971501 932063099 /nfs/dbraw/zinc/06/30/99/932063099.db2.gz ZXAKKEKLJGYLAT-OAHLLOKOSA-N 0 0 351.406 3.860 20 5 FHBDRN COc1ccc(-c2noc([C@H](C)N(C)Cc3ccccc3[N+](=O)[O-])n2)cc1 ZINC000178004868 932066672 /nfs/dbraw/zinc/06/66/72/932066672.db2.gz ZVQUCSSQQYLBTI-ZDUSSCGKSA-N 0 0 368.393 3.846 20 5 FHBDRN Cc1cccc(N(C)C(=O)c2ccc(N3CCC[C@@H](C)C3)c([N+](=O)[O-])c2)n1 ZINC000135230149 932076386 /nfs/dbraw/zinc/07/63/86/932076386.db2.gz BRTFVJBSFBCYJD-CQSZACIVSA-N 0 0 368.437 3.811 20 5 FHBDRN Cc1cccc(N(C)C(=O)c2ccc(N3CCC[C@H](C)C3)c([N+](=O)[O-])c2)n1 ZINC000135230120 932076441 /nfs/dbraw/zinc/07/64/41/932076441.db2.gz BRTFVJBSFBCYJD-AWEZNQCLSA-N 0 0 368.437 3.811 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N(Cc1ccccc1)C[C@H](O)CC ZINC000581458141 932092083 /nfs/dbraw/zinc/09/20/83/932092083.db2.gz CTKIPCAPCFCLTA-GOSISDBHSA-N 0 0 371.437 3.962 20 5 FHBDRN O=C1c2ccccc2C(=O)N1Cc1csc(-c2ccccc2[N+](=O)[O-])n1 ZINC000178019746 932094926 /nfs/dbraw/zinc/09/49/26/932094926.db2.gz YUDFAWKOMKPFKU-UHFFFAOYSA-N 0 0 365.370 3.515 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N1CCC[C@]2(C1)OCc1ccccc12 ZINC000548175424 932111927 /nfs/dbraw/zinc/11/19/27/932111927.db2.gz LDNAFKMWPJAMFE-HXUWFJFHSA-N 0 0 352.390 3.565 20 5 FHBDRN CN(Cc1ccc(Cl)c(F)c1)C(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000135257885 932116807 /nfs/dbraw/zinc/11/68/07/932116807.db2.gz OVENPBGWZASRPY-UHFFFAOYSA-N 0 0 351.765 3.729 20 5 FHBDRN CCOC(CCNC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1)OCC ZINC000276237564 932118733 /nfs/dbraw/zinc/11/87/33/932118733.db2.gz OULNFTTWWCHPPU-UHFFFAOYSA-N 0 0 368.433 3.613 20 5 FHBDRN CC1(C)[C@H](C(F)(F)F)CCN1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000276237946 932118852 /nfs/dbraw/zinc/11/88/52/932118852.db2.gz LPFVXKCLWAISER-CYBMUJFWSA-N 0 0 360.332 3.624 20 5 FHBDRN Cc1cnc([C@@H](C)Nc2ncc([N+](=O)[O-])c(C)c2Br)s1 ZINC000165801263 932123736 /nfs/dbraw/zinc/12/37/36/932123736.db2.gz WNBQRRMWGCXBLA-MRVPVSSYSA-N 0 0 357.233 3.999 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)N[C@@H]1COc2c1cccc2Cl ZINC000610709810 932141003 /nfs/dbraw/zinc/14/10/03/932141003.db2.gz WLVWGCHUYOXNBS-CQSZACIVSA-N 0 0 361.785 3.523 20 5 FHBDRN COc1ccccc1[C@H](CNC(=O)c1cc([N+](=O)[O-])ccc1C)OC(C)C ZINC000187416397 932166589 /nfs/dbraw/zinc/16/65/89/932166589.db2.gz QESVTKQDMCTNKT-IBGZPJMESA-N 0 0 372.421 3.808 20 5 FHBDRN Cc1nc(-c2ccccc2)sc1[C@H](C)OC(=O)c1nn(C)cc1[N+](=O)[O-] ZINC000780371585 932172153 /nfs/dbraw/zinc/17/21/53/932172153.db2.gz VTZDMNDTQCHLCR-NSHDSACASA-N 0 0 372.406 3.678 20 5 FHBDRN O=C(Nc1nc2cc3c(cc2s1)OCCCO3)c1ccccc1[N+](=O)[O-] ZINC000060612132 932185158 /nfs/dbraw/zinc/18/51/58/932185158.db2.gz BHGQTOSASCMCTL-UHFFFAOYSA-N 0 0 371.374 3.618 20 5 FHBDRN Cc1cc(F)cc(-c2noc(-c3cc([N+](=O)[O-])cc4c3OCCO4)n2)c1 ZINC000581514126 932189146 /nfs/dbraw/zinc/18/91/46/932189146.db2.gz YQFUMMHTHKICQQ-UHFFFAOYSA-N 0 0 357.297 3.531 20 5 FHBDRN C[C@H](c1ccco1)N(C)C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000119393275 932198012 /nfs/dbraw/zinc/19/80/12/932198012.db2.gz ISBQTDHCBHEQLA-SECBINFHSA-N 0 0 353.172 3.784 20 5 FHBDRN CN(C(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1)c1ccccn1 ZINC000134521574 932233706 /nfs/dbraw/zinc/23/37/06/932233706.db2.gz JVXPBVCDRYWXJR-UHFFFAOYSA-N 0 0 362.389 3.879 20 5 FHBDRN O=[N+]([O-])c1sc(CN[C@H]2COCc3ccccc32)cc1Br ZINC000602693625 932237722 /nfs/dbraw/zinc/23/77/22/932237722.db2.gz DBACYHROMRWGFD-ZDUSSCGKSA-N 0 0 369.240 3.780 20 5 FHBDRN Cc1sc(NC(=O)C[C@H]2CCCCO2)nc1-c1cccc([N+](=O)[O-])c1 ZINC000127189554 932238379 /nfs/dbraw/zinc/23/83/79/932238379.db2.gz CXOQZDNARHKDPQ-CQSZACIVSA-N 0 0 361.423 3.924 20 5 FHBDRN O=C(NCc1nc(-c2ccccc2)c[nH]1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000126546236 932239080 /nfs/dbraw/zinc/23/90/80/932239080.db2.gz RHIPVLGQPNCUHR-UHFFFAOYSA-N 0 0 356.769 3.568 20 5 FHBDRN CCNc1ccc(C(=O)Nc2cc(C(=O)OC)c(C)cc2C)cc1[N+](=O)[O-] ZINC000471671375 932240691 /nfs/dbraw/zinc/24/06/91/932240691.db2.gz WBAITWOINSAPQR-UHFFFAOYSA-N 0 0 371.393 3.682 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)C(=O)Nc2ccccc2C(C)C)cc1[N+](=O)[O-] ZINC000178062043 932245405 /nfs/dbraw/zinc/24/54/05/932245405.db2.gz ZYXDRRZFLQPVHW-AWEZNQCLSA-N 0 0 369.421 3.843 20 5 FHBDRN O=C(Cn1ccc([N+](=O)[O-])n1)N(Cc1ccccc1)c1ccc(Cl)cc1 ZINC000097007945 932262339 /nfs/dbraw/zinc/26/23/39/932262339.db2.gz CFYQMSZOLRKFDM-UHFFFAOYSA-N 0 0 370.796 3.678 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CNc1ccc(F)cc1OCC1CC1 ZINC000157238892 932267073 /nfs/dbraw/zinc/26/70/73/932267073.db2.gz KHYSLYMAKVZTIQ-UHFFFAOYSA-N 0 0 373.384 3.882 20 5 FHBDRN O=C(CCn1cccc1)Nc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1 ZINC000610512036 932291859 /nfs/dbraw/zinc/29/18/59/932291859.db2.gz QNQFXUXYPZCSBE-UHFFFAOYSA-N 0 0 363.373 3.656 20 5 FHBDRN COc1ccc([C@@H]2CCCN2Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000510435944 932315863 /nfs/dbraw/zinc/31/58/63/932315863.db2.gz NMZRKKGXFJHOLA-SFHVURJKSA-N 0 0 352.394 3.817 20 5 FHBDRN CC(C)(NC(=O)N[C@H]1CCOC2(CCCC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000157319957 932326841 /nfs/dbraw/zinc/32/68/41/932326841.db2.gz UEDAUNKNQURZJS-HNNXBMFYSA-N 0 0 361.442 3.621 20 5 FHBDRN CNC(=O)c1ccc(Oc2ccc(-c3cscn3)cc2)c([N+](=O)[O-])c1 ZINC000610515864 932333483 /nfs/dbraw/zinc/33/34/83/932333483.db2.gz AVYDSHKAIUTXMY-UHFFFAOYSA-N 0 0 355.375 3.870 20 5 FHBDRN Cc1sc(C(=O)N2C[C@@H](c3ccsc3)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000156307502 932344776 /nfs/dbraw/zinc/34/47/76/932344776.db2.gz UBLXHFRXOAUTKF-ZANVPECISA-N 0 0 352.437 3.628 20 5 FHBDRN CC(C)CN(CCc1ccc(F)cc1)C(=O)c1cccc([N+](=O)[O-])c1N ZINC000610520106 932375664 /nfs/dbraw/zinc/37/56/64/932375664.db2.gz YXMGMTOHJBIQTP-UHFFFAOYSA-N 0 0 359.401 3.657 20 5 FHBDRN Cc1c(NC(=O)N(C)[C@H](C)C(C)(C)O)cc([N+](=O)[O-])cc1C(F)(F)F ZINC000933344942 932376296 /nfs/dbraw/zinc/37/62/96/932376296.db2.gz JJQRSCUONWEWLH-SECBINFHSA-N 0 0 363.336 3.545 20 5 FHBDRN Cc1c(NC(=O)N2CC3(C2)CCOCC3)cc([N+](=O)[O-])cc1C(F)(F)F ZINC000933345203 932377029 /nfs/dbraw/zinc/37/70/29/932377029.db2.gz KRBCBSCKWFYCHE-UHFFFAOYSA-N 0 0 373.331 3.566 20 5 FHBDRN Cc1c(CC(=O)N[C@H](C)c2ccc(-n3cccn3)cc2)cccc1[N+](=O)[O-] ZINC000126707106 932383436 /nfs/dbraw/zinc/38/34/36/932383436.db2.gz ZDDOSPXKKBEGQE-OAHLLOKOSA-N 0 0 364.405 3.509 20 5 FHBDRN Cc1ccc(N2C(=O)C(=Cc3ccc([N+](=O)[O-])s3)NC2=S)cc1C ZINC000588421128 932390098 /nfs/dbraw/zinc/39/00/98/932390098.db2.gz ODWGRSFBYJUPNR-JYRVWZFOSA-N 0 0 359.432 3.535 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc2c(=O)cc[nH]c2c1 ZINC000477227892 932423642 /nfs/dbraw/zinc/42/36/42/932423642.db2.gz LMNUTYJATWTENP-LLVKDONJSA-N 0 0 369.402 3.556 20 5 FHBDRN Cc1cccc(Oc2ccccc2NC(=O)Cn2ccc([N+](=O)[O-])n2)c1 ZINC000127238814 932443622 /nfs/dbraw/zinc/44/36/22/932443622.db2.gz ZNRSRTFILBMGKS-UHFFFAOYSA-N 0 0 352.350 3.531 20 5 FHBDRN CC[C@@H](O)CCNC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000178100936 932446790 /nfs/dbraw/zinc/44/67/90/932446790.db2.gz ZCDGCIZVRRTKLB-CQSZACIVSA-N 0 0 360.435 3.637 20 5 FHBDRN COC1(CNC(=O)c2cccc(SC)c2[N+](=O)[O-])CCC(C)CC1 ZINC000477318376 932467022 /nfs/dbraw/zinc/46/70/22/932467022.db2.gz MKHPPJVKELPQMJ-UHFFFAOYSA-N 0 0 352.456 3.642 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)s1 ZINC000477322665 932470716 /nfs/dbraw/zinc/47/07/16/932470716.db2.gz ORUSGQFVTNZQMH-UHFFFAOYSA-N 0 0 373.478 3.916 20 5 FHBDRN CC[C@H](NC(=O)[C@H](C)n1ccc(C(F)(F)F)n1)c1cccc([N+](=O)[O-])c1 ZINC001266794944 932476983 /nfs/dbraw/zinc/47/69/83/932476983.db2.gz WLQCTRFJOWVOIK-GWCFXTLKSA-N 0 0 370.331 3.639 20 5 FHBDRN CC[C@@H](C)n1ncc(NC(=O)COc2ccc([N+](=O)[O-])cc2)c1C1CC1 ZINC000477336148 932485299 /nfs/dbraw/zinc/48/52/99/932485299.db2.gz FXSINZTZHHBKEY-GFCCVEGCSA-N 0 0 358.398 3.657 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)Nc1ccc(N2CCCC2)nc1 ZINC000276508480 932507951 /nfs/dbraw/zinc/50/79/51/932507951.db2.gz IOLRNGFRVLCGKF-UHFFFAOYSA-N 0 0 360.801 3.804 20 5 FHBDRN CCc1cnc(CCNC(=O)c2c(C)cc(Cl)cc2[N+](=O)[O-])s1 ZINC000477368979 932523728 /nfs/dbraw/zinc/52/37/28/932523728.db2.gz YUJXYJAOOJLYNE-UHFFFAOYSA-N 0 0 353.831 3.548 20 5 FHBDRN O=[N+]([O-])c1ccc(CN2CCC[C@@](O)(C(F)(F)F)CC2)c(Cl)c1 ZINC000285406726 932560224 /nfs/dbraw/zinc/56/02/24/932560224.db2.gz CVNPXKPSUQOCOE-ZDUSSCGKSA-N 0 0 352.740 3.528 20 5 FHBDRN Cc1cc(C(=O)NCCc2cn(C)c3cc(F)ccc23)cc([N+](=O)[O-])c1 ZINC000471681850 932566216 /nfs/dbraw/zinc/56/62/16/932566216.db2.gz AVSWJWDSGNSMQH-UHFFFAOYSA-N 0 0 355.369 3.507 20 5 FHBDRN COc1ccc(-c2nc(NC(=O)c3cc([N+](=O)[O-])c[nH]3)sc2C)cc1 ZINC000051206787 932612078 /nfs/dbraw/zinc/61/20/78/932612078.db2.gz OQRIZTYERJBQPH-UHFFFAOYSA-N 0 0 358.379 3.616 20 5 FHBDRN Cc1nnc(-c2ccccc2C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)o1 ZINC000127287043 932622696 /nfs/dbraw/zinc/62/26/96/932622696.db2.gz PWMZTGLBXJSSAL-GFCCVEGCSA-N 0 0 366.377 3.753 20 5 FHBDRN COc1ccc([C@H](O)CNc2cc(C)nc3c2cccc3[N+](=O)[O-])cc1 ZINC000302025295 932623646 /nfs/dbraw/zinc/62/36/46/932623646.db2.gz PTETZJGFMLBOHC-GOSISDBHSA-N 0 0 353.378 3.606 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@H](c1cccc(F)c1)C(C)(C)C ZINC000178131613 932624856 /nfs/dbraw/zinc/62/48/56/932624856.db2.gz SAEZWOYSSHDHOA-QGZVFWFLSA-N 0 0 362.405 3.533 20 5 FHBDRN COc1ccc(NC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])c(C)c1 ZINC000477471990 932626980 /nfs/dbraw/zinc/62/69/80/932626980.db2.gz PULMGBJJIWMJGH-UHFFFAOYSA-N 0 0 363.801 3.929 20 5 FHBDRN CC[C@H](OC1CCCCC1)C(=O)Nc1ccnn1-c1ccc([N+](=O)[O-])cc1 ZINC000471699506 932647757 /nfs/dbraw/zinc/64/77/57/932647757.db2.gz ZKYJXMGMHQGLJO-KRWDZBQOSA-N 0 0 372.425 3.847 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)s1 ZINC000477505729 932656784 /nfs/dbraw/zinc/65/67/84/932656784.db2.gz QALKOBNLTSNEPT-UHFFFAOYSA-N 0 0 373.478 3.916 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1c(-c2ccncc2)nc2ccccn21 ZINC000430657535 932662418 /nfs/dbraw/zinc/66/24/18/932662418.db2.gz HWTIEPMAUBLWQP-UHFFFAOYSA-N 0 0 373.372 3.865 20 5 FHBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1CC(C)(C)[C@@H]1c1cccs1 ZINC000561558473 932673676 /nfs/dbraw/zinc/67/36/76/932673676.db2.gz VYPNAZGXVWOSLB-HNNXBMFYSA-N 0 0 366.464 3.737 20 5 FHBDRN C[C@@H](c1ccccc1[N+](=O)[O-])N1CCC[C@@H](NC(=O)c2ccccc2)C1 ZINC001167483648 932698838 /nfs/dbraw/zinc/69/88/38/932698838.db2.gz YCDOGCPFUSRFFU-DOTOQJQBSA-N 0 0 353.422 3.550 20 5 FHBDRN C[C@@H]1CCc2ccccc2[C@@H]1Nc1sc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000302055137 932726931 /nfs/dbraw/zinc/72/69/31/932726931.db2.gz ALIFQAKNQWCSCF-MEBBXXQBSA-N 0 0 366.464 3.795 20 5 FHBDRN C[C@@H]1C[C@H]1c1ccc(CN(C(=O)c2cccc([N+](=O)[O-])c2N)C2CC2)o1 ZINC000178164823 932727574 /nfs/dbraw/zinc/72/75/74/932727574.db2.gz ICTDREBMSNIBBP-IAQYHMDHSA-N 0 0 355.394 3.698 20 5 FHBDRN CCOC(=O)c1sc(CNc2ccc3ncccc3c2[N+](=O)[O-])nc1C ZINC000610542178 932730348 /nfs/dbraw/zinc/73/03/48/932730348.db2.gz HPNICAXABKNJBG-UHFFFAOYSA-N 0 0 372.406 3.697 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CNc1ccc(OC(F)(F)F)cc1 ZINC000023901271 932731713 /nfs/dbraw/zinc/73/17/13/932731713.db2.gz VJHGZOROTAGQLH-UHFFFAOYSA-N 0 0 369.299 3.852 20 5 FHBDRN COc1cc(C(=O)N[C@@H]2c3cccc(F)c3CC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000430663548 932743723 /nfs/dbraw/zinc/74/37/23/932743723.db2.gz KBMZXMFUHCUEDC-VOJFVSQTSA-N 0 0 358.369 3.796 20 5 FHBDRN O=C(NC[C@@H]1CC[C@@H](O)C1)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000276655066 932818674 /nfs/dbraw/zinc/81/86/74/932818674.db2.gz QDWAPKWSVBUISN-CZUORRHYSA-N 0 0 371.393 3.670 20 5 FHBDRN Cc1ccc(S(=O)(=O)N([C@H](C)c2ccccc2)C2CC2)c([N+](=O)[O-])c1 ZINC000510472635 932850002 /nfs/dbraw/zinc/85/00/02/932850002.db2.gz NHQUEDIMZSLOSG-CQSZACIVSA-N 0 0 360.435 3.818 20 5 FHBDRN Cc1cc(OCC(=O)N[C@@H](C)c2c(F)cccc2Cl)ccc1[N+](=O)[O-] ZINC000430681050 932871510 /nfs/dbraw/zinc/87/15/10/932871510.db2.gz AWHIIOLEAMSYQS-NSHDSACASA-N 0 0 366.776 3.952 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)NC[C@H]1CCN(c2ccccc2)C1 ZINC000276670291 932880859 /nfs/dbraw/zinc/88/08/59/932880859.db2.gz ZASUZZOTWXWJJA-CQSZACIVSA-N 0 0 373.840 3.813 20 5 FHBDRN Cc1cc(OCC(=O)N2CCSC[C@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000430681368 932908283 /nfs/dbraw/zinc/90/82/83/932908283.db2.gz QPXHKBXATMSVAS-SFHVURJKSA-N 0 0 372.446 3.599 20 5 FHBDRN Cc1ccc(S(=O)(=O)N(Cc2ccco2)C2CCCC2)c([N+](=O)[O-])c1 ZINC000101573050 932928596 /nfs/dbraw/zinc/92/85/96/932928596.db2.gz VSNCIBCRCTWZMZ-UHFFFAOYSA-N 0 0 364.423 3.630 20 5 FHBDRN C[C@@H]1COCC[C@H]1c1noc(CCc2c(Cl)cccc2[N+](=O)[O-])n1 ZINC000924052643 932933459 /nfs/dbraw/zinc/93/34/59/932933459.db2.gz MZXQEEGPLFSQEH-GHMZBOCLSA-N 0 0 351.790 3.556 20 5 FHBDRN CCc1nc(C)c(NC(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])s1 ZINC000548313444 932938386 /nfs/dbraw/zinc/93/83/86/932938386.db2.gz ZRAUCGDOSBZQCO-UHFFFAOYSA-N 0 0 367.452 3.905 20 5 FHBDRN CC[C@@H](c1ccncc1)N(CC)C(=O)COc1ccc([N+](=O)[O-])c(C)c1 ZINC000430686658 932941075 /nfs/dbraw/zinc/94/10/75/932941075.db2.gz NQEXULQHQHPLNT-KRWDZBQOSA-N 0 0 357.410 3.677 20 5 FHBDRN Cc1ccc([C@H]2CSCCN2C(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])cc1 ZINC000610922977 932941598 /nfs/dbraw/zinc/94/15/98/932941598.db2.gz TVNJIIHQEIYIBG-CQSZACIVSA-N 0 0 374.466 3.680 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H](C)c1nc2ccccc2[nH]1 ZINC000588436015 932943282 /nfs/dbraw/zinc/94/32/82/932943282.db2.gz MMPUQMYBJCGSAV-HHQWOOOKSA-N 0 0 350.378 3.752 20 5 FHBDRN COc1ccc(NC(=O)/C(C)=C\c2ccc([N+](=O)[O-])cc2)cc1NC(C)=O ZINC000588436449 932946010 /nfs/dbraw/zinc/94/60/10/932946010.db2.gz PXKNDBMKFGQKMY-BENRWUELSA-N 0 0 369.377 3.604 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H](C)c1ccc2c(c1)OCO2 ZINC000588436343 932948348 /nfs/dbraw/zinc/94/83/48/932948348.db2.gz OPFPXRKLSDEWNU-SUIFULHWSA-N 0 0 354.362 3.604 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(NC(=O)C2CC2)c1 ZINC000588436504 932951894 /nfs/dbraw/zinc/95/18/94/932951894.db2.gz IUURUCHHQIIZKI-QBFSEMIESA-N 0 0 365.389 3.985 20 5 FHBDRN COc1ccc(CNC(=O)c2ccc(F)c(CSC)c2)cc1[N+](=O)[O-] ZINC000471797266 932952812 /nfs/dbraw/zinc/95/28/12/932952812.db2.gz FYTWFGVLLGFZOZ-UHFFFAOYSA-N 0 0 364.398 3.536 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000588437170 932963147 /nfs/dbraw/zinc/96/31/47/932963147.db2.gz YUYCFUZZJAYXLV-KXXVWKPMSA-N 0 0 355.350 3.784 20 5 FHBDRN CC(=Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc(C(F)(F)F)c[nH]c1=O ZINC000588436993 932966156 /nfs/dbraw/zinc/96/61/56/932966156.db2.gz BWSYFLDYDXYKHX-TWGQIWQCSA-N 0 0 367.283 3.756 20 5 FHBDRN C[C@@H]1CC[C@H](c2ccccc2)N(S(=O)(=O)c2ccccc2[N+](=O)[O-])C1 ZINC000510492466 932973779 /nfs/dbraw/zinc/97/37/79/932973779.db2.gz YUSGOUZXBZKYKZ-GDBMZVCRSA-N 0 0 360.435 3.757 20 5 FHBDRN CS[C@@H]1CCC[C@@H](NC(=O)c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000175982676 933007552 /nfs/dbraw/zinc/00/75/52/933007552.db2.gz ZKZXEZVNNNVDDW-GHMZBOCLSA-N 0 0 373.272 3.761 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc2c(cnn2C(F)F)c1 ZINC000610961923 933030094 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933215450 /nfs/dbraw/zinc/21/54/50/933215450.db2.gz MAVCPGMXDUAKCJ-JXXFODFXSA-N 0 0 362.470 3.877 20 5 FHBDRN C[C@@H](c1ccccc1)N(C1CC1)S(=O)(=O)Cc1ccccc1[N+](=O)[O-] ZINC000510560036 933226086 /nfs/dbraw/zinc/22/60/86/933226086.db2.gz QCJCGHLSPHXCAT-AWEZNQCLSA-N 0 0 360.435 3.650 20 5 FHBDRN O=C(CO[C@H]1CCCc2ccccc21)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000430785378 933229901 /nfs/dbraw/zinc/22/99/01/933229901.db2.gz VBWWROYYBNNWHP-FQEVSTJZSA-N 0 0 366.417 3.574 20 5 FHBDRN C[C@H]1CCCC[C@H]1CCNC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000510574230 933238869 /nfs/dbraw/zinc/23/88/69/933238869.db2.gz RYHNXSOBYVJYCI-GJZGRUSLSA-N 0 0 356.426 3.727 20 5 FHBDRN O=C(Nc1cccc2c1CCO2)c1ccc([N+](=O)[O-])cc1Br ZINC000477721285 933239219 /nfs/dbraw/zinc/23/92/19/933239219.db2.gz HILDWIHRPSIRGC-UHFFFAOYSA-N 0 0 363.167 3.545 20 5 FHBDRN CCOc1cc(C(=O)NCC[C@H]2CCCC[C@@H]2C)c([N+](=O)[O-])cc1OC ZINC000510587495 933249968 /nfs/dbraw/zinc/24/99/68/933249968.db2.gz HBXZZJUQRYXXQI-UONOGXRCSA-N 0 0 364.442 3.948 20 5 FHBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N2[C@@H]3CC[C@H]2C[C@@H](c2ccccc2)C3)c1 ZINC000510585754 933249999 /nfs/dbraw/zinc/24/99/99/933249999.db2.gz YBMHTIWCXPWEPW-BJWYYQGGSA-N 0 0 372.446 3.694 20 5 FHBDRN Cc1cc(OCC(=O)N(C)Cc2cc(Cl)ccc2F)ccc1[N+](=O)[O-] ZINC000430826650 933272640 /nfs/dbraw/zinc/27/26/40/933272640.db2.gz WLSTVXNGKJDXFU-UHFFFAOYSA-N 0 0 366.776 3.733 20 5 FHBDRN O=C(CO[C@@H]1CCCc2ccccc21)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000430831111 933279680 /nfs/dbraw/zinc/27/96/80/933279680.db2.gz TZHUWMJKRXOKNV-GOSISDBHSA-N 0 0 374.824 3.959 20 5 FHBDRN C[C@H]1CCCC[C@H]1CCNC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000510611048 933282975 /nfs/dbraw/zinc/28/29/75/933282975.db2.gz MQEYMRCQVDTACM-GJZGRUSLSA-N 0 0 370.453 3.942 20 5 FHBDRN O=C(Nc1cccc2c1CCO2)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000477742531 933285815 /nfs/dbraw/zinc/28/58/15/933285815.db2.gz JVPCIVYBOPDFOJ-UHFFFAOYSA-N 0 0 363.167 3.545 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCC(=O)N(C)Cc2ccc(Cl)s2)c1 ZINC000098074291 933302910 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366.377 3.612 20 5 FHBDRN Cc1cccc(C)c1NC(=O)COc1ccc([N+](=O)[O-])c2ncccc12 ZINC000471884859 933479422 /nfs/dbraw/zinc/47/94/22/933479422.db2.gz MPXSPHQBJZSVLD-UHFFFAOYSA-N 0 0 351.362 3.777 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)NCc2c(F)c(F)cc(F)c2F)c1 ZINC000610602515 933500900 /nfs/dbraw/zinc/50/09/00/933500900.db2.gz HCICBZVUQCBRPY-UHFFFAOYSA-N 0 0 374.315 3.803 20 5 FHBDRN CCCNC(=O)c1cccc(CNc2ccc([N+](=O)[O-])c(OCC)c2)c1 ZINC000178357729 933525418 /nfs/dbraw/zinc/52/54/18/933525418.db2.gz ZAWJKWZIPDKMNL-UHFFFAOYSA-N 0 0 357.410 3.745 20 5 FHBDRN COc1ccc(C(=O)CCC(=O)Oc2ccc(C)cc2[N+](=O)[O-])cc1F ZINC000176099008 933558908 /nfs/dbraw/zinc/55/89/08/933558908.db2.gz PYYGLNUOPCNFBJ-UHFFFAOYSA-N 0 0 361.325 3.619 20 5 FHBDRN O=C(NCc1c(F)c(F)cc(F)c1F)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000610637280 933580557 /nfs/dbraw/zinc/58/05/57/933580557.db2.gz FWTJDRVALLTMNE-UHFFFAOYSA-N 0 0 367.258 3.563 20 5 FHBDRN CCc1ccc([C@@H]2COCCN2C(=O)c2ccc(CC)c([N+](=O)[O-])c2)o1 ZINC000471903317 933590042 /nfs/dbraw/zinc/59/00/42/933590042.db2.gz RCNCEYMNHXRWPK-KRWDZBQOSA-N 0 0 358.394 3.526 20 5 FHBDRN Cn1nnc2cc(/C=C(/c3ccncc3)c3ccc([N+](=O)[O-])cc3)ccc21 ZINC000430983839 933615032 /nfs/dbraw/zinc/61/50/32/933615032.db2.gz JIILQJHAKAEMAG-LDADJPATSA-N 0 0 357.373 3.860 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)NCC(C)(C)c1ccc(F)cc1 ZINC000548426216 933630538 /nfs/dbraw/zinc/63/05/38/933630538.db2.gz ACCPYWCOJJXKCG-UHFFFAOYSA-N 0 0 360.385 3.840 20 5 FHBDRN CCn1c2ccccc2nc1[C@H](C)NC(=O)c1ccc(F)cc1[N+](=O)[O-] ZINC000135416111 933649944 /nfs/dbraw/zinc/64/99/44/933649944.db2.gz ATCAWJAEYGXCAM-NSHDSACASA-N 0 0 356.357 3.595 20 5 FHBDRN O=C(CSCc1ccc(F)cc1)Nc1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000610653787 933652503 /nfs/dbraw/zinc/65/25/03/933652503.db2.gz KQZDFHOXQMTILJ-UHFFFAOYSA-N 0 0 371.393 3.576 20 5 FHBDRN C[C@H](C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)N1CCC[C@@H](C)C1 ZINC000610655866 933659241 /nfs/dbraw/zinc/65/92/41/933659241.db2.gz VWUAOZQHJJUGGR-CHWSQXEVSA-N 0 0 374.466 3.777 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)c1ccc(-c2ccco2)[nH]c1=O ZINC000610664561 933682028 /nfs/dbraw/zinc/68/20/28/933682028.db2.gz CCYNNSJVINKCCY-UHFFFAOYSA-N 0 0 353.334 3.825 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)COCc1nc2ccccc2s1 ZINC000610664782 933700091 /nfs/dbraw/zinc/70/00/91/933700091.db2.gz RDPNYSVKJRRTHQ-UHFFFAOYSA-N 0 0 371.418 3.977 20 5 FHBDRN O=C(NCC1(CO)CC(c2ccccc2)C1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000581983248 933726026 /nfs/dbraw/zinc/72/60/26/933726026.db2.gz RCUKNYOKNNJDPN-UHFFFAOYSA-N 0 0 374.824 3.534 20 5 FHBDRN CCN(C(=O)COc1ccc([N+](=O)[O-])c(C)c1)[C@@H](C)c1cccc(OC)c1 ZINC000510796174 933742274 /nfs/dbraw/zinc/74/22/74/933742274.db2.gz STOOEWXOEPAYOE-HNNXBMFYSA-N 0 0 372.421 3.900 20 5 FHBDRN Cc1ccc(-c2nnc(NC(=O)Cc3ccc([N+](=O)[O-])cc3)s2)c(C)c1 ZINC000065083212 933743369 /nfs/dbraw/zinc/74/33/69/933743369.db2.gz RSLFOISLWHYVSF-UHFFFAOYSA-N 0 0 368.418 3.911 20 5 FHBDRN COc1ccccc1C[C@@H](NC(=O)NCc1ccccc1[N+](=O)[O-])C(C)C ZINC000477860394 933788024 /nfs/dbraw/zinc/78/80/24/933788024.db2.gz LXUHDGMBIGYHSB-QGZVFWFLSA-N 0 0 371.437 3.670 20 5 FHBDRN O=C(NC[C@@H]1CCC(F)(F)C1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000431083558 933806558 /nfs/dbraw/zinc/80/65/58/933806558.db2.gz ZDLMFEBPJDJSNU-MRVPVSSYSA-N 0 0 352.259 3.779 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@H](C)c1cccc(OC(F)F)c1 ZINC000510822172 933814562 /nfs/dbraw/zinc/81/45/62/933814562.db2.gz TWHZCPWCGSBQCO-LLVKDONJSA-N 0 0 350.321 3.996 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)NCc1cccnc1OC1CCCC1 ZINC000510823466 933816594 /nfs/dbraw/zinc/81/65/94/933816594.db2.gz BOCALSQXUSDLES-UHFFFAOYSA-N 0 0 355.394 3.550 20 5 FHBDRN CCc1ccc(C(=O)Nc2cc(F)ccc2-n2cccn2)cc1[N+](=O)[O-] ZINC000471926076 933820172 /nfs/dbraw/zinc/82/01/72/933820172.db2.gz ZBKUVXFETWRPIK-UHFFFAOYSA-N 0 0 354.341 3.734 20 5 FHBDRN O=[N+]([O-])c1cc(-c2ccccc2)ccc1OC[C@@H](O)COCC(F)(F)F ZINC000431097108 933829351 /nfs/dbraw/zinc/82/93/51/933829351.db2.gz ASLWTIPWMLMXKL-AWEZNQCLSA-N 0 0 371.311 3.580 20 5 FHBDRN O=C(NC[C@@H]1CCC(F)(F)C1)c1sc(Br)cc1[N+](=O)[O-] ZINC000431109770 933850870 /nfs/dbraw/zinc/85/08/70/933850870.db2.gz XLDRZHSCLYZAIJ-ZCFIWIBFSA-N 0 0 369.187 3.584 20 5 FHBDRN COCCN(Cc1ccc(C)cc1C)C(=O)c1ccc(F)cc1[N+](=O)[O-] ZINC000610706036 933856295 /nfs/dbraw/zinc/85/62/95/933856295.db2.gz XYZYNHBGFPLDHB-UHFFFAOYSA-N 0 0 360.385 3.640 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N1CC(C)(C)c2ccccc21 ZINC000610706501 933856303 /nfs/dbraw/zinc/85/63/03/933856303.db2.gz LTZRZBQOYNIELI-UHFFFAOYSA-N 0 0 355.394 3.611 20 5 FHBDRN O=C(NCCCc1ccccc1)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000510850626 933864687 /nfs/dbraw/zinc/86/46/87/933864687.db2.gz PSYBHJXEWKYTLG-UHFFFAOYSA-N 0 0 365.336 3.951 20 5 FHBDRN CNC(=O)c1cc([N+](=O)[O-])ccc1NCCCO[C@H](C)c1ccccc1 ZINC000510848915 933864837 /nfs/dbraw/zinc/86/48/37/933864837.db2.gz CSFBCAPHOOIBHQ-CQSZACIVSA-N 0 0 357.410 3.534 20 5 FHBDRN CSc1ccc(C(=O)N[C@H]2COc3c2cccc3Cl)cc1[N+](=O)[O-] ZINC000610709632 933872723 /nfs/dbraw/zinc/87/27/23/933872723.db2.gz GHBFUCJMUMAMGV-LBPRGKRZSA-N 0 0 364.810 3.834 20 5 FHBDRN CCOc1cc(CNc2ccc(C)c(C(=O)N(C)C)c2)ccc1[N+](=O)[O-] ZINC000276888824 933885539 /nfs/dbraw/zinc/88/55/39/933885539.db2.gz JXLGJYRNIAEHQS-UHFFFAOYSA-N 0 0 357.410 3.616 20 5 FHBDRN O=C(N[C@H]1COc2c1cccc2Cl)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000610712282 933887395 /nfs/dbraw/zinc/88/73/95/933887395.db2.gz ZDOMPPAKQASWLJ-LBPRGKRZSA-N 0 0 353.161 3.765 20 5 FHBDRN CC1(C)CN(Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c2ccccc21 ZINC000610710606 933888163 /nfs/dbraw/zinc/88/81/63/933888163.db2.gz XGXDADZHLGSGKF-UHFFFAOYSA-N 0 0 350.378 3.943 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2nc(CCCOCCc3ccccc3)no2)cc1 ZINC000544982465 933953323 /nfs/dbraw/zinc/95/33/23/933953323.db2.gz DTRIUYOAATYFJW-UHFFFAOYSA-N 0 0 353.378 3.837 20 5 FHBDRN CC(C)(CNC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCCCO1 ZINC000610721716 933970428 /nfs/dbraw/zinc/97/04/28/933970428.db2.gz RYGZVVUFZFIWKH-INIZCTEOSA-N 0 0 363.458 3.724 20 5 FHBDRN COCC(=O)N1CCc2cc(N[C@H](C)c3cccc([N+](=O)[O-])c3C)ccc21 ZINC000187657059 933975894 /nfs/dbraw/zinc/97/58/94/933975894.db2.gz JABUIPHBVYEBMA-CQSZACIVSA-N 0 0 369.421 3.612 20 5 FHBDRN Cc1ccnc(N2CCc3c(F)cc(Br)cc3C2)c1[N+](=O)[O-] ZINC000610726297 933992767 /nfs/dbraw/zinc/99/27/67/933992767.db2.gz PIWPEHVZPTUFTF-UHFFFAOYSA-N 0 0 366.190 3.763 20 5 FHBDRN CCCCCOCC(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000431171714 934002218 /nfs/dbraw/zinc/00/22/18/934002218.db2.gz GREOPXLQOZVRFS-UHFFFAOYSA-N 0 0 359.220 3.811 20 5 FHBDRN CC1(C)Cc2cc(NC(=O)N3CCc4ccc([N+](=O)[O-])cc4C3)ccc2O1 ZINC000610732105 934014840 /nfs/dbraw/zinc/01/48/40/934014840.db2.gz QWHXVSQUILVJGJ-UHFFFAOYSA-N 0 0 367.405 3.899 20 5 FHBDRN Cc1c(NC(=O)CCCOC(C)C)cc(Br)cc1[N+](=O)[O-] ZINC000431180549 934021971 /nfs/dbraw/zinc/02/19/71/934021971.db2.gz OZEQSOWOKAKTTI-UHFFFAOYSA-N 0 0 359.220 3.809 20 5 FHBDRN COc1cc(N[C@H]2CCCN(c3ccsc3[N+](=O)[O-])C2)cc(OC)c1 ZINC000610735609 934022182 /nfs/dbraw/zinc/02/21/82/934022182.db2.gz JOCLAIQPROYWFC-LBPRGKRZSA-N 0 0 363.439 3.754 20 5 FHBDRN CC[C@@H](C)[C@@H](OC)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000431182706 934054824 /nfs/dbraw/zinc/05/48/24/934054824.db2.gz VPCGYSPMZKBZIP-AMIZOPFISA-N 0 0 359.220 3.665 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N2CCC3(CC2)OCc2ccccc23)c1 ZINC000610746733 934067753 /nfs/dbraw/zinc/06/77/53/934067753.db2.gz DFRICBLVOKXGTE-UHFFFAOYSA-N 0 0 352.390 3.565 20 5 FHBDRN Cc1c(C(=O)N(Cc2cccs2)[C@@H]2C=C[C@H](CO)C2)cccc1[N+](=O)[O-] ZINC000561768747 934105268 /nfs/dbraw/zinc/10/52/68/934105268.db2.gz YDNCUDBTXDQFBQ-LSDHHAIUSA-N 0 0 372.446 3.544 20 5 FHBDRN CN(Cc1ccc([S@@](C)=O)cc1)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000178437094 934143479 /nfs/dbraw/zinc/14/34/79/934143479.db2.gz PUMBWSIQYULLEU-HSZRJFAPSA-N 0 0 352.843 3.618 20 5 FHBDRN O=C(Nc1ccc(C(F)(F)C(F)(F)F)cc1)c1ccc([N+](=O)[O-])cn1 ZINC000610771463 934146557 /nfs/dbraw/zinc/14/65/57/934146557.db2.gz PFGAIJISMHZFHQ-UHFFFAOYSA-N 0 0 361.226 3.896 20 5 FHBDRN C[C@@H](NC(=O)c1ccc(C(=O)c2cc[nH]c2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000176115181 934148028 /nfs/dbraw/zinc/14/80/28/934148028.db2.gz JXLKETRNJJRRNM-CYBMUJFWSA-N 0 0 363.373 3.645 20 5 FHBDRN Cc1ncc([N+](=O)[O-])n1CCN1CCC[C@@H]1c1nc2ccccc2s1 ZINC000610782692 934179149 /nfs/dbraw/zinc/17/91/49/934179149.db2.gz LNWIIEVVFPRRCJ-CQSZACIVSA-N 0 0 357.439 3.547 20 5 FHBDRN O=[N+]([O-])c1sc(N[C@H]2CCC(F)(F)C2)nc1N[C@@H]1CCC(F)(F)C1 ZINC000610786025 934188080 /nfs/dbraw/zinc/18/80/80/934188080.db2.gz PVOMSBFREVKNOW-SFYZADRCSA-N 0 0 368.356 3.673 20 5 FHBDRN O=C(N[C@H](C1CCCC1)C(F)(F)F)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000548489943 934207529 /nfs/dbraw/zinc/20/75/29/934207529.db2.gz FXKLBLLRMLUZJA-OAHLLOKOSA-N 0 0 371.359 3.784 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)CCc1nc2ccccc2s1 ZINC000512962528 934213194 /nfs/dbraw/zinc/21/31/94/934213194.db2.gz ZFZBXELROFRVEE-UHFFFAOYSA-N 0 0 369.446 3.838 20 5 FHBDRN Cc1ncc(C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2C)s1 ZINC000431227588 934229194 /nfs/dbraw/zinc/22/91/94/934229194.db2.gz ZSGLYJLPNLSLMG-UHFFFAOYSA-N 0 0 356.201 3.683 20 5 FHBDRN CC(C)(C(=O)NCc1c(F)cc(F)cc1F)c1ccccc1[N+](=O)[O-] ZINC000510966212 934238067 /nfs/dbraw/zinc/23/80/67/934238067.db2.gz AKMMIKMPBBYKKY-UHFFFAOYSA-N 0 0 352.312 3.606 20 5 FHBDRN Cc1cc(C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2C)ccn1 ZINC000431237374 934240604 /nfs/dbraw/zinc/24/06/04/934240604.db2.gz LFRAVFADKBYISR-UHFFFAOYSA-N 0 0 350.172 3.621 20 5 FHBDRN COCc1cc(O)ccc1NC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F ZINC000458073094 934274849 /nfs/dbraw/zinc/27/48/49/934274849.db2.gz ZRMFCTNDMUJUCR-UHFFFAOYSA-N 0 0 362.357 3.502 20 5 FHBDRN CC[C@H](CNC(=O)c1c[nH]c2cccc([N+](=O)[O-])c21)Oc1cccc(F)c1 ZINC000535696526 934289668 /nfs/dbraw/zinc/28/96/68/934289668.db2.gz QQKUQEAMBVKJLD-CYBMUJFWSA-N 0 0 371.368 3.803 20 5 FHBDRN O=C(N[C@H](c1ccccc1)c1ccncc1)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000535696106 934290667 /nfs/dbraw/zinc/29/06/67/934290667.db2.gz JGYGKOTYESRFPG-HXUWFJFHSA-N 0 0 372.384 3.991 20 5 FHBDRN CN(C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)[C@H]1CCC[C@@H]1c1ccccc1 ZINC000458092085 934291738 /nfs/dbraw/zinc/29/17/38/934291738.db2.gz PPIDLQPVLHYCBQ-QAPCUYQASA-N 0 0 364.405 3.879 20 5 FHBDRN CC(C)(CNC(=O)c1c[nH]c2cccc([N+](=O)[O-])c21)c1cccc(F)c1 ZINC000535698779 934294244 /nfs/dbraw/zinc/29/42/44/934294244.db2.gz IZWWIFYPPNFGBZ-UHFFFAOYSA-N 0 0 355.369 3.923 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)N2CC3(CCCCC3)[C@@H]2c2ccccc2)n1 ZINC000458127424 934311540 /nfs/dbraw/zinc/31/15/40/934311540.db2.gz MTPNNHDOSNRHJX-SFHVURJKSA-N 0 0 368.437 3.959 20 5 FHBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)N1CC2(CCCCC2)[C@@H]1c1ccccc1 ZINC000458128206 934313511 /nfs/dbraw/zinc/31/35/11/934313511.db2.gz NCHPLXJINFWYJS-KRWDZBQOSA-N 0 0 366.421 3.720 20 5 FHBDRN Cc1nn(Cc2ccc(C(=O)N[C@H]3C[C@@]3(C)C(C)C)cc2)c(C)c1[N+](=O)[O-] ZINC000458148542 934322914 /nfs/dbraw/zinc/32/29/14/934322914.db2.gz OSBKYVUAXUAKRV-PXNSSMCTSA-N 0 0 370.453 3.621 20 5 FHBDRN CO[C@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2SC(C)C)C12CCC2 ZINC000458189862 934363677 /nfs/dbraw/zinc/36/36/77/934363677.db2.gz MGFKOOKVACJKAX-CVEARBPZSA-N 0 0 364.467 3.783 20 5 FHBDRN O=[N+]([O-])c1cccc(CN(Cc2cccc3c2OCCCO3)C2CC2)c1 ZINC000535785478 934375996 /nfs/dbraw/zinc/37/59/96/934375996.db2.gz PBXHOMDQRSXZGM-UHFFFAOYSA-N 0 0 354.406 3.921 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CC(CC)(c3ccccc3)C2)c1 ZINC000458210436 934379213 /nfs/dbraw/zinc/37/92/13/934379213.db2.gz DZALNDWGMCDWRR-UHFFFAOYSA-N 0 0 354.406 3.797 20 5 FHBDRN C[C@H]1Cc2cc(F)ccc2[C@H](C)N1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000535793852 934386946 /nfs/dbraw/zinc/38/69/46/934386946.db2.gz XKAQGGQKQBSIBD-KBPBESRZSA-N 0 0 371.412 3.705 20 5 FHBDRN C[C@@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2NCc2ccccc2)CCO1 ZINC000535803517 934399997 /nfs/dbraw/zinc/39/99/97/934399997.db2.gz RDRGMEVSCQOEFL-ZBFHGGJFSA-N 0 0 369.421 3.504 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@@H](CC(=O)OC(C)C)C1 ZINC000588471517 934447638 /nfs/dbraw/zinc/44/76/38/934447638.db2.gz UEQIHPFHLUOGRW-HKBKRHGFSA-N 0 0 374.437 3.578 20 5 FHBDRN O=C1[C@@H](Nc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCN1C1CCCCC1 ZINC000610808422 934450097 /nfs/dbraw/zinc/45/00/97/934450097.db2.gz KDXPKPROGQFHTP-AWEZNQCLSA-N 0 0 371.359 3.959 20 5 FHBDRN CC[C@@]1(C)CN(C(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)CCO1 ZINC000277017511 934452738 /nfs/dbraw/zinc/45/27/38/934452738.db2.gz CACQZKQHKOSAJK-NRFANRHFSA-N 0 0 350.418 3.735 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)N1CCC[C@@H]1[C@H]1CCCCC1=O ZINC000176155155 934481233 /nfs/dbraw/zinc/48/12/33/934481233.db2.gz QZCNOPYCUQVBGW-QZTJIDSGSA-N 0 0 373.453 3.537 20 5 FHBDRN Cc1ccc(NC(=O)C(=O)N[C@@H](C)[C@H](C)C2CCCCC2)cc1[N+](=O)[O-] ZINC000176162296 934481614 /nfs/dbraw/zinc/48/16/14/934481614.db2.gz YWVQJLOZLJRMHI-KBPBESRZSA-N 0 0 361.442 3.563 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N1CCSc2ccccc21 ZINC000176169756 934484728 /nfs/dbraw/zinc/48/47/28/934484728.db2.gz UAWNPYWMHMXSMF-UHFFFAOYSA-N 0 0 370.839 3.549 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N(Cc2ccc(F)cc2)C2CCOCC2)c1 ZINC000277101154 934490046 /nfs/dbraw/zinc/49/00/46/934490046.db2.gz MIBAVSKUZGIXQK-UHFFFAOYSA-N 0 0 372.396 3.864 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)NC[C@@H]2CCOc3ccccc32)cc1[N+](=O)[O-] ZINC000176174711 934497847 /nfs/dbraw/zinc/49/78/47/934497847.db2.gz NVLILEYBMPDZEZ-ZBFHGGJFSA-N 0 0 369.421 3.830 20 5 FHBDRN COC(=O)C(C)(C)[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1C)c1ccccc1 ZINC000610823850 934499424 /nfs/dbraw/zinc/49/94/24/934499424.db2.gz RGLUPWFGHPCHCM-KRWDZBQOSA-N 0 0 370.405 3.574 20 5 FHBDRN C[C@H]([NH2+]Cc1ccnn1CCc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000610831447 934503048 /nfs/dbraw/zinc/50/30/48/934503048.db2.gz UAVBUWRPNDFXNU-INIZCTEOSA-N 0 0 350.422 3.885 20 5 FHBDRN O=[N+]([O-])c1ccc(NC[C@@H](CO)Cc2ccccc2C(F)(F)F)s1 ZINC000610864786 934539122 /nfs/dbraw/zinc/53/91/22/934539122.db2.gz SWBFNTOQNJORCW-JTQLQIEISA-N 0 0 360.357 3.938 20 5 FHBDRN Cc1cc(F)cc(C(=O)NCc2ccccc2OCC2CC2)c1[N+](=O)[O-] ZINC000176243908 934564621 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20 5 FHBDRN Cc1[nH]c2ccccc2c1CCNC(=O)c1cc(F)cc(C)c1[N+](=O)[O-] ZINC000176219050 934641275 /nfs/dbraw/zinc/64/12/75/934641275.db2.gz KSTJFONHXNDKAD-UHFFFAOYSA-N 0 0 355.369 3.805 20 5 FHBDRN C[C@H]1COCCCN1C(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 ZINC000610948388 934644724 /nfs/dbraw/zinc/64/47/24/934644724.db2.gz CSNVDSCVGYWIHY-AWEZNQCLSA-N 0 0 356.378 3.638 20 5 FHBDRN Cc1cc(F)cc(C(=O)N(C)CCCc2nc3ccccc3[nH]2)c1[N+](=O)[O-] ZINC000176223179 934646129 /nfs/dbraw/zinc/64/61/29/934646129.db2.gz YGROFWVKBQGRPP-UHFFFAOYSA-N 0 0 370.384 3.623 20 5 FHBDRN CCc1ccc(C(=O)N2CCC[C@]3(C2)OCc2ccccc23)cc1[N+](=O)[O-] ZINC000548504280 934663334 /nfs/dbraw/zinc/66/33/34/934663334.db2.gz DRVJLVIANZZCRV-OAQYLSRUSA-N 0 0 366.417 3.819 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H]1C[C@@H](O)c1cccs1 ZINC000176251027 934665842 /nfs/dbraw/zinc/66/58/42/934665842.db2.gz MLESFJUFRHRHIT-CZUORRHYSA-N 0 0 360.435 3.693 20 5 FHBDRN CCC[C@H](NC(=O)COc1ccc([N+](=O)[O-])c2cccnc12)C1CCC1 ZINC000458326854 934703361 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CCC[C@@H](C)NC(=O)[C@H]1CCCN(c2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000065230044 934751124 /nfs/dbraw/zinc/75/11/24/934751124.db2.gz FENMFOBOPFRUAI-OLZOCXBDSA-N 0 0 353.850 3.769 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)ccc1OC[C@H](O)COc1ccc(Cl)cc1 ZINC000535909750 934778608 /nfs/dbraw/zinc/77/86/08/934778608.db2.gz KPOKUSVAPCWEAD-GFCCVEGCSA-N 0 0 358.177 3.720 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OC[C@@H](O)COc2cccc(C(F)(F)F)c2)c1 ZINC000535911064 934784400 /nfs/dbraw/zinc/78/44/00/934784400.db2.gz USWPZDSWGSQEHA-ZDUSSCGKSA-N 0 0 371.311 3.741 20 5 FHBDRN O=C(N[C@H]1CCCc2cn(C3CCCC3)nc21)c1ccc([N+](=O)[O-])cc1 ZINC000611555601 934802189 /nfs/dbraw/zinc/80/21/89/934802189.db2.gz ZRSBZSJEOLTMRS-KRWDZBQOSA-N 0 0 354.410 3.714 20 5 FHBDRN O=C(N[C@@H]1CCCc2cn(C3CCCC3)nc21)c1cccc([N+](=O)[O-])c1 ZINC000611555560 934802359 /nfs/dbraw/zinc/80/23/59/934802359.db2.gz LDPBFUKFTOOIBU-QGZVFWFLSA-N 0 0 354.410 3.714 20 5 FHBDRN CC[C@@](C)(NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)c1nccs1 ZINC000135459979 934805242 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GPVBYMWTOJQRKI-NSHDSACASA-N 0 0 371.418 3.866 20 5 FHBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)Nc1nc2ccccn2n1 ZINC000134883068 934857164 /nfs/dbraw/zinc/85/71/64/934857164.db2.gz CKRPCEWJQIFILR-UHFFFAOYSA-N 0 0 371.422 3.638 20 5 FHBDRN CC(C)(C)c1ccc(CNC(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)cc1 ZINC000074374201 934862274 /nfs/dbraw/zinc/86/22/74/934862274.db2.gz MMMCPORTXRBZBM-UHFFFAOYSA-N 0 0 370.405 3.594 20 5 FHBDRN O=C(C[C@H]1CCc2ccccc2C1)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000533864169 934866018 /nfs/dbraw/zinc/86/60/18/934866018.db2.gz NCZVKWJCTFKGFP-HNNXBMFYSA-N 0 0 350.418 3.675 20 5 FHBDRN CC(=O)Nc1ccc(C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc1F ZINC000277281338 934869457 /nfs/dbraw/zinc/86/94/57/934869457.db2.gz AZFYGKBOLSPQFG-UHFFFAOYSA-N 0 0 373.384 3.743 20 5 FHBDRN Cc1onc(-c2ccncc2)c1C(=O)Nc1cc([N+](=O)[O-])c(C)cc1C ZINC000119535303 934872435 /nfs/dbraw/zinc/87/24/35/934872435.db2.gz GBNPBXYJVITWIO-UHFFFAOYSA-N 0 0 352.350 3.822 20 5 FHBDRN C[C@@H]1CC[C@@H](C(F)(F)F)CN1C(=O)c1c[nH]c2cccc([N+](=O)[O-])c21 ZINC000611561776 934872674 /nfs/dbraw/zinc/87/26/74/934872674.db2.gz MWAFCZCMCKCBOW-NXEZZACHSA-N 0 0 355.316 3.879 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N[C@@H](C)c2ccccc2C(F)(F)F)c1[N+](=O)[O-] ZINC000433997197 934874586 /nfs/dbraw/zinc/87/45/86/934874586.db2.gz NCLVHUWNBBOCQB-VIFPVBQESA-N 0 0 370.331 3.951 20 5 FHBDRN CCOc1cc(CN(C)c2ncccc2[N+](=O)[O-])ccc1OC(F)F ZINC000046483237 934875852 /nfs/dbraw/zinc/87/58/52/934875852.db2.gz WVNODRAJHXORNY-UHFFFAOYSA-N 0 0 353.325 3.626 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)c1c(C)cccc1Br ZINC000320485847 934883556 /nfs/dbraw/zinc/88/35/56/934883556.db2.gz NDIVWCCOKFYQPR-UHFFFAOYSA-N 0 0 365.183 3.927 20 5 FHBDRN Cc1ccc([C@H](C)N(C)S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])cc1 ZINC000119563502 934885000 /nfs/dbraw/zinc/88/50/00/934885000.db2.gz JKIYSXPAPNIKCU-LBPRGKRZSA-N 0 0 368.842 3.938 20 5 FHBDRN CCCC[C@H](COC)NC(=O)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC000755024755 934891328 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359.357 3.894 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)NCc1ccc(C2CCCCC2)cc1 ZINC000562049337 935703560 /nfs/dbraw/zinc/70/35/60/935703560.db2.gz VKIVWTWPOOGLCE-UHFFFAOYSA-N 0 0 370.453 3.854 20 5 FHBDRN COc1cc(C(=O)NCCCO[C@@H](C)c2ccccc2)cc([N+](=O)[O-])c1C ZINC000478747337 935705447 /nfs/dbraw/zinc/70/54/47/935705447.db2.gz PKCJODZOKQPMNG-HNNXBMFYSA-N 0 0 372.421 3.810 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@H]1CC(=O)c1ccccc1 ZINC000085491397 935708629 /nfs/dbraw/zinc/70/86/29/935708629.db2.gz WXFBJFCYKLNRTQ-INIZCTEOSA-N 0 0 352.390 3.781 20 5 FHBDRN Cc1nn(C)c(C(=O)Nc2nc(-c3ccc(C)cc3C)cs2)c1[N+](=O)[O-] ZINC000127667803 935715926 /nfs/dbraw/zinc/71/59/26/935715926.db2.gz KGXODLLYLHFKHA-UHFFFAOYSA-N 0 0 371.422 3.629 20 5 FHBDRN C[C@@H](NC(=O)N(C)CCOCc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000158325406 935726968 /nfs/dbraw/zinc/72/69/68/935726968.db2.gz FUQFYTRILOSWJG-OAHLLOKOSA-N 0 0 357.410 3.514 20 5 FHBDRN CCc1ccccc1CNC(=O)c1cc([N+](=O)[O-])ccc1SCCOC ZINC000158346863 935744120 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FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)Nc2ccc(N3CCCCCC3)cc2C)n1 ZINC000582503259 935781068 /nfs/dbraw/zinc/78/10/68/935781068.db2.gz IAFCOLFYHXJGMY-UHFFFAOYSA-N 0 0 371.441 3.752 20 5 FHBDRN CCc1nnc(NC(=O)c2ccc(SCCC(C)C)c([N+](=O)[O-])c2)[nH]1 ZINC000479078783 935783846 /nfs/dbraw/zinc/78/38/46/935783846.db2.gz JGRDXBMZFPUCFH-UHFFFAOYSA-N 0 0 363.443 3.666 20 5 FHBDRN Cc1cc(-c2nnc(CN(C)CCc3ccccc3[N+](=O)[O-])o2)c(C)o1 ZINC000511145041 935789587 /nfs/dbraw/zinc/78/95/87/935789587.db2.gz UZEGOOAOQUHKEJ-UHFFFAOYSA-N 0 0 356.382 3.529 20 5 FHBDRN COC[C@H](C)n1c(C)cc(C(=O)COc2cccc([N+](=O)[O-])c2C)c1C ZINC000047355602 945123709 /nfs/dbraw/zinc/12/37/09/945123709.db2.gz GQXUYGCDWRYIKF-ZDUSSCGKSA-N 0 0 360.410 3.791 20 5 FHBDRN CC[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1Br)c1ccncc1 ZINC000158435563 935796400 /nfs/dbraw/zinc/79/64/00/935796400.db2.gz WHFKPVQUHKYTCY-CQSZACIVSA-N 0 0 364.199 3.633 20 5 FHBDRN Cc1ccc(C)c(S(=O)(=O)N2CCCCc3ccccc32)c1[N+](=O)[O-] ZINC000479130178 935800592 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FHBDRN Cc1oc(-c2ccccc2)nc1CC(=O)N(C)c1cccc([N+](=O)[O-])c1 ZINC000158466202 935817848 /nfs/dbraw/zinc/81/78/48/935817848.db2.gz GGIDZPSEUVILDH-UHFFFAOYSA-N 0 0 351.362 3.764 20 5 FHBDRN CSc1cc(NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)ccn1 ZINC000611619447 935818090 /nfs/dbraw/zinc/81/80/90/935818090.db2.gz ZYQWGQRRKIRXJO-UHFFFAOYSA-N 0 0 355.322 3.565 20 5 FHBDRN CCC(=O)c1ccc(NC[C@](C)(CO)Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000479279511 935825183 /nfs/dbraw/zinc/82/51/83/935825183.db2.gz HDGQLGZASWHKJA-HXUWFJFHSA-N 0 0 356.422 3.841 20 5 FHBDRN CN(C(=O)c1cnn(-c2ccc(Cl)cc2)c1)c1cccc([N+](=O)[O-])c1 ZINC000158528569 935828992 /nfs/dbraw/zinc/82/89/92/935828992.db2.gz VWZQTVNTPRMMGW-UHFFFAOYSA-N 0 0 356.769 3.711 20 5 FHBDRN CCC(=O)Nc1ccc(NC(=O)C(C)(C)c2ccccc2[N+](=O)[O-])cc1 ZINC000431451721 935831529 /nfs/dbraw/zinc/83/15/29/935831529.db2.gz KFLWUYLHPYKEHC-UHFFFAOYSA-N 0 0 355.394 3.860 20 5 FHBDRN CCC(=O)c1ccc(NCCN2CCc3sccc3C2)c([N+](=O)[O-])c1 ZINC000479390452 935834760 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Cc1ccc(CC(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)cn1 ZINC000127917250 935839981 /nfs/dbraw/zinc/83/99/81/935839981.db2.gz BADMRNSIKWXFRT-UHFFFAOYSA-N 0 0 354.391 3.603 20 5 FHBDRN CCOC(=O)c1ccnc(Nc2ccc(OCC(F)F)cc2)c1[N+](=O)[O-] ZINC000479475990 935842697 /nfs/dbraw/zinc/84/26/97/935842697.db2.gz AVEXVFOCTCFDDK-UHFFFAOYSA-N 0 0 367.308 3.554 20 5 FHBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)N1CCSC[C@H]1c1ccccc1 ZINC000255516169 935845111 /nfs/dbraw/zinc/84/51/11/935845111.db2.gz URBZVTRBBOGWIP-YFWYWMRJSA-N 0 0 354.431 3.925 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CC[C@H](Cc3ccccc3)C2)c1 ZINC000187758180 935849692 /nfs/dbraw/zinc/84/96/92/935849692.db2.gz NRINJGBOUKTLNP-CVEARBPZSA-N 0 0 354.406 3.745 20 5 FHBDRN Cc1nc(N2CCN(c3ccc4ncccc4c3[N+](=O)[O-])CC2)sc1C ZINC000158583525 935852408 /nfs/dbraw/zinc/85/24/08/935852408.db2.gz CPGRCQCWNOPWRP-UHFFFAOYSA-N 0 0 369.450 3.543 20 5 FHBDRN COc1cc(NCc2ccc(COC3CCOCC3)cc2)ccc1[N+](=O)[O-] ZINC000127950795 935859015 /nfs/dbraw/zinc/85/90/15/935859015.db2.gz CSNYUSONRIRICF-UHFFFAOYSA-N 0 0 372.421 3.911 20 5 FHBDRN CC[C@H](N[C@H](C)c1ncc(Br)cn1)c1cccc([N+](=O)[O-])c1 ZINC000582596353 935859895 /nfs/dbraw/zinc/85/98/95/935859895.db2.gz IJWUUYBOGORHCE-YGRLFVJLSA-N 0 0 365.231 3.949 20 5 FHBDRN CC(=O)c1cc(NC(=O)CCOc2cc(C)ccc2[N+](=O)[O-])ccc1C ZINC000563407696 935859924 /nfs/dbraw/zinc/85/99/24/935859924.db2.gz VCTWWDZRHBAWGB-UHFFFAOYSA-N 0 0 356.378 3.822 20 5 FHBDRN O=C(NCCc1nccs1)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 ZINC000050450540 935862245 /nfs/dbraw/zinc/86/22/45/935862245.db2.gz XENPHNKOCGXPSC-UHFFFAOYSA-N 0 0 369.402 3.816 20 5 FHBDRN CCc1nc(C)c([C@H](C)N(C)C(=O)c2cc(OC)ccc2[N+](=O)[O-])s1 ZINC000120092340 935867940 /nfs/dbraw/zinc/86/79/40/935867940.db2.gz DDUJMTVBSPAUTG-NSHDSACASA-N 0 0 363.439 3.764 20 5 FHBDRN O=C(c1ccc(OC(F)F)c([N+](=O)[O-])c1)N1CC[C@@H]1c1cccc(F)c1 ZINC000611646895 935870355 /nfs/dbraw/zinc/87/03/55/935870355.db2.gz RKYWOLZWBSDTJF-CYBMUJFWSA-N 0 0 366.295 3.923 20 5 FHBDRN O=C(CSc1nnc(-c2ccc(F)cc2)o1)Nc1ccccc1[N+](=O)[O-] ZINC000611655000 935876334 /nfs/dbraw/zinc/87/63/34/935876334.db2.gz MHYJOWJRDPNTQG-UHFFFAOYSA-N 0 0 374.353 3.515 20 5 FHBDRN O=[N+]([O-])c1ccccc1CN1CCO[C@@H](c2cccc(OC(F)F)c2)C1 ZINC000127983250 935876820 /nfs/dbraw/zinc/87/68/20/935876820.db2.gz LGFHNGNHQFDJSL-QGZVFWFLSA-N 0 0 364.348 3.770 20 5 FHBDRN C[C@H](SCc1nc(-c2cccc([N+](=O)[O-])c2)no1)C(=O)OC(C)(C)C ZINC000479705645 935879882 /nfs/dbraw/zinc/87/98/82/935879882.db2.gz OOGUUQQTFJHXOL-JTQLQIEISA-N 0 0 365.411 3.608 20 5 FHBDRN CCSc1nccnc1-c1noc([C@H](C)c2cccc([N+](=O)[O-])c2)n1 ZINC000562119133 935889835 /nfs/dbraw/zinc/88/98/35/935889835.db2.gz DTTNAGCOCYXBKP-SNVBAGLBSA-N 0 0 357.395 3.699 20 5 FHBDRN O=C(COc1ccccc1[N+](=O)[O-])N[C@H]1CC[C@H](Cc2ccccc2)C1 ZINC000187771176 935894728 /nfs/dbraw/zinc/89/47/28/935894728.db2.gz BXHDMVJQAJNWJY-SJORKVTESA-N 0 0 354.406 3.501 20 5 FHBDRN CCC1(CC)[C@H](NC(=O)c2c([N+](=O)[O-])cccc2C(F)(F)F)C[C@@H]1OC ZINC000582633828 935896368 /nfs/dbraw/zinc/89/63/68/935896368.db2.gz ZMNPJNDINMBIHA-OLZOCXBDSA-N 0 0 374.359 3.937 20 5 FHBDRN CCCc1ccc(C(=O)CCC(=O)NCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000065579709 935897074 /nfs/dbraw/zinc/89/70/74/935897074.db2.gz COKCOMQBOKINHR-UHFFFAOYSA-N 0 0 354.406 3.827 20 5 FHBDRN COc1ccc(-c2cc(C(=O)Nc3cc([N+](=O)[O-])c(C)cc3C)n[nH]2)cc1 ZINC000479832979 935899820 /nfs/dbraw/zinc/89/98/20/935899820.db2.gz VYSDEPRTYNHVLR-UHFFFAOYSA-N 0 0 366.377 3.863 20 5 FHBDRN Cc1ccc([C@H](NS(=O)(=O)c2ccc([N+](=O)[O-])cc2C)C2CC2)cc1 ZINC000030337469 935911533 /nfs/dbraw/zinc/91/15/33/935911533.db2.gz PMXHLMHFHQDWAD-SFHVURJKSA-N 0 0 360.435 3.641 20 5 FHBDRN COc1ccccc1[C@H]1CCN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)C1 ZINC000152944200 935913771 /nfs/dbraw/zinc/91/37/71/935913771.db2.gz CVQXMYCFAUZVDW-LBPRGKRZSA-N 0 0 360.797 3.887 20 5 FHBDRN C[C@@H]1C[C@H](C)CCN(C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C1 ZINC000158690966 935914259 /nfs/dbraw/zinc/91/42/59/935914259.db2.gz MTTMSSLHYDCUHT-HZPDHXFCSA-N 0 0 359.470 3.706 20 5 FHBDRN Cc1cn2cc(NC(=O)CCc3c(Cl)cccc3[N+](=O)[O-])ccc2n1 ZINC001125613482 935915084 /nfs/dbraw/zinc/91/50/84/935915084.db2.gz JFJYJXRZGDHELE-UHFFFAOYSA-N 0 0 358.785 3.776 20 5 FHBDRN CCC(=O)c1ccc(NCc2cc(F)cc3c2OCOC3)c([N+](=O)[O-])c1 ZINC000479981789 935934456 /nfs/dbraw/zinc/93/44/56/935934456.db2.gz BRSNAJPRZNVNNN-UHFFFAOYSA-N 0 0 360.341 3.805 20 5 FHBDRN C[C@H](Cc1cccs1)NC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000431471786 935937727 /nfs/dbraw/zinc/93/77/27/935937727.db2.gz NXLYTLOQAMSRKT-SECBINFHSA-N 0 0 369.240 3.780 20 5 FHBDRN COc1ccc(OC)c([C@H](C)Nc2ncnc3ccc([N+](=O)[O-])cc32)c1 ZINC000611700361 935939571 /nfs/dbraw/zinc/93/95/71/935939571.db2.gz QEOJAPLGSINOCO-NSHDSACASA-N 0 0 354.366 3.728 20 5 FHBDRN O=[N+]([O-])c1ccc2ncnc(NC[C@@H]3CCC[C@H](C(F)(F)F)C3)c2c1 ZINC000611705700 935944617 /nfs/dbraw/zinc/94/46/17/935944617.db2.gz BBDMDIIMIGXCPR-MNOVXSKESA-N 0 0 354.332 3.741 20 5 FHBDRN O=[N+]([O-])c1ccc2ncnc(Nc3cnn(-c4ccccc4F)c3)c2c1 ZINC000611706617 935944734 /nfs/dbraw/zinc/94/47/34/935944734.db2.gz GBQFPDDQDDZRMG-UHFFFAOYSA-N 0 0 350.313 3.606 20 5 FHBDRN Cc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c(Br)n1 ZINC000128090944 935945398 /nfs/dbraw/zinc/94/53/98/935945398.db2.gz IYQUVWRTEXABMZ-UHFFFAOYSA-N 0 0 370.590 3.966 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)N[C@H](C1CCCC1)C(F)(F)F ZINC000480038971 935945454 /nfs/dbraw/zinc/94/54/54/935945454.db2.gz BUPIYSNBERBDSB-OAHLLOKOSA-N 0 0 373.375 3.900 20 5 FHBDRN Cc1c(CNC(=O)N2C[C@@H](c3ccccc3)C[C@H]2C)cccc1[N+](=O)[O-] ZINC000480041477 935945516 /nfs/dbraw/zinc/94/55/16/935945516.db2.gz GUBVQWJLMZRYFD-KDOFPFPSSA-N 0 0 353.422 3.991 20 5 FHBDRN O=[N+]([O-])c1ccc2ncnc(Nc3ccc(N4CCCCC4)nc3)c2c1 ZINC000611704152 935946332 /nfs/dbraw/zinc/94/63/32/935946332.db2.gz YCQGZSAZPHBUJH-UHFFFAOYSA-N 0 0 350.382 3.667 20 5 FHBDRN COc1cc(F)c([C@H](C)Nc2ncnc3ccc([N+](=O)[O-])cc32)cc1OC ZINC000611704847 935948081 /nfs/dbraw/zinc/94/80/81/935948081.db2.gz BEFWTJGAEYTLOK-JTQLQIEISA-N 0 0 372.356 3.867 20 5 FHBDRN O=C(NCCCCOCc1ccccc1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000050690624 935948480 /nfs/dbraw/zinc/94/84/80/935948480.db2.gz BPDJXYWCXKMOKV-UHFFFAOYSA-N 0 0 362.813 3.975 20 5 FHBDRN Cc1c(CNC(=O)NC2(Cc3ccccc3)CCC2)cccc1[N+](=O)[O-] ZINC000480052576 935949060 /nfs/dbraw/zinc/94/90/60/935949060.db2.gz FYLIJNYRHCFZLK-UHFFFAOYSA-N 0 0 353.422 3.868 20 5 FHBDRN Cc1c(CNC(=O)N(C)Cc2ccc(Cl)s2)cccc1[N+](=O)[O-] ZINC000480062003 935950313 /nfs/dbraw/zinc/95/03/13/935950313.db2.gz CPXYPGHKRBJHEH-UHFFFAOYSA-N 0 0 353.831 3.960 20 5 FHBDRN COc1ccc(CNCc2cc(O)cc(C(F)(F)F)c2)cc1[N+](=O)[O-] ZINC000582695145 935950727 /nfs/dbraw/zinc/95/07/27/935950727.db2.gz ZPWQPNYZPDPJBS-UHFFFAOYSA-N 0 0 356.300 3.618 20 5 FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H](C)CCC[C@H]1C ZINC000158742475 935954049 /nfs/dbraw/zinc/95/40/49/935954049.db2.gz UPNQPTKEDIKQLC-UONOGXRCSA-N 0 0 366.483 3.984 20 5 FHBDRN O=C(Nc1nc2cc(C(F)(F)F)ccc2[nH]1)c1ccc([N+](=O)[O-])cc1F ZINC000178634354 935954795 /nfs/dbraw/zinc/95/47/95/935954795.db2.gz BWLYWFPHUKILPZ-UHFFFAOYSA-N 0 0 368.246 3.881 20 5 FHBDRN COCc1ccc([C@H]2CCCN2C(=O)NCc2cccc([N+](=O)[O-])c2C)o1 ZINC000480072541 935957831 /nfs/dbraw/zinc/95/78/31/935957831.db2.gz YYJODSDAGGVCKI-QGZVFWFLSA-N 0 0 373.409 3.689 20 5 FHBDRN CN(c1ncnc2ccc([N+](=O)[O-])cc21)[C@@H]1CCCN(c2ccccc2)C1 ZINC000611710240 935963591 /nfs/dbraw/zinc/96/35/91/935963591.db2.gz ZZFUBDUHULJYQW-QGZVFWFLSA-N 0 0 363.421 3.643 20 5 FHBDRN CCC(=O)c1ccc(NCc2nc3cc(C)ccc3n2C)c([N+](=O)[O-])c1 ZINC000480112387 935964306 /nfs/dbraw/zinc/96/43/06/935964306.db2.gz VXGBCGTULZTYAZ-UHFFFAOYSA-N 0 0 352.394 3.995 20 5 FHBDRN CC[C@H](CC(=O)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccccc1 ZINC000135529441 935966422 /nfs/dbraw/zinc/96/64/22/935966422.db2.gz MMBADAYFVAJESW-WBVHZDCISA-N 0 0 368.437 3.587 20 5 FHBDRN Cc1csc(-c2ccc(NC(=O)c3ccc(N)c([N+](=O)[O-])c3)cc2)n1 ZINC000725745528 935971729 /nfs/dbraw/zinc/97/17/29/935971729.db2.gz BRWOZXIBMHWCBE-UHFFFAOYSA-N 0 0 354.391 3.861 20 5 FHBDRN Cc1cc(F)cc(C(=O)NCc2ccc(NC(=O)C(C)C)cc2)c1[N+](=O)[O-] ZINC000176738147 935976710 /nfs/dbraw/zinc/97/67/10/935976710.db2.gz VZNQBPXQWCJLSY-UHFFFAOYSA-N 0 0 373.384 3.567 20 5 FHBDRN CC(C)(C)OCc1cccc(CNc2ncnc3ccc([N+](=O)[O-])cc32)c1 ZINC000611711217 935980597 /nfs/dbraw/zinc/98/05/97/935980597.db2.gz UBFYPXAMSVGWLM-UHFFFAOYSA-N 0 0 366.421 3.887 20 5 FHBDRN O=C(c1cc([O-])cc([N+](=O)[O-])c1)N1CCC[C@H]1CCCc1ccccc1 ZINC000507321174 945140917 /nfs/dbraw/zinc/14/09/17/945140917.db2.gz CDMSXAZOUDXATI-QGZVFWFLSA-N 0 0 354.406 3.928 20 5 FHBDRN COCCOc1ccc([C@@H](C)Nc2cc(C)c([N+](=O)[O-])cn2)cc1OC ZINC000074741285 935987695 /nfs/dbraw/zinc/98/76/95/935987695.db2.gz LHYAYFDMJBMOLS-CYBMUJFWSA-N 0 0 361.398 3.505 20 5 FHBDRN CC[C@H]1c2ccsc2CCN1C(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000074763966 935988402 /nfs/dbraw/zinc/98/84/02/935988402.db2.gz XHXXKSPCHUAEEE-HNNXBMFYSA-N 0 0 359.451 3.918 20 5 FHBDRN C[C@@H](Nc1ncnc2ccc([N+](=O)[O-])cc21)c1noc(-c2ccccc2)n1 ZINC000611710928 935991981 /nfs/dbraw/zinc/99/19/81/935991981.db2.gz IVHQYXOYMBLXSD-LLVKDONJSA-N 0 0 362.349 3.761 20 5 FHBDRN CCOc1cccc([C@@H]2C[C@H]2NC(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)c1 ZINC000437214133 945138195 /nfs/dbraw/zinc/13/81/95/945138195.db2.gz MFXVBIRMGIZLHS-DLBZAZTESA-N 0 0 370.405 3.596 20 5 FHBDRN CN(Cc1nc(C(F)(F)F)cs1)c1ncc([N+](=O)[O-])cc1Cl ZINC000074775721 935996386 /nfs/dbraw/zinc/99/63/86/935996386.db2.gz KSYFRBMPYQTRDZ-UHFFFAOYSA-N 0 0 352.725 3.755 20 5 FHBDRN CC(C)c1ccc(C(=O)Nc2ccc([S@](C)=O)c(F)c2)cc1[N+](=O)[O-] ZINC000187784948 935998148 /nfs/dbraw/zinc/99/81/48/935998148.db2.gz HJSKOYCALNSAIQ-VWLOTQADSA-N 0 0 364.398 3.847 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCC(CO)(c3ccccc3)CC2)c2ncccc12 ZINC000431478188 936000342 /nfs/dbraw/zinc/00/03/42/936000342.db2.gz QGQJGXJGXLHXKQ-UHFFFAOYSA-N 0 0 363.417 3.674 20 5 FHBDRN Cc1ccccc1[C@@]1(F)CCN(C(=O)NCc2ccc([N+](=O)[O-])cc2)C1 ZINC000507318371 945139522 /nfs/dbraw/zinc/13/95/22/945139522.db2.gz RFJJFOFTJAFKGF-LJQANCHMSA-N 0 0 357.385 3.684 20 5 FHBDRN O=[N+]([O-])c1ncccc1N1CCO[C@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000611763810 936045202 /nfs/dbraw/zinc/04/52/02/936045202.db2.gz OECNXNDOIHAMPS-AWEZNQCLSA-N 0 0 353.300 3.587 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H](C)Oc1ccccc1 ZINC000507322018 945142009 /nfs/dbraw/zinc/14/20/09/945142009.db2.gz BPYNUSRYSUTNFG-INIZCTEOSA-N 0 0 371.437 3.982 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCC[C@@H]2c2ccc3c(c2)OCO3)c([N+](=O)[O-])c1 ZINC000077356925 936045817 /nfs/dbraw/zinc/04/58/17/936045817.db2.gz KGHFMIGOYCRVSJ-CYBMUJFWSA-N 0 0 357.322 3.573 20 5 FHBDRN O=C1CCCc2cc(Oc3ncnc4ccc([N+](=O)[O-])cc43)ccc2N1 ZINC000611711834 936049286 /nfs/dbraw/zinc/04/92/86/936049286.db2.gz AVOJNCPUBQEOJO-UHFFFAOYSA-N 0 0 350.334 3.605 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)CSc1ccc(C)cc1 ZINC000472254512 936058343 /nfs/dbraw/zinc/05/83/43/936058343.db2.gz DBAQBRGLYWHBGE-ZDUSSCGKSA-N 0 0 360.435 3.822 20 5 FHBDRN O=[N+]([O-])c1ccc2ncnc(N3CCS[C@@H](c4ccccc4)C3)c2c1 ZINC000611713133 936064767 /nfs/dbraw/zinc/06/47/67/936064767.db2.gz XUMWOQFHGBDACK-QGZVFWFLSA-N 0 0 352.419 3.833 20 5 FHBDRN Cc1cc(NC(=O)N2CCC(Oc3ncccc3F)CC2)ccc1[N+](=O)[O-] ZINC000277871226 936065300 /nfs/dbraw/zinc/06/53/00/936065300.db2.gz BSVZZUYVFSXXNL-UHFFFAOYSA-N 0 0 374.372 3.513 20 5 FHBDRN CC(=O)N(C)c1ccc(C(=O)OCc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000785148298 936072635 /nfs/dbraw/zinc/07/26/35/936072635.db2.gz GFCLRPNKUGBGMP-UHFFFAOYSA-N 0 0 362.769 3.588 20 5 FHBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CC[C@@H]2CCCC[C@@H]21 ZINC000159235986 936084251 /nfs/dbraw/zinc/08/42/51/936084251.db2.gz APSVGXHKPOMKQL-DYEKYZERSA-N 0 0 352.818 3.807 20 5 FHBDRN O=C(C[C@H](c1cccs1)n1cccc1)NCc1cccc([N+](=O)[O-])c1 ZINC000548766632 936090330 /nfs/dbraw/zinc/09/03/30/936090330.db2.gz AHBJCACXAWCKRK-MRXNPFEDSA-N 0 0 355.419 3.754 20 5 FHBDRN CCN(Cc1c[nH]c2ccccc12)C(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000187820448 936117834 /nfs/dbraw/zinc/11/78/34/936117834.db2.gz NXIJUTWLLCLSGM-UHFFFAOYSA-N 0 0 352.394 3.808 20 5 FHBDRN CSc1ccccc1[C@@H](C)NC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000548769496 936119144 /nfs/dbraw/zinc/11/91/44/936119144.db2.gz JGVVPHGSCCGZSA-SNVBAGLBSA-N 0 0 360.391 3.536 20 5 FHBDRN Cc1noc(C)c1N(C)C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000612045933 936144572 /nfs/dbraw/zinc/14/45/72/936144572.db2.gz PEWNIZVXLJPIQN-UHFFFAOYSA-N 0 0 355.803 3.608 20 5 FHBDRN Cc1ccc(SC[C@@H](C)NC(=O)COc2ccccc2[N+](=O)[O-])cc1 ZINC000472263390 936146375 /nfs/dbraw/zinc/14/63/75/936146375.db2.gz VYEUITFYQJTYOC-CQSZACIVSA-N 0 0 360.435 3.579 20 5 FHBDRN O=C(c1cc(N2CCC[C@H]2C2CCCC2)ccc1[N+](=O)[O-])N1CCCC1 ZINC000091455888 936179381 /nfs/dbraw/zinc/17/93/81/936179381.db2.gz KHNJZFHEXTWQAT-SFHVURJKSA-N 0 0 357.454 3.990 20 5 FHBDRN COc1cccc(CC2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)c1 ZINC000612214801 936198581 /nfs/dbraw/zinc/19/85/81/936198581.db2.gz FEJHKJFUMQCUCF-UHFFFAOYSA-N 0 0 354.406 3.698 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)Nc2cccc([S@](C)=O)c2)cc1[N+](=O)[O-] ZINC000078584882 936212612 /nfs/dbraw/zinc/21/26/12/936212612.db2.gz NWSCCXKXWCCQGG-XELLLNAOSA-N 0 0 361.423 3.523 20 5 FHBDRN O=C(N[C@@H]1CCC[C@@H]1CCO)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000187850682 936215860 /nfs/dbraw/zinc/21/58/60/936215860.db2.gz LPNJMXCMANWRRY-RHSMWYFYSA-N 0 0 369.421 3.619 20 5 FHBDRN Cc1cc(N2CCC(c3nncn3C3CC3)CC2)c(Cl)cc1[N+](=O)[O-] ZINC000091483588 936227903 /nfs/dbraw/zinc/22/79/03/936227903.db2.gz ZOJWPHRMJAIBGS-UHFFFAOYSA-N 0 0 361.833 3.867 20 5 FHBDRN CC(C)CC[C@H](C)NC(=O)C(=O)Nc1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000582860946 936229514 /nfs/dbraw/zinc/22/95/14/936229514.db2.gz LNXFVCKAGATVLL-ZDUSSCGKSA-N 0 0 363.458 3.772 20 5 FHBDRN O=C1CCCN1CC[C@H]1CN(c2ccc([N+](=O)[O-])cc2)c2ccccc21 ZINC000091485400 936235074 /nfs/dbraw/zinc/23/50/74/936235074.db2.gz YHQBSHPSSNJXSY-HNNXBMFYSA-N 0 0 351.406 3.843 20 5 FHBDRN CCC1(O)CCC(Nc2ncc([N+](=O)[O-])c(C)c2Br)CC1 ZINC000612449599 936242118 /nfs/dbraw/zinc/24/21/18/936242118.db2.gz UTFIRWVLWYDEDI-UHFFFAOYSA-N 0 0 358.236 3.556 20 5 FHBDRN COC[C@@H](NC(=O)c1cc([N+](=O)[O-])c(C)s1)c1cccc(Cl)c1 ZINC000582870278 936245197 /nfs/dbraw/zinc/24/51/97/936245197.db2.gz GQLUYCYHOOZCOU-GFCCVEGCSA-N 0 0 354.815 3.736 20 5 FHBDRN Cc1cc(Cl)c(C(=O)NCc2nc(C(C)(C)C)co2)cc1[N+](=O)[O-] ZINC000889554788 936246265 /nfs/dbraw/zinc/24/62/65/936246265.db2.gz QPDDCDYAMKICJF-UHFFFAOYSA-N 0 0 351.790 3.772 20 5 FHBDRN COc1cc(F)ccc1NC(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000026025194 945151688 /nfs/dbraw/zinc/15/16/88/945151688.db2.gz SMQUTOUXPNCHPB-UHFFFAOYSA-N 0 0 369.146 3.757 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)cnc1Sc1nnc(-c2cccnc2)n1C1CC1 ZINC000153541924 936256782 /nfs/dbraw/zinc/25/67/82/936256782.db2.gz HKHFJMJIWSSPGL-UHFFFAOYSA-N 0 0 374.813 3.783 20 5 FHBDRN Cn1c(C(=O)Nc2ccc(OCc3ccccc3)cc2)ccc1[N+](=O)[O-] ZINC000612518253 936261590 /nfs/dbraw/zinc/26/15/90/936261590.db2.gz JVFMZYGWBKUBTJ-UHFFFAOYSA-N 0 0 351.362 3.765 20 5 FHBDRN COc1ccc(NC(=O)c2c([N+](=O)[O-])cccc2C(F)(F)F)cc1OC ZINC000612517148 936261630 /nfs/dbraw/zinc/26/16/30/936261630.db2.gz YVGWJGLNEJULJR-UHFFFAOYSA-N 0 0 370.283 3.883 20 5 FHBDRN CCOc1ccc([C@@H]2C[C@H]2NC(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)cc1 ZINC000437230391 945152944 /nfs/dbraw/zinc/15/29/44/945152944.db2.gz BXRCQPYFLPZLJG-WMLDXEAASA-N 0 0 365.389 3.761 20 5 FHBDRN C[C@@H](C(=O)N[C@@H]1CCN(c2ccc(Cl)cc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000516696898 945153378 /nfs/dbraw/zinc/15/33/78/945153378.db2.gz HYTFIWSFXJQGKO-CZUORRHYSA-N 0 0 373.840 3.747 20 5 FHBDRN COc1ccc(-n2ccc(CN[C@H](C)c3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000178712849 936279427 /nfs/dbraw/zinc/27/94/27/936279427.db2.gz LFFZZQGSPMFUBQ-CQSZACIVSA-N 0 0 352.394 3.640 20 5 FHBDRN C[C@@H](CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)Cc1cccs1 ZINC000135846509 936285264 /nfs/dbraw/zinc/28/52/64/936285264.db2.gz NTHURUVUIUDWQK-GFCCVEGCSA-N 0 0 357.435 3.675 20 5 FHBDRN O=C(c1scnc1C1CCCC1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000612686460 936307597 /nfs/dbraw/zinc/30/75/97/936307597.db2.gz AEAHMRYPYPDKFG-UHFFFAOYSA-N 0 0 357.435 3.907 20 5 FHBDRN CC(C)NC(=O)c1ccc(Cl)c(NC(=O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000047407459 945157692 /nfs/dbraw/zinc/15/76/92/945157692.db2.gz QXUSKSCKKYSFSI-UHFFFAOYSA-N 0 0 361.785 3.639 20 5 FHBDRN CCCOc1cccc(NC(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)c1 ZINC000124142454 945157891 /nfs/dbraw/zinc/15/78/91/945157891.db2.gz VQRMHOCDNFPVJF-UHFFFAOYSA-N 0 0 355.394 3.974 20 5 FHBDRN Cn1cc(-c2noc(/C=C/c3ccc([N+](=O)[O-])cc3)n2)c(C(F)(F)F)n1 ZINC000426208991 945159663 /nfs/dbraw/zinc/15/96/63/945159663.db2.gz GKBHDBQIOBULBG-QPJJXVBHSA-N 0 0 365.271 3.568 20 5 FHBDRN CCc1nc(CN(C)C(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)cs1 ZINC000514923083 938262634 /nfs/dbraw/zinc/26/26/34/938262634.db2.gz KEXVATDLHHOYAN-UHFFFAOYSA-N 0 0 373.356 3.905 20 5 FHBDRN Cc1ccc2nc(C)c(C(=O)N3CCc4c(cccc4[N+](=O)[O-])C3)cc2c1 ZINC000536043729 938270300 /nfs/dbraw/zinc/27/03/00/938270300.db2.gz LCLUCOVGMLYZFF-UHFFFAOYSA-N 0 0 361.401 3.958 20 5 FHBDRN COc1cc(C)c([C@H](C)NC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)cc1OC ZINC000046596554 938276803 /nfs/dbraw/zinc/27/68/03/938276803.db2.gz MMYFYODCJAUOPA-RNVIBTMRSA-N 0 0 370.405 3.811 20 5 FHBDRN O=C(CCn1cc([N+](=O)[O-])cn1)Nc1ccc(Oc2ccccc2)cc1 ZINC000065633873 938278565 /nfs/dbraw/zinc/27/85/65/938278565.db2.gz UZFUHQVNQSPLFK-UHFFFAOYSA-N 0 0 352.350 3.612 20 5 FHBDRN O=C(Nc1ccc2c(c1)CCCO2)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000536059575 938289809 /nfs/dbraw/zinc/28/98/09/938289809.db2.gz MNSZTHZTWLCUIR-UHFFFAOYSA-N 0 0 353.378 3.510 20 5 FHBDRN CC(C)COc1ccc(CC(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)cc1 ZINC000536063852 938296582 /nfs/dbraw/zinc/29/65/82/938296582.db2.gz IUFOYABJJWKCFF-UHFFFAOYSA-N 0 0 368.433 3.757 20 5 FHBDRN C[C@@H](O)CCCNC(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000278838917 945163374 /nfs/dbraw/zinc/16/33/74/945163374.db2.gz PKAQMEYCZFSFMJ-CYBMUJFWSA-N 0 0 359.382 3.670 20 5 FHBDRN CCCOc1ccc(NC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)cc1Cl ZINC000102235353 938302611 /nfs/dbraw/zinc/30/26/11/938302611.db2.gz GTFRCVMZXDLWFF-UHFFFAOYSA-N 0 0 366.805 3.607 20 5 FHBDRN O=C(NCCCc1ccccn1)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000458588877 938303240 /nfs/dbraw/zinc/30/32/40/938303240.db2.gz WOJPIGFIOSHVGW-KRWDZBQOSA-N 0 0 368.437 3.512 20 5 FHBDRN C[C@@H](c1ccc2ccccc2c1)N(C(=O)c1cc([N+](=O)[O-])n[nH]1)C1CC1 ZINC000506736586 945164150 /nfs/dbraw/zinc/16/41/50/945164150.db2.gz RHAOEZJKCGUGOQ-LBPRGKRZSA-N 0 0 350.378 3.837 20 5 FHBDRN CN(C(N)=O)c1cccc(N[C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])c1 ZINC000426552215 945164170 /nfs/dbraw/zinc/16/41/70/945164170.db2.gz IZMJBYBGAWTFGN-KDOFPFPSSA-N 0 0 368.437 3.933 20 5 FHBDRN CCc1c(NCc2ccc([N+](=O)[O-])c(OC)c2)cnn1-c1ccccc1 ZINC000583604873 938318704 /nfs/dbraw/zinc/31/87/04/938318704.db2.gz ZICIBRNZMHYUDQ-UHFFFAOYSA-N 0 0 352.394 3.964 20 5 FHBDRN Cc1ccc(NC(=O)[C@@H](OC2CCOCC2)c2ccccc2)cc1[N+](=O)[O-] ZINC000536085272 938319978 /nfs/dbraw/zinc/31/99/78/938319978.db2.gz RCYCYTXZQRLRCY-IBGZPJMESA-N 0 0 370.405 3.779 20 5 FHBDRN CCOc1ccccc1CN(C)c1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-] ZINC000052472426 938322759 /nfs/dbraw/zinc/32/27/59/938322759.db2.gz AUKUWHPWLGYYLG-UHFFFAOYSA-N 0 0 369.421 3.522 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N[C@@H](c1ccccc1F)[C@@H](C)O ZINC000583634255 938329233 /nfs/dbraw/zinc/32/92/33/938329233.db2.gz PJYMEUIVIDECCC-SJKOYZFVSA-N 0 0 361.373 3.594 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)N(C)[C@H](C)c2ccc(Cl)c(Cl)c2)n1 ZINC000427182480 945165495 /nfs/dbraw/zinc/16/54/95/945165495.db2.gz PDDXHLRMVRAHLX-SECBINFHSA-N 0 0 371.224 3.951 20 5 FHBDRN C[C@H](NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)c1c(F)cccc1F ZINC000536091317 938333933 /nfs/dbraw/zinc/33/39/33/938333933.db2.gz YOKPUHYKTQUWNY-JTQLQIEISA-N 0 0 359.332 3.774 20 5 FHBDRN CN(Cc1cccnc1)c1cc(C(F)(F)C(F)(F)F)ncc1[N+](=O)[O-] ZINC000278358761 938337563 /nfs/dbraw/zinc/33/75/63/938337563.db2.gz CTOYXOJQCKISHI-UHFFFAOYSA-N 0 0 362.258 3.675 20 5 FHBDRN Cc1nc2nc(Sc3ccc([N+](=O)[O-])c4cnccc34)nn2c(C)c1C ZINC000052487936 938339033 /nfs/dbraw/zinc/33/90/33/938339033.db2.gz LESHGOIMBZEWMC-UHFFFAOYSA-N 0 0 366.406 3.657 20 5 FHBDRN CC[C@@H](NC(=O)NCCc1ccccc1[N+](=O)[O-])c1ccc(OC)cc1 ZINC000075109367 938341877 /nfs/dbraw/zinc/34/18/77/938341877.db2.gz YJGDONKIEWGQJE-QGZVFWFLSA-N 0 0 357.410 3.596 20 5 FHBDRN CC(C)Oc1ccccc1[C@H](C)NC(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000536094613 938341908 /nfs/dbraw/zinc/34/19/08/938341908.db2.gz GPJYJKOHKRCVOV-HNNXBMFYSA-N 0 0 371.437 3.985 20 5 FHBDRN CC(C)Oc1ccccc1[C@@H](C)NC(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000536094616 938342099 /nfs/dbraw/zinc/34/20/99/938342099.db2.gz GPJYJKOHKRCVOV-OAHLLOKOSA-N 0 0 371.437 3.985 20 5 FHBDRN COc1cccc(-c2nc([C@@H]3CCN(C)c4ccccc43)no2)c1[N+](=O)[O-] ZINC000583659236 938343291 /nfs/dbraw/zinc/34/32/91/938343291.db2.gz KXKQAHPAEMWUSE-CYBMUJFWSA-N 0 0 366.377 3.625 20 5 FHBDRN C[C@@H](NC(=O)NC1(Cc2ccc(F)cc2)CC1)c1ccccc1[N+](=O)[O-] ZINC000458627542 938344575 /nfs/dbraw/zinc/34/45/75/938344575.db2.gz WCGDFJSMOXSYRK-CYBMUJFWSA-N 0 0 357.385 3.869 20 5 FHBDRN COc1ccc(C[C@H](C)CNC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000536097195 938348996 /nfs/dbraw/zinc/34/89/96/938348996.db2.gz ZOUVZSCIZWOIFQ-GJZGRUSLSA-N 0 0 371.437 3.842 20 5 FHBDRN Cc1cc(NC(=O)COc2ccccc2F)c2cc([N+](=O)[O-])ccc2n1 ZINC000161831621 938363573 /nfs/dbraw/zinc/36/35/73/938363573.db2.gz GCZJYCQHYQURGL-UHFFFAOYSA-N 0 0 355.325 3.608 20 5 FHBDRN CC(C)[C@@H]1CCC[C@@H](NS(=O)(=O)CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC001211594598 938366704 /nfs/dbraw/zinc/36/67/04/938366704.db2.gz IUJBLBCFQQRRFZ-IAGOWNOFSA-N 0 0 368.499 3.662 20 5 FHBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@H](c2ccccc2)C2CCCC2)cc1 ZINC000519162272 945169110 /nfs/dbraw/zinc/16/91/10/945169110.db2.gz YWGJQTHMLVKEPI-GOSISDBHSA-N 0 0 360.435 3.805 20 5 FHBDRN CC(C)(C)OC(=O)c1ccc(C(=O)NCCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000536114854 938379424 /nfs/dbraw/zinc/37/94/24/938379424.db2.gz YMUYWCCLBOTNRJ-UHFFFAOYSA-N 0 0 370.405 3.523 20 5 FHBDRN C[C@H]1OCC[C@H]1Sc1cc(C(F)(F)C(F)(F)F)ncc1[N+](=O)[O-] ZINC000278396529 938381758 /nfs/dbraw/zinc/38/17/58/938381758.db2.gz GHRXBPMVIICGHT-HTRCEHHLSA-N 0 0 358.288 3.913 20 5 FHBDRN C[C@@H]1OCC[C@@H]1Sc1cc(C(F)(F)C(F)(F)F)ncc1[N+](=O)[O-] ZINC000278396556 938381933 /nfs/dbraw/zinc/38/19/33/938381933.db2.gz GHRXBPMVIICGHT-XPUUQOCRSA-N 0 0 358.288 3.913 20 5 FHBDRN CC[C@H](C)c1nnc([C@H](C)NC(=O)c2c(C)cc(Cl)cc2[N+](=O)[O-])[nH]1 ZINC000278408808 938394985 /nfs/dbraw/zinc/39/49/85/938394985.db2.gz YJPCCWPQNCFQQN-WPRPVWTQSA-N 0 0 365.821 3.679 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)C(F)(F)F)cc1S[C@@H]1CCCOC1 ZINC000278418964 938405982 /nfs/dbraw/zinc/40/59/82/938405982.db2.gz IITGRDZXWFSJHP-SSDOTTSWSA-N 0 0 358.288 3.915 20 5 FHBDRN CCCOc1cc(NC(=O)[C@H]2CCO[C@@H]2C)c([N+](=O)[O-])cc1OCCC ZINC000536125140 938406720 /nfs/dbraw/zinc/40/67/20/938406720.db2.gz FMKXRKIWOMTWMV-OLZOCXBDSA-N 0 0 366.414 3.536 20 5 FHBDRN CCCOc1cc(NC(=O)[C@@H]2CCO[C@@H]2C)c([N+](=O)[O-])cc1OCCC ZINC000536125139 938406764 /nfs/dbraw/zinc/40/67/64/938406764.db2.gz FMKXRKIWOMTWMV-CHWSQXEVSA-N 0 0 366.414 3.536 20 5 FHBDRN C[C@H](NC(=O)N(C)CCc1cccc([N+](=O)[O-])c1)c1cccc(F)c1F ZINC000511808203 945173029 /nfs/dbraw/zinc/17/30/29/945173029.db2.gz PNMUBFDLXNZJMQ-LBPRGKRZSA-N 0 0 363.364 3.818 20 5 FHBDRN Cc1ccc(NCCc2ccc([N+](=O)[O-])cc2)cc1-c1nnnn1C1CC1 ZINC000583804988 938420478 /nfs/dbraw/zinc/42/04/78/938420478.db2.gz LPDTWSPPMYRXAP-UHFFFAOYSA-N 0 0 364.409 3.546 20 5 FHBDRN C[C@@](NC(=O)Cc1ccccc1[N+](=O)[O-])(c1ccccc1)C(F)(F)F ZINC000536137266 938430757 /nfs/dbraw/zinc/43/07/57/938430757.db2.gz ZICYUMMYLJPEEK-MRXNPFEDSA-N 0 0 352.312 3.731 20 5 FHBDRN CC1(C)Cc2cc(NC(=O)Cc3c(F)cc([N+](=O)[O-])cc3F)ccc2O1 ZINC000583835282 938439373 /nfs/dbraw/zinc/43/93/73/938439373.db2.gz XLTPTQQAOBBCIE-UHFFFAOYSA-N 0 0 362.332 3.768 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)cnc1N[C@H](CO)c1ccc(C(F)(F)F)cc1 ZINC000536142770 938445263 /nfs/dbraw/zinc/44/52/63/938445263.db2.gz SEBFPBOAGAVSRG-LLVKDONJSA-N 0 0 361.707 3.808 20 5 FHBDRN O=C(c1csc([N+](=O)[O-])c1)N1CCC[C@@H](c2nc3ccccc3o2)C1 ZINC000052620920 938447119 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0 0 367.336 3.982 20 5 FHBDRN COC(=O)c1c(C)csc1NC(=O)c1cc(SC)ccc1[N+](=O)[O-] ZINC000584375119 938778877 /nfs/dbraw/zinc/77/88/77/938778877.db2.gz DKWNCFBGRQYZSH-UHFFFAOYSA-N 0 0 366.420 3.726 20 5 FHBDRN O=[N+]([O-])c1cc(F)cc(Oc2ncc(Br)cc2[N+](=O)[O-])c1 ZINC000135531092 938781988 /nfs/dbraw/zinc/78/19/88/938781988.db2.gz LWMMEILJGHLSIJ-UHFFFAOYSA-N 0 0 358.079 3.592 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]c(N3CCC[C@@H]3c3ccc4c(c3)OCCO4)nc2c1 ZINC000584387179 938796689 /nfs/dbraw/zinc/79/66/89/938796689.db2.gz GRHDTSPWLBZSSQ-MRXNPFEDSA-N 0 0 366.377 3.584 20 5 FHBDRN CCS[C@H]1CCCC[C@H]1NC(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000427212924 945206428 /nfs/dbraw/zinc/20/64/28/945206428.db2.gz OFIRKTABLPFSRP-ZBFHGGJFSA-N 0 0 351.472 3.577 20 5 FHBDRN CCC1CCN(C(=O)c2cc([N+](=O)[O-])cc(Br)c2C)CC1 ZINC000573225078 938818047 /nfs/dbraw/zinc/81/80/47/938818047.db2.gz LWUMGUYJIDTCJH-UHFFFAOYSA-N 0 0 355.232 3.928 20 5 FHBDRN Cc1cc(Oc2ncnc3c2cnn3-c2ccccc2)c(F)cc1[N+](=O)[O-] ZINC000480310994 938831469 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/nfs/dbraw/zinc/88/94/36/939889436.db2.gz VASBVWVWELYRAT-UHFFFAOYSA-N 0 0 370.453 3.575 20 5 FHBDRN O=C(NCc1nccc2ccccc21)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000179566643 939889505 /nfs/dbraw/zinc/88/95/05/939889505.db2.gz AGWSXDWVGPNFDP-UHFFFAOYSA-N 0 0 358.357 3.621 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H](C)c1cccc(F)c1F ZINC000179600894 939896716 /nfs/dbraw/zinc/89/67/16/939896716.db2.gz HVGXRBCSLGKONH-VIFPVBQESA-N 0 0 351.309 3.764 20 5 FHBDRN CSc1ccccc1[C@@H](C)NC(=O)CN(C)c1ccccc1[N+](=O)[O-] ZINC000410263494 939904966 /nfs/dbraw/zinc/90/49/66/939904966.db2.gz HPKXXSRBSFTMAE-CYBMUJFWSA-N 0 0 359.451 3.630 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)Cc1cc(F)ccc1Br ZINC000136256658 939906014 /nfs/dbraw/zinc/90/60/14/939906014.db2.gz LBPQDQNALJKTNG-UHFFFAOYSA-N 0 0 367.174 3.986 20 5 FHBDRN O=C(N[C@@H]1C[C@H]1c1cccc(F)c1)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000179670588 939913266 /nfs/dbraw/zinc/91/32/66/939913266.db2.gz FHOCICXJJGMCCY-JKSUJKDBSA-N 0 0 351.337 3.568 20 5 FHBDRN CSc1cccc(C(=O)Nc2nc(-c3ccccc3)c[nH]2)c1[N+](=O)[O-] ZINC000614459188 939913868 /nfs/dbraw/zinc/91/38/68/939913868.db2.gz GBRRKKMUBFEJBS-UHFFFAOYSA-N 0 0 354.391 3.959 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1)N1CCC(Sc2ccccn2)CC1 ZINC000364288744 939917422 /nfs/dbraw/zinc/91/74/22/939917422.db2.gz UBGXYVDLNPVJLP-UHFFFAOYSA-N 0 0 358.423 3.778 20 5 FHBDRN Cc1c(Br)cc(C(=O)N2CC[C@@H]3CCC[C@@H]32)cc1[N+](=O)[O-] ZINC000614644620 939919585 /nfs/dbraw/zinc/91/95/85/939919585.db2.gz CFOJAQZEOUQODM-GWCFXTLKSA-N 0 0 353.216 3.680 20 5 FHBDRN O=[N+]([O-])c1cnn([C@H]2CCCN(Cc3ccc(CSC(F)F)o3)C2)c1 ZINC000364330435 939919590 /nfs/dbraw/zinc/91/95/90/939919590.db2.gz VMRLRZLECISQTQ-NSHDSACASA-N 0 0 372.397 3.677 20 5 FHBDRN COc1cc(C(=O)N(C)[C@@H](C)Cc2ccc(C)cc2)c([N+](=O)[O-])cc1F ZINC000410496134 939922059 /nfs/dbraw/zinc/92/20/59/939922059.db2.gz CTNNLNMYQNSNIW-ZDUSSCGKSA-N 0 0 360.385 3.754 20 5 FHBDRN CC1(C)[C@H](O)C[C@H]1NC(=O)c1cc([N+](=O)[O-])ccc1SC1CCCC1 ZINC000614665963 939923816 /nfs/dbraw/zinc/92/38/16/939923816.db2.gz QQRMYDPZRPKCKG-HZPDHXFCSA-N 0 0 364.467 3.519 20 5 FHBDRN O=C(N[C@H]1CCOc2ccc(F)cc21)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000179759330 939931336 /nfs/dbraw/zinc/93/13/36/939931336.db2.gz DMHMLDAYTOVMDF-HNNXBMFYSA-N 0 0 367.336 3.536 20 5 FHBDRN Cc1cnc([C@H]2CCCN(Cc3nc4cc([N+](=O)[O-])ccc4o3)C2)s1 ZINC000364384784 939936166 /nfs/dbraw/zinc/93/61/66/939936166.db2.gz NGGGNRVOTHCWIW-LBPRGKRZSA-N 0 0 358.423 3.881 20 5 FHBDRN Cc1cc(OCC(=O)NCCCc2c[nH]c3ccccc23)ccc1[N+](=O)[O-] ZINC000431641924 939940979 /nfs/dbraw/zinc/94/09/79/939940979.db2.gz XWJJOJCQUMNQPT-UHFFFAOYSA-N 0 0 367.405 3.512 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC(c2c[nH]nc2C)CC1 ZINC000375826255 939948527 /nfs/dbraw/zinc/94/85/27/939948527.db2.gz STZHIFTXAJKZII-UHFFFAOYSA-N 0 0 374.466 3.758 20 5 FHBDRN Cc1ccc(-c2nc(CCNC(=O)c3cccc(C)c3[N+](=O)[O-])co2)cc1 ZINC000364482043 939950802 /nfs/dbraw/zinc/95/08/02/939950802.db2.gz JTBLRZKLBWXQFN-UHFFFAOYSA-N 0 0 365.389 3.839 20 5 FHBDRN COCCN(C(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F)[C@@H]1CC[C@@H](C)C1 ZINC000410758662 939953304 /nfs/dbraw/zinc/95/33/04/939953304.db2.gz DTRBHSFUAIEACH-VXGBXAGGSA-N 0 0 374.359 3.891 20 5 FHBDRN COCCN(C(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-])[C@H]1CCC[C@@H]1C ZINC000410765835 939954991 /nfs/dbraw/zinc/95/49/91/939954991.db2.gz YAFFNYQWTQCJPU-FZMZJTMJSA-N 0 0 374.359 3.891 20 5 FHBDRN CCc1nccn1C[C@@H]1CCCN1C(=O)Nc1cc(C)c([N+](=O)[O-])cc1C ZINC000364539652 939961128 /nfs/dbraw/zinc/96/11/28/939961128.db2.gz QBAFGPSLTRLUPO-HNNXBMFYSA-N 0 0 371.441 3.667 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C ZINC000410877957 939969228 /nfs/dbraw/zinc/96/92/28/939969228.db2.gz UELNTKLKZKLWJS-INIZCTEOSA-N 0 0 363.458 3.673 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@H]1CCC(=O)N(C)[C@@H]1c1cccs1 ZINC000364619410 939972133 /nfs/dbraw/zinc/97/21/33/939972133.db2.gz CJILENPUOAABDP-GUYCJALGSA-N 0 0 373.434 3.513 20 5 FHBDRN COc1cccc(C(=O)N2CC3(CCC3)[C@@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000410965222 939976337 /nfs/dbraw/zinc/97/63/37/939976337.db2.gz POHHFYHTOMIOBZ-SFHVURJKSA-N 0 0 352.390 3.971 20 5 FHBDRN COc1cccc(C(=O)N2C[C@H]3CCCCN3c3ccccc32)c1[N+](=O)[O-] ZINC000411014522 939985978 /nfs/dbraw/zinc/98/59/78/939985978.db2.gz PITSJDFXXAKUQG-CQSZACIVSA-N 0 0 367.405 3.623 20 5 FHBDRN Cc1cccc(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)c1[N+](=O)[O-] ZINC000411023421 939987684 /nfs/dbraw/zinc/98/76/84/939987684.db2.gz YJCVFLWQKVHAHO-HNNXBMFYSA-N 0 0 351.406 3.923 20 5 FHBDRN Cc1nnc([C@@H](C)OC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)o1 ZINC000062277825 939998245 /nfs/dbraw/zinc/99/82/45/939998245.db2.gz KPBLJHYWEQEJGE-LLVKDONJSA-N 0 0 369.333 3.997 20 5 FHBDRN CCOC[C@H]1CCCCN1C(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000411110333 939998634 /nfs/dbraw/zinc/99/86/34/939998634.db2.gz OAZYDKMKQYYEHJ-GFCCVEGCSA-N 0 0 360.332 3.645 20 5 FHBDRN COc1cc(C(=O)N2[C@@H](C)CCC2(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000411095401 940000979 /nfs/dbraw/zinc/00/09/79/940000979.db2.gz YTNSSTOJUVUFQW-VIFPVBQESA-N 0 0 358.341 3.608 20 5 FHBDRN COc1cc(C(=O)N[C@](C)(Cc2ccccc2)C2CC2)c([N+](=O)[O-])cc1F ZINC000411095420 940000998 /nfs/dbraw/zinc/00/09/98/940000998.db2.gz QNCXLBUYAMORJM-HXUWFJFHSA-N 0 0 372.396 3.884 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)C(=O)N[C@H](c1ccccc1)C(C)C ZINC000411143849 940003262 /nfs/dbraw/zinc/00/32/62/940003262.db2.gz ZLFRSEGFWCNDAD-SFHVURJKSA-N 0 0 369.421 3.664 20 5 FHBDRN O=C(NCCCSc1ccccc1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000411159886 940004825 /nfs/dbraw/zinc/00/48/25/940004825.db2.gz ABWLZHOIPSMHDV-ZWKOTPCHSA-N 0 0 356.447 3.997 20 5 FHBDRN Cc1nc(-c2ccc(NC(=O)CNc3ccccc3[N+](=O)[O-])cc2)oc1C ZINC000065875138 940005361 /nfs/dbraw/zinc/00/53/61/940005361.db2.gz VUDPENLXEXIYCW-UHFFFAOYSA-N 0 0 366.377 3.917 20 5 FHBDRN CC(C)(CNC(=O)c1cc(F)cc([N+](=O)[O-])c1N)c1ccc(Cl)cc1 ZINC000516537301 940006076 /nfs/dbraw/zinc/00/60/76/940006076.db2.gz SGFHMFHFRPPSCA-UHFFFAOYSA-N 0 0 365.792 3.677 20 5 FHBDRN COc1ccc(OCc2nnc(-c3cccc(Cl)c3)o2)c([N+](=O)[O-])c1 ZINC000106435750 945288844 /nfs/dbraw/zinc/28/88/44/945288844.db2.gz KAXNDTOUGWOJAW-UHFFFAOYSA-N 0 0 361.741 3.886 20 5 FHBDRN CCc1ccc(C(=O)N2CCCC[C@H]2c2noc(C3CC3)n2)cc1[N+](=O)[O-] ZINC000375878933 940007871 /nfs/dbraw/zinc/00/78/71/940007871.db2.gz WLVKGHWGHPCITN-HNNXBMFYSA-N 0 0 370.409 3.785 20 5 FHBDRN Cc1cc(NC(=O)C(=O)N(Cc2ccccc2)CC(C)C)ccc1[N+](=O)[O-] ZINC000411198377 940012918 /nfs/dbraw/zinc/01/29/18/940012918.db2.gz IGFPRSWUNIOAMG-UHFFFAOYSA-N 0 0 369.421 3.527 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N[C@H](C)CCc1ccc(O)cc1 ZINC000179862774 940013971 /nfs/dbraw/zinc/01/39/71/940013971.db2.gz LWNYGMPYRWEPMZ-CQSZACIVSA-N 0 0 356.422 3.977 20 5 FHBDRN Cc1cccc([C@@H]2CCCN2C(=O)CCCNc2ccc([N+](=O)[O-])cc2)n1 ZINC000167353188 940016059 /nfs/dbraw/zinc/01/60/59/940016059.db2.gz MVHJECCVKYHPEK-IBGZPJMESA-N 0 0 368.437 3.854 20 5 FHBDRN CC[C@@H](NC(=O)CNc1ccccc1[N+](=O)[O-])c1ccc(Cl)s1 ZINC000511857671 945290725 /nfs/dbraw/zinc/29/07/25/945290725.db2.gz GWUAKTVYBOHNSN-SNVBAGLBSA-N 0 0 353.831 3.989 20 5 FHBDRN C[C@H](C(=O)NCc1ncoc1-c1ccccc1)c1ccc([N+](=O)[O-])cc1F ZINC000364965514 940029512 /nfs/dbraw/zinc/02/95/12/940029512.db2.gz UMPOSQLKVOBMNH-LBPRGKRZSA-N 0 0 369.352 3.809 20 5 FHBDRN COc1ccc([C@H](NC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)C2CC2)cc1 ZINC000411328692 940031413 /nfs/dbraw/zinc/03/14/13/940031413.db2.gz PSEXOGOBRBFIKV-XUVXKRRUSA-N 0 0 366.417 3.974 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)N(Cc2ccccc2)[C@@H](C)C(C)(C)C)n1 ZINC000427333425 945291070 /nfs/dbraw/zinc/29/10/70/945291070.db2.gz ZBSBWUSGNFLNGN-AWEZNQCLSA-N 0 0 358.442 3.888 20 5 FHBDRN COCc1cccc(NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1 ZINC000136567580 940032670 /nfs/dbraw/zinc/03/26/70/940032670.db2.gz WGQSSGICPUFYIH-UHFFFAOYSA-N 0 0 355.394 3.938 20 5 FHBDRN CSc1ccc(C(=O)N[C@H](C)c2nc3ccccc3n2C)cc1[N+](=O)[O-] ZINC000136567984 940033664 /nfs/dbraw/zinc/03/36/64/940033664.db2.gz AVCZAWQWKSPZQJ-LLVKDONJSA-N 0 0 370.434 3.694 20 5 FHBDRN CCC1CCC(N(C)C(=O)Cc2c(F)c(OC)ccc2[N+](=O)[O-])CC1 ZINC000411358122 940035898 /nfs/dbraw/zinc/03/58/98/940035898.db2.gz SPOFSPDZOYITHQ-UHFFFAOYSA-N 0 0 352.406 3.712 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)C(=O)NCCC1=CCCCCC1 ZINC000411370242 940036639 /nfs/dbraw/zinc/03/66/39/940036639.db2.gz STLYQUATYQQQEL-UHFFFAOYSA-N 0 0 359.426 3.547 20 5 FHBDRN O=C(Nc1nc(C(F)(F)F)cs1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000411388846 940041199 /nfs/dbraw/zinc/04/11/99/940041199.db2.gz VCTFRUPFWUTXRQ-VHSXEESVSA-N 0 0 357.313 3.812 20 5 FHBDRN CN(CCCc1nc2ccccc2[nH]1)C(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000065900565 940043656 /nfs/dbraw/zinc/04/36/56/940043656.db2.gz FRKWUAMSBWTYRB-UHFFFAOYSA-N 0 0 372.812 3.829 20 5 FHBDRN O=C(N[C@@H]1C[C@H]1c1ccc(Cl)c(F)c1)c1ccc(F)cc1[N+](=O)[O-] ZINC000437388257 945293698 /nfs/dbraw/zinc/29/36/98/945293698.db2.gz SEWSTNJIJFGLLA-SMDDNHRTSA-N 0 0 352.724 3.812 20 5 FHBDRN Cc1c(Br)c(N2CC[C@H](c3ccco3)C2)ncc1[N+](=O)[O-] ZINC000612444403 940072033 /nfs/dbraw/zinc/07/20/33/940072033.db2.gz QOOPSFMHTXCRKL-JTQLQIEISA-N 0 0 352.188 3.648 20 5 FHBDRN COc1ccc(S(=O)(=O)Nc2cccc(C(C)(F)F)c2)cc1[N+](=O)[O-] ZINC000188563644 940077374 /nfs/dbraw/zinc/07/73/74/940077374.db2.gz JTPNINDFVVQATA-UHFFFAOYSA-N 0 0 372.349 3.516 20 5 FHBDRN O=C(N[C@@H](c1ccc(F)cc1)c1cccnc1)c1ccc([N+](=O)[O-])cc1F ZINC000365188163 940079229 /nfs/dbraw/zinc/07/92/29/940079229.db2.gz QQXOEYTVSJJQLD-SFHVURJKSA-N 0 0 369.327 3.787 20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])N[C@@H]1CCCOc2c(F)cccc21 ZINC000179884781 940082954 /nfs/dbraw/zinc/08/29/54/940082954.db2.gz WCLLBDYWCISHRG-OAHLLOKOSA-N 0 0 373.384 3.566 20 5 FHBDRN O=[N+]([O-])c1ccc(NC[C@H](c2ccc(Cl)cc2)N2CCOCC2)cc1 ZINC000065945894 940087129 /nfs/dbraw/zinc/08/71/29/940087129.db2.gz PQDVQNCMKDHQTQ-GOSISDBHSA-N 0 0 361.829 3.734 20 5 FHBDRN Cc1ccc(Br)cc1CNC(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000188564240 940088565 /nfs/dbraw/zinc/08/85/65/940088565.db2.gz VIBJWMQTBBCAND-UHFFFAOYSA-N 0 0 363.211 3.525 20 5 FHBDRN CCc1ccc([C@@H](C)NC(=O)CN(C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000548935343 940104021 /nfs/dbraw/zinc/10/40/21/940104021.db2.gz JJLHBXLEMQMQEZ-MRXNPFEDSA-N 0 0 369.465 3.509 20 5 FHBDRN Cc1ccc(F)cc1NC(=O)[C@H](C)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000548935140 940106417 /nfs/dbraw/zinc/10/64/17/940106417.db2.gz DKCRVUMOOHZXID-AWEZNQCLSA-N 0 0 359.401 3.544 20 5 FHBDRN CCc1ccc(-c2csc(NC(=O)c3ccc([N+](=O)[O-])n3C)n2)cc1 ZINC000612511678 940114854 /nfs/dbraw/zinc/11/48/54/940114854.db2.gz XFPOWMJDVIIWLS-UHFFFAOYSA-N 0 0 356.407 3.872 20 5 FHBDRN COc1ccc(-c2nc(COc3cc([N+](=O)[O-])ccc3Cl)no2)cc1 ZINC000177335835 940122625 /nfs/dbraw/zinc/12/26/25/940122625.db2.gz YYGGDRVYGUBVFT-UHFFFAOYSA-N 0 0 361.741 3.886 20 5 FHBDRN COc1ccc(F)cc1[C@H](C)NCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000179922085 940129161 /nfs/dbraw/zinc/12/91/61/940129161.db2.gz WDBANPTZVXNKDN-NSHDSACASA-N 0 0 372.356 3.643 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H](C)c1nc(C(F)(F)F)cs1 ZINC000278798636 940129174 /nfs/dbraw/zinc/12/91/74/940129174.db2.gz RFWFUNQOXODIFK-QMMMGPOBSA-N 0 0 359.329 3.870 20 5 FHBDRN C[C@@H](C(=O)N1CCC(n2ccc([N+](=O)[O-])n2)CC1)c1cc2ccccc2o1 ZINC000365356722 940130265 /nfs/dbraw/zinc/13/02/65/940130265.db2.gz BAMVBFCRHRWMBC-CYBMUJFWSA-N 0 0 368.393 3.505 20 5 FHBDRN Cn1c(C(=O)Nc2ccc(-c3cn4ccsc4n3)cc2)ccc1[N+](=O)[O-] ZINC000612556379 940143106 /nfs/dbraw/zinc/14/31/06/940143106.db2.gz BEMJJHRQOYWSFV-UHFFFAOYSA-N 0 0 367.390 3.562 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2nc(CN3C[C@@H](O)C[C@H]3c3ccccc3)co2)cc1 ZINC000411919077 940157131 /nfs/dbraw/zinc/15/71/31/940157131.db2.gz DSBBPKQLTBTBGY-OALUTQOASA-N 0 0 365.389 3.558 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)NC1CCN(c2cccs2)CC1 ZINC000128297339 940164153 /nfs/dbraw/zinc/16/41/53/940164153.db2.gz FCOIWWBGKYXHJE-UHFFFAOYSA-N 0 0 360.439 3.755 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N(Cc1ccccc1)[C@@H](CO)C1CC1 ZINC000179957057 940169518 /nfs/dbraw/zinc/16/95/18/940169518.db2.gz NNUOZKVGUVYKMK-IBGZPJMESA-N 0 0 369.421 3.708 20 5 FHBDRN O=C(Cn1ccc2ccccc21)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000540893402 940169841 /nfs/dbraw/zinc/16/98/41/940169841.db2.gz ZBLYHXCKUBZCBC-UHFFFAOYSA-N 0 0 357.797 3.562 20 5 FHBDRN Cc1c(Br)cc(C(=O)Nc2ncccc2Cl)cc1[N+](=O)[O-] ZINC000179964196 940174722 /nfs/dbraw/zinc/17/47/22/940174722.db2.gz QWGPBOGXEOWAQB-UHFFFAOYSA-N 0 0 370.590 3.966 20 5 FHBDRN Cc1ccc(Cl)c(OC[C@H](O)COc2cc(F)cc([N+](=O)[O-])c2)c1 ZINC000612605171 940175838 /nfs/dbraw/zinc/17/58/38/940175838.db2.gz GVYIPTFGRUSRMO-CYBMUJFWSA-N 0 0 355.749 3.514 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1F)N1CCC(c2ncccc2Cl)CC1 ZINC000365488571 940178385 /nfs/dbraw/zinc/17/83/85/940178385.db2.gz WSKYKXNGFPAXSN-UHFFFAOYSA-N 0 0 363.776 3.802 20 5 FHBDRN CC[C@H](NC(=O)NCc1ccc2c(c1)COC2)c1cccc([N+](=O)[O-])c1 ZINC000431664142 940198715 /nfs/dbraw/zinc/19/87/15/940198715.db2.gz XEOJYKJCKOJAQK-SFHVURJKSA-N 0 0 355.394 3.576 20 5 FHBDRN Cc1ccc(C(C)C)cc1OCC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000612645874 940200577 /nfs/dbraw/zinc/20/05/77/940200577.db2.gz XGDXNDNSQRWQTL-UHFFFAOYSA-N 0 0 354.406 3.995 20 5 FHBDRN CCC1CCC(CNC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC1 ZINC000066025917 940204362 /nfs/dbraw/zinc/20/43/62/940204362.db2.gz HKIYSIXYWLKYTH-UHFFFAOYSA-N 0 0 370.453 3.942 20 5 FHBDRN COc1cc(OCC(=O)N(C2CC2)C2CCC(C)CC2)ccc1[N+](=O)[O-] ZINC000066020439 940205073 /nfs/dbraw/zinc/20/50/73/940205073.db2.gz XKJTURRYVZPRGE-UHFFFAOYSA-N 0 0 362.426 3.552 20 5 FHBDRN CCC1CCC(CNC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)CC1 ZINC000066026564 940205188 /nfs/dbraw/zinc/20/51/88/940205188.db2.gz ZWVZPTNDPKXTOO-UHFFFAOYSA-N 0 0 356.426 3.727 20 5 FHBDRN CC[C@@H](C)NC(=O)c1ccc(NC(=O)Cc2ccccc2[N+](=O)[O-])c(C)c1 ZINC000066034988 940212844 /nfs/dbraw/zinc/21/28/44/940212844.db2.gz LCHZARFZQXVJTR-CQSZACIVSA-N 0 0 369.421 3.613 20 5 FHBDRN CC[C@@H](C)NC(=O)c1ccc(NC(=O)c2ccc([N+](=O)[O-])c(C)c2)c(C)c1 ZINC000066035006 940212882 /nfs/dbraw/zinc/21/28/82/940212882.db2.gz KWBPZGZNGJVBHX-CQSZACIVSA-N 0 0 369.421 3.992 20 5 FHBDRN CCOc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2OC)c2ncccc12 ZINC000427346248 945303968 /nfs/dbraw/zinc/30/39/68/945303968.db2.gz ICGFMVJPHZUSJN-UHFFFAOYSA-N 0 0 367.361 3.803 20 5 FHBDRN CC(C)(C)c1cnc(CNC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)o1 ZINC000124453044 945307329 /nfs/dbraw/zinc/30/73/29/945307329.db2.gz FRQHBMHXQFEIMA-UHFFFAOYSA-N 0 0 371.315 3.829 20 5 FHBDRN CC(C)Oc1ncccc1CNc1ccc([N+](=O)[O-])cc1OC(F)F ZINC000612778821 940272155 /nfs/dbraw/zinc/27/21/55/940272155.db2.gz YVNRPRZFZBBDCM-UHFFFAOYSA-N 0 0 353.325 3.991 20 5 FHBDRN COc1ccc(-c2cc(COc3nc(C)cc(C)c3[N+](=O)[O-])on2)cc1 ZINC000612786314 940274400 /nfs/dbraw/zinc/27/44/00/940274400.db2.gz FZMBLZQMOZLEFX-UHFFFAOYSA-N 0 0 355.350 3.849 20 5 FHBDRN CC(C)(CNC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1)Oc1ccccc1 ZINC000431686535 940288709 /nfs/dbraw/zinc/28/87/09/940288709.db2.gz RJZKGQQWBBSCJB-UHFFFAOYSA-N 0 0 371.437 3.987 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N(Cc2cccc(F)c2)C2CC2)c1 ZINC000548961564 940289518 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FHBDRN O=C(Nc1cccc2ccccc21)N1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000376110218 940327367 /nfs/dbraw/zinc/32/73/67/940327367.db2.gz GMCQCIJSGCZIMO-UHFFFAOYSA-N 0 0 365.393 3.814 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)N[C@H]2CCCc3ccc(C(C)C)cc32)n1 ZINC000427380255 945312103 /nfs/dbraw/zinc/31/21/03/945312103.db2.gz STALKNCWNFEGIZ-INIZCTEOSA-N 0 0 356.426 3.742 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1C[C@@H](C)Oc2ccc(Cl)cc21 ZINC000427361596 945315130 /nfs/dbraw/zinc/31/51/30/945315130.db2.gz YBPDPBGZUYAEEK-SNVBAGLBSA-N 0 0 362.769 3.685 20 5 FHBDRN COc1cccc([C@H](C)c2noc(COc3cccc([N+](=O)[O-])c3)n2)c1 ZINC000612918198 940336039 /nfs/dbraw/zinc/33/60/39/940336039.db2.gz WRNUQCHVAVNQOI-LBPRGKRZSA-N 0 0 355.350 3.717 20 5 FHBDRN O=[N+]([O-])c1cc(F)ccc1/C=C/c1nc(Cc2ccc3c(c2)CCO3)no1 ZINC000612912257 940337748 /nfs/dbraw/zinc/33/77/48/940337748.db2.gz VGTMJSDZNPWFAX-ZZXKWVIFSA-N 0 0 367.336 3.813 20 5 FHBDRN CCO[C@H]1C[C@H](NC(=O)c2cccc(Cl)c2[N+](=O)[O-])C12CCCC2 ZINC000177653445 940338513 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5 FHBDRN Cc1cnc([C@@H]2CCCN(c3ncnc4sc([N+](=O)[O-])cc43)C2)s1 ZINC000376172185 940413007 /nfs/dbraw/zinc/41/30/07/940413007.db2.gz MCRCSKQFUAIFAB-SNVBAGLBSA-N 0 0 361.452 3.748 20 5 FHBDRN CC(=O)c1cc(N[C@H]2CCN(Cc3ccccn3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000376177163 940422828 /nfs/dbraw/zinc/42/28/28/940422828.db2.gz ZZMPTIRSBROWJR-KUHUBIRLSA-N 0 0 368.437 3.515 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N(CC(F)(F)F)[C@@H](C)C(C)C ZINC000579952751 940423688 /nfs/dbraw/zinc/42/36/88/940423688.db2.gz MQZNJICBENQZCX-NSHDSACASA-N 0 0 368.377 3.501 20 5 FHBDRN O=[N+]([O-])c1ccc([C@H](NC[C@H]2COc3ccccc32)C(F)(F)F)cc1 ZINC000579966488 940425815 /nfs/dbraw/zinc/42/58/15/940425815.db2.gz IYHIVICFODJHTH-LRDDRELGSA-N 0 0 352.312 3.964 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1)CN(c1nnc([C@@H]3CCCS3)n1C1CC1)CC2 ZINC000579965343 940425839 /nfs/dbraw/zinc/42/58/39/940425839.db2.gz YEHAYQJPAMWFRS-INIZCTEOSA-N 0 0 371.466 3.652 20 5 FHBDRN C[C@H]1CCc2c(F)cccc2[C@H]1NC(=O)NCc1ccccc1[N+](=O)[O-] ZINC000431731933 940430810 /nfs/dbraw/zinc/43/08/10/940430810.db2.gz KNUWZZZNYDMEQI-SGTLLEGYSA-N 0 0 357.385 3.857 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(-c2nc(-c3cc(OC)ccc3OC)no2)c1 ZINC000580001475 940433243 /nfs/dbraw/zinc/43/32/43/940433243.db2.gz GEXXWHNSITZANP-UHFFFAOYSA-N 0 0 371.349 3.728 20 5 FHBDRN CC[C@@H](CSc1ccccc1)NC(=O)c1ccc([N+](=O)[O-])cc1OC ZINC000427369962 945320629 /nfs/dbraw/zinc/32/06/29/945320629.db2.gz MHQFYOCIQBZTAU-ZDUSSCGKSA-N 0 0 360.435 3.904 20 5 FHBDRN CCc1nc2cc(CNc3ncc([N+](=O)[O-])cc3C)ccc2n1C1CC1 ZINC000548987320 940443759 /nfs/dbraw/zinc/44/37/59/940443759.db2.gz WKAAYLMJLRJYIB-UHFFFAOYSA-N 0 0 351.410 3.579 20 5 FHBDRN COC(=O)c1ccc(OCc2cc(F)cc3cccnc32)cc1[N+](=O)[O-] ZINC000613109834 940452224 /nfs/dbraw/zinc/45/22/24/940452224.db2.gz BMKRKCNERAGUGI-UHFFFAOYSA-N 0 0 356.309 3.648 20 5 FHBDRN COC(=O)c1ccc(OCc2coc(-c3cccs3)n2)cc1[N+](=O)[O-] ZINC000613110239 940452681 /nfs/dbraw/zinc/45/26/81/940452681.db2.gz KTAQSHVEGSQOJU-UHFFFAOYSA-N 0 0 360.347 3.677 20 5 FHBDRN Cc1ccc(NS(=O)(=O)c2cc([N+](=O)[O-])c(Cl)cc2C)c(C)c1O ZINC000177824173 940455778 /nfs/dbraw/zinc/45/57/78/940455778.db2.gz UGAXVEVTKLPWMA-UHFFFAOYSA-N 0 0 370.814 3.680 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NCCC2CC(OC(C)(C)C)C2)c1 ZINC000548995799 940462590 /nfs/dbraw/zinc/46/25/90/940462590.db2.gz OCDHMPSDMKWGCK-UHFFFAOYSA-N 0 0 364.442 3.707 20 5 FHBDRN Cn1cc([C@H](N[C@H]2CCc3c2cccc3[N+](=O)[O-])c2ccc(F)cc2)cn1 ZINC000580216148 940468002 /nfs/dbraw/zinc/46/80/02/940468002.db2.gz OMGIXFXJQZVHJL-AZUAARDMSA-N 0 0 366.396 3.834 20 5 FHBDRN COc1cc(F)c(F)cc1NCc1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000580253896 940470719 /nfs/dbraw/zinc/47/07/19/940470719.db2.gz RKEHUKOYDWHKAS-UHFFFAOYSA-N 0 0 354.309 3.511 20 5 FHBDRN COc1ccc(CCC(=O)Oc2cc(Cl)ccc2[N+](=O)[O-])cc1OC ZINC000124839561 945323678 /nfs/dbraw/zinc/32/36/78/945323678.db2.gz KQXGCFIESWHNPG-UHFFFAOYSA-N 0 0 365.769 3.804 20 5 FHBDRN C[C@H]1CC[C@H](c2ccccc2)N(c2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])C1 ZINC000580424634 940474699 /nfs/dbraw/zinc/47/46/99/940474699.db2.gz RDMGXBPOWLWBJN-WMLDXEAASA-N 0 0 374.462 3.976 20 5 FHBDRN Cc1ccccc1-n1nccc1NC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000580509651 940477433 /nfs/dbraw/zinc/47/74/33/940477433.db2.gz LXJBUJZHJVJIKX-AWEZNQCLSA-N 0 0 350.378 3.831 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCc3ncccc3C2)nc1OCc1ccccc1 ZINC000613182251 940478675 /nfs/dbraw/zinc/47/86/75/940478675.db2.gz VNLVRWJFCAPSND-UHFFFAOYSA-N 0 0 362.389 3.527 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(N(C)C(C)=O)cc1 ZINC000613179800 940479996 /nfs/dbraw/zinc/47/99/96/940479996.db2.gz BZHZBYGGTCQZOE-INIZCTEOSA-N 0 0 369.421 3.785 20 5 FHBDRN O=[N+]([O-])c1ccc(NC[C@@H](O)COc2ccc(C(F)(F)F)cc2)s1 ZINC000066410837 940482288 /nfs/dbraw/zinc/48/22/88/940482288.db2.gz NTRJZTCJUWXLHF-SNVBAGLBSA-N 0 0 362.329 3.527 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N(Cc1ccccc1)c1ccncc1 ZINC000427398866 945325155 /nfs/dbraw/zinc/32/51/55/945325155.db2.gz MCPDWPQCBZURCI-UHFFFAOYSA-N 0 0 363.373 3.845 20 5 FHBDRN CNc1c(C(=O)N(C)Cc2ccc(C(F)(F)F)cc2)cccc1[N+](=O)[O-] ZINC000613223942 940486553 /nfs/dbraw/zinc/48/65/53/940486553.db2.gz YGEFTBINKYHABL-UHFFFAOYSA-N 0 0 367.327 3.928 20 5 FHBDRN O=[N+]([O-])c1cc2c(ncnc2N[C@@H](CCO)c2ccc(Cl)cc2)s1 ZINC000580796296 940487556 /nfs/dbraw/zinc/48/75/56/940487556.db2.gz VNHDWAWVGZHLJS-LBPRGKRZSA-N 0 0 364.814 3.789 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NCC2(CCOC)CCCCC2)c1 ZINC000549007874 940487984 /nfs/dbraw/zinc/48/79/84/940487984.db2.gz VXLUUKXBALCYDH-UHFFFAOYSA-N 0 0 364.442 3.710 20 5 FHBDRN CNc1c(C(=O)N2CCS[C@@H](c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000613234236 940489849 /nfs/dbraw/zinc/48/98/49/940489849.db2.gz IDFUGLWUHIFGCI-MRXNPFEDSA-N 0 0 357.435 3.567 20 5 FHBDRN C[C@H](Nc1nc2c(cc1[N+](=O)[O-])CCCC2)c1ccc([S@@](C)=O)cc1 ZINC000566911767 945325405 /nfs/dbraw/zinc/32/54/05/945325405.db2.gz MLNSWJWLXSTVJJ-UOXLDJKESA-N 0 0 359.451 3.779 20 5 FHBDRN C[C@H](Cc1cccs1)NC(=O)c1cc2ccccc2c([N+](=O)[O-])c1N ZINC001125808469 940490809 /nfs/dbraw/zinc/49/08/09/940490809.db2.gz PPKXQLRLKHBIIM-LLVKDONJSA-N 0 0 355.419 3.753 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(OC3CCCC3)nc2)c1 ZINC000549009289 940491861 /nfs/dbraw/zinc/49/18/61/940491861.db2.gz IUJXESIHXXURER-UHFFFAOYSA-N 0 0 371.393 3.962 20 5 FHBDRN CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)c1ccn(C2CCCC2)n1 ZINC000177967550 940493965 /nfs/dbraw/zinc/49/39/65/940493965.db2.gz IYOGZQZMUOKFPF-UHFFFAOYSA-N 0 0 362.817 3.832 20 5 FHBDRN C[C@H](CN(C)C(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)c1ccccc1 ZINC000066458672 940494925 /nfs/dbraw/zinc/49/49/25/940494925.db2.gz VZRKNUHZYCOZGE-OAHLLOKOSA-N 0 0 364.405 3.656 20 5 FHBDRN Cc1sc(C(=O)N2CCC(Nc3ccc(F)cc3)CC2)cc1[N+](=O)[O-] ZINC000066457905 940495023 /nfs/dbraw/zinc/49/50/23/940495023.db2.gz VENTWCROPMHNQT-UHFFFAOYSA-N 0 0 363.414 3.821 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])n[nH]1)N1CCCC[C@@H]1c1ccccc1C(F)(F)F ZINC000511462146 940495350 /nfs/dbraw/zinc/49/53/50/940495350.db2.gz LWQTWYLUCWYSTA-CYBMUJFWSA-N 0 0 368.315 3.704 20 5 FHBDRN O=C(NOC1CCCC1)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000785242481 940496233 /nfs/dbraw/zinc/49/62/33/940496233.db2.gz IWXXDIOMYWWDIX-UHFFFAOYSA-N 0 0 356.378 3.778 20 5 FHBDRN COc1ccc([C@H](C)NC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000431781292 940496780 /nfs/dbraw/zinc/49/67/80/940496780.db2.gz BSKFQZAHVYDXEJ-ZDUSSCGKSA-N 0 0 357.410 3.899 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1[C@@H](C)Cc2cc(F)ccc2[C@@H]1C ZINC000427399645 945326055 /nfs/dbraw/zinc/32/60/55/945326055.db2.gz POVSQRVVHRLFSH-RYUDHWBXSA-N 0 0 358.369 3.891 20 5 FHBDRN O=C(N[C@H](C1CC1)C(F)(F)F)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000581271520 940498120 /nfs/dbraw/zinc/49/81/20/940498120.db2.gz HMSYZWSZSPNNQV-GFCCVEGCSA-N 0 0 371.340 3.789 20 5 FHBDRN COCc1nc(Cc2noc(-c3cc4cc([N+](=O)[O-])ccc4o3)n2)cs1 ZINC000581336907 940499712 /nfs/dbraw/zinc/49/97/12/940499712.db2.gz KTLLDAVKQGERGC-UHFFFAOYSA-N 0 0 372.362 3.585 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N[C@@H]1c2ccc(F)cc2O[C@H]1C ZINC000581335179 940499724 /nfs/dbraw/zinc/49/97/24/940499724.db2.gz AJJGLJFVURREOY-FVMDXXJSSA-N 0 0 364.760 3.948 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)NCc1ccc(F)c(Cl)c1 ZINC000581361776 940500226 /nfs/dbraw/zinc/50/02/26/940500226.db2.gz RKEVSGYIAJYDNW-UHFFFAOYSA-N 0 0 365.792 3.771 20 5 FHBDRN Cc1ccc2c(c1)CN(c1ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c1)C2 ZINC000581285479 940500399 /nfs/dbraw/zinc/50/03/99/940500399.db2.gz FCNLNERPWFUWPZ-UHFFFAOYSA-N 0 0 351.406 3.659 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2Cc3ccccc3OC(C)(C)C2)c1 ZINC000581461127 940504424 /nfs/dbraw/zinc/50/44/24/940504424.db2.gz YBHYGIXIKFZZTK-UHFFFAOYSA-N 0 0 370.405 3.807 20 5 FHBDRN CC(C)Oc1nc(N2CC[C@@H](n3ncc4ccccc43)C2)ccc1[N+](=O)[O-] ZINC000581559313 940506450 /nfs/dbraw/zinc/50/64/50/940506450.db2.gz ULVJMINDNYYOGC-OAHLLOKOSA-N 0 0 367.409 3.578 20 5 FHBDRN C[C@@H]1C[C@@H](CCNc2ncc([N+](=O)[O-])cc2Br)C[C@H](C)O1 ZINC000581501273 940507150 /nfs/dbraw/zinc/50/71/50/940507150.db2.gz PHEYGMGRFKJMGV-JGPRNRPPSA-N 0 0 358.236 3.758 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1CCc2c1cccc2C(F)(F)F ZINC000427383283 945329418 /nfs/dbraw/zinc/32/94/18/945329418.db2.gz QZPYGIIPXLRGPM-UHFFFAOYSA-N 0 0 366.295 3.825 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H](C)c1nc(C2CCCCC2)no1 ZINC000427389189 945334661 /nfs/dbraw/zinc/33/46/61/945334661.db2.gz FYYCMIKTGBNSBK-NSHDSACASA-N 0 0 374.397 3.525 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)Nc1cncc(Cl)c1Cl ZINC000180129952 940609223 /nfs/dbraw/zinc/60/92/23/940609223.db2.gz DBCFPBGQLKSJNZ-UHFFFAOYSA-N 0 0 365.176 3.959 20 5 FHBDRN O=C(COc1ccccc1[N+](=O)[O-])OCc1ccc(OC(F)(F)F)cc1 ZINC000892539184 940611303 /nfs/dbraw/zinc/61/13/03/940611303.db2.gz BBVDCUMXLBLDDO-UHFFFAOYSA-N 0 0 371.267 3.616 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N(Cc1cccs1)CC(F)(F)F ZINC000427404729 945334809 /nfs/dbraw/zinc/33/48/09/945334809.db2.gz NUTDRCXZFATKNS-UHFFFAOYSA-N 0 0 374.340 3.870 20 5 FHBDRN Cc1c(CC(=O)N[C@H]2C[C@@H]2c2c(F)cccc2Cl)cccc1[N+](=O)[O-] ZINC000124902519 945335968 /nfs/dbraw/zinc/33/59/68/945335968.db2.gz QBKZHBZHBKZYOE-WFASDCNBSA-N 0 0 362.788 3.911 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N1C[C@@H](c2cnn(C)c2)C(C)(C)C1 ZINC000581953382 940634109 /nfs/dbraw/zinc/63/41/09/940634109.db2.gz NLZZKOGQZZCKFH-INIZCTEOSA-N 0 0 370.453 3.519 20 5 FHBDRN O=[N+]([O-])c1cc2c(nc1NCCc1nnc(-c3ccccc3)o1)CCCC2 ZINC000582059449 940645086 /nfs/dbraw/zinc/64/50/86/940645086.db2.gz NPBHFUVJRAAFMP-UHFFFAOYSA-N 0 0 365.393 3.573 20 5 FHBDRN COc1ccc(NC(=O)c2ccc(Br)c(F)c2)c([N+](=O)[O-])c1 ZINC000064645254 940651440 /nfs/dbraw/zinc/65/14/40/940651440.db2.gz CGEDPQZSPITPIN-UHFFFAOYSA-N 0 0 369.146 3.757 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)NCC1CC(c2ccccc2)C1 ZINC000549017891 940654298 /nfs/dbraw/zinc/65/42/98/940654298.db2.gz QZKBCRJFOKDWAD-UHFFFAOYSA-N 0 0 354.406 3.917 20 5 FHBDRN COc1cc(CN2C[C@@H](C(F)(F)F)CC[C@H]2C)c([N+](=O)[O-])cc1F ZINC000613384164 940659131 /nfs/dbraw/zinc/65/91/31/940659131.db2.gz UBYPWUPKTHKSHP-KOLCDFICSA-N 0 0 350.312 3.905 20 5 FHBDRN COc1cc(CN2C[C@H](C(F)(F)F)CC[C@H]2C)c([N+](=O)[O-])cc1F ZINC000613384165 940659195 /nfs/dbraw/zinc/65/91/95/940659195.db2.gz UBYPWUPKTHKSHP-MWLCHTKSSA-N 0 0 350.312 3.905 20 5 FHBDRN Cc1cc(C(=O)N[C@H](C(=O)OC(C)(C)C)c2ccccc2)cc([N+](=O)[O-])c1 ZINC000427406837 945338662 /nfs/dbraw/zinc/33/86/62/945338662.db2.gz JWGUVVVUWADMGG-KRWDZBQOSA-N 0 0 370.405 3.716 20 5 FHBDRN Cn1ccnc1[C@H](N[C@H]1CCc2c1cccc2[N+](=O)[O-])c1ccc(F)cc1 ZINC000582496708 940674708 /nfs/dbraw/zinc/67/47/08/940674708.db2.gz IRCATCWDXXTZKW-PKOBYXMFSA-N 0 0 366.396 3.834 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)N1CCCc2c(F)ccc(F)c21 ZINC000472538274 940681364 /nfs/dbraw/zinc/68/13/64/940681364.db2.gz IXOZQWYWRXWWNL-UHFFFAOYSA-N 0 0 364.373 3.945 20 5 FHBDRN COc1cc(CN(C)Cc2ccccc2Cl)c([N+](=O)[O-])cc1OC ZINC000506802580 945340092 /nfs/dbraw/zinc/34/00/92/945340092.db2.gz COPAACSLTFTKQA-UHFFFAOYSA-N 0 0 350.802 3.897 20 5 FHBDRN O=[N+]([O-])c1ccc2ncnc(N3CCO[C@@H](c4cccc(Cl)c4)C3)c2c1 ZINC000613431325 940702289 /nfs/dbraw/zinc/70/22/89/940702289.db2.gz ZLVSKIVHUCRRHE-QGZVFWFLSA-N 0 0 370.796 3.769 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@H](Cc2ccccc2)C1 ZINC000174124490 940704083 /nfs/dbraw/zinc/70/40/83/940704083.db2.gz PVGMROWTGQUWJO-OAHLLOKOSA-N 0 0 355.394 3.700 20 5 FHBDRN C[C@@H]1CC(CCNC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C[C@@H](C)O1 ZINC000549020658 940709471 /nfs/dbraw/zinc/70/94/71/940709471.db2.gz KAKDKDUPCPPMRT-GHMZBOCLSA-N 0 0 374.359 3.937 20 5 FHBDRN Cc1c([C@@H](C)N[C@H]2c3sccc3OC(C)(C)[C@@H]2O)cccc1[N+](=O)[O-] ZINC000414179618 940721076 /nfs/dbraw/zinc/72/10/76/940721076.db2.gz KYAWBYQIYNCGLH-XQAQDONZSA-N 0 0 362.451 3.889 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)NCCC1C[C@@H](C)O[C@H](C)C1 ZINC000549023745 940727597 /nfs/dbraw/zinc/72/75/97/940727597.db2.gz XBEKARBQRAYLQO-CHWSQXEVSA-N 0 0 365.430 3.709 20 5 FHBDRN CCNC(=O)c1ccc(Cl)cc1NC(=O)c1cc(C)cc([N+](=O)[O-])c1 ZINC000122083700 940729567 /nfs/dbraw/zinc/72/95/67/940729567.db2.gz SUCYVNQNAQIQEX-UHFFFAOYSA-N 0 0 361.785 3.559 20 5 FHBDRN COc1cc(Cl)c(C)cc1NC(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000047608668 945344987 /nfs/dbraw/zinc/34/49/87/945344987.db2.gz SMNCNUIURRQRBN-UHFFFAOYSA-N 0 0 364.785 3.973 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(OC(F)F)nc1 ZINC000549027357 940747361 /nfs/dbraw/zinc/74/73/61/940747361.db2.gz SORAJNDRFGJXMJ-LBPRGKRZSA-N 0 0 365.336 3.799 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1nc2cc(F)ccc2n1C ZINC000174610728 940749649 /nfs/dbraw/zinc/74/96/49/940749649.db2.gz JHKJCDNQALRZHE-SNVBAGLBSA-N 0 0 374.397 3.740 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCC(C)(C)C(F)(F)F ZINC000549034973 940772017 /nfs/dbraw/zinc/77/20/17/940772017.db2.gz WFQRTLLYRQWNHM-VIFPVBQESA-N 0 0 350.362 3.780 20 5 FHBDRN O=C(N[C@@H]1CCc2ccc(F)cc21)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000540918729 940787251 /nfs/dbraw/zinc/78/72/51/940787251.db2.gz OXWRSYKSVLYUBC-CQSZACIVSA-N 0 0 366.295 3.753 20 5 FHBDRN COc1ccc(CC(=O)N(C)CCc2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000540914177 940788604 /nfs/dbraw/zinc/78/86/04/940788604.db2.gz NKNVRSNGIWXZMI-UHFFFAOYSA-N 0 0 362.813 3.500 20 5 FHBDRN O=C(OCCCOc1ccc([N+](=O)[O-])cc1)c1cc(F)c(F)c(F)c1 ZINC000728652797 940791728 /nfs/dbraw/zinc/79/17/28/940791728.db2.gz MPXBIJFMSCBFEN-UHFFFAOYSA-N 0 0 355.268 3.638 20 5 FHBDRN CSc1ccccc1N(C)S(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-] ZINC000174976512 940792885 /nfs/dbraw/zinc/79/28/85/940792885.db2.gz NFTVQOZZQQAVHF-UHFFFAOYSA-N 0 0 366.464 3.759 20 5 FHBDRN CCOc1ccc([C@@H](C)Nc2cccc3c2CN(C)C3=O)cc1[N+](=O)[O-] ZINC000414224449 940797722 /nfs/dbraw/zinc/79/77/22/940797722.db2.gz LSHIWDBCEBTSNJ-GFCCVEGCSA-N 0 0 355.394 3.752 20 5 FHBDRN CC1(C)C[C@H](NCc2nccc(C(F)(F)F)n2)c2cc([N+](=O)[O-])ccc21 ZINC000414237805 940818201 /nfs/dbraw/zinc/81/82/01/940818201.db2.gz JSRBFEIZTHCACJ-ZDUSSCGKSA-N 0 0 366.343 3.916 20 5 FHBDRN COc1cc(C=O)c(Br)cc1Oc1nc(C)ccc1[N+](=O)[O-] ZINC000178194659 940818318 /nfs/dbraw/zinc/81/83/18/940818318.db2.gz OLRYXNMRGFCADP-UHFFFAOYSA-N 0 0 367.155 3.674 20 5 FHBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)N[C@H](c1ccccc1)[C@H]1CCCO1 ZINC000255894470 940818988 /nfs/dbraw/zinc/81/89/88/940818988.db2.gz UIBGJAZWFLXQDG-HKCWIBIESA-N 0 0 352.390 3.645 20 5 FHBDRN COc1ccc(C(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)c(OCC2CC2)c1 ZINC000472563628 940824236 /nfs/dbraw/zinc/82/42/36/940824236.db2.gz PBIFSGNVSDXNPG-UHFFFAOYSA-N 0 0 372.377 3.653 20 5 FHBDRN COc1ccc(-c2nnc(SCCOc3ccccc3[N+](=O)[O-])o2)cc1 ZINC000053127846 940827014 /nfs/dbraw/zinc/82/70/14/940827014.db2.gz IPXIZMMIJJJXAK-UHFFFAOYSA-N 0 0 373.390 3.825 20 5 FHBDRN CCS[C@H]1CCCC[C@@H]1NC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000175267470 940839007 /nfs/dbraw/zinc/83/90/07/940839007.db2.gz VABDGMKYRCIRJS-RDJZCZTQSA-N 0 0 374.466 3.575 20 5 FHBDRN COCCc1nc2cc(NC(=O)Nc3cccc([N+](=O)[O-])c3)ccc2o1 ZINC000440262541 945354183 /nfs/dbraw/zinc/35/41/83/945354183.db2.gz XRKKRPKLXFIZKZ-UHFFFAOYSA-N 0 0 356.338 3.569 20 5 FHBDRN CC1(C)C[C@H](NCc2ccccc2S(C)(=O)=O)c2cc([N+](=O)[O-])ccc21 ZINC000414268334 940862077 /nfs/dbraw/zinc/86/20/77/940862077.db2.gz XATRSOQZULNSPJ-KRWDZBQOSA-N 0 0 374.462 3.511 20 5 FHBDRN CC(C)(c1ccccc1)C1(NS(=O)(=O)Cc2ccccc2[N+](=O)[O-])CC1 ZINC000452039235 940863649 /nfs/dbraw/zinc/86/36/49/940863649.db2.gz ZYWIHLVVWRCEHY-UHFFFAOYSA-N 0 0 374.462 3.525 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1)[C@@H](NCc1nccc(C(F)(F)F)n1)CCC2 ZINC000414266676 940864613 /nfs/dbraw/zinc/86/46/13/940864613.db2.gz VZNIKKISKPUUOS-ZDUSSCGKSA-N 0 0 352.316 3.571 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccnn1-c1ccc(Cl)cc1 ZINC000175406326 940865437 /nfs/dbraw/zinc/86/54/37/940865437.db2.gz TYSOWZDNEFTZBP-UHFFFAOYSA-N 0 0 372.768 3.695 20 5 FHBDRN O=C(c1ccc(Br)cc1[N+](=O)[O-])N1CCc2ccccc2C1 ZINC000175493212 940871428 /nfs/dbraw/zinc/87/14/28/940871428.db2.gz CBMADYDQVKMHDP-UHFFFAOYSA-N 0 0 361.195 3.556 20 5 FHBDRN O=C(Nc1ccc(F)c(F)c1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000175502119 940872942 /nfs/dbraw/zinc/87/29/42/940872942.db2.gz WEIAAAZQFRUHOL-UHFFFAOYSA-N 0 0 357.110 3.888 20 5 FHBDRN O=C(Nc1ccc(F)cc1F)c1ccc(Br)cc1[N+](=O)[O-] ZINC000175501040 940873185 /nfs/dbraw/zinc/87/31/85/940873185.db2.gz UYHMZUBKAWTPAT-UHFFFAOYSA-N 0 0 357.110 3.888 20 5 FHBDRN COc1ccc(NC(=O)c2ccc(C)c(Br)c2)c([N+](=O)[O-])c1 ZINC000175491373 940876874 /nfs/dbraw/zinc/87/68/74/940876874.db2.gz WMILKEKTAYDEEM-UHFFFAOYSA-N 0 0 365.183 3.927 20 5 FHBDRN O=[N+]([O-])c1ccc(C(F)(F)F)c(Cn2cc(Br)cn2)c1 ZINC000549055058 940906122 /nfs/dbraw/zinc/90/61/22/940906122.db2.gz JZIVLDAEWFBAIL-UHFFFAOYSA-N 0 0 350.094 3.621 20 5 FHBDRN COc1cc(C(=O)N2CC[C@@H](c3ccccc3)[C@H]2C)c([N+](=O)[O-])cc1OC ZINC000175699090 940914375 /nfs/dbraw/zinc/91/43/75/940914375.db2.gz JKVZXVFALDEFLX-UKRRQHHQSA-N 0 0 370.405 3.630 20 5 FHBDRN CC(=O)c1cc([N+](=O)[O-])ccc1N1CCC(C(=O)c2cccs2)CC1 ZINC000376404922 940923359 /nfs/dbraw/zinc/92/33/59/940923359.db2.gz BNGRTQTZHSOTOW-UHFFFAOYSA-N 0 0 358.419 3.958 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)Nc1ccc([C@@H]2CCOC2)cc1 ZINC000582896777 940932956 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C[C@H](Cc1cccs1)NC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000180353201 940986587 /nfs/dbraw/zinc/98/65/87/940986587.db2.gz UVPXUOVTNJVQBH-SECBINFHSA-N 0 0 356.350 3.619 20 5 FHBDRN COc1ccc(NC(C)=O)cc1NC(=O)c1c(C)cc(C)c([N+](=O)[O-])c1C ZINC000180387032 940996799 /nfs/dbraw/zinc/99/67/99/940996799.db2.gz UYFVBJJJUILSLC-UHFFFAOYSA-N 0 0 371.393 3.739 20 5 FHBDRN Cc1c(C(=O)N2CCC[C@H]2CC(=O)c2cccs2)cccc1[N+](=O)[O-] ZINC000176212053 941004192 /nfs/dbraw/zinc/00/41/92/941004192.db2.gz LRCKNBJDZIIQNK-ZDUSSCGKSA-N 0 0 358.419 3.842 20 5 FHBDRN C[C@H](NCC(=O)Nc1nc2ccc(F)cc2s1)c1cccc([N+](=O)[O-])c1 ZINC000180425669 941012962 /nfs/dbraw/zinc/01/29/62/941012962.db2.gz DIJDDWAXSSGGMO-JTQLQIEISA-N 0 0 374.397 3.633 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)Nc1cc([N+](=O)[O-])c(F)cc1F ZINC000180435087 941015525 /nfs/dbraw/zinc/01/55/25/941015525.db2.gz WCJWDXNEUWRGQY-UHFFFAOYSA-N 0 0 365.292 3.959 20 5 FHBDRN Cc1ccc2nc(NC(=O)CN[C@H](C)c3cccc([N+](=O)[O-])c3)sc2c1 ZINC000180457687 941022088 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Cc1cc(Br)ccc1NC(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000180594247 941049190 /nfs/dbraw/zinc/04/91/90/941049190.db2.gz ZHUQGBXKTPFJHM-UHFFFAOYSA-N 0 0 350.172 3.500 20 5 FHBDRN O=[N+]([O-])c1ccn(Cc2nc(C3(c4ccc(F)cc4)CCCCC3)no2)n1 ZINC000583089778 941049208 /nfs/dbraw/zinc/04/92/08/941049208.db2.gz MXWAZRXEOSSUEH-UHFFFAOYSA-N 0 0 371.372 3.612 20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])NC1(Cc2ccccc2)CCC1 ZINC000472597347 941052986 /nfs/dbraw/zinc/05/29/86/941052986.db2.gz COOYQEKNYQTOJV-UHFFFAOYSA-N 0 0 353.422 3.678 20 5 FHBDRN Cc1cc(S(=O)(=O)Nc2c(F)cc(Cl)cc2F)ccc1[N+](=O)[O-] ZINC000180660481 941060047 /nfs/dbraw/zinc/06/00/47/941060047.db2.gz KZSYVYYLWYQCEY-UHFFFAOYSA-N 0 0 362.741 3.636 20 5 FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC(C)(C)CC1 ZINC000158948723 941060512 /nfs/dbraw/zinc/06/05/12/941060512.db2.gz XSDBJSODKNMORM-UHFFFAOYSA-N 0 0 366.483 3.986 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)SCc1nnnn1-c1ccccc1 ZINC000180686710 941064098 /nfs/dbraw/zinc/06/40/98/941064098.db2.gz 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CCOc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)cc1F ZINC000180822886 941081311 /nfs/dbraw/zinc/08/13/11/941081311.db2.gz CLWRVHORIHMRDJ-UHFFFAOYSA-N 0 0 370.283 3.986 20 5 FHBDRN O=C(NCc1ccc(Cl)cn1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000180848391 941083946 /nfs/dbraw/zinc/08/39/46/941083946.db2.gz GFXHKMKABPQPSN-UHFFFAOYSA-N 0 0 360.801 3.517 20 5 FHBDRN Cc1ccc(C(C)(C)C(=O)OCc2cc([N+](=O)[O-])cc3c2OCOC3)cc1 ZINC000728666800 941084723 /nfs/dbraw/zinc/08/47/23/941084723.db2.gz VBPUDRPAWMYODO-UHFFFAOYSA-N 0 0 371.389 3.791 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2nc(CN3CCC(c4c[nH]cn4)CC3)cs2)c1 ZINC000376494201 941084848 /nfs/dbraw/zinc/08/48/48/941084848.db2.gz ZLIUZOAPZPLCNB-UHFFFAOYSA-N 0 0 369.450 3.821 20 5 FHBDRN O=[N+]([O-])c1ccc2oc(CSc3nccc(C(F)(F)F)n3)nc2c1 ZINC000176937480 941086520 /nfs/dbraw/zinc/08/65/20/941086520.db2.gz MMYJSTMORNZVQH-UHFFFAOYSA-N 0 0 356.285 3.837 20 5 FHBDRN Cc1ccc(CN(C)C(=O)c2ccc(Br)cc2[N+](=O)[O-])o1 ZINC000176923631 941087276 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FHBDRN O=C(c1n[nH]c2ccc([N+](=O)[O-])cc21)N(Cc1ccc(F)cc1)CC1CC1 ZINC000115476304 941100079 /nfs/dbraw/zinc/10/00/79/941100079.db2.gz KVMLHAFCDDKQPN-UHFFFAOYSA-N 0 0 368.368 3.663 20 5 FHBDRN O=[N+]([O-])c1ccc(N[C@@H](CCO)c2ccccc2Br)cc1 ZINC000541005045 941101401 /nfs/dbraw/zinc/10/14/01/941101401.db2.gz GVZQVZTUVBTVOJ-HNNXBMFYSA-N 0 0 351.200 3.893 20 5 FHBDRN CC(C)CCSc1ccc(C(=O)N2CC[C@H]([C@@H](C)O)C2)cc1[N+](=O)[O-] ZINC000180994915 941101560 /nfs/dbraw/zinc/10/15/60/941101560.db2.gz SBTJGVJFZZACJT-HIFRSBDPSA-N 0 0 366.483 3.576 20 5 FHBDRN O=[N+]([O-])c1ccc(Nc2cnn(Cc3ccccn3)c2)cc1OC(F)F ZINC000181012642 941103417 /nfs/dbraw/zinc/10/34/17/941103417.db2.gz FZCUMOYSIKTWSC-UHFFFAOYSA-N 0 0 361.308 3.580 20 5 FHBDRN Nc1cccc([N+](=O)[O-])c1C(=O)NCC1CCC(c2ccccc2)CC1 ZINC000181055890 941106220 /nfs/dbraw/zinc/10/62/20/941106220.db2.gz VLYWACDRPGSZAA-UHFFFAOYSA-N 0 0 353.422 3.881 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@H](c1ccccc1)[C@H]1CCCO1 ZINC000188834209 941106882 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O=C(Nc1ccc(Cl)cc1)c1cc([N+](=O)[O-])ccc1SCCO ZINC000136035543 941123495 /nfs/dbraw/zinc/12/34/95/941123495.db2.gz BLAUBSIVJQWXHE-UHFFFAOYSA-N 0 0 352.799 3.585 20 5 FHBDRN CCOc1cc(NC(=O)c2ccc(C)nc2C)c([N+](=O)[O-])cc1OCC ZINC000128304135 941124691 /nfs/dbraw/zinc/12/46/91/941124691.db2.gz YHNAYJWEICUARS-UHFFFAOYSA-N 0 0 359.382 3.656 20 5 FHBDRN CCc1ccc(C(=O)N2CCCc3c([N+](=O)[O-])cccc32)cc1[N+](=O)[O-] ZINC000162277959 941125263 /nfs/dbraw/zinc/12/52/63/941125263.db2.gz WGXDDIGMIDJJNF-UHFFFAOYSA-N 0 0 355.350 3.658 20 5 FHBDRN CO[C@H](C)CCC(=O)Nc1ccc(OCc2ccccc2)cc1[N+](=O)[O-] ZINC000188971118 941135478 /nfs/dbraw/zinc/13/54/78/941135478.db2.gz ZZXDMYTWMMAGGL-CQSZACIVSA-N 0 0 358.394 3.927 20 5 FHBDRN COc1ccc(C(=O)CCC(=O)Nc2ccc(C)c([N+](=O)[O-])c2)cc1F ZINC000177600318 941140250 /nfs/dbraw/zinc/14/02/50/941140250.db2.gz LTXCXBVTYIOVIJ-UHFFFAOYSA-N 0 0 360.341 3.653 20 5 FHBDRN O=c1ccc(-c2cccc([N+](=O)[O-])c2)nn1Cc1ccc(F)c(Cl)c1 ZINC000188985988 941140700 /nfs/dbraw/zinc/14/07/00/941140700.db2.gz KELXSDIHNWCRJX-UHFFFAOYSA-N 0 0 359.744 3.659 20 5 FHBDRN CSc1cccc(C(=O)N[C@@H](C)CC(=O)c2cccs2)c1[N+](=O)[O-] ZINC000189016270 941141429 /nfs/dbraw/zinc/14/14/29/941141429.db2.gz KDVOSRJLTSMJAA-JTQLQIEISA-N 0 0 364.448 3.770 20 5 FHBDRN CCSc1cc(CNC(=O)c2ccc(SC)c([N+](=O)[O-])c2)ccn1 ZINC000189049363 941145639 /nfs/dbraw/zinc/14/56/39/941145639.db2.gz XAPXQWJWSSCEPC-UHFFFAOYSA-N 0 0 363.464 3.754 20 5 FHBDRN COCc1cccc(OC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)c1 ZINC000781804023 941147718 /nfs/dbraw/zinc/14/77/18/941147718.db2.gz YDWWXGMMFRGDFS-UHFFFAOYSA-N 0 0 353.277 3.562 20 5 FHBDRN CCN(Cc1c[nH]c2ccccc12)C(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000187926179 941152385 /nfs/dbraw/zinc/15/23/85/941152385.db2.gz IREQUKBHCFBCBT-UHFFFAOYSA-N 0 0 352.394 3.808 20 5 FHBDRN CC(C)c1nnc2ccc(NC(=O)[C@@H](C)c3ccc([N+](=O)[O-])cc3F)cn21 ZINC000189273950 941154361 /nfs/dbraw/zinc/15/43/61/941154361.db2.gz PEMDFAFIWAEXCA-NSHDSACASA-N 0 0 371.372 3.642 20 5 FHBDRN CN(CC1(c2ccccc2)CC1)C(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000189247139 941155253 /nfs/dbraw/zinc/15/52/53/941155253.db2.gz RRWSPPSTICRYOW-UHFFFAOYSA-N 0 0 361.401 3.947 20 5 FHBDRN CCCOc1ccc(NC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2C)c(C)c1 ZINC000189287239 941155408 /nfs/dbraw/zinc/15/54/08/941155408.db2.gz KZVAPWPXAOXHPF-UHFFFAOYSA-N 0 0 371.393 3.578 20 5 FHBDRN O=[N+]([O-])c1ccc(OC[C@H](O)CC(F)(F)F)c(Cc2ccccc2)c1 ZINC000189411262 941157344 /nfs/dbraw/zinc/15/73/44/941157344.db2.gz SKSTXDBMTZBGHT-OAHLLOKOSA-N 0 0 355.312 3.878 20 5 FHBDRN CC[C@](C)(O)CN(Cc1ccccc1)C(=O)c1ccc([N+](=O)[O-])cc1F ZINC000189474848 941158745 /nfs/dbraw/zinc/15/87/45/941158745.db2.gz DSXYTFJROHVAFU-IBGZPJMESA-N 0 0 360.385 3.537 20 5 FHBDRN CC[C@@](C)(O)CN(Cc1ccccc1)C(=O)c1cccc([N+](=O)[O-])c1C ZINC000189492982 941159144 /nfs/dbraw/zinc/15/91/44/941159144.db2.gz NGOYPTOHDRXGOQ-HXUWFJFHSA-N 0 0 356.422 3.707 20 5 FHBDRN Cc1csc([C@H](Nc2c3ccccc3n(C)c(=O)c2[N+](=O)[O-])C2CC2)n1 ZINC000892677991 941160310 /nfs/dbraw/zinc/16/03/10/941160310.db2.gz UMGTWPGZCXPWLK-CQSZACIVSA-N 0 0 370.434 3.775 20 5 FHBDRN O=C(Nc1cnc2ccccc2n1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000178242657 941210862 /nfs/dbraw/zinc/21/08/62/941210862.db2.gz QBPWRGPSCRMOPZ-UHFFFAOYSA-N 0 0 373.166 3.553 20 5 FHBDRN Cc1cc(F)c(Br)cc1NC(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000189636868 941235719 /nfs/dbraw/zinc/23/57/19/941235719.db2.gz ZKPIANMUCJGXGO-UHFFFAOYSA-N 0 0 367.174 3.986 20 5 FHBDRN C[C@@H](Nc1ccc(C(=O)Nc2ccncc2)cc1[N+](=O)[O-])c1ccccn1 ZINC000053140208 941237986 /nfs/dbraw/zinc/23/79/86/941237986.db2.gz YZXNDKYCNTYGAN-CYBMUJFWSA-N 0 0 363.377 3.810 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)Nc2cnn([C@H](C)C3CC3)c2)cc1[N+](=O)[O-] ZINC000189749293 941271076 /nfs/dbraw/zinc/27/10/76/941271076.db2.gz AGYVUIRPYUXXDP-QWHCGFSZSA-N 0 0 357.414 3.953 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCOCC2)c2ccccc21 ZINC000189848067 941288382 /nfs/dbraw/zinc/28/83/82/941288382.db2.gz BGHQLURIDYCKAY-UHFFFAOYSA-N 0 0 352.390 3.612 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC2(CCOCC2)c2ccccc21 ZINC000189857712 941290277 /nfs/dbraw/zinc/29/02/77/941290277.db2.gz MFCFOGUQIZDPPI-UHFFFAOYSA-N 0 0 352.390 3.612 20 5 FHBDRN COC[C@H](C)n1ccc(NCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)n1 ZINC000189884478 941293623 /nfs/dbraw/zinc/29/36/23/941293623.db2.gz BOEMMJYKCTZCSF-ZDUSSCGKSA-N 0 0 356.382 3.871 20 5 FHBDRN CCSCc1ccnc(NC(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)c1 ZINC000189865055 941294403 /nfs/dbraw/zinc/29/44/03/941294403.db2.gz PFXZLCGKZMJGSV-UHFFFAOYSA-N 0 0 361.423 3.812 20 5 FHBDRN CC[C@](C)(COc1ncccc1Cl)NC(=O)c1csc([N+](=O)[O-])c1 ZINC000178736874 941299569 /nfs/dbraw/zinc/29/95/69/941299569.db2.gz YUOCSROZDAFIKA-OAHLLOKOSA-N 0 0 369.830 3.682 20 5 FHBDRN C/C(=C/C(=O)NCc1cc(-c2ccccc2)no1)c1ccc([N+](=O)[O-])cc1 ZINC000785245648 941301618 /nfs/dbraw/zinc/30/16/18/941301618.db2.gz LNEZAQLTKYGKLX-KAMYIIQDSA-N 0 0 363.373 3.970 20 5 FHBDRN Cc1sc(S(=O)(=O)N(c2ccccc2)[C@H]2C[C@H]2C)cc1[N+](=O)[O-] ZINC000414475095 941305614 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FHBDRN Cc1nc2c(s1)[C@@H](Nc1cc3c(cc1[N+](=O)[O-])CCC(=O)N3)CCC2 ZINC000376638039 941370120 /nfs/dbraw/zinc/37/01/20/941370120.db2.gz VSOYEMBMLDZRAI-LBPRGKRZSA-N 0 0 358.423 3.734 20 5 FHBDRN Cc1cc(Br)oc1C(=O)N1c2ccc([N+](=O)[O-])cc2C[C@@H]1C ZINC000103375671 941379798 /nfs/dbraw/zinc/37/97/98/941379798.db2.gz GOEGSRASVZOABP-VIFPVBQESA-N 0 0 365.183 3.850 20 5 FHBDRN Cc1c([N+](=O)[O-])cc(C(=O)OCc2csc(C3CC3)n2)cc1[N+](=O)[O-] ZINC000782985466 941381621 /nfs/dbraw/zinc/38/16/21/941381621.db2.gz GYBYPZVIUGXZRR-UHFFFAOYSA-N 0 0 363.351 3.502 20 5 FHBDRN COCCSc1ccc([C@H](C)NC(=O)c2ccccc2[N+](=O)[O-])cc1 ZINC000103406058 941392742 /nfs/dbraw/zinc/39/27/42/941392742.db2.gz XYLAATYZMVHICF-ZDUSSCGKSA-N 0 0 360.435 3.824 20 5 FHBDRN CC(C)(CNC(=O)c1cccc2c(=O)c3ccccc3[nH]c12)C(F)(F)F ZINC000549120068 941398307 /nfs/dbraw/zinc/39/83/07/941398307.db2.gz QVHQXYFCDIQPJY-UHFFFAOYSA-N 0 0 362.351 4.000 20 5 FHBDRN CN(c1ccccc1)c1ccc(C[N@@H+]2CCCC[C@H]2C(=O)[O-])cc1[N+](=O)[O-] ZINC000414682996 941436013 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FHBDRN O=C(c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)N1CCC[C@@H](c2ccccc2)CC1 ZINC000066764051 941518654 /nfs/dbraw/zinc/51/86/54/941518654.db2.gz RTCUAGLAORFKBN-OAHLLOKOSA-N 0 0 369.377 3.913 20 5 FHBDRN Cc1cc(NC(=O)N2CC[C@@H](c3ccccc3)[C@@H](CO)C2)ccc1[N+](=O)[O-] ZINC000377114137 941523461 /nfs/dbraw/zinc/52/34/61/941523461.db2.gz LLWNZQYYNAOEOH-AEFFLSMTSA-N 0 0 369.421 3.533 20 5 FHBDRN Cc1cc(NCCn2cnnc2C(C)C)c([N+](=O)[O-])cc1C(F)(F)F ZINC000549146836 941526791 /nfs/dbraw/zinc/52/67/91/941526791.db2.gz ZYSLFHHNHBRPAZ-UHFFFAOYSA-N 0 0 357.336 3.749 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N2[C@@H]3CC[C@H]2C[C@@H](c2ccccc2)C3)c1[N+](=O)[O-] ZINC000549145411 941529918 /nfs/dbraw/zinc/52/99/18/941529918.db2.gz YEKCEAYVSSHHNP-MUJYYYPQSA-N 0 0 368.437 3.992 20 5 FHBDRN Cn1cc(-c2nc(COc3ccc([N+](=O)[O-])c4ncccc34)cs2)cn1 ZINC000613643462 941535389 /nfs/dbraw/zinc/53/53/89/941535389.db2.gz ZFYZWGSPHZCLBQ-UHFFFAOYSA-N 0 0 367.390 3.579 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCCC[C@H]1c1cc[nH]n1 ZINC000377163354 941537687 /nfs/dbraw/zinc/53/76/87/941537687.db2.gz ADVMQHOGZBPYFT-WBMJQRKESA-N 0 0 360.439 3.552 20 5 FHBDRN C[C@H](CSC(F)(F)F)C(=O)Nc1ccnn1-c1ccc([N+](=O)[O-])cc1 ZINC001125857034 941575708 /nfs/dbraw/zinc/57/57/08/941575708.db2.gz FVGOYIYVXBXJNM-SECBINFHSA-N 0 0 374.344 3.608 20 5 FHBDRN CO[C@@H](C)c1nc(CNC(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)cs1 ZINC000274293534 941598165 /nfs/dbraw/zinc/59/81/65/941598165.db2.gz RPSACYGLSVGZMZ-NSHDSACASA-N 0 0 364.427 3.697 20 5 FHBDRN CC(C)(C)C(=O)N1CCN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000128324868 941600894 /nfs/dbraw/zinc/60/08/94/941600894.db2.gz TWMKMXPNKYBANI-UHFFFAOYSA-N 0 0 371.437 3.545 20 5 FHBDRN Cc1nccn1-c1ccccc1CNc1ncnc2sc([N+](=O)[O-])cc21 ZINC000549184773 941605534 /nfs/dbraw/zinc/60/55/34/941605534.db2.gz UHXFPRQNVIQVPK-UHFFFAOYSA-N 0 0 366.406 3.706 20 5 FHBDRN CSCc1cccnc1C(=O)N1CCCCc2cc([N+](=O)[O-])ccc21 ZINC000892853535 941620536 /nfs/dbraw/zinc/62/05/36/941620536.db2.gz HIKBUOFXMSMTQO-UHFFFAOYSA-N 0 0 357.435 3.836 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)Nc1csc2ccccc12 ZINC000565690617 941634996 /nfs/dbraw/zinc/63/49/96/941634996.db2.gz WHDSNMRMAAREFB-UHFFFAOYSA-N 0 0 369.402 3.949 20 5 FHBDRN CC(=O)Nc1ccc(C(=O)N(c2cccc([N+](=O)[O-])c2)C2CCCC2)nc1 ZINC000541114629 941644260 /nfs/dbraw/zinc/64/42/60/941644260.db2.gz GTGURBNLBMZAFT-UHFFFAOYSA-N 0 0 368.393 3.538 20 5 FHBDRN CC(=O)c1ncc(C(=O)N(c2cccc([N+](=O)[O-])c2)C2CCCC2)s1 ZINC000415162713 941646205 /nfs/dbraw/zinc/64/62/05/941646205.db2.gz XBAWVLMDZOSNSF-UHFFFAOYSA-N 0 0 359.407 3.843 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2nc(-c3ccc[nH]3)cs2)c1 ZINC000549213802 941655616 /nfs/dbraw/zinc/65/56/16/941655616.db2.gz NISZCHAPFUFIJW-UHFFFAOYSA-N 0 0 358.379 3.697 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)c1ccc2nccnc2c1 ZINC000541130117 941669110 /nfs/dbraw/zinc/66/91/10/941669110.db2.gz ZCWGXNHQVFTLAL-UHFFFAOYSA-N 0 0 362.267 3.809 20 5 FHBDRN CC(C)(CCC(=O)Nc1cccc(-c2nnsc2Cl)c1)[N+](=O)[O-] ZINC000892914976 941679779 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CC(C)Oc1cc(C(=O)N(CC(F)(F)F)C2CCC2)ccc1[N+](=O)[O-] ZINC000415295591 941734672 /nfs/dbraw/zinc/73/46/72/941734672.db2.gz LVOQMBJNGPDRRX-UHFFFAOYSA-N 0 0 360.332 3.939 20 5 FHBDRN O=C(Cc1csc2nccn12)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000542987048 941745407 /nfs/dbraw/zinc/74/54/07/941745407.db2.gz CXOQJIAWXLYONT-UHFFFAOYSA-N 0 0 370.312 3.504 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)Nc1ccc(NC(=O)OC(C)(C)C)cc1 ZINC000729405240 941746772 /nfs/dbraw/zinc/74/67/72/941746772.db2.gz OOVPYPKYSNJKJX-UHFFFAOYSA-N 0 0 372.381 3.898 20 5 FHBDRN CC(=O)c1cc(-c2nc(Cc3ccc([N+](=O)[O-])c(C)c3)no2)c(C)nc1C ZINC000472776472 941752006 /nfs/dbraw/zinc/75/20/06/941752006.db2.gz JHBRULNRTHCXRA-UHFFFAOYSA-N 0 0 366.377 3.758 20 5 FHBDRN Cc1ccc(NC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)c(C[NH+](C)C)c1 ZINC000412117952 941794683 /nfs/dbraw/zinc/79/46/83/941794683.db2.gz WJKJSTDKHCMIHK-ZWKOTPCHSA-N 0 0 353.422 3.707 20 5 FHBDRN CN(Cc1c(F)cccc1Cl)C(=O)COc1cc(F)cc([N+](=O)[O-])c1 ZINC000433621129 941807869 /nfs/dbraw/zinc/80/78/69/941807869.db2.gz FRZQNSMUSUBHRM-UHFFFAOYSA-N 0 0 370.739 3.564 20 5 FHBDRN COC(=O)[C@H](C)[C@@H](NCc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000182348179 941813607 /nfs/dbraw/zinc/81/36/07/941813607.db2.gz WTRCOSTVWJYSQT-SJKOYZFVSA-N 0 0 362.813 3.888 20 5 FHBDRN C[C@@H](Sc1ccc(N)cc1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000513260038 941814324 /nfs/dbraw/zinc/81/43/24/941814324.db2.gz CXCUCFQLUYNLCX-SECBINFHSA-N 0 0 351.815 3.950 20 5 FHBDRN CN(C[C@@H]1CCC[C@@H]1O)C(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 ZINC000129331852 941815977 /nfs/dbraw/zinc/81/59/77/941815977.db2.gz CVDKRCAXAXULDA-KSSFIOAISA-N 0 0 370.405 3.620 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CC[C@H](Cc2ccccc2)C1 ZINC000412135655 941829564 /nfs/dbraw/zinc/82/95/64/941829564.db2.gz SZUKYOZPFUTJCZ-LSTHTHJFSA-N 0 0 350.418 3.790 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)NC(c2ccccc2)c2ccccc2)c1[N+](=O)[O-] ZINC000433680359 941831663 /nfs/dbraw/zinc/83/16/63/941831663.db2.gz ZUBSECQHBPCSIP-UHFFFAOYSA-N 0 0 364.405 3.961 20 5 FHBDRN O=[N+]([O-])c1ccc2nc(N3Cc4cnn(-c5ccccc5)c4C3)ccc2c1 ZINC000549284933 941837968 /nfs/dbraw/zinc/83/79/68/941837968.db2.gz DJZPOCSGQUZDHL-UHFFFAOYSA-N 0 0 357.373 3.849 20 5 FHBDRN C[C@H]1CCc2onc(C(=O)Nc3ccc4cc([N+](=O)[O-])ccc4n3)c2C1 ZINC000433693994 941844011 /nfs/dbraw/zinc/84/40/11/941844011.db2.gz FXRDBTBWKASTNJ-JTQLQIEISA-N 0 0 352.350 3.508 20 5 FHBDRN CCCCOC1CCN(C(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)CC1 ZINC000412149055 941845287 /nfs/dbraw/zinc/84/52/87/941845287.db2.gz BJIDOCMXXRVORY-UHFFFAOYSA-N 0 0 364.442 3.803 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CCOC[C@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000412157642 941853335 /nfs/dbraw/zinc/85/33/35/941853335.db2.gz GUFFXVDOVWRPOA-SFHVURJKSA-N 0 0 370.405 3.596 20 5 FHBDRN COc1c(C)cc(CN(C)C(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)cc1C ZINC000513331233 941856146 /nfs/dbraw/zinc/85/61/46/941856146.db2.gz DMBSDCRGOCNDRE-UHFFFAOYSA-N 0 0 367.405 3.974 20 5 FHBDRN O=C(c1ccc(OC(F)F)c([N+](=O)[O-])c1)N1CC[C@@H](CC(F)(F)F)C1 ZINC000433731159 941860051 /nfs/dbraw/zinc/86/00/51/941860051.db2.gz PSPBHKITZACIIX-QMMMGPOBSA-N 0 0 368.258 3.611 20 5 FHBDRN Cc1ccccc1C[C@H]1CCCN1C(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-] ZINC000433745581 941862323 /nfs/dbraw/zinc/86/23/23/941862323.db2.gz SCXTXKGCNKWVJE-OAHLLOKOSA-N 0 0 356.426 3.597 20 5 FHBDRN CCC(CC)n1ncc(C(=O)N(C)CCc2cccc([N+](=O)[O-])c2)c1C ZINC000513353102 941863257 /nfs/dbraw/zinc/86/32/57/941863257.db2.gz HHZSEXPPQMXZTH-UHFFFAOYSA-N 0 0 358.442 3.776 20 5 FHBDRN COc1ccccc1O[C@H]1CCCN(Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000513360972 941868163 /nfs/dbraw/zinc/86/81/63/941868163.db2.gz GUNRIHRERHKVHK-INIZCTEOSA-N 0 0 360.385 3.786 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@@]2(C)CCCc3ccccc32)c1 ZINC000549293508 941869430 /nfs/dbraw/zinc/86/94/30/941869430.db2.gz AXQKGMMBYLJGCW-FQEVSTJZSA-N 0 0 354.406 3.975 20 5 FHBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCC[C@@H](O)C1 ZINC000119091038 941870749 /nfs/dbraw/zinc/87/07/49/941870749.db2.gz WFFRTGLUZXZEOE-UKRRQHHQSA-N 0 0 366.483 3.624 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N[C@@H](C)c2nc(C(C)(C)C)cs2)c1[N+](=O)[O-] ZINC000433763726 941881458 /nfs/dbraw/zinc/88/14/58/941881458.db2.gz FIOHMPBNHDUFIX-VIFPVBQESA-N 0 0 365.459 3.686 20 5 FHBDRN Cc1c(NC(=O)[C@H](C)Cc2cnc3ccccc3n2)cccc1[N+](=O)[O-] ZINC000549300303 941883110 /nfs/dbraw/zinc/88/31/10/941883110.db2.gz QXMSGTOGJRXHJF-GFCCVEGCSA-N 0 0 350.378 3.664 20 5 FHBDRN CC(C)Oc1cc(C(=O)N(C)Cc2cc(Cl)cn2C)ccc1[N+](=O)[O-] ZINC000412185389 941883615 /nfs/dbraw/zinc/88/36/15/941883615.db2.gz QEDQCWWFVMTLEO-UHFFFAOYSA-N 0 0 365.817 3.646 20 5 FHBDRN O=C(NC1CC(C(F)(F)F)C1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000513390292 941886349 /nfs/dbraw/zinc/88/63/49/941886349.db2.gz NZZSXXQMXWDKSM-UHFFFAOYSA-N 0 0 357.332 3.610 20 5 FHBDRN C/C(=C/c1cccc([N+](=O)[O-])c1)CNc1ccc(CCS(C)(=O)=O)cc1 ZINC000468611929 941889429 /nfs/dbraw/zinc/88/94/29/941889429.db2.gz OIIALNGROPBWCR-QINSGFPZSA-N 0 0 374.462 3.697 20 5 FHBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)NCc1ccccc1OC1CCC1 ZINC000119634319 941891999 /nfs/dbraw/zinc/89/19/99/941891999.db2.gz WXALSIHADBXFFT-UHFFFAOYSA-N 0 0 369.421 3.568 20 5 FHBDRN CCO[C@H]1C[C@@H](N(C)C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)C12CCC2 ZINC000412195462 941898039 /nfs/dbraw/zinc/89/80/39/941898039.db2.gz PUGHEXZOPNITEG-MLHJIOFPSA-N 0 0 358.438 3.504 20 5 FHBDRN Cc1ccc(C)c(NC(=O)Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)c1 ZINC000103463507 941898083 /nfs/dbraw/zinc/89/80/83/941898083.db2.gz DIEYZNYRBLIABD-UHFFFAOYSA-N 0 0 350.378 3.714 20 5 FHBDRN O=C(c1sc(Br)cc1[N+](=O)[O-])N1CC[C@H](c2ccco2)C1 ZINC000365656540 941903652 /nfs/dbraw/zinc/90/36/52/941903652.db2.gz CCZVMHHNVOAPSB-QMMMGPOBSA-N 0 0 371.212 3.642 20 5 FHBDRN CCOc1cc(NC[C@H](C(=O)OC)c2ccc(F)cc2)ccc1[N+](=O)[O-] ZINC000433800244 941909480 /nfs/dbraw/zinc/90/94/80/941909480.db2.gz VHAUGJOQIUPLHP-HNNXBMFYSA-N 0 0 362.357 3.501 20 5 FHBDRN CC(C)Oc1cc(C(=O)NCCc2cc3ccccc3[nH]2)ccc1[N+](=O)[O-] ZINC000412203688 941912383 /nfs/dbraw/zinc/91/23/83/941912383.db2.gz VSZFVRYPJGCNOK-UHFFFAOYSA-N 0 0 367.405 3.836 20 5 FHBDRN CC(C)Oc1cc(C(=O)NC[C@@H]2[C@@H]3Cc4ccccc4[C@H]23)ccc1[N+](=O)[O-] ZINC000412206043 941912867 /nfs/dbraw/zinc/91/28/67/941912867.db2.gz MLRBSQPAJSHVMW-QKLQHJQFSA-N 0 0 366.417 3.698 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NCc1cccc2c1CCCN2 ZINC000415574285 941915211 /nfs/dbraw/zinc/91/52/11/941915211.db2.gz DIHGIVLHWCLFIW-UHFFFAOYSA-N 0 0 354.410 3.891 20 5 FHBDRN CN(Cc1cc(F)cc(F)c1)c1c(Br)cncc1[N+](=O)[O-] ZINC000433815494 941916070 /nfs/dbraw/zinc/91/60/70/941916070.db2.gz NESVWZZSSXNVCF-UHFFFAOYSA-N 0 0 358.142 3.667 20 5 FHBDRN Cc1ccc(C(=O)N[C@H]2CCO[C@@H]2c2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000182433991 941924819 /nfs/dbraw/zinc/92/48/19/941924819.db2.gz UMPBEBXVTIWBDP-DOTOQJQBSA-N 0 0 360.797 3.817 20 5 FHBDRN CC[C@@H](NC(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000433830871 941927183 /nfs/dbraw/zinc/92/71/83/941927183.db2.gz KJKBROREGVBAOU-GFCCVEGCSA-N 0 0 350.806 3.976 20 5 FHBDRN CC(C)CCn1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)n1 ZINC000182475048 941933297 /nfs/dbraw/zinc/93/32/97/941933297.db2.gz FWPRNKQEGKFETR-UHFFFAOYSA-N 0 0 368.340 3.691 20 5 FHBDRN CCOc1cc(Cl)ccc1C(=O)Nc1ccc(OC)cc1[N+](=O)[O-] ZINC000182493085 941934263 /nfs/dbraw/zinc/93/42/63/941934263.db2.gz NQPHFMPYHCACKN-UHFFFAOYSA-N 0 0 350.758 3.908 20 5 FHBDRN CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F)[C@@H]1CCc2ccccc21 ZINC000182511014 941936689 /nfs/dbraw/zinc/93/66/89/941936689.db2.gz OYSCWVJGDWVCFN-OAHLLOKOSA-N 0 0 362.332 3.956 20 5 FHBDRN O=C(N[C@@H](c1ccccc1)[C@@H]1CCOC1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412227229 941937518 /nfs/dbraw/zinc/93/75/18/941937518.db2.gz JFSNAOCWRFCBRD-MDNKFWRPSA-N 0 0 366.417 3.592 20 5 FHBDRN O=C(NCC1(Cc2ccc(F)cc2)CC1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412223334 941939487 /nfs/dbraw/zinc/93/94/87/941939487.db2.gz DCEQXEQLPOKFFF-RBUKOAKNSA-N 0 0 368.408 3.977 20 5 FHBDRN CC(C)Oc1cc(C(=O)N[C@H]2CCO[C@@H](C(C)(C)C)C2)ccc1[N+](=O)[O-] ZINC000412230107 941942374 /nfs/dbraw/zinc/94/23/74/941942374.db2.gz KRFUNZOKKQYXKW-WMLDXEAASA-N 0 0 364.442 3.706 20 5 FHBDRN CO[C@@H](c1ccccc1F)[C@@H](C)NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412229624 941942671 /nfs/dbraw/zinc/94/26/71/941942671.db2.gz HVAHYXJTFVCDJL-UMBPUVEWSA-N 0 0 372.396 3.730 20 5 FHBDRN COc1ccc([C@H](NC(=O)c2cc([N+](=O)[O-])ccc2C)C(F)(F)F)cc1 ZINC000182640232 941956981 /nfs/dbraw/zinc/95/69/81/941956981.db2.gz AIHWPORJEVKRAQ-HNNXBMFYSA-N 0 0 368.311 3.945 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)NCc1ccc2c(c1)CCCN2 ZINC000415659660 941982246 /nfs/dbraw/zinc/98/22/46/941982246.db2.gz OQFXCZQQAVMTGE-UHFFFAOYSA-N 0 0 370.409 3.673 20 5 FHBDRN O=C(NCCc1coc(-c2ccc(F)cc2)n1)c1ccc([N+](=O)[O-])cc1F ZINC000101531826 941984483 /nfs/dbraw/zinc/98/44/83/941984483.db2.gz AQCIIJDPNLSBCC-UHFFFAOYSA-N 0 0 373.315 3.501 20 5 FHBDRN O=C(NCCc1coc(-c2ccc(F)cc2)n1)c1cc(F)ccc1[N+](=O)[O-] ZINC000101531730 941984487 /nfs/dbraw/zinc/98/44/87/941984487.db2.gz QYRXWLZBORLGJK-UHFFFAOYSA-N 0 0 373.315 3.501 20 5 FHBDRN Cc1ccc(SC[C@@H](C)NC(=O)NCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000472863175 941984986 /nfs/dbraw/zinc/98/49/86/941984986.db2.gz STRWKRZBTPBKFD-CQSZACIVSA-N 0 0 359.451 3.883 20 5 FHBDRN CN(C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000377792478 941991867 /nfs/dbraw/zinc/99/18/67/941991867.db2.gz YBMPLSSGZYCPHW-LERXQTSPSA-N 0 0 353.806 3.525 20 5 FHBDRN CC(C)COC[C@H](NC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc21)c1ccco1 ZINC000101671263 941999580 /nfs/dbraw/zinc/99/95/80/941999580.db2.gz ZNTQILCNARLRID-KRWDZBQOSA-N 0 0 371.393 3.813 20 5 FHBDRN Cc1ccc([C@@]2(C)CCN(C(=O)CCOc3ccccc3[N+](=O)[O-])C2)cc1 ZINC000433953203 942014412 /nfs/dbraw/zinc/01/44/12/942014412.db2.gz ZCYULGIWEFXEPX-NRFANRHFSA-N 0 0 368.433 3.862 20 5 FHBDRN Cc1c(C(=O)N(Cc2ccncc2)Cc2cccnc2)cccc1[N+](=O)[O-] ZINC000072576831 942017662 /nfs/dbraw/zinc/01/76/62/942017662.db2.gz DNKRNPMJPBCEEM-UHFFFAOYSA-N 0 0 362.389 3.536 20 5 FHBDRN CC(C)(C)c1ccc(NC(=O)N2CCC3(C2)CCOCC3)cc1[N+](=O)[O-] ZINC000408052459 942020985 /nfs/dbraw/zinc/02/09/85/942020985.db2.gz PLXNIWSPWLEQTD-UHFFFAOYSA-N 0 0 361.442 3.927 20 5 FHBDRN CC(C)(C)OCc1cccc(CNC(=O)CNc2ccccc2[N+](=O)[O-])c1 ZINC000101883209 942022119 /nfs/dbraw/zinc/02/21/19/942022119.db2.gz BSIYNSOLOKNDAT-UHFFFAOYSA-N 0 0 371.437 3.638 20 5 FHBDRN CCCNC(=O)c1cccc(NC(=O)c2c(Cl)cccc2[N+](=O)[O-])c1 ZINC000110217378 942024856 /nfs/dbraw/zinc/02/48/56/942024856.db2.gz FSTQXCQBRNXCGD-UHFFFAOYSA-N 0 0 361.785 3.640 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCCCOc1ccc(F)cc1 ZINC000085621012 942031190 /nfs/dbraw/zinc/03/11/90/942031190.db2.gz APQWBSPJXWLRSF-UHFFFAOYSA-N 0 0 361.373 3.941 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H]1CCCc2cc(N)ccc21 ZINC000415766761 942042696 /nfs/dbraw/zinc/04/26/96/942042696.db2.gz SUEKOVTVKVLEHS-KRWDZBQOSA-N 0 0 354.410 3.939 20 5 FHBDRN Cc1c([C@@H]2CCCN2C(=O)Nc2cccc([N+](=O)[O-])c2Cl)cnn1C ZINC000377872188 942044634 /nfs/dbraw/zinc/04/46/34/942044634.db2.gz CPAOSIMWQINTCV-ZDUSSCGKSA-N 0 0 363.805 3.659 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1Cl)N1CCC(C2CCOCC2)CC1 ZINC000377875168 942045994 /nfs/dbraw/zinc/04/59/94/942045994.db2.gz RBRPJMPXFVTZEF-UHFFFAOYSA-N 0 0 367.833 3.919 20 5 FHBDRN C[C@@H](NC(=O)c1cc([N+](=O)[O-])c[nH]1)c1cccc(OCc2ccccc2)c1 ZINC000434055544 942058002 /nfs/dbraw/zinc/05/80/02/942058002.db2.gz YHICLJFBVHNPQH-CQSZACIVSA-N 0 0 365.389 3.993 20 5 FHBDRN O=C(COc1ccc(F)cc1[N+](=O)[O-])Nc1ccc(OC(F)(F)F)cc1 ZINC000102599992 942072643 /nfs/dbraw/zinc/07/26/43/942072643.db2.gz CEMMLVYTXNYTBL-UHFFFAOYSA-N 0 0 374.246 3.650 20 5 FHBDRN C[C@@H](NC(=O)Nc1cc(-c2ccccc2F)on1)c1cccc([N+](=O)[O-])c1 ZINC000434082544 942072745 /nfs/dbraw/zinc/07/27/45/942072745.db2.gz XVNGIHJZPVHRDB-LLVKDONJSA-N 0 0 370.340 3.694 20 5 FHBDRN Cc1nc2ccccc2n1C1CCN(c2ccc([N+](=O)[O-])c(N)c2F)CC1 ZINC000480850714 942080559 /nfs/dbraw/zinc/08/05/59/942080559.db2.gz YIHPODCTUFEAGO-UHFFFAOYSA-N 0 0 369.400 3.816 20 5 FHBDRN CCCN(CC(F)F)C(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000120691102 942080658 /nfs/dbraw/zinc/08/06/58/942080658.db2.gz LGROZWZIMBYNAZ-UHFFFAOYSA-N 0 0 365.174 3.783 20 5 FHBDRN Cc1c(-c2noc(-c3cc(COC(C)(C)C)on3)n2)cccc1[N+](=O)[O-] ZINC000420502531 942085165 /nfs/dbraw/zinc/08/51/65/942085165.db2.gz RGAAAKIKQMQHDN-UHFFFAOYSA-N 0 0 358.354 3.923 20 5 FHBDRN CCC(=O)c1ccc(NCc2ccc(C(=O)N(C)C)cc2)c([N+](=O)[O-])c1 ZINC000280052954 942098075 /nfs/dbraw/zinc/09/80/75/942098075.db2.gz NREDVZIWJLVHBS-UHFFFAOYSA-N 0 0 355.394 3.501 20 5 FHBDRN CCCOc1ccc([C@H](C)Nc2c(C(N)=O)cccc2[N+](=O)[O-])cc1OC ZINC000420584532 942107736 /nfs/dbraw/zinc/10/77/36/942107736.db2.gz KWZAHMFMKGMJJN-LBPRGKRZSA-N 0 0 373.409 3.664 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1Cc2ccccc2[C@@H]1OC ZINC000415890927 942111366 /nfs/dbraw/zinc/11/13/66/942111366.db2.gz FOYAGFMNIKWFAX-AEFFLSMTSA-N 0 0 372.446 3.749 20 5 FHBDRN O=c1c(Br)cc([N+](=O)[O-])cn1Cc1ccc(C(F)F)cc1 ZINC000460805354 942113644 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Nc1ccc(SCC(=O)N2CCc3ccc([N+](=O)[O-])cc32)c(Cl)c1 ZINC000502134164 942238475 /nfs/dbraw/zinc/23/84/75/942238475.db2.gz ZFIFUPFUMMIDPE-UHFFFAOYSA-N 0 0 363.826 3.512 20 5 FHBDRN O=c1c([N+](=O)[O-])cc(Cl)cn1Cc1cc(Cl)cc2cccnc21 ZINC000502135263 942238923 /nfs/dbraw/zinc/23/89/23/942238923.db2.gz JJRVRAMBBHICOJ-UHFFFAOYSA-N 0 0 350.161 3.660 20 5 FHBDRN C[C@H](NC(=O)N[C@@H]1c2ccc(F)cc2O[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000480970584 942245786 /nfs/dbraw/zinc/24/57/86/942245786.db2.gz YQVAHKOCVCWUDP-RVPKQNPDSA-N 0 0 359.357 3.616 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N[C@@H](c1ccc(Cl)cc1)C1CC1 ZINC000015580212 942246313 /nfs/dbraw/zinc/24/63/13/942246313.db2.gz KLVRQZOFNDIMRP-GOSISDBHSA-N 0 0 360.797 3.895 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)OCC(=O)c2ccc(C)c(C)c2)c1 ZINC000016196106 942247181 /nfs/dbraw/zinc/24/71/81/942247181.db2.gz XFSJOYDRKQQDRK-UHFFFAOYSA-N 0 0 359.403 3.973 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)O[C@H](C)C(=O)Nc2ccccc2C)c1 ZINC000016196715 942247937 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Cc1cnc([C@@H]2CCCN(C(=O)CCc3cccc([N+](=O)[O-])c3)C2)s1 ZINC000378089256 942263462 /nfs/dbraw/zinc/26/34/62/942263462.db2.gz NTHDRCUYSNWPLJ-OAHLLOKOSA-N 0 0 359.451 3.699 20 5 FHBDRN COc1ccc(C2(CNC(=O)c3ccc([N+](=O)[O-])n3C)CCCCC2)cc1 ZINC000502158648 942266352 /nfs/dbraw/zinc/26/63/52/942266352.db2.gz IPOPNUCYONQAEU-UHFFFAOYSA-N 0 0 371.437 3.574 20 5 FHBDRN COc1ccc(S[C@@H](C)C(=O)OCc2ccc([N+](=O)[O-])c(F)c2)cc1 ZINC000783075867 942270150 /nfs/dbraw/zinc/27/01/50/942270150.db2.gz MDOBOLCFJOGJPY-NSHDSACASA-N 0 0 365.382 3.967 20 5 FHBDRN CC(C)[C@H](NC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-])C(F)(F)F ZINC000416021805 942273324 /nfs/dbraw/zinc/27/33/24/942273324.db2.gz YNIDIAFIUVUWOG-JTQLQIEISA-N 0 0 358.238 3.930 20 5 FHBDRN CC(C)NC(=O)N(C)c1ccc(OCc2c(F)cccc2[N+](=O)[O-])cc1 ZINC000103463004 942274062 /nfs/dbraw/zinc/27/40/62/942274062.db2.gz TYAFKUBNPDKBCR-UHFFFAOYSA-N 0 0 361.373 3.867 20 5 FHBDRN CCCOc1ccc(NC(=O)c2ccc([N+](=O)[O-])n2C)cc1OCCC ZINC000502191123 942276961 /nfs/dbraw/zinc/27/69/61/942276961.db2.gz YSOBNGQMIHRJOY-UHFFFAOYSA-N 0 0 361.398 3.763 20 5 FHBDRN C[C@@H]1CC[C@@H](C)N(C(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])C1 ZINC000072545995 942279130 /nfs/dbraw/zinc/27/91/30/942279130.db2.gz BWQRMNMANPQCMN-GHMZBOCLSA-N 0 0 360.332 3.797 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1cccc(O)c1)N1CCS[C@@H]1c1ccc([N+](=O)[O-])cc1 ZINC000413507730 942281512 /nfs/dbraw/zinc/28/15/12/942281512.db2.gz CGSYHQWYRZOSQW-YQVWRLOYSA-N 0 0 370.430 3.678 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NCc1ncc(-c2ccccc2)o1 ZINC000122858669 942285672 /nfs/dbraw/zinc/28/56/72/942285672.db2.gz LYPMJTSUXFAOQM-UHFFFAOYSA-N 0 0 368.349 3.580 20 5 FHBDRN C[C@H](NC(=O)c1[nH]ncc1[N+](=O)[O-])c1ccc(Oc2ccccc2)c(F)c1 ZINC000137036011 942286765 /nfs/dbraw/zinc/28/67/65/942286765.db2.gz INLURCFAXCBDRK-NSHDSACASA-N 0 0 370.340 3.740 20 5 FHBDRN COc1ccc(C(=O)Oc2ccc(F)c3c2C(=O)C[C@@H]3C)cc1[N+](=O)[O-] ZINC000015634958 942287555 /nfs/dbraw/zinc/28/75/55/942287555.db2.gz VLVAEYFZVQCGEG-VIFPVBQESA-N 0 0 359.309 3.652 20 5 FHBDRN O=C(c1csc([N+](=O)[O-])c1)N1CCC[C@H]1Cc1cc(F)ccc1F ZINC000416044521 942290891 /nfs/dbraw/zinc/29/08/91/942290891.db2.gz ITDJFNIIOJQPIZ-ZDUSSCGKSA-N 0 0 352.362 3.782 20 5 FHBDRN CCC(=O)c1ccc(NC[C@@H]2CCO[C@H]2c2cnn(CC)c2)c([N+](=O)[O-])c1 ZINC000413517126 942291175 /nfs/dbraw/zinc/29/11/75/942291175.db2.gz OPWFCUMJEYOGRH-IFXJQAMLSA-N 0 0 372.425 3.594 20 5 FHBDRN CO[C@@H](CSCCC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000419534484 942292349 /nfs/dbraw/zinc/29/23/49/942292349.db2.gz PZYZSXFOBPRWGF-MRXNPFEDSA-N 0 0 374.462 3.914 20 5 FHBDRN CCN(C(=O)CCn1cc([N+](=O)[O-])nc1C)c1cccc(C(F)(F)F)c1 ZINC000416048964 942295519 /nfs/dbraw/zinc/29/55/19/942295519.db2.gz XIGIINUZDHVKRX-UHFFFAOYSA-N 0 0 370.331 3.562 20 5 FHBDRN C[C@@H](SCc1ccc(C(N)=O)cc1[N+](=O)[O-])c1nc2ccccc2o1 ZINC000183472053 942295680 /nfs/dbraw/zinc/29/56/80/942295680.db2.gz OPUWVTRPWKVCIP-SNVBAGLBSA-N 0 0 357.391 3.829 20 5 FHBDRN Cc1ccccc1[C@H]1CCN(S(=O)(=O)c2c(C)ccc(C)c2[N+](=O)[O-])C1 ZINC000481053021 942299692 /nfs/dbraw/zinc/29/96/92/942299692.db2.gz PBBNXBXGRHDTRY-INIZCTEOSA-N 0 0 374.462 3.698 20 5 FHBDRN Cc1cc(NCCC(C)(C)S(C)(=O)=O)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000413525383 942301271 /nfs/dbraw/zinc/30/12/71/942301271.db2.gz ZDVJSHWXQGWCAD-UHFFFAOYSA-N 0 0 368.377 3.547 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CCO[C@H](c3ccccc3F)C2)c(C(F)(F)F)c1 ZINC000413120401 942304475 /nfs/dbraw/zinc/30/44/75/942304475.db2.gz QRIFXNRELCADPN-AWEZNQCLSA-N 0 0 371.290 3.726 20 5 FHBDRN Cc1ccc(Cl)cc1NC(=O)[C@H](C)OC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000015653025 942306453 /nfs/dbraw/zinc/30/64/53/942306453.db2.gz FRSMBBKUCLNNIZ-NSHDSACASA-N 0 0 362.769 3.741 20 5 FHBDRN Cc1ccc(C)c(NC(=O)[C@@H](C)OC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)c1 ZINC000015655010 942306610 /nfs/dbraw/zinc/30/66/10/942306610.db2.gz FWDRZHFGJUGEMP-KUCQQTCKSA-N 0 0 368.389 3.795 20 5 FHBDRN Cc1nccn1CCCN(C)C(=O)Nc1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000501105479 942310106 /nfs/dbraw/zinc/31/01/06/942310106.db2.gz BLTYISJREFVIBN-UHFFFAOYSA-N 0 0 373.457 3.951 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CCO[C@@H](c3cccc(F)c3)C2)c(C(F)(F)F)c1 ZINC000413116382 942311429 /nfs/dbraw/zinc/31/14/29/942311429.db2.gz HDIGUWGMDKQBFX-CQSZACIVSA-N 0 0 371.290 3.726 20 5 FHBDRN CC[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1SCCOC)[C@@H]1CC1(C)C ZINC000416067362 942314447 /nfs/dbraw/zinc/31/44/47/942314447.db2.gz BYHQNIBWJZMBPF-GJZGRUSLSA-N 0 0 366.483 3.888 20 5 FHBDRN CC[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1SCCOC)[C@@H]1CC1(C)C ZINC000416067364 942314635 /nfs/dbraw/zinc/31/46/35/942314635.db2.gz BYHQNIBWJZMBPF-LSDHHAIUSA-N 0 0 366.483 3.888 20 5 FHBDRN O=C(NCc1cnc2ccccc2c1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513739207 942318240 /nfs/dbraw/zinc/31/82/40/942318240.db2.gz FUHMUAQRKTVIIR-UHFFFAOYSA-N 0 0 373.315 3.674 20 5 FHBDRN COc1cc2nc(C)sc2cc1NC(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000549398108 942319151 /nfs/dbraw/zinc/31/91/51/942319151.db2.gz OYUKPMXBPCMJRU-UHFFFAOYSA-N 0 0 372.406 3.843 20 5 FHBDRN CSc1cccc(C(=O)NC[C@H]2CCN(c3ccccc3)C2)c1[N+](=O)[O-] ZINC000188045518 942319462 /nfs/dbraw/zinc/31/94/62/942319462.db2.gz HKKPRJLEKNSZPS-CQSZACIVSA-N 0 0 371.462 3.573 20 5 FHBDRN O=[N+]([O-])c1c(N[C@@H](CO)c2c(Cl)cccc2Cl)nc2sccn21 ZINC000481080186 942323103 /nfs/dbraw/zinc/32/31/03/942323103.db2.gz YJYGOKFZHGURQR-VIFPVBQESA-N 0 0 373.221 3.756 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cn1)N1CCc2sccc2[C@@H]1c1cccs1 ZINC000378158516 942341401 /nfs/dbraw/zinc/34/14/01/942341401.db2.gz NJEMHWKPLFDYNP-MRXNPFEDSA-N 0 0 371.443 3.901 20 5 FHBDRN C[C@@H]1CCN(S(=O)(=O)c2c(Cl)cc(Cl)cc2[N+](=O)[O-])C[C@H]1C ZINC000501177882 942342302 /nfs/dbraw/zinc/34/23/02/942342302.db2.gz LBCCVKBQGSLVJW-RKDXNWHRSA-N 0 0 367.254 3.568 20 5 FHBDRN CC[C@H](NC(=O)Nc1c(C)ccc([N+](=O)[O-])c1C)c1c(C)nn(C)c1C ZINC000085637142 942342658 /nfs/dbraw/zinc/34/26/58/942342658.db2.gz XRONAZIBKIDCPC-AWEZNQCLSA-N 0 0 359.430 3.835 20 5 FHBDRN CC(C)NC(=O)[C@H]1CCC[C@H](Nc2nccc3ccc([N+](=O)[O-])cc32)C1 ZINC000413149276 942343651 /nfs/dbraw/zinc/34/36/51/942343651.db2.gz ROXSCLPDWPKJQM-GJZGRUSLSA-N 0 0 356.426 3.638 20 5 FHBDRN COc1cc(C(=O)N[C@H](c2ncc(C)s2)C2CC2)cc([N+](=O)[O-])c1C ZINC000188136395 942344812 /nfs/dbraw/zinc/34/48/12/942344812.db2.gz NPLZQKXTBGMWSN-HNNXBMFYSA-N 0 0 361.423 3.558 20 5 FHBDRN O=C(Nc1ccnn1-c1ccc([N+](=O)[O-])cc1)c1cccc(OC(F)F)c1 ZINC000103931077 942346540 /nfs/dbraw/zinc/34/65/40/942346540.db2.gz LSEOROILKSHRJR-UHFFFAOYSA-N 0 0 374.303 3.634 20 5 FHBDRN O=C(Cc1c(F)cccc1Cl)Nc1ccnn1-c1ccc([N+](=O)[O-])cc1 ZINC000103931121 942347189 /nfs/dbraw/zinc/34/71/89/942347189.db2.gz CWEVCPUZGPJXHI-UHFFFAOYSA-N 0 0 374.759 3.754 20 5 FHBDRN O=C(CSc1ccccc1[N+](=O)[O-])Nc1csc(-c2ccncc2)n1 ZINC001268826656 942347954 /nfs/dbraw/zinc/34/79/54/942347954.db2.gz QJMYYIAVKFTASO-UHFFFAOYSA-N 0 0 372.431 3.844 20 5 FHBDRN O=C1CC[C@@H](c2cccc(Nc3ncc([N+](=O)[O-])cc3C(F)(F)F)c2)N1 ZINC000413553641 942348807 /nfs/dbraw/zinc/34/88/07/942348807.db2.gz AWFWXAAMCHGALB-ZDUSSCGKSA-N 0 0 366.299 3.703 20 5 FHBDRN CC(C)Oc1ncc(C(=O)OCc2ccc([N+](=O)[O-])c(F)c2)cc1Cl ZINC000783087319 942350725 /nfs/dbraw/zinc/35/07/25/942350725.db2.gz UKPNTUPNDIHUIM-UHFFFAOYSA-N 0 0 368.748 3.927 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)Nc1cccc(-c2ncc[nH]2)c1 ZINC000103965655 942351160 /nfs/dbraw/zinc/35/11/60/942351160.db2.gz CFJJBSBANAJGOO-UHFFFAOYSA-N 0 0 365.393 3.816 20 5 FHBDRN O=C1CCCN1[C@@H]1CCCN(c2c(Cl)cc(Cl)cc2[N+](=O)[O-])CC1 ZINC000413567256 942355889 /nfs/dbraw/zinc/35/58/89/942355889.db2.gz KQDQSRSEOFIKQR-GFCCVEGCSA-N 0 0 372.252 3.883 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN(C)[C@@H](C)c1cc(F)ccc1F ZINC000072578501 942361526 /nfs/dbraw/zinc/36/15/26/942361526.db2.gz OAWOPOBFXXVUSB-LBPRGKRZSA-N 0 0 363.364 3.813 20 5 FHBDRN COCc1nc(CNc2ccc(Br)cc2[N+](=O)[O-])cs1 ZINC000290690282 942363968 /nfs/dbraw/zinc/36/39/68/942363968.db2.gz MIPNZNYNWRLLFX-UHFFFAOYSA-N 0 0 358.217 3.572 20 5 FHBDRN Cc1cc(F)cc([C@@]2(F)CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)C2)c1 ZINC000501252855 942365209 /nfs/dbraw/zinc/36/52/09/942365209.db2.gz JWUPRPLWWSATMO-GOSISDBHSA-N 0 0 364.323 3.892 20 5 FHBDRN Cc1cc(F)cc([C@@]2(F)CCN(C(=O)Cc3ccccc3[N+](=O)[O-])C2)c1 ZINC000501253843 942365981 /nfs/dbraw/zinc/36/59/81/942365981.db2.gz OLKGEAVMVUIILM-LJQANCHMSA-N 0 0 360.360 3.682 20 5 FHBDRN CSc1cccc(F)c1CNC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412329025 942369371 /nfs/dbraw/zinc/36/93/71/942369371.db2.gz DJBUQTBDVPBSBB-UONOGXRCSA-N 0 0 360.410 3.876 20 5 FHBDRN Cc1ccc([C@@H]2CCC[C@H]2N(C)c2ccc3ncc([N+](=O)[O-])n3n2)cc1 ZINC000502341738 942370412 /nfs/dbraw/zinc/37/04/12/942370412.db2.gz QXDSEWRRNNZMSP-JKSUJKDBSA-N 0 0 351.410 3.718 20 5 FHBDRN Cc1cccc(N2CCN(C(=O)c3ccc(Cl)cc3[N+](=O)[O-])CC2)c1 ZINC000016279017 942373094 /nfs/dbraw/zinc/37/30/94/942373094.db2.gz FGQJAHYNDCQXEH-UHFFFAOYSA-N 0 0 359.813 3.519 20 5 FHBDRN Cc1c(C(=O)N2CCC(c3ncccc3Cl)CC2)cccc1[N+](=O)[O-] ZINC000366791819 942373602 /nfs/dbraw/zinc/37/36/02/942373602.db2.gz DKXIFAXNOHWLRX-UHFFFAOYSA-N 0 0 359.813 3.971 20 5 FHBDRN COc1cc(CN(C)Cc2ccccc2)c([N+](=O)[O-])cc1OCC(F)F ZINC000183242382 942379443 /nfs/dbraw/zinc/37/94/43/942379443.db2.gz SQQMLOIMGVJGFU-UHFFFAOYSA-N 0 0 366.364 3.879 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])c2ncccc12)c1cncn1-c1ccccc1 ZINC001268849568 942406074 /nfs/dbraw/zinc/40/60/74/942406074.db2.gz KHCQPDVWOWUXKJ-UHFFFAOYSA-N 0 0 359.345 3.581 20 5 FHBDRN Cc1ccc(C(=O)NCc2ccc(OC3CCCC3)nc2)cc1[N+](=O)[O-] ZINC000501324072 942411097 /nfs/dbraw/zinc/41/10/97/942411097.db2.gz OMUDRURPXIQOOB-UHFFFAOYSA-N 0 0 355.394 3.550 20 5 FHBDRN CC(=Cc1cccc([N+](=O)[O-])c1)CNc1cc(C)n(CC(F)(F)F)n1 ZINC000419836521 942415177 /nfs/dbraw/zinc/41/51/77/942415177.db2.gz XXYWNOUIOVUSSR-WDZFZDKYSA-N 0 0 354.332 3.599 20 5 FHBDRN CC1CCN(c2ccc(C(=O)NCC3(C4CC4)CC3)cc2[N+](=O)[O-])CC1 ZINC000501333129 942416139 /nfs/dbraw/zinc/41/61/39/942416139.db2.gz ZKRIQVAQWWLTGP-UHFFFAOYSA-N 0 0 357.454 3.751 20 5 FHBDRN O=C(NC1(Cc2ccccc2)CCC1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000413629711 942431339 /nfs/dbraw/zinc/43/13/39/942431339.db2.gz TXCVESVRJDGQKU-RBUKOAKNSA-N 0 0 350.418 3.980 20 5 FHBDRN CCCn1c2ccccc2n(CC)c1=NC(=O)c1cc(C)ccc1[N+](=O)[O-] ZINC001269105475 942434195 /nfs/dbraw/zinc/43/41/95/942434195.db2.gz HCNFOLWGRNZODS-UHFFFAOYSA-N 0 0 366.421 3.830 20 5 FHBDRN COc1ccc(OC)c([C@@H]2CCCN2C(=O)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000015828151 942435423 /nfs/dbraw/zinc/43/54/23/942435423.db2.gz BNJJYRBPRVQZLM-KRWDZBQOSA-N 0 0 370.405 3.898 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CCc3c(F)ccc(F)c3C2)c(C(F)(F)F)c1 ZINC000413181960 942436794 /nfs/dbraw/zinc/43/67/94/942436794.db2.gz GASGIVPKAKQQFQ-UHFFFAOYSA-N 0 0 359.254 3.850 20 5 FHBDRN CCCN(C(=O)c1ccc(C)c([N+](=O)[O-])c1)[C@@H](C)C(=O)Nc1ccccc1 ZINC000502423256 942437359 /nfs/dbraw/zinc/43/73/59/942437359.db2.gz BHBLXFPKEYREDK-HNNXBMFYSA-N 0 0 369.421 3.783 20 5 FHBDRN CCCN(C(=O)c1ccc(C)c([N+](=O)[O-])c1)[C@H](C)C(=O)Nc1ccccc1 ZINC000502423257 942438042 /nfs/dbraw/zinc/43/80/42/942438042.db2.gz BHBLXFPKEYREDK-OAHLLOKOSA-N 0 0 369.421 3.783 20 5 FHBDRN Cc1cc(NC(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc2n[nH]cc21 ZINC000501395865 942448716 /nfs/dbraw/zinc/44/87/16/942448716.db2.gz PNLOMIPMHYJPOD-GFCCVEGCSA-N 0 0 353.382 3.971 20 5 FHBDRN CC[C@H](NC(=O)N1CCOc2ccc([N+](=O)[O-])cc2C1)c1ccccc1 ZINC000413647005 942457510 /nfs/dbraw/zinc/45/75/10/942457510.db2.gz IOFNBFXBCJTPSM-KRWDZBQOSA-N 0 0 355.394 3.650 20 5 FHBDRN O=[N+]([O-])c1cnccc1N1CCO[C@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000066815599 942464207 /nfs/dbraw/zinc/46/42/07/942464207.db2.gz WPCXKMWOYBFISK-HNNXBMFYSA-N 0 0 354.193 3.875 20 5 FHBDRN C[C@@H](c1ccc([N+](=O)[O-])cc1)N1C(=O)[C@@H]2C[C@H](C3CCCCC3)CN2C1=O ZINC000419968460 942471818 /nfs/dbraw/zinc/47/18/18/942471818.db2.gz PZFMEINPFVIYSH-OWQGQXMQSA-N 0 0 371.437 3.889 20 5 FHBDRN CC(C)(C(=O)N[C@@H]1C[C@]1(F)c1ccccc1)c1ccc([N+](=O)[O-])cc1F ZINC000424993166 942477329 /nfs/dbraw/zinc/47/73/29/942477329.db2.gz HJAHBCPKGMPYCO-APWZRJJASA-N 0 0 360.360 3.765 20 5 FHBDRN O=C(Nc1ccncc1[N+](=O)[O-])N1CCC[C@H]1c1nc2ccccc2s1 ZINC000183548081 942478344 /nfs/dbraw/zinc/47/83/44/942478344.db2.gz RHIBGNDITVONMH-ZDUSSCGKSA-N 0 0 369.406 3.969 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc([C@@H]2CCCOC2)cc1 ZINC000502499661 942479934 /nfs/dbraw/zinc/47/99/34/942479934.db2.gz GKOUKDHZMLAATE-OAHLLOKOSA-N 0 0 356.378 3.750 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1C[C@@]1(F)c1ccccc1 ZINC000424979097 942485246 /nfs/dbraw/zinc/48/52/46/942485246.db2.gz XPAURIHTYCSTFE-ULFGMLNVSA-N 0 0 360.410 3.829 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H](C(F)(F)F)C2(CCC2)C1 ZINC000366882962 942485554 /nfs/dbraw/zinc/48/55/54/942485554.db2.gz NAAJKAOYFUQBMD-CQSZACIVSA-N 0 0 372.343 3.798 20 5 FHBDRN CN1CC[C@@H](Nc2ncc([N+](=O)[O-])cc2F)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000413212426 942487138 /nfs/dbraw/zinc/48/71/38/942487138.db2.gz YSKZOARHPCJHPV-CABCVRRESA-N 0 0 368.771 3.779 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N[C@H](C)c1ccc(-n2cccn2)c(F)c1 ZINC000505373557 942493048 /nfs/dbraw/zinc/49/30/48/942493048.db2.gz 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O=C(c1cccc([N+](=O)[O-])c1)N1CCC(c2nc3c(s2)CCCC3)CC1 ZINC000425019927 942505333 /nfs/dbraw/zinc/50/53/33/942505333.db2.gz LRHVOYYZCJCZES-UHFFFAOYSA-N 0 0 371.462 3.950 20 5 FHBDRN CCCCn1cc(CNc2ncc([N+](=O)[O-])cc2C(F)(F)F)c(C)n1 ZINC000413221447 942505716 /nfs/dbraw/zinc/50/57/16/942505716.db2.gz JGMVHQFQLKWBNM-UHFFFAOYSA-N 0 0 357.336 3.926 20 5 FHBDRN Cn1ccnc1[C@@H](NCC(C)(C)C(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000549410200 942506634 /nfs/dbraw/zinc/50/66/34/942506634.db2.gz RWIWTGYPIQYURH-ZDUSSCGKSA-N 0 0 356.348 3.596 20 5 FHBDRN Cc1c(NC(=O)NCc2ccccc2-c2cnn(C)c2)cccc1[N+](=O)[O-] ZINC000378285276 942512527 /nfs/dbraw/zinc/51/25/27/942512527.db2.gz GQBMFGJCKRBVFO-UHFFFAOYSA-N 0 0 365.393 3.625 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N2CC[C@@H](C)c3cccc(O)c32)c1F ZINC000413710977 942514174 /nfs/dbraw/zinc/51/41/74/942514174.db2.gz IPSNBJFKBSLIFG-LLVKDONJSA-N 0 0 374.368 3.531 20 5 FHBDRN Cc1ccc(C2CCN(C(=O)c3c[nH]c4cc([N+](=O)[O-])ccc34)CC2)cn1 ZINC000541252653 942516083 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FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)Nc1ccc(C(=O)NC(C)C)cc1 ZINC000421442581 942575784 /nfs/dbraw/zinc/57/57/84/942575784.db2.gz DXVKBMQWPBFGBE-UHFFFAOYSA-N 0 0 355.394 3.602 20 5 FHBDRN Cc1ccc(C(=O)OCc2ccc(N(C)C)c([N+](=O)[O-])c2)c(F)c1F ZINC001268942002 942575914 /nfs/dbraw/zinc/57/59/14/942575914.db2.gz RWEOTBWQJFADHS-UHFFFAOYSA-N 0 0 350.321 3.604 20 5 FHBDRN O=C([C@@H]1CC[C@H](Nc2ccc([N+](=O)[O-])c3ncccc23)C1)N1CCCCC1 ZINC000413269815 942579572 /nfs/dbraw/zinc/57/95/72/942579572.db2.gz NZJHTYMYVZKBEU-CABCVRRESA-N 0 0 368.437 3.736 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)C1(c2c(F)cccc2F)CCC1 ZINC000421450339 942581773 /nfs/dbraw/zinc/58/17/73/942581773.db2.gz XMEWOSZQCBEURW-UHFFFAOYSA-N 0 0 360.360 3.654 20 5 FHBDRN O=C(N[C@H](CCO)c1ccc(Cl)cc1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412344495 942583233 /nfs/dbraw/zinc/58/32/33/942583233.db2.gz XRBZYKKESJINSP-RCCFBDPRSA-N 0 0 374.824 3.592 20 5 FHBDRN C[C@@H](C(=O)N[C@@H]1CCCC[C@H]1OC(F)F)c1ccc([N+](=O)[O-])cc1F ZINC000501650816 942587094 /nfs/dbraw/zinc/58/70/94/942587094.db2.gz QCKLYDJPRYEFFW-OWYVNGRQSA-N 0 0 360.332 3.504 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H]2CCC[C@@H]2c2ccccc2)c1 ZINC000452402969 942589253 /nfs/dbraw/zinc/58/92/53/942589253.db2.gz DNOFMLZKECVWJB-DOTOQJQBSA-N 0 0 354.406 3.917 20 5 FHBDRN C[C@@]1(c2ccccc2)CCN(C(=O)CSc2ccccc2[N+](=O)[O-])C1 ZINC000541304806 942589616 /nfs/dbraw/zinc/58/96/16/942589616.db2.gz PSDRWJMRDCBXMM-LJQANCHMSA-N 0 0 356.447 3.877 20 5 FHBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])N1C[C@@H]2CCCC[C@H]2C1 ZINC000541304407 942590935 /nfs/dbraw/zinc/59/09/35/942590935.db2.gz ZPNCAFIYUIVHRQ-RYUDHWBXSA-N 0 0 354.859 3.989 20 5 FHBDRN CCCCOc1cccc(NCC(=O)Nc2ccc([N+](=O)[O-])cc2OC)c1 ZINC000063462532 942591823 /nfs/dbraw/zinc/59/18/23/942591823.db2.gz UWRGCWFTFONPRZ-UHFFFAOYSA-N 0 0 373.409 3.833 20 5 FHBDRN C[C@H](Sc1ncc([N+](=O)[O-])cc1C(F)(F)F)C(=O)OC(C)(C)C ZINC000413275982 942595855 /nfs/dbraw/zinc/59/58/55/942595855.db2.gz VPXXXEOXGQBVBY-ZETCQYMHSA-N 0 0 352.334 3.831 20 5 FHBDRN CC(C)CN(CCc1ccccc1)C(=O)COc1ccccc1[N+](=O)[O-] ZINC000501681608 942596858 /nfs/dbraw/zinc/59/68/58/942596858.db2.gz VNMXMHCQDQOCTA-UHFFFAOYSA-N 0 0 356.422 3.701 20 5 FHBDRN COc1cc(C(=O)N[C@H]2CC[C@@H](C)c3ccccc32)cc([N+](=O)[O-])c1OC ZINC000501682665 942597312 /nfs/dbraw/zinc/59/73/12/942597312.db2.gz WIWQLGHUDCDUMB-WBMJQRKESA-N 0 0 370.405 3.980 20 5 FHBDRN CC[C@@H](CSc1ccccc1)NC(=O)COc1ccccc1[N+](=O)[O-] ZINC000501669021 942600794 /nfs/dbraw/zinc/60/07/94/942600794.db2.gz UJAKKUAVGDXQBT-AWEZNQCLSA-N 0 0 360.435 3.661 20 5 FHBDRN CCOC(=O)CN(C(=O)c1cc(F)cc([N+](=O)[O-])c1)[C@H](C)c1ccccc1 ZINC000513913597 942604725 /nfs/dbraw/zinc/60/47/25/942604725.db2.gz SEXLKPCSBXUEPN-CYBMUJFWSA-N 0 0 374.368 3.500 20 5 FHBDRN CN(CC1(O)CCCCCC1)C(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000501677475 942606229 /nfs/dbraw/zinc/60/62/29/942606229.db2.gz IRAHLQLFSBTVII-UHFFFAOYSA-N 0 0 374.359 3.771 20 5 FHBDRN CN(Cc1cc(Cl)ccc1F)C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000434344340 942607768 /nfs/dbraw/zinc/60/77/68/942607768.db2.gz ZLILLJXFMIECEZ-UHFFFAOYSA-N 0 0 362.748 3.536 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCN([C@H](C)c2ccsc2)CC1 ZINC000421499287 942611612 /nfs/dbraw/zinc/61/16/12/942611612.db2.gz ASEJARFUXQVRSW-OAHLLOKOSA-N 0 0 373.478 3.792 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NCCc1nc(C(C)(C)C)cs1 ZINC000421479043 942613294 /nfs/dbraw/zinc/61/32/94/942613294.db2.gz XVSIXKSONOUNHZ-UHFFFAOYSA-N 0 0 361.467 3.938 20 5 FHBDRN COC[C@H](NC(=O)c1cc([N+](=O)[O-])c(C)cc1C)c1ccc(F)c(F)c1 ZINC000421506303 942614672 /nfs/dbraw/zinc/61/46/72/942614672.db2.gz JNKPTLPQMIOWMM-INIZCTEOSA-N 0 0 364.348 3.607 20 5 FHBDRN COC(=O)[C@@H](C)Cc1ccc(NC(=O)c2cc([N+](=O)[O-])c(C)cc2C)cc1 ZINC000421516534 942621774 /nfs/dbraw/zinc/62/17/74/942621774.db2.gz MYCXKRDSAKRAPE-AWEZNQCLSA-N 0 0 370.405 3.816 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1C[C@H]2CCC(=O)c3cccc1c32 ZINC000421519270 942624922 /nfs/dbraw/zinc/62/49/22/942624922.db2.gz 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Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCO[C@H]1c1ccc(F)cc1 ZINC000421544854 942637186 /nfs/dbraw/zinc/63/71/86/942637186.db2.gz RQBIQXYCEAYTTF-KXBFYZLASA-N 0 0 372.396 3.858 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N[C@@H](C)[C@@H](c1ccccc1)[NH+](C)C ZINC000421526900 942637543 /nfs/dbraw/zinc/63/75/43/942637543.db2.gz XPFLPZBVZDGTBJ-KXBFYZLASA-N 0 0 355.438 3.633 20 5 FHBDRN CC(C)c1[nH]nc(C(=O)N2C[C@H](C(C)C)Nc3ccccc32)c1[N+](=O)[O-] ZINC000434395521 942646093 /nfs/dbraw/zinc/64/60/93/942646093.db2.gz PDWVDRZSQMGWED-CYBMUJFWSA-N 0 0 357.414 3.538 20 5 FHBDRN Cc1cc(=NC(=O)c2cc([N+](=O)[O-])c(C)cc2C)[nH]n1C1CCCCC1 ZINC000421561592 942647529 /nfs/dbraw/zinc/64/75/29/942647529.db2.gz RULAZMIDUHFNDP-UHFFFAOYSA-N 0 0 356.426 3.896 20 5 FHBDRN Cc1nn(C(C)(C)C)cc1[C@@H](C)NC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000274395897 942647577 /nfs/dbraw/zinc/64/75/77/942647577.db2.gz JGCVCVHQBXKDJU-LLVKDONJSA-N 0 0 369.425 3.827 20 5 FHBDRN Cc1cc(NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)cc2n[nH]cc21 ZINC000501747154 942649062 /nfs/dbraw/zinc/64/90/62/942649062.db2.gz QCIWBKOZQJIBSA-UHFFFAOYSA-N 0 0 351.366 3.606 20 5 FHBDRN O=C(N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1)C1(Oc2ccccc2)CC1 ZINC000421545638 942651578 /nfs/dbraw/zinc/65/15/78/942651578.db2.gz AHILKNFDFZLZML-KRWDZBQOSA-N 0 0 366.417 3.912 20 5 FHBDRN O=[N+]([O-])c1ccc2ccnc(N3CCCN4c5ccccc5C[C@@H]4C3)c2c1 ZINC000413315972 942656621 /nfs/dbraw/zinc/65/66/21/942656621.db2.gz WEBYDYIDCDNLQB-GOSISDBHSA-N 0 0 360.417 3.784 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)Nc1ncc2c(n1)CCC(C)(C)C2 ZINC000421554221 942657903 /nfs/dbraw/zinc/65/79/03/942657903.db2.gz KIJAASQGNKBWIE-UHFFFAOYSA-N 0 0 354.410 3.769 20 5 FHBDRN CC(C)OCCOC1CCN(c2nccc3ccc([N+](=O)[O-])cc32)CC1 ZINC000413319607 942658845 /nfs/dbraw/zinc/65/88/45/942658845.db2.gz OTBWVWNDMJRJER-UHFFFAOYSA-N 0 0 359.426 3.553 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NC(C)(C)c1cc(C(F)(F)F)on1 ZINC000421576227 942667095 /nfs/dbraw/zinc/66/70/95/942667095.db2.gz OZIBWQSKBPKSOJ-UHFFFAOYSA-N 0 0 371.315 3.884 20 5 FHBDRN O=C(CCc1ccc(C(F)F)cc1)NCCOc1ccc([N+](=O)[O-])cc1 ZINC001125876253 942667778 /nfs/dbraw/zinc/66/77/78/942667778.db2.gz FUPXCQPUXSPQEM-UHFFFAOYSA-N 0 0 364.348 3.660 20 5 FHBDRN Cc1ccc(NC(=O)c2ccc(N3CCOC[C@@H](C)C3)c([N+](=O)[O-])c2)cc1 ZINC000513998325 942674670 /nfs/dbraw/zinc/67/46/70/942674670.db2.gz BAACFEFWNXBEEI-HNNXBMFYSA-N 0 0 369.421 3.628 20 5 FHBDRN Cc1ncsc1-c1nc(COc2cc(F)c([N+](=O)[O-])cc2Cl)no1 ZINC000367005048 942675577 /nfs/dbraw/zinc/67/55/77/942675577.db2.gz XMYNNKXGKKVVRU-UHFFFAOYSA-N 0 0 370.749 3.781 20 5 FHBDRN CCCN(C(=O)c1cccc([N+](=O)[O-])c1C)[C@H](C)C(=O)Nc1ccccc1 ZINC000502714412 942678695 /nfs/dbraw/zinc/67/86/95/942678695.db2.gz FJYBTZDTKLAEGV-OAHLLOKOSA-N 0 0 369.421 3.783 20 5 FHBDRN CSC[C@@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)C1 ZINC000412368298 942679562 /nfs/dbraw/zinc/67/95/62/942679562.db2.gz UWKIAQDARFMKCA-CYBMUJFWSA-N 0 0 352.456 3.597 20 5 FHBDRN Nc1ccc(-c2noc(C[C@@H](c3ccc(O)cc3)C3CC3)n2)cc1[N+](=O)[O-] ZINC000420476313 942679956 /nfs/dbraw/zinc/67/99/56/942679956.db2.gz PQZNYPQIKSYSDV-OAHLLOKOSA-N 0 0 366.377 3.669 20 5 FHBDRN C[C@H]1CCCN(c2ccc(C(=O)N3CC(CC(F)F)C3)cc2[N+](=O)[O-])C1 ZINC000425085300 942683392 /nfs/dbraw/zinc/68/33/92/942683392.db2.gz IUWRIRNYFMFLQA-LBPRGKRZSA-N 0 0 367.396 3.558 20 5 FHBDRN CCCNc1ccc(CNC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)cc1 ZINC000434460054 942683913 /nfs/dbraw/zinc/68/39/13/942683913.db2.gz PRSMPIORLUUSKL-UHFFFAOYSA-N 0 0 368.437 3.685 20 5 FHBDRN O=[N+]([O-])c1ccc([C@@H]2C[C@H]2c2nc(-c3ccc4c(c3)OCCO4)no2)cc1 ZINC000420483229 942688240 /nfs/dbraw/zinc/68/82/40/942688240.db2.gz UIFSTHSASXMTOQ-LSDHHAIUSA-N 0 0 365.345 3.687 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)NC[C@@H]2CCC[C@H]2C2CC2)cc1OC ZINC000413869108 942695084 /nfs/dbraw/zinc/69/50/84/942695084.db2.gz ACZRMXHOGOXTOS-KBPBESRZSA-N 0 0 362.426 3.558 20 5 FHBDRN C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N1CCC(Nc2nccs2)CC1 ZINC000190366981 942697846 /nfs/dbraw/zinc/69/78/46/942697846.db2.gz LPQQDRROXBUYTB-OUKQBFOZSA-N 0 0 372.450 3.558 20 5 FHBDRN CCN(Cc1ccncc1)[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000502731017 942700105 /nfs/dbraw/zinc/70/01/05/942700105.db2.gz PXGGGIVVXPMJIB-ZDUSSCGKSA-N 0 0 353.382 3.623 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CCC[C@H](C[C@@H]2CCOC2)C1 ZINC000378398026 942703419 /nfs/dbraw/zinc/70/34/19/942703419.db2.gz GPDOHNUYQLFIPR-OLZOCXBDSA-N 0 0 352.818 3.527 20 5 FHBDRN CC(C)(C)n1cc(-c2noc([C@@H]3C[C@H]3c3ccc([N+](=O)[O-])cc3)n2)cn1 ZINC000420496011 942704013 /nfs/dbraw/zinc/70/40/13/942704013.db2.gz XXJHAIMPEPDRJL-LSDHHAIUSA-N 0 0 353.382 3.867 20 5 FHBDRN Cc1ccc2c(C(=O)NCc3nc4cc([N+](=O)[O-])ccc4[nH]3)csc2c1 ZINC000481151482 942706058 /nfs/dbraw/zinc/70/60/58/942706058.db2.gz DQGVUDDPHVSBQF-UHFFFAOYSA-N 0 0 366.402 3.924 20 5 FHBDRN O=C(c1ccc(N2CCCC2)c([N+](=O)[O-])c1)N1CC[C@H](C2CCCC2)C1 ZINC000421650390 942706953 /nfs/dbraw/zinc/70/69/53/942706953.db2.gz HCOOZENPMVHQKV-KRWDZBQOSA-N 0 0 357.454 3.847 20 5 FHBDRN CCSc1nccnc1-c1noc([C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)n1 ZINC000420507533 942709339 /nfs/dbraw/zinc/70/93/39/942709339.db2.gz XILHJIPYKAGEDR-QWHCGFSZSA-N 0 0 369.406 3.818 20 5 FHBDRN Cn1nc([N+](=O)[O-])cc1-c1nc([C@@H]2CCC(C)(C)c3ccccc32)no1 ZINC000420508420 942710830 /nfs/dbraw/zinc/71/08/30/942710830.db2.gz CBPJTNVTLODDFI-GFCCVEGCSA-N 0 0 353.382 3.582 20 5 FHBDRN Cc1cnc(-c2cccc(NS(=O)(=O)c3ccc(C)c([N+](=O)[O-])c3)c2)o1 ZINC000066814637 942711219 /nfs/dbraw/zinc/71/12/19/942711219.db2.gz JUEUTRMEGMMKQD-UHFFFAOYSA-N 0 0 373.390 3.667 20 5 FHBDRN CN(CCCc1cc(-c2ccc(F)cc2)n(C)n1)c1ccncc1[N+](=O)[O-] ZINC000066810507 942711666 /nfs/dbraw/zinc/71/16/66/942711666.db2.gz MZKDJTGTHFLZSB-UHFFFAOYSA-N 0 0 369.400 3.598 20 5 FHBDRN COCCO[C@H]1CCCN(C(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000514073429 942718517 /nfs/dbraw/zinc/71/85/17/942718517.db2.gz WSPLGVBMWXUPKC-KRWDZBQOSA-N 0 0 364.445 3.656 20 5 FHBDRN CON1CCC(c2noc(-c3ccc(C(C)(C)C)c([N+](=O)[O-])c3)n2)CC1 ZINC000420515106 942720322 /nfs/dbraw/zinc/72/03/22/942720322.db2.gz BZQSBZPRLMDCSJ-UHFFFAOYSA-N 0 0 360.414 3.683 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)Nc1ccc(-c2ncc[nH]2)cc1 ZINC000502764894 942725450 /nfs/dbraw/zinc/72/54/50/942725450.db2.gz CGLBWFCAYDPOJM-UHFFFAOYSA-N 0 0 361.361 3.578 20 5 FHBDRN CCC1(CC)CN(C(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)c2ccccc21 ZINC000434538726 942743390 /nfs/dbraw/zinc/74/33/90/942743390.db2.gz TZBPKNVPUGKIRC-UHFFFAOYSA-N 0 0 367.405 3.638 20 5 FHBDRN C[C@@H](NC(=O)NCCCCOCc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000051312388 942757797 /nfs/dbraw/zinc/75/77/97/942757797.db2.gz FVZUAAPUTWMDNB-MRXNPFEDSA-N 0 0 371.437 3.952 20 5 FHBDRN Cc1c(C(=O)N2c3ccc([N+](=O)[O-])cc3C[C@H]2C)cnn1CCC(C)C ZINC000137256443 942764729 /nfs/dbraw/zinc/76/47/29/942764729.db2.gz KLCZIEZLEMURPF-CYBMUJFWSA-N 0 0 356.426 3.737 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCCC12CCOCC2 ZINC000367057525 942775532 /nfs/dbraw/zinc/77/55/32/942775532.db2.gz KLHAGFHBCREULA-FUHWJXTLSA-N 0 0 360.454 3.629 20 5 FHBDRN O=C(Nc1ccnc2ccccc21)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000545902088 942780765 /nfs/dbraw/zinc/78/07/65/942780765.db2.gz LBOUWNKWQWTXMB-UHFFFAOYSA-N 0 0 372.178 3.580 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N(C)Cc1ccc(Br)o1 ZINC000421745534 942793193 /nfs/dbraw/zinc/79/31/93/942793193.db2.gz WHBHKEJDMWUBEA-UHFFFAOYSA-N 0 0 367.199 3.839 20 5 FHBDRN CCN(CC(F)(F)F)C(=O)[C@@H]1CCCN(c2ccc([N+](=O)[O-])c(C)c2)C1 ZINC000514176405 942802763 /nfs/dbraw/zinc/80/27/63/942802763.db2.gz PETJPKXQWOSKAD-CYBMUJFWSA-N 0 0 373.375 3.530 20 5 FHBDRN Cc1cc(N2CCN(C(=O)c3cc4occc4s3)CC2)ccc1[N+](=O)[O-] ZINC000514179791 942804855 /nfs/dbraw/zinc/80/48/55/942804855.db2.gz LMLCJAHJGUTYTO-UHFFFAOYSA-N 0 0 371.418 3.673 20 5 FHBDRN Cc1nc2sccn2c1CN(C)C(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC000421777539 942805463 /nfs/dbraw/zinc/80/54/63/942805463.db2.gz AEDLDWGTLXYEEA-UHFFFAOYSA-N 0 0 358.423 3.501 20 5 FHBDRN O=C(NC1(c2ccc(F)cc2)CC1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514202941 942811727 /nfs/dbraw/zinc/81/17/27/942811727.db2.gz DLNLDGBGLABGBK-UHFFFAOYSA-N 0 0 366.295 3.754 20 5 FHBDRN CC1(C)C[C@H](c2ccccc2)N(C(=O)COc2ccccc2[N+](=O)[O-])C1 ZINC000425120997 942822516 /nfs/dbraw/zinc/82/25/16/942822516.db2.gz PBDLDEJZLWALND-QGZVFWFLSA-N 0 0 354.406 3.973 20 5 FHBDRN CCSc1cccc(NC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2C)c1 ZINC000190126716 942827647 /nfs/dbraw/zinc/82/76/47/942827647.db2.gz KOUWJMMEYAWBEE-UHFFFAOYSA-N 0 0 359.407 3.592 20 5 FHBDRN Cc1cccc(C(=O)N2CCCN([C@H](C)c3ccccc3[N+](=O)[O-])CC2)c1 ZINC000434640020 942831146 /nfs/dbraw/zinc/83/11/46/942831146.db2.gz XRDPYGMFWMLNAZ-QGZVFWFLSA-N 0 0 367.449 3.812 20 5 FHBDRN CO[C@](C)([C@@H](C)NC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-])C1CC1 ZINC000413965520 942839648 /nfs/dbraw/zinc/83/96/48/942839648.db2.gz XIORNNKUYFRVFS-QLJPJBMISA-N 0 0 372.874 3.660 20 5 FHBDRN O=[N+]([O-])c1ccccc1OCCN[C@H](c1cc(F)ccc1F)C(F)F ZINC000434660610 942844598 /nfs/dbraw/zinc/84/45/98/942844598.db2.gz ALHSJYLNUHMTJH-OAHLLOKOSA-N 0 0 358.291 3.848 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1Oc1ccccc1)N1CCO[C@@H]2CCC[C@H]21 ZINC000514234435 942846000 /nfs/dbraw/zinc/84/60/00/942846000.db2.gz OCFDULZGYMELGH-IEBWSBKVSA-N 0 0 368.389 3.781 20 5 FHBDRN Cc1cc(C(=O)Nc2cccc(Cl)c2-n2cccn2)ccc1[N+](=O)[O-] ZINC000502932834 942851583 /nfs/dbraw/zinc/85/15/83/942851583.db2.gz YXLZRTSHXWTXFE-UHFFFAOYSA-N 0 0 356.769 3.995 20 5 FHBDRN CC(C)[C@H](NC(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])C(F)(F)F ZINC000413979866 942859190 /nfs/dbraw/zinc/85/91/90/942859190.db2.gz AORJQHRPQJZANW-UFBFGSQYSA-N 0 0 368.739 3.719 20 5 FHBDRN Cc1cc(F)cc2c1CN(Cc1nnc(-c3ccc([N+](=O)[O-])cc3)o1)CC2 ZINC000502944474 942861618 /nfs/dbraw/zinc/86/16/18/942861618.db2.gz QRSVJAZEUWWTDN-UHFFFAOYSA-N 0 0 368.368 3.651 20 5 FHBDRN COc1cc(CN[C@@H](c2cc(F)ccc2F)C(F)F)ccc1[N+](=O)[O-] ZINC000434688369 942866372 /nfs/dbraw/zinc/86/63/72/942866372.db2.gz LJPUGVKEYUSOIM-HNNXBMFYSA-N 0 0 358.291 3.978 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N(C)[C@H](CO)c1ccc(Cl)cc1 ZINC000421893684 942875455 /nfs/dbraw/zinc/87/54/55/942875455.db2.gz PFZAUOOGPPSLMC-QGZVFWFLSA-N 0 0 362.813 3.671 20 5 FHBDRN CC(C)[C@H](NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)C(F)(F)F ZINC000413997595 942876215 /nfs/dbraw/zinc/87/62/15/942876215.db2.gz WEDLHEUJZGKGQM-HNNXBMFYSA-N 0 0 373.375 3.514 20 5 FHBDRN C[C@@H](NC(=O)c1ccc([C@H]2CCCOC2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000502966302 942880481 /nfs/dbraw/zinc/88/04/81/942880481.db2.gz TYONDTGIYHWMAJ-KDOFPFPSSA-N 0 0 354.406 3.980 20 5 FHBDRN COc1ccc(CNC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1F ZINC000163955786 942885004 /nfs/dbraw/zinc/88/50/04/942885004.db2.gz NNIILSAPESXUIS-UHFFFAOYSA-N 0 0 373.384 3.617 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)NC2(C)CCC(C)CC2)cc1OC ZINC000133618120 942885338 /nfs/dbraw/zinc/88/53/38/942885338.db2.gz QAXBRGPLFBGXLN-UHFFFAOYSA-N 0 0 350.415 3.701 20 5 FHBDRN O=[N+]([O-])c1ccc(CNc2ccc(Cl)c(CN3CCOCC3)c2)cc1 ZINC000430090979 942886699 /nfs/dbraw/zinc/88/66/99/942886699.db2.gz UUZGBVCKKYRMAZ-UHFFFAOYSA-N 0 0 361.829 3.693 20 5 FHBDRN CCOc1ccc(C(=O)N2CCC[C@H](CC(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000421937867 942888892 /nfs/dbraw/zinc/88/88/92/942888892.db2.gz IWILRPBFEHCHIX-LLVKDONJSA-N 0 0 360.332 3.798 20 5 FHBDRN CC(=O)CN(CC(C)C)C(=O)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000421920636 942891420 /nfs/dbraw/zinc/89/14/20/942891420.db2.gz ODFGLKWJXGOMLB-UHFFFAOYSA-N 0 0 368.408 3.508 20 5 FHBDRN Cc1cc(OCC(=O)Nc2nc3c(s2)C[C@@H](C)CC3)ccc1[N+](=O)[O-] ZINC000430102213 942915075 /nfs/dbraw/zinc/91/50/75/942915075.db2.gz JLLOKAHOLXCAAR-JTQLQIEISA-N 0 0 361.423 3.502 20 5 FHBDRN O=C(N[C@H]1C[C@H]1c1ccccc1C(F)(F)F)c1ccccc1[N+](=O)[O-] ZINC000505501038 942916748 /nfs/dbraw/zinc/91/67/48/942916748.db2.gz YUTFQHCAXYBEIV-JSGCOSHPSA-N 0 0 350.296 3.900 20 5 FHBDRN CCc1occc1C(=O)N[C@H](CC(=O)OC(C)C)c1ccccc1[N+](=O)[O-] ZINC000430120826 942918830 /nfs/dbraw/zinc/91/88/30/942918830.db2.gz HXYGBJVEVGOCOC-OAHLLOKOSA-N 0 0 374.393 3.563 20 5 FHBDRN CC(C)c1csc2[nH]c(CCNc3ccccc3[N+](=O)[O-])nc(=O)c12 ZINC000122959362 942921247 /nfs/dbraw/zinc/92/12/47/942921247.db2.gz DKDZJYVWDXJWKQ-UHFFFAOYSA-N 0 0 358.423 3.671 20 5 FHBDRN CCN(CCc1ccc(C(F)(F)F)cc1)C(=O)c1ccc([N+](=O)[O-])o1 ZINC000425167612 942924661 /nfs/dbraw/zinc/92/46/61/942924661.db2.gz YAZJQOACMDSPJO-UHFFFAOYSA-N 0 0 356.300 3.911 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H]1Cc2ccccc2O1 ZINC000103604970 942927350 /nfs/dbraw/zinc/92/73/50/942927350.db2.gz CEWWGVRQNBIPAY-GOSISDBHSA-N 0 0 369.421 3.519 20 5 FHBDRN O=C(NCc1ncc(-c2ccccc2)cn1)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000183853377 942931796 /nfs/dbraw/zinc/93/17/96/942931796.db2.gz IHGRLUITCVQEOK-UHFFFAOYSA-N 0 0 368.780 3.635 20 5 FHBDRN O=C(NCCNc1ccc([N+](=O)[O-])cc1)Nc1ccc(OCC2CC2)cc1 ZINC000503050968 942940227 /nfs/dbraw/zinc/94/02/27/942940227.db2.gz GYPJMQHPYSXNRU-UHFFFAOYSA-N 0 0 370.409 3.617 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N(C)Cc1cc(Cl)ccc1F ZINC000434758526 942946689 /nfs/dbraw/zinc/94/66/89/942946689.db2.gz LEUMBOUFFSQWFT-UHFFFAOYSA-N 0 0 372.805 3.516 20 5 FHBDRN Cn1ccnc1CC1CCN(c2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)CC1 ZINC000133626055 942949155 /nfs/dbraw/zinc/94/91/55/942949155.db2.gz WUXVIHLTUYSHNC-UHFFFAOYSA-N 0 0 372.469 3.965 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1cnn(CC(F)F)c1 ZINC000503067538 942949276 /nfs/dbraw/zinc/94/92/76/942949276.db2.gz SIIJCTHRYNMFRH-UHFFFAOYSA-N 0 0 370.381 3.811 20 5 FHBDRN COc1cccc(Cl)c1Cn1nc(-c2cccc([N+](=O)[O-])c2)ccc1=O ZINC000505512649 942960078 /nfs/dbraw/zinc/96/00/78/942960078.db2.gz KUPJQIYZKPIEOS-UHFFFAOYSA-N 0 0 371.780 3.529 20 5 FHBDRN Cc1ccc(Sc2ccc(C(=O)N3C[C@@H](O)C[C@H]3C)cc2[N+](=O)[O-])cc1 ZINC000473003163 942962358 /nfs/dbraw/zinc/96/23/58/942962358.db2.gz UTIWEAKIXCYKCA-HIFRSBDPSA-N 0 0 372.446 3.650 20 5 FHBDRN Cc1ccc(C2CCN(C(=O)Cc3cccc([N+](=O)[O-])c3C)CC2)cn1 ZINC000378628061 942969679 /nfs/dbraw/zinc/96/96/79/942969679.db2.gz BZHSFFCMIIDLKJ-UHFFFAOYSA-N 0 0 353.422 3.555 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@H](CCO)CC1 ZINC000422081620 942977176 /nfs/dbraw/zinc/97/71/76/942977176.db2.gz XYFVXILHANYPOX-AWEZNQCLSA-N 0 0 366.483 3.722 20 5 FHBDRN Cc1cc(NC(=O)C(=O)c2ccc(Cl)cc2)c2cc([N+](=O)[O-])ccc2n1 ZINC000183681672 942991446 /nfs/dbraw/zinc/99/14/46/942991446.db2.gz BKMDITFLFCRFRE-UHFFFAOYSA-N 0 0 369.764 3.926 20 5 FHBDRN CCCOc1cc(NC(=O)C(C)(C)OC)c([N+](=O)[O-])cc1OCCC ZINC000503108218 942992315 /nfs/dbraw/zinc/99/23/15/942992315.db2.gz HPPFPQCNDYTUAU-UHFFFAOYSA-N 0 0 354.403 3.536 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N1C[C@H]2CCC(=O)c3cccc1c32 ZINC000183860269 943002819 /nfs/dbraw/zinc/00/28/19/943002819.db2.gz OGDVKRFSMMYTSZ-CQSZACIVSA-N 0 0 350.374 3.634 20 5 FHBDRN O=C(c1ccc(NC2CC2)c([N+](=O)[O-])c1)N1CCc2cccc(F)c2C1 ZINC000503146216 943005867 /nfs/dbraw/zinc/00/58/67/943005867.db2.gz ZQAPQQFFZGJOOB-UHFFFAOYSA-N 0 0 355.369 3.507 20 5 FHBDRN Cc1cnc([C@@H]2CCCCN2C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)s1 ZINC000367123539 943008960 /nfs/dbraw/zinc/00/89/60/943008960.db2.gz SXQYXKHNSAENHY-AWEZNQCLSA-N 0 0 371.422 3.603 20 5 FHBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CC2(C1)CCCCC2 ZINC000503173325 943021728 /nfs/dbraw/zinc/02/17/28/943021728.db2.gz ZCRIRURGRRUFII-GFCCVEGCSA-N 0 0 352.818 3.808 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N(CC(C)C)CC(F)(F)F)c1 ZINC000514449505 943027415 /nfs/dbraw/zinc/02/74/15/943027415.db2.gz AOTIMXDAJPGMQC-UHFFFAOYSA-N 0 0 350.362 3.977 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CC[C@H](c2ccccc2)[C@@H]1C ZINC000434901219 943037804 /nfs/dbraw/zinc/03/78/04/943037804.db2.gz TUVNFSYFENRJME-RDJZCZTQSA-N 0 0 353.422 3.720 20 5 FHBDRN COc1cccc([C@@H]2C[C@H]2NC(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)c1 ZINC000412398693 943050554 /nfs/dbraw/zinc/05/05/54/943050554.db2.gz YCRTWKAGSOKQOC-DLBZAZTESA-N 0 0 370.405 3.677 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])N[C@@H]1C[C@H]1c1ccccc1C(F)(F)F ZINC000505567149 943053005 /nfs/dbraw/zinc/05/30/05/943053005.db2.gz WBAPDCVHJKYMFM-DZGCQCFKSA-N 0 0 364.323 3.828 20 5 FHBDRN COc1ccc(CCNc2ncc(Cl)cc2[N+](=O)[O-])cc1OC(F)F ZINC000434941432 943056186 /nfs/dbraw/zinc/05/61/86/943056186.db2.gz CUZKWESEPIUZBF-UHFFFAOYSA-N 0 0 373.743 3.908 20 5 FHBDRN Cc1nn(-c2ccc(F)cc2)cc1CNc1ncc(Cl)cc1[N+](=O)[O-] ZINC000434941485 943056415 /nfs/dbraw/zinc/05/64/15/943056415.db2.gz CJAOCBNKXCEERK-UHFFFAOYSA-N 0 0 361.764 3.889 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N2CC[C@@H](CC(C)(C)C)C2)c1F ZINC000412407497 943065890 /nfs/dbraw/zinc/06/58/90/943065890.db2.gz DWTPDPHUMYTKCS-LBPRGKRZSA-N 0 0 352.406 3.570 20 5 FHBDRN CC[C@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1cccc(Cl)c1 ZINC000514502455 943066189 /nfs/dbraw/zinc/06/61/89/943066189.db2.gz HEUCNIDPUYGMSJ-HNNXBMFYSA-N 0 0 354.815 3.678 20 5 FHBDRN COc1ccc(COCCCNc2ncc(Cl)cc2[N+](=O)[O-])cc1 ZINC000434949527 943068896 /nfs/dbraw/zinc/06/88/96/943068896.db2.gz DHMYTHFAZLCKFL-UHFFFAOYSA-N 0 0 351.790 3.671 20 5 FHBDRN O=C([C@H]1CCCOCC1)N(CC1CC1)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000365829038 943069783 /nfs/dbraw/zinc/06/97/83/943069783.db2.gz HSFLEWBDEBNGAA-ZDUSSCGKSA-N 0 0 352.818 3.808 20 5 FHBDRN Cc1cc(NC(=O)c2ccc([N+](=O)[O-])cc2)cnc1N1CCCC[C@@H]1C ZINC000503228549 943072167 /nfs/dbraw/zinc/07/21/67/943072167.db2.gz GHWJTCQWGAJHFV-AWEZNQCLSA-N 0 0 354.410 3.929 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CC(C)(CC(F)(F)F)C2)ccc1[N+](=O)[O-] ZINC000412415604 943076853 /nfs/dbraw/zinc/07/68/53/943076853.db2.gz WPPQZJMGJSJFCB-UHFFFAOYSA-N 0 0 360.332 3.797 20 5 FHBDRN C[C@@H](C(=O)Nc1ccnn1-c1cccc(F)c1)c1ccc([N+](=O)[O-])cc1F ZINC000183906240 943091465 /nfs/dbraw/zinc/09/14/65/943091465.db2.gz YQEKLNXTEIJVRN-LLVKDONJSA-N 0 0 372.331 3.801 20 5 FHBDRN C[C@H](NC(=O)N(C)CCc1cccc([N+](=O)[O-])c1)[C@@H](C)c1ccccc1 ZINC000511581729 943093049 /nfs/dbraw/zinc/09/30/49/943093049.db2.gz RAGDXIQCNGOPEG-CVEARBPZSA-N 0 0 355.438 3.971 20 5 FHBDRN CS(=O)(=O)c1ccc(N2CCC[C@@H]2/C=C\c2ccccc2)c([N+](=O)[O-])c1 ZINC000503277344 943096609 /nfs/dbraw/zinc/09/66/09/943096609.db2.gz XWLXWHDFADIYMK-ZBTGYSDGSA-N 0 0 372.446 3.681 20 5 FHBDRN CC(=O)Nc1cccc([C@H](C)NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)c1 ZINC000514557464 943100999 /nfs/dbraw/zinc/10/09/99/943100999.db2.gz MUQZUXMCHYYDPS-NSHDSACASA-N 0 0 367.361 3.790 20 5 FHBDRN Cc1c(C(=O)Nc2ccnn2CCc2ccccc2)cccc1[N+](=O)[O-] ZINC000503333001 943123600 /nfs/dbraw/zinc/12/36/00/943123600.db2.gz NPHWPFSHIWHJFL-UHFFFAOYSA-N 0 0 350.378 3.595 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)c1ccn(-c2ccccc2F)n1 ZINC000183765735 943137069 /nfs/dbraw/zinc/13/70/69/943137069.db2.gz FWGDTBZPXDQAKJ-UHFFFAOYSA-N 0 0 374.759 3.503 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N1CCC[C@H]1[C@H]1CCCOC1 ZINC000514600976 943140226 /nfs/dbraw/zinc/14/02/26/943140226.db2.gz WQBHIKIWNJRQJQ-NHYWBVRUSA-N 0 0 353.806 3.671 20 5 FHBDRN Nc1ccc([N+](=O)[O-])cc1C(=O)OCc1ncc(-c2ccc(Cl)cc2)o1 ZINC000016814330 943159727 /nfs/dbraw/zinc/15/97/27/943159727.db2.gz LSBNFDABQPFXHY-UHFFFAOYSA-N 0 0 373.752 3.842 20 5 FHBDRN Cc1cc(Cc2noc(CCCc3ccc(O)c(F)c3)n2)ccc1[N+](=O)[O-] ZINC000514632785 943165187 /nfs/dbraw/zinc/16/51/87/943165187.db2.gz XSTOAUBGTYENND-UHFFFAOYSA-N 0 0 371.368 3.897 20 5 FHBDRN C[C@@H]1C[C@H](O)CN(C(=O)Nc2cccc(Oc3ccc([N+](=O)[O-])cc3)c2)C1 ZINC000416842318 943168875 /nfs/dbraw/zinc/16/88/75/943168875.db2.gz JASTXARWDZRCHT-CJNGLKHVSA-N 0 0 371.393 3.622 20 5 FHBDRN CC(C)(C)OC(=O)C(C)(C)CCNc1ncnc2sc([N+](=O)[O-])cc21 ZINC000425278624 943169273 /nfs/dbraw/zinc/16/92/73/943169273.db2.gz ZEBUZZGFRHJQTM-UHFFFAOYSA-N 0 0 366.443 3.769 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@H]2COCC[C@H]21 ZINC000503416922 943173769 /nfs/dbraw/zinc/17/37/69/943173769.db2.gz DBLIKYNEMRDUEW-XJKSGUPXSA-N 0 0 364.467 3.738 20 5 FHBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)N2CCC[C@H]2C2CCCCC2)cc1 ZINC000503439060 943184778 /nfs/dbraw/zinc/18/47/78/943184778.db2.gz VKUBAXNHNKDHLH-SFHVURJKSA-N 0 0 366.483 3.512 20 5 FHBDRN C[C@@H](C(=O)Nc1cccc(C(=O)N2CCCC2)c1)c1cccc([N+](=O)[O-])c1 ZINC000514647476 943191755 /nfs/dbraw/zinc/19/17/55/943191755.db2.gz CNTKJRBTGKKVLL-CQSZACIVSA-N 0 0 367.405 3.573 20 5 FHBDRN COC(=O)c1ccc(OC(=O)c2cccc(-c3ccoc3)c2)cc1[N+](=O)[O-] ZINC001267796078 943192134 /nfs/dbraw/zinc/19/21/34/943192134.db2.gz WSQRYKYNGQOISE-UHFFFAOYSA-N 0 0 367.313 3.861 20 5 FHBDRN COC(=O)c1ccc(OC(=O)C2(c3ccccc3C)CCC2)cc1[N+](=O)[O-] ZINC001267795380 943194679 /nfs/dbraw/zinc/19/46/79/943194679.db2.gz OHAROCSJESNNHU-UHFFFAOYSA-N 0 0 369.373 3.717 20 5 FHBDRN COCCSc1ccc([C@@H](C)Nc2c([N+](=O)[O-])c(C)nn2C)cc1 ZINC000505613933 943205995 /nfs/dbraw/zinc/20/59/95/943205995.db2.gz WPHVHTFCCGKPFN-LLVKDONJSA-N 0 0 350.444 3.548 20 5 FHBDRN COc1cc(CSc2ccc3c(c2)OCCO3)c([N+](=O)[O-])cc1F ZINC000545914115 943219768 /nfs/dbraw/zinc/21/97/68/943219768.db2.gz WYLXLVDASJHWLP-UHFFFAOYSA-N 0 0 351.355 3.806 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)Nc1c[nH]nc1-c1ccccc1F ZINC000513791157 943228731 /nfs/dbraw/zinc/22/87/31/943228731.db2.gz KIDRZUWQGZQVJJ-UHFFFAOYSA-N 0 0 372.381 3.855 20 5 FHBDRN CS(=O)(=O)c1cc([N+](=O)[O-])ccc1N[C@H]1CCc2sc(Cl)cc21 ZINC000514698703 943231472 /nfs/dbraw/zinc/23/14/72/943231472.db2.gz DOSWDWVEZURHDH-JTQLQIEISA-N 0 0 372.855 3.813 20 5 FHBDRN O=C(NCc1ccn(C2CCCC2)n1)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000431908730 943234871 /nfs/dbraw/zinc/23/48/71/943234871.db2.gz GBGVXOYVHPRMGL-UHFFFAOYSA-N 0 0 354.366 3.583 20 5 FHBDRN O=C(N[C@H]1CCC[C@H](c2nc3ccccc3[nH]2)C1)c1ccc([N+](=O)[O-])o1 ZINC000514728435 943256919 /nfs/dbraw/zinc/25/69/19/943256919.db2.gz VELDNIINOKAQJW-RYUDHWBXSA-N 0 0 354.366 3.520 20 5 FHBDRN C[C@@H](C(=O)NCCCSc1ccccn1)c1ccc([N+](=O)[O-])cc1F ZINC000425300550 943260857 /nfs/dbraw/zinc/26/08/57/943260857.db2.gz UVJBBFHNZKLYNW-GFCCVEGCSA-N 0 0 363.414 3.531 20 5 FHBDRN O=C(NC[C@@H]1COc2ccccc21)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000514753624 943267043 /nfs/dbraw/zinc/26/70/43/943267043.db2.gz QYPGCEJESVULEI-LLVKDONJSA-N 0 0 366.295 3.520 20 5 FHBDRN CCOc1ccc(C(=O)Nc2c[nH]nc2-c2ccccc2F)cc1[N+](=O)[O-] ZINC000513792105 943271087 /nfs/dbraw/zinc/27/10/87/943271087.db2.gz AAWPOUUKHMIVFK-UHFFFAOYSA-N 0 0 370.340 3.775 20 5 FHBDRN CN(C)c1cc(F)c(C(=O)Nc2ccc(Cl)c(Cl)n2)cc1[N+](=O)[O-] ZINC001269394743 943272256 /nfs/dbraw/zinc/27/22/56/943272256.db2.gz QSGRBPHEBSYICK-UHFFFAOYSA-N 0 0 373.171 3.754 20 5 FHBDRN C[C@@H]1C[C@H](CNC(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)[C@@H](C)O1 ZINC000416980856 943272876 /nfs/dbraw/zinc/27/28/76/943272876.db2.gz GTFONQFITURCBS-OPRDCNLKSA-N 0 0 361.320 3.549 20 5 FHBDRN Cc1noc(CSc2ccc(C(=O)Nc3ccc([N+](=O)[O-])cc3)cc2)n1 ZINC000514775969 943283856 /nfs/dbraw/zinc/28/38/56/943283856.db2.gz YCTGCQZRNPRMCA-UHFFFAOYSA-N 0 0 370.390 3.831 20 5 FHBDRN CN(C(=O)c1cc2cc([N+](=O)[O-])ccc2o1)[C@H](CCO)c1ccccc1 ZINC000503609423 943289481 /nfs/dbraw/zinc/28/94/81/943289481.db2.gz NBVSPLGJDWHMBF-MRXNPFEDSA-N 0 0 354.362 3.537 20 5 FHBDRN C[C@@H]1[C@H](c2nc(Cc3ccc([N+](=O)[O-])cc3Br)no2)C1(F)F ZINC000514785982 943290410 /nfs/dbraw/zinc/29/04/10/943290410.db2.gz OMRAYDINKMABNQ-KSBSHMNSSA-N 0 0 374.141 3.700 20 5 FHBDRN Cc1ccc(NC(=O)NCc2cccc(OC(C)(C)C)n2)cc1[N+](=O)[O-] ZINC000503626828 943298231 /nfs/dbraw/zinc/29/82/31/943298231.db2.gz KMMVQVMWIFGDMX-UHFFFAOYSA-N 0 0 358.398 3.797 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCOC2(CCC2)C1 ZINC000503617684 943303397 /nfs/dbraw/zinc/30/33/97/943303397.db2.gz KTBYCSAGBCBNFE-CYBMUJFWSA-N 0 0 364.467 3.928 20 5 FHBDRN O=C(NCCc1ccccc1[N+](=O)[O-])N[C@H]1C[C@H](c2ccc(F)cc2)C1 ZINC000431917286 943306611 /nfs/dbraw/zinc/30/66/11/943306611.db2.gz VFWWUXPZJKINIG-JCNLHEQBSA-N 0 0 357.385 3.522 20 5 FHBDRN Cn1cc([N+](=O)[O-])c(C(=O)NC2(c3ccc(C(C)(C)C)cc3)CCCC2)n1 ZINC000503645150 943308214 /nfs/dbraw/zinc/30/82/14/943308214.db2.gz AFRXNYWXZREAAM-UHFFFAOYSA-N 0 0 370.453 3.825 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]([C@H]2CCOC2)C1 ZINC000503637015 943312890 /nfs/dbraw/zinc/31/28/90/943312890.db2.gz KTNVUVJASIUQBC-KGLIPLIRSA-N 0 0 364.467 3.596 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)NCC1(Cc2ccccc2)CC1 ZINC000435298848 943319400 /nfs/dbraw/zinc/31/94/00/943319400.db2.gz ZNINXGSGWGRGNM-UHFFFAOYSA-N 0 0 363.417 3.689 20 5 FHBDRN Cc1csc([C@@H](NCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C2CC2)n1 ZINC000181617121 943320845 /nfs/dbraw/zinc/32/08/45/943320845.db2.gz AWQPOHPRVSTSFX-HNNXBMFYSA-N 0 0 371.422 3.651 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2noc(CN3CC[C@H](c4ccccc4F)C3)n2)c1 ZINC000503653000 943321509 /nfs/dbraw/zinc/32/15/09/943321509.db2.gz BKSCIRUVBHMPKO-AWEZNQCLSA-N 0 0 368.368 3.773 20 5 FHBDRN Cc1c(NC(=O)N[C@H]2CC[C@H](C)C2)cc(Br)cc1[N+](=O)[O-] ZINC000435322301 943323117 /nfs/dbraw/zinc/32/31/17/943323117.db2.gz BOKFFQLHUINDKC-KWQFWETISA-N 0 0 356.220 3.976 20 5 FHBDRN Cc1c(NC(=O)NC[C@H]2CC23CC3)cc(Br)cc1[N+](=O)[O-] ZINC000417068502 943325293 /nfs/dbraw/zinc/32/52/93/943325293.db2.gz DVUOSHFHVZVFND-SECBINFHSA-N 0 0 354.204 3.587 20 5 FHBDRN COc1cccc(SC)c1N[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000417077528 943329579 /nfs/dbraw/zinc/32/95/79/943329579.db2.gz PLSQSGUZYDPEKP-AWEZNQCLSA-N 0 0 373.434 3.543 20 5 FHBDRN CCCCCn1cc(CNC(=O)N(C)Cc2ccccc2[N+](=O)[O-])c(C)n1 ZINC000503794347 943371873 /nfs/dbraw/zinc/37/18/73/943371873.db2.gz JQISQZBYXMUILH-UHFFFAOYSA-N 0 0 373.457 3.632 20 5 FHBDRN CCCOc1ccc(C(=O)NCCc2ccc([N+](=O)[O-])cc2)cc1OCC ZINC000053215866 943380764 /nfs/dbraw/zinc/38/07/64/943380764.db2.gz FEQVPGYJFMKXGZ-UHFFFAOYSA-N 0 0 372.421 3.755 20 5 FHBDRN O=C(Cc1c(Cl)cccc1Cl)NCCc1ccc([N+](=O)[O-])cc1 ZINC000053218089 943381556 /nfs/dbraw/zinc/38/15/56/943381556.db2.gz CWDIMRLTWKVOJL-UHFFFAOYSA-N 0 0 353.205 3.803 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@H](C2CCC2)C1 ZINC000412465869 943392290 /nfs/dbraw/zinc/39/22/90/943392290.db2.gz UONUJTYOZAVMLE-INIZCTEOSA-N 0 0 364.467 3.736 20 5 FHBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+](C)[C@@H](Cc1ccccc1)C(=O)[O-] ZINC000514945313 943396995 /nfs/dbraw/zinc/39/69/95/943396995.db2.gz URJSRGCXDWXLGF-SFHVURJKSA-N 0 0 372.421 3.510 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(-c2nc(Cc3cccs3)no2)cc1OC ZINC000514949266 943415960 /nfs/dbraw/zinc/41/59/60/943415960.db2.gz BUTRECQMJLEMBG-UHFFFAOYSA-N 0 0 361.379 3.704 20 5 FHBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@@H]2C[C@H]2c2ccc3ccccc3c2)s1 ZINC000435438111 943417099 /nfs/dbraw/zinc/41/70/99/943417099.db2.gz NTPCQRHBWZRBKR-LSDHHAIUSA-N 0 0 374.443 3.644 20 5 FHBDRN COc1ccccc1C1(CNC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)CC1 ZINC000503929372 943421277 /nfs/dbraw/zinc/42/12/77/943421277.db2.gz NHRBPUBCZXACGS-UHFFFAOYSA-N 0 0 365.389 3.546 20 5 FHBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N[C@H]1C[C@H]1c1ccccc1 ZINC000503944186 943429112 /nfs/dbraw/zinc/42/91/12/943429112.db2.gz CDMYZVITBOWCDC-CQDKDKBSSA-N 0 0 360.797 3.688 20 5 FHBDRN Cc1ccc(S(=O)(=O)N(C)c2ccc(Cl)cc2F)c([N+](=O)[O-])c1 ZINC000435472173 943432836 /nfs/dbraw/zinc/43/28/36/943432836.db2.gz JWXGYTXKRRJAJS-UHFFFAOYSA-N 0 0 358.778 3.521 20 5 FHBDRN Cc1ccc(C)c(S(=O)(=O)N(C)c2ccc(Cl)cc2F)c1[N+](=O)[O-] ZINC000435475557 943434188 /nfs/dbraw/zinc/43/41/88/943434188.db2.gz VJCBGUICEOCOEA-UHFFFAOYSA-N 0 0 372.805 3.829 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])N1CCC[C@H]1/C=C/c1ccccc1 ZINC000503960709 943439362 /nfs/dbraw/zinc/43/93/62/943439362.db2.gz KYTWLTFPEWANBD-HHNLSAEISA-N 0 0 351.406 3.982 20 5 FHBDRN COC[C@H]1CCCN(C(=O)c2cccc3c(=O)c4ccccc4[nH]c23)CC1 ZINC000584704648 943449189 /nfs/dbraw/zinc/44/91/89/943449189.db2.gz QSYMQLSNYFNNNN-HNNXBMFYSA-N 0 0 364.445 3.570 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NCC(=O)N(Cc1ccccc1)C(C)(C)C ZINC000515022432 943450877 /nfs/dbraw/zinc/45/08/77/943450877.db2.gz YSYQBXCKAPZSKZ-UHFFFAOYSA-N 0 0 371.437 3.843 20 5 FHBDRN Cc1ccc(NC(=O)N(C)[C@@H](C)[C@@H]2Cc3ccccc3O2)cc1[N+](=O)[O-] ZINC000434213273 943451196 /nfs/dbraw/zinc/45/11/96/943451196.db2.gz FYKKXAMTTKWNCB-UGSOOPFHSA-N 0 0 355.394 3.759 20 5 FHBDRN C[C@H](NC(=O)N1CC[C@@H](COc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000503981351 943451322 /nfs/dbraw/zinc/45/13/22/943451322.db2.gz IRQQRUMPNAORPC-JKSUJKDBSA-N 0 0 369.421 3.766 20 5 FHBDRN C[C@H](Oc1cccc2ccccc21)C(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000435510377 943452032 /nfs/dbraw/zinc/45/20/32/943452032.db2.gz GXZLUQQOHFZOMQ-HNNXBMFYSA-N 0 0 364.401 3.874 20 5 FHBDRN COc1cc(COc2cccc(Oc3ncccn3)c2)c([N+](=O)[O-])cc1F ZINC000183962390 943486911 /nfs/dbraw/zinc/48/69/11/943486911.db2.gz YMSYMLYNWAPIBH-UHFFFAOYSA-N 0 0 371.324 3.904 20 5 FHBDRN O=[N+]([O-])c1cccc2ncnc(N[C@@H]3C[C@H]3c3cc(F)c(F)c(F)c3)c21 ZINC000435571283 943492567 /nfs/dbraw/zinc/49/25/67/943492567.db2.gz TTXKJBVDYIHSQA-TVQRCGJNSA-N 0 0 360.295 3.923 20 5 FHBDRN C[C@@H](c1ccccc1)N(C(=O)c1nn(C)cc1[N+](=O)[O-])c1ccccc1 ZINC000504091540 943496584 /nfs/dbraw/zinc/49/65/84/943496584.db2.gz LICHIUXGGMIKHY-AWEZNQCLSA-N 0 0 350.378 3.736 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N1CCO[C@@H](c2cccc(F)c2)C1 ZINC000515097930 943503724 /nfs/dbraw/zinc/50/37/24/943503724.db2.gz YBVXHMKGDDBXFO-GOSISDBHSA-N 0 0 373.384 3.902 20 5 FHBDRN CSc1ccc(CCNc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])cc1 ZINC000435592067 943507971 /nfs/dbraw/zinc/50/79/71/943507971.db2.gz JFBDVXNJVNSXLG-UHFFFAOYSA-N 0 0 371.462 3.864 20 5 FHBDRN Cc1cccc(CN2CCN(C(=O)Nc3ccc(C)c([N+](=O)[O-])c3)CC2)c1 ZINC000515114020 943512118 /nfs/dbraw/zinc/51/21/18/943512118.db2.gz PUYHMPDWKRPIIK-UHFFFAOYSA-N 0 0 368.437 3.561 20 5 FHBDRN CSc1ccc(CCNc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)cc1 ZINC000435603343 943512313 /nfs/dbraw/zinc/51/23/13/943512313.db2.gz HRWBCYAFJAMECY-UHFFFAOYSA-N 0 0 357.435 3.856 20 5 FHBDRN C[C@H]1CN(c2cccc3cnccc32)CCN1Cc1ccccc1[N+](=O)[O-] ZINC000515123888 943516330 /nfs/dbraw/zinc/51/63/30/943516330.db2.gz MAHFUJOHQBCJLL-INIZCTEOSA-N 0 0 362.433 3.854 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@H]1CCCc2ccccc21 ZINC000504192012 943542622 /nfs/dbraw/zinc/54/26/22/943542622.db2.gz SKWOZAHFWPVADI-AWEZNQCLSA-N 0 0 355.394 3.845 20 5 FHBDRN C[S@](=O)C1(CNc2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])CCC1 ZINC000435666174 943547947 /nfs/dbraw/zinc/54/79/47/943547947.db2.gz ZLQUVTZLCYQLPC-SANMLTNESA-N 0 0 372.446 3.539 20 5 FHBDRN CCn1cc(NC(=O)c2ccc(N3C[C@@H](C)C[C@H](C)C3)c([N+](=O)[O-])c2)cn1 ZINC000515193205 943557737 /nfs/dbraw/zinc/55/77/37/943557737.db2.gz ABYHDMJHHWLJNA-KBPBESRZSA-N 0 0 371.441 3.546 20 5 FHBDRN COc1cc(NC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)c(C)c(OC)c1 ZINC000504276896 943568800 /nfs/dbraw/zinc/56/88/00/943568800.db2.gz LEJZQKRNOVRYEJ-UHFFFAOYSA-N 0 0 355.350 3.654 20 5 FHBDRN CCN(Cc1ccc2c(c1)OCO2)C(=O)c1cc(SC)ccc1[N+](=O)[O-] ZINC000053285110 943577164 /nfs/dbraw/zinc/57/71/64/943577164.db2.gz DCVCYIDENMXQFG-UHFFFAOYSA-N 0 0 374.418 3.708 20 5 FHBDRN Cc1cc(C)cc(OCCC(=O)N2c3ccc([N+](=O)[O-])cc3C[C@@H]2C)c1 ZINC000504286671 943582174 /nfs/dbraw/zinc/58/21/74/943582174.db2.gz SAGGWDUJCUPHAV-HNNXBMFYSA-N 0 0 354.406 3.958 20 5 FHBDRN COc1cc(C)c(NS(=O)(=O)c2cc([N+](=O)[O-])cc(C)c2C)cc1C ZINC000435732761 943586542 /nfs/dbraw/zinc/58/65/42/943586542.db2.gz RLTFCMCNTKOWDO-UHFFFAOYSA-N 0 0 364.423 3.638 20 5 FHBDRN O=C(CSCc1ccc([N+](=O)[O-])cc1)Nc1ccc2c(c1)OCCCO2 ZINC000513813064 943589962 /nfs/dbraw/zinc/58/99/62/943589962.db2.gz WYUJMIZTPMKEJW-UHFFFAOYSA-N 0 0 374.418 3.628 20 5 FHBDRN CCCCCn1cc(CNC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)c(C)n1 ZINC000504348157 943601214 /nfs/dbraw/zinc/60/12/14/943601214.db2.gz ZIFLBSYMYGFVGP-UHFFFAOYSA-N 0 0 369.425 3.701 20 5 FHBDRN CCCCCn1cc(CNC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)c(C)n1 ZINC000504360623 943604524 /nfs/dbraw/zinc/60/45/24/943604524.db2.gz XXYSGOIKWROWKJ-UHFFFAOYSA-N 0 0 369.425 3.701 20 5 FHBDRN CC(C)COc1ncccc1C(=O)N1c2ccc([N+](=O)[O-])cc2C[C@H]1C ZINC000504381930 943610379 /nfs/dbraw/zinc/61/03/79/943610379.db2.gz PQIHRPFHBBMYCZ-CYBMUJFWSA-N 0 0 355.394 3.616 20 5 FHBDRN CS(=O)(=O)c1ccc(SCCCOc2ccc([N+](=O)[O-])cc2)cc1 ZINC000504389539 943618657 /nfs/dbraw/zinc/61/86/57/943618657.db2.gz UKWKMXJZOADJDQ-UHFFFAOYSA-N 0 0 367.448 3.560 20 5 FHBDRN C[C@H](NC(=O)COc1ccc(C(F)(F)F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000053286602 943620417 /nfs/dbraw/zinc/62/04/17/943620417.db2.gz JOFZKWMAJXFSGI-NSHDSACASA-N 0 0 368.311 3.870 20 5 FHBDRN O=[N+]([O-])c1ccc(C(F)(F)F)c(CN2CCC(O)(C(F)(F)F)CC2)c1 ZINC000293764726 943621842 /nfs/dbraw/zinc/62/18/42/943621842.db2.gz KHIJBSOOMKXDTJ-UHFFFAOYSA-N 0 0 372.265 3.503 20 5 FHBDRN COc1ccc(Cc2nc([C@@H]3C[C@H]3c3ccccc3)no2)cc1[N+](=O)[O-] ZINC000584792843 943625947 /nfs/dbraw/zinc/62/59/47/943625947.db2.gz YISGRVKYVBCIKV-LSDHHAIUSA-N 0 0 351.362 3.848 20 5 FHBDRN CCOc1ccc(NC(=O)N(C)CCc2ccccc2[N+](=O)[O-])c(F)c1 ZINC000417473185 943629880 /nfs/dbraw/zinc/62/98/80/943629880.db2.gz KBMCTMYRKVPEIR-UHFFFAOYSA-N 0 0 361.373 3.839 20 5 FHBDRN O=C(Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1)NCCC1CCCCC1 ZINC000504509301 943648694 /nfs/dbraw/zinc/64/86/94/943648694.db2.gz LHHXYHFDLRJDOB-UHFFFAOYSA-N 0 0 356.426 3.545 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCO[C@H](C)C1 ZINC000504534362 943649902 /nfs/dbraw/zinc/64/99/02/943649902.db2.gz RGCPAZVSRMXJLB-OLZOCXBDSA-N 0 0 352.456 3.642 20 5 FHBDRN C[C@@](NC(=O)Cc1ccc([N+](=O)[O-])cc1)(c1ccccc1)C(F)(F)F ZINC000504571506 943686098 /nfs/dbraw/zinc/68/60/98/943686098.db2.gz WIKCBRUBEQRIHY-MRXNPFEDSA-N 0 0 352.312 3.731 20 5 FHBDRN C[C@H](c1ccccc1)N(C)C(=O)CN(C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000504590204 943701131 /nfs/dbraw/zinc/70/11/31/943701131.db2.gz QLAARRGQTBDYJZ-HOFZKYPUSA-N 0 0 367.449 3.759 20 5 FHBDRN C[C@](NC(=O)c1cc(F)cc([N+](=O)[O-])c1)(c1ccccc1)C(F)(F)F ZINC000504594375 943704119 /nfs/dbraw/zinc/70/41/19/943704119.db2.gz WJBPZAKITREAMK-HNNXBMFYSA-N 0 0 356.275 3.941 20 5 FHBDRN O=C([O-])[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1ccc(C2CCC2)cc1 ZINC000417573944 943712574 /nfs/dbraw/zinc/71/25/74/943712574.db2.gz QUZQOZRUJZDBOI-SFHVURJKSA-N 0 0 354.406 3.648 20 5 FHBDRN O=C(Nc1cccc(-c2nnco2)c1)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000515281342 943758097 /nfs/dbraw/zinc/75/80/97/943758097.db2.gz FCJNHWHTLYVTOS-UHFFFAOYSA-N 0 0 350.290 3.643 20 5 FHBDRN COCC[C@H](C)CNC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 ZINC000412483285 943762320 /nfs/dbraw/zinc/76/23/20/943762320.db2.gz KHBHDCZRGQQLRC-HNNXBMFYSA-N 0 0 371.437 3.609 20 5 FHBDRN Cn1cc(C(=O)NC2CC(C(C)(C)C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000504739321 943764161 /nfs/dbraw/zinc/76/41/61/943764161.db2.gz FQCYQAACJBAJHQ-UHFFFAOYSA-N 0 0 356.426 3.550 20 5 FHBDRN CCn1c([C@@H]2CCCS2)nnc1N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000424157230 943765782 /nfs/dbraw/zinc/76/57/82/943765782.db2.gz MYDOVTFUZJUQEJ-INIZCTEOSA-N 0 0 373.482 3.943 20 5 FHBDRN CSc1c(F)cccc1C(=O)N=c1cc(-c2cccc([N+](=O)[O-])c2)[nH][nH]1 ZINC000437384440 943768253 /nfs/dbraw/zinc/76/82/53/943768253.db2.gz JXNSXWDNIZLKRI-UHFFFAOYSA-N 0 0 372.381 3.520 20 5 FHBDRN O=C(N[C@H]1C[C@H](c2ccccc2F)C1)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000437395363 943772789 /nfs/dbraw/zinc/77/27/89/943772789.db2.gz OLDUQRHKHMZXEJ-JOCQHMNTSA-N 0 0 353.353 3.891 20 5 FHBDRN COc1cccc(C(=O)NC[C@H]2CCC[C@H](C(F)(F)F)C2)c1[N+](=O)[O-] ZINC000435818628 943774005 /nfs/dbraw/zinc/77/40/05/943774005.db2.gz SVFMLGOQOOQYCU-QWRGUYRKSA-N 0 0 360.332 3.702 20 5 FHBDRN COc1cccc(C(=O)NC[C@@H]2CCC[C@H](C(F)(F)F)C2)c1[N+](=O)[O-] ZINC000435818627 943774490 /nfs/dbraw/zinc/77/44/90/943774490.db2.gz SVFMLGOQOOQYCU-MNOVXSKESA-N 0 0 360.332 3.702 20 5 FHBDRN CC(C)Oc1ccc(C(=O)Nc2ccc3cc([N+](=O)[O-])ccc3n2)nc1 ZINC000435818657 943774494 /nfs/dbraw/zinc/77/44/94/943774494.db2.gz SWVSHYNIFNXVKZ-UHFFFAOYSA-N 0 0 352.350 3.578 20 5 FHBDRN COc1cccc(C(=O)N2CC[C@H](Cc3ccccc3)[C@@H]2C)c1[N+](=O)[O-] ZINC000435818461 943775174 /nfs/dbraw/zinc/77/51/74/943775174.db2.gz MPBGCNWPQLZAJZ-GOEBONIOSA-N 0 0 354.406 3.697 20 5 FHBDRN O=C([O-])C[C@H](C[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C(F)(F)F ZINC000417628346 943778795 /nfs/dbraw/zinc/77/87/95/943778795.db2.gz PGJCVBHDYQCZJA-LLVKDONJSA-N 0 0 372.299 3.598 20 5 FHBDRN CCN(CC)C(=O)c1ccc(C(=O)O[C@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000103804211 943779768 /nfs/dbraw/zinc/77/97/68/943779768.db2.gz FUXWLTXRHDASGZ-CQSZACIVSA-N 0 0 370.405 3.995 20 5 FHBDRN O=C(NCCc1cc2ccccc2s1)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000584857982 943780219 /nfs/dbraw/zinc/78/02/19/943780219.db2.gz GYBZFPQGRQSPMC-UHFFFAOYSA-N 0 0 370.386 3.511 20 5 FHBDRN CCC(CC)[C@H](CCNC(=O)Nc1cc([N+](=O)[O-])ccc1OC)OC ZINC000437407167 943782177 /nfs/dbraw/zinc/78/21/77/943782177.db2.gz OGMNWHCFWTWWBL-HNNXBMFYSA-N 0 0 353.419 3.566 20 5 FHBDRN Cc1cc(OCC(=O)Nc2cccc(C(C)(C)C)c2O)ccc1[N+](=O)[O-] ZINC000435819508 943793448 /nfs/dbraw/zinc/79/34/48/943793448.db2.gz SOHDDWWBPYGGRK-UHFFFAOYSA-N 0 0 358.394 3.924 20 5 FHBDRN Cc1ccc(OCCNC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)cc1 ZINC000435827024 943797932 /nfs/dbraw/zinc/79/79/32/943797932.db2.gz OLCNYVWQYJUTQO-UHFFFAOYSA-N 0 0 372.424 3.799 20 5 FHBDRN O=C(N[C@H]1C[C@@H]1c1ccccc1OC(F)F)c1ccc([N+](=O)[O-])cc1F ZINC000437428837 943798427 /nfs/dbraw/zinc/79/84/27/943798427.db2.gz FBHNLKAFNDDDIA-OCCSQVGLSA-N 0 0 366.295 3.621 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N[C@@H]1CCCC[C@H]1OC(F)F ZINC000504771768 943802563 /nfs/dbraw/zinc/80/25/63/943802563.db2.gz XUZQRRFCNWFMCS-BXUZGUMPSA-N 0 0 357.357 3.884 20 5 FHBDRN C[C@H]1CCN(C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)CC12CCC2 ZINC000408090549 943804519 /nfs/dbraw/zinc/80/45/19/943804519.db2.gz VHJVBKMZYJHZJM-HNNXBMFYSA-N 0 0 357.454 3.847 20 5 FHBDRN CCOc1ccc(/C=C/c2nc(Cc3ccc([N+](=O)[O-])cn3)no2)cc1C ZINC000516893093 943809545 /nfs/dbraw/zinc/80/95/45/943809545.db2.gz SYTCSVDHPTVWNY-WEVVVXLNSA-N 0 0 366.377 3.841 20 5 FHBDRN CCCN(C(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C1CC1 ZINC000504832395 943819364 /nfs/dbraw/zinc/81/93/64/943819364.db2.gz ZLLYLMBXIGMAGF-UHFFFAOYSA-N 0 0 359.348 3.817 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCN(C)Cc2ccccc21 ZINC000504835993 943823905 /nfs/dbraw/zinc/82/39/05/943823905.db2.gz XDRHPLOHBOLNQM-AWEZNQCLSA-N 0 0 371.462 3.554 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCN(C)Cc2ccccc21 ZINC000504835996 943824316 /nfs/dbraw/zinc/82/43/16/943824316.db2.gz XDRHPLOHBOLNQM-CQSZACIVSA-N 0 0 371.462 3.554 20 5 FHBDRN O=C(N[C@H]1C[C@@H]1c1ccccc1OC(F)F)c1csc([N+](=O)[O-])c1 ZINC000437454137 943824755 /nfs/dbraw/zinc/82/47/55/943824755.db2.gz PKDLVLGPKMZJFI-MNOVXSKESA-N 0 0 354.334 3.544 20 5 FHBDRN C[C@H]1COCC[C@H]1C(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000435872259 943825390 /nfs/dbraw/zinc/82/53/90/943825390.db2.gz NNXQINBTKUDJHA-SCLBCKFNSA-N 0 0 356.378 3.998 20 5 FHBDRN Cc1ccc([C@@H]2C[C@H](C)CCN2C(=O)CNc2ccccc2[N+](=O)[O-])o1 ZINC000437470934 943841137 /nfs/dbraw/zinc/84/11/37/943841137.db2.gz JUSSGMZJPXWBIH-DYVFJYSZSA-N 0 0 357.410 3.908 20 5 FHBDRN O=C(N[C@H]1C[C@H](c2cc(F)cc(F)c2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000437476314 943845686 /nfs/dbraw/zinc/84/56/86/943845686.db2.gz RKRYZVFRMOMDQR-MJHDQNEOSA-N 0 0 350.296 3.688 20 5 FHBDRN C[C@@H]1c2cccn2CCN1C(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000435923239 943859231 /nfs/dbraw/zinc/85/92/31/943859231.db2.gz NWCONVGLYXWDDQ-CQSZACIVSA-N 0 0 357.413 3.700 20 5 FHBDRN C[C@@H]1CN(C(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)CCS1 ZINC000505724737 943862949 /nfs/dbraw/zinc/86/29/49/943862949.db2.gz BKOBINRXCFWDBT-CYBMUJFWSA-N 0 0 357.435 3.916 20 5 FHBDRN COc1ccc(-c2csc(NC(=O)c3cccc([N+](=O)[O-])c3N)n2)cc1 ZINC000468730511 943863633 /nfs/dbraw/zinc/86/36/33/943863633.db2.gz VYYBKONVGBQFCA-UHFFFAOYSA-N 0 0 370.390 3.561 20 5 FHBDRN O=C(NC[C@@H]1CCC(F)(F)C1)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000435954920 943876797 /nfs/dbraw/zinc/87/67/97/943876797.db2.gz RRFCMXKFYLUONP-LLVKDONJSA-N 0 0 374.362 3.986 20 5 FHBDRN CCOc1ccc(C(=O)N2CC[C@H](c3ccccc3C)C2)cc1[N+](=O)[O-] ZINC000504900609 943876897 /nfs/dbraw/zinc/87/68/97/943876897.db2.gz AJCVQRYWAPYXQZ-INIZCTEOSA-N 0 0 354.406 3.932 20 5 FHBDRN C[C@H](c1noc(CCCNc2ccc([N+](=O)[O-])cc2)n1)c1nccs1 ZINC000424365154 943878677 /nfs/dbraw/zinc/87/86/77/943878677.db2.gz UWLOAKXNYCOJBG-LLVKDONJSA-N 0 0 359.411 3.631 20 5 FHBDRN O=C(N[C@H]1C[C@H](c2cccc(F)c2)C1)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000437521631 943881087 /nfs/dbraw/zinc/88/10/87/943881087.db2.gz CHZLNQCPLLMIMH-MQMHXKEQSA-N 0 0 353.353 3.891 20 5 FHBDRN Cc1noc(-c2ccc(C)c(NC(=O)c3cc([N+](=O)[O-])c(C)s3)c2)n1 ZINC000515447042 943881611 /nfs/dbraw/zinc/88/16/11/943881611.db2.gz VSLNDNVJECWKBQ-UHFFFAOYSA-N 0 0 358.379 3.884 20 5 FHBDRN CC(C)Oc1nc(N2CC(c3nc4ccccc4s3)C2)ccc1[N+](=O)[O-] ZINC000516981105 943882836 /nfs/dbraw/zinc/88/28/36/943882836.db2.gz JDNQEKLGUFRWTC-UHFFFAOYSA-N 0 0 370.434 3.991 20 5 FHBDRN CSc1ccc(CCNC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000437530346 943891843 /nfs/dbraw/zinc/89/18/43/943891843.db2.gz YAPYSECPWLRAFV-UHFFFAOYSA-N 0 0 358.463 3.953 20 5 FHBDRN C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)[C@@H]1CCCOC1 ZINC000504919778 943898234 /nfs/dbraw/zinc/89/82/34/943898234.db2.gz QSUJUBCHGPXRBN-LSDHHAIUSA-N 0 0 370.405 3.932 20 5 FHBDRN CCN(C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2)[C@H](C)c1ccc(F)cc1 ZINC000515465583 943903211 /nfs/dbraw/zinc/90/32/11/943903211.db2.gz UVHFIQDAKDTNEO-LLVKDONJSA-N 0 0 360.341 3.686 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)NC2CC(C(C)(C)C)C2)cc1SC ZINC000504916851 943911917 /nfs/dbraw/zinc/91/19/17/943911917.db2.gz BNQUKMPNWNMTKF-UHFFFAOYSA-N 0 0 352.456 3.880 20 5 FHBDRN CCCOc1ccc([C@@H](C)Nc2ccc(C(N)=O)cc2[N+](=O)[O-])cc1OC ZINC000515480657 943920804 /nfs/dbraw/zinc/92/08/04/943920804.db2.gz UWPKYVFMCRZBLL-GFCCVEGCSA-N 0 0 373.409 3.664 20 5 FHBDRN CC(=O)c1cc(N[C@H]2CCN(c3c(F)cccc3F)C2)ccc1[N+](=O)[O-] ZINC000517022055 943923333 /nfs/dbraw/zinc/92/33/33/943923333.db2.gz VGEFDHUNLLJJDD-ZDUSSCGKSA-N 0 0 361.348 3.766 20 5 FHBDRN COc1cc(C(=O)N2CC[C@@H](c3ccccc3C)C2)c([N+](=O)[O-])cc1OC ZINC000504947345 943929046 /nfs/dbraw/zinc/92/90/46/943929046.db2.gz DVLIYMLPGKTPNQ-CQSZACIVSA-N 0 0 370.405 3.550 20 5 FHBDRN O=[N+]([O-])c1c2cccnc2ccc1N1CCC[C@H](OCC(F)(F)F)C1 ZINC000515501887 943930200 /nfs/dbraw/zinc/93/02/00/943930200.db2.gz UTQKPLYELFPQCS-NSHDSACASA-N 0 0 355.316 3.691 20 5 FHBDRN COC(=O)c1ccc(C(C)C)c(NC(=O)c2cccc(OC)c2[N+](=O)[O-])c1 ZINC000436026213 943947296 /nfs/dbraw/zinc/94/72/96/943947296.db2.gz ILCHAPAAEMJPTO-UHFFFAOYSA-N 0 0 372.377 3.766 20 5 FHBDRN Cc1ccc(S(=O)(=O)N2CCC[C@@H]2CCc2ccccc2)cc1[N+](=O)[O-] ZINC000515516446 943948870 /nfs/dbraw/zinc/94/88/70/943948870.db2.gz AXWVODIKVZWEKT-QGZVFWFLSA-N 0 0 374.462 3.689 20 5 FHBDRN COc1cccc(C(=O)N[C@@H](C)c2cc3cccc(F)c3o2)c1[N+](=O)[O-] ZINC000436016483 943955963 /nfs/dbraw/zinc/95/59/63/943955963.db2.gz RLKHLOMXTJIAEW-JTQLQIEISA-N 0 0 358.325 3.980 20 5 FHBDRN CCC(CC)[C@@H](CCNC(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1)OC ZINC000437603815 943960394 /nfs/dbraw/zinc/96/03/94/943960394.db2.gz IZRUTKHQYLBOSM-CXAGYDPISA-N 0 0 351.447 3.796 20 5 FHBDRN CCC(CC)[C@H](CCNC(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1)OC ZINC000437603816 943960465 /nfs/dbraw/zinc/96/04/65/943960465.db2.gz IZRUTKHQYLBOSM-DYVFJYSZSA-N 0 0 351.447 3.796 20 5 FHBDRN COc1cccc(C(=O)N[C@H](c2ccc(F)c(C)c2)C2CC2)c1[N+](=O)[O-] ZINC000436037340 943961856 /nfs/dbraw/zinc/96/18/56/943961856.db2.gz UOUHIMPRHZXCDP-KRWDZBQOSA-N 0 0 358.369 3.932 20 5 FHBDRN CC(C)[C@H](CC(F)(F)F)NC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000566525925 943963292 /nfs/dbraw/zinc/96/32/92/943963292.db2.gz ZIRHCYQDRSPDQY-LBPRGKRZSA-N 0 0 354.275 3.509 20 5 FHBDRN C/C(=C\c1ccccc1)CN(C)C(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000566527241 943963315 /nfs/dbraw/zinc/96/33/15/943963315.db2.gz UAOKGAXMEDYSBS-MDWZMJQESA-N 0 0 360.360 3.977 20 5 FHBDRN C[C@H]1CCCN1c1nnc(-c2ccc([N+](=O)[O-])cc2)n1Cc1ccccc1 ZINC000517063572 943963243 /nfs/dbraw/zinc/96/32/43/943963243.db2.gz POHPOLYKAUVNHQ-HNNXBMFYSA-N 0 0 363.421 3.890 20 5 FHBDRN O=C1CCCc2ccccc2N1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000505008784 943965780 /nfs/dbraw/zinc/96/57/80/943965780.db2.gz JTKPNARDDBYIEZ-UHFFFAOYSA-N 0 0 364.361 3.514 20 5 FHBDRN Cc1cccc2c(C(=O)N3CCN(c4ccccc4[N+](=O)[O-])CC3)coc21 ZINC000424550588 943969209 /nfs/dbraw/zinc/96/92/09/943969209.db2.gz YLSOIRWICZDSFD-UHFFFAOYSA-N 0 0 365.389 3.612 20 5 FHBDRN Cc1ccc([C@@H]2CCN(C(=O)CCC(=O)c3cccc([N+](=O)[O-])c3)C2)cc1 ZINC000517071867 943972212 /nfs/dbraw/zinc/97/22/12/943972212.db2.gz YBVSGFIWKSQSSC-GOSISDBHSA-N 0 0 366.417 3.882 20 5 FHBDRN CCC[C@H]1C[C@H]1NC(=O)c1cc(F)cc2c(=O)c3cccc(F)c3[nH]c12 ZINC000436048704 943972210 /nfs/dbraw/zinc/97/22/10/943972210.db2.gz 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FHBDRN O=C(Nc1nc2cc(F)c(F)cc2s1)c1cc(F)cc([N+](=O)[O-])c1 ZINC000518286184 944236230 /nfs/dbraw/zinc/23/62/30/944236230.db2.gz LXFDOICYOQTBOE-UHFFFAOYSA-N 0 0 353.281 3.874 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1N1CCC(c3ncccc3Cl)CC1)CCN2 ZINC000436365420 944237041 /nfs/dbraw/zinc/23/70/41/944237041.db2.gz IVJSMKJYETZOEH-UHFFFAOYSA-N 0 0 358.829 3.995 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2ncn(Cc3ccc(Br)s3)n2)cc1 ZINC000550124141 944239563 /nfs/dbraw/zinc/23/95/63/944239563.db2.gz VKBXOTAXMYISJX-UHFFFAOYSA-N 0 0 365.212 3.726 20 5 FHBDRN Cc1cc(OCc2nc(Cc3ccc(F)c(F)c3)no2)ccc1[N+](=O)[O-] ZINC000515819120 944240037 /nfs/dbraw/zinc/24/00/37/944240037.db2.gz DFAXCUJXWUABJB-UHFFFAOYSA-N 0 0 361.304 3.734 20 5 FHBDRN CCCc1n[nH]c(C(=O)N(C)Cc2ccc3ccccc3c2)c1[N+](=O)[O-] ZINC000518298646 944244928 /nfs/dbraw/zinc/24/49/28/944244928.db2.gz DOPHRQNGOOQCRH-UHFFFAOYSA-N 0 0 352.394 3.696 20 5 FHBDRN C[C@@H]1CCc2c(sc3ncn(Cc4c(F)cccc4[N+](=O)[O-])c(=O)c32)C1 ZINC000728786893 944245570 /nfs/dbraw/zinc/24/55/70/944245570.db2.gz FJGRLYWZMOSETO-SNVBAGLBSA-N 0 0 373.409 3.678 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H]1C[C@H]1c1cc(F)c(F)c(F)c1 ZINC000436376831 944246094 /nfs/dbraw/zinc/24/60/94/944246094.db2.gz DHRRHDPMPMQDFD-XHDPSFHLSA-N 0 0 365.311 3.998 20 5 FHBDRN Cc1c(CN(C)c2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])cnn1C ZINC000566600835 944247368 /nfs/dbraw/zinc/24/73/68/944247368.db2.gz GXQAIZGDSGQFSN-UHFFFAOYSA-N 0 0 364.405 3.504 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)F)cc1NCc1ccc(OCC2CC2)nc1 ZINC000436385166 944255770 /nfs/dbraw/zinc/25/57/70/944255770.db2.gz FSHOMIYKXHGZJP-UHFFFAOYSA-N 0 0 368.315 3.805 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N(c1ccc(F)cc1)C(C)C ZINC000518318012 944263172 /nfs/dbraw/zinc/26/31/72/944263172.db2.gz CASIKDXRTIVQMC-UHFFFAOYSA-N 0 0 352.387 3.646 20 5 FHBDRN CCOc1cc2c(cc1[C@@H]1C[C@@H]1Nc1ncccc1[N+](=O)[O-])O[C@@H](C)C2 ZINC000517393317 944263773 /nfs/dbraw/zinc/26/37/73/944263773.db2.gz MTUKTVRQMVBHHL-WHOFXGATSA-N 0 0 355.394 3.680 20 5 FHBDRN COc1ccc(CNC(=O)N2CCC[C@H]2c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000515829330 944264448 /nfs/dbraw/zinc/26/44/48/944264448.db2.gz AICPTBPXLKOPKO-INIZCTEOSA-N 0 0 373.384 3.789 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)F)cc1NC[C@@H](CCO)c1ccccc1 ZINC000436397830 944273212 /nfs/dbraw/zinc/27/32/12/944273212.db2.gz QMBXINISKFUUKM-GFCCVEGCSA-N 0 0 355.316 3.587 20 5 FHBDRN CC(C)NC(=O)[C@@H]1CCC[C@@H](Nc2cc(C(F)(F)F)ncc2[N+](=O)[O-])C1 ZINC000436398497 944274178 /nfs/dbraw/zinc/27/41/78/944274178.db2.gz VEIYMTYVTVDVKG-GHMZBOCLSA-N 0 0 374.363 3.504 20 5 FHBDRN O=C([O-])c1ccc([N+](=O)[O-])c(NC[C@@H](c2ccco2)[NH+]2CCCCC2)c1 ZINC000515851164 944274415 /nfs/dbraw/zinc/27/44/15/944274415.db2.gz MYILLBCCVXBTNO-INIZCTEOSA-N 0 0 359.382 3.525 20 5 FHBDRN COc1cc(C)c(NC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)cc1C ZINC000436397931 944275540 /nfs/dbraw/zinc/27/55/40/944275540.db2.gz QWEBVGCFQVNOSC-UHFFFAOYSA-N 0 0 366.377 3.658 20 5 FHBDRN C/C=C/C[C@@H](CO)NC(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000473710413 944279137 /nfs/dbraw/zinc/27/91/37/944279137.db2.gz OSFUVFGULINXQK-FAAWYNLUSA-N 0 0 371.393 3.836 20 5 FHBDRN CCCc1[nH]nc(C(=O)Nc2cc(Cl)c(OC)c(Cl)c2)c1[N+](=O)[O-] ZINC000518332248 944280595 /nfs/dbraw/zinc/28/05/95/944280595.db2.gz MCGKWSDXNQZCBN-UHFFFAOYSA-N 0 0 373.196 3.838 20 5 FHBDRN CCCc1n[nH]c(C(=O)NCc2cc(C)cc3c(C)c(C)[nH]c32)c1[N+](=O)[O-] ZINC000518332309 944280755 /nfs/dbraw/zinc/28/07/55/944280755.db2.gz QLEAEJDBDNGWOZ-UHFFFAOYSA-N 0 0 369.425 3.607 20 5 FHBDRN Cc1c(CC(=O)N(C)CCOc2cccc(Cl)c2)cccc1[N+](=O)[O-] ZINC000439029056 944284344 /nfs/dbraw/zinc/28/43/44/944284344.db2.gz QBRKITJQSRPATI-UHFFFAOYSA-N 0 0 362.813 3.637 20 5 FHBDRN COc1ccc(CCCNC(=O)c2cc(SC)ccc2[N+](=O)[O-])cc1 ZINC000515871136 944288933 /nfs/dbraw/zinc/28/89/33/944288933.db2.gz IIGKQDVAHLRBQU-UHFFFAOYSA-N 0 0 360.435 3.688 20 5 FHBDRN Cn1cnc2cc(NC(=O)c3ccc(C(F)(F)F)cc3[N+](=O)[O-])ccc21 ZINC000473719111 944295854 /nfs/dbraw/zinc/29/58/54/944295854.db2.gz DZEMOVVMAOMJBC-UHFFFAOYSA-N 0 0 364.283 3.753 20 5 FHBDRN COc1ccc(COCCNc2cc(C(F)(F)F)ncc2[N+](=O)[O-])cc1 ZINC000436422175 944296273 /nfs/dbraw/zinc/29/62/73/944296273.db2.gz YVIZXZRQMTZTAH-UHFFFAOYSA-N 0 0 371.315 3.646 20 5 FHBDRN O=C(Cn1ccc([N+](=O)[O-])n1)Nc1ccc(-c2cc3ccccc3o2)cc1 ZINC000123221014 944304458 /nfs/dbraw/zinc/30/44/58/944304458.db2.gz QZBZGGHAPUAIIE-UHFFFAOYSA-N 0 0 362.345 3.843 20 5 FHBDRN Cc1cccc(C)c1-n1nnnc1CSCc1cccc([N+](=O)[O-])c1C ZINC000105633856 944320221 /nfs/dbraw/zinc/32/02/21/944320221.db2.gz MKSAZVZJAKNOQG-UHFFFAOYSA-N 0 0 369.450 3.929 20 5 FHBDRN O=C(NCCc1nc2ccccc2s1)c1ccc([N+](=O)[O-])cc1Cl ZINC000017370815 944320750 /nfs/dbraw/zinc/32/07/50/944320750.db2.gz RJVVVCDXUOIEOX-UHFFFAOYSA-N 0 0 361.810 3.830 20 5 FHBDRN O=[N+]([O-])c1ccc(N[C@H]2CCc3nnc(-c4ccc(F)cc4)n3C2)c(F)c1 ZINC000505829610 944328065 /nfs/dbraw/zinc/32/80/65/944328065.db2.gz BUJHYGRBBSUSNY-ZDUSSCGKSA-N 0 0 371.347 3.558 20 5 FHBDRN COc1cccc([C@H]2CCCN2C(=O)COc2ccc([N+](=O)[O-])c(C)c2)c1 ZINC000053541378 944330095 /nfs/dbraw/zinc/33/00/95/944330095.db2.gz BTSFRLRYJLFLLL-LJQANCHMSA-N 0 0 370.405 3.654 20 5 FHBDRN CCc1sc(C(=O)N(C)c2ccc([N+](=O)[O-])nc2)cc1Br ZINC001270303160 944337772 /nfs/dbraw/zinc/33/77/72/944337772.db2.gz LPFABBDHLANCTE-UHFFFAOYSA-N 0 0 370.228 3.653 20 5 FHBDRN CCOc1ccc([C@H]2CCCN2c2ccc(C(=O)NC)cc2[N+](=O)[O-])cc1 ZINC000053552893 944343831 /nfs/dbraw/zinc/34/38/31/944343831.db2.gz YLEMUNISFHVKLP-QGZVFWFLSA-N 0 0 369.421 3.695 20 5 FHBDRN Cc1cnn([C@H]2CCCc3ccccc32)c1NC(=O)c1cc([N+](=O)[O-])c[nH]1 ZINC000518387998 944343854 /nfs/dbraw/zinc/34/38/54/944343854.db2.gz JBRYUYYAFPXASY-KRWDZBQOSA-N 0 0 365.393 3.606 20 5 FHBDRN COc1cc(CN2C[C@@H](C)O[C@@H](c3ccccc3)C2)c([N+](=O)[O-])cc1F ZINC000184251271 944350327 /nfs/dbraw/zinc/35/03/27/944350327.db2.gz BCZGXAYNIQRBNB-BFUOFWGJSA-N 0 0 360.385 3.705 20 5 FHBDRN Cc1ccc(OC[C@H](O)COc2c(Cl)cccc2[N+](=O)[O-])c(C)c1 ZINC000550177229 944353655 /nfs/dbraw/zinc/35/36/55/944353655.db2.gz SSUHIEYSVOSDCA-ZDUSSCGKSA-N 0 0 351.786 3.684 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1OC[C@@H](O)Cc1ccc(C(F)(F)F)cc1 ZINC000550178722 944354723 /nfs/dbraw/zinc/35/47/23/944354723.db2.gz NMWWMDUQPDKWIH-HNNXBMFYSA-N 0 0 355.312 3.904 20 5 FHBDRN COc1cc(CN2CCC(OC3CCCC3)CC2)c([N+](=O)[O-])cc1F ZINC000184259023 944354938 /nfs/dbraw/zinc/35/49/38/944354938.db2.gz VHWOLGZBYALQIS-UHFFFAOYSA-N 0 0 352.406 3.666 20 5 FHBDRN Cc1ccc(OC[C@@H](O)Cc2ccc(C(F)(F)F)cc2)cc1[N+](=O)[O-] ZINC000550179358 944359055 /nfs/dbraw/zinc/35/90/55/944359055.db2.gz XIXNDYNFSQGKTJ-AWEZNQCLSA-N 0 0 355.312 3.904 20 5 FHBDRN CNC(=O)c1ccc(N[C@H](C)c2ccc(OC(F)F)cc2)c([N+](=O)[O-])c1 ZINC000053557201 944366940 /nfs/dbraw/zinc/36/69/40/944366940.db2.gz GGDBWAJGAOKPDT-SNVBAGLBSA-N 0 0 365.336 3.729 20 5 FHBDRN CC(C)c1ccc(C(=O)N(CC(F)(F)F)[C@@H]2CCOC2)cc1[N+](=O)[O-] ZINC000439152090 944367043 /nfs/dbraw/zinc/36/70/43/944367043.db2.gz HIWCNBHDAGHTEX-GFCCVEGCSA-N 0 0 360.332 3.512 20 5 FHBDRN CNC(=O)c1ccc(NC[C@H](Nc2ccccc2)C(C)C)c([N+](=O)[O-])c1 ZINC000053556581 944367845 /nfs/dbraw/zinc/36/78/45/944367845.db2.gz QAYZUTJWSPUJPR-KRWDZBQOSA-N 0 0 356.426 3.503 20 5 FHBDRN Cc1ccc(-c2[nH]nc(NC(=O)Nc3cc([N+](=O)[O-])ccc3C)c2C)o1 ZINC000436485703 944369410 /nfs/dbraw/zinc/36/94/10/944369410.db2.gz HNFQGSLMTVOVNW-UHFFFAOYSA-N 0 0 355.354 3.569 20 5 FHBDRN CC[C@@H]1C[C@@]1(NC(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-])c1cccc(C)c1 ZINC000506181870 944370429 /nfs/dbraw/zinc/37/04/29/944370429.db2.gz BYQPKMYFFFYXLK-YJYMSZOUSA-N 0 0 356.426 3.805 20 5 FHBDRN C[C@@H](Nc1c(Br)cncc1[N+](=O)[O-])c1c(F)cccc1F ZINC000500272959 944379950 /nfs/dbraw/zinc/37/99/50/944379950.db2.gz RZNOADDNUQYFTG-SSDOTTSWSA-N 0 0 358.142 3.626 20 5 FHBDRN CCO[C@@H](C)c1nc(CC(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)cs1 ZINC000086625528 944380647 /nfs/dbraw/zinc/38/06/47/944380647.db2.gz JTKAHWQWWDZIBW-LBPRGKRZSA-N 0 0 363.439 3.947 20 5 FHBDRN CC(C)[C@@H](C(=O)N=c1cc(-c2cccc([N+](=O)[O-])c2)[nH][nH]1)c1ccccc1 ZINC000439149678 944380869 /nfs/dbraw/zinc/38/08/69/944380869.db2.gz CXFPFCUCSDNQAF-LJQANCHMSA-N 0 0 364.405 3.785 20 5 FHBDRN CCNc1ccc(C(=O)N(Cc2ccc(OC)cc2)C2CC2)cc1[N+](=O)[O-] ZINC000015034307 944383572 /nfs/dbraw/zinc/38/35/72/944383572.db2.gz QUIARAAHLIGGRD-UHFFFAOYSA-N 0 0 369.421 3.840 20 5 FHBDRN O=C(c1cc2sccc2s1)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000515973850 944384593 /nfs/dbraw/zinc/38/45/93/944384593.db2.gz FFQBNKIXYPJDMS-UHFFFAOYSA-N 0 0 373.459 3.833 20 5 FHBDRN CNC(=O)c1ccc(N[C@H](C)c2ccccc2OC(C)C)c([N+](=O)[O-])c1 ZINC000053572432 944385706 /nfs/dbraw/zinc/38/57/06/944385706.db2.gz LQUMVTIOHCMURY-CYBMUJFWSA-N 0 0 357.410 3.915 20 5 FHBDRN CCOC(=O)CN(C(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1)C1CCCC1 ZINC000439168475 944390911 /nfs/dbraw/zinc/39/09/11/944390911.db2.gz LJROGKQZNIEPRE-UHFFFAOYSA-N 0 0 362.426 3.666 20 5 FHBDRN Cc1cccc2oc(CCNC(=O)c3c(C)cc(Cl)cc3[N+](=O)[O-])nc21 ZINC000439167733 944391763 /nfs/dbraw/zinc/39/17/63/944391763.db2.gz KSYKLAQBHSWIGY-UHFFFAOYSA-N 0 0 373.796 3.979 20 5 FHBDRN CN(Cc1ccc(OC(F)(F)F)cc1)C(=O)c1ccc([N+](=O)[O-])cc1 ZINC000105877834 944393027 /nfs/dbraw/zinc/39/30/27/944393027.db2.gz JFPQGFHVWYWNDK-UHFFFAOYSA-N 0 0 354.284 3.766 20 5 FHBDRN O=C(Nc1nccc2sccc21)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000162643635 944393831 /nfs/dbraw/zinc/39/38/31/944393831.db2.gz IRTBDMMSLRPKCB-UHFFFAOYSA-N 0 0 365.374 3.643 20 5 FHBDRN CCn1c(SCc2ccc(OC)nc2)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000123680559 944395348 /nfs/dbraw/zinc/39/53/48/944395348.db2.gz QRKCHAKITBCNEY-UHFFFAOYSA-N 0 0 371.422 3.569 20 5 FHBDRN CCOc1ccc2c(c1)CCN(C(=O)Nc1ccc([N+](=O)[O-])c(C)c1)C2 ZINC000473770942 944397435 /nfs/dbraw/zinc/39/74/35/944397435.db2.gz AQHKDGHYQBEUMQ-UHFFFAOYSA-N 0 0 355.394 3.892 20 5 FHBDRN CO[C@H]1Cc2ccccc2N(C(=O)c2c(C)cc(C)c([N+](=O)[O-])c2C)C1 ZINC000500283690 944404532 /nfs/dbraw/zinc/40/45/32/944404532.db2.gz TZIIGWUGNIWWCH-INIZCTEOSA-N 0 0 354.406 3.738 20 5 FHBDRN O=C(c1csc(-c2cccc([N+](=O)[O-])c2)n1)N1Cc2ccccc2C1 ZINC000105976005 944406219 /nfs/dbraw/zinc/40/62/19/944406219.db2.gz PQYXVNCGBMRSCT-UHFFFAOYSA-N 0 0 351.387 3.874 20 5 FHBDRN C[C@@H](c1ccccc1Cl)N(C)S(=O)(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000123739702 944407746 /nfs/dbraw/zinc/40/77/46/944407746.db2.gz KKAPSODQHQCEOO-JTQLQIEISA-N 0 0 372.805 3.769 20 5 FHBDRN Cc1cn(CC(=O)c2cc(C)n(CCc3cccs3)c2C)nc1[N+](=O)[O-] ZINC000439193384 944417106 /nfs/dbraw/zinc/41/71/06/944417106.db2.gz RTWNVRFODIZJKY-UHFFFAOYSA-N 0 0 372.450 3.705 20 5 FHBDRN Nc1c(C(=O)Nc2ccc(F)cc2OC2CCCC2)cccc1[N+](=O)[O-] ZINC000123777144 944422125 /nfs/dbraw/zinc/42/21/25/944422125.db2.gz KVXZNXIAKZOCSC-UHFFFAOYSA-N 0 0 359.357 3.890 20 5 FHBDRN O=C(NCCOc1ccc([N+](=O)[O-])cc1)c1ccc(Cl)c(Cl)c1 ZINC000517592407 944422858 /nfs/dbraw/zinc/42/28/58/944422858.db2.gz BFNAWZKVTUJKDH-UHFFFAOYSA-N 0 0 355.177 3.710 20 5 FHBDRN COc1ccccc1[C@@H](Nc1ccc(F)cc1[N+](=O)[O-])c1nccn1C ZINC000053599804 944426760 /nfs/dbraw/zinc/42/67/60/944426760.db2.gz CODQCEOXNOKPQZ-QGZVFWFLSA-N 0 0 356.357 3.678 20 5 FHBDRN CC(C)N(c1ccc(Cl)cc1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000517604171 944437606 /nfs/dbraw/zinc/43/76/06/944437606.db2.gz FTIKHPTVVPUGAR-UHFFFAOYSA-N 0 0 354.815 3.852 20 5 FHBDRN CC(C)Sc1ccc(C(=O)N2CCC[C@@H](n3cc([N+](=O)[O-])cn3)C2)cc1 ZINC000364355224 944437755 /nfs/dbraw/zinc/43/77/55/944437755.db2.gz BCDYGBKEKADFHK-OAHLLOKOSA-N 0 0 374.466 3.769 20 5 FHBDRN COc1ccc(NC(=O)NC[C@H](C)Oc2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000543890801 944438903 /nfs/dbraw/zinc/43/89/03/944438903.db2.gz ZBNJSCMGUMXSDS-ZDUSSCGKSA-N 0 0 359.382 3.501 20 5 FHBDRN CC(C)CCS(=O)(=O)N(Cc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000439223887 944452098 /nfs/dbraw/zinc/45/20/98/944452098.db2.gz NDGIUTJPROLPEL-UHFFFAOYSA-N 0 0 362.451 3.977 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)c1cccc(OC(C)C)c1 ZINC000046809915 944454334 /nfs/dbraw/zinc/45/43/34/944454334.db2.gz ZOGAPQSREZAGLP-ZDUSSCGKSA-N 0 0 358.394 3.882 20 5 FHBDRN O=C(N[C@H]1C[C@@H]1c1ccccc1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000425972942 944464117 /nfs/dbraw/zinc/46/41/17/944464117.db2.gz DOZLLZSIMRPBSO-MOPGFXCFSA-N 0 0 351.406 3.825 20 5 FHBDRN O=[N+]([O-])c1ccn(C2CCN(Cc3cc(C(F)(F)F)ccc3F)CC2)n1 ZINC000425973519 944467649 /nfs/dbraw/zinc/46/76/49/944467649.db2.gz JMRGSIALDKNVSN-UHFFFAOYSA-N 0 0 372.322 3.786 20 5 FHBDRN COc1ccc2c(c1)CCCCN2C(=O)c1cc(OC)ccc1[N+](=O)[O-] ZINC000500305843 944469213 /nfs/dbraw/zinc/46/92/13/944469213.db2.gz VJCUYGFVSCKURA-UHFFFAOYSA-N 0 0 356.378 3.595 20 5 FHBDRN CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)O[C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000759829206 944469309 /nfs/dbraw/zinc/46/93/09/944469309.db2.gz RYOXBCUZYVXTCN-DOMZBBRYSA-N 0 0 366.414 3.748 20 5 FHBDRN Cc1c(Nc2cc([N+](=O)[O-])cc(F)c2C)c(=O)n(-c2ccccc2)n1C ZINC001167980713 944477113 /nfs/dbraw/zinc/47/71/13/944477113.db2.gz QKIRRPCAPWGBPG-UHFFFAOYSA-N 0 0 356.357 3.584 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)N2CCc3ccsc3C2)cc1SC ZINC000123879988 944477427 /nfs/dbraw/zinc/47/74/27/944477427.db2.gz LTVDYWDLWAGEIV-UHFFFAOYSA-N 0 0 364.448 3.585 20 5 FHBDRN Cc1cc2n(n1)[C@@H](C(F)(F)F)CCN2C(=O)c1cc(C)ccc1[N+](=O)[O-] ZINC000425596896 944494955 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CCc1nc([C@@H](C)NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)cs1 ZINC000110506476 944514625 /nfs/dbraw/zinc/51/46/25/944514625.db2.gz VQBDWHJESZZLGN-SNVBAGLBSA-N 0 0 360.439 3.679 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@H](C)c1ccc(Cl)c2ccccc21 ZINC000184287573 944522303 /nfs/dbraw/zinc/52/23/03/944522303.db2.gz WLFPYLZCINWPMU-LLVKDONJSA-N 0 0 372.812 3.784 20 5 FHBDRN COc1ccc(CNC(=O)c2c(Cl)c3ccccc3n2C)cc1[N+](=O)[O-] ZINC000516137473 944524230 /nfs/dbraw/zinc/52/42/30/944524230.db2.gz XXFYYNFEUOOWLW-UHFFFAOYSA-N 0 0 373.796 3.679 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]c(CSc3nccn3-c3ccccc3)nc2c1 ZINC000473794225 944524932 /nfs/dbraw/zinc/52/49/32/944524932.db2.gz BBTQTDSFVGGRFI-UHFFFAOYSA-N 0 0 351.391 3.949 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@H](n2cccn2)C1 ZINC000506209213 944526863 /nfs/dbraw/zinc/52/68/63/944526863.db2.gz UPHXYBMMKWKPQO-HNNXBMFYSA-N 0 0 374.466 3.771 20 5 FHBDRN C[C@H]1CO[C@@H](c2ccccc2Cl)CN1C(=O)c1ccc([N+](=O)[O-])cc1 ZINC000110518297 944527917 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ZINC000506217296 944555613 /nfs/dbraw/zinc/55/56/13/944555613.db2.gz UCHRTGFPZHLMCS-ZDUSSCGKSA-N 0 0 374.466 3.840 20 5 FHBDRN O=C(c1cscc1Cl)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC001126479675 944556348 /nfs/dbraw/zinc/55/63/48/944556348.db2.gz XSRCVDJRLXLYDB-UHFFFAOYSA-N 0 0 366.826 3.993 20 5 FHBDRN CC(C)OC(=O)C[C@H](NC(=O)CC(C)(C)C)c1ccccc1[N+](=O)[O-] ZINC000053659713 944557082 /nfs/dbraw/zinc/55/70/82/944557082.db2.gz KIQYVDXHFVOLEI-AWEZNQCLSA-N 0 0 350.415 3.530 20 5 FHBDRN Cn1cc(C(=O)NCC2CCC(C)(C)CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000536260291 944559376 /nfs/dbraw/zinc/55/93/76/944559376.db2.gz NSRUYZKFMIGZJW-UHFFFAOYSA-N 0 0 370.453 3.942 20 5 FHBDRN O=C(COc1ccccc1[N+](=O)[O-])Nc1csnc1-c1ccccc1 ZINC000436722123 944560594 /nfs/dbraw/zinc/56/05/94/944560594.db2.gz LLWAWKTZTVPBQM-UHFFFAOYSA-N 0 0 355.375 3.736 20 5 FHBDRN C[C@@H](c1nc2ccccc2s1)N(C)C(=O)Cc1ccccc1[N+](=O)[O-] ZINC000015094256 944568535 /nfs/dbraw/zinc/56/85/35/944568535.db2.gz XPAHMBSVVWNCSL-LBPRGKRZSA-N 0 0 355.419 3.967 20 5 FHBDRN CC(C)C(C)(C)CNC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000438410359 944570205 /nfs/dbraw/zinc/57/02/05/944570205.db2.gz SIVSYCYWQNBFAP-UHFFFAOYSA-N 0 0 362.348 3.948 20 5 FHBDRN COc1ccc(-c2nc(COc3c(Cl)cncc3[N+](=O)[O-])co2)cc1 ZINC000506560859 944573252 /nfs/dbraw/zinc/57/32/52/944573252.db2.gz KBUKXZTYCZNKRN-UHFFFAOYSA-N 0 0 361.741 3.886 20 5 FHBDRN O=C(c1cc(F)c([N+](=O)[O-])cc1F)N1C[C@@H]2CCC[C@]2(C(F)(F)F)C1 ZINC000894381094 944575559 /nfs/dbraw/zinc/57/55/59/944575559.db2.gz FPLOSGYHJAIMTP-RTHLEPHNSA-N 0 0 364.270 3.678 20 5 FHBDRN Cc1ccc2c(c1)N(S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-])CCC2 ZINC000110590950 944577429 /nfs/dbraw/zinc/57/74/29/944577429.db2.gz ZEKUGEABHHYNKM-UHFFFAOYSA-N 0 0 366.826 3.698 20 5 FHBDRN Cn1c2ccccc2nc1C(C)(C)NCc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000613744339 944577861 /nfs/dbraw/zinc/57/78/61/944577861.db2.gz ISZLDOHQZXNXFF-UHFFFAOYSA-N 0 0 365.393 3.648 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)NCCCc1c[nH]c2ccc(F)cc12 ZINC000506226244 944582308 /nfs/dbraw/zinc/58/23/08/944582308.db2.gz ZLMCOZULROMSGB-UHFFFAOYSA-N 0 0 355.369 3.507 20 5 FHBDRN CNc1ccc(C(=O)N[C@@H](c2nccs2)c2ccccc2)cc1[N+](=O)[O-] ZINC000517765511 944584507 /nfs/dbraw/zinc/58/45/07/944584507.db2.gz DONYHZOYJBSTTA-MRXNPFEDSA-N 0 0 368.418 3.612 20 5 FHBDRN CCS(=O)(=O)Cc1ccc(NCc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000894790598 944598569 /nfs/dbraw/zinc/59/85/69/944598569.db2.gz PXSBWKDGKYBGBQ-UHFFFAOYSA-N 0 0 368.842 3.795 20 5 FHBDRN CCC(CC)(CNC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F)OC ZINC000426015081 944619376 /nfs/dbraw/zinc/61/93/76/944619376.db2.gz GETDMONEFLYRKX-UHFFFAOYSA-N 0 0 361.345 3.523 20 5 FHBDRN COc1c(F)cc(F)cc1NC(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000473836925 944623629 /nfs/dbraw/zinc/62/36/29/944623629.db2.gz OMHITXXUPSFHLR-UHFFFAOYSA-N 0 0 351.309 3.546 20 5 FHBDRN COc1c(F)cc(F)cc1NC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000473836490 944624732 /nfs/dbraw/zinc/62/47/32/944624732.db2.gz NZIAEOSYKBMNBY-VIFPVBQESA-N 0 0 351.309 3.764 20 5 FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCCC[C@H]1C ZINC000133914670 944630171 /nfs/dbraw/zinc/63/01/71/944630171.db2.gz ITKKRASCQQOJOW-IUODEOHRSA-N 0 0 352.456 3.642 20 5 FHBDRN O=C(Nc1ccc2nccnc2c1)c1ccc([N+](=O)[O-])cc1Br ZINC000150740812 944631428 /nfs/dbraw/zinc/63/14/28/944631428.db2.gz PGZVBMATCZJVKG-UHFFFAOYSA-N 0 0 373.166 3.553 20 5 FHBDRN COc1cc(-c2noc(-c3c[nH]c4cc([N+](=O)[O-])ccc43)n2)ccc1O ZINC000436788563 944637812 /nfs/dbraw/zinc/63/78/12/944637812.db2.gz HHMXHBQLGXMIFE-UHFFFAOYSA-N 0 0 352.306 3.507 20 5 FHBDRN Cc1oc(-c2cccs2)nc1C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000759870002 944643298 /nfs/dbraw/zinc/64/32/98/944643298.db2.gz KJJUMIVGCRHHMU-UHFFFAOYSA-N 0 0 357.391 3.592 20 5 FHBDRN C[C@@H](Oc1ccc(-c2ccccc2)cc1[N+](=O)[O-])C(=O)NCC(F)(F)F ZINC000518723287 944648922 /nfs/dbraw/zinc/64/89/22/944648922.db2.gz LIDYZACBNJXYFX-LLVKDONJSA-N 0 0 368.311 3.708 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)Oc2ccc3c(C)cc(=O)oc3c2)c1 ZINC000018230652 944654084 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C[C@H](CC1CCCCC1)NC(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000426407818 944697168 /nfs/dbraw/zinc/69/71/68/944697168.db2.gz XANAKSKKSSHPEI-GFCCVEGCSA-N 0 0 359.430 3.629 20 5 FHBDRN COc1ccccc1[C@]1(C)C[C@@H]1NC(=O)c1c(C)c(C)ccc1[N+](=O)[O-] ZINC001126467340 944703016 /nfs/dbraw/zinc/70/30/16/944703016.db2.gz WIKFRJHSSHXWKM-PXNSSMCTSA-N 0 0 354.406 3.680 20 5 FHBDRN COc1cccc(CO[C@@H](C)c2nc(-c3ccc([N+](=O)[O-])cc3)no2)c1 ZINC000545551171 944704926 /nfs/dbraw/zinc/70/49/26/944704926.db2.gz USBOMZXFEZXNGT-LBPRGKRZSA-N 0 0 355.350 3.931 20 5 FHBDRN O=C(CC[C@H]1CCc2ccccc21)NCCOc1ccc([N+](=O)[O-])cc1 ZINC001125944235 944716478 /nfs/dbraw/zinc/71/64/78/944716478.db2.gz VSMDIOANTKKINC-MRXNPFEDSA-N 0 0 354.406 3.600 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H](C)[C@H]1Oc2ccccc2[C@H]1C ZINC000438507621 944717140 /nfs/dbraw/zinc/71/71/40/944717140.db2.gz UIPDUIBSXCOBKG-FMTVUPSXSA-N 0 0 371.393 3.678 20 5 FHBDRN Cc1c(NCc2nc(CC(C)C)no2)cc(Br)cc1[N+](=O)[O-] ZINC000429801792 944723690 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CC[C@@H]1CCC[C@H](C[NH2+][C@@H](Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C(=O)[O-])C1 ZINC000426739411 944752136 /nfs/dbraw/zinc/75/21/36/944752136.db2.gz CBXMPGWDXSOLRM-TYILLQQXSA-N 0 0 373.453 3.878 20 5 FHBDRN COc1ccccc1CN(C)C(=O)c1c([N+](=O)[O-])cccc1C(F)(F)F ZINC000516348345 944755415 /nfs/dbraw/zinc/75/54/15/944755415.db2.gz TUOBFDAVSSOGCF-UHFFFAOYSA-N 0 0 368.311 3.894 20 5 FHBDRN O=C(Nc1ccc(Cc2ccncc2)cc1)c1cc(F)cc([N+](=O)[O-])c1 ZINC000518786862 944766356 /nfs/dbraw/zinc/76/63/56/944766356.db2.gz DHSIXUSACCJDSO-UHFFFAOYSA-N 0 0 351.337 3.972 20 5 FHBDRN COc1cc(Cl)c(C(=O)COc2cccc([N+](=O)[O-])c2C)cc1OC ZINC000518788974 944771602 /nfs/dbraw/zinc/77/16/02/944771602.db2.gz UCXQOQDBNUDXNQ-UHFFFAOYSA-N 0 0 365.769 3.836 20 5 FHBDRN O=C(CCC1CCCC1)N1CCN(C/C=C/c2ccccc2[N+](=O)[O-])CC1 ZINC000506618155 944776284 /nfs/dbraw/zinc/77/62/84/944776284.db2.gz RZWQXYYBMZLITJ-WEVVVXLNSA-N 0 0 371.481 3.723 20 5 FHBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCO[C@H](c2ccccc2)C1 ZINC000517876476 944777096 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FHBDRN Cc1ccc(C[NH2+][C@@H](C(=O)[O-])C23CC4CC(CC(C4)C2)C3)cc1[N+](=O)[O-] ZINC000426787080 944810725 /nfs/dbraw/zinc/81/07/25/944810725.db2.gz AQYHOMVDHJLKPN-LMFLDHGRSA-N 0 0 358.438 3.662 20 5 FHBDRN C[C@@H]1[C@@H](c2ccccc2)CCN1C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000126523407 944817974 /nfs/dbraw/zinc/81/79/74/944817974.db2.gz NOADTUYMIXXTQM-BEFAXECRSA-N 0 0 353.422 3.725 20 5 FHBDRN O=C([O-])[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1csc2ccccc12 ZINC000426799530 944821014 /nfs/dbraw/zinc/82/10/14/944821014.db2.gz IMCZTKJEJUNTQP-INIZCTEOSA-N 0 0 356.403 3.595 20 5 FHBDRN O=C([O-])[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1cccc(Cl)c1Cl ZINC000426801092 944822319 /nfs/dbraw/zinc/82/23/19/944822319.db2.gz QAZSAYSDJDICEH-AWEZNQCLSA-N 0 0 369.204 3.687 20 5 FHBDRN CCN(CC)c1ccc(NC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)cn1 ZINC000506290049 944824386 /nfs/dbraw/zinc/82/43/86/944824386.db2.gz OGKWNGPVUDLYID-ZDUSSCGKSA-N 0 0 374.466 3.955 20 5 FHBDRN Cc1c(Cc2noc([C@@H](C)c3ccc4c(c3)OCO4)n2)cccc1[N+](=O)[O-] ZINC000426456622 944843447 /nfs/dbraw/zinc/84/34/47/944843447.db2.gz FSKJPQIYLQKUFT-LBPRGKRZSA-N 0 0 367.361 3.758 20 5 FHBDRN Cc1c(Cc2noc([C@H](C)c3ccc4c(c3)OCO4)n2)cccc1[N+](=O)[O-] ZINC000426456621 944843640 /nfs/dbraw/zinc/84/36/40/944843640.db2.gz FSKJPQIYLQKUFT-GFCCVEGCSA-N 0 0 367.361 3.758 20 5 FHBDRN C[C@H](OC(=O)c1cncc(Br)c1)c1ccc([N+](=O)[O-])cc1 ZINC000047176335 944850332 /nfs/dbraw/zinc/85/03/32/944850332.db2.gz KTDVMTSPPKOEPA-VIFPVBQESA-N 0 0 351.156 3.670 20 5 FHBDRN Cc1cccc(Cl)c1NC(=O)N1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000518844053 944854443 /nfs/dbraw/zinc/85/44/43/944854443.db2.gz LPLXAIWSKSNSRF-UHFFFAOYSA-N 0 0 361.785 3.983 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)NCc1ccc(-c2ccccc2)o1 ZINC000426843302 944860858 /nfs/dbraw/zinc/86/08/58/944860858.db2.gz OSVLGVPORZCRTQ-UHFFFAOYSA-N 0 0 352.346 3.793 20 5 FHBDRN CCc1cccc2c1OCC[C@H]2NC(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000507014784 944862902 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O=C(COc1cccc([N+](=O)[O-])c1)Nc1cc(Br)ccc1F ZINC000110649130 944881221 /nfs/dbraw/zinc/88/12/21/944881221.db2.gz STUZFXZVYXYXOL-UHFFFAOYSA-N 0 0 369.146 3.514 20 5 FHBDRN O=C(CC1CCCCC1)NCCNc1ccc2ncccc2c1[N+](=O)[O-] ZINC000507033242 944881675 /nfs/dbraw/zinc/88/16/75/944881675.db2.gz DUVIVXPPKPQFHO-UHFFFAOYSA-N 0 0 356.426 3.642 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])Nc1cc(Br)ccc1F ZINC000110647388 944882310 /nfs/dbraw/zinc/88/23/10/944882310.db2.gz HHEZEYZAZFRSOD-UHFFFAOYSA-N 0 0 368.162 3.547 20 5 FHBDRN CCOc1ccccc1[C@H](CC)NC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000505915005 944883578 /nfs/dbraw/zinc/88/35/78/944883578.db2.gz HGIAYPHFSBABQS-HNNXBMFYSA-N 0 0 368.393 3.751 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)NCCc1cc2ccccc2s1 ZINC000506650948 944883856 /nfs/dbraw/zinc/88/38/56/944883856.db2.gz GJYVFRMAEDLTFU-UHFFFAOYSA-N 0 0 356.403 3.791 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[C@H](Cc2ccccc2)[C@H]1C ZINC000426869559 944884013 /nfs/dbraw/zinc/88/40/13/944884013.db2.gz STZDPONWGRMUGP-GDBMZVCRSA-N 0 0 354.406 3.697 20 5 FHBDRN CC(C)(C(=O)N[C@@H]1C[C@H]1c1c(F)cccc1F)c1ccccc1[N+](=O)[O-] ZINC000511669732 944896264 /nfs/dbraw/zinc/89/62/64/944896264.db2.gz CXIJWNBGDLMESA-IAQYHMDHSA-N 0 0 360.360 3.823 20 5 FHBDRN Cc1ccc(CN(CCc2ccccc2)C(=O)c2cc([N+](=O)[O-])n[nH]2)s1 ZINC000505928706 944908755 /nfs/dbraw/zinc/90/87/55/944908755.db2.gz SJFJNOVFHTTXFX-UHFFFAOYSA-N 0 0 370.434 3.573 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])N[C@H]1CC[C@@H](Cc2ccccc2)C1 ZINC000438688336 944927660 /nfs/dbraw/zinc/92/76/60/944927660.db2.gz VMYAZQLIDBNTPR-ROUUACIJSA-N 0 0 368.433 3.891 20 5 FHBDRN O=C(CSCCCc1ccccc1)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000518912282 944930224 /nfs/dbraw/zinc/93/02/24/944930224.db2.gz UCNQHRREFYOGMJ-UHFFFAOYSA-N 0 0 374.418 3.628 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N1CC2(CCC2)[C@H]1C1CCOCC1 ZINC000425682542 944930228 /nfs/dbraw/zinc/93/02/28/944930228.db2.gz KBSHHZLPWPBFHI-GOSISDBHSA-N 0 0 373.453 3.970 20 5 FHBDRN C[C@H](Cc1ccc(Br)cc1)NC(=O)c1csc([N+](=O)[O-])c1 ZINC000044574403 944934068 /nfs/dbraw/zinc/93/40/68/944934068.db2.gz GSIPFMAGWGBAAB-SECBINFHSA-N 0 0 369.240 3.780 20 5 FHBDRN CS(=O)(=O)c1ccc(CSCc2c(F)cc([N+](=O)[O-])cc2F)cc1 ZINC000507079103 944935233 /nfs/dbraw/zinc/93/52/33/944935233.db2.gz UWRHSZGTWNZFDJ-UHFFFAOYSA-N 0 0 373.402 3.710 20 5 FHBDRN Cc1ccc(CN2CCN(C(=O)c3cccc(Cl)c3)CC2)cc1[N+](=O)[O-] ZINC000506328330 944945006 /nfs/dbraw/zinc/94/50/06/944945006.db2.gz ZXEIGECTEHWCNK-UHFFFAOYSA-N 0 0 373.840 3.515 20 5 FHBDRN CCCc1[nH]nc(C(=O)Nc2ccc(C(F)(F)F)c(OC)c2)c1[N+](=O)[O-] ZINC000426925902 944946543 /nfs/dbraw/zinc/94/65/43/944946543.db2.gz MVPLVSRKQZVIHV-UHFFFAOYSA-N 0 0 372.303 3.550 20 5 FHBDRN Cn1c(C(=O)Nc2ccc(Oc3ccc(F)cc3)nc2)ccc1[N+](=O)[O-] ZINC000516503322 944953038 /nfs/dbraw/zinc/95/30/38/944953038.db2.gz PFTUHFNJIAIHCQ-UHFFFAOYSA-N 0 0 356.313 3.512 20 5 FHBDRN CCN(Cc1ccc(OC)c(OC)c1)c1ncc([N+](=O)[O-])cc1Cl ZINC000432051583 944955703 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Cn1ccnc1-c1cccc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)c1 ZINC000516533318 944984121 /nfs/dbraw/zinc/98/41/21/944984121.db2.gz HLZFAEPBWCZTAR-UHFFFAOYSA-N 0 0 362.345 3.994 20 5 FHBDRN CNC(=O)c1ccc(N[C@H](C)c2ccccc2OC(F)F)c([N+](=O)[O-])c1 ZINC000507133257 944986140 /nfs/dbraw/zinc/98/61/40/944986140.db2.gz UUCGCOLUZWWITN-SNVBAGLBSA-N 0 0 365.336 3.729 20 5 FHBDRN O=[N+]([O-])c1ccc2ccnc(N3CCC[C@H](OCC(F)(F)F)C3)c2c1 ZINC000516549523 944995298 /nfs/dbraw/zinc/99/52/98/944995298.db2.gz MSOGNCKDJOYNBS-ZDUSSCGKSA-N 0 0 355.316 3.691 20 5 FHBDRN CC(F)(F)c1ccc(CNC(=O)NCCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000432074700 945010340 /nfs/dbraw/zinc/01/03/40/945010340.db2.gz GDGQNGIJWQDOTF-UHFFFAOYSA-N 0 0 363.364 3.748 20 5 FHBDRN CC1=C(C)C[C@H](c2nc(-c3ccc(-n4cncn4)c([N+](=O)[O-])c3)no2)CC1 ZINC000516569624 945012396 /nfs/dbraw/zinc/01/23/96/945012396.db2.gz XQXNSPGKVCYMMU-CQSZACIVSA-N 0 0 366.381 3.829 20 5 FHBDRN COc1cc(OC)c(CN(Cc2ccc([N+](=O)[O-])cc2)C2CC2)c(OC)c1 ZINC000507168707 945018495 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361.373 3.539 20 5 FHBDRN CCO[C@H]1C[C@@H](NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)C12CCCC2 ZINC000437122537 945051447 /nfs/dbraw/zinc/05/14/47/945051447.db2.gz AYNKFQAFMLRAJA-MSOLQXFVSA-N 0 0 373.453 3.637 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N(CCOC)[C@H]1CC[C@@H](C)C1 ZINC000439889817 945051646 /nfs/dbraw/zinc/05/16/46/945051646.db2.gz XFDKWJJVSNJNCS-KGLIPLIRSA-N 0 0 365.430 3.662 20 5 FHBDRN CCC(=O)Nc1cccc(-c2noc(-c3ccc([N+](=O)[O-])c(OC)c3)n2)c1 ZINC000545567880 945052253 /nfs/dbraw/zinc/05/22/53/945052253.db2.gz MXTWZWRXDMMSST-UHFFFAOYSA-N 0 0 368.349 3.669 20 5 FHBDRN Cc1cccc2c1CC[C@@H]2Nc1ccc([N+](=O)[O-])cc1C(=O)NC1CC1 ZINC000729471501 945056252 /nfs/dbraw/zinc/05/62/52/945056252.db2.gz ZNALQFAGSGCOFX-SFHVURJKSA-N 0 0 351.406 3.895 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1CC=C(c2c(F)cccc2F)CC1 ZINC000427070509 945056262 /nfs/dbraw/zinc/05/62/62/945056262.db2.gz VRIAKLJMBMNIEP-UHFFFAOYSA-N 0 0 374.343 3.811 20 5 FHBDRN 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ZINC000507705163 945478589 /nfs/dbraw/zinc/47/85/89/945478589.db2.gz GUGOABMOMZAJDF-CYBMUJFWSA-N 0 0 373.409 3.668 20 5 FHBDRN C[C@@H]1CO[C@@H](c2ccccc2)CN1C(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000120785984 945495214 /nfs/dbraw/zinc/49/52/14/945495214.db2.gz OKSLEGVEIZLSGE-SJKOYZFVSA-N 0 0 360.797 3.850 20 5 FHBDRN COc1ccc(NC(=O)[C@H](C)Oc2ccccc2Cl)cc1[N+](=O)[O-] ZINC000543859554 945530503 /nfs/dbraw/zinc/53/05/03/945530503.db2.gz KIWAUPKVBAYHFR-JTQLQIEISA-N 0 0 350.758 3.663 20 5 FHBDRN O=[N+]([O-])c1cnc(N[C@H]2CCOC3(CCCC3)C2)c(Br)c1 ZINC000301679812 945536359 /nfs/dbraw/zinc/53/63/59/945536359.db2.gz FDKHBOITFQYMEI-JTQLQIEISA-N 0 0 356.220 3.656 20 5 FHBDRN Cc1cc(Cl)c(C(=O)N(C)CCN(C)c2ccccc2)cc1[N+](=O)[O-] ZINC001125999288 945540609 /nfs/dbraw/zinc/54/06/09/945540609.db2.gz VUCAVCMNNDMXKV-UHFFFAOYSA-N 0 0 361.829 3.765 20 5 FHBDRN Cc1cccc2c1CCN(CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C2 ZINC000729477639 945541523 /nfs/dbraw/zinc/54/15/23/945541523.db2.gz MJBQWTVECLALCN-UHFFFAOYSA-N 0 0 359.813 3.553 20 5 FHBDRN CC(C)(CO)[C@@H](CNc1nc2sccn2c1[N+](=O)[O-])c1ccccc1 ZINC000120798455 945545943 /nfs/dbraw/zinc/54/59/43/945545943.db2.gz MVBZJSXLADHVHV-ZDUSSCGKSA-N 0 0 360.439 3.518 20 5 FHBDRN C[C@@H]1CC[C@H](O)[C@@H]([C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000281185087 945548711 /nfs/dbraw/zinc/54/87/11/945548711.db2.gz AFFZKHRJJPEDBD-MDRZDLKXSA-N 0 0 366.845 3.650 20 5 FHBDRN O=C(Nc1nc(Cc2ccccc2)ns1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000107356586 945563654 /nfs/dbraw/zinc/56/36/54/945563654.db2.gz JOXZJVDPHDXVOG-UHFFFAOYSA-N 0 0 374.809 3.943 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)C(C)(C)Cc1nc2ccccc2[nH]1 ZINC000281235434 945570851 /nfs/dbraw/zinc/57/08/51/945570851.db2.gz PIPWPPJBVNQCNQ-UHFFFAOYSA-N 0 0 366.421 3.698 20 5 FHBDRN CCCN(Cc1csc([N+](=O)[O-])c1)[C@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000729480312 945578483 /nfs/dbraw/zinc/57/84/83/945578483.db2.gz UJXPWDUKKGRDAW-AWEZNQCLSA-N 0 0 369.487 3.878 20 5 FHBDRN Cc1noc2nc(C3CC3)cc(C(=O)Oc3c(C)cccc3[N+](=O)[O-])c12 ZINC000760023352 945595595 /nfs/dbraw/zinc/59/55/95/945595595.db2.gz SKOVCKMHZCYRGE-UHFFFAOYSA-N 0 0 353.334 3.844 20 5 FHBDRN C[C@@H]1CC[C@H](CNC(=O)c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)C1 ZINC001271265141 945600476 /nfs/dbraw/zinc/60/04/76/945600476.db2.gz IHBVAAGPFWSODB-CVEARBPZSA-N 0 0 359.470 3.997 20 5 FHBDRN C[C@H]1CO[C@@H](c2cccc(Cl)c2)CN1c1ncc([N+](=O)[O-])cc1F ZINC000519629829 945600875 /nfs/dbraw/zinc/60/08/75/945600875.db2.gz GCUSYEDLRRMADH-ZUZCIYMTSA-N 0 0 351.765 3.749 20 5 FHBDRN CC(C)(CNC(=O)[C@H]1C[C@H]1c1cccc([N+](=O)[O-])c1)c1cccc(F)c1 ZINC001126019837 945636245 /nfs/dbraw/zinc/63/62/45/945636245.db2.gz PZBUZMXACBBGMZ-ROUUACIJSA-N 0 0 356.397 3.931 20 5 FHBDRN Cn1nccc1[C@H]1CCCCN1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000281453607 945639340 /nfs/dbraw/zinc/63/93/40/945639340.db2.gz QSPDTVPVHCRJEO-GOSISDBHSA-N 0 0 367.409 3.711 20 5 FHBDRN CCn1ccnc1[C@@H]1CCCCN1C(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000281481520 945646469 /nfs/dbraw/zinc/64/64/69/945646469.db2.gz DCNNJNLJTZRLNN-HNNXBMFYSA-N 0 0 368.393 3.925 20 5 FHBDRN C[C@H](OC(=O)c1cc(F)c([N+](=O)[O-])cc1F)c1nc2ccccc2n1C ZINC000125147629 945650585 /nfs/dbraw/zinc/65/05/85/945650585.db2.gz MPKQHTGFVDBUAO-VIFPVBQESA-N 0 0 361.304 3.678 20 5 FHBDRN Cc1ccccc1OCCCc1nc(Cc2ccccc2[N+](=O)[O-])no1 ZINC000546240020 945657053 /nfs/dbraw/zinc/65/70/53/945657053.db2.gz QUUMPODPWKSJJM-UHFFFAOYSA-N 0 0 353.378 3.889 20 5 FHBDRN COCC[C@H](Cc1ccco1)Nc1ccc([N+](=O)[O-])cc1OC(F)F ZINC000546181011 945661209 /nfs/dbraw/zinc/66/12/09/945661209.db2.gz PXZYVSMEUBQIDF-LLVKDONJSA-N 0 0 356.325 3.849 20 5 FHBDRN CC[C@H]1CN(C(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)CCCO1 ZINC000281513530 945673629 /nfs/dbraw/zinc/67/36/29/945673629.db2.gz IIJLYIZXTZNNCK-HNNXBMFYSA-N 0 0 350.418 3.735 20 5 FHBDRN Cc1ncc(C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)c(C2CC2)n1 ZINC000281532301 945674941 /nfs/dbraw/zinc/67/49/41/945674941.db2.gz YOWAMBVWQYBPSR-UHFFFAOYSA-N 0 0 366.299 3.842 20 5 FHBDRN CC[C@H]1CN(C(=O)c2cccc3c(=O)c4ccccc4[nH]c23)CCCO1 ZINC000281541678 945679916 /nfs/dbraw/zinc/67/99/16/945679916.db2.gz JVZIZHBSUSXVMQ-AWEZNQCLSA-N 0 0 350.418 3.735 20 5 FHBDRN CNc1ccc(C(=O)N2CCC[C@@H]2c2ccc(F)cc2F)cc1[N+](=O)[O-] ZINC000574409840 945680905 /nfs/dbraw/zinc/68/09/05/945680905.db2.gz GYWLRSBAAHFTIQ-MRXNPFEDSA-N 0 0 361.348 3.892 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1)CN(Cc1cc(-c3ccc(F)cc3)no1)CCO2 ZINC000519729278 945682340 /nfs/dbraw/zinc/68/23/40/945682340.db2.gz UZYDMQYKUCCKOU-UHFFFAOYSA-N 0 0 369.352 3.784 20 5 FHBDRN C[C@@H](NC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-])c1ccccn1 ZINC000181752836 945705249 /nfs/dbraw/zinc/70/52/49/945705249.db2.gz FUDYVXNEJSKOTG-SNVBAGLBSA-N 0 0 351.815 3.613 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)O[C@H](C)C(=O)c1cccc(Cl)c1 ZINC000018344453 945721098 /nfs/dbraw/zinc/72/10/98/945721098.db2.gz AJVULEWDRUYLDP-SNVBAGLBSA-N 0 0 363.753 3.685 20 5 FHBDRN Cc1ccc(C(=O)NCc2cccc(OCC(F)(F)F)c2)cc1[N+](=O)[O-] ZINC000107575573 945723860 /nfs/dbraw/zinc/72/38/60/945723860.db2.gz RJZRPHWQVPYZQB-UHFFFAOYSA-N 0 0 368.311 3.774 20 5 FHBDRN Cc1cccc(C(=O)N[C@@H](C)c2cccc(OC(F)F)c2)c1[N+](=O)[O-] ZINC000107625456 945733688 /nfs/dbraw/zinc/73/36/88/945733688.db2.gz BPXXEWKSAVZTGF-NSHDSACASA-N 0 0 350.321 3.996 20 5 FHBDRN COc1cc(CN2C[C@@H](C)OC[C@@H]2c2ccccc2)c([N+](=O)[O-])cc1F ZINC000248620379 945740044 /nfs/dbraw/zinc/74/00/44/945740044.db2.gz LBTKRYWEJCSFHJ-FZKQIMNGSA-N 0 0 360.385 3.705 20 5 FHBDRN O=C(NCC1Cc2ccccc2C1)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000444037857 945743367 /nfs/dbraw/zinc/74/33/67/945743367.db2.gz WLJXKBTYQYVLRO-UHFFFAOYSA-N 0 0 368.436 3.826 20 5 FHBDRN Cc1nn(C)c(C(=O)N2CCc3c2cccc3-c2ccccc2)c1[N+](=O)[O-] ZINC000184141979 945749750 /nfs/dbraw/zinc/74/97/50/945749750.db2.gz VKJAOYJQZRYHCS-UHFFFAOYSA-N 0 0 362.389 3.507 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)c1cncc(-c2ccccc2)c1 ZINC000519778953 945755848 /nfs/dbraw/zinc/75/58/48/945755848.db2.gz OMCNAPVBVRROBC-UHFFFAOYSA-N 0 0 361.401 3.972 20 5 FHBDRN O=C(Nc1cc2c(cc1[N+](=O)[O-])OCCCO2)[C@@H]1CSc2ccccc21 ZINC000522767718 945759199 /nfs/dbraw/zinc/75/91/99/945759199.db2.gz ABVWTSDWMITUDP-GFCCVEGCSA-N 0 0 372.402 3.584 20 5 FHBDRN O=C(NCCNc1ccccc1[N+](=O)[O-])c1csc(-c2cccs2)n1 ZINC000015824044 945779445 /nfs/dbraw/zinc/77/94/45/945779445.db2.gz RRGPJMBNODORET-UHFFFAOYSA-N 0 0 374.447 3.622 20 5 FHBDRN COc1ccccc1C1(NC(=O)c2cc(Cl)c(C)cc2[N+](=O)[O-])CC1 ZINC000843671157 945790420 /nfs/dbraw/zinc/79/04/20/945790420.db2.gz SEDDJZFYADGTOW-UHFFFAOYSA-N 0 0 360.797 3.984 20 5 FHBDRN CCc1cc(-c2noc(Cc3ccc(OC)cc3[N+](=O)[O-])n2)ccc1F ZINC001211852043 945802524 /nfs/dbraw/zinc/80/25/24/945802524.db2.gz OHVWVUQGXKVCQZ-UHFFFAOYSA-N 0 0 357.341 3.946 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)NCC2(C)CCCCC2)cc1OC ZINC000574443623 945806379 /nfs/dbraw/zinc/80/63/79/945806379.db2.gz OEENQNSXAAVPHJ-UHFFFAOYSA-N 0 0 350.415 3.702 20 5 FHBDRN COc1ccc(Cc2nc(-c3ccc4occc4c3)no2)c([N+](=O)[O-])c1 ZINC001211852641 945826318 /nfs/dbraw/zinc/82/63/18/945826318.db2.gz WDYPNUBZHNILID-UHFFFAOYSA-N 0 0 351.318 3.990 20 5 FHBDRN C[C@H](OC(=O)c1cncc(Br)c1)c1cccc([N+](=O)[O-])c1 ZINC000137356182 945829166 /nfs/dbraw/zinc/82/91/66/945829166.db2.gz VYWHHVWHPNUVEL-VIFPVBQESA-N 0 0 351.156 3.670 20 5 FHBDRN CC(C)(C)Cc1cc(=NC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)[nH][nH]1 ZINC000444085254 945830461 /nfs/dbraw/zinc/83/04/61/945830461.db2.gz LVFARHBTULSORT-UHFFFAOYSA-N 0 0 374.444 3.667 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1F)c1ccc(OC[C@H]2CCCO2)cc1 ZINC000519879684 945832406 /nfs/dbraw/zinc/83/24/06/945832406.db2.gz DDAULUVDHHNAQK-OAHLLOKOSA-N 0 0 360.341 3.544 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCC(=O)Nc2ccc(N3CCCC3)cc2)c1 ZINC000018456021 945846345 /nfs/dbraw/zinc/84/63/45/945846345.db2.gz YRODNXZLVFBSKW-UHFFFAOYSA-N 0 0 355.394 3.521 20 5 FHBDRN COC(=O)c1ccc(OC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c(Cl)c1 ZINC000894513671 945852783 /nfs/dbraw/zinc/85/27/83/945852783.db2.gz ZFEAXDPLNHIAQP-UHFFFAOYSA-N 0 0 370.144 3.907 20 5 FHBDRN COc1ccc([C@@H](C)Nc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])cc1 ZINC000519887756 945856771 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373.372 3.709 20 5 FHBDRN O=[N+]([O-])c1ccc(S(=O)(=O)Cc2csc(-c3cccs3)n2)cc1 ZINC000045320902 946008826 /nfs/dbraw/zinc/00/88/26/946008826.db2.gz WQODCIRDYKEDNX-UHFFFAOYSA-N 0 0 366.445 3.754 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)N2CC[C@H](Cc3nccs3)C2)cc1[N+](=O)[O-] ZINC000893451005 946015450 /nfs/dbraw/zinc/01/54/50/946015450.db2.gz FMTZDENFALAGPQ-UONOGXRCSA-N 0 0 374.466 3.695 20 5 FHBDRN Cc1c(C(=O)N2CCc3c2cccc3[N+](=O)[O-])cnn1-c1ccc(C)cc1 ZINC000078149058 946027144 /nfs/dbraw/zinc/02/71/44/946027144.db2.gz XTTOFVFEROLHJW-UHFFFAOYSA-N 0 0 362.389 3.600 20 5 FHBDRN COC(=O)c1cc(NC(=O)CSc2cc(C)ccc2C)cc([N+](=O)[O-])c1 ZINC000522867031 946031462 /nfs/dbraw/zinc/03/14/62/946031462.db2.gz JIGQTBXUDPHIBI-UHFFFAOYSA-N 0 0 374.418 3.729 20 5 FHBDRN O=C(NC1(c2ccccc2)CCOCC1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000522873774 946036712 /nfs/dbraw/zinc/03/67/12/946036712.db2.gz NIYOPVHJEUKIQL-UHFFFAOYSA-N 0 0 360.797 3.684 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@H](c1ccccc1)c1ccc(F)cc1 ZINC000045418645 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FHBDRN CCN(Cc1cccs1)C(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000109276156 946221112 /nfs/dbraw/zinc/22/11/12/946221112.db2.gz LLEBRPBMFZJASX-UHFFFAOYSA-N 0 0 356.407 3.504 20 5 FHBDRN CC(C)(C)NC(=O)c1ccc(NC(=O)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000087048414 946233010 /nfs/dbraw/zinc/23/30/10/946233010.db2.gz SNVNJFHRUBANSY-UHFFFAOYSA-N 0 0 369.421 3.694 20 5 FHBDRN COc1ccc(CNC(=O)Nc2cc([N+](=O)[O-])ccc2OC)cc1Cl ZINC000151397375 946237463 /nfs/dbraw/zinc/23/74/63/946237463.db2.gz DBRMXFQUZHZCJA-UHFFFAOYSA-N 0 0 365.773 3.587 20 5 FHBDRN C[C@H](NC(=O)Cc1cccc([N+](=O)[O-])c1)c1cccc(N2CCCC2)c1 ZINC000088219158 946241218 /nfs/dbraw/zinc/24/12/18/946241218.db2.gz SENHSDNFWHWQKA-HNNXBMFYSA-N 0 0 353.422 3.615 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)[C@H](C)Oc1ccc(F)c(F)c1 ZINC000129467102 946242204 /nfs/dbraw/zinc/24/22/04/946242204.db2.gz DARQTIGAOHYEJL-NSHDSACASA-N 0 0 350.321 3.896 20 5 FHBDRN Nc1ccc(-c2noc(Cc3ccccc3C(F)(F)F)n2)cc1[N+](=O)[O-] ZINC000546258233 946250383 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C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)Cc1csc(-c2ccoc2)n1 ZINC000151903856 946456514 /nfs/dbraw/zinc/45/65/14/946456514.db2.gz PVEDKUYVNPJOAS-NSHDSACASA-N 0 0 369.402 3.832 20 5 FHBDRN COC(=O)[C@@H](CC(F)F)NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000475132605 946468694 /nfs/dbraw/zinc/46/86/94/946468694.db2.gz ACJSBMSBRPHYKQ-CYBMUJFWSA-N 0 0 370.377 3.610 20 5 FHBDRN COC(=O)[C@@H](C[C@@H]1CCCc2ccccc21)NCc1csc([N+](=O)[O-])c1 ZINC000475146823 946472602 /nfs/dbraw/zinc/47/26/02/946472602.db2.gz ZDRBRUVADUGIMC-DOTOQJQBSA-N 0 0 374.462 3.798 20 5 FHBDRN COCc1nc(C)cc(Oc2ccc(Br)c(C)c2[N+](=O)[O-])n1 ZINC000897028650 946472943 /nfs/dbraw/zinc/47/29/43/946472943.db2.gz AAGIXRPYLHCTKJ-UHFFFAOYSA-N 0 0 368.187 3.703 20 5 FHBDRN Cc1nn(CCC(=O)N[C@@H]2CCC[C@H](C(C)C)CC2)c(C)c1[N+](=O)[O-] ZINC000186116740 946485657 /nfs/dbraw/zinc/48/56/57/946485657.db2.gz IYZFNVDFRUJIPQ-JKSUJKDBSA-N 0 0 350.463 3.519 20 5 FHBDRN CCOCc1ccccc1CNC(=O)c1cccc(SC)c1[N+](=O)[O-] ZINC000186115403 946486143 /nfs/dbraw/zinc/48/61/43/946486143.db2.gz AZBVNAKKXRFWSR-UHFFFAOYSA-N 0 0 360.435 3.783 20 5 FHBDRN CCOc1ccc(NC(=O)CN(Cc2ccccc2)C2CC2)c([N+](=O)[O-])c1 ZINC000025120345 946491630 /nfs/dbraw/zinc/49/16/30/946491630.db2.gz GQTKTWYRKZMOMJ-UHFFFAOYSA-N 0 0 369.421 3.597 20 5 FHBDRN O=C(NCCc1ccccc1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000048018943 946492647 /nfs/dbraw/zinc/49/26/47/946492647.db2.gz MKFHOLIKRQZBAP-UHFFFAOYSA-N 0 0 368.311 3.508 20 5 FHBDRN O=C(CN(Cc1ccccc1)C1CC1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000025120379 946493500 /nfs/dbraw/zinc/49/35/00/946493500.db2.gz DYMAJPMMOQIPCA-UHFFFAOYSA-N 0 0 359.813 3.851 20 5 FHBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)N[C@H]1C[C@H]1c1ccccc1 ZINC000067513800 946496028 /nfs/dbraw/zinc/49/60/28/946496028.db2.gz LPHYGECHCRCGCL-PMACEKPBSA-N 0 0 368.436 3.827 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2nc(CN3CCC(O)(C4CCC4)CC3)cs2)c1 ZINC000897034809 946504826 /nfs/dbraw/zinc/50/48/26/946504826.db2.gz MDWPRKZCUHNNOO-UHFFFAOYSA-N 0 0 373.478 3.845 20 5 FHBDRN CC[C@H](C)[C@H](O)CNC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 ZINC000475151813 946509215 /nfs/dbraw/zinc/50/92/15/946509215.db2.gz ZXYRRUURUIDCCJ-SUMWQHHRSA-N 0 0 358.394 3.524 20 5 FHBDRN COCCN(Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)Cc1ccc(C)cc1C ZINC000618276734 946515490 /nfs/dbraw/zinc/51/54/90/946515490.db2.gz IWWWDQTXQCEAOY-UHFFFAOYSA-N 0 0 368.437 3.737 20 5 FHBDRN CSc1cccc(C(=O)NCCOc2c(C)cccc2C)c1[N+](=O)[O-] ZINC000186149353 946517722 /nfs/dbraw/zinc/51/77/22/946517722.db2.gz NRTPUNPWCMWEKJ-UHFFFAOYSA-N 0 0 360.435 3.742 20 5 FHBDRN CSc1cccc(C(=O)Nc2ccc(C)c(NC(C)=O)c2)c1[N+](=O)[O-] ZINC000186153968 946519224 /nfs/dbraw/zinc/51/92/24/946519224.db2.gz UOPUXZWIMMPQAV-UHFFFAOYSA-N 0 0 359.407 3.836 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N(C)[C@H](C)[C@@H]1Cc2ccccc2O1 ZINC000127196773 946523983 /nfs/dbraw/zinc/52/39/83/946523983.db2.gz YUUBOWYZIVGWCI-ACJLOTCBSA-N 0 0 355.394 3.759 20 5 FHBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H](C)[C@H](OC)C1 ZINC000469873934 946528274 /nfs/dbraw/zinc/52/82/74/946528274.db2.gz GRJCCGIASYZYCJ-CZUORRHYSA-N 0 0 366.483 3.984 20 5 FHBDRN Nc1c(Cl)cc(C(=O)N2Cc3ccc(Cl)cc3C2)cc1[N+](=O)[O-] ZINC001141991383 946534464 /nfs/dbraw/zinc/53/44/64/946534464.db2.gz WQIZEKVSCLKWCX-UHFFFAOYSA-N 0 0 352.177 3.640 20 5 FHBDRN O=C(NC1CC1)c1ccc(N[C@@H](Cc2ccccc2)C2CC2)c([N+](=O)[O-])c1 ZINC000609914455 946534855 /nfs/dbraw/zinc/53/48/55/946534855.db2.gz BVKJSFDQLNKFSX-IBGZPJMESA-N 0 0 365.433 3.920 20 5 FHBDRN C[C@H](CNC(=O)N1CCC[C@@]2(CC2(F)F)C1)c1ccccc1[N+](=O)[O-] ZINC000897052148 946538234 /nfs/dbraw/zinc/53/82/34/946538234.db2.gz IZZMNCYLLUTUEP-MLGOLLRUSA-N 0 0 353.369 3.529 20 5 FHBDRN C[C@H](CNC(=O)N1CC(C)(C)[C@H]1c1cccnc1)c1ccccc1[N+](=O)[O-] ZINC000897058029 946544693 /nfs/dbraw/zinc/54/46/93/946544693.db2.gz LOHTZPZGDPDHIW-RDTXWAMCSA-N 0 0 368.437 3.886 20 5 FHBDRN C[C@@H](CNC(=O)N1CC(C)(CC(F)(F)F)C1)c1ccccc1[N+](=O)[O-] ZINC000897061646 946548306 /nfs/dbraw/zinc/54/83/06/946548306.db2.gz MHEMYQOZBMDZTG-NSHDSACASA-N 0 0 359.348 3.682 20 5 FHBDRN Cc1csc([C@@H]2CCN(C(=O)NC[C@H](C)c3ccccc3[N+](=O)[O-])C2)n1 ZINC000897049985 946549910 /nfs/dbraw/zinc/54/99/10/946549910.db2.gz LWYYEILBGDATGB-GXTWGEPZSA-N 0 0 374.466 3.662 20 5 FHBDRN O=[N+]([O-])c1cccc([C@H](N[C@@H](CCO)c2ccco2)c2ccccc2)c1 ZINC000186555405 946550522 /nfs/dbraw/zinc/55/05/22/946550522.db2.gz WLBFKOJPMWUXPS-AZUAARDMSA-N 0 0 352.390 3.991 20 5 FHBDRN CCO[C@H]1C[C@H](N(C)C(=O)c2cccc(SC)c2[N+](=O)[O-])C1(C)C ZINC000186560704 946551901 /nfs/dbraw/zinc/55/19/01/946551901.db2.gz MITFAAHCXZGHST-KBPBESRZSA-N 0 0 352.456 3.592 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCC(CCC[NH+]3CCOCC3)CC2)c(Cl)c1 ZINC000302012869 946555848 /nfs/dbraw/zinc/55/58/48/946555848.db2.gz DFRVEBOIPWFIHN-UHFFFAOYSA-N 0 0 367.877 3.577 20 5 FHBDRN CCOc1ccc(S(=O)(=O)Cc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000487361061 946557984 /nfs/dbraw/zinc/55/79/84/946557984.db2.gz VIVWWKJIMGGMRY-UHFFFAOYSA-N 0 0 355.799 3.621 20 5 FHBDRN COc1ccc(F)cc1[C@@H](C)NC(=O)c1cccc(SC)c1[N+](=O)[O-] ZINC000186165489 946558455 /nfs/dbraw/zinc/55/84/55/946558455.db2.gz VRBJZSJZFYEDRF-SNVBAGLBSA-N 0 0 364.398 3.955 20 5 FHBDRN COc1ccc(OC(F)F)c(NC(=O)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000048283462 946565094 /nfs/dbraw/zinc/56/50/94/946565094.db2.gz MMPPROSSQXMNTR-UHFFFAOYSA-N 0 0 352.293 3.766 20 5 FHBDRN CN(c1ccccc1NC(=O)COc1ccc([N+](=O)[O-])cc1)C1CCCC1 ZINC000475181151 946569750 /nfs/dbraw/zinc/56/97/50/946569750.db2.gz BGNJWHZQOJTYEU-UHFFFAOYSA-N 0 0 369.421 3.991 20 5 FHBDRN Cc1cc(C(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)c(C)n1C(C)C ZINC000048306101 946570545 /nfs/dbraw/zinc/57/05/45/946570545.db2.gz UMTRXNDZVNLDFP-UHFFFAOYSA-N 0 0 370.453 3.556 20 5 FHBDRN CN(Cc1nc2ccccc2n1C)c1ccc([N+](=O)[O-])cc1OC(F)F ZINC000302039677 946585583 /nfs/dbraw/zinc/58/55/83/946585583.db2.gz HIWAOGZTHJEMAS-UHFFFAOYSA-N 0 0 362.336 3.719 20 5 FHBDRN C[C@H](Cc1ccccc1)C(=O)Nc1ccnn1-c1ccc([N+](=O)[O-])cc1 ZINC000112013382 946602988 /nfs/dbraw/zinc/60/29/88/946602988.db2.gz ZZDJMIADFUWZFP-CQSZACIVSA-N 0 0 350.378 3.598 20 5 FHBDRN COCC(=O)N1CCc2c1cccc2N[C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000186588142 946604952 /nfs/dbraw/zinc/60/49/52/946604952.db2.gz QLEALPZPOPBEAJ-CQSZACIVSA-N 0 0 369.421 3.612 20 5 FHBDRN CSc1cccc(C(=O)NC[C@@H](C)Oc2cccc(C)c2)c1[N+](=O)[O-] ZINC000186590996 946608485 /nfs/dbraw/zinc/60/84/85/946608485.db2.gz ZSJHBOVHDJVUKL-CYBMUJFWSA-N 0 0 360.435 3.822 20 5 FHBDRN CC[C@@H](C)Oc1cc(-c2noc(COc3cccc([N+](=O)[O-])c3)n2)ccn1 ZINC000545780445 946614267 /nfs/dbraw/zinc/61/42/67/946614267.db2.gz VPHDTRKNXLFLQS-GFCCVEGCSA-N 0 0 370.365 3.796 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])s1)N1CCCCC[C@H]1[C@@H]1CCCCC1=O ZINC000164514347 946614482 /nfs/dbraw/zinc/61/44/82/946614482.db2.gz XNCZAIMQOWWWLA-STQMWFEESA-N 0 0 350.440 3.800 20 5 FHBDRN O=[N+]([O-])c1ccc(Cc2noc([C@@H]3C[C@@H]3c3cccc(F)c3F)n2)nc1 ZINC000545781346 946615491 /nfs/dbraw/zinc/61/54/91/946615491.db2.gz QGVOJSJERWFEMV-CHWSQXEVSA-N 0 0 358.304 3.513 20 5 FHBDRN Cc1cc(CCCc2nc(Cc3ccc([N+](=O)[O-])cn3)no2)c(C)s1 ZINC000545782941 946623646 /nfs/dbraw/zinc/62/36/46/946623646.db2.gz PCWNRVHIXBWQPL-UHFFFAOYSA-N 0 0 358.423 3.817 20 5 FHBDRN Cc1ccc(C)c([C@@H]2CCCN2C(=O)COc2cccc([N+](=O)[O-])c2)c1 ZINC000475543915 946627637 /nfs/dbraw/zinc/62/76/37/946627637.db2.gz AWELDVVLKOMHHI-IBGZPJMESA-N 0 0 354.406 3.954 20 5 FHBDRN CCc1n[nH]c(C(=O)N2CCCC[C@H]2CCCc2ccccc2)c1[N+](=O)[O-] ZINC000444329559 946631831 /nfs/dbraw/zinc/63/18/31/946631831.db2.gz KUDNYZAKGKVOMM-INIZCTEOSA-N 0 0 370.453 3.898 20 5 FHBDRN COCCN(CCc1ccccc1)C(=O)Nc1cc(C)c([N+](=O)[O-])cc1C ZINC000475553325 946637003 /nfs/dbraw/zinc/63/70/03/946637003.db2.gz OIQQZCJEZSLUQB-UHFFFAOYSA-N 0 0 371.437 3.935 20 5 FHBDRN C[C@@H]1CCN2[C@@H](C1)C(=O)N[C@@H]2c1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000186600881 946643631 /nfs/dbraw/zinc/64/36/31/946643631.db2.gz ITDLSZWOAUCRKD-WHCBVINPSA-N 0 0 357.435 3.552 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1-c1nc(-c2ccnc(OCC(F)F)c2)no1 ZINC000545841362 946654524 /nfs/dbraw/zinc/65/45/24/946654524.db2.gz ONBVCIBUBCYIQC-UHFFFAOYSA-N 0 0 362.292 3.659 20 5 FHBDRN CCC(O)(CC)CNC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 ZINC000440224231 946657870 /nfs/dbraw/zinc/65/78/70/946657870.db2.gz FRSNPSFNWJJTBL-UHFFFAOYSA-N 0 0 358.394 3.668 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)Nc1cncc2ccccc21 ZINC000536266468 946662817 /nfs/dbraw/zinc/66/28/17/946662817.db2.gz BCZLROFGOHQTCC-UHFFFAOYSA-N 0 0 350.378 3.974 20 5 FHBDRN CCOc1ccc([C@H](C)NC(=O)NCc2cccc([N+](=O)[O-])c2)cc1OC ZINC000067536388 946673060 /nfs/dbraw/zinc/67/30/60/946673060.db2.gz XXAUGWRITPYMHB-ZDUSSCGKSA-N 0 0 373.409 3.563 20 5 FHBDRN CN(Cc1c(F)cccc1Cl)C(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000067536826 946674315 /nfs/dbraw/zinc/67/43/15/946674315.db2.gz LKOBKPCLLKPJJP-UHFFFAOYSA-N 0 0 351.765 3.729 20 5 FHBDRN CC[C@H](Nc1nc(C)cc(C(=O)OC)c1[N+](=O)[O-])c1ccc(OC)cc1 ZINC000550345933 946701612 /nfs/dbraw/zinc/70/16/12/946701612.db2.gz NYLUUFUBTPUVJM-HNNXBMFYSA-N 0 0 359.382 3.657 20 5 FHBDRN O=C(Nc1cccc(OC(F)F)c1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088360106 946707814 /nfs/dbraw/zinc/70/78/14/946707814.db2.gz KEQCKAQQBIKRAB-UHFFFAOYSA-N 0 0 363.320 3.786 20 5 FHBDRN COc1cc(CCNC(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)ccc1C ZINC000475572689 946715281 /nfs/dbraw/zinc/71/52/81/946715281.db2.gz JLQSGMJXLLNFKA-UHFFFAOYSA-N 0 0 357.410 3.893 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)c1cccnc1SC(F)(F)F ZINC000067539190 946723667 /nfs/dbraw/zinc/72/36/67/946723667.db2.gz KMVDFDSWJMVDQX-UHFFFAOYSA-N 0 0 373.312 3.863 20 5 FHBDRN CC[C@H]1c2ccccc2CCN1C(=O)c1cc(OC)c(F)cc1[N+](=O)[O-] ZINC001126149550 946724784 /nfs/dbraw/zinc/72/47/84/946724784.db2.gz MAMVTKDLIFHPGE-INIZCTEOSA-N 0 0 358.369 3.892 20 5 FHBDRN CC(C)CCSc1ccc(C(=O)N2CC[C@H](O)[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000186631261 946746932 /nfs/dbraw/zinc/74/69/32/946746932.db2.gz ROWUYMLVKWRICX-BBRMVZONSA-N 0 0 366.483 3.576 20 5 FHBDRN CSc1cccc(C(=O)N2C[C@H](C)OC[C@@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000186630996 946747005 /nfs/dbraw/zinc/74/70/05/946747005.db2.gz MXSXHENDEYGJQQ-XJKSGUPXSA-N 0 0 372.446 3.919 20 5 FHBDRN CN(C(=O)c1cc(Cl)cc([N+](=O)[O-])c1)[C@@H]1CCCN(c2ccccc2)C1 ZINC000121450389 946748498 /nfs/dbraw/zinc/74/84/98/946748498.db2.gz XGLPVGXZYOIEJE-QGZVFWFLSA-N 0 0 373.840 3.989 20 5 FHBDRN O=c1c([N+](=O)[O-])cc(Br)cn1CCCCc1ccccc1 ZINC000186632580 946748646 /nfs/dbraw/zinc/74/86/46/946748646.db2.gz OQZGXLDRSIIBKK-UHFFFAOYSA-N 0 0 351.200 3.542 20 5 FHBDRN CC(C)(C)OC(=O)C1(NCc2ccc([N+](=O)[O-])cc2Cl)CCCC1 ZINC001167783962 946749178 /nfs/dbraw/zinc/74/91/78/946749178.db2.gz BALJKNZGMMDPGM-UHFFFAOYSA-N 0 0 354.834 3.992 20 5 FHBDRN CCOc1ccc([C@H](C)NC(=O)c2ccc(OCC)c([N+](=O)[O-])c2)cc1 ZINC000025877693 946756690 /nfs/dbraw/zinc/75/66/90/946756690.db2.gz AKLSLCBFRNSGPH-ZDUSSCGKSA-N 0 0 358.394 3.883 20 5 FHBDRN COC(=O)c1ccc(-c2noc(-c3cc(Cl)cc([N+](=O)[O-])c3)n2)cc1 ZINC000523107008 946767199 /nfs/dbraw/zinc/76/71/99/946767199.db2.gz AONJOQQBBBTZOW-UHFFFAOYSA-N 0 0 359.725 3.752 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1CN1CCSC[C@@H]1c1nccs1 ZINC000186638666 946768361 /nfs/dbraw/zinc/76/83/61/946768361.db2.gz OENDEWJRPZWCQT-CQSZACIVSA-N 0 0 365.480 3.740 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H](c2ccccc2)C(C)(C)CO)c1C ZINC000897145568 946773115 /nfs/dbraw/zinc/77/31/15/946773115.db2.gz IDGLLQUHDWFFQY-KRWDZBQOSA-N 0 0 370.449 3.744 20 5 FHBDRN O=C(c1cccc(Br)c1F)N1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001126611657 946783648 /nfs/dbraw/zinc/78/36/48/946783648.db2.gz LGEKJFVSKVQGAI-UHFFFAOYSA-N 0 0 365.158 3.652 20 5 FHBDRN CC(C)(C)OC(=O)c1ccsc1NC(=O)Cc1ccccc1[N+](=O)[O-] ZINC000184454523 946786410 /nfs/dbraw/zinc/78/64/10/946786410.db2.gz UQVNLWIXJNOELL-UHFFFAOYSA-N 0 0 362.407 3.793 20 5 FHBDRN COc1cccc([C@H]2C[C@@H](C)CN2C(=O)COc2ccccc2[N+](=O)[O-])c1 ZINC000544322457 946815323 /nfs/dbraw/zinc/81/53/23/946815323.db2.gz LZZQTBTWSOTEJJ-RDTXWAMCSA-N 0 0 370.405 3.592 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)c2cccc(OC(C)C)c2)c1 ZINC000067548833 946821398 /nfs/dbraw/zinc/82/13/98/946821398.db2.gz ZLZFTABHMGCDGP-CYBMUJFWSA-N 0 0 358.394 3.882 20 5 FHBDRN O=C(CSc1ccc(F)c(F)c1)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186310047 946841916 /nfs/dbraw/zinc/84/19/16/946841916.db2.gz KIKZQAWXSFUKDJ-UHFFFAOYSA-N 0 0 372.780 3.935 20 5 FHBDRN CCOC(=O)[C@@H](Cc1ccccc1)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000475598144 946845386 /nfs/dbraw/zinc/84/53/86/946845386.db2.gz ZMPDCAWIAMDFKE-QGZVFWFLSA-N 0 0 362.813 3.512 20 5 FHBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CCCC[C@@H](C)C1 ZINC000560112760 946869554 /nfs/dbraw/zinc/86/95/54/946869554.db2.gz XYHNBMRIGFLNKW-SNVBAGLBSA-N 0 0 355.232 3.928 20 5 FHBDRN O=C(COc1ccc(F)cc1Cl)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186314386 946869736 /nfs/dbraw/zinc/86/97/36/946869736.db2.gz AQKOKEGYUIBGJX-UHFFFAOYSA-N 0 0 373.167 3.736 20 5 FHBDRN Cc1c(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)cnn1-c1ccccc1 ZINC000186318855 946880924 /nfs/dbraw/zinc/88/09/24/946880924.db2.gz ZAWRCUFETILDJT-UHFFFAOYSA-N 0 0 370.796 3.672 20 5 FHBDRN Cc1c(F)ccc([N+](=O)[O-])c1C(=O)Nc1ccc(OC[C@@H]2CCCO2)cc1 ZINC000843769485 946885368 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ZINC000445182091 947575511 /nfs/dbraw/zinc/57/55/11/947575511.db2.gz DOSKJEQURAUGAC-KRWDZBQOSA-N 0 0 353.403 3.947 20 5 FHBDRN C[C@H](OC(=O)Cc1ccccc1[N+](=O)[O-])c1nnc(-c2cccs2)o1 ZINC000104924199 947581385 /nfs/dbraw/zinc/58/13/85/947581385.db2.gz LMHLUJUFBHRHFA-JTQLQIEISA-N 0 0 359.363 3.553 20 5 FHBDRN CC(C)Sc1ccc([C@@H](C)NC(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)cc1 ZINC000445193280 947591697 /nfs/dbraw/zinc/59/16/97/947591697.db2.gz XEOFGQSAJMWOSM-LLVKDONJSA-N 0 0 361.423 3.687 20 5 FHBDRN Nc1ccc(-c2noc([C@H]3SCCc4ccccc43)n2)cc1[N+](=O)[O-] ZINC000445213591 947591874 /nfs/dbraw/zinc/59/18/74/947591874.db2.gz WTGOEYJZXIMXLV-HNNXBMFYSA-N 0 0 354.391 3.606 20 5 FHBDRN O=C(O[C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)[C@H]1Cc2ccccc2S1 ZINC000759934081 947601826 /nfs/dbraw/zinc/60/18/26/947601826.db2.gz UUNZVQGWTUXYAY-SQWLQELKSA-N 0 0 373.434 3.535 20 5 FHBDRN O=C(NCc1ccc(F)c(Cl)c1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000087083776 947602094 /nfs/dbraw/zinc/60/20/94/947602094.db2.gz 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FHBDRN CCN(C(=O)CCn1nc(C)c([N+](=O)[O-])c1C)c1cccc(Cl)c1 ZINC000523945318 947751905 /nfs/dbraw/zinc/75/19/05/947751905.db2.gz IBXHALLLIBPZFL-UHFFFAOYSA-N 0 0 350.806 3.505 20 5 FHBDRN CCCN(C(=O)C(=O)c1ccc(Cl)s1)c1cccc([N+](=O)[O-])c1 ZINC000441470608 947771863 /nfs/dbraw/zinc/77/18/63/947771863.db2.gz XQCAFVULYKDKQX-UHFFFAOYSA-N 0 0 352.799 3.936 20 5 FHBDRN O=C(CCC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1)c1ccc(F)cc1 ZINC000152317319 947786174 /nfs/dbraw/zinc/78/61/74/947786174.db2.gz LMWXWOVNWBBUMC-UHFFFAOYSA-N 0 0 370.380 3.888 20 5 FHBDRN Cc1ccccc1CCC(=O)O[C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000759940095 947790245 /nfs/dbraw/zinc/79/02/45/947790245.db2.gz NWTSYPLIHFYJAY-IAGOWNOFSA-N 0 0 357.410 3.759 20 5 FHBDRN C/C(=C/c1ccccn1)C(=O)N1CCS[C@@H]1c1ccc([N+](=O)[O-])cc1 ZINC001126234353 947793698 /nfs/dbraw/zinc/79/36/98/947793698.db2.gz LUHOKQNOKIOYNY-MENFKHAKSA-N 0 0 355.419 3.667 20 5 FHBDRN Cc1ccc(NC(=O)[C@H](C)OC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)cc1F ZINC000728867466 947824290 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Cc1cc(CNCc2ccc(N(C)c3ccccc3)c([N+](=O)[O-])c2)on1 ZINC000105455561 948037468 /nfs/dbraw/zinc/03/74/68/948037468.db2.gz BFERJPJLACTDPL-UHFFFAOYSA-N 0 0 352.394 3.949 20 5 FHBDRN COc1cc(CN(C)C(=O)C(C)(C)c2ccccc2[N+](=O)[O-])cc(OC)c1 ZINC000429803493 948041140 /nfs/dbraw/zinc/04/11/40/948041140.db2.gz ANXYTRXKYIAJIM-UHFFFAOYSA-N 0 0 372.421 3.548 20 5 FHBDRN O=[N+]([O-])c1cccc2c(NCc3ccccc3N3CCOCC3)ccnc21 ZINC000432323942 948063048 /nfs/dbraw/zinc/06/30/48/948063048.db2.gz FMLVDHHSLNOPAB-UHFFFAOYSA-N 0 0 364.405 3.592 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])c1ccccc1OCc1cscn1 ZINC000125882255 948067780 /nfs/dbraw/zinc/06/77/80/948067780.db2.gz DNSORTAVAUGTRI-UHFFFAOYSA-N 0 0 369.402 3.560 20 5 FHBDRN CCOc1cccc(C(=O)O[C@@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)c1 ZINC000759945475 948071514 /nfs/dbraw/zinc/07/15/14/948071514.db2.gz GOSOXCCPSCJKBE-HZPDHXFCSA-N 0 0 359.382 3.531 20 5 FHBDRN CC(C)CCC[C@@H](C)NC(=O)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000520491120 948075885 /nfs/dbraw/zinc/07/58/85/948075885.db2.gz XQTVMYHYSAZCDO-OAHLLOKOSA-N 0 0 358.442 3.789 20 5 FHBDRN O=C(NC[C@@H]1CCCN(c2c(Cl)cccc2[N+](=O)[O-])C1)c1ccccc1 ZINC000432328173 948081745 /nfs/dbraw/zinc/08/17/45/948081745.db2.gz VLRRMNUJWRCMMH-AWEZNQCLSA-N 0 0 373.840 3.895 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(N2CCCC2)nc1 ZINC000184661060 948094531 /nfs/dbraw/zinc/09/45/31/948094531.db2.gz RMOXXTQINSVMMB-INIZCTEOSA-N 0 0 368.437 3.797 20 5 FHBDRN CC[C@@H](NC(=O)COc1ccc([N+](=O)[O-])c(F)c1)c1ccc(F)cc1F ZINC000125901597 948119225 /nfs/dbraw/zinc/11/92/25/948119225.db2.gz ZRTYXFJRJNEFKZ-OAHLLOKOSA-N 0 0 368.311 3.658 20 5 FHBDRN CCn1nccc1C1CCN(C(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)CC1 ZINC000278921310 948121568 /nfs/dbraw/zinc/12/15/68/948121568.db2.gz WPOGJHYEIWILCA-UHFFFAOYSA-N 0 0 371.441 3.840 20 5 FHBDRN Cc1c(N[C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])cnn1CCC(C)C ZINC000126819322 948124228 /nfs/dbraw/zinc/12/42/28/948124228.db2.gz JDOFNSZZHYWHOE-ZDUSSCGKSA-N 0 0 359.430 3.585 20 5 FHBDRN O=[N+]([O-])c1cccc2c(NCc3ccc(Cn4ccnc4)cc3)ccnc21 ZINC000432337722 948151574 /nfs/dbraw/zinc/15/15/74/948151574.db2.gz UNJKDSIMXBSPKS-UHFFFAOYSA-N 0 0 359.389 4.000 20 5 FHBDRN COc1ccc(CNc2cc(N(C)c3ccccc3)ncn2)cc1[N+](=O)[O-] ZINC000432340786 948158812 /nfs/dbraw/zinc/15/88/12/948158812.db2.gz PHHPJFLBTTXHAF-UHFFFAOYSA-N 0 0 365.393 3.773 20 5 FHBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)NCc1cccc(F)c1 ZINC000585696825 948164490 /nfs/dbraw/zinc/16/44/90/948164490.db2.gz MYRHXBWGMWBDOD-UHFFFAOYSA-N 0 0 367.174 3.735 20 5 FHBDRN O=C(NCCNc1ccc([N+](=O)[O-])cc1)N[C@@H]1CCCc2ccc(F)cc21 ZINC000473991653 948169303 /nfs/dbraw/zinc/16/93/03/948169303.db2.gz NBYRLPFYXHEJOQ-GOSISDBHSA-N 0 0 372.400 3.523 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1cc(-c2ccccc2)ns1 ZINC000427591061 948203411 /nfs/dbraw/zinc/20/34/11/948203411.db2.gz GXAUHGALQFZKJT-UHFFFAOYSA-N 0 0 355.375 3.979 20 5 FHBDRN COc1ccc(CNC(=O)N2CCC[C@]3(CC=CCC3)C2)cc1[N+](=O)[O-] ZINC000512020968 948206529 /nfs/dbraw/zinc/20/65/29/948206529.db2.gz VICNNXGXRYGUPY-LJQANCHMSA-N 0 0 359.426 3.635 20 5 FHBDRN Cc1n[nH]c(C(=O)N(Cc2ccccc2)Cc2ccccc2F)c1[N+](=O)[O-] ZINC000520509372 948206631 /nfs/dbraw/zinc/20/66/31/948206631.db2.gz HINCQGITKNJTMR-UHFFFAOYSA-N 0 0 368.368 3.608 20 5 FHBDRN COC(=O)[C@H](CC(C)C)Nc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000520517993 948209289 /nfs/dbraw/zinc/20/92/89/948209289.db2.gz CTIKOJFTGHTIOC-KRWDZBQOSA-N 0 0 370.405 3.825 20 5 FHBDRN COC(=O)c1cc(C)nc(N[C@@H]2CCC[C@H](C(F)(F)F)C2)c1[N+](=O)[O-] ZINC000585702612 948209312 /nfs/dbraw/zinc/20/93/12/948209312.db2.gz SPBYYFBIKVDZAL-VHSXEESVSA-N 0 0 361.320 3.618 20 5 FHBDRN COC(=O)c1cc(NC(=O)c2cc3c(o2)c(F)ccc3C)cc([N+](=O)[O-])c1 ZINC001126300583 948214316 /nfs/dbraw/zinc/21/43/16/948214316.db2.gz PULKDIKVHXBGOR-UHFFFAOYSA-N 0 0 372.308 3.827 20 5 FHBDRN COc1ccc(CSCC(=O)Nc2c(F)cccc2F)cc1[N+](=O)[O-] ZINC000046120763 948226691 /nfs/dbraw/zinc/22/66/91/948226691.db2.gz HFMOAIAIVGNZSI-UHFFFAOYSA-N 0 0 368.361 3.754 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)NC[C@@H]1CCC[C@H](C)[C@@H]1C ZINC001211697621 948233764 /nfs/dbraw/zinc/23/37/64/948233764.db2.gz VVGQIJUWPGMWDD-CQDKDKBSSA-N 0 0 354.472 3.562 20 5 FHBDRN COc1ccc(Cc2nc(-c3cccc4ncccc43)no2)cc1[N+](=O)[O-] ZINC000585731566 948241949 /nfs/dbraw/zinc/24/19/49/948241949.db2.gz QOWTYAALCLOTDL-UHFFFAOYSA-N 0 0 362.345 3.792 20 5 FHBDRN CCC(C)(C)[C@@H]1CCCN1C(=O)COc1ccc([N+](=O)[O-])c2cccnc12 ZINC000441547297 948245032 /nfs/dbraw/zinc/24/50/32/948245032.db2.gz POGQLXIUVZBGKM-KRWDZBQOSA-N 0 0 371.437 3.949 20 5 FHBDRN Cc1nn(Cc2ccc(C(=O)OC[C@@H]3CC=CCC3)cc2)c(C)c1[N+](=O)[O-] ZINC000060943856 948270450 /nfs/dbraw/zinc/27/04/50/948270450.db2.gz ZXENSQKEDWRFQG-QGZVFWFLSA-N 0 0 369.421 3.970 20 5 FHBDRN O=C(O[C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1)c1cnc2ccsc2c1 ZINC000759956345 948282114 /nfs/dbraw/zinc/28/21/14/948282114.db2.gz YDRVCJOFYBUKIF-ZIAGYGMSSA-N 0 0 372.406 3.742 20 5 FHBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])N1CC2(CCC2)[C@H]1C1CC1 ZINC000427597731 948300267 /nfs/dbraw/zinc/30/02/67/948300267.db2.gz XSHBUVIKGRFJHB-QGZVFWFLSA-N 0 0 364.829 3.808 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H]1C[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000184726681 948300311 /nfs/dbraw/zinc/30/03/11/948300311.db2.gz NWFJTLYVNHWPLV-MNOVXSKESA-N 0 0 366.295 3.763 20 5 FHBDRN CNC(=O)c1ccc(NCCc2cc(Cl)cc(Cl)c2)c([N+](=O)[O-])c1 ZINC000520565787 948305566 /nfs/dbraw/zinc/30/55/66/948305566.db2.gz HDVHQWXYQYMPAN-UHFFFAOYSA-N 0 0 368.220 3.916 20 5 FHBDRN Clc1nc2ccc3ccccc3c2nc1NCCN1CCSCC1 ZINC001167837285 948310628 /nfs/dbraw/zinc/31/06/28/948310628.db2.gz JAGBHBMOSCJCGM-UHFFFAOYSA-N 0 0 358.898 3.897 20 5 FHBDRN COc1cccc(C(C)(C)CNC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)c1 ZINC000441590200 948317471 /nfs/dbraw/zinc/31/74/71/948317471.db2.gz NIGOKPZASKNVLB-UHFFFAOYSA-N 0 0 367.405 3.792 20 5 FHBDRN CCC(C)(C)[C@@H]1CCCN1C(=O)c1cc(OC)c(OC)c([N+](=O)[O-])c1 ZINC000441587954 948320947 /nfs/dbraw/zinc/32/09/47/948320947.db2.gz RGVGWBDREJZTOY-HNNXBMFYSA-N 0 0 350.415 3.653 20 5 FHBDRN CCc1c(NC(=O)COc2ccc([N+](=O)[O-])c(C)c2)cnn1CCC(C)C ZINC000432397871 948330561 /nfs/dbraw/zinc/33/05/61/948330561.db2.gz HANVJFRXXKHADQ-UHFFFAOYSA-N 0 0 374.441 3.726 20 5 FHBDRN CC(C)(C)c1ccc(NC(=O)N(C[C@H]2CCOC2)C2CC2)cc1[N+](=O)[O-] ZINC000585807986 948334727 /nfs/dbraw/zinc/33/47/27/948334727.db2.gz RHGGNIFNCOKMRO-CYBMUJFWSA-N 0 0 361.442 3.925 20 5 FHBDRN O=C(CCCn1cccc1)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000427599848 948336208 /nfs/dbraw/zinc/33/62/08/948336208.db2.gz COCNTGMTLIYSBQ-UHFFFAOYSA-N 0 0 355.316 3.512 20 5 FHBDRN COc1ccc2c(c1)CN(Cc1cc([N+](=O)[O-])ccc1OC(F)F)CC2 ZINC000512068289 948347462 /nfs/dbraw/zinc/34/74/62/948347462.db2.gz QSDHDUXNMXPIDM-UHFFFAOYSA-N 0 0 364.348 3.763 20 5 FHBDRN Cc1nn(C(C)C)c(C)c1Cc1nc(-c2ccc([N+](=O)[O-])cc2C)no1 ZINC000574701042 948355717 /nfs/dbraw/zinc/35/57/17/948355717.db2.gz WLVNEBBHVDEFJG-UHFFFAOYSA-N 0 0 355.398 3.938 20 5 FHBDRN Cc1cc(C(=O)Nc2ccc(Br)cc2O)ccc1[N+](=O)[O-] ZINC000075472722 948371925 /nfs/dbraw/zinc/37/19/25/948371925.db2.gz LLCXAABXUNTTQL-UHFFFAOYSA-N 0 0 351.156 3.624 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](C)c2nc(C(F)(F)F)cs2)c1 ZINC000278991648 948378714 /nfs/dbraw/zinc/37/87/14/948378714.db2.gz RZUIVYKWJQBBNB-QMMMGPOBSA-N 0 0 359.329 3.870 20 5 FHBDRN Cc1nn(CC(=O)c2ccc(OCc3ccccc3)cc2)c(C)c1[N+](=O)[O-] ZINC000107075972 948392361 /nfs/dbraw/zinc/39/23/61/948392361.db2.gz KPWMEIBUOBLOHN-UHFFFAOYSA-N 0 0 365.389 3.870 20 5 FHBDRN CC(C)c1nc(CCNC(=O)Nc2ccc([N+](=O)[O-])cc2F)cs1 ZINC000544675361 948394383 /nfs/dbraw/zinc/39/43/83/948394383.db2.gz JMKCQYJJPXXQMJ-UHFFFAOYSA-N 0 0 352.391 3.678 20 5 FHBDRN COc1ccc(NC(=O)N[C@@H]2CCCc3ccc(F)cc32)cc1[N+](=O)[O-] ZINC000432429885 948397095 /nfs/dbraw/zinc/39/70/95/948397095.db2.gz IQTXTKKIGVJXHF-OAHLLOKOSA-N 0 0 359.357 3.942 20 5 FHBDRN Cc1cc(C(=O)N[C@@H](C)c2ccc(OC(C)C)cc2)c(N)c([N+](=O)[O-])c1 ZINC000729518126 948406058 /nfs/dbraw/zinc/40/60/58/948406058.db2.gz FCPXEDMUJBXDTE-ZDUSSCGKSA-N 0 0 357.410 3.764 20 5 FHBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCOC[C@@H]1C ZINC000432431764 948406502 /nfs/dbraw/zinc/40/65/02/948406502.db2.gz PQAOCVZBYGWTSP-SWLSCSKDSA-N 0 0 352.456 3.642 20 5 FHBDRN CC(C)[C@H](CC(F)(F)F)NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000438605933 948412702 /nfs/dbraw/zinc/41/27/02/948412702.db2.gz HHHCEBHUCHKSOC-LBPRGKRZSA-N 0 0 352.740 3.884 20 5 FHBDRN Cc1cc(N2CC[C@@H](C)[C@H](n3ccnc3)C2)c2cccc([N+](=O)[O-])c2n1 ZINC000302004849 948416320 /nfs/dbraw/zinc/41/63/20/948416320.db2.gz KPQPTYCMYOONCE-FZKQIMNGSA-N 0 0 351.410 3.735 20 5 FHBDRN O=[N+]([O-])c1cccc(F)c1OC[C@H](O)Cc1ccccc1C(F)(F)F ZINC000184778183 948418032 /nfs/dbraw/zinc/41/80/32/948418032.db2.gz HPEKPWKZDCIROV-LLVKDONJSA-N 0 0 359.275 3.735 20 5 FHBDRN CC(C)[C@H](CC(F)(F)F)NC(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000438611715 948429831 /nfs/dbraw/zinc/42/98/31/948429831.db2.gz OWPJFGJNOPFGIL-AWEZNQCLSA-N 0 0 361.364 3.880 20 5 FHBDRN COc1ccc2ccccc2c1CNC(=O)c1cc(C)cc([N+](=O)[O-])c1N ZINC000729518840 948430280 /nfs/dbraw/zinc/43/02/80/948430280.db2.gz UYZLFSQCKZRHNX-UHFFFAOYSA-N 0 0 365.389 3.577 20 5 FHBDRN COc1ccc(C2=N/C(=C/c3ccccc3Cl)C(=O)O2)cc1[N+](=O)[O-] ZINC000006441757 948455833 /nfs/dbraw/zinc/45/58/33/948455833.db2.gz KQOIPPKXCGYBSB-MDWZMJQESA-N 0 0 358.737 3.601 20 5 FHBDRN Cc1cc(C(=O)N[C@@H](C)c2cccc(OC(C)C)c2)c(N)c([N+](=O)[O-])c1 ZINC000729520201 948456538 /nfs/dbraw/zinc/45/65/38/948456538.db2.gz GZHGUVVHLDWVHY-ZDUSSCGKSA-N 0 0 357.410 3.764 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1cc(F)c(F)c(F)c1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000184786752 948483110 /nfs/dbraw/zinc/48/31/10/948483110.db2.gz FWOCKNUCCRGLON-QWHCGFSZSA-N 0 0 362.307 3.705 20 5 FHBDRN COc1cccc([C@@H](O)CNc2ccc([N+](=O)[O-])c(-c3ccccc3)n2)c1 ZINC000090092385 948504249 /nfs/dbraw/zinc/50/42/49/948504249.db2.gz HMVOBFFWIMWFNB-SFHVURJKSA-N 0 0 365.389 3.811 20 5 FHBDRN COc1cccc(C(C)(C)CNC(=O)Nc2cc([N+](=O)[O-])ccc2OC)c1 ZINC000441674999 948510131 /nfs/dbraw/zinc/51/01/31/948510131.db2.gz XVIJVERYEUZNFY-UHFFFAOYSA-N 0 0 373.409 3.711 20 5 FHBDRN Cc1ccc(NC(=O)N(C)[C@@H](c2ncc[nH]2)c2ccccc2)cc1[N+](=O)[O-] ZINC000432474789 948528516 /nfs/dbraw/zinc/52/85/16/948528516.db2.gz FCYRJAIGVWKUGM-QGZVFWFLSA-N 0 0 365.393 3.880 20 5 FHBDRN O=c1c2cc([N+](=O)[O-])ccc2ncn1CCc1cccc(Cl)c1Cl ZINC000432476152 948543139 /nfs/dbraw/zinc/54/31/39/948543139.db2.gz HVKBEOHFJGYDMT-UHFFFAOYSA-N 0 0 364.188 3.854 20 5 FHBDRN COC(=O)[C@@H](NCc1ccc([N+](=O)[O-])cc1)c1ccc2ccccc2c1 ZINC000125993344 948548922 /nfs/dbraw/zinc/54/89/22/948548922.db2.gz ARUSNPKQRBVCJD-IBGZPJMESA-N 0 0 350.374 3.752 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)OCC(=O)c1ccc2ccccc2c1 ZINC000019284621 948567427 /nfs/dbraw/zinc/56/74/27/948567427.db2.gz JONLFNHYCZTOII-UHFFFAOYSA-N 0 0 365.341 3.796 20 5 FHBDRN CCCN(CC1CC1)C(=O)c1cc([N+](=O)[O-])ccc1SCCOC ZINC000279168192 948568360 /nfs/dbraw/zinc/56/83/60/948568360.db2.gz CBXNEOQUBNQZDZ-UHFFFAOYSA-N 0 0 352.456 3.596 20 5 FHBDRN CCOc1cc2c(cc1NC(=O)c1cc([N+](=O)[O-])c(C)s1)O[C@@H](C)C2 ZINC000520681218 948575274 /nfs/dbraw/zinc/57/52/74/948575274.db2.gz LYQQUBVGJWPSCJ-VIFPVBQESA-N 0 0 362.407 3.939 20 5 FHBDRN CCc1ccc(-c2nc(-c3ccc(NC(C)=O)cc3)no2)cc1[N+](=O)[O-] ZINC000546331361 948575314 /nfs/dbraw/zinc/57/53/14/948575314.db2.gz MJBPXGYIVVXFHQ-UHFFFAOYSA-N 0 0 352.350 3.833 20 5 FHBDRN COc1ccc(C(C)(C)CNC(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1OC ZINC000520684540 948579406 /nfs/dbraw/zinc/57/94/06/948579406.db2.gz SNIANTRDRPPKFW-UHFFFAOYSA-N 0 0 372.421 3.628 20 5 FHBDRN Cc1cc(N2CCSCC2)ccc1NC(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000050495364 948587635 /nfs/dbraw/zinc/58/76/35/948587635.db2.gz FCKNCBXMIALTSP-UHFFFAOYSA-N 0 0 371.462 3.638 20 5 FHBDRN CCn1ccnc1[C@@H]1CCCCN1c1ccc([N+](=O)[O-])c(OC(C)C)n1 ZINC000584730152 948590745 /nfs/dbraw/zinc/59/07/45/948590745.db2.gz KSWCQHKKAFGCPV-AWEZNQCLSA-N 0 0 359.430 3.725 20 5 FHBDRN CC(C)(C)NC(=O)c1cccc(NC(=O)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000087136344 948593737 /nfs/dbraw/zinc/59/37/37/948593737.db2.gz CSLDLGWFMCHGKE-UHFFFAOYSA-N 0 0 369.421 3.694 20 5 FHBDRN CC(C)COC1CCN(Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)CC1 ZINC000728898748 948633258 /nfs/dbraw/zinc/63/32/58/948633258.db2.gz KGNACNICIHNFIT-UHFFFAOYSA-N 0 0 358.442 3.553 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)N[C@H]1C[C@H](c2ccc(F)cc2)C1 ZINC000432504174 948641257 /nfs/dbraw/zinc/64/12/57/948641257.db2.gz GZEVGNXGBPMLRT-JCNLHEQBSA-N 0 0 357.385 3.822 20 5 FHBDRN C[C@@H]1CCCN(c2ccc(C(=O)Nc3cccnc3F)cc2[N+](=O)[O-])C1 ZINC000843691749 948645347 /nfs/dbraw/zinc/64/53/47/948645347.db2.gz MJBYSMSVWVQKIH-GFCCVEGCSA-N 0 0 358.373 3.618 20 5 FHBDRN Cc1cc(C)cc([C@H](C)NS(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])c1 ZINC000500449839 948659374 /nfs/dbraw/zinc/65/93/74/948659374.db2.gz CLNLDTIXPZXIQW-LBPRGKRZSA-N 0 0 368.842 3.905 20 5 FHBDRN O=C(NCCc1c[nH]c2cc(F)ccc12)c1ccc([N+](=O)[O-])cc1Cl ZINC000050766851 948696923 /nfs/dbraw/zinc/69/69/23/948696923.db2.gz XCAMKYHRRPNGSZ-UHFFFAOYSA-N 0 0 361.760 3.841 20 5 FHBDRN Cc1cccnc1N(C)C(=O)c1cc([N+](=O)[O-])ccc1N1CCC(C)CC1 ZINC000279299780 948722785 /nfs/dbraw/zinc/72/27/85/948722785.db2.gz BRPFPWWSSQNKLE-UHFFFAOYSA-N 0 0 368.437 3.811 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N[C@]1(CO)CCCc2ccccc21 ZINC000441754816 948732263 /nfs/dbraw/zinc/73/22/63/948732263.db2.gz BJAJWMRHLQIKAD-FQEVSTJZSA-N 0 0 369.421 3.557 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc(OC(F)F)c(F)c1 ZINC000087143310 948746964 /nfs/dbraw/zinc/74/69/64/948746964.db2.gz VDIBLQYQTDVKOY-UHFFFAOYSA-N 0 0 354.284 3.907 20 5 FHBDRN CCOc1ccc(C(=O)Nc2ccc(-c3ccccc3)nn2)cc1[N+](=O)[O-] ZINC000150872578 948748482 /nfs/dbraw/zinc/74/84/82/948748482.db2.gz SDABUNCESMKERQ-UHFFFAOYSA-N 0 0 364.361 3.703 20 5 FHBDRN CCOc1cc(-c2noc(-c3ccc(CC)c([N+](=O)[O-])c3)n2)ccc1O ZINC000445428990 948793065 /nfs/dbraw/zinc/79/30/65/948793065.db2.gz AMOWUGZQBPBGAL-UHFFFAOYSA-N 0 0 355.350 3.979 20 5 FHBDRN COc1ccc(CN(C)Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)cc1C ZINC000728900183 948806089 /nfs/dbraw/zinc/80/60/89/948806089.db2.gz GGGPSOBESBVHRG-UHFFFAOYSA-N 0 0 366.421 3.865 20 5 FHBDRN Cc1cc(C)cc(N(C)S(=O)(=O)c2ccc([N+](=O)[O-])c3cccnc32)c1 ZINC000184817036 948817495 /nfs/dbraw/zinc/81/74/95/948817495.db2.gz XEDKZXXONICZRZ-UHFFFAOYSA-N 0 0 371.418 3.585 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)c1ncoc1-c1ccc(F)cc1 ZINC000184818907 948819438 /nfs/dbraw/zinc/81/94/38/948819438.db2.gz PJRHPAAZPCEYNW-UHFFFAOYSA-N 0 0 357.297 3.650 20 5 FHBDRN CCOC(=O)c1cc(C(=O)N2[C@H](C)C[C@@H]3CCCC[C@@H]32)cc([N+](=O)[O-])c1 ZINC000078794613 210221026 /nfs/dbraw/zinc/22/10/26/210221026.db2.gz RPYLVUBBWYNCDO-IGCXYCKISA-N 0 0 360.410 3.565 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CC[C@H](O)c3ccccc3C2)cc1OC(F)F ZINC000359898960 210195388 /nfs/dbraw/zinc/19/53/88/210195388.db2.gz LYBMZYHNHUWYNV-HNNXBMFYSA-N 0 0 350.321 3.640 20 5 FHBDRN COc1cc(C(=O)Nc2cccc([N+](=O)[O-])c2C)ccc1OC(F)F ZINC000008267712 210097490 /nfs/dbraw/zinc/09/74/90/210097490.db2.gz ABIYWQYBVNMQGK-UHFFFAOYSA-N 0 0 352.293 3.766 20 5 FHBDRN CC(=O)Nc1ccc(NC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)cc1 ZINC000007399557 210094211 /nfs/dbraw/zinc/09/42/11/210094211.db2.gz MXNRDDANSNXJHF-NSHDSACASA-N 0 0 359.407 3.673 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CSc1nc2cc(C)ccc2[nH]1 ZINC000005357820 210083944 /nfs/dbraw/zinc/08/39/44/210083944.db2.gz DJFHFDXQRZNZBD-UHFFFAOYSA-N 0 0 372.406 3.519 20 5 FHBDRN COc1ccc(Cl)cc1NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1C ZINC000005921484 210083619 /nfs/dbraw/zinc/08/36/19/210083619.db2.gz QMDMNHYSZULVDQ-UHFFFAOYSA-N 0 0 365.729 3.726 20 5 FHBDRN COc1ccc(NC(=O)CNc2ccc(C(F)(F)F)cc2)c([N+](=O)[O-])c1 ZINC000004904204 210080416 /nfs/dbraw/zinc/08/04/16/210080416.db2.gz ZBNJIZWSSWFUCR-UHFFFAOYSA-N 0 0 369.299 3.673 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)NC(c1ccccc1)c1ccccc1 ZINC000003515336 210078440 /nfs/dbraw/zinc/07/84/40/210078440.db2.gz ZEDIPMCGDKSUPH-UHFFFAOYSA-N 0 0 362.385 3.879 20 5 FHBDRN CS(=O)(=O)c1cccc(Oc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 ZINC000052332795 210061558 /nfs/dbraw/zinc/06/15/58/210061558.db2.gz HIGAYBJRFILLCI-UHFFFAOYSA-N 0 0 361.297 3.809 20 5 FHBDRN O=C(COc1ccc(Br)cc1F)Nc1ccc([N+](=O)[O-])cc1 ZINC000007200748 219794608 /nfs/dbraw/zinc/79/46/08/219794608.db2.gz BCTFPTSFXOBADH-UHFFFAOYSA-N 0 0 369.146 3.514 20 5 FHBDRN Cc1ccc(NC(=O)c2cccc(NC(=O)[C@@H]3C[C@H]3C)c2)cc1[N+](=O)[O-] ZINC000032644198 211554937 /nfs/dbraw/zinc/55/49/37/211554937.db2.gz JWYLLRMZDNRWKL-MLGOLLRUSA-N 0 0 353.378 3.750 20 5 FHBDRN NC(=O)c1ccc(CSc2nc3cc(Cl)ccc3[nH]2)c([N+](=O)[O-])c1 ZINC000016812807 211170911 /nfs/dbraw/zinc/17/09/11/211170911.db2.gz YAIHVQSONKZQTM-UHFFFAOYSA-N 0 0 362.798 3.516 20 5 FHBDRN Cc1cc(OC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)cc(C)c1Cl ZINC000006188820 210662130 /nfs/dbraw/zinc/66/21/30/210662130.db2.gz MYNVPLLKNZFIIN-UHFFFAOYSA-N 0 0 350.714 3.992 20 5 FHBDRN COc1ccc(Br)cc1NC(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000056035824 221077472 /nfs/dbraw/zinc/07/74/72/221077472.db2.gz YSKRMDXWTRJKCQ-UHFFFAOYSA-N 0 0 365.183 3.547 20 5 FHBDRN Cc1c(C(=O)Nc2cccc(Cl)c2F)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000070685137 221333785 /nfs/dbraw/zinc/33/37/85/221333785.db2.gz TWTYVPFMXHLCHO-UHFFFAOYSA-N 0 0 353.693 3.856 20 5 FHBDRN Cc1ccc2[nH]c(S[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3)nc2c1 ZINC000069878617 221328710 /nfs/dbraw/zinc/32/87/10/221328710.db2.gz YPLXDVCNAQUHNL-NSHDSACASA-N 0 0 356.407 3.899 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)Nc1ccc(F)cc1Br ZINC000071930456 221387818 /nfs/dbraw/zinc/38/78/18/221387818.db2.gz QCRKZVUHYZQSSL-UHFFFAOYSA-N 0 0 369.146 3.514 20 5 FHBDRN CCOc1ccc(NS(=O)(=O)c2cc([N+](=O)[O-])cc(C)c2C)cc1F ZINC000071977998 221393028 /nfs/dbraw/zinc/39/30/28/221393028.db2.gz JUAXCLQGTZVHCL-UHFFFAOYSA-N 0 0 368.386 3.550 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1C(F)(F)F)N1CCc2ccccc21 ZINC000072033490 221398456 /nfs/dbraw/zinc/39/84/56/221398456.db2.gz KIBNVUCXTRHMJX-UHFFFAOYSA-N 0 0 366.295 3.582 20 5 FHBDRN CCOc1ccccc1N1CCN(c2ccc(C(C)=O)cc2[N+](=O)[O-])CC1 ZINC000008147519 132373679 /nfs/dbraw/zinc/37/36/79/132373679.db2.gz DLLNNMMMCMCKRO-UHFFFAOYSA-N 0 0 369.421 3.523 20 5 FHBDRN CC(C)[C@@H](C)NC(=O)C1CCN(c2ccc([N+](=O)[O-])c3cccnc32)CC1 ZINC000109806978 132374290 /nfs/dbraw/zinc/37/42/90/132374290.db2.gz VHYPBFGYFNLAEI-CQSZACIVSA-N 0 0 370.453 3.520 20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])N(Cc1ccco1)CC(F)(F)F ZINC000105552449 222371047 /nfs/dbraw/zinc/37/10/47/222371047.db2.gz RSIQEIINAQBCCR-UHFFFAOYSA-N 0 0 371.315 3.581 20 5 FHBDRN Cc1c(C(=O)NCc2cc(Br)ccc2F)cccc1[N+](=O)[O-] ZINC000105913121 222379275 /nfs/dbraw/zinc/37/92/75/222379275.db2.gz DUCIRFWNJRDWDP-UHFFFAOYSA-N 0 0 367.174 3.735 20 5 FHBDRN Cc1ccc(C(=O)Nc2c(C)cccc2C(=O)N2CCCC2)cc1[N+](=O)[O-] ZINC000106104095 222381524 /nfs/dbraw/zinc/38/15/24/222381524.db2.gz XSHHYZHDUIDGLH-UHFFFAOYSA-N 0 0 367.405 3.700 20 5 FHBDRN C[C@@H]1CCN(C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)[C@H]2CCCC[C@H]12 ZINC000106235748 222384618 /nfs/dbraw/zinc/38/46/18/222384618.db2.gz WDNYDCXCLYHMLM-BJZITVGISA-N 0 0 368.437 3.821 20 5 FHBDRN C[C@@H]1CCN(C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)[C@@H]2CCCC[C@H]12 ZINC000106235754 222385329 /nfs/dbraw/zinc/38/53/29/222385329.db2.gz WDNYDCXCLYHMLM-LSBZLQRGSA-N 0 0 368.437 3.821 20 5 FHBDRN COCc1nc2cc(NC(=O)Nc3ccc([N+](=O)[O-])cc3F)ccc2o1 ZINC000541787247 567822290 /nfs/dbraw/zinc/82/22/90/567822290.db2.gz LXAYGGPGUNQVGG-UHFFFAOYSA-N 0 0 360.301 3.666 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])N1CCC(CCc2ccccc2)CC1 ZINC000517894722 567826498 /nfs/dbraw/zinc/82/64/98/567826498.db2.gz OMLPEFXBNFJYDI-UHFFFAOYSA-N 0 0 367.449 3.878 20 5 FHBDRN O=C([C@@H]1CC(=O)c2ccccc21)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452864354 567834106 /nfs/dbraw/zinc/83/41/06/567834106.db2.gz WDDMSWYDNUQDPU-DNVCBOLYSA-N 0 0 364.401 3.671 20 5 FHBDRN CO[C@H]1CCN(C(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000452863224 567845351 /nfs/dbraw/zinc/84/53/51/567845351.db2.gz DVWRARPUNSRONS-LIRRHRJNSA-N 0 0 369.421 3.835 20 5 FHBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CCC(C)=C(C)C1 ZINC000568082054 567862173 /nfs/dbraw/zinc/86/21/73/567862173.db2.gz QBHGTEDFCFRZGV-UHFFFAOYSA-N 0 0 353.216 3.848 20 5 FHBDRN COc1ccc(NC(=O)N2C[C@H](C)C[C@@H]2c2cccnc2)cc1[N+](=O)[O-] ZINC000541797123 567864399 /nfs/dbraw/zinc/86/43/99/567864399.db2.gz SVJMBEASKALZEC-IUODEOHRSA-N 0 0 356.382 3.613 20 5 FHBDRN O=C(c1cc(Cl)ccc1O)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452878200 567865863 /nfs/dbraw/zinc/86/58/63/567865863.db2.gz MPNYWOTVYJJCRR-CYBMUJFWSA-N 0 0 360.797 3.974 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])c(S(C)(=O)=O)c1)c1ccccc1F ZINC000155555186 567867928 /nfs/dbraw/zinc/86/79/28/567867928.db2.gz CFVJCHIBUWFCJE-JTQLQIEISA-N 0 0 355.412 3.991 20 5 FHBDRN COCc1cccc(C(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000452884418 567887713 /nfs/dbraw/zinc/88/77/13/567887713.db2.gz PXDFHDMEZMNXGD-SFHVURJKSA-N 0 0 354.406 3.761 20 5 FHBDRN COc1ccc2c(c1)C1(CC1)CN(CCOc1ccccc1[N+](=O)[O-])C2 ZINC000568112738 567888595 /nfs/dbraw/zinc/88/85/95/567888595.db2.gz OGBFYUNXOVJVSJ-UHFFFAOYSA-N 0 0 354.406 3.530 20 5 FHBDRN COc1ccccc1CC(=O)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452888908 567888612 /nfs/dbraw/zinc/88/86/12/567888612.db2.gz SWBYETDTZZYFFD-KRWDZBQOSA-N 0 0 354.406 3.552 20 5 FHBDRN COc1ccc(F)cc1C(=O)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452897046 567904108 /nfs/dbraw/zinc/90/41/08/567904108.db2.gz ZMNRFWJJLMGNKS-CQSZACIVSA-N 0 0 358.369 3.762 20 5 FHBDRN O=C(CCC(=O)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1)c1ccccc1 ZINC000452894408 567910414 /nfs/dbraw/zinc/91/04/14/567910414.db2.gz XVIUROQYKRZQSS-SFHVURJKSA-N 0 0 366.417 3.964 20 5 FHBDRN COc1cc(C(=O)N2CC3(CCC3)c3ccccc32)c([N+](=O)[O-])cc1OC ZINC000481447068 567953322 /nfs/dbraw/zinc/95/33/22/567953322.db2.gz KYTVQYYQENOMJB-UHFFFAOYSA-N 0 0 368.389 3.694 20 5 FHBDRN CC[C@@H]1[C@@H](CO)CCN1C(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000452924195 567956999 /nfs/dbraw/zinc/95/69/99/567956999.db2.gz KTWXIPVWQFGHPC-CRAIPNDOSA-N 0 0 369.421 3.571 20 5 FHBDRN Cc1c(CNC(=O)c2ccc(C(F)(F)F)c(F)c2)cccc1[N+](=O)[O-] ZINC000481461379 567957208 /nfs/dbraw/zinc/95/72/08/567957208.db2.gz ADEQTUXMNMOHEP-UHFFFAOYSA-N 0 0 356.275 3.991 20 5 FHBDRN Cc1cc(Cl)ccc1O[C@H](C)C(=O)NCc1cccc([N+](=O)[O-])c1C ZINC000481462449 567957539 /nfs/dbraw/zinc/95/75/39/567957539.db2.gz DGMVCXOQUNIOSA-CYBMUJFWSA-N 0 0 362.813 3.949 20 5 FHBDRN Cc1nc(-c2c[nH]c(C(=O)NCc3cccc([N+](=O)[O-])c3C)c2)cs1 ZINC000481470355 567965497 /nfs/dbraw/zinc/96/54/97/567965497.db2.gz BISCTQZXCOTHKP-UHFFFAOYSA-N 0 0 356.407 3.593 20 5 FHBDRN Cc1c(CNC(=O)CSc2ccc(Cl)cc2)cccc1[N+](=O)[O-] ZINC000481470901 567966123 /nfs/dbraw/zinc/96/61/23/567966123.db2.gz DWIYXNBIHZUSGJ-UHFFFAOYSA-N 0 0 350.827 3.965 20 5 FHBDRN Cc1c(CNC(=O)c2c[nH]nc2-c2ccccc2Cl)cccc1[N+](=O)[O-] ZINC000481463339 567966360 /nfs/dbraw/zinc/96/63/60/567966360.db2.gz FKWUZJODUFXCBB-UHFFFAOYSA-N 0 0 370.796 3.877 20 5 FHBDRN CC(C)C[C@H](C)n1nccc1NC(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000481466933 567970259 /nfs/dbraw/zinc/97/02/59/567970259.db2.gz SLOGWRYUVLXDPN-AWEZNQCLSA-N 0 0 359.430 3.763 20 5 FHBDRN Cc1cc(C(=O)NCc2cccc([N+](=O)[O-])c2C)c(Br)s1 ZINC000481469625 567970442 /nfs/dbraw/zinc/97/04/42/567970442.db2.gz YXBQKTWGAJRMII-UHFFFAOYSA-N 0 0 369.240 3.966 20 5 FHBDRN Cc1c(CNC(=O)c2c[nH]cc2-c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000481475847 567978233 /nfs/dbraw/zinc/97/82/33/567978233.db2.gz LJLVCQHQOVDRFZ-UHFFFAOYSA-N 0 0 353.353 3.967 20 5 FHBDRN Cc1nn(-c2ccccc2)c(C)c1C(=O)NCc1cccc([N+](=O)[O-])c1C ZINC000481474317 567979202 /nfs/dbraw/zinc/97/92/02/567979202.db2.gz IWEOPFAQTVXHIZ-UHFFFAOYSA-N 0 0 364.405 3.636 20 5 FHBDRN CCOCc1ccc(CNC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)cc1 ZINC000120365065 567980143 /nfs/dbraw/zinc/98/01/43/567980143.db2.gz GKRKHNZWSUYPCZ-UHFFFAOYSA-N 0 0 353.378 3.543 20 5 FHBDRN O=[N+]([O-])c1ccc(OC2CCN(Cc3ccc(C(F)F)nc3)CC2)cc1 ZINC000602477174 567984445 /nfs/dbraw/zinc/98/44/45/567984445.db2.gz RMHUWSVRICZKDV-UHFFFAOYSA-N 0 0 363.364 3.971 20 5 FHBDRN CC(=O)c1c(C)[nH]c(C(=O)NCc2cccc([N+](=O)[O-])c2C)c1C(C)C ZINC000481484998 567987143 /nfs/dbraw/zinc/98/71/43/567987143.db2.gz XQZRPKKJTJOWOQ-UHFFFAOYSA-N 0 0 357.410 3.796 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N(C)Cc1nc(-c2cccs2)no1 ZINC000481485233 567992431 /nfs/dbraw/zinc/99/24/31/567992431.db2.gz LRXSBSWXTGMXLX-UHFFFAOYSA-N 0 0 373.394 3.679 20 5 FHBDRN Cc1c(CNC(=O)C2(CCOCc3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000481494146 567997199 /nfs/dbraw/zinc/99/71/99/567997199.db2.gz QZNYMWGXXADPDL-UHFFFAOYSA-N 0 0 368.433 3.907 20 5 FHBDRN Cc1c(CNC(=O)CCC(=O)c2ccc(Cl)cc2)cccc1[N+](=O)[O-] ZINC000481496460 568005810 /nfs/dbraw/zinc/00/58/10/568005810.db2.gz WUYQQNQOIXIWMK-UHFFFAOYSA-N 0 0 360.797 3.836 20 5 FHBDRN CCCC1CCC(NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2CC)CC1 ZINC000568334781 568026030 /nfs/dbraw/zinc/02/60/30/568026030.db2.gz GNGDPQGBXOZTCI-UHFFFAOYSA-N 0 0 361.442 3.571 20 5 FHBDRN Cc1nnc([C@@H](N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c2ccccc2)[nH]1 ZINC000162530354 568028236 /nfs/dbraw/zinc/02/82/36/568028236.db2.gz FRZNWSNIXJSMQH-UGSOOPFHSA-N 0 0 351.410 3.770 20 5 FHBDRN Cc1sc(C(=O)N[C@@H]2CCO[C@H]2c2ccc(F)c(F)c2)cc1[N+](=O)[O-] ZINC000181863545 568029335 /nfs/dbraw/zinc/02/93/35/568029335.db2.gz JGYMCVZOTDUUBC-DOMZBBRYSA-N 0 0 368.361 3.503 20 5 FHBDRN C[C@@H](c1nc(CCc2ccc3c(c2)CCO3)no1)c1cccc([N+](=O)[O-])c1 ZINC000568445872 568038569 /nfs/dbraw/zinc/03/85/69/568038569.db2.gz ZSDZPVISAZHGEC-CYBMUJFWSA-N 0 0 365.389 3.850 20 5 FHBDRN CC[C@@H](NC(=O)NCc1ccc([N+](=O)[O-])cc1)c1ccc(OC)c(OC)c1 ZINC000568494691 568044632 /nfs/dbraw/zinc/04/46/32/568044632.db2.gz ZPAZXOMYCVOGCI-MRXNPFEDSA-N 0 0 373.409 3.563 20 5 FHBDRN CCCn1ncc(NC(=O)c2cc(OCC)ccc2[N+](=O)[O-])c1C1CC1 ZINC000452957272 568055525 /nfs/dbraw/zinc/05/55/25/568055525.db2.gz BDAXVTXJZMZXPH-UHFFFAOYSA-N 0 0 358.398 3.730 20 5 FHBDRN C[C@]1(CNc2ncnc3sc([N+](=O)[O-])cc32)OCCc2sccc21 ZINC000568573863 568056257 /nfs/dbraw/zinc/05/62/57/568056257.db2.gz CIYGTAABFZGJRL-OAHLLOKOSA-N 0 0 362.436 3.561 20 5 FHBDRN O=[N+]([O-])c1ccc(CN2CCO[C@H](c3ccc(F)cc3Cl)C2)cc1 ZINC000481578546 568060440 /nfs/dbraw/zinc/06/04/40/568060440.db2.gz DAIIXJFYHOYHQZ-KRWDZBQOSA-N 0 0 350.777 3.961 20 5 FHBDRN O=C(c1cc2c(cc1[N+](=O)[O-])OCO2)N1CCC[C@@H]1/C=C\c1ccccc1 ZINC000541875958 568061235 /nfs/dbraw/zinc/06/12/35/568061235.db2.gz ICVSSEIAPDOCLP-WHLNPGIBSA-N 0 0 366.373 3.642 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])Nc1ccc(OCC(F)(F)F)cc1 ZINC000065858957 568063427 /nfs/dbraw/zinc/06/34/27/568063427.db2.gz NCGICQNHTIKVGH-UHFFFAOYSA-N 0 0 369.299 3.587 20 5 FHBDRN Cc1nc(NC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])sc1C ZINC000481584254 568063511 /nfs/dbraw/zinc/06/35/11/568063511.db2.gz JTRRJTGEQRIFPH-UHFFFAOYSA-N 0 0 354.819 3.686 20 5 FHBDRN C[C@]1(CNC(=O)c2cccc(Cl)c2[N+](=O)[O-])OCCc2sccc21 ZINC000291173800 568066420 /nfs/dbraw/zinc/06/64/20/568066420.db2.gz SAMYUTDSYQFHOT-MRXNPFEDSA-N 0 0 366.826 3.528 20 5 FHBDRN C[C@@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC(O)(Cc2ccc(F)cc2)CC1 ZINC000481623566 568070512 /nfs/dbraw/zinc/07/05/12/568070512.db2.gz NOBDAKPEWPRORK-HNNXBMFYSA-N 0 0 358.413 3.865 20 5 FHBDRN COc1ccc(NC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])cc1F ZINC000481622035 568071176 /nfs/dbraw/zinc/07/11/76/568071176.db2.gz FGUYLCCZJXMHRW-UHFFFAOYSA-N 0 0 367.764 3.760 20 5 FHBDRN COc1cccc(F)c1NC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000481642622 568075059 /nfs/dbraw/zinc/07/50/59/568075059.db2.gz PVFCYNNIBZRBTD-UHFFFAOYSA-N 0 0 367.764 3.760 20 5 FHBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])Nc1nc(C2CC2)cs1 ZINC000481676961 568085171 /nfs/dbraw/zinc/08/51/71/568085171.db2.gz XWAZARNLFHFBFU-UHFFFAOYSA-N 0 0 366.830 3.946 20 5 FHBDRN CC[N@@H+]1CC[C@@H](N(C)C(=O)c2cc(Cl)cc(Cl)c2[N+](=O)[O-])[C@@H](C)C1 ZINC000291237313 568086720 /nfs/dbraw/zinc/08/67/20/568086720.db2.gz APLDQUXLDWCIIM-IINYFYTJSA-N 0 0 374.268 3.704 20 5 FHBDRN COc1ccccc1[C@@H](CNc1nc(C)ccc1[N+](=O)[O-])[NH+]1CCCC1 ZINC000481688463 568089054 /nfs/dbraw/zinc/08/90/54/568089054.db2.gz LFRYAPATHHXCHK-QGZVFWFLSA-N 0 0 356.426 3.556 20 5 FHBDRN COc1ccc(CN(C)CC(=O)Nc2c(C)cc(C)cc2C)cc1[N+](=O)[O-] ZINC000051589663 568090097 /nfs/dbraw/zinc/09/00/97/568090097.db2.gz HLKPGLRJLSJECG-UHFFFAOYSA-N 0 0 371.437 3.599 20 5 FHBDRN CCOc1cc(C(=O)N[C@@H](c2ccccc2)C2CC2)c([N+](=O)[O-])cc1OC ZINC000025879822 568096900 /nfs/dbraw/zinc/09/69/00/568096900.db2.gz CLTFQLTVZSQKJK-IBGZPJMESA-N 0 0 370.405 3.883 20 5 FHBDRN CC(=O)c1ccc(OC[C@H](O)Cc2ccc3ccccc3c2)c([N+](=O)[O-])c1 ZINC000481723850 568098453 /nfs/dbraw/zinc/09/84/53/568098453.db2.gz FBYDHFOIMUKXPA-LJQANCHMSA-N 0 0 365.385 3.933 20 5 FHBDRN CSc1ccc(CSC[C@@H](O)COc2ccccc2[N+](=O)[O-])cc1 ZINC000481735274 568099879 /nfs/dbraw/zinc/09/98/79/568099879.db2.gz IBVXWBYJQWENLW-AWEZNQCLSA-N 0 0 365.476 3.990 20 5 FHBDRN CC(C)(NC(=O)c1coc(Br)c1)c1ccccc1[N+](=O)[O-] ZINC000568640145 568103401 /nfs/dbraw/zinc/10/34/01/568103401.db2.gz PMAXXMWASHRLTE-UHFFFAOYSA-N 0 0 353.172 3.615 20 5 FHBDRN COc1cc(C(=O)N([C@@H](C)c2ccccc2)C2CC2)cc([N+](=O)[O-])c1OC ZINC000568666635 568115264 /nfs/dbraw/zinc/11/52/64/568115264.db2.gz XYQRACBMWJXNRH-ZDUSSCGKSA-N 0 0 370.405 3.978 20 5 FHBDRN O=C(NCCc1nc2ccccc2s1)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000603732465 568145477 /nfs/dbraw/zinc/14/54/77/568145477.db2.gz MLBPVQBRAQCPGS-UHFFFAOYSA-N 0 0 367.386 3.923 20 5 FHBDRN Cc1nn(Cc2ccc(C(=O)N(CC(C)C)C3CC3)cc2)c(C)c1[N+](=O)[O-] ZINC000075901613 568159410 /nfs/dbraw/zinc/15/94/10/568159410.db2.gz BUKHUEGTLCQIAK-UHFFFAOYSA-N 0 0 370.453 3.717 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1NCc1ccccc1)N1CC[C@@H]1C1CC1 ZINC000452994718 568184348 /nfs/dbraw/zinc/18/43/48/568184348.db2.gz RAFDQHBSOIKKTJ-LJQANCHMSA-N 0 0 351.406 3.831 20 5 FHBDRN C[S@](=O)c1ccc(NC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000159357814 568186533 /nfs/dbraw/zinc/18/65/33/568186533.db2.gz UJSXJZKIBGXUGC-AREMUKBSSA-N 0 0 373.434 3.529 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N1CCC[C@@H]1c1ccccc1 ZINC000481960748 568197016 /nfs/dbraw/zinc/19/70/16/568197016.db2.gz DPRHVAMCQYWRRL-QGZVFWFLSA-N 0 0 360.435 3.737 20 5 FHBDRN Cc1cc(S(=O)(=O)N[C@H]2CCc3sc(Cl)cc32)ccc1[N+](=O)[O-] ZINC000584683094 568201856 /nfs/dbraw/zinc/20/18/56/568201856.db2.gz XCGYHDQQOHTJRU-NSHDSACASA-N 0 0 372.855 3.584 20 5 FHBDRN CCOC(=O)c1cc(N[C@@H]2CCc3cn(C(C)C)nc3C2)ccc1[N+](=O)[O-] ZINC000481971492 568202497 /nfs/dbraw/zinc/20/24/97/568202497.db2.gz SWXVANCPZYHBBH-OAHLLOKOSA-N 0 0 372.425 3.518 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N[C@@H](c1ccccc1)C(F)F ZINC000481984706 568215448 /nfs/dbraw/zinc/21/54/48/568215448.db2.gz NGZJALXJXYTDKB-HNNXBMFYSA-N 0 0 354.740 3.913 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)N[C@@H](c1ccccc1)C(F)F ZINC000481989780 568215870 /nfs/dbraw/zinc/21/58/70/568215870.db2.gz OGHINGHXMKMXBY-HNNXBMFYSA-N 0 0 352.362 3.810 20 5 FHBDRN O=C(NCCNc1ccccc1[N+](=O)[O-])c1ccc(-c2ccc(F)cc2)o1 ZINC000007117105 568227095 /nfs/dbraw/zinc/22/70/95/568227095.db2.gz NWZZFNCXNYRCOR-UHFFFAOYSA-N 0 0 369.352 3.836 20 5 FHBDRN CCCN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2F)c2cc(F)ccc21 ZINC000568815255 568230691 /nfs/dbraw/zinc/23/06/91/568230691.db2.gz OQZQMBPGGAKWFT-UHFFFAOYSA-N 0 0 361.348 3.750 20 5 FHBDRN Cc1oc(-c2cccs2)nc1CC(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000043840625 568230793 /nfs/dbraw/zinc/23/07/93/568230793.db2.gz PCYDIAMGYNXICG-UHFFFAOYSA-N 0 0 371.418 3.821 20 5 FHBDRN Cc1ccc(NC(=O)c2ccc(N[C@H](C)[C@H]3CCOC3)c([N+](=O)[O-])c2)cc1 ZINC000541921400 568233963 /nfs/dbraw/zinc/23/39/63/568233963.db2.gz GNSPQNKWDWGGNH-ZBFHGGJFSA-N 0 0 369.421 3.992 20 5 FHBDRN CCSCc1ccc(NC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1 ZINC000568859142 568237253 /nfs/dbraw/zinc/23/72/53/568237253.db2.gz DNLGJFJAXPVKLG-KRWDZBQOSA-N 0 0 362.451 3.700 20 5 FHBDRN O=C(N[C@H](c1ccccc1)C(F)F)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000482045085 568238225 /nfs/dbraw/zinc/23/82/25/568238225.db2.gz RSWDQCKWMKHXHQ-CYBMUJFWSA-N 0 0 372.274 3.932 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(N[C@@H](c2nc(-c3ccncc3)no2)C(C)C)n1 ZINC000541932257 568249889 /nfs/dbraw/zinc/24/98/89/568249889.db2.gz KMSRMIMGXMFHJY-CQSZACIVSA-N 0 0 368.397 3.861 20 5 FHBDRN C[C@H](CNC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)CC(F)(F)F ZINC000412660327 568250655 /nfs/dbraw/zinc/25/06/55/568250655.db2.gz ROWGSUAEJREJNV-NSHDSACASA-N 0 0 359.348 3.513 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NCC1(c2ccccn2)CCC1 ZINC000482082041 568255051 /nfs/dbraw/zinc/25/50/51/568255051.db2.gz WYBMOIVUFBBDLU-UHFFFAOYSA-N 0 0 354.410 3.850 20 5 FHBDRN O=C(COc1ccccc1[N+](=O)[O-])N1C[C@H](c2ccccc2)C2(CCC2)C1 ZINC000412664824 568255077 /nfs/dbraw/zinc/25/50/77/568255077.db2.gz DDZNUIREVHXAAP-QGZVFWFLSA-N 0 0 366.417 3.770 20 5 FHBDRN CCOCc1nc([C@@H](C)NCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)no1 ZINC000291680756 568256631 /nfs/dbraw/zinc/25/66/31/568256631.db2.gz XGXVUYMUVAIMSG-GFCCVEGCSA-N 0 0 372.381 3.625 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(N2CCC(C(F)(F)F)(C(F)(F)F)C2)n1 ZINC000541936278 568257188 /nfs/dbraw/zinc/25/71/88/568257188.db2.gz WAGOJNOEHHZHBH-UHFFFAOYSA-N 0 0 357.254 3.928 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)N2CC[C@@]3(CC[C@H](C)C3)C2)cc1SC ZINC000541937143 568257378 /nfs/dbraw/zinc/25/73/78/568257378.db2.gz JWYNBDFPAJYTBE-KPZWWZAWSA-N 0 0 364.467 3.978 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])Nc1cnn(-c2ccc(Cl)cc2)c1 ZINC000482090916 568258680 /nfs/dbraw/zinc/25/86/80/568258680.db2.gz SZICDGPLGXSKOW-UHFFFAOYSA-N 0 0 371.784 3.756 20 5 FHBDRN COc1cc(C(=O)Nc2nc(-c3ccccc3F)co2)ccc1[N+](=O)[O-] ZINC000482126933 568268537 /nfs/dbraw/zinc/26/85/37/568268537.db2.gz NRRYHQLSCIGBKG-UHFFFAOYSA-N 0 0 357.297 3.650 20 5 FHBDRN Cc1ccc2c(c1)CN(C(=O)Nc1cc(C)c([N+](=O)[O-])cc1C)CCO2 ZINC000482133114 568270237 /nfs/dbraw/zinc/27/02/37/568270237.db2.gz SHUHOOFRYDAFOX-UHFFFAOYSA-N 0 0 355.394 3.947 20 5 FHBDRN C[C@@](NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)(C1CC1)C(F)(F)F ZINC000541945629 568273641 /nfs/dbraw/zinc/27/36/41/568273641.db2.gz KXDSWVMHEBXBHD-CYBMUJFWSA-N 0 0 368.258 3.657 20 5 FHBDRN NC(=O)c1ccc(NCC(c2ccccc2)c2ccccc2)c([N+](=O)[O-])c1 ZINC000007981921 568274038 /nfs/dbraw/zinc/27/40/38/568274038.db2.gz SEHXAHDISJXIRP-UHFFFAOYSA-N 0 0 361.401 3.938 20 5 FHBDRN O=[N+]([O-])c1cnc2ccccc2c1N1CCC[C@@H](c2nnc3ccccn32)C1 ZINC000291716962 568274609 /nfs/dbraw/zinc/27/46/09/568274609.db2.gz WFXHPJCQSVEXFV-CQSZACIVSA-N 0 0 374.404 3.570 20 5 FHBDRN Cc1ccc(S(=O)(=O)N(CC(F)(F)F)[C@H](C)C(C)C)c([N+](=O)[O-])c1 ZINC000569103670 568275987 /nfs/dbraw/zinc/27/59/87/568275987.db2.gz PXOMYJBLOBBBIQ-LLVKDONJSA-N 0 0 368.377 3.501 20 5 FHBDRN CCOc1ccc(-c2noc(COc3nc(C)cc(C)c3[N+](=O)[O-])n2)cc1 ZINC000541982946 568277088 /nfs/dbraw/zinc/27/70/88/568277088.db2.gz CYACEKJCWPBPSZ-UHFFFAOYSA-N 0 0 370.365 3.634 20 5 FHBDRN Cc1ccc([C@H](C)CNS(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000303745543 568280995 /nfs/dbraw/zinc/28/09/95/568280995.db2.gz AKDXVXYGUPNLNM-GFCCVEGCSA-N 0 0 368.842 3.639 20 5 FHBDRN CCCCN(C)C(=O)C1CCN(c2c3ccccc3ncc2[N+](=O)[O-])CC1 ZINC000291740242 568284770 /nfs/dbraw/zinc/28/47/70/568284770.db2.gz YONWKVAWQJSBNN-UHFFFAOYSA-N 0 0 370.453 3.618 20 5 FHBDRN Cc1cc(C(=O)NC[C@@H](c2ccccc2Cl)N(C)C)ccc1[N+](=O)[O-] ZINC000008262422 568284848 /nfs/dbraw/zinc/28/48/48/568284848.db2.gz YSJPOEQIJYUAIU-KRWDZBQOSA-N 0 0 361.829 3.589 20 5 FHBDRN Cc1c(CC(=O)Nc2nc(-c3ccccc3F)co2)cccc1[N+](=O)[O-] ZINC000482135568 568287248 /nfs/dbraw/zinc/28/72/48/568287248.db2.gz NLLGVJGRVVGVKW-UHFFFAOYSA-N 0 0 355.325 3.879 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)NCc1nc2cc(Cl)ccc2s1 ZINC000604441255 568288651 /nfs/dbraw/zinc/28/86/51/568288651.db2.gz HFINBNSOQLDEFX-UHFFFAOYSA-N 0 0 361.810 3.717 20 5 FHBDRN Cc1ccccc1[C@@H]1CN(C(=O)[C@H](C)c2cccc([N+](=O)[O-])c2)[C@H](C)CO1 ZINC000569061354 568295741 /nfs/dbraw/zinc/29/57/41/568295741.db2.gz RZDXDWBBEAXYNZ-QINHECLXSA-N 0 0 368.433 3.995 20 5 FHBDRN O=C(NCc1cccc([N+](=O)[O-])c1)c1c(F)ccc(Br)c1F ZINC000569063343 568295906 /nfs/dbraw/zinc/29/59/06/568295906.db2.gz UJSWKGBAXNYMLA-UHFFFAOYSA-N 0 0 371.137 3.566 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(C(C)=O)cc2)cc1SC ZINC000482168356 568300125 /nfs/dbraw/zinc/30/01/25/568300125.db2.gz YXLBBFBVLINGTR-UHFFFAOYSA-N 0 0 360.391 3.780 20 5 FHBDRN C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1c[nH]c2cccc([N+](=O)[O-])c21 ZINC000482171648 568300379 /nfs/dbraw/zinc/30/03/79/568300379.db2.gz BEOJYTJURCZTLS-GXSJLCMTSA-N 0 0 355.316 3.879 20 5 FHBDRN CC(C)c1scnc1NC(=O)N1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000569174152 568303840 /nfs/dbraw/zinc/30/38/40/568303840.db2.gz JASXAVLKSKCWOG-UHFFFAOYSA-N 0 0 362.411 3.601 20 5 FHBDRN CC[C@@H](C)CN(CC)c1cnn(-c2ccc([N+](=O)[O-])cc2)c(=O)c1Cl ZINC000569178650 568304919 /nfs/dbraw/zinc/30/49/19/568304919.db2.gz HGJJXYOEBXWOMN-GFCCVEGCSA-N 0 0 364.833 3.667 20 5 FHBDRN COC(=O)c1ccc(-c2noc([C@@H](C)c3cccc([N+](=O)[O-])c3)n2)cc1 ZINC000569187638 568306413 /nfs/dbraw/zinc/30/64/13/568306413.db2.gz PGDWNOCEWSLNBL-NSHDSACASA-N 0 0 353.334 3.583 20 5 FHBDRN O=C(Nc1ccc(CNc2ccc([N+](=O)[O-])s2)cc1)c1ccncc1 ZINC000604536213 568308926 /nfs/dbraw/zinc/30/89/26/568308926.db2.gz COSYYCTZVVZAIT-UHFFFAOYSA-N 0 0 354.391 3.916 20 5 FHBDRN CCc1nn(C)c(N[C@H]2CCC[C@H](c3nc4ccccc4[nH]3)C2)c1[N+](=O)[O-] ZINC000569217568 568313327 /nfs/dbraw/zinc/31/33/27/568313327.db2.gz QULOYSIBPLWFMB-STQMWFEESA-N 0 0 368.441 3.905 20 5 FHBDRN C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000482215820 568320625 /nfs/dbraw/zinc/32/06/25/568320625.db2.gz WZPPZOJLOWEDMV-RYUDHWBXSA-N 0 0 359.348 3.586 20 5 FHBDRN C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000482215822 568320633 /nfs/dbraw/zinc/32/06/33/568320633.db2.gz WZPPZOJLOWEDMV-VXGBXAGGSA-N 0 0 359.348 3.586 20 5 FHBDRN O=[N+]([O-])c1cc(Br)cnc1N1CCO[C@H](C2CCCCC2)C1 ZINC000569273618 568324819 /nfs/dbraw/zinc/32/48/19/568324819.db2.gz XFJZZFQKDZEJMO-AWEZNQCLSA-N 0 0 370.247 3.538 20 5 FHBDRN COc1ccc(C2(CNC(=O)c3cc([N+](=O)[O-])cn3C)CCCCC2)cc1 ZINC000517938450 568341554 /nfs/dbraw/zinc/34/15/54/568341554.db2.gz FWHSMLYGGVPZFC-UHFFFAOYSA-N 0 0 371.437 3.574 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2noc(CSc3ccc4c(c3)OCCO4)n2)c1 ZINC000031843107 568341927 /nfs/dbraw/zinc/34/19/27/568341927.db2.gz MIYWNANCDWMUNI-UHFFFAOYSA-N 0 0 371.374 3.708 20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])NC[C@@H]1CCCC[C@@H]1C(F)(F)F ZINC000482226177 568371120 /nfs/dbraw/zinc/37/11/20/568371120.db2.gz WISMNHPREJNARX-STQMWFEESA-N 0 0 373.375 3.882 20 5 FHBDRN C[C@H](Sc1ncnc2sccc21)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000003563297 568372150 /nfs/dbraw/zinc/37/21/50/568372150.db2.gz IXPMGZFEKXYDLK-VIFPVBQESA-N 0 0 360.420 3.719 20 5 FHBDRN COc1ccc(NC(=O)c2cc(C)nc3onc(C(C)C)c32)cc1[N+](=O)[O-] ZINC000542001264 568378244 /nfs/dbraw/zinc/37/82/44/568378244.db2.gz CWQQTYYOZRVXOM-UHFFFAOYSA-N 0 0 370.365 3.824 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N2CC[C@@H](C)c3ccccc32)c1C ZINC000032444318 568390537 /nfs/dbraw/zinc/39/05/37/568390537.db2.gz BXKBXQXLXPDZPZ-GFCCVEGCSA-N 0 0 360.435 3.914 20 5 FHBDRN COc1ccc(NC(=O)Cc2ccc(OCC(C)C)cc2)cc1[N+](=O)[O-] ZINC000541994962 568394202 /nfs/dbraw/zinc/39/42/02/568394202.db2.gz NPCBAQOHIUYZQV-UHFFFAOYSA-N 0 0 358.394 3.819 20 5 FHBDRN CC(C)c1ccc2c(c1)CCCN2S(=O)(=O)c1ccccc1[N+](=O)[O-] ZINC000032601361 568397127 /nfs/dbraw/zinc/39/71/27/568397127.db2.gz PFMQRLSWNGMKMH-UHFFFAOYSA-N 0 0 360.435 3.860 20 5 FHBDRN C[C@@H]1c2c(F)cccc2CCN1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000569392271 568400323 /nfs/dbraw/zinc/40/03/23/568400323.db2.gz BYKQNTYMOBHLMU-GFCCVEGCSA-N 0 0 368.368 3.903 20 5 FHBDRN Cc1cccc(NC(=O)Cc2noc([C@H](C)c3cccc([N+](=O)[O-])c3)n2)c1 ZINC000569409599 568401158 /nfs/dbraw/zinc/40/11/58/568401158.db2.gz JDTBHAIHWCGAKS-CYBMUJFWSA-N 0 0 366.377 3.619 20 5 FHBDRN C[C@H](Cc1cnc2ccccc2n1)c1nc(-c2ccc([N+](=O)[O-])s2)no1 ZINC000569480060 568402683 /nfs/dbraw/zinc/40/26/83/568402683.db2.gz MMLIPXKKRCQZJQ-SNVBAGLBSA-N 0 0 367.390 3.996 20 5 FHBDRN CCOCCC1(C(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)CCCC1 ZINC000569501817 568403762 /nfs/dbraw/zinc/40/37/62/568403762.db2.gz GUCNWOCIRHEHBB-UHFFFAOYSA-N 0 0 373.453 3.722 20 5 FHBDRN O=C([O-])c1cccc(OCC[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000569502260 568403836 /nfs/dbraw/zinc/40/38/36/568403836.db2.gz JGIDSAFJXUIQOT-KRWDZBQOSA-N 0 0 370.405 3.551 20 5 FHBDRN C[C@@H](c1nc(-c2ccc3c(c2)OCCO3)no1)c1cccc([N+](=O)[O-])c1 ZINC000569528345 568405619 /nfs/dbraw/zinc/40/56/19/568405619.db2.gz WRHCVWVYKOEKSV-LLVKDONJSA-N 0 0 353.334 3.568 20 5 FHBDRN COc1ccc(C(=O)N[C@H](c2ccccc2)c2ccncc2)cc1[N+](=O)[O-] ZINC000006978166 568408551 /nfs/dbraw/zinc/40/85/51/568408551.db2.gz SGVZFSJNQARZEF-LJQANCHMSA-N 0 0 363.373 3.518 20 5 FHBDRN C[C@@H](Nc1ccc(C(=O)N2CCC[C@H](F)C2)cc1[N+](=O)[O-])c1ccccn1 ZINC000569586383 568408665 /nfs/dbraw/zinc/40/86/65/568408665.db2.gz NMYILHOYLKKONJ-HIFRSBDPSA-N 0 0 372.400 3.737 20 5 FHBDRN O=C1c2ccc([N+](=O)[O-])cc2C(=O)N1CCSc1ccc(Cl)cc1 ZINC000006990383 568412639 /nfs/dbraw/zinc/41/26/39/568412639.db2.gz SNYNVPHYGYJRSB-UHFFFAOYSA-N 0 0 362.794 3.637 20 5 FHBDRN CC[NH+](CC)[C@H](CNc1ccc(CC(=O)[O-])cc1[N+](=O)[O-])c1ccccc1 ZINC000569697493 568412845 /nfs/dbraw/zinc/41/28/45/568412845.db2.gz PPWCJPQYPWQLFL-LJQANCHMSA-N 0 0 371.437 3.717 20 5 FHBDRN CC(C)(C(=O)N1CCC=C(c2cccnc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000569739891 568416516 /nfs/dbraw/zinc/41/65/16/568416516.db2.gz LSYOSVZVYUYOIE-UHFFFAOYSA-N 0 0 351.406 3.583 20 5 FHBDRN COC(C)(C)c1nc(C)c(C(=O)Nc2cc(F)cc([N+](=O)[O-])c2)s1 ZINC000569750234 568419941 /nfs/dbraw/zinc/41/99/41/568419941.db2.gz SFJFTCBYYSWEIM-UHFFFAOYSA-N 0 0 353.375 3.633 20 5 FHBDRN Cc1cc(N[C@@H]2CCCN([C@H](C)c3ccc(F)cc3)C2=O)ncc1[N+](=O)[O-] ZINC000569749763 568429468 /nfs/dbraw/zinc/42/94/68/568429468.db2.gz MOEXZOFWZTUOMK-CZUORRHYSA-N 0 0 372.400 3.601 20 5 FHBDRN Cc1cccc(-c2ccc(CNc3nccc(C(N)=O)c3[N+](=O)[O-])cc2)c1 ZINC000569867031 568432002 /nfs/dbraw/zinc/43/20/02/568432002.db2.gz ZOQFIBLIWAKMKT-UHFFFAOYSA-N 0 0 362.389 3.676 20 5 FHBDRN Cn1cc(C(=O)NCCC(C)(C)C2CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000569881529 568433174 /nfs/dbraw/zinc/43/31/74/568433174.db2.gz GLOPOMCKVNHKKZ-UHFFFAOYSA-N 0 0 356.426 3.551 20 5 FHBDRN C[C@@H](Cn1ccc2ccccc21)c1nc(-c2ccc(N)c([N+](=O)[O-])c2)no1 ZINC000569885970 568433778 /nfs/dbraw/zinc/43/37/78/568433778.db2.gz ROSCXODJSZTTQH-LBPRGKRZSA-N 0 0 363.377 3.985 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(C)c(C(C)=O)c2)cc1OC ZINC000569940118 568436470 /nfs/dbraw/zinc/43/64/70/568436470.db2.gz WRSXPISQWMBVGK-UHFFFAOYSA-N 0 0 372.377 3.765 20 5 FHBDRN COC[C@@H](NCc1ccc([N+](=O)[O-])cc1OC)c1cccc(Cl)c1 ZINC000570196686 568460883 /nfs/dbraw/zinc/46/08/83/568460883.db2.gz BXTPQYIVSTWADY-MRXNPFEDSA-N 0 0 350.802 3.734 20 5 FHBDRN CC[C@@H](CSc1ccc(C)c(C)c1)Nc1nccc(C(N)=O)c1[N+](=O)[O-] ZINC000570213984 568461872 /nfs/dbraw/zinc/46/18/72/568461872.db2.gz UGOYQYZYGYCWFD-ZDUSSCGKSA-N 0 0 374.466 3.688 20 5 FHBDRN CCN(Cc1ccccc1C)c1nnc(-c2ccc([N+](=O)[O-])cc2)n1C ZINC000570249174 568466380 /nfs/dbraw/zinc/46/63/80/568466380.db2.gz YYAJFFRYFHKVRP-UHFFFAOYSA-N 0 0 351.410 3.725 20 5 FHBDRN Cc1c(Cc2noc(-c3nc4cccnc4s3)n2)cccc1[N+](=O)[O-] ZINC000570340227 568467499 /nfs/dbraw/zinc/46/74/99/568467499.db2.gz JSGIQWHMGYBHMH-UHFFFAOYSA-N 0 0 353.363 3.549 20 5 FHBDRN CC(C)(C)c1ncc(C(=O)N2CCS[C@@H]2c2ccc([N+](=O)[O-])cc2)cn1 ZINC000570315465 568467637 /nfs/dbraw/zinc/46/76/37/568467637.db2.gz KMKJGKCZKVPMBB-MRXNPFEDSA-N 0 0 372.450 3.570 20 5 FHBDRN Cc1nn(Cc2ccc(C(=O)N[C@H]3CCC[C@H](C)C3)cc2)c(C)c1[N+](=O)[O-] ZINC000033183295 568470038 /nfs/dbraw/zinc/47/00/38/568470038.db2.gz VXLYWQQRCALRJJ-UGSOOPFHSA-N 0 0 370.453 3.765 20 5 FHBDRN CCCc1n[nH]c(C(=O)N[C@@H]2CC=C(c3ccc(F)cc3)CC2)c1[N+](=O)[O-] ZINC000482231489 568471571 /nfs/dbraw/zinc/47/15/71/568471571.db2.gz LIJFOTKLUATBBX-OAHLLOKOSA-N 0 0 372.400 3.775 20 5 FHBDRN CCOc1cc(C(=O)N(C)[C@H]2CCCC[C@H]2C)c([N+](=O)[O-])cc1OC ZINC000027257423 568477481 /nfs/dbraw/zinc/47/74/81/568477481.db2.gz CBZMYGUXOUQAJB-OCCSQVGLSA-N 0 0 350.415 3.653 20 5 FHBDRN O=[N+]([O-])c1cc(C(F)(F)F)ccc1NC[C@H]1CCC2(CCOCC2)[C@H]1O ZINC000570346208 568479630 /nfs/dbraw/zinc/47/96/30/568479630.db2.gz FETKWJJFSXNIMF-ABAIWWIYSA-N 0 0 374.359 3.593 20 5 FHBDRN O=C(Nc1cccc(F)c1Cl)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000570482385 568487721 /nfs/dbraw/zinc/48/77/21/568487721.db2.gz NUNXVFBXAGRMMH-UHFFFAOYSA-N 0 0 360.732 3.825 20 5 FHBDRN Cc1ccc([C@@]2(C)NC(=O)N(Cc3ccc([N+](=O)[O-])cc3Cl)C2=O)cc1 ZINC000542009452 568510653 /nfs/dbraw/zinc/51/06/53/568510653.db2.gz UDAYORVLCLVVEH-GOSISDBHSA-N 0 0 373.796 3.524 20 5 FHBDRN Cc1csc([C@@H](C)NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)n1 ZINC000120403920 568513468 /nfs/dbraw/zinc/51/34/68/568513468.db2.gz NKNYQZSPPOIREC-GFCCVEGCSA-N 0 0 360.439 3.795 20 5 FHBDRN Cc1cc(NCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)ccc1C(N)=O ZINC000570768432 568523652 /nfs/dbraw/zinc/52/36/52/568523652.db2.gz YGYDVZHGHBRNJG-UHFFFAOYSA-N 0 0 351.362 3.874 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N(C)[C@@H](C)c1ccccc1Cl ZINC000055267779 568604198 /nfs/dbraw/zinc/60/41/98/568604198.db2.gz QFIXARUJJXRMLS-LBPRGKRZSA-N 0 0 368.842 3.938 20 5 FHBDRN O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1N[C@H]1C[C@H]1c1c(F)cccc1Cl ZINC000738357118 598972170 /nfs/dbraw/zinc/97/21/70/598972170.db2.gz BYIHBWHKRYOIAL-RNCFNFMXSA-N 0 0 374.763 3.535 20 5 FHBDRN O=[N+]([O-])c1ccc(Sc2ccc(-c3nn[nH]n3)cc2F)c2ccncc21 ZINC000823645144 599058971 /nfs/dbraw/zinc/05/89/71/599058971.db2.gz ORCDWHOBUMJKQG-UHFFFAOYSA-N 0 0 368.353 3.613 20 5 FHBDRN C[C@H]1C[C@H](c2cccc(F)c2)N(c2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])C1 ZINC000820669221 599060000 /nfs/dbraw/zinc/06/00/00/599060000.db2.gz ZXPMPUPJRUJVGI-MEDUHNTESA-N 0 0 368.372 3.502 20 5 FHBDRN C[C@@H]1C[C@@H](c2cccc(F)c2)N(c2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])C1 ZINC000820669220 599060252 /nfs/dbraw/zinc/06/02/52/599060252.db2.gz ZXPMPUPJRUJVGI-BZNIZROVSA-N 0 0 368.372 3.502 20 5 FHBDRN CCOc1ccccc1[C@H](CC)Nc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-] ZINC000736653719 598246588 /nfs/dbraw/zinc/24/65/88/598246588.db2.gz LNZMJNYJDOCKJW-AWEZNQCLSA-N 0 0 368.397 3.737 20 5 FHBDRN C[C@@H](c1cc2ccccc2o1)N(C)c1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-] ZINC000736194906 598813824 /nfs/dbraw/zinc/81/38/24/598813824.db2.gz DUMROMFKILDXIJ-NSHDSACASA-N 0 0 364.365 3.719 20 5 FHBDRN C[C@@H](SCCOc1ccccc1[N+](=O)[O-])c1ccc(-c2nn[nH]n2)cc1 ZINC000736188164 599325762 /nfs/dbraw/zinc/32/57/62/599325762.db2.gz HXUKZTGXAFWUHQ-GFCCVEGCSA-N 0 0 371.422 3.648 20 5 FHBDRN C[C@H](Nc1nc2ccc([N+](=O)[O-])cc2s1)c1cccc(-c2nn[nH]n2)c1 ZINC000820462513 599352540 /nfs/dbraw/zinc/35/25/40/599352540.db2.gz YAWVQJAEOQTGLU-VIFPVBQESA-N 0 0 367.394 3.558 20 5 FHBDRN C[NH+](C)CCc1ccc(Nc2ccc(/C=C\C(=O)[O-])cc2[N+](=O)[O-])cc1 ZINC000737368359 599854717 /nfs/dbraw/zinc/85/47/17/599854717.db2.gz NNOFBQCJYNUGEG-POHAHGRESA-N 0 0 355.394 3.540 20 5 FHBDRN CC(C)(C[NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)C(=O)[O-] ZINC000426710516 605518201 /nfs/dbraw/zinc/51/82/01/605518201.db2.gz JPWURYBSNLTYEK-UHFFFAOYSA-N 0 0 362.357 3.727 20 5 FHBDRN C[C@H](Nc1ccc(/C=C\C(=O)[O-])cc1[N+](=O)[O-])[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000833526986 605864055 /nfs/dbraw/zinc/86/40/55/605864055.db2.gz XJVJCTCVPRVGQX-ITIMPDFMSA-N 0 0 373.453 3.758 20 5 FHBDRN O=[N+]([O-])c1cc(CSc2ccc(Cl)cc2-c2nn[nH]n2)cs1 ZINC000823634969 606631581 /nfs/dbraw/zinc/63/15/81/606631581.db2.gz PAQHRRSRNKUCOB-UHFFFAOYSA-N 0 0 353.816 3.782 20 5 FHBDRN COc1ccc(CS[C@H](C)c2cccc([N+](=O)[O-])c2)cc1-c1nn[nH]n1 ZINC000826207407 607984234 /nfs/dbraw/zinc/98/42/34/607984234.db2.gz NASUCTDLFYWWPZ-LLVKDONJSA-N 0 0 371.422 3.778 20 5 FHBDRN O=[N+]([O-])c1ccc(Sc2cccc(-c3nn[nH]n3)c2)cc1OC(F)F ZINC000826499373 608191725 /nfs/dbraw/zinc/19/17/25/608191725.db2.gz GMSMSAYNWOOAEX-UHFFFAOYSA-N 0 0 365.321 3.528 20 5 FHBDRN COc1ccc(-c2nn[nH]n2)cc1NCc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000826187069 609484701 /nfs/dbraw/zinc/48/47/01/609484701.db2.gz YISLRCQAEQOEQN-UHFFFAOYSA-N 0 0 368.397 3.519 20 5 FHBDRN O=C(NCCNc1ccc2ncccc2c1[N+](=O)[O-])c1ccccc1Cl ZINC000052007491 936313511 /nfs/dbraw/zinc/31/35/11/936313511.db2.gz OHTKHDFEKQKMKS-UHFFFAOYSA-N 0 0 370.796 3.638 20 5 FHBDRN O=C(Nc1ccnn1-c1cccc(F)c1)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000472273080 936319617 /nfs/dbraw/zinc/31/96/17/936319617.db2.gz GBTAIJMXKXDZPQ-UHFFFAOYSA-N 0 0 366.308 3.918 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1-c1nc(Cc2ccc(OC(F)F)cc2)no1 ZINC000612869024 936328234 /nfs/dbraw/zinc/32/82/34/936328234.db2.gz HGWPXEZXYMSJBD-UHFFFAOYSA-N 0 0 362.292 3.540 20 5 FHBDRN COC(=O)C(C)(C)c1ccc(NC(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000572903764 936328384 /nfs/dbraw/zinc/32/83/84/936328384.db2.gz XOWLINKMSOAFKE-ZDUSSCGKSA-N 0 0 370.405 3.788 20 5 FHBDRN O=C(N[C@@H]1CCCc2occc21)c1sc(Br)cc1[N+](=O)[O-] ZINC000277998872 936338060 /nfs/dbraw/zinc/33/80/60/936338060.db2.gz XKKPJCARTKZTBG-MRVPVSSYSA-N 0 0 371.212 3.819 20 5 FHBDRN Cc1ccc(NC(=O)CCNc2ccccc2[N+](=O)[O-])c2c1NCCC2 ZINC000582981144 936341645 /nfs/dbraw/zinc/34/16/45/936341645.db2.gz ZHKDJOKJBARMIL-UHFFFAOYSA-N 0 0 354.410 3.702 20 5 FHBDRN COc1cccc([C@H](C)c2noc(-c3cc4c(c([N+](=O)[O-])c3)OCO4)n2)c1 ZINC000612918312 936342577 /nfs/dbraw/zinc/34/25/77/936342577.db2.gz YZTAQBCYAWUFNF-JTQLQIEISA-N 0 0 369.333 3.534 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1Cl)N[C@H]1CCCc2ccccc21 ZINC000005118530 936377373 /nfs/dbraw/zinc/37/73/73/936377373.db2.gz NFGWNBMSYQUFAW-INIZCTEOSA-N 0 0 360.797 3.821 20 5 FHBDRN O=[N+]([O-])c1ccc([C@@H](NC[C@H](CO)c2ccccc2)C(F)(F)F)cc1 ZINC000583029540 936381353 /nfs/dbraw/zinc/38/13/53/936381353.db2.gz UMZLXIZQRZUGRN-GDBMZVCRSA-N 0 0 354.328 3.564 20 5 FHBDRN COc1ccc(OC)c(NC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000178753046 936385681 /nfs/dbraw/zinc/38/56/81/936385681.db2.gz OUBZCRMAHDYKEB-UHFFFAOYSA-N 0 0 371.393 3.809 20 5 FHBDRN COc1ccccc1CCNC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000437145304 945066838 /nfs/dbraw/zinc/06/68/38/945066838.db2.gz YEZVYJKKFSKLGK-UHFFFAOYSA-N 0 0 368.311 3.595 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H]1CCC[C@@H](SC)C1 ZINC000439903742 945068090 /nfs/dbraw/zinc/06/80/90/945068090.db2.gz QTVTWKDNJJADKW-DGCLKSJQSA-N 0 0 353.444 3.789 20 5 FHBDRN COc1ccc(-c2cnc(NC(=O)c3cc(C)cc([N+](=O)[O-])c3)n2C)cc1 ZINC000572916183 937078707 /nfs/dbraw/zinc/07/87/07/937078707.db2.gz VHKXPPYNZPIURP-UHFFFAOYSA-N 0 0 366.377 3.565 20 5 FHBDRN CC(C)N(Cc1ccccc1)C(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cn1 ZINC000178753228 937081623 /nfs/dbraw/zinc/08/16/23/937081623.db2.gz OZYVUPJXAUVFNU-CQSZACIVSA-N 0 0 359.451 3.908 20 5 FHBDRN CC[C@@H](c1ccccc1OC)N(C)C(=O)c1cccc([N+](=O)[O-])c1OC ZINC000514816249 937089880 /nfs/dbraw/zinc/08/98/80/937089880.db2.gz CMVXDIJEPLUKQI-HNNXBMFYSA-N 0 0 358.394 3.835 20 5 FHBDRN CC(=O)c1cccc(NC(=O)[C@@H](Sc2ccc([N+](=O)[O-])cn2)C(C)C)c1 ZINC000178763516 937096227 /nfs/dbraw/zinc/09/62/27/937096227.db2.gz YKRLQUVAUDSGCY-KRWDZBQOSA-N 0 0 373.434 3.948 20 5 FHBDRN COc1cc(CNc2c3c(ccc2Cl)OCC3)c([N+](=O)[O-])cc1F ZINC000480142980 937104080 /nfs/dbraw/zinc/10/40/80/937104080.db2.gz GDOGVWYJGWPXMI-UHFFFAOYSA-N 0 0 352.749 3.943 20 5 FHBDRN CCc1noc(-c2ccc(C)c(NC(=O)Cc3ccccc3[N+](=O)[O-])c2)n1 ZINC000176375471 937113897 /nfs/dbraw/zinc/11/38/97/937113897.db2.gz MFPFJWLWUHNITO-UHFFFAOYSA-N 0 0 366.377 3.697 20 5 FHBDRN COc1cc(CCNC(=O)c2ccc([N+](=O)[O-])cc2Cl)ccc1Cl ZINC000583105601 937122310 /nfs/dbraw/zinc/12/23/10/937122310.db2.gz PZGBMHCWXOSWKV-UHFFFAOYSA-N 0 0 369.204 3.883 20 5 FHBDRN CCOc1cccc(NC2CCC(O)(c3cccnc3)CC2)c1[N+](=O)[O-] ZINC000274519963 927071570 /nfs/dbraw/zinc/07/15/70/927071570.db2.gz ZXTLMTYZMQDGSP-UHFFFAOYSA-N 0 0 357.410 3.631 20 5 FHBDRN CN(Cc1ccc(F)cc1Cl)c1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1 ZINC000557583447 927108844 /nfs/dbraw/zinc/10/88/44/927108844.db2.gz CKGUPKHQLYUBRZ-UHFFFAOYSA-N 0 0 362.748 3.673 20 5 FHBDRN Cc1ccc(C(=O)Nc2cccc(OC[C@@H]3CCCO3)c2)cc1[N+](=O)[O-] ZINC000247972126 937137061 /nfs/dbraw/zinc/13/70/61/937137061.db2.gz ATHZKJAJHYCHJG-KRWDZBQOSA-N 0 0 356.378 3.713 20 5 FHBDRN CC(C)(C)OCc1cc(CNc2nc3c(cc2[N+](=O)[O-])CCCC3)no1 ZINC000579704345 927145465 /nfs/dbraw/zinc/14/54/65/927145465.db2.gz HQEWTCUQBURUNT-UHFFFAOYSA-N 0 0 360.414 3.784 20 5 FHBDRN COc1cc(C(=O)N2CCCc3c(F)ccc(C)c32)cc([N+](=O)[O-])c1OC ZINC000610174846 927172406 /nfs/dbraw/zinc/17/24/06/927172406.db2.gz GVBGCYZWBSXCGY-UHFFFAOYSA-N 0 0 374.368 3.653 20 5 FHBDRN CCOC(=O)c1ccnc(NCCOc2ccc(C(C)C)cc2)c1[N+](=O)[O-] ZINC000579725342 927191832 /nfs/dbraw/zinc/19/18/32/927191832.db2.gz FGGCSYWNEWOHQW-UHFFFAOYSA-N 0 0 373.409 3.781 20 5 FHBDRN Cc1nc(NC(=O)c2ccccc2-c2nc(C(C)C)no2)ccc1[N+](=O)[O-] ZINC000133633604 927214224 /nfs/dbraw/zinc/21/42/24/927214224.db2.gz IQVYVKBOFZTIQN-UHFFFAOYSA-N 0 0 367.365 3.724 20 5 FHBDRN COc1ccc(C(=O)Nc2cc([N+](=O)[O-])ccc2C)c(Br)c1 ZINC000133639907 927217786 /nfs/dbraw/zinc/21/77/86/927217786.db2.gz XCMWPEIYNISPGK-UHFFFAOYSA-N 0 0 365.183 3.927 20 5 FHBDRN C[C@@H](NS(=O)(=O)c1cccc2c1CCCC2)c1cccc([N+](=O)[O-])c1 ZINC000748054486 927261844 /nfs/dbraw/zinc/26/18/44/927261844.db2.gz KOROVJVVTOTCPT-CYBMUJFWSA-N 0 0 360.435 3.513 20 5 FHBDRN CO[C@@H](c1ccccc1F)[C@H](C)Nc1ncnc2sc([N+](=O)[O-])cc21 ZINC000557646125 927270500 /nfs/dbraw/zinc/27/05/00/927270500.db2.gz ZSXPZAPNQMWANZ-LKFCYVNXSA-N 0 0 362.386 3.927 20 5 FHBDRN CC1(C)CN(c2ncnc3cccc([N+](=O)[O-])c32)CC[C@@H]1C(F)(F)F ZINC000577571539 927283100 /nfs/dbraw/zinc/28/31/00/927283100.db2.gz BBQUFDAYAQQADP-LBPRGKRZSA-N 0 0 354.332 3.953 20 5 FHBDRN Cc1c(CC(=O)N[C@@H](C)c2cccc(-n3cccn3)c2)cccc1[N+](=O)[O-] ZINC000126839737 927287497 /nfs/dbraw/zinc/28/74/97/927287497.db2.gz RUVPWJDRJBUFOT-HNNXBMFYSA-N 0 0 364.405 3.509 20 5 FHBDRN C[C@@H]1CCCN(C(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])[C@H]1C ZINC000610178768 927317212 /nfs/dbraw/zinc/31/72/12/927317212.db2.gz WXYLKHCKQVNDKQ-MNOVXSKESA-N 0 0 360.332 3.797 20 5 FHBDRN C[C@@H](c1ccc([S@@](C)=O)cc1)N(C)c1ncc(Cl)cc1[N+](=O)[O-] ZINC000153891278 927317738 /nfs/dbraw/zinc/31/77/38/927317738.db2.gz HWJDORSTGLQUHW-VCGICTTQSA-N 0 0 353.831 3.578 20 5 FHBDRN CC(C)(C)C[C@@H](NC(=O)Cn1ccc([N+](=O)[O-])n1)c1ccc(Cl)cc1 ZINC000610178443 927320978 /nfs/dbraw/zinc/32/09/78/927320978.db2.gz YBUWMTXYQPHRTG-CQSZACIVSA-N 0 0 364.833 3.738 20 5 FHBDRN Cc1cccnc1[C@@H](NC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)C(C)C ZINC000120135834 927390149 /nfs/dbraw/zinc/39/01/49/927390149.db2.gz PILIHRDMBJWURL-SFHVURJKSA-N 0 0 368.437 3.763 20 5 FHBDRN Cc1nn(C)c(C(=O)Nc2ccc(N3CCCC[C@@H]3C)cc2C)c1[N+](=O)[O-] ZINC000153898678 927451264 /nfs/dbraw/zinc/45/12/64/927451264.db2.gz CFUXRKBYMPMGFP-ZDUSSCGKSA-N 0 0 371.441 3.576 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@H](c2cc(C)ccn2)C1 ZINC000583153196 937179524 /nfs/dbraw/zinc/17/95/24/937179524.db2.gz IXJVOGZAQGWQLE-ROUUACIJSA-N 0 0 367.449 3.883 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@@]3(C2)OCc2ccccc23)c1 ZINC000186943500 927596113 /nfs/dbraw/zinc/59/61/13/927596113.db2.gz QNSPWCBSWNESIJ-IBGZPJMESA-N 0 0 370.430 3.588 20 5 FHBDRN Cc1cc(OCC(=O)Nc2ccc(F)cc2NC2CC2)ccc1[N+](=O)[O-] ZINC000435758408 937175486 /nfs/dbraw/zinc/17/54/86/937175486.db2.gz DJYTYFXVRHEAIL-UHFFFAOYSA-N 0 0 359.357 3.634 20 5 FHBDRN O=C(c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)N(CCC1CC1)CC1CC1 ZINC000598465618 927638540 /nfs/dbraw/zinc/63/85/40/927638540.db2.gz GTRDCAWVXSFVDA-UHFFFAOYSA-N 0 0 355.394 3.501 20 5 FHBDRN Cc1nc(-c2ccc(CCNC(=O)c3ccc([N+](=O)[O-])o3)s2)cs1 ZINC000248023868 937178835 /nfs/dbraw/zinc/17/88/35/937178835.db2.gz 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CC[C@H](C)COc1cc([N+](=O)[O-])c(CN(C)[C@H]2CCCOC2)cc1OC ZINC000510077271 927791353 /nfs/dbraw/zinc/79/13/53/927791353.db2.gz BORDWRQBNTWHSO-HOCLYGCPSA-N 0 0 366.458 3.639 20 5 FHBDRN COC(C)(C)C[C@@H](C)NC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000175306129 927819568 /nfs/dbraw/zinc/81/95/68/927819568.db2.gz OUVIVFWYUUNKKZ-SECBINFHSA-N 0 0 361.345 3.521 20 5 FHBDRN Cc1nc(CNC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)sc1C ZINC000175307961 927820567 /nfs/dbraw/zinc/82/05/67/927820567.db2.gz ARCXMBOCKBSLBZ-UHFFFAOYSA-N 0 0 372.353 3.591 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)[C@H]1C[C@]12CCCc1ccccc12 ZINC000175311782 927823106 /nfs/dbraw/zinc/82/31/06/927823106.db2.gz CMONTHUHEIZMNK-NQIIRXRSSA-N 0 0 350.418 3.847 20 5 FHBDRN C[C@]1(c2ccccc2)C[C@H]1NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000610191204 927823716 /nfs/dbraw/zinc/82/37/16/927823716.db2.gz XBFSTSPXNBAXPF-UYAOXDASSA-N 0 0 351.406 3.629 20 5 FHBDRN CCO[C@H]1C[C@H](N(C)C(=O)c2cc(F)cc([N+](=O)[O-])c2)C12CCCCC2 ZINC000610192008 927838156 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CCOc1ccc([C@H](C)NC(=O)c2cc(C)ccc2[N+](=O)[O-])cc1OC ZINC000610223644 928303206 /nfs/dbraw/zinc/30/32/06/928303206.db2.gz KOLPRIVMGAWFJH-ZDUSSCGKSA-N 0 0 358.394 3.802 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N1CCC[C@H](C(F)(F)F)[C@H]1C ZINC000471162510 928312409 /nfs/dbraw/zinc/31/24/09/928312409.db2.gz PWKYRFDGKQBUGU-MNOVXSKESA-N 0 0 360.332 3.797 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](c2ccc(F)cc2)[C@@H]2CCCO2)c1 ZINC000610225259 928322519 /nfs/dbraw/zinc/32/25/19/928322519.db2.gz YLYRPYDBHFXHSQ-ROUUACIJSA-N 0 0 358.369 3.692 20 5 FHBDRN CCCN(C(=O)Cc1cccc([N+](=O)[O-])c1)[C@@H]1CCc2ccccc2C1 ZINC000610226250 928322806 /nfs/dbraw/zinc/32/28/06/928322806.db2.gz OWBAPLCNJNWSIB-LJQANCHMSA-N 0 0 352.434 3.933 20 5 FHBDRN O=C(CCC(=O)c1ccccc1)OCCSc1ccc([N+](=O)[O-])cc1 ZINC000784939796 928366692 /nfs/dbraw/zinc/36/66/92/928366692.db2.gz TVPXBTJGBAAJKS-UHFFFAOYSA-N 0 0 359.403 3.893 20 5 FHBDRN CC(C)Oc1cncc(C(=O)OCCSc2ccc([N+](=O)[O-])cc2)c1 ZINC000784939883 928368477 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C[C@@H](CC(=O)c1ccc(F)cc1)NC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc21 ZINC000127056875 928454289 /nfs/dbraw/zinc/45/42/89/928454289.db2.gz SGIAENSKASBTQD-NSHDSACASA-N 0 0 369.352 3.607 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)Nc1cc(Br)ccc1C ZINC000127056089 928456159 /nfs/dbraw/zinc/45/61/59/928456159.db2.gz OCXQKNWEXSXARP-UHFFFAOYSA-N 0 0 365.183 3.927 20 5 FHBDRN CCNC(=O)c1ccc(CNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1 ZINC000052190490 937247667 /nfs/dbraw/zinc/24/76/67/937247667.db2.gz HACACILHVLBDRD-UHFFFAOYSA-N 0 0 367.327 3.975 20 5 FHBDRN CC1(C)C[C@@H](NC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)CCO1 ZINC000278140626 937248890 /nfs/dbraw/zinc/24/88/90/937248890.db2.gz VUEPADQDUIVCFF-ZDUSSCGKSA-N 0 0 350.418 3.781 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1OC[C@@H](O)CO[C@@H]1CCCc2ccccc21 ZINC000583218768 937249541 /nfs/dbraw/zinc/24/95/41/937249541.db2.gz JFWQJZRGABPSCV-PKOBYXMFSA-N 0 0 357.406 3.737 20 5 FHBDRN CCOC(=O)c1cc(N[C@H](CCCO)c2ccccc2)ccc1[N+](=O)[O-] ZINC000127071401 928500446 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5 FHBDRN COc1ccc2c(c1)OCC[C@H]2NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000610234261 928785796 /nfs/dbraw/zinc/78/57/96/928785796.db2.gz QKHSBQIYTRHEQR-OAHLLOKOSA-N 0 0 362.769 3.510 20 5 FHBDRN Cc1cc(C(=O)COC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)c(C)[nH]1 ZINC000023459514 928800967 /nfs/dbraw/zinc/80/09/67/928800967.db2.gz NTWHKCLJTNSAHX-UHFFFAOYSA-N 0 0 358.375 3.794 20 5 FHBDRN O=C(N[C@H]1c2ccccc2C[C@@H]1O)c1cc2ccccc2c2cccnc12 ZINC000179599123 928851036 /nfs/dbraw/zinc/85/10/36/928851036.db2.gz VBUAZXQGEWEKER-UNMCSNQZSA-N 0 0 354.409 3.776 20 5 FHBDRN COc1ccc(C)cc1[C@@H](C)NC(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000458450020 937281442 /nfs/dbraw/zinc/28/14/42/937281442.db2.gz HBFGKZJBOMXFPE-CQSZACIVSA-N 0 0 357.410 3.515 20 5 FHBDRN Cc1cc(NCc2ccc(N3C[C@@H](C)O[C@@H](C)C3)nc2)ccc1[N+](=O)[O-] ZINC000052219369 937284205 /nfs/dbraw/zinc/28/42/05/937284205.db2.gz CKRMHXHBFKCTMF-GASCZTMLSA-N 0 0 356.426 3.524 20 5 FHBDRN COC(=O)C1CCC(Nc2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000134445482 928913643 /nfs/dbraw/zinc/91/36/43/928913643.db2.gz KHZXKMJOGJQQAB-UHFFFAOYSA-N 0 0 357.204 3.501 20 5 FHBDRN Cc1nnc([C@@H]2CCCCN2c2ccc([N+](=O)[O-])c(-c3ccccc3)n2)[nH]1 ZINC000509534212 928921426 /nfs/dbraw/zinc/92/14/26/928921426.db2.gz XCABHLKJMSGWLN-INIZCTEOSA-N 0 0 364.409 3.815 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(NCc2c(F)c(F)cc(F)c2F)c1 ZINC000611757026 937286468 /nfs/dbraw/zinc/28/64/68/937286468.db2.gz ZSCZZDINHGATQX-UHFFFAOYSA-N 0 0 358.247 3.550 20 5 FHBDRN COc1ccc(CC(=O)N(C)[C@@H](C)c2ccc(C)cc2C)cc1[N+](=O)[O-] ZINC000609010774 928954356 /nfs/dbraw/zinc/95/43/56/928954356.db2.gz RZBFUCRBPUMHNG-HNNXBMFYSA-N 0 0 356.422 3.982 20 5 FHBDRN CC[C@@H](Cc1ccccc1)NC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000609033156 928957207 /nfs/dbraw/zinc/95/72/07/928957207.db2.gz MKVDQZFNZMDGMD-KRWDZBQOSA-N 0 0 351.406 3.687 20 5 FHBDRN O=C(c1c[nH]c(=O)c([N+](=O)[O-])c1)N1CCCC[C@@H]1c1cc2ccccc2[nH]1 ZINC000187178633 928961723 /nfs/dbraw/zinc/96/17/23/928961723.db2.gz RMMFAUFPMBJTDF-MRXNPFEDSA-N 0 0 366.377 3.544 20 5 FHBDRN O=C(NCCc1ccccc1[N+](=O)[O-])N[C@H](C1CCCCC1)C(F)(F)F ZINC000467985629 928965249 /nfs/dbraw/zinc/96/52/49/928965249.db2.gz SZAFXKXHWWYCIF-OAHLLOKOSA-N 0 0 373.375 3.948 20 5 FHBDRN CCN(C(=O)c1c([N+](=O)[O-])cnn1C)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000164957072 928965755 /nfs/dbraw/zinc/96/57/55/928965755.db2.gz OMAXMAQKTRXGSG-SNVBAGLBSA-N 0 0 370.331 3.570 20 5 FHBDRN Cc1ncccc1C(=O)Nc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1 ZINC000170988230 928972830 /nfs/dbraw/zinc/97/28/30/928972830.db2.gz STZFCXUECHAYPA-UHFFFAOYSA-N 0 0 361.357 3.782 20 5 FHBDRN CC(=O)Nc1cccc(NC(=O)[C@@H](C)Sc2cccc([N+](=O)[O-])c2)c1 ZINC000509751991 928984773 /nfs/dbraw/zinc/98/47/73/928984773.db2.gz QOCAMHXLBVJZHC-LLVKDONJSA-N 0 0 359.407 3.673 20 5 FHBDRN CN(C(=O)c1cc([N+](=O)[O-])cn1C)c1ccc(OCc2ccccc2)cc1 ZINC000547726165 929003607 /nfs/dbraw/zinc/00/36/07/929003607.db2.gz DPADPWJFICXLTI-UHFFFAOYSA-N 0 0 365.389 3.789 20 5 FHBDRN CC(C)(C)c1cc(NC(=O)c2ccccc2[N+](=O)[O-])n(-c2ccccn2)n1 ZINC000609152000 929010292 /nfs/dbraw/zinc/01/02/92/929010292.db2.gz NLQLSKNRJXVSDT-UHFFFAOYSA-N 0 0 365.393 3.725 20 5 FHBDRN CN(C)c1nc2ccc(NC(=O)Cc3ccc([N+](=O)[O-])cc3Cl)cc2o1 ZINC000165019453 929064954 /nfs/dbraw/zinc/06/49/54/929064954.db2.gz DYRJXXJKGJAQAC-UHFFFAOYSA-N 0 0 374.784 3.637 20 5 FHBDRN O=C(OCc1ccc([N+](=O)[O-])cc1)c1cc(N2CCCC2=O)ccc1Cl ZINC000134641545 929107892 /nfs/dbraw/zinc/10/78/92/929107892.db2.gz VWRJARTVGGTBEI-UHFFFAOYSA-N 0 0 374.780 3.732 20 5 FHBDRN O=C(c1ccn(-c2ccccc2[N+](=O)[O-])n1)N1CCC[C@@]2(CC=CCC2)C1 ZINC000134682989 929131250 /nfs/dbraw/zinc/13/12/50/929131250.db2.gz VLXFHTYRYIHUBC-FQEVSTJZSA-N 0 0 366.421 3.743 20 5 FHBDRN C[C@@H]1CN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)C[C@@H](c2ccccc2)O1 ZINC000134681843 929131429 /nfs/dbraw/zinc/13/14/29/929131429.db2.gz HFXTUDHKWOZMON-PXAZEXFGSA-N 0 0 360.797 3.850 20 5 FHBDRN CN(CCCc1cc(-c2ccccc2)no1)C(=O)c1ccc([N+](=O)[O-])cc1 ZINC000110128778 937306645 /nfs/dbraw/zinc/30/66/45/937306645.db2.gz UGILMKFENZQFRY-UHFFFAOYSA-N 0 0 365.389 3.955 20 5 FHBDRN Cc1nc(CCOC(=O)c2cccc([N+](=O)[O-])c2Br)cs1 ZINC000781675264 929159685 /nfs/dbraw/zinc/15/96/85/929159685.db2.gz QRPSZURMSMDDLX-UHFFFAOYSA-N 0 0 371.212 3.522 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)COc1cc(Cl)ccc1Cl ZINC000004524352 929177975 /nfs/dbraw/zinc/17/79/75/929177975.db2.gz LOPUJZBJYTUXBH-UHFFFAOYSA-N 0 0 371.176 3.928 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(NCc2cccnc2OCC(F)(F)F)c1 ZINC000609494958 929179135 /nfs/dbraw/zinc/17/91/35/929179135.db2.gz INRMNAXFCBWKJS-UHFFFAOYSA-N 0 0 357.288 3.552 20 5 FHBDRN C[C@H](NC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1)c1cnn(CC2CCC2)c1 ZINC000890670333 929180304 /nfs/dbraw/zinc/18/03/04/929180304.db2.gz KWWOVDVYWNTYMN-KBPBESRZSA-N 0 0 356.426 3.572 20 5 FHBDRN C[C@@H](NC(=O)CSc1ccc([N+](=O)[O-])cc1)c1cnn(CC2CCC2)c1 ZINC000890676221 929222643 /nfs/dbraw/zinc/22/26/43/929222643.db2.gz DFMSKJXLKBDYMC-CYBMUJFWSA-N 0 0 374.466 3.561 20 5 FHBDRN CCc1c(NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)n[nH]c1-c1ccncc1 ZINC000134792912 929261387 /nfs/dbraw/zinc/26/13/87/929261387.db2.gz KVSQBUZDVSEMAJ-UHFFFAOYSA-N 0 0 371.784 3.848 20 5 FHBDRN CC(C)(CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)c1cccs1 ZINC000134794068 929269003 /nfs/dbraw/zinc/26/90/03/929269003.db2.gz JCDUSIDTRRROER-UHFFFAOYSA-N 0 0 357.435 3.774 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CCC[C@]2(CC=CCC2)C1 ZINC000134799765 929280156 /nfs/dbraw/zinc/28/01/56/929280156.db2.gz PXFDVFOLYGJODN-HXUWFJFHSA-N 0 0 353.422 3.968 20 5 FHBDRN CC(C)(NC(=O)c1cccc2ccc(=O)[nH]c21)c1ccc([N+](=O)[O-])cc1 ZINC000583285670 937318094 /nfs/dbraw/zinc/31/80/94/937318094.db2.gz JKSLJNBSRZMDOM-UHFFFAOYSA-N 0 0 351.362 3.514 20 5 FHBDRN Cc1cc(Cl)c(S(=O)(=O)Nc2c(F)cccc2F)cc1[N+](=O)[O-] ZINC000176635790 937320603 /nfs/dbraw/zinc/32/06/03/937320603.db2.gz GGRUBSVSLCAQFO-UHFFFAOYSA-N 0 0 362.741 3.636 20 5 FHBDRN Cn1c2ccc(Nc3ccc([N+](=O)[O-])c(C(F)(F)F)c3)cc2n(C)c1=O ZINC000535987141 937321285 /nfs/dbraw/zinc/32/12/85/937321285.db2.gz GZDIHLYEJHAMMI-UHFFFAOYSA-N 0 0 366.299 3.548 20 5 FHBDRN COc1cc(N2CC[C@H](COCc3ccccc3)C2)c(F)cc1[N+](=O)[O-] ZINC000535629126 929354882 /nfs/dbraw/zinc/35/48/82/929354882.db2.gz QNAVWCHNKKTGQC-HNNXBMFYSA-N 0 0 360.385 3.786 20 5 FHBDRN C[C@H](c1cccc(C(F)(F)F)c1)N(C(=O)c1c[nH]nc1[N+](=O)[O-])C1CC1 ZINC000547756059 929370120 /nfs/dbraw/zinc/37/01/20/929370120.db2.gz WLSUSQPEBJWXOZ-SECBINFHSA-N 0 0 368.315 3.703 20 5 FHBDRN CCOc1cc(C(=O)NC(C)(C)CC(C)(C)C)c([N+](=O)[O-])cc1OC ZINC000248254646 937330819 /nfs/dbraw/zinc/33/08/19/937330819.db2.gz KHEVPWPXQJIERW-UHFFFAOYSA-N 0 0 352.431 3.947 20 5 FHBDRN CC(C)C[C@H]1CCCN(C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)C1 ZINC000134867320 929450526 /nfs/dbraw/zinc/45/05/26/929450526.db2.gz VNHYLLZEFQDYRC-OAHLLOKOSA-N 0 0 356.426 3.679 20 5 FHBDRN Cc1nn(C(C)(C)C)cc1[C@@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000154892747 929458327 /nfs/dbraw/zinc/45/83/27/929458327.db2.gz CNGLGRFGSIMVDS-SNVBAGLBSA-N 0 0 364.833 3.999 20 5 FHBDRN COc1cc(C(=O)N(C)[C@@H]2CCCc3ccccc32)c([N+](=O)[O-])cc1F ZINC000583308270 937338143 /nfs/dbraw/zinc/33/81/43/937338143.db2.gz UUONWKQKDWPPHV-MRXNPFEDSA-N 0 0 358.369 3.892 20 5 FHBDRN CCOC(=O)CC1CCN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC1 ZINC000535993872 937339730 /nfs/dbraw/zinc/33/97/30/937339730.db2.gz QAINRTYFUKYWSL-UHFFFAOYSA-N 0 0 360.332 3.783 20 5 FHBDRN CCN(c1ccc(F)cc1)S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000248274911 937340386 /nfs/dbraw/zinc/34/03/86/937340386.db2.gz XWVZJAFOJVMDAO-UHFFFAOYSA-N 0 0 358.778 3.603 20 5 FHBDRN O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1CCCO[C@@H](c2ccccc2)C1 ZINC000609857302 929601186 /nfs/dbraw/zinc/60/11/86/929601186.db2.gz FVYITAALLBQZPZ-QGZVFWFLSA-N 0 0 360.797 3.852 20 5 FHBDRN Cc1cnn(Cc2ccccc2F)c1NC(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000187227320 929616498 /nfs/dbraw/zinc/61/64/98/929616498.db2.gz HWGJUHVYAMXHAB-UHFFFAOYSA-N 0 0 368.368 3.848 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)NCc1ccc(OC(F)F)cc1 ZINC000043126779 929617114 /nfs/dbraw/zinc/61/71/14/929617114.db2.gz VTWROBIWAQJTKV-UHFFFAOYSA-N 0 0 367.308 3.527 20 5 FHBDRN CC(=O)Nc1ccc(C(F)(F)F)cc1NC(=O)c1ccc([N+](=O)[O-])s1 ZINC000064828138 929622818 /nfs/dbraw/zinc/62/28/18/929622818.db2.gz JDCFNEGOJWDWIE-UHFFFAOYSA-N 0 0 373.312 3.886 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1[C@@H]2Cc3ccccc3[C@@H]21 ZINC000248294058 937346353 /nfs/dbraw/zinc/34/63/53/937346353.db2.gz XTACJYFREPHXBP-HQKIHSOMSA-N 0 0 354.431 3.530 20 5 FHBDRN C[C@H]1CO[C@@H](c2ccccc2)CN1C(=O)c1cccc(Cl)c1[N+](=O)[O-] ZINC000175820809 929681452 /nfs/dbraw/zinc/68/14/52/929681452.db2.gz ZMPJCURJBWVFKS-BLLLJJGKSA-N 0 0 360.797 3.850 20 5 FHBDRN O=C(c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)N1CCC(C2CCCC2)CC1 ZINC000610297703 929731447 /nfs/dbraw/zinc/73/14/47/929731447.db2.gz BZTGJHHYACHJSU-UHFFFAOYSA-N 0 0 368.437 3.823 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)N(Cc1ccco1)Cc1ccc(O)cc1 ZINC000157779456 929787903 /nfs/dbraw/zinc/78/79/03/929787903.db2.gz JEXLAQOTJAOTAL-UHFFFAOYSA-N 0 0 366.373 3.665 20 5 FHBDRN CC(C)[C@@H](c1nc(CCNc2ccccc2[N+](=O)[O-])no1)c1cccnc1 ZINC000580002696 929794994 /nfs/dbraw/zinc/79/49/94/929794994.db2.gz KTSJAGBNWAQRGV-GOSISDBHSA-N 0 0 367.409 3.815 20 5 FHBDRN COc1ccc(CC(=O)N[C@@H](Cc2ccc(F)cc2)C(C)C)cc1[N+](=O)[O-] ZINC000610311061 929811051 /nfs/dbraw/zinc/81/10/51/929811051.db2.gz NLWFHPOFHOHZSU-KRWDZBQOSA-N 0 0 374.412 3.669 20 5 FHBDRN CCc1nnc(-c2ccc(NC(=O)c3cc(C)cc([N+](=O)[O-])c3)cc2)o1 ZINC000175790701 929825845 /nfs/dbraw/zinc/82/58/45/929825845.db2.gz ASJBUGCCWSPOPL-UHFFFAOYSA-N 0 0 352.350 3.768 20 5 FHBDRN CCN(C(=O)c1ccc([N+](=O)[O-])cc1C)[C@H](COC)Cc1ccccc1 ZINC000471476367 929874138 /nfs/dbraw/zinc/87/41/38/929874138.db2.gz OGCWVXXWJVZAOH-SFHVURJKSA-N 0 0 356.422 3.623 20 5 FHBDRN COc1ccc(C(=O)N2CC[C@H](Cc3ccccc3)[C@H]2C)cc1[N+](=O)[O-] ZINC000471477765 929877085 /nfs/dbraw/zinc/87/70/85/929877085.db2.gz VSVAVLATLNRKGK-GDBMZVCRSA-N 0 0 354.406 3.697 20 5 FHBDRN CC1(C)[C@H](NC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)[C@@H]2CCCO[C@@H]21 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/nfs/dbraw/zinc/48/16/94/931481694.db2.gz XKTQRJRGKAZGJR-INIZCTEOSA-N 0 0 371.821 3.738 20 5 FHBDRN COc1cccc(-c2nc(-c3cccc(-n4ccnc4)c3)no2)c1[N+](=O)[O-] ZINC000581037504 931510670 /nfs/dbraw/zinc/51/06/70/931510670.db2.gz LMDASWKYJXAIDF-UHFFFAOYSA-N 0 0 363.333 3.506 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1CN1CCCC[C@@H]1c1noc(CC)n1 ZINC000610476226 931540214 /nfs/dbraw/zinc/54/02/14/931540214.db2.gz HQQLKZBKSDKDCF-OAHLLOKOSA-N 0 0 360.414 3.666 20 5 FHBDRN CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@H]3CN2c1ccc([N+](=O)[O-])c(-c2ccccc2)n1 ZINC000581074216 931541051 /nfs/dbraw/zinc/54/10/51/931541051.db2.gz MFDUIEDRHRSIFU-PSYRKBHYSA-N 0 0 351.406 3.516 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CC(C)(C)CCc3ccccc32)n1 ZINC000581079383 931544761 /nfs/dbraw/zinc/54/47/61/931544761.db2.gz DUHXGWJALDHIMT-OAHLLOKOSA-N 0 0 356.426 3.645 20 5 FHBDRN CCn1c(C)nc([N+](=O)[O-])c1NCc1ccc(NC(=O)c2ccco2)cc1 ZINC000581095098 931556966 /nfs/dbraw/zinc/55/69/66/931556966.db2.gz XTCLXBUCPBLUIR-UHFFFAOYSA-N 0 0 369.381 3.577 20 5 FHBDRN O=C(NCCc1c[nH]c2cc(F)ccc12)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000050767112 931609020 /nfs/dbraw/zinc/60/90/20/931609020.db2.gz BZCYGGNLJLKHES-UHFFFAOYSA-N 0 0 361.760 3.841 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)NCc2ccc(-c3csc(C)n3)o2)c1 ZINC000146225734 931642189 /nfs/dbraw/zinc/64/21/89/931642189.db2.gz SBFMFDCTCVNQLP-UHFFFAOYSA-N 0 0 373.390 3.558 20 5 FHBDRN O=C(Nc1cccc(OCC(F)(F)F)c1)c1cc([N+](=O)[O-])ccc1F ZINC000247330323 931704726 /nfs/dbraw/zinc/70/47/26/931704726.db2.gz OUARIVZMEGRRLZ-UHFFFAOYSA-N 0 0 358.247 3.927 20 5 FHBDRN CCON(C(=O)c1ccc(N2C[C@H](C)C[C@@H](C)C2)c([N+](=O)[O-])c1)C(C)C ZINC001143390030 931721853 /nfs/dbraw/zinc/72/18/53/931721853.db2.gz KQMOWFWBUFNZQW-HUUCEWRRSA-N 0 0 363.458 3.879 20 5 FHBDRN CN(C[C@@H]1CCCO[C@H]1c1ccccc1)C(=O)c1cccc([N+](=O)[O-])c1 ZINC000050866436 931759066 /nfs/dbraw/zinc/75/90/66/931759066.db2.gz VCNWUDAZYQIXSH-HKUYNNGSSA-N 0 0 354.406 3.835 20 5 FHBDRN CSc1ccc(C(=O)N2CCO[C@](C)(c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000157012229 931774539 /nfs/dbraw/zinc/77/45/39/931774539.db2.gz PPCWAIORGJRSEJ-IBGZPJMESA-N 0 0 372.446 3.705 20 5 FHBDRN COc1cc(-c2nc(-c3cccc4[nH]c(C)nc43)no2)cc([N+](=O)[O-])c1C ZINC000581276870 931775293 /nfs/dbraw/zinc/77/52/93/931775293.db2.gz GNEHJCATKLRQLK-UHFFFAOYSA-N 0 0 365.349 3.814 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])N[C@H]1CCCN(c2ccccc2Cl)C1 ZINC000126393597 931797087 /nfs/dbraw/zinc/79/70/87/931797087.db2.gz HEVDOOQKGZRHKV-HNNXBMFYSA-N 0 0 373.840 3.576 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@H](c1nc(C)cs1)C1CC1 ZINC000156136634 931825501 /nfs/dbraw/zinc/82/55/01/931825501.db2.gz RONVUDCVOAFSTP-AWEZNQCLSA-N 0 0 362.411 3.641 20 5 FHBDRN COc1cccc(-c2nc([C@@H](OC)c3ccc(F)cc3)no2)c1[N+](=O)[O-] ZINC000581335953 931855555 /nfs/dbraw/zinc/85/55/55/931855555.db2.gz LTWWJVJDIANGAP-HNNXBMFYSA-N 0 0 359.313 3.528 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)Nc1cccc(OC[C@@H]2CCCO2)c1 ZINC000043728393 931873535 /nfs/dbraw/zinc/87/35/35/931873535.db2.gz UMJRPCUGENLKOQ-KRWDZBQOSA-N 0 0 357.366 3.797 20 5 FHBDRN CCCCn1nccc1NC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000157121112 931884050 /nfs/dbraw/zinc/88/40/50/931884050.db2.gz SIOGMUDJUCFSQK-UHFFFAOYSA-N 0 0 367.203 3.606 20 5 FHBDRN Cc1nn(C(C)(C)C)cc1[C@H](C)NC(=O)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000156162655 931887641 /nfs/dbraw/zinc/88/76/41/931887641.db2.gz GKGPXYFGNBHPPR-VIFPVBQESA-N 0 0 366.368 3.624 20 5 FHBDRN O=C(c1ccn(-c2ccccc2[N+](=O)[O-])n1)N(Cc1cccs1)C1CC1 ZINC000135101829 931925213 /nfs/dbraw/zinc/92/52/13/931925213.db2.gz WTOXOCCKSOIVGE-UHFFFAOYSA-N 0 0 368.418 3.647 20 5 FHBDRN Cc1ccc(C(=O)OCC(=O)Nc2ccc3ccccc3c2)cc1[N+](=O)[O-] ZINC000003387369 931986399 /nfs/dbraw/zinc/98/63/99/931986399.db2.gz BFZNJZPQLAMZPP-UHFFFAOYSA-N 0 0 364.357 3.852 20 5 FHBDRN CC1(C)[C@@H](C(F)(F)F)CCN1C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000276179399 932003637 /nfs/dbraw/zinc/00/36/37/932003637.db2.gz IQNNEQFSIWWIIX-LBPRGKRZSA-N 0 0 355.316 3.879 20 5 FHBDRN COc1ccc(NC(=O)[C@@H](C)N2CC[C@H]2c2cccc(F)c2)c([N+](=O)[O-])c1 ZINC000610505305 932016331 /nfs/dbraw/zinc/01/63/31/932016331.db2.gz GHVQNPVLEUNBSC-PXAZEXFGSA-N 0 0 373.384 3.517 20 5 FHBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1cnc2ccccc2n1 ZINC000430600287 932046649 /nfs/dbraw/zinc/04/66/49/932046649.db2.gz HEYMYYGJUPYOKJ-JTQLQIEISA-N 0 0 372.768 3.597 20 5 FHBDRN CCOc1ccc(C(=O)N2CC[C@H](Cc3ccc(F)cc3)C2)cc1[N+](=O)[O-] ZINC000135195564 932047464 /nfs/dbraw/zinc/04/74/64/932047464.db2.gz RUYWROFNVXCXPY-OAHLLOKOSA-N 0 0 372.396 3.837 20 5 FHBDRN O=[N+]([O-])c1ccccc1CN(Cc1nc(Cc2ccccc2)no1)C1CC1 ZINC000135218918 932054481 /nfs/dbraw/zinc/05/44/81/932054481.db2.gz PLRPHIGCVNPMRN-UHFFFAOYSA-N 0 0 364.405 3.733 20 5 FHBDRN CC[C@@H](c1ccccc1)[N@H+](CCOc1ccc([N+](=O)[O-])cc1)CC(=O)[O-] ZINC000581440329 932075532 /nfs/dbraw/zinc/07/55/32/932075532.db2.gz DEOHMFBSHPTRJN-SFHVURJKSA-N 0 0 358.394 3.512 20 5 FHBDRN CCc1nc(NC(=O)CN(Cc2ccccc2[N+](=O)[O-])C2CC2)sc1C ZINC000135230275 932076471 /nfs/dbraw/zinc/07/64/71/932076471.db2.gz YLHBMVFUVZAXDR-UHFFFAOYSA-N 0 0 374.466 3.525 20 5 FHBDRN Cc1cccc(N(C)C(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)n1 ZINC000135231712 932079350 /nfs/dbraw/zinc/07/93/50/932079350.db2.gz UGISHAHJCCDXLO-UHFFFAOYSA-N 0 0 354.391 3.698 20 5 FHBDRN O=[N+]([O-])c1ccccc1CN(Cc1noc(-c2ccsc2)n1)C1CC1 ZINC000135234412 932086178 /nfs/dbraw/zinc/08/61/78/932086178.db2.gz DARAAEBNYDOBTB-UHFFFAOYSA-N 0 0 356.407 3.871 20 5 FHBDRN Cc1noc(C)c1[C@H](C)Nc1ncc([N+](=O)[O-])c(C)c1Br ZINC000165788054 932110995 /nfs/dbraw/zinc/11/09/95/932110995.db2.gz GNSJIJQPJZTGSZ-ZETCQYMHSA-N 0 0 355.192 3.839 20 5 FHBDRN O=C(Cc1cc(Br)ccc1F)Nc1ccc([N+](=O)[O-])cc1 ZINC000119385312 932177826 /nfs/dbraw/zinc/17/78/26/932177826.db2.gz VDZSTHSNIAYHGL-UHFFFAOYSA-N 0 0 353.147 3.678 20 5 FHBDRN COc1c(F)cc(F)cc1NCc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000471671821 932243957 /nfs/dbraw/zinc/24/39/57/932243957.db2.gz QFZMOMXTPGWPCG-UHFFFAOYSA-N 0 0 362.292 3.544 20 5 FHBDRN Cc1cc(C)c(NC(=O)C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c(C)c1 ZINC000178062775 932245275 /nfs/dbraw/zinc/24/52/75/932245275.db2.gz BQTDQJPDEPGBLQ-OAHLLOKOSA-N 0 0 369.421 3.644 20 5 FHBDRN Cc1sc(C(=O)Nc2cc(Br)ccc2O)cc1[N+](=O)[O-] ZINC000126564370 932255366 /nfs/dbraw/zinc/25/53/66/932255366.db2.gz XKADPBYLFXRPFS-UHFFFAOYSA-N 0 0 357.185 3.685 20 5 FHBDRN O=C(N[C@@H]1CCc2cc(F)ccc21)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000126602110 932265649 /nfs/dbraw/zinc/26/56/49/932265649.db2.gz BNGAWNCEPDCZAB-MRXNPFEDSA-N 0 0 351.337 3.699 20 5 FHBDRN COc1ccc(COC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)cc1F ZINC000781712350 932279575 /nfs/dbraw/zinc/27/95/75/932279575.db2.gz GJWSYCCGVQFGTC-UHFFFAOYSA-N 0 0 371.267 3.701 20 5 FHBDRN Cc1c(NC(=O)N2CCOCC[C@@H]2C)cc([N+](=O)[O-])cc1C(F)(F)F ZINC000933344095 932361400 /nfs/dbraw/zinc/36/14/00/932361400.db2.gz WXOBWLCFONUVEZ-VIFPVBQESA-N 0 0 361.320 3.565 20 5 FHBDRN Cc1c(NC(=O)NC2(C)CCOCC2)cc([N+](=O)[O-])cc1C(F)(F)F ZINC000933344097 932361636 /nfs/dbraw/zinc/36/16/36/932361636.db2.gz XBPGSJJOBCUKGP-UHFFFAOYSA-N 0 0 361.320 3.613 20 5 FHBDRN CCc1cc(NC(=O)[C@@H](C)Cc2ccco2)c2cc([N+](=O)[O-])ccc2n1 ZINC001266777432 932363693 /nfs/dbraw/zinc/36/36/93/932363693.db2.gz PWNPZIXSPRWQOV-LBPRGKRZSA-N 0 0 353.378 3.538 20 5 FHBDRN CC1(C)[C@H](C(F)(F)F)CCN1C(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000276421386 932381107 /nfs/dbraw/zinc/38/11/07/932381107.db2.gz ZLGIEAVRRKKMRE-CYBMUJFWSA-N 0 0 360.332 3.553 20 5 FHBDRN COc1ccccc1[C@H]1CCCCN1C(=O)c1cccc([N+](=O)[O-])c1N ZINC000610521361 932385282 /nfs/dbraw/zinc/38/52/82/932385282.db2.gz GELJSUPXZVSQGZ-OAHLLOKOSA-N 0 0 355.394 3.553 20 5 FHBDRN COc1ccc([C@@H]2CCN(C(=O)Nc3ccc(C)c([N+](=O)[O-])c3)C2)cc1 ZINC000157850805 932412493 /nfs/dbraw/zinc/41/24/93/932412493.db2.gz XEFASTSSENGURV-OAHLLOKOSA-N 0 0 355.394 3.933 20 5 FHBDRN CSc1cc(O)ccc1NC(=O)c1cccc(SC)c1[N+](=O)[O-] ZINC000754731849 932421240 /nfs/dbraw/zinc/42/12/40/932421240.db2.gz HKEHQEUESMDOMQ-UHFFFAOYSA-N 0 0 350.421 3.997 20 5 FHBDRN C[C@H](NC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)c1c(F)cccc1Cl ZINC000477249548 932432876 /nfs/dbraw/zinc/43/28/76/932432876.db2.gz HACXSZBHYJULQI-QMMMGPOBSA-N 0 0 362.748 3.755 20 5 FHBDRN CC(C)C[C@H]1OCCC[C@H]1NC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000477299875 932456725 /nfs/dbraw/zinc/45/67/25/932456725.db2.gz WUNVMWBPHJETKC-HUUCEWRRSA-N 0 0 374.359 3.937 20 5 FHBDRN Cc1sc(S(=O)(=O)N(C)[C@H](C)Cc2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000467081024 932459251 /nfs/dbraw/zinc/45/92/51/932459251.db2.gz KKRLJLCJGZQBKI-GFCCVEGCSA-N 0 0 368.480 3.525 20 5 FHBDRN CC(C)c1nnc([C@@H](C)NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]1 ZINC000477311405 932464177 /nfs/dbraw/zinc/46/41/77/932464177.db2.gz UHFPKKXWVIHXHG-SECBINFHSA-N 0 0 359.411 3.542 20 5 FHBDRN Cc1noc(C)c1CC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)c(C)s1 ZINC000097206911 932510784 /nfs/dbraw/zinc/51/07/84/932510784.db2.gz IHVMFQFBXIIDLE-UHFFFAOYSA-N 0 0 372.406 3.813 20 5 FHBDRN C[C@H](SCC(=O)NCc1ccc([N+](=O)[O-])cc1)c1nc2ccccc2[nH]1 ZINC000097207010 932511459 /nfs/dbraw/zinc/51/14/59/932511459.db2.gz WGLIIAAAHPDXON-LBPRGKRZSA-N 0 0 370.434 3.582 20 5 FHBDRN CCS[C@@H]1CCC[C@@H]1NC(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000178109378 932513481 /nfs/dbraw/zinc/51/34/81/932513481.db2.gz OIWKNGUVNNACPC-BYCMXARLSA-N 0 0 354.497 3.866 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H](C)c1ccncc1 ZINC000610530414 932520180 /nfs/dbraw/zinc/52/01/80/932520180.db2.gz LQRSTBHPDQIPGM-HNNXBMFYSA-N 0 0 356.426 3.714 20 5 FHBDRN CC(C)(C)[C@@H](NC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1)c1cccc(F)c1 ZINC000178104050 932523458 /nfs/dbraw/zinc/52/34/58/932523458.db2.gz XGBZWRDNGXRJPX-INIZCTEOSA-N 0 0 373.384 3.576 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H](C)c1nc2ccccc2[nH]1 ZINC000439905457 945070312 /nfs/dbraw/zinc/07/03/12/945070312.db2.gz VZOXZSXXFCJEAD-NSHDSACASA-N 0 0 369.381 3.753 20 5 FHBDRN CCOc1ccc(C(=O)N2CCC[C@H](C(F)(F)F)[C@@H]2C)cc1[N+](=O)[O-] ZINC000477421715 932575005 /nfs/dbraw/zinc/57/50/05/932575005.db2.gz SLEZQQVIKDPCCC-JQWIXIFHSA-N 0 0 360.332 3.797 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N(C)CCOCc1ccccc1 ZINC000477429027 932576799 /nfs/dbraw/zinc/57/67/99/932576799.db2.gz UKPDMWQACDWAHL-UHFFFAOYSA-N 0 0 362.813 3.845 20 5 FHBDRN Cc1ccc(-c2noc(-c3ccc(O[C@H]4CCOC4)cc3)n2)cc1[N+](=O)[O-] ZINC000581751465 932597709 /nfs/dbraw/zinc/59/77/09/932597709.db2.gz ABQQIVAZLPMAFN-INIZCTEOSA-N 0 0 367.361 3.788 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1F)N1CCCc2cc(F)c(F)cc21 ZINC000477451676 932616756 /nfs/dbraw/zinc/61/67/56/932616756.db2.gz XJYLHDZSDSXMIM-UHFFFAOYSA-N 0 0 350.296 3.534 20 5 FHBDRN Cc1ccc(C)c([C@@H](C)NC(=O)[C@H]2CC(c3ccccc3[N+](=O)[O-])=NO2)c1 ZINC001266815798 932618725 /nfs/dbraw/zinc/61/87/25/932618725.db2.gz GAAWODATDXZOAV-AUUYWEPGSA-N 0 0 367.405 3.582 20 5 FHBDRN Cc1ccc(C)c([C@@H](C)NC(=O)[C@@H]2CC(c3ccccc3[N+](=O)[O-])=NO2)c1 ZINC001266815799 932619175 /nfs/dbraw/zinc/61/91/75/932619175.db2.gz GAAWODATDXZOAV-KUHUBIRLSA-N 0 0 367.405 3.582 20 5 FHBDRN C[C@@H](C(=O)NCc1ccc(OC(F)(F)F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000581763060 932630091 /nfs/dbraw/zinc/63/00/91/932630091.db2.gz ODQCGQTWTLUUSG-LLVKDONJSA-N 0 0 368.311 3.913 20 5 FHBDRN Cc1ncsc1CCOC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000176023518 932641496 /nfs/dbraw/zinc/64/14/96/932641496.db2.gz RGGSBWCGPVKMCF-UHFFFAOYSA-N 0 0 371.212 3.522 20 5 FHBDRN CC(C)(C)c1ccc(NC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)cc1 ZINC000109983183 932645005 /nfs/dbraw/zinc/64/50/05/932645005.db2.gz LVQAXVCUYYERQI-UHFFFAOYSA-N 0 0 365.389 3.986 20 5 FHBDRN CC[C@@H](OC1CCCCC1)C(=O)Nc1ccnn1-c1ccc([N+](=O)[O-])cc1 ZINC000471699507 932648136 /nfs/dbraw/zinc/64/81/36/932648136.db2.gz ZKYJXMGMHQGLJO-QGZVFWFLSA-N 0 0 372.425 3.847 20 5 FHBDRN COCCCOc1cc(C)ccc1CNC(=O)c1cccc(C)c1[N+](=O)[O-] ZINC000127299683 932656122 /nfs/dbraw/zinc/65/61/22/932656122.db2.gz OOSYYNJGNSXIQW-UHFFFAOYSA-N 0 0 372.421 3.557 20 5 FHBDRN CC1(C)[C@@H](NC(=O)c2ccc(F)cc2[N+](=O)[O-])C[C@@H]1OCc1ccccc1 ZINC000471710572 932681956 /nfs/dbraw/zinc/68/19/56/932681956.db2.gz CCKZBTKKJXPRSX-ROUUACIJSA-N 0 0 372.396 3.848 20 5 FHBDRN Cc1ccc(C[C@@H](C)NC(=O)N(C)CCc2ccccc2[N+](=O)[O-])s1 ZINC000561567358 932696743 /nfs/dbraw/zinc/69/67/43/932696743.db2.gz GIRUHDZFIUKQFX-CYBMUJFWSA-N 0 0 361.467 3.780 20 5 FHBDRN CCn1c(-c2ccc([N+](=O)[O-])cc2)nn(CN2C[C@@H]3[C@H](C2)C3(C)C)c1=S ZINC000178152968 932696747 /nfs/dbraw/zinc/69/67/47/932696747.db2.gz PNYXSIGJOZYJCV-GASCZTMLSA-N 0 0 373.482 3.554 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1)N1CC[C@@](F)(c2cc(F)cc(F)c2)C1 ZINC000581839667 932719996 /nfs/dbraw/zinc/71/99/96/932719996.db2.gz SPAQYGORCCPUNB-KRWDZBQOSA-N 0 0 350.296 3.584 20 5 FHBDRN C[C@H](c1ccc([S@](C)=O)cc1)N(C)C(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000581858805 932752049 /nfs/dbraw/zinc/75/20/49/932752049.db2.gz VXMGCZQGFIEFOJ-BGPVNYDRSA-N 0 0 374.462 3.655 20 5 FHBDRN Cc1cc(C)c(NC(=O)COC(=O)c2cccc([N+](=O)[O-])c2C)c(C)c1 ZINC000003444675 932757632 /nfs/dbraw/zinc/75/76/32/932757632.db2.gz GVQZPJDPBZFARV-UHFFFAOYSA-N 0 0 356.378 3.624 20 5 FHBDRN CC1(C)[C@H](NC(=O)c2ccccc2[N+](=O)[O-])C[C@@H]1OCc1ccccc1 ZINC000187435338 932776505 /nfs/dbraw/zinc/77/65/05/932776505.db2.gz GGDDTXFMQFTNEA-MSOLQXFVSA-N 0 0 354.406 3.709 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)Nc2cccc(-c3nccn3C)c2)c1 ZINC000065011537 932807623 /nfs/dbraw/zinc/80/76/23/932807623.db2.gz KTOISPJGARAIDT-UHFFFAOYSA-N 0 0 368.418 3.970 20 5 FHBDRN CC[C@H](OC(=O)c1cc(C)cc(C(=O)OC)c1)c1cccc([N+](=O)[O-])c1 ZINC001266835845 932811290 /nfs/dbraw/zinc/81/12/90/932811290.db2.gz SHGIONFQJSDRCT-KRWDZBQOSA-N 0 0 357.362 3.998 20 5 FHBDRN COc1ccc(CNC(=O)c2sc(C)cc2OC(F)F)cc1[N+](=O)[O-] ZINC000510473561 932851802 /nfs/dbraw/zinc/85/18/02/932851802.db2.gz QRZQNXHQLSESIQ-UHFFFAOYSA-N 0 0 372.349 3.505 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC1(c2noc(C)n2)CCCCCC1 ZINC000101546221 932866615 /nfs/dbraw/zinc/86/66/15/932866615.db2.gz AOVCLVDWFTZFNH-UHFFFAOYSA-N 0 0 360.414 3.634 20 5 FHBDRN CC(C)N(Cc1csc([N+](=O)[O-])c1)c1ccc(N2CCOCC2)cc1 ZINC000101559321 932895963 /nfs/dbraw/zinc/89/59/63/932895963.db2.gz MZSPSRHCPDWWNN-UHFFFAOYSA-N 0 0 361.467 3.908 20 5 FHBDRN CCCCN(C)C(=O)C1CCN(c2nc3ccccc3cc2[N+](=O)[O-])CC1 ZINC000276676569 932902286 /nfs/dbraw/zinc/90/22/86/932902286.db2.gz UMGXMTQMCMARRR-UHFFFAOYSA-N 0 0 370.453 3.618 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc([N+](=O)[O-])c(F)cc1F ZINC000588436390 932948869 /nfs/dbraw/zinc/94/88/69/932948869.db2.gz UULQBSJKWZCHJY-TWGQIWQCSA-N 0 0 363.276 3.823 20 5 FHBDRN COCCOc1ccc(NC(=O)/C(C)=C\c2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000588437161 932963240 /nfs/dbraw/zinc/96/32/40/932963240.db2.gz WNEHOJBURXSIQV-QINSGFPZSA-N 0 0 370.405 3.970 20 5 FHBDRN O=c1c2cc3ccccc3cc2ncn1C[C@H](O)c1ccccc1Cl ZINC000051288493 932968729 /nfs/dbraw/zinc/96/87/29/932968729.db2.gz MOONJTKQMFVXFT-IBGZPJMESA-N 0 0 350.805 3.937 20 5 FHBDRN Cc1noc(C)c1C(C)(C)C(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000430691824 933003101 /nfs/dbraw/zinc/00/31/01/933003101.db2.gz KHJQUGDOSFMFMU-UHFFFAOYSA-N 0 0 359.426 3.616 20 5 FHBDRN CC(=O)N(c1nc(CNC(C)(C)c2ccc([N+](=O)[O-])cc2)cs1)C1CC1 ZINC000175985331 933011873 /nfs/dbraw/zinc/01/18/73/933011873.db2.gz ONNCQZAUSJZQAI-UHFFFAOYSA-N 0 0 374.466 3.592 20 5 FHBDRN O=[N+]([O-])c1ccccc1OCc1nc(-c2ccc(Br)o2)no1 ZINC000178273282 933019866 /nfs/dbraw/zinc/01/98/66/933019866.db2.gz IGNCNDCUNKMZEJ-UHFFFAOYSA-N 0 0 366.127 3.579 20 5 FHBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)OCc1ccc(Br)cn1 ZINC000255388606 933027311 /nfs/dbraw/zinc/02/73/11/933027311.db2.gz OMFNKOBDQJAXDN-BAQGIRSFSA-N 0 0 363.167 3.509 20 5 FHBDRN CC[C@H](NC(=O)NCc1ccc(OC)c([N+](=O)[O-])c1)c1ccc(C)cc1 ZINC000510495429 933035137 /nfs/dbraw/zinc/03/51/37/933035137.db2.gz DGGPYFHOKDQZHW-INIZCTEOSA-N 0 0 357.410 3.862 20 5 FHBDRN CN(CC(=O)Nc1cc(Cl)ccc1Cl)Cc1ccccc1[N+](=O)[O-] ZINC000043784073 933036049 /nfs/dbraw/zinc/03/60/49/933036049.db2.gz MQXLCRHJBKWWDU-UHFFFAOYSA-N 0 0 368.220 3.972 20 5 FHBDRN CC(=Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(-c2n[nH]c(C)n2)cc1 ZINC000588437783 933048460 /nfs/dbraw/zinc/04/84/60/933048460.db2.gz UFGIRCOTQBUWBS-QXMHVHEDSA-N 0 0 363.377 3.730 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N(Cc1ccco1)C[C@@H]1CCCO1 ZINC000588437399 933051123 /nfs/dbraw/zinc/05/11/23/933051123.db2.gz QSNPMQMHBBDPFS-RYBIEJRYSA-N 0 0 370.405 3.799 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc2c(c1)CCCC(=O)N2 ZINC000588438413 933058148 /nfs/dbraw/zinc/05/81/48/933058148.db2.gz DDDGKKWKFYEQET-QBFSEMIESA-N 0 0 365.389 3.912 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(-c2ncon2)cc1 ZINC000588438509 933058875 /nfs/dbraw/zinc/05/88/75/933058875.db2.gz LRRQBCUNTOOGPM-BENRWUELSA-N 0 0 350.334 3.687 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(O[C@H]2CCOC2)cc1 ZINC000588440710 933071175 /nfs/dbraw/zinc/07/11/75/933071175.db2.gz BCJGWFFYKAECAG-IFMUVIIVSA-N 0 0 368.389 3.805 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(O[C@@H]2CCOC2)cc1 ZINC000588440714 933071517 /nfs/dbraw/zinc/07/15/17/933071517.db2.gz BCJGWFFYKAECAG-LUQQZNFBSA-N 0 0 368.389 3.805 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCC(Oc3ccc(F)nc3)CC2)c2ccncc21 ZINC000276729466 933083001 /nfs/dbraw/zinc/08/30/01/933083001.db2.gz LGXQBQOCFAQWTF-UHFFFAOYSA-N 0 0 368.368 3.725 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccnc1-n1ccnc1C ZINC000588444509 933102413 /nfs/dbraw/zinc/10/24/13/933102413.db2.gz PWDLYDUSLQSTNT-SEYXRHQNSA-N 0 0 363.377 3.526 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)NCCc1csc(C(C)C)n1 ZINC000588445053 933107532 /nfs/dbraw/zinc/10/75/32/933107532.db2.gz IGVPMJPPJWCKKW-RAXLEYEMSA-N 0 0 359.451 3.937 20 5 FHBDRN CC1(NC(=O)Cc2ccc([N+](=O)[O-])cc2Br)CCCCC1 ZINC000176011806 933117208 /nfs/dbraw/zinc/11/72/08/933117208.db2.gz QRICSNNSOSBODI-UHFFFAOYSA-N 0 0 355.232 3.739 20 5 FHBDRN Cc1cc(OCC(=O)Nc2ccc(F)cc2OCC2CC2)ccc1[N+](=O)[O-] ZINC000430703538 933121918 /nfs/dbraw/zinc/12/19/18/933121918.db2.gz URVZMHWHXXFQDX-UHFFFAOYSA-N 0 0 374.368 3.849 20 5 FHBDRN COC(=O)[C@@H]1CCC[C@@H](C(=O)N(c2cccc([N+](=O)[O-])c2)C2CCCC2)C1 ZINC000610570947 933125104 /nfs/dbraw/zinc/12/51/04/933125104.db2.gz QITKXODBJRNKKU-HUUCEWRRSA-N 0 0 374.437 3.850 20 5 FHBDRN CC(=Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H](C)CC(=O)c1ccccc1 ZINC000588446615 933158972 /nfs/dbraw/zinc/15/89/72/933158972.db2.gz CMBKOZRQUHUYPM-ZSMUJPCHSA-N 0 0 352.390 3.776 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N[C@H](C)C[C@@H](O)c1ccc(F)cc1 ZINC000588446896 933163690 /nfs/dbraw/zinc/16/36/90/933163690.db2.gz STASEOVLRNPODT-QLZVHELBSA-N 0 0 372.396 3.766 20 5 FHBDRN Cc1cc(OCC(=O)N2CC[C@@H](C)C[C@@H]2c2ccco2)ccc1[N+](=O)[O-] ZINC000430711674 933165186 /nfs/dbraw/zinc/16/51/86/933165186.db2.gz AZZZCTJJPCSMJZ-CXAGYDPISA-N 0 0 358.394 3.875 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N([C@@H](C)c1ccccc1)C1CC1 ZINC000510509047 933165196 /nfs/dbraw/zinc/16/51/96/933165196.db2.gz TXPCRBJXIINWNM-AWEZNQCLSA-N 0 0 360.435 3.818 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)NCC1([C@@H](O)c2ccccc2)CC1 ZINC000588447291 933169782 /nfs/dbraw/zinc/16/97/82/933169782.db2.gz LNDNOLMTEJHVOV-ZDRDQBANSA-N 0 0 366.417 3.628 20 5 FHBDRN Cc1cc(OCC(=O)N2c3ccccc3SC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000430782402 933235545 /nfs/dbraw/zinc/23/55/45/933235545.db2.gz IMENIICQVUZRAV-ZDUSSCGKSA-N 0 0 358.419 3.809 20 5 FHBDRN Cc1cc(OCC(=O)N[C@H](C2CCCC2)C(F)(F)F)ccc1[N+](=O)[O-] ZINC000430783816 933235772 /nfs/dbraw/zinc/23/57/72/933235772.db2.gz OAQBHISIBDWYDY-OAHLLOKOSA-N 0 0 360.332 3.519 20 5 FHBDRN Cc1cc(OCC(=O)N[C@@H](C2CCCC2)C(F)(F)F)ccc1[N+](=O)[O-] ZINC000430783815 933235917 /nfs/dbraw/zinc/23/59/17/933235917.db2.gz OAQBHISIBDWYDY-HNNXBMFYSA-N 0 0 360.332 3.519 20 5 FHBDRN COC(=O)c1cc(NC(=O)[C@H]2[C@H](c3ccccc3)[C@@H]2C)c(C)c([N+](=O)[O-])c1 ZINC000430800796 933237509 /nfs/dbraw/zinc/23/75/09/933237509.db2.gz UYDCEXZDYWFBCP-UYHISHBKSA-N 0 0 368.389 3.678 20 5 FHBDRN COc1ccc(N(C)C(=O)COc2ccc([N+](=O)[O-])c(C)c2)cc1Cl ZINC000430793045 933241702 /nfs/dbraw/zinc/24/17/02/933241702.db2.gz USWRZDGRTWFGOW-UHFFFAOYSA-N 0 0 364.785 3.607 20 5 FHBDRN C[C@H](CC(=O)c1ccc(F)cc1)NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000127353188 933251089 /nfs/dbraw/zinc/25/10/89/933251089.db2.gz VLVIWIXEYGOZIG-SNVBAGLBSA-N 0 0 364.760 3.779 20 5 FHBDRN CN(Cc1nc(-c2cccs2)no1)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000510588360 933251139 /nfs/dbraw/zinc/25/11/39/933251139.db2.gz BKBALTRJPVRFRX-UHFFFAOYSA-N 0 0 364.814 3.992 20 5 FHBDRN CCO[C@H]1C[C@H](N(C)C(=O)c2ccc(SC)c([N+](=O)[O-])c2)C1(C)C ZINC000127356985 933252706 /nfs/dbraw/zinc/25/27/06/933252706.db2.gz HMCYTRHMSUULGF-GJZGRUSLSA-N 0 0 352.456 3.592 20 5 FHBDRN O=[N+]([O-])c1cc(F)c(CN2CCC(F)(c3cccnc3)CC2)c(F)c1 ZINC000510590927 933254223 /nfs/dbraw/zinc/25/42/23/933254223.db2.gz KYAXZSWCSPYCQG-UHFFFAOYSA-N 0 0 351.328 3.729 20 5 FHBDRN CSc1ccccc1CN(C)C(=O)COc1ccc([N+](=O)[O-])c(C)c1 ZINC000430820173 933260458 /nfs/dbraw/zinc/26/04/58/933260458.db2.gz JPBRBPSUIGJOSA-UHFFFAOYSA-N 0 0 360.435 3.663 20 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FHBDRN COc1ccc(CCCN(C)C(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)cc1 ZINC000535680727 934273227 /nfs/dbraw/zinc/27/32/27/934273227.db2.gz LHRVECZFOGYRRU-UHFFFAOYSA-N 0 0 367.405 3.790 20 5 FHBDRN Cc1c(CC(=O)NC2(c3ccc(F)cc3F)CCC2)cccc1[N+](=O)[O-] ZINC000535683850 934277926 /nfs/dbraw/zinc/27/79/26/934277926.db2.gz PIGRVEFKELUCLJ-UHFFFAOYSA-N 0 0 360.360 3.920 20 5 FHBDRN CCN(CCCNC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12)c1ccccc1 ZINC000535693786 934288266 /nfs/dbraw/zinc/28/82/66/934288266.db2.gz JGWVQUSQVIPJSJ-UHFFFAOYSA-N 0 0 366.421 3.723 20 5 FHBDRN CNc1ccc(C(=O)NC2(c3ccc(F)cc3F)CCC2)cc1[N+](=O)[O-] ZINC000535695017 934288922 /nfs/dbraw/zinc/28/89/22/934288922.db2.gz OTICDRKYXZLOND-UHFFFAOYSA-N 0 0 361.348 3.724 20 5 FHBDRN COc1ccc(Cl)cc1CC(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000512966095 934336063 /nfs/dbraw/zinc/33/60/63/934336063.db2.gz GCKOCYYQGQNMJE-UHFFFAOYSA-N 0 0 362.813 3.500 20 5 FHBDRN C[C@@H](NC(=O)c1cc([N+](=O)[O-])cn1C)[C@@H](C)c1ccccc1C(F)(F)F ZINC000535748573 934338184 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359.195 3.757 20 5 FHBDRN Cc1cc(NC(=O)c2cccc(C)c2F)n(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000119468504 934826216 /nfs/dbraw/zinc/82/62/16/934826216.db2.gz UVKQTASAWOUOPS-UHFFFAOYSA-N 0 0 354.341 3.789 20 5 FHBDRN COc1ccc(C)cc1CN[C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000611560391 934826444 /nfs/dbraw/zinc/82/64/44/934826444.db2.gz QNBCUUOXYJNXKL-IBGZPJMESA-N 0 0 366.421 3.525 20 5 FHBDRN O=C(c1csc([N+](=O)[O-])c1)N1CC=C(c2c(F)cccc2F)CC1 ZINC000472014862 934830599 /nfs/dbraw/zinc/83/05/99/934830599.db2.gz YGQHNCIMZHGTRY-UHFFFAOYSA-N 0 0 350.346 3.864 20 5 FHBDRN CCc1ccc(C(=O)NC[C@@H]2CCN(c3ccc(F)cc3)C2)cc1[N+](=O)[O-] ZINC000472014932 934830787 /nfs/dbraw/zinc/83/07/87/934830787.db2.gz ZBTPADLBZJZXRS-AWEZNQCLSA-N 0 0 371.412 3.553 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N1CC=C(c2c(F)cccc2F)CC1 ZINC000472016278 934831050 /nfs/dbraw/zinc/83/10/50/934831050.db2.gz GFEPOMLZCHXIDA-UHFFFAOYSA-N 0 0 374.343 3.568 20 5 FHBDRN Cc1ncc(CN(C)c2cc(C)nc(-c3ccc([N+](=O)[O-])cc3)n2)s1 ZINC000060860323 934838213 /nfs/dbraw/zinc/83/82/13/934838213.db2.gz PJCIFHRXLXAWBJ-UHFFFAOYSA-N 0 0 355.423 3.762 20 5 FHBDRN CC1(C)CC[C@@H]2C[C@@H](NC(=O)CCn3cc([N+](=O)[O-])cn3)c3cccc1c32 ZINC000538434411 934849582 /nfs/dbraw/zinc/84/95/82/934849582.db2.gz JPTILRBWAIIXKE-CXAGYDPISA-N 0 0 368.437 3.598 20 5 FHBDRN CC(C)(C)[C@H]1CCc2nc(NC(=O)c3ccc([N+](=O)[O-])cn3)sc2C1 ZINC000538696043 934889574 /nfs/dbraw/zinc/88/95/74/934889574.db2.gz AUFXDLRXCJELDQ-JTQLQIEISA-N 0 0 360.439 3.850 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)N1CCCCC[C@@H]1CC(=O)c1ccco1 ZINC000434255227 934936870 /nfs/dbraw/zinc/93/68/70/934936870.db2.gz UEVUCWQMUYYSBR-CQSZACIVSA-N 0 0 371.393 3.549 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)O[C@@H]2CCc3cccnc32)cc1SC ZINC000277312834 934937391 /nfs/dbraw/zinc/93/73/91/934937391.db2.gz WTUBJTOOGMJETL-CYBMUJFWSA-N 0 0 360.391 3.565 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1F)Nc1ccc(Br)cc1 ZINC000121717923 934941068 /nfs/dbraw/zinc/94/10/68/934941068.db2.gz YHWWUELHQVWMKS-UHFFFAOYSA-N 0 0 353.147 3.678 20 5 FHBDRN Cc1cnn(-c2ccccc2)c1NC(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000119626921 934943191 /nfs/dbraw/zinc/94/31/91/934943191.db2.gz OFFXLJDZWAMRAF-UHFFFAOYSA-N 0 0 350.378 3.660 20 5 FHBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N1CCN(C)[C@H](C)[C@H]1C ZINC000538917603 934948013 /nfs/dbraw/zinc/94/80/13/934948013.db2.gz CLQFDYDAFMINAY-ZIAGYGMSSA-N 0 0 365.499 3.508 20 5 FHBDRN Cc1cnc(C2CCN(Cc3nc4cc([N+](=O)[O-])ccc4o3)CC2)s1 ZINC000277321320 934949203 /nfs/dbraw/zinc/94/92/03/934949203.db2.gz DJUJYFSFQIHLPD-UHFFFAOYSA-N 0 0 358.423 3.881 20 5 FHBDRN C[C@H]1C[C@H](c2ccccc2)N(S(=O)(=O)CCc2ccccc2[N+](=O)[O-])C1 ZINC000511028824 934951048 /nfs/dbraw/zinc/95/10/48/934951048.db2.gz MECJMQGQEHKFDY-HNAYVOBHSA-N 0 0 374.462 3.550 20 5 FHBDRN O=C([C@@H]1C[C@]12CCc1ccccc12)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000178503381 934959809 /nfs/dbraw/zinc/95/98/09/934959809.db2.gz AZVJEOLGFPCERO-UNMCSNQZSA-N 0 0 362.429 3.990 20 5 FHBDRN O=C([C@H]1C[C@]12CCc1ccccc12)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000178503357 934959815 /nfs/dbraw/zinc/95/98/15/934959815.db2.gz AZVJEOLGFPCERO-IRLDBZIGSA-N 0 0 362.429 3.990 20 5 FHBDRN O=C(N[C@@H](c1ccccc1)[C@@H]1CCOC1)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000539002018 934983428 /nfs/dbraw/zinc/98/34/28/934983428.db2.gz ALTGFHNNLKTBMF-KUHUBIRLSA-N 0 0 366.373 3.849 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N[C@H](C)c1nc(C(C)(C)C)no1 ZINC000091985334 934989028 /nfs/dbraw/zinc/98/90/28/934989028.db2.gz NNPNCCMSINMYNG-GFCCVEGCSA-N 0 0 360.414 3.692 20 5 FHBDRN Cn1c(CNc2ccc3cc([N+](=O)[O-])ccc3n2)nc2cc(Cl)ccc21 ZINC000548614014 935010621 /nfs/dbraw/zinc/01/06/21/935010621.db2.gz QFJUYPORYNJMNU-UHFFFAOYSA-N 0 0 367.796 3.717 20 5 FHBDRN C[C@@H]1C[C@H](c2ccc(F)cc2)CN1C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000119687854 935030435 /nfs/dbraw/zinc/03/04/35/935030435.db2.gz INNNGMDNXFDFMS-YPMHNXCESA-N 0 0 368.368 3.628 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1C[C@H](C)C[C@@H]1c1ccccc1 ZINC000511044325 935040440 /nfs/dbraw/zinc/04/04/40/935040440.db2.gz PMROJCZBNNDFLU-CXAGYDPISA-N 0 0 360.435 3.675 20 5 FHBDRN CC(C)c1ccc2c(c1)[C@@H](NC(=O)c1cc3c(cc1[N+](=O)[O-])OCO3)CC2 ZINC000548622749 935043528 /nfs/dbraw/zinc/04/35/28/935043528.db2.gz YLAFEKIQOKIRCP-INIZCTEOSA-N 0 0 368.389 3.864 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CCc2c(cccc2OC)C1 ZINC000439909827 945073217 /nfs/dbraw/zinc/07/32/17/945073217.db2.gz GFCAZMYIILLLJZ-UHFFFAOYSA-N 0 0 371.393 3.592 20 5 FHBDRN C[C@@H](NC(=O)Nc1ccccc1O[C@@H]1CCOC1)c1cccc([N+](=O)[O-])c1 ZINC000119697350 935054838 /nfs/dbraw/zinc/05/48/38/935054838.db2.gz KEZVPZDUGZRLHF-CZUORRHYSA-N 0 0 371.393 3.645 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)Nc2scnc2C2CC2)cc1OC ZINC000536474913 935074403 /nfs/dbraw/zinc/07/44/03/935074403.db2.gz BAROVBYRKNHUDY-UHFFFAOYSA-N 0 0 363.395 3.588 20 5 FHBDRN Cc1sc(S(=O)(=O)N2C[C@H](c3ccccc3)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000124052443 945074774 /nfs/dbraw/zinc/07/47/74/945074774.db2.gz SSZIOBPNFMFEDI-SMDDNHRTSA-N 0 0 366.464 3.531 20 5 FHBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)N[C@@H]1CC[C@@H](c2ccc(F)cc2)C1 ZINC000472126346 935094890 /nfs/dbraw/zinc/09/48/90/935094890.db2.gz OITISVKTVZFFGY-SJLPKXTDSA-N 0 0 371.412 3.912 20 5 FHBDRN Cc1sc(C(=O)N2C[C@@H](c3ccc(F)cc3)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000151932556 935119365 /nfs/dbraw/zinc/11/93/65/935119365.db2.gz NHVYDTKLKMHIEM-BONVTDFDSA-N 0 0 364.398 3.706 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)NCc1c(C)oc2ccccc21 ZINC000467100146 935120802 /nfs/dbraw/zinc/12/08/02/935120802.db2.gz KFECGMAWGREBDV-UHFFFAOYSA-N 0 0 355.350 3.980 20 5 FHBDRN COc1ccc(CNC(=O)C2(c3ccccc3C)CCC2)cc1[N+](=O)[O-] ZINC000472136704 935135612 /nfs/dbraw/zinc/13/56/12/935135612.db2.gz PAXSMCZEAZMTMT-UHFFFAOYSA-N 0 0 354.406 3.650 20 5 FHBDRN COc1ccc(CC(=O)Nc2ccc(-c3ccc[nH]3)cc2)cc1[N+](=O)[O-] ZINC000539322624 935167742 /nfs/dbraw/zinc/16/77/42/935167742.db2.gz DONCNVLMIHYNKV-UHFFFAOYSA-N 0 0 351.362 3.780 20 5 FHBDRN CCOc1cn(-c2ccccc2)nc1C(=O)Oc1cc([N+](=O)[O-])ccc1C ZINC000728466024 935181431 /nfs/dbraw/zinc/18/14/31/935181431.db2.gz CNOHBBRDMQEWEP-UHFFFAOYSA-N 0 0 367.361 3.707 20 5 FHBDRN CC[C@@H](C)C(=O)O[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000023520622 945082038 /nfs/dbraw/zinc/08/20/38/945082038.db2.gz YHSHVZXIPIRQTA-RKDXNWHRSA-N 0 0 362.304 3.530 20 5 FHBDRN C[C@H]1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[S@]1=O ZINC000277445658 935184053 /nfs/dbraw/zinc/18/40/53/935184053.db2.gz JPJVZOKIGICMLC-RKNYENMMSA-N 0 0 364.492 3.666 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CC[C@@H](n3cnc4c3CCCC4)C2)c2ccncc21 ZINC000548661527 935194346 /nfs/dbraw/zinc/19/43/46/935194346.db2.gz HXMLCDUSKBUBRA-CQSZACIVSA-N 0 0 363.421 3.670 20 5 FHBDRN O=C([O-])c1ccc(C[NH2+][C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])cc1 ZINC000263408392 935199142 /nfs/dbraw/zinc/19/91/42/935199142.db2.gz KNUZCZKBQWZHHM-WMZOPIPTSA-N 0 0 354.406 3.794 20 5 FHBDRN O=C(NC[C@@H]1CSCCS1)c1cc2ccccc2c2cccnc12 ZINC000176648040 935214677 /nfs/dbraw/zinc/21/46/77/935214677.db2.gz ZDDQILPMRYMOJH-CQSZACIVSA-N 0 0 354.500 3.966 20 5 FHBDRN COc1ccc(OCC(=O)N(Cc2ccccc2)C(C)(C)C)c([N+](=O)[O-])c1 ZINC000014351112 935214969 /nfs/dbraw/zinc/21/49/69/935214969.db2.gz ONWFLAYENXYRHP-UHFFFAOYSA-N 0 0 372.421 3.810 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1)N1CCC[C@H](c2nc3c(s2)CCCC3)C1 ZINC000119786901 935222858 /nfs/dbraw/zinc/22/28/58/935222858.db2.gz ONZYJMVIJHXACP-AWEZNQCLSA-N 0 0 371.462 3.950 20 5 FHBDRN Cc1ccsc1[C@H]1C[C@H]1C(=O)NCCCNc1ccc(C)cc1[N+](=O)[O-] ZINC000438829060 945085265 /nfs/dbraw/zinc/08/52/65/945085265.db2.gz OSUCKRAAXSVUMY-LSDHHAIUSA-N 0 0 373.478 3.995 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)NCc1ccc2c(n1)CCCC2 ZINC000439913365 945086448 /nfs/dbraw/zinc/08/64/48/945086448.db2.gz WJEUXQGUVKKKPS-UHFFFAOYSA-N 0 0 370.409 3.589 20 5 FHBDRN Cc1ccc(F)cc1NC(=O)[C@@H](C)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000511073384 935256484 /nfs/dbraw/zinc/25/64/84/935256484.db2.gz OWLPWCWGMNQPIO-CQSZACIVSA-N 0 0 359.401 3.544 20 5 FHBDRN Cc1c(NC(=O)NCCCCC(=O)OC(C)(C)C)cccc1[N+](=O)[O-] ZINC000611356902 935257627 /nfs/dbraw/zinc/25/76/27/935257627.db2.gz IPEKFZQHQVBQOK-UHFFFAOYSA-N 0 0 351.403 3.537 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2ncn(Cc3cccc(Br)c3)n2)cc1 ZINC000072066378 935263641 /nfs/dbraw/zinc/26/36/41/935263641.db2.gz UULQNETWQFKUNR-UHFFFAOYSA-N 0 0 359.183 3.664 20 5 FHBDRN O=C(Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1)C12CC3CC(CC(C3)C1)C2 ZINC000072066315 935270903 /nfs/dbraw/zinc/27/09/03/935270903.db2.gz IAOSUUUUSHNVMF-UHFFFAOYSA-N 0 0 366.421 3.639 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1OCC(=O)N[C@@H](CC(C)C)c1ccccc1 ZINC000072068029 935279637 /nfs/dbraw/zinc/27/96/37/935279637.db2.gz UPFVRJDVGMIMND-KRWDZBQOSA-N 0 0 372.421 3.886 20 5 FHBDRN COC(=O)[C@H](C)[C@@H](NC(=O)Nc1cc([N+](=O)[O-])ccc1C)c1ccccc1 ZINC000119848349 935280940 /nfs/dbraw/zinc/28/09/40/935280940.db2.gz TXDDHXUOTZBBJI-CXAGYDPISA-N 0 0 371.393 3.575 20 5 FHBDRN Cn1cc([N+](=O)[O-])cc1-c1nc(C2(c3ccccc3F)CCCC2)no1 ZINC000551436254 935283959 /nfs/dbraw/zinc/28/39/59/935283959.db2.gz ZEHFEKHAOXPZQX-UHFFFAOYSA-N 0 0 356.357 3.983 20 5 FHBDRN Cc1cc(C)c(C(=O)Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)cc1C ZINC000072085946 935289436 /nfs/dbraw/zinc/28/94/36/935289436.db2.gz KEZWAWCEEAYEGL-UHFFFAOYSA-N 0 0 350.378 3.661 20 5 FHBDRN COc1ccccc1C/C(C)=C\C(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000255487096 935291564 /nfs/dbraw/zinc/29/15/64/935291564.db2.gz GMJZVORZZKAPFI-QBFSEMIESA-N 0 0 356.378 3.740 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCc1ccc(N2CCCC2)nc1 ZINC000119854008 935298189 /nfs/dbraw/zinc/29/81/89/935298189.db2.gz FTTIAZDUUPTYME-UHFFFAOYSA-N 0 0 369.425 3.529 20 5 FHBDRN COc1ccc([C@H](C)Nc2c([N+](=O)[O-])c(C)nn2C)cc1Br ZINC000051453964 935304612 /nfs/dbraw/zinc/30/46/12/935304612.db2.gz YBNYLHSCYPYWGZ-QMMMGPOBSA-N 0 0 369.219 3.581 20 5 FHBDRN CCc1cc2c(ncn(Cc3cc([N+](=O)[O-])ccc3OC(C)C)c2=O)s1 ZINC000511079928 935304664 /nfs/dbraw/zinc/30/46/64/935304664.db2.gz GUBMXJAYGSVXDS-UHFFFAOYSA-N 0 0 373.434 3.764 20 5 FHBDRN Cc1ccc(OCCNC(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)c(C)c1 ZINC001125583193 935305519 /nfs/dbraw/zinc/30/55/19/935305519.db2.gz PKYQCMNMPZZDMV-UHFFFAOYSA-N 0 0 372.421 3.808 20 5 FHBDRN Cc1c([C@@H](C)NCc2ccn(Cc3ccccc3)n2)cccc1[N+](=O)[O-] ZINC000551563381 935311697 /nfs/dbraw/zinc/31/16/97/935311697.db2.gz GIAGXBLCTZHFMJ-MRXNPFEDSA-N 0 0 350.422 3.999 20 5 FHBDRN O=[N+]([O-])c1cccc(F)c1CN(Cc1ccccc1)C[C@H](O)C(F)(F)F ZINC000611577697 935320687 /nfs/dbraw/zinc/32/06/87/935320687.db2.gz VHNOFYRKASXMDH-INIZCTEOSA-N 0 0 372.318 3.659 20 5 FHBDRN C[C@H](Cn1ncc2ccccc21)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000551658458 935325115 /nfs/dbraw/zinc/32/51/15/935325115.db2.gz QLIXEZWQBZCQHN-GFCCVEGCSA-N 0 0 372.812 3.550 20 5 FHBDRN Cc1c(C(=O)N2CC[C@@](F)(c3cc(F)cc(F)c3)C2)cccc1[N+](=O)[O-] ZINC000551686478 935329192 /nfs/dbraw/zinc/32/91/92/935329192.db2.gz FTNCYOZQWXOJEX-SFHVURJKSA-N 0 0 364.323 3.892 20 5 FHBDRN CCN(Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)Cc1c(F)cccc1F ZINC000507270958 945096943 /nfs/dbraw/zinc/09/69/43/945096943.db2.gz AGOZYELRNDBSFC-UHFFFAOYSA-N 0 0 374.347 3.945 20 5 FHBDRN O=[N+]([O-])c1c(NCc2ccc(Cn3cccn3)cc2)ccc2ncccc21 ZINC000051499514 935388153 /nfs/dbraw/zinc/38/81/53/935388153.db2.gz JZAOXDJDBQZSMX-UHFFFAOYSA-N 0 0 359.389 4.000 20 5 FHBDRN CC[C@@H](NC(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-])c1ccncc1 ZINC000158174461 935395777 /nfs/dbraw/zinc/39/57/77/935395777.db2.gz ZCHGZTMKARBZJH-CYBMUJFWSA-N 0 0 361.423 3.601 20 5 FHBDRN O=C(Cc1cccc([N+](=O)[O-])c1)NCc1nc(-c2ccccc2F)cs1 ZINC000468222042 935397500 /nfs/dbraw/zinc/39/75/00/935397500.db2.gz RQYYPNWDRKDQLY-UHFFFAOYSA-N 0 0 371.393 3.716 20 5 FHBDRN CC[C@H](NC(=O)c1cc([N+](=O)[O-])c(C)s1)c1ccc2c(c1)OCCO2 ZINC000055965248 935402660 /nfs/dbraw/zinc/40/26/60/935402660.db2.gz MQQCIUJNVLKXIS-LBPRGKRZSA-N 0 0 362.407 3.617 20 5 FHBDRN CCN(CC(=O)Nc1cc([N+](=O)[O-])ccc1C)c1ccc2[nH]ccc2c1 ZINC000472195091 935408039 /nfs/dbraw/zinc/40/80/39/935408039.db2.gz VEADPBVQMYEGEF-UHFFFAOYSA-N 0 0 352.394 3.850 20 5 FHBDRN Cc1c(C[S@](C)=O)cccc1NC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000582215473 935409975 /nfs/dbraw/zinc/40/99/75/935409975.db2.gz AAJRFDHIPFBXSX-CANCMXDXSA-N 0 0 360.435 3.524 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NCc1nc(CCc2ccccc2)no1 ZINC000085288643 935417485 /nfs/dbraw/zinc/41/74/85/935417485.db2.gz DJUMJEKLRXZDHA-UHFFFAOYSA-N 0 0 352.394 3.992 20 5 FHBDRN CC(C)c1ccc(C(=O)Nc2ccc(F)c(NC(N)=O)c2)cc1[N+](=O)[O-] ZINC000478050531 935422812 /nfs/dbraw/zinc/42/28/12/935422812.db2.gz QZXNYTQPYNHQPR-UHFFFAOYSA-N 0 0 360.345 3.600 20 5 FHBDRN COc1ccc(CC(=O)Nc2cccc(C(C)(F)F)c2)cc1[N+](=O)[O-] ZINC000548707788 935427580 /nfs/dbraw/zinc/42/75/80/935427580.db2.gz FKDZBUXCBLKIEO-UHFFFAOYSA-N 0 0 350.321 3.896 20 5 FHBDRN COc1cc(C(=O)N2CCC(CC(F)(F)F)CC2)c([N+](=O)[O-])cc1F ZINC000451550711 935433107 /nfs/dbraw/zinc/43/31/07/935433107.db2.gz JIHKRRQGSXZUCJ-UHFFFAOYSA-N 0 0 364.295 3.547 20 5 FHBDRN COc1ccc(-c2ccc(CN3CCC[C@@H]3c3ncc[nH]3)o2)c([N+](=O)[O-])c1 ZINC000437979457 945102160 /nfs/dbraw/zinc/10/21/60/945102160.db2.gz YBMUWPJQMQHZPE-MRXNPFEDSA-N 0 0 368.393 3.924 20 5 FHBDRN O=C(Nc1ccc2[nH]c(=S)[nH]c2c1)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000121782433 935465505 /nfs/dbraw/zinc/46/55/05/935465505.db2.gz JKSJRVBPIGTNEZ-UHFFFAOYSA-N 0 0 365.374 3.560 20 5 FHBDRN O=[N+]([O-])c1cccnc1SCCCCCn1nnc(-c2ccccc2)n1 ZINC000511096929 935481643 /nfs/dbraw/zinc/48/16/43/935481643.db2.gz RZJRJCDNTHZLCV-UHFFFAOYSA-N 0 0 370.438 3.606 20 5 FHBDRN CNc1c(C(=O)Nc2cc(C3C(C)(C)C3(C)C)[nH]n2)cccc1[N+](=O)[O-] ZINC001143444924 935494235 /nfs/dbraw/zinc/49/42/35/935494235.db2.gz XZRNIBRUHMSFIM-UHFFFAOYSA-N 0 0 357.414 3.762 20 5 FHBDRN O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC[C@@H](c2ncc[nH]2)C1 ZINC000263945179 935503242 /nfs/dbraw/zinc/50/32/42/935503242.db2.gz LASAFZLDTWBXPR-LLVKDONJSA-N 0 0 356.407 3.552 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)NC2(c3cccc(F)c3)CC2)c1 ZINC000540625422 935513814 /nfs/dbraw/zinc/51/38/14/935513814.db2.gz FUJAVKLWMQTKAW-UHFFFAOYSA-N 0 0 358.369 3.617 20 5 FHBDRN O=C(NCCc1cc2ccccc2[nH]1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000120080184 935539776 /nfs/dbraw/zinc/53/97/76/935539776.db2.gz XDNKPAIPABSDGL-UHFFFAOYSA-N 0 0 364.405 3.623 20 5 FHBDRN CCC[C@@]1(COC)CCCN1C(=O)Nc1cc([N+](=O)[O-])ccc1OCC ZINC000439933482 945107764 /nfs/dbraw/zinc/10/77/64/945107764.db2.gz QBFPEGJPTHHGGZ-SFHVURJKSA-N 0 0 365.430 3.807 20 5 FHBDRN COCCOCC(=O)Nc1c2ccccc2n2c1c1ccccc1nc2C ZINC000247968519 945108317 /nfs/dbraw/zinc/10/83/17/945108317.db2.gz RKMRRXBRIQOSJU-UHFFFAOYSA-N 0 0 363.417 3.551 20 5 FHBDRN COc1ccc(C(=O)Nc2nc3cc(F)c(C)cc3s2)cc1[N+](=O)[O-] ZINC000478087121 935566922 /nfs/dbraw/zinc/56/69/22/935566922.db2.gz QUOKKVFYORIDRS-UHFFFAOYSA-N 0 0 361.354 3.913 20 5 FHBDRN CCOc1ccc([C@@H]2C[C@H]2NC(=O)CSc2ccccc2[N+](=O)[O-])cc1 ZINC000437198876 945109149 /nfs/dbraw/zinc/10/91/49/945109149.db2.gz BGPNZGHCKQCIOJ-JKSUJKDBSA-N 0 0 372.446 3.758 20 5 FHBDRN CCOc1cc(NCCNc2cc(OC)cc(OC)c2)ccc1[N+](=O)[O-] ZINC000127484215 935580197 /nfs/dbraw/zinc/58/01/97/935580197.db2.gz DIKPDAVKKMPCNA-UHFFFAOYSA-N 0 0 361.398 3.535 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2csc(N3CCC(c4ccncn4)CC3)n2)cc1 ZINC000413472233 935585576 /nfs/dbraw/zinc/58/55/76/935585576.db2.gz SBWXKXJCAYRJTC-UHFFFAOYSA-N 0 0 367.434 3.892 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])[C@H]1CCN(c2ccc(Cl)cc2)C1=O ZINC000511106214 935591099 /nfs/dbraw/zinc/59/10/99/935591099.db2.gz LPVHBYZQYBTDQS-SFHVURJKSA-N 0 0 373.840 3.528 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)N2CCC[C@H]([C@H]3CCOC3)C2)cc1[N+](=O)[O-] ZINC000439937802 945110949 /nfs/dbraw/zinc/11/09/49/945110949.db2.gz YTFQXNHLTNVXLC-HOTGVXAUSA-N 0 0 360.454 3.781 20 5 FHBDRN COC(=O)c1cnc(Nc2cccc(OC3CCCC3)c2)c([N+](=O)[O-])c1 ZINC000478270119 935595022 /nfs/dbraw/zinc/59/50/22/935595022.db2.gz WXZHLSCUURJYDO-UHFFFAOYSA-N 0 0 357.366 3.841 20 5 FHBDRN CC(C)(C(=O)Nc1nccn1Cc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000582384923 935596785 /nfs/dbraw/zinc/59/67/85/935596785.db2.gz GEWCIUBJDSDUMI-UHFFFAOYSA-N 0 0 364.405 3.756 20 5 FHBDRN CC(C)(C)CC[C@@H](CO)NC(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000511110403 935614656 /nfs/dbraw/zinc/61/46/56/935614656.db2.gz YEQMGCBCPPHRPO-JTQLQIEISA-N 0 0 362.348 3.531 20 5 FHBDRN CSCCN(C)C(=O)c1ccc(N2C[C@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000152433023 935616416 /nfs/dbraw/zinc/61/64/16/935616416.db2.gz TWBYJMNLDBRPRS-OKILXGFUSA-N 0 0 365.499 3.512 20 5 FHBDRN O=[N+]([O-])c1cccc(OC[C@H](O)CSCc2ccccc2Cl)c1 ZINC000478371914 935619457 /nfs/dbraw/zinc/61/94/57/935619457.db2.gz RYHKERSFVZZXTB-AWEZNQCLSA-N 0 0 353.827 3.921 20 5 FHBDRN O=[N+]([O-])c1ccc(Cc2noc(CCCc3ccccc3Cl)n2)nc1 ZINC000582390487 935620679 /nfs/dbraw/zinc/62/06/79/935620679.db2.gz LHCXOGFVGMMSTR-UHFFFAOYSA-N 0 0 358.785 3.792 20 5 FHBDRN Cc1cc([C@@H]2CN(C(=O)Nc3cccc([N+](=O)[O-])c3)CCO2)ccc1F ZINC000127560584 935622146 /nfs/dbraw/zinc/62/21/46/935622146.db2.gz VFFUFOIINLQTSO-KRWDZBQOSA-N 0 0 359.357 3.648 20 5 FHBDRN C[C@H]1CN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[S@@](=O)C1 ZINC000277578175 935633937 /nfs/dbraw/zinc/63/39/37/935633937.db2.gz TVRZYRSUDFKFLR-RKNYENMMSA-N 0 0 364.492 3.524 20 5 FHBDRN CO[C@H](c1ccc(Cl)cc1)[C@@H](C)NC(=O)Cc1ccccc1[N+](=O)[O-] ZINC000127574122 935635137 /nfs/dbraw/zinc/63/51/37/935635137.db2.gz RGRKJJIUPPYSMT-XIKOKIGWSA-N 0 0 362.813 3.683 20 5 FHBDRN C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000582394650 935636236 /nfs/dbraw/zinc/63/62/36/935636236.db2.gz KULXHTOTPIGVMI-KGLIPLIRSA-N 0 0 370.405 3.565 20 5 FHBDRN O=C(NCCc1cccc(OCC(F)(F)F)c1)c1ccc([N+](=O)[O-])s1 ZINC000478527015 935641927 /nfs/dbraw/zinc/64/19/27/935641927.db2.gz HYVIVSQFDCPRGM-UHFFFAOYSA-N 0 0 374.340 3.570 20 5 FHBDRN Cc1ccccc1[C@@]1(F)CCN(C(=O)NCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000507296651 945113947 /nfs/dbraw/zinc/11/39/47/945113947.db2.gz NLJDULLSRDZQAF-HXUWFJFHSA-N 0 0 371.412 3.726 20 5 FHBDRN O=C(NCCc1cccc(OCC(F)(F)F)c1)c1cccc([N+](=O)[O-])c1 ZINC000478498504 935643777 /nfs/dbraw/zinc/64/37/77/935643777.db2.gz AFBKIXRKVLBJFJ-UHFFFAOYSA-N 0 0 368.311 3.508 20 5 FHBDRN Cc1cc(Cl)c(S(=O)(=O)N([C@@H](C)C2CC2)C2CC2)cc1[N+](=O)[O-] ZINC000176666605 935644968 /nfs/dbraw/zinc/64/49/68/935644968.db2.gz QBZLUUVKSBJDAO-JTQLQIEISA-N 0 0 358.847 3.508 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@@H]1Cc1ccccc1 ZINC000478559288 935646111 /nfs/dbraw/zinc/64/61/11/935646111.db2.gz XGNUPDVVGZUQNP-WMLDXEAASA-N 0 0 356.447 3.919 20 5 FHBDRN O=C(CCc1ccc([N+](=O)[O-])cc1Cl)N[C@@H]1[C@@H]2Cc3cc(F)ccc3[C@@H]21 ZINC001167571049 935647181 /nfs/dbraw/zinc/64/71/81/935647181.db2.gz NQCYAAZLUFAILU-AYOQOUSVSA-N 0 0 374.799 3.774 20 5 FHBDRN CC(C)[C@H]1CN(C(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])CCS1 ZINC000437204315 945114409 /nfs/dbraw/zinc/11/44/09/945114409.db2.gz XSIMNMOGIAQZLX-OAHLLOKOSA-N 0 0 372.874 3.617 20 5 FHBDRN CC(C)(C)CC[C@H](CO)NC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000478589725 935655953 /nfs/dbraw/zinc/65/59/53/935655953.db2.gz DRWZGVWLRDQTQF-LLVKDONJSA-N 0 0 362.348 3.531 20 5 FHBDRN Cc1n[nH]c(C(=O)N2CCC[C@@H]2c2cccc3ccccc32)c1[N+](=O)[O-] ZINC000519108761 945115389 /nfs/dbraw/zinc/11/53/89/945115389.db2.gz YHDUGFRZQRWITE-MRXNPFEDSA-N 0 0 350.378 3.757 20 5 FHBDRN CC(=O)CCc1ccc(O[C@H](C)C(=O)N(C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000158261876 935665481 /nfs/dbraw/zinc/66/54/81/935665481.db2.gz AVAGLYDSPLOUGV-OAHLLOKOSA-N 0 0 370.405 3.547 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N[C@@H]1CCCC[C@H]1n1cccn1 ZINC000127635682 935673269 /nfs/dbraw/zinc/67/32/69/935673269.db2.gz KKHVOZWTVXXETL-GDBMZVCRSA-N 0 0 357.414 3.714 20 5 FHBDRN CN(C(=O)c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1)c1ccn(C)n1 ZINC000478644076 935675192 /nfs/dbraw/zinc/67/51/92/935675192.db2.gz DSGYPOMYEBEFHQ-UHFFFAOYSA-N 0 0 368.418 3.756 20 5 FHBDRN CN(C(=O)CSc1ccc(C(F)(F)F)cn1)c1cccc([N+](=O)[O-])c1 ZINC000158286150 935685474 /nfs/dbraw/zinc/68/54/74/935685474.db2.gz ZERZKGHJHLPJSQ-UHFFFAOYSA-N 0 0 371.340 3.764 20 5 FHBDRN CCOc1cc(OCC(=O)c2ccc(OC(F)F)cc2)ccc1[N+](=O)[O-] ZINC000478730890 935687800 /nfs/dbraw/zinc/68/78/00/935687800.db2.gz DRGUUZISYQYSAG-UHFFFAOYSA-N 0 0 367.304 3.857 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N[C@H](c1nc(C2CC2)no1)C(C)C ZINC000127670681 935715932 /nfs/dbraw/zinc/71/59/32/935715932.db2.gz QDHFCQXQGKVXTK-AWEZNQCLSA-N 0 0 373.413 3.991 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2nc(CN3CCC[C@H](OC(F)F)C3)cs2)c1 ZINC000611608106 935730399 /nfs/dbraw/zinc/73/03/99/935730399.db2.gz FKPSFDPGQNDTSB-AWEZNQCLSA-N 0 0 369.393 3.922 20 5 FHBDRN CCOc1ccc(NC(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)cc1OC ZINC000124073884 945119912 /nfs/dbraw/zinc/11/99/12/945119912.db2.gz WKHPTJRIVOVSIC-UHFFFAOYSA-N 0 0 371.393 3.592 20 5 FHBDRN CCO[C@H]1C[C@H](N(C)C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)C12CCC2 ZINC000478865651 935746767 /nfs/dbraw/zinc/74/67/67/935746767.db2.gz MWFULIKLLNJLRX-ROUUACIJSA-N 0 0 373.453 3.589 20 5 FHBDRN Cc1c(CNC(=O)N[C@@H](c2ccccc2)[C@@H]2CCCO2)cccc1[N+](=O)[O-] ZINC000478867002 935746821 /nfs/dbraw/zinc/74/68/21/935746821.db2.gz HYAQBYSFDKBZBZ-OALUTQOASA-N 0 0 369.421 3.623 20 5 FHBDRN Cc1cc(OCC(=O)N[C@H](c2ccccc2)C(C)C)c(F)cc1[N+](=O)[O-] ZINC000478897728 935753024 /nfs/dbraw/zinc/75/30/24/935753024.db2.gz BKRYABDNKBEQRL-IBGZPJMESA-N 0 0 360.385 3.935 20 5 FHBDRN CN(C(=O)c1cc(F)ccc1[N+](=O)[O-])c1cccc(OC(F)(F)F)c1 ZINC000728493442 935762393 /nfs/dbraw/zinc/76/23/93/935762393.db2.gz UXQVZZNOINIINN-UHFFFAOYSA-N 0 0 358.247 3.909 20 5 FHBDRN COc1cc(C(=O)N[C@@H](C)c2ccccc2Cl)c([N+](=O)[O-])cc1OC ZINC000023654157 935764040 /nfs/dbraw/zinc/76/40/40/935764040.db2.gz NBQIGMONBMTJMJ-JTQLQIEISA-N 0 0 364.785 3.756 20 5 FHBDRN Cc1cc(N[C@@H]2CCC[C@H](NC(=O)OC(C)(C)C)C2)ncc1[N+](=O)[O-] ZINC000127740911 935765439 /nfs/dbraw/zinc/76/54/39/935765439.db2.gz BYJJNMFHCYXCPG-OLZOCXBDSA-N 0 0 350.419 3.546 20 5 FHBDRN Cc1cc(NC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)c(C)c(C)c1O ZINC000478986918 935766662 /nfs/dbraw/zinc/76/66/62/935766662.db2.gz ICESTVOWNXROHW-UHFFFAOYSA-N 0 0 353.378 3.819 20 5 FHBDRN CC[C@@]1(c2ccc(C)cc2)CC(=O)N(Cc2c(F)cccc2[N+](=O)[O-])C1=O ZINC000158400545 935767481 /nfs/dbraw/zinc/76/74/81/935767481.db2.gz YJTCBAZQCIDOOP-FQEVSTJZSA-N 0 0 370.380 3.649 20 5 FHBDRN COc1ccc(CN(C)Cc2cc(F)ccc2[N+](=O)[O-])cc1OC(F)F ZINC000051709617 935770813 /nfs/dbraw/zinc/77/08/13/935770813.db2.gz PCMXAFWYIYENQC-UHFFFAOYSA-N 0 0 370.327 3.976 20 5 FHBDRN C[C@H](c1ccco1)N(C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)C1CC1 ZINC000158941673 935771223 /nfs/dbraw/zinc/77/12/23/935771223.db2.gz BWAYLPNIKXQWIK-GFCCVEGCSA-N 0 0 353.378 3.964 20 5 FHBDRN CN(C(=O)c1cc([N+](=O)[O-])ccc1F)c1cccc(OC(F)(F)F)c1 ZINC000728493648 935777066 /nfs/dbraw/zinc/77/70/66/935777066.db2.gz XVLFOVCZJFGUMR-UHFFFAOYSA-N 0 0 358.247 3.909 20 5 FHBDRN Cc1c2ccccc2oc1[C@H](C)NS(=O)(=O)c1c(C)cccc1[N+](=O)[O-] ZINC000511791209 945124675 /nfs/dbraw/zinc/12/46/75/945124675.db2.gz JWLKQBWVIWWSBW-ZDUSSCGKSA-N 0 0 374.418 3.997 20 5 FHBDRN COc1cc(F)c(NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)cc1F ZINC000127799756 935803447 /nfs/dbraw/zinc/80/34/47/935803447.db2.gz JNNUFPLNVWAOSJ-UHFFFAOYSA-N 0 0 361.304 3.544 20 5 FHBDRN CN(C(=O)CCc1ccc(Br)cc1)c1cccc([N+](=O)[O-])c1 ZINC000158451812 935813317 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Cc1cc(C(=O)Nc2cc(Br)ccc2O)cc([N+](=O)[O-])c1 ZINC000536209348 938585621 /nfs/dbraw/zinc/58/56/21/938585621.db2.gz NRXIKNIDTYZNEC-UHFFFAOYSA-N 0 0 351.156 3.624 20 5 FHBDRN Cc1cc(Cl)ccc1O[C@@H](C)C(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000032970718 938595438 /nfs/dbraw/zinc/59/54/38/938595438.db2.gz DXIRFNREKPODRJ-LBPRGKRZSA-N 0 0 360.797 3.913 20 5 FHBDRN O=C(NC[C@@H](c1ccccc1)C1CC1)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000584090748 938596133 /nfs/dbraw/zinc/59/61/33/938596133.db2.gz XVSPIOAJRRUMCH-IBGZPJMESA-N 0 0 365.433 3.856 20 5 FHBDRN Cc1sc(S(=O)(=O)N2CCCc3c(C)cc(C)cc32)cc1[N+](=O)[O-] ZINC000466959549 945188827 /nfs/dbraw/zinc/18/88/27/945188827.db2.gz KWYLNHUMKYRTDS-UHFFFAOYSA-N 0 0 366.464 3.723 20 5 FHBDRN CN(CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)Cc1csc2ccccc12 ZINC000052805988 938605188 /nfs/dbraw/zinc/60/51/88/938605188.db2.gz DGYYKCJJKVUJTQ-UHFFFAOYSA-N 0 0 369.446 3.904 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)Nc2ccc(-c3cnc(C4CC4)o3)cc2)n1 ZINC000427199341 945189653 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CSc1ccc([N+](=O)[O-])c(C(=O)NCc2cc(-c3ccccc3)no2)c1 ZINC000052990363 938692532 /nfs/dbraw/zinc/69/25/32/938692532.db2.gz NEGQHRRWQCQILF-UHFFFAOYSA-N 0 0 369.402 3.902 20 5 FHBDRN COc1ccc(NC(=O)N[C@H]2COc3ccc(Cl)cc32)cc1[N+](=O)[O-] ZINC000611826377 938699116 /nfs/dbraw/zinc/69/91/16/938699116.db2.gz QYCMTHUBSKDFFB-LBPRGKRZSA-N 0 0 363.757 3.512 20 5 FHBDRN COc1ccc(CN(C)c2cc(C)c([N+](=O)[O-])cn2)cc1OC(F)F ZINC000074739890 938703797 /nfs/dbraw/zinc/70/37/97/938703797.db2.gz SKNZDWKCAXHWKP-UHFFFAOYSA-N 0 0 353.325 3.545 20 5 FHBDRN COc1ccc(COCCNc2ccc([N+](=O)[O-])c3cnccc23)cc1 ZINC000092959036 945197517 /nfs/dbraw/zinc/19/75/17/945197517.db2.gz SQIPNCLQQSOGOE-UHFFFAOYSA-N 0 0 353.378 3.780 20 5 FHBDRN Cc1cc(N2CCO[C@@H](c3ccc(F)c(Cl)c3)C2)ncc1[N+](=O)[O-] ZINC000074746870 938706011 /nfs/dbraw/zinc/70/60/11/938706011.db2.gz VORLKKONHCLSEX-OAHLLOKOSA-N 0 0 351.765 3.669 20 5 FHBDRN COCc1cc([N+](=O)[O-])ccc1NCc1ccc(Cn2ccnc2)cc1 ZINC000080948620 938708923 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FHBDRN CCOc1ccccc1NC(=O)COc1cc(C)c([N+](=O)[O-])cc1Cl ZINC000506431692 945207324 /nfs/dbraw/zinc/20/73/24/945207324.db2.gz IZWXKWNRWYZFBT-UHFFFAOYSA-N 0 0 364.785 3.973 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(N2CCC(C(=O)Nc3ccc(F)cc3)CC2)c1 ZINC000088718062 938852191 /nfs/dbraw/zinc/85/21/91/938852191.db2.gz UBCRVRDJEKXICY-UHFFFAOYSA-N 0 0 357.385 3.897 20 5 FHBDRN CCc1csc(NC(=O)c2cc([N+](=O)[O-])cc(Br)c2C)n1 ZINC000584424607 938853574 /nfs/dbraw/zinc/85/35/74/938853574.db2.gz KTYJVIYVYZEYJG-UHFFFAOYSA-N 0 0 370.228 3.937 20 5 FHBDRN Cc1ccc(C(=O)N2C[C@H]3CCCCN3c3ccccc32)cc1[N+](=O)[O-] ZINC000584431061 938860608 /nfs/dbraw/zinc/86/06/08/938860608.db2.gz UOYWTJSVADVRQU-MRXNPFEDSA-N 0 0 351.406 3.923 20 5 FHBDRN COc1cc(OC)c(NC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])cc1Cl ZINC000065668523 938863785 /nfs/dbraw/zinc/86/37/85/938863785.db2.gz WMRPKIPAVYZXGH-UHFFFAOYSA-N 0 0 372.711 3.796 20 5 FHBDRN CCOc1cc(N[C@H]2CCCN(Cc3ccccc3)C2=O)ccc1[N+](=O)[O-] ZINC000090147782 938877898 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FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N1CCN(Cc2cccs2)CC1 ZINC000093905794 938931938 /nfs/dbraw/zinc/93/19/38/938931938.db2.gz GJLMWCPGECDVJT-UHFFFAOYSA-N 0 0 373.478 3.540 20 5 FHBDRN COC(=O)c1ccc(NC(=O)c2cc3ccccc3c3cccnc23)cn1 ZINC000611880891 938938161 /nfs/dbraw/zinc/93/81/61/938938161.db2.gz KRBVLOUDYGKRAV-UHFFFAOYSA-N 0 0 357.369 3.822 20 5 FHBDRN CCCN(Cc1ccccc1)S(=O)(=O)c1cc([N+](=O)[O-])ccc1CC ZINC000065684915 938942049 /nfs/dbraw/zinc/94/20/49/938942049.db2.gz BWRNEZHKNWWBFZ-UHFFFAOYSA-N 0 0 362.451 3.758 20 5 FHBDRN O=C(N1CCc2sc(Cl)cc2C1)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000843620475 938947715 /nfs/dbraw/zinc/94/77/15/938947715.db2.gz KSUBLNWOEHGHLY-UHFFFAOYSA-N 0 0 372.780 3.986 20 5 FHBDRN CNc1cccnc1CNc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000480500117 938965093 /nfs/dbraw/zinc/96/50/93/938965093.db2.gz KPXJKLCJPYTHMY-UHFFFAOYSA-N 0 0 362.389 3.875 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)NC1(C(F)(F)F)CCCCC1 ZINC000511265001 938969805 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FHBDRN O=C(Nc1ccc(OC(F)F)cc1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000179190023 938986997 /nfs/dbraw/zinc/98/69/97/938986997.db2.gz PCNBACLWAIBXPO-UHFFFAOYSA-N 0 0 374.303 3.634 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(O[C@@H]2CCCC[C@@H]2O)cc1 ZINC000135665277 938987577 /nfs/dbraw/zinc/98/75/77/938987577.db2.gz UHOLWOJKFKLFPJ-RBUKOAKNSA-N 0 0 370.405 3.838 20 5 FHBDRN CCC[C@H](C)[C@@H]1CCCN1C(=O)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000785180633 938991386 /nfs/dbraw/zinc/99/13/86/938991386.db2.gz SVWKDNFWABTQRK-FZMZJTMJSA-N 0 0 367.833 3.614 20 5 FHBDRN CCN(C(=O)COc1ccc([N+](=O)[O-])c2cccnc12)c1ccc(F)cc1 ZINC000431593039 938991414 /nfs/dbraw/zinc/99/14/14/938991414.db2.gz VIMBBAWUDJWIPO-UHFFFAOYSA-N 0 0 369.352 3.714 20 5 FHBDRN CSc1ccc([C@@H](C)NS(=O)(=O)c2cc(C)sc2[N+](=O)[O-])cc1 ZINC001211625046 938992596 /nfs/dbraw/zinc/99/25/96/938992596.db2.gz OWCDHGODNCFHJU-SNVBAGLBSA-N 0 0 372.493 3.726 20 5 FHBDRN Cc1nc2ccccc2c2c(NC(=O)Cn3cccn3)c3ccccc3n21 ZINC000302879774 938994422 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3.552 20 5 FHBDRN Cc1cc(NC(=O)c2ccc3nc(C(F)(F)F)cn3c2)ccc1[N+](=O)[O-] ZINC000472399023 939875373 /nfs/dbraw/zinc/87/53/73/939875373.db2.gz VFNKVFGUKWZRCR-UHFFFAOYSA-N 0 0 364.283 3.822 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)ccc1CN1CCC[C@@H](c2nnc(C3CC3)[nH]2)C1 ZINC000179518471 939876539 /nfs/dbraw/zinc/87/65/39/939876539.db2.gz YTSSKPGYOMZYJG-CYBMUJFWSA-N 0 0 361.833 3.623 20 5 FHBDRN O=C(N[C@@H](c1cccs1)c1ccc(Cl)cc1)c1[nH]ncc1[N+](=O)[O-] ZINC000179522617 939877238 /nfs/dbraw/zinc/87/72/38/939877238.db2.gz XUMOUTFNKIREGZ-CYBMUJFWSA-N 0 0 362.798 3.552 20 5 FHBDRN COCCn1c(C)c(C)nc1SCCCOc1ccc([N+](=O)[O-])cc1 ZINC000077556754 939878818 /nfs/dbraw/zinc/87/88/18/939878818.db2.gz OLOMMVCQPHOUDJ-UHFFFAOYSA-N 0 0 365.455 3.616 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)Nc1cccc(-c2ncco2)c1 ZINC000179551125 939884113 /nfs/dbraw/zinc/88/41/13/939884113.db2.gz FXYOCOUTOPSVGY-UHFFFAOYSA-N 0 0 362.345 3.912 20 5 FHBDRN Cc1nc(-c2cccs2)ccc1C(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000065819292 939887171 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3.947 20 5 FHBDRN CCOc1ccc2c(c1)[C@H](NC(=O)Nc1ccc([N+](=O)[O-])c(C)c1)CCO2 ZINC000614200605 939900428 /nfs/dbraw/zinc/90/04/28/939900428.db2.gz CZMIRYVXLRJEHV-MRXNPFEDSA-N 0 0 371.393 3.947 20 5 FHBDRN CC[C@H]1C[C@]1(NS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1)c1cccc(C)c1 ZINC000410166145 939901295 /nfs/dbraw/zinc/90/12/95/939901295.db2.gz QHTUDXOEPRFHJK-QFBILLFUSA-N 0 0 374.462 3.648 20 5 FHBDRN C[C@@H]1C[C@H](c2cccnc2)N(Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000364105316 939904498 /nfs/dbraw/zinc/90/44/98/939904498.db2.gz VUVRZWLISGEFJA-CXAGYDPISA-N 0 0 365.393 3.623 20 5 FHBDRN O=C(N[C@@H](c1cc2ccccc2o1)c1ccccc1)c1[nH]ncc1[N+](=O)[O-] ZINC000136249950 939907622 /nfs/dbraw/zinc/90/76/22/939907622.db2.gz AQKUGYRLTKCBPO-QGZVFWFLSA-N 0 0 362.345 3.584 20 5 FHBDRN O=[N+]([O-])c1ccc2ncnc(NC[C@H](c3ccccc3)C(F)(F)F)c2c1 ZINC000614410687 939910671 /nfs/dbraw/zinc/91/06/71/939910671.db2.gz JCNZHSYQFBOJIV-CQSZACIVSA-N 0 0 362.311 3.718 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)N2CCCC3(CCOCC3)C2)cc1[N+](=O)[O-] ZINC000364281942 939917030 /nfs/dbraw/zinc/91/70/30/939917030.db2.gz CVOAFLOYBZRSFR-OAHLLOKOSA-N 0 0 361.442 3.566 20 5 FHBDRN C[C@@H]1CO[C@H](c2ccccc2)CN1C(=O)C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000410463358 939917674 /nfs/dbraw/zinc/91/76/74/939917674.db2.gz CWMOXDCNBIPRCD-BEFAXECRSA-N 0 0 368.433 3.861 20 5 FHBDRN COc1cc(C(=O)N[C@@H]2CCC[C@@H]2Cc2ccccc2)c([N+](=O)[O-])cc1F ZINC000410496546 939922077 /nfs/dbraw/zinc/92/20/77/939922077.db2.gz AHZZQZYNKYXRRW-RHSMWYFYSA-N 0 0 372.396 3.884 20 5 FHBDRN C[C@H](C(=O)NCc1cccc([N+](=O)[O-])c1)c1ccc(Br)cc1 ZINC000179787464 939934895 /nfs/dbraw/zinc/93/48/95/939934895.db2.gz LRHRZLZRUFGQPV-NSHDSACASA-N 0 0 363.211 3.777 20 5 FHBDRN O=C(Nc1cnn(Cc2ccccc2)c1)c1cccc([N+](=O)[O-])c1Cl ZINC000310570013 939935181 /nfs/dbraw/zinc/93/51/81/939935181.db2.gz XFTHLOXCXZSCMK-UHFFFAOYSA-N 0 0 356.769 3.745 20 5 FHBDRN C[C@H](OCCc1ccccc1)C(=O)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000410624826 939939635 /nfs/dbraw/zinc/93/96/35/939939635.db2.gz UQEWHSPNIHPYLB-HNNXBMFYSA-N 0 0 354.406 3.522 20 5 FHBDRN Cc1n[nH]cc1C1CCN(C(=O)c2c(C)cc(C)c([N+](=O)[O-])c2C)CC1 ZINC000375831810 939952970 /nfs/dbraw/zinc/95/29/70/939952970.db2.gz AKZUEKMPCIFLDS-UHFFFAOYSA-N 0 0 356.426 3.571 20 5 FHBDRN NC(=O)c1ccc(N2CCC[C@@H](c3ccc(F)cc3)CC2)c([N+](=O)[O-])c1 ZINC000540872565 939956300 /nfs/dbraw/zinc/95/63/00/939956300.db2.gz VBDCRCXSAKBERA-CYBMUJFWSA-N 0 0 357.385 3.607 20 5 FHBDRN CN(C(=O)c1ccc([N+](=O)[O-])o1)[C@@H](c1cccnc1)c1ccc(F)c(F)c1 ZINC000364517407 939957780 /nfs/dbraw/zinc/95/77/80/939957780.db2.gz YSLMTQPJAUCBHI-QGZVFWFLSA-N 0 0 373.315 3.723 20 5 FHBDRN Cc1c(NC(=O)c2cc(-c3ccc4c(c3)CCO4)no2)cccc1[N+](=O)[O-] ZINC000136428620 939966374 /nfs/dbraw/zinc/96/63/74/939966374.db2.gz BULATBYYUAPFBZ-UHFFFAOYSA-N 0 0 365.345 3.745 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)NC1CCN(c2ccc(Cl)cc2)CC1 ZINC000364609403 939967958 /nfs/dbraw/zinc/96/79/58/939967958.db2.gz YCIBILPUVSPROV-UHFFFAOYSA-N 0 0 373.840 3.576 20 5 FHBDRN COc1cc(C(=O)N2CCC3(CCC3)CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000375863570 939985889 /nfs/dbraw/zinc/98/58/89/939985889.db2.gz XEKCCQVDZAWVFR-UHFFFAOYSA-N 0 0 370.352 3.611 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])N(Cc1ccc(Cl)cc1)C1CC1 ZINC000065865932 939988728 /nfs/dbraw/zinc/98/87/28/939988728.db2.gz KVDLDAXRPBGJAM-UHFFFAOYSA-N 0 0 359.813 3.851 20 5 FHBDRN CCNc1ccc(C(=O)N2CC[C@@H](C(F)(F)F)C[C@H]2C)cc1[N+](=O)[O-] ZINC000411033505 939988911 /nfs/dbraw/zinc/98/89/11/939988911.db2.gz KAGMGLMJUYYIRP-ZYHUDNBSSA-N 0 0 359.348 3.830 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)NCCc2cc3ccccc3[nH]2)cc1[N+](=O)[O-] ZINC000136474752 939991029 /nfs/dbraw/zinc/99/10/29/939991029.db2.gz CSBPOPMQZMIDNQ-AWEZNQCLSA-N 0 0 366.421 3.987 20 5 FHBDRN Cc1cccc(NC2CCN(C(=O)c3cc(Cl)cc([N+](=O)[O-])c3)CC2)n1 ZINC000364745621 939992358 /nfs/dbraw/zinc/99/23/58/939992358.db2.gz ZBGYCEHBMUXOAM-UHFFFAOYSA-N 0 0 374.828 3.668 20 5 FHBDRN Cc1c(NC(=O)N2CC[C@H](n3ncc4ccccc43)C2)cccc1[N+](=O)[O-] ZINC000364720026 939992767 /nfs/dbraw/zinc/99/27/67/939992767.db2.gz DRAQQAJLXULEIG-HNNXBMFYSA-N 0 0 365.393 3.732 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)N(CC(C)C)c2ccccc2Cl)n1 ZINC000411086181 939995270 /nfs/dbraw/zinc/99/52/70/939995270.db2.gz NGLVATTULGJZIV-UHFFFAOYSA-N 0 0 350.806 3.767 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)Cc1ccc(NC(=O)C2CC2)cc1 ZINC000086613738 945287860 /nfs/dbraw/zinc/28/78/60/945287860.db2.gz ONHGLCUCLHNBIX-UHFFFAOYSA-N 0 0 367.405 3.741 20 5 FHBDRN CCC[C@H](NC(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-])C1CCCC1 ZINC000411120245 939999855 /nfs/dbraw/zinc/99/98/55/939999855.db2.gz DNSWXMNMPGHECX-AWEZNQCLSA-N 0 0 350.415 3.701 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H]1CC[C@H]2CCCC[C@H]2C1 ZINC000411133955 940002503 /nfs/dbraw/zinc/00/25/03/940002503.db2.gz ISDXCEFRICDMER-OWCLPIDISA-N 0 0 373.453 3.625 20 5 FHBDRN COc1ccc(CC(=O)N2CCC[C@H]2/C=C/c2ccccc2)cc1[N+](=O)[O-] ZINC000543734242 945290703 /nfs/dbraw/zinc/29/07/03/945290703.db2.gz UVAOWRGZVGCRGT-CKDFRHGISA-N 0 0 366.417 3.850 20 5 FHBDRN Cc1ccc([C@@H](C)N(C)C(=O)C(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)cc1 ZINC000411165594 940009940 /nfs/dbraw/zinc/00/99/40/940009940.db2.gz PYCGUQQYZOXAQI-OAHLLOKOSA-N 0 0 369.421 3.678 20 5 FHBDRN Cc1cccc([C@@H]2CCCN2C(=O)C(=O)Nc2ccc([N+](=O)[O-])c(C)c2)c1 ZINC000411193859 940012335 /nfs/dbraw/zinc/01/23/35/940012335.db2.gz PJBVUCSNFKBKQN-SFHVURJKSA-N 0 0 367.405 3.514 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CC=C(c2ccc(O)cc2)CC1 ZINC000411200684 940012885 /nfs/dbraw/zinc/01/28/85/940012885.db2.gz PXNJXRIBOGCCDQ-VQTJNVASSA-N 0 0 364.401 3.720 20 5 FHBDRN CC[C@H](SC)C(=O)Nc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1 ZINC000437365498 945290743 /nfs/dbraw/zinc/29/07/43/945290743.db2.gz OUFJRDJHFKOCII-INIZCTEOSA-N 0 0 358.419 3.906 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)Nc2nc(C(C)(C)C)cs2)c1F ZINC000411259299 940018605 /nfs/dbraw/zinc/01/86/05/940018605.db2.gz NEBLCEZDRFNOEO-UHFFFAOYSA-N 0 0 367.402 3.678 20 5 FHBDRN Cc1c(Br)c(=O)n(Cc2cccc(Cl)c2)cc1[N+](=O)[O-] ZINC000544079544 940022638 /nfs/dbraw/zinc/02/26/38/940022638.db2.gz IJZNCLCKFABHNH-UHFFFAOYSA-N 0 0 357.591 3.529 20 5 FHBDRN CCCOc1cc(OC)ccc1C(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000188525816 940031189 /nfs/dbraw/zinc/03/11/89/940031189.db2.gz UADNYQPMDXAALL-UHFFFAOYSA-N 0 0 358.394 3.664 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1ccc(C(=O)OC(C)(C)C)cc1 ZINC000179866967 940034570 /nfs/dbraw/zinc/03/45/70/940034570.db2.gz DRSQWVWOCQADMZ-UHFFFAOYSA-N 0 0 370.405 3.822 20 5 FHBDRN C[C@@H](C(=O)N(C)c1ccc([N+](=O)[O-])nc1)c1ccccc1C(F)(F)F ZINC000588983931 940042814 /nfs/dbraw/zinc/04/28/14/940042814.db2.gz ADGWGWIISPELIX-SNVBAGLBSA-N 0 0 353.300 3.775 20 5 FHBDRN C[C@H](OC(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F)c1ncc(Cl)n1C ZINC000755801144 940042916 /nfs/dbraw/zinc/04/29/16/940042916.db2.gz HOHFGLKGIWCLJA-IUCAKERBSA-N 0 0 355.753 3.529 20 5 FHBDRN CNC(=O)c1ccc(N2CCC[C@H](c3ccc(F)cc3)CC2)c([N+](=O)[O-])c1 ZINC000540874158 940044655 /nfs/dbraw/zinc/04/46/55/940044655.db2.gz RVDWTIVTMVNTJQ-AWEZNQCLSA-N 0 0 371.412 3.868 20 5 FHBDRN CCN(C(=O)Cc1cccc([N+](=O)[O-])c1C)[C@@H]1CCCc2cccnc21 ZINC000365030848 940045373 /nfs/dbraw/zinc/04/53/73/940045373.db2.gz SWECXDUUDHQHRK-GOSISDBHSA-N 0 0 353.422 3.767 20 5 FHBDRN O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1CCC([C@H]2CCCOC2)CC1 ZINC000365037348 940045697 /nfs/dbraw/zinc/04/56/97/940045697.db2.gz HNQHHEHDKROFFP-ZDUSSCGKSA-N 0 0 352.818 3.527 20 5 FHBDRN COc1cc(C(=O)N2CC=C(c3cnccc3C)CC2)cc([N+](=O)[O-])c1C ZINC000365085941 940053303 /nfs/dbraw/zinc/05/33/03/940053303.db2.gz LZDLATGKLINBBK-UHFFFAOYSA-N 0 0 367.405 3.545 20 5 FHBDRN CCc1nn(C)cc1-c1noc(-c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)n1 ZINC000426587507 945292992 /nfs/dbraw/zinc/29/29/92/945292992.db2.gz REWCCHCSNAANSJ-UHFFFAOYSA-N 0 0 355.398 3.905 20 5 FHBDRN COc1ccccc1CN(C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000411516288 940056912 /nfs/dbraw/zinc/05/69/12/940056912.db2.gz XNPHUGYVZRBKEU-RBUKOAKNSA-N 0 0 366.417 3.898 20 5 FHBDRN Cc1nc(-c2cccc(NC(=O)Cc3ccccc3[N+](=O)[O-])c2)[nH]c1C ZINC000365099647 940056985 /nfs/dbraw/zinc/05/69/85/940056985.db2.gz BNEVBBJWLVTXDY-UHFFFAOYSA-N 0 0 350.378 3.783 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@H]1CC(C)(C)Oc2ccccc21 ZINC000411522825 940057828 /nfs/dbraw/zinc/05/78/28/940057828.db2.gz FTAOBZHWFFQDDE-INIZCTEOSA-N 0 0 370.405 3.565 20 5 FHBDRN C[C@H](C(=O)Nc1cccc(Cn2cccn2)c1)c1ccc([N+](=O)[O-])cc1F ZINC000612455912 940078404 /nfs/dbraw/zinc/07/84/04/940078404.db2.gz VWVPCKSTAMMWKW-ZDUSSCGKSA-N 0 0 368.368 3.721 20 5 FHBDRN O=C(c1cc(N2CC3C[C@@H]4CC2C[C@H](C3)C4)ccc1[N+](=O)[O-])N1CCCC1 ZINC000065946775 940088393 /nfs/dbraw/zinc/08/83/93/940088393.db2.gz JHHFSFVTKWMJLR-SFYZZRBRSA-N 0 0 369.465 3.846 20 5 FHBDRN CC(C)CCSc1ccc(C(=O)NCC(C)(C)CCO)cc1[N+](=O)[O-] ZINC000448255543 940090278 /nfs/dbraw/zinc/09/02/78/940090278.db2.gz JENXJHQVBDKXFS-UHFFFAOYSA-N 0 0 368.499 3.871 20 5 FHBDRN O=C(Nc1ccnn1C1CCCCC1)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000124424666 945295402 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FHBDRN CC(C)(C(=O)N[C@@H]1C[C@]1(C)c1ccccc1)c1ccc([N+](=O)[O-])cc1F ZINC000612997929 940386108 /nfs/dbraw/zinc/38/61/08/940386108.db2.gz UGPAFZFCFFECLE-YLJYHZDGSA-N 0 0 356.397 3.858 20 5 FHBDRN Nc1ccc(C(=O)Nc2ccccc2-c2nc3ccccc3[nH]2)cc1[N+](=O)[O-] ZINC000066279329 940391026 /nfs/dbraw/zinc/39/10/26/940391026.db2.gz NGOBBDNLPNQCNO-UHFFFAOYSA-N 0 0 373.372 3.973 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)NCc2cccc(-c3ccc(C)cc3)c2)n1 ZINC000427360724 945314915 /nfs/dbraw/zinc/31/49/15/945314915.db2.gz BERADWZSKYETGU-UHFFFAOYSA-N 0 0 364.405 3.717 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1C[C@H](C)Oc2ccc(Cl)cc21 ZINC000427361595 945314922 /nfs/dbraw/zinc/31/49/22/945314922.db2.gz YBPDPBGZUYAEEK-JTQLQIEISA-N 0 0 362.769 3.685 20 5 FHBDRN Cc1cc(N2CCCN(c3cccc(Cl)c3C)CC2)ncc1[N+](=O)[O-] ZINC000579936089 940421919 /nfs/dbraw/zinc/42/19/19/940421919.db2.gz GDGKTWYSOLIUKA-UHFFFAOYSA-N 0 0 360.845 3.977 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N1CCOC[C@@H]1c1ccccc1 ZINC000580012264 940430595 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CCN(Cc1ccc2c(c1)OCO2)C(=O)C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000431743811 940456642 /nfs/dbraw/zinc/45/66/42/940456642.db2.gz KESCEPRXRZMWBI-UHFFFAOYSA-N 0 0 370.405 3.650 20 5 FHBDRN COC(=O)Nc1ccc(C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000177833572 940459140 /nfs/dbraw/zinc/45/91/40/940459140.db2.gz XCNBAYJXBWWZLK-LBPRGKRZSA-N 0 0 357.366 3.573 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC1CCN(C(=O)c2cc(Cl)c[nH]2)CC1 ZINC000376204386 940461216 /nfs/dbraw/zinc/46/12/16/940461216.db2.gz ALKFNUADTWDMIU-UHFFFAOYSA-N 0 0 362.817 3.601 20 5 FHBDRN Cc1ncccc1CC(=O)N(C)c1nc(-c2ccccc2[N+](=O)[O-])cs1 ZINC000580121600 940461591 /nfs/dbraw/zinc/46/15/91/940461591.db2.gz SJLFWDSABHCIIV-UHFFFAOYSA-N 0 0 368.418 3.627 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)c1ncsc1C(F)(F)F ZINC000548995811 940462609 /nfs/dbraw/zinc/46/26/09/940462609.db2.gz OIBYFAWZXAIKTC-UHFFFAOYSA-N 0 0 361.301 3.721 20 5 FHBDRN CCCN([C@@H]1CCc2ccccc21)S(=O)(=O)c1cccc([N+](=O)[O-])c1 ZINC000546170689 945322926 /nfs/dbraw/zinc/32/29/26/945322926.db2.gz WXZXRDMYMXGUIG-GOSISDBHSA-N 0 0 360.435 3.683 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])cc2c1OCCO2)N1CCC2(CCCCC2)CC1 ZINC000066364124 940467567 /nfs/dbraw/zinc/46/75/67/940467567.db2.gz LAPLLPQHOBUZHR-UHFFFAOYSA-N 0 0 360.410 3.553 20 5 FHBDRN CC(C)(C)CC[C@H]1NC(=O)N(CCc2ccc(Cl)cc2[N+](=O)[O-])C1=O ZINC000431750737 940467971 /nfs/dbraw/zinc/46/79/71/940467971.db2.gz BRSZAJMPTCNOTC-CYBMUJFWSA-N 0 0 367.833 3.537 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)Sc1nnc(-c2ccccn2)n1C ZINC000180093536 940470062 /nfs/dbraw/zinc/47/00/62/940470062.db2.gz JNXTXQUITIUZDN-GFCCVEGCSA-N 0 0 355.423 3.947 20 5 FHBDRN CC(C)CCSc1ccc(C(=O)NC[C@](C)(O)C2CC2)cc1[N+](=O)[O-] ZINC000440213955 945323310 /nfs/dbraw/zinc/32/33/10/945323310.db2.gz IGOHPHCRKILAJJ-SFHVURJKSA-N 0 0 366.483 3.624 20 5 FHBDRN Cc1cc(C)cc(CCNC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000511439037 940471137 /nfs/dbraw/zinc/47/11/37/940471137.db2.gz NVJDRRJUBNFSDF-UHFFFAOYSA-N 0 0 355.438 3.638 20 5 FHBDRN Cc1nn(CC(C)C)c(C)c1CC(=O)Oc1cc(Cl)ccc1[N+](=O)[O-] ZINC000124840132 945323471 /nfs/dbraw/zinc/32/34/71/945323471.db2.gz SAEDQLGJOSHARG-UHFFFAOYSA-N 0 0 365.817 3.866 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N1CC[C@H](C2CCOCC2)C1 ZINC000376210996 940473074 /nfs/dbraw/zinc/47/30/74/940473074.db2.gz MRGQOGVVYUVSKX-LBPRGKRZSA-N 0 0 353.806 3.529 20 5 FHBDRN C[C@@H]1CC[C@@H](c2ccccc2)N(c2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])C1 ZINC000580424632 940474626 /nfs/dbraw/zinc/47/46/26/940474626.db2.gz RDMGXBPOWLWBJN-PBHICJAKSA-N 0 0 374.462 3.976 20 5 FHBDRN CO[C@H]1CCCN(c2ccc([N+](=O)[O-])c(OCc3ccccc3)n2)CC1 ZINC000613183126 940478665 /nfs/dbraw/zinc/47/86/65/940478665.db2.gz UHUPQWKUEONEBY-INIZCTEOSA-N 0 0 357.410 3.574 20 5 FHBDRN CC1(C)CN(c2ccc([N+](=O)[O-])c(OCc3ccccc3)n2)CCCO1 ZINC000613180840 940480323 /nfs/dbraw/zinc/48/03/23/940480323.db2.gz LLJLORMIBJNXFP-UHFFFAOYSA-N 0 0 357.410 3.574 20 5 FHBDRN COc1cc(Cc2noc(C[C@@H]3CCC[C@H]3C)n2)c([N+](=O)[O-])c(OC)c1 ZINC000580601786 940482086 /nfs/dbraw/zinc/48/20/86/940482086.db2.gz QJIOMUQYMOQTRF-NEPJUHHUSA-N 0 0 361.398 3.565 20 5 FHBDRN Cn1ccc2c1cccc2C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000540899808 940486079 /nfs/dbraw/zinc/48/60/79/940486079.db2.gz SLLDHETVIZURSD-UHFFFAOYSA-N 0 0 357.797 3.712 20 5 FHBDRN COc1cc(OC)cc(-c2noc(-c3cc(OC)c(C)c([N+](=O)[O-])c3)n2)c1 ZINC000580919148 940488814 /nfs/dbraw/zinc/48/88/14/940488814.db2.gz MIMWSQAJTNIYFM-UHFFFAOYSA-N 0 0 371.349 3.646 20 5 FHBDRN O=[N+]([O-])c1cccc(OCc2nc(-c3ccccc3OC(F)F)no2)c1 ZINC000511455677 940489545 /nfs/dbraw/zinc/48/95/45/940489545.db2.gz TUMOKTHCDVDTHV-UHFFFAOYSA-N 0 0 363.276 3.825 20 5 FHBDRN CCc1ccc([C@@H]2CN(C(=O)[C@H](C)c3cccc([N+](=O)[O-])c3)CCO2)cc1 ZINC000580986437 940491480 /nfs/dbraw/zinc/49/14/80/940491480.db2.gz PHRXKUCHAHOXCR-QRWLVFNGSA-N 0 0 368.433 3.861 20 5 FHBDRN COc1cc(CSCCC(C)(C)O)c([N+](=O)[O-])cc1OCC(F)F ZINC000581021884 940492078 /nfs/dbraw/zinc/49/20/78/940492078.db2.gz CWHCGHITKRYOTK-UHFFFAOYSA-N 0 0 365.398 3.642 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2C[C@H](C)Oc3cc(F)ccc32)c1 ZINC000549010649 940493907 /nfs/dbraw/zinc/49/39/07/940493907.db2.gz WYMJSOLQOYRVCR-NSHDSACASA-N 0 0 360.341 3.560 20 5 FHBDRN COc1cc(CNc2ccc(C)c(NC(C)=O)c2C)c([N+](=O)[O-])cc1F ZINC000613273312 940499156 /nfs/dbraw/zinc/49/91/56/940499156.db2.gz XSWAHQDFEUZGMQ-UHFFFAOYSA-N 0 0 361.373 3.930 20 5 FHBDRN CC(C)[C@H](C)NC(=O)C1CCN(Cc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000163513742 940500031 /nfs/dbraw/zinc/50/00/31/940500031.db2.gz ROLBSBQLWDMLQY-ZDUSSCGKSA-N 0 0 367.877 3.621 20 5 FHBDRN Cc1cccc(C(=O)NCCc2ccc(Br)cc2)c1[N+](=O)[O-] ZINC000172175247 940502794 /nfs/dbraw/zinc/50/27/94/940502794.db2.gz RRTCGCKVLHCGQN-UHFFFAOYSA-N 0 0 363.211 3.638 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])N1CCCc2cc(F)c(F)cc21 ZINC000077619310 940504973 /nfs/dbraw/zinc/50/49/73/940504973.db2.gz XRSCXZOQOCFUKG-UHFFFAOYSA-N 0 0 362.332 3.621 20 5 FHBDRN Cc1nccc(NC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)c1Cl ZINC000124773517 945328173 /nfs/dbraw/zinc/32/81/73/945328173.db2.gz IZWKYIUAMMAJOP-UHFFFAOYSA-N 0 0 371.784 3.604 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N(Cc1ccccc1)CC(F)F ZINC000427403147 945329389 /nfs/dbraw/zinc/32/93/89/945329389.db2.gz GYUCECVKZCLCNM-UHFFFAOYSA-N 0 0 350.321 3.511 20 5 FHBDRN O=C(c1ccc(F)cc1OC(F)F)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000427385665 945330563 /nfs/dbraw/zinc/33/05/63/945330563.db2.gz YFGDPFPARYFLLI-UHFFFAOYSA-N 0 0 352.268 3.538 20 5 FHBDRN C[C@@H](Sc1ccccc1Cl)C(=O)N(C)c1ccc([N+](=O)[O-])nc1 ZINC000581690240 940589031 /nfs/dbraw/zinc/58/90/31/940589031.db2.gz ARINOZHILCMOLU-SNVBAGLBSA-N 0 0 351.815 3.787 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)N[C@H]2C[C@@H]3CCC(C)(C)c4cccc2c43)n1 ZINC000427388868 945334360 /nfs/dbraw/zinc/33/43/60/945334360.db2.gz CHBSHFPZGLIPIV-WFASDCNBSA-N 0 0 368.437 3.841 20 5 FHBDRN CCCc1ccc(NC(=O)C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000178066786 940632807 /nfs/dbraw/zinc/63/28/07/940632807.db2.gz NQWRUSPJFOAGNG-AWEZNQCLSA-N 0 0 369.421 3.672 20 5 FHBDRN CSCc1ccc(NC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)cc1 ZINC000066551026 940639548 /nfs/dbraw/zinc/63/95/48/940639548.db2.gz FYBCFAOQTRJQIY-UHFFFAOYSA-N 0 0 368.418 3.896 20 5 FHBDRN Cn1cnc([N+](=O)[O-])c1NCCOc1c(Cl)cc(Cl)cc1Cl ZINC000431816086 940643361 /nfs/dbraw/zinc/64/33/61/940643361.db2.gz ZAVWJXAEEHSPHW-UHFFFAOYSA-N 0 0 365.604 3.779 20 5 FHBDRN Cc1cnc(OCC(=O)N(C)[C@H](C)c2cc3ccccc3o2)c([N+](=O)[O-])c1 ZINC000426611406 945337083 /nfs/dbraw/zinc/33/70/83/945337083.db2.gz RMMGOYNIRAQTOH-CYBMUJFWSA-N 0 0 369.377 3.643 20 5 FHBDRN COc1cc(CN2CCCO[C@H](c3ccccc3)C2)c([N+](=O)[O-])cc1F ZINC000613379023 940650575 /nfs/dbraw/zinc/65/05/75/940650575.db2.gz VHYTWRJQRKGZKX-IBGZPJMESA-N 0 0 360.385 3.706 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)NCC(C)(C)c1cccs1 ZINC000511499493 940654469 /nfs/dbraw/zinc/65/44/69/940654469.db2.gz STPAHPOBHJHQOA-UHFFFAOYSA-N 0 0 361.467 3.818 20 5 FHBDRN CC(C)(C)c1ncc(C(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)s1 ZINC000582479941 940667978 /nfs/dbraw/zinc/66/79/78/940667978.db2.gz ZGHHUHPJLIQXGV-UHFFFAOYSA-N 0 0 372.450 3.803 20 5 FHBDRN CCc1nc(CS(=O)(=O)[C@@H](C)c2cc([N+](=O)[O-])ccc2C)cs1 ZINC000180139511 940679952 /nfs/dbraw/zinc/67/99/52/940679952.db2.gz ADRNBTCYTVDIML-NSHDSACASA-N 0 0 354.453 3.598 20 5 FHBDRN C[C@H]1CC(CCNC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)C[C@H](C)O1 ZINC000549019675 940690513 /nfs/dbraw/zinc/69/05/13/940690513.db2.gz UYYPBNYJJNIFJO-QWRGUYRKSA-N 0 0 372.368 3.520 20 5 FHBDRN Cc1oc2ccccc2c1CNCc1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000613426362 940693281 /nfs/dbraw/zinc/69/32/81/940693281.db2.gz FZVHCGGFCFRGHI-UHFFFAOYSA-N 0 0 354.362 3.710 20 5 FHBDRN Cc1c(CC(=O)N[C@@H]2C[C@H]2c2c(F)cccc2Cl)cccc1[N+](=O)[O-] ZINC000124902728 945347119 /nfs/dbraw/zinc/34/71/19/945347119.db2.gz QBKZHBZHBKZYOE-IUODEOHRSA-N 0 0 362.788 3.911 20 5 FHBDRN Cc1ccc(C(C)(C)CNC(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)cc1 ZINC000582569394 940738298 /nfs/dbraw/zinc/73/82/98/940738298.db2.gz ULEDYWMYVUAWRV-UHFFFAOYSA-N 0 0 362.376 3.818 20 5 FHBDRN CC(C)(CNC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)C(F)(F)F ZINC000549028166 940751558 /nfs/dbraw/zinc/75/15/58/940751558.db2.gz MVXCOPDCYDZHMT-UHFFFAOYSA-N 0 0 356.247 3.515 20 5 FHBDRN Cc1c(NC(=O)[C@@H](C)OC(=O)c2ccc3c(c2)CCC3)cccc1[N+](=O)[O-] ZINC000024339717 940751878 /nfs/dbraw/zinc/75/18/78/940751878.db2.gz MMPZNKFPEUACSW-CYBMUJFWSA-N 0 0 368.389 3.576 20 5 FHBDRN Cc1nc([C@H](NCc2csc([N+](=O)[O-])c2)c2ccc(Cl)cc2)no1 ZINC000180191396 940787962 /nfs/dbraw/zinc/78/79/62/940787962.db2.gz WLOJVMOTQCOQNB-CQSZACIVSA-N 0 0 364.814 3.880 20 5 FHBDRN Cc1cccc2[nH]c(CCC(=O)Nc3cc([N+](=O)[O-])c(C)cc3C)nc21 ZINC000174931682 940793633 /nfs/dbraw/zinc/79/36/33/940793633.db2.gz DZVMZHHALNXZAL-UHFFFAOYSA-N 0 0 352.394 3.968 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CCSC(CC)(CC)C2)c1 ZINC000549040339 940805176 /nfs/dbraw/zinc/80/51/76/940805176.db2.gz VAQWJQRUMXYSOW-UHFFFAOYSA-N 0 0 352.456 3.741 20 5 FHBDRN O=C(C[C@@H](O)c1ccc(Cl)cc1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000180197537 940806358 /nfs/dbraw/zinc/80/63/58/940806358.db2.gz UBLAHAAWNGCEBU-GOSISDBHSA-N 0 0 374.824 3.863 20 5 FHBDRN C[C@H](NC(=O)c1ccc(N2CCCC2)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000106624810 945350083 /nfs/dbraw/zinc/35/00/83/945350083.db2.gz HLWTZNMKYKRBIC-ZDUSSCGKSA-N 0 0 357.385 3.825 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H]1SCCc2sccc21 ZINC000175071364 940807071 /nfs/dbraw/zinc/80/70/71/940807071.db2.gz CMPBNODWSQVDIM-AWEZNQCLSA-N 0 0 350.421 3.634 20 5 FHBDRN O=C(CSc1ccc(Cl)cc1)NCCOc1ccc([N+](=O)[O-])cc1 ZINC000609455024 940817917 /nfs/dbraw/zinc/81/79/17/940817917.db2.gz RQFIXEXHLCBDCX-UHFFFAOYSA-N 0 0 366.826 3.536 20 5 FHBDRN CCc1nn(C)cc1-c1noc(-c2cc3cc([N+](=O)[O-])ccc3s2)n1 ZINC000426617144 945351687 /nfs/dbraw/zinc/35/16/87/945351687.db2.gz DFHGWKFQJPPKSP-UHFFFAOYSA-N 0 0 355.379 3.822 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000180219604 940829068 /nfs/dbraw/zinc/82/90/68/940829068.db2.gz PBFAXKKOSAFIOV-MAZHCROVSA-N 0 0 364.467 3.639 20 5 FHBDRN CSc1ccc(C(=O)NC[C@H](c2cccnc2)C(C)C)cc1[N+](=O)[O-] ZINC000175297066 940837712 /nfs/dbraw/zinc/83/77/12/940837712.db2.gz XDCSPLWQWCEELJ-HNNXBMFYSA-N 0 0 359.451 3.881 20 5 FHBDRN CCOc1ccc([C@@H](C)NCc2nccc(C(F)(F)F)n2)cc1[N+](=O)[O-] ZINC000414256742 940844499 /nfs/dbraw/zinc/84/44/99/940844499.db2.gz ODLUXVKCXVNELJ-SNVBAGLBSA-N 0 0 370.331 3.653 20 5 FHBDRN CC(C)[C@@H](CNC(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1)c1cccnc1 ZINC000175379406 940857736 /nfs/dbraw/zinc/85/77/36/940857736.db2.gz CWUPBRCKUCVPRL-RDTXWAMCSA-N 0 0 356.426 3.790 20 5 FHBDRN O=C(NCc1ccc(CO)c(F)c1)c1cc2ccccc2c2cccnc12 ZINC000170854256 940858434 /nfs/dbraw/zinc/85/84/34/940858434.db2.gz ULWXSTXNSHVMDX-UHFFFAOYSA-N 0 0 360.388 3.949 20 5 FHBDRN C[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccc(-n2cccn2)cc1 ZINC000175451493 940865755 /nfs/dbraw/zinc/86/57/55/940865755.db2.gz OHHAGMBKHGJIRN-GFCCVEGCSA-N 0 0 370.796 3.925 20 5 FHBDRN CC(C)CCN(CCC(C)C)C(=O)C(=O)Nc1cc(F)cc([N+](=O)[O-])c1 ZINC000472570137 940868893 /nfs/dbraw/zinc/86/88/93/940868893.db2.gz ZWFYWHQCQOGVBD-UHFFFAOYSA-N 0 0 367.421 3.593 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N1CCS[C@@H]2CCCC[C@H]21 ZINC000175442447 940870320 /nfs/dbraw/zinc/87/03/20/940870320.db2.gz SGXHRMXHASACLS-HUUCEWRRSA-N 0 0 354.859 3.677 20 5 FHBDRN O=C(N[C@H]1CCO[C@@H]1c1ccc(Cl)c(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000180246462 940875135 /nfs/dbraw/zinc/87/51/35/940875135.db2.gz RQWFYSYAJCICOU-JKSUJKDBSA-N 0 0 364.760 3.647 20 5 FHBDRN CC1(C)Cc2cccc(Oc3cc4c(cc3[N+](=O)[O-])CCC(=O)N4)c2O1 ZINC000506805874 945357021 /nfs/dbraw/zinc/35/70/21/945357021.db2.gz JGSJDVCLJWJJPR-UHFFFAOYSA-N 0 0 354.362 3.985 20 5 FHBDRN C[C@@H]1CSc2ccccc2N1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000472574662 940891759 /nfs/dbraw/zinc/89/17/59/940891759.db2.gz QQXZCGUVMMFDKM-CYBMUJFWSA-N 0 0 357.435 3.558 20 5 FHBDRN Cc1c(NC(=O)[C@@H](C)Nc2ccc3scnc3c2)cccc1[N+](=O)[O-] ZINC000171116126 940891854 /nfs/dbraw/zinc/89/18/54/940891854.db2.gz KOCQZNQNPKDRHV-LLVKDONJSA-N 0 0 356.407 3.952 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N2CCc3ccccc3[C@@H]2C)cc1OC ZINC000106681845 945361652 /nfs/dbraw/zinc/36/16/52/945361652.db2.gz ZMGGWVPFVVSBRF-ZDUSSCGKSA-N 0 0 370.405 3.762 20 5 FHBDRN C[S@@](=O)Cc1ccccc1NCc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000186084324 940948273 /nfs/dbraw/zinc/94/82/73/940948273.db2.gz LINLYPYUINHFJC-AREMUKBSSA-N 0 0 371.418 3.740 20 5 FHBDRN O=C(Nc1cccc(-c2cc[nH]n2)c1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000180330819 940973307 /nfs/dbraw/zinc/97/33/07/940973307.db2.gz BEFUKSFYXYOOCD-UHFFFAOYSA-N 0 0 374.303 3.839 20 5 FHBDRN CNc1ccc(C(=O)N2CCC[C@@H]2/C=C/c2ccccc2)cc1[N+](=O)[O-] ZINC000540956838 940993473 /nfs/dbraw/zinc/99/34/73/940993473.db2.gz WAJWDXQYOSXRGY-QXLXQBSBSA-N 0 0 351.406 3.955 20 5 FHBDRN COc1ccccc1[C@@H](C)CC(=O)OCCOc1ccc([N+](=O)[O-])cc1 ZINC000728660617 941002745 /nfs/dbraw/zinc/00/27/45/941002745.db2.gz DKAODZOQUFWOFK-AWEZNQCLSA-N 0 0 359.378 3.719 20 5 FHBDRN Cc1cc(-c2noc(CN[C@H](C)c3cccc([N+](=O)[O-])c3)n2)ccc1F ZINC000180396314 941003838 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C[C@@H]1CCCN(C(=O)c2ccc(N3C[C@@H](C)C[C@H](C)C3)c([N+](=O)[O-])c2)C1 ZINC000255942032 941097020 /nfs/dbraw/zinc/09/70/20/941097020.db2.gz BCJIMJBZBQIPPD-PMPSAXMXSA-N 0 0 359.470 3.949 20 5 FHBDRN CC(C)(C)c1ncc(NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)cn1 ZINC000180982603 941098620 /nfs/dbraw/zinc/09/86/20/941098620.db2.gz NMKLLVVNBHEYHL-UHFFFAOYSA-N 0 0 366.324 3.536 20 5 FHBDRN CC(=O)Nc1ccc(C)c(C(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000188833387 941099106 /nfs/dbraw/zinc/09/91/06/941099106.db2.gz ADMICCBSXCKLKI-UHFFFAOYSA-N 0 0 367.405 3.666 20 5 FHBDRN COc1ccc2c(c1)C[C@H](C)N(C(=O)COc1ccc([N+](=O)[O-])cc1)[C@H]2C ZINC000541005590 941101493 /nfs/dbraw/zinc/10/14/93/941101493.db2.gz OFNSKZPXXWRKQM-KBPBESRZSA-N 0 0 370.405 3.517 20 5 FHBDRN COc1cc(C(=O)N(c2cccc(F)c2)C2CCOCC2)ccc1[N+](=O)[O-] ZINC000180998493 941101733 /nfs/dbraw/zinc/10/17/33/941101733.db2.gz UNSRGUYNQDZWBD-UHFFFAOYSA-N 0 0 374.368 3.568 20 5 FHBDRN CC(C)CCOc1ccccc1CNC(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000181010869 941102739 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CC[C@@](C)(O)CN(Cc1ccccc1)C(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000189459055 941158242 /nfs/dbraw/zinc/15/82/42/941158242.db2.gz NJMODVODHYFAPR-OAQYLSRUSA-N 0 0 370.449 3.717 20 5 FHBDRN CC[C@@](C)(O)CN(Cc1ccccc1)C(=O)c1ccc([N+](=O)[O-])cc1F ZINC000189474871 941158784 /nfs/dbraw/zinc/15/87/84/941158784.db2.gz DSXYTFJROHVAFU-LJQANCHMSA-N 0 0 360.385 3.537 20 5 FHBDRN CC[C@](C)(O)CN(Cc1ccccc1)C(=O)c1cc([N+](=O)[O-])ccc1C ZINC000189495844 941159366 /nfs/dbraw/zinc/15/93/66/941159366.db2.gz BKLJZVOVUWCOFE-FQEVSTJZSA-N 0 0 356.422 3.707 20 5 FHBDRN COCCc1ccccc1NC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000189590985 941166512 /nfs/dbraw/zinc/16/65/12/941166512.db2.gz VKKIIAJJCLJJDL-UHFFFAOYSA-N 0 0 369.421 3.980 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)Nc1cccc2ccn(C)c21 ZINC000189593115 941166622 /nfs/dbraw/zinc/16/66/22/941166622.db2.gz UAHDBXWHCFZOEF-GFCCVEGCSA-N 0 0 368.393 3.534 20 5 FHBDRN O=C(N[C@H]1CCOc2c(F)cccc21)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000189634335 941235408 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FHBDRN COc1cc(C(=O)N2C[C@@H](C)Oc3c(Cl)cccc32)ccc1[N+](=O)[O-] ZINC000189836350 941286934 /nfs/dbraw/zinc/28/69/34/941286934.db2.gz UZNIPLBRYMJTMI-SNVBAGLBSA-N 0 0 362.769 3.685 20 5 FHBDRN Cc1cc(C(F)(F)F)ccc1CNC(=O)c1ccc(F)cc1[N+](=O)[O-] ZINC000189846844 941288441 /nfs/dbraw/zinc/28/84/41/941288441.db2.gz DXOMWMWLQMTRCS-UHFFFAOYSA-N 0 0 356.275 3.991 20 5 FHBDRN CCC(CC)c1nnc(NC(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)s1 ZINC000189884303 941293631 /nfs/dbraw/zinc/29/36/31/941293631.db2.gz HEPOBYXNXKNFAZ-UHFFFAOYSA-N 0 0 364.427 3.919 20 5 FHBDRN Cc1cc(NCCNC(=O)c2cccs2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000549108631 941308436 /nfs/dbraw/zinc/30/84/36/941308436.db2.gz JGYLSQUOOVKDRB-UHFFFAOYSA-N 0 0 373.356 3.825 20 5 FHBDRN CC1(C)CN(C(=O)c2ccc([N+](=O)[O-])cc2Cl)CC2(CCCC2)O1 ZINC000189954114 941312636 /nfs/dbraw/zinc/31/26/36/941312636.db2.gz ANALOPJQGNCRJB-UHFFFAOYSA-N 0 0 352.818 3.812 20 5 FHBDRN CCC(CC)[C@H]1C[C@@H](NC(=O)Nc2cc([N+](=O)[O-])ccc2OC)CCO1 ZINC000181492546 941336340 /nfs/dbraw/zinc/33/63/40/941336340.db2.gz DXOSJJYICXVZCE-SUMWQHHRSA-N 0 0 365.430 3.709 20 5 FHBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1C[C@H]2CCC[C@@H]2C1 ZINC000408006185 941342785 /nfs/dbraw/zinc/34/27/85/941342785.db2.gz WOAATBWOYBTLJI-GHMZBOCLSA-N 0 0 353.216 3.538 20 5 FHBDRN COc1cc(C(=O)Nc2ccc(OC)c3ncccc23)cc([N+](=O)[O-])c1C ZINC000190017545 941345899 /nfs/dbraw/zinc/34/58/99/941345899.db2.gz CFDKXHJIXKEGQI-UHFFFAOYSA-N 0 0 367.361 3.721 20 5 FHBDRN CC(C)[C@H]1N(Cc2cc([N+](=O)[O-])ccc2OC(F)F)CC12CCOCC2 ZINC000414521688 941371534 /nfs/dbraw/zinc/37/15/34/941371534.db2.gz FGSCNQBLCNCPDO-MRXNPFEDSA-N 0 0 370.396 3.833 20 5 FHBDRN COCCSc1ccc([C@@H](C)NC(=O)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000103406014 941392664 /nfs/dbraw/zinc/39/26/64/941392664.db2.gz TYPWRYQTZYKLIU-CQSZACIVSA-N 0 0 374.462 3.753 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCC1(c2ccccn2)CCC1 ZINC000376793537 941432373 /nfs/dbraw/zinc/43/23/73/941432373.db2.gz SMPKRPIAQIFVGP-UHFFFAOYSA-N 0 0 354.410 3.850 20 5 FHBDRN CC(C)CCC[C@H](C)NC(=O)COC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000008070336 941465494 /nfs/dbraw/zinc/46/54/94/941465494.db2.gz GSHQPBAFKZWHJC-LBPRGKRZSA-N 0 0 370.833 3.736 20 5 FHBDRN CC(=O)Nc1cc(N[C@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)ccc1C ZINC000472649206 941471073 /nfs/dbraw/zinc/47/10/73/941471073.db2.gz TXDKLCBDQRMWNC-RDJZCZTQSA-N 0 0 357.414 3.654 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@@H](C[C@H]2CCOC2)C1 ZINC000376948892 941474986 /nfs/dbraw/zinc/47/49/86/941474986.db2.gz MPFJRTSXVUEWBK-IPMKNSEASA-N 0 0 374.481 3.829 20 5 FHBDRN CC(=O)N1C[C@@H](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)c2ccccc21 ZINC000376955864 941477244 /nfs/dbraw/zinc/47/72/44/941477244.db2.gz PZJUCJTYFDVVCW-CYBMUJFWSA-N 0 0 371.368 3.603 20 5 FHBDRN CC(C)(C)Oc1cc(N2CCSC3(CCOCC3)C2)ccc1[N+](=O)[O-] ZINC000472669440 941537131 /nfs/dbraw/zinc/53/71/31/941537131.db2.gz CVBSIGCVLJFOSL-UHFFFAOYSA-N 0 0 366.483 3.875 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N1CCC[C@H]1c1cccc2c1OCCO2 ZINC000066769421 941540659 /nfs/dbraw/zinc/54/06/59/941540659.db2.gz FYISRCXPHMBLQJ-KRWDZBQOSA-N 0 0 368.389 3.652 20 5 FHBDRN CC(=O)c1ccc([N+](=O)[O-])cc1N1CC[C@H](n2ncc3ccccc32)C1 ZINC000377193264 941551527 /nfs/dbraw/zinc/55/15/27/941551527.db2.gz QQVXPIALSQUELJ-INIZCTEOSA-N 0 0 350.378 3.599 20 5 FHBDRN Cc1occc1CN(C)c1nnc(-c2cccc([N+](=O)[O-])c2)n1C1CC1 ZINC000565128073 941565443 /nfs/dbraw/zinc/56/54/43/941565443.db2.gz PWPVWMWMQRWINS-UHFFFAOYSA-N 0 0 353.382 3.726 20 5 FHBDRN Cn1ccc([C@H](NC(=O)c2ccccc2[N+](=O)[O-])c2ccc(Cl)cc2)n1 ZINC000377233269 941585203 /nfs/dbraw/zinc/58/52/03/941585203.db2.gz RXKVCNIRRADDRZ-QGZVFWFLSA-N 0 0 370.796 3.501 20 5 FHBDRN COCCN(C(=O)Nc1ccc(OC)c([N+](=O)[O-])c1)[C@H](C)c1ccccc1 ZINC000541107686 941593737 /nfs/dbraw/zinc/59/37/37/941593737.db2.gz UMJBMCOCCWHJKS-CQSZACIVSA-N 0 0 373.409 3.845 20 5 FHBDRN Cc1csc([C@H](C)NCc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)n1 ZINC000892854302 941621850 /nfs/dbraw/zinc/62/18/50/941621850.db2.gz BJOOLVXWYGCSRY-LBPRGKRZSA-N 0 0 357.439 3.611 20 5 FHBDRN O=C(N[C@@H](Cc1ccccc1Cl)c1ccccc1)c1c[nH]nc1[N+](=O)[O-] ZINC000549193716 941623155 /nfs/dbraw/zinc/62/31/55/941623155.db2.gz PWYSDCPFVFSOOS-INIZCTEOSA-N 0 0 370.796 3.685 20 5 FHBDRN O=C(c1coc2c1C(=O)CCC2)N1CCCCc2cc([N+](=O)[O-])ccc21 ZINC000892855813 941623175 /nfs/dbraw/zinc/62/31/75/941623175.db2.gz VTXNDPJHAXBEDO-UHFFFAOYSA-N 0 0 354.362 3.690 20 5 FHBDRN CCC[C@@H](Cc1ccccc1)N(CCC)C(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC001143491406 941626864 /nfs/dbraw/zinc/62/68/64/941626864.db2.gz MSQRNGPJPBXDPK-KRWDZBQOSA-N 0 0 371.437 3.959 20 5 FHBDRN CCOc1ncccc1-c1noc(C(C)(C)c2ccc([N+](=O)[O-])cc2F)n1 ZINC000565684297 941639692 /nfs/dbraw/zinc/63/96/92/941639692.db2.gz PJYMFUFNPPZNHJ-UHFFFAOYSA-N 0 0 372.356 3.904 20 5 FHBDRN Cc1cnn([C@H]2CCN(C(=O)c3cc([N+](=O)[O-])ccc3SC(C)C)C2)c1 ZINC000377329045 941645712 /nfs/dbraw/zinc/64/57/12/941645712.db2.gz FEEFZEFRSZFHRE-HNNXBMFYSA-N 0 0 374.466 3.687 20 5 FHBDRN C[C@H](CC(=O)N(c1cccc([N+](=O)[O-])c1)C1CCCC1)c1cnn(C)c1 ZINC000415164983 941647165 /nfs/dbraw/zinc/64/71/65/941647165.db2.gz YXXDPHUYHYHGPS-CQSZACIVSA-N 0 0 356.426 3.798 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)Nc2cccc(OCCF)c2)c1 ZINC000153905333 941655161 /nfs/dbraw/zinc/65/51/61/941655161.db2.gz DNDBTQJSVKBPPE-UHFFFAOYSA-N 0 0 362.357 3.659 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NCc2ccccc2OC(F)F)c1 ZINC000549213835 941655722 /nfs/dbraw/zinc/65/57/22/941655722.db2.gz OZENVDGREKIBEF-UHFFFAOYSA-N 0 0 366.320 3.525 20 5 FHBDRN CCCNC(=O)c1ccccc1NC(=O)c1cc(SC)ccc1[N+](=O)[O-] ZINC000024469895 941661279 /nfs/dbraw/zinc/66/12/79/941661279.db2.gz RMJJEEDZWLWVDF-UHFFFAOYSA-N 0 0 373.434 3.709 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)Nc2nnc(CC(C)C)s2)c1 ZINC000024469580 941661304 /nfs/dbraw/zinc/66/13/04/941661304.db2.gz MWKOHHAXJQLYDI-UHFFFAOYSA-N 0 0 352.441 3.619 20 5 FHBDRN O=C(Nc1cc(F)cc([N+](=O)[O-])c1)N1CC[C@@](F)(c2ccccc2F)C1 ZINC000549226846 941678049 /nfs/dbraw/zinc/67/80/49/941678049.db2.gz VJXPQMFDPYCNSH-KRWDZBQOSA-N 0 0 365.311 3.976 20 5 FHBDRN CCCCn1ncc(NC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)c1C ZINC000122399389 941713674 /nfs/dbraw/zinc/71/36/74/941713674.db2.gz BDMWLPKCPYEGIY-UHFFFAOYSA-N 0 0 350.806 3.734 20 5 FHBDRN Cc1cc(NC(=O)c2cccc([N+](=O)[O-])c2C)n(-c2ccccc2C)n1 ZINC000122400148 941713736 /nfs/dbraw/zinc/71/37/36/941713736.db2.gz PWEFNQHTLOMGFO-UHFFFAOYSA-N 0 0 350.378 3.958 20 5 FHBDRN COc1ccc(CNC(=O)c2cnc(-c3ccccc3)s2)cc1[N+](=O)[O-] ZINC000513165946 941715952 /nfs/dbraw/zinc/71/59/52/941715952.db2.gz NVJARHGQLDMYSY-UHFFFAOYSA-N 0 0 369.402 3.657 20 5 FHBDRN Cc1cc(C(=O)N2CCCC[C@@H]2c2nnc(C3CCC3)o2)cc([N+](=O)[O-])c1 ZINC000377438904 941723694 /nfs/dbraw/zinc/72/36/94/941723694.db2.gz WVRBCGUPHMIJDW-MRXNPFEDSA-N 0 0 370.409 3.921 20 5 FHBDRN CCc1sc(=O)n(CC(=O)c2cccc([N+](=O)[O-])c2)c1-c1ccccc1 ZINC000151137770 941724478 /nfs/dbraw/zinc/72/44/78/941724478.db2.gz FKFGWCNDAJFMBG-UHFFFAOYSA-N 0 0 368.414 3.930 20 5 FHBDRN CSc1cccc(C(=O)NCCCCC(=O)OC(C)(C)C)c1[N+](=O)[O-] ZINC000614449452 941734041 /nfs/dbraw/zinc/73/40/41/941734041.db2.gz SVNTTYDQYILELZ-UHFFFAOYSA-N 0 0 368.455 3.559 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCc1ccc2c(c1)CCCN2 ZINC000415299701 941737904 /nfs/dbraw/zinc/73/79/04/941737904.db2.gz QTRXNVHUVOULTJ-UHFFFAOYSA-N 0 0 354.410 3.891 20 5 FHBDRN Nc1ccc(C(=O)Nc2ccc(Oc3ccc(F)cc3)cn2)cc1[N+](=O)[O-] ZINC000729379927 941739804 /nfs/dbraw/zinc/73/98/04/941739804.db2.gz NMYQYDFHPKJIFZ-UHFFFAOYSA-N 0 0 368.324 3.756 20 5 FHBDRN O=C(Cn1ncc2ccc([N+](=O)[O-])cc21)N[C@@H](c1ccccc1)C1CCC1 ZINC000729379072 941742410 /nfs/dbraw/zinc/74/24/10/941742410.db2.gz NOKHBLLAMOIOGK-FQEVSTJZSA-N 0 0 364.405 3.602 20 5 FHBDRN Cc1nc([N+](=O)[O-])c(-c2noc([C@@H]3C[C@H]3c3ccc(Cl)s3)n2)n1C ZINC000377463240 941743436 /nfs/dbraw/zinc/74/34/36/941743436.db2.gz MBURGINUOHGHLP-HTQZYQBOSA-N 0 0 365.802 3.673 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1OC(=O)c1cccc(OC[C@H]2CCCO2)c1 ZINC000760013386 941748679 /nfs/dbraw/zinc/74/86/79/941748679.db2.gz ATJPXFDWZIRFAW-MRXNPFEDSA-N 0 0 357.362 3.680 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N[C@@H]2CCC[C@H]2c2ccccc2)c1F ZINC000412106948 941764578 /nfs/dbraw/zinc/76/45/78/941764578.db2.gz JFJHPZNAQLYRAI-GOEBONIOSA-N 0 0 372.396 3.738 20 5 FHBDRN COc1ccc(NC(=O)CSc2nccc3ccccc32)cc1[N+](=O)[O-] ZINC000541145026 941771779 /nfs/dbraw/zinc/77/17/79/941771779.db2.gz ZNQVGBFJFNJSBX-UHFFFAOYSA-N 0 0 369.402 3.882 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1F)N[C@H](C[C@H]1CCOC1)c1ccccc1 ZINC000122548488 941791641 /nfs/dbraw/zinc/79/16/41/941791641.db2.gz PGUJDTYFWPFCFM-AUUYWEPGSA-N 0 0 372.396 3.561 20 5 FHBDRN CS[C@@H]1CCC[C@@H](NC(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)C1 ZINC000412113543 941794696 /nfs/dbraw/zinc/79/46/96/941794696.db2.gz DALKJEPVXNCUJY-ZIAGYGMSSA-N 0 0 352.456 3.786 20 5 FHBDRN C[C@@H]1CCc2onc(C(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)c2C1 ZINC000433614877 941798637 /nfs/dbraw/zinc/79/86/37/941798637.db2.gz FDMBMPRNWJGOPU-MRVPVSSYSA-N 0 0 367.308 3.561 20 5 FHBDRN COc1ccc(CNc2cc(C(=O)NCC3CC3)ccc2C)cc1[N+](=O)[O-] ZINC000190361291 941808574 /nfs/dbraw/zinc/80/85/74/941808574.db2.gz UHPXHPPXYOAOST-UHFFFAOYSA-N 0 0 369.421 3.664 20 5 FHBDRN COc1ccc2oc(C)c(C(=O)Nc3n[nH]c4ccc([N+](=O)[O-])cc43)c2c1 ZINC000122584767 941817160 /nfs/dbraw/zinc/81/71/60/941817160.db2.gz JPEYQXIELTUFBV-UHFFFAOYSA-N 0 0 366.333 3.787 20 5 FHBDRN CC(C)N(CC(=O)N1CCCCCC1)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000513266162 941817288 /nfs/dbraw/zinc/81/72/88/941817288.db2.gz JEFIQMOTTSPRDR-UHFFFAOYSA-N 0 0 367.877 3.861 20 5 FHBDRN COc1ccc(NC(=O)N2CCC(c3cccc(N)c3)CC2)cc1[N+](=O)[O-] ZINC000415436394 941823296 /nfs/dbraw/zinc/82/32/96/941823296.db2.gz JLTCOIRKODFFLE-UHFFFAOYSA-N 0 0 370.409 3.597 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1C(F)(F)F)N1CCc2cc(F)ccc21 ZINC000513270950 941824706 /nfs/dbraw/zinc/82/47/06/941824706.db2.gz HIDFRCLDQNQNAK-UHFFFAOYSA-N 0 0 354.259 3.956 20 5 FHBDRN COCCOCc1cccc(NC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000047598779 941827124 /nfs/dbraw/zinc/82/71/24/941827124.db2.gz RWMSANLVFVSZDJ-AWEZNQCLSA-N 0 0 373.409 3.641 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CC[C@@H](Cc2ccccc2)C1 ZINC000412135640 941829269 /nfs/dbraw/zinc/82/92/69/941829269.db2.gz SZUKYOZPFUTJCZ-FFZOFVMBSA-N 0 0 350.418 3.790 20 5 FHBDRN CCN(Cc1ccccc1Cl)C(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-] ZINC000433683659 941833141 /nfs/dbraw/zinc/83/31/41/941833141.db2.gz OPAICLLPUOWLHH-UHFFFAOYSA-N 0 0 350.806 3.757 20 5 FHBDRN Cc1cccnc1[C@H](NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)C(C)C ZINC000412138902 941833632 /nfs/dbraw/zinc/83/36/32/941833632.db2.gz RCDXPOFOXUVTDL-RCCFBDPRSA-N 0 0 353.422 3.915 20 5 FHBDRN Cc1nn(Cc2ccc(C(=O)Oc3ccc(F)cc3)cc2)c(C)c1[N+](=O)[O-] ZINC000019677357 941836620 /nfs/dbraw/zinc/83/66/20/941836620.db2.gz XMVMMOUJHQQPOL-UHFFFAOYSA-N 0 0 369.352 3.815 20 5 FHBDRN O=C(c1csc(-c2cccc([N+](=O)[O-])c2)n1)N1CC[C@@H](c2ccco2)C1 ZINC000377611614 941843657 /nfs/dbraw/zinc/84/36/57/941843657.db2.gz NGBHMQOQWGWFQJ-CYBMUJFWSA-N 0 0 369.402 3.941 20 5 FHBDRN O=C(c1csc(-c2cccc([N+](=O)[O-])c2)n1)N1CC[C@H](c2ccco2)C1 ZINC000377611615 941843822 /nfs/dbraw/zinc/84/38/22/941843822.db2.gz NGBHMQOQWGWFQJ-ZDUSSCGKSA-N 0 0 369.402 3.941 20 5 FHBDRN O=C([C@H]1C[C@@H]1c1ccccc1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000412154143 941852477 /nfs/dbraw/zinc/85/24/77/941852477.db2.gz NKASJXTYFSMOFZ-UXHICEINSA-N 0 0 366.417 3.768 20 5 FHBDRN Cc1noc([C@@H](NC/C=C/c2ccccc2[N+](=O)[O-])c2ccccc2)n1 ZINC000377630100 941856230 /nfs/dbraw/zinc/85/62/30/941856230.db2.gz XHJPCDNAZPVYLB-DBEXCURXSA-N 0 0 350.378 3.679 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CC[C@@H](c2ccc(F)cc2)C1 ZINC000412162997 941857214 /nfs/dbraw/zinc/85/72/14/941857214.db2.gz CEAYRJMXIKGNPC-AYOQOUSVSA-N 0 0 354.381 3.854 20 5 FHBDRN C[C@]1(c2ccccc2)CCN(C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)C1 ZINC000412172281 941861545 /nfs/dbraw/zinc/86/15/45/941861545.db2.gz MNYJFIVWPNYNND-ZVDOUQERSA-N 0 0 350.418 3.889 20 5 FHBDRN CC[C@H]1c2ccsc2CCN1C(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000047625332 941861817 /nfs/dbraw/zinc/86/18/17/941861817.db2.gz DUNSJSDTMMVPNQ-AWEZNQCLSA-N 0 0 360.435 3.961 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CCS[C@H]3CCCC[C@H]32)ccc1[N+](=O)[O-] ZINC000412175805 941864377 /nfs/dbraw/zinc/86/43/77/941864377.db2.gz PBIKQQWBZVOGMO-WBVHZDCISA-N 0 0 364.467 3.882 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N2CCC[C@H](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000433772179 941877819 /nfs/dbraw/zinc/87/78/19/941877819.db2.gz CBCDTUMNYSNZMS-OAHLLOKOSA-N 0 0 356.426 3.536 20 5 FHBDRN O=[N+]([O-])c1cc(S(=O)(=O)Oc2cccc(Cl)c2Cl)cs1 ZINC000119319038 941879304 /nfs/dbraw/zinc/87/93/04/941879304.db2.gz NEWJXDDNSCYQMW-UHFFFAOYSA-N 0 0 354.192 3.731 20 5 FHBDRN Cc1cn([C@H](C)c2ccccc2)nc1NC(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000472824636 941880183 /nfs/dbraw/zinc/88/01/83/941880183.db2.gz CXRFPFQRBCNKKG-OAHLLOKOSA-N 0 0 364.405 3.890 20 5 FHBDRN CC(C)Oc1cc(C(=O)Nc2cccc(OCCF)c2)ccc1[N+](=O)[O-] ZINC000412184392 941883126 /nfs/dbraw/zinc/88/31/26/941883126.db2.gz KBIYQDUYAHCREA-UHFFFAOYSA-N 0 0 362.357 3.983 20 5 FHBDRN CC(=O)c1ccc(OCC(=O)Nc2cc([N+](=O)[O-])ccc2F)c(Cl)c1 ZINC000119550414 941887332 /nfs/dbraw/zinc/88/73/32/941887332.db2.gz QDNMBTRNOBTRRY-UHFFFAOYSA-N 0 0 366.732 3.607 20 5 FHBDRN CC(C)N(CC(=O)NCCC1=CCCCC1)Cc1ccc([N+](=O)[O-])cc1 ZINC000513410220 941893704 /nfs/dbraw/zinc/89/37/04/941893704.db2.gz BDNOFAHTDAPMBW-UHFFFAOYSA-N 0 0 359.470 3.812 20 5 FHBDRN C[C@@H](CNc1ccc([N+](=O)[O-])c(NC[C@H](C)C(F)(F)F)n1)C(F)(F)F ZINC000433786491 941895491 /nfs/dbraw/zinc/89/54/91/941895491.db2.gz XPOPWNHPHRFLSB-YUMQZZPRSA-N 0 0 374.285 3.632 20 5 FHBDRN CCc1cccc(NC(=O)Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)c1 ZINC000103463481 941897906 /nfs/dbraw/zinc/89/79/06/941897906.db2.gz BFCNQJYYHVLTSV-UHFFFAOYSA-N 0 0 350.378 3.659 20 5 FHBDRN CCOCCC1(CNC(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)CCC1 ZINC000412198180 941899164 /nfs/dbraw/zinc/89/91/64/941899164.db2.gz UHOYPHDEFKTCOP-UHFFFAOYSA-N 0 0 364.442 3.709 20 5 FHBDRN Cc1c(Br)c(N2CC[C@@H](CC(F)(F)F)C2)ncc1[N+](=O)[O-] ZINC000433815510 941916114 /nfs/dbraw/zinc/91/61/14/941916114.db2.gz NICGWDVNXDEOGJ-QMMMGPOBSA-N 0 0 368.153 3.839 20 5 FHBDRN Cc1cc(C(=O)N[C@@H]2CCO[C@@H]2c2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000182433437 941923292 /nfs/dbraw/zinc/92/32/92/941923292.db2.gz JVPWLZOTPQGKMJ-NVXWUHKLSA-N 0 0 360.797 3.817 20 5 FHBDRN Cc1cc(C(=O)N[C@@H]2CCO[C@H]2c2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000182433485 941925043 /nfs/dbraw/zinc/92/50/43/941925043.db2.gz JVPWLZOTPQGKMJ-WBVHZDCISA-N 0 0 360.797 3.817 20 5 FHBDRN Cc1c2ccccc2oc1[C@H](C)NC(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-] ZINC000433834811 941930362 /nfs/dbraw/zinc/93/03/62/941930362.db2.gz DYDYGQFSPHQBKU-NSHDSACASA-N 0 0 356.382 3.987 20 5 FHBDRN O=C(Nc1cccc2ncccc21)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000182485113 941934356 /nfs/dbraw/zinc/93/43/56/941934356.db2.gz NXHSVTIMLXKBNP-UHFFFAOYSA-N 0 0 359.288 3.997 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)NCc2ccc(F)cc2C(F)(F)F)c1[N+](=O)[O-] ZINC000433838194 941935241 /nfs/dbraw/zinc/93/52/41/941935241.db2.gz JCAOSIHETICXPJ-UHFFFAOYSA-N 0 0 374.294 3.529 20 5 FHBDRN COc1ccccc1OCc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-] ZINC000182627401 941940300 /nfs/dbraw/zinc/94/03/00/941940300.db2.gz VNSPXMKRWJBOHV-UHFFFAOYSA-N 0 0 369.320 3.835 20 5 FHBDRN CO[C@H](c1ccccc1F)[C@@H](C)NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412229620 941942527 /nfs/dbraw/zinc/94/25/27/941942527.db2.gz HVAHYXJTFVCDJL-HYLIHCSXSA-N 0 0 372.396 3.730 20 5 FHBDRN COc1ccc([C@@H](NC(=O)c2csc([N+](=O)[O-])c2)C(F)(F)F)cc1 ZINC000182589794 941945738 /nfs/dbraw/zinc/94/57/38/941945738.db2.gz ZSTIIZJDSAEGJZ-GFCCVEGCSA-N 0 0 360.313 3.698 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1OC(F)F)N1CCCc2cc(F)ccc21 ZINC000182602347 941946158 /nfs/dbraw/zinc/94/61/58/941946158.db2.gz CKPBDMNMVFUINS-UHFFFAOYSA-N 0 0 366.295 3.928 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N(C)[C@H](C)c2ccc(F)c(F)c2)c1[N+](=O)[O-] ZINC000433849887 941948260 /nfs/dbraw/zinc/94/82/60/941948260.db2.gz VBQGTGYDZPIHAM-SECBINFHSA-N 0 0 352.341 3.553 20 5 FHBDRN CC(C)C[C@@H]1C[C@@H](NC(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)CCO1 ZINC000412239216 941950477 /nfs/dbraw/zinc/95/04/77/941950477.db2.gz GBHVOFWNVWAGMI-JKSUJKDBSA-N 0 0 364.442 3.706 20 5 FHBDRN COc1cc(C)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000182665621 941950646 /nfs/dbraw/zinc/95/06/46/941950646.db2.gz VGRZWOBCXNHMDE-UHFFFAOYSA-N 0 0 352.293 3.766 20 5 FHBDRN C[C@H]1CCc2onc(C(=O)N3CCS[C@@H]3c3ccc([N+](=O)[O-])cc3)c2C1 ZINC000433865104 941953069 /nfs/dbraw/zinc/95/30/69/941953069.db2.gz NQIFJZBJSQJDLK-BBATYDOGSA-N 0 0 373.434 3.595 20 5 FHBDRN CCC(CC)[C@@H]1C[C@H](NC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)CCO1 ZINC000412244222 941955917 /nfs/dbraw/zinc/95/59/17/941955917.db2.gz OOKDBEWEOWHMKI-LULLPPNCSA-N 0 0 360.454 3.798 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1OC(F)F)N1CCc2c1cc(F)cc2F ZINC000182639460 941957035 /nfs/dbraw/zinc/95/70/35/941957035.db2.gz LDSDKMYOBDVANS-UHFFFAOYSA-N 0 0 370.258 3.677 20 5 FHBDRN O=C(Cc1cccc([N+](=O)[O-])c1)N[C@H](c1c(F)cccc1F)C(F)(F)F ZINC000182771743 941958875 /nfs/dbraw/zinc/95/88/75/941958875.db2.gz DNGJPYOUUNDJJI-OAHLLOKOSA-N 0 0 374.265 3.835 20 5 FHBDRN O=[N+]([O-])c1cc(-c2nc(-c3ccncn3)no2)ccc1NCc1ccccc1 ZINC000513506470 941968073 /nfs/dbraw/zinc/96/80/73/941968073.db2.gz QNIDDSLHPIRWSN-UHFFFAOYSA-N 0 0 374.360 3.714 20 5 FHBDRN O=C(c1cc2c(c([N+](=O)[O-])c1)OCO2)N1CCCc2cccc(Cl)c21 ZINC000182833180 941974340 /nfs/dbraw/zinc/97/43/40/941974340.db2.gz RAEIIJCHTAAERF-UHFFFAOYSA-N 0 0 360.753 3.570 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])c[nH]1)N1CCC[C@H](c2cccc(C(F)(F)F)c2)C1 ZINC000513520541 941980267 /nfs/dbraw/zinc/98/02/67/941980267.db2.gz OYMIFUSCTMLBII-LBPRGKRZSA-N 0 0 367.327 3.962 20 5 FHBDRN CC(=O)Nc1ccc(Br)cc1NCc1ccc([N+](=O)[O-])cc1 ZINC000101542394 941985524 /nfs/dbraw/zinc/98/55/24/941985524.db2.gz FNEDRJLBQKTBPV-UHFFFAOYSA-N 0 0 364.199 3.928 20 5 FHBDRN O=C(N[C@@H]1CCCOc2c(F)cccc21)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412258710 941988294 /nfs/dbraw/zinc/98/82/94/941988294.db2.gz SZXIQSXWXFETHZ-LZLYRXPVSA-N 0 0 370.380 3.868 20 5 FHBDRN CSc1cccc(C(=O)NCCC2C[C@H](C)O[C@@H](C)C2)c1[N+](=O)[O-] ZINC000549334977 941995260 /nfs/dbraw/zinc/99/52/60/941995260.db2.gz KOWJOIUJXZUULL-RYUDHWBXSA-N 0 0 352.456 3.640 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1Cl)N1CCC[C@H](OCC2CC2)C1 ZINC000377822724 942016111 /nfs/dbraw/zinc/01/61/11/942016111.db2.gz ZGQLTIFLBOHYOR-LBPRGKRZSA-N 0 0 353.806 3.671 20 5 FHBDRN CC(C)Oc1cc(C(=O)N(C)CC2(O)CCCCCC2)ccc1[N+](=O)[O-] ZINC000412267507 942016357 /nfs/dbraw/zinc/01/63/57/942016357.db2.gz GQJFEUKPSOTFSL-UHFFFAOYSA-N 0 0 364.442 3.539 20 5 FHBDRN Cc1nc(Cc2noc(-c3ccc(OC(F)F)c([N+](=O)[O-])c3)n2)cs1 ZINC000513592491 942030836 /nfs/dbraw/zinc/03/08/36/942030836.db2.gz PSRQUCGDYMQFRN-UHFFFAOYSA-N 0 0 368.321 3.602 20 5 FHBDRN CCOC(=O)c1ccnc(N[C@H]2CCO[C@@H](C(CC)CC)C2)c1[N+](=O)[O-] ZINC000182969791 942032103 /nfs/dbraw/zinc/03/21/03/942032103.db2.gz PDHYNYCDYADTES-DZGCQCFKSA-N 0 0 365.430 3.562 20 5 FHBDRN Cc1ccc([C@H]2CN(C(=O)Nc3cccc([N+](=O)[O-])c3Cl)CCO2)o1 ZINC000377847889 942034335 /nfs/dbraw/zinc/03/43/35/942034335.db2.gz RBEDYCYJRDSKSE-CQSZACIVSA-N 0 0 365.773 3.755 20 5 FHBDRN O=[N+]([O-])c1cc2ccccc2nc1NCCc1nc(C(F)(F)F)cs1 ZINC000473532700 942037475 /nfs/dbraw/zinc/03/74/75/942037475.db2.gz MYODBMISRCTVRK-UHFFFAOYSA-N 0 0 368.340 3.695 20 5 FHBDRN COC(=O)c1cc(C(=O)Nc2c(C)c(C)ccc2Cl)cc([N+](=O)[O-])c1 ZINC000434010665 942038501 /nfs/dbraw/zinc/03/85/01/942038501.db2.gz FPIVICINNFVVOM-UHFFFAOYSA-N 0 0 362.769 3.904 20 5 FHBDRN C[C@H]1c2c(Cl)cc(Cl)cc2CCN1C(=O)c1cc([N+](=O)[O-])c[nH]1 ZINC000434010658 942038788 /nfs/dbraw/zinc/03/87/88/942038788.db2.gz FOBHTUFBYKDEHJ-QMMMGPOBSA-N 0 0 354.193 3.989 20 5 FHBDRN CC(C)c1[nH]nc(C(=O)Nc2ccc(C(=O)C(C)(C)C)cc2)c1[N+](=O)[O-] ZINC000434015869 942041080 /nfs/dbraw/zinc/04/10/80/942041080.db2.gz FBRCIODNIKOOEO-UHFFFAOYSA-N 0 0 358.398 3.922 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H]1CCCc2cc(N)ccc21 ZINC000415766762 942042747 /nfs/dbraw/zinc/04/27/47/942042747.db2.gz SUEKOVTVKVLEHS-QGZVFWFLSA-N 0 0 354.410 3.939 20 5 FHBDRN CC[C@H](C)Oc1ccc(NC(=O)CCn2nc(C)c([N+](=O)[O-])c2C)cc1 ZINC000102239588 942047326 /nfs/dbraw/zinc/04/73/26/942047326.db2.gz JJTAKSHHKZVBEM-LBPRGKRZSA-N 0 0 360.414 3.614 20 5 FHBDRN Cc1ccc(-c2nc(CCNC(=O)c3ccc([N+](=O)[O-])cc3F)co2)cc1 ZINC000102358686 942050147 /nfs/dbraw/zinc/05/01/47/942050147.db2.gz VNQAVLGVYMKMFP-UHFFFAOYSA-N 0 0 369.352 3.670 20 5 FHBDRN CC[C@H](C)COc1cc([N+](=O)[O-])c(COc2cc(C)n(C)n2)cc1OC ZINC000513639923 942051045 /nfs/dbraw/zinc/05/10/45/942051045.db2.gz HNQXJHGNGMJKNT-LBPRGKRZSA-N 0 0 363.414 3.649 20 5 FHBDRN Cc1nc2c(s1)[C@H](Nc1c3ccccc3n(C)c(=O)c1[N+](=O)[O-])CCC2 ZINC000893110731 942056946 /nfs/dbraw/zinc/05/69/46/942056946.db2.gz NSZSQLNJHBPTAV-CYBMUJFWSA-N 0 0 370.434 3.701 20 5 FHBDRN O=C(CCCOc1ccccc1Cl)Nc1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000536251933 942064588 /nfs/dbraw/zinc/06/45/88/942064588.db2.gz ATKOTPZMINIONE-UHFFFAOYSA-N 0 0 374.784 3.922 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2cncc(Cl)c2Cl)c1 ZINC000517037091 942066555 /nfs/dbraw/zinc/06/65/55/942066555.db2.gz KLOPPDHKGGHEFN-UHFFFAOYSA-N 0 0 356.165 3.948 20 5 FHBDRN Cc1noc(C2(C)CCN(c3c4cc(F)ccc4ncc3[N+](=O)[O-])CC2)n1 ZINC000893118396 942069718 /nfs/dbraw/zinc/06/97/18/942069718.db2.gz DQALZOXXOUMQNI-UHFFFAOYSA-N 0 0 371.372 3.532 20 5 FHBDRN O=c1c2cc([N+](=O)[O-])ccc2nc2n1CC/C2=C\C1=Cc2ccccc2OC1 ZINC000102598592 942072893 /nfs/dbraw/zinc/07/28/93/942072893.db2.gz TWHYJGGJHIVFMB-XNTDXEJSSA-N 0 0 373.368 3.568 20 5 FHBDRN CCS(=O)(=O)c1ccc(CN[C@@H](C)c2cccc([N+](=O)[O-])c2C)s1 ZINC000279990204 942084647 /nfs/dbraw/zinc/08/46/47/942084647.db2.gz FGJFEPFRVQYQGX-LBPRGKRZSA-N 0 0 368.480 3.609 20 5 FHBDRN COc1cc(-c2noc([C@@H]3C[C@H]3c3ccc([N+](=O)[O-])cc3)n2)cc(C)n1 ZINC000420506664 942087515 /nfs/dbraw/zinc/08/75/15/942087515.db2.gz TXZPFDICVMPWSC-LSDHHAIUSA-N 0 0 352.350 3.628 20 5 FHBDRN CC(C)c1nn(C)cc1-c1noc([C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)n1 ZINC000420505214 942087558 /nfs/dbraw/zinc/08/75/58/942087558.db2.gz QXIDXAJUDIMTJK-UONOGXRCSA-N 0 0 353.382 3.773 20 5 FHBDRN COc1cc(C(=O)Nc2scnc2-c2ccccc2)ccc1[N+](=O)[O-] ZINC000102724673 942087641 /nfs/dbraw/zinc/08/76/41/942087641.db2.gz VTTYGHXZDZAHIX-UHFFFAOYSA-N 0 0 355.375 3.979 20 5 FHBDRN CO[C@H]1CCC[C@H](CC(=O)N(C)Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000280083026 942098819 /nfs/dbraw/zinc/09/88/19/942098819.db2.gz YNEWQOHFGKBAFX-WFASDCNBSA-N 0 0 354.834 3.802 20 5 FHBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1cccc2[nH]cnc21 ZINC000136265255 942099842 /nfs/dbraw/zinc/09/98/42/942099842.db2.gz XCIYTIJEWGTSRV-SECBINFHSA-N 0 0 360.757 3.531 20 5 FHBDRN CC(C)c1ccc(C(=O)N2CCO[C@H](c3ccsc3)C2)cc1[N+](=O)[O-] ZINC000190096465 942102860 /nfs/dbraw/zinc/10/28/60/942102860.db2.gz DHXBJPBCBRXZHF-KRWDZBQOSA-N 0 0 360.435 3.993 20 5 FHBDRN CC(C)(C)OCc1cccc(CNc2c(C(N)=O)cccc2[N+](=O)[O-])c1 ZINC000420581560 942105750 /nfs/dbraw/zinc/10/57/50/942105750.db2.gz HIIIBIISDZGLLQ-UHFFFAOYSA-N 0 0 357.410 3.621 20 5 FHBDRN CCNC(=O)c1ccc(C)c(NC(=O)c2c(Cl)cccc2[N+](=O)[O-])c1 ZINC000110221842 942115050 /nfs/dbraw/zinc/11/50/50/942115050.db2.gz BTOYRQIJNJAONV-UHFFFAOYSA-N 0 0 361.785 3.559 20 5 FHBDRN CC(=O)c1cccc(OCCCC(=O)N(C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000102833125 942115098 /nfs/dbraw/zinc/11/50/98/942115098.db2.gz CUBPACZOZKSDGV-UHFFFAOYSA-N 0 0 356.378 3.619 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N2CCC[C@H](C(C)(C)C)C2)c1F ZINC000412302982 942117147 /nfs/dbraw/zinc/11/71/47/942117147.db2.gz FHVLTFHTHUTOEB-LBPRGKRZSA-N 0 0 352.406 3.570 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1OC(=O)CCCOc1ccc(F)cc1F ZINC000760015703 942117602 /nfs/dbraw/zinc/11/76/02/942117602.db2.gz HNQNMMIONQGGQF-UHFFFAOYSA-N 0 0 351.305 3.946 20 5 FHBDRN Cc1nn(C)c2nccc(N3CCC[C@@H](c4ccc([N+](=O)[O-])cc4)C3)c12 ZINC000420626556 942126007 /nfs/dbraw/zinc/12/60/07/942126007.db2.gz JTUAKOGFTHHZPV-OAHLLOKOSA-N 0 0 351.410 3.569 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCC[C@@H](CCO)CC2)nc1-c1ccc(F)cc1 ZINC000420633224 942130653 /nfs/dbraw/zinc/13/06/53/942130653.db2.gz BOPKWYVCLUJDLH-CQSZACIVSA-N 0 0 359.401 3.785 20 5 FHBDRN CC[C@H](C)[C@H](NC(=O)c1ccc(Cl)cc1[N+](=O)[O-])C(=O)OC(C)(C)C ZINC000159018572 942136850 /nfs/dbraw/zinc/13/68/50/942136850.db2.gz JWUCPSXNBDYCLL-HZMBPMFUSA-N 0 0 370.833 3.734 20 5 FHBDRN C[C@@H](c1cccnc1)N(C)C(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-] ZINC000280233666 942141809 /nfs/dbraw/zinc/14/18/09/942141809.db2.gz ROHCVAFYDSLDCL-JTQLQIEISA-N 0 0 351.765 3.544 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)NCCCc1c[nH]c2ccc(F)cc12 ZINC000501970983 942145387 /nfs/dbraw/zinc/14/53/87/942145387.db2.gz AUGMSNLKTOKWIR-UHFFFAOYSA-N 0 0 371.368 3.586 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)[C@](C)(OC)C1CC1 ZINC000415922214 942149209 /nfs/dbraw/zinc/14/92/09/942149209.db2.gz TUPCRHCGJWBPNE-DIFFPNOSSA-N 0 0 352.456 3.640 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N(Cc1ccccc1)C[C@H]1CCCO1 ZINC000501980659 942150358 /nfs/dbraw/zinc/15/03/58/942150358.db2.gz ALGMGZLQMMKOLT-GOSISDBHSA-N 0 0 354.406 3.725 20 5 FHBDRN Cc1ccc(-c2cc(C(=O)N(Cc3ccc([N+](=O)[O-])cc3)C(C)C)[nH]n2)o1 ZINC000501977655 942158461 /nfs/dbraw/zinc/15/84/61/942158461.db2.gz JEKIJYREHRJIBD-UHFFFAOYSA-N 0 0 368.393 3.937 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)N(C)[C@@H]2CCCC[C@H]2C)cc1SC ZINC000102984891 942166743 /nfs/dbraw/zinc/16/67/43/942166743.db2.gz INIJSZJSNPBFQH-DGCLKSJQSA-N 0 0 352.456 3.976 20 5 FHBDRN CCN(Cc1occc1C)C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000413440249 942180137 /nfs/dbraw/zinc/18/01/37/942180137.db2.gz SDSBJSSMSSCBNJ-UHFFFAOYSA-N 0 0 365.817 3.924 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1COC(=O)c1ccc([C@@H]2CCC(=O)N2)cc1 ZINC000893157030 942186174 /nfs/dbraw/zinc/18/61/74/942186174.db2.gz IRYDSWYFVJMGCE-KRWDZBQOSA-N 0 0 368.389 3.520 20 5 FHBDRN Cc1c(C(=O)NCc2ccccc2N2CCCCC2)cccc1[N+](=O)[O-] ZINC000183154845 942186654 /nfs/dbraw/zinc/18/66/54/942186654.db2.gz SQCFJACZFVRVKK-UHFFFAOYSA-N 0 0 353.422 3.824 20 5 FHBDRN C[C@@H](CC(=O)c1cccs1)NC(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000159026484 942191905 /nfs/dbraw/zinc/19/19/05/942191905.db2.gz YTMPIHKALLKXOG-NSHDSACASA-N 0 0 369.402 3.596 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N(C)[C@@H](c1ccccc1)C(F)(F)F ZINC000103050507 942192767 /nfs/dbraw/zinc/19/27/67/942192767.db2.gz UOWDLVVJCVNJPC-HNNXBMFYSA-N 0 0 368.311 3.979 20 5 FHBDRN CC(C)NC(=O)c1ccc(NC(=O)c2c(Cl)cccc2[N+](=O)[O-])cc1 ZINC000110233884 942205777 /nfs/dbraw/zinc/20/57/77/942205777.db2.gz RFRVKKNAQYQPIN-UHFFFAOYSA-N 0 0 361.785 3.639 20 5 FHBDRN C[C@H](Nc1c2cc(Br)ccc2ncc1[N+](=O)[O-])c1cccnc1 ZINC000502087099 942212721 /nfs/dbraw/zinc/21/27/21/942212721.db2.gz GGWDTXYQGMRUCN-JTQLQIEISA-N 0 0 373.210 3.896 20 5 FHBDRN C[C@]1(O)CCCN(C(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)CC1 ZINC000280605819 942213724 /nfs/dbraw/zinc/21/37/24/942213724.db2.gz PAKYMOVSGUKGGD-FQEVSTJZSA-N 0 0 370.405 3.764 20 5 FHBDRN Cc1ccc(CNC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)cc1F ZINC000513730034 942215002 /nfs/dbraw/zinc/21/50/02/942215002.db2.gz IHZSBLYLOBMPRQ-UHFFFAOYSA-N 0 0 354.284 3.574 20 5 FHBDRN COC(=O)c1nc([C@@H]2CCCN2c2ccc(F)cc2[N+](=O)[O-])sc1C ZINC000280628887 942217294 /nfs/dbraw/zinc/21/72/94/942217294.db2.gz ZRDYZBZGTGUMLX-LBPRGKRZSA-N 0 0 365.386 3.627 20 5 FHBDRN CCOc1ccccc1N(C)C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000183192156 942219794 /nfs/dbraw/zinc/21/97/94/942219794.db2.gz UFBRJWJGPFHRCW-UHFFFAOYSA-N 0 0 366.320 3.872 20 5 FHBDRN O=[N+]([O-])c1cnc2ccc(Br)cc2c1N1C[C@@H]2C[C@H]1CS2 ZINC000413463611 942221018 /nfs/dbraw/zinc/22/10/18/942221018.db2.gz XWBMTCGOBVYFMK-UWVGGRQHSA-N 0 0 366.240 3.600 20 5 FHBDRN C[C@]1(CNC(=O)c2cc(Cl)ccc2[N+](=O)[O-])OCCc2sccc21 ZINC000290488220 942221807 /nfs/dbraw/zinc/22/18/07/942221807.db2.gz XFFNISKUYJIJII-MRXNPFEDSA-N 0 0 366.826 3.528 20 5 FHBDRN CCNc1ccc(C(=O)N[C@H]2CCOc3c(CC)cccc32)cc1[N+](=O)[O-] ZINC000513701405 942225302 /nfs/dbraw/zinc/22/53/02/942225302.db2.gz STGAUZSCQSXFQZ-INIZCTEOSA-N 0 0 369.421 3.843 20 5 FHBDRN CCC(CC)[C@@H]1C[C@H](NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)CCO1 ZINC000183438229 942225617 /nfs/dbraw/zinc/22/56/17/942225617.db2.gz DVLYUQLOPFEFET-ZBFHGGJFSA-N 0 0 354.834 3.962 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N2c3ccccc3CC[C@H]2C)c1C ZINC000480950978 942227855 /nfs/dbraw/zinc/22/78/55/942227855.db2.gz MPTDWFOYADJJAL-CYBMUJFWSA-N 0 0 360.435 3.742 20 5 FHBDRN C[C@H](OCC(F)(F)F)c1noc(CCc2cc(F)ccc2[N+](=O)[O-])n1 ZINC000924095635 942230715 /nfs/dbraw/zinc/23/07/15/942230715.db2.gz BUQUIFBRZQQJAI-QMMMGPOBSA-N 0 0 363.267 3.542 20 5 FHBDRN CCN(C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)c1ccccc1C(=O)OC ZINC000413472365 942231556 /nfs/dbraw/zinc/23/15/56/942231556.db2.gz OYDBYZSKINSELT-DLBZAZTESA-N 0 0 368.389 3.538 20 5 FHBDRN Cc1nn(Cc2ccc(C(=O)N3[C@H](C)CCC[C@@H]3C)cc2)c(C)c1[N+](=O)[O-] ZINC000103369064 942247043 /nfs/dbraw/zinc/24/70/43/942247043.db2.gz PLHDPYBRGVPMSW-OKILXGFUSA-N 0 0 370.453 3.860 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)NCc1cccc(OCC(C)C)c1 ZINC000500987248 942247562 /nfs/dbraw/zinc/24/75/62/942247562.db2.gz GFGAKMQGTAGKAV-UHFFFAOYSA-N 0 0 358.394 3.568 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)O[C@@H](C)C(=O)N(C)c2ccccc2)c1 ZINC000016196570 942247639 /nfs/dbraw/zinc/24/76/39/942247639.db2.gz YLGXSKARVGHYSI-LBPRGKRZSA-N 0 0 374.418 3.525 20 5 FHBDRN COc1ccc(CCC(=O)N2c3ccc([N+](=O)[O-])cc3C[C@H]2C)cc1F ZINC000103376651 942248087 /nfs/dbraw/zinc/24/80/87/942248087.db2.gz WJXODMPRINRECV-GFCCVEGCSA-N 0 0 358.369 3.653 20 5 FHBDRN CC(=O)c1cccc(O[C@@H](C)C(=O)N2c3ccc([N+](=O)[O-])cc3C[C@@H]2C)c1 ZINC000103375435 942248740 /nfs/dbraw/zinc/24/87/40/942248740.db2.gz CQOOKWBFTZVPRK-JSGCOSHPSA-N 0 0 368.389 3.543 20 5 FHBDRN C[C@@H](Nc1ccc(C(=O)N(C)CC(F)F)cc1[N+](=O)[O-])c1ccccn1 ZINC000103395487 942257798 /nfs/dbraw/zinc/25/77/98/942257798.db2.gz ZATHWNXFSRHJCT-LLVKDONJSA-N 0 0 364.352 3.500 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1F)N1CCO[C@H](c2ccccc2Cl)C1 ZINC000103445113 942260284 /nfs/dbraw/zinc/26/02/84/942260284.db2.gz RHZPLFBIUNNKFQ-INIZCTEOSA-N 0 0 364.760 3.601 20 5 FHBDRN C[C@H]1CN(c2ncc([N+](=O)[O-])cc2C(F)(F)F)C[C@@H](c2ccccc2)O1 ZINC000413077832 942260771 /nfs/dbraw/zinc/26/07/71/942260771.db2.gz SHHNERCMLAYQFF-NHYWBVRUSA-N 0 0 367.327 3.975 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H]1CCCOc2ccccc21 ZINC000122852002 942262259 /nfs/dbraw/zinc/26/22/59/942262259.db2.gz UBGXEAJZTOZOSA-CQSZACIVSA-N 0 0 357.366 3.639 20 5 FHBDRN COc1ccccc1SC[C@@H](C)CNC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000103422425 942262356 /nfs/dbraw/zinc/26/23/56/942262356.db2.gz QSCMYZRXZNBTMW-ZDUSSCGKSA-N 0 0 360.435 3.762 20 5 FHBDRN CC[C@@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1OC)c1nc(C)cs1 ZINC000122847911 942262397 /nfs/dbraw/zinc/26/23/97/942262397.db2.gz ZCXGOXXLLBOXML-LLVKDONJSA-N 0 0 350.400 3.641 20 5 FHBDRN C[C@H](NC(=O)NCc1cccc(OC(C)(C)C)n1)c1cccc([N+](=O)[O-])c1 ZINC000502172641 942263148 /nfs/dbraw/zinc/26/31/48/942263148.db2.gz ZDDHUJQKBTZOGK-ZDUSSCGKSA-N 0 0 372.425 3.728 20 5 FHBDRN Cc1cnc([C@H]2CCCN(C(=O)CCc3cccc([N+](=O)[O-])c3)C2)s1 ZINC000378089245 942263444 /nfs/dbraw/zinc/26/34/44/942263444.db2.gz NTHDRCUYSNWPLJ-HNNXBMFYSA-N 0 0 359.451 3.699 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CCC[C@H](CC(F)(F)F)C1 ZINC000420938446 942264703 /nfs/dbraw/zinc/26/47/03/942264703.db2.gz AUQMKTKCVNEDAF-GFCCVEGCSA-N 0 0 359.348 3.506 20 5 FHBDRN Cc1cn2c(n1)[C@H](CNC(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1)CCC2 ZINC000501027154 942269305 /nfs/dbraw/zinc/26/93/05/942269305.db2.gz DOCVYSVUVKNTOJ-HNNXBMFYSA-N 0 0 370.453 3.705 20 5 FHBDRN CC(C)CC(=O)N1CCC(Nc2ccc([N+](=O)[O-])c3ncccc23)CC1 ZINC000413088078 942272694 /nfs/dbraw/zinc/27/26/94/942272694.db2.gz TUZZHLYAYXRRKL-UHFFFAOYSA-N 0 0 356.426 3.592 20 5 FHBDRN Cc1ccc(NC(=O)[C@@H](c2ccccc2)N2CCSCC2)c([N+](=O)[O-])c1 ZINC000103468533 942273267 /nfs/dbraw/zinc/27/32/67/942273267.db2.gz KDMGYPPKOMYPJI-GOSISDBHSA-N 0 0 371.462 3.632 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2nnc(CN3CCC[C@H](CC(F)(F)F)C3)o2)cc1 ZINC000420954732 942274197 /nfs/dbraw/zinc/27/41/97/942274197.db2.gz VBWYKCRJCJTYRQ-LLVKDONJSA-N 0 0 370.331 3.809 20 5 FHBDRN CC(C)c1nccn1[C@H]1CCCN(C(=O)c2ccc(F)cc2[N+](=O)[O-])C1 ZINC000378107031 942276139 /nfs/dbraw/zinc/27/61/39/942276139.db2.gz ZZCVQHIKLBGBKT-AWEZNQCLSA-N 0 0 360.389 3.531 20 5 FHBDRN CCS[C@@H]1CCC[C@@H]1NC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000481010403 942276299 /nfs/dbraw/zinc/27/62/99/942276299.db2.gz PZZJVWQGBMKKFA-SWLSCSKDSA-N 0 0 372.874 3.808 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1)N1CCO[C@@H](c2ccccc2Cl)C1 ZINC000103502522 942277827 /nfs/dbraw/zinc/27/78/27/942277827.db2.gz BGOKZUIZMNPGFI-MRXNPFEDSA-N 0 0 361.785 3.854 20 5 FHBDRN Cc1ncsc1CCC(=O)N1CCS[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000413505890 942280377 /nfs/dbraw/zinc/28/03/77/942280377.db2.gz AQKQNTCXHWGGRK-INIZCTEOSA-N 0 0 363.464 3.567 20 5 FHBDRN Cc1cc([C@@H]2CN(C(=O)c3ccc([N+](=O)[O-])cc3C)CCO2)ccc1F ZINC000128416246 942282923 /nfs/dbraw/zinc/28/29/23/942282923.db2.gz JFUHSCBZBHOJPV-SFHVURJKSA-N 0 0 358.369 3.564 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N[C@@H](c2cccs2)C2CC2)c1F ZINC000413094018 942284603 /nfs/dbraw/zinc/28/46/03/942284603.db2.gz KDQRLWUNALGTMX-QGZVFWFLSA-N 0 0 364.398 3.614 20 5 FHBDRN COc1cc(F)ccc1NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513735767 942291091 /nfs/dbraw/zinc/29/10/91/942291091.db2.gz RSYSPAMTMLZVDW-UHFFFAOYSA-N 0 0 356.256 3.596 20 5 FHBDRN CC(C)(CCNc1c(Cl)cc([N+](=O)[O-])cc1Cl)S(C)(=O)=O ZINC000413518722 942291261 /nfs/dbraw/zinc/29/12/61/942291261.db2.gz JIZOKLAKLDDORX-UHFFFAOYSA-N 0 0 355.243 3.527 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CCC[C@@H](c3nccs3)C2)c(C(F)(F)F)c1 ZINC000413105340 942291712 /nfs/dbraw/zinc/29/17/12/942291712.db2.gz LHWCURJHQMVXOS-SECBINFHSA-N 0 0 358.345 3.849 20 5 FHBDRN Cc1c(Br)c(N[C@H](CO)CCC(C)(C)C)ncc1[N+](=O)[O-] ZINC000481042236 942291894 /nfs/dbraw/zinc/29/18/94/942291894.db2.gz CGPLRKBMOFZSBA-JTQLQIEISA-N 0 0 360.252 3.660 20 5 FHBDRN CCN(C(=O)c1cc([N+](=O)[O-])cnc1C)c1cccc(C(F)(F)F)c1 ZINC000416046956 942292586 /nfs/dbraw/zinc/29/25/86/942292586.db2.gz UASCYSAQEWUZDR-UHFFFAOYSA-N 0 0 353.300 3.984 20 5 FHBDRN CC[C@H](CC(=O)NCCNc1ccc([N+](=O)[O-])cc1)c1ccc(OC)cc1 ZINC000502222218 942298331 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3.858 20 5 FHBDRN CCOc1ncccc1-c1noc(-c2ccc([N+](=O)[O-])c(OC(C)C)c2)n1 ZINC000420485481 942689789 /nfs/dbraw/zinc/68/97/89/942689789.db2.gz WOECSATZPJDZMG-UHFFFAOYSA-N 0 0 370.365 3.893 20 5 FHBDRN CCOc1ccc(C2(CNc3ccncc3[N+](=O)[O-])CCOCC2)cc1 ZINC000066810460 942696559 /nfs/dbraw/zinc/69/65/59/942696559.db2.gz VKXNELXEAGYTPJ-UHFFFAOYSA-N 0 0 357.410 3.549 20 5 FHBDRN O=C(N[C@@H](c1ccccc1)[C@@H]1CCOC1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000378387804 942699543 /nfs/dbraw/zinc/69/95/43/942699543.db2.gz LIXCBDCRTZRYAY-DYVFJYSZSA-N 0 0 360.797 3.756 20 5 FHBDRN Cc1nn(C)c(-c2nc([C@H]3CCC(C)(C)c4ccccc43)no2)c1[N+](=O)[O-] ZINC000420508759 942710181 /nfs/dbraw/zinc/71/01/81/942710181.db2.gz DZPPXBJGKZGXJP-ZDUSSCGKSA-N 0 0 367.409 3.890 20 5 FHBDRN CSc1cc(C(=O)N=c2cc(-c3cccc([N+](=O)[O-])c3)[nH][nH]2)ccc1F ZINC000501846193 942717599 /nfs/dbraw/zinc/71/75/99/942717599.db2.gz KDLBABJNEHCMSL-UHFFFAOYSA-N 0 0 372.381 3.520 20 5 FHBDRN COCCC1(c2noc(Cc3c[nH]c4ccc([N+](=O)[O-])cc34)n2)CCC1 ZINC000420514397 942719061 /nfs/dbraw/zinc/71/90/61/942719061.db2.gz MCUDXRDBSSNZOY-UHFFFAOYSA-N 0 0 356.382 3.508 20 5 FHBDRN Cc1cc(C(=O)Nc2cc(Cl)ccc2-n2cccn2)ccc1[N+](=O)[O-] ZINC000502755398 942720127 /nfs/dbraw/zinc/72/01/27/942720127.db2.gz FZUKUXQYYMWJNF-UHFFFAOYSA-N 0 0 356.769 3.995 20 5 FHBDRN CCC[C@@H](NC(=O)[C@H](C)Oc1ccc([N+](=O)[O-])c(CO)c1)c1ccccc1 ZINC000431865390 942738194 /nfs/dbraw/zinc/73/81/94/942738194.db2.gz PVCPZUMWEYVQRB-KBXCAEBGSA-N 0 0 372.421 3.512 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)NCCc1ccccc1C(F)(F)F ZINC000502778724 942739230 /nfs/dbraw/zinc/73/92/30/942739230.db2.gz JQVRJAKNOHDHIC-UHFFFAOYSA-N 0 0 352.312 3.895 20 5 FHBDRN Cc1cc(S(=O)(=O)N(Cc2cccs2)C2CC2)c(C)cc1[N+](=O)[O-] ZINC000416368314 942740885 /nfs/dbraw/zinc/74/08/85/942740885.db2.gz HNVLYABQLJXUNK-UHFFFAOYSA-N 0 0 366.464 3.626 20 5 FHBDRN CCCNc1ccc(CNC(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)cc1 ZINC000434547935 942746506 /nfs/dbraw/zinc/74/65/06/942746506.db2.gz BVKHFHMPSFGRBT-UHFFFAOYSA-N 0 0 357.410 3.664 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)cnc1N[C@@H](CO)c1ccc(Br)cc1 ZINC000502794745 942747206 /nfs/dbraw/zinc/74/72/06/942747206.db2.gz VPPYNOYMFGZILA-NSHDSACASA-N 0 0 372.606 3.551 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(C)c(-n2cccc2)c1 ZINC000014182426 942754380 /nfs/dbraw/zinc/75/43/80/942754380.db2.gz BOMCUNZJVFBBDK-UHFFFAOYSA-N 0 0 351.362 3.955 20 5 FHBDRN COc1ccc(NC(=O)[C@H](C)N2C[C@@H](C)c3ccccc32)c([N+](=O)[O-])c1 ZINC000434569263 942762128 /nfs/dbraw/zinc/76/21/28/942762128.db2.gz FLEWQXOYXBRVLI-OLZOCXBDSA-N 0 0 355.394 3.554 20 5 FHBDRN O=[N+]([O-])c1ccccc1/C=C/CN1CCO[C@H](c2ccc(F)c(F)c2)C1 ZINC000513756228 942771751 /nfs/dbraw/zinc/77/17/51/942771751.db2.gz XEADYCHPQWKUFD-JUGMSXHOSA-N 0 0 360.360 3.960 20 5 FHBDRN CC(C)C1CCC(CNC(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)CC1 ZINC000431870653 942786051 /nfs/dbraw/zinc/78/60/51/942786051.db2.gz UGUZVPBWPUJYRE-UHFFFAOYSA-N 0 0 362.426 3.558 20 5 FHBDRN Cc1nn(Cc2noc(Cc3ccccc3C)n2)c2ccc([N+](=O)[O-])cc12 ZINC000502849731 942795207 /nfs/dbraw/zinc/79/52/07/942795207.db2.gz YOTBOJAUDCRJNR-UHFFFAOYSA-N 0 0 363.377 3.583 20 5 FHBDRN O=C(NCc1cc(-c2ccccc2)on1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000110269590 942800451 /nfs/dbraw/zinc/80/04/51/942800451.db2.gz LTZHCTPRSLQFBM-UHFFFAOYSA-N 0 0 357.753 3.833 20 5 FHBDRN C[C@@H]1CCCC[C@H]1OCCNC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000431871690 942805112 /nfs/dbraw/zinc/80/51/12/942805112.db2.gz MPJUTFLZAVAVCD-RHSMWYFYSA-N 0 0 363.458 3.724 20 5 FHBDRN CNC(=O)COc1ccc(Oc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1 ZINC000514181689 942806212 /nfs/dbraw/zinc/80/62/12/942806212.db2.gz DSQKHTLJDHKCEY-UHFFFAOYSA-N 0 0 370.283 3.531 20 5 FHBDRN C[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514195696 942806883 /nfs/dbraw/zinc/80/68/83/942806883.db2.gz SJCRGTNNBORIIH-MDZLAQPJSA-N 0 0 354.353 3.989 20 5 FHBDRN Cc1csc([C@H](NC(=O)NC[C@H](C)c2ccccc2[N+](=O)[O-])C2CC2)n1 ZINC000893244459 942813324 /nfs/dbraw/zinc/81/33/24/942813324.db2.gz OXEBJDTYKCIQRU-MEDUHNTESA-N 0 0 374.466 3.914 20 5 FHBDRN Cc1csc(N(C(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)C2CC2)n1 ZINC000514186367 942813614 /nfs/dbraw/zinc/81/36/14/942813614.db2.gz PKVCVKCOSHJHDZ-UHFFFAOYSA-N 0 0 369.349 3.770 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1C[C@H](C)O[C@@H](c2ccc(F)cc2)C1 ZINC000421774162 942816584 /nfs/dbraw/zinc/81/65/84/942816584.db2.gz LBNGDYMWVXDXPW-IFXJQAMLSA-N 0 0 372.396 3.953 20 5 FHBDRN Cc1ccc(-c2cncc(C(=O)Nc3n[nH]c4ccc([N+](=O)[O-])cc43)c2)cc1 ZINC000536254168 942820427 /nfs/dbraw/zinc/82/04/27/942820427.db2.gz TWFBXEWZVVFYNF-UHFFFAOYSA-N 0 0 373.372 3.516 20 5 FHBDRN CCSc1cccc(NC(=O)C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)c1 ZINC000190122150 942824800 /nfs/dbraw/zinc/82/48/00/942824800.db2.gz GPUAXXBSVKHXCW-UHFFFAOYSA-N 0 0 373.434 3.901 20 5 FHBDRN CCCCCn1cc(CNC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)c(C)n1 ZINC000502881287 942825667 /nfs/dbraw/zinc/82/56/67/942825667.db2.gz NEXJMRSQFOCLNT-UHFFFAOYSA-N 0 0 370.409 3.966 20 5 FHBDRN O=C(N[C@@H]1C[C@@H]1C1CCCCC1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514218922 942827541 /nfs/dbraw/zinc/82/75/41/942827541.db2.gz PDSZMTXKMPDFKT-CHWSQXEVSA-N 0 0 354.353 3.895 20 5 FHBDRN COc1cc(COc2ccc(F)cc2)c([N+](=O)[O-])cc1OCC(F)F ZINC000502908739 942832850 /nfs/dbraw/zinc/83/28/50/942832850.db2.gz BPTWNTBFBWAZAG-UHFFFAOYSA-N 0 0 357.284 3.965 20 5 FHBDRN COc1ccc([C@@H](NCc2cc([N+](=O)[O-])ccc2OC)C2CC2)c(F)c1 ZINC000421824684 942833257 /nfs/dbraw/zinc/83/32/57/942833257.db2.gz JURRYMGJBCNOEJ-IBGZPJMESA-N 0 0 360.385 3.992 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@H]1C[C@@H]1c1ccccc1C(F)(F)F ZINC000505459726 942839865 /nfs/dbraw/zinc/83/98/65/942839865.db2.gz HWGVWXOTZRSURW-HIFRSBDPSA-N 0 0 365.311 3.603 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@H]1C[C@H]1c1ccccc1C(F)(F)F ZINC000505459728 942839944 /nfs/dbraw/zinc/83/99/44/942839944.db2.gz HWGVWXOTZRSURW-ZFWWWQNUSA-N 0 0 365.311 3.603 20 5 FHBDRN O=C(c1csc(-c2ccc([N+](=O)[O-])cc2)n1)N1CCc2ccsc2C1 ZINC000122944163 942843241 /nfs/dbraw/zinc/84/32/41/942843241.db2.gz JECMBLDFGOTIPG-UHFFFAOYSA-N 0 0 371.443 3.978 20 5 FHBDRN CCCCCn1cc(CNC(=O)CCc2cccc([N+](=O)[O-])c2)c(C)n1 ZINC000502904779 942844102 /nfs/dbraw/zinc/84/41/02/942844102.db2.gz OUJVFSJEMJXLMJ-UHFFFAOYSA-N 0 0 358.442 3.539 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)Nc2cccc(OC(C)C)c2)c1F ZINC000412377366 942848965 /nfs/dbraw/zinc/84/89/65/942848965.db2.gz BKYOEDQUBRGJLG-UHFFFAOYSA-N 0 0 362.357 3.711 20 5 FHBDRN COc1ccc(OCC(=O)Nc2cccc(C(F)(F)F)c2)cc1[N+](=O)[O-] ZINC000190182818 942855107 /nfs/dbraw/zinc/85/51/07/942855107.db2.gz CVQRKCMODLGERE-UHFFFAOYSA-N 0 0 370.283 3.640 20 5 FHBDRN COc1ccc(CN[C@@H](c2cc(F)ccc2F)C(F)F)cc1[N+](=O)[O-] ZINC000434689678 942866385 /nfs/dbraw/zinc/86/63/85/942866385.db2.gz XIQWIAJTGPKYGF-HNNXBMFYSA-N 0 0 358.291 3.978 20 5 FHBDRN CCn1ccnc1[C@H]1CCCCN1C(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC000421870929 942870590 /nfs/dbraw/zinc/87/05/90/942870590.db2.gz AURRZEPHVDLWHB-MRXNPFEDSA-N 0 0 356.426 3.795 20 5 FHBDRN CC(C)Cn1c(-c2ccc([N+](=O)[O-])cc2)nnc1N1C[C@@H]2[C@H](C1)C2(C)C ZINC000549442193 942871290 /nfs/dbraw/zinc/87/12/90/942871290.db2.gz LXCLAZTXTUEINV-IYBDPMFKSA-N 0 0 355.442 3.602 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NC[C@](C)(Cc1ccccc1)[C@H](C)O ZINC000421900101 942877985 /nfs/dbraw/zinc/87/79/85/942877985.db2.gz XAVILWSYBADJJL-KKSFZXQISA-N 0 0 370.449 3.571 20 5 FHBDRN O=C(N[C@H]1CCCc2cn(C3CCCC3)nc21)c1ccccc1[N+](=O)[O-] ZINC000378550215 942880911 /nfs/dbraw/zinc/88/09/11/942880911.db2.gz YNXBEUSNINXOKN-INIZCTEOSA-N 0 0 354.410 3.714 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)CO[C@H]1CCCc2ccccc21 ZINC000430088093 942882040 /nfs/dbraw/zinc/88/20/40/942882040.db2.gz GKLJLLUSESINGV-KRWDZBQOSA-N 0 0 356.378 3.636 20 5 FHBDRN C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCN2c2ccc3ncccc3c2[N+](=O)[O-])C1 ZINC000543865324 942887033 /nfs/dbraw/zinc/88/70/33/942887033.db2.gz HEXKRYOFLSUWSJ-PBYMTVQHSA-N 0 0 355.438 3.909 20 5 FHBDRN O=C(COc1ccc(F)c(Cl)c1)N1CCCc2ccc([N+](=O)[O-])cc21 ZINC000509983887 942892575 /nfs/dbraw/zinc/89/25/75/942892575.db2.gz RYSMBRQBQCMKER-UHFFFAOYSA-N 0 0 364.760 3.746 20 5 FHBDRN CC[C@@H]1CCc2nc(NC(=O)COc3ccccc3[N+](=O)[O-])sc2C1 ZINC000503011660 942896173 /nfs/dbraw/zinc/89/61/73/942896173.db2.gz DLBWMGJIJQSLJD-LLVKDONJSA-N 0 0 361.423 3.584 20 5 FHBDRN O=C(c1cc(-c2ccc([N+](=O)[O-])cc2)n[nH]1)N1CC[C@H](C2CCCC2)C1 ZINC000421947779 942901223 /nfs/dbraw/zinc/90/12/23/942901223.db2.gz KDDVYSBELKDBAN-HNNXBMFYSA-N 0 0 354.410 3.637 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])o1)N(CC(F)(F)F)[C@@H]1CCCc2cccnc21 ZINC000378586020 942911313 /nfs/dbraw/zinc/91/13/13/942911313.db2.gz WRKJUKQVOKGFFD-LLVKDONJSA-N 0 0 369.299 3.665 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H]1Cc2ccccc2O1 ZINC000103604967 942927270 /nfs/dbraw/zinc/92/72/70/942927270.db2.gz CEWWGVRQNBIPAY-SFHVURJKSA-N 0 0 369.421 3.519 20 5 FHBDRN O=C(c1cncc(-c2ccccn2)c1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000378596952 942931729 /nfs/dbraw/zinc/93/17/29/942931729.db2.gz YSOMPDAYSPKOLD-UHFFFAOYSA-N 0 0 374.400 3.857 20 5 FHBDRN CN([C@H]1CCC[C@H]1c1ccccc1)S(=O)(=O)c1ccccc1[N+](=O)[O-] ZINC000416546901 942935721 /nfs/dbraw/zinc/93/57/21/942935721.db2.gz UKQZBZZOFFVUQA-HOTGVXAUSA-N 0 0 360.435 3.552 20 5 FHBDRN C[C@@H]1CC[C@H](O)CN1C(=O)c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1 ZINC000422036492 942948541 /nfs/dbraw/zinc/94/85/41/942948541.db2.gz QBNQYBULAMMGEC-CJNGLKHVSA-N 0 0 372.446 3.731 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)N2CC=C(c3ccccc3)C2)cc1SC ZINC000378604404 942950286 /nfs/dbraw/zinc/95/02/86/942950286.db2.gz CHAJXVABQYPDKC-UHFFFAOYSA-N 0 0 370.430 3.865 20 5 FHBDRN Cn1cnc([N+](=O)[O-])c1CN(Cc1cccc(-c2cccnc2)c1)C1CC1 ZINC000503074784 942957901 /nfs/dbraw/zinc/95/79/01/942957901.db2.gz RWQYCLMDSBCEBZ-UHFFFAOYSA-N 0 0 363.421 3.555 20 5 FHBDRN Cc1ccc(Sc2ccc(C(=O)N3C[C@H](O)C[C@@H]3C)cc2[N+](=O)[O-])cc1 ZINC000473003162 942961744 /nfs/dbraw/zinc/96/17/44/942961744.db2.gz UTIWEAKIXCYKCA-DZGCQCFKSA-N 0 0 372.446 3.650 20 5 FHBDRN CCC[N@H+](Cc1cc([O-])ccc1[N+](=O)[O-])[C@@H](C)CC(=O)Nc1ccccc1 ZINC000503082081 942965578 /nfs/dbraw/zinc/96/55/78/942965578.db2.gz FAYRLDSDXYCATN-HNNXBMFYSA-N 0 0 371.437 3.930 20 5 FHBDRN C[C@@H](NC(=O)CSc1nccn1C(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000503086947 942969041 /nfs/dbraw/zinc/96/90/41/942969041.db2.gz UZOYLZILXSZGGV-GFCCVEGCSA-N 0 0 362.455 3.516 20 5 FHBDRN COC(=O)c1cccc(Cl)c1COc1ccc([N+](=O)[O-])cc1C(C)=O ZINC000505526194 942977222 /nfs/dbraw/zinc/97/72/22/942977222.db2.gz LWJMBOHTHQFIOK-UHFFFAOYSA-N 0 0 363.753 3.816 20 5 FHBDRN C[C@]1(CNC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)CCCS1 ZINC000467323764 942979585 /nfs/dbraw/zinc/97/95/85/942979585.db2.gz IXDCFNJNGAWBHX-MRXNPFEDSA-N 0 0 363.464 3.734 20 5 FHBDRN Cc1cnc(OCc2nc3cc(Br)ccc3o2)c([N+](=O)[O-])c1 ZINC000505528151 942980495 /nfs/dbraw/zinc/98/04/95/942980495.db2.gz YZLGLRRGAGNXSM-UHFFFAOYSA-N 0 0 364.155 3.781 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN(C)[C@H](C)c1c(F)cccc1F ZINC000434831922 942990394 /nfs/dbraw/zinc/99/03/94/942990394.db2.gz PQRJQNLIPGJZHJ-GFCCVEGCSA-N 0 0 363.364 3.813 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CCCc2ccccc2CC1 ZINC000412382069 942992368 /nfs/dbraw/zinc/99/23/68/942992368.db2.gz BVNUYOGQGBEHHV-VQTJNVASSA-N 0 0 350.418 3.716 20 5 FHBDRN O=C(NCCCO[C@H]1CCCc2ccccc21)c1ccc([N+](=O)[O-])cc1F ZINC000505538045 942997109 /nfs/dbraw/zinc/99/71/09/942997109.db2.gz JOHAKUSHWVUXIW-IBGZPJMESA-N 0 0 372.396 3.948 20 5 FHBDRN Cc1cc(C)c(NC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)c(C)c1 ZINC000133638908 943001156 /nfs/dbraw/zinc/00/11/56/943001156.db2.gz LYNXZTNXXMVKNG-UHFFFAOYSA-N 0 0 350.378 3.958 20 5 FHBDRN CC(C)c1ccc(C(=O)N2CCN[C@H](c3cccc(F)c3)C2)cc1[N+](=O)[O-] ZINC000505552393 943017699 /nfs/dbraw/zinc/01/76/99/943017699.db2.gz ZEGUZJJNPXOSAM-SFHVURJKSA-N 0 0 371.412 3.644 20 5 FHBDRN C[C@@H]1C[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)c2ccccc2O1 ZINC000412387402 943020053 /nfs/dbraw/zinc/02/00/53/943020053.db2.gz WINOOMZMXPGNTC-QRVDHSFSSA-N 0 0 352.390 3.727 20 5 FHBDRN C/C=C\c1ccc(OCC(=O)N2CCc3ccc([N+](=O)[O-])cc32)c(OC)c1 ZINC000205676042 943031334 /nfs/dbraw/zinc/03/13/34/943031334.db2.gz SOEHPWDGYFHBIH-ARJAWSKDSA-N 0 0 368.389 3.605 20 5 FHBDRN Nn1c(S/C=C\c2ccc([N+](=O)[O-])o2)nnc1-c1ccccc1Cl ZINC000205676400 943031459 /nfs/dbraw/zinc/03/14/59/943031459.db2.gz RBNPOEGAXWMERA-FPLPWBNLSA-N 0 0 363.786 3.577 20 5 FHBDRN Cn1cnc([N+](=O)[O-])c1CN(Cc1cc(F)ccc1F)C1CCCC1 ZINC000434909043 943044940 /nfs/dbraw/zinc/04/49/40/943044940.db2.gz HRPSPQZIPOLGLB-UHFFFAOYSA-N 0 0 350.369 3.551 20 5 FHBDRN CCOc1cc(C(=O)N([C@@H](C)C(C)C)C2CC2)c([N+](=O)[O-])cc1OC ZINC000514498346 943054725 /nfs/dbraw/zinc/05/47/25/943054725.db2.gz JUWFFXBLBNWNTG-LBPRGKRZSA-N 0 0 350.415 3.651 20 5 FHBDRN CC(C)[C@@H](CNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21)c1cccnc1 ZINC000434170352 943055299 /nfs/dbraw/zinc/05/52/99/943055299.db2.gz QFVQBHPNGCQLNQ-GOSISDBHSA-N 0 0 366.421 3.501 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N2CCC(Cc3ccc(F)cc3)CC2)c1[N+](=O)[O-] ZINC000434188672 943055559 /nfs/dbraw/zinc/05/55/59/943055559.db2.gz JORMGDKXCXFKGO-UHFFFAOYSA-N 0 0 374.416 3.675 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1CN[C@H](C)c1nc(-c2ccc(F)cc2)no1 ZINC000366609918 943056831 /nfs/dbraw/zinc/05/68/31/943056831.db2.gz QXHZUQGFUGOQSK-LLVKDONJSA-N 0 0 372.356 3.643 20 5 FHBDRN CCN(CCNC(=O)N(C)Cc1ccccc1[N+](=O)[O-])c1ccccc1C ZINC000503208552 943060514 /nfs/dbraw/zinc/06/05/14/943060514.db2.gz ULKPTYHIUMJAFD-UHFFFAOYSA-N 0 0 370.453 3.571 20 5 FHBDRN COc1cc(F)cc(C[C@@H](C)NC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)c1 ZINC000412410507 943066432 /nfs/dbraw/zinc/06/64/32/943066432.db2.gz PDMWHANRYGAYRC-ZUSMLRIVSA-N 0 0 372.396 3.593 20 5 FHBDRN COc1ccc(C[C@H](C)Nc2ncc(Cl)cc2[N+](=O)[O-])cc1OC ZINC000434945653 943066995 /nfs/dbraw/zinc/06/69/95/943066995.db2.gz DWFHBPGAIYTFKT-JTQLQIEISA-N 0 0 351.790 3.704 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)cnc1N(CCCO)Cc1cccc(Cl)c1 ZINC000434947302 943067457 /nfs/dbraw/zinc/06/74/57/943067457.db2.gz PCSMUNKYUOJULT-UHFFFAOYSA-N 0 0 356.209 3.686 20 5 FHBDRN Cc1c(CNC(=O)N2CCC[C@H](c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000431899092 943071703 /nfs/dbraw/zinc/07/17/03/943071703.db2.gz PGRFELUMPYFBCC-SFHVURJKSA-N 0 0 353.422 3.992 20 5 FHBDRN CCNc1ccc(C(=O)NCCCN(CC)c2ccccc2)cc1[N+](=O)[O-] ZINC000503229732 943073637 /nfs/dbraw/zinc/07/36/37/943073637.db2.gz BSHZKOWMNCJKBF-UHFFFAOYSA-N 0 0 370.453 3.673 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N(C)Cc2ccc(C)c(C)c2)c1F ZINC000412415649 943077389 /nfs/dbraw/zinc/07/73/89/943077389.db2.gz WUSMPHQWHRECID-UHFFFAOYSA-N 0 0 360.385 3.560 20 5 FHBDRN CCc1oc2ccccc2c1CN(C)c1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000514518483 943077431 /nfs/dbraw/zinc/07/74/31/943077431.db2.gz XVEBOLQNZJTPFH-UHFFFAOYSA-N 0 0 353.378 3.639 20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])Nc1ccc(O)c2ccccc12 ZINC000514523783 943082955 /nfs/dbraw/zinc/08/29/55/943082955.db2.gz UOTSJRJVWUATMN-UHFFFAOYSA-N 0 0 351.362 3.894 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@]2(C1)OCc1ccccc12 ZINC000183893873 943083208 /nfs/dbraw/zinc/08/32/08/943083208.db2.gz YLQHERKSVAONJP-LJQANCHMSA-N 0 0 353.378 3.567 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N1CCc2cc(F)cc(C)c2C1 ZINC000503259663 943089810 /nfs/dbraw/zinc/08/98/10/943089810.db2.gz YPVRNBURUZTTCI-UHFFFAOYSA-N 0 0 359.357 3.641 20 5 FHBDRN CCOc1ccc(OC)cc1NC(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000105042960 943094441 /nfs/dbraw/zinc/09/44/41/943094441.db2.gz WHEAKOHKVUBZOG-GFCCVEGCSA-N 0 0 359.382 3.885 20 5 FHBDRN O=C(OCc1cnn(-c2ccccc2)c1)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000016718398 943098632 /nfs/dbraw/zinc/09/86/32/943098632.db2.gz LSLCKBPANRYIFZ-UHFFFAOYSA-N 0 0 357.753 3.791 20 5 FHBDRN Cc1ccc(C(=O)N[C@H](CC(=O)OC(C)C)c2ccccc2[N+](=O)[O-])cc1 ZINC000014375982 943110474 /nfs/dbraw/zinc/11/04/74/943110474.db2.gz SBPIBDADTJUBCG-QGZVFWFLSA-N 0 0 370.405 3.716 20 5 FHBDRN COC(=O)[C@@H]1CC[C@@H](c2ccccc2)N1Cc1ccc([N+](=O)[O-])cc1C ZINC000435044850 943117302 /nfs/dbraw/zinc/11/73/02/943117302.db2.gz WBXXGXSGDKWTPI-OALUTQOASA-N 0 0 354.406 3.782 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2ccc(CN3C[C@H](O)Cc4ccccc43)o2)c1 ZINC000435047141 943118666 /nfs/dbraw/zinc/11/86/66/943118666.db2.gz BTTOQDXDLKDPNB-QGZVFWFLSA-N 0 0 350.374 3.778 20 5 FHBDRN CCN(Cc1ccc2c(c1)OCO2)C(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000128464642 943125246 /nfs/dbraw/zinc/12/52/46/943125246.db2.gz WOEBAVPMIBAXSY-UHFFFAOYSA-N 0 0 362.769 3.639 20 5 FHBDRN O=C(N[C@H]1C[C@H]1c1ccccc1C(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000505594366 943126615 /nfs/dbraw/zinc/12/66/15/943126615.db2.gz SQUVVQMKSOKEEA-ZFWWWQNUSA-N 0 0 350.296 3.900 20 5 FHBDRN CC(=O)N1C=Cc2ccccc2[C@H]1CC(=O)Oc1c(C)cccc1[N+](=O)[O-] ZINC000760016949 943131988 /nfs/dbraw/zinc/13/19/88/943131988.db2.gz KRPMRNDCWHXXAG-GOSISDBHSA-N 0 0 366.373 3.773 20 5 FHBDRN COC(=O)c1cc(NC(=O)NC2CCC3(CC3)CC2)c(C)c([N+](=O)[O-])c1 ZINC000434173718 943136061 /nfs/dbraw/zinc/13/60/61/943136061.db2.gz LZSYHWXNDSEJNP-UHFFFAOYSA-N 0 0 361.398 3.534 20 5 FHBDRN O=C(NC[C@@H]1CCCCN1Cc1ccc([N+](=O)[O-])cc1)Nc1ccccc1 ZINC000058754099 943145945 /nfs/dbraw/zinc/14/59/45/943145945.db2.gz JZQRUSMHLWEGMA-IBGZPJMESA-N 0 0 368.437 3.771 20 5 FHBDRN CC[C@@H](CC(=O)NCCNc1ccccc1[N+](=O)[O-])c1ccc(OC)cc1 ZINC000503387803 943152907 /nfs/dbraw/zinc/15/29/07/943152907.db2.gz BSWKMDVZABPAKW-HNNXBMFYSA-N 0 0 371.437 3.715 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H](OC)C1(C)C ZINC000503406914 943166217 /nfs/dbraw/zinc/16/62/17/943166217.db2.gz OVFWDZZILLQQOM-HUUCEWRRSA-N 0 0 352.456 3.640 20 5 FHBDRN Cc1cc(NC(=O)c2ccn(-c3ccc(F)cc3F)n2)ccc1[N+](=O)[O-] ZINC000183787890 943172221 /nfs/dbraw/zinc/17/22/21/943172221.db2.gz IMNDQQSQTZZZNL-UHFFFAOYSA-N 0 0 358.304 3.619 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N(C)CCOCC1CC1 ZINC000503433862 943181846 /nfs/dbraw/zinc/18/18/46/943181846.db2.gz UEGNUUMFNZWZBN-UHFFFAOYSA-N 0 0 352.456 3.596 20 5 FHBDRN CC[C@@](C)(CO)NC(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000435128105 943182243 /nfs/dbraw/zinc/18/22/43/943182243.db2.gz BYXPIWOLIMMELQ-SFHVURJKSA-N 0 0 359.382 3.670 20 5 FHBDRN Cc1cc2cc(NC(=O)c3cc([N+](=O)[O-])ccc3SCCO)ccc2[nH]1 ZINC000136355958 943224041 /nfs/dbraw/zinc/22/40/41/943224041.db2.gz OYMHWZNRUWEPFZ-UHFFFAOYSA-N 0 0 371.418 3.721 20 5 FHBDRN O=C(NCc1ccncc1C(F)(F)F)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000514751933 943266815 /nfs/dbraw/zinc/26/68/15/943266815.db2.gz MJNGQNDFCLVVPU-UHFFFAOYSA-N 0 0 359.691 3.592 20 5 FHBDRN Cc1cc(NC(=O)N([C@H](C)C(=O)OC(C)(C)C)C2CC2)ccc1[N+](=O)[O-] ZINC000416978941 943270735 /nfs/dbraw/zinc/27/07/35/943270735.db2.gz WKBYSUQCOIRSDW-GFCCVEGCSA-N 0 0 363.414 3.630 20 5 FHBDRN COc1ccc(NC(=O)NCc2cnccc2C(C)(C)C)cc1[N+](=O)[O-] ZINC000416989572 943275224 /nfs/dbraw/zinc/27/52/24/943275224.db2.gz OSZCCEXADPYLIW-UHFFFAOYSA-N 0 0 358.398 3.618 20 5 FHBDRN Cc1c(Br)cc(C(=O)N2CC(C)=C[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000435267173 943290828 /nfs/dbraw/zinc/29/08/28/943290828.db2.gz JFVDTIJPZACZSU-SECBINFHSA-N 0 0 353.216 3.704 20 5 FHBDRN O=C1CCN1c1cccc(Nc2ccc([N+](=O)[O-])cc2Br)c1 ZINC000503615190 943292568 /nfs/dbraw/zinc/29/25/68/943292568.db2.gz MURHNIXCFSCLFT-UHFFFAOYSA-N 0 0 362.183 3.838 20 5 FHBDRN CC1=C[C@@H](C)CN(C(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])C1 ZINC000435271835 943294528 /nfs/dbraw/zinc/29/45/28/943294528.db2.gz YRWWMJNVDVAEHG-SNVBAGLBSA-N 0 0 358.316 3.574 20 5 FHBDRN Cn1cc([N+](=O)[O-])c(C(=O)N2CCCc3cc(-c4ccccc4)ccc32)n1 ZINC000503603596 943294890 /nfs/dbraw/zinc/29/48/90/943294890.db2.gz VERXYSOGUUNMFC-UHFFFAOYSA-N 0 0 362.389 3.588 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)NCc1cccc(OC(C)(C)C)n1 ZINC000503629233 943299042 /nfs/dbraw/zinc/29/90/42/943299042.db2.gz PPIKVTGOQPZFDU-UHFFFAOYSA-N 0 0 358.398 3.797 20 5 FHBDRN CSc1ccc(C(=O)NCCc2cc(F)c(F)c(F)c2)cc1[N+](=O)[O-] ZINC000503648333 943309281 /nfs/dbraw/zinc/30/92/81/943309281.db2.gz JDXZZNWWKAKQSK-UHFFFAOYSA-N 0 0 370.352 3.707 20 5 FHBDRN CN(C)c1cccc(CN(C)C(=O)c2cc3cc([N+](=O)[O-])ccc3o2)c1 ZINC000431916564 943311108 /nfs/dbraw/zinc/31/11/08/943311108.db2.gz NREKURJHZDXVQT-UHFFFAOYSA-N 0 0 353.378 3.679 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCc1nc2ccccc2o1 ZINC000425326122 943316441 /nfs/dbraw/zinc/31/64/41/943316441.db2.gz YAYIVDSEWNKREQ-AWEZNQCLSA-N 0 0 353.378 3.621 20 5 FHBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1cccnc1Cl ZINC000016987482 943320592 /nfs/dbraw/zinc/32/05/92/943320592.db2.gz SVCIKQXJKSKDNB-MRVPVSSYSA-N 0 0 356.165 3.703 20 5 FHBDRN C[C@@](O)(C1CCN(Cc2ccc([N+](=O)[O-])cc2Cl)CC1)C(F)(F)F ZINC000545932318 943322082 /nfs/dbraw/zinc/32/20/82/943322082.db2.gz WPIXVMQATCGYHJ-CQSZACIVSA-N 0 0 366.767 3.774 20 5 FHBDRN CNc1ccc(C(=O)N2CC=C(c3ccc(F)cc3)CC2)cc1[N+](=O)[O-] ZINC000514840615 943323217 /nfs/dbraw/zinc/32/32/17/943323217.db2.gz LPALUKMMNAULLI-UHFFFAOYSA-N 0 0 355.369 3.705 20 5 FHBDRN Cc1c(NC(=O)NCc2ccco2)cc(Br)cc1[N+](=O)[O-] ZINC000435329563 943333043 /nfs/dbraw/zinc/33/30/43/943333043.db2.gz PYVILXZUHYHIPV-UHFFFAOYSA-N 0 0 354.160 3.580 20 5 FHBDRN COc1cc(C)c([C@H](C)OC(=O)COc2cccc([N+](=O)[O-])c2)cc1C ZINC001269939040 943343322 /nfs/dbraw/zinc/34/33/22/943343322.db2.gz KWQIHADHXQXZQT-AWEZNQCLSA-N 0 0 359.378 3.903 20 5 FHBDRN Cc1c(NC(=O)c2cc(F)cc([N+](=O)[O-])c2)cnn1-c1ccccc1F ZINC000435346060 943347163 /nfs/dbraw/zinc/34/71/63/943347163.db2.gz OMYSVIKPSPFOGL-UHFFFAOYSA-N 0 0 358.304 3.619 20 5 FHBDRN COc1ccccc1[C@H]1CCCN1C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000126472461 943352129 /nfs/dbraw/zinc/35/21/29/943352129.db2.gz GELNXSCUQONPBK-GOSISDBHSA-N 0 0 369.421 3.693 20 5 FHBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCCO[C@H](CF)C1 ZINC000412450994 943353437 /nfs/dbraw/zinc/35/34/37/943353437.db2.gz NRTAZJUXKKCRBF-CQSZACIVSA-N 0 0 370.446 3.688 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)Nc1cccc2c1CCCC2 ZINC000514893892 943356671 /nfs/dbraw/zinc/35/66/71/943356671.db2.gz FGBDLIJTLAASNI-UHFFFAOYSA-N 0 0 367.405 3.613 20 5 FHBDRN Cc1cnc(COC(=O)c2ocnc2-c2ccccc2)c(C)c1[N+](=O)[O-] ZINC001269436471 943366365 /nfs/dbraw/zinc/36/63/65/943366365.db2.gz NHKUHUCAIFDAJR-UHFFFAOYSA-N 0 0 353.334 3.619 20 5 FHBDRN COc1ccc(CNC(=O)N2CC[C@H](c3ccccc3)[C@@H]2C)cc1[N+](=O)[O-] ZINC000435384570 943372534 /nfs/dbraw/zinc/37/25/34/943372534.db2.gz NEEJBKHHVSAMDV-YOEHRIQHSA-N 0 0 369.421 3.691 20 5 FHBDRN Cc1ccc2c(CCNC(=O)CCNc3ccccc3[N+](=O)[O-])c[nH]c2c1 ZINC000503858476 943387928 /nfs/dbraw/zinc/38/79/28/943387928.db2.gz SGIGJPKCDSHTAD-UHFFFAOYSA-N 0 0 366.421 3.545 20 5 FHBDRN COCC[C@@H](C)CNC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000412467674 943393197 /nfs/dbraw/zinc/39/31/97/943393197.db2.gz GASFFXCJKPMEQQ-CQSZACIVSA-N 0 0 357.410 3.741 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCSC2(CCC2)CC1 ZINC000412452312 943398581 /nfs/dbraw/zinc/39/85/81/943398581.db2.gz LQHJQVFJIXVEHQ-ZDUSSCGKSA-N 0 0 366.508 3.964 20 5 FHBDRN COC(=O)CCC(=O)Nc1cc([N+](=O)[O-])ccc1Sc1cccs1 ZINC000435442755 943419183 /nfs/dbraw/zinc/41/91/83/943419183.db2.gz KCONTENIJSGROD-UHFFFAOYSA-N 0 0 366.420 3.699 20 5 FHBDRN Cc1c(C(=O)NCCc2ccccc2C(F)(F)F)cccc1[N+](=O)[O-] ZINC000053233956 943422758 /nfs/dbraw/zinc/42/27/58/943422758.db2.gz JDNRKWMNNVOZMA-UHFFFAOYSA-N 0 0 352.312 3.895 20 5 FHBDRN C[C@@H](NC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)[C@@H](C)c1ccccc1 ZINC000473555008 943424582 /nfs/dbraw/zinc/42/45/82/943424582.db2.gz RLAZCJSYKZJZJP-HUUCEWRRSA-N 0 0 364.405 3.703 20 5 FHBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N(C)c1ccc(Cl)cc1F ZINC000435485731 943442071 /nfs/dbraw/zinc/44/20/71/943442071.db2.gz BYNDOPHFADYDJL-UHFFFAOYSA-N 0 0 358.778 3.521 20 5 FHBDRN C[C@@H](NC(=O)NCCc1cc(F)c(F)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000503980220 943450450 /nfs/dbraw/zinc/45/04/50/943450450.db2.gz FVQLJPOGMVHUEV-SNVBAGLBSA-N 0 0 367.327 3.615 20 5 FHBDRN C[C@H](NC(=O)NCCc1cc(F)c(F)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000503980219 943450697 /nfs/dbraw/zinc/45/06/97/943450697.db2.gz FVQLJPOGMVHUEV-JTQLQIEISA-N 0 0 367.327 3.615 20 5 FHBDRN Cc1ccc2c(nccc2N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)n1 ZINC000435505444 943460865 /nfs/dbraw/zinc/46/08/65/943460865.db2.gz ONGCJGFCSDOYJF-UHFFFAOYSA-N 0 0 364.405 3.894 20 5 FHBDRN CCCC(=O)Nc1ccc(C(=O)COc2cc(OC)ccc2[N+](=O)[O-])cc1 ZINC000515059101 943480394 /nfs/dbraw/zinc/48/03/94/943480394.db2.gz AGELMOKBKZFJBF-UHFFFAOYSA-N 0 0 372.377 3.604 20 5 FHBDRN COC(=O)c1cnc(N[C@@H]2C[C@H]2c2ccc(Cl)c(F)c2)c([N+](=O)[O-])c1 ZINC000435572991 943492419 /nfs/dbraw/zinc/49/24/19/943492419.db2.gz DOBRMBLYNWNMJL-GXFFZTMASA-N 0 0 365.748 3.537 20 5 FHBDRN O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)N1CCC[C@@]2(CC=CCC2)C1 ZINC000515087491 943494716 /nfs/dbraw/zinc/49/47/16/943494716.db2.gz OTCZIPRHZVFDSO-SFHVURJKSA-N 0 0 350.365 3.764 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCc1cccc(C(C)=O)c1 ZINC000566459758 943500164 /nfs/dbraw/zinc/50/01/64/943500164.db2.gz CLZSGIDPKHYKSQ-QGZVFWFLSA-N 0 0 354.406 3.683 20 5 FHBDRN COc1ccc2c(c1)[C@H](NC(=O)c1c(Cl)cccc1[N+](=O)[O-])CCO2 ZINC001267836250 943502767 /nfs/dbraw/zinc/50/27/67/943502767.db2.gz MLQNLQLIPARSRS-CYBMUJFWSA-N 0 0 362.769 3.510 20 5 FHBDRN O=C(Nc1ccnn1-c1cccc(F)c1)[C@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1 ZINC001269499003 943506888 /nfs/dbraw/zinc/50/68/88/943506888.db2.gz NBPGYVMSQYUHPO-SJORKVTESA-N 0 0 366.352 3.662 20 5 FHBDRN C[C@H](C1CC1)n1cc(N[C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)cn1 ZINC000584736040 943510260 /nfs/dbraw/zinc/51/02/60/943510260.db2.gz JJOYCADLHPAEJU-FZKQIMNGSA-N 0 0 366.425 3.697 20 5 FHBDRN COc1cccc(NC2CCC(C(=O)OC(C)(C)C)CC2)c1[N+](=O)[O-] ZINC000505708331 943510359 /nfs/dbraw/zinc/51/03/59/943510359.db2.gz YRHOIWTUKQWAHN-UHFFFAOYSA-N 0 0 350.415 3.916 20 5 FHBDRN C[C@@H]1CN(c2cccc3cnccc32)CCN1Cc1ccccc1[N+](=O)[O-] ZINC000515123889 943516127 /nfs/dbraw/zinc/51/61/27/943516127.db2.gz MAHFUJOHQBCJLL-MRXNPFEDSA-N 0 0 362.433 3.854 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1)[C@H](NCc1ncn(-c3ccccc3)n1)CCCC2 ZINC000417325740 943516940 /nfs/dbraw/zinc/51/69/40/943516940.db2.gz CDEDVWDZHLGWCC-LJQANCHMSA-N 0 0 363.421 3.733 20 5 FHBDRN Cc1c(N[C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)cnn1[C@@H]1CCOC1 ZINC000417348099 943527500 /nfs/dbraw/zinc/52/75/00/943527500.db2.gz IKKNVZDEHOSYMW-SJLPKXTDSA-N 0 0 356.426 3.941 20 5 FHBDRN Cc1cn([C@@H](C)c2ccccc2)nc1NC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000434221492 943541434 /nfs/dbraw/zinc/54/14/34/943541434.db2.gz XXQOBXXBOOEDTJ-AWEZNQCLSA-N 0 0 365.393 3.775 20 5 FHBDRN COc1cccc(C(=O)N2CCCC[C@H]2Cc2ccccc2)c1[N+](=O)[O-] ZINC000435688009 943547522 /nfs/dbraw/zinc/54/75/22/943547522.db2.gz LCKVMYGIHDVNOW-INIZCTEOSA-N 0 0 354.406 3.841 20 5 FHBDRN O=c1c2ccc([N+](=O)[O-])cc2ncn1Cc1ccc(Cl)c2cccnc12 ZINC000515211284 943557466 /nfs/dbraw/zinc/55/74/66/943557466.db2.gz QZBHZIJOESONOA-UHFFFAOYSA-N 0 0 366.764 3.555 20 5 FHBDRN COc1cc(C)c(NS(=O)(=O)c2cc(C)cc([N+](=O)[O-])c2C)cc1C ZINC000435719070 943577911 /nfs/dbraw/zinc/57/79/11/943577911.db2.gz IIFDPTJDRIOWPS-UHFFFAOYSA-N 0 0 364.423 3.638 20 5 FHBDRN C[C@H]1C[C@H](c2ccccc2)N(C(=O)CN(C)c2ccccc2[N+](=O)[O-])C1 ZINC000515226676 943581695 /nfs/dbraw/zinc/58/16/95/943581695.db2.gz MYSJMNKUZDONOW-HNAYVOBHSA-N 0 0 353.422 3.641 20 5 FHBDRN C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)COc1ccc(F)c(Cl)c1 ZINC000504285508 943582185 /nfs/dbraw/zinc/58/21/85/943582185.db2.gz BOSRMLKQOJPAPA-SNVBAGLBSA-N 0 0 364.760 3.744 20 5 FHBDRN C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)[C@@H]1Cc2cc(Cl)ccc2O1 ZINC000504286552 943582745 /nfs/dbraw/zinc/58/27/45/943582745.db2.gz PUKOPEMYQMPZIM-QGHHPUGFSA-N 0 0 358.781 3.530 20 5 FHBDRN C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)[C@H]1Cc2cc(Cl)ccc2O1 ZINC000504286549 943582835 /nfs/dbraw/zinc/58/28/35/943582835.db2.gz PUKOPEMYQMPZIM-BMLIUANNSA-N 0 0 358.781 3.530 20 5 FHBDRN C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)CCOc1ccc(Cl)cc1 ZINC000504318887 943588502 /nfs/dbraw/zinc/58/85/02/943588502.db2.gz QRPSRPSUODMFPJ-GFCCVEGCSA-N 0 0 360.797 3.995 20 5 FHBDRN CC[C@@H](NC(=O)c1ccccc1)c1nc(-c2cc([N+](=O)[O-])c[nH]2)cs1 ZINC000434223929 943589934 /nfs/dbraw/zinc/58/99/34/943589934.db2.gz ZWYLHSYEELHQKM-CYBMUJFWSA-N 0 0 356.407 3.928 20 5 FHBDRN CCCCCn1cc(CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])c(C)n1 ZINC000504329886 943597559 /nfs/dbraw/zinc/59/75/59/943597559.db2.gz WAGALQVRYUQOFP-UHFFFAOYSA-N 0 0 364.833 3.873 20 5 FHBDRN Cc1cc(OCC(=O)N2c3ccc([N+](=O)[O-])cc3C[C@@H]2C)ccc1Cl ZINC000504334149 943598020 /nfs/dbraw/zinc/59/80/20/943598020.db2.gz IPRBACIVRMCUDR-LBPRGKRZSA-N 0 0 360.797 3.913 20 5 FHBDRN O=C(c1n[nH]c2ccc([N+](=O)[O-])cc21)N1CCC[C@H]1/C=C\c1ccccc1 ZINC000504336634 943599797 /nfs/dbraw/zinc/59/97/97/943599797.db2.gz OLWIECGOHGMYPB-CDNLZTBQSA-N 0 0 362.389 3.789 20 5 FHBDRN COC(=O)[C@H](C)c1ccc(NC(=O)N[C@H](C)c2ccccc2[N+](=O)[O-])cc1 ZINC000417425235 943600181 /nfs/dbraw/zinc/60/01/81/943600181.db2.gz VTUYGIOHVBVHSY-CHWSQXEVSA-N 0 0 371.393 3.754 20 5 FHBDRN NC(=O)c1ccnc(N2CCCCC[C@H]2/C=C/c2ccccc2)c1[N+](=O)[O-] ZINC000584788867 943617881 /nfs/dbraw/zinc/61/78/81/943617881.db2.gz NYAJRGRODRCQLX-OFAQMXQXSA-N 0 0 366.421 3.551 20 5 FHBDRN Cc1c(C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)nnn1-c1ccccc1Cl ZINC000504445724 943627958 /nfs/dbraw/zinc/62/79/58/943627958.db2.gz KSLZQNGKXSGPIN-UHFFFAOYSA-N 0 0 371.784 3.698 20 5 FHBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CCCc2occc2C1 ZINC000584803441 943636442 /nfs/dbraw/zinc/63/64/42/943636442.db2.gz IPVPYZCEOMTTID-NSHDSACASA-N 0 0 364.785 3.584 20 5 FHBDRN CC(C)(C)c1ccc2c(c1)CCN2S(=O)(=O)c1ccc([N+](=O)[O-])s1 ZINC000504503903 943647821 /nfs/dbraw/zinc/64/78/21/943647821.db2.gz OXRNNDNMBOYOJH-UHFFFAOYSA-N 0 0 366.464 3.705 20 5 FHBDRN C[C@@H]1CCC[C@H](NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])C1 ZINC000048189277 943664055 /nfs/dbraw/zinc/66/40/55/943664055.db2.gz XLVBHAIZXLYCJV-MNOVXSKESA-N 0 0 360.332 3.844 20 5 FHBDRN Cc1ccc(CN(C)CC(=O)N(C)[C@@H](C)c2ccccc2)cc1[N+](=O)[O-] ZINC000504575916 943689541 /nfs/dbraw/zinc/68/95/41/943689541.db2.gz TVUNOQXXTIXMJM-INIZCTEOSA-N 0 0 355.438 3.555 20 5 FHBDRN CCOC(=O)c1cc(-c2nc(Cc3ccc(F)cc3)no2)cc([N+](=O)[O-])c1 ZINC000504603245 943694096 /nfs/dbraw/zinc/69/40/96/943694096.db2.gz CECNBBSKBYHWFJ-UHFFFAOYSA-N 0 0 371.324 3.551 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCC(c2cccc(N)c2)CC1 ZINC000424029674 943694811 /nfs/dbraw/zinc/69/48/11/943694811.db2.gz DFOKWVQLDXWFIN-UHFFFAOYSA-N 0 0 353.422 3.814 20 5 FHBDRN C[C@@H](c1ccccc1)N(C)C(=O)CN(C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000504590206 943701177 /nfs/dbraw/zinc/70/11/77/943701177.db2.gz QLAARRGQTBDYJZ-VEMDQMBVSA-N 0 0 367.449 3.759 20 5 FHBDRN Cc1ccc([C@@H](C)N2C(=O)N[C@H](CC3CCCCC3)C2=O)cc1[N+](=O)[O-] ZINC000431954091 943703515 /nfs/dbraw/zinc/70/35/15/943703515.db2.gz OWEZOUBOUMPPBR-CZUORRHYSA-N 0 0 359.426 3.855 20 5 FHBDRN Cc1ccc(OC[C@H](O)COc2cc(C)c([N+](=O)[O-])cc2Cl)cc1 ZINC000504672846 943738956 /nfs/dbraw/zinc/73/89/56/943738956.db2.gz FXJOPOWVRZRUKH-ZDUSSCGKSA-N 0 0 351.786 3.684 20 5 FHBDRN Cc1cc(OC[C@H](O)COCc2cccs2)c(Cl)cc1[N+](=O)[O-] ZINC000504681430 943742184 /nfs/dbraw/zinc/74/21/84/943742184.db2.gz XXFYIGDYDSMZDH-LLVKDONJSA-N 0 0 357.815 3.575 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)Nc2nnc(-c3ccco3)s2)c1 ZINC000053315919 943744716 /nfs/dbraw/zinc/74/47/16/943744716.db2.gz DIHHDQBOAFNYQF-UHFFFAOYSA-N 0 0 362.392 3.681 20 5 FHBDRN CCOc1cc(C(=O)NC[C@H]2CCC[C@H]2C2CC2)c([N+](=O)[O-])cc1OC ZINC000412484505 943758350 /nfs/dbraw/zinc/75/83/50/943758350.db2.gz XIRQYVVOTMORRF-KGLIPLIRSA-N 0 0 362.426 3.558 20 5 FHBDRN Cc1sc(C(=O)N[C@@H]2C[C@H]2c2cc(F)c(F)c(F)c2)cc1[N+](=O)[O-] ZINC000437380836 943763867 /nfs/dbraw/zinc/76/38/67/943763867.db2.gz PSYVXLPZJFGWTM-GZMMTYOYSA-N 0 0 356.325 3.668 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H](C2CCOCC2)C1 ZINC000366662226 943763876 /nfs/dbraw/zinc/76/38/76/943763876.db2.gz AYAFETCNHZPKRG-AWEZNQCLSA-N 0 0 364.467 3.596 20 5 FHBDRN C[C@H]1CN(C(=O)c2cc3cc([N+](=O)[O-])ccc3o2)[C@@H](c2ccccc2)CO1 ZINC000437380072 943764848 /nfs/dbraw/zinc/76/48/48/943764848.db2.gz LKYVUFJOENZEQK-SUMWQHHRSA-N 0 0 366.373 3.943 20 5 FHBDRN COc1ccc(CN(C)C(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)cc1 ZINC000435814970 943771332 /nfs/dbraw/zinc/77/13/32/943771332.db2.gz BYTAZSLAKHFJJX-UHFFFAOYSA-N 0 0 372.424 3.962 20 5 FHBDRN C[C@@H](C[NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1)CC(=O)[O-] ZINC000417625568 943775684 /nfs/dbraw/zinc/77/56/84/943775684.db2.gz ROYLSUCCUBJBRB-CQSZACIVSA-N 0 0 357.410 3.563 20 5 FHBDRN CCC(CC)[C@@H](CCNC(=O)Nc1cc([N+](=O)[O-])ccc1OC)OC ZINC000437407168 943782315 /nfs/dbraw/zinc/78/23/15/943782315.db2.gz OGMNWHCFWTWWBL-OAHLLOKOSA-N 0 0 353.419 3.566 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@H]1C[C@@H]1c1ccccc1OC(F)F ZINC000437410518 943784163 /nfs/dbraw/zinc/78/41/63/943784163.db2.gz UEJOIAFVQJLHPX-CABCVRRESA-N 0 0 362.332 3.791 20 5 FHBDRN C[C@H]1COCC[C@H]1C(=O)N(Cc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000435809332 943785609 /nfs/dbraw/zinc/78/56/09/943785609.db2.gz PGUPZORAMQYSLW-HNAYVOBHSA-N 0 0 354.406 3.801 20 5 FHBDRN COc1ccccc1CN(C)C(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000435837702 943791506 /nfs/dbraw/zinc/79/15/06/943791506.db2.gz WAZPPSHGLNRSQR-UHFFFAOYSA-N 0 0 372.424 3.962 20 5 FHBDRN CCn1c(C)nc([N+](=O)[O-])c1NCc1ccc(OCc2ccccn2)cc1 ZINC000584859433 943793888 /nfs/dbraw/zinc/79/38/88/943793888.db2.gz UXCRASGXOSRYAN-UHFFFAOYSA-N 0 0 367.409 3.706 20 5 FHBDRN O=C(N[C@H]1C[C@H](c2cccc(F)c2)C1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000437423032 943795913 /nfs/dbraw/zinc/79/59/13/943795913.db2.gz SIAOVAVNVALJDC-CZIWCDLHSA-N 0 0 369.396 3.984 20 5 FHBDRN C[C@H](NC(=O)c1cccc2c(=O)c3cccc(F)c3[nH]c12)c1cccnc1 ZINC000435830043 943799694 /nfs/dbraw/zinc/79/96/94/943799694.db2.gz AKOFOQCBUWQTAZ-LBPRGKRZSA-N 0 0 361.376 3.706 20 5 FHBDRN CC(C)C[C@H]1C[C@@H](NC(=O)c2c([N+](=O)[O-])cccc2C(F)(F)F)CCO1 ZINC000515332767 943802514 /nfs/dbraw/zinc/80/25/14/943802514.db2.gz RDKWOGNCHQQWCV-RYUDHWBXSA-N 0 0 374.359 3.937 20 5 FHBDRN CC(C)c1ccc(C[NH2+]CC[C@@H](CC(=O)[O-])C(F)(F)F)cc1[N+](=O)[O-] ZINC000417655831 943803508 /nfs/dbraw/zinc/80/35/08/943803508.db2.gz KELARVDMMMGQFO-LBPRGKRZSA-N 0 0 362.348 3.851 20 5 FHBDRN COc1ccc(Br)cc1NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000048444724 943812212 /nfs/dbraw/zinc/81/22/12/943812212.db2.gz UOIHRORKGMPKCP-UHFFFAOYSA-N 0 0 351.156 3.618 20 5 FHBDRN CC[C@@H](C(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)[N@H+](C)Cc1ccccc1 ZINC000516897921 943814160 /nfs/dbraw/zinc/81/41/60/943814160.db2.gz KMQXBXIYIMGSNI-LPHOPBHVSA-N 0 0 369.465 3.991 20 5 FHBDRN CC[C@H](C(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)[N@H+](C)Cc1ccccc1 ZINC000516897922 943814392 /nfs/dbraw/zinc/81/43/92/943814392.db2.gz KMQXBXIYIMGSNI-QFBILLFUSA-N 0 0 369.465 3.991 20 5 FHBDRN CSc1ccc(NC(=O)c2c([N+](=O)[O-])cccc2C(F)(F)F)cn1 ZINC000584866038 943816648 /nfs/dbraw/zinc/81/66/48/943816648.db2.gz MZVXFJORJDLHAF-UHFFFAOYSA-N 0 0 357.313 3.983 20 5 FHBDRN CCOc1cccc(CCC(=O)N2CCCc3ccc([N+](=O)[O-])cc32)c1 ZINC001125911642 943825398 /nfs/dbraw/zinc/82/53/98/943825398.db2.gz ZDIWAAARVIYENK-UHFFFAOYSA-N 0 0 354.406 3.906 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)NC[C@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000437460717 943830042 /nfs/dbraw/zinc/83/00/42/943830042.db2.gz HXLDQVAGJBERDO-QWHCGFSZSA-N 0 0 359.348 3.763 20 5 FHBDRN CC(C)(NC(=O)c1ccc([N+](=O)[O-])cn1)c1cccc(C(F)(F)F)c1 ZINC000584873591 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FHBDRN Cn1nc(CCNc2cc(C(F)(F)F)ncc2[N+](=O)[O-])c2ccccc21 ZINC000436332861 944212480 /nfs/dbraw/zinc/21/24/80/944212480.db2.gz BENGFIJGINRKGD-UHFFFAOYSA-N 0 0 365.315 3.550 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CCC[C@](C)(c2ccccc2)C1 ZINC000500182723 944219233 /nfs/dbraw/zinc/21/92/33/944219233.db2.gz KMFXSATVYCZTAN-NRFANRHFSA-N 0 0 367.449 3.895 20 5 FHBDRN Cc1cc(NC(=O)Cc2ccc(C)cc2)n(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000105587600 944227208 /nfs/dbraw/zinc/22/72/08/944227208.db2.gz ZMGCOPXESWPKBT-UHFFFAOYSA-N 0 0 350.378 3.579 20 5 FHBDRN CCCN(C(=O)[C@H]1CC(c2ccc(C)cc2)=NO1)c1cccc([N+](=O)[O-])c1 ZINC001270288710 944231663 /nfs/dbraw/zinc/23/16/63/944231663.db2.gz GOBBRPJGWXGFBT-LJQANCHMSA-N 0 0 367.405 3.839 20 5 FHBDRN CCC[C@]1(C(=O)OCC)CCCN1C(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000436350906 944233030 /nfs/dbraw/zinc/23/30/30/944233030.db2.gz AVFHEYGTUXZFIS-QGZVFWFLSA-N 0 0 368.817 3.586 20 5 FHBDRN O=C(Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1)C1(c2ccccc2F)CC1 ZINC000126565217 944233499 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3.944 20 5 FHBDRN COc1cccc(C[C@@H]2CCCN2C(=O)NCc2ccc([N+](=O)[O-])cc2)c1 ZINC000518349730 944291986 /nfs/dbraw/zinc/29/19/86/944291986.db2.gz GYWRKUGXKPVEOY-SFHVURJKSA-N 0 0 369.421 3.520 20 5 FHBDRN Cc1cc(OC(C)C)ccc1NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000517437085 944295230 /nfs/dbraw/zinc/29/52/30/944295230.db2.gz UTNAKXKNNMXJRA-UHFFFAOYSA-N 0 0 354.366 3.819 20 5 FHBDRN CCCCn1cc(CNc2cc(C(F)(F)F)ncc2[N+](=O)[O-])c(C)n1 ZINC000436410730 944299104 /nfs/dbraw/zinc/29/91/04/944299104.db2.gz KYYCQDNIAMBQKC-UHFFFAOYSA-N 0 0 357.336 3.926 20 5 FHBDRN C[C@@H](c1ccc(F)cc1)[S@@](=O)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000517470557 944314844 /nfs/dbraw/zinc/31/48/44/944314844.db2.gz KAVAPEWDGIVLIF-FTJNGKRUSA-N 0 0 365.382 3.610 20 5 FHBDRN C[C@@H](c1ccc(F)cc1)[S@](=O)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000517470558 944315301 /nfs/dbraw/zinc/31/53/01/944315301.db2.gz KAVAPEWDGIVLIF-JPQMIFPKSA-N 0 0 365.382 3.610 20 5 FHBDRN O=C(NCc1ccc(-c2ccccc2)o1)NCc1ccccc1[N+](=O)[O-] ZINC000518356921 944317948 /nfs/dbraw/zinc/31/79/48/944317948.db2.gz KMHAUTVQEYYZDQ-UHFFFAOYSA-N 0 0 351.362 3.854 20 5 FHBDRN Cc1ccccc1C1(C(=O)NCCOc2ccc([N+](=O)[O-])cc2)CCC1 ZINC000518358667 944319688 /nfs/dbraw/zinc/31/96/88/944319688.db2.gz ONZCTMGWIYBZJJ-UHFFFAOYSA-N 0 0 354.406 3.520 20 5 FHBDRN O=C(N[C@H]1CCC[C@H]1OCc1ccccc1)c1ccc([N+](=O)[O-])cc1F ZINC000123265674 944321986 /nfs/dbraw/zinc/32/19/86/944321986.db2.gz RDQPCKJLZOFRBY-ZWKOTPCHSA-N 0 0 358.369 3.602 20 5 FHBDRN Cc1nn(C)c(C(=O)N2CCCC[C@@H]2c2cccc(Cl)c2)c1[N+](=O)[O-] ZINC000436447874 944322362 /nfs/dbraw/zinc/32/23/62/944322362.db2.gz LGTRBPNNEPLTDM-CQSZACIVSA-N 0 0 362.817 3.658 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)N2CCCC[C@@H]2c2cccc(Cl)c2)n1 ZINC000436447101 944323790 /nfs/dbraw/zinc/32/37/90/944323790.db2.gz ADHJSJHPWKTECR-CQSZACIVSA-N 0 0 362.817 3.832 20 5 FHBDRN Cc1ccc([C@H](CNc2cc(C(=O)[O-])ccc2[N+](=O)[O-])[NH+]2CCCC2)cc1 ZINC000518381874 944333442 /nfs/dbraw/zinc/33/34/42/944333442.db2.gz ZUVYMUJDNLUQQS-IBGZPJMESA-N 0 0 369.421 3.850 20 5 FHBDRN Cn1cc(-c2nc(-c3ccc([N+](=O)[O-])s3)no2)c(-c2cccs2)n1 ZINC000515915735 944340507 /nfs/dbraw/zinc/34/05/07/944340507.db2.gz ABDJUQRLZRJIMO-UHFFFAOYSA-N 0 0 359.392 3.835 20 5 FHBDRN Cc1c([N+](=O)[O-])ccc(=O)n1CC(=O)c1ccc(Oc2ccccc2)cc1 ZINC000436472903 944352285 /nfs/dbraw/zinc/35/22/85/944352285.db2.gz BWRAIMSXOGTKKJ-UHFFFAOYSA-N 0 0 364.357 3.740 20 5 FHBDRN Cc1nn(CC(=O)N2c3ccccc3CCc3ccccc32)cc1[N+](=O)[O-] ZINC000436473339 944353611 /nfs/dbraw/zinc/35/36/11/944353611.db2.gz HAJZOIWWHCKWAX-UHFFFAOYSA-N 0 0 362.389 3.563 20 5 FHBDRN O=[N+]([O-])c1ccc(OC[C@H](O)COCc2ccccc2F)c2ccccc21 ZINC000550178374 944356164 /nfs/dbraw/zinc/35/61/64/944356164.db2.gz HPMLOKZEMHCRNV-OAHLLOKOSA-N 0 0 371.364 3.844 20 5 FHBDRN Cc1nn([C@@H](C)c2nc(=O)c3c(-c4ccco4)csc3[nH]2)cc1[N+](=O)[O-] ZINC000436475133 944356407 /nfs/dbraw/zinc/35/64/07/944356407.db2.gz RTXINGRGVAXXJE-VIFPVBQESA-N 0 0 371.378 3.679 20 5 FHBDRN CC(C)O[C@H]1C[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)C1(C)C ZINC000500260031 944359893 /nfs/dbraw/zinc/35/98/93/944359893.db2.gz DKJFEXOWYHJRCT-KBPBESRZSA-N 0 0 374.359 3.936 20 5 FHBDRN COc1cc(C)cc(CNC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 ZINC000505838668 944363125 /nfs/dbraw/zinc/36/31/25/944363125.db2.gz LNLGQBROIAHQNO-UHFFFAOYSA-N 0 0 368.311 3.861 20 5 FHBDRN C[C@]1(c2ccccc2)CCN(c2c(Br)cncc2[N+](=O)[O-])C1 ZINC000500265345 944367981 /nfs/dbraw/zinc/36/79/81/944367981.db2.gz DAXVJWDKUSFYBP-INIZCTEOSA-N 0 0 362.227 3.920 20 5 FHBDRN C[C@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl)[C@H]1Oc2ccccc2[C@@H]1C ZINC000438159102 944371691 /nfs/dbraw/zinc/37/16/91/944371691.db2.gz SGNZQCNZULCERY-ZKTNFTSUSA-N 0 0 374.824 3.860 20 5 FHBDRN Cc1cc(NC(=O)N[C@@H](C)c2cccc(-n3cccn3)c2)ccc1[N+](=O)[O-] ZINC000473764049 944375445 /nfs/dbraw/zinc/37/54/45/944375445.db2.gz JYYFMDGBXFTWCK-AWEZNQCLSA-N 0 0 365.393 3.972 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)c1ccc(Cn2cccn2)cc1 ZINC000086625090 944378272 /nfs/dbraw/zinc/37/82/72/944378272.db2.gz KKPOPOHYZFFNES-UHFFFAOYSA-N 0 0 350.378 3.709 20 5 FHBDRN O=[N+]([O-])c1cc(F)ccc1N[C@H]1CCc2nnc(-c3ccc(F)cc3)n2C1 ZINC000505840972 944378399 /nfs/dbraw/zinc/37/83/99/944378399.db2.gz SQRMFOGVQCEMRW-AWEZNQCLSA-N 0 0 371.347 3.558 20 5 FHBDRN CSc1cccc(C(=O)NC[C@]2(C)CCOC3(CCC3)C2)c1[N+](=O)[O-] ZINC000894659720 944379424 /nfs/dbraw/zinc/37/94/24/944379424.db2.gz APGHVHOYNMQIGO-QGZVFWFLSA-N 0 0 364.467 3.786 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)Nc1cc(-c2cccs2)[nH]n1 ZINC000436510093 944381741 /nfs/dbraw/zinc/38/17/41/944381741.db2.gz MKYGTNVSSCMDOT-UHFFFAOYSA-N 0 0 357.395 3.729 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)c1c(Cl)nccc1C(F)(F)F ZINC000123616251 944383617 /nfs/dbraw/zinc/38/36/17/944383617.db2.gz BYUNZWOWECTIBT-UHFFFAOYSA-N 0 0 373.718 3.635 20 5 FHBDRN C[C@@]1(CNC(=O)CSc2ccccc2[N+](=O)[O-])CCOC2(CCC2)C1 ZINC000894661584 944384241 /nfs/dbraw/zinc/38/42/41/944384241.db2.gz ZQOAUPPHJVZFJM-QGZVFWFLSA-N 0 0 364.467 3.543 20 5 FHBDRN C[C@@H](OC(=O)c1c(Cl)cccc1[N+](=O)[O-])c1cn(-c2ccccc2)nn1 ZINC000123585271 944386124 /nfs/dbraw/zinc/38/61/24/944386124.db2.gz BWEHLYOKWKJZSX-LLVKDONJSA-N 0 0 372.768 3.747 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N1CCN(c2cccs2)CC1 ZINC000439166196 944389076 /nfs/dbraw/zinc/38/90/76/944389076.db2.gz WMERFWUVLVCBMR-UHFFFAOYSA-N 0 0 365.842 3.581 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCCNc1cccc(C)n1 ZINC000506500084 944391347 /nfs/dbraw/zinc/39/13/47/944391347.db2.gz OAQAGIGKHMIDJA-UHFFFAOYSA-N 0 0 374.466 3.642 20 5 FHBDRN C[C@]1(CNC(=O)c2ccc([N+](=O)[O-])cc2Cl)CCOC2(CCC2)C1 ZINC000894674132 944392411 /nfs/dbraw/zinc/39/24/11/944392411.db2.gz VGSMGMKSTULSKQ-INIZCTEOSA-N 0 0 352.818 3.717 20 5 FHBDRN Cc1coc2ccc(NC(=O)N3CCC[C@H](n4cc([N+](=O)[O-])cn4)C3)cc12 ZINC000364343689 944403534 /nfs/dbraw/zinc/40/35/34/944403534.db2.gz XHQUHRKKIDWQOJ-AWEZNQCLSA-N 0 0 369.381 3.715 20 5 FHBDRN Cc1ccc(C(=O)Nc2ccnn2Cc2ccccc2F)cc1[N+](=O)[O-] ZINC000105973804 944406494 /nfs/dbraw/zinc/40/64/94/944406494.db2.gz PHIOOGGEFVYVKB-UHFFFAOYSA-N 0 0 354.341 3.539 20 5 FHBDRN C[C@H](Cc1cccc(O)c1)NC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000438189666 944406404 /nfs/dbraw/zinc/40/64/04/944406404.db2.gz UIFINVXLUOLGBG-SNVBAGLBSA-N 0 0 368.311 3.680 20 5 FHBDRN CN(C(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1)c1ccc(Cl)cc1F ZINC000439183402 944406547 /nfs/dbraw/zinc/40/65/47/944406547.db2.gz PCZQRILLHDZCFK-UHFFFAOYSA-N 0 0 374.759 3.850 20 5 FHBDRN O=C(N[C@@H]1CCC[C@H]1c1ccccc1)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000518454904 944407589 /nfs/dbraw/zinc/40/75/89/944407589.db2.gz ARZBVSIKCASTOC-GOEBONIOSA-N 0 0 350.378 3.537 20 5 FHBDRN O=[N+]([O-])c1cc(COc2ccc(-c3nncs3)cc2)c2c(c1)COCO2 ZINC000439184723 944409094 /nfs/dbraw/zinc/40/90/94/944409094.db2.gz BJGLBCDAVZKOJY-UHFFFAOYSA-N 0 0 371.374 3.559 20 5 FHBDRN COC[C@H]1CCCN(c2cc(C(F)(F)C(F)(F)F)ncc2[N+](=O)[O-])C1 ZINC000518475463 944414657 /nfs/dbraw/zinc/41/46/57/944414657.db2.gz CFXSZINHFXXPPW-VIFPVBQESA-N 0 0 369.290 3.507 20 5 FHBDRN Cc1cc(NC(=O)NCc2cccc(OC(C)(C)C)n2)ccc1[N+](=O)[O-] ZINC000473773357 944415917 /nfs/dbraw/zinc/41/59/17/944415917.db2.gz BQYYAKUEONLSOF-UHFFFAOYSA-N 0 0 358.398 3.797 20 5 FHBDRN CCN(Cc1ccc(C)cc1)C(=O)NCCOc1ccc([N+](=O)[O-])cc1 ZINC000517589983 944421360 /nfs/dbraw/zinc/42/13/60/944421360.db2.gz BYDYDUBTUAMAKI-UHFFFAOYSA-N 0 0 357.410 3.514 20 5 FHBDRN Nc1ccc(C(=O)Nc2ccc(F)cc2OC2CCCC2)cc1[N+](=O)[O-] ZINC000123786849 944424089 /nfs/dbraw/zinc/42/40/89/944424089.db2.gz JMDDGSYHLIVITN-UHFFFAOYSA-N 0 0 359.357 3.890 20 5 FHBDRN Cc1cc(NC(=O)N[C@@H](C)c2ccc([S@](C)=O)cc2)ccc1[N+](=O)[O-] ZINC000473774326 944427228 /nfs/dbraw/zinc/42/72/28/944427228.db2.gz SFJUOEUWEYFWHE-VDBVYFBLSA-N 0 0 361.423 3.523 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)C[C@@H]1CCCO1 ZINC000506192767 944437318 /nfs/dbraw/zinc/43/73/18/944437318.db2.gz POKZRNWJIDSHKV-OCCSQVGLSA-N 0 0 352.456 3.784 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2CCC(CC(F)(F)F)CC2)c1 ZINC000516030735 944443866 /nfs/dbraw/zinc/44/38/66/944443866.db2.gz UHBFWGRIVRAWAT-UHFFFAOYSA-N 0 0 374.359 3.863 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H](c3ccccc3)OC[C@H]2C)c1 ZINC000110315554 944444075 /nfs/dbraw/zinc/44/40/75/944444075.db2.gz CDRXXKZREVLGPD-ACJLOTCBSA-N 0 0 372.446 3.919 20 5 FHBDRN Cc1cccc(-c2nnc([C@@H](C)OC(=O)c3ccc([N+](=O)[O-])cc3)o2)c1 ZINC000017483991 944447009 /nfs/dbraw/zinc/44/70/09/944447009.db2.gz KCIPSASPOVKJTB-GFCCVEGCSA-N 0 0 353.334 3.871 20 5 FHBDRN Cc1ccc(S(=O)(=O)N2CCC[C@H](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000518510490 944454249 /nfs/dbraw/zinc/45/42/49/944454249.db2.gz RPGDCSYTXLQYLN-QGZVFWFLSA-N 0 0 374.462 3.547 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1C[C@@H]2CCC[C@]2(C(F)(F)F)C1 ZINC000894378499 944456957 /nfs/dbraw/zinc/45/69/57/944456957.db2.gz SXJZJZDHINWQLR-FAYQHZLMSA-N 0 0 368.355 3.889 20 5 FHBDRN CCN(C(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)c1cccnc1C ZINC000439231581 944458939 /nfs/dbraw/zinc/45/89/39/944458939.db2.gz IVRZMTZOKVGSSU-UHFFFAOYSA-N 0 0 353.300 3.984 20 5 FHBDRN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CCC2(C1)Oc1ccccc1O2 ZINC000516073986 944466064 /nfs/dbraw/zinc/46/60/64/944466064.db2.gz HTPKCTRACHEEDE-RVDMUPIBSA-N 0 0 352.390 3.872 20 5 FHBDRN CCOc1cc(NC(=O)N[C@H]2CCC[C@H](F)C2)c([N+](=O)[O-])cc1OCC ZINC000518524665 944471389 /nfs/dbraw/zinc/47/13/89/944471389.db2.gz JEMYDKCXIIEMFD-RYUDHWBXSA-N 0 0 369.393 3.794 20 5 FHBDRN C[C@@H]1CCN(C(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)[C@H]2CCCC[C@H]12 ZINC000517645562 944476253 /nfs/dbraw/zinc/47/62/53/944476253.db2.gz ZQVMPYGFJHNADG-DFHBCGBQSA-N 0 0 369.421 3.889 20 5 FHBDRN COc1cccc2c1OCC[C@@H]2NC(=O)c1cccc(SC)c1[N+](=O)[O-] ZINC000366646853 944477473 /nfs/dbraw/zinc/47/74/73/944477473.db2.gz VSVXEGDQYLLQMB-ZDUSSCGKSA-N 0 0 374.418 3.579 20 5 FHBDRN Cc1ccccc1NC(=O)[C@H](C)OC(=O)CSc1ccccc1[N+](=O)[O-] ZINC000025062331 944477807 /nfs/dbraw/zinc/47/78/07/944477807.db2.gz QQUUJZAZABUXEY-ZDUSSCGKSA-N 0 0 374.418 3.566 20 5 FHBDRN Cc1cc(NC(=O)N(C)[C@H](C)[C@@H]2Cc3ccccc3O2)ccc1[N+](=O)[O-] ZINC000473787402 944485138 /nfs/dbraw/zinc/48/51/38/944485138.db2.gz VXRVKOVUIYMDBZ-ACJLOTCBSA-N 0 0 355.394 3.759 20 5 FHBDRN O=C(CCn1cc([N+](=O)[O-])cn1)Nc1c(Cl)cc(Cl)cc1Cl ZINC000439270220 944492203 /nfs/dbraw/zinc/49/22/03/944492203.db2.gz GJXDTLQMVGMBES-UHFFFAOYSA-N 0 0 363.588 3.780 20 5 FHBDRN Cc1ccc(C)c(CSCC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)c1 ZINC000518555575 944498832 /nfs/dbraw/zinc/49/88/32/944498832.db2.gz KBCIMHPUGWRJCF-UHFFFAOYSA-N 0 0 374.418 3.812 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCN(C)c2ccccc21 ZINC000110474868 944500009 /nfs/dbraw/zinc/50/00/09/944500009.db2.gz UDJLYVZFSZUVNB-CYBMUJFWSA-N 0 0 357.435 3.558 20 5 FHBDRN Cc1ccc(NC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)c(C)c1O ZINC000439281495 944501114 /nfs/dbraw/zinc/50/11/14/944501114.db2.gz AMLRNVAIXXACCX-UHFFFAOYSA-N 0 0 366.377 3.570 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@]1(Cc2ccc(Cl)cc2)CCOC1 ZINC000500319569 944503327 /nfs/dbraw/zinc/50/33/27/944503327.db2.gz DBCIMSZKHILYFC-IBGZPJMESA-N 0 0 374.824 3.688 20 5 FHBDRN C[C@H](C(=O)N1CC[C@@]2(C1)CCc1ccccc1O2)c1cccc([N+](=O)[O-])c1 ZINC000519571310 944503460 /nfs/dbraw/zinc/50/34/60/944503460.db2.gz LKPZBRVSLBNBCD-YCRPNKLZSA-N 0 0 366.417 3.695 20 5 FHBDRN O=C(CSc1ccccc1[N+](=O)[O-])Nc1cccc(NC(=O)C2CC2)c1 ZINC000506855613 944505317 /nfs/dbraw/zinc/50/53/17/944505317.db2.gz GFXSHKLMAQHZSU-UHFFFAOYSA-N 0 0 371.418 3.674 20 5 FHBDRN C[C@@H](NC(=O)Nc1ccc2c(c1)NC(=O)CS2)c1cccc([N+](=O)[O-])c1 ZINC000509726832 944509560 /nfs/dbraw/zinc/50/95/60/944509560.db2.gz BQJUJERYFKJMLS-SNVBAGLBSA-N 0 0 372.406 3.522 20 5 FHBDRN CC[C@@H](NC(=O)c1cc(OC)ccc1[N+](=O)[O-])c1ccc(OC)c(OC)c1 ZINC000516112823 944513057 /nfs/dbraw/zinc/51/30/57/944513057.db2.gz FCTMEWZLRAOFHH-OAHLLOKOSA-N 0 0 374.393 3.502 20 5 FHBDRN CC(=O)c1ccc(-c2ccc(C(=O)N(C)c3ccc([N+](=O)[O-])nc3)o2)cc1 ZINC000439299491 944516061 /nfs/dbraw/zinc/51/60/61/944516061.db2.gz VBKKOUCATQMDHY-UHFFFAOYSA-N 0 0 365.345 3.729 20 5 FHBDRN COC(=O)c1cccc(Cl)c1COc1c(Cl)cncc1[N+](=O)[O-] ZINC000506541878 944519379 /nfs/dbraw/zinc/51/93/79/944519379.db2.gz SHCQCRVEXGEWKO-UHFFFAOYSA-N 0 0 357.149 3.662 20 5 FHBDRN COc1ccc(OC)c([C@@H](C)NC(=O)c2c(C)c(F)ccc2[N+](=O)[O-])c1 ZINC000843756902 944524141 /nfs/dbraw/zinc/52/41/41/944524141.db2.gz FKLCMSCJQWPBPG-LLVKDONJSA-N 0 0 362.357 3.551 20 5 FHBDRN Cc1ccc(NC(=O)N(C)CCCOCc2ccccc2)cc1[N+](=O)[O-] ZINC000439320728 944526238 /nfs/dbraw/zinc/52/62/38/944526238.db2.gz BYAWQTVJCHXVHG-UHFFFAOYSA-N 0 0 357.410 3.974 20 5 FHBDRN O=C(NCCc1cc2ccccc2s1)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000506545111 944528251 /nfs/dbraw/zinc/52/82/51/944528251.db2.gz AQTTXCILFNPJML-UHFFFAOYSA-N 0 0 366.402 3.658 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(-c2nccs2)cc1 ZINC000017590699 944543881 /nfs/dbraw/zinc/54/38/81/944543881.db2.gz SEDVUKSYRAZHGY-UHFFFAOYSA-N 0 0 355.375 3.979 20 5 FHBDRN CCc1nn(C)c(NCc2ccc(Oc3ccc(F)cc3)nc2)c1[N+](=O)[O-] ZINC000092828886 944549831 /nfs/dbraw/zinc/54/98/31/944549831.db2.gz XMLTXDFRQLJFCC-UHFFFAOYSA-N 0 0 371.372 3.829 20 5 FHBDRN CC(C)(C(=O)N1CCN(C2CC2)c2ccccc21)c1ccc([N+](=O)[O-])cc1 ZINC000426358172 944556228 /nfs/dbraw/zinc/55/62/28/944556228.db2.gz USCBYQYDGVFANE-UHFFFAOYSA-N 0 0 365.433 3.888 20 5 FHBDRN Cc1c(CNc2cc(F)c(N3CCOCC3)cc2F)cccc1[N+](=O)[O-] ZINC000506218636 944559464 /nfs/dbraw/zinc/55/94/64/944559464.db2.gz OCDCMHDVAPFOPK-UHFFFAOYSA-N 0 0 363.364 3.630 20 5 FHBDRN Cn1c2ccccc2nc1[C@@H]1CCCCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000517751636 944563613 /nfs/dbraw/zinc/56/36/13/944563613.db2.gz WHJWUJVRPCXSKB-AWEZNQCLSA-N 0 0 370.434 3.910 20 5 FHBDRN CSc1cc2c(cc1NC(=O)c1cc(C)cc([N+](=O)[O-])c1)OCCO2 ZINC000505873664 944568035 /nfs/dbraw/zinc/56/80/35/944568035.db2.gz ZODKDUWTGHJEBH-UHFFFAOYSA-N 0 0 360.391 3.649 20 5 FHBDRN C[C@H](CNc1ccccc1)NC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000438393046 944573459 /nfs/dbraw/zinc/57/34/59/944573459.db2.gz IGCXSGUVOXQUCE-LLVKDONJSA-N 0 0 367.327 3.844 20 5 FHBDRN CSCc1cccc(CNC(=O)CCNc2ccccc2[N+](=O)[O-])c1 ZINC000438396785 944575241 /nfs/dbraw/zinc/57/52/41/944575241.db2.gz UTUIYAOWRRRFSW-UHFFFAOYSA-N 0 0 359.451 3.576 20 5 FHBDRN Cc1c2ccccc2oc1[C@H](C)NS(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1 ZINC000517769086 944576916 /nfs/dbraw/zinc/57/69/16/944576916.db2.gz BUNLAEXORSNVAX-ZDUSSCGKSA-N 0 0 374.418 3.997 20 5 FHBDRN Cc1ccccc1-c1nc(COC(=O)c2ccc(Cl)cc2[N+](=O)[O-])no1 ZINC000162706039 944577405 /nfs/dbraw/zinc/57/74/05/944577405.db2.gz YMLNPTLMKRHOMT-UHFFFAOYSA-N 0 0 373.752 3.964 20 5 FHBDRN O=[N+]([O-])c1ccccc1/C=C\CN1CCC[C@H](Oc2ncccc2F)C1 ZINC000425999923 944577743 /nfs/dbraw/zinc/57/77/43/944577743.db2.gz QPSDDDHOXVKAEB-OUOZUETKSA-N 0 0 357.385 3.686 20 5 FHBDRN Cc1cccc2c1CC[C@H]2Nc1c([N+](=O)[O-])cc(CO)c(C)c1[N+](=O)[O-] ZINC000729471278 944579270 /nfs/dbraw/zinc/57/92/70/944579270.db2.gz UQQXLCJQHSGSOC-OAHLLOKOSA-N 0 0 357.366 3.712 20 5 FHBDRN Cc1c(F)ccc([N+](=O)[O-])c1C(=O)NCc1ccc(NC(=O)C(C)C)cc1 ZINC000843759065 944581550 /nfs/dbraw/zinc/58/15/50/944581550.db2.gz FVQIBRXOLBRJCZ-UHFFFAOYSA-N 0 0 373.384 3.567 20 5 FHBDRN COc1ccc2cc(NC(=O)[C@@H](C)c3cccc([N+](=O)[O-])c3)ccc2n1 ZINC000518664144 944587018 /nfs/dbraw/zinc/58/70/18/944587018.db2.gz APAUSSLFWDJWAX-LBPRGKRZSA-N 0 0 351.362 3.894 20 5 FHBDRN O=[N+]([O-])c1ccc(S(=O)(=O)NC2CCC(c3ccccc3)CC2)cc1 ZINC000506223565 944588228 /nfs/dbraw/zinc/58/82/28/944588228.db2.gz MEOPSSJBXZMMHD-UHFFFAOYSA-N 0 0 360.435 3.600 20 5 FHBDRN Cc1cc(Cl)ccc1NC(=O)COc1c(Cl)cncc1[N+](=O)[O-] ZINC000506567337 944588467 /nfs/dbraw/zinc/58/84/67/944588467.db2.gz DVFJSKBHFLIRKM-UHFFFAOYSA-N 0 0 356.165 3.623 20 5 FHBDRN O=[N+]([O-])c1ccc(O[C@H]2CCCC[C@@H]2F)c(I)c1 ZINC001226037752 944589029 /nfs/dbraw/zinc/58/90/29/944589029.db2.gz ZGUDSKHBSFSUDP-ONGXEEELSA-N 0 0 365.142 3.859 20 5 FHBDRN O=C1CCc2cc([N+](=O)[O-])c(NCc3cc(-c4ccccc4)no3)cc2N1 ZINC000506856970 944591132 /nfs/dbraw/zinc/59/11/32/944591132.db2.gz NPMXMIAMBQIYKD-UHFFFAOYSA-N 0 0 364.361 3.747 20 5 FHBDRN CC(C)Oc1ccccc1C(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000516211912 944592228 /nfs/dbraw/zinc/59/22/28/944592228.db2.gz ILWCPBPSPJCHGD-UHFFFAOYSA-N 0 0 367.405 3.836 20 5 FHBDRN CN(C(=O)c1ccc(Sc2ccccn2)cc1)c1ccc([N+](=O)[O-])nc1 ZINC000516211418 944592857 /nfs/dbraw/zinc/59/28/57/944592857.db2.gz VKBFXOQPYWFWAH-UHFFFAOYSA-N 0 0 366.402 3.813 20 5 FHBDRN CC(=O)c1ccc(OCC(=O)c2ccc3c(c2)CCCC3)c([N+](=O)[O-])c1 ZINC000120695731 944600280 /nfs/dbraw/zinc/60/02/80/944600280.db2.gz RXMYOSWXGDGFPN-UHFFFAOYSA-N 0 0 353.374 3.938 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)Nc1cccnc1C(F)(F)F ZINC000517779711 944602591 /nfs/dbraw/zinc/60/25/91/944602591.db2.gz BBPSEJOUUHQVDL-UHFFFAOYSA-N 0 0 364.283 3.602 20 5 FHBDRN CC(C)c1ccc(C(=O)NC[C@@H]2CCN(c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000439415066 944605276 /nfs/dbraw/zinc/60/52/76/944605276.db2.gz BYXXDFKPDCKNHS-INIZCTEOSA-N 0 0 367.449 3.975 20 5 FHBDRN COc1cc(Cc2noc(-c3ccc(C)c(C)c3)n2)c([N+](=O)[O-])c(OC)c1 ZINC000516239262 944608624 /nfs/dbraw/zinc/60/86/24/944608624.db2.gz FYYRDGFPEAKVEP-UHFFFAOYSA-N 0 0 369.377 3.870 20 5 FHBDRN CC[C@@]1(CNC(=O)c2cccc(C)c2[N+](=O)[O-])OCCc2ccccc21 ZINC000517790622 944612863 /nfs/dbraw/zinc/61/28/63/944612863.db2.gz XPLYSRFQHGUMDE-FQEVSTJZSA-N 0 0 354.406 3.511 20 5 FHBDRN O=C(Cc1cccc([N+](=O)[O-])c1)NC[C@H](Cc1ccccc1)C(F)(F)F ZINC000517790544 944613051 /nfs/dbraw/zinc/61/30/51/944613051.db2.gz VFQWEUXWLPGMDD-HNNXBMFYSA-N 0 0 366.339 3.675 20 5 FHBDRN CN(C(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)c1nncs1 ZINC000184342496 944630107 /nfs/dbraw/zinc/63/01/07/944630107.db2.gz CUTGCJCAMCCGRS-UHFFFAOYSA-N 0 0 356.363 3.515 20 5 FHBDRN CC(C)N(C)c1ccccc1CNC(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000438463288 944644210 /nfs/dbraw/zinc/64/42/10/944644210.db2.gz CGZMZRJIBCSRFS-UHFFFAOYSA-N 0 0 373.478 3.848 20 5 FHBDRN C[C@H](NC(=O)c1cc(Br)ccc1O)c1cccc([N+](=O)[O-])c1 ZINC000436795490 944648444 /nfs/dbraw/zinc/64/84/44/944648444.db2.gz FVLZIVDYSWEWHH-VIFPVBQESA-N 0 0 365.183 3.554 20 5 FHBDRN CCNC(=O)c1ccc(Cl)cc1NCc1c(F)cc([N+](=O)[O-])cc1F ZINC000506246576 944663039 /nfs/dbraw/zinc/66/30/39/944663039.db2.gz QCPWGPHIOAXWKL-UHFFFAOYSA-N 0 0 369.755 3.888 20 5 FHBDRN CC(C)CNC(=O)c1ccccc1NCc1c(F)cc([N+](=O)[O-])cc1F ZINC000506248271 944669263 /nfs/dbraw/zinc/66/92/63/944669263.db2.gz WLBSGBCBVUJXCE-UHFFFAOYSA-N 0 0 363.364 3.871 20 5 FHBDRN O=C(CNC(=O)c1cc2ccccc2c2cccnc12)Nc1cccc(F)c1 ZINC000050359687 944675104 /nfs/dbraw/zinc/67/51/04/944675104.db2.gz XNVNQNMPEFMUDD-UHFFFAOYSA-N 0 0 373.387 3.896 20 5 FHBDRN COc1cc(-c2noc(Cc3ccc([N+](=O)[O-])cc3Cl)n2)ccc1O ZINC000436820998 944689571 /nfs/dbraw/zinc/68/95/71/944689571.db2.gz JPVNTKGJCJLXHN-UHFFFAOYSA-N 0 0 361.741 3.603 20 5 FHBDRN O=C([O-])[C@H](Cc1ccccc1)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000426679852 944693486 /nfs/dbraw/zinc/69/34/86/944693486.db2.gz YGAIJNGVYCXAFJ-SFHVURJKSA-N 0 0 366.373 3.640 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])NCCCn1ccc2ccccc21 ZINC000516319789 944699687 /nfs/dbraw/zinc/69/96/87/944699687.db2.gz CEMRDINDSCILEY-UHFFFAOYSA-N 0 0 367.405 3.525 20 5 FHBDRN C[C@H](CCOc1ccccc1)c1nc(-c2ccc(N)c([N+](=O)[O-])c2)no1 ZINC000545550695 944700113 /nfs/dbraw/zinc/70/01/13/944700113.db2.gz WEYCZQDFNCSBFT-GFCCVEGCSA-N 0 0 354.366 3.800 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)CCOc1ccc(F)cc1Cl ZINC000044490285 944700915 /nfs/dbraw/zinc/70/09/15/944700915.db2.gz SFQISIBPEDKTCD-UHFFFAOYSA-N 0 0 366.776 3.815 20 5 FHBDRN Cc1ccc(C[NH2+]C[C@H](Cc2ccccc2Cl)C(=O)[O-])cc1[N+](=O)[O-] ZINC000426702167 944701703 /nfs/dbraw/zinc/70/17/03/944701703.db2.gz FHAQLILUINEMTQ-HNNXBMFYSA-N 0 0 362.813 3.590 20 5 FHBDRN Cc1ccc(C[NH2+]C[C@H](Cc2cccc(Cl)c2)C(=O)[O-])cc1[N+](=O)[O-] ZINC000426703502 944705267 /nfs/dbraw/zinc/70/52/67/944705267.db2.gz GJDJOYSBKVRUFV-HNNXBMFYSA-N 0 0 362.813 3.590 20 5 FHBDRN COc1ccc(CC(=O)N[C@H](c2ccccc2)C2CCC2)cc1[N+](=O)[O-] ZINC000517843510 944707104 /nfs/dbraw/zinc/70/71/04/944707104.db2.gz VFFFXNWTMNQLNR-HXUWFJFHSA-N 0 0 354.406 3.804 20 5 FHBDRN COc1cc(Br)c(/C=C\c2ccc([N+](=O)[O-])cn2)cc1O ZINC000439525812 944709800 /nfs/dbraw/zinc/70/98/00/944709800.db2.gz NJJPNLLMJVPOIL-IHWYPQMZSA-N 0 0 351.156 3.637 20 5 FHBDRN COc1ccc(CCc2nc(-c3ccc(N)c([N+](=O)[O-])c3)no2)cc1Cl ZINC000545552441 944713687 /nfs/dbraw/zinc/71/36/87/944713687.db2.gz GWQZUFJGEFTXNN-UHFFFAOYSA-N 0 0 374.784 3.674 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])NC[C@@H]1CCC[C@H](C(F)(F)F)C1 ZINC000438506190 944715825 /nfs/dbraw/zinc/71/58/25/944715825.db2.gz FQKAGGRAGXICIG-OLZOCXBDSA-N 0 0 374.359 3.849 20 5 FHBDRN Cc1cccc2c1CN([C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)CC2 ZINC000429577576 944716355 /nfs/dbraw/zinc/71/63/55/944716355.db2.gz KDHBJEIPYBPCPV-CYBMUJFWSA-N 0 0 373.840 3.942 20 5 FHBDRN CCn1c(C)nc([N+](=O)[O-])c1N[C@@H]1CC[C@H](c2ccccc2)C[C@H]1OC ZINC000516337410 944738760 /nfs/dbraw/zinc/73/87/60/944738760.db2.gz JIXFRSPYMNSSCA-GVDBMIGSSA-N 0 0 358.442 3.883 20 5 FHBDRN Cc1ccccc1OCCCN(C)CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000053720385 944746431 /nfs/dbraw/zinc/74/64/31/944746431.db2.gz GXZZXDNPGCOKHA-UHFFFAOYSA-N 0 0 371.437 3.551 20 5 FHBDRN C[C@@H](Nc1cc(-c2nn[nH]n2)c2cc([N+](=O)[O-])ccc2n1)c1cccs1 ZINC000736139444 944749422 /nfs/dbraw/zinc/74/94/22/944749422.db2.gz QQVVQTHERPPFDW-SECBINFHSA-N 0 0 367.394 3.558 20 5 FHBDRN CC[C@@H]1CCC[C@H](C[NH2+][C@H](Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C(=O)[O-])C1 ZINC000426739408 944752156 /nfs/dbraw/zinc/75/21/56/944752156.db2.gz CBXMPGWDXSOLRM-BIENJYKASA-N 0 0 373.453 3.878 20 5 FHBDRN C/C=C\c1ccc(NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2CC)cc1 ZINC000566767437 944755772 /nfs/dbraw/zinc/75/57/72/944755772.db2.gz HLZKXSBCGLXDLY-HYXAFXHYSA-N 0 0 353.378 3.768 20 5 FHBDRN O=c1c2cc(Cl)cc(Cl)c2ncn1Cc1csc([N+](=O)[O-])c1 ZINC000047171524 944756068 /nfs/dbraw/zinc/75/60/68/944756068.db2.gz MYKSZIFPBOVFJU-UHFFFAOYSA-N 0 0 356.190 3.721 20 5 FHBDRN CC[C@@H]1CCCC[C@H]1NC(=O)CSCc1ccc(OC)c([N+](=O)[O-])c1 ZINC000027705661 944771968 /nfs/dbraw/zinc/77/19/68/944771968.db2.gz BQMGSNLBYLXHOW-HUUCEWRRSA-N 0 0 366.483 3.922 20 5 FHBDRN O=C1[C@@H](Oc2ccc(F)c(Cl)c2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000518791487 944773095 /nfs/dbraw/zinc/77/30/95/944773095.db2.gz WPFGGWUUTSMGOX-HNNXBMFYSA-N 0 0 350.733 3.572 20 5 FHBDRN CN(CCOc1cccc(Cl)c1)C(=O)c1cc(F)cc([N+](=O)[O-])c1 ZINC000518791872 944776026 /nfs/dbraw/zinc/77/60/26/944776026.db2.gz HMWSUVFPLMCXPL-UHFFFAOYSA-N 0 0 352.749 3.538 20 5 FHBDRN O=[N+]([O-])c1ccc(NCc2ccc(Br)cc2[N+](=O)[O-])cc1 ZINC000162762157 944790019 /nfs/dbraw/zinc/79/00/19/944790019.db2.gz ABEACYCARWWDFB-UHFFFAOYSA-N 0 0 352.144 3.878 20 5 FHBDRN Cc1cnc(NC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])c(Br)c1 ZINC000162763657 944791205 /nfs/dbraw/zinc/79/12/05/944791205.db2.gz VBXJZNRRVOOLKT-UHFFFAOYSA-N 0 0 372.125 3.591 20 5 FHBDRN Cc1ccc(C(=O)COC(=O)CSc2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000004219404 944795300 /nfs/dbraw/zinc/79/53/00/944795300.db2.gz NSDXQONSXHGVEQ-UHFFFAOYSA-N 0 0 359.403 3.730 20 5 FHBDRN COc1cc(C)cc(-c2nc(Cc3cccc([N+](=O)[O-])c3C)no2)c1O ZINC000436942867 944831033 /nfs/dbraw/zinc/83/10/33/944831033.db2.gz IJRKANJQDNBKBR-UHFFFAOYSA-N 0 0 355.350 3.567 20 5 FHBDRN CC(C)(NC(=O)Nc1cccc2c1OCCC2=O)c1ccc([N+](=O)[O-])cc1 ZINC000506988666 944837169 /nfs/dbraw/zinc/83/71/69/944837169.db2.gz UNYXAXQJGLXQNF-UHFFFAOYSA-N 0 0 369.377 3.617 20 5 FHBDRN CCSc1cccc(F)c1NS(=O)(=O)Cc1ccccc1[N+](=O)[O-] ZINC000518850700 944843874 /nfs/dbraw/zinc/84/38/74/944843874.db2.gz UGKIBDWQDKTSSC-UHFFFAOYSA-N 0 0 370.427 3.788 20 5 FHBDRN O=C([O-])[C@@H](Cc1ccco1)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000426826044 944850033 /nfs/dbraw/zinc/85/00/33/944850033.db2.gz SHWKKEZIMBYGRX-OAHLLOKOSA-N 0 0 372.402 3.702 20 5 FHBDRN COc1ccc(CCNc2cc(C(F)(F)F)ncc2[N+](=O)[O-])cc1F ZINC000436404286 944851655 /nfs/dbraw/zinc/85/16/55/944851655.db2.gz LJDQBXDOQXBKBE-UHFFFAOYSA-N 0 0 359.279 3.811 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1)N(Cc1ccccc1)C[C@H]1CCCO1 ZINC000053748841 944853309 /nfs/dbraw/zinc/85/33/09/944853309.db2.gz HZNOXMPGASYDTF-GOSISDBHSA-N 0 0 355.394 3.808 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H](C)N(Cc3ccccc3)C[C@@H]2C)c1 ZINC000500424132 944856421 /nfs/dbraw/zinc/85/64/21/944856421.db2.gz MIXSDCMVRMXSQM-SJORKVTESA-N 0 0 367.449 3.638 20 5 FHBDRN COC(=O)[C@H](C)Cc1ccc(NCc2c(F)cc([N+](=O)[O-])cc2F)cc1 ZINC000506297993 944858688 /nfs/dbraw/zinc/85/86/88/944858688.db2.gz NSKPCRKERXEEEV-LLVKDONJSA-N 0 0 364.348 3.837 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H](C)c1cccc(OC(C)C)c1 ZINC000426851679 944861861 /nfs/dbraw/zinc/86/18/61/944861861.db2.gz SEAXPKXWMLMBBV-ZDUSSCGKSA-N 0 0 358.394 3.882 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H](C)c1ccc(OC(C)C)cc1 ZINC000426844784 944862996 /nfs/dbraw/zinc/86/29/96/944862996.db2.gz FXUCUVRFTKBDOA-ZDUSSCGKSA-N 0 0 358.394 3.882 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)NC[C@@H]1C[C@H]1c1cccc(OC)c1 ZINC000414007259 944863257 /nfs/dbraw/zinc/86/32/57/944863257.db2.gz IEFLMIUUELJZJU-HOCLYGCPSA-N 0 0 370.405 3.536 20 5 FHBDRN CCCc1n[nH]c(C(=O)N[C@H](C)c2ccc(SCC)cc2)c1[N+](=O)[O-] ZINC000518852065 944864647 /nfs/dbraw/zinc/86/46/47/944864647.db2.gz NYIVGZVZIISHJC-LLVKDONJSA-N 0 0 362.455 3.873 20 5 FHBDRN CCN(C(=O)C(=O)Nc1ccc(C)c([N+](=O)[O-])c1)[C@@H](C)c1ccc(F)cc1 ZINC000516443332 944864985 /nfs/dbraw/zinc/86/49/85/944864985.db2.gz VCYPNAUCBJTGGT-ZDUSSCGKSA-N 0 0 373.384 3.591 20 5 FHBDRN CC(=O)c1ccc(NCCc2ccn(-c3ccccc3)n2)c([N+](=O)[O-])c1 ZINC000507016261 944865704 /nfs/dbraw/zinc/86/57/04/944865704.db2.gz XCUAEINVAUJUNN-UHFFFAOYSA-N 0 0 350.378 3.638 20 5 FHBDRN O=[N+]([O-])c1cc(-c2nc(-c3ccc(Cl)cc3)no2)ccc1-n1cncn1 ZINC000518857580 944871160 /nfs/dbraw/zinc/87/11/60/944871160.db2.gz JZMGFQMODZLIHP-UHFFFAOYSA-N 0 0 368.740 3.546 20 5 FHBDRN CCN(C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21)c1ccccc1OC ZINC000500426000 944873839 /nfs/dbraw/zinc/87/38/39/944873839.db2.gz RBODSJVSGKVJCF-UHFFFAOYSA-N 0 0 353.378 3.611 20 5 FHBDRN Cc1c(NC(=O)N2CC[C@H](COc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000506314204 944890096 /nfs/dbraw/zinc/89/00/96/944890096.db2.gz DTIWHYFYQLVISW-HNNXBMFYSA-N 0 0 355.394 3.836 20 5 FHBDRN Cc1ccc(O[C@H](C)CNC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000511664700 944893143 /nfs/dbraw/zinc/89/31/43/944893143.db2.gz MYXJHUOYNGXQGM-MRXNPFEDSA-N 0 0 371.437 3.555 20 5 FHBDRN CC(C)Cn1c(-c2ccc([N+](=O)[O-])cc2)nnc1N(C)C[C@H]1CCCCO1 ZINC000517969593 944893221 /nfs/dbraw/zinc/89/32/21/944893221.db2.gz VLYUXFBCCYMKML-QGZVFWFLSA-N 0 0 373.457 3.515 20 5 FHBDRN CC(C)C[C@H](C)n1nccc1NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000426878014 944898414 /nfs/dbraw/zinc/89/84/14/944898414.db2.gz BVQLWSYZQWRXHS-NSHDSACASA-N 0 0 356.386 3.527 20 5 FHBDRN CCOC(=O)c1cc(C(=O)N2CCCC3(CCCC3)C2)cc([N+](=O)[O-])c1 ZINC000438670413 944901104 /nfs/dbraw/zinc/90/11/04/944901104.db2.gz CPPMSSJBIOJCEH-UHFFFAOYSA-N 0 0 360.410 3.568 20 5 FHBDRN Cc1ccc(S(=O)(=O)N(Cc2ccc(F)cc2)C(C)C)cc1[N+](=O)[O-] ZINC000507070051 944912016 /nfs/dbraw/zinc/91/20/16/944912016.db2.gz HVZDFMHECDSULC-UHFFFAOYSA-N 0 0 366.414 3.642 20 5 FHBDRN Cc1ccc(NC(=O)NC[C@H]2CCO[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000432002672 944917283 /nfs/dbraw/zinc/91/72/83/944917283.db2.gz XBALYYRCFAJAQQ-CRAIPNDOSA-N 0 0 355.394 3.803 20 5 FHBDRN CC(C)(C(=O)NCc1cc(-c2ccccc2)no1)c1ccccc1[N+](=O)[O-] ZINC000432013123 944926009 /nfs/dbraw/zinc/92/60/09/944926009.db2.gz KKYAGMSDSZYDFF-UHFFFAOYSA-N 0 0 365.389 3.844 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(Cc1ccc(F)cc1)C(C)C ZINC000507064649 944926536 /nfs/dbraw/zinc/92/65/36/944926536.db2.gz MXRNUMUOZZQWRO-UHFFFAOYSA-N 0 0 366.414 3.642 20 5 FHBDRN O=C(c1ccn(-c2ccccc2[N+](=O)[O-])n1)N1CCCC2(CCCC2)C1 ZINC000438688166 944927012 /nfs/dbraw/zinc/92/70/12/944927012.db2.gz UXWPPMQLMFWHOJ-UHFFFAOYSA-N 0 0 354.410 3.577 20 5 FHBDRN CC[C@@H](C)c1nnc(N(C)Cc2ccccc2[N+](=O)[O-])n1C[C@@H]1CCCO1 ZINC000549508529 944931903 /nfs/dbraw/zinc/93/19/03/944931903.db2.gz OMPWNAMYLAYAKO-ZBFHGGJFSA-N 0 0 373.457 3.515 20 5 FHBDRN Cc1ccccc1[C@@]1(F)CCN(C(=O)NCc2ccccc2[N+](=O)[O-])C1 ZINC000507083388 944940112 /nfs/dbraw/zinc/94/01/12/944940112.db2.gz DQONSKILJMFGBW-LJQANCHMSA-N 0 0 357.385 3.684 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccc(C(F)(F)F)c(OC)c1 ZINC000426923625 944943705 /nfs/dbraw/zinc/94/37/05/944943705.db2.gz LBWLTKXFNDOBLK-UHFFFAOYSA-N 0 0 370.283 3.883 20 5 FHBDRN CN(CCCCNC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000054167454 944947282 /nfs/dbraw/zinc/94/72/82/944947282.db2.gz SVSCXJRYMCLTMB-UHFFFAOYSA-N 0 0 361.829 3.895 20 5 FHBDRN CCCN(C(=O)c1cccs1)C1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000432049818 944953059 /nfs/dbraw/zinc/95/30/59/944953059.db2.gz ODUUQKDIQDNKDV-UHFFFAOYSA-N 0 0 374.466 3.573 20 5 FHBDRN CN(C[C@@H]1OCCc2ccccc21)C(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000506336487 944959253 /nfs/dbraw/zinc/95/92/53/944959253.db2.gz AJCRUVJTLSBUCD-KRWDZBQOSA-N 0 0 360.797 3.634 20 5 FHBDRN COc1ccc(C(=O)C2CCN(Cc3csc([N+](=O)[O-])c3)CC2)cc1 ZINC000054173384 944970042 /nfs/dbraw/zinc/97/00/42/944970042.db2.gz HNEJMOGDEFJSRR-UHFFFAOYSA-N 0 0 360.435 3.760 20 5 FHBDRN CCOc1cc(NC(=O)NCC2(C3CC3)CC2)c([N+](=O)[O-])cc1OCC ZINC000507124312 944971098 /nfs/dbraw/zinc/97/10/98/944971098.db2.gz BXAOAMFTOLZYEN-UHFFFAOYSA-N 0 0 363.414 3.704 20 5 FHBDRN COc1ccccc1[C@H](NC(=O)c1cc(F)cc([N+](=O)[O-])c1)c1ccco1 ZINC000426985419 944978746 /nfs/dbraw/zinc/97/87/46/944978746.db2.gz WYEPGJVEFCUUCP-SFHVURJKSA-N 0 0 370.336 3.855 20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])N[C@@H](C1CCCC1)C(F)(F)F ZINC000437955413 944982274 /nfs/dbraw/zinc/98/22/74/944982274.db2.gz PXHSWRVBFFHIHL-HNNXBMFYSA-N 0 0 359.348 3.634 20 5 FHBDRN COc1ccccc1Oc1ccc(CNC(=O)c2cc([N+](=O)[O-])c[nH]2)cc1 ZINC000518964390 944982399 /nfs/dbraw/zinc/98/23/99/944982399.db2.gz PYRQDFXUNJYWSG-UHFFFAOYSA-N 0 0 367.361 3.654 20 5 FHBDRN CCOc1ccc(NC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)cc1OC ZINC000507146670 944982846 /nfs/dbraw/zinc/98/28/46/944982846.db2.gz WTQQXAYVGDRGDF-UHFFFAOYSA-N 0 0 355.350 3.736 20 5 FHBDRN C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)NCCC(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000437066521 944986720 /nfs/dbraw/zinc/98/67/20/944986720.db2.gz SUHXWVFOLGVUAB-TXEJJXNPSA-N 0 0 373.375 3.759 20 5 FHBDRN COc1cc(-c2nc(-c3ccc(F)c(F)c3)no2)cc([N+](=O)[O-])c1OC ZINC000438747535 944988226 /nfs/dbraw/zinc/98/82/26/944988226.db2.gz ZJNPPYHIXWVMAK-UHFFFAOYSA-N 0 0 363.276 3.607 20 5 FHBDRN CCc1c(NC(=O)c2c[nH]c3cccc([N+](=O)[O-])c32)onc1C(F)(F)F ZINC000505957984 944993360 /nfs/dbraw/zinc/99/33/60/944993360.db2.gz AHLWHIDNWHWNEZ-UHFFFAOYSA-N 0 0 368.271 3.898 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)N2CC[C@H](C)[C@@H]3CCCC[C@H]32)cc1C ZINC000516550225 944996746 /nfs/dbraw/zinc/99/67/46/944996746.db2.gz IZXRXBOZOQYOJI-VBNZEHGJSA-N 0 0 366.483 3.801 20 5 FHBDRN CCCN(c1ccc(Cl)cc1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1F ZINC000518975909 944998805 /nfs/dbraw/zinc/99/88/05/944998805.db2.gz PTXDUYJXDKTYSF-UHFFFAOYSA-N 0 0 372.805 3.993 20 5 FHBDRN O=C(Nc1ccc2c[nH]nc2c1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000051342488 945003100 /nfs/dbraw/zinc/00/31/00/945003100.db2.gz MJBUUQKEHZUDQA-UHFFFAOYSA-N 0 0 365.374 3.847 20 5 FHBDRN COc1ccc(C(=O)N[C@H](C2CCCCC2)C(F)(F)F)cc1[N+](=O)[O-] ZINC000439832254 945011702 /nfs/dbraw/zinc/01/17/02/945011702.db2.gz XJDRGSAKXKPFDH-CQSZACIVSA-N 0 0 360.332 3.844 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N1CCN(c2ccc(Cl)cc2)CC1 ZINC000511756030 945017958 /nfs/dbraw/zinc/01/79/58/945017958.db2.gz RPFAEWICJBXLHJ-UHFFFAOYSA-N 0 0 359.813 3.519 20 5 FHBDRN COc1ccc(C[C@@H](C)CN(C)C(=O)c2ccc([N+](=O)[O-])cc2OC)cc1 ZINC000427021629 945021054 /nfs/dbraw/zinc/02/10/54/945021054.db2.gz UOYRYHAZHGKENY-CQSZACIVSA-N 0 0 372.421 3.563 20 5 FHBDRN CCOc1cccc([C@@H]2C[C@H]2NC(=O)N(C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000437845424 945022738 /nfs/dbraw/zinc/02/27/38/945022738.db2.gz RYBNFTKDOMGUAT-ZWKOTPCHSA-N 0 0 369.421 3.691 20 5 FHBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)N1CC[C@@H](c2cccc(Cl)c2)C1 ZINC000432082152 945024071 /nfs/dbraw/zinc/02/40/71/945024071.db2.gz SPAXAUBQESXJQX-MRXNPFEDSA-N 0 0 373.840 3.990 20 5 FHBDRN CCNc1ccc(C(=O)NCCc2ccc(SC)cc2)cc1[N+](=O)[O-] ZINC000438801680 945035161 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FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H](C)c1ccc2c(c1)OCO2 ZINC000439888002 945049618 /nfs/dbraw/zinc/04/96/18/945049618.db2.gz JIWHPVDAADGCNY-NSHDSACASA-N 0 0 373.365 3.605 20 5 FHBDRN O=C(Nc1nc(C2CC2)c[nH]1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000519020724 945049974 /nfs/dbraw/zinc/04/99/74/945049974.db2.gz RCVBYTCNJJMKFM-UHFFFAOYSA-N 0 0 355.379 3.571 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])N1CC[C@H](c2cccc(Cl)c2)C1 ZINC000432090420 945051108 /nfs/dbraw/zinc/05/11/08/945051108.db2.gz RNMRVFZASDXFJA-HNNXBMFYSA-N 0 0 359.813 3.947 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)NCCCNc1ccccc1 ZINC000439876508 945056223 /nfs/dbraw/zinc/05/62/23/945056223.db2.gz HMBLYXQSTAPVFR-UHFFFAOYSA-N 0 0 358.398 3.617 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N(C)Cc1ccc(F)c(F)c1 ZINC000439879272 945056586 /nfs/dbraw/zinc/05/65/86/945056586.db2.gz GLTKOEDGDINEKO-UHFFFAOYSA-N 0 0 365.336 3.936 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H](COC)c1ccccc1 ZINC000439878466 945057334 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FHBDRN O=[N+]([O-])c1ccc(OC[C@@H](O)Cc2ccccc2C(F)(F)F)c(F)c1 ZINC000153914917 945405364 /nfs/dbraw/zinc/40/53/64/945405364.db2.gz LZYPDMGDPKZLLO-LBPRGKRZSA-N 0 0 359.275 3.735 20 5 FHBDRN CCc1ccc(C(=O)N[C@@H](c2nccs2)C(F)(F)F)cc1[N+](=O)[O-] ZINC000507641094 945408305 /nfs/dbraw/zinc/40/83/05/945408305.db2.gz PBMXQBJEOQIDGV-NSHDSACASA-N 0 0 359.329 3.647 20 5 FHBDRN Cc1ncc([N+](=O)[O-])n1CCN1CCCC[C@H]1c1ccc(F)cc1F ZINC001167772675 945408349 /nfs/dbraw/zinc/40/83/49/945408349.db2.gz WQLSJQONTQPKNC-INIZCTEOSA-N 0 0 350.369 3.605 20 5 FHBDRN CCOc1ccc(C(=O)N(C)Cc2c(F)cccc2F)cc1[N+](=O)[O-] ZINC000511870584 945414512 /nfs/dbraw/zinc/41/45/12/945414512.db2.gz AULZWWSJRMHQRB-UHFFFAOYSA-N 0 0 350.321 3.544 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(F)cc1OC(F)F ZINC000427487261 945415728 /nfs/dbraw/zinc/41/57/28/945415728.db2.gz OEJXDXOMXZVVCT-UHFFFAOYSA-N 0 0 356.256 3.596 20 5 FHBDRN CC(C)(NC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)c1nccs1 ZINC000151377467 945431652 /nfs/dbraw/zinc/43/16/52/945431652.db2.gz IDIBRVOVJVHHQZ-UHFFFAOYSA-N 0 0 359.329 3.735 20 5 FHBDRN COc1cc(F)c(NC(=O)CSc2ccccc2[N+](=O)[O-])cc1F ZINC000124983220 945435175 /nfs/dbraw/zinc/43/51/75/945435175.db2.gz FAMCXAZJJCXYDK-UHFFFAOYSA-N 0 0 354.334 3.612 20 5 FHBDRN CN(Cc1ccc(OC(F)F)cc1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000018173168 945444622 /nfs/dbraw/zinc/44/46/22/945444622.db2.gz QKPKKZIKRVEFHK-UHFFFAOYSA-N 0 0 351.309 3.860 20 5 FHBDRN O=C(CC[S@@](=O)Cc1cccc(Cl)c1)Nc1ccccc1[N+](=O)[O-] ZINC000507691641 945453860 /nfs/dbraw/zinc/45/38/60/945453860.db2.gz DZBGKFINYAZWTL-XMMPIXPASA-N 0 0 366.826 3.526 20 5 FHBDRN COc1ccc(C)cc1[C@H](C)NC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000087023238 945457601 /nfs/dbraw/zinc/45/76/01/945457601.db2.gz UOCZEHFUGBEJOF-AWEZNQCLSA-N 0 0 369.421 3.741 20 5 FHBDRN CC(C)(C(=O)Nc1ccc2cc([N+](=O)[O-])ccc2n1)c1cccc(F)c1 ZINC000426648123 945460568 /nfs/dbraw/zinc/46/05/68/945460568.db2.gz RNVSCZFFCVACFK-UHFFFAOYSA-N 0 0 353.353 3.620 20 5 FHBDRN CCc1cccc(CC(=O)Nc2ccnn2-c2ccc([N+](=O)[O-])cc2)c1 ZINC000507710693 945483425 /nfs/dbraw/zinc/48/34/25/945483425.db2.gz QXCLFQACXUDWFO-UHFFFAOYSA-N 0 0 350.378 3.524 20 5 FHBDRN C[C@H](c1ccccc1)[C@H](C)NC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000125024143 945486911 /nfs/dbraw/zinc/48/69/11/945486911.db2.gz PXHGCDDSGWJTPR-GJZGRUSLSA-N 0 0 353.422 3.855 20 5 FHBDRN COc1cc(Cl)c(C)cc1NC(=O)[C@@H](C)Oc1ccc([N+](=O)[O-])cc1 ZINC000015330802 945490219 /nfs/dbraw/zinc/49/02/19/945490219.db2.gz MBFXOMMPMAOZHU-LLVKDONJSA-N 0 0 364.785 3.971 20 5 FHBDRN Cc1cc(C(=O)Nc2ccc([N+](=O)[O-])c3ncccc23)nn1-c1ccccc1 ZINC000184392103 945492486 /nfs/dbraw/zinc/49/24/86/945492486.db2.gz LTEOEFGANMHTRO-UHFFFAOYSA-N 0 0 373.372 3.889 20 5 FHBDRN Cc1cc([N+](=O)[O-])cnc1Oc1cccc(I)c1 ZINC000052812148 945497122 /nfs/dbraw/zinc/49/71/22/945497122.db2.gz QYGDWFPJOBHUQQ-UHFFFAOYSA-N 0 0 356.119 3.695 20 5 FHBDRN CC[C@H](C)COc1cc([N+](=O)[O-])c(CN2CCC[C@H]2CF)cc1OC ZINC000550032318 945497694 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FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(C(F)(F)F)nc1C ZINC000281246655 945574680 /nfs/dbraw/zinc/57/46/80/945574680.db2.gz FZTPXUNFJREMJW-UHFFFAOYSA-N 0 0 369.299 3.968 20 5 FHBDRN CC[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1)c1nc(C)cs1 ZINC000729449625 945575579 /nfs/dbraw/zinc/57/55/79/945575579.db2.gz YIZYUTYHSFJYTM-HNNXBMFYSA-N 0 0 374.466 3.841 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1OC(=O)c1ccc(N2CCC(C)CC2)nc1 ZINC000760023736 945575797 /nfs/dbraw/zinc/57/57/97/945575797.db2.gz ZQKBGIMCTAMRLJ-UHFFFAOYSA-N 0 0 355.394 3.754 20 5 FHBDRN CCC[C@]1(C)CCCN(C(=O)c2cc([N+](=O)[O-])ccc2SCCO)C1 ZINC000137344604 945585550 /nfs/dbraw/zinc/58/55/50/945585550.db2.gz FOKWOJVSWVITSY-GOSISDBHSA-N 0 0 366.483 3.722 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)[C@@H]1C[C@H]1c1ccc2c(c1)OCCO2 ZINC000129404062 945602341 /nfs/dbraw/zinc/60/23/41/945602341.db2.gz VXQAABNSSVKDGJ-LSDHHAIUSA-N 0 0 368.389 3.725 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)[C@H]1C[C@@H]1c1ccc2c(c1)OCCO2 ZINC000129403866 945602456 /nfs/dbraw/zinc/60/24/56/945602456.db2.gz VXQAABNSSVKDGJ-CABCVRRESA-N 0 0 368.389 3.725 20 5 FHBDRN CCCC1(CNC(=O)c2cc(F)cc([N+](=O)[O-])c2Br)CC1 ZINC000760027429 945610903 /nfs/dbraw/zinc/61/09/03/945610903.db2.gz ZUNRELONEWGHIZ-UHFFFAOYSA-N 0 0 359.195 3.807 20 5 FHBDRN CCC(=O)c1ccc(NC2CCC(O)(c3cccnc3)CC2)c([N+](=O)[O-])c1 ZINC000281418632 945626441 /nfs/dbraw/zinc/62/64/41/945626441.db2.gz ILQFTISDGAMVKF-UHFFFAOYSA-N 0 0 369.421 3.825 20 5 FHBDRN C[C@@H]1CN(C(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)CC(C)(C)C1 ZINC000519676892 945628289 /nfs/dbraw/zinc/62/82/89/945628289.db2.gz HCPUXDRTWFVOTR-ZDUSSCGKSA-N 0 0 358.442 3.696 20 5 FHBDRN COCCOc1ccccc1CNC(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000473632343 945632966 /nfs/dbraw/zinc/63/29/66/945632966.db2.gz ASFAVGZXZAJUKZ-UHFFFAOYSA-N 0 0 372.421 3.673 20 5 FHBDRN CC(C)(C)OC(=O)CCSCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000281432790 945633413 /nfs/dbraw/zinc/63/34/13/945633413.db2.gz JFCDSFNAYDGSOQ-UHFFFAOYSA-N 0 0 365.411 3.610 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1OC(=O)c1ccc(CNC(=O)C(C)(C)C)cc1 ZINC000760023023 945633393 /nfs/dbraw/zinc/63/33/93/945633393.db2.gz RDWBSALQAHUEJH-UHFFFAOYSA-N 0 0 370.405 3.785 20 5 FHBDRN Cc1ccc(CNc2nnc([C@H]3Cc4ccccc4O3)o2)cc1[N+](=O)[O-] ZINC000181749758 945634002 /nfs/dbraw/zinc/63/40/02/945634002.db2.gz QSULKPGVFCLPST-MRXNPFEDSA-N 0 0 352.350 3.575 20 5 FHBDRN Cc1oc(C(C)C)nc1C(=O)Nc1cc(C)nc2ccc([N+](=O)[O-])cc21 ZINC000519667789 945641114 /nfs/dbraw/zinc/64/11/14/945641114.db2.gz MAHMAIKXBDPOTK-UHFFFAOYSA-N 0 0 354.366 3.545 20 5 FHBDRN CCO[C@@H]1C[C@H](NC(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)C12CCCC2 ZINC000248612049 945641632 /nfs/dbraw/zinc/64/16/32/945641632.db2.gz XVCIXQDPUIJGSP-OAUYIBNBSA-N 0 0 364.417 3.691 20 5 FHBDRN CC(C)Oc1ccc(N(C)C(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)cc1 ZINC000519670519 945643237 /nfs/dbraw/zinc/64/32/37/945643237.db2.gz RYMBXBUWFXFCCM-UHFFFAOYSA-N 0 0 364.348 3.866 20 5 FHBDRN COCc1cc(CNC(=O)c2ccc(SC)c([N+](=O)[O-])c2)ccc1F ZINC000107496523 945644839 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945713362 /nfs/dbraw/zinc/71/33/62/945713362.db2.gz WYMGQZFCIOCRDG-UHFFFAOYSA-N 0 0 355.394 3.844 20 5 FHBDRN COC(=O)Cc1ccc(NC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)cc1 ZINC000473652743 945720867 /nfs/dbraw/zinc/72/08/67/945720867.db2.gz QUTAEECAPVUTGY-UHFFFAOYSA-N 0 0 356.378 3.686 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])N[C@H]1CC[C@@H](c2ccc(F)cc2)C1 ZINC000473649902 945725170 /nfs/dbraw/zinc/72/51/70/945725170.db2.gz QYJVTPBYLNJCNV-ZBFHGGJFSA-N 0 0 357.385 3.598 20 5 FHBDRN CN(C)c1ccc([N+](=O)[O-])cc1C(=O)OCc1cc(-c2cccs2)on1 ZINC000018357820 945733324 /nfs/dbraw/zinc/73/33/24/945733324.db2.gz HWFQFBIGINSYLU-UHFFFAOYSA-N 0 0 373.390 3.734 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](Cc1ccc(F)cc1)C(C)C ZINC000444030505 945735271 /nfs/dbraw/zinc/73/52/71/945735271.db2.gz KGYWRGALUTVYKC-KRWDZBQOSA-N 0 0 360.385 3.740 20 5 FHBDRN C[C@@H](NC(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)c1cncs1 ZINC000894477089 945752239 /nfs/dbraw/zinc/75/22/39/945752239.db2.gz MIBGHSZCDMAOHR-MRVPVSSYSA-N 0 0 374.344 3.631 20 5 FHBDRN Cc1cccc2c1CCN([C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C)C2 ZINC000729479572 945755827 /nfs/dbraw/zinc/75/58/27/945755827.db2.gz LMVCEUAWTUTPON-HNNXBMFYSA-N 0 0 353.422 3.597 20 5 FHBDRN CC[C@H](Cc1ccccc1C(F)(F)F)NC(=O)CCC(C)(C)[N+](=O)[O-] ZINC001126476646 945763541 /nfs/dbraw/zinc/76/35/41/945763541.db2.gz DOESRKOMYFWOLQ-CYBMUJFWSA-N 0 0 360.376 3.978 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)N[C@H](C)CNc2ccccc2)cc1[N+](=O)[O-] ZINC000129414426 945773609 /nfs/dbraw/zinc/77/36/09/945773609.db2.gz CCKSZEQNHQMKPP-CABCVRRESA-N 0 0 356.426 3.764 20 5 FHBDRN Cc1c(NC(=O)c2ccc(CSc3nccn3C)o2)cccc1[N+](=O)[O-] ZINC000044648072 945787609 /nfs/dbraw/zinc/78/76/09/945787609.db2.gz GZRCWJFAYISFTF-UHFFFAOYSA-N 0 0 372.406 3.774 20 5 FHBDRN CCn1ccnc1[C@H]1CCCCN1C(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000281685993 945810366 /nfs/dbraw/zinc/81/03/66/945810366.db2.gz GCBHUNMGAOFWCL-MRXNPFEDSA-N 0 0 374.466 3.657 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)Nc1ccc(OC(F)F)cn1 ZINC000519842240 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Cc1ccc(Br)cc1NC(=O)NCc1ccccc1[N+](=O)[O-] ZINC000045622562 946092341 /nfs/dbraw/zinc/09/23/41/946092341.db2.gz LBIGZDCEANUZEA-UHFFFAOYSA-N 0 0 364.199 3.987 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)CCCC(=O)c1ccc(C)cc1 ZINC000184416179 946096849 /nfs/dbraw/zinc/09/68/49/946096849.db2.gz OSEHRLXZMATJIO-UHFFFAOYSA-N 0 0 370.405 3.581 20 5 FHBDRN O=C(N[C@@H]1[C@@H]2Cc3ccccc3[C@@H]21)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000444233042 946097427 /nfs/dbraw/zinc/09/74/27/946097427.db2.gz STBGHKOPXVYDQJ-BVYCBKJFSA-N 0 0 366.420 3.749 20 5 FHBDRN COc1ccc2ccc(OC(=O)COc3ccc([N+](=O)[O-])cc3)cc2c1 ZINC000025727947 946098234 /nfs/dbraw/zinc/09/82/34/946098234.db2.gz DRIRQTSLDSHZJC-UHFFFAOYSA-N 0 0 353.330 3.741 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)c1cnc(-c2ccccn2)s1 ZINC000129444065 946099962 /nfs/dbraw/zinc/09/99/62/946099962.db2.gz NXCVAENYTOUIMT-UHFFFAOYSA-N 0 0 354.391 3.982 20 5 FHBDRN COc1ccc(NC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)c(C)n1 ZINC000444230399 946100935 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C[C@@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000027800231 946121122 /nfs/dbraw/zinc/12/11/22/946121122.db2.gz LKHNBAWKKWZNHI-CYBMUJFWSA-N 0 0 369.421 3.649 20 5 FHBDRN C[C@@H](OC(=O)CCCc1nc(C(C)(C)C)no1)c1ccc([N+](=O)[O-])cc1 ZINC000066877213 946129133 /nfs/dbraw/zinc/12/91/33/946129133.db2.gz LUGPBHCBXOPKRX-GFCCVEGCSA-N 0 0 361.398 3.902 20 5 FHBDRN CCc1n[nH]c(C(=O)N(C2CC2)C2CC(c3ccccc3C)C2)c1[N+](=O)[O-] ZINC000444256451 946133376 /nfs/dbraw/zinc/13/33/76/946133376.db2.gz LQHTWRXTRPDAIL-UHFFFAOYSA-N 0 0 368.437 3.740 20 5 FHBDRN CCc1n[nH]c(C(=O)N2CCC[C@H](C)[C@@H]2c2ccc(C)cc2)c1[N+](=O)[O-] ZINC000444257021 946139789 /nfs/dbraw/zinc/13/97/89/946139789.db2.gz OCJCSSNHWWRGJP-SUMWQHHRSA-N 0 0 356.426 3.802 20 5 FHBDRN CSc1ccc(C(=O)N2CCC[C@H](c3nccs3)C2)cc1[N+](=O)[O-] ZINC000109053572 946141714 /nfs/dbraw/zinc/14/17/14/946141714.db2.gz ZBKOEOYHNJEEJY-LBPRGKRZSA-N 0 0 363.464 3.793 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)N[C@H](Cc1ccccc1)C1CC1 ZINC000522945192 946144315 /nfs/dbraw/zinc/14/43/15/946144315.db2.gz RSUPLKSDBQPBFQ-HXUWFJFHSA-N 0 0 367.449 3.924 20 5 FHBDRN CN(Cc1ccccc1N1CCCC1)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000045778594 946150635 /nfs/dbraw/zinc/15/06/35/946150635.db2.gz NLXBNOVTLLBXHQ-UHFFFAOYSA-N 0 0 354.410 3.859 20 5 FHBDRN CCc1n[nH]c(C(=O)N(Cc2ccccc2)C2CCCCC2)c1[N+](=O)[O-] ZINC000444266943 946151222 /nfs/dbraw/zinc/15/12/22/946151222.db2.gz KCJRSHNVLPONKJ-UHFFFAOYSA-N 0 0 356.426 3.855 20 5 FHBDRN CNc1ccc(C(=O)N2C[C@H](C)C[C@@H]2c2cccc(OC)c2)cc1[N+](=O)[O-] ZINC000544318877 946151505 /nfs/dbraw/zinc/15/15/05/946151505.db2.gz KXUFIPXMRFDMAM-FZKQIMNGSA-N 0 0 369.421 3.868 20 5 FHBDRN C[C@@H](OC(=O)/C=C/Sc1ccccc1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000018803693 946155385 /nfs/dbraw/zinc/15/53/85/946155385.db2.gz PCJIMNJXWGRGNL-OCHBPSSRSA-N 0 0 372.402 3.771 20 5 FHBDRN C[C@H](OC(=O)c1ccc(Cl)cc1F)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000018808169 946155504 /nfs/dbraw/zinc/15/55/04/946155504.db2.gz WYIPCUISUUPEPL-VIFPVBQESA-N 0 0 366.732 3.571 20 5 FHBDRN CCCc1cc(NC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)n(C)n1 ZINC000444283436 946161349 /nfs/dbraw/zinc/16/13/49/946161349.db2.gz DRDOJWUMLMTMJA-UHFFFAOYSA-N 0 0 360.417 3.620 20 5 FHBDRN CC(C)[C@@H]1CCN1C(=O)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12 ZINC000444290801 946169939 /nfs/dbraw/zinc/16/99/39/946169939.db2.gz PCNIJMQWACVIBT-KRWDZBQOSA-N 0 0 356.372 3.830 20 5 FHBDRN C[C@@]1(F)CCN(C(=O)c2cc(F)cc3c(=O)c4cc(F)ccc4[nH]c23)C1 ZINC000444294829 946182023 /nfs/dbraw/zinc/18/20/23/946182023.db2.gz WABMEDJPBTTWIO-LJQANCHMSA-N 0 0 360.335 3.534 20 5 FHBDRN CCO[C@H](C)c1nc(COc2ccc([N+](=O)[O-])c(C(=O)OC)c2)cs1 ZINC000522979400 946183305 /nfs/dbraw/zinc/18/33/05/946183305.db2.gz OWJDSJGLVZEXHT-SNVBAGLBSA-N 0 0 366.395 3.514 20 5 FHBDRN CC(=O)N(c1ccc(NC(=O)c2cccc([N+](=O)[O-])c2C)cc1)[C@H]1C[C@H]1C ZINC000294050647 946188517 /nfs/dbraw/zinc/18/85/17/946188517.db2.gz FRKQEYUGNSDBBG-BLVKFPJESA-N 0 0 367.405 3.917 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN(C)[C@@H](C)c1ccc(C)cc1 ZINC000052907272 946195649 /nfs/dbraw/zinc/19/56/49/946195649.db2.gz JDWTWKMEALHHKO-AWEZNQCLSA-N 0 0 357.410 3.543 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])o1)N1CC[C@@H](c2cccc(Br)c2)C1 ZINC000456157135 946196841 /nfs/dbraw/zinc/19/68/41/946196841.db2.gz SCNJJSCRWJQJFA-LLVKDONJSA-N 0 0 365.183 3.580 20 5 FHBDRN COc1cc(OCc2nc(-c3cc(C)cc(F)c3)no2)ccc1[N+](=O)[O-] ZINC000545619329 946211429 /nfs/dbraw/zinc/21/14/29/946211429.db2.gz QNWQZDKOABLTLW-UHFFFAOYSA-N 0 0 359.313 3.680 20 5 FHBDRN O=C(CCc1ccc(F)cc1)O[C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000759926722 946216449 /nfs/dbraw/zinc/21/64/49/946216449.db2.gz BQSQBNDXKMFIDC-CVEARBPZSA-N 0 0 361.373 3.590 20 5 FHBDRN CNc1ccc(C(=O)N2CCC(Cc3ccc(F)cc3)CC2)cc1[N+](=O)[O-] ZINC000523050635 946218493 /nfs/dbraw/zinc/21/84/93/946218493.db2.gz YMPPONOHKDBDJM-UHFFFAOYSA-N 0 0 371.412 3.871 20 5 FHBDRN COc1cccc(N[C@@H]2CCC[C@@H](NC(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000302507102 946237843 /nfs/dbraw/zinc/23/78/43/946237843.db2.gz RABXGSDZOBKCRE-CHWSQXEVSA-N 0 0 365.430 3.851 20 5 FHBDRN CC[C@@H](C)C(=O)Nc1cccc(CNC(=O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000045939803 946255505 /nfs/dbraw/zinc/25/55/05/946255505.db2.gz FVGLWXDAQCUVJX-CYBMUJFWSA-N 0 0 355.394 3.509 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)ccc1CN1CCC[C@](O)(C(F)(F)F)CC1 ZINC000323781609 946257233 /nfs/dbraw/zinc/25/72/33/946257233.db2.gz DLJMMEWPJZTBEP-CYBMUJFWSA-N 0 0 352.740 3.528 20 5 FHBDRN COc1ccc(Br)cc1CNCc1cccc([N+](=O)[O-])c1 ZINC000052926154 946258175 /nfs/dbraw/zinc/25/81/75/946258175.db2.gz IVBXEEVXTZAJAT-UHFFFAOYSA-N 0 0 351.200 3.656 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1OC(=O)CCc1nnc(-c2ccsc2)o1 ZINC000045998224 946278185 /nfs/dbraw/zinc/27/81/85/946278185.db2.gz FFUUTIHYNKKPJJ-UHFFFAOYSA-N 0 0 359.363 3.553 20 5 FHBDRN CC1(C)C[C@H](Nc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)c2ccccc21 ZINC000302688155 946280801 /nfs/dbraw/zinc/28/08/01/946280801.db2.gz YRSPTUUPXYYHAB-INIZCTEOSA-N 0 0 360.435 3.833 20 5 FHBDRN COc1cc(C(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)ccc1OC(C)C ZINC000088231927 946292410 /nfs/dbraw/zinc/29/24/10/946292410.db2.gz CZVJVFAOONHPPI-UHFFFAOYSA-N 0 0 370.405 3.589 20 5 FHBDRN CN(CCc1cccs1)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186014698 946292898 /nfs/dbraw/zinc/29/28/98/946292898.db2.gz ZEIGLBNNDYBATR-UHFFFAOYSA-N 0 0 353.831 3.694 20 5 FHBDRN O=C([C@@H]1C[C@@]12CCCc1ccccc12)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088230743 946293170 /nfs/dbraw/zinc/29/31/70/946293170.db2.gz SFSUWVDGBKFDCU-RBBKRZOGSA-N 0 0 362.429 3.774 20 5 FHBDRN CCCOc1ccc(CCC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)cc1 ZINC000088231193 946294075 /nfs/dbraw/zinc/29/40/75/946294075.db2.gz IAAKGRZMINUUAS-UHFFFAOYSA-N 0 0 368.433 3.901 20 5 FHBDRN O=C(c1cccc(Br)c1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088231926 946297244 /nfs/dbraw/zinc/29/72/44/946297244.db2.gz ZDKXJMDBOMAASA-UHFFFAOYSA-N 0 0 361.195 3.556 20 5 FHBDRN C[C@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1)c1cccc(N2CCCC2)c1 ZINC000088238253 946297355 /nfs/dbraw/zinc/29/73/55/946297355.db2.gz YNGOAYOYODGVID-HNNXBMFYSA-N 0 0 353.422 3.615 20 5 FHBDRN Cc1cc(C(=O)N[C@H](c2ccc3c(c2)OCCO3)C2CC2)cc([N+](=O)[O-])c1 ZINC000148296905 946305432 /nfs/dbraw/zinc/30/54/32/946305432.db2.gz ZKVFCRNHMLYBPO-IBGZPJMESA-N 0 0 368.389 3.556 20 5 FHBDRN CC(C)[C@@H](O)CCNC(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000438487692 946306599 /nfs/dbraw/zinc/30/65/99/946306599.db2.gz BEIWAAXDLWATGJ-SFHVURJKSA-N 0 0 373.409 3.916 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CC[C@](C)(c2ccccc2)C1 ZINC000438489749 946306991 /nfs/dbraw/zinc/30/69/91/946306991.db2.gz JXIDBIMBVGLWMZ-FQEVSTJZSA-N 0 0 353.422 3.505 20 5 FHBDRN Cc1cccc(CSCC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)c1 ZINC000088231777 946314260 /nfs/dbraw/zinc/31/42/60/946314260.db2.gz NYEYZBPNKWLILM-UHFFFAOYSA-N 0 0 356.447 3.721 20 5 FHBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)NCCC1=CCCC1 ZINC000550321683 946337145 /nfs/dbraw/zinc/33/71/45/946337145.db2.gz SJNHDTCHYRVQME-UHFFFAOYSA-N 0 0 353.216 3.896 20 5 FHBDRN COCc1cc(CNC(=O)c2cccc(SC)c2[N+](=O)[O-])ccc1F ZINC000186469243 946338397 /nfs/dbraw/zinc/33/83/97/946338397.db2.gz CESLDGRPRCDNSS-UHFFFAOYSA-N 0 0 364.398 3.532 20 5 FHBDRN C[C@@H](NC(=O)CN(C)c1ccccc1[N+](=O)[O-])c1cc2cccc(F)c2o1 ZINC000475083233 946342033 /nfs/dbraw/zinc/34/20/33/946342033.db2.gz ALQACDVQHYKMIR-GFCCVEGCSA-N 0 0 371.368 3.794 20 5 FHBDRN CC(C)(C(=O)N[C@H]1CCO[C@H](c2cccs2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000456564248 946351027 /nfs/dbraw/zinc/35/10/27/946351027.db2.gz YRYFVRQCWOERMR-HOCLYGCPSA-N 0 0 374.462 3.970 20 5 FHBDRN COC(=O)c1cc(-c2nc(Cc3ccc(Cl)cc3)no2)cc([N+](=O)[O-])c1 ZINC000109613154 946353768 /nfs/dbraw/zinc/35/37/68/946353768.db2.gz UKOOPEZMDOSMPP-UHFFFAOYSA-N 0 0 373.752 3.676 20 5 FHBDRN Cc1c(Cl)cc(S(=O)(=O)Oc2cc(F)ccc2F)cc1[N+](=O)[O-] ZINC000729486806 946357233 /nfs/dbraw/zinc/35/72/33/946357233.db2.gz BLEXOYSCBDEOEK-UHFFFAOYSA-N 0 0 363.725 3.603 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@]1(O)CCCC(C)(C)C1 ZINC000438501738 946365378 /nfs/dbraw/zinc/36/53/78/946365378.db2.gz MFDYYSUDRKHWFA-UGSOOPFHSA-N 0 0 366.483 3.523 20 5 FHBDRN O=C(NC1Cc2ccccc2C1)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000444319931 946376707 /nfs/dbraw/zinc/37/67/07/946376707.db2.gz DEVFEHALYKCLKP-UHFFFAOYSA-N 0 0 372.399 3.718 20 5 FHBDRN COc1ccc(C(=O)N[C@H](C)c2cc3cccc(F)c3o2)cc1[N+](=O)[O-] ZINC000475099150 946377790 /nfs/dbraw/zinc/37/77/90/946377790.db2.gz XOALTDTXRKBHQK-SNVBAGLBSA-N 0 0 358.325 3.980 20 5 FHBDRN COc1ccc([C@@H]2CCCN2c2ccc([N+](=O)[O-])c3cnccc32)nc1 ZINC000897295752 946392972 /nfs/dbraw/zinc/39/29/72/946392972.db2.gz IJQJTLLLXSYVGD-IBGZPJMESA-N 0 0 350.378 3.888 20 5 FHBDRN COc1ccc(CN(C)C(=O)Nc2cc([N+](=O)[O-])ccc2C)c(OC)c1 ZINC000043149803 946398067 /nfs/dbraw/zinc/39/80/67/946398067.db2.gz IMMGJKGACPPJDD-UHFFFAOYSA-N 0 0 359.382 3.584 20 5 FHBDRN Cc1onc(-c2ccccc2C)c1C(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000475105680 946406731 /nfs/dbraw/zinc/40/67/31/946406731.db2.gz DDJCSXWFVRNMOY-UHFFFAOYSA-N 0 0 365.389 3.839 20 5 FHBDRN O=[N+]([O-])c1cccc(CCc2nc(-c3ccc(OCC4CC4)nc3)no2)c1 ZINC000545686164 946407814 /nfs/dbraw/zinc/40/78/14/946407814.db2.gz XVOZKVQTVYERPS-UHFFFAOYSA-N 0 0 366.377 3.614 20 5 FHBDRN CN1CCC[C@@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)c2ccccc21 ZINC000456596931 946410576 /nfs/dbraw/zinc/41/05/76/946410576.db2.gz OXAUZMMBZIEPDH-QGZVFWFLSA-N 0 0 373.840 3.878 20 5 FHBDRN O=C(c1ccc(N2CCCC2)c(F)c1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088251979 946412663 /nfs/dbraw/zinc/41/26/63/946412663.db2.gz KFXVMNURWCGTHI-UHFFFAOYSA-N 0 0 369.396 3.533 20 5 FHBDRN Cc1ccc(NC(=O)NCc2ccccc2[N+](=O)[O-])c(Br)c1 ZINC000047705594 946413339 /nfs/dbraw/zinc/41/33/39/946413339.db2.gz AEVLHZUCGUQIOU-UHFFFAOYSA-N 0 0 364.199 3.987 20 5 FHBDRN CCN(C(=O)c1ccc([N+](=O)[O-])c(OC)c1)c1nc2ccccc2s1 ZINC000523002896 946415307 /nfs/dbraw/zinc/41/53/07/946415307.db2.gz PGDSRQRSBCRYRA-UHFFFAOYSA-N 0 0 357.391 3.880 20 5 FHBDRN O=C(N[C@H](c1cccc(F)c1)c1ccccn1)c1cc(F)ccc1[N+](=O)[O-] ZINC000121371655 946423120 /nfs/dbraw/zinc/42/31/20/946423120.db2.gz VQKVWUOEIYUSLP-GOSISDBHSA-N 0 0 369.327 3.787 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)Nc1ccnn1C1CCCCC1 ZINC000127191415 946424303 /nfs/dbraw/zinc/42/43/03/946424303.db2.gz JPNCIROTPONUCC-UHFFFAOYSA-N 0 0 367.409 3.959 20 5 FHBDRN Cc1cc(C(=O)N(Cc2ccccc2)CC2(O)CCCC2)cc([N+](=O)[O-])c1 ZINC000475491248 946427406 /nfs/dbraw/zinc/42/74/06/946427406.db2.gz FENQDVYPSADKKQ-UHFFFAOYSA-N 0 0 368.433 3.851 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N2CCCc3cccc(F)c32)cc1OC ZINC000121369982 946427670 /nfs/dbraw/zinc/42/76/70/946427670.db2.gz QDKLHPGTGXPZCQ-UHFFFAOYSA-N 0 0 374.368 3.734 20 5 FHBDRN O=C(N[C@H]1CCC(F)(F)C1)c1cc(F)c(Cl)c([N+](=O)[O-])c1Cl ZINC000897007720 946438371 /nfs/dbraw/zinc/43/83/71/946438371.db2.gz NXUSKVLXRCKTKN-YFKPBYRVSA-N 0 0 357.115 3.958 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])Nc1ccc2oc(C3CC3)nc2c1 ZINC000047855370 946443952 /nfs/dbraw/zinc/44/39/52/946443952.db2.gz YHYLQLAJWQQZFE-UHFFFAOYSA-N 0 0 352.350 3.935 20 5 FHBDRN CSc1cccc(C(=O)N[C@H]2CCCN(c3ccccc3)C2)c1[N+](=O)[O-] ZINC000186512742 946444733 /nfs/dbraw/zinc/44/47/33/946444733.db2.gz GHPVZZMTVSZIFW-AWEZNQCLSA-N 0 0 371.462 3.716 20 5 FHBDRN CC(C)(O)COc1ccc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)cc1 ZINC000475498497 946458663 /nfs/dbraw/zinc/45/86/63/946458663.db2.gz UXILYVFMQRUSRK-UHFFFAOYSA-N 0 0 370.361 3.743 20 5 FHBDRN COc1ccc(CNC(=O)N(CC(C)C)CC(C)(C)C)cc1[N+](=O)[O-] ZINC000475137746 946458932 /nfs/dbraw/zinc/45/89/32/946458932.db2.gz SGKUZGRBTGRFOY-UHFFFAOYSA-N 0 0 351.447 3.817 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)NCC2(c3ccccc3)CC2)c1 ZINC000047990884 946462016 /nfs/dbraw/zinc/46/20/16/946462016.db2.gz DGIMPOJGLKPLNI-UHFFFAOYSA-N 0 0 354.406 3.520 20 5 FHBDRN Cc1c(NC(=O)NCCCOCCc2ccccc2)cccc1[N+](=O)[O-] ZINC000048053203 946485282 /nfs/dbraw/zinc/48/52/82/946485282.db2.gz LATGMYRYGOCMMC-UHFFFAOYSA-N 0 0 357.410 3.674 20 5 FHBDRN CCOc1cc(NC(=O)N(C)C[C@@H](C)CC)c([N+](=O)[O-])cc1OCC ZINC000111715366 946506476 /nfs/dbraw/zinc/50/64/76/946506476.db2.gz XDXSSUOQEYODOZ-LBPRGKRZSA-N 0 0 353.419 3.902 20 5 FHBDRN CSc1ccccc1[C@H](C)NC(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000441383962 946508384 /nfs/dbraw/zinc/50/83/84/946508384.db2.gz KYOQHFLVRUUREC-ZDUSSCGKSA-N 0 0 360.435 3.963 20 5 FHBDRN COc1cc(F)c([C@@H](C)NC(=O)c2cc([N+](=O)[O-])ccc2C)cc1OC ZINC000074611339 946519222 /nfs/dbraw/zinc/51/92/22/946519222.db2.gz JOKIERJHANLDAD-LLVKDONJSA-N 0 0 362.357 3.551 20 5 FHBDRN CSc1cccc(C(=O)Nc2ccccc2-n2cccn2)c1[N+](=O)[O-] ZINC000186135390 946524164 /nfs/dbraw/zinc/52/41/64/946524164.db2.gz HIOCGEPZAUGRHX-UHFFFAOYSA-N 0 0 354.391 3.755 20 5 FHBDRN CC(=O)Nc1ccc(C(F)(F)F)cc1NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000141383974 946530440 /nfs/dbraw/zinc/53/04/40/946530440.db2.gz IFVAZQJGKVVGOQ-UHFFFAOYSA-N 0 0 367.283 3.824 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N[C@H]1CCCc2ccc(F)cc21 ZINC000093063466 946534887 /nfs/dbraw/zinc/53/48/87/946534887.db2.gz IKYVBBVMMKDNNF-IBGZPJMESA-N 0 0 367.380 3.952 20 5 FHBDRN COC(C)(C)CNC(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000469873797 946538184 /nfs/dbraw/zinc/53/81/84/946538184.db2.gz GAGNUZMMJALIGJ-UHFFFAOYSA-N 0 0 359.382 3.934 20 5 FHBDRN CC[C@H](C)[C@H]1CCCCN1C(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000523097305 946544247 /nfs/dbraw/zinc/54/42/47/946544247.db2.gz WLUWCNQLDBXRAG-KBXCAEBGSA-N 0 0 356.426 3.821 20 5 FHBDRN CC(C)[C@H](CNC(=O)CCc1cccc([N+](=O)[O-])c1)Nc1ccccc1 ZINC000088281983 946546726 /nfs/dbraw/zinc/54/67/26/946546726.db2.gz IHOXPZDBGADMGC-IBGZPJMESA-N 0 0 355.438 3.780 20 5 FHBDRN C[C@@H](CNC(=O)N1C[C@H](C)C[C@@H]1c1cccnc1)c1ccccc1[N+](=O)[O-] ZINC000897060910 946548162 /nfs/dbraw/zinc/54/81/62/946548162.db2.gz DFAJSVLLMFOPOH-ZRGWGRIASA-N 0 0 368.437 3.886 20 5 FHBDRN C[C@@H](CN(C)C(=O)NC[C@@H](C)c1ccccc1[N+](=O)[O-])c1nccs1 ZINC000897061340 946548567 /nfs/dbraw/zinc/54/85/67/946548567.db2.gz IJRMAXWBPGRFLP-OLZOCXBDSA-N 0 0 362.455 3.600 20 5 FHBDRN CCO[C@@H]1C[C@@H](N(C)C(=O)c2cccc(SC)c2[N+](=O)[O-])C1(C)C ZINC000186560721 946551645 /nfs/dbraw/zinc/55/16/45/946551645.db2.gz MITFAAHCXZGHST-ZIAGYGMSSA-N 0 0 352.456 3.592 20 5 FHBDRN CSc1cccc(C(=O)Nc2ccc(C(=O)N(C)C)c(C)c2)c1[N+](=O)[O-] ZINC000186564390 946552306 /nfs/dbraw/zinc/55/23/06/946552306.db2.gz RTYTVJCOPVXBQB-UHFFFAOYSA-N 0 0 373.434 3.579 20 5 FHBDRN C[C@@H](CNC(=O)N1CCC[C@@H]1c1ccncc1)c1ccccc1[N+](=O)[O-] ZINC000897074242 946553354 /nfs/dbraw/zinc/55/33/54/946553354.db2.gz BIPSNKVSTCTODC-WMLDXEAASA-N 0 0 354.410 3.640 20 5 FHBDRN CN(Cc1ccc(Cl)cc1Cl)C(=O)COc1ccccc1[N+](=O)[O-] ZINC000015965960 946558638 /nfs/dbraw/zinc/55/86/38/946558638.db2.gz AAECZSPFPWSYLX-UHFFFAOYSA-N 0 0 369.204 3.939 20 5 FHBDRN Cn1ccnc1[C@H](NCc1ccc([N+](=O)[O-])c(Cl)c1)c1ccccc1 ZINC000783594166 946563541 /nfs/dbraw/zinc/56/35/41/946563541.db2.gz DNPQOXFPLWCSCE-QGZVFWFLSA-N 0 0 356.813 3.861 20 5 FHBDRN CC[C@H](c1ccncc1)N(C)C(=O)NC[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000897069560 946564734 /nfs/dbraw/zinc/56/47/34/946564734.db2.gz XTMQELKFHVHDBV-WMLDXEAASA-N 0 0 356.426 3.886 20 5 FHBDRN COc1ccc(OC(F)F)c(NC(=O)c2cccc([N+](=O)[O-])c2C)c1 ZINC000048282716 946565193 /nfs/dbraw/zinc/56/51/93/946565193.db2.gz RJSMDJCDGNPIDG-UHFFFAOYSA-N 0 0 352.293 3.766 20 5 FHBDRN O=[N+]([O-])c1cc2c(ncnc2N2CC[C@@H]3CC[C@@]32c2cccnc2)s1 ZINC000897070888 946567255 /nfs/dbraw/zinc/56/72/55/946567255.db2.gz IZBLRLRRSDVBBV-GTNSWQLSSA-N 0 0 353.407 3.510 20 5 FHBDRN CCc1nc(CN(C)C(=O)NC[C@@H](C)c2ccccc2[N+](=O)[O-])cs1 ZINC000897071369 946567517 /nfs/dbraw/zinc/56/75/17/946567517.db2.gz BUHWALOEZSTVDL-GFCCVEGCSA-N 0 0 362.455 3.559 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N[C@@H]1CCc2c1cccc2Cl ZINC000520421593 946570385 /nfs/dbraw/zinc/57/03/85/946570385.db2.gz OZDUOIIQLAHEQT-OAHLLOKOSA-N 0 0 366.826 3.522 20 5 FHBDRN CC(C)c1ncc(CN(C)C(=O)c2cc3cc([N+](=O)[O-])ccc3o2)cn1 ZINC000441404585 946580945 /nfs/dbraw/zinc/58/09/45/946580945.db2.gz AHPWMNVKDIRYCQ-UHFFFAOYSA-N 0 0 354.366 3.527 20 5 FHBDRN CCOc1cc(N2CCC(C(=O)c3ccc(O)cc3)CC2)ccc1[N+](=O)[O-] ZINC000092687624 946588158 /nfs/dbraw/zinc/58/81/58/946588158.db2.gz XOLHBEATXIDCQS-UHFFFAOYSA-N 0 0 370.405 3.798 20 5 FHBDRN O=c1c([N+](=O)[O-])cccn1CCOC(c1ccccc1)c1ccccc1 ZINC000102204410 946596078 /nfs/dbraw/zinc/59/60/78/946596078.db2.gz YNPAAUMCJMQJJR-UHFFFAOYSA-N 0 0 350.374 3.563 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)NCC1(c2ccc(F)cc2)CCCC1 ZINC000048348214 946598939 /nfs/dbraw/zinc/59/89/39/946598939.db2.gz YGFXMOHBKPDRPJ-UHFFFAOYSA-N 0 0 357.385 3.679 20 5 FHBDRN CCCCn1cc(C(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)c(C)n1 ZINC000186206042 946619341 /nfs/dbraw/zinc/61/93/41/946619341.db2.gz CFKOPVQHIJPTPI-UHFFFAOYSA-N 0 0 356.426 3.705 20 5 FHBDRN C[C@@H]1CC[C@@H](CCc2nc(Cc3c[nH]c4ccc([N+](=O)[O-])cc34)no2)O1 ZINC000545782329 946631494 /nfs/dbraw/zinc/63/14/94/946631494.db2.gz ABHKODDZRZIGIQ-RISCZKNCSA-N 0 0 356.382 3.550 20 5 FHBDRN Cc1c(CC(=O)N2CCO[C@@H](c3cccc(Cl)c3)C2)cccc1[N+](=O)[O-] ZINC000186220957 946631479 /nfs/dbraw/zinc/63/14/79/946631479.db2.gz WHCJLAJITZWUMJ-GOSISDBHSA-N 0 0 374.824 3.699 20 5 FHBDRN O=C1[C@H](Nc2ccc([N+](=O)[O-])cn2)CCN1c1ccc(Cl)cc1Cl ZINC000473909232 946633531 /nfs/dbraw/zinc/63/35/31/946633531.db2.gz BAQJPGAUBNCKHS-GFCCVEGCSA-N 0 0 367.192 3.514 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N1CCO[C@@H](c2ccccc2Cl)C1 ZINC000151787178 946634601 /nfs/dbraw/zinc/63/46/01/946634601.db2.gz SVYHWNCSJSLLFW-GOSISDBHSA-N 0 0 374.824 3.781 20 5 FHBDRN CCO[C@H]1C[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2SC)C12CCCC2 ZINC001126606227 946651523 /nfs/dbraw/zinc/65/15/23/946651523.db2.gz BSISSHUJIWXRFX-HOTGVXAUSA-N 0 0 364.467 3.784 20 5 FHBDRN Cc1cc(OCc2nc(Cc3ccc([N+](=O)[O-])cn3)no2)cc(C)c1Cl ZINC000545786384 946652966 /nfs/dbraw/zinc/65/29/66/946652966.db2.gz OTLHUKRIKZKGJY-UHFFFAOYSA-N 0 0 374.784 3.813 20 5 FHBDRN COc1cc(NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)cc(OC)c1 ZINC000545818688 946658843 /nfs/dbraw/zinc/65/88/43/946658843.db2.gz HKSSTLIUGJIKMF-UHFFFAOYSA-N 0 0 362.357 3.667 20 5 FHBDRN C[C@H]1C[C@@H](CNC(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CCO1 ZINC000475192363 946660578 /nfs/dbraw/zinc/66/05/78/946660578.db2.gz MPKJTJKUIPUPOF-UWVGGRQHSA-N 0 0 361.320 3.550 20 5 FHBDRN COCCCCN(Cc1ccccc1)C(=O)c1cccc([N+](=O)[O-])c1OC ZINC000475191930 946661109 /nfs/dbraw/zinc/66/11/09/946661109.db2.gz REEGKFRDXVTJHV-UHFFFAOYSA-N 0 0 372.421 3.672 20 5 FHBDRN Cc1cn(-c2ccccc2)nc1C(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000186259622 946663723 /nfs/dbraw/zinc/66/37/23/946663723.db2.gz LMDKNIYENZBGMX-OAHLLOKOSA-N 0 0 364.405 3.888 20 5 FHBDRN O=C(c1cc(F)cc2c(=O)c3cccc(F)c3[nH]c12)N1CCCC2(CC2)C1 ZINC000444329795 946671206 /nfs/dbraw/zinc/67/12/06/946671206.db2.gz KWLJAFYZTMPUDY-UHFFFAOYSA-N 0 0 368.383 3.976 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)N[C@@H]2C[C@H]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000428360088 946672798 /nfs/dbraw/zinc/67/27/98/946672798.db2.gz IENQCFQCBLKILJ-BMGDILEWSA-N 0 0 353.422 3.895 20 5 FHBDRN Cc1[nH]c2ccccc2c1C(=O)O[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000027812522 946678020 /nfs/dbraw/zinc/67/80/20/946678020.db2.gz KNASDUZXYZKEJW-LBPRGKRZSA-N 0 0 367.361 3.569 20 5 FHBDRN Cc1c(NC(=O)Cc2ccccc2[N+](=O)[O-])cnn1-c1cc(C)ccc1C ZINC000151950400 946680802 /nfs/dbraw/zinc/68/08/02/946680802.db2.gz FZLFRKPEPCYZHJ-UHFFFAOYSA-N 0 0 364.405 3.887 20 5 FHBDRN Cc1cc2c(cc1C)[C@@H](C(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1)CO2 ZINC000186613440 946684965 /nfs/dbraw/zinc/68/49/65/946684965.db2.gz GTLTZCZFQHJUCN-SFHVURJKSA-N 0 0 366.417 3.879 20 5 FHBDRN Cc1cc2c(cc1C)[C@H](C(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1)CO2 ZINC000186613455 946685724 /nfs/dbraw/zinc/68/57/24/946685724.db2.gz GTLTZCZFQHJUCN-GOSISDBHSA-N 0 0 366.417 3.879 20 5 FHBDRN CC(C)CN(CC(C)(C)C)C(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000475200988 946714915 /nfs/dbraw/zinc/71/49/15/946714915.db2.gz CXJAMOUOCUDDST-UHFFFAOYSA-N 0 0 358.442 3.925 20 5 FHBDRN CCO[C@@H]1C[C@H](NC(=O)c2cccc(SC)c2[N+](=O)[O-])C12CCCC2 ZINC000186617911 946718358 /nfs/dbraw/zinc/71/83/58/946718358.db2.gz DPSBWFSKCMUNML-LSDHHAIUSA-N 0 0 364.467 3.784 20 5 FHBDRN C[C@H](c1cccc(Cl)c1)N(C)S(=O)(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000151971962 946730313 /nfs/dbraw/zinc/73/03/13/946730313.db2.gz IODYBIFRGMMJHO-GFCCVEGCSA-N 0 0 368.842 3.771 20 5 FHBDRN CCOCc1ccc(NC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)cc1 ZINC000088391939 946739485 /nfs/dbraw/zinc/73/94/85/946739485.db2.gz UJKJCHMMFFTCCV-UHFFFAOYSA-N 0 0 355.394 3.722 20 5 FHBDRN C[C@@H](Cc1ccc(O)cc1)NC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000151986195 946740488 /nfs/dbraw/zinc/74/04/88/946740488.db2.gz LKBHNLSKAFVZGI-JTQLQIEISA-N 0 0 368.311 3.680 20 5 FHBDRN CC(C)CCSc1ccc(C(=O)N2CC[C@@H](O)[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000186631298 946747208 /nfs/dbraw/zinc/74/72/08/946747208.db2.gz ROWUYMLVKWRICX-XJKSGUPXSA-N 0 0 366.483 3.576 20 5 FHBDRN CSc1cccc(C(=O)N2C[C@H](C)OC[C@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000186630960 946747302 /nfs/dbraw/zinc/74/73/02/946747302.db2.gz MXSXHENDEYGJQQ-BBRMVZONSA-N 0 0 372.446 3.919 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NC[C@@H](C)Oc1ccccc1F ZINC000475583727 946751093 /nfs/dbraw/zinc/75/10/93/946751093.db2.gz XIOVEHYLNRLKSZ-CYBMUJFWSA-N 0 0 361.373 3.940 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@@H](c1oc2ccccc2c1C)C(C)C ZINC000112187585 946758663 /nfs/dbraw/zinc/75/86/63/946758663.db2.gz RUMUEZCGIHQOIV-GOSISDBHSA-N 0 0 370.409 3.668 20 5 FHBDRN Cc1c(-c2nc(-c3ccc4oc(N(C)C)nc4c3)no2)cccc1[N+](=O)[O-] ZINC000546531686 946768878 /nfs/dbraw/zinc/76/88/78/946768878.db2.gz DZBARSCSQBXNLI-UHFFFAOYSA-N 0 0 365.349 3.827 20 5 FHBDRN O=C(NCc1ccc(Cl)cc1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000016024386 946772321 /nfs/dbraw/zinc/77/23/21/946772321.db2.gz MTABGUOCZNWPDC-UHFFFAOYSA-N 0 0 373.840 3.781 20 5 FHBDRN CCOc1ccc(C(=O)NCCc2ccc(OC(C)C)cc2)cc1[N+](=O)[O-] ZINC000025887262 946777189 /nfs/dbraw/zinc/77/71/89/946777189.db2.gz QNXSPOPOBHOYMH-UHFFFAOYSA-N 0 0 372.421 3.753 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2ncn(CCCOc3cccc(Cl)c3)n2)cc1 ZINC000523110444 946779810 /nfs/dbraw/zinc/77/98/10/946779810.db2.gz KONDEQZOUSPUAG-UHFFFAOYSA-N 0 0 358.785 3.976 20 5 FHBDRN CCC(C)(C)[C@@H]1CCCN1C(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000134028585 946782596 /nfs/dbraw/zinc/78/25/96/946782596.db2.gz QFSRFVCSAWKWKU-KRWDZBQOSA-N 0 0 356.426 3.821 20 5 FHBDRN Nc1ccc2c(c1)CCC[C@@H]2NC(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000186652486 946783888 /nfs/dbraw/zinc/78/38/88/946783888.db2.gz RNULPGWMNOHRNZ-IBGZPJMESA-N 0 0 368.437 3.563 20 5 FHBDRN CCOC(=O)c1ccnc(N(C)[C@@H](C)c2c(F)cccc2F)c1[N+](=O)[O-] ZINC000523114963 946790102 /nfs/dbraw/zinc/79/01/02/946790102.db2.gz HKKYVPWXBAKUHY-JTQLQIEISA-N 0 0 365.336 3.642 20 5 FHBDRN CCCN(Cc1ccc(F)cc1)c1nccc(C(=O)OCC)c1[N+](=O)[O-] ZINC000523114466 946798077 /nfs/dbraw/zinc/79/80/77/946798077.db2.gz KZPVUBRSWOFBPS-UHFFFAOYSA-N 0 0 361.373 3.722 20 5 FHBDRN COc1c(C(=O)Nc2c(F)cccc2N2CCCC2)cccc1[N+](=O)[O-] ZINC000475597844 946835620 /nfs/dbraw/zinc/83/56/20/946835620.db2.gz YCHJNHWMROZOEI-UHFFFAOYSA-N 0 0 359.357 3.595 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)c2ccnc(-c3ccccc3)n2)cc1[N+](=O)[O-] ZINC001126614851 946837349 /nfs/dbraw/zinc/83/73/49/946837349.db2.gz GWZJVGLDUVAJMH-CQSZACIVSA-N 0 0 362.389 3.851 20 5 FHBDRN C[C@H](CCC1CCCCC1)NC(=O)c1ccnc(-n2ccc([N+](=O)[O-])n2)c1 ZINC001126157143 946845696 /nfs/dbraw/zinc/84/56/96/946845696.db2.gz RZXSINPCAXJBOF-CQSZACIVSA-N 0 0 371.441 3.654 20 5 FHBDRN C[C@@H](CCC1CCCCC1)NC(=O)c1ccnc(-n2ccc([N+](=O)[O-])n2)c1 ZINC001126157142 946845976 /nfs/dbraw/zinc/84/59/76/946845976.db2.gz RZXSINPCAXJBOF-AWEZNQCLSA-N 0 0 371.441 3.654 20 5 FHBDRN CCc1cnc(CN(C)C(=O)c2cccc(SC)c2[N+](=O)[O-])s1 ZINC000186681111 946849256 /nfs/dbraw/zinc/84/92/56/946849256.db2.gz DSYZZXMGAQBGGM-UHFFFAOYSA-N 0 0 351.453 3.608 20 5 FHBDRN COCC1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)CC1 ZINC000112315650 946855342 /nfs/dbraw/zinc/85/53/42/946855342.db2.gz CAVNBLIWJINAOB-UHFFFAOYSA-N 0 0 370.405 3.886 20 5 FHBDRN Cc1cc(NC(=O)CO[C@H]2CCC[C@@H](C)C2)n(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000261483975 946866310 /nfs/dbraw/zinc/86/63/10/946866310.db2.gz YSLFKSVJHWFOPV-DYVFJYSZSA-N 0 0 372.425 3.623 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CCO[C@H](c2cccc(F)c2)C1 ZINC000184487004 946872496 /nfs/dbraw/zinc/87/24/96/946872496.db2.gz BMVSADFSUCBZBY-SFHVURJKSA-N 0 0 373.384 3.956 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N(C)C[C@H]1COc2ccccc2O1 ZINC000184485608 946872634 /nfs/dbraw/zinc/87/26/34/946872634.db2.gz SOWQIJJXDQLSCH-AWEZNQCLSA-N 0 0 371.393 3.515 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CC[C@@]2(C1)OCc1ccccc12 ZINC000184484656 946873198 /nfs/dbraw/zinc/87/31/98/946873198.db2.gz WJAXDBDZQCFKFW-FQEVSTJZSA-N 0 0 367.405 3.875 20 5 FHBDRN CC[C@H](CNc1ccccc1)NC(=O)N[C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000458884697 946877259 /nfs/dbraw/zinc/87/72/59/946877259.db2.gz FSYRZMXJAYXMMN-GOEBONIOSA-N 0 0 356.426 3.846 20 5 FHBDRN CCCc1n[nH]c(C(=O)N(C)Cc2csc3ccccc23)c1[N+](=O)[O-] ZINC000523124836 946885401 /nfs/dbraw/zinc/88/54/01/946885401.db2.gz LOTDNAXCMDVZQS-UHFFFAOYSA-N 0 0 358.423 3.757 20 5 FHBDRN CCCOc1cc(OC)ccc1C(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000475340821 946909945 /nfs/dbraw/zinc/90/99/45/946909945.db2.gz AYLNYPQFLQTOGI-UHFFFAOYSA-N 0 0 360.366 3.653 20 5 FHBDRN CC(C)(NC(=O)c1cc2c(cc1[N+](=O)[O-])OCCCO2)c1cccc(F)c1 ZINC001126173569 946914053 /nfs/dbraw/zinc/91/40/53/946914053.db2.gz GIZFBXZGNCPNCM-UHFFFAOYSA-N 0 0 374.368 3.560 20 5 FHBDRN CS(=O)(=O)c1ccc(Oc2ccc(Br)cc2[N+](=O)[O-])cc1 ZINC000048760133 946917603 /nfs/dbraw/zinc/91/76/03/946917603.db2.gz DKQIMBCFNWYIMJ-UHFFFAOYSA-N 0 0 372.196 3.553 20 5 FHBDRN CN(Cc1ccc(Cl)s1)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000067375067 946933375 /nfs/dbraw/zinc/93/33/75/946933375.db2.gz XXKPYWLGHCIONI-CQSZACIVSA-N 0 0 365.842 3.547 20 5 FHBDRN CSc1cccc(C(=O)NCc2cccc3cccnc32)c1[N+](=O)[O-] ZINC000186333233 946935973 /nfs/dbraw/zinc/93/59/73/946935973.db2.gz DADISYHNUZRWQX-UHFFFAOYSA-N 0 0 353.403 3.795 20 5 FHBDRN C[C@@H](NC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1)c1cccc2ccccc21 ZINC000048873607 946943669 /nfs/dbraw/zinc/94/36/69/946943669.db2.gz DLJJUFVBRGBIAH-CYBMUJFWSA-N 0 0 363.373 3.564 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)Nc1cccc(OC[C@@H]2CCCO2)c1 ZINC000087064746 946944717 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360.797 3.677 20 5 FHBDRN COc1cccc([C@@H]2C[C@@H]2C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000186341595 946960351 /nfs/dbraw/zinc/96/03/51/946960351.db2.gz HJRVMJQWKVYOFW-HOTGVXAUSA-N 0 0 360.797 3.677 20 5 FHBDRN CC(=O)c1ccc(C(=O)Nc2cc(-c3cccc([N+](=O)[O-])c3)[nH]n2)s1 ZINC000523161786 946961976 /nfs/dbraw/zinc/96/19/76/946961976.db2.gz PHRMFKWUUISWDE-UHFFFAOYSA-N 0 0 356.363 3.501 20 5 FHBDRN CCOc1ccc(N(CC)S(=O)(=O)c2cc([N+](=O)[O-])c(C)s2)cc1 ZINC000466975911 946971084 /nfs/dbraw/zinc/97/10/84/946971084.db2.gz GJIFELWRZGSOLX-UHFFFAOYSA-N 0 0 370.452 3.579 20 5 FHBDRN CN(Cc1csc(Br)c1)c1nc2sccn2c1[N+](=O)[O-] ZINC000048963083 946981077 /nfs/dbraw/zinc/98/10/77/946981077.db2.gz UWKHQLCLYRUXQV-UHFFFAOYSA-N 0 0 373.257 3.764 20 5 FHBDRN CCC1(CC)CCC(NC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2C)CC1 ZINC000475380307 946982093 /nfs/dbraw/zinc/98/20/93/946982093.db2.gz GDFLUVAAHDKESS-UHFFFAOYSA-N 0 0 361.442 3.707 20 5 FHBDRN O=[N+]([O-])c1cccc(CS(=O)(=O)N2CC3(CCC3)[C@@H]2c2ccccc2)c1 ZINC000432256103 946985768 /nfs/dbraw/zinc/98/57/68/946985768.db2.gz BIGPNTUEXRMQGK-SFHVURJKSA-N 0 0 372.446 3.652 20 5 FHBDRN CC(C)(CNC(=O)NCCc1ccc([N+](=O)[O-])cc1)c1ccccc1F ZINC000523203169 946986617 /nfs/dbraw/zinc/98/66/17/946986617.db2.gz NFBLUGNXIPJIFR-UHFFFAOYSA-N 0 0 359.401 3.553 20 5 FHBDRN C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)N3CCC[C@H](C)C3)cc2[N+](=O)[O-])C1 ZINC000025967723 946997674 /nfs/dbraw/zinc/99/76/74/946997674.db2.gz BCJIMJBZBQIPPD-HRCADAONSA-N 0 0 359.470 3.949 20 5 FHBDRN CC(C)n1cc2cc(NC(=O)NCCc3ccc([N+](=O)[O-])cc3)ccc2n1 ZINC000475394506 947011155 /nfs/dbraw/zinc/01/11/55/947011155.db2.gz RRJRJPDGTABJPM-UHFFFAOYSA-N 0 0 367.409 3.890 20 5 FHBDRN Cc1ccc2c(c1)CC[C@@H]2NS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000511927694 947017191 /nfs/dbraw/zinc/01/71/91/947017191.db2.gz QIRHALBXDLFMKH-HNNXBMFYSA-N 0 0 366.826 3.522 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)c1occc1Br ZINC000186345779 947021254 /nfs/dbraw/zinc/02/12/54/947021254.db2.gz OZZDUZLREJETAY-UHFFFAOYSA-N 0 0 359.563 3.534 20 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358.348 3.869 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1)[C@H]1CCSC1 ZINC000475426943 947070292 /nfs/dbraw/zinc/07/02/92/947070292.db2.gz DVRFTHXDGCWULV-ZDUSSCGKSA-N 0 0 356.403 3.517 20 5 FHBDRN O=C(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccc(C2CCC2)cc1 ZINC000444642878 947085351 /nfs/dbraw/zinc/08/53/51/947085351.db2.gz YBDKFMZMAANZSH-UHFFFAOYSA-N 0 0 350.378 3.669 20 5 FHBDRN CN(Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)Cc1cc(F)c(F)c(F)c1 ZINC000444685629 947086974 /nfs/dbraw/zinc/08/69/74/947086974.db2.gz AUXUAHKUQVTNJP-UHFFFAOYSA-N 0 0 350.300 3.520 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1Cl)N(Cc1ccccc1)C1CC1 ZINC000053325006 947093529 /nfs/dbraw/zinc/09/35/29/947093529.db2.gz XBUDHROPBRXAHB-UHFFFAOYSA-N 0 0 360.797 3.818 20 5 FHBDRN O=C(c1c[nH]c(=O)c([N+](=O)[O-])c1)N1CCCC[C@@H]1c1cccc(Cl)c1 ZINC000444669934 947093592 /nfs/dbraw/zinc/09/35/92/947093592.db2.gz XIDUCWYHZIIMTA-CQSZACIVSA-N 0 0 361.785 3.716 20 5 FHBDRN C[C@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@H]1Oc2ccccc2[C@H]1C 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COc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@H](C)COCc1ccccc1 ZINC000444897782 947320396 /nfs/dbraw/zinc/32/03/96/947320396.db2.gz FUVPFBPFPSTYTD-AWEZNQCLSA-N 0 0 373.409 3.578 20 5 FHBDRN CCS[C@H]1CCCC[C@H]1NC(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000444895123 947332870 /nfs/dbraw/zinc/33/28/70/947332870.db2.gz JTCFKKMGTSPVMD-HIFRSBDPSA-N 0 0 353.444 3.789 20 5 FHBDRN CCCN(Cc1ccc(C)cc1)S(=O)(=O)c1ccc(C)cc1[N+](=O)[O-] ZINC000523500944 947333205 /nfs/dbraw/zinc/33/32/05/947333205.db2.gz SANWYQOXAICRNI-UHFFFAOYSA-N 0 0 362.451 3.813 20 5 FHBDRN CCCNC(=O)c1cccc(NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000523504554 947336305 /nfs/dbraw/zinc/33/63/05/947336305.db2.gz CYZJSLWWTRYRLQ-UHFFFAOYSA-N 0 0 369.421 3.651 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)NCc2cc(Br)cs2)c1 ZINC000088147433 947349135 /nfs/dbraw/zinc/34/91/35/947349135.db2.gz UUMSYCPYVZUADI-UHFFFAOYSA-N 0 0 355.213 3.657 20 5 FHBDRN CCOCCO[C@H](C)C(=O)N(Cc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000440594292 947353043 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COc1cc(C)ccc1CNC(=O)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000444996816 947409705 /nfs/dbraw/zinc/40/97/05/947409705.db2.gz MJVWGHBVQJYQLZ-UHFFFAOYSA-N 0 0 372.424 3.928 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2ncn(Cc3nc4ccccc4n3C(F)F)n2)cc1 ZINC000508515223 947410710 /nfs/dbraw/zinc/41/07/10/947410710.db2.gz YHCVZHVCOQFWLA-UHFFFAOYSA-N 0 0 370.319 3.646 20 5 FHBDRN O=C(c1ncccc1Oc1ccccc1)N1CCc2c1cccc2[N+](=O)[O-] ZINC000440630719 947412060 /nfs/dbraw/zinc/41/20/60/947412060.db2.gz RUTNOQURZMRJJW-UHFFFAOYSA-N 0 0 361.357 3.985 20 5 FHBDRN O=C(CCCOc1ccc(F)cc1)Nc1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000440627373 947412732 /nfs/dbraw/zinc/41/27/32/947412732.db2.gz QBXNOSCZQDSEHB-UHFFFAOYSA-N 0 0 369.352 3.502 20 5 FHBDRN C/C(=C/c1ccccc1Cl)C(=O)N1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000785325582 947415194 /nfs/dbraw/zinc/41/51/94/947415194.db2.gz DIWOTJSFRFBUQT-SEYXRHQNSA-N 0 0 374.828 3.712 20 5 FHBDRN C[C@@H](CCc1cccn1C)NC(=O)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000445007453 947429782 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COC(=O)[C@@H](C)[C@@H](NCc1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1 ZINC000152073946 947519121 /nfs/dbraw/zinc/51/91/21/947519121.db2.gz ZSZDTDUDXLLJAP-YVEFUNNKSA-N 0 0 362.813 3.888 20 5 FHBDRN COc1ccccc1[C@@H](C)N(C)C(=O)COc1cccc([N+](=O)[O-])c1C ZINC000053837868 947553852 /nfs/dbraw/zinc/55/38/52/947553852.db2.gz UNWZUEKOAIQWBF-CQSZACIVSA-N 0 0 358.394 3.510 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])c2cccnc12)Nc1ccc(Cl)cc1 ZINC000143777077 947554445 /nfs/dbraw/zinc/55/44/45/947554445.db2.gz NWDQXXSIXCEHDW-UHFFFAOYSA-N 0 0 357.753 3.814 20 5 FHBDRN C[C@@H]1CO[C@@H](C)CN1C(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 ZINC000120339756 947561610 /nfs/dbraw/zinc/56/16/10/947561610.db2.gz BQYSVHQBUBXPBF-KGLIPLIRSA-N 0 0 356.378 3.637 20 5 FHBDRN Cc1cc(NC(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)ccc1C1CC1 ZINC000445167090 947564356 /nfs/dbraw/zinc/56/43/56/947564356.db2.gz XSILTEKBEKEREW-UHFFFAOYSA-N 0 0 365.393 3.979 20 5 FHBDRN Cc1cc([N+](=O)[O-])cnc1N[C@@H]1CCC[C@@H](NC(=O)OC(C)(C)C)C1 ZINC000127732642 947564926 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Cc1cccc([N+](=O)[O-])c1C(=O)OCC(=O)Nc1cccc(Cl)c1C ZINC000026113231 947651461 /nfs/dbraw/zinc/65/14/61/947651461.db2.gz JRJHLAQYBPTFMW-UHFFFAOYSA-N 0 0 362.769 3.661 20 5 FHBDRN Cc1ccc(S(=O)(=O)N2CC3(CCC3)[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000432304416 947660444 /nfs/dbraw/zinc/66/04/44/947660444.db2.gz YWAOONAUKUSDGQ-SFHVURJKSA-N 0 0 372.446 3.819 20 5 FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)OCC1(SC)CCC1 ZINC000799690100 947667234 /nfs/dbraw/zinc/66/72/34/947667234.db2.gz AYGPKQMWGJGWNB-UHFFFAOYSA-N 0 0 371.480 3.776 20 5 FHBDRN CCc1ccc(NC(=O)[C@@H](C)OC(=O)c2c(C)cccc2[N+](=O)[O-])cc1 ZINC000026114614 947680384 /nfs/dbraw/zinc/68/03/84/947680384.db2.gz ZDFKKAPEWPBGKQ-CYBMUJFWSA-N 0 0 356.378 3.650 20 5 FHBDRN CSc1ccc(C(=O)Nc2ccc(OCC(C)C)nc2)cc1[N+](=O)[O-] ZINC000523888721 947690278 /nfs/dbraw/zinc/69/02/78/947690278.db2.gz VVBKUPWYJLUAEA-UHFFFAOYSA-N 0 0 361.423 3.999 20 5 FHBDRN Cn1c(C(=O)O[C@@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)cc2ccccc21 ZINC000759937126 947709024 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CCOc1ccc(C(=O)O[C@@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)cc1 ZINC000759939422 947743836 /nfs/dbraw/zinc/74/38/36/947743836.db2.gz MITSCPRRNZZVBN-JKSUJKDBSA-N 0 0 359.382 3.531 20 5 FHBDRN COc1cc2nc(NC(=O)c3ccc([N+](=O)[O-])c(C)c3)sc2cc1OC ZINC000021559100 947748283 /nfs/dbraw/zinc/74/82/83/947748283.db2.gz IPXMUUCBHOVEQF-UHFFFAOYSA-N 0 0 373.390 3.782 20 5 FHBDRN Cc1ccccc1CCC(=O)O[C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1 ZINC000759940094 947790750 /nfs/dbraw/zinc/79/07/50/947790750.db2.gz NWTSYPLIHFYJAY-DLBZAZTESA-N 0 0 357.410 3.759 20 5 FHBDRN O=C(NC[C@H]1CCCC1(F)F)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000459013476 947822839 /nfs/dbraw/zinc/82/28/39/947822839.db2.gz DNZSFKACWYKDLR-CYBMUJFWSA-N 0 0 353.369 3.704 20 5 FHBDRN Cc1ccc2c(COC(=O)c3ccc([N+](=O)[O-])cc3C)cc(=O)oc2c1C ZINC000725987796 947832133 /nfs/dbraw/zinc/83/21/33/947832133.db2.gz NJFJMVYITRCAFJ-UHFFFAOYSA-N 0 0 367.357 3.983 20 5 FHBDRN CC[C@@H]1CCN(Cn2nc(-c3ccc([N+](=O)[O-])cc3)n(CC)c2=S)C1 ZINC000162925969 947882086 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FHBDRN CCCNC(=O)c1cccc(CNc2ccnc3c2cccc3[N+](=O)[O-])c1 ZINC000432318636 947986510 /nfs/dbraw/zinc/98/65/10/947986510.db2.gz UEGFFGUHXNUEMB-UHFFFAOYSA-N 0 0 364.405 3.895 20 5 FHBDRN COc1cccc([C@@H]2C[C@H]2NC(=O)NC(C)(C)c2ccccc2[N+](=O)[O-])c1 ZINC000459057447 947992437 /nfs/dbraw/zinc/99/24/37/947992437.db2.gz YGWXAPHVGPJANI-DOTOQJQBSA-N 0 0 369.421 3.694 20 5 FHBDRN O=[N+]([O-])c1cccc2c(NC[C@H](CO)Cc3ccc(F)cc3)ccnc21 ZINC000432319701 948002025 /nfs/dbraw/zinc/00/20/25/948002025.db2.gz HUURLAMSQBUNBD-CQSZACIVSA-N 0 0 355.369 3.545 20 5 FHBDRN O=C(c1ccc(Cl)c([N+](=O)[O-])c1)N(Cc1ccco1)C[C@H]1CCCO1 ZINC000000741272 948005907 /nfs/dbraw/zinc/00/59/07/948005907.db2.gz LCZVCJNHVZDCEV-CQSZACIVSA-N 0 0 364.785 3.663 20 5 FHBDRN O=C(Nc1ccc(Br)c([N+](=O)[O-])c1)c1cccnc1Cl ZINC000094188528 948044096 /nfs/dbraw/zinc/04/40/96/948044096.db2.gz LPOWBCKFEFOBPD-UHFFFAOYSA-N 0 0 356.563 3.658 20 5 FHBDRN CC(=O)Nc1ccc(CCNc2ccnc3c2cccc3[N+](=O)[O-])cc1 ZINC000432322590 948044460 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FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@@H]1c1cccn1C ZINC000184657668 948095138 /nfs/dbraw/zinc/09/51/38/948095138.db2.gz CNHWOOZMJACSLA-QFBILLFUSA-N 0 0 355.438 3.866 20 5 FHBDRN COc1cccc(Cc2noc(Cc3ccc([N+](=O)[O-])cc3Cl)n2)c1 ZINC000546295542 948108325 /nfs/dbraw/zinc/10/83/25/948108325.db2.gz YLEIQNSAAQVMHX-UHFFFAOYSA-N 0 0 359.769 3.821 20 5 FHBDRN O=C1CCCN1Cc1ccc(CNc2c(Cl)cccc2[N+](=O)[O-])cc1 ZINC000432334023 948144563 /nfs/dbraw/zinc/14/45/63/948144563.db2.gz DWWUTQGDPWJESY-UHFFFAOYSA-N 0 0 359.813 3.983 20 5 FHBDRN CC(C)Oc1cncc(C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1 ZINC000129569815 948161546 /nfs/dbraw/zinc/16/15/46/948161546.db2.gz VORBQBHJGNJDRN-UHFFFAOYSA-N 0 0 355.394 3.582 20 5 FHBDRN C[C@@H](Sc1ccccn1)C(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000129563703 948161810 /nfs/dbraw/zinc/16/18/10/948161810.db2.gz CJCXFVZSWZSMLO-CYBMUJFWSA-N 0 0 357.435 3.662 20 5 FHBDRN Cc1nc(N2CCN(c3c(Cl)cccc3[N+](=O)[O-])CC2)sc1C ZINC000432342068 948164344 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C[C@@H](c1ccc(-n2cncn2)cc1)N(C)c1ccnc2c1cccc2[N+](=O)[O-] ZINC000432347548 948188867 /nfs/dbraw/zinc/18/88/67/948188867.db2.gz OPYKXQBZHBFLAD-AWEZNQCLSA-N 0 0 374.404 3.921 20 5 FHBDRN CCc1cc(N(CC)C[C@H]2CCCO2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000520512414 948194055 /nfs/dbraw/zinc/19/40/55/948194055.db2.gz RVRGASGAOSZZKI-QGZVFWFLSA-N 0 0 356.426 3.620 20 5 FHBDRN CCCN(CC)C(=O)c1ccc(C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC000512021425 948209261 /nfs/dbraw/zinc/20/92/61/948209261.db2.gz CNQFLEBMXNQSEF-UHFFFAOYSA-N 0 0 355.394 3.719 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])c2cccnc12)N1CC(Cc2ccsc2)C1 ZINC001167832350 948209806 /nfs/dbraw/zinc/20/98/06/948209806.db2.gz VEBFHRYOZPOVNN-UHFFFAOYSA-N 0 0 353.403 3.519 20 5 FHBDRN O=C(/C=C/c1cccc(F)c1)O[C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000759949035 948209945 /nfs/dbraw/zinc/20/99/45/948209945.db2.gz NLBSLBQIJJVCJC-GUFYHEMZSA-N 0 0 359.357 3.671 20 5 FHBDRN COc1ccc(C(=O)N2CCN(C3CC3)c3c(C)cccc32)cc1[N+](=O)[O-] ZINC000184712313 948247732 /nfs/dbraw/zinc/24/77/32/948247732.db2.gz MIZKXRGSCXPAKL-UHFFFAOYSA-N 0 0 367.405 3.541 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)[C@@H](C)Cn1ncc2ccccc21 ZINC000585736855 948248048 /nfs/dbraw/zinc/24/80/48/948248048.db2.gz RKMGWIJZOFHBSN-ZDUSSCGKSA-N 0 0 352.394 3.836 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1CCSC[C@H]1c1ccc(C)cc1 ZINC000427595609 948272927 /nfs/dbraw/zinc/27/29/27/948272927.db2.gz DWIPXLKNTORDSZ-KRWDZBQOSA-N 0 0 372.446 3.842 20 5 FHBDRN COC[C@@H](NC(=O)c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1)C1CC1 ZINC000441573993 948291639 /nfs/dbraw/zinc/29/16/39/948291639.db2.gz RNOWPVYEQVBHOH-GOSISDBHSA-N 0 0 372.446 3.901 20 5 FHBDRN COc1cc(N2CCC[C@@H]2[C@@H]2CCCC[C@@]2(C)O)c(F)cc1[N+](=O)[O-] ZINC000585788729 948295379 /nfs/dbraw/zinc/29/53/79/948295379.db2.gz KEWUPOGHHDMELK-WPKBUWHJSA-N 0 0 352.406 3.653 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)Nc1ccc2c(c1)OC(F)(F)O2 ZINC000019207832 948296084 /nfs/dbraw/zinc/29/60/84/948296084.db2.gz AULKLBSMZGSZIO-UHFFFAOYSA-N 0 0 368.317 3.647 20 5 FHBDRN CSc1ccc(C(=O)Nc2ccc3c(c2)OC(F)(F)O3)cc1[N+](=O)[O-] ZINC000019207909 948297247 /nfs/dbraw/zinc/29/72/47/948297247.db2.gz NPESCYUYEIJNDK-UHFFFAOYSA-N 0 0 368.317 3.891 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1C[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000184726670 948300744 /nfs/dbraw/zinc/30/07/44/948300744.db2.gz NWFJTLYVNHWPLV-GHMZBOCLSA-N 0 0 366.295 3.763 20 5 FHBDRN Cc1ccc([C@H]2C[C@H](C)N(S(=O)(=O)c3ccc(C)c([N+](=O)[O-])c3)C2)cc1 ZINC001211699414 948303452 /nfs/dbraw/zinc/30/34/52/948303452.db2.gz IPQFNSQRUVKTNI-RDJZCZTQSA-N 0 0 374.462 3.778 20 5 FHBDRN CC(C)Oc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)ccn1 ZINC000614592716 948311612 /nfs/dbraw/zinc/31/16/12/948311612.db2.gz QXCPPRVBAXXAAJ-UHFFFAOYSA-N 0 0 367.308 3.631 20 5 FHBDRN Cc1ccc(Sc2ccc(C(=O)N(C)[C@@H]3CCOC3)cc2[N+](=O)[O-])cc1 ZINC000106847074 948319460 /nfs/dbraw/zinc/31/94/60/948319460.db2.gz WTNNUAAFXBXPMJ-OAHLLOKOSA-N 0 0 372.446 3.915 20 5 FHBDRN O=C(Nc1cc(Cl)cc(F)c1F)c1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000441587108 948323130 /nfs/dbraw/zinc/32/31/30/948323130.db2.gz HGWKRLGRKIHKKB-UHFFFAOYSA-N 0 0 370.695 3.550 20 5 FHBDRN COc1cccc(COC(=O)c2ccc([N+](=O)[O-])cc2Cl)c1OC ZINC000006236723 948346491 /nfs/dbraw/zinc/34/64/91/948346491.db2.gz QOMUVBYDQCHFIN-UHFFFAOYSA-N 0 0 351.742 3.622 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@H]2CCc3ccc(F)cc32)c1 ZINC000106929438 948354951 /nfs/dbraw/zinc/35/49/51/948354951.db2.gz CKNRVWMOWJSCOE-INIZCTEOSA-N 0 0 358.369 3.615 20 5 FHBDRN CCN(CCNC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)c1cccc(C)c1 ZINC000512074206 948362946 /nfs/dbraw/zinc/36/29/46/948362946.db2.gz LPVYIIYTODARPD-UHFFFAOYSA-N 0 0 366.421 3.641 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(-c2nc(COc3ccc(OC)cc3)no2)c1 ZINC000574720751 948374524 /nfs/dbraw/zinc/37/45/24/948374524.db2.gz CWTBJTCPHXODGL-UHFFFAOYSA-N 0 0 371.349 3.631 20 5 FHBDRN CC(=O)CCC(C)(C)C(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000427601421 948375630 /nfs/dbraw/zinc/37/56/30/948375630.db2.gz YZAPBXRFYUFVJB-UHFFFAOYSA-N 0 0 360.332 3.625 20 5 FHBDRN Cn1cc(CNc2cnc3c(c2)CCCC3)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000574717555 948383268 /nfs/dbraw/zinc/38/32/68/948383268.db2.gz MSXKLFUYYQUHSK-UHFFFAOYSA-N 0 0 363.421 3.881 20 5 FHBDRN COc1ccc(NC(=O)N2CC[C@@](C)(c3ccc(F)cc3)C2)cc1[N+](=O)[O-] ZINC000432432629 948404319 /nfs/dbraw/zinc/40/43/19/948404319.db2.gz SLASDVVBKGTBBL-LJQANCHMSA-N 0 0 373.384 3.938 20 5 FHBDRN C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)[C@@H](C)CN1C ZINC000512101888 948418581 /nfs/dbraw/zinc/41/85/81/948418581.db2.gz VTRKPMVQFRRXRA-GJZGRUSLSA-N 0 0 369.421 3.552 20 5 FHBDRN COC(=O)COc1ccc(CNc2ccc(Cl)cc2C)cc1[N+](=O)[O-] ZINC000473999620 948430256 /nfs/dbraw/zinc/43/02/56/948430256.db2.gz FXZAAIKUCCXPIF-UHFFFAOYSA-N 0 0 364.785 3.721 20 5 FHBDRN C[C@@H](Nc1ncnc2sc([N+](=O)[O-])cc21)c1ccc(-n2cccn2)cc1 ZINC000520629517 948441946 /nfs/dbraw/zinc/44/19/46/948441946.db2.gz PEUKDGZDJFLSQK-LLVKDONJSA-N 0 0 366.406 3.958 20 5 FHBDRN Cc1c(NC(=O)C2CCC(NC(=O)C(C)(C)C)CC2)cccc1[N+](=O)[O-] ZINC000279059671 948447312 /nfs/dbraw/zinc/44/73/12/948447312.db2.gz SDDKLSHSKVMRHY-UHFFFAOYSA-N 0 0 361.442 3.563 20 5 FHBDRN CC1(C)C[C@@H](Nc2cccc(N3CCNC3=O)c2)c2cc([N+](=O)[O-])ccc21 ZINC000279062218 948455031 /nfs/dbraw/zinc/45/50/31/948455031.db2.gz KYIWYFGRKKMJOT-GOSISDBHSA-N 0 0 366.421 3.959 20 5 FHBDRN Cc1nc(-c2cccc(C(=O)NCCc3cccc([N+](=O)[O-])c3)c2)cs1 ZINC000125987662 948455234 /nfs/dbraw/zinc/45/52/34/948455234.db2.gz YVARPKXZBABTDV-UHFFFAOYSA-N 0 0 367.430 3.999 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)N(CC(C)C)CC(C)(C)C ZINC000441655706 948473364 /nfs/dbraw/zinc/47/33/64/948473364.db2.gz LQASMXILWLQHAA-UHFFFAOYSA-N 0 0 363.458 3.681 20 5 FHBDRN CCC(CC)c1cc(CNC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)on1 ZINC000087125883 948475385 /nfs/dbraw/zinc/47/53/85/948475385.db2.gz FGPRHIYMERGNRU-UHFFFAOYSA-N 0 0 372.425 3.754 20 5 FHBDRN Cc1ccccc1C1(CNC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)CC1 ZINC000512122557 948479273 /nfs/dbraw/zinc/47/92/73/948479273.db2.gz 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ZINC000452876790 567875468 /nfs/dbraw/zinc/87/54/68/567875468.db2.gz LURDMWUGKKPYSD-OAHLLOKOSA-N 0 0 358.369 3.519 20 5 FHBDRN COc1cc(C(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)ccc1C ZINC000452878876 567875493 /nfs/dbraw/zinc/87/54/93/567875493.db2.gz MSHYZYRORVBBPH-KRWDZBQOSA-N 0 0 354.406 3.932 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)Nc1cnn(C)c1-c1ccccc1 ZINC000481391694 567883147 /nfs/dbraw/zinc/88/31/47/567883147.db2.gz MSARNUOLFHUCFZ-UHFFFAOYSA-N 0 0 351.366 3.948 20 5 FHBDRN COc1ccc(CC(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000452888058 567897125 /nfs/dbraw/zinc/89/71/25/567897125.db2.gz SDWKIBXFWXREEX-QGZVFWFLSA-N 0 0 354.406 3.552 20 5 FHBDRN CC[C@@H](c1ccncc1)N(C)C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000128534676 567901056 /nfs/dbraw/zinc/90/10/56/567901056.db2.gz UGAYZLXYPQKUOI-KRWDZBQOSA-N 0 0 354.410 3.787 20 5 FHBDRN CCCN1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2)c2ccc(F)cc21 ZINC000481408279 567903487 /nfs/dbraw/zinc/90/34/87/567903487.db2.gz 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O=C(NC[C@H]1CCN(c2ccccc2)C1)c1cc([N+](=O)[O-])ccc1Cl ZINC000264971939 567941064 /nfs/dbraw/zinc/94/10/64/567941064.db2.gz ZDGRIMNLFJVLDE-CYBMUJFWSA-N 0 0 359.813 3.505 20 5 FHBDRN CC(C)CC(=O)N1CCC(Nc2ccc([N+](=O)[O-])c3cccnc23)CC1 ZINC000264976058 567941785 /nfs/dbraw/zinc/94/17/85/567941785.db2.gz ZYZJYKIIPKTQOM-UHFFFAOYSA-N 0 0 356.426 3.592 20 5 FHBDRN Cc1ccc(C(=O)N2CCS[C@H]2c2ccc([N+](=O)[O-])cc2)c(O)c1C ZINC000436588137 567947034 /nfs/dbraw/zinc/94/70/34/567947034.db2.gz HFXHTDVJRPZZEK-SFHVURJKSA-N 0 0 358.419 3.805 20 5 FHBDRN Cc1cccc2c(CCNC(=O)Cc3ccc([N+](=O)[O-])cc3Cl)c[nH]c21 ZINC000128544233 567953851 /nfs/dbraw/zinc/95/38/51/567953851.db2.gz FPTSZZOVJFWDCY-UHFFFAOYSA-N 0 0 371.824 3.939 20 5 FHBDRN CSc1ccc(C(=O)Nc2cccc(-c3nnco3)c2)cc1[N+](=O)[O-] ZINC000024697550 567967720 /nfs/dbraw/zinc/96/77/20/567967720.db2.gz MXRZMROLRDVSER-UHFFFAOYSA-N 0 0 356.363 3.619 20 5 FHBDRN Cc1cc(OC(F)F)c(C(=O)NCc2cccc([N+](=O)[O-])c2C)s1 ZINC000481473612 567972225 /nfs/dbraw/zinc/97/22/25/567972225.db2.gz HXGKJMHGZJLCTD-UHFFFAOYSA-N 0 0 356.350 3.805 20 5 FHBDRN O=C(Nc1cc(Cl)cc2cccnc21)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000541852065 567979022 /nfs/dbraw/zinc/97/90/22/567979022.db2.gz JJUDXWOZIUNIDN-UHFFFAOYSA-N 0 0 371.736 3.777 20 5 FHBDRN Cc1cc(Br)ccc1C(=O)NCc1cccc([N+](=O)[O-])c1C ZINC000481475366 567979837 /nfs/dbraw/zinc/97/98/37/567979837.db2.gz CTYYGYSLAQTLMC-UHFFFAOYSA-N 0 0 363.211 3.904 20 5 FHBDRN CC[C@H](C)n1ncc(C(=O)NCc2cccc([N+](=O)[O-])c2C)c1C1CC1 ZINC000481484337 567986712 /nfs/dbraw/zinc/98/67/12/567986712.db2.gz WIKRRNZZAXAITE-LBPRGKRZSA-N 0 0 356.426 3.878 20 5 FHBDRN COc1cc(C(=O)NCc2cccc([N+](=O)[O-])c2C)ccc1OC(C)C ZINC000481487584 567988054 /nfs/dbraw/zinc/98/80/54/567988054.db2.gz CCTDGNYVELTBJO-UHFFFAOYSA-N 0 0 358.394 3.629 20 5 FHBDRN O=C(c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)N1CCC[C@@H]1c1ccccc1 ZINC000521423337 567995517 /nfs/dbraw/zinc/99/55/17/567995517.db2.gz NPGABNHSZYCNRQ-LJQANCHMSA-N 0 0 362.389 3.758 20 5 FHBDRN CCc1c(C(=O)NCc2cccc([N+](=O)[O-])c2C)cnn1C1CCCC1 ZINC000481499094 567997186 /nfs/dbraw/zinc/99/71/86/567997186.db2.gz BNGOMSLXGOWNCS-UHFFFAOYSA-N 0 0 356.426 3.707 20 5 FHBDRN CSC1CCN(C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC1 ZINC000602933649 568020232 /nfs/dbraw/zinc/02/02/32/568020232.db2.gz YFRKVIRTKNBCAF-UHFFFAOYSA-N 0 0 363.361 3.973 20 5 FHBDRN C[C@@H]1CCC[C@H](N(C)C(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000568341541 568026409 /nfs/dbraw/zinc/02/64/09/568026409.db2.gz SEBOIMODGBALPH-HIFRSBDPSA-N 0 0 358.442 3.839 20 5 FHBDRN Cn1nc(NC(=O)Nc2ccc(C(C)(C)C)c([N+](=O)[O-])c2)cc1C1CC1 ZINC000568449483 568039227 /nfs/dbraw/zinc/03/92/27/568039227.db2.gz HYJWLCXZAUMIPM-UHFFFAOYSA-N 0 0 357.414 3.569 20 5 FHBDRN CCN1CCc2ccc(NC(=O)Cc3c[nH]c4ccc([N+](=O)[O-])cc34)cc21 ZINC000128575551 568042707 /nfs/dbraw/zinc/04/27/07/568042707.db2.gz UAMPPOAYOQTSHS-UHFFFAOYSA-N 0 0 364.405 3.640 20 5 FHBDRN CC(C)(CCc1noc(-c2ccc(OCc3ccccc3)nc2)n1)[N+](=O)[O-] ZINC000291101782 568049310 /nfs/dbraw/zinc/04/93/10/568049310.db2.gz RIONDSHUERWEPY-UHFFFAOYSA-N 0 0 368.393 3.699 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)CCc1ccc2[nH]ccc2c1 ZINC000568544141 568049915 /nfs/dbraw/zinc/04/99/15/568049915.db2.gz XCDOIVHBSURYOB-UHFFFAOYSA-N 0 0 351.406 3.710 20 5 FHBDRN Cn1cncc1CNC(=O)c1cc([N+](=O)[O-])ccc1SCC1CCCC1 ZINC000291095010 568050618 /nfs/dbraw/zinc/05/06/18/568050618.db2.gz AXBAOGKECWAUQU-UHFFFAOYSA-N 0 0 374.466 3.541 20 5 FHBDRN Cc1nc(CCCC(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)cs1 ZINC000568556347 568050983 /nfs/dbraw/zinc/05/09/83/568050983.db2.gz QZHXOVLIAWWIAR-UHFFFAOYSA-N 0 0 372.450 3.523 20 5 FHBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCCC[C@@H]2c2ccccc2)c(F)c1 ZINC000568573559 568058485 /nfs/dbraw/zinc/05/84/85/568058485.db2.gz CJMNEQRNIJCLHS-MRXNPFEDSA-N 0 0 364.398 3.650 20 5 FHBDRN COC(=O)c1cc(NC(=O)c2cc(C)cc([N+](=O)[O-])c2)cc(Cl)c1F ZINC000481580235 568058732 /nfs/dbraw/zinc/05/87/32/568058732.db2.gz RSUKYLSZDYAVIK-UHFFFAOYSA-N 0 0 366.732 3.735 20 5 FHBDRN C[C@@H](CNC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1)Oc1ccc(Cl)cc1 ZINC000568579515 568059141 /nfs/dbraw/zinc/05/91/41/568059141.db2.gz OXJQZGGORFAIHH-STQMWFEESA-N 0 0 362.813 3.935 20 5 FHBDRN O=C(NC[C@H]1CCO[C@@H]1c1ccccc1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000481588133 568063398 /nfs/dbraw/zinc/06/33/98/568063398.db2.gz NGAMDDIQCWVFAR-CXAGYDPISA-N 0 0 360.797 3.756 20 5 FHBDRN COc1cc(C(=O)NCCCO[C@H](C)c2ccccc2)ccc1[N+](=O)[O-] ZINC000159243780 568064267 /nfs/dbraw/zinc/06/42/67/568064267.db2.gz QLSXCJALCCIHQE-CQSZACIVSA-N 0 0 358.394 3.501 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)Nc1cc(Cl)ccc1-n1cccn1 ZINC000128598067 568066883 /nfs/dbraw/zinc/06/68/83/568066883.db2.gz LCKZGCHOUHSCJV-UHFFFAOYSA-N 0 0 372.768 3.695 20 5 FHBDRN O=C(NC[C@H]1CCC2(CCCCC2)O1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000481635651 568074500 /nfs/dbraw/zinc/07/45/00/568074500.db2.gz IWWJXCBQFQJBAB-OAHLLOKOSA-N 0 0 352.818 3.860 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)N[C@H]1C[C@@H]1c1cccc(F)c1 ZINC000067333986 568077123 /nfs/dbraw/zinc/07/71/23/568077123.db2.gz QDXTYLNKGXGQEW-MSOLQXFVSA-N 0 0 357.385 3.598 20 5 FHBDRN Cc1c(CS(=O)(=O)Cc2cccc(OC(F)F)c2)cccc1[N+](=O)[O-] ZINC000051554086 568079798 /nfs/dbraw/zinc/07/97/98/568079798.db2.gz QEXBXUMWFOSANR-UHFFFAOYSA-N 0 0 371.361 3.620 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(N(C)CC(=O)Nc2ccc(Cl)c(Cl)c2)n1 ZINC000481676120 568085017 /nfs/dbraw/zinc/08/50/17/568085017.db2.gz MUKJOMIKBZIACS-UHFFFAOYSA-N 0 0 369.208 3.680 20 5 FHBDRN COCCCCc1cccnc1NC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000291248775 568087587 /nfs/dbraw/zinc/08/75/87/568087587.db2.gz LVEKVUQEYWRKCB-UHFFFAOYSA-N 0 0 368.393 3.693 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(Nc2ccc3c(c2)N(C(=O)C(C)(C)C)CCO3)n1 ZINC000481686636 568088945 /nfs/dbraw/zinc/08/89/45/568088945.db2.gz JDZZZFVWZANWKN-UHFFFAOYSA-N 0 0 370.409 3.813 20 5 FHBDRN Cn1cc([C@H](NC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C(C)(C)C)cn1 ZINC000481705817 568090732 /nfs/dbraw/zinc/09/07/32/568090732.db2.gz WDJXDSBBLPIXQV-AWEZNQCLSA-N 0 0 365.821 3.891 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(NCc2cccc(NC(=O)c3ccccn3)c2)n1 ZINC000481701492 568092435 /nfs/dbraw/zinc/09/24/35/568092435.db2.gz LLXJBPCYCLSHHS-UHFFFAOYSA-N 0 0 363.377 3.558 20 5 FHBDRN CCn1nc(C)c([N+](=O)[O-])c1N1CCC(c2noc3cc(F)ccc32)CC1 ZINC000291267656 568093305 /nfs/dbraw/zinc/09/33/05/568093305.db2.gz ZNHINUXMRGPXIR-UHFFFAOYSA-N 0 0 373.388 3.784 20 5 FHBDRN Cc1ccccc1CNc1ccccc1NC(=O)c1cc([N+](=O)[O-])nn1C ZINC000481715086 568093805 /nfs/dbraw/zinc/09/38/05/568093805.db2.gz WHRCOIKSOMLXBH-UHFFFAOYSA-N 0 0 365.393 3.501 20 5 FHBDRN Cc1cnc(OCC(=O)N[C@@H](C)c2ccc(CC(C)C)cc2)c([N+](=O)[O-])c1 ZINC000481737508 568099647 /nfs/dbraw/zinc/09/96/47/568099647.db2.gz OZEPQVXIHVIMEX-HNNXBMFYSA-N 0 0 371.437 3.753 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2ncn(C[C@@H](O)Cc3ccc4ccccc4c3)n2)cc1 ZINC000481735243 568100033 /nfs/dbraw/zinc/10/00/33/568100033.db2.gz YJWMTHQIETZSGM-FQEVSTJZSA-N 0 0 374.400 3.610 20 5 FHBDRN C[C@@H](CNC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1 ZINC000049581592 568108631 /nfs/dbraw/zinc/10/86/31/568108631.db2.gz WVZRZWZBJPEINE-QWHCGFSZSA-N 0 0 362.813 3.935 20 5 FHBDRN C[C@@]1(NC(=O)c2cc(Cl)cc(Cl)c2[N+](=O)[O-])CCO[C@@H]1C1CC1 ZINC000291344409 568121073 /nfs/dbraw/zinc/12/10/73/568121073.db2.gz ABDFOPKFYKPHDJ-UKRRQHHQSA-N 0 0 359.209 3.589 20 5 FHBDRN CC[C@H](Oc1ccccc1F)C(=O)N1c2ccc([N+](=O)[O-])cc2C[C@@H]1C ZINC000481773980 568122992 /nfs/dbraw/zinc/12/29/92/568122992.db2.gz CMYQYDKFOMNXFE-SJCJKPOMSA-N 0 0 358.369 3.869 20 5 FHBDRN C[C@@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)c1cc([N+](=O)[O-])nn1C ZINC000481803829 568128975 /nfs/dbraw/zinc/12/89/75/568128975.db2.gz XCQXQTCZDLILQM-AWEZNQCLSA-N 0 0 364.405 3.829 20 5 FHBDRN C[C@@H]1CN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)c2cccc(F)c2O1 ZINC000481821904 568134808 /nfs/dbraw/zinc/13/48/08/568134808.db2.gz GEZYFZUMYOIXAV-LLVKDONJSA-N 0 0 370.340 3.571 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(NC(=O)C2CC2)cc1 ZINC000291423518 568137589 /nfs/dbraw/zinc/13/75/89/568137589.db2.gz KVTLJGRSYBGBOF-UHFFFAOYSA-N 0 0 353.378 3.758 20 5 FHBDRN Cn1nc([N+](=O)[O-])cc1C(=O)Nc1cccc(-c2ccc3ccccc3c2)n1 ZINC000481872586 568139035 /nfs/dbraw/zinc/13/90/35/568139035.db2.gz ULKMFDRKHSTANZ-UHFFFAOYSA-N 0 0 373.372 3.796 20 5 FHBDRN Cc1c(CN2CCN(Cc3cccc(Cl)c3)CC2)cccc1[N+](=O)[O-] ZINC000603836530 568159500 /nfs/dbraw/zinc/15/95/00/568159500.db2.gz AANNNDQZAIWXRO-UHFFFAOYSA-N 0 0 359.857 3.874 20 5 FHBDRN COc1cc(C(=O)N(C)[C@H]2CCCC[C@H]2C(F)(F)F)ccc1[N+](=O)[O-] ZINC000291443842 568159983 /nfs/dbraw/zinc/15/99/83/568159983.db2.gz BPMKFGWGHYOWBU-NEPJUHHUSA-N 0 0 360.332 3.797 20 5 FHBDRN CN(CC(=O)NCc1ccc(Cl)cc1Cl)c1ccccc1[N+](=O)[O-] ZINC000463241978 568180893 /nfs/dbraw/zinc/18/08/93/568180893.db2.gz FFXKSGQURAYKNT-UHFFFAOYSA-N 0 0 368.220 3.654 20 5 FHBDRN COCCCCc1cccnc1NC(=O)/C=C/c1ccc([N+](=O)[O-])cc1 ZINC000291506081 568181988 /nfs/dbraw/zinc/18/19/88/568181988.db2.gz WKECXVDBURBILB-FMIVXFBMSA-N 0 0 355.394 3.611 20 5 FHBDRN O=C(N[C@H](c1ccccc1)C(F)F)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000481942188 568195072 /nfs/dbraw/zinc/19/50/72/568195072.db2.gz JNKPZJFUBSAFQR-MRXNPFEDSA-N 0 0 373.315 3.585 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@H](c2ccccc2)C(F)F)c1 ZINC000481944810 568195191 /nfs/dbraw/zinc/19/51/91/568195191.db2.gz RQGHMJFZORYSFZ-QGZVFWFLSA-N 0 0 364.348 3.795 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N(C)[C@@H](C)c1ccc(F)cc1 ZINC000481959216 568196950 /nfs/dbraw/zinc/19/69/50/568196950.db2.gz ADZHNJWVAYNSAO-ZDUSSCGKSA-N 0 0 366.414 3.732 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N1CCC[C@H]1c1ccsc1 ZINC000481978766 568211485 /nfs/dbraw/zinc/21/14/85/568211485.db2.gz FUUGWUDIVYDUDR-HNNXBMFYSA-N 0 0 366.464 3.799 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N(C)[C@H](C)c1ccccc1F ZINC000481975488 568212800 /nfs/dbraw/zinc/21/28/00/568212800.db2.gz GNQKMGJJCRKJKI-CYBMUJFWSA-N 0 0 366.414 3.732 20 5 FHBDRN O=C(Nc1ccncc1[N+](=O)[O-])N[C@@H](Cc1ccccc1)c1ccccc1 ZINC000541906797 568216140 /nfs/dbraw/zinc/21/61/40/568216140.db2.gz WPFWXCXIQDJZDZ-SFHVURJKSA-N 0 0 362.389 3.517 20 5 FHBDRN CCn1c(C)nc([N+](=O)[O-])c1N1CC[C@](F)(c2cc(C)cc(F)c2)C1 ZINC000568793246 568219471 /nfs/dbraw/zinc/21/94/71/568219471.db2.gz DDTPRKSVEJKPRA-QGZVFWFLSA-N 0 0 350.369 3.642 20 5 FHBDRN COc1cccc([C@H](C)C(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)c1 ZINC000568795508 568222013 /nfs/dbraw/zinc/22/20/13/568222013.db2.gz RIGDVQXXNBUCMC-ZDUSSCGKSA-N 0 0 367.405 3.547 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N1CCC[C@@H]1[C@@H]1C[C@@H](C)CC[C@@H]1O ZINC000408262797 568223405 /nfs/dbraw/zinc/22/34/05/568223405.db2.gz ZQVQQPLABJIPDC-BIMQEMHKSA-N 0 0 374.481 3.922 20 5 FHBDRN COc1cc(N[C@H]2CCO[C@H]2c2ccc(F)c(F)c2)c(F)cc1[N+](=O)[O-] ZINC000302034736 568227052 /nfs/dbraw/zinc/22/70/52/568227052.db2.gz UEASJYSKDUUIMX-GUYCJALGSA-N 0 0 368.311 3.963 20 5 FHBDRN COCOc1ccc(OC)cc1CNC(C)(C)c1ccccc1[N+](=O)[O-] ZINC000291646811 568240696 /nfs/dbraw/zinc/24/06/96/568240696.db2.gz CHFITWSJHJPBQD-UHFFFAOYSA-N 0 0 360.410 3.611 20 5 FHBDRN C[C@@H](CNC(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1)CC(F)(F)F ZINC000412652926 568246977 /nfs/dbraw/zinc/24/69/77/568246977.db2.gz JJISBQJNDWPNST-ZJUUUORDSA-N 0 0 350.362 3.780 20 5 FHBDRN Cn1ccnc1[C@@H](NCCCc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000568910297 568251941 /nfs/dbraw/zinc/25/19/41/568251941.db2.gz OZAOAUOGVUKWSU-IBGZPJMESA-N 0 0 350.422 3.640 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(N[C@H](C)c2noc(Cc3ccccc3)n2)n1 ZINC000541933748 568252316 /nfs/dbraw/zinc/25/23/16/568252316.db2.gz SNSXCFSHGIKICZ-CYBMUJFWSA-N 0 0 353.382 3.754 20 5 FHBDRN COc1ccc(OC)c([C@H]2CCCN2C(=O)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC000015827708 568252602 /nfs/dbraw/zinc/25/26/02/568252602.db2.gz LWLJIZPVDGXKDW-GOSISDBHSA-N 0 0 370.405 3.518 20 5 FHBDRN O=C(Nc1ccncc1[N+](=O)[O-])N1CCC[C@H](CCCc2ccccc2)C1 ZINC000541924829 568252880 /nfs/dbraw/zinc/25/28/80/568252880.db2.gz MZXTWNBVGHGJAL-KRWDZBQOSA-N 0 0 368.437 3.679 20 5 FHBDRN Cc1cc(NC(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)n(-c2ccccc2)n1 ZINC000568944042 568254319 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ZINC000120393823 568279021 /nfs/dbraw/zinc/27/90/21/568279021.db2.gz GGYRYECVKIXMQV-UHFFFAOYSA-N 0 0 364.448 3.594 20 5 FHBDRN COc1ccc(C(=O)Nc2nc(-c3ccccc3F)co2)cc1[N+](=O)[O-] ZINC000482121030 568280675 /nfs/dbraw/zinc/28/06/75/568280675.db2.gz CEEXRIFFBZVXSC-UHFFFAOYSA-N 0 0 357.297 3.650 20 5 FHBDRN Cc1cccc2c(CCNC(=O)CCOc3ccccc3[N+](=O)[O-])c[nH]c21 ZINC000128774714 568295930 /nfs/dbraw/zinc/29/59/30/568295930.db2.gz BQTKUOUVKLMLEK-UHFFFAOYSA-N 0 0 367.405 3.512 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1)N1CCCn2c(cc3ccccc32)C1 ZINC000569155247 568299795 /nfs/dbraw/zinc/29/97/95/568299795.db2.gz BGRJKQJXTKCHBG-UHFFFAOYSA-N 0 0 350.378 3.987 20 5 FHBDRN CCS(=O)(=O)c1ccc2oc(/C=C/c3ccc([N+](=O)[O-])cc3)nc2c1 ZINC000008321075 568300767 /nfs/dbraw/zinc/30/07/67/568300767.db2.gz VSEMHWSHVKJZDX-BJMVGYQFSA-N 0 0 358.375 3.700 20 5 FHBDRN CC(=O)c1cc(N2CCC(c3noc(C(C)C)n3)CC2)ccc1[N+](=O)[O-] ZINC000291769767 568304440 /nfs/dbraw/zinc/30/44/40/568304440.db2.gz BSACCQLUYCFNNF-UHFFFAOYSA-N 0 0 358.398 3.688 20 5 FHBDRN Cc1cc(SCc2ccc([N+](=O)[O-])cc2)n2nc(C(F)(F)F)nc2n1 ZINC000159436114 568305612 /nfs/dbraw/zinc/30/56/12/568305612.db2.gz SWOGHLANBAZNIJ-UHFFFAOYSA-N 0 0 369.328 3.652 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(OCC(=O)Nc2cc(Cl)ccc2Cl)n1 ZINC000541984763 568311331 /nfs/dbraw/zinc/31/13/31/568311331.db2.gz OESRLLFQMYOJTE-UHFFFAOYSA-N 0 0 370.192 3.931 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N1CCC[C@H]1c1ccc2c(c1)OCCO2 ZINC000604562646 568311725 /nfs/dbraw/zinc/31/17/25/568311725.db2.gz BSXKNLSXHGTQAD-KRWDZBQOSA-N 0 0 368.389 3.652 20 5 FHBDRN CC[C@H](C)Oc1cc(CNc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)ccn1 ZINC000302035090 568319018 /nfs/dbraw/zinc/31/90/18/568319018.db2.gz LPZQRTMUYTYFOM-LBPRGKRZSA-N 0 0 370.409 3.664 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N(CC)[C@@H]1CCOC(C)(C)C1 ZINC000569275222 568325922 /nfs/dbraw/zinc/32/59/22/568325922.db2.gz DBPRDFWSNOZSTO-CQSZACIVSA-N 0 0 365.430 3.805 20 5 FHBDRN CC[C@H]1CCCN(C(=O)c2ccc(Cn3nc(C)c([N+](=O)[O-])c3C)cc2)C1 ZINC000031682007 568339033 /nfs/dbraw/zinc/33/90/33/568339033.db2.gz UCQBSQXQHYZORQ-INIZCTEOSA-N 0 0 370.453 3.719 20 5 FHBDRN COC(=O)c1ccc(Cl)c(NC(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000569301495 568346299 /nfs/dbraw/zinc/34/62/99/568346299.db2.gz LQZUNCOWDGKTAJ-JTQLQIEISA-N 0 0 362.769 3.777 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1CSc1nncn1-c1ccccc1F ZINC000569302339 568350495 /nfs/dbraw/zinc/35/04/95/568350495.db2.gz UEYIGQQKQIDUFE-UHFFFAOYSA-N 0 0 360.370 3.616 20 5 FHBDRN O=C(c1cc([O-])cc([N+](=O)[O-])c1)N1C[C@@H](c2ccccc2)C2(CCC2)C1 ZINC000412674779 568371746 /nfs/dbraw/zinc/37/17/46/568371746.db2.gz NQMZKTWWBKVFOA-SFHVURJKSA-N 0 0 352.390 3.710 20 5 FHBDRN CS[C@H]1CCC[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000181995550 568371760 /nfs/dbraw/zinc/37/17/60/568371760.db2.gz BZQJGAITJZLUJY-KOLCDFICSA-N 0 0 360.382 3.600 20 5 FHBDRN CC(C)(C)c1csc(C2CCN(C(=O)c3ccc([N+](=O)[O-])[nH]3)CC2)n1 ZINC000265100599 568376003 /nfs/dbraw/zinc/37/60/03/568376003.db2.gz HFDPEQNBRCNWMY-UHFFFAOYSA-N 0 0 362.455 3.697 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)c1ccc2c(c1)COC2 ZINC000541996915 568387265 /nfs/dbraw/zinc/38/72/65/568387265.db2.gz BOHWEALGQGULLW-UHFFFAOYSA-N 0 0 352.268 3.896 20 5 FHBDRN C[C@@H]1CCN(S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])c2ccccc21 ZINC000032444334 568390559 /nfs/dbraw/zinc/39/05/59/568390559.db2.gz IYHWFVHSFGKYIK-LLVKDONJSA-N 0 0 366.826 3.951 20 5 FHBDRN COc1ccc(CCCC(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)c(OC)c1 ZINC000541998599 568392175 /nfs/dbraw/zinc/39/21/75/568392175.db2.gz JRMQFUXDIFLAOC-UHFFFAOYSA-N 0 0 374.393 3.582 20 5 FHBDRN COC(=O)c1ccc(CNc2ccc(Br)cc2[N+](=O)[O-])cc1 ZINC000315563604 568393044 /nfs/dbraw/zinc/39/30/44/568393044.db2.gz OODPJNIHJWEUBC-UHFFFAOYSA-N 0 0 365.183 3.756 20 5 FHBDRN Cc1c(C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)cnn1-c1ccc(F)cc1F ZINC000032644136 568395350 /nfs/dbraw/zinc/39/53/50/568395350.db2.gz BNXZFWXMEYPHHN-UHFFFAOYSA-N 0 0 372.331 3.928 20 5 FHBDRN C[C@H]1CCCN(c2ccc(C(=O)NCCc3ccccc3)cc2[N+](=O)[O-])C1 ZINC000006124603 568395884 /nfs/dbraw/zinc/39/58/84/568395884.db2.gz UMNPDCNTNKACGV-INIZCTEOSA-N 0 0 367.449 3.804 20 5 FHBDRN Cc1ccn2cc(C(=O)Nc3ccc([N+](=O)[O-])c(C(F)(F)F)c3)nc2c1 ZINC000541997947 568397193 /nfs/dbraw/zinc/39/71/93/568397193.db2.gz CMHBGGGWZGBXGV-UHFFFAOYSA-N 0 0 364.283 3.822 20 5 FHBDRN C[C@H](CCc1ccccc1[N+](=O)[O-])Nc1ccc(Cn2ccnc2)cn1 ZINC000569411077 568401204 /nfs/dbraw/zinc/40/12/04/568401204.db2.gz UXDBPCGLOAPQDT-OAHLLOKOSA-N 0 0 351.410 3.668 20 5 FHBDRN C[C@H](Oc1ccc(Cl)cc1)c1nc(Cc2ccc([N+](=O)[O-])cn2)no1 ZINC000569408840 568401210 /nfs/dbraw/zinc/40/12/10/568401210.db2.gz ALHYHAPXOYLZCB-JTQLQIEISA-N 0 0 360.757 3.757 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])N1C[C@H](c2ccccc2)[C@H]2CCC[C@H]21 ZINC000569484189 568403257 /nfs/dbraw/zinc/40/32/57/568403257.db2.gz CONDUDQFDHAHIE-QWFCFKBJSA-N 0 0 350.418 3.932 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N[C@H]2CCc3sc(Cl)cc32)c1[N+](=O)[O-] ZINC000569537996 568406586 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Cc1cc(N[C@H]2CCCN([C@H](C)c3ccc(F)cc3)C2=O)ncc1[N+](=O)[O-] ZINC000569749761 568429500 /nfs/dbraw/zinc/42/95/00/568429500.db2.gz MOEXZOFWZTUOMK-CJNGLKHVSA-N 0 0 372.400 3.601 20 5 FHBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H](OC(F)F)C1 ZINC000569749947 568429701 /nfs/dbraw/zinc/42/97/01/568429701.db2.gz OGXBFNIFYIBLCK-LBPRGKRZSA-N 0 0 374.409 3.797 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H](CC(=O)N(C)C)c1ccccc1 ZINC000569877029 568432994 /nfs/dbraw/zinc/43/29/94/568432994.db2.gz IZRFKUCKYUENAB-HNAYVOBHSA-N 0 0 355.438 3.773 20 5 FHBDRN CO[C@H](C)CN(C)C(=O)c1ccc(SCCC(C)C)c([N+](=O)[O-])c1 ZINC000570031833 568441982 /nfs/dbraw/zinc/44/19/82/568441982.db2.gz NEQXRFQGKVJWDX-CYBMUJFWSA-N 0 0 354.472 3.840 20 5 FHBDRN Cc1ccc(C(=O)Nc2cc(-c3ccc(F)cc3F)nn2C)cc1[N+](=O)[O-] ZINC000570126824 568453034 /nfs/dbraw/zinc/45/30/34/568453034.db2.gz NBJIOSBIOWNUAT-UHFFFAOYSA-N 0 0 372.331 3.834 20 5 FHBDRN C[C@@H](CCc1ccco1)NC(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000570072749 568456582 /nfs/dbraw/zinc/45/65/82/568456582.db2.gz HNKYVELDALOTQQ-ZDUSSCGKSA-N 0 0 370.409 3.532 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]cc(Cc3noc(COc4ccsc4)n3)c2c1 ZINC000570244514 568466058 /nfs/dbraw/zinc/46/60/58/568466058.db2.gz AWRRLIKGWGVAOX-UHFFFAOYSA-N 0 0 356.363 3.690 20 5 FHBDRN Cc1cc(N(C)C)ccc1-c1noc(CCc2cccc([N+](=O)[O-])c2)n1 ZINC000570327685 568469946 /nfs/dbraw/zinc/46/99/46/568469946.db2.gz OPFRPSRAGQOVGC-UHFFFAOYSA-N 0 0 352.394 3.804 20 5 FHBDRN COc1cccc(N2CC[C@](F)(c3cc(F)cc(F)c3)C2)c1[N+](=O)[O-] ZINC000570419141 568475426 /nfs/dbraw/zinc/47/54/26/568475426.db2.gz DQYWVMBXBPYSHR-QGZVFWFLSA-N 0 0 352.312 3.957 20 5 FHBDRN Cn1cc([N+](=O)[O-])cc1C(=O)Nc1nc2c(ccc3c2CCCC3)s1 ZINC000570647911 568493566 /nfs/dbraw/zinc/49/35/66/568493566.db2.gz WHDQLBKTGIBPMS-UHFFFAOYSA-N 0 0 356.407 3.674 20 5 FHBDRN C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N(C)Cc1ccccc1F ZINC000007358675 568501741 /nfs/dbraw/zinc/50/17/41/568501741.db2.gz QBNIAVYASSDWPI-GFCCVEGCSA-N 0 0 356.357 3.977 20 5 FHBDRN CN1C(=O)c2cc(Br)ccc2N[C@@H]1c1ccc([N+](=O)[O-])s1 ZINC000542009738 568515809 /nfs/dbraw/zinc/51/58/09/568515809.db2.gz ZSVAJHIZQSZYKP-LBPRGKRZSA-N 0 0 368.212 3.615 20 5 FHBDRN CC(=O)Nc1cccc(NC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)c1C ZINC000570782363 568526029 /nfs/dbraw/zinc/52/60/29/568526029.db2.gz GFBWWGMXABLGNU-UHFFFAOYSA-N 0 0 370.409 3.568 20 5 FHBDRN Cc1c(CNC(=O)N2CC3(CCCC3)OC(C)(C)C2)cccc1[N+](=O)[O-] ZINC000408328463 568704474 /nfs/dbraw/zinc/70/44/74/568704474.db2.gz GVZQIZZGOOIEQD-UHFFFAOYSA-N 0 0 361.442 3.536 20 5 FHBDRN O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1N[C@H](CC1CC1)c1ccccc1 ZINC000823630517 599054044 /nfs/dbraw/zinc/05/40/44/599054044.db2.gz ZHRSFGAFGVYTBG-MRXNPFEDSA-N 0 0 350.382 3.728 20 5 FHBDRN COc1ccccc1[C@@H](C)Sc1ccc([N+](=O)[O-])cc1-c1nn[nH]n1 ZINC000821883376 599068250 /nfs/dbraw/zinc/06/82/50/599068250.db2.gz UQSLMNZKXHOJBD-SNVBAGLBSA-N 0 0 357.395 3.637 20 5 FHBDRN O=[N+]([O-])c1ccc(Cl)c(CSc2ccc(-c3nn[nH]n3)cc2F)c1 ZINC000738358186 599170232 /nfs/dbraw/zinc/17/02/32/599170232.db2.gz AMYUPSLVLOSOGR-UHFFFAOYSA-N 0 0 365.777 3.860 20 5 FHBDRN Cc1ccccc1[C@@H](Nc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-])C1CC1 ZINC000737425083 598774481 /nfs/dbraw/zinc/77/44/81/598774481.db2.gz YSZPFBQOPBYYLP-KRWDZBQOSA-N 0 0 350.382 3.647 20 5 FHBDRN C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCN(c2ccc(C(=O)[O-])cc2)C[C@H]1C ZINC000828495054 600821899 /nfs/dbraw/zinc/82/18/99/600821899.db2.gz UWQQRBMTCRVCSJ-HUUCEWRRSA-N 0 0 369.421 3.565 20 5 FHBDRN O=[N+]([O-])c1ccc2sc(C=Cc3cc(-c4nn[nH]n4)cs3)nc2c1 ZINC000823645149 606303429 /nfs/dbraw/zinc/30/34/29/606303429.db2.gz OTOPXWFLIVQRGA-RQOWECAXSA-N 0 0 356.392 3.617 20 5 FHBDRN CC[C@H](Nc1c(F)cc(-c2nn[nH]n2)cc1F)c1cccc([N+](=O)[O-])c1 ZINC000820924830 606479320 /nfs/dbraw/zinc/47/93/20/606479320.db2.gz ACKYFXBJRDBOHU-AWEZNQCLSA-N 0 0 360.324 3.616 20 5 FHBDRN O=[N+]([O-])c1cccc(F)c1CSc1ccc(Cl)cc1-c1nn[nH]n1 ZINC000823647869 606631642 /nfs/dbraw/zinc/63/16/42/606631642.db2.gz OSMMXQCBCOVVTK-UHFFFAOYSA-N 0 0 365.777 3.860 20 5 FHBDRN O=[N+]([O-])c1ccc(Cl)c(CNc2ccc(-c3nn[nH]n3)c(Cl)c2)c1 ZINC000823640278 606801294 /nfs/dbraw/zinc/80/12/94/606801294.db2.gz ZZTDVIDDNTWTML-UHFFFAOYSA-N 0 0 365.180 3.694 20 5 FHBDRN CC[C@@H](Nc1ncc(Cl)c(C)c1-c1nn[nH]n1)c1cccc([N+](=O)[O-])c1 ZINC000825149544 609569330 /nfs/dbraw/zinc/56/93/30/609569330.db2.gz ZYOKKMQWXRXWND-CYBMUJFWSA-N 0 0 373.804 3.695 20 5 FHBDRN O=[N+]([O-])c1cc(C(F)(F)N2CC[C@H](c3ccncc3)C2)cnc1Cl ZINC001165044257 721926609 /nfs/dbraw/zinc/92/66/09/721926609.db2.gz TYNQWXLMFNCPKM-NSHDSACASA-N 0 0 354.744 3.577 20 5 FHBDRN C[C@@H](C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)N1CCC[C@H]1C ZINC000178724323 936323114 /nfs/dbraw/zinc/32/31/14/936323114.db2.gz RJEGCNOHMGIACC-NEPJUHHUSA-N 0 0 360.439 3.530 20 5 FHBDRN C[C@H]1CN(C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)c2ccc(F)cc2O1 ZINC000135893894 936326325 /nfs/dbraw/zinc/32/63/25/936326325.db2.gz XATNZGDAUVGLLO-NSHDSACASA-N 0 0 369.352 3.572 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CN[C@H](C)c1ccc2c(c1)OCCCO2 ZINC000178729233 936327067 /nfs/dbraw/zinc/32/70/67/936327067.db2.gz ATPIESMBVINKEM-CYBMUJFWSA-N 0 0 358.394 3.616 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1-c1nc(COc2ccc(Cl)c(F)c2)no1 ZINC000582979238 936343634 /nfs/dbraw/zinc/34/36/34/936343634.db2.gz KFKMYWMUPBCUNG-UHFFFAOYSA-N 0 0 364.720 3.720 20 5 FHBDRN COc1cc(Cc2noc(C3(c4cccc(F)c4)CC3)n2)ccc1[N+](=O)[O-] ZINC000612965181 936350819 /nfs/dbraw/zinc/35/08/19/936350819.db2.gz UMRAJUYXQHLTRV-UHFFFAOYSA-N 0 0 369.352 3.796 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1)N[C@H]1c2ccccc2CC12CCOCC2 ZINC000582993145 936350953 /nfs/dbraw/zinc/35/09/53/936350953.db2.gz MMLKEKXFYMJGIS-SFHVURJKSA-N 0 0 367.405 3.811 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CSCc1nc2ccccc2[nH]1 ZINC000015410872 936351200 /nfs/dbraw/zinc/35/12/00/936351200.db2.gz YCADCCGTLYQQAY-UHFFFAOYSA-N 0 0 356.407 3.651 20 5 FHBDRN Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)NC(=O)c1[nH]ncc1[N+](=O)[O-] ZINC000153666753 936370445 /nfs/dbraw/zinc/37/04/45/936370445.db2.gz MMHJTBHDKOTTFC-SNVBAGLBSA-N 0 0 371.422 3.549 20 5 FHBDRN CC(=O)N(C)c1ccc(C(=O)O[C@H](C)c2cc([N+](=O)[O-])ccc2C)cc1 ZINC000785159240 936384937 /nfs/dbraw/zinc/38/49/37/936384937.db2.gz AZUQPKHQNUMLAO-CYBMUJFWSA-N 0 0 356.378 3.804 20 5 FHBDRN O=C(/C=C\c1cnc2ccccc2n1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000255564815 936386092 /nfs/dbraw/zinc/38/60/92/936386092.db2.gz JZCFWJFZLUETJQ-GHXNOFRVSA-N 0 0 374.400 3.742 20 5 FHBDRN CNc1c(C(=O)N2CC[C@@](F)(c3ccccc3C)C2)cccc1[N+](=O)[O-] ZINC000506374817 945065368 /nfs/dbraw/zinc/06/53/68/945065368.db2.gz HCGJSRIPNWFFFZ-IBGZPJMESA-N 0 0 357.385 3.656 20 5 FHBDRN CCCC[C@H]1CCC[C@@H]1NC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000110715625 945065409 /nfs/dbraw/zinc/06/54/09/945065409.db2.gz KRLNPCYKTICOMV-HOCLYGCPSA-N 0 0 356.426 3.869 20 5 FHBDRN CCCC[C@@H]1CCC[C@@H]1NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000110722918 945068085 /nfs/dbraw/zinc/06/80/85/945068085.db2.gz MYURSQNZYDZUTA-KDOFPFPSSA-N 0 0 356.426 3.869 20 5 FHBDRN CCCCOC1CCN(C(=O)Nc2cc([N+](=O)[O-])ccc2OCC)CC1 ZINC000439903750 945068598 /nfs/dbraw/zinc/06/85/98/945068598.db2.gz RIWNXOLUNXYYJK-UHFFFAOYSA-N 0 0 365.430 3.807 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)c1cccc(Br)c1Cl ZINC000136018980 937087348 /nfs/dbraw/zinc/08/73/48/937087348.db2.gz ZMRQIADUEFPTDE-UHFFFAOYSA-N 0 0 369.602 3.941 20 5 FHBDRN CC(=O)c1cccc(NC(=O)[C@H](Sc2ccc([N+](=O)[O-])cn2)C(C)C)c1 ZINC000178763529 937096296 /nfs/dbraw/zinc/09/62/96/937096296.db2.gz YKRLQUVAUDSGCY-QGZVFWFLSA-N 0 0 373.434 3.948 20 5 FHBDRN O=C(c1cc2cc([N+](=O)[O-])ccc2o1)N1CCC(C2CCOCC2)CC1 ZINC000548787583 937108908 /nfs/dbraw/zinc/10/89/08/937108908.db2.gz LBQYPMPQCWRTLX-UHFFFAOYSA-N 0 0 358.394 3.620 20 5 FHBDRN CCCCOCCOCCNC(=O)c1cc2ccccc2c2cccnc12 ZINC000437148247 945069476 /nfs/dbraw/zinc/06/94/76/945069476.db2.gz WLPFCYLCISEWMJ-UHFFFAOYSA-N 0 0 366.461 3.951 20 5 FHBDRN COc1ccc2c(c1)CCCN(C(=O)c1cc(Cl)ccc1[N+](=O)[O-])C2 ZINC000728544342 937116963 /nfs/dbraw/zinc/11/69/63/937116963.db2.gz YWTHWLNQXCPOCM-UHFFFAOYSA-N 0 0 360.797 3.845 20 5 FHBDRN COC(=O)c1cc(NC(=O)[C@H]2C[C@H]2c2ccccc2Cl)cc([N+](=O)[O-])c1 ZINC000583108977 937127046 /nfs/dbraw/zinc/12/70/46/937127046.db2.gz HAEURNCUUYJKLJ-GJZGRUSLSA-N 0 0 374.780 3.777 20 5 FHBDRN CCn1c(CCNc2ncnc3sc([N+](=O)[O-])cc32)nc2ccccc21 ZINC000557542002 927037214 /nfs/dbraw/zinc/03/72/14/927037214.db2.gz ZYWQRXRJECCURW-UHFFFAOYSA-N 0 0 368.422 3.624 20 5 FHBDRN COc1ccccc1C1(CNc2ncnc3sc([N+](=O)[O-])cc32)CC1 ZINC000557534996 927044091 /nfs/dbraw/zinc/04/40/91/927044091.db2.gz CYXGSVNBWUFBQE-UHFFFAOYSA-N 0 0 356.407 3.752 20 5 FHBDRN CCOC(=O)/C=C/c1ccc(NC(=O)Cc2cccc([N+](=O)[O-])c2C)cc1 ZINC000160149339 927045051 /nfs/dbraw/zinc/04/50/51/927045051.db2.gz WALMSTYLGFQYPL-FMIVXFBMSA-N 0 0 368.389 3.661 20 5 FHBDRN CC(=O)c1ccc(N2CCC([C@H](O)c3ccccc3)CC2)c([N+](=O)[O-])c1 ZINC000023357138 927056846 /nfs/dbraw/zinc/05/68/46/927056846.db2.gz FZZPHRCAPWGWMG-HXUWFJFHSA-N 0 0 354.406 3.747 20 5 FHBDRN CS(=O)(=O)c1ccc(N[C@H]2CCC[C@H](C(F)(F)F)C2)c([N+](=O)[O-])c1 ZINC000023357203 927057687 /nfs/dbraw/zinc/05/76/87/927057687.db2.gz CODNNUJNVBNGKJ-UWVGGRQHSA-N 0 0 366.361 3.531 20 5 FHBDRN O=[N+]([O-])c1ccc(OC2CCN(c3cc(Cl)nc(C4CC4)n3)CC2)cc1 ZINC000160163105 927070653 /nfs/dbraw/zinc/07/06/53/927070653.db2.gz LYWOTQZQRIOXIG-UHFFFAOYSA-N 0 0 374.828 3.963 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1OC[C@H](O)c1cccc(Br)c1 ZINC000755325810 937139063 /nfs/dbraw/zinc/13/90/63/937139063.db2.gz YASVRGPTWSQAND-AWEZNQCLSA-N 0 0 352.184 3.778 20 5 FHBDRN COc1cc(C(=O)Nc2cccc3ccc(C)nc32)cc([N+](=O)[O-])c1OC ZINC000610174276 927170626 /nfs/dbraw/zinc/17/06/26/927170626.db2.gz MYOSTQDVJUIWKR-UHFFFAOYSA-N 0 0 367.361 3.721 20 5 FHBDRN CCC[C@H]1CCCC[C@@H]1NC(=O)c1cc(OC)c(OC)c([N+](=O)[O-])c1 ZINC000610174206 927170727 /nfs/dbraw/zinc/17/07/27/927170727.db2.gz POZJBSCFSCLHMV-JSGCOSHPSA-N 0 0 350.415 3.701 20 5 FHBDRN CCN(Cc1cccc(NC(=O)Nc2ccc([N+](=O)[O-])cc2)c1)C(C)=O ZINC000047967299 927176455 /nfs/dbraw/zinc/17/64/55/927176455.db2.gz YNLKJDOETWANTO-UHFFFAOYSA-N 0 0 356.382 3.607 20 5 FHBDRN COCc1cccc(-c2noc(CCCNc3ccc([N+](=O)[O-])cc3)n2)c1 ZINC000583114945 937141204 /nfs/dbraw/zinc/14/12/04/937141204.db2.gz HUWPCLFYGVHZHZ-UHFFFAOYSA-N 0 0 368.393 3.836 20 5 FHBDRN COc1cc(C(=O)N[C@H](c2ccccc2)C2CCC2)cc([N+](=O)[O-])c1OC ZINC000610174379 927201099 /nfs/dbraw/zinc/20/10/99/927201099.db2.gz FOESSMNKSXPQQR-GOSISDBHSA-N 0 0 370.405 3.883 20 5 FHBDRN COc1cc(C(=O)NCC[C@H]2CCC[C@@H](C)C2)cc([N+](=O)[O-])c1OC ZINC000610176519 927242361 /nfs/dbraw/zinc/24/23/61/927242361.db2.gz QRUAXANXVXLVLF-CHWSQXEVSA-N 0 0 350.415 3.558 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1CCCOc2c(F)cccc21 ZINC000471108922 927259059 /nfs/dbraw/zinc/25/90/59/927259059.db2.gz AIRXCKCXOWOFBY-CQSZACIVSA-N 0 0 374.368 3.776 20 5 FHBDRN C[C@H](C1CC1)n1cc(N[C@@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)cn1 ZINC000579743914 927263271 /nfs/dbraw/zinc/26/32/71/927263271.db2.gz OHMMDGKUCCYZFN-FZKQIMNGSA-N 0 0 366.425 3.697 20 5 FHBDRN Cc1cc(Cl)c(OC[C@@H](O)COc2ccccc2[N+](=O)[O-])cc1F ZINC000557648896 927277871 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Cc1ccc(C(=O)N(Cc2ccco2)Cc2cccnc2)cc1[N+](=O)[O-] ZINC000247984252 937151882 /nfs/dbraw/zinc/15/18/82/937151882.db2.gz IOFHFUFXNPWSIJ-UHFFFAOYSA-N 0 0 351.362 3.734 20 5 FHBDRN O=C(NCc1cccc(COCC(F)(F)F)c1)c1csc([N+](=O)[O-])c1 ZINC000178789689 937152609 /nfs/dbraw/zinc/15/26/09/937152609.db2.gz ODODYYSSSKMFPW-UHFFFAOYSA-N 0 0 374.340 3.665 20 5 FHBDRN COc1cc(C(=O)N[C@@H](C)c2cc(C)cc(C)c2)cc([N+](=O)[O-])c1OC ZINC000610179760 927342858 /nfs/dbraw/zinc/34/28/58/927342858.db2.gz IIYMCVRBAHQJJI-ZDUSSCGKSA-N 0 0 358.394 3.720 20 5 FHBDRN COc1c(C)cnc(CNC(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)c1C ZINC000120129442 927345118 /nfs/dbraw/zinc/34/51/18/927345118.db2.gz ZMIAYIPKSAIOFJ-UHFFFAOYSA-N 0 0 358.398 3.554 20 5 FHBDRN CCC[C@@H](CCc1ccccc1)NC(=O)COc1cccc([N+](=O)[O-])c1 ZINC000610180470 927383327 /nfs/dbraw/zinc/38/33/27/927383327.db2.gz AYQWLGKOWABWGZ-KRWDZBQOSA-N 0 0 356.422 3.891 20 5 FHBDRN COc1ccccc1[C@@]1(C)C[C@@H]1NC(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000610181885 927394099 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ZINC000610186598 927660523 /nfs/dbraw/zinc/66/05/23/927660523.db2.gz YBEDNYGECSSDJB-BJJXKVORSA-N 0 0 374.824 3.763 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(NC(=O)OC(C)(C)C)nc1 ZINC000278106119 937189317 /nfs/dbraw/zinc/18/93/17/937189317.db2.gz KQAOABOADQPNEG-UHFFFAOYSA-N 0 0 372.381 3.898 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)c1cc(F)cc2cccnc21 ZINC000583160331 937189688 /nfs/dbraw/zinc/18/96/88/937189688.db2.gz WNZHJKPKTPGNHI-UHFFFAOYSA-N 0 0 353.353 3.597 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)Nc1nc2c(cccc2Cl)n1C ZINC000471143138 927846149 /nfs/dbraw/zinc/84/61/49/927846149.db2.gz RYPOICQGWKHJLZ-UHFFFAOYSA-N 0 0 374.784 3.786 20 5 FHBDRN CN(c1cc(Cl)cc(Cl)c1)S(=O)(=O)c1csc([N+](=O)[O-])c1 ZINC000120252148 927867383 /nfs/dbraw/zinc/86/73/83/927867383.db2.gz VXNHRINIMKQZBZ-UHFFFAOYSA-N 0 0 367.235 3.788 20 5 FHBDRN CC1(C)[C@H](NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[C@@H]2CCCO[C@@H]21 ZINC000610192815 927869805 /nfs/dbraw/zinc/86/98/05/927869805.db2.gz 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ZINC000784935558 928019734 /nfs/dbraw/zinc/01/97/34/928019734.db2.gz LBJOVANJYSZFHW-UHFFFAOYSA-N 0 0 350.421 3.661 20 5 FHBDRN CCCn1nc(C)c(C(=O)OCCSc2ccc([N+](=O)[O-])cc2)c1C ZINC000784936612 928036549 /nfs/dbraw/zinc/03/65/49/928036549.db2.gz SZQGKJNFLIUPFR-UHFFFAOYSA-N 0 0 363.439 3.767 20 5 FHBDRN C[C@H](NC(=O)NC[C@H]1[C@@H]2c3ccccc3C[C@H]12)c1cccc([N+](=O)[O-])c1 ZINC000246882931 928049420 /nfs/dbraw/zinc/04/94/20/928049420.db2.gz LVXKOILYNHNRKE-VEFTVXKRSA-N 0 0 351.406 3.541 20 5 FHBDRN C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1CC(=O)N[C@@H](c1ccccc1)C1CC1 ZINC000728200729 928068082 /nfs/dbraw/zinc/06/80/82/928068082.db2.gz AACTUOLVEJCULU-SZNDQCEHSA-N 0 0 365.433 3.613 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCc1ccccc1-n1ccnc1 ZINC000120312841 928079094 /nfs/dbraw/zinc/07/90/94/928079094.db2.gz NAAZNILMMCQEBW-UHFFFAOYSA-N 0 0 365.393 3.719 20 5 FHBDRN O=C1[C@H](Nc2ccc(F)cc2[N+](=O)[O-])CCCN1c1ccccc1Cl ZINC000610211036 928081076 /nfs/dbraw/zinc/08/10/76/928081076.db2.gz NDORORNYMGYZLH-CQSZACIVSA-N 0 0 363.776 3.995 20 5 FHBDRN O=C(C1=Cc2ccccc2OC1)N1CCS[C@@H]1c1ccc([N+](=O)[O-])cc1 ZINC000610210464 928088896 /nfs/dbraw/zinc/08/88/96/928088896.db2.gz UFMXJQIENXIGQD-LJQANCHMSA-N 0 0 368.414 3.645 20 5 FHBDRN O=C(OCC[C@@H]1CCCCO1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000784936739 928102126 /nfs/dbraw/zinc/10/21/26/928102126.db2.gz JVBSDAGARHRHKZ-AWEZNQCLSA-N 0 0 362.407 3.834 20 5 FHBDRN CCCC[C@H](NC(=O)c1ccc(N)c([N+](=O)[O-])c1)c1ccc(OC)cc1 ZINC000728552058 937220717 /nfs/dbraw/zinc/22/07/17/937220717.db2.gz SDLGOWDEWSWDGQ-KRWDZBQOSA-N 0 0 357.410 3.847 20 5 FHBDRN COc1ccccc1N(C)C(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000064807475 928136016 /nfs/dbraw/zinc/13/60/16/928136016.db2.gz NXMALPFOEBRPKW-NSHDSACASA-N 0 0 364.785 3.687 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1CCOc2c(C)cccc21 ZINC000471155911 928169810 /nfs/dbraw/zinc/16/98/10/928169810.db2.gz IFYYIMCYHFYFOT-CQSZACIVSA-N 0 0 356.378 3.556 20 5 FHBDRN CCN(CC(=O)Nc1c(C)cccc1C)Cc1ccc([N+](=O)[O-])cc1OC ZINC000430214071 928191747 /nfs/dbraw/zinc/19/17/47/928191747.db2.gz WQOGWEPETIOLJB-UHFFFAOYSA-N 0 0 371.437 3.681 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2noc(CN(CC3CCC3)CC(F)(F)F)n2)cc1 ZINC000178815751 937230252 /nfs/dbraw/zinc/23/02/52/937230252.db2.gz RGWVGFDCLRAWSJ-UHFFFAOYSA-N 0 0 370.331 3.809 20 5 FHBDRN COc1c(F)cc(S(=O)(=O)Nc2ccc(C)cc2Cl)cc1[N+](=O)[O-] ZINC000187167747 928245422 /nfs/dbraw/zinc/24/54/22/928245422.db2.gz KQXZIMBEUILCJX-UHFFFAOYSA-N 0 0 374.777 3.505 20 5 FHBDRN COCc1ccc([C@H]2CCCN2c2cc(C)c([N+](=O)[O-])c(C(=O)OC)c2)o1 ZINC000161587679 937231272 /nfs/dbraw/zinc/23/12/72/937231272.db2.gz ODWQQAPSADMPSB-MRXNPFEDSA-N 0 0 374.393 3.771 20 5 FHBDRN Nc1c(C(=O)N2CCc3c(F)cccc3C2)cc2ccccc2c1[N+](=O)[O-] ZINC001266291645 928263437 /nfs/dbraw/zinc/26/34/37/928263437.db2.gz KZHWKHKIPGXRQC-UHFFFAOYSA-N 0 0 365.364 3.668 20 5 FHBDRN COc1ccc([C@@H]2CCCN2Cc2ccc([N+](=O)[O-])cc2OC)cc1OC ZINC000430222756 928275922 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FHBDRN C[C@@H](Nc1ncc([N+](=O)[O-])s1)c1nnc(-c2cccc(F)c2)s1 ZINC000375595408 928350910 /nfs/dbraw/zinc/35/09/10/928350910.db2.gz DONGQDHGMLUZJV-SSDOTTSWSA-N 0 0 351.388 3.882 20 5 FHBDRN COc1ccc(OC)c(NC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)c1 ZINC000157642155 928369045 /nfs/dbraw/zinc/36/90/45/928369045.db2.gz DYFHVSHFFMRDBM-UHFFFAOYSA-N 0 0 373.409 3.756 20 5 FHBDRN CC(C)c1ncc(C(=O)Nc2cc(-c3cccc([N+](=O)[O-])c3)[nH]n2)s1 ZINC000127005089 928382596 /nfs/dbraw/zinc/38/25/96/928382596.db2.gz JAEHNCJJFZPKOO-UHFFFAOYSA-N 0 0 357.395 3.817 20 5 FHBDRN COc1ccc(NC(=O)Cc2cccc([N+](=O)[O-])c2)cc1Br ZINC000610228390 928390241 /nfs/dbraw/zinc/39/02/41/928390241.db2.gz RNQDMGRPOBCYPP-UHFFFAOYSA-N 0 0 365.183 3.547 20 5 FHBDRN CCc1ncsc1NC(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000157669921 928406939 /nfs/dbraw/zinc/40/69/39/928406939.db2.gz SDHWIOQXRPHMAY-QMMMGPOBSA-N 0 0 355.803 3.673 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)NCc2nc(-c3ccc(Cl)cc3)no2)c1 ZINC000610229350 928421506 /nfs/dbraw/zinc/42/15/06/928421506.db2.gz RAEXQXVPSQRWGV-UHFFFAOYSA-N 0 0 372.768 3.537 20 5 FHBDRN O=C(OCCSc1ccc([N+](=O)[O-])cc1)c1ccn(C2CCCC2)n1 ZINC000784940904 928455982 /nfs/dbraw/zinc/45/59/82/928455982.db2.gz WLBGUUHWHOJACG-UHFFFAOYSA-N 0 0 361.423 3.856 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1CN(C)Cc1nc(C(F)(F)F)cs1 ZINC000430244370 928461433 /nfs/dbraw/zinc/46/14/33/928461433.db2.gz XDYZDFRBIADIQB-UHFFFAOYSA-N 0 0 361.345 3.711 20 5 FHBDRN Cc1nn(CCC(=O)N(Cc2ccc(C)c(C)c2)C2CC2)c(C)c1[N+](=O)[O-] ZINC000127068584 928518138 /nfs/dbraw/zinc/51/81/38/928518138.db2.gz SACNATIBNOTFJN-UHFFFAOYSA-N 0 0 370.453 3.606 20 5 FHBDRN C[C@@H]1CN(Cc2c(F)cc([N+](=O)[O-])cc2F)C[C@@H](c2ccsc2)O1 ZINC000509360349 928561442 /nfs/dbraw/zinc/56/14/42/928561442.db2.gz VWPXCPOQBQCKEL-HWPZZCPQSA-N 0 0 354.378 3.897 20 5 FHBDRN CCOc1cc(NC(=O)NCC2(C(F)F)CC2)c([N+](=O)[O-])cc1OCC ZINC000471174771 928564547 /nfs/dbraw/zinc/56/45/47/928564547.db2.gz CMBFGTSERIPFDF-UHFFFAOYSA-N 0 0 373.356 3.559 20 5 FHBDRN O=C(/C=C\c1ccccc1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000254975082 928620194 /nfs/dbraw/zinc/62/01/94/928620194.db2.gz PHWCZNPTNAYDLL-WDZFZDKYSA-N 0 0 352.390 3.678 20 5 FHBDRN COc1cc(CN[C@H]2CCc3sc(Cl)cc32)c([N+](=O)[O-])cc1O ZINC000583232861 937262715 /nfs/dbraw/zinc/26/27/15/937262715.db2.gz HCKJIQUSHILJFI-JTQLQIEISA-N 0 0 354.815 3.801 20 5 FHBDRN O=[N+]([O-])c1c(Cl)c2ccccc2nc1N1CCO[C@H](C(F)(F)F)C1 ZINC001167083107 928717431 /nfs/dbraw/zinc/71/74/31/928717431.db2.gz YKYONAHYWXRLQM-JTQLQIEISA-N 0 0 361.707 3.564 20 5 FHBDRN C[C@H](C(=O)NC1(c2ccc(F)cc2)CCOCC1)c1cccc([N+](=O)[O-])c1 ZINC000583239306 937270459 /nfs/dbraw/zinc/27/04/59/937270459.db2.gz RZYNWQPUMOZPKV-AWEZNQCLSA-N 0 0 372.396 3.660 20 5 FHBDRN Nc1c(C(=O)Nc2cc(C(F)(F)F)ccc2F)cc(F)cc1[N+](=O)[O-] ZINC000327558649 928737174 /nfs/dbraw/zinc/73/71/74/928737174.db2.gz CKKJPZKPBSQNIR-UHFFFAOYSA-N 0 0 361.226 3.726 20 5 FHBDRN CCOc1ccc(C(=O)n2ccccc2=Nc2ccccc2)cc1[N+](=O)[O-] ZINC000254990462 928744037 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FHBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(N2CCC(c3ccsc3)CC2)s1 ZINC000274940864 929063679 /nfs/dbraw/zinc/06/36/79/929063679.db2.gz BCADZUFQDHMVIV-UHFFFAOYSA-N 0 0 372.493 3.505 20 5 FHBDRN O=C(c1ccn(-c2ccccc2[N+](=O)[O-])n1)N1CCC2(CCCCC2)CC1 ZINC000134577838 929069742 /nfs/dbraw/zinc/06/97/42/929069742.db2.gz LZTQIEGZABTMAY-UHFFFAOYSA-N 0 0 368.437 3.967 20 5 FHBDRN Cc1cc(F)ccc1OC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC001266331316 929069990 /nfs/dbraw/zinc/06/99/90/929069990.db2.gz PIOZTCRYDURYFY-UHFFFAOYSA-N 0 0 355.325 3.662 20 5 FHBDRN COC(=O)c1ccc(F)c(CNc2cc([N+](=O)[O-])ccc2OC(F)F)c1 ZINC000510138597 929082815 /nfs/dbraw/zinc/08/28/15/929082815.db2.gz FECBIRZVRZZTNH-UHFFFAOYSA-N 0 0 370.283 3.734 20 5 FHBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N(C)CC1(O)CCCC1 ZINC000120626568 929130230 /nfs/dbraw/zinc/13/02/30/929130230.db2.gz ROBRPRYKTHMPHZ-UHFFFAOYSA-N 0 0 366.483 3.720 20 5 FHBDRN CN(C[C@@H]1CCCO[C@H]1c1ccccc1)C(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000610239195 929134596 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3.592 20 5 FHBDRN O=C(NCCc1nc2c(s1)CCCC2)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000134766441 929223086 /nfs/dbraw/zinc/22/30/86/929223086.db2.gz LQOBSDZPPCEIRZ-UHFFFAOYSA-N 0 0 365.842 3.556 20 5 FHBDRN Cc1cc(C(=O)N(C)Cc2ccccc2[N+](=O)[O-])c(Br)s1 ZINC000471219986 929223605 /nfs/dbraw/zinc/22/36/05/929223605.db2.gz KPMBXBLBEWSDFX-UHFFFAOYSA-N 0 0 369.240 3.999 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])N1CCc2cccc(Cl)c2C1 ZINC000458006600 929228452 /nfs/dbraw/zinc/22/84/52/929228452.db2.gz BBWIZEHBQBKHOC-UHFFFAOYSA-N 0 0 360.797 3.602 20 5 FHBDRN CO[C@@]1(C)C[C@@H](NC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)C1(C)C ZINC000547749404 929291067 /nfs/dbraw/zinc/29/10/67/929291067.db2.gz OFEHRDUWUATIEK-GCJKJVERSA-N 0 0 364.445 3.615 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N(Cc1ccc(F)cc1)CC1CC1 ZINC000609652572 929294237 /nfs/dbraw/zinc/29/42/37/929294237.db2.gz SMBKMGTYDIALJM-UHFFFAOYSA-N 0 0 358.369 3.795 20 5 FHBDRN CO[C@H](CNC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1)c1ccccc1 ZINC000178846070 937322121 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3.557 20 5 FHBDRN O=C(N[C@@H]1CSc2ccccc21)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000609791953 929489325 /nfs/dbraw/zinc/48/93/25/929489325.db2.gz XKZYROVGQDZGGJ-OAHLLOKOSA-N 0 0 369.446 3.772 20 5 FHBDRN Cc1c2ccccc2n(C)c1CNC(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000471236851 929505440 /nfs/dbraw/zinc/50/54/40/929505440.db2.gz SYFKPBRQCNZKBT-UHFFFAOYSA-N 0 0 366.421 3.513 20 5 FHBDRN O=C(N[C@H]1C[C@H]1c1cccc(F)c1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000178861706 937339622 /nfs/dbraw/zinc/33/96/22/937339622.db2.gz PAFZAIQHOXVAED-ROUUACIJSA-N 0 0 369.396 3.964 20 5 FHBDRN O=C(NCCc1ccccc1[N+](=O)[O-])NCc1c(Cl)cccc1Cl ZINC000547764505 929572234 /nfs/dbraw/zinc/57/22/34/929572234.db2.gz XLAVCLJIVQTTPU-UHFFFAOYSA-N 0 0 368.220 3.944 20 5 FHBDRN Cc1cnn(Cc2ccccc2F)c1NC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000187215387 929588930 /nfs/dbraw/zinc/58/89/30/929588930.db2.gz VNXYKJQAJYUUTL-UHFFFAOYSA-N 0 0 354.341 3.539 20 5 FHBDRN CN(C(=O)c1cc(F)ccc1[N+](=O)[O-])[C@H](c1ccccc1)c1ccccn1 ZINC000360024800 929604045 /nfs/dbraw/zinc/60/40/45/929604045.db2.gz WDYLYOHGMOLBBD-LJQANCHMSA-N 0 0 365.364 3.991 20 5 FHBDRN Cc1cc(C)c(NC(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])c(C)n1 ZINC000121053337 929668022 /nfs/dbraw/zinc/66/80/22/929668022.db2.gz LNLMXKNEOSPMJK-LBPRGKRZSA-N 0 0 363.801 3.974 20 5 FHBDRN O=C(CSc1nccn1C1CC1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000011891820 929689341 /nfs/dbraw/zinc/68/93/41/929689341.db2.gz ILOIACRZGCPVHY-UHFFFAOYSA-N 0 0 352.803 3.510 20 5 FHBDRN O=C(NCCc1ccc(F)cc1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000064866525 929700758 /nfs/dbraw/zinc/70/07/58/929700758.db2.gz RPAIBORHJPTKBP-UHFFFAOYSA-N 0 0 371.393 3.830 20 5 FHBDRN Cc1nn(C)c(C(=O)N(C)c2ccc(-c3ccccc3)cc2)c1[N+](=O)[O-] ZINC000610296926 929714714 /nfs/dbraw/zinc/71/47/14/929714714.db2.gz PUHSEROWATUOQT-UHFFFAOYSA-N 0 0 350.378 3.580 20 5 FHBDRN Cc1cc(N2CC[C@H](Oc3cccnc3)C2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000578946387 929747036 /nfs/dbraw/zinc/74/70/36/929747036.db2.gz PUIMPAJYBGQART-ZDUSSCGKSA-N 0 0 367.327 3.975 20 5 FHBDRN Cc1ccc(OC[C@H](O)Cc2ccccc2C(F)(F)F)cc1[N+](=O)[O-] ZINC000583335212 937356181 /nfs/dbraw/zinc/35/61/81/937356181.db2.gz DVMSDONQXUGVOW-CYBMUJFWSA-N 0 0 355.312 3.904 20 5 FHBDRN O=C(c1cc2c(cc1[N+](=O)[O-])OCO2)N1CC2(CCC2)[C@H]1c1ccccc1 ZINC000578973225 929759982 /nfs/dbraw/zinc/75/99/82/929759982.db2.gz QWJVKPWAWAEMFT-GOSISDBHSA-N 0 0 366.373 3.691 20 5 FHBDRN Cc1nn(CCC(=O)NC(C)(C)c2ccc(C(C)C)cc2)c(C)c1[N+](=O)[O-] ZINC000609189430 929767089 /nfs/dbraw/zinc/76/70/89/929767089.db2.gz UUFGNCVODCYCCZ-UHFFFAOYSA-N 0 0 372.469 3.973 20 5 FHBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)NCCc1ccsc1 ZINC000579984152 929769675 /nfs/dbraw/zinc/76/96/75/929769675.db2.gz OUSMBHXMHIBISO-UHFFFAOYSA-N 0 0 369.240 3.700 20 5 FHBDRN O=C(c1cnc(C2CC2)s1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000610305666 929775932 /nfs/dbraw/zinc/77/59/32/929775932.db2.gz ZHQPZWGIIMWKAN-UHFFFAOYSA-N 0 0 373.434 3.612 20 5 FHBDRN CCCc1csc(NC(=O)c2cc(OCC)c(OC)cc2[N+](=O)[O-])n1 ZINC000127134910 929784000 /nfs/dbraw/zinc/78/40/00/929784000.db2.gz CJKIOLXPRVJEAW-UHFFFAOYSA-N 0 0 365.411 3.663 20 5 FHBDRN CC(C)(C(=O)NCC1(c2ccc(F)cc2F)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000535639608 929784107 /nfs/dbraw/zinc/78/41/07/929784107.db2.gz LJLRIYORELVDPL-UHFFFAOYSA-N 0 0 374.387 3.999 20 5 FHBDRN CCC[C@H](CCO)CNC(=O)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000278211989 937362751 /nfs/dbraw/zinc/36/27/51/937362751.db2.gz RCRLUPDJWPOSEL-CQSZACIVSA-N 0 0 352.434 3.622 20 5 FHBDRN Cc1cc(F)ccc1NC(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000583345599 937362769 /nfs/dbraw/zinc/36/27/69/937362769.db2.gz KVBUCAVSKCOBCJ-UHFFFAOYSA-N 0 0 356.357 3.888 20 5 FHBDRN Cc1ccc([C@@H]2C[C@H](C)CCN2S(=O)(=O)c2ccccc2[N+](=O)[O-])o1 ZINC000610316775 929874769 /nfs/dbraw/zinc/87/47/69/929874769.db2.gz CKJJINCEZWPCHN-DOMZBBRYSA-N 0 0 364.423 3.658 20 5 FHBDRN COc1ccc(C(=O)N2CC[C@H](Cc3ccccc3)[C@@H]2C)cc1[N+](=O)[O-] ZINC000471477766 929876958 /nfs/dbraw/zinc/87/69/58/929876958.db2.gz VSVAVLATLNRKGK-GOEBONIOSA-N 0 0 354.406 3.697 20 5 FHBDRN Cn1ccnc1[C@H](N[C@H]1CCO[C@@H](C(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000560546566 929886056 /nfs/dbraw/zinc/88/60/56/929886056.db2.gz VWMNBTPUYDWKEO-CGTJXYLNSA-N 0 0 372.469 3.601 20 5 FHBDRN CCO[C@@H]1C[C@@H](NC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C12CCC2 ZINC000610317488 929887649 /nfs/dbraw/zinc/88/76/49/929887649.db2.gz YFXXWAXUIGUNLH-ZIAGYGMSSA-N 0 0 353.806 3.717 20 5 FHBDRN Cc1nc(NC(=O)[C@@H](OC2CCCC2)c2ccccc2)ccc1[N+](=O)[O-] ZINC000134076658 929905838 /nfs/dbraw/zinc/90/58/38/929905838.db2.gz YJPZLGDBSCLZMV-SFHVURJKSA-N 0 0 355.394 3.937 20 5 FHBDRN C[C@@H](NCc1ccccc1[N+](=O)[O-])c1ncc(Br)cc1F ZINC000187317358 929908773 /nfs/dbraw/zinc/90/87/73/929908773.db2.gz MNTGQXAWUNJDAN-SECBINFHSA-N 0 0 354.179 3.742 20 5 FHBDRN COCCCCc1cccnc1NC(=O)c1c(C)c(C)ccc1[N+](=O)[O-] ZINC000891091487 929913049 /nfs/dbraw/zinc/91/30/49/929913049.db2.gz SUBHGIYPRCIATB-UHFFFAOYSA-N 0 0 357.410 3.828 20 5 FHBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)c1nc2ccccc2cc1Cl ZINC000583352733 937370863 /nfs/dbraw/zinc/37/08/63/937370863.db2.gz JXJXCLLWLRLEQJ-UHFFFAOYSA-N 0 0 355.781 3.769 20 5 FHBDRN CC(=O)Nc1c(C)ccc(NC(=O)NCCc2ccccc2[N+](=O)[O-])c1C ZINC000610321882 929927988 /nfs/dbraw/zinc/92/79/88/929927988.db2.gz LWASJCHWJAZINE-UHFFFAOYSA-N 0 0 370.409 3.534 20 5 FHBDRN CN(C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2)[C@H]1CCC[C@@H]1c1ccccc1 ZINC000458022632 929928265 /nfs/dbraw/zinc/92/82/65/929928265.db2.gz IFFGTWFDTAERCS-CVEARBPZSA-N 0 0 368.389 3.732 20 5 FHBDRN C[C@@]1(CNC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)CCCC[C@H]1O ZINC000275714893 929965265 /nfs/dbraw/zinc/96/52/65/929965265.db2.gz HOYQDNIEVNOMEX-KNQAVFIVSA-N 0 0 364.445 3.765 20 5 FHBDRN C[C@@]1(CNC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)CCCC[C@@H]1O ZINC000275714904 929965449 /nfs/dbraw/zinc/96/54/49/929965449.db2.gz HOYQDNIEVNOMEX-UGKGYDQZSA-N 0 0 364.445 3.765 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])c(Cl)c1)N1CCC(OC2CCCC2)CC1 ZINC000155544171 929966943 /nfs/dbraw/zinc/96/69/43/929966943.db2.gz HGBGNNBALWDDHW-UHFFFAOYSA-N 0 0 352.818 3.812 20 5 FHBDRN C[C@@H]1CCC[C@H](C)N1CC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC001167337636 929993466 /nfs/dbraw/zinc/99/34/66/929993466.db2.gz VCKMQOODHUPGPS-BETUJISGSA-N 0 0 374.466 3.920 20 5 FHBDRN COc1cc(CCNc2ncc(Cl)cc2Cl)c([N+](=O)[O-])cc1OC ZINC000610339721 930032227 /nfs/dbraw/zinc/03/22/27/930032227.db2.gz XCCXHZLRWIFLCE-UHFFFAOYSA-N 0 0 372.208 3.968 20 5 FHBDRN Cc1cc(C(=O)N[C@H](CC(=O)OC(C)C)c2ccccc2[N+](=O)[O-])oc1C ZINC000134111691 930038240 /nfs/dbraw/zinc/03/82/40/930038240.db2.gz XFRDQBIQXYCDAI-OAHLLOKOSA-N 0 0 374.393 3.617 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CCSC3(CCC3)CC2)c(Br)c1 ZINC000583368571 937384206 /nfs/dbraw/zinc/38/42/06/937384206.db2.gz VLFPFSMSKJBNKX-UHFFFAOYSA-N 0 0 358.261 3.618 20 5 FHBDRN C[C@@H]1C(=O)CC[C@H](C(=O)NCc2cc([N+](=O)[O-])ccc2Cl)C1(C)C ZINC000275726096 930052133 /nfs/dbraw/zinc/05/21/33/930052133.db2.gz WTKGXOKJPSMWPX-ZWNOBZJWSA-N 0 0 352.818 3.506 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N[C@@H](CC1CC1)c1ccccc1 ZINC000610348254 930060202 /nfs/dbraw/zinc/06/02/02/930060202.db2.gz WUDKEJJOPPDFAV-SFHVURJKSA-N 0 0 369.421 3.944 20 5 FHBDRN CSc1ccc(CCCC(=O)NCCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000572962735 937385769 /nfs/dbraw/zinc/38/57/69/937385769.db2.gz KIRMPSKVBRTTPS-UHFFFAOYSA-N 0 0 358.463 3.998 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H](c1cccnc1)C(C)C ZINC000177679525 930063816 /nfs/dbraw/zinc/06/38/16/930063816.db2.gz JIWXGTMUADDUHB-HNNXBMFYSA-N 0 0 358.398 3.560 20 5 FHBDRN CO[C@@H]1C[C@H](N(C)C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)C12CCC2 ZINC000458496618 937386029 /nfs/dbraw/zinc/38/60/29/937386029.db2.gz IHHPMFNLAAAYKI-RRQGHBQHSA-N 0 0 361.442 3.563 20 5 FHBDRN CCS[C@H]1CCC[C@H](NC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)C1 ZINC000176699077 937379637 /nfs/dbraw/zinc/37/96/37/937379637.db2.gz ATZZKTPIOCEPCI-GJZGRUSLSA-N 0 0 374.466 3.575 20 5 FHBDRN COc1ccccc1CCC(=O)Nc1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000176699509 937379780 /nfs/dbraw/zinc/37/97/80/937379780.db2.gz AWOIKZGTEXXHSY-UHFFFAOYSA-N 0 0 351.362 3.723 20 5 FHBDRN CCS[C@H]1CCC[C@@H](NC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)C1 ZINC000176699108 937379850 /nfs/dbraw/zinc/37/98/50/937379850.db2.gz ATZZKTPIOCEPCI-CABCVRRESA-N 0 0 374.466 3.575 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N(C)C[C@H](C)c1nccs1 ZINC000275736868 930073323 /nfs/dbraw/zinc/07/33/23/930073323.db2.gz BCLYFDYGUXTJRW-JTQLQIEISA-N 0 0 353.831 3.889 20 5 FHBDRN CN(C[C@H]1CCCCO1)C(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000275738198 930077372 /nfs/dbraw/zinc/07/73/72/930077372.db2.gz WVKAIXYPGAJXLK-OAHLLOKOSA-N 0 0 350.418 3.735 20 5 FHBDRN Cc1[nH]nc(NC(=O)c2ccc([N+](=O)[O-])n2C)c1-c1cccc(Cl)c1 ZINC000610354534 930103149 /nfs/dbraw/zinc/10/31/49/930103149.db2.gz IOCGRIJVZVGGCW-UHFFFAOYSA-N 0 0 359.773 3.538 20 5 FHBDRN O=C1Nc2ccccc2[C@H]1CCNc1cc(C(F)(F)F)ncc1[N+](=O)[O-] ZINC000583374856 937389315 /nfs/dbraw/zinc/38/93/15/937389315.db2.gz XLNZZFWWXMUBEA-SNVBAGLBSA-N 0 0 366.299 3.547 20 5 FHBDRN O=C(CCCCCc1ccc(O)cc1)NCCc1ccccc1[N+](=O)[O-] ZINC000610356945 930112048 /nfs/dbraw/zinc/11/20/48/930112048.db2.gz UFOSSGJWWSEFSP-UHFFFAOYSA-N 0 0 356.422 3.762 20 5 FHBDRN O=C(NC1CC1)c1ccc(N2CCc3c(Cl)cccc3C2)c([N+](=O)[O-])c1 ZINC000610076544 930165954 /nfs/dbraw/zinc/16/59/54/930165954.db2.gz RDZNYZQXDDRPOZ-UHFFFAOYSA-N 0 0 371.824 3.703 20 5 FHBDRN Cc1nc(C(C)(C)NC(=O)c2cccc(Cl)c2[N+](=O)[O-])sc1C ZINC000175888299 930198048 /nfs/dbraw/zinc/19/80/48/930198048.db2.gz VMXBCFMETVSMPH-UHFFFAOYSA-N 0 0 353.831 3.987 20 5 FHBDRN Cc1ccccc1[C@H](C)NC(=O)[C@@H](C)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000536008055 937398856 /nfs/dbraw/zinc/39/88/56/937398856.db2.gz OYTBKDXSRDHTHJ-JKSUJKDBSA-N 0 0 367.449 3.527 20 5 FHBDRN C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCN2c2ccc3cc([N+](=O)[O-])ccc3n2)C1 ZINC000580113582 930262702 /nfs/dbraw/zinc/26/27/02/930262702.db2.gz PWZUPARBOFBFHT-JXIYXGQPSA-N 0 0 355.438 3.909 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NCCCC(C)(C)COC ZINC000580115658 930267097 /nfs/dbraw/zinc/26/70/97/930267097.db2.gz RJLOALXAHAYUBL-UHFFFAOYSA-N 0 0 354.472 3.889 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)NCCSC(F)(F)F)cc1[N+](=O)[O-] ZINC000175901365 930277036 /nfs/dbraw/zinc/27/70/36/930277036.db2.gz JONIZTUMOHOXMP-SECBINFHSA-N 0 0 351.350 3.516 20 5 FHBDRN Cc1cccc2c1[C@H](C)C[C@H]2Cc1nc(-c2c([N+](=O)[O-])ncn2C)no1 ZINC000580127149 930287165 /nfs/dbraw/zinc/28/71/65/930287165.db2.gz YTEWOVJWDVSCSH-NEPJUHHUSA-N 0 0 353.382 3.520 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(=O)n1CCCCOc1cccc(C(F)(F)F)c1 ZINC000471544713 930304483 /nfs/dbraw/zinc/30/44/83/930304483.db2.gz CJKKZLVPJSFEJI-UHFFFAOYSA-N 0 0 370.327 3.943 20 5 FHBDRN CC(C)[C@H]1CC[C@@H](C)C[C@@H]1OC(=O)COc1cc(C=O)ccc1[N+](=O)[O-] ZINC000748154217 930341565 /nfs/dbraw/zinc/34/15/65/930341565.db2.gz LQNNZSGQDDJXBQ-UNEWFSDZSA-N 0 0 363.410 3.790 20 5 FHBDRN Cn1cc([C@@H](N[C@@H]2CCc3c2cccc3[N+](=O)[O-])c2ccc(F)cc2)cn1 ZINC000580216150 930372755 /nfs/dbraw/zinc/37/27/55/930372755.db2.gz OMGIXFXJQZVHJL-QUCCMNQESA-N 0 0 366.396 3.834 20 5 FHBDRN CC1(C)CC[C@]([NH2+]Cc2cccc([N+](=O)[O-])c2)(C(=O)[O-])c2ccccc21 ZINC000580224628 930378192 /nfs/dbraw/zinc/37/81/92/930378192.db2.gz VUUJSYWRLDINCA-HXUWFJFHSA-N 0 0 354.406 3.736 20 5 FHBDRN COCCn1ccc2ccc(NC(=O)/C=C\c3ccc([N+](=O)[O-])cc3)cc21 ZINC000255188067 930383925 /nfs/dbraw/zinc/38/39/25/930383925.db2.gz AZCXRMURLFGVJA-WTKPLQERSA-N 0 0 365.389 3.848 20 5 FHBDRN CCCN(C(=O)CC(C)(C)CC(=O)OCC)c1cccc([N+](=O)[O-])c1 ZINC000583404632 937413048 /nfs/dbraw/zinc/41/30/48/937413048.db2.gz DMSHXKVLLXTZAN-UHFFFAOYSA-N 0 0 350.415 3.707 20 5 FHBDRN COc1cc(CNC(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)ccc1C ZINC001125433091 930416437 /nfs/dbraw/zinc/41/64/37/930416437.db2.gz ZNCRKGOIAINSMG-UHFFFAOYSA-N 0 0 358.394 3.629 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCN(c3ccnc4c(Cl)cccc34)CC2)cn1 ZINC000579507838 930421196 /nfs/dbraw/zinc/42/11/96/930421196.db2.gz LCUOGDJJNKQSJM-UHFFFAOYSA-N 0 0 369.812 3.518 20 5 FHBDRN Cc1ccc2c(c1)N([C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C)CCC2 ZINC001167375956 930447258 /nfs/dbraw/zinc/44/72/58/930447258.db2.gz FKOAPNJYYKTSDP-HNNXBMFYSA-N 0 0 353.422 3.991 20 5 FHBDRN CC(C)COc1ccc(CC(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)cc1 ZINC000536352648 930473248 /nfs/dbraw/zinc/47/32/48/930473248.db2.gz CQYHAQOGWYNQNR-UHFFFAOYSA-N 0 0 368.393 3.687 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2nc(C3(c4ccccc4)CCOCC3)no2)s1 ZINC000579526791 930484231 /nfs/dbraw/zinc/48/42/31/930484231.db2.gz NTMCSWRSDWTWCL-UHFFFAOYSA-N 0 0 357.391 3.803 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(=O)n1CC/C=C/c1ccc(Br)cc1 ZINC000471559399 930522162 /nfs/dbraw/zinc/52/21/62/930522162.db2.gz NVTSOVBMICIASA-DUXPYHPUSA-N 0 0 363.211 3.931 20 5 FHBDRN Cc1cc(N[C@@H]2CCc3nc(-c4ccccc4)ncc3C2)ncc1[N+](=O)[O-] ZINC000610430891 930526362 /nfs/dbraw/zinc/52/63/62/930526362.db2.gz QFAADDQVIKFSEW-MRXNPFEDSA-N 0 0 361.405 3.725 20 5 FHBDRN CCc1noc(CC)c1CNC(=O)c1c(C)cc(Cl)cc1[N+](=O)[O-] ZINC000275870164 930559897 /nfs/dbraw/zinc/55/98/97/930559897.db2.gz OESWSWFMWFEMHA-UHFFFAOYSA-N 0 0 351.790 3.599 20 5 FHBDRN CCCC(=O)Nc1cccc(CNC(=O)Nc2cc(F)cc([N+](=O)[O-])c2)c1 ZINC000548087721 930590903 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C[C@H](NC(=O)Nc1nccn1-c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000581831629 932713824 /nfs/dbraw/zinc/71/38/24/932713824.db2.gz QGDQBWBEXKVMDE-ZDUSSCGKSA-N 0 0 351.366 3.663 20 5 FHBDRN CCCOc1ccc(CNc2ncccc2[N+](=O)[O-])c(OC(F)F)c1 ZINC000471737716 932748658 /nfs/dbraw/zinc/74/86/58/932748658.db2.gz QOKJMIUWJFXHPQ-UHFFFAOYSA-N 0 0 353.325 3.992 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)cnc1N(Cc1ccccc1)C[C@H](O)c1ccco1 ZINC000161041719 932754532 /nfs/dbraw/zinc/75/45/32/932754532.db2.gz VJPBFSCKQLZVLN-INIZCTEOSA-N 0 0 373.796 3.976 20 5 FHBDRN Cc1nn(C)c(N2CCC[C@H](c3nc4ccccc4s3)C2)c1[N+](=O)[O-] ZINC000051261829 932760442 /nfs/dbraw/zinc/76/04/42/932760442.db2.gz MDTLKAPNEZKHRC-LBPRGKRZSA-N 0 0 357.439 3.630 20 5 FHBDRN CC(C)(C)OC(=O)NC/C=C\CNc1ccc2ncccc2c1[N+](=O)[O-] ZINC000588432546 932805832 /nfs/dbraw/zinc/80/58/32/932805832.db2.gz BVMBZMAVRXBLHP-PLNGDYQASA-N 0 0 358.398 3.636 20 5 FHBDRN O=[N+]([O-])c1cc2ccccc2nc1N1CCC[C@@H](c2nnc(C3CC3)[nH]2)C1 ZINC000276661460 932820296 /nfs/dbraw/zinc/82/02/96/932820296.db2.gz RWNJBSPRGVPSEI-CQSZACIVSA-N 0 0 364.409 3.523 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1N1CCN(C(=O)CCCc2ccccc2)CC1 ZINC000548285018 932829966 /nfs/dbraw/zinc/82/99/66/932829966.db2.gz DXNLRAFWOUXENN-UHFFFAOYSA-N 0 0 367.449 3.575 20 5 FHBDRN CC(C)C(=O)c1cnccc1NC(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000187463541 932886925 /nfs/dbraw/zinc/88/69/25/932886925.db2.gz MISJVFLEJZKQFZ-LBPRGKRZSA-N 0 0 373.434 3.948 20 5 FHBDRN C[C@H](NC(=O)NCCc1c[nH]c2cc(F)ccc12)c1cccc([N+](=O)[O-])c1 ZINC000051279177 932893468 /nfs/dbraw/zinc/89/34/68/932893468.db2.gz LQYLEBBQIQQCBI-LBPRGKRZSA-N 0 0 370.384 3.818 20 5 FHBDRN CCOc1ccc(C(=O)N2C[C@H](C)Oc3cc(C)ccc32)cc1[N+](=O)[O-] ZINC000178222921 932910483 /nfs/dbraw/zinc/91/04/83/932910483.db2.gz JEPKMJIWMGPRPX-ZDUSSCGKSA-N 0 0 356.378 3.730 20 5 FHBDRN C[C@@H](NC(=O)c1cc([N+](=O)[O-])cn1C)c1ccc(Oc2cccnc2)cc1 ZINC000561624286 932920877 /nfs/dbraw/zinc/92/08/77/932920877.db2.gz WADZPIAXEQEECY-CYBMUJFWSA-N 0 0 366.377 3.612 20 5 FHBDRN COc1cccc(COC(=O)/C(C)=C\c2ccc([N+](=O)[O-])cc2)c1OC ZINC000588435536 932936052 /nfs/dbraw/zinc/93/60/52/932936052.db2.gz DABAODTXCLOALM-QBFSEMIESA-N 0 0 357.362 3.759 20 5 FHBDRN CCOc1cccc([C@H](C)NC(=O)[C@H]2C[C@H]2c2cccc([N+](=O)[O-])c2)c1 ZINC001125542201 932943491 /nfs/dbraw/zinc/94/34/91/932943491.db2.gz WLBXMJFLIWOIKO-AGRHKRQWSA-N 0 0 354.406 3.974 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(-c2nnco2)cc1 ZINC000588436530 932953608 /nfs/dbraw/zinc/95/36/08/932953608.db2.gz VCXMPKLXIBICIH-BENRWUELSA-N 0 0 350.334 3.687 20 5 FHBDRN CCOc1cc(C(=O)NC[C@H](CC)c2ccccc2)c([N+](=O)[O-])cc1OC ZINC000008403878 932957150 /nfs/dbraw/zinc/95/71/50/932957150.db2.gz SFDMMYIFEVKNFU-AWEZNQCLSA-N 0 0 372.421 3.926 20 5 FHBDRN CN(Cc1cc([N+](=O)[O-])ccc1Cl)C[C@H](O)c1cc(F)ccc1F ZINC000051286904 932958338 /nfs/dbraw/zinc/95/83/38/932958338.db2.gz GUEKWRBHRJCROV-INIZCTEOSA-N 0 0 356.756 3.692 20 5 FHBDRN CCC(=O)Nc1ccc(NC(=O)/C(C)=C\c2ccc([N+](=O)[O-])cc2)cc1 ZINC000588437024 932959763 /nfs/dbraw/zinc/95/97/63/932959763.db2.gz UHSBGKMLLUPVOG-SEYXRHQNSA-N 0 0 353.378 3.985 20 5 FHBDRN O=C(NC[C@H]1CCC2(CCCCC2)O1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000276688760 932976089 /nfs/dbraw/zinc/97/60/89/932976089.db2.gz GRMFWDUUDJTUSZ-GFCCVEGCSA-N 0 0 352.818 3.860 20 5 FHBDRN CC(C)c1ccc(C(=O)Nc2cnn(Cc3ccccn3)c2)cc1[N+](=O)[O-] ZINC000187579034 933010736 /nfs/dbraw/zinc/01/07/36/933010736.db2.gz QEPZYIMOZVCXFZ-UHFFFAOYSA-N 0 0 365.393 3.610 20 5 FHBDRN O=C(Oc1cc(F)cc(F)c1)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000749521067 933016563 /nfs/dbraw/zinc/01/65/63/933016563.db2.gz PMYKKNJXBWMEML-UHFFFAOYSA-N 0 0 358.094 3.855 20 5 FHBDRN O=[N+]([O-])c1ccccc1NCc1nc(-c2ccc(Br)o2)no1 ZINC000178278174 933021731 /nfs/dbraw/zinc/02/17/31/933021731.db2.gz IQOZKJLBJWJRKZ-UHFFFAOYSA-N 0 0 365.143 3.612 20 5 FHBDRN COc1ccc2c(c1)CN(C(=O)/C(C)=C\c1ccc([N+](=O)[O-])cc1)CC2 ZINC000588437479 933051836 /nfs/dbraw/zinc/05/18/36/933051836.db2.gz PUVTXJLVVUDCBI-KAMYIIQDSA-N 0 0 352.390 3.592 20 5 FHBDRN COC(=O)c1ccc(NC(=O)/C(C)=C\c2ccc([N+](=O)[O-])cc2)c(F)c1 ZINC000588438245 933055594 /nfs/dbraw/zinc/05/55/94/933055594.db2.gz KXWKYLOBUDANDE-LUAWRHEFSA-N 0 0 358.325 3.563 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(C[S@](C)=O)c1 ZINC000588438760 933057583 /nfs/dbraw/zinc/05/75/83/933057583.db2.gz LEQACDBMCGUJIU-VPUOEENPSA-N 0 0 358.419 3.515 20 5 FHBDRN CCOc1cc(CNC(=O)/C(C)=C\c2ccc([N+](=O)[O-])cc2)ccc1OC ZINC000588439196 933062871 /nfs/dbraw/zinc/06/28/71/933062871.db2.gz XJRSKOQSXQUUSO-KAMYIIQDSA-N 0 0 370.405 3.722 20 5 FHBDRN C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)Nc1cnn([C@@H](C)C2CC2)c1 ZINC000187621891 933066345 /nfs/dbraw/zinc/06/63/45/933066345.db2.gz NHYHZPVFKVLVIA-STQMWFEESA-N 0 0 357.414 3.592 20 5 FHBDRN CCCOc1ncccc1CNC(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000175999383 933073263 /nfs/dbraw/zinc/07/32/63/933073263.db2.gz PSBHDAAWDQEBOJ-AWEZNQCLSA-N 0 0 372.425 3.647 20 5 FHBDRN COCCC1(CNC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCCC1 ZINC000471830484 933078419 /nfs/dbraw/zinc/07/84/19/933078419.db2.gz BQZHDNVFAPGZJK-UHFFFAOYSA-N 0 0 374.359 3.940 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H]1CCN(c2ccccc2)C1 ZINC000588444091 933097623 /nfs/dbraw/zinc/09/76/23/933097623.db2.gz PTJMWIFFEVITDZ-ZUTYSQTGSA-N 0 0 365.433 3.641 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000588444169 933098116 /nfs/dbraw/zinc/09/81/16/933098116.db2.gz LWTXDOFAQUHAGL-LUQQZNFBSA-N 0 0 370.380 3.737 20 5 FHBDRN CC(=Cc1ccc([N+](=O)[O-])cc1)C(=O)OCc1cc2ccccc2[nH]c1=O ZINC000588445155 933111622 /nfs/dbraw/zinc/11/16/22/933111622.db2.gz NCZKARAABWGPJO-RAXLEYEMSA-N 0 0 364.357 3.995 20 5 FHBDRN C[C@@H]1CC[C@H](c2ccccc2)N(S(=O)(=O)c2ccc([N+](=O)[O-])s2)C1 ZINC000510557409 933223548 /nfs/dbraw/zinc/22/35/48/933223548.db2.gz DPXCRZOADKZFPP-TZMCWYRMSA-N 0 0 366.464 3.818 20 5 FHBDRN Cc1cccc([C@H]2CCN(C(=O)COc3ccc([N+](=O)[O-])c(C)c3)C2)c1 ZINC000430786368 933230523 /nfs/dbraw/zinc/23/05/23/933230523.db2.gz APRRPEISJHBUNC-KRWDZBQOSA-N 0 0 354.406 3.607 20 5 FHBDRN Cc1cc(OCC(=O)Nc2ccc(OC3CCC3)c(F)c2)ccc1[N+](=O)[O-] ZINC000430781190 933233565 /nfs/dbraw/zinc/23/35/65/933233565.db2.gz ARYUZHKPRTWOQL-UHFFFAOYSA-N 0 0 374.368 3.991 20 5 FHBDRN Cc1cc(OCC(=O)N2[C@H](C)Cc3cc(F)ccc3[C@H]2C)ccc1[N+](=O)[O-] ZINC000430802219 933238414 /nfs/dbraw/zinc/23/84/14/933238414.db2.gz KKRCOCFWWUBANC-ZIAGYGMSSA-N 0 0 372.396 3.956 20 5 FHBDRN C/C=C\c1ccc(NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OCC)cc1 ZINC000510578754 933243789 /nfs/dbraw/zinc/24/37/89/933243789.db2.gz ISFYZMLSZJSMHZ-HYXAFXHYSA-N 0 0 369.377 3.604 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1ncc(C(C)=O)s1 ZINC000157993613 933248618 /nfs/dbraw/zinc/24/86/18/933248618.db2.gz VVGIMKZWKSLEAS-UHFFFAOYSA-N 0 0 351.409 3.618 20 5 FHBDRN CCn1cnnc1-c1ccccc1NC(=O)/C=C\c1ccc([N+](=O)[O-])cc1 ZINC000255398027 933249225 /nfs/dbraw/zinc/24/92/25/933249225.db2.gz LOGMVSCQGIDUBK-XFXZXTDPSA-N 0 0 363.377 3.525 20 5 FHBDRN CCOc1cc(C(=O)NCC[C@@H]2CCCC[C@@H]2C)c([N+](=O)[O-])cc1OC ZINC000510587493 933249747 /nfs/dbraw/zinc/24/97/47/933249747.db2.gz HBXZZJUQRYXXQI-KBPBESRZSA-N 0 0 364.442 3.948 20 5 FHBDRN CCSc1nccnc1C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000430812893 933263798 /nfs/dbraw/zinc/26/37/98/933263798.db2.gz GMOBKJPQXDUEBT-UHFFFAOYSA-N 0 0 372.328 3.768 20 5 FHBDRN CCOc1ccccc1OCCOc1ccc([N+](=O)[O-])c2ncccc12 ZINC000471865943 933266861 /nfs/dbraw/zinc/26/68/61/933266861.db2.gz OIGJIWUTABFPFA-UHFFFAOYSA-N 0 0 354.362 4.000 20 5 FHBDRN C/C=C\c1ccc(NC(=O)C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)cc1 ZINC000510610891 933282591 /nfs/dbraw/zinc/28/25/91/933282591.db2.gz LBUKYPIGUDXMKQ-PLNGDYQASA-N 0 0 353.378 3.822 20 5 FHBDRN Cc1cc(OCC(=O)Nc2ccc(F)cc2OC(C)C)ccc1[N+](=O)[O-] ZINC000430834292 933285910 /nfs/dbraw/zinc/28/59/10/933285910.db2.gz WOESSGDGWBSGQJ-UHFFFAOYSA-N 0 0 362.357 3.847 20 5 FHBDRN Cc1cc(OCC(=O)N[C@@H]2CC[C@@H](c3ccc(F)cc3)C2)ccc1[N+](=O)[O-] ZINC000430836181 933293178 /nfs/dbraw/zinc/29/31/78/933293178.db2.gz DLLOVSCVMYVZBJ-NVXWUHKLSA-N 0 0 372.396 3.874 20 5 FHBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2[C@@H]3CC[C@H]2C[C@@H](c2ccccc2)C3)cc1 ZINC000510618610 933293679 /nfs/dbraw/zinc/29/36/79/933293679.db2.gz ZIUDAKQQHKUDOZ-VBUUOAMHSA-N 0 0 372.446 3.694 20 5 FHBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)NC[C@@H]1CCC(F)(F)C1 ZINC000430850343 933316376 /nfs/dbraw/zinc/31/63/76/933316376.db2.gz UUYVYHCROJTPEW-CQSZACIVSA-N 0 0 355.385 3.652 20 5 FHBDRN C[C@@H]1CO[C@H](c2ccccc2)CN1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610581369 933318837 /nfs/dbraw/zinc/31/88/37/933318837.db2.gz LNHNYIXWXDRVJY-ACJLOTCBSA-N 0 0 353.378 3.698 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CCC[C@H]2OCc2ccccc2)c1 ZINC000430866147 933339082 /nfs/dbraw/zinc/33/90/82/933339082.db2.gz YLSHYRNPUIPVBA-PKOBYXMFSA-N 0 0 354.406 3.771 20 5 FHBDRN Cc1cc(C)cc([C@@H]2NC(=O)N([C@@H](C)c3cccc([N+](=O)[O-])c3)C2=O)c1 ZINC000430878175 933342479 /nfs/dbraw/zinc/34/24/79/933342479.db2.gz MCARNYQKCSEZMA-GUYCJALGSA-N 0 0 353.378 3.566 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)ccc1CN[C@@H](Cn1cccn1)c1ccccc1 ZINC000610582744 933358408 /nfs/dbraw/zinc/35/84/08/933358408.db2.gz UMGJUULGTQOXPP-KRWDZBQOSA-N 0 0 356.813 3.976 20 5 FHBDRN Cc1[nH]nc(C(=O)Nc2ccc(SCc3ccccc3)cn2)c1[N+](=O)[O-] ZINC000611087014 933436624 /nfs/dbraw/zinc/43/66/24/933436624.db2.gz GDXWREKFYRFXDQ-UHFFFAOYSA-N 0 0 369.406 3.566 20 5 FHBDRN COc1ccc(-c2ccc(CN3CCO[C@@H]4CCC[C@@H]43)o2)c([N+](=O)[O-])c1 ZINC000510693843 933441771 /nfs/dbraw/zinc/44/17/71/933441771.db2.gz UBQRXOPFDIWEES-QFBILLFUSA-N 0 0 358.394 3.617 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)C[C@H](C)C(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000610599102 933492315 /nfs/dbraw/zinc/49/23/15/933492315.db2.gz RGJITJHQIFDEOM-GJZGRUSLSA-N 0 0 354.406 3.990 20 5 FHBDRN CSc1ccc(C(=O)NCc2c(F)c(F)cc(F)c2F)cc1[N+](=O)[O-] ZINC000610602934 933509072 /nfs/dbraw/zinc/50/90/72/933509072.db2.gz KACNEZQPBPCWOZ-UHFFFAOYSA-N 0 0 374.315 3.803 20 5 FHBDRN CCc1ccc(C(=O)N2CCC[C@H]2c2ccc3c(c2)OCO3)cc1[N+](=O)[O-] ZINC000471890960 933511793 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/nfs/dbraw/zinc/27/68/09/935276809.db2.gz IMHNMWRPCCFZIV-UHFFFAOYSA-N 0 0 350.128 3.976 20 5 FHBDRN CN(C(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(Br)cc1F ZINC000065863878 935280232 /nfs/dbraw/zinc/28/02/32/935280232.db2.gz WJNNCBJAIHXNID-UHFFFAOYSA-N 0 0 353.147 3.773 20 5 FHBDRN COC(=O)[C@@H](C)[C@@H](NC(=O)Nc1ccc(C)c([N+](=O)[O-])c1)c1ccccc1 ZINC000119846876 935281039 /nfs/dbraw/zinc/28/10/39/935281039.db2.gz MUCPICBSFCNOED-SUMWQHHRSA-N 0 0 371.393 3.575 20 5 FHBDRN CC1(C)[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)[C@@H]2CCCO[C@@H]21 ZINC000551455109 935281172 /nfs/dbraw/zinc/28/11/72/935281172.db2.gz SPRVFUHZMADJPF-GDLCADMTSA-N 0 0 372.343 3.547 20 5 FHBDRN Cc1ccc(NC(=O)Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)c(F)c1 ZINC000539758775 935291722 /nfs/dbraw/zinc/29/17/22/935291722.db2.gz SXUJXGPETHPNPM-UHFFFAOYSA-N 0 0 354.341 3.545 20 5 FHBDRN CCOc1ccc(NC(=O)[C@@H]2C[C@@H]2c2cccc([N+](=O)[O-])c2)cc1OC ZINC001125582982 935296137 /nfs/dbraw/zinc/29/61/37/935296137.db2.gz INOWCKXYVMWHJA-HZPDHXFCSA-N 0 0 356.378 3.744 20 5 FHBDRN CCOc1ccc(NC(=O)[C@H]2C[C@H]2c2cccc([N+](=O)[O-])c2)cc1OC ZINC001125582981 935296301 /nfs/dbraw/zinc/29/63/01/935296301.db2.gz INOWCKXYVMWHJA-HOTGVXAUSA-N 0 0 356.378 3.744 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCc2cc(F)ccc2C1 ZINC000092009003 935300789 /nfs/dbraw/zinc/30/07/89/935300789.db2.gz AVFPFNMENIGSMK-LBPRGKRZSA-N 0 0 360.410 3.799 20 5 FHBDRN CCc1nc(C)c([C@@H](C)N(C)C(=O)c2cc(F)ccc2[N+](=O)[O-])s1 ZINC000119875107 935311667 /nfs/dbraw/zinc/31/16/67/935311667.db2.gz BMUBTXXSWOGRMX-SNVBAGLBSA-N 0 0 351.403 3.894 20 5 FHBDRN CC[C@@H](NC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-])c1ccncc1 ZINC000158085602 935315113 /nfs/dbraw/zinc/31/51/13/935315113.db2.gz HIORFFRJNCMEAF-CQSZACIVSA-N 0 0 363.801 3.680 20 5 FHBDRN CC(C)Oc1ncccc1C(=O)Nc1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000551647275 935324166 /nfs/dbraw/zinc/32/41/66/935324166.db2.gz WURXVZQZPXYEJU-UHFFFAOYSA-N 0 0 352.350 3.578 20 5 FHBDRN CC(C)[C@H](CC(=O)OCC(=O)Nc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000728476384 935324335 /nfs/dbraw/zinc/32/43/35/935324335.db2.gz YWXKQCSUKGSIFG-SFHVURJKSA-N 0 0 370.405 3.906 20 5 FHBDRN C[C@@H](Cn1ncc2ccccc21)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000551658459 935324802 /nfs/dbraw/zinc/32/48/02/935324802.db2.gz QLIXEZWQBZCQHN-LBPRGKRZSA-N 0 0 372.812 3.550 20 5 FHBDRN Cc1ccc(C[C@H]2CCCN2C(=O)Cc2cccc([N+](=O)[O-])c2C)cc1 ZINC000438832397 945093034 /nfs/dbraw/zinc/09/30/34/945093034.db2.gz FIVSGJXODQBLSM-LJQANCHMSA-N 0 0 352.434 3.988 20 5 FHBDRN Cc1ccn(-c2ccc(NC(=O)Cc3cccc([N+](=O)[O-])c3C)cc2)n1 ZINC000551699369 935336206 /nfs/dbraw/zinc/33/62/06/935336206.db2.gz ZZAWXYIVDIAUPV-UHFFFAOYSA-N 0 0 350.378 3.579 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)NCCc2cc3ccccc3[nH]2)c1 ZINC000119931797 935337430 /nfs/dbraw/zinc/33/74/30/935337430.db2.gz GONKFFDXZKIFPQ-UHFFFAOYSA-N 0 0 367.405 3.512 20 5 FHBDRN O=C(c1ccccc1[N+](=O)[O-])N1CCC[C@H](c2nc3c(s2)CCCC3)C1 ZINC000119957031 935361500 /nfs/dbraw/zinc/36/15/00/935361500.db2.gz JQNHXCVKUHMNQL-ZDUSSCGKSA-N 0 0 371.462 3.950 20 5 FHBDRN CCOc1ccc(C(=O)Nc2cn(C)nc2-c2ccccc2)cc1[N+](=O)[O-] ZINC000091146271 935394729 /nfs/dbraw/zinc/39/47/29/935394729.db2.gz MYDNGGRFFGTIRW-UHFFFAOYSA-N 0 0 366.377 3.646 20 5 FHBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N1CC(C(F)(F)F)C1 ZINC000551989655 935396657 /nfs/dbraw/zinc/39/66/57/935396657.db2.gz YRDJVZGNQHFMKE-UHFFFAOYSA-N 0 0 362.373 3.977 20 5 FHBDRN CCc1c(C(=O)CNc2ccc(Cl)c([N+](=O)[O-])c2)[nH]c(C)c1C(C)=O ZINC000085268830 935403095 /nfs/dbraw/zinc/40/30/95/935403095.db2.gz KXPYMVPFWVZNQI-UHFFFAOYSA-N 0 0 363.801 3.945 20 5 FHBDRN Cc1csc(Oc2ccc(NC(=O)c3ccc([N+](=O)[O-])cn3)cc2F)n1 ZINC000552010062 935403866 /nfs/dbraw/zinc/40/38/66/935403866.db2.gz BSNGUXBONRLBKV-UHFFFAOYSA-N 0 0 374.353 3.938 20 5 FHBDRN Cc1nn(CCC(=O)N(C)[C@@H](C)c2ccc(Cl)cc2)c(C)c1[N+](=O)[O-] ZINC000263729783 935419449 /nfs/dbraw/zinc/41/94/49/935419449.db2.gz ZUSILXCTLZTNRT-LBPRGKRZSA-N 0 0 364.833 3.671 20 5 FHBDRN COc1ccccc1CN(C(=O)Nc1cc([N+](=O)[O-])ccc1OC)C1CC1 ZINC000047320049 945101095 /nfs/dbraw/zinc/10/10/95/945101095.db2.gz BWYJWJFYXCZZAI-UHFFFAOYSA-N 0 0 371.393 3.809 20 5 FHBDRN O=c1onc(-c2ccc([N+](=O)[O-])cc2)n1CC1CCC(C(F)(F)F)CC1 ZINC000472207628 935466082 /nfs/dbraw/zinc/46/60/82/935466082.db2.gz QJEDOAPYVXFKFU-UHFFFAOYSA-N 0 0 371.315 3.780 20 5 FHBDRN Cc1ccc(C(C)(C)CNC(=O)COc2ccc([N+](=O)[O-])c(F)c2)cc1 ZINC000728485090 935479279 /nfs/dbraw/zinc/47/92/79/935479279.db2.gz QVKHWLLSWYBDOP-UHFFFAOYSA-N 0 0 360.385 3.515 20 5 FHBDRN C/C(=C/C(=O)N1CCO[C@@H](c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000785123712 935486380 /nfs/dbraw/zinc/48/63/80/935486380.db2.gz IUPLIASTJLSUJK-RXHHAWBHSA-N 0 0 352.390 3.598 20 5 FHBDRN O=C(CNc1cc([N+](=O)[O-])ccc1OC(F)F)Nc1cccc(Cl)c1 ZINC000511096421 935488519 /nfs/dbraw/zinc/48/85/19/935488519.db2.gz RYSGXFKSGCGPDV-UHFFFAOYSA-N 0 0 371.727 3.900 20 5 FHBDRN C[C@@H](c1ccco1)N(C)c1nnc(-c2cccc([N+](=O)[O-])c2)n1C1CC1 ZINC000582307561 935508063 /nfs/dbraw/zinc/50/80/63/935508063.db2.gz QXTHFPKYZXAVFY-LBPRGKRZSA-N 0 0 353.382 3.979 20 5 FHBDRN Cc1c(CC(=O)N2CCC[C@@H]2c2ccc3c(c2)OCO3)cccc1[N+](=O)[O-] ZINC000120055743 935510566 /nfs/dbraw/zinc/51/05/66/935510566.db2.gz OCJYSESDXFYNAT-QGZVFWFLSA-N 0 0 368.389 3.538 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)Nc2nc3ccsc3s2)c1 ZINC000540624879 935513589 /nfs/dbraw/zinc/51/35/89/935513589.db2.gz SJBMQKKHVJPHLR-UHFFFAOYSA-N 0 0 363.420 3.982 20 5 FHBDRN COc1ccc(-c2cnc(NC(=O)c3c(C)cccc3[N+](=O)[O-])n2C)cc1 ZINC000582323647 935523154 /nfs/dbraw/zinc/52/31/54/935523154.db2.gz JLIATEDFTGBJIH-UHFFFAOYSA-N 0 0 366.377 3.565 20 5 FHBDRN COc1ccccc1C[C@@H](C)N(C)C(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000582337803 935539126 /nfs/dbraw/zinc/53/91/26/935539126.db2.gz GGDDHEXWMZCYOT-CABCVRRESA-N 0 0 356.422 3.797 20 5 FHBDRN CNc1nccc(C(=O)Nc2ccc(C(C)C)cc2C(C)C)c1[N+](=O)[O-] ZINC000516660600 945107811 /nfs/dbraw/zinc/10/78/11/945107811.db2.gz CMOVYPGAICGSFB-UHFFFAOYSA-N 0 0 356.426 3.953 20 5 FHBDRN Cc1cc2sc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3N)nc2cc1F ZINC000478069479 935562469 /nfs/dbraw/zinc/56/24/69/935562469.db2.gz UJQDPDJKJKLQHS-UHFFFAOYSA-N 0 0 364.333 3.626 20 5 FHBDRN CCOc1cccc(CNC(=O)Nc2cc([N+](=O)[O-])ccc2OCC)c1 ZINC000439934743 945108865 /nfs/dbraw/zinc/10/88/65/945108865.db2.gz SFTRVPMFFUXKRU-UHFFFAOYSA-N 0 0 359.382 3.714 20 5 FHBDRN C[C@H](Cc1ccc(O)cc1)N(C)C(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000120085157 935578600 /nfs/dbraw/zinc/57/86/00/935578600.db2.gz FLLTUOHFABZHDZ-KGLIPLIRSA-N 0 0 374.462 3.871 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@H]1CCN(c2cccc(Cl)c2)C1 ZINC000176316532 935584144 /nfs/dbraw/zinc/58/41/44/935584144.db2.gz RTEJYXYFSMIUBJ-AWEZNQCLSA-N 0 0 359.813 3.565 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1C[C@H]1c1ccc(OC(F)F)cc1 ZINC000478171293 935588136 /nfs/dbraw/zinc/58/81/36/935588136.db2.gz FILMHJWEXSQVTR-UONOGXRCSA-N 0 0 362.332 3.791 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N(C)[C@@H](C)Cc1ccc(O)cc1 ZINC000120084731 935588813 /nfs/dbraw/zinc/58/88/13/935588813.db2.gz FLLTUOHFABZHDZ-UONOGXRCSA-N 0 0 374.462 3.871 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@H]1c1ccc(OC(F)F)cc1 ZINC000478209706 935592271 /nfs/dbraw/zinc/59/22/71/935592271.db2.gz SOMGLALHQZLUBZ-JKSUJKDBSA-N 0 0 362.332 3.791 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[C@@H](c2cccc(F)c2)C1 ZINC000478266021 935594990 /nfs/dbraw/zinc/59/49/90/935594990.db2.gz JMVLESLDSODMDI-HIFRSBDPSA-N 0 0 358.369 3.809 20 5 FHBDRN COC(=O)c1cnc(NCCc2ccc3ccccc3c2)c([N+](=O)[O-])c1 ZINC000478282034 935605446 /nfs/dbraw/zinc/60/54/46/935605446.db2.gz PXSBWCQSDYPLOU-UHFFFAOYSA-N 0 0 351.362 3.584 20 5 FHBDRN COc1cc(C(=O)N[C@@H](C)c2ccc(F)cc2F)cc([N+](=O)[O-])c1C ZINC000478281583 935605480 /nfs/dbraw/zinc/60/54/80/935605480.db2.gz MHCPILWRAIZGRR-JTQLQIEISA-N 0 0 350.321 3.681 20 5 FHBDRN CC[C@@H](C)c1ncc(NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)cn1 ZINC000478278085 935606107 /nfs/dbraw/zinc/60/61/07/935606107.db2.gz IXJMXFNLODDWQP-LLVKDONJSA-N 0 0 353.382 3.561 20 5 FHBDRN COC(=O)[C@H](c1cccc(Cl)c1)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000511109447 935611826 /nfs/dbraw/zinc/61/18/26/935611826.db2.gz OCCAKYHEBNEGDF-KRWDZBQOSA-N 0 0 362.813 3.637 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)N2CCC[C@@H]([C@H]3CCOC3)C2)cc1[N+](=O)[O-] ZINC000439937801 945112173 /nfs/dbraw/zinc/11/21/73/945112173.db2.gz YTFQXNHLTNVXLC-CVEARBPZSA-N 0 0 360.454 3.781 20 5 FHBDRN CN(C(=O)CCc1ncc(-c2ccccc2)o1)c1cccc([N+](=O)[O-])c1 ZINC000158194123 935620173 /nfs/dbraw/zinc/62/01/73/935620173.db2.gz NUXPOWWWXVIVFL-UHFFFAOYSA-N 0 0 351.362 3.845 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)N1CC[C@H](CC(F)(F)F)C1 ZINC000277574998 935622593 /nfs/dbraw/zinc/62/25/93/935622593.db2.gz LHFUYPHNHPYOLG-GFCCVEGCSA-N 0 0 359.348 3.588 20 5 FHBDRN COc1cc(OCC(=O)N[C@H]2CC(C)(C)c3ccccc32)ccc1[N+](=O)[O-] ZINC000158202024 935632575 /nfs/dbraw/zinc/63/25/75/935632575.db2.gz LDLVSOHHPIKQGY-INIZCTEOSA-N 0 0 370.405 3.521 20 5 FHBDRN COc1cc(OC2CC2)ccc1C(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000478490840 935636123 /nfs/dbraw/zinc/63/61/23/935636123.db2.gz NLMSUIZVXRIUCY-ZDUSSCGKSA-N 0 0 370.405 3.944 20 5 FHBDRN Cc1c(CN[C@H](c2ccn(C)n2)c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000478498241 935637064 /nfs/dbraw/zinc/63/70/64/935637064.db2.gz NJDBZDRGQMDCTP-IBGZPJMESA-N 0 0 354.385 3.655 20 5 FHBDRN CN(C(=O)c1c(F)cc(Br)cc1F)c1cccc([N+](=O)[O-])c1 ZINC000158227407 935639096 /nfs/dbraw/zinc/63/90/96/935639096.db2.gz YRZWSJOIUKFEDU-UHFFFAOYSA-N 0 0 371.137 3.912 20 5 FHBDRN COc1ccccc1-c1nn(C)cc1C(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000127587449 935640113 /nfs/dbraw/zinc/64/01/13/935640113.db2.gz WMFPXKOYDPCXRC-UHFFFAOYSA-N 0 0 366.377 3.565 20 5 FHBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@H](C)[C@@H]1C ZINC000540766069 935647417 /nfs/dbraw/zinc/64/74/17/935647417.db2.gz VSSSAPKYPUMOMP-STQMWFEESA-N 0 0 352.456 3.736 20 5 FHBDRN CC(C)[C@@H]1CN(C(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])CCS1 ZINC000437202738 945114451 /nfs/dbraw/zinc/11/44/51/945114451.db2.gz XLKWYQLXABETGR-NHYWBVRUSA-N 0 0 372.874 3.616 20 5 FHBDRN CN(C(=O)Cc1csc(-c2cccs2)n1)c1cccc([N+](=O)[O-])c1 ZINC000158245996 935658826 /nfs/dbraw/zinc/65/88/26/935658826.db2.gz VSJTWQYULHEFSF-UHFFFAOYSA-N 0 0 359.432 3.985 20 5 FHBDRN Cc1c(CNC(=O)NCCCc2c[nH]c3ccccc23)cccc1[N+](=O)[O-] ZINC000478611896 935664981 /nfs/dbraw/zinc/66/49/81/935664981.db2.gz XJSDUKFHZZEQBR-UHFFFAOYSA-N 0 0 366.421 3.817 20 5 FHBDRN CC(C)c1ncc(NC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])cn1 ZINC000478638308 935669316 /nfs/dbraw/zinc/66/93/16/935669316.db2.gz ZORLKESKBLPPMV-UHFFFAOYSA-N 0 0 364.789 3.569 20 5 FHBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1cc(Cl)ccn1 ZINC000511118389 935669320 /nfs/dbraw/zinc/66/93/20/935669320.db2.gz CCHINIUYPUBREQ-QMMMGPOBSA-N 0 0 356.165 3.703 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N[C@H](C)c1ccc(NC(N)=O)cc1 ZINC000127625910 935670907 /nfs/dbraw/zinc/67/09/07/935670907.db2.gz UBYZFBVEQMFYBZ-GFCCVEGCSA-N 0 0 371.397 3.585 20 5 FHBDRN Cc1nn(C)c(C(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)c1[N+](=O)[O-] ZINC000127627914 935671004 /nfs/dbraw/zinc/67/10/04/935671004.db2.gz ZPSSOMWGYQCEQG-UHFFFAOYSA-N 0 0 362.695 3.561 20 5 FHBDRN COc1cc(Cc2noc(-c3cc(F)c(F)c(F)c3)n2)ccc1[N+](=O)[O-] ZINC000545069953 935682928 /nfs/dbraw/zinc/68/29/28/935682928.db2.gz FDCTYXGTCPYMNL-UHFFFAOYSA-N 0 0 365.267 3.662 20 5 FHBDRN CCOc1cc(OCc2nnc(-c3ccc(OC)cc3)o2)ccc1[N+](=O)[O-] ZINC000478720950 935686611 /nfs/dbraw/zinc/68/66/11/935686611.db2.gz PDVXDKHEKNOFSL-UHFFFAOYSA-N 0 0 371.349 3.631 20 5 FHBDRN C[C@@H](SCc1ccc2c(c1)OCO2)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000478738913 935694609 /nfs/dbraw/zinc/69/46/09/935694609.db2.gz OBFYJQFCTSRESE-LLVKDONJSA-N 0 0 360.391 3.584 20 5 FHBDRN CC(C)c1nnc([C@@H]2CCCCN2c2ncc(Cl)cc2[N+](=O)[O-])[nH]1 ZINC000582447274 935721530 /nfs/dbraw/zinc/72/15/30/935721530.db2.gz DTEQHSGEXCPCGP-NSHDSACASA-N 0 0 350.810 3.616 20 5 FHBDRN Cc1cc(NC(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])cc(C)c1O ZINC000478810444 935729426 /nfs/dbraw/zinc/72/94/26/935729426.db2.gz DOSPJZDLHFLSSI-LLVKDONJSA-N 0 0 364.785 3.977 20 5 FHBDRN O=C(N[C@H](CCc1ccccc1)C(F)(F)F)c1ccc([N+](=O)[O-])s1 ZINC000478832662 935736076 /nfs/dbraw/zinc/73/60/76/935736076.db2.gz MNAMBXQWDYIGTM-GFCCVEGCSA-N 0 0 358.341 3.950 20 5 FHBDRN Cn1nccc1-c1cc(F)ccc1OCCOc1ccc([N+](=O)[O-])cc1 ZINC000478840529 935739472 /nfs/dbraw/zinc/73/94/72/935739472.db2.gz SBQLIKMGJJCUIH-UHFFFAOYSA-N 0 0 357.341 3.592 20 5 FHBDRN CC(C)(C)OC(=O)CCSc1ncc(Br)cc1[N+](=O)[O-] ZINC000431418520 935743275 /nfs/dbraw/zinc/74/32/75/935743275.db2.gz MCYKOIOTWUZZFZ-UHFFFAOYSA-N 0 0 363.233 3.576 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N[C@@H](C)c1nc(C(C)(C)C)no1 ZINC000127693950 935743407 /nfs/dbraw/zinc/74/34/07/935743407.db2.gz FHKBGQDRKDKYMU-NSHDSACASA-N 0 0 361.402 3.775 20 5 FHBDRN Cc1c(CNC(=O)N[C@H](c2ccccc2)[C@H]2CCCO2)cccc1[N+](=O)[O-] ZINC000478867009 935746044 /nfs/dbraw/zinc/74/60/44/935746044.db2.gz HYAQBYSFDKBZBZ-RTBURBONSA-N 0 0 369.421 3.623 20 5 FHBDRN Cn1c(Sc2ccc([N+](=O)[O-])c(OC(F)F)c2)nnc1C1CCC1 ZINC000302061398 935757234 /nfs/dbraw/zinc/75/72/34/935757234.db2.gz TVPQHJNMLBGZLJ-UHFFFAOYSA-N 0 0 356.354 3.743 20 5 FHBDRN Cc1c(OC(=O)CCc2nc(-c3cccs3)no2)cccc1[N+](=O)[O-] ZINC000051705138 935757467 /nfs/dbraw/zinc/75/74/67/935757467.db2.gz QLWMCWRVMKALPT-UHFFFAOYSA-N 0 0 359.363 3.553 20 5 FHBDRN COC(=O)c1ccc(Cl)c(CN2CCc3ccc([N+](=O)[O-])cc3C2)c1 ZINC000511135013 935759832 /nfs/dbraw/zinc/75/98/32/935759832.db2.gz MNFXCRXUNHANHH-UHFFFAOYSA-N 0 0 360.797 3.593 20 5 FHBDRN CC[C@]1(c2ccc(C)cc2)CC(=O)N(Cc2cccc([N+](=O)[O-])c2)C1=O ZINC000158381112 935765515 /nfs/dbraw/zinc/76/55/15/935765515.db2.gz ZSRVFZHSCUMOPP-HXUWFJFHSA-N 0 0 352.390 3.510 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NCCc1ccc(C)c(OC)c1 ZINC000158381880 935765642 /nfs/dbraw/zinc/76/56/42/935765642.db2.gz GNUDFIFONNEWGV-UHFFFAOYSA-N 0 0 374.462 3.996 20 5 FHBDRN C[C@H]1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C[C@H]1n1ccnc1 ZINC000127744658 935767683 /nfs/dbraw/zinc/76/76/83/935767683.db2.gz FQOXLNUWQMGTHW-XHDPSFHLSA-N 0 0 363.805 3.560 20 5 FHBDRN COc1ccc(NC(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)cc1 ZINC000509572449 945122566 /nfs/dbraw/zinc/12/25/66/945122566.db2.gz QQEWGMXQGTWBSZ-UHFFFAOYSA-N 0 0 365.183 3.927 20 5 FHBDRN CCN(Cc1ccc2c(c1)OCO2)C(=O)Nc1c(C)ccc([N+](=O)[O-])c1C ZINC000127762864 935784947 /nfs/dbraw/zinc/78/49/47/935784947.db2.gz LAINQQJAOOORTC-UHFFFAOYSA-N 0 0 371.393 3.994 20 5 FHBDRN O=C(N[C@H]1CCO[C@H](c2ccccc2)C1)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000158422831 935785998 /nfs/dbraw/zinc/78/59/98/935785998.db2.gz XVOMAZQIAFVLIS-LIRRHRJNSA-N 0 0 365.389 3.726 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(N2CCC[C@H]2c2ccc3c(c2)OCCO3)n1 ZINC000611615593 935788302 /nfs/dbraw/zinc/78/83/02/935788302.db2.gz IPQMNOXRGBTJDC-HNNXBMFYSA-N 0 0 355.394 3.719 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(N2CCC[C@@H]2c2ccc3c(c2)OCCO3)n1 ZINC000611615594 935788314 /nfs/dbraw/zinc/78/83/14/935788314.db2.gz IPQMNOXRGBTJDC-OAHLLOKOSA-N 0 0 355.394 3.719 20 5 FHBDRN Cc1cccc(OCCNC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1 ZINC000127787336 935791389 /nfs/dbraw/zinc/79/13/89/935791389.db2.gz AONGLRQXBXBMIT-UHFFFAOYSA-N 0 0 369.421 3.656 20 5 FHBDRN COc1cccc2c1OC[C@@H](Nc1ccc([N+](=O)[O-])c3cnccc13)C2 ZINC000077358206 935799469 /nfs/dbraw/zinc/79/94/69/935799469.db2.gz QCPQUOIZZBJRIB-ZDUSSCGKSA-N 0 0 351.362 3.567 20 5 FHBDRN CN(C(=O)c1cc(Cl)nc(N2CCCC2)c1)c1cccc([N+](=O)[O-])c1 ZINC000158446057 935806163 /nfs/dbraw/zinc/80/61/63/935806163.db2.gz WLDNRLXIUSLAFY-UHFFFAOYSA-N 0 0 360.801 3.520 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@](C)(c2ccc(F)cc2)C1 ZINC000431440196 935809885 /nfs/dbraw/zinc/80/98/85/935809885.db2.gz YXGZAXAERBMWGO-IBGZPJMESA-N 0 0 373.384 3.938 20 5 FHBDRN CC(C)(C(=O)N1CCSc2ccncc21)c1ccc([N+](=O)[O-])cc1F ZINC000277681368 935813048 /nfs/dbraw/zinc/81/30/48/935813048.db2.gz QHXLVXNAJFSWQK-UHFFFAOYSA-N 0 0 361.398 3.545 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(NC[C@@H]2CCN(c3ccc(F)c(F)c3)C2)n1 ZINC000611616953 935814541 /nfs/dbraw/zinc/81/45/41/935814541.db2.gz YLHWOFQOEFJVPC-ZDUSSCGKSA-N 0 0 362.380 3.823 20 5 FHBDRN Cc1nc([C@H]2CCCN2C(=O)CSc2ccccc2[N+](=O)[O-])cs1 ZINC000479297885 935823738 /nfs/dbraw/zinc/82/37/38/935823738.db2.gz XRRHIZMPQBOIET-CYBMUJFWSA-N 0 0 363.464 3.816 20 5 FHBDRN Cc1cc(C(=O)Nc2cnn(-c3ccc(Cl)cc3)c2)ccc1[N+](=O)[O-] ZINC000479291913 935825955 /nfs/dbraw/zinc/82/59/55/935825955.db2.gz OEPAQMTYDNQYGS-UHFFFAOYSA-N 0 0 356.769 3.995 20 5 FHBDRN CC[C@@H](NC(=O)c1ccc(Br)c([N+](=O)[O-])c1)c1ccncc1 ZINC000158506588 935827111 /nfs/dbraw/zinc/82/71/11/935827111.db2.gz KNAQZYYNEQHOOL-CYBMUJFWSA-N 0 0 364.199 3.633 20 5 FHBDRN CCCN(C(=O)COc1ccc([N+](=O)[O-])cc1)[C@H]1CCCc2cccnc21 ZINC000479369126 935831582 /nfs/dbraw/zinc/83/15/82/935831582.db2.gz VYKHXWHCDULTGH-SFHVURJKSA-N 0 0 369.421 3.685 20 5 FHBDRN CC(C)C(=O)Nc1ccc(C(=O)[C@@H](C)Sc2ncccc2[N+](=O)[O-])cc1 ZINC000127887351 935834300 /nfs/dbraw/zinc/83/43/00/935834300.db2.gz NJECWBFLHZEBJV-GFCCVEGCSA-N 0 0 373.434 3.948 20 5 FHBDRN C[C@H](CNC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-])C(F)(F)F ZINC000479397183 935835494 /nfs/dbraw/zinc/83/54/94/935835494.db2.gz XBBIXDNFYPAOAX-SSDOTTSWSA-N 0 0 356.753 3.655 20 5 FHBDRN COc1ccc(OCCCNC(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)cc1 ZINC000127909847 935836302 /nfs/dbraw/zinc/83/63/02/935836302.db2.gz FOLZTCTUCYXRET-UHFFFAOYSA-N 0 0 373.409 3.811 20 5 FHBDRN CCCCc1oc2ccccc2c1CN(C)C(=O)c1n[nH]cc1[N+](=O)[O-] ZINC000479429839 935838662 /nfs/dbraw/zinc/83/86/62/935838662.db2.gz VULYWAPTUPCJJZ-UHFFFAOYSA-N 0 0 356.382 3.679 20 5 FHBDRN Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000050383708 935839740 /nfs/dbraw/zinc/83/97/40/935839740.db2.gz DNRKJHMJVYABHX-UHFFFAOYSA-N 0 0 369.421 3.850 20 5 FHBDRN C[C@@H](NC(=O)c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1)c1ncon1 ZINC000479478282 935842691 /nfs/dbraw/zinc/84/26/91/935842691.db2.gz WDACQHHKOZDJQC-LLVKDONJSA-N 0 0 370.390 3.620 20 5 FHBDRN COc1ccc(O[C@@H](C)CNC(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)cc1 ZINC000127929978 935844744 /nfs/dbraw/zinc/84/47/44/935844744.db2.gz IRGVHSSHQGGEOZ-ZDUSSCGKSA-N 0 0 373.409 3.809 20 5 FHBDRN CCc1ccc([C@H]2CCN(C(=O)NCCc3cccc([N+](=O)[O-])c3)C2)cc1 ZINC000431457163 935851246 /nfs/dbraw/zinc/85/12/46/935851246.db2.gz HQMWBGUYZMVSOW-IBGZPJMESA-N 0 0 367.449 3.899 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)NCc1ccc(F)cc1C(F)(F)F ZINC000479638417 935868668 /nfs/dbraw/zinc/86/86/68/935868668.db2.gz MCCYETUZAWXMHR-UHFFFAOYSA-N 0 0 372.274 3.691 20 5 FHBDRN O=C(CN(Cc1ccco1)Cc1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000023992965 935877822 /nfs/dbraw/zinc/87/78/22/935877822.db2.gz RWNPSOXCRPAIBP-UHFFFAOYSA-N 0 0 365.389 3.829 20 5 FHBDRN C[C@H](SCC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C(=O)OC(C)(C)C ZINC000479711020 935879672 /nfs/dbraw/zinc/87/96/72/935879672.db2.gz ZNIBOILSJFNVSZ-VIFPVBQESA-N 0 0 374.846 3.650 20 5 FHBDRN CO[C@@H](c1ccccc1Cl)[C@H](C)NC(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000479725170 935884757 /nfs/dbraw/zinc/88/47/57/935884757.db2.gz FHIZYEXKFNFJDP-KPZWWZAWSA-N 0 0 362.813 3.683 20 5 FHBDRN CCC(CC)[C@@H]1C[C@@H](NC(=O)NCc2cccc([N+](=O)[O-])c2C)CCO1 ZINC000479748477 935886308 /nfs/dbraw/zinc/88/63/08/935886308.db2.gz QBOHZCWYPDYKPS-WMZOPIPTSA-N 0 0 363.458 3.686 20 5 FHBDRN Cc1ccc(CN(C)C(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)o1 ZINC000050551030 935888504 /nfs/dbraw/zinc/88/85/04/935888504.db2.gz KPANRZMUZZSCNU-UHFFFAOYSA-N 0 0 357.391 3.892 20 5 FHBDRN CCOC(=O)c1ccccc1N(CC)C(=O)c1cc(C)cc([N+](=O)[O-])c1 ZINC000135158917 935889253 /nfs/dbraw/zinc/88/92/53/935889253.db2.gz IJKJPHGICSNXGL-UHFFFAOYSA-N 0 0 356.378 3.747 20 5 FHBDRN COc1cc(C(=O)Nc2nc(C3CCC3)cs2)cc([N+](=O)[O-])c1OC ZINC000277757094 935890280 /nfs/dbraw/zinc/89/02/80/935890280.db2.gz RPXKCRUQNCXTOE-UHFFFAOYSA-N 0 0 363.395 3.588 20 5 FHBDRN COc1cc(CN[C@H](C)c2cnn(CC3CCC3)c2)c([N+](=O)[O-])cc1F ZINC000934562485 935890789 /nfs/dbraw/zinc/89/07/89/935890789.db2.gz QLQUTUWXJYVSGT-GFCCVEGCSA-N 0 0 362.405 3.590 20 5 FHBDRN CO[C@@H](c1ccccc1Cl)[C@H](C)NC(=O)c1cc(F)cc([N+](=O)[O-])c1 ZINC000479787857 935892088 /nfs/dbraw/zinc/89/20/88/935892088.db2.gz MWFXBUMHKNIXJT-MGPLVRAMSA-N 0 0 366.776 3.893 20 5 FHBDRN COc1cc(C)cc(CNc2ncc([N+](=O)[O-])cc2Br)c1 ZINC000128034774 935906937 /nfs/dbraw/zinc/90/69/37/935906937.db2.gz IQVHKBOQRJWKDB-UHFFFAOYSA-N 0 0 352.188 3.681 20 5 FHBDRN CCc1ccc(C(=O)N2CCN(C3CC3)c3ccc(F)cc32)cc1[N+](=O)[O-] ZINC000479850856 935907692 /nfs/dbraw/zinc/90/76/92/935907692.db2.gz OOYQCNNWCKWZLA-UHFFFAOYSA-N 0 0 369.396 3.926 20 5 FHBDRN C[S@@](=O)c1cccc(NCc2cc([N+](=O)[O-])ccc2OC(F)F)c1 ZINC000121835860 935912436 /nfs/dbraw/zinc/91/24/36/935912436.db2.gz ISRZRAAISFCBBN-DEOSSOPVSA-N 0 0 356.350 3.546 20 5 FHBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N(C1CC1)[C@@H]1CCc2ccccc21 ZINC000507334607 945133294 /nfs/dbraw/zinc/13/32/94/945133294.db2.gz QWQSYVMDCUVBKE-GOSISDBHSA-N 0 0 372.446 3.744 20 5 FHBDRN COC(=O)c1cc(NC(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)cc(C)c1C ZINC000479930274 935921701 /nfs/dbraw/zinc/92/17/01/935921701.db2.gz JFVUDLUYGPKWNH-UHFFFAOYSA-N 0 0 372.377 3.568 20 5 FHBDRN Cn1c(Sc2ncnc3ccc([N+](=O)[O-])cc32)nnc1-c1cccs1 ZINC000611700879 935940567 /nfs/dbraw/zinc/94/05/67/935940567.db2.gz YBZDAYYAQIAHLK-UHFFFAOYSA-N 0 0 370.419 3.546 20 5 FHBDRN O=C(/C=C\c1ccncn1)Oc1ccc(Cc2ccccc2)cc1[N+](=O)[O-] ZINC000588539586 935941539 /nfs/dbraw/zinc/94/15/39/935941539.db2.gz UXMPWIZQLHOTNY-CLFYSBASSA-N 0 0 361.357 3.594 20 5 FHBDRN O=[N+]([O-])c1ccc2ncnc(NC[C@H]3CCC[C@@H](C(F)(F)F)C3)c2c1 ZINC000611705702 935944866 /nfs/dbraw/zinc/94/48/66/935944866.db2.gz BBDMDIIMIGXCPR-WDEREUQCSA-N 0 0 354.332 3.741 20 5 FHBDRN Cc1c(CNC(=O)N2C[C@@H](c3ccccc3)C[C@@H]2C)cccc1[N+](=O)[O-] ZINC000480041481 935945362 /nfs/dbraw/zinc/94/53/62/935945362.db2.gz GUBVQWJLMZRYFD-KSSFIOAISA-N 0 0 353.422 3.991 20 5 FHBDRN CN(Cc1nc(C(F)(F)F)cs1)c1ncnc2ccc([N+](=O)[O-])cc21 ZINC000611705655 935946613 /nfs/dbraw/zinc/94/66/13/935946613.db2.gz GMXMMPXRJUIHPL-UHFFFAOYSA-N 0 0 369.328 3.650 20 5 FHBDRN Cn1c(C(=O)Nc2ccc(CNc3ccccc3)cc2)ccc1[N+](=O)[O-] ZINC000480031770 935946684 /nfs/dbraw/zinc/94/66/84/935946684.db2.gz RANDOMRZKRTXRG-UHFFFAOYSA-N 0 0 350.378 3.798 20 5 FHBDRN Cn1cc(-c2ncc(/C=C/c3nc4cc([N+](=O)[O-])ccc4s3)cn2)cn1 ZINC000480049925 935948573 /nfs/dbraw/zinc/94/85/73/935948573.db2.gz SHSJKXQILCJZID-GORDUTHDSA-N 0 0 364.390 3.565 20 5 FHBDRN COc1ccc(C2CCN(c3nc4sccn4c3[N+](=O)[O-])CC2)cc1 ZINC000075060385 935948661 /nfs/dbraw/zinc/94/86/61/935948661.db2.gz WNQZRLJLQJQFDA-UHFFFAOYSA-N 0 0 358.423 3.697 20 5 FHBDRN CCC(=O)c1ccc(NC[C@@H](C(=O)OC)c2ccccc2)c([N+](=O)[O-])c1 ZINC000480059088 935950847 /nfs/dbraw/zinc/95/08/47/935950847.db2.gz LVMWYVANAQGOJY-OAHLLOKOSA-N 0 0 356.378 3.556 20 5 FHBDRN Cc1c(CNC(=O)N2CC[C@H](COc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000480070643 935956179 /nfs/dbraw/zinc/95/61/79/935956179.db2.gz PHIWNRJRSQBYJO-INIZCTEOSA-N 0 0 369.421 3.514 20 5 FHBDRN CC[C@@H]1Cc2ccccc2CN1C(=O)NCc1cccc([N+](=O)[O-])c1C ZINC000480070639 935956982 /nfs/dbraw/zinc/95/69/82/935956982.db2.gz PGXAKYVYXRLPRD-GOSISDBHSA-N 0 0 353.422 3.950 20 5 FHBDRN COc1ccc2c(c1)C1(CC1)CN(C(=O)c1cc([N+](=O)[O-])c(C)s1)C2 ZINC000562187060 935957756 /nfs/dbraw/zinc/95/77/56/935957756.db2.gz FUBGGYIHEMBMHB-UHFFFAOYSA-N 0 0 358.419 3.661 20 5 FHBDRN CC[C@@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)Nc1ccc2occ(C)c2c1 ZINC000480082948 935959305 /nfs/dbraw/zinc/95/93/05/935959305.db2.gz RPERMMMZLIHDSK-CQSZACIVSA-N 0 0 371.397 3.521 20 5 FHBDRN O=C(NCc1ccc(F)c(F)c1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000431474764 935962679 /nfs/dbraw/zinc/96/26/79/935962679.db2.gz XOMMAQJYIZYWSP-UHFFFAOYSA-N 0 0 371.137 3.566 20 5 FHBDRN O=C(N[C@H]1CCCOCC1)c1cc([N+](=O)[O-])ccc1SC1CCCC1 ZINC000611451037 935967709 /nfs/dbraw/zinc/96/77/09/935967709.db2.gz VTWOIYLPXMTKEF-ZDUSSCGKSA-N 0 0 364.467 3.928 20 5 FHBDRN CCOC(=O)c1cc(C(=O)N([C@H](C)[C@H](C)CC)C2CC2)cc([N+](=O)[O-])c1 ZINC000519115769 945137455 /nfs/dbraw/zinc/13/74/55/945137455.db2.gz NDSNVMFOAVSFGM-CHWSQXEVSA-N 0 0 362.426 3.811 20 5 FHBDRN Cc1cc(NCc2ccc(NC(=O)c3ccco3)cc2)ncc1[N+](=O)[O-] ZINC000074738867 935987364 /nfs/dbraw/zinc/98/73/64/935987364.db2.gz WOHJCLBLCOXWCI-UHFFFAOYSA-N 0 0 352.350 3.756 20 5 FHBDRN CC(=O)N[C@@H]1Cc2ccccc2N(Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000611561096 935989941 /nfs/dbraw/zinc/98/99/41/935989941.db2.gz HTLPEOHPRYFLTN-GOSISDBHSA-N 0 0 367.449 3.786 20 5 FHBDRN O=C(NCCc1ccccc1[N+](=O)[O-])N(Cc1ccc(F)cc1)CC1CC1 ZINC000075108623 936000548 /nfs/dbraw/zinc/00/05/48/936000548.db2.gz LUOAADVFGQWGOL-UHFFFAOYSA-N 0 0 371.412 3.898 20 5 FHBDRN CCOCc1ccc(NC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)cc1 ZINC000075357690 936009646 /nfs/dbraw/zinc/00/96/46/936009646.db2.gz WTHGOFASRGCGQR-UHFFFAOYSA-N 0 0 353.378 3.725 20 5 FHBDRN COc1cc(CN(C)[C@@H]2CC2(C)C)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000426543996 945139749 /nfs/dbraw/zinc/13/97/49/945139749.db2.gz LJBNXACXJJDHDP-CQSZACIVSA-N 0 0 362.348 3.775 20 5 FHBDRN COc1ccc2c(c1)N(C(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1)CCO2 ZINC000187798772 936025764 /nfs/dbraw/zinc/02/57/64/936025764.db2.gz QJDAPLLNEFEXMY-UHFFFAOYSA-N 0 0 356.378 3.766 20 5 FHBDRN CNC(=O)c1ccc(NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)c(Cl)c1 ZINC000135623163 936029350 /nfs/dbraw/zinc/02/93/50/936029350.db2.gz AWVALSLJNPZDTJ-UHFFFAOYSA-N 0 0 368.176 3.514 20 5 FHBDRN COc1c(O)ccc(CNc2ccccc2OCC(F)F)c1[N+](=O)[O-] ZINC000892294676 936030946 /nfs/dbraw/zinc/03/09/46/936030946.db2.gz WSKLEYSGBLZEGF-UHFFFAOYSA-N 0 0 354.309 3.565 20 5 FHBDRN C[C@H](Cc1ccc(Cl)cc1)N(C)C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000135619507 936033321 /nfs/dbraw/zinc/03/33/21/936033321.db2.gz SBPLAOZBMDLTNY-LLVKDONJSA-N 0 0 372.812 3.828 20 5 FHBDRN Cc1ccc2c(c1C)OC[C@H]2NC(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000077417534 936051017 /nfs/dbraw/zinc/05/10/17/936051017.db2.gz DOXPKMAKJVEJTD-CXAGYDPISA-N 0 0 355.394 3.706 20 5 FHBDRN Cc1ccc2c(c1C)OC[C@H]2NC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000077417530 936051061 /nfs/dbraw/zinc/05/10/61/936051061.db2.gz DOXPKMAKJVEJTD-SUMWQHHRSA-N 0 0 355.394 3.706 20 5 FHBDRN COc1ccc(NC(=O)NC2(c3ccc(F)cc3)CCC2)cc1[N+](=O)[O-] ZINC000611823520 936056235 /nfs/dbraw/zinc/05/62/35/936056235.db2.gz DGRMRABUFKTCNF-UHFFFAOYSA-N 0 0 359.357 3.943 20 5 FHBDRN Cc1cc(C(=O)Nc2ccccc2C(=O)NCC(C)C)cc([N+](=O)[O-])c1 ZINC000121901981 936066309 /nfs/dbraw/zinc/06/63/09/936066309.db2.gz JGUGWKKVEHKDOS-UHFFFAOYSA-N 0 0 355.394 3.541 20 5 FHBDRN CC(C)Oc1cccc(CN(C)c2ncnc3ccc([N+](=O)[O-])cc32)c1 ZINC000611712962 936066583 /nfs/dbraw/zinc/06/65/83/936066583.db2.gz UKDWTPDIYXEGRK-UHFFFAOYSA-N 0 0 352.394 3.962 20 5 FHBDRN O=[N+]([O-])c1ccccc1/C=C/c1nc(COCC(F)(F)C(F)F)no1 ZINC000277873738 936068111 /nfs/dbraw/zinc/06/81/11/936068111.db2.gz CYQBWGXMGWLKAD-AATRIKPKSA-N 0 0 361.251 3.565 20 5 FHBDRN COC[C@H](Nc1ncnc2ccc([N+](=O)[O-])cc21)c1ccc(F)c(F)c1 ZINC000611714699 936068123 /nfs/dbraw/zinc/06/81/23/936068123.db2.gz XBHITXSEDYKMPW-INIZCTEOSA-N 0 0 360.320 3.616 20 5 FHBDRN O=C(Nc1ccccc1-n1cccn1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513699490 936090566 /nfs/dbraw/zinc/09/05/66/936090566.db2.gz OAWAQMPOLJABDQ-UHFFFAOYSA-N 0 0 374.303 3.634 20 5 FHBDRN CO[C@@H](CCN[C@@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F)C(F)(F)F ZINC000566346483 936095731 /nfs/dbraw/zinc/09/57/31/936095731.db2.gz WPQJFNFYEOTCGW-QWRGUYRKSA-N 0 0 360.254 3.755 20 5 FHBDRN O=C(Nc1ccc(O[C@@H]2CCCC[C@@H]2O)cc1)c1cc(F)ccc1[N+](=O)[O-] ZINC000135684404 936116891 /nfs/dbraw/zinc/11/68/91/936116891.db2.gz DXCISESPZMAUAR-ZWKOTPCHSA-N 0 0 374.368 3.669 20 5 FHBDRN Cc1c(OC(=O)Cc2csc(-c3cccnc3)n2)cccc1[N+](=O)[O-] ZINC000121928713 936134729 /nfs/dbraw/zinc/13/47/29/936134729.db2.gz QZYQAACAZHOSJP-UHFFFAOYSA-N 0 0 355.375 3.570 20 5 FHBDRN O=C(Nc1cc2c(cc1F)NC(=O)CC2)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000121937621 936148771 /nfs/dbraw/zinc/14/87/71/936148771.db2.gz CQHLJTCYRVEZFM-UHFFFAOYSA-N 0 0 363.732 3.524 20 5 FHBDRN O=C(c1cc(F)ccc1[N+](=O)[O-])N1CC[C@H](OCCCc2ccccc2)C1 ZINC000176742801 936158340 /nfs/dbraw/zinc/15/83/40/936158340.db2.gz SLJZWSOLLXJAEQ-KRWDZBQOSA-N 0 0 372.396 3.598 20 5 FHBDRN O=[N+]([O-])c1cnc(NC[C@H](NCc2ccccc2)C(F)(F)F)c(Cl)c1 ZINC000582815905 936164498 /nfs/dbraw/zinc/16/44/98/936164498.db2.gz GZXOEPMILUYAMY-ZDUSSCGKSA-N 0 0 374.750 3.776 20 5 FHBDRN O=C(c1cc(NC[C@@H]2Cc3ccccc32)ccc1[N+](=O)[O-])N1CCCC1 ZINC000091454866 936171193 /nfs/dbraw/zinc/17/11/93/936171193.db2.gz UJBGMAKXNDMAAB-HNNXBMFYSA-N 0 0 351.406 3.583 20 5 FHBDRN CCCOc1ccc(NC(=O)CCn2cc([N+](=O)[O-])nc2C)cc1Cl ZINC000061167689 936177261 /nfs/dbraw/zinc/17/72/61/936177261.db2.gz GPRMWTQCTVLBOE-UHFFFAOYSA-N 0 0 366.805 3.571 20 5 FHBDRN COc1ccc(CN(CC2CCC2)C(=O)c2ccc([N+](=O)[O-])o2)c(OC)c1 ZINC000511800682 945149432 /nfs/dbraw/zinc/14/94/32/945149432.db2.gz CYHYPRHDAROFSM-UHFFFAOYSA-N 0 0 374.393 3.648 20 5 FHBDRN CSc1ccc(Cl)cc1NC(=O)CCn1cc([N+](=O)[O-])nc1C ZINC000061196084 936202938 /nfs/dbraw/zinc/20/29/38/936202938.db2.gz QANVRAAGHIEZOY-UHFFFAOYSA-N 0 0 354.819 3.504 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)Nc2nc(C(C)(C)C)ns2)cc1[N+](=O)[O-] ZINC000078565085 936203765 /nfs/dbraw/zinc/20/37/65/936203765.db2.gz MITWGAYXAPQNFC-JTQLQIEISA-N 0 0 363.443 3.935 20 5 FHBDRN C[C@H](NC(=O)c1cccc2c(=O)c3ccccc3[nH]c12)C(=O)OC(C)(C)C ZINC000277934552 936214210 /nfs/dbraw/zinc/21/42/10/936214210.db2.gz BFJGXNFJWCYDMI-LBPRGKRZSA-N 0 0 366.417 3.554 20 5 FHBDRN CC1(COC(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)CCCCCC1 ZINC000780502568 936225004 /nfs/dbraw/zinc/22/50/04/936225004.db2.gz VBRMIFASCSHBNK-UHFFFAOYSA-N 0 0 369.439 3.516 20 5 FHBDRN CC1(NC(=O)CCCNc2ccc([N+](=O)[O-])cc2)CCC(F)(F)CC1 ZINC000612335296 936226287 /nfs/dbraw/zinc/22/62/87/936226287.db2.gz KKIAWZDLVXUSER-UHFFFAOYSA-N 0 0 355.385 3.871 20 5 FHBDRN COC(=O)c1cc([N+](=O)[O-])c(N[C@H]2CCc3c2cccc3O)cc1Cl ZINC000091485039 936230033 /nfs/dbraw/zinc/23/00/33/936230033.db2.gz SIXVHRWOANTQHA-ZDUSSCGKSA-N 0 0 362.769 3.840 20 5 FHBDRN Cc1ccc(NC(=O)c2ccc(NCC(C)(C)CCO)c([N+](=O)[O-])c2)cc1 ZINC000078688971 936242081 /nfs/dbraw/zinc/24/20/81/936242081.db2.gz UJNAZNXQQWUNML-UHFFFAOYSA-N 0 0 371.437 3.976 20 5 FHBDRN Cc1ccc(-c2nnc(Sc3ncc(Cl)cc3[N+](=O)[O-])n2C)cc1 ZINC000153545276 936253378 /nfs/dbraw/zinc/25/33/78/936253378.db2.gz DYQINCVBNWLNKU-UHFFFAOYSA-N 0 0 361.814 3.898 20 5 FHBDRN C[C@@H]1CSCCN(c2cc(C(F)(F)C(F)(F)F)ncc2[N+](=O)[O-])C1 ZINC000582885172 936258800 /nfs/dbraw/zinc/25/88/00/936258800.db2.gz UDIDWRCAPPHBBK-QMMMGPOBSA-N 0 0 371.331 3.833 20 5 FHBDRN O=C(N[C@H]1CCOC2(CCCCC2)C1)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000161573536 936274869 /nfs/dbraw/zinc/27/48/69/936274869.db2.gz PYPLVLLVDBVYQE-ZDUSSCGKSA-N 0 0 352.818 3.860 20 5 FHBDRN O=C(Nc1ccc(Nc2ncc(Cl)cc2[N+](=O)[O-])cc1)[C@@H]1CCCO1 ZINC000153570887 936277145 /nfs/dbraw/zinc/27/71/45/936277145.db2.gz WNJWAQVFWRMRCK-AWEZNQCLSA-N 0 0 362.773 3.504 20 5 FHBDRN Cc1c(CC(=O)N2CCCCC[C@H]2c2ccncc2)cccc1[N+](=O)[O-] ZINC000161687034 936290243 /nfs/dbraw/zinc/29/02/43/936290243.db2.gz ADMMTRKBJDMOPZ-IBGZPJMESA-N 0 0 353.422 3.985 20 5 FHBDRN CCO[C@@H]1C[C@@H](Nc2cc(C)nc3c2cccc3[N+](=O)[O-])[C@@]12CCCO2 ZINC000612664402 936304219 /nfs/dbraw/zinc/30/42/19/936304219.db2.gz MZJVIWXFCJSZHN-LMMKCTJWSA-N 0 0 357.410 3.590 20 5 FHBDRN O=C(c1c[nH]cc1-c1ccccc1F)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000427175641 945159887 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C[C@H]1Oc2ccccc2[C@H]1NC(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000583521267 938290816 /nfs/dbraw/zinc/29/08/16/938290816.db2.gz BIVAZRXNUPAKSG-HWPZZCPQSA-N 0 0 361.785 3.570 20 5 FHBDRN C[C@@H](CC(=O)c1ccccc1F)C(=O)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000536063666 938295148 /nfs/dbraw/zinc/29/51/48/938295148.db2.gz ACZFLMPIGWTERP-ZDUSSCGKSA-N 0 0 370.380 3.528 20 5 FHBDRN O=C(c1ccc(OC2CCC2)cc1)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000536063065 938296079 /nfs/dbraw/zinc/29/60/79/938296079.db2.gz IYEDMSKVBDBERB-UHFFFAOYSA-N 0 0 352.390 3.725 20 5 FHBDRN CCc1cccnc1NC(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000506000669 945163292 /nfs/dbraw/zinc/16/32/92/945163292.db2.gz BGOCCGOCHPMRIC-UHFFFAOYSA-N 0 0 357.413 3.751 20 5 FHBDRN COc1cc(OC)c(CNc2ccc([N+](=O)[O-])c3cnccc23)c(OC)c1 ZINC000052433984 938300251 /nfs/dbraw/zinc/30/02/51/938300251.db2.gz UHDPJKQSYWTHGZ-UHFFFAOYSA-N 0 0 369.377 3.781 20 5 FHBDRN Cc1nc(-c2cccc(C)c2)[nH]c1C(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000536068632 938300752 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FHBDRN CCSCc1ccccc1-c1nc(-c2c([N+](=O)[O-])nc(C)n2C)no1 ZINC000583590713 938311137 /nfs/dbraw/zinc/31/11/37/938311137.db2.gz FJXSSQOFANKMMY-UHFFFAOYSA-N 0 0 359.411 3.607 20 5 FHBDRN COc1ccc(OC)c([C@H]2C[C@H]2c2nc(-c3ccc([N+](=O)[O-])s3)no2)c1 ZINC000583590667 938311154 /nfs/dbraw/zinc/31/11/54/938311154.db2.gz CIVIKEPCUVHOMW-ZYHUDNBSSA-N 0 0 373.390 3.995 20 5 FHBDRN CO[C@@H](C)c1nc(CNc2cc(C(F)(F)F)ncc2[N+](=O)[O-])cs1 ZINC000278337588 938314202 /nfs/dbraw/zinc/31/42/02/938314202.db2.gz IXARFXMTRFRJPO-ZETCQYMHSA-N 0 0 362.333 3.785 20 5 FHBDRN O=C(Nc1ccc(-c2ccccc2)cn1)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000583618640 938325088 /nfs/dbraw/zinc/32/50/88/938325088.db2.gz UEVHAKBQJQCBIU-UHFFFAOYSA-N 0 0 359.345 3.785 20 5 FHBDRN COCc1ccc([C@@H]2CCCN2c2cc(OC)c([N+](=O)[O-])cc2F)o1 ZINC000161709451 938328042 /nfs/dbraw/zinc/32/80/42/938328042.db2.gz QTVIKJBQLSJQMU-ZDUSSCGKSA-N 0 0 350.346 3.823 20 5 FHBDRN O=C(Nc1cccc(CNc2ncccc2[N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000052489183 938338848 /nfs/dbraw/zinc/33/88/48/938338848.db2.gz UTMDSZFTMNDCJA-UHFFFAOYSA-N 0 0 366.352 3.993 20 5 FHBDRN Cc1ccc(C[C@@H](C)N(C)C(=O)NCCc2ccccc2[N+](=O)[O-])cc1 ZINC000075109065 938340115 /nfs/dbraw/zinc/34/01/15/938340115.db2.gz GIVGAGCLELOVGU-MRXNPFEDSA-N 0 0 355.438 3.718 20 5 FHBDRN CC(C)Oc1cc(N[C@@H](C)CCc2ccccc2[N+](=O)[O-])ccc1C(N)=O ZINC000437243271 945166566 /nfs/dbraw/zinc/16/65/66/945166566.db2.gz HPXHBQAISQJJKW-AWEZNQCLSA-N 0 0 371.437 3.914 20 5 FHBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])N1C[C@@H](C2CC2)[C@@H]1C1CC1 ZINC000458630768 938348737 /nfs/dbraw/zinc/34/87/37/938348737.db2.gz MOVXXBGPQMSYHJ-RDJZCZTQSA-N 0 0 363.845 3.621 20 5 FHBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])N1C[C@H](C2CC2)[C@H]1C1CC1 ZINC000458630766 938348779 /nfs/dbraw/zinc/34/87/79/938348779.db2.gz MOVXXBGPQMSYHJ-NVXWUHKLSA-N 0 0 363.845 3.621 20 5 FHBDRN CC(C)(CNC(=O)NCCc1cccc([N+](=O)[O-])c1)c1ccccc1F ZINC000536099118 938351716 /nfs/dbraw/zinc/35/17/16/938351716.db2.gz NRNDMFRGEPFNQB-UHFFFAOYSA-N 0 0 359.401 3.553 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ZINC000124186331 945171300 /nfs/dbraw/zinc/17/13/00/945171300.db2.gz QBPCKAOFGNRYTN-UHFFFAOYSA-N 0 0 363.320 3.786 20 5 FHBDRN Cc1ncsc1-c1nc(COc2cc([N+](=O)[O-])ccc2Cl)no1 ZINC000128149156 938420813 /nfs/dbraw/zinc/42/08/13/938420813.db2.gz KKLXCAXYCJPHNG-UHFFFAOYSA-N 0 0 352.759 3.642 20 5 FHBDRN Cc1c(CNC(=O)N(C)[C@H](C)Cc2cccc(F)c2)cccc1[N+](=O)[O-] ZINC000458685958 938426532 /nfs/dbraw/zinc/42/65/32/938426532.db2.gz HNTVCNQLEKVOHY-CYBMUJFWSA-N 0 0 359.401 3.815 20 5 FHBDRN COc1cc(C(=O)N2CCc3sc(Cl)cc3C2)ccc1[N+](=O)[O-] ZINC000583814312 938429513 /nfs/dbraw/zinc/42/95/13/938429513.db2.gz UMFCLVNAOSWNQR-UHFFFAOYSA-N 0 0 352.799 3.517 20 5 FHBDRN Cc1cccc(C2=CCN(C(=O)NCc3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000536137860 938432554 /nfs/dbraw/zinc/43/25/54/938432554.db2.gz QVCJYGNPOINVDT-UHFFFAOYSA-N 0 0 351.406 3.902 20 5 FHBDRN O=C(N[C@H](c1ccccc1)c1ccccn1)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000052609524 938435109 /nfs/dbraw/zinc/43/51/09/938435109.db2.gz WQFSKGJPJFIPEC-HXUWFJFHSA-N 0 0 372.384 3.991 20 5 FHBDRN CN(CCOc1ccc(Cl)cc1)C(=O)c1c[nH]c2cc([N+](=O)[O-])ccc21 ZINC000052606043 938436478 /nfs/dbraw/zinc/43/64/78/938436478.db2.gz AFXMEIZALTUQFJ-UHFFFAOYSA-N 0 0 373.796 3.881 20 5 FHBDRN CCc1c(NC(=O)c2cc([N+](=O)[O-])ccc2OC)cnn1CCC(C)C ZINC000427204739 945175372 /nfs/dbraw/zinc/17/53/72/945175372.db2.gz OWVIJBXGYYCAKN-UHFFFAOYSA-N 0 0 360.414 3.661 20 5 FHBDRN O=C(Nc1ccnc(Sc2ccccn2)c1)c1cc(F)ccc1[N+](=O)[O-] ZINC000102253353 938449954 /nfs/dbraw/zinc/44/99/54/938449954.db2.gz VRZZSKMIHOWBLI-UHFFFAOYSA-N 0 0 370.365 3.927 20 5 FHBDRN CCCNc1ccc(CNC(=O)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000458710627 938464634 /nfs/dbraw/zinc/46/46/34/938464634.db2.gz DUMJKNSNZBYZSS-AWEZNQCLSA-N 0 0 356.426 3.977 20 5 FHBDRN CC(=O)c1ccc([N+](=O)[O-])cc1N1CCc2[nH]c3ccc(F)cc3c2C1 ZINC000583893434 938470013 /nfs/dbraw/zinc/47/00/13/938470013.db2.gz XZNLGWXXJPGMBG-UHFFFAOYSA-N 0 0 353.353 3.981 20 5 FHBDRN CSc1ccc2ncnc(N3CCc4ccc([N+](=O)[O-])cc4C3)c2c1 ZINC000573008666 938479626 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356.350 3.950 20 5 FHBDRN C[C@@H](c1nccs1)N1CCN(c2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000432141206 945182476 /nfs/dbraw/zinc/18/24/76/945182476.db2.gz CNTIIPWNHIQEGH-NSHDSACASA-N 0 0 352.847 3.588 20 5 FHBDRN O=c1c([N+](=O)[O-])cc(Cl)cn1Cc1csc(C2CCCCC2)n1 ZINC000158518848 938539844 /nfs/dbraw/zinc/53/98/44/938539844.db2.gz HJRUGNZSENDHNI-UHFFFAOYSA-N 0 0 353.831 3.962 20 5 FHBDRN CC(=O)c1cc([N+](=O)[O-])ccc1OCc1nc(-c2ccccc2F)no1 ZINC000435772253 938563897 /nfs/dbraw/zinc/56/38/97/938563897.db2.gz OLOHXZUVIDSKFM-UHFFFAOYSA-N 0 0 357.297 3.566 20 5 FHBDRN CC(=O)c1cc(NC(=O)N(C)CCc2ccccc2[N+](=O)[O-])ccc1C ZINC000584061848 938577334 /nfs/dbraw/zinc/57/73/34/938577334.db2.gz WUXUMRZONSDZKA-UHFFFAOYSA-N 0 0 355.394 3.812 20 5 FHBDRN Cc1ccc(OC2CCN(c3c4c(ccc3[N+](=O)[O-])NCC4)CC2)cc1 ZINC000584085853 938593259 /nfs/dbraw/zinc/59/32/59/938593259.db2.gz CXOJCBUQDYICQI-UHFFFAOYSA-N 0 0 353.422 3.919 20 5 FHBDRN Cc1ccc(Sc2ccc(C(=O)N[C@@H]3CCOC3)cc2[N+](=O)[O-])cc1 ZINC000179043195 938597520 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3.986 20 5 FHBDRN O=C(Nc1cc(Cl)cnc1Br)c1ccc([N+](=O)[O-])cc1 ZINC000312904620 945191771 /nfs/dbraw/zinc/19/17/71/945191771.db2.gz YPQBOINDFABBRS-UHFFFAOYSA-N 0 0 356.563 3.658 20 5 FHBDRN O=C(NCCCn1ccc2ccccc21)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000052894514 938646710 /nfs/dbraw/zinc/64/67/10/938646710.db2.gz JGDRYPYUQBBAGJ-UHFFFAOYSA-N 0 0 362.389 3.851 20 5 FHBDRN CCS[C@@H]1CCC[C@@H](Nc2nc(C)cc(C(=O)OC)c2[N+](=O)[O-])C1 ZINC000584249107 938658511 /nfs/dbraw/zinc/65/85/11/938658511.db2.gz ULHUJKDIPGRMKT-VXGBXAGGSA-N 0 0 353.444 3.561 20 5 FHBDRN Cc1ccc(NC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)cc1F ZINC000052934367 938662723 /nfs/dbraw/zinc/66/27/23/938662723.db2.gz YXHDXTDJDZIESB-UHFFFAOYSA-N 0 0 354.341 3.695 20 5 FHBDRN Cn1cc(C(=O)Nc2cc(F)ccc2F)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000052932685 938662728 /nfs/dbraw/zinc/66/27/28/938662728.db2.gz YGIXTOPDIMOFNM-UHFFFAOYSA-N 0 0 358.304 3.526 20 5 FHBDRN O=C(Oc1cccc([N+](=O)[O-])c1)C1(c2cccc(Cl)c2)CCOCC1 ZINC000052930523 938667902 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3.719 20 5 FHBDRN CCOc1cc(NCc2ccccc2Cn2cccn2)ccc1[N+](=O)[O-] ZINC000080766142 938702325 /nfs/dbraw/zinc/70/23/25/938702325.db2.gz CRRLDIQMTJFBNA-UHFFFAOYSA-N 0 0 352.394 3.850 20 5 FHBDRN Cc1cc(N[C@@H](C)c2ccc(NC(=O)NC3CC3)cc2)ncc1[N+](=O)[O-] ZINC000074741062 938705554 /nfs/dbraw/zinc/70/55/54/938705554.db2.gz NOYNUVGYLIPMBA-LBPRGKRZSA-N 0 0 355.398 3.755 20 5 FHBDRN Cc1cc(Nc2ccc(CS(=O)(=O)C(C)(C)C)cc2)ncc1[N+](=O)[O-] ZINC000074745095 938706980 /nfs/dbraw/zinc/70/69/80/938706980.db2.gz HODJNUJBDBTPHE-UHFFFAOYSA-N 0 0 363.439 3.755 20 5 FHBDRN CC(=O)c1ccc([N+](=O)[O-])cc1N1CCC[C@@H](CC(=O)OC(C)(C)C)C1 ZINC000584372453 938717395 /nfs/dbraw/zinc/71/73/95/938717395.db2.gz XJLSTWNMTRTTIN-AWEZNQCLSA-N 0 0 362.426 3.746 20 5 FHBDRN O=[N+]([O-])c1cccc2c(N(Cc3ccccc3)CC3(CO)CC3)ccnc21 ZINC000432146861 945201553 /nfs/dbraw/zinc/20/15/53/945201553.db2.gz CYSKOVZGGWJHKJ-UHFFFAOYSA-N 0 0 363.417 3.922 20 5 FHBDRN CC(C)c1nc2ccc(NC(=O)c3cc([N+](=O)[O-])c[nH]c3=O)cc2s1 ZINC000519187525 945202147 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CC(C)(C)OC(=O)[C@@H]1CCCN1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000179218634 938991112 /nfs/dbraw/zinc/99/11/12/938991112.db2.gz MOQJQAFZKNPJLY-INIZCTEOSA-N 0 0 373.409 3.556 20 5 FHBDRN Cn1c(C(=O)Nc2cc(Br)ccc2Cl)ccc1[N+](=O)[O-] ZINC000061693010 938992821 /nfs/dbraw/zinc/99/28/21/938992821.db2.gz YTTXACNVKAUYNU-UHFFFAOYSA-N 0 0 358.579 3.602 20 5 FHBDRN Cc1ccc(C(=O)Nc2cccc(C(=O)NC(C)(C)C)c2)cc1[N+](=O)[O-] ZINC000046604582 938994315 /nfs/dbraw/zinc/99/43/15/938994315.db2.gz SQNDWPUMMZTPRR-UHFFFAOYSA-N 0 0 355.394 3.684 20 5 FHBDRN COC(=O)[C@@H](NCc1ccc([N+](=O)[O-])cc1F)c1ccc2ccccc2c1 ZINC000611943815 938994427 /nfs/dbraw/zinc/99/44/27/938994427.db2.gz ZJHWBETVVNWEQA-IBGZPJMESA-N 0 0 368.364 3.891 20 5 FHBDRN Cc1c(C(=O)Nc2cccc(C(=O)NC(C)(C)C)c2)cccc1[N+](=O)[O-] ZINC000046605918 938994509 /nfs/dbraw/zinc/99/45/09/938994509.db2.gz SJEIINWGBYIRCB-UHFFFAOYSA-N 0 0 355.394 3.684 20 5 FHBDRN C[C@@H]1CCN(CC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H]1c1cccc(F)c1 ZINC000472336823 938994766 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3.926 20 5 FHBDRN CCCC[C@H]1CCC[C@H]1NC(=O)c1ccc2c(c1[N+](=O)[O-])OCCCO2 ZINC001125772662 939007798 /nfs/dbraw/zinc/00/77/98/939007798.db2.gz IDCIMGXHQGNJRN-DZGCQCFKSA-N 0 0 362.426 3.845 20 5 FHBDRN CC1(C)CC[C@@H](c2nc(-c3ccc(-n4cncn4)c([N+](=O)[O-])c3)no2)C1 ZINC000453196563 939008161 /nfs/dbraw/zinc/00/81/61/939008161.db2.gz MDRXVSGKPUIYPC-GFCCVEGCSA-N 0 0 354.370 3.519 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000176939227 939008450 /nfs/dbraw/zinc/00/84/50/939008450.db2.gz RYZAQXJLLJAXAK-UHFFFAOYSA-N 0 0 358.354 3.868 20 5 FHBDRN CC[C@H](NC(=O)[C@@H]1C[C@H]1c1cccc([N+](=O)[O-])c1)c1nc2ccccc2[nH]1 ZINC001125774197 939008715 /nfs/dbraw/zinc/00/87/15/939008715.db2.gz QUTLSPAXPGULLY-XHSDSOJGSA-N 0 0 364.405 3.842 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(Sc2cccc(Br)c2)n1 ZINC000166894247 939012892 /nfs/dbraw/zinc/01/28/92/939012892.db2.gz WIFZSMDRCBSIMM-UHFFFAOYSA-N 0 0 369.196 3.690 20 5 FHBDRN C[C@H](O)C[C@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1SC1CCCC1 ZINC000611985003 939013537 /nfs/dbraw/zinc/01/35/37/939013537.db2.gz VYJWGRCWSBKAQO-RYUDHWBXSA-N 0 0 352.456 3.519 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)Nc2cccc3[nH]ccc32)cc1OC ZINC000110144297 939013972 /nfs/dbraw/zinc/01/39/72/939013972.db2.gz SGSFUBZMCYKOMK-UHFFFAOYSA-N 0 0 355.350 3.736 20 5 FHBDRN Cc1ccc(-c2csc(NC(=O)Cc3cncs3)n2)cc1[N+](=O)[O-] ZINC000188077668 939017698 /nfs/dbraw/zinc/01/76/98/939017698.db2.gz HQUBWDWUMOGZSN-UHFFFAOYSA-N 0 0 360.420 3.664 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)N[C@H]1CCSc2ccccc21 ZINC000065733168 939018465 /nfs/dbraw/zinc/01/84/65/939018465.db2.gz DUXGHJLDEYMAJF-INIZCTEOSA-N 0 0 367.430 3.903 20 5 FHBDRN COc1ccccc1[C@@H]1CCCN1C(=O)/C=C\c1ccc([N+](=O)[O-])cc1 ZINC000255635737 939018795 /nfs/dbraw/zinc/01/87/95/939018795.db2.gz CMZWWWRNFNUEEM-GFBZKKKVSA-N 0 0 352.390 3.980 20 5 FHBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)N1CCC[C@@H](Nc2ccccc2)C1 ZINC000255631013 939018933 /nfs/dbraw/zinc/01/89/33/939018933.db2.gz KRAYMGFBLIJWGU-ADYSOMBNSA-N 0 0 351.406 3.711 20 5 FHBDRN CC(C)c1ccc(C(=O)NCCc2nn(C)c3ccccc23)cc1[N+](=O)[O-] ZINC000188137249 939019348 /nfs/dbraw/zinc/01/93/48/939019348.db2.gz UGHGKSHPPGYPTQ-UHFFFAOYSA-N 0 0 366.421 3.577 20 5 FHBDRN CCc1nnc(COc2c(C)cc(Br)cc2[N+](=O)[O-])s1 ZINC000612021257 939021556 /nfs/dbraw/zinc/02/15/56/939021556.db2.gz QZGHTTZAQWXSJQ-UHFFFAOYSA-N 0 0 358.217 3.659 20 5 FHBDRN CC(C)Oc1cc(CN(C(=O)c2csc([N+](=O)[O-])c2)C2CC2)ccn1 ZINC000179264815 939022121 /nfs/dbraw/zinc/02/21/21/939022121.db2.gz JIHFQGWCQISYTK-UHFFFAOYSA-N 0 0 361.423 3.643 20 5 FHBDRN Cc1cc(F)cc(C(=O)Nc2ccn(Cc3ccccc3)n2)c1[N+](=O)[O-] ZINC000176979272 939023003 /nfs/dbraw/zinc/02/30/03/939023003.db2.gz MQUOVPPJAUJUKC-UHFFFAOYSA-N 0 0 354.341 3.539 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N[C@H]1COc2cc(F)cc(F)c21 ZINC000612037967 939023433 /nfs/dbraw/zinc/02/34/33/939023433.db2.gz LLSJLIQBKRKZOF-LBPRGKRZSA-N 0 0 369.711 3.782 20 5 FHBDRN O=C(c1cccc([N+](=O)[O-])c1)N1CCC(OCc2ccccc2F)CC1 ZINC000092053497 945222060 /nfs/dbraw/zinc/22/20/60/945222060.db2.gz ZBXSAVCSIZUDDD-UHFFFAOYSA-N 0 0 358.369 3.555 20 5 FHBDRN COc1ccc(NC(=O)c2cc(C)cc(Br)c2)c([N+](=O)[O-])c1 ZINC000124316964 945222709 /nfs/dbraw/zinc/22/27/09/945222709.db2.gz PPUYPERJOFUGKS-UHFFFAOYSA-N 0 0 365.183 3.927 20 5 FHBDRN COc1ccc2c(c1)CC[C@H](NC(=O)c1cc3cc([N+](=O)[O-])ccc3o1)C2 ZINC000612087417 939048193 /nfs/dbraw/zinc/04/81/93/939048193.db2.gz FDWZDLZERVQLJG-HNNXBMFYSA-N 0 0 366.373 3.637 20 5 FHBDRN Cc1cccc([C@H](NC(=O)c2csc([N+](=O)[O-])c2)c2ccccn2)c1 ZINC000179277721 939056165 /nfs/dbraw/zinc/05/61/65/939056165.db2.gz WHWROCWOGXGQQN-KRWDZBQOSA-N 0 0 353.403 3.879 20 5 FHBDRN COc1ccc(OC(F)F)c(CN(C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000179315799 939079998 /nfs/dbraw/zinc/07/99/98/939079998.db2.gz QMFWURXNRIBWRC-UHFFFAOYSA-N 0 0 352.337 3.837 20 5 FHBDRN CN(Cc1ccc(Oc2cnccn2)cc1)Cc1ccccc1[N+](=O)[O-] ZINC000179316553 939080164 /nfs/dbraw/zinc/08/01/64/939080164.db2.gz SBVJOVFMMQFNNQ-UHFFFAOYSA-N 0 0 350.378 3.809 20 5 FHBDRN COc1ccc(-c2cc(N(C)Cc3ccc([N+](=O)[O-])cc3OC)n[nH]2)cc1 ZINC001167685346 939113802 /nfs/dbraw/zinc/11/38/02/939113802.db2.gz JHRDRWYMUSCTLE-UHFFFAOYSA-N 0 0 368.393 3.639 20 5 FHBDRN C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CCc2ccc(F)cc21 ZINC000179390522 939139965 /nfs/dbraw/zinc/13/99/65/939139965.db2.gz ITSGYONQBZDQJC-NSHDSACASA-N 0 0 354.341 3.908 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(CC)Cc1ccccc1C ZINC000065791510 939148392 /nfs/dbraw/zinc/14/83/92/939148392.db2.gz NDUJIFGKNZYEFJ-UHFFFAOYSA-N 0 0 362.451 3.676 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)Nc1cccc(-n2ccnc2)c1 ZINC000179437774 939159560 /nfs/dbraw/zinc/15/95/60/939159560.db2.gz ZSXGNZOOGHEZNF-UHFFFAOYSA-N 0 0 350.378 3.958 20 5 FHBDRN Cc1ccc(S(=O)(=O)N2CCC[C@H]2CCc2ccccc2)c([N+](=O)[O-])c1 ZINC000507429660 945232088 /nfs/dbraw/zinc/23/20/88/945232088.db2.gz NVZVOFOMBJTDBC-KRWDZBQOSA-N 0 0 374.462 3.689 20 5 FHBDRN Cc1cc(-c2noc([C@H](C)NC(=O)c3ccc([N+](=O)[O-])cc3)n2)ccc1F ZINC000472371882 939175242 /nfs/dbraw/zinc/17/52/42/939175242.db2.gz ARLDXLBUNCPADA-NSHDSACASA-N 0 0 370.340 3.583 20 5 FHBDRN Cc1cc(-c2noc([C@@H](C)NC(=O)c3ccc([N+](=O)[O-])cc3)n2)ccc1F ZINC000472371881 939175309 /nfs/dbraw/zinc/17/53/09/939175309.db2.gz ARLDXLBUNCPADA-LLVKDONJSA-N 0 0 370.340 3.583 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]c(NCc3sccc3Br)nc2c1 ZINC000148360765 939182381 /nfs/dbraw/zinc/18/23/81/939182381.db2.gz ZBTDDHHNNXKFAX-UHFFFAOYSA-N 0 0 353.201 3.907 20 5 FHBDRN CSc1cccc(C(=O)NCCCNc2cccc(F)c2)c1[N+](=O)[O-] ZINC000188347877 939206818 /nfs/dbraw/zinc/20/68/18/939206818.db2.gz JZCFWLXAOMDOKM-UHFFFAOYSA-N 0 0 363.414 3.688 20 5 FHBDRN Cc1c(C(=O)N(C)Cc2cc([N+](=O)[O-])ccc2Cl)cnn1CC(C)C ZINC000179511207 939225061 /nfs/dbraw/zinc/22/50/61/939225061.db2.gz YFRFNNCRSBBLFV-UHFFFAOYSA-N 0 0 364.833 3.681 20 5 FHBDRN Cc1cc([N-]S(=O)(=O)c2ccc([N+](=O)[O-])c(C)c2)c2cccnc2c1C ZINC000437318906 945238353 /nfs/dbraw/zinc/23/83/53/945238353.db2.gz QCGKJQNPFOSUNW-UHFFFAOYSA-N 0 0 371.418 3.869 20 5 FHBDRN Cc1cccc([C@@H](NC(=O)COc2ccccc2[N+](=O)[O-])C(F)(F)F)c1 ZINC000511833791 945243882 /nfs/dbraw/zinc/24/38/82/945243882.db2.gz WCDFZBBLXYORSM-MRXNPFEDSA-N 0 0 368.311 3.702 20 5 FHBDRN COC[C@H](Cc1ccccc1)NC(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000473858192 945244325 /nfs/dbraw/zinc/24/43/25/945244325.db2.gz JIOCAPDQGCJAPC-KRWDZBQOSA-N 0 0 356.422 3.706 20 5 FHBDRN Cn1nccc1C1C[C@H]2CC[C@@H](C1)N2c1ccnc2c1cccc2[N+](=O)[O-] ZINC000432164742 945249143 /nfs/dbraw/zinc/24/91/43/945249143.db2.gz FTJNPODBDBBUQN-GOOCMWNKSA-N 0 0 363.421 3.792 20 5 FHBDRN O=C(N[C@@H]1C[C@H]1c1c(F)cccc1Cl)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000437333718 945255624 /nfs/dbraw/zinc/25/56/24/945255624.db2.gz CVZPYOQBRLZDQZ-YMTOWFKASA-N 0 0 374.759 3.550 20 5 FHBDRN CC(C)c1sc(NC(=O)c2cc([N+](=O)[O-])n[nH]2)nc1-c1ccccc1 ZINC000507468995 945255664 /nfs/dbraw/zinc/25/56/64/945255664.db2.gz PIOPMZXROLZTGA-UHFFFAOYSA-N 0 0 357.395 3.817 20 5 FHBDRN CCOC(=O)CC(C)(C)N(C)C(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000438951358 945258067 /nfs/dbraw/zinc/25/80/67/945258067.db2.gz SKMVJGGMYBGUHK-UHFFFAOYSA-N 0 0 350.415 3.522 20 5 FHBDRN COc1cccc2c1CC[C@H]2NC(=O)c1c(C)cc(Cl)cc1[N+](=O)[O-] ZINC000438951308 945258271 /nfs/dbraw/zinc/25/82/71/945258271.db2.gz JGCLDYBGWVTGJI-CQSZACIVSA-N 0 0 360.797 3.983 20 5 FHBDRN CCOC(=O)C[C@](C)(NC(=O)c1c(C)cc(Cl)cc1[N+](=O)[O-])C(C)C ZINC000438954290 945261320 /nfs/dbraw/zinc/26/13/20/945261320.db2.gz RFGRIROWMMOTSI-KRWDZBQOSA-N 0 0 370.833 3.654 20 5 FHBDRN COC(=O)C1(N(C)C(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)CCCCC1 ZINC000438941591 945265347 /nfs/dbraw/zinc/26/53/47/945265347.db2.gz MGGFFXVFRXVRFE-UHFFFAOYSA-N 0 0 362.426 3.666 20 5 FHBDRN CC1CCN(C(=O)COc2ccc(-c3ccccc3)cc2[N+](=O)[O-])CC1 ZINC000516832538 945278272 /nfs/dbraw/zinc/27/82/72/945278272.db2.gz BSRIZJZWAIFYAK-UHFFFAOYSA-N 0 0 354.406 3.899 20 5 FHBDRN CCS[C@H]1CC[C@H](N(C)C(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)C1 ZINC000188461396 939884964 /nfs/dbraw/zinc/88/49/64/939884964.db2.gz IQZVAKDHPBLCRC-KBPBESRZSA-N 0 0 352.456 3.658 20 5 FHBDRN CCc1nn(C)c(OC)c1CNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000092962014 945279319 /nfs/dbraw/zinc/27/93/19/945279319.db2.gz VFBJNRFATALMPZ-UHFFFAOYSA-N 0 0 358.320 3.530 20 5 FHBDRN CC(C)c1ccc(OCCNC(=O)NCc2ccccc2[N+](=O)[O-])cc1 ZINC000410147646 939898769 /nfs/dbraw/zinc/89/87/69/939898769.db2.gz MUIJFPSVVHTECZ-UHFFFAOYSA-N 0 0 357.410 3.596 20 5 FHBDRN O=C(NCc1ccc(-c2cccnc2)cc1)c1ccc([N+](=O)[O-])cc1F ZINC000437372610 945280688 /nfs/dbraw/zinc/28/06/88/945280688.db2.gz LVZSHYXCTYXLFS-UHFFFAOYSA-N 0 0 351.337 3.726 20 5 FHBDRN COc1cc(C(=O)NCC2(CC(C)C)CCC2)c([N+](=O)[O-])cc1OC ZINC000151352320 945282784 /nfs/dbraw/zinc/28/27/84/945282784.db2.gz OBTZGCTYKITVMR-UHFFFAOYSA-N 0 0 350.415 3.558 20 5 FHBDRN CC(C)C[C@@H]1OCCC[C@@H]1NC(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000410735922 939950615 /nfs/dbraw/zinc/95/06/15/939950615.db2.gz KMFVCNDYPMQKPH-GJZGRUSLSA-N 0 0 374.359 3.937 20 5 FHBDRN Cc1cc(C(=O)N[C@H](C)c2ccc(N3CCCC3=O)cc2)ccc1[N+](=O)[O-] ZINC000065837056 939952170 /nfs/dbraw/zinc/95/21/70/939952170.db2.gz LGGZDIDPMKETGN-CQSZACIVSA-N 0 0 367.405 3.521 20 5 FHBDRN COC[C@@H](Nc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1)c1ccccc1 ZINC000091981444 939956905 /nfs/dbraw/zinc/95/69/05/939956905.db2.gz HWIWGXZHUBQNOK-GOSISDBHSA-N 0 0 369.421 3.630 20 5 FHBDRN COc1ccc(C(=O)Nc2ccc3[nH]c(C(F)F)nc3c2)cc1[N+](=O)[O-] ZINC000179828268 939966650 /nfs/dbraw/zinc/96/66/50/939966650.db2.gz MBYJXPYDSFCMBC-UHFFFAOYSA-N 0 0 362.292 3.670 20 5 FHBDRN CC(C)C(C)(C)S(=O)(=O)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000431643152 939967560 /nfs/dbraw/zinc/96/75/60/939967560.db2.gz LWDNAVVZECBPMS-UHFFFAOYSA-N 0 0 352.412 3.599 20 5 FHBDRN COc1cc(C(=O)Nc2cnc(-c3ccccc3)nc2)cc([N+](=O)[O-])c1C ZINC000188508619 939971269 /nfs/dbraw/zinc/97/12/69/939971269.db2.gz KQEVDBXFEFSYLS-UHFFFAOYSA-N 0 0 364.361 3.621 20 5 FHBDRN COc1ccc(CSCC(=O)NCC2CCC(C)CC2)cc1[N+](=O)[O-] ZINC000065854177 939972584 /nfs/dbraw/zinc/97/25/84/939972584.db2.gz QFPOBWBIJFTTKI-UHFFFAOYSA-N 0 0 366.483 3.779 20 5 FHBDRN COc1ccc(CCCN(C)C(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 ZINC000154583672 939980802 /nfs/dbraw/zinc/98/08/02/939980802.db2.gz XMJNJINKWNFILS-UHFFFAOYSA-N 0 0 362.813 3.962 20 5 FHBDRN COc1cc(C(=O)NC(C)(C)c2ccccc2C)c([N+](=O)[O-])cc1OC ZINC000410976250 939983886 /nfs/dbraw/zinc/98/38/86/939983886.db2.gz YZRNQEDWCVUHRF-UHFFFAOYSA-N 0 0 358.394 3.586 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc2c(c1)CCCC2=O ZINC000411016387 939986101 /nfs/dbraw/zinc/98/61/01/939986101.db2.gz OBFNHJKKRZCMDP-UHFFFAOYSA-N 0 0 354.362 3.765 20 5 FHBDRN Cn1c(C(=O)N(c2ccc(Br)cc2)C2CC2)ccc1[N+](=O)[O-] ZINC000411047654 939990797 /nfs/dbraw/zinc/99/07/97/939990797.db2.gz NAAYPQROYIBJPB-UHFFFAOYSA-N 0 0 364.199 3.505 20 5 FHBDRN CCN(c1ccnc(NC(=O)c2ccc([N+](=O)[O-])c(C)c2)n1)C1CCCC1 ZINC000411103069 939998210 /nfs/dbraw/zinc/99/82/10/939998210.db2.gz FHWPVRLQEXRBAF-UHFFFAOYSA-N 0 0 369.425 3.714 20 5 FHBDRN O=C(Nc1ccc(Sc2nncs2)cc1)c1ccccc1[N+](=O)[O-] ZINC000516521883 940000089 /nfs/dbraw/zinc/00/00/89/940000089.db2.gz KGNASBNJWGNRCY-UHFFFAOYSA-N 0 0 358.404 3.850 20 5 FHBDRN COc1cc(C(=O)N[C@@](C)(Cc2ccccc2)C2CC2)c([N+](=O)[O-])cc1F ZINC000411095418 940000996 /nfs/dbraw/zinc/00/09/96/940000996.db2.gz QNCXLBUYAMORJM-FQEVSTJZSA-N 0 0 372.396 3.884 20 5 FHBDRN CCCN(Cc1ccccc1)C(=O)C(=O)Nc1cc(C)c([N+](=O)[O-])cc1C ZINC000411160257 940004859 /nfs/dbraw/zinc/00/48/59/940004859.db2.gz SRISFCQNZZJQKV-UHFFFAOYSA-N 0 0 369.421 3.589 20 5 FHBDRN CCCN(Cc1ccccc1)C(=O)C(=O)Nc1cc([N+](=O)[O-])c(C)cc1C ZINC000411162292 940009661 /nfs/dbraw/zinc/00/96/61/940009661.db2.gz XNQDAVOJYKCFJQ-UHFFFAOYSA-N 0 0 369.421 3.589 20 5 FHBDRN Cc1cccc(OCCN(C)C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)c1 ZINC000411200398 940012876 /nfs/dbraw/zinc/01/28/76/940012876.db2.gz PPFITPQOXLKQQB-RBUKOAKNSA-N 0 0 354.406 3.544 20 5 FHBDRN Cc1cccc([C@H](C)NC(=O)C(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)c1C ZINC000411236897 940016807 /nfs/dbraw/zinc/01/68/07/940016807.db2.gz JBOQGWBGBKHCEF-HNNXBMFYSA-N 0 0 369.421 3.644 20 5 FHBDRN O=C1[C@H](Oc2cccc(C(F)(F)F)c2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000518284109 945289631 /nfs/dbraw/zinc/28/96/31/945289631.db2.gz RAVJGANIJAJQJA-OAHLLOKOSA-N 0 0 366.295 3.798 20 5 FHBDRN CCCOc1ccccc1NC(=O)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC000411250947 940022226 /nfs/dbraw/zinc/02/22/26/940022226.db2.gz GRXPTDKSTATVCH-UHFFFAOYSA-N 0 0 362.357 3.713 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N[C@H](C)c2ccc(C)cc2C)c1F ZINC000411332114 940028095 /nfs/dbraw/zinc/02/80/95/940028095.db2.gz AOJFYYTWGPCFBA-CYBMUJFWSA-N 0 0 360.385 3.779 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N(Cc2ccccc2C)C2CC2)c1F ZINC000411340659 940028603 /nfs/dbraw/zinc/02/86/03/940028603.db2.gz RRAOYZINCRUBBO-UHFFFAOYSA-N 0 0 372.396 3.785 20 5 FHBDRN C[C@@]1(O)CCCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)C1 ZINC000179864571 940033716 /nfs/dbraw/zinc/03/37/16/940033716.db2.gz KNKRUMLGDFEHIO-LJQANCHMSA-N 0 0 372.446 3.733 20 5 FHBDRN Cc1c(-c2nc([C@H]3CN(C4CCCCC4)CCO3)no2)cccc1[N+](=O)[O-] ZINC000364993272 940034687 /nfs/dbraw/zinc/03/46/87/940034687.db2.gz GZCMKFRHGNXTMN-QGZVFWFLSA-N 0 0 372.425 3.659 20 5 FHBDRN O=[N+]([O-])c1ccc(N[C@@H]2C[C@H](CO)c3ccccc32)cc1OC(F)F ZINC000364985645 940036935 /nfs/dbraw/zinc/03/69/35/940036935.db2.gz RMMRANSSTOUFPF-QMTHXVAHSA-N 0 0 350.321 3.829 20 5 FHBDRN Cc1nc(CC2CC2)sc1C(=O)N1c2ccc([N+](=O)[O-])cc2C[C@@H]1C ZINC000188530913 940037502 /nfs/dbraw/zinc/03/75/02/940037502.db2.gz LLIMSIGDGMPMIK-JTQLQIEISA-N 0 0 357.435 3.904 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)C(=O)N(CC1CC1)C1CCCCC1 ZINC000411391885 940042223 /nfs/dbraw/zinc/04/22/23/940042223.db2.gz BYNAYUJXIBSIHR-UHFFFAOYSA-N 0 0 373.453 3.721 20 5 FHBDRN Cc1cc(NC(=O)c2ccc([N+](=O)[O-])cc2C)n(-c2ccccc2F)n1 ZINC000154056226 940046509 /nfs/dbraw/zinc/04/65/09/940046509.db2.gz OWKRTGRBOYJSSB-UHFFFAOYSA-N 0 0 354.341 3.789 20 5 FHBDRN Cc1ccc(OCCCCNC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)cc1 ZINC000411462257 940051142 /nfs/dbraw/zinc/05/11/42/940051142.db2.gz PSRMNXMUBJQOTD-VQTJNVASSA-N 0 0 368.433 3.982 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cn1)N1CCC([C@H](F)c2ccccc2F)CC1 ZINC000375909591 940055088 /nfs/dbraw/zinc/05/50/88/940055088.db2.gz LHXPVXYZNRKDCG-KRWDZBQOSA-N 0 0 361.348 3.692 20 5 FHBDRN CC[C@@H](NC(=O)Cc1c(F)c(OC)ccc1[N+](=O)[O-])c1cccs1 ZINC000411545579 940061047 /nfs/dbraw/zinc/06/10/47/940061047.db2.gz QHKCECCZYKIDIU-LLVKDONJSA-N 0 0 352.387 3.614 20 5 FHBDRN O=C(C1CCC(F)(F)CC1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000136626003 940067323 /nfs/dbraw/zinc/06/73/23/940067323.db2.gz LASBFWSXLZRTEW-UHFFFAOYSA-N 0 0 368.380 3.790 20 5 FHBDRN O=C(C[C@@H](c1ccc(O)cc1)C1CC1)NCCc1ccc([N+](=O)[O-])cc1 ZINC000411588061 940070950 /nfs/dbraw/zinc/07/09/50/940070950.db2.gz YRXHOZCRYBBCKY-LJQANCHMSA-N 0 0 354.406 3.543 20 5 FHBDRN CSCCNC(=O)c1cc([N+](=O)[O-])ccc1SCC1CCCC1 ZINC000612443864 940072307 /nfs/dbraw/zinc/07/23/07/940072307.db2.gz NWZAWHLEBOBHGE-UHFFFAOYSA-N 0 0 354.497 3.970 20 5 FHBDRN CCCc1c(NC(=O)c2ccc([N+](=O)[O-])cn2)cnn1-c1ccc(F)cc1 ZINC000375930707 940074134 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/nfs/dbraw/zinc/12/26/09/940122609.db2.gz UBXYHHWGQRQLDE-UHFFFAOYSA-N 0 0 365.817 3.513 20 5 FHBDRN Cc1c(CC(=O)N[C@H]2CCCOc3c(F)cccc32)cccc1[N+](=O)[O-] ZINC000179919002 940129153 /nfs/dbraw/zinc/12/91/53/940129153.db2.gz LUMHDQXEYNRHGU-INIZCTEOSA-N 0 0 358.369 3.615 20 5 FHBDRN O=C(Nc1c[nH]ccc1=O)c1cc([N+](=O)[O-])ccc1SCC1CCCC1 ZINC000612535227 940129188 /nfs/dbraw/zinc/12/91/88/940129188.db2.gz CAYAOALGSFXKAX-UHFFFAOYSA-N 0 0 373.434 3.818 20 5 FHBDRN COc1ccc(-c2nc(NC(=O)c3ccc([N+](=O)[O-])n3C)sc2C)cc1 ZINC000612540343 940132026 /nfs/dbraw/zinc/13/20/26/940132026.db2.gz FNKSLVDXWVHCNY-UHFFFAOYSA-N 0 0 372.406 3.626 20 5 FHBDRN CC(C)(NC(=O)NCCc1cc(F)ccc1F)c1ccc([N+](=O)[O-])cc1 ZINC000431660202 940135983 /nfs/dbraw/zinc/13/59/83/940135983.db2.gz MKJNYMDKRPCOQW-UHFFFAOYSA-N 0 0 363.364 3.650 20 5 FHBDRN Cc1noc(C)c1[C@@H](C)NC(=O)c1c([N+](=O)[O-])cccc1C(F)(F)F ZINC000612545679 940137737 /nfs/dbraw/zinc/13/77/37/940137737.db2.gz LZEOEJMHTMOPDW-SSDOTTSWSA-N 0 0 357.288 3.709 20 5 FHBDRN CCO[C@H]1C[C@H](NC(=O)c2c([N+](=O)[O-])cccc2C(F)(F)F)C12CCC2 ZINC000612548025 940138562 /nfs/dbraw/zinc/13/85/62/940138562.db2.gz YDVJRLRWJHVZBM-STQMWFEESA-N 0 0 372.343 3.691 20 5 FHBDRN Cn1c(C(=O)Nc2cccc(-c3nc4ccccc4[nH]3)c2)ccc1[N+](=O)[O-] ZINC000612567551 940144647 /nfs/dbraw/zinc/14/46/47/940144647.db2.gz BHPFPPJBHMOXFZ-UHFFFAOYSA-N 0 0 361.361 3.729 20 5 FHBDRN COc1ccc(N(Cc2cccs2)C(=O)c2cc([N+](=O)[O-])cn2C)cc1 ZINC000612566765 940145527 /nfs/dbraw/zinc/14/55/27/940145527.db2.gz OLXVFINHYYLIDV-UHFFFAOYSA-N 0 0 371.418 3.850 20 5 FHBDRN O=C(c1cccc([N+](=O)[O-])c1)N1CCC(c2nc3c(cccc3F)[nH]2)CC1 ZINC000365393171 940149346 /nfs/dbraw/zinc/14/93/46/940149346.db2.gz PLKBVXQYCDMSJE-UHFFFAOYSA-N 0 0 368.368 3.630 20 5 FHBDRN CC[C@@H](c1cccc(OC)c1)N(C)C(=O)COc1ccccc1[N+](=O)[O-] ZINC000584489547 940157104 /nfs/dbraw/zinc/15/71/04/940157104.db2.gz KGWZJOPMOAFOLQ-INIZCTEOSA-N 0 0 358.394 3.592 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)Nc2cccc([C@H](C)OC)c2)c1F ZINC000411908779 940159477 /nfs/dbraw/zinc/15/94/77/940159477.db2.gz QSFFTSWJVNBVPM-NSHDSACASA-N 0 0 362.357 3.631 20 5 FHBDRN O=C(Nc1ncccc1Cl)c1ccc([N+](=O)[O-])cc1Br ZINC000179963859 940174715 /nfs/dbraw/zinc/17/47/15/940174715.db2.gz RMBXFZCZBOAFMG-UHFFFAOYSA-N 0 0 356.563 3.658 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2OCCC[C@@H]2C1 ZINC000181673939 945300733 /nfs/dbraw/zinc/30/07/33/945300733.db2.gz ZXOFBROKMCMBMW-CZUORRHYSA-N 0 0 364.467 3.736 20 5 FHBDRN CCOc1cc(OCc2nc([C@@H](C)SCC)no2)ccc1[N+](=O)[O-] ZINC000188584787 940179641 /nfs/dbraw/zinc/17/96/41/940179641.db2.gz QSDIVZNIXRTSKQ-SNVBAGLBSA-N 0 0 353.400 3.770 20 5 FHBDRN COc1cc(OCC(=O)Nc2ccccc2OCC(C)C)ccc1[N+](=O)[O-] ZINC000066025223 940204777 /nfs/dbraw/zinc/20/47/77/940204777.db2.gz JDFNPFSLRGWUOB-UHFFFAOYSA-N 0 0 374.393 3.656 20 5 FHBDRN COc1c(F)cc(NCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)cc1F ZINC000124488297 945303129 /nfs/dbraw/zinc/30/31/29/945303129.db2.gz WUCZYTXXJPGCGO-UHFFFAOYSA-N 0 0 362.292 3.544 20 5 FHBDRN CC(C)C(=O)COc1c2cc(Br)ccc2ncc1[N+](=O)[O-] ZINC000612661299 940208002 /nfs/dbraw/zinc/20/80/02/940208002.db2.gz XNOUDDNFORGYSQ-UHFFFAOYSA-N 0 0 353.172 3.509 20 5 FHBDRN O=[N+]([O-])c1cnc2ccc(Br)cc2c1OCCOCC1CC1 ZINC000612660842 940208382 /nfs/dbraw/zinc/20/83/82/940208382.db2.gz CVIPBMSILIGUCT-UHFFFAOYSA-N 0 0 367.199 3.711 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NCc2ccc(C(F)(F)F)cc2)c1 ZINC000548952342 940209044 /nfs/dbraw/zinc/20/90/44/940209044.db2.gz LQCPUBFVBIOWNT-UHFFFAOYSA-N 0 0 368.311 3.942 20 5 FHBDRN CCN(Cc1c[nH]c2ccccc12)C(=O)c1ccc([N+](=O)[O-])cc1OC ZINC000427347738 945303761 /nfs/dbraw/zinc/30/37/61/945303761.db2.gz QUGOUOAZHWNZLB-UHFFFAOYSA-N 0 0 353.378 3.747 20 5 FHBDRN Cc1cnc(-c2cccc(NC(=O)CNc3ccccc3[N+](=O)[O-])c2)o1 ZINC000066857498 945306735 /nfs/dbraw/zinc/30/67/35/945306735.db2.gz JHZDVTNNHCMHCJ-UHFFFAOYSA-N 0 0 352.350 3.609 20 5 FHBDRN Cn1c(COc2ccccc2)nnc1SCc1csc([N+](=O)[O-])c1 ZINC000124570829 945306778 /nfs/dbraw/zinc/30/67/78/945306778.db2.gz ABWWXKXUTKLDCM-UHFFFAOYSA-N 0 0 362.436 3.656 20 5 FHBDRN COCCOc1ccccc1COC(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000177519988 940247592 /nfs/dbraw/zinc/24/75/92/940247592.db2.gz YAJDDOAEBYGXHA-UHFFFAOYSA-N 0 0 365.769 3.630 20 5 FHBDRN Cc1cc(OCc2nn(C)cc2Br)c(Cl)cc1[N+](=O)[O-] ZINC000558853667 940250787 /nfs/dbraw/zinc/25/07/87/940250787.db2.gz UMBYIYHXIDTIJY-UHFFFAOYSA-N 0 0 360.595 3.632 20 5 FHBDRN CN(Cc1cc(Cl)cc(Cl)c1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000053116740 940261517 /nfs/dbraw/zinc/26/15/17/940261517.db2.gz KIJSZEMGEDOJQD-UHFFFAOYSA-N 0 0 368.220 3.633 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1C[C@H](C)Oc2c(Cl)cccc21 ZINC000427352420 945307338 /nfs/dbraw/zinc/30/73/38/945307338.db2.gz OOQSBKWSXDLJMR-JTQLQIEISA-N 0 0 362.769 3.685 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H]2CCCc3ccccc32)c1 ZINC000548959456 940272022 /nfs/dbraw/zinc/27/20/22/940272022.db2.gz RBZULGPQDYTYEG-HNNXBMFYSA-N 0 0 354.406 3.843 20 5 FHBDRN O=[N+]([O-])c1cc2c(ncnc2N2CC=C(c3ccc(O)cc3)CC2)s1 ZINC000376075427 940275694 /nfs/dbraw/zinc/27/56/94/940275694.db2.gz WOYBSUXNGAXJMZ-UHFFFAOYSA-N 0 0 354.391 3.599 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N(Cc2ccc(OC)cc2)C2CC2)c1 ZINC000548958991 940275884 /nfs/dbraw/zinc/27/58/84/940275884.db2.gz OBWIQNODPHCXOL-UHFFFAOYSA-N 0 0 370.405 3.807 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1c(F)cccc1Br ZINC000427374769 945308952 /nfs/dbraw/zinc/30/89/52/945308952.db2.gz JRCYMKYQKUFXHT-UHFFFAOYSA-N 0 0 369.146 3.757 20 5 FHBDRN CCOc1cc(OCc2nccn2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000188602238 940288378 /nfs/dbraw/zinc/28/83/78/940288378.db2.gz DSDCZOITEIOAGG-UHFFFAOYSA-N 0 0 353.378 3.817 20 5 FHBDRN CN(Cc1ccc(Br)s1)C(=O)c1ccc([N+](=O)[O-])s1 ZINC000018107831 945311113 /nfs/dbraw/zinc/31/11/13/945311113.db2.gz WFCAOQQAEKOQIZ-UHFFFAOYSA-N 0 0 361.242 3.753 20 5 FHBDRN Cc1cc(F)cc(-c2noc([C@H](C)NC(=O)c3cccc([N+](=O)[O-])c3)n2)c1 ZINC000612890790 940329661 /nfs/dbraw/zinc/32/96/61/940329661.db2.gz DIHAWJHZGFUBNW-NSHDSACASA-N 0 0 370.340 3.583 20 5 FHBDRN C[C@@H](c1ncc(C(C)(C)C)o1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000177633023 940329932 /nfs/dbraw/zinc/32/99/32/940329932.db2.gz SKCAJSJTEAYSSJ-AWEZNQCLSA-N 0 0 358.442 3.764 20 5 FHBDRN O=[N+]([O-])c1cccc(CCc2nc(Cc3ccc4ccccc4n3)no2)c1 ZINC000612893719 940330952 /nfs/dbraw/zinc/33/09/52/940330952.db2.gz LEWQQYQMNMGURB-UHFFFAOYSA-N 0 0 360.373 3.902 20 5 FHBDRN O=[N+]([O-])c1ccccc1OCc1nc(Cc2ccc3ccccc3n2)no1 ZINC000612893708 940331060 /nfs/dbraw/zinc/33/10/60/940331060.db2.gz JSUOSZYOXKKHIV-UHFFFAOYSA-N 0 0 362.345 3.696 20 5 FHBDRN CC(C)(NC(=O)NCc1ccc2ccccc2n1)c1ccc([N+](=O)[O-])cc1 ZINC000431701385 940335228 /nfs/dbraw/zinc/33/52/28/940335228.db2.gz CZNAWEFBURFPST-UHFFFAOYSA-N 0 0 364.405 3.878 20 5 FHBDRN COc1ccc(-c2nc([C@H]3CCc4ccccc4C3)no2)cc1[N+](=O)[O-] ZINC000612952143 940356827 /nfs/dbraw/zinc/35/68/27/940356827.db2.gz WAROHZWLHYPKPW-AWEZNQCLSA-N 0 0 351.362 3.926 20 5 FHBDRN O=[N+]([O-])c1ccc2c(cnn2CN2CCC(OC3CCCCC3)CC2)c1 ZINC000124740682 945317496 /nfs/dbraw/zinc/31/74/96/945317496.db2.gz GBXKPENFXJLQGI-UHFFFAOYSA-N 0 0 358.442 3.716 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])N1CC=C(c2ccc(Cl)nc2)CC1 ZINC000376150675 940380503 /nfs/dbraw/zinc/38/05/03/940380503.db2.gz ORCHNWIWNSFCFL-UHFFFAOYSA-N 0 0 357.797 3.502 20 5 FHBDRN CCN(CCC(F)(F)F)C(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F ZINC000612995218 940385159 /nfs/dbraw/zinc/38/51/59/940385159.db2.gz GSYNYLMNNATKEC-UHFFFAOYSA-N 0 0 350.312 3.812 20 5 FHBDRN O=C(Nc1cc(Cl)ccn1)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000236048476 940389035 /nfs/dbraw/zinc/38/90/35/940389035.db2.gz VPQLDAGMCHUXSR-UHFFFAOYSA-N 0 0 356.563 3.658 20 5 FHBDRN COCC(C)(C)N(Cc1ccccc1)C(=O)Cc1ccc([N+](=O)[O-])cc1F ZINC000472483256 940389784 /nfs/dbraw/zinc/38/97/84/940389784.db2.gz HSOMRRSEQXNSNI-UHFFFAOYSA-N 0 0 374.412 3.730 20 5 FHBDRN CCC[C@H]1CCCC[C@H]1NC(=O)c1ccc2c(c1[N+](=O)[O-])OCCCO2 ZINC001125803230 940391483 /nfs/dbraw/zinc/39/14/83/940391483.db2.gz VQWHEPASYDPOSG-DZGCQCFKSA-N 0 0 362.426 3.845 20 5 FHBDRN CC[C@H](C)[C@H](NC(=O)c1nn(CC)cc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000427358998 945314083 /nfs/dbraw/zinc/31/40/83/945314083.db2.gz TVVYYAVFCLAPBT-NHYWBVRUSA-N 0 0 364.833 3.982 20 5 FHBDRN COc1cc(C)ccc1NC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000066287218 940394002 /nfs/dbraw/zinc/39/40/02/940394002.db2.gz OTHFSYYBLGYRIS-UHFFFAOYSA-N 0 0 366.377 3.565 20 5 FHBDRN O=C(OCCn1cc([N+](=O)[O-])cn1)c1ccc(-c2ccccc2Cl)o1 ZINC000177743896 940399053 /nfs/dbraw/zinc/39/90/53/940399053.db2.gz UZWWLKRONKLMSX-UHFFFAOYSA-N 0 0 361.741 3.562 20 5 FHBDRN CSc1ccc([C@@H](C)NC(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)cc1 ZINC000066304983 940405254 /nfs/dbraw/zinc/40/52/54/940405254.db2.gz BGVHSDLHGAZJCY-LLVKDONJSA-N 0 0 374.418 3.579 20 5 FHBDRN COCC(C)(C)N(Cc1ccccc1)C(=O)c1cc([N+](=O)[O-])ccc1C ZINC000472488957 940409489 /nfs/dbraw/zinc/40/94/89/940409489.db2.gz YXRPLDQLKNEFCT-UHFFFAOYSA-N 0 0 356.422 3.971 20 5 FHBDRN C[C@H]1CCc2c(F)cccc2[C@@H]1NC(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000431721844 940409527 /nfs/dbraw/zinc/40/95/27/940409527.db2.gz JJHPPVLTSFCCJY-KPZWWZAWSA-N 0 0 357.385 3.857 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc3c(c2)OC(C)(C)O3)c1 ZINC000548979050 940410552 /nfs/dbraw/zinc/41/05/52/940410552.db2.gz RHCKBFOSTRGBAK-UHFFFAOYSA-N 0 0 358.350 3.753 20 5 FHBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(SCc2c(F)cccc2F)s1 ZINC000579896770 940413379 /nfs/dbraw/zinc/41/33/79/940413379.db2.gz VLQXZAGVVBXPDM-UHFFFAOYSA-N 0 0 365.404 3.630 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc(-c2cc[nH]n2)c1 ZINC000548980726 940416072 /nfs/dbraw/zinc/41/60/72/940416072.db2.gz QSKWQHAZIXNVOA-UHFFFAOYSA-N 0 0 365.393 3.691 20 5 FHBDRN CCOc1cc(OCc2nc(Cc3ccccc3)no2)ccc1[N+](=O)[O-] ZINC000188616766 940421453 /nfs/dbraw/zinc/42/14/53/940421453.db2.gz KTHHCCGUWCHLOY-UHFFFAOYSA-N 0 0 355.350 3.546 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)NC[C@@H](c1ccccc1)C1CC1 ZINC000579936749 940421740 /nfs/dbraw/zinc/42/17/40/940421740.db2.gz HXPILFZHBKXVDN-SFHVURJKSA-N 0 0 356.447 3.997 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)N(CC(C)C)c2ccc(Cl)cc2)n1 ZINC000427368006 945319658 /nfs/dbraw/zinc/31/96/58/945319658.db2.gz VZOVVXODTXGITD-UHFFFAOYSA-N 0 0 350.806 3.767 20 5 FHBDRN C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1cnc(-c2ccncc2)s1 ZINC000580011541 940430502 /nfs/dbraw/zinc/43/05/02/940430502.db2.gz JKENAVMRWBGKEJ-UHFFFAOYSA-N 0 0 354.435 3.788 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])cc2c1OCCO2)N(CC1CCCCC1)C1CC1 ZINC000066330443 940439083 /nfs/dbraw/zinc/43/90/83/940439083.db2.gz GSLVRMOQVQPZQO-UHFFFAOYSA-N 0 0 360.410 3.551 20 5 FHBDRN COc1c(F)cc(F)cc1NC(=O)c1ccc(SC)c([N+](=O)[O-])c1 ZINC000472502605 940441735 /nfs/dbraw/zinc/44/17/35/940441735.db2.gz REFNLUQEIYPVMR-UHFFFAOYSA-N 0 0 354.334 3.856 20 5 FHBDRN CCO[C@H](C)c1nc(COc2ccc(C(=O)OC)c([N+](=O)[O-])c2)cs1 ZINC000613109445 940451903 /nfs/dbraw/zinc/45/19/03/940451903.db2.gz ITJSYWCUFCYWDJ-SNVBAGLBSA-N 0 0 366.395 3.514 20 5 FHBDRN COC(=O)c1ccc(OCc2csc(-c3ccoc3)n2)cc1[N+](=O)[O-] ZINC000613109281 940451930 /nfs/dbraw/zinc/45/19/30/940451930.db2.gz ZPSCHSODRBWUOA-UHFFFAOYSA-N 0 0 360.347 3.677 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CN[C@@H](C)c1nc2ccc(Cl)cc2n1C ZINC000180094255 940467968 /nfs/dbraw/zinc/46/79/68/940467968.db2.gz UKVBYNBQYFCVOQ-NSHDSACASA-N 0 0 374.828 3.994 20 5 FHBDRN C[C@@H](NC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1)c1nccn1-c1ccccc1 ZINC000580247356 940470574 /nfs/dbraw/zinc/47/05/74/940470574.db2.gz IFSJSLKJWKATRA-LSDHHAIUSA-N 0 0 364.405 3.761 20 5 FHBDRN O=C(C1CC1)[C@@H]1CN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCO1 ZINC000580264640 940471132 /nfs/dbraw/zinc/47/11/32/940471132.db2.gz INGGMUXCDQJTNM-KRWDZBQOSA-N 0 0 372.446 3.503 20 5 FHBDRN C[C@@H]1CC[C@H](c2ccccc2)N(c2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])C1 ZINC000580424633 940474703 /nfs/dbraw/zinc/47/47/03/940474703.db2.gz RDMGXBPOWLWBJN-RHSMWYFYSA-N 0 0 374.462 3.976 20 5 FHBDRN O=C(CCc1cnn(-c2ccccc2)c1)Oc1cc(Cl)ccc1[N+](=O)[O-] ZINC000124837075 945323844 /nfs/dbraw/zinc/32/38/44/945323844.db2.gz CMTZMFGAOWSBAF-UHFFFAOYSA-N 0 0 371.780 3.972 20 5 FHBDRN Cc1ccncc1[C@H](C)Nc1ccc([N+](=O)[O-])c(OCc2ccccc2)n1 ZINC000613184203 940479171 /nfs/dbraw/zinc/47/91/71/940479171.db2.gz YAZNJQJHHYMEFD-HNNXBMFYSA-N 0 0 364.405 3.867 20 5 FHBDRN Cc1ccncc1[C@@H](C)Nc1ccc([N+](=O)[O-])c(OCc2ccccc2)n1 ZINC000613184205 940479227 /nfs/dbraw/zinc/47/92/27/940479227.db2.gz YAZNJQJHHYMEFD-OAHLLOKOSA-N 0 0 364.405 3.867 20 5 FHBDRN CC(C)c1cc(CNc2ccc([N+](=O)[O-])c(OCc3ccccc3)n2)on1 ZINC000613180973 940480261 /nfs/dbraw/zinc/48/02/61/940480261.db2.gz VIDMHXKGLPSXLO-UHFFFAOYSA-N 0 0 368.393 3.714 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1OC[C@@H](O)COc1ccccc1C(F)(F)F ZINC000580622082 940480573 /nfs/dbraw/zinc/48/05/73/940480573.db2.gz NKUXVELDGLSYBL-LBPRGKRZSA-N 0 0 371.311 3.741 20 5 FHBDRN CC(C)(NC(=O)/C=C\c1cnc2ccccc2n1)c1ccc([N+](=O)[O-])cc1 ZINC000255886803 940480793 /nfs/dbraw/zinc/48/07/93/940480793.db2.gz VFBDVLXKWNHJFM-XFXZXTDPSA-N 0 0 362.389 3.603 20 5 FHBDRN CO[C@H]1CCCC[C@H]1C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000511448320 940481927 /nfs/dbraw/zinc/48/19/27/940481927.db2.gz WOBPTYGQKUZOEN-RISCZKNCSA-N 0 0 371.231 3.809 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1[N-]S(=O)(=O)c1ccc(OC)cc1Cl ZINC000580608201 940482320 /nfs/dbraw/zinc/48/23/20/940482320.db2.gz GYUVDMHGFXDFNM-UHFFFAOYSA-N 0 0 370.814 3.620 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1OCc1csc(Nc2ccccc2)n1 ZINC000580733779 940483298 /nfs/dbraw/zinc/48/32/98/940483298.db2.gz OZGWNQPSTTUJHY-UHFFFAOYSA-N 0 0 357.391 3.804 20 5 FHBDRN CC(C)c1c(NCc2c([N+](=O)[O-])ncn2C)cnn1-c1ccccc1Cl ZINC000580754548 940484758 /nfs/dbraw/zinc/48/47/58/940484758.db2.gz ZRCAIHAVJBBNOP-UHFFFAOYSA-N 0 0 374.832 3.903 20 5 FHBDRN COc1cccc2c1OCC[C@H]2Nc1ncnc2sc([N+](=O)[O-])cc21 ZINC000376221477 940484982 /nfs/dbraw/zinc/48/49/82/940484982.db2.gz MZNGOUZAUIHKCJ-LLVKDONJSA-N 0 0 358.379 3.544 20 5 FHBDRN Cc1c(Br)cccc1-c1noc(-c2ccc([N+](=O)[O-])cn2)n1 ZINC000580809203 940488159 /nfs/dbraw/zinc/48/81/59/940488159.db2.gz BJPIIPKKUCXFMA-UHFFFAOYSA-N 0 0 361.155 3.778 20 5 FHBDRN Cc1cc(C(=O)Nc2ccc3[nH]c([C@@H]4CCCO4)nc3c2)ccc1[N+](=O)[O-] ZINC000066445380 940489171 /nfs/dbraw/zinc/48/91/71/940489171.db2.gz BNIQWLQNVGPTIE-KRWDZBQOSA-N 0 0 366.377 3.883 20 5 FHBDRN C[C@@H](CN(C)C(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)c1ccccc1 ZINC000066460375 940494873 /nfs/dbraw/zinc/49/48/73/940494873.db2.gz JVOAFANAZOYCHR-HNNXBMFYSA-N 0 0 364.405 3.656 20 5 FHBDRN C[C@H](NC(=O)NCCCCc1ccc([N+](=O)[O-])cc1)c1ccncc1F ZINC000511463114 940496265 /nfs/dbraw/zinc/49/62/65/940496265.db2.gz ZJISIQDWKJSCLD-ZDUSSCGKSA-N 0 0 360.389 3.512 20 5 FHBDRN Cc1ccccc1OCCNC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000431782669 940497443 /nfs/dbraw/zinc/49/74/43/940497443.db2.gz PYNIZEXHURUEHL-UHFFFAOYSA-N 0 0 357.410 3.517 20 5 FHBDRN Cc1ccnc(OC2CCN(c3ccc4cc([N+](=O)[O-])ccc4n3)CC2)c1 ZINC000581402386 940501400 /nfs/dbraw/zinc/50/14/00/940501400.db2.gz IUGLRUJWQPYBOD-UHFFFAOYSA-N 0 0 364.405 3.894 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCc1cccnc1OC(C)C ZINC000613296331 940506173 /nfs/dbraw/zinc/50/61/73/940506173.db2.gz RKCKWLMTRPJQLD-UHFFFAOYSA-N 0 0 358.398 3.716 20 5 FHBDRN C[C@H]1CC(CCNc2ncc([N+](=O)[O-])cc2Br)C[C@H](C)O1 ZINC000581501275 940507300 /nfs/dbraw/zinc/50/73/00/940507300.db2.gz PHEYGMGRFKJMGV-UWVGGRQHSA-N 0 0 358.236 3.758 20 5 FHBDRN Cc1c(CN2CCn3c(C4CCCC4)nnc3[C@H]2C)cccc1[N+](=O)[O-] ZINC000581507103 940507568 /nfs/dbraw/zinc/50/75/68/940507568.db2.gz WGIDOEGUXFMJCT-CQSZACIVSA-N 0 0 355.442 3.729 20 5 FHBDRN O=[N+]([O-])c1cc(CN2CCO[C@H](c3cccc(F)c3)C2)ccc1Cl ZINC000178013117 940509665 /nfs/dbraw/zinc/50/96/65/940509665.db2.gz IFXZUJBLXKVREO-KRWDZBQOSA-N 0 0 350.777 3.961 20 5 FHBDRN O=C([O-])c1cc(NCC[NH+]2CCC3(CCCCC3)CC2)ccc1[N+](=O)[O-] ZINC000581610149 940510245 /nfs/dbraw/zinc/51/02/45/940510245.db2.gz ASORUIUGAMOMRB-UHFFFAOYSA-N 0 0 361.442 3.751 20 5 FHBDRN O=C(c1c(Cl)cccc1[N+](=O)[O-])N1C[C@H]2CCC(=O)c3cccc1c32 ZINC000184382785 945331920 /nfs/dbraw/zinc/33/19/20/945331920.db2.gz DFUOXIGFZOKLRS-SNVBAGLBSA-N 0 0 356.765 3.969 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)Nc2ccccc2COC(C)(C)CC)n1 ZINC000427385949 945332446 /nfs/dbraw/zinc/33/24/46/945332446.db2.gz AYPDHLJDIVECDV-UHFFFAOYSA-N 0 0 360.414 3.769 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H](C1CCCCC1)C(F)(F)F ZINC000427386359 945332554 /nfs/dbraw/zinc/33/25/54/945332554.db2.gz GHUZRXIQQDEIHX-AWEZNQCLSA-N 0 0 360.332 3.844 20 5 FHBDRN Cc1ccc2c(c1C)OC[C@@H]2NC(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000511477794 940589206 /nfs/dbraw/zinc/58/92/06/940589206.db2.gz QONKOXKZIYVDOU-SFHVURJKSA-N 0 0 369.421 3.529 20 5 FHBDRN CCN1CCN(C(=O)C(C)(C)c2ccccc2[N+](=O)[O-])c2ccccc21 ZINC001125811799 940599774 /nfs/dbraw/zinc/59/97/74/940599774.db2.gz GFYWCHUIEXIJFM-UHFFFAOYSA-N 0 0 353.422 3.746 20 5 FHBDRN CCOc1cc(NC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)ccc1C ZINC000066526005 940601563 /nfs/dbraw/zinc/60/15/63/940601563.db2.gz XUILZLKHEQRGPL-UHFFFAOYSA-N 0 0 366.377 3.740 20 5 FHBDRN O=C(CCNc1cccc(COCC2CC2)c1)Nc1ccccc1[N+](=O)[O-] ZINC000581880194 940629250 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3.928 20 5 FHBDRN C[C@H]1CN(C(=O)c2ccc(Cl)cc2[N+](=O)[O-])[C@H](c2ccccc2)CO1 ZINC000173726713 940664753 /nfs/dbraw/zinc/66/47/53/940664753.db2.gz VFGJQGAOFXJEGT-SJCJKPOMSA-N 0 0 360.797 3.850 20 5 FHBDRN O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)N1CCCc2occc2C1 ZINC000582325048 940665799 /nfs/dbraw/zinc/66/57/99/940665799.db2.gz RMIVFFBQECKIAZ-UHFFFAOYSA-N 0 0 367.308 3.770 20 5 FHBDRN CCN(CCCNC(=O)c1cc(F)c(F)cc1[N+](=O)[O-])c1ccccc1 ZINC000120115968 940699122 /nfs/dbraw/zinc/69/91/22/940699122.db2.gz KKTLROYBKSPQQZ-UHFFFAOYSA-N 0 0 363.364 3.519 20 5 FHBDRN COCc1ccc([C@@H]2CCCN2c2ncnc3ccc([N+](=O)[O-])cc32)o1 ZINC000613433948 940705888 /nfs/dbraw/zinc/70/58/88/940705888.db2.gz DCKHHJWKFNOZHM-INIZCTEOSA-N 0 0 354.366 3.619 20 5 FHBDRN COC(=O)c1cnc(Oc2cnc3ccc(Cl)cc3c2)c([N+](=O)[O-])c1 ZINC000582563707 940724367 /nfs/dbraw/zinc/72/43/67/940724367.db2.gz NSRPLAULPHWVFD-UHFFFAOYSA-N 0 0 359.725 3.770 20 5 FHBDRN COc1ccc(-c2ocnc2C(=O)Nc2ccc([N+](=O)[O-])c(C)c2)cc1 ZINC000582569339 940727064 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CC(C)(NC(=O)c1ccn(-c2ccccc2F)n1)c1ccc([N+](=O)[O-])cc1 ZINC000176881539 941082489 /nfs/dbraw/zinc/08/24/89/941082489.db2.gz DFUVQLTWGMLIED-UHFFFAOYSA-N 0 0 368.368 3.585 20 5 FHBDRN CCc1c(C(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)[nH]c(C)c1C(C)=O ZINC000176883203 941082715 /nfs/dbraw/zinc/08/27/15/941082715.db2.gz WDLRRPCIMVMZLR-UHFFFAOYSA-N 0 0 357.410 3.661 20 5 FHBDRN COC(=O)c1cc(OCc2nc(C(C)(C)C)cs2)ccc1[N+](=O)[O-] ZINC000176928554 941087669 /nfs/dbraw/zinc/08/76/69/941087669.db2.gz PGEBLNMTCJHRHS-UHFFFAOYSA-N 0 0 350.396 3.714 20 5 FHBDRN Nc1cccc([N+](=O)[O-])c1C(=O)N1Cc2ccccc2[C@H](c2ccccc2)C1 ZINC000180903167 941090663 /nfs/dbraw/zinc/09/06/63/941090663.db2.gz FFYADJIAQVIAHR-SFHVURJKSA-N 0 0 373.412 3.965 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2noc(N3CCSC4(CCCCC4)C3)n2)cc1 ZINC000431831147 941092333 /nfs/dbraw/zinc/09/23/33/941092333.db2.gz FKGRJPPUFIUAFG-UHFFFAOYSA-N 0 0 360.439 3.901 20 5 FHBDRN COCCn1cc2c(n1)[C@H](NCc1ccc(C(C)C)c([N+](=O)[O-])c1)CCC2 ZINC000376504798 941092340 /nfs/dbraw/zinc/09/23/40/941092340.db2.gz IPALDUSZPQHINB-GOSISDBHSA-N 0 0 372.469 3.728 20 5 FHBDRN C[C@H](CCc1ccccc1[N+](=O)[O-])Nc1cn(C)nc1-c1ccccn1 ZINC000613540205 941099239 /nfs/dbraw/zinc/09/92/39/941099239.db2.gz DZCLKRIALHPVFH-CQSZACIVSA-N 0 0 351.410 3.824 20 5 FHBDRN COc1ccc2c(c1)OCC[C@H]2NC(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000365524270 941100978 /nfs/dbraw/zinc/10/09/78/941100978.db2.gz CRCCMHAKWALDDW-OAHLLOKOSA-N 0 0 362.769 3.510 20 5 FHBDRN COC[C@H](NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1)c1ccc(F)c(F)c1 ZINC000181042611 941105463 /nfs/dbraw/zinc/10/54/63/941105463.db2.gz FIULCBQWEXUIOV-HNNXBMFYSA-N 0 0 370.739 3.644 20 5 FHBDRN O=C(N[C@H]1C[C@H]1c1cccc(F)c1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000181077621 941107553 /nfs/dbraw/zinc/10/75/53/941107553.db2.gz HVDNOHRVFNHYJY-JSGCOSHPSA-N 0 0 366.295 3.621 20 5 FHBDRN CC[C@@H]1CN(C(=O)c2c(N)cccc2[N+](=O)[O-])CC[C@H]1c1ccccc1 ZINC000181148609 941109044 /nfs/dbraw/zinc/10/90/44/941109044.db2.gz XVNBSYGXJLDQDB-GDBMZVCRSA-N 0 0 353.422 3.833 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CCO[C@@H](c2cccc(F)c2)C1 ZINC000188840473 941109308 /nfs/dbraw/zinc/10/93/08/941109308.db2.gz QJGPJYFBGIFOTF-QGZVFWFLSA-N 0 0 359.357 3.648 20 5 FHBDRN Cc1cccc(Cl)c1CS(=O)(=O)Cc1cccc([N+](=O)[O-])c1C ZINC000414409952 941111617 /nfs/dbraw/zinc/11/16/17/941111617.db2.gz ILGHIEAFFKAGCE-UHFFFAOYSA-N 0 0 353.827 3.980 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CCN(c2ccccc2)CC1 ZINC000120146845 941114833 /nfs/dbraw/zinc/11/48/33/941114833.db2.gz OICCSUHJRRUZAW-UHFFFAOYSA-N 0 0 354.410 3.566 20 5 FHBDRN COc1cc(C(=O)N[C@@H]2CCCC[C@@H]2C(C)C)c([N+](=O)[O-])cc1OC ZINC000103057363 941115106 /nfs/dbraw/zinc/11/51/06/941115106.db2.gz LHDWQKDPVYDFOW-TZMCWYRMSA-N 0 0 350.415 3.557 20 5 FHBDRN CCOc1cc(C(=O)N[C@H]2CCCC[C@@H]2C(C)C)c([N+](=O)[O-])cc1OC ZINC000103056306 941115137 /nfs/dbraw/zinc/11/51/37/941115137.db2.gz RRSUDIDXNPFEQT-HIFRSBDPSA-N 0 0 364.442 3.947 20 5 FHBDRN Cc1ccccc1[C@H]1C[C@H](C)N(C(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)C1 ZINC000181255931 941117834 /nfs/dbraw/zinc/11/78/34/941117834.db2.gz YUUXVVNTOYEPOZ-ZFWWWQNUSA-N 0 0 368.389 3.650 20 5 FHBDRN CC[C@H](CNc1c([N+](=O)[O-])c(C)nn1C)Oc1cccc(C(F)(F)F)c1 ZINC000431831958 941124717 /nfs/dbraw/zinc/12/47/17/941124717.db2.gz NUIQQQVNEWRMDJ-GFCCVEGCSA-N 0 0 372.347 3.925 20 5 FHBDRN O=C(Nc1ccc2c(c1)CCCO2)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000181346024 941128831 /nfs/dbraw/zinc/12/88/31/941128831.db2.gz QKZKZANWCGWQQC-UHFFFAOYSA-N 0 0 364.304 3.774 20 5 FHBDRN O=C(COc1cccc([N+](=O)[O-])c1)Nc1cnccc1-c1cccc(F)c1 ZINC000177534000 941134699 /nfs/dbraw/zinc/13/46/99/941134699.db2.gz YKNRZRZDXYFOJN-UHFFFAOYSA-N 0 0 367.336 3.813 20 5 FHBDRN Cc1ccc2c(c1)O[C@@H](C)CN2C(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000178227905 941136278 /nfs/dbraw/zinc/13/62/78/941136278.db2.gz JSSFHPILTPBZBX-LBPRGKRZSA-N 0 0 351.362 3.812 20 5 FHBDRN COc1cc(CS(=O)(=O)[C@H](C)c2cccc([N+](=O)[O-])c2)ccc1Cl ZINC000414429857 941136393 /nfs/dbraw/zinc/13/63/93/941136393.db2.gz VKSWFHIYTBPCAB-LLVKDONJSA-N 0 0 369.826 3.933 20 5 FHBDRN CCSc1cc(CNC(=O)[C@@H](CC)Cc2ccc([N+](=O)[O-])cc2)ccn1 ZINC000189096990 941145488 /nfs/dbraw/zinc/14/54/88/941145488.db2.gz PZQIVXZXIBUYRG-INIZCTEOSA-N 0 0 373.478 3.987 20 5 FHBDRN CCSc1cc(CNC(=O)c2c(C)cc(C)c([N+](=O)[O-])c2C)ccn1 ZINC000189047286 941145662 /nfs/dbraw/zinc/14/56/62/941145662.db2.gz LNWLQJAVYCAPHI-UHFFFAOYSA-N 0 0 359.451 3.957 20 5 FHBDRN Cc1c(NC(=O)CCOc2ccccc2[N+](=O)[O-])cnn1CCC(C)C ZINC000122200901 941146424 /nfs/dbraw/zinc/14/64/24/941146424.db2.gz MUCADHSNDPABOB-UHFFFAOYSA-N 0 0 360.414 3.553 20 5 FHBDRN Cc1cc(NC(=O)N2CCN(c3ccccc3F)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000616099375 941151517 /nfs/dbraw/zinc/15/15/17/941151517.db2.gz OKUSDLQVGPFSMO-AWEZNQCLSA-N 0 0 372.400 3.785 20 5 FHBDRN C[C@@H](CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])Oc1ccc(F)cc1 ZINC000072500508 941155272 /nfs/dbraw/zinc/15/52/72/941155272.db2.gz FHXBNYMOPCXGCN-JTQLQIEISA-N 0 0 352.749 3.585 20 5 FHBDRN Cc1csc([C@H]2COCCN2Cc2ccc(Cl)cc2[N+](=O)[O-])n1 ZINC000189308874 941155770 /nfs/dbraw/zinc/15/57/70/941155770.db2.gz HBTWMZMTJYTPQD-CQSZACIVSA-N 0 0 353.831 3.587 20 5 FHBDRN CCN(Cc1c[nH]c2ccccc12)C(=O)COc1cccc([N+](=O)[O-])c1 ZINC000189565617 941161324 /nfs/dbraw/zinc/16/13/24/941161324.db2.gz DNJPBJVBVVZCDA-UHFFFAOYSA-N 0 0 353.378 3.504 20 5 FHBDRN Cc1nn(-c2ccccc2)cc1NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000181420250 941161780 /nfs/dbraw/zinc/16/17/80/941161780.db2.gz PBBYGRHAMYNTEK-UHFFFAOYSA-N 0 0 370.796 3.924 20 5 FHBDRN Cc1ccc2[nH]c([C@@H]3CCCN3c3nc4cc([N+](=O)[O-])ccc4[nH]3)nc2c1 ZINC000573059359 941163596 /nfs/dbraw/zinc/16/35/96/941163596.db2.gz ZXRYWKCYZMNFLE-KRWDZBQOSA-N 0 0 362.393 3.997 20 5 FHBDRN C[C@@H](NC(=O)c1cccc(OC[C@H]2CCCO2)c1)c1cccc([N+](=O)[O-])c1 ZINC000077661747 941211583 /nfs/dbraw/zinc/21/15/83/941211583.db2.gz AATQSBBSOJTUNR-AUUYWEPGSA-N 0 0 370.405 3.644 20 5 FHBDRN O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCCCC[C@@H]1c1ncon1 ZINC000189594834 941213511 /nfs/dbraw/zinc/21/35/11/941213511.db2.gz OVRRFHVOHVZOKR-CYBMUJFWSA-N 0 0 372.406 3.950 20 5 FHBDRN CCOc1cccc2[nH]cc(CC(=O)N(C)c3cccc([N+](=O)[O-])c3)c21 ZINC000189595906 941213938 /nfs/dbraw/zinc/21/39/38/941213938.db2.gz OKDTVTCRPNGQIM-UHFFFAOYSA-N 0 0 353.378 3.680 20 5 FHBDRN C[C@H](C1CC1)n1cc(NC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)cn1 ZINC000189661322 941245328 /nfs/dbraw/zinc/24/53/28/941245328.db2.gz CUJNCSKAUNSNHO-CQSZACIVSA-N 0 0 371.441 3.907 20 5 FHBDRN Cc1cnc([C@@H](NC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)C2CC2)s1 ZINC000549106315 941285837 /nfs/dbraw/zinc/28/58/37/941285837.db2.gz SCPLBELZGHNATP-INIZCTEOSA-N 0 0 374.466 3.695 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1N1CC[C@@H](C2CCOCC2)C1 ZINC000407989213 941286744 /nfs/dbraw/zinc/28/67/44/941286744.db2.gz GIVGWEWMTXEMOK-GFCCVEGCSA-N 0 0 355.232 3.610 20 5 FHBDRN COC[C@@H](C)n1ccc(NCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)n1 ZINC000189884497 941293454 /nfs/dbraw/zinc/29/34/54/941293454.db2.gz BOEMMJYKCTZCSF-CYBMUJFWSA-N 0 0 356.382 3.871 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CCN(c2ccccc2F)C[C@@H]1C ZINC000189902786 941297518 /nfs/dbraw/zinc/29/75/18/941297518.db2.gz FOQQPKPWGZNFEJ-AWEZNQCLSA-N 0 0 372.400 3.785 20 5 FHBDRN C/C(=C\C(=O)NCc1cc(-c2ccccc2)no1)c1ccc([N+](=O)[O-])cc1 ZINC000785245649 941301748 /nfs/dbraw/zinc/30/17/48/941301748.db2.gz LNEZAQLTKYGKLX-SDNWHVSQSA-N 0 0 363.373 3.970 20 5 FHBDRN Cc1c(CN2CCC(C(=O)c3ccc(O)cc3)CC2)cccc1[N+](=O)[O-] ZINC000122249340 941306879 /nfs/dbraw/zinc/30/68/79/941306879.db2.gz KLQCOAMLUOIOGC-UHFFFAOYSA-N 0 0 354.406 3.704 20 5 FHBDRN CCOc1c(Cl)cccc1CC(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000189942684 941307870 /nfs/dbraw/zinc/30/78/70/941307870.db2.gz HQOGONYKBIFXCY-UHFFFAOYSA-N 0 0 362.813 3.548 20 5 FHBDRN CC1(C)CN(C(=O)c2c(Cl)cccc2[N+](=O)[O-])CC2(CCCC2)O1 ZINC000189948471 941312754 /nfs/dbraw/zinc/31/27/54/941312754.db2.gz JJZNBTYWEYLAGI-UHFFFAOYSA-N 0 0 352.818 3.812 20 5 FHBDRN CSc1ccc(C(=O)Nc2ccc(NC(C)=O)c(C)c2)cc1[N+](=O)[O-] ZINC000892695849 941329056 /nfs/dbraw/zinc/32/90/56/941329056.db2.gz FEGGXTGXQIPAFF-UHFFFAOYSA-N 0 0 359.407 3.836 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N(Cc1c(F)cccc1F)C1CC1 ZINC000190003623 941334098 /nfs/dbraw/zinc/33/40/98/941334098.db2.gz SVWAQHZBYLLPSW-UHFFFAOYSA-N 0 0 360.360 3.997 20 5 FHBDRN COc1ccc(F)cc1[C@H](C)NC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000122254058 941336364 /nfs/dbraw/zinc/33/63/64/941336364.db2.gz XXTPPPVRFDMSAT-LBPRGKRZSA-N 0 0 373.384 3.571 20 5 FHBDRN CCC(CC)[C@H]1C[C@H](NC(=O)Nc2cc([N+](=O)[O-])ccc2OC)CCO1 ZINC000181492511 941336548 /nfs/dbraw/zinc/33/65/48/941336548.db2.gz DXOSJJYICXVZCE-CXAGYDPISA-N 0 0 365.430 3.709 20 5 FHBDRN O=C(C[C@@H]1CCC[C@@H](C(F)(F)F)O1)N1CCCc2ccc([N+](=O)[O-])cc21 ZINC001125848656 941341786 /nfs/dbraw/zinc/34/17/86/941341786.db2.gz VOYADFFIQXWZQI-ZFWWWQNUSA-N 0 0 372.343 3.764 20 5 FHBDRN Cc1ccc(-c2nc(C(=O)Nc3cccc([N+](=O)[O-])c3C)cs2)n1C ZINC000122263614 941361879 /nfs/dbraw/zinc/36/18/79/941361879.db2.gz FZFQHODKMKJLDM-UHFFFAOYSA-N 0 0 356.407 3.926 20 5 FHBDRN CC(C)c1ccc(CNCc2nccc(C(F)(F)F)n2)cc1[N+](=O)[O-] ZINC000414500721 941373199 /nfs/dbraw/zinc/37/31/99/941373199.db2.gz CLLHOBPDSABRQV-UHFFFAOYSA-N 0 0 354.332 3.817 20 5 FHBDRN C[C@@H](NC(=O)CCc1c(Cl)cccc1[N+](=O)[O-])c1c(F)cncc1F ZINC000935967637 941379778 /nfs/dbraw/zinc/37/97/78/941379778.db2.gz FZNBWZLHDJKNML-SECBINFHSA-N 0 0 369.755 3.731 20 5 FHBDRN Cc1cncn1C1CCN(c2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000376741839 941407315 /nfs/dbraw/zinc/40/73/15/941407315.db2.gz JYPKPHUMDNKFGS-UHFFFAOYSA-N 0 0 365.231 3.704 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)Nc2ccnn2-c2ccc(Cl)cc2)c1 ZINC000072536455 941424611 /nfs/dbraw/zinc/42/46/11/941424611.db2.gz YQJKWKYDQCQVMV-UHFFFAOYSA-N 0 0 356.769 3.995 20 5 FHBDRN CN(c1ccccc1)c1ccc(C[NH2+]CCCCC(=O)[O-])cc1[N+](=O)[O-] ZINC000414684659 941439035 /nfs/dbraw/zinc/43/90/35/941439035.db2.gz RFURQKWGBDCTQC-UHFFFAOYSA-N 0 0 357.410 3.707 20 5 FHBDRN CCCN(C(=O)c1ccc([N+](=O)[O-])cc1F)[C@@H]1C[C@H](OCC)C1(C)C ZINC000564449462 941457014 /nfs/dbraw/zinc/45/70/14/941457014.db2.gz IDMGKMFLDPJOIS-CVEARBPZSA-N 0 0 352.406 3.790 20 5 FHBDRN CCOc1cccc(NC2CCN(Cc3cscn3)CC2)c1[N+](=O)[O-] ZINC000376924918 941467735 /nfs/dbraw/zinc/46/77/35/941467735.db2.gz AJSBPIPUBZFMRK-UHFFFAOYSA-N 0 0 362.455 3.527 20 5 FHBDRN C[C@@H](SCc1c([N+](=O)[O-])ncn1C)c1nc(-c2cccc(F)c2)no1 ZINC000376940017 941470681 /nfs/dbraw/zinc/47/06/81/941470681.db2.gz DGVZRVBWDYIKBF-SECBINFHSA-N 0 0 363.374 3.512 20 5 FHBDRN C/C=C\C[C@H](CO)Nc1ccc(C(=O)Nc2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000472652107 941487382 /nfs/dbraw/zinc/48/73/82/941487382.db2.gz SIEXCLARLFONPO-CWIOURORSA-N 0 0 369.421 3.895 20 5 FHBDRN CCC(=O)c1ccc(N[C@H](c2nc[nH]n2)c2ccccc2)c([N+](=O)[O-])c1 ZINC000377087061 941511787 /nfs/dbraw/zinc/51/17/87/941511787.db2.gz SDOHRPQQQHPRGO-KRWDZBQOSA-N 0 0 351.366 3.507 20 5 FHBDRN COc1cc(Cl)c(C)cc1NC(=O)Cc1ccc([N+](=O)[O-])cc1F ZINC000122326323 941527982 /nfs/dbraw/zinc/52/79/82/941527982.db2.gz KBMXKGLACXVICC-UHFFFAOYSA-N 0 0 352.749 3.886 20 5 FHBDRN Cc1ccc(-c2nc(CCNC(=O)c3ccccc3[N+](=O)[O-])co2)cc1 ZINC000377174275 941541498 /nfs/dbraw/zinc/54/14/98/941541498.db2.gz VHXGUROHKDYPBM-UHFFFAOYSA-N 0 0 351.362 3.531 20 5 FHBDRN C[C@H](NC(=O)c1c[nH]nc1[N+](=O)[O-])c1ccc(Oc2ccccc2)c(F)c1 ZINC000549157537 941552040 /nfs/dbraw/zinc/55/20/40/941552040.db2.gz AZXJZCPKQKIPHS-NSHDSACASA-N 0 0 370.340 3.740 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CC[C@H](c2ccccc2F)C1 ZINC000412056408 941566085 /nfs/dbraw/zinc/56/60/85/941566085.db2.gz OHRSWDVJMAHAFG-JCGIZDLHSA-N 0 0 354.381 3.854 20 5 FHBDRN CC1=C(c2ccco2)CN(C(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)CC1 ZINC000549164581 941568622 /nfs/dbraw/zinc/56/86/22/941568622.db2.gz IERPYFCNVFWVCZ-UHFFFAOYSA-N 0 0 351.362 3.989 20 5 FHBDRN Cn1cc([N+](=O)[O-])c(C(=O)N2CCC[C@@H]2c2cccc(Cl)c2Cl)n1 ZINC000377244849 941591702 /nfs/dbraw/zinc/59/17/02/941591702.db2.gz YFQSHZLRPUFQGO-LLVKDONJSA-N 0 0 369.208 3.612 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(N[C@@H](C)[C@@H](OC)c2ccc(F)cc2)c1 ZINC000541113101 941594874 /nfs/dbraw/zinc/59/48/74/941594874.db2.gz HLBRGWBEIXCARA-APPDUMDISA-N 0 0 362.357 3.709 20 5 FHBDRN O=C(Nc1cccc2c1OCO2)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000541108475 941600043 /nfs/dbraw/zinc/60/00/43/941600043.db2.gz LRASGEFFYJDQAH-UHFFFAOYSA-N 0 0 354.240 3.595 20 5 FHBDRN Cc1ccnc(OC2CCN(Cc3ccc([N+](=O)[O-])cc3Cl)CC2)c1 ZINC000541107678 941602047 /nfs/dbraw/zinc/60/20/47/941602047.db2.gz ZXWJDXQIOKGUDC-UHFFFAOYSA-N 0 0 361.829 3.995 20 5 FHBDRN Cc1ccc(F)c2c1N(C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)CCC2 ZINC000066786776 941638782 /nfs/dbraw/zinc/63/87/82/941638782.db2.gz BFIAZLGKYRAWTK-UHFFFAOYSA-N 0 0 359.313 3.544 20 5 FHBDRN CCc1ccc(-c2csc(NC(=O)c3cc([N+](=O)[O-])cn3C)n2)cc1 ZINC000024465919 941660055 /nfs/dbraw/zinc/66/00/55/941660055.db2.gz NTHZIUYBTYTLIQ-UHFFFAOYSA-N 0 0 356.407 3.872 20 5 FHBDRN O=C(c1c[nH]nc1[N+](=O)[O-])N1CC=C(c2ccc(Cl)c(Cl)c2)CC1 ZINC000549224342 941673087 /nfs/dbraw/zinc/67/30/87/941673087.db2.gz XDVUKHWLUGITFK-UHFFFAOYSA-N 0 0 367.192 3.554 20 5 FHBDRN Cc1ccc(C(=O)Nc2ccc(SC(=O)N(C)C)cc2)cc1[N+](=O)[O-] ZINC000729241981 941699434 /nfs/dbraw/zinc/69/94/34/941699434.db2.gz BCDSRPNNMOCTKO-UHFFFAOYSA-N 0 0 359.407 3.929 20 5 FHBDRN Cc1ccc(C(=O)Nc2cccc(SC(=O)N(C)C)c2)cc1[N+](=O)[O-] ZINC000729242872 941699984 /nfs/dbraw/zinc/69/99/84/941699984.db2.gz NZSHGDSDCJYYMZ-UHFFFAOYSA-N 0 0 359.407 3.929 20 5 FHBDRN CC(C)n1ncc2cc(NC(=O)N[C@@H](C)c3cccc([N+](=O)[O-])c3)cnc21 ZINC000047524508 941705892 /nfs/dbraw/zinc/70/58/92/941705892.db2.gz HYNADOSKEUWMBC-LBPRGKRZSA-N 0 0 368.397 3.803 20 5 FHBDRN C[C@H]1Oc2cc(F)ccc2[C@H]1NC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000377418176 941711633 /nfs/dbraw/zinc/71/16/33/941711633.db2.gz GQUMPLWLZUYBGJ-GLEZIHRCSA-N 0 0 350.733 3.639 20 5 FHBDRN CC(C)Cc1ccccc1C(=O)OCC(=O)Nc1cccc([N+](=O)[O-])c1 ZINC001125859501 941715505 /nfs/dbraw/zinc/71/55/05/941715505.db2.gz UENZVHBGOCHARI-UHFFFAOYSA-N 0 0 356.378 3.589 20 5 FHBDRN C[C@@H](O)c1ccc(CNC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000178864321 941735037 /nfs/dbraw/zinc/73/50/37/941735037.db2.gz SAVNTQCFVCJZAD-CQSZACIVSA-N 0 0 369.421 3.522 20 5 FHBDRN COc1cc(C(=O)Nc2cccc(F)c2F)c([N+](=O)[O-])cc1OC(F)F ZINC000122434247 941736221 /nfs/dbraw/zinc/73/62/21/941736221.db2.gz DJMCQVFCMAYXQE-UHFFFAOYSA-N 0 0 374.246 3.735 20 5 FHBDRN O=[N+]([O-])c1cc2c(cc1CN1CCC(c3ccsc3)CC1)OCCO2 ZINC000614456464 941737127 /nfs/dbraw/zinc/73/71/27/941737127.db2.gz VZKHWBWHMDZHRV-UHFFFAOYSA-N 0 0 360.435 3.807 20 5 FHBDRN CN(Cc1cn(C)nc1C(F)(F)F)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000178877568 941739362 /nfs/dbraw/zinc/73/93/62/941739362.db2.gz CKFIWEIGZZOJMC-UHFFFAOYSA-N 0 0 362.739 3.633 20 5 FHBDRN Nc1c(F)c(N2CC[C@H](Oc3ccc(Cl)cc3)C2)ccc1[N+](=O)[O-] ZINC000549251671 941750428 /nfs/dbraw/zinc/75/04/28/941750428.db2.gz ZIHPXAIMCVLGOG-LBPRGKRZSA-N 0 0 351.765 3.627 20 5 FHBDRN COc1ccc([C@@H](CCO)Nc2nc3ccccc3cc2[N+](=O)[O-])cc1 ZINC000473524326 941763137 /nfs/dbraw/zinc/76/31/37/941763137.db2.gz XCNSULQKHYLJPR-QGZVFWFLSA-N 0 0 353.378 3.687 20 5 FHBDRN O=C(Cc1noc2ccc(F)cc21)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000415340607 941766112 /nfs/dbraw/zinc/76/61/12/941766112.db2.gz WQSKYVMTNQPJQP-UHFFFAOYSA-N 0 0 369.352 3.609 20 5 FHBDRN Cc1c(NC(=O)[C@@H](C)N2CCC[C@H]2c2nccs2)cccc1[N+](=O)[O-] ZINC000377502476 941768943 /nfs/dbraw/zinc/76/89/43/941768943.db2.gz MGZHRCZLXSJSFD-DOMZBBRYSA-N 0 0 360.439 3.524 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])N[C@@H](c1cc(F)ccc1F)C(F)F ZINC000433621017 941789942 /nfs/dbraw/zinc/78/99/42/941789942.db2.gz DNSPPCHSFFVFKL-AWEZNQCLSA-N 0 0 371.290 3.679 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(OC)c(OC(C)C)c2)c1 ZINC000274198646 941795388 /nfs/dbraw/zinc/79/53/88/941795388.db2.gz KZFKQASZRFYPMD-UHFFFAOYSA-N 0 0 360.366 3.652 20 5 FHBDRN CC(C)(CNC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)Oc1ccccc1 ZINC000412117500 941797252 /nfs/dbraw/zinc/79/72/52/941797252.db2.gz WDTZHWNZQPHPQT-ZWKOTPCHSA-N 0 0 354.406 3.672 20 5 FHBDRN C[C@@H](NCc1coc(-c2ccc([N+](=O)[O-])cc2)n1)c1c(F)cncc1F ZINC000513241921 941811445 /nfs/dbraw/zinc/81/14/45/941811445.db2.gz NBJCPXPVDWPPLQ-SNVBAGLBSA-N 0 0 360.320 3.774 20 5 FHBDRN CC(=O)c1ccc(-c2nc(Cc3c[nH]c4ccc([N+](=O)[O-])cc34)no2)cc1 ZINC000472799709 941814216 /nfs/dbraw/zinc/81/42/16/941814216.db2.gz NYNDBIYQLQKNAE-UHFFFAOYSA-N 0 0 362.345 3.920 20 5 FHBDRN Cc1cc(NC(=O)N2CCC(c3cccc(N)c3)CC2)ccc1[N+](=O)[O-] ZINC000415422532 941815862 /nfs/dbraw/zinc/81/58/62/941815862.db2.gz WVJUWZNAGNFATP-UHFFFAOYSA-N 0 0 354.410 3.897 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C(=O)Nc2ccccc2C[S@@](C)=O)cc1Cl ZINC001267660294 941819776 /nfs/dbraw/zinc/81/97/76/941819776.db2.gz IETJQOCFJWKASZ-XMMPIXPASA-N 0 0 366.826 3.687 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)NC[C@H](C)c2cccc(C)c2)c1F ZINC000412134643 941828228 /nfs/dbraw/zinc/82/82/28/941828228.db2.gz SDIWJKCOAZPVTG-ZDUSSCGKSA-N 0 0 360.385 3.513 20 5 FHBDRN CCOC(=O)c1cc(NCc2cnn(-c3ccccc3)c2)ccc1[N+](=O)[O-] ZINC000433699455 941839660 /nfs/dbraw/zinc/83/96/60/941839660.db2.gz OBUUJZQLUGNOLV-UHFFFAOYSA-N 0 0 366.377 3.569 20 5 FHBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)c1cc(=O)c2ccccc2o1 ZINC000118687246 941842355 /nfs/dbraw/zinc/84/23/55/941842355.db2.gz LCWQDCQOOMMPMW-UHFFFAOYSA-N 0 0 358.737 3.915 20 5 FHBDRN Cc1ccc(C)c(C(=O)CCC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000513352412 941863173 /nfs/dbraw/zinc/86/31/73/941863173.db2.gz BEUVTNWOWIMJOZ-UHFFFAOYSA-N 0 0 368.433 3.876 20 5 FHBDRN CCc1ccc(C(=O)CCC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000513342188 941864184 /nfs/dbraw/zinc/86/41/84/941864184.db2.gz CYCXEENQMZCKFG-UHFFFAOYSA-N 0 0 368.433 3.821 20 5 FHBDRN CCc1ccccc1[C@@H]1C[C@H]1C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000549293146 941864335 /nfs/dbraw/zinc/86/43/35/941864335.db2.gz ADPZGWKBWITOLM-VQTJNVASSA-N 0 0 350.418 3.846 20 5 FHBDRN Cc1n[nH]c(C(=O)N[C@H](c2ccc(CC(C)C)cc2)C2CC2)c1[N+](=O)[O-] ZINC000513344408 941865472 /nfs/dbraw/zinc/86/54/72/941865472.db2.gz ZYVAUAUXRYFURM-MRXNPFEDSA-N 0 0 356.426 3.706 20 5 FHBDRN C[C@H]1C[C@H](c2nc(-c3ccc(-n4cncn4)c([N+](=O)[O-])c3)no2)C[C@@H](C)C1 ZINC000453207185 941867231 /nfs/dbraw/zinc/86/72/31/941867231.db2.gz ZFWQZOMRLBOGGF-IMRBUKKESA-N 0 0 368.397 3.765 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1NCc1ccccc1)N1CCCCCO1 ZINC000472822943 941868628 /nfs/dbraw/zinc/86/86/28/941868628.db2.gz JVVXRJIDBFJXDC-UHFFFAOYSA-N 0 0 355.394 3.765 20 5 FHBDRN CC[C@H](NC(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-])c1ccc(F)cc1F ZINC000433759789 941872281 /nfs/dbraw/zinc/87/22/81/941872281.db2.gz RWVMCWGKRFXOQX-LBPRGKRZSA-N 0 0 352.341 3.601 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N(Cc2ccccc2)[C@@H](C)C2CC2)c1[N+](=O)[O-] ZINC000433771413 941878063 /nfs/dbraw/zinc/87/80/63/941878063.db2.gz PSZMIGMBQFEBDP-ZDUSSCGKSA-N 0 0 356.426 3.882 20 5 FHBDRN COc1cccc(C2(C(=O)NCc3ccc([N+](=O)[O-])cc3)CCCC2)c1 ZINC000517486383 941880422 /nfs/dbraw/zinc/88/04/22/941880422.db2.gz RHIBVIWEZYLJSF-UHFFFAOYSA-N 0 0 354.406 3.732 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CCC(OC(C)(C)C)CC2)ccc1[N+](=O)[O-] ZINC000412182270 941881662 /nfs/dbraw/zinc/88/16/62/941881662.db2.gz FCYFRPSWCPDKGF-UHFFFAOYSA-N 0 0 364.442 3.802 20 5 FHBDRN CCCC[C@H](NC(=O)Cc1c(F)c(OC)ccc1[N+](=O)[O-])C1CCC1 ZINC000412183672 941882340 /nfs/dbraw/zinc/88/23/40/941882340.db2.gz MODJZOYJBMOYBY-AWEZNQCLSA-N 0 0 352.406 3.760 20 5 FHBDRN CO[C@H]1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2SCC(C)C)C1 ZINC000472826302 941884001 /nfs/dbraw/zinc/88/40/01/941884001.db2.gz OUOVQJKXZABBOQ-OCCSQVGLSA-N 0 0 352.456 3.640 20 5 FHBDRN O=[N+]([O-])c1ccc2oc(CN3CCCN(c4ccccc4F)CC3)nc2c1 ZINC000513375833 941884193 /nfs/dbraw/zinc/88/41/93/941884193.db2.gz KTLYUAGGUNKMOS-UHFFFAOYSA-N 0 0 370.384 3.587 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2C[C@@H]2c2c(F)cccc2F)c1 ZINC000549300819 941889630 /nfs/dbraw/zinc/88/96/30/941889630.db2.gz XIENAEUPMPDHAD-NHYWBVRUSA-N 0 0 362.332 3.558 20 5 FHBDRN Cc1cccnc1[C@@H](NC(=O)NCCc1cccc([N+](=O)[O-])c1)C(C)C ZINC000119537754 941890040 /nfs/dbraw/zinc/89/00/40/941890040.db2.gz JIAJSQICUXZSRV-KRWDZBQOSA-N 0 0 356.426 3.537 20 5 FHBDRN C[C@@H]1CN(C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)C[C@@H](c2ccsc2)O1 ZINC000412191794 941890927 /nfs/dbraw/zinc/89/09/27/941890927.db2.gz ZHCJIAVXYLZMFM-IUHNQTRMSA-N 0 0 372.446 3.748 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])c(Br)c1)c1c(F)cccc1F ZINC000119632256 941891859 /nfs/dbraw/zinc/89/18/59/941891859.db2.gz HLEIDZXYVSLALZ-UHFFFAOYSA-N 0 0 357.110 3.888 20 5 FHBDRN Cc1ccc(NC(=O)c2ccc(NC3(CO)CCCC3)c([N+](=O)[O-])c2)cc1 ZINC000433775014 941892611 /nfs/dbraw/zinc/89/26/11/941892611.db2.gz OYSFKSCGZZKRQZ-UHFFFAOYSA-N 0 0 369.421 3.873 20 5 FHBDRN O=C(Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1)Nc1ccc(Cl)cc1 ZINC000103463466 941897787 /nfs/dbraw/zinc/89/77/87/941897787.db2.gz JRXOHZOITSOSHN-UHFFFAOYSA-N 0 0 356.769 3.750 20 5 FHBDRN Cc1cc(N2CCC[C@@H]([C@@H](O)C(F)(F)F)C2)c2cccc([N+](=O)[O-])c2n1 ZINC000433789530 941898660 /nfs/dbraw/zinc/89/86/60/941898660.db2.gz NINUOIXBDIRISU-BDJLRTHQSA-N 0 0 369.343 3.591 20 5 FHBDRN CC(C)N(CC(=O)N1CCC[C@H]2CCCC[C@H]21)Cc1ccc([N+](=O)[O-])cc1 ZINC000513405272 941899467 /nfs/dbraw/zinc/89/94/67/941899467.db2.gz FVVMCOACRVHKQX-UYAOXDASSA-N 0 0 373.497 3.986 20 5 FHBDRN CC(C)(CNC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)Oc1ccccc1 ZINC000513407708 941901962 /nfs/dbraw/zinc/90/19/62/941901962.db2.gz HJOUSFFJYHPJFE-UHFFFAOYSA-N 0 0 369.421 3.757 20 5 FHBDRN O=C(c1coc2c1C(=O)CCC2)N1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000893025825 941904221 /nfs/dbraw/zinc/90/42/21/941904221.db2.gz KQUZWELIRLMRCV-UHFFFAOYSA-N 0 0 354.362 3.690 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])c(Cl)c1)c1ccnn1CCc1ccccc1 ZINC001125861615 941915201 /nfs/dbraw/zinc/91/52/01/941915201.db2.gz IKXKXYUEHQTSBD-UHFFFAOYSA-N 0 0 370.796 3.940 20 5 FHBDRN C[C@H](NC(=O)Nc1cc(C2(C)CCCC2)on1)c1cccc([N+](=O)[O-])c1 ZINC000433820764 941919280 /nfs/dbraw/zinc/91/92/80/941919280.db2.gz FLYDHVXZNYTGMK-LBPRGKRZSA-N 0 0 358.398 3.719 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)Nc1ncc(-c2ccccc2F)s1 ZINC000549312777 941919965 /nfs/dbraw/zinc/91/99/65/941919965.db2.gz YSVUAHYCUZUWDG-UHFFFAOYSA-N 0 0 373.365 3.875 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N(Cc2ccc([C@@H]3C[C@H]3C)o2)C2CC2)c1[N+](=O)[O-] ZINC000433830072 941925933 /nfs/dbraw/zinc/92/59/33/941925933.db2.gz HCJATALRSNIZOF-BXUZGUMPSA-N 0 0 372.425 3.963 20 5 FHBDRN O=C(Nc1cccc(OCCF)c1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000182403905 941930888 /nfs/dbraw/zinc/93/08/88/941930888.db2.gz XRJZXDNYMOYKMM-UHFFFAOYSA-N 0 0 370.283 3.797 20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])NCC1CC(c2ccccc2)C1 ZINC000549318502 941936254 /nfs/dbraw/zinc/93/62/54/941936254.db2.gz UICQSPYKSNKSQM-UHFFFAOYSA-N 0 0 353.422 3.707 20 5 FHBDRN CC(C)Oc1cc(C(=O)N[C@@H]2CCO[C@@H](C(C)(C)C)C2)ccc1[N+](=O)[O-] ZINC000412230104 941942436 /nfs/dbraw/zinc/94/24/36/941942436.db2.gz KRFUNZOKKQYXKW-RHSMWYFYSA-N 0 0 364.442 3.706 20 5 FHBDRN COc1cccc2[nH]cc(CC(=O)N3c4ccc([N+](=O)[O-])cc4C[C@@H]3C)c21 ZINC000182600719 941946018 /nfs/dbraw/zinc/94/60/18/941946018.db2.gz OCUAFBIIGYFOEN-LBPRGKRZSA-N 0 0 365.389 3.605 20 5 FHBDRN COc1ccc([C@H](NC(=O)c2cccc([N+](=O)[O-])c2)C(F)(F)F)cc1 ZINC000182611739 941947425 /nfs/dbraw/zinc/94/74/25/941947425.db2.gz CZISNVFXZABQKI-AWEZNQCLSA-N 0 0 354.284 3.637 20 5 FHBDRN Cn1cc([N+](=O)[O-])cc1C(=O)N[C@@H](c1cccc(C(F)(F)F)c1)C1CC1 ZINC000549321413 941949563 /nfs/dbraw/zinc/94/95/63/941949563.db2.gz GGSVVKBFTOVQHD-OAHLLOKOSA-N 0 0 367.327 3.833 20 5 FHBDRN C[C@@H]1COc2ccccc2CN1C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412238769 941950506 /nfs/dbraw/zinc/95/05/06/941950506.db2.gz AXCMDOFDBOWVGT-JEBQAFNWSA-N 0 0 352.390 3.508 20 5 FHBDRN CC[C@@H](O)CN(Cc1ccccc1)c1nc2ccccc2cc1[N+](=O)[O-] ZINC000473529734 941950639 /nfs/dbraw/zinc/95/06/39/941950639.db2.gz JGWPEDJGQLILCP-QGZVFWFLSA-N 0 0 351.406 3.921 20 5 FHBDRN Cc1cc(C(=O)N2CCN([C@H](C)c3cc([N+](=O)[O-])ccc3C)CC2)c(C)o1 ZINC000182690674 941952802 /nfs/dbraw/zinc/95/28/02/941952802.db2.gz XLZMQINWAANCCT-OAHLLOKOSA-N 0 0 371.437 3.632 20 5 FHBDRN COc1ccccc1O[C@H]1CCCN(C(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000513478953 941955964 /nfs/dbraw/zinc/95/59/64/941955964.db2.gz HOWMFXJPRZTGIH-INIZCTEOSA-N 0 0 371.393 3.679 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N[C@H](C)c2c(C)cccc2C)c1F ZINC000412245338 941956778 /nfs/dbraw/zinc/95/67/78/941956778.db2.gz HXGBQOHWPJYCNN-CYBMUJFWSA-N 0 0 360.385 3.779 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])N[C@@H](c1c(F)cccc1F)C(F)(F)F ZINC000182776640 941959459 /nfs/dbraw/zinc/95/94/59/941959459.db2.gz GELXAZADBAOTMT-HNNXBMFYSA-N 0 0 374.265 3.835 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]cc(Cc3noc([C@@H]4OC[C@@H]5CCC[C@@H]54)n3)c2c1 ZINC000377748493 941960665 /nfs/dbraw/zinc/96/06/65/941960665.db2.gz RIJGIWOCMSAFCI-SIMVJXQJSA-N 0 0 354.366 3.538 20 5 FHBDRN O=C(COc1cccc([N+](=O)[O-])c1)OCc1ncc(-c2ccc(F)cc2)o1 ZINC000126306980 941962309 /nfs/dbraw/zinc/96/23/09/941962309.db2.gz LZBNVPLADUTQTH-UHFFFAOYSA-N 0 0 372.308 3.511 20 5 FHBDRN CN(C)c1nc(Cl)c(C(=O)Nc2ccc([N+](=O)[O-])c(Cl)c2)s1 ZINC001125862106 941962342 /nfs/dbraw/zinc/96/23/42/941962342.db2.gz IXNXZEWHPCUXFX-UHFFFAOYSA-N 0 0 361.210 3.676 20 5 FHBDRN CCc1c[nH]c(SCc2cc(OC)c(OCC(F)F)cc2[N+](=O)[O-])n1 ZINC000182751271 941964654 /nfs/dbraw/zinc/96/46/54/941964654.db2.gz FARQPNIREXASEZ-UHFFFAOYSA-N 0 0 373.381 3.825 20 5 FHBDRN Cn1c2ccc(C(=O)Nc3ccc([N+](=O)[O-])cc3F)cc2nc1C(F)F ZINC000513486511 941966156 /nfs/dbraw/zinc/96/61/56/941966156.db2.gz WCKVETAERYVCNO-UHFFFAOYSA-N 0 0 364.283 3.811 20 5 FHBDRN Cc1cc(NC(=O)N(CCO)[C@@H]2CCCc3ccccc32)ccc1[N+](=O)[O-] ZINC000182766447 941966386 /nfs/dbraw/zinc/96/63/86/941966386.db2.gz JCPDSJSTLNKUTL-LJQANCHMSA-N 0 0 369.421 3.807 20 5 FHBDRN CN(C)C(=O)C[C@H](Nc1nc2ccccc2cc1[N+](=O)[O-])c1ccccc1 ZINC000473530195 941969726 /nfs/dbraw/zinc/96/97/26/941969726.db2.gz YLQCQKNPWAAROW-KRWDZBQOSA-N 0 0 364.405 3.775 20 5 FHBDRN O=C(NCc1ccccc1OC(F)(F)F)c1cc(F)cc([N+](=O)[O-])c1 ZINC000517557331 941976596 /nfs/dbraw/zinc/97/65/96/941976596.db2.gz BVFQNZZNSCXLSB-UHFFFAOYSA-N 0 0 358.247 3.563 20 5 FHBDRN CSc1ccc(C(=O)N2C[C@@H](C)C[C@@H]2c2cccnc2)cc1[N+](=O)[O-] ZINC000182836230 941978539 /nfs/dbraw/zinc/97/85/39/941978539.db2.gz NQVBOVFTGOVQTN-SWLSCSKDSA-N 0 0 357.435 3.935 20 5 FHBDRN CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F)c1ccc(Cl)cn1 ZINC000182897657 941991649 /nfs/dbraw/zinc/99/16/49/941991649.db2.gz ABCNPKHYXNQOQT-UHFFFAOYSA-N 0 0 357.700 3.521 20 5 FHBDRN C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412257302 941992986 /nfs/dbraw/zinc/99/29/86/941992986.db2.gz ILZNRULLXVGQGV-HPEDKQMDSA-N 0 0 356.344 3.888 20 5 FHBDRN Cc1cc(C(=O)N2CCC[C@H]2Cn2ccnc2C(C)C)ccc1[N+](=O)[O-] ZINC000377794762 941998809 /nfs/dbraw/zinc/99/88/09/941998809.db2.gz MAXHACLGVVTFFH-INIZCTEOSA-N 0 0 356.426 3.528 20 5 FHBDRN CC1(C)SC[C@H]1NC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000549336225 941998908 /nfs/dbraw/zinc/99/89/08/941998908.db2.gz UYWHDKKVINKPCL-QGZVFWFLSA-N 0 0 371.462 3.831 20 5 FHBDRN Cc1ccc(NC(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])cc1OCC(F)F ZINC000433935814 942011158 /nfs/dbraw/zinc/01/11/58/942011158.db2.gz DYAVSAKXYRQGQL-UHFFFAOYSA-N 0 0 368.340 3.646 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccnn1[C@@H](C)C1CC1 ZINC000072575120 942016826 /nfs/dbraw/zinc/01/68/26/942016826.db2.gz OBVARJZAOUZWHZ-NWDGAFQWSA-N 0 0 360.439 3.882 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1Cl)N[C@H]1C[C@H](CO)c2ccccc21 ZINC000377820828 942018471 /nfs/dbraw/zinc/01/84/71/942018471.db2.gz IIIXPODTIZYWPU-YGRLFVJLSA-N 0 0 361.785 3.591 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)N2CCC(n3ccnc3)CC2)cc1[N+](=O)[O-] ZINC000101863594 942021233 /nfs/dbraw/zinc/02/12/33/942021233.db2.gz DKBOMSUMLDLQEG-UHFFFAOYSA-N 0 0 356.426 3.566 20 5 FHBDRN CCCc1n[nH]c(C(=O)N2CC[C@H](c3ccc(C)cc3C)C2)c1[N+](=O)[O-] ZINC000473531161 942024848 /nfs/dbraw/zinc/02/48/48/942024848.db2.gz PEZUDCRGZZTXEJ-AWEZNQCLSA-N 0 0 356.426 3.517 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCCCOCCc1ccccc1 ZINC000085620130 942027500 /nfs/dbraw/zinc/02/75/00/942027500.db2.gz CWABOAZIFCZVQT-UHFFFAOYSA-N 0 0 371.437 3.983 20 5 FHBDRN CN(CCC1CCCCC1)C(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000102104352 942034263 /nfs/dbraw/zinc/03/42/63/942034263.db2.gz CUVHWYXFPVJLFF-UHFFFAOYSA-N 0 0 367.833 3.616 20 5 FHBDRN Cc1cc(C)cc(CN(C)C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)c1 ZINC000433998792 942034782 /nfs/dbraw/zinc/03/47/82/942034782.db2.gz YTEJRJHTRIXZMI-UHFFFAOYSA-N 0 0 364.405 3.670 20 5 FHBDRN CN(Cc1cc(F)cc(F)c1)C(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000434001442 942035901 /nfs/dbraw/zinc/03/59/01/942035901.db2.gz IMKLTYFPQZPIQT-UHFFFAOYSA-N 0 0 354.740 3.728 20 5 FHBDRN C[C@@H]1c2c(Cl)cc(Cl)cc2CCN1C(=O)c1cc([N+](=O)[O-])c[nH]1 ZINC000434010657 942038495 /nfs/dbraw/zinc/03/84/95/942038495.db2.gz FOBHTUFBYKDEHJ-MRVPVSSYSA-N 0 0 354.193 3.989 20 5 FHBDRN COc1cc(OCC(=O)Nc2c(C)c(C)ccc2Cl)ccc1[N+](=O)[O-] ZINC000434037576 942049931 /nfs/dbraw/zinc/04/99/31/942049931.db2.gz QLBXFFGBCJPIDR-UHFFFAOYSA-N 0 0 364.785 3.891 20 5 FHBDRN COc1ccc([C@@H](NC(=O)CNc2cccc([N+](=O)[O-])c2C)C2CC2)cc1 ZINC000025604181 942062667 /nfs/dbraw/zinc/06/26/67/942062667.db2.gz BTYNRUSUCBPWCM-FQEVSTJZSA-N 0 0 369.421 3.591 20 5 FHBDRN COCCN(C(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1)[C@@H]1CC[C@@H](C)C1 ZINC000412286697 942065795 /nfs/dbraw/zinc/06/57/95/942065795.db2.gz HUIWCIDSFXAHER-GDBMZVCRSA-N 0 0 364.442 3.659 20 5 FHBDRN CC(C)CN(CC(F)(F)F)C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513669734 942066427 /nfs/dbraw/zinc/06/64/27/942066427.db2.gz OPFYOXHUNZAYFY-UHFFFAOYSA-N 0 0 370.274 3.857 20 5 FHBDRN CCc1nc(NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)sc1C ZINC000513664659 942072726 /nfs/dbraw/zinc/07/27/26/942072726.db2.gz XZGXTSDYMNPXTA-UHFFFAOYSA-N 0 0 357.338 3.776 20 5 FHBDRN O=C(COc1ccc(F)cc1[N+](=O)[O-])Nc1cccc(C(F)(F)F)c1 ZINC000102599971 942072665 /nfs/dbraw/zinc/07/26/65/942072665.db2.gz WRRJSAMEDCMNIY-UHFFFAOYSA-N 0 0 358.247 3.770 20 5 FHBDRN Cc1nn(-c2ccccc2)cc1CNC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000183054879 942073779 /nfs/dbraw/zinc/07/37/79/942073779.db2.gz QMRVAXNZUKGEIT-UHFFFAOYSA-N 0 0 370.796 3.672 20 5 FHBDRN CSc1cccc(C(=O)Nc2ccc3[nH]c(N(C)C)nc3c2)c1[N+](=O)[O-] ZINC000549372383 942073918 /nfs/dbraw/zinc/07/39/18/942073918.db2.gz RWJLZIKFOSWJQX-UHFFFAOYSA-N 0 0 371.422 3.511 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)c1ccccc1NCc1ccco1 ZINC000137148136 942076493 /nfs/dbraw/zinc/07/64/93/942076493.db2.gz FPMSSJZJEWVKAW-UHFFFAOYSA-N 0 0 351.362 3.730 20 5 FHBDRN CC(=O)Nc1cc(F)c(F)cc1NC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc21 ZINC000102644424 942076693 /nfs/dbraw/zinc/07/66/93/942076693.db2.gz XDZNWCMHYSCSSC-UHFFFAOYSA-N 0 0 374.303 3.565 20 5 FHBDRN O=C(c1c[nH]c2ccc([N+](=O)[O-])cc12)N(Cc1ccco1)CC(F)(F)F ZINC000102639187 942076945 /nfs/dbraw/zinc/07/69/45/942076945.db2.gz HHILKKCFROZKCX-UHFFFAOYSA-N 0 0 367.283 3.874 20 5 FHBDRN COc1ccc(NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc1N ZINC000415836976 942078651 /nfs/dbraw/zinc/07/86/51/942078651.db2.gz MZXHWVXJCGDGOE-UHFFFAOYSA-N 0 0 358.398 3.628 20 5 FHBDRN COc1ccc(C(F)(F)C(=O)OCc2cc(F)ccc2[N+](=O)[O-])cc1 ZINC000756339740 942081100 /nfs/dbraw/zinc/08/11/00/942081100.db2.gz AYUYZKSRYMCJOJ-UHFFFAOYSA-N 0 0 355.268 3.578 20 5 FHBDRN O=C1CCc2cc([N+](=O)[O-])c(N[C@@H]3CCO[C@@H](c4cccs4)C3)cc2N1 ZINC000413352147 942082880 /nfs/dbraw/zinc/08/28/80/942082880.db2.gz MQOXYLPKEFDORY-MLGOLLRUSA-N 0 0 373.434 3.873 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2noc(-c3cc(C4CC4)no3)n2)c2c1NCCC2 ZINC000420504641 942086581 /nfs/dbraw/zinc/08/65/81/942086581.db2.gz OSQVIXHNCMVZGC-UHFFFAOYSA-N 0 0 353.338 3.535 20 5 FHBDRN Cc1ccc(Sc2ccc(C(=O)N(C)CCCCO)cc2[N+](=O)[O-])cc1 ZINC000472915148 942088461 /nfs/dbraw/zinc/08/84/61/942088461.db2.gz QWOMWTTZHZOEMW-UHFFFAOYSA-N 0 0 374.462 3.899 20 5 FHBDRN CC(C)(C)C1CC(c2nc(-c3ccc(-n4cncn4)c([N+](=O)[O-])c3)no2)C1 ZINC000420507761 942088726 /nfs/dbraw/zinc/08/87/26/942088726.db2.gz ZZLSXUXZJIQHBQ-UHFFFAOYSA-N 0 0 368.397 3.765 20 5 FHBDRN CC(C)(C)OC(=O)[C@]1(C)CCN(c2nccc3c2cccc3[N+](=O)[O-])C1 ZINC000413360278 942091841 /nfs/dbraw/zinc/09/18/41/942091841.db2.gz PGCCHYKVBFEFDN-LJQANCHMSA-N 0 0 357.410 3.701 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1nnc(C)n1C1CC1 ZINC000501864084 942095942 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ZINC000416048781 942295391 /nfs/dbraw/zinc/29/53/91/942295391.db2.gz OHRYTNYIRWSQBB-OAHLLOKOSA-N 0 0 364.323 3.859 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])N1CCC[C@@H]1Cc1cc(F)ccc1F ZINC000416054411 942299038 /nfs/dbraw/zinc/29/90/38/942299038.db2.gz WFGRIEXJCZGAIV-MRXNPFEDSA-N 0 0 360.360 3.649 20 5 FHBDRN O=C(Nc1cc(Br)cc([N+](=O)[O-])c1)N1Cc2ccccc2C1 ZINC000501081532 942300253 /nfs/dbraw/zinc/30/02/53/942300253.db2.gz GCOPAIBKEPTKTJ-UHFFFAOYSA-N 0 0 362.183 3.905 20 5 FHBDRN CO[C@](C)([C@@H](C)Nc1ncc([N+](=O)[O-])c(C)c1Br)C1CC1 ZINC000413524908 942300954 /nfs/dbraw/zinc/30/09/54/942300954.db2.gz XGLJNGACFLFUTL-YMTOWFKASA-N 0 0 358.236 3.676 20 5 FHBDRN CC(C)(C)c1ccc(NC(=O)N2CCc3cc[nH]c(=O)c3C2)cc1[N+](=O)[O-] ZINC000501093477 942304299 /nfs/dbraw/zinc/30/42/99/942304299.db2.gz JUQCCJZZLTWDTM-UHFFFAOYSA-N 0 0 370.409 3.583 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CCO[C@@H](c3ccccc3F)C2)c(C(F)(F)F)c1 ZINC000413120403 942304848 /nfs/dbraw/zinc/30/48/48/942304848.db2.gz QRIFXNRELCADPN-CQSZACIVSA-N 0 0 371.290 3.726 20 5 FHBDRN Cc1cccc(C)c1NC(=O)[C@H](C)OC(=O)/C=C/c1ccc([N+](=O)[O-])cc1 ZINC000015655184 942307090 /nfs/dbraw/zinc/30/70/90/942307090.db2.gz VETDRHDZOUWJNZ-RZXPCSSPSA-N 0 0 368.389 3.795 20 5 FHBDRN CCc1noc(C)c1NC(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000501101022 942307809 /nfs/dbraw/zinc/30/78/09/942307809.db2.gz RLKYFXYSSDDWQL-UHFFFAOYSA-N 0 0 369.175 3.860 20 5 FHBDRN C[C@@H](Nc1ccc(C(=O)NC[C@H]2CC23CC3)cc1[N+](=O)[O-])c1ccccn1 ZINC000416071893 942318569 /nfs/dbraw/zinc/31/85/69/942318569.db2.gz MKQSMGLYCHYMLF-UKRRQHHQSA-N 0 0 366.421 3.693 20 5 FHBDRN CC[C@@H](NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)[C@@H]1CC1(C)C ZINC000416079961 942326961 /nfs/dbraw/zinc/32/69/61/942326961.db2.gz LDECWQAAPAPUAQ-JKSUJKDBSA-N 0 0 359.470 3.752 20 5 FHBDRN C[C@@H]1CC[C@@H](O)CN1C(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000421068301 942327221 /nfs/dbraw/zinc/32/72/21/942327221.db2.gz WZRXQYQBAPYZAL-CZUORRHYSA-N 0 0 371.393 3.764 20 5 FHBDRN Cc1ccc(NC(=O)[C@H](C)OC(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1F ZINC000015699039 942331791 /nfs/dbraw/zinc/33/17/91/942331791.db2.gz RQGIXOHEGXPOMO-LBPRGKRZSA-N 0 0 360.341 3.535 20 5 FHBDRN CCOc1cc(C(=O)N[C@H](CC)[C@H]2CC2(C)C)c([N+](=O)[O-])cc1OC ZINC000416085633 942333277 /nfs/dbraw/zinc/33/32/77/942333277.db2.gz RRAZGKXZDUIBJI-CHWSQXEVSA-N 0 0 350.415 3.557 20 5 FHBDRN Cc1cccc(N2CCC(Nc3ccc([N+](=O)[O-])c4ncccc34)CC2)n1 ZINC000413137301 942336884 /nfs/dbraw/zinc/33/68/84/942336884.db2.gz CDUSARWPBSMNQI-UHFFFAOYSA-N 0 0 363.421 3.927 20 5 FHBDRN CC(=O)N1CCc2cc(NC(=O)Nc3c(C)ccc([N+](=O)[O-])c3C)ccc21 ZINC000085633733 942338744 /nfs/dbraw/zinc/33/87/44/942338744.db2.gz YSOYHENAPDGAIU-UHFFFAOYSA-N 0 0 368.393 3.765 20 5 FHBDRN Cc1cc(CNC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)cc(C)n1 ZINC000421087979 942339237 /nfs/dbraw/zinc/33/92/37/942339237.db2.gz KITODMJLTVHADU-UHFFFAOYSA-N 0 0 366.324 3.530 20 5 FHBDRN CC(C)[C@@H]1N(c2ccc([N+](=O)[O-])c(OC(F)F)c2)CC12CCOCC2 ZINC000413542513 942340611 /nfs/dbraw/zinc/34/06/11/942340611.db2.gz FBCHCJVAJGUZJL-HNNXBMFYSA-N 0 0 356.369 3.838 20 5 FHBDRN CNC(=O)c1ccc(N2C[C@H](c3ccccc3)C3(CCC3)C2)c([N+](=O)[O-])c1 ZINC000413544065 942341592 /nfs/dbraw/zinc/34/15/92/942341592.db2.gz ZKPHXCHXCYGQLU-QGZVFWFLSA-N 0 0 365.433 3.729 20 5 FHBDRN C[C@H]1CCN(S(=O)(=O)c2c(Cl)cc(Cl)cc2[N+](=O)[O-])C[C@H]1C ZINC000501177880 942342326 /nfs/dbraw/zinc/34/23/26/942342326.db2.gz LBCCVKBQGSLVJW-DTWKUNHWSA-N 0 0 367.254 3.568 20 5 FHBDRN CCCOc1ccc(CNc2ncc([N+](=O)[O-])cc2C(F)(F)F)cn1 ZINC000413134458 942343162 /nfs/dbraw/zinc/34/31/62/942343162.db2.gz LLEDPMKLDCGYRT-UHFFFAOYSA-N 0 0 356.304 3.805 20 5 FHBDRN Cc1csc(N(C(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)C2CC2)n1 ZINC000413549290 942344718 /nfs/dbraw/zinc/34/47/18/942344718.db2.gz LBZDNTVBLXJERP-UHFFFAOYSA-N 0 0 361.423 3.956 20 5 FHBDRN C[C@@H](NC(=O)NCc1cnccc1C(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000413143941 942347909 /nfs/dbraw/zinc/34/79/09/942347909.db2.gz MKTPJJCYTQQLSJ-CYBMUJFWSA-N 0 0 356.426 3.848 20 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ZINC000502341735 942370465 /nfs/dbraw/zinc/37/04/65/942370465.db2.gz QXDSEWRRNNZMSP-CVEARBPZSA-N 0 0 351.410 3.718 20 5 FHBDRN COc1cc(N[C@@H](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2)c(C)c(OC)c1 ZINC000502342564 942371025 /nfs/dbraw/zinc/37/10/25/942371025.db2.gz BRINJPFSUNPJQQ-LBPRGKRZSA-N 0 0 373.409 3.750 20 5 FHBDRN C[C@@H](Nc1ccc2ncc([N+](=O)[O-])n2n1)c1cc(F)c(Cl)cc1Cl ZINC000502343167 942371280 /nfs/dbraw/zinc/37/12/80/942371280.db2.gz XAAMPIHYBFZMOT-SSDOTTSWSA-N 0 0 370.171 3.678 20 5 FHBDRN CCN(C(=O)c1cc([N+](=O)[O-])ccc1OC)[C@H](C)Cc1ccc(OC)cc1 ZINC000066805542 942379254 /nfs/dbraw/zinc/37/92/54/942379254.db2.gz ALAJJQOPMYWUKJ-CQSZACIVSA-N 0 0 372.421 3.705 20 5 FHBDRN Cc1nn(Cc2ncc(-c3cccc(Br)c3)o2)cc1[N+](=O)[O-] ZINC000501281324 942380390 /nfs/dbraw/zinc/38/03/90/942380390.db2.gz CSZFUBBZXYTQMM-UHFFFAOYSA-N 0 0 363.171 3.566 20 5 FHBDRN Cc1cccc([C@H]2CCCN2S(=O)(=O)CCc2ccc([N+](=O)[O-])cc2)c1 ZINC000183526151 942383371 /nfs/dbraw/zinc/38/33/71/942383371.db2.gz JFKOVSZOEFEHRD-LJQANCHMSA-N 0 0 374.462 3.613 20 5 FHBDRN O=C(O[C@@H](C1CC1)C(F)(F)F)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000122887167 942385023 /nfs/dbraw/zinc/38/50/23/942385023.db2.gz WPWHWQSPLUBKAB-AWEZNQCLSA-N 0 0 358.316 3.693 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(C)[C@H]1CCC[C@@H]1C(C)(C)C ZINC000419799484 942385195 /nfs/dbraw/zinc/38/51/95/942385195.db2.gz XGGIYJPEVOUDID-HOCLYGCPSA-N 0 0 361.442 3.515 20 5 FHBDRN CC[C@H]1CC[C@H](C)N1CC(=O)Nc1ccc([N+](=O)[O-])cc1Br ZINC000330636943 942385274 /nfs/dbraw/zinc/38/52/74/942385274.db2.gz AUCIJIADIOJFCM-QWRGUYRKSA-N 0 0 370.247 3.559 20 5 FHBDRN Cc1ccc(NC(=O)C(=O)N[C@@H](C)c2ccc(C3CC3)cc2)cc1[N+](=O)[O-] ZINC000419788908 942391857 /nfs/dbraw/zinc/39/18/57/942391857.db2.gz BYFOOSPJMGNWDK-ZDUSSCGKSA-N 0 0 367.405 3.597 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)Nc1cc(F)ccc1OC[C@H]1CCCO1 ZINC000502369927 942401120 /nfs/dbraw/zinc/40/11/20/942401120.db2.gz UYCMLLGNEFXEAJ-OAHLLOKOSA-N 0 0 374.368 3.852 20 5 FHBDRN CC[S@](=O)[C@H]1CCC[C@@H](Nc2ncc([N+](=O)[O-])cc2C(F)(F)F)C1 ZINC000413177073 942408687 /nfs/dbraw/zinc/40/86/87/942408687.db2.gz LKPZNVOPDDUBPV-XRADQBPISA-N 0 0 365.377 3.500 20 5 FHBDRN CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NCc1ccc(C(F)(F)F)cc1 ZINC000016301827 942411103 /nfs/dbraw/zinc/41/11/03/942411103.db2.gz FOQJNUVLZIOZLH-UHFFFAOYSA-N 0 0 367.327 3.610 20 5 FHBDRN CC(=O)NC1(c2noc(-c3cc([N+](=O)[O-])c(C)cc3C)n2)CCCCC1 ZINC000421237506 942429544 /nfs/dbraw/zinc/42/95/44/942429544.db2.gz BSTGCSCJYCYSTM-UHFFFAOYSA-N 0 0 358.398 3.557 20 5 FHBDRN O=C(Nc1ccc(O[C@@H]2CCCC[C@@H]2O)cc1)c1csc([N+](=O)[O-])c1 ZINC000505241250 942432875 /nfs/dbraw/zinc/43/28/75/942432875.db2.gz XDZZJWWMBTYFIP-LSDHHAIUSA-N 0 0 362.407 3.591 20 5 FHBDRN Cc1nc([C@@H]2CCCOC2)sc1C(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000366481107 942433964 /nfs/dbraw/zinc/43/39/64/942433964.db2.gz KMVWJUCIRAOAQP-GFCCVEGCSA-N 0 0 361.423 3.814 20 5 FHBDRN O=[N+]([O-])c1cnc2ccc(N3CCc4c(ccc(Cl)c4Cl)C3)nn21 ZINC000502420197 942435741 /nfs/dbraw/zinc/43/57/41/942435741.db2.gz YLBPBBPFIPPPDF-UHFFFAOYSA-N 0 0 364.192 3.507 20 5 FHBDRN COc1ccccc1N1CC[C@@H](Nc2nccc3ccc([N+](=O)[O-])cc32)C1 ZINC000413181888 942436673 /nfs/dbraw/zinc/43/66/73/942436673.db2.gz FSENFWCHJHPKFP-OAHLLOKOSA-N 0 0 364.405 3.842 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CCO[C@@H](c3cccc(C(F)(F)F)c3)C2)c(F)c1 ZINC000413184073 942437305 /nfs/dbraw/zinc/43/73/05/942437305.db2.gz NCPMHVVDPUQTTJ-CQSZACIVSA-N 0 0 371.290 3.726 20 5 FHBDRN CSc1ccc(C(=O)NCCOc2ccccc2Cl)cc1[N+](=O)[O-] ZINC000501377380 942441312 /nfs/dbraw/zinc/44/13/12/942441312.db2.gz KWJCJNXPFSWJLP-UHFFFAOYSA-N 0 0 366.826 3.779 20 5 FHBDRN CC(C)Oc1cc(C(=O)N[C@@H](C)CCc2ccc(O)cc2)ccc1[N+](=O)[O-] ZINC000413619412 942441211 /nfs/dbraw/zinc/44/12/11/942441211.db2.gz BDKGUHSJZKTQNY-AWEZNQCLSA-N 0 0 372.421 3.839 20 5 FHBDRN CC(C)Oc1cc(C(=O)N[C@H](C)CCc2ccc(O)cc2)ccc1[N+](=O)[O-] ZINC000413619415 942441354 /nfs/dbraw/zinc/44/13/54/942441354.db2.gz BDKGUHSJZKTQNY-CQSZACIVSA-N 0 0 372.421 3.839 20 5 FHBDRN O=C(NC[C@@H]1C[C@H]1C1CCC1)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000424910492 942441521 /nfs/dbraw/zinc/44/15/21/942441521.db2.gz SRDDSWGWZAPLNX-GUYCJALGSA-N 0 0 364.420 3.986 20 5 FHBDRN Cc1c(C(=O)Nc2cc(Cl)ccc2-n2cccn2)cccc1[N+](=O)[O-] ZINC000046725024 942448329 /nfs/dbraw/zinc/44/83/29/942448329.db2.gz QBAGKPGUZFDLOH-UHFFFAOYSA-N 0 0 356.769 3.995 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])Nc1cc(Cl)ccc1-n1cccn1 ZINC000046724991 942448490 /nfs/dbraw/zinc/44/84/90/942448490.db2.gz NWZQMGSKCPLLJR-UHFFFAOYSA-N 0 0 356.769 3.615 20 5 FHBDRN Cn1c(-c2ccc([N+](=O)[O-])cc2)nnc1N1CCC[C@H](CC(F)(F)F)C1 ZINC000421259904 942448597 /nfs/dbraw/zinc/44/85/97/942448597.db2.gz IDZMEVDDCIYETD-LLVKDONJSA-N 0 0 369.347 3.559 20 5 FHBDRN CCSc1nccnc1-c1noc(-c2cc([N+](=O)[O-])c(C)cc2C)n1 ZINC000421260857 942449692 /nfs/dbraw/zinc/44/96/92/942449692.db2.gz MKUGQJPLZNAVMT-UHFFFAOYSA-N 0 0 357.395 3.831 20 5 FHBDRN C[C@H](CC(=O)c1ccc(F)cc1)NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000413638987 942454770 /nfs/dbraw/zinc/45/47/70/942454770.db2.gz NWDSPNPXQFIKOP-OCBCSQNSSA-N 0 0 370.380 3.615 20 5 FHBDRN O=C(NCCNc1ccc([N+](=O)[O-])cc1)c1csc(-c2ccccc2)n1 ZINC000015835239 942455352 /nfs/dbraw/zinc/45/53/52/942455352.db2.gz XFUZGVDARQPJDX-UHFFFAOYSA-N 0 0 368.418 3.560 20 5 FHBDRN CCC(CC)(CNC(=O)c1c(C)cccc1[N+](=O)[O-])C(=O)OC(C)(C)C ZINC000424943029 942455824 /nfs/dbraw/zinc/45/58/24/942455824.db2.gz PIAWIWGFGQKFHS-UHFFFAOYSA-N 0 0 364.442 3.781 20 5 FHBDRN C[C@H](NC(=O)c1ccc(N2CCC[C@H](C)C2)c([N+](=O)[O-])c1)C(F)(F)F ZINC000424952277 942465803 /nfs/dbraw/zinc/46/58/03/942465803.db2.gz NZCUZAMUJKAQAF-QWRGUYRKSA-N 0 0 359.348 3.512 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)Oc1ccccc1C(F)(F)F ZINC000014099015 942469830 /nfs/dbraw/zinc/46/98/30/942469830.db2.gz ACWOREXUZFYZIC-UHFFFAOYSA-N 0 0 361.297 3.690 20 5 FHBDRN COc1cccc(C=C2CCN(C(=O)c3cc([N+](=O)[O-])cnc3C)CC2)c1 ZINC000472948939 942472009 /nfs/dbraw/zinc/47/20/09/942472009.db2.gz JPIKHEBPFFPDSP-UHFFFAOYSA-N 0 0 367.405 3.626 20 5 FHBDRN CC[C@@H](Nc1ncc([N+](=O)[O-])cc1F)[C@@H](c1ccc(C)cc1)n1cncn1 ZINC000413205281 942476957 /nfs/dbraw/zinc/47/69/57/942476957.db2.gz JQZXSNYVIXAQSQ-IAGOWNOFSA-N 0 0 370.388 3.509 20 5 FHBDRN CC(C)n1cc2c(n1)C[C@@H](Nc1nccc3ccc([N+](=O)[O-])cc31)CC2 ZINC000413209534 942478925 /nfs/dbraw/zinc/47/89/25/942478925.db2.gz URPSRYSSBAIXFU-HNNXBMFYSA-N 0 0 351.410 3.890 20 5 FHBDRN O=[N+]([O-])c1cnc(NCc2ccnc(OC3CCC3)c2)c(C(F)(F)F)c1 ZINC000413215196 942489264 /nfs/dbraw/zinc/48/92/64/942489264.db2.gz XQXRNLNUYBESNW-UHFFFAOYSA-N 0 0 368.315 3.947 20 5 FHBDRN COc1ccc(C(=O)N2CCC[C@H]2/C=C/c2ccccc2)cc1[N+](=O)[O-] ZINC000505373168 942492116 /nfs/dbraw/zinc/49/21/16/942492116.db2.gz QLFZGBGSEHIOMB-KAMXEHQASA-N 0 0 352.390 3.921 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])o1)N1CCC(c2nc3c(s2)CCCC3)CC1 ZINC000425015476 942501263 /nfs/dbraw/zinc/50/12/63/942501263.db2.gz FMXBGRZQNSXWPK-UHFFFAOYSA-N 0 0 361.423 3.543 20 5 FHBDRN COCC(C)(C)CCCNC(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1 ZINC000412336066 942501505 /nfs/dbraw/zinc/50/15/05/942501505.db2.gz ITIALLKEUWWWAN-UHFFFAOYSA-N 0 0 352.431 3.565 20 5 FHBDRN COc1ccc(Cl)cc1C(C)(C)NC(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000425041053 942516095 /nfs/dbraw/zinc/51/60/95/942516095.db2.gz YNXFAVHUMDQKCH-UHFFFAOYSA-N 0 0 362.813 3.851 20 5 FHBDRN O=[N+]([O-])c1cnc(N[C@@H]2CCO[C@H]2c2ccc(Cl)c(F)c2)c(F)c1 ZINC000413228779 942516400 /nfs/dbraw/zinc/51/64/00/942516400.db2.gz QHRFQIZLYLPOPC-KGLIPLIRSA-N 0 0 355.728 3.864 20 5 FHBDRN O=C(c1c(Cl)cccc1[N+](=O)[O-])N1CCC[C@@H](c2nccs2)C1 ZINC000137092611 942525193 /nfs/dbraw/zinc/52/51/93/942525193.db2.gz JBAJHEGZYMSDQO-SNVBAGLBSA-N 0 0 351.815 3.725 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N[C@@H]1CCCC[C@H]1OC(F)F ZINC000505399927 942527209 /nfs/dbraw/zinc/52/72/09/942527209.db2.gz OMPXMOUZMNQRPL-DGCLKSJQSA-N 0 0 357.357 3.884 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2nc(CN3CC[C@@H](O)CC34CCC4)cs2)c1 ZINC000421377595 942528082 /nfs/dbraw/zinc/52/80/82/942528082.db2.gz TZQYDHXQRNJGOW-MRXNPFEDSA-N 0 0 359.451 3.598 20 5 FHBDRN Cc1nn(-c2ccccc2)cc1NC(=O)c1cc([N+](=O)[O-])c(F)cc1C ZINC001268896814 942528282 /nfs/dbraw/zinc/52/82/82/942528282.db2.gz YUJXOWAIVKZJOO-UHFFFAOYSA-N 0 0 354.341 3.789 20 5 FHBDRN CC[C@H](NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)c1nc(C)cs1 ZINC000104602478 942534207 /nfs/dbraw/zinc/53/42/07/942534207.db2.gz KYIAMWFACVNCOL-ZDUSSCGKSA-N 0 0 360.439 3.815 20 5 FHBDRN Cc1ccc(NC(=O)NC(=O)CSCc2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000513816755 942535347 /nfs/dbraw/zinc/53/53/47/942535347.db2.gz SZXFSRCNODPDLW-UHFFFAOYSA-N 0 0 373.434 3.793 20 5 FHBDRN CC(C)c1[nH]nc(C(=O)Nc2cccc(Oc3ccccn3)c2)c1[N+](=O)[O-] ZINC000434235145 942539730 /nfs/dbraw/zinc/53/97/30/942539730.db2.gz GRHZMHYRAOXETR-UHFFFAOYSA-N 0 0 367.365 3.881 20 5 FHBDRN CC(C)CCc1nc(CN2CCN(c3cccc([N+](=O)[O-])c3)CC2)cs1 ZINC000518911586 942540382 /nfs/dbraw/zinc/54/03/82/942540382.db2.gz FAAFHOMNLRTRAB-UHFFFAOYSA-N 0 0 374.510 3.962 20 5 FHBDRN CCS[C@@H]1CCC[C@H](NC(=O)CSc2ccccc2[N+](=O)[O-])C1 ZINC000541266031 942546968 /nfs/dbraw/zinc/54/69/68/942546968.db2.gz VICSGKVRUZXRMV-QWHCGFSZSA-N 0 0 354.497 3.867 20 5 FHBDRN CCC[C@@H](NC(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-])c1ccc(F)cc1F ZINC000434249399 942548699 /nfs/dbraw/zinc/54/86/99/942548699.db2.gz MDTXAWUOJUEMJA-CYBMUJFWSA-N 0 0 366.368 3.991 20 5 FHBDRN CO[C@@H](C)C(=O)Nc1cccc(NC(=O)Nc2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000502568118 942548940 /nfs/dbraw/zinc/54/89/40/942548940.db2.gz FBWUYPSRINJFBM-LBPRGKRZSA-N 0 0 372.381 3.521 20 5 FHBDRN Nc1cccc([N+](=O)[O-])c1C(=O)N1CC=C(c2cccc3ccccc32)C1 ZINC000501559141 942549332 /nfs/dbraw/zinc/54/93/32/942549332.db2.gz VGQWSDQLBBTFIX-UHFFFAOYSA-N 0 0 359.385 3.870 20 5 FHBDRN CC[C@@H](C)Oc1cc(C)ccc1CNC(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-] ZINC000434253792 942551100 /nfs/dbraw/zinc/55/11/00/942551100.db2.gz NBMCWKYQIDFCSG-CYBMUJFWSA-N 0 0 374.441 3.857 20 5 FHBDRN O=C(c1c[nH]c2cc([N+](=O)[O-])ccc12)N1CC=C(c2ccccc2F)C1 ZINC000501583465 942551444 /nfs/dbraw/zinc/55/14/44/942551444.db2.gz JPSGIQQIYRDJDZ-UHFFFAOYSA-N 0 0 351.337 3.755 20 5 FHBDRN CC[C@H](Oc1ccccc1F)C(=O)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000513842528 942552940 /nfs/dbraw/zinc/55/29/40/942552940.db2.gz JOQQHWOOFOCIGT-KRWDZBQOSA-N 0 0 358.369 3.871 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CCO[C@@H](c3ccccc3C(F)(F)F)C2)c(F)c1 ZINC000413244893 942559459 /nfs/dbraw/zinc/55/94/59/942559459.db2.gz NPEZVWBZGKUSPH-CQSZACIVSA-N 0 0 371.290 3.726 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCCn2cc(C)nc21 ZINC000378307847 942563913 /nfs/dbraw/zinc/56/39/13/942563913.db2.gz QPTADSSHZXGVTE-ZDUSSCGKSA-N 0 0 374.466 3.519 20 5 FHBDRN COc1ccc(CNC(=O)CCC(C)(C)c2ccccc2)cc1[N+](=O)[O-] ZINC000513854714 942564095 /nfs/dbraw/zinc/56/40/95/942564095.db2.gz TXXGQQDJDXFWQP-UHFFFAOYSA-N 0 0 356.422 3.978 20 5 FHBDRN Cc1ccc(-c2cnccn2)cc1NC(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000366552324 942571895 /nfs/dbraw/zinc/57/18/95/942571895.db2.gz PLRYCMKPDXNUGT-UHFFFAOYSA-N 0 0 362.389 3.932 20 5 FHBDRN CN(C)c1ccc(COC(=O)CC[C@@H]2CC2(Cl)Cl)cc1[N+](=O)[O-] ZINC001268940866 942574353 /nfs/dbraw/zinc/57/43/53/942574353.db2.gz AVICMGZPNSDPLE-LLVKDONJSA-N 0 0 361.225 3.678 20 5 FHBDRN O=C(c1ccc(Cl)cc1[N+](=O)[O-])N1CCC[C@@H](Oc2ccccc2)C1 ZINC000416269417 942574676 /nfs/dbraw/zinc/57/46/76/942574676.db2.gz DLQRERLPUJHZGV-OAHLLOKOSA-N 0 0 360.797 3.932 20 5 FHBDRN CC(C)Cn1ncc(NC(=O)CCOc2ccccc2[N+](=O)[O-])c1C(C)C ZINC000501619543 942577831 /nfs/dbraw/zinc/57/78/31/942577831.db2.gz QNSLCRRYKDMABB-UHFFFAOYSA-N 0 0 374.441 3.978 20 5 FHBDRN Cc1c(NC(=O)[C@@H](C)CC(F)F)cc(Br)cc1[N+](=O)[O-] ZINC000413767396 942580654 /nfs/dbraw/zinc/58/06/54/942580654.db2.gz NCTXDSJXKJKVEI-LURJTMIESA-N 0 0 351.147 3.896 20 5 FHBDRN COCC(C)(C)CC(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000413768080 942580725 /nfs/dbraw/zinc/58/07/25/942580725.db2.gz OGGZAMCGTNQFHV-UHFFFAOYSA-N 0 0 359.220 3.667 20 5 FHBDRN C[C@H](c1cccc([N+](=O)[O-])c1)N(C)CC(=O)N(C)[C@@H](C)c1ccccc1 ZINC000016419969 942582411 /nfs/dbraw/zinc/58/24/11/942582411.db2.gz XSJQVSWTDPBFGV-CVEARBPZSA-N 0 0 355.438 3.807 20 5 FHBDRN O=C(c1cc2cccc([N+](=O)[O-])c2[nH]1)N1CCC[C@@H](Oc2ccccc2)C1 ZINC000416270248 942583315 /nfs/dbraw/zinc/58/33/15/942583315.db2.gz KYWCTNLHDIDOHE-MRXNPFEDSA-N 0 0 365.389 3.760 20 5 FHBDRN C[C@@H]1CCCN(c2ccc(C(=O)N3CC[C@@H](C)[C@H](C)C3)cc2[N+](=O)[O-])C1 ZINC000501647067 942594155 /nfs/dbraw/zinc/59/41/55/942594155.db2.gz NRJAXVJEMPEAOI-BZUAXINKSA-N 0 0 359.470 3.949 20 5 FHBDRN C[C@@H]1CCCN(c2ccc(C(=O)N3CC[C@H](C)[C@@H](C)C3)cc2[N+](=O)[O-])C1 ZINC000501647072 942594415 /nfs/dbraw/zinc/59/44/15/942594415.db2.gz NRJAXVJEMPEAOI-PMPSAXMXSA-N 0 0 359.470 3.949 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N(C)C[C@@H]1OCCc2ccccc21 ZINC000421456764 942595582 /nfs/dbraw/zinc/59/55/82/942595582.db2.gz ABCYUJZDXSDDDZ-IBGZPJMESA-N 0 0 354.406 3.598 20 5 FHBDRN COc1cc(C(=O)N[C@H]2CC[C@H](C)c3ccccc32)cc([N+](=O)[O-])c1OC ZINC000501682663 942597682 /nfs/dbraw/zinc/59/76/82/942597682.db2.gz WIWQLGHUDCDUMB-LRDDRELGSA-N 0 0 370.405 3.980 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)Nc1cccc(C[S@@](C)=O)c1C ZINC000421481083 942598129 /nfs/dbraw/zinc/59/81/29/942598129.db2.gz RTNPQWXLNGJMBO-RUZDIDTESA-N 0 0 360.435 3.651 20 5 FHBDRN O=C(NCCNc1ccc([N+](=O)[O-])cc1)Nc1cccc(C(F)F)c1 ZINC000513923339 942598683 /nfs/dbraw/zinc/59/86/83/942598683.db2.gz CWJBBLSUWALVTG-UHFFFAOYSA-N 0 0 350.325 3.766 20 5 FHBDRN CCCCN(C(=O)[C@H](C)NC(=O)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000434332849 942600267 /nfs/dbraw/zinc/60/02/67/942600267.db2.gz CIUWISMEFNNGLA-HNNXBMFYSA-N 0 0 369.421 3.546 20 5 FHBDRN O=C(Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1)Nc1ccc(Cl)cc1 ZINC000501675893 942606340 /nfs/dbraw/zinc/60/63/40/942606340.db2.gz QSRMOMQLZJTKET-UHFFFAOYSA-N 0 0 356.769 3.750 20 5 FHBDRN O=C(c1ccc(OC(F)F)c([N+](=O)[O-])c1)N1CC[C@H](c2ccccc2)C1 ZINC000513748871 942607228 /nfs/dbraw/zinc/60/72/28/942607228.db2.gz LGNNRCYPFSXUNP-AWEZNQCLSA-N 0 0 362.332 3.826 20 5 FHBDRN COc1ccc(CNC(=O)[C@H]2C[C@@H]2c2cccc(Cl)c2)cc1[N+](=O)[O-] ZINC000501678700 942607945 /nfs/dbraw/zinc/60/79/45/942607945.db2.gz MHXHQPSCBYCIBY-CABCVRRESA-N 0 0 360.797 3.677 20 5 FHBDRN CCOc1ccc(NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)cc1 ZINC000513748067 942610170 /nfs/dbraw/zinc/61/01/70/942610170.db2.gz BBXHRBVAFBFDAO-UHFFFAOYSA-N 0 0 352.293 3.847 20 5 FHBDRN COC(=O)CC[C@H](NC(=O)c1cc([N+](=O)[O-])c(C)cc1C)c1ccccc1 ZINC000421480678 942613342 /nfs/dbraw/zinc/61/33/42/942613342.db2.gz ZVGJYXUHKIKIIF-KRWDZBQOSA-N 0 0 370.405 3.636 20 5 FHBDRN COc1cc2c(cc1F)CN(C(=O)c1cc([N+](=O)[O-])c(C)cc1C)CC2 ZINC000421507876 942614628 /nfs/dbraw/zinc/61/46/28/942614628.db2.gz LFTJVRTYWHMBPI-UHFFFAOYSA-N 0 0 358.369 3.558 20 5 FHBDRN COC[C@@H](NC(=O)c1cc([N+](=O)[O-])c(C)cc1C)c1ccc(F)c(F)c1 ZINC000421506304 942614719 /nfs/dbraw/zinc/61/47/19/942614719.db2.gz JNKPTLPQMIOWMM-MRXNPFEDSA-N 0 0 364.348 3.607 20 5 FHBDRN COc1cc(N(CCCO)Cc2cccc(Cl)c2)c(F)cc1[N+](=O)[O-] ZINC000509538015 942622323 /nfs/dbraw/zinc/62/23/23/942622323.db2.gz CHYBSAAUTFYJLU-UHFFFAOYSA-N 0 0 368.792 3.785 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CCCCC[C@@H]2C[C@@H](C)O)ccc1[N+](=O)[O-] ZINC000413802398 942625249 /nfs/dbraw/zinc/62/52/49/942625249.db2.gz HICYAVLNNOFQMM-GDBMZVCRSA-N 0 0 364.442 3.538 20 5 FHBDRN Cc1cc(NC(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])cc2n[nH]cc21 ZINC000501720536 942627066 /nfs/dbraw/zinc/62/70/66/942627066.db2.gz JHLXDLHLYUVDQZ-JTQLQIEISA-N 0 0 374.784 3.839 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N(C)C[C@@H]1OCCc2ccccc21 ZINC000513956188 942634024 /nfs/dbraw/zinc/63/40/24/942634024.db2.gz VOAAATVZRAAUJC-SFHVURJKSA-N 0 0 355.394 3.681 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N(C)CCCOCc1ccccc1 ZINC000421541549 942635759 /nfs/dbraw/zinc/63/57/59/942635759.db2.gz MBSDVHOIVJYGSK-UHFFFAOYSA-N 0 0 356.422 3.891 20 5 FHBDRN O=C(NCc1ccc(Cl)cc1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513720529 942638450 /nfs/dbraw/zinc/63/84/50/942638450.db2.gz LRVDSFKYQYMJFO-UHFFFAOYSA-N 0 0 356.712 3.780 20 5 FHBDRN COCCC[C@@H](Cc1ccccc1)NC(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC000421533992 942643000 /nfs/dbraw/zinc/64/30/00/942643000.db2.gz KSXSNGHXIIEFQL-SFHVURJKSA-N 0 0 370.449 3.979 20 5 FHBDRN COC(=O)[C@@H](C)c1ccc(NC(=O)c2cc([N+](=O)[O-])c(C)cc2C)cc1 ZINC000421562007 942647504 /nfs/dbraw/zinc/64/75/04/942647504.db2.gz SFNCXXCBAWGCAU-ZDUSSCGKSA-N 0 0 356.378 3.740 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2cccc(-n3nccc3C)c2)c1 ZINC000366998255 942655387 /nfs/dbraw/zinc/65/53/87/942655387.db2.gz VXNYNVVTMYNFPE-UHFFFAOYSA-N 0 0 366.377 3.740 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NCc1ccc([C@H](C)O)cc1 ZINC000171436963 942655862 /nfs/dbraw/zinc/65/58/62/942655862.db2.gz KKEGZLYWSUEBEF-HNNXBMFYSA-N 0 0 371.437 3.768 20 5 FHBDRN COc1cccc2c1N(C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)CCC2 ZINC000413317441 942657592 /nfs/dbraw/zinc/65/75/92/942657592.db2.gz MUKQRPDLMRNHNB-DLBZAZTESA-N 0 0 352.390 3.686 20 5 FHBDRN O=C(NC[C@H]1CC[C@H](c2ccccc2)O1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412360262 942662784 /nfs/dbraw/zinc/66/27/84/942662784.db2.gz OVLAONYRQIJOIO-IYWMVGAKSA-N 0 0 366.417 3.735 20 5 FHBDRN CC(C)Oc1cc(C(=O)Nc2ccnn2[C@@H](C)C2CC2)ccc1[N+](=O)[O-] ZINC000413329031 942666839 /nfs/dbraw/zinc/66/68/39/942666839.db2.gz CCLKZIYRVJWQND-LBPRGKRZSA-N 0 0 358.398 3.802 20 5 FHBDRN CCOc1ccc2c(c1)CCN(C(=O)c1c[nH]c3ccc([N+](=O)[O-])cc13)C2 ZINC000434436178 942677856 /nfs/dbraw/zinc/67/78/56/942677856.db2.gz COPHFWXDYMQXTE-UHFFFAOYSA-N 0 0 365.389 3.673 20 5 FHBDRN O=C(NC1CCC2(CC2)CC1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000434459109 942683242 /nfs/dbraw/zinc/68/32/42/942683242.db2.gz JOXIOZRYERFEJL-UHFFFAOYSA-N 0 0 373.453 3.870 20 5 FHBDRN Cc1nn(-c2ccccc2)c(C)c1COC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000016470243 942685271 /nfs/dbraw/zinc/68/52/71/942685271.db2.gz SWYMEWMCCGKNEW-UHFFFAOYSA-N 0 0 351.362 3.754 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CC=C(c2cccnc2)CC1 ZINC000378378520 942685269 /nfs/dbraw/zinc/68/52/69/942685269.db2.gz PSYFJLTZNYKDTJ-CQSZACIVSA-N 0 0 369.446 3.786 20 5 FHBDRN O=C(NCCNc1ccc([N+](=O)[O-])cc1)c1cc(Cl)c(F)cc1Cl ZINC000549426334 942686010 /nfs/dbraw/zinc/68/60/10/942686010.db2.gz ZKBUWCKGXNXNQF-UHFFFAOYSA-N 0 0 372.183 3.883 20 5 FHBDRN CSc1cccc(C(=O)NC[C@H]2CC23CCSCC3)c1[N+](=O)[O-] ZINC000421590216 942686768 /nfs/dbraw/zinc/68/67/68/942686768.db2.gz MQFGHELXUFQKEJ-LLVKDONJSA-N 0 0 352.481 3.580 20 5 FHBDRN O=C(/C=C/c1cccc([N+](=O)[O-])c1)N[C@@H](c1ccccc1)[C@@H]1CCOC1 ZINC000378386790 942697189 /nfs/dbraw/zinc/69/71/89/942697189.db2.gz BQCMEYPRTDTVDA-ODBONLNUSA-N 0 0 352.390 3.502 20 5 FHBDRN Cc1cc(F)c(S(=O)(=O)Cc2ccc([N+](=O)[O-])cc2Cl)cc1F ZINC000549425702 942697543 /nfs/dbraw/zinc/69/75/43/942697543.db2.gz KOQDTTQVJYPMSH-UHFFFAOYSA-N 0 0 361.753 3.809 20 5 FHBDRN CC[C@@H](OC1CCCC1)c1nc(Cc2cc(OC)ccc2[N+](=O)[O-])no1 ZINC000420492524 942697742 /nfs/dbraw/zinc/69/77/42/942697742.db2.gz KHWZHFDDNWFJGR-MRXNPFEDSA-N 0 0 361.398 3.988 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1C[S@](C)=O ZINC000183619657 942697811 /nfs/dbraw/zinc/69/78/11/942697811.db2.gz SMHWOESYOTZYTO-HAWMADMCSA-N 0 0 374.462 3.681 20 5 FHBDRN O=C(/C=C/c1ccc([N+](=O)[O-])cc1)N[C@@H](c1ccccc1)[C@@H]1CCOC1 ZINC000378394615 942703702 /nfs/dbraw/zinc/70/37/02/942703702.db2.gz YJVZFMJCHHJPMY-GHNAFIFTSA-N 0 0 352.390 3.502 20 5 FHBDRN O=C(NCCOCc1ccc(Cl)cc1)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000514051548 942706488 /nfs/dbraw/zinc/70/64/88/942706488.db2.gz GAKGKRDUXYUPKF-UHFFFAOYSA-N 0 0 373.796 3.676 20 5 FHBDRN CN(Cc1cccc(C(F)(F)F)c1)C(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000502758339 942707027 /nfs/dbraw/zinc/70/70/27/942707027.db2.gz FHSFTGFIYBASNN-UHFFFAOYSA-N 0 0 368.311 3.651 20 5 FHBDRN Cc1ccc(-c2nc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4o3)n[nH]2)cc1 ZINC000514056607 942710421 /nfs/dbraw/zinc/71/04/21/942710421.db2.gz IBGFVZBIKPJYIG-UHFFFAOYSA-N 0 0 363.333 3.687 20 5 FHBDRN CC(C)(C(=O)Nc1ccc(-c2cc[nH]n2)cc1)c1ccccc1[N+](=O)[O-] ZINC000431864845 942710722 /nfs/dbraw/zinc/71/07/22/942710722.db2.gz YKUNEORUJJNLQE-UHFFFAOYSA-N 0 0 350.378 3.901 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N1CCC[C@H](C[C@H]2CCOC2)C1 ZINC000378397432 942715120 /nfs/dbraw/zinc/71/51/20/942715120.db2.gz FRLHAQLHJIQDBG-CHWSQXEVSA-N 0 0 367.833 3.919 20 5 FHBDRN O=[N+]([O-])c1cc(CN2CCC(F)(c3ccccc3)CC2)c2c(c1)COCO2 ZINC000434501112 942727039 /nfs/dbraw/zinc/72/70/39/942727039.db2.gz FOQKKMALCYPNEW-UHFFFAOYSA-N 0 0 372.396 3.922 20 5 FHBDRN CC(C)(CNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-])Oc1ccccc1 ZINC000514086084 942738198 /nfs/dbraw/zinc/73/81/98/942738198.db2.gz ZCHNYQXGAUQYJZ-UHFFFAOYSA-N 0 0 369.421 3.757 20 5 FHBDRN COC(=O)c1cc(NCc2cccc(OC(C)(C)C)n2)cc(C)c1[N+](=O)[O-] ZINC000502789482 942742900 /nfs/dbraw/zinc/74/29/00/942742900.db2.gz LRJBBPXRWVBUIH-UHFFFAOYSA-N 0 0 373.409 3.874 20 5 FHBDRN O=C(NCCCCOCc1ccccc1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000110261086 942759056 /nfs/dbraw/zinc/75/90/56/942759056.db2.gz XHSCDHRAAAWFCB-UHFFFAOYSA-N 0 0 362.813 3.975 20 5 FHBDRN COc1ccc2c(c1)C[C@H](C(C)C)CN2C(=O)c1cc([N+](=O)[O-])cnc1C ZINC000421715983 942767071 /nfs/dbraw/zinc/76/70/71/942767071.db2.gz ZKJCBCRGPMEUAD-HNNXBMFYSA-N 0 0 369.421 3.782 20 5 FHBDRN C[C@@H](NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1)c1ccc(F)cc1F ZINC000181587294 942776379 /nfs/dbraw/zinc/77/63/79/942776379.db2.gz SDXKNBMNVWZCTE-SNVBAGLBSA-N 0 0 360.320 3.774 20 5 FHBDRN O=[N+]([O-])c1ccc(CN2CCOC[C@@H]2c2nc3ccccc3s2)cc1 ZINC000502821835 942777874 /nfs/dbraw/zinc/77/78/74/942777874.db2.gz HRHRKWMEKZKIPE-MRXNPFEDSA-N 0 0 355.419 3.778 20 5 FHBDRN CN(Cc1cccc(F)c1)C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514140277 942778122 /nfs/dbraw/zinc/77/81/22/942778122.db2.gz NJIFBNRECBSMSW-UHFFFAOYSA-N 0 0 354.284 3.608 20 5 FHBDRN O=[N+]([O-])c1nn(Cc2csc(-c3ccsc3)n2)cc1Br ZINC000502833653 942785273 /nfs/dbraw/zinc/78/52/73/942785273.db2.gz NOBJPZMYKWQEMS-UHFFFAOYSA-N 0 0 371.241 3.787 20 5 FHBDRN Cn1ncc([N+](=O)[O-])c1NC(=O)c1cc2c(s1)CC[C@@H](C(C)(C)C)C2 ZINC001269819213 942788280 /nfs/dbraw/zinc/78/82/80/942788280.db2.gz GCBBXNGMNODHID-LLVKDONJSA-N 0 0 362.455 3.793 20 5 FHBDRN Cc1cc(Br)c(=O)n(Cc2ccc(Cl)c([N+](=O)[O-])c2)c1 ZINC000783122551 942788431 /nfs/dbraw/zinc/78/84/31/942788431.db2.gz GTINOCXCZIRAGC-UHFFFAOYSA-N 0 0 357.591 3.529 20 5 FHBDRN O=C(NC1(c2ccccc2F)CC1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514184640 942793652 /nfs/dbraw/zinc/79/36/52/942793652.db2.gz WWUQFWQNQACHCO-UHFFFAOYSA-N 0 0 366.295 3.754 20 5 FHBDRN CCN(C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)c1nc(C)cs1 ZINC000514185960 942794368 /nfs/dbraw/zinc/79/43/68/942794368.db2.gz MIOPRYXZELHRRK-UHFFFAOYSA-N 0 0 357.338 3.628 20 5 FHBDRN CSc1cccc(NC(=O)Cn2nc(C)c3cc([N+](=O)[O-])ccc32)c1 ZINC000502850708 942795768 /nfs/dbraw/zinc/79/57/68/942795768.db2.gz XPPVARRQCQPUOM-UHFFFAOYSA-N 0 0 356.407 3.614 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CCCC[C@@H]1Cc1ccccc1 ZINC000110268718 942797623 /nfs/dbraw/zinc/79/76/23/942797623.db2.gz JSNPJDWMNZCDCU-QGZVFWFLSA-N 0 0 374.462 3.689 20 5 FHBDRN CSc1cc(NC(=O)CCn2cc([N+](=O)[O-])nc2C)ccc1Cl ZINC000413940787 942806295 /nfs/dbraw/zinc/80/62/95/942806295.db2.gz BXKVZHSGXCSBDR-UHFFFAOYSA-N 0 0 354.819 3.504 20 5 FHBDRN CCCCNC(=O)[C@@H]1CCCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000514197947 942807492 /nfs/dbraw/zinc/80/74/92/942807492.db2.gz WNKOHIJPFPDRHE-GFCCVEGCSA-N 0 0 373.375 3.746 20 5 FHBDRN O=[N+]([O-])c1cc(C(F)(F)F)ccc1SCCCNc1ncccn1 ZINC000514196795 942807783 /nfs/dbraw/zinc/80/77/83/942807783.db2.gz CNPSSBHGDLHPKH-UHFFFAOYSA-N 0 0 358.345 3.998 20 5 FHBDRN COCCc1nc2cc(NC(=O)c3cc([N+](=O)[O-])c(C)cc3C)ccc2o1 ZINC000421783946 942808940 /nfs/dbraw/zinc/80/89/40/942808940.db2.gz GXXOIEWPGRZBPZ-UHFFFAOYSA-N 0 0 369.377 3.794 20 5 FHBDRN Cc1oc(C)c(C(=O)OCC(=O)Nc2cc([N+](=O)[O-])ccc2Cl)c1C ZINC000016541936 942809626 /nfs/dbraw/zinc/80/96/26/942809626.db2.gz WHDMLXRPFMXIAL-UHFFFAOYSA-N 0 0 366.757 3.562 20 5 FHBDRN Cc1cc(C)cc(CCNC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)c1 ZINC000514188429 942815582 /nfs/dbraw/zinc/81/55/82/942815582.db2.gz FBPFBOLUGVVGTM-UHFFFAOYSA-N 0 0 364.348 3.786 20 5 FHBDRN Cc1c(C(=O)N2CC[C@@H](O)[C@H]2c2ccc(Cl)cc2)cccc1[N+](=O)[O-] ZINC000425112401 942815682 /nfs/dbraw/zinc/81/56/82/942815682.db2.gz ZPCNCKPVXDAGDI-IAGOWNOFSA-N 0 0 360.797 3.505 20 5 FHBDRN CC(C)(NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)c1cccs1 ZINC000514189273 942816690 /nfs/dbraw/zinc/81/66/90/942816690.db2.gz KJTNNHHQKOYENG-UHFFFAOYSA-N 0 0 356.350 3.923 20 5 FHBDRN CS[C@H]1CCC[C@H](NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)C1 ZINC000514194801 942819932 /nfs/dbraw/zinc/81/99/32/942819932.db2.gz LZSYPCOWGKEATK-QWRGUYRKSA-N 0 0 360.382 3.600 20 5 FHBDRN COc1cc(C(=O)Nc2cc(-c3ccccc3)on2)cc([N+](=O)[O-])c1C ZINC000190119122 942824612 /nfs/dbraw/zinc/82/46/12/942824612.db2.gz CTVBJECKHHBJIS-UHFFFAOYSA-N 0 0 353.334 3.819 20 5 FHBDRN Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)N1CC[C@@H](Cc2ccncc2)C1 ZINC000367091947 942838273 /nfs/dbraw/zinc/83/82/73/942838273.db2.gz MMKVHXCYHMSEKP-AWEZNQCLSA-N 0 0 358.373 3.534 20 5 FHBDRN CCOc1cc2c(cc1NC(=O)c1ccc([N+](=O)[O-])cc1C)O[C@H](C)C2 ZINC000502916056 942840131 /nfs/dbraw/zinc/84/01/31/942840131.db2.gz KBUUYPZRBMNHCI-GFCCVEGCSA-N 0 0 356.378 3.878 20 5 FHBDRN Cc1ccccc1[C@@]1(F)CCN([C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000502905083 942845208 /nfs/dbraw/zinc/84/52/08/942845208.db2.gz CUXNPOZYDAPCAI-FOIQADDNSA-N 0 0 371.412 3.801 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CN[C@@H](c1cc(F)ccc1F)C(F)F ZINC000434661716 942845554 /nfs/dbraw/zinc/84/55/54/942845554.db2.gz ABPMQUSPOHXGCR-HNNXBMFYSA-N 0 0 358.291 3.978 20 5 FHBDRN CC(C)N(C1CCC1)S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000416460813 942848457 /nfs/dbraw/zinc/84/84/57/942848457.db2.gz MFEWCANVMJYNTC-UHFFFAOYSA-N 0 0 366.361 3.565 20 5 FHBDRN Cn1cc(CNc2ccc3c(c2)CCCN3)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000414850321 942853697 /nfs/dbraw/zinc/85/36/97/942853697.db2.gz MOUBEHRSEKLFLD-UHFFFAOYSA-N 0 0 363.421 3.966 20 5 FHBDRN CCOc1ccc(C(=O)Nc2ccc(-n3cccn3)cc2C)cc1[N+](=O)[O-] ZINC000190194288 942854207 /nfs/dbraw/zinc/85/42/07/942854207.db2.gz PJEMDNWWJWCXPO-UHFFFAOYSA-N 0 0 366.377 3.740 20 5 FHBDRN CC(C)c1ccc(C(=O)N2CCO[C@@H](c3cccc(O)c3)C2)cc1[N+](=O)[O-] ZINC000190183716 942854892 /nfs/dbraw/zinc/85/48/92/942854892.db2.gz XTACSKGYOCZIKB-LJQANCHMSA-N 0 0 370.405 3.638 20 5 FHBDRN COc1ccc(-c2cnc(COc3ccc(OC)c([N+](=O)[O-])c3)o2)cc1 ZINC000190179851 942855157 /nfs/dbraw/zinc/85/51/57/942855157.db2.gz COUDWOXIFBMJOW-UHFFFAOYSA-N 0 0 356.334 3.846 20 5 FHBDRN CCOc1ccc(NC(=O)CN(C)Cc2ccc(CC)cc2)c([N+](=O)[O-])c1 ZINC000016564386 942855501 /nfs/dbraw/zinc/85/55/01/942855501.db2.gz HJJXSGCYPKHCLV-UHFFFAOYSA-N 0 0 371.437 3.626 20 5 FHBDRN CC(C)Oc1cc(C(=O)NC[C@@H]2CCCCC2(F)F)ccc1[N+](=O)[O-] ZINC000412379298 942867123 /nfs/dbraw/zinc/86/71/23/942867123.db2.gz WAYYNDKKYGAVGG-ZDUSSCGKSA-N 0 0 356.369 3.937 20 5 FHBDRN Nc1cccc([N+](=O)[O-])c1C(=O)N1C[C@@H](c2ccccc2)C2(CCC2)C1 ZINC000413985105 942867911 /nfs/dbraw/zinc/86/79/11/942867911.db2.gz LZNIENQDNDPUDX-HNNXBMFYSA-N 0 0 351.406 3.587 20 5 FHBDRN CCNc1ccc(C(=O)OCC(=O)c2ccc(C)c(C)c2)cc1[N+](=O)[O-] ZINC000016579561 942868229 /nfs/dbraw/zinc/86/82/29/942868229.db2.gz OXCUVBALHODBTG-UHFFFAOYSA-N 0 0 356.378 3.683 20 5 FHBDRN CC(C)[C@H]1N(C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)CC12CCOCC2 ZINC000413990968 942869859 /nfs/dbraw/zinc/86/98/59/942869859.db2.gz ZYIYJMCQWWBEMB-QGZVFWFLSA-N 0 0 360.454 3.536 20 5 FHBDRN CCCn1ccnc1-c1cccc(NC(=O)c2c(N)cccc2[N+](=O)[O-])c1 ZINC000378540267 942872056 /nfs/dbraw/zinc/87/20/56/942872056.db2.gz UHOLTWKVMDLDLY-UHFFFAOYSA-N 0 0 365.393 3.703 20 5 FHBDRN CC[C@H](CNC(=O)CCOc1cc(C)ccc1[N+](=O)[O-])CC(F)(F)F ZINC000413997193 942875405 /nfs/dbraw/zinc/87/54/05/942875405.db2.gz BISLZXUFAALSLO-LBPRGKRZSA-N 0 0 362.348 3.767 20 5 FHBDRN O=C(NCc1ccc(Cl)cc1F)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC001269847570 942883573 /nfs/dbraw/zinc/88/35/73/942883573.db2.gz VKZKUHHUWNQRAU-UHFFFAOYSA-N 0 0 363.776 3.892 20 5 FHBDRN O=C(CO[C@@H]1CCCc2ccccc21)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000430090544 942884502 /nfs/dbraw/zinc/88/45/02/942884502.db2.gz OBPOEUDXKBEQTD-LJQANCHMSA-N 0 0 352.390 3.578 20 5 FHBDRN CN(Cc1nc(-c2ccccc2)c[nH]1)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000133618737 942886110 /nfs/dbraw/zinc/88/61/10/942886110.db2.gz LFCVFEZYCJDOIV-UHFFFAOYSA-N 0 0 363.377 3.758 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1cc(C(N)=O)ccc1C ZINC000502993687 942896658 /nfs/dbraw/zinc/89/66/58/942896658.db2.gz BDDIGUADTMIEDR-UHFFFAOYSA-N 0 0 373.434 3.757 20 5 FHBDRN COc1ccc(NC(=O)CO[C@H]2CCCc3ccccc32)c([N+](=O)[O-])c1 ZINC000430092403 942904001 /nfs/dbraw/zinc/90/40/01/942904001.db2.gz ZWBMPSSVJJPCLO-SFHVURJKSA-N 0 0 356.378 3.636 20 5 FHBDRN COc1cccc2sc(NC(=O)COc3ccc([N+](=O)[O-])c(C)c3)nc21 ZINC000430094122 942906639 /nfs/dbraw/zinc/90/66/39/942906639.db2.gz IRIOGGXTQZQKNI-UHFFFAOYSA-N 0 0 373.390 3.539 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2noc(COc3ccnc(C(F)(F)F)c3)n2)c1 ZINC000430110301 942921940 /nfs/dbraw/zinc/92/19/40/942921940.db2.gz YDYNPBWRYQPAJF-UHFFFAOYSA-N 0 0 366.255 3.638 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCCCC1(O)CCC1 ZINC000421995956 942929407 /nfs/dbraw/zinc/92/94/07/942929407.db2.gz SRHVTUGKIDQPLQ-UHFFFAOYSA-N 0 0 352.456 3.522 20 5 FHBDRN COc1ccc(NC(=O)CNc2c(C)c(C)ccc2Cl)c([N+](=O)[O-])c1 ZINC000434737254 942931690 /nfs/dbraw/zinc/93/16/90/942931690.db2.gz NQZPPOXPZRELMK-UHFFFAOYSA-N 0 0 363.801 3.924 20 5 FHBDRN CN([C@H]1CCC[C@@H]1c1ccccc1)S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000416547667 942937812 /nfs/dbraw/zinc/93/78/12/942937812.db2.gz WBYABGROCWPYJH-MOPGFXCFSA-N 0 0 374.462 3.693 20 5 FHBDRN COCC[C@@H](NC(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)C(C)(C)C ZINC000511566454 942939743 /nfs/dbraw/zinc/93/97/43/942939743.db2.gz PGWMXJSDVPJNSK-XJKSGUPXSA-N 0 0 351.447 3.715 20 5 FHBDRN Cc1cc(NCC2CCN(C(=O)c3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000078021262 942942317 /nfs/dbraw/zinc/94/23/17/942942317.db2.gz UUFYYTRZDJZWLV-UHFFFAOYSA-N 0 0 353.422 3.868 20 5 FHBDRN COc1ccccc1C1(CNC(=O)Nc2cc([N+](=O)[O-])ccc2C)CC1 ZINC000503070861 942951087 /nfs/dbraw/zinc/95/10/87/942951087.db2.gz WEMJPKFBZPYACV-UHFFFAOYSA-N 0 0 355.394 3.765 20 5 FHBDRN COc1cc(CNc2ccc(-n3cccn3)c(F)c2)c([N+](=O)[O-])cc1F ZINC000184006114 942955207 /nfs/dbraw/zinc/95/52/07/942955207.db2.gz GTJYJLDHPMLCTJ-UHFFFAOYSA-N 0 0 360.320 3.679 20 5 FHBDRN Cc1nc([C@H]2CCCCCN2C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)no1 ZINC000378610920 942955702 /nfs/dbraw/zinc/95/57/02/942955702.db2.gz RWLGRYCXDFIWDL-CQSZACIVSA-N 0 0 364.789 3.697 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(C)Cc1cc(Cl)ccc1F ZINC000434770299 942959239 /nfs/dbraw/zinc/95/92/39/942959239.db2.gz ZQOBMPLTVVJLEV-UHFFFAOYSA-N 0 0 372.805 3.516 20 5 FHBDRN C[C@@]1(CNC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)CCCS1 ZINC000467323763 942978917 /nfs/dbraw/zinc/97/89/17/942978917.db2.gz IXDCFNJNGAWBHX-INIZCTEOSA-N 0 0 363.464 3.734 20 5 FHBDRN CC(=O)c1ccc(C(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cc1O ZINC000412381653 942981873 /nfs/dbraw/zinc/98/18/73/942981873.db2.gz UNHBJIDYLSBJOL-INIZCTEOSA-N 0 0 368.389 3.523 20 5 FHBDRN O=C(NCCCc1nc(-c2ccncc2)cs1)c1ccc([N+](=O)[O-])s1 ZINC000503094959 942983218 /nfs/dbraw/zinc/98/32/18/942983218.db2.gz SLHAQFDINNDQKI-UHFFFAOYSA-N 0 0 374.447 3.537 20 5 FHBDRN Cc1cnc([C@@H](NC(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)C2CC2)s1 ZINC000184267180 942992197 /nfs/dbraw/zinc/99/21/97/942992197.db2.gz SJOORYDNNZPDSN-BONVTDFDSA-N 0 0 363.414 3.870 20 5 FHBDRN CN(CCOc1ccccc1Cl)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000434836279 942993028 /nfs/dbraw/zinc/99/30/28/942993028.db2.gz LPDYJINUYHJDAQ-UHFFFAOYSA-N 0 0 361.785 3.900 20 5 FHBDRN CC(C)c1ccc(CNC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)cc1 ZINC000514422417 943005280 /nfs/dbraw/zinc/00/52/80/943005280.db2.gz ZBGAISCMSCDKOZ-UHFFFAOYSA-N 0 0 364.405 3.834 20 5 FHBDRN CO[C@@](C)(CNC(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1)c1ccccc1 ZINC000412383527 943009762 /nfs/dbraw/zinc/00/97/62/943009762.db2.gz OCLHGAFIPVMPRC-FQEVSTJZSA-N 0 0 372.421 3.674 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)c1cnccc1Oc1ccccc1 ZINC000503154349 943010480 /nfs/dbraw/zinc/01/04/80/943010480.db2.gz UZABGFQJIBLZBM-UHFFFAOYSA-N 0 0 363.373 3.755 20 5 FHBDRN C[C@H](NC(=O)c1cscc1Br)c1cccc([N+](=O)[O-])c1 ZINC000404711226 943013210 /nfs/dbraw/zinc/01/32/10/943013210.db2.gz MTOCPDKMVLNPQD-QMMMGPOBSA-N 0 0 355.213 3.910 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2C[C@@H]3[C@@H]4C=C[C@@H](C4)[C@]3(C)C2)ccc1[N+](=O)[O-] ZINC000412388262 943019875 /nfs/dbraw/zinc/01/98/75/943019875.db2.gz XLNKFBFYRWJGPO-WRXMGDCGSA-N 0 0 356.422 3.666 20 5 FHBDRN CC(=O)c1ccc(NCCc2ccc(-n3cccn3)cc2)c([N+](=O)[O-])c1 ZINC000014315614 943023650 /nfs/dbraw/zinc/02/36/50/943023650.db2.gz VGNNAXCWJILOSR-UHFFFAOYSA-N 0 0 350.378 3.638 20 5 FHBDRN COc1ccc(C(=O)C2CCN(Cc3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000014326225 943026277 /nfs/dbraw/zinc/02/62/77/943026277.db2.gz CWJWVFOVWIQULT-UHFFFAOYSA-N 0 0 354.406 3.698 20 5 FHBDRN O=C(Nc1c2nsnc2ccc1Cl)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC001126430179 943047137 /nfs/dbraw/zinc/04/71/37/943047137.db2.gz CEACSWGPDWRFHN-WDEREUQCSA-N 0 0 374.809 3.995 20 5 FHBDRN CC(C)c1[nH]nc(C(=O)Nc2ccc(-n3ccnc3)c(Cl)c2)c1[N+](=O)[O-] ZINC000434190453 943056272 /nfs/dbraw/zinc/05/62/72/943056272.db2.gz TYSJTQPFAOWZNR-UHFFFAOYSA-N 0 0 374.788 3.533 20 5 FHBDRN C[C@@H](NC(=O)N1CCC[C@@H](Oc2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000416708499 943056717 /nfs/dbraw/zinc/05/67/17/943056717.db2.gz SAVUSZWOMJHGDG-NVXWUHKLSA-N 0 0 369.421 3.909 20 5 FHBDRN O=C(Cc1cccc([N+](=O)[O-])c1)N1CC(c2cccc(C(F)(F)F)c2)C1 ZINC000412392373 943057147 /nfs/dbraw/zinc/05/71/47/943057147.db2.gz FQNIZYTYPSIOEV-UHFFFAOYSA-N 0 0 364.323 3.782 20 5 FHBDRN CCN(Cc1cccc(Cl)c1)C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000514495331 943062907 /nfs/dbraw/zinc/06/29/07/943062907.db2.gz DXNAESAEKSMZSP-UHFFFAOYSA-N 0 0 362.769 3.639 20 5 FHBDRN Cc1sc(NC(=O)[C@@H]2CCCOCC2)nc1-c1cccc([N+](=O)[O-])c1 ZINC000365837621 943064954 /nfs/dbraw/zinc/06/49/54/943064954.db2.gz WNMDGQNCFFADPA-GFCCVEGCSA-N 0 0 361.423 3.782 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC[C@H]1COc1cccnc1C ZINC000416729896 943065844 /nfs/dbraw/zinc/06/58/44/943065844.db2.gz MZOOOUFOQFHUNJ-INIZCTEOSA-N 0 0 370.409 3.682 20 5 FHBDRN CCO[C@H](C)c1nc(CN(C)c2ncc(Cl)cc2[N+](=O)[O-])cs1 ZINC000434953899 943070631 /nfs/dbraw/zinc/07/06/31/943070631.db2.gz DRNYYIUDYGLWRR-SECBINFHSA-N 0 0 356.835 3.834 20 5 FHBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N(C)[C@H]1CCCc2ccccc21 ZINC000514529430 943086393 /nfs/dbraw/zinc/08/63/93/943086393.db2.gz RAUMHGFTWKTPSX-KRWDZBQOSA-N 0 0 360.435 3.601 20 5 FHBDRN CS(=O)(=O)c1ccc(N2CCC[C@H]2/C=C\c2ccccc2)c([N+](=O)[O-])c1 ZINC000503277343 943096707 /nfs/dbraw/zinc/09/67/07/943096707.db2.gz XWLXWHDFADIYMK-YDZSZYSISA-N 0 0 372.446 3.681 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2noc(N3CC[C@@H](COc4ccccc4)C3)n2)cc1 ZINC000503281569 943102545 /nfs/dbraw/zinc/10/25/45/943102545.db2.gz LPVBOPYOWMLDRD-CQSZACIVSA-N 0 0 366.377 3.550 20 5 FHBDRN CC(C)OC(=O)C[C@H](NC(=O)c1cccc(F)c1)c1ccccc1[N+](=O)[O-] ZINC000014376117 943110343 /nfs/dbraw/zinc/11/03/43/943110343.db2.gz XOTVUKQUNQKRLE-INIZCTEOSA-N 0 0 374.368 3.547 20 5 FHBDRN COCCN(Cc1ccccc1)C(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000514560632 943110671 /nfs/dbraw/zinc/11/06/71/943110671.db2.gz XWIDGIPOUKGLIC-UHFFFAOYSA-N 0 0 354.362 3.630 20 5 FHBDRN O=C(N[C@@H]1C[C@@H]1c1ccccc1C(F)(F)F)c1ccc([N+](=O)[O-])cc1 ZINC000505592651 943118966 /nfs/dbraw/zinc/11/89/66/943118966.db2.gz HCTDSNGWJROINL-UKRRQHHQSA-N 0 0 350.296 3.900 20 5 FHBDRN O=C(N[C@H]1C[C@H]1c1ccccc1C(F)(F)F)c1ccc([N+](=O)[O-])cc1 ZINC000505592652 943119105 /nfs/dbraw/zinc/11/91/05/943119105.db2.gz HCTDSNGWJROINL-ZFWWWQNUSA-N 0 0 350.296 3.900 20 5 FHBDRN COC(=O)c1cnc([C@H](C)Nc2ccc([N+](=O)[O-])c(OC(F)F)c2)s1 ZINC000425273497 943140914 /nfs/dbraw/zinc/14/09/14/943140914.db2.gz OUMKDHMBJXYYDV-ZETCQYMHSA-N 0 0 373.337 3.612 20 5 FHBDRN O=C(NCC1(Cc2ccccc2)CC1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000435100440 943148803 /nfs/dbraw/zinc/14/88/03/943148803.db2.gz GGXYLXPUAXDQRR-UHFFFAOYSA-N 0 0 365.433 3.685 20 5 FHBDRN Nc1ccc([N+](=O)[O-])cc1C(=O)OCc1cc2ccccc2nc1Cl ZINC000016814346 943159884 /nfs/dbraw/zinc/15/98/84/943159884.db2.gz XFNKIQGPRBLPOG-UHFFFAOYSA-N 0 0 357.753 3.736 20 5 FHBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)C1(c2cccnc2)CCCC1 ZINC000514628634 943161959 /nfs/dbraw/zinc/16/19/59/943161959.db2.gz FSABFDZWOMEFHQ-UHFFFAOYSA-N 0 0 367.449 3.941 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N=c1cc(C2CC2)n(CC)[nH]1 ZINC000503429401 943178003 /nfs/dbraw/zinc/17/80/03/943178003.db2.gz QLCOCHVYJWRKKE-UHFFFAOYSA-N 0 0 374.466 3.865 20 5 FHBDRN C[C@@H](c1ccc(F)cc1F)N1CCN(c2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000505611284 943185445 /nfs/dbraw/zinc/18/54/45/943185445.db2.gz QYTCUTICCSMPOT-LBPRGKRZSA-N 0 0 365.355 3.895 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000503424038 943186555 /nfs/dbraw/zinc/18/65/55/943186555.db2.gz VXXWILORHMOOCA-WQVCFCJDSA-N 0 0 364.467 3.640 20 5 FHBDRN O=C(Nc1nc(-c2ccccc2)cs1)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000514659424 943187262 /nfs/dbraw/zinc/18/72/62/943187262.db2.gz YKLGWKIXGXQBOG-UHFFFAOYSA-N 0 0 369.358 3.699 20 5 FHBDRN COC(=O)c1cnc(N[C@H]2C[C@H](c3ccccc3Cl)C2)c([N+](=O)[O-])c1 ZINC000514680050 943196099 /nfs/dbraw/zinc/19/60/99/943196099.db2.gz TUENZXJINWTOAF-UMSPYCQHSA-N 0 0 361.785 3.788 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)NCc2cccc(COC(C)(C)C)c2)c1[N+](=O)[O-] ZINC000434178455 943198003 /nfs/dbraw/zinc/19/80/03/943198003.db2.gz WKQMUEIFJIZXJE-UHFFFAOYSA-N 0 0 374.441 3.686 20 5 FHBDRN O=[N+]([O-])c1cnc(Nc2ccc3c(c2)N(CC(F)F)CCS3)s1 ZINC000557673493 943220303 /nfs/dbraw/zinc/22/03/03/943220303.db2.gz DQDZNJXRRMAQDW-UHFFFAOYSA-N 0 0 358.395 3.972 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)O[C@H]2CC(C)(C)OC2(C)C)cc1SC ZINC000783159284 943220622 /nfs/dbraw/zinc/22/06/22/943220622.db2.gz OQNUZEVRSWHIBO-AWEZNQCLSA-N 0 0 369.439 3.828 20 5 FHBDRN CC(C)(NS(=O)(=O)Cc1ccccc1Cl)c1ccc([N+](=O)[O-])cc1 ZINC000431908533 943238169 /nfs/dbraw/zinc/23/81/69/943238169.db2.gz CQADZYNITCXKRG-UHFFFAOYSA-N 0 0 368.842 3.603 20 5 FHBDRN CN(CCOc1ccccc1Cl)C(=S)Nc1ccc([N+](=O)[O-])cc1 ZINC000016949039 943243955 /nfs/dbraw/zinc/24/39/55/943243955.db2.gz RDBOMOHAMFTMPL-UHFFFAOYSA-N 0 0 365.842 3.956 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N(C)[C@H](C)C(=O)OC(C)C ZINC000503550521 943253369 /nfs/dbraw/zinc/25/33/69/943253369.db2.gz GOFRIDGXPIMIEG-GFCCVEGCSA-N 0 0 368.455 3.509 20 5 FHBDRN Cc1cc(C2=N/C(=C\c3ccc([C@@H]4C[C@@H]4C)o3)C(=O)O2)ccc1[N+](=O)[O-] ZINC000016949232 943253411 /nfs/dbraw/zinc/25/34/11/943253411.db2.gz JPSYXXSRGXNTCI-GDWNITNLSA-N 0 0 352.346 3.964 20 5 FHBDRN Cc1ccc(NC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)c(Cl)c1 ZINC000031551284 943259087 /nfs/dbraw/zinc/25/90/87/943259087.db2.gz DVVQZELFRXIYPA-UHFFFAOYSA-N 0 0 356.769 3.995 20 5 FHBDRN O=C([O-])c1cc(N[C@@H](C[NH+]2CCCC2)c2ccccc2)ccc1[N+](=O)[O-] ZINC000514732398 943260191 /nfs/dbraw/zinc/26/01/91/943260191.db2.gz FZQYSNRRVYVMRD-KRWDZBQOSA-N 0 0 355.394 3.542 20 5 FHBDRN COc1ccc(NC(=O)N2CCC[C@@H](Oc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000416984527 943268079 /nfs/dbraw/zinc/26/80/79/943268079.db2.gz CCSBRHZRKNKBKL-MRXNPFEDSA-N 0 0 371.393 3.679 20 5 FHBDRN COC(=O)c1ccc(OCCSc2ccccc2F)c([N+](=O)[O-])c1 ZINC000514767464 943277639 /nfs/dbraw/zinc/27/76/39/943277639.db2.gz YSLQMPHAJFZSDL-UHFFFAOYSA-N 0 0 351.355 3.692 20 5 FHBDRN Cc1nnc(-c2cccc(NC(=O)[C@@H](C)c3cccc([N+](=O)[O-])c3)c2)o1 ZINC000514771718 943280502 /nfs/dbraw/zinc/28/05/02/943280502.db2.gz XMMDUIJJDUXYAF-NSHDSACASA-N 0 0 352.350 3.695 20 5 FHBDRN Cc1cc(Nc2ccc(CC(N)=O)cc2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000549462365 943289066 /nfs/dbraw/zinc/28/90/66/943289066.db2.gz AEYWONMJHXEUKK-UHFFFAOYSA-N 0 0 353.300 3.693 20 5 FHBDRN Cn1c(-c2ccc([N+](=O)[O-])cc2)nnc1N1CCC[C@H]1C1CCCCC1 ZINC000514784967 943289697 /nfs/dbraw/zinc/28/96/97/943289697.db2.gz BIMAKJDMQLPVHP-KRWDZBQOSA-N 0 0 355.442 3.939 20 5 FHBDRN C[C@@H]1[C@@H](c2nc(Cc3ccc([N+](=O)[O-])cc3Br)no2)C1(F)F ZINC000514785977 943290151 /nfs/dbraw/zinc/29/01/51/943290151.db2.gz OMRAYDINKMABNQ-KBUNVGBDSA-N 0 0 374.141 3.700 20 5 FHBDRN O=C(Nc1cc(F)c(F)cc1Br)c1ccccc1[N+](=O)[O-] ZINC000435259968 943298575 /nfs/dbraw/zinc/29/85/75/943298575.db2.gz LHGIMJXMINJRJX-UHFFFAOYSA-N 0 0 357.110 3.888 20 5 FHBDRN CS[C@@H]1CCCCN(C(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000435290394 943306975 /nfs/dbraw/zinc/30/69/75/943306975.db2.gz QJHPWFWPTLZWKI-WCQYABFASA-N 0 0 372.874 3.760 20 5 FHBDRN CS[C@@H]1CCCCN(C(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000435290393 943307071 /nfs/dbraw/zinc/30/70/71/943307071.db2.gz QJHPWFWPTLZWKI-DGCLKSJQSA-N 0 0 372.874 3.760 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCCc1cscn1 ZINC000503645858 943308473 /nfs/dbraw/zinc/30/84/73/943308473.db2.gz CBRYRDSWXKFWQT-UHFFFAOYSA-N 0 0 351.453 3.526 20 5 FHBDRN O=C(NC1(c2ccccc2)CCCC1)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000505655334 943318161 /nfs/dbraw/zinc/31/81/61/943318161.db2.gz FKTGMEPRGBOYBO-UHFFFAOYSA-N 0 0 350.378 3.670 20 5 FHBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CC[C@@H]1c1ccccc1 ZINC000431918513 943321903 /nfs/dbraw/zinc/32/19/03/943321903.db2.gz IUDCVKSKNMGQQT-OAHLLOKOSA-N 0 0 361.195 3.945 20 5 FHBDRN Cc1c(NC(=O)N2CC[C@H](C)[C@H]2C)cc(Br)cc1[N+](=O)[O-] ZINC000435322829 943323803 /nfs/dbraw/zinc/32/38/03/943323803.db2.gz HDMASLZEMWBKRX-WCBMZHEXSA-N 0 0 356.220 3.928 20 5 FHBDRN Cc1c(NC(=O)N[C@H]2C=CCCC2)cc(Br)cc1[N+](=O)[O-] ZINC000435322971 943323882 /nfs/dbraw/zinc/32/38/82/943323882.db2.gz INZJVTVZKHMKCP-NSHDSACASA-N 0 0 354.204 3.896 20 5 FHBDRN Cc1c(NC(=O)N[C@H]2[C@@H]3CCC[C@@H]32)cc(Br)cc1[N+](=O)[O-] ZINC000435326517 943325545 /nfs/dbraw/zinc/32/55/45/943325545.db2.gz DDASEJOXMCRTID-IWIIMEHWSA-N 0 0 354.204 3.586 20 5 FHBDRN Cc1c(NC(=O)N[C@@H](C)CC2CC2)cc(Br)cc1[N+](=O)[O-] ZINC000435326032 943326067 /nfs/dbraw/zinc/32/60/67/943326067.db2.gz BUVSICHMNFCJNF-QMMMGPOBSA-N 0 0 356.220 3.976 20 5 FHBDRN COc1cc(NCc2ccc([N+](=O)[O-])c(OC)c2)c(Cl)c(OC)c1 ZINC000417069396 943332122 /nfs/dbraw/zinc/33/21/22/943332122.db2.gz UAHQDLLMHUZWJR-UHFFFAOYSA-N 0 0 352.774 3.886 20 5 FHBDRN Cc1c(NC(=O)N(C)[C@@H]2CCSC2)cc(Br)cc1[N+](=O)[O-] ZINC000435330807 943334990 /nfs/dbraw/zinc/33/49/90/943334990.db2.gz WITJESQQVYVMGG-SNVBAGLBSA-N 0 0 374.260 3.635 20 5 FHBDRN Cc1ccc2c(c1)[C@@H](NC(=O)CCOc1ccccc1[N+](=O)[O-])[C@H](C)C2 ZINC000503703598 943344868 /nfs/dbraw/zinc/34/48/68/943344868.db2.gz RRNWMNVEZSEAOP-VLIAUNLRSA-N 0 0 354.406 3.722 20 5 FHBDRN C[C@@H](NC(=O)NCc1cccc2c1CCCN2)c1cccc([N+](=O)[O-])c1 ZINC000417127070 943362192 /nfs/dbraw/zinc/36/21/92/943362192.db2.gz FIBDSCVUWHIWFV-CYBMUJFWSA-N 0 0 354.410 3.513 20 5 FHBDRN Cc1cnc(COC(=O)[C@H](C)Sc2ccc(F)cc2)c(C)c1[N+](=O)[O-] ZINC001269436490 943366698 /nfs/dbraw/zinc/36/66/98/943366698.db2.gz NZTFKXPVACEFLJ-LBPRGKRZSA-N 0 0 364.398 3.970 20 5 FHBDRN Cc1ccc(Sc2ccc(CN3CCC[C@H]3C(N)=O)cc2[N+](=O)[O-])cc1 ZINC000505682134 943371166 /nfs/dbraw/zinc/37/11/66/943371166.db2.gz CNZRPGXETXXWJE-INIZCTEOSA-N 0 0 371.462 3.504 20 5 FHBDRN CCc1cccc2c1OCC[C@@H]2NC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000514905828 943374900 /nfs/dbraw/zinc/37/49/00/943374900.db2.gz CEFYZFBLEHWIFA-UGSOOPFHSA-N 0 0 354.406 3.901 20 5 FHBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)N2CCC[C@H]2/C=C/c2ccccc2)cc1 ZINC000503835629 943380069 /nfs/dbraw/zinc/38/00/69/943380069.db2.gz ZDMQDCCHXNGODD-MZEUMTGBSA-N 0 0 372.446 3.602 20 5 FHBDRN Cc1cccc(O[C@H]2CCCC[C@@H]2NC(=O)Cc2ccccc2[N+](=O)[O-])c1 ZINC000435407661 943383367 /nfs/dbraw/zinc/38/33/67/943383367.db2.gz MCVQGEIQCDEINS-ICSRJNTNSA-N 0 0 368.433 3.952 20 5 FHBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCC[C@@H]2/C=C\c2ccccc2)s1 ZINC000503822267 943384263 /nfs/dbraw/zinc/38/42/63/943384263.db2.gz TZIWDAFEJVGNFF-QIAWRQBBSA-N 0 0 364.448 3.523 20 5 FHBDRN Cc1ccc(C(=O)CCC(=O)NCCc2ccc([N+](=O)[O-])cc2)cc1C ZINC000053217764 943389546 /nfs/dbraw/zinc/38/95/46/943389546.db2.gz CCNNJAVZCFYJHP-UHFFFAOYSA-N 0 0 354.406 3.533 20 5 FHBDRN COC[C@H](NCc1cc(OC)c(F)cc1[N+](=O)[O-])c1cccc(Cl)c1 ZINC000514966881 943413001 /nfs/dbraw/zinc/41/30/01/943413001.db2.gz RSGFTOFGNFWBMU-HNNXBMFYSA-N 0 0 368.792 3.873 20 5 FHBDRN Cc1cc(NCc2nnc3ccccn32)c([N+](=O)[O-])cc1C(F)(F)F ZINC000549466106 943415821 /nfs/dbraw/zinc/41/58/21/943415821.db2.gz VAMSDOGHTODLBR-UHFFFAOYSA-N 0 0 351.288 3.577 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)N[C@H]2C[C@@H]2c2ccccc2)cc1SC ZINC000503945855 943429476 /nfs/dbraw/zinc/42/94/76/943429476.db2.gz HUCGKSHNMWTWLO-OCCSQVGLSA-N 0 0 358.419 3.611 20 5 FHBDRN CCCOc1ccc2c(c1)CCN(C(=O)c1cc(C)ccc1[N+](=O)[O-])C2 ZINC000435457766 943435509 /nfs/dbraw/zinc/43/55/09/943435509.db2.gz MFMHLPZECXGFDL-UHFFFAOYSA-N 0 0 354.406 3.891 20 5 FHBDRN Cc1nc([N+](=O)[O-])c(-c2noc(-c3ccc(C(F)(F)F)c(F)c3)n2)n1C ZINC000515020277 943450376 /nfs/dbraw/zinc/45/03/76/943450376.db2.gz YEJADPSAZDRKIT-UHFFFAOYSA-N 0 0 371.250 3.512 20 5 FHBDRN O=[N+]([O-])c1ccccc1CN1CCO[C@@H](c2ccc(F)c(Cl)c2)C1 ZINC000066845485 943452168 /nfs/dbraw/zinc/45/21/68/943452168.db2.gz UNTNJFHDXXNFFD-QGZVFWFLSA-N 0 0 350.777 3.961 20 5 FHBDRN COc1ccc(Cc2noc([C@@H]3C[C@H]3c3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000417243152 943459124 /nfs/dbraw/zinc/45/91/24/943459124.db2.gz BDLIPKCBHMECHQ-DLBZAZTESA-N 0 0 351.362 3.848 20 5 FHBDRN O=[N+]([O-])c1ccc(Sc2nnc(NCCc3cccs3)s2)nc1 ZINC000014855536 943474257 /nfs/dbraw/zinc/47/42/57/943474257.db2.gz LRTRGJPMFCZQND-UHFFFAOYSA-N 0 0 365.465 3.709 20 5 FHBDRN O=C(Cc1cccc(F)c1)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F ZINC000515051846 943475221 /nfs/dbraw/zinc/47/52/21/943475221.db2.gz NCKHIZVURUKEFG-UHFFFAOYSA-N 0 0 370.302 3.868 20 5 FHBDRN CCC1(CC)CN(C(=O)c2cc([N+](=O)[O-])ccc2SCCOC)C1 ZINC000504087037 943485664 /nfs/dbraw/zinc/48/56/64/943485664.db2.gz FLPZZDKMBGHGRP-UHFFFAOYSA-N 0 0 352.456 3.596 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)N1CC[C@H](CC2CC2)C1 ZINC000515084175 943492955 /nfs/dbraw/zinc/49/29/55/943492955.db2.gz FCJOWFSMBDKEAJ-GFCCVEGCSA-N 0 0 367.243 3.548 20 5 FHBDRN CCCOc1ccccc1NC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000515085464 943493724 /nfs/dbraw/zinc/49/37/24/943493724.db2.gz MWPBNGUXNRZFBY-UHFFFAOYSA-N 0 0 350.321 3.843 20 5 FHBDRN C[C@H]1C[C@H](C)CN(C(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000017167381 943493900 /nfs/dbraw/zinc/49/39/00/943493900.db2.gz RKDYAHHUAGNVKR-RYUDHWBXSA-N 0 0 373.375 3.920 20 5 FHBDRN Cc1cc(F)cc2c1CN(C(=O)c1c[nH]c3ccc([N+](=O)[O-])cc31)CC2 ZINC000504098944 943499387 /nfs/dbraw/zinc/49/93/87/943499387.db2.gz UHLSZZHPONEVEB-UHFFFAOYSA-N 0 0 353.353 3.722 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1)[C@H](Nc1ccc(N3CCOCC3)cn1)CCCC2 ZINC000417311025 943507784 /nfs/dbraw/zinc/50/77/84/943507784.db2.gz NFIJQQXQDGPKDZ-LJQANCHMSA-N 0 0 368.437 3.706 20 5 FHBDRN COc1cccc(C(=O)NCc2ccccc2C(F)(F)F)c1[N+](=O)[O-] ZINC000435611894 943515168 /nfs/dbraw/zinc/51/51/68/943515168.db2.gz CZELTMBQPSHYKG-UHFFFAOYSA-N 0 0 354.284 3.552 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1)[C@@H](NCc1ncn(-c3ccccc3)n1)CCCC2 ZINC000417325739 943516903 /nfs/dbraw/zinc/51/69/03/943516903.db2.gz CDEDVWDZHLGWCC-IBGZPJMESA-N 0 0 363.421 3.733 20 5 FHBDRN Cc1cc(F)cc2c1CN(C(=O)c1cc3cccc([N+](=O)[O-])c3[nH]1)CC2 ZINC000504135281 943518639 /nfs/dbraw/zinc/51/86/39/943518639.db2.gz JEKBHPGITWJOGV-UHFFFAOYSA-N 0 0 353.353 3.722 20 5 FHBDRN CS(=O)(=O)c1ccc(NCC2(c3ccccc3)CCCC2)c([N+](=O)[O-])c1 ZINC000515163981 943530842 /nfs/dbraw/zinc/53/08/42/943530842.db2.gz CVCNNGXDRHWOHG-UHFFFAOYSA-N 0 0 374.462 3.922 20 5 FHBDRN COc1cccc(C(=O)N(C)Cc2c(F)cccc2Cl)c1[N+](=O)[O-] ZINC000435666791 943530876 /nfs/dbraw/zinc/53/08/76/943530876.db2.gz CAYKWKHNTRPXCR-UHFFFAOYSA-N 0 0 352.749 3.668 20 5 FHBDRN CSc1ccc(C(=O)N2CC[C@H](COc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000504183970 943531478 /nfs/dbraw/zinc/53/14/78/943531478.db2.gz HLOQLKWZNPMGLR-AWEZNQCLSA-N 0 0 372.446 3.858 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)NC2CCN(c3ccccc3)CC2)c1 ZINC000053263175 943532694 /nfs/dbraw/zinc/53/26/94/943532694.db2.gz IKYFJQDXDLLMAW-UHFFFAOYSA-N 0 0 371.462 3.716 20 5 FHBDRN CCNc1ccc(C(=O)N[C@H](c2ccc(OC)cc2)C2CC2)cc1[N+](=O)[O-] ZINC000515186457 943543027 /nfs/dbraw/zinc/54/30/27/943543027.db2.gz MLQVIZWWDGWTKQ-IBGZPJMESA-N 0 0 369.421 3.916 20 5 FHBDRN CCNc1ccc(C(=O)N[C@@H](c2ccc(OC)cc2)C2CC2)cc1[N+](=O)[O-] ZINC000515186458 943543159 /nfs/dbraw/zinc/54/31/59/943543159.db2.gz MLQVIZWWDGWTKQ-LJQANCHMSA-N 0 0 369.421 3.916 20 5 FHBDRN COc1cccc(C(=O)N2CCCC[C@@H]2Cc2ccccc2)c1[N+](=O)[O-] ZINC000435688010 943547534 /nfs/dbraw/zinc/54/75/34/943547534.db2.gz LCKVMYGIHDVNOW-MRXNPFEDSA-N 0 0 354.406 3.841 20 5 FHBDRN CC(C)Oc1ccc(NC(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)c(F)c1 ZINC000558090894 943570077 /nfs/dbraw/zinc/57/00/77/943570077.db2.gz DFXLIMJLZSUFHE-UHFFFAOYSA-N 0 0 368.311 3.981 20 5 FHBDRN C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)[C@H]1COc2ccc(Cl)cc2C1 ZINC000504278672 943570129 /nfs/dbraw/zinc/57/01/29/943570129.db2.gz DYJMQKJPJKNVKX-BXUZGUMPSA-N 0 0 372.808 3.777 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCC[C@@H]1c1ccccc1C ZINC000053279171 943577607 /nfs/dbraw/zinc/57/76/07/943577607.db2.gz AVKJYGYDLRVRCG-GOSISDBHSA-N 0 0 369.421 3.687 20 5 FHBDRN C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)CCCOc1ccc(F)cc1 ZINC000504298147 943578064 /nfs/dbraw/zinc/57/80/64/943578064.db2.gz COZDHUPGOJQOAQ-CYBMUJFWSA-N 0 0 358.369 3.871 20 5 FHBDRN CC(=O)c1ccc(Sc2nnc(-c3ccoc3C)n2C)c([N+](=O)[O-])c1 ZINC000105334610 943580506 /nfs/dbraw/zinc/58/05/06/943580506.db2.gz SILHEKSZRHDGBK-UHFFFAOYSA-N 0 0 358.379 3.646 20 5 FHBDRN C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)COc1ccc(F)c(Cl)c1 ZINC000504285507 943582278 /nfs/dbraw/zinc/58/22/78/943582278.db2.gz BOSRMLKQOJPAPA-JTQLQIEISA-N 0 0 364.760 3.744 20 5 FHBDRN C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)COc1ccc(F)cc1Cl ZINC000504311168 943585852 /nfs/dbraw/zinc/58/58/52/943585852.db2.gz GTQHIOPECGJKPE-SNVBAGLBSA-N 0 0 364.760 3.744 20 5 FHBDRN Cc1cc(Cl)ccc1OCC(=O)N1c2ccc([N+](=O)[O-])cc2C[C@H]1C ZINC000504324477 943594926 /nfs/dbraw/zinc/59/49/26/943594926.db2.gz JJFCQVOHJJDCAP-GFCCVEGCSA-N 0 0 360.797 3.913 20 5 FHBDRN CC[C@@H](CC(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1)c1ccccc1 ZINC000504328391 943596264 /nfs/dbraw/zinc/59/62/64/943596264.db2.gz HEDFUMZVOHODBJ-KRWDZBQOSA-N 0 0 367.449 3.827 20 5 FHBDRN Cc1cccc(C)c1OCCCNC(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000511627409 943600839 /nfs/dbraw/zinc/60/08/39/943600839.db2.gz NIXVTAUEZZAZOG-UHFFFAOYSA-N 0 0 372.421 3.566 20 5 FHBDRN Cc1nn(CC(=O)Nc2ccc([N+](=O)[O-])cc2F)cc1-c1ccccc1 ZINC000435753315 943604152 /nfs/dbraw/zinc/60/41/52/943604152.db2.gz QKLMTTNPJQXDMV-UHFFFAOYSA-N 0 0 354.341 3.545 20 5 FHBDRN CCCCCn1cc(CNC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)c(C)n1 ZINC000504360500 943604806 /nfs/dbraw/zinc/60/48/06/943604806.db2.gz VWWIUFPPNCQQNZ-UHFFFAOYSA-N 0 0 372.469 3.884 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(-c3c[nH]cn3)cc2)c1 ZINC000053286640 943620321 /nfs/dbraw/zinc/62/03/21/943620321.db2.gz KNEDMGLJZCCYGG-UHFFFAOYSA-N 0 0 354.391 3.959 20 5 FHBDRN Cc1cccc([C@H]2NC(=O)N([C@H](C)c3ccc(C)c([N+](=O)[O-])c3)C2=O)c1C ZINC000431948116 943625840 /nfs/dbraw/zinc/62/58/40/943625840.db2.gz CYQVXARNJRFIJI-RDTXWAMCSA-N 0 0 367.405 3.874 20 5 FHBDRN CC(C)(COCc1ccccc1)NC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000504476379 943640276 /nfs/dbraw/zinc/64/02/76/943640276.db2.gz XHLAICCVURUMHM-UHFFFAOYSA-N 0 0 362.813 3.973 20 5 FHBDRN O=C(CCc1ccc([N+](=O)[O-])cc1Cl)N1CCOCC2(CCCC2)C1 ZINC001269563452 943640385 /nfs/dbraw/zinc/64/03/85/943640385.db2.gz ZACDNJVSJNJHCE-UHFFFAOYSA-N 0 0 366.845 3.600 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCO[C@H](C)C1 ZINC000504534361 943649847 /nfs/dbraw/zinc/64/98/47/943649847.db2.gz RGCPAZVSRMXJLB-CHWSQXEVSA-N 0 0 352.456 3.642 20 5 FHBDRN COc1ccccc1[C@H]1CCCN1C(=O)COc1ccc([N+](=O)[O-])c(C)c1 ZINC000431951480 943659888 /nfs/dbraw/zinc/65/98/88/943659888.db2.gz CJSFTCYPCZZVIC-GOSISDBHSA-N 0 0 370.405 3.654 20 5 FHBDRN C[C@](NC(=O)COc1ccccc1[N+](=O)[O-])(c1ccccc1)C(F)(F)F ZINC000504547078 943669677 /nfs/dbraw/zinc/66/96/77/943669677.db2.gz MHTCCJWCQVRDGM-INIZCTEOSA-N 0 0 368.311 3.568 20 5 FHBDRN CC1(C)CCC[C@](O)(CNC(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000504552317 943674169 /nfs/dbraw/zinc/67/41/69/943674169.db2.gz JOMKPMRMPOSWJL-MRXNPFEDSA-N 0 0 374.359 3.675 20 5 FHBDRN O=C(NCCNc1ccccc1[N+](=O)[O-])[C@@H]1C[C@H]1c1ccccc1Cl ZINC000105376311 943682972 /nfs/dbraw/zinc/68/29/72/943682972.db2.gz WWAGGWNNNXXVMP-UONOGXRCSA-N 0 0 359.813 3.580 20 5 FHBDRN Cc1ccc(Sc2ccc(C[NH2+]C[C@@H](C)C(=O)[O-])cc2[N+](=O)[O-])cc1 ZINC000417581577 943727819 /nfs/dbraw/zinc/72/78/19/943727819.db2.gz GOILCSIOTFKPOC-CYBMUJFWSA-N 0 0 360.435 3.865 20 5 FHBDRN CC(C)(C)N(Cc1cccc(F)c1)C(=O)COc1ccccc1[N+](=O)[O-] ZINC000053318633 943744763 /nfs/dbraw/zinc/74/47/63/943744763.db2.gz DTTXJMCXFFLWBA-UHFFFAOYSA-N 0 0 360.385 3.940 20 5 FHBDRN CC(C)(CNC(=O)CCNc1ccccc1[N+](=O)[O-])c1ccccc1F ZINC000504740516 943763921 /nfs/dbraw/zinc/76/39/21/943763921.db2.gz JTNNDPFAPKQTLQ-UHFFFAOYSA-N 0 0 359.401 3.630 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)N[C@@H]2[C@H]3CCc4ccccc4[C@@H]23)cc1[N+](=O)[O-] ZINC000435780012 943766119 /nfs/dbraw/zinc/76/61/19/943766119.db2.gz TXPLMCQWJIHNDQ-NLKHACGTSA-N 0 0 365.433 3.992 20 5 FHBDRN COc1cccc(C(=O)N(Cc2cccs2)CC(F)(F)F)c1[N+](=O)[O-] ZINC000435815506 943772620 /nfs/dbraw/zinc/77/26/20/943772620.db2.gz DFBGWXADNBQDFE-UHFFFAOYSA-N 0 0 374.340 3.870 20 5 FHBDRN CCc1ccc(CC)c(NC(=O)c2cc(C(=O)OC)cc([N+](=O)[O-])c2)c1 ZINC000437396368 943773472 /nfs/dbraw/zinc/77/34/72/943773472.db2.gz NDVULUAYWGPWCO-UHFFFAOYSA-N 0 0 356.378 3.759 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)N[C@H]1C[C@H](c2ccccc2F)C1 ZINC000437402722 943778583 /nfs/dbraw/zinc/77/85/83/943778583.db2.gz CTGQHTLWKIFFAK-SHTZXODSSA-N 0 0 367.380 3.751 20 5 FHBDRN O=C([O-])C[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000417644400 943778616 /nfs/dbraw/zinc/77/86/16/943778616.db2.gz AQOMKGWEODUXKT-YOEHRIQHSA-N 0 0 358.394 3.978 20 5 FHBDRN CC[C@H](CSc1ccccc1)NC(=O)Cc1ccc([N+](=O)[O-])cc1F ZINC000504745991 943779761 /nfs/dbraw/zinc/77/97/61/943779761.db2.gz RRHSZVHBLSLSGI-CQSZACIVSA-N 0 0 362.426 3.964 20 5 FHBDRN C[C@H]1COCC[C@@H]1C(=O)N(Cc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000435809334 943785779 /nfs/dbraw/zinc/78/57/79/943785779.db2.gz PGUPZORAMQYSLW-KXBFYZLASA-N 0 0 354.406 3.801 20 5 FHBDRN CC(C)c1ccc(CNc2ccn(CCC(F)(F)F)n2)cc1[N+](=O)[O-] ZINC000424206714 943788704 /nfs/dbraw/zinc/78/87/04/943788704.db2.gz OKSMKWBUOYBLBR-UHFFFAOYSA-N 0 0 356.348 3.901 20 5 FHBDRN COc1ccc(NC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)c(OC)c1 ZINC000435833259 943789076 /nfs/dbraw/zinc/78/90/76/943789076.db2.gz DLCHMMCQKCISKV-UHFFFAOYSA-N 0 0 374.396 3.951 20 5 FHBDRN O=C(Nc1cccc(CO)c1)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000435833088 943789175 /nfs/dbraw/zinc/78/91/75/943789175.db2.gz DSSMAVLLQXGDJX-UHFFFAOYSA-N 0 0 362.360 3.565 20 5 FHBDRN Nc1ccc(-c2noc([C@@H]3C[C@H]3c3ccc(F)cc3F)n2)cc1[N+](=O)[O-] ZINC000515329564 943792288 /nfs/dbraw/zinc/79/22/88/943792288.db2.gz VETVPZGSQWGNQL-NWDGAFQWSA-N 0 0 358.304 3.776 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1C[C@@H]1c1ccccc1OC(F)F ZINC000437424943 943797075 /nfs/dbraw/zinc/79/70/75/943797075.db2.gz FJAKUTMMCLHHMY-CABCVRRESA-N 0 0 362.332 3.791 20 5 FHBDRN COC[C@H](C)Nc1ccccc1NC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000516905470 943803743 /nfs/dbraw/zinc/80/37/43/943803743.db2.gz NDODSJSLKWZQJJ-KBPBESRZSA-N 0 0 357.410 3.784 20 5 FHBDRN COc1cc(C(=O)Nc2nc(C(C)(C)C)cs2)cc([N+](=O)[O-])c1OC ZINC000515334874 943803968 /nfs/dbraw/zinc/80/39/68/943803968.db2.gz QLASGFFYWJFOCJ-UHFFFAOYSA-N 0 0 365.411 3.618 20 5 FHBDRN CCOc1ncccc1-c1noc(/C=C\c2ccc(F)cc2[N+](=O)[O-])n1 ZINC000515334748 943804296 /nfs/dbraw/zinc/80/42/96/943804296.db2.gz OAKUNZXWVQSFRJ-VURMDHGXSA-N 0 0 356.313 3.748 20 5 FHBDRN CCOc1cccc(/C=C\C(=O)N2CCCc3ccc([N+](=O)[O-])cc32)c1 ZINC001125911357 943808043 /nfs/dbraw/zinc/80/80/43/943808043.db2.gz MKEIPVTWZZHFDD-FLIBITNWSA-N 0 0 352.390 3.986 20 5 FHBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCCC[C@@H]1CCC(=O)[O-] ZINC000424256626 943808374 /nfs/dbraw/zinc/80/83/74/943808374.db2.gz JIQPLIKEWKIEIW-OAHLLOKOSA-N 0 0 350.415 3.601 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1Cc1nc([C@H](c2ccc(C)cc2)C(C)C)no1 ZINC000516893393 943808709 /nfs/dbraw/zinc/80/87/09/943808709.db2.gz GZLPCERKDLRWIL-KRWDZBQOSA-N 0 0 355.398 3.627 20 5 FHBDRN Cc1sc(C(=O)N[C@H]2CCC[C@@H]2OCc2ccccc2)cc1[N+](=O)[O-] ZINC000123018311 943809013 /nfs/dbraw/zinc/80/90/13/943809013.db2.gz MQPJOJHUTWULEG-HOCLYGCPSA-N 0 0 360.435 3.832 20 5 FHBDRN CC(C)[C@H](NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1)C1(CO)CCC1 ZINC000516895473 943810932 /nfs/dbraw/zinc/81/09/32/943810932.db2.gz VHSXKOXDHLQEHJ-INIZCTEOSA-N 0 0 362.451 3.727 20 5 FHBDRN O=C(N[C@H]1C[C@@H]1c1ccccc1OC(F)F)c1ccc(F)cc1[N+](=O)[O-] ZINC000437435089 943812863 /nfs/dbraw/zinc/81/28/63/943812863.db2.gz OZASKDGKPXKYSS-OLZOCXBDSA-N 0 0 366.295 3.621 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H](CCOC)c1ccc(C)o1 ZINC000516897581 943812968 /nfs/dbraw/zinc/81/29/68/943812968.db2.gz ZWOBEIBZWKXUCZ-OAHLLOKOSA-N 0 0 361.398 3.958 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1ccnc(N2CC[C@@H](C)C2)c1 ZINC000437437402 943815302 /nfs/dbraw/zinc/81/53/02/943815302.db2.gz VYISHWIGAXMHAX-GFCCVEGCSA-N 0 0 354.410 3.705 20 5 FHBDRN CCC[C@H]1CCCCN1C(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000516900687 943815747 /nfs/dbraw/zinc/81/57/47/943815747.db2.gz NIYDRRHWXFXUAM-HNNXBMFYSA-N 0 0 358.442 3.983 20 5 FHBDRN O=C(COc1ccccc1[N+](=O)[O-])N[C@H]1C[C@H](c2cccc(Cl)c2)C1 ZINC000437440378 943817615 /nfs/dbraw/zinc/81/76/15/943817615.db2.gz DHFQQVZQCSKCPC-CTYIDZIISA-N 0 0 360.797 3.689 20 5 FHBDRN CSc1cccc(-c2nc(-c3cnc4ccccn43)no2)c1[N+](=O)[O-] ZINC000515359842 943824501 /nfs/dbraw/zinc/82/45/01/943824501.db2.gz JHGJQZZLMFUCSE-UHFFFAOYSA-N 0 0 353.363 3.681 20 5 FHBDRN COc1cccc(C(=O)Nc2cc(-c3ccccc3)ns2)c1[N+](=O)[O-] ZINC000435880111 943831785 /nfs/dbraw/zinc/83/17/85/943831785.db2.gz NJMBIGQSALRYKH-UHFFFAOYSA-N 0 0 355.375 3.979 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1CN1CCC[C@@]2(CCCOC2)C1 ZINC000425411987 943836553 /nfs/dbraw/zinc/83/65/53/943836553.db2.gz BLJJGPOWLNYKKU-MRXNPFEDSA-N 0 0 369.259 3.750 20 5 FHBDRN CCOC(=O)c1cc(C(=O)Nc2ncccc2C(C)C)cc([N+](=O)[O-])c1 ZINC000504848479 943840137 /nfs/dbraw/zinc/84/01/37/943840137.db2.gz GYUTZNOKWCIUKR-UHFFFAOYSA-N 0 0 357.366 3.542 20 5 FHBDRN CCOc1ccc([C@@H](C)Nc2ccc(COCCO)cc2)cc1[N+](=O)[O-] ZINC000424316555 943840309 /nfs/dbraw/zinc/84/03/09/943840309.db2.gz NCGKIVIKXZWTAR-CQSZACIVSA-N 0 0 360.410 3.676 20 5 FHBDRN COc1cc(CNc2ccccc2-n2nccc2C)c([N+](=O)[O-])cc1F ZINC000184020460 943841546 /nfs/dbraw/zinc/84/15/46/943841546.db2.gz YFOUGHOEVIADED-UHFFFAOYSA-N 0 0 356.357 3.849 20 5 FHBDRN O=C(Nc1ccc2c[nH]nc2c1)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000435949351 943887336 /nfs/dbraw/zinc/88/73/36/943887336.db2.gz RFQVMDIQQZPOEH-UHFFFAOYSA-N 0 0 354.369 3.810 20 5 FHBDRN COC1CCC(CCNC(=O)CCc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC001267881214 943891669 /nfs/dbraw/zinc/89/16/69/943891669.db2.gz RCCRGESNSJKHMZ-UHFFFAOYSA-N 0 0 368.861 3.892 20 5 FHBDRN CCc1ccc2c(c1)[C@@H](NC(=O)c1cc(OC)c(C)c([N+](=O)[O-])c1)CCO2 ZINC001267881276 943892098 /nfs/dbraw/zinc/89/20/98/943892098.db2.gz SJHFZEBUJYNEOK-INIZCTEOSA-N 0 0 370.405 3.728 20 5 FHBDRN Cc1c(NC(=O)N[C@H]2CCC[C@@H]2C)cc(Br)cc1[N+](=O)[O-] ZINC000504895152 943893573 /nfs/dbraw/zinc/89/35/73/943893573.db2.gz MWXUVPKQCFTQNT-KWQFWETISA-N 0 0 356.220 3.976 20 5 FHBDRN CC[C@H](c1ccccc1)[N@H+](CCOc1ccccc1[N+](=O)[O-])CC(=O)[O-] ZINC000566510107 943895060 /nfs/dbraw/zinc/89/50/60/943895060.db2.gz JFMIFNKMCYJEMX-MRXNPFEDSA-N 0 0 358.394 3.512 20 5 FHBDRN COc1cccc(C(=O)N(C)Cc2cc(Cl)ccc2F)c1[N+](=O)[O-] ZINC000435978683 943903446 /nfs/dbraw/zinc/90/34/46/943903446.db2.gz PELFMKZGYDRDLW-UHFFFAOYSA-N 0 0 352.749 3.668 20 5 FHBDRN COc1ccc([C@H]2CCN(C(=O)CSc3ccccc3[N+](=O)[O-])C2)cc1 ZINC000504909376 943905767 /nfs/dbraw/zinc/90/57/67/943905767.db2.gz REQRTRSMIXQJFA-HNNXBMFYSA-N 0 0 372.446 3.712 20 5 FHBDRN Cc1ccsc1[C@@H](CO)NCc1ccc(Br)cc1[N+](=O)[O-] ZINC000425432432 943907436 /nfs/dbraw/zinc/90/74/36/943907436.db2.gz KPDCSTAAHCKTDO-GFCCVEGCSA-N 0 0 371.256 3.550 20 5 FHBDRN CCn1ccnc1[C@@H]1CCCCN1C(=O)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000435995570 943922207 /nfs/dbraw/zinc/92/22/07/943922207.db2.gz NPLZMHCCJHZFNH-INIZCTEOSA-N 0 0 367.409 3.660 20 5 FHBDRN COc1cc(NC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c(C)c(OC)c1 ZINC000504946522 943940757 /nfs/dbraw/zinc/94/07/57/943940757.db2.gz ADPFGEKTXZRHLS-LBPRGKRZSA-N 0 0 359.382 3.803 20 5 FHBDRN COc1cccc(C(=O)Nc2cc(-c3ncco3)ccc2C)c1[N+](=O)[O-] ZINC000436028888 943949722 /nfs/dbraw/zinc/94/97/22/943949722.db2.gz WOUPHVMZPCBEIL-UHFFFAOYSA-N 0 0 353.334 3.819 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(CC1CCCCC1)C1CC1 ZINC000515520196 943952458 /nfs/dbraw/zinc/95/24/58/943952458.db2.gz UOVDBZUSTINKHS-UHFFFAOYSA-N 0 0 352.456 3.637 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2noc(Cc3cccc(Br)c3)n2)c1 ZINC000505003250 943955337 /nfs/dbraw/zinc/95/53/37/943955337.db2.gz RKHKPFUGPWTFTH-UHFFFAOYSA-N 0 0 360.167 3.998 20 5 FHBDRN C[C@H]1C[C@H]1C(=O)Nc1ccc(-c2nc(-c3cccc([N+](=O)[O-])c3)no2)cc1 ZINC000504986627 943957651 /nfs/dbraw/zinc/95/76/51/943957651.db2.gz OGXNOGOZKWTFPN-MEDUHNTESA-N 0 0 364.361 3.906 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N(C)[C@@H](C)c1ccc(F)c(F)c1 ZINC000515508080 943959906 /nfs/dbraw/zinc/95/99/06/943959906.db2.gz YRLKRGNQGSJWRE-NSHDSACASA-N 0 0 370.377 3.563 20 5 FHBDRN CC1(C)CN(Cc2ccc(Br)cc2[N+](=O)[O-])[C@@H]1[C@@H]1CCCO1 ZINC000425449413 943962246 /nfs/dbraw/zinc/96/22/46/943962246.db2.gz STBCGKRSSPYOCE-LSDHHAIUSA-N 0 0 369.259 3.747 20 5 FHBDRN C[C@@H]1CCCN1c1nnc(-c2ccc([N+](=O)[O-])cc2)n1Cc1ccccc1 ZINC000517063573 943963469 /nfs/dbraw/zinc/96/34/69/943963469.db2.gz POHPOLYKAUVNHQ-OAHLLOKOSA-N 0 0 363.421 3.890 20 5 FHBDRN CC1CCN(c2ccc(-c3nc(-c4cccc([N+](=O)[O-])c4)no3)cn2)CC1 ZINC000505018804 943971580 /nfs/dbraw/zinc/97/15/80/943971580.db2.gz OOIGEXBJVIGPRR-UHFFFAOYSA-N 0 0 365.393 3.943 20 5 FHBDRN Cc1cc(C(=O)N(C)c2nc(-c3ccccc3[N+](=O)[O-])cs2)ns1 ZINC000436049194 943972962 /nfs/dbraw/zinc/97/29/62/943972962.db2.gz LPNNWGALRIKHIL-UHFFFAOYSA-N 0 0 360.420 3.760 20 5 FHBDRN COc1cccc(CO[C@@H](C)c2nc(-c3cccc([N+](=O)[O-])c3)no2)c1 ZINC000505022770 943974727 /nfs/dbraw/zinc/97/47/27/943974727.db2.gz CGBPPDMWCKWZIA-LBPRGKRZSA-N 0 0 355.350 3.931 20 5 FHBDRN O=C(CCc1ccccc1)N1CCC(Nc2ccc([N+](=O)[O-])cc2)CC1 ZINC000515550469 943983736 /nfs/dbraw/zinc/98/37/36/943983736.db2.gz NFFBPQJLACNBNG-UHFFFAOYSA-N 0 0 353.422 3.631 20 5 FHBDRN Cc1c(-c2nc(-c3ccc(C)cc3)no2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000505030690 943987774 /nfs/dbraw/zinc/98/77/74/943987774.db2.gz ORVYWVISZFZJPU-UHFFFAOYSA-N 0 0 362.349 3.509 20 5 FHBDRN CCOc1ccccc1CN(C)c1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-] ZINC000515554838 943991157 /nfs/dbraw/zinc/99/11/57/943991157.db2.gz DVNAUDMSCXOXSD-UHFFFAOYSA-N 0 0 371.437 3.768 20 5 FHBDRN CC1(C)Cc2cccc(OCc3nc(-c4cccc([N+](=O)[O-])c4)no3)c2O1 ZINC000505038746 943994725 /nfs/dbraw/zinc/99/47/25/943994725.db2.gz KPVRREYIWJBWCQ-UHFFFAOYSA-N 0 0 367.361 3.937 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)c1ccc2ccc(Cl)cc2n1 ZINC000437666008 944008799 /nfs/dbraw/zinc/00/87/99/944008799.db2.gz CEIZCVQRDVXXFH-UHFFFAOYSA-N 0 0 355.781 3.769 20 5 FHBDRN Cc1ccc(F)c(CN(C)C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)c1 ZINC000436080129 944014049 /nfs/dbraw/zinc/01/40/49/944014049.db2.gz MIQVHCIBBDQDGJ-UHFFFAOYSA-N 0 0 368.368 3.500 20 5 FHBDRN O=C(NCC1(C2CC2)CCC1)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000506091652 944018708 /nfs/dbraw/zinc/01/87/08/944018708.db2.gz QUUPWPZEVGDZDL-UHFFFAOYSA-N 0 0 355.341 3.898 20 5 FHBDRN Nc1c(C(=O)Nc2ccc(Oc3ccccn3)cc2)cc(F)cc1[N+](=O)[O-] ZINC000505757030 944022776 /nfs/dbraw/zinc/02/27/76/944022776.db2.gz DVUHLTXYSVIQNJ-UHFFFAOYSA-N 0 0 368.324 3.756 20 5 FHBDRN CC(C)[C@H]1CCC[C@@H](NC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000505067440 944026718 /nfs/dbraw/zinc/02/67/18/944026718.db2.gz CAYKAVIBSQVEFD-LSDHHAIUSA-N 0 0 356.426 3.725 20 5 FHBDRN O=C(NCCNc1ccc([N+](=O)[O-])cc1)Nc1ccc(C(F)(F)F)cc1 ZINC000505067140 944027477 /nfs/dbraw/zinc/02/74/77/944027477.db2.gz XPSFTONSAVKHTH-UHFFFAOYSA-N 0 0 368.315 3.847 20 5 FHBDRN O=C(NCCc1ccsc1)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000436097601 944029099 /nfs/dbraw/zinc/02/90/99/944029099.db2.gz IIAJXBIDJHWIQI-UHFFFAOYSA-N 0 0 366.417 3.854 20 5 FHBDRN C[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1F)c1ccccc1OC(F)F ZINC000515595760 944032990 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O=C(c1cc2cccc([N+](=O)[O-])c2[nH]1)N1CC[C@@H](c2ccccc2F)C1 ZINC000500085691 944072540 /nfs/dbraw/zinc/07/25/40/944072540.db2.gz ABRYXRVTYONRTE-CYBMUJFWSA-N 0 0 353.353 3.845 20 5 FHBDRN CC(C)c1ccc(CCNC(=O)CCOc2ccccc2[N+](=O)[O-])cc1 ZINC000515638711 944073027 /nfs/dbraw/zinc/07/30/27/944073027.db2.gz JXBWQVKMJJFWGL-UHFFFAOYSA-N 0 0 356.422 3.846 20 5 FHBDRN CC[C@H](C)[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F)C(F)(F)F ZINC000436184134 944078611 /nfs/dbraw/zinc/07/86/11/944078611.db2.gz SWTVAFMHPJNYQY-CPCISQLKSA-N 0 0 370.274 3.903 20 5 FHBDRN C[C@@H]1CN(C(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[C@H]1C ZINC000436190577 944083362 /nfs/dbraw/zinc/08/33/62/944083362.db2.gz NMSCOSHOTHZHIN-NXEZZACHSA-N 0 0 362.373 3.820 20 5 FHBDRN CC[C@@H](C)[C@@H](NC(=O)CSc1ccccc1[N+](=O)[O-])C(F)(F)F ZINC000436173271 944086095 /nfs/dbraw/zinc/08/60/95/944086095.db2.gz RLLKSSFIQZBBKZ-NOZJJQNGSA-N 0 0 350.362 3.780 20 5 FHBDRN NC(=O)c1cccc(NCC(F)(F)c2ccc(Cl)cc2)c1[N+](=O)[O-] ZINC000517192269 944088308 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FHBDRN Cc1oc(Br)cc1C(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000424819654 944139761 /nfs/dbraw/zinc/13/97/61/944139761.db2.gz JVLUBEYXUXADJM-UHFFFAOYSA-N 0 0 367.199 3.573 20 5 FHBDRN CCOc1ccc([C@H](C)NC(=O)c2csc([N+](=O)[O-])c2)cc1OCC ZINC000044309651 944141461 /nfs/dbraw/zinc/14/14/61/944141461.db2.gz KYUBVRUDRCHOMJ-NSHDSACASA-N 0 0 364.423 3.945 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H]1C[C@H]1c1cc(F)c(F)c(F)c1 ZINC000436266822 944142665 /nfs/dbraw/zinc/14/26/65/944142665.db2.gz WDFRGSRDQCZGMF-XHDPSFHLSA-N 0 0 365.311 3.998 20 5 FHBDRN CCN(CCc1cccs1)C(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000500129844 944145393 /nfs/dbraw/zinc/14/53/93/944145393.db2.gz IAOHRYIXLBTRLY-UHFFFAOYSA-N 0 0 350.465 3.840 20 5 FHBDRN O=c1cc(CNc2ccc([N+](=O)[O-])c(OC(F)F)c2)c2ccccc2[nH]1 ZINC000092657316 944145453 /nfs/dbraw/zinc/14/54/53/944145453.db2.gz BVDBSPPEVZINNM-UHFFFAOYSA-N 0 0 361.304 3.650 20 5 FHBDRN Cc1c(NC(=O)N[C@@H]2C[C@H]2c2cc(F)c(F)c(F)c2)cccc1[N+](=O)[O-] ZINC000436257141 944150263 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FHBDRN COc1ccccc1[C@H]1CCCN1C(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000123138241 944176790 /nfs/dbraw/zinc/17/67/90/944176790.db2.gz AEJAORMVGOUQIE-MRXNPFEDSA-N 0 0 371.393 3.981 20 5 FHBDRN Cc1c(CNC(=O)N[C@@H]2C[C@H]2c2c(F)cccc2F)cccc1[N+](=O)[O-] ZINC000437858467 944178478 /nfs/dbraw/zinc/17/84/78/944178478.db2.gz LZHPBUQXTUCDCW-IUODEOHRSA-N 0 0 361.348 3.537 20 5 FHBDRN Cc1ccccc1[C@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1C ZINC000515756811 944185425 /nfs/dbraw/zinc/18/54/25/944185425.db2.gz DIFVVULIBGAUJN-QGZVFWFLSA-N 0 0 360.435 3.737 20 5 FHBDRN CCN(CC)c1ccc(CNc2cc(C(F)(F)F)ncc2[N+](=O)[O-])cn1 ZINC000436317752 944195123 /nfs/dbraw/zinc/19/51/23/944195123.db2.gz NLKQWUCKJZBQTB-UHFFFAOYSA-N 0 0 369.347 3.862 20 5 FHBDRN O=C(Nc1ccc2cc([N+](=O)[O-])ccc2n1)C1(Cc2ccc(F)cc2)CC1 ZINC000437901650 944209547 /nfs/dbraw/zinc/20/95/47/944209547.db2.gz WPYZVLHXVZTVLT-UHFFFAOYSA-N 0 0 365.364 3.665 20 5 FHBDRN CCC[C@@]1(C(=O)OCC)CCCN1C(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000436340909 944218432 /nfs/dbraw/zinc/21/84/32/944218432.db2.gz ZPICBHRULCUFSQ-KRWDZBQOSA-N 0 0 368.817 3.586 20 5 FHBDRN Cc1ccc(CSCCn2cc([N+](=O)[O-])cn2)cc1Br ZINC000437923529 944221414 /nfs/dbraw/zinc/22/14/14/944221414.db2.gz ZGWHBVCNSVDDSB-UHFFFAOYSA-N 0 0 356.245 3.796 20 5 FHBDRN C[C@H]1OCC[C@@]1(C)NC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000544124470 944223439 /nfs/dbraw/zinc/22/34/39/944223439.db2.gz YSTUJQHSFCTKHU-JLTOFOAXSA-N 0 0 369.421 3.504 20 5 FHBDRN Cc1cc(Sc2nnc(COc3ccccc3)n2C)ccc1[N+](=O)[O-] ZINC000092685287 944225732 /nfs/dbraw/zinc/22/57/32/944225732.db2.gz HEZVBJMRTAIZRJ-UHFFFAOYSA-N 0 0 356.407 3.762 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]c(CN(Cc3ccccc3Cl)C3COC3)nc2c1 ZINC000425523368 944226181 /nfs/dbraw/zinc/22/61/81/944226181.db2.gz CRCHERORMCBXGL-UHFFFAOYSA-N 0 0 372.812 3.526 20 5 FHBDRN Cc1cc(NC(=O)Cc2ccccc2Cl)n(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000105582177 944228283 /nfs/dbraw/zinc/22/82/83/944228283.db2.gz QXTYIQRWQLOLMI-UHFFFAOYSA-N 0 0 370.796 3.924 20 5 FHBDRN CCCN(C(=O)c1ccc2c(c1)nc(C)[nH]c2=O)c1cccc([N+](=O)[O-])c1 ZINC001270289120 944235646 /nfs/dbraw/zinc/23/56/46/944235646.db2.gz SXPVSWJRXNWXAO-UHFFFAOYSA-N 0 0 366.377 3.609 20 5 FHBDRN COC(=O)c1cc(NC(=O)[C@@H]2C[C@@H]2c2ccc(F)cc2)c(C)c([N+](=O)[O-])c1 ZINC000515817583 944237646 /nfs/dbraw/zinc/23/76/46/944237646.db2.gz ZPHPOCOGCUFXMW-HUUCEWRRSA-N 0 0 372.352 3.571 20 5 FHBDRN COC(=O)c1cc(NC(=O)[C@H]2C[C@@H]2c2ccc(F)cc2)c(C)c([N+](=O)[O-])c1 ZINC000515817581 944237731 /nfs/dbraw/zinc/23/77/31/944237731.db2.gz ZPHPOCOGCUFXMW-CABCVRRESA-N 0 0 372.352 3.571 20 5 FHBDRN O=C(N1CCc2ccc([N+](=O)[O-])cc2C1)C1(Cc2ccc(F)cc2)CC1 ZINC000437882554 944245437 /nfs/dbraw/zinc/24/54/37/944245437.db2.gz JGRMFZCJNVMEDS-UHFFFAOYSA-N 0 0 354.381 3.642 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)F)cc1N1CCO[C@@H](c2cccc(F)c2)C1 ZINC000436381637 944250693 /nfs/dbraw/zinc/25/06/93/944250693.db2.gz AFUIUDJSZLVOKB-CQSZACIVSA-N 0 0 371.290 3.726 20 5 FHBDRN COc1cccc(COCCNc2cc(C(F)(F)F)ncc2[N+](=O)[O-])c1 ZINC000436391320 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3.628 20 5 FHBDRN COc1ccc(C(=O)O[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1 ZINC000017526883 944497139 /nfs/dbraw/zinc/49/71/39/944497139.db2.gz DJTBOJYEKAAPGO-NSHDSACASA-N 0 0 369.333 3.571 20 5 FHBDRN C[C@H](NC(=O)Nc1ccc2c(c1)NC(=O)CS2)c1cccc([N+](=O)[O-])c1 ZINC000509726831 944509616 /nfs/dbraw/zinc/50/96/16/944509616.db2.gz BQJUJERYFKJMLS-JTQLQIEISA-N 0 0 372.406 3.522 20 5 FHBDRN C[C@H](Oc1cccc(Cl)c1Cl)C(=O)N(C)c1ccc([N+](=O)[O-])nc1 ZINC000439292811 944511764 /nfs/dbraw/zinc/51/17/64/944511764.db2.gz BOCRFRAECMXUPS-VIFPVBQESA-N 0 0 370.192 3.727 20 5 FHBDRN C[C@@H]1CO[C@H](c2ccccc2Cl)CN1C(=O)Cc1ccccc1[N+](=O)[O-] ZINC000110515797 944521201 /nfs/dbraw/zinc/52/12/01/944521201.db2.gz JQSWYYUWDUFDSS-ACJLOTCBSA-N 0 0 374.824 3.779 20 5 FHBDRN O=C(Nc1cccc(-c2nccs2)c1)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000516135997 944523343 /nfs/dbraw/zinc/52/33/43/944523343.db2.gz QRLBNHSOHAJIPH-UHFFFAOYSA-N 0 0 369.358 3.699 20 5 FHBDRN C[C@@H]1CO[C@@H](c2ccccc2Cl)CN1C(=O)Cc1ccccc1[N+](=O)[O-] ZINC000110515803 944527420 /nfs/dbraw/zinc/52/74/20/944527420.db2.gz JQSWYYUWDUFDSS-FZKQIMNGSA-N 0 0 374.824 3.779 20 5 FHBDRN Cc1nc2c(s1)[C@@H](N(C)C(=O)c1cc([N+](=O)[O-])c(C)s1)CCC2 ZINC000110532170 944529971 /nfs/dbraw/zinc/52/99/71/944529971.db2.gz JLYLJQOZXAWKPM-NSHDSACASA-N 0 0 351.453 3.879 20 5 FHBDRN C[C@@H]1CO[C@H](c2ccccc2Cl)CN1C(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000110515014 944532733 /nfs/dbraw/zinc/53/27/33/944532733.db2.gz NOTKESXSSYKFLF-ACJLOTCBSA-N 0 0 374.824 3.779 20 5 FHBDRN CCCCOc1ccc(CCNC(=O)NCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000516149677 944538234 /nfs/dbraw/zinc/53/82/34/944538234.db2.gz FZZPDRVMFSKBDK-UHFFFAOYSA-N 0 0 371.437 3.816 20 5 FHBDRN C[C@@H](Cc1ccc(C(F)(F)F)cc1)NC(=O)c1ccccc1[N+](=O)[O-] ZINC000110556805 944540702 /nfs/dbraw/zinc/54/07/02/944540702.db2.gz AOSFLQJHZBTAOW-NSHDSACASA-N 0 0 352.312 3.975 20 5 FHBDRN CCc1ccc(C(=O)Nc2cc(NC(=O)N(C)C)ccc2C)cc1[N+](=O)[O-] ZINC000437905014 944543449 /nfs/dbraw/zinc/54/34/49/944543449.db2.gz CWRCQFSKVQYWFM-UHFFFAOYSA-N 0 0 370.409 3.811 20 5 FHBDRN CCCOCc1ccccc1CNC(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000047100266 944544309 /nfs/dbraw/zinc/54/43/09/944544309.db2.gz BWGJEFNUPMBYAB-UHFFFAOYSA-N 0 0 371.437 3.863 20 5 FHBDRN O=C(Nc1cccc2c1OCO2)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000543890410 944548317 /nfs/dbraw/zinc/54/83/17/944548317.db2.gz AUZCQBRFDSZMAI-UHFFFAOYSA-N 0 0 355.350 3.520 20 5 FHBDRN CCOc1cc(N2CCC(OC[C@H]3CCCCO3)CC2)ccc1[N+](=O)[O-] ZINC000426360206 944549456 /nfs/dbraw/zinc/54/94/56/944549456.db2.gz YZVGPIBAOLKMQY-QGZVFWFLSA-N 0 0 364.442 3.548 20 5 FHBDRN CCCOc1cc(NC(=O)N[C@H]2CC23CC3)c([N+](=O)[O-])cc1OCCC ZINC000425613555 944551662 /nfs/dbraw/zinc/55/16/62/944551662.db2.gz WHUGWVGMHWDDML-INIZCTEOSA-N 0 0 363.414 3.846 20 5 FHBDRN Cc1cc(Br)c(=O)n(Cc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000518622611 944552553 /nfs/dbraw/zinc/55/25/53/944552553.db2.gz CZJSLQFCULTPRV-UHFFFAOYSA-N 0 0 357.591 3.529 20 5 FHBDRN O=C(NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)c1c(F)cccc1Cl ZINC000516171019 944554323 /nfs/dbraw/zinc/55/43/23/944554323.db2.gz CQOGNJONSARVJB-UHFFFAOYSA-N 0 0 361.760 3.841 20 5 FHBDRN Cc1ccc(NC(=O)NC[C@@H](C)COCc2ccccc2)cc1[N+](=O)[O-] ZINC000506556211 944563286 /nfs/dbraw/zinc/56/32/86/944563286.db2.gz RXTQGMISKLKYBB-CQSZACIVSA-N 0 0 357.410 3.878 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CNc1cc(C)c(F)cc1Cl ZINC000506221465 944564352 /nfs/dbraw/zinc/56/43/52/944564352.db2.gz TYPXEPKSMJEJET-UHFFFAOYSA-N 0 0 367.764 3.755 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(NCc2cc(Cl)sc2Cl)n1 ZINC000312723574 944564748 /nfs/dbraw/zinc/56/47/48/944564748.db2.gz PBPREXSBCVQJAE-UHFFFAOYSA-N 0 0 362.194 3.757 20 5 FHBDRN CCn1c(COc2c(Cl)cncc2[N+](=O)[O-])nc2c1cccc2F ZINC000506557257 944565882 /nfs/dbraw/zinc/56/58/82/944565882.db2.gz WFDYIXOFFXMLMC-UHFFFAOYSA-N 0 0 350.737 3.731 20 5 FHBDRN COc1cc(CN[C@H](C)c2c(F)cccc2OC)c([N+](=O)[O-])cc1F ZINC000184309608 944566250 /nfs/dbraw/zinc/56/62/50/944566250.db2.gz PJLYARZNEJELAW-SNVBAGLBSA-N 0 0 352.337 3.741 20 5 FHBDRN O=C(OCc1ccc([N+](=O)[O-])c(F)c1)c1cc(F)c(Cl)nc1Cl ZINC000783412122 944568062 /nfs/dbraw/zinc/56/80/62/944568062.db2.gz WEYAOLYEAIFGNH-UHFFFAOYSA-N 0 0 363.103 3.932 20 5 FHBDRN CCN(CC)C(=O)c1ccc(NC(=O)c2c(C)c(F)ccc2[N+](=O)[O-])cc1 ZINC000843759350 944570192 /nfs/dbraw/zinc/57/01/92/944570192.db2.gz NIOYTMBVBYMNIS-UHFFFAOYSA-N 0 0 373.384 3.777 20 5 FHBDRN CCc1ccc(NCC(=O)Nc2ccc([N+](=O)[O-])cc2OC)cc1Cl ZINC000506220950 944574495 /nfs/dbraw/zinc/57/44/95/944574495.db2.gz SAFKJZHFWPCTAI-UHFFFAOYSA-N 0 0 363.801 3.870 20 5 FHBDRN CCCc1ccc([C@@H](C)N(CC(N)=O)Cc2c(F)cccc2[N+](=O)[O-])cc1 ZINC000505872762 944577192 /nfs/dbraw/zinc/57/71/92/944577192.db2.gz QKISSMDGUHXPSK-CQSZACIVSA-N 0 0 373.428 3.735 20 5 FHBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)NC1CCC(c2ccccc2)CC1 ZINC000506225086 944577564 /nfs/dbraw/zinc/57/75/64/944577564.db2.gz RZLIQCNGQJCKPL-UHFFFAOYSA-N 0 0 360.435 3.600 20 5 FHBDRN COc1ccc(F)cc1[C@H](C)NCc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000184303839 944582224 /nfs/dbraw/zinc/58/22/24/944582224.db2.gz JXDFVEXDGQOGFV-JTQLQIEISA-N 0 0 352.337 3.741 20 5 FHBDRN Cc1ncc(NC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)c(C2CC2)n1 ZINC000439404490 944582531 /nfs/dbraw/zinc/58/25/31/944582531.db2.gz QZTMMIBMFVLQTJ-UHFFFAOYSA-N 0 0 355.398 3.627 20 5 FHBDRN COc1ccc(Cl)cc1CNC(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000047131511 944586231 /nfs/dbraw/zinc/58/62/31/944586231.db2.gz OVDGUPDDNYUSMT-UHFFFAOYSA-N 0 0 363.801 3.598 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)N2CCCc3c(C)c(F)cc(Cl)c32)n1 ZINC000425623371 944592301 /nfs/dbraw/zinc/59/23/01/944592301.db2.gz CBUTUXNZALREEQ-UHFFFAOYSA-N 0 0 366.780 3.505 20 5 FHBDRN Cc1ncc(NC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)c(C2CC2)n1 ZINC000439420408 944593036 /nfs/dbraw/zinc/59/30/36/944593036.db2.gz MDWKIVAMNBDVIM-UHFFFAOYSA-N 0 0 367.409 3.767 20 5 FHBDRN Cc1cc(NCC(=O)N2CCc3cc([N+](=O)[O-])ccc32)c(Cl)cc1F ZINC000506233885 944600591 /nfs/dbraw/zinc/60/05/91/944600591.db2.gz OQGNGEGGUXAOJN-UHFFFAOYSA-N 0 0 363.776 3.697 20 5 FHBDRN COc1cc(CNCC(C)(F)F)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000550258668 944604872 /nfs/dbraw/zinc/60/48/72/944604872.db2.gz CPLJJIJZCYTWLP-UHFFFAOYSA-N 0 0 366.364 3.927 20 5 FHBDRN CC(C)c1ccc(C(=O)NC[C@H]2CCN(c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000439415067 944604966 /nfs/dbraw/zinc/60/49/66/944604966.db2.gz BYXXDFKPDCKNHS-MRXNPFEDSA-N 0 0 367.449 3.975 20 5 FHBDRN CC[C@H](NC(=O)N1CCOc2ccc(F)cc2C1)c1cccc([N+](=O)[O-])c1 ZINC000426013245 944610886 /nfs/dbraw/zinc/61/08/86/944610886.db2.gz MMLXMCSYTSGYGI-KRWDZBQOSA-N 0 0 373.384 3.789 20 5 FHBDRN CC[C@@H](C)C(=O)Nc1cccc(CNC(=O)Nc2ccc([N+](=O)[O-])cc2)c1 ZINC000047141240 944613182 /nfs/dbraw/zinc/61/31/82/944613182.db2.gz LGWCKBZRLMHHKP-CYBMUJFWSA-N 0 0 370.409 3.901 20 5 FHBDRN O=[N+]([O-])c1cc(CNc2ccc(F)cc2OC2CCOCC2)cs1 ZINC000506236745 944615407 /nfs/dbraw/zinc/61/54/07/944615407.db2.gz SXFKXBFMIDAPEG-UHFFFAOYSA-N 0 0 352.387 3.965 20 5 FHBDRN CSc1ccc(C(=O)N(C)C[C@@H]2OCCc3ccccc32)cc1[N+](=O)[O-] ZINC000506237324 944620495 /nfs/dbraw/zinc/62/04/95/944620495.db2.gz BLISNMAAPXZLFW-KRWDZBQOSA-N 0 0 372.446 3.703 20 5 FHBDRN C[C@H]1C[C@H](C)CN(c2ccc(C(=O)NCc3ccoc3)cc2[N+](=O)[O-])C1 ZINC000517796463 944623854 /nfs/dbraw/zinc/62/38/54/944623854.db2.gz GHRBKHSALDUXIF-KBPBESRZSA-N 0 0 357.410 3.600 20 5 FHBDRN C[C@@H](OC(=O)c1ccc2c(c1)CCCC2)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000017669157 944627754 /nfs/dbraw/zinc/62/77/54/944627754.db2.gz TYUVHIMYRFEKJG-CYBMUJFWSA-N 0 0 368.389 3.658 20 5 FHBDRN CCOc1cc(C(=O)N(C)[C@H]2CCC[C@@H](C)C2)c([N+](=O)[O-])cc1OC ZINC000031998982 944627994 /nfs/dbraw/zinc/62/79/94/944627994.db2.gz FLMCXKBXTPIXCD-OLZOCXBDSA-N 0 0 350.415 3.653 20 5 FHBDRN Cc1ccc(SCC(=O)NCCNc2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000008175450 944658915 /nfs/dbraw/zinc/65/89/15/944658915.db2.gz AWBIAQKHDDSWGM-UHFFFAOYSA-N 0 0 359.451 3.532 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NC(C)(C)C(=O)c1ccccc1 ZINC000566707479 944659153 /nfs/dbraw/zinc/65/91/53/944659153.db2.gz XANQTURLWPYECT-ZDUSSCGKSA-N 0 0 372.446 3.853 20 5 FHBDRN Cn1c(-c2ccc([N+](=O)[O-])cc2)nnc1N1CCC[C@H]1c1ccsc1 ZINC000290779818 944659651 /nfs/dbraw/zinc/65/96/51/944659651.db2.gz PJLKSUNLWSDQJS-HNNXBMFYSA-N 0 0 355.423 3.793 20 5 FHBDRN COc1ccc(C[C@@H](C)CNC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)cc1 ZINC000759875025 944666150 /nfs/dbraw/zinc/66/61/50/944666150.db2.gz PTOWKSYPGRMDPG-WASHYIJTSA-N 0 0 354.406 3.612 20 5 FHBDRN COc1ccc(C[C@H](C)CNC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)cc1 ZINC000759875023 944666465 /nfs/dbraw/zinc/66/64/65/944666465.db2.gz PTOWKSYPGRMDPG-BLMSOEDDSA-N 0 0 354.406 3.612 20 5 FHBDRN COC(=O)c1cc(OCc2cccc(OC(C)(C)C)n2)ccc1[N+](=O)[O-] ZINC000506864439 944679637 /nfs/dbraw/zinc/67/96/37/944679637.db2.gz AQFWZZYZBGEFHH-UHFFFAOYSA-N 0 0 360.366 3.533 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@@H](c1ccc(CC(C)C)cc1)C1CC1 ZINC000506252147 944690777 /nfs/dbraw/zinc/69/07/77/944690777.db2.gz FGOMNYBBXQMZKB-FQEVSTJZSA-N 0 0 370.453 3.566 20 5 FHBDRN Cc1cc(O)c(C(C)C)cc1C(=O)NCCNc1ccccc1[N+](=O)[O-] ZINC000436825117 944692856 /nfs/dbraw/zinc/69/28/56/944692856.db2.gz FLNOYOGSBIHGTG-UHFFFAOYSA-N 0 0 357.410 3.574 20 5 FHBDRN O=C(CC/C=C/c1ccccc1)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000151197003 944695593 /nfs/dbraw/zinc/69/55/93/944695593.db2.gz VTAQGVYCGHTENR-ONNFQVAWSA-N 0 0 365.433 3.737 20 5 FHBDRN CC(C)Cn1c(-c2cccc([N+](=O)[O-])c2)nnc1N(C)CC[C@H]1CCCO1 ZINC000549502851 944698629 /nfs/dbraw/zinc/69/86/29/944698629.db2.gz BGCYYGPTGSERMR-QGZVFWFLSA-N 0 0 373.457 3.515 20 5 FHBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H](O)C(C)(C)C1 ZINC000438517470 944710872 /nfs/dbraw/zinc/71/08/72/944710872.db2.gz QEVOAPBYDHDYNX-INIZCTEOSA-N 0 0 366.483 3.720 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])NC[C@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000438506191 944716074 /nfs/dbraw/zinc/71/60/74/944716074.db2.gz FQKAGGRAGXICIG-QWHCGFSZSA-N 0 0 374.359 3.849 20 5 FHBDRN Cc1nn(C(C)C)c(C)c1Cc1nc(Cc2cccc([N+](=O)[O-])c2C)no1 ZINC000426409070 944718308 /nfs/dbraw/zinc/71/83/08/944718308.db2.gz DGQDDCLXPLRUNB-UHFFFAOYSA-N 0 0 369.425 3.862 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])NCc1ccc(-c2ccccc2)o1 ZINC000516317162 944719660 /nfs/dbraw/zinc/71/96/60/944719660.db2.gz CRNSUBZMRALKPS-UHFFFAOYSA-N 0 0 366.373 3.940 20 5 FHBDRN COc1cccc(N(CC(C)C)C(=O)c2cc(OC)ccc2[N+](=O)[O-])c1 ZINC000516319079 944721755 /nfs/dbraw/zinc/72/17/55/944721755.db2.gz CIPUXSRMUZQUEY-UHFFFAOYSA-N 0 0 358.394 3.915 20 5 FHBDRN C[C@H](Cc1ccccc1F)NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000054166798 944727979 /nfs/dbraw/zinc/72/79/79/944727979.db2.gz WGMPHQCCEFIFHT-CQSZACIVSA-N 0 0 371.412 3.695 20 5 FHBDRN COc1ccc(CC(C)(C)NC(=O)CSc2ccccc2[N+](=O)[O-])cc1 ZINC000438525234 944731161 /nfs/dbraw/zinc/73/11/61/944731161.db2.gz UXNLJULORKMFIE-UHFFFAOYSA-N 0 0 374.462 3.833 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1OCC(=O)N(C1CC1)C1CCC(C)CC1 ZINC000500391521 944735481 /nfs/dbraw/zinc/73/54/81/944735481.db2.gz UWOWZZDHZZSGDK-UHFFFAOYSA-N 0 0 362.426 3.552 20 5 FHBDRN CC(C)[C@H](C)N(CC(F)(F)F)C(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000516339555 944741059 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ZINC000436918987 944803112 /nfs/dbraw/zinc/80/31/12/944803112.db2.gz LOIJGHGXZYCZJI-UHFFFAOYSA-N 0 0 352.293 3.618 20 5 FHBDRN CC[C@@H](NC(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1)C(=O)OC(C)(C)C ZINC000566775922 944803546 /nfs/dbraw/zinc/80/35/46/944803546.db2.gz BTJGIPYSPNAALB-CQSZACIVSA-N 0 0 350.415 3.568 20 5 FHBDRN Cc1cc2cc(C[NH2+][C@@H](Cc3ccccc3[N+](=O)[O-])C(=O)[O-])oc2cc1C ZINC000426806119 944806358 /nfs/dbraw/zinc/80/63/58/944806358.db2.gz AJRPZOYLQQLXPI-KRWDZBQOSA-N 0 0 368.389 3.743 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])c2cccnc12)Nc1ccsc1Cl ZINC000438570763 944806992 /nfs/dbraw/zinc/80/69/92/944806992.db2.gz XCOOOQYTDHHPIP-UHFFFAOYSA-N 0 0 363.782 3.875 20 5 FHBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NCc1ccc(F)c(F)c1 ZINC000518820108 944816262 /nfs/dbraw/zinc/81/62/62/944816262.db2.gz VNCUPVZKXMEICE-VIFPVBQESA-N 0 0 370.739 3.610 20 5 FHBDRN Cc1cccc2oc(CCNC(=O)Nc3cc([N+](=O)[O-])ccc3C)nc21 ZINC000500412104 944817342 /nfs/dbraw/zinc/81/73/42/944817342.db2.gz 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CCn1ccnc1[C@@H]1CCCCN1C(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000366657729 944849199 /nfs/dbraw/zinc/84/91/99/944849199.db2.gz WGGXBAPPCFYHRI-HNNXBMFYSA-N 0 0 362.817 3.832 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)NCCc1cc(F)c(F)c(F)c1 ZINC000506300315 944850341 /nfs/dbraw/zinc/85/03/41/944850341.db2.gz JKCIWJNFBHABGL-UHFFFAOYSA-N 0 0 353.300 3.685 20 5 FHBDRN CC[C@@H](CNC(=O)c1ccc([N+](=O)[O-])o1)Oc1ccccc1C(F)(F)F ZINC000439652304 944851466 /nfs/dbraw/zinc/85/14/66/944851466.db2.gz UATGPZGSPXVKHK-JTQLQIEISA-N 0 0 372.299 3.794 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc2nccnc2c1 ZINC000047179128 944852122 /nfs/dbraw/zinc/85/21/22/944852122.db2.gz FEBIKIJGVVEQOL-LLVKDONJSA-N 0 0 354.391 3.657 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N2C[C@H](C)N(Cc3ccccc3)C[C@H]2C)c1 ZINC000500424129 944857110 /nfs/dbraw/zinc/85/71/10/944857110.db2.gz MIXSDCMVRMXSQM-DLBZAZTESA-N 0 0 367.449 3.638 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)NCCCO[C@H](C)c2ccccc2)c1 ZINC000517946452 944860700 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3.891 20 5 FHBDRN Cc1cc([N+](=O)[O-])cnc1Nc1ccc(CS(=O)(=O)C(C)(C)C)cc1 ZINC000516484326 944929158 /nfs/dbraw/zinc/92/91/58/944929158.db2.gz MGTJUQIQLWBWFL-UHFFFAOYSA-N 0 0 363.439 3.755 20 5 FHBDRN CC(=O)c1cc(N2CCC[C@H](C(=O)Nc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000516486112 944931152 /nfs/dbraw/zinc/93/11/52/944931152.db2.gz BIFRXMNNHIRLAF-HNNXBMFYSA-N 0 0 367.405 3.653 20 5 FHBDRN COc1cc(NC(=O)Cc2cccc([N+](=O)[O-])c2)ccc1C(F)(F)F ZINC000426935387 944933959 /nfs/dbraw/zinc/93/39/59/944933959.db2.gz UWPFRAFEPHAOKP-UHFFFAOYSA-N 0 0 354.284 3.803 20 5 FHBDRN CCSCC[C@@H](C)NC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000437024385 944936249 /nfs/dbraw/zinc/93/62/49/944936249.db2.gz ZMWVLOSPJLULNQ-SECBINFHSA-N 0 0 350.362 3.875 20 5 FHBDRN CC[C@@H](c1cccc(OC)c1)N(C)C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000516506100 944941024 /nfs/dbraw/zinc/94/10/24/944941024.db2.gz WMHLLRCCJMUXLJ-HNNXBMFYSA-N 0 0 372.377 3.555 20 5 FHBDRN COc1ccc(CN2Cc3cccc(Br)c3C2)cc1[N+](=O)[O-] ZINC000613747134 944948353 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/nfs/dbraw/zinc/22/27/74/946222774.db2.gz OWZVXPZUCXWRKA-BJZITVGISA-N 0 0 368.437 3.821 20 5 FHBDRN COc1ccc(F)c(NC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)c1 ZINC000088226920 946233934 /nfs/dbraw/zinc/23/39/34/946233934.db2.gz QYYZWKHTDOKOEZ-SNVBAGLBSA-N 0 0 350.371 3.862 20 5 FHBDRN CCC[C@@H](C)NC(=O)[C@H]1CCCN(Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000783555347 946250986 /nfs/dbraw/zinc/25/09/86/946250986.db2.gz PGELJIMXVZXIPT-HIFRSBDPSA-N 0 0 367.877 3.765 20 5 FHBDRN COc1ccc(NC(=O)CN(C)c2ccc3ccccc3c2)c([N+](=O)[O-])c1 ZINC000007494138 946260389 /nfs/dbraw/zinc/26/03/89/946260389.db2.gz UWSUMBUCESYSIZ-UHFFFAOYSA-N 0 0 365.389 3.832 20 5 FHBDRN CCCc1[nH]nc(C(=O)Nc2nc(-c3ccccc3C)cs2)c1[N+](=O)[O-] ZINC000109429077 946285189 /nfs/dbraw/zinc/28/51/89/946285189.db2.gz HFZGUJQRORPELQ-UHFFFAOYSA-N 0 0 371.422 3.955 20 5 FHBDRN Cc1cc(Br)cc(C)c1NC(=O)c1cc([N+](=O)[O-])cnc1C ZINC000045998738 946286387 /nfs/dbraw/zinc/28/63/87/946286387.db2.gz JJJYIVBQMUPZKO-UHFFFAOYSA-N 0 0 364.199 3.930 20 5 FHBDRN C[C@@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1)c1cccc(N2CCCC2)c1 ZINC000088238254 946292084 /nfs/dbraw/zinc/29/20/84/946292084.db2.gz YNGOAYOYODGVID-OAHLLOKOSA-N 0 0 353.422 3.615 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)Nc1ccccc1OCC(F)F ZINC000151881837 946292198 /nfs/dbraw/zinc/29/21/98/946292198.db2.gz HMJMYOMDPRRLAB-UHFFFAOYSA-N 0 0 368.361 3.970 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)Nc1nc2cc(F)c(F)cc2s1 ZINC000109460616 946301427 /nfs/dbraw/zinc/30/14/27/946301427.db2.gz ZIBQPBDBAFLHJP-UHFFFAOYSA-N 0 0 365.317 3.500 20 5 FHBDRN CC[C@@H]1CN(C(=O)[C@H]2C[C@@H]2c2cccc([N+](=O)[O-])c2)c2ccccc2O1 ZINC001126595919 946311547 /nfs/dbraw/zinc/31/15/47/946311547.db2.gz XZUXXRQQZSHKNT-ZACQAIPSSA-N 0 0 352.390 3.903 20 5 FHBDRN Cn1c2ccccc2nc1C(C)(C)NCc1c(F)cc([N+](=O)[O-])cc1F ZINC000509630948 946312495 /nfs/dbraw/zinc/31/24/95/946312495.db2.gz DWCWYUOCHPAOOQ-UHFFFAOYSA-N 0 0 360.364 3.785 20 5 FHBDRN CSc1cccc(C(=O)N(C)CCOc2cccc(C)c2)c1[N+](=O)[O-] ZINC000186020048 946323987 /nfs/dbraw/zinc/32/39/87/946323987.db2.gz ABGVTZDLTSCENH-UHFFFAOYSA-N 0 0 360.435 3.776 20 5 FHBDRN O=C(N[C@H]1COc2ccc(Cl)cc21)c1ccc([N+](=O)[O-])cc1Cl ZINC000475080915 946335899 /nfs/dbraw/zinc/33/58/99/946335899.db2.gz MLVKKAHZZXJCIQ-ZDUSSCGKSA-N 0 0 353.161 3.765 20 5 FHBDRN O=C(NCc1ccc(Cl)cc1Cl)NCc1ccccc1[N+](=O)[O-] ZINC000042996695 946336771 /nfs/dbraw/zinc/33/67/71/946336771.db2.gz LWJKYIKABFLNLU-UHFFFAOYSA-N 0 0 354.193 3.901 20 5 FHBDRN COc1ccc(Cc2noc(/C=C/c3ccc([N+](=O)[O-])cc3)n2)cc1OC ZINC000109577383 946338872 /nfs/dbraw/zinc/33/88/72/946338872.db2.gz LTJVJZNCKVMLRH-UXBLZVDNSA-N 0 0 367.361 3.756 20 5 FHBDRN CSc1cccc(C(=O)N2CCN(c3cccc(C)c3)CC2)c1[N+](=O)[O-] ZINC000186024477 946349914 /nfs/dbraw/zinc/34/99/14/946349914.db2.gz CLCJTEXOQOIICI-UHFFFAOYSA-N 0 0 371.462 3.588 20 5 FHBDRN CSc1cccc(C(=O)NC2CCN(c3ccccc3)CC2)c1[N+](=O)[O-] ZINC000186472455 946351781 /nfs/dbraw/zinc/35/17/81/946351781.db2.gz QCVVOZOVVWYICJ-UHFFFAOYSA-N 0 0 371.462 3.716 20 5 FHBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)N(C2CC2)[C@H]2CCc3ccccc32)cc1 ZINC000109616690 946352804 /nfs/dbraw/zinc/35/28/04/946352804.db2.gz AGGICXVWLCVWSP-IBGZPJMESA-N 0 0 372.446 3.577 20 5 FHBDRN CC(C)c1ccc(CN(C)Cc2nc(-c3cccnc3)no2)cc1[N+](=O)[O-] ZINC000093365458 946357343 /nfs/dbraw/zinc/35/73/43/946357343.db2.gz ZQGQYJRGLWTZDG-UHFFFAOYSA-N 0 0 367.409 3.795 20 5 FHBDRN O=C(COc1ccc(Cl)c(Cl)c1)NCc1ccccc1[N+](=O)[O-] ZINC000046149293 946372668 /nfs/dbraw/zinc/37/26/68/946372668.db2.gz ILVYEDLZFBETMB-UHFFFAOYSA-N 0 0 355.177 3.597 20 5 FHBDRN CSc1cccc(C(=O)N[C@@H]2CCOc3ccc(F)cc32)c1[N+](=O)[O-] ZINC000186480515 946372839 /nfs/dbraw/zinc/37/28/39/946372839.db2.gz VXYXARRTYBMTSS-CYBMUJFWSA-N 0 0 362.382 3.709 20 5 FHBDRN CCC[C@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)C(=O)OC ZINC000475098991 946377831 /nfs/dbraw/zinc/37/78/31/946377831.db2.gz WJPFBRCIFKFLHV-HNNXBMFYSA-N 0 0 366.801 3.940 20 5 FHBDRN C[C@@H](CSCc1ccccc1)C(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000440104395 946389978 /nfs/dbraw/zinc/38/99/78/946389978.db2.gz LPNMQCTYDWRFGJ-HNNXBMFYSA-N 0 0 358.463 3.823 20 5 FHBDRN COc1ccc(C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])c(OCC(C)C)c1 ZINC000475482688 946391441 /nfs/dbraw/zinc/39/14/41/946391441.db2.gz YEGRUGMRXKMCAV-UHFFFAOYSA-N 0 0 374.393 3.899 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)N1CC2(CCC2)[C@@H]1c1ccco1 ZINC000456575353 946391935 /nfs/dbraw/zinc/39/19/35/946391935.db2.gz UNSOOTYGLJCVAS-IBGZPJMESA-N 0 0 365.389 3.896 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1-c1noc(-c2csc(-c3cnccn3)n2)n1 ZINC000545691678 946396114 /nfs/dbraw/zinc/39/61/14/946396114.db2.gz RDTGZEBVDNFOMS-UHFFFAOYSA-N 0 0 366.362 3.534 20 5 FHBDRN CCc1nc([C@@H](C)NC(=O)c2cccc(SC)c2[N+](=O)[O-])cs1 ZINC000186487720 946397494 /nfs/dbraw/zinc/39/74/94/946397494.db2.gz LJAWGZOLVPFQBE-SECBINFHSA-N 0 0 351.453 3.827 20 5 FHBDRN COCCCCc1noc(-c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)n1 ZINC000545685310 946406617 /nfs/dbraw/zinc/40/66/17/946406617.db2.gz PROSYJSJPKEFGT-UHFFFAOYSA-N 0 0 374.441 3.850 20 5 FHBDRN COc1ccc(C(=O)Nc2ccc([N+](=O)[O-])cc2)c(OCCOC(C)C)c1 ZINC000475485627 946407664 /nfs/dbraw/zinc/40/76/64/946407664.db2.gz HOQVCZVQCPFRLP-UHFFFAOYSA-N 0 0 374.393 3.660 20 5 FHBDRN Cc1c(C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)cnn1CC(C)C ZINC000121370545 946426092 /nfs/dbraw/zinc/42/60/92/946426092.db2.gz YBBUYAXDASDXNY-UHFFFAOYSA-N 0 0 356.426 3.561 20 5 FHBDRN CC(=Cc1cccc([N+](=O)[O-])c1)CNc1ccc(N2CCNC2=O)cc1C ZINC000441335034 946440859 /nfs/dbraw/zinc/44/08/59/946440859.db2.gz XHUOWHPSFFHULZ-UVTDQMKNSA-N 0 0 366.421 3.948 20 5 FHBDRN CC(C)c1ccc(CNc2cn(Cc3ccccc3)nn2)cc1[N+](=O)[O-] ZINC000508488310 946475676 /nfs/dbraw/zinc/47/56/76/946475676.db2.gz IPQMKZIQBBYFPT-UHFFFAOYSA-N 0 0 351.410 3.970 20 5 FHBDRN C[C@@H]1[C@H](C(=O)N2CCCc3ccc([N+](=O)[O-])cc32)CCN1c1ccccc1 ZINC000475502831 946488455 /nfs/dbraw/zinc/48/84/55/946488455.db2.gz OZPPLHOJEHEXQE-DNVCBOLYSA-N 0 0 365.433 3.789 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N(Cc1ccccc1)CC1(O)CCCC1 ZINC000475502919 946488747 /nfs/dbraw/zinc/48/87/47/946488747.db2.gz NLKSXQVGQXGGPT-UHFFFAOYSA-N 0 0 368.433 3.851 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1OC[C@@H](O)c1ccccc1C(F)(F)F ZINC000179065139 946490349 /nfs/dbraw/zinc/49/03/49/946490349.db2.gz MUVJKSQLDQPAAE-CYBMUJFWSA-N 0 0 357.284 3.735 20 5 FHBDRN Cc1c(C(F)(F)F)nn(C)c1NC(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000186111254 946492404 /nfs/dbraw/zinc/49/24/04/946492404.db2.gz SBYHFATXPOHERZ-ZETCQYMHSA-N 0 0 374.294 3.537 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)Cc1ccc(Br)s1 ZINC000074400501 946502420 /nfs/dbraw/zinc/50/24/20/946502420.db2.gz CZONHTGHAAUDNM-UHFFFAOYSA-N 0 0 355.213 3.908 20 5 FHBDRN CCOc1cc(NC(=O)N(C)C[C@H](C)CC)c([N+](=O)[O-])cc1OCC ZINC000111715365 946506740 /nfs/dbraw/zinc/50/67/40/946506740.db2.gz XDXSSUOQEYODOZ-GFCCVEGCSA-N 0 0 353.419 3.902 20 5 FHBDRN Cc1c(C(F)(F)F)nn(C)c1NC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000186139523 946523856 /nfs/dbraw/zinc/52/38/56/946523856.db2.gz LDKZIWRIKLJPKY-UHFFFAOYSA-N 0 0 362.695 3.561 20 5 FHBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H](C)[C@@H](OC)C1 ZINC000469873929 946528107 /nfs/dbraw/zinc/52/81/07/946528107.db2.gz GRJCCGIASYZYCJ-BBRMVZONSA-N 0 0 366.483 3.984 20 5 FHBDRN COC(=O)[C@@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)C1CC1 ZINC000475159739 946529360 /nfs/dbraw/zinc/52/93/60/946529360.db2.gz ZENXWMULTXSWTC-INIZCTEOSA-N 0 0 364.785 3.549 20 5 FHBDRN Cc1ccc(C(=O)Nc2ccc(-c3cn4cccnc4n3)cc2)cc1[N+](=O)[O-] ZINC000048206079 946532423 /nfs/dbraw/zinc/53/24/23/946532423.db2.gz VPGOIUWFIFETES-UHFFFAOYSA-N 0 0 373.372 3.865 20 5 FHBDRN COc1c(C(=O)NC[C@H]2CCCO[C@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000475163117 946538064 /nfs/dbraw/zinc/53/80/64/946538064.db2.gz FPLUBOSTDYJJLD-QAPCUYQASA-N 0 0 370.405 3.501 20 5 FHBDRN C[C@H](CNC(=O)N1CCC=C(c2ccncc2)C1)c1ccccc1[N+](=O)[O-] ZINC000897057563 946544848 /nfs/dbraw/zinc/54/48/48/946544848.db2.gz GFPJFGFXKXLFEP-OAHLLOKOSA-N 0 0 366.421 3.592 20 5 FHBDRN C[C@@H](CNC(=O)N1CC(C)(C)[C@H]1c1ccncc1)c1ccccc1[N+](=O)[O-] ZINC000897061657 946548196 /nfs/dbraw/zinc/54/81/96/946548196.db2.gz MODXNQSCGNDPQH-KBXCAEBGSA-N 0 0 368.437 3.886 20 5 FHBDRN CC1(C)C[C@H](Nc2ccc([N+](=O)[O-])cc2N2CCOC2=O)CCS1 ZINC000897061026 946548216 /nfs/dbraw/zinc/54/82/16/946548216.db2.gz QCCKDTZLZWQQAY-LLVKDONJSA-N 0 0 351.428 3.638 20 5 FHBDRN COc1cc(C(=O)Nc2cccc(-c3cnco3)c2)c([N+](=O)[O-])cc1OC ZINC000048241705 946548536 /nfs/dbraw/zinc/54/85/36/946548536.db2.gz MCQYWPHQMWPWIM-UHFFFAOYSA-N 0 0 369.333 3.519 20 5 FHBDRN CC1(C)C[C@@H](Nc2ccc([N+](=O)[O-])cc2N2CCOC2=O)CCS1 ZINC000897061027 946548653 /nfs/dbraw/zinc/54/86/53/946548653.db2.gz QCCKDTZLZWQQAY-NSHDSACASA-N 0 0 351.428 3.638 20 5 FHBDRN CC(=O)Nc1ccc(C)c(NC(=O)N(C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000048274349 946564637 /nfs/dbraw/zinc/56/46/37/946564637.db2.gz DYFQECQUZUUJBI-UHFFFAOYSA-N 0 0 356.382 3.526 20 5 FHBDRN C[C@@H](NCc1ccc(C(N)=O)cc1[N+](=O)[O-])c1cc(Cl)ccc1Cl ZINC000186180451 946585669 /nfs/dbraw/zinc/58/56/69/946585669.db2.gz SNDLQVODAAICAL-SECBINFHSA-N 0 0 368.220 3.851 20 5 FHBDRN Cc1nn(Cc2ccc(-c3nc([C@H]4C[C@@H]4C)no3)cc2)c(C)c1[N+](=O)[O-] ZINC000545767740 946586033 /nfs/dbraw/zinc/58/60/33/946586033.db2.gz JDRBIINEBGSRPX-BONVTDFDSA-N 0 0 353.382 3.630 20 5 FHBDRN CC[C@@H](C)[C@](C)(O)CNC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000475188499 946591480 /nfs/dbraw/zinc/59/14/80/946591480.db2.gz CBUILEBDZFWQGD-YMTOWFKASA-N 0 0 363.336 3.532 20 5 FHBDRN COc1c(C(=O)N2CC3(CCC3)c3c2cccc3F)cccc1[N+](=O)[O-] ZINC000475527550 946600832 /nfs/dbraw/zinc/60/08/32/946600832.db2.gz NHHLCFZBBGHCEL-UHFFFAOYSA-N 0 0 356.353 3.825 20 5 FHBDRN CC(C)COc1cccc(-c2nc(Cc3ccc([N+](=O)[O-])cn3)no2)c1 ZINC000545775483 946611231 /nfs/dbraw/zinc/61/12/31/946611231.db2.gz KFXPCFAZAURZQW-UHFFFAOYSA-N 0 0 354.366 3.665 20 5 FHBDRN CCOc1cc(CNC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)ccc1OC ZINC000121388261 946612397 /nfs/dbraw/zinc/61/23/97/946612397.db2.gz UQTCRBXIWXDWGQ-UHFFFAOYSA-N 0 0 364.785 3.586 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N[C@H]1CCc2cn(C(C)C)nc2C1 ZINC000475549745 946619521 /nfs/dbraw/zinc/61/95/21/946619521.db2.gz FYLRCIILEOZYHI-HNNXBMFYSA-N 0 0 371.441 3.668 20 5 FHBDRN Cc1nn(Cc2coc(-c3ccc(C(F)(F)F)cc3)n2)cc1[N+](=O)[O-] ZINC000181812460 946624383 /nfs/dbraw/zinc/62/43/83/946624383.db2.gz DYCUXIIJJLDHBL-UHFFFAOYSA-N 0 0 352.272 3.822 20 5 FHBDRN Cc1ccc(C)c([C@@H]2CCCN2C(=O)CNc2ccccc2[N+](=O)[O-])c1 ZINC000475544623 946628735 /nfs/dbraw/zinc/62/87/35/946628735.db2.gz VIWMZRYUZUHMBC-SFHVURJKSA-N 0 0 353.422 3.987 20 5 FHBDRN COc1cc(C(=O)N2CCC[C@@]2(C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000186225140 946629628 /nfs/dbraw/zinc/62/96/28/946629628.db2.gz PSXIFYQMAYGOOW-FQEVSTJZSA-N 0 0 354.406 3.841 20 5 FHBDRN CC(=O)Nc1cc(NC(=O)N(C)Cc2ccccc2[N+](=O)[O-])ccc1C ZINC000048364847 946630975 /nfs/dbraw/zinc/63/09/75/946630975.db2.gz ZJMSYGLMGDNQNN-UHFFFAOYSA-N 0 0 356.382 3.526 20 5 FHBDRN O=C(NCc1coc(-c2cccs2)n1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000026064602 946636726 /nfs/dbraw/zinc/63/67/26/946636726.db2.gz BWQQPHLJRQRCRD-UHFFFAOYSA-N 0 0 363.782 3.895 20 5 FHBDRN CSc1cccc(C(=O)N(CC(F)(F)F)c2ccccn2)c1[N+](=O)[O-] ZINC000186250030 946647116 /nfs/dbraw/zinc/64/71/16/946647116.db2.gz MMQIPURGQCADBY-UHFFFAOYSA-N 0 0 371.340 3.921 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NC[C@H](C)N(C)c1ccccc1 ZINC000475563390 946657673 /nfs/dbraw/zinc/65/76/73/946657673.db2.gz FYMWYMVXHCIPQJ-HNNXBMFYSA-N 0 0 356.426 3.858 20 5 FHBDRN Cc1nc(NC(=O)c2cn(C)nc2-c2ccccc2Cl)ccc1[N+](=O)[O-] ZINC000134016287 946658973 /nfs/dbraw/zinc/65/89/73/946658973.db2.gz CXLGDORFPOUYFE-UHFFFAOYSA-N 0 0 371.784 3.604 20 5 FHBDRN O=[N+]([O-])c1cccnc1SCc1nc(-c2ccc(F)c(F)c2)no1 ZINC000134022697 946663135 /nfs/dbraw/zinc/66/31/35/946663135.db2.gz CLTWLWRQMWHJIK-UHFFFAOYSA-N 0 0 350.306 3.610 20 5 FHBDRN Cc1ccc(NCCCNC(=O)N(C)[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 ZINC000121406056 946669618 /nfs/dbraw/zinc/66/96/18/946669618.db2.gz AFCUGGOEYXVSRW-HNNXBMFYSA-N 0 0 371.441 3.503 20 5 FHBDRN COc1cccc(C[C@H]2CCCN2C(=O)NCc2cccc([N+](=O)[O-])c2)c1 ZINC000067536326 946674376 /nfs/dbraw/zinc/67/43/76/946674376.db2.gz LGXPBBWDIIDLPG-QGZVFWFLSA-N 0 0 369.421 3.520 20 5 FHBDRN COc1ccc([C@@H](C)CCNC(=O)c2ccc([N+](=O)[O-])c(OC)c2)cc1 ZINC000151950673 946682244 /nfs/dbraw/zinc/68/22/44/946682244.db2.gz ZSCCCJITZUBECV-ZDUSSCGKSA-N 0 0 358.394 3.536 20 5 FHBDRN COC1CCC(CCNC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000541634401 946695831 /nfs/dbraw/zinc/69/58/31/946695831.db2.gz DGCQPCKTKIGACY-UHFFFAOYSA-N 0 0 354.834 3.502 20 5 FHBDRN CSc1ccc(C(=O)N[C@H]2CCCc3cc(N)ccc32)cc1[N+](=O)[O-] ZINC000186611024 946701280 /nfs/dbraw/zinc/70/12/80/946701280.db2.gz USESTDVARXKUMT-HNNXBMFYSA-N 0 0 357.435 3.706 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)NC[C@@H](O)c1ccc2ccccc2c1 ZINC000088363947 946707852 /nfs/dbraw/zinc/70/78/52/946707852.db2.gz FJJSHWWHASQXIA-HXUWFJFHSA-N 0 0 364.401 3.530 20 5 FHBDRN COC(C)(C)C[C@@H](C)NC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000074735643 946717253 /nfs/dbraw/zinc/71/72/53/946717253.db2.gz HZYUOWJAYHFJNB-CQSZACIVSA-N 0 0 351.447 3.718 20 5 FHBDRN Cc1nc2ccc(N[C@H]3CCN(c4cccc([N+](=O)[O-])c4)C3=O)cc2s1 ZINC000261410291 946745720 /nfs/dbraw/zinc/74/57/20/946745720.db2.gz SDAZQMBNLFPVAH-INIZCTEOSA-N 0 0 368.418 3.730 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)C[C@@H]2CC(=O)Nc3ccccc32)cc1[N+](=O)[O-] ZINC001126610695 946750740 /nfs/dbraw/zinc/75/07/40/946750740.db2.gz HKVMZFJCHYWUOY-UKRRQHHQSA-N 0 0 367.405 3.597 20 5 FHBDRN C[C@H](NC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)[C@H]1CCCOC1 ZINC000475232587 946755043 /nfs/dbraw/zinc/75/50/43/946755043.db2.gz JVEYTUHYOORJPE-UWVGGRQHSA-N 0 0 361.320 3.550 20 5 FHBDRN CCc1n[nH]c(C(=O)N[C@H](CC2CCCC2)c2ccccc2)c1[N+](=O)[O-] ZINC000444334700 946766370 /nfs/dbraw/zinc/76/63/70/946766370.db2.gz IEMYFBXCTFZYPS-MRXNPFEDSA-N 0 0 356.426 3.932 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)N[C@@H]1CCCc2c(F)cccc21 ZINC000458875285 946767950 /nfs/dbraw/zinc/76/79/50/946767950.db2.gz DYIBQYMIJSQZQQ-GOSISDBHSA-N 0 0 371.412 3.995 20 5 FHBDRN CCOC(=O)c1ccnc(N[C@@H]2CCOc3c(CC)cccc32)c1[N+](=O)[O-] ZINC000523111342 946775058 /nfs/dbraw/zinc/77/50/58/946775058.db2.gz NIBUOPMTVDHGMY-OAHLLOKOSA-N 0 0 371.393 3.665 20 5 FHBDRN Cc1cc(C)cc(OCCCn2cnc(-c3cccc([N+](=O)[O-])c3)n2)c1 ZINC000523108966 946777211 /nfs/dbraw/zinc/77/72/11/946777211.db2.gz NYBSMWQRVYTZGI-UHFFFAOYSA-N 0 0 352.394 3.939 20 5 FHBDRN Cc1nc(NC(=O)CCc2ccccc2Br)ccc1[N+](=O)[O-] ZINC000134027730 946777954 /nfs/dbraw/zinc/77/79/54/946777954.db2.gz MCAUCEVDKHETOP-UHFFFAOYSA-N 0 0 364.199 3.632 20 5 FHBDRN CCC(C)(C)[C@H]1CCCN1C(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000134028797 946783083 /nfs/dbraw/zinc/78/30/83/946783083.db2.gz QFSRFVCSAWKWKU-QGZVFWFLSA-N 0 0 356.426 3.821 20 5 FHBDRN C[C@@H]1CN(Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C[C@H](C2CC2)O1 ZINC000475276694 946793504 /nfs/dbraw/zinc/79/35/04/946793504.db2.gz BLWWOKZEPNDUMW-SJKOYZFVSA-N 0 0 359.451 3.718 20 5 FHBDRN CCSCc1cc(C(=O)Nc2ccc3cc([N+](=O)[O-])ccc3n2)no1 ZINC000186298351 946794531 /nfs/dbraw/zinc/79/45/31/946794531.db2.gz CHMJJNGJCPPQSL-UHFFFAOYSA-N 0 0 358.379 3.636 20 5 FHBDRN C[C@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000475278424 946796593 /nfs/dbraw/zinc/79/65/93/946796593.db2.gz WARHBNODKHYXQT-XHDPSFHLSA-N 0 0 368.359 3.768 20 5 FHBDRN CCOC(=O)c1ccnc(N(Cc2ccc(F)cc2)CC2CC2)c1[N+](=O)[O-] ZINC000523115099 946802712 /nfs/dbraw/zinc/80/27/12/946802712.db2.gz RSDVUELDWHVQJB-UHFFFAOYSA-N 0 0 373.384 3.722 20 5 FHBDRN Cc1ccccc1[C@H](NC(=O)C(=O)Nc1ccc(C)c([N+](=O)[O-])c1)C(C)C ZINC000112221720 946805609 /nfs/dbraw/zinc/80/56/09/946805609.db2.gz COWLWBQRWIGAJK-GOSISDBHSA-N 0 0 369.421 3.664 20 5 FHBDRN CSCCCCCNC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000444335069 946820624 /nfs/dbraw/zinc/82/06/24/946820624.db2.gz FNGWCSGLRZJDKU-UHFFFAOYSA-N 0 0 354.475 3.944 20 5 FHBDRN COc1ccccc1[C@H]1CCCN1C(=O)c1cccc([N+](=O)[O-])c1OC ZINC000475597747 946836063 /nfs/dbraw/zinc/83/60/63/946836063.db2.gz AXHNDAPKFOXFLA-OAHLLOKOSA-N 0 0 356.378 3.589 20 5 FHBDRN O=C(COc1ccccc1Cl)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186309820 946840852 /nfs/dbraw/zinc/84/08/52/946840852.db2.gz IBJSQNKCCPXIND-UHFFFAOYSA-N 0 0 355.177 3.597 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1SCCc2ccccc21 ZINC000186308720 946841028 /nfs/dbraw/zinc/84/10/28/946841028.db2.gz NTPMWIWBVBRWIO-MRXNPFEDSA-N 0 0 362.838 3.895 20 5 FHBDRN C[C@@H]1CC[C@H](CNC(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC000475303773 946845512 /nfs/dbraw/zinc/84/55/12/946845512.db2.gz NYPGUATZSJGVQV-CABCVRRESA-N 0 0 361.442 3.584 20 5 FHBDRN CC1(C(=O)OCc2c(Br)cccc2[N+](=O)[O-])CCC(=O)CC1 ZINC000909384468 946852160 /nfs/dbraw/zinc/85/21/60/946852160.db2.gz YEUVWNPMVREDSB-UHFFFAOYSA-N 0 0 370.199 3.550 20 5 FHBDRN COc1cccc(C2(NC(=O)N[C@@H](C)c3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000458883526 946876370 /nfs/dbraw/zinc/87/63/70/946876370.db2.gz BVMPPBOUZTWJCI-ZDUSSCGKSA-N 0 0 355.394 3.653 20 5 FHBDRN CC(C)n1cc([C@H](C)NCc2coc(-c3ccc([N+](=O)[O-])cc3)n2)cn1 ZINC000541645422 946878064 /nfs/dbraw/zinc/87/80/64/946878064.db2.gz FIQFTXBIASCKOE-ZDUSSCGKSA-N 0 0 355.398 3.878 20 5 FHBDRN COc1cccc(C(=O)Nc2cnn(CC(C)C)c2C(C)C)c1[N+](=O)[O-] ZINC000444336910 946894992 /nfs/dbraw/zinc/89/49/92/946894992.db2.gz BMSPXQOLANMYNY-UHFFFAOYSA-N 0 0 360.414 3.832 20 5 FHBDRN COC(=O)[C@@](C)(Cc1ccc(O)cc1)Nc1c(C)cc(C)c([N+](=O)[O-])c1C ZINC001168080314 946908124 /nfs/dbraw/zinc/90/81/24/946908124.db2.gz JWNFWOWIDSANDS-HXUWFJFHSA-N 0 0 372.421 3.812 20 5 FHBDRN Cc1nn(CCC(=O)N(C)[C@@H](c2ccccc2)C(C)C)c(C)c1[N+](=O)[O-] ZINC000112588502 946916489 /nfs/dbraw/zinc/91/64/89/946916489.db2.gz UZSDCRHSGJRYTH-GOSISDBHSA-N 0 0 358.442 3.654 20 5 FHBDRN COc1ccc(Nc2ncc(Br)cc2[N+](=O)[O-])cc1OC ZINC000048759836 946916601 /nfs/dbraw/zinc/91/66/01/946916601.db2.gz UZOZFGOEUALYAT-UHFFFAOYSA-N 0 0 354.160 3.513 20 5 FHBDRN COc1ccc(CCCC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000186331309 946919210 /nfs/dbraw/zinc/91/92/10/946919210.db2.gz RHDVMWCNOXIAHH-UHFFFAOYSA-N 0 0 362.813 3.896 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1SCCc2sccc21 ZINC000186332134 946919806 /nfs/dbraw/zinc/91/98/06/946919806.db2.gz DVAXPMBTCHJYJK-CQSZACIVSA-N 0 0 368.867 3.957 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@H]1SCCc2sccc21 ZINC000186332118 946919877 /nfs/dbraw/zinc/91/98/77/946919877.db2.gz DVAXPMBTCHJYJK-AWEZNQCLSA-N 0 0 368.867 3.957 20 5 FHBDRN O=C(C[C@H]1CCOc2ccccc21)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186331845 946920356 /nfs/dbraw/zinc/92/03/56/946920356.db2.gz NEPVCSQCCWWRGW-GFCCVEGCSA-N 0 0 360.797 3.821 20 5 FHBDRN O=C1CCCC(=O)N1c1cccc(NC/C=C/c2ccccc2[N+](=O)[O-])c1 ZINC000475350840 946924950 /nfs/dbraw/zinc/92/49/50/946924950.db2.gz ZHADULPRDVHZMC-FNORWQNLSA-N 0 0 365.389 3.764 20 5 FHBDRN CCOC(=O)C1CCC(N(CC)C(=O)c2cc([N+](=O)[O-])c(C)s2)CC1 ZINC000511906047 946928288 /nfs/dbraw/zinc/92/82/88/946928288.db2.gz SFFVXYKVUYCAJB-UHFFFAOYSA-N 0 0 368.455 3.549 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)NC1(c2cccc(F)c2)CC1 ZINC000128512131 946934369 /nfs/dbraw/zinc/93/43/69/946934369.db2.gz FJRGHJSNCDWSBG-UHFFFAOYSA-N 0 0 357.385 3.732 20 5 FHBDRN COc1c(C(=O)N[C@H](c2ccccc2)c2ccncc2)cccc1[N+](=O)[O-] ZINC000475605189 946941933 /nfs/dbraw/zinc/94/19/33/946941933.db2.gz XEZQQCVIQNGLDD-GOSISDBHSA-N 0 0 363.373 3.518 20 5 FHBDRN Cc1nc(CN(C)c2cc(Cl)c(C(F)(F)F)cc2[N+](=O)[O-])no1 ZINC000302015077 946944006 /nfs/dbraw/zinc/94/40/06/946944006.db2.gz FEIRKCHGMDACEH-UHFFFAOYSA-N 0 0 350.684 3.595 20 5 FHBDRN C[C@H]1CCN(C(=O)CSc2ccc([N+](=O)[O-])cc2)c2c(O)cccc21 ZINC000186334323 946948594 /nfs/dbraw/zinc/94/85/94/946948594.db2.gz AFKOUXWETVCEBL-LBPRGKRZSA-N 0 0 358.419 3.933 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1Br ZINC000186336376 946950179 /nfs/dbraw/zinc/95/01/79/946950179.db2.gz NRQBXFNTYAZADV-UHFFFAOYSA-N 0 0 369.602 3.941 20 5 FHBDRN O=C(Nc1nc(-c2ccc3ccccc3c2)cs1)c1n[nH]cc1[N+](=O)[O-] ZINC000126758723 946954868 /nfs/dbraw/zinc/95/48/68/946954868.db2.gz XXKBQZCQGDLALX-UHFFFAOYSA-N 0 0 365.374 3.847 20 5 FHBDRN C[C@H](NS(=O)(=O)c1ccc([N+](=O)[O-])s1)c1cccc2ccccc21 ZINC000523165912 946963810 /nfs/dbraw/zinc/96/38/10/946963810.db2.gz GOWDHVGAFPIZOO-NSHDSACASA-N 0 0 362.432 3.849 20 5 FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@H](C(C)C)C1 ZINC000444524102 946974047 /nfs/dbraw/zinc/97/40/47/946974047.db2.gz PHFNQEVJZQDHLM-AWEZNQCLSA-N 0 0 366.483 3.842 20 5 FHBDRN O=C(c1cc(Cl)c(F)c([N+](=O)[O-])c1)N1CCC[C@@]2(CCSC2)C1 ZINC000909389167 946987018 /nfs/dbraw/zinc/98/70/18/946987018.db2.gz NCBHJPYRVLINIP-OAHLLOKOSA-N 0 0 358.822 3.747 20 5 FHBDRN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNCc1nc2c(s1)COCC2 ZINC000897238192 946997857 /nfs/dbraw/zinc/99/78/57/946997857.db2.gz NBVOHGBVIHQVNL-UHFFFAOYSA-N 0 0 374.249 3.721 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1N1CCC(c2nc(-c3ccccn3)no2)CC1 ZINC000112965840 946998949 /nfs/dbraw/zinc/99/89/49/946998949.db2.gz WGTGGFATAUNJFS-UHFFFAOYSA-N 0 0 365.393 3.732 20 5 FHBDRN CC[C@H](C)[C@H](NC(=O)CCCNc1ccc([N+](=O)[O-])cc1)C(F)(F)F ZINC000444560408 947001627 /nfs/dbraw/zinc/00/16/27/947001627.db2.gz VMKPVUVYPRBWFR-NHYWBVRUSA-N 0 0 361.364 3.880 20 5 FHBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N2CC3(CCC3)[C@H]2c2ccccc2)c1 ZINC000432260173 947004613 /nfs/dbraw/zinc/00/46/13/947004613.db2.gz SMPDDMGIEXYGTJ-QGZVFWFLSA-N 0 0 358.419 3.511 20 5 FHBDRN CO[C@@H]1CCOc2c(NC(=O)C(C)(C)c3ccccc3[N+](=O)[O-])cccc21 ZINC000509630182 947005479 /nfs/dbraw/zinc/00/54/79/947005479.db2.gz AXRLTIVDEMIYPI-QGZVFWFLSA-N 0 0 370.405 3.981 20 5 FHBDRN C[C@@H]1N(c2ccc(Br)cc2[N+](=O)[O-])CCC12CCOCC2 ZINC000408196715 947006487 /nfs/dbraw/zinc/00/64/87/947006487.db2.gz FAIAVQLSGWZVRH-NSHDSACASA-N 0 0 355.232 3.753 20 5 FHBDRN Cc1nn(CCC(=O)Nc2cccc(OC3CCCC3)c2)c(C)c1[N+](=O)[O-] ZINC000523223371 947007472 /nfs/dbraw/zinc/00/74/72/947007472.db2.gz YYQOWHMJWUDSNP-UHFFFAOYSA-N 0 0 372.425 3.758 20 5 FHBDRN CCCN([C@@H]1CCc2ccccc2C1)S(=O)(=O)c1ccccc1[N+](=O)[O-] ZINC000511924732 947010646 /nfs/dbraw/zinc/01/06/46/947010646.db2.gz FOMRCPOBJRFNMY-QGZVFWFLSA-N 0 0 374.462 3.553 20 5 FHBDRN CCN(Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)Cc1ccc(OC)cc1OC ZINC000444592676 947017679 /nfs/dbraw/zinc/01/76/79/947017679.db2.gz DDTFSCIKRQPCEN-UHFFFAOYSA-N 0 0 370.409 3.510 20 5 FHBDRN CC(C)N(Cc1nncn1-c1ccccc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000444594240 947020158 /nfs/dbraw/zinc/02/01/58/947020158.db2.gz SBHWFRWFCOLYAH-UHFFFAOYSA-N 0 0 351.410 3.586 20 5 FHBDRN CC[C@H](C[C@@H](C)CO)NC(=O)c1cc(F)c(Cl)c([N+](=O)[O-])c1Cl ZINC000897245282 947022965 /nfs/dbraw/zinc/02/29/65/947022965.db2.gz UPIFKNLCOVGKLR-HTQZYQBOSA-N 0 0 367.204 3.568 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N1C[C@@H](C)C[C@H]1c1cccnc1 ZINC000186354219 947041671 /nfs/dbraw/zinc/04/16/71/947041671.db2.gz MOMFNWALLQKRKR-LRDDRELGSA-N 0 0 356.382 3.613 20 5 FHBDRN Cc1c(NC(=O)C(=O)Nc2csc3ccccc23)cccc1[N+](=O)[O-] ZINC000440484842 947045494 /nfs/dbraw/zinc/04/54/94/947045494.db2.gz IIAITQRYEHGMBL-UHFFFAOYSA-N 0 0 355.375 3.695 20 5 FHBDRN COc1ccc(CSCC(=O)N(C)c2ccccc2F)cc1[N+](=O)[O-] ZINC000523279802 947047702 /nfs/dbraw/zinc/04/77/02/947047702.db2.gz NCJNOQCKBQZGAI-UHFFFAOYSA-N 0 0 364.398 3.639 20 5 FHBDRN C[C@@H](CC(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccc(F)cc1F ZINC000444637089 947048925 /nfs/dbraw/zinc/04/89/25/947048925.db2.gz PMAWTJLMOOXPGV-JTQLQIEISA-N 0 0 374.347 3.559 20 5 FHBDRN CC(C)[C@@H](CC1CCCC1)C(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444638044 947049818 /nfs/dbraw/zinc/04/98/18/947049818.db2.gz UCYKLWWWDNBPSR-OAHLLOKOSA-N 0 0 358.442 3.940 20 5 FHBDRN CNc1ccc(C(=O)Nc2cc(C)nn2-c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000523282983 947050759 /nfs/dbraw/zinc/05/07/59/947050759.db2.gz MODAPVKRFYYESW-UHFFFAOYSA-N 0 0 369.356 3.522 20 5 FHBDRN O=C(Nc1ccc2c(c1)OCO2)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000123550659 947054188 /nfs/dbraw/zinc/05/41/88/947054188.db2.gz RBLNUDBTVKRSJC-UHFFFAOYSA-N 0 0 354.240 3.595 20 5 FHBDRN O=C(N[C@H](c1ccccc1)[C@H]1CCCO1)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000523272992 947059179 /nfs/dbraw/zinc/05/91/79/947059179.db2.gz OILQDIKLASANKT-IEBWSBKVSA-N 0 0 366.373 3.991 20 5 FHBDRN O=C(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@H]1C[C@H]1c1cccc(Cl)c1 ZINC000444632431 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ZINC000759932131 947522517 /nfs/dbraw/zinc/52/25/17/947522517.db2.gz MRKHGDYHBUPQCD-HOTGVXAUSA-N 0 0 360.414 3.570 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])Nc1ccnc(Sc2ccccn2)c1 ZINC000523701340 947526868 /nfs/dbraw/zinc/52/68/68/947526868.db2.gz ZVLUAKHOGQXLLW-UHFFFAOYSA-N 0 0 366.402 3.717 20 5 FHBDRN C[C@H](Oc1ccc(C(F)(F)F)cc1)C(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000188324741 947528361 /nfs/dbraw/zinc/52/83/61/947528361.db2.gz CJWIUPLEXAAAHD-NSHDSACASA-N 0 0 368.311 3.697 20 5 FHBDRN O=[N+]([O-])c1cccc(/C=C/c2nc(-c3cncc(Br)c3)no2)c1 ZINC000546315968 947540485 /nfs/dbraw/zinc/54/04/85/947540485.db2.gz HPGPKXHMLHGIDJ-SNAWJCMRSA-N 0 0 373.166 3.973 20 5 FHBDRN COc1cccc(NC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)c1O ZINC000445159203 947554132 /nfs/dbraw/zinc/55/41/32/947554132.db2.gz NRTUGQKYHXWCPV-UHFFFAOYSA-N 0 0 360.369 3.648 20 5 FHBDRN Cc1cccc(CCNC(=O)c2sc(Br)cc2[N+](=O)[O-])c1 ZINC000445170802 947562010 /nfs/dbraw/zinc/56/20/10/947562010.db2.gz DJEDLMFSDCYQLM-UHFFFAOYSA-N 0 0 369.240 3.700 20 5 FHBDRN O=C(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)Nc1ccc2ccoc2c1 ZINC000445169244 947566303 /nfs/dbraw/zinc/56/63/03/947566303.db2.gz WLMIBJGLEJVIFS-UHFFFAOYSA-N 0 0 351.322 3.539 20 5 FHBDRN CC[C@H](Cc1ccccc1)NC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000087085277 947569866 /nfs/dbraw/zinc/56/98/66/947569866.db2.gz WQNHSUWAJBTASW-GOSISDBHSA-N 0 0 353.422 3.684 20 5 FHBDRN Cc1cc(S(=O)(=O)N(C)[C@H](C)c2c(F)cccc2F)ccc1[N+](=O)[O-] ZINC000523758873 947577566 /nfs/dbraw/zinc/57/75/66/947577566.db2.gz VHKFTEORDROPTQ-LLVKDONJSA-N 0 0 370.377 3.563 20 5 FHBDRN O=C(c1sc(Br)cc1[N+](=O)[O-])N1Cc2ccccc2C1 ZINC000445186182 947578563 /nfs/dbraw/zinc/57/85/63/947578563.db2.gz RMBQJILHLBSSCH-UHFFFAOYSA-N 0 0 353.197 3.575 20 5 FHBDRN C[C@H]1C[C@@H](c2ccccc2)CN1c1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-] ZINC000523751784 947586888 /nfs/dbraw/zinc/58/68/88/947586888.db2.gz SKJXNOUBUYDPCQ-WMLDXEAASA-N 0 0 365.433 3.869 20 5 FHBDRN CCC1(CC)CN(c2nnc(-c3ccc([N+](=O)[O-])cc3)n2C)CCS1 ZINC000508520634 947587950 /nfs/dbraw/zinc/58/79/50/947587950.db2.gz LIRAHPPCSGTXJS-UHFFFAOYSA-N 0 0 361.471 3.502 20 5 FHBDRN Cc1ncsc1CN(C)C(=O)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000445198772 947596937 /nfs/dbraw/zinc/59/69/37/947596937.db2.gz WQTPVEYAHVFMCF-UHFFFAOYSA-N 0 0 363.442 3.718 20 5 FHBDRN COCc1ccccc1NC(=O)c1sc(Br)cc1[N+](=O)[O-] ZINC000445202265 947599370 /nfs/dbraw/zinc/59/93/70/947599370.db2.gz FBVQYQKCBQDMCC-UHFFFAOYSA-N 0 0 371.212 3.818 20 5 FHBDRN Nc1ccc(-c2noc(-c3ccccc3C(F)(F)F)n2)cc1[N+](=O)[O-] ZINC000445215081 947615719 /nfs/dbraw/zinc/61/57/19/947615719.db2.gz ZJPOYTITMOGNRS-UHFFFAOYSA-N 0 0 350.256 3.913 20 5 FHBDRN Cn1c(-c2ccc([N+](=O)[O-])cc2)nnc1N1CC[C@H](c2ccc(F)cc2)C1 ZINC000508523304 947617702 /nfs/dbraw/zinc/61/77/02/947617702.db2.gz DEQNKQOCPMERIJ-HNNXBMFYSA-N 0 0 367.384 3.523 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N(Cc1ccco1)Cc1cccnc1 ZINC000087085536 947626286 /nfs/dbraw/zinc/62/62/86/947626286.db2.gz QXWOIECNCXIURW-UHFFFAOYSA-N 0 0 365.389 3.744 20 5 FHBDRN O=C(N[C@@H]1CCc2ccccc2C1)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000445249259 947645532 /nfs/dbraw/zinc/64/55/32/947645532.db2.gz LXGKKADQBRPOHB-QGZVFWFLSA-N 0 0 368.436 3.969 20 5 FHBDRN O=C(Nc1cc(F)cc(F)c1)c1sc(Br)cc1[N+](=O)[O-] ZINC000445250503 947646832 /nfs/dbraw/zinc/64/68/32/947646832.db2.gz OGFXAMPQRSUHTJ-UHFFFAOYSA-N 0 0 363.139 3.949 20 5 FHBDRN CCOc1ccc(C(=O)N[C@H]2C[C@@H]2c2c(F)cccc2F)cc1[N+](=O)[O-] ZINC000523828643 947646903 /nfs/dbraw/zinc/64/69/03/947646903.db2.gz ZDXHTIJUVFKSGU-FZMZJTMJSA-N 0 0 362.332 3.558 20 5 FHBDRN Cc1ccccc1CN(C)C(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C ZINC000125751533 947653512 /nfs/dbraw/zinc/65/35/12/947653512.db2.gz ASPYMAIDOZEXPB-UHFFFAOYSA-N 0 0 357.366 3.700 20 5 FHBDRN Cc1ccc(S(=O)(=O)N2CC3(CCC3)[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000432304415 947660556 /nfs/dbraw/zinc/66/05/56/947660556.db2.gz YWAOONAUKUSDGQ-GOSISDBHSA-N 0 0 372.446 3.819 20 5 FHBDRN NC(=O)CN(CCC1CCCCC1)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000523858164 947667738 /nfs/dbraw/zinc/66/77/38/947667738.db2.gz RJVCXGJRZMAPGN-UHFFFAOYSA-N 0 0 353.850 3.506 20 5 FHBDRN CN(Cc1c(F)cccc1F)C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000511966666 947679226 /nfs/dbraw/zinc/67/92/26/947679226.db2.gz ZSEDWSIGTMOICT-UHFFFAOYSA-N 0 0 372.274 3.747 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1C(=O)O[C@@H](C)C(=O)Nc1cccc(Cl)c1 ZINC000026114541 947680346 /nfs/dbraw/zinc/68/03/46/947680346.db2.gz FUBAPRLWCSINOZ-NSHDSACASA-N 0 0 362.769 3.741 20 5 FHBDRN COc1cc(-c2nc(Cc3ccc4c(c3)CCC4)no2)ccc1[N+](=O)[O-] ZINC000445292115 947684196 /nfs/dbraw/zinc/68/41/96/947684196.db2.gz HKJBKUGCYJDUTO-UHFFFAOYSA-N 0 0 351.362 3.733 20 5 FHBDRN C[C@H](NC(=O)c1csc(-c2ccccn2)n1)c1cccc([N+](=O)[O-])c1 ZINC000149869400 947684615 /nfs/dbraw/zinc/68/46/15/947684615.db2.gz JEZQSWCHEJTRNS-NSHDSACASA-N 0 0 354.391 3.604 20 5 FHBDRN Cc1cccc(CN(C)C(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000518822557 947689787 /nfs/dbraw/zinc/68/97/87/947689787.db2.gz MTOOWDDZVNHBTM-ZDUSSCGKSA-N 0 0 362.813 3.983 20 5 FHBDRN C[C@@H]1CC[C@@H](NC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000523888719 947690239 /nfs/dbraw/zinc/69/02/39/947690239.db2.gz VMBSEUWXSPSQMI-YRGRVCCFSA-N 0 0 354.834 3.958 20 5 FHBDRN CC(C)N(C(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])C1CCOCC1 ZINC000074957608 947696714 /nfs/dbraw/zinc/69/67/14/947696714.db2.gz IOHSUPDDZQUQBD-UHFFFAOYSA-N 0 0 360.332 3.643 20 5 FHBDRN CCCc1ncc(C(=O)O[C@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)s1 ZINC000759936161 947698409 /nfs/dbraw/zinc/69/84/09/947698409.db2.gz SYONHIMOQCQXAK-NEPJUHHUSA-N 0 0 364.427 3.541 20 5 FHBDRN COc1cccc(N2CCc3sc(Br)cc3C2)c1[N+](=O)[O-] ZINC000613884448 947698518 /nfs/dbraw/zinc/69/85/18/947698518.db2.gz AXSZOOFGCRRWHF-UHFFFAOYSA-N 0 0 369.240 3.990 20 5 FHBDRN COC(=O)CCc1ccc(NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000610044763 947701839 /nfs/dbraw/zinc/70/18/39/947701839.db2.gz PWCINWOLGPSXGO-UHFFFAOYSA-N 0 0 370.405 3.617 20 5 FHBDRN C[C@H](Cc1ccccc1)C(=O)O[C@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1 ZINC000759938650 947712785 /nfs/dbraw/zinc/71/27/85/947712785.db2.gz LIRMMXAZSMIUDA-PVAVHDDUSA-N 0 0 357.410 3.697 20 5 FHBDRN C[C@@H](C[C@H](O)c1cccs1)Nc1ncc([N+](=O)[O-])cc1Br ZINC000128872638 947771981 /nfs/dbraw/zinc/77/19/81/947771981.db2.gz LIGKPCMDFKDQDY-KWQFWETISA-N 0 0 372.244 3.738 20 5 FHBDRN C/C(=C/C(=O)N1CCC(n2ccc([N+](=O)[O-])n2)CC1)c1ccccc1Cl ZINC000785338047 947786304 /nfs/dbraw/zinc/78/63/04/947786304.db2.gz XGGLUMXIKGNKSS-SEYXRHQNSA-N 0 0 374.828 3.712 20 5 FHBDRN Cc1ccccc1[C@H]1CN(CCOc2ccc([N+](=O)[O-])cc2)[C@@H](C)CO1 ZINC000441472390 947792007 /nfs/dbraw/zinc/79/20/07/947792007.db2.gz XKPZOYOJJCRRPD-OXJNMPFZSA-N 0 0 356.422 3.744 20 5 FHBDRN O=C(OC[C@@H]1CC1(Cl)Cl)c1cc([N+](=O)[O-])ccc1Br ZINC000725985051 947826646 /nfs/dbraw/zinc/82/66/46/947826646.db2.gz OLNYLFGGZVLXSM-LURJTMIESA-N 0 0 368.998 3.708 20 5 FHBDRN O=[N+]([O-])c1ccc(NC[C@@H]2CN(Cc3ccccc3)CCO2)c(Cl)c1 ZINC000015171191 947842626 /nfs/dbraw/zinc/84/26/26/947842626.db2.gz NCCJPJGXBJHFRT-MRXNPFEDSA-N 0 0 361.829 3.561 20 5 FHBDRN O=[N+]([O-])c1cccc(Cl)c1NCc1ccc(CN2CCOCC2)cc1 ZINC000432313024 947920937 /nfs/dbraw/zinc/92/09/37/947920937.db2.gz LNXUYCKVKOZHEL-UHFFFAOYSA-N 0 0 361.829 3.693 20 5 FHBDRN O=[N+]([O-])c1cccc(Cl)c1NCc1ccccc1CN1CCOCC1 ZINC000432314552 947933063 /nfs/dbraw/zinc/93/30/63/947933063.db2.gz WVGVVCPVTVNMTB-UHFFFAOYSA-N 0 0 361.829 3.693 20 5 FHBDRN CCc1nc([C@H](C)NC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)cs1 ZINC000184625383 947939481 /nfs/dbraw/zinc/93/94/81/947939481.db2.gz MBSPOTBEKJVHAT-VIFPVBQESA-N 0 0 368.846 3.828 20 5 FHBDRN CC(C)(C)OC(=O)[C@@H]1CCN(c2ccc([N+](=O)[O-])c(-c3ccccc3)n2)C1 ZINC000536390610 947958945 /nfs/dbraw/zinc/95/89/45/947958945.db2.gz NCRPKOHDGXKOSE-OAHLLOKOSA-N 0 0 369.421 3.825 20 5 FHBDRN CCCOc1ccc([C@@H](C)Nc2c([N+](=O)[O-])c(CC)nn2C)cc1OC ZINC000094137444 947977223 /nfs/dbraw/zinc/97/72/23/947977223.db2.gz RWAUQDMSUILCSZ-GFCCVEGCSA-N 0 0 362.430 3.861 20 5 FHBDRN O=C(c1cnc(-c2cccnc2)s1)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000536401048 948002297 /nfs/dbraw/zinc/00/22/97/948002297.db2.gz SMAXAPFIEIMHKK-UHFFFAOYSA-N 0 0 366.402 3.706 20 5 FHBDRN CCc1cccc(CC)c1NC(=O)[C@@H](C)Oc1ccc([N+](=O)[O-])c(CO)c1 ZINC000432319485 948005694 /nfs/dbraw/zinc/00/56/94/948005694.db2.gz GPASWCADAHWQME-CYBMUJFWSA-N 0 0 372.421 3.618 20 5 FHBDRN Cc1ccc([C@@H](Cn2ccnc2)NC(=O)c2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000441493539 948022489 /nfs/dbraw/zinc/02/24/89/948022489.db2.gz SZZKDHNNNGIMSK-LJQANCHMSA-N 0 0 364.405 3.579 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N2C[C@@H](C)Cc3ccccc32)cc1OC ZINC000105378456 948022976 /nfs/dbraw/zinc/02/29/76/948022976.db2.gz VQTPAMQYVPNEHK-ZDUSSCGKSA-N 0 0 370.405 3.841 20 5 FHBDRN COc1cccc([C@H]2C[C@H]2C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1 ZINC000129556101 948031452 /nfs/dbraw/zinc/03/14/52/948031452.db2.gz LXHIKZOZTXQTGC-WOJBJXKFSA-N 0 0 366.417 3.898 20 5 FHBDRN CCCC(O)(CCC)CNC(=O)c1cc([N+](=O)[O-])ccc1SCC ZINC000120914490 948041569 /nfs/dbraw/zinc/04/15/69/948041569.db2.gz VKNQZUQKHYSGJM-UHFFFAOYSA-N 0 0 354.472 3.768 20 5 FHBDRN O=[N+]([O-])c1cccc2c(N3CCO[C@H](c4ccccc4F)C3)ccnc21 ZINC000432323112 948057175 /nfs/dbraw/zinc/05/71/75/948057175.db2.gz OWPBPCKZQQERMT-SFHVURJKSA-N 0 0 353.353 3.860 20 5 FHBDRN O=C(CCCc1ccccc1)O[C@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1 ZINC000759945507 948072238 /nfs/dbraw/zinc/07/22/38/948072238.db2.gz HCLMYNKRXXFIKS-IRXDYDNUSA-N 0 0 357.410 3.841 20 5 FHBDRN O=C(CCCc1ccccc1)O[C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000759945506 948072517 /nfs/dbraw/zinc/07/25/17/948072517.db2.gz HCLMYNKRXXFIKS-IAGOWNOFSA-N 0 0 357.410 3.841 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])c2cccnc12)N1Cc2ccccc2C2(CC2)C1 ZINC000184659941 948086993 /nfs/dbraw/zinc/08/69/93/948086993.db2.gz BEHXOBWJYMSZSB-UHFFFAOYSA-N 0 0 359.385 3.831 20 5 FHBDRN CCO[C@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2Cl)C12CCCC2 ZINC000075357046 948089701 /nfs/dbraw/zinc/08/97/01/948089701.db2.gz FDWBAONFJNTMBY-CABCVRRESA-N 0 0 352.818 3.716 20 5 FHBDRN C[C@@H]1CC(=O)Oc2cc(OC(=O)/C=C\c3ccc([N+](=O)[O-])cc3)ccc21 ZINC000785360568 948099913 /nfs/dbraw/zinc/09/99/13/948099913.db2.gz CBSJEAQIFBCRET-TWLAMCEISA-N 0 0 353.330 3.626 20 5 FHBDRN CCOCc1ccc(NC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)cc1 ZINC000075358075 948116577 /nfs/dbraw/zinc/11/65/77/948116577.db2.gz VQUVJYPRLFSDPJ-UHFFFAOYSA-N 0 0 366.377 3.569 20 5 FHBDRN C[C@H]1CC(=O)Oc2cc(OC(=O)c3cc(F)c([N+](=O)[O-])cc3F)ccc21 ZINC000785363741 948132302 /nfs/dbraw/zinc/13/23/02/948132302.db2.gz NAIYXKOEUHRBGO-QMMMGPOBSA-N 0 0 363.272 3.505 20 5 FHBDRN COc1ccc(CNc2ccnc3c2cccc3[N+](=O)[O-])c(OC)c1OC ZINC000432337501 948151180 /nfs/dbraw/zinc/15/11/80/948151180.db2.gz RFOQGPIMSSKYPJ-UHFFFAOYSA-N 0 0 369.377 3.781 20 5 FHBDRN COc1cc(C(=O)N(C)C/C(C)=C\c2ccccc2)c([N+](=O)[O-])cc1OC ZINC000427589768 948164555 /nfs/dbraw/zinc/16/45/55/948164555.db2.gz UAABIAANUUOCAD-UVTDQMKNSA-N 0 0 370.405 3.788 20 5 FHBDRN C/C=C/c1ccc(OCC(=O)Nc2cc([N+](=O)[O-])ccc2OC)c(OC)c1 ZINC000019159718 948164633 /nfs/dbraw/zinc/16/46/33/948164633.db2.gz MWBVUCAJERONIQ-SNAWJCMRSA-N 0 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ZINC000585715186 948225752 /nfs/dbraw/zinc/22/57/52/948225752.db2.gz GMQJDDOZYHJOAB-UHFFFAOYSA-N 0 0 372.164 3.566 20 5 FHBDRN Cc1cc(NC(=O)CSc2ccc([N+](=O)[O-])cc2)n(-c2ccccc2)n1 ZINC000585712865 948230169 /nfs/dbraw/zinc/23/01/69/948230169.db2.gz LHFFJGPLYJFVPZ-UHFFFAOYSA-N 0 0 368.418 3.820 20 5 FHBDRN O=C(COc1ccsc1Cl)Nc1ccc([N+](=O)[O-])c2ncccc12 ZINC000585747160 948251249 /nfs/dbraw/zinc/25/12/49/948251249.db2.gz QROOXNKNUUSYJV-UHFFFAOYSA-N 0 0 363.782 3.875 20 5 FHBDRN COCc1cccc2sc(NC(=O)c3cccc([N+](=O)[O-])c3C)nc21 ZINC000520539322 948254785 /nfs/dbraw/zinc/25/47/85/948254785.db2.gz ADNQDOXVVBADOY-UHFFFAOYSA-N 0 0 357.391 3.912 20 5 FHBDRN Cc1cc(CNC(=O)c2cc([N+](=O)[O-])ccc2SC2CCCC2)n(C)n1 ZINC000585749686 948256235 /nfs/dbraw/zinc/25/62/35/948256235.db2.gz VUUPUHBRCUEAFD-UHFFFAOYSA-N 0 0 374.466 3.601 20 5 FHBDRN CCc1ccc([C@@H]2CCN(C(=O)Cc3ccc(OC)c([N+](=O)[O-])c3)C2)cc1 ZINC000520554975 948266396 /nfs/dbraw/zinc/26/63/96/948266396.db2.gz LIYHDBGOTAHBMR-GOSISDBHSA-N 0 0 368.433 3.724 20 5 FHBDRN CC(C)c1nc(C(=O)O[C@@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)cs1 ZINC000759955421 948281051 /nfs/dbraw/zinc/28/10/51/948281051.db2.gz XSBXEDVVOLUVBB-CHWSQXEVSA-N 0 0 364.427 3.712 20 5 FHBDRN CCOC(=O)c1cc(C(=O)N2CCC[C@@H]2C(C)(C)CC)cc([N+](=O)[O-])c1 ZINC000441580974 948295906 /nfs/dbraw/zinc/29/59/06/948295906.db2.gz KFLOYWNRZWADQA-MRXNPFEDSA-N 0 0 362.426 3.812 20 5 FHBDRN COc1cccc(C(C)(C)CNC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000441588277 948324199 /nfs/dbraw/zinc/32/41/99/948324199.db2.gz KUIYNFOGYURNCN-UHFFFAOYSA-N 0 0 370.449 3.975 20 5 FHBDRN O=C(NCCNc1ccc2ccccc2n1)c1ccc([N+](=O)[O-])cc1Cl ZINC000125965296 948330077 /nfs/dbraw/zinc/33/00/77/948330077.db2.gz JYKJRIDVSOYFCQ-UHFFFAOYSA-N 0 0 370.796 3.638 20 5 FHBDRN CCN(CC)C(=O)[C@@H]1CCC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000512067102 948351389 /nfs/dbraw/zinc/35/13/89/948351389.db2.gz KOAYHMMKCYRLLJ-SFHVURJKSA-N 0 0 371.437 3.688 20 5 FHBDRN CC(C)(C(=O)Nc1nnc(-c2ccco2)s1)c1ccccc1[N+](=O)[O-] ZINC000432411054 948356691 /nfs/dbraw/zinc/35/66/91/948356691.db2.gz UYUMJPDGTXKPKI-UHFFFAOYSA-N 0 0 358.379 3.623 20 5 FHBDRN COc1cc(C(=O)Nc2nc3cc(F)c(F)cc3s2)ccc1[N+](=O)[O-] ZINC000512078501 948372852 /nfs/dbraw/zinc/37/28/52/948372852.db2.gz VFFKJQXLYWYVPV-UHFFFAOYSA-N 0 0 365.317 3.744 20 5 FHBDRN COC1CCC(CC(=O)N(C)Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000126839019 948378296 /nfs/dbraw/zinc/37/82/96/948378296.db2.gz DPEIZEJCISNYPC-UHFFFAOYSA-N 0 0 354.834 3.802 20 5 FHBDRN CC(=O)c1ccc2c(c1)oc(=O)n2Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000585814417 948380715 /nfs/dbraw/zinc/38/07/15/948380715.db2.gz PLIVWCYKXBCYEI-UHFFFAOYSA-N 0 0 370.361 3.541 20 5 FHBDRN O=[N+]([O-])c1ccccc1OCCN1CCO[C@@H](c2ccccc2Cl)C1 ZINC000507785663 948391330 /nfs/dbraw/zinc/39/13/30/948391330.db2.gz DPQDVZHUDZZWMF-GOSISDBHSA-N 0 0 362.813 3.701 20 5 FHBDRN Cc1cc(C(=O)NCc2cccc(Cl)c2Cl)c(N)c([N+](=O)[O-])c1 ZINC000729518073 948407064 /nfs/dbraw/zinc/40/70/64/948407064.db2.gz CJYDHKIHCFEARI-UHFFFAOYSA-N 0 0 354.193 3.722 20 5 FHBDRN C[C@@H]1CN(C)[C@@H](C)CN1C(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 ZINC000512101890 948418783 /nfs/dbraw/zinc/41/87/83/948418783.db2.gz VTRKPMVQFRRXRA-LSDHHAIUSA-N 0 0 369.421 3.552 20 5 FHBDRN C[C@H](NC(=O)[C@H]1C[C@@H]1c1cc(F)c(F)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000184774339 948426507 /nfs/dbraw/zinc/42/65/07/948426507.db2.gz NUJYVILWAHAFAT-FZZIBODNSA-N 0 0 364.323 3.993 20 5 FHBDRN CC(C)Oc1cc(O)ccc1NC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000432443716 948432777 /nfs/dbraw/zinc/43/27/77/948432777.db2.gz APQQWOBSONGZJG-UHFFFAOYSA-N 0 0 369.377 3.681 20 5 FHBDRN Cc1cc(Br)cc(C)c1NC(=O)c1ccc([N+](=O)[O-])n1C ZINC000107236567 948432911 /nfs/dbraw/zinc/43/29/11/948432911.db2.gz KSDDBLYGVRNGCM-UHFFFAOYSA-N 0 0 352.188 3.565 20 5 FHBDRN CC(C)CCSc1ccc(C(=O)N[C@H]2CCOC[C@@H]2C)cc1[N+](=O)[O-] ZINC000432446461 948440370 /nfs/dbraw/zinc/44/03/70/948440370.db2.gz JRRQPEQOJVFHJO-ZFWWWQNUSA-N 0 0 366.483 3.888 20 5 FHBDRN C[C@@H](CCNC(=O)N(C)CCc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000512112171 948448381 /nfs/dbraw/zinc/44/83/81/948448381.db2.gz MQLDYDHENSGHMQ-INIZCTEOSA-N 0 0 355.438 3.973 20 5 FHBDRN CCc1noc(CC)c1CNC(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000087124835 948448646 /nfs/dbraw/zinc/44/86/46/948448646.db2.gz ORVNUYRBQXBCLJ-UHFFFAOYSA-N 0 0 374.441 3.530 20 5 FHBDRN COC(=O)[C@@H](NCc1csc([N+](=O)[O-])c1)c1ccc2ccccc2c1 ZINC000125985737 948457248 /nfs/dbraw/zinc/45/72/48/948457248.db2.gz MMWXDVVLXURTPA-KRWDZBQOSA-N 0 0 356.403 3.813 20 5 FHBDRN Cc1ccc2c(c1)CC[C@H]2NC(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000512120093 948467607 /nfs/dbraw/zinc/46/76/07/948467607.db2.gz FBJHXRSYFXLSPL-LJQANCHMSA-N 0 0 353.422 3.775 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)Nc1cc(OC)c(C)c(OC)c1 ZINC000432456854 948472909 /nfs/dbraw/zinc/47/29/09/948472909.db2.gz ZNNFDHHFGOVRKP-UHFFFAOYSA-N 0 0 361.354 3.573 20 5 FHBDRN Cc1ccc(-c2nnco2)cc1NC(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000087125647 948476642 /nfs/dbraw/zinc/47/66/42/948476642.db2.gz KYDYENZBWACHDH-UHFFFAOYSA-N 0 0 352.350 3.525 20 5 FHBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)c1ccc2c(c1)COC(=O)N2 ZINC001126318006 948480362 /nfs/dbraw/zinc/48/03/62/948480362.db2.gz JSXNXWGYICJAMR-UHFFFAOYSA-N 0 0 361.741 3.871 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N(C)Cc1cnc(C(C)C)nc1 ZINC000441664872 948489677 /nfs/dbraw/zinc/48/96/77/948489677.db2.gz DAOJRCXHNLQQIF-UHFFFAOYSA-N 0 0 357.414 3.789 20 5 FHBDRN Cc1cc(C)n(-c2ccc(CC(=O)N(C)c3ccc([N+](=O)[O-])cc3)cc2)n1 ZINC000078803547 948507365 /nfs/dbraw/zinc/50/73/65/948507365.db2.gz VANWXPOKZILLGR-UHFFFAOYSA-N 0 0 364.405 3.603 20 5 FHBDRN C[C@@H]1CN(C(=O)COc2ccc([N+](=O)[O-])c3cccnc23)c2ccccc21 ZINC000432473148 948526675 /nfs/dbraw/zinc/52/66/75/948526675.db2.gz IYONGRSNCNJHRU-CYBMUJFWSA-N 0 0 363.373 3.672 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1)N(CCC(F)(F)F)CC(F)(F)F ZINC000279122132 948526933 /nfs/dbraw/zinc/52/69/33/948526933.db2.gz LSNNRZUXTFMPAV-UHFFFAOYSA-N 0 0 359.226 3.943 20 5 FHBDRN Cc1c(Br)cc(C(=O)N2CC[C@H]3CCC[C@@H]32)cc1[N+](=O)[O-] ZINC000614644622 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FHBDRN COC(=O)[C@H](N[C@@H](C)CCc1ccccc1[N+](=O)[O-])c1ccccc1F ZINC000614655187 948625904 /nfs/dbraw/zinc/62/59/04/948625904.db2.gz YYSNCPKGQIGFSU-SCLBCKFNSA-N 0 0 360.385 3.559 20 5 FHBDRN Cc1c(N[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)cnn1CCC(C)C ZINC000126856509 948636034 /nfs/dbraw/zinc/63/60/34/948636034.db2.gz GWBQOWWVWDOYMT-CYBMUJFWSA-N 0 0 359.430 3.585 20 5 FHBDRN C[C@H]1c2ccsc2CCN1C(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000520714810 948668342 /nfs/dbraw/zinc/66/83/42/948668342.db2.gz MUYLYSRUZWBFIF-LBPRGKRZSA-N 0 0 368.418 3.602 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)NCCc2c[nH]c3cc(F)ccc23)c1 ZINC000050766687 948697281 /nfs/dbraw/zinc/69/72/81/948697281.db2.gz CTVSPKDBCJZUID-UHFFFAOYSA-N 0 0 373.409 3.910 20 5 FHBDRN Cc1sc(C(=O)Nc2ccc(OC[C@@H]3CCCO3)cc2)cc1[N+](=O)[O-] ZINC000046500695 948700677 /nfs/dbraw/zinc/70/06/77/948700677.db2.gz LMNCYBHQCKAEAW-AWEZNQCLSA-N 0 0 362.407 3.775 20 5 FHBDRN O=C(c1c[nH]c2cccc([N+](=O)[O-])c12)N1CCc2ccc(F)c(F)c2C1 ZINC000536482199 948720061 /nfs/dbraw/zinc/72/00/61/948720061.db2.gz RXLLVDNAVLBBMC-UHFFFAOYSA-N 0 0 357.316 3.553 20 5 FHBDRN O=C(N[C@@H](c1ccccc1)[C@@H]1CCCO1)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000536483747 948728884 /nfs/dbraw/zinc/72/88/84/948728884.db2.gz XIMQUPOPBVYEMA-HKUYNNGSSA-N 0 0 365.389 3.726 20 5 FHBDRN C[C@H](NC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1)c1cncc(F)c1 ZINC000459176011 948730669 /nfs/dbraw/zinc/73/06/69/948730669.db2.gz SAHUQLAXPPRGKM-LBPRGKRZSA-N 0 0 358.373 3.564 20 5 FHBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])NC1(c2ccccc2)CC1 ZINC000523955712 948731950 /nfs/dbraw/zinc/73/19/50/948731950.db2.gz GWSBRKMFGGNHCJ-UHFFFAOYSA-N 0 0 360.797 3.823 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N(Cc1ccsc1)c1cccnc1 ZINC000440738225 948744785 /nfs/dbraw/zinc/74/47/85/948744785.db2.gz PMJCCFWAIABBON-UHFFFAOYSA-N 0 0 369.402 3.907 20 5 FHBDRN Cc1cc(OCC(=O)Nc2ccc(OC(F)(F)F)cc2)ccc1[N+](=O)[O-] ZINC000021587247 948761590 /nfs/dbraw/zinc/76/15/90/948761590.db2.gz JZQZWNMAGOPAHN-UHFFFAOYSA-N 0 0 370.283 3.819 20 5 FHBDRN CSc1ccc(C(=O)N(C)CCOc2ccccc2F)cc1[N+](=O)[O-] ZINC000016112747 948781102 /nfs/dbraw/zinc/78/11/02/948781102.db2.gz KJIDFRPSOUYFTM-UHFFFAOYSA-N 0 0 364.398 3.607 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])N[C@@H]1CC[C@H](c2cccc(F)c2)C1 ZINC000474012196 948789275 /nfs/dbraw/zinc/78/92/75/948789275.db2.gz NWKROKOGWVODSA-WMLDXEAASA-N 0 0 357.385 3.869 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)Nc1ccc(-c2c[nH]cn2)cc1 ZINC000524007123 948798965 /nfs/dbraw/zinc/79/89/65/948798965.db2.gz ADUWBZRXTANJMM-UHFFFAOYSA-N 0 0 356.769 3.820 20 5 FHBDRN CCOc1cc(-c2noc(/C=C/c3cccc([N+](=O)[O-])c3)n2)ccc1O ZINC000445419045 948802172 /nfs/dbraw/zinc/80/21/72/948802172.db2.gz PULJTBSVOPBQRW-RMKNXTFCSA-N 0 0 353.334 3.920 20 5 FHBDRN CC[C@H]1CCCCN1C(=O)[C@@H](C)OC(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000021613197 948818280 /nfs/dbraw/zinc/81/82/80/948818280.db2.gz OMBWSGJELRIOSQ-YPMHNXCESA-N 0 0 368.817 3.585 20 5 FHBDRN CC[C@@H]1CCCCN1C(=O)[C@@H](C)OC(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000021613194 948818574 /nfs/dbraw/zinc/81/85/74/948818574.db2.gz OMBWSGJELRIOSQ-DGCLKSJQSA-N 0 0 368.817 3.585 20 5 FHBDRN O=C(COc1cccc([N+](=O)[O-])c1)Nc1ccc(Br)cc1F ZINC000006061506 219711638 /nfs/dbraw/zinc/71/16/38/219711638.db2.gz OXQLQFXNPSFSTG-UHFFFAOYSA-N 0 0 369.146 3.514 20 5 FHBDRN COc1cc(C(=O)Nc2ccc(Cl)cc2F)c([N+](=O)[O-])cc1OC ZINC000007970458 219836457 /nfs/dbraw/zinc/83/64/57/219836457.db2.gz QKZZORYGKOOZLJ-UHFFFAOYSA-N 0 0 354.721 3.657 20 5 FHBDRN CCN(CC)S(=O)(=O)c1ccc(Oc2cccc(F)c2)c([N+](=O)[O-])c1 ZINC000008146953 219849643 /nfs/dbraw/zinc/84/96/43/219849643.db2.gz YLCXUFWEMOXBSU-UHFFFAOYSA-N 0 0 368.386 3.557 20 5 FHBDRN CCOc1ccc([C@H](C)NC(=O)Cc2ccc([N+](=O)[O-])cc2)cc1OCC ZINC000008311959 219859021 /nfs/dbraw/zinc/85/90/21/219859021.db2.gz GJZJTZUZQANKEK-AWEZNQCLSA-N 0 0 372.421 3.812 20 5 FHBDRN Cc1cc(Cl)ccc1NC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000014492512 220124500 /nfs/dbraw/zinc/12/45/00/220124500.db2.gz QVIQRKKUPTXQNO-UHFFFAOYSA-N 0 0 356.769 3.995 20 5 FHBDRN CC(C)CCNC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000015499801 220154454 /nfs/dbraw/zinc/15/44/54/220154454.db2.gz ANSZRCMVECCJNL-UHFFFAOYSA-N 0 0 350.362 3.868 20 5 FHBDRN O=C(Nc1ccc2c(c1)OCCCO2)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000015618712 220157231 /nfs/dbraw/zinc/15/72/31/220157231.db2.gz OHZOOKBXAJDBQE-UHFFFAOYSA-N 0 0 369.377 3.583 20 5 FHBDRN CC(=O)Nc1ccc(S[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC000016553185 220186173 /nfs/dbraw/zinc/18/61/73/220186173.db2.gz LMAHRGUQAHVNJC-LLVKDONJSA-N 0 0 359.407 3.673 20 5 FHBDRN C[C@@H](NC(=O)c1ccc(N)c([N+](=O)[O-])c1)c1cccc(C(F)(F)F)c1 ZINC000018016020 220222276 /nfs/dbraw/zinc/22/22/76/220222276.db2.gz JJVDZCODLBKXBO-SECBINFHSA-N 0 0 353.300 3.687 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(C)c1ccc2ccccc2c1 ZINC000021632427 220361202 /nfs/dbraw/zinc/36/12/02/220361202.db2.gz CEQIWSGESGWXHV-UHFFFAOYSA-N 0 0 372.402 3.582 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)c1cnn(-c2cccc(Cl)c2)c1 ZINC000055012751 221056182 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Cc1ccc(NC(=O)[C@@H](c2ccccc2)N2CCSCC2)cc1[N+](=O)[O-] ZINC000072034417 221398640 /nfs/dbraw/zinc/39/86/40/221398640.db2.gz DABVXJPHROKVTP-GOSISDBHSA-N 0 0 371.462 3.632 20 5 FHBDRN CC(C)[C@H](C)N(C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)C1CC1 ZINC000106039927 132239821 /nfs/dbraw/zinc/23/98/21/132239821.db2.gz NQFYFLGTWGHMBV-HNNXBMFYSA-N 0 0 359.470 3.847 20 5 FHBDRN CCC[C@H](C)NC(=O)[C@@H]1CCCN(c2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000109599394 132374176 /nfs/dbraw/zinc/37/41/76/132374176.db2.gz JNOODCRPQYLFEE-QWHCGFSZSA-N 0 0 353.850 3.769 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])c1cc(Cl)ccc1Br ZINC000097427443 222180657 /nfs/dbraw/zinc/18/06/57/222180657.db2.gz ZBPJRLXLJMBXKB-UHFFFAOYSA-N 0 0 369.602 3.941 20 5 FHBDRN O=C1CCCCCN1CCCNc1ccc(Br)cc1[N+](=O)[O-] ZINC000098071773 222225437 /nfs/dbraw/zinc/22/54/37/222225437.db2.gz LGWOZBGJJSSBAN-UHFFFAOYSA-N 0 0 370.247 3.562 20 5 FHBDRN CN(Cc1cc(Br)ccc1F)C(=O)c1ccccc1[N+](=O)[O-] ZINC000105860502 222378014 /nfs/dbraw/zinc/37/80/14/222378014.db2.gz LJUDTJNQOVIDSZ-UHFFFAOYSA-N 0 0 367.174 3.769 20 5 FHBDRN Cc1sc(C(=O)Nc2ccccc2NC(=O)N2CCCC2)cc1[N+](=O)[O-] ZINC000108647818 222426153 /nfs/dbraw/zinc/42/61/53/222426153.db2.gz KZVCZLLTHGXUMA-UHFFFAOYSA-N 0 0 374.422 3.845 20 5 FHBDRN CCc1cc(C(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)oc1CC ZINC000128529817 567830785 /nfs/dbraw/zinc/83/07/85/567830785.db2.gz RAVZCHNFZPCLAG-UHFFFAOYSA-N 0 0 372.421 3.996 20 5 FHBDRN CCO[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)C[C@@H]1C ZINC000452865673 567845535 /nfs/dbraw/zinc/84/55/35/567845535.db2.gz NWIDLOLRADQNAQ-HZMBPMFUSA-N 0 0 360.332 3.501 20 5 FHBDRN CC(=O)c1ccc(C(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)s1 ZINC000452873678 567869335 /nfs/dbraw/zinc/86/93/35/567869335.db2.gz JXWQYQCAFUNLQT-AWEZNQCLSA-N 0 0 358.419 3.879 20 5 FHBDRN CC(C)Oc1ncccc1C(=O)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452870298 567869718 /nfs/dbraw/zinc/86/97/18/567869718.db2.gz ZMWWQQHILGCORA-MRXNPFEDSA-N 0 0 369.421 3.797 20 5 FHBDRN CCO[C@H]1CCN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])C[C@@H]1C ZINC000452875742 567869720 /nfs/dbraw/zinc/86/97/20/567869720.db2.gz SNMIQPQPNVKVTN-HZMBPMFUSA-N 0 0 360.332 3.501 20 5 FHBDRN C[C@@H]1C[C@H](CNC(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)[C@H](C)O1 ZINC000412637970 567881222 /nfs/dbraw/zinc/88/12/22/567881222.db2.gz HQHZPOCARGSVAS-IJEWVQPXSA-N 0 0 369.421 3.882 20 5 FHBDRN CC[C@H](CNC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)CC(F)(F)F ZINC000412633626 567881257 /nfs/dbraw/zinc/88/12/57/567881257.db2.gz XJRRXEDTUPMFOT-LBPRGKRZSA-N 0 0 373.375 3.903 20 5 FHBDRN COc1ccc(OC)c(C(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000452883469 567887195 /nfs/dbraw/zinc/88/71/95/567887195.db2.gz PPSUJOTZVJMFAW-HNNXBMFYSA-N 0 0 370.405 3.632 20 5 FHBDRN CN(C)c1cccc(C(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000452881993 567896564 /nfs/dbraw/zinc/89/65/64/567896564.db2.gz OVGGFUALRAKRGP-QGZVFWFLSA-N 0 0 353.422 3.681 20 5 FHBDRN CC(C)(C)c1ccc(C(C)(C)CNc2nccc(C(N)=O)c2[N+](=O)[O-])cc1 ZINC000568123956 567900442 /nfs/dbraw/zinc/90/04/42/567900442.db2.gz HVLATRANXTXTPY-UHFFFAOYSA-N 0 0 370.453 3.776 20 5 FHBDRN COc1ccc(CCC(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000452890555 567904735 /nfs/dbraw/zinc/90/47/35/567904735.db2.gz UUHLCMREIIQZRG-SFHVURJKSA-N 0 0 368.433 3.942 20 5 FHBDRN Cc1cc(=O)n(CC(=O)c2ccc(Oc3ccccc3)cc2)cc1[N+](=O)[O-] ZINC000128534300 567904872 /nfs/dbraw/zinc/90/48/72/567904872.db2.gz UZTKMNUOFOSNTG-UHFFFAOYSA-N 0 0 364.357 3.740 20 5 FHBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)N(C)CC(C)(C)CO ZINC000452898261 567911690 /nfs/dbraw/zinc/91/16/90/567911690.db2.gz BWNAQEQMCHDBEW-UHFFFAOYSA-N 0 0 354.472 3.578 20 5 FHBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)NC1(c2ccccc2)CCC1 ZINC000517909657 567916037 /nfs/dbraw/zinc/91/60/37/567916037.db2.gz IFZIDQFKXVWLLX-UHFFFAOYSA-N 0 0 366.826 3.606 20 5 FHBDRN O=[N+]([O-])c1ccc(NC[C@@H]2CCCC(F)(F)C2)c(F)c1N1CCOCC1 ZINC000584665143 567917108 /nfs/dbraw/zinc/91/71/08/567917108.db2.gz BELYDJASPMKLTK-GFCCVEGCSA-N 0 0 373.375 3.808 20 5 FHBDRN CC(C)C[C@@H](C)n1nccc1NC(=O)NCCNc1ccc([N+](=O)[O-])cc1 ZINC000481436240 567935678 /nfs/dbraw/zinc/93/56/78/567935678.db2.gz BOUINRZDDPTNIR-CQSZACIVSA-N 0 0 374.445 3.632 20 5 FHBDRN O=[N+]([O-])c1ccc(SC[C@H](O)COc2cccc(C(F)(F)F)c2)nc1 ZINC000159196853 567947154 /nfs/dbraw/zinc/94/71/54/567947154.db2.gz YBXXVXVCEBZXAV-GFCCVEGCSA-N 0 0 374.340 3.541 20 5 FHBDRN O=C(Nc1cccc(OC[C@H]2CCCO2)c1)Nc1cccc([N+](=O)[O-])c1 ZINC000024685052 567957380 /nfs/dbraw/zinc/95/73/80/567957380.db2.gz DWWMAAQQSCQMFG-QGZVFWFLSA-N 0 0 357.366 3.797 20 5 FHBDRN Cc1onc(-c2ccccc2C)c1-c1nc(CCC(C)(C)[N+](=O)[O-])no1 ZINC000291005416 567957428 /nfs/dbraw/zinc/95/74/28/567957428.db2.gz ACEAQCHTJRYYLU-UHFFFAOYSA-N 0 0 356.382 3.996 20 5 FHBDRN COc1ccc(CCCCC(=O)NCc2cccc([N+](=O)[O-])c2C)cc1 ZINC000481461190 567957872 /nfs/dbraw/zinc/95/78/72/567957872.db2.gz AOEHYMDSVZXNRU-UHFFFAOYSA-N 0 0 356.422 3.941 20 5 FHBDRN Cn1nc(C(F)F)c2cc(-c3nc(CCC(C)(C)[N+](=O)[O-])no3)sc21 ZINC000291006688 567958048 /nfs/dbraw/zinc/95/80/48/567958048.db2.gz AHNZUEAWRWYWPL-UHFFFAOYSA-N 0 0 371.369 3.610 20 5 FHBDRN CC(C)C(=O)c1ccc(NC(=O)CN(C)c2ccccc2[N+](=O)[O-])cc1 ZINC000452926804 567959574 /nfs/dbraw/zinc/95/95/74/567959574.db2.gz DEWFJYXMIIWCRV-UHFFFAOYSA-N 0 0 355.394 3.508 20 5 FHBDRN Cc1c(CNC(=O)[C@H]2C[C@]23CCCc2ccccc23)cccc1[N+](=O)[O-] ZINC000481465710 567965555 /nfs/dbraw/zinc/96/55/55/567965555.db2.gz LKNPKVCQLSYWCW-NQIIRXRSSA-N 0 0 350.418 3.814 20 5 FHBDRN CCCc1c(C(=O)NCc2cccc([N+](=O)[O-])c2C)[nH]c(C)c1C(C)=O ZINC000481466771 567970297 /nfs/dbraw/zinc/97/02/97/567970297.db2.gz NULYUYYYCWZXQC-UHFFFAOYSA-N 0 0 357.410 3.625 20 5 FHBDRN CSCCCN(C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)c1cccnc1 ZINC000602373710 567973827 /nfs/dbraw/zinc/97/38/27/567973827.db2.gz PJKABSSKRQIIAF-ZWKOTPCHSA-N 0 0 371.462 3.880 20 5 FHBDRN Cc1ccc(C)c(N2CCN(C(=O)Nc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000481478974 567977038 /nfs/dbraw/zinc/97/70/38/567977038.db2.gz JVRVTIZTGAJPNP-UHFFFAOYSA-N 0 0 354.410 3.566 20 5 FHBDRN C[C@@H]1Oc2ccccc2[C@@H]1NC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000521507595 567980036 /nfs/dbraw/zinc/98/00/36/567980036.db2.gz PYKJWPHSWHNNQZ-BJOHPYRUSA-N 0 0 366.295 3.866 20 5 FHBDRN Cc1sc(-c2ccco2)nc1C(=O)NCc1cccc([N+](=O)[O-])c1C ZINC000481478045 567980206 /nfs/dbraw/zinc/98/02/06/567980206.db2.gz XRSUBWJKGFKDPV-UHFFFAOYSA-N 0 0 357.391 3.858 20 5 FHBDRN CC(C)(CCc1noc(CSc2nc3ccccc3s2)n1)[N+](=O)[O-] ZINC000291047885 567991062 /nfs/dbraw/zinc/99/10/62/567991062.db2.gz HQBWVTWWGRDBBP-UHFFFAOYSA-N 0 0 364.452 3.960 20 5 FHBDRN Cc1c(CNC(=O)COc2cccc(OCC(C)C)c2)cccc1[N+](=O)[O-] ZINC000481492874 567992010 /nfs/dbraw/zinc/99/20/10/567992010.db2.gz ONJVGHZTVXSKSP-UHFFFAOYSA-N 0 0 372.421 3.633 20 5 FHBDRN CC(C)(CCc1noc([C@@H]2CCCN2Cc2ccc(F)cc2)n1)[N+](=O)[O-] ZINC000291067378 568000937 /nfs/dbraw/zinc/00/09/37/568000937.db2.gz KYRGITMCAGRDTG-HNNXBMFYSA-N 0 0 362.405 3.534 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)c1nc(CCC(C)(C)[N+](=O)[O-])no1 ZINC000291077066 568011842 /nfs/dbraw/zinc/01/18/42/568011842.db2.gz MTACPHBTNPRTGK-SNVBAGLBSA-N 0 0 366.399 3.819 20 5 FHBDRN O=[N+]([O-])c1sc(CN2CCC(c3ccon3)CC2)cc1Br ZINC000602717888 568014855 /nfs/dbraw/zinc/01/48/55/568014855.db2.gz JRXYSQZZJHYBGF-UHFFFAOYSA-N 0 0 372.244 3.786 20 5 FHBDRN Cc1c(CNC(=O)[C@@H]2C[C@H]2c2cc(F)c(F)c(F)c2)cccc1[N+](=O)[O-] ZINC000481504435 568031965 /nfs/dbraw/zinc/03/19/65/568031965.db2.gz WLSZBKOQEASAFV-QWHCGFSZSA-N 0 0 364.323 3.740 20 5 FHBDRN C[C@@H](C(=O)Nc1cc(Br)ccc1O)c1cccc([N+](=O)[O-])c1 ZINC000568361948 568033506 /nfs/dbraw/zinc/03/35/06/568033506.db2.gz RTECRMVWRHQKQO-SECBINFHSA-N 0 0 365.183 3.805 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N(C)Cc1ccccc1N(C)C ZINC000568442496 568038352 /nfs/dbraw/zinc/03/83/52/568038352.db2.gz PNTUSFGJUOIXPE-KRWDZBQOSA-N 0 0 369.465 3.888 20 5 FHBDRN COC[C@H](NC(=O)c1c[nH]c2cccc([N+](=O)[O-])c21)c1cccc(Cl)c1 ZINC000568456636 568039981 /nfs/dbraw/zinc/03/99/81/568039981.db2.gz JBCHZELINLFTHK-HNNXBMFYSA-N 0 0 373.796 3.847 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)CCc1c[nH]c2ccccc12 ZINC000568543709 568048869 /nfs/dbraw/zinc/04/88/69/568048869.db2.gz RVKKZWASGBTMLX-UHFFFAOYSA-N 0 0 351.406 3.710 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CC[C@H](CC(C)(C)C)C1(C)C ZINC000412834991 568049142 /nfs/dbraw/zinc/04/91/42/568049142.db2.gz YZVCTAYQZKBQKS-CQSZACIVSA-N 0 0 350.463 3.553 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NCc1ccc(F)cc1F ZINC000481545671 568050512 /nfs/dbraw/zinc/05/05/12/568050512.db2.gz PQQHRHJJGXIHEO-UHFFFAOYSA-N 0 0 352.362 3.915 20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])N[C@H]1C[C@H](c2ccc(F)cc2)C1 ZINC000481545330 568050515 /nfs/dbraw/zinc/05/05/15/568050515.db2.gz RJTLWKKVGICIAL-KOMQPUFPSA-N 0 0 357.385 3.598 20 5 FHBDRN C[C@@H](C(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1)c1ccc2c(c1)OCO2 ZINC000481545630 568051054 /nfs/dbraw/zinc/05/10/54/568051054.db2.gz PMTSIJOVFSKAAM-CYBMUJFWSA-N 0 0 368.389 3.618 20 5 FHBDRN CCCc1nc(-c2noc(-c3ccc(N4CCCC4)c([N+](=O)[O-])c3)n2)co1 ZINC000568567122 568051533 /nfs/dbraw/zinc/05/15/33/568051533.db2.gz ZJKAKAUYBHGXMU-UHFFFAOYSA-N 0 0 369.381 3.853 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)NC[C@H]1CCO[C@@H]1c1ccccc1 ZINC000481580348 568058827 /nfs/dbraw/zinc/05/88/27/568058827.db2.gz XUHRBMCXIITIAO-DNVCBOLYSA-N 0 0 372.446 3.581 20 5 FHBDRN C[C@H](CNC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1)Oc1ccc(Cl)cc1 ZINC000568579510 568059128 /nfs/dbraw/zinc/05/91/28/568059128.db2.gz OXJQZGGORFAIHH-CHWSQXEVSA-N 0 0 362.813 3.935 20 5 FHBDRN Cc1cc(C)n(-c2ccc(-c3nc(CCC(C)(C)[N+](=O)[O-])no3)cc2)n1 ZINC000291144868 568064070 /nfs/dbraw/zinc/06/40/70/568064070.db2.gz YQIRVUAXAGCNEP-UHFFFAOYSA-N 0 0 355.398 3.527 20 5 FHBDRN COC(=O)c1cc(NC(=O)c2ccc([N+](=O)[O-])cc2F)cc(Cl)c1F ZINC000481614165 568068379 /nfs/dbraw/zinc/06/83/79/568068379.db2.gz QENRUIOYHOLQSZ-UHFFFAOYSA-N 0 0 370.695 3.565 20 5 FHBDRN Cc1c2ccccc2oc1[C@@H](C)NC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000481636993 568075346 /nfs/dbraw/zinc/07/53/46/568075346.db2.gz XVNJJKZRUCNUNP-LLVKDONJSA-N 0 0 368.345 3.869 20 5 FHBDRN C[C@H]1CCC[N@H+](Cc2ccc(NC(=O)c3ccc([N+](=O)[O-])c([O-])c3)cc2)C1 ZINC000541891793 568075562 /nfs/dbraw/zinc/07/55/62/568075562.db2.gz VSKLPYHERGCJEH-AWEZNQCLSA-N 0 0 369.421 3.785 20 5 FHBDRN CN(Cc1ccc(F)cc1Br)C(=O)c1ccc([N+](=O)[O-])cc1 ZINC000481679020 568085712 /nfs/dbraw/zinc/08/57/12/568085712.db2.gz WNASCRJUXGERLH-UHFFFAOYSA-N 0 0 367.174 3.769 20 5 FHBDRN O=C(Nc1ccnn1-c1ccc([N+](=O)[O-])cc1)[C@H]1C[C@@H]1c1ccc(F)cc1 ZINC000068103699 568086344 /nfs/dbraw/zinc/08/63/44/568086344.db2.gz BVFMUSIVFMQCNW-SJORKVTESA-N 0 0 366.352 3.662 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(Sc2nc(C3CC3)n(-c3ccccc3)n2)n1 ZINC000481708803 568090734 /nfs/dbraw/zinc/09/07/34/568090734.db2.gz CIFWYFZWTUEZGG-UHFFFAOYSA-N 0 0 353.407 3.908 20 5 FHBDRN CCn1c(SC[C@@H](O)CCC(C)C)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000481705284 568091173 /nfs/dbraw/zinc/09/11/73/568091173.db2.gz YTGLFYROOPUBJB-HNNXBMFYSA-N 0 0 364.471 3.762 20 5 FHBDRN O=[N+]([O-])c1ccc(CNc2ccnc3cc(Br)cnc32)cc1 ZINC000128627718 568092697 /nfs/dbraw/zinc/09/26/97/568092697.db2.gz AAIOVKWRMFVQAW-UHFFFAOYSA-N 0 0 359.183 3.913 20 5 FHBDRN C[C@@H]1[C@H](C(F)(F)F)CCCN1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000481738699 568099845 /nfs/dbraw/zinc/09/98/45/568099845.db2.gz FGOMTDQPCFBJCX-QMTHXVAHSA-N 0 0 360.332 3.624 20 5 FHBDRN CN(C(=O)COc1cc(Cl)cc(Cl)c1)c1ccc([N+](=O)[O-])cc1 ZINC000024784308 568100261 /nfs/dbraw/zinc/10/02/61/568100261.db2.gz XDJSFWKFKGMFPR-UHFFFAOYSA-N 0 0 355.177 3.943 20 5 FHBDRN CCOc1cc(CS(=O)(=O)Cc2ccc(C)cc2C)ccc1[N+](=O)[O-] ZINC000568630429 568100996 /nfs/dbraw/zinc/10/09/96/568100996.db2.gz LAVJXRNDRTXRRV-UHFFFAOYSA-N 0 0 363.435 3.725 20 5 FHBDRN Cc1cccc(N2CCN(C(=O)c3cc(Cl)cc([N+](=O)[O-])c3)CC2)c1 ZINC000128635600 568101987 /nfs/dbraw/zinc/10/19/87/568101987.db2.gz ZPQKVXKGLQOIIC-UHFFFAOYSA-N 0 0 359.813 3.519 20 5 FHBDRN CC(C)Oc1nc(N[C@@H]2CCO[C@H](c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000568647625 568106956 /nfs/dbraw/zinc/10/69/56/568106956.db2.gz USVGLXQOAIKQFC-WBVHZDCISA-N 0 0 357.410 3.531 20 5 FHBDRN CC(C)CO[C@@H](C)c1noc(CNc2ccc(Cl)c([N+](=O)[O-])c2)n1 ZINC000072910953 568109586 /nfs/dbraw/zinc/10/95/86/568109586.db2.gz BCDQOYFUIPZFAF-JTQLQIEISA-N 0 0 354.794 3.977 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)Nc2cc(C3CC3)ccn2)cc1SC ZINC000291330529 568115372 /nfs/dbraw/zinc/11/53/72/568115372.db2.gz WEJWSTJICIIHPV-UHFFFAOYSA-N 0 0 359.407 3.850 20 5 FHBDRN CC(C)(C)N(Cc1ccccn1)C(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000568678910 568120266 /nfs/dbraw/zinc/12/02/66/568120266.db2.gz WHIAELHGNBLJKL-UHFFFAOYSA-N 0 0 363.364 3.638 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)NC[C@@H]1CCO[C@@H]1c1ccccc1 ZINC000568692209 568123770 /nfs/dbraw/zinc/12/37/70/568123770.db2.gz XUHRBMCXIITIAO-HNAYVOBHSA-N 0 0 372.446 3.581 20 5 FHBDRN O=C1COc2c(N[C@H]3CCC[C@H]3Cc3ccccc3[N+](=O)[O-])cccc2N1 ZINC000568699676 568131865 /nfs/dbraw/zinc/13/18/65/568131865.db2.gz CAIUBZJVNBIEMT-ZFWWWQNUSA-N 0 0 367.405 3.749 20 5 FHBDRN CSC1CCN(C(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000601692403 568133223 /nfs/dbraw/zinc/13/32/23/568133223.db2.gz YPUBVXWUSLHNLA-UHFFFAOYSA-N 0 0 360.888 3.694 20 5 FHBDRN COc1cc(C(=O)N[C@H](c2ccccc2)C(F)F)cc([N+](=O)[O-])c1C ZINC000481825735 568136236 /nfs/dbraw/zinc/13/62/36/568136236.db2.gz ORYHPQUKCGITSL-OAHLLOKOSA-N 0 0 350.321 3.648 20 5 FHBDRN CSc1cccc(C(=O)NCCc2ccc(F)cc2F)c1[N+](=O)[O-] ZINC000568708000 568136411 /nfs/dbraw/zinc/13/64/11/568136411.db2.gz UMKLUKRIZZXQAZ-UHFFFAOYSA-N 0 0 352.362 3.567 20 5 FHBDRN O=[N+]([O-])c1ccc(NCC[C@@H]2COc3ccccc3O2)cc1OC(F)F ZINC000481834984 568147791 /nfs/dbraw/zinc/14/77/91/568147791.db2.gz CAFSSWMYKRKZSG-GFCCVEGCSA-N 0 0 366.320 3.838 20 5 FHBDRN Cc1cc(C)c(-c2csc(NC(=O)c3cc([N+](=O)[O-])nn3C)n2)cc1C ZINC000481887788 568151716 /nfs/dbraw/zinc/15/17/16/568151716.db2.gz NANPBTYSPRWBRF-UHFFFAOYSA-N 0 0 371.422 3.629 20 5 FHBDRN O=C(c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1)N1CCCC[C@@H]1CCO ZINC000128676978 568153464 /nfs/dbraw/zinc/15/34/64/568153464.db2.gz YYZKMULJXBHQQF-QGZVFWFLSA-N 0 0 369.421 3.716 20 5 FHBDRN CCc1nc(CCNC(=O)c2cc(Cl)cc(Cl)c2[N+](=O)[O-])cs1 ZINC000291433865 568153774 /nfs/dbraw/zinc/15/37/74/568153774.db2.gz FLZFSYZMVBRJGV-UHFFFAOYSA-N 0 0 374.249 3.893 20 5 FHBDRN Cc1cnc(Sc2nnc(-c3cccc(Cl)c3)n2C)c([N+](=O)[O-])c1 ZINC000481843420 568157939 /nfs/dbraw/zinc/15/79/39/568157939.db2.gz SUKJDLOVHLPZLE-UHFFFAOYSA-N 0 0 361.814 3.898 20 5 FHBDRN COc1cc(NC(=O)Nc2ccc([N+](=O)[O-])cc2)ccc1OC(F)F ZINC000603836980 568159670 /nfs/dbraw/zinc/15/96/70/568159670.db2.gz HDYHBGIADOPSFE-UHFFFAOYSA-N 0 0 353.281 3.849 20 5 FHBDRN COC(=O)c1cc(OCc2ccc(OC(F)F)cc2)ccc1[N+](=O)[O-] ZINC000481895037 568170044 /nfs/dbraw/zinc/17/00/44/568170044.db2.gz BEUPEJPIIHCWKV-UHFFFAOYSA-N 0 0 353.277 3.562 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)Nc1ncccc1CCCCOC ZINC000291504464 568181725 /nfs/dbraw/zinc/18/17/25/568181725.db2.gz WALWCIKXDUJEHS-UHFFFAOYSA-N 0 0 373.409 3.610 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)NCCOc1cccc2ccccc21 ZINC000603939787 568184766 /nfs/dbraw/zinc/18/47/66/568184766.db2.gz BPHRGPOZOYOIBX-UHFFFAOYSA-N 0 0 366.373 3.565 20 5 FHBDRN COC(=O)c1cc(OCc2cc(-c3ccc(F)cc3)no2)ccc1[N+](=O)[O-] ZINC000481924906 568187007 /nfs/dbraw/zinc/18/70/07/568187007.db2.gz RYRZGFLTPQNWOV-UHFFFAOYSA-N 0 0 372.308 3.755 20 5 FHBDRN O=C(N[C@@H](c1ccccc1)C(F)F)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000481942183 568195065 /nfs/dbraw/zinc/19/50/65/568195065.db2.gz JNKPZJFUBSAFQR-INIZCTEOSA-N 0 0 373.315 3.585 20 5 FHBDRN COc1cccc([C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])c(OC)c2)c1 ZINC000159369273 568197048 /nfs/dbraw/zinc/19/70/48/568197048.db2.gz KPODQYGQJNCDRI-MRXNPFEDSA-N 0 0 356.378 3.589 20 5 FHBDRN C[C@@H](Oc1ccc(Cl)c(Cl)c1)C(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000603999657 568197616 /nfs/dbraw/zinc/19/76/16/568197616.db2.gz AYFXPGWDUKOHQA-SNVBAGLBSA-N 0 0 369.204 3.985 20 5 FHBDRN C[C@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1F)c1cccc2ccccc21 ZINC000604019500 568199699 /nfs/dbraw/zinc/19/96/99/568199699.db2.gz HBMBYVKNEHZTQO-LBPRGKRZSA-N 0 0 374.393 3.927 20 5 FHBDRN Cc1ccc(NC(=O)c2ccc(N3CCO[C@H](C)[C@H]3C)c([N+](=O)[O-])c2)cc1 ZINC000481980949 568213278 /nfs/dbraw/zinc/21/32/78/568213278.db2.gz ZDFLKFUYNHUMBC-HUUCEWRRSA-N 0 0 369.421 3.769 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(N[C@H]2CCN(c3ccccc3OC(F)F)C2)n1 ZINC000481983443 568215388 /nfs/dbraw/zinc/21/53/88/568215388.db2.gz SYNOEUYBHSOIOP-LBPRGKRZSA-N 0 0 364.352 3.590 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N1CCC[C@@H]1c1cccs1 ZINC000481985831 568215671 /nfs/dbraw/zinc/21/56/71/568215671.db2.gz ZFZAYGAVDMFTIL-CQSZACIVSA-N 0 0 366.464 3.799 20 5 FHBDRN C[C@@H](C1CC1)N(Cc1ccccc1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000007213270 568227785 /nfs/dbraw/zinc/22/77/85/568227785.db2.gz PTXZYNCCBOAPOR-AWEZNQCLSA-N 0 0 360.435 3.584 20 5 FHBDRN Cc1cccc(C2(c3noc(CNc4ccccc4[N+](=O)[O-])n3)CC2)c1 ZINC000568808155 568229306 /nfs/dbraw/zinc/22/93/06/568229306.db2.gz YEARVBUIPKRYFM-UHFFFAOYSA-N 0 0 350.378 3.978 20 5 FHBDRN CSc1ccc(C(=O)NC[C@H]2CC[C@@H](c3ccccc3)O2)cc1[N+](=O)[O-] ZINC000568807005 568229322 /nfs/dbraw/zinc/22/93/22/568229322.db2.gz SNONUBBFZLQQNL-WBVHZDCISA-N 0 0 372.446 3.967 20 5 FHBDRN COc1cc(NC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)cc(OC)c1 ZINC000007474545 568234763 /nfs/dbraw/zinc/23/47/63/568234763.db2.gz OZCWBYYLCXYEIX-LLVKDONJSA-N 0 0 362.407 3.731 20 5 FHBDRN COc1ccc2c(c1NC(=O)c1c[nH]c3cc([N+](=O)[O-])ccc13)CCC2 ZINC000482048811 568238611 /nfs/dbraw/zinc/23/86/11/568238611.db2.gz QHTACBVHAKMLRK-UHFFFAOYSA-N 0 0 351.362 3.826 20 5 FHBDRN C[C@@H](C(=O)N[C@H](c1ccccc1)C(F)F)c1ccc([N+](=O)[O-])cc1F ZINC000482048379 568238634 /nfs/dbraw/zinc/23/86/34/568238634.db2.gz YHYFWUSKYXLXIF-MEBBXXQBSA-N 0 0 352.312 3.960 20 5 FHBDRN COc1ccc(CNC(=O)[C@H](C)c2cc3ccccc3o2)cc1[N+](=O)[O-] ZINC000482048812 568238697 /nfs/dbraw/zinc/23/86/97/568238697.db2.gz ZAFGGHBCJXSADI-GFCCVEGCSA-N 0 0 354.362 3.770 20 5 FHBDRN CCc1ccc([C@H]2CN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)CCO2)cc1 ZINC000482051794 568239839 /nfs/dbraw/zinc/23/98/39/568239839.db2.gz GEIDXAYNRVOELI-GOSISDBHSA-N 0 0 358.369 3.510 20 5 FHBDRN Cc1cc(N[C@H](c2ccc([N+](=O)[O-])cc2)C(F)(F)F)cc(OCCO)c1 ZINC000568890004 568248266 /nfs/dbraw/zinc/24/82/66/568248266.db2.gz QFJWWFSVBUCYAW-MRXNPFEDSA-N 0 0 370.327 3.990 20 5 FHBDRN CCc1ccccc1OCC(=O)N1CCS[C@@H]1c1ccc([N+](=O)[O-])cc1 ZINC000568891259 568248501 /nfs/dbraw/zinc/24/85/01/568248501.db2.gz RFVZZMRNDSSMKX-LJQANCHMSA-N 0 0 372.446 3.810 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(NC[C@@H]2CCCO[C@@H]2C(C)(C)C)c1 ZINC000302109612 568251702 /nfs/dbraw/zinc/25/17/02/568251702.db2.gz SZOMODMAVZQNPM-BBRMVZONSA-N 0 0 350.415 3.635 20 5 FHBDRN CCc1n[nH]c(C(=O)N[C@H](C)c2ccc(F)c3ccccc32)c1[N+](=O)[O-] ZINC000568908660 568251833 /nfs/dbraw/zinc/25/18/33/568251833.db2.gz UCYQGVWWQDKHLY-SNVBAGLBSA-N 0 0 356.357 3.664 20 5 FHBDRN COc1ccc([C@@H]2CCCN2C(=O)c2ccc(C)c([N+](=O)[O-])c2)c(OC)c1 ZINC000015829886 568252589 /nfs/dbraw/zinc/25/25/89/568252589.db2.gz GGRBDEAFTIONPH-KRWDZBQOSA-N 0 0 370.405 3.898 20 5 FHBDRN C[C@@]1(CNC(=O)c2ccc([N+](=O)[O-])cc2Cl)OCCc2sccc21 ZINC000291673460 568252647 /nfs/dbraw/zinc/25/26/47/568252647.db2.gz WDRRAJNTHURILL-INIZCTEOSA-N 0 0 366.826 3.528 20 5 FHBDRN C[C@H](NC(=O)Nc1cccc([N+](=O)[O-])c1)c1cccc(-n2cccn2)c1 ZINC000072930778 568253375 /nfs/dbraw/zinc/25/33/75/568253375.db2.gz BOZJTUOBICSQSG-ZDUSSCGKSA-N 0 0 351.366 3.663 20 5 FHBDRN O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)NCc1ccc(C(F)F)cc1 ZINC000568929044 568253396 /nfs/dbraw/zinc/25/33/96/568253396.db2.gz NRAHALIXMIONLQ-UHFFFAOYSA-N 0 0 356.275 3.670 20 5 FHBDRN COc1ccc2c(c1)C[C@@H](C)N(C(=O)c1cc([N+](=O)[O-])ccc1OC)[C@@H]2C ZINC000541934487 568254482 /nfs/dbraw/zinc/25/44/82/568254482.db2.gz QKLNIVINGMKFRU-CHWSQXEVSA-N 0 0 370.405 3.760 20 5 FHBDRN COCCOc1ccc(Cl)cc1C(=O)Nc1ccc(C)c([N+](=O)[O-])c1 ZINC000482082898 568255043 /nfs/dbraw/zinc/25/50/43/568255043.db2.gz QBHGHEXTTSGSBG-UHFFFAOYSA-N 0 0 364.785 3.834 20 5 FHBDRN CC(C)Cn1cc(NC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)cn1 ZINC000159406009 568256585 /nfs/dbraw/zinc/25/65/85/568256585.db2.gz XGYLGWPFHAZYPG-UHFFFAOYSA-N 0 0 357.414 3.644 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N2CC[C@]3(CC[C@@H](C)C3)C2)cc1OC ZINC000541937552 568257704 /nfs/dbraw/zinc/25/77/04/568257704.db2.gz SPCAJCPENSVQJU-YJYMSZOUSA-N 0 0 362.426 3.654 20 5 FHBDRN C[C@H](C(=O)NCCNc1ccc([N+](=O)[O-])cc1)c1cc2ccccc2o1 ZINC000482087645 568257994 /nfs/dbraw/zinc/25/79/94/568257994.db2.gz GAQZYYUVNYLFIA-ZDUSSCGKSA-N 0 0 353.378 3.673 20 5 FHBDRN CCOc1ccc(C(=O)N2CC[C@@H](c3cccc(F)c3)C2)cc1[N+](=O)[O-] ZINC000568979530 568258079 /nfs/dbraw/zinc/25/80/79/568258079.db2.gz OLDSGMAPOUHLFU-OAHLLOKOSA-N 0 0 358.369 3.762 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)N[C@@]1(C(F)(F)F)CCc2ccccc21 ZINC000541937939 568261638 /nfs/dbraw/zinc/26/16/38/568261638.db2.gz FABSRWCLZLFRPV-KRWDZBQOSA-N 0 0 364.323 3.658 20 5 FHBDRN CC[C@H]1Cc2ccccc2CN1c1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1 ZINC000568994141 568265418 /nfs/dbraw/zinc/26/54/18/568265418.db2.gz ZAKBMTOEKDSPCH-AWEZNQCLSA-N 0 0 350.378 3.585 20 5 FHBDRN O=C(N[C@H](c1ccccc1)C(F)F)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000482096001 568267174 /nfs/dbraw/zinc/26/71/74/568267174.db2.gz AWWWVGLTGQJZBP-MRXNPFEDSA-N 0 0 372.331 3.517 20 5 FHBDRN C[C@H]1C[C@@H](c2ccc(C(F)(F)F)cc2)N(c2c([N+](=O)[O-])ncn2C)C1 ZINC000482105444 568275109 /nfs/dbraw/zinc/27/51/09/568275109.db2.gz ZEOVUJLXIABCGD-GWCFXTLKSA-N 0 0 354.332 3.935 20 5 FHBDRN CCOC(=O)C[C@](C)(NC(=O)Nc1cc(C)c([N+](=O)[O-])cc1C)C(C)C ZINC000482112027 568275559 /nfs/dbraw/zinc/27/55/59/568275559.db2.gz GOCNUKUXULMVSF-SFHVURJKSA-N 0 0 365.430 3.701 20 5 FHBDRN Cn1nc(C2CCCC2)cc1NC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000541976323 568277393 /nfs/dbraw/zinc/27/73/93/568277393.db2.gz SOXNEOMLWWAGMZ-UHFFFAOYSA-N 0 0 353.382 3.720 20 5 FHBDRN O=C(NC[C@H]1CCO[C@H]1c1ccccc1)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000569047950 568285467 /nfs/dbraw/zinc/28/54/67/568285467.db2.gz YXQGWGGFYVRQDL-BEFAXECRSA-N 0 0 365.389 3.584 20 5 FHBDRN O=[N+]([O-])c1cn(C[C@@H]2CCCO[C@H]2c2ccc(C(F)(F)F)cc2)cn1 ZINC000569140956 568290256 /nfs/dbraw/zinc/29/02/56/568290256.db2.gz PRVPACSMXUVMGX-WFASDCNBSA-N 0 0 355.316 3.978 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N[C@H]1C[C@H](c2ccccc2Cl)C1 ZINC000569144084 568292940 /nfs/dbraw/zinc/29/29/40/568292940.db2.gz BTBLJNCIGLOEBJ-JOCQHMNTSA-N 0 0 360.797 3.689 20 5 FHBDRN Cc1ccsc1CCCC(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000159420213 568295360 /nfs/dbraw/zinc/29/53/60/568295360.db2.gz LRXPDMGGQBWFPC-UHFFFAOYSA-N 0 0 373.478 3.636 20 5 FHBDRN CN1C(=O)CCc2cc(C[NH2+]C(C)(C)c3ccccc3[N+](=O)[O-])ccc21 ZINC000291775535 568305577 /nfs/dbraw/zinc/30/55/77/568305577.db2.gz UEEVLNHCVKSNKW-UHFFFAOYSA-N 0 0 353.422 3.529 20 5 FHBDRN COC(=O)c1ccc(-c2noc([C@H](C)c3cccc([N+](=O)[O-])c3)n2)cc1 ZINC000569187637 568306372 /nfs/dbraw/zinc/30/63/72/568306372.db2.gz PGDWNOCEWSLNBL-LLVKDONJSA-N 0 0 353.334 3.583 20 5 FHBDRN Cc1[nH]nc(NC(=O)CCNc2ccccc2[N+](=O)[O-])c1-c1ccccc1 ZINC000604533262 568308414 /nfs/dbraw/zinc/30/84/14/568308414.db2.gz HXWDHOCWGHZJEF-UHFFFAOYSA-N 0 0 365.393 3.734 20 5 FHBDRN O=C(c1cc2cccc([N+](=O)[O-])c2[nH]1)N1CCC2(CCSCC2)CC1 ZINC000601739637 568312556 /nfs/dbraw/zinc/31/25/56/568312556.db2.gz KDJBEMFGYOKSLM-UHFFFAOYSA-N 0 0 359.451 3.826 20 5 FHBDRN CCc1nn(C)c(N[C@@H]2CCC[C@@H](c3nc4ccccc4[nH]3)C2)c1[N+](=O)[O-] ZINC000569217565 568313351 /nfs/dbraw/zinc/31/33/51/568313351.db2.gz QULOYSIBPLWFMB-CHWSQXEVSA-N 0 0 368.441 3.905 20 5 FHBDRN Cc1nn(C(C)C)c(C)c1Cc1nc(-c2ccc(C)c([N+](=O)[O-])c2)no1 ZINC000291786965 568314243 /nfs/dbraw/zinc/31/42/43/568314243.db2.gz AUTNZATXYWPUSP-UHFFFAOYSA-N 0 0 355.398 3.938 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCCC[C@@H]1C(F)(F)F ZINC000482213673 568317352 /nfs/dbraw/zinc/31/73/52/568317352.db2.gz MHUVFUJQNUBDDI-GWCFXTLKSA-N 0 0 360.332 3.702 20 5 FHBDRN C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000482215818 568320639 /nfs/dbraw/zinc/32/06/39/568320639.db2.gz WZPPZOJLOWEDMV-NWDGAFQWSA-N 0 0 359.348 3.586 20 5 FHBDRN COc1ccc(C)cc1NC(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-] ZINC000482218950 568321014 /nfs/dbraw/zinc/32/10/14/568321014.db2.gz JUESCZJOIAJSRM-UHFFFAOYSA-N 0 0 362.407 3.895 20 5 FHBDRN Cc1c(N[C@@H]2CCN([C@H](C)c3ccc(F)cc3)C2=O)cccc1[N+](=O)[O-] ZINC000453064184 568322415 /nfs/dbraw/zinc/32/24/15/568322415.db2.gz ONKWOAKAYOIUEH-CXAGYDPISA-N 0 0 357.385 3.816 20 5 FHBDRN CCOc1ccc([C@H](C)NC(=O)CCOc2cc(C)ccc2[N+](=O)[O-])cc1 ZINC000031535314 568332721 /nfs/dbraw/zinc/33/27/21/568332721.db2.gz QDBRTFGXNJBNQD-HNNXBMFYSA-N 0 0 372.421 3.948 20 5 FHBDRN O=C(CCCc1nc(-c2ccc(F)cc2)no1)Nc1ccc([N+](=O)[O-])cc1 ZINC000031702218 568335972 /nfs/dbraw/zinc/33/59/72/568335972.db2.gz FKOVTBYUJYXNAO-UHFFFAOYSA-N 0 0 370.340 3.745 20 5 FHBDRN COC1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)CC1 ZINC000049622104 568339165 /nfs/dbraw/zinc/33/91/65/568339165.db2.gz PGUXCSVFIUMPCD-UHFFFAOYSA-N 0 0 356.378 3.638 20 5 FHBDRN O=C(NCCNc1ccccc1[N+](=O)[O-])C1(c2ccccc2)CCCC1 ZINC000032418569 568389648 /nfs/dbraw/zinc/38/96/48/568389648.db2.gz ALBJAQMCJNBIKX-UHFFFAOYSA-N 0 0 353.422 3.635 20 5 FHBDRN CC(C)(C)c1nc2cc(NC(=O)COc3ccccc3[N+](=O)[O-])ccc2[nH]1 ZINC000032465252 568391077 /nfs/dbraw/zinc/39/10/77/568391077.db2.gz YPMWSYMNFRFGOA-UHFFFAOYSA-N 0 0 368.393 3.786 20 5 FHBDRN C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CC[C@@H](c2ccccc2F)C1 ZINC000569345244 568395712 /nfs/dbraw/zinc/39/57/12/568395712.db2.gz LHPANDPUTYHYHS-UONOGXRCSA-N 0 0 357.385 3.550 20 5 FHBDRN C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CC[C@H](c2ccccc2F)C1 ZINC000569345243 568395718 /nfs/dbraw/zinc/39/57/18/568395718.db2.gz LHPANDPUTYHYHS-KGLIPLIRSA-N 0 0 357.385 3.550 20 5 FHBDRN CC(C)(NC(=O)c1c[nH]c(=O)c2ccccc12)c1ccccc1[N+](=O)[O-] ZINC000569483470 568399104 /nfs/dbraw/zinc/39/91/04/568399104.db2.gz FDLYJUNBEMWHQL-UHFFFAOYSA-N 0 0 351.362 3.514 20 5 FHBDRN Cc1ccc(Cl)c(NC(=O)N2CCOc3ccc([N+](=O)[O-])cc3C2)c1 ZINC000569413516 568401219 /nfs/dbraw/zinc/40/12/19/568401219.db2.gz JQQDWBUESIKNHD-UHFFFAOYSA-N 0 0 361.785 3.983 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)[C@@H]1CCc2cccc(O)c21 ZINC000569427182 568402069 /nfs/dbraw/zinc/40/20/69/568402069.db2.gz HSLOMTVSFLCXKQ-QGZVFWFLSA-N 0 0 354.406 3.767 20 5 FHBDRN Cc1cc(NC2CC(C(F)(F)F)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000569525079 568405357 /nfs/dbraw/zinc/40/53/57/568405357.db2.gz ROMUWSLEKULWLI-UHFFFAOYSA-N 0 0 352.316 3.535 20 5 FHBDRN CCCNC(=O)Nc1cccc(OCc2ccc([N+](=O)[O-])c(OC)c2)c1 ZINC000569533064 568405911 /nfs/dbraw/zinc/40/59/11/568405911.db2.gz AABDBXJMDSINQP-UHFFFAOYSA-N 0 0 359.382 3.714 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CSc1ccc2c(c1)OCCCO2 ZINC000006436722 568406987 /nfs/dbraw/zinc/40/69/87/568406987.db2.gz ZXYPIUZBCRQJAU-UHFFFAOYSA-N 0 0 374.418 3.795 20 5 FHBDRN C[C@@H](c1cccs1)N(C)C(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000032825736 568409705 /nfs/dbraw/zinc/40/97/05/568409705.db2.gz SKIDMWZYSUMSSO-LBPRGKRZSA-N 0 0 356.407 3.675 20 5 FHBDRN COC(=O)c1ccccc1NC(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000032892033 568411848 /nfs/dbraw/zinc/41/18/48/568411848.db2.gz PPRIYXPCXIDBQW-LLVKDONJSA-N 0 0 360.391 3.501 20 5 FHBDRN COCCOc1ccc(NC(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000569778234 568423925 /nfs/dbraw/zinc/42/39/25/568423925.db2.gz BXZAOIMXGOYZGO-AWEZNQCLSA-N 0 0 358.394 3.671 20 5 FHBDRN CC(C)OCc1nc([C@@H](C)NCc2ccc(C(C)C)c([N+](=O)[O-])c2)no1 ZINC000569866638 568432031 /nfs/dbraw/zinc/43/20/31/568432031.db2.gz OFJNMVIPKYZIGS-CYBMUJFWSA-N 0 0 362.430 3.877 20 5 FHBDRN COc1ccccc1N(C(C)C)S(=O)(=O)c1c(C)cccc1[N+](=O)[O-] ZINC000569891798 568433973 /nfs/dbraw/zinc/43/39/73/568433973.db2.gz QFTVCKYHDGMWCJ-UHFFFAOYSA-N 0 0 364.423 3.516 20 5 FHBDRN CO[C@@H](C)CN(C)C(=O)c1ccc(SCCC(C)C)c([N+](=O)[O-])c1 ZINC000570031836 568442036 /nfs/dbraw/zinc/44/20/36/568442036.db2.gz NEQXRFQGKVJWDX-ZDUSSCGKSA-N 0 0 354.472 3.840 20 5 FHBDRN C[C@H](c1ccco1)N(C)c1nnc(-c2ccc([N+](=O)[O-])cc2)n1C1CC1 ZINC000569983291 568445634 /nfs/dbraw/zinc/44/56/34/568445634.db2.gz QDKDCTLSZAIFIY-GFCCVEGCSA-N 0 0 353.382 3.979 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N[C@@H]1COc2ccc(F)cc2C1 ZINC000570004250 568449252 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3.941 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)c1nc(-c2ccc3n[nH]nc3c2)no1 ZINC000570454147 568478122 /nfs/dbraw/zinc/47/81/22/568478122.db2.gz UKULERMXRBHBRO-GFCCVEGCSA-N 0 0 364.365 3.652 20 5 FHBDRN CCS[C@@H]1CCC[C@@H](NC(=O)CCNc2ccccc2[N+](=O)[O-])C1 ZINC000482233753 568487244 /nfs/dbraw/zinc/48/72/44/568487244.db2.gz ZAJCGGZYXPZQPP-ZIAGYGMSSA-N 0 0 351.472 3.577 20 5 FHBDRN Cc1c(Cl)cc(S(=O)(=O)Nc2ccc(F)c(F)c2)cc1[N+](=O)[O-] ZINC000007418708 568505461 /nfs/dbraw/zinc/50/54/61/568505461.db2.gz LTKQOEIFSRTNLT-UHFFFAOYSA-N 0 0 362.741 3.636 20 5 FHBDRN CCc1ccc(CN(C)C(=O)COc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000007489737 568521696 /nfs/dbraw/zinc/52/16/96/568521696.db2.gz CIVUCVRIAGWHPA-UHFFFAOYSA-N 0 0 362.813 3.848 20 5 FHBDRN CC[C@H](CN(CC)C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2)c1ccccc1 ZINC000482250009 568528382 /nfs/dbraw/zinc/52/83/82/568528382.db2.gz QHYTYURPFHPMBP-CQSZACIVSA-N 0 0 370.405 3.979 20 5 FHBDRN C[C@H](c1ccccc1)[C@H](C)NC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 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FHBDRN COc1cc([N+](=O)[O-])ccc1CN[C@@H](CO)c1c(Cl)cccc1Cl ZINC000430236446 928381008 /nfs/dbraw/zinc/38/10/08/928381008.db2.gz AVLRXCAQYVCTED-AWEZNQCLSA-N 0 0 371.220 3.733 20 5 FHBDRN COC[C@H](NCc1ccc([N+](=O)[O-])cc1OC)c1ccc(Cl)cc1 ZINC000430238396 928392295 /nfs/dbraw/zinc/39/22/95/928392295.db2.gz HQPHIBRPRKBKJL-INIZCTEOSA-N 0 0 350.802 3.734 20 5 FHBDRN O=C(C=Cc1ccc([N+](=O)[O-])cc1)N1CCC[C@H]1CC(=O)c1cccs1 ZINC000254944960 928426077 /nfs/dbraw/zinc/42/60/77/928426077.db2.gz ORXOBQFDLUZUCN-BJIFSAINSA-N 0 0 370.430 3.934 20 5 FHBDRN C[C@@H]1C[C@H](c2ccccc2)N(c2sc(S(C)(=O)=O)cc2[N+](=O)[O-])C1 ZINC000286235505 928432438 /nfs/dbraw/zinc/43/24/38/928432438.db2.gz CPCXZEKRYRGUBG-DGCLKSJQSA-N 0 0 366.464 3.647 20 5 FHBDRN COc1ccc(OCC(=O)N[C@@H](c2ccc(C)cc2)C2CC2)c([N+](=O)[O-])c1 ZINC000248129509 937253319 /nfs/dbraw/zinc/25/33/19/937253319.db2.gz AHYVPAGWUGPVLL-FQEVSTJZSA-N 0 0 370.405 3.558 20 5 FHBDRN O=[N+]([O-])c1c(N[C@@H]2c3ccccc3CC23CCOCC3)nc2sccn21 ZINC000583236241 937261650 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FHBDRN CC(C)n1cc([C@@H](C)NC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)cn1 ZINC000547709213 928765369 /nfs/dbraw/zinc/76/53/69/928765369.db2.gz MQISFILDFQIBGD-CQSZACIVSA-N 0 0 374.444 3.950 20 5 FHBDRN O=C(c1ccc2[nH]c3ccccc3c(=O)c2c1)N1CCc2ccccc2CC1 ZINC000547712164 928801852 /nfs/dbraw/zinc/80/18/52/928801852.db2.gz UOQKMZFKFJGKOM-UHFFFAOYSA-N 0 0 368.436 3.922 20 5 FHBDRN CCN(CC)C(=S)Sc1ncc([N+](=O)[O-])c(C)c1Br ZINC000753996408 928873222 /nfs/dbraw/zinc/87/32/22/928873222.db2.gz XEYQOHXSZILNDQ-UHFFFAOYSA-N 0 0 364.290 3.780 20 5 FHBDRN Cc1ccc(NC(=O)N[C@@H](C)c2noc(-c3ccccc3)n2)cc1[N+](=O)[O-] ZINC000134426480 928895331 /nfs/dbraw/zinc/89/53/31/928895331.db2.gz NSHIJTKPZMSSRB-LBPRGKRZSA-N 0 0 367.365 3.836 20 5 FHBDRN O=C1Nc2cc(Cl)ccc2[C@H]1C1CCN(c2ccncc2[N+](=O)[O-])CC1 ZINC000608975136 928930436 /nfs/dbraw/zinc/93/04/36/928930436.db2.gz RJMWIWNHSLGIBZ-QGZVFWFLSA-N 0 0 372.812 3.596 20 5 FHBDRN COC1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cc2[N+](=O)[O-])CC1 ZINC000608972534 928930574 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Cc1c(NC(=O)CC[N@@H+]2CCc3ccc(Cl)cc3C2)cccc1[N+](=O)[O-] ZINC000535615804 928988670 /nfs/dbraw/zinc/98/86/70/928988670.db2.gz GNNDFFAQWYEJCJ-UHFFFAOYSA-N 0 0 373.840 3.944 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2cnn(Cc3nccn3Cc3ccccc3)c2)cc1 ZINC000609150922 929014342 /nfs/dbraw/zinc/01/43/42/929014342.db2.gz KVHPTYNIZITIJT-UHFFFAOYSA-N 0 0 359.389 3.751 20 5 FHBDRN O=c1nc(-c2ccc([N+](=O)[O-])s2)[nH]c2sc3c(c21)CCCS3 ZINC000165047445 929085837 /nfs/dbraw/zinc/08/58/37/929085837.db2.gz KBDPYNGSUOEGLY-UHFFFAOYSA-N 0 0 351.434 3.660 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CCc3ccc(C)cc32)cc1OC ZINC000609303629 929104642 /nfs/dbraw/zinc/10/46/42/929104642.db2.gz BDURPMLBFPPSGP-MRXNPFEDSA-N 0 0 370.405 3.728 20 5 FHBDRN Cc1cc(C(=O)COc2cc(F)cc([N+](=O)[O-])c2)c(C)n1CC(F)(F)F ZINC000135340427 937304027 /nfs/dbraw/zinc/30/40/27/937304027.db2.gz QJHPMEZUXTWOFW-UHFFFAOYSA-N 0 0 374.290 3.976 20 5 FHBDRN Cc1noc(C)c1[C@@H](C)CNC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000154660548 929126415 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929311086 /nfs/dbraw/zinc/31/10/86/929311086.db2.gz GSSQKFJOKIXZOF-UHFFFAOYSA-N 0 0 363.464 3.891 20 5 FHBDRN Cc1ccc([C@@]2(C)NC(=O)N(Cc3ccc(Cl)cc3[N+](=O)[O-])C2=O)cc1 ZINC000609693423 929314346 /nfs/dbraw/zinc/31/43/46/929314346.db2.gz VXUSEKTYQYXJBF-GOSISDBHSA-N 0 0 373.796 3.524 20 5 FHBDRN C[C@H]1CCC[C@H](OCc2cccc(NC(=O)c3c[nH]nc3[N+](=O)[O-])c2)C1 ZINC000547757638 929373616 /nfs/dbraw/zinc/37/36/16/929373616.db2.gz CMGQSVAEPPDALO-WFASDCNBSA-N 0 0 358.398 3.666 20 5 FHBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCC[C@@H](c2ccncn2)C1 ZINC001167100852 929377444 /nfs/dbraw/zinc/37/74/44/929377444.db2.gz OMBLZRWYIDLZTL-OAHLLOKOSA-N 0 0 356.426 3.552 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)Nc2ccc(OC3COC3)cc2)cc1[N+](=O)[O-] ZINC000187189723 929390930 /nfs/dbraw/zinc/39/09/30/929390930.db2.gz XNODVJSLNJZVHD-CYBMUJFWSA-N 0 0 371.393 3.564 20 5 FHBDRN COC(=O)c1ccc2nc(SCc3c(F)cccc3[N+](=O)[O-])oc2c1 ZINC000609752937 929403423 /nfs/dbraw/zinc/40/34/23/929403423.db2.gz VWNSSPDTBZEZJD-UHFFFAOYSA-N 0 0 362.338 3.954 20 5 FHBDRN O=[N+]([O-])c1ccc(CSc2ccc3nnc(-c4ccccc4)n3n2)cc1 ZINC000060132754 929412265 /nfs/dbraw/zinc/41/22/65/929412265.db2.gz FCZHFFQPQJKGRF-UHFFFAOYSA-N 0 0 363.402 3.992 20 5 FHBDRN C[C@H](C(=O)Nc1ccc(Nc2ncccn2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000583301732 937328376 /nfs/dbraw/zinc/32/83/76/937328376.db2.gz FUPGXFILLLTCSU-ZDUSSCGKSA-N 0 0 363.377 3.871 20 5 FHBDRN Cc1c(NC(=O)NCCc2ccccc2[N+](=O)[O-])cnn1CCC(C)C ZINC000467991887 929441523 /nfs/dbraw/zinc/44/15/23/929441523.db2.gz CPXYZFPQLPJARZ-UHFFFAOYSA-N 0 0 359.430 3.510 20 5 FHBDRN C[C@H](NC(=O)COc1cc(F)cc([N+](=O)[O-])c1)c1ccccc1Cl ZINC000135353408 937334762 /nfs/dbraw/zinc/33/47/62/937334762.db2.gz GEBIUQBHEOTKPO-JTQLQIEISA-N 0 0 352.749 3.644 20 5 FHBDRN CC1(C)[C@@H]2CN(C(=O)c3ccc(NCc4ccccc4)c([N+](=O)[O-])c3)C[C@@H]21 ZINC000610243626 929507973 /nfs/dbraw/zinc/50/79/73/929507973.db2.gz UAPKXUXAJBIKHD-CALCHBBNSA-N 0 0 365.433 3.935 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)c1nccnc1Sc1ccccc1 ZINC000544046216 937336123 /nfs/dbraw/zinc/33/61/23/937336123.db2.gz PEMTUFDIDNJEQJ-UHFFFAOYSA-N 0 0 352.375 3.788 20 5 FHBDRN CCN(C(=O)COc1ccc([N+](=O)[O-])cc1)[C@H](C)c1cccc(OC)c1 ZINC000248257739 937336819 /nfs/dbraw/zinc/33/68/19/937336819.db2.gz UBWBLFSCDKNAJP-CQSZACIVSA-N 0 0 358.394 3.592 20 5 FHBDRN Cc1cnn(Cc2ccccc2F)c1NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000187206635 929540253 /nfs/dbraw/zinc/54/02/53/929540253.db2.gz VMSHGRZHWWNXCT-UHFFFAOYSA-N 0 0 354.341 3.539 20 5 FHBDRN Cc1cnn(Cc2ccccc2F)c1NC(=O)c1ccc(C)c([N+](=O)[O-])c1 ZINC000187211260 929553858 /nfs/dbraw/zinc/55/38/58/929553858.db2.gz AIYQXNBVSGTPLB-UHFFFAOYSA-N 0 0 368.368 3.848 20 5 FHBDRN O=C(Nc1ccc(OCCc2ccccc2)nc1)c1ccccc1[N+](=O)[O-] ZINC000134899831 929562103 /nfs/dbraw/zinc/56/21/03/929562103.db2.gz WGRKZTCGPCDHBR-UHFFFAOYSA-N 0 0 363.373 3.864 20 5 FHBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)NC1(c2cccc(F)c2)CCOCC1 ZINC000255047469 929579475 /nfs/dbraw/zinc/57/94/75/929579475.db2.gz XVWSUBKOYMRJCE-TWGQIWQCSA-N 0 0 370.380 3.569 20 5 FHBDRN O=C(NCC[C@H](O)C1CC1)c1cc([N+](=O)[O-])ccc1SC1CCCC1 ZINC000890722838 929592811 /nfs/dbraw/zinc/59/28/11/929592811.db2.gz RHRCOXBPMVTZDH-INIZCTEOSA-N 0 0 364.467 3.520 20 5 FHBDRN O=C(N[C@H]1C[C@H]1c1c(F)cccc1Cl)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000120743277 929603915 /nfs/dbraw/zinc/60/39/15/929603915.db2.gz JWVJHJIRSHGQDQ-UHLUBPPHSA-N 0 0 370.714 3.951 20 5 FHBDRN CC(C)(NC(=O)N[C@@H]1C[C@H]1c1ccccc1F)c1ccc([N+](=O)[O-])cc1 ZINC000080116612 937345551 /nfs/dbraw/zinc/34/55/51/937345551.db2.gz WAVYFUIJWYLPAW-DOTOQJQBSA-N 0 0 357.385 3.824 20 5 FHBDRN COc1ccccc1[C@@H](CC(C)C)NC(=O)COc1ccccc1[N+](=O)[O-] ZINC000471446779 929651948 /nfs/dbraw/zinc/65/19/48/929651948.db2.gz MDQXUEAPMHZEMQ-MRXNPFEDSA-N 0 0 372.421 3.886 20 5 FHBDRN Cc1ccnc(OC2CCN(c3ccc([N+](=O)[O-])c4cccnc43)CC2)c1 ZINC000611764326 937351743 /nfs/dbraw/zinc/35/17/43/937351743.db2.gz VEQIZFFFEUQOCM-UHFFFAOYSA-N 0 0 364.405 3.894 20 5 FHBDRN CN(CC(=O)N[C@H](CC1CC1)c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000610294769 929697320 /nfs/dbraw/zinc/69/73/20/929697320.db2.gz WFEHVSSTSFVYRL-QGZVFWFLSA-N 0 0 353.422 3.689 20 5 FHBDRN C[C@@H](c1nnc(-c2ccccc2)o1)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000375626779 929716989 /nfs/dbraw/zinc/71/69/89/929716989.db2.gz ZAMHPTNJAKOJCW-AWEZNQCLSA-N 0 0 352.394 3.880 20 5 FHBDRN C[C@@H](c1ncc(C(C)(C)C)o1)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000177633970 929722036 /nfs/dbraw/zinc/72/20/36/929722036.db2.gz SUBVBOWJAVQAIK-AWEZNQCLSA-N 0 0 358.442 3.764 20 5 FHBDRN Cc1nc(NC(=O)c2cc(NC(=O)C(C)(C)C)ccc2F)ccc1[N+](=O)[O-] ZINC000134034070 929723735 /nfs/dbraw/zinc/72/37/35/929723735.db2.gz YQHPSQNNFISHGN-UHFFFAOYSA-N 0 0 374.372 3.674 20 5 FHBDRN CCCCO[C@H]1C[C@@H](NC(=O)c2c(Cl)cccc2[N+](=O)[O-])C1(C)C ZINC000177642465 929727625 /nfs/dbraw/zinc/72/76/25/929727625.db2.gz FQRHQKDLSQIQKN-KGLIPLIRSA-N 0 0 354.834 3.962 20 5 FHBDRN COc1ccc(C(=O)N(C)c2ccc([N+](=O)[O-])cc2)cc1-c1ccccn1 ZINC000165451441 929761661 /nfs/dbraw/zinc/76/16/61/929761661.db2.gz FQVWFTOQPXPLKR-UHFFFAOYSA-N 0 0 363.373 3.942 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@@H](Cc3ccccc3)[C@H]2C)c1 ZINC000471462457 929763615 /nfs/dbraw/zinc/76/36/15/929763615.db2.gz NFVNUBXZNSRNSK-ZBFHGGJFSA-N 0 0 354.406 3.697 20 5 FHBDRN Cn1ncc([N+](=O)[O-])c1C(=O)Nc1cc(Cl)ccc1OC1CCCC1 ZINC000187305450 929766222 /nfs/dbraw/zinc/76/62/22/929766222.db2.gz PUVLMVYYMGUUDJ-UHFFFAOYSA-N 0 0 364.789 3.555 20 5 FHBDRN CCS[C@@H]1CCC[C@@H]1NC(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000175824826 929769343 /nfs/dbraw/zinc/76/93/43/929769343.db2.gz LQTUHWRHUMKZET-WCQYABFASA-N 0 0 373.272 3.761 20 5 FHBDRN CC(C)(C)OC(=O)Cc1cccc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2)c1 ZINC000610306989 929776768 /nfs/dbraw/zinc/77/67/68/929776768.db2.gz QNWMSEMBQQDZOO-UHFFFAOYSA-N 0 0 374.368 3.870 20 5 FHBDRN CC(C)(C)OC(=O)Cc1cccc(NC(=O)c2csc([N+](=O)[O-])c2)c1 ZINC000610306880 929777039 /nfs/dbraw/zinc/77/70/39/929777039.db2.gz KZHGNQGRYZHTHO-UHFFFAOYSA-N 0 0 362.407 3.793 20 5 FHBDRN O=C(CC1CCC(c2ccccc2)CC1)OCCn1cc([N+](=O)[O-])cn1 ZINC000748124418 929781711 /nfs/dbraw/zinc/78/17/11/929781711.db2.gz CMINMWWYQXMWJK-UHFFFAOYSA-N 0 0 357.410 3.699 20 5 FHBDRN C[C@H](CNC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc21)c1ccc(F)cc1F ZINC000610308486 929797176 /nfs/dbraw/zinc/79/71/76/929797176.db2.gz ZGYQKNSYXKARGZ-SNVBAGLBSA-N 0 0 359.332 3.888 20 5 FHBDRN CCOC(=O)c1nc(Cl)sc1Nc1cc([N+](=O)[O-])ccc1OC ZINC001210444940 929799515 /nfs/dbraw/zinc/79/95/15/929799515.db2.gz QFMNLRXQGVCBKL-UHFFFAOYSA-N 0 0 357.775 3.634 20 5 FHBDRN CCO[C@H]1C[C@H](NC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)C12CCCC2 ZINC000610309569 929807170 /nfs/dbraw/zinc/80/71/70/929807170.db2.gz OTJREYLXSWYHRE-IRXDYDNUSA-N 0 0 357.410 3.544 20 5 FHBDRN CCO[C@@H]1C[C@@H](NC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)C12CCCC2 ZINC000610309567 929807287 /nfs/dbraw/zinc/80/72/87/929807287.db2.gz OTJREYLXSWYHRE-IAGOWNOFSA-N 0 0 357.410 3.544 20 5 FHBDRN Cc1ccc(OC[C@@H](O)COc2ccc([N+](=O)[O-])c3ncccc23)c(C)c1 ZINC000471472388 929844071 /nfs/dbraw/zinc/84/40/71/929844071.db2.gz RSKZBOSJYRMHFB-OAHLLOKOSA-N 0 0 368.389 3.579 20 5 FHBDRN COC(=O)c1cc(NC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)ccc1C ZINC000471474783 929855726 /nfs/dbraw/zinc/85/57/26/929855726.db2.gz DUYPFEVBTUMDNR-LBPRGKRZSA-N 0 0 374.418 3.809 20 5 FHBDRN CC(C)c1ccc(C(=O)NCc2nc3cc(F)ccc3o2)cc1[N+](=O)[O-] ZINC000580014388 929862570 /nfs/dbraw/zinc/86/25/70/929862570.db2.gz KHQLIVBMHUKIPH-UHFFFAOYSA-N 0 0 357.341 3.929 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N1CCO[C@@H](c2ccccc2C)C1 ZINC000610316866 929872576 /nfs/dbraw/zinc/87/25/76/929872576.db2.gz GZJUFSPLCBVQTC-GOSISDBHSA-N 0 0 371.393 3.517 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N1CCO[C@H](c2ccccc2C)C1 ZINC000610316867 929873861 /nfs/dbraw/zinc/87/38/61/929873861.db2.gz GZJUFSPLCBVQTC-SFHVURJKSA-N 0 0 371.393 3.517 20 5 FHBDRN COc1ccc2c(c1)OCC[C@H]2NC(=O)Nc1ccc(C)c([N+](=O)[O-])c1 ZINC000610316922 929874623 /nfs/dbraw/zinc/87/46/23/929874623.db2.gz KQHYWBZHAUOUHG-OAHLLOKOSA-N 0 0 357.366 3.557 20 5 FHBDRN C[C@@H](NCc1ccc([N+](=O)[O-])cc1)c1ncc(Br)cc1F ZINC000187317979 929909607 /nfs/dbraw/zinc/90/96/07/929909607.db2.gz XFZGYRPOJZCFKV-SECBINFHSA-N 0 0 354.179 3.742 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCOCC3(CCCC3)C2)c(Br)c1 ZINC000302440869 929937068 /nfs/dbraw/zinc/93/70/68/929937068.db2.gz RGJBLSSRXUNLEN-UHFFFAOYSA-N 0 0 355.232 3.754 20 5 FHBDRN Cc1cc(OCC(=O)Nc2ccc(-c3ccccn3)cc2)ccc1[N+](=O)[O-] ZINC000583353306 937372412 /nfs/dbraw/zinc/37/24/12/937372412.db2.gz KXYIHTFVTRHEDA-UHFFFAOYSA-N 0 0 363.373 3.983 20 5 FHBDRN Cc1ccc(CN(C)C(=O)c2ccc([N+](=O)[O-])cc2Br)cc1 ZINC000610036361 929964160 /nfs/dbraw/zinc/96/41/60/929964160.db2.gz OUMSXBMRXYSJTK-UHFFFAOYSA-N 0 0 363.211 3.938 20 5 FHBDRN CC[C@@H](C(=O)OCCn1cc([N+](=O)[O-])cn1)c1cccc(C(F)(F)F)c1 ZINC000175851451 929966129 /nfs/dbraw/zinc/96/61/29/929966129.db2.gz KYYRGFPYTBHHLB-CQSZACIVSA-N 0 0 371.315 3.547 20 5 FHBDRN Cc1cccc(C(=O)N[C@@H]2CCN(c3cccc(Cl)c3)C2)c1[N+](=O)[O-] ZINC000430474746 930020114 /nfs/dbraw/zinc/02/01/14/930020114.db2.gz QFTMDMXJWBNREP-CQSZACIVSA-N 0 0 359.813 3.565 20 5 FHBDRN Cc1nn(CCC(=O)N[C@H](C)[C@@H](C)C2CCCCC2)c(C)c1[N+](=O)[O-] ZINC000176695379 937378846 /nfs/dbraw/zinc/37/88/46/937378846.db2.gz NUZDYJOFOVYPFQ-CHWSQXEVSA-N 0 0 350.463 3.519 20 5 FHBDRN C/C(=C\C(=O)OCc1c(C)nn(C(F)F)c1C)c1ccc([N+](=O)[O-])cc1 ZINC000784994985 930029772 /nfs/dbraw/zinc/02/97/72/930029772.db2.gz FLIBEBQREQWSEO-CSKARUKUSA-N 0 0 365.336 3.950 20 5 FHBDRN CCc1cccc(OCC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)c1 ZINC000610046737 930035553 /nfs/dbraw/zinc/03/55/53/930035553.db2.gz CTQCMDMEDGKELX-UHFFFAOYSA-N 0 0 356.422 3.675 20 5 FHBDRN C[C@@H]1C(=O)CC[C@@H](C(=O)NCc2cc([N+](=O)[O-])ccc2Cl)C1(C)C ZINC000275726091 930051775 /nfs/dbraw/zinc/05/17/75/930051775.db2.gz WTKGXOKJPSMWPX-MFKMUULPSA-N 0 0 352.818 3.506 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@@H](C)Sc1ccc(F)cc1 ZINC001266555111 930058569 /nfs/dbraw/zinc/05/85/69/930058569.db2.gz JRBPQJARORDEID-LLVKDONJSA-N 0 0 364.398 3.540 20 5 FHBDRN COc1ccc2c(c1)CCCN(C(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1)C2 ZINC000610064058 930061274 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20 5 FHBDRN COc1cc(C)ccc1C(=O)N1CCS[C@@H]1c1ccc([N+](=O)[O-])cc1 ZINC000548039095 930109906 /nfs/dbraw/zinc/10/99/06/930109906.db2.gz KGZRDHPMHZOFJD-GOSISDBHSA-N 0 0 358.419 3.800 20 5 FHBDRN O=C(COc1cc(F)cc([N+](=O)[O-])c1)Nc1ccccc1C(F)(F)F ZINC000135359673 937389678 /nfs/dbraw/zinc/38/96/78/937389678.db2.gz JLFCNFCXNVBFKE-UHFFFAOYSA-N 0 0 358.247 3.770 20 5 FHBDRN Cc1nn(Cc2ccc(C(=O)Nc3ccsc3)cc2)c(C)c1[N+](=O)[O-] ZINC000135363563 937390071 /nfs/dbraw/zinc/39/00/71/937390071.db2.gz QGWGVYBXUWVHIZ-UHFFFAOYSA-N 0 0 356.407 3.770 20 5 FHBDRN O=C(NCc1ccc(F)cc1F)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000463310392 930123106 /nfs/dbraw/zinc/12/31/06/930123106.db2.gz PCHXUKILCORPDD-UHFFFAOYSA-N 0 0 360.238 3.822 20 5 FHBDRN CCc1cc(NC(=O)c2ccc(SCCC(C)C)c([N+](=O)[O-])c2)no1 ZINC000610076002 930135867 /nfs/dbraw/zinc/13/58/67/930135867.db2.gz XCKCVNDGZIWBKZ-UHFFFAOYSA-N 0 0 363.439 3.958 20 5 FHBDRN Cc1nc(C)c(/C=C2/N=C(c3ccc(Cl)c([N+](=O)[O-])c3)OC2=O)s1 ZINC000255166950 930143462 /nfs/dbraw/zinc/14/34/62/930143462.db2.gz YWHRMOQIMITIAI-IZZDOVSWSA-N 0 0 363.782 3.666 20 5 FHBDRN CCSc1ccc(-c2noc(CCn3cc([N+](=O)[O-])nc3C)n2)cc1 ZINC000278226741 937393072 /nfs/dbraw/zinc/39/30/72/937393072.db2.gz PHRRHQWPAZCLBG-UHFFFAOYSA-N 0 0 359.411 3.504 20 5 FHBDRN CO[C@@H]1C[C@H](c2ccccc2)CC[C@@H]1NC(=O)c1ccc([N+](=O)[O-])s1 ZINC000560801270 930188405 /nfs/dbraw/zinc/18/84/05/930188405.db2.gz GBAPWZMGXOLMOU-QLFBSQMISA-N 0 0 360.435 3.737 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C(=O)OCc2cccc([N+](=O)[O-])c2)cc1Cl ZINC001125418388 930216377 /nfs/dbraw/zinc/21/63/77/930216377.db2.gz DZJWBVCVAPQFSO-UHFFFAOYSA-N 0 0 350.714 3.822 20 5 FHBDRN O=[N+]([O-])c1ccc(S(=O)(=O)Nc2ccc(Oc3cccnc3)cc2)cc1 ZINC000580087403 930227617 /nfs/dbraw/zinc/22/76/17/930227617.db2.gz UFIQLYXSHJFWDI-UHFFFAOYSA-N 0 0 371.374 3.583 20 5 FHBDRN C[C@@H](Nc1ccc([N+](=O)[O-])c2cnccc12)c1ccc2c(c1)CC(=O)N2C ZINC000728287040 930282071 /nfs/dbraw/zinc/28/20/71/930282071.db2.gz RLYBDWOZVILSES-GFCCVEGCSA-N 0 0 362.389 3.835 20 5 FHBDRN CNC(=O)c1cc([N+](=O)[O-])ccc1N[C@H]1CCc2sc(Cl)cc21 ZINC000580138520 930293947 /nfs/dbraw/zinc/29/39/47/930293947.db2.gz ZFRNXGRJBFUUAN-NSHDSACASA-N 0 0 351.815 3.769 20 5 FHBDRN NC(=O)c1ccc(N2Cc3ccccc3[C@@H](c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000580137450 930296355 /nfs/dbraw/zinc/29/63/55/930296355.db2.gz YTBHICFOWMPFFO-LJQANCHMSA-N 0 0 373.412 3.846 20 5 FHBDRN CNC(=O)c1ccc(NCCc2cccc(Cl)c2Cl)c([N+](=O)[O-])c1 ZINC000064914588 930311382 /nfs/dbraw/zinc/31/13/82/930311382.db2.gz HNGHSKKVDTVYNB-UHFFFAOYSA-N 0 0 368.220 3.916 20 5 FHBDRN O=[N+]([O-])c1c(NCCc2ccccc2C(F)(F)F)nc2sccn21 ZINC000064915747 930313028 /nfs/dbraw/zinc/31/30/28/930313028.db2.gz RENZOGQPCQIILY-UHFFFAOYSA-N 0 0 356.329 3.977 20 5 FHBDRN COc1ccc(COc2c(Br)cccc2OC)cc1[N+](=O)[O-] ZINC000121172468 930325630 /nfs/dbraw/zinc/32/56/30/930325630.db2.gz XKSYCYPBBYFKCO-UHFFFAOYSA-N 0 0 368.183 3.954 20 5 FHBDRN O=[N+]([O-])c1cccc(OC[C@@H](O)CNc2ccc(CC(F)(F)F)cc2)c1 ZINC000580185757 930343818 /nfs/dbraw/zinc/34/38/18/930343818.db2.gz VIPDYCRKDKNPBP-HNNXBMFYSA-N 0 0 370.327 3.551 20 5 FHBDRN O=C(Nc1ccc(F)c([N+](=O)[O-])c1)c1cc(Br)cnc1Cl ZINC000050044895 930372701 /nfs/dbraw/zinc/37/27/01/930372701.db2.gz FIDALQPPBGFCEV-UHFFFAOYSA-N 0 0 374.553 3.797 20 5 FHBDRN CCCC[C@@H](C)N(CCCC)C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000580233360 930391126 /nfs/dbraw/zinc/39/11/26/930391126.db2.gz UHHAEXFWBMUILB-OAHLLOKOSA-N 0 0 373.457 3.997 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H](c1nc(C2CC2)no1)C(C)C ZINC000162996230 937415682 /nfs/dbraw/zinc/41/56/82/937415682.db2.gz NEBJPTGNVINPGZ-CQSZACIVSA-N 0 0 359.386 3.682 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N1CCOc2ccc(F)cc2C1 ZINC000580279572 930439135 /nfs/dbraw/zinc/43/91/35/930439135.db2.gz KSQNKZBKXSHIMH-UHFFFAOYSA-N 0 0 359.357 3.723 20 5 FHBDRN CSc1ccc(F)cc1CNc1cc2nc[nH]c(=O)c2cc1[N+](=O)[O-] ZINC000610411207 930444301 /nfs/dbraw/zinc/44/43/01/930444301.db2.gz KAOFVKFYEMPKNU-UHFFFAOYSA-N 0 0 360.370 3.717 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N(CCc1cccc(F)c1)C1CC1 ZINC000070959718 930453254 /nfs/dbraw/zinc/45/32/54/930453254.db2.gz BTLRZNUCIMUCIS-UHFFFAOYSA-N 0 0 358.369 3.590 20 5 FHBDRN COc1cc(Br)cc(OC)c1OCc1ccccc1[N+](=O)[O-] ZINC000118953877 930459733 /nfs/dbraw/zinc/45/97/33/930459733.db2.gz GMGWTUZJQJJMQL-UHFFFAOYSA-N 0 0 368.183 3.954 20 5 FHBDRN O=C(NC/C=C\c1ccccc1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000255344367 930465934 /nfs/dbraw/zinc/46/59/34/930465934.db2.gz LJWOSLONVQIRGJ-TWGQIWQCSA-N 0 0 365.433 3.641 20 5 FHBDRN CC[C@@H](Cc1ccccc1)N(C)C(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000175801059 930472397 /nfs/dbraw/zinc/47/23/97/930472397.db2.gz CQFTVNVTFPVDAI-SFHVURJKSA-N 0 0 355.438 3.800 20 5 FHBDRN CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)OCC[C@H]2CCCC2=O)CC1 ZINC000748159833 930478132 /nfs/dbraw/zinc/47/81/32/930478132.db2.gz ZDACWTADMXYXHO-OAHLLOKOSA-N 0 0 374.437 3.747 20 5 FHBDRN Cc1sc(C(=O)Nc2nnc(/C=C\c3ccco3)s2)cc1[N+](=O)[O-] ZINC000255377519 930489784 /nfs/dbraw/zinc/48/97/84/930489784.db2.gz XWQMBVZNCCDHGB-PLNGDYQASA-N 0 0 362.392 3.832 20 5 FHBDRN O=C(Cc1ccc(Cl)c([N+](=O)[O-])c1)N1CC2(CCC2)[C@H]1c1ccncc1 ZINC001167379133 930494567 /nfs/dbraw/zinc/49/45/67/930494567.db2.gz MKGSJKKDLNDKHW-GOSISDBHSA-N 0 0 371.824 3.940 20 5 FHBDRN O=c1c([N+](=O)[O-])cc(Cl)cn1CCOc1c(Cl)cccc1Cl ZINC000158541328 930495361 /nfs/dbraw/zinc/49/53/61/930495361.db2.gz FQQDQCVGWRWJPO-UHFFFAOYSA-N 0 0 363.584 3.796 20 5 FHBDRN CCCN(C(=O)Cn1c(C)ncc1[N+](=O)[O-])[C@H](C)c1cc2ccccc2o1 ZINC001125441159 930516285 /nfs/dbraw/zinc/51/62/85/930516285.db2.gz HPGLWTVNHDWLPX-CYBMUJFWSA-N 0 0 370.409 3.846 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(=O)n1CC/C=C\c1ccc(Br)cc1 ZINC000471559400 930521887 /nfs/dbraw/zinc/52/18/87/930521887.db2.gz NVTSOVBMICIASA-RQOWECAXSA-N 0 0 363.211 3.931 20 5 FHBDRN Cc1noc(C(F)F)c1C(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000610431380 930524382 /nfs/dbraw/zinc/52/43/82/930524382.db2.gz IRYWPGNUVHINSI-UHFFFAOYSA-N 0 0 353.325 3.880 20 5 FHBDRN Cc1cc(N2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)ncc1[N+](=O)[O-] ZINC000610430833 930526485 /nfs/dbraw/zinc/52/64/85/930526485.db2.gz GQAMBTQUIKZREP-RKDXNWHRSA-N 0 0 357.254 3.865 20 5 FHBDRN CC[C@@H](NC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1)[C@@H]1CCCCO1 ZINC000655350939 930529460 /nfs/dbraw/zinc/52/94/60/930529460.db2.gz UQFLYSCBKKJFFM-XLIONFOSSA-N 0 0 364.445 3.759 20 5 FHBDRN Cc1ccc(-c2csc(NC(=O)CCn3cccc3)n2)cc1[N+](=O)[O-] ZINC000610432278 930530625 /nfs/dbraw/zinc/53/06/25/930530625.db2.gz SNWXUNGNIBRIOV-UHFFFAOYSA-N 0 0 356.407 3.857 20 5 FHBDRN O=C(N[C@@H]1CC[C@H]2CCCC[C@H]2C1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000610434276 930531781 /nfs/dbraw/zinc/53/17/81/930531781.db2.gz SQMBMOFVQQGHEH-HLLBOEOZSA-N 0 0 368.437 3.869 20 5 FHBDRN CCCc1nc(-c2noc(Cn3ccc4cc([N+](=O)[O-])ccc43)n2)co1 ZINC000580362847 930573046 /nfs/dbraw/zinc/57/30/46/930573046.db2.gz GTSYLHBKESNCKC-UHFFFAOYSA-N 0 0 353.338 3.588 20 5 FHBDRN CO[C@H](c1ccc(F)cc1)[C@H](C)NC(=O)c1cc([N+](=O)[O-])c(F)cc1C ZINC001266606644 930588278 /nfs/dbraw/zinc/58/82/78/930588278.db2.gz YXBZMTXKDDFMMV-GTNSWQLSSA-N 0 0 364.348 3.687 20 5 FHBDRN Cc1cc(=O)[nH]c2ccc(NC(=O)c3ccc([N+](=O)[O-])c4cccnc34)cc12 ZINC001167388896 930596409 /nfs/dbraw/zinc/59/64/09/930596409.db2.gz MYEHFGAVNYJHHP-UHFFFAOYSA-N 0 0 374.356 3.958 20 5 FHBDRN Cc1cc(NC(=O)[C@H](C)c2cccc([N+](=O)[O-])c2)ncc1Br ZINC000319538179 930614600 /nfs/dbraw/zinc/61/46/00/930614600.db2.gz KNYJIIRZQBKYRR-SNVBAGLBSA-N 0 0 364.199 3.803 20 5 FHBDRN Cc1nc(-c2cccc(NC(=O)c3cc(Cl)cc([N+](=O)[O-])c3)c2)n[nH]1 ZINC000119079711 930614772 /nfs/dbraw/zinc/61/47/72/930614772.db2.gz YVQZNHAQXLDYPS-UHFFFAOYSA-N 0 0 357.757 3.594 20 5 FHBDRN Cc1cccc([C@@H]2CCCN2C(=O)CSc2ccc([N+](=O)[O-])cc2)n1 ZINC000119088814 930637512 /nfs/dbraw/zinc/63/75/12/930637512.db2.gz HVNJJCRZUXYJFJ-KRWDZBQOSA-N 0 0 357.435 3.754 20 5 FHBDRN CCCc1n[nH]c(C(=O)N2CCC[C@H](Cc3ccc(C)cc3)C2)c1[N+](=O)[O-] ZINC000579628760 930654734 /nfs/dbraw/zinc/65/47/34/930654734.db2.gz ANKYWJCTVQYYOT-MRXNPFEDSA-N 0 0 370.453 3.674 20 5 FHBDRN CCC(CC)[C@@H]1C[C@@H](NC(=O)c2cc(F)c([N+](=O)[O-])cc2F)CCO1 ZINC000155741225 930664806 /nfs/dbraw/zinc/66/48/06/930664806.db2.gz DOAWVISVTXPRFA-ZBEGNZNMSA-N 0 0 356.369 3.587 20 5 FHBDRN Cc1cc(CNc2ccc([N+](=O)[O-])c(N3CCOCC3)c2F)ccc1F ZINC000580449998 930691153 /nfs/dbraw/zinc/69/11/53/930691153.db2.gz CUIDIJUCSMVFPV-UHFFFAOYSA-N 0 0 363.364 3.630 20 5 FHBDRN CC(=O)c1ccc(OCC(=O)N[C@@H](C)c2ccc(C)c(C)c2)c([N+](=O)[O-])c1 ZINC000119114713 930692067 /nfs/dbraw/zinc/69/20/67/930692067.db2.gz BQLKQTAXZODCRZ-AWEZNQCLSA-N 0 0 370.405 3.670 20 5 FHBDRN CO[C@@H](C)CN(C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(C)C ZINC000610121980 930723698 /nfs/dbraw/zinc/72/36/98/930723698.db2.gz JZCVGZXHBASGRT-LBPRGKRZSA-N 0 0 363.439 3.604 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N[C@@H]1CCO[C@H](CC(C)C)C1 ZINC000275892944 930724232 /nfs/dbraw/zinc/72/42/32/930724232.db2.gz RZDGXEDBQYUVKN-ZIAGYGMSSA-N 0 0 354.834 3.880 20 5 FHBDRN Cc1cc(F)ccc1C(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000119151090 930749465 /nfs/dbraw/zinc/74/94/65/930749465.db2.gz YJKBONFRQWPYEU-UHFFFAOYSA-N 0 0 358.369 3.726 20 5 FHBDRN Cc1nc(-c2c[nH]c(C(=O)N(C)Cc3ccccc3[N+](=O)[O-])c2)cs1 ZINC000046361742 930775875 /nfs/dbraw/zinc/77/58/75/930775875.db2.gz AWUUKXKIWVIGLD-UHFFFAOYSA-N 0 0 356.407 3.627 20 5 FHBDRN O=c1ccccn1Cc1ccc(CNc2c(F)cccc2[N+](=O)[O-])cc1 ZINC000561140620 930798285 /nfs/dbraw/zinc/79/82/85/930798285.db2.gz IQNQDMKSKLKXKW-UHFFFAOYSA-N 0 0 353.353 3.556 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000050292761 930824486 /nfs/dbraw/zinc/82/44/86/930824486.db2.gz BQTDUWQLRFKCLK-UHFFFAOYSA-N 0 0 370.346 3.879 20 5 FHBDRN CC(C)(C)C(=O)CNC(=O)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12 ZINC000275916376 930840727 /nfs/dbraw/zinc/84/07/27/930840727.db2.gz FRYAGFCXAHNRQB-UHFFFAOYSA-N 0 0 372.371 3.717 20 5 FHBDRN Cc1ccc(CO[C@H](C)C(=O)N2CCc3cc(C)c([N+](=O)[O-])cc32)cc1 ZINC001266623478 930872614 /nfs/dbraw/zinc/87/26/14/930872614.db2.gz PXGNWVJJLPHDFB-OAHLLOKOSA-N 0 0 354.406 3.706 20 5 FHBDRN CCc1ccc(C(=O)N2c3ccccc3NC(=O)C2(C)C)cc1[N+](=O)[O-] ZINC000579727442 930879064 /nfs/dbraw/zinc/87/90/64/930879064.db2.gz LYANYSGWAOBYRE-UHFFFAOYSA-N 0 0 353.378 3.535 20 5 FHBDRN C[C@H](CNc1ccc([N+](=O)[O-])c(N2CCOCC2)c1F)CC(F)(F)F ZINC000580581958 930884713 /nfs/dbraw/zinc/88/47/13/930884713.db2.gz OMLHNHRIEHMYKD-JTQLQIEISA-N 0 0 365.327 3.571 20 5 FHBDRN Cc1ccc(C)c(C2=NO[C@@H](C(=O)Nc3ccc([N+](=O)[O-])c(C)c3)C2)c1 ZINC001266633594 930967435 /nfs/dbraw/zinc/96/74/35/930967435.db2.gz OVBACXCJKLORRH-GOSISDBHSA-N 0 0 353.378 3.652 20 5 FHBDRN CC(C)Cn1cc(NC(=O)Cc2ccc([N+](=O)[O-])cc2)c(C(F)F)n1 ZINC000535641838 930968915 /nfs/dbraw/zinc/96/89/15/930968915.db2.gz USLMKNZCEQPJDD-UHFFFAOYSA-N 0 0 352.341 3.566 20 5 FHBDRN CC(C)[C@@H](O)CNC(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000610143380 930978458 /nfs/dbraw/zinc/97/84/58/930978458.db2.gz SQPUFEXPLRJUIS-KRWDZBQOSA-N 0 0 359.382 3.526 20 5 FHBDRN COc1ccc(NC(=O)c2cc(OC)c(C(C)C)c(OC)c2)c([N+](=O)[O-])c1 ZINC000510334762 931003472 /nfs/dbraw/zinc/00/34/72/931003472.db2.gz SBIZLOUWRXUFSV-UHFFFAOYSA-N 0 0 374.393 3.996 20 5 FHBDRN C[C@@H]1C[N@H+](Cc2ccccc2)CCN1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC001167430204 931010532 /nfs/dbraw/zinc/01/05/32/931010532.db2.gz VNZXOABSIGWNCU-OAHLLOKOSA-N 0 0 359.857 3.955 20 5 FHBDRN CCCOc1ccc(COC(=O)c2cc(OC)c(F)cc2[N+](=O)[O-])cc1 ZINC001125465495 931015038 /nfs/dbraw/zinc/01/50/38/931015038.db2.gz AYAZYKPMEBVCJT-UHFFFAOYSA-N 0 0 363.341 3.888 20 5 FHBDRN C[C@@H](NC(=O)N1CCOC2(C1)CCCCCC2)c1cccc([N+](=O)[O-])c1 ZINC000177805082 931028078 /nfs/dbraw/zinc/02/80/78/931028078.db2.gz BZTFCIACXKENQR-OAHLLOKOSA-N 0 0 361.442 3.791 20 5 FHBDRN CC[C@@H](NC(=O)CCc1cc(OC)ccc1OC)c1cccc([N+](=O)[O-])c1 ZINC000177806632 931034601 /nfs/dbraw/zinc/03/46/01/931034601.db2.gz AVKQCGAWWBHJSW-GOSISDBHSA-N 0 0 372.421 3.812 20 5 FHBDRN CCc1nc2c(s1)[C@H](N(C)C(=O)c1ccc([N+](=O)[O-])cc1F)CCC2 ZINC000119286794 931035802 /nfs/dbraw/zinc/03/58/02/931035802.db2.gz JYEYSFPVNXFZLO-CQSZACIVSA-N 0 0 363.414 3.902 20 5 FHBDRN O=C(N[C@H](Cn1cccn1)c1ccccc1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000610158788 931068378 /nfs/dbraw/zinc/06/83/78/931068378.db2.gz NFEKAPSGHAYNJG-MRXNPFEDSA-N 0 0 370.796 3.616 20 5 FHBDRN C[C@@H](CO)CCCNC(=O)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12 ZINC000275951754 931094193 /nfs/dbraw/zinc/09/41/93/931094193.db2.gz KVKYJYBODZVCGS-LLVKDONJSA-N 0 0 374.387 3.510 20 5 FHBDRN O=C(NCCOc1ccccc1F)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000437149145 945069992 /nfs/dbraw/zinc/06/99/92/945069992.db2.gz GEGPOQAIUPPFKS-UHFFFAOYSA-N 0 0 372.274 3.562 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(-c2nc(C(C)(C)c3ccccc3Cl)no2)n1 ZINC000580801097 931165045 /nfs/dbraw/zinc/16/50/45/931165045.db2.gz WTUOPIVCRWEFKY-UHFFFAOYSA-N 0 0 361.789 3.841 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N(CCc1ccccc1)[C@@H]1CCOC1 ZINC000175861629 931165986 /nfs/dbraw/zinc/16/59/86/931165986.db2.gz YBGKWAPEFGEMGW-GOSISDBHSA-N 0 0 369.421 3.769 20 5 FHBDRN Cc1nc(N(C)CCCc2cc(-c3cccc(F)c3)n[nH]2)ccc1[N+](=O)[O-] ZINC000471623697 931230978 /nfs/dbraw/zinc/23/09/78/931230978.db2.gz CNTABVBTBKYAGF-UHFFFAOYSA-N 0 0 369.400 3.896 20 5 FHBDRN O=C(/C=C\c1cncc(F)c1)Nc1ccc([N+](=O)[O-])c(Br)c1 ZINC000588390422 931238162 /nfs/dbraw/zinc/23/81/62/931238162.db2.gz AOBUEEGKUXYLIT-RJRFIUFISA-N 0 0 366.146 3.543 20 5 FHBDRN C[C@H](C(=O)N1CCCC[C@H]([C@H]2CCOC2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000891334571 931254034 /nfs/dbraw/zinc/25/40/34/931254034.db2.gz JPDLQBMJAPQRSY-KKUMJFAQSA-N 0 0 364.417 3.503 20 5 FHBDRN CCOc1ccc(C(=O)Nc2ccc(F)cc2NC2CC2)cc1[N+](=O)[O-] ZINC000119345995 931275596 /nfs/dbraw/zinc/27/55/96/931275596.db2.gz FTUXYWKBKZWVEN-UHFFFAOYSA-N 0 0 359.357 3.959 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)[C@@H](C)Oc2ccc(F)c(F)c2)cc1[N+](=O)[O-] ZINC000177846819 931286243 /nfs/dbraw/zinc/28/62/43/931286243.db2.gz WWEHWFLLKZTSTD-VXGBXAGGSA-N 0 0 364.348 3.826 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)Cc2ccc(-n3cccn3)cc2)cc1[N+](=O)[O-] ZINC000177846276 931286543 /nfs/dbraw/zinc/28/65/43/931286543.db2.gz YJSGWCNBOMNHDJ-HNNXBMFYSA-N 0 0 364.405 3.509 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])c(Cl)c1)N1CCCC[C@@H]([C@H]2CCOC2)C1 ZINC000891338216 931304564 /nfs/dbraw/zinc/30/45/64/931304564.db2.gz YJEQGXZHEIFLMA-KGLIPLIRSA-N 0 0 352.818 3.527 20 5 FHBDRN CC[C@H](CSC)N(C)C(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC001266664393 931307937 /nfs/dbraw/zinc/30/79/37/931307937.db2.gz BXRNHUYBLPGTKV-CQSZACIVSA-N 0 0 359.451 3.870 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)c2ccc(OC(F)F)cc2)cc1[N+](=O)[O-] ZINC000177860622 931333277 /nfs/dbraw/zinc/33/32/77/931333277.db2.gz DDVCHWLZCGAFIT-NSHDSACASA-N 0 0 350.321 3.996 20 5 FHBDRN COCc1cc([N+](=O)[O-])ccc1NCCc1c[nH]c2ccc(OC)cc12 ZINC000610468624 931378053 /nfs/dbraw/zinc/37/80/53/931378053.db2.gz DVWDRYZLVJBBSH-UHFFFAOYSA-N 0 0 355.394 3.886 20 5 FHBDRN CC[C@H]1CN(c2nc(C(=O)OC)ccc2[N+](=O)[O-])CC[C@@H]1c1ccccc1 ZINC000561263204 931382630 /nfs/dbraw/zinc/38/26/30/931382630.db2.gz QYCMQISOWVEKEP-HOCLYGCPSA-N 0 0 369.421 3.797 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)c2cccnc2N2CCCCC2)cc1[N+](=O)[O-] ZINC000177871873 931392818 /nfs/dbraw/zinc/39/28/18/931392818.db2.gz XEEYYLFCKFBRAH-OAHLLOKOSA-N 0 0 368.437 3.780 20 5 FHBDRN COC(=O)c1cc2cc(COc3nc(C)cc(C)c3[N+](=O)[O-])ccc2o1 ZINC000548148763 931395483 /nfs/dbraw/zinc/39/54/83/931395483.db2.gz OLIFTTXTSJDZCC-UHFFFAOYSA-N 0 0 356.334 3.718 20 5 FHBDRN Cc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2nc[nH]n2)c(F)c1 ZINC000537861833 931411267 /nfs/dbraw/zinc/41/12/67/931411267.db2.gz QRMVSCRCAGFMTA-UHFFFAOYSA-N 0 0 373.369 3.564 20 5 FHBDRN CCS[C@@H]1CCCC[C@@H]1[NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000175872800 931425949 /nfs/dbraw/zinc/42/59/49/931425949.db2.gz ORTLDCMCEPEXLR-JKSUJKDBSA-N 0 0 352.456 3.615 20 5 FHBDRN CC1CCN(C(=O)c2ccc(N3C[C@@H](C)C[C@H](C)C3)c([N+](=O)[O-])c2)CC1 ZINC000255934302 931439015 /nfs/dbraw/zinc/43/90/15/931439015.db2.gz CNYSOJCBCNFKHO-HOTGVXAUSA-N 0 0 359.470 3.949 20 5 FHBDRN CC(C)C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1N)c1nc2ccccc2[nH]1 ZINC000175880319 931456053 /nfs/dbraw/zinc/45/60/53/931456053.db2.gz IYWAVHBVGSCUHC-HNNXBMFYSA-N 0 0 367.409 3.571 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1c2ccccc2O[C@H]1C ZINC000572863892 931477203 /nfs/dbraw/zinc/47/72/03/931477203.db2.gz JUICASHPZCJXQH-NVGCLXPQSA-N 0 0 358.419 3.714 20 5 FHBDRN O=C(NCc1cscn1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000050685391 931522037 /nfs/dbraw/zinc/52/20/37/931522037.db2.gz OCBVUXTYLSCSNE-UHFFFAOYSA-N 0 0 368.418 3.593 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1CN(C)Cc1ccc(OC)c(OC)c1 ZINC000610476204 931540089 /nfs/dbraw/zinc/54/00/89/931540089.db2.gz HRJHZZIEBDUXRA-UHFFFAOYSA-N 0 0 360.410 3.643 20 5 FHBDRN Cc1cccc(C(=O)N2CCN(C3CC3)c3ccc(F)cc32)c1[N+](=O)[O-] ZINC000187369603 931573512 /nfs/dbraw/zinc/57/35/12/931573512.db2.gz PHIBWDSESJEKEW-UHFFFAOYSA-N 0 0 355.369 3.672 20 5 FHBDRN CSc1cccc(C(=O)N[C@H]2CCO[C@H](C(C)(C)C)C2)c1[N+](=O)[O-] ZINC000334077183 931608866 /nfs/dbraw/zinc/60/88/66/931608866.db2.gz YMYYBWPMIXNHJX-FZMZJTMJSA-N 0 0 352.456 3.640 20 5 FHBDRN CCn1c2cc(F)ccc2nc1NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC001266677792 931609006 /nfs/dbraw/zinc/60/90/06/931609006.db2.gz PDBVEOVVMPFGCF-LSDHHAIUSA-N 0 0 368.368 3.846 20 5 FHBDRN O=C(Cc1ccc(F)c(Cl)c1)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC001266677971 931610624 /nfs/dbraw/zinc/61/06/24/931610624.db2.gz SYHFNBVLKJJECN-UHFFFAOYSA-N 0 0 371.195 3.942 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)NC[C@@](C)(O)c2ccsc2)cc1[N+](=O)[O-] ZINC000177926523 931613990 /nfs/dbraw/zinc/61/39/90/931613990.db2.gz HTBXPLHDZHONGU-GOSISDBHSA-N 0 0 362.451 3.591 20 5 FHBDRN O=C(N[C@@H]1CCC[C@H](C2CC2)C1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000156864590 931642326 /nfs/dbraw/zinc/64/23/26/931642326.db2.gz QVWLCRDWFQGRSY-ZWKOTPCHSA-N 0 0 371.481 3.896 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)OCc1ccccc1Oc1cccnc1 ZINC000728321574 931713601 /nfs/dbraw/zinc/71/36/01/931713601.db2.gz ZOBIZXUUSOBJIR-UHFFFAOYSA-N 0 0 365.345 3.843 20 5 FHBDRN COc1ccc(C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)c(F)c1 ZINC000121287505 931735560 /nfs/dbraw/zinc/73/55/60/931735560.db2.gz NNHQCEKYWMJAGJ-UHFFFAOYSA-N 0 0 356.256 3.596 20 5 FHBDRN CNc1ccc(C(=O)N2CC[C@](F)(c3ccccc3C)C2)cc1[N+](=O)[O-] ZINC000581263027 931755226 /nfs/dbraw/zinc/75/52/26/931755226.db2.gz VOLBUYYSYDXJTN-LJQANCHMSA-N 0 0 357.385 3.656 20 5 FHBDRN CC(C)(NC(=O)COc1ccc(F)c(Cl)c1)c1ccc([N+](=O)[O-])cc1 ZINC000430545232 931771442 /nfs/dbraw/zinc/77/14/42/931771442.db2.gz HOXGZYOGPNFKOZ-UHFFFAOYSA-N 0 0 366.776 3.818 20 5 FHBDRN CCOc1ccccc1NC(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000581274950 931774710 /nfs/dbraw/zinc/77/47/10/931774710.db2.gz LLVCCQSJZZJYFY-UHFFFAOYSA-N 0 0 368.393 3.839 20 5 FHBDRN CSc1nc(C(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)c2ccccn21 ZINC000430558939 931836432 /nfs/dbraw/zinc/83/64/32/931836432.db2.gz ZMYAEIMDHABPDK-UHFFFAOYSA-N 0 0 370.434 3.630 20 5 FHBDRN Cc1cc(OCC(=O)N[C@@H](C)C(C)(C)c2ccccc2)ccc1[N+](=O)[O-] ZINC000430559608 931844098 /nfs/dbraw/zinc/84/40/98/931844098.db2.gz TVPGCOYCZHVHCE-HNNXBMFYSA-N 0 0 356.422 3.765 20 5 FHBDRN Cc1ccccc1[C@@H](C)c1noc(-c2cc([N+](=O)[O-])cc3c2OCCO3)n1 ZINC000581336059 931851695 /nfs/dbraw/zinc/85/16/95/931851695.db2.gz QCEAWSBXUOSULW-GFCCVEGCSA-N 0 0 367.361 3.876 20 5 FHBDRN Cc1cc(OCC(=O)N[C@@H](c2ccccc2)C2CCC2)ccc1[N+](=O)[O-] ZINC000430571980 931908139 /nfs/dbraw/zinc/90/81/39/931908139.db2.gz OULYFQYYJXMODN-FQEVSTJZSA-N 0 0 354.406 3.940 20 5 FHBDRN C[C@H](CNC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C1CCCCC1 ZINC000581381360 931922613 /nfs/dbraw/zinc/92/26/13/931922613.db2.gz ZNAKYZYSMIMPDE-LLVKDONJSA-N 0 0 367.833 3.519 20 5 FHBDRN Cc1cc(C)c(NC(=O)COc2c(C)c(C)ncc2[N+](=O)[O-])c(Cl)c1 ZINC000581381161 931926511 /nfs/dbraw/zinc/92/65/11/931926511.db2.gz SDEFCULVXBIMGT-UHFFFAOYSA-N 0 0 363.801 3.894 20 5 FHBDRN COc1ccc([C@H]2CCN(C(=O)c3cccc(Cl)c3[N+](=O)[O-])C2)cc1 ZINC000175997887 931947120 /nfs/dbraw/zinc/94/71/20/931947120.db2.gz JABVBZYGFJCALL-ZDUSSCGKSA-N 0 0 360.797 3.887 20 5 FHBDRN CSc1ccc([N+](=O)[O-])cc1C(=O)OCc1ncc(C(C)(C)C)o1 ZINC001266717569 931983009 /nfs/dbraw/zinc/98/30/09/931983009.db2.gz LKAOELWBLFYCAE-UHFFFAOYSA-N 0 0 350.396 3.959 20 5 FHBDRN COc1ccc(CSCC(=O)N2CCCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000510418370 931986610 /nfs/dbraw/zinc/98/66/10/931986610.db2.gz VWKYUWYUXNPKEM-ZDUSSCGKSA-N 0 0 352.456 3.628 20 5 FHBDRN CC(C)c1ccc(C(=O)OCC(=O)Nc2ccc(F)c([N+](=O)[O-])c2)cc1 ZINC000003387350 931986939 /nfs/dbraw/zinc/98/69/39/931986939.db2.gz QVVSTKSDCNICNZ-UHFFFAOYSA-N 0 0 360.341 3.653 20 5 FHBDRN O=[N+]([O-])c1ccn(CCN[C@H](c2cccc3ccccc32)C(F)(F)F)n1 ZINC000510419071 931997802 /nfs/dbraw/zinc/99/78/02/931997802.db2.gz CLAJDLXSWFRGHE-MRXNPFEDSA-N 0 0 364.327 3.838 20 5 FHBDRN COc1cc(C(=O)N[C@@H](C)[C@@H](C)C2CCCCC2)c([N+](=O)[O-])cc1OC ZINC000177999748 932005934 /nfs/dbraw/zinc/00/59/34/932005934.db2.gz AHRSBUDAIARIIW-OLZOCXBDSA-N 0 0 364.442 3.947 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2nnc(CN3CCC[C@@H]3c3ccc(O)cc3)o2)cc1 ZINC000610390104 932009607 /nfs/dbraw/zinc/00/96/07/932009607.db2.gz HOTPLGYUMCLHDU-QGZVFWFLSA-N 0 0 366.377 3.688 20 5 FHBDRN C[C@@H]1CN(c2ccc(Br)cc2[N+](=O)[O-])C[C@@H](C(F)(F)F)O1 ZINC000610412492 932022539 /nfs/dbraw/zinc/02/25/39/932022539.db2.gz YVPLBNXVFFVYIE-HQJQHLMTSA-N 0 0 369.137 3.513 20 5 FHBDRN C[C@@H]1C[C@@H](c2ccc(F)cc2)CN1C(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000135239532 932080798 /nfs/dbraw/zinc/08/07/98/932080798.db2.gz YGTXGDVGDMMBHZ-GDBMZVCRSA-N 0 0 372.396 3.907 20 5 FHBDRN Cc1csc([C@@H](C)Nc2ncc([N+](=O)[O-])c(C)c2Br)n1 ZINC000165773850 932093773 /nfs/dbraw/zinc/09/37/73/932093773.db2.gz PHJXKFCEMTYCTR-MRVPVSSYSA-N 0 0 357.233 3.999 20 5 FHBDRN O=C1c2ccccc2C(=O)N1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000178019276 932094795 /nfs/dbraw/zinc/09/47/95/932094795.db2.gz NVMUFMLSROWXIW-UHFFFAOYSA-N 0 0 365.370 3.515 20 5 FHBDRN CSc1cc(C(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)ccc1F ZINC000581452245 932098823 /nfs/dbraw/zinc/09/88/23/932098823.db2.gz MSOJDYDVMJFHLU-UHFFFAOYSA-N 0 0 373.409 3.910 20 5 FHBDRN O=C(c1c(F)cccc1[N+](=O)[O-])N1CC=C(c2ccc(Cl)nc2)CC1 ZINC001266735581 932115687 /nfs/dbraw/zinc/11/56/87/932115687.db2.gz UFOGAYUJTYPFMZ-UHFFFAOYSA-N 0 0 361.760 3.712 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N2CCC[C@@H]2c2cccs2)c1C ZINC000119367353 932120195 /nfs/dbraw/zinc/12/01/95/932120195.db2.gz IJZRAMPSTJJNIQ-CYBMUJFWSA-N 0 0 366.464 3.799 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CCO[C@@H](c3cccs3)C2)c1C ZINC000891411212 932130429 /nfs/dbraw/zinc/13/04/29/932130429.db2.gz DGVQSNCOUGHQJD-UKRRQHHQSA-N 0 0 360.435 3.923 20 5 FHBDRN CC(C)(NC(=O)COc1cccc([N+](=O)[O-])c1)c1cccc(Cl)c1F ZINC000471665699 932149178 /nfs/dbraw/zinc/14/91/78/932149178.db2.gz DBNVIOIGMRSPMF-UHFFFAOYSA-N 0 0 366.776 3.818 20 5 FHBDRN CCOc1ccc(C2=CCN(C(=O)Cc3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000119383752 932177525 /nfs/dbraw/zinc/17/75/25/932177525.db2.gz UHNHRNCQGNHFPX-UHFFFAOYSA-N 0 0 366.417 3.852 20 5 FHBDRN CC1CCN(c2ccc(C(=O)Nc3ccccc3O)cc2[N+](=O)[O-])CC1 ZINC000060618712 932187170 /nfs/dbraw/zinc/18/71/70/932187170.db2.gz DMHJPSGIBJTSIV-UHFFFAOYSA-N 0 0 355.394 3.789 20 5 FHBDRN CC(C)[C@@H]1C[C@H](CC(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)CCO1 ZINC000581511627 932189331 /nfs/dbraw/zinc/18/93/31/932189331.db2.gz UXCSUASTXSHOIC-KUHUBIRLSA-N 0 0 373.453 3.576 20 5 FHBDRN CC(C)[C@H]1C[C@H](CC(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)CCO1 ZINC000581511625 932189372 /nfs/dbraw/zinc/18/93/72/932189372.db2.gz UXCSUASTXSHOIC-AUUYWEPGSA-N 0 0 373.453 3.576 20 5 FHBDRN CCOc1cc(NC(=O)Cc2cccs2)c([N+](=O)[O-])cc1OCC ZINC000073081857 932194809 /nfs/dbraw/zinc/19/48/09/932194809.db2.gz WQJOAVXPRWZJSN-UHFFFAOYSA-N 0 0 350.396 3.635 20 5 FHBDRN C[C@@H](c1ccco1)N(C)C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000119393117 932197775 /nfs/dbraw/zinc/19/77/75/932197775.db2.gz ISBQTDHCBHEQLA-VIFPVBQESA-N 0 0 353.172 3.784 20 5 FHBDRN CC[C@H](CNc1ccc(C(=O)Nc2ccc(C)cc2)cc1[N+](=O)[O-])OC ZINC000581521247 932200614 /nfs/dbraw/zinc/20/06/14/932200614.db2.gz MWFWCWDWMNCPTP-MRXNPFEDSA-N 0 0 357.410 3.992 20 5 FHBDRN O=C(NC1CC1)c1ccc(N2CC[C@](F)(c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000561487144 932217319 /nfs/dbraw/zinc/21/73/19/932217319.db2.gz VGXWSIXLTCEDNF-HXUWFJFHSA-N 0 0 369.396 3.562 20 5 FHBDRN CCOCCC1(CNC(=O)N(C)Cc2ccccc2[N+](=O)[O-])CCCC1 ZINC000178051698 932223383 /nfs/dbraw/zinc/22/33/83/932223383.db2.gz ZVHYDINDMHFJJX-UHFFFAOYSA-N 0 0 363.458 3.723 20 5 FHBDRN CC1(C)[C@H](NC(=O)c2ccc([N+](=O)[O-])s2)C[C@H]1OCc1ccccc1 ZINC000471670883 932227694 /nfs/dbraw/zinc/22/76/94/932227694.db2.gz JHGFZUWGZGMSSK-HUUCEWRRSA-N 0 0 360.435 3.770 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N1CCC[C@H]1c1ccccc1Cl ZINC000097017423 932263582 /nfs/dbraw/zinc/26/35/82/932263582.db2.gz NDTJIQSFPBOPSQ-KRWDZBQOSA-N 0 0 360.797 3.991 20 5 FHBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)NCCOCC1CCC1 ZINC000581581780 932272338 /nfs/dbraw/zinc/27/23/38/932272338.db2.gz SRHBQLKRNJLYHS-UHFFFAOYSA-N 0 0 366.483 3.889 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(N2CCC[C@H](c3nc(C(F)(F)F)c[nH]3)C2)n1 ZINC000581587065 932282396 /nfs/dbraw/zinc/28/23/96/932282396.db2.gz ZEZFUMQUWMPHAS-NSHDSACASA-N 0 0 369.347 3.733 20 5 FHBDRN C[C@H]1C[C@H](C)CN(c2ccc(C(=O)Nc3ccccc3N)cc2[N+](=O)[O-])C1 ZINC000119404562 932292432 /nfs/dbraw/zinc/29/24/32/932292432.db2.gz UMQPHARGPRGJQY-KBPBESRZSA-N 0 0 368.437 3.912 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N[C@@H]1CCCc2[nH]c(=O)ccc21 ZINC000276391686 932316512 /nfs/dbraw/zinc/31/65/12/932316512.db2.gz IKUZPKJWJBFXPR-CQSZACIVSA-N 0 0 356.382 3.511 20 5 FHBDRN COc1ccccc1[C@@H](CNC(=O)c1ccc([N+](=O)[O-])cc1C)OC(C)C ZINC000187422676 932316750 /nfs/dbraw/zinc/31/67/50/932316750.db2.gz PPSSHKGHPYSZOA-LJQANCHMSA-N 0 0 372.421 3.808 20 5 FHBDRN COCCCC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1OC)c1ccccc1 ZINC000477138574 932349503 /nfs/dbraw/zinc/34/95/03/932349503.db2.gz NRVQWGSUUZSJHF-QGZVFWFLSA-N 0 0 372.421 3.891 20 5 FHBDRN Cc1c(NC(=O)N[C@H]2CCO[C@H](C)C2)cc([N+](=O)[O-])cc1C(F)(F)F ZINC000933344206 932361313 /nfs/dbraw/zinc/36/13/13/932361313.db2.gz YIBUAJUFRBYWIN-SCZZXKLOSA-N 0 0 361.320 3.611 20 5 FHBDRN CCc1cc(NC(=O)c2ccc(C(F)F)o2)c2cc([N+](=O)[O-])ccc2n1 ZINC001266777689 932365200 /nfs/dbraw/zinc/36/52/00/932365200.db2.gz ZWLIOTYERGBVJR-UHFFFAOYSA-N 0 0 361.304 3.910 20 5 FHBDRN COc1ccc(CNC(=O)c2c(C)cc(Cl)cc2[N+](=O)[O-])c(OC)c1 ZINC000477192068 932379708 /nfs/dbraw/zinc/37/97/08/932379708.db2.gz OECJBWUBRPLBJK-UHFFFAOYSA-N 0 0 364.785 3.504 20 5 FHBDRN Cc1cccc(N2CCN(C(=O)c3c(C)cc(Cl)cc3[N+](=O)[O-])CC2)c1 ZINC000477201144 932390588 /nfs/dbraw/zinc/39/05/88/932390588.db2.gz ABWMGAOOSRJSJE-UHFFFAOYSA-N 0 0 373.840 3.827 20 5 FHBDRN CN(C)S(=O)(=O)c1ccc(SCC2CCCCC2)c([N+](=O)[O-])c1 ZINC000477208152 932403466 /nfs/dbraw/zinc/40/34/66/932403466.db2.gz PPQDPQRQGRQLAK-UHFFFAOYSA-N 0 0 358.485 3.518 20 5 FHBDRN COc1ccccc1CN(CCn1cc([N+](=O)[O-])cn1)Cc1cccs1 ZINC000157386645 932420738 /nfs/dbraw/zinc/42/07/38/932420738.db2.gz XUDTXAFIWYPMMK-UHFFFAOYSA-N 0 0 372.450 3.564 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)NC[C@H](C)N(C)c1ccccc1 ZINC000477280595 932445334 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ZINC000178173387 932755938 /nfs/dbraw/zinc/75/59/38/932755938.db2.gz AQEWVBLTKAEEEA-UHFFFAOYSA-N 0 0 368.315 3.514 20 5 FHBDRN Cc1nc(C)n(-c2ccccc2NC(=O)[C@H](C)c2cccc([N+](=O)[O-])c2)n1 ZINC000581861371 932760169 /nfs/dbraw/zinc/76/01/69/932760169.db2.gz XSWZZJARSBMWBV-GFCCVEGCSA-N 0 0 365.393 3.535 20 5 FHBDRN O=[N+]([O-])c1ccc(NCCOc2ccc(Cl)cn2)cc1OC(F)F ZINC000471741714 932760927 /nfs/dbraw/zinc/76/09/27/932760927.db2.gz SODNNZBZKGXYMH-UHFFFAOYSA-N 0 0 359.716 3.736 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)c1coc2cc(C)c(C)cc12 ZINC000471743571 932770215 /nfs/dbraw/zinc/77/02/15/932770215.db2.gz GVMGJSARJYCMPP-UHFFFAOYSA-N 0 0 354.362 3.896 20 5 FHBDRN Cc1cccc([C@H](NCC(=O)Nc2ccccc2[N+](=O)[O-])C(F)(F)F)c1 ZINC000510470285 932772109 /nfs/dbraw/zinc/77/21/09/932772109.db2.gz IDLYMUSREILXDZ-INIZCTEOSA-N 0 0 367.327 3.735 20 5 FHBDRN CC[C@H](OC(=O)c1cccc(C(=O)N(C)C)c1)c1cccc([N+](=O)[O-])c1 ZINC001266836006 932812155 /nfs/dbraw/zinc/81/21/55/932812155.db2.gz VYWFNTIDCHKABP-KRWDZBQOSA-N 0 0 356.378 3.605 20 5 FHBDRN CCOC(=O)c1cccc(NC(=O)CCCNc2ccc([N+](=O)[O-])cc2)c1 ZINC000023913514 932820391 /nfs/dbraw/zinc/82/03/91/932820391.db2.gz LHCLWVGAFPPGNL-UHFFFAOYSA-N 0 0 371.393 3.602 20 5 FHBDRN COC[C@H](Nc1ccc(/C=C\C(=O)OC)cc1[N+](=O)[O-])c1ccccc1 ZINC000255369427 932828592 /nfs/dbraw/zinc/82/85/92/932828592.db2.gz VWIAHIBEFXEVQT-CCCPALQASA-N 0 0 356.378 3.581 20 5 FHBDRN C[C@@H]1CCc2c(F)cccc2[C@@H]1NC(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000430671096 932851750 /nfs/dbraw/zinc/85/17/50/932851750.db2.gz WAZDWNGKPRRZMN-ZUOKHONESA-N 0 0 372.396 3.943 20 5 FHBDRN COc1cc(OCC(=O)N2c3ccccc3SC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000430672494 932855204 /nfs/dbraw/zinc/85/52/04/932855204.db2.gz UNIGVYIHIAHUAH-LBPRGKRZSA-N 0 0 374.418 3.510 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NCc1noc(-c2ccc(F)cc2F)n1 ZINC000187461133 932883718 /nfs/dbraw/zinc/88/37/18/932883718.db2.gz PXOJPGYBVQWFRS-UHFFFAOYSA-N 0 0 362.292 3.544 20 5 FHBDRN O=C1NCCc2ccc(NCc3ccc(-c4ccccc4[N+](=O)[O-])o3)cc21 ZINC000610911035 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3.560 20 5 FHBDRN C[C@@H]1CCCC[C@H]1CCNC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000510542808 933206635 /nfs/dbraw/zinc/20/66/35/933206635.db2.gz CEOOARAZGYKEMU-CABCVRRESA-N 0 0 356.426 3.727 20 5 FHBDRN Cc1cc(OCC(=O)Nc2cc(F)ccc2OC(F)F)ccc1[N+](=O)[O-] ZINC000430800226 933236823 /nfs/dbraw/zinc/23/68/23/933236823.db2.gz PZVGLNJWSRIOJJ-UHFFFAOYSA-N 0 0 370.283 3.661 20 5 FHBDRN C[C@H]1CCCC[C@@H]1CCNC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000510574232 933239153 /nfs/dbraw/zinc/23/91/53/933239153.db2.gz RYHNXSOBYVJYCI-LSDHHAIUSA-N 0 0 356.426 3.727 20 5 FHBDRN COc1ccc(NC(=O)CO[C@H]2CCCc3ccccc32)cc1[N+](=O)[O-] ZINC000430789753 933239435 /nfs/dbraw/zinc/23/94/35/933239435.db2.gz XIPDKQWWDFJBKN-KRWDZBQOSA-N 0 0 356.378 3.636 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])c2ncccc12)Nc1ccc2c(c1)CCC2 ZINC000471863306 933250560 /nfs/dbraw/zinc/25/05/60/933250560.db2.gz FEUQESXLKDGZCF-UHFFFAOYSA-N 0 0 363.373 3.649 20 5 FHBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N2CCC[C@@H]2c2ccc(Cl)cc2)c1 ZINC000220341948 933254494 /nfs/dbraw/zinc/25/44/94/933254494.db2.gz YIHVPMUSCCJDNC-MRXNPFEDSA-N 0 0 366.826 3.774 20 5 FHBDRN Cc1cc(OCC(=O)N2CC[C@@](C)(c3ccc(F)cc3)C2)ccc1[N+](=O)[O-] ZINC000430824849 933267861 /nfs/dbraw/zinc/26/78/61/933267861.db2.gz XLWCZNPXGAKVBF-HXUWFJFHSA-N 0 0 372.396 3.611 20 5 FHBDRN C/C(=C\c1ccccc1)CN(C)C(=O)COc1ccc([N+](=O)[O-])c(C)c1 ZINC000430826733 933272582 /nfs/dbraw/zinc/27/25/82/933272582.db2.gz XHQVVAOJBOJWDH-RVDMUPIBSA-N 0 0 354.406 3.844 20 5 FHBDRN CN1CCCN(Cc2nc3cc([N+](=O)[O-])ccc3o2)c2ccc(F)cc21 ZINC000610582213 933324348 /nfs/dbraw/zinc/32/43/48/933324348.db2.gz HQUHZIKWKCYNCU-UHFFFAOYSA-N 0 0 356.357 3.722 20 5 FHBDRN Cc1cccc(NCCNc2ccc(Br)cc2[N+](=O)[O-])n1 ZINC000510650698 933368470 /nfs/dbraw/zinc/36/84/70/933368470.db2.gz SWZADBVDRLBJBN-UHFFFAOYSA-N 0 0 351.204 3.585 20 5 FHBDRN CCOc1ccc(NC(=O)C(C)(C)c2ccccc2[N+](=O)[O-])cc1OC ZINC000430896042 933377327 /nfs/dbraw/zinc/37/73/27/933377327.db2.gz FXWPGUCKVIYITQ-UHFFFAOYSA-N 0 0 358.394 3.918 20 5 FHBDRN O=C(c1ccccc1)c1ccc(NCC[C@H](O)C(F)(F)F)c([N+](=O)[O-])c1 ZINC000510692129 933429936 /nfs/dbraw/zinc/42/99/36/933429936.db2.gz YZPFFZIYWPPYAL-HNNXBMFYSA-N 0 0 368.311 3.551 20 5 FHBDRN COC[C@H]1CCCN1c1ccc(C(=O)Nc2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000610588382 933437877 /nfs/dbraw/zinc/43/78/77/933437877.db2.gz LAQVWGNSENHCQL-QGZVFWFLSA-N 0 0 369.421 3.771 20 5 FHBDRN O=[N+]([O-])c1cnc(N2C[C@H](C(F)(F)F)[C@H](C(F)(F)F)C2)c(Cl)c1 ZINC000610587757 933438966 /nfs/dbraw/zinc/43/89/66/933438966.db2.gz XKYKTYFUQGMCAL-KNVOCYPGSA-N 0 0 363.645 3.820 20 5 FHBDRN CCOC(=O)c1ccc(CNc2ccc(Br)cc2[N+](=O)[O-])o1 ZINC000610588709 933443740 /nfs/dbraw/zinc/44/37/40/933443740.db2.gz FVIGTFHFPCRAKB-UHFFFAOYSA-N 0 0 369.171 3.739 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)N1C[C@H](C(F)(F)F)[C@@H](C(F)(F)F)C1 ZINC000610591594 933445277 /nfs/dbraw/zinc/44/52/77/933445277.db2.gz VFMYJTHAVAYVPD-UWVGGRQHSA-N 0 0 371.237 3.799 20 5 FHBDRN COc1cc(CNCc2cc([N+](=O)[O-])ccc2Cl)cc(OC)c1OC ZINC000060774026 933446706 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20 5 FHBDRN COc1ccc(COCCC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000610622660 933542150 /nfs/dbraw/zinc/54/21/50/933542150.db2.gz OTGUJZBTUGALPA-UHFFFAOYSA-N 0 0 372.421 3.562 20 5 FHBDRN Cc1cccnc1/C=C\C(=O)OCc1cnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000588453104 933560424 /nfs/dbraw/zinc/56/04/24/933560424.db2.gz PNCBHVRVJXYUBM-HJWRWDBZSA-N 0 0 365.345 3.710 20 5 FHBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])Nc1ccc2c(c1)COC2 ZINC000091680930 933562432 /nfs/dbraw/zinc/56/24/32/933562432.db2.gz ICIDMNVHBTWNLZ-UHFFFAOYSA-N 0 0 362.769 3.686 20 5 FHBDRN COC[C@@H](NC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1)c1ccccc1 ZINC000178370283 933577570 /nfs/dbraw/zinc/57/75/70/933577570.db2.gz ZORZALHITNVXAT-LJQANCHMSA-N 0 0 369.421 3.657 20 5 FHBDRN CCOc1ccc([C@H](C)NC(=O)NCCc2cccc([N+](=O)[O-])c2)cc1 ZINC000611147306 933578618 /nfs/dbraw/zinc/57/86/18/933578618.db2.gz GPUQNOWKWKNFPN-AWEZNQCLSA-N 0 0 357.410 3.596 20 5 FHBDRN Cc1cc(C(=O)NC(C)(C)c2ccccc2[N+](=O)[O-])nn1[C@@H](C)C1CC1 ZINC000561705705 933585973 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3.956 20 5 FHBDRN COc1ccc(NC(=O)CN2c3ccccc3SC[C@H]2C)c([N+](=O)[O-])c1 ZINC000430999563 933642390 /nfs/dbraw/zinc/64/23/90/933642390.db2.gz LWXPPMXYVXNREQ-GFCCVEGCSA-N 0 0 373.434 3.543 20 5 FHBDRN COc1ccc(CN(C)C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)cc1OC ZINC000610661354 933671345 /nfs/dbraw/zinc/67/13/45/933671345.db2.gz YBYBDOKJQKYSPP-UHFFFAOYSA-N 0 0 373.409 3.893 20 5 FHBDRN COc1ccc2c(c1)OCC[C@H]2NC(=O)Nc1c(C)ccc([N+](=O)[O-])c1C ZINC000610661227 933671568 /nfs/dbraw/zinc/67/15/68/933671568.db2.gz LCSMADRLGDUVPS-OAHLLOKOSA-N 0 0 371.393 3.866 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N2CC(Cc3cccc(C)c3)C2)c1 ZINC000610659810 933671644 /nfs/dbraw/zinc/67/16/44/933671644.db2.gz XPLMOHREDBFUIA-UHFFFAOYSA-N 0 0 356.447 3.940 20 5 FHBDRN Cc1cccc(CC2CN(C(=O)c3cc4cc([N+](=O)[O-])ccc4o3)C2)c1 ZINC000610659604 933676040 /nfs/dbraw/zinc/67/60/40/933676040.db2.gz BHAHKJDJROOOFR-UHFFFAOYSA-N 0 0 350.374 3.964 20 5 FHBDRN CCS[C@@H]1CCCC[C@H]1NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1C ZINC000176113155 933679822 /nfs/dbraw/zinc/67/98/22/933679822.db2.gz IFVKOJKEWWWRKW-UKRRQHHQSA-N 0 0 367.427 3.606 20 5 FHBDRN Cc1ccc(N2CCC(C(=O)Nc3c(C)ccc([N+](=O)[O-])c3C)CC2)nc1 ZINC000610664456 933681462 /nfs/dbraw/zinc/68/14/62/933681462.db2.gz MCCZBXDCTOFVKB-UHFFFAOYSA-N 0 0 368.437 3.770 20 5 FHBDRN O=C(NC1CCN(c2cccs2)CC1)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000610671383 933707906 /nfs/dbraw/zinc/70/79/06/933707906.db2.gz BWHNPVKIEAYWOT-UHFFFAOYSA-N 0 0 370.434 3.536 20 5 FHBDRN COc1ccc(CCCC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000512953647 933760316 /nfs/dbraw/zinc/76/03/16/933760316.db2.gz CONQBZXKAGQQSE-UHFFFAOYSA-N 0 0 356.422 3.627 20 5 FHBDRN C[C@@H](CCc1ccccc1)NC(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000510802845 933762012 /nfs/dbraw/zinc/76/20/12/933762012.db2.gz JADDPOGVDTXCDU-INIZCTEOSA-N 0 0 355.438 3.800 20 5 FHBDRN O=C(c1cccc(Cl)c1[N+](=O)[O-])N1CCO[C@@H](c2cccc(F)c2)C1 ZINC000176128515 933763017 /nfs/dbraw/zinc/76/30/17/933763017.db2.gz WTJACYLZPUJRFR-OAHLLOKOSA-N 0 0 364.760 3.601 20 5 FHBDRN Cc1nn(C)c(C(=O)N([C@@H](C)c2ccccc2Cl)C2CC2)c1[N+](=O)[O-] ZINC000098101720 933765305 /nfs/dbraw/zinc/76/53/05/933765305.db2.gz BWFMYFYUZBLOSU-NSHDSACASA-N 0 0 362.817 3.656 20 5 FHBDRN Cc1cc(OCC(=O)N(C)[C@H](C)c2cc(F)ccc2F)ccc1[N+](=O)[O-] ZINC000510811700 933779631 /nfs/dbraw/zinc/77/96/31/933779631.db2.gz KGMGQAPGYQDXQM-GFCCVEGCSA-N 0 0 364.348 3.780 20 5 FHBDRN COc1cc(C(=O)NCC2(c3ccc(F)cc3)CCCC2)ccc1[N+](=O)[O-] ZINC000510813603 933782560 /nfs/dbraw/zinc/78/25/60/933782560.db2.gz IAMWINRBNUJYLS-UHFFFAOYSA-N 0 0 372.396 3.984 20 5 FHBDRN CCOc1cc(CNC2(c3noc(C)n3)CCCCC2)ccc1[N+](=O)[O-] ZINC000276846876 933785054 /nfs/dbraw/zinc/78/50/54/933785054.db2.gz DCLGWLFSHBXKJT-UHFFFAOYSA-N 0 0 360.414 3.634 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2noc(CNc3cc(F)cc(F)c3F)n2)c1 ZINC000431088863 933819399 /nfs/dbraw/zinc/81/93/99/933819399.db2.gz XQMULGZFIGVGFI-UHFFFAOYSA-N 0 0 350.256 3.674 20 5 FHBDRN O=C(NCc1cccc(OCC(F)F)c1)c1cccc(Cl)c1[N+](=O)[O-] ZINC000176045228 933842137 /nfs/dbraw/zinc/84/21/37/933842137.db2.gz OBSASSTVRWGNSA-UHFFFAOYSA-N 0 0 370.739 3.822 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)O[C@H](C)c1nc2cc(Cl)ccc2n1C ZINC000176043962 933855084 /nfs/dbraw/zinc/85/50/84/933855084.db2.gz IONOKSLUDJMGCZ-SNVBAGLBSA-N 0 0 374.784 3.756 20 5 FHBDRN Cc1cnc(C(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)cc1C ZINC001266938802 933857121 /nfs/dbraw/zinc/85/71/21/933857121.db2.gz QEVFQQNYOLLMFK-UHFFFAOYSA-N 0 0 350.172 3.621 20 5 FHBDRN O=C(N[C@@H]1COc2c1cccc2Cl)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000610709576 933872025 /nfs/dbraw/zinc/87/20/25/933872025.db2.gz YVEKQQUTLZZFSV-OAHLLOKOSA-N 0 0 373.796 3.686 20 5 FHBDRN O=[N+]([O-])c1cnc(N[C@H]2COc3c2cccc3Cl)c(Br)c1 ZINC000610709995 933888295 /nfs/dbraw/zinc/88/82/95/933888295.db2.gz UECLNXUBMJGRQW-NSHDSACASA-N 0 0 370.590 3.951 20 5 FHBDRN O=C(N[C@H]1COc2c1cccc2Cl)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000610714550 933890647 /nfs/dbraw/zinc/89/06/47/933890647.db2.gz HKVSTSSCQMRHBI-HNNXBMFYSA-N 0 0 357.753 3.593 20 5 FHBDRN CC1CCC(NC(=O)COc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000535663015 933946420 /nfs/dbraw/zinc/94/64/20/933946420.db2.gz ZJZLNOHFWDXRTN-UHFFFAOYSA-N 0 0 360.332 3.687 20 5 FHBDRN CCc1ccc(C(=O)Nc2cc3c(cc2SC)OCCO3)cc1[N+](=O)[O-] ZINC000471941926 933975439 /nfs/dbraw/zinc/97/54/39/933975439.db2.gz RUBOJNXLCAOVFZ-UHFFFAOYSA-N 0 0 374.418 3.903 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)NCc1nc2ccccc2s1 ZINC000510895676 933977363 /nfs/dbraw/zinc/97/73/63/933977363.db2.gz GEBDQJQDLBNTBI-UHFFFAOYSA-N 0 0 370.434 3.589 20 5 FHBDRN Cc1cccc(C(=O)OCC(=O)Nc2ccccc2C(C)(C)C)c1[N+](=O)[O-] ZINC000003494943 933977466 /nfs/dbraw/zinc/97/74/66/933977466.db2.gz KJQQZUWZDGYBOT-UHFFFAOYSA-N 0 0 370.405 3.996 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)[N-]c1nc(C(C)C)cs1 ZINC000178419700 934030711 /nfs/dbraw/zinc/03/07/11/934030711.db2.gz QLCQLIAZSHZHBZ-UHFFFAOYSA-N 0 0 355.441 3.592 20 5 FHBDRN CCOc1cc(CN2CCSC[C@@H]2c2nccs2)ccc1[N+](=O)[O-] ZINC000276931392 934038991 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FHBDRN O=C(Nc1cccc(-c2cc[nH]n2)c1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000466904985 934145257 /nfs/dbraw/zinc/14/52/57/934145257.db2.gz BJYWOXSTNYJXNE-UHFFFAOYSA-N 0 0 363.377 3.575 20 5 FHBDRN COC(=O)c1cc(N[C@H]2CCOc3c(OC)cccc32)cc(C)c1[N+](=O)[O-] ZINC000610769853 934145486 /nfs/dbraw/zinc/14/54/86/934145486.db2.gz KGLBUCPSGNKKIY-HNNXBMFYSA-N 0 0 372.377 3.634 20 5 FHBDRN Cc1c(Br)cc(C(=O)N(C)Cc2ccco2)cc1[N+](=O)[O-] ZINC000162815512 934174186 /nfs/dbraw/zinc/17/41/86/934174186.db2.gz PEFVRYJGFDFVDQ-UHFFFAOYSA-N 0 0 353.172 3.531 20 5 FHBDRN CC(C)[C@@H]1c2ccccc2CCN1C(=O)COc1ccccc1[N+](=O)[O-] ZINC000610790875 934206276 /nfs/dbraw/zinc/20/62/76/934206276.db2.gz KQDLTHLLAQTCJZ-HXUWFJFHSA-N 0 0 354.406 3.756 20 5 FHBDRN Cc1ccncc1CN(C)C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000477900606 934216354 /nfs/dbraw/zinc/21/63/54/934216354.db2.gz IKEUCEUJDBMRRV-UHFFFAOYSA-N 0 0 365.842 3.702 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)NCCc1c(Cl)cccc1Cl ZINC000065139722 934219022 /nfs/dbraw/zinc/21/90/22/934219022.db2.gz ZXSGGUNYMYTENG-UHFFFAOYSA-N 0 0 369.204 3.639 20 5 FHBDRN Cc1ccc(S(=O)(=O)N2C[C@@H](C)C[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000510965134 934237013 /nfs/dbraw/zinc/23/70/13/934237013.db2.gz GMDDTTVAJWAIJX-GOEBONIOSA-N 0 0 360.435 3.675 20 5 FHBDRN COC1CCC(NC(=O)c2cc([N+](=O)[O-])ccc2SC(C)C)CC1 ZINC000458055371 934262628 /nfs/dbraw/zinc/26/26/28/934262628.db2.gz CKTNMWBZBQPBMR-UHFFFAOYSA-N 0 0 352.456 3.783 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(O)cc1COC ZINC000458059558 934267860 /nfs/dbraw/zinc/26/78/60/934267860.db2.gz JKWFTKMDASFIIN-AWEZNQCLSA-N 0 0 358.394 3.654 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(C)Cc1ccc(Cl)c(F)c1 ZINC000535689366 934282692 /nfs/dbraw/zinc/28/26/92/934282692.db2.gz FWWABJQLPDADQC-UHFFFAOYSA-N 0 0 372.805 3.516 20 5 FHBDRN CC(C)[C@@H]1C[C@H]1NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 ZINC000458146306 934321563 /nfs/dbraw/zinc/32/15/63/934321563.db2.gz UFYILYXNEHTJGZ-DHSIGJKJSA-N 0 0 368.437 3.937 20 5 FHBDRN CCN(C(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-])[C@@H](C)C(F)(F)F ZINC000477951428 934364230 /nfs/dbraw/zinc/36/42/30/934364230.db2.gz MMCXECLDZMEIEE-VIFPVBQESA-N 0 0 368.739 3.816 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1C[C@H](C)C[C@H]1c1ccccc1 ZINC000510985663 934420685 /nfs/dbraw/zinc/42/06/85/934420685.db2.gz QRNJQLCGTMPQMP-DYVFJYSZSA-N 0 0 360.435 3.675 20 5 FHBDRN O=[N+]([O-])c1ccc(NCCCc2nnc3n2CCCC3)c(C(F)(F)F)c1 ZINC000277008695 934453128 /nfs/dbraw/zinc/45/31/28/934453128.db2.gz LBLYKYPZUMPGBH-UHFFFAOYSA-N 0 0 369.347 3.586 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@H](C)[C@H](C)C1CCCCC1 ZINC000176158481 934481099 /nfs/dbraw/zinc/48/10/99/934481099.db2.gz DXHUIACPOFPVJN-UONOGXRCSA-N 0 0 361.442 3.563 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)NC[C@H]2CCOc3ccccc32)cc1[N+](=O)[O-] ZINC000176174744 934497963 /nfs/dbraw/zinc/49/79/63/934497963.db2.gz NVLILEYBMPDZEZ-GDBMZVCRSA-N 0 0 369.421 3.830 20 5 FHBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)c1ccn(C)n1 ZINC000458257262 934534451 /nfs/dbraw/zinc/53/44/51/934534451.db2.gz IYLCFXNIXHQBMQ-LBPRGKRZSA-N 0 0 362.455 3.712 20 5 FHBDRN COc1ccc(C)cc1CNC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000610878814 934547408 /nfs/dbraw/zinc/54/74/08/934547408.db2.gz IQHWMHCRCDUNSH-UHFFFAOYSA-N 0 0 369.421 3.786 20 5 FHBDRN O=C(CCOc1cccc(F)c1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000610874817 934551683 /nfs/dbraw/zinc/55/16/83/934551683.db2.gz IKSQFBRTEXBQEK-UHFFFAOYSA-N 0 0 358.369 3.694 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N1CCC[C@@H]1c1ccc(O)cc1 ZINC000610887365 934564797 /nfs/dbraw/zinc/56/47/97/934564797.db2.gz XLGJJCANFFIHNM-QGZVFWFLSA-N 0 0 360.797 3.860 20 5 FHBDRN O=C(NCC(C1CC1)C1CC1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000610900180 934585956 /nfs/dbraw/zinc/58/59/56/934585956.db2.gz ALINAZIWSYZLPU-UHFFFAOYSA-N 0 0 353.216 3.523 20 5 FHBDRN CC(C)(C)c1ccc(C[NH2+][C@@H](Cc2ccc([N+](=O)[O-])cc2)C(=O)[O-])s1 ZINC000277154481 934636902 /nfs/dbraw/zinc/63/69/02/934636902.db2.gz CUQJHTPRNLYFAV-HNNXBMFYSA-N 0 0 362.451 3.739 20 5 FHBDRN O=C(NC[C@@H]1CCCO[C@H]1c1ccccc1)c1ccc([N+](=O)[O-])cc1F ZINC000145926478 934650641 /nfs/dbraw/zinc/65/06/41/934650641.db2.gz YHIJBYZVANNJCD-KSSFIOAISA-N 0 0 358.369 3.632 20 5 FHBDRN COc1ccc(C)cc1CNC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000610963774 934651102 /nfs/dbraw/zinc/65/11/02/934651102.db2.gz MTUABVPKESHWAM-UHFFFAOYSA-N 0 0 369.421 3.786 20 5 FHBDRN C[C@@]1(c2ccccc2)C[C@H]1NC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000610964162 934662550 /nfs/dbraw/zinc/66/25/50/934662550.db2.gz OCIXERKKFVJLJG-CTNGQTDRSA-N 0 0 365.433 3.999 20 5 FHBDRN Cc1nc(C2(NC(=O)Cc3cccc([N+](=O)[O-])c3C)CCCCCC2)no1 ZINC000610969128 934666932 /nfs/dbraw/zinc/66/69/32/934666932.db2.gz YCDJOLXRPGPNFH-UHFFFAOYSA-N 0 0 372.425 3.503 20 5 FHBDRN CCC[C@@H](NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)C1CCC1 ZINC000458318606 934677174 /nfs/dbraw/zinc/67/71/74/934677174.db2.gz ZJJWUXGJYCSXSM-QGZVFWFLSA-N 0 0 359.470 3.896 20 5 FHBDRN O=C(/C=C/c1ccc([N+](=O)[O-])cc1)N1CCC[C@@H]1C[C@@H](O)c1cccs1 ZINC000176252248 934678796 /nfs/dbraw/zinc/67/87/96/934678796.db2.gz RBUGILSBRBOSFB-JSMQFAGNSA-N 0 0 372.446 3.784 20 5 FHBDRN O=C(NCCCc1nc2ccccc2[nH]1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000161105193 934694119 /nfs/dbraw/zinc/69/41/19/934694119.db2.gz CEXCROVWXYDBRA-UHFFFAOYSA-N 0 0 373.800 3.879 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2nnc(CN3Cc4ccccc4C(F)(F)C3)o2)cc1 ZINC000610989969 934715311 /nfs/dbraw/zinc/71/53/11/934715311.db2.gz ZWHIRLQVYSINNK-UHFFFAOYSA-N 0 0 372.331 3.752 20 5 FHBDRN O=C(CCN1Cc2ccccc2C(F)(F)C1)Nc1ccccc1[N+](=O)[O-] ZINC000610989907 934716148 /nfs/dbraw/zinc/71/61/48/934716148.db2.gz TYKVKRJRVPEJLO-UHFFFAOYSA-N 0 0 361.348 3.531 20 5 FHBDRN C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1Cc2ccccc2C(F)(F)C1 ZINC000610989841 934716325 /nfs/dbraw/zinc/71/63/25/934716325.db2.gz NNXQGYFLIXCKGJ-LBPRGKRZSA-N 0 0 361.348 3.529 20 5 FHBDRN CCOc1ccc(NC(=O)COc2ccc([N+](=O)[O-])cc2C)cc1OCC ZINC000535891655 934718689 /nfs/dbraw/zinc/71/86/89/934718689.db2.gz KDUNHEADDIBCAO-UHFFFAOYSA-N 0 0 374.393 3.718 20 5 FHBDRN O=c1oc(-c2ccc([N+](=O)[O-])cc2)nn1CCCc1ccc(Cl)cc1 ZINC000535891667 934718699 /nfs/dbraw/zinc/71/86/99/934718699.db2.gz JSVXXDLBQZTVMA-UHFFFAOYSA-N 0 0 359.769 3.698 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1OCC(=O)N(C)[C@@H](C)c1ccc(F)c(F)c1 ZINC000535892543 934719806 /nfs/dbraw/zinc/71/98/06/934719806.db2.gz QZGKMCAXSPCOFH-LBPRGKRZSA-N 0 0 364.348 3.780 20 5 FHBDRN O=C(c1csc(-c2cccc([N+](=O)[O-])c2)n1)N1CCOC2(CCCC2)C1 ZINC000151053770 934752255 /nfs/dbraw/zinc/75/22/55/934752255.db2.gz RQQZWGVVPIGPIW-UHFFFAOYSA-N 0 0 373.434 3.504 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N1C[C@H](C(F)(F)F)CC[C@H]1C ZINC000611555544 934802075 /nfs/dbraw/zinc/80/20/75/934802075.db2.gz IQVDAIPLOCFROX-NXEZZACHSA-N 0 0 361.320 3.798 20 5 FHBDRN COc1cc(NC[C@@]2(O)CCC[C@@H](C(F)(F)F)C2)c([N+](=O)[O-])cc1F ZINC000302524560 934802111 /nfs/dbraw/zinc/80/21/11/934802111.db2.gz JPVMPENVVQCEIF-YMTOWFKASA-N 0 0 366.311 3.638 20 5 FHBDRN O=C(CN1CCCC[C@@H]1Cc1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000110001842 934806822 /nfs/dbraw/zinc/80/68/22/934806822.db2.gz JRPBZCIGVJYDFR-QGZVFWFLSA-N 0 0 353.422 3.631 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)N1CC=C(c2c(F)cccc2F)CC1 ZINC000472011519 934824967 /nfs/dbraw/zinc/82/49/67/934824967.db2.gz HJANPGOYCOGKPV-UHFFFAOYSA-N 0 0 358.344 3.731 20 5 FHBDRN CC1(C)CCC(C[NH2+][C@H](Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C(=O)[O-])CC1 ZINC000277237479 934825764 /nfs/dbraw/zinc/82/57/64/934825764.db2.gz IZRHMIDHFKQVID-GOSISDBHSA-N 0 0 373.453 3.878 20 5 FHBDRN CC(C)(C)C(=O)CCCC(=O)N1CCS[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000450000439 934829344 /nfs/dbraw/zinc/82/93/44/934829344.db2.gz UNLURNBURPLXFL-KRWDZBQOSA-N 0 0 364.467 3.954 20 5 FHBDRN CCC[C@H](C)c1cc(NC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)n[nH]1 ZINC000119491500 934833494 /nfs/dbraw/zinc/83/34/94/934833494.db2.gz OJQLDTCDBRQDMR-LBPRGKRZSA-N 0 0 368.397 3.660 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N(C)C(C)(C)c1ccc2c(c1)OCO2 ZINC000119507645 934851573 /nfs/dbraw/zinc/85/15/73/934851573.db2.gz 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O=[N+]([O-])c1ccc(OCc2nc(C3CCCC3)no2)c(Br)c1 ZINC000119520244 934857301 /nfs/dbraw/zinc/85/73/01/934857301.db2.gz LRFJHBXQMJCGAE-UHFFFAOYSA-N 0 0 368.187 3.977 20 5 FHBDRN C[C@H](c1ccc(F)cc1)N(C)S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000119522120 934864262 /nfs/dbraw/zinc/86/42/62/934864262.db2.gz BMURJIDPGUZWHH-SNVBAGLBSA-N 0 0 372.805 3.769 20 5 FHBDRN O=C(Nc1ccc2c(c1)NC(=O)CS2)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000071804512 934872888 /nfs/dbraw/zinc/87/28/88/934872888.db2.gz CZSXSJBPJDWIBC-UHFFFAOYSA-N 0 0 363.782 3.545 20 5 FHBDRN CC(C)CC[C@H]1CCCCN1C(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000119544413 934874979 /nfs/dbraw/zinc/87/49/79/934874979.db2.gz ZJODCKZXTJDADU-CQSZACIVSA-N 0 0 371.437 3.867 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1)N(S(=O)(=O)c1ccc(Cl)c(Cl)c1)CC2 ZINC000014099058 934875612 /nfs/dbraw/zinc/87/56/12/934875612.db2.gz YRUBRQHYPDDVLR-UHFFFAOYSA-N 0 0 373.217 3.653 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)c1nc(N)nc(Nc2ccccc2)n1 ZINC000071814121 934879719 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FHBDRN O=C(Cc1ccccc1F)Nc1ccc([N+](=O)[O-])c(Br)c1 ZINC000119636761 934952864 /nfs/dbraw/zinc/95/28/64/934952864.db2.gz CSLDOEVYTAJPDC-UHFFFAOYSA-N 0 0 353.147 3.678 20 5 FHBDRN CC(C)(C)[C@@H]1CCCC[C@@H]1NC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000110050204 935002989 /nfs/dbraw/zinc/00/29/89/935002989.db2.gz SYXXEYNXNPHHID-WBVHZDCISA-N 0 0 371.437 3.771 20 5 FHBDRN CC(C)c1ccccc1NC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000110048087 935003206 /nfs/dbraw/zinc/00/32/06/935003206.db2.gz HMXBCCGXJYZQGC-UHFFFAOYSA-N 0 0 351.362 3.812 20 5 FHBDRN CNc1ccc([N+](=O)[O-])cc1NC(=O)c1ccnc(N2CCC[C@@H](C)C2)c1 ZINC000563198705 935005270 /nfs/dbraw/zinc/00/52/70/935005270.db2.gz LWHPCGUVPIYWFG-CYBMUJFWSA-N 0 0 369.425 3.520 20 5 FHBDRN O=[N+]([O-])c1ccc(OC2CCN(Cc3cnn(C4CCC4)c3)CC2)cc1 ZINC000892109594 935013902 /nfs/dbraw/zinc/01/39/02/935013902.db2.gz CBGHMPXBHMOLCU-UHFFFAOYSA-N 0 0 356.426 3.560 20 5 FHBDRN O=[N+]([O-])c1ccc(OS(=O)(=O)/C=C\c2ccc(F)cc2)c2cccnc21 ZINC000588491626 935014759 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ZINC000046500901 935070747 /nfs/dbraw/zinc/07/07/47/935070747.db2.gz SXESTZFBVMSUJF-INIZCTEOSA-N 0 0 356.378 3.713 20 5 FHBDRN Cc1ccc(S(=O)(=O)N(C)CCCCc2ccccc2)cc1[N+](=O)[O-] ZINC000511048661 935072208 /nfs/dbraw/zinc/07/22/08/935072208.db2.gz RTGOXCKYWWXLDO-UHFFFAOYSA-N 0 0 362.451 3.547 20 5 FHBDRN CC(C)Cc1ccc(S(=O)(=O)Nc2cc([N+](=O)[O-])ccc2F)cc1 ZINC000014256447 935076465 /nfs/dbraw/zinc/07/64/65/935076465.db2.gz WOEXGGOVARIZAX-UHFFFAOYSA-N 0 0 352.387 3.733 20 5 FHBDRN O=C(Nc1ncc(Cl)s1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000124048456 945074895 /nfs/dbraw/zinc/07/48/95/945074895.db2.gz DRCRMYKEDYFAPX-UHFFFAOYSA-N 0 0 351.693 3.976 20 5 FHBDRN Cc1ccccc1COC1CCN(C(=O)c2ccc([N+](=O)[O-])s2)CC1 ZINC000119710202 935080764 /nfs/dbraw/zinc/08/07/64/935080764.db2.gz TUWMLFFNNKNFPA-UHFFFAOYSA-N 0 0 360.435 3.786 20 5 FHBDRN Cc1nn(C)c(C(=O)Nc2ccc(C)c(OCCC(C)C)c2)c1[N+](=O)[O-] ZINC000157565746 935091792 /nfs/dbraw/zinc/09/17/92/935091792.db2.gz NYQJUZSMGPKQEI-UHFFFAOYSA-N 0 0 360.414 3.622 20 5 FHBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)N[C@H]1CC[C@@H](c2ccc(F)cc2)C1 ZINC000472126344 935095079 /nfs/dbraw/zinc/09/50/79/935095079.db2.gz OITISVKTVZFFGY-AEFFLSMTSA-N 0 0 371.412 3.912 20 5 FHBDRN O=C1CCN1c1cccc(-c2noc(-c3ccc([N+](=O)[O-])cc3Cl)n2)c1 ZINC000438821644 945076792 /nfs/dbraw/zinc/07/67/92/945076792.db2.gz UUWLRJFUJZWSCM-UHFFFAOYSA-N 0 0 370.752 3.702 20 5 FHBDRN Cn1ncc([N+](=O)[O-])c1C(=O)N1CCCCC[C@H]1c1ccc(Cl)cc1 ZINC000123376205 935102874 /nfs/dbraw/zinc/10/28/74/935102874.db2.gz UAXWXPIUOQOKJJ-AWEZNQCLSA-N 0 0 362.817 3.739 20 5 FHBDRN COC(=O)c1cccc(-c2noc(/C=C/c3ccc([N+](=O)[O-])cc3)n2)c1 ZINC000438821604 945077240 /nfs/dbraw/zinc/07/72/40/945077240.db2.gz UJNASJXEBGKBSY-JXMROGBWSA-N 0 0 351.318 3.602 20 5 FHBDRN CSc1ccc(C(=O)NCc2c(F)cc(F)cc2F)cc1[N+](=O)[O-] ZINC000511055936 935123178 /nfs/dbraw/zinc/12/31/78/935123178.db2.gz GMVYLVXURAOTND-UHFFFAOYSA-N 0 0 356.325 3.664 20 5 FHBDRN CC(C)CCn1nccc1NC(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000548648861 935126626 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3.763 20 5 FHBDRN Cc1ccc(Oc2ccccc2)c(NC(=O)CCn2cc([N+](=O)[O-])cn2)c1 ZINC000084786263 935178799 /nfs/dbraw/zinc/17/87/99/935178799.db2.gz NKBZDVBQZZKLTA-UHFFFAOYSA-N 0 0 366.377 3.921 20 5 FHBDRN Cc1ccn2c(=O)cc(CSCc3cccc([N+](=O)[O-])c3C)nc2c1 ZINC000609387449 935187391 /nfs/dbraw/zinc/18/73/91/935187391.db2.gz GEIPGUYLKPDIQA-UHFFFAOYSA-N 0 0 355.419 3.653 20 5 FHBDRN CCN(Cc1ccccc1)C(=O)[C@@H](C)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000511062219 935196911 /nfs/dbraw/zinc/19/69/11/935196911.db2.gz CQEDDUBDQYBZAW-QGZVFWFLSA-N 0 0 369.465 3.506 20 5 FHBDRN O=C([O-])c1ccc(C[NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])cc1 ZINC000263408391 935199063 /nfs/dbraw/zinc/19/90/63/935199063.db2.gz KNUZCZKBQWZHHM-SJLPKXTDSA-N 0 0 354.406 3.794 20 5 FHBDRN CSc1ccc(NC(=O)c2ccc(Br)cc2[N+](=O)[O-])nc1 ZINC000431344606 935201873 /nfs/dbraw/zinc/20/18/73/935201873.db2.gz NPSMFTAQOBUVND-UHFFFAOYSA-N 0 0 368.212 3.727 20 5 FHBDRN Cc1c2ccccc2oc1[C@H](C)NS(=O)(=O)c1cccc([N+](=O)[O-])c1C ZINC000511779577 945083489 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935268792 /nfs/dbraw/zinc/26/87/92/935268792.db2.gz GQKLYIANABZREN-JTQLQIEISA-N 0 0 360.757 3.757 20 5 FHBDRN COC(=O)[C@H](C)[C@H](NC(=O)Nc1ccc(C)c([N+](=O)[O-])c1)c1ccccc1 ZINC000119846712 935280382 /nfs/dbraw/zinc/28/03/82/935280382.db2.gz MUCPICBSFCNOED-DYVFJYSZSA-N 0 0 371.393 3.575 20 5 FHBDRN COC(=O)[C@@H](C)[C@H](NC(=O)Nc1cc([N+](=O)[O-])ccc1C)c1ccccc1 ZINC000119848811 935280815 /nfs/dbraw/zinc/28/08/15/935280815.db2.gz TXDDHXUOTZBBJI-GUYCJALGSA-N 0 0 371.393 3.575 20 5 FHBDRN CC(C)c1ccc(C(=O)Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)cc1 ZINC000072086065 935290371 /nfs/dbraw/zinc/29/03/71/935290371.db2.gz BENJBAXLJBLEKN-UHFFFAOYSA-N 0 0 350.378 3.860 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1cc(-c2ccc(F)cc2)[nH]n1 ZINC000505988578 945091568 /nfs/dbraw/zinc/09/15/68/945091568.db2.gz VMVQGTLBEGJQNO-UHFFFAOYSA-N 0 0 354.341 3.993 20 5 FHBDRN COc1ccccc1C(C)(C)CNC(=O)c1cc([N+](=O)[O-])c(F)cc1C ZINC001125584230 935323934 /nfs/dbraw/zinc/32/39/34/935323934.db2.gz FOFXWHULNFZJQO-UHFFFAOYSA-N 0 0 360.385 3.759 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])s1)N1CC[C@](F)(c2cc(F)cc(F)c2)C1 ZINC000551686696 935329205 /nfs/dbraw/zinc/32/92/05/935329205.db2.gz NAIHLIAKSBTBLP-OAHLLOKOSA-N 0 0 356.325 3.645 20 5 FHBDRN CC(C)(C)c1ccc(NC(=O)CCn2cc(Cl)cn2)cc1[N+](=O)[O-] ZINC000551681473 935329449 /nfs/dbraw/zinc/32/94/49/935329449.db2.gz QQXMRWVXXWMEID-UHFFFAOYSA-N 0 0 350.806 3.771 20 5 FHBDRN CSc1ccc(C(=O)NC[C@H]2CCCO[C@H]2C(C)(C)C)cc1[N+](=O)[O-] ZINC000118269301 935334830 /nfs/dbraw/zinc/33/48/30/935334830.db2.gz KVIGHIOXUPNVGP-CZUORRHYSA-N 0 0 366.483 3.888 20 5 FHBDRN COc1ccc([C@H](C)NC(=O)Nc2cccc([N+](=O)[O-])c2)c(C)c1OC ZINC000562030585 935357992 /nfs/dbraw/zinc/35/79/92/935357992.db2.gz ODEVYILSEIPGMD-LBPRGKRZSA-N 0 0 359.382 3.803 20 5 FHBDRN Cc1nnc(SCC(=O)c2ccc([N+](=O)[O-])cc2)n1-c1ccccc1C ZINC000511087276 935363309 /nfs/dbraw/zinc/36/33/09/935363309.db2.gz ZJNJLYAKJTVXIG-UHFFFAOYSA-N 0 0 368.418 3.767 20 5 FHBDRN COc1ccc(-c2ccc(CN3CCC[C@H]3c3ncc[nH]3)o2)c([N+](=O)[O-])c1 ZINC000437979456 945096446 /nfs/dbraw/zinc/09/64/46/945096446.db2.gz YBMUWPJQMQHZPE-INIZCTEOSA-N 0 0 368.393 3.924 20 5 FHBDRN CCCCN(CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)CC(F)(F)F ZINC000119968776 935380380 /nfs/dbraw/zinc/38/03/80/935380380.db2.gz YLMHFERDIWRZSA-UHFFFAOYSA-N 0 0 367.755 3.851 20 5 FHBDRN Cc1ccc(C(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)c(Cl)c1 ZINC000427111484 945096952 /nfs/dbraw/zinc/09/69/52/945096952.db2.gz RSRULEZGLZIWBA-UHFFFAOYSA-N 0 0 359.813 3.519 20 5 FHBDRN Cc1nc(C)n(-c2ccccc2NC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)n1 ZINC000161175787 935387418 /nfs/dbraw/zinc/38/74/18/935387418.db2.gz PFVBTAPIXQHSHX-UHFFFAOYSA-N 0 0 371.784 3.698 20 5 FHBDRN COc1ccc([C@@H](Nc2ccc([N+](=O)[O-])c(C)c2)c2nccn2C)cc1 ZINC000051501510 935388640 /nfs/dbraw/zinc/38/86/40/935388640.db2.gz GTAWNHKORALAFE-GOSISDBHSA-N 0 0 352.394 3.847 20 5 FHBDRN Cn1cc(NC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)c(-c2ccccc2)n1 ZINC000091145318 935398346 /nfs/dbraw/zinc/39/83/46/935398346.db2.gz CHRUQZABYXTVEJ-UHFFFAOYSA-N 0 0 361.361 3.729 20 5 FHBDRN O=C(COc1ccccc1[N+](=O)[O-])Nc1ccc(Oc2cccnc2)cc1 ZINC000582204279 935403880 /nfs/dbraw/zinc/40/38/80/935403880.db2.gz OQSMKVRQVZCXSC-UHFFFAOYSA-N 0 0 365.345 3.800 20 5 FHBDRN CCN(Cc1ccc(OC)cc1)C(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000047319744 945100798 /nfs/dbraw/zinc/10/07/98/945100798.db2.gz APKUSXVPNWAGRP-UHFFFAOYSA-N 0 0 359.382 3.666 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N[C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2 ZINC000120017743 935457057 /nfs/dbraw/zinc/45/70/57/935457057.db2.gz PTPLLXNLYBWKAE-XKQJLSEDSA-N 0 0 359.426 3.681 20 5 FHBDRN Cc1ccc(Sc2ccc(C(=O)N[C@H](C)C[C@H](C)O)cc2[N+](=O)[O-])cc1 ZINC000544027367 935472258 /nfs/dbraw/zinc/47/22/58/935472258.db2.gz SMQPLPGSGWFRCP-KGLIPLIRSA-N 0 0 374.462 3.944 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)NC1CCC(c2nc(C)no2)CC1 ZINC000582271395 935476440 /nfs/dbraw/zinc/47/64/40/935476440.db2.gz YGHKQGCWONKOBK-UHFFFAOYSA-N 0 0 373.413 3.697 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1N1CCC[C@@H](OC(F)F)C1 ZINC000611583992 935479423 /nfs/dbraw/zinc/47/94/23/935479423.db2.gz RHPORRGQPRCYDN-SECBINFHSA-N 0 0 351.147 3.565 20 5 FHBDRN Cc1c(CC(=O)NCCCCOc2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000178562072 935504517 /nfs/dbraw/zinc/50/45/17/935504517.db2.gz PNXAROJMIZLYSL-UHFFFAOYSA-N 0 0 360.385 3.560 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])N[C@@H]1CCc2sc(Cl)cc21 ZINC000426533375 945105364 /nfs/dbraw/zinc/10/53/64/945105364.db2.gz PTUURHHZPHLDOG-SNVBAGLBSA-N 0 0 351.815 3.525 20 5 FHBDRN O=[N+]([O-])c1ccccc1CNc1cccc(F)c1I ZINC000381686717 935519820 /nfs/dbraw/zinc/51/98/20/935519820.db2.gz VHMZYZGPXBESMQ-UHFFFAOYSA-N 0 0 372.137 3.951 20 5 FHBDRN Cc1c([N+](=O)[O-])cc(C(=O)N2c3ccccc3SC[C@@H]2C)cc1[N+](=O)[O-] ZINC000176658705 935529648 /nfs/dbraw/zinc/52/96/48/935529648.db2.gz LQIIKRUNDYIEES-JTQLQIEISA-N 0 0 373.390 3.952 20 5 FHBDRN COc1ccccc1C[C@@H](C)N(C)C(=O)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000582337805 935538831 /nfs/dbraw/zinc/53/88/31/935538831.db2.gz GGDDHEXWMZCYOT-HUUCEWRRSA-N 0 0 356.422 3.797 20 5 FHBDRN CCCc1[nH]nc(C(=O)Nc2ccc(-c3nc(C)cs3)cc2)c1[N+](=O)[O-] ZINC000158109019 935566426 /nfs/dbraw/zinc/56/64/26/935566426.db2.gz NVNPQNRAERKKRU-UHFFFAOYSA-N 0 0 371.422 3.955 20 5 FHBDRN COc1ccc(Cn2ccnc2Sc2cc(C)c([N+](=O)[O-])cn2)cc1 ZINC000490093337 935567543 /nfs/dbraw/zinc/56/75/43/935567543.db2.gz NPQZGUOUGUECGT-UHFFFAOYSA-N 0 0 356.407 3.703 20 5 FHBDRN CCOc1ccc2nc(NC(=O)c3ccc([N+](=O)[O-])cc3OC)sc2c1 ZINC000427129716 945109914 /nfs/dbraw/zinc/10/99/14/945109914.db2.gz ZYXZNCYFCXAYAN-UHFFFAOYSA-N 0 0 373.390 3.864 20 5 FHBDRN CC(C)n1cc(Br)cc1C(=O)NCc1ccccc1[N+](=O)[O-] ZINC000120086179 935577971 /nfs/dbraw/zinc/57/79/71/935577971.db2.gz QAPWFPFOVWYQMW-UHFFFAOYSA-N 0 0 366.215 3.670 20 5 FHBDRN Cc1cc(Br)c(NC(=O)c2ccc([N+](=O)[O-])n2C)cc1Cl ZINC000127499896 935584350 /nfs/dbraw/zinc/58/43/50/935584350.db2.gz NWWVRFASTQWFNS-UHFFFAOYSA-N 0 0 372.606 3.910 20 5 FHBDRN CN(C(=O)c1nn(-c2ccccc2)c2c1CCC2)c1cccc([N+](=O)[O-])c1 ZINC000158142881 935591543 /nfs/dbraw/zinc/59/15/43/935591543.db2.gz UPNNLDOMQSLLNW-UHFFFAOYSA-N 0 0 362.389 3.546 20 5 FHBDRN Cc1c(CNC(=O)NCc2ccc(C(F)(F)F)cc2)cccc1[N+](=O)[O-] ZINC000478272734 935594987 /nfs/dbraw/zinc/59/49/87/935594987.db2.gz AIDXJYQIMXHEBN-UHFFFAOYSA-N 0 0 367.327 3.921 20 5 FHBDRN O=C(N[C@@H]1CC[C@H](c2cccc(F)c2)C1)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000478257599 935599023 /nfs/dbraw/zinc/59/90/23/935599023.db2.gz UATNDJVVRWDUGS-SWLSCSKDSA-N 0 0 372.352 3.529 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CC[C@H](c3cccc(F)c3)C2)c1 ZINC000478256679 935599480 /nfs/dbraw/zinc/59/94/80/935599480.db2.gz URLCHGBXWMNIOQ-ZFWWWQNUSA-N 0 0 358.369 3.809 20 5 FHBDRN O=C(COc1cccc([N+](=O)[O-])c1)N[C@H]1CC[C@H](c2cccc(F)c2)C1 ZINC000478277924 935605467 /nfs/dbraw/zinc/60/54/67/935605467.db2.gz GWVQFEMEWNNLGL-HOCLYGCPSA-N 0 0 358.369 3.565 20 5 FHBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCO[C@H](c2cccc(O)c2)C1 ZINC000127528134 935607443 /nfs/dbraw/zinc/60/74/43/935607443.db2.gz CCHDDCZOAIKDQC-FQEVSTJZSA-N 0 0 372.421 3.661 20 5 FHBDRN CCc1cc(Br)ccc1NC(=O)c1ccc([N+](=O)[O-])n1C ZINC000127553464 935621924 /nfs/dbraw/zinc/62/19/24/935621924.db2.gz UFFNRLXTKAOUGV-UHFFFAOYSA-N 0 0 352.188 3.511 20 5 FHBDRN CSCCN(C)C(=O)c1ccc(N2C[C@@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000152433104 935622696 /nfs/dbraw/zinc/62/26/96/935622696.db2.gz TWBYJMNLDBRPRS-KBPBESRZSA-N 0 0 365.499 3.512 20 5 FHBDRN CO[C@@H](c1ccc(Cl)cc1)[C@H](C)NC(=O)Cc1ccccc1[N+](=O)[O-] ZINC000127574341 935635231 /nfs/dbraw/zinc/63/52/31/935635231.db2.gz RGRKJJIUPPYSMT-KPZWWZAWSA-N 0 0 362.813 3.683 20 5 FHBDRN C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000582394649 935636256 /nfs/dbraw/zinc/63/62/56/935636256.db2.gz KULXHTOTPIGVMI-KBPBESRZSA-N 0 0 370.405 3.565 20 5 FHBDRN CS[C@H]1CCC[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2Br)C1 ZINC000152473882 935659468 /nfs/dbraw/zinc/65/94/68/935659468.db2.gz CWRFGMDKOGIUII-ONGXEEELSA-N 0 0 373.272 3.761 20 5 FHBDRN O=C(O[C@H]([C@@H]1CCCO1)C(F)(F)F)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000158254781 935663163 /nfs/dbraw/zinc/66/31/63/935663163.db2.gz OHCLJAKYJKWQIU-WDEREUQCSA-N 0 0 353.680 3.515 20 5 FHBDRN CN(C(=O)c1ccn(-c2cccc(Cl)c2)n1)c1cccc([N+](=O)[O-])c1 ZINC000158256075 935663241 /nfs/dbraw/zinc/66/32/41/935663241.db2.gz ARENOGSAEOEPPK-UHFFFAOYSA-N 0 0 356.769 3.711 20 5 FHBDRN CC[C@H](CSC)N(C)C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000091220722 935670962 /nfs/dbraw/zinc/67/09/62/935670962.db2.gz NLHLMCXNBZSYMD-SNVBAGLBSA-N 0 0 361.261 3.571 20 5 FHBDRN Cc1cc(OC[C@H](O)COCc2ccc(Cl)cc2)c(F)cc1[N+](=O)[O-] ZINC000478671786 935672297 /nfs/dbraw/zinc/67/22/97/935672297.db2.gz FKTVQCJBEHNPPU-CQSZACIVSA-N 0 0 369.776 3.652 20 5 FHBDRN CCOc1cc(OCC(=O)N[C@H](C)c2ccc(CC)cc2)ccc1[N+](=O)[O-] ZINC000478731648 935687891 /nfs/dbraw/zinc/68/78/91/935687891.db2.gz RWQHOIADRUPRBC-CQSZACIVSA-N 0 0 372.421 3.812 20 5 FHBDRN O=[N+]([O-])c1ccccc1-n1ccc(-c2nc(-c3ccc(F)c(F)c3)no2)n1 ZINC000478706621 935690195 /nfs/dbraw/zinc/69/01/95/935690195.db2.gz XZOKHISMFSVYBF-UHFFFAOYSA-N 0 0 369.287 3.776 20 5 FHBDRN Cn1c2cc(F)ccc2nc1N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000431407236 935691377 /nfs/dbraw/zinc/69/13/77/935691377.db2.gz OCOSNDWEDULGHK-UHFFFAOYSA-N 0 0 370.384 3.668 20 5 FHBDRN COC[C@@H](NC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)c1ccccc1 ZINC000178578113 935691961 /nfs/dbraw/zinc/69/19/61/935691961.db2.gz IVRLGEZRJMTIJO-OAHLLOKOSA-N 0 0 368.311 3.731 20 5 FHBDRN COC[C@@H]1CCCN(C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1 ZINC000158674010 935692851 /nfs/dbraw/zinc/69/28/51/935692851.db2.gz HRAAUIQLLJKLMB-SNVBAGLBSA-N 0 0 361.320 3.504 20 5 FHBDRN C[C@@H](CC(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1)C1CCCCC1 ZINC000511123558 935697196 /nfs/dbraw/zinc/69/71/96/935697196.db2.gz IUHJAZUSWJMUSR-INIZCTEOSA-N 0 0 359.470 3.850 20 5 FHBDRN CC[C@@H](CN(CC)S(=O)(=O)c1ccc([N+](=O)[O-])s1)c1ccccc1 ZINC000478770868 935714778 /nfs/dbraw/zinc/71/47/78/935714778.db2.gz WUKZDNQTXRQRQI-ZDUSSCGKSA-N 0 0 368.480 3.861 20 5 FHBDRN O=C(CN1CCC=C(c2ccco2)C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000511127860 935718091 /nfs/dbraw/zinc/71/80/91/935718091.db2.gz XGXUFMXAUUZDJS-UHFFFAOYSA-N 0 0 361.785 3.569 20 5 FHBDRN CCc1cccc2c(CC(=O)Nc3ccc(OC)c([N+](=O)[O-])c3)c[nH]c21 ZINC000543848944 935742808 /nfs/dbraw/zinc/74/28/08/935742808.db2.gz CIPDKHVJDWQCSH-UHFFFAOYSA-N 0 0 353.378 3.828 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N1CCCc2ccc(F)cc21 ZINC000511132030 935745347 /nfs/dbraw/zinc/74/53/47/935745347.db2.gz UETQIKAJRBXBRA-UHFFFAOYSA-N 0 0 370.789 3.529 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)N[C@H](CO)c1c(Cl)cccc1Cl ZINC000478898834 935753079 /nfs/dbraw/zinc/75/30/79/935753079.db2.gz FNYUWJQTLYYSBZ-CYBMUJFWSA-N 0 0 370.192 3.757 20 5 FHBDRN Cc1cc(OCC(=O)NC2(c3ccccc3)CCC2)c(F)cc1[N+](=O)[O-] ZINC000478908603 935753743 /nfs/dbraw/zinc/75/37/43/935753743.db2.gz NWEAQNWEMCYZES-UHFFFAOYSA-N 0 0 358.369 3.617 20 5 FHBDRN Cc1ccc(NC(=O)COC(=O)c2cc(C)cc([N+](=O)[O-])c2)c(Cl)c1 ZINC000121807975 935754315 /nfs/dbraw/zinc/75/43/15/935754315.db2.gz NNAUMIPRBQEQAQ-UHFFFAOYSA-N 0 0 362.769 3.661 20 5 FHBDRN C/C=C/c1ccc(OCC(=O)N(C)c2cccc([N+](=O)[O-])c2)c(OC)c1 ZINC000158369940 935754629 /nfs/dbraw/zinc/75/46/29/935754629.db2.gz CODWHIUZYZWKTA-GQCTYLIASA-N 0 0 356.378 3.678 20 5 FHBDRN CCOc1ccc(C(C)=O)cc1CN(C)CCc1ccccc1[N+](=O)[O-] ZINC000511135387 935762829 /nfs/dbraw/zinc/76/28/29/935762829.db2.gz FORJXVBXQBWIEI-UHFFFAOYSA-N 0 0 356.422 3.871 20 5 FHBDRN C[C@@H](Cc1nc(Cc2ccc([N+](=O)[O-])cn2)no1)c1ccc(F)cc1F ZINC000545075349 935775352 /nfs/dbraw/zinc/77/53/52/935775352.db2.gz HIQFSMSEIUCHBO-JTQLQIEISA-N 0 0 360.320 3.588 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)Nc1ccc(C(F)(F)F)nc1 ZINC000479049166 935779135 /nfs/dbraw/zinc/77/91/35/935779135.db2.gz QZCICDURJAYYQE-UHFFFAOYSA-N 0 0 368.315 3.715 20 5 FHBDRN O=C(N[C@@H](CCCc1ccccc1)c1ccccc1)c1c[nH]nc1[N+](=O)[O-] ZINC000548740580 935791195 /nfs/dbraw/zinc/79/11/95/935791195.db2.gz HGPMBDBBQKGLPR-SFHVURJKSA-N 0 0 364.405 3.812 20 5 FHBDRN CCc1nc(-c2ccccc2NC(=O)C=Cc2ccc([N+](=O)[O-])cc2)n[nH]1 ZINC000161307371 935799600 /nfs/dbraw/zinc/79/96/00/935799600.db2.gz LCFADWFIHPYOKV-FMIVXFBMSA-N 0 0 363.377 3.594 20 5 FHBDRN CCC(C)(C)OCc1cccc(NC(=O)c2ccnc(N)c2[N+](=O)[O-])c1C ZINC000563381920 935800618 /nfs/dbraw/zinc/80/06/18/935800618.db2.gz WFJNKLXAVWMHAI-UHFFFAOYSA-N 0 0 372.425 3.668 20 5 FHBDRN Cc1c2ccccc2oc1[C@@H](C)NS(=O)(=O)c1c(C)cccc1[N+](=O)[O-] ZINC000511791208 945124879 /nfs/dbraw/zinc/12/48/79/945124879.db2.gz JWLKQBWVIWWSBW-CYBMUJFWSA-N 0 0 374.418 3.997 20 5 FHBDRN Cc1c(C(=O)N2CCN(C3CC3)c3cc(F)ccc32)cccc1[N+](=O)[O-] ZINC000479188675 935817313 /nfs/dbraw/zinc/81/73/13/935817313.db2.gz OUNGZRGMYKARHQ-UHFFFAOYSA-N 0 0 355.369 3.672 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1C(F)(F)F)N1CCC(C(F)F)CC1 ZINC000479199709 935818274 /nfs/dbraw/zinc/81/82/74/935818274.db2.gz WYLYFNCWQOMKNH-UHFFFAOYSA-N 0 0 352.259 3.731 20 5 FHBDRN O=C(NC1CC(F)(F)C1)c1cc(Br)cc([N+](=O)[O-])c1Cl ZINC000277688006 935820070 /nfs/dbraw/zinc/82/00/70/935820070.db2.gz XCBCSTRBCPOMAF-UHFFFAOYSA-N 0 0 369.549 3.538 20 5 FHBDRN CCn1nc(C)c([N+](=O)[O-])c1NCc1cccc(C)c1Br ZINC000479300243 935823715 /nfs/dbraw/zinc/82/37/15/935823715.db2.gz GBQDNWVXZAJZLU-UHFFFAOYSA-N 0 0 353.220 3.803 20 5 FHBDRN O=C(Nc1ccn(-c2ccccc2Cl)n1)c1ccc([N+](=O)[O-])cc1F ZINC000158506845 935824437 /nfs/dbraw/zinc/82/44/37/935824437.db2.gz GLVVAUNNHGKCAJ-UHFFFAOYSA-N 0 0 360.732 3.825 20 5 FHBDRN COc1ccccc1O[C@H](C)CNC(=O)Nc1c(C)ccc([N+](=O)[O-])c1C ZINC000127856560 935824593 /nfs/dbraw/zinc/82/45/93/935824593.db2.gz YLTAHHWFQFTSGU-CYBMUJFWSA-N 0 0 373.409 3.809 20 5 FHBDRN Cc1[nH]nc(C(=O)Nc2cccc(OCc3cccc(F)c3)c2)c1[N+](=O)[O-] ZINC000519103961 945126594 /nfs/dbraw/zinc/12/65/94/945126594.db2.gz PYRJEJSDBKRQBA-UHFFFAOYSA-N 0 0 370.340 3.597 20 5 FHBDRN Cc1cnc([C@@H](NC(=O)NCc2cccc([N+](=O)[O-])c2C)C2CC2)s1 ZINC000479319779 935824786 /nfs/dbraw/zinc/82/47/86/935824786.db2.gz MPNXSBXDDOYHAY-HNNXBMFYSA-N 0 0 360.439 3.619 20 5 FHBDRN CC(C)CC(=O)Nc1ccc(C(=O)CSc2ncccc2[N+](=O)[O-])cc1 ZINC000127860378 935826613 /nfs/dbraw/zinc/82/66/13/935826613.db2.gz UDDRLXRCVXNVDM-UHFFFAOYSA-N 0 0 373.434 3.949 20 5 FHBDRN COc1ccc(Cl)cc1NC(=O)[C@H](C)Sc1ncccc1[N+](=O)[O-] ZINC000127860889 935827034 /nfs/dbraw/zinc/82/70/34/935827034.db2.gz RDFYXTIZXOHTDG-VIFPVBQESA-N 0 0 367.814 3.771 20 5 FHBDRN O=C(c1csc(-c2cccc([N+](=O)[O-])c2)n1)N1CCc2sccc2C1 ZINC000050297536 935827296 /nfs/dbraw/zinc/82/72/96/935827296.db2.gz DMMXAPFZOZRJID-UHFFFAOYSA-N 0 0 371.443 3.978 20 5 FHBDRN COc1ccccc1NC1CCN(C(=O)c2ccc([N+](=O)[O-])cc2C)CC1 ZINC000085499295 935827406 /nfs/dbraw/zinc/82/74/06/935827406.db2.gz GTDGLGFLPRRADB-UHFFFAOYSA-N 0 0 369.421 3.629 20 5 FHBDRN O=C(NCCc1cccs1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000050292177 935827524 /nfs/dbraw/zinc/82/75/24/935827524.db2.gz ZLUSSZXLLXQSID-UHFFFAOYSA-N 0 0 359.432 3.752 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1Sc1nnc2ccccn21 ZINC000023845379 935829622 /nfs/dbraw/zinc/82/96/22/935829622.db2.gz SJMVTUREVBAQEY-UHFFFAOYSA-N 0 0 351.185 3.551 20 5 FHBDRN CCNC(=O)c1ccc(CNc2ccc(C(=O)CC)cc2[N+](=O)[O-])cc1 ZINC000479372098 935831273 /nfs/dbraw/zinc/83/12/73/935831273.db2.gz DIURZRQQIKACJB-UHFFFAOYSA-N 0 0 355.394 3.549 20 5 FHBDRN O=C(c1csc([N+](=O)[O-])c1)N1CC[C@H](OCCCc2ccccc2)C1 ZINC000176335489 935835654 /nfs/dbraw/zinc/83/56/54/935835654.db2.gz RDSVXFMNVVUPBE-INIZCTEOSA-N 0 0 360.435 3.520 20 5 FHBDRN CCn1nc(C)c([N+](=O)[O-])c1NCCOc1ccc(C(F)(F)F)cc1 ZINC000479375806 935835727 /nfs/dbraw/zinc/83/57/27/935835727.db2.gz GWOBSGPBOZBSJX-UHFFFAOYSA-N 0 0 358.320 3.629 20 5 FHBDRN CCn1nc(C)c([N+](=O)[O-])c1N(C)Cc1cccc(Br)c1 ZINC000479380584 935835828 /nfs/dbraw/zinc/83/58/28/935835828.db2.gz SJJXJAAAYYYUOC-UHFFFAOYSA-N 0 0 353.220 3.519 20 5 FHBDRN C[C@H](c1ccncc1)N(C)C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000050355280 935837651 /nfs/dbraw/zinc/83/76/51/935837651.db2.gz JEIQAGLPGBVNKQ-GFCCVEGCSA-N 0 0 368.418 3.947 20 5 FHBDRN Cc1ccc2nc(NC(=O)CSc3ncccc3[N+](=O)[O-])sc2c1 ZINC000127901520 935837657 /nfs/dbraw/zinc/83/76/57/935837657.db2.gz MFLOYHNKCRFISR-UHFFFAOYSA-N 0 0 360.420 3.639 20 5 FHBDRN C[C@@H]1CCCC[C@@H]1OCC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000479470083 935840631 /nfs/dbraw/zinc/84/06/31/935840631.db2.gz IIBOCOYRTBJIKP-WBMJQRKESA-N 0 0 354.834 3.502 20 5 FHBDRN COc1cccc(O[C@H](C)CNC(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)c1 ZINC000127929288 935844731 /nfs/dbraw/zinc/84/47/31/935844731.db2.gz IILUVVXYSULCCL-CYBMUJFWSA-N 0 0 373.409 3.809 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N(C)Cc1ccc2c(c1)OCO2 ZINC000479540790 935855171 /nfs/dbraw/zinc/85/51/71/935855171.db2.gz KNNXETPKZDFTHZ-UHFFFAOYSA-N 0 0 374.418 3.708 20 5 FHBDRN CCOC(=O)c1ccccc1N(CC)C(=O)c1ccc([N+](=O)[O-])cc1C ZINC000135160534 935889607 /nfs/dbraw/zinc/88/96/07/935889607.db2.gz HFOUSJFSQGFTNL-UHFFFAOYSA-N 0 0 356.378 3.747 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)N1CCC[C@@H](c2ccccc2)C1 ZINC000562118191 935889638 /nfs/dbraw/zinc/88/96/38/935889638.db2.gz HPQUREDUTBJUJF-GOSISDBHSA-N 0 0 363.417 3.956 20 5 FHBDRN CC[C@@H](C)COc1cc([N+](=O)[O-])c(CN2CCCOC[C@@H]2C)cc1OC ZINC000611668198 935890650 /nfs/dbraw/zinc/89/06/50/935890650.db2.gz DOCKQGCYVKYVQF-CABCVRRESA-N 0 0 366.458 3.639 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)CCCOc1ccc2c(c1)OCO2 ZINC000479831170 935902299 /nfs/dbraw/zinc/90/22/99/935902299.db2.gz PHTZHIHBNSKEFB-UHFFFAOYSA-N 0 0 372.377 3.738 20 5 FHBDRN C[C@H]1CCN(C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C[C@H](C)C1 ZINC000158691143 935914287 /nfs/dbraw/zinc/91/42/87/935914287.db2.gz MTTMSSLHYDCUHT-JKSUJKDBSA-N 0 0 359.470 3.706 20 5 FHBDRN COc1cc(C(=O)NCCc2c[nH]c3cc(C)ccc23)cc([N+](=O)[O-])c1C ZINC000479927923 935918700 /nfs/dbraw/zinc/91/87/00/935918700.db2.gz IKIZJXZKPBKGHZ-UHFFFAOYSA-N 0 0 367.405 3.674 20 5 FHBDRN Cn1cnc([N+](=O)[O-])c1CN1CC=C(c2ccc(Cl)c(Cl)c2)CC1 ZINC000511179715 935925544 /nfs/dbraw/zinc/92/55/44/935925544.db2.gz ARNXBELDAISBNZ-UHFFFAOYSA-N 0 0 367.236 3.924 20 5 FHBDRN COc1cc(C(=O)NCc2ccccc2OCC2CC2)cc([N+](=O)[O-])c1C ZINC000479972499 935932779 /nfs/dbraw/zinc/93/27/79/935932779.db2.gz XXKHRMSLOFLGGR-UHFFFAOYSA-N 0 0 370.405 3.631 20 5 FHBDRN COc1cc(C(=O)N(C)[C@@H](C)Cc2ccc(C)cc2)cc([N+](=O)[O-])c1C ZINC000479990712 935936996 /nfs/dbraw/zinc/93/69/96/935936996.db2.gz LKVINIULECDZHF-AWEZNQCLSA-N 0 0 356.422 3.923 20 5 FHBDRN O=C(NCc1ccc(F)cc1F)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000431471836 935937667 /nfs/dbraw/zinc/93/76/67/935937667.db2.gz OISSADNCKSTZNS-UHFFFAOYSA-N 0 0 371.137 3.566 20 5 FHBDRN C[C@H](NC(=O)Nc1ccc(-c2ccccc2)nn1)c1cccc([N+](=O)[O-])c1 ZINC000158723639 935938728 /nfs/dbraw/zinc/93/87/28/935938728.db2.gz SRCHCWAMIAXMPB-ZDUSSCGKSA-N 0 0 363.377 3.935 20 5 FHBDRN COc1ccc(OC)c([C@@H](C)Nc2ncnc3ccc([N+](=O)[O-])cc32)c1 ZINC000611700355 935939691 /nfs/dbraw/zinc/93/96/91/935939691.db2.gz QEOJAPLGSINOCO-LLVKDONJSA-N 0 0 354.366 3.728 20 5 FHBDRN O=[N+]([O-])c1ccc2ncnc(NCc3csc(-c4ccccc4)n3)c2c1 ZINC000611699794 935939848 /nfs/dbraw/zinc/93/98/48/935939848.db2.gz GYMOMIRUSYRQHI-UHFFFAOYSA-N 0 0 363.402 3.696 20 5 FHBDRN CCOC(=O)[C@@H](Cc1cccc(Cl)c1)NCc1ccc([N+](=O)[O-])cc1 ZINC000582700007 935956578 /nfs/dbraw/zinc/95/65/78/935956578.db2.gz SWAFNKCGRPJXSO-QGZVFWFLSA-N 0 0 362.813 3.512 20 5 FHBDRN Cc1c(CNC(=O)N(C)Cc2cc(F)c(F)c(F)c2)cccc1[N+](=O)[O-] ZINC000480070833 935957531 /nfs/dbraw/zinc/95/75/31/935957531.db2.gz OJGVZQPOLFIKTE-UHFFFAOYSA-N 0 0 367.327 3.662 20 5 FHBDRN Cc1c(CNC(=O)Nc2ccc(NC(=O)C(C)C)cc2)cccc1[N+](=O)[O-] ZINC000480071844 935957542 /nfs/dbraw/zinc/95/75/42/935957542.db2.gz SHUNUQGRUGOVQP-UHFFFAOYSA-N 0 0 370.409 3.819 20 5 FHBDRN CCn1nc(C)c([N+](=O)[O-])c1N1CCC[C@@H](Oc2ccccc2Cl)C1 ZINC000480091105 935960384 /nfs/dbraw/zinc/96/03/84/935960384.db2.gz JPDCSCUNEIBMCM-CYBMUJFWSA-N 0 0 364.833 3.821 20 5 FHBDRN CCc1ccc([C@H]2CCN(c3ccc(C(=O)NC)cc3[N+](=O)[O-])C2)cc1 ZINC000431474588 935964905 /nfs/dbraw/zinc/96/49/05/935964905.db2.gz UFFLSFQPDRFEKY-KRWDZBQOSA-N 0 0 353.422 3.511 20 5 FHBDRN COC(=O)c1cc(C)nc(N[C@H](c2ccc(OC)cc2)C(C)C)c1[N+](=O)[O-] ZINC000582713850 935974742 /nfs/dbraw/zinc/97/47/42/935974742.db2.gz IRPDXCIECRTGTH-INIZCTEOSA-N 0 0 373.409 3.903 20 5 FHBDRN O=[N+]([O-])c1ccc2ncnc(N(Cc3ccccc3)C[C@@H]3CCCO3)c2c1 ZINC000611711357 935977012 /nfs/dbraw/zinc/97/70/12/935977012.db2.gz LBENOVZFXFAXLG-KRWDZBQOSA-N 0 0 364.405 3.724 20 5 FHBDRN CCOC(=O)c1cc(C(=O)N([C@@H](C)[C@@H](C)CC)C2CC2)cc([N+](=O)[O-])c1 ZINC000519115772 945137628 /nfs/dbraw/zinc/13/76/28/945137628.db2.gz NDSNVMFOAVSFGM-STQMWFEESA-N 0 0 362.426 3.811 20 5 FHBDRN COc1ccc(CCNc2cc(C)c([N+](=O)[O-])cn2)cc1OC(F)F ZINC000074745913 935987892 /nfs/dbraw/zinc/98/78/92/935987892.db2.gz JHWDVDHGMHOCFL-UHFFFAOYSA-N 0 0 353.325 3.563 20 5 FHBDRN O=C(c1ccccc1)c1ccc(NC[C@@H](O)c2ccco2)c([N+](=O)[O-])c1 ZINC000075668712 936014485 /nfs/dbraw/zinc/01/44/85/936014485.db2.gz VYABYHZZJCPDKV-QGZVFWFLSA-N 0 0 352.346 3.564 20 5 FHBDRN CSc1ccc([C@@H](C)Nc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])cc1 ZINC000075669130 936014801 /nfs/dbraw/zinc/01/48/01/936014801.db2.gz 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LXXDDJTWKWVUFG-ZDUSSCGKSA-N 0 0 352.459 3.697 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)C[C@H](c1nccn1C)C(F)(F)F ZINC000582913097 936285926 /nfs/dbraw/zinc/28/59/26/936285926.db2.gz AGOUKQAQWIUQCT-LLVKDONJSA-N 0 0 370.331 3.620 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(Cc2noc([C@@H](C)OCc3ccccc3)n2)c1 ZINC000277975649 936292393 /nfs/dbraw/zinc/29/23/93/936292393.db2.gz TUSHTUPXLSBJTL-CYBMUJFWSA-N 0 0 369.377 3.855 20 5 FHBDRN CCC(=O)c1ccc(NCc2cccc(N3CCOCC3)c2)c([N+](=O)[O-])c1 ZINC000432130758 945154745 /nfs/dbraw/zinc/15/47/45/945154745.db2.gz SSCBXZDMIZAYQG-UHFFFAOYSA-N 0 0 369.421 3.636 20 5 FHBDRN CCOc1ccc(C(=O)Nc2ccc(-n3cccn3)c(F)c2)cc1[N+](=O)[O-] ZINC000047419802 945154927 /nfs/dbraw/zinc/15/49/27/945154927.db2.gz QYEAICJBKSXSMA-UHFFFAOYSA-N 0 0 370.340 3.571 20 5 FHBDRN Cc1cc(-c2nc(-c3ccc([N+](=O)[O-])cc3C)no2)nc(C(F)(F)F)n1 ZINC000582930317 936301978 /nfs/dbraw/zinc/30/19/78/936301978.db2.gz DCYUEJJWSIQUDM-UHFFFAOYSA-N 0 0 365.271 3.737 20 5 FHBDRN 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3.602 20 5 FHBDRN CCN(C(=O)CCn1nc(C)c([N+](=O)[O-])c1C)[C@@H](C)c1ccc(F)cc1 ZINC000102233628 938301499 /nfs/dbraw/zinc/30/14/99/938301499.db2.gz OSLUUSSXSNOZPB-ZDUSSCGKSA-N 0 0 362.405 3.547 20 5 FHBDRN O=C(NCc1ccco1)c1cccc(CNc2ccc([N+](=O)[O-])cc2)c1 ZINC000052453631 938309974 /nfs/dbraw/zinc/30/99/74/938309974.db2.gz RMLPROIOBDPFRQ-UHFFFAOYSA-N 0 0 351.362 3.730 20 5 FHBDRN C[C@@H]1C[C@@H](C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)C[C@H](C)O1 ZINC000245706192 938310958 /nfs/dbraw/zinc/31/09/58/938310958.db2.gz BXJZPVQYFGDMKR-PTEHBNRSSA-N 0 0 361.423 3.860 20 5 FHBDRN CCOC(=O)c1ccc(C(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000583595865 938312363 /nfs/dbraw/zinc/31/23/63/938312363.db2.gz LURZFZMFZFGIEY-UHFFFAOYSA-N 0 0 368.389 3.576 20 5 FHBDRN Cc1ccccc1OCCCN(C)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000052457712 938312650 /nfs/dbraw/zinc/31/26/50/938312650.db2.gz WZAUSSPIDPSUFZ-UHFFFAOYSA-N 0 0 372.421 3.671 20 5 FHBDRN C[C@@H](NC(=O)N[C@H](C)c1ccccc1[N+](=O)[O-])c1nc2c(s1)CCC2 ZINC000458616550 938327145 /nfs/dbraw/zinc/32/71/45/938327145.db2.gz JYVHWNWVBLKEKD-GHMZBOCLSA-N 0 0 360.439 3.661 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N[C@@H](c1ccccc1F)[C@H](C)O ZINC000583634256 938329283 /nfs/dbraw/zinc/32/92/83/938329283.db2.gz PJYMEUIVIDECCC-YVEFUNNKSA-N 0 0 361.373 3.594 20 5 FHBDRN O=c1[nH]c(N2CC[C@H](c3cccc(Cl)c3)C2)nc2ccc([N+](=O)[O-])cc12 ZINC000432135869 945166761 /nfs/dbraw/zinc/16/67/61/945166761.db2.gz MUDWMVRYFYLAOW-LBPRGKRZSA-N 0 0 370.796 3.891 20 5 FHBDRN Cc1nc([C@@H]2CCCCCN2C(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)no1 ZINC000583668256 938348222 /nfs/dbraw/zinc/34/82/22/938348222.db2.gz MHNLOSXKFLDRGC-LRDDRELGSA-N 0 0 358.398 3.534 20 5 FHBDRN Cc1cc(NC(=O)CSCc2ccccn2)c2cc([N+](=O)[O-])ccc2n1 ZINC000161827572 938355563 /nfs/dbraw/zinc/35/55/63/938355563.db2.gz MSBXJZHPFPEFEQ-UHFFFAOYSA-N 0 0 368.418 3.718 20 5 FHBDRN COc1ccc(C(F)(F)F)cc1-c1noc(-c2cccnc2[N+](=O)[O-])n1 ZINC001213171819 938355924 /nfs/dbraw/zinc/35/59/24/938355924.db2.gz AEUUHIMKQDUVOJ-UHFFFAOYSA-N 0 0 366.255 3.734 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@H]1c2sccc2OC(C)(C)[C@@H]1O ZINC000583680811 938358715 /nfs/dbraw/zinc/35/87/15/938358715.db2.gz PWHGBDSEHDYLMO-XQAQDONZSA-N 0 0 362.451 3.889 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)NCc2cc(F)cc(Br)c2)c1 ZINC000525647423 938369745 /nfs/dbraw/zinc/36/97/45/938369745.db2.gz LVESIAGOAMVFOH-UHFFFAOYSA-N 0 0 367.174 3.735 20 5 FHBDRN O=C(Nc1ccc(N2CCCCC2)cn1)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000507374337 945171244 /nfs/dbraw/zinc/17/12/44/945171244.db2.gz HWTOZQIPFGIGPY-UHFFFAOYSA-N 0 0 365.393 3.714 20 5 FHBDRN CCC[C@@H]1C[C@@H](C(=O)Nc2cc(C)nc3ccc([N+](=O)[O-])cc32)CCO1 ZINC000161867988 938390951 /nfs/dbraw/zinc/39/09/51/938390951.db2.gz WMBKPFVRJHYXLB-DZGCQCFKSA-N 0 0 357.410 3.985 20 5 FHBDRN Cc1cc(N(C)C)ccc1NC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000124183890 945171203 /nfs/dbraw/zinc/17/12/03/945171203.db2.gz COYWCGDXXOUYGR-UHFFFAOYSA-N 0 0 354.410 3.559 20 5 FHBDRN Cc1cccc(C2=CCN(S(=O)(=O)c3ccc([N+](=O)[O-])c(C)c3)CC2)c1 ZINC000536122323 938396135 /nfs/dbraw/zinc/39/61/35/938396135.db2.gz XNOGILDDXASVEU-UHFFFAOYSA-N 0 0 372.446 3.690 20 5 FHBDRN Cc1sc(S(=O)(=O)N2CCCCC[C@H]2c2ccco2)cc1[N+](=O)[O-] ZINC000124186422 945171500 /nfs/dbraw/zinc/17/15/00/945171500.db2.gz RIXBQZCCVDVHDN-LBPRGKRZSA-N 0 0 370.452 3.864 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000278420174 938407603 /nfs/dbraw/zinc/40/76/03/938407603.db2.gz CDCJZRHSVNPEJV-WBVHZDCISA-N 0 0 358.369 3.692 20 5 FHBDRN COc1ccc(-c2nc3cc(Br)c(C)nc3[nH]2)cc1[N+](=O)[O-] ZINC000178983359 938437196 /nfs/dbraw/zinc/43/71/96/938437196.db2.gz MFFZYJPYXZEKSL-UHFFFAOYSA-N 0 0 363.171 3.613 20 5 FHBDRN Cc1cc(C[C@@H](C)NC(=O)c2csc([N+](=O)[O-])c2)n(-c2ccccc2)n1 ZINC000178984061 938437483 /nfs/dbraw/zinc/43/74/83/938437483.db2.gz UJDLWDPBXQGLIT-GFCCVEGCSA-N 0 0 370.434 3.511 20 5 FHBDRN C[C@@H]1[C@@H](Cc2ccccc2)CCN1C(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000583835684 938441268 /nfs/dbraw/zinc/44/12/68/938441268.db2.gz PPMOVHJXQPUKTL-UKRRQHHQSA-N 0 0 374.387 3.895 20 5 FHBDRN CCS[C@@H]1CCCC[C@H]1NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000427206418 945175127 /nfs/dbraw/zinc/17/51/27/945175127.db2.gz RMAWOAZJMFISMD-HUUCEWRRSA-N 0 0 356.875 3.971 20 5 FHBDRN O=C(OCC1CC(F)(F)C1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000835489713 938445040 /nfs/dbraw/zinc/44/50/40/938445040.db2.gz OTZAOCKHTWSVKJ-UHFFFAOYSA-N 0 0 350.115 3.559 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)cnc1N[C@@H](CO)c1ccc(C(F)(F)F)cc1 ZINC000536142771 938445229 /nfs/dbraw/zinc/44/52/29/938445229.db2.gz SEBFPBOAGAVSRG-NSHDSACASA-N 0 0 361.707 3.808 20 5 FHBDRN COc1ccc([C@H](Nc2ccc(C)cc2[N+](=O)[O-])c2nccn2C)cc1 ZINC000080540815 938449692 /nfs/dbraw/zinc/44/96/92/938449692.db2.gz WTLWEQPUAFVCGI-SFHVURJKSA-N 0 0 352.394 3.847 20 5 FHBDRN CC(C)(C)C1CN(C(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C1 ZINC000458701291 938451313 /nfs/dbraw/zinc/45/13/13/938451313.db2.gz CDWBTDMPYLNJEU-UHFFFAOYSA-N 0 0 359.348 3.801 20 5 FHBDRN C[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)c1cc2c(cc1[N+](=O)[O-])OCCCO2 ZINC001126454605 945176553 /nfs/dbraw/zinc/17/65/53/945176553.db2.gz RSNHRHMWNQKMSS-UMVBOHGHSA-N 0 0 360.410 3.549 20 5 FHBDRN O=C(c1cnn(-c2ccccc2F)c1)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000161946226 938480038 /nfs/dbraw/zinc/48/00/38/938480038.db2.gz IAZZJDHAAWSKGD-UHFFFAOYSA-N 0 0 366.352 3.513 20 5 FHBDRN C[C@H]1CSC[C@H]1NC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000583922743 938488215 /nfs/dbraw/zinc/48/82/15/938488215.db2.gz AFZLPMNXTKJDQA-SUMWQHHRSA-N 0 0 371.462 3.688 20 5 FHBDRN C[C@H]1CSC[C@@H]1NC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000583922742 938488308 /nfs/dbraw/zinc/48/83/08/938488308.db2.gz AFZLPMNXTKJDQA-GUYCJALGSA-N 0 0 371.462 3.688 20 5 FHBDRN O=C(Nc1ccn(CC(F)(F)F)n1)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000179012081 938488648 /nfs/dbraw/zinc/48/86/48/938488648.db2.gz KIBJWVORKHUCMU-UHFFFAOYSA-N 0 0 370.312 3.821 20 5 FHBDRN COc1ccc(F)cc1[C@H](C)NC(=O)c1cc(F)c([N+](=O)[O-])cc1F ZINC000135456806 938490347 /nfs/dbraw/zinc/49/03/47/938490347.db2.gz NFZNNORDTPCNAN-QMMMGPOBSA-N 0 0 354.284 3.512 20 5 FHBDRN CC(C)C[C@@H](C)Oc1cc(CNC(=O)c2ccccc2[N+](=O)[O-])ccn1 ZINC000110949945 945180250 /nfs/dbraw/zinc/18/02/50/945180250.db2.gz DRPALJRDZHJQLV-CQSZACIVSA-N 0 0 357.410 3.733 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)NC1(c2ccc(F)cc2)CC1 ZINC000536171675 938503205 /nfs/dbraw/zinc/50/32/05/938503205.db2.gz PSSMMSKSFIHKFI-UHFFFAOYSA-N 0 0 353.353 3.563 20 5 FHBDRN CSc1cccc(-c2nc(-c3ccc4c(c3)OCO4)no2)c1[N+](=O)[O-] ZINC000583960055 938505275 /nfs/dbraw/zinc/50/52/75/938505275.db2.gz FZMYEZMIJJFVCN-UHFFFAOYSA-N 0 0 357.347 3.762 20 5 FHBDRN CN(C(=O)c1ccc(N2CCCCCC2)nc1)c1cccc([N+](=O)[O-])c1 ZINC000179021634 938510156 /nfs/dbraw/zinc/51/01/56/938510156.db2.gz JLSJQDIBDWKMSE-UHFFFAOYSA-N 0 0 354.410 3.647 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)N(Cc2ccco2)c2ccc(Cl)cc2)n1 ZINC000427191224 945181392 /nfs/dbraw/zinc/18/13/92/945181392.db2.gz XCDGYTCQRQTTCT-UHFFFAOYSA-N 0 0 374.784 3.905 20 5 FHBDRN CCCn1c(Sc2ccc(F)cc2[N+](=O)[O-])nnc1-c1ccncc1 ZINC000247965403 938522869 /nfs/dbraw/zinc/52/28/69/938522869.db2.gz BLJXVZQDQOVTMQ-UHFFFAOYSA-N 0 0 359.386 3.949 20 5 FHBDRN CN(Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)[C@@H](CO)c1ccccc1 ZINC000584007119 938535322 /nfs/dbraw/zinc/53/53/22/938535322.db2.gz IHTUTPGREANUCT-INIZCTEOSA-N 0 0 354.328 3.779 20 5 FHBDRN O=C(Nc1ccc2nc(C3CC3)oc2c1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000176803010 938535603 /nfs/dbraw/zinc/53/56/03/938535603.db2.gz PERAUJSEKQTMFV-UHFFFAOYSA-N 0 0 368.305 3.774 20 5 FHBDRN COc1ccc(CCNC(=O)c2ccc([N+](=O)[O-])cc2Cl)c(Cl)c1 ZINC000151382983 938535786 /nfs/dbraw/zinc/53/57/86/938535786.db2.gz PCUAMSMNFUTQLX-UHFFFAOYSA-N 0 0 369.204 3.883 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N(C)[C@H](C)c1c(F)cccc1F ZINC000427195353 945184485 /nfs/dbraw/zinc/18/44/85/945184485.db2.gz DGQZMTCKTIESBI-SNVBAGLBSA-N 0 0 350.321 3.715 20 5 FHBDRN CC(C)(C)OC(=O)Cc1noc(-c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)n1 ZINC000545185305 938545755 /nfs/dbraw/zinc/54/57/55/938545755.db2.gz ZHRPCZUITPUPPP-UHFFFAOYSA-N 0 0 361.398 3.827 20 5 FHBDRN Cc1cc(OCC(=O)OCc2ccc([N+](=O)[O-])c(F)c2)ccc1Cl ZINC000781959116 945184586 /nfs/dbraw/zinc/18/45/86/945184586.db2.gz VAFZECUJVYOXRP-UHFFFAOYSA-N 0 0 353.733 3.818 20 5 FHBDRN CCOC[C@@H]1CCN(c2cc(C(F)(F)C(F)(F)F)ncc2[N+](=O)[O-])C1 ZINC000278578827 938550775 /nfs/dbraw/zinc/55/07/75/938550775.db2.gz XYKFTEAFFBIDEO-SECBINFHSA-N 0 0 369.290 3.507 20 5 FHBDRN Cc1cc(OS(=O)(=O)c2cscc2C(F)F)c(F)cc1[N+](=O)[O-] ZINC001211608624 938572609 /nfs/dbraw/zinc/57/26/09/938572609.db2.gz JEGNHOIEJXWCIS-UHFFFAOYSA-N 0 0 367.326 3.809 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1Cl)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000162010640 938579200 /nfs/dbraw/zinc/57/92/00/938579200.db2.gz QTEZXNQQCJWDHN-UHFFFAOYSA-N 0 0 361.741 3.749 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000158810062 938580291 /nfs/dbraw/zinc/58/02/91/938580291.db2.gz BHKIWLDYURPBBS-HNAYVOBHSA-N 0 0 354.406 3.801 20 5 FHBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)N1CCC[C@@H](Cc2ccccc2)C1 ZINC000536207510 938581782 /nfs/dbraw/zinc/58/17/82/938581782.db2.gz AOZALRQRGOMAOD-IBGZPJMESA-N 0 0 367.449 3.802 20 5 FHBDRN Cc1ncc([N+](=O)[O-])n1CCOC(=O)c1cc(C(C)C)nc2ccccc21 ZINC000162025935 938597945 /nfs/dbraw/zinc/59/79/45/938597945.db2.gz CZJICUOQJWCICA-UHFFFAOYSA-N 0 0 368.393 3.628 20 5 FHBDRN C[C@@H](NC(=O)N1CCc2c3ccccc3[nH]c2C1)c1cccc([N+](=O)[O-])c1 ZINC000179045015 938598478 /nfs/dbraw/zinc/59/84/78/938598478.db2.gz BGTQLKCTEUOPEU-CYBMUJFWSA-N 0 0 364.405 3.905 20 5 FHBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)C[C@@H]1OC(=O)c2ccccc21 ZINC000135497449 938599023 /nfs/dbraw/zinc/59/90/23/938599023.db2.gz HWWLKPNHQDQKJV-HNNXBMFYSA-N 0 0 360.753 3.797 20 5 FHBDRN COC(=O)[C@H](NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)c1ccsc1 ZINC000278657529 938627899 /nfs/dbraw/zinc/62/78/99/938627899.db2.gz HBFGFTOURHDZPC-CYBMUJFWSA-N 0 0 374.340 3.679 20 5 FHBDRN CC[C@@H](Nc1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1)c1ccc(Cl)cc1 ZINC000584179489 938630433 /nfs/dbraw/zinc/63/04/33/938630433.db2.gz BNULXEZUNOSNOA-CQSZACIVSA-N 0 0 358.785 3.882 20 5 FHBDRN Cc1c(CC(=O)Nc2ccc3c(c2)C(=O)CC(C)(C)O3)cccc1[N+](=O)[O-] ZINC000584179593 938630526 /nfs/dbraw/zinc/63/05/26/938630526.db2.gz IYDUFLRFDHCSEM-UHFFFAOYSA-N 0 0 368.389 3.828 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])c[nH]1)N1CCC(c2c[nH]c3ccc(F)cc32)CC1 ZINC000584195452 938636128 /nfs/dbraw/zinc/63/61/28/938636128.db2.gz CHMGFAFVPYOVRN-UHFFFAOYSA-N 0 0 356.357 3.563 20 5 FHBDRN O=C(C1CCN(c2ccccc2[N+](=O)[O-])CC1)N1CC(C2CCCCC2)C1 ZINC000584252043 938657327 /nfs/dbraw/zinc/65/73/27/938657327.db2.gz PYAKBBUTTOZKMP-UHFFFAOYSA-N 0 0 371.481 3.850 20 5 FHBDRN CCC(C)(C)[C@H]1CCc2nc(NC(=O)c3n[nH]cc3[N+](=O)[O-])sc2C1 ZINC000584249485 938658251 /nfs/dbraw/zinc/65/82/51/938658251.db2.gz NQGMOQAWLAVJED-VIFPVBQESA-N 0 0 363.443 3.568 20 5 FHBDRN C[C@@H](Nc1ccc(C(=O)NCc2ccco2)cc1[N+](=O)[O-])c1ccccn1 ZINC000052916457 938662040 /nfs/dbraw/zinc/66/20/40/938662040.db2.gz NMEIIEGSOPCKGK-CYBMUJFWSA-N 0 0 366.377 3.686 20 5 FHBDRN O=[N+]([O-])c1ccc([C@H](NC[C@H](CO)Cc2ccccc2)C(F)(F)F)cc1 ZINC000584296322 938675673 /nfs/dbraw/zinc/67/56/73/938675673.db2.gz MQAQJBPXHQOKQP-PBHICJAKSA-N 0 0 368.355 3.639 20 5 FHBDRN COc1ccc(OC)c(-c2noc(/C=C/c3ccccc3[N+](=O)[O-])n2)c1 ZINC000584298623 938676312 /nfs/dbraw/zinc/67/63/12/938676312.db2.gz ADGJCTNNQJSPFO-JXMROGBWSA-N 0 0 353.334 3.832 20 5 FHBDRN COc1ccc([C@H]2CCCN2C(=O)c2cccc([N+](=O)[O-])c2C)c(OC)c1 ZINC000052955403 938676835 /nfs/dbraw/zinc/67/68/35/938676835.db2.gz MJUFKXZYHILRFL-GOSISDBHSA-N 0 0 370.405 3.898 20 5 FHBDRN O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)N(CC(F)F)c1ccc(F)cc1 ZINC000584315330 938683581 /nfs/dbraw/zinc/68/35/81/938683581.db2.gz SSRZRMNQFOVQDH-UHFFFAOYSA-N 0 0 374.265 3.853 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NCc1ccc(C(C)C)cc1 ZINC000584321921 938685246 /nfs/dbraw/zinc/68/52/46/938685246.db2.gz SIBVFSUJTINWHA-UHFFFAOYSA-N 0 0 369.421 3.536 20 5 FHBDRN O=C(CCCOc1cccc(F)c1)N1CCCc2ccc([N+](=O)[O-])cc21 ZINC000573194380 938699070 /nfs/dbraw/zinc/69/90/70/938699070.db2.gz QHWSOWPIKGAYCP-UHFFFAOYSA-N 0 0 358.369 3.872 20 5 FHBDRN Cc1cc(Sc2nnc(-c3ccccc3Cl)n2C)ncc1[N+](=O)[O-] ZINC000074738513 938706231 /nfs/dbraw/zinc/70/62/31/938706231.db2.gz YDQNTBZKXTWSHO-UHFFFAOYSA-N 0 0 361.814 3.898 20 5 FHBDRN Cc1cc(NCc2ccc(OCc3ccccn3)cc2)ncc1[N+](=O)[O-] ZINC000074741969 938706812 /nfs/dbraw/zinc/70/68/12/938706812.db2.gz RDGCSQIZGMIQFS-UHFFFAOYSA-N 0 0 350.378 3.884 20 5 FHBDRN CNC(=O)c1ccc(NCCOc2ccccc2C(C)(C)C)c([N+](=O)[O-])c1 ZINC000518199541 945197660 /nfs/dbraw/zinc/19/76/60/945197660.db2.gz CZFWAXWBTJYWGV-UHFFFAOYSA-N 0 0 371.437 3.743 20 5 FHBDRN CN(Cc1ccc[nH]1)C(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000080970613 938711281 /nfs/dbraw/zinc/71/12/81/938711281.db2.gz TVEPSKRWCJJTMT-UHFFFAOYSA-N 0 0 350.378 3.939 20 5 FHBDRN CC(=O)c1ccc([N+](=O)[O-])cc1N1CCC[C@@H](C(=O)Nc2ccccc2)C1 ZINC000584372095 938717109 /nfs/dbraw/zinc/71/71/09/938717109.db2.gz HTIGMBJLMLWLFH-OAHLLOKOSA-N 0 0 367.405 3.653 20 5 FHBDRN Cc1ccsc1CN(C)C(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000053012164 938717313 /nfs/dbraw/zinc/71/73/13/938717313.db2.gz WVAMGTLZNSCKGD-UHFFFAOYSA-N 0 0 370.434 3.637 20 5 FHBDRN CCc1ccc(S(=O)(=O)N(C)c2ccccc2SC)cc1[N+](=O)[O-] ZINC000573206697 938719225 /nfs/dbraw/zinc/71/92/25/938719225.db2.gz JUFIZZBRMQILIH-UHFFFAOYSA-N 0 0 366.464 3.704 20 5 FHBDRN CCc1cccnc1NC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000506015735 945200270 /nfs/dbraw/zinc/20/02/70/945200270.db2.gz XQLIATYSXVMFNB-UHFFFAOYSA-N 0 0 350.172 3.567 20 5 FHBDRN CCCCC[C@@H]1CCCN1C(=O)c1nnn(-c2cccc([N+](=O)[O-])c2)c1C ZINC000427212625 945205068 /nfs/dbraw/zinc/20/50/68/945205068.db2.gz MMMJUTGPQPKUEU-OAHLLOKOSA-N 0 0 371.441 3.669 20 5 FHBDRN COCc1cccc(CNc2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)c1 ZINC000077524102 938803538 /nfs/dbraw/zinc/80/35/38/938803538.db2.gz BPEZZLLJVJTOTI-UHFFFAOYSA-N 0 0 369.421 3.589 20 5 FHBDRN CC(C)[C@@H]1C[C@@H](NC(=O)CCc2c(Cl)cccc2[N+](=O)[O-])CCO1 ZINC000935224986 938816940 /nfs/dbraw/zinc/81/69/40/938816940.db2.gz DKSCAIMQPCBVPI-LRDDRELGSA-N 0 0 354.834 3.501 20 5 FHBDRN Cc1ccc(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)cc1[N+](=O)[O-] ZINC000584431060 938860700 /nfs/dbraw/zinc/86/07/00/938860700.db2.gz UOYWTJSVADVRQU-INIZCTEOSA-N 0 0 351.406 3.923 20 5 FHBDRN CCCc1nc([C@H](NCc2cc(F)ccc2[N+](=O)[O-])c2ccccc2)no1 ZINC000363582925 938862767 /nfs/dbraw/zinc/86/27/67/938862767.db2.gz OKEWRFLHJRNDET-GOSISDBHSA-N 0 0 370.384 3.949 20 5 FHBDRN C/C(=C/C(=O)N1CC[C@H](Oc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000843618860 938873819 /nfs/dbraw/zinc/87/38/19/938873819.db2.gz GJZNZSMGFHLDBN-ZDRDQBANSA-N 0 0 352.390 3.678 20 5 FHBDRN CSc1ccc(CNC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)cc1 ZINC000179096502 938884829 /nfs/dbraw/zinc/88/48/29/938884829.db2.gz MVGGKKDMEQRSBH-UHFFFAOYSA-N 0 0 355.419 3.657 20 5 FHBDRN O=C(/C=C\c1ccc2c(c1)OCO2)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000255597377 938885957 /nfs/dbraw/zinc/88/59/57/938885957.db2.gz MQFUBUPBRRNOJV-WMZJFQQLSA-N 0 0 366.373 3.528 20 5 FHBDRN COC[C@H](Nc1cc(OC)c([N+](=O)[O-])cc1F)c1ccc(F)c(F)c1 ZINC000091026780 938887586 /nfs/dbraw/zinc/88/75/86/938887586.db2.gz BOOFIIBRKHLJNA-AWEZNQCLSA-N 0 0 356.300 3.820 20 5 FHBDRN COc1ccccc1N1CCC(Nc2c(OC)cccc2[N+](=O)[O-])CC1 ZINC000584440220 938887957 /nfs/dbraw/zinc/88/79/57/938887957.db2.gz JOKSMWQDQKNXPJ-UHFFFAOYSA-N 0 0 357.410 3.693 20 5 FHBDRN CCS[C@@H]1CCCCN(C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000480381758 938898931 /nfs/dbraw/zinc/89/89/31/938898931.db2.gz ZKKUOXYZYCUDEC-MRXNPFEDSA-N 0 0 374.466 3.528 20 5 FHBDRN CC[C@@H](OC(=O)[C@@H]1CC[C@H]1C(=O)OC(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC001267374988 938907691 /nfs/dbraw/zinc/90/76/91/938907691.db2.gz XIRPPPPMUZRSRQ-BZUAXINKSA-N 0 0 363.410 3.957 20 5 FHBDRN Cc1c(C(=O)N[C@H](C[C@@H]2CCOC2)c2ccccc2)cccc1[N+](=O)[O-] ZINC000158853435 938911260 /nfs/dbraw/zinc/91/12/60/938911260.db2.gz FJXWBEMMCUGNRW-MAUKXSAKSA-N 0 0 354.406 3.801 20 5 FHBDRN C[C@H](Nc1ccc([N+](=O)[O-])c(OC(F)F)c1)[C@H](O)c1ccc(F)cc1 ZINC000092653341 938917007 /nfs/dbraw/zinc/91/70/07/938917007.db2.gz QJKWKTFGCOOGIU-VFZGTOFNSA-N 0 0 356.300 3.869 20 5 FHBDRN CN(Cc1ccc(Cl)c(Cl)c1)c1ccc2ncc([N+](=O)[O-])n2n1 ZINC000115489723 938934153 /nfs/dbraw/zinc/93/41/53/938934153.db2.gz MRIDXZSGFKNRPW-UHFFFAOYSA-N 0 0 352.181 3.581 20 5 FHBDRN COc1cc(C)c([C@H](C)NC(=O)Nc2ccc([N+](=O)[O-])cc2)cc1OC ZINC000128223728 938934516 /nfs/dbraw/zinc/93/45/16/938934516.db2.gz DFVFIGYLLRQCPN-LBPRGKRZSA-N 0 0 359.382 3.803 20 5 FHBDRN CCOc1c(CNCc2cccc([N+](=O)[O-])c2C)c(C)nn1CC(C)C ZINC000480446437 938941184 /nfs/dbraw/zinc/94/11/84/938941184.db2.gz RWTPGCUEVXLPKI-UHFFFAOYSA-N 0 0 360.458 3.753 20 5 FHBDRN COc1ccc([C@H](Nc2c([N+](=O)[O-])ncn2C)c2ccc(C)cc2)cc1 ZINC000140067601 938944720 /nfs/dbraw/zinc/94/47/20/938944720.db2.gz XJZANHLAGIQLHO-QGZVFWFLSA-N 0 0 352.394 3.847 20 5 FHBDRN CC(C)OCc1cccc(N[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)c1 ZINC000141438545 938947077 /nfs/dbraw/zinc/94/70/77/938947077.db2.gz ADDINNKLRANAKH-AWEZNQCLSA-N 0 0 357.410 3.959 20 5 FHBDRN COc1c(O)cccc1CNCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000278776053 938965925 /nfs/dbraw/zinc/96/59/25/938965925.db2.gz UURVPSTUTRRKML-UHFFFAOYSA-N 0 0 356.300 3.618 20 5 FHBDRN Cc1cc(C(=O)NCc2ccc(OC(F)F)c(F)c2)cc([N+](=O)[O-])c1 ZINC000511266255 938971116 /nfs/dbraw/zinc/97/11/16/938971116.db2.gz OJBJTIVCEWQMDL-UHFFFAOYSA-N 0 0 354.284 3.574 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1ncc(-c2ccccc2)s1 ZINC000427244041 945219207 /nfs/dbraw/zinc/21/92/07/945219207.db2.gz UHIHOMDHOCSUHH-UHFFFAOYSA-N 0 0 355.375 3.979 20 5 FHBDRN COc1cc(Oc2nc(-c3ccncc3)nc3c2CCC3)ccc1[N+](=O)[O-] ZINC000480550642 938971577 /nfs/dbraw/zinc/97/15/77/938971577.db2.gz FWQQKMBURLGZIL-UHFFFAOYSA-N 0 0 364.361 3.736 20 5 FHBDRN O=C(CSc1ncccc1[N+](=O)[O-])c1cccc(Br)c1 ZINC000065693274 938972390 /nfs/dbraw/zinc/97/23/90/938972390.db2.gz SSUQCGWBNWGPPQ-UHFFFAOYSA-N 0 0 353.197 3.727 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(N2CCC[C@H](c3ncc4n3CCCC4)C2)c1 ZINC000409637617 938978758 /nfs/dbraw/zinc/97/87/58/938978758.db2.gz YTQJJAIPIUDDIT-AWEZNQCLSA-N 0 0 356.426 3.520 20 5 FHBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CC[C@H]2c2ccc(Cl)cc2)c(F)c1 ZINC000511292132 938990751 /nfs/dbraw/zinc/99/07/51/938990751.db2.gz VXESCTAZJQSXRU-AWEZNQCLSA-N 0 0 370.789 3.523 20 5 FHBDRN Cn1cccc1[C@H]1CCCCN1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000472333121 938990857 /nfs/dbraw/zinc/99/08/57/938990857.db2.gz BADPQSYCHIVUCO-QGZVFWFLSA-N 0 0 367.409 3.711 20 5 FHBDRN CCCC[C@@H](Sc1cc(C(F)(F)F)ncc1[N+](=O)[O-])C(=O)OC ZINC000480557914 938991804 /nfs/dbraw/zinc/99/18/04/938991804.db2.gz AMTAZVQHIDPWTI-SECBINFHSA-N 0 0 352.334 3.833 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)c1cc(Cl)cc(Br)c1 ZINC000227766014 938992340 /nfs/dbraw/zinc/99/23/40/938992340.db2.gz IDMMCRTWDOBVMB-UHFFFAOYSA-N 0 0 369.602 3.941 20 5 FHBDRN Cc1cccc(C(=O)Nc2cccc(C(=O)NC(C)(C)C)c2)c1[N+](=O)[O-] ZINC000046604318 938994291 /nfs/dbraw/zinc/99/42/91/938994291.db2.gz JYXKATNLHYSVTJ-UHFFFAOYSA-N 0 0 355.394 3.684 20 5 FHBDRN Cc1sc(C(=O)Nc2cccc(C(=O)NC(C)(C)C)c2)cc1[N+](=O)[O-] ZINC000046604284 938994332 /nfs/dbraw/zinc/99/43/32/938994332.db2.gz HOMFKNFDHQHMRB-UHFFFAOYSA-N 0 0 361.423 3.745 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2noc(C[C@H]3CCC[C@@H](C(F)(F)F)O3)n2)c1 ZINC000923774421 938994492 /nfs/dbraw/zinc/99/44/92/938994492.db2.gz XLBNUGOGCMQGLD-NEPJUHHUSA-N 0 0 357.288 3.687 20 5 FHBDRN Cc1cc(NCCOCC(F)(F)F)c(Br)cc1[N+](=O)[O-] ZINC000235775874 938995694 /nfs/dbraw/zinc/99/56/94/938995694.db2.gz MNAAXQTWEIZXRQ-UHFFFAOYSA-N 0 0 357.126 3.657 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)Nc1cccc(Oc2ccccc2)c1 ZINC000065712565 938997024 /nfs/dbraw/zinc/99/70/24/938997024.db2.gz OYKLQEIMGPGXON-UHFFFAOYSA-N 0 0 352.350 3.531 20 5 FHBDRN CN(Cc1ccccc1Cl)C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000065716371 938997035 /nfs/dbraw/zinc/99/70/35/938997035.db2.gz RVXRXSUUXPHYMI-UHFFFAOYSA-N 0 0 357.797 3.862 20 5 FHBDRN C[C@@H](NC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21)c1ccc(F)cc1F ZINC000065717503 939007128 /nfs/dbraw/zinc/00/71/28/939007128.db2.gz NLIVRSQYDRAEAZ-LLVKDONJSA-N 0 0 359.332 3.705 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)N(Cc1cccc(F)c1)C1CC1 ZINC000065724596 939007156 /nfs/dbraw/zinc/00/71/56/939007156.db2.gz QNMZKIHPIRXQDG-UHFFFAOYSA-N 0 0 367.380 3.880 20 5 FHBDRN CCc1ccc([C@@H]2COCCN2C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)o1 ZINC000131783177 939009380 /nfs/dbraw/zinc/00/93/80/939009380.db2.gz TWZIOKRKZIZFJN-GUYCJALGSA-N 0 0 373.409 3.594 20 5 FHBDRN Cc1ncc([N+](=O)[O-])n1CC(=O)Nc1cc(F)ccc1Oc1ccccc1 ZINC001125777209 939012246 /nfs/dbraw/zinc/01/22/46/939012246.db2.gz NGCNGUDRSRAMGW-UHFFFAOYSA-N 0 0 370.340 3.670 20 5 FHBDRN C[C@H](C[C@H](C)O)NC(=O)c1cc([N+](=O)[O-])ccc1SC1CCCC1 ZINC000611985001 939013487 /nfs/dbraw/zinc/01/34/87/939013487.db2.gz VYJWGRCWSBKAQO-NEPJUHHUSA-N 0 0 352.456 3.519 20 5 FHBDRN CC(C)[C@@H](NC(=O)c1cc([N+](=O)[O-])cc2c1OCCO2)c1ccc(F)cc1 ZINC000548855115 939015170 /nfs/dbraw/zinc/01/51/70/939015170.db2.gz FPOVZAIWYVUIHI-QGZVFWFLSA-N 0 0 374.368 3.632 20 5 FHBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)NC1CCC(CO)CC1 ZINC000611989872 939016320 /nfs/dbraw/zinc/01/63/20/939016320.db2.gz JNBRUZPVRLXDES-UHFFFAOYSA-N 0 0 366.483 3.768 20 5 FHBDRN COc1cc(OC)c(OC)cc1CNCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000892419791 939016468 /nfs/dbraw/zinc/01/64/68/939016468.db2.gz IZTHEYXVKZQSOK-UHFFFAOYSA-N 0 0 366.801 3.564 20 5 FHBDRN CSc1cccc(C(=O)Nc2cccc(-c3cc[nH]n3)c2)c1[N+](=O)[O-] ZINC000188043190 939016952 /nfs/dbraw/zinc/01/69/52/939016952.db2.gz BDGONYLSEABYKT-UHFFFAOYSA-N 0 0 354.391 3.959 20 5 FHBDRN O=C(c1cc2c(cc1[N+](=O)[O-])OCO2)N(Cc1ccco1)c1ccccc1 ZINC000611994283 939017404 /nfs/dbraw/zinc/01/74/04/939017404.db2.gz MHGFZVTZMQYYOW-UHFFFAOYSA-N 0 0 366.329 3.764 20 5 FHBDRN CS(=O)(=O)c1cc(S[C@@H]2CCc3ccc(F)cc32)ccc1[N+](=O)[O-] ZINC000179258611 939017746 /nfs/dbraw/zinc/01/77/46/939017746.db2.gz BOUMCIGTDDADRN-OAHLLOKOSA-N 0 0 367.423 3.917 20 5 FHBDRN Cc1cc(C)cc(N(C)C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)c1 ZINC000179257889 939017770 /nfs/dbraw/zinc/01/77/70/939017770.db2.gz YPGWMQDPZGXNGZ-UHFFFAOYSA-N 0 0 350.378 3.674 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)NC1(c2ccc(F)cc2)CCC1 ZINC000065744779 939021637 /nfs/dbraw/zinc/02/16/37/939021637.db2.gz DEFQMDLYXNPWIN-UHFFFAOYSA-N 0 0 367.380 3.884 20 5 FHBDRN CCN(C(=O)c1cc(F)cc([N+](=O)[O-])c1)c1ccc(Br)cn1 ZINC000609443846 939032405 /nfs/dbraw/zinc/03/24/05/939032405.db2.gz ZIOUANUKGPSLFL-UHFFFAOYSA-N 0 0 368.162 3.558 20 5 FHBDRN CC1(NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)CCC(F)(F)CC1 ZINC000612064774 939033841 /nfs/dbraw/zinc/03/38/41/939033841.db2.gz UHZTVEMFPQCQHX-UHFFFAOYSA-N 0 0 364.295 3.894 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C(=O)OCc2nc(-c3ccccc3)no2)cc1Cl ZINC001125781510 939035637 /nfs/dbraw/zinc/03/56/37/939035637.db2.gz XDYPGRPWUNOPST-UHFFFAOYSA-N 0 0 373.752 3.964 20 5 FHBDRN Cc1ccc(Br)cc1CNC(=O)Cc1ccccc1[N+](=O)[O-] ZINC000188217902 939057063 /nfs/dbraw/zinc/05/70/63/939057063.db2.gz CHSMQAUIWWUEMJ-UHFFFAOYSA-N 0 0 363.211 3.525 20 5 FHBDRN COc1ccc(CCCC(=O)N2CCc3c2cccc3[N+](=O)[O-])c(OC)c1 ZINC000179281449 939061376 /nfs/dbraw/zinc/06/13/76/939061376.db2.gz FSJFFFJKLRFNJZ-UHFFFAOYSA-N 0 0 370.405 3.524 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NCCCOc1ccccc1 ZINC000179284302 939068390 /nfs/dbraw/zinc/06/83/90/939068390.db2.gz BOXWZWZJEHHPRS-UHFFFAOYSA-N 0 0 360.435 3.906 20 5 FHBDRN C[C@H]1c2ccccc2CCN1C(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000179301393 939070627 /nfs/dbraw/zinc/07/06/27/939070627.db2.gz XOIAXVVVEWGNKZ-AWEZNQCLSA-N 0 0 362.389 3.540 20 5 FHBDRN O=[N+]([O-])c1cnc(N[C@H]2COc3cc(F)cc(F)c32)c(Br)c1 ZINC000612113732 939071667 /nfs/dbraw/zinc/07/16/67/939071667.db2.gz JPKBEKDQCFGZFT-JTQLQIEISA-N 0 0 372.125 3.576 20 5 FHBDRN C[C@@H](CNC(=O)Nc1cccc([N+](=O)[O-])c1)c1nc(-c2ccccc2)no1 ZINC000179293337 939077490 /nfs/dbraw/zinc/07/74/90/939077490.db2.gz JSVRPJBGJUFRRQ-LBPRGKRZSA-N 0 0 367.365 3.570 20 5 FHBDRN C[C@H](NC(=O)c1cn(C)nc1-c1cccs1)c1cccc([N+](=O)[O-])c1 ZINC000179313836 939079424 /nfs/dbraw/zinc/07/94/24/939079424.db2.gz QDJVCYRHZTXRNJ-NSHDSACASA-N 0 0 356.407 3.548 20 5 FHBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)N(Cc1ccc(O)cc1)CC1CC1 ZINC000255676036 939082938 /nfs/dbraw/zinc/08/29/38/939082938.db2.gz FLISXUHWZIQTDD-GHXNOFRVSA-N 0 0 352.390 3.752 20 5 FHBDRN O=C(NCCc1ccc(F)cc1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000179326786 939085804 /nfs/dbraw/zinc/08/58/04/939085804.db2.gz IRIFZOGBJPNZQR-UHFFFAOYSA-N 0 0 357.385 3.651 20 5 FHBDRN O=C(c1c[nH]c(=O)c([N+](=O)[O-])c1)N1CCC[C@H]1c1cccc2ccccc21 ZINC000188277389 939127779 /nfs/dbraw/zinc/12/77/79/939127779.db2.gz UFZIGQLAFVKSIH-KRWDZBQOSA-N 0 0 363.373 3.826 20 5 FHBDRN C[C@H](c1ccc(F)cc1)N(C)C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000179384246 939139563 /nfs/dbraw/zinc/13/95/63/939139563.db2.gz HOYWQHVNUVARSK-GFCCVEGCSA-N 0 0 355.369 3.977 20 5 FHBDRN C[C@H]1C[C@H](c2cccnc2)N(C(=O)CCc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000935370087 939142096 /nfs/dbraw/zinc/14/20/96/939142096.db2.gz DXRNMXYVDQTKQL-SCLBCKFNSA-N 0 0 357.385 3.671 20 5 FHBDRN O=[N+]([O-])c1ccc(OS(=O)(=O)c2cccc(C(F)(F)F)c2)cc1F ZINC000065795112 939152877 /nfs/dbraw/zinc/15/28/77/939152877.db2.gz ANOCDCAZQYHBII-UHFFFAOYSA-N 0 0 365.260 3.520 20 5 FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)NCCC1CCCC1 ZINC000179438517 939159483 /nfs/dbraw/zinc/15/94/83/939159483.db2.gz PVYACCTUJZBZLX-UHFFFAOYSA-N 0 0 352.456 3.643 20 5 FHBDRN Cc1cc2c(cc1C)[C@H](C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-])CO2 ZINC000472377590 939182677 /nfs/dbraw/zinc/18/26/77/939182677.db2.gz WTEBNLUCCGJMLA-MRXNPFEDSA-N 0 0 374.824 3.700 20 5 FHBDRN Cc1ccc(-c2cncc(F)c2)cc1NC(=O)c1cc([N+](=O)[O-])cn1C ZINC000548897525 939211858 /nfs/dbraw/zinc/21/18/58/939211858.db2.gz LCANBGGIOQBFLX-UHFFFAOYSA-N 0 0 354.341 3.695 20 5 FHBDRN COc1ccccc1CCNC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000120105796 939219481 /nfs/dbraw/zinc/21/94/81/939219481.db2.gz LTGQOBQSLVOFKF-UHFFFAOYSA-N 0 0 369.421 3.520 20 5 FHBDRN Cc1cccc(NC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)c1C ZINC000110154810 939223431 /nfs/dbraw/zinc/22/34/31/939223431.db2.gz FXBPGPONIBBSBJ-AWEZNQCLSA-N 0 0 373.434 3.516 20 5 FHBDRN O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)N1CCCc2ccc(F)cc21 ZINC000563996553 939224186 /nfs/dbraw/zinc/22/41/86/939224186.db2.gz QVOVHSFKLQBDNU-UHFFFAOYSA-N 0 0 350.296 3.534 20 5 FHBDRN O=[N+]([O-])c1cccc(CSc2nc3cc(Br)cnc3[nH]2)c1 ZINC000206511048 939227395 /nfs/dbraw/zinc/22/73/95/939227395.db2.gz QVJQJOSBJKDGJJ-UHFFFAOYSA-N 0 0 365.212 3.921 20 5 FHBDRN CCCc1cc(C(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)sc1C ZINC000018077294 945252298 /nfs/dbraw/zinc/25/22/98/945252298.db2.gz UFUYJNVKKANPFM-UHFFFAOYSA-N 0 0 373.478 3.880 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N(CC1CCC1)c1ccccc1 ZINC000437334878 945257074 /nfs/dbraw/zinc/25/70/74/945257074.db2.gz SWRWQWNZHKTPBH-UHFFFAOYSA-N 0 0 360.435 3.899 20 5 FHBDRN O=C(N[C@@H]1C[C@H]1c1c(F)cccc1F)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000437335968 945258013 /nfs/dbraw/zinc/25/80/13/945258013.db2.gz WZFGVXYBJIDVER-YMTOWFKASA-N 0 0 357.316 3.640 20 5 FHBDRN O=C(N[C@@H]1C[C@H]1c1ccc(Br)cc1)c1ccc([N+](=O)[O-])s1 ZINC000437337001 945258856 /nfs/dbraw/zinc/25/88/56/945258856.db2.gz MHBFBPSDRQERCZ-WDEREUQCSA-N 0 0 367.224 3.705 20 5 FHBDRN Cc1cccc2[nH]c(CNC(=O)c3c(C)cc(Cl)cc3[N+](=O)[O-])nc21 ZINC000438954339 945260881 /nfs/dbraw/zinc/26/08/81/945260881.db2.gz JFWMXUSNWCLFOR-UHFFFAOYSA-N 0 0 358.785 3.671 20 5 FHBDRN CCCN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2OC)c2cc(F)ccc21 ZINC000427316851 945268573 /nfs/dbraw/zinc/26/85/73/945268573.db2.gz ZAWOTVSZQSVWOK-UHFFFAOYSA-N 0 0 373.384 3.619 20 5 FHBDRN C/C=C/c1ccc(OCC(=O)Nc2ccc(C)c([N+](=O)[O-])c2)c(OC)c1 ZINC000015409024 945272802 /nfs/dbraw/zinc/27/28/02/945272802.db2.gz UETSIUBTCAQWIR-SNAWJCMRSA-N 0 0 356.378 3.962 20 5 FHBDRN O=[N+]([O-])c1ccc(CN(Cc2ccc(Br)cn2)C2CC2)cc1 ZINC000179521648 939877186 /nfs/dbraw/zinc/87/71/86/939877186.db2.gz BLBMSLCNELPIDE-UHFFFAOYSA-N 0 0 362.227 3.917 20 5 FHBDRN CSc1ccc(C(=O)N[C@H](c2cnn(C)c2)C(C)(C)C)cc1[N+](=O)[O-] ZINC000473579696 945278703 /nfs/dbraw/zinc/27/87/03/945278703.db2.gz YLQSWZULOUHWBK-OAHLLOKOSA-N 0 0 362.455 3.567 20 5 FHBDRN COc1cccc(CC2CCN(C(=O)c3csc([N+](=O)[O-])c3)CC2)c1 ZINC000612214792 939886415 /nfs/dbraw/zinc/88/64/15/939886415.db2.gz BIIBYSZAKVHUTE-UHFFFAOYSA-N 0 0 360.435 3.760 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(C)[C@H](C)c1c(F)cccc1F ZINC000516834246 945279398 /nfs/dbraw/zinc/27/93/98/945279398.db2.gz MGGOUJXFLAVWFK-LLVKDONJSA-N 0 0 370.377 3.563 20 5 FHBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])Nc1cc(F)ccc1O ZINC000179651387 939908672 /nfs/dbraw/zinc/90/86/72/939908672.db2.gz BYSHOWYTTPALNY-UHFFFAOYSA-N 0 0 354.721 3.501 20 5 FHBDRN O=C(c1ccc(NC2CC2)c([N+](=O)[O-])c1)N1CC[C@@H](c2ccccc2F)C1 ZINC000410283960 939909888 /nfs/dbraw/zinc/90/98/88/939909888.db2.gz HWLKBLDKSGBDGS-CQSZACIVSA-N 0 0 369.396 3.938 20 5 FHBDRN O=C(NC1(c2ccc(Br)cc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000511331062 939914610 /nfs/dbraw/zinc/91/46/10/939914610.db2.gz BZMVBYHXANIMGG-UHFFFAOYSA-N 0 0 361.195 3.776 20 5 FHBDRN COc1ccccc1-c1noc([C@@H](C)NCc2cccc([N+](=O)[O-])c2)n1 ZINC000364301559 939921612 /nfs/dbraw/zinc/92/16/12/939921612.db2.gz NAWJQDIJAYLGNI-GFCCVEGCSA-N 0 0 354.366 3.504 20 5 FHBDRN COc1ccc(NC(=O)c2sccc2Br)cc1[N+](=O)[O-] ZINC000136330724 939922487 /nfs/dbraw/zinc/92/24/87/939922487.db2.gz PRPMSAITNNRZQJ-UHFFFAOYSA-N 0 0 357.185 3.680 20 5 FHBDRN O=C(NCC1(CCO)CC1)c1cc([N+](=O)[O-])ccc1SC1CCCC1 ZINC000614676171 939924143 /nfs/dbraw/zinc/92/41/43/939924143.db2.gz NHTWXEHAAIXUSQ-UHFFFAOYSA-N 0 0 364.467 3.522 20 5 FHBDRN Cn1cccc1[C@@H]1CCCN1Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000179710204 939924714 /nfs/dbraw/zinc/92/47/14/939924714.db2.gz RNIIJSXBRLGBMA-HNNXBMFYSA-N 0 0 351.353 3.872 20 5 FHBDRN Cc1nnc([C@H](C)OC(=O)c2cc([N+](=O)[O-])ccc2SC(C)C)o1 ZINC000179749975 939931097 /nfs/dbraw/zinc/93/10/97/939931097.db2.gz ONPQWEHSAHFKTA-VIFPVBQESA-N 0 0 351.384 3.705 20 5 FHBDRN CCc1ccc(C(=O)N[C@@H]2C[C@H]2c2cc(F)c(F)c(F)c2)cc1[N+](=O)[O-] ZINC000437357140 945283704 /nfs/dbraw/zinc/28/37/04/945283704.db2.gz FZLNXITZWHJQNL-SWLSCSKDSA-N 0 0 364.323 3.860 20 5 FHBDRN CC(C)c1ccc(C(=O)Nc2ccc(N3CCCC3)nc2)cc1[N+](=O)[O-] ZINC000438959405 945283996 /nfs/dbraw/zinc/28/39/96/945283996.db2.gz LZQSWMIDNOALFF-UHFFFAOYSA-N 0 0 354.410 3.966 20 5 FHBDRN COCCN(C(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-])[C@H]1CC[C@H](C)C1 ZINC000410757955 939953474 /nfs/dbraw/zinc/95/34/74/939953474.db2.gz APSASMNTQDPFKS-AAEUAGOBSA-N 0 0 374.359 3.891 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1C[C@H]1c1cccc(OC)c1 ZINC000410817416 939961604 /nfs/dbraw/zinc/96/16/04/939961604.db2.gz JAEQLDVVDNTAGN-JKSUJKDBSA-N 0 0 356.378 3.744 20 5 FHBDRN Cc1nc2ccccc2n1CCCNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000136418945 939962030 /nfs/dbraw/zinc/96/20/30/939962030.db2.gz VKCDNANAOHYCEQ-UHFFFAOYSA-N 0 0 372.812 3.726 20 5 FHBDRN COc1cc(N2CCC(OC(=O)C3=CCCCC3)CC2)ccc1[N+](=O)[O-] ZINC000124420148 945285525 /nfs/dbraw/zinc/28/55/25/945285525.db2.gz AGVTZBCOGHDHHE-UHFFFAOYSA-N 0 0 360.410 3.616 20 5 FHBDRN COc1cc(C(=O)Nc2ccc3[nH]c(C(F)F)nc3c2)ccc1[N+](=O)[O-] ZINC000179830552 939967294 /nfs/dbraw/zinc/96/72/94/939967294.db2.gz VXLQNMXTVADHEX-UHFFFAOYSA-N 0 0 362.292 3.670 20 5 FHBDRN CC1=C(C(=O)N[C@H](CC(=O)OC(C)C)c2ccccc2[N+](=O)[O-])CCC1 ZINC000437364313 945290748 /nfs/dbraw/zinc/29/07/48/945290748.db2.gz JVRVSWRALAODKN-MRXNPFEDSA-N 0 0 360.410 3.594 20 5 FHBDRN Cc1nn(CCC(=O)N2c3ccccc3CCC2(C)C)c(C)c1[N+](=O)[O-] ZINC000410995524 939982528 /nfs/dbraw/zinc/98/25/28/939982528.db2.gz HFONIMJQYSMRAS-UHFFFAOYSA-N 0 0 356.426 3.556 20 5 FHBDRN CCNc1ccc(C(=O)N[C@H](c2nccs2)C(F)(F)F)cc1[N+](=O)[O-] ZINC000410976436 939983858 /nfs/dbraw/zinc/98/38/58/939983858.db2.gz ZOOTXAXSIRIHQS-LLVKDONJSA-N 0 0 374.344 3.517 20 5 FHBDRN Cc1nc2c(s1)CCC[C@@H]2CN(C)C(=O)c1cccc([N+](=O)[O-])c1C ZINC000364699108 939985413 /nfs/dbraw/zinc/98/54/13/939985413.db2.gz SBVRFUSKNPCORL-CYBMUJFWSA-N 0 0 359.451 3.860 20 5 FHBDRN CCOc1ncc(C)cc1NC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC000411012731 939985951 /nfs/dbraw/zinc/98/59/51/939985951.db2.gz HNMXEQALYKGJIO-UHFFFAOYSA-N 0 0 369.299 3.968 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)NCCc2cc3ccccc3[nH]2)cc1[N+](=O)[O-] ZINC000136474716 939991167 /nfs/dbraw/zinc/99/11/67/939991167.db2.gz CSBPOPMQZMIDNQ-CQSZACIVSA-N 0 0 366.421 3.987 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1OCc1nnc(-c2cccc(Cl)c2)o1 ZINC000106435926 945287767 /nfs/dbraw/zinc/28/77/67/945287767.db2.gz FGGDBNAARKJFSX-UHFFFAOYSA-N 0 0 361.741 3.886 20 5 FHBDRN C[C@@H](NC(=O)Nc1ccccc1-n1cccn1)c1cccc([N+](=O)[O-])c1 ZINC000047539234 945287954 /nfs/dbraw/zinc/28/79/54/945287954.db2.gz CQFDPSFKHMBAHA-CYBMUJFWSA-N 0 0 351.366 3.663 20 5 FHBDRN O=C(NC1(C2CCC2)CCC1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000411108835 939998620 /nfs/dbraw/zinc/99/86/20/939998620.db2.gz FJXOUJKQBCIVOA-UHFFFAOYSA-N 0 0 372.343 3.989 20 5 FHBDRN Cc1c(C(=O)N[C@@H](C)[C@H](C)c2ccccc2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000177183542 940002351 /nfs/dbraw/zinc/00/23/51/940002351.db2.gz AMTLEXVADSLOPT-AAEUAGOBSA-N 0 0 357.366 3.733 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)C(=O)N[C@@H](c1ccccc1)C(C)C ZINC000411142743 940003226 /nfs/dbraw/zinc/00/32/26/940003226.db2.gz XHQQMOQZTRZTNE-GOSISDBHSA-N 0 0 369.421 3.664 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])NCc1ccccc1OC1CCCC1 ZINC000065872609 940004371 /nfs/dbraw/zinc/00/43/71/940004371.db2.gz ZQEGJEPHLYAJIG-UHFFFAOYSA-N 0 0 369.421 3.645 20 5 FHBDRN COc1cccc(CN(C)C(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)c1 ZINC000411160791 940004691 /nfs/dbraw/zinc/00/46/91/940004691.db2.gz JGDRMLVWSHWDQO-UHFFFAOYSA-N 0 0 358.394 3.663 20 5 FHBDRN O=C(N[C@@H]1C[C@H]1c1cc(F)c(F)c(F)c1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000437365605 945290738 /nfs/dbraw/zinc/29/07/38/945290738.db2.gz SUPKORLTHAPXOO-SMDDNHRTSA-N 0 0 370.714 3.951 20 5 FHBDRN CCn1c2ccccc2nc1NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000411240152 940016804 /nfs/dbraw/zinc/01/68/04/940016804.db2.gz SGIOCDQYQQUYFK-LSDHHAIUSA-N 0 0 350.378 3.707 20 5 FHBDRN CC(=O)Nc1cccc(NC(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)c1C 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JTRZSNXOUWVINI-UHFFFAOYSA-N 0 0 367.405 3.620 20 5 FHBDRN Cc1sc(CNC(=O)c2c(N)cccc2[N+](=O)[O-])nc1-c1ccccc1 ZINC000365020779 940040205 /nfs/dbraw/zinc/04/02/05/940040205.db2.gz YKNSVWUWFHFDFE-UHFFFAOYSA-N 0 0 368.418 3.539 20 5 FHBDRN C[C@H](NC(=O)CSc1ccc([N+](=O)[O-])cn1)c1ccccc1Cl ZINC000159718094 940042701 /nfs/dbraw/zinc/04/27/01/940042701.db2.gz LYIWQSFFBXKRQT-JTQLQIEISA-N 0 0 351.815 3.613 20 5 FHBDRN CCC(=O)Nc1ccc(C)c(NC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)c1 ZINC000411430173 940045171 /nfs/dbraw/zinc/04/51/71/940045171.db2.gz SMFMKFNMYWMFNI-DLBZAZTESA-N 0 0 367.405 3.994 20 5 FHBDRN Cc1cc(NC(=O)C(=O)N(C)C2CCC(C(C)C)CC2)ccc1[N+](=O)[O-] ZINC000411465040 940051046 /nfs/dbraw/zinc/05/10/46/940051046.db2.gz NNTGBSMUJKIFEP-UHFFFAOYSA-N 0 0 361.442 3.515 20 5 FHBDRN CCc1cccc2c(CCNC(=O)c3cc(OC)ccc3[N+](=O)[O-])c[nH]c21 ZINC000111046208 945292609 /nfs/dbraw/zinc/29/26/09/945292609.db2.gz MPKSOQKFOWDZMZ-UHFFFAOYSA-N 0 0 367.405 3.620 20 5 FHBDRN 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O=[N+]([O-])c1cccc([C@@H]([NH2+]CCCOC[C@@H]2CCCO2)c2ccccc2)c1 ZINC000180022228 940250179 /nfs/dbraw/zinc/25/01/79/940250179.db2.gz QTOJHNMSDJAKQO-SFTDATJTSA-N 0 0 370.449 3.860 20 5 FHBDRN Cc1nn(C)c(C(=O)N2CCCCC[C@@H]2/C=C/c2ccccc2)c1[N+](=O)[O-] ZINC000177536272 940257310 /nfs/dbraw/zinc/25/73/10/940257310.db2.gz QRKWRSNFCDMQEI-GZKZCVOOSA-N 0 0 368.437 3.735 20 5 FHBDRN CCOc1cc(OCC(=O)N[C@H](c2ccccc2)C2CC2)ccc1[N+](=O)[O-] ZINC000188602452 940288304 /nfs/dbraw/zinc/28/83/04/940288304.db2.gz RHXJDCZIHSMSML-HXUWFJFHSA-N 0 0 370.405 3.640 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1OCC(=O)Nc1cc(Cl)ccc1C ZINC000506781447 945312473 /nfs/dbraw/zinc/31/24/73/945312473.db2.gz LKULSGDFKTYVGZ-UHFFFAOYSA-N 0 0 350.758 3.583 20 5 FHBDRN COc1ccc2c(ccn2Cc2nc(Cc3ccccc3[N+](=O)[O-])no2)c1 ZINC000612865529 940319103 /nfs/dbraw/zinc/31/91/03/940319103.db2.gz DVKVWRLYVDURMA-UHFFFAOYSA-N 0 0 364.361 3.580 20 5 FHBDRN COc1ccc(COCCc2nc(-c3ccc(C)c([N+](=O)[O-])c3)no2)cc1 ZINC000612895066 940327590 /nfs/dbraw/zinc/32/75/90/940327590.db2.gz RDMIPAFREVEWGZ-UHFFFAOYSA-N 0 0 369.377 3.721 20 5 FHBDRN COC(=O)c1cc(NC(=O)c2coc(C3CCCC3)n2)c(C)c([N+](=O)[O-])c1 ZINC000511392463 940331943 /nfs/dbraw/zinc/33/19/43/940331943.db2.gz VHEDZXWYVHQAIA-UHFFFAOYSA-N 0 0 373.365 3.588 20 5 FHBDRN COc1ccc2c(c1)OC[C@@H](c1nc(-c3ccc(C)c([N+](=O)[O-])c3)no1)C2 ZINC000612895597 940331985 /nfs/dbraw/zinc/33/19/85/940331985.db2.gz VTLKNQPGWMBXHB-AWEZNQCLSA-N 0 0 367.361 3.681 20 5 FHBDRN CCCCO[C@H]1C[C@H](NC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])C1(C)C ZINC000177642780 940332309 /nfs/dbraw/zinc/33/23/09/940332309.db2.gz YDRPBSSKPJVSDB-GJZGRUSLSA-N 0 0 356.369 3.587 20 5 FHBDRN COC(=O)[C@@H](CC(C)(C)C)OC(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000782663449 940334529 /nfs/dbraw/zinc/33/45/29/940334529.db2.gz HYQXUQCRQDTFKD-SMDDNHRTSA-N 0 0 369.439 3.596 20 5 FHBDRN COCc1ccc(-c2noc(-c3c[nH]c4cc([N+](=O)[O-])ccc43)n2)cc1 ZINC000612902430 940335833 /nfs/dbraw/zinc/33/58/33/940335833.db2.gz MRJFXOJCOMOOHU-UHFFFAOYSA-N 0 0 350.334 3.940 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)Nc1ccc2oc(C(C)(C)C)nc2c1 ZINC000046653934 940336863 /nfs/dbraw/zinc/33/68/63/940336863.db2.gz JAMILYRFJQWNLV-UHFFFAOYSA-N 0 0 354.366 3.989 20 5 FHBDRN C[C@@H]1CCCC[C@H]1NC(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000086971287 945315992 /nfs/dbraw/zinc/31/59/92/945315992.db2.gz KQHHDKFNVBXUOJ-QMTHXVAHSA-N 0 0 355.232 3.595 20 5 FHBDRN Cc1nc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)ccc1[N+](=O)[O-] ZINC000177668527 940348727 /nfs/dbraw/zinc/34/87/27/940348727.db2.gz SBSLRQGEEQBTOM-UHFFFAOYSA-N 0 0 358.335 3.673 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]nc(-c3nc([C@@H]4CCc5ccccc5C4)no3)c2c1 ZINC000612952189 940356923 /nfs/dbraw/zinc/35/69/23/940356923.db2.gz XUIQPQNQXAHOBG-CYBMUJFWSA-N 0 0 361.361 3.794 20 5 FHBDRN Cc1nccc(NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)c1Cl ZINC000124669099 945317297 /nfs/dbraw/zinc/31/72/97/945317297.db2.gz CWSYKUAPOZKHEF-UHFFFAOYSA-N 0 0 370.590 3.966 20 5 FHBDRN COc1cccc(Cc2noc([C@@H](C)Sc3ccc([N+](=O)[O-])cc3)n2)n1 ZINC000612979818 940375169 /nfs/dbraw/zinc/37/51/69/940375169.db2.gz JVZMCZDJOBMEDZ-LLVKDONJSA-N 0 0 372.406 3.826 20 5 FHBDRN Cc1cc(=NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1[C@H](C)C1CC1 ZINC000544087873 940384030 /nfs/dbraw/zinc/38/40/30/940384030.db2.gz ASNMICBRNYCHRF-LLVKDONJSA-N 0 0 370.434 3.960 20 5 FHBDRN Cc1c(C(=O)Nc2ccc(F)cc2Cl)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000066279700 940391040 /nfs/dbraw/zinc/39/10/40/940391040.db2.gz NFAXUULSYIMRHD-UHFFFAOYSA-N 0 0 353.693 3.856 20 5 FHBDRN Cc1oc(NC(=O)c2cc([N+](=O)[O-])ccc2Br)nc1C1CC1 ZINC000892516075 940397108 /nfs/dbraw/zinc/39/71/08/940397108.db2.gz NOWJSVLOTCWRDI-UHFFFAOYSA-N 0 0 366.171 3.783 20 5 FHBDRN Cc1cc(C)c(NC(=O)c2ccc([N+](=O)[O-])cc2Br)cc1O ZINC000613031845 940400906 /nfs/dbraw/zinc/40/09/06/940400906.db2.gz PQLAMBPCBVYKPM-UHFFFAOYSA-N 0 0 365.183 3.932 20 5 FHBDRN CC(C)(CNC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-])OCC1CC1 ZINC000414014154 940405159 /nfs/dbraw/zinc/40/51/59/940405159.db2.gz XBZACVNAXIRLMO-UHFFFAOYSA-N 0 0 372.874 3.662 20 5 FHBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H](CO)[C@H]1C ZINC000414022162 940416510 /nfs/dbraw/zinc/41/65/10/940416510.db2.gz GEGCCFYFAIXITR-KGLIPLIRSA-N 0 0 366.483 3.576 20 5 FHBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)Nc1ccc(-c2ccccn2)cc1 ZINC000579901740 940420364 /nfs/dbraw/zinc/42/03/64/940420364.db2.gz GHRRPGRWNOYGSO-UHFFFAOYSA-N 0 0 369.402 3.766 20 5 FHBDRN CO[C@@H](CNC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)C1CC1 ZINC000511418319 940422003 /nfs/dbraw/zinc/42/20/03/940422003.db2.gz NQLSWBIVHBNQOK-SFHVURJKSA-N 0 0 356.378 3.542 20 5 FHBDRN O=[N+]([O-])c1cccc(F)c1N1CCC[C@H](n2ccc(C(F)(F)F)n2)C1 ZINC000579987082 940429196 /nfs/dbraw/zinc/42/91/96/940429196.db2.gz LLQSJSCLPKBMHJ-JTQLQIEISA-N 0 0 358.295 3.791 20 5 FHBDRN CC[C@@H](NC(=O)N1CCC(n2ccc([N+](=O)[O-])n2)CC1)c1ccc(C)cc1 ZINC000365507805 940429651 /nfs/dbraw/zinc/42/96/51/940429651.db2.gz JSTIECMDDJEQGL-QGZVFWFLSA-N 0 0 371.441 3.598 20 5 FHBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H](CO)[C@@H]1C ZINC000414032347 940430887 /nfs/dbraw/zinc/43/08/87/940430887.db2.gz KSMRLYFPAAHJDJ-KBPBESRZSA-N 0 0 366.483 3.720 20 5 FHBDRN Cc1ccc(-c2nc(-c3cccnc3OCC(F)F)no2)cc1[N+](=O)[O-] ZINC000580017673 940432225 /nfs/dbraw/zinc/43/22/25/940432225.db2.gz WEGHYGFBAYKANU-UHFFFAOYSA-N 0 0 362.292 3.659 20 5 FHBDRN Cc1oc(NC(=O)c2cccc([N+](=O)[O-])c2Br)nc1C1CC1 ZINC000892520340 940434013 /nfs/dbraw/zinc/43/40/13/940434013.db2.gz JAIFLPCZFVAIAW-UHFFFAOYSA-N 0 0 366.171 3.783 20 5 FHBDRN Cc1ccc(NC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)c(Br)n1 ZINC000255880882 940438005 /nfs/dbraw/zinc/43/80/05/940438005.db2.gz SFVBYYKOVDVWJZ-UITAMQMPSA-N 0 0 362.183 3.713 20 5 FHBDRN COc1ccc2[nH]cc(CC(=O)Oc3cc(Cl)ccc3[N+](=O)[O-])c2c1 ZINC000124803350 945320720 /nfs/dbraw/zinc/32/07/20/945320720.db2.gz VBAKYQNDQYVVEP-UHFFFAOYSA-N 0 0 360.753 3.886 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NCCc2ccc(SC)cc2)c1 ZINC000548995353 940463760 /nfs/dbraw/zinc/46/37/60/940463760.db2.gz XOHIARSEPCGPCR-UHFFFAOYSA-N 0 0 360.435 3.688 20 5 FHBDRN O=C(Nc1ncc(C(F)(F)F)s1)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000548996404 940465018 /nfs/dbraw/zinc/46/50/18/940465018.db2.gz IOFOROMJIDESFS-UHFFFAOYSA-N 0 0 372.328 3.660 20 5 FHBDRN Cc1c(C(=O)N2C[C@H](c3ccccc3)[C@H]3COCC[C@H]32)cccc1[N+](=O)[O-] ZINC000376206163 940467151 /nfs/dbraw/zinc/46/71/51/940467151.db2.gz GTTVWCUGHPTEST-QWFCFKBJSA-N 0 0 366.417 3.548 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1[C@H](C)Nc1ccc(C)c(N2CCNC2=O)c1 ZINC000580146345 940469023 /nfs/dbraw/zinc/46/90/23/940469023.db2.gz NUHFDIXQHCDATP-AWEZNQCLSA-N 0 0 354.410 3.914 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)c2csc(-c3ccccn3)n2)cc1[N+](=O)[O-] ZINC000177861563 940469381 /nfs/dbraw/zinc/46/93/81/940469381.db2.gz ATGYNLYWCJGFKW-GFCCVEGCSA-N 0 0 368.418 3.913 20 5 FHBDRN O=[N+]([O-])c1cccc2ncnc(N3CCC(OC4CCCCC4)CC3)c21 ZINC000580258924 940471072 /nfs/dbraw/zinc/47/10/72/940471072.db2.gz OPSGRPJUMYRPBM-UHFFFAOYSA-N 0 0 356.426 3.856 20 5 FHBDRN O=C(NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)N(CC1CC1)C1CCC1 ZINC000580266887 940471389 /nfs/dbraw/zinc/47/13/89/940471389.db2.gz GGHLWCFRGILURS-UHFFFAOYSA-N 0 0 356.426 3.593 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1CCC[C@H]1/C=C\c1ccccc1 ZINC000427395161 945323802 /nfs/dbraw/zinc/32/38/02/945323802.db2.gz NTVPURSCOPKLKW-YDZSZYSISA-N 0 0 352.390 3.921 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCc1cc(C)ccc1OC ZINC000613175686 940476106 /nfs/dbraw/zinc/47/61/06/940476106.db2.gz MRXAEDSMYGFMJX-INIZCTEOSA-N 0 0 356.422 3.797 20 5 FHBDRN O=C(NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)c1coc2cc(F)ccc12 ZINC000580495873 940477101 /nfs/dbraw/zinc/47/71/01/940477101.db2.gz PUTJRFWNZXAYBE-UHFFFAOYSA-N 0 0 367.336 3.934 20 5 FHBDRN C[C@H](CC(C)(C)c1ccccc1)Nc1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1 ZINC000580573305 940479457 /nfs/dbraw/zinc/47/94/57/940479457.db2.gz WDGFWXSIJCXJOB-CYBMUJFWSA-N 0 0 366.421 3.834 20 5 FHBDRN Cc1ncsc1/C=C\c1nc(Cc2c[nH]c3ccc([N+](=O)[O-])cc23)no1 ZINC000580601986 940482176 /nfs/dbraw/zinc/48/21/76/940482176.db2.gz YQIIVXFTICHVTM-PLNGDYQASA-N 0 0 367.390 3.985 20 5 FHBDRN CN(Cc1ccc(O)cc1)C(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC000580731083 940483127 /nfs/dbraw/zinc/48/31/27/940483127.db2.gz DBWZOPHGEFWVQN-UHFFFAOYSA-N 0 0 363.373 3.635 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CCO[C@H](c3ccccc3)C2)c1 ZINC000549005329 940484031 /nfs/dbraw/zinc/48/40/31/940484031.db2.gz BBMNPHHWNKJEGA-KXBFYZLASA-N 0 0 370.405 3.644 20 5 FHBDRN C[C@@H]1C[C@@H](c2ccccc2)CN1C(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000580766576 940485230 /nfs/dbraw/zinc/48/52/30/940485230.db2.gz LDRKEXRKOXIKTP-TZMCWYRMSA-N 0 0 360.360 3.820 20 5 FHBDRN CC(C)Oc1ccc(CCNC(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000580810996 940486185 /nfs/dbraw/zinc/48/61/85/940486185.db2.gz OIBVUMDCSXHIME-HNNXBMFYSA-N 0 0 356.422 3.844 20 5 FHBDRN Cc1c(CNC(=O)N2Cc3ccccc3OC(C)(C)C2)cccc1[N+](=O)[O-] ZINC000580915312 940488766 /nfs/dbraw/zinc/48/87/66/940488766.db2.gz SMMRVRZSDNLULZ-UHFFFAOYSA-N 0 0 369.421 3.786 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@@](C)(c3ccccc3)C2)c1 ZINC000549007315 940488986 /nfs/dbraw/zinc/48/89/86/940488986.db2.gz QIFXJMBGLRCLBT-HXUWFJFHSA-N 0 0 354.406 3.797 20 5 FHBDRN Cn1cnc([N+](=O)[O-])c1CN1CCCC[C@H]1c1nc(C(C)(C)C)cs1 ZINC000376226277 940490011 /nfs/dbraw/zinc/49/00/11/940490011.db2.gz NDZREUBOQDRCRQ-LBPRGKRZSA-N 0 0 363.487 3.810 20 5 FHBDRN CC(C)(C)c1ccc(NC(=O)C(=O)N[C@@H]2CC3CCC2CC3)cc1[N+](=O)[O-] ZINC000580883172 940490035 /nfs/dbraw/zinc/49/00/35/940490035.db2.gz FVTSKUUBTWBCBF-SEEARECTSA-N 0 0 373.453 3.526 20 5 FHBDRN C[C@@H](Cc1ccccc1F)NC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000431774381 940491140 /nfs/dbraw/zinc/49/11/40/940491140.db2.gz FDRXVMJKQNSKJO-ZDUSSCGKSA-N 0 0 359.401 3.899 20 5 FHBDRN O=C(NCc1ccn(C2CCCC2)n1)C1(c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000601347138 940492684 /nfs/dbraw/zinc/49/26/84/940492684.db2.gz CDKZIHIXYMLOST-UHFFFAOYSA-N 0 0 368.437 3.645 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC=C(c2ccccn2)C1 ZINC000581076298 940492851 /nfs/dbraw/zinc/49/28/51/940492851.db2.gz CWPWCNFNPVKOCP-KRWDZBQOSA-N 0 0 365.433 3.874 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)NCc1cnn(-c2ccccc2)c1 ZINC000581123872 940495716 /nfs/dbraw/zinc/49/57/16/940495716.db2.gz NVRXVWPZURDKKR-UHFFFAOYSA-N 0 0 365.393 3.665 20 5 FHBDRN COc1cc(F)c(F)cc1NC(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000581279809 940498322 /nfs/dbraw/zinc/49/83/22/940498322.db2.gz JXWJILPQNUKIQY-UHFFFAOYSA-N 0 0 365.336 3.588 20 5 FHBDRN O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)N[C@H](C1CCCC1)C(F)(F)F ZINC000581332996 940499555 /nfs/dbraw/zinc/49/95/55/940499555.db2.gz KSUCUDJWTAUMHR-CQSZACIVSA-N 0 0 366.286 3.653 20 5 FHBDRN Cc1c(OC(=O)c2cnn(-c3ccncc3)c2C(F)F)cccc1[N+](=O)[O-] ZINC000782698073 940500842 /nfs/dbraw/zinc/50/08/42/940500842.db2.gz VUQRRKQPTYQLHX-UHFFFAOYSA-N 0 0 374.303 3.641 20 5 FHBDRN O=[N+]([O-])c1ccc(OCCN2CCO[C@H](c3ccc(Cl)cc3)C2)cc1 ZINC000581442819 940503520 /nfs/dbraw/zinc/50/35/20/940503520.db2.gz XQZAUTGXNOWLLB-SFHVURJKSA-N 0 0 362.813 3.701 20 5 FHBDRN CO[C@@H]1C[C@H](c2ccccc2)CC[C@@H]1NC(=O)c1cc([N+](=O)[O-])ccc1C ZINC000581480585 940504534 /nfs/dbraw/zinc/50/45/34/940504534.db2.gz ZTQQTIUYJCBJBP-LSTHTHJFSA-N 0 0 368.433 3.984 20 5 FHBDRN CSc1ccc(NC(=O)CCc2c(Cl)cccc2[N+](=O)[O-])cn1 ZINC001125808807 940506241 /nfs/dbraw/zinc/50/62/41/940506241.db2.gz VFBFZOJVGFHMHN-UHFFFAOYSA-N 0 0 351.815 3.936 20 5 FHBDRN COC(=O)Nc1cc(NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)ccc1F ZINC000066489582 940507899 /nfs/dbraw/zinc/50/78/99/940507899.db2.gz CFHMTPADJMBDKM-UHFFFAOYSA-N 0 0 367.720 3.818 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)OCc1cc(-c2ccccc2)on1 ZINC000124766093 945327516 /nfs/dbraw/zinc/32/75/16/945327516.db2.gz PSQIXRJPSJKUNH-UHFFFAOYSA-N 0 0 352.346 3.926 20 5 FHBDRN CCN(C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1C)c1ccc(F)c(F)c1 ZINC000124764721 945327944 /nfs/dbraw/zinc/32/79/44/945327944.db2.gz ICOBKUHEXZKIAG-UHFFFAOYSA-N 0 0 365.292 3.756 20 5 FHBDRN O=C(Nc1cc(F)c(F)c(F)c1)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000124777247 945328442 /nfs/dbraw/zinc/32/84/42/945328442.db2.gz YHFFWRLQDQPQGB-UHFFFAOYSA-N 0 0 351.284 3.602 20 5 FHBDRN COc1ccccc1C[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1OC)C(C)C ZINC000427384009 945330800 /nfs/dbraw/zinc/33/08/00/945330800.db2.gz MACPQRIYJFNVDD-KRWDZBQOSA-N 0 0 372.421 3.609 20 5 FHBDRN COc1ccc(OCCOC(=O)c2cc(Cl)cs2)c([N+](=O)[O-])c1 ZINC000758756829 945331207 /nfs/dbraw/zinc/33/12/07/945331207.db2.gz GEUHSHJHQQEXCN-UHFFFAOYSA-N 0 0 357.771 3.554 20 5 FHBDRN Nc1ccc(-c2noc([C@@H]3C[C@@H]3c3cc(F)ccc3F)n2)cc1[N+](=O)[O-] ZINC000581915610 940625649 /nfs/dbraw/zinc/62/56/49/940625649.db2.gz KWUPUTZRFUNFDO-ZYHUDNBSSA-N 0 0 358.304 3.776 20 5 FHBDRN Cc1ccc([C@@H]2OCCC[C@@H]2CNC(=O)c2ccc([N+](=O)[O-])cc2F)cc1 ZINC000173489582 940629370 /nfs/dbraw/zinc/62/93/70/940629370.db2.gz ZMYWNQZJCGNONF-BEFAXECRSA-N 0 0 372.396 3.940 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H](C)Cc1nc2ccccc2s1 ZINC000427391787 945335541 /nfs/dbraw/zinc/33/55/41/945335541.db2.gz SAYGVUDVQWUCHW-NSHDSACASA-N 0 0 371.418 3.574 20 5 FHBDRN COc1cc(CCO)ccc1NCc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000581975887 940636491 /nfs/dbraw/zinc/63/64/91/940636491.db2.gz AZYCBSVVNZBCSA-UHFFFAOYSA-N 0 0 360.410 3.538 20 5 FHBDRN COc1ccc2c(c1)[C@@H](C(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)CC2 ZINC000431815573 940644501 /nfs/dbraw/zinc/64/45/01/940644501.db2.gz WKUDAPUHOWYWQA-GUYCJALGSA-N 0 0 354.406 3.819 20 5 FHBDRN O=[N+]([O-])c1ccc(OCc2nc(CCc3ccccc3)no2)c(Cl)c1 ZINC000173681132 940653917 /nfs/dbraw/zinc/65/39/17/940653917.db2.gz RIUZQIAZDWODTG-UHFFFAOYSA-N 0 0 359.769 3.995 20 5 FHBDRN CSc1ccc(C(=O)N2C[C@H](C)OC[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000173680374 940653951 /nfs/dbraw/zinc/65/39/51/940653951.db2.gz VKSSOADAZWTOOP-GUYCJALGSA-N 0 0 372.446 3.919 20 5 FHBDRN Cc1cc(NC2CC[NH+](CC3CCCC3)CC2)c(C(=O)[O-])cc1[N+](=O)[O-] ZINC000582243884 940656059 /nfs/dbraw/zinc/65/60/59/940656059.db2.gz BNMPAIOPJJXWTL-UHFFFAOYSA-N 0 0 361.442 3.668 20 5 FHBDRN COc1cc(CN2C[C@H](C(F)(F)F)CC[C@@H]2C)c([N+](=O)[O-])cc1F ZINC000613384163 940659120 /nfs/dbraw/zinc/65/91/20/940659120.db2.gz UBYPWUPKTHKSHP-GXSJLCMTSA-N 0 0 350.312 3.905 20 5 FHBDRN COC(=O)c1c(C)cccc1NCc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000582195754 940660085 /nfs/dbraw/zinc/66/00/85/940660085.db2.gz RDTMBFJRJFDVPO-UHFFFAOYSA-N 0 0 367.361 3.957 20 5 FHBDRN O=[N+]([O-])c1cc(F)ccc1-c1nc(C2(c3ccccc3)CCOCC2)no1 ZINC000582327120 940665897 /nfs/dbraw/zinc/66/58/97/940665897.db2.gz NKABBEGRWLYPGW-UHFFFAOYSA-N 0 0 369.352 3.880 20 5 FHBDRN Cc1ccc([C@H]2C[C@H](C)CCN2S(=O)(=O)c2ccc([N+](=O)[O-])s2)o1 ZINC000174084870 940701261 /nfs/dbraw/zinc/70/12/61/940701261.db2.gz WBLVVKUCHLEHGL-ZYHUDNBSSA-N 0 0 370.452 3.720 20 5 FHBDRN COC(=O)c1ccccc1C(=O)c1ccc(N(C)C2CCC2)c([N+](=O)[O-])c1 ZINC000427413882 945343196 /nfs/dbraw/zinc/34/31/96/945343196.db2.gz NBZNYFKHIDCAQE-UHFFFAOYSA-N 0 0 368.389 3.601 20 5 FHBDRN C[C@@H](CNC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc21)c1ccc(F)cc1F ZINC000174343883 940724305 /nfs/dbraw/zinc/72/43/05/940724305.db2.gz BDNWQFDHSHZJFO-JTQLQIEISA-N 0 0 359.332 3.888 20 5 FHBDRN C[C@H](NC(=O)CCOc1ccccc1[N+](=O)[O-])c1cc2ccccc2o1 ZINC000047609804 945345062 /nfs/dbraw/zinc/34/50/62/945345062.db2.gz PJRXVIDGRUOJRM-ZDUSSCGKSA-N 0 0 354.362 3.987 20 5 FHBDRN CCc1nc(COC(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])cs1 ZINC000728651667 940776648 /nfs/dbraw/zinc/77/66/48/940776648.db2.gz WTYCBTDSAMTLFG-UHFFFAOYSA-N 0 0 368.436 3.701 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccnn1-c1ccc(Cl)cc1 ZINC000174818412 940780170 /nfs/dbraw/zinc/78/01/70/940780170.db2.gz UXBCTAYKONNGIB-UHFFFAOYSA-N 0 0 356.769 3.995 20 5 FHBDRN COc1ccc(Cc2noc(-c3cc(C)ccc3[N+](=O)[O-])n2)cc1OC ZINC000174837248 940784260 /nfs/dbraw/zinc/78/42/60/940784260.db2.gz QOMYXYPCZCCFGM-UHFFFAOYSA-N 0 0 355.350 3.561 20 5 FHBDRN CSc1ccccc1N(C)S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000174971514 940792778 /nfs/dbraw/zinc/79/27/78/940792778.db2.gz NSUSOXZAZPEPIQ-UHFFFAOYSA-N 0 0 372.855 3.795 20 5 FHBDRN C[C@H]1CCC(C)(C)N1CC(=O)Nc1ccc([N+](=O)[O-])cc1Br ZINC000452014946 940792782 /nfs/dbraw/zinc/79/27/82/940792782.db2.gz UVMCQAIJEGVJGG-JTQLQIEISA-N 0 0 370.247 3.559 20 5 FHBDRN COc1ccc(NC(=O)c2ccc(F)c(Br)c2)c([N+](=O)[O-])c1 ZINC000175071996 940807150 /nfs/dbraw/zinc/80/71/50/940807150.db2.gz JXBGLIMPIRUMSE-UHFFFAOYSA-N 0 0 369.146 3.757 20 5 FHBDRN Cc1ccc(OC[C@@H](O)COc2ccccc2C(F)(F)F)c([N+](=O)[O-])c1 ZINC000582689448 940813821 /nfs/dbraw/zinc/81/38/21/940813821.db2.gz RWTNTDJTKLLRLN-LBPRGKRZSA-N 0 0 371.311 3.741 20 5 FHBDRN COCCNc1ccc(CNC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)cc1 ZINC000440261764 945353883 /nfs/dbraw/zinc/35/38/83/945353883.db2.gz UUJKCFOSVLVBLW-UHFFFAOYSA-N 0 0 371.437 3.707 20 5 FHBDRN O=C(N[C@H]1CCO[C@H]1c1ccc(Cl)c(F)c1)c1ccccc1[N+](=O)[O-] ZINC000180241934 940853068 /nfs/dbraw/zinc/85/30/68/940853068.db2.gz RZNMNMAIURXJRL-HOCLYGCPSA-N 0 0 364.760 3.647 20 5 FHBDRN CCOCc1ccc(CNC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000175370037 940855869 /nfs/dbraw/zinc/85/58/69/940855869.db2.gz RFAUOUKEZNHVHO-UHFFFAOYSA-N 0 0 371.437 3.866 20 5 FHBDRN CC(C)[C@@H](CNC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1)c1cccnc1 ZINC000175379371 940857627 /nfs/dbraw/zinc/85/76/27/940857627.db2.gz CWUPBRCKUCVPRL-KBXCAEBGSA-N 0 0 356.426 3.790 20 5 FHBDRN CN(Cc1ccccc1F)C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000175527546 940877423 /nfs/dbraw/zinc/87/74/23/940877423.db2.gz OKDZWJKVYQNZOF-UHFFFAOYSA-N 0 0 367.174 3.769 20 5 FHBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)NCC1(c2ccccc2)CCCC1 ZINC000472572555 940883532 /nfs/dbraw/zinc/88/35/32/940883532.db2.gz BBWJTAIFHIHVGJ-UHFFFAOYSA-N 0 0 374.462 3.526 20 5 FHBDRN C[C@H](NC(=O)c1c(F)cccc1Br)c1cccc([N+](=O)[O-])c1 ZINC000175638829 940906138 /nfs/dbraw/zinc/90/61/38/940906138.db2.gz ZWOQUJOWFHKGRZ-VIFPVBQESA-N 0 0 367.174 3.987 20 5 FHBDRN Cc1nc(NC(=O)c2cc(Br)ccc2Cl)ccc1[N+](=O)[O-] ZINC000175682017 940908428 /nfs/dbraw/zinc/90/84/28/940908428.db2.gz OBJPKTWXFAZNJM-UHFFFAOYSA-N 0 0 370.590 3.966 20 5 FHBDRN Cn1c(SCc2cc([N+](=O)[O-])ccc2C(F)(F)F)nnc1C(F)F ZINC000549058282 940930365 /nfs/dbraw/zinc/93/03/65/940930365.db2.gz PCHLRTUKZNSOPT-UHFFFAOYSA-N 0 0 368.287 3.972 20 5 FHBDRN CC(=O)c1cc(NCc2cccc(-c3cnn(C)c3)c2)ccc1[N+](=O)[O-] ZINC000376410422 940933240 /nfs/dbraw/zinc/93/32/40/940933240.db2.gz VYHLKWUARDRAJG-UHFFFAOYSA-N 0 0 350.378 3.810 20 5 FHBDRN CC1(C)C[C@@H](Nc2cccc(O[C@@H]3CC(=O)N3)c2)c2cc([N+](=O)[O-])ccc21 ZINC000414318036 940958627 /nfs/dbraw/zinc/95/86/27/940958627.db2.gz LIMNBUBAQOIJIT-IEBWSBKVSA-N 0 0 367.405 3.654 20 5 FHBDRN COc1cccc([C@H](Nc2ccc(N)cc2[N+](=O)[O-])c2ccccn2)c1 ZINC000376418850 940959561 /nfs/dbraw/zinc/95/95/61/940959561.db2.gz DSGYUJDYTJJHIQ-IBGZPJMESA-N 0 0 350.378 3.782 20 5 FHBDRN CS(=O)(=O)c1ccc(/C=C\c2ccc3cc([N+](=O)[O-])ccc3n2)cc1 ZINC000545317536 940966882 /nfs/dbraw/zinc/96/68/82/940966882.db2.gz WKIKRWARZWIKBR-KXFIGUGUSA-N 0 0 354.387 3.717 20 5 FHBDRN C[C@@H](CC(=O)c1ccc(Cl)cc1)C(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000186274060 940972797 /nfs/dbraw/zinc/97/27/97/940972797.db2.gz JMCRKTYSQJMYEL-LBPRGKRZSA-N 0 0 360.797 3.774 20 5 FHBDRN COc1ccc(C[C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1OC ZINC000180328469 940973167 /nfs/dbraw/zinc/97/31/67/940973167.db2.gz GNXLBKFXAMBWCF-CYBMUJFWSA-N 0 0 358.394 3.738 20 5 FHBDRN O=C(Nc1ccc2oc(C3CC3)nc2c1)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000180354117 940983117 /nfs/dbraw/zinc/98/31/17/940983117.db2.gz DKQWHSJVPZYGRC-UHFFFAOYSA-N 0 0 367.317 3.594 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)F)cc1N1CC[C@@]2(C1)OCc1ccccc12 ZINC000376429274 940988544 /nfs/dbraw/zinc/98/85/44/940988544.db2.gz TXNFMEQDRWJIFD-INIZCTEOSA-N 0 0 365.311 3.644 20 5 FHBDRN C[C@H]1CSc2ccccc2N1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000472590531 941000566 /nfs/dbraw/zinc/00/05/66/941000566.db2.gz SXTSQNJKFIFRSC-LBPRGKRZSA-N 0 0 358.419 3.962 20 5 FHBDRN C[C@@H]1CSc2ccccc2N1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000472590529 941000715 /nfs/dbraw/zinc/00/07/15/941000715.db2.gz SXTSQNJKFIFRSC-GFCCVEGCSA-N 0 0 358.419 3.962 20 5 FHBDRN Cc1cn(C2CCCCC2)[nH]c1=NC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000544302719 945367138 /nfs/dbraw/zinc/36/71/38/945367138.db2.gz BOXYUSDWMPCGHW-UHFFFAOYSA-N 0 0 367.409 3.760 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N[C@H]1CCOc2ccc(F)cc21 ZINC000176225533 941008630 /nfs/dbraw/zinc/00/86/30/941008630.db2.gz XMTXAXNGKGSLJD-AWEZNQCLSA-N 0 0 359.357 3.996 20 5 FHBDRN C[C@@H](NCC(=O)Nc1nc2ccc(F)cc2s1)c1cccc([N+](=O)[O-])c1 ZINC000180425687 941012952 /nfs/dbraw/zinc/01/29/52/941012952.db2.gz DIJDDWAXSSGGMO-SNVBAGLBSA-N 0 0 374.397 3.633 20 5 FHBDRN C[C@H](NCC(=O)Nc1nc(-c2ccco2)cs1)c1cccc([N+](=O)[O-])c1 ZINC000180433518 941014333 /nfs/dbraw/zinc/01/43/33/941014333.db2.gz YFLARMCGZIGUQZ-NSHDSACASA-N 0 0 372.406 3.601 20 5 FHBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000255910104 941016745 /nfs/dbraw/zinc/01/67/45/941016745.db2.gz KKQNUBQZHQUDRA-XGICHPGQSA-N 0 0 367.361 3.707 20 5 FHBDRN C[C@H](NCc1nc(COc2ccc(F)cc2)no1)c1cccc([N+](=O)[O-])c1 ZINC000180452231 941018136 /nfs/dbraw/zinc/01/81/36/941018136.db2.gz LWEOFKXCDHXWNI-LBPRGKRZSA-N 0 0 372.356 3.547 20 5 FHBDRN Cc1c(C(=O)N[C@H]2CCN(c3cccc(Cl)c3)C2)cccc1[N+](=O)[O-] ZINC000176314816 941018513 /nfs/dbraw/zinc/01/85/13/941018513.db2.gz HGIXGTILTNMFEK-AWEZNQCLSA-N 0 0 359.813 3.565 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCS[C@H]4COCC[C@@H]43)o2)cc1 ZINC000180454505 941022878 /nfs/dbraw/zinc/02/28/78/941022878.db2.gz ZASZDWAABGYXCU-WMZOPIPTSA-N 0 0 360.435 3.561 20 5 FHBDRN O=[N+]([O-])c1ccccc1OCCN(Cc1ccco1)Cc1cccnc1 ZINC000180468577 941023904 /nfs/dbraw/zinc/02/39/04/941023904.db2.gz DBEGZBBYJKVSHW-UHFFFAOYSA-N 0 0 353.378 3.664 20 5 FHBDRN CC(C)c1nnc2n1CCN(C(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1)[C@@H]2C ZINC000188712101 941030549 /nfs/dbraw/zinc/03/05/49/941030549.db2.gz LZBCWWPCWMHAFA-CYBMUJFWSA-N 0 0 371.441 3.650 20 5 FHBDRN O=C(Nc1ccc2ncccc2c1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000180527311 941037403 /nfs/dbraw/zinc/03/74/03/941037403.db2.gz NDCXDYBCOFEQGV-UHFFFAOYSA-N 0 0 359.288 3.997 20 5 FHBDRN COc1ccc(NC(=O)CNc2c(F)cc(Cl)cc2F)c([N+](=O)[O-])c1 ZINC000180597402 941049512 /nfs/dbraw/zinc/04/95/12/941049512.db2.gz IPRZEFBHIYKYTD-UHFFFAOYSA-N 0 0 371.727 3.586 20 5 FHBDRN C[C@@H](NC(=O)c1c(N)cccc1[N+](=O)[O-])c1cccc(C(F)(F)F)c1 ZINC000180598155 941049728 /nfs/dbraw/zinc/04/97/28/941049728.db2.gz MLJIAGJJSLHBKQ-SECBINFHSA-N 0 0 353.300 3.687 20 5 FHBDRN CC(=O)c1cc(N[C@H](c2cnn(C)c2)c2ccc(F)cc2)ccc1[N+](=O)[O-] ZINC000376458698 941051495 /nfs/dbraw/zinc/05/14/95/941051495.db2.gz BECSWJSKHPOBCY-IBGZPJMESA-N 0 0 368.368 3.872 20 5 FHBDRN Nc1cccc([N+](=O)[O-])c1C(=O)N1CCC(CCc2ccccc2)CC1 ZINC000180614400 941055560 /nfs/dbraw/zinc/05/55/60/941055560.db2.gz RIGVWLFSEQYYFK-UHFFFAOYSA-N 0 0 353.422 3.662 20 5 FHBDRN COC1(C(=O)Nc2nccc3cc([N+](=O)[O-])ccc32)CCC(F)(F)CC1 ZINC000892638365 941056610 /nfs/dbraw/zinc/05/66/10/941056610.db2.gz RNDNVYUYVDAHCB-UHFFFAOYSA-N 0 0 365.336 3.676 20 5 FHBDRN CC(=O)c1cc(N[C@@H](c2cnn(C)c2)c2ccccc2)ccc1[N+](=O)[O-] ZINC000376473883 941064770 /nfs/dbraw/zinc/06/47/70/941064770.db2.gz JHDQFAYUYLUFCO-LJQANCHMSA-N 0 0 350.378 3.732 20 5 FHBDRN COc1ccc(CSCC(=O)N[C@H]2CC23CCCCC3)cc1[N+](=O)[O-] ZINC000180715097 941066549 /nfs/dbraw/zinc/06/65/49/941066549.db2.gz FPFHJHJLJSYCKU-INIZCTEOSA-N 0 0 364.467 3.676 20 5 FHBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)Nc1nc(CN2CCCCC2)cs1 ZINC000255921153 941068633 /nfs/dbraw/zinc/06/86/33/941068633.db2.gz TVWGKSAGYGKSAU-TWGQIWQCSA-N 0 0 372.450 3.689 20 5 FHBDRN CC(=O)Nc1ccc(C)c(C(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)c1 ZINC000188784819 941084024 /nfs/dbraw/zinc/08/40/24/941084024.db2.gz ONBWBFNBZHMIET-UHFFFAOYSA-N 0 0 367.405 3.666 20 5 FHBDRN C[C@H](NC(=O)c1c(N)cccc1[N+](=O)[O-])c1ccc(-c2cccnc2)cc1 ZINC000180840753 941084391 /nfs/dbraw/zinc/08/43/91/941084391.db2.gz WQFRFKBHYSIJAE-ZDUSSCGKSA-N 0 0 362.389 3.730 20 5 FHBDRN COC(=O)c1c(C)c([N+](=O)[O-])ccc1NCc1nccc2ccccc21 ZINC001167704409 941084736 /nfs/dbraw/zinc/08/47/36/941084736.db2.gz PMRDGPABDHVMEU-UHFFFAOYSA-N 0 0 351.362 3.850 20 5 FHBDRN CCn1c(NC(=O)c2cc(OC)ccc2[N+](=O)[O-])nc2cc(Cl)ccc21 ZINC000180906684 941090056 /nfs/dbraw/zinc/09/00/56/941090056.db2.gz MPJPOGAKSDCXLN-UHFFFAOYSA-N 0 0 374.784 3.879 20 5 FHBDRN CCc1oc2ccccc2c1CN(C)C(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000180895245 941090353 /nfs/dbraw/zinc/09/03/53/941090353.db2.gz FJHMVKOMTVTPSL-UHFFFAOYSA-N 0 0 353.378 3.758 20 5 FHBDRN Nc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1CCSc2ccc(Cl)cc21 ZINC000180896812 941090479 /nfs/dbraw/zinc/09/04/79/941090479.db2.gz PUEXPYBGUAZGSZ-LBPRGKRZSA-N 0 0 363.826 3.797 20 5 FHBDRN O=[N+]([O-])c1ccc2oc(CN3CCC(Oc4ccccc4)CC3)nc2c1 ZINC000177022138 941094424 /nfs/dbraw/zinc/09/44/24/941094424.db2.gz VRLXJVXKRCHPHS-UHFFFAOYSA-N 0 0 353.378 3.779 20 5 FHBDRN COc1cc(C(=O)N2C[C@@H](C)Oc3ccc(C)cc32)cc([N+](=O)[O-])c1C ZINC000188807706 941094707 /nfs/dbraw/zinc/09/47/07/941094707.db2.gz XPSIYGBIPKNSRU-GFCCVEGCSA-N 0 0 356.378 3.648 20 5 FHBDRN C[C@@H](O)[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)C1 ZINC000181056474 941106181 /nfs/dbraw/zinc/10/61/81/941106181.db2.gz JOFNSZKQBHIWML-ZIAGYGMSSA-N 0 0 372.446 3.589 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)c1ccc2[nH]c(C(F)F)nc2c1 ZINC000549090482 941108504 /nfs/dbraw/zinc/10/85/04/941108504.db2.gz JOKRSFDRQKSSOQ-UHFFFAOYSA-N 0 0 374.347 3.723 20 5 FHBDRN C[C@H](NC(=O)c1c(N)cccc1[N+](=O)[O-])c1ccc(OCC2CC2)c(F)c1 ZINC000181194028 941112693 /nfs/dbraw/zinc/11/26/93/941112693.db2.gz MNQWQZNFLQCUCN-NSHDSACASA-N 0 0 373.384 3.596 20 5 FHBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)[C@H]1CCc2c1cccc2Cl ZINC000414413353 941114302 /nfs/dbraw/zinc/11/43/02/941114302.db2.gz KJEKYZOBWUJFJY-INIZCTEOSA-N 0 0 351.811 3.851 20 5 FHBDRN O=[N+]([O-])c1cc(C(F)(F)F)cc([N+](=O)[O-])c1NCC1(O)CCCCC1 ZINC000302004923 941114631 /nfs/dbraw/zinc/11/46/31/941114631.db2.gz ZUODAAQYMLJPJZ-UHFFFAOYSA-N 0 0 363.292 3.629 20 5 FHBDRN COc1cc(C(=O)N[C@H]2CCCC[C@H]2C(C)C)c([N+](=O)[O-])cc1OC ZINC000103057358 941115086 /nfs/dbraw/zinc/11/50/86/941115086.db2.gz LHDWQKDPVYDFOW-JSGCOSHPSA-N 0 0 350.415 3.557 20 5 FHBDRN CCCOc1cc(OC)ccc1C(=O)N1CCc2c1cccc2[N+](=O)[O-] ZINC000188844545 941117846 /nfs/dbraw/zinc/11/78/46/941117846.db2.gz WNLXEOJYBFZWER-UHFFFAOYSA-N 0 0 356.378 3.595 20 5 FHBDRN COc1ccc(C(=O)N2CCc3c2cccc3[N+](=O)[O-])c(OC(C)C)c1 ZINC000188844731 941117863 /nfs/dbraw/zinc/11/78/63/941117863.db2.gz OGNXZXRHNAAMJK-UHFFFAOYSA-N 0 0 356.378 3.594 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@H](C)c1cn(-c2ccccc2)nn1 ZINC000181337308 941124801 /nfs/dbraw/zinc/12/48/01/941124801.db2.gz IEWKOJZBFWVPDB-HUUCEWRRSA-N 0 0 351.410 3.896 20 5 FHBDRN CC1(C)CN(C(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CC(C)(C)O1 ZINC000188938923 941132209 /nfs/dbraw/zinc/13/22/09/941132209.db2.gz RNJFJCHJMWJCQD-UHFFFAOYSA-N 0 0 360.332 3.643 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CCOc2c(F)cccc21 ZINC000188986300 941140606 /nfs/dbraw/zinc/14/06/06/941140606.db2.gz MNHRRDRNNOMMMT-KDOFPFPSSA-N 0 0 372.396 3.943 20 5 FHBDRN O=C(c1ccc(Cl)cc1[N+](=O)[O-])N1CCO[C@@H](c2ccccc2F)C1 ZINC000066691428 941144869 /nfs/dbraw/zinc/14/48/69/941144869.db2.gz QQFCXHOFTFCFSN-MRXNPFEDSA-N 0 0 364.760 3.601 20 5 FHBDRN CCN1C(=O)c2cc(Cl)ccc2N[C@@H]1c1ccc([N+](=O)[O-])c(OC)c1 ZINC000092198904 941145396 /nfs/dbraw/zinc/14/53/96/941145396.db2.gz USKIYKKAONHGTE-INIZCTEOSA-N 0 0 361.785 3.843 20 5 FHBDRN CCN(Cc1ccccn1)C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000177674745 941146089 /nfs/dbraw/zinc/14/60/89/941146089.db2.gz VNDQZTQXPGMNNX-UHFFFAOYSA-N 0 0 368.418 3.776 20 5 FHBDRN CC(C)c1nnc2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3Cl)cn21 ZINC000189266212 941154334 /nfs/dbraw/zinc/15/43/34/941154334.db2.gz OHBQIFLJHPOTMR-UHFFFAOYSA-N 0 0 359.773 3.667 20 5 FHBDRN CSc1ccc(C(=O)N[C@H]2CCOc3c(F)cccc32)cc1[N+](=O)[O-] ZINC000189263232 941154378 /nfs/dbraw/zinc/15/43/78/941154378.db2.gz YERGKUDVHLQWIY-ZDUSSCGKSA-N 0 0 362.382 3.709 20 5 FHBDRN Cc1cnc([C@H](C)NC(=O)c2ccc([N+](=O)[O-])cc2Br)s1 ZINC000177926675 941155122 /nfs/dbraw/zinc/15/51/22/941155122.db2.gz OKOKJNHCUJNZMS-QMMMGPOBSA-N 0 0 370.228 3.613 20 5 FHBDRN CC(F)(F)c1cccc(NC(=O)c2cn(-c3cccc([N+](=O)[O-])c3)nn2)c1 ZINC000189391550 941156815 /nfs/dbraw/zinc/15/68/15/941156815.db2.gz ASPXXIIGJSEITE-UHFFFAOYSA-N 0 0 373.319 3.540 20 5 FHBDRN COC(=O)CC1(CC(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)CCCC1 ZINC000189395538 941157108 /nfs/dbraw/zinc/15/71/08/941157108.db2.gz WFGHECOFYGKKPP-AWEZNQCLSA-N 0 0 362.426 3.594 20 5 FHBDRN CCN(CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)c1cc(C)ccc1C ZINC001167709516 941158540 /nfs/dbraw/zinc/15/85/40/941158540.db2.gz ZEUFSWKBABCFBP-UHFFFAOYSA-N 0 0 353.422 3.627 20 5 FHBDRN COc1cc(C(=O)NCc2csc(-c3ccco3)n2)cc([N+](=O)[O-])c1C ZINC000189472831 941158587 /nfs/dbraw/zinc/15/85/87/941158587.db2.gz QHUAMJZPLRJZCU-UHFFFAOYSA-N 0 0 373.390 3.558 20 5 FHBDRN CC[C@@](C)(O)CN(Cc1ccccc1)C(=O)c1cc([N+](=O)[O-])c(C)s1 ZINC000189506484 941159358 /nfs/dbraw/zinc/15/93/58/941159358.db2.gz KUNDWJNUACXRLT-GOSISDBHSA-N 0 0 362.451 3.768 20 5 FHBDRN CSCc1cccc(CNC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000189508204 941159389 /nfs/dbraw/zinc/15/93/89/941159389.db2.gz XBALXVFHRDRHFT-UHFFFAOYSA-N 0 0 364.854 3.970 20 5 FHBDRN CCN(Cc1c[nH]c2ccccc12)C(=O)c1ccc(OC)c([N+](=O)[O-])c1 ZINC000189563605 941161274 /nfs/dbraw/zinc/16/12/74/941161274.db2.gz ZTKZHYCDVSYIRG-UHFFFAOYSA-N 0 0 353.378 3.747 20 5 FHBDRN O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCCCC[C@H]1c1ncon1 ZINC000189594854 941213484 /nfs/dbraw/zinc/21/34/84/941213484.db2.gz OVRRFHVOHVZOKR-ZDUSSCGKSA-N 0 0 372.406 3.950 20 5 FHBDRN CC(=O)c1ccc(NC[C@](C)(Cc2ccccc2)[C@H](C)O)c([N+](=O)[O-])c1 ZINC000189652559 941242376 /nfs/dbraw/zinc/24/23/76/941242376.db2.gz ZBPYITLDYDFSJN-YWZLYKJASA-N 0 0 356.422 3.839 20 5 FHBDRN COc1ccc2[nH]c(C(=O)NCc3ccc([N+](=O)[O-])cc3Cl)cc2c1 ZINC000189659974 941245316 /nfs/dbraw/zinc/24/53/16/941245316.db2.gz SMRUEKPRROQOGJ-UHFFFAOYSA-N 0 0 359.769 3.668 20 5 FHBDRN C[C@@H](c1ccccn1)N(C)C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000178478572 941261289 /nfs/dbraw/zinc/26/12/89/941261289.db2.gz ZJRRZPPYOIIJTE-JTQLQIEISA-N 0 0 364.199 3.586 20 5 FHBDRN COC[C@H](Cc1ccccc1)N(C)C(=O)Nc1c(C)ccc([N+](=O)[O-])c1C ZINC000189737855 941266730 /nfs/dbraw/zinc/26/67/30/941266730.db2.gz URBDQDXMSHVRSP-KRWDZBQOSA-N 0 0 371.437 3.933 20 5 FHBDRN COc1cc(C(=O)Nc2c(C)cc(N(C)C)cc2C)cc([N+](=O)[O-])c1C ZINC000189719288 941266908 /nfs/dbraw/zinc/26/69/08/941266908.db2.gz VZGJLNOMJFHFQP-UHFFFAOYSA-N 0 0 357.410 3.847 20 5 FHBDRN C[C@H](C1CC1)n1cc(NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)cn1 ZINC000189753314 941271197 /nfs/dbraw/zinc/27/11/97/941271197.db2.gz NDTIOMLHDVEJBY-CYBMUJFWSA-N 0 0 369.425 3.959 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)NCCSc1ccccc1 ZINC000024383703 941273380 /nfs/dbraw/zinc/27/33/80/941273380.db2.gz RTEQUJUJCWFQGI-UHFFFAOYSA-N 0 0 359.451 3.695 20 5 FHBDRN CCOc1cc2c(cc1NC(=O)Cc1cccc([N+](=O)[O-])c1C)O[C@@H](C)C2 ZINC000178562823 941276807 /nfs/dbraw/zinc/27/68/07/941276807.db2.gz NZHZWEYRZRSWHA-LBPRGKRZSA-N 0 0 370.405 3.807 20 5 FHBDRN Cc1ccc(-n2cccn2)cc1N[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000189839075 941287143 /nfs/dbraw/zinc/28/71/43/941287143.db2.gz UFFXGJFEEDWNPF-AWEZNQCLSA-N 0 0 365.393 3.528 20 5 FHBDRN Cc1ccc(-n2cccn2)cc1N[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000189839092 941287214 /nfs/dbraw/zinc/28/72/14/941287214.db2.gz UFFXGJFEEDWNPF-CQSZACIVSA-N 0 0 365.393 3.528 20 5 FHBDRN Cc1cc(C(F)(F)F)ccc1CNC(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000189854459 941289364 /nfs/dbraw/zinc/28/93/64/941289364.db2.gz JTRUVVBQWAJACV-UHFFFAOYSA-N 0 0 352.312 3.781 20 5 FHBDRN CCCN(c1cccc([N+](=O)[O-])c1)S(=O)(=O)c1ccc(OC)cc1C ZINC001211646071 941302005 /nfs/dbraw/zinc/30/20/05/941302005.db2.gz IYTUNBFMCNMCJB-UHFFFAOYSA-N 0 0 364.423 3.517 20 5 FHBDRN Cc1ccccc1OCCNC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000178857040 941315417 /nfs/dbraw/zinc/31/54/17/941315417.db2.gz ALPLZMZYOVOHNJ-UHFFFAOYSA-N 0 0 369.421 3.656 20 5 FHBDRN Cn1ccnc1-c1cc(NC(=O)c2cc3ccccc3c3cccnc23)n[nH]1 ZINC000179055376 941334060 /nfs/dbraw/zinc/33/40/60/941334060.db2.gz YEJVUUYHQQVYGW-UHFFFAOYSA-N 0 0 368.400 3.764 20 5 FHBDRN COC(=O)C[C@@](C)(NCc1ccc(C(C)C)c([N+](=O)[O-])c1)c1ccncc1 ZINC000190020881 941346725 /nfs/dbraw/zinc/34/67/25/941346725.db2.gz LIVWPYCXOWBKNR-HXUWFJFHSA-N 0 0 371.437 3.681 20 5 FHBDRN COC(=O)c1ccc(OCc2ccc([N+](=O)[O-])cc2Cl)c(OC)c1 ZINC000543863827 941353423 /nfs/dbraw/zinc/35/34/23/941353423.db2.gz ZXUZLQANWBDWCP-UHFFFAOYSA-N 0 0 351.742 3.622 20 5 FHBDRN C[C@H](NC(=O)[C@H]1CCCN1Cc1ccc(F)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000452180288 941364873 /nfs/dbraw/zinc/36/48/73/941364873.db2.gz CJQYGWRGXBOPRS-IFXJQAMLSA-N 0 0 371.412 3.576 20 5 FHBDRN CC(C)c1ccc(CNc2cccc(O[C@@H]3CC(=O)N3)c2)cc1[N+](=O)[O-] ZINC000414554541 941378415 /nfs/dbraw/zinc/37/84/15/941378415.db2.gz SKAKFEHVERVRGQ-LJQANCHMSA-N 0 0 355.394 3.555 20 5 FHBDRN CCS[C@H]1CC[C@@H](N(C)S(=O)(=O)c2c(C)ccc(C)c2[N+](=O)[O-])C1 ZINC000190031276 941378970 /nfs/dbraw/zinc/37/89/70/941378970.db2.gz OAXOMDDZBKUKQX-KGLIPLIRSA-N 0 0 372.512 3.506 20 5 FHBDRN O=C(c1cccc([N+](=O)[O-])c1F)N1CCO[C@H](c2ccccc2Cl)C1 ZINC000376741814 941407450 /nfs/dbraw/zinc/40/74/50/941407450.db2.gz JPELZSXVJWDTAO-HNNXBMFYSA-N 0 0 364.760 3.601 20 5 FHBDRN C[C@H](COc1ccccc1)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000122286181 941431859 /nfs/dbraw/zinc/43/18/59/941431859.db2.gz JBARHLQGQKBKLR-LLVKDONJSA-N 0 0 366.320 3.850 20 5 FHBDRN Cc1cnc(OCC(=O)Nc2ccc(SC(F)F)cc2)c([N+](=O)[O-])c1 ZINC000178279610 941434796 /nfs/dbraw/zinc/43/47/96/941434796.db2.gz KIJJSHLZKBRUIZ-UHFFFAOYSA-N 0 0 369.349 3.630 20 5 FHBDRN Cc1ccnc(C2CCN(C(=O)c3c(C)cc(C)c([N+](=O)[O-])c3C)CC2)n1 ZINC000376841726 941447854 /nfs/dbraw/zinc/44/78/54/941447854.db2.gz IXDQYVXXSKLYPV-UHFFFAOYSA-N 0 0 368.437 3.638 20 5 FHBDRN COc1ccc2c(c1)[C@H](C(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1)CC2 ZINC000431838008 941477195 /nfs/dbraw/zinc/47/71/95/941477195.db2.gz ORZRZUALUFVHLS-QGZVFWFLSA-N 0 0 354.406 3.685 20 5 FHBDRN Cc1nc([C@H]2CCCCN2C(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)no1 ZINC000377011580 941491498 /nfs/dbraw/zinc/49/14/98/941491498.db2.gz ZSNDZPOVRMKTAV-OAHLLOKOSA-N 0 0 358.398 3.777 20 5 FHBDRN C[C@H]1CCN(c2nnc(-c3cccc([N+](=O)[O-])c3)n2Cc2ccccc2)C1 ZINC000549131200 941498470 /nfs/dbraw/zinc/49/84/70/941498470.db2.gz WNCGRROHRPABGT-HNNXBMFYSA-N 0 0 363.421 3.748 20 5 FHBDRN CC(=O)c1ccc([N+](=O)[O-])cc1N[C@H]1CCN(C(C)=O)c2ccccc21 ZINC000377175315 941541553 /nfs/dbraw/zinc/54/15/53/941541553.db2.gz LPOCYOCGKMBFPQ-KRWDZBQOSA-N 0 0 353.378 3.707 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(Cl)cc2-n2cccn2)c1 ZINC000472671887 941541812 /nfs/dbraw/zinc/54/18/12/941541812.db2.gz RLRFQTBLIBXEBJ-UHFFFAOYSA-N 0 0 356.769 3.995 20 5 FHBDRN CCOc1ccc(C(C)=O)cc1CN(C)CCc1cccc([N+](=O)[O-])c1 ZINC000549156837 941547919 /nfs/dbraw/zinc/54/79/19/941547919.db2.gz OHLOHHRVODVKQS-UHFFFAOYSA-N 0 0 356.422 3.871 20 5 FHBDRN C[C@@](O)(C1CCN(c2ccnc3c2cccc3[N+](=O)[O-])CC1)C(F)(F)F ZINC000564700352 941567432 /nfs/dbraw/zinc/56/74/32/941567432.db2.gz AOQASQLGNDNSIF-MRXNPFEDSA-N 0 0 369.343 3.673 20 5 FHBDRN CCn1ccnc1[C@H]1CCCCN1C(=O)/C=C/c1cccc([N+](=O)[O-])c1 ZINC000377220097 941575309 /nfs/dbraw/zinc/57/53/09/941575309.db2.gz DGWRRKVCEBEPOK-OAGJVSPASA-N 0 0 354.410 3.578 20 5 FHBDRN CC(=O)N[C@H](C)C1CCN(c2cc(C)c(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000549173722 941585690 /nfs/dbraw/zinc/58/56/90/941585690.db2.gz PWQDRUMDOQNJGL-LLVKDONJSA-N 0 0 373.375 3.663 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(N[C@@H](C)[C@H](OC)c2ccc(F)cc2)c1 ZINC000541113103 941587728 /nfs/dbraw/zinc/58/77/28/941587728.db2.gz HLBRGWBEIXCARA-GTNSWQLSSA-N 0 0 362.357 3.709 20 5 FHBDRN O=C(Nc1ccc(C2CCC2)cc1)C(=O)Nc1cc(F)cc([N+](=O)[O-])c1 ZINC000472697300 941597246 /nfs/dbraw/zinc/59/72/46/941597246.db2.gz GNKZTBQQTVGRLR-UHFFFAOYSA-N 0 0 357.341 3.579 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(SCCOc2ccc(OC)cc2)c1 ZINC000541113668 941601982 /nfs/dbraw/zinc/60/19/82/941601982.db2.gz OJRJPQBBWSUDPS-UHFFFAOYSA-N 0 0 363.391 3.561 20 5 FHBDRN C[C@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)c1c[nH]nc1[N+](=O)[O-] ZINC000549183270 941604563 /nfs/dbraw/zinc/60/45/63/941604563.db2.gz DLYNQSJWXSDYAY-CYBMUJFWSA-N 0 0 350.378 3.818 20 5 FHBDRN C[C@H](c1cccs1)N(Cc1ccccc1)C(=O)c1c[nH]nc1[N+](=O)[O-] ZINC000549192121 941616943 /nfs/dbraw/zinc/61/69/43/941616943.db2.gz WCFYGHATQKGHHV-GFCCVEGCSA-N 0 0 356.407 3.783 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])Nc1cccc(SC(F)F)c1 ZINC000066782459 941620508 /nfs/dbraw/zinc/62/05/08/941620508.db2.gz NOXWOEOACZWNLK-UHFFFAOYSA-N 0 0 353.350 3.960 20 5 FHBDRN Cc1ccc(F)c2c1N(C(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1)CCC2 ZINC000066786781 941638775 /nfs/dbraw/zinc/63/87/75/941638775.db2.gz BCWASLULPLINTM-UHFFFAOYSA-N 0 0 373.340 3.852 20 5 FHBDRN Cc1cnn([C@@H]2CCN(C(=O)c3cc4ccccc4c4cccnc34)C2)c1 ZINC000377362097 941674947 /nfs/dbraw/zinc/67/49/47/941674947.db2.gz ZYDYAJCMPFMPBW-QGZVFWFLSA-N 0 0 356.429 3.980 20 5 FHBDRN COc1ccccc1Nc1nnc(Sc2ccncc2[N+](=O)[O-])s1 ZINC000066796615 941689163 /nfs/dbraw/zinc/68/91/63/941689163.db2.gz CZYNRGNQJLRKKK-UHFFFAOYSA-N 0 0 361.408 3.745 20 5 FHBDRN CCCOc1ccc(NC(=O)c2cc([N+](=O)[O-])cn2C)cc1OCCC ZINC000024477923 941690437 /nfs/dbraw/zinc/69/04/37/941690437.db2.gz IKDYIKNQDPPCJD-UHFFFAOYSA-N 0 0 361.398 3.763 20 5 FHBDRN COc1cc(OCC(=O)OC[C@@H]2CCCc3ccccc32)ccc1[N+](=O)[O-] ZINC000729216650 941693837 /nfs/dbraw/zinc/69/38/37/941693837.db2.gz BUZJCVFZZHBQCC-HNNXBMFYSA-N 0 0 371.389 3.646 20 5 FHBDRN CC(C)Oc1cc(C(=O)N[C@@](C)(C2CC2)C(F)(F)F)ccc1[N+](=O)[O-] ZINC000415244920 941699201 /nfs/dbraw/zinc/69/92/01/941699201.db2.gz UIFCOHNVZMZFRS-HNNXBMFYSA-N 0 0 360.332 3.843 20 5 FHBDRN C[C@@H]1CCc2ccccc2N1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000072553835 941716931 /nfs/dbraw/zinc/71/69/31/941716931.db2.gz SMALFMMFNZMMLW-CYBMUJFWSA-N 0 0 350.378 3.986 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CCOc3cccc(F)c32)ccc1[N+](=O)[O-] ZINC000415288940 941730167 /nfs/dbraw/zinc/73/01/67/941730167.db2.gz AFYPAKYKEGQECB-UHFFFAOYSA-N 0 0 360.341 3.560 20 5 FHBDRN CCNC(=O)Nc1cccc(NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000067302474 941738382 /nfs/dbraw/zinc/73/83/82/941738382.db2.gz AAKYOYBFIZYYDL-UHFFFAOYSA-N 0 0 362.773 3.642 20 5 FHBDRN CC(C)Oc1cc(C(=O)N[C@H]2CCOc3ccc(F)cc32)ccc1[N+](=O)[O-] ZINC000412099139 941739498 /nfs/dbraw/zinc/73/94/98/941739498.db2.gz ZKGKMZVDXXKHBY-HNNXBMFYSA-N 0 0 374.368 3.775 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCc1cccc2c1CCCN2 ZINC000415303547 941740574 /nfs/dbraw/zinc/74/05/74/941740574.db2.gz UXAHEJGZIGTLJH-UHFFFAOYSA-N 0 0 354.410 3.891 20 5 FHBDRN Cn1c(C(=O)Nc2ccc(NC(=O)OC(C)(C)C)cc2)ccc1[N+](=O)[O-] ZINC000729404513 941746807 /nfs/dbraw/zinc/74/68/07/941746807.db2.gz JGTMOQXJKJOVOU-UHFFFAOYSA-N 0 0 360.370 3.533 20 5 FHBDRN O=C(CCNc1ccc([N+](=O)[O-])nc1)Nc1cc(Cl)cc(Cl)c1 ZINC000549251042 941747566 /nfs/dbraw/zinc/74/75/66/941747566.db2.gz NGNVDOMLCBYPCX-UHFFFAOYSA-N 0 0 355.181 3.737 20 5 FHBDRN Cc1cccc2c1CCN(C(=O)c1ccc(N3CCCC3)c([N+](=O)[O-])c1)C2 ZINC000729411865 941748269 /nfs/dbraw/zinc/74/82/69/941748269.db2.gz DPZITSQNVGBQKN-UHFFFAOYSA-N 0 0 365.433 3.702 20 5 FHBDRN Nc1ccc(C(=O)N2CCCC[C@@H]2Cc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000729419791 941749240 /nfs/dbraw/zinc/74/92/40/941749240.db2.gz NLIFUKALOGWHFU-MRXNPFEDSA-N 0 0 357.385 3.554 20 5 FHBDRN O=C(OCc1cncc(OCc2ccccc2)c1)c1csc([N+](=O)[O-])c1 ZINC000783022524 941754243 /nfs/dbraw/zinc/75/42/43/941754243.db2.gz DHJNWHYKDGPLPR-UHFFFAOYSA-N 0 0 370.386 3.987 20 5 FHBDRN O=[N+]([O-])c1cc2ccccc2nc1NCc1ccnc(OC2CCC2)c1 ZINC000473523058 941762828 /nfs/dbraw/zinc/76/28/28/941762828.db2.gz RLDHIKAYWDZAFF-UHFFFAOYSA-N 0 0 350.378 3.503 20 5 FHBDRN CN(C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)c1ccc2cc[nH]c2c1 ZINC000473524026 941763257 /nfs/dbraw/zinc/76/32/57/941763257.db2.gz JKHNDPRQFYRFSN-UHFFFAOYSA-N 0 0 361.304 3.954 20 5 FHBDRN C[C@H]([C@H]1Cc2ccccc2O1)N(C)C(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000433565964 941767406 /nfs/dbraw/zinc/76/74/06/941767406.db2.gz XVVUXOZPDHCKIG-KZULUSFZSA-N 0 0 366.373 3.805 20 5 FHBDRN C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CCC[C@@H]1c1nccs1 ZINC000377503251 941769747 /nfs/dbraw/zinc/76/97/47/941769747.db2.gz RFQQKLFYSVRGFD-BXUZGUMPSA-N 0 0 371.422 3.999 20 5 FHBDRN O=[N+]([O-])c1c(N2CC[C@](F)(c3ccccc3F)C2)nc2sccn21 ZINC000549265078 941791044 /nfs/dbraw/zinc/79/10/44/941791044.db2.gz AYEQAVYPNATEBF-OAHLLOKOSA-N 0 0 350.350 3.518 20 5 FHBDRN CCc1nc([C@H](C)NC(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)cs1 ZINC000412112993 941793626 /nfs/dbraw/zinc/79/36/26/941793626.db2.gz WIXIBTCYAQZMMA-NSHDSACASA-N 0 0 363.439 3.892 20 5 FHBDRN Cc1nn(Cc2ccc(C(=O)OCCC(F)(F)F)cc2)c(C)c1[N+](=O)[O-] ZINC000122560760 941796809 /nfs/dbraw/zinc/79/68/09/941796809.db2.gz ORTIRSPPGIIWIL-UHFFFAOYSA-N 0 0 371.315 3.566 20 5 FHBDRN C[C@@H](NC(=O)[C@@H]1COCC[C@@H]1c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000415395946 941797580 /nfs/dbraw/zinc/79/75/80/941797580.db2.gz TYLAHNGYSPBBHQ-ZTFGCOKTSA-N 0 0 354.406 3.592 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)NCc1ncc(-c2ccccc2)o1 ZINC000122567667 941798485 /nfs/dbraw/zinc/79/84/85/941798485.db2.gz PVHHQGTWBWPABA-UHFFFAOYSA-N 0 0 368.349 3.580 20 5 FHBDRN COCC(C)(C)CC(=O)N(C)c1nc(-c2ccccc2[N+](=O)[O-])cs1 ZINC000415399052 941804696 /nfs/dbraw/zinc/80/46/96/941804696.db2.gz XXPVWXNJCJOBJY-UHFFFAOYSA-N 0 0 363.439 3.744 20 5 FHBDRN Cc1ccc(CN(C)C(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])nc1 ZINC000616172082 941807501 /nfs/dbraw/zinc/80/75/01/941807501.db2.gz SHBBIKGHFCCRQV-UHFFFAOYSA-N 0 0 365.842 3.702 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N[C@H](c2ccccc2)C(C)C)c1F ZINC000412127378 941807592 /nfs/dbraw/zinc/80/75/92/941807592.db2.gz FWXCGGWUABKOPB-IBGZPJMESA-N 0 0 360.385 3.799 20 5 FHBDRN Nc1ccc(SCC(=O)N2CCc3cc([N+](=O)[O-])ccc32)c(Cl)c1 ZINC000513263577 941816029 /nfs/dbraw/zinc/81/60/29/941816029.db2.gz SVFLTHRNMUCNPP-UHFFFAOYSA-N 0 0 363.826 3.512 20 5 FHBDRN CNC(=O)c1ccc(N2CC[C@@](C)(CCc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000433645421 941820591 /nfs/dbraw/zinc/82/05/91/941820591.db2.gz OWIZXCGDEMQCND-OAQYLSRUSA-N 0 0 367.449 3.804 20 5 FHBDRN COC(=O)c1cnc(NCCc2cccc3ccccc32)c([N+](=O)[O-])c1 ZINC000616176840 941822326 /nfs/dbraw/zinc/82/23/26/941822326.db2.gz VOPZLVFTRFSZCU-UHFFFAOYSA-N 0 0 351.362 3.584 20 5 FHBDRN Cc1nn(CC(=O)c2ccc(Br)cc2)c2ccc([N+](=O)[O-])cc12 ZINC000513277565 941826923 /nfs/dbraw/zinc/82/69/23/941826923.db2.gz ROOCVMRKKUBMHE-UHFFFAOYSA-N 0 0 374.194 3.898 20 5 FHBDRN CC[C@H](NC(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-])c1cccc(Cl)c1 ZINC000433681057 941830960 /nfs/dbraw/zinc/83/09/60/941830960.db2.gz BPSOJUHXQCHLPM-LBPRGKRZSA-N 0 0 350.806 3.976 20 5 FHBDRN CC(C)(C)[C@@H]1OCCC[C@H]1CNC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412133885 941831302 /nfs/dbraw/zinc/83/13/02/941831302.db2.gz ZFBHDRBUQPHADU-DZJNRPSUSA-N 0 0 360.454 3.656 20 5 FHBDRN CCc1ccc(CN(C(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])C2CC2)cc1 ZINC000433680615 941831456 /nfs/dbraw/zinc/83/14/56/941831456.db2.gz QKVAXOGLUQWYFL-UHFFFAOYSA-N 0 0 356.426 3.809 20 5 FHBDRN C[C@H](C(=O)N(C)CCc1cccc([N+](=O)[O-])c1)[C@@H]1OCCc2sccc21 ZINC000513304352 941836965 /nfs/dbraw/zinc/83/69/65/941836965.db2.gz XGHKETZHTNOPBR-UGSOOPFHSA-N 0 0 374.462 3.607 20 5 FHBDRN CCO[C@@H]1C[C@@H](Nc2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)[C@H]1n1cccn1 ZINC000549284850 941837939 /nfs/dbraw/zinc/83/79/39/941837939.db2.gz CNMVPUXMTSBLDV-ZTFGCOKTSA-N 0 0 374.441 3.799 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N2C[C@@H](C)[C@@H]2c2ccccc2)c1F ZINC000412144830 941841309 /nfs/dbraw/zinc/84/13/09/941841309.db2.gz CAUBYEOMHANBOX-CWTRNNRKSA-N 0 0 358.369 3.505 20 5 FHBDRN COc1cccc(F)c1[C@H](C)NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412146264 941841612 /nfs/dbraw/zinc/84/16/12/941841612.db2.gz OSYIQZAZIVYREZ-TUKIKUTGSA-N 0 0 358.369 3.723 20 5 FHBDRN CSc1ccc(F)cc1CNC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412148538 941842742 /nfs/dbraw/zinc/84/27/42/941842742.db2.gz AIRLJWUUHXANQS-JKSUJKDBSA-N 0 0 360.410 3.876 20 5 FHBDRN CCc1nc([C@@H]2CCCN(c3ccc([N+](=O)[O-])c(OC(F)F)c3)C2)no1 ZINC000365609222 941846321 /nfs/dbraw/zinc/84/63/21/941846321.db2.gz CZCALUDCGORLCG-SNVBAGLBSA-N 0 0 368.340 3.526 20 5 FHBDRN CCOC(=O)c1cc(NCCc2nc(CC)c(C)s2)ccc1[N+](=O)[O-] ZINC000433714197 941847034 /nfs/dbraw/zinc/84/70/34/941847034.db2.gz POFTXVWFUBQPAW-UHFFFAOYSA-N 0 0 363.439 3.753 20 5 FHBDRN Cc1cccc2oc(CCNC(=O)[C@@H]3C[C@H]3c3ccc([N+](=O)[O-])cc3)nc21 ZINC000412160106 941853794 /nfs/dbraw/zinc/85/37/94/941853794.db2.gz PVYDIBXSDXSRHK-JKSUJKDBSA-N 0 0 365.389 3.507 20 5 FHBDRN Cc1n[nH]c(C(=O)N[C@H](C)c2ccc(Oc3ccccc3)cc2)c1[N+](=O)[O-] ZINC000513347856 941860550 /nfs/dbraw/zinc/86/05/50/941860550.db2.gz FMXKTBWLGVAJOU-GFCCVEGCSA-N 0 0 366.377 3.910 20 5 FHBDRN O=C1[C@@H](Nc2ccc(C(F)(F)F)cc2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000433743025 941861074 /nfs/dbraw/zinc/86/10/74/941861074.db2.gz ULOOFRGSDSXGFI-HNNXBMFYSA-N 0 0 365.311 3.831 20 5 FHBDRN CC1(C)CCC[C@H](c2nc(-c3ccc(-n4cncn4)c([N+](=O)[O-])c3)no2)C1 ZINC000453202751 941862462 /nfs/dbraw/zinc/86/24/62/941862462.db2.gz UHUAEKSHOVPULL-ZDUSSCGKSA-N 0 0 368.397 3.909 20 5 FHBDRN Cc1cnc(-c2cccc(NC(=O)c3n[nH]c(C(C)C)c3[N+](=O)[O-])c2)o1 ZINC000433746997 941863156 /nfs/dbraw/zinc/86/31/56/941863156.db2.gz JVKPUXROALBWQT-UHFFFAOYSA-N 0 0 355.354 3.657 20 5 FHBDRN O=C(c1ccc(N2CCCC2)c([N+](=O)[O-])c1)N1CC[C@@H](CC(F)(F)F)C1 ZINC000433736241 941864027 /nfs/dbraw/zinc/86/40/27/941864027.db2.gz QWINUJXSUAQFQG-LBPRGKRZSA-N 0 0 371.359 3.610 20 5 FHBDRN COC(=O)c1cc(NC(=O)c2cccc(SC)c2[N+](=O)[O-])c(C)cc1C ZINC000472820198 941864311 /nfs/dbraw/zinc/86/43/11/941864311.db2.gz ZKOJCFKEDDMOBF-UHFFFAOYSA-N 0 0 374.418 3.972 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N(C)c2ccc(OC)c(Cl)c2)c1 ZINC000549293079 941864317 /nfs/dbraw/zinc/86/43/17/941864317.db2.gz CIPFVPXGOLCVDA-UHFFFAOYSA-N 0 0 364.785 3.932 20 5 FHBDRN CC[C@@H](NC(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-])c1ccc(F)cc1F ZINC000433759787 941872461 /nfs/dbraw/zinc/87/24/61/941872461.db2.gz RWVMCWGKRFXOQX-GFCCVEGCSA-N 0 0 352.341 3.601 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@H](c2ccccc2)[C@H]2CCCO2)c1 ZINC000549295642 941872823 /nfs/dbraw/zinc/87/28/23/941872823.db2.gz XCGGSQAHVUYYSB-RTBURBONSA-N 0 0 370.405 3.644 20 5 FHBDRN COc1ccccc1O[C@@H]1CCCN(Cc2ccc([N+](=O)[O-])cc2OC)C1 ZINC000513370775 941879670 /nfs/dbraw/zinc/87/96/70/941879670.db2.gz KTUFLSSBJGFJIB-QGZVFWFLSA-N 0 0 372.421 3.655 20 5 FHBDRN COc1ccc(CC(=O)N[C@H](C)Cc2ccc(C)cc2C)cc1[N+](=O)[O-] ZINC000517485833 941880272 /nfs/dbraw/zinc/88/02/72/941880272.db2.gz ZGHDQGCAACMTAV-OAHLLOKOSA-N 0 0 356.422 3.510 20 5 FHBDRN Cc1cn([C@@H](C)c2ccccc2)nc1NC(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000472824635 941880280 /nfs/dbraw/zinc/88/02/80/941880280.db2.gz CXRFPFQRBCNKKG-HNNXBMFYSA-N 0 0 364.405 3.890 20 5 FHBDRN CC[C@@H]1CCCC[C@@H]1N(C)C(=O)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC000412186440 941884242 /nfs/dbraw/zinc/88/42/42/941884242.db2.gz SAQBEFYETRGKGG-OCCSQVGLSA-N 0 0 352.406 3.712 20 5 FHBDRN Cc1cn([C@H](C)c2ccccc2)[nH]c1=NC(=O)c1ccc([N+](=O)[O-])cc1F ZINC000472828525 941887370 /nfs/dbraw/zinc/88/73/70/941887370.db2.gz UGWJXXFBPBCZRD-CYBMUJFWSA-N 0 0 368.368 3.522 20 5 FHBDRN C/C(=C\c1cccc([N+](=O)[O-])c1)CNc1ccc(CCS(C)(=O)=O)cc1 ZINC000468611928 941889604 /nfs/dbraw/zinc/88/96/04/941889604.db2.gz OIIALNGROPBWCR-NTCAYCPXSA-N 0 0 374.462 3.697 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CC[C@H](c3ccccc3)C2)c(F)c1N1CCOCC1 ZINC000565224067 941891048 /nfs/dbraw/zinc/89/10/48/941891048.db2.gz ZGZWDWUCXSYKGZ-INIZCTEOSA-N 0 0 371.412 3.564 20 5 FHBDRN C[C@H](NC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)c1ccncc1F ZINC000513383502 941892517 /nfs/dbraw/zinc/89/25/17/941892517.db2.gz QEMFRPZNWMBFKE-QMMMGPOBSA-N 0 0 357.263 3.639 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)NCCCCCOC2CCCCC2)c1[N+](=O)[O-] ZINC000433775996 941892969 /nfs/dbraw/zinc/89/29/69/941892969.db2.gz UPMRTIBNSDBKIG-UHFFFAOYSA-N 0 0 366.462 3.691 20 5 FHBDRN Cc1cc(OCC(=O)N(C)[C@H]2CCCc3ccccc32)ccc1[N+](=O)[O-] ZINC000024521148 941896768 /nfs/dbraw/zinc/89/67/68/941896768.db2.gz NPGRZJVESKJHNL-IBGZPJMESA-N 0 0 354.406 3.818 20 5 FHBDRN CO[C@@H]1CC[C@@H](NC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)C1 ZINC000472833266 941897128 /nfs/dbraw/zinc/89/71/28/941897128.db2.gz NDTCZZZJLGYPNE-IAGOWNOFSA-N 0 0 369.421 3.504 20 5 FHBDRN CN(C)c1nc2ccc(NC(=O)c3cc(Cl)cc([N+](=O)[O-])c3)cc2o1 ZINC000158982766 941899143 /nfs/dbraw/zinc/89/91/43/941899143.db2.gz BNSUIEJVCRGQGN-UHFFFAOYSA-N 0 0 360.757 3.708 20 5 FHBDRN C[C@@H]([C@H]1Cc2ccccc2O1)N(C)C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412201420 941906383 /nfs/dbraw/zinc/90/63/83/941906383.db2.gz QWHGHQXDUKXCGN-RDOJZNBBSA-N 0 0 366.417 3.549 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCC[C@H]([C@@H](O)C(F)(F)F)C2)cc1C(F)(F)F ZINC000433799417 941909440 /nfs/dbraw/zinc/90/94/40/941909440.db2.gz RFKZDRLFGFYWAY-QPUJVOFHSA-N 0 0 372.265 3.753 20 5 FHBDRN CC[C@H](Nc1cc(C)nc(-c2ccc([N+](=O)[O-])cc2)n1)C1CCOCC1 ZINC000074774543 941909595 /nfs/dbraw/zinc/90/95/95/941909595.db2.gz BGWVSIGIHGWIOU-KRWDZBQOSA-N 0 0 356.426 3.977 20 5 FHBDRN CC(C)N(CCc1nccs1)C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412211991 941917700 /nfs/dbraw/zinc/91/77/00/941917700.db2.gz IXZZMICQXHFPLX-JKSUJKDBSA-N 0 0 359.451 3.635 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)Nc1cc(C2(C)CCCC2)on1 ZINC000433824614 941921242 /nfs/dbraw/zinc/92/12/42/941921242.db2.gz BEYMBWWLJCABLJ-UHFFFAOYSA-N 0 0 358.398 3.500 20 5 FHBDRN NC(=O)c1ccc(CSC[C@H]2CCc3ccccc3C2)c([N+](=O)[O-])c1 ZINC000513436154 941921659 /nfs/dbraw/zinc/92/16/59/941921659.db2.gz BMPHSMZGBAHUSW-ZDUSSCGKSA-N 0 0 356.447 3.732 20 5 FHBDRN O=C(N[C@H]1CCO[C@@H]1c1ccc(Cl)cc1)c1ccc([N+](=O)[O-])s1 ZINC000182435890 941925101 /nfs/dbraw/zinc/92/51/01/941925101.db2.gz VSZKNZRIGYDCMP-SMDDNHRTSA-N 0 0 352.799 3.570 20 5 FHBDRN O=[N+]([O-])c1cc2ccccc2nc1NCc1nccn1CCc1ccccc1 ZINC000473528857 941925457 /nfs/dbraw/zinc/92/54/57/941925457.db2.gz HWVUNQWSYNBCOH-UHFFFAOYSA-N 0 0 373.416 3.616 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N[C@@H]1CCCc2cc(N)ccc21 ZINC000415585611 941928231 /nfs/dbraw/zinc/92/82/31/941928231.db2.gz UXFAOKYXWILRRF-MRXNPFEDSA-N 0 0 354.410 3.993 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H]1CCO[C@H]1c1ccc(Cl)cc1 ZINC000182485247 941934141 /nfs/dbraw/zinc/93/41/41/941934141.db2.gz RUEROVZOWQDWNQ-SJORKVTESA-N 0 0 360.797 3.817 20 5 FHBDRN COc1cccc(C2(C(=O)NCCCCc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000513451380 941937622 /nfs/dbraw/zinc/93/76/22/941937622.db2.gz PSRPOPCOLLFLJG-UHFFFAOYSA-N 0 0 368.433 3.774 20 5 FHBDRN COc1ccc(C[C@H](C)CNC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)cc1 ZINC000412225526 941940014 /nfs/dbraw/zinc/94/00/14/941940014.db2.gz WSBYRXOFNTUXQC-PNHOKKKMSA-N 0 0 368.433 3.702 20 5 FHBDRN COCc1ccccc1NC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000182631151 941940718 /nfs/dbraw/zinc/94/07/18/941940718.db2.gz ORZDNXOBBFNKFH-UHFFFAOYSA-N 0 0 352.293 3.595 20 5 FHBDRN O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCCCCO1 ZINC000472849058 941940801 /nfs/dbraw/zinc/94/08/01/941940801.db2.gz MQTFSUXDQXASKJ-UHFFFAOYSA-N 0 0 364.345 3.650 20 5 FHBDRN CO[C@@H](c1ccccc1F)[C@H](C)NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412229622 941942500 /nfs/dbraw/zinc/94/25/00/941942500.db2.gz HVAHYXJTFVCDJL-SPVIKVHDSA-N 0 0 372.396 3.730 20 5 FHBDRN C[C@H](OCC1CC1)C(=O)N(Cc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000075352177 941944615 /nfs/dbraw/zinc/94/46/15/941944615.db2.gz VHFOPSPCLRCKFC-HNNXBMFYSA-N 0 0 354.406 3.943 20 5 FHBDRN O=C(Nc1cccnc1-c1ccccc1)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000182681754 941951575 /nfs/dbraw/zinc/95/15/75/941951575.db2.gz JALWGQIVHCPYEU-UHFFFAOYSA-N 0 0 363.329 3.638 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N(C)[C@@H](C)c2nc3ccccc3s2)c1[N+](=O)[O-] ZINC000433869182 941956534 /nfs/dbraw/zinc/95/65/34/941956534.db2.gz QLZASXJOGJCAHR-JTQLQIEISA-N 0 0 373.438 3.884 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2ccc(C[NH2+]C[C@H]3Cc4ccccc4O3)o2)c1 ZINC000517545158 941958513 /nfs/dbraw/zinc/95/85/13/941958513.db2.gz GBGMTUBUDWTOGI-GOSISDBHSA-N 0 0 350.374 3.948 20 5 FHBDRN COc1cccc(C2=CCN(C(=O)[C@@H]3C[C@H]3c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000412249505 941959439 /nfs/dbraw/zinc/95/94/39/941959439.db2.gz LKWSUIQDHSEOQO-VQTJNVASSA-N 0 0 364.401 3.633 20 5 FHBDRN COc1cc(CN(C#N)c2ccccc2)c([N+](=O)[O-])cc1OCC(F)F ZINC000182748671 941964519 /nfs/dbraw/zinc/96/45/19/941964519.db2.gz UPJKVYFJHDELIH-UHFFFAOYSA-N 0 0 363.320 3.735 20 5 FHBDRN C[C@@H]1C[C@@H](c2cccnc2)N(C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000182814301 941971816 /nfs/dbraw/zinc/97/18/16/941971816.db2.gz PQRHKDDOGNSAKB-PXAZEXFGSA-N 0 0 359.813 3.795 20 5 FHBDRN CSc1ccc(C(=O)N2C[C@H](C)C[C@@H]2c2cccnc2)cc1[N+](=O)[O-] ZINC000182836210 941978729 /nfs/dbraw/zinc/97/87/29/941978729.db2.gz NQVBOVFTGOVQTN-IUODEOHRSA-N 0 0 357.435 3.935 20 5 FHBDRN CN(Cc1cc(F)cc(F)c1)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000433917623 941997272 /nfs/dbraw/zinc/99/72/72/941997272.db2.gz FTDLDIFYCXDUEV-UHFFFAOYSA-N 0 0 369.755 3.868 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])[nH]1)N1CC[C@](F)(c2cccc(C(F)(F)F)c2)C1 ZINC000513533885 942002254 /nfs/dbraw/zinc/00/22/54/942002254.db2.gz UHZHMALSZOUNPS-OAHLLOKOSA-N 0 0 371.290 3.653 20 5 FHBDRN COc1ccc2c(c1)OCC(C(=O)Nc1ccc([N+](=O)[O-])c(Cl)c1)=C2 ZINC001125863191 942011316 /nfs/dbraw/zinc/01/13/16/942011316.db2.gz ROOQZTZNIHVGBY-UHFFFAOYSA-N 0 0 360.753 3.671 20 5 FHBDRN COc1ccc(C(=O)N2CC[C@@](C)(c3ccc(C)cc3)C2)cc1[N+](=O)[O-] ZINC000433952927 942014097 /nfs/dbraw/zinc/01/40/97/942014097.db2.gz YGYQVCOHSWCGRY-HXUWFJFHSA-N 0 0 354.406 3.716 20 5 FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N(C)[C@@H]1CC[C@H](C)C1 ZINC000464467875 942026706 /nfs/dbraw/zinc/02/67/06/942026706.db2.gz DIOHJGWERWMTMW-QWHCGFSZSA-N 0 0 352.456 3.594 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N(C)Cc2cc(Cl)ccc2F)c1 ZINC000433991763 942031516 /nfs/dbraw/zinc/03/15/16/942031516.db2.gz AKTVPFAWXCLOSX-UHFFFAOYSA-N 0 0 352.749 3.668 20 5 FHBDRN CCOC(=O)c1ccnc(N[C@H]2CCO[C@H](C(CC)CC)C2)c1[N+](=O)[O-] ZINC000182969772 942032071 /nfs/dbraw/zinc/03/20/71/942032071.db2.gz PDHYNYCDYADTES-ZFWWWQNUSA-N 0 0 365.430 3.562 20 5 FHBDRN CSc1ccc(C(=O)N(C)Cc2cc(F)cc(F)c2)cc1[N+](=O)[O-] ZINC000433993515 942032791 /nfs/dbraw/zinc/03/27/91/942032791.db2.gz NGOZSLDFMAOKEW-UHFFFAOYSA-N 0 0 352.362 3.867 20 5 FHBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)NC1CCC2(CC2)CC1 ZINC000433995953 942033436 /nfs/dbraw/zinc/03/34/36/942033436.db2.gz XEAIQYWVERVJNX-UHFFFAOYSA-N 0 0 360.457 3.994 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCCOc1ccc(F)c(F)c1 ZINC000085620307 942034549 /nfs/dbraw/zinc/03/45/49/942034549.db2.gz UQKNICAATMNIQS-UHFFFAOYSA-N 0 0 365.336 3.690 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)NC[C@H]2CCC[C@H](C(F)(F)F)C2)c1[N+](=O)[O-] ZINC000434012387 942039084 /nfs/dbraw/zinc/03/90/84/942039084.db2.gz OMXMHEXHROYXMH-UWVGGRQHSA-N 0 0 362.352 3.540 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1-c1nc(-c2ccnc(OCC(F)F)c2)no1 ZINC000545844951 942041329 /nfs/dbraw/zinc/04/13/29/942041329.db2.gz SGMIOXDPQWDMFO-UHFFFAOYSA-N 0 0 362.292 3.659 20 5 FHBDRN CCCc1csc(NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)n1 ZINC000182978402 942043901 /nfs/dbraw/zinc/04/39/01/942043901.db2.gz OHADHIOKIRSUOO-UHFFFAOYSA-N 0 0 357.338 3.858 20 5 FHBDRN Cc1ccn(C2CCN(C(=O)Nc3cccc([N+](=O)[O-])c3Cl)CC2)n1 ZINC000377867718 942046424 /nfs/dbraw/zinc/04/64/24/942046424.db2.gz BCPNAGAVMRSSCB-UHFFFAOYSA-N 0 0 363.805 3.622 20 5 FHBDRN Cc1nn(CCC(=O)N(C)c2cccc3ccccc32)c(C)c1[N+](=O)[O-] ZINC000102238748 942047112 /nfs/dbraw/zinc/04/71/12/942047112.db2.gz WXJIQOLSCDXJPP-UHFFFAOYSA-N 0 0 352.394 3.614 20 5 FHBDRN COc1cc(C(=O)Nc2c(C)cccc2OC(F)F)ccc1[N+](=O)[O-] ZINC000102257497 942047885 /nfs/dbraw/zinc/04/78/85/942047885.db2.gz SFFFUEPNVSBLON-UHFFFAOYSA-N 0 0 352.293 3.766 20 5 FHBDRN COc1ccc(CNC(=O)c2ccc([N+](=O)[O-])cc2F)c(C(F)(F)F)c1 ZINC000102280969 942049421 /nfs/dbraw/zinc/04/94/21/942049421.db2.gz BPTISEGPGYQWSF-UHFFFAOYSA-N 0 0 372.274 3.691 20 5 FHBDRN Cc1c(C(=O)N[C@H]2CC(C)(C)Oc3ccc(N)cc32)cccc1[N+](=O)[O-] ZINC000377884372 942051277 /nfs/dbraw/zinc/05/12/77/942051277.db2.gz NPOPBPZQXOVCRY-HNNXBMFYSA-N 0 0 355.394 3.518 20 5 FHBDRN CCCN(CC1CCCCC1)C(=O)CCn1nc(C)c([N+](=O)[O-])c1C ZINC000102337542 942052588 /nfs/dbraw/zinc/05/25/88/942052588.db2.gz YSTQTWGACQAROM-UHFFFAOYSA-N 0 0 350.463 3.617 20 5 FHBDRN O=C(Nc1ccc(CCO)cc1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000102499125 942065961 /nfs/dbraw/zinc/06/59/61/942065961.db2.gz RAXFYFNRXDYPET-UHFFFAOYSA-N 0 0 369.402 3.505 20 5 FHBDRN COC[C@H](NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)c1ccc(Cl)cc1 ZINC000412287390 942066232 /nfs/dbraw/zinc/06/62/32/942066232.db2.gz KAIRRLVYHFXKLI-KSZLIROESA-N 0 0 374.824 3.856 20 5 FHBDRN Cc1c(CNC(=O)C[C@H](c2ccc(O)cc2)C2CC2)cccc1[N+](=O)[O-] ZINC000412290405 942067100 /nfs/dbraw/zinc/06/71/00/942067100.db2.gz MHNRHZJRNTWNNF-SFHVURJKSA-N 0 0 354.406 3.809 20 5 FHBDRN CCO[C@H](CNC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000412290550 942067498 /nfs/dbraw/zinc/06/74/98/942067498.db2.gz JFVWUQKOAXIZFB-IPMKNSEASA-N 0 0 354.406 3.592 20 5 FHBDRN Cn1ccnc1[C@@H](NCc1ccc(Cl)s1)c1cccc([N+](=O)[O-])c1 ZINC000513662624 942070391 /nfs/dbraw/zinc/07/03/91/942070391.db2.gz YACHUTWNTGLDDP-HNNXBMFYSA-N 0 0 362.842 3.922 20 5 FHBDRN C[C@H](NC(=O)COc1ccc(F)cc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000102600003 942073030 /nfs/dbraw/zinc/07/30/30/942073030.db2.gz ZYCDKJDXULZMLY-JTQLQIEISA-N 0 0 352.749 3.644 20 5 FHBDRN Cc1cccc(NC(=O)C2CC[NH+]([C@@H](C)c3cccc([N+](=O)[O-])c3)CC2)n1 ZINC000053163655 942073455 /nfs/dbraw/zinc/07/34/55/942073455.db2.gz TVDGLXWWUYYFNJ-HNNXBMFYSA-N 0 0 368.437 3.710 20 5 FHBDRN Cc1ccc(NS(=O)(=O)c2cc([N+](=O)[O-])cc(C)c2C)c(Cl)c1 ZINC000015243411 942074726 /nfs/dbraw/zinc/07/47/26/942074726.db2.gz PGISARZXCDXJLE-UHFFFAOYSA-N 0 0 354.815 3.974 20 5 FHBDRN COc1cc(C(=O)N2Cc3cc(C)ccc3CC2(C)C)ccc1[N+](=O)[O-] ZINC000513683717 942075583 /nfs/dbraw/zinc/07/55/83/942075583.db2.gz BJZBICFNWDECRW-UHFFFAOYSA-N 0 0 354.406 3.889 20 5 FHBDRN CC(C)(C)c1ncc(NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)cn1 ZINC000513685575 942075969 /nfs/dbraw/zinc/07/59/69/942075969.db2.gz PBQHISHCQNSISK-UHFFFAOYSA-N 0 0 366.324 3.536 20 5 FHBDRN COCCC1(c2noc(C(F)(F)c3ccc([N+](=O)[O-])cc3)n2)CCC1 ZINC000420516339 942077129 /nfs/dbraw/zinc/07/71/29/942077129.db2.gz XOYFIBZRJAMAFS-UHFFFAOYSA-N 0 0 353.325 3.576 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CCc2cc(Cl)ccc2C1 ZINC000412294294 942077248 /nfs/dbraw/zinc/07/72/48/942077248.db2.gz UXNYJUMVOBUOJU-ZWKOTPCHSA-N 0 0 356.809 3.937 20 5 FHBDRN CCn1ncc(NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)c1C(F)(F)F ZINC000466503380 942077566 /nfs/dbraw/zinc/07/75/66/942077566.db2.gz LXUYCDZEZMFWQQ-UHFFFAOYSA-N 0 0 362.695 3.736 20 5 FHBDRN Cc1cccc(O)c1NC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000183076848 942080272 /nfs/dbraw/zinc/08/02/72/942080272.db2.gz PCGZRDINPPLYSD-UHFFFAOYSA-N 0 0 351.156 3.624 20 5 FHBDRN CC(C)Oc1cc(-c2nc(-c3cn(C)nc3C(C)C)no2)ccc1[N+](=O)[O-] ZINC000420506102 942088099 /nfs/dbraw/zinc/08/80/99/942088099.db2.gz TZVHTPBSHQGYRO-UHFFFAOYSA-N 0 0 371.397 3.956 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)Nc1ccc(F)cc1C(F)(F)F ZINC000102739414 942089710 /nfs/dbraw/zinc/08/97/10/942089710.db2.gz PXKSCBFKGRBSCC-UHFFFAOYSA-N 0 0 358.247 3.770 20 5 FHBDRN CCOc1cc(NC(=O)c2c(Cl)cccc2[N+](=O)[O-])ccc1OC ZINC000110227768 942090595 /nfs/dbraw/zinc/09/05/95/942090595.db2.gz FTYHRBOAFFMKCZ-UHFFFAOYSA-N 0 0 350.758 3.908 20 5 FHBDRN C[C@@H](NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)c1ccc(F)cc1F ZINC000513722825 942097688 /nfs/dbraw/zinc/09/76/88/942097688.db2.gz ADHITVAZUQDKKJ-MRVPVSSYSA-N 0 0 372.274 3.965 20 5 FHBDRN CCOc1ccc2c(c1)CCN(C(=O)c1ccc(CC)c([N+](=O)[O-])c1)C2 ZINC000434090377 942098016 /nfs/dbraw/zinc/09/80/16/942098016.db2.gz GIMLVJWZIGMAHO-UHFFFAOYSA-N 0 0 354.406 3.754 20 5 FHBDRN C[C@@H]1CN(C(=O)c2cccc3c(=O)c4ccccc4[nH]c23)C[C@@H](C2CC2)O1 ZINC000280085834 942099685 /nfs/dbraw/zinc/09/96/85/942099685.db2.gz QLMSSKJGKCEUFT-YJYMSZOUSA-N 0 0 362.429 3.733 20 5 FHBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)Nc1ccc2c(c1)CCN2 ZINC000415873118 942101223 /nfs/dbraw/zinc/10/12/23/942101223.db2.gz YAOQIDCIDNPAMC-UHFFFAOYSA-N 0 0 354.410 3.707 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNc1cccc(NC(=O)N(C)C)c1C ZINC000280108961 942109437 /nfs/dbraw/zinc/10/94/37/942109437.db2.gz VJLVCKNNTHESJR-UHFFFAOYSA-N 0 0 358.398 3.617 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CC(Cc3ccccc3Cl)C2)c1 ZINC000549384380 942110920 /nfs/dbraw/zinc/11/09/20/942110920.db2.gz GDIXNMWVVBQJCS-UHFFFAOYSA-N 0 0 374.824 3.962 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N2CCC[C@@H](C(C)(C)C)C2)c1F ZINC000412302979 942117418 /nfs/dbraw/zinc/11/74/18/942117418.db2.gz FHVLTFHTHUTOEB-GFCCVEGCSA-N 0 0 352.406 3.570 20 5 FHBDRN Cc1ccc([C@H]2OCCC[C@H]2CNc2c(C(N)=O)cccc2[N+](=O)[O-])cc1 ZINC000420593523 942120759 /nfs/dbraw/zinc/12/07/59/942120759.db2.gz BUQFKEKWNHGZJE-HNAYVOBHSA-N 0 0 369.421 3.582 20 5 FHBDRN CCc1c(NC(=O)c2cc(C)cc([N+](=O)[O-])c2)n[nH]c1-c1ccncc1 ZINC000102868838 942123832 /nfs/dbraw/zinc/12/38/32/942123832.db2.gz ZVVNELLGSCTCKE-UHFFFAOYSA-N 0 0 351.366 3.503 20 5 FHBDRN COc1cc(C(=O)N2C[C@@H](C)O[C@@H](c3ccccc3)C2)cc([N+](=O)[O-])c1C ZINC000190102428 942123842 /nfs/dbraw/zinc/12/38/42/942123842.db2.gz AVIDZCMYTCGBQY-BFUOFWGJSA-N 0 0 370.405 3.514 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)NCCCc1c[nH]c2ccc(F)cc12 ZINC000501945855 942126117 /nfs/dbraw/zinc/12/61/17/942126117.db2.gz HZJVLTZKUHOKEX-UHFFFAOYSA-N 0 0 369.396 3.897 20 5 FHBDRN COc1cc(N2CC[C@H](C(F)(F)F)C3(CCOCC3)C2)ccc1[N+](=O)[O-] ZINC000413391311 942128479 /nfs/dbraw/zinc/12/84/79/942128479.db2.gz GBEJBBCOEQFUEO-HNNXBMFYSA-N 0 0 374.359 3.789 20 5 FHBDRN CN(C[C@H](O)Cc1ccccc1)C(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000480882878 942132319 /nfs/dbraw/zinc/13/23/19/942132319.db2.gz ITJXIUQEUWNZQH-QGZVFWFLSA-N 0 0 370.449 3.568 20 5 FHBDRN CO[C@@](C)([C@H](C)NC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-])C1CC1 ZINC000415914762 942139646 /nfs/dbraw/zinc/13/96/46/942139646.db2.gz BSVHCLJOSSGVLX-VFZGTOFNSA-N 0 0 360.332 3.547 20 5 FHBDRN Cc1cc(C(=O)NCCCc2c[nH]c3ccc(F)cc23)cc([N+](=O)[O-])c1 ZINC000501972574 942146227 /nfs/dbraw/zinc/14/62/27/942146227.db2.gz CCYDSRJJBNEKEM-UHFFFAOYSA-N 0 0 355.369 3.886 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N(Cc1ccccc1)C[C@@H]1CCCO1 ZINC000501980660 942149824 /nfs/dbraw/zinc/14/98/24/942149824.db2.gz ALGMGZLQMMKOLT-SFHVURJKSA-N 0 0 354.406 3.725 20 5 FHBDRN C[C@H](Nc1ccc([N+](=O)[O-])cc1Br)[C@H](O)Cc1ccccc1 ZINC000501982436 942151871 /nfs/dbraw/zinc/15/18/71/942151871.db2.gz KOORHONBRBJSRH-MEDUHNTESA-N 0 0 365.227 3.761 20 5 FHBDRN C[C@@H](O)c1ccc(CNC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)cc1 ZINC000178893226 942151881 /nfs/dbraw/zinc/15/18/81/942151881.db2.gz OLEFVTJBSCQURX-SNVBAGLBSA-N 0 0 368.311 3.597 20 5 FHBDRN C[C@H](O)c1ccc(CNC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)cc1 ZINC000178893216 942152349 /nfs/dbraw/zinc/15/23/49/942152349.db2.gz OLEFVTJBSCQURX-JTQLQIEISA-N 0 0 368.311 3.597 20 5 FHBDRN CC(C)c1nnc([C@@H](C)Nc2ccc([N+](=O)[O-])cc2Br)[nH]1 ZINC000501986294 942154057 /nfs/dbraw/zinc/15/40/57/942154057.db2.gz HYIXNPOKWTXASP-MRVPVSSYSA-N 0 0 354.208 3.772 20 5 FHBDRN Cc1nn(Cc2ccccc2)c(Cl)c1Cn1nc(C)c([N+](=O)[O-])c1C ZINC000053161721 942156207 /nfs/dbraw/zinc/15/62/07/942156207.db2.gz PDJVQKREGWEUOR-UHFFFAOYSA-N 0 0 359.817 3.663 20 5 FHBDRN CN(CCCOCc1ccccc1)C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412314675 942166037 /nfs/dbraw/zinc/16/60/37/942166037.db2.gz KMLUVNLFIHPFQY-VQTJNVASSA-N 0 0 368.433 3.764 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)Nc2cc(F)cc(F)c2)cc1SC ZINC000102980643 942166478 /nfs/dbraw/zinc/16/64/78/942166478.db2.gz IUCHNMYENJSZFF-UHFFFAOYSA-N 0 0 354.334 3.856 20 5 FHBDRN C[C@@H](c1ccccc1[N+](=O)[O-])N1C(=O)[C@@H]2CC[C@@H](c3ccccc3)N2C1=O ZINC000280369860 942168835 /nfs/dbraw/zinc/16/88/35/942168835.db2.gz KLXQAARIONQKNS-OWQGQXMQSA-N 0 0 365.389 3.824 20 5 FHBDRN Cc1cc(C(=O)N2CCC[C@@H]2c2nc(C(C)(C)C)no2)ccc1[N+](=O)[O-] ZINC000280361828 942171688 /nfs/dbraw/zinc/17/16/88/942171688.db2.gz TYYZBLDPGFXFMS-CQSZACIVSA-N 0 0 358.398 3.561 20 5 FHBDRN CC[C@@](C)(NC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F)c1nccs1 ZINC000183013224 942175324 /nfs/dbraw/zinc/17/53/24/942175324.db2.gz PUNYKCIBVQUWKJ-OAHLLOKOSA-N 0 0 371.365 3.708 20 5 FHBDRN C[C@@H](NCc1nc2cc([N+](=O)[O-])ccc2o1)c1ccccc1-n1cccn1 ZINC000183152607 942184932 /nfs/dbraw/zinc/18/49/32/942184932.db2.gz PQYCCMVIQYVDHA-CYBMUJFWSA-N 0 0 363.377 3.773 20 5 FHBDRN CC(C)[C@@H]1N(C(=O)N[C@@H](C)c2ccccc2[N+](=O)[O-])CC12CCOCC2 ZINC000413438161 942185960 /nfs/dbraw/zinc/18/59/60/942185960.db2.gz POHWNSVZJQXLLW-YOEHRIQHSA-N 0 0 361.442 3.502 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N1CC[C@H](c2ccccc2OC)C1 ZINC000280458490 942186688 /nfs/dbraw/zinc/18/66/88/942186688.db2.gz OGQOINJHQWIAKR-AWEZNQCLSA-N 0 0 370.405 3.632 20 5 FHBDRN CN(C(=O)COc1ccccc1[N+](=O)[O-])[C@H](c1ccccc1)C(F)(F)F ZINC000103051053 942192790 /nfs/dbraw/zinc/19/27/90/942192790.db2.gz GWLCWXZXSSJRPA-MRXNPFEDSA-N 0 0 368.311 3.736 20 5 FHBDRN O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CC[C@@H](O)[C@H](C2CCCC2)C1 ZINC000413441248 942193692 /nfs/dbraw/zinc/19/36/92/942193692.db2.gz BYTMYFCBISZYAL-XJKSGUPXSA-N 0 0 358.360 3.991 20 5 FHBDRN O=[N+]([O-])c1cc(Br)cnc1NC1CCC(C(F)F)CC1 ZINC000413452737 942206160 /nfs/dbraw/zinc/20/61/60/942206160.db2.gz UMPFCCVJIVZULE-UHFFFAOYSA-N 0 0 350.163 3.988 20 5 FHBDRN Cc1cccc2[nH]cc(CCNC(=O)CCNc3ccccc3[N+](=O)[O-])c21 ZINC000103129035 942212897 /nfs/dbraw/zinc/21/28/97/942212897.db2.gz OMQQPRRJSCVJJM-UHFFFAOYSA-N 0 0 366.421 3.545 20 5 FHBDRN CCN(c1ccccc1F)S(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-] ZINC000480941893 942215795 /nfs/dbraw/zinc/21/57/95/942215795.db2.gz ZHOASSWAUBNKQM-UHFFFAOYSA-N 0 0 352.387 3.566 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N1CC[C@@H](c2ccccc2F)C1 ZINC000502115336 942223403 /nfs/dbraw/zinc/22/34/03/942223403.db2.gz GPRNYIMGDLKXKU-CYBMUJFWSA-N 0 0 358.369 3.762 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H](C)c1c(F)cccc1OC ZINC000122773061 942223399 /nfs/dbraw/zinc/22/33/99/942223399.db2.gz GMQLBNWRDRQEGP-JTQLQIEISA-N 0 0 363.345 3.634 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1)N(Cc1cccc(F)c1)C[C@@H]1CCCO1 ZINC000051190775 942226374 /nfs/dbraw/zinc/22/63/74/942226374.db2.gz QVOWPTIKQUIBFW-SFHVURJKSA-N 0 0 373.384 3.947 20 5 FHBDRN Cc1ccccc1[C@H](CC(F)(F)F)NC(=O)c1ccc([N+](=O)[O-])cn1 ZINC000518295957 942226476 /nfs/dbraw/zinc/22/64/76/942226476.db2.gz IZOPCDLIPDDNCD-AWEZNQCLSA-N 0 0 353.300 3.722 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1)N(Cc1cccc(F)c1)C[C@H]1CCCO1 ZINC000051190776 942226494 /nfs/dbraw/zinc/22/64/94/942226494.db2.gz QVOWPTIKQUIBFW-GOSISDBHSA-N 0 0 373.384 3.947 20 5 FHBDRN CC(C)n1ccc(NC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)n1 ZINC000280669374 942227579 /nfs/dbraw/zinc/22/75/79/942227579.db2.gz XTIFEFROFUCPGE-UHFFFAOYSA-N 0 0 355.301 3.618 20 5 FHBDRN CCC(=O)c1ccc(NCCCc2nnc3n2CCCCC3)c([N+](=O)[O-])c1 ZINC000280717958 942238428 /nfs/dbraw/zinc/23/84/28/942238428.db2.gz LWRIFZHFYNITBZ-UHFFFAOYSA-N 0 0 371.441 3.550 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N[C@H](CCCO)c1ccccc1 ZINC000085637813 942239508 /nfs/dbraw/zinc/23/95/08/942239508.db2.gz XVUZCAPWZLNFEA-MRXNPFEDSA-N 0 0 357.410 3.847 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N[C@H]1CCC[C@H]1OCc1ccccc1 ZINC000122796282 942240900 /nfs/dbraw/zinc/24/09/00/942240900.db2.gz FNHWZAMOZOSZMD-VQTJNVASSA-N 0 0 368.433 3.782 20 5 FHBDRN O=C(NCc1cccc([N+](=O)[O-])c1)N(Cc1ccc(F)cc1F)C1CC1 ZINC000103311308 942244309 /nfs/dbraw/zinc/24/43/09/942244309.db2.gz XVOOCWXIMBLGGC-UHFFFAOYSA-N 0 0 361.348 3.747 20 5 FHBDRN COC(=O)Cc1cccc(NC(=O)c2cc3ccccc3c3cccnc23)n1 ZINC000190100351 942247348 /nfs/dbraw/zinc/24/73/48/942247348.db2.gz NLDQANDMIFZOBP-UHFFFAOYSA-N 0 0 371.396 3.751 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N1CCCC[C@H]1c1noc(C2CC2)n1 ZINC000378073710 942247499 /nfs/dbraw/zinc/24/74/99/942247499.db2.gz GQTBPYYXDBVNNG-INIZCTEOSA-N 0 0 370.409 3.542 20 5 FHBDRN C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1coc(Br)c1 ZINC000103376157 942247959 /nfs/dbraw/zinc/24/79/59/942247959.db2.gz UKASNTJLKJTMFJ-QMMMGPOBSA-N 0 0 351.156 3.542 20 5 FHBDRN O=[N+]([O-])c1cnc(NCC2(c3ccc(Cl)cc3)CCOCC2)c(F)c1 ZINC000413069686 942250729 /nfs/dbraw/zinc/25/07/29/942250729.db2.gz HUAYDPLJLFSBHN-UHFFFAOYSA-N 0 0 365.792 3.943 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N(C[C@@H]1CCCO1)C1CCCC1 ZINC000122840135 942251320 /nfs/dbraw/zinc/25/13/20/942251320.db2.gz QOJFFWRRVJMTEQ-HNNXBMFYSA-N 0 0 363.414 3.559 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)Nc1cccc(-c2nnc(C)o2)c1 ZINC000366378342 942254826 /nfs/dbraw/zinc/25/48/26/942254826.db2.gz MWKMUPMUJYZAOP-UHFFFAOYSA-N 0 0 368.349 3.604 20 5 FHBDRN COc1ccc(C2(CNC(=O)c3ccc([N+](=O)[O-])o3)CCCCC2)cc1 ZINC000502163744 942255589 /nfs/dbraw/zinc/25/55/89/942255589.db2.gz MHBBUEJQIRCGQY-UHFFFAOYSA-N 0 0 358.394 3.828 20 5 FHBDRN CCCCNC(=O)[C@@H]1CC[C@@H](C)N(c2ccc([N+](=O)[O-])c3ncccc23)C1 ZINC000413073588 942259804 /nfs/dbraw/zinc/25/98/04/942259804.db2.gz OOZCSTRYQQJVBU-HUUCEWRRSA-N 0 0 370.453 3.664 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)N[C@H]1CCCc2sccc21 ZINC000502175778 942264986 /nfs/dbraw/zinc/26/49/86/942264986.db2.gz SKVPNTNRLHHXOX-HNNXBMFYSA-N 0 0 359.451 3.918 20 5 FHBDRN C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCC[C@@H](CC(F)(F)F)C1 ZINC000420949637 942271717 /nfs/dbraw/zinc/27/17/17/942271717.db2.gz OWZPVLOTZLHUJE-NEPJUHHUSA-N 0 0 359.348 3.586 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)N(C)[C@@H]2CCCC[C@H]2c2ccccc2)n1 ZINC000416021684 942273447 /nfs/dbraw/zinc/27/34/47/942273447.db2.gz YSHSTEVEBKMALK-JKSUJKDBSA-N 0 0 356.426 3.610 20 5 FHBDRN O=C(Nc1cc(CC2CC2)nn1-c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000502185638 942274582 /nfs/dbraw/zinc/27/45/82/942274582.db2.gz FRDIXXBBVGRNIV-UHFFFAOYSA-N 0 0 362.389 3.985 20 5 FHBDRN CC(C)(C)OC(=O)CC[C@H]1CCCCN1C(=O)c1ccc([N+](=O)[O-])cc1 ZINC000416034102 942282407 /nfs/dbraw/zinc/28/24/07/942282407.db2.gz MRSMXULESWDGQG-OAHLLOKOSA-N 0 0 362.426 3.711 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)Nc2cccc(Cl)c2)cc1OC ZINC000015629828 942290296 /nfs/dbraw/zinc/29/02/96/942290296.db2.gz GGLIRYOCQGZZQF-UHFFFAOYSA-N 0 0 350.758 3.908 20 5 FHBDRN Cc1ccc(S(=O)(=O)N2c3ccccc3SC[C@H]2C)c([N+](=O)[O-])c1 ZINC000434109104 942291924 /nfs/dbraw/zinc/29/19/24/942291924.db2.gz NQOTVVXCKZBSJP-GFCCVEGCSA-N 0 0 364.448 3.593 20 5 FHBDRN CN(C(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@@H]1CCC[C@H]1C(C)(C)C ZINC000419530314 942292217 /nfs/dbraw/zinc/29/22/17/942292217.db2.gz ZBFYJEHSVSJDMZ-CZUORRHYSA-N 0 0 373.457 3.827 20 5 FHBDRN CN(C(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@@H]1CCC[C@@H]1C(C)(C)C ZINC000419530316 942292459 /nfs/dbraw/zinc/29/24/59/942292459.db2.gz ZBFYJEHSVSJDMZ-XJKSGUPXSA-N 0 0 373.457 3.827 20 5 FHBDRN C[C@@H](SCc1cccc(S(C)(=O)=O)c1)c1ccccc1[N+](=O)[O-] ZINC000419511462 942295444 /nfs/dbraw/zinc/29/54/44/942295444.db2.gz CIAVDDCURYEXFT-GFCCVEGCSA-N 0 0 351.449 3.993 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)N1CCC[C@@H]1Cc1cc(F)ccc1F ZINC000416050010 942295806 /nfs/dbraw/zinc/29/58/06/942295806.db2.gz QADMEPBHTQDKIJ-QGZVFWFLSA-N 0 0 360.360 3.649 20 5 FHBDRN C[C@@H]1CN(C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)c2ccc(F)cc2O1 ZINC000413512028 942299735 /nfs/dbraw/zinc/29/97/35/942299735.db2.gz HIRUQEVUOPSGKF-XFBWCDHKSA-N 0 0 356.353 3.652 20 5 FHBDRN C[C@H](NC(=O)Nc1cc(Br)cc([N+](=O)[O-])c1)c1cccnc1 ZINC000501081689 942300275 /nfs/dbraw/zinc/30/02/75/942300275.db2.gz GMZCVSYBGSMONO-VIFPVBQESA-N 0 0 365.187 3.635 20 5 FHBDRN CCSc1ccc([C@H](C)NC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000103631010 942302027 /nfs/dbraw/zinc/30/20/27/942302027.db2.gz RRSAQCDCYMVHNV-LBPRGKRZSA-N 0 0 373.434 3.523 20 5 FHBDRN O=C(CCC(=O)c1ccc(F)cc1F)OCc1ccc([N+](=O)[O-])c(F)c1 ZINC000783079135 942303697 /nfs/dbraw/zinc/30/36/97/942303697.db2.gz DMMXTXAFJUYPPO-UHFFFAOYSA-N 0 0 367.279 3.718 20 5 FHBDRN CSc1cccc(C(=O)NCCCN(C)c2ccccc2)c1[N+](=O)[O-] ZINC000188014317 942305291 /nfs/dbraw/zinc/30/52/91/942305291.db2.gz SJPRJGWQVAXRHV-UHFFFAOYSA-N 0 0 359.451 3.573 20 5 FHBDRN Cc1c(NC(=O)Cc2csc(-c3ccccn3)n2)cccc1[N+](=O)[O-] ZINC000015661254 942307242 /nfs/dbraw/zinc/30/72/42/942307242.db2.gz SRSDJMFVKMCOTI-UHFFFAOYSA-N 0 0 354.391 3.603 20 5 FHBDRN CO[C@@H]1CCC[C@H](C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000513737146 942308787 /nfs/dbraw/zinc/30/87/87/942308787.db2.gz VLWIIFWJVLVPQN-TVQRCGJNSA-N 0 0 357.204 3.501 20 5 FHBDRN Cc1ccc([C@@H](c2ccccn2)N(C)C(=O)c2ccc([N+](=O)[O-])cn2)cc1 ZINC000378137459 942315099 /nfs/dbraw/zinc/31/50/99/942315099.db2.gz GVJQZXUQXIIZAF-IBGZPJMESA-N 0 0 362.389 3.555 20 5 FHBDRN COc1ccc(OCCSCc2nnc(C3CC3)s2)c([N+](=O)[O-])c1 ZINC000419569421 942318688 /nfs/dbraw/zinc/31/86/88/942318688.db2.gz BFMIFGAGCPBJNQ-UHFFFAOYSA-N 0 0 367.452 3.645 20 5 FHBDRN COC(=O)c1cnc(N2C[C@@H](c3ccccc3)C3(CCC3)C2)c([N+](=O)[O-])c1 ZINC000413530336 942318713 /nfs/dbraw/zinc/31/87/13/942318713.db2.gz KHFIWHQRRDCRIU-INIZCTEOSA-N 0 0 367.405 3.551 20 5 FHBDRN Cc1nn(Cc2ccc(C(=O)N3C[C@H](C)[C@@H](C)[C@H]3C)cc2)c(C)c1[N+](=O)[O-] ZINC000416079030 942318730 /nfs/dbraw/zinc/31/87/30/942318730.db2.gz TTWHXZVPYPKGEZ-GZBFAFLISA-N 0 0 370.453 3.573 20 5 FHBDRN CCCN(C(=O)[C@@H]1CN(c2ccccn2)C[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000501135337 942324443 /nfs/dbraw/zinc/32/44/43/942324443.db2.gz OAQWSHZETDQKPQ-CRAIPNDOSA-N 0 0 368.437 3.505 20 5 FHBDRN CC[C@@](C)(NC(=O)c1cc(OC)c(C)c([N+](=O)[O-])c1)c1nc(C)cs1 ZINC000188072585 942326174 /nfs/dbraw/zinc/32/61/74/942326174.db2.gz LXAWDKJGSHLIJT-QGZVFWFLSA-N 0 0 363.439 3.732 20 5 FHBDRN CCOc1cc(Cl)ccc1CNC(=O)c1ccc([N+](=O)[O-])c(OC)c1 ZINC000501140650 942326299 /nfs/dbraw/zinc/32/62/99/942326299.db2.gz HCYNACLFGBHMPX-UHFFFAOYSA-N 0 0 364.785 3.586 20 5 FHBDRN CSc1cccc(C(=O)NCCCOc2ccc(C)cc2)c1[N+](=O)[O-] ZINC000188109695 942331422 /nfs/dbraw/zinc/33/14/22/942331422.db2.gz OLEZMJUSKGWSSF-UHFFFAOYSA-N 0 0 360.435 3.824 20 5 FHBDRN COc1cc(C(=O)N(Cc2ccco2)Cc2ccco2)cc([N+](=O)[O-])c1C ZINC000188096445 942334756 /nfs/dbraw/zinc/33/47/56/942334756.db2.gz WUFIIMRMFMNVIL-UHFFFAOYSA-N 0 0 370.361 3.940 20 5 FHBDRN COc1ccc(NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)c(C)c1 ZINC000513739878 942335337 /nfs/dbraw/zinc/33/53/37/942335337.db2.gz NTRPDQJUJIVKLN-UHFFFAOYSA-N 0 0 352.293 3.766 20 5 FHBDRN CCC(CC)[C@@H]1C[C@@H](NC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)CCO1 ZINC000183224149 942336481 /nfs/dbraw/zinc/33/64/81/942336481.db2.gz UOFDYPBPNOCREF-UGSOOPFHSA-N 0 0 359.426 3.790 20 5 FHBDRN CC(C)NC(=O)[C@@H]1CCC[C@H](Nc2ccc([N+](=O)[O-])c3ncccc23)C1 ZINC000413138997 942338066 /nfs/dbraw/zinc/33/80/66/942338066.db2.gz DKINHDMOHYDZQO-KGLIPLIRSA-N 0 0 356.426 3.638 20 5 FHBDRN CC(C)NC(=O)[C@@H]1CCC[C@H](Nc2nccc3ccc([N+](=O)[O-])cc32)C1 ZINC000413149273 942343779 /nfs/dbraw/zinc/34/37/79/942343779.db2.gz ROXSCLPDWPKJQM-CABCVRRESA-N 0 0 356.426 3.638 20 5 FHBDRN CC(C)NC(=O)[C@H]1CCC[C@H](Nc2ncc([N+](=O)[O-])cc2C(F)(F)F)C1 ZINC000413150506 942344201 /nfs/dbraw/zinc/34/42/01/942344201.db2.gz VEVABCPLUVXXOI-QWRGUYRKSA-N 0 0 374.363 3.504 20 5 FHBDRN Cc1cc(F)cc2c1CN(C(=O)c1ccc([N+](=O)[O-])c3cccnc13)CC2 ZINC000501194979 942345549 /nfs/dbraw/zinc/34/55/49/942345549.db2.gz BRFRMFZDZOERLG-UHFFFAOYSA-N 0 0 365.364 3.789 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(OC2COC2)cc1 ZINC000188144562 942348654 /nfs/dbraw/zinc/34/86/54/942348654.db2.gz RLMZDKZZEXHZSP-HNNXBMFYSA-N 0 0 370.405 3.580 20 5 FHBDRN Cc1nc(-c2cccc(NC(=O)c3c(Cl)cccc3[N+](=O)[O-])c2)no1 ZINC000110250071 942349750 /nfs/dbraw/zinc/34/97/50/942349750.db2.gz KRQYNEGQYJQBKC-UHFFFAOYSA-N 0 0 358.741 3.859 20 5 FHBDRN Cc1cccc(C(=O)N2CCN([C@H](C)c3cccc(F)c3)CC2)c1[N+](=O)[O-] ZINC000103974682 942357547 /nfs/dbraw/zinc/35/75/47/942357547.db2.gz BBGNSLOYVVUXDX-OAHLLOKOSA-N 0 0 371.412 3.561 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@](F)(c3ccccc3C)C2)c1 ZINC000501244505 942358680 /nfs/dbraw/zinc/35/86/80/942358680.db2.gz NUMOGQXORJLCNN-LJQANCHMSA-N 0 0 358.369 3.623 20 5 FHBDRN CCN(CC(=O)Nc1ccc([N+](=O)[O-])cc1C)[C@@H](C)c1cccc(OC)c1 ZINC000072577577 942360922 /nfs/dbraw/zinc/36/09/22/942360922.db2.gz FYWLFCKAJFHSDD-HNNXBMFYSA-N 0 0 371.437 3.933 20 5 FHBDRN Cc1cc(F)cc2c1CN(C(=O)CSc1ccc([N+](=O)[O-])cc1)CC2 ZINC000501253275 942365359 /nfs/dbraw/zinc/36/53/59/942365359.db2.gz WAZFYLDTBDVRRE-UHFFFAOYSA-N 0 0 360.410 3.719 20 5 FHBDRN COc1cccc([C@@H]2C[C@H]2CNC(=O)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000413575514 942368543 /nfs/dbraw/zinc/36/85/43/942368543.db2.gz VDEKEHJDTOQDEG-AXHNFQJDSA-N 0 0 369.421 3.767 20 5 FHBDRN CC(C)c1ccc(CN2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000015766736 942370438 /nfs/dbraw/zinc/37/04/38/942370438.db2.gz AKLXUSOZZGDSRK-UHFFFAOYSA-N 0 0 367.449 3.676 20 5 FHBDRN O=[N+]([O-])c1ccc(NCc2nnc(C3CC3)s2)c(Br)c1 ZINC000413578434 942371313 /nfs/dbraw/zinc/37/13/13/942371313.db2.gz JMNIPWPWROYDME-UHFFFAOYSA-N 0 0 355.217 3.698 20 5 FHBDRN Cn1c(C(=O)N2CCC[C@@H]2Cc2c(F)cccc2Cl)ccc1[N+](=O)[O-] ZINC000502357817 942378422 /nfs/dbraw/zinc/37/84/22/942378422.db2.gz YEFBLGGBIOLYIG-LLVKDONJSA-N 0 0 365.792 3.573 20 5 FHBDRN Cc1ccc(NC(=O)C(=O)N(C)[C@H]2CCC[C@@H]2C(C)(C)C)cc1[N+](=O)[O-] ZINC000419794405 942382396 /nfs/dbraw/zinc/38/23/96/942382396.db2.gz LBDFMFGZUUMEDE-GJZGRUSLSA-N 0 0 361.442 3.515 20 5 FHBDRN O=C(Nc1cc(Br)cc([N+](=O)[O-])c1)c1scnc1C1CC1 ZINC000501299205 942385088 /nfs/dbraw/zinc/38/50/88/942385088.db2.gz AYHBBYPFXAPTCJ-UHFFFAOYSA-N 0 0 368.212 3.944 20 5 FHBDRN Cc1ccc(NC(=O)C(=O)N[C@H](C)c2ccc(C3CC3)cc2)cc1[N+](=O)[O-] ZINC000419788904 942391660 /nfs/dbraw/zinc/39/16/60/942391660.db2.gz BYFOOSPJMGNWDK-CYBMUJFWSA-N 0 0 367.405 3.597 20 5 FHBDRN CS(=O)(=O)CC1(CNc2c(Cl)cc(Cl)cc2[N+](=O)[O-])CCC1 ZINC000413585642 942393219 /nfs/dbraw/zinc/39/32/19/942393219.db2.gz RVQUULGOAOUFHS-UHFFFAOYSA-N 0 0 367.254 3.528 20 5 FHBDRN COc1ccc(C(=O)NCc2ccc(C(F)(F)F)cc2)cc1[N+](=O)[O-] ZINC000016301239 942398585 /nfs/dbraw/zinc/39/85/85/942398585.db2.gz VBPBTKLRFWDMNT-UHFFFAOYSA-N 0 0 354.284 3.552 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2C[C@H](C)C[C@H]2c2cccnc2)c1 ZINC000366812459 942399957 /nfs/dbraw/zinc/39/99/57/942399957.db2.gz XGSFUQASHFPZKW-QAPCUYQASA-N 0 0 369.421 3.677 20 5 FHBDRN COc1cc(NCc2ccc([N+](=O)[O-])cc2Cl)cc(OC)c1OC ZINC000237171329 942402511 /nfs/dbraw/zinc/40/25/11/942402511.db2.gz NQDXPJPCYKMBFW-UHFFFAOYSA-N 0 0 352.774 3.886 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])c2ncccc12)C1=Cc2cc(F)ccc2OC1 ZINC001268849240 942405323 /nfs/dbraw/zinc/40/53/23/942405323.db2.gz HINYWORLZCQRTB-UHFFFAOYSA-N 0 0 365.320 3.697 20 5 FHBDRN C[C@@H](Nc1ccc(C(=O)NC2CC(C)(F)C2)cc1[N+](=O)[O-])c1ccccn1 ZINC000452281054 942405940 /nfs/dbraw/zinc/40/59/40/942405940.db2.gz SESPWKGWBYNANS-RMQJPMRHSA-N 0 0 372.400 3.783 20 5 FHBDRN COC1(CCNC(=O)c2cc([N+](=O)[O-])ccc2SC(C)C)CCC1 ZINC000501337488 942407432 /nfs/dbraw/zinc/40/74/32/942407432.db2.gz FOEGSZZKKMZLJC-UHFFFAOYSA-N 0 0 352.456 3.784 20 5 FHBDRN CCOc1ccc(C(=O)NCc2ccc(C(F)(F)F)cc2)cc1[N+](=O)[O-] ZINC000016301702 942411518 /nfs/dbraw/zinc/41/15/18/942411518.db2.gz NDCUDLMMZATEPV-UHFFFAOYSA-N 0 0 368.311 3.942 20 5 FHBDRN Cc1nnc(-c2cccc(NC(=O)c3c(Cl)cccc3[N+](=O)[O-])c2)n1C ZINC000378216171 942411585 /nfs/dbraw/zinc/41/15/85/942411585.db2.gz COAQIYFVMRYEDB-UHFFFAOYSA-N 0 0 371.784 3.604 20 5 FHBDRN C[C@H](OCCc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])c2ncccc12 ZINC001268854691 942420505 /nfs/dbraw/zinc/42/05/05/942420505.db2.gz ZYFCGJZICXUDPU-AWEZNQCLSA-N 0 0 365.389 3.729 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CNc1ccc2c(c1)C(=O)CCCC2 ZINC000421198069 942422541 /nfs/dbraw/zinc/42/25/41/942422541.db2.gz TVJMHANWRSUCPD-UHFFFAOYSA-N 0 0 367.405 3.863 20 5 FHBDRN CN(Cc1c(Cl)cccc1Cl)c1ccc2ncc([N+](=O)[O-])n2n1 ZINC000502399349 942424184 /nfs/dbraw/zinc/42/41/84/942424184.db2.gz ULZMKHVYXMAXKF-UHFFFAOYSA-N 0 0 352.181 3.581 20 5 FHBDRN CC[C@@H](NCc1nnc(-c2ccncc2F)s1)c1cccc([N+](=O)[O-])c1 ZINC000366825046 942425471 /nfs/dbraw/zinc/42/54/71/942425471.db2.gz JZNOWTPWDQYYBG-OAHLLOKOSA-N 0 0 373.413 3.888 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N2CC[C@@H](C)c3ccccc32)c1F ZINC000413184253 942437654 /nfs/dbraw/zinc/43/76/54/942437654.db2.gz XCXTYOGSXRMDJO-GFCCVEGCSA-N 0 0 358.369 3.825 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CCO[C@@H](c3cccs3)C2)c(C(F)(F)F)c1 ZINC000413186229 942438473 /nfs/dbraw/zinc/43/84/73/942438473.db2.gz BGAQIYQZGNDUIJ-LLVKDONJSA-N 0 0 359.329 3.648 20 5 FHBDRN CC(C)Oc1cc(C(=O)Nc2cccnc2OC(C)C)ccc1[N+](=O)[O-] ZINC000413189199 942439854 /nfs/dbraw/zinc/43/98/54/942439854.db2.gz YKWPVODLTSDKQJ-UHFFFAOYSA-N 0 0 359.382 3.817 20 5 FHBDRN CN(C)C(=O)[C@@H]1CCC[C@H](Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)C1 ZINC000513745412 942442356 /nfs/dbraw/zinc/44/23/56/942442356.db2.gz YOBJTZBHEPVWFJ-MNOVXSKESA-N 0 0 359.348 3.673 20 5 FHBDRN O=C(NC[C@@H]1C[C@H]1C1CCC1)c1sc(Br)cc1[N+](=O)[O-] ZINC000424887787 942444244 /nfs/dbraw/zinc/44/42/44/942444244.db2.gz BEPHHQDUGIEMNU-IUCAKERBSA-N 0 0 359.245 3.585 20 5 FHBDRN O=[N+]([O-])c1ccc(Cc2noc([C@@H]3CC34CC4)n2)c(Br)c1 ZINC000421249292 942455628 /nfs/dbraw/zinc/45/56/28/942455628.db2.gz IUXSROALQLDFHM-JTQLQIEISA-N 0 0 350.172 3.599 20 5 FHBDRN CCC(=O)c1ccc(N2CCCC[C@H]2c2noc(CC)n2)c([N+](=O)[O-])c1 ZINC000366495110 942455727 /nfs/dbraw/zinc/45/57/27/942455727.db2.gz WVJFRDYSGVCELA-AWEZNQCLSA-N 0 0 358.398 3.865 20 5 FHBDRN O=[N+]([O-])c1ccc(Cc2noc([C@H]3CC34CC4)n2)c(Br)c1 ZINC000421249294 942455835 /nfs/dbraw/zinc/45/58/35/942455835.db2.gz IUXSROALQLDFHM-SNVBAGLBSA-N 0 0 350.172 3.599 20 5 FHBDRN O=[N+]([O-])c1ccc2ccnc(N[C@H]3CCOC4(CCSCC4)C3)c2c1 ZINC000413194597 942459750 /nfs/dbraw/zinc/45/97/50/942459750.db2.gz BQRRATQSFHYQAN-AWEZNQCLSA-N 0 0 359.451 4.000 20 5 FHBDRN C[C@@H](O)C[C@@H](CNc1ncc([N+](=O)[O-])cc1C(F)(F)F)c1ccccc1 ZINC000413197612 942460549 /nfs/dbraw/zinc/46/05/49/942460549.db2.gz SABMBQQQIHEASN-YPMHNXCESA-N 0 0 369.343 3.975 20 5 FHBDRN O=[N+]([O-])c1ccc(OC(F)F)c(CN2CCN(c3ccccc3)CC2)c1 ZINC000505315136 942472098 /nfs/dbraw/zinc/47/20/98/942472098.db2.gz VGYJASJWQFTYCS-UHFFFAOYSA-N 0 0 363.364 3.518 20 5 FHBDRN O=[N+]([O-])c1ccc2ccnc(N3CCO[C@]4(CCc5ccccc54)C3)c2c1 ZINC000413204982 942477100 /nfs/dbraw/zinc/47/71/00/942477100.db2.gz PCCDHDNEGWVUOI-OAQYLSRUSA-N 0 0 361.401 3.821 20 5 FHBDRN Cc1csc(Sc2ccc(C(=O)N[C@H]3CC34CC4)cc2[N+](=O)[O-])n1 ZINC000424983584 942487899 /nfs/dbraw/zinc/48/78/99/942487899.db2.gz JNALNARLBBCAAZ-ZDUSSCGKSA-N 0 0 361.448 3.793 20 5 FHBDRN CCn1cc(CC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)c2ccccc21 ZINC000502510707 942488062 /nfs/dbraw/zinc/48/80/62/942488062.db2.gz LAKLBYOXLCOXFR-CQSZACIVSA-N 0 0 351.406 3.989 20 5 FHBDRN Cc1ccc(C2=CCN(C(=O)[C@@H]3C[C@H]3c3ccc([N+](=O)[O-])cc3)CC2)cn1 ZINC000413679097 942491346 /nfs/dbraw/zinc/49/13/46/942491346.db2.gz YIEXKRNFMOFKAT-VQTJNVASSA-N 0 0 363.417 3.718 20 5 FHBDRN O=C(COc1cccc([N+](=O)[O-])c1)N1CCC[C@H]1/C=C/c1ccccc1 ZINC000505373371 942492844 /nfs/dbraw/zinc/49/28/44/942492844.db2.gz SCZMEQVPJMFHOI-FLVLSHQESA-N 0 0 352.390 3.678 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1F)N1CCC[C@H]1/C=C\c1ccccc1 ZINC000505354060 942497196 /nfs/dbraw/zinc/49/71/96/942497196.db2.gz UCRIEWDKOGAKQS-PXAMLJHWSA-N 0 0 354.381 3.981 20 5 FHBDRN CN(CCCc1ccccc1)C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513715523 942501296 /nfs/dbraw/zinc/50/12/96/942501296.db2.gz QFRAJZJCCSRNGL-UHFFFAOYSA-N 0 0 364.348 3.901 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCCOc1ccccc1 ZINC000502526709 942501504 /nfs/dbraw/zinc/50/15/04/942501504.db2.gz OBIRQAIWZSOTTG-UHFFFAOYSA-N 0 0 360.435 3.906 20 5 FHBDRN COc1cc(C(=O)Nc2cc(C(C)(C)C)ccc2O)c([N+](=O)[O-])cc1OC ZINC000616905222 942503731 /nfs/dbraw/zinc/50/37/31/942503731.db2.gz IIIZODATWBUXJQ-UHFFFAOYSA-N 0 0 374.393 3.867 20 5 FHBDRN CCN(C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)c1cccnc1 ZINC000104401988 942504902 /nfs/dbraw/zinc/50/49/02/942504902.db2.gz BFENMKGWYPJWEG-UHFFFAOYSA-N 0 0 354.391 3.780 20 5 FHBDRN O=C(CC1CC(c2ccccc2)C1)N1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1 ZINC000366898405 942506047 /nfs/dbraw/zinc/50/60/47/942506047.db2.gz VVQMIVVPWPXXOP-VJFUWPCTSA-N 0 0 368.437 3.539 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC[C@@H]1c1nccs1 ZINC000366903047 942509419 /nfs/dbraw/zinc/50/94/19/942509419.db2.gz MXGCVJFEYKYRJH-CYBMUJFWSA-N 0 0 362.411 3.819 20 5 FHBDRN COc1cccc(C=C2CCN(C(=O)c3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000472953652 942515027 /nfs/dbraw/zinc/51/50/27/942515027.db2.gz RPZMSPRRUOXNCC-UHFFFAOYSA-N 0 0 352.390 3.923 20 5 FHBDRN CCO[C@@H]1C[C@@H](Nc2ccc([N+](=O)[O-])c3ncccc23)C12CCOCC2 ZINC000413228214 942516049 /nfs/dbraw/zinc/51/60/49/942516049.db2.gz KIDRFGMXSTZPRR-IAGOWNOFSA-N 0 0 357.410 3.529 20 5 FHBDRN Cn1ccnc1[C@@H](NC[C@H]1CC12CCSCC2)c1cccc([N+](=O)[O-])c1 ZINC000421375366 942527033 /nfs/dbraw/zinc/52/70/33/942527033.db2.gz IMHQIFUOUCTJCP-WBVHZDCISA-N 0 0 372.494 3.541 20 5 FHBDRN CN(CCCOc1ccccc1)C(=O)CSCc1ccc([N+](=O)[O-])cc1 ZINC000513815037 942533543 /nfs/dbraw/zinc/53/35/43/942533543.db2.gz LVWGWKOYDFXRLW-UHFFFAOYSA-N 0 0 374.462 3.756 20 5 FHBDRN Cc1ccc(SCCNC(=O)CSc2ccc([N+](=O)[O-])cc2)cc1 ZINC000014803518 942534238 /nfs/dbraw/zinc/53/42/38/942534238.db2.gz QCWBRWRGPRZMDX-UHFFFAOYSA-N 0 0 362.476 3.904 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2C[C@H](C)Oc3c(F)cccc32)ccc1[N+](=O)[O-] ZINC000413729351 942535009 /nfs/dbraw/zinc/53/50/09/942535009.db2.gz UGWRWFRZPFOZFN-LBPRGKRZSA-N 0 0 374.368 3.949 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2C[C@@H](C)Oc3c(F)cccc32)ccc1[N+](=O)[O-] ZINC000413729350 942535391 /nfs/dbraw/zinc/53/53/91/942535391.db2.gz UGWRWFRZPFOZFN-GFCCVEGCSA-N 0 0 374.368 3.949 20 5 FHBDRN C[C@H]1CN(C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)c2cccc(F)c2O1 ZINC000413726045 942535480 /nfs/dbraw/zinc/53/54/80/942535480.db2.gz OTQMUIADPQXYGZ-TUKIKUTGSA-N 0 0 356.353 3.652 20 5 FHBDRN CC(C)c1[nH]nc(C(=O)Nc2cc(Br)ccc2F)c1[N+](=O)[O-] ZINC000434230923 942536071 /nfs/dbraw/zinc/53/60/71/942536071.db2.gz JROSQQAZFFVPQG-UHFFFAOYSA-N 0 0 371.166 3.595 20 5 FHBDRN C[C@H](NC(=O)N[C@@H]1c2ccc(F)cc2O[C@@H]1C)c1ccccc1[N+](=O)[O-] ZINC000501568277 942543341 /nfs/dbraw/zinc/54/33/41/942543341.db2.gz QBAHDZBQYDHVEG-RVPKQNPDSA-N 0 0 359.357 3.616 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)NCc1ccc(Cl)cc1Cl ZINC000014797487 942544475 /nfs/dbraw/zinc/54/44/75/942544475.db2.gz PSQZEGFSVWNRTQ-UHFFFAOYSA-N 0 0 355.177 3.840 20 5 FHBDRN CCS[C@H]1CCC[C@@H](NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000120220423 942546438 /nfs/dbraw/zinc/54/64/38/942546438.db2.gz PCETXZWVFIEZBB-HIFRSBDPSA-N 0 0 361.467 3.799 20 5 FHBDRN O=C(COC/C=C\c1ccccc1)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000513833513 942547901 /nfs/dbraw/zinc/54/79/01/942547901.db2.gz DFRIZBXQOJBNLP-TWGQIWQCSA-N 0 0 352.390 3.604 20 5 FHBDRN CCO[C@H](CCNC(=O)CSc1ccccc1[N+](=O)[O-])C1CCCC1 ZINC000541265013 942548111 /nfs/dbraw/zinc/54/81/11/942548111.db2.gz TXZBUMQNUAAPMO-MRXNPFEDSA-N 0 0 366.483 3.789 20 5 FHBDRN CO[C@H](C)C(=O)Nc1cccc(NC(=O)Nc2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000502568117 942548638 /nfs/dbraw/zinc/54/86/38/942548638.db2.gz FBWUYPSRINJFBM-GFCCVEGCSA-N 0 0 372.381 3.521 20 5 FHBDRN O=C(COc1cccc([N+](=O)[O-])c1)N1CC=C(c2ccc(Cl)cc2)CC1 ZINC000434252399 942550072 /nfs/dbraw/zinc/55/00/72/942550072.db2.gz ZVDRXBJNCFUOGJ-UHFFFAOYSA-N 0 0 372.808 3.943 20 5 FHBDRN CCN(C(=O)c1cc([N+](=O)[O-])c(C)cc1C)c1ccc(OC)c(OC)c1 ZINC000421421285 942551496 /nfs/dbraw/zinc/55/14/96/942551496.db2.gz BLSFKWQLUSLYCN-UHFFFAOYSA-N 0 0 358.394 3.896 20 5 FHBDRN COc1ccc(OC)c([C@H](C)NC(=O)c2cc([N+](=O)[O-])c(C)cc2C)c1 ZINC000421425210 942553692 /nfs/dbraw/zinc/55/36/92/942553692.db2.gz JNGQPIDYTDTMAX-ZDUSSCGKSA-N 0 0 358.394 3.720 20 5 FHBDRN CCCNC(=O)c1cccc(NC(=O)c2cc([N+](=O)[O-])c(C)cc2C)c1 ZINC000421426474 942554314 /nfs/dbraw/zinc/55/43/14/942554314.db2.gz IVCXZGSERIAMBJ-UHFFFAOYSA-N 0 0 355.394 3.604 20 5 FHBDRN Cc1nc([C@H]2CCCOC2)sc1-c1nc(-c2ccccc2[N+](=O)[O-])no1 ZINC000366545805 942557473 /nfs/dbraw/zinc/55/74/73/942557473.db2.gz RCJIKQOJNVGJAN-NSHDSACASA-N 0 0 372.406 3.971 20 5 FHBDRN C[C@@H](CNC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F)CC(F)(F)F ZINC000413751838 942558818 /nfs/dbraw/zinc/55/88/18/942558818.db2.gz VJLHAFYPQSZRAC-SSDOTTSWSA-N 0 0 371.262 3.906 20 5 FHBDRN Cc1ccc([C@@]2(C)CCN(C(=O)NCCc3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000434264073 942560921 /nfs/dbraw/zinc/56/09/21/942560921.db2.gz NKYVKKOIURTDIM-NRFANRHFSA-N 0 0 367.449 3.819 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)N1CCC(F)(c2ccccc2)CC1 ZINC000434266384 942561786 /nfs/dbraw/zinc/56/17/86/942561786.db2.gz LOHATAUJXFFMDP-UHFFFAOYSA-N 0 0 371.412 3.808 20 5 FHBDRN COc1ccc(C(=O)Nc2cnn(CC(C)C)c2C(C)C)cc1[N+](=O)[O-] ZINC000501603670 942564347 /nfs/dbraw/zinc/56/43/47/942564347.db2.gz GSVTZAPXOJGQPP-UHFFFAOYSA-N 0 0 360.414 3.832 20 5 FHBDRN CC(=O)Nc1ccc(NC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)cc1Cl ZINC000014122364 942566288 /nfs/dbraw/zinc/56/62/88/942566288.db2.gz RCLPBDRCVPEOJM-RUDMXATFSA-N 0 0 359.769 3.859 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N[C@H](C)c1ccc2c(c1)CCC(=O)N2 ZINC000421430768 942566783 /nfs/dbraw/zinc/56/67/83/942566783.db2.gz JFUHXUSHLIYFJL-CYBMUJFWSA-N 0 0 367.405 3.587 20 5 FHBDRN CC[C@@H]1C[C@]1(NC(=O)c1cc(OC)ccc1[N+](=O)[O-])c1cccc(C)c1 ZINC000501595336 942568762 /nfs/dbraw/zinc/56/87/62/942568762.db2.gz SFERKPVBPHWMMW-JLTOFOAXSA-N 0 0 354.406 3.967 20 5 FHBDRN CCCn1ccnc1CCCN(C)c1ncc([N+](=O)[O-])cc1C(F)(F)F ZINC000413258979 942569627 /nfs/dbraw/zinc/56/96/27/942569627.db2.gz HDKLFXJAGRBLCZ-UHFFFAOYSA-N 0 0 371.363 3.684 20 5 FHBDRN O=C([O-])C[C@H]([NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)C1CC1 ZINC000756390613 942569823 /nfs/dbraw/zinc/56/98/23/942569823.db2.gz VSFBMJUVLKUIEN-INIZCTEOSA-N 0 0 374.368 3.869 20 5 FHBDRN C[C@@H]1CO[C@@H](C)CN1C(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000501597639 942570114 /nfs/dbraw/zinc/57/01/14/942570114.db2.gz NMRHWNGCYMUYOF-KGLIPLIRSA-N 0 0 372.446 3.995 20 5 FHBDRN CC[C@H](CSc1ccccc1)NC(=O)COc1cccc([N+](=O)[O-])c1 ZINC000501600595 942570397 /nfs/dbraw/zinc/57/03/97/942570397.db2.gz DPFGQWTWYYUMNS-CQSZACIVSA-N 0 0 360.435 3.661 20 5 FHBDRN CO[C@H]1Cc2ccccc2N(Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000502598295 942570756 /nfs/dbraw/zinc/57/07/56/942570756.db2.gz ZFXJZIFCLOGPFK-SFHVURJKSA-N 0 0 365.389 3.828 20 5 FHBDRN COc1cc(CN(C)C(=O)c2cc([N+](=O)[O-])c(C)cc2C)cc(OC)c1 ZINC000421436678 942571491 /nfs/dbraw/zinc/57/14/91/942571491.db2.gz PASVOHGGIVKCDO-UHFFFAOYSA-N 0 0 358.394 3.501 20 5 FHBDRN Cc1cn(CC(=O)OCc2ccc(N(C)C)c([N+](=O)[O-])c2)c2ccccc12 ZINC001268936462 942571679 /nfs/dbraw/zinc/57/16/79/942571679.db2.gz NMLOYOBLSZPHNL-UHFFFAOYSA-N 0 0 367.405 3.667 20 5 FHBDRN CC[C@H](C)Oc1cc(C(=O)OCc2ccc(N(C)C)c([N+](=O)[O-])c2)ccn1 ZINC001268941490 942576051 /nfs/dbraw/zinc/57/60/51/942576051.db2.gz RAEGGGYQORFJSY-ZDUSSCGKSA-N 0 0 373.409 3.590 20 5 FHBDRN Cc1ccccc1C[C@H](C)C(=O)OCc1ccc(N(C)C)c([N+](=O)[O-])c1 ZINC001268943336 942576437 /nfs/dbraw/zinc/57/64/37/942576437.db2.gz YDWYQRDNVXXGHO-HNNXBMFYSA-N 0 0 356.422 3.891 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CCC(OC3CCC3)CC2)ccc1[N+](=O)[O-] ZINC000416263867 942578868 /nfs/dbraw/zinc/57/88/68/942578868.db2.gz AXNGYDQLIBINHD-UHFFFAOYSA-N 0 0 362.426 3.556 20 5 FHBDRN COc1cccc(C2=CCN(C(=O)c3c(Cl)cccc3[N+](=O)[O-])C2)c1 ZINC000501634819 942582088 /nfs/dbraw/zinc/58/20/88/942582088.db2.gz BAFCFSLDWHTRIC-UHFFFAOYSA-N 0 0 358.781 3.796 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N[C@H](c1ccccc1)[C@H]1CCCO1 ZINC000421460250 942582615 /nfs/dbraw/zinc/58/26/15/942582615.db2.gz FWQNQKUAMLZOMC-RTBURBONSA-N 0 0 354.406 3.862 20 5 FHBDRN CCc1ccc([C@H]2COCCN2C(=O)c2cc([N+](=O)[O-])c(C)cc2C)o1 ZINC000421465263 942586283 /nfs/dbraw/zinc/58/62/83/942586283.db2.gz BYEXHGFLTRHJKX-QGZVFWFLSA-N 0 0 358.394 3.581 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2[C@@H](C(F)(F)F)[C@H]21 ZINC000378322314 942588032 /nfs/dbraw/zinc/58/80/32/942588032.db2.gz VUHBCHFEYDLNPT-BIMULSAOSA-N 0 0 360.357 3.730 20 5 FHBDRN COc1ccc(C[C@H](C)NC(=O)c2cc([N+](=O)[O-])c(C)cc2C)cc1OC ZINC000421471361 942590254 /nfs/dbraw/zinc/59/02/54/942590254.db2.gz NZSZOFYGPLWNOY-AWEZNQCLSA-N 0 0 372.421 3.590 20 5 FHBDRN COc1ccccc1[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])c(C)cc2C)C1 ZINC000421475072 942592797 /nfs/dbraw/zinc/59/27/97/942592797.db2.gz MIXVUPKJTXPORI-OAHLLOKOSA-N 0 0 354.406 3.850 20 5 FHBDRN CC(C)n1ncc2c1C[C@H](Nc1nccc3ccc([N+](=O)[O-])cc31)CC2 ZINC000413273439 942595478 /nfs/dbraw/zinc/59/54/78/942595478.db2.gz ZFNYDDBQGUMASA-OAHLLOKOSA-N 0 0 351.410 3.890 20 5 FHBDRN CCCOc1cccc(CCNC(=O)c2ccc(OCC)c([N+](=O)[O-])c2)c1 ZINC000434333345 942599105 /nfs/dbraw/zinc/59/91/05/942599105.db2.gz FDPCWHOGIDQWQJ-UHFFFAOYSA-N 0 0 372.421 3.755 20 5 FHBDRN CC(C)(NC(=O)NCC1(c2ccccc2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000431860981 942600524 /nfs/dbraw/zinc/60/05/24/942600524.db2.gz JYFGMAAYGGQXRC-UHFFFAOYSA-N 0 0 353.422 3.861 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NC[C@H]1CCO[C@H]1c1ccccc1 ZINC000421486272 942602565 /nfs/dbraw/zinc/60/25/65/942602565.db2.gz XEOOEHPCWLRHNI-APWZRJJASA-N 0 0 354.406 3.719 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N(C)[C@@H](C)c1ccc([S@](C)=O)cc1 ZINC000421489439 942603139 /nfs/dbraw/zinc/60/31/39/942603139.db2.gz WAILLUAJGCCTFH-RXBISOJRSA-N 0 0 374.462 3.782 20 5 FHBDRN O=C(c1ccc(OC(F)F)c([N+](=O)[O-])c1)N1CC[C@@H](c2ccccc2)C1 ZINC000513748872 942607286 /nfs/dbraw/zinc/60/72/86/942607286.db2.gz LGNNRCYPFSXUNP-CQSZACIVSA-N 0 0 362.332 3.826 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N[C@H](c1ccccc1)[C@H]1CCOC1 ZINC000421499842 942611145 /nfs/dbraw/zinc/61/11/45/942611145.db2.gz BHDKCDXVKJRSHI-QFBILLFUSA-N 0 0 354.406 3.719 20 5 FHBDRN O=[N+]([O-])c1ccc2ccnc(N[C@@H]3CCCN(CC(F)(F)F)C3)c2c1 ZINC000413294588 942614072 /nfs/dbraw/zinc/61/40/72/942614072.db2.gz GNUUSZLFKGDXPM-GFCCVEGCSA-N 0 0 354.332 3.582 20 5 FHBDRN CO[C@H](C)c1nsc(Oc2ccc(Br)cc2[N+](=O)[O-])n1 ZINC000509537993 942622139 /nfs/dbraw/zinc/62/21/39/942622139.db2.gz CGFVYLCVWUOXEU-ZCFIWIBFSA-N 0 0 360.189 3.709 20 5 FHBDRN CC[C@@H](CSc1ccccc1)NC(=O)c1ccc([N+](=O)[O-])c(OC)c1 ZINC000501719464 942626931 /nfs/dbraw/zinc/62/69/31/942626931.db2.gz QTCNVZMFWOZLFR-AWEZNQCLSA-N 0 0 360.435 3.904 20 5 FHBDRN Cc1n[nH]c(C(=O)N2CCc3cc(Cl)cc(Cl)c3[C@H]2C)c1[N+](=O)[O-] ZINC000434373140 942627698 /nfs/dbraw/zinc/62/76/98/942627698.db2.gz YPIFCVJEGJCCEA-MRVPVSSYSA-N 0 0 369.208 3.693 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N[C@@H]1CCO[C@@H](c2ccccc2)C1 ZINC000421523290 942628045 /nfs/dbraw/zinc/62/80/45/942628045.db2.gz SSHZQPXMXHOCBQ-VQIMIIECSA-N 0 0 354.406 3.862 20 5 FHBDRN COC[C@@H](Cc1ccccc1)N(C)C(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC000421505011 942631057 /nfs/dbraw/zinc/63/10/57/942631057.db2.gz LNHPKWFTODLVIU-QGZVFWFLSA-N 0 0 356.422 3.541 20 5 FHBDRN COc1ccc(CN(CC2CC2)C(=O)c2ccccc2[N+](=O)[O-])c(OC)c1 ZINC000501706834 942631474 /nfs/dbraw/zinc/63/14/74/942631474.db2.gz DJCWWDOTDVBDJI-UHFFFAOYSA-N 0 0 370.405 3.664 20 5 FHBDRN Cc1cc(NC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)cc2n[nH]cc21 ZINC000501731713 942637868 /nfs/dbraw/zinc/63/78/68/942637868.db2.gz YWDBHWRNOUUPEI-NSHDSACASA-N 0 0 356.407 3.899 20 5 FHBDRN Cc1ccccc1[C@H](NC(=O)c1c([N+](=O)[O-])cnn1C)[C@@H]1CCC[C@@H](C)C1 ZINC000501730483 942637874 /nfs/dbraw/zinc/63/78/74/942637874.db2.gz PTPBKAILEIMZPE-DDUZABMNSA-N 0 0 370.453 3.934 20 5 FHBDRN O=[N+]([O-])c1cnc(NC[C@]2(CO)C[C@@H]2c2ccccc2)c(C(F)(F)F)c1 ZINC000413309263 942642360 /nfs/dbraw/zinc/64/23/60/942642360.db2.gz LHJWAHQHQITGJG-ZBFHGGJFSA-N 0 0 367.327 3.587 20 5 FHBDRN CC(C)OCc1nc([C@@H](C)Nc2ccc([N+](=O)[O-])c3ncccc23)no1 ZINC000413309558 942643003 /nfs/dbraw/zinc/64/30/03/942643003.db2.gz LXMNYNUWBMAHSS-LLVKDONJSA-N 0 0 357.370 3.624 20 5 FHBDRN CCOc1cc2c(cc1NC(=O)c1cc([N+](=O)[O-])c(C)cc1C)OCCO2 ZINC000421533883 942643082 /nfs/dbraw/zinc/64/30/82/942643082.db2.gz SIZXMEXLRBEJPU-UHFFFAOYSA-N 0 0 372.377 3.634 20 5 FHBDRN CCN(C(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1)[C@@H]1CCOC(C)(C)C1 ZINC000413821751 942648997 /nfs/dbraw/zinc/64/89/97/942648997.db2.gz JMDIJGVOHLRPLC-OAHLLOKOSA-N 0 0 364.442 3.802 20 5 FHBDRN COc1ccc(CNC(=O)N(C)Cc2cc3ccccc3o2)cc1[N+](=O)[O-] ZINC000472970548 942652177 /nfs/dbraw/zinc/65/21/77/942652177.db2.gz RISLQLKXWDZZGU-UHFFFAOYSA-N 0 0 369.377 3.691 20 5 FHBDRN COCCOCc1ccc(CNc2ccc([N+](=O)[O-])c3ncccc23)cc1 ZINC000413313150 942655771 /nfs/dbraw/zinc/65/57/71/942655771.db2.gz REUKSYUZKQRXDE-UHFFFAOYSA-N 0 0 367.405 3.918 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)cc1 ZINC000513721360 942660847 /nfs/dbraw/zinc/66/08/47/942660847.db2.gz VZNHFPSDQNINKG-NSHDSACASA-N 0 0 350.321 3.996 20 5 FHBDRN O=[N+]([O-])c1cnccc1N1CCO[C@@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000066815601 942661285 /nfs/dbraw/zinc/66/12/85/942661285.db2.gz WPCXKMWOYBFISK-OAHLLOKOSA-N 0 0 354.193 3.875 20 5 FHBDRN Cc1n[nH]c(C(=O)N[C@H](c2cccc(Cl)c2)C2CCCC2)c1[N+](=O)[O-] ZINC000434421638 942663988 /nfs/dbraw/zinc/66/39/88/942663988.db2.gz MNBFFAUQINNHOC-AWEZNQCLSA-N 0 0 362.817 3.941 20 5 FHBDRN CO[C@H](C)C(=O)Nc1cccc(NC(=O)Nc2cccc([N+](=O)[O-])c2C)c1 ZINC000502697439 942664253 /nfs/dbraw/zinc/66/42/53/942664253.db2.gz DTSKHFUYSQSLCY-GFCCVEGCSA-N 0 0 372.381 3.521 20 5 FHBDRN O=[N+]([O-])c1ccc(N[C@@H]2CCO[C@H](c3cccnc3)C2)c2cccnc21 ZINC000413322959 942664372 /nfs/dbraw/zinc/66/43/72/942664372.db2.gz SGSMINMOODZERM-KDOFPFPSSA-N 0 0 350.378 3.870 20 5 FHBDRN COc1cc(NC(=O)Nc2cccc([N+](=O)[O-])c2C)ccc1NC(C)=O ZINC000502698674 942665412 /nfs/dbraw/zinc/66/54/12/942665412.db2.gz KEHGNPQMQSCUAM-UHFFFAOYSA-N 0 0 358.354 3.514 20 5 FHBDRN CNC(=O)c1cnc(/C=C/c2ccc(-c3ccc([N+](=O)[O-])cc3)o2)s1 ZINC000502713040 942678093 /nfs/dbraw/zinc/67/80/93/942678093.db2.gz URWMZJHACBTIHY-VQHVLOKHSA-N 0 0 355.375 3.841 20 5 FHBDRN O=C(NC[C@H]1CC12CCSCC2)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000421591263 942687159 /nfs/dbraw/zinc/68/71/59/942687159.db2.gz PGVIRBGKZWNOOY-LLVKDONJSA-N 0 0 374.384 3.877 20 5 FHBDRN C[C@@H]1C[C@@H](c2noc(-c3ccnc(-c4ccccc4)c3[N+](=O)[O-])n2)CCO1 ZINC000420486807 942690700 /nfs/dbraw/zinc/69/07/00/942690700.db2.gz HJUASWVXTSDMPS-OCCSQVGLSA-N 0 0 366.377 3.989 20 5 FHBDRN Cc1cc(Cc2noc([C@H]3CCc4ccccc4O3)n2)ccc1[N+](=O)[O-] ZINC000420486218 942691413 /nfs/dbraw/zinc/69/14/13/942691413.db2.gz DLYHMOGAGPBNGA-QGZVFWFLSA-N 0 0 351.362 3.943 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)NC[C@@H]2CCC[C@@H]2C2CC2)cc1OC ZINC000413869114 942696136 /nfs/dbraw/zinc/69/61/36/942696136.db2.gz ACZRMXHOGOXTOS-UONOGXRCSA-N 0 0 362.426 3.558 20 5 FHBDRN COc1ccc(NC(=O)c2ccc(OC(F)F)c(F)c2)c([N+](=O)[O-])c1 ZINC000501814331 942708067 /nfs/dbraw/zinc/70/80/67/942708067.db2.gz JANGFKAKVGVOTN-UHFFFAOYSA-N 0 0 356.256 3.596 20 5 FHBDRN CC(C)C[C@H](NC(=O)CN(C)Cc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000501842391 942710985 /nfs/dbraw/zinc/71/09/85/942710985.db2.gz LUAKDGRGEPWFJC-IBGZPJMESA-N 0 0 369.465 3.930 20 5 FHBDRN Cc1nc(CNCc2ccc(-c3ccccc3[N+](=O)[O-])o2)c2n1CCCC2 ZINC000378397216 942715903 /nfs/dbraw/zinc/71/59/03/942715903.db2.gz PYSGLJVKGZJUJE-UHFFFAOYSA-N 0 0 366.421 3.986 20 5 FHBDRN Cc1ccc(-c2noc(-c3ccc(N4CCCC4)c([N+](=O)[O-])c3)n2)nc1C ZINC000420512695 942715962 /nfs/dbraw/zinc/71/59/62/942715962.db2.gz XHJWPQQXBRVHGU-UHFFFAOYSA-N 0 0 365.393 3.924 20 5 FHBDRN O=[N+]([O-])c1cc(-c2nc(-c3ccncn3)no2)ccc1Nc1ccccc1 ZINC000514075810 942720343 /nfs/dbraw/zinc/72/03/43/942720343.db2.gz MGZKIEIBCXMFCS-UHFFFAOYSA-N 0 0 360.333 3.845 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N2CC[C@@H](C3CCCC3)C2)cc1OC ZINC000421654241 942722363 /nfs/dbraw/zinc/72/23/63/942722363.db2.gz KMESDOIFUDWAIW-CQSZACIVSA-N 0 0 362.426 3.654 20 5 FHBDRN CC[C@H](C)[C@@H]1CCCCN1C(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F ZINC001126425560 942724198 /nfs/dbraw/zinc/72/41/98/942724198.db2.gz NDNJQCJADMOHEY-WFASDCNBSA-N 0 0 351.422 3.841 20 5 FHBDRN O=[N+]([O-])c1ccc2ncnc(N3Cc4cccc(Br)c4C3)c2c1 ZINC000613704731 942748650 /nfs/dbraw/zinc/74/86/50/942748650.db2.gz OJHDZRVHSKZXJL-UHFFFAOYSA-N 0 0 371.194 3.821 20 5 FHBDRN CSc1cccc(C(=O)N(C)C2CC(OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000421693703 942748936 /nfs/dbraw/zinc/74/89/36/942748936.db2.gz NRUUVCCKPLTIIF-UHFFFAOYSA-N 0 0 352.456 3.735 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1CN1CCC(C(=O)OC(C)(C)C)CC1 ZINC000514105330 942749065 /nfs/dbraw/zinc/74/90/65/942749065.db2.gz QQJFFIJSEAPVNA-UHFFFAOYSA-N 0 0 364.442 3.547 20 5 FHBDRN CCn1c(S[C@@H](C(=O)OC)C2CC2)nc2cc3ccccc3cc2c1=O ZINC000514109097 942752194 /nfs/dbraw/zinc/75/21/94/942752194.db2.gz JRSGPXVXGBXSMI-QGZVFWFLSA-N 0 0 368.458 3.613 20 5 FHBDRN O=[N+]([O-])c1cnc(N[C@H](CO)c2ccc(Br)cc2)c(Cl)c1 ZINC000502800514 942752619 /nfs/dbraw/zinc/75/26/19/942752619.db2.gz XYRWBKAACBVUAX-GFCCVEGCSA-N 0 0 372.606 3.551 20 5 FHBDRN CC(C)(CNC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1)c1cccnc1 ZINC000413892944 942754981 /nfs/dbraw/zinc/75/49/81/942754981.db2.gz ZVRFEFFHXGLJFR-UHFFFAOYSA-N 0 0 368.437 3.642 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)S(=O)(=O)[C@@H]1C[C@H]1c1ccccc1 ZINC000416383508 942756805 /nfs/dbraw/zinc/75/68/05/942756805.db2.gz DTUVHTRZWOZJFY-RBUKOAKNSA-N 0 0 374.462 3.691 20 5 FHBDRN C[C@]1(CCc2ccccc2)CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2N)C1 ZINC000434590540 942773088 /nfs/dbraw/zinc/77/30/88/942773088.db2.gz ADQODDUYAFYAQO-FQEVSTJZSA-N 0 0 371.412 3.801 20 5 FHBDRN CCCCCn1cc(CNc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)c(C)n1 ZINC000502803228 942773322 /nfs/dbraw/zinc/77/33/22/942773322.db2.gz VSEJSJUZGJVCCE-UHFFFAOYSA-N 0 0 371.441 3.787 20 5 FHBDRN CC1(C)[C@H](c2ccccc2)CCN1C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000421723583 942778639 /nfs/dbraw/zinc/77/86/39/942778639.db2.gz WFNPEWTXWXWOBC-HNNXBMFYSA-N 0 0 368.389 3.732 20 5 FHBDRN COc1ccc2oc(C(=O)Nc3cc([N+](=O)[O-])ccc3OC)c(C)c2c1 ZINC000014197444 942783755 /nfs/dbraw/zinc/78/37/55/942783755.db2.gz AJCFXXOFMNFBCL-UHFFFAOYSA-N 0 0 356.334 3.919 20 5 FHBDRN Cc1nn(Cc2nc(-c3ccc(F)c(C)c3)no2)c2ccc([N+](=O)[O-])cc12 ZINC000502850662 942795836 /nfs/dbraw/zinc/79/58/36/942795836.db2.gz XAUWMPRHHUSKNO-UHFFFAOYSA-N 0 0 367.340 3.799 20 5 FHBDRN Cc1oc(C)c(C(=O)OCC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])c1C ZINC000016541929 942808782 /nfs/dbraw/zinc/80/87/82/942808782.db2.gz JWSGEFKVCRQAFW-UHFFFAOYSA-N 0 0 366.757 3.562 20 5 FHBDRN Cc1csc([C@@H](NC(=O)NC[C@@H](C)c2ccccc2[N+](=O)[O-])C2CC2)n1 ZINC000893244451 942813633 /nfs/dbraw/zinc/81/36/33/942813633.db2.gz OXEBJDTYKCIQRU-BZNIZROVSA-N 0 0 374.466 3.914 20 5 FHBDRN CC(C)[C@H]1C[C@H](CC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)CCO1 ZINC000514188328 942815595 /nfs/dbraw/zinc/81/55/95/942815595.db2.gz CXAMUQDRYMMNFJ-IEBWSBKVSA-N 0 0 362.470 3.875 20 5 FHBDRN O=[N+]([O-])c1cc(C(F)(F)F)ccc1NCc1nccn1CC(F)(F)F ZINC000514191015 942816748 /nfs/dbraw/zinc/81/67/48/942816748.db2.gz UVAHAADHTZQUKM-UHFFFAOYSA-N 0 0 368.237 3.985 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N[C@H](C)c1nc2ccccc2n1C ZINC000421774809 942817056 /nfs/dbraw/zinc/81/70/56/942817056.db2.gz VLUOAWPBIFWGGX-CYBMUJFWSA-N 0 0 352.394 3.589 20 5 FHBDRN Cc1ccc(NC2CCN(C(=O)CCc3ccccc3)CC2)c([N+](=O)[O-])c1 ZINC000514194269 942819678 /nfs/dbraw/zinc/81/96/78/942819678.db2.gz XRMQBVQFFWCASA-UHFFFAOYSA-N 0 0 367.449 3.939 20 5 FHBDRN COc1cc(C(=O)Nc2cc(C3CCCC3)nn2C)cc([N+](=O)[O-])c1C ZINC000190117022 942824951 /nfs/dbraw/zinc/82/49/51/942824951.db2.gz FPPOAQHPPFXZKK-UHFFFAOYSA-N 0 0 358.398 3.555 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1OC(F)F)N1CCC2(C1)CCCCC2 ZINC000182191377 942829938 /nfs/dbraw/zinc/82/99/38/942829938.db2.gz LNJQBMOKDUYFQO-UHFFFAOYSA-N 0 0 354.353 3.993 20 5 FHBDRN O=[N+]([O-])c1cc(C(F)(F)F)ccc1NCc1cccc(-n2cncn2)c1 ZINC000514206943 942830599 /nfs/dbraw/zinc/83/05/99/942830599.db2.gz XDIWJDOKEZCBMU-UHFFFAOYSA-N 0 0 363.299 3.806 20 5 FHBDRN CCCCN(CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])CC(F)(F)F ZINC000502910209 942835015 /nfs/dbraw/zinc/83/50/15/942835015.db2.gz KATIWRVPCHIDQE-UHFFFAOYSA-N 0 0 367.755 3.851 20 5 FHBDRN O=C(NCCOC1CCCCCC1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514226578 942837835 /nfs/dbraw/zinc/83/78/35/942837835.db2.gz JUIARVOZLZGPNM-UHFFFAOYSA-N 0 0 372.368 3.665 20 5 FHBDRN CSc1ccc(C(=O)N2CC=C(c3cnccc3C)CC2)cc1[N+](=O)[O-] ZINC000378515855 942843208 /nfs/dbraw/zinc/84/32/08/942843208.db2.gz WWFDKUHLINXVFY-UHFFFAOYSA-N 0 0 369.446 3.950 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@H](c1ncc(C)s1)C1CC1 ZINC000122950363 942843536 /nfs/dbraw/zinc/84/35/36/942843536.db2.gz QWBLESNGEURGQD-AWEZNQCLSA-N 0 0 362.411 3.641 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CN[C@H](c1cc(F)ccc1F)C(F)F ZINC000434661717 942845309 /nfs/dbraw/zinc/84/53/09/942845309.db2.gz ABPMQUSPOHXGCR-OAHLLOKOSA-N 0 0 358.291 3.978 20 5 FHBDRN Cc1ccccc1[C@@]1(F)CCN([C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000502905084 942845305 /nfs/dbraw/zinc/84/53/05/942845305.db2.gz CUXNPOZYDAPCAI-MGPUTAFESA-N 0 0 371.412 3.801 20 5 FHBDRN CCc1cc(NC(=O)C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)ccc1C ZINC000190182324 942855070 /nfs/dbraw/zinc/85/50/70/942855070.db2.gz GYSROXPNGDGPMY-UHFFFAOYSA-N 0 0 355.394 3.660 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)Nc1cccc([C@@H]2CCC(=O)N2)c1 ZINC000413981103 942860073 /nfs/dbraw/zinc/86/00/73/942860073.db2.gz YUJBSCDBUOPASV-INIZCTEOSA-N 0 0 367.405 3.723 20 5 FHBDRN O=[N+]([O-])c1cccc(CN[C@H](CCO)c2ccccc2Br)c1 ZINC000514246011 942861137 /nfs/dbraw/zinc/86/11/37/942861137.db2.gz GIMGOEVZCCSDHR-MRXNPFEDSA-N 0 0 365.227 3.571 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CC2(CCC2)[C@H]1C1CCOCC1 ZINC000425133794 942864848 /nfs/dbraw/zinc/86/48/48/942864848.db2.gz RYVNHSDLHYKSLX-IPMKNSEASA-N 0 0 370.449 3.506 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CC2(CCC2)[C@@H]1C1CCOCC1 ZINC000425133795 942865020 /nfs/dbraw/zinc/86/50/20/942865020.db2.gz RYVNHSDLHYKSLX-OTWHNJEPSA-N 0 0 370.449 3.506 20 5 FHBDRN COC(=O)c1cccc(Cl)c1COc1cc([N+](=O)[O-])ccc1OC ZINC000505472963 942869339 /nfs/dbraw/zinc/86/93/39/942869339.db2.gz FJXALNOJDJWKFO-UHFFFAOYSA-N 0 0 351.742 3.622 20 5 FHBDRN CN(CC1(O)CCCC1)C(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000502957154 942875974 /nfs/dbraw/zinc/87/59/74/942875974.db2.gz QRSUARKQRHRGIL-UHFFFAOYSA-N 0 0 369.421 3.716 20 5 FHBDRN Cc1cc(C)cc(OCCC(=O)N2CCCc3ccc([N+](=O)[O-])cc32)c1 ZINC000509981754 942891029 /nfs/dbraw/zinc/89/10/29/942891029.db2.gz JPXDLBOOGODXKV-UHFFFAOYSA-N 0 0 354.406 3.960 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])N1CCC[C@H](CC(F)(F)F)C1 ZINC000421939936 942896801 /nfs/dbraw/zinc/89/68/01/942896801.db2.gz MDLSVOQVLBRFPD-GFCCVEGCSA-N 0 0 360.332 3.555 20 5 FHBDRN CCCN(C(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-])[C@@H]1CCc2ccccc2C1 ZINC000434184041 942900345 /nfs/dbraw/zinc/90/03/45/942900345.db2.gz QHSGCGBATYSNRC-MRXNPFEDSA-N 0 0 370.453 3.851 20 5 FHBDRN O=C(c1cc(-c2ccc([N+](=O)[O-])cc2)n[nH]1)N1CC[C@@H](C2CCCC2)C1 ZINC000421947781 942901286 /nfs/dbraw/zinc/90/12/86/942901286.db2.gz KDDVYSBELKDBAN-OAHLLOKOSA-N 0 0 354.410 3.637 20 5 FHBDRN CC[C@@H]1Cc2ccccc2CN1C(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000183836184 942901524 /nfs/dbraw/zinc/90/15/24/942901524.db2.gz XARMTILJJGZAIL-OAHLLOKOSA-N 0 0 370.405 3.589 20 5 FHBDRN Cc1c(Br)cc(C(=O)NCC2CCSCC2)cc1[N+](=O)[O-] ZINC000509994970 942906295 /nfs/dbraw/zinc/90/62/95/942906295.db2.gz OPPRJKVKNRPGKS-UHFFFAOYSA-N 0 0 373.272 3.539 20 5 FHBDRN COc1cc(C(=O)N[C@H](c2ccccc2)c2ccncc2)ccc1[N+](=O)[O-] ZINC000133703734 942906587 /nfs/dbraw/zinc/90/65/87/942906587.db2.gz XODYLKXSWKSVRH-LJQANCHMSA-N 0 0 363.373 3.518 20 5 FHBDRN CC[C@@H]1CN(C(=O)c2cccc3c(=O)c4ccccc4[nH]c23)C[C@H](CC)O1 ZINC000421961153 942909057 /nfs/dbraw/zinc/90/90/57/942909057.db2.gz FTUIANXIGGGYMW-GASCZTMLSA-N 0 0 364.445 3.711 20 5 FHBDRN Cc1occc1C(=O)NC1CCN(c2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000066817167 942909378 /nfs/dbraw/zinc/90/93/78/942909378.db2.gz OVZJRNRQAIYNMJ-UHFFFAOYSA-N 0 0 363.801 3.548 20 5 FHBDRN CC[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)C[C@H](CC)O1 ZINC000421973985 942911661 /nfs/dbraw/zinc/91/16/61/942911661.db2.gz LDKJSMGMVBCXEO-TXEJJXNPSA-N 0 0 360.332 3.643 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(C)c(C(N)=O)c1 ZINC000503026601 942918107 /nfs/dbraw/zinc/91/81/07/942918107.db2.gz NQWOUMFJRFYBRX-UHFFFAOYSA-N 0 0 373.434 3.757 20 5 FHBDRN O=C(NCCNc1ccc([N+](=O)[O-])cc1)c1cc(Cl)ccc1Cl ZINC000008175015 942919024 /nfs/dbraw/zinc/91/90/24/942919024.db2.gz IYDZDODEIRADGX-UHFFFAOYSA-N 0 0 354.193 3.744 20 5 FHBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@H](C)C[C@@H](CO)C1 ZINC000421990897 942926710 /nfs/dbraw/zinc/92/67/10/942926710.db2.gz WBUQHJKORCLNAM-ZIAGYGMSSA-N 0 0 366.483 3.578 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)NCCCC1(O)CCC1 ZINC000421995497 942928872 /nfs/dbraw/zinc/92/88/72/942928872.db2.gz RPMYCFAENFTNKV-UHFFFAOYSA-N 0 0 352.456 3.520 20 5 FHBDRN Cc1ccc(-c2nnc([C@@H](C)Oc3ccc([N+](=O)[O-])c(CO)c3)o2)cc1C ZINC000431884507 942931137 /nfs/dbraw/zinc/93/11/37/942931137.db2.gz PQYRFZBTPBXLKO-CYBMUJFWSA-N 0 0 369.377 3.894 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CNc1c(C)c(C)ccc1Cl ZINC000434741295 942934502 /nfs/dbraw/zinc/93/45/02/942934502.db2.gz DHEPCTPULHDXLS-UHFFFAOYSA-N 0 0 363.801 3.924 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)NCCc1ccc(F)c(F)c1F ZINC000544230702 942934528 /nfs/dbraw/zinc/93/45/28/942934528.db2.gz SYLIRSLUIWUQJL-UHFFFAOYSA-N 0 0 353.300 3.685 20 5 FHBDRN CCC[C@H](CC(=O)OCC)Oc1cccc([N+](=O)[O-])c1Br ZINC001225756175 942945981 /nfs/dbraw/zinc/94/59/81/942945981.db2.gz ABAXCFLFYRWFAX-SNVBAGLBSA-N 0 0 360.204 3.858 20 5 FHBDRN COc1cc(C(=O)NCCCC(C)(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000126365415 942950516 /nfs/dbraw/zinc/95/05/16/942950516.db2.gz BPLFSIQAAAJAOI-UHFFFAOYSA-N 0 0 360.357 3.761 20 5 FHBDRN COCCN(Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)CC(F)(F)F ZINC000549446635 942951097 /nfs/dbraw/zinc/95/10/97/942951097.db2.gz XGKQKWHLDNZIIL-UHFFFAOYSA-N 0 0 360.254 3.624 20 5 FHBDRN COC(=O)[C@@H]1CC[C@@H](c2ccccc2)N1Cc1c(F)cccc1[N+](=O)[O-] ZINC000434794679 942972414 /nfs/dbraw/zinc/97/24/14/942972414.db2.gz LGBWFJZWFPEUPM-WMZOPIPTSA-N 0 0 358.369 3.613 20 5 FHBDRN COc1ccc(NC(=O)c2ccc([N+](=O)[O-])c(OC)c2)c(C(F)(F)F)c1 ZINC000503107902 942977938 /nfs/dbraw/zinc/97/79/38/942977938.db2.gz NKWMKKYCFHUVJM-UHFFFAOYSA-N 0 0 370.283 3.883 20 5 FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCC(C)(C)C1 ZINC000509958682 942981834 /nfs/dbraw/zinc/98/18/34/942981834.db2.gz PSDVFOMSNBDQIN-LBPRGKRZSA-N 0 0 352.456 3.642 20 5 FHBDRN COc1cc(C2(C(=O)NCc3ccccc3[N+](=O)[O-])CCC2)ccc1C ZINC000503094758 942983355 /nfs/dbraw/zinc/98/33/55/942983355.db2.gz QGRXLSSIPFCBOK-UHFFFAOYSA-N 0 0 354.406 3.650 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)c1cnn(C)c1C ZINC000503117564 942986349 /nfs/dbraw/zinc/98/63/49/942986349.db2.gz NQFWHNNDLJWLQN-LLVKDONJSA-N 0 0 362.455 3.630 20 5 FHBDRN CC(C)(C(=O)Nc1cccc(-c2cc[nH]n2)c1)c1ccccc1[N+](=O)[O-] ZINC000431891300 942994434 /nfs/dbraw/zinc/99/44/34/942994434.db2.gz KGDAMQPHXJZOEY-UHFFFAOYSA-N 0 0 350.378 3.901 20 5 FHBDRN O=Cc1cc([N+](=O)[O-])ccc1OCc1nc(-c2ccc(Cl)cc2)no1 ZINC000016655397 943000633 /nfs/dbraw/zinc/00/06/33/943000633.db2.gz IKEJJVLZVOCYMF-UHFFFAOYSA-N 0 0 359.725 3.690 20 5 FHBDRN CCN(C(=O)CCCNc1ccc([N+](=O)[O-])cc1)c1cccc(OC)c1 ZINC000505545801 943004891 /nfs/dbraw/zinc/00/48/91/943004891.db2.gz XZOJVNDTBXOSAR-UHFFFAOYSA-N 0 0 357.410 3.849 20 5 FHBDRN CC(C)NC(=O)c1ccc(N[C@@H](c2cnn(C)c2)C(C)(C)C)c([N+](=O)[O-])c1 ZINC000425241387 943032098 /nfs/dbraw/zinc/03/20/98/943032098.db2.gz QEQAEXLTXBHMQB-KRWDZBQOSA-N 0 0 373.457 3.666 20 5 FHBDRN Cc1cc(NC(=O)c2cncc(OC(C)C)c2)c2cc([N+](=O)[O-])ccc2n1 ZINC000183692567 943035490 /nfs/dbraw/zinc/03/54/90/943035490.db2.gz NHRYISPLJFVWFO-UHFFFAOYSA-N 0 0 366.377 3.886 20 5 FHBDRN C[C@H]1c2ccccc2CCN1c1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-] ZINC000425238394 943041449 /nfs/dbraw/zinc/04/14/49/943041449.db2.gz UWPAOFFBPZRHQB-ZDUSSCGKSA-N 0 0 351.406 3.611 20 5 FHBDRN CCOC(=O)c1cc(N[C@H](c2cnn(C)c2)C(C)(C)C)ccc1[N+](=O)[O-] ZINC000425239825 943046188 /nfs/dbraw/zinc/04/61/88/943046188.db2.gz OKDSQFRYGYTHJE-MRXNPFEDSA-N 0 0 360.414 3.704 20 5 FHBDRN C[C@@H](c1ccco1)N(C)C(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000120255017 943054096 /nfs/dbraw/zinc/05/40/96/943054096.db2.gz HDAHGWKAYPCEQO-JTQLQIEISA-N 0 0 372.299 3.962 20 5 FHBDRN Cc1c(CNC(=O)NC[C@H](c2ccccc2)C2CC2)cccc1[N+](=O)[O-] ZINC000431898119 943057979 /nfs/dbraw/zinc/05/79/79/943057979.db2.gz JYELCEZISWHHAY-GOSISDBHSA-N 0 0 353.422 3.896 20 5 FHBDRN Cc1cc(NC(=O)c2cc([N+](=O)[O-])cnc2C)cnc1N1CCCC[C@H]1C ZINC000503206124 943058882 /nfs/dbraw/zinc/05/88/82/943058882.db2.gz DSNZVZWZPBDOOF-CYBMUJFWSA-N 0 0 369.425 3.633 20 5 FHBDRN O=C(COc1ccccc1[N+](=O)[O-])NCc1cccc(Cl)c1Cl ZINC000514495259 943063266 /nfs/dbraw/zinc/06/32/66/943063266.db2.gz WKTXPYNMBQCCCG-UHFFFAOYSA-N 0 0 355.177 3.597 20 5 FHBDRN O=C1CCc2cc([N+](=O)[O-])c(NCC3(Cc4ccccc4)CC3)cc2N1 ZINC000434954504 943070892 /nfs/dbraw/zinc/07/08/92/943070892.db2.gz INVJOICIZCXVRO-UHFFFAOYSA-N 0 0 351.406 3.914 20 5 FHBDRN CO[C@@H](CNC(=O)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1)CC(C)C ZINC000416752617 943076034 /nfs/dbraw/zinc/07/60/34/943076034.db2.gz VVWHFUMAXRNIDU-SJLPKXTDSA-N 0 0 363.458 3.545 20 5 FHBDRN CC(C)NC(=O)c1ccc(N[C@@H](C)c2ccc(Cl)cn2)c([N+](=O)[O-])c1 ZINC000425257144 943078081 /nfs/dbraw/zinc/07/80/81/943078081.db2.gz HSDXFVDZJZTWHH-NSHDSACASA-N 0 0 362.817 3.955 20 5 FHBDRN CC(C)(C)OC(=O)CCCCCNc1nc2sccn2c1[N+](=O)[O-] ZINC000503251746 943086104 /nfs/dbraw/zinc/08/61/04/943086104.db2.gz CFRRFPYWZHBIGY-UHFFFAOYSA-N 0 0 354.432 3.618 20 5 FHBDRN O=C(Nc1ccnn1-c1cccc(F)c1)c1ccc([N+](=O)[O-])cc1Cl ZINC000183902329 943087165 /nfs/dbraw/zinc/08/71/65/943087165.db2.gz YCVMPXPODMJOKB-UHFFFAOYSA-N 0 0 360.732 3.825 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCc1ccc(F)cc1F ZINC000514532417 943088845 /nfs/dbraw/zinc/08/88/45/943088845.db2.gz QQVPCIGRWXNRHC-SNVBAGLBSA-N 0 0 352.362 3.670 20 5 FHBDRN COC(=O)c1cc(C(=O)N(Cc2ccccc2F)C(C)C)cc([N+](=O)[O-])c1 ZINC000514534121 943091125 /nfs/dbraw/zinc/09/11/25/943091125.db2.gz QUCIBACAUVAKQJ-UHFFFAOYSA-N 0 0 374.368 3.571 20 5 FHBDRN C[C@@H](CCc1ccccc1[N+](=O)[O-])NCc1noc(-c2ccccc2F)n1 ZINC000435031247 943114254 /nfs/dbraw/zinc/11/42/54/943114254.db2.gz ZFSHAZDLPRWHIU-ZDUSSCGKSA-N 0 0 370.384 3.895 20 5 FHBDRN O=C(N[C@@H]1C[C@H]1c1ccccc1C(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000505594363 943126451 /nfs/dbraw/zinc/12/64/51/943126451.db2.gz SQUVVQMKSOKEEA-DZGCQCFKSA-N 0 0 350.296 3.900 20 5 FHBDRN CC1(NC(=O)NCCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCCC1 ZINC000503349657 943133067 /nfs/dbraw/zinc/13/30/67/943133067.db2.gz WPIYWXVERQQAIL-UHFFFAOYSA-N 0 0 374.363 3.657 20 5 FHBDRN Cc1c(F)ccc([N+](=O)[O-])c1C(=O)OCc1nc(C(F)(F)F)cs1 ZINC001269261358 943138582 /nfs/dbraw/zinc/13/85/82/943138582.db2.gz SEVKODFMAWAKCX-UHFFFAOYSA-N 0 0 364.276 3.875 20 5 FHBDRN CN(CCn1ccc([N+](=O)[O-])n1)[C@@H](c1ccc(Cl)cc1)c1ccccn1 ZINC000365840389 943139939 /nfs/dbraw/zinc/13/99/39/943139939.db2.gz MWSZRNJIYBMQFT-SFHVURJKSA-N 0 0 371.828 3.561 20 5 FHBDRN O=[N+]([O-])c1cccc(F)c1COc1cccc(I)c1 ZINC000505597500 943146819 /nfs/dbraw/zinc/14/68/19/943146819.db2.gz RGJQXYFCOCNFNS-UHFFFAOYSA-N 0 0 373.121 3.918 20 5 FHBDRN CCc1cnc(CNC(=O)c2cc([N+](=O)[O-])ccc2SCC(C)C)o1 ZINC000505602215 943161012 /nfs/dbraw/zinc/16/10/12/943161012.db2.gz LEBNTULIZDXSGA-UHFFFAOYSA-N 0 0 363.439 3.823 20 5 FHBDRN O=C([C@@H]1[C@H]2CCCO[C@H]21)N(Cc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000503406166 943165445 /nfs/dbraw/zinc/16/54/45/943165445.db2.gz WPAYIYRASRNPLB-GUDVDZBRSA-N 0 0 352.390 3.553 20 5 FHBDRN Cc1cccc(C)c1OCCCNc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 ZINC000505605291 943169280 /nfs/dbraw/zinc/16/92/80/943169280.db2.gz FVVPYDCKNMPSFD-UHFFFAOYSA-N 0 0 369.421 3.977 20 5 FHBDRN Cc1cc(N[C@@H]2CCO[C@H]2c2cnn(C)c2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000425279346 943173267 /nfs/dbraw/zinc/17/32/67/943173267.db2.gz FNTMCSDBNBCJOK-DOMZBBRYSA-N 0 0 370.331 3.598 20 5 FHBDRN Cc1cccc(C(=O)N2CCC(C(=O)c3ccccc3)CC2)c1[N+](=O)[O-] ZINC000014410622 943178751 /nfs/dbraw/zinc/17/87/51/943178751.db2.gz FGFAXGATSYMQDB-UHFFFAOYSA-N 0 0 352.390 3.638 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000503424035 943186670 /nfs/dbraw/zinc/18/66/70/943186670.db2.gz VXXWILORHMOOCA-APHBMKBZSA-N 0 0 364.467 3.640 20 5 FHBDRN Cc1ccc([C@@H]2CCN(C(=O)COc3ccc([N+](=O)[O-])c(C)c3)C2)cc1 ZINC000514646856 943192275 /nfs/dbraw/zinc/19/22/75/943192275.db2.gz NLJXFOZLLIDJPM-QGZVFWFLSA-N 0 0 354.406 3.607 20 5 FHBDRN CC(C)(NC(=O)c1csc(C(F)(F)F)n1)c1ccccc1[N+](=O)[O-] ZINC000514683817 943199872 /nfs/dbraw/zinc/19/98/72/943199872.db2.gz HLWBAFSKEKETKO-UHFFFAOYSA-N 0 0 359.329 3.735 20 5 FHBDRN CCOC(=O)c1cc(C(=O)N[C@@H](C)[C@@H](C)c2ccccc2)cc([N+](=O)[O-])c1 ZINC000473552255 943204489 /nfs/dbraw/zinc/20/44/89/943204489.db2.gz YLQKDWOKUYTQKI-KGLIPLIRSA-N 0 0 370.405 3.694 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)/C=C\Sc1ccccc1 ZINC000214970357 943217536 /nfs/dbraw/zinc/21/75/36/943217536.db2.gz WACABEMAJNCNTN-KTKRTIGZSA-N 0 0 372.402 3.691 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N[C@H]1CCN(c2ccc(F)cc2)C1 ZINC000416922999 943219910 /nfs/dbraw/zinc/21/99/10/943219910.db2.gz PYMDUYSZAANSSM-HNNXBMFYSA-N 0 0 372.400 3.751 20 5 FHBDRN CCSc1nnc(SCc2cc(OC)c(F)cc2[N+](=O)[O-])s1 ZINC000183821362 943235607 /nfs/dbraw/zinc/23/56/07/943235607.db2.gz UHYRPRGVSZJEBZ-UHFFFAOYSA-N 0 0 361.445 3.998 20 5 FHBDRN Cc1ccc(-c2csc(NC(=O)c3ccc([N+](=O)[O-])n3C)n2)c(C)c1 ZINC000514708905 943237801 /nfs/dbraw/zinc/23/78/01/943237801.db2.gz VMTKPHHOIJICSQ-UHFFFAOYSA-N 0 0 356.407 3.926 20 5 FHBDRN O=C(N[C@H]1CCC[C@@H](c2nc3ccccc3[nH]2)C1)c1ccc([N+](=O)[O-])o1 ZINC000514728433 943256677 /nfs/dbraw/zinc/25/66/77/943256677.db2.gz VELDNIINOKAQJW-NEPJUHHUSA-N 0 0 354.366 3.520 20 5 FHBDRN O=[N+]([O-])c1cccc(S(=O)(=O)N2CCC(CCc3ccccc3)CC2)c1 ZINC000514767245 943277443 /nfs/dbraw/zinc/27/74/43/943277443.db2.gz WYCOPRARYFVDKF-UHFFFAOYSA-N 0 0 374.462 3.628 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](CC)[C@H]1CCCO1 ZINC000503616790 943302571 /nfs/dbraw/zinc/30/25/71/943302571.db2.gz IXUAFLUWUIPEEG-LSDHHAIUSA-N 0 0 352.456 3.784 20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])N1CCCc2c(F)cc(F)cc21 ZINC000514811425 943308602 /nfs/dbraw/zinc/30/86/02/943308602.db2.gz RQVFLPHUCYJTEY-UHFFFAOYSA-N 0 0 361.348 3.654 20 5 FHBDRN CSc1cc(C)ccc1NCC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000417054208 943314112 /nfs/dbraw/zinc/31/41/12/943314112.db2.gz IGJSIHJYXRNOLQ-UHFFFAOYSA-N 0 0 357.435 3.626 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N1C[C@@H](O)C[C@@H]1c1ccccc1 ZINC000417045427 943315302 /nfs/dbraw/zinc/31/53/02/943315302.db2.gz RFVOPFRAVRIKMO-MAUKXSAKSA-N 0 0 355.394 3.551 20 5 FHBDRN CCOc1ccc(C(=O)NCC2(Cc3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000435297356 943318292 /nfs/dbraw/zinc/31/82/92/943318292.db2.gz VGIBWBFLMXGJGN-UHFFFAOYSA-N 0 0 354.406 3.746 20 5 FHBDRN Cc1c(NC(=O)N[C@@H]2CCCSC2)cc(Br)cc1[N+](=O)[O-] ZINC000435322433 943323305 /nfs/dbraw/zinc/32/33/05/943323305.db2.gz CQJMAVXAFCCLEU-SNVBAGLBSA-N 0 0 374.260 3.683 20 5 FHBDRN Cc1c(NC(=O)N[C@@H]2CS[C@@H](C)C2)cc(Br)cc1[N+](=O)[O-] ZINC000417075080 943328999 /nfs/dbraw/zinc/32/89/99/943328999.db2.gz LPBSUDIXTLQCIZ-XVKPBYJWSA-N 0 0 374.260 3.681 20 5 FHBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1CNc1cccc2c1CN(C)C2=O ZINC000417074969 943329012 /nfs/dbraw/zinc/32/90/12/943329012.db2.gz ZUJGAKPBYVNIOY-UHFFFAOYSA-N 0 0 355.394 3.580 20 5 FHBDRN C[C@@H](NC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(-n2cccn2)cc1 ZINC000514834641 943329964 /nfs/dbraw/zinc/32/99/64/943329964.db2.gz UZPLXWDPGKMWLH-LSDHHAIUSA-N 0 0 364.405 3.761 20 5 FHBDRN Cc1c(NC(=O)N2CCC[C@H](C)C2)cc(Br)cc1[N+](=O)[O-] ZINC000435330538 943333726 /nfs/dbraw/zinc/33/37/26/943333726.db2.gz UHFQKCSIPVNMLH-VIFPVBQESA-N 0 0 356.220 3.930 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(CCC(C)C)CCC(C)C ZINC000514849807 943334927 /nfs/dbraw/zinc/33/49/27/943334927.db2.gz WUGSRLDNNJQTRH-UHFFFAOYSA-N 0 0 372.487 3.686 20 5 FHBDRN Cc1c(NC(=O)N(C)[C@H]2CCSC2)cc(Br)cc1[N+](=O)[O-] ZINC000435330806 943335228 /nfs/dbraw/zinc/33/52/28/943335228.db2.gz WITJESQQVYVMGG-JTQLQIEISA-N 0 0 374.260 3.635 20 5 FHBDRN CC(C)(C(=O)N1CC[C@H](COc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000505667039 943341682 /nfs/dbraw/zinc/34/16/82/943341682.db2.gz YNDNDVMGNRVDIU-INIZCTEOSA-N 0 0 368.433 3.800 20 5 FHBDRN Cc1cc(C(=O)Nc2nc(CN3CCCCC3)cs2)ccc1[N+](=O)[O-] ZINC000014524714 943370901 /nfs/dbraw/zinc/37/09/01/943370901.db2.gz MRBTVXXMROGIQH-UHFFFAOYSA-N 0 0 360.439 3.598 20 5 FHBDRN CC[C@](C)(COc1ncccc1Cl)NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000435413799 943387760 /nfs/dbraw/zinc/38/77/60/943387760.db2.gz XIRUCBWSIBTSLD-QGZVFWFLSA-N 0 0 363.801 3.621 20 5 FHBDRN CCCOc1ccc([C@H](C)NC(=O)COc2ccccc2[N+](=O)[O-])cc1 ZINC000503869725 943391840 /nfs/dbraw/zinc/39/18/40/943391840.db2.gz GDTCQDXWNFVWLJ-AWEZNQCLSA-N 0 0 358.394 3.640 20 5 FHBDRN CSc1cccc(C(=O)N2CCSC3(CCC3)CC2)c1[N+](=O)[O-] ZINC000412468323 943392851 /nfs/dbraw/zinc/39/28/51/943392851.db2.gz VUKUCLZILXFPBC-UHFFFAOYSA-N 0 0 352.481 3.819 20 5 FHBDRN CCOc1cc(N[C@H]2CCCO[C@@H]2c2nccn2CC)ccc1[N+](=O)[O-] ZINC000190415234 943397296 /nfs/dbraw/zinc/39/72/96/943397296.db2.gz MUBBXFDELQOEIZ-YOEHRIQHSA-N 0 0 360.414 3.542 20 5 FHBDRN COCC[C@H](C)CNC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000412457295 943398863 /nfs/dbraw/zinc/39/88/63/943398863.db2.gz BJSBWNSMWCPLNA-HNNXBMFYSA-N 0 0 371.437 3.609 20 5 FHBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N1CCCO[C@H](CF)C1 ZINC000412458143 943399625 /nfs/dbraw/zinc/39/96/25/943399625.db2.gz ZJILGZPSWWJAEH-CQSZACIVSA-N 0 0 370.446 3.544 20 5 FHBDRN Cc1ccc(NCCCNC(=O)[C@H](c2cccnc2)C(C)C)c([N+](=O)[O-])c1 ZINC000435451845 943410884 /nfs/dbraw/zinc/41/08/84/943410884.db2.gz LMRBTGBLLUTFLH-IBGZPJMESA-N 0 0 370.453 3.656 20 5 FHBDRN CCCN(C(=O)c1ccc(Cn2nc(C)c([N+](=O)[O-])c2C)cc1)C(C)C ZINC000514947428 943414369 /nfs/dbraw/zinc/41/43/69/943414369.db2.gz XXEPDMAGKDDMJD-UHFFFAOYSA-N 0 0 358.442 3.717 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc2c1OCCC2=O ZINC000503931954 943423244 /nfs/dbraw/zinc/42/32/44/943423244.db2.gz WRSOROXYFRZDOT-LLVKDONJSA-N 0 0 372.402 3.679 20 5 FHBDRN Cc1nc2ccccc2n1CCC(=O)N[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000503945722 943429727 /nfs/dbraw/zinc/42/97/27/943429727.db2.gz MCUCWMHXCPSDTE-ZDUSSCGKSA-N 0 0 352.394 3.520 20 5 FHBDRN COCCN(c1ncc([N+](=O)[O-])cn1)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000545484522 943442478 /nfs/dbraw/zinc/44/24/78/943442478.db2.gz WIZHAPKUDCRENE-NSHDSACASA-N 0 0 370.331 3.618 20 5 FHBDRN COc1cccc(C(=O)NCCc2ccccc2C(F)(F)F)c1[N+](=O)[O-] ZINC000435509970 943450954 /nfs/dbraw/zinc/45/09/54/943450954.db2.gz FBAWZNGBQYJPRE-UHFFFAOYSA-N 0 0 368.311 3.595 20 5 FHBDRN COCCCNC(=O)c1ccc(Sc2ccc(C)cc2)c([N+](=O)[O-])c1 ZINC000017171393 943493723 /nfs/dbraw/zinc/49/37/23/943493723.db2.gz LFGFJEBFYPILRI-UHFFFAOYSA-N 0 0 360.435 3.821 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1)[C@H](NCc1nccn1CC(F)(F)F)CCCC2 ZINC000417301689 943495159 /nfs/dbraw/zinc/49/51/59/943495159.db2.gz BUERSPVTBQLDLC-OAHLLOKOSA-N 0 0 368.359 3.911 20 5 FHBDRN COc1cccc([N+](=O)[O-])c1N1CCC(n2ccc(C(F)(F)F)n2)CC1 ZINC000584731645 943495183 /nfs/dbraw/zinc/49/51/83/943495183.db2.gz ZXGVQDZJXGOUFX-UHFFFAOYSA-N 0 0 370.331 3.660 20 5 FHBDRN Nc1nccc(C(=O)N[C@@H]2CCC[C@@H](c3ccc(Cl)cc3)C2)c1[N+](=O)[O-] ZINC000515071264 943497647 /nfs/dbraw/zinc/49/76/47/943497647.db2.gz COPYXRQPWZQIHM-TZMCWYRMSA-N 0 0 374.828 3.512 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@@H](COc3ccccc3)C2)c1 ZINC000504103934 943501302 /nfs/dbraw/zinc/50/13/02/943501302.db2.gz OAKHSSGGCUYYET-CQSZACIVSA-N 0 0 372.446 3.858 20 5 FHBDRN Cc1sc(S(=O)(=O)N2CC[C@H](C)[C@H]3CCCC[C@H]32)cc1[N+](=O)[O-] ZINC000545938814 943503232 /nfs/dbraw/zinc/50/32/32/943503232.db2.gz ZAPVSRDVEAVJNK-CYZMBNFOSA-N 0 0 358.485 3.554 20 5 FHBDRN CCc1ccnc(CNc2ccc([N+](=O)[O-])c(OCc3ccccc3)n2)c1 ZINC000435588537 943506241 /nfs/dbraw/zinc/50/62/41/943506241.db2.gz NBEIESFJUVDWLP-UHFFFAOYSA-N 0 0 364.405 3.560 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)NCCCO[C@H](C)c1ccccc1 ZINC000515113376 943512102 /nfs/dbraw/zinc/51/21/02/943512102.db2.gz AEDZMULHLSIMQX-CQSZACIVSA-N 0 0 373.409 3.893 20 5 FHBDRN O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1CC[C@@H](COc2ccccc2)C1 ZINC000504147245 943514796 /nfs/dbraw/zinc/51/47/96/943514796.db2.gz ZCPSKXUMCOAGCU-CYBMUJFWSA-N 0 0 360.797 3.789 20 5 FHBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(N[C@H]2C[C@H](c3cccc(F)c3)C2)s1 ZINC000435600140 943520515 /nfs/dbraw/zinc/52/05/15/943520515.db2.gz YQEOVCPMVASETD-UMSPYCQHSA-N 0 0 370.427 3.557 20 5 FHBDRN CC(C)(C)O[C@@H](C(=O)NCCNc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000513810256 943524188 /nfs/dbraw/zinc/52/41/88/943524188.db2.gz YATAWVHNBHYGKC-GOSISDBHSA-N 0 0 371.437 3.679 20 5 FHBDRN CSc1ccc(C(=O)N2CC[C@@H](COc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000504183972 943531843 /nfs/dbraw/zinc/53/18/43/943531843.db2.gz HLOQLKWZNPMGLR-CQSZACIVSA-N 0 0 372.446 3.858 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)N1CC[C@@H](COc2ccccc2)C1 ZINC000504166450 943533079 /nfs/dbraw/zinc/53/30/79/943533079.db2.gz OMNJFWQZBRXLDJ-OAHLLOKOSA-N 0 0 372.446 3.614 20 5 FHBDRN Cc1cc(C)cc([C@@H]2NC(=O)N([C@@H](C)c3ccc(C)c([N+](=O)[O-])c3)C2=O)c1 ZINC000431940508 943550819 /nfs/dbraw/zinc/55/08/19/943550819.db2.gz VAAHHZCMHLCAAU-KSSFIOAISA-N 0 0 367.405 3.874 20 5 FHBDRN CCn1nccc1NC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000515179810 943552319 /nfs/dbraw/zinc/55/23/19/943552319.db2.gz VIKGLHULAOZDHG-UHFFFAOYSA-N 0 0 351.366 3.807 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])Nc1ccc2ccc(Cl)cc2n1 ZINC000504262550 943557286 /nfs/dbraw/zinc/55/72/86/943557286.db2.gz YKMFFYLUZBSBNK-UHFFFAOYSA-N 0 0 356.769 3.847 20 5 FHBDRN COc1ccc(Cl)cc1CC(=O)N1c2ccc([N+](=O)[O-])cc2C[C@H]1C ZINC000504275728 943568229 /nfs/dbraw/zinc/56/82/29/943568229.db2.gz YZMSKEGUCWWAML-LLVKDONJSA-N 0 0 360.797 3.777 20 5 FHBDRN C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)[C@@H]1COc2ccc(Cl)cc2C1 ZINC000504278673 943570025 /nfs/dbraw/zinc/57/00/25/943570025.db2.gz DYJMQKJPJKNVKX-FZMZJTMJSA-N 0 0 372.808 3.777 20 5 FHBDRN CC(C)(C)[C@@H]1CN(S(=O)(=O)c2ccccc2[N+](=O)[O-])c2ccccc21 ZINC000435721408 943579797 /nfs/dbraw/zinc/57/97/97/943579797.db2.gz CJYSRVPUFZYGBN-CQSZACIVSA-N 0 0 360.435 3.933 20 5 FHBDRN Cc1cc(C)c(OCC(=O)N2c3ccc([N+](=O)[O-])cc3C[C@H]2C)c(C)c1 ZINC000504341567 943593262 /nfs/dbraw/zinc/59/32/62/943593262.db2.gz TWZDPVUDWMOCHX-OAHLLOKOSA-N 0 0 354.406 3.877 20 5 FHBDRN CC(C)n1ncc2cc(C(=O)N3c4ccc([N+](=O)[O-])cc4C[C@@H]3C)cnc21 ZINC000504328835 943596151 /nfs/dbraw/zinc/59/61/51/943596151.db2.gz MAOBOIKRBPFZNU-LBPRGKRZSA-N 0 0 365.393 3.512 20 5 FHBDRN CCN(CC)C(=O)c1ccc(C(=O)Oc2cc([N+](=O)[O-])ccc2C)cc1 ZINC000103761684 943607798 /nfs/dbraw/zinc/60/77/98/943607798.db2.gz DCIPANKQOVNWQR-UHFFFAOYSA-N 0 0 356.378 3.604 20 5 FHBDRN O=C(Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1)NCCCC1CCCCC1 ZINC000504508236 943648293 /nfs/dbraw/zinc/64/82/93/943648293.db2.gz BOEAIEMFXDAPLC-UHFFFAOYSA-N 0 0 370.453 3.935 20 5 FHBDRN CCNc1nc(SCc2c(F)cccc2[N+](=O)[O-])nc2ccccc21 ZINC000504519886 943653280 /nfs/dbraw/zinc/65/32/80/943653280.db2.gz VUYQFQVTPPNXQJ-UHFFFAOYSA-N 0 0 358.398 3.823 20 5 FHBDRN CC1(C)CCC[C@@](O)(CNC(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000504552312 943674014 /nfs/dbraw/zinc/67/40/14/943674014.db2.gz JOMKPMRMPOSWJL-INIZCTEOSA-N 0 0 374.359 3.675 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCC[C@@H]1OC ZINC000504554622 943676072 /nfs/dbraw/zinc/67/60/72/943676072.db2.gz LGYAIOIIIYETTO-WFASDCNBSA-N 0 0 352.456 3.642 20 5 FHBDRN COc1cc(C)c([S@@](C)=O)cc1OCc1c(Cl)cccc1[N+](=O)[O-] ZINC000424102313 943719745 /nfs/dbraw/zinc/71/97/45/943719745.db2.gz LDMJIRJRAMPWRI-XMMPIXPASA-N 0 0 369.826 3.882 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)c1nnc([C@H]2CCCS2)n1C ZINC000424084668 943722674 /nfs/dbraw/zinc/72/26/74/943722674.db2.gz CDUIFHRGDGPPHP-OAHLLOKOSA-N 0 0 361.471 3.706 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1Cn1nc(C2CC2)nc1C1CC1 ZINC000424091294 943727660 /nfs/dbraw/zinc/72/76/60/943727660.db2.gz MJKZRXYYCVQRSQ-UHFFFAOYSA-N 0 0 363.215 3.752 20 5 FHBDRN Cc1cc(OC[C@H](O)COc2ccccc2F)c(Cl)cc1[N+](=O)[O-] ZINC000504672991 943739136 /nfs/dbraw/zinc/73/91/36/943739136.db2.gz IEEFOFUVEAOEGX-LLVKDONJSA-N 0 0 355.749 3.514 20 5 FHBDRN CN(c1ccccc1)c1ccc(C[NH2+][C@H](CC2CC2)C(=O)[O-])cc1[N+](=O)[O-] ZINC000417615279 943765569 /nfs/dbraw/zinc/76/55/69/943765569.db2.gz CJMCNFYQTLSOQV-QGZVFWFLSA-N 0 0 369.421 3.706 20 5 FHBDRN CCn1c([C@H]2CCCS2)nnc1N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000424157231 943765881 /nfs/dbraw/zinc/76/58/81/943765881.db2.gz MYDOVTFUZJUQEJ-MRXNPFEDSA-N 0 0 373.482 3.943 20 5 FHBDRN O=C(c1csc([N+](=O)[O-])c1)N1CCC(CCc2ccc(O)cc2)CC1 ZINC000516845960 943766193 /nfs/dbraw/zinc/76/61/93/943766193.db2.gz PLFSNPSAFBZRAI-UHFFFAOYSA-N 0 0 360.435 3.847 20 5 FHBDRN Cc1ccc(C[NH2+][C@@H](CCSc2ccccc2)C(=O)[O-])cc1[N+](=O)[O-] ZINC000417630277 943768683 /nfs/dbraw/zinc/76/86/83/943768683.db2.gz XUOLLHOYGVDPJM-INIZCTEOSA-N 0 0 360.435 3.628 20 5 FHBDRN CCCCO[C@@H]1C[C@H](N(C)C(=O)c2cccc(OC)c2[N+](=O)[O-])C1(C)C ZINC000435818155 943773075 /nfs/dbraw/zinc/77/30/75/943773075.db2.gz LKVALOABUCQFTG-JKSUJKDBSA-N 0 0 364.442 3.659 20 5 FHBDRN C[C@@H]([C@@H]([NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C(=O)[O-])C1CC1 ZINC000417642684 943790488 /nfs/dbraw/zinc/79/04/88/943790488.db2.gz WPSYZVBKFVEIOC-PIGZYNQJSA-N 0 0 360.435 3.912 20 5 FHBDRN O=C(NCCc1cccs1)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000435837973 943791552 /nfs/dbraw/zinc/79/15/52/943791552.db2.gz XAKVKCORIOETCW-UHFFFAOYSA-N 0 0 366.417 3.854 20 5 FHBDRN O=C(c1ccc(-c2ccccn2)nc1)N1CCCc2ccc([N+](=O)[O-])cc21 ZINC001125911030 943805452 /nfs/dbraw/zinc/80/54/52/943805452.db2.gz IMHLCNGIAJZXPB-UHFFFAOYSA-N 0 0 360.373 3.645 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H](CCOC)c1ccc(C)o1 ZINC000516897580 943812900 /nfs/dbraw/zinc/81/29/00/943812900.db2.gz ZWOBEIBZWKXUCZ-HNNXBMFYSA-N 0 0 361.398 3.958 20 5 FHBDRN CCOC(=O)c1cc(C(=O)N(CC)c2ccccc2F)cc([N+](=O)[O-])c1 ZINC000515369806 943816051 /nfs/dbraw/zinc/81/60/51/943816051.db2.gz IVIAIUKMHMEYCE-UHFFFAOYSA-N 0 0 360.341 3.577 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1F)N[C@H]1C[C@H](c2cccc(Cl)c2)C1 ZINC000437440513 943817772 /nfs/dbraw/zinc/81/77/72/943817772.db2.gz DQWUUUOLRRMLAR-CTYIDZIISA-N 0 0 362.788 3.992 20 5 FHBDRN COc1cc(CNc2ccccc2-n2ccc(C)n2)c([N+](=O)[O-])cc1F ZINC000184018617 943818166 /nfs/dbraw/zinc/81/81/66/943818166.db2.gz HTJKWNMINGOYNT-UHFFFAOYSA-N 0 0 356.357 3.849 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N[C@H]1C[C@H](c2cccc(F)c2)C1 ZINC000437451994 943822004 /nfs/dbraw/zinc/82/20/04/943822004.db2.gz SEDFPYQCOZXLPI-SAZUREKKSA-N 0 0 367.380 3.820 20 5 FHBDRN Cc1sc(C(=O)N[C@@H]2CCC[C@@H]2OCc2ccccc2)cc1[N+](=O)[O-] ZINC000123018116 943822583 /nfs/dbraw/zinc/82/25/83/943822583.db2.gz MQPJOJHUTWULEG-ZBFHGGJFSA-N 0 0 360.435 3.832 20 5 FHBDRN Cc1sc(C(=O)N[C@@H]2CCC[C@H]2OCc2ccccc2)cc1[N+](=O)[O-] ZINC000123018523 943829419 /nfs/dbraw/zinc/82/94/19/943829419.db2.gz MQPJOJHUTWULEG-GDBMZVCRSA-N 0 0 360.435 3.832 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])NC[C@@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000437460643 943830151 /nfs/dbraw/zinc/83/01/51/943830151.db2.gz HHDYTCKVBLLHTF-DGCLKSJQSA-N 0 0 359.348 3.763 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)NC[C@@H]1CCC[C@H](C(F)(F)F)C1 ZINC000437460716 943830231 /nfs/dbraw/zinc/83/02/31/943830231.db2.gz HXLDQVAGJBERDO-OLZOCXBDSA-N 0 0 359.348 3.763 20 5 FHBDRN Cn1cc([N+](=O)[O-])cc1C(=O)N1CCCc2cc(C(F)(F)F)ccc21 ZINC000515367284 943830914 /nfs/dbraw/zinc/83/09/14/943830914.db2.gz PACUTMUUOJRRMY-UHFFFAOYSA-N 0 0 353.300 3.545 20 5 FHBDRN Cc1cc([C@H]2CCCN2Cc2ccc(Br)cc2[N+](=O)[O-])on1 ZINC000425412152 943830943 /nfs/dbraw/zinc/83/09/43/943830943.db2.gz ZKBDSYDQQSFUKG-CYBMUJFWSA-N 0 0 366.215 3.991 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCc1cccc2c1CCCN2 ZINC000516921952 943830931 /nfs/dbraw/zinc/83/09/31/943830931.db2.gz ZAYGISMQAMGYLG-ZDUSSCGKSA-N 0 0 371.462 3.750 20 5 FHBDRN O=[N+]([O-])c1cc(-c2nc(-c3ccc4c(c3)OCO4)no2)ccc1NC1CC1 ZINC000504826951 943833297 /nfs/dbraw/zinc/83/32/97/943833297.db2.gz BDNOZDYMVQDGSN-UHFFFAOYSA-N 0 0 366.333 3.615 20 5 FHBDRN CSc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(-c2nnc(C)o2)cc1 ZINC001126419814 943855426 /nfs/dbraw/zinc/85/54/26/943855426.db2.gz LGNQXIVQPYZWGQ-UHFFFAOYSA-N 0 0 370.390 3.927 20 5 FHBDRN COc1ccc(NC(=O)N[C@H]2CCSc3ccccc32)cc1[N+](=O)[O-] ZINC000543888604 943858637 /nfs/dbraw/zinc/85/86/37/943858637.db2.gz UQMFLHVPMKBYTF-ZDUSSCGKSA-N 0 0 359.407 3.962 20 5 FHBDRN Cc1csc(CNC(=O)c2cccc3c(=O)c4cccc(F)c4[nH]c23)n1 ZINC000435935802 943869934 /nfs/dbraw/zinc/86/99/34/943869934.db2.gz MHMZOPHHUMNNBP-UHFFFAOYSA-N 0 0 367.405 3.515 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])N[C@H]1C[C@H](c2cccc(F)c2)C1 ZINC000437520750 943879145 /nfs/dbraw/zinc/87/91/45/943879145.db2.gz ZBXWSXNBICELBS-KOMQPUFPSA-N 0 0 358.369 3.565 20 5 FHBDRN CN(CCC1CC1)C(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000437525606 943887252 /nfs/dbraw/zinc/88/72/52/943887252.db2.gz MXNJNHKUONFNAP-UHFFFAOYSA-N 0 0 359.348 3.674 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N1CCC(Cc2ccc(F)cc2)CC1 ZINC000504889452 943887933 /nfs/dbraw/zinc/88/79/33/943887933.db2.gz OXXKOKSTFIOTPC-UHFFFAOYSA-N 0 0 372.396 3.837 20 5 FHBDRN Nc1c(C(=O)N[C@@H]2C[C@H]2c2cccc3ccccc32)cc(F)cc1[N+](=O)[O-] ZINC000435973979 943896675 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369.396 3.656 20 5 FHBDRN COc1cc(NC(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)ccc1O ZINC000436377691 944246741 /nfs/dbraw/zinc/24/67/41/944246741.db2.gz NYMALVXCLNUDML-UHFFFAOYSA-N 0 0 371.271 3.972 20 5 FHBDRN COc1ccc(CNC(=O)NCc2csc3ccccc23)cc1[N+](=O)[O-] ZINC000515829597 944248161 /nfs/dbraw/zinc/24/81/61/944248161.db2.gz NCGQKXRJMKYNOX-UHFFFAOYSA-N 0 0 371.418 3.818 20 5 FHBDRN CC[C@H](CC(F)(F)F)C(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000518312552 944258652 /nfs/dbraw/zinc/25/86/52/944258652.db2.gz DDMXQHQQJXDQMJ-SNVBAGLBSA-N 0 0 357.332 3.713 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)F)cc1NCc1cc(F)cc2c1OCOC2 ZINC000436392671 944261321 /nfs/dbraw/zinc/26/13/21/944261321.db2.gz SQMLTMRNFNAVFX-UHFFFAOYSA-N 0 0 373.262 3.626 20 5 FHBDRN CCOc1cc2c(cc1[C@@H]1C[C@H]1Nc1ncccc1[N+](=O)[O-])O[C@H](C)C2 ZINC000517393316 944264108 /nfs/dbraw/zinc/26/41/08/944264108.db2.gz MTUKTVRQMVBHHL-OSAQELSMSA-N 0 0 355.394 3.680 20 5 FHBDRN CC(C)NC(=O)c1ccc(NCCCc2cccc(F)c2)c([N+](=O)[O-])c1 ZINC000518318720 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944300746 /nfs/dbraw/zinc/30/07/46/944300746.db2.gz YPGVXMGEBSWLTR-INIZCTEOSA-N 0 0 353.422 3.580 20 5 FHBDRN Cc1nc(C)c(CCNC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)s1 ZINC000517458118 944301785 /nfs/dbraw/zinc/30/17/85/944301785.db2.gz HLDOJFDSAJOQNY-NSHDSACASA-N 0 0 365.480 3.508 20 5 FHBDRN COc1cc(CSCc2cc(C)on2)c([N+](=O)[O-])cc1OC(F)F ZINC000105626129 944302680 /nfs/dbraw/zinc/30/26/80/944302680.db2.gz WVVJCANTZAIYHM-UHFFFAOYSA-N 0 0 360.338 3.935 20 5 FHBDRN CCCOc1ccc(CNc2ccc([N+](=O)[O-])cc2C(=O)NC)c(C)c1 ZINC000473729442 944305055 /nfs/dbraw/zinc/30/50/55/944305055.db2.gz UHQIAXKTSQDJIW-UHFFFAOYSA-N 0 0 357.410 3.664 20 5 FHBDRN COc1cc(CN(C)Cc2nc3ccccc3s2)c([N+](=O)[O-])cc1F ZINC000184236750 944306375 /nfs/dbraw/zinc/30/63/75/944306375.db2.gz OIQXRBCDKIPNJG-UHFFFAOYSA-N 0 0 361.398 3.984 20 5 FHBDRN CC[C@H]1CCCN(C(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C1 ZINC000426271384 944306649 /nfs/dbraw/zinc/30/66/49/944306649.db2.gz NVOVYPJAVYHSFN-NSHDSACASA-N 0 0 359.348 3.945 20 5 FHBDRN O=C(c1cccc([N+](=O)[O-])c1)N1CCO[C@@H](c2ccc(F)cc2Cl)C1 ZINC000184240434 944307342 /nfs/dbraw/zinc/30/73/42/944307342.db2.gz HSWZDBJDJCTNBO-MRXNPFEDSA-N 0 0 364.760 3.601 20 5 FHBDRN O=[N+]([O-])c1cccc(F)c1CN1CC[C@@H](O)[C@H]1c1ccc(Cl)cc1 ZINC000425552806 944321171 /nfs/dbraw/zinc/32/11/71/944321171.db2.gz RCMGCHBEFGPFQK-IAGOWNOFSA-N 0 0 350.777 3.695 20 5 FHBDRN Cc1nn(C)c(C(=O)N2CCCC[C@H]2c2cccc(Cl)c2)c1[N+](=O)[O-] ZINC000436447872 944322652 /nfs/dbraw/zinc/32/26/52/944322652.db2.gz LGTRBPNNEPLTDM-AWEZNQCLSA-N 0 0 362.817 3.658 20 5 FHBDRN Cc1cc(OCC(=O)NCc2cccc(COC(C)C)c2)ccc1[N+](=O)[O-] ZINC000053541749 944329424 /nfs/dbraw/zinc/32/94/24/944329424.db2.gz NFMPVFZYPQFALN-UHFFFAOYSA-N 0 0 372.421 3.523 20 5 FHBDRN COC(=O)c1ccsc1NC(=O)c1c(C)cc(Cl)cc1[N+](=O)[O-] ZINC000439112827 944340302 /nfs/dbraw/zinc/34/03/02/944340302.db2.gz JRGBBXIKFFUQFZ-UHFFFAOYSA-N 0 0 354.771 3.657 20 5 FHBDRN COC1CCC(CNC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)CC1 ZINC000517492970 944340393 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3.945 20 5 FHBDRN C/C=C/c1ccc(OC[C@@H](O)COc2cccc(C)c2[N+](=O)[O-])c(OC)c1 ZINC000550179207 944357719 /nfs/dbraw/zinc/35/77/19/944357719.db2.gz VMLUPBDOFFTLAY-MQDFFIGUSA-N 0 0 373.405 3.764 20 5 FHBDRN CCCOc1ccc([C@H](C)NC(=O)c2cc([N+](=O)[O-])cnc2C)cc1OC ZINC000048501291 944361056 /nfs/dbraw/zinc/36/10/56/944361056.db2.gz HEJVHEOXFSXAFP-LBPRGKRZSA-N 0 0 373.409 3.587 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(-c2nc(-c3ccc4nc[nH]c4c3)no2)c1 ZINC000518436992 944365260 /nfs/dbraw/zinc/36/52/60/944365260.db2.gz SGTWWHAUXGOFGN-UHFFFAOYSA-N 0 0 351.322 3.587 20 5 FHBDRN CC(C)C[C@H](C)Oc1cc(CNC(=O)c2cccc([N+](=O)[O-])c2)ccn1 ZINC000518438846 944367609 /nfs/dbraw/zinc/36/76/09/944367609.db2.gz YGLNKTSBSDVOAT-AWEZNQCLSA-N 0 0 357.410 3.733 20 5 FHBDRN C[C@@]1(c2ccccc2)CCN(c2c(Br)cncc2[N+](=O)[O-])C1 ZINC000500265346 944368074 /nfs/dbraw/zinc/36/80/74/944368074.db2.gz DAXVJWDKUSFYBP-MRXNPFEDSA-N 0 0 362.227 3.920 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)NCc2nc3ccccc3[nH]2)cc1[N+](=O)[O-] ZINC000518428768 944373348 /nfs/dbraw/zinc/37/33/48/944373348.db2.gz XGXBGNPMLFXSIS-UHFFFAOYSA-N 0 0 352.394 3.699 20 5 FHBDRN Cc1cc(C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)nn1-c1ccccc1 ZINC000086625436 944373711 /nfs/dbraw/zinc/37/37/11/944373711.db2.gz SDNFJDGJDVHPEU-UHFFFAOYSA-N 0 0 350.378 3.958 20 5 FHBDRN CSc1ccc(C(=O)N2CCc3c(F)cc(F)cc3C2)cc1[N+](=O)[O-] ZINC000123530564 944374538 /nfs/dbraw/zinc/37/45/38/944374538.db2.gz ATGMRURTXJESDG-UHFFFAOYSA-N 0 0 364.373 3.793 20 5 FHBDRN Cc1cc(N[C@@H]2CCc3nnc(-c4ccc(F)cc4)n3C2)ccc1[N+](=O)[O-] ZINC000505841581 944376772 /nfs/dbraw/zinc/37/67/72/944376772.db2.gz XFUYGUOXIWOADF-MRXNPFEDSA-N 0 0 367.384 3.728 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)NCc1ccc(Br)c(F)c1 ZINC000500267751 944376763 /nfs/dbraw/zinc/37/67/63/944376763.db2.gz ONNBCNZKPIGIHD-UHFFFAOYSA-N 0 0 367.174 3.735 20 5 FHBDRN CNC(=O)c1ccc(N2CCC(=Cc3cccc(F)c3)CC2)c([N+](=O)[O-])c1 ZINC000053573252 944385053 /nfs/dbraw/zinc/38/50/53/944385053.db2.gz SWPIRCSNYHDDLU-UHFFFAOYSA-N 0 0 369.396 3.777 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)Cc1ccc(OC(F)F)cc1 ZINC000086624811 944386824 /nfs/dbraw/zinc/38/68/24/944386824.db2.gz QUYULYAWAZCRTQ-UHFFFAOYSA-N 0 0 350.321 3.994 20 5 FHBDRN CCCCOc1cccc(CNc2ccc(C(=O)NC)cc2[N+](=O)[O-])c1 ZINC000053572620 944386951 /nfs/dbraw/zinc/38/69/51/944386951.db2.gz PXAKCCNJEVCSGR-UHFFFAOYSA-N 0 0 357.410 3.745 20 5 FHBDRN Cc1ccc(NC(=O)c2cnc3onc(C(C)(C)C)c3c2)cc1[N+](=O)[O-] ZINC000515976261 944388447 /nfs/dbraw/zinc/38/84/47/944388447.db2.gz ULJNGLMJJJRYQZ-UHFFFAOYSA-N 0 0 354.366 3.989 20 5 FHBDRN C[C@@]1(CNC(=O)CSc2ccc([N+](=O)[O-])cc2)CCOC2(CCC2)C1 ZINC000894673710 944391486 /nfs/dbraw/zinc/39/14/86/944391486.db2.gz PCXXNKXWRNDDGU-QGZVFWFLSA-N 0 0 364.467 3.543 20 5 FHBDRN CN(Cc1ccc(C(F)(F)F)cc1)C(=O)COc1cccc([N+](=O)[O-])c1 ZINC000105972500 944406271 /nfs/dbraw/zinc/40/62/71/944406271.db2.gz BVKXHOZTXYMREF-UHFFFAOYSA-N 0 0 368.311 3.651 20 5 FHBDRN COc1ccc(CC(=O)N[C@H]2C[C@H](c3ccccc3C)C2)cc1[N+](=O)[O-] ZINC000518474763 944414731 /nfs/dbraw/zinc/41/47/31/944414731.db2.gz LINGWKWIXDKYHN-WKILWMFISA-N 0 0 354.406 3.517 20 5 FHBDRN Cc1ccc([C@@H](C)[NH2+]Cc2cc3ccccc3n(C)c2=O)cc1[N+](=O)[O-] ZINC000426305363 944420275 /nfs/dbraw/zinc/42/02/75/944420275.db2.gz CHHZCOGIGTWCGG-CQSZACIVSA-N 0 0 351.406 3.606 20 5 FHBDRN COc1cccc(C[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])c(C)c2)c1 ZINC000516000189 944421769 /nfs/dbraw/zinc/42/17/69/944421769.db2.gz CWMBTKVLRXESBL-KRWDZBQOSA-N 0 0 354.406 3.759 20 5 FHBDRN CC(=O)c1ccc2c(c1)CCN(C(=O)Nc1ccc([N+](=O)[O-])c(C)c1)CC2 ZINC000473774392 944426902 /nfs/dbraw/zinc/42/69/02/944426902.db2.gz GQQJFJCAXOQUCV-UHFFFAOYSA-N 0 0 367.405 3.739 20 5 FHBDRN CCCc1n[nH]c(C(=O)NCc2cccc(COC(C)(C)C)c2)c1[N+](=O)[O-] ZINC000517614989 944444582 /nfs/dbraw/zinc/44/45/82/944444582.db2.gz IQAISGGCTDSRRS-UHFFFAOYSA-N 0 0 374.441 3.516 20 5 FHBDRN O=C(NCCNc1ccc([N+](=O)[O-])cc1)N[C@@H]1CCc2c1cccc2Cl ZINC000518498628 944446108 /nfs/dbraw/zinc/44/61/08/944446108.db2.gz OFZYVZPPEGNOJA-QGZVFWFLSA-N 0 0 374.828 3.647 20 5 FHBDRN CCOc1ccc(C(=O)N2Cc3ccccc3OC(C)(C)C2)cc1[N+](=O)[O-] ZINC000517619561 944447535 /nfs/dbraw/zinc/44/75/35/944447535.db2.gz BTZBXJKGOWVUSH-UHFFFAOYSA-N 0 0 370.405 3.807 20 5 FHBDRN CC[C@H]1CCCCN1C(=O)[C@@H](C)OC(=O)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000011025377 944455726 /nfs/dbraw/zinc/45/57/26/944455726.db2.gz BBQAYKFBLZVZJT-YPMHNXCESA-N 0 0 368.817 3.585 20 5 FHBDRN CC(=O)c1cc2c(cc1NC(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1)OCO2 ZINC000439227751 944456617 /nfs/dbraw/zinc/45/66/17/944456617.db2.gz ZPHBGGQZKOMZJA-UHFFFAOYSA-N 0 0 370.361 3.902 20 5 FHBDRN CC[C@H]1CCCCN1C(=O)[C@@H](C)OC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000011028877 944457857 /nfs/dbraw/zinc/45/78/57/944457857.db2.gz RBTGPXHNPJQECX-NEPJUHHUSA-N 0 0 368.817 3.585 20 5 FHBDRN C[C@@H]1CC[C@@H](NC(=O)c2cccc([N+](=O)[O-])c2Br)C[C@@H]1C ZINC000159123528 944458512 /nfs/dbraw/zinc/45/85/12/944458512.db2.gz QEHQCXQRACZJKN-OUAUKWLOSA-N 0 0 355.232 3.912 20 5 FHBDRN O=[N+]([O-])c1ccn(C2CCN(Cc3ccc(F)cc3C(F)(F)F)CC2)n1 ZINC000425968656 944464123 /nfs/dbraw/zinc/46/41/23/944464123.db2.gz UVIPQFBJDXZRDG-UHFFFAOYSA-N 0 0 372.322 3.786 20 5 FHBDRN CC(C)Oc1ccc(CNC(=O)CSc2ccccc2[N+](=O)[O-])cc1 ZINC000506855804 944470017 /nfs/dbraw/zinc/47/00/17/944470017.db2.gz HFRNURZWGGQDEE-UHFFFAOYSA-N 0 0 360.435 3.791 20 5 FHBDRN C[C@@H]1CC[C@H](COc2c3cc(Br)ccc3ncc2[N+](=O)[O-])O1 ZINC000473789498 944470081 /nfs/dbraw/zinc/47/00/81/944470081.db2.gz YNJWVIKSIUEHQG-MWLCHTKSSA-N 0 0 367.199 3.852 20 5 FHBDRN COc1ccc(COC(=O)c2nc(C)oc2-c2ccccc2)cc1[N+](=O)[O-] ZINC000759830639 944470413 /nfs/dbraw/zinc/47/04/13/944470413.db2.gz MQBORPHTPMBSDB-UHFFFAOYSA-N 0 0 368.345 3.924 20 5 FHBDRN COc1cc(NC(=O)Nc2ccc([N+](=O)[O-])c(C)c2)ccc1NC(C)=O ZINC000473790857 944474072 /nfs/dbraw/zinc/47/40/72/944474072.db2.gz WFHGVVKJFCXSHR-UHFFFAOYSA-N 0 0 358.354 3.514 20 5 FHBDRN C[C@@H]1CCN(C(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)[C@@H]2CCCC[C@H]12 ZINC000517645564 944476081 /nfs/dbraw/zinc/47/60/81/944476081.db2.gz ZQVMPYGFJHNADG-RVZJWNSFSA-N 0 0 369.421 3.889 20 5 FHBDRN C[C@@H]1CCN(C(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)[C@@H]2CCCC[C@@H]12 ZINC000517645565 944476257 /nfs/dbraw/zinc/47/62/57/944476257.db2.gz ZQVMPYGFJHNADG-UVBSCNOISA-N 0 0 369.421 3.889 20 5 FHBDRN CC(C)(NC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)c1ccccc1 ZINC000517644786 944477163 /nfs/dbraw/zinc/47/71/63/944477163.db2.gz OPEWLUWDDBMMQH-UHFFFAOYSA-N 0 0 351.362 3.514 20 5 FHBDRN CC(=O)Nc1ccccc1-c1noc(/C=C/c2ccc([N+](=O)[O-])cc2)n1 ZINC000545543060 944479138 /nfs/dbraw/zinc/47/91/38/944479138.db2.gz QRGXYVSTOUBBBC-DHZHZOJOSA-N 0 0 350.334 3.774 20 5 FHBDRN CC(C)c1nc(C[NH2+]CCOc2ccc([N+](=O)[O-])cc2)c2ccccn21 ZINC000518544933 944480562 /nfs/dbraw/zinc/48/05/62/944480562.db2.gz PRSBYZBZCVKRGP-UHFFFAOYSA-N 0 0 354.410 3.535 20 5 FHBDRN CCCCOc1ccc(CCNC(=O)c2ccc(OC)c([N+](=O)[O-])c2)cc1 ZINC000500313188 944480826 /nfs/dbraw/zinc/48/08/26/944480826.db2.gz DONGIMPAENNXEV-UHFFFAOYSA-N 0 0 372.421 3.755 20 5 FHBDRN CO[C@H]1Cc2ccccc2N(C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000500316890 944490459 /nfs/dbraw/zinc/49/04/59/944490459.db2.gz OHIDBQBLPLDEOX-HNNXBMFYSA-N 0 0 372.396 3.616 20 5 FHBDRN CC(=O)c1cc(NC(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)ccc1C ZINC000518559937 944501881 /nfs/dbraw/zinc/50/18/81/944501881.db2.gz LWLUDPZMYZQXBD-UHFFFAOYSA-N 0 0 353.378 3.696 20 5 FHBDRN CC(=O)Nc1cc(F)c(F)cc1NC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000506542834 944523598 /nfs/dbraw/zinc/52/35/98/944523598.db2.gz PZUIFCGSRKLXDM-UHFFFAOYSA-N 0 0 374.303 3.565 20 5 FHBDRN C[C@@H]1CO[C@H](c2ccccc2Cl)CN1C(=O)c1ccccc1[N+](=O)[O-] ZINC000110514952 944525383 /nfs/dbraw/zinc/52/53/83/944525383.db2.gz YOFAOPUSTSVLJQ-PXAZEXFGSA-N 0 0 360.797 3.850 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N(C)[C@H]1CCCc2nc(C)sc21 ZINC000110528877 944534219 /nfs/dbraw/zinc/53/42/19/944534219.db2.gz CJBVLAAKVBCTDL-AWEZNQCLSA-N 0 0 361.423 3.518 20 5 FHBDRN COc1ccc([C@@H](C)NCc2cc(OC)c(F)cc2[N+](=O)[O-])cc1F ZINC000184299777 944535753 /nfs/dbraw/zinc/53/57/53/944535753.db2.gz QIRBUKLLRCAGQH-SNVBAGLBSA-N 0 0 352.337 3.741 20 5 FHBDRN C[C@@H](Oc1ccc(Cl)c(Cl)c1)C(=O)N(C)c1ccc([N+](=O)[O-])nc1 ZINC000558182938 944540239 /nfs/dbraw/zinc/54/02/39/944540239.db2.gz KLVLBNROSWQUIS-SECBINFHSA-N 0 0 370.192 3.727 20 5 FHBDRN C[C@@H](c1ccc(F)c(Cl)c1)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000516157313 944544136 /nfs/dbraw/zinc/54/41/36/944544136.db2.gz MMQTZBLVKJHMLY-LBPRGKRZSA-N 0 0 364.808 3.666 20 5 FHBDRN CN(C)c1nc2cc(NC(=O)CSc3ccc([N+](=O)[O-])cc3)ccc2o1 ZINC000133907468 944545672 /nfs/dbraw/zinc/54/56/72/944545672.db2.gz LFVGMCOYWWOSEW-UHFFFAOYSA-N 0 0 372.406 3.533 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NS(=O)(=O)CCc1cccc(Cl)c1 ZINC000506552793 944551108 /nfs/dbraw/zinc/55/11/08/944551108.db2.gz OGQMIAWVXUTXHP-UHFFFAOYSA-N 0 0 368.842 3.849 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(C(=O)N2C[C@@H]3CCC[C@]3(C(F)(F)F)C2)c1F ZINC000894380622 944552919 /nfs/dbraw/zinc/55/29/19/944552919.db2.gz WXGUATBPZAXULU-BONVTDFDSA-N 0 0 360.307 3.847 20 5 FHBDRN C[C@H](NC(=O)COc1ccccc1C(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000053656376 944556830 /nfs/dbraw/zinc/55/68/30/944556830.db2.gz QZCNHXZCLCWAJW-NSHDSACASA-N 0 0 368.311 3.870 20 5 FHBDRN CCOc1ccc(C(=O)NCCSCc2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000017603998 944558509 /nfs/dbraw/zinc/55/85/09/944558509.db2.gz CVXOTDORUQYUDI-UHFFFAOYSA-N 0 0 374.462 3.965 20 5 FHBDRN CCCCCC[C@@](C)(NC(=O)c1cccc([N+](=O)[O-])c1C)C(=O)OCC ZINC001125940281 944560480 /nfs/dbraw/zinc/56/04/80/944560480.db2.gz FQMJJVSZHTXDFS-LJQANCHMSA-N 0 0 364.442 3.925 20 5 FHBDRN O=C(NCc1cc(Cl)cc2c1OCC2)[C@@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1 ZINC001267966272 944561339 /nfs/dbraw/zinc/56/13/39/944561339.db2.gz AHEUZZSYXUXLCH-IAGOWNOFSA-N 0 0 372.808 3.603 20 5 FHBDRN O=C(Nc1ccc(Cl)cc1OCC(F)(F)F)c1cc([N+](=O)[O-])c[nH]1 ZINC000505873838 944568424 /nfs/dbraw/zinc/56/84/24/944568424.db2.gz BOAHFHPMTIAIQF-UHFFFAOYSA-N 0 0 363.679 3.770 20 5 FHBDRN CSc1cc2c(cc1NC(=O)c1cc([N+](=O)[O-])ccc1C)OCCO2 ZINC000505873554 944569206 /nfs/dbraw/zinc/56/92/06/944569206.db2.gz YHICPWQPCODQJB-UHFFFAOYSA-N 0 0 360.391 3.649 20 5 FHBDRN C[C@H](Oc1ccc2c(c1)CCC2)C(=O)N1c2ccc([N+](=O)[O-])cc2C[C@@H]1C ZINC000517760475 944580624 /nfs/dbraw/zinc/58/06/24/944580624.db2.gz VLEWHCQGHXRPLY-KBPBESRZSA-N 0 0 366.417 3.829 20 5 FHBDRN O=[N+]([O-])c1ccc(Cc2noc(C3(CCF)CC3)n2)c(Br)c1 ZINC000516219113 944581686 /nfs/dbraw/zinc/58/16/86/944581686.db2.gz TUPNNPJIVXRYOV-UHFFFAOYSA-N 0 0 370.178 3.722 20 5 FHBDRN Cc1cc(S(=O)(=O)NC2(c3ccc(Cl)cc3)CC2)ccc1[N+](=O)[O-] ZINC000516207053 944587014 /nfs/dbraw/zinc/58/70/14/944587014.db2.gz WEVGMDZVJAOJNJ-UHFFFAOYSA-N 0 0 366.826 3.524 20 5 FHBDRN COc1ccc(CSCC(=O)N[C@H]2CC[C@H](C)CC2)cc1[N+](=O)[O-] ZINC000518663687 944587484 /nfs/dbraw/zinc/58/74/84/944587484.db2.gz JYYXTHQWKGUVTQ-MQMHXKEQSA-N 0 0 352.456 3.532 20 5 FHBDRN CCc1ccc(C(=O)N2CCC[C@@H]2[C@@H]2C[C@@H](C)CC[C@@H]2O)cc1[N+](=O)[O-] ZINC000500350249 944587839 /nfs/dbraw/zinc/58/78/39/944587839.db2.gz STWHTGOHUCMTDX-KUZCPNRJSA-N 0 0 360.454 3.559 20 5 FHBDRN Cn1cc([N+](=O)[O-])cc1C(=O)N1CCCC[C@@H]1c1cc2ccccc2[nH]1 ZINC000518665734 944588119 /nfs/dbraw/zinc/58/81/19/944588119.db2.gz MMFIJHRDSQQJGM-QGZVFWFLSA-N 0 0 352.394 3.782 20 5 FHBDRN COC(=O)c1oc2ccccc2c1COc1ccc(OC)cc1[N+](=O)[O-] ZINC000517773991 944595166 /nfs/dbraw/zinc/59/51/66/944595166.db2.gz JJEMVKXWVCELOO-UHFFFAOYSA-N 0 0 357.318 3.715 20 5 FHBDRN CC(C)(C(=O)NCCc1cccc2[nH]ccc21)c1ccc([N+](=O)[O-])cc1 ZINC000506233042 944598535 /nfs/dbraw/zinc/59/85/35/944598535.db2.gz SETXXHCFNGTARA-UHFFFAOYSA-N 0 0 351.406 3.713 20 5 FHBDRN COc1ccc(C)cc1C(=O)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000103921581 944606077 /nfs/dbraw/zinc/60/60/77/944606077.db2.gz FDKIBUODYPQLHS-UHFFFAOYSA-N 0 0 351.362 3.658 20 5 FHBDRN Cc1ccc(N(Cc2ccco2)C(=O)c2cc([N+](=O)[O-])cnc2N)cc1C ZINC000759859699 944606674 /nfs/dbraw/zinc/60/66/74/944606674.db2.gz WADJIBRYXSBVAV-UHFFFAOYSA-N 0 0 366.377 3.629 20 5 FHBDRN CS(=O)(=O)CCCCOC(=O)c1c2ccccc2cc2ccccc21 ZINC000759861478 944609187 /nfs/dbraw/zinc/60/91/87/944609187.db2.gz PSXYFAHAEROWIV-UHFFFAOYSA-N 0 0 356.443 3.975 20 5 FHBDRN CC(C)CCOC1CCN(C(=O)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000296806997 944615523 /nfs/dbraw/zinc/61/55/23/944615523.db2.gz LSDAWAXAKADURO-HNNXBMFYSA-N 0 0 363.458 3.893 20 5 FHBDRN CCc1nccn1[C@@H](C)CC(=O)N(C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000843759758 944625403 /nfs/dbraw/zinc/62/54/03/944625403.db2.gz WXDARFVZSZJSKC-LBPRGKRZSA-N 0 0 364.833 3.617 20 5 FHBDRN CC[C@@](C)(NC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12)c1nc(C)cs1 ZINC000150741538 944628942 /nfs/dbraw/zinc/62/89/42/944628942.db2.gz HBCUGCSIDPUEDX-QGZVFWFLSA-N 0 0 358.423 3.896 20 5 FHBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)[C@@H](OC1CCCC1)c1ccccc1 ZINC000759869435 944632555 /nfs/dbraw/zinc/63/25/55/944632555.db2.gz FJARVZIIVCAQIE-FQEVSTJZSA-N 0 0 368.433 3.954 20 5 FHBDRN O=[N+]([O-])c1cncc(Cl)c1OCCOc1ccc(Br)cc1 ZINC000506583518 944633909 /nfs/dbraw/zinc/63/39/09/944633909.db2.gz DKQFXVNBKLTGKW-UHFFFAOYSA-N 0 0 373.590 3.864 20 5 FHBDRN COc1cc(-c2noc(-c3c[nH]c4ccc([N+](=O)[O-])cc43)n2)ccc1O ZINC000436788863 944637494 /nfs/dbraw/zinc/63/74/94/944637494.db2.gz ISZURZDDMPOPLB-UHFFFAOYSA-N 0 0 352.306 3.507 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)c1cccc(COC2CCOCC2)c1 ZINC000426022400 944645435 /nfs/dbraw/zinc/64/54/35/944645435.db2.gz NTHFUPHFUJWYJR-UHFFFAOYSA-N 0 0 370.405 3.851 20 5 FHBDRN O=C([O-])Cc1ccccc1C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000426679418 944693827 /nfs/dbraw/zinc/69/38/27/944693827.db2.gz VYXPNCZOPJFBEV-UHFFFAOYSA-N 0 0 366.373 3.772 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(NCc2ccc(C)cc2OC(C)(C)C)n1 ZINC000566744531 944695402 /nfs/dbraw/zinc/69/54/02/944695402.db2.gz PNSPCWKEFLHEHS-UHFFFAOYSA-N 0 0 373.409 3.874 20 5 FHBDRN Cc1ccc(NC(=O)N2CC(Cc3ccc(F)c(F)c3)C2)cc1[N+](=O)[O-] ZINC000438499180 944695561 /nfs/dbraw/zinc/69/55/61/944695561.db2.gz VYPJSLQQOCHMAB-UHFFFAOYSA-N 0 0 361.348 3.888 20 5 FHBDRN CC(C)OC(=O)c1ccc(COc2c(Cl)cncc2[N+](=O)[O-])cc1 ZINC000506600039 944698055 /nfs/dbraw/zinc/69/80/55/944698055.db2.gz IQSIWNGADDHBGZ-UHFFFAOYSA-N 0 0 350.758 3.787 20 5 FHBDRN CC(C)(c1nc(-c2cccc([N+](=O)[O-])c2)no1)c1ccc2c(c1)OCO2 ZINC000426408190 944702973 /nfs/dbraw/zinc/70/29/73/944702973.db2.gz YZXOAMUAHRVJRX-UHFFFAOYSA-N 0 0 353.334 3.699 20 5 FHBDRN COC(=O)c1c(F)cc(NCc2c(F)cc([N+](=O)[O-])cc2F)cc1F ZINC000506259469 944710808 /nfs/dbraw/zinc/71/08/08/944710808.db2.gz QKWJSQFVUMELQG-UHFFFAOYSA-N 0 0 358.247 3.550 20 5 FHBDRN Cc1ccc(NC(=O)[C@H](C)N2CCc3ccc([N+](=O)[O-])cc3C2)c(Cl)c1 ZINC000438523546 944727718 /nfs/dbraw/zinc/72/77/18/944727718.db2.gz NKZRNJLZERNJPP-ZDUSSCGKSA-N 0 0 373.840 3.942 20 5 FHBDRN O=C(CCn1cc([N+](=O)[O-])cn1)N(Cc1ccc(F)cc1)C1CCCCC1 ZINC000516334223 944733278 /nfs/dbraw/zinc/73/32/78/944733278.db2.gz CKOGVEBVDVLEMT-UHFFFAOYSA-N 0 0 374.416 3.682 20 5 FHBDRN CC(C)[C@@H](C)N(CC(F)(F)F)C(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000516339554 944741294 /nfs/dbraw/zinc/74/12/94/944741294.db2.gz YGSLTPQYRVJNQM-SECBINFHSA-N 0 0 368.302 3.851 20 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COc1cc(CNc2cnn(-c3ccccc3F)c2C)ccc1[N+](=O)[O-] ZINC000506281784 944798962 /nfs/dbraw/zinc/79/89/62/944798962.db2.gz PAUIOGFOVXTYKS-UHFFFAOYSA-N 0 0 356.357 3.849 20 5 FHBDRN CC(C)(C)OC(=O)C[C@H]1CCCN(c2c3c(ccc2[N+](=O)[O-])NCC3)C1 ZINC000516383622 944800969 /nfs/dbraw/zinc/80/09/69/944800969.db2.gz ADKJXRLNHPRCPA-CYBMUJFWSA-N 0 0 361.442 3.511 20 5 FHBDRN CNC(=O)c1cc([N+](=O)[O-])ccc1NCCc1c(Cl)cccc1Cl ZINC000506979641 944806478 /nfs/dbraw/zinc/80/64/78/944806478.db2.gz QKZKFOGWGFAODY-UHFFFAOYSA-N 0 0 368.220 3.916 20 5 FHBDRN Cn1cc(C(=O)N2CCCC3(CCCC3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000438570816 944807102 /nfs/dbraw/zinc/80/71/02/944807102.db2.gz XKFBHONXZYQYNJ-UHFFFAOYSA-N 0 0 368.437 3.792 20 5 FHBDRN O=C(Nc1ccc2cc([N+](=O)[O-])ccc2n1)c1cc(-n2cccc2)ccn1 ZINC000500411346 944812294 /nfs/dbraw/zinc/81/22/94/944812294.db2.gz WIPRXPOMOHJCOH-UHFFFAOYSA-N 0 0 359.345 3.581 20 5 FHBDRN CCCCOc1ncccc1CNC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000516397074 944817108 /nfs/dbraw/zinc/81/71/08/944817108.db2.gz WWXSBPOIGAIJTH-UHFFFAOYSA-N 0 0 363.801 3.752 20 5 FHBDRN O=C(NCc1cccc([N+](=O)[O-])c1)N[C@H]1CCCC[C@H]1CC(F)(F)F ZINC000516400396 944820493 /nfs/dbraw/zinc/82/04/93/944820493.db2.gz XCCPUDOIOVZOJQ-JSGCOSHPSA-N 0 0 359.348 3.905 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N[C@H]1CCCc2sccc21 ZINC000162778669 944822218 /nfs/dbraw/zinc/82/22/18/944822218.db2.gz UDYFRUXGLIYIHQ-AWEZNQCLSA-N 0 0 361.423 3.542 20 5 FHBDRN CC(C)(C)c1ccc(C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C(=O)[O-])cc1 ZINC000426808689 944829552 /nfs/dbraw/zinc/82/95/52/944829552.db2.gz NLMUDJKGODSWKD-KRWDZBQOSA-N 0 0 356.422 3.678 20 5 FHBDRN CC(C)(C)[C@@H]1CCC[C@H]1NC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000412829310 944835615 /nfs/dbraw/zinc/83/56/15/944835615.db2.gz UGYMAHYPDCGZDX-GDBMZVCRSA-N 0 0 357.410 3.793 20 5 FHBDRN CC(C)(C)c1ccc(C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C(=O)[O-])s1 ZINC000426818967 944840202 /nfs/dbraw/zinc/84/02/02/944840202.db2.gz UKPPHGVGQKZVRK-AWEZNQCLSA-N 0 0 362.451 3.739 20 5 FHBDRN CCCc1n[nH]c(C(=O)N[C@H](C)c2cccc(OC(C)C)c2)c1[N+](=O)[O-] ZINC000518865392 944862280 /nfs/dbraw/zinc/86/22/80/944862280.db2.gz BSGBROORTOUMSS-GFCCVEGCSA-N 0 0 360.414 3.549 20 5 FHBDRN COc1ccc(Cl)cc1CNC(=O)CSc1cccc([N+](=O)[O-])c1 ZINC000509728873 944862453 /nfs/dbraw/zinc/86/24/53/944862453.db2.gz LBFALCCNPQWHIF-UHFFFAOYSA-N 0 0 366.826 3.665 20 5 FHBDRN O=C(NC1(Cc2ccccc2)CC1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000505914358 944871411 /nfs/dbraw/zinc/87/14/11/944871411.db2.gz YKMPLVWGPPIMNE-UHFFFAOYSA-N 0 0 362.332 3.701 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC(C)(C)Cc2oc(C)cc21 ZINC000506307258 944879998 /nfs/dbraw/zinc/87/99/98/944879998.db2.gz QUNXKIYOGVVDNT-OAHLLOKOSA-N 0 0 358.394 3.948 20 5 FHBDRN COc1ccc(OCCOc2ccc(C(F)(F)F)nc2C)c([N+](=O)[O-])c1 ZINC000506307335 944891667 /nfs/dbraw/zinc/89/16/67/944891667.db2.gz DDSGRAMZLLTJHM-UHFFFAOYSA-N 0 0 372.299 3.783 20 5 FHBDRN Cc1nn(-c2ccccc2)cc1NC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000511670691 944897319 /nfs/dbraw/zinc/89/73/19/944897319.db2.gz IVNQENKYQYMXRF-UHFFFAOYSA-N 0 0 361.361 3.823 20 5 FHBDRN CCCc1n[nH]c(C(=O)N(C)Cc2ccccc2C(F)(F)F)c1[N+](=O)[O-] ZINC000518892421 944897442 /nfs/dbraw/zinc/89/74/42/944897442.db2.gz JFGMQVRFADGZMX-UHFFFAOYSA-N 0 0 370.331 3.561 20 5 FHBDRN Nc1c(C(=O)NCc2cccc(Cl)c2Cl)cc(F)cc1[N+](=O)[O-] ZINC000516469764 944900476 /nfs/dbraw/zinc/90/04/76/944900476.db2.gz MTEMSMQXESTZJZ-UHFFFAOYSA-N 0 0 358.156 3.553 20 5 FHBDRN O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CC[C@@H](Oc2ccc(Cl)cc2)C1 ZINC000566818104 944904024 /nfs/dbraw/zinc/90/40/24/944904024.db2.gz ROCWDKMZVGYUFP-MRXNPFEDSA-N 0 0 364.760 3.681 20 5 FHBDRN CC[C@@H](C)Oc1ccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000511696204 944911147 /nfs/dbraw/zinc/91/11/47/944911147.db2.gz VAWSMQYHUNDXJJ-GFCCVEGCSA-N 0 0 350.396 3.573 20 5 FHBDRN CC(C)[C@H](Cc1ccc(F)cc1)NC(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000437009711 944911384 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3.795 20 5 FHBDRN CNc1ccc(C(=O)N2CCCCC[C@H]2c2ccncc2)cc1[N+](=O)[O-] ZINC000516489501 944936920 /nfs/dbraw/zinc/93/69/20/944936920.db2.gz OJZGHPNGRGHYEK-KRWDZBQOSA-N 0 0 354.410 3.789 20 5 FHBDRN CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1NCc1ccc2c(c1)COC2 ZINC000432030763 944937227 /nfs/dbraw/zinc/93/72/27/944937227.db2.gz GQENEJMSTYBKKE-UHFFFAOYSA-N 0 0 360.341 3.553 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N[C@H](c2cccc(C)c2)C(F)(F)F)c1 ZINC000511699522 944942463 /nfs/dbraw/zinc/94/24/63/944942463.db2.gz GBOGLBJHZRCQDG-OAHLLOKOSA-N 0 0 368.311 3.945 20 5 FHBDRN COCCN(Cc1ccc(F)cc1Cl)c1ncc(C)cc1[N+](=O)[O-] ZINC000432050316 944952003 /nfs/dbraw/zinc/95/20/03/944952003.db2.gz YSPBHIXSWPNEEZ-UHFFFAOYSA-N 0 0 353.781 3.744 20 5 FHBDRN COCCN(Cc1ccc(F)cc1Cl)c1cc(C)c([N+](=O)[O-])cn1 ZINC000432050555 944953897 /nfs/dbraw/zinc/95/38/97/944953897.db2.gz ZSCFIXPVGFMGKS-UHFFFAOYSA-N 0 0 353.781 3.744 20 5 FHBDRN COc1cc(Cl)ccc1C(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000516508896 944957304 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FHBDRN O=C1CCN1c1cccc(-c2noc(/C=C/c3ccccc3[N+](=O)[O-])n2)c1 ZINC000438812422 945044388 /nfs/dbraw/zinc/04/43/88/945044388.db2.gz HLCGHUFSMOQMPZ-CMDGGOBGSA-N 0 0 362.345 3.552 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N(C)CCCOc1ccccc1 ZINC000439888312 945049557 /nfs/dbraw/zinc/04/95/57/945049557.db2.gz NGRDRROMBYWOMC-UHFFFAOYSA-N 0 0 373.409 3.926 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N(CCOC)[C@@H]1CC[C@@H](C)C1 ZINC000439889819 945051891 /nfs/dbraw/zinc/05/18/91/945051891.db2.gz XFDKWJJVSNJNCS-ZIAGYGMSSA-N 0 0 365.430 3.662 20 5 FHBDRN COC1(C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)CCCCC1 ZINC000516590960 945052896 /nfs/dbraw/zinc/05/28/96/945052896.db2.gz KDJFCJSQKGMBHU-UHFFFAOYSA-N 0 0 357.204 3.645 20 5 FHBDRN CCO[C@@H]1C[C@H](NC(=O)CSc2ccc([N+](=O)[O-])cc2)C12CCCC2 ZINC000437123633 945054044 /nfs/dbraw/zinc/05/40/44/945054044.db2.gz FHKLYPIPXADMBX-JKSUJKDBSA-N 0 0 364.467 3.541 20 5 FHBDRN Cc1cccc(O[C@@H](C)C(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000437123994 945054237 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CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1Cc2ccccc2C[C@@H]1C ZINC000439882899 945060863 /nfs/dbraw/zinc/06/08/63/945060863.db2.gz LRGJVLSOTDUKHK-ZDUSSCGKSA-N 0 0 355.394 3.972 20 5 FHBDRN COCc1cc(Cl)cc(S(=O)(=O)Nc2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000519041271 945062820 /nfs/dbraw/zinc/06/28/20/945062820.db2.gz IYHWUTWJGNRBQL-UHFFFAOYSA-N 0 0 370.814 3.504 20 5 FHBDRN Cc1c(NC(=O)Cc2ccc(F)cc2Br)cccc1[N+](=O)[O-] ZINC000185994080 945376430 /nfs/dbraw/zinc/37/64/30/945376430.db2.gz QKBUELDILNLLNJ-UHFFFAOYSA-N 0 0 367.174 3.986 20 5 FHBDRN Cc1cccc(OCCNC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)c1 ZINC000018147447 945379744 /nfs/dbraw/zinc/37/97/44/945379744.db2.gz MJIMSXQQLCQRGI-UHFFFAOYSA-N 0 0 356.403 3.927 20 5 FHBDRN CSc1ccc(C(=O)NCCOc2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000018150901 945381136 /nfs/dbraw/zinc/38/11/36/945381136.db2.gz KRNKCDJGRUYYGO-UHFFFAOYSA-N 0 0 366.826 3.779 20 5 FHBDRN COC(=O)[C@@H](C)CC(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000475045828 945385984 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CC(C)c1csc(CNC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)n1 ZINC000151374392 945430876 /nfs/dbraw/zinc/43/08/76/945430876.db2.gz RYINKBQGGDNCAS-UHFFFAOYSA-N 0 0 360.439 3.679 20 5 FHBDRN O=[N+]([O-])c1ccccc1NCCNC(=S)Nc1ccccc1Cl ZINC000018162164 945435828 /nfs/dbraw/zinc/43/58/28/945435828.db2.gz MVDRPAAAFAOKFK-UHFFFAOYSA-N 0 0 350.831 3.647 20 5 FHBDRN CCC(CC)(C(=O)NCCNc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000440358630 945441448 /nfs/dbraw/zinc/44/14/48/945441448.db2.gz PRQGJTJGMMYENZ-UHFFFAOYSA-N 0 0 355.438 3.881 20 5 FHBDRN COc1cccc([C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])cc2OC)c1 ZINC000427511855 945452235 /nfs/dbraw/zinc/45/22/35/945452235.db2.gz OEMRNODHSZUBHL-QGZVFWFLSA-N 0 0 356.378 3.589 20 5 FHBDRN O=C(N=c1cc(C2CCCCC2)[nH][nH]1)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000426647717 945461962 /nfs/dbraw/zinc/46/19/62/945461962.db2.gz OSMNALHAQIZEPW-UHFFFAOYSA-N 0 0 353.382 3.521 20 5 FHBDRN CC(C)OC(=O)CC[C@H](C)NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000473613067 945482423 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Cc1sc(C(=O)Nc2nc(Cc3ccccc3)ns2)cc1[N+](=O)[O-] ZINC000107200302 945518313 /nfs/dbraw/zinc/51/83/13/945518313.db2.gz YZXTWSLBDNPNHM-UHFFFAOYSA-N 0 0 360.420 3.659 20 5 FHBDRN COc1ccccc1O[C@@H](C)CNC(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000473876185 945544522 /nfs/dbraw/zinc/54/45/22/945544522.db2.gz LPQQUDMIVJBPKQ-AWEZNQCLSA-N 0 0 372.421 3.924 20 5 FHBDRN CN(C(=O)c1ccc(C2SCCS2)cc1)c1ccc([N+](=O)[O-])nc1 ZINC000281214665 945563923 /nfs/dbraw/zinc/56/39/23/945563923.db2.gz QVFCXFNJAXNQSE-UHFFFAOYSA-N 0 0 361.448 3.745 20 5 FHBDRN C[C@H](OC(=O)c1ccc(NC(=O)C2CC2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000137423669 945564416 /nfs/dbraw/zinc/56/44/16/945564416.db2.gz BUTJMCAIIWIGNU-LBPRGKRZSA-N 0 0 354.362 3.861 20 5 FHBDRN Cc1ccc(S(=O)(=O)N[C@@H]2CCc3c2cccc3Cl)cc1[N+](=O)[O-] ZINC000511886859 945564944 /nfs/dbraw/zinc/56/49/44/945564944.db2.gz FAQAFNAHODVHFB-OAHLLOKOSA-N 0 0 366.826 3.522 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])N1CC[C@@H](c2c(F)cccc2F)C1 ZINC000184401321 945568906 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CNc1ccc(-c2nc([C@@H]3CSc4ccccc4O3)no2)cc1[N+](=O)[O-] ZINC000519623389 945594338 /nfs/dbraw/zinc/59/43/38/945594338.db2.gz JYMYHPPWQJERDP-AWEZNQCLSA-N 0 0 370.390 3.912 20 5 FHBDRN C[C@@H]1CC[C@@H](CNC(=O)c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)C1 ZINC001271265146 945600562 /nfs/dbraw/zinc/60/05/62/945600562.db2.gz IHBVAAGPFWSODB-HZPDHXFCSA-N 0 0 359.470 3.997 20 5 FHBDRN CCCCCC[C@@](C)(NC(=O)c1ccc([N+](=O)[O-])cc1C)C(=O)OCC ZINC001126015008 945612846 /nfs/dbraw/zinc/61/28/46/945612846.db2.gz ZWRYYMPUOAHMII-LJQANCHMSA-N 0 0 364.442 3.925 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)Nc2ccc(N3CCC3=O)cc2)cc1[N+](=O)[O-] ZINC000281423479 945627748 /nfs/dbraw/zinc/62/77/48/945627748.db2.gz ZRDKNQBGMJEETE-CYBMUJFWSA-N 0 0 368.393 3.523 20 5 FHBDRN C[C@@H]1C[C@@H](C(=O)N(Cc2ccc([N+](=O)[O-])cc2)c2ccccc2)[C@@H](C)O1 ZINC001126493914 945628810 /nfs/dbraw/zinc/62/88/10/945628810.db2.gz WUEZHPHCAQIMTA-SPYBWZPUSA-N 0 0 354.406 3.942 20 5 FHBDRN CC(C)Cc1coc(NC(=O)c2cc([N+](=O)[O-])ccc2Br)n1 ZINC000894441030 945634410 /nfs/dbraw/zinc/63/44/10/945634410.db2.gz DNVUNKGKPMBYSU-UHFFFAOYSA-N 0 0 368.187 3.796 20 5 FHBDRN CCN(C(=O)CCOc1cc(C)ccc1[N+](=O)[O-])[C@H](C)c1cccnc1 ZINC000281503340 945655369 /nfs/dbraw/zinc/65/53/69/945655369.db2.gz IBGDYEIQZNWYSV-OAHLLOKOSA-N 0 0 357.410 3.677 20 5 FHBDRN COc1ccccc1[C@@H](C)Cc1nc(Cc2ccccc2[N+](=O)[O-])no1 ZINC000546241025 945672539 /nfs/dbraw/zinc/67/25/39/945672539.db2.gz QTUMUESMFJXKMF-ZDUSSCGKSA-N 0 0 353.378 3.923 20 5 FHBDRN O=C(COc1ccc(Br)cc1F)c1ccc([N+](=O)[O-])cc1 ZINC000048403942 945680967 /nfs/dbraw/zinc/68/09/67/945680967.db2.gz CROJDSQMEUHMIS-UHFFFAOYSA-N 0 0 354.131 3.758 20 5 FHBDRN Nc1c(C(=O)N[C@@H]2CC[C@H](c3ccc(F)cc3)C2)cc(F)cc1[N+](=O)[O-] ZINC000473641801 945683162 /nfs/dbraw/zinc/68/31/62/945683162.db2.gz CEGMXDDJXNNPJC-SMDDNHRTSA-N 0 0 361.348 3.521 20 5 FHBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)NCc1ncccc1O ZINC000473642874 945686281 /nfs/dbraw/zinc/68/62/81/945686281.db2.gz ZRLIJFVIZFEZSA-UHFFFAOYSA-N 0 0 361.423 3.518 20 5 FHBDRN Cc1ccc2c(c1)N(C(=O)c1cc3c(cc1[N+](=O)[O-])OCCCO3)CCC2 ZINC001126027074 945692676 /nfs/dbraw/zinc/69/26/76/945692676.db2.gz MTQIVCFDLZNWDT-UHFFFAOYSA-N 0 0 368.389 3.658 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)Nc2ccc3nc(C(F)F)sc3c2)n1 ZINC000557724862 945696912 /nfs/dbraw/zinc/69/69/12/945696912.db2.gz YDMCYAUWUPHLRN-UHFFFAOYSA-N 0 0 367.337 3.611 20 5 FHBDRN C[C@@H](C(=O)N1CCO[C@H](c2cccc(Cl)c2)C1)c1cccc([N+](=O)[O-])c1 ZINC000519737879 945703900 /nfs/dbraw/zinc/70/39/00/945703900.db2.gz PABCTQOPLHZENE-ACJLOTCBSA-N 0 0 374.824 3.952 20 5 FHBDRN CSCC[C@@H](N[C@H](C)c1ccc([N+](=O)[O-])cc1)c1nnc2ccccn21 ZINC000164294798 945708715 /nfs/dbraw/zinc/70/87/15/945708715.db2.gz YDYWOJNFQQMSRB-CZUORRHYSA-N 0 0 371.466 3.783 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)Nc1nnc(-c2ccco2)s1 ZINC000522744258 945737997 /nfs/dbraw/zinc/73/79/97/945737997.db2.gz KLYKDBNDMKTUKT-UHFFFAOYSA-N 0 0 364.770 3.541 20 5 FHBDRN Cc1ccc(OCCNC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)c(C)c1 ZINC000522744290 945738061 /nfs/dbraw/zinc/73/80/61/945738061.db2.gz MPCPWOSRNDKQTO-UHFFFAOYSA-N 0 0 362.813 3.603 20 5 FHBDRN CC(C)c1ccc(C(=O)NC[C@H](O)[C@H](C)c2ccccc2)cc1[N+](=O)[O-] ZINC001167775693 945740426 /nfs/dbraw/zinc/74/04/26/945740426.db2.gz QVQGFVIIWMGXJP-KUHUBIRLSA-N 0 0 356.422 3.613 20 5 FHBDRN Cc1c(OCC(=O)NCCc2ccc(C(C)C)cc2)cccc1[N+](=O)[O-] ZINC000107676796 945747874 /nfs/dbraw/zinc/74/78/74/945747874.db2.gz RQYJNFOOUROVCM-UHFFFAOYSA-N 0 0 356.422 3.764 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)CCCc1cc(F)ccc1F ZINC000519778862 945755558 /nfs/dbraw/zinc/75/55/58/945755558.db2.gz NJLMQBSIEHDHQJ-UHFFFAOYSA-N 0 0 362.376 3.897 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C(=O)N2C[C@@H](C)OC3(CCCC3)C2)cc1Cl ZINC000843745796 945770534 /nfs/dbraw/zinc/77/05/34/945770534.db2.gz REJNXANZCMSLHY-GFCCVEGCSA-N 0 0 352.818 3.730 20 5 FHBDRN CC(C)c1ccc(C(=O)NCCc2ccc3n[nH]cc3c2)cc1[N+](=O)[O-] ZINC000519817771 945781735 /nfs/dbraw/zinc/78/17/35/945781735.db2.gz RIJJAZKNKIHXSF-UHFFFAOYSA-N 0 0 352.394 3.567 20 5 FHBDRN Cc1cc(N2CCN([C@@H](C)c3cccnc3)CC2)c(Cl)cc1[N+](=O)[O-] ZINC000301472360 945802202 /nfs/dbraw/zinc/80/22/02/945802202.db2.gz KSUBPUBKZLPSKQ-AWEZNQCLSA-N 0 0 360.845 3.835 20 5 FHBDRN COc1cc(NC[C@@H](CO)c2ccccc2Cl)c([N+](=O)[O-])cc1F ZINC000519844635 945813179 /nfs/dbraw/zinc/81/31/79/945813179.db2.gz QFAXSSBIGQOOLI-JTQLQIEISA-N 0 0 354.765 3.584 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@@H](CC(C)C)c1ccc(Cl)cc1 ZINC000121303449 945820929 /nfs/dbraw/zinc/82/09/29/945820929.db2.gz GVQCAOVKBCXXCV-HNNXBMFYSA-N 0 0 364.833 3.657 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C[S@@](=O)c1ccc(Br)cc1 ZINC000107941788 945829695 /nfs/dbraw/zinc/82/96/95/945829695.db2.gz GYSAJYJAXXSPNF-NRFANRHFSA-N 0 0 370.224 3.674 20 5 FHBDRN CCn1ccnc1[C@@H]1CCCCN1C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000281734549 945831699 /nfs/dbraw/zinc/83/16/99/945831699.db2.gz IYGDGUUGSADBLQ-INIZCTEOSA-N 0 0 367.409 3.660 20 5 FHBDRN Cc1cccc(CN(C)C(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)n1 ZINC000444087824 945837128 /nfs/dbraw/zinc/83/71/28/945837128.db2.gz LZWWJNBQASUYKO-UHFFFAOYSA-N 0 0 357.413 3.657 20 5 FHBDRN Cc1cc(Br)c(F)cc1NC(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000184157091 945843769 /nfs/dbraw/zinc/84/37/69/945843769.db2.gz BDCDFNGZIMUPIM-UHFFFAOYSA-N 0 0 367.174 3.986 20 5 FHBDRN CCN(Cc1ccc(C)cc1)C(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000519883828 945852118 /nfs/dbraw/zinc/85/21/18/945852118.db2.gz NZSPVFIGQAZPKA-UHFFFAOYSA-N 0 0 358.394 3.583 20 5 FHBDRN CC1(C)CC[C@@H](NC(=O)CNc2ccccc2[N+](=O)[O-])c2ccccc21 ZINC000519886154 945856013 /nfs/dbraw/zinc/85/60/13/945856013.db2.gz PAERJCNWOPCDHX-MRXNPFEDSA-N 0 0 353.422 3.936 20 5 FHBDRN CC(C)CN(Cc1ccccc1)S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000519889723 945859701 /nfs/dbraw/zinc/85/97/01/945859701.db2.gz HNAFVWAIZRRGHG-UHFFFAOYSA-N 0 0 362.451 3.583 20 5 FHBDRN Cc1ccc([C@H](C)N(C)S(=O)(=O)c2c(F)cccc2[N+](=O)[O-])c(C)c1 ZINC000519892220 945864606 /nfs/dbraw/zinc/86/46/06/945864606.db2.gz SJOKZTCYVFUTPT-ZDUSSCGKSA-N 0 0 366.414 3.732 20 5 FHBDRN O=C(Nc1ccc(Br)c([N+](=O)[O-])c1)c1cc(Cl)ccn1 ZINC000094188531 945874352 /nfs/dbraw/zinc/87/43/52/945874352.db2.gz IFRNBHVNLMSSND-UHFFFAOYSA-N 0 0 356.563 3.658 20 5 FHBDRN CCc1cccc2c1N(S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)CC2 ZINC000519910286 945878015 /nfs/dbraw/zinc/87/80/15/945878015.db2.gz MAPMVESVMQTMJO-UHFFFAOYSA-N 0 0 366.826 3.562 20 5 FHBDRN COc1cc(N2CCC[C@@H](c3ncc4n3CCCC4)C2)ccc1[N+](=O)[O-] ZINC000281834641 945881948 /nfs/dbraw/zinc/88/19/48/945881948.db2.gz IMWPSVZDERRNIO-CQSZACIVSA-N 0 0 356.426 3.520 20 5 FHBDRN CC(C)(C)OC(=O)CCCCOC(=O)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000785274817 945883514 /nfs/dbraw/zinc/88/35/14/945883514.db2.gz UNFWIPHPPVDHEZ-UHFFFAOYSA-N 0 0 359.325 3.542 20 5 FHBDRN COc1cc(C)c(S(=O)(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)c(C)c1 ZINC000545207622 945884173 /nfs/dbraw/zinc/88/41/73/945884173.db2.gz NMIKNCCBRIUCMZ-UHFFFAOYSA-N 0 0 364.423 3.638 20 5 FHBDRN C[C@H](C(=O)N[C@H]1CCO[C@@H](c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000248718914 945888502 /nfs/dbraw/zinc/88/85/02/945888502.db2.gz CCUVWPGRASYASL-ZUEVXXBESA-N 0 0 372.396 3.874 20 5 FHBDRN CCN(Cc1ccc(OC)cc1OC)C(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000519904847 945889535 /nfs/dbraw/zinc/88/95/35/945889535.db2.gz GNRWWARBWBYGJG-UHFFFAOYSA-N 0 0 373.409 3.974 20 5 FHBDRN C[C@@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccc(NC(=O)C2CC2)cc1 ZINC000045032791 945898790 /nfs/dbraw/zinc/89/87/90/945898790.db2.gz JUVGGNJZQAWSFJ-GFCCVEGCSA-N 0 0 368.393 3.826 20 5 FHBDRN Cc1[nH]c2c(cc(C)cc2CNC(=O)COc2cccc([N+](=O)[O-])c2)c1C ZINC000519945125 945917150 /nfs/dbraw/zinc/91/71/50/945917150.db2.gz DFMQEZPZUCTADL-UHFFFAOYSA-N 0 0 367.405 3.697 20 5 FHBDRN CCCN(C(=O)Cc1cc(F)cc2c1OCOC2)c1cccc([N+](=O)[O-])c1 ZINC000281911791 945917503 /nfs/dbraw/zinc/91/75/03/945917503.db2.gz SEZLJGGTRYIFMH-UHFFFAOYSA-N 0 0 374.368 3.586 20 5 FHBDRN COc1ccc(CCNC(=O)Nc2cc([N+](=O)[O-])ccc2C)c(Cl)c1 ZINC000473684972 945929273 /nfs/dbraw/zinc/92/92/73/945929273.db2.gz AMPAVXFYRCHVDT-UHFFFAOYSA-N 0 0 363.801 3.929 20 5 FHBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)N1CC[C@H](C2CCC2)C1 ZINC000665677613 945944969 /nfs/dbraw/zinc/94/49/69/945944969.db2.gz ABPBGGNRTCRLFK-KRWDZBQOSA-N 0 0 360.457 3.803 20 5 FHBDRN CN(C1CCC(C(C)(C)C)CC1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000519967738 945956987 /nfs/dbraw/zinc/95/69/87/945956987.db2.gz BLLUJIUMRBPGBZ-UHFFFAOYSA-N 0 0 354.472 3.820 20 5 FHBDRN CCN([C@H](C)c1ccc(F)cc1)S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000108415626 945959629 /nfs/dbraw/zinc/95/96/29/945959629.db2.gz IOQRUERHLPRRFF-CYBMUJFWSA-N 0 0 366.414 3.647 20 5 FHBDRN C[C@@H](C(=O)N1CCN(C2CC2)c2ccc(F)cc21)c1cccc([N+](=O)[O-])c1 ZINC000617766069 945969330 /nfs/dbraw/zinc/96/93/30/945969330.db2.gz NQVMXMVZJZMUAK-CYBMUJFWSA-N 0 0 369.396 3.853 20 5 FHBDRN O=C(N[C@H]1CCSC1)c1ccccc1Sc1ccccc1[N+](=O)[O-] ZINC000440863552 945970010 /nfs/dbraw/zinc/97/00/10/945970010.db2.gz CCFHKMHAVISCMV-LBPRGKRZSA-N 0 0 360.460 3.981 20 5 FHBDRN COc1cc(C(=O)N[C@@H]2CCCC[C@@H]2C(C)(C)C)c([N+](=O)[O-])cc1OC ZINC000074500521 945970764 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3.606 20 5 FHBDRN C[C@@H](Cc1ccsc1)NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000108656821 946034511 /nfs/dbraw/zinc/03/45/11/946034511.db2.gz BJFXBBLAHRQDLP-ZDUSSCGKSA-N 0 0 359.451 3.618 20 5 FHBDRN CCc1cccc2c1N(C(=O)COc1ccc([N+](=O)[O-])c(OC)c1)CCC2 ZINC000522874218 946039826 /nfs/dbraw/zinc/03/98/26/946039826.db2.gz GCAAJAHIYILBLA-UHFFFAOYSA-N 0 0 370.405 3.524 20 5 FHBDRN COc1ccc(OCC(=O)N(c2cccc([N+](=O)[O-])c2)C2CCCC2)cc1 ZINC000522874374 946040783 /nfs/dbraw/zinc/04/07/83/946040783.db2.gz PMNOADPBXJVSHH-UHFFFAOYSA-N 0 0 370.405 3.958 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)NCC1(c2ccc(F)cc2)CCC1 ZINC000522883884 946053602 /nfs/dbraw/zinc/05/36/02/946053602.db2.gz XQLCNEHPTCJIQX-UHFFFAOYSA-N 0 0 371.412 3.698 20 5 FHBDRN C[C@@H]1CCC[C@@H](CNC(=O)c2ccc3c(c2[N+](=O)[O-])OCCCO3)[C@H]1C ZINC001270823408 946056183 /nfs/dbraw/zinc/05/61/83/946056183.db2.gz TYHOAZNCYOWPKD-RDBSUJKOSA-N 0 0 362.426 3.558 20 5 FHBDRN O=C(N[C@H]1C[C@H]1c1c(F)cccc1F)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000522894721 946074609 /nfs/dbraw/zinc/07/46/09/946074609.db2.gz WCDBYHPUCUYBBV-RISCZKNCSA-N 0 0 352.724 3.812 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)Oc1ccc2c(c1)CCC2 ZINC000545250991 946093134 /nfs/dbraw/zinc/09/31/34/946093134.db2.gz CBYQZXMOISZMBL-CYBMUJFWSA-N 0 0 370.405 3.888 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])[C@@H](c1ccc(F)cc1)c1ncccn1 ZINC000066881669 946098512 /nfs/dbraw/zinc/09/85/12/946098512.db2.gz QJBRUYFEYMBJJT-SFHVURJKSA-N 0 0 352.369 3.745 20 5 FHBDRN C[C@@H](CC(=O)c1ccco1)NC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000444234033 946098993 /nfs/dbraw/zinc/09/89/93/946098993.db2.gz GCKREJOKJHREQI-ZDUSSCGKSA-N 0 0 374.396 3.666 20 5 FHBDRN Cc1n[nH]c(C(=O)NCCc2c(C)cc(C(C)(C)C)cc2C)c1[N+](=O)[O-] ZINC000522923635 946107965 /nfs/dbraw/zinc/10/79/65/946107965.db2.gz XXMSTNNWWQBQRT-UHFFFAOYSA-N 0 0 358.442 3.513 20 5 FHBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])OCC1CC(F)(F)C1 ZINC000837627556 946118789 /nfs/dbraw/zinc/11/87/89/946118789.db2.gz AZKGPLMYVLVYKF-UHFFFAOYSA-N 0 0 351.758 3.929 20 5 FHBDRN COc1cc(Nc2ccc(N3CCOCC3)c(C)c2)c([N+](=O)[O-])cc1OC ZINC000302101624 946121142 /nfs/dbraw/zinc/12/11/42/946121142.db2.gz VFTKUZUQEBZFGI-UHFFFAOYSA-N 0 0 373.409 3.501 20 5 FHBDRN CSc1cccc(C(=O)Nc2ccc(-c3ncon3)cc2)c1[N+](=O)[O-] ZINC000186448591 946122902 /nfs/dbraw/zinc/12/29/02/946122902.db2.gz MHXQZQBOKNQTKP-UHFFFAOYSA-N 0 0 356.363 3.619 20 5 FHBDRN CCN(C(=O)CCc1cc(F)ccc1[N+](=O)[O-])c1ccccc1C(=O)OC ZINC001126086717 946122855 /nfs/dbraw/zinc/12/28/55/946122855.db2.gz BEPKRYLGJLQWEC-UHFFFAOYSA-N 0 0 374.368 3.506 20 5 FHBDRN O=C(c1cccc2c(=O)c3cccc(F)c3[nH]c12)N1C[C@@H]2CCC[C@H]2C1 ZINC000444250243 946124707 /nfs/dbraw/zinc/12/47/07/946124707.db2.gz UFNVENXHVJFLRQ-STQMWFEESA-N 0 0 350.393 3.693 20 5 FHBDRN Cc1sc(C(=O)Nc2ccc3[nH]c([C@@H]4CCCO4)nc3c2)cc1[N+](=O)[O-] ZINC000109021545 946126333 /nfs/dbraw/zinc/12/63/33/946126333.db2.gz HPHWQYDDRFGRBW-AWEZNQCLSA-N 0 0 372.406 3.945 20 5 FHBDRN CC(=O)N[C@H](CC(=O)O[C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccc(C)cc1 ZINC000066877450 946130967 /nfs/dbraw/zinc/13/09/67/946130967.db2.gz PZUMEPXATCVSIU-IFXJQAMLSA-N 0 0 370.405 3.775 20 5 FHBDRN CSc1cccc(C(=O)N[C@@H](c2ccccc2)[C@@H]2CCCO2)c1[N+](=O)[O-] ZINC000186445581 946136777 /nfs/dbraw/zinc/13/67/77/946136777.db2.gz IXCNOXHFOGGSRB-RDJZCZTQSA-N 0 0 372.446 3.967 20 5 FHBDRN CCc1n[nH]c(C(=O)N2CCC[C@@H](C)[C@@H]2c2ccc(C)cc2)c1[N+](=O)[O-] ZINC000444257018 946139952 /nfs/dbraw/zinc/13/99/52/946139952.db2.gz OCJCSSNHWWRGJP-CXAGYDPISA-N 0 0 356.426 3.802 20 5 FHBDRN C[C@H](C1CC1)n1cc(NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)cn1 ZINC000186447271 946145186 /nfs/dbraw/zinc/14/51/86/946145186.db2.gz KLOOTIOYKBIGIH-SECBINFHSA-N 0 0 366.324 3.616 20 5 FHBDRN Cc1ccc([C@@H]2CCCN2C(=O)COc2ccc([N+](=O)[O-])cc2)cc1C ZINC000109126828 946153662 /nfs/dbraw/zinc/15/36/62/946153662.db2.gz RESWASWZPJYYDT-IBGZPJMESA-N 0 0 354.406 3.954 20 5 FHBDRN CCNc1ccc(C(=O)N[C@H](Cc2ccccc2)C2CC2)cc1[N+](=O)[O-] ZINC000522956658 946157184 /nfs/dbraw/zinc/15/71/84/946157184.db2.gz BLGCKORJOQMIJP-GOSISDBHSA-N 0 0 353.422 3.778 20 5 FHBDRN C[C@H](NC(=O)CC1CCCCC1)C(=O)O[C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000159941984 946174943 /nfs/dbraw/zinc/17/49/43/946174943.db2.gz PKLYNNAXFDCVSW-KBPBESRZSA-N 0 0 362.426 3.674 20 5 FHBDRN CCc1[nH]nc(C(=O)Nc2cccc(COC(C)(C)C)c2C)c1[N+](=O)[O-] ZINC000444285395 946175042 /nfs/dbraw/zinc/17/50/42/946175042.db2.gz WOKMGXBDHPXEPK-UHFFFAOYSA-N 0 0 360.414 3.756 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1)C(=O)N1CCC[C@@H]1c1cccc(Cl)c1 ZINC000121248194 946178795 /nfs/dbraw/zinc/17/87/95/946178795.db2.gz RBAVWXPYJODBEX-MRXNPFEDSA-N 0 0 373.796 3.550 20 5 FHBDRN C[C@H](C(=O)Nc1ccnn1-c1ccc([N+](=O)[O-])cc1)c1ccccc1F ZINC000109210665 946192036 /nfs/dbraw/zinc/19/20/36/946192036.db2.gz JRBOJCVTMDDNKX-LBPRGKRZSA-N 0 0 354.341 3.662 20 5 FHBDRN Cc1nc2ccccc2cc1C(=O)Nc1ccnn1-c1ccc([N+](=O)[O-])cc1 ZINC000109210990 946195276 /nfs/dbraw/zinc/19/52/76/946195276.db2.gz CRNONNPTUBVVSZ-UHFFFAOYSA-N 0 0 373.372 3.889 20 5 FHBDRN O=C(CCc1ccc(F)cc1)O[C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1 ZINC000759926730 946209179 /nfs/dbraw/zinc/20/91/79/946209179.db2.gz BQSQBNDXKMFIDC-JKSUJKDBSA-N 0 0 361.373 3.590 20 5 FHBDRN CC(C)(C)n1cc(NC(=O)c2ccc([N+](=O)[O-])cc2Br)cn1 ZINC000151876317 946214564 /nfs/dbraw/zinc/21/45/64/946214564.db2.gz VIILKAHAMWPQNN-UHFFFAOYSA-N 0 0 367.203 3.561 20 5 FHBDRN CC(C)(CCC(=O)N(CCc1ccc(Cl)cc1)CC1CC1)[N+](=O)[O-] ZINC001126100181 946230288 /nfs/dbraw/zinc/23/02/88/946230288.db2.gz GOZZKKIQMWFMFQ-UHFFFAOYSA-N 0 0 352.862 3.957 20 5 FHBDRN CCNC(=O)Nc1cccc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000109294875 946231454 /nfs/dbraw/zinc/23/14/54/946231454.db2.gz XPWGGDSKBRGLJX-UHFFFAOYSA-N 0 0 362.773 3.642 20 5 FHBDRN CSCc1cccc(CNc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)c1 ZINC000302505546 946237834 /nfs/dbraw/zinc/23/78/34/946237834.db2.gz QGGZLJQAKBKXCI-UHFFFAOYSA-N 0 0 357.435 3.955 20 5 FHBDRN COc1ccc(F)c(NC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)c1 ZINC000088226919 946239768 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CN1CCC[C@H](NC(=O)CSc2ccccc2[N+](=O)[O-])c2ccccc21 ZINC000456599605 946409317 /nfs/dbraw/zinc/40/93/17/946409317.db2.gz RTDJLTQVBZLRPD-HNNXBMFYSA-N 0 0 371.462 3.774 20 5 FHBDRN O=[N+]([O-])c1cccc(N2CCN(Cc3cc(-c4cccs4)on3)CC2)c1 ZINC000047743144 946416169 /nfs/dbraw/zinc/41/61/69/946416169.db2.gz NMCIVQNPPKCDPM-UHFFFAOYSA-N 0 0 370.434 3.634 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])Nc1ccc2c(c1)OC1(CCCC1)O2 ZINC000047748633 946418612 /nfs/dbraw/zinc/41/86/12/946418612.db2.gz XRBIPLXJVNAEJU-UHFFFAOYSA-N 0 0 369.377 3.958 20 5 FHBDRN CCNC(=O)N(C)c1cccc(NC/C=C\c2ccccc2[N+](=O)[O-])c1 ZINC000475490487 946424641 /nfs/dbraw/zinc/42/46/41/946424641.db2.gz CGIAFGKEPUMDMS-CLFYSBASSA-N 0 0 354.410 3.886 20 5 FHBDRN COc1ccc(Br)c(NC(=O)c2ccccc2[N+](=O)[O-])c1 ZINC000111324508 946427939 /nfs/dbraw/zinc/42/79/39/946427939.db2.gz IZMQAWRUOLWVOA-UHFFFAOYSA-N 0 0 351.156 3.618 20 5 FHBDRN CCO[C@@H](C)c1nc(CN(C)Cc2cc([N+](=O)[O-])ccc2OC)cs1 ZINC000441319789 946433647 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3.567 20 5 FHBDRN Cn1cc(N2CCC[C@H](Nc3c(Cl)cc([N+](=O)[O-])cc3Cl)C2)cn1 ZINC000475499077 946499083 /nfs/dbraw/zinc/49/90/83/946499083.db2.gz RVIVBIFBFPGVKC-JTQLQIEISA-N 0 0 370.240 3.716 20 5 FHBDRN CCc1ccc(CN2CCN(c3cccc(OC)c3[N+](=O)[O-])CC2)s1 ZINC000475499096 946499164 /nfs/dbraw/zinc/49/91/64/946499164.db2.gz SDFYMUNFAAYBRN-UHFFFAOYSA-N 0 0 361.467 3.550 20 5 FHBDRN CSc1cccc(C(=O)NC[C@H]2CCCO[C@H]2C(C)(C)C)c1[N+](=O)[O-] ZINC000186524250 946504877 /nfs/dbraw/zinc/50/48/77/946504877.db2.gz OZHHTTQXFYCDDI-MLGOLLRUSA-N 0 0 366.483 3.888 20 5 FHBDRN CCc1nc([C@@H](C)NC(=O)CCOc2cc(C)ccc2[N+](=O)[O-])cs1 ZINC000111672327 946509675 /nfs/dbraw/zinc/50/96/75/946509675.db2.gz SNEGMQMPVIFRID-GFCCVEGCSA-N 0 0 363.439 3.568 20 5 FHBDRN COc1ccc(Cl)cc1N(C)C(=O)c1ccc(OC)c([N+](=O)[O-])c1 ZINC000074608988 946518941 /nfs/dbraw/zinc/51/89/41/946518941.db2.gz MEPIRFOHJQBRQN-UHFFFAOYSA-N 0 0 350.758 3.542 20 5 FHBDRN COc1cc(F)c([C@@H](C)NC(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1OC ZINC000074610823 946519294 /nfs/dbraw/zinc/51/92/94/946519294.db2.gz IGSOJEWLANBVKH-LLVKDONJSA-N 0 0 362.357 3.551 20 5 FHBDRN C[C@@H](NCc1ccc([N+](=O)[O-])cc1F)c1ccc(Br)cn1 ZINC000475509794 946520683 /nfs/dbraw/zinc/52/06/83/946520683.db2.gz MXGQUABLNBRTRT-SECBINFHSA-N 0 0 354.179 3.742 20 5 FHBDRN Cc1ccc2c(CCNC(=O)Cc3cccc([N+](=O)[O-])c3C)cn(C)c2c1 ZINC000186551564 946535314 /nfs/dbraw/zinc/53/53/14/946535314.db2.gz BBPVPILFYHUEQM-UHFFFAOYSA-N 0 0 365.433 3.605 20 5 FHBDRN CSc1cccc(C(=O)NCC2(c3ccc(F)cc3)CC2)c1[N+](=O)[O-] ZINC000186158273 946540275 /nfs/dbraw/zinc/54/02/75/946540275.db2.gz OIYHQIQNYRNBGK-UHFFFAOYSA-N 0 0 360.410 3.917 20 5 FHBDRN C[C@H](CNC(=O)N1CC[C@](C)(C(F)(F)F)C1)c1ccccc1[N+](=O)[O-] ZINC000897050240 946549586 /nfs/dbraw/zinc/54/95/86/946549586.db2.gz POPKUGYFNKCUPP-ABAIWWIYSA-N 0 0 359.348 3.682 20 5 FHBDRN C[C@@H](CNC(=O)N[C@H](c1ccncc1)C1CC1)c1ccccc1[N+](=O)[O-] ZINC000897050346 946549806 /nfs/dbraw/zinc/54/98/06/946549806.db2.gz NNFVUDIJRZNMLC-UGSOOPFHSA-N 0 0 354.410 3.544 20 5 FHBDRN Cc1cncc([C@@H]2CCCN2C(=O)NC[C@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000897050879 946550849 /nfs/dbraw/zinc/55/08/49/946550849.db2.gz VTSKZUQEIDAHSQ-YJBOKZPZSA-N 0 0 368.437 3.948 20 5 FHBDRN CCc1cnc(CN(C)C(=O)NC[C@H](C)c2ccccc2[N+](=O)[O-])s1 ZINC000897068729 946563496 /nfs/dbraw/zinc/56/34/96/946563496.db2.gz YLBRITDRDWYKIJ-LBPRGKRZSA-N 0 0 362.455 3.559 20 5 FHBDRN O=C(OCc1cccc([N+](=O)[O-])c1)c1ccccc1OCc1cscn1 ZINC000125550212 946564879 /nfs/dbraw/zinc/56/48/79/946564879.db2.gz YSPFZGPZUNBOMS-UHFFFAOYSA-N 0 0 370.386 3.987 20 5 FHBDRN C[S@](=O)Cc1cc(NC(=O)c2c(F)cccc2[N+](=O)[O-])ccc1Cl ZINC001126132899 946565157 /nfs/dbraw/zinc/56/51/57/946565157.db2.gz OGWZEBLFGSYQPV-DEOSSOPVSA-N 0 0 370.789 3.518 20 5 FHBDRN CC(C)(C)c1ccc(NCc2ccc(S(C)(=O)=O)cc2)cc1[N+](=O)[O-] ZINC000520420799 946566655 /nfs/dbraw/zinc/56/66/55/946566655.db2.gz GXWUKUSIIZLBFG-UHFFFAOYSA-N 0 0 362.451 3.908 20 5 FHBDRN C[C@H](CNC(=O)N1CCC[C@H]1c1ccccn1)c1ccccc1[N+](=O)[O-] ZINC000897072223 946569617 /nfs/dbraw/zinc/56/96/17/946569617.db2.gz XIPAKRIULDBBCL-KDOFPFPSSA-N 0 0 354.410 3.640 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1cccc(Oc2ccccc2)c1 ZINC000148151619 946570991 /nfs/dbraw/zinc/57/09/91/946570991.db2.gz NUZGGRGUUBJTEV-UHFFFAOYSA-N 0 0 366.377 3.921 20 5 FHBDRN C[C@@H]1N(C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CCOC1(C)C ZINC000475184626 946576000 /nfs/dbraw/zinc/57/60/00/946576000.db2.gz MYLFTSYBKHYCEM-VIFPVBQESA-N 0 0 361.320 3.645 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C(=O)N2CCN(C)c3cc(F)ccc32)cc1Cl ZINC001126605272 946582713 /nfs/dbraw/zinc/58/27/13/946582713.db2.gz PNJOQZGLALLVOV-UHFFFAOYSA-N 0 0 363.776 3.792 20 5 FHBDRN O=[N+]([O-])c1ncccc1OCCOc1ccc(Cl)cc1Br ZINC000026044220 946582790 /nfs/dbraw/zinc/58/27/90/946582790.db2.gz CMLCIQRHSJPJFH-UHFFFAOYSA-N 0 0 373.590 3.864 20 5 FHBDRN C[C@@H](CNC(=O)N(C)Cc1ccc(Cl)nc1)c1ccccc1[N+](=O)[O-] ZINC000897076182 946582867 /nfs/dbraw/zinc/58/28/67/946582867.db2.gz VGERMQNKCFNDQN-LBPRGKRZSA-N 0 0 362.817 3.588 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2nnc(CN3Cc4ccccc4C4(CC4)C3)o2)cc1 ZINC000186171195 946584332 /nfs/dbraw/zinc/58/43/32/946584332.db2.gz YWOXHOIUOIDHFD-UHFFFAOYSA-N 0 0 362.389 3.692 20 5 FHBDRN O=C1CCc2cc(-c3noc(/C=C/c4ccc([N+](=O)[O-])cc4)n3)ccc2N1 ZINC000545770887 946586053 /nfs/dbraw/zinc/58/60/53/946586053.db2.gz UGIFOYJKHDKXJO-XCVCLJGOSA-N 0 0 362.345 3.700 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@H](c2cccc(Cl)c2)C1 ZINC000186184575 946588456 /nfs/dbraw/zinc/58/84/56/946588456.db2.gz YHQHSHXYGIANIG-KRWDZBQOSA-N 0 0 360.797 3.770 20 5 FHBDRN Cc1c(C(=O)N2CCO[C@H](c3cccc(Cl)c3)C2)cccc1[N+](=O)[O-] ZINC000186193628 946589232 /nfs/dbraw/zinc/58/92/32/946589232.db2.gz QONIESYOYIWGNC-KRWDZBQOSA-N 0 0 360.797 3.770 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2ncn(Cc3csc(Br)c3)n2)cc1 ZINC000523008522 946593020 /nfs/dbraw/zinc/59/30/20/946593020.db2.gz CIXCKFZLGLVGIL-UHFFFAOYSA-N 0 0 365.212 3.726 20 5 FHBDRN C[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccccc1-n1cccn1 ZINC000121384551 946602243 /nfs/dbraw/zinc/60/22/43/946602243.db2.gz GUMSCRIWWIJGFB-GFCCVEGCSA-N 0 0 370.796 3.925 20 5 FHBDRN CO[C@@H]1CCC[C@H](CC(=O)Nc2cc(C)nn2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000475536009 946606704 /nfs/dbraw/zinc/60/67/04/946606704.db2.gz ZZVYSMXHQOOUDJ-WMLDXEAASA-N 0 0 372.425 3.623 20 5 FHBDRN CCOC(=O)Nc1ccc(C(=O)N2c3ccc([N+](=O)[O-])cc3C[C@H]2C)cc1 ZINC000728810647 946607605 /nfs/dbraw/zinc/60/76/05/946607605.db2.gz URIYUKBDRVQWLP-GFCCVEGCSA-N 0 0 369.377 3.755 20 5 FHBDRN C[C@@H](Cc1ccc(Cl)cc1)c1nc(Cc2ccc([N+](=O)[O-])cn2)no1 ZINC000545777866 946610133 /nfs/dbraw/zinc/61/01/33/946610133.db2.gz XXMFHCNIUVGUMS-NSHDSACASA-N 0 0 358.785 3.963 20 5 FHBDRN Cc1ccccc1[C@H]1C[C@@H](C)N(C(=O)COc2ccc([N+](=O)[O-])cc2)C1 ZINC000523099288 946611742 /nfs/dbraw/zinc/61/17/42/946611742.db2.gz OYXYXQDHMZAHCQ-CVEARBPZSA-N 0 0 354.406 3.687 20 5 FHBDRN CSc1cccc(C(=O)N[C@@H](c2nc(C)cs2)C2CC2)c1[N+](=O)[O-] ZINC000186584256 946613953 /nfs/dbraw/zinc/61/39/53/946613953.db2.gz RXADGLMNRPWTCS-CYBMUJFWSA-N 0 0 363.464 3.963 20 5 FHBDRN CCOc1cc(CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])ccc1OC ZINC000074628889 946614300 /nfs/dbraw/zinc/61/43/00/946614300.db2.gz SDJXLELVIZPUFH-UHFFFAOYSA-N 0 0 364.785 3.586 20 5 FHBDRN Cc1cc(-c2noc(-c3cc([N+](=O)[O-])cn3C)n2)ccc1N1CC[C@H](C)C1 ZINC000545781579 946614410 /nfs/dbraw/zinc/61/44/10/946614410.db2.gz LPRPYLDMGTYEBA-LBPRGKRZSA-N 0 0 367.409 3.805 20 5 FHBDRN Cc1cc(N[C@@H](C[NH+]2CCCC2)c2ccccc2)cc(C(=O)[O-])c1[N+](=O)[O-] ZINC000567392622 946617761 /nfs/dbraw/zinc/61/77/61/946617761.db2.gz YAKYCVVMJFBHMP-SFHVURJKSA-N 0 0 369.421 3.850 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N1CCO[C@H](c2cccc(Cl)c2)C1 ZINC000186206161 946618682 /nfs/dbraw/zinc/61/86/82/946618682.db2.gz OSUXTUZIAFXWLZ-SFHVURJKSA-N 0 0 374.824 3.781 20 5 FHBDRN CCc1n[nH]c(C(=O)N2CCCC[C@@H]2CCCc2ccccc2)c1[N+](=O)[O-] ZINC000444329778 946621173 /nfs/dbraw/zinc/62/11/73/946621173.db2.gz KUDNYZAKGKVOMM-MRXNPFEDSA-N 0 0 370.453 3.898 20 5 FHBDRN COc1ccc(C(=O)N2CCC[C@@]2(C)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000186215459 946629749 /nfs/dbraw/zinc/62/97/49/946629749.db2.gz ABXOCNHEZGAAGF-FQEVSTJZSA-N 0 0 354.406 3.841 20 5 FHBDRN Cc1c(CC(=O)N2CCO[C@H](c3cccc(Cl)c3)C2)cccc1[N+](=O)[O-] ZINC000186220941 946631625 /nfs/dbraw/zinc/63/16/25/946631625.db2.gz WHCJLAJITZWUMJ-SFHVURJKSA-N 0 0 374.824 3.699 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CCCc3cc(N)ccc32)c1 ZINC000186596594 946636934 /nfs/dbraw/zinc/63/69/34/946636934.db2.gz KARAGKDCHZFKEH-INIZCTEOSA-N 0 0 357.435 3.706 20 5 FHBDRN Cc1cn2cc(NC(=O)[C@H](C)Sc3ccc([N+](=O)[O-])cc3)ccc2n1 ZINC000523009467 946637729 /nfs/dbraw/zinc/63/77/29/946637729.db2.gz LDSCZSMNYFMHKB-LBPRGKRZSA-N 0 0 356.407 3.670 20 5 FHBDRN COc1ccc(OC)c(CNC(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)c1 ZINC000475555699 946640064 /nfs/dbraw/zinc/64/00/64/946640064.db2.gz NCLLHZYSKKPEFW-UHFFFAOYSA-N 0 0 359.382 3.551 20 5 FHBDRN CCNc1ccc(C(=O)Nc2ccc(NC(C)=O)c(C)c2)cc1[N+](=O)[O-] ZINC000893509859 946640211 /nfs/dbraw/zinc/64/02/11/946640211.db2.gz CXVBHVAYWBWWBQ-UHFFFAOYSA-N 0 0 356.382 3.546 20 5 FHBDRN CCS[C@H]1CCCCN(CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000112089491 946659034 /nfs/dbraw/zinc/65/90/34/946659034.db2.gz AVNHZQQONURNNA-ZDUSSCGKSA-N 0 0 371.890 3.794 20 5 FHBDRN CCC(CC)(CO)CNC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000475192065 946662345 /nfs/dbraw/zinc/66/23/45/946662345.db2.gz PXNPXMFBIUAJKG-UHFFFAOYSA-N 0 0 363.336 3.534 20 5 FHBDRN COc1ccc(CN2CCC[C@@H]2c2nc3c(n2C)CCCC3)cc1[N+](=O)[O-] ZINC000614771256 946666311 /nfs/dbraw/zinc/66/63/11/946666311.db2.gz CQOOMMMNIQSATI-QGZVFWFLSA-N 0 0 370.453 3.553 20 5 FHBDRN COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1NCc1noc2ccccc12 ZINC000550339600 946666329 /nfs/dbraw/zinc/66/63/29/946666329.db2.gz SHEGSSACRIDMBF-UHFFFAOYSA-N 0 0 361.741 3.788 20 5 FHBDRN COc1ccc2c(c1)CCN(C(=O)Nc1cc(C)c([N+](=O)[O-])cc1C)CC2 ZINC000475567297 946668310 /nfs/dbraw/zinc/66/83/10/946668310.db2.gz KONAXVWFFVNWPN-UHFFFAOYSA-N 0 0 369.421 3.853 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)CC(=O)c1ccco1 ZINC000121420365 946680601 /nfs/dbraw/zinc/68/06/01/946680601.db2.gz BKPCGWMOYMDQQP-NSHDSACASA-N 0 0 362.407 3.691 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N[C@H](C)COc1cccc(F)c1 ZINC000475569772 946693457 /nfs/dbraw/zinc/69/34/57/946693457.db2.gz QMMLRMWOAFPTMU-CYBMUJFWSA-N 0 0 361.373 3.940 20 5 FHBDRN Cc1nn(CC(=O)N(Cc2ccccc2)C(C)C)c2ccc([N+](=O)[O-])cc12 ZINC000432232953 946701367 /nfs/dbraw/zinc/70/13/67/946701367.db2.gz OXXAWHQGJLSVJJ-UHFFFAOYSA-N 0 0 366.421 3.690 20 5 FHBDRN COc1ccc(-c2ccc(CN3CCOCC34CCC4)o2)c([N+](=O)[O-])c1 ZINC000093510203 946707141 /nfs/dbraw/zinc/70/71/41/946707141.db2.gz WZBNWWIWIUJQIH-UHFFFAOYSA-N 0 0 358.394 3.618 20 5 FHBDRN O=C(c1cnc([C@H]2CCCO2)s1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000129726214 946710854 /nfs/dbraw/zinc/71/08/54/946710854.db2.gz ALGHEQUMYNVHFC-OAHLLOKOSA-N 0 0 373.434 3.708 20 5 FHBDRN O=C(NCCOC1CCCC1)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000475210363 946725347 /nfs/dbraw/zinc/72/53/47/946725347.db2.gz IOXSZBIYRODNGR-UHFFFAOYSA-N 0 0 361.320 3.694 20 5 FHBDRN O=C(Nc1cc(-c2ccccc2)on1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088391005 946738395 /nfs/dbraw/zinc/73/83/95/946738395.db2.gz IWPJCNLTURESOM-UHFFFAOYSA-N 0 0 364.361 3.840 20 5 FHBDRN O=C(Nc1ccc2c(c1)C(=O)CCC2)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088393036 946742162 /nfs/dbraw/zinc/74/21/62/946742162.db2.gz VUJVRDODSQMTBQ-UHFFFAOYSA-N 0 0 365.389 3.704 20 5 FHBDRN CC(C)CCSc1ccc(C(=O)N2CC[C@H](O)[C@H](C)C2)cc1[N+](=O)[O-] ZINC000186631245 946747450 /nfs/dbraw/zinc/74/74/50/946747450.db2.gz ROWUYMLVKWRICX-CJNGLKHVSA-N 0 0 366.483 3.576 20 5 FHBDRN COc1ccc2c(c1)CN(C(=O)c1cccc(SC)c1[N+](=O)[O-])CC2 ZINC000186274537 946749019 /nfs/dbraw/zinc/74/90/19/946749019.db2.gz PXQZPZQOSSCQNS-UHFFFAOYSA-N 0 0 358.419 3.524 20 5 FHBDRN CCSCC[C@@H](C)N(C)C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000183058965 946753604 /nfs/dbraw/zinc/75/36/04/946753604.db2.gz BLGFXTOEDGWEKQ-SNVBAGLBSA-N 0 0 362.398 3.800 20 5 FHBDRN CCOc1cc(C(=O)N[C@H](c2ccccc2)C2CC2)c([N+](=O)[O-])cc1OC ZINC000025879819 946756788 /nfs/dbraw/zinc/75/67/88/946756788.db2.gz CLTFQLTVZSQKJK-LJQANCHMSA-N 0 0 370.405 3.883 20 5 FHBDRN CC[C@H](C)C(=O)Nc1cccc(CNC(=O)c2cccc([N+](=O)[O-])c2)c1 ZINC000049087309 946757013 /nfs/dbraw/zinc/75/70/13/946757013.db2.gz AAEUSSAUKDFWGB-ZDUSSCGKSA-N 0 0 355.394 3.509 20 5 FHBDRN Cc1ccccc1[C@@H]1CCCN1S(=O)(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000151994095 946771302 /nfs/dbraw/zinc/77/13/02/946771302.db2.gz VUOYXSMJFKTKEO-SFHVURJKSA-N 0 0 360.435 3.570 20 5 FHBDRN CCC(C)(C)[C@H]1CCCN1C(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000134025602 946775198 /nfs/dbraw/zinc/77/51/98/946775198.db2.gz ZNRWYRWOGSJLDR-QGZVFWFLSA-N 0 0 356.426 3.821 20 5 FHBDRN C[C@@H](CNC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1)Oc1ccccc1 ZINC000121455154 946775580 /nfs/dbraw/zinc/77/55/80/946775580.db2.gz VQKVJCXWKZAPNZ-HNNXBMFYSA-N 0 0 369.421 3.736 20 5 FHBDRN Nc1ccc2c(c1)CCC[C@H]2NC(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000186652468 946783874 /nfs/dbraw/zinc/78/38/74/946783874.db2.gz RNULPGWMNOHRNZ-LJQANCHMSA-N 0 0 368.437 3.563 20 5 FHBDRN CC(C)(C)OC(=O)c1ccsc1NC(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000184454929 946789951 /nfs/dbraw/zinc/78/99/51/946789951.db2.gz KXUHOXFCUSGBBP-UHFFFAOYSA-N 0 0 362.407 3.793 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@H](c1ccccc1C)C(C)C ZINC000112222049 946802867 /nfs/dbraw/zinc/80/28/67/946802867.db2.gz DVFWFWSUEYEITG-SFHVURJKSA-N 0 0 369.421 3.664 20 5 FHBDRN O=[N+]([O-])c1cc(Br)cnc1N1CC[C@H](c2ccccc2F)C1 ZINC000549577119 946831824 /nfs/dbraw/zinc/83/18/24/946831824.db2.gz HXBAFJQRYPZXRK-JTQLQIEISA-N 0 0 366.190 3.885 20 5 FHBDRN O=[N+]([O-])c1cc(Br)cnc1N1CC[C@@H](c2ccccc2F)C1 ZINC000549577120 946832423 /nfs/dbraw/zinc/83/24/23/946832423.db2.gz HXBAFJQRYPZXRK-SNVBAGLBSA-N 0 0 366.190 3.885 20 5 FHBDRN Cc1csc([C@H](C)NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)n1 ZINC000546535342 946835175 /nfs/dbraw/zinc/83/51/75/946835175.db2.gz SNQBEJCOSGVDGO-JTQLQIEISA-N 0 0 351.403 3.654 20 5 FHBDRN COc1ccccc1[C@@H]1CCCN1C(=O)c1cccc([N+](=O)[O-])c1OC ZINC000475597745 946836687 /nfs/dbraw/zinc/83/66/87/946836687.db2.gz AXHNDAPKFOXFLA-HNNXBMFYSA-N 0 0 356.378 3.589 20 5 FHBDRN C[C@H]1CC[C@@H](CNC(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC000475303776 946845627 /nfs/dbraw/zinc/84/56/27/946845627.db2.gz NYPGUATZSJGVQV-LSDHHAIUSA-N 0 0 361.442 3.584 20 5 FHBDRN Cc1cccc(CN(Cc2ccccn2)C(=O)c2ccc([N+](=O)[O-])o2)c1 ZINC000112288078 946846034 /nfs/dbraw/zinc/84/60/34/946846034.db2.gz BTFHBZBTNSTBRP-UHFFFAOYSA-N 0 0 351.362 3.734 20 5 FHBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)c1ccc2[nH]c3c(c2c1)CCCC3 ZINC000536277632 946870081 /nfs/dbraw/zinc/87/00/81/946870081.db2.gz COLIPSXKAIVYJI-UHFFFAOYSA-N 0 0 363.417 3.927 20 5 FHBDRN CCNc1ccc(C(=O)N2CC[C@H](c3ccccc3OC)C2)cc1[N+](=O)[O-] ZINC000523126001 946885002 /nfs/dbraw/zinc/88/50/02/946885002.db2.gz YZEAVOBCSGUZJR-HNNXBMFYSA-N 0 0 369.421 3.665 20 5 FHBDRN C[C@@H]1CC[C@@H](NC(=O)c2cc(F)cc3c(=O)c4cccc(F)c4[nH]c23)C1 ZINC000444468761 946889854 /nfs/dbraw/zinc/88/98/54/946889854.db2.gz RIJXERGFVLKURF-ZYHUDNBSSA-N 0 0 356.372 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Cc1cc(C)cc(CN(C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)c1 ZINC000444710298 947139066 /nfs/dbraw/zinc/13/90/66/947139066.db2.gz UZAOLLRROOXMMN-UHFFFAOYSA-N 0 0 352.394 3.894 20 5 FHBDRN CCCN(C(=O)[C@@H]1Oc2ccccc2O[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000441433723 947144646 /nfs/dbraw/zinc/14/46/46/947144646.db2.gz GZZQVYSHNCXDQJ-SCLBCKFNSA-N 0 0 356.378 3.566 20 5 FHBDRN O=C(NCCNc1ccccc1[N+](=O)[O-])c1cccc(-c2ccoc2)c1 ZINC000536299090 947144787 /nfs/dbraw/zinc/14/47/87/947144787.db2.gz AKQLXPQCELTIGJ-UHFFFAOYSA-N 0 0 351.362 3.697 20 5 FHBDRN Cc1cc(CN(C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)ccc1F ZINC000444736555 947152015 /nfs/dbraw/zinc/15/20/15/947152015.db2.gz AAODJRVQERTSHO-UHFFFAOYSA-N 0 0 356.357 3.724 20 5 FHBDRN CCOC(=O)[C@@H]1CCN(Cc2ccc(OC)c([N+](=O)[O-])c2)c2ccccc21 ZINC000444725000 947168059 /nfs/dbraw/zinc/16/80/59/947168059.db2.gz MBQVVVPKMZXWMJ-MRXNPFEDSA-N 0 0 370.405 3.660 20 5 FHBDRN CC(C)[C@H]1CCCN([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000444771296 947207754 /nfs/dbraw/zinc/20/77/54/947207754.db2.gz OQVJZXFIXSFPAG-OLZOCXBDSA-N 0 0 353.850 3.943 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc2c(c1)ncn2C ZINC000440546389 947209047 /nfs/dbraw/zinc/20/90/47/947209047.db2.gz MWSSWUGMSVYBDV-NSHDSACASA-N 0 0 356.407 3.601 20 5 FHBDRN Cc1ccc(F)c(-c2cc(NC(=O)c3n[nH]c(C(C)C)c3[N+](=O)[O-])n[nH]2)c1 ZINC000444808797 947223532 /nfs/dbraw/zinc/22/35/32/947223532.db2.gz AQKPSBOFAXAKEG-UHFFFAOYSA-N 0 0 372.360 3.531 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(Cl)c1NCCS(=O)(=O)c1ccc(F)cc1 ZINC000444822627 947236725 /nfs/dbraw/zinc/23/67/25/947236725.db2.gz AMZYNZVSTWXYBN-UHFFFAOYSA-N 0 0 372.805 3.582 20 5 FHBDRN O=C(Nc1nc2ccccc2[nH]1)c1sc(Br)cc1[N+](=O)[O-] ZINC000444823864 947237791 /nfs/dbraw/zinc/23/77/91/947237791.db2.gz GZGCEJYXKLSQNP-UHFFFAOYSA-N 0 0 367.184 3.547 20 5 FHBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H](O)C(C)(C)C1 ZINC000438529107 947239671 /nfs/dbraw/zinc/23/96/71/947239671.db2.gz SHAXVJCKCNRWBK-INIZCTEOSA-N 0 0 366.483 3.576 20 5 FHBDRN CN(Cc1ccc(F)cc1)C(=O)c1sc(Br)cc1[N+](=O)[O-] ZINC000444825481 947241193 /nfs/dbraw/zinc/24/11/93/947241193.db2.gz DXQYMDCVQMCCGO-UHFFFAOYSA-N 0 0 373.203 3.830 20 5 FHBDRN CC[C@H](C)[C@H]1CCCCN1S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000523418423 947248004 /nfs/dbraw/zinc/24/80/04/947248004.db2.gz RJNGSUYJOXBZKI-WCQYABFASA-N 0 0 360.863 3.838 20 5 FHBDRN Cn1ccnc1[C@@H](NCc1ccccc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000509614142 947252544 /nfs/dbraw/zinc/25/25/44/947252544.db2.gz AXHQNQWUPUODRP-KRWDZBQOSA-N 0 0 356.813 3.861 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)Nc1cccc(OCC(C)C)c1 ZINC000125663915 947256087 /nfs/dbraw/zinc/25/60/87/947256087.db2.gz SVWDGVSERRIISR-UHFFFAOYSA-N 0 0 371.393 3.515 20 5 FHBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1OC(=O)c1ccnc(-n2cccc2)c1 ZINC001126195085 947259675 /nfs/dbraw/zinc/25/96/75/947259675.db2.gz LDDKEAZDFPZNKX-UHFFFAOYSA-N 0 0 357.753 3.962 20 5 FHBDRN CN(CCCOCc1ccccc1)C(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000384243292 947260387 /nfs/dbraw/zinc/26/03/87/947260387.db2.gz MGOQOTGETWNRQR-UHFFFAOYSA-N 0 0 362.813 3.927 20 5 FHBDRN O=C(c1sc(Br)cc1[N+](=O)[O-])N1CCc2sccc2C1 ZINC000444830779 947263068 /nfs/dbraw/zinc/26/30/68/947263068.db2.gz VSONEOYNZBCZSI-UHFFFAOYSA-N 0 0 373.253 3.679 20 5 FHBDRN CCOc1cccc([C@@H](C)NC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)c1 ZINC000087069485 947286168 /nfs/dbraw/zinc/28/61/68/947286168.db2.gz DAIHUCLDKHKAHB-CQSZACIVSA-N 0 0 369.421 3.822 20 5 FHBDRN CC(C)Oc1cccc(CN(C)C(=O)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000123555617 947297629 /nfs/dbraw/zinc/29/76/29/947297629.db2.gz PVEQFQVOYAHXCQ-UHFFFAOYSA-N 0 0 356.422 3.973 20 5 FHBDRN O=C(COc1cc(Cl)ccc1[N+](=O)[O-])Nc1cccc2c1N=S=N2 ZINC000121294900 947298964 /nfs/dbraw/zinc/29/89/64/947298964.db2.gz SDCFBVFBPHDAQY-UHFFFAOYSA-N 0 0 364.770 3.992 20 5 FHBDRN CC(C)(C)OCCNC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000519919441 947299136 /nfs/dbraw/zinc/29/91/36/947299136.db2.gz NNRIYOQXWBDGOR-UHFFFAOYSA-N 0 0 357.410 3.883 20 5 FHBDRN CC(C)(C(=O)NCc1ccc(OC(F)F)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000523484841 947301419 /nfs/dbraw/zinc/30/14/19/947301419.db2.gz MIJDCOLNUPWFTH-UHFFFAOYSA-N 0 0 364.348 3.790 20 5 FHBDRN CC(C)[C@H](Cc1ccccc1)C(=O)NCCOc1ccc([N+](=O)[O-])cc1 ZINC000523486086 947303054 /nfs/dbraw/zinc/30/30/54/947303054.db2.gz SJVWIWCNJNYUPK-IBGZPJMESA-N 0 0 356.422 3.605 20 5 FHBDRN O=[N+]([O-])c1c(N2CCn3c(cc4c3cccc4Cl)C2)nc2sccn21 ZINC000444882104 947306771 /nfs/dbraw/zinc/30/67/71/947306771.db2.gz ZMZOBJJDEFERMF-UHFFFAOYSA-N 0 0 373.825 3.932 20 5 FHBDRN CC1CCN(c2cccc(NC(=O)COc3cccc([N+](=O)[O-])c3)c2)CC1 ZINC000523494309 947311300 /nfs/dbraw/zinc/31/13/00/947311300.db2.gz YMGMXWJQAORMPE-UHFFFAOYSA-N 0 0 369.421 3.849 20 5 FHBDRN CC(C)(C(=O)NCc1c(F)cccc1Cl)c1ccc([N+](=O)[O-])cc1 ZINC000523497610 947316739 /nfs/dbraw/zinc/31/67/39/947316739.db2.gz VHNGGBNWKAZTBA-UHFFFAOYSA-N 0 0 350.777 3.981 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NCCc1c[nH]c2cc(F)ccc12 ZINC000444899415 947320692 /nfs/dbraw/zinc/32/06/92/947320692.db2.gz QCJOVGFLFHHUDP-UHFFFAOYSA-N 0 0 372.356 3.588 20 5 FHBDRN COc1cc(C)c(NC(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)cc1F ZINC000186423941 947320691 /nfs/dbraw/zinc/32/06/91/947320691.db2.gz NQQHBJYGUKBEJS-JTQLQIEISA-N 0 0 350.321 3.932 20 5 FHBDRN C[C@H](C1CC1)n1cc(NC(=O)c2ccc([N+](=O)[O-])c3cccnc23)cn1 ZINC000186429056 947321211 /nfs/dbraw/zinc/32/12/11/947321211.db2.gz SPJCMHQIVDNPDA-LLVKDONJSA-N 0 0 351.366 3.563 20 5 FHBDRN CCO[C@H](C(=O)NCCCNc1ccc(C)cc1[N+](=O)[O-])c1ccccc1 ZINC000523511966 947325453 /nfs/dbraw/zinc/32/54/53/947325453.db2.gz BRAJGBZHLZJDEK-IBGZPJMESA-N 0 0 371.437 3.599 20 5 FHBDRN COc1ccc(CSCC(=O)N[C@H]2C[C@H](C)C[C@H](C)C2)cc1[N+](=O)[O-] ZINC000523512840 947326151 /nfs/dbraw/zinc/32/61/51/947326151.db2.gz UZTZXBXGIUGLDA-NHAGDIPZSA-N 0 0 366.483 3.778 20 5 FHBDRN C[C@@H](NC(=O)c1cc(F)cc([N+](=O)[O-])c1)c1ncc(-c2ccccc2)o1 ZINC000523515410 947326691 /nfs/dbraw/zinc/32/66/91/947326691.db2.gz HOUYSRPDJOELMZ-LLVKDONJSA-N 0 0 355.325 3.880 20 5 FHBDRN CCS[C@H]1CCCC[C@@H]1NC(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000444895127 947332814 /nfs/dbraw/zinc/33/28/14/947332814.db2.gz JTCFKKMGTSPVMD-ZFWWWQNUSA-N 0 0 353.444 3.789 20 5 FHBDRN CC(C)(C(=O)NCc1ccccc1OCC1CC1)c1ccc([N+](=O)[O-])cc1 ZINC000523501846 947333052 /nfs/dbraw/zinc/33/30/52/947333052.db2.gz WEJOSCXVHQJWKT-UHFFFAOYSA-N 0 0 368.433 3.978 20 5 FHBDRN C[C@@H]1C[C@@H](NC(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C[C@H](C)O1 ZINC000249347066 947333703 /nfs/dbraw/zinc/33/37/03/947333703.db2.gz OQLOLXWNDQBFFI-DOFRTFSJSA-N 0 0 361.320 3.691 20 5 FHBDRN CCOc1c(OC)cc(CNc2c(F)cc([N+](=O)[O-])cc2F)cc1OC ZINC000440588397 947335202 /nfs/dbraw/zinc/33/52/02/947335202.db2.gz LDTVIFUJEGNCLM-UHFFFAOYSA-N 0 0 368.336 3.901 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@H]1CCO[C@@H]1c1ccccc1 ZINC000444896900 947335930 /nfs/dbraw/zinc/33/59/30/947335930.db2.gz DICXNLGPDRDVSB-RDTXWAMCSA-N 0 0 371.393 3.503 20 5 FHBDRN Cc1cccc(C(=O)N[C@H](C)c2ccc(-n3cccn3)cc2)c1[N+](=O)[O-] ZINC000440592578 947336282 /nfs/dbraw/zinc/33/62/82/947336282.db2.gz CEYHMAAPYYPFPY-CQSZACIVSA-N 0 0 350.378 3.580 20 5 FHBDRN COc1ccccc1CC(C)(C)NC(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000444897034 947336457 /nfs/dbraw/zinc/33/64/57/947336457.db2.gz DTMSKRJESYXMPO-UHFFFAOYSA-N 0 0 373.409 3.755 20 5 FHBDRN CCOCCC1(CNC(=O)c2ccc(OCC)c([N+](=O)[O-])c2)CCCC1 ZINC000150779315 947336605 /nfs/dbraw/zinc/33/66/05/947336605.db2.gz HQBDNIMNGFRGKR-UHFFFAOYSA-N 0 0 364.442 3.710 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H](C)COc1cccc(C)c1 ZINC000444923904 947341657 /nfs/dbraw/zinc/34/16/57/947341657.db2.gz RNDZSBMELUPCQF-ZDUSSCGKSA-N 0 0 359.382 3.501 20 5 FHBDRN CSc1cccc(C(=O)N[C@@H]2CCCOc3ccccc32)c1[N+](=O)[O-] ZINC000186432478 947342288 /nfs/dbraw/zinc/34/22/88/947342288.db2.gz IOIDHRNLPAXKCX-CQSZACIVSA-N 0 0 358.419 3.960 20 5 FHBDRN CC[C@@H](c1ccncc1)N(CC)C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000523533381 947342501 /nfs/dbraw/zinc/34/25/01/947342501.db2.gz DYBGASUBCXXVGD-SFHVURJKSA-N 0 0 366.421 3.944 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cnn([C@@H](C)C2CC2)c1 ZINC000186433044 947343545 /nfs/dbraw/zinc/34/35/45/947343545.db2.gz RITHKNWTXYIZKE-RYUDHWBXSA-N 0 0 360.439 3.882 20 5 FHBDRN O=C(Nc1ccc2cc([N+](=O)[O-])ccc2n1)[C@@H]1C[C@H]1c1c(F)cccc1F ZINC000440607093 947357333 /nfs/dbraw/zinc/35/73/33/947357333.db2.gz APXXUOGWTQFROZ-CHWSQXEVSA-N 0 0 369.327 3.585 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[C@@H](c2cccc(C)c2)C1 ZINC000444935987 947358142 /nfs/dbraw/zinc/35/81/42/947358142.db2.gz IRLVYASNRUEUBH-OAHLLOKOSA-N 0 0 355.394 3.933 20 5 FHBDRN CC[C@@H]1CN(c2cc(C)c(C(F)(F)F)cc2[N+](=O)[O-])C[C@@H](C)[S@@]1=O ZINC000549582649 947371025 /nfs/dbraw/zinc/37/10/25/947371025.db2.gz MXUZKQZRLVUVKS-JEKXNZCQSA-N 0 0 364.389 3.658 20 5 FHBDRN CC[C@@H]1CN(c2cc(C)c(C(F)(F)F)cc2[N+](=O)[O-])C[C@@H](C)[S@]1=O ZINC000549582647 947376694 /nfs/dbraw/zinc/37/66/94/947376694.db2.gz MXUZKQZRLVUVKS-UTDUZKHQSA-N 0 0 364.389 3.658 20 5 FHBDRN O=C(Nc1ccc(-c2n[nH]c(C3CC3)n2)cc1)c1csc([N+](=O)[O-])c1 ZINC000523569279 947378434 /nfs/dbraw/zinc/37/84/34/947378434.db2.gz QAIRQEFILPNEFX-UHFFFAOYSA-N 0 0 355.379 3.571 20 5 FHBDRN Cc1ccc([C@@H]2[C@@H](C)CCCN2C(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)cc1 ZINC000444997863 947392565 /nfs/dbraw/zinc/39/25/65/947392565.db2.gz QBGAEOCHRYKKEY-GUYCJALGSA-N 0 0 355.394 3.617 20 5 FHBDRN O=C(Nc1ccc2cc([N+](=O)[O-])ccc2n1)C12CC3CC(CC(C3)C1)C2 ZINC000440615860 947392500 /nfs/dbraw/zinc/39/25/00/947392500.db2.gz QFNRMNCOHJVMEH-UHFFFAOYSA-N 0 0 351.406 3.720 20 5 FHBDRN Cc1cc2cc[nH]c2cc1NC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000444979357 947394325 /nfs/dbraw/zinc/39/43/25/947394325.db2.gz YZIROOYMVXKEOI-UHFFFAOYSA-N 0 0 350.378 3.975 20 5 FHBDRN O=C(N[C@@H]1CCc2c1cccc2O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000523581013 947397566 /nfs/dbraw/zinc/39/75/66/947397566.db2.gz FWCZGDIXOKRDQF-CQSZACIVSA-N 0 0 354.387 3.932 20 5 FHBDRN COc1ccc(CNC(=O)N(C)[C@@H](C)Cc2ccccc2C)cc1[N+](=O)[O-] ZINC000444990334 947403250 /nfs/dbraw/zinc/40/32/50/947403250.db2.gz SNDRKMJBRFXEEF-HNNXBMFYSA-N 0 0 371.437 3.684 20 5 FHBDRN O=[N+]([O-])c1cccc(CS(=O)(=O)N2CCCC[C@@H]2c2ccccc2)c1 ZINC000546266889 947404042 /nfs/dbraw/zinc/40/40/42/947404042.db2.gz KYPYAFWEHTZPHS-GOSISDBHSA-N 0 0 360.435 3.652 20 5 FHBDRN Cc1nc(C)c(CNC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)s1 ZINC000444993768 947407052 /nfs/dbraw/zinc/40/70/52/947407052.db2.gz BETITMAIKLQRDL-UHFFFAOYSA-N 0 0 363.442 3.685 20 5 FHBDRN CSc1cccc(C(=O)NCc2nc(C(C)C)cs2)c1[N+](=O)[O-] ZINC000188222722 947459488 /nfs/dbraw/zinc/45/94/88/947459488.db2.gz LCJSDENLHLOSOH-UHFFFAOYSA-N 0 0 351.453 3.827 20 5 FHBDRN CC(C)[C@@H](c1ccccc1)N(C)C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000523650207 947462987 /nfs/dbraw/zinc/46/29/87/947462987.db2.gz VAGVAXUICIPQHC-SFHVURJKSA-N 0 0 356.378 3.793 20 5 FHBDRN CC(C)(NC(=O)NC[C@H]1CCCCC1(F)F)c1ccccc1[N+](=O)[O-] ZINC000458955308 947472169 /nfs/dbraw/zinc/47/21/69/947472169.db2.gz WLBQOXWSCAWAOK-GFCCVEGCSA-N 0 0 355.385 3.955 20 5 FHBDRN CC(C)c1ncc(CN(C)c2cc(C(F)(F)F)ncc2[N+](=O)[O-])cn1 ZINC000440642710 947475076 /nfs/dbraw/zinc/47/50/76/947475076.db2.gz FEAKCKDKWGNJNP-UHFFFAOYSA-N 0 0 355.320 3.558 20 5 FHBDRN Cc1ccccc1C[C@@H](C)N(C)C(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000445073404 947488301 /nfs/dbraw/zinc/48/83/01/947488301.db2.gz KBNXZDIGMZJRFX-MRXNPFEDSA-N 0 0 355.438 3.718 20 5 FHBDRN Cc1cc(OCC(=O)N(Cc2ccc(F)cc2)CC2CC2)ccc1[N+](=O)[O-] ZINC001126208387 947488542 /nfs/dbraw/zinc/48/85/42/947488542.db2.gz ILTYNUKDTKBQRV-UHFFFAOYSA-N 0 0 372.396 3.860 20 5 FHBDRN COc1cc(CNC(C)(C)c2nc3ccccc3n2C)ccc1[N+](=O)[O-] ZINC000473164071 947510029 /nfs/dbraw/zinc/51/00/29/947510029.db2.gz UWKJYLLODIYVCK-UHFFFAOYSA-N 0 0 354.410 3.515 20 5 FHBDRN C[C@H](CCC1CCCCC1)NC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000523709318 947519081 /nfs/dbraw/zinc/51/90/81/947519081.db2.gz ODRJPWNPCXSZMI-CQSZACIVSA-N 0 0 371.441 3.654 20 5 FHBDRN C[C@@H](NC(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@H](C)C1CCCCC1 ZINC000445108311 947521153 /nfs/dbraw/zinc/52/11/53/947521153.db2.gz JLQCEDNLIVZGKW-QWHCGFSZSA-N 0 0 373.457 3.875 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)N1CCC[C@@H]1C[C@H](O)c1ccc(F)cc1 ZINC000162830233 947524151 /nfs/dbraw/zinc/52/41/51/947524151.db2.gz QWPGGTLMQBXXEN-MSOLQXFVSA-N 0 0 373.384 3.854 20 5 FHBDRN O=C(c1ccc(F)cc1[N+](=O)[O-])N1CC[C@H](OCCCc2ccccc2)C1 ZINC000150782687 947533445 /nfs/dbraw/zinc/53/34/45/947533445.db2.gz XQLKJVUYUOEOID-KRWDZBQOSA-N 0 0 372.396 3.598 20 5 FHBDRN CC[C@H](SC)C(=O)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F ZINC000128522321 947543975 /nfs/dbraw/zinc/54/39/75/947543975.db2.gz YPRPLFGOGHEQSD-LBPRGKRZSA-N 0 0 350.362 3.627 20 5 FHBDRN Cc1ccc(CNC(=O)c2ccc([N+](=O)[O-])s2)c(OCC(F)(F)F)c1 ZINC000128520367 947545198 /nfs/dbraw/zinc/54/51/98/947545198.db2.gz HPXPFIBGMQYEJJ-UHFFFAOYSA-N 0 0 374.340 3.836 20 5 FHBDRN C[C@@H](c1ccccc1)n1cnnc1SCCOc1ccccc1[N+](=O)[O-] ZINC000053841314 947554441 /nfs/dbraw/zinc/55/44/41/947554441.db2.gz CYNAKBGNDKZEOQ-AWEZNQCLSA-N 0 0 370.434 3.967 20 5 FHBDRN CC(C)[C@@H]1CN([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CCS1 ZINC000072836984 947556990 /nfs/dbraw/zinc/55/69/90/947556990.db2.gz QAYJHNKYBDLFOS-NHYWBVRUSA-N 0 0 371.890 3.649 20 5 FHBDRN Cc1cc(C(=O)NCc2ccc(Br)s2)cc([N+](=O)[O-])c1 ZINC000049158228 947562526 /nfs/dbraw/zinc/56/25/26/947562526.db2.gz WBXHRUUILVPTAD-UHFFFAOYSA-N 0 0 355.213 3.657 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])c1cc2cc(Br)ccc2[nH]1 ZINC000053867216 947569928 /nfs/dbraw/zinc/56/99/28/947569928.db2.gz KTINNFWFEBUETE-UHFFFAOYSA-N 0 0 374.194 3.769 20 5 FHBDRN O=C(OCc1noc(-c2ccc(Cl)cc2)n1)c1csc([N+](=O)[O-])c1 ZINC000053880551 947574326 /nfs/dbraw/zinc/57/43/26/947574326.db2.gz GYUKKMANSLZNMY-UHFFFAOYSA-N 0 0 365.754 3.717 20 5 FHBDRN NC(=O)c1ccc(CNc2cc(Cl)cc(C(F)(F)F)c2)c([N+](=O)[O-])c1 ZINC000184562335 947586510 /nfs/dbraw/zinc/58/65/10/947586510.db2.gz TZCWIVUFYWSAAI-UHFFFAOYSA-N 0 0 373.718 3.978 20 5 FHBDRN C[C@@H](c1nnc(-c2cccs2)o1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088606253 947587031 /nfs/dbraw/zinc/58/70/31/947587031.db2.gz QHULYGPLQKJZJS-NSHDSACASA-N 0 0 356.407 3.826 20 5 FHBDRN O=C(O[C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1)c1cc(F)cc(Cl)c1 ZINC000759934190 947587356 /nfs/dbraw/zinc/58/73/56/947587356.db2.gz PNLNRMGLBLTKDX-KGLIPLIRSA-N 0 0 367.764 3.925 20 5 FHBDRN CO[C@@H]1CCN(c2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000440684031 947598361 /nfs/dbraw/zinc/59/83/61/947598361.db2.gz ZUFRYRWEJWSBON-RHSMWYFYSA-N 0 0 354.406 3.830 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CCc1nc(-c2cc(Cl)cc(Cl)c2)no1 ZINC000445216982 947617287 /nfs/dbraw/zinc/61/72/87/947617287.db2.gz VYVUUAGRXRGOIP-UHFFFAOYSA-N 0 0 368.180 3.699 20 5 FHBDRN C[C@@H]1CCC[C@@H](NC(=O)c2sc(Br)cc2[N+](=O)[O-])[C@@H]1C ZINC000445248175 947645737 /nfs/dbraw/zinc/64/57/37/947645737.db2.gz IZEPGWCCWOLWLT-IWSPIJDZSA-N 0 0 361.261 3.973 20 5 FHBDRN O=C(C[C@@H]1CCc2ccccc21)O[C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000759934990 947671678 /nfs/dbraw/zinc/67/16/78/947671678.db2.gz RDSZYALYHFODRC-CGTJXYLNSA-N 0 0 369.421 3.938 20 5 FHBDRN Cc1ccccc1[C@@H](C)CC(=O)N=c1cc(-c2cccc([N+](=O)[O-])c2)[nH][nH]1 ZINC000523871112 947682380 /nfs/dbraw/zinc/68/23/80/947682380.db2.gz TZGNGWYFXFTZKD-AWEZNQCLSA-N 0 0 364.405 3.848 20 5 FHBDRN CC[C@@H](Cc1ccc(Cl)cc1)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000523854957 947687319 /nfs/dbraw/zinc/68/73/19/947687319.db2.gz XLSQVJRZAZFATA-AWEZNQCLSA-N 0 0 368.842 3.548 20 5 FHBDRN CCCc1ncc(C(=O)O[C@@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)s1 ZINC000759936166 947698582 /nfs/dbraw/zinc/69/85/82/947698582.db2.gz SYONHIMOQCQXAK-VXGBXAGGSA-N 0 0 364.427 3.541 20 5 FHBDRN COc1ccc(/C=C\C(=O)O[C@@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)cc1 ZINC000759937309 947710230 /nfs/dbraw/zinc/71/02/30/947710230.db2.gz WMDQAIKYYXSBMB-BEBBCNLGSA-N 0 0 371.393 3.540 20 5 FHBDRN Cc1cc(Cl)cc(Cl)c1CNc1cc([N+](=O)[O-])c2nncn2c1 ZINC001167796864 947710912 /nfs/dbraw/zinc/71/09/12/947710912.db2.gz XTGZLSAQPKEIIH-UHFFFAOYSA-N 0 0 352.181 3.865 20 5 FHBDRN CC/C(=C\C(=O)N1CCC(n2ccc([N+](=O)[O-])n2)CC1)c1ccc(C)cc1 ZINC000785335224 947724059 /nfs/dbraw/zinc/72/40/59/947724059.db2.gz GKQQEDTUTNEEFA-JQIJEIRASA-N 0 0 368.437 3.757 20 5 FHBDRN CCOc1ccc(C(=O)O[C@@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)cc1 ZINC000759939420 947743140 /nfs/dbraw/zinc/74/31/40/947743140.db2.gz MITSCPRRNZZVBN-HZPDHXFCSA-N 0 0 359.382 3.531 20 5 FHBDRN CS(=O)(=O)c1ccc(NCCCSc2ccccc2)c([N+](=O)[O-])c1 ZINC000015168454 947743382 /nfs/dbraw/zinc/74/33/82/947743382.db2.gz GXAFQXKZENONJT-UHFFFAOYSA-N 0 0 366.464 3.593 20 5 FHBDRN Cc1nn(CCC(=O)Nc2ccc(-c3nccs3)cc2)c(C)c1[N+](=O)[O-] ZINC000523951294 947754833 /nfs/dbraw/zinc/75/48/33/947754833.db2.gz RFADLCZVIPHWJE-UHFFFAOYSA-N 0 0 371.422 3.560 20 5 FHBDRN O=C(Cc1ccc(O)cc1Cl)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000129526749 947775209 /nfs/dbraw/zinc/77/52/09/947775209.db2.gz IJSAPEPBIIVLSL-UHFFFAOYSA-N 0 0 360.797 3.688 20 5 FHBDRN O=C(O[C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1)c1cc2c(s1)CCC2 ZINC000759942245 947811875 /nfs/dbraw/zinc/81/18/75/947811875.db2.gz QQZPEVPLJJDXDG-OLZOCXBDSA-N 0 0 361.423 3.682 20 5 FHBDRN Cc1ccc(CC(=O)O[C@@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)cc1C ZINC000759943547 947832171 /nfs/dbraw/zinc/83/21/71/947832171.db2.gz RYZYUZPKMJDXOI-IAGOWNOFSA-N 0 0 357.410 3.678 20 5 FHBDRN C[C@H](NC(=O)N1CCCC[C@@H]([C@H]2CCOC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000895066841 947843631 /nfs/dbraw/zinc/84/36/31/947843631.db2.gz NUEONDNHHRJONI-UAGQMJEPSA-N 0 0 361.442 3.504 20 5 FHBDRN Cc1cc(C(=O)O[C@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)c(F)cc1F ZINC000759943260 947844526 /nfs/dbraw/zinc/84/45/26/947844526.db2.gz QYQMGLWDERUCGQ-CABCVRRESA-N 0 0 365.336 3.719 20 5 FHBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)N1CC2(CCC2)[C@H]1c1ccccc1 ZINC000432309016 947846683 /nfs/dbraw/zinc/84/66/83/947846683.db2.gz WCYNWCGSAXICSH-GOSISDBHSA-N 0 0 372.446 3.652 20 5 FHBDRN Cc1cccc(NC(=O)CN(C)c2ccnc3c2cccc3[N+](=O)[O-])c1C ZINC000432311594 947874623 /nfs/dbraw/zinc/87/46/23/947874623.db2.gz DMRLUFCUYRTZCC-UHFFFAOYSA-N 0 0 364.405 3.835 20 5 FHBDRN Cc1nc(-c2ccccc2)ncc1C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000125822298 947881967 /nfs/dbraw/zinc/88/19/67/947881967.db2.gz SPCJUUUGPSJUEM-UHFFFAOYSA-N 0 0 374.400 3.559 20 5 FHBDRN C[C@H](NC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)c1ccccn1 ZINC000184621954 947923301 /nfs/dbraw/zinc/92/33/01/947923301.db2.gz LKWHHMGSOYGVFX-VIFPVBQESA-N 0 0 354.288 3.891 20 5 FHBDRN O=C(NC1CCN(c2c(Cl)cccc2[N+](=O)[O-])CC1)c1ccsc1 ZINC000432315509 947944773 /nfs/dbraw/zinc/94/47/73/947944773.db2.gz ZQRRVUIGGXZNMV-UHFFFAOYSA-N 0 0 365.842 3.709 20 5 FHBDRN O=C(/C=C/c1nc2ccccc2s1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000105266557 947964105 /nfs/dbraw/zinc/96/41/05/947964105.db2.gz WEGBJYIBEXFXEM-BQYQJAHWSA-N 0 0 351.387 3.807 20 5 FHBDRN CCCOc1ccc([C@H](C)Nc2c([N+](=O)[O-])c(CC)nn2C)cc1OC ZINC000094137445 947977594 /nfs/dbraw/zinc/97/75/94/947977594.db2.gz RWAUQDMSUILCSZ-LBPRGKRZSA-N 0 0 362.430 3.861 20 5 FHBDRN COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)NCc2ccoc2)cc1 ZINC000053040464 947987925 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FHBDRN CCN(C[C@H]1CCN(c2c(Cl)cccc2[N+](=O)[O-])C1)CC(F)(F)F ZINC000432328502 948080382 /nfs/dbraw/zinc/08/03/82/948080382.db2.gz KOEXUSHAVPFDLZ-LLVKDONJSA-N 0 0 365.783 3.959 20 5 FHBDRN CCO[C@@H]1C[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2Cl)C12CCCC2 ZINC000075357043 948089905 /nfs/dbraw/zinc/08/99/05/948089905.db2.gz FDWBAONFJNTMBY-LSDHHAIUSA-N 0 0 352.818 3.716 20 5 FHBDRN CCOc1ccc(C(=O)Oc2ccc3c(c2)OC(=O)C[C@@H]3C)cc1[N+](=O)[O-] ZINC000785360491 948099076 /nfs/dbraw/zinc/09/90/76/948099076.db2.gz BOEPZKAQQKHGKY-NSHDSACASA-N 0 0 371.345 3.625 20 5 FHBDRN O=C(N[C@@H]1C[C@@H]1Cc1ccccc1)C1(c2ccc([N+](=O)[O-])cc2)CCC1 ZINC001126288147 948101630 /nfs/dbraw/zinc/10/16/30/948101630.db2.gz AFGHADBHURVMEW-QFBILLFUSA-N 0 0 350.418 3.764 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(NC(=O)NC)c1 ZINC000184661745 948103110 /nfs/dbraw/zinc/10/31/10/948103110.db2.gz FLYJNWWVZQCZDK-AWEZNQCLSA-N 0 0 370.409 3.554 20 5 FHBDRN O=[N+]([O-])c1cccc2c(NCc3ccc4c(c3)OCCCO4)ccnc21 ZINC000432331118 948111559 /nfs/dbraw/zinc/11/15/59/948111559.db2.gz JFCQPLYIFNZOCZ-UHFFFAOYSA-N 0 0 351.362 3.916 20 5 FHBDRN CCC[C@@H](C)NC(=O)[C@@H]1CCCN(c2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000432331902 948128650 /nfs/dbraw/zinc/12/86/50/948128650.db2.gz RQCHGWOLWLRMRE-CHWSQXEVSA-N 0 0 353.850 3.769 20 5 FHBDRN O=C(CCc1ccccc1F)O[C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000759947801 948136068 /nfs/dbraw/zinc/13/60/68/948136068.db2.gz XBLMPXLDHSYYMF-CVEARBPZSA-N 0 0 361.373 3.590 20 5 FHBDRN COc1cc(C(=O)N[C@@H]2CCC[C@H](C)[C@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000585690208 948139172 /nfs/dbraw/zinc/13/91/72/948139172.db2.gz RTXGCTULSSTJJM-HOSYDEDBSA-N 0 0 372.368 3.759 20 5 FHBDRN C[C@@H]1CC(=O)Oc2cc(OC(=O)C(C)(C)c3ccc([N+](=O)[O-])cc3)ccc21 ZINC000785364348 948144556 /nfs/dbraw/zinc/14/45/56/948144556.db2.gz HOZLCFXFHHWPNN-GFCCVEGCSA-N 0 0 369.373 3.891 20 5 FHBDRN O=[N+]([O-])c1cccc(Cl)c1NCc1cccc(CN2CCOCC2)c1 ZINC000432337741 948151656 /nfs/dbraw/zinc/15/16/56/948151656.db2.gz UQEZDADAEXPFJN-UHFFFAOYSA-N 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O=[N+]([O-])c1ccc(N[C@H](CN2CCOCC2)c2ccccc2)c(Cl)c1 ZINC000015143244 220148194 /nfs/dbraw/zinc/14/81/94/220148194.db2.gz UIZVBIKSNCHBCU-GOSISDBHSA-N 0 0 361.829 3.734 20 5 FHBDRN Cc1[nH]c2ccc(C(=O)NCCNc3ccc([N+](=O)[O-])cc3)cc2c1C ZINC000015139167 220148583 /nfs/dbraw/zinc/14/85/83/220148583.db2.gz WWSXJLKGOFDQPE-UHFFFAOYSA-N 0 0 352.394 3.535 20 5 FHBDRN CC(C)[C@H](Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000015142443 220148626 /nfs/dbraw/zinc/14/86/26/220148626.db2.gz JQXFFZAUAIDSDK-KRWDZBQOSA-N 0 0 366.414 3.947 20 5 FHBDRN CC(C)c1ccc(NC(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)cc1 ZINC000015632996 220157608 /nfs/dbraw/zinc/15/76/08/220157608.db2.gz CQKGECBXUYWSHH-UHFFFAOYSA-N 0 0 351.366 3.551 20 5 FHBDRN C[C@H](NC(=O)Cc1ccccc1[N+](=O)[O-])c1ccc(Br)cc1 ZINC000015621312 220157669 /nfs/dbraw/zinc/15/76/69/220157669.db2.gz FVNLLFLCVDMYTK-NSHDSACASA-N 0 0 363.211 3.777 20 5 FHBDRN C[C@@H]1CCC[C@H](NC(=O)c2ccc(Br)c([N+](=O)[O-])c2)[C@@H]1C ZINC000015791662 220165335 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O=[N+]([O-])c1c(N2CCC(Nc3ccc(F)cc3)CC2)nc2sccn21 ZINC000049980330 221028599 /nfs/dbraw/zinc/02/85/99/221028599.db2.gz YOALRCVIMIMYRA-UHFFFAOYSA-N 0 0 361.402 3.524 20 5 FHBDRN CSc1cccc(NC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)c1 ZINC000052927749 221041919 /nfs/dbraw/zinc/04/19/19/221041919.db2.gz UIWKXAVVPUEEDK-UHFFFAOYSA-N 0 0 368.418 3.970 20 5 FHBDRN Cc1ccc(C)c(OC2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)c1 ZINC000055708829 221073617 /nfs/dbraw/zinc/07/36/17/221073617.db2.gz LHNYAFLEKMKSJI-UHFFFAOYSA-N 0 0 354.406 3.895 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(N2CCCC2)c(F)c1 ZINC000055777545 221074805 /nfs/dbraw/zinc/07/48/05/221074805.db2.gz JVURSZWLSKWKLG-UHFFFAOYSA-N 0 0 359.357 3.595 20 5 FHBDRN CC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1C)c1ccc2c(c1)OCCO2 ZINC000055964420 221076419 /nfs/dbraw/zinc/07/64/19/221076419.db2.gz DDHGUHFTPDEPRK-HNNXBMFYSA-N 0 0 356.378 3.556 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N(Cc1ccco1)C1CCCC1 ZINC000056106590 221078106 /nfs/dbraw/zinc/07/81/06/221078106.db2.gz HHQHNZDSJAOYNN-UHFFFAOYSA-N 0 0 364.423 3.630 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)Nc1nnc(-c2ccccc2Cl)s1 ZINC000056248710 221079131 /nfs/dbraw/zinc/07/91/31/221079131.db2.gz ZWTOLXNCOYSSBP-UHFFFAOYSA-N 0 0 374.809 3.948 20 5 FHBDRN COc1ccc2c(c1)CCC[C@H]2CC(=O)NCc1ccccc1[N+](=O)[O-] ZINC000057174483 221085010 /nfs/dbraw/zinc/08/50/10/221085010.db2.gz IWYYGZJQARQZHB-HNNXBMFYSA-N 0 0 354.406 3.730 20 5 FHBDRN Cc1cc(NC(=O)c2ccc(F)cc2F)n(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000068120703 221312866 /nfs/dbraw/zinc/31/28/66/221312866.db2.gz JIKKSHROVTWJFG-UHFFFAOYSA-N 0 0 358.304 3.619 20 5 FHBDRN COc1ccc(C(=O)N2CCCc3cc(Cl)cc(F)c32)cc1[N+](=O)[O-] ZINC000068145133 221314603 /nfs/dbraw/zinc/31/46/03/221314603.db2.gz SLHMLBRNIRDZAO-UHFFFAOYSA-N 0 0 364.760 3.989 20 5 FHBDRN CC[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1N(C)C)c1ccc(OC)cc1 ZINC000069713213 221327485 /nfs/dbraw/zinc/32/74/85/221327485.db2.gz FYFOPGXZOPDTJB-KRWDZBQOSA-N 0 0 357.410 3.551 20 5 FHBDRN Cc1[nH]nc(C(=O)Nc2ccc(Oc3cccc(C)c3)cc2)c1[N+](=O)[O-] ZINC000072049679 221399181 /nfs/dbraw/zinc/39/91/81/221399181.db2.gz MAUAQBUPHLXQOT-UHFFFAOYSA-N 0 0 352.350 3.979 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)Nc2ccc(OC(C)C)cc2)c1C ZINC000071977273 221392037 /nfs/dbraw/zinc/39/20/37/221392037.db2.gz ZHMGNOFBAQWJEW-UHFFFAOYSA-N 0 0 364.423 3.800 20 5 FHBDRN O=[N+]([O-])c1ccc(NCCOc2ccc3c(c2)OCO3)c(C(F)(F)F)c1 ZINC000072027435 221396941 /nfs/dbraw/zinc/39/69/41/221396941.db2.gz BHYJHXAHEQPITQ-UHFFFAOYSA-N 0 0 370.283 3.833 20 5 FHBDRN CC(=O)c1ccc(N2CCN(c3ccccc3Cl)CC2)c([N+](=O)[O-])c1 ZINC000008148395 132373734 /nfs/dbraw/zinc/37/37/34/132373734.db2.gz LJXGCGZYMBBFJD-UHFFFAOYSA-N 0 0 359.813 3.777 20 5 FHBDRN Cc1cc(N2CCC(c3nc(-c4ccccn4)no3)CC2)ccc1[N+](=O)[O-] ZINC000078680024 132377226 /nfs/dbraw/zinc/37/72/26/132377226.db2.gz XGPMWFUGBWNURI-UHFFFAOYSA-N 0 0 365.393 3.732 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)N1CCN(c2ccccc2Cl)CC1 ZINC000043467773 136121300 /nfs/dbraw/zinc/12/13/00/136121300.db2.gz IJNOXEQXYIMRQE-UHFFFAOYSA-N 0 0 360.801 3.602 20 5 FHBDRN Cc1csc(Sc2ccc(C(=O)N(C)C(C)C)cc2[N+](=O)[O-])n1 ZINC000097077040 222157310 /nfs/dbraw/zinc/15/73/10/222157310.db2.gz HKRHEPJSZOZUEX-UHFFFAOYSA-N 0 0 351.453 3.991 20 5 FHBDRN C[C@@H]1CN(Cc2ccccc2)CCN1C(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000097592202 222194075 /nfs/dbraw/zinc/19/40/75/222194075.db2.gz DJMKNMFHMKDZBA-CQSZACIVSA-N 0 0 373.840 3.595 20 5 FHBDRN COc1ccc(SCCC(=O)Nc2cc([N+](=O)[O-])ccc2F)cc1 ZINC000105287924 222366491 /nfs/dbraw/zinc/36/64/91/222366491.db2.gz QUZRPTMYCSHAMV-UHFFFAOYSA-N 0 0 350.371 3.863 20 5 FHBDRN Cc1nn(C)c2nc(C3CC3)cc(C(=O)Nc3ccc(C)c([N+](=O)[O-])c3)c12 ZINC000105629558 222371887 /nfs/dbraw/zinc/37/18/87/222371887.db2.gz ZHIKWGZIRUXQRQ-UHFFFAOYSA-N 0 0 365.393 3.623 20 5 FHBDRN Cc1c(Cl)cc(S(=O)(=O)N([C@@H](C)C(C)C)C2CC2)cc1[N+](=O)[O-] ZINC000106186808 222383599 /nfs/dbraw/zinc/38/35/99/222383599.db2.gz QSWGOMRFDXQTHQ-NSHDSACASA-N 0 0 360.863 3.754 20 5 FHBDRN C[C@H](Cc1ccc(Br)cc1)NC(=O)c1ccc([N+](=O)[O-])s1 ZINC000107601629 222396979 /nfs/dbraw/zinc/39/69/79/222396979.db2.gz PDPAOMXXQXJBKR-SECBINFHSA-N 0 0 369.240 3.780 20 5 FHBDRN O=C(Nc1ccc(F)c(Cl)c1)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000109263941 538576826 /nfs/dbraw/zinc/57/68/26/538576826.db2.gz PKVCBMDHSSIJHJ-UHFFFAOYSA-N 0 0 360.732 3.825 20 5 FHBDRN CC(C)Oc1cccnc1C(=O)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452853585 567818948 /nfs/dbraw/zinc/81/89/48/567818948.db2.gz OEEDMNDXVBEDBI-MRXNPFEDSA-N 0 0 369.421 3.797 20 5 FHBDRN Cn1cc(NC(=O)Nc2ccc([N+](=O)[O-])cc2F)c(-c2ccccc2)n1 ZINC000541787476 567821051 /nfs/dbraw/zinc/82/10/51/567821051.db2.gz QIJODMQVNVZHSN-UHFFFAOYSA-N 0 0 355.329 3.778 20 5 FHBDRN Cc1sc(C(=O)N2CCC(Oc3ccccc3F)CC2)cc1[N+](=O)[O-] ZINC000601739419 567822375 /nfs/dbraw/zinc/82/23/75/567822375.db2.gz VEAFGOWPAZVASA-UHFFFAOYSA-N 0 0 364.398 3.787 20 5 FHBDRN Cc1nc(C2CC2)oc1C(=O)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452867044 567829293 /nfs/dbraw/zinc/82/92/93/567829293.db2.gz XWRKVDNCEACEBE-OAHLLOKOSA-N 0 0 355.394 3.788 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1F)N1CCC[C@@H](Nc2ccccc2)C1 ZINC000541785213 567831262 /nfs/dbraw/zinc/83/12/62/567831262.db2.gz IVFBPKFWJUBLQP-CQSZACIVSA-N 0 0 358.373 3.842 20 5 FHBDRN Cc1cccc2c1O[C@H](C(=O)N1CCC[C@H](c3ccc([N+](=O)[O-])cc3)C1)C2 ZINC000452863788 567833947 /nfs/dbraw/zinc/83/39/47/567833947.db2.gz MGEOBQODCMAKFF-HKUYNNGSSA-N 0 0 366.417 3.613 20 5 FHBDRN CC(=O)c1ccc(C(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000452860949 567835359 /nfs/dbraw/zinc/83/53/59/567835359.db2.gz TYADEIDEYRZTRP-SFHVURJKSA-N 0 0 352.390 3.817 20 5 FHBDRN CC(C)Nc1ncccc1C(=O)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452870123 567839796 /nfs/dbraw/zinc/83/97/96/567839796.db2.gz ZKYORRSKCPIRNS-MRXNPFEDSA-N 0 0 368.437 3.830 20 5 FHBDRN COc1ccc(C(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)c(F)c1 ZINC000452878008 567853803 /nfs/dbraw/zinc/85/38/03/567853803.db2.gz MKUJGJSRUXOIFX-AWEZNQCLSA-N 0 0 358.369 3.762 20 5 FHBDRN CC(=O)c1ccc(CC(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000452888145 567888555 /nfs/dbraw/zinc/88/85/55/567888555.db2.gz SKQFBBXGQOVDMC-IBGZPJMESA-N 0 0 366.417 3.746 20 5 FHBDRN CC(C)Oc1cccc([C@H](C)NC(=O)COc2cccc([N+](=O)[O-])c2)c1 ZINC000481408549 567904746 /nfs/dbraw/zinc/90/47/46/567904746.db2.gz CXXCQRWEVUEOJQ-AWEZNQCLSA-N 0 0 358.394 3.638 20 5 FHBDRN O=[N+]([O-])c1ccc(SC[C@@H](O)COc2cccc3ccccc32)nc1 ZINC000159183833 567907075 /nfs/dbraw/zinc/90/70/75/567907075.db2.gz BASGHHLDAADQKW-HNNXBMFYSA-N 0 0 356.403 3.675 20 5 FHBDRN CCCN1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2)c2ccc(F)cc21 ZINC000481414635 567914232 /nfs/dbraw/zinc/91/42/32/567914232.db2.gz PSNHAGQEUJWMNA-UHFFFAOYSA-N 0 0 361.348 3.750 20 5 FHBDRN O=C(N[C@H]1C[C@H](c2ccc(F)cc2)C1)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000481424439 567925618 /nfs/dbraw/zinc/92/56/18/567925618.db2.gz JGQVXPSQZMCMMQ-CTYIDZIISA-N 0 0 365.364 3.958 20 5 FHBDRN CC(C)C[C@H](C)n1nccc1NC(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000481443644 567953659 /nfs/dbraw/zinc/95/36/59/567953659.db2.gz XQFHCURAAIQYQI-AWEZNQCLSA-N 0 0 359.430 3.763 20 5 FHBDRN COC(=O)[C@@H](Cc1ccc(Cl)cc1)Sc1ncccc1[N+](=O)[O-] ZINC000541835490 567958079 /nfs/dbraw/zinc/95/80/79/567958079.db2.gz VCTFFCGEZXBPAJ-CYBMUJFWSA-N 0 0 352.799 3.520 20 5 FHBDRN Cc1c(CNC(=O)CCc2nc3ccccc3s2)cccc1[N+](=O)[O-] ZINC000481469479 567967795 /nfs/dbraw/zinc/96/77/95/567967795.db2.gz UPSNITWCULKHQL-UHFFFAOYSA-N 0 0 355.419 3.762 20 5 FHBDRN Cc1ccc2[nH]cc(CCC(=O)NCc3cccc([N+](=O)[O-])c3C)c2c1 ZINC000481475259 567977527 /nfs/dbraw/zinc/97/75/27/567977527.db2.gz CTUBIEXTSNTDEH-UHFFFAOYSA-N 0 0 351.406 3.942 20 5 FHBDRN Cc1c(CNC(=O)Cc2ccc(C(F)(F)F)cc2)cccc1[N+](=O)[O-] ZINC000481496421 567998255 /nfs/dbraw/zinc/99/82/55/567998255.db2.gz WMCIPVREBWHITP-UHFFFAOYSA-N 0 0 352.312 3.781 20 5 FHBDRN Nc1c(Cl)cc(Cl)cc1CN1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000602640433 568002973 /nfs/dbraw/zinc/00/29/73/568002973.db2.gz OASJFKSIUNAFNK-UHFFFAOYSA-N 0 0 370.240 3.517 20 5 FHBDRN Cc1ccc(C)c(C(=O)CCC(=O)NCc2cccc([N+](=O)[O-])c2C)c1 ZINC000481498167 568005886 /nfs/dbraw/zinc/00/58/86/568005886.db2.gz YDUFFRQDFBJSRV-UHFFFAOYSA-N 0 0 354.406 3.799 20 5 FHBDRN Cc1c(CNC(=O)c2ccc(OC3CCCC3)nc2)cccc1[N+](=O)[O-] ZINC000481494436 568007416 /nfs/dbraw/zinc/00/74/16/568007416.db2.gz RFHHSFGOPPONEO-UHFFFAOYSA-N 0 0 355.394 3.550 20 5 FHBDRN Cc1c(CNC(=O)c2cc(Br)cs2)cccc1[N+](=O)[O-] ZINC000481498391 568007507 /nfs/dbraw/zinc/00/75/07/568007507.db2.gz YGRMXWBVZCZJRK-UHFFFAOYSA-N 0 0 355.213 3.657 20 5 FHBDRN CC(C)O[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2SC(C)C)C1 ZINC000568394321 568030389 /nfs/dbraw/zinc/03/03/89/568030389.db2.gz JRNPBVSIWHNDKE-CQSZACIVSA-N 0 0 352.456 3.735 20 5 FHBDRN CCC[C@H]([NH2+]C[C@H](O)COc1cccc(C)c1)c1cccc([N+](=O)[O-])c1 ZINC000481537962 568043866 /nfs/dbraw/zinc/04/38/66/568043866.db2.gz VWZYCWXQCJMRRJ-ICSRJNTNSA-N 0 0 358.438 3.774 20 5 FHBDRN CCn1nc(C)c(CN[C@H](c2ccc([N+](=O)[O-])cc2)C(F)(F)F)c1C ZINC000568522561 568046048 /nfs/dbraw/zinc/04/60/48/568046048.db2.gz ZFFCNYLEQIIREU-OAHLLOKOSA-N 0 0 356.348 3.821 20 5 FHBDRN CC(C)(CCc1noc(Cc2cc(Br)ccc2F)n1)[N+](=O)[O-] ZINC000291107271 568048097 /nfs/dbraw/zinc/04/80/97/568048097.db2.gz SFIPVOBDGRNTCA-UHFFFAOYSA-N 0 0 372.194 3.550 20 5 FHBDRN C[C@H]1[C@H](C(F)(F)F)CCCN1c1nnc(-c2ccc([N+](=O)[O-])cc2)n1C ZINC000568566544 568048669 /nfs/dbraw/zinc/04/86/69/568048669.db2.gz FRZWPHZKSPTSMY-GXFFZTMASA-N 0 0 369.347 3.558 20 5 FHBDRN O=[N+]([O-])c1cccc(COc2cccc(I)c2)c1 ZINC000024724792 568048925 /nfs/dbraw/zinc/04/89/25/568048925.db2.gz SETZCBLGNUXWSM-UHFFFAOYSA-N 0 0 355.131 3.778 20 5 FHBDRN O=C(c1ccc2c(c1)CCCC2=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000481544457 568050071 /nfs/dbraw/zinc/05/00/71/568050071.db2.gz NWQAPLRSTOUQAQ-UHFFFAOYSA-N 0 0 364.401 3.919 20 5 FHBDRN COc1cccc2c1[C@@H](C(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1)CC2 ZINC000481548938 568050467 /nfs/dbraw/zinc/05/04/67/568050467.db2.gz YWINMPVVZAQRPX-SFHVURJKSA-N 0 0 366.417 3.824 20 5 FHBDRN C[C@H]1CCCN(c2ccc(C(=O)N3C[C@@H]4[C@H](C3)C4(C)C)cc2[N+](=O)[O-])C1 ZINC000408229270 568057450 /nfs/dbraw/zinc/05/74/50/568057450.db2.gz PCCXUJJVRNOQSI-CWRNSKLLSA-N 0 0 357.454 3.559 20 5 FHBDRN COC(=O)[C@@H](Cc1ccc(C)cc1)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000481581802 568058605 /nfs/dbraw/zinc/05/86/05/568058605.db2.gz OQKSXYLKIZMRBJ-CRAIPNDOSA-N 0 0 356.422 3.647 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)NC[C@H]2CCO[C@@H]2c2ccccc2)c1 ZINC000481576532 568060529 /nfs/dbraw/zinc/06/05/29/568060529.db2.gz RMQAOBWXJUQPDN-RDTXWAMCSA-N 0 0 372.446 3.824 20 5 FHBDRN COCc1ccccc1NC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000481602455 568064387 /nfs/dbraw/zinc/06/43/87/568064387.db2.gz XJIOVHULHOERRB-UHFFFAOYSA-N 0 0 363.801 3.759 20 5 FHBDRN O=[N+]([O-])c1ccc2nc(N3CCN(c4ncccc4Cl)CC3)ccc2c1 ZINC000302004029 568075413 /nfs/dbraw/zinc/07/54/13/568075413.db2.gz YQYLUIRKOMUZBA-UHFFFAOYSA-N 0 0 369.812 3.518 20 5 FHBDRN O=[N+]([O-])c1ccc2oc(CN3CCC[C@@]4(C3)OCc3ccccc34)nc2c1 ZINC000481686645 568089132 /nfs/dbraw/zinc/08/91/32/568089132.db2.gz JHDXVQTUXDIJIK-FQEVSTJZSA-N 0 0 365.389 3.758 20 5 FHBDRN Cn1nc([N+](=O)[O-])cc1C(=O)Nc1ccccc1Nc1ccc(F)cc1F ZINC000481691541 568089294 /nfs/dbraw/zinc/08/92/94/568089294.db2.gz QZYCMLCBDCNDLZ-UHFFFAOYSA-N 0 0 373.319 3.602 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2ncn(C[C@H](O)Cc3ccc4ccccc4c3)n2)c1 ZINC000481707699 568091046 /nfs/dbraw/zinc/09/10/46/568091046.db2.gz UGVSHJREKQSCEM-HXUWFJFHSA-N 0 0 374.400 3.610 20 5 FHBDRN COc1ccc(OC[C@H](O)Cc2ccc3ccccc3c2)c([N+](=O)[O-])c1 ZINC000481725282 568098427 /nfs/dbraw/zinc/09/84/27/568098427.db2.gz OYCIWUUQLZQEHX-QGZVFWFLSA-N 0 0 353.374 3.739 20 5 FHBDRN CSc1ccc(CSC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1 ZINC000481734760 568100194 /nfs/dbraw/zinc/10/01/94/568100194.db2.gz HTGQHBYPECXMFV-HNNXBMFYSA-N 0 0 365.476 3.990 20 5 FHBDRN C[C@@H]1CCCN(c2ccc(C(=O)Nc3cccc(O)c3)cc2[N+](=O)[O-])C1 ZINC000603482799 568105621 /nfs/dbraw/zinc/10/56/21/568105621.db2.gz AYTDBNNDKFZBSH-CYBMUJFWSA-N 0 0 355.394 3.789 20 5 FHBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NC[C@@H](C)c1ccccc1 ZINC000049581593 568108606 /nfs/dbraw/zinc/10/86/06/568108606.db2.gz WVZRZWZBJPEINE-CHWSQXEVSA-N 0 0 362.813 3.935 20 5 FHBDRN Cc1cc(=O)[nH]c2cc(C(=O)N[C@H](C)c3cccc([N+](=O)[O-])c3)ccc12 ZINC000568672095 568117003 /nfs/dbraw/zinc/11/70/03/568117003.db2.gz BPZKONFFJCTTHA-GFCCVEGCSA-N 0 0 351.362 3.648 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)c1c(Cl)n(C)nc1C(C)C ZINC000291355610 568123722 /nfs/dbraw/zinc/12/37/22/568123722.db2.gz ARASORGGJBZXJN-UHFFFAOYSA-N 0 0 350.806 3.920 20 5 FHBDRN CS(=O)(=O)c1cc([N+](=O)[O-])ccc1SCc1ccc(Cl)cc1 ZINC000302719417 568124058 /nfs/dbraw/zinc/12/40/58/568124058.db2.gz OKNGDEGNCRADFY-UHFFFAOYSA-N 0 0 357.840 3.944 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(-c2nc(CC3CCC(OC)CC3)no2)c1 ZINC000568695779 568127235 /nfs/dbraw/zinc/12/72/35/568127235.db2.gz MDZAMYVRUXABAM-UHFFFAOYSA-N 0 0 361.398 3.791 20 5 FHBDRN Cc1cc(Cl)cnc1NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000291385191 568131812 /nfs/dbraw/zinc/13/18/12/568131812.db2.gz BTEKOSRYCKCUCM-UHFFFAOYSA-N 0 0 374.828 3.807 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2c3ccccc3CC23CCOCC3)c1 ZINC000291420052 568137509 /nfs/dbraw/zinc/13/75/09/568137509.db2.gz KHAUYFAMKIOSJK-LJQANCHMSA-N 0 0 366.417 3.727 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)NCc1ccc(C2CC2)cc1 ZINC000481866963 568144533 /nfs/dbraw/zinc/14/45/33/568144533.db2.gz BALNDPBFFDZCLH-UHFFFAOYSA-N 0 0 353.422 3.981 20 5 FHBDRN CC[C@H]1CCC[C@@H](NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C1 ZINC000128691536 568145505 /nfs/dbraw/zinc/14/55/05/568145505.db2.gz SYAHCTQEJLDRIB-DOTOQJQBSA-N 0 0 359.470 3.896 20 5 FHBDRN O=C1c2ccccc2C(=O)N1CCCCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000024839003 568149460 /nfs/dbraw/zinc/14/94/60/568149460.db2.gz CJPGITBQTKYHCF-UHFFFAOYSA-N 0 0 374.780 3.703 20 5 FHBDRN C[C@@H](Nc1ccc(NC(=O)c2cc([N+](=O)[O-])nn2C)cc1)c1ccccc1 ZINC000481883305 568153279 /nfs/dbraw/zinc/15/32/79/568153279.db2.gz IUDFFBWIEDJOGM-CYBMUJFWSA-N 0 0 365.393 3.754 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)c1cnc2c(cnn2C(C)C)c1 ZINC000291487130 568153698 /nfs/dbraw/zinc/15/36/98/568153698.db2.gz SLMDSGSSJMIVAD-UHFFFAOYSA-N 0 0 353.382 3.735 20 5 FHBDRN COCCCCc1cccnc1NC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000291432105 568153730 /nfs/dbraw/zinc/15/37/30/568153730.db2.gz JKKUVDVBLCICGQ-UHFFFAOYSA-N 0 0 371.437 3.875 20 5 FHBDRN C[C@@]1(CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])OCCc2sccc21 ZINC000291451527 568163134 /nfs/dbraw/zinc/16/31/34/568163134.db2.gz NZNDGNBGQRBPGJ-INIZCTEOSA-N 0 0 366.826 3.528 20 5 FHBDRN O=C(Nc1nc(-c2ccc3c(c2)CCCC3)cs1)c1n[nH]cc1[N+](=O)[O-] ZINC000159356370 568185854 /nfs/dbraw/zinc/18/58/54/568185854.db2.gz SMDULYANOGQSCU-UHFFFAOYSA-N 0 0 369.406 3.573 20 5 FHBDRN Cc1cc(Br)ccc1CSCCn1cc([N+](=O)[O-])cn1 ZINC000481923419 568186345 /nfs/dbraw/zinc/18/63/45/568186345.db2.gz OIVTULFJBCHXRH-UHFFFAOYSA-N 0 0 356.245 3.796 20 5 FHBDRN CC[C@@H](C)c1ccc([C@H](NC(=O)Cn2ccc([N+](=O)[O-])n2)C(C)C)cc1 ZINC000603950545 568187206 /nfs/dbraw/zinc/18/72/06/568187206.db2.gz SCNPSRBAQZXAEO-AUUYWEPGSA-N 0 0 358.442 3.818 20 5 FHBDRN COC(=O)c1cc(OCC(=O)c2ccc3c(c2)CCCC3)ccc1[N+](=O)[O-] ZINC000481926186 568188933 /nfs/dbraw/zinc/18/89/33/568188933.db2.gz VSGVLWKVTYZTIE-UHFFFAOYSA-N 0 0 369.373 3.522 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1)c1cnc(-c2ccc3c(c2)OCO3)s1 ZINC000481951279 568195488 /nfs/dbraw/zinc/19/54/88/568195488.db2.gz HXGFMJWAXCXNGK-UHFFFAOYSA-N 0 0 369.358 3.699 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N1CCC[C@H]1c1ccccc1 ZINC000481960747 568196998 /nfs/dbraw/zinc/19/69/98/568196998.db2.gz DPRHVAMCQYWRRL-KRWDZBQOSA-N 0 0 360.435 3.737 20 5 FHBDRN Cc1cc(N2CCC[C@H](n3cccn3)C2)c(Br)cc1[N+](=O)[O-] ZINC000302720797 568201507 /nfs/dbraw/zinc/20/15/07/568201507.db2.gz ZVMMWQAASCIBFZ-LBPRGKRZSA-N 0 0 365.231 3.704 20 5 FHBDRN O=[N+]([O-])c1cnc2ccc(N3Cc4ccccc4-c4ccccc4C3)nn21 ZINC000302002460 568205293 /nfs/dbraw/zinc/20/52/93/568205293.db2.gz QXMZDXPWEDRZNX-UHFFFAOYSA-N 0 0 357.373 3.825 20 5 FHBDRN CCC(C)(C)NC(=O)COc1ccc(Cc2ccccc2)cc1[N+](=O)[O-] ZINC000481973571 568212155 /nfs/dbraw/zinc/21/21/55/568212155.db2.gz PWMDVFXZCIKDCA-UHFFFAOYSA-N 0 0 356.422 3.869 20 5 FHBDRN O=C(c1cc(Cl)cc(Cl)c1[N+](=O)[O-])N1CCC(n2ccnc2)CC1 ZINC000291578107 568216413 /nfs/dbraw/zinc/21/64/13/568216413.db2.gz UKIISMCCMYLGDF-UHFFFAOYSA-N 0 0 369.208 3.575 20 5 FHBDRN C[C@H](Nc1ccc(Br)cc1)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000007222570 568218465 /nfs/dbraw/zinc/21/84/65/568218465.db2.gz WDNIKQDBFDSHSW-JTQLQIEISA-N 0 0 364.199 3.796 20 5 FHBDRN O=C(N[C@H](CC(F)(F)F)c1ccccc1)c1ccc([N+](=O)[O-])c([O-])c1 ZINC000604187167 568222898 /nfs/dbraw/zinc/22/28/98/568222898.db2.gz KSBJKSQSPNBXLX-GFCCVEGCSA-N 0 0 354.284 3.724 20 5 FHBDRN O=C(N[C@@H](c1ccccc1)C(F)F)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000482009255 568226673 /nfs/dbraw/zinc/22/66/73/568226673.db2.gz KCQJVSZFTKTWPP-INIZCTEOSA-N 0 0 372.331 3.517 20 5 FHBDRN CCOc1cc(NC(=O)N2CCC[C@@H](C)C2)c([N+](=O)[O-])cc1OCC ZINC000043839004 568230718 /nfs/dbraw/zinc/23/07/18/568230718.db2.gz WUZJHEMMRYZISO-GFCCVEGCSA-N 0 0 351.403 3.656 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N[C@H](c1ccccc1)C(F)F ZINC000482017449 568230983 /nfs/dbraw/zinc/23/09/83/568230983.db2.gz JQDLAWDTZDZDRV-QGZVFWFLSA-N 0 0 359.332 3.741 20 5 FHBDRN CCc1ccc([C@@H]2CN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)CCO2)cc1 ZINC000482051795 568239846 /nfs/dbraw/zinc/23/98/46/568239846.db2.gz GEIDXAYNRVOELI-SFHVURJKSA-N 0 0 358.369 3.510 20 5 FHBDRN Cc1ccc(CNC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)cc1F ZINC000012487244 568242154 /nfs/dbraw/zinc/24/21/54/568242154.db2.gz VEGSSNCQZQCBCG-UHFFFAOYSA-N 0 0 357.385 3.573 20 5 FHBDRN O=C(NCCc1c[nH]c2cc(Cl)cc(Cl)c12)c1ccc([N+](=O)[O-])[nH]1 ZINC000482051716 568242573 /nfs/dbraw/zinc/24/25/73/568242573.db2.gz CFBKAQKXUTVKKN-UHFFFAOYSA-N 0 0 367.192 3.684 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc3c(c2)N(C)CC3)cc1SC ZINC000181949576 568243374 /nfs/dbraw/zinc/24/33/74/568243374.db2.gz XSDPMJIUTNGTLJ-UHFFFAOYSA-N 0 0 373.434 3.570 20 5 FHBDRN Cc1c(Br)c(=O)n(Cc2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000568890304 568248343 /nfs/dbraw/zinc/24/83/43/568248343.db2.gz SIPHKLAWEZHZAO-UHFFFAOYSA-N 0 0 357.591 3.529 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)NCc1ccc(C2CC2)cc1 ZINC000568897458 568249656 /nfs/dbraw/zinc/24/96/56/568249656.db2.gz SQNLGMRQNDOOHL-UHFFFAOYSA-N 0 0 353.422 3.856 20 5 FHBDRN CCS[C@H]1CCC[C@H]1NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000541926091 568250840 /nfs/dbraw/zinc/25/08/40/568250840.db2.gz UYWMDBAGHRTNSX-MFKMUULPSA-N 0 0 360.382 3.600 20 5 FHBDRN COc1cc(C(=O)N[C@@H]2CCO[C@H](c3ccccc3)C2)cc([N+](=O)[O-])c1C ZINC000190294571 568252751 /nfs/dbraw/zinc/25/27/51/568252751.db2.gz WHVVBDLLGDEMQI-APWZRJJASA-N 0 0 370.405 3.562 20 5 FHBDRN CC(C)Oc1ccc(NC(=O)c2ccc([N+](=O)[O-])n2C)c(C(F)(F)F)c1 ZINC000517922200 568253963 /nfs/dbraw/zinc/25/39/63/568253963.db2.gz YOBGMBXAOQBSMT-UHFFFAOYSA-N 0 0 371.315 3.992 20 5 FHBDRN COc1cccc(NC2CCN(c3nc(C)cc(C)c3[N+](=O)[O-])CC2)c1 ZINC000541934575 568256535 /nfs/dbraw/zinc/25/65/35/568256535.db2.gz PKCSTOCMBDZWOG-UHFFFAOYSA-N 0 0 356.426 3.696 20 5 FHBDRN CCc1ccc2nc(NC(=O)COc3ccccc3[N+](=O)[O-])sc2c1 ZINC000007758468 568256661 /nfs/dbraw/zinc/25/66/61/568256661.db2.gz LMRDLSLICWADFC-UHFFFAOYSA-N 0 0 357.391 3.784 20 5 FHBDRN O=C(N[C@H]1CCc2ccc(F)cc21)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000541935883 568257605 /nfs/dbraw/zinc/25/76/05/568257605.db2.gz OEDCVMLKQMKGAN-ZDUSSCGKSA-N 0 0 366.295 3.753 20 5 FHBDRN COC1(c2ccccc2)CN(C(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)C1 ZINC000482085947 568257977 /nfs/dbraw/zinc/25/79/77/568257977.db2.gz WCLIKJQORXCUCG-UHFFFAOYSA-N 0 0 355.394 3.601 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N2C[C@@H](c3ccccc3)C3(CCC3)C2)c1[N+](=O)[O-] ZINC000412667111 568258070 /nfs/dbraw/zinc/25/80/70/568258070.db2.gz HGPKYPFETMWEBA-HNNXBMFYSA-N 0 0 368.437 3.851 20 5 FHBDRN CCS[C@H](C)c1noc(CN(C)c2cc(OC)c(F)cc2[N+](=O)[O-])n1 ZINC000482089656 568258323 /nfs/dbraw/zinc/25/83/23/568258323.db2.gz DDUCNWMKTSRBNY-SECBINFHSA-N 0 0 370.406 3.576 20 5 FHBDRN Cc1ccc(Cl)c(OC[C@H](O)COc2c(C)cccc2[N+](=O)[O-])c1 ZINC000584688924 568264283 /nfs/dbraw/zinc/26/42/83/568264283.db2.gz PXSDFLNKSHMHNQ-ZDUSSCGKSA-N 0 0 351.786 3.684 20 5 FHBDRN CC(C)(NCc1nccn1Cc1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000291687461 568264578 /nfs/dbraw/zinc/26/45/78/568264578.db2.gz INNLSJNISFGKQS-UHFFFAOYSA-N 0 0 350.422 3.865 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1Cl)N[C@H](c1ccccc1)C1CC1 ZINC000021365276 568265148 /nfs/dbraw/zinc/26/51/48/568265148.db2.gz PAPNZRVTWMTTNE-GOSISDBHSA-N 0 0 360.797 3.895 20 5 FHBDRN O=C(N[C@@H](c1ccccc1)C(F)F)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000482095999 568267167 /nfs/dbraw/zinc/26/71/67/568267167.db2.gz AWWWVGLTGQJZBP-INIZCTEOSA-N 0 0 372.331 3.517 20 5 FHBDRN O=C(c1ccc(OC(F)F)c([N+](=O)[O-])c1)N1CCC(C(F)(F)F)CC1 ZINC000541944756 568273242 /nfs/dbraw/zinc/27/32/42/568273242.db2.gz HIIQSOJQNSAKHT-UHFFFAOYSA-N 0 0 368.258 3.611 20 5 FHBDRN O=C(Nc1ccc2cc([N+](=O)[O-])ccc2n1)c1ccn(Cc2ccccc2)c1 ZINC000541945142 568273413 /nfs/dbraw/zinc/27/34/13/568273413.db2.gz SPIDFKUBMMIJKO-UHFFFAOYSA-N 0 0 372.384 3.667 20 5 FHBDRN CCOC(=O)C1CCC(CC(=O)N[C@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000569104230 568277252 /nfs/dbraw/zinc/27/72/52/568277252.db2.gz AHLACLRWVHFKTI-WLYUNCDWSA-N 0 0 362.426 3.532 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N[C@@H]2CC=C(c3ccc(F)cc3)CC2)c1[N+](=O)[O-] ZINC000482161118 568297559 /nfs/dbraw/zinc/29/75/59/568297559.db2.gz VQTCYUGSHSJETG-OAHLLOKOSA-N 0 0 372.400 3.946 20 5 FHBDRN C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1c[nH]c2cccc([N+](=O)[O-])c21 ZINC000482171650 568300416 /nfs/dbraw/zinc/30/04/16/568300416.db2.gz BEOJYTJURCZTLS-KOLCDFICSA-N 0 0 355.316 3.879 20 5 FHBDRN C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000482177644 568301892 /nfs/dbraw/zinc/30/18/92/568301892.db2.gz KDIQNTHESFWJIT-MFKMUULPSA-N 0 0 371.359 3.972 20 5 FHBDRN CC[C@@H](c1cccc(OC)c1)N(C)C(=O)c1cc([N+](=O)[O-])c(F)cc1N ZINC000291774985 568305535 /nfs/dbraw/zinc/30/55/35/568305535.db2.gz OCBXOBZVAQWBGW-INIZCTEOSA-N 0 0 361.373 3.548 20 5 FHBDRN CCOCCC1(CNC(=O)c2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC1 ZINC000291782202 568310107 /nfs/dbraw/zinc/31/01/07/568310107.db2.gz QDIUWGCWOMVMIY-UHFFFAOYSA-N 0 0 361.225 3.838 20 5 FHBDRN Cc1c(CC(=O)NCCc2ccc(C(F)(F)F)cc2)cccc1[N+](=O)[O-] ZINC000159440399 568312392 /nfs/dbraw/zinc/31/23/92/568312392.db2.gz NCAJNIKDWGJOCN-UHFFFAOYSA-N 0 0 366.339 3.823 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CCCc3cc(OC)ccc3C2)c1 ZINC000569242174 568314482 /nfs/dbraw/zinc/31/44/82/568314482.db2.gz KYWKGKNZKFBZKV-UHFFFAOYSA-N 0 0 370.405 3.591 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)Nc1cccc(OC(F)(F)F)c1 ZINC000031030880 568321777 /nfs/dbraw/zinc/32/17/77/568321777.db2.gz QTWMSKMBPPOYRO-UHFFFAOYSA-N 0 0 356.256 3.511 20 5 FHBDRN CCCOc1ccccc1NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000031274008 568328132 /nfs/dbraw/zinc/32/81/32/568328132.db2.gz KHEXCNHOULUMMB-UHFFFAOYSA-N 0 0 366.377 3.822 20 5 FHBDRN C[C@H](CNC(=O)c1cc(Br)cc([N+](=O)[O-])c1)CC(F)(F)F ZINC000412671544 568345808 /nfs/dbraw/zinc/34/58/08/568345808.db2.gz HTZOQTBEDCSRBI-ZETCQYMHSA-N 0 0 369.137 3.676 20 5 FHBDRN CC(C)c1cc(C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)nn1C ZINC000541995633 568378457 /nfs/dbraw/zinc/37/84/57/568378457.db2.gz FFEAMFYKXZMYAC-UHFFFAOYSA-N 0 0 356.304 3.723 20 5 FHBDRN Cc1sc(C(=O)N2CCC[C@H]2c2ccc3c(c2)OCCO3)cc1[N+](=O)[O-] ZINC000032452802 568390668 /nfs/dbraw/zinc/39/06/68/568390668.db2.gz AYVYOLLAOLZYQU-ZDUSSCGKSA-N 0 0 374.418 3.713 20 5 FHBDRN CCc1nc([C@H]2CCCN(C(=O)Nc3cc(C)c([N+](=O)[O-])cc3C)C2)no1 ZINC000365274176 568397089 /nfs/dbraw/zinc/39/70/89/568397089.db2.gz AKAVBVKXFLEMDC-ZDUSSCGKSA-N 0 0 373.413 3.569 20 5 FHBDRN COc1c(-c2nc(-c3ccc(N(C)C)cc3F)no2)cccc1[N+](=O)[O-] ZINC000569389724 568400181 /nfs/dbraw/zinc/40/01/81/568400181.db2.gz CGYDYGFEAACSFS-UHFFFAOYSA-N 0 0 358.329 3.526 20 5 FHBDRN O=[N+]([O-])c1cc(-c2nc(Cc3cc4ccccc4o3)no2)cc2c1OCO2 ZINC000569580639 568408336 /nfs/dbraw/zinc/40/83/36/568408336.db2.gz DARFUVMLJYDQNO-UHFFFAOYSA-N 0 0 365.301 3.711 20 5 FHBDRN CC(C)Cc1nnc(NC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)s1 ZINC000032892182 568411835 /nfs/dbraw/zinc/41/18/35/568411835.db2.gz DLZPQAHJLYQNCI-JTQLQIEISA-N 0 0 366.468 3.764 20 5 FHBDRN COc1ccc([C@H](C)NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)cc1F ZINC000007031231 568419862 /nfs/dbraw/zinc/41/98/62/568419862.db2.gz HVIBJVMYAMTSDF-NSHDSACASA-N 0 0 373.384 3.808 20 5 FHBDRN C[C@@H](C(=O)N1CCN(CC2CC2)c2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000569771348 568422867 /nfs/dbraw/zinc/42/28/67/568422867.db2.gz AUDIUCNWVKMULE-OAHLLOKOSA-N 0 0 365.433 3.962 20 5 FHBDRN COc1cc2c(cc1Cl)CN(C(=O)c1cccc([N+](=O)[O-])c1C)CC2 ZINC000569845354 568427333 /nfs/dbraw/zinc/42/73/33/568427333.db2.gz MCUSUWWVIJGGGM-UHFFFAOYSA-N 0 0 360.797 3.764 20 5 FHBDRN CC[C@@H](NS(=O)(=O)c1cc([N+](=O)[O-])ccc1C)c1cc(F)ccc1F ZINC000569747967 568429345 /nfs/dbraw/zinc/42/93/45/568429345.db2.gz JORQGRUMWKRNCE-OAHLLOKOSA-N 0 0 370.377 3.611 20 5 FHBDRN O=C(NCc1c(Cl)cccc1-n1ccnc1)c1ccc(F)cc1[N+](=O)[O-] ZINC000569859316 568431066 /nfs/dbraw/zinc/43/10/66/568431066.db2.gz CWZHENKYYLMEQF-UHFFFAOYSA-N 0 0 374.759 3.503 20 5 FHBDRN C[C@@H]1C[C@@H](CCNC(=O)c2c([N+](=O)[O-])cccc2C(F)(F)F)CCO1 ZINC000569859500 568431068 /nfs/dbraw/zinc/43/10/68/568431068.db2.gz VAPDDDLQDIQLFW-MNOVXSKESA-N 0 0 360.332 3.549 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](CC(=O)N(C)C)c1ccccc1 ZINC000569877030 568433003 /nfs/dbraw/zinc/43/30/03/568433003.db2.gz IZRFKUCKYUENAB-KXBFYZLASA-N 0 0 355.438 3.773 20 5 FHBDRN C[C@H](Cn1ccc2ccccc21)c1nc(-c2ccc(N)c([N+](=O)[O-])c2)no1 ZINC000569885969 568433788 /nfs/dbraw/zinc/43/37/88/568433788.db2.gz ROSCXODJSZTTQH-GFCCVEGCSA-N 0 0 363.377 3.985 20 5 FHBDRN COc1ccccc1[C@@H](CO)N[C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000569908214 568435813 /nfs/dbraw/zinc/43/58/13/568435813.db2.gz SLRKULOYJYWWDY-ZWKOTPCHSA-N 0 0 356.422 3.649 20 5 FHBDRN C[C@@]1(c2ccccc2)CN(c2ncc([N+](=O)[O-])cc2C(F)(F)F)CCO1 ZINC000570025033 568441837 /nfs/dbraw/zinc/44/18/37/568441837.db2.gz OWTOCZQMWUPIQW-INIZCTEOSA-N 0 0 367.327 3.761 20 5 FHBDRN CC(C)n1cc([C@@H](C)NC(=O)c2c([N+](=O)[O-])cccc2C(F)(F)F)cn1 ZINC000569968722 568444964 /nfs/dbraw/zinc/44/49/64/568444964.db2.gz LTVIQRAUJULDQR-SNVBAGLBSA-N 0 0 370.331 3.882 20 5 FHBDRN CC[C@H](c1ccccc1OC)N(C)C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000570081437 568457591 /nfs/dbraw/zinc/45/75/91/568457591.db2.gz OAYFPKHVOCBDQW-CQSZACIVSA-N 0 0 372.377 3.555 20 5 FHBDRN CNc1ccc(C(=O)Nc2ccc(C)c(Br)c2)cc1[N+](=O)[O-] ZINC000316679038 568460475 /nfs/dbraw/zinc/46/04/75/568460475.db2.gz MHNRYCYTSHLFRV-UHFFFAOYSA-N 0 0 364.199 3.960 20 5 FHBDRN Cc1cc(OCc2nc(-c3ccc4c(n3)CCCC4)no2)ccc1[N+](=O)[O-] ZINC000570245960 568466134 /nfs/dbraw/zinc/46/61/34/568466134.db2.gz ZBWUSZJZSHYBSU-UHFFFAOYSA-N 0 0 366.377 3.806 20 5 FHBDRN O=[N+]([O-])c1cccc(-n2ccc(-c3nc(-c4ccc(F)cc4F)no3)n2)c1 ZINC000570417699 568475352 /nfs/dbraw/zinc/47/53/52/568475352.db2.gz SPKCJUGQEVHTCE-UHFFFAOYSA-N 0 0 369.287 3.776 20 5 FHBDRN Cc1ccc(-c2nnc(N3CCc4ccc([N+](=O)[O-])cc4C3)n2C2CC2)o1 ZINC000570457856 568478248 /nfs/dbraw/zinc/47/82/48/568478248.db2.gz WUZAQNRXSAEZEC-UHFFFAOYSA-N 0 0 365.393 3.652 20 5 FHBDRN C[C@H](CNC(=O)c1ccc(Br)cc1[N+](=O)[O-])CC(F)(F)F ZINC000412681091 568486225 /nfs/dbraw/zinc/48/62/25/568486225.db2.gz RBHOGVLGAFOMJC-ZETCQYMHSA-N 0 0 369.137 3.676 20 5 FHBDRN COc1ccc2c(c1)OC[C@@H](Nc1ccc([N+](=O)[O-])cc1OC(F)F)C2 ZINC000570557837 568487114 /nfs/dbraw/zinc/48/71/14/568487114.db2.gz DNLJIHZGGJPKHN-NSHDSACASA-N 0 0 366.320 3.620 20 5 FHBDRN Cc1c(Cl)cc(S(=O)(=O)N2c3ccccc3C[C@H]2C)cc1[N+](=O)[O-] ZINC000007416871 568505432 /nfs/dbraw/zinc/50/54/32/568505432.db2.gz QUGGPRMCKDTXTF-SNVBAGLBSA-N 0 0 366.826 3.697 20 5 FHBDRN COc1ccc(OCC(=O)N[C@H](CC(C)C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000007441931 568511095 /nfs/dbraw/zinc/51/10/95/568511095.db2.gz OAXYMIHZIJIKKG-QGZVFWFLSA-N 0 0 372.421 3.886 20 5 FHBDRN CNC(=O)c1cccc(CNC(=O)c2cc3ccccc3c3cccnc23)c1 ZINC000049658434 568558213 /nfs/dbraw/zinc/55/82/13/568558213.db2.gz WGRYRCQAKBGEKT-UHFFFAOYSA-N 0 0 369.424 3.678 20 5 FHBDRN C[C@@H](c1ccco1)N(C(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)C1CC1 ZINC000056185958 568641161 /nfs/dbraw/zinc/64/11/61/568641161.db2.gz RWPDZZOPHGLEDL-ZDUSSCGKSA-N 0 0 366.377 3.739 20 5 FHBDRN CC[C@@H](Nc1ccc([N+](=O)[O-])cc1-c1nn[nH]n1)c1cc(F)ccc1F ZINC000736370926 598975351 /nfs/dbraw/zinc/97/53/51/598975351.db2.gz UDUHOZZGZCHCTO-CQSZACIVSA-N 0 0 360.324 3.616 20 5 FHBDRN Cc1cc(C)c(-c2nn[nH]n2)c(S[C@@H](C)c2ccccc2[N+](=O)[O-])n1 ZINC000822193475 599124111 /nfs/dbraw/zinc/12/41/11/599124111.db2.gz YXCOFWGCIVSIIH-NSHDSACASA-N 0 0 356.411 3.640 20 5 FHBDRN O=[N+]([O-])c1cnc(Sc2cc(Cl)ccc2Cl)c(-c2nn[nH]n2)c1 ZINC000823652267 599152492 /nfs/dbraw/zinc/15/24/92/599152492.db2.gz XUIFNWBCJUEADW-UHFFFAOYSA-N 0 0 369.193 3.628 20 5 FHBDRN O=[N+]([O-])c1ccc2nc(Oc3ccc(-c4nn[nH]n4)cc3Cl)sc2c1 ZINC000738366887 598276038 /nfs/dbraw/zinc/27/60/38/598276038.db2.gz JQZOSSYFMOASKL-UHFFFAOYSA-N 0 0 374.769 3.830 20 5 FHBDRN C[C@H](c1cccc(Cl)c1)N(C)c1ccc([N+](=O)[O-])cc1-c1nn[nH]n1 ZINC000736202316 598814663 /nfs/dbraw/zinc/81/46/63/598814663.db2.gz ZYZQDZSNBSPQLC-SNVBAGLBSA-N 0 0 358.789 3.626 20 5 FHBDRN O=[N+]([O-])c1ccc(Oc2ccc(-c3nn[nH]n3)cc2Cl)c(Cl)c1 ZINC000823644271 599317657 /nfs/dbraw/zinc/31/76/57/599317657.db2.gz JBHMXNDZBRRLOR-UHFFFAOYSA-N 0 0 352.137 3.874 20 5 FHBDRN O=[N+]([O-])c1ccc(NCC2CCC(C(F)(F)F)CC2)c(-c2nn[nH]n2)c1 ZINC000823639462 599689619 /nfs/dbraw/zinc/68/96/19/599689619.db2.gz AQRNCEIELVGJJI-UHFFFAOYSA-N 0 0 370.335 3.556 20 5 FHBDRN O=C([O-])c1ccc(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)o1 ZINC000740132016 600524223 /nfs/dbraw/zinc/52/42/23/600524223.db2.gz AHQDMHCTDNRSIK-UHFFFAOYSA-N 0 0 358.375 3.904 20 5 FHBDRN O=C([O-])[C@H]([NH2+]CCCCc1ccc([N+](=O)[O-])cc1)c1cccc(Cl)c1 ZINC000739506492 600599973 /nfs/dbraw/zinc/59/99/73/600599973.db2.gz GUMXTYQDUCRZOD-QGZVFWFLSA-N 0 0 362.813 3.986 20 5 FHBDRN C[NH+](C)[C@H](CNc1cc(Cl)c(C(=O)[O-])cc1[N+](=O)[O-])c1ccccc1 ZINC000737360264 600942149 /nfs/dbraw/zinc/94/21/49/600942149.db2.gz WRAXSKAKSZLXNL-MRXNPFEDSA-N 0 0 363.801 3.661 20 5 FHBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](c1ccccc1)[C@@H](C)C(=O)[O-] ZINC000827058534 601658062 /nfs/dbraw/zinc/65/80/62/601658062.db2.gz IWMSLXDDIHIPHC-KUHUBIRLSA-N 0 0 372.421 3.934 20 5 FHBDRN Cc1c(C[N@@H+](C)[C@H](C(=O)[O-])c2cc(F)c(F)c(F)c2)cccc1[N+](=O)[O-] ZINC000832853751 601902022 /nfs/dbraw/zinc/90/20/22/601902022.db2.gz UKKKVNPZCLXDGA-INIZCTEOSA-N 0 0 368.311 3.578 20 5 FHBDRN Cc1cc(NC2CC[NH+](C3CCCCC3)CC2)cc(C(=O)[O-])c1[N+](=O)[O-] ZINC000522061057 602320520 /nfs/dbraw/zinc/32/05/20/602320520.db2.gz UUGZHTLLKCUDKM-UHFFFAOYSA-N 0 0 361.442 3.810 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2nc(-c3cccc(-c4nn[nH]n4)c3)cs2)c1 ZINC000826499276 607645372 /nfs/dbraw/zinc/64/53/72/607645372.db2.gz CFNIGXWGMQMIMA-UHFFFAOYSA-N 0 0 350.363 3.565 20 5 FHBDRN CC(C)[N@H+](C)Cc1ccccc1CNc1cc(C(=O)[O-])ccc1[N+](=O)[O-] ZINC000575127989 605176945 /nfs/dbraw/zinc/17/69/45/605176945.db2.gz WXADXYFFBBMSOO-UHFFFAOYSA-N 0 0 357.410 3.745 20 5 FHBDRN O=[N+]([O-])c1ccc2nc(Sc3cccc(-c4nn[nH]n4)c3)sc2c1 ZINC000823644154 606945619 /nfs/dbraw/zinc/94/56/19/606945619.db2.gz GJQSAQQEKQEEEO-UHFFFAOYSA-N 0 0 356.392 3.536 20 5 FHBDRN O=[N+]([O-])c1ccc(Sc2ccc(-c3nn[nH]n3)cc2F)c2ncccc12 ZINC000826499804 608186626 /nfs/dbraw/zinc/18/66/26/608186626.db2.gz YDRQHVBTDKWIBS-UHFFFAOYSA-N 0 0 368.353 3.613 20 5 FHBDRN Cc1cccc(OS(=O)(=O)c2ccc(C(=O)C(C)C)cc2)c1[N+](=O)[O-] ZINC000755282442 936315658 /nfs/dbraw/zinc/31/56/58/936315658.db2.gz QJTWVDWLFAIWSB-UHFFFAOYSA-N 0 0 363.391 3.510 20 5 FHBDRN O=[N+]([O-])c1ccc(NC[C@@H]2OCCc3ccccc32)c(OC(F)F)c1 ZINC000612785036 936318322 /nfs/dbraw/zinc/31/83/22/936318322.db2.gz KUIPWLBUYPFJKK-INIZCTEOSA-N 0 0 350.321 3.922 20 5 FHBDRN Cc1ccc(SC[C@@H](C)NC(=O)Cc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000472274470 936335369 /nfs/dbraw/zinc/33/53/69/936335369.db2.gz IQQNTTMFWNUSQN-CYBMUJFWSA-N 0 0 362.426 3.882 20 5 FHBDRN COc1cc2c(cc1Cl)CN(C(=O)c1cccc(C)c1[N+](=O)[O-])CC2 ZINC000572913434 936345098 /nfs/dbraw/zinc/34/50/98/936345098.db2.gz AEZRNYFZTKMMTP-UHFFFAOYSA-N 0 0 360.797 3.764 20 5 FHBDRN CO[C@@H](C)c1nc(CNC(=O)c2c(C)cc(Cl)cc2[N+](=O)[O-])cs1 ZINC000278002529 936345923 /nfs/dbraw/zinc/34/59/23/936345923.db2.gz OKOXCFZPXTXORS-VIFPVBQESA-N 0 0 369.830 3.651 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1-c1nc(Cc2nc3cc(F)ccc3s2)no1 ZINC000612932199 936346147 /nfs/dbraw/zinc/34/61/47/936346147.db2.gz UYKSBHADEDJLPS-UHFFFAOYSA-N 0 0 371.353 3.688 20 5 FHBDRN O=c1cc(-c2nc([C@@H]3CCc4ccccc43)no2)c2cc([N+](=O)[O-])ccc2[nH]1 ZINC000612933415 936346211 /nfs/dbraw/zinc/34/62/11/936346211.db2.gz TWDHWOQMMSYLHN-CQSZACIVSA-N 0 0 374.356 3.977 20 5 FHBDRN Cc1cc(NC(=O)N2CCC(n3cc(Cl)cn3)CC2)ccc1[N+](=O)[O-] ZINC000153639388 936346606 /nfs/dbraw/zinc/34/66/06/936346606.db2.gz LSNBDSLHMZFTOP-UHFFFAOYSA-N 0 0 363.805 3.622 20 5 FHBDRN Cc1c(Cc2noc([C@H]3CCCCN3C(=O)C(C)C)n2)cccc1[N+](=O)[O-] ZINC000582989886 936352312 /nfs/dbraw/zinc/35/23/12/936352312.db2.gz FVIVUFOTNHNJKZ-MRXNPFEDSA-N 0 0 372.425 3.587 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)NCc1ccnc(N2CCCCC2)c1 ZINC000079102734 936353485 /nfs/dbraw/zinc/35/34/85/936353485.db2.gz ZEJKNDBYAPWIPF-UHFFFAOYSA-N 0 0 369.425 3.610 20 5 FHBDRN Cc1ccc(NC(=O)NC[C@H]2CC[C@@H](c3ccccc3)O2)cc1[N+](=O)[O-] ZINC000582992916 936354927 /nfs/dbraw/zinc/35/49/27/936354927.db2.gz JYRXFLBTQNFOHS-AEFFLSMTSA-N 0 0 355.394 3.945 20 5 FHBDRN CC1(C)CN(C(=O)COc2ccccc2[N+](=O)[O-])C[C@H]1c1ccccc1 ZINC000122014434 936364580 /nfs/dbraw/zinc/36/45/80/936364580.db2.gz YPODWOGRVIDJKV-INIZCTEOSA-N 0 0 354.406 3.626 20 5 FHBDRN C[C@H]1CN(C(=O)c2cccc3c(=O)c4ccccc4[nH]c23)CC(C)(C)O1 ZINC000278018768 936370882 /nfs/dbraw/zinc/37/08/82/936370882.db2.gz ZFBYBBQZCJSNKN-ZDUSSCGKSA-N 0 0 350.418 3.733 20 5 FHBDRN COC(=O)c1ccc(OCc2cc(C)nc3ccccc23)cc1[N+](=O)[O-] ZINC000613110734 936374235 /nfs/dbraw/zinc/37/42/35/936374235.db2.gz WYCIRGRAIAFXBI-UHFFFAOYSA-N 0 0 352.346 3.817 20 5 FHBDRN COc1cccc(N2CC[C@@H](CNc3ncc(Cl)cc3[N+](=O)[O-])C2)c1 ZINC000153679172 936381129 /nfs/dbraw/zinc/38/11/29/936381129.db2.gz PMGMWFIXAZQTBR-LBPRGKRZSA-N 0 0 362.817 3.590 20 5 FHBDRN O=[N+]([O-])c1ccc(NCCCn2cc(Br)cn2)c(Cl)c1 ZINC000394394565 936386919 /nfs/dbraw/zinc/38/69/19/936386919.db2.gz ADTXIYVSSBCJII-UHFFFAOYSA-N 0 0 359.611 3.709 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)NCc2ccc(OC(F)F)c(F)c2)c1 ZINC000511229154 936390127 /nfs/dbraw/zinc/39/01/27/936390127.db2.gz JOAGOUNEMMKBBT-UHFFFAOYSA-N 0 0 354.284 3.574 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H]1CCO[C@@H](C(C)(C)C)C1 ZINC000439887337 945066044 /nfs/dbraw/zinc/06/60/44/945066044.db2.gz JOROJHNXEGNRMQ-MLGOLLRUSA-N 0 0 365.430 3.709 20 5 FHBDRN Cc1cc(C)cc(N2CC[C@H](C(=O)Nc3ccc(C)c([N+](=O)[O-])c3)C2=O)c1 ZINC000505980920 945068954 /nfs/dbraw/zinc/06/89/54/945068954.db2.gz HAZFNQSNPLZKHO-QGZVFWFLSA-N 0 0 367.405 3.512 20 5 FHBDRN O=C(N[C@@H]1CCO[C@@H](C2CC2)C1)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000278055076 937087789 /nfs/dbraw/zinc/08/77/89/937087789.db2.gz MLIXKELJIYUCAR-AUUYWEPGSA-N 0 0 362.429 3.781 20 5 FHBDRN CC[C@H](c1ccccc1OC)N(C)C(=O)c1cccc([N+](=O)[O-])c1OC ZINC000514816250 937089853 /nfs/dbraw/zinc/08/98/53/937089853.db2.gz CMVXDIJEPLUKQI-OAHLLOKOSA-N 0 0 358.394 3.835 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2noc(-c3ccc(OCC(F)(F)F)cn3)n2)c1 ZINC000514816625 937089869 /nfs/dbraw/zinc/08/98/69/937089869.db2.gz QZNHZLLPYLCHPN-UHFFFAOYSA-N 0 0 366.255 3.648 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(-c2nc(Cc3c[nH]c4cc(Cl)ccc34)no2)n1 ZINC000514817066 937089883 /nfs/dbraw/zinc/08/98/83/937089883.db2.gz VPKZVSXCFAABMY-UHFFFAOYSA-N 0 0 372.772 3.587 20 5 FHBDRN C[C@@H](C(=O)N[C@@H](C)c1ccc(-n2cccn2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000514834638 937094053 /nfs/dbraw/zinc/09/40/53/937094053.db2.gz UZPLXWDPGKMWLH-CABCVRRESA-N 0 0 364.405 3.761 20 5 FHBDRN O=C(Nc1ccc2c(c1)CCO2)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000079475956 937097352 /nfs/dbraw/zinc/09/73/52/937097352.db2.gz NLLQBNRVPDLJIY-UHFFFAOYSA-N 0 0 352.268 3.801 20 5 FHBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCC[C@H]2c2ccsc2)c(Cl)c1 ZINC000056062924 937110029 /nfs/dbraw/zinc/11/00/29/937110029.db2.gz QPBYLHDAIVRTIA-ZDUSSCGKSA-N 0 0 372.855 3.836 20 5 FHBDRN Cc1nn(C)c(NCc2ccc(COCc3ccccc3)cc2)c1[N+](=O)[O-] ZINC000052103911 937117323 /nfs/dbraw/zinc/11/73/23/937117323.db2.gz YEDQMKDUFKKPBB-UHFFFAOYSA-N 0 0 366.421 3.966 20 5 FHBDRN C[C@@H](NC(=O)c1cccc2c(=O)c3ccccc3[nH]c12)[C@@H]1CCCCO1 ZINC000278077598 937118647 /nfs/dbraw/zinc/11/86/47/937118647.db2.gz OTDUCZYEMSLIEP-ACJLOTCBSA-N 0 0 350.418 3.781 20 5 FHBDRN Cc1ccccc1C(C)(C)CNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O ZINC000302594567 937124005 /nfs/dbraw/zinc/12/40/05/937124005.db2.gz AYBONXNJNMHEEU-UHFFFAOYSA-N 0 0 362.451 3.696 20 5 FHBDRN CSc1cccc(NC(=O)[C@H](C)OC(=O)c2ccc([N+](=O)[O-])s2)c1 ZINC000023344006 927036757 /nfs/dbraw/zinc/03/67/57/927036757.db2.gz SJNVXUSJIYPUDQ-VIFPVBQESA-N 0 0 366.420 3.562 20 5 FHBDRN CCOC(=O)[C@H](CNc1ccc([N+](=O)[O-])c(C(C)=O)c1)Cc1ccccc1 ZINC000557546049 927049552 /nfs/dbraw/zinc/04/95/52/927049552.db2.gz PIUVKJPXBYDKQL-INIZCTEOSA-N 0 0 370.405 3.631 20 5 FHBDRN CCCCOc1ccc(CNC(=O)c2csc([N+](=O)[O-])c2)cc1OC ZINC000044524987 927056826 /nfs/dbraw/zinc/05/68/26/927056826.db2.gz JDJKWKKMOOEJAR-UHFFFAOYSA-N 0 0 364.423 3.774 20 5 FHBDRN CCCOc1ccccc1[C@@H](CC(C)C)NC(=O)c1[nH]ncc1[N+](=O)[O-] ZINC000126827365 927084384 /nfs/dbraw/zinc/08/43/84/927084384.db2.gz PHHIGNVHBOJBKL-CQSZACIVSA-N 0 0 360.414 3.624 20 5 FHBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CSC[C@@H]1C ZINC000557590701 927095514 /nfs/dbraw/zinc/09/55/14/927095514.db2.gz CRKPATUEKURNNU-SMDDNHRTSA-N 0 0 354.497 3.824 20 5 FHBDRN COc1ccc(Cl)c(NC(=O)c2cc(OC)c(OC)c([N+](=O)[O-])c2)c1 ZINC000610173662 927130941 /nfs/dbraw/zinc/13/09/41/927130941.db2.gz QMDOUVJATCKMJF-UHFFFAOYSA-N 0 0 366.757 3.526 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(C(F)(F)F)nc1 ZINC000471104748 927140939 /nfs/dbraw/zinc/14/09/39/927140939.db2.gz RNONYXKFMZKURD-UHFFFAOYSA-N 0 0 355.272 3.660 20 5 FHBDRN C[C@@H](CNC(=O)NCc1ccc([N+](=O)[O-])cc1)Oc1ccccc1Cl ZINC000175262682 927141340 /nfs/dbraw/zinc/14/13/40/927141340.db2.gz CHOIPETZDUPTTI-LBPRGKRZSA-N 0 0 363.801 3.515 20 5 FHBDRN CCc1nc(C)c([C@@H](C)N(C)C(=O)NCc2ccc([N+](=O)[O-])cc2)s1 ZINC000175265510 927143862 /nfs/dbraw/zinc/14/38/62/927143862.db2.gz HSXHTSHUEVGHPB-GFCCVEGCSA-N 0 0 362.455 3.825 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cn1)C(=O)Nc1cccc2ncccc21 ZINC000160184589 927147052 /nfs/dbraw/zinc/14/70/52/927147052.db2.gz KKGAYIBOIHYUCR-NSHDSACASA-N 0 0 354.391 3.657 20 5 FHBDRN COc1ccc(F)cc1CNC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000187906198 937140037 /nfs/dbraw/zinc/14/00/37/937140037.db2.gz NKOPWSMERCPUBS-UHFFFAOYSA-N 0 0 373.384 3.617 20 5 FHBDRN CCN(C(=O)c1cc(OC)c(OC)c([N+](=O)[O-])c1)[C@H]1CCCC[C@H]1C ZINC000610174696 927177994 /nfs/dbraw/zinc/17/79/94/927177994.db2.gz XMCKIRHBMAYTQC-OCCSQVGLSA-N 0 0 350.415 3.653 20 5 FHBDRN Cc1ncc([N+](=O)[O-])n1CC(=O)N(Cc1cccs1)c1ccc(F)cc1 ZINC001125271873 927206517 /nfs/dbraw/zinc/20/65/17/927206517.db2.gz NJWHXDOXAVEVDC-UHFFFAOYSA-N 0 0 374.397 3.534 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N(C)Cc1cccc(N(C)C)c1 ZINC000120100863 927206566 /nfs/dbraw/zinc/20/65/66/927206566.db2.gz FCIGWMTZRFBABG-UHFFFAOYSA-N 0 0 356.426 3.942 20 5 FHBDRN Cc1cc(OCC(=O)N2CCC(c3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000430142089 927222883 /nfs/dbraw/zinc/22/28/83/927222883.db2.gz ZQEIABWBSVHZQW-UHFFFAOYSA-N 0 0 354.406 3.688 20 5 FHBDRN Cc1cnc([C@@H](C)NC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)s1 ZINC000153887626 927287660 /nfs/dbraw/zinc/28/76/60/927287660.db2.gz VVHMZCVTORQZAZ-GFCCVEGCSA-N 0 0 360.439 3.795 20 5 FHBDRN CCC(CC)c1cc(CNC(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)on1 ZINC000579757349 927300972 /nfs/dbraw/zinc/30/09/72/927300972.db2.gz ZSSSKLQCFGCFNS-UHFFFAOYSA-N 0 0 367.352 3.624 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NC[C@]1(O)CCCc2ccccc21 ZINC000120119534 927310521 /nfs/dbraw/zinc/31/05/21/927310521.db2.gz ZUBOPLKCHHIHBA-HXUWFJFHSA-N 0 0 369.421 3.557 20 5 FHBDRN Cc1nn(Cc2ccc(C(=O)N3CCC[C@@H](C)[C@@H]3C)cc2)c(C)c1[N+](=O)[O-] ZINC000610178474 927320720 /nfs/dbraw/zinc/32/07/20/927320720.db2.gz CDLJICRECJIYKK-HIFRSBDPSA-N 0 0 370.453 3.717 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)NCC1(Cc2ccc(F)cc2)CC1 ZINC000471110967 927330241 /nfs/dbraw/zinc/33/02/41/927330241.db2.gz YFFVXVKVPKXIHI-UHFFFAOYSA-N 0 0 372.396 3.885 20 5 FHBDRN O=C(Nc1nccn1-c1ccccc1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000430148035 927331771 /nfs/dbraw/zinc/33/17/71/927331771.db2.gz KLJQUKLUOKLAKQ-UHFFFAOYSA-N 0 0 363.377 3.607 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCC(c3nnc4n3CCCC4)CC2)c(Cl)c1 ZINC000274654392 927353754 /nfs/dbraw/zinc/35/37/54/927353754.db2.gz DFPRSOCROPMRLB-UHFFFAOYSA-N 0 0 361.833 3.560 20 5 FHBDRN CCc1nn(C)c(NCc2csc(CCc3ccccc3)n2)c1[N+](=O)[O-] ZINC000579766045 927354005 /nfs/dbraw/zinc/35/40/05/927354005.db2.gz QMIDRLYOZUPXKF-UHFFFAOYSA-N 0 0 371.466 3.745 20 5 FHBDRN O=C(/C=C/c1ccc([N+](=O)[O-])cc1)O[C@@H](c1ccccn1)C(F)(F)F ZINC000160218618 927364680 /nfs/dbraw/zinc/36/46/80/927364680.db2.gz JAJAZLVWCOBZQA-PPYMECGQSA-N 0 0 352.268 3.850 20 5 FHBDRN COc1cccc(CNC(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)c1OC ZINC000120132629 927366782 /nfs/dbraw/zinc/36/67/82/927366782.db2.gz JQXKPFDMGLNVML-UHFFFAOYSA-N 0 0 359.382 3.551 20 5 FHBDRN CC[C@@](C)(OC)c1noc(-c2cc(Br)c(C)c([N+](=O)[O-])c2)n1 ZINC000583136690 937157513 /nfs/dbraw/zinc/15/75/13/937157513.db2.gz KZSQDICYURUDIC-CQSZACIVSA-N 0 0 370.203 3.987 20 5 FHBDRN O=c1ccc(-c2cccc([N+](=O)[O-])c2)nn1CCOc1ccccc1Cl ZINC000126852441 927446838 /nfs/dbraw/zinc/44/68/38/927446838.db2.gz IEYIUUWIUMLYNM-UHFFFAOYSA-N 0 0 371.780 3.551 20 5 FHBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)N[C@@H](c1ccccc1)C(F)(F)F ZINC000120157961 927465803 /nfs/dbraw/zinc/46/58/03/927465803.db2.gz VOWAXCHVIWRFTP-HNNXBMFYSA-N 0 0 367.327 3.740 20 5 FHBDRN Cc1cccc(C(=O)Nc2cc(Br)ccc2O)c1[N+](=O)[O-] ZINC000176434057 937166398 /nfs/dbraw/zinc/16/63/98/937166398.db2.gz UDJSEOWJUPVMQF-UHFFFAOYSA-N 0 0 351.156 3.624 20 5 FHBDRN COc1cccc(OC)c1CC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000176436371 937166906 /nfs/dbraw/zinc/16/69/06/937166906.db2.gz AZPCEQRJOSPBPG-UHFFFAOYSA-N 0 0 372.421 3.592 20 5 FHBDRN Cc1ccc(Oc2ccc(NC(=O)c3ccccc3[N+](=O)[O-])cc2)nn1 ZINC000610184228 927504158 /nfs/dbraw/zinc/50/41/58/927504158.db2.gz JQTZXXBLYBPZBG-UHFFFAOYSA-N 0 0 350.334 3.738 20 5 FHBDRN COCCC[C@H](Cc1ccccc1)NC(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000471117664 927506953 /nfs/dbraw/zinc/50/69/53/927506953.db2.gz WMFFGAZPIQDBSN-MRXNPFEDSA-N 0 0 357.410 3.754 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)cnc1N1CCC[C@@H]1C[C@@H](O)c1cccs1 ZINC000153916673 927513758 /nfs/dbraw/zinc/51/37/58/927513758.db2.gz RPBUKGANMJXZKH-DGCLKSJQSA-N 0 0 353.831 3.797 20 5 FHBDRN COc1ccc(C[C@@H](C)CNC(=O)c2cccc(SC)c2[N+](=O)[O-])cc1 ZINC000186897384 927517141 /nfs/dbraw/zinc/51/71/41/927517141.db2.gz FPAREIZYQDGNHS-CYBMUJFWSA-N 0 0 374.462 3.934 20 5 FHBDRN COC[C@H](NC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1)C(C)C ZINC000610185229 927549471 /nfs/dbraw/zinc/54/94/71/927549471.db2.gz HCTXUNZVXSZEQT-KRWDZBQOSA-N 0 0 357.410 3.739 20 5 FHBDRN COc1cccc([C@@H]2CN(C(=O)Nc3ccc([N+](=O)[O-])cc3C)CCO2)c1 ZINC000162568000 937174204 /nfs/dbraw/zinc/17/42/04/937174204.db2.gz IABDDUXQVOGFPL-SFHVURJKSA-N 0 0 371.393 3.517 20 5 FHBDRN CCNc1ccc(C(=O)N[C@H](CC)c2cccc([N+](=O)[O-])c2)cc1[N+](=O)[O-] ZINC001266278118 927596881 /nfs/dbraw/zinc/59/68/81/927596881.db2.gz KAEKTSYZHIJKAJ-OAHLLOKOSA-N 0 0 372.381 3.816 20 5 FHBDRN CSCCCCCNC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000186945686 927598728 /nfs/dbraw/zinc/59/87/28/927598728.db2.gz PCTQIUUAQBVWFO-UHFFFAOYSA-N 0 0 362.904 3.990 20 5 FHBDRN CC[C@@H](CC1CCCC1)C(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000510069129 927638318 /nfs/dbraw/zinc/63/83/18/927638318.db2.gz FSYHROOMTOPJBH-KRWDZBQOSA-N 0 0 359.470 3.850 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CCC[C@@H]1C[C@@H](O)c1ccco1 ZINC000162575084 937183200 /nfs/dbraw/zinc/18/32/00/937183200.db2.gz SPLYAJLCYOXJRW-CZUORRHYSA-N 0 0 359.382 3.616 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CC[C@@]2(C1)OCc1ccccc12 ZINC000186972872 927686241 /nfs/dbraw/zinc/68/62/41/927686241.db2.gz BSTZPLCBWKGGIG-SFHVURJKSA-N 0 0 358.781 3.520 20 5 FHBDRN COc1ccc(C(=O)COc2ccc([N+](=O)[O-])cc2Br)cc1 ZINC000133690740 927709414 /nfs/dbraw/zinc/70/94/14/927709414.db2.gz VBSYUVUKJDXELK-UHFFFAOYSA-N 0 0 366.167 3.628 20 5 FHBDRN CN(Cc1ccccc1C(F)(F)F)C(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000248036654 937189558 /nfs/dbraw/zinc/18/95/58/937189558.db2.gz JKYYOCWDQVWVJF-UHFFFAOYSA-N 0 0 352.312 3.815 20 5 FHBDRN C[C@H](OC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1)c1ccccc1Cl ZINC000176763857 937191042 /nfs/dbraw/zinc/19/10/42/937191042.db2.gz XVQQPFHBRKGWEG-NSHDSACASA-N 0 0 372.768 3.747 20 5 FHBDRN O=[N+]([O-])c1ccc(OCc2nn(-c3ccccc3)c3c2CCC3)c(F)c1 ZINC000109692219 927769747 /nfs/dbraw/zinc/76/97/47/927769747.db2.gz WWACHXHQRJKWKR-UHFFFAOYSA-N 0 0 353.353 3.987 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCc1ccnc(OC2CCC2)c1 ZINC000120228122 927806014 /nfs/dbraw/zinc/80/60/14/927806014.db2.gz YAAQMCLWIZAGIX-UHFFFAOYSA-N 0 0 370.409 3.860 20 5 FHBDRN CC[C@@H](NC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1ccncc1 ZINC000175306036 927819039 /nfs/dbraw/zinc/81/90/39/927819039.db2.gz SUGKYURZJQJXOG-GFCCVEGCSA-N 0 0 366.324 3.864 20 5 FHBDRN O=C(N1CCC[C@@H]1c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(F)(F)F ZINC000186997743 927823297 /nfs/dbraw/zinc/82/32/97/927823297.db2.gz TUSTWSVBOMJRGU-GFCCVEGCSA-N 0 0 371.340 3.944 20 5 FHBDRN O=C(N[C@H]1C[C@@H]1C1CCCCC1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000610191595 927852659 /nfs/dbraw/zinc/85/26/59/927852659.db2.gz YXGGPURLHDFXIF-SJORKVTESA-N 0 0 357.454 3.894 20 5 FHBDRN O=C(COc1ccc(F)c(Cl)c1)Nc1cc([N+](=O)[O-])c(F)cc1F ZINC000120261089 927903980 /nfs/dbraw/zinc/90/39/80/927903980.db2.gz YPJAZRXMUBHSKN-UHFFFAOYSA-N 0 0 360.675 3.683 20 5 FHBDRN CSc1cccc(C(=O)N[C@H]2CCCO[C@@H]2CC(C)C)c1[N+](=O)[O-] ZINC000187109776 927919691 /nfs/dbraw/zinc/91/96/91/927919691.db2.gz WVVAMQROTWXHKY-UONOGXRCSA-N 0 0 352.456 3.640 20 5 FHBDRN COC(=O)[C@@H](CNC(=O)c1cc2ccccc2c2cccnc12)CC(C)C ZINC000610201510 927963491 /nfs/dbraw/zinc/96/34/91/927963491.db2.gz ODUAANYWCHRXQR-MRXNPFEDSA-N 0 0 364.445 3.953 20 5 FHBDRN COCc1cc(N[C@@H](C)CCc2ccccc2[N+](=O)[O-])cc(C(=O)OC)c1 ZINC000430203238 927981076 /nfs/dbraw/zinc/98/10/76/927981076.db2.gz NWHZGYMVUCTINH-AWEZNQCLSA-N 0 0 372.421 3.961 20 5 FHBDRN CCN(C[C@H]1COc2ccccc2O1)C(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000043149204 927985335 /nfs/dbraw/zinc/98/53/35/927985335.db2.gz RQNNPJQSMYZFJF-HNNXBMFYSA-N 0 0 371.393 3.597 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)cc1 ZINC000049653341 928026836 /nfs/dbraw/zinc/02/68/36/928026836.db2.gz TUICDVVRMSSBTC-AWEZNQCLSA-N 0 0 350.378 3.580 20 5 FHBDRN CCOc1ccccc1CNC(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1 ZINC001125290958 928029292 /nfs/dbraw/zinc/02/92/92/928029292.db2.gz WLFJBTFPDVFKEM-UHFFFAOYSA-N 0 0 358.394 3.711 20 5 FHBDRN Cc1ccccc1[C@@H]1CC(=O)N(CN2c3ccc([N+](=O)[O-])cc3C[C@@H]2C)C1 ZINC000728194505 928051442 /nfs/dbraw/zinc/05/14/42/928051442.db2.gz ACYWHAYPVRVTEY-DOTOQJQBSA-N 0 0 365.433 3.628 20 5 FHBDRN Cc1c(NC(=O)NC(C)(C)C2CC2)cc(Br)cc1[N+](=O)[O-] ZINC000583181910 937216468 /nfs/dbraw/zinc/21/64/68/937216468.db2.gz PICQTNIZKSMRNQ-UHFFFAOYSA-N 0 0 356.220 3.976 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1CN[C@@H](CC(=O)OC(C)C)c1ccccc1 ZINC000430209429 928088309 /nfs/dbraw/zinc/08/83/09/928088309.db2.gz XUNKOSOWYCOJKL-SFHVURJKSA-N 0 0 372.421 3.776 20 5 FHBDRN CC(=O)Nc1cccc(C(=O)OCCSc2ccc([N+](=O)[O-])cc2)c1 ZINC000784937413 928089662 /nfs/dbraw/zinc/08/96/62/928089662.db2.gz IDOPELHPPMCBAI-UHFFFAOYSA-N 0 0 360.391 3.502 20 5 FHBDRN O=C(c1cc(F)ccc1F)N1CCS[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000610210346 928094981 /nfs/dbraw/zinc/09/49/81/928094981.db2.gz KLWPXRLBPYIWSK-INIZCTEOSA-N 0 0 350.346 3.761 20 5 FHBDRN CCOC(=O)c1cccnc1SCc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000083092454 928158988 /nfs/dbraw/zinc/15/89/88/928158988.db2.gz HCSHTKVKHZVFAV-UHFFFAOYSA-N 0 0 359.363 3.600 20 5 FHBDRN Cc1c(Br)cc(C(=O)N2C[C@H]3CCCC[C@@H]3C2)cc1[N+](=O)[O-] ZINC000126874173 928175189 /nfs/dbraw/zinc/17/51/89/928175189.db2.gz ISNVFULFDGTRBD-VXGBXAGGSA-N 0 0 367.243 3.928 20 5 FHBDRN CNC(=O)c1ccc(Cl)c(NC(=O)c2cccc(Cl)c2[N+](=O)[O-])c1 ZINC000175750379 928192700 /nfs/dbraw/zinc/19/27/00/928192700.db2.gz NZTZSXWJYCXVSR-UHFFFAOYSA-N 0 0 368.176 3.514 20 5 FHBDRN O=C(Nc1ccncc1[N+](=O)[O-])NC1(c2ccc(Cl)c(Cl)c2)CC1 ZINC000578059553 928205142 /nfs/dbraw/zinc/20/51/42/928205142.db2.gz XLAKUSPJIREIDH-UHFFFAOYSA-N 0 0 367.192 3.529 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)Nc1cccc2c1OCC[C@@H]2OC ZINC000471156722 928207796 /nfs/dbraw/zinc/20/77/96/928207796.db2.gz MQLGRWDPGBELJE-HNNXBMFYSA-N 0 0 372.377 3.716 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN(CC1CCC1)CC(F)(F)F ZINC000178818437 937228121 /nfs/dbraw/zinc/22/81/21/937228121.db2.gz LTCMVRYYZQGCIE-UHFFFAOYSA-N 0 0 373.375 3.896 20 5 FHBDRN C[C@@H](NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)c1ccc(Cl)cn1 ZINC000471158152 928215507 /nfs/dbraw/zinc/21/55/07/928215507.db2.gz VCXRMMHNLHPZIB-GFCCVEGCSA-N 0 0 374.828 3.734 20 5 FHBDRN CC(=O)c1ccc(OS(=O)(=O)c2ccc([N+](=O)[O-])cc2C)c(Cl)c1 ZINC000120356717 928235067 /nfs/dbraw/zinc/23/50/67/928235067.db2.gz CHRUZXZVJNZBML-UHFFFAOYSA-N 0 0 369.782 3.527 20 5 FHBDRN COCc1ccc([C@@H]2CCCN2c2cc(C)c([N+](=O)[O-])c(C(=O)OC)c2)o1 ZINC000161587808 937230829 /nfs/dbraw/zinc/23/08/29/937230829.db2.gz ODWQQAPSADMPSB-INIZCTEOSA-N 0 0 374.393 3.771 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])c(Cl)c1)c1csc([C@H]2CCCO2)n1 ZINC000120371982 928265325 /nfs/dbraw/zinc/26/53/25/928265325.db2.gz QDJRQSBTBPYYSU-GFCCVEGCSA-N 0 0 353.787 3.809 20 5 FHBDRN COc1ccc([C@H]2CCCN2Cc2ccc([N+](=O)[O-])cc2OC)cc1OC ZINC000430222758 928276215 /nfs/dbraw/zinc/27/62/15/928276215.db2.gz WUDRGJZCFKQJPW-QGZVFWFLSA-N 0 0 372.421 3.958 20 5 FHBDRN O=C(Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)[C@H]1Cc2ccccc21 ZINC000610221070 928276388 /nfs/dbraw/zinc/27/63/88/928276388.db2.gz XQBAHYPRXDLCPC-HNNXBMFYSA-N 0 0 351.387 3.997 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)Cc1ccn(-c2ccc(F)cc2)n1 ZINC000610221006 928277686 /nfs/dbraw/zinc/27/76/86/928277686.db2.gz WQDJUBZPWBCCQJ-UHFFFAOYSA-N 0 0 368.368 3.718 20 5 FHBDRN C[C@@H](C(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1)c1cccc(Cl)c1 ZINC000610220641 928281165 /nfs/dbraw/zinc/28/11/65/928281165.db2.gz RHZUTYFDKNDACD-CQSZACIVSA-N 0 0 373.840 3.701 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1CN1C[C@H](c2ccccc2C)OC[C@H]1C ZINC000430221811 928284183 /nfs/dbraw/zinc/28/41/83/928284183.db2.gz UGGZXFDERZBUBB-FOIQADDNSA-N 0 0 356.422 3.874 20 5 FHBDRN Cc1ccc(N(C)C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3F)n2)c(C)c1 ZINC001125296475 928285268 /nfs/dbraw/zinc/28/52/68/928285268.db2.gz GCNYVSOVGXKVCM-UHFFFAOYSA-N 0 0 368.368 3.813 20 5 FHBDRN C[C@@H](C(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1)c1cccc(Cl)c1 ZINC000610224034 928299897 /nfs/dbraw/zinc/29/98/97/928299897.db2.gz DRDRCWRNYOTIGC-CQSZACIVSA-N 0 0 373.840 3.701 20 5 FHBDRN Cc1cc(N[C@H]2CCC[C@H](C(=O)NC(C)C)C2)c2cccc([N+](=O)[O-])c2n1 ZINC000302045366 928319802 /nfs/dbraw/zinc/31/98/02/928319802.db2.gz XVORHSAMIXKJMQ-GJZGRUSLSA-N 0 0 370.453 3.947 20 5 FHBDRN CCOC(=O)c1cc(NC(=O)Cc2cccc([N+](=O)[O-])c2)ccc1Cl ZINC000610225442 928322760 /nfs/dbraw/zinc/32/27/60/928322760.db2.gz WZCYKQKLHQDULG-UHFFFAOYSA-N 0 0 362.769 3.606 20 5 FHBDRN O=C(NC1(c2ccccc2F)CC1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000126965983 928349013 /nfs/dbraw/zinc/34/90/13/928349013.db2.gz IDSWHAUOZIRBLO-UHFFFAOYSA-N 0 0 369.396 3.753 20 5 FHBDRN COC(C)(C)c1noc(CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])n1 ZINC000154192039 928387308 /nfs/dbraw/zinc/38/73/08/928387308.db2.gz DHDQSANXJHINNE-UHFFFAOYSA-N 0 0 374.319 3.533 20 5 FHBDRN Cc1ccc(OCCCCNC(=O)c2cc(F)cc(C)c2[N+](=O)[O-])cc1 ZINC000176770983 937242129 /nfs/dbraw/zinc/24/21/29/937242129.db2.gz YLXPXLACBQLEBQ-UHFFFAOYSA-N 0 0 360.385 3.940 20 5 FHBDRN CC[C@H](C)[C@@H](NC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)C(F)(F)F ZINC000278137819 937243241 /nfs/dbraw/zinc/24/32/41/937243241.db2.gz NEVRVMTXLMEJSZ-RMLUDKJBSA-N 0 0 371.315 3.555 20 5 FHBDRN COc1ccc(CNC(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)cc1O ZINC000178827588 937250751 /nfs/dbraw/zinc/25/07/51/937250751.db2.gz VRNHOEIWBXHOBQ-UHFFFAOYSA-N 0 0 358.394 3.537 20 5 FHBDRN Cc1c(Br)c(N[C@@H](C)c2cccc(O)c2)ncc1[N+](=O)[O-] ZINC000394752177 928472311 /nfs/dbraw/zinc/47/23/11/928472311.db2.gz VEJFMGHGBJPLTR-VIFPVBQESA-N 0 0 352.188 3.939 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)COc2ccc(Cl)c(F)c2)cc1[N+](=O)[O-] ZINC000583217604 937248965 /nfs/dbraw/zinc/24/89/65/937248965.db2.gz KGBQJPKVLUVQGV-NSHDSACASA-N 0 0 366.776 3.952 20 5 FHBDRN CC(C)(C)c1nc(CCNC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)cs1 ZINC000254953347 928481773 /nfs/dbraw/zinc/48/17/73/928481773.db2.gz QCDJYSMXMULBFD-TWGQIWQCSA-N 0 0 359.451 3.721 20 5 FHBDRN CCCN(CC(F)F)C(=O)c1sc(Br)cc1[N+](=O)[O-] ZINC000278142164 937252197 /nfs/dbraw/zinc/25/21/97/937252197.db2.gz NOWPBWCXFYBDEO-UHFFFAOYSA-N 0 0 357.176 3.536 20 5 FHBDRN O=C(Nc1c2c(nn1-c1ccccc1)CCC2)c1csc([N+](=O)[O-])c1 ZINC000044399584 937252292 /nfs/dbraw/zinc/25/22/92/937252292.db2.gz ITGCBGXWKRTZOU-UHFFFAOYSA-N 0 0 354.391 3.583 20 5 FHBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N(C)[C@H](C)c1ccncc1 ZINC000120469168 928519424 /nfs/dbraw/zinc/51/94/24/928519424.db2.gz XSDQBPWVWWJLIP-VXGBXAGGSA-N 0 0 363.801 3.630 20 5 FHBDRN CC(=O)c1cc(C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)n(C)c1 ZINC000178824037 937252982 /nfs/dbraw/zinc/25/29/82/937252982.db2.gz QYZGLZDYKLJECJ-UHFFFAOYSA-N 0 0 370.390 3.512 20 5 FHBDRN Nc1c(C(=O)Nc2nc(-c3cccc(F)c3)cs2)cccc1[N+](=O)[O-] ZINC000176532910 937253327 /nfs/dbraw/zinc/25/33/27/937253327.db2.gz QPUGMCHUDDKJPV-UHFFFAOYSA-N 0 0 358.354 3.692 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2CCCCN2c2ccccc21 ZINC000583223907 937254843 /nfs/dbraw/zinc/25/48/43/937254843.db2.gz JDHYTKNGBFBBAM-INIZCTEOSA-N 0 0 351.406 3.923 20 5 FHBDRN C[C@H]1CN(Cc2c(F)cc([N+](=O)[O-])cc2F)C[C@H](c2ccsc2)O1 ZINC000509360351 928561865 /nfs/dbraw/zinc/56/18/65/928561865.db2.gz VWPXCPOQBQCKEL-MGPLVRAMSA-N 0 0 354.378 3.897 20 5 FHBDRN Cc1cnc(C2CCN(C(=O)c3cc(F)c([N+](=O)[O-])cc3F)CC2)s1 ZINC000278146816 937258952 /nfs/dbraw/zinc/25/89/52/937258952.db2.gz NNCVSJAOXZFJKT-UHFFFAOYSA-N 0 0 367.377 3.658 20 5 FHBDRN CCNc1ccc(C(=O)Nc2cccc(-c3noc(C)n3)c2)cc1[N+](=O)[O-] ZINC000064823468 928621650 /nfs/dbraw/zinc/62/16/50/928621650.db2.gz SKTXBMSLEVSFGY-UHFFFAOYSA-N 0 0 367.365 3.637 20 5 FHBDRN COC[C@H](CC(C)(C)C)NC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000655305179 928659086 /nfs/dbraw/zinc/65/90/86/928659086.db2.gz NLMZPQFPGAADEU-HNNXBMFYSA-N 0 0 366.461 3.862 20 5 FHBDRN Cc1cc(-n2c(C)cc(C(=O)COc3cc(C)ccc3[N+](=O)[O-])c2C)no1 ZINC000021615623 928731818 /nfs/dbraw/zinc/73/18/18/928731818.db2.gz MPLZODYGWUQGNN-UHFFFAOYSA-N 0 0 369.377 3.869 20 5 FHBDRN CCOc1ccc(Cl)cc1CCNC(=O)c1ccc(C)c([N+](=O)[O-])c1 ZINC001266306825 928767227 /nfs/dbraw/zinc/76/72/27/928767227.db2.gz HXUYLEOCFSCMEK-UHFFFAOYSA-N 0 0 362.813 3.928 20 5 FHBDRN CCOC(=O)Cc1cccc(NC(=O)c2c(C)c(C)ccc2[N+](=O)[O-])c1 ZINC000889094553 928780767 /nfs/dbraw/zinc/78/07/67/928780767.db2.gz WRSIYEVZJRMVAO-UHFFFAOYSA-N 0 0 356.378 3.570 20 5 FHBDRN COc1ccc2c(c1)OCC[C@@H]2NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000610234259 928786446 /nfs/dbraw/zinc/78/64/46/928786446.db2.gz QKHSBQIYTRHEQR-HNNXBMFYSA-N 0 0 362.769 3.510 20 5 FHBDRN Cc1cc(C(=O)NCc2ccc([N+](=O)[O-])cc2)c(Br)s1 ZINC000471193983 928870079 /nfs/dbraw/zinc/87/00/79/928870079.db2.gz KXGOKSXDSABHJN-UHFFFAOYSA-N 0 0 355.213 3.657 20 5 FHBDRN COc1ccc(NC(=O)c2ccccc2[N+](=O)[O-])c(Br)c1 ZINC000608900998 928899539 /nfs/dbraw/zinc/89/95/39/928899539.db2.gz QIJGVVDQWRQGPW-UHFFFAOYSA-N 0 0 351.156 3.618 20 5 FHBDRN CC(C)Oc1nc(N2CCO[C@@](C)(c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000578247945 928902843 /nfs/dbraw/zinc/90/28/43/928902843.db2.gz OBSGTNZYXNNKFC-LJQANCHMSA-N 0 0 357.410 3.529 20 5 FHBDRN C[C@@H]1CO[C@@H](c2ccccc2)CN1C(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000608965611 928919684 /nfs/dbraw/zinc/91/96/84/928919684.db2.gz ADHMIPJHLLPVAX-BFUOFWGJSA-N 0 0 365.389 3.678 20 5 FHBDRN Cc1ccc(Cl)cc1C(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000509695341 928980496 /nfs/dbraw/zinc/98/04/96/928980496.db2.gz DPEDEPDKFNLEKN-UHFFFAOYSA-N 0 0 359.813 3.519 20 5 FHBDRN O=C(Nc1cccc(CSc2ccccn2)c1)c1ccc([N+](=O)[O-])[nH]1 ZINC000509835981 929033965 /nfs/dbraw/zinc/03/39/65/929033965.db2.gz CLBCAHMBRZIVBN-UHFFFAOYSA-N 0 0 354.391 3.863 20 5 FHBDRN O=C(/C=C\c1ccnc(Cl)c1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000255010794 929043583 /nfs/dbraw/zinc/04/35/83/929043583.db2.gz FMEPJLLEUZSBAR-DAXSKMNVSA-N 0 0 357.797 3.848 20 5 FHBDRN O=C(COc1cc(F)cc([N+](=O)[O-])c1)Nc1ccccc1Br ZINC000135341327 937300234 /nfs/dbraw/zinc/30/02/34/937300234.db2.gz KQFIFNUGAQOHBB-UHFFFAOYSA-N 0 0 369.146 3.514 20 5 FHBDRN O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1c(F)ccc(F)c1F ZINC000120620314 929108270 /nfs/dbraw/zinc/10/82/70/929108270.db2.gz MCYNGSNNRUMQNS-UHFFFAOYSA-N 0 0 362.210 3.866 20 5 FHBDRN CCC(CC)n1nc(C(=O)NCc2cc([N+](=O)[O-])c(F)cc2F)cc1C ZINC001143376611 929143398 /nfs/dbraw/zinc/14/33/98/929143398.db2.gz IMDDCHXSOHYRRG-UHFFFAOYSA-N 0 0 366.368 3.669 20 5 FHBDRN Cc1nc([C@@H]2CCCN2c2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])cs1 ZINC000275004848 929158505 /nfs/dbraw/zinc/15/85/05/929158505.db2.gz HPBJHEXAEPUBNQ-HNNXBMFYSA-N 0 0 372.450 3.593 20 5 FHBDRN COCCC1(CNC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)CCC1 ZINC000134734839 929201482 /nfs/dbraw/zinc/20/14/82/929201482.db2.gz KOWYFZGSQNWOTM-UHFFFAOYSA-N 0 0 373.356 3.525 20 5 FHBDRN COCCN1C(=O)CCc2cc(N[C@H](C)c3ccc([N+](=O)[O-])cc3)ccc21 ZINC000275023363 929218907 /nfs/dbraw/zinc/21/89/07/929218907.db2.gz NCQNTRNDMAKIPG-CQSZACIVSA-N 0 0 369.421 3.694 20 5 FHBDRN COc1ccc(C(=O)COc2ccc(C(C)=O)cc2[N+](=O)[O-])cc1Cl ZINC000120659505 929233714 /nfs/dbraw/zinc/23/37/14/929233714.db2.gz BSAMULJYCFYZOM-UHFFFAOYSA-N 0 0 363.753 3.721 20 5 FHBDRN C[C@H](c1ccc(F)cc1)N(C)C(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000583284922 937314543 /nfs/dbraw/zinc/31/45/43/937314543.db2.gz ZECHSKLDQUVBQZ-SNVBAGLBSA-N 0 0 352.312 3.774 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCC[C@@H](c3nc(-c4ccc(F)cc4)no3)C2)cn1 ZINC000583286961 937316119 /nfs/dbraw/zinc/31/61/19/937316119.db2.gz MBKHOQUMRKTDOP-CYBMUJFWSA-N 0 0 369.356 3.563 20 5 FHBDRN Cc1ccc(CCCC(=O)NCc2cc([N+](=O)[O-])c(F)cc2F)s1 ZINC001143376931 929267732 /nfs/dbraw/zinc/26/77/32/929267732.db2.gz NMKPVLFMUWLYBJ-UHFFFAOYSA-N 0 0 354.378 3.882 20 5 FHBDRN Cc1cccnc1[C@@H](NC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12)C(C)C ZINC000609663596 929311540 /nfs/dbraw/zinc/31/15/40/929311540.db2.gz NUXIHGQXIKRQFX-KRWDZBQOSA-N 0 0 352.394 3.907 20 5 FHBDRN CCS[C@@H]1CCCC[C@@H]1NC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000134831551 929313314 /nfs/dbraw/zinc/31/33/14/929313314.db2.gz NZNNFUHYWYTDEI-SUMWQHHRSA-N 0 0 374.466 3.575 20 5 FHBDRN CCOC(=O)c1cnn(Cc2ccc(Cl)cc2[N+](=O)[O-])c1C(F)F ZINC000609692900 929314106 /nfs/dbraw/zinc/31/41/06/929314106.db2.gz GDQGIPRZCIJISI-UHFFFAOYSA-N 0 0 359.716 3.607 20 5 FHBDRN O=C(N[C@H]1C[C@H]1c1c(F)cccc1F)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000609702572 929330835 /nfs/dbraw/zinc/33/08/35/929330835.db2.gz FZMLVJRLJLDOPD-BZNIZROVSA-N 0 0 357.316 3.640 20 5 FHBDRN COC(=O)c1ccnc(N[C@@H](C)c2cccc(OC(F)F)c2)c1[N+](=O)[O-] ZINC000598589688 929335340 /nfs/dbraw/zinc/33/53/40/929335340.db2.gz ICNDXELYKCVLCN-VIFPVBQESA-N 0 0 367.308 3.551 20 5 FHBDRN C[C@H]1CCC[C@@H](OCc2cccc(NC(=O)c3c[nH]nc3[N+](=O)[O-])c2)C1 ZINC000547757637 929372803 /nfs/dbraw/zinc/37/28/03/929372803.db2.gz CMGQSVAEPPDALO-SWLSCSKDSA-N 0 0 358.398 3.666 20 5 FHBDRN O=C(N[C@H](c1ccsc1)c1ccc(Cl)cc1)c1c[nH]nc1[N+](=O)[O-] ZINC000547758366 929398119 /nfs/dbraw/zinc/39/81/19/929398119.db2.gz RVWQVYFAUOVHDP-ZDUSSCGKSA-N 0 0 362.798 3.552 20 5 FHBDRN Cc1ncncc1C(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000609756160 929401690 /nfs/dbraw/zinc/40/16/90/929401690.db2.gz XWISVVRTWDYXTB-UHFFFAOYSA-N 0 0 350.334 3.738 20 5 FHBDRN C[C@@H](C(=O)Nc1ccc(Nc2ncccn2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000583301731 937328311 /nfs/dbraw/zinc/32/83/11/937328311.db2.gz FUPGXFILLLTCSU-CYBMUJFWSA-N 0 0 363.377 3.871 20 5 FHBDRN CCOc1ccc(C(=O)N(C)[C@@H](C)c2ccc(OC)cc2)cc1[N+](=O)[O-] ZINC000248260014 937329542 /nfs/dbraw/zinc/32/95/42/937329542.db2.gz VJJUDQUAXXREIP-ZDUSSCGKSA-N 0 0 358.394 3.835 20 5 FHBDRN Cc1ccccc1[C@H](O)CNc1ncc([N+](=O)[O-])c(C)c1Br ZINC000754038814 929435724 /nfs/dbraw/zinc/43/57/24/929435724.db2.gz XHCHRQYWSDHHEI-CYBMUJFWSA-N 0 0 366.215 3.515 20 5 FHBDRN O=C(NCCc1ccccc1[N+](=O)[O-])N1CC(c2ccc(Cl)cc2)C1 ZINC000458472750 937330754 /nfs/dbraw/zinc/33/07/54/937330754.db2.gz LOAGGXDCWPFAER-UHFFFAOYSA-N 0 0 359.813 3.600 20 5 FHBDRN Cc1nn(CC(=O)N(Cc2ccc(F)cc2)C2CCCCC2)cc1[N+](=O)[O-] ZINC000579883267 929466609 /nfs/dbraw/zinc/46/66/09/929466609.db2.gz XEIOYERFPNNKEM-UHFFFAOYSA-N 0 0 374.416 3.600 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2noc(CNc3ccc(-c4cncnc4)cc3)n2)cc1 ZINC000609797565 929498037 /nfs/dbraw/zinc/49/80/37/929498037.db2.gz PUILIFZPAAHIRB-UHFFFAOYSA-N 0 0 374.360 3.714 20 5 FHBDRN O=C(Nc1cc([N+](=O)[O-])ccc1Sc1cccs1)[C@H]1[C@@H]2CCC(=O)[C@@H]21 ZINC001266357892 929543244 /nfs/dbraw/zinc/54/32/44/929543244.db2.gz OSNBEWFZVVVWRT-GTTSAUCSSA-N 0 0 374.443 3.971 20 5 FHBDRN COCCN1C(=O)CCc2cc(N[C@@H](C)c3cccc([N+](=O)[O-])c3)ccc21 ZINC000275100813 929569046 /nfs/dbraw/zinc/56/90/46/929569046.db2.gz DBTAKBMRNWLSJR-AWEZNQCLSA-N 0 0 369.421 3.694 20 5 FHBDRN CN(C(=O)c1cc(Cl)cc([N+](=O)[O-])c1)c1ccc(Br)cn1 ZINC000609855257 929607733 /nfs/dbraw/zinc/60/77/33/929607733.db2.gz IPKHOVXFLLILDB-UHFFFAOYSA-N 0 0 370.590 3.682 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1Br)N1CCc2cccc(F)c21 ZINC000427571470 937346065 /nfs/dbraw/zinc/34/60/65/937346065.db2.gz JVHOPGMHDLNOLR-UHFFFAOYSA-N 0 0 365.158 3.699 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)N[C@@H](Cc1ccccc1)C1CC1 ZINC000134958046 929636593 /nfs/dbraw/zinc/63/65/93/929636593.db2.gz KQFABQHVYFOLHS-SFHVURJKSA-N 0 0 356.447 3.824 20 5 FHBDRN CCOC[C@H]1CCCN(C(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)C1 ZINC000275636367 929662038 /nfs/dbraw/zinc/66/20/38/929662038.db2.gz WHOWDGKGBUHVRA-HNNXBMFYSA-N 0 0 364.445 3.982 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2C[C@@H]2c2c(F)cccc2Cl)c1 ZINC000121062045 929667632 /nfs/dbraw/zinc/66/76/32/929667632.db2.gz HWCTWBTWJIONAU-HZMBPMFUSA-N 0 0 364.760 3.682 20 5 FHBDRN O=C(NCc1ccc(F)cc1Br)Nc1ccc([N+](=O)[O-])cc1 ZINC000547975350 929675555 /nfs/dbraw/zinc/67/55/55/929675555.db2.gz HLWZLRBEWXRUIY-UHFFFAOYSA-N 0 0 368.162 3.818 20 5 FHBDRN CC[C@@H]1c2ccccc2CCN1C(=O)CN(C)c1ccccc1[N+](=O)[O-] ZINC000610294023 929689255 /nfs/dbraw/zinc/68/92/55/929689255.db2.gz FLSUNVYLWWOWRO-QGZVFWFLSA-N 0 0 353.422 3.567 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N[C@H]2CCC(C)(C)C[C@H]2C)cc1OC ZINC000177639168 929725758 /nfs/dbraw/zinc/72/57/58/929725758.db2.gz IWTHBCKSEUMQBZ-OCCSQVGLSA-N 0 0 364.442 3.947 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)NCC1CCN(c2ccccc2)CC1 ZINC000468042166 929728853 /nfs/dbraw/zinc/72/88/53/929728853.db2.gz WOTHHXQMLHNXLK-UHFFFAOYSA-N 0 0 353.422 3.550 20 5 FHBDRN O=C(Nc1ccc2c(c1)OC(F)(F)O2)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000109851107 929735728 /nfs/dbraw/zinc/73/57/28/929735728.db2.gz ZZQDDIDCUKXNMG-UHFFFAOYSA-N 0 0 361.260 3.650 20 5 FHBDRN C[C@@H](N[C@@H](C)c1noc(Cc2ccccc2)n1)c1ccc([N+](=O)[O-])cc1 ZINC000165433030 929736715 /nfs/dbraw/zinc/73/67/15/929736715.db2.gz ARVRTBZZZFLXNX-KGLIPLIRSA-N 0 0 352.394 3.980 20 5 FHBDRN Cc1cc(C(=O)Nc2cn(CC(C)C)nc2C(F)F)cc([N+](=O)[O-])c1 ZINC000535638824 929737238 /nfs/dbraw/zinc/73/72/38/929737238.db2.gz ZRWFFEFKJKHHLU-UHFFFAOYSA-N 0 0 352.341 3.946 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2noc(Cc3ccn(-c4ccc(F)cc4)n3)n2)c1 ZINC000544902224 929746327 /nfs/dbraw/zinc/74/63/27/929746327.db2.gz MJQGCUQLZBKTDL-UHFFFAOYSA-N 0 0 365.324 3.560 20 5 FHBDRN Cc1ccc(S(=O)(=O)Nc2ccc3nn(C(C)C)cc3c2)cc1[N+](=O)[O-] ZINC000134052358 929747058 /nfs/dbraw/zinc/74/70/58/929747058.db2.gz LCPWEHIUXRDZTC-UHFFFAOYSA-N 0 0 374.422 3.635 20 5 FHBDRN CCS[C@H]1CCC[C@@H]1NC(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000175824849 929769723 /nfs/dbraw/zinc/76/97/23/929769723.db2.gz LQTUHWRHUMKZET-AAEUAGOBSA-N 0 0 373.272 3.761 20 5 FHBDRN O=C(c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)N1CC[C@@H]1c1cccc(F)c1 ZINC000610304521 929775009 /nfs/dbraw/zinc/77/50/09/929775009.db2.gz AYOLTHACQSPLAP-GOSISDBHSA-N 0 0 366.352 3.507 20 5 FHBDRN O=C(NC[C@H](O)C1CCCCC1)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000275663939 929782269 /nfs/dbraw/zinc/78/22/69/929782269.db2.gz NFMGGGQAQYRAJV-FQEVSTJZSA-N 0 0 364.445 3.765 20 5 FHBDRN O=C(NC[C@@H](O)C1CCCCC1)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000275663946 929782633 /nfs/dbraw/zinc/78/26/33/929782633.db2.gz NFMGGGQAQYRAJV-HXUWFJFHSA-N 0 0 364.445 3.765 20 5 FHBDRN CCOc1cc(NC(=O)N(CC)C2CCC2)c([N+](=O)[O-])cc1OCC ZINC000610014024 929784227 /nfs/dbraw/zinc/78/42/27/929784227.db2.gz NTAFFUUXGBBYDZ-UHFFFAOYSA-N 0 0 351.403 3.799 20 5 FHBDRN CC[C@H](NC(=O)N1CCOC[C@H]1CC1CCC1)c1cccc([N+](=O)[O-])c1 ZINC000458485394 937359330 /nfs/dbraw/zinc/35/93/30/937359330.db2.gz CDZGLPZKKZVIGC-MSOLQXFVSA-N 0 0 361.442 3.647 20 5 FHBDRN CCOc1cc(C(=O)NC[C@H](C)c2ccc(C)cc2)c([N+](=O)[O-])cc1OC ZINC000127137902 929787793 /nfs/dbraw/zinc/78/77/93/929787793.db2.gz HKSPHALLKVQNNI-AWEZNQCLSA-N 0 0 372.421 3.844 20 5 FHBDRN CC1(C)CCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)c2ccccc21 ZINC000579995744 929789720 /nfs/dbraw/zinc/78/97/20/929789720.db2.gz ZNWILQOUIJZTIS-UHFFFAOYSA-N 0 0 364.398 3.611 20 5 FHBDRN O=C(NCc1ccc(Oc2ccc(F)cc2)nc1)c1ccccc1[N+](=O)[O-] ZINC000046308217 929797788 /nfs/dbraw/zinc/79/77/88/929797788.db2.gz BMRCYSGWPJGDFZ-UHFFFAOYSA-N 0 0 367.336 3.851 20 5 FHBDRN CC[C@@H](NC(=O)N1CCC[C@]2(CCSC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000458485374 937360266 /nfs/dbraw/zinc/36/02/66/937360266.db2.gz CAEAZIGXFFYPEX-AEFFLSMTSA-N 0 0 363.483 3.975 20 5 FHBDRN COc1cc(Br)nc(Nc2cc([N+](=O)[O-])ccc2OC)c1 ZINC001210444980 929801359 /nfs/dbraw/zinc/80/13/59/929801359.db2.gz RYHXOJZMSSCCPC-UHFFFAOYSA-N 0 0 354.160 3.513 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H]2CCN(c3ccccc3F)C2)c1C ZINC000891083256 929864062 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367.174 3.735 20 5 FHBDRN CCCC(=O)Nc1cccc(CNc2nc3sccn3c2[N+](=O)[O-])c1 ZINC000052324716 937396346 /nfs/dbraw/zinc/39/63/46/937396346.db2.gz NPPXPBQXMWZXGJ-UHFFFAOYSA-N 0 0 359.411 3.655 20 5 FHBDRN CO[C@@H]1CCCC[C@H]1NC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000275785507 930217571 /nfs/dbraw/zinc/21/75/71/930217571.db2.gz NNJHXPQQWRDECF-RTBURBONSA-N 0 0 350.418 3.781 20 5 FHBDRN Cc1nn(-c2cccc(F)c2)cc1C(=O)OCc1cccc([N+](=O)[O-])c1 ZINC001125418770 930222339 /nfs/dbraw/zinc/22/23/39/930222339.db2.gz MIKFXJPSEJRGOG-UHFFFAOYSA-N 0 0 355.325 3.585 20 5 FHBDRN COCCn1cc2c(n1)[C@H](Nc1ccc(Cl)cc1[N+](=O)[O-])CCC2 ZINC000471540193 930254893 /nfs/dbraw/zinc/25/48/93/930254893.db2.gz MZLIVXPOGRWBGG-CQSZACIVSA-N 0 0 350.806 3.581 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)[C@@]1(C)CCCc2ccccc21 ZINC000560994645 930268793 /nfs/dbraw/zinc/26/87/93/930268793.db2.gz YXBNPFDGUFHJLS-NRFANRHFSA-N 0 0 352.434 3.890 20 5 FHBDRN CN(C(=O)c1cc(-c2cccc(Cl)c2)no1)c1ccc([N+](=O)[O-])nc1 ZINC000580121358 930277162 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FHBDRN COc1cc(C(=O)N[C@@H](C)CCOCc2ccccc2)cc([N+](=O)[O-])c1C ZINC000583398758 937407272 /nfs/dbraw/zinc/40/72/72/937407272.db2.gz JHDOHMAIYKPCIB-AWEZNQCLSA-N 0 0 372.421 3.637 20 5 FHBDRN O=[N+]([O-])c1cccc(Cl)c1CN1Cc2cnn(-c3ccccc3)c2C1 ZINC000579483751 930359765 /nfs/dbraw/zinc/35/97/65/930359765.db2.gz VTGUMVYXZJJISU-UHFFFAOYSA-N 0 0 354.797 3.950 20 5 FHBDRN C[C@H](CNC(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1)Oc1ccccc1 ZINC000070898480 930364918 /nfs/dbraw/zinc/36/49/18/930364918.db2.gz SVALFMZKYOYMIB-ZIAGYGMSSA-N 0 0 360.435 3.659 20 5 FHBDRN COC(=O)/C=C/c1ccc(N[C@@H]2COc3c2ccc(C)c3C)c([N+](=O)[O-])c1 ZINC000728287598 930386381 /nfs/dbraw/zinc/38/63/81/930386381.db2.gz RQADSTLESZDVLU-RCMYXZNBSA-N 0 0 368.389 3.943 20 5 FHBDRN COC(=O)/C=C/c1ccc(N[C@H]2COc3c2ccc(C)c3C)c([N+](=O)[O-])c1 ZINC000728287597 930386856 /nfs/dbraw/zinc/38/68/56/930386856.db2.gz RQADSTLESZDVLU-NADMHLTPSA-N 0 0 368.389 3.943 20 5 FHBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1CN1C[C@H](C(F)(F)F)O[C@@H](C)C1 ZINC000610410685 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361.373 3.562 20 5 FHBDRN Cc1cc(N2CCC(N3c4ccccc4C[C@@H]3C)CC2)ncc1[N+](=O)[O-] ZINC000610430843 930526554 /nfs/dbraw/zinc/52/65/54/930526554.db2.gz UCIGAJTYCXDKIA-HNNXBMFYSA-N 0 0 352.438 3.718 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CC[C@@H](c2ccccc2F)C1 ZINC000580340821 930533036 /nfs/dbraw/zinc/53/30/36/930533036.db2.gz XIOTVDBFHMNNAM-CYBMUJFWSA-N 0 0 367.380 3.774 20 5 FHBDRN CC(C)(CO)[C@@H](CNC(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000119019232 930536377 /nfs/dbraw/zinc/53/63/77/930536377.db2.gz XXDUNTJVIYNBIG-KRWDZBQOSA-N 0 0 357.410 3.519 20 5 FHBDRN Cc1ccc(I)c(Nc2ccc(F)cc2[N+](=O)[O-])n1 ZINC001210953281 930548056 /nfs/dbraw/zinc/54/80/56/930548056.db2.gz ZTZBJKQCRXESEL-UHFFFAOYSA-N 0 0 373.125 3.786 20 5 FHBDRN Cc1ccc(CN(C)C(=O)NCCCNc2ccc(C)cc2[N+](=O)[O-])cc1 ZINC000610102079 930564333 /nfs/dbraw/zinc/56/43/33/930564333.db2.gz BFKVLVLXKKWQHH-UHFFFAOYSA-N 0 0 370.453 3.855 20 5 FHBDRN Cn1cccc1[C@H]1CCCCN1C(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000610438300 930594275 /nfs/dbraw/zinc/59/42/75/930594275.db2.gz SKNFCQBUTLEUSM-GOSISDBHSA-N 0 0 352.394 3.782 20 5 FHBDRN C[C@@](O)(CC(=O)N1CCCCc2ccc([N+](=O)[O-])cc21)c1ccccc1 ZINC001167392977 930625719 /nfs/dbraw/zinc/62/57/19/930625719.db2.gz KRMPXNSSZAUEQX-HXUWFJFHSA-N 0 0 354.406 3.562 20 5 FHBDRN Cc1ccc(CN[C@H](C)c2noc(Cc3ccccc3)n2)cc1[N+](=O)[O-] ZINC000080345406 937432672 /nfs/dbraw/zinc/43/26/72/937432672.db2.gz VJSJGAFGNKGHSB-CQSZACIVSA-N 0 0 352.394 3.728 20 5 FHBDRN O=C(c1ccc(-c2cn[nH]c2)cc1)N1CCCCc2ccc([N+](=O)[O-])cc21 ZINC001167397894 930665569 /nfs/dbraw/zinc/66/55/69/930665569.db2.gz UBFIHAOCBKCYBK-UHFFFAOYSA-N 0 0 362.389 3.968 20 5 FHBDRN COC(=O)[C@H](Nc1nc2ccccc2c2ccccc12)C1CCOCC1 ZINC001167399892 930677854 /nfs/dbraw/zinc/67/78/54/930677854.db2.gz ASNMRNGZQPSGIJ-LJQANCHMSA-N 0 0 350.418 3.768 20 5 FHBDRN O=C(Cc1cccc(C(F)F)c1)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000579638178 930680928 /nfs/dbraw/zinc/68/09/28/930680928.db2.gz HWQZGTOVEOPISS-UHFFFAOYSA-N 0 0 373.359 3.915 20 5 FHBDRN CCOc1cccc(N2CC[C@@]3(C2)CCc2ccccc2O3)c1[N+](=O)[O-] ZINC000579658117 930722367 /nfs/dbraw/zinc/72/23/67/930722367.db2.gz UDAFIBISYIQSIY-HXUWFJFHSA-N 0 0 354.406 3.968 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N[C@H]1CCO[C@H](CC(C)C)C1 ZINC000275892938 930724424 /nfs/dbraw/zinc/72/44/24/930724424.db2.gz RZDGXEDBQYUVKN-UONOGXRCSA-N 0 0 354.834 3.880 20 5 FHBDRN COc1ccccc1[C@H]1CCN(C(=O)[C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000579666570 930733775 /nfs/dbraw/zinc/73/37/75/930733775.db2.gz CUOOAIUOGIVDOQ-ZBFHGGJFSA-N 0 0 354.406 3.723 20 5 FHBDRN O=C(NCCOc1ccc([N+](=O)[O-])cc1)Nc1ccc(F)c(C2CC2)c1 ZINC000579669815 930738270 /nfs/dbraw/zinc/73/82/70/930738270.db2.gz OIXXJFNDWMLTJJ-UHFFFAOYSA-N 0 0 359.357 3.812 20 5 FHBDRN CC(C)Cn1ncc(C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)c1C(F)F ZINC000155759076 930750507 /nfs/dbraw/zinc/75/05/07/930750507.db2.gz BEVQVOPRUPQHJB-LLVKDONJSA-N 0 0 366.368 3.876 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]cc(Cc3noc(C4Cc5ccccc5C4)n3)c2c1 ZINC000580497145 930752353 /nfs/dbraw/zinc/75/23/53/930752353.db2.gz OOHSPNAGNORERI-UHFFFAOYSA-N 0 0 360.373 3.932 20 5 FHBDRN O=C(Oc1cccc([N+](=O)[O-])c1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000050256555 930752588 /nfs/dbraw/zinc/75/25/88/930752588.db2.gz KSRSRXQGHVYVOG-UHFFFAOYSA-N 0 0 371.330 3.846 20 5 FHBDRN Cc1noc(C)c1[C@@H](C)CNC(=O)c1c(C)cc(Cl)cc1[N+](=O)[O-] ZINC000275897837 930754441 /nfs/dbraw/zinc/75/44/41/930754441.db2.gz SWMZUMLRWDCUHO-VIFPVBQESA-N 0 0 351.790 3.695 20 5 FHBDRN CCn1nc(C)c([N+](=O)[O-])c1NCCc1ccc(Br)s1 ZINC000234208616 930792881 /nfs/dbraw/zinc/79/28/81/930792881.db2.gz BPSAUXCTWHAFSX-UHFFFAOYSA-N 0 0 359.249 3.598 20 5 FHBDRN Cc1c(Br)cc(C(=O)NC[C@@H]2CC=CCC2)cc1[N+](=O)[O-] ZINC001125455734 930805615 /nfs/dbraw/zinc/80/56/15/930805615.db2.gz PCIYPOVYMKWLNJ-LLVKDONJSA-N 0 0 353.216 3.752 20 5 FHBDRN CCC(CC)(CO)CNC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000275908853 930828112 /nfs/dbraw/zinc/82/81/12/930828112.db2.gz DESAWGNJANOWQL-UHFFFAOYSA-N 0 0 352.434 3.622 20 5 FHBDRN CCOc1ccc(NC(=O)CN([C@@H](C)c2ccco2)C2CC2)c([N+](=O)[O-])c1 ZINC000119189698 930831056 /nfs/dbraw/zinc/83/10/56/930831056.db2.gz XYOQDWVXEBTENX-ZDUSSCGKSA-N 0 0 373.409 3.751 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)NCCC(=O)OC(C)(C)C ZINC000537151463 930834456 /nfs/dbraw/zinc/83/44/56/930834456.db2.gz MPXYAWYXDLWRHM-UHFFFAOYSA-N 0 0 368.455 3.557 20 5 FHBDRN O=C(NCC1(c2ccc(F)cc2Cl)CC1)c1ccc(F)cc1[N+](=O)[O-] ZINC000156600833 930867691 /nfs/dbraw/zinc/86/76/91/930867691.db2.gz ZONUJOJUUXBXIS-UHFFFAOYSA-N 0 0 366.751 3.988 20 5 FHBDRN CC(C)OCCNC(=O)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12 ZINC000275921084 930873646 /nfs/dbraw/zinc/87/36/46/930873646.db2.gz GIRHMDNIIXFVCS-UHFFFAOYSA-N 0 0 360.360 3.527 20 5 FHBDRN CCN(Cc1ccccc1)C(=O)c1cc([N+](=O)[O-])ccc1SCCOC ZINC000119203535 930878163 /nfs/dbraw/zinc/87/81/63/930878163.db2.gz NEVVMLUBSAHPAM-UHFFFAOYSA-N 0 0 374.462 3.996 20 5 FHBDRN C[C@@H](CNc1ccc([N+](=O)[O-])c(N2CCOCC2)c1F)CC(F)(F)F ZINC000580581959 930885006 /nfs/dbraw/zinc/88/50/06/930885006.db2.gz OMLHNHRIEHMYKD-SNVBAGLBSA-N 0 0 365.327 3.571 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)N(Cc2cccnc2)C(C)C)c1 ZINC000537300459 930903665 /nfs/dbraw/zinc/90/36/65/930903665.db2.gz SDFILIIHWRYOQD-UHFFFAOYSA-N 0 0 357.410 3.504 20 5 FHBDRN CCc1nc(NC(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)sc1C ZINC000580598466 930907569 /nfs/dbraw/zinc/90/75/69/930907569.db2.gz LEFOYVWRUGFESR-UHFFFAOYSA-N 0 0 373.438 3.768 20 5 FHBDRN Cc1ccc(C(=O)Nc2ccc([N+](=O)[O-])c(C)c2)cc1-c1cnn(C)c1 ZINC001266631004 930922481 /nfs/dbraw/zinc/92/24/81/930922481.db2.gz JEFRPGHZEITOKP-UHFFFAOYSA-N 0 0 350.378 3.864 20 5 FHBDRN CC(C)(CNC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)c1ccccc1F ZINC000109946279 930949423 /nfs/dbraw/zinc/94/94/23/930949423.db2.gz VOARADLRPUAQJO-UHFFFAOYSA-N 0 0 355.369 3.923 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1Cc2cccc(O)c2C1 ZINC000430497659 930958686 /nfs/dbraw/zinc/95/86/86/930958686.db2.gz TUWOJSBYCNQVGU-CYBMUJFWSA-N 0 0 372.446 3.698 20 5 FHBDRN CCOC(=O)CC[C@H](C)NC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000275929317 930988453 /nfs/dbraw/zinc/98/84/53/930988453.db2.gz HQLGRJDOYNFBFC-ZDUSSCGKSA-N 0 0 366.417 3.555 20 5 FHBDRN COCc1ccc(CNC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000119262572 930991791 /nfs/dbraw/zinc/99/17/91/930991791.db2.gz QVBAPCWNDCLFJV-UHFFFAOYSA-N 0 0 371.437 3.563 20 5 FHBDRN CC(C)(C)OC(=O)Cc1noc(-c2cc(C(F)(F)F)ccc2[N+](=O)[O-])n1 ZINC000579799825 931057934 /nfs/dbraw/zinc/05/79/34/931057934.db2.gz JLMILRGYWZDMNV-UHFFFAOYSA-N 0 0 373.287 3.548 20 5 FHBDRN Cc1ccccc1[C@H](C(=O)[O-])[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000580726594 931063870 /nfs/dbraw/zinc/06/38/70/931063870.db2.gz XCWMZCWWCJYDRQ-VQIMIIECSA-N 0 0 354.406 3.909 20 5 FHBDRN Nc1cc2nc3ccccc3n(-c3ccc(Cl)nc3Cl)c-2cc1=O ZINC001211278055 931064166 /nfs/dbraw/zinc/06/41/66/931064166.db2.gz RPMAHVRPOJLIPE-UHFFFAOYSA-N 0 0 357.200 3.775 20 5 FHBDRN Cc1nc(NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc(C2CC2)n1 ZINC000430509629 931103755 /nfs/dbraw/zinc/10/37/55/931103755.db2.gz XXVYQPVNIVKABL-UHFFFAOYSA-N 0 0 366.299 3.842 20 5 FHBDRN C[C@H]1C[C@@H](c2ccccc2)CN1C(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000580766573 931129625 /nfs/dbraw/zinc/12/96/25/931129625.db2.gz LDRKEXRKOXIKTP-GXTWGEPZSA-N 0 0 360.360 3.820 20 5 FHBDRN CSCC[C@@H](C)N(C)C(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000134314873 931162170 /nfs/dbraw/zinc/16/21/70/931162170.db2.gz RFDHQXCQOYXVMU-GHMZBOCLSA-N 0 0 360.863 3.616 20 5 FHBDRN Cc1cccc(OC[C@H](O)COCc2ccccc2Cl)c1[N+](=O)[O-] ZINC000153799097 931163729 /nfs/dbraw/zinc/16/37/29/931163729.db2.gz IFOOYHPFDFVVPX-CQSZACIVSA-N 0 0 351.786 3.513 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N(CCc1ccccc1)[C@H]1CCOC1 ZINC000175861651 931166125 /nfs/dbraw/zinc/16/61/25/931166125.db2.gz YBGKWAPEFGEMGW-SFHVURJKSA-N 0 0 369.421 3.769 20 5 FHBDRN C[C@H](NC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1)C(=O)OC(C)(C)C ZINC000275986356 931182926 /nfs/dbraw/zinc/18/29/26/931182926.db2.gz POAVRXPSLYXZNG-LBPRGKRZSA-N 0 0 366.417 3.554 20 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/nfs/dbraw/zinc/28/63/87/931286387.db2.gz QCFZFIQLWWPDMW-CYBMUJFWSA-N 0 0 368.368 3.719 20 5 FHBDRN CNc1ccc(C(=O)NCCCCc2ccc(F)c(F)c2)cc1[N+](=O)[O-] ZINC000548143978 931291140 /nfs/dbraw/zinc/29/11/40/931291140.db2.gz DTZQIMOGAAHPLI-UHFFFAOYSA-N 0 0 363.364 3.667 20 5 FHBDRN Cc1c(C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cnn1-c1ccccc1 ZINC000177849179 931293907 /nfs/dbraw/zinc/29/39/07/931293907.db2.gz CSYUTDIDJCPSHG-AWEZNQCLSA-N 0 0 364.405 3.888 20 5 FHBDRN CCc1ccccc1NC(=O)[C@@H](C)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000580880758 931295872 /nfs/dbraw/zinc/29/58/72/931295872.db2.gz FAIIVIADEJVIPU-OAHLLOKOSA-N 0 0 355.438 3.659 20 5 FHBDRN O=C(c1cc(Cl)ccc1[N+](=O)[O-])N1CCCC[C@H]([C@@H]2CCOC2)C1 ZINC000891337578 931297043 /nfs/dbraw/zinc/29/70/43/931297043.db2.gz HHWYIXRLRKFOEV-QWHCGFSZSA-N 0 0 352.818 3.527 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCC[C@H](c3ccncn3)C2)cc1C(F)(F)F ZINC000610468403 931320980 /nfs/dbraw/zinc/32/09/80/931320980.db2.gz FBLTZABUSNGJLG-NSHDSACASA-N 0 0 352.316 3.788 20 5 FHBDRN C[C@H](NC(=O)N1CCC[C@@H](Nc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000177853393 931323602 /nfs/dbraw/zinc/32/36/02/931323602.db2.gz GPKGFPOBZFBQPR-MAUKXSAKSA-N 0 0 368.437 3.942 20 5 FHBDRN COc1cc(C(=O)N[C@@H]2CCC[C@@H]2CCC(C)C)cc([N+](=O)[O-])c1OC ZINC000610174319 931347031 /nfs/dbraw/zinc/34/70/31/931347031.db2.gz SWHODAOHJOQTOQ-UKRRQHHQSA-N 0 0 364.442 3.947 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1Cl)N1CCCC[C@H]([C@@H]2CCOC2)C1 ZINC000891343396 931355251 /nfs/dbraw/zinc/35/52/51/931355251.db2.gz WBZLZTCWWWSKNW-QWHCGFSZSA-N 0 0 352.818 3.527 20 5 FHBDRN COc1cccc(C[C@@H]2CCCN2C(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000580926727 931358273 /nfs/dbraw/zinc/35/82/73/931358273.db2.gz MGBZRZGBPNUHFL-YJBOKZPZSA-N 0 0 368.433 3.941 20 5 FHBDRN CC(C)[C@H](O)C1(CNC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)CC1 ZINC000276005429 931381619 /nfs/dbraw/zinc/38/16/19/931381619.db2.gz SLTZOIJITMOATC-FQEVSTJZSA-N 0 0 364.445 3.621 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)c2ccc3c(c2)OCCCO3)cc1[N+](=O)[O-] ZINC000177866137 931389824 /nfs/dbraw/zinc/38/98/24/931389824.db2.gz DPVRPNLOLWMHKA-CYBMUJFWSA-N 0 0 356.378 3.556 20 5 FHBDRN Cc1ccc(I)c(Oc2ccncc2[N+](=O)[O-])c1 ZINC000610469573 931393709 /nfs/dbraw/zinc/39/37/09/931393709.db2.gz YDDPVBWYLKAOEY-UHFFFAOYSA-N 0 0 356.119 3.695 20 5 FHBDRN COc1ccc2c(c1)ncc([N+](=O)[O-])c2N1CCC[C@@H]1[C@@H]1CCCOC1 ZINC000580949721 931397061 /nfs/dbraw/zinc/39/70/61/931397061.db2.gz WUNWIZOSRPXQJI-CXAGYDPISA-N 0 0 357.410 3.547 20 5 FHBDRN COc1ccc(NC(=O)c2ccc(Br)cc2F)cc1[N+](=O)[O-] ZINC000317483362 931403800 /nfs/dbraw/zinc/40/38/00/931403800.db2.gz AZCOEXBJKUDJDG-UHFFFAOYSA-N 0 0 369.146 3.757 20 5 FHBDRN Cn1nc(CC(C)(C)C)cc1NC(=O)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000156747382 931405440 /nfs/dbraw/zinc/40/54/40/931405440.db2.gz GMGOODYUZZYDHQ-UHFFFAOYSA-N 0 0 350.806 3.823 20 5 FHBDRN COc1cc(C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)ccc1F ZINC000580967104 931422907 /nfs/dbraw/zinc/42/29/07/931422907.db2.gz AQRVUOVINBTLFW-UHFFFAOYSA-N 0 0 369.146 3.757 20 5 FHBDRN COc1ccc(CN(C)c2ccc([N+](=O)[O-])c(C)n2)cc1OC(F)F ZINC000471635371 931429211 /nfs/dbraw/zinc/42/92/11/931429211.db2.gz QNAQSQCXMJIVKW-UHFFFAOYSA-N 0 0 353.325 3.545 20 5 FHBDRN CCOc1ccc(-c2noc(C(C)(C)c3ccc([N+](=O)[O-])cc3F)n2)cn1 ZINC000580977450 931436927 /nfs/dbraw/zinc/43/69/27/931436927.db2.gz VJDHDCBEIISQSC-UHFFFAOYSA-N 0 0 372.356 3.904 20 5 FHBDRN CC(C)[C@H]1N(c2ccc(Br)cc2[N+](=O)[O-])CC12CCOCC2 ZINC000580998971 931458621 /nfs/dbraw/zinc/45/86/21/931458621.db2.gz WUWNJBUZAOHKIR-OAHLLOKOSA-N 0 0 369.259 3.999 20 5 FHBDRN O=C(COc1cc(Cl)ccc1[N+](=O)[O-])N[C@@H](c1ccccc1)C1CC1 ZINC000121263610 931462412 /nfs/dbraw/zinc/46/24/12/931462412.db2.gz XXKDYPNLKJCHQQ-SFHVURJKSA-N 0 0 360.797 3.895 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1C(=O)OCc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000782215852 931475368 /nfs/dbraw/zinc/47/53/68/931475368.db2.gz WLRGUPXBNSCARA-UHFFFAOYSA-N 0 0 350.714 3.822 20 5 FHBDRN CC(C)C[C@H](CO)NC(=O)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12 ZINC000276021010 931539319 /nfs/dbraw/zinc/53/93/19/931539319.db2.gz VDTFGEPTGQTRBI-CYBMUJFWSA-N 0 0 374.387 3.509 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1CN1CCCC[C@@H]1c1noc(C2CC2)n1 ZINC000610476248 931541064 /nfs/dbraw/zinc/54/10/64/931541064.db2.gz NVPXESOENFJYBZ-MRXNPFEDSA-N 0 0 372.425 3.981 20 5 FHBDRN Cc1cnc(Cl)cc1C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC001266677565 931607028 /nfs/dbraw/zinc/60/70/28/931607028.db2.gz KTDVYVYIYDZMJB-UHFFFAOYSA-N 0 0 354.193 3.578 20 5 FHBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])c1cccc(C(F)(F)F)n1 ZINC001266677800 931608835 /nfs/dbraw/zinc/60/88/35/931608835.db2.gz POLWCXQCZVGSCX-UHFFFAOYSA-N 0 0 373.718 3.635 20 5 FHBDRN CN(Cc1ccc(Cl)cc1)C(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000160783965 931619327 /nfs/dbraw/zinc/61/93/27/931619327.db2.gz LALHZEZGLYECRF-UHFFFAOYSA-N 0 0 370.796 3.706 20 5 FHBDRN C[C@@H]1C(=O)CC[C@@H](C(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])C1(C)C ZINC000276047646 931644545 /nfs/dbraw/zinc/64/45/45/931644545.db2.gz YLIRJWUIJVPPRA-RISCZKNCSA-N 0 0 366.845 3.548 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CCc2cc(Cl)ccc21 ZINC000581207359 931675036 /nfs/dbraw/zinc/67/50/36/931675036.db2.gz QGBLVGYOALWQGM-UHFFFAOYSA-N 0 0 355.781 3.861 20 5 FHBDRN C[C@@]1(NC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)CCO[C@@H]1C1CC1 ZINC000276049912 931685525 /nfs/dbraw/zinc/68/55/25/931685525.db2.gz YTTJXMDSZYWCFV-IFMALSPDSA-N 0 0 362.429 3.781 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)N(C)[C@@H](C)c2cccs2)cc1C ZINC000126275894 931691605 /nfs/dbraw/zinc/69/16/05/931691605.db2.gz XXOPQEUMLLBBIS-LBPRGKRZSA-N 0 0 354.453 3.655 20 5 FHBDRN O=c1c2cc(F)ccc2ccn1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000581221105 931696661 /nfs/dbraw/zinc/69/66/61/931696661.db2.gz WCRJBLLSKPJQTK-UHFFFAOYSA-N 0 0 365.320 3.752 20 5 FHBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)Nc1nc(-c2cccs2)ns1 ZINC000588402827 931697305 /nfs/dbraw/zinc/69/73/05/931697305.db2.gz DKXVYHZIGDFTRT-YVMONPNESA-N 0 0 358.404 3.827 20 5 FHBDRN CC(=O)c1ccc(NCc2cc(C)nc(N3CCCC3)c2)c([N+](=O)[O-])c1 ZINC000581223661 931703592 /nfs/dbraw/zinc/70/35/92/931703592.db2.gz PZDOCWMLBNWQFJ-UHFFFAOYSA-N 0 0 354.410 3.713 20 5 FHBDRN CN(C[C@H]1CCCO[C@H]1c1ccccc1)C(=O)c1csc([N+](=O)[O-])c1 ZINC000050862753 931738333 /nfs/dbraw/zinc/73/83/33/931738333.db2.gz VTKGRFOOLKEIPF-PBHICJAKSA-N 0 0 360.435 3.896 20 5 FHBDRN C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CCC[C@@]2(CCCOC2)C1 ZINC000477045897 931739924 /nfs/dbraw/zinc/73/99/24/931739924.db2.gz FZCARQMPEVTKBD-AUUYWEPGSA-N 0 0 372.425 3.598 20 5 FHBDRN CC(C)Oc1cccc([C@@H](C)NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)c1 ZINC000048323462 931755501 /nfs/dbraw/zinc/75/55/01/931755501.db2.gz CVRCOZPBUDCREF-LLVKDONJSA-N 0 0 361.373 3.594 20 5 FHBDRN C[C@@H](Nc1ncnc2sc([N+](=O)[O-])cc21)c1cccc(-n2cccn2)c1 ZINC000581268103 931761257 /nfs/dbraw/zinc/76/12/57/931761257.db2.gz LGLKAHNCAJUSKC-LLVKDONJSA-N 0 0 366.406 3.958 20 5 FHBDRN CC(=O)c1cccc(NC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)c1O ZINC000581267142 931764242 /nfs/dbraw/zinc/76/42/42/931764242.db2.gz SMIZMHLMPARFAT-LLVKDONJSA-N 0 0 360.391 3.622 20 5 FHBDRN CC[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2SC2CCCC2)CCO1 ZINC000134421310 931764475 /nfs/dbraw/zinc/76/44/75/931764475.db2.gz RJZLMLPKJSPMJE-CQSZACIVSA-N 0 0 364.467 3.881 20 5 FHBDRN CC[C@H](Oc1ccccc1F)C(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000430554264 931819122 /nfs/dbraw/zinc/81/91/22/931819122.db2.gz QDKDITVWLPBICZ-INIZCTEOSA-N 0 0 360.385 3.943 20 5 FHBDRN CCc1noc([C@H](C)Sc2nnc(-c3ccc([N+](=O)[O-])cc3)n2CC)n1 ZINC000157146292 931903213 /nfs/dbraw/zinc/90/32/13/931903213.db2.gz RFMOPJSSQYNVPP-JTQLQIEISA-N 0 0 374.426 3.672 20 5 FHBDRN COc1c(C(=O)N2C[C@@H](c3ccc(C)cc3)C[C@@H]2C)cccc1[N+](=O)[O-] ZINC000477086458 931908930 /nfs/dbraw/zinc/90/89/30/931908930.db2.gz KJMIBZIVOBQOCH-HOCLYGCPSA-N 0 0 354.406 3.930 20 5 FHBDRN Cc1nn(C)c(N[C@H]2CCN(c3ccc(Cl)c(Cl)c3)C2)c1[N+](=O)[O-] ZINC000477087875 931910814 /nfs/dbraw/zinc/91/08/14/931910814.db2.gz ITZVZVQGFRGXAW-JTQLQIEISA-N 0 0 370.240 3.634 20 5 FHBDRN O=C([C@@H]1CCc2ccccc21)N1CCS[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000610235059 931924384 /nfs/dbraw/zinc/92/43/84/931924384.db2.gz PVHORIZJCBBHCL-MJGOQNOKSA-N 0 0 354.431 3.899 20 5 FHBDRN COc1cc(OCC(=O)N[C@H]2CCCC[C@H]2C(C)(C)C)ccc1[N+](=O)[O-] ZINC000066020481 931926904 /nfs/dbraw/zinc/92/69/04/931926904.db2.gz LOXAHYOCIWJVRP-CABCVRRESA-N 0 0 364.442 3.703 20 5 FHBDRN O=[N+]([O-])c1cccc2ncnc(N3CC[C@](F)(c4cc(F)cc(F)c4)C3)c21 ZINC000561351857 931969476 /nfs/dbraw/zinc/96/94/76/931969476.db2.gz XEARGDHBVGBJMC-GOSISDBHSA-N 0 0 374.322 3.891 20 5 FHBDRN C[C@@H](NC(=O)NCC[C@@H]1CNc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000891380522 931969725 /nfs/dbraw/zinc/96/97/25/931969725.db2.gz CHLDIMSRAKVBRL-UKRRQHHQSA-N 0 0 354.410 3.554 20 5 FHBDRN O=C1C[C@H](Nc2ccc(Cl)cc2[N+](=O)[O-])CN1[C@H]1C[C@@H]1c1ccccc1 ZINC000463017225 931983507 /nfs/dbraw/zinc/98/35/07/931983507.db2.gz XWSMXIGTNXQULF-UXLLHSPISA-N 0 0 371.824 3.817 20 5 FHBDRN COc1c(C(=O)Nc2cccc(C)c2Br)cccc1[N+](=O)[O-] ZINC000317531135 931984350 /nfs/dbraw/zinc/98/43/50/931984350.db2.gz JGQCWGNNCFQBIT-UHFFFAOYSA-N 0 0 365.183 3.927 20 5 FHBDRN COc1cc(C(=O)N[C@H](C)[C@H](C)C2CCCCC2)c([N+](=O)[O-])cc1OC ZINC000177999731 932005079 /nfs/dbraw/zinc/00/50/79/932005079.db2.gz AHRSBUDAIARIIW-QWHCGFSZSA-N 0 0 364.442 3.947 20 5 FHBDRN C[C@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1COc2ccccc21 ZINC000165691491 932036600 /nfs/dbraw/zinc/03/66/00/932036600.db2.gz ILZFFKVMTOIILD-GWCFXTLKSA-N 0 0 361.785 3.934 20 5 FHBDRN COC(=O)c1c(NC(=O)c2ccc([N+](=O)[O-])s2)sc2c1CCCC2 ZINC000060525161 932041154 /nfs/dbraw/zinc/04/11/54/932041154.db2.gz RKAFFEPYPUOEMW-UHFFFAOYSA-N 0 0 366.420 3.636 20 5 FHBDRN Cc1ccc(Nc2cccc(C(=O)Nc3cc([N+](=O)[O-])ccc3C)c2)nn1 ZINC000134473707 932041869 /nfs/dbraw/zinc/04/18/69/932041869.db2.gz AESXXSUIPGSKTH-UHFFFAOYSA-N 0 0 363.377 3.998 20 5 FHBDRN CC(C)(CNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21)c1ccccc1F ZINC000109972619 932070900 /nfs/dbraw/zinc/07/09/00/932070900.db2.gz GFIYYUWRIIPNPE-UHFFFAOYSA-N 0 0 369.396 3.783 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2noc([C@H]3CCN(c4ccccc4F)C3)n2)c1 ZINC000581458315 932091714 /nfs/dbraw/zinc/09/17/14/932091714.db2.gz MKMTUKYSEPWRED-ZDUSSCGKSA-N 0 0 354.341 3.778 20 5 FHBDRN O=C1c2ccccc2C(=O)N1Cc1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000178019255 932095305 /nfs/dbraw/zinc/09/53/05/932095305.db2.gz JNXAFLGRRBGXEQ-UHFFFAOYSA-N 0 0 365.370 3.515 20 5 FHBDRN COc1ccc(CC(=O)N2C[C@H](C)C[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000561416435 932129539 /nfs/dbraw/zinc/12/95/39/932129539.db2.gz ALHYPQPRQQDDFH-RHSMWYFYSA-N 0 0 354.406 3.756 20 5 FHBDRN CCS[C@H]1CCC[C@@H]1NC(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000178031172 932140266 /nfs/dbraw/zinc/14/02/66/932140266.db2.gz VOSQLKRDCJAPSH-HOTGVXAUSA-N 0 0 351.472 3.577 20 5 FHBDRN CCOC(=O)/C=C\c1ccc(NC(=O)Cc2cccc([N+](=O)[O-])c2C)cc1 ZINC000255315827 932167454 /nfs/dbraw/zinc/16/74/54/932167454.db2.gz WALMSTYLGFQYPL-XFXZXTDPSA-N 0 0 368.389 3.661 20 5 FHBDRN O=C(COc1ccccc1[N+](=O)[O-])NCC1(Cc2ccccc2)CCCC1 ZINC001266753746 932201171 /nfs/dbraw/zinc/20/11/71/932201171.db2.gz TXAPOYYQXPVKEA-UHFFFAOYSA-N 0 0 368.433 3.893 20 5 FHBDRN C[C@H](NC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc2n[nH]cc2c1 ZINC000561491888 932208475 /nfs/dbraw/zinc/20/84/75/932208475.db2.gz RKYMVCJBCRDBEK-RYUDHWBXSA-N 0 0 353.382 3.593 20 5 FHBDRN O=C(NCc1nnc(-c2ccccc2)s1)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000160943309 932243771 /nfs/dbraw/zinc/24/37/71/932243771.db2.gz MIRSCQSBCBVOIL-UHFFFAOYSA-N 0 0 374.809 3.697 20 5 FHBDRN Cc1cc(OC[C@@H](O)COc2ccc3ccccc3c2)ccc1[N+](=O)[O-] ZINC000561494670 932244552 /nfs/dbraw/zinc/24/45/52/932244552.db2.gz PSGZVVHNJDXRMR-QGZVFWFLSA-N 0 0 353.374 3.875 20 5 FHBDRN C[C@@H]1CC(NC(=O)c2ccc(Br)cc2[N+](=O)[O-])C[C@@H](C)C1 ZINC000430611334 932251500 /nfs/dbraw/zinc/25/15/00/932251500.db2.gz NRKLVWRXUHOPPO-UWVGGRQHSA-N 0 0 355.232 3.912 20 5 FHBDRN CCc1c(NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)cnn1CC(C)C ZINC000157232145 932267823 /nfs/dbraw/zinc/26/78/23/932267823.db2.gz ZDNUIAKFWISUOO-UHFFFAOYSA-N 0 0 350.806 3.915 20 5 FHBDRN CSc1ccc(NC(=O)CCn2nc(C)c([N+](=O)[O-])c2C)cc1Cl ZINC000175911404 932309875 /nfs/dbraw/zinc/30/98/75/932309875.db2.gz IYODBRDFISZDSS-UHFFFAOYSA-N 0 0 368.846 3.812 20 5 FHBDRN CSc1ccc(NC(=O)CN(Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000178075978 932313533 /nfs/dbraw/zinc/31/35/33/932313533.db2.gz IULQFBXFQBFQMD-UHFFFAOYSA-N 0 0 371.462 3.920 20 5 FHBDRN COc1ccc(OC)c(NC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)c1 ZINC000178078838 932315170 /nfs/dbraw/zinc/31/51/70/932315170.db2.gz ZQWDECBJYLGYLT-UHFFFAOYSA-N 0 0 371.393 3.809 20 5 FHBDRN CCOc1cc(N2CCc3c(cnn3-c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000610514923 932323613 /nfs/dbraw/zinc/32/36/13/932323613.db2.gz FYAFKIGYANCYJY-UHFFFAOYSA-N 0 0 364.405 3.742 20 5 FHBDRN CCc1ccc(C(=O)N2CCO[C@@](C)(c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000157318918 932326765 /nfs/dbraw/zinc/32/67/65/932326765.db2.gz PRQKTYMDKYGPDP-HXUWFJFHSA-N 0 0 354.406 3.545 20 5 FHBDRN O=C(/C=C\c1ccc(Cl)nc1)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000255329027 932342259 /nfs/dbraw/zinc/34/22/59/932342259.db2.gz UNQPSZNUMJEYLB-XFFZJAGNSA-N 0 0 359.813 3.796 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCCC[C@@H]1CCCC[C@@H]1O ZINC000134568022 932359252 /nfs/dbraw/zinc/35/92/52/932359252.db2.gz KZQJKCVUPVNYCJ-ZQIUZPCESA-N 0 0 366.483 3.523 20 5 FHBDRN Cc1c(NC(=O)N[C@H]2CCO[C@@H](C)C2)cc([N+](=O)[O-])cc1C(F)(F)F ZINC000933344210 932362519 /nfs/dbraw/zinc/36/25/19/932362519.db2.gz YIBUAJUFRBYWIN-WPRPVWTQSA-N 0 0 361.320 3.611 20 5 FHBDRN Nc1c(C(=O)N2CCC[C@H](c3cc4ccccc4[nH]3)C2)cccc1[N+](=O)[O-] ZINC000610520127 932375651 /nfs/dbraw/zinc/37/56/51/932375651.db2.gz FZQQMXOBFMAZDH-AWEZNQCLSA-N 0 0 364.405 3.678 20 5 FHBDRN O=C(c1cc(F)cc2cccnc21)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000157347942 932377914 /nfs/dbraw/zinc/37/79/14/932377914.db2.gz RNIBDHSNMIKRJS-UHFFFAOYSA-N 0 0 351.337 3.875 20 5 FHBDRN CC(C)/C=C\C(=O)O[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000785058437 932395566 /nfs/dbraw/zinc/39/55/66/932395566.db2.gz IDXLGVCUUHJJEI-ISGFRBBESA-N 0 0 374.315 3.696 20 5 FHBDRN COCCC1(CNC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)CCCCC1 ZINC000477292710 932453016 /nfs/dbraw/zinc/45/30/16/932453016.db2.gz KZSHXVOCMWAUPN-UHFFFAOYSA-N 0 0 354.834 3.965 20 5 FHBDRN CC[C@H](C)n1ncc(NC(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])c1C1CC1 ZINC000477301791 932456916 /nfs/dbraw/zinc/45/69/16/932456916.db2.gz SOBLIIVSUAAXFM-JTQLQIEISA-N 0 0 360.418 3.739 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)NC2(c3ccc(F)cc3F)CCC2)c1[N+](=O)[O-] ZINC000477339775 932484932 /nfs/dbraw/zinc/48/49/32/932484932.db2.gz PJFFSNWJQPHDBP-UHFFFAOYSA-N 0 0 364.352 3.529 20 5 FHBDRN Cc1sc(NC(=O)c2cccc(C)n2)nc1-c1cccc([N+](=O)[O-])c1 ZINC000097206938 932495934 /nfs/dbraw/zinc/49/59/34/932495934.db2.gz WKWACCPEVUMGBS-UHFFFAOYSA-N 0 0 354.391 3.982 20 5 FHBDRN CC[C@H](C)Oc1ccccc1/C=C\C(=O)OCCn1c(C)ncc1[N+](=O)[O-] ZINC000255363755 932504679 /nfs/dbraw/zinc/50/46/79/932504679.db2.gz DBQJQFVDOJLAHL-CMUBDUJZSA-N 0 0 373.409 3.534 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)N(Cc1ccccn1)c1ccc(F)cc1 ZINC000097206644 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FHBDRN CCc1cc(OCC(=O)N2CCc3ccc([N+](=O)[O-])cc32)ccc1Cl ZINC000477629192 932755988 /nfs/dbraw/zinc/75/59/88/932755988.db2.gz XDAHFSPZFSAJMI-UHFFFAOYSA-N 0 0 360.797 3.779 20 5 FHBDRN CCCn1c(C)cc(C(=O)COC(=O)c2cccc([N+](=O)[O-])c2C)c1C ZINC000003444444 932759699 /nfs/dbraw/zinc/75/96/99/932759699.db2.gz BPFMQNVPYWEBEN-UHFFFAOYSA-N 0 0 358.394 3.771 20 5 FHBDRN CC[C@@H](NC(=O)N(C)CC1(O)CCCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000187441932 932772427 /nfs/dbraw/zinc/77/24/27/932772427.db2.gz HNXSNWRLVUSGPL-QGZVFWFLSA-N 0 0 363.458 3.773 20 5 FHBDRN Cc1cc(C(=O)Nc2ncc(Br)cc2C)cc([N+](=O)[O-])c1 ZINC000135279764 932791617 /nfs/dbraw/zinc/79/16/17/932791617.db2.gz IBYUKKZXEAKCBG-UHFFFAOYSA-N 0 0 350.172 3.621 20 5 FHBDRN Cc1nc(-c2ccccc2)sc1CNC(=O)c1cccc([N+](=O)[O-])c1N ZINC000178189642 932796389 /nfs/dbraw/zinc/79/63/89/932796389.db2.gz QDEOALLRKACTNR-UHFFFAOYSA-N 0 0 368.418 3.539 20 5 FHBDRN COc1cc(OCC(=O)N2c3ccccc3SC[C@H]2C)ccc1[N+](=O)[O-] ZINC000430672493 932855081 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FHBDRN CC(C)(C)c1ccc(C(=O)N2CCC[C@@H](OCC3CC3)C2)cc1[N+](=O)[O-] ZINC000548308055 932913132 /nfs/dbraw/zinc/91/31/32/932913132.db2.gz QPSTYSRNKZXHHG-MRXNPFEDSA-N 0 0 360.454 3.924 20 5 FHBDRN O=C(c1cc(-c2ccc(F)cc2)on1)N1CCc2c1cccc2[N+](=O)[O-] ZINC000178229368 932920152 /nfs/dbraw/zinc/92/01/52/932920152.db2.gz CGWAEZLYXMYOER-UHFFFAOYSA-N 0 0 353.309 3.592 20 5 FHBDRN CCOc1cc(CSc2nc(C)c(C3CC3)c(=O)[nH]2)ccc1[N+](=O)[O-] ZINC000601087871 932942463 /nfs/dbraw/zinc/94/24/63/932942463.db2.gz JXYOJMBRMLPOBQ-UHFFFAOYSA-N 0 0 361.423 3.967 20 5 FHBDRN CC(=O)Nc1cc(NC(=O)/C(C)=C\c2ccc([N+](=O)[O-])cc2)ccc1F ZINC000588436380 932948905 /nfs/dbraw/zinc/94/89/05/932948905.db2.gz FGCXVEZSTDEVOE-LUAWRHEFSA-N 0 0 357.341 3.734 20 5 FHBDRN COC(=O)/C=C\c1ccc(NC[C@@H](C)c2nc(C)cs2)c([N+](=O)[O-])c1 ZINC000588436552 932954063 /nfs/dbraw/zinc/95/40/63/932954063.db2.gz NQFMPEYCRKWFFF-JPVGGKMYSA-N 0 0 361.423 3.762 20 5 FHBDRN CCSCC[C@H](C)Nc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1 ZINC000135337375 932975824 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3.688 20 5 FHBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N(C)c1ccc(Cl)cn1 ZINC000134720548 933178153 /nfs/dbraw/zinc/17/81/53/933178153.db2.gz QPVQRYFACASKHN-VIFPVBQESA-N 0 0 370.192 3.727 20 5 FHBDRN O=[N+]([O-])c1ccc(NC[C@@H](CO)Cc2ccc(F)c(F)c2)c2ncccc12 ZINC000477701810 933192356 /nfs/dbraw/zinc/19/23/56/933192356.db2.gz KLWIQSWYCVFTRV-ZDUSSCGKSA-N 0 0 373.359 3.684 20 5 FHBDRN O=C(NCCc1ccccc1[N+](=O)[O-])N[C@@H](c1ccccc1)C(F)(F)F ZINC000548383376 933231302 /nfs/dbraw/zinc/23/13/02/933231302.db2.gz YAPHRBZXUUZISL-HNNXBMFYSA-N 0 0 367.327 3.740 20 5 FHBDRN C/C=C/c1ccc(NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OCC)cc1 ZINC000510578753 933243820 /nfs/dbraw/zinc/24/38/20/933243820.db2.gz ISFYZMLSZJSMHZ-HWKANZROSA-N 0 0 369.377 3.604 20 5 FHBDRN CC[C@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2SCCOC)CC1 ZINC000157997918 933246956 /nfs/dbraw/zinc/24/69/56/933246956.db2.gz VISTYIIELJYPFL-AWEZNQCLSA-N 0 0 366.483 3.986 20 5 FHBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1cccc2c1CCO2 ZINC000477732736 933254554 /nfs/dbraw/zinc/25/45/54/933254554.db2.gz VJFFROWFIJRQBR-JTQLQIEISA-N 0 0 362.769 3.589 20 5 FHBDRN CCCCCn1nc(C)cc1NC(=O)COc1ccc([N+](=O)[O-])c(C)c1 ZINC000430820430 933262371 /nfs/dbraw/zinc/26/23/71/933262371.db2.gz KEFGPCPQKXBXPQ-UHFFFAOYSA-N 0 0 360.414 3.616 20 5 FHBDRN Cc1cc(OCC(=O)NCc2cc(F)c(Cl)cc2F)ccc1[N+](=O)[O-] ZINC000430823297 933266470 /nfs/dbraw/zinc/26/64/70/933266470.db2.gz SRUVCWBBNLFIOP-UHFFFAOYSA-N 0 0 370.739 3.530 20 5 FHBDRN CC[C@H](NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)c1ccncc1 ZINC000158000214 933272223 /nfs/dbraw/zinc/27/22/23/933272223.db2.gz BQTBKEQVCLQFJS-HNNXBMFYSA-N 0 0 368.418 3.994 20 5 FHBDRN COc1ccc(Cl)cc1NC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088332443 933279589 /nfs/dbraw/zinc/27/95/89/933279589.db2.gz VGYNSUXIOXXRLK-UHFFFAOYSA-N 0 0 361.785 3.847 20 5 FHBDRN CCOc1cc(Cl)ccc1NC(=O)COc1ccc([N+](=O)[O-])c(C)c1 ZINC000430840883 933292675 /nfs/dbraw/zinc/29/26/75/933292675.db2.gz UNJCTQMKBKSPIP-UHFFFAOYSA-N 0 0 364.785 3.973 20 5 FHBDRN Cc1c(NC(=O)c2cnc(Oc3ccccc3)cn2)cccc1[N+](=O)[O-] ZINC000090990000 933380458 /nfs/dbraw/zinc/38/04/58/933380458.db2.gz SOLQRYMSULCJNW-UHFFFAOYSA-N 0 0 350.334 3.738 20 5 FHBDRN O=C(CCCOc1ccc(Cl)cc1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000510664455 933390284 /nfs/dbraw/zinc/39/02/84/933390284.db2.gz HJBOWYZXRCVMJZ-UHFFFAOYSA-N 0 0 360.797 3.997 20 5 FHBDRN C[C@@H]1CC[C@H](NC(=O)c2ccc(Br)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000430924604 933422903 /nfs/dbraw/zinc/42/29/03/933422903.db2.gz AUQCPAWTIDSDIB-NRUUGDAUSA-N 0 0 355.232 3.912 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)N1C[C@@H](C(F)(F)F)[C@H](C(F)(F)F)C1 ZINC000610591593 933445225 /nfs/dbraw/zinc/44/52/25/933445225.db2.gz VFMYJTHAVAYVPD-NXEZZACHSA-N 0 0 371.237 3.799 20 5 FHBDRN O=C(N[C@H]1C[C@H]1c1cccc(F)c1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000178344683 933449831 /nfs/dbraw/zinc/44/98/31/933449831.db2.gz SYGSJTYFQJZQCV-OALUTQOASA-N 0 0 369.396 3.964 20 5 FHBDRN Cc1c(NS(=O)(=O)c2ccc(OCC(C)C)cc2)cccc1[N+](=O)[O-] ZINC000535654189 933454323 /nfs/dbraw/zinc/45/43/23/933454323.db2.gz DSSIULNEFVIDMX-UHFFFAOYSA-N 0 0 364.423 3.739 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1/C=C1/NC(=S)N(c2ccccc2Cl)C1=O ZINC000588449866 933480368 /nfs/dbraw/zinc/48/03/68/933480368.db2.gz BDGICYPOFZPQMI-NTEUORMPSA-N 0 0 373.821 3.819 20 5 FHBDRN COc1cccc(C2CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)c1 ZINC000548408913 933505331 /nfs/dbraw/zinc/50/53/31/933505331.db2.gz UERUIHYQMNIGFJ-UHFFFAOYSA-N 0 0 358.369 3.762 20 5 FHBDRN O=[N+]([O-])c1ccccc1OCCN1C[C@H](C(F)(F)F)[C@H](C(F)(F)F)C1 ZINC000610604699 933512748 /nfs/dbraw/zinc/51/27/48/933512748.db2.gz HCKDWJOMUINFPV-AOOOYVTPSA-N 0 0 372.265 3.646 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)Nc2ccc3c(c2)OCCCO3)cc1[N+](=O)[O-] ZINC000610627562 933548059 /nfs/dbraw/zinc/54/80/59/933548059.db2.gz AIVVOQNGFMYZBM-ZDUSSCGKSA-N 0 0 371.393 3.947 20 5 FHBDRN COc1cc(C(=O)Nc2nc3c(s2)C[C@H](C)CC3)cc([N+](=O)[O-])c1C ZINC000477817410 933622510 /nfs/dbraw/zinc/62/25/10/933622510.db2.gz LJQCUSXIGQLKTN-SECBINFHSA-N 0 0 361.423 3.745 20 5 FHBDRN CCc1ccc(C(=O)Nc2cccc(-n3cc(C)[nH]c3=O)c2)cc1[N+](=O)[O-] ZINC000477826711 933633025 /nfs/dbraw/zinc/63/30/25/933633025.db2.gz YUXKENMYCCDOBR-UHFFFAOYSA-N 0 0 366.377 3.609 20 5 FHBDRN Nc1c(C(=O)N[C@@H](CC(F)(F)F)c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000091797924 933645203 /nfs/dbraw/zinc/64/52/03/933645203.db2.gz OYVYFPXBIRIJPS-LBPRGKRZSA-N 0 0 371.290 3.740 20 5 FHBDRN COC[C@@H](Cc1ccccc1)N(C)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000510760733 933664358 /nfs/dbraw/zinc/66/43/58/933664358.db2.gz FDISCWVVFGZZOO-OAHLLOKOSA-N 0 0 350.365 3.563 20 5 FHBDRN Cc1cccc(CC2CN(C(=O)C(C)(C)c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000610659924 933668613 /nfs/dbraw/zinc/66/86/13/933668613.db2.gz BHRLQSTYXGDCTJ-UHFFFAOYSA-N 0 0 352.434 3.882 20 5 FHBDRN C[C@@H]1CCN(Cc2c([N+](=O)[O-])ncn2C)c2cc(Cl)ccc2S1 ZINC000610662284 933672393 /nfs/dbraw/zinc/67/23/93/933672393.db2.gz VXWPEBNJMOFXHQ-SNVBAGLBSA-N 0 0 352.847 3.873 20 5 FHBDRN O=C(c1ccn(-c2ccccc2[N+](=O)[O-])n1)N1CC[C@H]1c1cccc(F)c1 ZINC000611210489 933716622 /nfs/dbraw/zinc/71/66/22/933716622.db2.gz OCRNTMHIQMNQJJ-INIZCTEOSA-N 0 0 366.352 3.507 20 5 FHBDRN Cc1nc2ccccc2c2c(NC(=O)c3cncn3C)c3ccccc3n21 ZINC000431042742 933739624 /nfs/dbraw/zinc/73/96/24/933739624.db2.gz KSANOPTUCNPIJJ-UHFFFAOYSA-N 0 0 355.401 3.935 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)NCCc1ccc(Cl)cc1 ZINC000510789777 933740091 /nfs/dbraw/zinc/74/00/91/933740091.db2.gz IXZVKTJRWUNTDE-UHFFFAOYSA-N 0 0 361.829 3.675 20 5 FHBDRN Cc1cc(OCC(=O)N(Cc2ccccc2F)C(C)C)ccc1[N+](=O)[O-] ZINC000510789286 933740186 /nfs/dbraw/zinc/74/01/86/933740186.db2.gz ZUGIHUKSZFDCSN-UHFFFAOYSA-N 0 0 360.385 3.858 20 5 FHBDRN CCc1ccc(C(=O)Nc2ccnn2CCc2ccccc2)cc1[N+](=O)[O-] ZINC000471918928 933755453 /nfs/dbraw/zinc/75/54/53/933755453.db2.gz AXXBJXXMLMFJKO-UHFFFAOYSA-N 0 0 364.405 3.849 20 5 FHBDRN Cc1nn(C)c(C(=O)N2CCC[C@@H]2c2ccc(C(C)(C)C)cc2)c1[N+](=O)[O-] ZINC000098100134 933767851 /nfs/dbraw/zinc/76/78/51/933767851.db2.gz GAKHUEFUNKKVAB-MRXNPFEDSA-N 0 0 370.453 3.912 20 5 FHBDRN C[C@H](O)CC(C)(C)CNC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000176038941 933786016 /nfs/dbraw/zinc/78/60/16/933786016.db2.gz PPWANQPMKIJHQT-AWEZNQCLSA-N 0 0 371.437 3.865 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1C[S@@](C)=O ZINC000588458681 933788117 /nfs/dbraw/zinc/78/81/17/933788117.db2.gz VCOGUEXXBPDJQI-BMGIKKBBSA-N 0 0 358.419 3.515 20 5 FHBDRN Cc1ccc(NC(=O)c2n[nH]c(C3CC3)c2Br)cc1[N+](=O)[O-] ZINC000065094680 933805384 /nfs/dbraw/zinc/80/53/84/933805384.db2.gz AUMUPTVSUKUZKL-UHFFFAOYSA-N 0 0 365.187 3.519 20 5 FHBDRN Cc1nn(C)c(C(=O)Nc2ccccc2Oc2cccc(F)c2)c1[N+](=O)[O-] ZINC000098101937 933823070 /nfs/dbraw/zinc/82/30/70/933823070.db2.gz JXRPMIFHWJYBKL-UHFFFAOYSA-N 0 0 370.340 3.820 20 5 FHBDRN CCOc1cc(CNc2ccc(NC(=O)C3CC3)cc2)ccc1[N+](=O)[O-] ZINC000276872601 933848716 /nfs/dbraw/zinc/84/87/16/933848716.db2.gz HSYZIXLHWDRJOP-UHFFFAOYSA-N 0 0 355.394 3.954 20 5 FHBDRN CCOC(=O)c1csc([C@H]2CCCN2c2ccc([N+](=O)[O-])cc2F)n1 ZINC000276890328 933888304 /nfs/dbraw/zinc/88/83/04/933888304.db2.gz UEXUXXVJRBKFPZ-CQSZACIVSA-N 0 0 365.386 3.709 20 5 FHBDRN CC(C)(CNC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CCCCO1 ZINC000610717175 933933084 /nfs/dbraw/zinc/93/30/84/933933084.db2.gz PPMAQDMJTDBOJK-AWEZNQCLSA-N 0 0 355.822 3.965 20 5 FHBDRN O=C1OC(c2ccccc2C(F)(F)F)=N/C1=C\c1ccc([N+](=O)[O-])o1 ZINC000176061030 933941154 /nfs/dbraw/zinc/94/11/54/933941154.db2.gz XRVYHXKGXPBZAV-XFFZJAGNSA-N 0 0 352.224 3.551 20 5 FHBDRN Cc1nn(C)c2ncc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc12 ZINC000024033012 933946782 /nfs/dbraw/zinc/94/67/82/933946782.db2.gz COPXJRRBFODRDG-UHFFFAOYSA-N 0 0 367.390 3.652 20 5 FHBDRN CC(C)(CNC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])[C@@H]1CCCCO1 ZINC000610719913 933958000 /nfs/dbraw/zinc/95/80/00/933958000.db2.gz UYCJAQCCALWLKP-AWEZNQCLSA-N 0 0 374.359 3.939 20 5 FHBDRN O=C(N[C@@H]1C[C@H]1C1CC1)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 ZINC000431165580 933982526 /nfs/dbraw/zinc/98/25/26/933982526.db2.gz FPNHTZWFXOBDPH-QFBILLFUSA-N 0 0 351.406 3.735 20 5 FHBDRN COC(=O)c1cc(Cl)c(Cl)cc1NC(=O)c1ccc([N+](=O)[O-])o1 ZINC000431168281 933997489 /nfs/dbraw/zinc/99/74/89/933997489.db2.gz ODWKHPRYLRUMHD-UHFFFAOYSA-N 0 0 359.121 3.534 20 5 FHBDRN Cc1ncccc1C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000431181788 934048283 /nfs/dbraw/zinc/04/82/83/934048283.db2.gz LFNWZHLZWOQOKK-UHFFFAOYSA-N 0 0 350.172 3.621 20 5 FHBDRN O=C(Nc1cnc2ccccc2n1)c1ccc([N+](=O)[O-])cc1Br ZINC000176084596 934057450 /nfs/dbraw/zinc/05/74/50/934057450.db2.gz SQFASMRWEXCBSC-UHFFFAOYSA-N 0 0 373.166 3.553 20 5 FHBDRN CCc1ccc(C(=O)N=c2ccn([C@H](C)c3ccccc3)[nH]2)cc1[N+](=O)[O-] ZINC000610746090 934070782 /nfs/dbraw/zinc/07/07/82/934070782.db2.gz PCQCHTQYJVBZQN-CQSZACIVSA-N 0 0 364.405 3.637 20 5 FHBDRN CCOc1cc(NC(=O)c2c(C)cncc2C)c([N+](=O)[O-])cc1OCC ZINC000610753206 934094553 /nfs/dbraw/zinc/09/45/53/934094553.db2.gz MWACCJCZPUBDTM-UHFFFAOYSA-N 0 0 359.382 3.656 20 5 FHBDRN CCOc1cc(CNc2cccc(-c3nnc(C)n3C)c2)ccc1[N+](=O)[O-] ZINC000276958337 934127780 /nfs/dbraw/zinc/12/77/80/934127780.db2.gz VEWJSRZNIOTQAE-UHFFFAOYSA-N 0 0 367.409 3.710 20 5 FHBDRN Cc1noc(C2CCN(c3c4cccc(Cl)c4ncc3[N+](=O)[O-])CC2)n1 ZINC000891947572 934155689 /nfs/dbraw/zinc/15/56/89/934155689.db2.gz JTGSQCZRSJOFNI-UHFFFAOYSA-N 0 0 373.800 3.872 20 5 FHBDRN CO[C@H](CNC(=O)c1cc(F)cc([N+](=O)[O-])c1)c1ccccc1Cl ZINC000610789621 934203688 /nfs/dbraw/zinc/20/36/88/934203688.db2.gz DJPKVTBVCOHLJW-OAHLLOKOSA-N 0 0 352.749 3.505 20 5 FHBDRN O=C(N[C@@H](C1CCCC1)C(F)(F)F)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000548489942 934207080 /nfs/dbraw/zinc/20/70/80/934207080.db2.gz FXKLBLLRMLUZJA-HNNXBMFYSA-N 0 0 371.359 3.784 20 5 FHBDRN Cc1ccc(S(=O)(=O)N2C[C@@H](C)C[C@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000510965135 934237429 /nfs/dbraw/zinc/23/74/29/934237429.db2.gz GMDDTTVAJWAIJX-HOCLYGCPSA-N 0 0 360.435 3.675 20 5 FHBDRN Cc1c(NC(=O)[C@@H]2Cc3ccccc32)cc(Br)cc1[N+](=O)[O-] ZINC000431235958 934239413 /nfs/dbraw/zinc/23/94/13/934239413.db2.gz YKYVHNIBOMBOPO-CYBMUJFWSA-N 0 0 361.195 3.944 20 5 FHBDRN Cc1c(NC(=O)CCOCC(C)C)cc(Br)cc1[N+](=O)[O-] ZINC000431248926 934248592 /nfs/dbraw/zinc/24/85/92/934248592.db2.gz QQORMRLHFYRJIJ-UHFFFAOYSA-N 0 0 359.220 3.667 20 5 FHBDRN CC(C)Oc1ccccc1CNC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000535674729 934269388 /nfs/dbraw/zinc/26/93/88/934269388.db2.gz IENKMWHUDQPHOB-UHFFFAOYSA-N 0 0 353.378 3.793 20 5 FHBDRN CCc1nnc([C@@H](C)NCc2ccc(-c3ccccc3[N+](=O)[O-])s2)[nH]1 ZINC000535685114 934278514 /nfs/dbraw/zinc/27/85/14/934278514.db2.gz CYLZEYPQEZXWCX-LLVKDONJSA-N 0 0 357.439 3.855 20 5 FHBDRN CCOC[C@H]1CCCCN1C(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000458080185 934282854 /nfs/dbraw/zinc/28/28/54/934282854.db2.gz LLSAEAOXUGAWHE-CYBMUJFWSA-N 0 0 360.332 3.645 20 5 FHBDRN O=C(N[C@@H](c1ccccc1)c1ccccn1)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000535696594 934289562 /nfs/dbraw/zinc/28/95/62/934289562.db2.gz PIDDJKPJBIYXID-FQEVSTJZSA-N 0 0 372.384 3.991 20 5 FHBDRN O=C(NCc1cc(-c2ccccc2)no1)c1c[nH]c2cccc([N+](=O)[O-])c21 ZINC000535697271 934291395 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0 360.435 3.783 20 5 FHBDRN CC[C@H](NC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-])c1ccncc1 ZINC000158085437 935021986 /nfs/dbraw/zinc/02/19/86/935021986.db2.gz HIORFFRJNCMEAF-AWEZNQCLSA-N 0 0 363.801 3.680 20 5 FHBDRN CCc1nc(-c2ccc(C(=O)Nc3ccc(C)c([N+](=O)[O-])c3)cc2)n[nH]1 ZINC000119686183 935031076 /nfs/dbraw/zinc/03/10/76/935031076.db2.gz VJXPKOSAATUQDZ-UHFFFAOYSA-N 0 0 351.366 3.503 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N(C)C1Cc2ccccc2C1 ZINC000439892637 945074545 /nfs/dbraw/zinc/07/45/45/945074545.db2.gz SXJIKANAUICXJN-UHFFFAOYSA-N 0 0 355.394 3.625 20 5 FHBDRN Cc1c(C(=O)Nc2cccc(Cl)c2C)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000247840588 935073324 /nfs/dbraw/zinc/07/33/24/935073324.db2.gz PSGAEXNZSYGKJB-UHFFFAOYSA-N 0 0 371.784 3.698 20 5 FHBDRN Cc1ccc(Oc2ccccc2NC(=O)Cn2nccc2[N+](=O)[O-])cc1 ZINC000119714503 935098991 /nfs/dbraw/zinc/09/89/91/935098991.db2.gz RUBXCCJWLVNBHW-UHFFFAOYSA-N 0 0 352.350 3.531 20 5 FHBDRN C[C@H](C(=O)NCc1ccc(OC(C)(C)C)nc1)c1cccc([N+](=O)[O-])c1 ZINC000516640052 945079325 /nfs/dbraw/zinc/07/93/25/945079325.db2.gz LAVDOXBVCZLOOR-ZDUSSCGKSA-N 0 0 357.410 3.587 20 5 FHBDRN O=C1CCN1c1cccc(-c2noc(/C=C/c3ccc([N+](=O)[O-])cc3)n2)c1 ZINC000438823048 945079656 /nfs/dbraw/zinc/07/96/56/945079656.db2.gz IESRHOZICDVQMQ-RMKNXTFCSA-N 0 0 362.345 3.552 20 5 FHBDRN O=C(c1cc2cccc([N+](=O)[O-])c2[nH]1)N(Cc1ccccc1)CC(F)F ZINC000437173524 945080184 /nfs/dbraw/zinc/08/01/84/945080184.db2.gz XYMYVFHKGOLXRX-UHFFFAOYSA-N 0 0 359.332 3.984 20 5 FHBDRN O=C(Nc1ccc2cc([N+](=O)[O-])ccc2n1)C1(c2cccc(F)c2)CC1 ZINC000084776646 935168676 /nfs/dbraw/zinc/16/86/76/935168676.db2.gz ZELNYVWBANUHHG-UHFFFAOYSA-N 0 0 351.337 3.952 20 5 FHBDRN O=C(Nc1ccc2cc([N+](=O)[O-])ccc2n1)c1ccc(OC(F)F)cc1 ZINC000084775917 935168933 /nfs/dbraw/zinc/16/89/33/935168933.db2.gz YFGWARAPQURDDZ-UHFFFAOYSA-N 0 0 359.288 3.997 20 5 FHBDRN CC[C@H](C)C(=O)O[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000023520624 945082414 /nfs/dbraw/zinc/08/24/14/945082414.db2.gz YHSHVZXIPIRQTA-DTWKUNHWSA-N 0 0 362.304 3.530 20 5 FHBDRN COC(=O)c1cc(NC(=O)CCCc2sccc2C)cc([N+](=O)[O-])c1 ZINC000438825800 945082831 /nfs/dbraw/zinc/08/28/31/945082831.db2.gz WVWQYJJJUANQCL-UHFFFAOYSA-N 0 0 362.407 3.713 20 5 FHBDRN Cc1nc(-c2cccc(NC(=O)C(C)(C)c3ccccc3[N+](=O)[O-])c2)n[nH]1 ZINC000431342326 935194441 /nfs/dbraw/zinc/19/44/41/935194441.db2.gz SJXBFIARVRYNKP-UHFFFAOYSA-N 0 0 365.393 3.605 20 5 FHBDRN CCn1c(C)nc([N+](=O)[O-])c1NCCCc1cn(-c2ccccc2)nc1C ZINC000582083647 935229800 /nfs/dbraw/zinc/22/98/00/935229800.db2.gz GMPVXAFARLMUHT-UHFFFAOYSA-N 0 0 368.441 3.658 20 5 FHBDRN C[C@@H](CNc1ccccc1)NC(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000119799366 935235640 /nfs/dbraw/zinc/23/56/40/935235640.db2.gz ZFWBRKFMFJZEBS-KBPBESRZSA-N 0 0 359.451 3.692 20 5 FHBDRN C[C@H](CNc1ccccc1)NC(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000119799218 935235654 /nfs/dbraw/zinc/23/56/54/935235654.db2.gz ZFWBRKFMFJZEBS-ZIAGYGMSSA-N 0 0 359.451 3.692 20 5 FHBDRN COc1ccc(CNC(=O)[C@H](C)CCc2ccccc2F)cc1[N+](=O)[O-] ZINC000463170640 935240503 /nfs/dbraw/zinc/24/05/03/935240503.db2.gz NLYJUFGTTNGMKV-CYBMUJFWSA-N 0 0 360.385 3.628 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)NC(C)(C)c1nc(C)cs1 ZINC000439913331 945086738 /nfs/dbraw/zinc/08/67/38/945086738.db2.gz WHEYNNBQNLFBBU-UHFFFAOYSA-N 0 0 364.427 3.815 20 5 FHBDRN Cc1c(CN(Cc2ccccc2)C[C@@H](O)C(F)(F)F)cccc1[N+](=O)[O-] ZINC000611575324 935243655 /nfs/dbraw/zinc/24/36/55/935243655.db2.gz GDENCFWWCWZZMP-QGZVFWFLSA-N 0 0 368.355 3.829 20 5 FHBDRN C[C@@H](c1cccc(Cl)c1)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000119807816 935248819 /nfs/dbraw/zinc/24/88/19/935248819.db2.gz BMYXIESEIHCNNH-AWEZNQCLSA-N 0 0 373.840 3.767 20 5 FHBDRN C[C@@H](C(=O)Nc1ccccc1Cl)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000511073661 935251184 /nfs/dbraw/zinc/25/11/84/935251184.db2.gz PZEFYCIKMFMFNG-ZDUSSCGKSA-N 0 0 361.829 3.750 20 5 FHBDRN O=C(NCc1cc(F)cc(F)c1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000437164109 945087988 /nfs/dbraw/zinc/08/79/88/945087988.db2.gz JTAVTQACHQJLNW-UHFFFAOYSA-N 0 0 360.238 3.822 20 5 FHBDRN C[C@@H](c1ccc(Cl)cc1)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000119814018 935260968 /nfs/dbraw/zinc/26/09/68/935260968.db2.gz OCPQEBKQQKUTPL-AWEZNQCLSA-N 0 0 373.840 3.767 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N(Cc1cccc(F)c1)C[C@@H]1CCCO1 ZINC000072064519 935264605 /nfs/dbraw/zinc/26/46/05/935264605.db2.gz KPKCVLNKXDMADQ-SFHVURJKSA-N 0 0 372.396 3.864 20 5 FHBDRN C[C@@H](SCc1ccc(S(C)(=O)=O)cc1)c1cccc([N+](=O)[O-])c1 ZINC000551373694 935271949 /nfs/dbraw/zinc/27/19/49/935271949.db2.gz VMHWDXYBLRJDGR-GFCCVEGCSA-N 0 0 351.449 3.993 20 5 FHBDRN Cc1cc(C)cc(NC(=O)[C@H](C)N(C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000511075494 935275270 /nfs/dbraw/zinc/27/52/70/935275270.db2.gz ZGQASBLEWUOADP-INIZCTEOSA-N 0 0 355.438 3.713 20 5 FHBDRN Cc1cc(C)cc(NC(=O)[C@@H](C)N(C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000511075495 935275449 /nfs/dbraw/zinc/27/54/49/935275449.db2.gz ZGQASBLEWUOADP-MRXNPFEDSA-N 0 0 355.438 3.713 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1OCc1ccc(-n2nc(C)cc2C)cc1 ZINC000072067973 935275991 /nfs/dbraw/zinc/27/59/91/935275991.db2.gz LHUOHWRMQOYAIT-UHFFFAOYSA-N 0 0 353.378 3.985 20 5 FHBDRN Cc1n[nH]c(C(=O)NC(C)(C)Cc2ccc(Cl)cc2Cl)c1[N+](=O)[O-] ZINC000472167795 935280452 /nfs/dbraw/zinc/28/04/52/935280452.db2.gz BFDWDUORCJLRRC-UHFFFAOYSA-N 0 0 371.224 3.684 20 5 FHBDRN CCCc1nc(C)c(C(=O)N2CCS[C@H]2c2ccc([N+](=O)[O-])cc2)o1 ZINC000551455699 935280753 /nfs/dbraw/zinc/28/07/53/935280753.db2.gz JIMMALJLBCULHP-KRWDZBQOSA-N 0 0 361.423 3.732 20 5 FHBDRN Cc1ccc(-c2cc(C(=O)N[C@@H](C)c3cccc([N+](=O)[O-])c3)[nH]n2)cc1 ZINC000519066298 945089908 /nfs/dbraw/zinc/08/99/08/945089908.db2.gz CTBRYUXKVAMSBY-ZDUSSCGKSA-N 0 0 350.378 3.784 20 5 FHBDRN Cc1nnc([C@@H]2CC23CCN(c2ccc([N+](=O)[O-])c4cnccc42)CC3)o1 ZINC000370843543 935283628 /nfs/dbraw/zinc/28/36/28/935283628.db2.gz RTPLDFWSGYXDNF-HNNXBMFYSA-N 0 0 365.393 3.609 20 5 FHBDRN Cn1c(-c2nc(-c3cc(Br)ccc3F)no2)ccc1[N+](=O)[O-] ZINC000551462679 935293549 /nfs/dbraw/zinc/29/35/49/935293549.db2.gz PDOVODGQRJIBRM-UHFFFAOYSA-N 0 0 367.134 3.552 20 5 FHBDRN CCOc1ccc(NC(=O)[C@H]2C[C@@H]2c2cccc([N+](=O)[O-])c2)cc1OC ZINC001125582980 935296449 /nfs/dbraw/zinc/29/64/49/935296449.db2.gz INOWCKXYVMWHJA-CVEARBPZSA-N 0 0 356.378 3.744 20 5 FHBDRN Cc1ccc(C[C@@H]2CCCN2C(=O)Cc2cccc([N+](=O)[O-])c2C)cc1 ZINC000438832396 945093313 /nfs/dbraw/zinc/09/33/13/945093313.db2.gz FIVSGJXODQBLSM-IBGZPJMESA-N 0 0 352.434 3.988 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCc2cc(F)ccc2C1 ZINC000092009006 935308399 /nfs/dbraw/zinc/30/83/99/935308399.db2.gz AVFPFNMENIGSMK-GFCCVEGCSA-N 0 0 360.410 3.799 20 5 FHBDRN O=c1c2ccc([N+](=O)[O-])cc2ncn1Cc1ccc(Cl)c(Cl)c1 ZINC000072105668 935309103 /nfs/dbraw/zinc/30/91/03/935309103.db2.gz ZCEIUYCTPOXOFX-UHFFFAOYSA-N 0 0 350.161 3.660 20 5 FHBDRN CC(=O)Nc1cc(F)c(F)cc1NC(=O)c1c[nH]c2cccc([N+](=O)[O-])c21 ZINC000551617900 935315314 /nfs/dbraw/zinc/31/53/14/935315314.db2.gz ZJUHCEXMHHIAMZ-UHFFFAOYSA-N 0 0 374.303 3.565 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)N1CCC=C(c2ccccc2)C1 ZINC000551617794 935315419 /nfs/dbraw/zinc/31/54/19/935315419.db2.gz YTWOZMWXIPCNIS-UHFFFAOYSA-N 0 0 351.406 3.636 20 5 FHBDRN COc1ccc(CN[C@@H](c2nc(C)cs2)C(F)(F)F)cc1[N+](=O)[O-] ZINC000451127527 935315994 /nfs/dbraw/zinc/31/59/94/935315994.db2.gz HDYYCLRMWILARN-LBPRGKRZSA-N 0 0 361.345 3.762 20 5 FHBDRN C[C@@H](CC(=O)Nc1cc(Br)cc([N+](=O)[O-])c1)c1cccnc1 ZINC000551668595 935325341 /nfs/dbraw/zinc/32/53/41/935325341.db2.gz SGPQRYZAPPQXCG-JTQLQIEISA-N 0 0 364.199 3.885 20 5 FHBDRN CNc1ccc(C(=O)Nc2ccnn2-c2cccc(Cl)c2)cc1[N+](=O)[O-] ZINC000551737303 935335080 /nfs/dbraw/zinc/33/50/80/935335080.db2.gz GPGDGCHPOKFXLY-UHFFFAOYSA-N 0 0 371.784 3.728 20 5 FHBDRN CC(C)CC(=O)Nc1ccc(C(=O)N(C)c2cccc([N+](=O)[O-])c2)cc1F ZINC000158120882 935338230 /nfs/dbraw/zinc/33/82/30/935338230.db2.gz UZUWRTUXSSPKRY-UHFFFAOYSA-N 0 0 373.384 3.995 20 5 FHBDRN C[C@H](CC(=O)c1ccccc1)NC(=O)C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000551827878 935357097 /nfs/dbraw/zinc/35/70/97/935357097.db2.gz YCRBMPLPIHJXOA-CQSZACIVSA-N 0 0 354.406 3.650 20 5 FHBDRN Cn1c(NC(=O)c2c[nH]c3cccc([N+](=O)[O-])c32)nc2cc(Cl)ccc21 ZINC000551844132 935360452 /nfs/dbraw/zinc/36/04/52/935360452.db2.gz KHBFPXWVAWAUGH-UHFFFAOYSA-N 0 0 369.768 3.869 20 5 FHBDRN O=C(c1ccccc1[N+](=O)[O-])N1CCC[C@@H](c2nc3c(s2)CCCC3)C1 ZINC000119957201 935361715 /nfs/dbraw/zinc/36/17/15/935361715.db2.gz JQNHXCVKUHMNQL-CYBMUJFWSA-N 0 0 371.462 3.950 20 5 FHBDRN CCN(c1ccc2[nH]ccc2c1)S(=O)(=O)c1c(C)cc([N+](=O)[O-])cc1C ZINC000472189850 935371708 /nfs/dbraw/zinc/37/17/08/935371708.db2.gz KLNICBHRKKIZRJ-UHFFFAOYSA-N 0 0 373.434 3.908 20 5 FHBDRN Cc1cc(OCC(=O)N2CCCCC[C@H]2c2cccn2C)ccc1[N+](=O)[O-] ZINC000431372357 935381316 /nfs/dbraw/zinc/38/13/16/935381316.db2.gz WQNRWXSPQBKFCS-IBGZPJMESA-N 0 0 371.437 3.764 20 5 FHBDRN COc1ccc(-c2csc(NC(=O)c3cc([N+](=O)[O-])cnc3C)n2)cc1 ZINC000506722600 945097478 /nfs/dbraw/zinc/09/74/78/945097478.db2.gz XTMSGZZIFAHHPZ-UHFFFAOYSA-N 0 0 370.390 3.683 20 5 FHBDRN CC(=O)N1C=Cc2ccccc2[C@@H]1CC(=O)Oc1ccc(C)cc1[N+](=O)[O-] ZINC000051528449 935423167 /nfs/dbraw/zinc/42/31/67/935423167.db2.gz REOSYKKVEAZRTR-KRWDZBQOSA-N 0 0 366.373 3.773 20 5 FHBDRN COC(=O)c1cc2cc(NC(=O)c3cc([N+](=O)[O-])c(C)s3)ccc2o1 ZINC000044658284 945099975 /nfs/dbraw/zinc/09/99/75/945099975.db2.gz BXJJXVWTWXKIBL-UHFFFAOYSA-N 0 0 360.347 3.750 20 5 FHBDRN COc1ccccc1NC1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2)CC1 ZINC000085358042 935453884 /nfs/dbraw/zinc/45/38/84/935453884.db2.gz BNOQCSYYWPNWCF-UHFFFAOYSA-N 0 0 370.409 3.712 20 5 FHBDRN COc1cccc(-c2nc(Cc3c[nH]c4ccc(F)cc34)no2)c1[N+](=O)[O-] ZINC000582267003 935467826 /nfs/dbraw/zinc/46/78/26/935467826.db2.gz XGQCWXZIFNTADI-UHFFFAOYSA-N 0 0 368.324 3.865 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)c1nc(-c2ccncc2OC)no1 ZINC000582267448 935468469 /nfs/dbraw/zinc/46/84/69/935468469.db2.gz SPJSEELNSVGLEB-ZDUSSCGKSA-N 0 0 354.366 3.785 20 5 FHBDRN Cc1ccc(Sc2ccc(C(=O)N[C@@H](C)C[C@@H](C)O)cc2[N+](=O)[O-])cc1 ZINC000544027368 935472296 /nfs/dbraw/zinc/47/22/96/935472296.db2.gz SMQPLPGSGWFRCP-UONOGXRCSA-N 0 0 374.462 3.944 20 5 FHBDRN Cn1cnc([N+](=O)[O-])c1CN(Cc1ccccc1C(F)(F)F)CC1CC1 ZINC000511097152 935511638 /nfs/dbraw/zinc/51/16/38/935511638.db2.gz SYAPCLWEHIUDQV-UHFFFAOYSA-N 0 0 368.359 3.759 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N(C)[C@H]1CCCc2ccccc21 ZINC000055973818 935520677 /nfs/dbraw/zinc/52/06/77/935520677.db2.gz FTZYCABQBGUOGT-INIZCTEOSA-N 0 0 360.435 3.601 20 5 FHBDRN Cc1c(NC(=O)c2ccc3nc(C(F)(F)F)cn3c2)cccc1[N+](=O)[O-] ZINC000472217150 935529243 /nfs/dbraw/zinc/52/92/43/935529243.db2.gz NFUDWBBQAJFAJD-UHFFFAOYSA-N 0 0 364.283 3.822 20 5 FHBDRN COc1cc2c(cc1F)CN(c1ccc([N+](=O)[O-])c3cnccc31)CC2 ZINC000540709714 935540893 /nfs/dbraw/zinc/54/08/93/935540893.db2.gz RBLIVNGITKNQBT-UHFFFAOYSA-N 0 0 353.353 3.853 20 5 FHBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCO[C@@H](C)C1 ZINC000540750584 935553861 /nfs/dbraw/zinc/55/38/61/935553861.db2.gz LASPJLDUNPLRBS-STQMWFEESA-N 0 0 352.456 3.784 20 5 FHBDRN COCc1cccc(OCC2(COc3ccc(OC)cc3[N+](=O)[O-])CC2)c1 ZINC000478062578 935557823 /nfs/dbraw/zinc/55/78/23/935557823.db2.gz OQLOHAKRGZXBBQ-UHFFFAOYSA-N 0 0 373.405 3.988 20 5 FHBDRN Cc1ccc(C)c(S(=O)(=O)N2CCc3sccc3[C@H]2C)c1[N+](=O)[O-] ZINC000478140399 935576645 /nfs/dbraw/zinc/57/66/45/935576645.db2.gz DUBPKDNQGWCIMC-GFCCVEGCSA-N 0 0 366.464 3.581 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])[C@@H]1CCN(c2cccc(Cl)c2)C1=O ZINC000511104675 935578169 /nfs/dbraw/zinc/57/81/69/935578169.db2.gz ICDRAEMLKZATLI-GOSISDBHSA-N 0 0 373.840 3.528 20 5 FHBDRN Cc1ccc(C)c(S(=O)(=O)N2CCC[C@@H]3CCCC[C@@H]32)c1[N+](=O)[O-] ZINC000478147466 935578870 /nfs/dbraw/zinc/57/88/70/935578870.db2.gz XQUQPYRFNGAAEP-GJZGRUSLSA-N 0 0 352.456 3.555 20 5 FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H](C)c1ccccc1 ZINC000478180763 935583152 /nfs/dbraw/zinc/58/31/52/935583152.db2.gz PPQWTJPHFFRHBE-AWEZNQCLSA-N 0 0 374.462 3.867 20 5 FHBDRN O=C(N[C@@H](c1ccccc1)c1ccc2[nH]cnc2c1)c1ccc([N+](=O)[O-])cc1 ZINC000023388888 935585256 /nfs/dbraw/zinc/58/52/56/935585256.db2.gz PHNIEWDFRICYDS-FQEVSTJZSA-N 0 0 372.384 3.991 20 5 FHBDRN CC[C@H](C)c1ncc(NC(=O)CCCNc2ccc([N+](=O)[O-])cc2)cn1 ZINC000478296279 935601258 /nfs/dbraw/zinc/60/12/58/935601258.db2.gz FABRQWCEBHXGRI-ZDUSSCGKSA-N 0 0 357.414 3.729 20 5 FHBDRN CCN(CC1CCC1)C(=O)c1cc([N+](=O)[O-])ccc1SCCOC ZINC000478291116 935607413 /nfs/dbraw/zinc/60/74/13/935607413.db2.gz MZSFEOZIEVSYIB-UHFFFAOYSA-N 0 0 352.456 3.596 20 5 FHBDRN C[C@@H](c1ccccc1)N(C)C(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000519106809 945112093 /nfs/dbraw/zinc/11/20/93/945112093.db2.gz UBVDMMIWCBGXJO-AWEZNQCLSA-N 0 0 350.378 3.614 20 5 FHBDRN COC(=O)[C@@H](c1cccc(Cl)c1)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000511109448 935611883 /nfs/dbraw/zinc/61/18/83/935611883.db2.gz OCCAKYHEBNEGDF-QGZVFWFLSA-N 0 0 362.813 3.637 20 5 FHBDRN CCC[C@@H](CCO)CNC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 ZINC000478298212 935611897 /nfs/dbraw/zinc/61/18/97/935611897.db2.gz URSVKIVSYZNJMV-HNNXBMFYSA-N 0 0 372.421 3.916 20 5 FHBDRN Cc1c(CNC(=O)NCC2(c3ccccc3)CCC2)cccc1[N+](=O)[O-] ZINC000478367053 935619594 /nfs/dbraw/zinc/61/95/94/935619594.db2.gz FPZSFPGUKFDXKD-UHFFFAOYSA-N 0 0 353.422 3.824 20 5 FHBDRN O=[N+]([O-])c1cccc(OC[C@@H](O)CSCc2ccccc2Cl)c1 ZINC000478371916 935619684 /nfs/dbraw/zinc/61/96/84/935619684.db2.gz RYHKERSFVZZXTB-CQSZACIVSA-N 0 0 353.827 3.921 20 5 FHBDRN Cc1cc(C(=O)N(C)c2cccc([N+](=O)[O-])c2)c2cnn(C(C)C)c2n1 ZINC000158192665 935619844 /nfs/dbraw/zinc/61/98/44/935619844.db2.gz MDJYQGKPNGHWNP-UHFFFAOYSA-N 0 0 353.382 3.505 20 5 FHBDRN CN(Cc1cn(C)nc1C(F)(F)F)c1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000127570066 935626914 /nfs/dbraw/zinc/62/69/14/935626914.db2.gz YJZMTPAIKHBLKG-UHFFFAOYSA-N 0 0 365.315 3.532 20 5 FHBDRN CC[C@@H](NC(=O)NCc1cccc([N+](=O)[O-])c1C)c1ccc(OC)cc1 ZINC000478459639 935629576 /nfs/dbraw/zinc/62/95/76/935629576.db2.gz NCUKUSMPPKHZMC-QGZVFWFLSA-N 0 0 357.410 3.862 20 5 FHBDRN Cc1c(NC(=O)[C@@H](C)N2CCC=C(c3ccco3)C2)cccc1[N+](=O)[O-] ZINC000511112219 935631194 /nfs/dbraw/zinc/63/11/94/935631194.db2.gz YGFYILRKSNFJSY-CQSZACIVSA-N 0 0 355.394 3.613 20 5 FHBDRN Cc1nn(C)c(N2CCC[C@@H](COc3ccccc3Cl)C2)c1[N+](=O)[O-] ZINC000158239108 935643228 /nfs/dbraw/zinc/64/32/28/935643228.db2.gz ZLBVBXIJSAEEBZ-CYBMUJFWSA-N 0 0 364.833 3.586 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2C[C@H](c3ccc(Cl)cc3)C2)c1 ZINC000478556829 935646912 /nfs/dbraw/zinc/64/69/12/935646912.db2.gz COYLOMZVDGZZGW-MQMHXKEQSA-N 0 0 360.797 3.933 20 5 FHBDRN CC(C)[C@H]1CN(C(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])CCS1 ZINC000437202740 945114526 /nfs/dbraw/zinc/11/45/26/945114526.db2.gz XLKWYQLXABETGR-XHDPSFHLSA-N 0 0 372.874 3.616 20 5 FHBDRN CC(C)(C)CC[C@@H](CO)NC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000478589726 935655845 /nfs/dbraw/zinc/65/58/45/935655845.db2.gz DRWZGVWLRDQTQF-NSHDSACASA-N 0 0 362.348 3.531 20 5 FHBDRN COc1cc(C(=O)NCCOc2ccc(C(C)(C)C)cc2)ccc1[N+](=O)[O-] ZINC000511117781 935662153 /nfs/dbraw/zinc/66/21/53/935662153.db2.gz ZNIAJJYNODUOQX-UHFFFAOYSA-N 0 0 372.421 3.710 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(N2CCC(Oc3ccc(C)cc3)CC2)c1 ZINC000302068885 935669973 /nfs/dbraw/zinc/66/99/73/935669973.db2.gz DNWLKNSYHLUSJV-UHFFFAOYSA-N 0 0 370.405 3.738 20 5 FHBDRN CC(C)(C)c1cc(NC(=O)c2cccc([N+](=O)[O-])c2)n(-c2ccccn2)n1 ZINC000519095061 945116944 /nfs/dbraw/zinc/11/69/44/945116944.db2.gz VTONMTUFEQVEOD-UHFFFAOYSA-N 0 0 365.393 3.725 20 5 FHBDRN Cc1nn(C)c(C(=O)Nc2ccc(Oc3cccc(C)c3)cc2)c1[N+](=O)[O-] ZINC000127652967 935689199 /nfs/dbraw/zinc/68/91/99/935689199.db2.gz QQEIGIIANFZZFK-UHFFFAOYSA-N 0 0 366.377 3.990 20 5 FHBDRN CCCc1[nH]nc(C(=O)Nc2ccc3c4c(cccc42)CC3)c1[N+](=O)[O-] ZINC000110061312 935706199 /nfs/dbraw/zinc/70/61/99/935706199.db2.gz PXKVRZPHLAFKAY-UHFFFAOYSA-N 0 0 350.378 3.775 20 5 FHBDRN CC(C)c1ccc(C(=O)N(C[C@@H]2CCCO2)c2ccncc2)cc1[N+](=O)[O-] ZINC000187745161 935744622 /nfs/dbraw/zinc/74/46/22/935744622.db2.gz LNUQSDXCKLBADC-KRWDZBQOSA-N 0 0 369.421 3.939 20 5 FHBDRN Cc1c(CNC(=O)N[C@H]2C[C@H]2c2c(F)cccc2F)cccc1[N+](=O)[O-] ZINC000478856295 935745792 /nfs/dbraw/zinc/74/57/92/935745792.db2.gz LZHPBUQXTUCDCW-DOMZBBRYSA-N 0 0 361.348 3.537 20 5 FHBDRN CCO[C@H]1C[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2F)C12CCCCC2 ZINC000478861475 935746049 /nfs/dbraw/zinc/74/60/49/935746049.db2.gz VMIALQNEGDTHMN-CVEARBPZSA-N 0 0 350.390 3.592 20 5 FHBDRN CN1CCCN(C(=O)c2ccc([N+](=O)[O-])c(Cl)c2)c2cc(F)ccc21 ZINC000158348584 935749748 /nfs/dbraw/zinc/74/97/48/935749748.db2.gz GMWTZCHRYLUNOD-UHFFFAOYSA-N 0 0 363.776 3.874 20 5 FHBDRN Cc1c(CNC(=O)NCCc2csc(C(C)C)n2)cccc1[N+](=O)[O-] ZINC000478900992 935752972 /nfs/dbraw/zinc/75/29/72/935752972.db2.gz QMKIKFNOOBPVJM-UHFFFAOYSA-N 0 0 362.455 3.525 20 5 FHBDRN CCC1(CC)CC(=O)N(Cc2cc([N+](=O)[O-])ccc2OC(C)C)C(=O)C1 ZINC000478901316 935753061 /nfs/dbraw/zinc/75/30/61/935753061.db2.gz VOBWTWILYXTWPJ-UHFFFAOYSA-N 0 0 362.426 3.837 20 5 FHBDRN C[C@@H]1CC[C@@]2(CCN(c3ccc(S(=O)(=O)C(F)F)cc3[N+](=O)[O-])C2)C1 ZINC000302066251 935756404 /nfs/dbraw/zinc/75/64/04/935756404.db2.gz WFQHJIQQUNHQIS-BDJLRTHQSA-N 0 0 374.409 3.608 20 5 FHBDRN COc1ccc(F)cc1[C@@H](C)NC(=O)NCc1cccc([N+](=O)[O-])c1C ZINC000478932512 935756753 /nfs/dbraw/zinc/75/67/53/935756753.db2.gz UWSCURZYLGOZOZ-GFCCVEGCSA-N 0 0 361.373 3.611 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N1CCN(Cc2ccc(Cl)cc2)CC1 ZINC000511135576 935761898 /nfs/dbraw/zinc/76/18/98/935761898.db2.gz LUAURWJYHNVMHJ-UHFFFAOYSA-N 0 0 373.840 3.515 20 5 FHBDRN CC(C)c1csc(CNC(=O)c2ccc([N+](=O)[O-])c3cccnc23)n1 ZINC000158386285 935765450 /nfs/dbraw/zinc/76/54/50/935765450.db2.gz BOOMUYVXKCEZFR-UHFFFAOYSA-N 0 0 356.407 3.653 20 5 FHBDRN CCNc1ccc(C(=O)N2Cc3ccccc3C3(CC3)C2)cc1[N+](=O)[O-] ZINC000479032386 935771504 /nfs/dbraw/zinc/77/15/04/935771504.db2.gz CMZDUPNPYNOGQP-UHFFFAOYSA-N 0 0 351.406 3.714 20 5 FHBDRN COc1cc(C(=O)NC2(C(F)(F)F)CCCCC2)cc([N+](=O)[O-])c1C ZINC000479081476 935783468 /nfs/dbraw/zinc/78/34/68/935783468.db2.gz UQYGZGHPVBNESR-UHFFFAOYSA-N 0 0 360.332 3.907 20 5 FHBDRN Cc1cc(C)c(NC(=O)CN(C)Cc2ccc(C)c([N+](=O)[O-])c2)c(C)c1 ZINC000158422730 935786632 /nfs/dbraw/zinc/78/66/32/935786632.db2.gz BRWLZGYEUHKZQB-UHFFFAOYSA-N 0 0 355.438 3.899 20 5 FHBDRN Cc1c(OCC(=O)Nc2ccccc2C(F)(F)F)cccc1[N+](=O)[O-] ZINC000047355702 945123778 /nfs/dbraw/zinc/12/37/78/945123778.db2.gz URJSBHIVNHHAJE-UHFFFAOYSA-N 0 0 354.284 3.940 20 5 FHBDRN Cc1cc(F)cc(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)c1[N+](=O)[O-] ZINC000121820966 935795077 /nfs/dbraw/zinc/79/50/77/935795077.db2.gz CCOJMYGVJQBBLQ-UHFFFAOYSA-N 0 0 372.356 3.579 20 5 FHBDRN Cc1noc([C@H](OC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)c2ccccc2)n1 ZINC000176679957 935802622 /nfs/dbraw/zinc/80/26/22/935802622.db2.gz ORPHQKAFCWCVJN-ZPHJMFTNSA-N 0 0 365.345 3.632 20 5 FHBDRN CCCN(CC(F)(F)F)C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000611615096 935804069 /nfs/dbraw/zinc/80/40/69/935804069.db2.gz IGKWYQSHRFVZDL-UHFFFAOYSA-N 0 0 356.247 3.611 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(C(=O)N2CCC(OC3CCCC3)CC2)c1F ZINC000277676565 935809385 /nfs/dbraw/zinc/80/93/85/935809385.db2.gz MULZZUSTGQDEPX-UHFFFAOYSA-N 0 0 350.390 3.606 20 5 FHBDRN O=C(/C=C/c1ccc([N+](=O)[O-])cc1)Nc1nnc(/C=C\c2ccco2)s1 ZINC000255508650 935813790 /nfs/dbraw/zinc/81/37/90/935813790.db2.gz VZUXQNZFYJCSNC-SXIMUEDZSA-N 0 0 368.374 3.862 20 5 FHBDRN C[C@@H](Oc1cccnc1[N+](=O)[O-])C(=O)N[C@@H](C)c1cccc2ccccc21 ZINC000023754155 935818105 /nfs/dbraw/zinc/81/81/05/935818105.db2.gz DSLPOHRTVNXAJY-UONOGXRCSA-N 0 0 365.389 3.788 20 5 FHBDRN CCS[C@@H](C)c1noc(CN(C)Cc2c(F)cccc2[N+](=O)[O-])n1 ZINC000127825741 935819028 /nfs/dbraw/zinc/81/90/28/935819028.db2.gz AIBAWNFXWDKOID-JTQLQIEISA-N 0 0 354.407 3.563 20 5 FHBDRN Cc1c(Br)cc(C(=O)N(CC(F)F)C(C)C)cc1[N+](=O)[O-] ZINC000127854734 935824366 /nfs/dbraw/zinc/82/43/66/935824366.db2.gz UIYLUTLHQLBAON-UHFFFAOYSA-N 0 0 365.174 3.781 20 5 FHBDRN CSC[C@@H]1CCCN1C(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000127858119 935824542 /nfs/dbraw/zinc/82/45/42/935824542.db2.gz IXEWGEMSAXXTDO-NSHDSACASA-N 0 0 373.272 3.633 20 5 FHBDRN CN(C(=O)Cc1cccc(OCC(F)(F)F)c1)c1cccc([N+](=O)[O-])c1 ZINC000158510692 935824886 /nfs/dbraw/zinc/82/48/86/935824886.db2.gz VVYGDTGAIGGOOF-UHFFFAOYSA-N 0 0 368.311 3.741 20 5 FHBDRN Cc1oc(-c2cccs2)nc1CC(=O)N(C)c1cccc([N+](=O)[O-])c1 ZINC000158492286 935825368 /nfs/dbraw/zinc/82/53/68/935825368.db2.gz CRYZFZRLTNGBBM-UHFFFAOYSA-N 0 0 357.391 3.825 20 5 FHBDRN CCOc1cc(COC(=O)[C@H]2CCCN2c2ccccc2)ccc1[N+](=O)[O-] ZINC000785134484 935827339 /nfs/dbraw/zinc/82/73/39/935827339.db2.gz UHQKDFURNGKWJC-GOSISDBHSA-N 0 0 370.405 3.706 20 5 FHBDRN CCCN(C(=O)Cc1ccc([N+](=O)[O-])cc1)[C@H]1CCCc2cccnc21 ZINC000479346833 935828688 /nfs/dbraw/zinc/82/86/88/935828688.db2.gz HSKGHHAEBGPCJR-SFHVURJKSA-N 0 0 353.422 3.849 20 5 FHBDRN COc1cc(C(=O)N2CCC[C@@H](c3ccccc3)C2)c([N+](=O)[O-])cc1OC ZINC000519127136 945131023 /nfs/dbraw/zinc/13/10/23/945131023.db2.gz QXAJFWVOYYHZFG-OAHLLOKOSA-N 0 0 370.405 3.632 20 5 FHBDRN C[C@@H](CNC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-])C(F)(F)F ZINC000479397186 935835009 /nfs/dbraw/zinc/83/50/09/935835009.db2.gz XBBIXDNFYPAOAX-ZETCQYMHSA-N 0 0 356.753 3.655 20 5 FHBDRN C[C@@H](CNC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1)C(F)(F)F ZINC000479401754 935835304 /nfs/dbraw/zinc/83/53/04/935835304.db2.gz YFMLYPBPYGFPNO-LBPRGKRZSA-N 0 0 373.375 3.759 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H](OCCCc2ccccc2)C1 ZINC000176338216 935835750 /nfs/dbraw/zinc/83/57/50/935835750.db2.gz BIZSIFHZQZDHKO-LJQANCHMSA-N 0 0 368.433 3.767 20 5 FHBDRN C[C@H](Sc1ncccc1[N+](=O)[O-])C(=O)Nc1cccc2ncccc21 ZINC000127908836 935836923 /nfs/dbraw/zinc/83/69/23/935836923.db2.gz IOGMVDZDAFUHQO-NSHDSACASA-N 0 0 354.391 3.657 20 5 FHBDRN CCc1nc(C)c(C(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])s1 ZINC000479406330 935837380 /nfs/dbraw/zinc/83/73/80/935837380.db2.gz JMCNXABVXZKODO-UHFFFAOYSA-N 0 0 353.831 3.548 20 5 FHBDRN CC[C@H](C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-])c1c(C)noc1C ZINC000479420820 935838189 /nfs/dbraw/zinc/83/81/89/935838189.db2.gz ISLFCUWZSRUMLB-AWEZNQCLSA-N 0 0 365.817 3.706 20 5 FHBDRN CC[C@H]1[C@H](C)CCN1C(=O)c1ccc(Cn2nc(C)c([N+](=O)[O-])c2C)cc1 ZINC000479431509 935838437 /nfs/dbraw/zinc/83/84/37/935838437.db2.gz ZQRUZMLZSZBGIF-ACJLOTCBSA-N 0 0 370.453 3.717 20 5 FHBDRN Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)c1ccccc1[N+](=O)[O-] ZINC000050383714 935839531 /nfs/dbraw/zinc/83/95/31/935839531.db2.gz OJVPNBGWUKTNNX-UHFFFAOYSA-N 0 0 355.394 3.541 20 5 FHBDRN CCc1ccc([C@@H](COC)NC(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)o1 ZINC000127927269 935843258 /nfs/dbraw/zinc/84/32/58/935843258.db2.gz ULVCPUJCFZRYIY-CQSZACIVSA-N 0 0 361.398 3.876 20 5 FHBDRN Cc1noc([C@@H](OC(=O)c2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)n1 ZINC000176684221 935844837 /nfs/dbraw/zinc/84/48/37/935844837.db2.gz WUYHULRFDVVPRY-HNNXBMFYSA-N 0 0 373.752 3.886 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)Nc1ccc(OCc2cccnc2)cc1 ZINC000728497068 935846603 /nfs/dbraw/zinc/84/66/03/935846603.db2.gz MPSTWRJUTLRYJZ-UHFFFAOYSA-N 0 0 364.361 3.525 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CCC(C2CCOCC2)CC1 ZINC000119942782 935853394 /nfs/dbraw/zinc/85/33/94/935853394.db2.gz NSNZZAHCWWYQEZ-UHFFFAOYSA-N 0 0 361.442 3.882 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)NC[C@H](c1ccccc1)C(F)(F)F ZINC000187761951 935855306 /nfs/dbraw/zinc/85/53/06/935855306.db2.gz YCGQGOHGHBANIF-OAHLLOKOSA-N 0 0 352.312 3.600 20 5 FHBDRN Nc1nc(C2CC2)c(C(=O)OCc2ccc([N+](=O)[O-])cc2Cl)s1 ZINC000782347790 935863621 /nfs/dbraw/zinc/86/36/21/935863621.db2.gz CDVUHAMBQRHYCG-UHFFFAOYSA-N 0 0 353.787 3.521 20 5 FHBDRN O=C(NC[C@H]1CCC2(CCCCC2)O1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000479587761 935864179 /nfs/dbraw/zinc/86/41/79/935864179.db2.gz DRBOIPSDGNAPNZ-GOSISDBHSA-N 0 0 373.453 3.544 20 5 FHBDRN Cc1c(CNC(=O)NC[C@@H]2CCC3(CCCCC3)O2)cccc1[N+](=O)[O-] ZINC000479592207 935865437 /nfs/dbraw/zinc/86/54/37/935865437.db2.gz MWLUWZYGRUNILF-INIZCTEOSA-N 0 0 361.442 3.584 20 5 FHBDRN CC(C)(C)SCCNC(=O)c1sc(Br)cc1[N+](=O)[O-] ZINC000277738295 935867139 /nfs/dbraw/zinc/86/71/39/935867139.db2.gz OXHZZKVSDVYESM-UHFFFAOYSA-N 0 0 367.290 3.680 20 5 FHBDRN CO[C@H](c1ccccc1Cl)[C@@H](C)NC(=O)c1csc([N+](=O)[O-])c1 ZINC000479658078 935872435 /nfs/dbraw/zinc/87/24/35/935872435.db2.gz REOMGIVVGVRBOE-OTYXRUKQSA-N 0 0 354.815 3.816 20 5 FHBDRN O=C(N[C@H]1COc2ccc(F)cc2C1)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000516693452 945130534 /nfs/dbraw/zinc/13/05/34/945130534.db2.gz RYKMQSSHEBXMIF-CYBMUJFWSA-N 0 0 372.377 3.682 20 5 FHBDRN Cc1ccc(CN(C)C(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)o1 ZINC000050551027 935888537 /nfs/dbraw/zinc/88/85/37/935888537.db2.gz BQEFVKICIBUFFZ-UHFFFAOYSA-N 0 0 357.391 3.892 20 5 FHBDRN C[C@@H](NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)c1ccccn1 ZINC000050551552 935888551 /nfs/dbraw/zinc/88/85/51/935888551.db2.gz IYWBZZRLZMNHAM-LLVKDONJSA-N 0 0 354.391 3.604 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C ZINC000121836348 935913900 /nfs/dbraw/zinc/91/39/00/935913900.db2.gz GSQCDWCVVLSODK-UHFFFAOYSA-N 0 0 374.309 3.589 20 5 FHBDRN CCCC[C@@H](NC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)C1CCC1 ZINC000158692036 935913951 /nfs/dbraw/zinc/91/39/51/935913951.db2.gz XGLVOQAQUJJUJM-MRXNPFEDSA-N 0 0 357.410 3.525 20 5 FHBDRN CCC(=O)c1ccc(N[C@@H](C)c2ccc3c(c2)NC(=O)CO3)c([N+](=O)[O-])c1 ZINC000479908769 935915639 /nfs/dbraw/zinc/91/56/39/935915639.db2.gz HSNYDYCQDTVDPL-NSHDSACASA-N 0 0 369.377 3.692 20 5 FHBDRN CC(=O)N1C=Cc2ccccc2[C@@H]1CC(=O)OCc1ccccc1[N+](=O)[O-] ZINC000024199399 935918133 /nfs/dbraw/zinc/91/81/33/935918133.db2.gz VJQJYOIZBXVHOL-IBGZPJMESA-N 0 0 366.373 3.602 20 5 FHBDRN CCC(=O)c1ccc(Nc2ccc(OC)c(NC(C)=O)c2)c([N+](=O)[O-])c1 ZINC000479940630 935921644 /nfs/dbraw/zinc/92/16/44/935921644.db2.gz OLSMIODGTZLIPN-UHFFFAOYSA-N 0 0 357.366 3.898 20 5 FHBDRN CC(C)OCc1ccccc1CNC(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000548748953 935923474 /nfs/dbraw/zinc/92/34/74/935923474.db2.gz MVJBMMIRQRZXPB-UHFFFAOYSA-N 0 0 371.437 3.562 20 5 FHBDRN CCOc1ccc(OC(C)(C)C(=O)Nc2cc(F)cc([N+](=O)[O-])c2)cc1 ZINC000548750434 935928751 /nfs/dbraw/zinc/92/87/51/935928751.db2.gz ZQAJPZHMBCNZEP-UHFFFAOYSA-N 0 0 362.357 3.929 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)NC[C@H](C[C@@H](C)O)c2ccccc2)c1 ZINC000159994200 935929878 /nfs/dbraw/zinc/92/98/78/935929878.db2.gz ANLUKSGQHOATDM-HIFRSBDPSA-N 0 0 374.462 3.601 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)N1C[C@H](C)c2ccccc21 ZINC000128066528 935931991 /nfs/dbraw/zinc/93/19/91/935931991.db2.gz NAHFUWWZQYQWNC-STQMWFEESA-N 0 0 355.394 3.554 20 5 FHBDRN CN(C[C@@H]1CCC[C@H]1O)C(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000128073684 935938512 /nfs/dbraw/zinc/93/85/12/935938512.db2.gz NKPOCPOIFLGIQJ-HNAYVOBHSA-N 0 0 369.421 3.571 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1F)N1CCC[C@]2(C1)OCc1ccccc12 ZINC000480016749 935944424 /nfs/dbraw/zinc/94/44/24/935944424.db2.gz OMYRWKKFFKDRQB-LJQANCHMSA-N 0 0 371.368 3.787 20 5 FHBDRN O=[N+]([O-])c1ccc2ncnc(NC[C@@H]3CCCO[C@H]3c3ccccc3)c2c1 ZINC000611708151 935950117 /nfs/dbraw/zinc/95/01/17/935950117.db2.gz KAKDHVLYFLGAAP-KXBFYZLASA-N 0 0 364.405 3.540 20 5 FHBDRN Cc1c(CNC(=O)N(CCC(F)(F)F)CC2CC2)cccc1[N+](=O)[O-] ZINC000480061604 935951963 /nfs/dbraw/zinc/95/19/63/935951963.db2.gz MSEJCJVTVLDOGV-UHFFFAOYSA-N 0 0 359.348 3.777 20 5 FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@H](C)CCC[C@H]1C ZINC000158742348 935954148 /nfs/dbraw/zinc/95/41/48/935954148.db2.gz UPNQPTKEDIKQLC-ZIAGYGMSSA-N 0 0 366.483 3.984 20 5 FHBDRN Cc1ccccc1C[C@H](C)NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000519114318 945135905 /nfs/dbraw/zinc/13/59/05/945135905.db2.gz LSWVLUOYMIVPKP-INIZCTEOSA-N 0 0 367.449 3.864 20 5 FHBDRN CCC(=O)c1ccc(N[C@H](C)c2cn(-c3ccccc3)nn2)c([N+](=O)[O-])c1 ZINC000480072921 935957072 /nfs/dbraw/zinc/95/70/72/935957072.db2.gz ZGDXAJZNLNTPNE-CYBMUJFWSA-N 0 0 365.393 3.941 20 5 FHBDRN O=C(Nc1nc2cc(C(F)(F)F)ccc2[nH]1)c1csc([N+](=O)[O-])c1 ZINC000178638526 935960676 /nfs/dbraw/zinc/96/06/76/935960676.db2.gz COSKURTWTZNYEN-UHFFFAOYSA-N 0 0 356.285 3.804 20 5 FHBDRN Cc1ccc(C)n1C1CCN(c2ncnc3ccc([N+](=O)[O-])cc32)CC1 ZINC000611710683 935962690 /nfs/dbraw/zinc/96/26/90/935962690.db2.gz LUUIZGYGBOYFAQ-UHFFFAOYSA-N 0 0 351.410 3.798 20 5 FHBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)OCc1noc(-c2ccc(F)cc2)n1 ZINC000255527777 935969766 /nfs/dbraw/zinc/96/97/66/935969766.db2.gz 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CCOCc1ccc(NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000075358060 936009670 /nfs/dbraw/zinc/00/96/70/936009670.db2.gz YVJZTHSLMLXBEB-UHFFFAOYSA-N 0 0 366.377 3.569 20 5 FHBDRN CC(C)(C)[C@@H]1OCCC[C@@H]1CNC(=O)CSc1ccccc1[N+](=O)[O-] ZINC000118368279 936025437 /nfs/dbraw/zinc/02/54/37/936025437.db2.gz TZKAXARNGYWTBQ-CXAGYDPISA-N 0 0 366.483 3.644 20 5 FHBDRN O=C(OCc1nc(-c2ccccc2)no1)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000135622696 936031333 /nfs/dbraw/zinc/03/13/33/936031333.db2.gz ACBQGYVMRYVYIT-UHFFFAOYSA-N 0 0 359.725 3.655 20 5 FHBDRN O=[N+]([O-])c1ccc2ncnc(N(Cc3cccc(O)c3)CC3CC3)c2c1 ZINC000611712075 936040341 /nfs/dbraw/zinc/04/03/41/936040341.db2.gz VVLDQRMBMXZDDA-UHFFFAOYSA-N 0 0 350.378 3.660 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2COc3c2ccc(C)c3C)c1 ZINC000077295520 936043961 /nfs/dbraw/zinc/04/39/61/936043961.db2.gz FRDWDIDTVRVGMO-HNNXBMFYSA-N 0 0 358.419 3.797 20 5 FHBDRN Cc1ccc(C)n1C1CCN(CC(=O)Nc2ccc([N+](=O)[O-])cc2C)CC1 ZINC000507322186 945141992 /nfs/dbraw/zinc/14/19/92/945141992.db2.gz AJPMRPILUHMRGP-UHFFFAOYSA-N 0 0 370.453 3.597 20 5 FHBDRN Cc1cccc(C)c1NC(=O)CN(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000135230012 936046490 /nfs/dbraw/zinc/04/64/90/936046490.db2.gz PHPNHXXTORCKSD-UHFFFAOYSA-N 0 0 353.422 3.815 20 5 FHBDRN COc1ccc(NC(=O)N(C[C@@H]2CCCO2)C2CCCC2)cc1[N+](=O)[O-] ZINC000611827080 936061352 /nfs/dbraw/zinc/06/13/52/936061352.db2.gz ZRSYOLFQXREWKT-HNNXBMFYSA-N 0 0 363.414 3.559 20 5 FHBDRN CC(C)C[C@H](Nc1ncnc2ccc([N+](=O)[O-])cc21)C(=O)OC(C)(C)C ZINC000611714337 936071616 /nfs/dbraw/zinc/07/16/16/936071616.db2.gz OVPPCKIILMFLNV-HNNXBMFYSA-N 0 0 360.414 3.706 20 5 FHBDRN CS[C@@H]1CCC[C@H](Nc2ccc([N+](=O)[O-])cc2N2CCOC2=O)C1 ZINC000078267269 936083331 /nfs/dbraw/zinc/08/33/31/936083331.db2.gz BXSIXTLKSZRSNB-WCQYABFASA-N 0 0 351.428 3.638 20 5 FHBDRN O=[N+]([O-])c1ccc(NC[C@@H](O)c2ccccc2Cl)cc1OC(F)F ZINC000078300113 936091929 /nfs/dbraw/zinc/09/19/29/936091929.db2.gz XAAZJRCXLKDVAL-CYBMUJFWSA-N 0 0 358.728 3.995 20 5 FHBDRN CC[C@@H](Nc1ccc(C(=O)c2nccn2C)cc1[N+](=O)[O-])c1ccncc1 ZINC000078306453 936097154 /nfs/dbraw/zinc/09/71/54/936097154.db2.gz IZLABTWRBAGPSZ-OAHLLOKOSA-N 0 0 365.393 3.518 20 5 FHBDRN CCN(Cc1c(F)cccc1F)C(=O)c1cc([N+](=O)[O-])c(F)cc1C ZINC001125626205 936110490 /nfs/dbraw/zinc/11/04/90/936110490.db2.gz GRUOJMMEDDKHAP-UHFFFAOYSA-N 0 0 352.312 3.983 20 5 FHBDRN Cc1cc(OCC(=O)N[C@@H]2C[C@H]2c2cccc(Cl)c2)ccc1[N+](=O)[O-] ZINC000437219723 945145864 /nfs/dbraw/zinc/14/58/64/945145864.db2.gz KLZVGBHLUBDUJL-JKSUJKDBSA-N 0 0 360.797 3.608 20 5 FHBDRN C[C@H](CNC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-])c1ccncc1 ZINC000612047669 936144605 /nfs/dbraw/zinc/14/46/05/936144605.db2.gz SMBILBZYGMOFOY-LLVKDONJSA-N 0 0 365.842 3.655 20 5 FHBDRN CCN(CC(=O)Nc1c(C)cccc1C)c1ncc([N+](=O)[O-])cc1Cl ZINC000078412104 936149166 /nfs/dbraw/zinc/14/91/66/936149166.db2.gz REXIFYPJEMKTSG-UHFFFAOYSA-N 0 0 362.817 3.725 20 5 FHBDRN Cc1cnccc1OC1CCN(C(=O)Nc2ccc([N+](=O)[O-])c(C)c2)CC1 ZINC000277909204 936149751 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O=C(c1ccc(F)c(C(F)(F)F)c1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000519137309 945148275 /nfs/dbraw/zinc/14/82/75/945148275.db2.gz NQMJGTDCBAYANB-UHFFFAOYSA-N 0 0 354.259 3.956 20 5 FHBDRN CCn1cnnc1-c1cccc(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])c1 ZINC000121956489 936201178 /nfs/dbraw/zinc/20/11/78/936201178.db2.gz APAYSJHTDDJTJS-UHFFFAOYSA-N 0 0 371.784 3.779 20 5 FHBDRN CC(C)(C)C(C)(C)CNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-] ZINC000431496404 936206285 /nfs/dbraw/zinc/20/62/85/936206285.db2.gz SAVGIQHLNQLIPH-UHFFFAOYSA-N 0 0 363.458 3.551 20 5 FHBDRN Cc1cn2c(nc(C)c2-c2noc(-c3cc(C)cc([N+](=O)[O-])c3)n2)s1 ZINC000426546637 945150376 /nfs/dbraw/zinc/15/03/76/945150376.db2.gz BGIUBMRIXOKBPQ-UHFFFAOYSA-N 0 0 355.379 3.946 20 5 FHBDRN CCc1ccc(C(=O)N2CCC(c3ncc(C)s3)CC2)cc1[N+](=O)[O-] ZINC000277939035 936218686 /nfs/dbraw/zinc/21/86/86/936218686.db2.gz HXFVPMMNSWIKEN-UHFFFAOYSA-N 0 0 359.451 3.942 20 5 FHBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NCC(C)(C)C(F)(F)F ZINC000558704015 936227434 /nfs/dbraw/zinc/22/74/34/936227434.db2.gz SJSOISTXYRCRAF-QMMMGPOBSA-N 0 0 368.739 3.720 20 5 FHBDRN COc1ccc([C@@H](Nc2ncc(Cl)cc2[N+](=O)[O-])c2nccn2C)cc1 ZINC000153539686 936252208 /nfs/dbraw/zinc/25/22/08/936252208.db2.gz PVJWUPXPRBJLHA-OAHLLOKOSA-N 0 0 373.800 3.587 20 5 FHBDRN C[C@@H](C(=O)N1CCc2c(F)cc(F)cc2C1)c1ccc([N+](=O)[O-])cc1F ZINC000612482159 936256086 /nfs/dbraw/zinc/25/60/86/936256086.db2.gz ZZHMVVOZMLKOCQ-SNVBAGLBSA-N 0 0 364.323 3.701 20 5 FHBDRN C[C@H]1CSCCN(c2cc(C(F)(F)C(F)(F)F)ncc2[N+](=O)[O-])C1 ZINC000582885171 936258727 /nfs/dbraw/zinc/25/87/27/936258727.db2.gz UDIDWRCAPPHBBK-MRVPVSSYSA-N 0 0 371.331 3.833 20 5 FHBDRN O=C(NCc1ccc(N2CCCCC2)nc1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000047417656 945154557 /nfs/dbraw/zinc/15/45/57/945154557.db2.gz HIVZQZLRAOCOIG-UHFFFAOYSA-N 0 0 374.828 3.564 20 5 FHBDRN COc1ccc(-n2ccc(CN[C@@H](C)c3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000178712838 936279572 /nfs/dbraw/zinc/27/95/72/936279572.db2.gz LFFZZQGSPMFUBQ-AWEZNQCLSA-N 0 0 352.394 3.640 20 5 FHBDRN Cc1nccn1-c1ccccc1CNC(=O)Nc1ccc([N+](=O)[O-])cc1F ZINC000612611303 936283097 /nfs/dbraw/zinc/28/30/97/936283097.db2.gz IRWBLRUITJMHMH-UHFFFAOYSA-N 0 0 369.356 3.550 20 5 FHBDRN CCO[C@@H](C)c1nc(CN(C)c2cc([N+](=O)[O-])ccc2C(C)=O)cs1 ZINC000582926427 936299378 /nfs/dbraw/zinc/29/93/78/936299378.db2.gz LLHDYQQQVFDFES-LBPRGKRZSA-N 0 0 363.439 3.988 20 5 FHBDRN C[C@@H]1C[C@H](c2noc(CCOc3ccc(Cl)cc3[N+](=O)[O-])n2)CCO1 ZINC000545102245 936309305 /nfs/dbraw/zinc/30/93/05/936309305.db2.gz YJZGGCIAIUUMCL-GHMZBOCLSA-N 0 0 367.789 3.535 20 5 FHBDRN CC(C)[C@H](O)C(C)(C)CNC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000178878875 938250044 /nfs/dbraw/zinc/25/00/44/938250044.db2.gz HBOBGOFRWPVWBU-HNNXBMFYSA-N 0 0 350.440 3.582 20 5 FHBDRN CC(C)(C(=O)NC[C@@H]1CSc2ccccc2O1)c1ccc([N+](=O)[O-])cc1 ZINC000583441958 938255423 /nfs/dbraw/zinc/25/54/23/938255423.db2.gz NKDUDZYZEDUDJV-OAHLLOKOSA-N 0 0 372.446 3.542 20 5 FHBDRN CCc1nn(C)c(N[C@@H](c2cccc(C)c2)c2ccccn2)c1[N+](=O)[O-] ZINC000091680091 938255975 /nfs/dbraw/zinc/25/59/75/938255975.db2.gz BRQZHZJLVINDDR-KRWDZBQOSA-N 0 0 351.410 3.796 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)N(C)[C@H](C)c2cccc(C(F)(F)F)c2)n1 ZINC000427176931 945161557 /nfs/dbraw/zinc/16/15/57/945161557.db2.gz WSARVRWGGBRNOP-SNVBAGLBSA-N 0 0 370.331 3.663 20 5 FHBDRN C[C@@H](O)CC(C)(C)CNC(=O)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000278268183 938264998 /nfs/dbraw/zinc/26/49/98/938264998.db2.gz XZFORUUMTYKTNO-CYBMUJFWSA-N 0 0 352.434 3.621 20 5 FHBDRN O=C(N1CCc2c(cccc2[N+](=O)[O-])C1)C1(c2ccccc2)CCCC1 ZINC000536042867 938272183 /nfs/dbraw/zinc/27/21/83/938272183.db2.gz BCRSKGZDSVITDJ-UHFFFAOYSA-N 0 0 350.418 3.992 20 5 FHBDRN Cc1nn(C)c(C)c1[C@@H](NCc1cccc([N+](=O)[O-])c1C)C(F)(F)F ZINC000536050596 938277822 /nfs/dbraw/zinc/27/78/22/938277822.db2.gz NTKKVXDSUNSUNV-OAHLLOKOSA-N 0 0 356.348 3.647 20 5 FHBDRN Cc1nn(C)c(C)c1[C@H](NCc1cccc([N+](=O)[O-])c1C)C(F)(F)F ZINC000536050593 938277849 /nfs/dbraw/zinc/27/78/49/938277849.db2.gz NTKKVXDSUNSUNV-HNNXBMFYSA-N 0 0 356.348 3.647 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCc2c1cccc2O ZINC000080459073 938278946 /nfs/dbraw/zinc/27/89/46/938278946.db2.gz LKAARILMIUBXQC-GOSISDBHSA-N 0 0 369.421 3.908 20 5 FHBDRN Cc1cc(C)c(S(=O)(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)s1 ZINC000431533377 938281905 /nfs/dbraw/zinc/28/19/05/938281905.db2.gz RFSUIECHQACISN-UHFFFAOYSA-N 0 0 366.464 3.626 20 5 FHBDRN O=c1sc2c(n1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)CCCC2 ZINC000583512281 938284851 /nfs/dbraw/zinc/28/48/51/938284851.db2.gz CJEDKLJWDIAXAM-UHFFFAOYSA-N 0 0 358.341 3.764 20 5 FHBDRN Cc1cc(NC(=O)c2ccccc2-n2cccn2)c2cc([N+](=O)[O-])ccc2n1 ZINC000161752968 938290283 /nfs/dbraw/zinc/29/02/83/938290283.db2.gz OTUPRMLWWMOMEN-UHFFFAOYSA-N 0 0 373.372 3.889 20 5 FHBDRN C[C@@H](Nc1ccc([N+](=O)[O-])cc1F)c1ccc(OCC(=O)NC2CC2)cc1 ZINC000052411583 938291567 /nfs/dbraw/zinc/29/15/67/938291567.db2.gz LNDNSBYGSDPOCS-GFCCVEGCSA-N 0 0 373.384 3.564 20 5 FHBDRN Cc1ccc(OCCCC(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)cc1C ZINC000536061602 938292851 /nfs/dbraw/zinc/29/28/51/938292851.db2.gz CYZUOYVSLPAVFE-UHFFFAOYSA-N 0 0 368.433 3.956 20 5 FHBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)N1CC(c2ccc(Cl)cc2)C1 ZINC000458590919 938304450 /nfs/dbraw/zinc/30/44/50/938304450.db2.gz SDDLSVULZLNGNL-UHFFFAOYSA-N 0 0 359.813 3.600 20 5 FHBDRN C[C@@H](NS(=O)(=O)CCc1ccc([N+](=O)[O-])cc1)c1cc2ccccc2o1 ZINC000178934947 938319513 /nfs/dbraw/zinc/31/95/13/938319513.db2.gz QQDGKCZDTWSLLA-CYBMUJFWSA-N 0 0 374.418 3.564 20 5 FHBDRN COc1ccc([C@@H](C)N(C)C(=O)NCCc2ccccc2[N+](=O)[O-])cc1 ZINC000075109369 938331026 /nfs/dbraw/zinc/33/10/26/938331026.db2.gz ISMXKKGUHLYDHF-CQSZACIVSA-N 0 0 357.410 3.549 20 5 FHBDRN O=C(NCCCc1c[nH]c2ccccc12)NCCc1ccccc1[N+](=O)[O-] ZINC000075109025 938331368 /nfs/dbraw/zinc/33/13/68/938331368.db2.gz OVMKOIFMUALKCM-UHFFFAOYSA-N 0 0 366.421 3.551 20 5 FHBDRN C[C@@H](NC(=O)N1CCOC[C@H]1c1ccc(F)cc1)c1ccccc1[N+](=O)[O-] ZINC000458624357 938337334 /nfs/dbraw/zinc/33/73/34/938337334.db2.gz RONCFGGRLQHSRV-ACJLOTCBSA-N 0 0 373.384 3.578 20 5 FHBDRN COc1ccc(C[C@H](C)CNC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000536097197 938349106 /nfs/dbraw/zinc/34/91/06/938349106.db2.gz ZOUVZSCIZWOIFQ-LSDHHAIUSA-N 0 0 371.437 3.842 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N1CC[C@@H](c2ccc(OC)cc2)C1 ZINC000536100243 938353380 /nfs/dbraw/zinc/35/33/80/938353380.db2.gz TVOANEFKGAAWDZ-OAHLLOKOSA-N 0 0 370.405 3.632 20 5 FHBDRN Cc1ncc(/C=C\C(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)s1 ZINC000255575412 938355834 /nfs/dbraw/zinc/35/58/34/938355834.db2.gz QVGWEKNLHNXOOV-HYXAFXHYSA-N 0 0 368.212 3.774 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)N[C@H]2CCC[C@H](C(C)C)CC2)cc1F ZINC001211593930 938360406 /nfs/dbraw/zinc/36/04/06/938360406.db2.gz AOENIUFIKXOGAW-KBPBESRZSA-N 0 0 372.462 3.926 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)NCCCc1c[nH]c2ccccc12 ZINC000536102229 938361728 /nfs/dbraw/zinc/36/17/28/938361728.db2.gz FEXFOLKGKSSOCB-UHFFFAOYSA-N 0 0 367.405 3.837 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1Cl)N1CCO[C@H](c2ccsc2)C1 ZINC000163391729 938364562 /nfs/dbraw/zinc/36/45/62/938364562.db2.gz QDWPZSCFVRUXFS-AWEZNQCLSA-N 0 0 352.799 3.523 20 5 FHBDRN COC(=O)c1ccc(CNc2ccc3cc([N+](=O)[O-])ccc3n2)cc1OC ZINC000157414155 938368639 /nfs/dbraw/zinc/36/86/39/938368639.db2.gz OWBVBUDAFTYLHB-UHFFFAOYSA-N 0 0 367.361 3.550 20 5 FHBDRN CC(=O)c1ccc([N-]S(=O)(=O)c2c(C)cc([N+](=O)[O-])cc2C)cc1C ZINC000536114677 938382998 /nfs/dbraw/zinc/38/29/98/938382998.db2.gz ROSSZOXWZGBFSQ-UHFFFAOYSA-N 0 0 362.407 3.523 20 5 FHBDRN COCC1CCN(c2cc(C(F)(F)C(F)(F)F)ncc2[N+](=O)[O-])CC1 ZINC000278414413 938399031 /nfs/dbraw/zinc/39/90/31/938399031.db2.gz HZWTVOFPTFTLTB-UHFFFAOYSA-N 0 0 369.290 3.507 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)NCC(C)(C)c1ncccc1C ZINC000583782399 938406725 /nfs/dbraw/zinc/40/67/25/938406725.db2.gz JVEFEPHFGSINEJ-UHFFFAOYSA-N 0 0 356.426 3.960 20 5 FHBDRN CSc1ccc(N(C)S(=O)(=O)c2c(C)ccc(C)c2[N+](=O)[O-])cc1 ZINC000480208574 938416759 /nfs/dbraw/zinc/41/67/59/938416759.db2.gz JIKXMGNRHHMCFM-UHFFFAOYSA-N 0 0 366.464 3.759 20 5 FHBDRN Cc1ccccc1[C@H](C)NC(=O)[C@@H](C)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000046599520 938430988 /nfs/dbraw/zinc/43/09/88/938430988.db2.gz XBUPCUFPOJMAEJ-JKSUJKDBSA-N 0 0 355.438 3.601 20 5 FHBDRN CC(C)c1nn(C)cc1-c1noc([C@H](C)c2ccc([N+](=O)[O-])cc2F)n1 ZINC000426211756 945173932 /nfs/dbraw/zinc/17/39/32/945173932.db2.gz DHHJHOFPYIQGGF-SNVBAGLBSA-N 0 0 359.361 3.793 20 5 FHBDRN O=C(c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1)N1CCCSCC1 ZINC000507376476 945174063 /nfs/dbraw/zinc/17/40/63/945174063.db2.gz TXLJPDUHJJSBAZ-UHFFFAOYSA-N 0 0 357.435 3.918 20 5 FHBDRN Cc1cc(CN(C)C(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)no1 ZINC000052606824 938433972 /nfs/dbraw/zinc/43/39/72/938433972.db2.gz MGPNLGHFTRIWME-UHFFFAOYSA-N 0 0 367.361 3.956 20 5 FHBDRN O=C(NCCSCc1ccccc1F)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000052610240 938434976 /nfs/dbraw/zinc/43/49/76/938434976.db2.gz QKBDTPSCNBZRLC-UHFFFAOYSA-N 0 0 373.409 3.878 20 5 FHBDRN C[C@H](CCc1ccccc1[N+](=O)[O-])Nc1ccc2c(c1)N(C(N)=O)CCC2 ZINC000426554548 945175059 /nfs/dbraw/zinc/17/50/59/945175059.db2.gz VXLPDCTTZGPYOV-CQSZACIVSA-N 0 0 368.437 3.859 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)Nc2cc(C)c(OC)cc2C)cc1OC ZINC000278471745 938459928 /nfs/dbraw/zinc/45/99/28/938459928.db2.gz UNABJXGDCTTYTR-UHFFFAOYSA-N 0 0 374.393 3.880 20 5 FHBDRN O=[N+]([O-])c1cccc2c(N3CCC(c4noc(C5CC5)n4)CC3)ccnc21 ZINC000432140430 945176871 /nfs/dbraw/zinc/17/68/71/945176871.db2.gz QGOKWAYEAREVQD-UHFFFAOYSA-N 0 0 365.393 3.787 20 5 FHBDRN CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H](CO)c1ccc(F)cc1 ZINC000583888331 938467570 /nfs/dbraw/zinc/46/75/70/938467570.db2.gz IDYCSYZOSGKQGG-HZPDHXFCSA-N 0 0 364.442 3.928 20 5 FHBDRN C[C@@H]1CSC[C@H]1NC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000583922740 938488187 /nfs/dbraw/zinc/48/81/87/938488187.db2.gz AFZLPMNXTKJDQA-CXAGYDPISA-N 0 0 371.462 3.688 20 5 FHBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)Nc1ccc(OC(F)(F)F)cc1 ZINC000536163502 938490721 /nfs/dbraw/zinc/49/07/21/938490721.db2.gz SVGPNUPWEZQYRX-UHFFFAOYSA-N 0 0 369.299 3.858 20 5 FHBDRN Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)Nc1ccc([N+](=O)[O-])c(C)n1 ZINC000302075581 938502057 /nfs/dbraw/zinc/50/20/57/938502057.db2.gz VYVBAEJLNCJIMF-VIFPVBQESA-N 0 0 357.336 3.847 20 5 FHBDRN CCC(CC)N(CC)C(=O)CSCc1ccc(OC)c([N+](=O)[O-])c1 ZINC000583960095 938505145 /nfs/dbraw/zinc/50/51/45/938505145.db2.gz IEDYOAMGLSXYHV-UHFFFAOYSA-N 0 0 354.472 3.874 20 5 FHBDRN O=[N+]([O-])c1cc2c(ncnc2NCCc2cccc(C(F)(F)F)n2)s1 ZINC000432140881 945183835 /nfs/dbraw/zinc/18/38/35/945183835.db2.gz YGMGSAMHTZTWKB-UHFFFAOYSA-N 0 0 369.328 3.668 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@@H]1CCc2ccc(C(C)C)cc21 ZINC001211606800 938540490 /nfs/dbraw/zinc/54/04/90/938540490.db2.gz YITZBJBICVDENU-GOSISDBHSA-N 0 0 374.462 3.992 20 5 FHBDRN COc1cccc(C(=O)N[C@H]2C[C@H](c3ccccc3Cl)C2)c1[N+](=O)[O-] ZINC000584015755 938545216 /nfs/dbraw/zinc/54/52/16/938545216.db2.gz VXGYKMICKAFRGU-HAQNSBGRSA-N 0 0 360.797 3.933 20 5 FHBDRN CCOC[C@H]1CCN(c2cc(C(F)(F)C(F)(F)F)ncc2[N+](=O)[O-])C1 ZINC000278578830 938550712 /nfs/dbraw/zinc/55/07/12/938550712.db2.gz XYKFTEAFFBIDEO-VIFPVBQESA-N 0 0 369.290 3.507 20 5 FHBDRN CC(C)[C@H](CNC(=O)NCCc1cccc([N+](=O)[O-])c1)Nc1ccccc1 ZINC000536201258 938566144 /nfs/dbraw/zinc/56/61/44/938566144.db2.gz MRJAPKGJAZHPDH-IBGZPJMESA-N 0 0 370.453 3.573 20 5 FHBDRN COc1ccc(C[C@H](C)CNc2ncnc3sc([N+](=O)[O-])cc32)cc1 ZINC000584044597 938568436 /nfs/dbraw/zinc/56/84/36/938568436.db2.gz JHVKYQUUXPNEDM-NSHDSACASA-N 0 0 358.423 3.899 20 5 FHBDRN Cc1csc(NC2CCN(C/C=C/c3ccccc3[N+](=O)[O-])CC2)n1 ZINC000473076544 945186952 /nfs/dbraw/zinc/18/69/52/945186952.db2.gz SSRRCMAUYDKIMG-GQCTYLIASA-N 0 0 358.467 3.949 20 5 FHBDRN Cc1ccc(S(=O)(=O)N[C@@H](c2ccco2)c2ccccc2)cc1[N+](=O)[O-] ZINC000052782410 938579396 /nfs/dbraw/zinc/57/93/96/938579396.db2.gz DGMYNEOUQYZTDJ-GOSISDBHSA-N 0 0 372.402 3.564 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N2CCC3(CC2)C(F)(F)C3(F)F)c1C ZINC000892368204 938582093 /nfs/dbraw/zinc/58/20/93/938582093.db2.gz UXFHWBOVCLYHAO-UHFFFAOYSA-N 0 0 360.307 3.718 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)c2cn(C)nc2-c2cccs2)cc1[N+](=O)[O-] ZINC000158809235 938589050 /nfs/dbraw/zinc/58/90/50/938589050.db2.gz BMQNVZNXZXFICO-GFCCVEGCSA-N 0 0 370.434 3.856 20 5 FHBDRN Cc1nn(C(F)F)c(C)c1CC(=O)Nc1cc([N+](=O)[O-])c(Cl)cc1C ZINC000135496885 938598137 /nfs/dbraw/zinc/59/81/37/938598137.db2.gz YKPBJKZPFACOTJ-UHFFFAOYSA-N 0 0 372.759 3.946 20 5 FHBDRN CCN(Cc1ccoc1)C(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000102281446 938639126 /nfs/dbraw/zinc/63/91/26/938639126.db2.gz ZGXFLMQROPIYET-LLVKDONJSA-N 0 0 352.774 3.657 20 5 FHBDRN CC[C@@H](CNC(=O)c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1)OC ZINC000584203850 938639570 /nfs/dbraw/zinc/63/95/70/938639570.db2.gz GBFOQYKVTKCNEL-HNNXBMFYSA-N 0 0 360.435 3.901 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)OC/C=C\c2cccc(C(F)(F)F)c2)n1 ZINC000588590036 938647731 /nfs/dbraw/zinc/64/77/31/938647731.db2.gz UISABEMKGUJFOC-XQRVVYSFSA-N 0 0 369.299 3.700 20 5 FHBDRN CCOc1cc(NC(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)ccc1OC ZINC000124232851 945193163 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FHBDRN O=C(NCCNc1ccc([N+](=O)[O-])cc1)N[C@@H]1C[C@H]1c1ccc(Cl)cc1 ZINC000437987629 945203319 /nfs/dbraw/zinc/20/33/19/945203319.db2.gz PCNOHIJNYOOLHH-DLBZAZTESA-N 0 0 374.828 3.515 20 5 FHBDRN C[C@H](c1ccccc1)[C@H](C)NC(=O)N1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000584383633 938786827 /nfs/dbraw/zinc/78/68/27/938786827.db2.gz IUDJMIHRGNWOTH-GJZGRUSLSA-N 0 0 369.421 3.691 20 5 FHBDRN CC(C)Oc1c(Cl)cccc1NCc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000118386792 938804287 /nfs/dbraw/zinc/80/42/87/938804287.db2.gz XUOZHMUWSHXXMB-UHFFFAOYSA-N 0 0 363.801 3.746 20 5 FHBDRN CCS[C@H]1CCCC[C@@H]1NC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000427210890 945205719 /nfs/dbraw/zinc/20/57/19/945205719.db2.gz FBHQDGAKGBGUJA-RDJZCZTQSA-N 0 0 361.467 3.730 20 5 FHBDRN Cc1cccc([C@@H]2CCCN2S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)c1 ZINC000056140543 938811954 /nfs/dbraw/zinc/81/19/54/938811954.db2.gz HDZDGNMTJHTUFA-INIZCTEOSA-N 0 0 364.398 3.568 20 5 FHBDRN COc1cccc(Br)c1OCCc1ccc([N+](=O)[O-])cc1 ZINC000440072009 945206530 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FHBDRN COc1cc(Cl)c(NC(=O)COc2ccc([N+](=O)[O-])cc2)cc1C ZINC000584435591 938875840 /nfs/dbraw/zinc/87/58/40/938875840.db2.gz OZNKXLFYSNEMMD-UHFFFAOYSA-N 0 0 350.758 3.583 20 5 FHBDRN CCOc1cc(N[C@@H]2CCCN(Cc3ccccc3)C2=O)ccc1[N+](=O)[O-] ZINC000090147781 938877840 /nfs/dbraw/zinc/87/78/40/938877840.db2.gz RVDLJMBDHICMDS-QGZVFWFLSA-N 0 0 369.421 3.597 20 5 FHBDRN CC(C)c1ccc(C(=O)NCCc2ccc3c(c2)CCO3)cc1[N+](=O)[O-] ZINC000473596876 945212099 /nfs/dbraw/zinc/21/20/99/945212099.db2.gz FADKUNOALHGSTI-UHFFFAOYSA-N 0 0 354.406 3.626 20 5 FHBDRN O=[N+]([O-])c1ccc([O-])cc1C[NH+]1CCC(c2c[nH]c3ncccc23)CC1 ZINC000091955044 938909039 /nfs/dbraw/zinc/90/90/39/938909039.db2.gz AZBLHGDMSNCZDD-UHFFFAOYSA-N 0 0 352.394 3.556 20 5 FHBDRN O=C1CCc2cc([N+](=O)[O-])c(N(CCC(F)(F)F)CC3CC3)cc2N1 ZINC000176855070 938923148 /nfs/dbraw/zinc/92/31/48/938923148.db2.gz ASFWNGHZNOHGNC-UHFFFAOYSA-N 0 0 357.332 3.648 20 5 FHBDRN Cc1nc(-c2ccc(NC(=O)c3cc(C)ccc3[N+](=O)[O-])cc2Cl)n[nH]1 ZINC000124299288 945217552 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FHBDRN Cc1cc(C)cc(N(C)C(=O)COc2ccc([N+](=O)[O-])c3cccnc23)c1 ZINC000431557167 938966803 /nfs/dbraw/zinc/96/68/03/938966803.db2.gz DWSUOUCAEPYKGK-UHFFFAOYSA-N 0 0 365.389 3.802 20 5 FHBDRN CC(C)[C@@H]1N(C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)CC1(C)C ZINC000480550916 938971399 /nfs/dbraw/zinc/97/13/99/938971399.db2.gz XYMCZWOXMKWRAH-SFHVURJKSA-N 0 0 359.470 3.704 20 5 FHBDRN O=C(c1cc(-c2ccc(F)cc2)on1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000135580223 938977197 /nfs/dbraw/zinc/97/71/97/938977197.db2.gz XZQUMTYXWJDKPD-UHFFFAOYSA-N 0 0 367.336 3.587 20 5 FHBDRN CC(C)(C)OC1CC(CCNC(=O)Nc2ccc([N+](=O)[O-])cc2F)C1 ZINC000431569863 938977215 /nfs/dbraw/zinc/97/72/15/938977215.db2.gz KCMZMMSCWQEJDU-UHFFFAOYSA-N 0 0 353.394 3.839 20 5 FHBDRN COc1ccc(CC(=O)N[C@H](C)c2ccccc2SC)cc1[N+](=O)[O-] ZINC000548835215 938979062 /nfs/dbraw/zinc/97/90/62/938979062.db2.gz SXRCSPIKMROTOB-GFCCVEGCSA-N 0 0 360.435 3.745 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CCc3cc(Br)cc(F)c3C2)s1 ZINC000409640992 938979525 /nfs/dbraw/zinc/97/95/25/938979525.db2.gz XAQPXMBQOUVIAR-UHFFFAOYSA-N 0 0 358.192 3.516 20 5 FHBDRN CC(C)Oc1ccc(F)cc1NC(=O)Cc1ccc(F)cc1[N+](=O)[O-] ZINC001125721711 938980902 /nfs/dbraw/zinc/98/09/02/938980902.db2.gz JCQYFHZQCRHATP-UHFFFAOYSA-N 0 0 350.321 3.841 20 5 FHBDRN O=C(CSc1ccccc1[N+](=O)[O-])N[C@H](Cc1ccccc1)C1CC1 ZINC000135603768 938981669 /nfs/dbraw/zinc/98/16/69/938981669.db2.gz DSKBVXHIBCYSMP-MRXNPFEDSA-N 0 0 356.447 3.824 20 5 FHBDRN CC(C)CCN(C(=O)COc1ccc([N+](=O)[O-])c2cccnc12)C1CC1 ZINC000431585048 938984781 /nfs/dbraw/zinc/98/47/81/938984781.db2.gz XXZUNRHQXNLESI-UHFFFAOYSA-N 0 0 357.410 3.559 20 5 FHBDRN CCn1nc(C)c([N+](=O)[O-])c1N1CC[C@](F)(c2cc(C)cc(F)c2)C1 ZINC000409660191 938986039 /nfs/dbraw/zinc/98/60/39/938986039.db2.gz GHYWYMNSRYWAQF-QGZVFWFLSA-N 0 0 350.369 3.642 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(O[C@H]2CCCC[C@@H]2O)cc1 ZINC000135665307 938987576 /nfs/dbraw/zinc/98/75/76/938987576.db2.gz UHOLWOJKFKLFPJ-OALUTQOASA-N 0 0 370.405 3.838 20 5 FHBDRN Cc1c(NS(=O)(=O)/C=C/c2ccccc2Cl)cccc1[N+](=O)[O-] ZINC000135687369 938989204 /nfs/dbraw/zinc/98/92/04/938989204.db2.gz SHYGQUPFCJYDPW-MDZDMXLPSA-N 0 0 352.799 3.969 20 5 FHBDRN Cc1cc(C)cc(OCCNC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)c1 ZINC000065700526 938990247 /nfs/dbraw/zinc/99/02/47/938990247.db2.gz RCUMLRDLZDCZIB-UHFFFAOYSA-N 0 0 369.421 3.595 20 5 FHBDRN Cc1cc(F)cc(C(=O)N2CCc3[nH]c4ccccc4c3C2)c1[N+](=O)[O-] ZINC000176910563 938993408 /nfs/dbraw/zinc/99/34/08/938993408.db2.gz YUMPHCUPTRCYQH-UHFFFAOYSA-N 0 0 353.353 3.722 20 5 FHBDRN C[C@H](NC(=O)NCCc1cc2ccccc2[nH]1)c1cccc([N+](=O)[O-])c1 ZINC000136107582 938993959 /nfs/dbraw/zinc/99/39/59/938993959.db2.gz QZTCKZGUMDKTKP-ZDUSSCGKSA-N 0 0 352.394 3.679 20 5 FHBDRN CCC1(CC)CN(C(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)CCS1 ZINC000466916762 938994125 /nfs/dbraw/zinc/99/41/25/938994125.db2.gz KPINXXZJDASBFC-UHFFFAOYSA-N 0 0 353.444 3.743 20 5 FHBDRN C[C@@H](c1ccc(F)c(F)c1)N(C)C(=O)CSc1ncccc1[N+](=O)[O-] ZINC000120436977 938995026 /nfs/dbraw/zinc/99/50/26/938995026.db2.gz NARBSAWODIFCAO-JTQLQIEISA-N 0 0 367.377 3.580 20 5 FHBDRN O=C(Nc1ccc2cc([N+](=O)[O-])ccc2n1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000176921142 938996029 /nfs/dbraw/zinc/99/60/29/938996029.db2.gz CWPLNFGQYKKBRT-UHFFFAOYSA-N 0 0 372.724 3.957 20 5 FHBDRN O=C(Nc1ccc2cc([N+](=O)[O-])ccc2n1)c1cc([N+](=O)[O-])ccc1Cl ZINC000176921309 938996032 /nfs/dbraw/zinc/99/60/32/938996032.db2.gz QZLKKXFFAGMDAB-UHFFFAOYSA-N 0 0 372.724 3.957 20 5 FHBDRN O=[N+]([O-])c1cccc2ncnc(Oc3cccc(Oc4cnccn4)c3)c21 ZINC000480578556 938996284 /nfs/dbraw/zinc/99/62/84/938996284.db2.gz NSMDJGIAFSDTMG-UHFFFAOYSA-N 0 0 361.317 3.913 20 5 FHBDRN COc1ccc(Cl)cc1NC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000065711741 938996834 /nfs/dbraw/zinc/99/68/34/938996834.db2.gz YDSOPTGKMMFIFA-UHFFFAOYSA-N 0 0 359.769 3.850 20 5 FHBDRN CC(=O)Nc1ccc(S[C@H](C)C(=O)N(C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000128279930 938998323 /nfs/dbraw/zinc/99/83/23/938998323.db2.gz ZZBMNAVYRRFODL-GFCCVEGCSA-N 0 0 373.434 3.697 20 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O=[N+]([O-])c1ccc(CN2CCN(c3ccc(Cl)cn3)CC2)c(Cl)c1 ZINC000543857916 939943428 /nfs/dbraw/zinc/94/34/28/939943428.db2.gz RBPDSULGARCBST-UHFFFAOYSA-N 0 0 367.236 3.619 20 5 FHBDRN CC[C@H](CSC)N(C)C(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000410661502 939943837 /nfs/dbraw/zinc/94/38/37/939943837.db2.gz JBXNYDDAPJMEAM-SECBINFHSA-N 0 0 350.362 3.827 20 5 FHBDRN CC[C@@H](CSC)N(C)C(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000410661505 939943882 /nfs/dbraw/zinc/94/38/82/939943882.db2.gz JBXNYDDAPJMEAM-VIFPVBQESA-N 0 0 350.362 3.827 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)Nc1cc(Cc2ccccc2)ccc1O ZINC000179807835 939944789 /nfs/dbraw/zinc/94/47/89/939944789.db2.gz UTONUJHUWICRIM-UHFFFAOYSA-N 0 0 363.373 3.847 20 5 FHBDRN Cc1ccc(C(C)(C)NC(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)cn1 ZINC000410714212 939944824 /nfs/dbraw/zinc/94/48/24/939944824.db2.gz SOAWOEQEHABUSY-UHFFFAOYSA-N 0 0 367.327 3.982 20 5 FHBDRN Cc1n[nH]cc1C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 ZINC000375825210 939945131 /nfs/dbraw/zinc/94/51/31/939945131.db2.gz PRUBFVZAQTWWKR-UHFFFAOYSA-N 0 0 370.434 3.861 20 5 FHBDRN Cc1cc(=O)[nH]c(-c2cccc(NC(=O)c3ccc([N+](=O)[O-])cc3C)c2)n1 ZINC000364486614 939947796 /nfs/dbraw/zinc/94/77/96/939947796.db2.gz UOZWFBWRLRLPCV-UHFFFAOYSA-N 0 0 364.361 3.627 20 5 FHBDRN C[C@@H](c1c(F)cccc1F)N(C)C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000480621572 939948259 /nfs/dbraw/zinc/94/82/59/939948259.db2.gz JNBFXDHAGPQREE-VIFPVBQESA-N 0 0 360.320 3.583 20 5 FHBDRN O=C(Cc1c[nH]c2ccc(Cl)cc12)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000062157925 939948783 /nfs/dbraw/zinc/94/87/83/939948783.db2.gz XXTREVQUEMYJHG-UHFFFAOYSA-N 0 0 355.781 3.861 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N(C)CCCc2ccccc2)cc1OC ZINC000046639263 939950078 /nfs/dbraw/zinc/95/00/78/939950078.db2.gz QXHZDOWJKKHEHM-UHFFFAOYSA-N 0 0 372.421 3.707 20 5 FHBDRN CSc1cccc(C(=O)N2CCC[C@H](C[C@@H]3CCOC3)C2)c1[N+](=O)[O-] ZINC000364484052 939951379 /nfs/dbraw/zinc/95/13/79/939951379.db2.gz FEIHEPSREIRQQZ-KGLIPLIRSA-N 0 0 364.467 3.596 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N[C@@H]1C[C@H](CO)c2ccccc21 ZINC000364518528 939955440 /nfs/dbraw/zinc/95/54/40/939955440.db2.gz PYIUCCVWMLNUSG-CXAGYDPISA-N 0 0 355.394 3.554 20 5 FHBDRN Cc1nc2cc(NC(=O)c3c(C)cc(C)c([N+](=O)[O-])c3C)ccc2n1C ZINC000091985918 939957762 /nfs/dbraw/zinc/95/77/62/939957762.db2.gz BNOLWMVNILZTAD-UHFFFAOYSA-N 0 0 352.394 3.967 20 5 FHBDRN COCC[C@@H](Nc1ncc([N+](=O)[O-])cc1Br)c1ccc(C)o1 ZINC000540870491 939962708 /nfs/dbraw/zinc/96/27/08/939962708.db2.gz BEXKKYNUDCIGEF-GFCCVEGCSA-N 0 0 370.203 3.843 20 5 FHBDRN CCCN(C(=O)Cc1c(C)nn(C(C)C)c1C)c1cccc([N+](=O)[O-])c1 ZINC000410822647 939962715 /nfs/dbraw/zinc/96/27/15/939962715.db2.gz OJDYWWYVNXXKQM-UHFFFAOYSA-N 0 0 358.442 3.975 20 5 FHBDRN CCCN(C(=O)[C@H]1CCN(c2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000410825937 939962805 /nfs/dbraw/zinc/96/28/05/939962805.db2.gz XAXFRAIHXYARIB-INIZCTEOSA-N 0 0 353.422 3.864 20 5 FHBDRN CCCN(C(=O)c1ccnc(OC(F)F)c1)c1cccc([N+](=O)[O-])c1 ZINC000410822176 939962911 /nfs/dbraw/zinc/96/29/11/939962911.db2.gz MRLVHLHBDNCQSE-UHFFFAOYSA-N 0 0 351.309 3.648 20 5 FHBDRN C[C@H](c1c(F)cccc1F)N(C)C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000480621571 939964680 /nfs/dbraw/zinc/96/46/80/939964680.db2.gz JNBFXDHAGPQREE-SECBINFHSA-N 0 0 360.320 3.583 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N1CCCc2c(OC)cccc21 ZINC000410979037 939984136 /nfs/dbraw/zinc/98/41/36/939984136.db2.gz QZOABDQBRGXMOU-UHFFFAOYSA-N 0 0 356.378 3.595 20 5 FHBDRN CCOc1ccc(C(=O)N[C@H](CC)CNc2ccccc2)cc1[N+](=O)[O-] ZINC000411035724 939985619 /nfs/dbraw/zinc/98/56/19/939985619.db2.gz ZXOGMERLAFVMRC-OAHLLOKOSA-N 0 0 357.410 3.614 20 5 FHBDRN CCCCN(Cc1ccccc1F)C(=O)CNc1ccccc1[N+](=O)[O-] ZINC000065866049 939988824 /nfs/dbraw/zinc/98/88/24/939988824.db2.gz GOEMICXGLUHGRP-UHFFFAOYSA-N 0 0 359.401 3.975 20 5 FHBDRN Cc1c(NC(=O)N2CC[C@@H](n3cc4ccccc4n3)C2)cccc1[N+](=O)[O-] ZINC000364723015 939992947 /nfs/dbraw/zinc/99/29/47/939992947.db2.gz QWCXBSUIJGALGQ-OAHLLOKOSA-N 0 0 365.393 3.732 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc2c(n1)CCCC2=O ZINC000411077446 939993881 /nfs/dbraw/zinc/99/38/81/939993881.db2.gz UHELMSKORMOUEA-CQSZACIVSA-N 0 0 367.405 3.716 20 5 FHBDRN COc1ccc(CSCC(=O)N2[C@@H](C)CCC2(C)C)cc1[N+](=O)[O-] ZINC000411085927 939995134 /nfs/dbraw/zinc/99/51/34/939995134.db2.gz LUGYZZQXRHENHW-LBPRGKRZSA-N 0 0 352.456 3.626 20 5 FHBDRN COC(=O)c1sc(NC(=O)c2cc(C)ccc2[N+](=O)[O-])nc1C(C)C ZINC000411061458 939996600 /nfs/dbraw/zinc/99/66/00/939996600.db2.gz ZYUDFCQRIDOXHP-UHFFFAOYSA-N 0 0 363.395 3.522 20 5 FHBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCC[C@@H]2c2cccs2)c(Cl)c1 ZINC000047543213 945287828 /nfs/dbraw/zinc/28/78/28/945287828.db2.gz NEHJGSXAIDEXMI-GFCCVEGCSA-N 0 0 372.855 3.836 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc2c(n1)CCCC2=O ZINC000411074349 939998281 /nfs/dbraw/zinc/99/82/81/939998281.db2.gz MQIUQWBHYVHJRI-NSHDSACASA-N 0 0 371.418 3.628 20 5 FHBDRN CC[C@H](NC(=O)C(=O)Nc1cc(C)c([N+](=O)[O-])cc1C)c1ccc(C)cc1 ZINC000411132213 940001815 /nfs/dbraw/zinc/00/18/15/940001815.db2.gz XZWXKGYIJBLJEE-INIZCTEOSA-N 0 0 369.421 3.726 20 5 FHBDRN Cc1nn(C[C@H](O)COc2cc(C)c(Cl)cc2C(C)C)cc1[N+](=O)[O-] ZINC000179856683 940009553 /nfs/dbraw/zinc/00/95/53/940009553.db2.gz FLGGUVGABRCQCQ-ZDUSSCGKSA-N 0 0 367.833 3.625 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCC1C[C@H](C)O[C@@H](C)C1 ZINC000573333365 940014551 /nfs/dbraw/zinc/01/45/51/940014551.db2.gz GQLHNMCZZLTLTF-RLFYNMQTSA-N 0 0 362.470 3.873 20 5 FHBDRN CCn1c(COC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)nc2c1cccc2F ZINC000728613451 940020826 /nfs/dbraw/zinc/02/08/26/940020826.db2.gz IUOZXQZKDDEWQO-DHZHZOJOSA-N 0 0 369.352 3.860 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N[C@H]1CCc2cnn(C(C)C)c2C1 ZINC000364908852 940021074 /nfs/dbraw/zinc/02/10/74/940021074.db2.gz KWJPTDVSGUJQSB-INIZCTEOSA-N 0 0 370.453 3.585 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N2CCC[C@H]2c2ccccc2)c1F ZINC000411250008 940022185 /nfs/dbraw/zinc/02/21/85/940022185.db2.gz XXUJSWJMVOFJEB-HNNXBMFYSA-N 0 0 358.369 3.649 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CCC(c2ccc(O)cc2)CC1 ZINC000411246135 940022338 /nfs/dbraw/zinc/02/23/38/940022338.db2.gz ZJVNXQNQAOUXMY-VQTJNVASSA-N 0 0 366.417 3.810 20 5 FHBDRN COc1cc(-c2noc(CNc3cc([N+](=O)[O-])ccc3OC)n2)ccc1C ZINC000136545943 940025800 /nfs/dbraw/zinc/02/58/00/940025800.db2.gz BQQWQHCXJQWDEO-UHFFFAOYSA-N 0 0 370.365 3.583 20 5 FHBDRN CCOc1ccc(NC(=O)c2c(C)cc(C)c([N+](=O)[O-])c2C)cc1CO ZINC000179865271 940034257 /nfs/dbraw/zinc/03/42/57/940034257.db2.gz GSROGZXKDFIQKU-UHFFFAOYSA-N 0 0 358.394 3.663 20 5 FHBDRN C[C@H](C(=O)N[C@@H](c1ccccc1)[C@H]1CCOC1)c1ccc([N+](=O)[O-])cc1F ZINC000364991170 940034481 /nfs/dbraw/zinc/03/44/81/940034481.db2.gz SDUPTASRIIXYKW-RFUYNDQBSA-N 0 0 372.396 3.731 20 5 FHBDRN CC[C@H](C)[C@H](C)N(C(=O)C(=O)Nc1cc(C)c([N+](=O)[O-])cc1C)C1CC1 ZINC000411400686 940037948 /nfs/dbraw/zinc/03/79/48/940037948.db2.gz KQLKZQKPTQTHCV-FZMZJTMJSA-N 0 0 361.442 3.576 20 5 FHBDRN COc1ccc(C(=O)NCCSCc2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000018202117 940046542 /nfs/dbraw/zinc/04/65/42/940046542.db2.gz FTWIWXLHQWLMHU-UHFFFAOYSA-N 0 0 360.435 3.575 20 5 FHBDRN CC(=O)Nc1cc(NC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)ccc1C ZINC000411460107 940049587 /nfs/dbraw/zinc/04/95/87/940049587.db2.gz QVYHOOLDGGZSSS-DLBZAZTESA-N 0 0 353.378 3.604 20 5 FHBDRN Cc1cccc(-c2noc(CN(C)CCc3cccc([N+](=O)[O-])c3)n2)c1 ZINC000548928758 940049796 /nfs/dbraw/zinc/04/97/96/940049796.db2.gz UFFFYQAWEYCCGH-UHFFFAOYSA-N 0 0 352.394 3.628 20 5 FHBDRN CCn1c(COC(=O)c2cccc([N+](=O)[O-])c2C)nc2c1cccc2F ZINC000728615257 940051604 /nfs/dbraw/zinc/05/16/04/940051604.db2.gz DTJHJODLOHCMCG-UHFFFAOYSA-N 0 0 357.341 3.769 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)C(=O)N(C)[C@H](C)C1CCCCC1 ZINC000411501333 940054818 /nfs/dbraw/zinc/05/48/18/940054818.db2.gz AWIDFYYUZGDYKC-CQSZACIVSA-N 0 0 361.442 3.577 20 5 FHBDRN COCCOc1ccc(NC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000411504829 940054830 /nfs/dbraw/zinc/05/48/30/940054830.db2.gz NBVMAMZABJJGQG-ZWKOTPCHSA-N 0 0 370.405 3.671 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)N1CC2C[C@@H]3CC1C[C@H](C2)C3 ZINC000065924943 940059744 /nfs/dbraw/zinc/05/97/44/940059744.db2.gz KXDYBLBUGASVNS-JOUKPKRSSA-N 0 0 357.454 3.824 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)C1(c2ccc(C(F)(F)F)cc2)CC1 ZINC000188542625 940059892 /nfs/dbraw/zinc/05/98/92/940059892.db2.gz AILBVPDHDXDMMC-UHFFFAOYSA-N 0 0 364.323 3.962 20 5 FHBDRN CCc1cccc2c(CCNC(=O)Cc3ccc([N+](=O)[O-])cc3)c[nH]c21 ZINC000111047602 945293481 /nfs/dbraw/zinc/29/34/81/945293481.db2.gz FFNGTNGMPMZCKK-UHFFFAOYSA-N 0 0 351.406 3.540 20 5 FHBDRN O=[N+]([O-])c1cccc2ncnc(N3CCCO[C@H](c4ccccc4)C3)c21 ZINC000612443217 940071394 /nfs/dbraw/zinc/07/13/94/940071394.db2.gz JAKASVAZNKVMSU-KRWDZBQOSA-N 0 0 350.378 3.506 20 5 FHBDRN Cc1c(Br)c(N2CC[C@@H](c3ccco3)C2)ncc1[N+](=O)[O-] ZINC000612444411 940071860 /nfs/dbraw/zinc/07/18/60/940071860.db2.gz QOOPSFMHTXCRKL-SNVBAGLBSA-N 0 0 352.188 3.648 20 5 FHBDRN C[C@H](c1ccc([S@@](C)=O)cc1)N(C)C(=O)/C=C/c1ccc([N+](=O)[O-])cc1 ZINC000177290568 940082055 /nfs/dbraw/zinc/08/20/55/940082055.db2.gz HDBBICCZYLSTOF-LQKRDTJCSA-N 0 0 372.446 3.565 20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])N[C@H]1CCCOc2c(F)cccc21 ZINC000179884792 940082890 /nfs/dbraw/zinc/08/28/90/940082890.db2.gz WCLLBDYWCISHRG-HNNXBMFYSA-N 0 0 373.384 3.566 20 5 FHBDRN CO[C@@H](CNC(=O)c1ccccc1Sc1ccccc1[N+](=O)[O-])C1CC1 ZINC000511351382 940084787 /nfs/dbraw/zinc/08/47/87/940084787.db2.gz ONGAJZNHZFXGCY-INIZCTEOSA-N 0 0 372.446 3.901 20 5 FHBDRN C[C@H](C(=O)NC[C@H]1CCc2ccccc2C1)c1ccc([N+](=O)[O-])cc1F ZINC000612473418 940085986 /nfs/dbraw/zinc/08/59/86/940085986.db2.gz ZGFUHCGHSQEKCD-KBPBESRZSA-N 0 0 356.397 3.759 20 5 FHBDRN CC[C@@H](C)NC(=O)[C@@H](C)Nc1cc(Cl)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000065945939 940088590 /nfs/dbraw/zinc/08/85/90/940088590.db2.gz YSKSTPQDHICIJI-HTQZYQBOSA-N 0 0 367.755 3.982 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])N[C@@H]1CCCOc2c(F)cccc21 ZINC000179898572 940093336 /nfs/dbraw/zinc/09/33/36/940093336.db2.gz AWVWPDXGZYRLDH-OAHLLOKOSA-N 0 0 374.368 3.533 20 5 FHBDRN CC1CCC2(CCN(C(=O)c3cc(=O)[nH]c4ccc([N+](=O)[O-])cc43)C2)CC1 ZINC000365261093 940100503 /nfs/dbraw/zinc/10/05/03/940100503.db2.gz VIHBQSIZQLLRRQ-UHFFFAOYSA-N 0 0 369.421 3.891 20 5 FHBDRN COc1ccccc1-c1noc([C@H](C)NCc2c(F)cccc2[N+](=O)[O-])n1 ZINC000612527340 940123789 /nfs/dbraw/zinc/12/37/89/940123789.db2.gz JIFYLVREYFDKJE-NSHDSACASA-N 0 0 372.356 3.643 20 5 FHBDRN Cn1c(C(=O)Nc2nc3c(ccc4ccccc34)s2)ccc1[N+](=O)[O-] ZINC000612540330 940132145 /nfs/dbraw/zinc/13/21/45/940132145.db2.gz ZMHCLFUUXUNBJF-UHFFFAOYSA-N 0 0 352.375 3.949 20 5 FHBDRN C[C@H](C(=O)Nc1nc(-c2ccccc2)c[nH]1)c1ccc([N+](=O)[O-])cc1F ZINC000612563891 940147980 /nfs/dbraw/zinc/14/79/80/940147980.db2.gz PBQNLVBLCDTPDF-NSHDSACASA-N 0 0 354.341 3.866 20 5 FHBDRN Cc1c(NC(=O)[C@H]2CCC(=O)N(C)[C@@H]2c2cccs2)cccc1[N+](=O)[O-] ZINC000365413422 940150406 /nfs/dbraw/zinc/15/04/06/940150406.db2.gz QBHAZLMVLCCSHO-SJCJKPOMSA-N 0 0 373.434 3.513 20 5 FHBDRN Cc1ccc(NC(=O)[C@@H]2CCC(=O)N(C)[C@@H]2c2cccs2)cc1[N+](=O)[O-] ZINC000365411858 940150510 /nfs/dbraw/zinc/15/05/10/940150510.db2.gz KRPPHIOEXGHEEH-DYVFJYSZSA-N 0 0 373.434 3.513 20 5 FHBDRN O=C(N[C@@H](c1ccccc1)c1ccccn1)c1cc([N+](=O)[O-])cc(F)c1F ZINC000365416747 940150534 /nfs/dbraw/zinc/15/05/34/940150534.db2.gz VJZVPZJHZBTYBH-SFHVURJKSA-N 0 0 369.327 3.787 20 5 FHBDRN C[C@H]1CC[S@](=O)CCN1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000365478206 940171672 /nfs/dbraw/zinc/17/16/72/940171672.db2.gz RZVWHIBLKYRJME-RZFZLAGVSA-N 0 0 364.492 3.666 20 5 FHBDRN COCCNc1nnc(S[C@@H](C)c2cc([N+](=O)[O-])ccc2C)s1 ZINC000179968277 940175690 /nfs/dbraw/zinc/17/56/90/940175690.db2.gz QZEVGZIJFMZGFO-JTQLQIEISA-N 0 0 354.457 3.666 20 5 FHBDRN CC(C)(C)Oc1ccc(CNC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)cn1 ZINC000179985562 940192676 /nfs/dbraw/zinc/19/26/76/940192676.db2.gz AGXIBIJICOEWDD-UHFFFAOYSA-N 0 0 368.393 3.578 20 5 FHBDRN CCO[C@@H]1C[C@H](Nc2cc(C)nc3c2cccc3[N+](=O)[O-])[C@]12CCCO2 ZINC000612664408 940209231 /nfs/dbraw/zinc/20/92/31/940209231.db2.gz MZJVIWXFCJSZHN-YQVWRLOYSA-N 0 0 357.410 3.590 20 5 FHBDRN CC[C@@H](C)NC(=O)c1ccc(NC(=O)c2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000066034615 940212772 /nfs/dbraw/zinc/21/27/72/940212772.db2.gz HTNDXKJTTFQQPU-CYBMUJFWSA-N 0 0 355.394 3.684 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1cc(F)ccc1OCC1CC1 ZINC000427347645 945303767 /nfs/dbraw/zinc/30/37/67/945303767.db2.gz PYHAAGTTWHCPRY-UHFFFAOYSA-N 0 0 360.341 3.784 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)Nc1cncc(Br)c1 ZINC000180004407 940224795 /nfs/dbraw/zinc/22/47/95/940224795.db2.gz AFXOHVRWTXBGLE-UHFFFAOYSA-N 0 0 364.199 3.930 20 5 FHBDRN O=C(Nc1ccc(O)cc1F)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000124518941 945304540 /nfs/dbraw/zinc/30/45/40/945304540.db2.gz SVMWNYSVUMBYOW-UHFFFAOYSA-N 0 0 374.246 3.633 20 5 FHBDRN Cc1cc2cc(NC(=O)N3CCc4c(cccc4[N+](=O)[O-])C3)ccc2[nH]1 ZINC000124554323 945305907 /nfs/dbraw/zinc/30/59/07/945305907.db2.gz JLJPPLLNPHPNOW-UHFFFAOYSA-N 0 0 350.378 3.975 20 5 FHBDRN COC(=O)c1ccc(Cl)c(COc2ccc(OC)cc2[N+](=O)[O-])c1 ZINC000511857302 945307315 /nfs/dbraw/zinc/30/73/15/945307315.db2.gz GBDLOOHCESVMIY-UHFFFAOYSA-N 0 0 351.742 3.622 20 5 FHBDRN C[C@@H](Nc1ccc([N+](=O)[O-])cc1OC(F)F)c1ccc2[nH]c(=O)[nH]c2c1 ZINC000612778802 940272391 /nfs/dbraw/zinc/27/23/91/940272391.db2.gz QJYKKPWNPHNMCD-MRVPVSSYSA-N 0 0 364.308 3.951 20 5 FHBDRN CCOc1cc(OCC(=O)NC2(c3ccccc3)CCC2)ccc1[N+](=O)[O-] ZINC000188602206 940288223 /nfs/dbraw/zinc/28/82/23/940288223.db2.gz WUFWTGOLGVEMMH-UHFFFAOYSA-N 0 0 370.405 3.568 20 5 FHBDRN O=C(OCc1nc(C(F)(F)F)cs1)c1cc(F)c([N+](=O)[O-])cc1F ZINC000782651905 940310077 /nfs/dbraw/zinc/31/00/77/940310077.db2.gz ASTXVRLBLLICKT-UHFFFAOYSA-N 0 0 368.239 3.705 20 5 FHBDRN O=c1[nH]c(N[C@H](c2ccccc2)c2ccccn2)nc2ccc([N+](=O)[O-])cc21 ZINC000376102827 940310839 /nfs/dbraw/zinc/31/08/39/940310839.db2.gz KEGBJLUTPSBJEI-GOSISDBHSA-N 0 0 373.372 3.840 20 5 FHBDRN COc1ccc(OC)c(-c2noc(CSc3ccc([N+](=O)[O-])cc3)n2)c1 ZINC000612867667 940315819 /nfs/dbraw/zinc/31/58/19/940315819.db2.gz MLRPZRQAMLCKLP-UHFFFAOYSA-N 0 0 373.390 3.954 20 5 FHBDRN C[C@H]1CC[C@@H](C(F)(F)F)CN1c1c([N+](=O)[O-])c(C(F)(F)F)nn1C ZINC000601139691 940324032 /nfs/dbraw/zinc/32/40/32/940324032.db2.gz MHFSKJTUTYQRCO-NKWVEPMBSA-N 0 0 360.258 3.514 20 5 FHBDRN Cc1ccc(Cl)cc1NC(=O)N1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000376117846 940334096 /nfs/dbraw/zinc/33/40/96/940334096.db2.gz SXIGVRAZIWOGDC-UHFFFAOYSA-N 0 0 363.805 3.622 20 5 FHBDRN O=[N+]([O-])c1ccc(Cc2nc(Cc3ccc4c(c3)CCO4)no2)c(Cl)c1 ZINC000612911791 940337201 /nfs/dbraw/zinc/33/72/01/940337201.db2.gz FBMRGQWAMLBNJE-UHFFFAOYSA-N 0 0 371.780 3.748 20 5 FHBDRN COc1cccc([C@@H](C)c2noc(-c3n[nH]c4ccc([N+](=O)[O-])cc43)n2)c1 ZINC000612917146 940339189 /nfs/dbraw/zinc/33/91/89/940339189.db2.gz FRCPZBWOSBDCNG-SNVBAGLBSA-N 0 0 365.349 3.682 20 5 FHBDRN CN(Cc1noc(-c2ccc(Cl)cc2[N+](=O)[O-])n1)C(=O)c1ccccc1 ZINC000612946110 940352344 /nfs/dbraw/zinc/35/23/44/940352344.db2.gz XTECKLQHMZXNPS-UHFFFAOYSA-N 0 0 372.768 3.570 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccccc1C(=O)OC(C)(C)C ZINC000427363996 945317047 /nfs/dbraw/zinc/31/70/47/945317047.db2.gz AYAGZVGZPREQNG-UHFFFAOYSA-N 0 0 372.377 3.811 20 5 FHBDRN COc1cc(Cc2noc(CCc3ccccc3F)n2)ccc1[N+](=O)[O-] ZINC000612963461 940364447 /nfs/dbraw/zinc/36/44/47/940364447.db2.gz PDDIYLBHLKUPQE-UHFFFAOYSA-N 0 0 357.341 3.502 20 5 FHBDRN COc1cc(C(=O)N[C@@H]2CC[C@@H](c3ccccc3)C2)c([N+](=O)[O-])cc1OC ZINC000376148508 940371773 /nfs/dbraw/zinc/37/17/73/940371773.db2.gz IOVNXVUTLGKWFC-HUUCEWRRSA-N 0 0 370.405 3.678 20 5 FHBDRN Cc1cc(C)c(OC(=O)C[C@@H](C)NC(=O)C2CCCCC2)c([N+](=O)[O-])c1 ZINC000066274923 940377901 /nfs/dbraw/zinc/37/79/01/940377901.db2.gz WVNHDJIYVFQZDG-CQSZACIVSA-N 0 0 362.426 3.592 20 5 FHBDRN CC[C@@H](C)c1ccc(S(=O)(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)cc1 ZINC000543860129 940378232 /nfs/dbraw/zinc/37/82/32/940378232.db2.gz PRPSGHFECAJOQS-GFCCVEGCSA-N 0 0 364.423 3.918 20 5 FHBDRN CC(C)(CNC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1 ZINC000412008441 940382317 /nfs/dbraw/zinc/38/23/17/940382317.db2.gz FOIIJXGDDPRGFG-ZWKOTPCHSA-N 0 0 356.397 3.931 20 5 FHBDRN CC(C)(CNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F)[C@@H]1CCCCO1 ZINC000612998749 940382398 /nfs/dbraw/zinc/38/23/98/940382398.db2.gz FEPWDVWUHYCZAY-INIZCTEOSA-N 0 0 366.433 3.723 20 5 FHBDRN C[C@@H](NC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F)c1nc2ccccc2[nH]1 ZINC000612997980 940386476 /nfs/dbraw/zinc/38/64/76/940386476.db2.gz NLDUBFMVCBJXBY-LLVKDONJSA-N 0 0 370.384 3.765 20 5 FHBDRN CCOc1cc(OCC(=O)Nc2c(C)cccc2CC)ccc1[N+](=O)[O-] ZINC000188608535 940392159 /nfs/dbraw/zinc/39/21/59/940392159.db2.gz ZNHBYGOXSONBSG-UHFFFAOYSA-N 0 0 358.394 3.882 20 5 FHBDRN CC[C@@H](C)[C@H](NC(=O)c1nn(CC)cc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000427358995 945314266 /nfs/dbraw/zinc/31/42/66/945314266.db2.gz TVVYYAVFCLAPBT-ABAIWWIYSA-N 0 0 364.833 3.982 20 5 FHBDRN CCOc1cc(OCC(=O)N2CCC[C@@H]3CCCC[C@@H]32)ccc1[N+](=O)[O-] ZINC000188618187 940422854 /nfs/dbraw/zinc/42/28/54/940422854.db2.gz IOSBORZYUDZAFP-HOCLYGCPSA-N 0 0 362.426 3.554 20 5 FHBDRN O=C(CCCc1cccs1)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000580004563 940433530 /nfs/dbraw/zinc/43/35/30/940433530.db2.gz VXKBETSAPDUCRG-UHFFFAOYSA-N 0 0 357.435 3.819 20 5 FHBDRN CC(C)(C)C[C@H](Nc1nccc(C(N)=O)c1[N+](=O)[O-])c1ccc(F)cc1 ZINC000580021244 940436473 /nfs/dbraw/zinc/43/64/73/940436473.db2.gz WEGVDTZXWQLVKK-AWEZNQCLSA-N 0 0 360.389 3.817 20 5 FHBDRN O=C(Nc1nc2c(s1)CSCC2)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000376189769 940442237 /nfs/dbraw/zinc/44/22/37/940442237.db2.gz TVONTBDQUTUKOM-UHFFFAOYSA-N 0 0 361.404 3.839 20 5 FHBDRN Cc1c(CN2C(=O)[C@@H]3C[C@@H](C4CCCCC4)CN3C2=O)cccc1[N+](=O)[O-] ZINC000431735723 940442913 /nfs/dbraw/zinc/44/29/13/940442913.db2.gz KVYBRGDEXAXHDG-AEFFLSMTSA-N 0 0 371.437 3.636 20 5 FHBDRN COC(=O)c1ccc(OCc2ncc(-c3ccccc3F)o2)cc1[N+](=O)[O-] ZINC000613110013 940452262 /nfs/dbraw/zinc/45/22/62/940452262.db2.gz RWFWQFNKDDRMRI-UHFFFAOYSA-N 0 0 372.308 3.755 20 5 FHBDRN COC(=O)c1ccc(OCC(=O)c2c(C)cc(C)cc2C)cc1[N+](=O)[O-] ZINC000613113162 940456792 /nfs/dbraw/zinc/45/67/92/940456792.db2.gz YRAVFPBNJIPBFB-UHFFFAOYSA-N 0 0 357.362 3.568 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)c2c(Cl)nc3ccccn32)cc1[N+](=O)[O-] ZINC000177834883 940459418 /nfs/dbraw/zinc/45/94/18/940459418.db2.gz AZBIDAGMOAUFKX-NSHDSACASA-N 0 0 358.785 3.695 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)c2cc3ccccc3oc2=O)cc1[N+](=O)[O-] ZINC000177837646 940459744 /nfs/dbraw/zinc/45/97/44/940459744.db2.gz ZGCVDCQJNAQMRR-GFCCVEGCSA-N 0 0 352.346 3.501 20 5 FHBDRN CCCN([C@H]1CCc2ccccc21)S(=O)(=O)c1cccc([N+](=O)[O-])c1 ZINC000546170690 945322882 /nfs/dbraw/zinc/32/28/82/945322882.db2.gz WXZXRDMYMXGUIG-SFHVURJKSA-N 0 0 360.435 3.683 20 5 FHBDRN CC(C)N(C(=O)c1cc([N+](=O)[O-])cc2c1OCCO2)c1ccc(F)cc1 ZINC000066358759 940467279 /nfs/dbraw/zinc/46/72/79/940467279.db2.gz SDDXJANOHXDBLQ-UHFFFAOYSA-N 0 0 360.341 3.560 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCN(c3ccc(Cl)cn3)CC2)c2ncccc12 ZINC000066372606 940467998 /nfs/dbraw/zinc/46/79/98/940467998.db2.gz NOBXSEWZFCFWEB-UHFFFAOYSA-N 0 0 369.812 3.518 20 5 FHBDRN C[C@@H](NC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1)c1nccn1-c1ccccc1 ZINC000580247355 940470524 /nfs/dbraw/zinc/47/05/24/940470524.db2.gz IFSJSLKJWKATRA-HUUCEWRRSA-N 0 0 364.405 3.761 20 5 FHBDRN Cn1cc([N+](=O)[O-])cc1C(=O)N1CCCc2c(Cl)ccc(Cl)c21 ZINC000580405964 940474246 /nfs/dbraw/zinc/47/42/46/940474246.db2.gz IHPXHEZHIDJKNZ-UHFFFAOYSA-N 0 0 354.193 3.833 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1F)N[C@@H]1CCCN(c2ccccc2)C1 ZINC000580500301 940477221 /nfs/dbraw/zinc/47/72/21/940477221.db2.gz FDJDJJPSQPFXPN-CYBMUJFWSA-N 0 0 358.373 3.524 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N1CCOc2c(F)cccc2C1 ZINC000580502384 940477241 /nfs/dbraw/zinc/47/72/41/940477241.db2.gz ROOMPNXUDFMETP-UHFFFAOYSA-N 0 0 359.357 3.723 20 5 FHBDRN Cc1ccnc(-c2n[nH]c([C@H](C)N[C@H](C)c3cc([N+](=O)[O-])ccc3C)n2)c1 ZINC000580511417 940477592 /nfs/dbraw/zinc/47/75/92/940477592.db2.gz FHNNORMDPQEDDD-KGLIPLIRSA-N 0 0 366.425 3.804 20 5 FHBDRN C[C@H]1CCN(c2sc(S(C)(=O)=O)cc2[N+](=O)[O-])CC12CCCCC2 ZINC000613188131 940478519 /nfs/dbraw/zinc/47/85/19/940478519.db2.gz KLGSDDFGJVAJNC-LBPRGKRZSA-N 0 0 372.512 3.857 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCC(C)(C)[C@@H]1CCCCO1 ZINC000613188838 940480765 /nfs/dbraw/zinc/48/07/65/940480765.db2.gz HZGJUIWMGAFDRT-AEFFLSMTSA-N 0 0 362.470 3.875 20 5 FHBDRN C[C@@H]1C[C@H](c2cccs2)CN1c1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1 ZINC000376217536 940481598 /nfs/dbraw/zinc/48/15/98/940481598.db2.gz DYHCFUBCPRIFRN-MNOVXSKESA-N 0 0 356.407 3.688 20 5 FHBDRN COc1cc(OC)cc([C@H](Nc2ccc([N+](=O)[O-])s2)c2nccn2C)c1 ZINC000066410733 940482227 /nfs/dbraw/zinc/48/22/27/940482227.db2.gz CVVQNUUOPAFXRH-INIZCTEOSA-N 0 0 374.422 3.609 20 5 FHBDRN O=[N+]([O-])c1cc(CN2CCO[C@@H](c3ccc(F)cc3)C2)ccc1Cl ZINC000177942476 940486215 /nfs/dbraw/zinc/48/62/15/940486215.db2.gz RHFDASLHHIWNCK-QGZVFWFLSA-N 0 0 350.777 3.961 20 5 FHBDRN CC(=O)c1ccc(Nc2cccc([C@@H](C)N3CCOCC3)c2)c([N+](=O)[O-])c1 ZINC000511456408 940488704 /nfs/dbraw/zinc/48/87/04/940488704.db2.gz XSVRTAOARSFODC-CQSZACIVSA-N 0 0 369.421 3.934 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@H](c3ccc(C)cc3)C2)c1 ZINC000549008906 940489881 /nfs/dbraw/zinc/48/98/81/940489881.db2.gz JFUHPRSKCGMBFI-INIZCTEOSA-N 0 0 354.406 3.932 20 5 FHBDRN COc1cc(OCc2nc(-c3ccc4[nH]ccc4c3)no2)ccc1[N+](=O)[O-] ZINC000545610011 945325623 /nfs/dbraw/zinc/32/56/23/945325623.db2.gz YWUSSCNMZUYPAK-UHFFFAOYSA-N 0 0 366.333 3.714 20 5 FHBDRN CCNc1ccc(C(=O)N[C@H](C)COc2c(C)cccc2C)cc1[N+](=O)[O-] ZINC000511461276 940492811 /nfs/dbraw/zinc/49/28/11/940492811.db2.gz NZRAUCGAQOWBHQ-OAHLLOKOSA-N 0 0 371.437 3.841 20 5 FHBDRN CC(C)c1nnc(CN[C@@H](c2ccc([N+](=O)[O-])cc2)C(F)(F)F)s1 ZINC000581136233 940496102 /nfs/dbraw/zinc/49/61/02/940496102.db2.gz UNMCEAIZDPZZMY-LBPRGKRZSA-N 0 0 360.361 3.963 20 5 FHBDRN O=C(NCCCc1ccccc1)c1c([N+](=O)[O-])cccc1C(F)(F)F ZINC000581337578 940499698 /nfs/dbraw/zinc/49/96/98/940499698.db2.gz PMNKWVXIXOGZAY-UHFFFAOYSA-N 0 0 352.312 3.976 20 5 FHBDRN CC[C@@H](NC(=O)c1ccccc1)c1noc(-c2cc(C)cc([N+](=O)[O-])c2)n1 ZINC000581336433 940499733 /nfs/dbraw/zinc/49/97/33/940499733.db2.gz KQWTUQNPDXSPFI-MRXNPFEDSA-N 0 0 366.377 3.834 20 5 FHBDRN CS(=O)(=O)c1ccc(Oc2cncc(-c3ccccc3)c2)c([N+](=O)[O-])c1 ZINC000581521201 940505661 /nfs/dbraw/zinc/50/56/61/940505661.db2.gz KUGHJBPOTUJKPB-UHFFFAOYSA-N 0 0 370.386 3.853 20 5 FHBDRN C[C@@H](CNC(=O)N(C)CCc1cccc([N+](=O)[O-])c1)Cc1cccs1 ZINC000511473609 940505897 /nfs/dbraw/zinc/50/58/97/940505897.db2.gz HGLUGDDDQOPDLE-CQSZACIVSA-N 0 0 361.467 3.719 20 5 FHBDRN COc1ccc(Br)cc1NC(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000172863350 940507669 /nfs/dbraw/zinc/50/76/69/940507669.db2.gz CNKWRKACYZTZQC-UHFFFAOYSA-N 0 0 365.183 3.547 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1)CCN2Cc1nnc(-c2ccc(Cl)cc2)o1 ZINC000178013699 940509522 /nfs/dbraw/zinc/50/95/22/940509522.db2.gz RLYXCGOGLFXGML-UHFFFAOYSA-N 0 0 356.769 3.861 20 5 FHBDRN C[C@H](Nc1ccc(C(N)=O)cc1OCC(F)F)c1ccccc1[N+](=O)[O-] ZINC000581758107 940511889 /nfs/dbraw/zinc/51/18/89/940511889.db2.gz PXIMDBPFVUVEMZ-JTQLQIEISA-N 0 0 365.336 3.511 20 5 FHBDRN Cc1cccc(NC2CCN(c3ncnc4sc([N+](=O)[O-])cc43)CC2)c1 ZINC000581779327 940591016 /nfs/dbraw/zinc/59/10/16/940591016.db2.gz XQCCCHTXBIKIBJ-UHFFFAOYSA-N 0 0 369.450 3.989 20 5 FHBDRN COc1ccc(CNC(=O)N2CCC[C@@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000431815505 940645126 /nfs/dbraw/zinc/64/51/26/940645126.db2.gz YXTRELBUCORHCU-QGZVFWFLSA-N 0 0 369.421 3.693 20 5 FHBDRN CCOC(=O)CC(C)(C)CC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000582203924 940653990 /nfs/dbraw/zinc/65/39/90/940653990.db2.gz YTIFICXXRQKOKL-UHFFFAOYSA-N 0 0 364.442 3.701 20 5 FHBDRN O=C(CN1CC[C@H](C(F)(F)F)C2(CCC2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000582169241 940658562 /nfs/dbraw/zinc/65/85/62/940658562.db2.gz CDPSEJGPZBRQGZ-AWEZNQCLSA-N 0 0 371.359 3.588 20 5 FHBDRN COc1ccc2c(c1)[C@@H](C(=O)NCCCCc1ccc([N+](=O)[O-])cc1)CC2 ZINC000431819997 940659188 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FHBDRN C[C@H]1CC(CCNC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C[C@H](C)O1 ZINC000549020659 940709588 /nfs/dbraw/zinc/70/95/88/940709588.db2.gz KAKDKDUPCPPMRT-QWRGUYRKSA-N 0 0 374.359 3.937 20 5 FHBDRN CCC1(CC)[C@H](OC)C[C@@H]1NC(=O)c1c([N+](=O)[O-])cccc1C(F)(F)F ZINC000582633829 940769205 /nfs/dbraw/zinc/76/92/05/940769205.db2.gz ZMNPJNDINMBIHA-QWHCGFSZSA-N 0 0 374.359 3.937 20 5 FHBDRN O=C(CCn1cnc(-c2cccc([N+](=O)[O-])c2)n1)Nc1cccc(Cl)c1 ZINC000174797798 940780971 /nfs/dbraw/zinc/78/09/71/940780971.db2.gz VEKQJZDTRYXLNU-UHFFFAOYSA-N 0 0 371.784 3.536 20 5 FHBDRN Cc1cc(=O)oc2cc(OC(=O)c3cc([N+](=O)[O-])ccc3Cl)ccc12 ZINC000003566504 940813983 /nfs/dbraw/zinc/81/39/83/940813983.db2.gz WISOAVJCMKHCEK-UHFFFAOYSA-N 0 0 359.721 3.882 20 5 FHBDRN Cc1ccc(CCC(=O)NCCOc2ccc([N+](=O)[O-])cc2)cc1Cl ZINC000609455022 940817826 /nfs/dbraw/zinc/81/78/26/940817826.db2.gz RFXQWKHNFSOXFN-UHFFFAOYSA-N 0 0 362.813 3.684 20 5 FHBDRN C[C@H](c1ccncc1)N(C)C(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000175167923 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3.798 20 5 FHBDRN O=C(Nc1cc2c(cc1F)NC(=O)CC2)c1cccc(Cl)c1[N+](=O)[O-] ZINC000122105119 940906683 /nfs/dbraw/zinc/90/66/83/940906683.db2.gz ZUVGRANZDLBIPV-UHFFFAOYSA-N 0 0 363.732 3.524 20 5 FHBDRN Cc1c(C(=O)Nc2ccc(C(C)C)cc2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000024360349 940909636 /nfs/dbraw/zinc/90/96/36/940909636.db2.gz NOZOTZCFQDSMPD-UHFFFAOYSA-N 0 0 365.393 3.860 20 5 FHBDRN C[C@H](c1ccccn1)N(C)C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000175698173 940914409 /nfs/dbraw/zinc/91/44/09/940914409.db2.gz LWKYUYZLTFPVSN-SNVBAGLBSA-N 0 0 364.199 3.586 20 5 FHBDRN O=C(NCC1(CCO)CCCCC1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000175892194 940947942 /nfs/dbraw/zinc/94/79/42/940947942.db2.gz HYLXPYGYHAINFN-UHFFFAOYSA-N 0 0 355.822 3.703 20 5 FHBDRN O=C(N[C@H](c1nccs1)C(F)(F)F)c1ccc([N+](=O)[O-])cc1Cl ZINC000507602017 945363691 /nfs/dbraw/zinc/36/36/91/945363691.db2.gz NVLVNVDCJVGODV-SECBINFHSA-N 0 0 365.720 3.738 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N(CC(F)(F)F)C1CCC1 ZINC000175963131 940965375 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CC(C)(C)c1ccc([C@@H]2CCCN2C(=O)c2cc([N+](=O)[O-])cnc2N)cc1 ZINC000180538044 941040519 /nfs/dbraw/zinc/04/05/19/941040519.db2.gz LHZHZPGHZHBGKB-KRWDZBQOSA-N 0 0 368.437 3.847 20 5 FHBDRN CSc1ccc(C(=O)Nc2cc(C(F)(F)F)ccn2)cc1[N+](=O)[O-] ZINC000180586954 941048804 /nfs/dbraw/zinc/04/88/04/941048804.db2.gz SLBYWJSNHQVNLT-UHFFFAOYSA-N 0 0 357.313 3.983 20 5 FHBDRN CC(C)(NC(=O)Cc1ccccc1OC(F)F)c1ccc([N+](=O)[O-])cc1 ZINC000176505515 941053535 /nfs/dbraw/zinc/05/35/35/941053535.db2.gz HYEMKRVTIFJFJK-UHFFFAOYSA-N 0 0 364.348 3.790 20 5 FHBDRN COc1cc(COc2ccc(C)nc2)c([N+](=O)[O-])cc1OCC(F)F ZINC000180654624 941060116 /nfs/dbraw/zinc/06/01/16/941060116.db2.gz BMKVQPJTRXUTRV-UHFFFAOYSA-N 0 0 354.309 3.530 20 5 FHBDRN Cc1cc(NC(=O)c2ccc([N+](=O)[O-])cc2C)n(-c2ccccc2C)n1 ZINC000102981330 941062362 /nfs/dbraw/zinc/06/23/62/941062362.db2.gz DFOMWCWCAQEHMR-UHFFFAOYSA-N 0 0 350.378 3.958 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCc1cc(C)c(O)c(C)c1 ZINC000188733739 941063899 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Cc1ccc(C(C)(C)C(=O)OCC(=O)Nc2ccc(F)c([N+](=O)[O-])c2)cc1 ZINC000728666514 941071127 /nfs/dbraw/zinc/07/11/27/941071127.db2.gz RYOONOJQCTVGKR-UHFFFAOYSA-N 0 0 374.368 3.502 20 5 FHBDRN NC(=O)c1ccc(CSC[C@@H]2CCC3(CCCCC3)O2)c([N+](=O)[O-])c1 ZINC000188762522 941077139 /nfs/dbraw/zinc/07/71/39/941077139.db2.gz SKPYEKSCUFBWQY-HNNXBMFYSA-N 0 0 364.467 3.809 20 5 FHBDRN NC(=O)c1ccc(CSC[C@H]2CCC3(CCCCC3)O2)c([N+](=O)[O-])c1 ZINC000188762541 941077148 /nfs/dbraw/zinc/07/71/48/941077148.db2.gz SKPYEKSCUFBWQY-OAHLLOKOSA-N 0 0 364.467 3.809 20 5 FHBDRN Cc1cnc([C@@H](C)CNC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)s1 ZINC000187083595 941077791 /nfs/dbraw/zinc/07/77/91/941077791.db2.gz HMRSTFJXYCLDDO-NSHDSACASA-N 0 0 362.455 3.698 20 5 FHBDRN CN(Cc1cccc(Cl)c1Cl)C(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000180884721 941088155 /nfs/dbraw/zinc/08/81/55/941088155.db2.gz RRGLGYFNUBQISO-UHFFFAOYSA-N 0 0 354.193 3.756 20 5 FHBDRN Cc1cc(-c2nc(-c3ccc(C(=O)NC4CC4)cc3)no2)ccc1[N+](=O)[O-] ZINC000544097894 941090322 /nfs/dbraw/zinc/09/03/22/941090322.db2.gz UGSNQPRGHGDUGU-UHFFFAOYSA-N 0 0 364.361 3.512 20 5 FHBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1CCCSc2ccccc21 ZINC000180924047 941093517 /nfs/dbraw/zinc/09/35/17/941093517.db2.gz HYHURFULCLAVKQ-UHFFFAOYSA-N 0 0 364.448 3.594 20 5 FHBDRN Cc1cnc(N[C@@H](CCO)c2ccccc2Br)c([N+](=O)[O-])c1 ZINC000541005798 941096098 /nfs/dbraw/zinc/09/60/98/941096098.db2.gz TXBIOGDAEQPKIF-ZDUSSCGKSA-N 0 0 366.215 3.596 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1OC(F)F)N1CC[C@@H](c2ccccc2)C1 ZINC000181151094 941109091 /nfs/dbraw/zinc/10/90/91/941109091.db2.gz REDLHTPYRKQRJN-CYBMUJFWSA-N 0 0 362.332 3.826 20 5 FHBDRN O=C(NCc1cccc2cccnc21)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000181110559 941109461 /nfs/dbraw/zinc/10/94/61/941109461.db2.gz LHKCELXUOHNNCB-UHFFFAOYSA-N 0 0 373.315 3.674 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@H](C)Cc1ccccc1C(F)(F)F ZINC000181209073 941110896 /nfs/dbraw/zinc/11/08/96/941110896.db2.gz ICHOEJMAAMFALS-SNVBAGLBSA-N 0 0 367.327 3.678 20 5 FHBDRN Nc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(Cl)c(Br)c1 ZINC000181181416 941112089 /nfs/dbraw/zinc/11/20/89/941112089.db2.gz XHIXIYFVBXCJRW-UHFFFAOYSA-N 0 0 370.590 3.845 20 5 FHBDRN COc1cc(CS(=O)(=O)Cc2cccc([N+](=O)[O-])c2C)ccc1Cl ZINC000414415067 941118271 /nfs/dbraw/zinc/11/82/71/941118271.db2.gz OOOYQIHYRGVRRQ-UHFFFAOYSA-N 0 0 369.826 3.680 20 5 FHBDRN Cc1ccnc(Oc2ccc(NC(=O)Cc3cccc([N+](=O)[O-])c3)cc2)n1 ZINC000177332246 941118415 /nfs/dbraw/zinc/11/84/15/941118415.db2.gz VMLHCWLUTXVKAH-UHFFFAOYSA-N 0 0 364.361 3.667 20 5 FHBDRN C[C@@H](CCC1CCCCC1)NC(=O)C(=O)Nc1cc(F)cc([N+](=O)[O-])c1 ZINC000472617688 941120919 /nfs/dbraw/zinc/12/09/19/941120919.db2.gz TYKMLOBASGNGLH-LBPRGKRZSA-N 0 0 365.405 3.538 20 5 FHBDRN Cc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2SCCO)cc1Cl ZINC000136035151 941123567 /nfs/dbraw/zinc/12/35/67/941123567.db2.gz QEFYQJHOFVQZER-UHFFFAOYSA-N 0 0 366.826 3.893 20 5 FHBDRN CCCOc1ccc(C[NH2+]Cc2cc3c(cc2[N+](=O)[O-])OCCO3)c(C)c1 ZINC000616094592 941124211 /nfs/dbraw/zinc/12/42/11/941124211.db2.gz NGLDMZIPPXCTNN-UHFFFAOYSA-N 0 0 372.421 3.753 20 5 FHBDRN C[C@H](NCc1cc(F)ccc1[N+](=O)[O-])c1ccc(N2CCCC2=O)cc1 ZINC000181354894 941131926 /nfs/dbraw/zinc/13/19/26/941131926.db2.gz XMTXMFWUVDIOGD-ZDUSSCGKSA-N 0 0 357.385 3.712 20 5 FHBDRN C[C@@H](NCc1cc(F)ccc1[N+](=O)[O-])c1ccc(N2CCCC2=O)cc1 ZINC000181354915 941131999 /nfs/dbraw/zinc/13/19/99/941131999.db2.gz XMTXMFWUVDIOGD-CYBMUJFWSA-N 0 0 357.385 3.712 20 5 FHBDRN CN(Cc1noc(-c2ccc(F)cc2F)n1)Cc1ccccc1[N+](=O)[O-] ZINC000188940780 941132180 /nfs/dbraw/zinc/13/21/80/941132180.db2.gz LCTJGGSWCJKTRU-UHFFFAOYSA-N 0 0 360.320 3.555 20 5 FHBDRN CC[C@H](C)OCC(=O)Nc1ccc(OCc2ccccc2)cc1[N+](=O)[O-] ZINC000188974827 941137421 /nfs/dbraw/zinc/13/74/21/941137421.db2.gz XKBZZSUKABBHKW-AWEZNQCLSA-N 0 0 358.394 3.927 20 5 FHBDRN C[C@@H](C(=O)N[C@H]1CCOc2c(F)cccc21)c1ccc([N+](=O)[O-])cc1F ZINC000188998747 941142840 /nfs/dbraw/zinc/14/28/40/941142840.db2.gz PGGUZTKOZCMQMF-HWPZZCPQSA-N 0 0 362.332 3.617 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@H](C)Oc2ncccc21 ZINC000189058446 941145971 /nfs/dbraw/zinc/14/59/71/941145971.db2.gz GJNXOBJAELSZLG-NSHDSACASA-N 0 0 359.407 3.530 20 5 FHBDRN CCSc1cc(CNC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)ccn1 ZINC000189109734 941148576 /nfs/dbraw/zinc/14/85/76/941148576.db2.gz JRHXVNOBAHRCGZ-UHFFFAOYSA-N 0 0 372.450 3.606 20 5 FHBDRN COCc1cccc(CC(=O)Nc2cc(C)nc3ccc([N+](=O)[O-])cc32)c1 ZINC000189109609 941148617 /nfs/dbraw/zinc/14/86/17/941148617.db2.gz FWCVYBOHYJALRT-UHFFFAOYSA-N 0 0 365.389 3.779 20 5 FHBDRN Cc1c(NCC(=O)Nc2ccccc2OC(F)F)cccc1[N+](=O)[O-] ZINC000007975235 941149003 /nfs/dbraw/zinc/14/90/03/941149003.db2.gz OEUWSNFXIHSZNA-UHFFFAOYSA-N 0 0 351.309 3.555 20 5 FHBDRN Cc1cnc([C@H](C)NC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)s1 ZINC000177918517 941153073 /nfs/dbraw/zinc/15/30/73/941153073.db2.gz BEKPRQSJRNXBGI-QWRGUYRKSA-N 0 0 351.453 3.718 20 5 FHBDRN CN(c1cccc([N+](=O)[O-])c1)S(=O)(=O)c1ccc(CC(F)(F)F)cc1 ZINC000189316621 941156206 /nfs/dbraw/zinc/15/62/06/941156206.db2.gz FLZPRYFMPXLJJE-UHFFFAOYSA-N 0 0 374.340 3.525 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)NCc1ccc(Cl)cc1F ZINC000189278431 941156629 /nfs/dbraw/zinc/15/66/29/941156629.db2.gz SAUAUQHLXRUQAK-UHFFFAOYSA-N 0 0 354.790 3.796 20 5 FHBDRN COc1cc(C(=O)N2CCOc3c(Cl)cccc32)cc([N+](=O)[O-])c1C ZINC000189396862 941157080 /nfs/dbraw/zinc/15/70/80/941157080.db2.gz RDPYBQMHJRVFKV-UHFFFAOYSA-N 0 0 362.769 3.604 20 5 FHBDRN COC[C@@H](Cc1ccccc1)N(C)C(=O)Nc1ccc(C)c([N+](=O)[O-])c1 ZINC000189472568 941158560 /nfs/dbraw/zinc/15/85/60/941158560.db2.gz CWOMRBNQGMQDLI-QGZVFWFLSA-N 0 0 357.410 3.625 20 5 FHBDRN CC(C)c1noc(CCCNC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)n1 ZINC000189487534 941159086 /nfs/dbraw/zinc/15/90/86/941159086.db2.gz FDRREGIZWQRZGR-UHFFFAOYSA-N 0 0 360.414 3.587 20 5 FHBDRN COC[C@H](Cc1ccccc1)N(C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000189491868 941159181 /nfs/dbraw/zinc/15/91/81/941159181.db2.gz ACVYMEFPEHEVBM-INIZCTEOSA-N 0 0 357.410 3.625 20 5 FHBDRN CC(C)CCSc1ccc(C(=O)N2CC[C@H](C)[C@@H]2CO)cc1[N+](=O)[O-] ZINC000189492499 941159196 /nfs/dbraw/zinc/15/91/96/941159196.db2.gz FFRXZFCTSXNTRQ-BBRMVZONSA-N 0 0 366.483 3.576 20 5 FHBDRN CC[C@@](C)(O)CN(Cc1ccccc1)C(=O)c1cc([N+](=O)[O-])ccc1C ZINC000189495863 941159280 /nfs/dbraw/zinc/15/92/80/941159280.db2.gz BKLJZVOVUWCOFE-HXUWFJFHSA-N 0 0 356.422 3.707 20 5 FHBDRN CC[C@@](C)(O)CN(Cc1ccccc1)C(=O)c1cc(C)cc([N+](=O)[O-])c1 ZINC000189496579 941159319 /nfs/dbraw/zinc/15/93/19/941159319.db2.gz JJYZWPUEXYEUAB-HXUWFJFHSA-N 0 0 356.422 3.707 20 5 FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)NCC(C)(C)C(C)C ZINC000189442682 941159868 /nfs/dbraw/zinc/15/98/68/941159868.db2.gz ROLSZNYYFNQRIE-UHFFFAOYSA-N 0 0 354.472 3.745 20 5 FHBDRN COc1cc(NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)ccc1F ZINC000189429056 941159922 /nfs/dbraw/zinc/15/99/22/941159922.db2.gz XTWPVELQGAYCJX-UHFFFAOYSA-N 0 0 369.146 3.757 20 5 FHBDRN CCOC[C@H](NC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-])C(C)C ZINC000189541557 941161061 /nfs/dbraw/zinc/16/10/61/941161061.db2.gz VYRDDJLEOSWYAQ-LBPRGKRZSA-N 0 0 360.863 3.518 20 5 FHBDRN CCOC(=O)c1cnc2ccccc2c1N(C)Cc1ccccc1[N+](=O)[O-] ZINC000215875844 941166441 /nfs/dbraw/zinc/16/64/41/941166441.db2.gz UJXZFEFRPDCATH-UHFFFAOYSA-N 0 0 365.389 3.956 20 5 FHBDRN Cc1occc1CN(C)C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000178298308 941219493 /nfs/dbraw/zinc/21/94/93/941219493.db2.gz WVGHZVFAQASKHP-UHFFFAOYSA-N 0 0 353.172 3.531 20 5 FHBDRN Cc1cc(-n2cccn2)ccc1NC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000189608747 941221896 /nfs/dbraw/zinc/22/18/96/941221896.db2.gz IBAUDTYVWVJJNX-UHFFFAOYSA-N 0 0 356.769 3.995 20 5 FHBDRN CC(C)c1ccc(C(=O)N2CCCCC[C@H]2c2ncon2)cc1[N+](=O)[O-] ZINC000189632657 941232810 /nfs/dbraw/zinc/23/28/10/941232810.db2.gz IXMCJSBZWBGGBS-HNNXBMFYSA-N 0 0 358.398 3.859 20 5 FHBDRN C[C@@H]1CO[C@H](c2ccccc2)CN1C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000066710087 941265349 /nfs/dbraw/zinc/26/53/49/941265349.db2.gz FMSFDZQLHLAITD-ACJLOTCBSA-N 0 0 365.389 3.678 20 5 FHBDRN Cc1c(CC(=O)N[C@@H](c2nc3ccccc3[nH]2)C(C)C)cccc1[N+](=O)[O-] ZINC000178575832 941279894 /nfs/dbraw/zinc/27/98/94/941279894.db2.gz OBWLTRPTBSNJLT-LJQANCHMSA-N 0 0 366.421 3.836 20 5 FHBDRN Cc1cc(-n2cccn2)ccc1N[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000189827639 941288843 /nfs/dbraw/zinc/28/88/43/941288843.db2.gz JHFULDLCARDSKE-AWEZNQCLSA-N 0 0 365.393 3.528 20 5 FHBDRN O=C([C@H]1C[C@]12CCc1ccccc12)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000178677352 941294460 /nfs/dbraw/zinc/29/44/60/941294460.db2.gz QKZZYPUNBWAAQU-KNQAVFIVSA-N 0 0 362.429 3.990 20 5 FHBDRN CCN(Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C[C@@H](O)C(F)(F)F ZINC000189865265 941294539 /nfs/dbraw/zinc/29/45/39/941294539.db2.gz NROKPTXSLKGVEP-OAHLLOKOSA-N 0 0 358.316 3.600 20 5 FHBDRN Cc1sc(S(=O)(=O)N(c2ccccc2)[C@H]2C[C@@H]2C)cc1[N+](=O)[O-] ZINC000414475089 941305435 /nfs/dbraw/zinc/30/54/35/941305435.db2.gz UEPCWFJQSKGGRT-GWCFXTLKSA-N 0 0 352.437 3.568 20 5 FHBDRN CCCOc1cccc(CCNC(=O)N(C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000178880836 941317710 /nfs/dbraw/zinc/31/77/10/941317710.db2.gz RVICSNKTSLTZAR-UHFFFAOYSA-N 0 0 371.437 3.768 20 5 FHBDRN C[N@@H+](Cc1ccccc1[N+](=O)[O-])C[C@@H](O)Cc1ccccc1C(F)(F)F ZINC000179001159 941329848 /nfs/dbraw/zinc/32/98/48/941329848.db2.gz UUCCQKKLJIJOGF-HNNXBMFYSA-N 0 0 368.355 3.649 20 5 FHBDRN COc1ccc(C(=O)OCc2ccc([N+](=O)[O-])c(F)c2)cc1OC(F)F ZINC000782959892 941342419 /nfs/dbraw/zinc/34/24/19/941342419.db2.gz DBHYRQYBHSEXJO-UHFFFAOYSA-N 0 0 371.267 3.701 20 5 FHBDRN CC(C)[C@@H]1CCCC[C@H]1NC(=O)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000103326266 941353409 /nfs/dbraw/zinc/35/34/09/941353409.db2.gz PVDYFGVZNRKDLV-GXTWGEPZSA-N 0 0 367.833 3.518 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CCCc3nc(C)sc32)c1 ZINC000376611147 941354867 /nfs/dbraw/zinc/35/48/67/941354867.db2.gz PJGFHDFIJBCNCM-CYBMUJFWSA-N 0 0 363.464 3.889 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CCCc3nc(C)sc32)c1 ZINC000376611150 941355412 /nfs/dbraw/zinc/35/54/12/941355412.db2.gz PJGFHDFIJBCNCM-ZDUSSCGKSA-N 0 0 363.464 3.889 20 5 FHBDRN Cc1ccc(C(=O)OCC(=O)Nc2c(C)cccc2[N+](=O)[O-])cc1Cl ZINC000728675558 941367055 /nfs/dbraw/zinc/36/70/55/941367055.db2.gz LSHHDQVSBRRKLF-UHFFFAOYSA-N 0 0 362.769 3.661 20 5 FHBDRN COc1cc(C(=O)N(Cc2c(F)cccc2F)C2CC2)ccc1[N+](=O)[O-] ZINC000190024756 941368015 /nfs/dbraw/zinc/36/80/15/941368015.db2.gz SXLUKEYYFAGUDJ-UHFFFAOYSA-N 0 0 362.332 3.686 20 5 FHBDRN CN(C)c1ccc(N(C)C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)cc1 ZINC000103415787 941400468 /nfs/dbraw/zinc/40/04/68/941400468.db2.gz NLPXPVWDQJMYJW-UHFFFAOYSA-N 0 0 354.410 3.512 20 5 FHBDRN COc1ccc(CNc2ccc(C(=O)N(C)C)c(Cl)c2)cc1[N+](=O)[O-] ZINC000573112535 941418898 /nfs/dbraw/zinc/41/88/98/941418898.db2.gz DDBRHZWHOFWURX-UHFFFAOYSA-N 0 0 363.801 3.571 20 5 FHBDRN C[N@H+](CCCC(=O)[O-])Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000414643057 941427570 /nfs/dbraw/zinc/42/75/70/941427570.db2.gz WQSYQWBJRUEJFP-UHFFFAOYSA-N 0 0 362.357 3.823 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N2c3ccccc3CC[C@@H]2C)c1F ZINC000414721676 941449498 /nfs/dbraw/zinc/44/94/98/941449498.db2.gz CJTDQGGUUFNEHG-LBPRGKRZSA-N 0 0 358.369 3.653 20 5 FHBDRN C/C=C/C[C@@H](CO)Nc1ccc(C(=O)Nc2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000472652109 941487164 /nfs/dbraw/zinc/48/71/64/941487164.db2.gz SIEXCLARLFONPO-IDOMTICXSA-N 0 0 369.421 3.895 20 5 FHBDRN Cc1cc(Nc2ccn(CC(F)F)n2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000549145772 941524433 /nfs/dbraw/zinc/52/44/33/941524433.db2.gz GKMQQRXDXUUETN-UHFFFAOYSA-N 0 0 350.247 3.549 20 5 FHBDRN CC(C)[C@H](NC(=O)N1CCC(n2ccc([N+](=O)[O-])n2)CC1)c1ccccc1 ZINC000377182509 941539025 /nfs/dbraw/zinc/53/90/25/941539025.db2.gz FLATZFPGMGYBPW-SFHVURJKSA-N 0 0 371.441 3.535 20 5 FHBDRN CC(=O)c1ccc([N+](=O)[O-])cc1N1CC[C@@H](n2ncc3ccccc32)C1 ZINC000377193265 941551354 /nfs/dbraw/zinc/55/13/54/941551354.db2.gz QQVXPIALSQUELJ-MRXNPFEDSA-N 0 0 350.378 3.599 20 5 FHBDRN CC(C)c1nnc(N(C)Cc2ccccc2[N+](=O)[O-])n1Cc1ccccc1 ZINC000549158514 941555869 /nfs/dbraw/zinc/55/58/69/941555869.db2.gz NRHBPQDJBJEHJX-UHFFFAOYSA-N 0 0 365.437 3.994 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H](c1ccccc1)c1cccnc1 ZINC000377209111 941562227 /nfs/dbraw/zinc/56/22/27/941562227.db2.gz VRXIRKQUVGJIEQ-LJQANCHMSA-N 0 0 363.373 3.518 20 5 FHBDRN C[C@@H](NC(=O)c1cc(O)ccc1C(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000189168237 941564868 /nfs/dbraw/zinc/56/48/68/941564868.db2.gz SFAODAYVPXMZLF-SECBINFHSA-N 0 0 354.284 3.810 20 5 FHBDRN CCO[C@H](CCNC(=O)Nc1ccc(OC)c([N+](=O)[O-])c1)C1CCCC1 ZINC000541105304 941597552 /nfs/dbraw/zinc/59/75/52/941597552.db2.gz JNHLJMSBRBCTKZ-MRXNPFEDSA-N 0 0 365.430 3.710 20 5 FHBDRN C[C@@H](OC(=O)c1cc(Cl)ccc1[N+](=O)[O-])C(=O)N(C)C1CCCCC1 ZINC000136165022 941599860 /nfs/dbraw/zinc/59/98/60/941599860.db2.gz YWVMJJOJYDHBHT-LLVKDONJSA-N 0 0 368.817 3.585 20 5 FHBDRN O=C(N[C@H](c1cccc2ccccc21)C(F)(F)F)c1c[nH]nc1[N+](=O)[O-] ZINC000549189982 941614647 /nfs/dbraw/zinc/61/46/47/941614647.db2.gz GMFQLMUNLMXYHK-CYBMUJFWSA-N 0 0 364.283 3.505 20 5 FHBDRN COC(=O)c1cc(C(=O)N2CCCC[C@@H]2CCC(C)C)cc([N+](=O)[O-])c1 ZINC000472713119 941617654 /nfs/dbraw/zinc/61/76/54/941617654.db2.gz QCXSWXMDYRWJRH-MRXNPFEDSA-N 0 0 362.426 3.812 20 5 FHBDRN CC(=O)Nc1cccc(C(=O)N2CCCCc3cc([N+](=O)[O-])ccc32)c1C ZINC000892852902 941619998 /nfs/dbraw/zinc/61/99/98/941619998.db2.gz FVKWCSNIYNKCTN-UHFFFAOYSA-N 0 0 367.405 3.845 20 5 FHBDRN Cn1cc(-c2ccc(C(=O)N3CCCCc4cc([N+](=O)[O-])ccc43)o2)cn1 ZINC000892855042 941622333 /nfs/dbraw/zinc/62/23/33/941622333.db2.gz QHBTZOXYZUXVMY-UHFFFAOYSA-N 0 0 366.377 3.571 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)N[C@@H]1CCCc2ccc(F)cc21 ZINC000549193264 941624142 /nfs/dbraw/zinc/62/41/42/941624142.db2.gz XVUNGQILDPKDPP-LJQANCHMSA-N 0 0 371.412 3.995 20 5 FHBDRN O=C(Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)[C@H]1C[C@H]1c1cccnc1 ZINC000377307809 941634355 /nfs/dbraw/zinc/63/43/55/941634355.db2.gz ZLOCKCFHNBGTPA-GJZGRUSLSA-N 0 0 366.402 3.856 20 5 FHBDRN O=C(Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)[C@@H]1C[C@@H]1c1cccnc1 ZINC000377307810 941634380 /nfs/dbraw/zinc/63/43/80/941634380.db2.gz ZLOCKCFHNBGTPA-HUUCEWRRSA-N 0 0 366.402 3.856 20 5 FHBDRN CNC(=O)c1ccc(NCc2cccc(COC(C)(C)C)c2)c([N+](=O)[O-])c1 ZINC000549215548 941653622 /nfs/dbraw/zinc/65/36/22/941653622.db2.gz BHBGHHDXWTYQDZ-UHFFFAOYSA-N 0 0 371.437 3.882 20 5 FHBDRN COC(=O)c1ccccc1C(=O)c1ccc(NCC[C@@H](C)F)c([N+](=O)[O-])c1 ZINC000549233174 941686353 /nfs/dbraw/zinc/68/63/53/941686353.db2.gz UQCCVHGZOSYEAS-GFCCVEGCSA-N 0 0 374.368 3.772 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]c(C(Cl)=Cc3nccn3CC(F)(F)F)nc2c1 ZINC000728700090 941687817 /nfs/dbraw/zinc/68/78/17/941687817.db2.gz LZYJMVNLUVYLMM-RMKNXTFCSA-N 0 0 371.706 3.967 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]c(C(Cl)=Cc3nccn3CC(F)(F)F)nc2c1 ZINC000728700092 941688353 /nfs/dbraw/zinc/68/83/53/941688353.db2.gz LZYJMVNLUVYLMM-TWGQIWQCSA-N 0 0 371.706 3.967 20 5 FHBDRN COc1cc(OCC(=O)OC[C@H]2CCCc3ccccc32)ccc1[N+](=O)[O-] ZINC000729216654 941693791 /nfs/dbraw/zinc/69/37/91/941693791.db2.gz BUZJCVFZZHBQCC-OAHLLOKOSA-N 0 0 371.389 3.646 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)NC[C@@H]1CSc2ccccc21 ZINC000452218216 941694340 /nfs/dbraw/zinc/69/43/40/941694340.db2.gz FOCAPMPOYIUZGB-CQSZACIVSA-N 0 0 371.462 3.793 20 5 FHBDRN O=C(Cn1ncc2ccc([N+](=O)[O-])cc21)OC[C@@H]1CCCc2ccccc21 ZINC000729220479 941694672 /nfs/dbraw/zinc/69/46/72/941694672.db2.gz XBLIJLZFRQRUOU-INIZCTEOSA-N 0 0 365.389 3.608 20 5 FHBDRN C[C@@H]1CN(C(=O)c2cc(Cl)ccc2[N+](=O)[O-])c2ccccc2N(C)C1=O ZINC000365565461 941696388 /nfs/dbraw/zinc/69/63/88/941696388.db2.gz ITNRODOQRVCUNJ-LLVKDONJSA-N 0 0 373.796 3.508 20 5 FHBDRN CC(=O)c1ccc(-c2nc(Cc3ccc([N+](=O)[O-])c(C)c3)no2)c(F)c1 ZINC000472764633 941708302 /nfs/dbraw/zinc/70/83/02/941708302.db2.gz CATGJBVFEXYPPS-UHFFFAOYSA-N 0 0 355.325 3.886 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2c3ccccc3OC[C@H]2C)ccc1[N+](=O)[O-] ZINC000415260629 941712234 /nfs/dbraw/zinc/71/22/34/941712234.db2.gz FXZMQFRDWYMSKL-CYBMUJFWSA-N 0 0 356.378 3.810 20 5 FHBDRN COCc1cc([N+](=O)[O-])ccc1NCCc1cc(C(F)(F)F)ccn1 ZINC000549244221 941722123 /nfs/dbraw/zinc/72/21/23/941722123.db2.gz DWLGCZMKSJIDCI-UHFFFAOYSA-N 0 0 355.316 3.810 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H](CC)Oc2cccc(C)c2)c1 ZINC000549243747 941724173 /nfs/dbraw/zinc/72/41/73/941724173.db2.gz HOZTVWUMQUCGGK-OAHLLOKOSA-N 0 0 372.421 3.889 20 5 FHBDRN COc1cc2nc(C)sc2cc1NC(=O)c1cc([N+](=O)[O-])ccc1F ZINC000726761407 941728679 /nfs/dbraw/zinc/72/86/79/941728679.db2.gz FFEGFWQMKMUIDC-UHFFFAOYSA-N 0 0 361.354 3.913 20 5 FHBDRN C[C@@H](NC(=O)c1c(Cl)cccc1[N+](=O)[O-])c1nccn1-c1ccccc1 ZINC000377447917 941730866 /nfs/dbraw/zinc/73/08/66/941730866.db2.gz UGHNXXXFZYOTPS-GFCCVEGCSA-N 0 0 370.796 3.925 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)[C@@H]2COCC[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000415292477 941732978 /nfs/dbraw/zinc/73/29/78/941732978.db2.gz HEXWWSAANIQFST-KFKAGJAMSA-N 0 0 368.433 3.901 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1OC(F)F)N1CCS[C@@H]2CCCC[C@@H]21 ZINC000182341220 941737831 /nfs/dbraw/zinc/73/78/31/941737831.db2.gz YBVXPWAVXIVJPV-GXTWGEPZSA-N 0 0 372.393 3.696 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)Nc2cc(Cl)c(OC)cc2OC)c1 ZINC000067298394 941738241 /nfs/dbraw/zinc/73/82/41/941738241.db2.gz XJURNDQCXIZMLX-UHFFFAOYSA-N 0 0 366.757 3.526 20 5 FHBDRN CCc1c(C(=O)Nc2cccc([N+](=O)[O-])c2)cnn1-c1ccc(F)cc1 ZINC000024484727 941760894 /nfs/dbraw/zinc/76/08/94/941760894.db2.gz ZDDTUIJAMCJJKQ-UHFFFAOYSA-N 0 0 354.341 3.734 20 5 FHBDRN C[C@@H]([C@H]1Cc2ccccc2O1)N(C)C(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000433565963 941767457 /nfs/dbraw/zinc/76/74/57/941767457.db2.gz XVVUXOZPDHCKIG-KPZWWZAWSA-N 0 0 366.373 3.805 20 5 FHBDRN Cc1cc(NC(=O)NC[C@@H]2CCCN(c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000433593779 941780856 /nfs/dbraw/zinc/78/08/56/941780856.db2.gz KZMRRKFPXADGMW-INIZCTEOSA-N 0 0 368.437 3.941 20 5 FHBDRN COC(=O)c1ccc(CNC(=O)c2cc3ccccc3c3cccnc23)o1 ZINC000513213530 941784440 /nfs/dbraw/zinc/78/44/40/941784440.db2.gz UTQCDOOQORLYLQ-UHFFFAOYSA-N 0 0 360.369 3.698 20 5 FHBDRN C[C@@H]1C[C@@H](CCNc2ncc(Br)cc2[N+](=O)[O-])C[C@H](C)O1 ZINC000549261654 941785121 /nfs/dbraw/zinc/78/51/21/941785121.db2.gz UTEZYWVIVIHQBB-JGPRNRPPSA-N 0 0 358.236 3.758 20 5 FHBDRN O=C(Nc1ccc(O[C@@H]2CCOC2)cc1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412119635 941802170 /nfs/dbraw/zinc/80/21/70/941802170.db2.gz GNHDXQWNGGEYHD-CEXWTWQISA-N 0 0 368.389 3.505 20 5 FHBDRN COc1ccc(S(=O)(=O)Oc2ccc(C(C)(C)C)cc2)c([N+](=O)[O-])c1 ZINC000024258374 941802951 /nfs/dbraw/zinc/80/29/51/941802951.db2.gz ZVRNDPVYAISPDU-UHFFFAOYSA-N 0 0 365.407 3.669 20 5 FHBDRN CCC(CC)[C@H]1C[C@H](NC(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)CCO1 ZINC000190064503 941803241 /nfs/dbraw/zinc/80/32/41/941803241.db2.gz MFVVCYNUGHSADV-CRAIPNDOSA-N 0 0 364.442 3.625 20 5 FHBDRN CCc1cc(NC(=O)C(C)(C)CC(F)F)c2cc([N+](=O)[O-])ccc2n1 ZINC000415402892 941806111 /nfs/dbraw/zinc/80/61/11/941806111.db2.gz RJYWWIXRGSXUCR-UHFFFAOYSA-N 0 0 351.353 3.747 20 5 FHBDRN CN(C(=O)c1ccc([N+](=O)[O-])s1)C1CCN(c2cccc(F)c2)CC1 ZINC000365592103 941806438 /nfs/dbraw/zinc/80/64/38/941806438.db2.gz HZGXLSSMYPOTJJ-UHFFFAOYSA-N 0 0 363.414 3.536 20 5 FHBDRN Cc1c(C(=O)NCc2ccc([N+](=O)[O-])cc2)cnn1-c1cc(C)ccc1C ZINC000120187299 941808387 /nfs/dbraw/zinc/80/83/87/941808387.db2.gz ZRJFCQJCBZJCAW-UHFFFAOYSA-N 0 0 364.405 3.636 20 5 FHBDRN CC(C)c1ccc(C(=O)NC[C@@H](CCO)c2ccccc2)cc1[N+](=O)[O-] ZINC000190068437 941808750 /nfs/dbraw/zinc/80/87/50/941808750.db2.gz AHXZQXMSFTYLDO-QGZVFWFLSA-N 0 0 356.422 3.614 20 5 FHBDRN O=C(NCc1ccccc1OCC1CC1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412126892 941810224 /nfs/dbraw/zinc/81/02/24/941810224.db2.gz PTXIGEYLQPLAGF-RBUKOAKNSA-N 0 0 366.417 3.804 20 5 FHBDRN CO[C@H](C)CN(C)[C@@H](C(=O)Nc1ccc(C)cc1[N+](=O)[O-])c1ccccc1 ZINC000513261803 941814945 /nfs/dbraw/zinc/81/49/45/941814945.db2.gz POCKKXRNSVBWOG-DNVCBOLYSA-N 0 0 371.437 3.550 20 5 FHBDRN CN(C[C@H]1CCC[C@H]1O)C(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 ZINC000129332515 941816538 /nfs/dbraw/zinc/81/65/38/941816538.db2.gz CVDKRCAXAXULDA-RDTXWAMCSA-N 0 0 370.405 3.620 20 5 FHBDRN O=c1ccc([N+](=O)[O-])cn1CCSCc1c(Cl)cccc1Cl ZINC000513266047 941817185 /nfs/dbraw/zinc/81/71/85/941817185.db2.gz FTNFMVHLNDGWFJ-UHFFFAOYSA-N 0 0 359.234 3.997 20 5 FHBDRN CC1CCC(OC2CCN(C(=O)c3csc([N+](=O)[O-])c3)CC2)CC1 ZINC000377578398 941817246 /nfs/dbraw/zinc/81/72/46/941817246.db2.gz ARARXASUFWUBAD-UHFFFAOYSA-N 0 0 352.456 3.856 20 5 FHBDRN CCCCN(C(=O)CCn1cc([N+](=O)[O-])cn1)[C@H](CC)c1ccccc1 ZINC000513294204 941833189 /nfs/dbraw/zinc/83/31/89/941833189.db2.gz OJJIHKVKXOMXBZ-GOSISDBHSA-N 0 0 358.442 3.961 20 5 FHBDRN COc1ccc(CN(Cc2ccnc(OC(C)C)c2)C2CC2)cc1[N+](=O)[O-] ZINC000513309310 941839812 /nfs/dbraw/zinc/83/98/12/941839812.db2.gz AJUBIJRDCRPWQV-UHFFFAOYSA-N 0 0 371.437 3.950 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N(Cc2ccc(F)cc2F)C2CC2)c1[N+](=O)[O-] ZINC000433702736 941840818 /nfs/dbraw/zinc/84/08/18/941840818.db2.gz MOGMSYKDODKXGK-UHFFFAOYSA-N 0 0 364.352 3.524 20 5 FHBDRN CC(=O)N1C[C@@H](C)CN(C(=O)c2cc([N+](=O)[O-])ccc2C)c2ccccc21 ZINC000365617045 941847648 /nfs/dbraw/zinc/84/76/48/941847648.db2.gz DVBKRMKAPKKPML-CYBMUJFWSA-N 0 0 367.405 3.553 20 5 FHBDRN CCOC(=O)c1cc(NCc2ccc3c(c2)OCCCO3)ccc1[N+](=O)[O-] ZINC000433716339 941848192 /nfs/dbraw/zinc/84/81/92/941848192.db2.gz ASLSVOOBLKKVQD-UHFFFAOYSA-N 0 0 372.377 3.545 20 5 FHBDRN CC(=O)c1cccc(OCCCC(=O)Oc2c(C)cccc2[N+](=O)[O-])c1 ZINC000760014473 941856360 /nfs/dbraw/zinc/85/63/60/941856360.db2.gz GICSNAYADSJEJM-UHFFFAOYSA-N 0 0 357.362 3.870 20 5 FHBDRN CCCOc1ccccc1N[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000433727056 941857957 /nfs/dbraw/zinc/85/79/57/941857957.db2.gz LWOFSWJJVBQVKD-QGZVFWFLSA-N 0 0 355.394 3.601 20 5 FHBDRN O=C(c1ccc(OC(F)F)c([N+](=O)[O-])c1)N1CC[C@H](CC(F)(F)F)C1 ZINC000433731156 941860136 /nfs/dbraw/zinc/86/01/36/941860136.db2.gz PSPBHKITZACIIX-MRVPVSSYSA-N 0 0 368.258 3.611 20 5 FHBDRN CN(Cc1nc2c(s1)CCCC2)C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412173115 941862633 /nfs/dbraw/zinc/86/26/33/941862633.db2.gz VIRCHSKZHUSLRS-LSDHHAIUSA-N 0 0 371.462 3.692 20 5 FHBDRN CC1(C)C[C@@H](C(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)c2ccccc2O1 ZINC000412174391 941863354 /nfs/dbraw/zinc/86/33/54/941863354.db2.gz PIPOYNLKNDQBJY-GOSISDBHSA-N 0 0 366.417 3.824 20 5 FHBDRN Cc1cc(F)cc2[nH]c(C(=O)N(C)CCc3cccc([N+](=O)[O-])c3)cc21 ZINC000513344152 941865627 /nfs/dbraw/zinc/86/56/27/941865627.db2.gz YCKYLOGLRCHKPI-UHFFFAOYSA-N 0 0 355.369 3.838 20 5 FHBDRN C[C@H](c1cccnc1)N1CCN(Cc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000119221656 941870692 /nfs/dbraw/zinc/87/06/92/941870692.db2.gz HYOSABLUMUJNTL-CQSZACIVSA-N 0 0 360.845 3.522 20 5 FHBDRN CC(C)c1[nH]nc(C(=O)N(C)c2cccc(OC(F)(F)F)c2)c1[N+](=O)[O-] ZINC000433757662 941871083 /nfs/dbraw/zinc/87/10/83/941871083.db2.gz PAIHRNPFVPXEDQ-UHFFFAOYSA-N 0 0 372.303 3.617 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)c1cn(C)c2ccc(F)cc12 ZINC000513353490 941872896 /nfs/dbraw/zinc/87/28/96/941872896.db2.gz KEFHVTWIVJKOHB-UHFFFAOYSA-N 0 0 355.369 3.540 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CCc2c(F)ccc(F)c2C1 ZINC000412182121 941881590 /nfs/dbraw/zinc/88/15/90/941881590.db2.gz ZDOOXGQHRJWERZ-LSDHHAIUSA-N 0 0 358.344 3.561 20 5 FHBDRN O=C(c1ccc(N2CCCCC2)cc1)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000119546032 941887220 /nfs/dbraw/zinc/88/72/20/941887220.db2.gz USOJDLDEKSGOKT-UHFFFAOYSA-N 0 0 365.433 3.784 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N[C@H](C)c2ccc(F)cc2Cl)c1[N+](=O)[O-] ZINC000433773361 941891864 /nfs/dbraw/zinc/89/18/64/941891864.db2.gz GGNKKMPADFZQCW-MRVPVSSYSA-N 0 0 354.769 3.725 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N2CCS[C@H](C)[C@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000433774004 941892174 /nfs/dbraw/zinc/89/21/74/941892174.db2.gz JQATXORCOVHWCU-WBMJQRKESA-N 0 0 374.466 3.760 20 5 FHBDRN Cc1ccc(CN(C(C)C)S(=O)(=O)c2csc([N+](=O)[O-])c2)s1 ZINC000119646006 941893544 /nfs/dbraw/zinc/89/35/44/941893544.db2.gz QHGRNOKKAZHCDV-UHFFFAOYSA-N 0 0 360.482 3.626 20 5 FHBDRN CO[C@H]1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2NCc2ccccc2)C1 ZINC000472832165 941895701 /nfs/dbraw/zinc/89/57/01/941895701.db2.gz ZVGVDDZMRHALRJ-WBVHZDCISA-N 0 0 369.421 3.504 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N(C)[C@@H](C)c2sc(C)nc2C)c1 ZINC000549305189 941899618 /nfs/dbraw/zinc/89/96/18/941899618.db2.gz CMVXAIYULRYOII-NSHDSACASA-N 0 0 363.439 3.900 20 5 FHBDRN O=C(NOCc1c(F)cccc1[N+](=O)[O-])c1cccc(C(F)(F)F)c1 ZINC000103462982 941900333 /nfs/dbraw/zinc/90/03/33/941900333.db2.gz HBINEGHOUNNNSP-UHFFFAOYSA-N 0 0 358.247 3.614 20 5 FHBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)N1CCc2ccc(F)cc2C1 ZINC000433807947 941904582 /nfs/dbraw/zinc/90/45/82/941904582.db2.gz MZAMOCCSGPRRLD-UHFFFAOYSA-N 0 0 371.412 3.825 20 5 FHBDRN C[C@H]([C@@H]1Cc2ccccc2O1)N(C)C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412201416 941906507 /nfs/dbraw/zinc/90/65/07/941906507.db2.gz QWHGHQXDUKXCGN-DDDRJPGCSA-N 0 0 366.417 3.549 20 5 FHBDRN CCC(CC)OC(=O)c1cc([N+](=O)[O-])ccc1I ZINC000721652785 941908853 /nfs/dbraw/zinc/90/88/53/941908853.db2.gz LEKCBYNKBAQCHB-UHFFFAOYSA-N 0 0 363.151 3.545 20 5 FHBDRN O=C(NCCOc1ccccc1Cl)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412206959 941912877 /nfs/dbraw/zinc/91/28/77/941912877.db2.gz MQZYRZKTTWCJRB-LSDHHAIUSA-N 0 0 360.797 3.547 20 5 FHBDRN Cn1cc(CNC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)c(-c2ccccc2)n1 ZINC000122596966 941916380 /nfs/dbraw/zinc/91/63/80/941916380.db2.gz GBYLSAMZZFVJHV-UHFFFAOYSA-N 0 0 370.796 3.579 20 5 FHBDRN Cc1cn([C@H](C)c2ccccc2)nc1NC(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000472838118 941917392 /nfs/dbraw/zinc/91/73/92/941917392.db2.gz LKHCNBKWVZZVMN-OAHLLOKOSA-N 0 0 364.405 3.890 20 5 FHBDRN CCCc1n[nH]c(C(=O)N(C)Cc2ccc(Cl)cc2Cl)c1[N+](=O)[O-] ZINC000609459646 941924880 /nfs/dbraw/zinc/92/48/80/941924880.db2.gz YMFXDQGPMSLUNI-UHFFFAOYSA-N 0 0 371.224 3.849 20 5 FHBDRN CC(C)c1[nH]nc(C(=O)Nc2ncc(Cc3ccccc3)s2)c1[N+](=O)[O-] ZINC000433827514 941924968 /nfs/dbraw/zinc/92/49/68/941924968.db2.gz ZONFEBPIZYGNHQ-UHFFFAOYSA-N 0 0 371.422 3.741 20 5 FHBDRN Cc1c(CC(=O)N[C@H]2CCO[C@H]2c2ccc(Cl)cc2)cccc1[N+](=O)[O-] ZINC000182451213 941926125 /nfs/dbraw/zinc/92/61/25/941926125.db2.gz JVIKJRHQWCXVQS-LPHOPBHVSA-N 0 0 374.824 3.746 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N(Cc2ccc([C@@H]3C[C@@H]3C)o2)C2CC2)c1[N+](=O)[O-] ZINC000433830077 941926143 /nfs/dbraw/zinc/92/61/43/941926143.db2.gz HCJATALRSNIZOF-SMDDNHRTSA-N 0 0 372.425 3.963 20 5 FHBDRN CC1(C)C[C@H](C(=O)NCCc2cccc([N+](=O)[O-])c2)c2ccccc2O1 ZINC000412217842 941926173 /nfs/dbraw/zinc/92/61/73/941926173.db2.gz MAHLZOQKLKQPSP-KRWDZBQOSA-N 0 0 354.406 3.598 20 5 FHBDRN O=C(Nc1nc2ccccc2c(=O)[nH]1)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000517524827 941930374 /nfs/dbraw/zinc/93/03/74/941930374.db2.gz HGGJKYXPURQDBN-UHFFFAOYSA-N 0 0 366.358 3.711 20 5 FHBDRN CC(C)Oc1cc(C(=O)N[C@@H](CCCO)c2ccccc2)ccc1[N+](=O)[O-] ZINC000412225652 941940445 /nfs/dbraw/zinc/94/04/45/941940445.db2.gz GCHZYSBGXBGCJO-KRWDZBQOSA-N 0 0 372.421 3.626 20 5 FHBDRN CC(C)CCSc1ccc(C(=O)N[C@H](C)c2ncon2)cc1[N+](=O)[O-] ZINC000182545340 941941610 /nfs/dbraw/zinc/94/16/10/941941610.db2.gz XHFDLYZPCOCYCG-LLVKDONJSA-N 0 0 364.427 3.607 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCN(C(=O)c2cccc(F)c2)CC1 ZINC000182612564 941947248 /nfs/dbraw/zinc/94/72/48/941947248.db2.gz KVCGSUMDHNOCRN-HNNXBMFYSA-N 0 0 371.412 3.561 20 5 FHBDRN Cc1nn(-c2ccccc2)cc1NC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000182621399 941947860 /nfs/dbraw/zinc/94/78/60/941947860.db2.gz FJXIFNICKCYOLE-UHFFFAOYSA-N 0 0 356.769 3.995 20 5 FHBDRN Cc1cc(=NC(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)[nH]n1[C@@H](C)C1CC1 ZINC000412238428 941950493 /nfs/dbraw/zinc/95/04/93/941950493.db2.gz ABVDWQXQFCOCDX-ZDUSSCGKSA-N 0 0 372.425 3.532 20 5 FHBDRN CC(C)c1[nH]nc(C(=O)Nc2ccccc2N2CCCCC2)c1[N+](=O)[O-] ZINC000433872623 941950616 /nfs/dbraw/zinc/95/06/16/941950616.db2.gz LYKUIYWHRODYJE-UHFFFAOYSA-N 0 0 357.414 3.684 20 5 FHBDRN Cc1ccc(C2CCN(C(=O)[C@@H]3C[C@H]3c3ccc([N+](=O)[O-])cc3)CC2)cn1 ZINC000412240762 941950980 /nfs/dbraw/zinc/95/09/80/941950980.db2.gz GWPWLGJXOFJSBA-VQTJNVASSA-N 0 0 365.433 3.808 20 5 FHBDRN CC(C)Oc1cc(C(=O)Nc2cccc3c2OCCC3=O)ccc1[N+](=O)[O-] ZINC000412242856 941953867 /nfs/dbraw/zinc/95/38/67/941953867.db2.gz DVRVVQSOBBZKGH-UHFFFAOYSA-N 0 0 370.361 3.600 20 5 FHBDRN CCC(CC)[C@@H]1C[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)CCO1 ZINC000412244220 941955744 /nfs/dbraw/zinc/95/57/44/941955744.db2.gz OOKDBEWEOWHMKI-KANFNMMFSA-N 0 0 360.454 3.798 20 5 FHBDRN CCC(CC)[C@H]1C[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)CCO1 ZINC000412244218 941955752 /nfs/dbraw/zinc/95/57/52/941955752.db2.gz OOKDBEWEOWHMKI-GDAAHCPNSA-N 0 0 360.454 3.798 20 5 FHBDRN Cc1sc(NC(=O)CCOCC2CC2)nc1-c1cccc([N+](=O)[O-])c1 ZINC000433875365 941959451 /nfs/dbraw/zinc/95/94/51/941959451.db2.gz QTSCIKQVTTVKNJ-UHFFFAOYSA-N 0 0 361.423 3.782 20 5 FHBDRN O=C(N[C@H]1CCCOc2cc(F)ccc21)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412250677 941961018 /nfs/dbraw/zinc/96/10/18/941961018.db2.gz VXKUQUURCCWIRC-KSZLIROESA-N 0 0 370.380 3.868 20 5 FHBDRN Cc1cc(NC(=O)N(CCO)[C@H]2CCCc3ccccc32)ccc1[N+](=O)[O-] ZINC000182766468 941966801 /nfs/dbraw/zinc/96/68/01/941966801.db2.gz JCPDSJSTLNKUTL-IBGZPJMESA-N 0 0 369.421 3.807 20 5 FHBDRN Nc1cccc(C2CCN(C(=O)Nc3cc(F)cc([N+](=O)[O-])c3)CC2)c1 ZINC000415630850 941968741 /nfs/dbraw/zinc/96/87/41/941968741.db2.gz LOMYFVWZTZOSPG-UHFFFAOYSA-N 0 0 358.373 3.728 20 5 FHBDRN CC1(C)SC[C@@H]1NC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000549336220 941998748 /nfs/dbraw/zinc/99/87/48/941998748.db2.gz UYWHDKKVINKPCL-KRWDZBQOSA-N 0 0 371.462 3.831 20 5 FHBDRN Cc1c(Br)cccc1NC(=O)c1n[nH]c(C(C)C)c1[N+](=O)[O-] ZINC000433938605 942004309 /nfs/dbraw/zinc/00/43/09/942004309.db2.gz BJHLMAGKUYZSTQ-UHFFFAOYSA-N 0 0 367.203 3.765 20 5 FHBDRN CC(C)Oc1cc(C(=O)Nc2ncn(C3CCCCC3)n2)ccc1[N+](=O)[O-] ZINC000412263273 942012344 /nfs/dbraw/zinc/01/23/44/942012344.db2.gz YKMYRAQDWONVNZ-UHFFFAOYSA-N 0 0 373.413 3.731 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N[C@@H](C)CCCC(F)(F)F)c1F ZINC000412279741 942020640 /nfs/dbraw/zinc/02/06/40/942020640.db2.gz BNBKXNIBWHZXFY-VIFPVBQESA-N 0 0 366.311 3.522 20 5 FHBDRN C[C@H](NCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1nccn1-c1ccccc1 ZINC000377868159 942046330 /nfs/dbraw/zinc/04/63/30/942046330.db2.gz GBXHEWFKYGMFKG-ZDUSSCGKSA-N 0 0 367.365 3.540 20 5 FHBDRN Cn1c(SCc2coc(-c3ccc([N+](=O)[O-])cc3)n2)nnc1C1CCC1 ZINC000513630664 942046533 /nfs/dbraw/zinc/04/65/33/942046533.db2.gz RBZXZPLUPSXFQX-UHFFFAOYSA-N 0 0 371.422 3.938 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)Nc1c(C)cccc1OC(F)F ZINC000102258382 942048112 /nfs/dbraw/zinc/04/81/12/942048112.db2.gz DBBPLSYXWHKMAB-UHFFFAOYSA-N 0 0 352.293 3.766 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC(O)(c2ccccc2C)CC1 ZINC000377896484 942054984 /nfs/dbraw/zinc/05/49/84/942054984.db2.gz DDUMLZFVYFAEQY-UHFFFAOYSA-N 0 0 369.421 3.727 20 5 FHBDRN Cc1nc2c(s1)[C@@H](Nc1c3ccccc3n(C)c(=O)c1[N+](=O)[O-])CCC2 ZINC000893110732 942056883 /nfs/dbraw/zinc/05/68/83/942056883.db2.gz NSZSQLNJHBPTAV-ZDUSSCGKSA-N 0 0 370.434 3.701 20 5 FHBDRN Cn1ccnc1[C@@H](NCc1cccc(Cl)c1)c1ccc([N+](=O)[O-])cc1 ZINC000513655751 942058251 /nfs/dbraw/zinc/05/82/51/942058251.db2.gz OENRVEVIVIKCHD-KRWDZBQOSA-N 0 0 356.813 3.861 20 5 FHBDRN Cc1cccc2c1OCC[C@H]2NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412281605 942059752 /nfs/dbraw/zinc/05/97/52/942059752.db2.gz OFADFSHRHUCFMP-RCCFBDPRSA-N 0 0 352.390 3.647 20 5 FHBDRN C[C@@H](NC(=O)COc1ccc(F)cc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000102600007 942072503 /nfs/dbraw/zinc/07/25/03/942072503.db2.gz ZYCDKJDXULZMLY-SNVBAGLBSA-N 0 0 352.749 3.644 20 5 FHBDRN COC(=O)c1ccccc1CCC(=O)Nc1cc([N+](=O)[O-])c(C)cc1C ZINC000536251932 942072759 /nfs/dbraw/zinc/07/27/59/942072759.db2.gz AMVKAWFNAPPUMJ-UHFFFAOYSA-N 0 0 356.378 3.570 20 5 FHBDRN CCCCN(Cc1ccccc1Cl)C(=O)CCn1cc([N+](=O)[O-])cn1 ZINC000102613752 942074508 /nfs/dbraw/zinc/07/45/08/942074508.db2.gz ZWOBBJGVTIKIAJ-UHFFFAOYSA-N 0 0 364.833 3.664 20 5 FHBDRN CC(=O)Nc1ccc(Cl)cc1NC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc21 ZINC000102638578 942076953 /nfs/dbraw/zinc/07/69/53/942076953.db2.gz PCWKWCLVFRTIKZ-UHFFFAOYSA-N 0 0 372.768 3.940 20 5 FHBDRN CC(C)(C)OC(=O)[C@]1(C)CCN(c2nccc3cc([N+](=O)[O-])ccc32)C1 ZINC000413352623 942083511 /nfs/dbraw/zinc/08/35/11/942083511.db2.gz CYAYBIAEVDXPTE-LJQANCHMSA-N 0 0 357.410 3.701 20 5 FHBDRN O=[N+]([O-])c1c(N[C@@H]2CCO[C@@H](c3cccs3)C2)nc2sccn21 ZINC000413352157 942083597 /nfs/dbraw/zinc/08/35/97/942083597.db2.gz MSBWAJIERVWFOV-NXEZZACHSA-N 0 0 350.425 3.698 20 5 FHBDRN Cc1[nH]c(-c2ccccc2)nc1C(=O)OCCOc1ccccc1[N+](=O)[O-] ZINC000728724672 942088734 /nfs/dbraw/zinc/08/87/34/942088734.db2.gz DIIRDEGJCXWPHA-UHFFFAOYSA-N 0 0 367.361 3.529 20 5 FHBDRN O=[N+]([O-])c1cc2c(ncnc2N[C@@H]2CCO[C@@H](c3cccs3)C2)s1 ZINC000413355320 942089885 /nfs/dbraw/zinc/08/98/85/942089885.db2.gz RYXKRPJSKHLTHJ-MWLCHTKSSA-N 0 0 362.436 3.993 20 5 FHBDRN C[C@H](C1CCCCC1)N(C)S(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC001211650898 942092957 /nfs/dbraw/zinc/09/29/57/942092957.db2.gz BUUVDFBCFZCFSX-LLVKDONJSA-N 0 0 360.863 3.838 20 5 FHBDRN CCc1nn(C)c(N[C@@H]2C[C@H]2c2ccc(Br)s2)c1[N+](=O)[O-] ZINC000480858309 942094195 /nfs/dbraw/zinc/09/41/95/942094195.db2.gz QYNJETZIWHXSBG-VXNVDRBHSA-N 0 0 371.260 3.683 20 5 FHBDRN O=C(NCC1CCC(F)CC1)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000843728014 942095850 /nfs/dbraw/zinc/09/58/50/942095850.db2.gz ZARWTPQJYFFFQC-UHFFFAOYSA-N 0 0 359.195 3.615 20 5 FHBDRN C[C@@H]1CN(C(=O)c2cccc3c(=O)c4ccccc4[nH]c23)C[C@H](C2CC2)O1 ZINC000280085816 942099525 /nfs/dbraw/zinc/09/95/25/942099525.db2.gz QLMSSKJGKCEUFT-BFUOFWGJSA-N 0 0 362.429 3.733 20 5 FHBDRN Cc1cnc(C)c(NCCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])n1 ZINC000501878712 942099632 /nfs/dbraw/zinc/09/96/32/942099632.db2.gz DTJVNKMYIRLDPQ-UHFFFAOYSA-N 0 0 355.320 3.544 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1CCO[C@H](c2ccccc2)C1 ZINC000280071503 942102104 /nfs/dbraw/zinc/10/21/04/942102104.db2.gz QKCXOSQKURBSSM-YJBOKZPZSA-N 0 0 370.405 3.644 20 5 FHBDRN CC(C)c1ccc(C(=O)N2CCO[C@@H](c3ccsc3)C2)cc1[N+](=O)[O-] ZINC000190096481 942102871 /nfs/dbraw/zinc/10/28/71/942102871.db2.gz DHXBJPBCBRXZHF-QGZVFWFLSA-N 0 0 360.435 3.993 20 5 FHBDRN CC(C)c1ccc(C(=O)N(C)CCC(=O)OC(C)(C)C)cc1[N+](=O)[O-] ZINC000190097692 942102923 /nfs/dbraw/zinc/10/29/23/942102923.db2.gz LXRLVYBPDLGRKL-UHFFFAOYSA-N 0 0 350.415 3.522 20 5 FHBDRN Cc1cc([N+](=O)[O-])cnc1N1CCC[C@H]1c1ccc(Br)cn1 ZINC000413369640 942104102 /nfs/dbraw/zinc/10/41/02/942104102.db2.gz GRSDNSALNQXDTG-AWEZNQCLSA-N 0 0 363.215 3.797 20 5 FHBDRN CCCOc1ccc([C@@H](C)Nc2c(C(N)=O)cccc2[N+](=O)[O-])cc1OC ZINC000420584531 942107857 /nfs/dbraw/zinc/10/78/57/942107857.db2.gz KWZAHMFMKGMJJN-GFCCVEGCSA-N 0 0 373.409 3.664 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1OC(=O)c1cccc(NC(=O)[C@@H]2C[C@H]2C)c1 ZINC000760015693 942114131 /nfs/dbraw/zinc/11/41/31/942114131.db2.gz HFTVVQIRBZQXRK-IUODEOHRSA-N 0 0 354.362 3.717 20 5 FHBDRN CCOc1cc(C(=O)N[C@H](CC)c2ccccc2)c([N+](=O)[O-])cc1OC ZINC000415893415 942121288 /nfs/dbraw/zinc/12/12/88/942121288.db2.gz KPWDIRQLOPDVIG-OAHLLOKOSA-N 0 0 358.394 3.883 20 5 FHBDRN O=C(c1ccccc1)c1ccc(N2CC[C@H](O)CC23CCC3)c([N+](=O)[O-])c1 ZINC000420629709 942126785 /nfs/dbraw/zinc/12/67/85/942126785.db2.gz CXTPOUWOBGFUGG-KRWDZBQOSA-N 0 0 366.417 3.710 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2noc(N3CCC[C@@H](CC(F)(F)F)C3)n2)cc1 ZINC000420619577 942135223 /nfs/dbraw/zinc/13/52/23/942135223.db2.gz FTEXRNLBLPWUKQ-JTQLQIEISA-N 0 0 356.304 3.814 20 5 FHBDRN CC(=O)c1cc(N2C[C@H](C(=O)OC(C)(C)C)C[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000420643449 942138815 /nfs/dbraw/zinc/13/88/15/942138815.db2.gz UJIDGEXOGXEREY-GXTWGEPZSA-N 0 0 362.426 3.602 20 5 FHBDRN CCOc1ccccc1CN[C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000513690802 942144536 /nfs/dbraw/zinc/14/45/36/942144536.db2.gz MKEFWZDEXHHPFY-LJQANCHMSA-N 0 0 366.421 3.606 20 5 FHBDRN O=C(Cc1cc(F)c(Cl)cc1[N+](=O)[O-])N1CC[C@H](CC(F)(F)F)C1 ZINC000280263175 942145582 /nfs/dbraw/zinc/14/55/82/942145582.db2.gz UHHLKYRLKRSYKJ-MRVPVSSYSA-N 0 0 368.714 3.731 20 5 FHBDRN CC(C)c1ccc(C(=O)Nc2cc([C@H]3CCCOC3)[nH]n2)cc1[N+](=O)[O-] ZINC000280267458 942147156 /nfs/dbraw/zinc/14/71/56/942147156.db2.gz ZLLPBPYPWMPKSK-ZDUSSCGKSA-N 0 0 358.398 3.588 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1CCOC2(CCCCC2)C1 ZINC000280281565 942149658 /nfs/dbraw/zinc/14/96/58/942149658.db2.gz YWMUQDYWSSXOAG-CQSZACIVSA-N 0 0 362.426 3.605 20 5 FHBDRN CO[C@H]1CCC[C@H](CC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000280298538 942154002 /nfs/dbraw/zinc/15/40/02/942154002.db2.gz NXBKKKXCQWOBGC-JQWIXIFHSA-N 0 0 358.341 3.730 20 5 FHBDRN O=C(c1cc(N[C@@H]2C[C@H]2c2ccccc2F)ccc1[N+](=O)[O-])N1CCCC1 ZINC000413415324 942161359 /nfs/dbraw/zinc/16/13/59/942161359.db2.gz WLNJJGQPIAKIRP-MAUKXSAKSA-N 0 0 369.396 3.938 20 5 FHBDRN Nc1ccc(F)c(NC(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000415928509 942164720 /nfs/dbraw/zinc/16/47/20/942164720.db2.gz XYNOVCFBCGXNQA-CYBMUJFWSA-N 0 0 358.373 3.728 20 5 FHBDRN Cc1ccc(C(=O)Nc2cc3c(cc2[N+](=O)[O-])OCCCO3)cc1Cl ZINC000102980786 942166516 /nfs/dbraw/zinc/16/65/16/942166516.db2.gz ODDTZSIHHWZKPD-UHFFFAOYSA-N 0 0 362.769 3.970 20 5 FHBDRN CC[C@](C)(NC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F)c1nccs1 ZINC000183013201 942173669 /nfs/dbraw/zinc/17/36/69/942173669.db2.gz PUNYKCIBVQUWKJ-HNNXBMFYSA-N 0 0 371.365 3.708 20 5 FHBDRN COc1ccc(CN(C)C(=O)c2cc(SC)ccc2[N+](=O)[O-])cc1C ZINC000103022722 942183370 /nfs/dbraw/zinc/18/33/70/942183370.db2.gz NTDXEVKCHNUCMW-UHFFFAOYSA-N 0 0 360.435 3.906 20 5 FHBDRN Cc1cc(F)cc2c1CN(C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)CC2 ZINC000412316827 942183832 /nfs/dbraw/zinc/18/38/32/942183832.db2.gz CMLVMUNZYPDSAN-ZWKOTPCHSA-N 0 0 354.381 3.731 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@@H](CC(F)F)c1ccccc1 ZINC000420739127 942187151 /nfs/dbraw/zinc/18/71/51/942187151.db2.gz OQXYBEIXYLAXDQ-AWEZNQCLSA-N 0 0 370.377 3.578 20 5 FHBDRN Cc1ccnc(C2CCN(c3c4cc(F)ccc4ncc3[N+](=O)[O-])CC2)n1 ZINC000893157959 942191841 /nfs/dbraw/zinc/19/18/41/942191841.db2.gz MAKAAVJUAFKOCX-UHFFFAOYSA-N 0 0 367.384 3.765 20 5 FHBDRN C[C@@H](CNC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-])CC(F)(F)F ZINC000413446308 942192598 /nfs/dbraw/zinc/19/25/98/942192598.db2.gz YSLGQQZYOIOOHS-SECBINFHSA-N 0 0 367.755 3.678 20 5 FHBDRN COCCC[C@@H](C)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000280522947 942196665 /nfs/dbraw/zinc/19/66/65/942196665.db2.gz GHUJGIXBVDMYDX-SECBINFHSA-N 0 0 359.220 3.667 20 5 FHBDRN CN(C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2)c1c(Cl)cccc1Cl ZINC000183165156 942200253 /nfs/dbraw/zinc/20/02/53/942200253.db2.gz LSKTUNFBPLOLRD-UHFFFAOYSA-N 0 0 369.160 3.907 20 5 FHBDRN CCn1ccnc1[C@@H]1CCCCN1C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000280556919 942201590 /nfs/dbraw/zinc/20/15/90/942201590.db2.gz NMFVDHFLENFHJK-INIZCTEOSA-N 0 0 357.414 3.879 20 5 FHBDRN CCNc1ccc(Cl)cc1NC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000183168467 942202188 /nfs/dbraw/zinc/20/21/88/942202188.db2.gz MCTWTZYKRMRJLY-UHFFFAOYSA-N 0 0 363.757 3.661 20 5 FHBDRN CS[C@H](C)CNC(=O)c1ccc(N2C[C@H](C)C[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000502079406 942207460 /nfs/dbraw/zinc/20/74/60/942207460.db2.gz NOJOLNRCKVYLKW-MGPQQGTHSA-N 0 0 365.499 3.558 20 5 FHBDRN COc1ccc2c(c1)ncc([N+](=O)[O-])c2N1CC[C@@H](O)[C@H](C2CCCC2)C1 ZINC000413447823 942208864 /nfs/dbraw/zinc/20/88/64/942208864.db2.gz JCDVVWBDZDZTBB-QFBILLFUSA-N 0 0 371.437 3.529 20 5 FHBDRN COC(=O)CCSc1c2cc(Br)ccc2ncc1[N+](=O)[O-] ZINC000502096011 942217422 /nfs/dbraw/zinc/21/74/22/942217422.db2.gz HVCCKBGPUNRZQP-UHFFFAOYSA-N 0 0 371.212 3.561 20 5 FHBDRN O=C(Nc1ccc(OC[C@H]2CCCO2)cc1)c1cc(F)cc([N+](=O)[O-])c1 ZINC000518284446 942217474 /nfs/dbraw/zinc/21/74/74/942217474.db2.gz PLLYVOKXQUDODW-QGZVFWFLSA-N 0 0 360.341 3.544 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N2CCC[C@H]2Cc2ccccc2)c1C ZINC000024474533 942218950 /nfs/dbraw/zinc/21/89/50/942218950.db2.gz QPEKIQVPJMYHDM-KRWDZBQOSA-N 0 0 374.462 3.607 20 5 FHBDRN CCN(CCOc1ccccc1C)C(=O)NCc1ccccc1[N+](=O)[O-] ZINC000420813631 942220577 /nfs/dbraw/zinc/22/05/77/942220577.db2.gz YICNLYQGGJNVGU-UHFFFAOYSA-N 0 0 357.410 3.514 20 5 FHBDRN C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1Oc1cc(F)ccc1[N+](=O)[O-] ZINC001225579978 942221637 /nfs/dbraw/zinc/22/16/37/942221637.db2.gz XLQJLSMONPSUOD-ABAIWWIYSA-N 0 0 354.378 3.758 20 5 FHBDRN COc1cccc(NC2CCN(C(=O)c3ccc(C)cc3)CC2)c1[N+](=O)[O-] ZINC000290484077 942223799 /nfs/dbraw/zinc/22/37/99/942223799.db2.gz BTLMVMYBRMGUIN-UHFFFAOYSA-N 0 0 369.421 3.629 20 5 FHBDRN CC1(C)C[C@@H](C(=O)N2CCc3c2cccc3[N+](=O)[O-])c2ccccc2O1 ZINC000413478941 942223969 /nfs/dbraw/zinc/22/39/69/942223969.db2.gz JHGWWYFWNXSNKU-OAHLLOKOSA-N 0 0 352.390 3.829 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CCCC[C@@H]2c2nc(-c3ccccc3)c[nH]2)nc1 ZINC000280661828 942225955 /nfs/dbraw/zinc/22/59/55/942225955.db2.gz BMBYHBLQTFCAEW-MRXNPFEDSA-N 0 0 350.382 3.507 20 5 FHBDRN CCOc1ccc(C(=O)N[C@H]2CCO[C@@H](C(CC)CC)C2)cc1[N+](=O)[O-] ZINC000183429798 942226143 /nfs/dbraw/zinc/22/61/43/942226143.db2.gz FGSDERSQTFKTSJ-MAUKXSAKSA-N 0 0 364.442 3.707 20 5 FHBDRN COc1ccc([C@@H]2CCCN2c2nc3ccc([N+](=O)[O-])cc3c(=O)[nH]2)cc1 ZINC000280671439 942228189 /nfs/dbraw/zinc/22/81/89/942228189.db2.gz CLWVCSDWEQLNEH-KRWDZBQOSA-N 0 0 366.377 3.594 20 5 FHBDRN CC[C@@H]1C[C@H](C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2C)CCO1 ZINC000280698901 942231156 /nfs/dbraw/zinc/23/11/56/942231156.db2.gz LFBKMLSGQGXUPZ-ZYHUDNBSSA-N 0 0 371.231 3.809 20 5 FHBDRN Cc1cc([C@@H]2CN(Cc3nc4cc([N+](=O)[O-])ccc4o3)CCO2)ccc1F ZINC000129368246 942231444 /nfs/dbraw/zinc/23/14/44/942231444.db2.gz HRFLCVHKKFYFLW-SFHVURJKSA-N 0 0 371.368 3.757 20 5 FHBDRN Cc1c(CO)cc([N+](=O)[O-])c(N2CCC(C)=C(c3ccco3)C2)c1[N+](=O)[O-] ZINC000800889803 942237058 /nfs/dbraw/zinc/23/70/58/942237058.db2.gz SEEFYJUFIXLNNT-UHFFFAOYSA-N 0 0 373.365 3.581 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)NCc1cccc2ccccc21 ZINC000502131392 942237257 /nfs/dbraw/zinc/23/72/57/942237257.db2.gz XBDCEUDHJMYRTE-UHFFFAOYSA-N 0 0 365.389 3.756 20 5 FHBDRN CC(=O)c1ccc(NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)cc1 ZINC000513731513 942237265 /nfs/dbraw/zinc/23/72/65/942237265.db2.gz XDYNJHYIXGPQQD-UHFFFAOYSA-N 0 0 350.277 3.651 20 5 FHBDRN Cc1c2ccccc2oc1C(=O)Nc1n[nH]c(-c2cccc([N+](=O)[O-])c2)n1 ZINC000103202145 942241351 /nfs/dbraw/zinc/24/13/51/942241351.db2.gz TVEKGXJJRRDCJH-UHFFFAOYSA-N 0 0 363.333 3.687 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N(CCc1ccccc1)C1CC1 ZINC000728733448 942243310 /nfs/dbraw/zinc/24/33/10/942243310.db2.gz DHTWGPGXYGJCNJ-UHFFFAOYSA-N 0 0 355.394 3.842 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)OCC(=O)c2ccc(F)c(F)c2)c1 ZINC000016196351 942248014 /nfs/dbraw/zinc/24/80/14/942248014.db2.gz LFCPGFKUFBCFPW-UHFFFAOYSA-N 0 0 367.329 3.635 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)OCC(=O)c2ccc(F)cc2F)c1 ZINC000016196980 942248589 /nfs/dbraw/zinc/24/85/89/942248589.db2.gz AEIPXFNBTXTUPC-UHFFFAOYSA-N 0 0 367.329 3.635 20 5 FHBDRN Cc1csc(Sc2ccc(C(=O)N(C)CC(F)F)cc2[N+](=O)[O-])n1 ZINC000103398388 942258281 /nfs/dbraw/zinc/25/82/81/942258281.db2.gz GNTZVXVASOPKAG-UHFFFAOYSA-N 0 0 373.406 3.848 20 5 FHBDRN CN(Cc1cccc(C(F)(F)F)c1)C(=O)Cc1ccccc1[N+](=O)[O-] ZINC000046714934 942259618 /nfs/dbraw/zinc/25/96/18/942259618.db2.gz LLOUDLMCIXKKLB-UHFFFAOYSA-N 0 0 352.312 3.815 20 5 FHBDRN CCOCCN(C(=O)c1ccc([N+](=O)[O-])s1)c1ccc(Cl)cc1 ZINC000416013303 942259996 /nfs/dbraw/zinc/25/99/96/942259996.db2.gz NJOBLOPLNLZLNF-UHFFFAOYSA-N 0 0 354.815 3.993 20 5 FHBDRN O=C(c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1)N1CCOC2(CCC2)C1 ZINC000128409784 942264108 /nfs/dbraw/zinc/26/41/08/942264108.db2.gz MTJYBEANKYAIKM-UHFFFAOYSA-N 0 0 367.405 3.734 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2nc(CSCc3cn(CC4CC4)nn3)co2)cc1 ZINC000419441826 942265289 /nfs/dbraw/zinc/26/52/89/942265289.db2.gz UMONBDVRLRUSMK-UHFFFAOYSA-N 0 0 371.422 3.685 20 5 FHBDRN COc1ccc(CN2CCO[C@H](c3ccccc3Cl)C2)cc1[N+](=O)[O-] ZINC000103490315 942268138 /nfs/dbraw/zinc/26/81/38/942268138.db2.gz LATRJFMUPRLHSH-SFHVURJKSA-N 0 0 362.813 3.830 20 5 FHBDRN COc1cc(C(=O)NCCc2c(C)cc(C)cc2C)cc([N+](=O)[O-])c1OC ZINC000502181252 942270726 /nfs/dbraw/zinc/27/07/26/942270726.db2.gz PVBBNPAICHDCIT-UHFFFAOYSA-N 0 0 372.421 3.510 20 5 FHBDRN CCCOc1ncccc1CNc1ncc([N+](=O)[O-])cc1C(F)(F)F ZINC000413088022 942272498 /nfs/dbraw/zinc/27/24/98/942272498.db2.gz WCNJNGLYCHBMQW-UHFFFAOYSA-N 0 0 356.304 3.805 20 5 FHBDRN COc1ccc(CSCc2nn(C)cc2Br)cc1[N+](=O)[O-] ZINC000419478358 942274164 /nfs/dbraw/zinc/27/41/64/942274164.db2.gz MVILYPTYIYEOKT-UHFFFAOYSA-N 0 0 372.244 3.533 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N2CCc3cc(C)ccc3C2)cc1OC ZINC000481006563 942275676 /nfs/dbraw/zinc/27/56/76/942275676.db2.gz MFPHZIMSVDIGPY-UHFFFAOYSA-N 0 0 370.405 3.509 20 5 FHBDRN C[C@@H]1C[C@H](Nc2cc(C(F)(F)C(F)(F)F)ncc2[N+](=O)[O-])CS1 ZINC000413506377 942280863 /nfs/dbraw/zinc/28/08/63/942280863.db2.gz AZZJNDUWUQIUOW-RQJHMYQMSA-N 0 0 357.304 3.950 20 5 FHBDRN Cc1cnc([C@@H](C)CNC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)s1 ZINC000183205673 942281004 /nfs/dbraw/zinc/28/10/04/942281004.db2.gz JZKLQMHOLWLKPO-LBPRGKRZSA-N 0 0 374.466 3.837 20 5 FHBDRN COc1ccc(Br)c(OC(=O)c2cc([N+](=O)[O-])ccc2C)c1 ZINC001269073767 942282534 /nfs/dbraw/zinc/28/25/34/942282534.db2.gz NLCYQOQNRUJFFB-UHFFFAOYSA-N 0 0 366.167 3.894 20 5 FHBDRN COc1ccc2c(c1)N(C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)C[C@@H](C)O2 ZINC000413509704 942282769 /nfs/dbraw/zinc/28/27/69/942282769.db2.gz HREDSMPQXXBJQH-OAUYIBNBSA-N 0 0 368.389 3.521 20 5 FHBDRN Cc1ccc(CSCc2c([N+](=O)[O-])ncn2C)c(Br)c1 ZINC000419506342 942287519 /nfs/dbraw/zinc/28/75/19/942287519.db2.gz MDKQBCJUHTWZNU-UHFFFAOYSA-N 0 0 356.245 3.833 20 5 FHBDRN CCC(CC)[C@@H]1C[C@@H](NC(=O)CSc2ccc([N+](=O)[O-])cc2)CCO1 ZINC000183467357 942289121 /nfs/dbraw/zinc/28/91/21/942289121.db2.gz FOZUYGCPWBENLL-YOEHRIQHSA-N 0 0 366.483 3.787 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1COCc2ccccc21 ZINC000416045478 942290960 /nfs/dbraw/zinc/29/09/60/942290960.db2.gz CWDQWDDSHREOJC-MRXNPFEDSA-N 0 0 358.419 3.708 20 5 FHBDRN Cc1ccc(S(=O)(=O)N2c3ccccc3SC[C@@H]2C)c([N+](=O)[O-])c1 ZINC000434109105 942291766 /nfs/dbraw/zinc/29/17/66/942291766.db2.gz NQOTVVXCKZBSJP-LBPRGKRZSA-N 0 0 364.448 3.593 20 5 FHBDRN O=[N+]([O-])c1ccc(N2C[C@H](O)C[C@H]2c2ccccc2)cc1C(F)(F)F ZINC000413513016 942300044 /nfs/dbraw/zinc/30/00/44/942300044.db2.gz YFDBBXXEJQIIJX-CJNGLKHVSA-N 0 0 352.312 3.926 20 5 FHBDRN CCCN(C[C@@H]1COc2ccccc2O1)C(=O)c1ccc([N+](=O)[O-])cc1C ZINC000502236325 942300050 /nfs/dbraw/zinc/30/00/50/942300050.db2.gz XKGITJPLAAIJJG-MRXNPFEDSA-N 0 0 370.405 3.595 20 5 FHBDRN CN(C[C@H]1OCCc2ccccc21)c1ncc([N+](=O)[O-])cc1C(F)(F)F ZINC000413102154 942302132 /nfs/dbraw/zinc/30/21/32/942302132.db2.gz DXGHHGSAJRICDX-OAHLLOKOSA-N 0 0 367.327 3.759 20 5 FHBDRN CC(C)[C@@H](C)NC(=O)C1CCN(c2nccc3ccc([N+](=O)[O-])cc32)CC1 ZINC000413101339 942302154 /nfs/dbraw/zinc/30/21/54/942302154.db2.gz INHJZKBPPDNWKM-CQSZACIVSA-N 0 0 370.453 3.520 20 5 FHBDRN CCOc1cc(F)ccc1N[C@@H](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000502248217 942305350 /nfs/dbraw/zinc/30/53/50/942305350.db2.gz KUNNUXBSDPWAOG-LBPRGKRZSA-N 0 0 361.373 3.962 20 5 FHBDRN CO[C@@H]1CCC[C@@H](C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000513737144 942308514 /nfs/dbraw/zinc/30/85/14/942308514.db2.gz VLWIIFWJVLVPQN-NOZJJQNGSA-N 0 0 357.204 3.501 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)N2CC3(CCC3)[C@H]2[C@H]2CCCO2)cc1[N+](=O)[O-] ZINC000290632176 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20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N(C)CCN(C)c1ccccc1 ZINC000085636737 942339356 /nfs/dbraw/zinc/33/93/56/942339356.db2.gz MGQXZOLCUNPKPT-UHFFFAOYSA-N 0 0 356.426 3.812 20 5 FHBDRN COCCCCN(C)C(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 ZINC000416098672 942343823 /nfs/dbraw/zinc/34/38/23/942343823.db2.gz IGIOGAXYJGPCFV-UHFFFAOYSA-N 0 0 371.437 3.706 20 5 FHBDRN Cn1ccnc1[C@@H](NCCc1cccc(F)c1F)c1cccc([N+](=O)[O-])c1 ZINC000513708733 942348186 /nfs/dbraw/zinc/34/81/86/942348186.db2.gz WOEDNNRAZFOGBU-SFHVURJKSA-N 0 0 372.375 3.528 20 5 FHBDRN Cc1c(C(=O)Nc2cc(F)ccc2OC[C@@H]2CCCO2)cccc1[N+](=O)[O-] ZINC000502317371 942350479 /nfs/dbraw/zinc/35/04/79/942350479.db2.gz MSCXDMYMCOIIAI-AWEZNQCLSA-N 0 0 374.368 3.852 20 5 FHBDRN CCC(CC)[C@@H]1C[C@H](NC(=O)Nc2ccc([N+](=O)[O-])cc2OC)CCO1 ZINC000122876458 942354233 /nfs/dbraw/zinc/35/42/33/942354233.db2.gz GVKRFTGTWXNGAU-CJNGLKHVSA-N 0 0 365.430 3.709 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)NCCc1ccc(Cl)cc1Cl ZINC000015739826 942355012 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COc1ccc(OC)c([C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)c1 ZINC000015827796 942435331 /nfs/dbraw/zinc/43/53/31/942435331.db2.gz JQZFOQWUYBFRAB-ZDUSSCGKSA-N 0 0 362.407 3.651 20 5 FHBDRN CO[C@@H](C)c1nc(CNc2ncc([N+](=O)[O-])cc2C(F)(F)F)cs1 ZINC000413186714 942438475 /nfs/dbraw/zinc/43/84/75/942438475.db2.gz PTNJOBPYYKGXBB-ZETCQYMHSA-N 0 0 362.333 3.785 20 5 FHBDRN COc1cccc(C2(NC(=O)c3ccc([N+](=O)[O-])c(OC(C)C)c3)CC2)c1 ZINC000413612138 942438973 /nfs/dbraw/zinc/43/89/73/942438973.db2.gz FDJOYITWGYDGEP-UHFFFAOYSA-N 0 0 370.405 3.810 20 5 FHBDRN COC(=O)c1cc(C(C)C)ccc1NC(=O)CNc1ccccc1[N+](=O)[O-] ZINC000505284060 942441329 /nfs/dbraw/zinc/44/13/29/942441329.db2.gz TXWNCXHMKPIAIQ-UHFFFAOYSA-N 0 0 371.393 3.555 20 5 FHBDRN COC(=O)c1cc(C)ccc1NC(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000505276603 942441437 /nfs/dbraw/zinc/44/14/37/942441437.db2.gz IMPWETBCKWDQMO-UHFFFAOYSA-N 0 0 354.318 3.688 20 5 FHBDRN CN(CC(=O)Nc1cccc(Cl)c1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000016312734 942443137 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942484073 /nfs/dbraw/zinc/48/40/73/942484073.db2.gz OYJIMKKMVKHMPS-AWEZNQCLSA-N 0 0 354.406 3.903 20 5 FHBDRN CCn1cc(CC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c2ccccc21 ZINC000502510706 942487807 /nfs/dbraw/zinc/48/78/07/942487807.db2.gz LAKLBYOXLCOXFR-AWEZNQCLSA-N 0 0 351.406 3.989 20 5 FHBDRN CC(=O)c1ccc(CNc2ncc([N+](=O)[O-])cc2C(F)(F)F)nc1C ZINC000413213537 942488081 /nfs/dbraw/zinc/48/80/81/942488081.db2.gz JSFGEEWZGDHYLF-UHFFFAOYSA-N 0 0 354.288 3.527 20 5 FHBDRN O=C(c1cc(F)c2ccccc2c1)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000505375723 942490450 /nfs/dbraw/zinc/49/04/50/942490450.db2.gz UEDVANGWYPETSC-UHFFFAOYSA-N 0 0 366.348 3.791 20 5 FHBDRN COc1ccc(C(=O)N2CCC[C@@H]2/C=C/c2ccccc2)cc1[N+](=O)[O-] ZINC000505373169 942491957 /nfs/dbraw/zinc/49/19/57/942491957.db2.gz QLFZGBGSEHIOMB-QXLXQBSBSA-N 0 0 352.390 3.921 20 5 FHBDRN O=C(COc1cccc([N+](=O)[O-])c1)N1CCC[C@@H]1/C=C\c1ccccc1 ZINC000505373373 942492913 /nfs/dbraw/zinc/49/29/13/942492913.db2.gz SCZMEQVPJMFHOI-WFTPILKQSA-N 0 0 352.390 3.678 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CCC(Cc3cccnc3)CC2)c(C(F)(F)F)c1 ZINC000413220409 942498450 /nfs/dbraw/zinc/49/84/50/942498450.db2.gz PABSYDHQKKNLMF-UHFFFAOYSA-N 0 0 366.343 3.863 20 5 FHBDRN CO[C@](C)([C@@H](C)NC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C)C1CC1 ZINC000413686628 942498709 /nfs/dbraw/zinc/49/87/09/942498709.db2.gz JTEABZFSZQUDSE-AUUYWEPGSA-N 0 0 363.458 3.718 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1C[C@@H]2CCC(=O)c3cccc1c32 ZINC000413685527 942499136 /nfs/dbraw/zinc/49/91/36/942499136.db2.gz FFVBSFRDJXYDET-RRQGHBQHSA-N 0 0 362.385 3.805 20 5 FHBDRN CC(C)Oc1cc(C(=O)NCCC2C[C@H](C)O[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000412331297 942499283 /nfs/dbraw/zinc/49/92/83/942499283.db2.gz NLKKHWPKBGEQRI-KBPBESRZSA-N 0 0 364.442 3.706 20 5 FHBDRN CC(C)n1cnnc1C1CCN(c2nccc3ccc([N+](=O)[O-])cc32)CC1 ZINC000413224570 942502078 /nfs/dbraw/zinc/50/20/78/942502078.db2.gz YSOASCWIFGFDHJ-UHFFFAOYSA-N 0 0 366.425 3.699 20 5 FHBDRN O=C(COc1ccccc1[N+](=O)[O-])N[C@H](c1ccc(F)cc1)C1CCC1 ZINC000104424894 942509604 /nfs/dbraw/zinc/50/96/04/942509604.db2.gz KTJOLBYBCXBDEI-IBGZPJMESA-N 0 0 358.369 3.770 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)C1(c2ccccc2)CCC1 ZINC000016376266 942511495 /nfs/dbraw/zinc/51/14/95/942511495.db2.gz JPAIOYCKGYZPNX-UHFFFAOYSA-N 0 0 368.389 3.507 20 5 FHBDRN CO[C@](C)([C@H](C)NC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F)C1CC1 ZINC000413702445 942512777 /nfs/dbraw/zinc/51/27/77/942512777.db2.gz XPWWLEYDNVAMDC-XXFAHNHDSA-N 0 0 373.356 3.521 20 5 FHBDRN CC(C)Sc1ccc(Cl)cc1NC(=O)CCn1cc([N+](=O)[O-])cn1 ZINC000104484402 942513576 /nfs/dbraw/zinc/51/35/76/942513576.db2.gz DSCSYLYFXBYIAN-UHFFFAOYSA-N 0 0 368.846 3.974 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCC(n3cc(Cl)cn3)CC2)c2cccnc21 ZINC000413230418 942518764 /nfs/dbraw/zinc/51/87/64/942518764.db2.gz IKKCQTJZVBOBFT-UHFFFAOYSA-N 0 0 357.801 3.834 20 5 FHBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)N[C@@H]1C[C@H]1c1ccc(F)cc1 ZINC000434150453 942526642 /nfs/dbraw/zinc/52/66/42/942526642.db2.gz ARYWOTAGAKDDKN-RBUKOAKNSA-N 0 0 371.412 3.912 20 5 FHBDRN O=[N+]([O-])c1cccc(CN(CCO)Cc2ccc(Cl)c(Cl)c2)c1 ZINC000502549364 942526944 /nfs/dbraw/zinc/52/69/44/942526944.db2.gz WYDITNHWYPYHOH-UHFFFAOYSA-N 0 0 355.221 3.896 20 5 FHBDRN Cc1cn(C2CCCCC2)nc1NC(=O)Nc1ccc(C)c([N+](=O)[O-])c1 ZINC000434229096 942535315 /nfs/dbraw/zinc/53/53/15/942535315.db2.gz UFGSEVUOGALUIL-UHFFFAOYSA-N 0 0 357.414 3.979 20 5 FHBDRN Cc1ccccc1O[C@H](C)CNC(=O)CSc1ccccc1[N+](=O)[O-] ZINC000541262203 942539251 /nfs/dbraw/zinc/53/92/51/942539251.db2.gz JYKFHUDKTHQQOO-CQSZACIVSA-N 0 0 360.435 3.579 20 5 FHBDRN CC(C)Oc1cc(C(=O)Nc2cccc(CCCO)c2)ccc1[N+](=O)[O-] ZINC000413739490 942542147 /nfs/dbraw/zinc/54/21/47/942542147.db2.gz ZJUVNLDPHXXIIB-UHFFFAOYSA-N 0 0 358.394 3.559 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N2C[C@H](C)C[C@H]2c2ccccc2F)c1[N+](=O)[O-] ZINC000434242290 942542577 /nfs/dbraw/zinc/54/25/77/942542577.db2.gz LHCIKUMHKBCWQC-RISCZKNCSA-N 0 0 360.389 3.804 20 5 FHBDRN CCC(CC)(CNC(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-])c1ccccc1 ZINC000434244568 942545123 /nfs/dbraw/zinc/54/51/23/942545123.db2.gz SODUEQHPCQSGRW-UHFFFAOYSA-N 0 0 358.442 3.929 20 5 FHBDRN CC[C@@H](NC(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-])c1cc(F)ccc1F ZINC000434246493 942545653 /nfs/dbraw/zinc/54/56/53/942545653.db2.gz SVDPZINHIDMHEE-GFCCVEGCSA-N 0 0 352.341 3.601 20 5 FHBDRN COc1cc(C)ccc1CN[C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000513717524 942546450 /nfs/dbraw/zinc/54/64/50/942546450.db2.gz PVFWWFPWGGZVQH-IBGZPJMESA-N 0 0 366.421 3.525 20 5 FHBDRN Cc1ccccc1C1=CCN(C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)C1 ZINC000501559177 942549371 /nfs/dbraw/zinc/54/93/71/942549371.db2.gz VNMKCINQIOUWRN-UHFFFAOYSA-N 0 0 374.400 3.628 20 5 FHBDRN COCc1cc([N+](=O)[O-])ccc1NCc1ccccc1-c1cnn(C)c1 ZINC000366919547 942549436 /nfs/dbraw/zinc/54/94/36/942549436.db2.gz PSXWDKFAAIEXJK-UHFFFAOYSA-N 0 0 352.394 3.754 20 5 FHBDRN O=C([C@@H]1COc2ccc(Cl)cc2C1)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000513839443 942551212 /nfs/dbraw/zinc/55/12/12/942551212.db2.gz KUCQIUJPMXFUJB-ZDUSSCGKSA-N 0 0 372.808 3.779 20 5 FHBDRN CC(=O)Nc1cccc([C@H](C)NC(=O)c2cc([N+](=O)[O-])c(C)cc2C)c1 ZINC000421423066 942552093 /nfs/dbraw/zinc/55/20/93/942552093.db2.gz POTKPUSWWQMNCH-ZDUSSCGKSA-N 0 0 355.394 3.661 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N2CCC(=Cc3ccccc3F)CC2)c1[N+](=O)[O-] ZINC000434257128 942552227 /nfs/dbraw/zinc/55/22/27/942552227.db2.gz SINMGFURFXBRCV-UHFFFAOYSA-N 0 0 372.400 3.900 20 5 FHBDRN C[C@@H]1[C@H](c2ccccc2)CCN1C(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000434258031 942552966 /nfs/dbraw/zinc/55/29/66/942552966.db2.gz WOZACBDHGWLVOW-NVXWUHKLSA-N 0 0 353.422 3.801 20 5 FHBDRN O=C(CSc1ccccc1[N+](=O)[O-])NCc1cc2c(s1)CCCC2 ZINC000541280858 942553196 /nfs/dbraw/zinc/55/31/96/942553196.db2.gz HLUDJNYASUZCCW-UHFFFAOYSA-N 0 0 362.476 3.944 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N1CC=C(c2ccccc2F)C1 ZINC000501587002 942553806 /nfs/dbraw/zinc/55/38/06/942553806.db2.gz HANMKIKNKBYROP-UHFFFAOYSA-N 0 0 360.772 3.856 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCC(c3noc(C4CC4)n3)CC2)c2cccnc21 ZINC000413242171 942558316 /nfs/dbraw/zinc/55/83/16/942558316.db2.gz XCDVUKILJZEOFK-UHFFFAOYSA-N 0 0 365.393 3.787 20 5 FHBDRN O=C(c1ccc(Cl)cc1[N+](=O)[O-])N1CCC(F)(c2cccnc2)CC1 ZINC000366946916 942558348 /nfs/dbraw/zinc/55/83/48/942558348.db2.gz SAWHVBNAZZSECQ-UHFFFAOYSA-N 0 0 363.776 3.744 20 5 FHBDRN O=C(C[C@@H]1CCCCCN1C(=O)Cc1cccc([N+](=O)[O-])c1)c1ccco1 ZINC000434267279 942562544 /nfs/dbraw/zinc/56/25/44/942562544.db2.gz RCEQCBKIHSKDPH-INIZCTEOSA-N 0 0 370.405 3.775 20 5 FHBDRN Cc1csc(Sc2ccc(C(=O)N3CC[C@@H](F)C3)cc2[N+](=O)[O-])n1 ZINC000452371310 942563390 /nfs/dbraw/zinc/56/33/90/942563390.db2.gz QXBAEBRTUYVEAJ-LLVKDONJSA-N 0 0 367.427 3.695 20 5 FHBDRN COc1cccc2c1CCN(c1ncc([N+](=O)[O-])cc1C(F)(F)F)CC2 ZINC000413259954 942570256 /nfs/dbraw/zinc/57/02/56/942570256.db2.gz DPOFIWXXMYKNCD-UHFFFAOYSA-N 0 0 367.327 3.622 20 5 FHBDRN CC(C)Cn1ncc(NC(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])c1C(C)C ZINC000501622771 942571850 /nfs/dbraw/zinc/57/18/50/942571850.db2.gz UDEYIJHIWZDWFK-UHFFFAOYSA-N 0 0 362.434 3.670 20 5 FHBDRN Cc1ccc(C(=O)Nc2ccc(F)cc2-c2cnn(C)c2)cc1[N+](=O)[O-] ZINC000366557248 942573280 /nfs/dbraw/zinc/57/32/80/942573280.db2.gz DWPBKUJNHSJQFH-UHFFFAOYSA-N 0 0 354.341 3.695 20 5 FHBDRN CCOc1ccc(C(=O)NC[C@]2(C)C[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000501612280 942574077 /nfs/dbraw/zinc/57/40/77/942574077.db2.gz NHSVOEZXNYWIJB-JXFKEZNVSA-N 0 0 354.406 3.917 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)Nc1cccc(N2CCCC2=O)c1 ZINC000421440486 942574137 /nfs/dbraw/zinc/57/41/37/942574137.db2.gz YGEHQIJIHKHRGS-UHFFFAOYSA-N 0 0 353.378 3.591 20 5 FHBDRN CCOC(=O)CN(C(=O)c1cc([N+](=O)[O-])c(C)cc1C)c1ccccc1F ZINC000421441873 942575158 /nfs/dbraw/zinc/57/51/58/942575158.db2.gz CLUCZKRQOGZFQQ-UHFFFAOYSA-N 0 0 374.368 3.561 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NCCCCOCc1ccccc1 ZINC000421450564 942581060 /nfs/dbraw/zinc/58/10/60/942581060.db2.gz JNUWCBLORXAFAR-UHFFFAOYSA-N 0 0 356.422 3.938 20 5 FHBDRN CCOc1cc(C)ccc1CNC(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000151174400 942581115 /nfs/dbraw/zinc/58/11/15/942581115.db2.gz VZHBECKLSOZOLB-UHFFFAOYSA-N 0 0 360.435 3.710 20 5 FHBDRN CC(C)CCc1noc(CNc2cc([N+](=O)[O-])ccc2OC(F)F)n1 ZINC000063461627 942592024 /nfs/dbraw/zinc/59/20/24/942592024.db2.gz IZCGSHZDSWQXAY-UHFFFAOYSA-N 0 0 356.329 3.780 20 5 FHBDRN CC1(C)[C@H](Nc2ccc(Br)cc2[N+](=O)[O-])[C@@H]2CCCO[C@@H]21 ZINC000085674018 942593098 /nfs/dbraw/zinc/59/30/98/942593098.db2.gz APASAMXNJUIBRI-GDLCADMTSA-N 0 0 355.232 3.973 20 5 FHBDRN C[C@H]1CCCC[C@H]1OCCNC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513719379 942595230 /nfs/dbraw/zinc/59/52/30/942595230.db2.gz BSGMIOVCNRKAEW-SMDDNHRTSA-N 0 0 372.368 3.521 20 5 FHBDRN CSc1cccc(C(=O)N[C@@H]2CCCC[C@H]2OC(F)F)c1[N+](=O)[O-] ZINC000501665856 942599418 /nfs/dbraw/zinc/59/94/18/942599418.db2.gz NCGFRQNWEFHFDJ-GHMZBOCLSA-N 0 0 360.382 3.597 20 5 FHBDRN CCCNc1ccc(CNC(=O)NCc2cccc([N+](=O)[O-])c2C)cc1 ZINC000434336961 942602967 /nfs/dbraw/zinc/60/29/67/942602967.db2.gz SIOFYUQYTFGKIN-UHFFFAOYSA-N 0 0 356.426 3.725 20 5 FHBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])Nc1cccc2c1CCO2 ZINC000434151236 942612404 /nfs/dbraw/zinc/61/24/04/942612404.db2.gz DQYDQABFXUFTCH-UHFFFAOYSA-N 0 0 361.785 3.547 20 5 FHBDRN COc1cc(C(=O)N(C)[C@H]2CCC[C@H]2C(C)(C)C)cc([N+](=O)[O-])c1OC ZINC000416292909 942617358 /nfs/dbraw/zinc/61/73/58/942617358.db2.gz QEWIDYKDDOCYII-KGLIPLIRSA-N 0 0 364.442 3.899 20 5 FHBDRN Cn1cc(-c2ccccc2CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])cn1 ZINC000366975773 942619469 /nfs/dbraw/zinc/61/94/69/942619469.db2.gz DUSQCNCTPXFJPM-UHFFFAOYSA-N 0 0 370.796 3.579 20 5 FHBDRN CSC1(CNC(=O)c2cc(F)cc3c(=O)c4cc(F)ccc4[nH]c23)CC1 ZINC000280147996 942623700 /nfs/dbraw/zinc/62/37/00/942623700.db2.gz QPXQBFGRGMWMIQ-UHFFFAOYSA-N 0 0 374.412 3.997 20 5 FHBDRN COc1ccc(C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1-c1ccn(C)n1 ZINC000378346431 942626457 /nfs/dbraw/zinc/62/64/57/942626457.db2.gz QXGQVQWFJFIUJF-UHFFFAOYSA-N 0 0 366.377 3.565 20 5 FHBDRN Cc1ccc(CN(C)C(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)s1 ZINC000513749927 942627657 /nfs/dbraw/zinc/62/76/57/942627657.db2.gz YHBMLBAWCKJDSS-UHFFFAOYSA-N 0 0 356.350 3.838 20 5 FHBDRN CC1(C)CCN(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)CCS1 ZINC000434384366 942632625 /nfs/dbraw/zinc/63/26/25/942632625.db2.gz DCQONTLVKDQSAQ-UHFFFAOYSA-N 0 0 357.863 3.675 20 5 FHBDRN Cc1ccc(NC(=O)N(C)C[C@@H]2OCCc3ccccc32)cc1[N+](=O)[O-] ZINC000513955049 942633586 /nfs/dbraw/zinc/63/35/86/942633586.db2.gz STBUJWHYAFVTJZ-SFHVURJKSA-N 0 0 355.394 3.681 20 5 FHBDRN CC(C)OCc1nc([C@H](C)Nc2ccc([N+](=O)[O-])c3ncccc23)no1 ZINC000413309559 942642501 /nfs/dbraw/zinc/64/25/01/942642501.db2.gz LXMNYNUWBMAHSS-NSHDSACASA-N 0 0 357.370 3.624 20 5 FHBDRN CC(=O)c1ccc(N2CCO[C@H](c3ccc(F)c(F)c3)C2)c([N+](=O)[O-])c1 ZINC000066815506 942645365 /nfs/dbraw/zinc/64/53/65/942645365.db2.gz WNKAVWAEHLELQI-SFHVURJKSA-N 0 0 362.332 3.654 20 5 FHBDRN CC(C)[C@H](CC(F)(F)F)NC(=O)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000502692452 942650395 /nfs/dbraw/zinc/65/03/95/942650395.db2.gz DYCJRAROAALQEV-ZDUSSCGKSA-N 0 0 361.364 3.756 20 5 FHBDRN O=C(N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1)C1(Oc2ccccc2)CC1 ZINC000421545639 942651752 /nfs/dbraw/zinc/65/17/52/942651752.db2.gz AHILKNFDFZLZML-QGZVFWFLSA-N 0 0 366.417 3.912 20 5 FHBDRN O=C(NCc1ccc(Cl)cc1)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000016024394 942653749 /nfs/dbraw/zinc/65/37/49/942653749.db2.gz FNTMQDJTIWPXAP-UHFFFAOYSA-N 0 0 369.602 3.941 20 5 FHBDRN C[C@@H]1[C@@H](C)[C@H](C)CN1C(=O)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000416322426 942656132 /nfs/dbraw/zinc/65/61/32/942656132.db2.gz MVMPCQAOPXYNEU-FRRDWIJNSA-N 0 0 352.409 3.937 20 5 FHBDRN O=[N+]([O-])c1cnc(N[C@H](CCO)c2cccc(C(F)(F)F)c2)c(F)c1 ZINC000413316619 942656686 /nfs/dbraw/zinc/65/66/86/942656686.db2.gz PWKVEIWWKONSHB-CYBMUJFWSA-N 0 0 359.279 3.683 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CCc3c2c(F)ccc3F)ccc1[N+](=O)[O-] ZINC000412358042 942662067 /nfs/dbraw/zinc/66/20/67/942662067.db2.gz FOERYSKRWZDOHM-UHFFFAOYSA-N 0 0 362.332 3.863 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1cscc1Br ZINC000404698592 942662473 /nfs/dbraw/zinc/66/24/73/942662473.db2.gz CKQRLCHABCFXNX-UHFFFAOYSA-N 0 0 355.213 3.691 20 5 FHBDRN CC(C)Oc1cc(C(=O)Nc2ccccc2OCCF)ccc1[N+](=O)[O-] ZINC000413845720 942664141 /nfs/dbraw/zinc/66/41/41/942664141.db2.gz SKALVAWAYWVUCV-UHFFFAOYSA-N 0 0 362.357 3.983 20 5 FHBDRN COc1cccc(N2CCC3(CC2)OCCc2ccccc23)c1[N+](=O)[O-] ZINC000413323383 942664211 /nfs/dbraw/zinc/66/42/11/942664211.db2.gz DDTDSWVCPVXSPN-UHFFFAOYSA-N 0 0 354.406 3.672 20 5 FHBDRN O=[N+]([O-])c1cnc(N[C@H]2CCO[C@H](c3ccncc3)C2)c(C(F)(F)F)c1 ZINC000413325486 942665230 /nfs/dbraw/zinc/66/52/30/942665230.db2.gz VSONDPDGQAZWFD-FZMZJTMJSA-N 0 0 368.315 3.736 20 5 FHBDRN Cc1cc(CNC(=O)c2c([N+](=O)[O-])cccc2C(F)(F)F)cc(C)n1 ZINC000421576365 942668081 /nfs/dbraw/zinc/66/80/81/942668081.db2.gz LZRFGCOHIARHDD-UHFFFAOYSA-N 0 0 353.300 3.555 20 5 FHBDRN COc1cccc([C@@H]2C[C@H]2CNC(=O)N(C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000413838582 942668791 /nfs/dbraw/zinc/66/87/91/942668791.db2.gz ULJOLTDFFTVHJF-WMZOPIPTSA-N 0 0 369.421 3.549 20 5 FHBDRN Cc1cc(CNC(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])cc(C)n1 ZINC000421577322 942669080 /nfs/dbraw/zinc/66/90/80/942669080.db2.gz FENRPNZEFSKTSA-UHFFFAOYSA-N 0 0 353.300 3.555 20 5 FHBDRN O=C(N[C@H]1C[C@H](c2ccc(F)cc2)C1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412363959 942669914 /nfs/dbraw/zinc/66/99/14/942669914.db2.gz PEXSUBOYMWQWJE-OYSPMZIOSA-N 0 0 354.381 3.900 20 5 FHBDRN COc1cccc(C2(CNC(=O)[C@@H]3C[C@H]3c3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000412367237 942671316 /nfs/dbraw/zinc/67/13/16/942671316.db2.gz UZEIQOQXFIPCRL-RBUKOAKNSA-N 0 0 366.417 3.555 20 5 FHBDRN O=C(c1ccc(NC2CC2)c([N+](=O)[O-])c1)N1CCC[C@H](c2ccccn2)C1 ZINC000590401528 942672630 /nfs/dbraw/zinc/67/26/30/942672630.db2.gz MJUYVCLVWHPFEU-HNNXBMFYSA-N 0 0 366.421 3.584 20 5 FHBDRN O=C(NC[C@H]1CC12CCSCC2)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000421593952 942675538 /nfs/dbraw/zinc/67/55/38/942675538.db2.gz XJDOLJDXTNGPOB-SNVBAGLBSA-N 0 0 374.384 3.877 20 5 FHBDRN CCC(C)(C)NC(=O)COc1ccc([N+](=O)[O-])cc1Cc1ccccc1 ZINC000016459079 942675667 /nfs/dbraw/zinc/67/56/67/942675667.db2.gz WGWMSZYQIDLDOH-UHFFFAOYSA-N 0 0 356.422 3.869 20 5 FHBDRN CN(Cc1cccc(OC(F)(F)F)c1)C(=O)Nc1ccncc1[N+](=O)[O-] ZINC000183611328 942683301 /nfs/dbraw/zinc/68/33/01/942683301.db2.gz OUUYFTNIEJUSEZ-UHFFFAOYSA-N 0 0 370.287 3.552 20 5 FHBDRN O=C(NC[C@H]1CC12CCSCC2)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000421588414 942684644 /nfs/dbraw/zinc/68/46/44/942684644.db2.gz JFUBQVDFYHHIFR-GFCCVEGCSA-N 0 0 374.384 3.877 20 5 FHBDRN CC(C)(C(=O)NC[C@@H]1CC12CCSCC2)c1ccc([N+](=O)[O-])cc1F ZINC000421592038 942686589 /nfs/dbraw/zinc/68/65/89/942686589.db2.gz RLWQBNFAYJAHBY-LBPRGKRZSA-N 0 0 366.458 3.661 20 5 FHBDRN CC(C)Oc1cc(-c2nc(-c3ccc(N(C)C)nc3)no2)ccc1[N+](=O)[O-] ZINC000420484810 942689156 /nfs/dbraw/zinc/68/91/56/942689156.db2.gz SSGKWXWVCJPBEG-UHFFFAOYSA-N 0 0 369.381 3.560 20 5 FHBDRN O=C(N[C@@H]1CCCOc2c(F)cccc21)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000183317468 942695990 /nfs/dbraw/zinc/69/59/90/942695990.db2.gz GZRGTAIRSIIYJM-QGZVFWFLSA-N 0 0 369.352 3.859 20 5 FHBDRN O=C(NCc1ccccc1F)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000047864486 942696716 /nfs/dbraw/zinc/69/67/16/942696716.db2.gz ATCCOFOKZPBIAH-UHFFFAOYSA-N 0 0 355.272 3.657 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)NC(C)(C)CCc2ccccc2)c1F ZINC000413343034 942697944 /nfs/dbraw/zinc/69/79/44/942697944.db2.gz PNJUHQPQMDMSBT-UHFFFAOYSA-N 0 0 374.412 3.813 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)N1CCC[C@]1(C)Cc1ccc(F)cc1 ZINC000421616734 942700907 /nfs/dbraw/zinc/70/09/07/942700907.db2.gz BPSQLFBFIKNUDP-LJQANCHMSA-N 0 0 357.385 3.675 20 5 FHBDRN COc1c(C(=O)N2CCC[C@@]2(C)Cc2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000421617909 942701801 /nfs/dbraw/zinc/70/18/01/942701801.db2.gz FIGIYDXBODZVCY-FQEVSTJZSA-N 0 0 372.396 3.980 20 5 FHBDRN CCOc1cc(CS(=O)(=O)c2cc(F)c(C)cc2F)ccc1[N+](=O)[O-] ZINC000549426671 942710294 /nfs/dbraw/zinc/71/02/94/942710294.db2.gz UOIFETSUYOYEBR-UHFFFAOYSA-N 0 0 371.361 3.554 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)Nc1ccc2ccn(C)c(=O)c2c1 ZINC000501844705 942713078 /nfs/dbraw/zinc/71/30/78/942713078.db2.gz OZRWHYLPJXZXBM-UHFFFAOYSA-N 0 0 365.389 3.624 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1OC(F)F)N1CC[C@@H](C2CCCC2)C1 ZINC000421647314 942720225 /nfs/dbraw/zinc/72/02/25/942720225.db2.gz UNCKUZDINSQDSA-GFCCVEGCSA-N 0 0 354.353 3.849 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCc3c(cnn3-c3ccccc3)C2)c2ncccc12 ZINC000502757116 942721427 /nfs/dbraw/zinc/72/14/27/942721427.db2.gz NZSGPOPULSKDDX-UHFFFAOYSA-N 0 0 371.400 3.891 20 5 FHBDRN COCc1cc(CNC(=O)c2cc(SC)ccc2[N+](=O)[O-])ccc1F ZINC000170969884 942724276 /nfs/dbraw/zinc/72/42/76/942724276.db2.gz DNALFENMAQDLNY-UHFFFAOYSA-N 0 0 364.398 3.532 20 5 FHBDRN Cc1cc(CN[C@@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)ccc1F ZINC000514083045 942734049 /nfs/dbraw/zinc/73/40/49/942734049.db2.gz JKJUJMFWWBXKKD-GOSISDBHSA-N 0 0 354.385 3.655 20 5 FHBDRN Cc1cc(S(=O)(=O)N(C)[C@@H](C)c2cccs2)c(C)cc1[N+](=O)[O-] ZINC000416370110 942734890 /nfs/dbraw/zinc/73/48/90/942734890.db2.gz JGXKIVZIOVPHPF-LBPRGKRZSA-N 0 0 354.453 3.655 20 5 FHBDRN CCC[C@@H](NC(=O)[C@@H](C)Oc1ccc([N+](=O)[O-])c(CO)c1)c1ccccc1 ZINC000431865393 942738411 /nfs/dbraw/zinc/73/84/11/942738411.db2.gz PVCPZUMWEYVQRB-RDTXWAMCSA-N 0 0 372.421 3.512 20 5 FHBDRN Cc1cccc([C@H](NC(=O)Nc2ccncc2[N+](=O)[O-])c2ccccn2)c1 ZINC000183625618 942743260 /nfs/dbraw/zinc/74/32/60/942743260.db2.gz FJCPYQGWARQGJN-SFHVURJKSA-N 0 0 363.377 3.604 20 5 FHBDRN O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1CCC(Cc2cccnc2)CC1 ZINC000378421391 942745122 /nfs/dbraw/zinc/74/51/22/942745122.db2.gz IWSXSMOPFFHJSX-UHFFFAOYSA-N 0 0 359.813 3.738 20 5 FHBDRN O=C(Nc1ccncc1[N+](=O)[O-])N1CCC(c2nc3ccccc3o2)CC1 ZINC000183626684 942746644 /nfs/dbraw/zinc/74/66/44/942746644.db2.gz SURGBILYNBHPPU-UHFFFAOYSA-N 0 0 367.365 3.543 20 5 FHBDRN Cc1ccccc1CCN[C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000513755356 942748255 /nfs/dbraw/zinc/74/82/55/942748255.db2.gz RRVGXJFQFANYTO-IBGZPJMESA-N 0 0 350.422 3.558 20 5 FHBDRN COc1ccc(CNC(=O)Nc2ccc(OCC3CC3)cc2)cc1[N+](=O)[O-] ZINC000502809885 942762916 /nfs/dbraw/zinc/76/29/16/942762916.db2.gz KSZUNLVZVPKAJK-UHFFFAOYSA-N 0 0 371.393 3.714 20 5 FHBDRN CC1CCN(c2ccc(C(=O)N3CC(CC(F)F)C3)cc2[N+](=O)[O-])CC1 ZINC000425094230 942767783 /nfs/dbraw/zinc/76/77/83/942767783.db2.gz SPVYJOXMMHDGFQ-UHFFFAOYSA-N 0 0 367.396 3.558 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])N[C@H](CC(F)F)c1ccccc1 ZINC000421700599 942772646 /nfs/dbraw/zinc/77/26/46/942772646.db2.gz QYTLROFETSYXKW-CQSZACIVSA-N 0 0 364.348 3.876 20 5 FHBDRN Cc1cn(-c2ccc(Cl)cc2)nc1NC(=O)c1ccc([N+](=O)[O-])cc1C ZINC000545963627 942774013 /nfs/dbraw/zinc/77/40/13/942774013.db2.gz BZVHOGYWAIVXNH-UHFFFAOYSA-N 0 0 370.796 3.725 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])[nH]1)N1CCC[C@H](COc2ccccc2Cl)C1 ZINC000514149441 942774151 /nfs/dbraw/zinc/77/41/51/942774151.db2.gz MPPLNFRIYRSCDJ-LBPRGKRZSA-N 0 0 363.801 3.508 20 5 FHBDRN C[C@H](NCc1nc(-c2cccc([N+](=O)[O-])c2)no1)c1ccc(F)cc1F ZINC000181585968 942775786 /nfs/dbraw/zinc/77/57/86/942775786.db2.gz NTEQLJYXKPQITR-JTQLQIEISA-N 0 0 360.320 3.774 20 5 FHBDRN O=C(c1ccc(OC2CCCC2)nc1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000514140494 942777941 /nfs/dbraw/zinc/77/79/41/942777941.db2.gz PZQJAOOZRMCGRL-UHFFFAOYSA-N 0 0 353.378 3.514 20 5 FHBDRN Cc1ccc(C(=O)N(C)c2ccc(C(=O)NC(C)(C)C)cc2)cc1[N+](=O)[O-] ZINC000413919308 942778519 /nfs/dbraw/zinc/77/85/19/942778519.db2.gz FQWXSPMEDMVUJR-UHFFFAOYSA-N 0 0 369.421 3.708 20 5 FHBDRN O=C(c1csc(-c2ccc([N+](=O)[O-])cc2)n1)N1CCC(C2CC2)CC1 ZINC000590426786 942778588 /nfs/dbraw/zinc/77/85/88/942778588.db2.gz GXWVTCPQGQWXJN-UHFFFAOYSA-N 0 0 357.435 3.981 20 5 FHBDRN CCCCOC1CCN(c2nnc(-c3ccc([N+](=O)[O-])cc3)n2CC)CC1 ZINC000549436039 942782871 /nfs/dbraw/zinc/78/28/71/942782871.db2.gz BUBAVLIMOWIUCK-UHFFFAOYSA-N 0 0 373.457 3.659 20 5 FHBDRN COc1cc(CN2CCCC[C@H]2C(F)F)c([N+](=O)[O-])cc1OC(F)F ZINC000502831086 942784601 /nfs/dbraw/zinc/78/46/01/942784601.db2.gz QKGHJQGNWZMNOJ-JTQLQIEISA-N 0 0 366.311 3.824 20 5 FHBDRN Cn1ncc([N+](=O)[O-])c1NC(=O)c1ccc(SCc2ccccc2)cc1 ZINC001269818838 942788260 /nfs/dbraw/zinc/78/82/60/942788260.db2.gz FMBKGLHEXKTDJQ-UHFFFAOYSA-N 0 0 368.418 3.873 20 5 FHBDRN CC[C@H](c1ccncc1)N(C)C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514184686 942793717 /nfs/dbraw/zinc/79/37/17/942793717.db2.gz XSAWFLAIHJCDHK-CYBMUJFWSA-N 0 0 365.336 3.815 20 5 FHBDRN C[C@@H]1CCCC[C@@H]1OCCNC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000431871688 942804839 /nfs/dbraw/zinc/80/48/39/942804839.db2.gz MPJUTFLZAVAVCD-PBHICJAKSA-N 0 0 363.458 3.724 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1C[C@@H](C)O[C@@H](c2ccc(F)cc2)C1 ZINC000421774161 942816502 /nfs/dbraw/zinc/81/65/02/942816502.db2.gz LBNGDYMWVXDXPW-AUUYWEPGSA-N 0 0 372.396 3.953 20 5 FHBDRN CC[C@@H](CO)N(Cc1ccccc1)C(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC000421800066 942819886 /nfs/dbraw/zinc/81/98/86/942819886.db2.gz GFMPUJYQGKASBG-KRWDZBQOSA-N 0 0 356.422 3.625 20 5 FHBDRN O=C(NC[C@H]1CSc2ccccc21)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412374458 942820022 /nfs/dbraw/zinc/82/00/22/942820022.db2.gz XKNWMORXVGALQP-RRQGHBQHSA-N 0 0 354.431 3.704 20 5 FHBDRN COc1cccc(C2=CCN(C(=O)c3cc([N+](=O)[O-])c(C)cc3C)C2)c1 ZINC000421804187 942822167 /nfs/dbraw/zinc/82/21/67/942822167.db2.gz SVSJYLUJFUIGQQ-UHFFFAOYSA-N 0 0 352.390 3.760 20 5 FHBDRN CC(C)(C)Oc1cccc(CNC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)n1 ZINC000502882158 942826698 /nfs/dbraw/zinc/82/66/98/942826698.db2.gz YAVMCUHCLPNLOM-UHFFFAOYSA-N 0 0 369.377 3.843 20 5 FHBDRN CSc1ccc(NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)nc1 ZINC000514225402 942836635 /nfs/dbraw/zinc/83/66/35/942836635.db2.gz BQZSDQOVUANYLK-UHFFFAOYSA-N 0 0 355.322 3.565 20 5 FHBDRN COc1ccc(OCC(=O)Nc2ccc(C)cc2Cl)cc1[N+](=O)[O-] ZINC000190190927 942849840 /nfs/dbraw/zinc/84/98/40/942849840.db2.gz RRSLYEQDHYYITE-UHFFFAOYSA-N 0 0 350.758 3.583 20 5 FHBDRN Cc1csc(NC2CCN(C(=O)c3cc([N+](=O)[O-])c(C)cc3C)CC2)n1 ZINC000421863153 942852238 /nfs/dbraw/zinc/85/22/38/942852238.db2.gz JZXFFSKJSKMLHI-UHFFFAOYSA-N 0 0 374.466 3.693 20 5 FHBDRN COc1ccc(OCc2nc(-c3ccc(F)c(C)c3)no2)cc1[N+](=O)[O-] ZINC000190195698 942853505 /nfs/dbraw/zinc/85/35/05/942853505.db2.gz FYMRHEVJWAHWMR-UHFFFAOYSA-N 0 0 359.313 3.680 20 5 FHBDRN COc1ccc(OCC(=O)Nc2c(C)cccc2Cl)cc1[N+](=O)[O-] ZINC000190183707 942855056 /nfs/dbraw/zinc/85/50/56/942855056.db2.gz PGGHJCUWIXWMKU-UHFFFAOYSA-N 0 0 350.758 3.583 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)N1C[C@H](c2ccccc2)C2(CCC2)C1 ZINC000413971458 942855791 /nfs/dbraw/zinc/85/57/91/942855791.db2.gz BHVVPWYQBHZBLX-LJQANCHMSA-N 0 0 350.418 3.934 20 5 FHBDRN C[C@H](CNC(=O)c1c([N+](=O)[O-])cccc1C(F)(F)F)CC(F)(F)F ZINC000413973159 942856801 /nfs/dbraw/zinc/85/68/01/942856801.db2.gz DDZMQWKTWCIBIF-ZETCQYMHSA-N 0 0 358.238 3.932 20 5 FHBDRN CC(C)[C@@H]1N(C(=O)c2ccc(Cl)cc2[N+](=O)[O-])CC12CCOCC2 ZINC000413976546 942857133 /nfs/dbraw/zinc/85/71/33/942857133.db2.gz NUXVJBASFSVQLG-HNNXBMFYSA-N 0 0 352.818 3.525 20 5 FHBDRN CC(C)[C@H](NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)C(F)(F)F ZINC000413980068 942859280 /nfs/dbraw/zinc/85/92/80/942859280.db2.gz CFCZUEUFLFPPCD-JTQLQIEISA-N 0 0 356.247 3.513 20 5 FHBDRN CC(C)[C@@H]1N(C(=O)c2c(Cl)cccc2[N+](=O)[O-])CC12CCOCC2 ZINC000413985526 942867940 /nfs/dbraw/zinc/86/79/40/942867940.db2.gz VLUWYDDWSDBMTQ-HNNXBMFYSA-N 0 0 352.818 3.525 20 5 FHBDRN C[C@H](CNC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-])CC(F)(F)F ZINC000413989644 942868946 /nfs/dbraw/zinc/86/89/46/942868946.db2.gz OLLCSNMBYSZLPO-VIFPVBQESA-N 0 0 368.739 3.722 20 5 FHBDRN COC[C@@H](C)Nc1ccccc1NC(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC000421892592 942875100 /nfs/dbraw/zinc/87/51/00/942875100.db2.gz RLKCSJUEZHVGSH-CQSZACIVSA-N 0 0 357.410 3.911 20 5 FHBDRN CC(C)[C@H](NC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-])C(F)(F)F ZINC000413999145 942880706 /nfs/dbraw/zinc/88/07/06/942880706.db2.gz UKGMFLKGDPFMQR-ZDUSSCGKSA-N 0 0 368.739 3.720 20 5 FHBDRN O=C(c1ccc(Cl)cc1[N+](=O)[O-])N1CC[C@H](n2ncc3ccccc32)C1 ZINC000378566206 942893399 /nfs/dbraw/zinc/89/33/99/942893399.db2.gz GESAZMCBBFRJKM-AWEZNQCLSA-N 0 0 370.796 3.685 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])N1CCC[C@@H](CC(F)(F)F)C1 ZINC000421939939 942896765 /nfs/dbraw/zinc/89/67/65/942896765.db2.gz MDLSVOQVLBRFPD-LBPRGKRZSA-N 0 0 360.332 3.555 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)N1CCC[C@H](CC(F)(F)F)C1 ZINC000421948225 942901170 /nfs/dbraw/zinc/90/11/70/942901170.db2.gz VUAQKASMYSGNFA-GFCCVEGCSA-N 0 0 369.343 3.741 20 5 FHBDRN Cc1nccc(CNC(=O)c2cc([N+](=O)[O-])ccc2SC2CCCC2)n1 ZINC000137200664 942902781 /nfs/dbraw/zinc/90/27/81/942902781.db2.gz UDEHPYATMKMKER-UHFFFAOYSA-N 0 0 372.450 3.658 20 5 FHBDRN CC(=O)c1ccc(N2CCC[C@@H]2c2cccc3c2OCCO3)c([N+](=O)[O-])c1 ZINC000066818769 942910863 /nfs/dbraw/zinc/91/08/63/942910863.db2.gz MNIBXVDWPZIWOO-MRXNPFEDSA-N 0 0 368.389 3.910 20 5 FHBDRN Cc1cc(OCC(=O)N2CCCSc3ccccc32)ccc1[N+](=O)[O-] ZINC000430107617 942920473 /nfs/dbraw/zinc/92/04/73/942920473.db2.gz SCSUJXMFHZULQR-UHFFFAOYSA-N 0 0 358.419 3.811 20 5 FHBDRN CN([C@@H]1CCC[C@H]1c1ccccc1)S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000416547671 942938013 /nfs/dbraw/zinc/93/80/13/942938013.db2.gz WBYABGROCWPYJH-RBUKOAKNSA-N 0 0 374.462 3.693 20 5 FHBDRN COCC[C@@H](NC(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1)C(C)(C)C ZINC000511566453 942940985 /nfs/dbraw/zinc/94/09/85/942940985.db2.gz PGWMXJSDVPJNSK-CZUORRHYSA-N 0 0 351.447 3.715 20 5 FHBDRN COc1ccc(NC(=O)Cc2cccc(Br)c2)c([N+](=O)[O-])c1 ZINC000133633064 942941255 /nfs/dbraw/zinc/94/12/55/942941255.db2.gz OCJRBBXHUSWPHG-UHFFFAOYSA-N 0 0 365.183 3.547 20 5 FHBDRN CSC[C@](C)(O)CNc1cc(Cl)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000078022464 942941381 /nfs/dbraw/zinc/94/13/81/942941381.db2.gz VMUCRLPZNNBNTE-LLVKDONJSA-N 0 0 358.769 3.793 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCC1CCSCC1 ZINC000503067207 942949457 /nfs/dbraw/zinc/94/94/57/942949457.db2.gz QULCEPGDOUIWOW-UHFFFAOYSA-N 0 0 354.497 3.970 20 5 FHBDRN COc1cccc(Br)c1OC(=O)c1csc([N+](=O)[O-])c1 ZINC000178360214 942965231 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NC(=O)c1ccc(N2CCC(c3c[nH]c4ccccc43)CC2)c([N+](=O)[O-])c1 ZINC000014319545 943024260 /nfs/dbraw/zinc/02/42/60/943024260.db2.gz JWYVDDFTLDMJAD-UHFFFAOYSA-N 0 0 364.405 3.559 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NCCc1c[nH]c2ccc(F)cc12 ZINC000122964078 943028096 /nfs/dbraw/zinc/02/80/96/943028096.db2.gz RDZDUULVRJWWHH-UHFFFAOYSA-N 0 0 372.356 3.588 20 5 FHBDRN O=C(CN1CC=C(c2ccc(Cl)cc2)CC1)Nc1ccccc1[N+](=O)[O-] ZINC000434904837 943042348 /nfs/dbraw/zinc/04/23/48/943042348.db2.gz OXMVASLSMCSSST-UHFFFAOYSA-N 0 0 371.824 3.976 20 5 FHBDRN COc1ccc(C[C@@H](C)CNC(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 ZINC000536254698 943047500 /nfs/dbraw/zinc/04/75/00/943047500.db2.gz RDWRWCQNGMEVNW-CYBMUJFWSA-N 0 0 357.410 3.912 20 5 FHBDRN COCCOc1ccc(F)cc1NCc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000184010599 943047540 /nfs/dbraw/zinc/04/75/40/943047540.db2.gz DEVKPNFTYYWFGR-UHFFFAOYSA-N 0 0 368.336 3.519 20 5 FHBDRN CCN(C(=O)COc1cccc([N+](=O)[O-])c1)C12CC3CC(CC(C3)C1)C2 ZINC000514487676 943048906 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3.659 20 5 FHBDRN COC(=O)CCCOc1ccc(Nc2ncc(Cl)cc2[N+](=O)[O-])cc1 ZINC000434947668 943067707 /nfs/dbraw/zinc/06/77/07/943067707.db2.gz RPSZVKLEPUGJSD-UHFFFAOYSA-N 0 0 365.773 3.719 20 5 FHBDRN O=C(C[C@@H](c1cccs1)n1cccc1)NCCc1cccc([N+](=O)[O-])c1 ZINC000503228953 943071802 /nfs/dbraw/zinc/07/18/02/943071802.db2.gz GOPRMKMARYVPFB-KRWDZBQOSA-N 0 0 369.446 3.796 20 5 FHBDRN Cc1cc(NC(=O)c2ccc([N+](=O)[O-])cc2)cnc1N1CCCC[C@H]1C ZINC000503228551 943072001 /nfs/dbraw/zinc/07/20/01/943072001.db2.gz GHWJTCQWGAJHFV-CQSZACIVSA-N 0 0 354.410 3.929 20 5 FHBDRN COc1cc(NC(=O)Cc2cccc([N+](=O)[O-])c2C)ccc1OC(C)C ZINC000183891885 943076173 /nfs/dbraw/zinc/07/61/73/943076173.db2.gz YNCCFLGNODEAHB-UHFFFAOYSA-N 0 0 358.394 3.880 20 5 FHBDRN Cc1c(C(=O)N(C)Cc2ccccc2[N+](=O)[O-])cnn1-c1cccc(C)c1 ZINC000514520283 943079476 /nfs/dbraw/zinc/07/94/76/943079476.db2.gz IRQUVXXDENYDCF-UHFFFAOYSA-N 0 0 364.405 3.670 20 5 FHBDRN CN(CCOc1ccccc1)Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000434984279 943081242 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COc1cc(OCC(=O)N(C)[C@@H](C)c2ccc(C)cc2C)ccc1[N+](=O)[O-] ZINC000503303566 943112307 /nfs/dbraw/zinc/11/23/07/943112307.db2.gz NWCQXPPOOSKKKT-HNNXBMFYSA-N 0 0 372.421 3.819 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2nc(CN3C[C@H](O)Cc4ccccc43)cs2)c1 ZINC000435047622 943118947 /nfs/dbraw/zinc/11/89/47/943118947.db2.gz ILNLVJQHLLISGT-QGZVFWFLSA-N 0 0 367.430 3.642 20 5 FHBDRN CCNc1ccc(C(=O)N2CCC(OC3CCCC3)CC2)cc1[N+](=O)[O-] ZINC000503335272 943124555 /nfs/dbraw/zinc/12/45/55/943124555.db2.gz JIXRGBCQAUONGD-UHFFFAOYSA-N 0 0 361.442 3.590 20 5 FHBDRN Cc1ccc(NC(=O)Nc2cnn(Cc3ccccc3)c2)cc1[N+](=O)[O-] ZINC000048050826 943127844 /nfs/dbraw/zinc/12/78/44/943127844.db2.gz YBAMBGUFMDWWAX-UHFFFAOYSA-N 0 0 351.366 3.792 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N1CCC[C@H]1[C@@H]1CCCOC1 ZINC000514600974 943140127 /nfs/dbraw/zinc/14/01/27/943140127.db2.gz WQBHIKIWNJRQJQ-ABAIWWIYSA-N 0 0 353.806 3.671 20 5 FHBDRN CCN(C(=O)NCCc1ccc([N+](=O)[O-])cc1)[C@H](C)Cc1ccsc1 ZINC000190398250 943141250 /nfs/dbraw/zinc/14/12/50/943141250.db2.gz LTGANWCFCOFTMN-CQSZACIVSA-N 0 0 361.467 3.862 20 5 FHBDRN O=C([C@@H]1[C@@H]2CCCO[C@H]12)N(Cc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000503406170 943165188 /nfs/dbraw/zinc/16/51/88/943165188.db2.gz WPAYIYRASRNPLB-OTWHNJEPSA-N 0 0 352.390 3.553 20 5 FHBDRN CC(C)(CCO)Nc1nnc(-c2ccccc2[N+](=O)[O-])cc1C(F)(F)F ZINC001167739170 943168034 /nfs/dbraw/zinc/16/80/34/943168034.db2.gz IPGVKDQSTAKFBH-UHFFFAOYSA-N 0 0 370.331 3.644 20 5 FHBDRN COc1ccccc1-c1nc(C(=O)Nc2ccc([N+](=O)[O-])c(C)n2)cs1 ZINC000133682379 943172202 /nfs/dbraw/zinc/17/22/02/943172202.db2.gz ASKHROZEPFNVCQ-UHFFFAOYSA-N 0 0 370.390 3.683 20 5 FHBDRN C[C@H](C(=O)N1C[C@@H]2CCC(=O)c3cccc1c32)c1ccc([N+](=O)[O-])cc1F ZINC000183801937 943186971 /nfs/dbraw/zinc/18/69/71/943186971.db2.gz BCIQEULCTTXCFD-RYUDHWBXSA-N 0 0 368.364 3.944 20 5 FHBDRN Cc1ncc([N+](=O)[O-])c(OCc2cccc(C(=O)NCC(C)C)c2)c1C ZINC000514677723 943194324 /nfs/dbraw/zinc/19/43/24/943194324.db2.gz KLHDHHLPFVUCAA-UHFFFAOYSA-N 0 0 357.410 3.571 20 5 FHBDRN O=C(Nc1ncsc1C1CC1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000893279468 943198076 /nfs/dbraw/zinc/19/80/76/943198076.db2.gz IKUVQEWFTSJMBM-UHFFFAOYSA-N 0 0 372.450 3.784 20 5 FHBDRN COc1cc(C)c(Br)cc1NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000183934591 943211753 /nfs/dbraw/zinc/21/17/53/943211753.db2.gz KSYSDNLASPPZBP-UHFFFAOYSA-N 0 0 365.183 3.927 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1C[C@@H](O)C[C@@H]1c1ccccc1 ZINC000416914457 943222897 /nfs/dbraw/zinc/22/28/97/943222897.db2.gz GXMSFDJVOXNWCI-DOTOQJQBSA-N 0 0 355.394 3.551 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1C[C@@H](O)C[C@H]1c1ccccc1 ZINC000416914461 943223169 /nfs/dbraw/zinc/22/31/69/943223169.db2.gz GXMSFDJVOXNWCI-RDJZCZTQSA-N 0 0 355.394 3.551 20 5 FHBDRN C[C@H]1C[C@H](C(C)(C)C)CCN1C(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000503542535 943238306 /nfs/dbraw/zinc/23/83/06/943238306.db2.gz XQNPKGVTRXLHCO-QWHCGFSZSA-N 0 0 373.457 3.827 20 5 FHBDRN CO[C@H](CCNc1ccc([N+](=O)[O-])cc1Br)C(F)(F)F ZINC000503581118 943263409 /nfs/dbraw/zinc/26/34/09/943263409.db2.gz JNLXTORYFYXSDI-SNVBAGLBSA-N 0 0 357.126 3.737 20 5 FHBDRN CCCCN(C)C(=O)CSc1ccc([N+](=O)[O-])cc1Br ZINC000503572430 943268910 /nfs/dbraw/zinc/26/89/10/943268910.db2.gz FWPJVMTUMMBRFH-UHFFFAOYSA-N 0 0 361.261 3.708 20 5 FHBDRN COc1cc2ccccc2cc1C(=O)NCc1cccc([N+](=O)[O-])c1C ZINC000616491223 943269223 /nfs/dbraw/zinc/26/92/23/943269223.db2.gz RWVNKEXHPJTKIS-UHFFFAOYSA-N 0 0 350.374 3.995 20 5 FHBDRN COc1cc(CSc2ccc(NC(C)=O)cc2)c([N+](=O)[O-])cc1F ZINC000183832328 943270821 /nfs/dbraw/zinc/27/08/21/943270821.db2.gz SISIFCHDKREILT-UHFFFAOYSA-N 0 0 350.371 3.993 20 5 FHBDRN CC(C)c1[nH]nc(C(=O)Nc2ccc(Oc3ccncc3)cc2)c1[N+](=O)[O-] ZINC000434182758 943271666 /nfs/dbraw/zinc/27/16/66/943271666.db2.gz LKHBFSKISHMUFD-UHFFFAOYSA-N 0 0 367.365 3.881 20 5 FHBDRN CC(=O)c1ccc2c(c1)CN(C(=O)Nc1cc([N+](=O)[O-])c(C)cc1C)C2 ZINC000416990442 943274761 /nfs/dbraw/zinc/27/47/61/943274761.db2.gz BTXJBDBTXNQZBN-UHFFFAOYSA-N 0 0 353.378 3.962 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)N[C@@H]1C[C@H]1c1ccco1 ZINC000416991482 943277990 /nfs/dbraw/zinc/27/79/90/943277990.db2.gz QFQBQDPQEJGFHE-MWLCHTKSSA-N 0 0 355.272 3.884 20 5 FHBDRN O=C(Nc1cc(F)c(F)cc1Br)c1csc([N+](=O)[O-])c1 ZINC000435249524 943279038 /nfs/dbraw/zinc/27/90/38/943279038.db2.gz NIRPJOLFAUKXHN-UHFFFAOYSA-N 0 0 363.139 3.949 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)N1CCO[C@@H](C2CCC2)C1 ZINC000416995094 943279125 /nfs/dbraw/zinc/27/91/25/943279125.db2.gz VHMIGJIBLPYPMX-CQSZACIVSA-N 0 0 373.331 3.646 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N([C@@H](C)C(=O)OC(C)(C)C)C1CC1 ZINC000416995668 943280709 /nfs/dbraw/zinc/28/07/09/943280709.db2.gz LRTXHYNZEXXQJO-LBPRGKRZSA-N 0 0 363.414 3.630 20 5 FHBDRN Cc1ccc(N2CCN(C(=O)c3c(Cl)cccc3[N+](=O)[O-])CC2)cc1C ZINC000760019648 943281245 /nfs/dbraw/zinc/28/12/45/943281245.db2.gz IGBZAOJISKEHCI-UHFFFAOYSA-N 0 0 373.840 3.827 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NCc1cnccc1C(C)(C)C ZINC000416998011 943281991 /nfs/dbraw/zinc/28/19/91/943281991.db2.gz OUQKQYZIOYHWMF-UHFFFAOYSA-N 0 0 358.398 3.618 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CCN(Cc2ccccc2)[C@H](C)C1 ZINC000417000741 943283236 /nfs/dbraw/zinc/28/32/36/943283236.db2.gz RSJJVMBCTHCHEO-MRXNPFEDSA-N 0 0 368.437 3.641 20 5 FHBDRN Cn1c2cccc(F)c2nc1NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000503598033 943283439 /nfs/dbraw/zinc/28/34/39/943283439.db2.gz OKZBBYWVLPPQOF-UHFFFAOYSA-N 0 0 368.290 3.673 20 5 FHBDRN O=C(c1cc2nc[nH]c2cc1F)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000425315905 943291666 /nfs/dbraw/zinc/29/16/66/943291666.db2.gz OUFSLWNXELZDJF-ZDUSSCGKSA-N 0 0 368.368 3.630 20 5 FHBDRN COc1ccc([C@@H](C)NC(=O)c2cc([N+](=O)[O-])ccc2C)c(C)c1OC ZINC000514809786 943307041 /nfs/dbraw/zinc/30/70/41/943307041.db2.gz KBDXTSDTEJODII-CYBMUJFWSA-N 0 0 358.394 3.720 20 5 FHBDRN CC(C)(C)[C@@H]1C[C@H](NC(=O)c2c([N+](=O)[O-])cccc2C(F)(F)F)CCO1 ZINC000566409666 943312141 /nfs/dbraw/zinc/31/21/41/943312141.db2.gz KMPHTNVVKYSHLZ-MFKMUULPSA-N 0 0 374.359 3.937 20 5 FHBDRN Cc1ccc(S(=O)(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)c(Cl)c1 ZINC000431918352 943313988 /nfs/dbraw/zinc/31/39/88/943313988.db2.gz HJKKWYPFGZACFK-UHFFFAOYSA-N 0 0 368.842 3.770 20 5 FHBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NCc1ccccc1Cl ZINC000016987497 943320795 /nfs/dbraw/zinc/32/07/95/943320795.db2.gz WQNFJMOHCXGFAY-JTQLQIEISA-N 0 0 369.204 3.985 20 5 FHBDRN CCOC(=O)c1ccccc1N(C)C(=O)c1c(C)c(C)ccc1[N+](=O)[O-] ZINC001125897377 943323298 /nfs/dbraw/zinc/32/32/98/943323298.db2.gz WYWNVDMCULIZJB-UHFFFAOYSA-N 0 0 356.378 3.665 20 5 FHBDRN C[C@H](c1ccccc1Br)N(C)C(=O)c1ccc([N+](=O)[O-])n1C ZINC000503654682 943323475 /nfs/dbraw/zinc/32/34/75/943323475.db2.gz MNGGAHWZJWVXSK-SNVBAGLBSA-N 0 0 366.215 3.529 20 5 FHBDRN Cc1c(NC(=O)N2CC=C(C)CC2)cc(Br)cc1[N+](=O)[O-] ZINC000435330503 943333784 /nfs/dbraw/zinc/33/37/84/943333784.db2.gz TZFHQBAAJYJOTN-UHFFFAOYSA-N 0 0 354.204 3.850 20 5 FHBDRN Cc1nc2nc(SCc3c(F)cc([N+](=O)[O-])cc3F)nn2c(C)c1C ZINC000505665335 943335765 /nfs/dbraw/zinc/33/57/65/943335765.db2.gz UEIVGEMNKBRDRF-UHFFFAOYSA-N 0 0 365.365 3.528 20 5 FHBDRN CC(C)(C)c1ccc(NC(=O)N2C[C@@H]3CC[C@H](O)C[C@@H]3C2)cc1[N+](=O)[O-] ZINC000417107568 943345400 /nfs/dbraw/zinc/34/54/00/943345400.db2.gz HLLJXVJMINOPBL-GUTXKFCHSA-N 0 0 361.442 3.517 20 5 FHBDRN Cn1c(C(=O)Nc2ccc(Sc3ccncc3)cc2)ccc1[N+](=O)[O-] ZINC000435370780 943364297 /nfs/dbraw/zinc/36/42/97/943364297.db2.gz JXPUSRWDHCQNCW-UHFFFAOYSA-N 0 0 354.391 3.732 20 5 FHBDRN COc1ccc(CSCC(=O)N(C)Cc2cccc(C)c2)cc1[N+](=O)[O-] ZINC000514900058 943370442 /nfs/dbraw/zinc/37/04/42/943370442.db2.gz AGBPHBLEAGDBLW-UHFFFAOYSA-N 0 0 374.462 3.804 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)c1occc1COc1ccccc1 ZINC000053216317 943381848 /nfs/dbraw/zinc/38/18/48/943381848.db2.gz YATZAAQSBUWXCH-UHFFFAOYSA-N 0 0 366.373 3.739 20 5 FHBDRN O=C(CCCc1nc2ccccc2s1)NCCc1ccc([N+](=O)[O-])cc1 ZINC000053216402 943386523 /nfs/dbraw/zinc/38/65/23/943386523.db2.gz CXSJHOFUWSQRFS-UHFFFAOYSA-N 0 0 369.446 3.886 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)C1(c2ccc(F)cc2)CCCC1 ZINC000053218081 943386540 /nfs/dbraw/zinc/38/65/40/943386540.db2.gz ORBFFNYXHKDXGU-UHFFFAOYSA-N 0 0 356.397 3.905 20 5 FHBDRN Cc1ccc(S(=O)(=O)N2CCC[C@@H]2/C=C\c2ccccc2)cc1[N+](=O)[O-] ZINC000503861956 943390006 /nfs/dbraw/zinc/39/00/06/943390006.db2.gz PGNULQIKABMWNE-QXPKXGMISA-N 0 0 372.446 3.770 20 5 FHBDRN COc1ccc(C)cc1CCNC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000503893128 943395812 /nfs/dbraw/zinc/39/58/12/943395812.db2.gz NPNFTQIYDWTPAZ-UHFFFAOYSA-N 0 0 363.801 3.929 20 5 FHBDRN O=C(c1c([N+](=O)[O-])cccc1C(F)(F)F)N1CC[C@H](c2cccnc2)C1 ZINC000514941142 943408864 /nfs/dbraw/zinc/40/88/64/943408864.db2.gz WWVZQINHJNQHDW-LBPRGKRZSA-N 0 0 365.311 3.638 20 5 FHBDRN Cc1cnn(CC(=O)Nc2cc([N+](=O)[O-])ccc2Sc2cccs2)c1 ZINC000435450136 943410835 /nfs/dbraw/zinc/41/08/35/943410835.db2.gz ZMVLCYYLPCJBFR-UHFFFAOYSA-N 0 0 374.447 3.951 20 5 FHBDRN CCn1c(C)nc([N+](=O)[O-])c1NCCc1nc2ccccc2n1C(F)F ZINC000514966551 943413100 /nfs/dbraw/zinc/41/31/00/943413100.db2.gz UHMWOHBRTDONEO-UHFFFAOYSA-N 0 0 364.356 3.519 20 5 FHBDRN C[C@H](c1ccccc1)[C@H](C)NC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000473555007 943424513 /nfs/dbraw/zinc/42/45/13/943424513.db2.gz RLAZCJSYKZJZJP-GJZGRUSLSA-N 0 0 364.405 3.703 20 5 FHBDRN COc1ccc(-c2ocnc2-c2nc(-c3cccc([N+](=O)[O-])c3)no2)cc1 ZINC000514968388 943434971 /nfs/dbraw/zinc/43/49/71/943434971.db2.gz CQJNGZNNIFIBRW-UHFFFAOYSA-N 0 0 364.317 3.975 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N(C)c2ccc(Cl)cc2F)c1C ZINC000435479426 943437049 /nfs/dbraw/zinc/43/70/49/943437049.db2.gz KTELHEZFVTWYBX-UHFFFAOYSA-N 0 0 372.805 3.829 20 5 FHBDRN COCCn1c(C)c(C)nc1SCc1c(F)cc([N+](=O)[O-])cc1F ZINC000505700652 943446970 /nfs/dbraw/zinc/44/69/70/943446970.db2.gz QZQYKUHDXSOKRX-UHFFFAOYSA-N 0 0 357.382 3.625 20 5 FHBDRN O=C(N[C@@H](c1ccccc1)c1ccncc1)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000503999549 943459350 /nfs/dbraw/zinc/45/93/50/943459350.db2.gz XTISZZNDWPPUFD-FQEVSTJZSA-N 0 0 372.384 3.991 20 5 FHBDRN O=C(COc1ccccc1[N+](=O)[O-])NCCc1c(Cl)cccc1Cl ZINC000053237731 943470100 /nfs/dbraw/zinc/47/01/00/943470100.db2.gz SRUACJPPBJQBSK-UHFFFAOYSA-N 0 0 369.204 3.639 20 5 FHBDRN Cc1ccc(COC(=O)c2cc3c(cc2[N+](=O)[O-])OCCCO3)c(C)c1 ZINC001269481244 943474795 /nfs/dbraw/zinc/47/47/95/943474795.db2.gz QFTCYJCRIWKKJT-UHFFFAOYSA-N 0 0 357.362 3.730 20 5 FHBDRN CCOC(=O)c1cc(C(=O)N2CC[C@H](C)[C@H]3CCCC[C@H]32)cc([N+](=O)[O-])c1 ZINC000515058552 943479953 /nfs/dbraw/zinc/47/99/53/943479953.db2.gz QQEXPQFYQULVGF-MORSLUCNSA-N 0 0 374.437 3.812 20 5 FHBDRN CCOc1ccc(NC(=O)c2cccc(OC)c2[N+](=O)[O-])cc1Cl ZINC000435548225 943481282 /nfs/dbraw/zinc/48/12/82/943481282.db2.gz MXKRESNVTBSVSI-UHFFFAOYSA-N 0 0 350.758 3.908 20 5 FHBDRN O=C(Nc1cc2c(cc1F)CCC(=O)N2)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000505706067 943483737 /nfs/dbraw/zinc/48/37/37/943483737.db2.gz MRTYUMGRFHGCBB-UHFFFAOYSA-N 0 0 363.732 3.524 20 5 FHBDRN Cc1csc(CCC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)n1 ZINC000435567533 943489807 /nfs/dbraw/zinc/48/98/07/943489807.db2.gz LVEQTVZFBFCSSP-UHFFFAOYSA-N 0 0 357.338 3.532 20 5 FHBDRN CC(C)Oc1ccc(C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)nc1 ZINC000435568142 943490611 /nfs/dbraw/zinc/49/06/11/943490611.db2.gz NTKBKIDQDBEJOU-UHFFFAOYSA-N 0 0 367.308 3.631 20 5 FHBDRN O=C(NC[C@H]1CC[C@@H](c2ccccc2)O1)Nc1cc(F)cc([N+](=O)[O-])c1 ZINC000515096165 943502883 /nfs/dbraw/zinc/50/28/83/943502883.db2.gz BWHCJGIAHWTLLB-SJORKVTESA-N 0 0 359.357 3.776 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1NCc1csc(Br)c1)CCN2 ZINC000436307762 943502967 /nfs/dbraw/zinc/50/29/67/943502967.db2.gz LCCFIULESUYCNT-UHFFFAOYSA-N 0 0 354.229 3.999 20 5 FHBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@H]2C[C@H](c3cccc(Cl)c3)C2)s1 ZINC000435589858 943506736 /nfs/dbraw/zinc/50/67/36/943506736.db2.gz SVTFILBVWMWHOO-UMSPYCQHSA-N 0 0 372.855 3.534 20 5 FHBDRN Cc1sc(C(=O)Nc2n[nH]c(-c3ccccc3Cl)n2)cc1[N+](=O)[O-] ZINC000504121053 943511906 /nfs/dbraw/zinc/51/19/06/943511906.db2.gz RWCBSHBJUWFYFK-UHFFFAOYSA-N 0 0 363.786 3.656 20 5 FHBDRN COc1cc(C(=O)Nc2nc3c(s2)CCCCCC3)ccc1[N+](=O)[O-] ZINC000511621295 943538730 /nfs/dbraw/zinc/53/87/30/943538730.db2.gz ZDXFGGGQERGAAX-UHFFFAOYSA-N 0 0 361.423 3.971 20 5 FHBDRN O=[N+]([O-])c1ccccc1/C=C/c1nc(-c2cccc(OCC(F)F)n2)no1 ZINC000584753255 943541367 /nfs/dbraw/zinc/54/13/67/943541367.db2.gz ODQMCCMYZVZVDM-CMDGGOBGSA-N 0 0 374.303 3.854 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H]1CCCc2ccccc21 ZINC000504192013 943542746 /nfs/dbraw/zinc/54/27/46/943542746.db2.gz SKWOZAHFWPVADI-CQSZACIVSA-N 0 0 355.394 3.845 20 5 FHBDRN Cc1cc(OCC(=O)N[C@H]2CCC[C@@H]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC001126416084 943543356 /nfs/dbraw/zinc/54/33/56/943543356.db2.gz ZYRBFAWGPAHXLD-MJGOQNOKSA-N 0 0 368.433 3.810 20 5 FHBDRN Cc1nn(CC(=O)Nc2ccc(C)c([N+](=O)[O-])c2)cc1-c1ccccc1 ZINC000435673734 943552357 /nfs/dbraw/zinc/55/23/57/943552357.db2.gz WAFLGNPGUKFEBR-UHFFFAOYSA-N 0 0 350.378 3.714 20 5 FHBDRN CC[C@H](O)CN(Cc1ccccc1)C(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000435710592 943557802 /nfs/dbraw/zinc/55/78/02/943557802.db2.gz VOVLQXBSGFSOLI-KRWDZBQOSA-N 0 0 368.389 3.754 20 5 FHBDRN CC(C)c1cccc(CNC(=O)c2ccc([N+](=O)[O-])c(-n3ccnc3)c2)c1 ZINC001269533116 943571299 /nfs/dbraw/zinc/57/12/99/943571299.db2.gz NHRIWBWCFKBMIO-UHFFFAOYSA-N 0 0 364.405 3.834 20 5 FHBDRN NC(=O)c1ccc(CN2CCC[C@@H]2c2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000053278720 943578004 /nfs/dbraw/zinc/57/80/04/943578004.db2.gz PGLGBUAVQJNRAH-MRXNPFEDSA-N 0 0 359.813 3.684 20 5 FHBDRN CC(C)(C)[C@@H]1CN(S(=O)(=O)c2ccc([N+](=O)[O-])s2)c2ccccc21 ZINC000435721880 943579827 /nfs/dbraw/zinc/57/98/27/943579827.db2.gz KEQWQPRVBPCJQN-GFCCVEGCSA-N 0 0 366.464 3.995 20 5 FHBDRN O=c1[nH]c2ccccc2cc1CCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000504305679 943583695 /nfs/dbraw/zinc/58/36/95/943583695.db2.gz WUDQNONHFDFQAX-UHFFFAOYSA-N 0 0 362.345 3.684 20 5 FHBDRN C[C@@H]1CCCC[C@H]1OCCNC(=O)CSCc1ccc([N+](=O)[O-])cc1 ZINC000513813208 943585690 /nfs/dbraw/zinc/58/56/90/943585690.db2.gz ZFVQSJSHCBDDCY-RHSMWYFYSA-N 0 0 366.483 3.540 20 5 FHBDRN C[C@@H]1CCCC[C@@H]1OCCNC(=O)CSCc1ccc([N+](=O)[O-])cc1 ZINC000513813207 943586020 /nfs/dbraw/zinc/58/60/20/943586020.db2.gz ZFVQSJSHCBDDCY-PBHICJAKSA-N 0 0 366.483 3.540 20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])N[C@@H]1CCC[C@H]1c1ccccc1 ZINC000515240206 943590145 /nfs/dbraw/zinc/59/01/45/943590145.db2.gz WPHGQPUNXPBELP-DLBZAZTESA-N 0 0 353.422 3.849 20 5 FHBDRN C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)CCCOCCc1ccccc1 ZINC000504303932 943591293 /nfs/dbraw/zinc/59/12/93/943591293.db2.gz KTJFBPMGDVJIFC-INIZCTEOSA-N 0 0 368.433 3.912 20 5 FHBDRN CC1=NN(c2ccc(C(=O)N3c4ccc([N+](=O)[O-])cc4C[C@H]3C)cc2)CC1 ZINC000504334465 943598786 /nfs/dbraw/zinc/59/87/86/943598786.db2.gz MZPWHTRFOJPSBP-CQSZACIVSA-N 0 0 364.405 3.772 20 5 FHBDRN COC(=O)[C@@H](C)c1ccc(NC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000417444570 943615636 /nfs/dbraw/zinc/61/56/36/943615636.db2.gz YPFDDOLTASZGEA-STQMWFEESA-N 0 0 371.393 3.754 20 5 FHBDRN C[C@]1(C(=O)Nc2cc3c(cc2[N+](=O)[O-])OCCCO3)C[C@@H]1c1ccccc1 ZINC000414760436 943616495 /nfs/dbraw/zinc/61/64/95/943616495.db2.gz YTKDOKCFNKPPSH-VLIAUNLRSA-N 0 0 368.389 3.888 20 5 FHBDRN COc1cc(Cc2noc(C3=CCCCCC3)n2)c([N+](=O)[O-])c(OC)c1 ZINC000584806505 943647186 /nfs/dbraw/zinc/64/71/86/943647186.db2.gz MPMWQZKJBMVTPU-UHFFFAOYSA-N 0 0 359.382 3.933 20 5 FHBDRN Cc1nnc(SCc2c(F)cccc2[N+](=O)[O-])n1Cc1ccccc1 ZINC000504519250 943652795 /nfs/dbraw/zinc/65/27/95/943652795.db2.gz SNHOJVLDHKMWNA-UHFFFAOYSA-N 0 0 358.398 3.974 20 5 FHBDRN Cn1c(SCc2c(F)cccc2[N+](=O)[O-])nnc1-c1cccs1 ZINC000504546587 943669690 /nfs/dbraw/zinc/66/96/90/943669690.db2.gz GWBQULXBEMZCGU-UHFFFAOYSA-N 0 0 350.400 3.883 20 5 FHBDRN COc1ccc(NC(=O)N2CCc3cc(F)cc(C)c3C2)cc1[N+](=O)[O-] ZINC000504609314 943716964 /nfs/dbraw/zinc/71/69/64/943716964.db2.gz WPZJTXUGDGOYJD-UHFFFAOYSA-N 0 0 359.357 3.641 20 5 FHBDRN CCSc1ccc([C@@H](C)NC(=O)COc2ccc([N+](=O)[O-])cc2)cc1 ZINC000504704650 943749714 /nfs/dbraw/zinc/74/97/14/943749714.db2.gz YPQRGJMSLQFLCC-CYBMUJFWSA-N 0 0 360.435 3.963 20 5 FHBDRN CCOc1cc(C(=O)NC[C@@H]2CCC[C@H]2C2CC2)c([N+](=O)[O-])cc1OC ZINC000412484503 943756983 /nfs/dbraw/zinc/75/69/83/943756983.db2.gz XIRQYVVOTMORRF-KBPBESRZSA-N 0 0 362.426 3.558 20 5 FHBDRN CCc1ccc(CN(C)C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)cc1 ZINC000515284091 943759459 /nfs/dbraw/zinc/75/94/59/943759459.db2.gz ZBMSCSPJEAJUNO-UHFFFAOYSA-N 0 0 364.405 3.615 20 5 FHBDRN CCOc1cc(NC(=O)[C@H]2CCC[C@H](F)C2)c([N+](=O)[O-])cc1OCC ZINC000425409561 943761487 /nfs/dbraw/zinc/76/14/87/943761487.db2.gz AWQUKGLQXDYFFF-RYUDHWBXSA-N 0 0 354.378 3.859 20 5 FHBDRN CS[C@@H]1CCCCN(C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000435779719 943766421 /nfs/dbraw/zinc/76/64/21/943766421.db2.gz SHBCLPKBTXJJLY-QGZVFWFLSA-N 0 0 365.499 3.845 20 5 FHBDRN O=C(N[C@H]1CCCOc2ccccc21)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000504718087 943767346 /nfs/dbraw/zinc/76/73/46/943767346.db2.gz YKJAIEFERFUQNC-INIZCTEOSA-N 0 0 367.405 3.813 20 5 FHBDRN O=C([O-])C[C@H](C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C(F)(F)F ZINC000417630807 943767795 /nfs/dbraw/zinc/76/77/95/943767795.db2.gz RPORFZGOGGEZIQ-LLVKDONJSA-N 0 0 372.299 3.598 20 5 FHBDRN COc1ccc(NC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)cc1OC ZINC000435813413 943770485 /nfs/dbraw/zinc/77/04/85/943770485.db2.gz HWCOKKIKPQJTOF-UHFFFAOYSA-N 0 0 374.396 3.951 20 5 FHBDRN CC(C)Oc1ccc(C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)nc1 ZINC000435814517 943771700 /nfs/dbraw/zinc/77/17/00/943771700.db2.gz WKMKAKMOVNAIKE-UHFFFAOYSA-N 0 0 357.410 3.530 20 5 FHBDRN O=C(NCCc1ccco1)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12 ZINC000435819238 943774343 /nfs/dbraw/zinc/77/43/43/943774343.db2.gz VNKPECHDYCBTOQ-UHFFFAOYSA-N 0 0 368.339 3.525 20 5 FHBDRN O=C(N[C@H]1C[C@H](c2ccc(C(F)(F)F)cc2)C1)c1ccc([N+](=O)[O-])[nH]1 ZINC000437397763 943774364 /nfs/dbraw/zinc/77/43/64/943774364.db2.gz PWMMPBULJFRVAH-UMSPYCQHSA-N 0 0 353.300 3.618 20 5 FHBDRN COCCSc1ccc([C@H](C)NC(=O)c2csc([N+](=O)[O-])c2)cc1 ZINC000504749705 943780392 /nfs/dbraw/zinc/78/03/92/943780392.db2.gz IYEIIMKJIAYWJM-NSHDSACASA-N 0 0 366.464 3.886 20 5 FHBDRN CCO[C@H]1C[C@H](N(C)C(=O)c2cccc(OC)c2[N+](=O)[O-])C1(CC)CC ZINC000435807298 943784137 /nfs/dbraw/zinc/78/41/37/943784137.db2.gz IQVLWFTZHPETKO-HOTGVXAUSA-N 0 0 364.442 3.659 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N[C@H]1C[C@H](c2ccccc2F)C1 ZINC000437412493 943785661 /nfs/dbraw/zinc/78/56/61/943785661.db2.gz PDQXNUDDBBNNDP-MQMHXKEQSA-N 0 0 367.380 3.820 20 5 FHBDRN O=C(NCCc1cccc(F)c1)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000435834004 943789292 /nfs/dbraw/zinc/78/92/92/943789292.db2.gz GWRHPHLZQGIQGD-UHFFFAOYSA-N 0 0 360.388 3.793 20 5 FHBDRN O=C(Cc1ccc(Cl)s1)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000515327320 943791455 /nfs/dbraw/zinc/79/14/55/943791455.db2.gz MYAYGCGQEDAXCE-UHFFFAOYSA-N 0 0 363.826 3.692 20 5 FHBDRN COc1cccc(C(=O)N[C@@H]2CCCO[C@@H]2c2ccc(C)cc2)c1[N+](=O)[O-] ZINC000435824272 943795998 /nfs/dbraw/zinc/79/59/98/943795998.db2.gz CPJKABWRFHIJBL-VQIMIIECSA-N 0 0 370.405 3.562 20 5 FHBDRN Cc1cc(OCC(=O)N2CC[C@@H](C)c3cccc(O)c32)ccc1[N+](=O)[O-] ZINC000435823493 943796748 /nfs/dbraw/zinc/79/67/48/943796748.db2.gz DCJIEZYINJLDOM-GFCCVEGCSA-N 0 0 356.378 3.528 20 5 FHBDRN COc1ccc(OC)c(NC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)c1 ZINC000435825258 943796940 /nfs/dbraw/zinc/79/69/40/943796940.db2.gz JYNMEQDLRBFMGP-UHFFFAOYSA-N 0 0 374.396 3.951 20 5 FHBDRN CC(=O)Nc1cccc(NC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)c1 ZINC000435831096 943800458 /nfs/dbraw/zinc/80/04/58/943800458.db2.gz MVOANACLCXCAKA-UHFFFAOYSA-N 0 0 371.396 3.892 20 5 FHBDRN COc1ccc(C[NH2+]CCC2(CC(=O)[O-])CCCCC2)cc1[N+](=O)[O-] ZINC000417653486 943800901 /nfs/dbraw/zinc/80/09/01/943800901.db2.gz SMPZHARADIODJO-UHFFFAOYSA-N 0 0 350.415 3.508 20 5 FHBDRN COc1ccc(C[C@H]2CCCN(C(=O)c3ccc([N+](=O)[O-])s3)C2)cc1 ZINC000516899835 943814518 /nfs/dbraw/zinc/81/45/18/943814518.db2.gz YLHUIPMBWBGQEM-CQSZACIVSA-N 0 0 360.435 3.760 20 5 FHBDRN CCC[C@@H]1CCCCN1C(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000516900688 943815986 /nfs/dbraw/zinc/81/59/86/943815986.db2.gz NIYDRRHWXFXUAM-OAHLLOKOSA-N 0 0 358.442 3.983 20 5 FHBDRN CCCN(C(=O)COc1ccc([N+](=O)[O-])cc1)[C@H]1CCc2ccccc21 ZINC000515371730 943817320 /nfs/dbraw/zinc/81/73/20/943817320.db2.gz KTPROZVLRMQJJP-IBGZPJMESA-N 0 0 354.406 3.900 20 5 FHBDRN C[C@@H]1COCC[C@@H]1C(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000435872257 943825597 /nfs/dbraw/zinc/82/55/97/943825597.db2.gz NNXQINBTKUDJHA-ACJLOTCBSA-N 0 0 356.378 3.998 20 5 FHBDRN COc1cccc(SC)c1NC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000417695917 943833335 /nfs/dbraw/zinc/83/33/35/943833335.db2.gz UUSWPBHNXMDGBD-UHFFFAOYSA-N 0 0 373.434 3.916 20 5 FHBDRN CC(=O)c1ccc(CC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000437468656 943840351 /nfs/dbraw/zinc/84/03/51/943840351.db2.gz CSFVIAYMWDOYJJ-UHFFFAOYSA-N 0 0 352.390 3.531 20 5 FHBDRN CCn1c(C)nc([N+](=O)[O-])c1N[C@H]1COc2c1ccc(Cl)c2Cl ZINC000515398167 943847171 /nfs/dbraw/zinc/84/71/71/943847171.db2.gz NGKQJEWNNILEII-JTQLQIEISA-N 0 0 357.197 3.972 20 5 FHBDRN COC(=O)c1ccc(-c2noc(-c3cc4cc([N+](=O)[O-])ccc4o3)n2)cc1 ZINC000504854904 943847470 /nfs/dbraw/zinc/84/74/70/943847470.db2.gz XMAKTSILDOWPTI-UHFFFAOYSA-N 0 0 365.301 3.845 20 5 FHBDRN Cn1c(C(=O)N[C@H]2C[C@H](c3cccc(C(F)(F)F)c3)C2)ccc1[N+](=O)[O-] ZINC000437478699 943848389 /nfs/dbraw/zinc/84/83/89/943848389.db2.gz YRLNNAKCTMPJFC-AULYBMBSSA-N 0 0 367.327 3.628 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1)[C@H](Nc1ccc(COCCO)cc1)CCCC2 ZINC000424309405 943854140 /nfs/dbraw/zinc/85/41/40/943854140.db2.gz AQIDPUSAEZQPJH-HXUWFJFHSA-N 0 0 356.422 3.983 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1OC(=O)Cc1ccccc1Br ZINC000760020502 943855694 /nfs/dbraw/zinc/85/56/94/943855694.db2.gz ZOLJELYBNIKDGI-UHFFFAOYSA-N 0 0 350.168 3.814 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2nc(-c3ccc(Oc4ccc(F)cc4)nc3)no2)[nH]1 ZINC000504872756 943861477 /nfs/dbraw/zinc/86/14/77/943861477.db2.gz JWWBHELTCRHESJ-UHFFFAOYSA-N 0 0 367.296 3.966 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)NC[C@@H]1CCC[C@H](C(F)(F)F)C1 ZINC000437496264 943861721 /nfs/dbraw/zinc/86/17/21/943861721.db2.gz KNMHUMCWSOLWAL-KGLIPLIRSA-N 0 0 373.375 3.805 20 5 FHBDRN Cc1ccccc1[C@H]1CCN(C(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)C1 ZINC000504875119 943864990 /nfs/dbraw/zinc/86/49/90/943864990.db2.gz GQDXRHPJBFZVQP-KRWDZBQOSA-N 0 0 363.417 3.874 20 5 FHBDRN C[C@@H]1CCCC[C@@H]1c1nc(-c2ccc(-n3cncn3)c([N+](=O)[O-])c2)no1 ZINC000424359869 943865632 /nfs/dbraw/zinc/86/56/32/943865632.db2.gz IMSXWTBBPTXXDP-YPMHNXCESA-N 0 0 354.370 3.519 20 5 FHBDRN CC(C)CO[C@@H]1CCN(Cc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000425421866 943868848 /nfs/dbraw/zinc/86/88/48/943868848.db2.gz MNLDIYHCSLRRIO-CQSZACIVSA-N 0 0 357.248 3.604 20 5 FHBDRN Cc1c(NC(=O)c2cc(Cl)c3c(c2)OCCCO3)cccc1[N+](=O)[O-] ZINC000014798624 943873347 /nfs/dbraw/zinc/87/33/47/943873347.db2.gz UGBFDNXDRTWQGB-UHFFFAOYSA-N 0 0 362.769 3.970 20 5 FHBDRN CCOc1ccc([C@@H](C)NCc2nnc(C(C)C)s2)cc1[N+](=O)[O-] ZINC000504899906 943878135 /nfs/dbraw/zinc/87/81/35/943878135.db2.gz OESUODBHAQCQHD-LLVKDONJSA-N 0 0 350.444 3.819 20 5 FHBDRN C[C@@H](c1noc(CCCNc2ccc([N+](=O)[O-])cc2)n1)c1nccs1 ZINC000424365155 943878970 /nfs/dbraw/zinc/87/89/70/943878970.db2.gz UWLOAKXNYCOJBG-NSHDSACASA-N 0 0 359.411 3.631 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]cc(Cc3noc(/C=C/c4cccc(O)c4)n3)c2c1 ZINC000435958653 943881258 /nfs/dbraw/zinc/88/12/58/943881258.db2.gz OSLDUEVLBVBQQO-QPJJXVBHSA-N 0 0 362.345 3.926 20 5 FHBDRN O=C(N[C@@H]1[C@H]2CCc3ccccc3[C@@H]12)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000435960928 943882989 /nfs/dbraw/zinc/88/29/89/943882989.db2.gz BNSPTNJANIVJTN-PWIZWCRZSA-N 0 0 363.417 3.627 20 5 FHBDRN COc1ccc([C@H]2CCN(C(=O)c3c[nH]c4cc([N+](=O)[O-])ccc34)C2)cc1 ZINC000504884439 943883095 /nfs/dbraw/zinc/88/30/95/943883095.db2.gz AKMBXOOAQOPGSQ-AWEZNQCLSA-N 0 0 365.389 3.714 20 5 FHBDRN Cc1ccc(CN(C(=O)COc2cc(F)ccc2[N+](=O)[O-])C2CC2)cc1 ZINC000053367124 943889357 /nfs/dbraw/zinc/88/93/57/943889357.db2.gz URALZTAFRWSHSF-UHFFFAOYSA-N 0 0 358.369 3.612 20 5 FHBDRN CSc1ccc(C(=O)NCCCOc2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000504894145 943892974 /nfs/dbraw/zinc/89/29/74/943892974.db2.gz GUNJEDPBDWYBKX-UHFFFAOYSA-N 0 0 360.435 3.824 20 5 FHBDRN CCc1ccc(CC)c(NCC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])c1 ZINC000435972178 943894992 /nfs/dbraw/zinc/89/49/92/943894992.db2.gz KVGHLLYNLIEOPR-UHFFFAOYSA-N 0 0 357.410 3.779 20 5 FHBDRN CC(=O)N(c1ccc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2)cc1)[C@H]1C[C@H]1C ZINC000516991582 943895704 /nfs/dbraw/zinc/89/57/04/943895704.db2.gz XRARVGXMQPFQFT-ZMZPIMSZSA-N 0 0 371.368 3.748 20 5 FHBDRN CCOc1ccc([C@@H](C)[NH2+]CCOc2ccc(OC)cc2)cc1[N+](=O)[O-] ZINC000504905124 943903315 /nfs/dbraw/zinc/90/33/15/943903315.db2.gz CPVQSTYGGQORKP-CQSZACIVSA-N 0 0 360.410 3.732 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1nc(SC)ns1 ZINC000505735966 943912025 /nfs/dbraw/zinc/91/20/25/943912025.db2.gz KIJZHNFLWWXOFQ-UHFFFAOYSA-N 0 0 370.481 3.923 20 5 FHBDRN CCn1ccnc1[C@H]1CCCCN1C(=O)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000435995574 943922367 /nfs/dbraw/zinc/92/23/67/943922367.db2.gz NPLZMHCCJHZFNH-MRXNPFEDSA-N 0 0 367.409 3.660 20 5 FHBDRN CC1(C)CN(C(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)CC(C)(C)O1 ZINC000504926312 943923853 /nfs/dbraw/zinc/92/38/53/943923853.db2.gz HWVGTIKMGKDBPL-UHFFFAOYSA-N 0 0 360.332 3.643 20 5 FHBDRN CC1=C[C@@H](C)CN(C(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)C1 ZINC000436003444 943935150 /nfs/dbraw/zinc/93/51/50/943935150.db2.gz LTDVILYVDKHQOB-OAHLLOKOSA-N 0 0 357.454 3.869 20 5 FHBDRN CNc1ccc(C(=O)NCCCCOc2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000515488649 943935845 /nfs/dbraw/zinc/93/58/45/943935845.db2.gz IGLZTOSKTSDHJS-UHFFFAOYSA-N 0 0 357.410 3.534 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2noc(-c3cn(-c4ccccc4Cl)nn3)n2)c1 ZINC000504975245 943946766 /nfs/dbraw/zinc/94/67/66/943946766.db2.gz PHRXEDUPVOHNDO-UHFFFAOYSA-N 0 0 368.740 3.546 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2noc(-c3cnc(-c4ccccn4)s3)n2)c1 ZINC000504980463 943949713 /nfs/dbraw/zinc/94/97/13/943949713.db2.gz KYWCAJJCMWSKGQ-UHFFFAOYSA-N 0 0 351.347 3.830 20 5 FHBDRN COc1ccc2nc(NC(=O)c3c[nH]c4cc([N+](=O)[O-])ccc43)sc2c1 ZINC000504980984 943950264 /nfs/dbraw/zinc/95/02/64/943950264.db2.gz ZZBORTLVTIISEC-UHFFFAOYSA-N 0 0 368.374 3.947 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1CN1CCC([C@@H]2CCCO2)CC1 ZINC000425444242 943955779 /nfs/dbraw/zinc/95/57/79/943955779.db2.gz MCOUKBTWZCHIIT-INIZCTEOSA-N 0 0 369.259 3.748 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2noc(/C=C/c3ccc4c(c3)OCCO4)n2)c1 ZINC000504985941 943956512 /nfs/dbraw/zinc/95/65/12/943956512.db2.gz JOMRLVQVLXRRAK-FNORWQNLSA-N 0 0 351.318 3.586 20 5 FHBDRN CCC(CC)[C@H](CCNC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1)OC ZINC000437603818 943960452 /nfs/dbraw/zinc/96/04/52/943960452.db2.gz IZRUTKHQYLBOSM-GUYCJALGSA-N 0 0 351.447 3.796 20 5 FHBDRN C[C@@H](C(=O)N1CCC[C@@]2(C1)OCc1ccccc12)c1cccc([N+](=O)[O-])c1 ZINC000517065135 943965943 /nfs/dbraw/zinc/96/59/43/943965943.db2.gz IZVYLVGSTMVTDE-VFNWGFHPSA-N 0 0 366.417 3.746 20 5 FHBDRN COc1cccc(C(=O)Nc2nc3c(ccc(F)c3F)s2)c1[N+](=O)[O-] ZINC000436044340 943967066 /nfs/dbraw/zinc/96/70/66/943967066.db2.gz BAEICRLMDIGAQI-UHFFFAOYSA-N 0 0 365.317 3.744 20 5 FHBDRN Cc1ccc([C@H]2CCN(C(=O)CCC(=O)c3cccc([N+](=O)[O-])c3)C2)cc1 ZINC000517071868 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Cc1cc(NC(=O)CCc2cccc(C)c2)n(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000105584987 944227715 /nfs/dbraw/zinc/22/77/15/944227715.db2.gz GCBCBNCOYYZRDO-UHFFFAOYSA-N 0 0 364.405 3.969 20 5 FHBDRN CCc1ccc(C(=O)Nc2cc(C)nn2-c2ccc([N+](=O)[O-])cc2)cc1 ZINC000105587575 944228062 /nfs/dbraw/zinc/22/80/62/944228062.db2.gz JTTGKNVNDHHLBB-UHFFFAOYSA-N 0 0 350.378 3.904 20 5 FHBDRN COc1ccc([C@@H]2CCN(C(=O)Nc3ccc([N+](=O)[O-])cc3OC)C2)cc1 ZINC000123162992 944231449 /nfs/dbraw/zinc/23/14/49/944231449.db2.gz CXYPLRFRNTYDFI-CQSZACIVSA-N 0 0 371.393 3.633 20 5 FHBDRN CCC[C@@]1(C(=O)OCC)CCCN1C(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000436350905 944233182 /nfs/dbraw/zinc/23/31/82/944233182.db2.gz AVFHEYGTUXZFIS-KRWDZBQOSA-N 0 0 368.817 3.586 20 5 FHBDRN O=C(Nc1cccc(Oc2cnccn2)c1)c1cc(F)cc([N+](=O)[O-])c1 ZINC000518285154 944234832 /nfs/dbraw/zinc/23/48/32/944234832.db2.gz KCBIJQUGMDXKDK-UHFFFAOYSA-N 0 0 354.297 3.569 20 5 FHBDRN CC1=CCCN(C(=O)c2cc([N+](=O)[O-])ccc2NCc2ccccc2)C1 ZINC000437962991 944241521 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COc1ccc(CNC(=O)N2CCC[C@H]2c2ccccc2C)cc1[N+](=O)[O-] ZINC000515829077 944264707 /nfs/dbraw/zinc/26/47/07/944264707.db2.gz NKTKDYFJCKWLFE-KRWDZBQOSA-N 0 0 369.421 3.959 20 5 FHBDRN CN(CCCC(=O)OC(C)(C)C)c1cc(C(F)(F)F)ncc1[N+](=O)[O-] ZINC000436406664 944266562 /nfs/dbraw/zinc/26/65/62/944266562.db2.gz JDGGCKJCSMPBRI-UHFFFAOYSA-N 0 0 363.336 3.567 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H]1C[C@H]1c1ccc(Cl)cc1 ZINC000436397130 944273386 /nfs/dbraw/zinc/27/33/86/944273386.db2.gz ZGPURSGBPUJZEG-DZGCQCFKSA-N 0 0 361.785 3.934 20 5 FHBDRN O=C([O-])c1ccc([N+](=O)[O-])c(NC[C@H](c2ccco2)[NH+]2CCCCC2)c1 ZINC000515851166 944274484 /nfs/dbraw/zinc/27/44/84/944274484.db2.gz MYILLBCCVXBTNO-MRXNPFEDSA-N 0 0 359.382 3.525 20 5 FHBDRN CC[S@](=O)[C@@H]1CCC[C@@H](Nc2cc(C(F)(F)F)ncc2[N+](=O)[O-])C1 ZINC000436401317 944277772 /nfs/dbraw/zinc/27/77/72/944277772.db2.gz ORLRGQQODMCDKE-MZEXLTETSA-N 0 0 365.377 3.500 20 5 FHBDRN O=C(NCc1ccc(F)c(F)c1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000438004406 944281651 /nfs/dbraw/zinc/28/16/51/944281651.db2.gz QSDRVQZSTNVQEC-UHFFFAOYSA-N 0 0 361.348 3.747 20 5 FHBDRN COC(=O)c1cc(CNCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)cs1 ZINC000894579107 944284448 /nfs/dbraw/zinc/28/44/48/944284448.db2.gz DUQZYSPWBIDYSJ-UHFFFAOYSA-N 0 0 374.340 3.752 20 5 FHBDRN CCn1c(C)nc([N+](=O)[O-])c1N1C[C@@H](c2ccccc2Cl)OC[C@H]1C ZINC000517424490 944286629 /nfs/dbraw/zinc/28/66/29/944286629.db2.gz HUKXLTPOBVKKLA-ABAIWWIYSA-N 0 0 364.833 3.739 20 5 FHBDRN O=C(N[C@@H]1C[C@H]1c1cccc(F)c1)C1(c2ccc([N+](=O)[O-])cc2)CCC1 ZINC001270439048 944296805 /nfs/dbraw/zinc/29/68/05/944296805.db2.gz IAQAREGITUHINW-ZWKOTPCHSA-N 0 0 354.381 3.828 20 5 FHBDRN Cc1nc[nH]c1CNC(=O)c1cc([N+](=O)[O-])ccc1SCC1CCCC1 ZINC000517439378 944297276 /nfs/dbraw/zinc/29/72/76/944297276.db2.gz WGDLVHGCLDJJLB-UHFFFAOYSA-N 0 0 374.466 3.839 20 5 FHBDRN CN(Cc1nc2c(s1)CCCC2)c1cc(C(F)(F)F)ncc1[N+](=O)[O-] ZINC000436409438 944297496 /nfs/dbraw/zinc/29/74/96/944297496.db2.gz YZSPXHJUUXJRNG-UHFFFAOYSA-N 0 0 372.372 3.980 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H](O)CC(C)(C)C ZINC000506474436 944299582 /nfs/dbraw/zinc/29/95/82/944299582.db2.gz MTGCOOYVYDPVNN-ZDUSSCGKSA-N 0 0 354.472 3.624 20 5 FHBDRN Cc1ccc(C[C@H]2CCCN(C(=O)c3cccc([N+](=O)[O-])c3N)C2)cc1 ZINC000517455936 944300928 /nfs/dbraw/zinc/30/09/28/944300928.db2.gz YPGVXMGEBSWLTR-MRXNPFEDSA-N 0 0 353.422 3.580 20 5 FHBDRN Cc1sc(C(=O)NCc2ccc3c(c2)nc(C2CC2)n3C)cc1[N+](=O)[O-] ZINC000550155996 944310067 /nfs/dbraw/zinc/31/00/67/944310067.db2.gz VLDHUZCKFPHBSX-UHFFFAOYSA-N 0 0 370.434 3.659 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC[C@@H](CO)Cc1cc(F)c(F)c(F)c1 ZINC000436427870 944310644 /nfs/dbraw/zinc/31/06/44/944310644.db2.gz CDQOHQQNORXPAO-LBPRGKRZSA-N 0 0 354.328 3.584 20 5 FHBDRN Cc1c(C(=O)N[C@H](c2ccc3c(c2)OCCO3)C(C)C)cccc1[N+](=O)[O-] ZINC000017368043 944320031 /nfs/dbraw/zinc/32/00/31/944320031.db2.gz IVSBRJZMJMSQTI-IBGZPJMESA-N 0 0 370.405 3.802 20 5 FHBDRN O=[N+]([O-])c1ccc(Cl)c(CNc2ccc(CN3CCOCC3)cc2)c1 ZINC000123269635 944322472 /nfs/dbraw/zinc/32/24/72/944322472.db2.gz RFUAGCSSGYHUOQ-UHFFFAOYSA-N 0 0 361.829 3.693 20 5 FHBDRN CSc1cc(C(=O)COc2ccc([N+](=O)[O-])c(C)c2)ccc1NC(C)=O ZINC000053541276 944331105 /nfs/dbraw/zinc/33/11/05/944331105.db2.gz ZVIUDUUKGAVKNO-UHFFFAOYSA-N 0 0 374.418 3.845 20 5 FHBDRN CN(C(=O)CN1CCC[C@H]1/C=C\c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000505825147 944332312 /nfs/dbraw/zinc/33/23/12/944332312.db2.gz KGFKFIKRCDUBNY-VJIACCKLSA-N 0 0 365.433 3.735 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(-c2nc(C3Cc4ccccc4C3)no2)c1 ZINC000515915213 944339902 /nfs/dbraw/zinc/33/99/02/944339902.db2.gz WBGXVOOXDKWMSF-UHFFFAOYSA-N 0 0 351.362 3.926 20 5 FHBDRN CCc1cc(NCc2ccc(OC)nc2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000053555215 944342979 /nfs/dbraw/zinc/34/29/79/944342979.db2.gz JIOWMZPQDVRMLO-UHFFFAOYSA-N 0 0 365.393 3.630 20 5 FHBDRN CNC(=O)c1ccc(NCCc2ccc(C(F)(F)F)cc2)c([N+](=O)[O-])c1 ZINC000053549543 944343597 /nfs/dbraw/zinc/34/35/97/944343597.db2.gz LCTRDGPOPGOWSD-UHFFFAOYSA-N 0 0 367.327 3.628 20 5 FHBDRN C/C=C\c1ccc(OC[C@H](O)COc2ccc(C)c([N+](=O)[O-])c2)c(OC)c1 ZINC000550175990 944345962 /nfs/dbraw/zinc/34/59/62/944345962.db2.gz XNBBOSQQINWIND-YIEVGGLXSA-N 0 0 373.405 3.764 20 5 FHBDRN CC[C@@H]1C[C@H]1NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 ZINC000438113623 944350904 /nfs/dbraw/zinc/35/09/04/944350904.db2.gz LHXLFOLOXWFJLV-PBFPGSCMSA-N 0 0 354.410 3.691 20 5 FHBDRN COc1cc(NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)ccc1O ZINC000438114912 944352151 /nfs/dbraw/zinc/35/21/51/944352151.db2.gz JMLXVUPZQIVVRT-UHFFFAOYSA-N 0 0 371.374 3.685 20 5 FHBDRN O=[N+]([O-])c1cncc(Br)c1N1CC[C@H](c2ccccc2F)C1 ZINC000518404534 944353742 /nfs/dbraw/zinc/35/37/42/944353742.db2.gz XPZMUTNTHUTBAU-JTQLQIEISA-N 0 0 366.190 3.885 20 5 FHBDRN Cc1nn([C@H](C)C(=O)NC(c2ccccc2)c2ccccc2)cc1[N+](=O)[O-] ZINC000436476318 944357902 /nfs/dbraw/zinc/35/79/02/944357902.db2.gz YLBQZOMLVCNEFV-OAHLLOKOSA-N 0 0 364.405 3.567 20 5 FHBDRN CC(C)c1nc(CS(=O)(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)cs1 ZINC000105714633 944359521 /nfs/dbraw/zinc/35/95/21/944359521.db2.gz RTJOJTWMMYYAFL-NSHDSACASA-N 0 0 354.453 3.851 20 5 FHBDRN Cc1c(C(=O)NCc2ccc(Br)c(F)c2)cccc1[N+](=O)[O-] ZINC000500261023 944362065 /nfs/dbraw/zinc/36/20/65/944362065.db2.gz IGFCEZJRPZASTL-UHFFFAOYSA-N 0 0 367.174 3.735 20 5 FHBDRN C[C@@H]1CN(C(=O)c2ccc(Cl)cc2[N+](=O)[O-])C[C@@H](c2ccccc2)O1 ZINC000140074420 944364597 /nfs/dbraw/zinc/36/45/97/944364597.db2.gz YJOPBTGRVWASQN-PXAZEXFGSA-N 0 0 360.797 3.850 20 5 FHBDRN Cc1ccc(-c2[nH]nc(NC(=O)Nc3ccc(C)c([N+](=O)[O-])c3)c2C)o1 ZINC000436483810 944367456 /nfs/dbraw/zinc/36/74/56/944367456.db2.gz AYIMGPDDGQJTOJ-UHFFFAOYSA-N 0 0 355.354 3.569 20 5 FHBDRN C[C@H](NC(=O)CSc1ccc([N+](=O)[O-])cc1)[C@@H]1Oc2ccccc2[C@H]1C ZINC000438158168 944371452 /nfs/dbraw/zinc/37/14/52/944371452.db2.gz WFHTWARFKUCOHA-QHRIQVFBSA-N 0 0 372.446 3.756 20 5 FHBDRN COc1ccc(CCCNC(=O)Nc2ccc([N+](=O)[O-])c(C)c2)cc1OC ZINC000473760221 944371644 /nfs/dbraw/zinc/37/16/44/944371644.db2.gz AWABBFSFEYKSTQ-UHFFFAOYSA-N 0 0 373.409 3.675 20 5 FHBDRN CCOc1ncccc1CNc1ccc(Br)cc1[N+](=O)[O-] ZINC000105818220 944377777 /nfs/dbraw/zinc/37/77/77/944377777.db2.gz YATDEIGLYKZFGD-UHFFFAOYSA-N 0 0 352.188 3.763 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)CCc1nnc(-c2ccccc2)o1 ZINC000086624301 944378710 /nfs/dbraw/zinc/37/87/10/944378710.db2.gz WLUSKJPSJQTWJT-UHFFFAOYSA-N 0 0 366.377 3.833 20 5 FHBDRN CCSc1nn(CN(C)Cc2ccccc2[N+](=O)[O-])c(=S)s1 ZINC000025479380 944381900 /nfs/dbraw/zinc/38/19/00/944381900.db2.gz JLPRBVKUKPEBRI-UHFFFAOYSA-N 0 0 356.498 3.784 20 5 FHBDRN COC(=O)c1ccc(CCC(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)cc1 ZINC000086625521 944384004 /nfs/dbraw/zinc/38/40/04/944384004.db2.gz STZDKDLCSYOGMZ-UHFFFAOYSA-N 0 0 356.378 3.570 20 5 FHBDRN CC(C)(C)[C@H](NCn1c2cc([N+](=O)[O-])ccc2oc1=O)c1ccccc1 ZINC000123578076 944384486 /nfs/dbraw/zinc/38/44/86/944384486.db2.gz YIRWXVCUNQQXJN-QGZVFWFLSA-N 0 0 355.394 3.837 20 5 FHBDRN COc1ccc(S(=O)(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)cc1Cl ZINC000473768848 944387602 /nfs/dbraw/zinc/38/76/02/944387602.db2.gz YYBLCBGFAMTRJG-UHFFFAOYSA-N 0 0 370.814 3.674 20 5 FHBDRN O=C(Nc1c2c(nn1-c1ccccc1)CCC2)c1cc(F)cc([N+](=O)[O-])c1 ZINC000517557338 944388652 /nfs/dbraw/zinc/38/86/52/944388652.db2.gz CCQLVWVQYMASLL-UHFFFAOYSA-N 0 0 366.352 3.661 20 5 FHBDRN CCCCOC1CCN(c2c(Br)cncc2[N+](=O)[O-])CC1 ZINC000500273471 944389939 /nfs/dbraw/zinc/38/99/39/944389939.db2.gz VOGAKCGHYDGHMC-UHFFFAOYSA-N 0 0 358.236 3.538 20 5 FHBDRN CCn1nc(C)c([N+](=O)[O-])c1N1CC[C@@](F)(c2cccc(Cl)c2)C1 ZINC000509527827 944397166 /nfs/dbraw/zinc/39/71/66/944397166.db2.gz UNIYCHIQGDRVBK-INIZCTEOSA-N 0 0 352.797 3.848 20 5 FHBDRN COCCc1ccc(OCCCC(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC000105942883 944398513 /nfs/dbraw/zinc/39/85/13/944398513.db2.gz JQDRXASPOJWPRG-UHFFFAOYSA-N 0 0 358.394 3.581 20 5 FHBDRN C/C=C/c1ccc(OS(=O)(=O)c2c(F)cccc2[N+](=O)[O-])c(OC)c1 ZINC000123658269 944399840 /nfs/dbraw/zinc/39/98/40/944399840.db2.gz BWRBUESSENZYHJ-HWKANZROSA-N 0 0 367.354 3.543 20 5 FHBDRN Cc1cc(OCC(=O)N(C)c2ccc(Cl)cc2F)ccc1[N+](=O)[O-] ZINC000439178962 944403273 /nfs/dbraw/zinc/40/32/73/944403273.db2.gz JUROLXKZQFORLD-UHFFFAOYSA-N 0 0 352.749 3.738 20 5 FHBDRN C[C@@H](C1CC1)N(C)C(=O)c1ccc(N2C[C@H](C)C[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000500278368 944403632 /nfs/dbraw/zinc/40/36/32/944403632.db2.gz HEMZWWXROYEVJF-KFWWJZLASA-N 0 0 359.470 3.948 20 5 FHBDRN CNc1ccc(-c2nc(Cc3cc(C)ccc3OC)no2)cc1[N+](=O)[O-] ZINC000545537342 944409406 /nfs/dbraw/zinc/40/94/06/944409406.db2.gz IMVWJEFFZLTWPB-UHFFFAOYSA-N 0 0 354.366 3.594 20 5 FHBDRN O=C(NC1(C(F)F)CC1)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000500286072 944410501 /nfs/dbraw/zinc/41/05/01/944410501.db2.gz SSCSTSWFPNNVJS-UHFFFAOYSA-N 0 0 362.332 3.701 20 5 FHBDRN CN(Cc1cccc([N+](=O)[O-])c1)[C@@H]1c2cc(Cl)cc(Cl)c2C[C@@H]1O ZINC000518474000 944413525 /nfs/dbraw/zinc/41/35/25/944413525.db2.gz QZVGDWRBCGVSRC-DLBZAZTESA-N 0 0 367.232 3.992 20 5 FHBDRN Cc1cc(NC(=O)N2CC[C@H](n3ncc4ccccc43)C2)ccc1[N+](=O)[O-] ZINC000473773816 944414716 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CC[C@H]1CCCCN1C(=O)[C@H](C)OC(=O)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000011025379 944455834 /nfs/dbraw/zinc/45/58/34/944455834.db2.gz BBQAYKFBLZVZJT-AAEUAGOBSA-N 0 0 368.817 3.585 20 5 FHBDRN O=C(c1cc(Cl)cc(Cl)c1[N+](=O)[O-])N1CC[C@H]([C@H]2CCCO2)C1 ZINC000894703816 944457844 /nfs/dbraw/zinc/45/78/44/944457844.db2.gz HGNKITZZPFVTSU-TVQRCGJNSA-N 0 0 359.209 3.543 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(NCc2ccnc(OCC(F)(F)F)c2)c1 ZINC000517638475 944459196 /nfs/dbraw/zinc/45/91/96/944459196.db2.gz XNPCYZCUHKMLHM-UHFFFAOYSA-N 0 0 357.288 3.552 20 5 FHBDRN CC(C)Oc1cc(C(=O)N[C@H]2CCc3ccccc3OC2)ccc1[N+](=O)[O-] ZINC001270324789 944460812 /nfs/dbraw/zinc/46/08/12/944460812.db2.gz MKUJNXNUWQQFQP-INIZCTEOSA-N 0 0 370.405 3.506 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)c1cc(-c2ccoc2)n[nH]1 ZINC000517650859 944465782 /nfs/dbraw/zinc/46/57/82/944465782.db2.gz SEQJURPRLLCRCO-UHFFFAOYSA-N 0 0 354.366 3.629 20 5 FHBDRN O=[N+]([O-])c1cc2c(nc1N1CC[C@]3(C1)OCc1ccccc13)CCCC2 ZINC000518523211 944469433 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354.391 3.698 20 5 FHBDRN O=C(CCn1cc([N+](=O)[O-])cn1)Nc1ccc2oc3ccccc3c2c1 ZINC000517664673 944488154 /nfs/dbraw/zinc/48/81/54/944488154.db2.gz CALAZNXYCZCEIS-UHFFFAOYSA-N 0 0 350.334 3.720 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](c1ccccc1)c1ccccn1 ZINC000072753214 944488437 /nfs/dbraw/zinc/48/84/37/944488437.db2.gz VDDCRACVGDFTLX-LJQANCHMSA-N 0 0 363.373 3.518 20 5 FHBDRN C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)N(C)CC3CCC3)cc2[N+](=O)[O-])C1 ZINC000517671567 944495269 /nfs/dbraw/zinc/49/52/69/944495269.db2.gz XGKTVSMHZLFRDV-GASCZTMLSA-N 0 0 359.470 3.949 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)NCCOCc1ccc(OC)cc1 ZINC000516121062 944504614 /nfs/dbraw/zinc/50/46/14/944504614.db2.gz YHDXJNRUAPHPFM-UHFFFAOYSA-N 0 0 373.409 3.504 20 5 FHBDRN Cc1ccc(-c2cnc(CCC(=O)N(C)c3ccc([N+](=O)[O-])nc3)o2)cc1 ZINC000439288841 944507560 /nfs/dbraw/zinc/50/75/60/944507560.db2.gz ZSMNMLKENJGMES-UHFFFAOYSA-N 0 0 366.377 3.549 20 5 FHBDRN O=C(NCCCOCC(F)(F)F)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000073564618 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364.390 3.578 20 5 FHBDRN CN(C[C@H]1OCCc2ccccc21)C(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000506259872 944710301 /nfs/dbraw/zinc/71/03/01/944710301.db2.gz OGENNQGURZYQCY-QGZVFWFLSA-N 0 0 360.797 3.634 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)N2CCOc3ccc(F)cc3C2)cc1[N+](=O)[O-] ZINC000426041282 944711197 /nfs/dbraw/zinc/71/11/97/944711197.db2.gz ZHTAAOOVBHADEC-CYBMUJFWSA-N 0 0 373.384 3.708 20 5 FHBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@@](C)(O)CC1 ZINC000473603301 944715139 /nfs/dbraw/zinc/71/51/39/944715139.db2.gz AGVWYRYHMJHELL-GOSISDBHSA-N 0 0 366.483 3.864 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])NC[C@H]1CCC[C@H](C(F)(F)F)C1 ZINC000438506192 944715857 /nfs/dbraw/zinc/71/58/57/944715857.db2.gz FQKAGGRAGXICIG-STQMWFEESA-N 0 0 374.359 3.849 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H](C)[C@@H]1Oc2ccccc2[C@H]1C ZINC000438507625 944716924 /nfs/dbraw/zinc/71/69/24/944716924.db2.gz UIPDUIBSXCOBKG-SEDUGSJDSA-N 0 0 371.393 3.678 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@]1(O)CCCC(C)(C)C1 ZINC000438508028 944718275 /nfs/dbraw/zinc/71/82/75/944718275.db2.gz XIXKTHXSDXDJMH-OXQOHEQNSA-N 0 0 362.470 3.611 20 5 FHBDRN O=C([O-])[C@H](Cc1c[nH]c2ccc([N+](=O)[O-])cc12)[NH2+]Cc1cccc(Cl)c1 ZINC000426718683 944720085 /nfs/dbraw/zinc/72/00/85/944720085.db2.gz BVIXXYDMIIHHDQ-KRWDZBQOSA-N 0 0 373.796 3.515 20 5 FHBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H](O)C(C)(C)C1 ZINC000438529108 944738031 /nfs/dbraw/zinc/73/80/31/944738031.db2.gz SHAXVJCKCNRWBK-MRXNPFEDSA-N 0 0 366.483 3.576 20 5 FHBDRN C[C@H]1Oc2cc(F)ccc2[C@H]1Nc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 ZINC000516337712 944738928 /nfs/dbraw/zinc/73/89/28/944738928.db2.gz YHLDUFLKDJJJQW-LZVRBXCZSA-N 0 0 357.341 3.553 20 5 FHBDRN C[C@@H]1[C@H](CC(F)(F)F)C[C@H](C)N1C(=O)CNc1ccccc1[N+](=O)[O-] ZINC000452667200 944741829 /nfs/dbraw/zinc/74/18/29/944741829.db2.gz UUFIOGUQGLUIQF-TUAOUCFPSA-N 0 0 359.348 3.585 20 5 FHBDRN COc1ccc([C@@H]2CCCN2C(=O)c2csc([N+](=O)[O-])c2)cc1OC ZINC000364456498 944753594 /nfs/dbraw/zinc/75/35/94/944753594.db2.gz CCEIKNSCVSOXMG-ZDUSSCGKSA-N 0 0 362.407 3.651 20 5 FHBDRN C[C@@H]1[C@@H](C)CN1C(=O)c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1 ZINC000509609154 944756834 /nfs/dbraw/zinc/75/68/34/944756834.db2.gz FQOADCWLYMIDHZ-DTWKUNHWSA-N 0 0 369.208 3.568 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(S(=O)(=O)Nc2cccc(C(F)F)c2)c1C ZINC000509599560 944763211 /nfs/dbraw/zinc/76/32/11/944763211.db2.gz GINDBDKOENOUQZ-UHFFFAOYSA-N 0 0 356.350 3.950 20 5 FHBDRN Cn1cnc([N+](=O)[O-])c1CNc1cccc(COc2ccc(F)cc2)c1 ZINC000506271380 944763756 /nfs/dbraw/zinc/76/37/56/944763756.db2.gz GPGVPGJDCGHFRL-UHFFFAOYSA-N 0 0 356.357 3.659 20 5 FHBDRN O=C(NCc1nc2cc(Cl)ccc2s1)c1ccc([N+](=O)[O-])cc1F ZINC000518786143 944766163 /nfs/dbraw/zinc/76/61/63/944766163.db2.gz IBPWGEMYEKTMPV-UHFFFAOYSA-N 0 0 365.773 3.927 20 5 FHBDRN Cn1ncc2ccc(-c3noc(C(C)(C)c4ccccc4[N+](=O)[O-])n3)cc21 ZINC000426428488 944772451 /nfs/dbraw/zinc/77/24/51/944772451.db2.gz SAWWNBRRWDVHBH-UHFFFAOYSA-N 0 0 363.377 3.857 20 5 FHBDRN C[C@@]1(C(=O)[O-])CCCC[C@H]1[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000426755215 944775336 /nfs/dbraw/zinc/77/53/36/944775336.db2.gz XPCCIEZBNFMJIE-IEBWSBKVSA-N 0 0 358.394 3.978 20 5 FHBDRN C[C@@](O)(CNC(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F)C1CCCCC1 ZINC000506278741 944775879 /nfs/dbraw/zinc/77/58/79/944775879.db2.gz GTSFIZOUXQMWRY-MRXNPFEDSA-N 0 0 374.359 3.675 20 5 FHBDRN COc1ccc([C@H](CCC(=O)[O-])[NH2+]Cc2ccc([N+](=O)[O-])cc2C)cc1 ZINC000426756745 944777940 /nfs/dbraw/zinc/77/79/40/944777940.db2.gz AECFKXKFVMUGTC-SFHVURJKSA-N 0 0 358.394 3.608 20 5 FHBDRN O=C(NCCOc1ccccc1)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000541586567 944787706 /nfs/dbraw/zinc/78/77/06/944787706.db2.gz BQOAFGZDTZCLPD-UHFFFAOYSA-N 0 0 369.299 3.814 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)NCCc2cc3ccccc3s2)c1 ZINC000506623974 944797344 /nfs/dbraw/zinc/79/73/44/944797344.db2.gz FPLHWBABYOJYJD-UHFFFAOYSA-N 0 0 356.403 3.791 20 5 FHBDRN CC[C@@H](CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1)c1ccccc1 ZINC000728801053 944799804 /nfs/dbraw/zinc/79/98/04/944799804.db2.gz QVNTVMVTXDUXJB-KRWDZBQOSA-N 0 0 367.449 3.827 20 5 FHBDRN CCN(C(=O)CCCNc1ccc([N+](=O)[O-])cc1)[C@@H]1CCOC(C)(C)C1 ZINC000426766542 944803628 /nfs/dbraw/zinc/80/36/28/944803628.db2.gz FKWHXIMPFOYBOD-QGZVFWFLSA-N 0 0 363.458 3.593 20 5 FHBDRN CN(c1ccccc1)c1ccc(C[NH2+][C@H](C(=O)[O-])C(C)(C)C)cc1[N+](=O)[O-] ZINC000426806848 944808095 /nfs/dbraw/zinc/80/80/95/944808095.db2.gz LJUSEHQFFMUTLX-GOSISDBHSA-N 0 0 371.437 3.952 20 5 FHBDRN CC(C)[C@@H](CC(F)(F)F)NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000438587571 944810600 /nfs/dbraw/zinc/81/06/00/944810600.db2.gz BVWVWACPACCZIZ-CYBMUJFWSA-N 0 0 373.375 3.902 20 5 FHBDRN O=C([O-])[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1c(Cl)oc2ccccc21 ZINC000426787149 944811126 /nfs/dbraw/zinc/81/11/26/944811126.db2.gz BHWLXCGXXALLBC-HNNXBMFYSA-N 0 0 374.780 3.780 20 5 FHBDRN O=C(c1cc(F)c(F)cc1[N+](=O)[O-])N1C[C@@H]2CCC[C@]2(C(F)(F)F)C1 ZINC000894385439 944814090 /nfs/dbraw/zinc/81/40/90/944814090.db2.gz QWSOFVBIMZTCPG-RTHLEPHNSA-N 0 0 364.270 3.678 20 5 FHBDRN Cc1nn(C(C)C)c(C)c1CC(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000500412677 944824187 /nfs/dbraw/zinc/82/41/87/944824187.db2.gz WVOZNNOPDVOPCJ-UHFFFAOYSA-N 0 0 364.833 3.501 20 5 FHBDRN O=C([O-])[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1ccc(Cl)cc1Cl ZINC000426803642 944825695 /nfs/dbraw/zinc/82/56/95/944825695.db2.gz OCQJZOWSMPPKHC-HNNXBMFYSA-N 0 0 369.204 3.687 20 5 FHBDRN Cc1cccc2c1OCC[C@H]2NC(=O)C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000505903415 944830886 /nfs/dbraw/zinc/83/08/86/944830886.db2.gz QTRLLAPUKJTBPF-MRXNPFEDSA-N 0 0 354.406 3.821 20 5 FHBDRN CC(C)c1cccc(O[C@H](C)C(=O)NCCOc2ccc([N+](=O)[O-])cc2)c1 ZINC000518846799 944838761 /nfs/dbraw/zinc/83/87/61/944838761.db2.gz PTTOHSSZZWMWLT-OAHLLOKOSA-N 0 0 372.421 3.681 20 5 FHBDRN Cc1ccc(-c2noc([C@H](C)c3ccc4c(c3)OCO4)n2)cc1[N+](=O)[O-] ZINC000426456699 944842324 /nfs/dbraw/zinc/84/23/24/944842324.db2.gz WIFOAYAWKJKDPB-LLVKDONJSA-N 0 0 353.334 3.834 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(C(=O)Oc2cc(Br)cc(F)c2F)n1 ZINC001270517436 944844430 /nfs/dbraw/zinc/84/44/30/944844430.db2.gz LUOADEFJVQSLPN-UHFFFAOYSA-N 0 0 373.109 3.558 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)Nc1cccc(SC)c1C ZINC000543308393 944846831 /nfs/dbraw/zinc/84/68/31/944846831.db2.gz RGJYFRAAXGCPJQ-UHFFFAOYSA-N 0 0 361.423 3.955 20 5 FHBDRN COc1ccc(CCC(=O)O[C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1OC ZINC000047176523 944851589 /nfs/dbraw/zinc/85/15/89/944851589.db2.gz NQGSNOHNOPXWDS-ZDUSSCGKSA-N 0 0 359.378 3.849 20 5 FHBDRN O=[N+]([O-])c1ccc(OCCNc2ncnc3sc4c(c32)CCC4)cc1 ZINC000518844814 944855886 /nfs/dbraw/zinc/85/58/86/944855886.db2.gz RBFIGIYNAQOWBJ-UHFFFAOYSA-N 0 0 356.407 3.579 20 5 FHBDRN CCN(C(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1C)[C@H](C)c1ccc(F)cc1 ZINC000516438849 944859759 /nfs/dbraw/zinc/85/97/59/944859759.db2.gz OPOBUQSRRMJSNB-CYBMUJFWSA-N 0 0 373.384 3.591 20 5 FHBDRN O=[N+]([O-])c1cccc([C@@H](O)CN2CCc3c2cccc3C(F)(F)F)c1 ZINC000759911032 944861525 /nfs/dbraw/zinc/86/15/25/944861525.db2.gz LZIVYFJUAQJIHE-INIZCTEOSA-N 0 0 352.312 3.710 20 5 FHBDRN NC(=O)c1ccc(N[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)c([N+](=O)[O-])c1 ZINC000507030375 944879096 /nfs/dbraw/zinc/87/90/96/944879096.db2.gz RXBQSCHLXQXUOQ-SMDDNHRTSA-N 0 0 365.311 3.681 20 5 FHBDRN CC[C@@H](CNc1ccc(C(=O)NC)cc1[N+](=O)[O-])Oc1ccccc1C ZINC000426890034 944908884 /nfs/dbraw/zinc/90/88/84/944908884.db2.gz PWDYSSYLVQWGJM-HNNXBMFYSA-N 0 0 357.410 3.532 20 5 FHBDRN COc1cc(C(=O)NCCc2ccccc2C(F)(F)F)ccc1[N+](=O)[O-] ZINC000511695490 944909108 /nfs/dbraw/zinc/90/91/08/944909108.db2.gz JCKUAYPSJBAXKY-UHFFFAOYSA-N 0 0 368.311 3.595 20 5 FHBDRN O=C(N[C@@H](c1cc2ccccc2o1)c1ccccc1)c1cc([N+](=O)[O-])n[nH]1 ZINC000505928198 944910463 /nfs/dbraw/zinc/91/04/63/944910463.db2.gz KMFUYBGRJIYULV-GOSISDBHSA-N 0 0 362.345 3.584 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1C[C@H](c2ccccc2C)C[C@@H]1C ZINC000426902107 944910859 /nfs/dbraw/zinc/91/08/59/944910859.db2.gz BBYCAMYPPGFSAX-LSDHHAIUSA-N 0 0 354.406 3.930 20 5 FHBDRN CN(Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)Cc1ccc(F)cc1F ZINC000506323287 944911088 /nfs/dbraw/zinc/91/10/88/944911088.db2.gz CHWCMGIPEBVYJX-UHFFFAOYSA-N 0 0 372.375 3.906 20 5 FHBDRN CCc1oc2ccccc2c1CN(C)C(=O)c1cc(F)cc([N+](=O)[O-])c1N ZINC000516465054 944914481 /nfs/dbraw/zinc/91/44/81/944914481.db2.gz LZSXUWXAYJFPTO-UHFFFAOYSA-N 0 0 371.368 3.897 20 5 FHBDRN CC(C)c1ccccc1OCCNC(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000518898827 944915851 /nfs/dbraw/zinc/91/58/51/944915851.db2.gz FUUQHNVNIMNKLR-UHFFFAOYSA-N 0 0 372.421 3.682 20 5 FHBDRN COC(=O)[C@@H]1CCCN1Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000506662798 944917334 /nfs/dbraw/zinc/91/73/34/944917334.db2.gz OKWRECSOXVELBX-INIZCTEOSA-N 0 0 374.368 3.664 20 5 FHBDRN O=C(COc1c(Cl)cccc1Cl)NCCc1ccc([N+](=O)[O-])cc1 ZINC000505934184 944924437 /nfs/dbraw/zinc/92/44/37/944924437.db2.gz VGWMCLRCXUEXCA-UHFFFAOYSA-N 0 0 369.204 3.639 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCCc1nc(C)oc1C ZINC000507089143 944928457 /nfs/dbraw/zinc/92/84/57/944928457.db2.gz PXGYXADUQAMZMD-UHFFFAOYSA-N 0 0 363.439 3.674 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)Nc1ccccc1-c1cn[nH]c1 ZINC000439734724 944930580 /nfs/dbraw/zinc/93/05/80/944930580.db2.gz QHEYTQAOQDUVCS-UHFFFAOYSA-N 0 0 361.361 3.578 20 5 FHBDRN COc1cc(C(=O)N[C@@H]2CC[C@@H](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000438692736 944931475 /nfs/dbraw/zinc/93/14/75/944931475.db2.gz LQFXSBIJERZFHN-DOTOQJQBSA-N 0 0 354.406 3.745 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N(Cc1ccccc1)[C@@H](CC)CO ZINC000518013985 944931845 /nfs/dbraw/zinc/93/18/45/944931845.db2.gz BXFCFOJYURURSV-KRWDZBQOSA-N 0 0 371.437 3.962 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](CC)C[C@H](C)CO ZINC000507095623 944932346 /nfs/dbraw/zinc/93/23/46/944932346.db2.gz VCZSADVTCJNNCD-QWHCGFSZSA-N 0 0 354.472 3.624 20 5 FHBDRN COc1cc(C(=O)Nc2ccc(C(F)(F)F)c(OC)c2)ccc1[N+](=O)[O-] ZINC000426919775 944940134 /nfs/dbraw/zinc/94/01/34/944940134.db2.gz YKNJKHURDZLKSU-UHFFFAOYSA-N 0 0 370.283 3.883 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCC(CC)(CC)CO ZINC000507086832 944943657 /nfs/dbraw/zinc/94/36/57/944943657.db2.gz OLKPOESUQBKXHR-UHFFFAOYSA-N 0 0 354.472 3.625 20 5 FHBDRN COCCN(Cc1ccc(F)cc1Cl)c1ccc([N+](=O)[O-])c(C)n1 ZINC000432048932 944950690 /nfs/dbraw/zinc/95/06/90/944950690.db2.gz SSYLVHGHDPBXGM-UHFFFAOYSA-N 0 0 353.781 3.744 20 5 FHBDRN CCCN(c1ccc(Cl)cc1)S(=O)(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000518950430 944962150 /nfs/dbraw/zinc/96/21/50/944962150.db2.gz QNTBSVWGKKSQDI-UHFFFAOYSA-N 0 0 372.805 3.993 20 5 FHBDRN COc1cc2c(c(OC)c1OC)CCN(c1cc(C)ccc1[N+](=O)[O-])CC2 ZINC000432057444 944965532 /nfs/dbraw/zinc/96/55/32/944965532.db2.gz MVPIOHBPESUMIO-UHFFFAOYSA-N 0 0 372.421 3.534 20 5 FHBDRN Cc1nc(N(CCCO)Cc2ccc(Cl)c(Cl)c2)ccc1[N+](=O)[O-] ZINC000432060414 944968692 /nfs/dbraw/zinc/96/86/92/944968692.db2.gz FKQLJHRBLYJMFX-UHFFFAOYSA-N 0 0 370.236 3.994 20 5 FHBDRN C[C@@H]1C[C@@H](c2ccccc2)[C@@H](C)N1C(=O)CNc1ccccc1[N+](=O)[O-] ZINC000426969578 944973284 /nfs/dbraw/zinc/97/32/84/944973284.db2.gz WKYOXIDGMPHKRE-BFYDXBDKSA-N 0 0 353.422 3.800 20 5 FHBDRN CC[C@@H](C)Oc1cccc(NS(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000511730970 944978628 /nfs/dbraw/zinc/97/86/28/944978628.db2.gz VPQYIFDAJSPGAF-CYBMUJFWSA-N 0 0 364.423 3.881 20 5 FHBDRN CN(Cc1cccc(Cl)c1Cl)C(=O)c1ccc(N)c([N+](=O)[O-])c1 ZINC000017917013 944991737 /nfs/dbraw/zinc/99/17/37/944991737.db2.gz ZWQQCLWIGLSOOR-UHFFFAOYSA-N 0 0 354.193 3.756 20 5 FHBDRN Cc1ccc(C(=O)Nc2ccnn2-c2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000437078873 944996961 /nfs/dbraw/zinc/99/69/61/944996961.db2.gz BMOJIPUNAQGRJP-UHFFFAOYSA-N 0 0 356.769 3.995 20 5 FHBDRN O=[N+]([O-])c1ccccc1CN(Cc1csc(-c2ncccn2)n1)C1CC1 ZINC000507165765 944997800 /nfs/dbraw/zinc/99/78/00/944997800.db2.gz AFIVWJJBWOAXKA-UHFFFAOYSA-N 0 0 367.434 3.673 20 5 FHBDRN CC[C@@H]1CC[C@H](C)N(S(=O)(=O)c2cc([N+](=O)[O-])cc(Cl)c2F)C1 ZINC001211848344 945002377 /nfs/dbraw/zinc/00/23/77/945002377.db2.gz BHJJFYHBRAGJLC-VHSXEESVSA-N 0 0 364.826 3.587 20 5 FHBDRN O=[N+]([O-])c1ccc(CN(Cc2cnn(CC(F)(F)F)c2)C2CC2)cc1 ZINC000507153895 945003074 /nfs/dbraw/zinc/00/30/74/945003074.db2.gz GBJFBLXBTIXDDZ-UHFFFAOYSA-N 0 0 354.332 3.518 20 5 FHBDRN CC(=O)N1C[C@@H]2CCC[C@H](Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)[C@H]2C1 ZINC000516558181 945008402 /nfs/dbraw/zinc/00/84/02/945008402.db2.gz ORWTYRDKKNKBCF-WHOFXGATSA-N 0 0 371.359 3.673 20 5 FHBDRN COc1cc(C(=O)N[C@@H](C2CCCCC2)C(F)(F)F)ccc1[N+](=O)[O-] ZINC000439834790 945013429 /nfs/dbraw/zinc/01/34/29/945013429.db2.gz JGDFWAAIGHUGRS-AWEZNQCLSA-N 0 0 360.332 3.844 20 5 FHBDRN O=[N+]([O-])c1cccc(OCCSc2ccc(Br)cn2)c1 ZINC000507172652 945021037 /nfs/dbraw/zinc/02/10/37/945021037.db2.gz GRNDRCZRMFDICT-UHFFFAOYSA-N 0 0 355.213 3.923 20 5 FHBDRN CC(C)(C)S(=O)(=O)Cc1ccc(NCc2csc([N+](=O)[O-])c2)cc1 ZINC000126623218 945022420 /nfs/dbraw/zinc/02/24/20/945022420.db2.gz HARPKDYVKDOLDR-UHFFFAOYSA-N 0 0 368.480 3.982 20 5 FHBDRN O=C(NCCc1ccccc1[N+](=O)[O-])N1CC[C@H](c2cccc(Cl)c2)C1 ZINC000432086092 945030507 /nfs/dbraw/zinc/03/05/07/945030507.db2.gz VQBHMYSSUJIUPJ-INIZCTEOSA-N 0 0 373.840 3.990 20 5 FHBDRN COC(=O)c1cc(Cl)ccc1NC(=O)Cc1cccc([N+](=O)[O-])c1C ZINC000439853370 945031184 /nfs/dbraw/zinc/03/11/84/945031184.db2.gz JIJVXJGTYXKMCF-UHFFFAOYSA-N 0 0 362.769 3.524 20 5 FHBDRN CC(=O)c1ccc(OCC(=O)c2c(C)[nH]c3ccccc32)c([N+](=O)[O-])c1 ZINC000120817208 945032191 /nfs/dbraw/zinc/03/21/91/945032191.db2.gz YXPCBCXJPMHKCD-UHFFFAOYSA-N 0 0 352.346 3.849 20 5 FHBDRN CSc1cccc(C(=O)N[C@H](C)c2ccc(Cl)cn2)c1[N+](=O)[O-] ZINC000507188383 945032892 /nfs/dbraw/zinc/03/28/92/945032892.db2.gz ONQSWBBABPSBPF-SECBINFHSA-N 0 0 351.815 3.856 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H](C)[C@@H]1COc2ccccc21 ZINC000439867736 945041556 /nfs/dbraw/zinc/04/15/56/945041556.db2.gz BYBAGAQHADXBMQ-DOMZBBRYSA-N 0 0 371.393 3.680 20 5 FHBDRN CCOc1ccccc1CNC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000437132166 945043813 /nfs/dbraw/zinc/04/38/13/945043813.db2.gz OJJMWUANQBDPKK-UHFFFAOYSA-N 0 0 368.311 3.942 20 5 FHBDRN CC[C@H](NS(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1)c1ccc(F)cc1F ZINC000519034312 945049169 /nfs/dbraw/zinc/04/91/69/945049169.db2.gz MSQHXASNOIRARR-HNNXBMFYSA-N 0 0 370.377 3.611 20 5 FHBDRN O=[N+]([O-])c1cc(F)c(CSc2nnc(Cc3ccccc3)[nH]2)c(F)c1 ZINC000506367138 945051416 /nfs/dbraw/zinc/05/14/16/945051416.db2.gz BOYCSNQLJCGCAO-UHFFFAOYSA-N 0 0 362.361 3.874 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N(CCOC)[C@H]1CC[C@H](C)C1 ZINC000439889816 945051287 /nfs/dbraw/zinc/05/12/87/945051287.db2.gz XFDKWJJVSNJNCS-KBPBESRZSA-N 0 0 365.430 3.662 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@H](C(F)(F)F)[C@@H]1C ZINC000439882253 945059541 /nfs/dbraw/zinc/05/95/41/945059541.db2.gz OSYRWTNPSZWCEC-ONGXEEELSA-N 0 0 361.320 3.798 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CCc2cc(C)ccc2C1 ZINC000439882753 945060897 /nfs/dbraw/zinc/06/08/97/945060897.db2.gz QRQBIHIKGWSDKL-UHFFFAOYSA-N 0 0 355.394 3.892 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)Nc1ccc(O)c(Cl)c1 ZINC000439883279 945061289 /nfs/dbraw/zinc/06/12/89/945061289.db2.gz STZLUWNEPPCWMX-UHFFFAOYSA-N 0 0 351.746 3.997 20 5 FHBDRN COc1ccc2c(c1)C1(CC1)CN(c1c3c(ccc1[N+](=O)[O-])NCC3)C2 ZINC000519042004 945062295 /nfs/dbraw/zinc/06/22/95/945062295.db2.gz RAQLNRJLLHLKIV-UHFFFAOYSA-N 0 0 351.406 3.623 20 5 FHBDRN Cc1ccccc1C1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])s2)CC1 ZINC000106722854 945384744 /nfs/dbraw/zinc/38/47/44/945384744.db2.gz QVODKZLCUAZLEV-UHFFFAOYSA-N 0 0 366.464 3.533 20 5 FHBDRN C[C@@H](OC(=O)c1cc2ccccc2o1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 ZINC000004332386 945387000 /nfs/dbraw/zinc/38/70/00/945387000.db2.gz AQHZZLJPXYCSKQ-SNVBAGLBSA-N 0 0 372.308 3.664 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)NCCOc1cccc(C(F)(F)F)c1 ZINC000511868786 945388594 /nfs/dbraw/zinc/38/85/94/945388594.db2.gz NDMSDSXSVKSCSE-UHFFFAOYSA-N 0 0 368.311 3.731 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccc2[nH]c(C3CCC3)nc2c1 ZINC000427468445 945396710 /nfs/dbraw/zinc/39/67/10/945396710.db2.gz COPCKUMDRRROSY-UHFFFAOYSA-N 0 0 366.377 4.000 20 5 FHBDRN CSc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@H]1c1ccccc1 ZINC001126569904 945399214 /nfs/dbraw/zinc/39/92/14/945399214.db2.gz YRLLVXMIXCFSKZ-MRXNPFEDSA-N 0 0 358.419 3.530 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N(Cc1cscn1)c1ccccc1 ZINC000427461971 945408124 /nfs/dbraw/zinc/40/81/24/945408124.db2.gz GLOAQJNNPWCTGV-UHFFFAOYSA-N 0 0 369.402 3.907 20 5 FHBDRN C[C@H]1CC[C@@](C[NH2+]Cc2cc([N+](=O)[O-])ccc2OC(F)F)(CC(=O)[O-])C1 ZINC000426632170 945409523 /nfs/dbraw/zinc/40/95/23/945409523.db2.gz SVWAEHMAWAWNAJ-GTNSWQLSSA-N 0 0 372.368 3.567 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)NCCCn1ccc2ccccc21 ZINC000087002262 945425396 /nfs/dbraw/zinc/42/53/96/945425396.db2.gz PQCLKFNUWBDLRL-UHFFFAOYSA-N 0 0 351.406 3.689 20 5 FHBDRN CC(=O)c1csc(C(=O)Nc2cc(-c3cccc([N+](=O)[O-])c3)[nH]n2)c1 ZINC000106913201 945443434 /nfs/dbraw/zinc/44/34/34/945443434.db2.gz MEDWBOWYXULDEZ-UHFFFAOYSA-N 0 0 356.363 3.501 20 5 FHBDRN COc1ccc(OC(C)C)c(NC(=O)NCCc2ccc([N+](=O)[O-])cc2)c1 ZINC000106946861 945448843 /nfs/dbraw/zinc/44/88/43/945448843.db2.gz PFEXPGYKOWXINP-UHFFFAOYSA-N 0 0 373.409 3.755 20 5 FHBDRN CCN(Cc1ccc2ccccc2c1)C(=O)c1nn(CC)cc1[N+](=O)[O-] ZINC000427520271 945463481 /nfs/dbraw/zinc/46/34/81/945463481.db2.gz YLAYPMQRGMKLSC-UHFFFAOYSA-N 0 0 352.394 3.627 20 5 FHBDRN C[C@H](NC(=O)c1ccccc1[N+](=O)[O-])c1ccc(F)c(Br)c1 ZINC000507701544 945465027 /nfs/dbraw/zinc/46/50/27/945465027.db2.gz GMZRCDIYTJYZHS-VIFPVBQESA-N 0 0 367.174 3.987 20 5 FHBDRN COc1cc(OCC(=O)N(CC2CCC2)c2ccccc2)ccc1[N+](=O)[O-] ZINC000438038074 945482409 /nfs/dbraw/zinc/48/24/09/945482409.db2.gz UFDLPZVLUJRGPD-UHFFFAOYSA-N 0 0 370.405 3.816 20 5 FHBDRN CC(C)(C)c1ccccc1OCCNC(=O)NCc1ccccc1[N+](=O)[O-] ZINC000519491801 945483679 /nfs/dbraw/zinc/48/36/79/945483679.db2.gz MMHRVFJIAXZPSE-UHFFFAOYSA-N 0 0 371.437 3.771 20 5 FHBDRN C[C@@H](c1ccccc1F)[S@@](=O)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000507714426 945488389 /nfs/dbraw/zinc/48/83/89/945488389.db2.gz PLCXHCKKCBDFJB-VDBVYFBLSA-N 0 0 364.398 3.572 20 5 FHBDRN O=C1CCc2cc([N+](=O)[O-])c(Sc3ccc4c(c3)OCCCO4)cc2N1 ZINC000506841214 945489975 /nfs/dbraw/zinc/48/99/75/945489975.db2.gz QSGMRVZDHGBGTH-UHFFFAOYSA-N 0 0 372.402 3.792 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CNc1ccccc1N1CCCCC1 ZINC000015337072 945490246 /nfs/dbraw/zinc/49/02/46/945490246.db2.gz UXNKLRMIKIXAPH-UHFFFAOYSA-N 0 0 368.437 3.944 20 5 FHBDRN CCOCCC1(CNC(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)CCC1 ZINC000151278270 945492039 /nfs/dbraw/zinc/49/20/39/945492039.db2.gz LULVXFZWCBZZCC-OAHLLOKOSA-N 0 0 363.458 3.860 20 5 FHBDRN O=[N+]([O-])c1cnc2cc(Br)ccc2c1N1C[C@H]2[C@@H](C1)C2(F)F ZINC000894407175 945495510 /nfs/dbraw/zinc/49/55/10/945495510.db2.gz REIHMHCPAXVJLF-AOOOYVTPSA-N 0 0 370.153 3.607 20 5 FHBDRN COc1cc(CN(C)Cc2nc3ccccc3s2)c([N+](=O)[O-])cc1OC ZINC000120791944 945495621 /nfs/dbraw/zinc/49/56/21/945495621.db2.gz WFHRJOATCFMEKO-UHFFFAOYSA-N 0 0 373.434 3.854 20 5 FHBDRN Cc1cc(C(=O)Nc2nc(Cc3ccccc3)ns2)ccc1[N+](=O)[O-] ZINC000107200050 945516594 /nfs/dbraw/zinc/51/65/94/945516594.db2.gz QFKRNQCOCJBRNS-UHFFFAOYSA-N 0 0 354.391 3.598 20 5 FHBDRN COc1ccccc1[C@@H](NC(=O)Cc1cccc([N+](=O)[O-])c1)c1ccco1 ZINC000129394329 945520369 /nfs/dbraw/zinc/52/03/69/945520369.db2.gz RTZNTRZLZGJLHX-HXUWFJFHSA-N 0 0 366.373 3.645 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1OC(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000760022250 945547208 /nfs/dbraw/zinc/54/72/08/945547208.db2.gz KCJNQJDEIUSMPS-LLVKDONJSA-N 0 0 362.363 3.898 20 5 FHBDRN O=C(CCc1c(Cl)cccc1[N+](=O)[O-])N1CCC(=O)Nc2ccccc21 ZINC001126004894 945554211 /nfs/dbraw/zinc/55/42/11/945554211.db2.gz QGAJYLBPKKFACB-UHFFFAOYSA-N 0 0 373.796 3.556 20 5 FHBDRN C[C@@H]1CC[C@H](O)[C@@H]([C@H]2CCCN2C(=O)c2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000281179999 945556373 /nfs/dbraw/zinc/55/63/73/945556373.db2.gz AAQUUNAPXSMBFA-MDRZDLKXSA-N 0 0 366.845 3.650 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CCCC[C@H]1c1ccnn1C ZINC000281220379 945558602 /nfs/dbraw/zinc/55/86/02/945558602.db2.gz BKVNWCGSUSUAKN-INIZCTEOSA-N 0 0 357.414 3.704 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)c1cccc([C@@H]2CCOC2)c1 ZINC000281235991 945571388 /nfs/dbraw/zinc/57/13/88/945571388.db2.gz FHKYGPDFZRHUQJ-OAHLLOKOSA-N 0 0 356.378 3.750 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)N2CCc3c(F)cccc3C2)cc1[N+](=O)[O-] ZINC000125092468 945574630 /nfs/dbraw/zinc/57/46/30/945574630.db2.gz BMNMVRQSMTVHJE-CYBMUJFWSA-N 0 0 357.385 3.871 20 5 FHBDRN Cc1c(NC(=O)N2CCC[C@@H]2[C@@H]2C[C@H](C)CC[C@H]2O)cccc1[N+](=O)[O-] ZINC000281312301 945586473 /nfs/dbraw/zinc/58/64/73/945586473.db2.gz IPETZFHWDRXNMB-KBEZCGTCSA-N 0 0 361.442 3.697 20 5 FHBDRN CCn1ccnc1[C@@H]1CCCCN1C(=O)N[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000281320181 945598541 /nfs/dbraw/zinc/59/85/41/945598541.db2.gz YBNVCTWARAJVBG-PBHICJAKSA-N 0 0 371.441 3.809 20 5 FHBDRN CN(C)c1ccc([N+](=O)[O-])cc1C(=O)O[C@H]1COc2cc(Cl)ccc21 ZINC001271264038 945605868 /nfs/dbraw/zinc/60/58/68/945605868.db2.gz DEBFZLYAJLUQAV-INIZCTEOSA-N 0 0 362.769 3.605 20 5 FHBDRN O=C(CCc1cc(F)ccc1[N+](=O)[O-])O[C@@H]1COc2cc(Cl)ccc21 ZINC001271265568 945614086 /nfs/dbraw/zinc/61/40/86/945614086.db2.gz JDNBFRCNDMUODC-MRXNPFEDSA-N 0 0 365.744 3.997 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC[C@@H]1[C@@H]1C[C@H](C)CC[C@H]1O ZINC000281365173 945614960 /nfs/dbraw/zinc/61/49/60/945614960.db2.gz MHEKMJDOAWKPGY-UOAMXJAYSA-N 0 0 361.442 3.697 20 5 FHBDRN COc1cc(N2CCC[C@H]2c2nc3c(n2C)CCCC3)ccc1[N+](=O)[O-] ZINC000281392457 945621129 /nfs/dbraw/zinc/62/11/29/945621129.db2.gz GKBURKBGUVYVDL-KRWDZBQOSA-N 0 0 356.426 3.557 20 5 FHBDRN CCOc1ccc(OC)cc1NC(=O)c1cc([N+](=O)[O-])ccc1SC ZINC001126021725 945632129 /nfs/dbraw/zinc/63/21/29/945632129.db2.gz PDDBMGVRQPYRNL-UHFFFAOYSA-N 0 0 362.407 3.976 20 5 FHBDRN COc1cc(CN2C[C@@H](c3ccccc3)O[C@@H](C)C2)c([N+](=O)[O-])cc1F ZINC000248618033 945633837 /nfs/dbraw/zinc/63/38/37/945633837.db2.gz BCZGXAYNIQRBNB-DJJJIMSYSA-N 0 0 360.385 3.705 20 5 FHBDRN Cc1cn2cc(NC(=O)c3cc([N+](=O)[O-])ccc3C(F)(F)F)ccc2n1 ZINC000550052656 945643320 /nfs/dbraw/zinc/64/33/20/945643320.db2.gz KECBFEDPLBNHEB-UHFFFAOYSA-N 0 0 364.283 3.822 20 5 FHBDRN CSCc1nc2ccccc2n1CC(=O)Oc1cc([N+](=O)[O-])ccc1C ZINC000125150103 945652058 /nfs/dbraw/zinc/65/20/58/945652058.db2.gz BEMMUFUUUDMQFU-UHFFFAOYSA-N 0 0 371.418 3.722 20 5 FHBDRN CC(C)(C(=O)NCc1ccc([N+](=O)[O-])cc1)c1ccc(Cl)cc1F ZINC000473642001 945664895 /nfs/dbraw/zinc/66/48/95/945664895.db2.gz LGTAUSHUZHNQDD-UHFFFAOYSA-N 0 0 350.777 3.981 20 5 FHBDRN O=C(Nc1cc2c(cn1)CCC2)c1sc(Br)cc1[N+](=O)[O-] ZINC000519695833 945668805 /nfs/dbraw/zinc/66/88/05/945668805.db2.gz GSVIBPVOJPXHLE-UHFFFAOYSA-N 0 0 368.212 3.555 20 5 FHBDRN Cc1cccc2c1CCN(CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C2 ZINC000729479722 945671416 /nfs/dbraw/zinc/67/14/16/945671416.db2.gz DDORSOIKCKBJEY-UHFFFAOYSA-N 0 0 359.813 3.553 20 5 FHBDRN O=C(Nc1ccnn1Cc1ccc(F)cc1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000129410839 945693978 /nfs/dbraw/zinc/69/39/78/945693978.db2.gz VCUMVGFOVVITPN-UHFFFAOYSA-N 0 0 374.759 3.884 20 5 FHBDRN C[C@H](NC(=O)c1ccc([N+](=O)[O-])c2cccnc12)c1nc2ccccc2[nH]1 ZINC000121217565 945699972 /nfs/dbraw/zinc/69/99/72/945699972.db2.gz NNALHNFADHUBDN-NSHDSACASA-N 0 0 361.361 3.510 20 5 FHBDRN C[C@@H](C(=O)N1CCO[C@@H](c2cccc(Cl)c2)C1)c1cccc([N+](=O)[O-])c1 ZINC000519737880 945703751 /nfs/dbraw/zinc/70/37/51/945703751.db2.gz PABCTQOPLHZENE-FZKQIMNGSA-N 0 0 374.824 3.952 20 5 FHBDRN CC(C)(NC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1)c1nccs1 ZINC000444019670 945716861 /nfs/dbraw/zinc/71/68/61/945716861.db2.gz IPQXDSMDESQSBF-UHFFFAOYSA-N 0 0 363.442 3.803 20 5 FHBDRN CC1(C)C[C@H]1CNC(=O)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12 ZINC000444009571 945719888 /nfs/dbraw/zinc/71/98/88/945719888.db2.gz MMBIESKYAIUQPK-JTQLQIEISA-N 0 0 356.372 3.735 20 5 FHBDRN CCOc1ccc(C(=O)Nc2ccc(SC)cc2OC)cc1[N+](=O)[O-] ZINC000487454943 945723932 /nfs/dbraw/zinc/72/39/32/945723932.db2.gz MZUSKFRLTBLNFZ-UHFFFAOYSA-N 0 0 362.407 3.976 20 5 FHBDRN Cc1cc(C(=O)Nc2cc(-c3cccc(F)c3F)[nH]n2)ccc1[N+](=O)[O-] ZINC000473650928 945727113 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FHBDRN COc1ccc(Cc2nc(-c3ccc4cnccc4c3)no2)c([N+](=O)[O-])c1 ZINC001211851743 945776600 /nfs/dbraw/zinc/77/66/00/945776600.db2.gz JGSCPRRTYODKBY-UHFFFAOYSA-N 0 0 362.345 3.792 20 5 FHBDRN O=C(NCCNc1ccccc1[N+](=O)[O-])c1csc(-c2ccccc2)n1 ZINC000015824266 945783584 /nfs/dbraw/zinc/78/35/84/945783584.db2.gz QVZHKYMXDVTBTQ-UHFFFAOYSA-N 0 0 368.418 3.560 20 5 FHBDRN CCOc1ccc(C(=O)Nc2ccccc2-c2noc(C)n2)cc1[N+](=O)[O-] ZINC000107817090 945792663 /nfs/dbraw/zinc/79/26/63/945792663.db2.gz KJEHQAKJURSPAS-UHFFFAOYSA-N 0 0 368.349 3.604 20 5 FHBDRN O=C(NCCOc1ccc([N+](=O)[O-])cc1)c1c(Cl)cc(F)cc1Cl ZINC000579071110 945799669 /nfs/dbraw/zinc/79/96/69/945799669.db2.gz GZZGVQQBHQSJSQ-UHFFFAOYSA-N 0 0 373.167 3.850 20 5 FHBDRN CC(C)(CNC(=O)NCCc1ccc([N+](=O)[O-])cc1)c1cccc(F)c1 ZINC000522799638 945837671 /nfs/dbraw/zinc/83/76/71/945837671.db2.gz GCYNBNXVMUOXKX-UHFFFAOYSA-N 0 0 359.401 3.553 20 5 FHBDRN O=C(O[C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)[C@@H]1C[C@@H]1c1ccc(F)cc1 ZINC000759926140 945846825 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O=[N+]([O-])c1cccc2c1CCN2Cn1nc(C2CC2)n(C2CC2)c1=S ZINC000178917906 945929308 /nfs/dbraw/zinc/92/93/08/945929308.db2.gz MAWDVHMYISDPQU-UHFFFAOYSA-N 0 0 357.439 3.555 20 5 FHBDRN CC(=O)Nc1ccc(C)c(NCc2nc(-c3cccc([N+](=O)[O-])c3)no2)c1 ZINC000108348360 945936723 /nfs/dbraw/zinc/93/67/23/945936723.db2.gz KFLLKALCDIIGQW-UHFFFAOYSA-N 0 0 367.365 3.524 20 5 FHBDRN C[C@H](OC(=O)CCCNC(=O)c1ccc(F)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000066876548 945942277 /nfs/dbraw/zinc/94/22/77/945942277.db2.gz XOMGUFSSMOCINB-ZDUSSCGKSA-N 0 0 374.368 3.548 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N[C@H]1CCCC12CCOCC2 ZINC000281931142 945947440 /nfs/dbraw/zinc/94/74/40/945947440.db2.gz HLGGPTYWEWTSLI-AWEZNQCLSA-N 0 0 352.818 3.636 20 5 FHBDRN C[C@@H]1CC[C@H](O)[C@@H]([C@@H]2CCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000281931365 945947514 /nfs/dbraw/zinc/94/75/14/945947514.db2.gz HJNNIDOKAQLREJ-VZEFYGNVSA-N 0 0 372.421 3.743 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N1CCC(Nc2cccc(C)c2)CC1 ZINC000151757959 945957017 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20 5 FHBDRN O=C(CCOc1ccc(Cl)cc1)N1CCCc2ccc([N+](=O)[O-])cc21 ZINC000522873036 946038836 /nfs/dbraw/zinc/03/88/36/946038836.db2.gz CHIOFKJAIBPWGN-UHFFFAOYSA-N 0 0 360.797 3.997 20 5 FHBDRN CC(C)CN(C(=O)CCn1cc([N+](=O)[O-])cn1)c1ccc(Cl)cc1 ZINC000475057889 946047560 /nfs/dbraw/zinc/04/75/60/946047560.db2.gz KIDFGCGOYQZIEP-UHFFFAOYSA-N 0 0 350.806 3.524 20 5 FHBDRN Cc1cc(OCC(=O)Nc2ccc(Br)cc2)ccc1[N+](=O)[O-] ZINC000001284546 946055628 /nfs/dbraw/zinc/05/56/28/946055628.db2.gz ABNXFVYFZDDCED-UHFFFAOYSA-N 0 0 365.183 3.683 20 5 FHBDRN CO[C@H](c1ccc(Cl)cc1)[C@@H](C)NC(=O)c1cc(F)cc([N+](=O)[O-])c1 ZINC000522887721 946057033 /nfs/dbraw/zinc/05/70/33/946057033.db2.gz HZRCXBMQRWPZTE-HWPZZCPQSA-N 0 0 366.776 3.893 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1N1CCC[C@@H]1[C@@H]1CCCC[C@@H]1O ZINC000408171142 946062808 /nfs/dbraw/zinc/06/28/08/946062808.db2.gz HLGAWELUSHTVBX-ZENOOKHLSA-N 0 0 369.259 3.877 20 5 FHBDRN CC[C@H]1CN(CC(=O)Nc2c(C)cccc2[N+](=O)[O-])c2ccccc2O1 ZINC000444212392 946072101 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O=C(c1ccc2[nH]c3ccccc3c(=O)c2c1)N1CCc2ccc(O)cc2C1 ZINC000444241903 946118298 /nfs/dbraw/zinc/11/82/98/946118298.db2.gz SJOJYUQPFYYUFY-UHFFFAOYSA-N 0 0 370.408 3.585 20 5 FHBDRN COc1cccc(CO[C@@H](C)C(=O)O[C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000066877996 946119571 /nfs/dbraw/zinc/11/95/71/946119571.db2.gz MWNXEOWFNUZOLQ-KBPBESRZSA-N 0 0 359.378 3.813 20 5 FHBDRN CC(=O)N[C@@H](CC(=O)O[C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccc(C)cc1 ZINC000066877454 946130875 /nfs/dbraw/zinc/13/08/75/946130875.db2.gz PZUMEPXATCVSIU-LIRRHRJNSA-N 0 0 370.405 3.775 20 5 FHBDRN CN(c1ccccc1)C1CCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000428346082 946132630 /nfs/dbraw/zinc/13/26/30/946132630.db2.gz KHUYAXVESBRXAY-UHFFFAOYSA-N 0 0 351.410 3.576 20 5 FHBDRN CSc1cccc(C(=O)N[C@H](c2ccccc2)[C@H]2CCCO2)c1[N+](=O)[O-] ZINC000186445632 946136725 /nfs/dbraw/zinc/13/67/25/946136725.db2.gz IXCNOXHFOGGSRB-NVXWUHKLSA-N 0 0 372.446 3.967 20 5 FHBDRN C[C@H](Cc1ccc(Cl)cc1)N(C)C(=O)COc1cccc([N+](=O)[O-])c1 ZINC000522945066 946144504 /nfs/dbraw/zinc/14/45/04/946144504.db2.gz KRJLUNJQZMQBPP-CYBMUJFWSA-N 0 0 362.813 3.717 20 5 FHBDRN O=[N+]([O-])c1ccc(N[C@@H]2CCC[C@@H]3OCC[C@@H]32)nc1OCc1ccccc1 ZINC000302158416 946150538 /nfs/dbraw/zinc/15/05/38/946150538.db2.gz GAYOKIDNHKJTDU-NUJGCVRESA-N 0 0 369.421 3.938 20 5 FHBDRN COc1ccc(N(C)C(=O)c2ccc(Cl)cc2[N+](=O)[O-])cc1OC ZINC000109136334 946163565 /nfs/dbraw/zinc/16/35/65/946163565.db2.gz GKFCMXPMFNXEGL-UHFFFAOYSA-N 0 0 350.758 3.542 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N(CC(C)C)c1ccc(Cl)cc1 ZINC000475064744 946164980 /nfs/dbraw/zinc/16/49/80/946164980.db2.gz MGJQURXFVPLXIA-UHFFFAOYSA-N 0 0 364.833 3.832 20 5 FHBDRN CCc1nc([C@H](C)NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)cs1 ZINC000181784634 946167797 /nfs/dbraw/zinc/16/77/97/946167797.db2.gz DVZFIGPCWDIIBH-QMMMGPOBSA-N 0 0 371.365 3.706 20 5 FHBDRN CCC1(CC)[C@H](NC(=O)c2cc(SC)ccc2[N+](=O)[O-])C[C@H]1OC ZINC000151877950 946188216 /nfs/dbraw/zinc/18/82/16/946188216.db2.gz OWXONQBKHWEDGZ-HUUCEWRRSA-N 0 0 352.456 3.640 20 5 FHBDRN C[C@H](C(=O)Nc1ccccc1-c1cn[nH]c1)c1ccc([N+](=O)[O-])cc1F ZINC000439758852 946208756 /nfs/dbraw/zinc/20/87/56/946208756.db2.gz SQOBUXFUGUMDSU-NSHDSACASA-N 0 0 354.341 3.866 20 5 FHBDRN O=C(O[C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)c1coc2ccccc12 ZINC000759926734 946209393 /nfs/dbraw/zinc/20/93/93/946209393.db2.gz BSKXABRFLYLBCB-GOEBONIOSA-N 0 0 355.350 3.878 20 5 FHBDRN C[C@H](CNC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1)c1nccs1 ZINC000444312981 946210052 /nfs/dbraw/zinc/21/00/52/946210052.db2.gz MTKIHQVKULZZJJ-GFCCVEGCSA-N 0 0 363.442 3.671 20 5 FHBDRN CS(=O)(=O)c1ccc(N[C@@H]2CC[C@H](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000302486605 946234113 /nfs/dbraw/zinc/23/41/13/946234113.db2.gz IKENGNMNIRVDOG-HZPDHXFCSA-N 0 0 374.462 3.822 20 5 FHBDRN CNC(=O)c1cc([N+](=O)[O-])ccc1N[C@H](c1ccccc1)c1ccccn1 ZINC000109317310 946235092 /nfs/dbraw/zinc/23/50/92/946235092.db2.gz SFLJBQGGMXARBH-LJQANCHMSA-N 0 0 362.389 3.551 20 5 FHBDRN Cc1cccc(N2CCC(C(=O)Nc3ccc(F)cc3)CC2)c1[N+](=O)[O-] ZINC000302511780 946239172 /nfs/dbraw/zinc/23/91/72/946239172.db2.gz SSAWAZIKQIEBNO-UHFFFAOYSA-N 0 0 357.385 3.897 20 5 FHBDRN COc1c(C(=O)Nc2ccc(-n3ccnc3)c(Cl)c2)cccc1[N+](=O)[O-] ZINC000475459845 946246568 /nfs/dbraw/zinc/24/65/68/946246568.db2.gz CITNVVZGUFMJAM-UHFFFAOYSA-N 0 0 372.768 3.695 20 5 FHBDRN C[C@@H]1C[C@@H](c2cccnc2)N(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000186016944 946286723 /nfs/dbraw/zinc/28/67/23/946286723.db2.gz OXGHNNCXKDVGHC-PXAZEXFGSA-N 0 0 374.828 3.936 20 5 FHBDRN COC(=O)c1cc(C(=O)Nc2csc3ccccc23)cc([N+](=O)[O-])c1 ZINC000487483517 946287022 /nfs/dbraw/zinc/28/70/22/946287022.db2.gz IJCHGQVFEQBWCO-UHFFFAOYSA-N 0 0 356.359 3.848 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2noc(/C=C/c3ccc4c(c3)OCCO4)n2)cc1 ZINC000546259786 946289685 /nfs/dbraw/zinc/28/96/85/946289685.db2.gz LGYXILSCQVEHDC-KRXBUXKQSA-N 0 0 351.318 3.586 20 5 FHBDRN COc1cc(C(=O)N[C@H](C)c2cccc(N3CCCC3)c2)ccc1[N+](=O)[O-] ZINC000088238272 946295285 /nfs/dbraw/zinc/29/52/85/946295285.db2.gz FGRAFDDVGTZNTR-CQSZACIVSA-N 0 0 369.421 3.695 20 5 FHBDRN Cc1ccc(-c2ocnc2C(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)cc1 ZINC000088231353 946295669 /nfs/dbraw/zinc/29/56/69/946295669.db2.gz WKDKSGDCQCTLOW-UHFFFAOYSA-N 0 0 363.373 3.757 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2nc(-c3nc(-c4ccccn4)no3)cs2)cc1 ZINC000109500932 946309296 /nfs/dbraw/zinc/30/92/96/946309296.db2.gz UDXWVAQHURWUSJ-UHFFFAOYSA-N 0 0 351.347 3.830 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2noc(-c3cccc(Oc4cnccn4)c3)n2)cc1 ZINC000546260710 946311334 /nfs/dbraw/zinc/31/13/34/946311334.db2.gz ZMMWNYBURLJGLX-UHFFFAOYSA-N 0 0 361.317 3.894 20 5 FHBDRN COc1cc(C(=O)N[C@@H](C)c2cc3cccc(F)c3o2)ccc1[N+](=O)[O-] ZINC000475077694 946324584 /nfs/dbraw/zinc/32/45/84/946324584.db2.gz UAMFMRUCDZAFNV-JTQLQIEISA-N 0 0 358.325 3.980 20 5 FHBDRN CC(C)Oc1ccc(Cn2cnc3cc([N+](=O)[O-])ccc3c2=O)cc1Cl ZINC000186466005 946331327 /nfs/dbraw/zinc/33/13/27/946331327.db2.gz UZTBEPMNSBDJBQ-UHFFFAOYSA-N 0 0 373.796 3.794 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2nc(-c3ccc(N4CCCCC4)nc3)no2)cc1 ZINC000109567429 946340210 /nfs/dbraw/zinc/34/02/10/946340210.db2.gz KXOGHQAOJINJRS-UHFFFAOYSA-N 0 0 351.366 3.697 20 5 FHBDRN O=[N+]([O-])c1cnc2ccc(F)cc2c1N1CC(c2ncc(C3CC3)cn2)C1 ZINC000894903461 946345144 /nfs/dbraw/zinc/34/51/44/946345144.db2.gz SXTZFRKETSOHOH-UHFFFAOYSA-N 0 0 365.368 3.553 20 5 FHBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@H]1C[C@H](C)O ZINC000125506280 946348773 /nfs/dbraw/zinc/34/87/73/946348773.db2.gz YLUUQPYRDZIDPN-KBPBESRZSA-N 0 0 366.483 3.718 20 5 FHBDRN O=[N+]([O-])c1ccccc1NCCc1nc(Cc2ccc(Cl)cc2)no1 ZINC000109612111 946353720 /nfs/dbraw/zinc/35/37/20/946353720.db2.gz CVXPAVAGRYEFRZ-UHFFFAOYSA-N 0 0 358.785 3.877 20 5 FHBDRN CCCc1n[nH]c(C(=O)NCC(C)(C)c2ccccc2Cl)c1[N+](=O)[O-] ZINC000109626361 946361614 /nfs/dbraw/zinc/36/16/14/946361614.db2.gz SYJYFMJLNXFPPF-UHFFFAOYSA-N 0 0 364.833 3.631 20 5 FHBDRN O=C(NC[C@H]1CCCS1)c1cc(F)c(Cl)c([N+](=O)[O-])c1Cl ZINC000896957317 946366649 /nfs/dbraw/zinc/36/66/49/946366649.db2.gz WCGVBUMLLIGTMZ-ZCFIWIBFSA-N 0 0 353.202 3.666 20 5 FHBDRN Cc1nc(-c2ccccc2)sc1C(=O)NCc1ccccc1[N+](=O)[O-] ZINC000046148658 946374114 /nfs/dbraw/zinc/37/41/14/946374114.db2.gz MQVBNOVMBREJSK-UHFFFAOYSA-N 0 0 353.403 3.957 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])c1cnn(-c2ccccc2)c1C1CC1 ZINC000046149448 946374347 /nfs/dbraw/zinc/37/43/47/946374347.db2.gz FWVWQBBXCLZLJW-UHFFFAOYSA-N 0 0 362.389 3.588 20 5 FHBDRN CC[C@@H](C)N(Cc1ccccc1)C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000111194505 946392019 /nfs/dbraw/zinc/39/20/19/946392019.db2.gz QTXMLFOWAQXEJF-CYBMUJFWSA-N 0 0 352.394 3.912 20 5 FHBDRN CC(=O)Nc1cccc([C@@H](C)NC(=O)Nc2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000043147834 946397887 /nfs/dbraw/zinc/39/78/87/946397887.db2.gz KYUDUIFNXPTWQQ-GFCCVEGCSA-N 0 0 356.382 3.744 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])Nc1ccc(OC(F)(F)F)cc1 ZINC000047700247 946399862 /nfs/dbraw/zinc/39/98/62/946399862.db2.gz ZDQUVALLBITIGG-UHFFFAOYSA-N 0 0 355.272 3.815 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1-c1noc([C@H]2CC(=O)N(C3CCCCC3)C2)n1 ZINC000545688970 946406600 /nfs/dbraw/zinc/40/66/00/946406600.db2.gz JIXDHLCXKFOOSO-ZDUSSCGKSA-N 0 0 370.409 3.602 20 5 FHBDRN Cn1cc(C(=O)Nc2ccc([N+](=O)[O-])cc2)c(-c2ccc(Cl)s2)n1 ZINC000475485620 946407608 /nfs/dbraw/zinc/40/76/08/946407608.db2.gz HJISFLALXIPIOS-UHFFFAOYSA-N 0 0 362.798 3.963 20 5 FHBDRN CO[C@H](C)c1nc(COC(=O)c2c(Cl)cccc2[N+](=O)[O-])cs1 ZINC000783555617 946433172 /nfs/dbraw/zinc/43/31/72/946433172.db2.gz YUWWTESVNUYUDO-MRVPVSSYSA-N 0 0 356.787 3.769 20 5 FHBDRN COC[C@@H](Sc1ccc([N+](=O)[O-])cc1C(=O)NC1CC1)c1ccccc1 ZINC000897004248 946434326 /nfs/dbraw/zinc/43/43/26/946434326.db2.gz XVQPSTXFSSBXKX-GOSISDBHSA-N 0 0 372.446 3.967 20 5 FHBDRN CC1(C)C[C@@H](Nc2c(Cl)c(Cl)ccc2[N+](=O)[O-])CCS1(=O)=O ZINC000896998028 946441843 /nfs/dbraw/zinc/44/18/43/946441843.db2.gz ITOCQVISOGEXMP-QMMMGPOBSA-N 0 0 367.254 3.669 20 5 FHBDRN COc1cc(NC(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])ccc1F ZINC000444323509 946444720 /nfs/dbraw/zinc/44/47/20/946444720.db2.gz BGWZRNDSBDKWPL-SECBINFHSA-N 0 0 368.748 3.802 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1Br)N1CCCc2ccccc21 ZINC000129494617 946445778 /nfs/dbraw/zinc/44/57/78/946445778.db2.gz FHEOEJNLBGJIHW-UHFFFAOYSA-N 0 0 361.195 3.950 20 5 FHBDRN COC[C@H](Sc1sc(S(C)(=O)=O)cc1[N+](=O)[O-])c1ccccc1 ZINC000897003222 946449149 /nfs/dbraw/zinc/44/91/49/946449149.db2.gz NAFUMHPMFNNNIM-LBPRGKRZSA-N 0 0 373.477 3.540 20 5 FHBDRN Cc1ccc(-c2noc(COC(=O)c3ccc(C)c([N+](=O)[O-])c3)n2)cc1 ZINC000025117062 946451162 /nfs/dbraw/zinc/45/11/62/946451162.db2.gz RGPBLEUDITYVOR-UHFFFAOYSA-N 0 0 353.334 3.619 20 5 FHBDRN Cc1ccc(F)c(NC(=O)Cc2ccc([N+](=O)[O-])cc2Br)c1 ZINC000151903475 946451906 /nfs/dbraw/zinc/45/19/06/946451906.db2.gz WHVVVDZRSUHYRA-UHFFFAOYSA-N 0 0 367.174 3.986 20 5 FHBDRN COC(=O)[C@H](NCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)C1CC1 ZINC000475140983 946465221 /nfs/dbraw/zinc/46/52/21/946465221.db2.gz SIKCJGCDUJLMEW-GOSISDBHSA-N 0 0 374.368 3.567 20 5 FHBDRN Cc1nn(CCC(=O)N[C@@H]2CCC[C@@H](C(C)C)CC2)c(C)c1[N+](=O)[O-] ZINC000186116757 946485749 /nfs/dbraw/zinc/48/57/49/946485749.db2.gz IYZFNVDFRUJIPQ-HZPDHXFCSA-N 0 0 350.463 3.519 20 5 FHBDRN Cc1nn(CCC(=O)N[C@H]2CCC[C@H](C(C)C)CC2)c(C)c1[N+](=O)[O-] ZINC000186116748 946486061 /nfs/dbraw/zinc/48/60/61/946486061.db2.gz IYZFNVDFRUJIPQ-HOTGVXAUSA-N 0 0 350.463 3.519 20 5 FHBDRN O=C(c1csc([N+](=O)[O-])c1)N(Cc1ccccc1)CC1(O)CCCC1 ZINC000475499470 946497225 /nfs/dbraw/zinc/49/72/25/946497225.db2.gz WLAHMBVSIUHCKS-UHFFFAOYSA-N 0 0 360.435 3.604 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1CN[C@H](C)c1ccc(Br)cn1 ZINC000475500979 946502009 /nfs/dbraw/zinc/50/20/09/946502009.db2.gz IFAHDIBJSKNGNX-LLVKDONJSA-N 0 0 350.216 3.912 20 5 FHBDRN CNC(=O)c1cc([N+](=O)[O-])ccc1NCCSCc1ccc(C)cc1 ZINC000261374354 946506381 /nfs/dbraw/zinc/50/63/81/946506381.db2.gz VZLVHGRBXYAUOD-UHFFFAOYSA-N 0 0 359.451 3.608 20 5 FHBDRN Cc1c(C(=O)Nc2cc(-c3cc(F)cc(F)c3)nn2C)cccc1[N+](=O)[O-] ZINC000487486997 946509834 /nfs/dbraw/zinc/50/98/34/946509834.db2.gz HFCXLVXYSVEAJY-UHFFFAOYSA-N 0 0 372.331 3.834 20 5 FHBDRN CSc1cccc(C(=O)N(C[C@H]2CCCO2)c2ccncc2)c1[N+](=O)[O-] ZINC000186519881 946511181 /nfs/dbraw/zinc/51/11/81/946511181.db2.gz RBNFWFAESMPSCZ-CQSZACIVSA-N 0 0 373.434 3.538 20 5 FHBDRN CSc1cccc(C(=O)NCCOc2cccc(Cl)c2)c1[N+](=O)[O-] ZINC000186149305 946517630 /nfs/dbraw/zinc/51/76/30/946517630.db2.gz WDLWTEPPLXUDTP-UHFFFAOYSA-N 0 0 366.826 3.779 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N(C)[C@@H](C)[C@H]1Cc2ccccc2O1 ZINC000127197026 946524398 /nfs/dbraw/zinc/52/43/98/946524398.db2.gz YUUBOWYZIVGWCI-SCLBCKFNSA-N 0 0 355.394 3.759 20 5 FHBDRN CSc1cccc(C(=O)Nc2cc(NC(C)=O)ccc2C)c1[N+](=O)[O-] ZINC000186143621 946528288 /nfs/dbraw/zinc/52/82/88/946528288.db2.gz ZJTQRRJPTFUUKF-UHFFFAOYSA-N 0 0 359.407 3.836 20 5 FHBDRN COC(=O)[C@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)C1CC1 ZINC000475159740 946529641 /nfs/dbraw/zinc/52/96/41/946529641.db2.gz ZENXWMULTXSWTC-MRXNPFEDSA-N 0 0 364.785 3.549 20 5 FHBDRN Cc1cc([C@H](C)NC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)c(C)s1 ZINC000049675579 946529599 /nfs/dbraw/zinc/52/95/99/946529599.db2.gz QWHDKGHKWHGSEU-LBPRGKRZSA-N 0 0 370.434 3.950 20 5 FHBDRN CSc1cccc(C(=O)N(C)Cc2cnc(C(C)C)nc2)c1[N+](=O)[O-] ZINC000441380895 946536952 /nfs/dbraw/zinc/53/69/52/946536952.db2.gz HUQSOAOKMDQKMM-UHFFFAOYSA-N 0 0 360.439 3.502 20 5 FHBDRN C[C@@H](CNC(=O)N1C[C@H](C)C[C@H]1c1cccnc1)c1ccccc1[N+](=O)[O-] ZINC000897060909 946547235 /nfs/dbraw/zinc/54/72/35/946547235.db2.gz DFAJSVLLMFOPOH-VCBZYWHSSA-N 0 0 368.437 3.886 20 5 FHBDRN Cc1cncc([C@H]2CCCN2C(=O)NC[C@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000897050876 946549184 /nfs/dbraw/zinc/54/91/84/946549184.db2.gz VTSKZUQEIDAHSQ-MAUKXSAKSA-N 0 0 368.437 3.948 20 5 FHBDRN C[C@H](CNC(=O)N1CCC[C@H](C(F)(F)F)C1)c1ccccc1[N+](=O)[O-] ZINC000897049727 946549435 /nfs/dbraw/zinc/54/94/35/946549435.db2.gz IXUZMMUEESGETC-NEPJUHHUSA-N 0 0 359.348 3.682 20 5 FHBDRN CC(C)Oc1ccc(Br)cc1NC(=O)c1ccc([N+](=O)[O-])o1 ZINC000128497643 946550008 /nfs/dbraw/zinc/55/00/08/946550008.db2.gz XGOGIABJDXMOSJ-UHFFFAOYSA-N 0 0 369.171 3.990 20 5 FHBDRN C[C@H](CNC(=O)N1CCC[C@@H]1c1ccncc1)c1ccccc1[N+](=O)[O-] ZINC000897074241 946553498 /nfs/dbraw/zinc/55/34/98/946553498.db2.gz BIPSNKVSTCTODC-RHSMWYFYSA-N 0 0 354.410 3.640 20 5 FHBDRN CC(C)N(Cc1nnc(-c2ccccc2)n1C)Cc1ccc([N+](=O)[O-])cc1 ZINC000128500496 946555510 /nfs/dbraw/zinc/55/55/10/946555510.db2.gz ANBYSJFRAJTCLV-UHFFFAOYSA-N 0 0 365.437 3.801 20 5 FHBDRN O=C(CN1Cc2ccccc2C2(CC2)C1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000186165972 946558264 /nfs/dbraw/zinc/55/82/64/946558264.db2.gz WRSQLZNJRVOQOE-UHFFFAOYSA-N 0 0 371.824 3.734 20 5 FHBDRN Cc1cccc([C@@H]2CCCN2C(=O)NC[C@H](C)c2ccccc2[N+](=O)[O-])n1 ZINC000897068302 946562288 /nfs/dbraw/zinc/56/22/88/946562288.db2.gz UPYOCEGWTGHQCE-LIRRHRJNSA-N 0 0 368.437 3.948 20 5 FHBDRN CCCO[C@@H]1CCCN(C(=O)NC[C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000897070226 946565929 /nfs/dbraw/zinc/56/59/29/946565929.db2.gz BPSXTELBTQHVHS-HZPDHXFCSA-N 0 0 363.458 3.689 20 5 FHBDRN Cc1cn(-c2cccc(NCC=Cc3ccccc3[N+](=O)[O-])c2)c(=O)[nH]1 ZINC000475517176 946568516 /nfs/dbraw/zinc/56/85/16/946568516.db2.gz RNRKCXIQOPYCAH-ALCCZGGFSA-N 0 0 350.378 3.920 20 5 FHBDRN C[C@@H](CNC(=O)N1CCC[C@@H]1c1ccccn1)c1ccccc1[N+](=O)[O-] ZINC000897072222 946570249 /nfs/dbraw/zinc/57/02/49/946570249.db2.gz XIPAKRIULDBBCL-KBXCAEBGSA-N 0 0 354.410 3.640 20 5 FHBDRN CCOC(=O)c1cc(C(=O)N(CC(C)C)CC(C)(C)C)cc([N+](=O)[O-])c1 ZINC000475182403 946571263 /nfs/dbraw/zinc/57/12/63/946571263.db2.gz KHRVVUIJZFKAOS-UHFFFAOYSA-N 0 0 364.442 3.916 20 5 FHBDRN CCc1ccc([C@H](COC)NC(=O)c2cccc(SC)c2[N+](=O)[O-])o1 ZINC000186576685 946585998 /nfs/dbraw/zinc/58/59/98/946585998.db2.gz BUVFPUVTNSNSAQ-ZDUSSCGKSA-N 0 0 364.423 3.590 20 5 FHBDRN COc1cc(OC)c(CN[C@H](C)c2cccc([N+](=O)[O-])c2C)c(OC)c1 ZINC000164416270 946597755 /nfs/dbraw/zinc/59/77/55/946597755.db2.gz YKUYZOVMLZBAON-CYBMUJFWSA-N 0 0 360.410 3.780 20 5 FHBDRN COCC(=O)N1CCc2c1cccc2N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000186588677 946605257 /nfs/dbraw/zinc/60/52/57/946605257.db2.gz QXOOWEVQLSGMIK-CQSZACIVSA-N 0 0 369.421 3.612 20 5 FHBDRN O=[N+]([O-])c1ccc(Cc2noc(C3(Cc4ccccc4)CCC3)n2)nc1 ZINC000545781627 946619235 /nfs/dbraw/zinc/61/92/35/946619235.db2.gz MTEMEYZYRPFBND-UHFFFAOYSA-N 0 0 350.378 3.628 20 5 FHBDRN CCOc1ccccc1[C@@H](CC)NC(=O)c1cccc([N+](=O)[O-])c1OC ZINC000475538965 946623756 /nfs/dbraw/zinc/62/37/56/946623756.db2.gz VUEQCEUGQXUVNS-OAHLLOKOSA-N 0 0 358.394 3.883 20 5 FHBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)N1CCCCC[C@@H]1/C=C\c1cccs1 ZINC000184437237 946624250 /nfs/dbraw/zinc/62/42/50/946624250.db2.gz QLKUGKNRAOJMFO-MEJMFZKBSA-N 0 0 372.450 3.732 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)N[C@@H]1CCO[C@H](c2ccccc2)C1 ZINC000184438393 946625891 /nfs/dbraw/zinc/62/58/91/946625891.db2.gz MLZHYGIRPYUFKW-MJGOQNOKSA-N 0 0 369.421 3.657 20 5 FHBDRN C[C@]1(CO)CCC[C@@H]1NC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000473906629 946628901 /nfs/dbraw/zinc/62/89/01/946628901.db2.gz UDAOUDYIRMJLTF-AZUAARDMSA-N 0 0 369.421 3.619 20 5 FHBDRN Cc1c(Cc2noc(-c3ccn(-c4ccccc4)n3)n2)cccc1[N+](=O)[O-] ZINC000545782061 946631622 /nfs/dbraw/zinc/63/16/22/946631622.db2.gz YBXHXLPGOMFLGQ-UHFFFAOYSA-N 0 0 361.361 3.730 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N1CCO[C@H](c2ccccc2Cl)C1 ZINC000151787098 946634431 /nfs/dbraw/zinc/63/44/31/946634431.db2.gz SVYHWNCSJSLLFW-SFHVURJKSA-N 0 0 374.824 3.781 20 5 FHBDRN COc1cc(CN(C)Cc2cnccc2C)c([N+](=O)[O-])cc1OC(F)F ZINC000475563358 946657724 /nfs/dbraw/zinc/65/77/24/946657724.db2.gz BIWLVYAOPKKQFB-UHFFFAOYSA-N 0 0 367.352 3.540 20 5 FHBDRN C[C@H]1C[C@H](CNC(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CCO1 ZINC000475192365 946660870 /nfs/dbraw/zinc/66/08/70/946660870.db2.gz MPKJTJKUIPUPOF-VHSXEESVSA-N 0 0 361.320 3.550 20 5 FHBDRN CCO[C@H]1C[C@@H](NC(=O)C2(c3ccc([N+](=O)[O-])cc3)CCC2)C12CCCC2 ZINC001126607371 946676922 /nfs/dbraw/zinc/67/69/22/946676922.db2.gz UEXZAUUDFCIIGG-MSOLQXFVSA-N 0 0 372.465 3.871 20 5 FHBDRN CC[C@@H](Nc1cccc2c1CCN2C(=O)COC)c1cccc([N+](=O)[O-])c1 ZINC000186606025 946692206 /nfs/dbraw/zinc/69/22/06/946692206.db2.gz JWNBGYOFLKSDEW-QGZVFWFLSA-N 0 0 369.421 3.694 20 5 FHBDRN C[C@@]1(NC(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CCO[C@@H]1C1CC1 ZINC000475206244 946721580 /nfs/dbraw/zinc/72/15/80/946721580.db2.gz BMKRWSDJLWQOMK-UKRRQHHQSA-N 0 0 373.331 3.693 20 5 FHBDRN C[C@@H](CNC(=O)c1cccc2c(=O)c3cccc(F)c3[nH]c12)C(F)(F)F ZINC000444332764 946731453 /nfs/dbraw/zinc/73/14/53/946731453.db2.gz UQHLPKFSZYPVIM-VIFPVBQESA-N 0 0 366.314 3.749 20 5 FHBDRN CC(C)C[C@@H]1CCCN(C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)C1 ZINC000151973562 946731896 /nfs/dbraw/zinc/73/18/96/946731896.db2.gz HNBYBNXGZGYPTJ-HNNXBMFYSA-N 0 0 356.426 3.679 20 5 FHBDRN Cc1ccccc1-n1cc(C(=O)N2c3ccc([N+](=O)[O-])cc3C[C@@H]2C)cn1 ZINC000112169287 946733337 /nfs/dbraw/zinc/73/33/37/946733337.db2.gz LEZMMSQDPNIWKI-AWEZNQCLSA-N 0 0 362.389 3.680 20 5 FHBDRN Cc1cccc2c1CC[C@H]2NS(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000729490000 946736915 /nfs/dbraw/zinc/73/69/15/946736915.db2.gz AODDSSMGQIGHEL-CQSZACIVSA-N 0 0 366.826 3.522 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)N[C@@H]1CCCc2c[nH]nc21 ZINC000475219890 946742387 /nfs/dbraw/zinc/74/23/87/946742387.db2.gz OGXWCGRVIMSJMG-LLVKDONJSA-N 0 0 369.303 3.536 20 5 FHBDRN CSc1cccc(C(=O)N2C[C@@H](C)OC[C@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000186630942 946747416 /nfs/dbraw/zinc/74/74/16/946747416.db2.gz MXSXHENDEYGJQQ-CJNGLKHVSA-N 0 0 372.446 3.919 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)N(Cc1cccc(O)c1)CC1CC1 ZINC000473928515 946747963 /nfs/dbraw/zinc/74/79/63/946747963.db2.gz QFNKEWGPOWIHCF-UHFFFAOYSA-N 0 0 372.446 3.831 20 5 FHBDRN Cc1ccccc1-n1cc(C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)cn1 ZINC000112171303 946750277 /nfs/dbraw/zinc/75/02/77/946750277.db2.gz QLJOFVHZMUJCSH-CQSZACIVSA-N 0 0 350.378 3.580 20 5 FHBDRN CCCN(Cc1ccc(F)cc1[N+](=O)[O-])[C@H](C)C(=O)Nc1ccccc1 ZINC001168074010 946752178 /nfs/dbraw/zinc/75/21/78/946752178.db2.gz PBAWFDCBCXDUEV-CQSZACIVSA-N 0 0 359.401 3.973 20 5 FHBDRN Cc1nc(NC(=O)Cc2coc3cc4c(cc23)CCC4)ccc1[N+](=O)[O-] ZINC000440408439 946753837 /nfs/dbraw/zinc/75/38/37/946753837.db2.gz KYESHVIKNVHSHZ-UHFFFAOYSA-N 0 0 351.362 3.714 20 5 FHBDRN Cc1nc(-c2cccs2)ccc1C(=O)Nc1ccc([N+](=O)[O-])c(C)n1 ZINC000134026683 946776672 /nfs/dbraw/zinc/77/66/72/946776672.db2.gz XUMNJOUBLJFXRM-UHFFFAOYSA-N 0 0 354.391 3.982 20 5 FHBDRN COc1nc(C)cc(C)c1COC(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC001271732055 946796464 /nfs/dbraw/zinc/79/64/64/946796464.db2.gz OXQDJVVHRVZIMT-UHFFFAOYSA-N 0 0 356.334 3.718 20 5 FHBDRN C[C@H]1[C@H](C(F)(F)F)CCN1Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000475279850 946817092 /nfs/dbraw/zinc/81/70/92/946817092.db2.gz OQXSRJZHNBYDLE-GZMMTYOYSA-N 0 0 354.275 3.969 20 5 FHBDRN CC(C)c1[nH]nc(C(=O)Nc2ccc3[nH]c(C(C)(C)C)nc3c2)c1[N+](=O)[O-] ZINC000475593471 946821347 /nfs/dbraw/zinc/82/13/47/946821347.db2.gz BXFXAGKBLSVRJX-UHFFFAOYSA-N 0 0 370.413 3.867 20 5 FHBDRN CCC(=O)Nc1ccc(C)c(NC(=O)c2cc(OC)ccc2[N+](=O)[O-])c1 ZINC000067548698 946828107 /nfs/dbraw/zinc/82/81/07/946828107.db2.gz MBQIBWMRKWRGFW-UHFFFAOYSA-N 0 0 357.366 3.513 20 5 FHBDRN C[C@@H]1CCN(C(=O)CCOc2ccccc2[N+](=O)[O-])c2c(O)cccc21 ZINC000186304838 946831112 /nfs/dbraw/zinc/83/11/12/946831112.db2.gz VBJPRPBMXYPZAE-CYBMUJFWSA-N 0 0 356.378 3.610 20 5 FHBDRN Cc1ccccc1N1C(=O)C(=Cc2ccc(Cl)c([N+](=O)[O-])c2)NC1=S ZINC000208924282 946833622 /nfs/dbraw/zinc/83/36/22/946833622.db2.gz BKQYCSROBVFXMM-JYRVWZFOSA-N 0 0 373.821 3.819 20 5 FHBDRN C[C@H](c1cccc([N+](=O)[O-])c1)N(C)[C@@H]1CCN(c2ccccc2F)C1=O ZINC000112360107 946861808 /nfs/dbraw/zinc/86/18/08/946861808.db2.gz GQMDPXGIZDQCIT-FZKQIMNGSA-N 0 0 357.385 3.532 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]cc(Cc3nc(Cc4ccc(F)cc4F)no3)c2c1 ZINC000546273227 946863500 /nfs/dbraw/zinc/86/35/00/946863500.db2.gz UCSLJKGROHSSSN-UHFFFAOYSA-N 0 0 370.315 3.919 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CCO[C@@H](c2cccc(F)c2)C1 ZINC000184487019 946872945 /nfs/dbraw/zinc/87/29/45/946872945.db2.gz BMVSADFSUCBZBY-GOSISDBHSA-N 0 0 373.384 3.956 20 5 FHBDRN CCN(C(=O)COc1ccccc1[N+](=O)[O-])c1ccc(Cl)c(F)c1 ZINC000441420963 946873904 /nfs/dbraw/zinc/87/39/04/946873904.db2.gz XJXBTNMHLPMJMS-UHFFFAOYSA-N 0 0 352.749 3.819 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)N[C@@H](C)c2cccc(O)c2)cc1SC ZINC000444456974 946892903 /nfs/dbraw/zinc/89/29/03/946892903.db2.gz PHFWYCCBNSFGPS-JTQLQIEISA-N 0 0 362.407 3.522 20 5 FHBDRN COCCc1ccc(Oc2ncc(Br)cc2[N+](=O)[O-])cc1 ZINC000048760118 946916311 /nfs/dbraw/zinc/91/63/11/946916311.db2.gz SXJPBLMQMUUZDU-UHFFFAOYSA-N 0 0 353.172 3.734 20 5 FHBDRN COc1ccc(C(C)(C)C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000186332251 946934591 /nfs/dbraw/zinc/93/45/91/946934591.db2.gz GLDUIWVWYKVEFA-UHFFFAOYSA-N 0 0 362.813 3.851 20 5 FHBDRN Cc1ccc(S(=O)(=O)N2CCC(c3ccsc3)CC2)cc1[N+](=O)[O-] ZINC000186335537 946948800 /nfs/dbraw/zinc/94/88/00/946948800.db2.gz VQBDIXVRFCWJBC-UHFFFAOYSA-N 0 0 366.464 3.533 20 5 FHBDRN CCOC(C)(C)CNC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000444517102 946971795 /nfs/dbraw/zinc/97/17/95/946971795.db2.gz FDOXZBMOGONRFV-UHFFFAOYSA-N 0 0 357.410 3.883 20 5 FHBDRN Cc1cccc(C)c1OC[C@@H](C)NC(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000523189250 946977389 /nfs/dbraw/zinc/97/73/89/946977389.db2.gz VOZAATZVVYGULN-MRXNPFEDSA-N 0 0 371.437 3.521 20 5 FHBDRN O=C(NC1CCC2(CCOCC2)CC1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000438521236 946984165 /nfs/dbraw/zinc/98/41/65/946984165.db2.gz BYDRPGLTJDITKZ-UHFFFAOYSA-N 0 0 373.453 3.638 20 5 FHBDRN CCN(C[C@@H]1CCOC1)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000613861835 946994711 /nfs/dbraw/zinc/99/47/11/946994711.db2.gz HTKVZBZNXXJPOZ-JTQLQIEISA-N 0 0 361.320 3.504 20 5 FHBDRN O=C(NCc1ccc2c(n1)CCCC2)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000444561091 947001561 /nfs/dbraw/zinc/00/15/61/947001561.db2.gz ZEAPFYHUYLZCIB-UHFFFAOYSA-N 0 0 351.362 3.545 20 5 FHBDRN CCC(C)(C)C1CCC(NC(=O)CCn2nc(C)c([N+](=O)[O-])c2C)CC1 ZINC000523223051 947005658 /nfs/dbraw/zinc/00/56/58/947005658.db2.gz IOUVGLYVVMUITL-UHFFFAOYSA-N 0 0 364.490 3.909 20 5 FHBDRN COc1ccc(OCCOc2ccc(NC(=O)C(C)C)cc2)c([N+](=O)[O-])c1 ZINC000543875134 947006557 /nfs/dbraw/zinc/00/65/57/947006557.db2.gz KDYQUIDKFWSELK-UHFFFAOYSA-N 0 0 374.393 3.656 20 5 FHBDRN CC(=O)N(c1nc(Cn2cnc([N+](=O)[O-])c2)cs1)c1ccc(C)cc1C ZINC000026123203 947009667 /nfs/dbraw/zinc/00/96/67/947009667.db2.gz QFWBMEXYHBURAC-UHFFFAOYSA-N 0 0 371.422 3.598 20 5 FHBDRN Cc1nc(-c2ccc(NC(=O)C(C)(C)n3cc([N+](=O)[O-])cn3)cc2)cs1 ZINC000523227487 947011700 /nfs/dbraw/zinc/01/17/00/947011700.db2.gz WHPFWDWDEAFRSG-UHFFFAOYSA-N 0 0 371.422 3.597 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)c1ccc(OC(F)F)cc1 ZINC000186346672 947022173 /nfs/dbraw/zinc/02/21/73/947022173.db2.gz IRRVJFFFIRMTAH-UHFFFAOYSA-N 0 0 356.712 3.780 20 5 FHBDRN CN(Cc1ccc(F)c(Cl)c1)C(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000432267223 947025706 /nfs/dbraw/zinc/02/57/06/947025706.db2.gz BPNCJNJDMBAYQY-UHFFFAOYSA-N 0 0 365.792 3.848 20 5 FHBDRN C[C@H](Cc1ccccc1F)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186350664 947026947 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366.373 3.991 20 5 FHBDRN O=C(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@@H]1CC[C@@H]2CCCC[C@H]2C1 ZINC000444634787 947065158 /nfs/dbraw/zinc/06/51/58/947065158.db2.gz ZWQCYTQMBBMZGF-MELADBBJSA-N 0 0 356.426 3.694 20 5 FHBDRN CCSc1ccc(C(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000444644731 947065536 /nfs/dbraw/zinc/06/55/36/947065536.db2.gz NLCGQORITXQIFO-UHFFFAOYSA-N 0 0 356.407 3.513 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1-c1nc(-c2ccc(OCC(F)F)nc2)no1 ZINC000546551192 947073603 /nfs/dbraw/zinc/07/36/03/947073603.db2.gz JQXJHTUQLSGAGT-UHFFFAOYSA-N 0 0 362.292 3.659 20 5 FHBDRN COC(=O)[C@H](NC/C=C\c1ccccc1[N+](=O)[O-])c1ccc(C)c(C)c1 ZINC000428373226 947079761 /nfs/dbraw/zinc/07/97/61/947079761.db2.gz NOPLHWFEFNMMPT-MONCILHSSA-N 0 0 354.406 3.729 20 5 FHBDRN CC[C@H](C(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)C1CCC(C)CC1 ZINC000444638446 947080991 /nfs/dbraw/zinc/08/09/91/947080991.db2.gz WDPUZOJFLHANCU-PIMMBPRGSA-N 0 0 358.442 3.940 20 5 FHBDRN O=C(CCCc1ccc(Cl)cc1)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 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FWCYUVQXVZBEPY-RDJZCZTQSA-N 0 0 374.437 3.840 20 5 FHBDRN CN(Cc1ccc(F)c(Cl)c1)C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000432288545 947113965 /nfs/dbraw/zinc/11/39/65/947113965.db2.gz ZIRSPAMVWBQQRU-UHFFFAOYSA-N 0 0 362.748 3.536 20 5 FHBDRN C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N(C)Cc1cc(Cl)ccc1F ZINC000444697599 947123111 /nfs/dbraw/zinc/12/31/11/947123111.db2.gz QTCILIDOHVWSSC-NSHDSACASA-N 0 0 365.792 3.846 20 5 FHBDRN CCOC(=O)[C@H]1CCN(Cc2ccc([N+](=O)[O-])c(OC)c2)c2ccccc21 ZINC000444712743 947142690 /nfs/dbraw/zinc/14/26/90/947142690.db2.gz WZTYCGDDSLLMSI-INIZCTEOSA-N 0 0 370.405 3.660 20 5 FHBDRN COC(=O)c1cc(NC(=O)C/C=C/c2ccc(C)cc2)cc([N+](=O)[O-])c1 ZINC000440535837 947180048 /nfs/dbraw/zinc/18/00/48/947180048.db2.gz CRLLQNJPZNOHTB-ONEGZZNKSA-N 0 0 354.362 3.732 20 5 FHBDRN CC[C@@H](C)NC(=O)[C@@H](C)Sc1ccc(Br)cc1[N+](=O)[O-] ZINC000088501624 947181739 /nfs/dbraw/zinc/18/17/39/947181739.db2.gz LQZUBAVRFBGKSS-RKDXNWHRSA-N 0 0 361.261 3.753 20 5 FHBDRN COc1c(C(=O)NCC(C)(C)c2ccccc2Cl)cccc1[N+](=O)[O-] ZINC000475612746 947203891 /nfs/dbraw/zinc/20/38/91/947203891.db2.gz QOZPPCXGWADILS-UHFFFAOYSA-N 0 0 362.813 3.964 20 5 FHBDRN C[C@H](CN(C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000066934875 947205731 /nfs/dbraw/zinc/20/57/31/947205731.db2.gz XNNYLABQYIQAON-GFCCVEGCSA-N 0 0 368.842 3.672 20 5 FHBDRN CC(C)N(C)C(=O)C1CCN(c2c(Cl)cc([N+](=O)[O-])cc2Cl)CC1 ZINC000121498596 947209173 /nfs/dbraw/zinc/20/91/73/947209173.db2.gz IUKXNKRCDDZMRR-UHFFFAOYSA-N 0 0 374.268 3.985 20 5 FHBDRN O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1cc2c(s1)CCC2 ZINC000121290046 947220786 /nfs/dbraw/zinc/22/07/86/947220786.db2.gz XFYPXZBLLRNKDJ-UHFFFAOYSA-N 0 0 354.334 3.999 20 5 FHBDRN C[C@@H](NC(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1)c1cc(F)c(Cl)cc1Cl ZINC000444826302 947240975 /nfs/dbraw/zinc/24/09/75/947240975.db2.gz LUTAGNAJRLKJDV-ZCFIWIBFSA-N 0 0 374.155 3.632 20 5 FHBDRN O=C(NCCCc1ccccc1)c1sc(Br)cc1[N+](=O)[O-] ZINC000444829862 947245508 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FHBDRN CCOC(=O)c1ccnc(NCc2ccccc2OCC2CC2)c1[N+](=O)[O-] ZINC000523513403 947325304 /nfs/dbraw/zinc/32/53/04/947325304.db2.gz AZDKFCQEEAJYNJ-UHFFFAOYSA-N 0 0 371.393 3.567 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NCCc1c[nH]c2cccc(C)c12 ZINC000444910592 947328253 /nfs/dbraw/zinc/32/82/53/947328253.db2.gz GKGNAWCLKMAIGD-UHFFFAOYSA-N 0 0 368.393 3.757 20 5 FHBDRN Cc1ccc(NCCCNC(=O)N[C@@H](C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000523518558 947330258 /nfs/dbraw/zinc/33/02/58/947330258.db2.gz GMTINUUSRXDGLQ-HNNXBMFYSA-N 0 0 356.426 3.766 20 5 FHBDRN O=[N+]([O-])c1ccccc1Cc1noc(COc2ccc(F)cc2Cl)n1 ZINC000546239724 947332515 /nfs/dbraw/zinc/33/25/15/947332515.db2.gz BTJUFXXXKSSSHV-UHFFFAOYSA-N 0 0 363.732 3.940 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NCCCn1ccc2ccccc21 ZINC000444896466 947336038 /nfs/dbraw/zinc/33/60/38/947336038.db2.gz LZUVITXZYPNQHH-UHFFFAOYSA-N 0 0 368.393 3.770 20 5 FHBDRN CSCc1ccc(NC(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000444897916 947337297 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O=C(Nc1ccc2cc([N+](=O)[O-])ccc2n1)[C@H]1C[C@H]1c1c(F)cccc1F ZINC000440607097 947362242 /nfs/dbraw/zinc/36/22/42/947362242.db2.gz APXXUOGWTQFROZ-OLZOCXBDSA-N 0 0 369.327 3.585 20 5 FHBDRN CSc1ccc(C)c(NC(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)c1 ZINC000444946617 947366447 /nfs/dbraw/zinc/36/64/47/947366447.db2.gz XIHHKNNQPNLDML-UHFFFAOYSA-N 0 0 371.422 3.823 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@H](C)[C@@H]1Oc2ccccc2[C@H]1C ZINC000444931119 947370994 /nfs/dbraw/zinc/37/09/94/947370994.db2.gz NDSXPYHAFZTARS-SEDUGSJDSA-N 0 0 371.393 3.678 20 5 FHBDRN CCc1ccc(NC(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1CC ZINC000444933191 947372143 /nfs/dbraw/zinc/37/21/43/947372143.db2.gz QNYOYNBUMGEBAQ-UHFFFAOYSA-N 0 0 367.409 3.918 20 5 FHBDRN C[C@@H](SCc1ccccc1)C(=O)Nc1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000440623274 947377047 /nfs/dbraw/zinc/37/70/47/947377047.db2.gz JQIUSRLKJKLPSP-CYBMUJFWSA-N 0 0 367.430 3.825 20 5 FHBDRN CC[C@H](CNC(=O)c1ccc([N+](=O)[O-])s1)Oc1cccc(Cl)c1 ZINC000440616068 947377176 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356.426 3.782 20 5 FHBDRN COc1cc(C(=O)N2CC[C@H](C)C[C@@H]2c2ccco2)cc([N+](=O)[O-])c1OC ZINC000440627077 947430917 /nfs/dbraw/zinc/43/09/17/947430917.db2.gz HSUKGIFXOIXMSH-GXTWGEPZSA-N 0 0 374.393 3.818 20 5 FHBDRN O=[N+]([O-])c1cccc2ncnc(Sc3nnc(-c4ccc(F)cc4)o3)c21 ZINC000544395556 947434471 /nfs/dbraw/zinc/43/44/71/947434471.db2.gz ZTEPGNKYENKDBD-UHFFFAOYSA-N 0 0 369.337 3.878 20 5 FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)CC(C)(C)C ZINC000457194299 947440644 /nfs/dbraw/zinc/44/06/44/947440644.db2.gz OUEUIEZGEAQUCI-LBPRGKRZSA-N 0 0 354.472 3.888 20 5 FHBDRN O=C(O[C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1)[C@H]1CSc2ccccc21 ZINC000759931185 947458245 /nfs/dbraw/zinc/45/82/45/947458245.db2.gz LARVGOVMMAWCPJ-RRFJBIMHSA-N 0 0 373.434 3.708 20 5 FHBDRN Cn1cc([N+](=O)[O-])cc1C(=O)NC(C)(C)c1ccc(Cl)c(Cl)c1 ZINC000523651508 947462946 /nfs/dbraw/zinc/46/29/46/947462946.db2.gz BLHYXVNWUVJWAR-UHFFFAOYSA-N 0 0 356.209 3.905 20 5 FHBDRN CC(C)Oc1ccc(NC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)c(F)c1 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QKSYIUAIIXUZGG-GFCCVEGCSA-N 0 0 359.430 3.518 20 5 FHBDRN C[C@](O)(CNc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-])C(F)(F)F ZINC000536334302 947527399 /nfs/dbraw/zinc/52/73/99/947527399.db2.gz SQMFCJRUKQCSSV-INIZCTEOSA-N 0 0 368.311 3.551 20 5 FHBDRN Cc1cccc(C(=O)N2C[C@@H](C)N(Cc3ccccc3)C[C@@H]2C)c1[N+](=O)[O-] ZINC000500437613 947536802 /nfs/dbraw/zinc/53/68/02/947536802.db2.gz APDQSCDPJRTGDP-SJORKVTESA-N 0 0 367.449 3.638 20 5 FHBDRN CC(C)(C(=O)Nc1cccc(-c2nnco2)c1)c1ccc([N+](=O)[O-])cc1F ZINC000546571450 947540988 /nfs/dbraw/zinc/54/09/88/947540988.db2.gz NXCNFLLHKCWRLL-UHFFFAOYSA-N 0 0 370.340 3.700 20 5 FHBDRN COc1nc(NCc2c(C)cc(Cl)cc2Cl)nc(C)c1[N+](=O)[O-] ZINC001167792770 947567455 /nfs/dbraw/zinc/56/74/55/947567455.db2.gz MLNQZHRYXSSCQF-UHFFFAOYSA-N 0 0 357.197 3.929 20 5 FHBDRN Cc1ccc(NC(=O)CN2CCc3ccc([N+](=O)[O-])cc3C2)c(Cl)c1 ZINC000088606166 947572327 /nfs/dbraw/zinc/57/23/27/947572327.db2.gz WZUWRJQVMRSOFM-UHFFFAOYSA-N 0 0 359.813 3.553 20 5 FHBDRN Cc1cc(S(=O)(=O)N[C@H]2CCc3c2cccc3Cl)ccc1[N+](=O)[O-] ZINC000523757415 947574495 /nfs/dbraw/zinc/57/44/95/947574495.db2.gz ISOPZJFJOQEXRM-HNNXBMFYSA-N 0 0 366.826 3.522 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000445185521 947577337 /nfs/dbraw/zinc/57/73/37/947577337.db2.gz QFDFRAGETFPZJL-UHFFFAOYSA-N 0 0 373.368 3.520 20 5 FHBDRN Cc1cc(S(=O)(=O)N(C)[C@@H](C)c2c(F)cccc2F)ccc1[N+](=O)[O-] ZINC000523758874 947577552 /nfs/dbraw/zinc/57/75/52/947577552.db2.gz VHKFTEORDROPTQ-NSHDSACASA-N 0 0 370.377 3.563 20 5 FHBDRN O=C(c1ccc(F)cc1[N+](=O)[O-])N1CCC(OCC2CCCC2)CC1 ZINC000150799832 947577581 /nfs/dbraw/zinc/57/75/81/947577581.db2.gz UVRUYEHUWMWZLG-UHFFFAOYSA-N 0 0 350.390 3.545 20 5 FHBDRN C[C@H]1CCC[C@H](CNC(=O)c2sc(Br)cc2[N+](=O)[O-])C1 ZINC000445189150 947581039 /nfs/dbraw/zinc/58/10/39/947581039.db2.gz VCBQPKJWQVVEPZ-IUCAKERBSA-N 0 0 361.261 3.975 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CCN(c2cccs2)CC1 ZINC000120342207 947595214 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O=C(NCCc1ccc([N+](=O)[O-])cc1)N[C@H]1CCc2c1cccc2Cl ZINC000523877923 947704068 /nfs/dbraw/zinc/70/40/68/947704068.db2.gz UDHWKFNOQPWIHR-KRWDZBQOSA-N 0 0 359.813 3.777 20 5 FHBDRN Cc1cccc([C@H](C)C(=O)O[C@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)c1 ZINC000759936798 947710285 /nfs/dbraw/zinc/71/02/85/947710285.db2.gz VQPQGGJXAPXWHJ-XIRDDKMYSA-N 0 0 357.410 3.930 20 5 FHBDRN COc1ccccc1OCCN(C)C(=O)c1c(C)cc(C)c([N+](=O)[O-])c1C ZINC000094032562 947740960 /nfs/dbraw/zinc/74/09/60/947740960.db2.gz IFYJWQMHBQYRCN-UHFFFAOYSA-N 0 0 372.421 3.680 20 5 FHBDRN CC(=O)CCc1ccc(O[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 ZINC000021557270 947748790 /nfs/dbraw/zinc/74/87/90/947748790.db2.gz ZQZGBULISAEDDI-OAHLLOKOSA-N 0 0 370.405 3.831 20 5 FHBDRN C[C@@H](c1ccccc1)c1ccc(OC(=O)CCn2cc([N+](=O)[O-])cn2)cc1 ZINC000728853145 947755249 /nfs/dbraw/zinc/75/52/49/947755249.db2.gz XTNJSRAUEVPQBI-HNNXBMFYSA-N 0 0 365.389 3.939 20 5 FHBDRN O=C(c1cc2c(c(Cl)c1)OCO2)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000152314452 947771561 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947941340 /nfs/dbraw/zinc/94/13/40/947941340.db2.gz RSOFDEFEHYVZGT-CYBMUJFWSA-N 0 0 365.861 3.723 20 5 FHBDRN O=C(OCc1cc([N+](=O)[O-])ccc1Cl)c1cccc(OCC(F)F)n1 ZINC000125830140 947943954 /nfs/dbraw/zinc/94/39/54/947943954.db2.gz ROSYHMJKDUBHMB-UHFFFAOYSA-N 0 0 372.711 3.644 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H]1CCCC1(F)F ZINC000459033734 947947733 /nfs/dbraw/zinc/94/77/33/947947733.db2.gz RVAGNKPZKJQTMR-CQSZACIVSA-N 0 0 355.385 3.950 20 5 FHBDRN COc1cc(CNc2ccnc3c2cccc3[N+](=O)[O-])cc(OC)c1OC ZINC000432315116 947957617 /nfs/dbraw/zinc/95/76/17/947957617.db2.gz SZJKOHIVAQCYMV-UHFFFAOYSA-N 0 0 369.377 3.781 20 5 FHBDRN O=[N+]([O-])c1cccc(Cl)c1NC[C@@H](c1cccs1)N1CCOCC1 ZINC000432316583 947965836 /nfs/dbraw/zinc/96/58/36/947965836.db2.gz YGDSNGFCBOPWLL-AWEZNQCLSA-N 0 0 367.858 3.795 20 5 FHBDRN Cc1ccc(F)c(CCNC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000459039983 947983458 /nfs/dbraw/zinc/98/34/58/947983458.db2.gz KSALMFJETJDOLY-UHFFFAOYSA-N 0 0 371.412 3.959 20 5 FHBDRN CCc1cccc(CC)c1NC(=O)[C@H](C)Oc1ccc([N+](=O)[O-])c(CO)c1 ZINC000432319486 948005823 /nfs/dbraw/zinc/00/58/23/948005823.db2.gz GPASWCADAHWQME-ZDUSSCGKSA-N 0 0 372.421 3.618 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NCc1cccc(-n2ccnc2)c1 ZINC000094152190 948017991 /nfs/dbraw/zinc/01/79/91/948017991.db2.gz KPQBXFWSRVPUOK-UHFFFAOYSA-N 0 0 364.405 3.636 20 5 FHBDRN O=C(OCc1ccccc1[N+](=O)[O-])c1nn(-c2ccccc2)c2c1CCC2 ZINC000105435311 948032428 /nfs/dbraw/zinc/03/24/28/948032428.db2.gz OVSMVERLDIZEJT-UHFFFAOYSA-N 0 0 363.373 3.626 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)NC1CCc2ccccc2CC1 ZINC000459073536 948044239 /nfs/dbraw/zinc/04/42/39/948044239.db2.gz PRRAGAQXSQHZHA-UHFFFAOYSA-N 0 0 367.449 3.726 20 5 FHBDRN COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)NC2CC=CC2)cc1 ZINC000125878909 948067295 /nfs/dbraw/zinc/06/72/95/948067295.db2.gz HTLSGSCNMOPTLB-UHFFFAOYSA-N 0 0 354.362 3.844 20 5 FHBDRN COc1cccc(N2CC[C@@H](Nc3ccnc4c3cccc4[N+](=O)[O-])C2)c1 ZINC000432326175 948073539 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CCN(CCNC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)c1ccccc1C ZINC000512012982 948184980 /nfs/dbraw/zinc/18/49/80/948184980.db2.gz XSCSYDPKQKNDLX-UHFFFAOYSA-N 0 0 366.421 3.641 20 5 FHBDRN COC(=O)[C@H]1CC[C@H](Nc2cc(C)c(Br)cc2[N+](=O)[O-])CC1 ZINC001167830611 948192482 /nfs/dbraw/zinc/19/24/82/948192482.db2.gz MEKYOGZSLYCOOO-XYPYZODXSA-N 0 0 371.231 3.809 20 5 FHBDRN CC(C)OCc1ccccc1CNC(=O)NCc1ccccc1[N+](=O)[O-] ZINC000520511457 948192893 /nfs/dbraw/zinc/19/28/93/948192893.db2.gz ABYDLLGAQZMASM-UHFFFAOYSA-N 0 0 357.410 3.519 20 5 FHBDRN CCc1ccc(NCc2ccc(OCC(=O)OC)c([N+](=O)[O-])c2)cc1C ZINC000473992767 948197951 /nfs/dbraw/zinc/19/79/51/948197951.db2.gz FQAIYHSFYDYJMX-UHFFFAOYSA-N 0 0 358.394 3.630 20 5 FHBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)N1CCc2cccc(F)c21 ZINC000427590506 948198917 /nfs/dbraw/zinc/19/89/17/948198917.db2.gz AXDWPVOSOWWFLH-UHFFFAOYSA-N 0 0 372.399 3.883 20 5 FHBDRN Cc1ccc(C(=O)CCCC(=O)N2CCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000184692545 948206521 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FHBDRN O=[N+]([O-])c1cccc(Br)c1OC[C@@H]1COc2ccccc2O1 ZINC000585732324 948241232 /nfs/dbraw/zinc/24/12/32/948241232.db2.gz MCVFJNZBVHHHPI-JTQLQIEISA-N 0 0 366.167 3.576 20 5 FHBDRN CC(C)(C)c1cc(C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)n[nH]1 ZINC000585750528 948257916 /nfs/dbraw/zinc/25/79/16/948257916.db2.gz QCDJJLIFCGCIQP-UHFFFAOYSA-N 0 0 367.203 3.630 20 5 FHBDRN Cc1cc(N2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)ccc1[N+](=O)[O-] ZINC000054061202 948261390 /nfs/dbraw/zinc/26/13/90/948261390.db2.gz SVEXHTPWYKBTEI-UHFFFAOYSA-N 0 0 374.828 3.807 20 5 FHBDRN CCc1ccc([C@H]2CCN(C(=O)Cc3ccc(OC)c([N+](=O)[O-])c3)C2)cc1 ZINC000520554976 948266242 /nfs/dbraw/zinc/26/62/42/948266242.db2.gz LIYHDBGOTAHBMR-SFHVURJKSA-N 0 0 368.433 3.724 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCCC[C@H]1c1ncc[nH]1 ZINC000184717390 948269050 /nfs/dbraw/zinc/26/90/50/948269050.db2.gz DZAWUCUYUFCDDU-RDJZCZTQSA-N 0 0 356.426 3.640 20 5 FHBDRN C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)Nc3cccnc3F)cc2[N+](=O)[O-])C1 ZINC000843691467 948282938 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FHBDRN O=[N+]([O-])c1cc(C(F)F)ccc1NC[C@@H]1CCN(CC(F)(F)F)C1 ZINC000326311866 948542949 /nfs/dbraw/zinc/54/29/49/948542949.db2.gz LQDHZXOSOKNGMN-VIFPVBQESA-N 0 0 353.291 3.829 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N(C)[C@@H](c1ncc[nH]1)c1ccccc1 ZINC000432484823 948556599 /nfs/dbraw/zinc/55/65/99/948556599.db2.gz HNPUQLUCXJAGSC-QGZVFWFLSA-N 0 0 365.393 3.880 20 5 FHBDRN Cc1ccc(NC(=O)NC(C)(C)c2cc(C(F)(F)F)on2)cc1[N+](=O)[O-] ZINC000432482408 948556766 /nfs/dbraw/zinc/55/67/66/948556766.db2.gz GIYFMKXACYWLTO-UHFFFAOYSA-N 0 0 372.303 3.967 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)NCc1ccc(F)c(Cl)c1 ZINC000512156676 948580658 /nfs/dbraw/zinc/58/06/58/948580658.db2.gz QSQVAPLIKUQRHE-UHFFFAOYSA-N 0 0 365.792 3.771 20 5 FHBDRN Cc1cccc(-c2nnc([C@H](C)OC(=O)c3ccc([N+](=O)[O-])s3)o2)c1 ZINC000019296702 948599809 /nfs/dbraw/zinc/59/98/09/948599809.db2.gz TZRUBENIDHBLJO-JTQLQIEISA-N 0 0 359.363 3.933 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)O[C@H]([C@@H]1CCCOC1)C(F)(F)F ZINC000279195109 948599947 /nfs/dbraw/zinc/59/99/47/948599947.db2.gz KAGIGDYKYQFPGI-FJJZPOORSA-N 0 0 373.327 3.899 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCOCC2(CCCC2)C1 ZINC000613961768 948627497 /nfs/dbraw/zinc/62/74/97/948627497.db2.gz DSKSTZYNNZKLTH-KRWDZBQOSA-N 0 0 360.454 3.583 20 5 FHBDRN CC1CCN(c2ccc(C(=O)Nc3cccnc3F)cc2[N+](=O)[O-])CC1 ZINC000843691877 948630991 /nfs/dbraw/zinc/63/09/91/948630991.db2.gz NWJVAPOMIOFFDE-UHFFFAOYSA-N 0 0 358.373 3.618 20 5 FHBDRN CCOC(=O)C1CCC(Nc2ccc([N+](=O)[O-])cc2Br)CC1 ZINC000389132343 948651664 /nfs/dbraw/zinc/65/16/64/948651664.db2.gz KTGUYHILJOQIBD-UHFFFAOYSA-N 0 0 371.231 3.891 20 5 FHBDRN COC(=O)CCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccccc1 ZINC000536467906 948686877 /nfs/dbraw/zinc/68/68/77/948686877.db2.gz MOBLNYMEFOYTGD-UHFFFAOYSA-N 0 0 360.391 3.502 20 5 FHBDRN CN(Cc1ccccc1)c1ncnc(N(C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000040572637 948702448 /nfs/dbraw/zinc/70/24/48/948702448.db2.gz MSSFSORIBMOTRS-UHFFFAOYSA-N 0 0 363.421 3.658 20 5 FHBDRN CC(=O)Nc1ccc(Cl)c(NC(=O)c2c[nH]c3cccc([N+](=O)[O-])c32)c1 ZINC000536486859 948735334 /nfs/dbraw/zinc/73/53/34/948735334.db2.gz VFUWWDVLAIUVME-UHFFFAOYSA-N 0 0 372.768 3.940 20 5 FHBDRN O=[N+]([O-])c1ccccc1/C=C\c1nc(-c2ccc(-c3nnco3)cc2)no1 ZINC000445392195 948740252 /nfs/dbraw/zinc/74/02/52/948740252.db2.gz LNUGFWLQYNOPHP-KTKRTIGZSA-N 0 0 361.317 3.865 20 5 FHBDRN CCOCc1ccccc1CNc1cc(C)c([N+](=O)[O-])c(C(=O)OC)c1 ZINC000440737639 948745085 /nfs/dbraw/zinc/74/50/85/948745085.db2.gz CXNZGNADLIBKKM-UHFFFAOYSA-N 0 0 358.394 3.838 20 5 FHBDRN Cc1c(NC(=O)[C@@H](C)Nc2ccc(OCC(C)C)nc2)cccc1[N+](=O)[O-] ZINC000523973645 948748684 /nfs/dbraw/zinc/74/86/84/948748684.db2.gz IUQFBBKPOYGPIU-CQSZACIVSA-N 0 0 372.425 3.772 20 5 FHBDRN Cc1c(NC(=O)[C@H](C)Nc2ccc(OCC(C)C)nc2)cccc1[N+](=O)[O-] ZINC000523973644 948748937 /nfs/dbraw/zinc/74/89/37/948748937.db2.gz IUQFBBKPOYGPIU-AWEZNQCLSA-N 0 0 372.425 3.772 20 5 FHBDRN COC1(c2noc(-c3ccc(OC(F)F)c([N+](=O)[O-])c3)n2)CCCC1 ZINC000445384439 948751469 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Cc1cccc2sc(NC(=O)c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3)nc21 ZINC000006259907 219722511 /nfs/dbraw/zinc/72/25/11/219722511.db2.gz POQADTMRGMCEFU-UHFFFAOYSA-N 0 0 358.335 3.673 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1O[C@@H](C)C(=O)Nc1ccc(Cl)cc1 ZINC000006290654 219723847 /nfs/dbraw/zinc/72/38/47/219723847.db2.gz YULZISLNFBSFHI-JTQLQIEISA-N 0 0 350.758 3.663 20 5 FHBDRN O=C(Nc1ccc(F)c([N+](=O)[O-])c1)c1cc(Br)ccc1F ZINC000008079642 219846606 /nfs/dbraw/zinc/84/66/06/219846606.db2.gz VZZOXQNBCACWOW-UHFFFAOYSA-N 0 0 357.110 3.888 20 5 FHBDRN Cc1ccc(S(=O)(=O)N(C)[C@H]2CCCc3ccccc32)cc1[N+](=O)[O-] ZINC000008167285 219851385 /nfs/dbraw/zinc/85/13/85/219851385.db2.gz UVSFJZAORGUPJX-KRWDZBQOSA-N 0 0 360.435 3.601 20 5 FHBDRN C[C@H]1C[C@@H](c2cccnc2)N(CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000359875652 223134418 /nfs/dbraw/zinc/13/44/18/223134418.db2.gz NSYBOFRJRZKDCF-SJCJKPOMSA-N 0 0 374.828 3.665 20 5 FHBDRN Cc1ccccc1NC1CCN(C(=O)Cc2ccccc2[N+](=O)[O-])CC1 ZINC000359956410 223139583 /nfs/dbraw/zinc/13/95/83/223139583.db2.gz KRKHUAWRCPAFKL-UHFFFAOYSA-N 0 0 353.422 3.549 20 5 FHBDRN O=Cc1ccc(OCc2ccc(F)cc2Br)c([N+](=O)[O-])c1 ZINC000010123972 219894165 /nfs/dbraw/zinc/89/41/65/219894165.db2.gz XZIPAFZPARSWCX-UHFFFAOYSA-N 0 0 354.131 3.888 20 5 FHBDRN O=C(Nc1cc([N+](=O)[O-])ccc1F)c1ccc(OC[C@H]2CCCO2)cc1 ZINC000013619129 220079269 /nfs/dbraw/zinc/07/92/69/220079269.db2.gz JTGYFNOWMZBBIP-OAHLLOKOSA-N 0 0 360.341 3.544 20 5 FHBDRN COc1ccc(NC(=O)CNc2cccc3ccccc32)c([N+](=O)[O-])c1 ZINC000015086289 220148104 /nfs/dbraw/zinc/14/81/04/220148104.db2.gz BFQUKQRFRNYUHF-UHFFFAOYSA-N 0 0 351.362 3.807 20 5 FHBDRN CCCCCc1nnc(NC(=O)c2ccc(OCC)c([N+](=O)[O-])c2)s1 ZINC000019005460 220232761 /nfs/dbraw/zinc/23/27/61/220232761.db2.gz GFDWOAHIJSNQHT-UHFFFAOYSA-N 0 0 364.427 3.830 20 5 FHBDRN CCOc1ccc(C(=O)Nc2ccc(OC(F)F)cc2)cc1[N+](=O)[O-] ZINC000019006087 220233261 /nfs/dbraw/zinc/23/32/61/220233261.db2.gz WKADHXYCMOUQHL-UHFFFAOYSA-N 0 0 352.293 3.847 20 5 FHBDRN Cc1c(C(=O)N[C@H](C)c2cccc(Cl)c2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000023482879 220427939 /nfs/dbraw/zinc/42/79/39/220427939.db2.gz UTAZONPRYZCLGW-SNVBAGLBSA-N 0 0 363.757 3.956 20 5 FHBDRN CCOc1cc(C(=O)N(CC)C2CCCCC2)c([N+](=O)[O-])cc1OC ZINC000025251044 220478946 /nfs/dbraw/zinc/47/89/46/220478946.db2.gz XRPPHQICQRYRKX-UHFFFAOYSA-N 0 0 350.415 3.797 20 5 FHBDRN Cc1nc2ccccc2nc1S[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000029281465 220599744 /nfs/dbraw/zinc/59/97/44/220599744.db2.gz QXYNJXKJBRFJJL-GFCCVEGCSA-N 0 0 368.418 3.966 20 5 FHBDRN CC(C)NC(=O)c1ccc(Cl)cc1NC(=O)c1ccccc1[N+](=O)[O-] ZINC000046716674 220984813 /nfs/dbraw/zinc/98/48/13/220984813.db2.gz MGFTYSLPNJDWSQ-UHFFFAOYSA-N 0 0 361.785 3.639 20 5 FHBDRN CCC(=O)Nc1ccc(C)c(NC(=O)c2ccc(OC)c([N+](=O)[O-])c2)c1 ZINC000046679111 220985095 /nfs/dbraw/zinc/98/50/95/220985095.db2.gz WFYQEVOMXVFLBF-UHFFFAOYSA-N 0 0 357.366 3.513 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1-n1cccn1 ZINC000049703791 221027134 /nfs/dbraw/zinc/02/71/34/221027134.db2.gz JISKGMIUMWMDJU-CYBMUJFWSA-N 0 0 368.418 3.900 20 5 FHBDRN NC(=O)c1ccc(CN2CCC[C@@H]2c2cccc(Cl)c2)c([N+](=O)[O-])c1 ZINC000053157941 221042964 /nfs/dbraw/zinc/04/29/64/221042964.db2.gz FZXICKDDCQBNNA-MRXNPFEDSA-N 0 0 359.813 3.684 20 5 FHBDRN CC[C@H](NC(=O)c1ccc([N+](=O)[O-])c(C)c1)c1ccc2c(c1)OCCO2 ZINC000055964293 221076646 /nfs/dbraw/zinc/07/66/46/221076646.db2.gz KDCGJONWCBADMJ-HNNXBMFYSA-N 0 0 356.378 3.556 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N(Cc1ccccc1)[C@@H](C)C1CC1 ZINC000059822988 221127319 /nfs/dbraw/zinc/12/73/19/221127319.db2.gz HVIAJUJFFSNJIJ-HNNXBMFYSA-N 0 0 374.462 3.893 20 5 FHBDRN O=c1ccc([N+](=O)[O-])cn1Cc1ccc(OCc2ccc(F)cc2)cc1 ZINC000063414609 221142463 /nfs/dbraw/zinc/14/24/63/221142463.db2.gz QONVUELCEDYBJP-UHFFFAOYSA-N 0 0 354.337 3.523 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H](c2ccccc2)OCC1(C)C ZINC000066512052 221244685 /nfs/dbraw/zinc/24/46/85/221244685.db2.gz AUIRTVHSMUYUHT-SFHVURJKSA-N 0 0 354.406 3.896 20 5 FHBDRN CCCC[C@]1(c2ccccc2)NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C1=O ZINC000068926592 221319222 /nfs/dbraw/zinc/31/92/22/221319222.db2.gz ZPHDSJKQOJMIPB-HXUWFJFHSA-N 0 0 367.405 3.732 20 5 FHBDRN Cc1c(C(=O)Nc2cc(Cl)ccc2F)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000070731622 221335064 /nfs/dbraw/zinc/33/50/64/221335064.db2.gz MZBVBQRBKAXHRM-UHFFFAOYSA-N 0 0 353.693 3.856 20 5 FHBDRN O=C(c1ccc(OC(F)(F)F)cc1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000071818340 221379888 /nfs/dbraw/zinc/37/98/88/221379888.db2.gz XCMPCIDUNISGMP-UHFFFAOYSA-N 0 0 352.268 3.696 20 5 FHBDRN COC(=O)c1ccc(OCc2ccc(Br)s2)c([N+](=O)[O-])c1 ZINC000071912188 221386704 /nfs/dbraw/zinc/38/67/04/221386704.db2.gz MWHMEPJCSXQVOJ-UHFFFAOYSA-N 0 0 372.196 3.784 20 5 FHBDRN CC(C)(C)[C@H](NC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)c1ccccc1 ZINC000071965858 221390565 /nfs/dbraw/zinc/39/05/65/221390565.db2.gz UQNJGPCEKSHBQS-QGZVFWFLSA-N 0 0 352.394 3.988 20 5 FHBDRN CC(C)[C@@H](C)N(C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)C1CC1 ZINC000106039924 132239953 /nfs/dbraw/zinc/23/99/53/132239953.db2.gz NQFYFLGTWGHMBV-OAHLLOKOSA-N 0 0 359.470 3.847 20 5 FHBDRN Cc1ccc(NC(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1C ZINC000043143926 132300894 /nfs/dbraw/zinc/30/08/94/132300894.db2.gz AOVMZJSXVAOLHW-UHFFFAOYSA-N 0 0 354.410 3.566 20 5 FHBDRN O=[N+]([O-])c1ccccc1N1CCN(Cc2csc(-c3ccco3)n2)CC1 ZINC000030003861 132374292 /nfs/dbraw/zinc/37/42/92/132374292.db2.gz XNNRHHDLWZTAMV-UHFFFAOYSA-N 0 0 370.434 3.634 20 5 FHBDRN O=C(c1ccn(-c2cccc([N+](=O)[O-])c2)n1)N1CCCc2cc(F)ccc21 ZINC000041838081 136121108 /nfs/dbraw/zinc/12/11/08/136121108.db2.gz GCRSLFMBQLCKRR-UHFFFAOYSA-N 0 0 366.352 3.513 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2noc(CNc3ccccc3OC(F)F)n2)cc1 ZINC000097703115 222207752 /nfs/dbraw/zinc/20/77/52/222207752.db2.gz WKGHTJWEKZINJB-UHFFFAOYSA-N 0 0 362.292 3.858 20 5 FHBDRN C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1CC(=O)Nc1cccc2c1N=S=N2 ZINC000110884548 222491798 /nfs/dbraw/zinc/49/17/98/222491798.db2.gz NOYUQYUBIZBKLB-JTQLQIEISA-N 0 0 369.406 3.711 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCC(=O)c2cccc(Br)c2)c1 ZINC000021614421 263384308 /nfs/dbraw/zinc/38/43/08/263384308.db2.gz XVXGXTSOYUPHJV-UHFFFAOYSA-N 0 0 350.168 3.927 20 5 FHBDRN COC(=O)c1cc(C(=O)N2CC[C@H](C)c3ccccc32)cc([N+](=O)[O-])c1 ZINC000031785166 536870715 /nfs/dbraw/zinc/87/07/15/536870715.db2.gz ALHUAMYDYWDSCQ-LBPRGKRZSA-N 0 0 354.362 3.535 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2C[C@H](c3cccc(F)c3)C2)c1 ZINC000568058295 567823483 /nfs/dbraw/zinc/82/34/83/567823483.db2.gz NHQLZLNNRRTICO-CTYIDZIISA-N 0 0 358.369 3.809 20 5 FHBDRN Cc1cc(C(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)nn1C(F)F ZINC000452866206 567829277 /nfs/dbraw/zinc/82/92/77/567829277.db2.gz XPYSTKSATCCAHA-CYBMUJFWSA-N 0 0 364.352 3.515 20 5 FHBDRN COCc1ccc(C(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000452862196 567834241 /nfs/dbraw/zinc/83/42/41/567834241.db2.gz DAUQAKDVAJFQAJ-GOSISDBHSA-N 0 0 354.406 3.761 20 5 FHBDRN Cc1cncc(CCC(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000452864370 567834412 /nfs/dbraw/zinc/83/44/12/567834412.db2.gz WEJDRFHHDVEXDU-SFHVURJKSA-N 0 0 353.422 3.637 20 5 FHBDRN C[C@H](CC(=O)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1)c1cccnc1 ZINC000452866248 567835959 /nfs/dbraw/zinc/83/59/59/567835959.db2.gz XTCMYYOMNVDDFN-QAPCUYQASA-N 0 0 353.422 3.890 20 5 FHBDRN O=C(c1c[nH]nc1-c1ccoc1)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452867106 567836861 /nfs/dbraw/zinc/83/68/61/567836861.db2.gz YCGDZSKMGYNOPZ-CQSZACIVSA-N 0 0 366.377 3.598 20 5 FHBDRN O=C([C@@H]1CC(=O)c2ccccc21)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452864357 567838796 /nfs/dbraw/zinc/83/87/96/567838796.db2.gz WDDMSWYDNUQDPU-HNAYVOBHSA-N 0 0 364.401 3.671 20 5 FHBDRN O=C(c1ccc2nsnc2c1)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452863658 567840042 /nfs/dbraw/zinc/84/00/42/567840042.db2.gz VRGBRCVOSWBPFN-AWEZNQCLSA-N 0 0 368.418 3.619 20 5 FHBDRN CC[C@@](C)(NCC(=O)Nc1cc([N+](=O)[O-])ccc1C)c1nc(C)cs1 ZINC000072865013 567840995 /nfs/dbraw/zinc/84/09/95/567840995.db2.gz UHYDFCZLJSSTNS-QGZVFWFLSA-N 0 0 362.455 3.522 20 5 FHBDRN O=C(COc1ccccc1F)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452863881 567844810 /nfs/dbraw/zinc/84/48/10/567844810.db2.gz FEMCJQXKIMDSMF-HNNXBMFYSA-N 0 0 358.369 3.519 20 5 FHBDRN O=C(c1cc(-c2ccco2)n[nH]1)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452873901 567860692 /nfs/dbraw/zinc/86/06/92/567860692.db2.gz KGZUKMRLSHXTEG-CQSZACIVSA-N 0 0 366.377 3.598 20 5 FHBDRN O=[N+]([O-])c1ccc(CCNc2cc(Cl)ccc2N2CCOCC2)cc1 ZINC000541801611 567865007 /nfs/dbraw/zinc/86/50/07/567865007.db2.gz GKYJXPNMFIRYSV-UHFFFAOYSA-N 0 0 361.829 3.739 20 5 FHBDRN CC(C)Oc1ncccc1C(=O)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452870297 567871894 /nfs/dbraw/zinc/87/18/94/567871894.db2.gz ZMWWQQHILGCORA-INIZCTEOSA-N 0 0 369.421 3.797 20 5 FHBDRN O=C(c1cc(-c2ccco2)n[nH]1)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452873900 567875098 /nfs/dbraw/zinc/87/50/98/567875098.db2.gz KGZUKMRLSHXTEG-AWEZNQCLSA-N 0 0 366.377 3.598 20 5 FHBDRN CC[C@@H](CNC(=O)CSc1ccccc1[N+](=O)[O-])CC(F)(F)F ZINC000412632829 567881057 /nfs/dbraw/zinc/88/10/57/567881057.db2.gz VAYPMPXBZSSUGI-SNVBAGLBSA-N 0 0 350.362 3.782 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCO[C@H](c3ccc(C(F)(F)F)cc3)C2)cn1 ZINC000568100594 567881674 /nfs/dbraw/zinc/88/16/74/567881674.db2.gz UEYZZEWDKMNIRH-AWEZNQCLSA-N 0 0 353.300 3.587 20 5 FHBDRN CC(C)(C)c1ccc(NC(=O)[C@@H]2CCN(CC(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000568121086 567884614 /nfs/dbraw/zinc/88/46/14/567884614.db2.gz HTZILUNAYQBXME-LLVKDONJSA-N 0 0 373.375 3.715 20 5 FHBDRN CCCN1CCN(C(=O)c2ccc(C)c([N+](=O)[O-])c2)c2ccc(F)cc21 ZINC000481394540 567889842 /nfs/dbraw/zinc/88/98/42/567889842.db2.gz WGDHUJUAPJZCSS-UHFFFAOYSA-N 0 0 357.385 3.919 20 5 FHBDRN CC[C@H](c1ccncc1)N(C)C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000128534917 567901429 /nfs/dbraw/zinc/90/14/29/567901429.db2.gz UGAYZLXYPQKUOI-QGZVFWFLSA-N 0 0 354.410 3.787 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)N(C)[C@H](C)c2ccc(F)cc2)c1 ZINC000541821449 567902664 /nfs/dbraw/zinc/90/26/64/567902664.db2.gz ZSXYGMQYVBETIK-CYBMUJFWSA-N 0 0 366.414 3.732 20 5 FHBDRN CCS[C@H]1CCCCN(S(=O)(=O)c2cc(C)cc([N+](=O)[O-])c2C)C1 ZINC000541822869 567904444 /nfs/dbraw/zinc/90/44/44/567904444.db2.gz UJRAGQCPLGPBDL-AWEZNQCLSA-N 0 0 372.512 3.508 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H]1c2ccc(F)cc2O[C@H]1C ZINC000517910419 567909125 /nfs/dbraw/zinc/90/91/25/567909125.db2.gz FTRBLLZEOYAKPC-BTDLBPIBSA-N 0 0 359.357 3.940 20 5 FHBDRN COc1ccc(CNc2ncc(Cc3ccccc3F)s2)cc1[N+](=O)[O-] ZINC000541821164 567909764 /nfs/dbraw/zinc/90/97/64/567909764.db2.gz RHKZBWPFTAIAKY-UHFFFAOYSA-N 0 0 373.409 3.824 20 5 FHBDRN CO[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)C[C@@H]1C ZINC000452895957 567911364 /nfs/dbraw/zinc/91/13/64/567911364.db2.gz SZOBMZNMZUZMNB-KSSFIOAISA-N 0 0 370.405 3.884 20 5 FHBDRN C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)CCC1(F)F ZINC000290985086 567925816 /nfs/dbraw/zinc/92/58/16/567925816.db2.gz RYZQGWUUTYRZCW-CYBMUJFWSA-N 0 0 367.396 3.702 20 5 FHBDRN C[C@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)c2ccccc21 ZINC000541825342 567930879 /nfs/dbraw/zinc/93/08/79/567930879.db2.gz UJKAUCZISNLVPU-LBPRGKRZSA-N 0 0 364.398 3.827 20 5 FHBDRN O=C(NCc1ncc(-c2ccccc2)o1)Nc1ccc([N+](=O)[O-])cc1F ZINC000541833824 567936906 /nfs/dbraw/zinc/93/69/06/567936906.db2.gz PDMOAJVPNBVEGF-UHFFFAOYSA-N 0 0 356.313 3.711 20 5 FHBDRN CN(CC(C)(C)CO)C(=O)c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1 ZINC000452911310 567944708 /nfs/dbraw/zinc/94/47/08/567944708.db2.gz VSJSKOBLLYRYQG-UHFFFAOYSA-N 0 0 374.462 3.837 20 5 FHBDRN COc1ccc(-c2cncc(-c3nc(CCC(C)(C)[N+](=O)[O-])no3)c2)cc1 ZINC000291011624 567955635 /nfs/dbraw/zinc/95/56/35/567955635.db2.gz BBKIIIHIXZVCQB-UHFFFAOYSA-N 0 0 368.393 3.795 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2nccn2C[C@H](O)COc2ccc(Cl)cc2)cc1 ZINC000051451932 567961276 /nfs/dbraw/zinc/96/12/76/567961276.db2.gz VNKBRPWWMSTBCJ-INIZCTEOSA-N 0 0 373.796 3.552 20 5 FHBDRN COc1cc(N[C@@H]2CCO[C@@H]2c2ccc(F)c(F)c2)c(F)cc1[N+](=O)[O-] ZINC000302034734 567965630 /nfs/dbraw/zinc/96/56/30/567965630.db2.gz UEASJYSKDUUIMX-CXAGYDPISA-N 0 0 368.311 3.963 20 5 FHBDRN COC(=O)C1CC[NH+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 ZINC000159202771 567970058 /nfs/dbraw/zinc/97/00/58/567970058.db2.gz BFRNQEPWTIUTGW-UHFFFAOYSA-N 0 0 360.435 3.708 20 5 FHBDRN CC[C@@H](CNC(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F)CC(F)(F)F ZINC000412643056 567976772 /nfs/dbraw/zinc/97/67/72/567976772.db2.gz ZKJOYDQUCKKSQU-NXEZZACHSA-N 0 0 350.312 3.932 20 5 FHBDRN Cc1c(CNC(=O)Cc2c[nH]c3ccc(Cl)cc23)cccc1[N+](=O)[O-] ZINC000481482676 567980049 /nfs/dbraw/zinc/98/00/49/567980049.db2.gz XMXNSIIVDLMHAG-UHFFFAOYSA-N 0 0 357.797 3.897 20 5 FHBDRN Cc1c(CNC(=O)CCc2cccc(OC(C)(C)C)n2)cccc1[N+](=O)[O-] ZINC000481477414 567980101 /nfs/dbraw/zinc/98/01/01/567980101.db2.gz HVXNXKBHMGRBHG-UHFFFAOYSA-N 0 0 371.437 3.725 20 5 FHBDRN Cc1c(CNC(=O)C[C@@H](C)C(=O)c2cccc(F)c2)cccc1[N+](=O)[O-] ZINC000481476489 567980625 /nfs/dbraw/zinc/98/06/25/567980625.db2.gz MIVDWIJGEKGAGG-GFCCVEGCSA-N 0 0 358.369 3.568 20 5 FHBDRN Cc1nc(-c2cccc(C)c2)[nH]c1C(=O)NCc1cccc([N+](=O)[O-])c1C ZINC000481499048 567996845 /nfs/dbraw/zinc/99/68/45/567996845.db2.gz BIEJTHLVRSHPSI-UHFFFAOYSA-N 0 0 364.405 3.840 20 5 FHBDRN Cc1c(CNC(=O)Cc2csc(-c3cccs3)n2)cccc1[N+](=O)[O-] ZINC000481501191 567997364 /nfs/dbraw/zinc/99/73/64/567997364.db2.gz HWYMFLGNLIULNJ-UHFFFAOYSA-N 0 0 373.459 3.947 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N[C@H](C[C@H]1CCOC1)c1ccccc1 ZINC000159213668 568005709 /nfs/dbraw/zinc/00/57/09/568005709.db2.gz ZJJYSIQWRKYQLU-YLJYHZDGSA-N 0 0 368.433 3.812 20 5 FHBDRN Cc1cc(=O)n(Cc2csc(-c3ccc(Cl)cc3)n2)cc1[N+](=O)[O-] ZINC000128562967 568015963 /nfs/dbraw/zinc/01/59/63/568015963.db2.gz HEQJTYFZMBFCCK-UHFFFAOYSA-N 0 0 361.810 3.890 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1)CN(c1nnc(Cc3ccc(F)cc3)s1)CC2 ZINC000302090574 568017368 /nfs/dbraw/zinc/01/73/68/568017368.db2.gz GSDNCXBHUGQPCA-UHFFFAOYSA-N 0 0 370.409 3.739 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N1CCN(Cc2ccsc2)CC1 ZINC000568334111 568025957 /nfs/dbraw/zinc/02/59/57/568025957.db2.gz OZHNUCMYZYABFS-UHFFFAOYSA-N 0 0 374.466 3.568 20 5 FHBDRN CCCN1CC(=O)N[C@@H]1c1ccc(Sc2ccc(C)cc2)c([N+](=O)[O-])c1 ZINC000602755711 568031636 /nfs/dbraw/zinc/03/16/36/568031636.db2.gz IYWLOHCJPGKQLH-IBGZPJMESA-N 0 0 371.462 3.895 20 5 FHBDRN C[C@@H](C(=O)NCCc1c[nH]c2ccc(F)cc12)c1ccc([N+](=O)[O-])cc1F ZINC000568496770 568037400 /nfs/dbraw/zinc/03/74/00/568037400.db2.gz YMGCDAMJXFOVEY-LLVKDONJSA-N 0 0 373.359 3.817 20 5 FHBDRN O=C(c1ccc([C@@H]2CCCOC2)cc1)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000541869611 568040954 /nfs/dbraw/zinc/04/09/54/568040954.db2.gz JENWYKOHFMVTLB-GOSISDBHSA-N 0 0 366.417 3.687 20 5 FHBDRN COc1cc(C(=O)N(C)c2ccc([N+](=O)[O-])nc2)ccc1OC1CCCC1 ZINC000568557933 568051302 /nfs/dbraw/zinc/05/13/02/568051302.db2.gz LOWMXGFNTAABRN-UHFFFAOYSA-N 0 0 371.393 3.596 20 5 FHBDRN O=C(c1cc2c(cc1[N+](=O)[O-])OCO2)N1CCC[C@H]1/C=C/c1ccccc1 ZINC000541875957 568058533 /nfs/dbraw/zinc/05/85/33/568058533.db2.gz ICVSSEIAPDOCLP-HVHJFMEUSA-N 0 0 366.373 3.642 20 5 FHBDRN CC(C)(CCc1noc(Cc2csc(-c3ccccc3)n2)n1)[N+](=O)[O-] ZINC000291125039 568059033 /nfs/dbraw/zinc/05/90/33/568059033.db2.gz VMFYDFYHMVQBAA-UHFFFAOYSA-N 0 0 358.423 3.772 20 5 FHBDRN CSc1ccc(C(=O)NC[C@H]2CCO[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000481582140 568060444 /nfs/dbraw/zinc/06/04/44/568060444.db2.gz QJPRBQSWVWSHJP-CRAIPNDOSA-N 0 0 372.446 3.824 20 5 FHBDRN Cc1noc2nc(C(C)C)cc(-c3nc(CCC(C)(C)[N+](=O)[O-])no3)c12 ZINC000291149152 568064011 /nfs/dbraw/zinc/06/40/11/568064011.db2.gz ZDNZOWJAMPMYPQ-UHFFFAOYSA-N 0 0 359.386 3.693 20 5 FHBDRN CCOc1ccc(C(=O)NC[C@H]2CCO[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000481596310 568064332 /nfs/dbraw/zinc/06/43/32/568064332.db2.gz JGHRGYNXABIWBO-VQIMIIECSA-N 0 0 370.405 3.501 20 5 FHBDRN Cc1ccccc1NCCC(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000568582912 568065123 /nfs/dbraw/zinc/06/51/23/568065123.db2.gz GSQUQIYNENXNSG-UHFFFAOYSA-N 0 0 366.421 3.545 20 5 FHBDRN C[C@@H](CN(C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000066934874 568068725 /nfs/dbraw/zinc/06/87/25/568068725.db2.gz XNNYLABQYIQAON-LBPRGKRZSA-N 0 0 368.842 3.672 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)NC[C@H]1CCC2(CCCCC2)O1 ZINC000481627868 568070486 /nfs/dbraw/zinc/07/04/86/568070486.db2.gz NVVSFPIOONMZDB-QGZVFWFLSA-N 0 0 371.437 3.548 20 5 FHBDRN CCN(C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2)c1ccc(Cl)cc1F ZINC000568588149 568070630 /nfs/dbraw/zinc/07/06/30/568070630.db2.gz NSABNKBECDGGCW-UHFFFAOYSA-N 0 0 366.732 3.783 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H]2CCC3(CCCCC3)O2)c1 ZINC000481644037 568080161 /nfs/dbraw/zinc/08/01/61/568080161.db2.gz LJMCDSJWOJDZLT-ZDUSSCGKSA-N 0 0 364.467 3.928 20 5 FHBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])Nc1ccc(F)c(F)c1 ZINC000481657409 568081480 /nfs/dbraw/zinc/08/14/80/568081480.db2.gz NMEKOCQDCJVUGF-UHFFFAOYSA-N 0 0 355.728 3.891 20 5 FHBDRN Cn1nc([N+](=O)[O-])cc1C(=O)N[C@@H](c1cccc(Cl)c1)C1CCCC1 ZINC000481671671 568083597 /nfs/dbraw/zinc/08/35/97/568083597.db2.gz QCMFQNGCUXPUBS-MRXNPFEDSA-N 0 0 362.817 3.643 20 5 FHBDRN COc1ccc(Br)cc1CN(C)c1nc(C)ccc1[N+](=O)[O-] ZINC000481688305 568088908 /nfs/dbraw/zinc/08/89/08/568088908.db2.gz AHOPADCZSILWHO-UHFFFAOYSA-N 0 0 366.215 3.706 20 5 FHBDRN O=[N+]([O-])c1ccc2oc(CN3CCC[C@]4(C3)OCc3ccccc34)nc2c1 ZINC000481686647 568089010 /nfs/dbraw/zinc/08/90/10/568089010.db2.gz JHDXVQTUXDIJIK-HXUWFJFHSA-N 0 0 365.389 3.758 20 5 FHBDRN COc1ccc(C)cc1NC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000481717261 568093794 /nfs/dbraw/zinc/09/37/94/568093794.db2.gz VUYCUSXRSODVFK-UHFFFAOYSA-N 0 0 363.801 3.929 20 5 FHBDRN Cc1c(CC(=O)N2CCC[C@@H]2C[C@H](O)c2cccs2)cccc1[N+](=O)[O-] ZINC000128638794 568096894 /nfs/dbraw/zinc/09/68/94/568096894.db2.gz PZQDOIPWUKYQMI-WBVHZDCISA-N 0 0 374.462 3.622 20 5 FHBDRN C[C@@H]1[C@@H](C(F)(F)F)CCCN1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000481738701 568099854 /nfs/dbraw/zinc/09/98/54/568099854.db2.gz FGOMTDQPCFBJCX-YGRLFVJLSA-N 0 0 360.332 3.624 20 5 FHBDRN O=[N+]([O-])c1cc(CSc2ccc3c(c2)OCCO3)c2c(c1)COCO2 ZINC000006916238 568113151 /nfs/dbraw/zinc/11/31/51/568113151.db2.gz XVMDJFMTJYRXJQ-UHFFFAOYSA-N 0 0 361.375 3.525 20 5 FHBDRN NC(=O)c1ccc(CN2CC=C(c3cccc(Cl)c3)CC2)c([N+](=O)[O-])c1 ZINC000481755631 568114075 /nfs/dbraw/zinc/11/40/75/568114075.db2.gz KYGAZELKSWGZIO-UHFFFAOYSA-N 0 0 371.824 3.636 20 5 FHBDRN O=C(N[C@H]1C[C@H](c2ccc(F)cc2)C1)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000481754652 568114245 /nfs/dbraw/zinc/11/42/45/568114245.db2.gz LIEUYTXLWOAVDQ-MQMHXKEQSA-N 0 0 353.353 3.891 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C(C)C)[C@H](CO)C(C)C ZINC000452980375 568124245 /nfs/dbraw/zinc/12/42/45/568124245.db2.gz INJCYBSAOSCICZ-WBVHZDCISA-N 0 0 368.499 3.726 20 5 FHBDRN O=C(Nc1cnc(-c2ccccc2)nc1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000128658686 568126940 /nfs/dbraw/zinc/12/69/40/568126940.db2.gz DOZNPZFCJCSWJI-UHFFFAOYSA-N 0 0 354.753 3.958 20 5 FHBDRN COC(=O)c1cccc(-c2noc(/C(C)=C/c3ccc([N+](=O)[O-])cc3)n2)c1 ZINC000568697847 568127425 /nfs/dbraw/zinc/12/74/25/568127425.db2.gz CMWDAGODTIXNBO-ZRDIBKRKSA-N 0 0 365.345 3.992 20 5 FHBDRN C[C@H](Oc1ccccc1NC(=O)c1cc([N+](=O)[O-])nn1C)c1ccccc1 ZINC000481795757 568127695 /nfs/dbraw/zinc/12/76/95/568127695.db2.gz OSLYITLUTVJYFV-ZDUSSCGKSA-N 0 0 366.377 3.721 20 5 FHBDRN COCC1(CNC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)CCCCC1 ZINC000568701813 568129436 /nfs/dbraw/zinc/12/94/36/568129436.db2.gz OQOKZOFDNLOAHQ-CQSZACIVSA-N 0 0 366.483 3.789 20 5 FHBDRN O=C(N[C@@H]1c2ccccc2CC12CCOCC2)c1cc(F)ccc1[N+](=O)[O-] ZINC000291454723 568144616 /nfs/dbraw/zinc/14/46/16/568144616.db2.gz OIPNLGQIVGRGLB-GOSISDBHSA-N 0 0 370.380 3.558 20 5 FHBDRN COC(=O)c1cnc(NC(=O)c2cc3ccccc3c3cccnc23)s1 ZINC000603733397 568145786 /nfs/dbraw/zinc/14/57/86/568145786.db2.gz UXWJIPODRDPTRI-UHFFFAOYSA-N 0 0 363.398 3.883 20 5 FHBDRN C[C@H](Nc1ccc(NC(=O)c2cc([N+](=O)[O-])nn2C)cc1)c1ccccc1 ZINC000481883306 568152092 /nfs/dbraw/zinc/15/20/92/568152092.db2.gz IUDFFBWIEDJOGM-ZDUSSCGKSA-N 0 0 365.393 3.754 20 5 FHBDRN COc1cc(C(=O)Nc2cnc(C(F)(F)F)cc2C)cc([N+](=O)[O-])c1C ZINC000464668776 568161926 /nfs/dbraw/zinc/16/19/26/568161926.db2.gz YJDGOMNAOVTBDA-UHFFFAOYSA-N 0 0 369.299 3.886 20 5 FHBDRN O=C(CSc1ccccc1[N+](=O)[O-])NC[C@H]1CCC2(CCCCC2)O1 ZINC000481853687 568162878 /nfs/dbraw/zinc/16/28/78/568162878.db2.gz IIQDFZCKVCLKAO-CQSZACIVSA-N 0 0 364.467 3.685 20 5 FHBDRN CCCC(=O)Nc1ccc(C(=O)COc2cc([N+](=O)[O-])ccc2OC)cc1 ZINC000007091046 568167907 /nfs/dbraw/zinc/16/79/07/568167907.db2.gz TTYAVMQWGVNZJW-UHFFFAOYSA-N 0 0 372.377 3.604 20 5 FHBDRN O=C(NCc1ccccc1N1CCCCC1)Nc1ccc([N+](=O)[O-])cc1 ZINC000481902554 568168431 /nfs/dbraw/zinc/16/84/31/568168431.db2.gz UDGLSBDMJHSQMS-UHFFFAOYSA-N 0 0 354.410 3.907 20 5 FHBDRN Cc1cccc(C(=O)N2CCN(Cc3ccccc3Cl)CC2)c1[N+](=O)[O-] ZINC000481914943 568182188 /nfs/dbraw/zinc/18/21/88/568182188.db2.gz CASGHHBPMXBKII-UHFFFAOYSA-N 0 0 373.840 3.515 20 5 FHBDRN O=C(c1cc(OCc2ccccc2)ccc1[N+](=O)[O-])N1CC[C@@H]1C1CC1 ZINC000452996207 568182386 /nfs/dbraw/zinc/18/23/86/568182386.db2.gz SVFGHQFIPZGWSP-GOSISDBHSA-N 0 0 352.390 3.798 20 5 FHBDRN CC(C)[C@H](C)NC(=O)COc1ccc(Cc2ccccc2)cc1[N+](=O)[O-] ZINC000481954330 568196883 /nfs/dbraw/zinc/19/68/83/568196883.db2.gz BCAPXKZUPSADBD-HNNXBMFYSA-N 0 0 356.422 3.725 20 5 FHBDRN COc1ccc(CNC(=O)COc2ccc(C(C)(C)C)cc2)cc1[N+](=O)[O-] ZINC000604018450 568199566 /nfs/dbraw/zinc/19/95/66/568199566.db2.gz HMFFWMLKMBZSGZ-UHFFFAOYSA-N 0 0 372.421 3.596 20 5 FHBDRN Cc1cc(C2CC2)nc(NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)n1 ZINC000291582327 568216423 /nfs/dbraw/zinc/21/64/23/568216423.db2.gz KMRNGJRPBNRZEI-UHFFFAOYSA-N 0 0 366.299 3.842 20 5 FHBDRN CCn1c(C)nc([N+](=O)[O-])c1N1CC[C@@](F)(c2cc(C)cc(F)c2)C1 ZINC000568793245 568219478 /nfs/dbraw/zinc/21/94/78/568219478.db2.gz DDTPRKSVEJKPRA-KRWDZBQOSA-N 0 0 350.369 3.642 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC1(c2ccc(Cl)cc2)CC1 ZINC000482008115 568226548 /nfs/dbraw/zinc/22/65/48/568226548.db2.gz IHVQGQZECOWJLQ-UHFFFAOYSA-N 0 0 366.826 3.524 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NCC(=O)N(Cc1ccc(C)o1)C1CC1 ZINC000568820645 568228581 /nfs/dbraw/zinc/22/85/81/568228581.db2.gz FWBJPOSFGKTKLY-UHFFFAOYSA-N 0 0 357.410 3.662 20 5 FHBDRN O=C(Nc1ccncc1[N+](=O)[O-])NC1(c2c(Cl)cccc2Cl)CC1 ZINC000541924093 568233085 /nfs/dbraw/zinc/23/30/85/568233085.db2.gz MBCUKLSYCPBOOK-UHFFFAOYSA-N 0 0 367.192 3.529 20 5 FHBDRN COc1cc(NC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)cc(OC)c1 ZINC000007474542 568234785 /nfs/dbraw/zinc/23/47/85/568234785.db2.gz OZCWBYYLCXYEIX-NSHDSACASA-N 0 0 362.407 3.731 20 5 FHBDRN COc1cc(Cc2noc([C@@H]3CCc4ccccc4O3)n2)ccc1[N+](=O)[O-] ZINC000568858762 568237274 /nfs/dbraw/zinc/23/72/74/568237274.db2.gz RFXFMHVZGFGRTD-INIZCTEOSA-N 0 0 367.361 3.644 20 5 FHBDRN C[C@@H]1[C@H](Cc2ccccc2)CCN1c1cc2nc[nH]c(=O)c2cc1[N+](=O)[O-] ZINC000568864393 568238612 /nfs/dbraw/zinc/23/86/12/568238612.db2.gz JIOBEAQGDCFCKI-HIFRSBDPSA-N 0 0 364.405 3.701 20 5 FHBDRN O=C(CCc1ccc(Br)cc1)NCc1ccccc1[N+](=O)[O-] ZINC000482061015 568248134 /nfs/dbraw/zinc/24/81/34/568248134.db2.gz LYIDVHFRJXBYJV-UHFFFAOYSA-N 0 0 363.211 3.606 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN(C)Cc1c(F)cccc1F ZINC000568888291 568248223 /nfs/dbraw/zinc/24/82/23/568248223.db2.gz IEJCTCKHTTZVGO-UHFFFAOYSA-N 0 0 363.364 3.642 20 5 FHBDRN CC(C)[C@@H]1C[C@@H](CC(=O)Nc2ccnn2-c2ccc([N+](=O)[O-])cc2)CCO1 ZINC000541930237 568250774 /nfs/dbraw/zinc/25/07/74/568250774.db2.gz HJCOOXVFSCWLBP-YOEHRIQHSA-N 0 0 372.425 3.560 20 5 FHBDRN CCOCCOCc1cccc(CNc2nc(C)cc(C)c2[N+](=O)[O-])c1 ZINC000541932269 568250827 /nfs/dbraw/zinc/25/08/27/568250827.db2.gz MAXLZBOGSSZQGE-UHFFFAOYSA-N 0 0 359.426 3.772 20 5 FHBDRN O=C(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccc(C2=CCCC2)cc1 ZINC000568922600 568252516 /nfs/dbraw/zinc/25/25/16/568252516.db2.gz UYYDWDIOSDKBTF-UHFFFAOYSA-N 0 0 362.389 3.968 20 5 FHBDRN O=C(Nc1ccc2nnc(C3CCC3)n2c1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000190299567 568252720 /nfs/dbraw/zinc/25/27/20/568252720.db2.gz ABSAWCCMCDWIMS-UHFFFAOYSA-N 0 0 371.784 3.811 20 5 FHBDRN COc1cc(C(=O)N[C@H]2CCO[C@H](c3ccccc3)C2)cc([N+](=O)[O-])c1C ZINC000190294592 568252738 /nfs/dbraw/zinc/25/27/38/568252738.db2.gz WHVVBDLLGDEMQI-LPHOPBHVSA-N 0 0 370.405 3.562 20 5 FHBDRN COc1ccc(N(C)C(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)cc1F ZINC000541924305 568252777 /nfs/dbraw/zinc/25/27/77/568252777.db2.gz YDYHHYQCWHDCHF-UHFFFAOYSA-N 0 0 370.283 3.621 20 5 FHBDRN CC(C)C[C@H](NC(=O)C(C)(C)C)c1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000453020693 568254687 /nfs/dbraw/zinc/25/46/87/568254687.db2.gz DUNHOGASFNDDEC-AWEZNQCLSA-N 0 0 360.414 3.894 20 5 FHBDRN O=C(N[C@]1(C(F)(F)F)CCc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000541936674 568256816 /nfs/dbraw/zinc/25/68/16/568256816.db2.gz WFYZFJRZEOPTEE-MRXNPFEDSA-N 0 0 350.296 3.729 20 5 FHBDRN COc1ccc2c(c1)C1(CC1)CN(C(=O)Nc1cc(F)cc([N+](=O)[O-])c1)C2 ZINC000568970668 568258693 /nfs/dbraw/zinc/25/86/93/568258693.db2.gz AAXVGLJJTWJIIZ-UHFFFAOYSA-N 0 0 371.368 3.822 20 5 FHBDRN CC(C)(C)c1ncc(NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)cn1 ZINC000136921707 568258887 /nfs/dbraw/zinc/25/88/87/568258887.db2.gz LJDMOVWYXRKSOF-UHFFFAOYSA-N 0 0 369.425 3.879 20 5 FHBDRN CC(C)C[C@@H]1C[C@H](NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)CCO1 ZINC000541938522 568259358 /nfs/dbraw/zinc/25/93/58/568259358.db2.gz FQFZVPBVWPHDDN-CHWSQXEVSA-N 0 0 372.368 3.520 20 5 FHBDRN CC(C)C[C@H]1C[C@@H](NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)CCO1 ZINC000541938525 568261102 /nfs/dbraw/zinc/26/11/02/568261102.db2.gz FQFZVPBVWPHDDN-STQMWFEESA-N 0 0 372.368 3.520 20 5 FHBDRN COc1cccc(C(=O)Nc2nc(-c3ccccc3F)co2)c1[N+](=O)[O-] ZINC000482128449 568268773 /nfs/dbraw/zinc/26/87/73/568268773.db2.gz QYQGWJYIONJHIF-UHFFFAOYSA-N 0 0 357.297 3.650 20 5 FHBDRN O=C(c1ccc(OC(F)F)c([N+](=O)[O-])c1)N1CCc2cc(F)ccc2C1 ZINC000541966495 568269518 /nfs/dbraw/zinc/26/95/18/568269518.db2.gz JHQFYTJKOCALOD-UHFFFAOYSA-N 0 0 366.295 3.534 20 5 FHBDRN Cc1cc(Br)cc([N+](=O)[O-])c1OCc1nnc(C2CC2)s1 ZINC000569075530 568272541 /nfs/dbraw/zinc/27/25/41/568272541.db2.gz DVOLYWJIHMXAGO-UHFFFAOYSA-N 0 0 370.228 3.974 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CSc1nnc(NCC(C)C)s1 ZINC000023226883 568273585 /nfs/dbraw/zinc/27/35/85/568273585.db2.gz BTQPYJLXWJEUOS-UHFFFAOYSA-N 0 0 354.457 3.815 20 5 FHBDRN CCC1(CO)CCN(C(=O)c2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC1 ZINC000291699640 568273868 /nfs/dbraw/zinc/27/38/68/568273868.db2.gz OTKUNSYTJXHRCF-UHFFFAOYSA-N 0 0 361.225 3.526 20 5 FHBDRN Cc1ccc(-c2noc(C3CCC(NC(=O)C4CC4)CC3)n2)cc1[N+](=O)[O-] ZINC000584685908 568275317 /nfs/dbraw/zinc/27/53/17/568275317.db2.gz VRJKVLAVWAYNTA-UHFFFAOYSA-N 0 0 370.409 3.506 20 5 FHBDRN O=C(Nc1ccc2[nH]ccc2c1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000265068926 568277948 /nfs/dbraw/zinc/27/79/48/568277948.db2.gz UXTIWISLHYXBCP-UHFFFAOYSA-N 0 0 364.405 3.931 20 5 FHBDRN CC(C)(NCc1cncc(Br)c1)c1ccccc1[N+](=O)[O-] ZINC000291731785 568283173 /nfs/dbraw/zinc/28/31/73/568283173.db2.gz NXEKYVNICQEJER-UHFFFAOYSA-N 0 0 350.216 3.777 20 5 FHBDRN Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)NCc1cc([O-])ccc1[N+](=O)[O-] ZINC000569128270 568285396 /nfs/dbraw/zinc/28/53/96/568285396.db2.gz HSPWLPGELKPJRW-VIFPVBQESA-N 0 0 372.347 3.527 20 5 FHBDRN O=C(Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)c1ccc2nccn2c1 ZINC000482150135 568285646 /nfs/dbraw/zinc/28/56/46/568285646.db2.gz CQJWUIHWDJTGOT-UHFFFAOYSA-N 0 0 365.374 3.618 20 5 FHBDRN C[C@]1(c2ccccc2)CCCN(c2cccc(C(N)=O)c2[N+](=O)[O-])CC1 ZINC000569133014 568285784 /nfs/dbraw/zinc/28/57/84/568285784.db2.gz AJOCCEOXDIKVKF-FQEVSTJZSA-N 0 0 353.422 3.642 20 5 FHBDRN O=[N+]([O-])c1ccc(CSc2ncc(Br)cc2[N+](=O)[O-])cc1 ZINC000159427136 568293482 /nfs/dbraw/zinc/29/34/82/568293482.db2.gz KTABQIVTQFVCIV-UHFFFAOYSA-N 0 0 370.184 3.953 20 5 FHBDRN CCN(C(=O)c1c(C)cc(Cl)cc1[N+](=O)[O-])[C@H]1CCOC(C)(C)C1 ZINC000291742916 568293830 /nfs/dbraw/zinc/29/38/30/568293830.db2.gz XSJPPZRAILBEIM-ZDUSSCGKSA-N 0 0 354.834 3.976 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N[C@H](CC(C)(C)C)C(F)(F)F)c1[N+](=O)[O-] ZINC000482160599 568297433 /nfs/dbraw/zinc/29/74/33/568297433.db2.gz UBUYSRLXGLLHIF-MRVPVSSYSA-N 0 0 350.341 3.538 20 5 FHBDRN C[C@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1F)[C@@H]1OCCc2sccc21 ZINC000291761759 568298243 /nfs/dbraw/zinc/29/82/43/568298243.db2.gz LRABUPHCLBNLFB-VFZGTOFNSA-N 0 0 365.386 3.619 20 5 FHBDRN O=C(Nc1ccc(O)c2ccccc12)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000604474474 568299000 /nfs/dbraw/zinc/29/90/00/568299000.db2.gz YXCKTIHSUURMIS-UHFFFAOYSA-N 0 0 374.356 3.892 20 5 FHBDRN COc1ccc(CCNC(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)cc1 ZINC000302107894 568301466 /nfs/dbraw/zinc/30/14/66/568301466.db2.gz JHTAWQCIXOHITB-UHFFFAOYSA-N 0 0 356.422 3.873 20 5 FHBDRN CCc1ccc(C(=O)NC[C@](C)(Cc2ccccc2)[C@H](C)O)cc1[N+](=O)[O-] ZINC000482179436 568302041 /nfs/dbraw/zinc/30/20/41/568302041.db2.gz KDEFAMSUNSITRT-BTYIYWSLSA-N 0 0 370.449 3.517 20 5 FHBDRN CC(C)C[C@@H]1OCCC[C@H]1NC(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000482180730 568302191 /nfs/dbraw/zinc/30/21/91/568302191.db2.gz LQPXGQYRIJHYML-XKQJLSEDSA-N 0 0 366.483 3.785 20 5 FHBDRN C[C@H](C(=O)Nc1ccnn1CCc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000569182214 568304966 /nfs/dbraw/zinc/30/49/66/568304966.db2.gz LMMPKZIHNCMXAG-HNNXBMFYSA-N 0 0 364.405 3.776 20 5 FHBDRN CSCc1cccc(NC(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)c1 ZINC000569191350 568307020 /nfs/dbraw/zinc/30/70/20/568307020.db2.gz IOAMFGBUCIHNAN-UHFFFAOYSA-N 0 0 371.422 3.656 20 5 FHBDRN O=C(N[C@@H]1[C@@H]2CCO[C@@H]2C12CCC2)c1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000291784650 568309491 /nfs/dbraw/zinc/30/94/91/568309491.db2.gz QGYGJWSBDXYAHH-FZZIBODNSA-N 0 0 371.220 3.589 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H]2CCCC[C@@H]2C(F)(F)F)c1 ZINC000482210694 568312800 /nfs/dbraw/zinc/31/28/00/568312800.db2.gz NHXXMSDGFZFIKV-GWCFXTLKSA-N 0 0 360.332 3.702 20 5 FHBDRN COc1ccccc1N(C(=O)c1cc(OC)c(OC)c([N+](=O)[O-])c1)C(C)C ZINC000291796763 568316444 /nfs/dbraw/zinc/31/64/44/568316444.db2.gz WSVNTEGERSYWGA-UHFFFAOYSA-N 0 0 374.393 3.676 20 5 FHBDRN CCc1coc(NC(=O)c2ccc(N3C[C@H](C)C[C@H](C)C3)c([N+](=O)[O-])c2)n1 ZINC000569234487 568317094 /nfs/dbraw/zinc/31/70/94/568317094.db2.gz ANUXYVTUTBXGID-BETUJISGSA-N 0 0 372.425 3.880 20 5 FHBDRN COc1cccc(COCc2noc(/C=C\c3ccccc3[N+](=O)[O-])n2)c1 ZINC000609475238 568320504 /nfs/dbraw/zinc/32/05/04/568320504.db2.gz UAJOEJHRGLEUTH-KTKRTIGZSA-N 0 0 367.361 3.874 20 5 FHBDRN COc1ccc(-c2cnc(NC(=O)c3cccc(C)c3[N+](=O)[O-])n2C)cc1 ZINC000569266932 568323339 /nfs/dbraw/zinc/32/33/39/568323339.db2.gz OKUZYFBQSFHASK-UHFFFAOYSA-N 0 0 366.377 3.565 20 5 FHBDRN COc1cccc(-c2nc(-c3ccc4c(n3)CCCC4)no2)c1[N+](=O)[O-] ZINC000569273394 568324767 /nfs/dbraw/zinc/32/47/67/568324767.db2.gz SWWNTEOWSGGLFX-UHFFFAOYSA-N 0 0 352.350 3.594 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)Nc1nc2c(cccc2Cl)[nH]1 ZINC000569274021 568325550 /nfs/dbraw/zinc/32/55/50/568325550.db2.gz ZJBYNQQRKNZWGA-UHFFFAOYSA-N 0 0 365.176 3.959 20 5 FHBDRN CC(C)n1cc(NC(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cn1 ZINC000584703447 568349350 /nfs/dbraw/zinc/34/93/50/568349350.db2.gz OPEFBZQZMYLMBC-OAHLLOKOSA-N 0 0 357.414 3.784 20 5 FHBDRN Cn1cc([N+](=O)[O-])cc1C(=O)Nc1ccnc(Oc2ccc(F)cc2F)c1 ZINC000569313039 568367861 /nfs/dbraw/zinc/36/78/61/568367861.db2.gz FNXQOOFYYHXWEB-UHFFFAOYSA-N 0 0 374.303 3.651 20 5 FHBDRN Cc1cc([C@H](C)NC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)c(C)s1 ZINC000032167183 568368403 /nfs/dbraw/zinc/36/84/03/568368403.db2.gz YHHPGXBAQDSFCB-LBPRGKRZSA-N 0 0 370.434 3.950 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)CSc1ccc(F)c(F)c1 ZINC000005565068 568390879 /nfs/dbraw/zinc/39/08/79/568390879.db2.gz RZWSYSNSCPTNTA-UHFFFAOYSA-N 0 0 354.334 3.612 20 5 FHBDRN CSc1ccc(C(=O)Nc2cccc(Cn3cccn3)c2)cc1[N+](=O)[O-] ZINC000032467291 568391142 /nfs/dbraw/zinc/39/11/42/568391142.db2.gz STBDQQUNQXVGJH-UHFFFAOYSA-N 0 0 368.418 3.814 20 5 FHBDRN CC(C)(NC(=O)C1CCC(OC(F)F)CC1)c1ccccc1[N+](=O)[O-] ZINC000569339813 568395351 /nfs/dbraw/zinc/39/53/51/568395351.db2.gz NSUGRODBGAIQCE-UHFFFAOYSA-N 0 0 356.369 3.744 20 5 FHBDRN O=C(Nc1cc2c(cc1[N+](=O)[O-])OCCCO2)[C@H]1CC[C@@H](C(F)(F)F)C1 ZINC000569340925 568395368 /nfs/dbraw/zinc/39/53/68/568395368.db2.gz MRWCMLLYMNHQFY-VHSXEESVSA-N 0 0 374.315 3.673 20 5 FHBDRN C[C@H]1CN(C(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)CC2(CCC2)O1 ZINC000569342619 568395456 /nfs/dbraw/zinc/39/54/56/568395456.db2.gz FHEOREIRMXXXRR-LBPRGKRZSA-N 0 0 373.434 3.502 20 5 FHBDRN CCc1nc([C@@H]2CCCN(C(=O)Nc3cc(C)c([N+](=O)[O-])cc3C)C2)no1 ZINC000365274170 568397078 /nfs/dbraw/zinc/39/70/78/568397078.db2.gz AKAVBVKXFLEMDC-CYBMUJFWSA-N 0 0 373.413 3.569 20 5 FHBDRN COCc1ccc([C@@H]2CCCN2c2ccc([N+](=O)[O-])c(OC(C)C)n2)o1 ZINC000569472138 568399541 /nfs/dbraw/zinc/39/95/41/568399541.db2.gz NPKDDZZSJRHTDM-AWEZNQCLSA-N 0 0 361.398 3.858 20 5 FHBDRN Cc1cc(/C=C\c2nc(-c3c([N+](=O)[O-])ncn3C)no2)ccc1OC(C)C ZINC000569390727 568400227 /nfs/dbraw/zinc/40/02/27/568400227.db2.gz RQEWOSJZPWWDRW-VURMDHGXSA-N 0 0 369.381 3.644 20 5 FHBDRN C[C@@H](CN(C(=O)[C@H](C)c1cccc([N+](=O)[O-])c1)[C@@H](C)CO)c1ccccc1 ZINC000569423641 568401854 /nfs/dbraw/zinc/40/18/54/568401854.db2.gz KAXORHGCIUMXAW-YESZJQIVSA-N 0 0 370.449 3.711 20 5 FHBDRN O=C(NCCOc1ccc([N+](=O)[O-])cc1)N1CC2(CCC2)[C@@H]1c1ccco1 ZINC000569561368 568407634 /nfs/dbraw/zinc/40/76/34/568407634.db2.gz 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COc1ccccc1[C@@H](CO)N[C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000569908212 568435766 /nfs/dbraw/zinc/43/57/66/568435766.db2.gz SLRKULOYJYWWDY-QZTJIDSGSA-N 0 0 356.422 3.649 20 5 FHBDRN CC1(C)CN(c2ccc(Br)cc2[N+](=O)[O-])[C@H]1[C@H]1CCCO1 ZINC000569978551 568445572 /nfs/dbraw/zinc/44/55/72/568445572.db2.gz CKDXHGFPVAMBOU-KGLIPLIRSA-N 0 0 355.232 3.751 20 5 FHBDRN CCCOCc1ccccc1CNC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000569998296 568448005 /nfs/dbraw/zinc/44/80/05/568448005.db2.gz OKFJKSMJIUGMGE-OAHLLOKOSA-N 0 0 356.422 3.941 20 5 FHBDRN O=C1CCCc2cc(Oc3ncnc4cccc([N+](=O)[O-])c43)ccc2N1 ZINC000570008164 568449337 /nfs/dbraw/zinc/44/93/37/568449337.db2.gz HUZYYKMJSTWDIS-UHFFFAOYSA-N 0 0 350.334 3.605 20 5 FHBDRN C[C@@H](N[C@H]1CCc2c1cccc2[N+](=O)[O-])c1noc(-c2ccccc2)n1 ZINC000570105917 568451338 /nfs/dbraw/zinc/45/13/38/568451338.db2.gz FMNJKVFHOFNGOF-WBMJQRKESA-N 0 0 350.378 3.983 20 5 FHBDRN O=[N+]([O-])c1cc(F)ccc1-c1nc(Cc2ccc(C(F)(F)F)cn2)no1 ZINC000570093588 568458550 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ZINC000176411416 937136501 /nfs/dbraw/zinc/13/65/01/937136501.db2.gz QJLXPGLRDIQMSI-KKSFZXQISA-N 0 0 370.449 3.588 20 5 FHBDRN CN(C[C@@H]1CC=CCC1)C(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000583117609 937138049 /nfs/dbraw/zinc/13/80/49/937138049.db2.gz YQEDDZCOSDIOHO-CQSZACIVSA-N 0 0 356.426 3.616 20 5 FHBDRN Cc1ccc(-c2nc(C(=O)Nc3ccc([N+](=O)[O-])c(C)n3)cs2)cc1 ZINC000133625119 927153490 /nfs/dbraw/zinc/15/34/90/927153490.db2.gz PLEYKVTXIPADAN-UHFFFAOYSA-N 0 0 354.391 3.982 20 5 FHBDRN COc1ccc(CN[C@@H](C)c2nc(C(F)(F)F)cs2)cc1[N+](=O)[O-] ZINC000274568091 927156486 /nfs/dbraw/zinc/15/64/86/927156486.db2.gz HCUNLQJXWWHFOZ-QMMMGPOBSA-N 0 0 361.345 3.930 20 5 FHBDRN CC(C)CCOc1cccc(NC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)c1 ZINC000122070858 937142622 /nfs/dbraw/zinc/14/26/22/937142622.db2.gz KGNAFOVLPXNYLB-UHFFFAOYSA-N 0 0 371.393 3.597 20 5 FHBDRN O=[N+]([O-])c1cc2c(ncnc2NCc2csc(-c3ccco3)n2)s1 ZINC000557621768 927215758 /nfs/dbraw/zinc/21/57/58/927215758.db2.gz RUFQSPOODWDSCD-UHFFFAOYSA-N 0 0 359.392 3.928 20 5 FHBDRN Cc1nc(NC(=O)c2cccc(OCc3cscn3)c2)ccc1[N+](=O)[O-] ZINC000133642484 927217840 /nfs/dbraw/zinc/21/78/40/927217840.db2.gz JDCGAILLJMBDIC-UHFFFAOYSA-N 0 0 370.390 3.586 20 5 FHBDRN Cc1cc(Cl)c(OC[C@H](O)COc2ccccc2[N+](=O)[O-])cc1F ZINC000557648895 927276012 /nfs/dbraw/zinc/27/60/12/927276012.db2.gz CDADVSFEWWBOFN-LLVKDONJSA-N 0 0 355.749 3.514 20 5 FHBDRN O=C(C1CCN(c2ccc([N+](=O)[O-])c(OC(F)F)c2)CC1)C(F)(F)F ZINC000274627556 927282084 /nfs/dbraw/zinc/28/20/84/927282084.db2.gz MPMMFFGNJAXMQD-UHFFFAOYSA-N 0 0 368.258 3.544 20 5 FHBDRN COc1ccc(CN2C[C@@H](C)O[C@@H](c3ccc(F)cc3)C2)cc1[N+](=O)[O-] ZINC000126834933 927290869 /nfs/dbraw/zinc/29/08/69/927290869.db2.gz MTEYDZYWHWLJNZ-BFUOFWGJSA-N 0 0 360.385 3.705 20 5 FHBDRN CO[C@H](CNC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-])C1CCCCC1 ZINC000598439088 927305830 /nfs/dbraw/zinc/30/58/30/927305830.db2.gz FIHSXUZIMLXZFM-OAHLLOKOSA-N 0 0 374.359 3.939 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N1CC[C@@H](Cc2ccccc2)C1 ZINC000610178537 927318231 /nfs/dbraw/zinc/31/82/31/927318231.db2.gz GKNMQTNWNLUDIQ-HNNXBMFYSA-N 0 0 358.825 3.882 20 5 FHBDRN O=C(Cc1cccc([N+](=O)[O-])c1)N1C[C@@H]2CCCCN2c2ccccc21 ZINC000579763036 927325672 /nfs/dbraw/zinc/32/56/72/927325672.db2.gz YXVLHGUSSTXQDT-KRWDZBQOSA-N 0 0 351.406 3.543 20 5 FHBDRN CC(C)(C)C[C@@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)c1ccc(Cl)cc1 ZINC000610178249 927332867 /nfs/dbraw/zinc/33/28/67/927332867.db2.gz PNTAPLRDFITZHG-OAHLLOKOSA-N 0 0 364.833 3.738 20 5 FHBDRN COc1ccccc1[C@@]1(C)C[C@@H]1NC(=O)c1cc(SC)ccc1[N+](=O)[O-] ZINC000610181625 927400167 /nfs/dbraw/zinc/40/01/67/927400167.db2.gz FEHJHTCEHNFMLV-PKOBYXMFSA-N 0 0 372.446 3.785 20 5 FHBDRN COc1ccccc1[C@@]1(C)C[C@H]1NC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000610181641 927400205 /nfs/dbraw/zinc/40/02/05/927400205.db2.gz GHIUPULTRBGZOP-WIYYLYMNSA-N 0 0 368.433 3.727 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)N1CCC2(C1)CCOCC2 ZINC000274659129 927440753 /nfs/dbraw/zinc/44/07/53/927440753.db2.gz PDMWMIVXULTJHO-UHFFFAOYSA-N 0 0 373.331 3.648 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N1C[C@@H](C)[C@H]1c1ccccc1 ZINC000175290239 927456823 /nfs/dbraw/zinc/45/68/23/927456823.db2.gz HFHGIRKLBFKGOQ-ACJLOTCBSA-N 0 0 355.394 3.506 20 5 FHBDRN CSc1cccc(C(=O)N[C@H](C)[C@H]2COc3ccccc32)c1[N+](=O)[O-] ZINC000186890844 927468508 /nfs/dbraw/zinc/46/85/08/927468508.db2.gz LACVIWXMXGSMJT-BXUZGUMPSA-N 0 0 358.419 3.611 20 5 FHBDRN CCc1nn(C)cc1NC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000274678204 927470240 /nfs/dbraw/zinc/47/02/40/927470240.db2.gz VVDHMEOQAOCOOZ-UHFFFAOYSA-N 0 0 357.292 3.554 20 5 FHBDRN Cc1c(C(=O)Nc2ncc(C3(O)CCCCC3)s2)cccc1[N+](=O)[O-] ZINC000274676252 927482473 /nfs/dbraw/zinc/48/24/73/927482473.db2.gz IUTXULBHPRMTBM-UHFFFAOYSA-N 0 0 361.423 3.764 20 5 FHBDRN C[C@H](C(=O)NCc1nc(-c2ccncc2)cs1)c1cccc([N+](=O)[O-])c1 ZINC000579789259 927518733 /nfs/dbraw/zinc/51/87/33/927518733.db2.gz WWIUBMMJGFIDFD-LBPRGKRZSA-N 0 0 368.418 3.533 20 5 FHBDRN COC(=O)CCSc1cccc(NC(=O)c2ccc([N+](=O)[O-])c(C)c2)c1 ZINC000535944311 937181438 /nfs/dbraw/zinc/18/14/38/937181438.db2.gz QBHPTPJEXGYFPY-UHFFFAOYSA-N 0 0 374.418 3.811 20 5 FHBDRN CCCc1n[nH]c(C(=O)NCCCCCc2ccc(F)cc2)c1[N+](=O)[O-] ZINC000186962780 927616748 /nfs/dbraw/zinc/61/67/48/927616748.db2.gz WLEFUTNFLWQGTO-UHFFFAOYSA-N 0 0 362.405 3.552 20 5 FHBDRN C[C@@H]1C[C@H](c2ccccc2)[C@@H](C)N1C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000610186914 927632223 /nfs/dbraw/zinc/63/22/23/927632223.db2.gz QBDYFWRBQDHWST-NFAWXSAZSA-N 0 0 368.389 3.730 20 5 FHBDRN C[C@@H]1C[C@@H](c2ccccc2)[C@H](C)N1C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000610186916 927632325 /nfs/dbraw/zinc/63/23/25/927632325.db2.gz QBDYFWRBQDHWST-VNHYZAJKSA-N 0 0 368.389 3.730 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CCC[C@@H]1C[C@H](O)c1ccco1 ZINC000162574851 937183182 /nfs/dbraw/zinc/18/31/82/937183182.db2.gz SPLYAJLCYOXJRW-CJNGLKHVSA-N 0 0 359.382 3.616 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc3[nH]c(C)cc(=O)c3c2)c1 ZINC000430189708 927726979 /nfs/dbraw/zinc/72/69/79/927726979.db2.gz YSVWJGINQNDADS-UHFFFAOYSA-N 0 0 369.402 3.719 20 5 FHBDRN C[C@@]1(CNC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)CCCC[C@@H]1O ZINC000278107726 937194486 /nfs/dbraw/zinc/19/44/86/937194486.db2.gz KAMVRABHRKCKHJ-AVRDEDQJSA-N 0 0 364.445 3.765 20 5 FHBDRN COc1ccc(CC(C)(C)NC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000186982025 927732997 /nfs/dbraw/zinc/73/29/97/927732997.db2.gz LJBWGZNILVGWSF-AWEZNQCLSA-N 0 0 371.437 3.985 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NC[C@@H](C[C@@H](C)O)c1ccccc1 ZINC000120218388 927767965 /nfs/dbraw/zinc/76/79/65/927767965.db2.gz RLSFORSIFPQNDQ-NVXWUHKLSA-N 0 0 371.437 3.888 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NC[C@H](C[C@H](C)O)c1ccccc1 ZINC000120218868 927769358 /nfs/dbraw/zinc/76/93/58/927769358.db2.gz RLSFORSIFPQNDQ-RDJZCZTQSA-N 0 0 371.437 3.888 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1CN[C@H](C)c1cccc(N2CCCC2=O)c1 ZINC000430193637 927781083 /nfs/dbraw/zinc/78/10/83/927781083.db2.gz GVVCCBAEGUFILR-CQSZACIVSA-N 0 0 369.421 3.581 20 5 FHBDRN CC[C@H](Oc1ccccc1C)C(=O)Nc1cc([N+](=O)[O-])c(F)cc1F ZINC000175726449 927817588 /nfs/dbraw/zinc/81/75/88/927817588.db2.gz CGLGDJAKKAHLEL-HNNXBMFYSA-N 0 0 350.321 3.978 20 5 FHBDRN COC(C)(C)C[C@H](C)NC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000175306110 927819185 /nfs/dbraw/zinc/81/91/85/927819185.db2.gz OUVIVFWYUUNKKZ-VIFPVBQESA-N 0 0 361.345 3.521 20 5 FHBDRN CC(C)[C@H](CNC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)c1cccnc1 ZINC000175309789 927823077 /nfs/dbraw/zinc/82/30/77/927823077.db2.gz SDCPJZQKNAQMGV-KRWDZBQOSA-N 0 0 368.437 3.734 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)Nc1cccc(NC(=O)C2CC2)c1 ZINC000154006176 927846537 /nfs/dbraw/zinc/84/65/37/927846537.db2.gz WHNADYBDURYDMJ-UHFFFAOYSA-N 0 0 353.378 3.515 20 5 FHBDRN COc1cc(OC2CC2)ccc1C(=O)OCc1ccc([N+](=O)[O-])c(F)c1 ZINC000784930091 927858968 /nfs/dbraw/zinc/85/89/68/927858968.db2.gz CPOUOJMPENTCFH-UHFFFAOYSA-N 0 0 361.325 3.641 20 5 FHBDRN CC1(C)[C@H](NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[C@@H]2CCCO[C@H]21 ZINC000610192813 927872771 /nfs/dbraw/zinc/87/27/71/927872771.db2.gz QXGPOYXMLKLKDP-APHBMKBZSA-N 0 0 360.435 3.743 20 5 FHBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)N1C[C@H](C2CC2)[C@@H]1C1CC1 ZINC000458411771 937200469 /nfs/dbraw/zinc/20/04/69/937200469.db2.gz DPOHHDOCBBBSET-MOPGFXCFSA-N 0 0 357.454 3.748 20 5 FHBDRN CC(C)OCc1ccccc1CNC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000079716738 937205685 /nfs/dbraw/zinc/20/56/85/937205685.db2.gz CLEAJLAKZAFQKA-UHFFFAOYSA-N 0 0 367.405 3.931 20 5 FHBDRN C[C@H]1CO[C@@H](c2cccc(Cl)c2)CN1C(=O)c1csc([N+](=O)[O-])c1 ZINC000187072140 927897317 /nfs/dbraw/zinc/89/73/17/927897317.db2.gz PNETZFAPTMKFJM-IINYFYTJSA-N 0 0 366.826 3.912 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1ccc(OC(C)(C)C)cc1 ZINC000610194786 927897985 /nfs/dbraw/zinc/89/79/85/927897985.db2.gz YJYADUGQVNYXKK-UHFFFAOYSA-N 0 0 364.423 3.881 20 5 FHBDRN C[C@H](CC1CCCCC1)C(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000510082429 927905240 /nfs/dbraw/zinc/90/52/40/927905240.db2.gz DOOXMBKMVXFELK-MRXNPFEDSA-N 0 0 359.470 3.850 20 5 FHBDRN O=C(NCCc1ccc(C(F)(F)F)cc1)NCc1ccccc1[N+](=O)[O-] ZINC000042838699 927912316 /nfs/dbraw/zinc/91/23/16/927912316.db2.gz JBFJUXPMGSPREV-UHFFFAOYSA-N 0 0 367.327 3.656 20 5 FHBDRN O=C(NCc1nc(C2CC2)cs1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000124015962 937203543 /nfs/dbraw/zinc/20/35/43/937203543.db2.gz BMHIMZHMEQKUFS-UHFFFAOYSA-N 0 0 372.450 3.803 20 5 FHBDRN Cc1cccnc1C(F)(F)c1nc(Cc2cccc([N+](=O)[O-])c2C)no1 ZINC000583169022 937204260 /nfs/dbraw/zinc/20/42/60/937204260.db2.gz YBHHWEXLPWKFMV-UHFFFAOYSA-N 0 0 360.320 3.721 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N[C@@H](C)C[C@H](O)c1ccccc1 ZINC000120280181 927958271 /nfs/dbraw/zinc/95/82/71/927958271.db2.gz PYHCUFKZIGUUFZ-KSSFIOAISA-N 0 0 357.410 3.845 20 5 FHBDRN Cc1cc(C(=O)N2CCc3cc([N+](=O)[O-])ccc32)c(Br)s1 ZINC000471147700 927978611 /nfs/dbraw/zinc/97/86/11/927978611.db2.gz NDPPQRWALBIPRB-UHFFFAOYSA-N 0 0 367.224 3.930 20 5 FHBDRN COCc1cc(N[C@H](C)CCc2ccccc2[N+](=O)[O-])cc(C(=O)OC)c1 ZINC000430203239 927980448 /nfs/dbraw/zinc/98/04/48/927980448.db2.gz NWHZGYMVUCTINH-CQSZACIVSA-N 0 0 372.421 3.961 20 5 FHBDRN Cc1cc(CN2CCN(c3c(Cl)cc([N+](=O)[O-])cc3Cl)CC2)no1 ZINC000302022672 927992306 /nfs/dbraw/zinc/99/23/06/927992306.db2.gz IVSMGCOJCHOJQS-UHFFFAOYSA-N 0 0 371.224 3.520 20 5 FHBDRN C[C@@H](Sc1ccccn1)C(=O)OCCSc1ccc([N+](=O)[O-])cc1 ZINC000784932903 927995776 /nfs/dbraw/zinc/99/57/76/927995776.db2.gz AWEZZLHQRMNIKF-GFCCVEGCSA-N 0 0 364.448 3.806 20 5 FHBDRN CC[C@H](OC1CCCC1)C(=O)OCCSc1ccc([N+](=O)[O-])cc1 ZINC000784933464 928012809 /nfs/dbraw/zinc/01/28/09/928012809.db2.gz BHVBYNDQYFWJOR-INIZCTEOSA-N 0 0 353.440 3.968 20 5 FHBDRN Cc1ccccc1[C@@H]1CN(C(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)CCO1 ZINC000610208595 928070843 /nfs/dbraw/zinc/07/08/43/928070843.db2.gz HSQPZGSEWRTQHQ-SFHVURJKSA-N 0 0 365.389 3.598 20 5 FHBDRN COc1cc(CC(=O)N2CCS[C@H]2c2ccc([N+](=O)[O-])cc2)ccc1C ZINC000610209933 928075222 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FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCCCN(C)c1ccccc1 ZINC000023428221 928148569 /nfs/dbraw/zinc/14/85/69/928148569.db2.gz YLLNBJYAPAZWDM-HNNXBMFYSA-N 0 0 373.478 3.718 20 5 FHBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N(C)c1c(F)cccc1F ZINC000064813555 928155709 /nfs/dbraw/zinc/15/57/09/928155709.db2.gz MKOITWQRJLKOQY-SECBINFHSA-N 0 0 370.739 3.957 20 5 FHBDRN Cc1ccc(C(=O)N2CCc3ccc([N+](=O)[O-])cc32)cc1Br ZINC000176503403 937224525 /nfs/dbraw/zinc/22/45/25/937224525.db2.gz XPCGMHRBZZZNTP-UHFFFAOYSA-N 0 0 361.195 3.869 20 5 FHBDRN CC(=O)c1ccc(F)cc1OCc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000157538954 928212737 /nfs/dbraw/zinc/21/27/37/928212737.db2.gz RXNLIARGXGJHQV-UHFFFAOYSA-N 0 0 357.297 3.566 20 5 FHBDRN C[C@]1(CNC(=O)Cn2c3ccccc3c(=O)c3ccccc32)CCCS1 ZINC000154126098 928220888 /nfs/dbraw/zinc/22/08/88/928220888.db2.gz PLYFKYIRMPAIRN-OAQYLSRUSA-N 0 0 366.486 3.557 20 5 FHBDRN Cc1cccc2c1N(C(=O)c1cc(Br)cc([N+](=O)[O-])c1)CC2 ZINC000178813236 937229078 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CC(C)C[C@@H](c1nc(-c2ccc([N+](=O)[O-])s2)no1)N1CCCCC1=O ZINC000278130117 937234016 /nfs/dbraw/zinc/23/40/16/937234016.db2.gz KDLMIOVEDPRIKL-NSHDSACASA-N 0 0 364.427 3.806 20 5 FHBDRN O=C(OCCSc1ccc([N+](=O)[O-])cc1)c1ccnn1C1CCCC1 ZINC000784939386 928297434 /nfs/dbraw/zinc/29/74/34/928297434.db2.gz UDJNMVHRFYXPQL-UHFFFAOYSA-N 0 0 361.423 3.856 20 5 FHBDRN O=C(Cc1cccc([N+](=O)[O-])c1)NCc1ccnc(Oc2ccccc2)c1 ZINC000610224194 928300387 /nfs/dbraw/zinc/30/03/87/928300387.db2.gz HWCSPBQORXHMOS-UHFFFAOYSA-N 0 0 363.373 3.641 20 5 FHBDRN Cc1noc(-c2ccc(C)c(NC(=O)c3cc(C)ccc3[N+](=O)[O-])c2)n1 ZINC000610224889 928308210 /nfs/dbraw/zinc/30/82/10/928308210.db2.gz FEGQMPYJRUGAKH-UHFFFAOYSA-N 0 0 352.350 3.822 20 5 FHBDRN CC[C@@H](C)[C@H](NC(=O)Cc1cccc([N+](=O)[O-])c1)c1nc2ccccc2[nH]1 ZINC000610224744 928310320 /nfs/dbraw/zinc/31/03/20/928310320.db2.gz MGEHOXYRIRZSQA-YJYMSZOUSA-N 0 0 366.421 3.917 20 5 FHBDRN O=C(Cc1cccc([N+](=O)[O-])c1)Nc1cccnc1OCc1ccccc1 ZINC000610224721 928310974 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CCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H](C)Oc1ccccc1 ZINC000157698304 928455079 /nfs/dbraw/zinc/45/50/79/928455079.db2.gz RLUXBVLIUJMIJV-CYBMUJFWSA-N 0 0 360.435 3.904 20 5 FHBDRN CCN(C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)C12CC3CC(CC(C3)C1)C2 ZINC000070755116 928469147 /nfs/dbraw/zinc/46/91/47/928469147.db2.gz UNWRPXPWZXZJQI-UHFFFAOYSA-N 0 0 373.409 3.934 20 5 FHBDRN O=C(/C=C\c1ccc(Cl)s1)OCC(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000254954379 928485942 /nfs/dbraw/zinc/48/59/42/928485942.db2.gz BZGCWIBDHFVRSL-ALCCZGGFSA-N 0 0 366.782 3.505 20 5 FHBDRN COc1cccc(-c2nc(C(=O)Nc3cc([N+](=O)[O-])c(C)cc3C)no2)c1 ZINC000471171038 928503005 /nfs/dbraw/zinc/50/30/05/928503005.db2.gz XTNGKEFKUHRUCO-UHFFFAOYSA-N 0 0 368.349 3.523 20 5 FHBDRN CCOc1ccc(C(=O)N2CC3CC2(c2ccccc2)C3)cc1[N+](=O)[O-] ZINC000598556396 928719262 /nfs/dbraw/zinc/71/92/62/928719262.db2.gz UICALHRPBDWGNK-UHFFFAOYSA-N 0 0 352.390 3.755 20 5 FHBDRN CN(Cc1cc2ccccc2o1)Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000083113932 928791536 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FHBDRN Cc1ccc(NC(=O)c2ccc(NC[C@H]3CCCOC3)c([N+](=O)[O-])c2)cc1 ZINC000608972637 928927218 /nfs/dbraw/zinc/92/72/18/928927218.db2.gz DATUMYTUALLDHK-OAHLLOKOSA-N 0 0 369.421 3.994 20 5 FHBDRN COCc1nc(C(=O)N(c2cccc([N+](=O)[O-])c2)C2CCCC2)cs1 ZINC000120572195 928948694 /nfs/dbraw/zinc/94/86/94/928948694.db2.gz LSXHQQJKCPNXLD-UHFFFAOYSA-N 0 0 361.423 3.787 20 5 FHBDRN Cc1cc(C)n([C@@H](C)C(=O)N(c2cccc([N+](=O)[O-])c2)C2CCCC2)n1 ZINC000120563915 928964335 /nfs/dbraw/zinc/96/43/35/928964335.db2.gz BAXWHFZBQLWMTL-HNNXBMFYSA-N 0 0 356.426 3.945 20 5 FHBDRN O=C(Cc1cccc([N+](=O)[O-])c1)N1CCC(OCC2CCCCC2)CC1 ZINC000610237056 928978943 /nfs/dbraw/zinc/97/89/43/928978943.db2.gz WGANOPXYXDZZSP-UHFFFAOYSA-N 0 0 360.454 3.725 20 5 FHBDRN C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)N(C)c3ccccn3)cc2[N+](=O)[O-])C1 ZINC000134545904 929007631 /nfs/dbraw/zinc/00/76/31/929007631.db2.gz LEDHBACOHCSRLG-GASCZTMLSA-N 0 0 368.437 3.749 20 5 FHBDRN O=C(C[C@@H]1CCCN1C(=O)Cc1ccc([N+](=O)[O-])cc1F)c1ccccc1 ZINC000120587945 929016196 /nfs/dbraw/zinc/01/61/96/929016196.db2.gz AHZJIQXWJAOMTD-INIZCTEOSA-N 0 0 370.380 3.540 20 5 FHBDRN O=[N+]([O-])c1cc(F)cc2ccc(NCc3ccc(-c4ncon4)cc3)nc21 ZINC001167089048 929025100 /nfs/dbraw/zinc/02/51/00/929025100.db2.gz GYXQIPWDGKMXNW-UHFFFAOYSA-N 0 0 365.324 3.944 20 5 FHBDRN CC(C)(C(=O)NCc1cnccc1C(F)(F)F)c1ccccc1[N+](=O)[O-] ZINC000598569277 929026271 /nfs/dbraw/zinc/02/62/71/929026271.db2.gz KIBAOJBAJMKEBZ-UHFFFAOYSA-N 0 0 367.327 3.603 20 5 FHBDRN CC(C)(CNC(=O)COc1ccc([N+](=O)[O-])cc1)c1ccc(Cl)cc1 ZINC000059827279 929079644 /nfs/dbraw/zinc/07/96/44/929079644.db2.gz YIOQJZNOPWOTIQ-UHFFFAOYSA-N 0 0 362.813 3.721 20 5 FHBDRN CS[C@H]1CCCCN([C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000134597044 929094562 /nfs/dbraw/zinc/09/45/62/929094562.db2.gz RVNDGOGIZPGLNN-YPMHNXCESA-N 0 0 371.890 3.793 20 5 FHBDRN O=C(NC[C@@H]1CCN(c2ccccc2)C1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000134595087 929094808 /nfs/dbraw/zinc/09/48/08/929094808.db2.gz MDMJFCLWWMMZRC-ZDUSSCGKSA-N 0 0 359.813 3.505 20 5 FHBDRN Nc1c(C(=O)NCCc2nc(C3CCCCC3)cs2)cccc1[N+](=O)[O-] ZINC000176621313 937300106 /nfs/dbraw/zinc/30/01/06/937300106.db2.gz FJQKQKRXTRMLRR-UHFFFAOYSA-N 0 0 374.466 3.654 20 5 FHBDRN COc1ccccc1C[C@H]1CCCN1C(=O)c1cc([N+](=O)[O-])ccc1C ZINC000123615264 929136094 /nfs/dbraw/zinc/13/60/94/929136094.db2.gz NSRRJVIKJLUIOT-MRXNPFEDSA-N 0 0 354.406 3.759 20 5 FHBDRN Cc1ccc(CNC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])nc1C ZINC000458004851 929164257 /nfs/dbraw/zinc/16/42/57/929164257.db2.gz KLPMHBYMVZUFPH-UHFFFAOYSA-N 0 0 365.842 3.669 20 5 FHBDRN O=[N+]([O-])c1cc(COc2cccc(N3CCCC3)c2)c2c(c1)COCO2 ZINC000583277008 937308639 /nfs/dbraw/zinc/30/86/39/937308639.db2.gz BHSRMMHEZKFXDY-UHFFFAOYSA-N 0 0 356.378 3.641 20 5 FHBDRN O=[N+]([O-])c1c(NCc2cccc(OCC(F)(F)F)c2)nc2sccn21 ZINC000052243293 937311466 /nfs/dbraw/zinc/31/14/66/937311466.db2.gz TYLUDMJSOVSFEN-UHFFFAOYSA-N 0 0 372.328 3.857 20 5 FHBDRN O=C(NC1(c2ccccc2)CCOCC1)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000609571174 929233342 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ZINC000580127151 930287624 /nfs/dbraw/zinc/28/76/24/930287624.db2.gz YTEWOVJWDVSCSH-RYUDHWBXSA-N 0 0 353.382 3.520 20 5 FHBDRN CN(C(=O)c1cc([N+](=O)[O-])ccc1Br)c1ccc(F)cc1 ZINC000049965852 930298766 /nfs/dbraw/zinc/29/87/66/930298766.db2.gz XUTXJWSJEKABKX-UHFFFAOYSA-N 0 0 353.147 3.773 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H]1CC[C@H](c2ccc(F)cc2)C1 ZINC000471543112 930300017 /nfs/dbraw/zinc/30/00/17/930300017.db2.gz XANQJJVZPWHWBH-ZFWWWQNUSA-N 0 0 358.369 3.809 20 5 FHBDRN O=C(NCc1cccc([N+](=O)[O-])c1)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000580151987 930311659 /nfs/dbraw/zinc/31/16/59/930311659.db2.gz FISINLMOKGNFEU-UHFFFAOYSA-N 0 0 373.368 3.520 20 5 FHBDRN CC(C)[C@H]1CC[C@@H](C)C[C@H]1OC(=O)COc1cc(C=O)ccc1[N+](=O)[O-] ZINC000748154214 930341698 /nfs/dbraw/zinc/34/16/98/930341698.db2.gz LQNNZSGQDDJXBQ-FRFSOERESA-N 0 0 363.410 3.790 20 5 FHBDRN O=C(NCCc1ccccc1[N+](=O)[O-])N1CCS[C@H](c2ccccc2)C1 ZINC000610405190 930391838 /nfs/dbraw/zinc/39/18/38/930391838.db2.gz RUJVLFJJUTVHCP-SFHVURJKSA-N 0 0 371.462 3.637 20 5 FHBDRN Cc1cc([C@@H](C)NC(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)c(C)s1 ZINC000580236601 930395293 /nfs/dbraw/zinc/39/52/93/930395293.db2.gz DIACVFWAISAHPO-SECBINFHSA-N 0 0 354.378 3.971 20 5 FHBDRN CC1(C)CC[C@H](C(=O)OCC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000781693717 930432390 /nfs/dbraw/zinc/43/23/90/930432390.db2.gz HPQLRDMRSHIKLJ-JTQLQIEISA-N 0 0 354.790 3.556 20 5 FHBDRN CNc1ccc(C(=O)Oc2ccc(F)c3c2C(=O)C[C@@H]3C)cc1[N+](=O)[O-] ZINC000728288249 930444559 /nfs/dbraw/zinc/44/45/59/930444559.db2.gz AZCNROLGIULZAF-VIFPVBQESA-N 0 0 358.325 3.685 20 5 FHBDRN Cc1nn(C)c(NCc2cccc(OCc3ccccc3)c2)c1[N+](=O)[O-] ZINC000052326132 937416819 /nfs/dbraw/zinc/41/68/19/937416819.db2.gz CDXFSGAIVFDCKI-UHFFFAOYSA-N 0 0 352.394 3.828 20 5 FHBDRN CC(C)(C)c1ncc(NC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)cn1 ZINC000610094347 930455351 /nfs/dbraw/zinc/45/53/51/930455351.db2.gz AXADSSUKQZUCOQ-UHFFFAOYSA-N 0 0 371.441 3.827 20 5 FHBDRN Cc1cc(-c2nc(-c3cccc(OCC(F)F)n3)no2)ccc1[N+](=O)[O-] ZINC000545138978 937417721 /nfs/dbraw/zinc/41/77/21/937417721.db2.gz LRUXIVWBPOJIKC-UHFFFAOYSA-N 0 0 362.292 3.659 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[C@H](c2ccc(C)cc2)C1 ZINC000548079976 930512465 /nfs/dbraw/zinc/51/24/65/930512465.db2.gz RJKOEOXLVTWVJE-HNNXBMFYSA-N 0 0 355.394 3.933 20 5 FHBDRN CC(C)[C@H](O)C(C)(C)CNC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000275838582 930513216 /nfs/dbraw/zinc/51/32/16/930513216.db2.gz CAFBUPIRFQKAAL-FQEVSTJZSA-N 0 0 366.461 3.867 20 5 FHBDRN CCn1c(SCc2ccn(C(C)C)n2)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000177749328 930520560 /nfs/dbraw/zinc/52/05/60/930520560.db2.gz RNTWACRLBQNMPC-UHFFFAOYSA-N 0 0 372.454 3.943 20 5 FHBDRN O=C(N[C@@H]1CC[C@@H]2CCCC[C@H]2C1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000610434277 930532152 /nfs/dbraw/zinc/53/21/52/930532152.db2.gz SQMBMOFVQQGHEH-YQQAZPJKSA-N 0 0 368.437 3.869 20 5 FHBDRN CC(C)(CO)[C@H](CNC(=O)Nc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000119016167 930536079 /nfs/dbraw/zinc/53/60/79/930536079.db2.gz AQDLVGWHMXUEJT-QGZVFWFLSA-N 0 0 357.410 3.519 20 5 FHBDRN Cc1cnc(Nc2ccc(F)cc2[N+](=O)[O-])c(I)c1 ZINC001210951801 930544862 /nfs/dbraw/zinc/54/48/62/930544862.db2.gz QCGLNZKOXDBHHE-UHFFFAOYSA-N 0 0 373.125 3.786 20 5 FHBDRN CCOc1cccc(NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])n1 ZINC000610435049 930557925 /nfs/dbraw/zinc/55/79/25/930557925.db2.gz VYBVJKDYFWBHRA-UHFFFAOYSA-N 0 0 355.272 3.660 20 5 FHBDRN O=C(N[C@H](c1noc(-c2cccc([N+](=O)[O-])c2)n1)C1CC1)c1ccccc1 ZINC000580362919 930573570 /nfs/dbraw/zinc/57/35/70/930573570.db2.gz KQOCSXBHKMTBKX-INIZCTEOSA-N 0 0 364.361 3.526 20 5 FHBDRN CNC(=O)c1cc(NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)ccc1Cl ZINC000119045498 930577440 /nfs/dbraw/zinc/57/74/40/930577440.db2.gz LEQXWNCTCSELNM-UHFFFAOYSA-N 0 0 368.176 3.514 20 5 FHBDRN CCO[C@H]1C[C@H](NC(=O)c2c(Cl)cccc2[N+](=O)[O-])C1(CC)CC ZINC000119059051 930593075 /nfs/dbraw/zinc/59/30/75/930593075.db2.gz UYDLNDAIUBNUNY-KBPBESRZSA-N 0 0 354.834 3.962 20 5 FHBDRN CC(C)(CCO)CNC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 ZINC000177762142 930604046 /nfs/dbraw/zinc/60/40/46/930604046.db2.gz MKJSETGQKWOZMG-UHFFFAOYSA-N 0 0 358.394 3.526 20 5 FHBDRN CCC(C)(C)c1ccc(NC(=O)C(=O)NCc2cccc([N+](=O)[O-])c2)cc1 ZINC000580400639 930627551 /nfs/dbraw/zinc/62/75/51/930627551.db2.gz JAPOZADSXUNSNV-UHFFFAOYSA-N 0 0 369.421 3.537 20 5 FHBDRN CC(C)(CO)[C@H](CNC(=O)/C=C\c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000255204103 930637959 /nfs/dbraw/zinc/63/79/59/930637959.db2.gz USHLDHMHEHHYMT-QTJNJRLBSA-N 0 0 368.433 3.527 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)Nc1ccc(N2CCCC2)cn1 ZINC000275881952 930663829 /nfs/dbraw/zinc/66/38/29/930663829.db2.gz QCCRIFHWACITIQ-UHFFFAOYSA-N 0 0 360.801 3.804 20 5 FHBDRN CC[C@H]1c2ccccc2CCN1C(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000074645031 930683184 /nfs/dbraw/zinc/68/31/84/930683184.db2.gz WGJPOQYEFHPAIX-KRWDZBQOSA-N 0 0 354.406 3.900 20 5 FHBDRN CC(=O)c1ccc(OCC(=O)N[C@H](C)c2ccc(C)c(C)c2)c([N+](=O)[O-])c1 ZINC000119114615 930691932 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FHBDRN Cc1ccc([C@@H]2CCN(C(=O)NCc3ccccc3[N+](=O)[O-])C2)c(C)c1 ZINC000471590549 930826535 /nfs/dbraw/zinc/82/65/35/930826535.db2.gz NFHJLLAULSEJMT-QGZVFWFLSA-N 0 0 353.422 3.911 20 5 FHBDRN O=C(N[C@@H]1[C@@H]2CCO[C@@H]2C12CCC2)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000275908957 930827842 /nfs/dbraw/zinc/82/78/42/930827842.db2.gz DGXKIDCFSGMEKW-RVHYNSKXSA-N 0 0 374.440 3.781 20 5 FHBDRN COCC[C@@H](NC(=O)c1c(C)cc(Cl)cc1[N+](=O)[O-])c1ccc(C)o1 ZINC000275911467 930834427 /nfs/dbraw/zinc/83/44/27/930834427.db2.gz WJKTUNBZGODFOU-CYBMUJFWSA-N 0 0 366.801 3.966 20 5 FHBDRN Cc1c(Br)cccc1CS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000119200552 930857190 /nfs/dbraw/zinc/85/71/90/930857190.db2.gz HKZFGADFIPVUFY-UHFFFAOYSA-N 0 0 370.224 3.640 20 5 FHBDRN CCOc1cccc([C@H]2C[C@@H]2NC(=O)N(C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000537201119 930862428 /nfs/dbraw/zinc/86/24/28/930862428.db2.gz RYBNFTKDOMGUAT-MSOLQXFVSA-N 0 0 369.421 3.691 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)Nc2cc(F)c(F)c(F)c2)c1 ZINC000537324927 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Cc1ccc([N+](=O)[O-])cc1C(=O)N(Cc1cccc(F)c1)C[C@H]1CCCO1 ZINC000050379171 930978076 /nfs/dbraw/zinc/97/80/76/930978076.db2.gz MIFPTMCILJUMQK-GOSISDBHSA-N 0 0 372.396 3.864 20 5 FHBDRN CCOc1ccc(C(=O)N2C[C@H](CC)Oc3ccccc32)cc1[N+](=O)[O-] ZINC000071500074 931005912 /nfs/dbraw/zinc/00/59/12/931005912.db2.gz APQNHFWNPZHIHB-AWEZNQCLSA-N 0 0 356.378 3.811 20 5 FHBDRN Cc1cc(C(=O)Nc2cc([N+](=O)[O-])ccc2C)nn1-c1cccc(F)c1 ZINC000537586258 931046275 /nfs/dbraw/zinc/04/62/75/931046275.db2.gz GQSXMDYKFFZOQP-UHFFFAOYSA-N 0 0 354.341 3.789 20 5 FHBDRN Cc1nccn1-c1ccc([C@H](C)NC(=O)c2cc(F)ccc2[N+](=O)[O-])cc1 ZINC000119310220 931068522 /nfs/dbraw/zinc/06/85/22/931068522.db2.gz XDIOCNYITSMVIG-LBPRGKRZSA-N 0 0 368.368 3.719 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)NCCc1ccccc1Cl ZINC000119310772 931068852 /nfs/dbraw/zinc/06/88/52/931068852.db2.gz IMAOSURWAXSVQM-UHFFFAOYSA-N 0 0 357.797 3.631 20 5 FHBDRN O=C(O[C@H](c1cccnc1)c1ccccc1[N+](=O)[O-])c1ccc2cccnn21 ZINC001266648856 931118323 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FHBDRN COc1cc(C)c(NC(=O)COc2ccc([N+](=O)[O-])c(OC)c2)c(C)c1C ZINC000579867993 931157454 /nfs/dbraw/zinc/15/74/54/931157454.db2.gz NDBPPQQAXKMXFB-UHFFFAOYSA-N 0 0 374.393 3.555 20 5 FHBDRN CCOC(=O)C1CCC(N(CC)c2cc([N+](=O)[O-])ccc2C(C)=O)CC1 ZINC000579875394 931170920 /nfs/dbraw/zinc/17/09/20/931170920.db2.gz NDJQFDNNGZHEPX-UHFFFAOYSA-N 0 0 362.426 3.746 20 5 FHBDRN C[C@H](CNC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1)COCc1ccccc1 ZINC000580808352 931177020 /nfs/dbraw/zinc/17/70/20/931177020.db2.gz YPQOYQGDABTDLQ-HZPDHXFCSA-N 0 0 356.422 3.667 20 5 FHBDRN CC(=O)N1CCCN(CCCOc2ccc([N+](=O)[O-])cc2)c2ccccc21 ZINC000177818993 931212822 /nfs/dbraw/zinc/21/28/22/931212822.db2.gz ZVVPAZPPAAGJML-UHFFFAOYSA-N 0 0 369.421 3.627 20 5 FHBDRN CC(C)(C)CN(CC(C)(C)C)C(=O)c1cc([N+](=O)[O-])cc2c1OCCO2 ZINC000561188867 931221412 /nfs/dbraw/zinc/22/14/12/931221412.db2.gz OJEMZAGMLBQURS-UHFFFAOYSA-N 0 0 364.442 3.900 20 5 FHBDRN CCCN(CCc1cccc(F)c1)c1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1 ZINC000561195647 931233537 /nfs/dbraw/zinc/23/35/37/931233537.db2.gz CDQKLHNXYQBGPA-UHFFFAOYSA-N 0 0 370.384 3.842 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1cnc2c(c1)c(C)nn2C ZINC000134346410 931255151 /nfs/dbraw/zinc/25/51/51/931255151.db2.gz WKZMTSGTSWSLMS-UHFFFAOYSA-N 0 0 371.422 3.549 20 5 FHBDRN O=[N+]([O-])c1cc(CN(Cc2ccccc2)CC(F)F)c2c(c1)COCO2 ZINC000177836212 931264886 /nfs/dbraw/zinc/26/48/86/931264886.db2.gz LZJWGDUFGNUCBS-UHFFFAOYSA-N 0 0 364.348 3.729 20 5 FHBDRN O=C(Nc1ccc(F)cc1Cl)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000119350682 931271216 /nfs/dbraw/zinc/27/12/16/931271216.db2.gz PPWCXLMFWRPYQI-UHFFFAOYSA-N 0 0 360.732 3.825 20 5 FHBDRN Cc1nc(C)c([C@H](C)N(C)c2nnc(-c3ccc([N+](=O)[O-])cc3)n2C)s1 ZINC000580861685 931278345 /nfs/dbraw/zinc/27/83/45/931278345.db2.gz MCWWJCKCZYKXGE-NSHDSACASA-N 0 0 372.454 3.661 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)Cc2cnn(-c3ccccc3)c2)cc1[N+](=O)[O-] ZINC000177850450 931290992 /nfs/dbraw/zinc/29/09/92/931290992.db2.gz JIMAIIKJVLNVOU-OAHLLOKOSA-N 0 0 364.405 3.509 20 5 FHBDRN Cc1nn(C(C)(C)C)cc1[C@@H](C)NCc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000157789297 931318087 /nfs/dbraw/zinc/31/80/87/931318087.db2.gz FCEZQPLHAGTRDR-LLVKDONJSA-N 0 0 357.414 3.847 20 5 FHBDRN COc1ccc(SCC(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000177855010 931324648 /nfs/dbraw/zinc/32/46/48/931324648.db2.gz HCZWVQJRDFLIIK-ZDUSSCGKSA-N 0 0 360.435 3.881 20 5 FHBDRN CC[C@H](C)[C@@H]1CCCCN1C(=O)c1cc(OC)c(OC)c([N+](=O)[O-])c1 ZINC000610175691 931326605 /nfs/dbraw/zinc/32/66/05/931326605.db2.gz RLUWCEVOUOUTSG-JSGCOSHPSA-N 0 0 350.415 3.653 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)ccc1NCc1ncn(Cc2cccc(F)c2)n1 ZINC000471628609 931340153 /nfs/dbraw/zinc/34/01/53/931340153.db2.gz MUYDQKFYKMNKLE-UHFFFAOYSA-N 0 0 361.764 3.639 20 5 FHBDRN CC(C)CN(C(=O)c1cc([N+](=O)[O-])cn1C)[C@@H]1CCCc2cccnc21 ZINC000548145290 931360636 /nfs/dbraw/zinc/36/06/36/931360636.db2.gz GBSMVIGXYQLPIL-MRXNPFEDSA-N 0 0 356.426 3.504 20 5 FHBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1OC(=O)c1cccnc1Br ZINC000160692804 931360997 /nfs/dbraw/zinc/36/09/97/931360997.db2.gz OTHVYTRKKRPKRO-UHFFFAOYSA-N 0 0 371.574 3.933 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)c2cccc(-n3cccn3)c2)cc1[N+](=O)[O-] ZINC000177868201 931391345 /nfs/dbraw/zinc/39/13/45/931391345.db2.gz MXPNKRVOZISFLV-CQSZACIVSA-N 0 0 350.378 3.580 20 5 FHBDRN Cc1c(NC(=O)Cc2cccc([N+](=O)[O-])c2)cnn1-c1ccc(Cl)cc1 ZINC000580976587 931436731 /nfs/dbraw/zinc/43/67/31/931436731.db2.gz CLYJNLHMYSKGLA-UHFFFAOYSA-N 0 0 370.796 3.924 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)CCc2ccc(O)cc2)c1 ZINC000155975927 931516277 /nfs/dbraw/zinc/51/62/77/931516277.db2.gz WBIHBFKQCCXSGU-GFCCVEGCSA-N 0 0 360.435 3.773 20 5 FHBDRN O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)N[C@@H]1C[C@H]1c1ccc(Cl)cc1 ZINC000581093823 931555068 /nfs/dbraw/zinc/55/50/68/931555068.db2.gz JTBNAZFFHVSZIM-BLLLJJGKSA-N 0 0 366.751 3.741 20 5 FHBDRN CC(=O)Nc1ccccc1CNC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000610191532 931564995 /nfs/dbraw/zinc/56/49/95/931564995.db2.gz VBUCGMGEJMEDED-UHFFFAOYSA-N 0 0 369.402 3.698 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CCCO[C@H]2CC(C)C)c1 ZINC000187383399 931589126 /nfs/dbraw/zinc/58/91/26/931589126.db2.gz CZZKBWBGWMCQAP-ZBFHGGJFSA-N 0 0 352.456 3.640 20 5 FHBDRN CCCCN(CCCO)C(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000276030310 931596839 /nfs/dbraw/zinc/59/68/39/931596839.db2.gz WDHBXIJUXOHKRC-UHFFFAOYSA-N 0 0 352.434 3.718 20 5 FHBDRN COc1ccccc1[C@H](CNC(=O)c1cccc(C)c1[N+](=O)[O-])OC(C)C ZINC000187391989 931602619 /nfs/dbraw/zinc/60/26/19/931602619.db2.gz IHPNSMZWDFBYBA-SFHVURJKSA-N 0 0 372.421 3.808 20 5 FHBDRN COc1ccc(COCCNc2ccc3ncccc3c2[N+](=O)[O-])cc1 ZINC000537878749 931621038 /nfs/dbraw/zinc/62/10/38/931621038.db2.gz PQAQVWREYWERKK-UHFFFAOYSA-N 0 0 353.378 3.780 20 5 FHBDRN Cc1ccc(NC(=O)CCc2nc(-c3cccs3)no2)cc1[N+](=O)[O-] ZINC000050823719 931668639 /nfs/dbraw/zinc/66/86/39/931668639.db2.gz PIMXCCVLDCNSGG-UHFFFAOYSA-N 0 0 358.379 3.586 20 5 FHBDRN COc1ccc(NC(=O)NC[C@@H]2CCO[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000276051605 931686964 /nfs/dbraw/zinc/68/69/64/931686964.db2.gz SPVQQXXHNKKNHV-KSSFIOAISA-N 0 0 371.393 3.503 20 5 FHBDRN O=[N+]([O-])c1ccc(S(=O)(=O)CCOc2cccc3ccccc32)cc1 ZINC000477038760 931725336 /nfs/dbraw/zinc/72/53/36/931725336.db2.gz WCELQXSBKBBWPJ-UHFFFAOYSA-N 0 0 357.387 3.601 20 5 FHBDRN COc1cc(C)c(NC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)cc1OC ZINC000048315586 931736725 /nfs/dbraw/zinc/73/67/25/931736725.db2.gz PSTOYBFIOYAVKN-UHFFFAOYSA-N 0 0 355.350 3.654 20 5 FHBDRN CN(C(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])C(C1CC1)C1CC1 ZINC000064974755 931770631 /nfs/dbraw/zinc/77/06/31/931770631.db2.gz GYXVCXZLZQHBPC-UHFFFAOYSA-N 0 0 372.343 3.797 20 5 FHBDRN COc1cc(Cc2noc(CC(C)(C)C(F)(F)F)n2)ccc1[N+](=O)[O-] ZINC000581336654 931852430 /nfs/dbraw/zinc/85/24/30/931852430.db2.gz XNHNKOGIIBJNKF-UHFFFAOYSA-N 0 0 359.304 3.708 20 5 FHBDRN CC(C)(O)c1ccc(CNc2c(Br)cncc2[N+](=O)[O-])cc1 ZINC000302463609 931859113 /nfs/dbraw/zinc/85/91/13/931859113.db2.gz VPABMHRFLDWGOZ-UHFFFAOYSA-N 0 0 366.215 3.592 20 5 FHBDRN Cc1cccc(CC(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)c1 ZINC000581345834 931867405 /nfs/dbraw/zinc/86/74/05/931867405.db2.gz UPLMLJDWUDQPIL-UHFFFAOYSA-N 0 0 352.312 3.781 20 5 FHBDRN Cc1ccc(F)c(OCC(=O)N(C)Cc2cc([N+](=O)[O-])ccc2Cl)c1 ZINC000160866724 931883590 /nfs/dbraw/zinc/88/35/90/931883590.db2.gz MXDUMVSDEIEYMC-UHFFFAOYSA-N 0 0 366.776 3.733 20 5 FHBDRN CC(=O)c1cc(NC[C@@]2(CO)C[C@@H]2c2ccc(F)cc2)ccc1[N+](=O)[O-] ZINC000561338153 931904252 /nfs/dbraw/zinc/90/42/52/931904252.db2.gz JPRWKJVRIQUZDN-IEBWSBKVSA-N 0 0 358.369 3.515 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N[C@@H]1c2ccc(F)cc2O[C@@H]1C ZINC000477091416 931909713 /nfs/dbraw/zinc/90/97/13/931909713.db2.gz YQQCLTQXEQDQIT-DIFFPNOSSA-N 0 0 359.357 3.994 20 5 FHBDRN Cc1nn(C(C)(C)C)cc1[C@H](C)NC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000156178205 931924091 /nfs/dbraw/zinc/92/40/91/931924091.db2.gz NJEKMFDUCZHYGL-JTQLQIEISA-N 0 0 364.833 3.999 20 5 FHBDRN O=[N+]([O-])c1cncc(Br)c1N1CCC[C@@H](CC(F)(F)F)C1 ZINC000420622161 931930664 /nfs/dbraw/zinc/93/06/64/931930664.db2.gz ISKQSEUVMXHMQZ-QMMMGPOBSA-N 0 0 368.153 3.921 20 5 FHBDRN Cc1ccccc1O[C@H](C)CNC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000610244832 931933182 /nfs/dbraw/zinc/93/31/82/931933182.db2.gz VOZUZDSOHUWDSJ-CYBMUJFWSA-N 0 0 353.378 3.582 20 5 FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCC[C@@H](C)C1 ZINC000135121007 931943183 /nfs/dbraw/zinc/94/31/83/931943183.db2.gz CIQWWFXOYKURAK-OLZOCXBDSA-N 0 0 352.456 3.642 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(N2CCC(C(F)(F)F)(C(F)(F)F)C2)c1 ZINC000610278599 931944340 /nfs/dbraw/zinc/94/43/40/931944340.db2.gz VELFHVZLWPKBME-UHFFFAOYSA-N 0 0 358.238 3.925 20 5 FHBDRN CC(C)(C)OC(=O)[C@@]12CCC[C@H]1CN(c1ncc(Cl)cc1[N+](=O)[O-])C2 ZINC000544002149 931952108 /nfs/dbraw/zinc/95/21/08/931952108.db2.gz PTMJOKMOMBKLIZ-APPDUMDISA-N 0 0 367.833 3.591 20 5 FHBDRN Cc1noc(C)c1C[C@H](C)NC(=O)CCc1c(Cl)cccc1[N+](=O)[O-] ZINC000933255977 931990347 /nfs/dbraw/zinc/99/03/47/931990347.db2.gz HKKUGEMVDSHTKR-JTQLQIEISA-N 0 0 365.817 3.533 20 5 FHBDRN O=C(COC(=O)C(F)(F)c1cccc(Cl)c1)c1ccc([N+](=O)[O-])cc1 ZINC000728331937 931991297 /nfs/dbraw/zinc/99/12/97/931991297.db2.gz GJPXTTCZKIYVHB-UHFFFAOYSA-N 0 0 369.707 3.766 20 5 FHBDRN C[C@H](CCc1ccccc1)NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000033147211 931991315 /nfs/dbraw/zinc/99/13/15/931991315.db2.gz JMHWJRDNNOAYKA-OAHLLOKOSA-N 0 0 364.405 3.532 20 5 FHBDRN CC(C)(C)[C@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl)C(F)(F)F ZINC000610397537 932014246 /nfs/dbraw/zinc/01/42/46/932014246.db2.gz SVANVOCXVBMYRD-LBPRGKRZSA-N 0 0 352.740 3.884 20 5 FHBDRN Cc1noc(Cl)c1CCC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000135189031 932041880 /nfs/dbraw/zinc/04/18/80/932041880.db2.gz IMLIMLDMCCTHFC-UHFFFAOYSA-N 0 0 363.801 3.668 20 5 FHBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)Nc1ccc(N2CCSCC2)cc1 ZINC000255302347 932042892 /nfs/dbraw/zinc/04/28/92/932042892.db2.gz LJZPFZSLWGRNBE-KMKOMSMNSA-N 0 0 369.446 3.800 20 5 FHBDRN CSCCCCCNC(=O)c1cc([N+](=O)[O-])ccc1Br ZINC000187412182 932043634 /nfs/dbraw/zinc/04/36/34/932043634.db2.gz CXFYLPVCQDOFDS-UHFFFAOYSA-N 0 0 361.261 3.620 20 5 FHBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1cnc2ccccc2n1 ZINC000430600288 932047080 /nfs/dbraw/zinc/04/70/80/932047080.db2.gz HEYMYYGJUPYOKJ-SNVBAGLBSA-N 0 0 372.768 3.597 20 5 FHBDRN Cc1c(Cl)cc(S(=O)(=O)N(C2CC2)C2CCCC2)cc1[N+](=O)[O-] ZINC000046407511 932053054 /nfs/dbraw/zinc/05/30/54/932053054.db2.gz FTLBHFPTPAGCJY-UHFFFAOYSA-N 0 0 358.847 3.652 20 5 FHBDRN CCOc1ccc(C(=O)NCC(C)(C)c2ccccc2F)cc1[N+](=O)[O-] ZINC000109971466 932063597 /nfs/dbraw/zinc/06/35/97/932063597.db2.gz HGUOMCFNJMMFTO-UHFFFAOYSA-N 0 0 360.385 3.840 20 5 FHBDRN COc1cc(N2C[C@H](C(F)(F)F)[C@H](C(F)(F)F)C2)ccc1[N+](=O)[O-] ZINC000610587771 932071526 /nfs/dbraw/zinc/07/15/26/932071526.db2.gz YEXIRCBAUZAYHM-DTORHVGOSA-N 0 0 358.238 3.780 20 5 FHBDRN CCOc1ccc(NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)cc1F ZINC000157162052 932076878 /nfs/dbraw/zinc/07/68/78/932076878.db2.gz OVEZUBAOZHNLHN-UHFFFAOYSA-N 0 0 357.341 3.795 20 5 FHBDRN Cc1c(Br)c(NCC2(O)CCCCCC2)ncc1[N+](=O)[O-] ZINC000165781225 932094537 /nfs/dbraw/zinc/09/45/37/932094537.db2.gz VQMWLAXHIRFMTM-UHFFFAOYSA-N 0 0 358.236 3.558 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N1CCC[C@@]2(C1)OCc1ccccc12 ZINC000548175423 932111765 /nfs/dbraw/zinc/11/17/65/932111765.db2.gz LDNAFKMWPJAMFE-FQEVSTJZSA-N 0 0 352.390 3.565 20 5 FHBDRN CC1(C)[C@H](C(F)(F)F)CCN1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000276228648 932114766 /nfs/dbraw/zinc/11/47/66/932114766.db2.gz KBFQMFSNHZCDLH-GFCCVEGCSA-N 0 0 370.331 3.808 20 5 FHBDRN O=C(COC(=O)[C@H]1C[C@@H]1c1cccc(Cl)c1)c1ccc([N+](=O)[O-])cc1 ZINC000728338652 932116603 /nfs/dbraw/zinc/11/66/03/932116603.db2.gz GFEAEVIYWJSDTP-CVEARBPZSA-N 0 0 359.765 3.778 20 5 FHBDRN CCOc1ccc(C2=CCN(C(=O)c3ccc([N+](=O)[O-])s3)CC2)cc1 ZINC000119363649 932123125 /nfs/dbraw/zinc/12/31/25/932123125.db2.gz VDGDDHSCHDYEGN-UHFFFAOYSA-N 0 0 358.419 3.985 20 5 FHBDRN Cc1cnc([C@H](C)Nc2ncc([N+](=O)[O-])c(C)c2Br)s1 ZINC000165801389 932123869 /nfs/dbraw/zinc/12/38/69/932123869.db2.gz WNBQRRMWGCXBLA-QMMMGPOBSA-N 0 0 357.233 3.999 20 5 FHBDRN COc1ccc(OC)c([C@@H]2C[C@@H]2C(=O)N[C@@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000276264406 932137551 /nfs/dbraw/zinc/13/75/51/932137551.db2.gz MORYYNAAJUHBRR-NUTKFTJISA-N 0 0 370.405 3.593 20 5 FHBDRN COc1cc(F)c([C@@H](C)NCc2ccc([N+](=O)[O-])c(F)c2)cc1OC ZINC000276295369 932147660 /nfs/dbraw/zinc/14/76/60/932147660.db2.gz IUJANRZQQXXFQO-SNVBAGLBSA-N 0 0 352.337 3.741 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1N1CCC[C@H]1[C@H]1CCCOC1 ZINC000566006354 932154889 /nfs/dbraw/zinc/15/48/89/932154889.db2.gz AADGTJPMRLITBG-AAEUAGOBSA-N 0 0 355.232 3.753 20 5 FHBDRN Cc1ccc(NCCCNC(=O)N2CCC[C@H]2c2ccc[nH]2)c([N+](=O)[O-])c1 ZINC000121397015 932167795 /nfs/dbraw/zinc/16/77/95/932167795.db2.gz PYSNFUHFISFRJM-KRWDZBQOSA-N 0 0 371.441 3.580 20 5 FHBDRN CCCN(c1nnc(-c2ccc([N+](=O)[O-])cc2)n1C[C@@H]1CCCO1)C(C)C ZINC000581498835 932170579 /nfs/dbraw/zinc/17/05/79/932170579.db2.gz LELBIPZTNCSNDW-KRWDZBQOSA-N 0 0 373.457 3.657 20 5 FHBDRN CN(Cc1ccc(F)c(Cl)c1)c1cc2nc[nH]c(=O)c2cc1[N+](=O)[O-] ZINC000581525815 932208365 /nfs/dbraw/zinc/20/83/65/932208365.db2.gz LESKUKAAZUKPEU-UHFFFAOYSA-N 0 0 362.748 3.673 20 5 FHBDRN Cc1ccc(C)c(C(=O)OCC(=O)Nc2cc([N+](=O)[O-])ccc2Cl)c1 ZINC000003401513 932268376 /nfs/dbraw/zinc/26/83/76/932268376.db2.gz UQQJVPORPPBQPP-UHFFFAOYSA-N 0 0 362.769 3.661 20 5 FHBDRN Cc1cc(C)cc(C(=O)OCC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c1 ZINC000003401930 932273576 /nfs/dbraw/zinc/27/35/76/932273576.db2.gz BFODOCHOHIBYNB-UHFFFAOYSA-N 0 0 362.769 3.661 20 5 FHBDRN CC(=O)N(c1ccc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2)cc1)C1CC1 ZINC000581627464 932343111 /nfs/dbraw/zinc/34/31/11/932343111.db2.gz KJBQSCLDTKJLAX-UHFFFAOYSA-N 0 0 357.341 3.502 20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])Nc1nnc(-c2ccccc2)s1 ZINC000247343895 932345437 /nfs/dbraw/zinc/34/54/37/932345437.db2.gz TXEJZVDQKHZIPJ-UHFFFAOYSA-N 0 0 369.406 3.554 20 5 FHBDRN NC(=O)c1ccc(CNc2c(F)cc(Cl)cc2Cl)c([N+](=O)[O-])c1 ZINC000126686695 932354981 /nfs/dbraw/zinc/35/49/81/932354981.db2.gz LBHDATMHRKKAAO-UHFFFAOYSA-N 0 0 358.156 3.752 20 5 FHBDRN Cn1cnc([N+](=O)[O-])c1N1CC=C(c2ccccc2C(F)(F)F)CC1 ZINC000477167917 932362210 /nfs/dbraw/zinc/36/22/10/932362210.db2.gz OKQFUNWKISRJCJ-UHFFFAOYSA-N 0 0 352.316 3.641 20 5 FHBDRN O=C(Cc1cc(F)c(F)cc1F)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000127203010 932366070 /nfs/dbraw/zinc/36/60/70/932366070.db2.gz VOEMJZGVOGWSAA-UHFFFAOYSA-N 0 0 366.339 3.694 20 5 FHBDRN Cc1c(NC(=O)N2CC[C@@H]2C(F)F)cc([N+](=O)[O-])cc1C(F)(F)F ZINC000933344907 932376311 /nfs/dbraw/zinc/37/63/11/932376311.db2.gz JCBDACFUBSCIPF-SNVBAGLBSA-N 0 0 353.247 3.793 20 5 FHBDRN CN(CC(=O)N[C@@H]1CCC(C)(C)c2ccccc21)c1ccccc1[N+](=O)[O-] ZINC001125524848 932400945 /nfs/dbraw/zinc/40/09/45/932400945.db2.gz FDFGQOVSQBRPJL-QGZVFWFLSA-N 0 0 367.449 3.960 20 5 FHBDRN CC(C)(NC(=O)Cc1ccc([N+](=O)[O-])cc1F)c1cccc(Cl)c1 ZINC000477226837 932423608 /nfs/dbraw/zinc/42/36/08/932423608.db2.gz DCPRTHWIIANOHM-UHFFFAOYSA-N 0 0 350.777 3.981 20 5 FHBDRN CC1(CNC(=O)c2ccn(-c3c(Cl)cc([N+](=O)[O-])cc3Cl)n2)CC1 ZINC000477231026 932423743 /nfs/dbraw/zinc/42/37/43/932423743.db2.gz ZFBQCIHUYAJYEO-UHFFFAOYSA-N 0 0 369.208 3.617 20 5 FHBDRN C[C@@H](CNC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1ccncc1 ZINC000610526252 932477190 /nfs/dbraw/zinc/47/71/90/932477190.db2.gz KOOSSIHPQCKLPJ-JTQLQIEISA-N 0 0 353.300 3.542 20 5 FHBDRN Cc1cc(OCC(=O)NC[C@H]2CCCCC(F)(F)C2)ccc1[N+](=O)[O-] ZINC000581683294 932489227 /nfs/dbraw/zinc/48/92/27/932489227.db2.gz NGADTHJKJRYTNF-ZDUSSCGKSA-N 0 0 356.369 3.614 20 5 FHBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N(CC1CC1)CC1CC1 ZINC000121433652 932495996 /nfs/dbraw/zinc/49/59/96/932495996.db2.gz JKFXTCFDGVTKPP-UHFFFAOYSA-N 0 0 353.216 3.620 20 5 FHBDRN CN(CCCc1cc(-c2ccccc2)no1)C(=O)c1ccc([N+](=O)[O-])o1 ZINC000127255284 932497427 /nfs/dbraw/zinc/49/74/27/932497427.db2.gz RBABYFXSRYUDEZ-UHFFFAOYSA-N 0 0 355.350 3.548 20 5 FHBDRN COC(=O)c1cc(CNC(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)oc1C ZINC000097214868 932518597 /nfs/dbraw/zinc/51/85/97/932518597.db2.gz JTUNOBMOMRFSBH-UHFFFAOYSA-N 0 0 374.393 3.510 20 5 FHBDRN C[C@@H](CC(=O)c1cccs1)NC(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000161003150 932530307 /nfs/dbraw/zinc/53/03/07/932530307.db2.gz KFVOZKGZOKRSED-NSHDSACASA-N 0 0 364.448 3.526 20 5 FHBDRN COCCCOc1cc(C)ccc1CNC(=O)c1cccc([N+](=O)[O-])c1C ZINC000127282203 932575415 /nfs/dbraw/zinc/57/54/15/932575415.db2.gz FTKKDQSUPXMPOC-UHFFFAOYSA-N 0 0 372.421 3.557 20 5 FHBDRN Cc1ccccc1Nc1nc(Cn2cc([N+](=O)[O-])cc(C)c2=O)cs1 ZINC000127276031 932576314 /nfs/dbraw/zinc/57/63/14/932576314.db2.gz PJSYTABLNZCENY-UHFFFAOYSA-N 0 0 356.407 3.622 20 5 FHBDRN CC(C)[C@@H]1CC[C@@H](C)C[C@H]1CNC(=O)CN(C)c1ccccc1[N+](=O)[O-] ZINC001125532537 932607548 /nfs/dbraw/zinc/60/75/48/932607548.db2.gz QQGWNKXDVJUIKD-IKGGRYGDSA-N 0 0 361.486 3.856 20 5 FHBDRN COc1ccc(OC)c(NC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)c1 ZINC000023132290 932615487 /nfs/dbraw/zinc/61/54/87/932615487.db2.gz QBAWTHGIPUVNOS-NSHDSACASA-N 0 0 362.407 3.731 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)N[C@@H]1CC[C@H](c2ccc(F)cc2)C1 ZINC000471687649 932618271 /nfs/dbraw/zinc/61/82/71/932618271.db2.gz YERNMIBITCCXCR-DOTOQJQBSA-N 0 0 357.385 3.869 20 5 FHBDRN CC1(C)[C@H](NC(=O)Cc2cccc([N+](=O)[O-])c2)C[C@@H]1OCc1ccccc1 ZINC000471692890 932631127 /nfs/dbraw/zinc/63/11/27/932631127.db2.gz LCIZQXJPJDWKTK-MOPGFXCFSA-N 0 0 368.433 3.637 20 5 FHBDRN COc1ccc(CC(=O)N(CC(C)(C)C)c2ccccn2)cc1[N+](=O)[O-] ZINC000891498961 932659308 /nfs/dbraw/zinc/65/93/08/932659308.db2.gz FQBWWFRPJGGEAC-UHFFFAOYSA-N 0 0 357.410 3.620 20 5 FHBDRN Cc1ccc(-c2cccnc2)cc1NC(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000477518438 932664323 /nfs/dbraw/zinc/66/43/23/932664323.db2.gz HXKQVBVMAOYSRO-UHFFFAOYSA-N 0 0 363.373 3.983 20 5 FHBDRN COC(=O)c1ccc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)cc1F ZINC000178147040 932669565 /nfs/dbraw/zinc/66/95/65/932669565.db2.gz MREGDYSKWXTIBU-UHFFFAOYSA-N 0 0 374.349 3.988 20 5 FHBDRN Cc1ccc2c(c1)N(C(=O)CCNc1ccccc1[N+](=O)[O-])C[C@@H](C)O2 ZINC000477551844 932680545 /nfs/dbraw/zinc/68/05/45/932680545.db2.gz RTQCYJDUCKQYKS-CQSZACIVSA-N 0 0 355.394 3.519 20 5 FHBDRN Cc1cc(C(=O)NCCc2cn(C)c3cc(F)ccc23)ccc1[N+](=O)[O-] ZINC000471710484 932681596 /nfs/dbraw/zinc/68/15/96/932681596.db2.gz BMCXXUDKEHDLPV-UHFFFAOYSA-N 0 0 355.369 3.507 20 5 FHBDRN CC1(C)[C@H](NC(=O)c2csc([N+](=O)[O-])c2)C[C@@H]1OCc1ccccc1 ZINC000471715980 932691699 /nfs/dbraw/zinc/69/16/99/932691699.db2.gz MAFSCTIEKOIYON-CABCVRRESA-N 0 0 360.435 3.770 20 5 FHBDRN CCOC(=O)N[C@H]1CCCN(c2c(Cl)cc([N+](=O)[O-])cc2Cl)C1 ZINC000302051017 932731255 /nfs/dbraw/zinc/73/12/55/932731255.db2.gz XGOKNOMYPILUJX-VIFPVBQESA-N 0 0 362.213 3.617 20 5 FHBDRN Cc1ccc([C@H]2CCN(C(=O)NCCc3ccc([N+](=O)[O-])cc3)C2)c(C)c1 ZINC000471736845 932743818 /nfs/dbraw/zinc/74/38/18/932743818.db2.gz MVKRFWQPLSWXAR-SFHVURJKSA-N 0 0 367.449 3.953 20 5 FHBDRN Cc1csc([C@H](NC(=O)[C@@H]2C[C@@H]2c2cccc([N+](=O)[O-])c2)C2CC2)n1 ZINC000933510714 932747175 /nfs/dbraw/zinc/74/71/75/932747175.db2.gz XFXNMEVLSLBFER-BZUAXINKSA-N 0 0 357.435 3.731 20 5 FHBDRN CCCN(CC(=O)Nc1ccccc1OC)Cc1cccc([N+](=O)[O-])c1C ZINC000051255900 932761234 /nfs/dbraw/zinc/76/12/34/932761234.db2.gz UKTKXPUCQZUCFM-UHFFFAOYSA-N 0 0 371.437 3.763 20 5 FHBDRN CC[C@@H](C(=O)O[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000003446459 932761254 /nfs/dbraw/zinc/76/12/54/932761254.db2.gz JHRALTZMKKAFDP-CXAGYDPISA-N 0 0 356.378 3.659 20 5 FHBDRN CC[C@H](OC(=O)[C@@H](C)OC[C@@H]1CCCCO1)c1cccc([N+](=O)[O-])c1 ZINC001266835574 932811213 /nfs/dbraw/zinc/81/12/13/932811213.db2.gz IQGZKMNFNZFKER-COXVUDFISA-N 0 0 351.399 3.563 20 5 FHBDRN O=[N+]([O-])c1cc2ccccc2nc1NCc1nnc(C2CC2)n1C1CC1 ZINC000276645080 932816737 /nfs/dbraw/zinc/81/67/37/932816737.db2.gz PYIDVMARLOZICE-UHFFFAOYSA-N 0 0 350.382 3.559 20 5 FHBDRN CCc1ccc([C@H](NCCOCC(F)F)c2ccc([N+](=O)[O-])cc2)o1 ZINC000471763814 932827843 /nfs/dbraw/zinc/82/78/43/932827843.db2.gz XOWBROIZTDUOCV-QGZVFWFLSA-N 0 0 354.353 3.711 20 5 FHBDRN COc1ccc(Cl)cc1NC(=O)CN(C)c1c(C)cccc1[N+](=O)[O-] ZINC000548290522 932843711 /nfs/dbraw/zinc/84/37/11/932843711.db2.gz JKOXFHYWSLTFFF-UHFFFAOYSA-N 0 0 363.801 3.640 20 5 FHBDRN CCOc1cc(/C=C\C(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)ccc1O ZINC000255375101 932868373 /nfs/dbraw/zinc/86/83/73/932868373.db2.gz OYCPSOKBOCOYRE-SDQBBNPISA-N 0 0 370.405 3.764 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)N[C@@H](C)Cc2ccc(O)cc2)cc1[N+](=O)[O-] ZINC000175970206 932891643 /nfs/dbraw/zinc/89/16/43/932891643.db2.gz LYVYPIWPOQDYLK-KBPBESRZSA-N 0 0 357.410 3.600 20 5 FHBDRN Cc1ccccc1[C@@H](NC(=O)COc1ccc([N+](=O)[O-])c(C)c1)C1CC1 ZINC000430681622 932895622 /nfs/dbraw/zinc/89/56/22/932895622.db2.gz FGUZCGFIMUCHRB-FQEVSTJZSA-N 0 0 354.406 3.858 20 5 FHBDRN CC1(C)CCC(CNC(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000135325230 932913465 /nfs/dbraw/zinc/91/34/65/932913465.db2.gz KHMJNQBIMORHNG-UHFFFAOYSA-N 0 0 367.833 3.519 20 5 FHBDRN COc1ccc(OC(=O)/C(C)=C\c2ccc([N+](=O)[O-])cc2)c([N+](=O)[O-])c1 ZINC000588435408 932928989 /nfs/dbraw/zinc/92/89/89/932928989.db2.gz KUNMUNBQACLHJN-LUAWRHEFSA-N 0 0 358.306 3.521 20 5 FHBDRN CCOc1ccc(C(=O)N2Cc3ccccc3C(F)(F)C2)cc1[N+](=O)[O-] ZINC000610918707 932930863 /nfs/dbraw/zinc/93/08/63/932930863.db2.gz STFFUZDPABBNSG-UHFFFAOYSA-N 0 0 362.332 3.741 20 5 FHBDRN CCOc1cccc([C@H](C)NC(=O)[C@@H]2C[C@@H]2c2cccc([N+](=O)[O-])c2)c1 ZINC001125542207 932942052 /nfs/dbraw/zinc/94/20/52/932942052.db2.gz WLBXMJFLIWOIKO-MJXNMMHHSA-N 0 0 354.406 3.974 20 5 FHBDRN COCCC1(CNC(=O)CSc2ccc([N+](=O)[O-])cc2)CCCCC1 ZINC000187493496 932944565 /nfs/dbraw/zinc/94/45/65/932944565.db2.gz YKJLOBMFUQDZSJ-UHFFFAOYSA-N 0 0 366.483 3.790 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(NC(=O)C2CC2)cc1 ZINC000588436306 932947745 /nfs/dbraw/zinc/94/77/45/932947745.db2.gz GOBWGXUDNXCCKD-SEYXRHQNSA-N 0 0 365.389 3.985 20 5 FHBDRN C[C@@H](NC(=O)c1ccc([N+](=O)[O-])cn1)c1ccc(Oc2cccnc2)cc1 ZINC000581904878 932954043 /nfs/dbraw/zinc/95/40/43/932954043.db2.gz GPALWJJOAOPKSU-CYBMUJFWSA-N 0 0 364.361 3.668 20 5 FHBDRN CCCNC(=O)c1cccc(NC(=O)/C(C)=C\c2ccc([N+](=O)[O-])cc2)c1 ZINC000588436928 932956267 /nfs/dbraw/zinc/95/62/67/932956267.db2.gz OAZOEYHCLGLCOW-OWBHPGMISA-N 0 0 367.405 3.777 20 5 FHBDRN CN(Cc1cc([N+](=O)[O-])ccc1Cl)C[C@@H](O)c1c(F)cccc1F ZINC000051287075 932960171 /nfs/dbraw/zinc/96/01/71/932960171.db2.gz MFUVUHPGYNLPFY-OAHLLOKOSA-N 0 0 356.756 3.692 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)Oc1cc(C(=O)N(C)C)ccc1C ZINC000588436967 932965420 /nfs/dbraw/zinc/96/54/20/932965420.db2.gz MZOYUHDZGCOSMH-KAMYIIQDSA-N 0 0 368.389 3.614 20 5 FHBDRN CCOc1cccc(CNc2nc(C)ccc2[N+](=O)[O-])c1OC(F)F ZINC000178256824 932992027 /nfs/dbraw/zinc/99/20/27/932992027.db2.gz XULCWKUIYAQOMZ-UHFFFAOYSA-N 0 0 353.325 3.910 20 5 FHBDRN CCS[C@H](C)c1noc(CN(C)[C@@H](C)c2cccc([N+](=O)[O-])c2)n1 ZINC000178269116 933003932 /nfs/dbraw/zinc/00/39/32/933003932.db2.gz GEHPUARQBIYJCZ-NWDGAFQWSA-N 0 0 350.444 3.985 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)CSc2ccc(C)cc2)c1 ZINC000187593844 933016777 /nfs/dbraw/zinc/01/67/77/933016777.db2.gz OLZRMLRHPNCSGZ-CYBMUJFWSA-N 0 0 360.435 3.822 20 5 FHBDRN Cn1ncc([N+](=O)[O-])c1C(=O)NC1(c2ccc(Cl)cc2)CCCCC1 ZINC000165904914 933051267 /nfs/dbraw/zinc/05/12/67/933051267.db2.gz AAKOTMMOYHNTJS-UHFFFAOYSA-N 0 0 362.817 3.571 20 5 FHBDRN CNC(=O)c1ccc(Cl)cc1NC(=O)/C(C)=C\c1ccc([N+](=O)[O-])cc1 ZINC000588438071 933057597 /nfs/dbraw/zinc/05/75/97/933057597.db2.gz RYVMEEOCSXLUBU-LUAWRHEFSA-N 0 0 373.796 3.650 20 5 FHBDRN COc1ccc(CCNC(=O)/C(C)=C\c2ccc([N+](=O)[O-])cc2)cc1F ZINC000588438410 933058211 /nfs/dbraw/zinc/05/82/11/933058211.db2.gz AMGWVPZNMZBISY-QBFSEMIESA-N 0 0 358.369 3.505 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc([S@](C)=O)c(F)c1 ZINC000588439346 933065148 /nfs/dbraw/zinc/06/51/48/933065148.db2.gz UNBQVTWBBHYSKS-ZVDPHFIASA-N 0 0 362.382 3.513 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc([S@@](C)=O)c(F)c1 ZINC000588439345 933065306 /nfs/dbraw/zinc/06/53/06/933065306.db2.gz UNBQVTWBBHYSKS-WNFFGTKGSA-N 0 0 362.382 3.513 20 5 FHBDRN COc1cccc2c1CC[C@@H]2NC(=O)/C(C)=C\c1ccc([N+](=O)[O-])cc1 ZINC000588440161 933069393 /nfs/dbraw/zinc/06/93/93/933069393.db2.gz FAPIFZXRHOUUKD-SQVRQVGWSA-N 0 0 352.390 3.810 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(-n2cnnc2C)c1 ZINC000588441118 933071765 /nfs/dbraw/zinc/07/17/65/933071765.db2.gz ASPKBSNMUDJWSC-RAXLEYEMSA-N 0 0 363.377 3.526 20 5 FHBDRN CN(C[C@@H](O)C1CC1)C(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000610572260 933128380 /nfs/dbraw/zinc/12/83/80/933128380.db2.gz MNBBKHRSVBXRQO-GOSISDBHSA-N 0 0 371.393 3.622 20 5 FHBDRN Cn1ncc([N+](=O)[O-])c1NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 ZINC000891761415 933137022 /nfs/dbraw/zinc/13/70/22/933137022.db2.gz BUDXBLRNGGBIOS-BQBZGAKWSA-N 0 0 360.258 3.650 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N[C@H](C)c1nc2ccccc2n1C ZINC000588445792 933142061 /nfs/dbraw/zinc/14/20/61/933142061.db2.gz HREUHXXHELUZCF-WUFNSSIPSA-N 0 0 364.405 3.762 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N1CCO[C@](C)(c2ccccc2)C1 ZINC000588446479 933162003 /nfs/dbraw/zinc/16/20/03/933162003.db2.gz NTOPDZWBRFHIND-XLEIFJPLSA-N 0 0 366.417 3.772 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H](C)CCc1ccc(O)cc1 ZINC000588446830 933163738 /nfs/dbraw/zinc/16/37/38/933163738.db2.gz ACNSHMMWQYJUQG-PLFFATQSSA-N 0 0 354.406 3.841 20 5 FHBDRN CC(=Cc1ccc([N+](=O)[O-])cc1)C(=O)OCCc1c[nH]nc1C(F)(F)F ZINC000588447104 933172523 /nfs/dbraw/zinc/17/25/23/933172523.db2.gz RTDFNYQVCWBQSL-CSKARUKUSA-N 0 0 369.299 3.526 20 5 FHBDRN C[C@H](c1ccccc1)N(C1CC1)S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000510537646 933200092 /nfs/dbraw/zinc/20/00/92/933200092.db2.gz IYQPVQPCHYGPJG-CQSZACIVSA-N 0 0 360.435 3.650 20 5 FHBDRN C[C@H]1CC[C@@H](c2ccccc2)N(S(=O)(=O)c2ccc([N+](=O)[O-])s2)C1 ZINC000510557407 933223605 /nfs/dbraw/zinc/22/36/05/933223605.db2.gz DPXCRZOADKZFPP-JSGCOSHPSA-N 0 0 366.464 3.818 20 5 FHBDRN O=C(CO[C@@H]1CCCc2ccccc21)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000430785379 933230016 /nfs/dbraw/zinc/23/00/16/933230016.db2.gz VBWWROYYBNNWHP-HXUWFJFHSA-N 0 0 366.417 3.574 20 5 FHBDRN Cc1cc(OCC(=O)N[C@@H](C)c2ccc3ncsc3c2)ccc1[N+](=O)[O-] ZINC000430787793 933231250 /nfs/dbraw/zinc/23/12/50/933231250.db2.gz JEFUMKPPHOBTRG-LBPRGKRZSA-N 0 0 371.418 3.769 20 5 FHBDRN Cc1cc(OCC(=O)N2c3ccccc3SC[C@H]2C)ccc1[N+](=O)[O-] ZINC000430782395 933235866 /nfs/dbraw/zinc/23/58/66/933235866.db2.gz IMENIICQVUZRAV-CYBMUJFWSA-N 0 0 358.419 3.809 20 5 FHBDRN Cc1cc(OCC(=O)Nc2cccc(-c3ncco3)c2)ccc1[N+](=O)[O-] ZINC000430790710 933240195 /nfs/dbraw/zinc/24/01/95/933240195.db2.gz JIVIQCQINPRKDG-UHFFFAOYSA-N 0 0 353.334 3.576 20 5 FHBDRN Cc1cc(OCC(=O)Nc2cc3c(cc2Cl)CCC3=O)ccc1[N+](=O)[O-] ZINC000430799059 933245623 /nfs/dbraw/zinc/24/56/23/933245623.db2.gz KFMLLYPOYPJISF-UHFFFAOYSA-N 0 0 374.780 3.703 20 5 FHBDRN Cc1cc(OCC(=O)N2CCc3ccc(Cl)cc3C2)ccc1[N+](=O)[O-] ZINC000430799081 933245807 /nfs/dbraw/zinc/24/58/07/933245807.db2.gz KLYYJAPSTVRSQI-UHFFFAOYSA-N 0 0 360.797 3.520 20 5 FHBDRN Cc1cc(OCC(=O)N(CC(F)F)c2ccccc2)ccc1[N+](=O)[O-] ZINC000430825158 933266461 /nfs/dbraw/zinc/26/64/61/933266461.db2.gz XSYJNSAWEQFWOZ-UHFFFAOYSA-N 0 0 350.321 3.580 20 5 FHBDRN O=C(NCc1c(F)cc(F)c(F)c1F)c1c(Cl)cccc1[N+](=O)[O-] ZINC000430829818 933275509 /nfs/dbraw/zinc/27/55/09/933275509.db2.gz IFKXDJBZYLUJAU-UHFFFAOYSA-N 0 0 362.666 3.735 20 5 FHBDRN Cc1cc(OCC(=O)N[C@@H]2CCCc3ccc(F)cc32)ccc1[N+](=O)[O-] ZINC000430831804 933282934 /nfs/dbraw/zinc/28/29/34/933282934.db2.gz VVKZLYJKXDGDBF-QGZVFWFLSA-N 0 0 358.369 3.615 20 5 FHBDRN O=[N+]([O-])c1ccc2oc(CN(Cc3cccs3)C[C@@H]3CCCO3)nc2c1 ZINC000610580899 933312052 /nfs/dbraw/zinc/31/20/52/933312052.db2.gz WRDSUBXVRQHQNT-AWEZNQCLSA-N 0 0 373.434 3.979 20 5 FHBDRN C[C@H](c1cccc([N+](=O)[O-])c1)N1C(=O)[C@H]2C[C@@H](C3CCCCC3)CN2C1=O ZINC000430884947 933363316 /nfs/dbraw/zinc/36/33/16/933363316.db2.gz YNWOPGRBBVPGAF-MZMPZRCHSA-N 0 0 371.437 3.889 20 5 FHBDRN C[C@H](c1cccc([N+](=O)[O-])c1)N1C(=O)[C@H]2C[C@H](C3CCCCC3)CN2C1=O ZINC000430884949 933363338 /nfs/dbraw/zinc/36/33/38/933363338.db2.gz YNWOPGRBBVPGAF-RPVQJOFSSA-N 0 0 371.437 3.889 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)Nc1cccc(Cl)c1OC ZINC000510655409 933366799 /nfs/dbraw/zinc/36/67/99/933366799.db2.gz BBKZYRXBBGDUGT-UHFFFAOYSA-N 0 0 365.773 3.587 20 5 FHBDRN CC(C)(NC(=O)c1cc(-c2cccs2)on1)c1ccc([N+](=O)[O-])cc1 ZINC000430889981 933371546 /nfs/dbraw/zinc/37/15/46/933371546.db2.gz QRLIMRFQBPQEBU-UHFFFAOYSA-N 0 0 357.391 3.976 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1CN1CCO[C@]2(CCc3ccccc32)C1 ZINC000510660063 933376864 /nfs/dbraw/zinc/37/68/64/933376864.db2.gz CGTIDUFTPHVHRT-OAQYLSRUSA-N 0 0 368.433 3.667 20 5 FHBDRN COc1ccc(-c2ccc(CN3CCO[C@@H]4CCC[C@H]43)o2)c([N+](=O)[O-])c1 ZINC000510693844 933441655 /nfs/dbraw/zinc/44/16/55/933441655.db2.gz UBQRXOPFDIWEES-VQIMIIECSA-N 0 0 358.394 3.617 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CN1CC[C@@H](OCCCc2ccccc2)C1 ZINC000430943000 933455770 /nfs/dbraw/zinc/45/57/70/933455770.db2.gz NUPASIHHSGGNKI-HXUWFJFHSA-N 0 0 370.449 3.827 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)N[C@@H]2C[C@@]2(C)c2ccccc2)cc1[N+](=O)[O-] ZINC000610594886 933472656 /nfs/dbraw/zinc/47/26/56/933472656.db2.gz DNSBHTNRKKLYPS-QMIHWGKISA-N 0 0 353.422 3.994 20 5 FHBDRN COc1cc(C(=O)O[C@@H](C)c2cc(F)ccc2C)c([N+](=O)[O-])cc1OC ZINC001266905203 933482871 /nfs/dbraw/zinc/48/28/71/933482871.db2.gz GPDSVIFDUXZXPB-NSHDSACASA-N 0 0 363.341 3.978 20 5 FHBDRN COc1ccc(COCCC(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000610599263 933491171 /nfs/dbraw/zinc/49/11/71/933491171.db2.gz BMOGIZMHFWAGRS-HNNXBMFYSA-N 0 0 372.421 3.696 20 5 FHBDRN O=[N+]([O-])c1ccccc1OCCN1C[C@@H](C(F)(F)F)[C@H](C(F)(F)F)C1 ZINC000610604700 933512887 /nfs/dbraw/zinc/51/28/87/933512887.db2.gz HCKDWJOMUINFPV-NXEZZACHSA-N 0 0 372.265 3.646 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N2C[C@H](C(F)(F)F)[C@H](C(F)(F)F)C2)c1 ZINC000610605538 933512993 /nfs/dbraw/zinc/51/29/93/933512993.db2.gz SGXDKCSJGMYMCO-AOOOYVTPSA-N 0 0 370.249 3.716 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1F)N1CCO[C@@H](c2ccc(Cl)cc2)C1 ZINC000131273169 933519539 /nfs/dbraw/zinc/51/95/39/933519539.db2.gz YXBGOZMJSYSCJX-MRXNPFEDSA-N 0 0 364.760 3.601 20 5 FHBDRN COC(=O)c1ccc(F)c(COc2ccc([N+](=O)[O-])c3ncccc23)c1 ZINC000471892810 933531184 /nfs/dbraw/zinc/53/11/84/933531184.db2.gz MNFVTQALUILLQL-UHFFFAOYSA-N 0 0 356.309 3.648 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)c2ccc3c(c2)CCCC(=O)N3)cc1[N+](=O)[O-] ZINC000610620907 933539467 /nfs/dbraw/zinc/53/94/67/933539467.db2.gz ZGGXHPSXHQEWON-ZDUSSCGKSA-N 0 0 367.405 3.669 20 5 FHBDRN CN(C(=O)c1cc2cc([N+](=O)[O-])ccc2o1)[C@H]1CCc2ccccc2C1 ZINC000510727469 933565488 /nfs/dbraw/zinc/56/54/88/933565488.db2.gz RGTRYPYNLHBEQQ-INIZCTEOSA-N 0 0 350.374 3.971 20 5 FHBDRN Cc1cccc2oc(CCNC(=O)[C@H]3C[C@H]3c3cccc([N+](=O)[O-])c3)nc21 ZINC000933822627 933577861 /nfs/dbraw/zinc/57/78/61/933577861.db2.gz QKDLEDZFZOYPHW-HOTGVXAUSA-N 0 0 365.389 3.507 20 5 FHBDRN CC(C)c1c(C(=O)Nc2cc(F)cc([N+](=O)[O-])c2)cnn1-c1ccccn1 ZINC000548421672 933592042 /nfs/dbraw/zinc/59/20/42/933592042.db2.gz YBVSOKDXOQBJOR-UHFFFAOYSA-N 0 0 369.356 3.690 20 5 FHBDRN CCc1ccc(C(=O)OCC(=O)Nc2cc([N+](=O)[O-])ccc2Cl)cc1 ZINC000003489965 933600974 /nfs/dbraw/zinc/60/09/74/933600974.db2.gz KHXRDSPOUFYJHM-UHFFFAOYSA-N 0 0 362.769 3.606 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1C[C@H]1c1ccccc1F ZINC000458043246 933609148 /nfs/dbraw/zinc/60/91/48/933609148.db2.gz PXNAXMVPFBLCCB-XQAQDONZSA-N 0 0 360.410 3.887 20 5 FHBDRN CCCCCN(Cc1ccc(F)cc1)C(=O)c1c([N+](=O)[O-])c(C)nn1C ZINC000098097888 933626839 /nfs/dbraw/zinc/62/68/39/933626839.db2.gz IUELUULFCPHXTE-UHFFFAOYSA-N 0 0 362.405 3.608 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H](C)c1ccc(NC(=O)C2CC2)cc1 ZINC000510754086 933636304 /nfs/dbraw/zinc/63/63/04/933636304.db2.gz NEGLOXDKHWQBMR-ZDUSSCGKSA-N 0 0 367.405 3.743 20 5 FHBDRN Cc1nn(C)c(C(=O)NCC2(c3cccc(C)c3)CCCCC2)c1[N+](=O)[O-] ZINC000098099122 933639323 /nfs/dbraw/zinc/63/93/23/933639323.db2.gz ZQSHMGYAQBEKRL-UHFFFAOYSA-N 0 0 370.453 3.577 20 5 FHBDRN CC(C)[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1Cl)C(=O)OC(C)(C)C ZINC000843589357 933648262 /nfs/dbraw/zinc/64/82/62/933648262.db2.gz CIIAYCBXNQMDBI-GFCCVEGCSA-N 0 0 356.806 3.801 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)N[C@H](c1cccs1)C1CC1 ZINC000477841386 933652087 /nfs/dbraw/zinc/65/20/87/933652087.db2.gz GSEKRSWUOHILFL-KRWDZBQOSA-N 0 0 359.451 3.992 20 5 FHBDRN O=C(c1cccc([N+](=O)[O-])c1)N1CC(Cc2ccc(C(F)(F)F)cc2)C1 ZINC000610660176 933679598 /nfs/dbraw/zinc/67/95/98/933679598.db2.gz GZLFGIDGWSQUGO-UHFFFAOYSA-N 0 0 364.323 3.928 20 5 FHBDRN CCS[C@@H]1CCCC[C@@H]1NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1C ZINC000176113128 933679811 /nfs/dbraw/zinc/67/98/11/933679811.db2.gz IFVKOJKEWWWRKW-DZGCQCFKSA-N 0 0 367.427 3.606 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])[nH]1)N1CCC[C@H]1c1ccccc1Br ZINC000610669759 933705027 /nfs/dbraw/zinc/70/50/27/933705027.db2.gz RNNVRUXCNYUQHA-ZDUSSCGKSA-N 0 0 364.199 3.663 20 5 FHBDRN O=C(Nc1cc(Cl)ccn1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000431034941 933718835 /nfs/dbraw/zinc/71/88/35/933718835.db2.gz AXOSMRCUIMAEMW-UHFFFAOYSA-N 0 0 356.563 3.658 20 5 FHBDRN C[C@@H](NCc1c(F)cc([N+](=O)[O-])cc1F)c1ccc(Br)cn1 ZINC000510790891 933728389 /nfs/dbraw/zinc/72/83/89/933728389.db2.gz JGJDWPVYQLCMLP-MRVPVSSYSA-N 0 0 372.169 3.881 20 5 FHBDRN CC(=O)N1CCCCC[C@H]1C1CCN(c2cc(C)ccc2[N+](=O)[O-])CC1 ZINC000610677579 933752695 /nfs/dbraw/zinc/75/26/95/933752695.db2.gz NVVMCWRIFYJGJD-SFHVURJKSA-N 0 0 359.470 3.911 20 5 FHBDRN Cc1nn(C)c(C(=O)Nc2ccc(Oc3cccc(F)c3)cc2)c1[N+](=O)[O-] ZINC000098100702 933766504 /nfs/dbraw/zinc/76/65/04/933766504.db2.gz RVNXYHMBHHQBJS-UHFFFAOYSA-N 0 0 370.340 3.820 20 5 FHBDRN CCOc1cc(NC(=O)NCc2ccsc2)c([N+](=O)[O-])cc1OCC ZINC000043838235 933775051 /nfs/dbraw/zinc/77/50/51/933775051.db2.gz DEIGXZWGWCZRAU-UHFFFAOYSA-N 0 0 365.411 3.775 20 5 FHBDRN Cc1cc(NC(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)n(C)n1 ZINC000043839074 933775101 /nfs/dbraw/zinc/77/51/01/933775101.db2.gz BSRBKHWZVXLVDP-UHFFFAOYSA-N 0 0 351.366 3.633 20 5 FHBDRN Cc1c(C(=O)NCCc2cccc([N+](=O)[O-])c2)cnn1C1CCCCC1 ZINC000510811531 933779531 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FHBDRN O=C(N1CCCc2c([N+](=O)[O-])cccc21)[C@@]1(c2ccccc2)C[C@H](F)C1 ZINC001266960770 934091611 /nfs/dbraw/zinc/09/16/11/934091611.db2.gz ASDWMXPRGUUZBQ-SGNKCFNYSA-N 0 0 354.381 3.944 20 5 FHBDRN Cc1cc(C)c(OCC(=O)N2CCCc3c([N+](=O)[O-])cccc32)c(C)c1 ZINC001266960919 934094215 /nfs/dbraw/zinc/09/42/15/934094215.db2.gz CHJZCOIYHZCSCB-UHFFFAOYSA-N 0 0 354.406 3.878 20 5 FHBDRN Cc1nc(N[C@H]2CCc3nc(-c4ccccc4)ncc3C2)ccc1[N+](=O)[O-] ZINC000610754879 934096928 /nfs/dbraw/zinc/09/69/28/934096928.db2.gz HCUDWSSTSBSETL-INIZCTEOSA-N 0 0 361.405 3.725 20 5 FHBDRN CCOc1cccc(CCNc2ccc([N+](=O)[O-])c(OC(F)F)c2)n1 ZINC000610755564 934103423 /nfs/dbraw/zinc/10/34/23/934103423.db2.gz WIGULOFJUBHNGQ-UHFFFAOYSA-N 0 0 353.325 3.645 20 5 FHBDRN CCOc1cccc(CCNC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)n1 ZINC000610760515 934114869 /nfs/dbraw/zinc/11/48/69/934114869.db2.gz PPOCFNQOHFVQNA-UHFFFAOYSA-N 0 0 371.418 3.576 20 5 FHBDRN CSCc1cccc(CNC(=O)CCOc2ccccc2[N+](=O)[O-])c1 ZINC000187668065 934137577 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CSc1ccc([N+](=O)[O-])c(C(=O)NCc2c(F)cc(F)cc2F)c1 ZINC000510955572 934224475 /nfs/dbraw/zinc/22/44/75/934224475.db2.gz MXORXBBPVOQFGN-UHFFFAOYSA-N 0 0 356.325 3.664 20 5 FHBDRN Cc1c(NC(=O)[C@@H](C)C(F)(F)F)cc(Br)cc1[N+](=O)[O-] ZINC000431247819 934248818 /nfs/dbraw/zinc/24/88/18/934248818.db2.gz PCIDBKSXHYORPQ-ZCFIWIBFSA-N 0 0 355.110 3.803 20 5 FHBDRN COCCN(C(=O)c1c[nH]c2cccc([N+](=O)[O-])c12)[C@H](C)c1ccccc1 ZINC000535677993 934259183 /nfs/dbraw/zinc/25/91/83/934259183.db2.gz WGCBVAOYGOIDRO-CQSZACIVSA-N 0 0 367.405 3.926 20 5 FHBDRN O=C(Nc1scnc1C1CC1)c1ccc([N+](=O)[O-])cc1Br ZINC000535669434 934262490 /nfs/dbraw/zinc/26/24/90/934262490.db2.gz NVYFHEVFWYKAST-UHFFFAOYSA-N 0 0 368.212 3.944 20 5 FHBDRN O=C(NCCc1nc2ccccc2s1)c1c[nH]c2cccc([N+](=O)[O-])c21 ZINC000535695559 934288131 /nfs/dbraw/zinc/28/81/31/934288131.db2.gz AVLYPPDFGNEJRC-UHFFFAOYSA-N 0 0 366.402 3.658 20 5 FHBDRN CC[C@@H](CNC(=O)c1c[nH]c2cccc([N+](=O)[O-])c21)Oc1cccc(F)c1 ZINC000535696529 934289791 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363.391 3.862 20 5 FHBDRN CCCn1ncc(C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1C1CC1 ZINC000157481583 935082897 /nfs/dbraw/zinc/08/28/97/935082897.db2.gz AQTQPQINDTUGRQ-CYBMUJFWSA-N 0 0 356.426 3.878 20 5 FHBDRN O=[N+]([O-])c1ccccc1OCCSc1n[nH]c(Cc2cccs2)n1 ZINC000071961780 935099727 /nfs/dbraw/zinc/09/97/27/935099727.db2.gz NIKYRBXWNIQDFL-UHFFFAOYSA-N 0 0 362.436 3.536 20 5 FHBDRN COCCN(Cc1cccs1)C(=O)N[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000539247312 935109647 /nfs/dbraw/zinc/10/96/47/935109647.db2.gz WWPZVTLMAFTROL-CYBMUJFWSA-N 0 0 363.439 3.576 20 5 FHBDRN CCc1ccc(-c2nc(-c3cccc(N4CCC4=O)c3)no2)cc1[N+](=O)[O-] ZINC000438823266 945078875 /nfs/dbraw/zinc/07/88/75/945078875.db2.gz YSAWKXFELAFSDU-UHFFFAOYSA-N 0 0 364.361 3.611 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H]1C[C@H]1c1ccc(F)cc1 ZINC000439899351 945080282 /nfs/dbraw/zinc/08/02/82/945080282.db2.gz JTLXOCWGYWGRHR-LSDHHAIUSA-N 0 0 359.357 3.810 20 5 FHBDRN COc1ccccc1[C@@H]1CCCN1C(=O)Cc1cccc([N+](=O)[O-])c1C ZINC000119737349 935164205 /nfs/dbraw/zinc/16/42/05/935164205.db2.gz VYRSOLYLRXUGKT-SFHVURJKSA-N 0 0 354.406 3.818 20 5 FHBDRN C[C@H](Oc1cccc(F)c1)C(=O)Nc1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000084776414 935168654 /nfs/dbraw/zinc/16/86/54/935168654.db2.gz JFRXPENMUQQGMC-NSHDSACASA-N 0 0 355.325 3.688 20 5 FHBDRN O=C(Nc1ccc2cc([N+](=O)[O-])ccc2n1)C1(c2ccc(F)cc2)CC1 ZINC000084776614 935169472 /nfs/dbraw/zinc/16/94/72/935169472.db2.gz WHNACSXWAMUOMW-UHFFFAOYSA-N 0 0 351.337 3.952 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N1CC[C@@H](CC(F)(F)F)C1 ZINC000277438556 935174926 /nfs/dbraw/zinc/17/49/26/935174926.db2.gz NCAVLNULVKBDII-VIFPVBQESA-N 0 0 350.724 3.971 20 5 FHBDRN CCN(Cc1ccccc1)C(=O)[C@H](C)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000511062218 935197013 /nfs/dbraw/zinc/19/70/13/935197013.db2.gz CQEDDUBDQYBZAW-KRWDZBQOSA-N 0 0 369.465 3.506 20 5 FHBDRN CCN(Cc1ccc(OC)cc1)C(=O)C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000431348208 935219567 /nfs/dbraw/zinc/21/95/67/935219567.db2.gz FBDLLVVSKUPLPN-UHFFFAOYSA-N 0 0 356.422 3.930 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)cc(Cl)c1N1CC[C@@H]([C@@H](O)C(F)(F)F)C1 ZINC000450880374 935233078 /nfs/dbraw/zinc/23/30/78/935233078.db2.gz LAXFMCZELHNXMN-KSBSHMNSSA-N 0 0 359.131 3.651 20 5 FHBDRN O=C1NCCCN1c1cc(NC/C=C/c2ccccc2[N+](=O)[O-])ccc1F ZINC000582085099 935236490 /nfs/dbraw/zinc/23/64/90/935236490.db2.gz TXXKZBWJHQQYAR-ZZXKWVIFSA-N 0 0 370.384 3.779 20 5 FHBDRN COc1cccc(CC(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)c1 ZINC000014376762 935242640 /nfs/dbraw/zinc/24/26/40/935242640.db2.gz RUYFOHAZAIJYSI-UHFFFAOYSA-N 0 0 369.402 3.908 20 5 FHBDRN CC(C)CCn1cc(C(=O)Nc2ccc(C(C)(C)C)c([N+](=O)[O-])c2)nn1 ZINC000551324010 935250104 /nfs/dbraw/zinc/25/01/04/935250104.db2.gz SCRHAHWVUPWTBN-UHFFFAOYSA-N 0 0 359.430 3.782 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(CN[C@@H](c2ncccc2C)C(C)(C)C)c1 ZINC000934287464 935255081 /nfs/dbraw/zinc/25/50/81/935255081.db2.gz LCFABKWKMXTDLM-SFHVURJKSA-N 0 0 371.437 3.962 20 5 FHBDRN O=[N+]([O-])c1ccc(/C=C\c2cccc(I)c2)nc1 ZINC000551349055 935260760 /nfs/dbraw/zinc/26/07/60/935260760.db2.gz QLBDRUHPMVYXPW-PLNGDYQASA-N 0 0 352.131 3.765 20 5 FHBDRN COc1ccc2c(c1)[C@@H](NC(=O)Nc1cc([N+](=O)[O-])ccc1C)CCO2 ZINC000467101853 935264518 /nfs/dbraw/zinc/26/45/18/935264518.db2.gz KSJWHUVEFVWURI-HNNXBMFYSA-N 0 0 357.366 3.557 20 5 FHBDRN Cc1ccccc1[C@H](C)NC(=O)[C@H](C)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000511074609 935266612 /nfs/dbraw/zinc/26/66/12/935266612.db2.gz VRDXLHVVONXUPK-IRXDYDNUSA-N 0 0 369.465 3.643 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)N1CC[C@@](F)(c2cc(F)cc(F)c2)C1 ZINC000551388639 935274140 /nfs/dbraw/zinc/27/41/40/935274140.db2.gz KKPMFJQUFKSCCE-KRWDZBQOSA-N 0 0 365.311 3.976 20 5 FHBDRN Cc1ccc(CN2CCC[C@@H]2c2nc3c(n2C)CCCC3)cc1[N+](=O)[O-] ZINC000548676894 935274431 /nfs/dbraw/zinc/27/44/31/935274431.db2.gz UBHBTYXYJIHZLE-GOSISDBHSA-N 0 0 354.454 3.853 20 5 FHBDRN CN(C(=O)C1(c2ccccc2Cl)CCOCC1)c1cccc([N+](=O)[O-])c1 ZINC000158018196 935279103 /nfs/dbraw/zinc/27/91/03/935279103.db2.gz JMCGELRZEQTPOP-UHFFFAOYSA-N 0 0 374.824 3.959 20 5 FHBDRN CN(C(=O)c1cccc([N+](=O)[O-])c1)c1ccc(Br)cc1F ZINC000065864305 935282131 /nfs/dbraw/zinc/28/21/31/935282131.db2.gz NROHXBTYRPMFMC-UHFFFAOYSA-N 0 0 353.147 3.773 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])c(Cl)c1)N1CCOC2(C1)CCCCCC2 ZINC000161144489 935294073 /nfs/dbraw/zinc/29/40/73/935294073.db2.gz SCTFZWKNILGVHO-UHFFFAOYSA-N 0 0 352.818 3.814 20 5 FHBDRN Cc1cccc(NC2CCN(C(=O)NCc3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000119874232 935311718 /nfs/dbraw/zinc/31/17/18/935311718.db2.gz XESWPQJHWHDLHH-UHFFFAOYSA-N 0 0 368.437 3.689 20 5 FHBDRN Cc1cc(NS(=O)(=O)Cc2cccc(C(F)(F)F)c2)ccc1[N+](=O)[O-] ZINC000539854576 935316259 /nfs/dbraw/zinc/31/62/59/935316259.db2.gz CXZGQAPJQNGNPF-UHFFFAOYSA-N 0 0 374.340 3.864 20 5 FHBDRN C[C@@H]1CC[C@H](CCC(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)O1 ZINC000551680066 935327548 /nfs/dbraw/zinc/32/75/48/935327548.db2.gz MQVATWHUBLPPDL-NOZJJQNGSA-N 0 0 357.204 3.644 20 5 FHBDRN O=[N+]([O-])c1cccc2c1CCN(c1nn3cc(C4CCCC4)nc3s1)C2 ZINC000548693380 935331179 /nfs/dbraw/zinc/33/11/79/935331179.db2.gz QUXMSKAVZKVYIQ-UHFFFAOYSA-N 0 0 369.450 3.919 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2noc(CN3CCC(CC(F)(F)F)CC3)n2)c1 ZINC000551708530 935331281 /nfs/dbraw/zinc/33/12/81/935331281.db2.gz FNORTVNEFOKNHO-UHFFFAOYSA-N 0 0 370.331 3.809 20 5 FHBDRN C[C@@H]1[C@@H](C(F)(F)F)CCN1C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000472183075 935337407 /nfs/dbraw/zinc/33/74/07/935337407.db2.gz PLXSJPPIHBJMGB-KCJUWKMLSA-N 0 0 365.739 3.731 20 5 FHBDRN CCN(Cc1ccncc1)C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000051468516 935337797 /nfs/dbraw/zinc/33/77/97/935337797.db2.gz ATONRVFMZUVJQZ-UHFFFAOYSA-N 0 0 368.418 3.776 20 5 FHBDRN Cc1sc2nc3n(c(=O)c2c1C)CC/C3=C\c1ccc([N+](=O)[O-])cc1 ZINC000209976418 935353986 /nfs/dbraw/zinc/35/39/86/935353986.db2.gz WPMISGBIQVBRMQ-UKTHLTGXSA-N 0 0 353.403 3.927 20 5 FHBDRN C[C@H](O)C[C@H](CNC(=O)C(C)(C)c1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000551829964 935357229 /nfs/dbraw/zinc/35/72/29/935357229.db2.gz ZBVVYDHCHFQXTN-DOTOQJQBSA-N 0 0 370.449 3.543 20 5 FHBDRN Cc1c(Cl)cc(S(=O)(=O)N(C)c2ccccc2F)cc1[N+](=O)[O-] ZINC000119947924 935357846 /nfs/dbraw/zinc/35/78/46/935357846.db2.gz OHZHFFRHGNXUSX-UHFFFAOYSA-N 0 0 358.778 3.521 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])Cc1ccn(-c2ccc(F)cc2)n1 ZINC000511087920 935364844 /nfs/dbraw/zinc/36/48/44/935364844.db2.gz DAAHGDPFXFHLOM-UHFFFAOYSA-N 0 0 354.385 3.594 20 5 FHBDRN Cc1cc(OCC(=O)N2CCCCC[C@@H]2c2cccn2C)ccc1[N+](=O)[O-] ZINC000431372358 935381459 /nfs/dbraw/zinc/38/14/59/935381459.db2.gz WQNRWXSPQBKFCS-LJQANCHMSA-N 0 0 371.437 3.764 20 5 FHBDRN Cc1c(NC(=O)N(C[C@H](C)c2ccccc2)[C@@H](C)CO)cccc1[N+](=O)[O-] ZINC000562024445 935385761 /nfs/dbraw/zinc/38/57/61/935385761.db2.gz JRCFGSCKKZZUNA-GJZGRUSLSA-N 0 0 371.437 3.922 20 5 FHBDRN COc1cc(Cc2noc(CCc3cccc(C)c3)n2)ccc1[N+](=O)[O-] ZINC000545056343 935387427 /nfs/dbraw/zinc/38/74/27/935387427.db2.gz YJBWYXQVZYBCNZ-UHFFFAOYSA-N 0 0 353.378 3.671 20 5 FHBDRN C[C@@H](NC(=O)CSc1ccc([N+](=O)[O-])cc1)c1ccc(F)c(F)c1 ZINC000014575338 935391219 /nfs/dbraw/zinc/39/12/19/935391219.db2.gz REDFPCFDESDENI-SNVBAGLBSA-N 0 0 352.362 3.843 20 5 FHBDRN CCc1ccc(C(=O)Nc2cn(C)nc2-c2ccccc2)cc1[N+](=O)[O-] ZINC000091144640 935395081 /nfs/dbraw/zinc/39/50/81/935395081.db2.gz MUPOQFFDHJQTAK-UHFFFAOYSA-N 0 0 350.378 3.810 20 5 FHBDRN C[C@@H](NCc1cc([N+](=O)[O-])cc2c1OCOC2)c1c(F)cccc1F ZINC000263683671 935396869 /nfs/dbraw/zinc/39/68/69/935396869.db2.gz NJDZWXGPIGUDQC-SNVBAGLBSA-N 0 0 350.321 3.590 20 5 FHBDRN CC[C@@H](NC(=O)c1cc([N+](=O)[O-])c(C)s1)c1ccc2c(c1)OCCO2 ZINC000055965249 935402404 /nfs/dbraw/zinc/40/24/04/935402404.db2.gz MQQCIUJNVLKXIS-GFCCVEGCSA-N 0 0 362.407 3.617 20 5 FHBDRN COCCOc1ccc(F)cc1NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000119988158 935408713 /nfs/dbraw/zinc/40/87/13/935408713.db2.gz WPCWTTYEFZKNQA-UHFFFAOYSA-N 0 0 368.748 3.665 20 5 FHBDRN CC1CCN(c2ccc(C(=O)N(C)c3cccc([N+](=O)[O-])c3)cn2)CC1 ZINC000158207593 935431758 /nfs/dbraw/zinc/43/17/58/935431758.db2.gz ODULGXWHWQHMBD-UHFFFAOYSA-N 0 0 354.410 3.503 20 5 FHBDRN COc1cc(CN2CCS[C@@H](C)[C@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000118415215 935433293 /nfs/dbraw/zinc/43/32/93/935433293.db2.gz DNCNGGLOBKGGOS-ZJUUUORDSA-N 0 0 362.398 3.531 20 5 FHBDRN O=C(C1CCN(c2ccccc2[N+](=O)[O-])CC1)N1CCC[C@@H]2CCCC[C@@H]21 ZINC000014598096 935438295 /nfs/dbraw/zinc/43/82/95/935438295.db2.gz LDPCFHWQCVZALM-WMZOPIPTSA-N 0 0 371.481 3.992 20 5 FHBDRN C[C@@H](Nc1ccc(C(=O)N2CC[C@@H](C)C2)cc1[N+](=O)[O-])c1ccccn1 ZINC000263807494 935456584 /nfs/dbraw/zinc/45/65/84/935456584.db2.gz NJXKSTGVUQZMFX-ZIAGYGMSSA-N 0 0 354.410 3.645 20 5 FHBDRN Cc1ccc(C(C)(C)CNC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2)cc1 ZINC000728483817 935461782 /nfs/dbraw/zinc/46/17/82/935461782.db2.gz CRXOCZGLRNLCDS-UHFFFAOYSA-N 0 0 371.393 3.827 20 5 FHBDRN Cc1c(Cc2noc(-c3cc(N4CCCC4)ccn3)n2)cccc1[N+](=O)[O-] ZINC000582267303 935469241 /nfs/dbraw/zinc/46/92/41/935469241.db2.gz LKNYPOFUVNXYGQ-UHFFFAOYSA-N 0 0 365.393 3.539 20 5 FHBDRN O=C1NCC[C@H]1CCSc1nc2ccccc2c2nc3ccccc3n21 ZINC000582279681 935475345 /nfs/dbraw/zinc/47/53/45/935475345.db2.gz XZTFCYPQKNEWOW-ZDUSSCGKSA-N 0 0 362.458 3.654 20 5 FHBDRN COc1ccc(C(=O)CCCC(=O)Oc2ccc(C)cc2[N+](=O)[O-])cc1 ZINC000051558414 935477776 /nfs/dbraw/zinc/47/77/76/935477776.db2.gz AUDBHRVMLOSEEY-UHFFFAOYSA-N 0 0 357.362 3.870 20 5 FHBDRN Cc1c(CC(=O)NCCSCc2ccccc2F)cccc1[N+](=O)[O-] ZINC000178554575 935485950 /nfs/dbraw/zinc/48/59/50/935485950.db2.gz HWSDWMYPFGEHGG-UHFFFAOYSA-N 0 0 362.426 3.634 20 5 FHBDRN COC(=O)c1cc(C)nc(N2C[C@H](C)C[C@H]2c2ccccc2F)c1[N+](=O)[O-] ZINC000582292938 935496713 /nfs/dbraw/zinc/49/67/13/935496713.db2.gz SZROAQWXYHJAMJ-BZNIZROVSA-N 0 0 373.384 3.811 20 5 FHBDRN O=C(c1cc(F)c(F)cc1[N+](=O)[O-])N1CCC(OC2CCCCC2)CC1 ZINC000263915666 935499626 /nfs/dbraw/zinc/49/96/26/935499626.db2.gz JUDWLRWWPJZSRV-UHFFFAOYSA-N 0 0 368.380 3.827 20 5 FHBDRN CSc1ccc(OS(=O)(=O)c2cc(C)c(F)c([N+](=O)[O-])c2)cc1 ZINC000092979634 935501917 /nfs/dbraw/zinc/50/19/17/935501917.db2.gz CCDAQRYKORILAS-UHFFFAOYSA-N 0 0 357.384 3.532 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H](OC(F)F)C1 ZINC000611586468 935507088 /nfs/dbraw/zinc/50/70/88/935507088.db2.gz OHQOXFPQTYDMIJ-GFCCVEGCSA-N 0 0 374.409 3.941 20 5 FHBDRN Cc1ccc(NC(=O)CNc2cc([N+](=O)[O-])ccc2OC(F)F)cc1F ZINC000511098094 935524996 /nfs/dbraw/zinc/52/49/96/935524996.db2.gz ZAUNERGSJLDOHR-UHFFFAOYSA-N 0 0 369.299 3.694 20 5 FHBDRN COc1ccccc1C[C@@H]1CCCN1C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000120068032 935525483 /nfs/dbraw/zinc/52/54/83/935525483.db2.gz DYXQMTDGCJFLPY-KRWDZBQOSA-N 0 0 355.394 3.842 20 5 FHBDRN CCCCc1nnc(NC(=O)CSc2ccc([N+](=O)[O-])cc2)s1 ZINC000014660999 935527300 /nfs/dbraw/zinc/52/73/00/935527300.db2.gz XRICBAJNEQIJDD-UHFFFAOYSA-N 0 0 352.441 3.520 20 5 FHBDRN C[C@@H]1CCCN(c2ccc(C(=O)Nc3ccc(F)nc3)cc2[N+](=O)[O-])C1 ZINC000135034985 935542436 /nfs/dbraw/zinc/54/24/36/935542436.db2.gz GEOVMESFFRVOJK-GFCCVEGCSA-N 0 0 358.373 3.618 20 5 FHBDRN Cc1cc2sc(NC(=O)Cc3ccc([N+](=O)[O-])cc3F)nc2cc1F ZINC000478082740 935565819 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O=C(Cc1ccc([N+](=O)[O-])cc1F)N[C@H]1CC[C@H](c2cccc(F)c2)C1 ZINC000478227094 935589246 /nfs/dbraw/zinc/58/92/46/935589246.db2.gz LVHRSJMYAPYCDX-BBRMVZONSA-N 0 0 360.360 3.868 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N(C)[C@H]2CCC(C)(C)C2)cc1OC ZINC000478202524 935591879 /nfs/dbraw/zinc/59/18/79/935591879.db2.gz UPJIMVJZEBVCDC-LBPRGKRZSA-N 0 0 350.415 3.653 20 5 FHBDRN O=C(N[C@H]1CC[C@@H](c2cccc(F)c2)C1)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000478257596 935598737 /nfs/dbraw/zinc/59/87/37/935598737.db2.gz UATNDJVVRWDUGS-DOMZBBRYSA-N 0 0 372.352 3.529 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CC[C@H](c3cccc(F)c3)C2)c1 ZINC000478256676 935599451 /nfs/dbraw/zinc/59/94/51/935599451.db2.gz URLCHGBXWMNIOQ-DZGCQCFKSA-N 0 0 358.369 3.809 20 5 FHBDRN CN(C)C(=O)c1cccc(Oc2ccc([N+](=O)[O-])cc2Br)c1 ZINC000478280403 935605448 /nfs/dbraw/zinc/60/54/48/935605448.db2.gz WPRTYDNWFMMKCB-UHFFFAOYSA-N 0 0 365.183 3.851 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)Nc2cnc([C@H](C)CC)nc2)cc1OC ZINC000478288082 935607919 /nfs/dbraw/zinc/60/79/19/935607919.db2.gz GXIDMGGKFZBTST-LLVKDONJSA-N 0 0 374.397 3.558 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)N2CCC(CC)(Cc3ccccc3)CC2)n1 ZINC000478318104 935609579 /nfs/dbraw/zinc/60/95/79/935609579.db2.gz DBIAMOHFPGCYGC-UHFFFAOYSA-N 0 0 370.453 3.686 20 5 FHBDRN Cc1cc(C)c(NC(=O)CN(C)CCc2ccccc2[N+](=O)[O-])c(C)c1 ZINC000511110400 935614786 /nfs/dbraw/zinc/61/47/86/935614786.db2.gz YARKBPJBQMMIPV-UHFFFAOYSA-N 0 0 355.438 3.633 20 5 FHBDRN CCc1cc(Br)ccc1NC(=O)c1cc([N+](=O)[O-])cn1C ZINC000127554388 935621960 /nfs/dbraw/zinc/62/19/60/935621960.db2.gz RQBPNOCJLHXMPA-UHFFFAOYSA-N 0 0 352.188 3.511 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H](CO)c1c(Cl)cccc1Cl ZINC000478440082 935626507 /nfs/dbraw/zinc/62/65/07/935626507.db2.gz URTVCKDULUYDJT-AWEZNQCLSA-N 0 0 369.204 3.673 20 5 FHBDRN COc1cc(OCC(=O)N[C@@H]2CC(C)(C)c3ccccc32)ccc1[N+](=O)[O-] ZINC000158202179 935631744 /nfs/dbraw/zinc/63/17/44/935631744.db2.gz LDLVSOHHPIKQGY-MRXNPFEDSA-N 0 0 370.405 3.521 20 5 FHBDRN CNc1ccc(C(=O)OCCOc2cccc(Cl)c2)cc1[N+](=O)[O-] ZINC000023484430 935634540 /nfs/dbraw/zinc/63/45/40/935634540.db2.gz IPGSDACJOLRRLM-UHFFFAOYSA-N 0 0 350.758 3.526 20 5 FHBDRN Cc1nc(-c2cccc(NC(=O)CCc3cccc([N+](=O)[O-])c3)c2)no1 ZINC000127591733 935640147 /nfs/dbraw/zinc/64/01/47/935640147.db2.gz MCAWRUZQBOWYEG-UHFFFAOYSA-N 0 0 352.350 3.525 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N[C@H](C)c1ccc2c(c1)CC(=O)N2 ZINC000127593493 935644802 /nfs/dbraw/zinc/64/48/02/935644802.db2.gz IAVPPKLRTMFOHJ-GFCCVEGCSA-N 0 0 368.393 3.589 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N[C@@H](C)c1ccc2c(c1)CC(=O)N2 ZINC000127593285 935644911 /nfs/dbraw/zinc/64/49/11/935644911.db2.gz IAVPPKLRTMFOHJ-LBPRGKRZSA-N 0 0 368.393 3.589 20 5 FHBDRN Cc1n[nH]c(C(=O)N2CCC[C@H]2c2cccc3ccccc32)c1[N+](=O)[O-] ZINC000519108760 945115715 /nfs/dbraw/zinc/11/57/15/945115715.db2.gz YHDUGFRZQRWITE-INIZCTEOSA-N 0 0 350.378 3.757 20 5 FHBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])N(CC1CC1)C1CCC1 ZINC000478619738 935671497 /nfs/dbraw/zinc/67/14/97/935671497.db2.gz HOQVOOAQDUOLCA-UHFFFAOYSA-N 0 0 352.818 3.808 20 5 FHBDRN CC(C)c1ncc(NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)cn1 ZINC000478677963 935674852 /nfs/dbraw/zinc/67/48/52/935674852.db2.gz WHAHSKQWXYRXSM-UHFFFAOYSA-N 0 0 365.187 3.523 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H](CO)c1ccccc1 ZINC000507289177 945116848 /nfs/dbraw/zinc/11/68/48/945116848.db2.gz DSDWBPDDHZIMOD-HNNXBMFYSA-N 0 0 374.462 3.603 20 5 FHBDRN CCn1c(SCC2(OC)CCCC2)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000478719701 935686894 /nfs/dbraw/zinc/68/68/94/935686894.db2.gz PQICDWHHRIGRTM-UHFFFAOYSA-N 0 0 362.455 3.925 20 5 FHBDRN CCOc1cc(OCC(=O)Nc2ccc(F)c(Cl)c2)ccc1[N+](=O)[O-] ZINC000478716702 935693785 /nfs/dbraw/zinc/69/37/85/935693785.db2.gz LQUXLAJYEUMXFH-UHFFFAOYSA-N 0 0 368.748 3.804 20 5 FHBDRN C[C@H](CC(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1)C1CCCCC1 ZINC000511123559 935696904 /nfs/dbraw/zinc/69/69/04/935696904.db2.gz IUHJAZUSWJMUSR-MRXNPFEDSA-N 0 0 359.470 3.850 20 5 FHBDRN CCOc1cc(CCCNC(=O)c2cccc(C)c2[N+](=O)[O-])ccc1OC ZINC000127662698 935697819 /nfs/dbraw/zinc/69/78/19/935697819.db2.gz LOWZDQQWTLAPSW-UHFFFAOYSA-N 0 0 372.421 3.673 20 5 FHBDRN CCN(C(=O)[C@@H](C)N(C)CCc1ccccc1[N+](=O)[O-])C1CCCCC1 ZINC000511126604 935715662 /nfs/dbraw/zinc/71/56/62/935715662.db2.gz ZILCRUGMKHBKSN-MRXNPFEDSA-N 0 0 361.486 3.639 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])Cc1nnc(-c2ccccc2)s1 ZINC000511127283 935721504 /nfs/dbraw/zinc/72/15/04/935721504.db2.gz UPLVYIDWXKAOFU-UHFFFAOYSA-N 0 0 354.435 3.788 20 5 FHBDRN Cc1ncsc1/C=C\C(=O)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC000588519502 935726833 /nfs/dbraw/zinc/72/68/33/935726833.db2.gz FLKNVNQJLGIYEH-PLNGDYQASA-N 0 0 368.212 3.774 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1nc2cccnc2[nH]1 ZINC000507292713 945120308 /nfs/dbraw/zinc/12/03/08/945120308.db2.gz UFFDHHRFNPEMSC-UHFFFAOYSA-N 0 0 357.395 3.621 20 5 FHBDRN O=C1CCCc2ccc(OCc3cc([N+](=O)[O-])cc4c3OCOC4)cc21 ZINC000478868880 935746809 /nfs/dbraw/zinc/74/68/09/935746809.db2.gz AXBKEXBKSVILOD-UHFFFAOYSA-N 0 0 355.346 3.559 20 5 FHBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)Nc1cccc(OCC(C)C)c1 ZINC000511131182 935748169 /nfs/dbraw/zinc/74/81/69/935748169.db2.gz NCOXWACPWQENSB-UHFFFAOYSA-N 0 0 364.423 3.739 20 5 FHBDRN Cc1[nH]c2ccccc2c1CCNC(=O)NCc1cccc([N+](=O)[O-])c1C ZINC000478891223 935752274 /nfs/dbraw/zinc/75/22/74/935752274.db2.gz APZJNENYDPASEV-UHFFFAOYSA-N 0 0 366.421 3.735 20 5 FHBDRN O=C(Nc1ccc(Cl)c(F)c1)c1cc([N+](=O)[O-])ccc1SCCO ZINC000136474172 945121127 /nfs/dbraw/zinc/12/11/27/945121127.db2.gz CPEOOVUWEKYVPV-UHFFFAOYSA-N 0 0 370.789 3.724 20 5 FHBDRN CCO[C@@H]1C[C@@H](N(C)C(=O)c2ccc([N+](=O)[O-])c3cccnc23)C12CCC2 ZINC000158377743 935759640 /nfs/dbraw/zinc/75/96/40/935759640.db2.gz MPAWDUFUURHLSA-IAGOWNOFSA-N 0 0 369.421 3.563 20 5 FHBDRN CCO[C@H]1C[C@H](N(C)C(=O)c2ccc([N+](=O)[O-])c3cccnc23)C12CCC2 ZINC000158377604 935759826 /nfs/dbraw/zinc/75/98/26/935759826.db2.gz MPAWDUFUURHLSA-IRXDYDNUSA-N 0 0 369.421 3.563 20 5 FHBDRN CC[C@]1(c2ccc(C)cc2)CC(=O)N(Cc2c(F)cccc2[N+](=O)[O-])C1=O ZINC000158400406 935767582 /nfs/dbraw/zinc/76/75/82/935767582.db2.gz YJTCBAZQCIDOOP-HXUWFJFHSA-N 0 0 370.380 3.649 20 5 FHBDRN Cc1c(Br)cc(C(=O)NCCc2ccccc2)cc1[N+](=O)[O-] ZINC000509570965 945122135 /nfs/dbraw/zinc/12/21/35/945122135.db2.gz LQKUVKBTDNNWKX-UHFFFAOYSA-N 0 0 363.211 3.638 20 5 FHBDRN CSc1ccccc1NC(=O)[C@@H](C)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000511141983 935778442 /nfs/dbraw/zinc/77/84/42/935778442.db2.gz XYKZJHWGOYDKFU-CQSZACIVSA-N 0 0 373.478 3.818 20 5 FHBDRN CN(Cc1ccccc1)C(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000050123557 935780335 /nfs/dbraw/zinc/78/03/35/935780335.db2.gz BWIYDVKQSXLAQN-UHFFFAOYSA-N 0 0 353.422 3.857 20 5 FHBDRN COc1cc(C(=O)N2CCSC[C@@H]2c2ccccc2)cc([N+](=O)[O-])c1C ZINC000479099661 935791597 /nfs/dbraw/zinc/79/15/97/935791597.db2.gz MUEMNGAIYDWUDI-QGZVFWFLSA-N 0 0 372.446 3.842 20 5 FHBDRN Cc1nnc(N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)n1Cc1ccccc1 ZINC000582519307 935795124 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FHBDRN O=C(NCCc1ccsc1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000050312731 935829904 /nfs/dbraw/zinc/82/99/04/935829904.db2.gz IZPMUVBNXMFLDE-UHFFFAOYSA-N 0 0 359.432 3.752 20 5 FHBDRN CCC(=O)c1ccc(NCC(=O)N2CCCc3ccccc32)c([N+](=O)[O-])c1 ZINC000479370096 935831193 /nfs/dbraw/zinc/83/11/93/935831193.db2.gz GIEAGQIOMGLXMS-UHFFFAOYSA-N 0 0 367.405 3.579 20 5 FHBDRN CCC(CC)n1nccc1C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000479386549 935834714 /nfs/dbraw/zinc/83/47/14/935834714.db2.gz ZIEJXQOJZGSNBT-UHFFFAOYSA-N 0 0 364.833 3.778 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)CCCc1ccc(F)c(F)c1 ZINC000176336828 935835739 /nfs/dbraw/zinc/83/57/39/935835739.db2.gz BPIJKQFICWWKQF-UHFFFAOYSA-N 0 0 350.321 3.843 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccn(-c2ccccc2Cl)n1 ZINC000158560597 935835956 /nfs/dbraw/zinc/83/59/56/935835956.db2.gz FIOCMZQNBUGJRA-UHFFFAOYSA-N 0 0 372.768 3.695 20 5 FHBDRN COCCC1(C(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])CCCC1 ZINC000479421893 935838284 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CN(C)c1ccccc1-c1noc(Cc2ccc([N+](=O)[O-])cc2Cl)n1 ZINC000545582820 945157913 /nfs/dbraw/zinc/15/79/13/945157913.db2.gz BYQWHKFRIGMKBO-UHFFFAOYSA-N 0 0 358.785 3.955 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1OCC(=O)N[C@@H](C)c1ccccc1Cl ZINC000506735709 945158270 /nfs/dbraw/zinc/15/82/70/945158270.db2.gz YPNJONZNDLCWTN-NSHDSACASA-N 0 0 364.785 3.513 20 5 FHBDRN COCc1ccc(C(=O)Nc2cc(C)nc3ccc([N+](=O)[O-])cc32)cc1 ZINC000161720958 938255971 /nfs/dbraw/zinc/25/59/71/938255971.db2.gz MUXFDZLDTLLDQK-UHFFFAOYSA-N 0 0 351.362 3.850 20 5 FHBDRN COCc1ccc([C@H]2CCCN2C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)o1 ZINC000161724443 938264523 /nfs/dbraw/zinc/26/45/23/938264523.db2.gz JUBPEEVGPDIHBB-OAHLLOKOSA-N 0 0 364.785 3.965 20 5 FHBDRN C[C@H](C(=O)N(C)Cc1cnn(-c2ccccc2)c1)c1cccc([N+](=O)[O-])c1 ZINC000583477152 938269938 /nfs/dbraw/zinc/26/99/38/938269938.db2.gz MPPMMQHLRFGPKL-HNNXBMFYSA-N 0 0 364.405 3.543 20 5 FHBDRN C[C@@H](c1ccccc1[N+](=O)[O-])n1nnc(-c2ccc(Br)cc2)n1 ZINC000409538554 938282034 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Cc1cc(F)cc(C(=O)NCc2cccc(OCC(F)F)c2)c1[N+](=O)[O-] ZINC000176800280 938445866 /nfs/dbraw/zinc/44/58/66/938445866.db2.gz GBESWYGGALWXIF-UHFFFAOYSA-N 0 0 368.311 3.616 20 5 FHBDRN CCOC(=O)[C@@]1(C(C)C)CCN(c2ccnc3c2cccc3[N+](=O)[O-])C1 ZINC000432139105 945175635 /nfs/dbraw/zinc/17/56/35/945175635.db2.gz ZITKCBPLODYKNW-IBGZPJMESA-N 0 0 357.410 3.559 20 5 FHBDRN CN(Cc1ccc(C(=O)NC2CC2)cc1)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000611790910 938450836 /nfs/dbraw/zinc/45/08/36/938450836.db2.gz AQGAVQVSAZNQKA-UHFFFAOYSA-N 0 0 373.840 3.772 20 5 FHBDRN CC(C)OC(=O)C[C@H]1CCCN(c2ccnc3c2cccc3[N+](=O)[O-])C1 ZINC000432138775 945175898 /nfs/dbraw/zinc/17/58/98/945175898.db2.gz MZVKHDJBYJHSEC-CQSZACIVSA-N 0 0 357.410 3.701 20 5 FHBDRN CC(C)N(CC(F)F)C(=O)c1sc(Br)cc1[N+](=O)[O-] ZINC000278479383 938463845 /nfs/dbraw/zinc/46/38/45/938463845.db2.gz JAWGNNLQQQDMDE-UHFFFAOYSA-N 0 0 357.176 3.535 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)N1CCCN(c2ccccc2Cl)CC1 ZINC000583893472 938470078 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COC1CCC(N(C)c2nnc(-c3cccc([N+](=O)[O-])c3)n2C2CC2)CC1 ZINC000584000663 938530526 /nfs/dbraw/zinc/53/05/26/938530526.db2.gz RQLJLLBNAFKXCT-UHFFFAOYSA-N 0 0 371.441 3.582 20 5 FHBDRN C[C@@H](Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C(=O)N1CCCC[C@@H]1C ZINC000248048005 938530531 /nfs/dbraw/zinc/53/05/31/938530531.db2.gz AEMNZQAYDPZTEY-WDEREUQCSA-N 0 0 359.348 3.815 20 5 FHBDRN CCOC(=O)c1cc(C(=O)N(C)[C@H](C)c2cccs2)cc([N+](=O)[O-])c1 ZINC000024235545 938548056 /nfs/dbraw/zinc/54/80/56/938548056.db2.gz GAZFCEUHVCEILK-LLVKDONJSA-N 0 0 362.407 3.666 20 5 FHBDRN O=[N+]([O-])c1ccccc1NC[C@H](CO)Cc1ccccc1Br ZINC000428656026 938551338 /nfs/dbraw/zinc/55/13/38/938551338.db2.gz GJQHBUQPDPUIQO-GFCCVEGCSA-N 0 0 365.227 3.620 20 5 FHBDRN CC(=O)c1cc(N2C[C@]3(C[C@@H]4CC[C@H]3C4)OC(C)(C)C2)ccc1[N+](=O)[O-] ZINC000408109043 945185578 /nfs/dbraw/zinc/18/55/78/945185578.db2.gz VUBVVUXGUCJHQG-SIFCLUCFSA-N 0 0 358.438 3.971 20 5 FHBDRN Cc1nnc(NCc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)n1C ZINC000161998486 938561497 /nfs/dbraw/zinc/56/14/97/938561497.db2.gz OPGTUGIUVFHUDE-UHFFFAOYSA-N 0 0 357.345 3.575 20 5 FHBDRN O=[N+]([O-])c1cccc(OC[C@@H](O)COc2ccc(Cl)c(Cl)c2)c1 ZINC000573026792 938569052 /nfs/dbraw/zinc/56/90/52/938569052.db2.gz XKTZMUNUOGYXCM-LLVKDONJSA-N 0 0 358.177 3.720 20 5 FHBDRN Cc1cc(OS(=O)(=O)c2ccc3c(c2)CCCC3)c(F)cc1[N+](=O)[O-] ZINC001211609201 938579020 /nfs/dbraw/zinc/57/90/20/938579020.db2.gz TWHMCCJHYQEMRM-UHFFFAOYSA-N 0 0 365.382 3.689 20 5 FHBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@]1(O)CCC[C@@H]1C ZINC000584073726 938581217 /nfs/dbraw/zinc/58/12/17/938581217.db2.gz MACBIXUOXVWIJY-UGSOOPFHSA-N 0 0 366.483 3.624 20 5 FHBDRN Cc1cc(C)c(S(=O)(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)s1 ZINC000431541646 938586297 /nfs/dbraw/zinc/58/62/97/938586297.db2.gz IGFSRONUXFNGMM-UHFFFAOYSA-N 0 0 366.464 3.626 20 5 FHBDRN CC[C@@H](C)[C@@H](NC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1)C(F)(F)F ZINC000584092854 938594689 /nfs/dbraw/zinc/59/46/89/938594689.db2.gz MMCUIQCWDMNQRJ-QMTHXVAHSA-N 0 0 359.348 3.640 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCC1([C@H](O)C(C)C)CC1 ZINC000507369922 945188930 /nfs/dbraw/zinc/18/89/30/945188930.db2.gz NIKLFLWFJPDDHN-MRXNPFEDSA-N 0 0 366.483 3.624 20 5 FHBDRN Cc1nc(COC(=O)c2cc(Br)cc([N+](=O)[O-])c2)c(C)s1 ZINC000162038650 938604424 /nfs/dbraw/zinc/60/44/24/938604424.db2.gz STMMNFCOGADGTP-UHFFFAOYSA-N 0 0 371.212 3.788 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]c(CNCc3ccc(OCC4CC4)cc3)nc2c1 ZINC000278653102 938619915 /nfs/dbraw/zinc/61/99/15/938619915.db2.gz JUEKYXWQOOAOQQ-UHFFFAOYSA-N 0 0 352.394 3.550 20 5 FHBDRN Cc1ccc2nc(CS[C@H](C)c3ccccc3[N+](=O)[O-])cc(=O)n2c1 ZINC000437270919 945196151 /nfs/dbraw/zinc/19/61/51/945196151.db2.gz UZZARJWRRKXJFA-CYBMUJFWSA-N 0 0 355.419 3.906 20 5 FHBDRN Cc1ncc([N+](=O)[O-])c(OCC(=O)NC[C@H](c2ccccc2)C(C)C)c1C ZINC000584183451 938631431 /nfs/dbraw/zinc/63/14/31/938631431.db2.gz IWTPTKZIUVRTIW-KRWDZBQOSA-N 0 0 371.437 3.541 20 5 FHBDRN Cc1nnc(-c2ccc(C(=O)N3CCCc4c([N+](=O)[O-])cccc43)cc2)o1 ZINC000162094618 938644145 /nfs/dbraw/zinc/64/41/45/938644145.db2.gz AUZVSTHCBLRURT-UHFFFAOYSA-N 0 0 364.361 3.546 20 5 FHBDRN O=[N+]([O-])c1cc2c(ncnc2Sc2nnc(C(F)(F)F)s2)s1 ZINC000573154688 938654278 /nfs/dbraw/zinc/65/42/78/938654278.db2.gz JJEGTGLZRDEYNH-UHFFFAOYSA-N 0 0 365.343 3.621 20 5 FHBDRN O=C(c1cc(F)cc([N+](=O)[O-])c1)N1C[C@@H]2CCCCN2c2ccccc21 ZINC000584251727 938655955 /nfs/dbraw/zinc/65/59/55/938655955.db2.gz FCYLEVAFGMCZRK-HNNXBMFYSA-N 0 0 355.369 3.753 20 5 FHBDRN COc1cccc(C2(c3noc(-c4cccc([N+](=O)[O-])c4OC)n3)CC2)c1 ZINC000584258838 938659347 /nfs/dbraw/zinc/65/93/47/938659347.db2.gz KDFYFMSOSKFNHP-UHFFFAOYSA-N 0 0 367.361 3.742 20 5 FHBDRN CC(C)CNC(=O)c1ccc(NC(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000584269326 938663103 /nfs/dbraw/zinc/66/31/03/938663103.db2.gz JRRTWHNEAKDIGE-AWEZNQCLSA-N 0 0 369.421 3.723 20 5 FHBDRN CCCC[C@@H](C)N(C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000584320610 938684874 /nfs/dbraw/zinc/68/48/74/938684874.db2.gz DIGGLIIBODIWTJ-SNVBAGLBSA-N 0 0 368.377 3.813 20 5 FHBDRN CCOc1ccc([C@@H](C)NC(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)cc1 ZINC000611823504 938692029 /nfs/dbraw/zinc/69/20/29/938692029.db2.gz CNVJSASLURTZCU-GFCCVEGCSA-N 0 0 359.382 3.885 20 5 FHBDRN CCc1[nH]nc(C(=O)N(C)c2ccc(-c3ccccc3)cc2)c1[N+](=O)[O-] ZINC000573190849 938693456 /nfs/dbraw/zinc/69/34/56/938693456.db2.gz VMXNIXQPDVCMAI-UHFFFAOYSA-N 0 0 350.378 3.824 20 5 FHBDRN C[C@H](CNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1)Oc1ccc(F)cc1 ZINC000080762120 938702031 /nfs/dbraw/zinc/70/20/31/938702031.db2.gz YPQQBXKOQRRCIV-CYBMUJFWSA-N 0 0 360.385 3.595 20 5 FHBDRN Cc1cc(NCc2ccnc(OCc3ccccc3)c2)ncc1[N+](=O)[O-] ZINC000074740727 938706613 /nfs/dbraw/zinc/70/66/13/938706613.db2.gz OZUIBZAXQHEWKI-UHFFFAOYSA-N 0 0 350.378 3.884 20 5 FHBDRN COc1ccccc1C[C@H](C)N(C)C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000080996810 938713162 /nfs/dbraw/zinc/71/31/62/938713162.db2.gz OSHRGOFLHGWGGD-ZDUSSCGKSA-N 0 0 367.405 3.788 20 5 FHBDRN O=[N+]([O-])c1cnc(NCc2nccn2CCc2ccccc2)c(Cl)c1 ZINC000081033062 938716462 /nfs/dbraw/zinc/71/64/62/938716462.db2.gz CDVNPYLXBCDNPJ-UHFFFAOYSA-N 0 0 357.801 3.695 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl ZINC000437287448 945202174 /nfs/dbraw/zinc/20/21/74/945202174.db2.gz IKLOPWIWBUCSEQ-DZGCQCFKSA-N 0 0 366.204 3.891 20 5 FHBDRN COc1cc(C(=O)N[C@@H](c2cccc(C)c2)C(F)(F)F)ccc1[N+](=O)[O-] ZINC000511819456 945202871 /nfs/dbraw/zinc/20/28/71/945202871.db2.gz ADEWTAPIYDCVGW-HNNXBMFYSA-N 0 0 368.311 3.945 20 5 FHBDRN O=[N+]([O-])c1cc(F)cc(Oc2ccc3nnc(-c4ccccc4)n3n2)c1 ZINC000135530279 938781366 /nfs/dbraw/zinc/78/13/66/938781366.db2.gz FUXYFFCEWOXKSK-UHFFFAOYSA-N 0 0 351.297 3.631 20 5 FHBDRN O=[N+]([O-])c1ccc(NCCc2ccc(Br)s2)c2nonc21 ZINC000219720392 938820992 /nfs/dbraw/zinc/82/09/92/938820992.db2.gz FUEVHXOHIAKJGH-UHFFFAOYSA-N 0 0 369.200 3.610 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2nnc(N3CCC[C@@H]4CCC[C@H]43)n2C2CC2)cc1 ZINC000584416406 938843756 /nfs/dbraw/zinc/84/37/56/938843756.db2.gz CMRBJYMBKKWTJJ-SUMWQHHRSA-N 0 0 353.426 3.957 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)NCc2c(Cl)cccc2Cl)c1 ZINC000516757963 945209214 /nfs/dbraw/zinc/20/92/14/945209214.db2.gz YXCRBSJXXKSOLL-UHFFFAOYSA-N 0 0 355.177 3.840 20 5 FHBDRN CC(C)c1noc(-c2ccnc(N3CCc4ccc([N+](=O)[O-])cc4C3)c2)n1 ZINC000088763984 938852965 /nfs/dbraw/zinc/85/29/65/938852965.db2.gz FGBIXNVIJXMOGV-UHFFFAOYSA-N 0 0 365.393 3.726 20 5 FHBDRN COC(=O)c1cc(C)nc(N(C)[C@@H](C)c2c(F)cccc2F)c1[N+](=O)[O-] ZINC000584427804 938857110 /nfs/dbraw/zinc/85/71/10/938857110.db2.gz OQUFEDSFXWVOFP-JTQLQIEISA-N 0 0 365.336 3.560 20 5 FHBDRN O=C(NCc1cccc(Br)c1)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000065668176 938860637 /nfs/dbraw/zinc/86/06/37/938860637.db2.gz JBPXKNJAAGLDLC-UHFFFAOYSA-N 0 0 371.137 3.566 20 5 FHBDRN CCOC(=O)c1sc(NC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])cc1C ZINC000065668201 938860934 /nfs/dbraw/zinc/86/09/34/938860934.db2.gz DINLGYQFPVHOJK-UHFFFAOYSA-N 0 0 370.333 3.672 20 5 FHBDRN CCS[C@H]1CCCCN(C(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)C1 ZINC000480338922 938868351 /nfs/dbraw/zinc/86/83/51/938868351.db2.gz UFKULNZWLJVOBT-INIZCTEOSA-N 0 0 361.467 3.684 20 5 FHBDRN Cc1cc(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)ccc1O ZINC000151898116 938870292 /nfs/dbraw/zinc/87/02/92/938870292.db2.gz ITDGCRZFYCCYDH-UHFFFAOYSA-N 0 0 358.397 3.807 20 5 FHBDRN COc1ccc(F)cc1[C@H](C)NC(=O)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000065669571 938874193 /nfs/dbraw/zinc/87/41/93/938874193.db2.gz YOKVXWVXRMIGIG-QMMMGPOBSA-N 0 0 354.284 3.512 20 5 FHBDRN CCc1ccc(Nc2ccc(C(=O)c3nccn3C)cc2[N+](=O)[O-])cc1 ZINC000480350135 938877843 /nfs/dbraw/zinc/87/78/43/938877843.db2.gz SZDZAASLCAPTBJ-UHFFFAOYSA-N 0 0 350.378 3.865 20 5 FHBDRN Cc1ccc(C(=O)NCc2c(Cl)cccc2-n2ccnc2)cc1[N+](=O)[O-] ZINC000584439458 938883446 /nfs/dbraw/zinc/88/34/46/938883446.db2.gz WVVCLYWKPZOKIU-UHFFFAOYSA-N 0 0 370.796 3.672 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)[C@@H]2COc3cc(C)c(C)cc32)cc1[N+](=O)[O-] ZINC000472322048 938883877 /nfs/dbraw/zinc/88/38/77/938883877.db2.gz RFIBFUUQYJWGGU-WMLDXEAASA-N 0 0 354.406 3.873 20 5 FHBDRN Cc1ccccc1OCCN(C)C(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000024220786 938885952 /nfs/dbraw/zinc/88/59/52/938885952.db2.gz OBXXKGYZZSXCCH-OAHLLOKOSA-N 0 0 374.462 3.921 20 5 FHBDRN Cc1c(-c2cc(COc3cc(C)c([N+](=O)[O-])cc3Cl)on2)cnn1C ZINC000506433570 945212930 /nfs/dbraw/zinc/21/29/30/945212930.db2.gz OISXVZOLNYNOKQ-UHFFFAOYSA-N 0 0 362.773 3.833 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1cccc(Cl)c1C ZINC000519202617 945213955 /nfs/dbraw/zinc/21/39/55/945213955.db2.gz DEPVFSZTKOXZDZ-UHFFFAOYSA-N 0 0 354.815 3.920 20 5 FHBDRN CCCc1[nH]nc(C(=O)Nc2cnc(-c3ccccc3)s2)c1[N+](=O)[O-] ZINC000091774631 938905526 /nfs/dbraw/zinc/90/55/26/938905526.db2.gz UKNAIEHCDBIFRW-UHFFFAOYSA-N 0 0 357.395 3.646 20 5 FHBDRN CC[C@@H](OC(=O)c1cccc(Cn2cncn2)c1)c1cccc([N+](=O)[O-])c1 ZINC001267374864 938909265 /nfs/dbraw/zinc/90/92/65/938909265.db2.gz SVQFBGFEJFMAJE-GOSISDBHSA-N 0 0 366.377 3.543 20 5 FHBDRN C[C@H]1CN(c2ccc(C(=O)c3nccn3C)cc2[N+](=O)[O-])c2ccccc21 ZINC000480399140 938910214 /nfs/dbraw/zinc/91/02/14/938910214.db2.gz VCDCNNKOJOXGEZ-ZDUSSCGKSA-N 0 0 362.389 3.815 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)N[C@@H](c1ccccc1)C1CCC1 ZINC000511255666 938920186 /nfs/dbraw/zinc/92/01/86/938920186.db2.gz AOKJBZCSPXEWAT-IBGZPJMESA-N 0 0 353.422 3.978 20 5 FHBDRN CCc1ccc(S(=O)(=O)Oc2cc(F)ccc2Cl)cc1[N+](=O)[O-] ZINC001211620366 938920818 /nfs/dbraw/zinc/92/08/18/938920818.db2.gz XOUVUADCVQNNFT-UHFFFAOYSA-N 0 0 359.762 3.717 20 5 FHBDRN CC(C)Oc1cccc(CN(C)C(=O)NCc2ccccc2[N+](=O)[O-])c1 ZINC000179111352 938941241 /nfs/dbraw/zinc/94/12/41/938941241.db2.gz SRADHMDQTQKLOQ-UHFFFAOYSA-N 0 0 357.410 3.724 20 5 FHBDRN O=C(N[C@@H]1C[C@H]1c1ccc(Br)cc1)c1cccc([N+](=O)[O-])c1 ZINC000437299377 945217459 /nfs/dbraw/zinc/21/74/59/945217459.db2.gz SZSULZMZIRCEDZ-LSDHHAIUSA-N 0 0 361.195 3.643 20 5 FHBDRN COc1cccc([C@H]2CCCN2CC(=O)Nc2c(C)cccc2[N+](=O)[O-])c1 ZINC000198529536 938962227 /nfs/dbraw/zinc/96/22/27/938962227.db2.gz WEVJGDSDWYYXOX-QGZVFWFLSA-N 0 0 369.421 3.687 20 5 FHBDRN O=[N+]([O-])c1ccccc1-c1ccc(CN2CCN(c3ccccn3)CC2)o1 ZINC000158889711 938964948 /nfs/dbraw/zinc/96/49/48/938964948.db2.gz LSPHGHOIHZNEHZ-UHFFFAOYSA-N 0 0 364.405 3.572 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)Oc1cccc2ccc(C)nc21 ZINC000065684933 938965105 /nfs/dbraw/zinc/96/51/05/938965105.db2.gz RJNKRAFNZZMWAF-UHFFFAOYSA-N 0 0 372.402 3.782 20 5 FHBDRN Cc1ccc(NC(=O)C(=O)N2CC(C)(C)[C@H]2c2cccs2)cc1[N+](=O)[O-] ZINC000511264751 938970976 /nfs/dbraw/zinc/97/09/76/938970976.db2.gz HNRGRFBMTVOXFU-OAHLLOKOSA-N 0 0 373.434 3.513 20 5 FHBDRN C[C@@H](c1cccc([N+](=O)[O-])c1)S(=O)(=O)Cc1ncccc1C(F)(F)F ZINC000431573612 938979501 /nfs/dbraw/zinc/97/95/01/938979501.db2.gz BWFXTRSXALZMOJ-JTQLQIEISA-N 0 0 374.340 3.685 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N(C)Cc1ccc(Br)o1 ZINC000511282124 938983069 /nfs/dbraw/zinc/98/30/69/938983069.db2.gz RAAYWTCTAGMFRD-UHFFFAOYSA-N 0 0 353.172 3.531 20 5 FHBDRN Cc1cc(C(=O)Nc2ccc(O[C@@H]3CCCC[C@H]3O)cc2)cc([N+](=O)[O-])c1 ZINC000135655669 938986155 /nfs/dbraw/zinc/98/61/55/938986155.db2.gz WBHZIOBTWRXARW-RTBURBONSA-N 0 0 370.405 3.838 20 5 FHBDRN CCC[C@@H](C)[C@H]1CCCN1C(=O)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000785180632 938991404 /nfs/dbraw/zinc/99/14/04/938991404.db2.gz SVWKDNFWABTQRK-BXUZGUMPSA-N 0 0 367.833 3.614 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])c2cccnc12)Nc1cccc2ncccc21 ZINC000431593377 938991943 /nfs/dbraw/zinc/99/19/43/938991943.db2.gz YIYBPNTWPCKLHD-UHFFFAOYSA-N 0 0 374.356 3.709 20 5 FHBDRN O=C(Nc1ccc(O[C@@H]2CCOC2)cc1)c1cccc(Cl)c1[N+](=O)[O-] ZINC000176905889 938993091 /nfs/dbraw/zinc/99/30/91/938993091.db2.gz BZJFQWNZLRPEJD-CYBMUJFWSA-N 0 0 362.769 3.668 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CCOc2ccc(Cl)cc21 ZINC000136096229 938993625 /nfs/dbraw/zinc/99/36/25/938993625.db2.gz WJGYQBGSPLGKHN-UHFFFAOYSA-N 0 0 371.780 3.698 20 5 FHBDRN COC(=O)c1cnc(N[C@H]2CC[C@H](c3ccc(F)cc3)C2)c([N+](=O)[O-])c1 ZINC000480572480 938994029 /nfs/dbraw/zinc/99/40/29/938994029.db2.gz BGDPCNDTBQVXSD-WFASDCNBSA-N 0 0 359.357 3.664 20 5 FHBDRN Cc1oc(-c2cccs2)nc1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000120436905 938994871 /nfs/dbraw/zinc/99/48/71/938994871.db2.gz GLKLLLIXIKHQGQ-UHFFFAOYSA-N 0 0 369.402 3.752 20 5 FHBDRN COCCCC[C@@H](Nc1ccc(C(N)=O)cc1[N+](=O)[O-])c1ccccc1 ZINC000480579766 938996068 /nfs/dbraw/zinc/99/60/68/938996068.db2.gz LUZWQNVOLMTVPX-MRXNPFEDSA-N 0 0 357.410 3.664 20 5 FHBDRN CCOc1cc(Cl)ccc1CNC(=O)c1ccc(F)cc1[N+](=O)[O-] ZINC000158915605 938996447 /nfs/dbraw/zinc/99/64/47/938996447.db2.gz MVSRNFPYARUIQK-UHFFFAOYSA-N 0 0 352.749 3.716 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)Oc1cc(C)c(Cl)cc1C(C)C ZINC000065715512 938998800 /nfs/dbraw/zinc/99/88/00/938998800.db2.gz VYDQMDYVAIWNNG-UHFFFAOYSA-N 0 0 351.790 3.791 20 5 FHBDRN C[C@H](c1ccc(Cl)cc1)N(C)C(=O)CSc1ncccc1[N+](=O)[O-] ZINC000120438534 939000188 /nfs/dbraw/zinc/00/01/88/939000188.db2.gz ASUCHULAMFYHKN-LLVKDONJSA-N 0 0 365.842 3.955 20 5 FHBDRN O=[N+]([O-])c1ccc(F)c(NS(=O)(=O)/C=C\c2cccc(Cl)c2)c1 ZINC000588619835 939000214 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FHBDRN COc1cc(C(=O)N(C)[C@@H](C)Cc2cccc(F)c2)c([N+](=O)[O-])cc1F ZINC000411108716 939998696 /nfs/dbraw/zinc/99/86/96/939998696.db2.gz DVFIAVDNTRUNLM-NSHDSACASA-N 0 0 364.348 3.585 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])o1)N1CCC[C@]1(c1ccccc1)C(F)(F)F ZINC000162242206 940002115 /nfs/dbraw/zinc/00/21/15/940002115.db2.gz LCNPMPTUEWJCCX-HNNXBMFYSA-N 0 0 354.284 3.882 20 5 FHBDRN CCC(=O)c1ccc(OCC(=O)N2CCCc3c([N+](=O)[O-])cccc32)cc1 ZINC000162245408 940006153 /nfs/dbraw/zinc/00/61/53/940006153.db2.gz VZOBWLTWEHXOJC-UHFFFAOYSA-N 0 0 368.389 3.546 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])o1)N1CCC[C@@]1(c1ccccc1)C(F)(F)F ZINC000162242347 940006529 /nfs/dbraw/zinc/00/65/29/940006529.db2.gz LCNPMPTUEWJCCX-OAHLLOKOSA-N 0 0 354.284 3.882 20 5 FHBDRN CCCN(CC1CCCCC1)C(=O)C(=O)Nc1ccc([N+](=O)[O-])c(C)c1 ZINC000411180204 940007051 /nfs/dbraw/zinc/00/70/51/940007051.db2.gz QYFOZZZIKJZOTG-UHFFFAOYSA-N 0 0 361.442 3.661 20 5 FHBDRN Cc1nn(C[C@@H](O)COc2cc(C)c(Cl)cc2C(C)C)cc1[N+](=O)[O-] ZINC000179856670 940009583 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Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)C(=O)N(C)C1CCC(C)(C)CC1 ZINC000411405840 940039371 /nfs/dbraw/zinc/03/93/71/940039371.db2.gz DHBNFGXIIZCVBV-UHFFFAOYSA-N 0 0 361.442 3.577 20 5 FHBDRN CCc1ccc(NC(=O)C(=O)Nc2ccc([N+](=O)[O-])c(C)c2)cc1CC ZINC000411413075 940040302 /nfs/dbraw/zinc/04/03/02/940040302.db2.gz YOXYPHORSBWCMM-UHFFFAOYSA-N 0 0 355.394 3.605 20 5 FHBDRN Cc1cc([C@H](C)NS(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])c(C)s1 ZINC000516783709 940045820 /nfs/dbraw/zinc/04/58/20/940045820.db2.gz AGGPNDNLOOPBPG-VIFPVBQESA-N 0 0 374.871 3.966 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)C[C@H](c1ccc(O)cc1)C1CC1 ZINC000411529047 940057905 /nfs/dbraw/zinc/05/79/05/940057905.db2.gz SZQALFANUDXMHO-SFHVURJKSA-N 0 0 370.405 3.509 20 5 FHBDRN O=C(C[C@H](c1ccc(O)cc1)C1CC1)NCCc1ccc([N+](=O)[O-])cc1 ZINC000411588058 940071189 /nfs/dbraw/zinc/07/11/89/940071189.db2.gz YRXHOZCRYBBCKY-IBGZPJMESA-N 0 0 354.406 3.543 20 5 FHBDRN O=[N+]([O-])c1cccc2ncnc(N3CCC4(CC3)OCc3ccccc34)c21 ZINC000612447833 940074066 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O=C(NCCc1ccccn1)c1cc([N+](=O)[O-])ccc1SC1CCCC1 ZINC000124502330 945303564 /nfs/dbraw/zinc/30/35/64/945303564.db2.gz RVIJTWLGLPBYIF-UHFFFAOYSA-N 0 0 371.462 3.997 20 5 FHBDRN O=C(NC[C@@H]1CCCCO1)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 ZINC000140661171 945303986 /nfs/dbraw/zinc/30/39/86/945303986.db2.gz UHAVBIZAOUXGMP-INIZCTEOSA-N 0 0 356.378 3.686 20 5 FHBDRN C[C@@H](NC(=O)c1ccc(Br)cc1O)c1cccc([N+](=O)[O-])c1 ZINC000066047607 940230903 /nfs/dbraw/zinc/23/09/03/940230903.db2.gz MKNOIJKWSBPNQB-SECBINFHSA-N 0 0 365.183 3.554 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])cc1[N+](=O)[O-] ZINC000177498024 940236103 /nfs/dbraw/zinc/23/61/03/940236103.db2.gz RZIWFJUHXZIEDK-SECBINFHSA-N 0 0 365.292 3.581 20 5 FHBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)N[C@H](c1ccccc1)c1cccnc1 ZINC000255869285 940236952 /nfs/dbraw/zinc/23/69/52/940236952.db2.gz WXBCRXNTNJBACK-NZIDHHNMSA-N 0 0 359.385 3.909 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CC[C@@H](n3ncc4ccccc43)C2)c2ccncc21 ZINC000511370282 940241455 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CC(=O)N1c2ccccc2C[C@H]1c1nc(-c2ccc(C)c([N+](=O)[O-])c2)no1 ZINC000612895049 940327549 /nfs/dbraw/zinc/32/75/49/940327549.db2.gz GEJWZQLGRRZPKA-KRWDZBQOSA-N 0 0 364.361 3.604 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2nc(Cc3ccc4c(c3)OCCO4)no2)c(Cl)c1 ZINC000612892620 940330665 /nfs/dbraw/zinc/33/06/65/940330665.db2.gz NJRJOTSKXLOJHR-UHFFFAOYSA-N 0 0 373.752 3.660 20 5 FHBDRN Cc1ccc(F)cc1-c1noc([C@@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)n1 ZINC000612892932 940331341 /nfs/dbraw/zinc/33/13/41/940331341.db2.gz NHVVHNPJPJSUFD-LLVKDONJSA-N 0 0 370.340 3.583 20 5 FHBDRN O=[N+]([O-])c1ccccc1/C=C\c1nc(Cc2ccc3c(c2)OCCO3)no1 ZINC000612894005 940331927 /nfs/dbraw/zinc/33/19/27/940331927.db2.gz MPKAWMYZUGNUNR-VURMDHGXSA-N 0 0 365.345 3.510 20 5 FHBDRN COc1ccc2c(c1)OC[C@H](c1nc(-c3ccc(C)c([N+](=O)[O-])c3)no1)C2 ZINC000612895611 940332010 /nfs/dbraw/zinc/33/20/10/940332010.db2.gz VTLKNQPGWMBXHB-CQSZACIVSA-N 0 0 367.361 3.681 20 5 FHBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)c1nc([C@@H]2CCCC[C@H]2C)no1 ZINC000612928329 940341445 /nfs/dbraw/zinc/34/14/45/940341445.db2.gz SXKNCMUQBKWJEB-TYNCELHUSA-N 0 0 358.398 3.763 20 5 FHBDRN COc1ccc(Cc2nc([C@H]3CCc4ccccc43)no2)cc1[N+](=O)[O-] ZINC000612933148 940344286 /nfs/dbraw/zinc/34/42/86/940344286.db2.gz NKGBRDFLLKYJGU-HNNXBMFYSA-N 0 0 351.362 3.655 20 5 FHBDRN C[C@H](NC(=O)c1cccc(Cl)c1[N+](=O)[O-])c1cccc(-n2cccn2)c1 ZINC000177679314 940349891 /nfs/dbraw/zinc/34/98/91/940349891.db2.gz ABODXAHTVCOEOM-LBPRGKRZSA-N 0 0 370.796 3.925 20 5 FHBDRN CC(C)c1[nH]nc(-c2nc([C@H]3CCc4ccccc4C3)no2)c1[N+](=O)[O-] ZINC000612951381 940356079 /nfs/dbraw/zinc/35/60/79/940356079.db2.gz FUGFNCNTVSJMIQ-ZDUSSCGKSA-N 0 0 353.382 3.764 20 5 FHBDRN COc1ccc(Cc2nc([C@@H]3CCc4ccccc4C3)no2)cc1[N+](=O)[O-] ZINC000612952164 940356987 /nfs/dbraw/zinc/35/69/87/940356987.db2.gz WUKPRIZAHXSQPD-MRXNPFEDSA-N 0 0 365.389 3.850 20 5 FHBDRN COc1cc(Cc2noc(-c3cc(F)c(C)cc3F)n2)ccc1[N+](=O)[O-] ZINC000612967934 940360083 /nfs/dbraw/zinc/36/00/83/940360083.db2.gz YEQHXNMWRNRTKT-UHFFFAOYSA-N 0 0 361.304 3.831 20 5 FHBDRN COc1cccc(Cc2nnc(SCc3cccc([N+](=O)[O-])c3)o2)c1 ZINC000066256824 940370288 /nfs/dbraw/zinc/37/02/88/940370288.db2.gz DJVHGNQRPFORBB-UHFFFAOYSA-N 0 0 357.391 3.870 20 5 FHBDRN O=C(Nc1cc(Cl)ccc1Cl)c1cc([N+](=O)[O-])cc2c1OCCO2 ZINC000066266207 940370810 /nfs/dbraw/zinc/37/08/10/940370810.db2.gz MJSJMOOCCWBTFF-UHFFFAOYSA-N 0 0 369.160 3.925 20 5 FHBDRN COc1cccc(Cc2noc(/C(C)=C/c3ccc([N+](=O)[O-])cc3)n2)n1 ZINC000612979748 940375122 /nfs/dbraw/zinc/37/51/22/940375122.db2.gz CRYOBBVJDDSTQL-ZRDIBKRKSA-N 0 0 352.350 3.533 20 5 FHBDRN COCC(C)(C)N(Cc1ccccc1)C(=O)c1cc(C)ccc1[N+](=O)[O-] ZINC000472480974 940378826 /nfs/dbraw/zinc/37/88/26/940378826.db2.gz TVQLZDJTRYJQRA-UHFFFAOYSA-N 0 0 356.422 3.971 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)Nc1nc2c(s1)CSCC2 ZINC000376156351 940382446 /nfs/dbraw/zinc/38/24/46/940382446.db2.gz HLWWAWGMJQDWTD-UHFFFAOYSA-N 0 0 374.447 3.503 20 5 FHBDRN CC(C)(C(=O)N[C@@H]1C[C@@]1(C)c1ccccc1)c1ccc([N+](=O)[O-])cc1F ZINC000612997928 940386418 /nfs/dbraw/zinc/38/64/18/940386418.db2.gz UGPAFZFCFFECLE-XLIONFOSSA-N 0 0 356.397 3.858 20 5 FHBDRN CC(C)(C(=O)NC[C@@H]1CCc2ccccc2C1)c1ccc([N+](=O)[O-])cc1F ZINC000612997899 940386447 /nfs/dbraw/zinc/38/64/47/940386447.db2.gz RGFVWEBHITZXON-CQSZACIVSA-N 0 0 370.424 3.933 20 5 FHBDRN Cc1cc(C)c(NC(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])cc1O ZINC000613031674 940401472 /nfs/dbraw/zinc/40/14/72/940401472.db2.gz LWDITLYEACLJGN-NSHDSACASA-N 0 0 364.785 3.977 20 5 FHBDRN CCOc1cc(C(=O)Nc2cc(O)c(C)cc2C)c([N+](=O)[O-])cc1OC ZINC000613032048 940408447 /nfs/dbraw/zinc/40/84/47/940408447.db2.gz ZBKLDQKQGFWPLM-UHFFFAOYSA-N 0 0 360.366 3.577 20 5 FHBDRN CC(C)c1nccn1C[C@H]1CCCN1c1ncnc2sc([N+](=O)[O-])cc21 ZINC000376170516 940410561 /nfs/dbraw/zinc/41/05/61/940410561.db2.gz GFFFDIZYHNQUEV-GFCCVEGCSA-N 0 0 372.454 3.588 20 5 FHBDRN O=C(N[C@H]1CCCc2sccc21)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000160381150 940432188 /nfs/dbraw/zinc/43/21/88/940432188.db2.gz DIGAWJBBDZNEDZ-INIZCTEOSA-N 0 0 368.418 3.649 20 5 FHBDRN O=C(OCCn1cc([N+](=O)[O-])cn1)c1ccc(-c2ccc(F)cc2)cc1F ZINC000177783850 940435671 /nfs/dbraw/zinc/43/56/71/940435671.db2.gz ATQVPIBGYPRPIE-UHFFFAOYSA-N 0 0 373.315 3.594 20 5 FHBDRN O=C(CCc1ccccc1OC(F)(F)F)NCc1ccc([N+](=O)[O-])cc1 ZINC000066330242 940438615 /nfs/dbraw/zinc/43/86/15/940438615.db2.gz HPZSDYLMDKXAGV-UHFFFAOYSA-N 0 0 368.311 3.742 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)Cc1cnc2ccccc2n1 ZINC000548987478 940442194 /nfs/dbraw/zinc/44/21/94/940442194.db2.gz JMTCNHFZBOIDJN-ZDUSSCGKSA-N 0 0 350.378 3.664 20 5 FHBDRN CCO[C@@H](C)c1nc(COc2ccc(C(=O)OC)c([N+](=O)[O-])c2)cs1 ZINC000613109444 940452013 /nfs/dbraw/zinc/45/20/13/940452013.db2.gz ITJSYWCUFCYWDJ-JTQLQIEISA-N 0 0 366.395 3.514 20 5 FHBDRN COC(=O)Nc1ccc(C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000177833562 940459085 /nfs/dbraw/zinc/45/90/85/940459085.db2.gz XCNBAYJXBWWZLK-GFCCVEGCSA-N 0 0 357.366 3.573 20 5 FHBDRN COc1ccc(/C=C/C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1OC ZINC000177843924 940462022 /nfs/dbraw/zinc/46/20/22/940462022.db2.gz ROBWOQOSMXEYER-RNVIBTMRSA-N 0 0 370.405 3.811 20 5 FHBDRN Cc1cc(NC2CCN(C(=O)c3cc(Cl)c[nH]3)CC2)ccc1[N+](=O)[O-] ZINC000376206211 940467571 /nfs/dbraw/zinc/46/75/71/940467571.db2.gz XCIKEUJADCFSBQ-UHFFFAOYSA-N 0 0 362.817 3.601 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1[N+](=O)[O-] ZINC000177871151 940470280 /nfs/dbraw/zinc/47/02/80/940470280.db2.gz LDEDRLRQVQIQSR-JTQLQIEISA-N 0 0 363.757 3.956 20 5 FHBDRN COc1ccc(CNC(=O)NCc2cc3ccccc3s2)cc1[N+](=O)[O-] ZINC000548998551 940471066 /nfs/dbraw/zinc/47/10/66/940471066.db2.gz RYCGWBCMZUUMFR-UHFFFAOYSA-N 0 0 371.418 3.818 20 5 FHBDRN O=C(C1CC1)[C@H]1CN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCO1 ZINC000580264641 940471160 /nfs/dbraw/zinc/47/11/60/940471160.db2.gz INGGMUXCDQJTNM-QGZVFWFLSA-N 0 0 372.446 3.503 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1CCC[C@@H]1/C=C\c1ccccc1 ZINC000427395162 945323655 /nfs/dbraw/zinc/32/36/55/945323655.db2.gz NTVPURSCOPKLKW-ZBTGYSDGSA-N 0 0 352.390 3.921 20 5 FHBDRN Cc1nsc(C)c1-c1noc(Cc2ccc([N+](=O)[O-])cc2Cl)n1 ZINC000426601004 945323753 /nfs/dbraw/zinc/32/37/53/945323753.db2.gz OUNVIFKCRYAIMG-UHFFFAOYSA-N 0 0 350.787 3.962 20 5 FHBDRN C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)N(C)Cc1ccc(F)cc1 ZINC000003542035 940475746 /nfs/dbraw/zinc/47/57/46/940475746.db2.gz KNWXKBWWEYSWRD-LLVKDONJSA-N 0 0 365.792 3.846 20 5 FHBDRN CCN(C)[C@@H](c1nc(Cc2ccc([N+](=O)[O-])c(C)c2)no1)c1ccccc1 ZINC000580481496 940476594 /nfs/dbraw/zinc/47/65/94/940476594.db2.gz AZKXZEVHIVATSX-LJQANCHMSA-N 0 0 366.421 3.918 20 5 FHBDRN Cc1ccnc(-c2n[nH]c([C@H](C)N[C@@H](C)c3cc([N+](=O)[O-])ccc3C)n2)c1 ZINC000580511416 940477510 /nfs/dbraw/zinc/47/75/10/940477510.db2.gz FHNNORMDPQEDDD-KBPBESRZSA-N 0 0 366.425 3.804 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(C(=O)OC)c1C ZINC000613175145 940478075 /nfs/dbraw/zinc/47/80/75/940478075.db2.gz VJQLUVDVJPEPLP-HNNXBMFYSA-N 0 0 370.405 3.897 20 5 FHBDRN O=C(CCOc1ccccc1)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000580459223 940478211 /nfs/dbraw/zinc/47/82/11/940478211.db2.gz HYGXXNHRLXBVTD-UHFFFAOYSA-N 0 0 365.183 3.765 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C)[C@H](C1)C2(F)F ZINC000580592365 940479894 /nfs/dbraw/zinc/47/98/94/940479894.db2.gz QPLNJFNUBUSXIU-DZGCQCFKSA-N 0 0 356.394 3.824 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC(c2cccnc2)CC1 ZINC000613189679 940481095 /nfs/dbraw/zinc/48/10/95/940481095.db2.gz VZZKBNHPLLIQJI-KRWDZBQOSA-N 0 0 367.449 3.965 20 5 FHBDRN Cc1cc(N[C@H]2CC[N@@H+]([C@H](C)c3ccccc3)C2)cc(C(=O)[O-])c1[N+](=O)[O-] ZINC000580650802 940481220 /nfs/dbraw/zinc/48/12/20/940481220.db2.gz ZKUDUZCUIKQDJX-ZBFHGGJFSA-N 0 0 369.421 3.849 20 5 FHBDRN CC(C)[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)c2ccccc21 ZINC000580610078 940482460 /nfs/dbraw/zinc/48/24/60/940482460.db2.gz WNSHXWPWYAWODA-INIZCTEOSA-N 0 0 368.389 3.766 20 5 FHBDRN CNc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc([C@@H]2CCCOC2)cc1 ZINC000580716568 940482690 /nfs/dbraw/zinc/48/26/90/940482690.db2.gz IVUDTDMFVCDIKS-OAHLLOKOSA-N 0 0 355.394 3.783 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)NC[C@@](C)(O)c2cccs2)cc1[N+](=O)[O-] ZINC000177918916 940483065 /nfs/dbraw/zinc/48/30/65/940483065.db2.gz QVLPIMJLNKKPDD-GOSISDBHSA-N 0 0 362.451 3.591 20 5 FHBDRN Cc1ccc(NC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)cc1OC(C)C ZINC000580686628 940483880 /nfs/dbraw/zinc/48/38/80/940483880.db2.gz SVAVRUXISCYHCC-UHFFFAOYSA-N 0 0 358.350 3.671 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)NC[C@](C)(O)c2ccsc2)cc1[N+](=O)[O-] ZINC000177926508 940485491 /nfs/dbraw/zinc/48/54/91/940485491.db2.gz HTBXPLHDZHONGU-SFHVURJKSA-N 0 0 362.451 3.591 20 5 FHBDRN CC(C)(NC(=O)NCCc1c(F)cccc1F)c1ccc([N+](=O)[O-])cc1 ZINC000431769757 940487097 /nfs/dbraw/zinc/48/70/97/940487097.db2.gz JDGFUXDBVRRIDM-UHFFFAOYSA-N 0 0 363.364 3.650 20 5 FHBDRN Cc1cc(-c2ncco2)ccc1NC(=O)CNc1ccccc1[N+](=O)[O-] ZINC000580802681 940487793 /nfs/dbraw/zinc/48/77/93/940487793.db2.gz MZDHIXSBNUTHPL-UHFFFAOYSA-N 0 0 352.350 3.609 20 5 FHBDRN CCOCCC1(CNC(=O)c2cc(OCC)ccc2[N+](=O)[O-])CCCC1 ZINC000549007962 940489652 /nfs/dbraw/zinc/48/96/52/940489652.db2.gz YYPYEROXRAAMMH-UHFFFAOYSA-N 0 0 364.442 3.710 20 5 FHBDRN CC(C)c1nnc(CN[C@H](c2ccc([N+](=O)[O-])cc2)C(F)(F)F)s1 ZINC000581136229 940496077 /nfs/dbraw/zinc/49/60/77/940496077.db2.gz UNMCEAIZDPZZMY-GFCCVEGCSA-N 0 0 360.361 3.963 20 5 FHBDRN C[C@@H](C(=O)NCc1csc(-c2ccco2)n1)c1cccc([N+](=O)[O-])c1 ZINC000581228123 940497018 /nfs/dbraw/zinc/49/70/18/940497018.db2.gz HWGVZNFVYHZPGX-LLVKDONJSA-N 0 0 357.391 3.731 20 5 FHBDRN CN(C)c1nnc(Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])s1 ZINC000066468354 940498146 /nfs/dbraw/zinc/49/81/46/940498146.db2.gz GQZXCFCUTMZROK-UHFFFAOYSA-N 0 0 350.347 3.682 20 5 FHBDRN CC(C)Oc1ccccc1[C@@H](C)Nc1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1 ZINC000581327076 940499235 /nfs/dbraw/zinc/49/92/35/940499235.db2.gz JXSDRXJSOPBXIR-GFCCVEGCSA-N 0 0 368.393 3.626 20 5 FHBDRN Cc1ccccc1[C@H](C)c1noc(-c2cc([N+](=O)[O-])cc3c2OCCO3)n1 ZINC000581336060 940499711 /nfs/dbraw/zinc/49/97/11/940499711.db2.gz 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SIWLSNSFZDQLCK-UHFFFAOYSA-N 0 0 365.783 3.707 20 5 FHBDRN O=C(NCc1cccc([N+](=O)[O-])c1)N[C@H](c1nccs1)c1ccccc1 ZINC000170879649 940877839 /nfs/dbraw/zinc/87/78/39/940877839.db2.gz ZTSBFRWEVROVBP-INIZCTEOSA-N 0 0 368.418 3.640 20 5 FHBDRN COc1cc(C[N@H+](C)[C@H](C)C2(C)CC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000180260661 940891272 /nfs/dbraw/zinc/89/12/72/940891272.db2.gz OFAXHZWFXFYIIX-LLVKDONJSA-N 0 0 358.385 3.868 20 5 FHBDRN CC(C)(C)OC(=O)[C@@H](NCc1c(F)cccc1[N+](=O)[O-])c1ccccc1 ZINC000180284251 940922412 /nfs/dbraw/zinc/92/24/12/940922412.db2.gz GCGIITLNMFTFHL-KRWDZBQOSA-N 0 0 360.385 3.907 20 5 FHBDRN O=C(NCCSc1ccccc1)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000120869256 945360735 /nfs/dbraw/zinc/36/07/35/945360735.db2.gz QICQYAKPDRSKPF-UHFFFAOYSA-N 0 0 353.403 3.665 20 5 FHBDRN O=C1CC[C@H](c2cccc(N[C@H](Cc3ccccc3[N+](=O)[O-])C3CC3)c2)N1 ZINC000414313139 940945495 /nfs/dbraw/zinc/94/54/95/940945495.db2.gz KBHUIDMYQNLWOF-RTBURBONSA-N 0 0 365.433 3.979 20 5 FHBDRN 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COc1ccccc1[C@@H](C)CC(=O)OCC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000728664906 941066519 /nfs/dbraw/zinc/06/65/19/941066519.db2.gz UHVQYBQNBNNPHT-ZDUSSCGKSA-N 0 0 357.362 3.523 20 5 FHBDRN Cc1cnc(OCC(=O)N2CC[C@@H](C)Sc3ccccc32)c([N+](=O)[O-])c1 ZINC000176705026 941070345 /nfs/dbraw/zinc/07/03/45/941070345.db2.gz NJYSOWFNIMYTNQ-CYBMUJFWSA-N 0 0 373.434 3.595 20 5 FHBDRN O=C(Nc1cc([N+](=O)[O-])ccc1[O-])c1ccc(Cl)cc1Br ZINC000180766611 941073150 /nfs/dbraw/zinc/07/31/50/941073150.db2.gz IDSQJIFLMRCFAD-UHFFFAOYSA-N 0 0 371.574 3.969 20 5 FHBDRN CC(C)(NCc1nc(-c2cccc([N+](=O)[O-])c2)no1)c1ccc(F)c(F)c1 ZINC000180873083 941087304 /nfs/dbraw/zinc/08/73/04/941087304.db2.gz WMZJMYLMMKBLAY-UHFFFAOYSA-N 0 0 374.347 3.948 20 5 FHBDRN CN(C(=O)Nc1ccc([N+](=O)[O-])cc1)C1CCN(c2ccccc2)CC1 ZINC000414393850 941090844 /nfs/dbraw/zinc/09/08/44/941090844.db2.gz AMQAMRZYBXSDBN-UHFFFAOYSA-N 0 0 354.410 3.728 20 5 FHBDRN Cc1nn(C)c(C(=O)N2CCCCC[C@@H]2/C=C/c2cccs2)c1[N+](=O)[O-] ZINC000180922748 941092323 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FHBDRN O=C(N[C@H]1C[C@@H]1c1cccc(F)c1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000181077637 941107522 /nfs/dbraw/zinc/10/75/22/941107522.db2.gz HVDNOHRVFNHYJY-OCCSQVGLSA-N 0 0 366.295 3.621 20 5 FHBDRN CC[C@@H]1CN(C(=O)c2c(N)cccc2[N+](=O)[O-])CC[C@@H]1c1ccccc1 ZINC000181148568 941109005 /nfs/dbraw/zinc/10/90/05/941109005.db2.gz XVNBSYGXJLDQDB-ZBFHGGJFSA-N 0 0 353.422 3.833 20 5 FHBDRN COC(=O)[C@@H](C)CSc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000115521050 941114762 /nfs/dbraw/zinc/11/47/62/941114762.db2.gz LXGYORDVHUGNRY-LBPRGKRZSA-N 0 0 359.403 3.727 20 5 FHBDRN C[C@@H](NCc1c(F)cccc1[N+](=O)[O-])c1ccc(N2CCOC2=O)cc1 ZINC000181287842 941120196 /nfs/dbraw/zinc/12/01/96/941120196.db2.gz BDFWDAOEBISFEX-GFCCVEGCSA-N 0 0 359.357 3.541 20 5 FHBDRN CC(C)CCc1nc(CS(=O)(=O)Cc2ccccc2[N+](=O)[O-])cs1 ZINC000414421426 941121622 /nfs/dbraw/zinc/12/16/22/941121622.db2.gz XVZCPNYRYUPOSI-UHFFFAOYSA-N 0 0 368.480 3.755 20 5 FHBDRN CC[C@@H](NC(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1)c1cccs1 ZINC000188871528 941123108 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CC1(C)CN(C(=O)c2ccc([N+](=O)[O-])c3cccnc23)CC2(CCCC2)O1 ZINC000189173366 941149502 /nfs/dbraw/zinc/14/95/02/941149502.db2.gz MBTBIIWOACTMEX-UHFFFAOYSA-N 0 0 369.421 3.707 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN(C)CC1(c2ccccc2)CC1 ZINC000189292387 941155462 /nfs/dbraw/zinc/15/54/62/941155462.db2.gz CWJOYXRGWZQWEO-UHFFFAOYSA-N 0 0 353.422 3.505 20 5 FHBDRN COc1ccc(F)cc1CNC(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000189306016 941155697 /nfs/dbraw/zinc/15/56/97/941155697.db2.gz WNKJFWQMBDUHAD-NSHDSACASA-N 0 0 364.398 3.540 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)Nc1ccc2c(c1)C(=O)CCC2 ZINC000177985398 941156668 /nfs/dbraw/zinc/15/66/68/941156668.db2.gz ZTPVLUQSWIUFFB-UHFFFAOYSA-N 0 0 356.403 3.845 20 5 FHBDRN O=C(Nc1ccsc1Cl)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000189402849 941157152 /nfs/dbraw/zinc/15/71/52/941157152.db2.gz QNCBZFBIPTYWOY-UHFFFAOYSA-N 0 0 366.830 3.664 20 5 FHBDRN COc1ccc2[nH]c(C(=O)N(Cc3cccc([N+](=O)[O-])c3)C3CC3)cc2c1 ZINC000189507019 941159284 /nfs/dbraw/zinc/15/92/84/941159284.db2.gz KTNKVXFEERWBBY-UHFFFAOYSA-N 0 0 365.389 3.890 20 5 FHBDRN Cc1csc([C@@H](Nc2c3ccccc3n(C)c(=O)c2[N+](=O)[O-])C2CC2)n1 ZINC000892677990 941160268 /nfs/dbraw/zinc/16/02/68/941160268.db2.gz UMGTWPGZCXPWLK-AWEZNQCLSA-N 0 0 370.434 3.775 20 5 FHBDRN COc1ccc(NC(=O)[C@@H](C)Nc2cccc3ccn(C)c32)c([N+](=O)[O-])c1 ZINC000189585266 941166095 /nfs/dbraw/zinc/16/60/95/941166095.db2.gz GLPUTCRJXYAVKL-GFCCVEGCSA-N 0 0 368.393 3.534 20 5 FHBDRN COc1cc(C(=O)Nc2c[nH]nc2-c2ccccc2)cc([N+](=O)[O-])c1C ZINC000189600603 941214510 /nfs/dbraw/zinc/21/45/10/941214510.db2.gz HYBBROJVGWSCPT-UHFFFAOYSA-N 0 0 352.350 3.554 20 5 FHBDRN CCOC(=O)[C@H](NCc1ccc(OC)c([N+](=O)[O-])c1)c1cccc(C)c1C ZINC000189664091 941245669 /nfs/dbraw/zinc/24/56/69/941245669.db2.gz OYQGZAVAUFDGAF-LJQANCHMSA-N 0 0 372.421 3.614 20 5 FHBDRN COc1ccc(OC)c(NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)c1 ZINC000178446285 941256602 /nfs/dbraw/zinc/25/66/02/941256602.db2.gz LEMOPIROJGCEGE-UHFFFAOYSA-N 0 0 370.283 3.883 20 5 FHBDRN O=C(Nc1cc2c(cn1)CCC2)c1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC000452161618 941259282 /nfs/dbraw/zinc/25/92/82/941259282.db2.gz KMWWWOBXMMTGQX-UHFFFAOYSA-N 0 0 351.284 3.750 20 5 FHBDRN Cc1cn(-c2c(F)cccc2F)nc1C(=O)N(C)c1cccc([N+](=O)[O-])c1 ZINC000189721170 941267779 /nfs/dbraw/zinc/26/77/79/941267779.db2.gz FLWTXIMZTYCGNZ-UHFFFAOYSA-N 0 0 372.331 3.644 20 5 FHBDRN C[C@@H](NC(=O)Nc1cc2c(cc1F)NC(=O)CC2)c1cccc([N+](=O)[O-])c1 ZINC000189765427 941277701 /nfs/dbraw/zinc/27/77/01/941277701.db2.gz MDWYVEDHDRHDCF-SNVBAGLBSA-N 0 0 372.356 3.501 20 5 FHBDRN Cc1ccc(-n2cccn2)cc1N[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000189841344 941287674 /nfs/dbraw/zinc/28/76/74/941287674.db2.gz SFFSGBJRMVCVAT-AWEZNQCLSA-N 0 0 365.393 3.528 20 5 FHBDRN COC[C@H](C)n1ccc(NCc2ccc(-c3ccccc3[N+](=O)[O-])o2)n1 ZINC000189862551 941290156 /nfs/dbraw/zinc/29/01/56/941290156.db2.gz WCICWGBJVYDBIJ-ZDUSSCGKSA-N 0 0 356.382 3.871 20 5 FHBDRN Cc1cc(C)c(NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)c(C)n1 ZINC000178791238 941304665 /nfs/dbraw/zinc/30/46/65/941304665.db2.gz SALYDDCYERNXBO-UHFFFAOYSA-N 0 0 364.199 3.930 20 5 FHBDRN Cn1nccc1[C@H]1CCCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1 ZINC000376601487 941309120 /nfs/dbraw/zinc/30/91/20/941309120.db2.gz ZZIJOJARTXNNKA-LBPRGKRZSA-N 0 0 370.434 3.563 20 5 FHBDRN Cc1ccc(C)c(S(=O)(=O)N[C@@H]2CCCc3sccc32)c1[N+](=O)[O-] ZINC000480702374 941311133 /nfs/dbraw/zinc/31/11/33/941311133.db2.gz WXDFREGRWZAGRF-CYBMUJFWSA-N 0 0 366.464 3.629 20 5 FHBDRN Cc1cc(NCc2cccnc2N(C)C)c([N+](=O)[O-])cc1C(F)(F)F ZINC000549109463 941322869 /nfs/dbraw/zinc/32/28/69/941322869.db2.gz UFQMXGDRXKTVRI-UHFFFAOYSA-N 0 0 354.332 3.995 20 5 FHBDRN COc1ccc2nc(Cl)c(C(=O)NCc3ccc([N+](=O)[O-])cc3)cc2c1 ZINC000178262065 941332732 /nfs/dbraw/zinc/33/27/32/941332732.db2.gz PWJHCQLUNDEXCR-UHFFFAOYSA-N 0 0 371.780 3.735 20 5 FHBDRN Cc1ccc(CN(C)C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)s1 ZINC000181489771 941335744 /nfs/dbraw/zinc/33/57/44/941335744.db2.gz JOPFYCFPJOPZOG-UHFFFAOYSA-N 0 0 356.350 3.838 20 5 FHBDRN C[C@H](NC(=O)c1cccc(NC(=O)[C@@H]2C[C@@H]2C)c1)c1ccc([N+](=O)[O-])cc1 ZINC000452183346 941367498 /nfs/dbraw/zinc/36/74/98/941367498.db2.gz ORXLUEXUGGZWIM-ZJNRKIDTSA-N 0 0 367.405 3.680 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1CNc1cccc([C@@H]2CCC(=O)N2)c1 ZINC000414535455 941375551 /nfs/dbraw/zinc/37/55/51/941375551.db2.gz IDDNSOAHHPNCRT-KRWDZBQOSA-N 0 0 355.394 3.557 20 5 FHBDRN CC(C)NC(=O)[C@H](C)NCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000414548651 941377135 /nfs/dbraw/zinc/37/71/35/941377135.db2.gz YBURQJDYVBWHAX-NSHDSACASA-N 0 0 365.817 3.511 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2nc(CNCc3nnc(C4CC4)s3)cs2)c1 ZINC000414556805 941378789 /nfs/dbraw/zinc/37/87/89/941378789.db2.gz OYHOUTXLCSROKD-UHFFFAOYSA-N 0 0 373.463 3.737 20 5 FHBDRN C[C@H](NC(=O)N(C)[C@@H](C)[C@@H]1Cc2ccccc2O1)c1cccc([N+](=O)[O-])c1 ZINC000136107415 941379731 /nfs/dbraw/zinc/37/97/31/941379731.db2.gz AROKBKMJVJYOKT-NJSLBKSFSA-N 0 0 369.421 3.689 20 5 FHBDRN C/C=C/c1ccc(OS(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)c(OC)c1 ZINC000023862789 941385307 /nfs/dbraw/zinc/38/53/07/941385307.db2.gz HVQWERUZBYGEJC-SNAWJCMRSA-N 0 0 363.391 3.713 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2ccc(CNCc3cnc4n3CCCC4)o2)cc1 ZINC000376726991 941386665 /nfs/dbraw/zinc/38/66/65/941386665.db2.gz BQGXKLUUDDXHSW-UHFFFAOYSA-N 0 0 352.394 3.677 20 5 FHBDRN COC(=O)[C@@H]1CC12CCN(c1cc(C)c(C(F)(F)F)cc1[N+](=O)[O-])CC2 ZINC000549117945 941393798 /nfs/dbraw/zinc/39/37/98/941393798.db2.gz ARXSLJWUIYRZNR-LBPRGKRZSA-N 0 0 372.343 3.702 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N(C)c1ccc(N(C)C)cc1 ZINC000103415736 941400425 /nfs/dbraw/zinc/40/04/25/941400425.db2.gz NWRHTTHYMUBKRG-ZDUSSCGKSA-N 0 0 359.451 3.804 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])s1)N1CCC[C@@H](Cn2cnc3ccccc32)C1 ZINC000376939670 941470670 /nfs/dbraw/zinc/47/06/70/941470670.db2.gz ASGBHRZBHKNBRB-CYBMUJFWSA-N 0 0 370.434 3.558 20 5 FHBDRN Cc1cccc([C@H]2CCCN2C(=O)COc2ccc([N+](=O)[O-])c(C)c2)c1 ZINC000431837872 941482059 /nfs/dbraw/zinc/48/20/59/941482059.db2.gz 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ZINC000066786574 941588697 /nfs/dbraw/zinc/58/86/97/941588697.db2.gz ZSRMRTHALXAYQF-UHFFFAOYSA-N 0 0 358.369 3.573 20 5 FHBDRN COc1ccc(NC(=O)N[C@@H](c2ccccc2)[C@H]2CCCO2)cc1[N+](=O)[O-] ZINC000541105819 941598945 /nfs/dbraw/zinc/59/89/45/941598945.db2.gz LUAPIJUDAYNNIG-MSOLQXFVSA-N 0 0 371.393 3.645 20 5 FHBDRN CCc1oc(C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc1C(=O)OC ZINC000549194751 941620441 /nfs/dbraw/zinc/62/04/41/941620441.db2.gz OPFBNTJMNNJDPD-UHFFFAOYSA-N 0 0 374.393 3.588 20 5 FHBDRN CC(=O)Nc1ccc(C(=O)N2CCCCc3cc([N+](=O)[O-])ccc32)cc1F ZINC000892855470 941622575 /nfs/dbraw/zinc/62/25/75/941622575.db2.gz XUYNNYQBFWKFRK-UHFFFAOYSA-N 0 0 371.368 3.675 20 5 FHBDRN CC(C)(C)CN(CC(C)(C)C)C(=O)C(=O)Nc1cc(F)cc([N+](=O)[O-])c1 ZINC000472719628 941627195 /nfs/dbraw/zinc/62/71/95/941627195.db2.gz BIGZIELDJQMAQX-UHFFFAOYSA-N 0 0 367.421 3.593 20 5 FHBDRN O=C(Cc1cc(F)c(Cl)cc1[N+](=O)[O-])N1CCC[C@@H]1c1cccnc1 ZINC000365553553 941634987 /nfs/dbraw/zinc/63/49/87/941634987.db2.gz BXJLSOOIOFEJKG-OAHLLOKOSA-N 0 0 363.776 3.689 20 5 FHBDRN COc1ccc(CN(C(=O)[C@H](C)c2cccc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000583256434 941650256 /nfs/dbraw/zinc/65/02/56/941650256.db2.gz HHMBULIOMJSLJI-CQSZACIVSA-N 0 0 354.406 3.898 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1Cl)N1CC[C@@H](C2CCOCC2)C1 ZINC000377329263 941651727 /nfs/dbraw/zinc/65/17/27/941651727.db2.gz GLBHXQDXZWWIOL-GFCCVEGCSA-N 0 0 353.806 3.529 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2cc3c(cc2Cl)OCO3)c1 ZINC000549212285 941651976 /nfs/dbraw/zinc/65/19/76/941651976.db2.gz GKGTZVMSHXNIJN-UHFFFAOYSA-N 0 0 364.741 3.628 20 5 FHBDRN O=C(Nc1cc(F)cc([N+](=O)[O-])c1)N1CC[C@](F)(c2ccccc2F)C1 ZINC000549226847 941677961 /nfs/dbraw/zinc/67/79/61/941677961.db2.gz VJXPQMFDPYCNSH-QGZVFWFLSA-N 0 0 365.311 3.976 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)c2ccc(F)cc2F)c1 ZINC000549232164 941682940 /nfs/dbraw/zinc/68/29/40/941682940.db2.gz VGGXVPXSZKFJLU-SNVBAGLBSA-N 0 0 350.321 3.763 20 5 FHBDRN CCN(C(=O)Nc1cccc([N+](=O)[O-])c1)[C@@H](COC)Cc1ccccc1 ZINC000472755568 941686725 /nfs/dbraw/zinc/68/67/25/941686725.db2.gz WYEUJRHBXXVWKJ-GOSISDBHSA-N 0 0 357.410 3.706 20 5 FHBDRN Cc1c(C(=O)Nc2ccc(SC(=O)N(C)C)cc2)cccc1[N+](=O)[O-] ZINC000729242333 941699886 /nfs/dbraw/zinc/69/98/86/941699886.db2.gz PAUZWSMSGGBENW-UHFFFAOYSA-N 0 0 359.407 3.929 20 5 FHBDRN O=[N+]([O-])C[C@@H](Oc1ccc(Br)c(Cl)c1)c1cccnc1 ZINC001225444328 941717370 /nfs/dbraw/zinc/71/73/70/941717370.db2.gz MSCJNKPZHGZTKF-CYBMUJFWSA-N 0 0 357.591 3.894 20 5 FHBDRN CC(C)Oc1cccc(CN(C)[C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000120657148 941727480 /nfs/dbraw/zinc/72/74/80/941727480.db2.gz RPVZGRHIJOCGFX-OAHLLOKOSA-N 0 0 371.437 3.841 20 5 FHBDRN COc1ccc(C[C@@H](C)CN(C)C(=O)c2cccc([N+](=O)[O-])c2C)cc1 ZINC000123323444 941729174 /nfs/dbraw/zinc/72/91/74/941729174.db2.gz OIWYSCKSPBARIZ-CQSZACIVSA-N 0 0 356.422 3.863 20 5 FHBDRN NC(=O)C[C@@H](Nc1nc2ccccc2cc1[N+](=O)[O-])c1cccc(Cl)c1 ZINC000473522743 941750592 /nfs/dbraw/zinc/75/05/92/941750592.db2.gz MBURKYFTPLJHFQ-OAHLLOKOSA-N 0 0 370.796 3.825 20 5 FHBDRN C[C@@H](CSc1ccccc1)C(=O)NCCNc1ccccc1[N+](=O)[O-] ZINC000261417482 941754266 /nfs/dbraw/zinc/75/42/66/941754266.db2.gz AGAYDFWZIYPVES-AWEZNQCLSA-N 0 0 359.451 3.551 20 5 FHBDRN CN(C(=O)[C@@H]1CCO[C@H]1c1ccc(Cl)cc1)c1cccc([N+](=O)[O-])c1 ZINC000415326482 941757724 /nfs/dbraw/zinc/75/77/24/941757724.db2.gz AEHQRHJKUUMYQA-SJORKVTESA-N 0 0 360.797 3.989 20 5 FHBDRN Cc1cc(NCCNc2ccccn2)c(Br)cc1[N+](=O)[O-] ZINC000473524829 941763943 /nfs/dbraw/zinc/76/39/43/941763943.db2.gz IPDJANPCNVALQS-UHFFFAOYSA-N 0 0 351.204 3.585 20 5 FHBDRN COc1ccc(NC(=O)c2c(C)cc(Cl)cc2[N+](=O)[O-])cc1OC ZINC000460458901 941763998 /nfs/dbraw/zinc/76/39/98/941763998.db2.gz CHSVGEPPXDQQLU-UHFFFAOYSA-N 0 0 350.758 3.826 20 5 FHBDRN O=[N+]([O-])c1cccc(OC[C@@H](O)CSc2ccc3ccccc3n2)c1 ZINC000015232416 941764775 /nfs/dbraw/zinc/76/47/75/941764775.db2.gz NEBSLHXUTTUBKW-OAHLLOKOSA-N 0 0 356.403 3.675 20 5 FHBDRN Cc1ccnc(OC2CCN(c3nc4ccccc4cc3[N+](=O)[O-])CC2)c1 ZINC000473525354 941765323 /nfs/dbraw/zinc/76/53/23/941765323.db2.gz WMHIJKGTUKOSIZ-UHFFFAOYSA-N 0 0 364.405 3.894 20 5 FHBDRN COc1ccc(NC(=O)NCc2cc(F)c(Cl)cc2F)cc1[N+](=O)[O-] ZINC000433583876 941770681 /nfs/dbraw/zinc/77/06/81/941770681.db2.gz ZWRSKFMVJHKUNP-UHFFFAOYSA-N 0 0 371.727 3.857 20 5 FHBDRN C[C@@H](NCc1coc(-c2ccc([N+](=O)[O-])cc2)n1)c1ccc2n[nH]cc2c1 ZINC000513195496 941770836 /nfs/dbraw/zinc/77/08/36/941770836.db2.gz CQNILUPNWYFCRB-GFCCVEGCSA-N 0 0 363.377 3.977 20 5 FHBDRN O=[N+]([O-])c1cc(F)ccc1NC[C@@H](O)COc1ccc(C(F)(F)F)cc1 ZINC000513181808 941773745 /nfs/dbraw/zinc/77/37/45/941773745.db2.gz DENAETMUYMFEOP-GFCCVEGCSA-N 0 0 374.290 3.605 20 5 FHBDRN Cc1cccc(OC[C@H](O)CNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 ZINC000513201594 941778056 /nfs/dbraw/zinc/77/80/56/941778056.db2.gz OVEGZBIBAZFYED-CYBMUJFWSA-N 0 0 370.327 3.774 20 5 FHBDRN CC(=O)c1cc(-c2nc(Cc3cccc([N+](=O)[O-])c3C)no2)c(C)nc1C ZINC000472790667 941791740 /nfs/dbraw/zinc/79/17/40/941791740.db2.gz NCDLXIDSXZJASJ-UHFFFAOYSA-N 0 0 366.377 3.758 20 5 FHBDRN C[C@H](NC(=O)[C@@H]1COCC[C@@H]1c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000415395945 941797699 /nfs/dbraw/zinc/79/76/99/941797699.db2.gz TYLAHNGYSPBBHQ-BMGDILEWSA-N 0 0 354.406 3.592 20 5 FHBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)N[C@@H]1C[C@H]1c1cccc2ccccc21 ZINC000430000325 941802355 /nfs/dbraw/zinc/80/23/55/941802355.db2.gz IAISCLXFHMEKDM-DLBZAZTESA-N 0 0 368.414 3.582 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CCC[C@@H](Oc2ccccc2)C1 ZINC000412127057 941806819 /nfs/dbraw/zinc/80/68/19/941806819.db2.gz RULGPIVQPNUSSG-HSALFYBXSA-N 0 0 366.417 3.768 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)N1CCC[C@@H](c2ccccc2)C1 ZINC000431844502 941813320 /nfs/dbraw/zinc/81/33/20/941813320.db2.gz MMZBBZLNUMXYGH-GOSISDBHSA-N 0 0 353.422 3.727 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NCc2c(C)c3ccccc3n2C)c1 ZINC000549274074 941813521 /nfs/dbraw/zinc/81/35/21/941813521.db2.gz BYXRBQRHORWYFR-UHFFFAOYSA-N 0 0 367.405 3.724 20 5 FHBDRN Cc1cc(Cl)c(C(=O)Nc2ccccc2C[S@](C)=O)cc1[N+](=O)[O-] ZINC001267661031 941820465 /nfs/dbraw/zinc/82/04/65/941820465.db2.gz WIPFVRZEIALSIH-DEOSSOPVSA-N 0 0 366.826 3.687 20 5 FHBDRN COc1cc(Cl)c(C(=O)COc2cc(F)cc([N+](=O)[O-])c2)cc1OC ZINC000433644645 941820482 /nfs/dbraw/zinc/82/04/82/941820482.db2.gz JZBHFOBTVUTGCQ-UHFFFAOYSA-N 0 0 369.732 3.666 20 5 FHBDRN C[C@@H](C(=O)N(C)CCc1cccc([N+](=O)[O-])c1)[C@H]1OCCc2sccc21 ZINC000513304350 941837100 /nfs/dbraw/zinc/83/71/00/941837100.db2.gz XGHKETZHTNOPBR-FZKQIMNGSA-N 0 0 374.462 3.607 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])Nc1ccc(Br)cc1 ZINC000047608335 941840221 /nfs/dbraw/zinc/84/02/21/941840221.db2.gz XFXTWDLHWVLFFD-UHFFFAOYSA-N 0 0 365.183 3.765 20 5 FHBDRN Cn1ccnc1[C@@H]1CCN(c2c3cc(Cl)ccc3ncc2[N+](=O)[O-])C1 ZINC000892984680 941842994 /nfs/dbraw/zinc/84/29/94/941842994.db2.gz FLOGCKSLNAIIFH-LLVKDONJSA-N 0 0 357.801 3.524 20 5 FHBDRN CO[C@@H](C)[C@@H](C)Nc1ccc(C(=O)Nc2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000583967285 941849754 /nfs/dbraw/zinc/84/97/54/941849754.db2.gz WVGZECDAIFFRGY-KGLIPLIRSA-N 0 0 357.410 3.991 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N(C)[C@@H](C)c2cccc(Cl)c2)c1[N+](=O)[O-] ZINC000433707225 941851999 /nfs/dbraw/zinc/85/19/99/941851999.db2.gz BJZXJQMUGLOUMH-JTQLQIEISA-N 0 0 350.806 3.928 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)c1cc(C2CCCCC2)n[nH]1 ZINC000513337936 941852445 /nfs/dbraw/zinc/85/24/45/941852445.db2.gz HLLHYFGXHIMQHR-UHFFFAOYSA-N 0 0 356.426 3.680 20 5 FHBDRN C[C@H](CNC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)Sc1ccccc1 ZINC000412153382 941852516 /nfs/dbraw/zinc/85/25/16/941852516.db2.gz WPMGJOYODHIBDK-JEBQAFNWSA-N 0 0 356.447 3.995 20 5 FHBDRN C[C@H](CC(=O)c1ccccc1F)C(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000513337438 941852891 /nfs/dbraw/zinc/85/28/91/941852891.db2.gz BARDTGHHLKFKJG-CQSZACIVSA-N 0 0 372.396 3.644 20 5 FHBDRN Cc1ncsc1NC(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000472815306 941854000 /nfs/dbraw/zinc/85/40/00/941854000.db2.gz YQBORTWHUJTXOX-UHFFFAOYSA-N 0 0 374.344 3.819 20 5 FHBDRN Cc1ccc(-c2cc(C(=O)N(C)CCc3cccc([N+](=O)[O-])c3)[nH]n2)cc1 ZINC000513347403 941860473 /nfs/dbraw/zinc/86/04/73/941860473.db2.gz ALQDXYRTQDBABI-UHFFFAOYSA-N 0 0 364.405 3.608 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NC1CC(C(F)(F)F)C1 ZINC000513350963 941861739 /nfs/dbraw/zinc/86/17/39/941861739.db2.gz JTBVKMJJUUDVKP-UHFFFAOYSA-N 0 0 359.348 3.856 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2cc(-n3cccn3)ccc2C)c1 ZINC000549294014 941862583 /nfs/dbraw/zinc/86/25/83/941862583.db2.gz LXBMPHSWECJVPK-UHFFFAOYSA-N 0 0 366.377 3.740 20 5 FHBDRN CC(C)Oc1cc(C(=O)N(C)[C@H](C)Cc2ccc(O)cc2)ccc1[N+](=O)[O-] ZINC000412176859 941864888 /nfs/dbraw/zinc/86/48/88/941864888.db2.gz ABZKHIAIZRLLNI-CQSZACIVSA-N 0 0 372.421 3.791 20 5 FHBDRN Cc1n[nH]c(C(=O)N[C@@H](c2ccc(CC(C)C)cc2)C2CC2)c1[N+](=O)[O-] ZINC000513344407 941865413 /nfs/dbraw/zinc/86/54/13/941865413.db2.gz ZYVAUAUXRYFURM-INIZCTEOSA-N 0 0 356.426 3.706 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@H](COc3ccccc3)C2)c1 ZINC000549294537 941867521 /nfs/dbraw/zinc/86/75/21/941867521.db2.gz QNTRWJXYGKIVQS-HNNXBMFYSA-N 0 0 370.405 3.535 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N[C@H](c2ccc(F)cc2)C2CCC2)c1[N+](=O)[O-] ZINC000433758469 941872380 /nfs/dbraw/zinc/87/23/80/941872380.db2.gz LABUZMSUBUFLEX-HNNXBMFYSA-N 0 0 360.389 3.852 20 5 FHBDRN COc1cc(C(=O)N[C@H]2CC(C)(C)c3ccccc32)cc([N+](=O)[O-])c1OC ZINC000431847556 941874121 /nfs/dbraw/zinc/87/41/21/941874121.db2.gz WJLDQBSAOMMKIU-HNNXBMFYSA-N 0 0 370.405 3.764 20 5 FHBDRN COc1ccccc1O[C@H]1CCCN(Cc2ccc([N+](=O)[O-])cc2OC)C1 ZINC000513370774 941879554 /nfs/dbraw/zinc/87/95/54/941879554.db2.gz KTUFLSSBJGFJIB-KRWDZBQOSA-N 0 0 372.421 3.655 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N[C@H]2CCCC[C@H]2Cc2ccccc2)c1[N+](=O)[O-] ZINC000433760365 941879594 /nfs/dbraw/zinc/87/95/94/941879594.db2.gz UUMYPMACVAVLFX-HOTGVXAUSA-N 0 0 370.453 3.973 20 5 FHBDRN CCN(Cc1ccc(Cl)s1)S(=O)(=O)c1csc([N+](=O)[O-])c1 ZINC000119351461 941880486 /nfs/dbraw/zinc/88/04/86/941880486.db2.gz ZBMOYGTYPFDFEU-UHFFFAOYSA-N 0 0 366.873 3.582 20 5 FHBDRN CC[C@@H](C)N(Cc1ccccc1)C(=O)COc1ccc([N+](=O)[O-])c(OC)c1 ZINC000146879205 941886715 /nfs/dbraw/zinc/88/67/15/941886715.db2.gz JWVSQMGLHZEUNC-OAHLLOKOSA-N 0 0 372.421 3.810 20 5 FHBDRN CN(Cc1cnn(C)c1)Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000119661053 941896348 /nfs/dbraw/zinc/89/63/48/941896348.db2.gz IMCVSZQSIJKUQK-UHFFFAOYSA-N 0 0 365.437 3.728 20 5 FHBDRN CO[C@H]1CC[C@@H](NC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)C1 ZINC000472833269 941897473 /nfs/dbraw/zinc/89/74/73/941897473.db2.gz NDTCZZZJLGYPNE-SJORKVTESA-N 0 0 369.421 3.504 20 5 FHBDRN O=C(Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1)Nc1ccc(F)cc1Cl ZINC000103463394 941897957 /nfs/dbraw/zinc/89/79/57/941897957.db2.gz IOWLIYONADJBMM-UHFFFAOYSA-N 0 0 374.759 3.890 20 5 FHBDRN COc1ccccc1O[C@H]1CCCN(Cc2ccc([N+](=O)[O-])c(OC)c2)C1 ZINC000513410529 941909155 /nfs/dbraw/zinc/90/91/55/941909155.db2.gz CYVKQAOMBYDARP-INIZCTEOSA-N 0 0 372.421 3.655 20 5 FHBDRN O=C(c1cscc1Br)N1CCc2c1cccc2[N+](=O)[O-] ZINC000513414469 941911910 /nfs/dbraw/zinc/91/19/10/941911910.db2.gz DWFIYKRVNQRNQQ-UHFFFAOYSA-N 0 0 353.197 3.622 20 5 FHBDRN Cc1c(NC(=O)N2CCC[C@@H]2Cn2ccnc2C(C)C)cccc1[N+](=O)[O-] ZINC000377709281 941917832 /nfs/dbraw/zinc/91/78/32/941917832.db2.gz TTZZNFAWOKWFKP-OAHLLOKOSA-N 0 0 371.441 3.920 20 5 FHBDRN C[C@H](Nc1ncc([N+](=O)[O-])c(N)n1)c1cccc(OCc2ccccc2)c1 ZINC000433819289 941918706 /nfs/dbraw/zinc/91/87/06/941918706.db2.gz IZVYPHUNPQLCTC-ZDUSSCGKSA-N 0 0 365.393 3.549 20 5 FHBDRN Cc1noc(C)c1[C@H](C)CNC(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1 ZINC000412212925 941921200 /nfs/dbraw/zinc/92/12/00/941921200.db2.gz WFMYLOOOBTZJIR-LLVKDONJSA-N 0 0 361.398 3.520 20 5 FHBDRN Cc1cc(C(=O)N[C@H]2CCO[C@H]2c2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000182433508 941925024 /nfs/dbraw/zinc/92/50/24/941925024.db2.gz JVPWLZOTPQGKMJ-RDJZCZTQSA-N 0 0 360.797 3.817 20 5 FHBDRN CCC[C@H](C)NC(=O)[C@@H]1CCCN(c2nc3ccccc3cc2[N+](=O)[O-])C1 ZINC000473528910 941925392 /nfs/dbraw/zinc/92/53/92/941925392.db2.gz IBJLNKACGCIJIZ-GOEBONIOSA-N 0 0 370.453 3.664 20 5 FHBDRN CC(C)Oc1cccc([C@H](C)NC(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])c1 ZINC000433831243 941926267 /nfs/dbraw/zinc/92/62/67/941926267.db2.gz CDAAAAXVECUNLW-LBPRGKRZSA-N 0 0 360.414 3.720 20 5 FHBDRN C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1)c1ncon1 ZINC000182537667 941931397 /nfs/dbraw/zinc/93/13/97/941931397.db2.gz FMVDCBZPIZVQIG-LLVKDONJSA-N 0 0 370.390 3.620 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@H]1CCO[C@H]1c1ccc(Cl)cc1 ZINC000182485262 941934280 /nfs/dbraw/zinc/93/42/80/941934280.db2.gz RUEROVZOWQDWNQ-IRXDYDNUSA-N 0 0 360.797 3.817 20 5 FHBDRN Cn1cc(-c2cccc(CNc3nc4ccccc4cc3[N+](=O)[O-])c2)cn1 ZINC000473528770 941935166 /nfs/dbraw/zinc/93/51/66/941935166.db2.gz VBUDJZXXUZWKNP-UHFFFAOYSA-N 0 0 359.389 3.578 20 5 FHBDRN O=C(Nc1cccc(Br)c1Cl)c1ccc([N+](=O)[O-])cn1 ZINC000549322288 941949486 /nfs/dbraw/zinc/94/94/86/941949486.db2.gz MIDNQCKGCSEGQY-UHFFFAOYSA-N 0 0 356.563 3.658 20 5 FHBDRN CC(C)C[C@H]1C[C@@H](NC(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)CCO1 ZINC000412239212 941950444 /nfs/dbraw/zinc/95/04/44/941950444.db2.gz GBHVOFWNVWAGMI-HOTGVXAUSA-N 0 0 364.442 3.706 20 5 FHBDRN CCN(C(=O)c1cc([N+](=O)[O-])ccc1SCC1CCCC1)[C@@H](C)CO ZINC000513469681 941951020 /nfs/dbraw/zinc/95/10/20/941951020.db2.gz RJYWKBYCRPJWBS-ZDUSSCGKSA-N 0 0 366.483 3.720 20 5 FHBDRN CC(C)[C@@H](CNC(=O)NCCc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000517550104 941952437 /nfs/dbraw/zinc/95/24/37/941952437.db2.gz BRZRAMGMYZXCJY-LJQANCHMSA-N 0 0 355.438 3.876 20 5 FHBDRN CCN(Cc1nc2ccccc2c(=O)[nH]1)[C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000182636641 941956552 /nfs/dbraw/zinc/95/65/52/941956552.db2.gz ANEQLPIVYNNFFQ-AWEZNQCLSA-N 0 0 366.421 3.723 20 5 FHBDRN C[C@H](O)C[C@@H]1CCCCCN1C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000513497463 941963413 /nfs/dbraw/zinc/96/34/13/941963413.db2.gz XFMVUOOEKPPTRV-RYUDHWBXSA-N 0 0 355.822 3.796 20 5 FHBDRN O=C(N[C@@H](c1c(F)cccc1F)C(F)(F)F)c1ccc([N+](=O)[O-])s1 ZINC000182747851 941964922 /nfs/dbraw/zinc/96/49/22/941964922.db2.gz LBWCSVAKHDWEBH-NSHDSACASA-N 0 0 366.267 3.968 20 5 FHBDRN Cc1cc(NC(=O)N2C[C@@H](C)O[C@H](c3ccsc3)C2)ccc1[N+](=O)[O-] ZINC000182763212 941965689 /nfs/dbraw/zinc/96/56/89/941965689.db2.gz NLDPJEUJCXXDIC-WBMJQRKESA-N 0 0 361.423 3.959 20 5 FHBDRN COc1cc(CS[C@H]2CCO[C@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000182788366 941966929 /nfs/dbraw/zinc/96/69/29/941966929.db2.gz SDYDRQAZWJKDDW-XPTSAGLGSA-N 0 0 363.382 3.658 20 5 FHBDRN O=C(N[C@H](c1ccccc1)c1cccnc1)c1cc([N+](=O)[O-])cc(F)c1F ZINC000377754771 941968745 /nfs/dbraw/zinc/96/87/45/941968745.db2.gz XFVBVBHEHXNFMP-GOSISDBHSA-N 0 0 369.327 3.787 20 5 FHBDRN CN(C)C(=O)C[C@@H](Nc1nc2ccccc2cc1[N+](=O)[O-])c1ccccc1 ZINC000473530197 941969736 /nfs/dbraw/zinc/96/97/36/941969736.db2.gz YLQCQKNPWAAROW-QGZVFWFLSA-N 0 0 364.405 3.775 20 5 FHBDRN C[C@@H]1C[C@H](c2cccnc2)N(C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000182814260 941972060 /nfs/dbraw/zinc/97/20/60/941972060.db2.gz PQRHKDDOGNSAKB-SJKOYZFVSA-N 0 0 359.813 3.795 20 5 FHBDRN O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CC[C@H](C(F)(F)F)C2(CCC2)C1 ZINC000513518434 941978020 /nfs/dbraw/zinc/97/80/20/941978020.db2.gz MHLIQIXZOFOMKG-ZDUSSCGKSA-N 0 0 360.307 3.929 20 5 FHBDRN Cc1sc(C(=O)Nc2cc(C)cc(Br)c2O)cc1[N+](=O)[O-] ZINC000182917033 941987749 /nfs/dbraw/zinc/98/77/49/941987749.db2.gz ZFBFMAHRVSODTA-UHFFFAOYSA-N 0 0 371.212 3.994 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2Cc3ccccc3OC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000412255400 941991049 /nfs/dbraw/zinc/99/10/49/941991049.db2.gz ZDEDVPPMJSHDIK-AWEZNQCLSA-N 0 0 370.405 3.805 20 5 FHBDRN CSc1cccc(C(=O)NCC[C@@H]2C[C@@H](C)O[C@@H](C)C2)c1[N+](=O)[O-] ZINC000549334976 941995367 /nfs/dbraw/zinc/99/53/67/941995367.db2.gz KOWJOIUJXZUULL-CLLJXQQHSA-N 0 0 352.456 3.640 20 5 FHBDRN Cc1nc([C@@H]2CCCCCN2C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)no1 ZINC000412260517 941997884 /nfs/dbraw/zinc/99/78/84/941997884.db2.gz VAICVDASKGZSHP-BBWFWOEESA-N 0 0 370.409 3.534 20 5 FHBDRN C[C@@H](C(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1)c1ccccc1 ZINC000182924614 941998681 /nfs/dbraw/zinc/99/86/81/941998681.db2.gz HAMNJPQNAYFKFD-OAHLLOKOSA-N 0 0 354.406 3.768 20 5 FHBDRN Cc1ccccc1C[C@@H]1CCCN1C(=O)COc1ccccc1[N+](=O)[O-] ZINC000513553403 942008857 /nfs/dbraw/zinc/00/88/57/942008857.db2.gz KYMJNZHPQKNUJJ-KRWDZBQOSA-N 0 0 354.406 3.516 20 5 FHBDRN O=C(Nc1cc(C(F)(F)F)ccn1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412261981 942011896 /nfs/dbraw/zinc/01/18/96/942011896.db2.gz XSHOXCWYMJAVLB-QWHCGFSZSA-N 0 0 351.284 3.751 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CC[C@@H](COc2ccccc2)C1 ZINC000412263184 942012444 /nfs/dbraw/zinc/01/24/44/942012444.db2.gz ZFEIGBIWKKBDIY-UIAACRFSSA-N 0 0 366.417 3.626 20 5 FHBDRN Cc1nn(C(C)(C)C)cc1[C@H](C)NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412265991 942013082 /nfs/dbraw/zinc/01/30/82/942013082.db2.gz FMTWIMQWZWSGCW-AFAVFJNCSA-N 0 0 370.453 3.836 20 5 FHBDRN COc1cc(C(=O)NCc2cccc(COC(C)(C)C)c2)ccc1[N+](=O)[O-] ZINC000101845827 942014590 /nfs/dbraw/zinc/01/45/90/942014590.db2.gz XNRQSMJNSWPRAS-UHFFFAOYSA-N 0 0 372.421 3.849 20 5 FHBDRN O=C(CC[C@@H]1CCOC1)N(Cc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000433981213 942022888 /nfs/dbraw/zinc/02/28/88/942022888.db2.gz MVLWNFCIDDMRTC-QGZVFWFLSA-N 0 0 354.406 3.945 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)Nc1cccc2cccnc21 ZINC000513584626 942024726 /nfs/dbraw/zinc/02/47/26/942024726.db2.gz YAEUZQCODLIWSC-UHFFFAOYSA-N 0 0 350.378 3.849 20 5 FHBDRN CCN(CCNC(=O)c1c(Cl)cccc1[N+](=O)[O-])c1ccccc1C ZINC000110219373 942024837 /nfs/dbraw/zinc/02/48/37/942024837.db2.gz VCJOOIQCHOKPOP-UHFFFAOYSA-N 0 0 361.829 3.813 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCc1ccccc1-n1ccnc1 ZINC000085620957 942027430 /nfs/dbraw/zinc/02/74/30/942027430.db2.gz UKBDONASWXORSB-UHFFFAOYSA-N 0 0 365.393 3.719 20 5 FHBDRN CN(Cc1cc(F)cc(F)c1)C(=O)CSc1ccccc1[N+](=O)[O-] ZINC000433992429 942030738 /nfs/dbraw/zinc/03/07/38/942030738.db2.gz ZWFIGWBSSVENFO-UHFFFAOYSA-N 0 0 352.362 3.624 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N[C@@H](CC(F)(F)F)c2ccccc2)c1[N+](=O)[O-] ZINC000433995247 942032595 /nfs/dbraw/zinc/03/25/95/942032595.db2.gz TUQUNOIXLVHHOU-NSHDSACASA-N 0 0 370.331 3.865 20 5 FHBDRN O=C(c1c[nH]c2cccc([N+](=O)[O-])c12)N1CCc2cc(Cl)ccc2C1 ZINC000480820555 942034752 /nfs/dbraw/zinc/03/47/52/942034752.db2.gz FDCDHTXLZRPMEU-UHFFFAOYSA-N 0 0 355.781 3.928 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)NC[C@H]2CCC[C@@H](C(F)(F)F)C2)c1[N+](=O)[O-] ZINC000434012388 942039027 /nfs/dbraw/zinc/03/90/27/942039027.db2.gz OMXMHEXHROYXMH-VHSXEESVSA-N 0 0 362.352 3.540 20 5 FHBDRN CC(C)c1noc(-c2ccc(NC(=O)Cc3ccc([N+](=O)[O-])cc3)cc2)n1 ZINC000102151870 942039617 /nfs/dbraw/zinc/03/96/17/942039617.db2.gz LPWHGJSAQTWEFG-UHFFFAOYSA-N 0 0 366.377 3.949 20 5 FHBDRN C[C@H]1CCc2nc(NC(=O)N(C)CCc3ccccc3[N+](=O)[O-])sc2C1 ZINC000513606635 942045101 /nfs/dbraw/zinc/04/51/01/942045101.db2.gz SAXZPIBELPFEKL-LBPRGKRZSA-N 0 0 374.466 3.883 20 5 FHBDRN Cc1cnn(C2CCN(C(=O)Nc3cccc([N+](=O)[O-])c3Cl)CC2)c1 ZINC000377879692 942048953 /nfs/dbraw/zinc/04/89/53/942048953.db2.gz PJBKYVAJNRSJQR-UHFFFAOYSA-N 0 0 363.805 3.622 20 5 FHBDRN O=C([C@H]1CCOc2ccccc21)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000163806053 942053997 /nfs/dbraw/zinc/05/39/97/942053997.db2.gz IXDKFWCBJPCWFD-SFHVURJKSA-N 0 0 352.390 3.652 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NCc1ccnc(OCC2CC2)c1 ZINC001125863807 942058121 /nfs/dbraw/zinc/05/81/21/942058121.db2.gz ZZJVSEHFCXDWJH-UHFFFAOYSA-N 0 0 369.421 3.634 20 5 FHBDRN COc1ccc(-c2noc(-c3ccc(OC(F)F)c([N+](=O)[O-])c3)n2)cc1 ZINC000513646520 942062286 /nfs/dbraw/zinc/06/22/86/942062286.db2.gz ZBSKHKXEQDTDQJ-UHFFFAOYSA-N 0 0 363.276 3.922 20 5 FHBDRN C[C@H](c1ccc(Cl)cc1)N(C)C(=O)COc1ccc(F)cc1[N+](=O)[O-] ZINC000102599550 942072920 /nfs/dbraw/zinc/07/29/20/942072920.db2.gz SBGDMNCARLDXPB-LLVKDONJSA-N 0 0 366.776 3.986 20 5 FHBDRN C[C@@H](CN[C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000513684654 942075261 /nfs/dbraw/zinc/07/52/61/942075261.db2.gz UAARNEOPDKESJI-IFXJQAMLSA-N 0 0 368.412 3.950 20 5 FHBDRN O=C(N[C@@H]1CCc2cc(F)ccc21)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513686202 942080104 /nfs/dbraw/zinc/08/01/04/942080104.db2.gz XBUJPDLXVBQPAA-CYBMUJFWSA-N 0 0 366.295 3.753 20 5 FHBDRN CC(C)(C)OC(=O)[C@@]1(C)CCN(c2ccc3ncccc3c2[N+](=O)[O-])C1 ZINC000413352352 942083397 /nfs/dbraw/zinc/08/33/97/942083397.db2.gz CNFHNSKBNBVVPW-IBGZPJMESA-N 0 0 357.410 3.701 20 5 FHBDRN CC(C)(CC(F)F)c1nc(-c2ccc([N+](=O)[O-])c3c2CCCN3)no1 ZINC000420502450 942085683 /nfs/dbraw/zinc/08/56/83/942085683.db2.gz QWYFEVXIMMLRQJ-UHFFFAOYSA-N 0 0 352.341 3.936 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)NCC(C)(C)c2cccnc2)cc1[N+](=O)[O-] ZINC000413358381 942091164 /nfs/dbraw/zinc/09/11/64/942091164.db2.gz KXAFXPRXJOLCHD-CQSZACIVSA-N 0 0 356.426 3.636 20 5 FHBDRN CC1(C)CN(C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)[C@H]1[C@H]1CCCO1 ZINC000290412955 942093440 /nfs/dbraw/zinc/09/34/40/942093440.db2.gz MYHPEIPKNAXDOV-KGLIPLIRSA-N 0 0 353.806 3.670 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])Nc1scnc1-c1ccccc1 ZINC000102758921 942095492 /nfs/dbraw/zinc/09/54/92/942095492.db2.gz MOQRSVIWGZOHGY-UHFFFAOYSA-N 0 0 354.391 3.769 20 5 FHBDRN Cc1cnc([C@H]2CCCN(C(=O)Cc3cccc([N+](=O)[O-])c3C)C2)s1 ZINC000366628960 942099094 /nfs/dbraw/zinc/09/90/94/942099094.db2.gz PPIJJMFZJQFGGL-HNNXBMFYSA-N 0 0 359.451 3.617 20 5 FHBDRN CCOc1ccc(OC)cc1NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000413367548 942100885 /nfs/dbraw/zinc/10/08/85/942100885.db2.gz DUHMNRVGMHBPQT-JKSUJKDBSA-N 0 0 356.378 3.744 20 5 FHBDRN C[C@H](c1ccncc1)N(C)C(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-] ZINC000280091475 942100915 /nfs/dbraw/zinc/10/09/15/942100915.db2.gz JGYCPPMEMGUAMX-SNVBAGLBSA-N 0 0 351.765 3.544 20 5 FHBDRN Cc1ccc(NC(=O)c2ccc(NC[C@H]3CCC[C@@H]3O)c([N+](=O)[O-])c2)cc1 ZINC000413380431 942114290 /nfs/dbraw/zinc/11/42/90/942114290.db2.gz ULGLPMCCQFQMDL-BEFAXECRSA-N 0 0 369.421 3.728 20 5 FHBDRN CCC(CC)[C@@H]1C[C@H](NC(=O)c2ccc([N+](=O)[O-])c3cccnc23)CCO1 ZINC000183357464 942117936 /nfs/dbraw/zinc/11/79/36/942117936.db2.gz 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CN(C[C@@H](O)Cc1ccccc1)C(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000480882877 942134091 /nfs/dbraw/zinc/13/40/91/942134091.db2.gz ITJXIUQEUWNZQH-KRWDZBQOSA-N 0 0 370.449 3.568 20 5 FHBDRN Cc1nc2c(cccc2C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)o1 ZINC000280204847 942136136 /nfs/dbraw/zinc/13/61/36/942136136.db2.gz UTPCFOMVLLLWKW-UHFFFAOYSA-N 0 0 351.362 3.849 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])o1)N(Cc1ccc2c(c1)OCO2)C1CCCCC1 ZINC000102908632 942142985 /nfs/dbraw/zinc/14/29/85/942142985.db2.gz FAXUYGCZGMJJHR-UHFFFAOYSA-N 0 0 372.377 3.892 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)cnc1N1C[C@@H](c2ccc(Cl)cc2)[C@H](CO)C1 ZINC000377996026 942144024 /nfs/dbraw/zinc/14/40/24/942144024.db2.gz XALPQLCPYDBGRW-FZMZJTMJSA-N 0 0 368.220 3.509 20 5 FHBDRN Cc1ccc(NC(=O)c2ccc(N3CC[C@]34CCOC4)c([N+](=O)[O-])c2)cc1 ZINC000420640479 942148342 /nfs/dbraw/zinc/14/83/42/942148342.db2.gz MUIPVEHGKXFJQO-HXUWFJFHSA-N 0 0 367.405 3.525 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)c1cnn(-c2ccccc2)c1 ZINC000501981901 942149716 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CCn1cc([C@@H]2OCC[C@H]2CNc2nccc3ccc([N+](=O)[O-])cc32)cn1 ZINC000413505424 942280383 /nfs/dbraw/zinc/28/03/83/942280383.db2.gz CAPCQUIJXZUZLR-KBXCAEBGSA-N 0 0 367.409 3.549 20 5 FHBDRN CCCN(C[C@H]1COc2ccccc2O1)C(=O)c1cc(C)cc([N+](=O)[O-])c1 ZINC000502206297 942282176 /nfs/dbraw/zinc/28/21/76/942282176.db2.gz FNIIADPZGXLKSY-KRWDZBQOSA-N 0 0 370.405 3.595 20 5 FHBDRN O=C(NC[C@@H]1CC12CC2)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000416041407 942287113 /nfs/dbraw/zinc/28/71/13/942287113.db2.gz DIBOWNDGAJQOGR-HNNXBMFYSA-N 0 0 352.390 3.704 20 5 FHBDRN C[C@@H](c1cccc(O)c1)N(C)C(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000137040495 942287219 /nfs/dbraw/zinc/28/72/19/942287219.db2.gz QMRCNVCHGFHWLV-AWEZNQCLSA-N 0 0 357.410 3.712 20 5 FHBDRN O=C(Nc1cc(CC2CC2)nn1-c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000502203745 942289138 /nfs/dbraw/zinc/28/91/38/942289138.db2.gz PVOBAFACXFMQKK-UHFFFAOYSA-N 0 0 362.389 3.985 20 5 FHBDRN CN(C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)[C@H]1CC[C@@H](C(F)(F)F)CC1 ZINC000290584960 942291591 /nfs/dbraw/zinc/29/15/91/942291591.db2.gz IAAYZUFUGVRTPX-AOOOYVTPSA-N 0 0 370.331 3.664 20 5 FHBDRN C[C@H]1CCCN(c2ccc(C(=O)N3CC[C@@H](C4CC4)C3)cc2[N+](=O)[O-])C1 ZINC000481043060 942292072 /nfs/dbraw/zinc/29/20/72/942292072.db2.gz QXXBOWROKDBWNE-WMLDXEAASA-N 0 0 357.454 3.703 20 5 FHBDRN CC(C)(C)S(=O)(=O)Cc1ccc(Nc2ncc([N+](=O)[O-])cc2F)cc1 ZINC000413108458 942292884 /nfs/dbraw/zinc/29/28/84/942292884.db2.gz ROANSCOVHNQKPL-UHFFFAOYSA-N 0 0 367.402 3.586 20 5 FHBDRN O=[N+]([O-])c1ccc2ccnc(NCc3ccc(OCC4CC4)nc3)c2c1 ZINC000413109388 942293339 /nfs/dbraw/zinc/29/33/39/942293339.db2.gz SOKFYAQNOLZDMS-UHFFFAOYSA-N 0 0 350.378 3.939 20 5 FHBDRN CCC[C@H](C)NC(=O)[C@H]1CCCN(c2nccc3ccc([N+](=O)[O-])cc32)C1 ZINC000413108942 942293401 /nfs/dbraw/zinc/29/34/01/942293401.db2.gz SCNNXYQDVFQFAL-HOCLYGCPSA-N 0 0 370.453 3.664 20 5 FHBDRN Cc1cccc(N2CCN(C(=O)Nc3c(C)ccc([N+](=O)[O-])c3C)CC2)c1 ZINC000085636225 942295516 /nfs/dbraw/zinc/29/55/16/942295516.db2.gz DNBZJCSHHBYBFQ-UHFFFAOYSA-N 0 0 368.437 3.874 20 5 FHBDRN COCc1ccccc1CNC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000103603002 942297345 /nfs/dbraw/zinc/29/73/45/942297345.db2.gz LTAWXMVOBFDELQ-UHFFFAOYSA-N 0 0 371.437 3.861 20 5 FHBDRN COc1cccc(N(CC(C)C)C[C@@H](O)COc2ccccc2[N+](=O)[O-])c1 ZINC001167727857 942298420 /nfs/dbraw/zinc/29/84/20/942298420.db2.gz HCVVKRLVTHRSMW-QGZVFWFLSA-N 0 0 374.437 3.506 20 5 FHBDRN COc1cc(CSCC[C@@H]2CCOC2)c([N+](=O)[O-])cc1OC(F)F ZINC000419519505 942298493 /nfs/dbraw/zinc/29/84/93/942298493.db2.gz CZHLDHQTXOYHLV-JTQLQIEISA-N 0 0 363.382 3.865 20 5 FHBDRN CO[C@@](C)([C@@H](C)Nc1ncc([N+](=O)[O-])c(C)c1Br)C1CC1 ZINC000413524904 942300701 /nfs/dbraw/zinc/30/07/01/942300701.db2.gz XGLJNGACFLFUTL-OTYXRUKQSA-N 0 0 358.236 3.676 20 5 FHBDRN CCC(=O)c1ccc(N[C@@H](C)c2noc(COC(C)C)n2)c([N+](=O)[O-])c1 ZINC000290608232 942302166 /nfs/dbraw/zinc/30/21/66/942302166.db2.gz COUWGJQKSFBEEL-NSHDSACASA-N 0 0 362.386 3.669 20 5 FHBDRN CO[C@H](CNC(=O)c1cc([N+](=O)[O-])ccc1SC(C)C)CC(C)C ZINC000416051828 942302241 /nfs/dbraw/zinc/30/22/41/942302241.db2.gz BVLGVGIRCTXZSM-AWEZNQCLSA-N 0 0 354.472 3.886 20 5 FHBDRN CC[C@H](Cc1ccccc1)NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000128428562 942302731 /nfs/dbraw/zinc/30/27/31/942302731.db2.gz MHOABWYEJNARAH-MRXNPFEDSA-N 0 0 351.406 3.756 20 5 FHBDRN C[C@@H]1CCN(C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)CCS1 ZINC000501110489 942302846 /nfs/dbraw/zinc/30/28/46/942302846.db2.gz KXRGFFVBJLCYLE-SECBINFHSA-N 0 0 374.260 3.717 20 5 FHBDRN COc1cc(C(=O)N[C@@H](C)c2ccc(C3CC3)cc2)cc([N+](=O)[O-])c1OC ZINC000416053299 942303395 /nfs/dbraw/zinc/30/33/95/942303395.db2.gz CVTWSSCXQDWSQE-LBPRGKRZSA-N 0 0 370.405 3.980 20 5 FHBDRN CC(=O)c1ccc(N[C@H]2CCN(C(C)=O)c3ccccc32)c([N+](=O)[O-])c1 ZINC000366755916 942306105 /nfs/dbraw/zinc/30/61/05/942306105.db2.gz CECSTGQEKUPSGG-INIZCTEOSA-N 0 0 353.378 3.707 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)c1ccc(OCC(F)(F)C(F)F)nc1 ZINC000103736601 942306649 /nfs/dbraw/zinc/30/66/49/942306649.db2.gz XDOLJAAQOUDPCP-UHFFFAOYSA-N 0 0 373.262 3.521 20 5 FHBDRN CC[C@@H](CNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-])CC(F)(F)F ZINC000413522076 942308945 /nfs/dbraw/zinc/30/89/45/942308945.db2.gz PKQHAJBWKWANQC-SNVBAGLBSA-N 0 0 359.348 3.878 20 5 FHBDRN CCn1cc([C@@H]2OCC[C@H]2CNc2ccc([N+](=O)[O-])c3ncccc23)cn1 ZINC000413522675 942309327 /nfs/dbraw/zinc/30/93/27/942309327.db2.gz XXLDNIRNCBUTMQ-ORAYPTAESA-N 0 0 367.409 3.549 20 5 FHBDRN COC(=O)c1cnc(N[C@H]2C[C@H](c3ccc(Cl)cc3)C2)c([N+](=O)[O-])c1 ZINC000481057958 942309770 /nfs/dbraw/zinc/30/97/70/942309770.db2.gz MBXXBYZAKPJSKJ-YEORSEQZSA-N 0 0 361.785 3.788 20 5 FHBDRN O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])NC[C@@H]1CC12CC2 ZINC000416069555 942315980 /nfs/dbraw/zinc/31/59/80/942315980.db2.gz KSQVIJOBYPDQTB-JTQLQIEISA-N 0 0 360.357 3.622 20 5 FHBDRN COCC1CCC(Nc2ncc([N+](=O)[O-])c(C)c2Br)CC1 ZINC000413528851 942317143 /nfs/dbraw/zinc/31/71/43/942317143.db2.gz FQXQSQXSPWZYGE-UHFFFAOYSA-N 0 0 358.236 3.678 20 5 FHBDRN CSc1cccc(C(=O)NCCO[C@@H]2CCCC[C@@H]2C)c1[N+](=O)[O-] ZINC000188060353 942317860 /nfs/dbraw/zinc/31/78/60/942317860.db2.gz JFAIREACWBQTAU-GXTWGEPZSA-N 0 0 352.456 3.642 20 5 FHBDRN C[C@@H](Nc1ccc(C(=O)NC[C@@H]2CC23CC3)cc1[N+](=O)[O-])c1ccccn1 ZINC000416071890 942318670 /nfs/dbraw/zinc/31/86/70/942318670.db2.gz MKQSMGLYCHYMLF-HIFRSBDPSA-N 0 0 366.421 3.693 20 5 FHBDRN O=C(Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1)N1CC[C@]12CCOC2 ZINC000421054289 942321514 /nfs/dbraw/zinc/32/15/14/942321514.db2.gz HXWUJQLVWDBZSD-LJQANCHMSA-N 0 0 369.377 3.784 20 5 FHBDRN C[C@H](Sc1ccc(Br)cc1[N+](=O)[O-])c1nnnn1C1CC1 ZINC000188059708 942323468 /nfs/dbraw/zinc/32/34/68/942323468.db2.gz YPNNBTPNXFJEOU-ZETCQYMHSA-N 0 0 370.232 3.532 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N[C@H](CC)[C@H]2CC2(C)C)cc1OC ZINC000416084200 942324427 /nfs/dbraw/zinc/32/44/27/942324427.db2.gz OSGGXFHBBMIYAP-CHWSQXEVSA-N 0 0 350.415 3.557 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(N2C[C@H](c3ccccc3)C3(CCC3)C2)n1 ZINC000413534921 942324912 /nfs/dbraw/zinc/32/49/12/942324912.db2.gz PTRFHUFBAPLMKP-OAHLLOKOSA-N 0 0 367.405 3.551 20 5 FHBDRN CC(C)(C)C(=O)NC[C@H]1CCCN(c2nccc3ccc([N+](=O)[O-])cc32)C1 ZINC000413131085 942326244 /nfs/dbraw/zinc/32/62/44/942326244.db2.gz DSPZZKRCQKLSTF-CQSZACIVSA-N 0 0 370.453 3.522 20 5 FHBDRN CCOc1cc(Cl)ccc1CNC(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000501141887 942326415 /nfs/dbraw/zinc/32/64/15/942326415.db2.gz MEPBTZLIHHGHOS-UHFFFAOYSA-N 0 0 362.813 3.896 20 5 FHBDRN CC[C@H](NC(=O)c1cc(OC)c(OC(F)F)cc1[N+](=O)[O-])[C@H]1CC1(C)C ZINC000416087774 942334675 /nfs/dbraw/zinc/33/46/75/942334675.db2.gz ZDQKRDXMLCVPJU-MNOVXSKESA-N 0 0 372.368 3.759 20 5 FHBDRN CCOc1cc(Cl)ccc1CNC(=O)Cc1cccc([N+](=O)[O-])c1C ZINC000501152265 942335966 /nfs/dbraw/zinc/33/59/66/942335966.db2.gz WVYZTUHBQSZIEF-UHFFFAOYSA-N 0 0 362.813 3.814 20 5 FHBDRN O=C(Nc1ccc(-c2cc[nH]n2)cc1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513709102 942341729 /nfs/dbraw/zinc/34/17/29/942341729.db2.gz BTZXOUNZUHQVBL-UHFFFAOYSA-N 0 0 374.303 3.839 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)Nc1c(F)cccc1NC1CC1 ZINC000137184352 942346247 /nfs/dbraw/zinc/34/62/47/942346247.db2.gz WQDUIMWDYZPDEK-UHFFFAOYSA-N 0 0 368.368 3.971 20 5 FHBDRN O=C(Nc1ccnn1-c1ccc([N+](=O)[O-])cc1)c1ccc(Cl)cc1F ZINC000103930736 942347075 /nfs/dbraw/zinc/34/70/75/942347075.db2.gz NBBLVRGVRSCXGS-UHFFFAOYSA-N 0 0 360.732 3.825 20 5 FHBDRN COC(=O)[C@H](CNc1ccc([N+](=O)[O-])c2cnccc12)c1ccc(C)cc1 ZINC000501202981 942347900 /nfs/dbraw/zinc/34/79/00/942347900.db2.gz WKSVOHOFTHMHIR-MRXNPFEDSA-N 0 0 365.389 3.820 20 5 FHBDRN CC(C)n1cnnc1[C@H]1CCCN(c2ccc([N+](=O)[O-])c3ncccc23)C1 ZINC000413146622 942348953 /nfs/dbraw/zinc/34/89/53/942348953.db2.gz NIHSXRNIADWCQD-AWEZNQCLSA-N 0 0 366.425 3.699 20 5 FHBDRN COCCOc1c(Cl)cccc1NC(=O)c1ccc([N+](=O)[O-])cc1C ZINC000502320981 942352210 /nfs/dbraw/zinc/35/22/10/942352210.db2.gz VUWPPYKLZFTLQS-UHFFFAOYSA-N 0 0 364.785 3.834 20 5 FHBDRN O=C(Nc1cc(F)ccc1OC[C@@H]1CCCO1)c1ccc([N+](=O)[O-])s1 ZINC000502307401 942357870 /nfs/dbraw/zinc/35/78/70/942357870.db2.gz DGICCTFSUQJPLE-NSHDSACASA-N 0 0 366.370 3.606 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@@](F)(c3ccccc3C)C2)c1 ZINC000501244504 942358566 /nfs/dbraw/zinc/35/85/66/942358566.db2.gz NUMOGQXORJLCNN-IBGZPJMESA-N 0 0 358.369 3.623 20 5 FHBDRN C[C@H](Sc1ncc(Br)cc1[N+](=O)[O-])C(=O)OC(C)(C)C ZINC000481123096 942359267 /nfs/dbraw/zinc/35/92/67/942359267.db2.gz PPTVPPUAZCKBIE-ZETCQYMHSA-N 0 0 363.233 3.575 20 5 FHBDRN CCN(C(=O)Cc1ccccc1[N+](=O)[O-])[C@H](C)Cc1ccc(OC)cc1 ZINC000066806330 942361924 /nfs/dbraw/zinc/36/19/24/942361924.db2.gz KSSLZCIPSPWOJV-OAHLLOKOSA-N 0 0 356.422 3.626 20 5 FHBDRN CC(C)Oc1cc(C(=O)N[C@@H]2CCCC[C@H]2OC(F)F)ccc1[N+](=O)[O-] ZINC000412324486 942363350 /nfs/dbraw/zinc/36/33/50/942363350.db2.gz ZZHXFTSGYZYLNO-TZMCWYRMSA-N 0 0 372.368 3.662 20 5 FHBDRN COc1ccc(C[NH+]2CCC(N3CCc4ccccc43)CC2)cc1[N+](=O)[O-] ZINC000502332891 942364720 /nfs/dbraw/zinc/36/47/20/942364720.db2.gz NKVZDLODIVFMFT-UHFFFAOYSA-N 0 0 367.449 3.631 20 5 FHBDRN O=C1CCCN1[C@H]1CCCN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC1 ZINC000413572839 942366931 /nfs/dbraw/zinc/36/69/31/942366931.db2.gz RQLBWKXUQKQFDT-LBPRGKRZSA-N 0 0 371.359 3.595 20 5 FHBDRN CCc1nn(C)c(NC2CC(F)(c3cccc(Cl)c3)C2)c1[N+](=O)[O-] ZINC000481129998 942367892 /nfs/dbraw/zinc/36/78/92/942367892.db2.gz YIDMLNSDEUXWEP-UHFFFAOYSA-N 0 0 352.797 3.983 20 5 FHBDRN CCOc1ccc(-c2nc(Cn3cc([N+](=O)[O-])c(C)n3)cs2)cc1OC ZINC000501264992 942370008 /nfs/dbraw/zinc/37/00/08/942370008.db2.gz SCMVHEBPFMSYCK-UHFFFAOYSA-N 0 0 374.422 3.679 20 5 FHBDRN Cc1ccc([C@H]2CCC[C@H]2N(C)c2ccc3ncc([N+](=O)[O-])n3n2)cc1 ZINC000502341737 942370721 /nfs/dbraw/zinc/37/07/21/942370721.db2.gz QXDSEWRRNNZMSP-HZPDHXFCSA-N 0 0 351.410 3.718 20 5 FHBDRN CCOc1ccc(C(=O)NCCCOc2cccc(C)c2)cc1[N+](=O)[O-] ZINC000016278257 942372852 /nfs/dbraw/zinc/37/28/52/942372852.db2.gz AKFSHTAOMWMSBB-UHFFFAOYSA-N 0 0 358.394 3.501 20 5 FHBDRN CC(C)(C(=O)NC[C@H]1CC[C@@H](c2ccccc2)O1)c1ccc([N+](=O)[O-])cc1 ZINC000460848324 942373659 /nfs/dbraw/zinc/37/36/59/942373659.db2.gz RGDCCMNQGSYXSH-MOPGFXCFSA-N 0 0 368.433 3.909 20 5 FHBDRN Cc1ccc(-c2cccc(CNc3ccc4ncc([N+](=O)[O-])n4n3)c2)cc1 ZINC000502353297 942375297 /nfs/dbraw/zinc/37/52/97/942375297.db2.gz OKOBPEDGCVVEKL-UHFFFAOYSA-N 0 0 359.389 3.647 20 5 FHBDRN Cc1c(NC(=O)C(=O)N[C@H](C)c2ccc(C3CC3)cc2)cccc1[N+](=O)[O-] ZINC000419793681 942381538 /nfs/dbraw/zinc/38/15/38/942381538.db2.gz JMWGEAAHIGMXHD-CYBMUJFWSA-N 0 0 367.405 3.597 20 5 FHBDRN O=[N+]([O-])c1cnccc1Sc1nnc(NCCc2cccs2)s1 ZINC000066797256 942395241 /nfs/dbraw/zinc/39/52/41/942395241.db2.gz DRPMXMLWIIKMNZ-UHFFFAOYSA-N 0 0 365.465 3.709 20 5 FHBDRN CC(C)(CNc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1)c1cccnc1 ZINC000413589610 942395291 /nfs/dbraw/zinc/39/52/91/942395291.db2.gz PQWYKEGDPVMZBS-UHFFFAOYSA-N 0 0 368.437 3.616 20 5 FHBDRN Cc1nc(-c2cccc(NC(=O)[C@@H](C)c3ccc([N+](=O)[O-])cc3F)c2)no1 ZINC000183247852 942398271 /nfs/dbraw/zinc/39/82/71/942398271.db2.gz HUDAJYTWBSTDFO-JTQLQIEISA-N 0 0 370.340 3.835 20 5 FHBDRN COc1ccc2c(c1)[C@H](OC(=O)[C@@H]1C[C@H]1c1cccc([N+](=O)[O-])c1)CCO2 ZINC001268850271 942400618 /nfs/dbraw/zinc/40/06/18/942400618.db2.gz VPHWHNNXHVMKBN-FRQCXROJSA-N 0 0 369.373 3.774 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CNc1ccc2c(c1)C(=O)CCCC2 ZINC000421190779 942400752 /nfs/dbraw/zinc/40/07/52/942400752.db2.gz BKDXSHYDOWFLOS-UHFFFAOYSA-N 0 0 367.405 3.863 20 5 FHBDRN O=C(NC[C@H]1CC[C@@H](c2ccccc2)O1)c1c[nH]c2cccc([N+](=O)[O-])c21 ZINC000460849538 942400817 /nfs/dbraw/zinc/40/08/17/942400817.db2.gz VMRKLNWLCHOVGM-KDOFPFPSSA-N 0 0 365.389 3.726 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N(CC(C)C)[C@@H](C)c1ccccc1C ZINC000501306955 942403920 /nfs/dbraw/zinc/40/39/20/942403920.db2.gz WKZYVKKKOQKDGF-HNNXBMFYSA-N 0 0 358.442 3.654 20 5 FHBDRN O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])NCC1(C2CC2)CC1 ZINC000501331722 942416109 /nfs/dbraw/zinc/41/61/09/942416109.db2.gz XAVDYFQLKIEEDR-UHFFFAOYSA-N 0 0 371.359 3.722 20 5 FHBDRN C[C@H](NC(=O)Nc1cn(C)nc1-c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000501347254 942422808 /nfs/dbraw/zinc/42/28/08/942422808.db2.gz AMUGJOWOAUEHLX-ZDUSSCGKSA-N 0 0 365.393 3.878 20 5 FHBDRN COc1ccc(CSCc2c([N+](=O)[O-])ncn2C)c(Br)c1 ZINC000421216947 942432392 /nfs/dbraw/zinc/43/23/92/942432392.db2.gz IHRNZRJHRXFHDU-UHFFFAOYSA-N 0 0 372.244 3.533 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CCCc2cc(F)c(F)cc21 ZINC000413182282 942436517 /nfs/dbraw/zinc/43/65/17/942436517.db2.gz RYKZYGXKZDJMIU-LSDHHAIUSA-N 0 0 358.344 3.956 20 5 FHBDRN Cc1c(NC(=O)CCCNc2ccc([N+](=O)[O-])cc2)cnn1CC(C)C ZINC000501366490 942436745 /nfs/dbraw/zinc/43/67/45/942436745.db2.gz RFNKFTMSJUNFJO-UHFFFAOYSA-N 0 0 359.430 3.587 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CCO[C@H](c3cccs3)C2)c(C(F)(F)F)c1 ZINC000413186230 942438430 /nfs/dbraw/zinc/43/84/30/942438430.db2.gz BGAQIYQZGNDUIJ-NSHDSACASA-N 0 0 359.329 3.648 20 5 FHBDRN Cc1ccccc1CN(C)C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513744732 942439139 /nfs/dbraw/zinc/43/91/39/942439139.db2.gz ORWNYQNFHLSQPK-UHFFFAOYSA-N 0 0 350.321 3.777 20 5 FHBDRN Cc1cc(CNC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)ccc1F ZINC000513744822 942444542 /nfs/dbraw/zinc/44/45/42/942444542.db2.gz PYKCYSRQWMEREK-UHFFFAOYSA-N 0 0 354.284 3.574 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CC(=O)c2ccccc21 ZINC000416190171 942454126 /nfs/dbraw/zinc/45/41/26/942454126.db2.gz BIHJJIZQASTJCO-KBXCAEBGSA-N 0 0 352.390 3.607 20 5 FHBDRN CC(C)(CCCc1ccccc1)CNC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 ZINC000505323742 942463601 /nfs/dbraw/zinc/46/36/01/942463601.db2.gz YDAFIEWSYNXUEI-UHFFFAOYSA-N 0 0 372.469 3.692 20 5 FHBDRN Cc1ccc(Cl)cc1NC(=O)[C@@H](C)OC(=O)c1ccc([N+](=O)[O-])s1 ZINC000015855802 942467001 /nfs/dbraw/zinc/46/70/01/942467001.db2.gz VSDFOFCZZFNNIU-SECBINFHSA-N 0 0 368.798 3.802 20 5 FHBDRN CC(C)[C@H](NS(=O)(=O)c1ccccc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000014099917 942469651 /nfs/dbraw/zinc/46/96/51/942469651.db2.gz ANWOUBKGMYVQCY-INIZCTEOSA-N 0 0 368.842 3.924 20 5 FHBDRN O=C(N[C@@H]1C[C@H]1C1CCC1)c1cc(F)cc2c(=O)c3cccc(F)c3[nH]c12 ZINC000424965640 942473968 /nfs/dbraw/zinc/47/39/68/942473968.db2.gz GMUMKONMYMYGHU-SUMWQHHRSA-N 0 0 368.383 3.878 20 5 FHBDRN Nc1c(C(=O)Nc2nccn2-c2ccccc2)cc2ccccc2c1[N+](=O)[O-] ZINC001269113641 942474450 /nfs/dbraw/zinc/47/44/50/942474450.db2.gz GDLDPBMEZVIHFL-UHFFFAOYSA-N 0 0 373.372 3.768 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1C[C@]1(F)c1ccccc1 ZINC000424979095 942485490 /nfs/dbraw/zinc/48/54/90/942485490.db2.gz XPAURIHTYCSTFE-IWEFOYFVSA-N 0 0 360.410 3.829 20 5 FHBDRN O=C(c1cc2cccc([N+](=O)[O-])c2[nH]1)N(Cc1ccco1)CC(F)(F)F ZINC000502497594 942493103 /nfs/dbraw/zinc/49/31/03/942493103.db2.gz YMAHIXICTDJPTB-UHFFFAOYSA-N 0 0 367.283 3.874 20 5 FHBDRN CCc1nc(C(C)C)ccc1C(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000505376159 942493713 /nfs/dbraw/zinc/49/37/13/942493713.db2.gz ZRWZSOJJJJJVFU-UHFFFAOYSA-N 0 0 369.421 3.579 20 5 FHBDRN COc1ccc(NC(=O)[C@H]2CC(C)(C)Oc3ccccc32)cc1[N+](=O)[O-] ZINC000413683157 942498794 /nfs/dbraw/zinc/49/87/94/942498794.db2.gz GUGLWRNRILZDLJ-AWEZNQCLSA-N 0 0 356.378 3.887 20 5 FHBDRN CO[C@@](C)([C@@H](C)NC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C)C1CC1 ZINC000413686632 942498825 /nfs/dbraw/zinc/49/88/25/942498825.db2.gz JTEABZFSZQUDSE-KUHUBIRLSA-N 0 0 363.458 3.718 20 5 FHBDRN CO[C@@](C)([C@H](C)NC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C)C1CC1 ZINC000413686635 942498949 /nfs/dbraw/zinc/49/89/49/942498949.db2.gz JTEABZFSZQUDSE-LIRRHRJNSA-N 0 0 363.458 3.718 20 5 FHBDRN O=C(COc1ccccc1[N+](=O)[O-])N[C@@H](c1ccc(F)cc1)C1CCC1 ZINC000104424891 942509731 /nfs/dbraw/zinc/50/97/31/942509731.db2.gz KTJOLBYBCXBDEI-LJQANCHMSA-N 0 0 358.369 3.770 20 5 FHBDRN CS(=O)(=O)c1ccc(N2CCCC[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000541234451 942511323 /nfs/dbraw/zinc/51/13/23/942511323.db2.gz UYKORKVUJWRHAI-MRXNPFEDSA-N 0 0 360.435 3.730 20 5 FHBDRN CC(C)(C)OCc1cc(CNc2ncc([N+](=O)[O-])cc2C(F)(F)F)no1 ZINC000413226316 942511596 /nfs/dbraw/zinc/51/15/96/942511596.db2.gz HVPRWWHIILTGJS-UHFFFAOYSA-N 0 0 374.319 3.924 20 5 FHBDRN C[C@@H](CC(=O)c1ccc(F)cc1)NC(=O)c1c[nH]c2cccc([N+](=O)[O-])c21 ZINC000501506237 942515386 /nfs/dbraw/zinc/51/53/86/942515386.db2.gz AZDOQINHINKKRX-NSHDSACASA-N 0 0 369.352 3.607 20 5 FHBDRN COc1ccc([C@@H](NC(=O)c2cc(C)cc([N+](=O)[O-])c2)C(F)(F)F)cc1 ZINC000505386427 942517744 /nfs/dbraw/zinc/51/77/44/942517744.db2.gz ICSIXGNHSRAFBY-OAHLLOKOSA-N 0 0 368.311 3.945 20 5 FHBDRN CCn1nccc1[C@@H]1OCC[C@H]1CNc1ccc([N+](=O)[O-])c2ncccc12 ZINC000413239147 942530637 /nfs/dbraw/zinc/53/06/37/942530637.db2.gz LZBMQMODLCRSKW-ORAYPTAESA-N 0 0 367.409 3.549 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N(Cc2ccccc2)CC2CCC2)c1[N+](=O)[O-] ZINC000434226983 942533314 /nfs/dbraw/zinc/53/33/14/942533314.db2.gz VMNRDFTUIURNJQ-UHFFFAOYSA-N 0 0 356.426 3.884 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N[C@H]2CCCC[C@@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000434228866 942535454 /nfs/dbraw/zinc/53/54/54/942535454.db2.gz PRDFDAVRSYNQCZ-CABCVRRESA-N 0 0 356.426 3.898 20 5 FHBDRN CC(C)c1[nH]nc(C(=O)Nc2ccc(Br)c(F)c2)c1[N+](=O)[O-] ZINC000434244855 942545848 /nfs/dbraw/zinc/54/58/48/942545848.db2.gz JUMZHJIKFZXFRN-UHFFFAOYSA-N 0 0 371.166 3.595 20 5 FHBDRN CCOc1cccc([C@@H]2C[C@@H]2NC(=O)CSc2ccccc2[N+](=O)[O-])c1 ZINC000541269869 942547728 /nfs/dbraw/zinc/54/77/28/942547728.db2.gz AKKCVSGDVNYXEU-HOTGVXAUSA-N 0 0 372.446 3.758 20 5 FHBDRN C[C@H](CCc1ccccc1[N+](=O)[O-])NC1(c2noc(C(F)F)n2)CCC1 ZINC000366536440 942550886 /nfs/dbraw/zinc/55/08/86/942550886.db2.gz QVUJVXLRCKDCSY-LLVKDONJSA-N 0 0 366.368 3.906 20 5 FHBDRN C[C@H](Oc1ccccc1Cl)C(=O)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000513839622 942551112 /nfs/dbraw/zinc/55/11/12/942551112.db2.gz NNBPMHVLRBRNOJ-LBPRGKRZSA-N 0 0 360.797 3.995 20 5 FHBDRN O=C(CCCOc1ccccc1F)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000513842449 942552814 /nfs/dbraw/zinc/55/28/14/942552814.db2.gz IGXSOUUDILDLRC-UHFFFAOYSA-N 0 0 358.369 3.872 20 5 FHBDRN COc1ccc(NC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1NC(C)=O ZINC000502590212 942552905 /nfs/dbraw/zinc/55/29/05/942552905.db2.gz YDXRGPNIZDVWTF-UHFFFAOYSA-N 0 0 358.354 3.514 20 5 FHBDRN CCc1c(C(=O)N2CCCc3c([N+](=O)[O-])cccc32)cnn1C(C)(C)C ZINC000513843180 942553898 /nfs/dbraw/zinc/55/38/98/942553898.db2.gz VGYNYVMCNHEZQU-UHFFFAOYSA-N 0 0 356.426 3.702 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NCc1ccnc(N2CCCCC2)c1 ZINC000421426342 942554379 /nfs/dbraw/zinc/55/43/79/942554379.db2.gz DTFDMLZJJHLVLG-UHFFFAOYSA-N 0 0 368.437 3.527 20 5 FHBDRN COc1ccc(CC(C)(C)NC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)cc1 ZINC000413742766 942554424 /nfs/dbraw/zinc/55/44/24/942554424.db2.gz NYYLMDTXFXUWIY-RBUKOAKNSA-N 0 0 368.433 3.844 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N1CCC[C@H]1c1cccnc1 ZINC000366544710 942556509 /nfs/dbraw/zinc/55/65/09/942556509.db2.gz FXBLDVKJEUQJSO-HNNXBMFYSA-N 0 0 365.311 3.986 20 5 FHBDRN O=C(N[C@@H]1CCCC[C@H]1OC(F)F)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000501594537 942567668 /nfs/dbraw/zinc/56/76/68/942567668.db2.gz PCAPZCMZNBCJRG-DGCLKSJQSA-N 0 0 354.309 3.621 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N(C2CC2)C2CCC(C)CC2)c1F ZINC000413262932 942574876 /nfs/dbraw/zinc/57/48/76/942574876.db2.gz MDDZCRXADOFKKN-UHFFFAOYSA-N 0 0 364.417 3.855 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N(CC(F)(F)F)c1ccccn1 ZINC000421444881 942576584 /nfs/dbraw/zinc/57/65/84/942576584.db2.gz NEBJDKMISOQSGT-UHFFFAOYSA-N 0 0 353.300 3.816 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N[C@@H](c1ccccc1)[C@@H]1CCCO1 ZINC000421460248 942582314 /nfs/dbraw/zinc/58/23/14/942582314.db2.gz FWQNQKUAMLZOMC-OALUTQOASA-N 0 0 354.406 3.862 20 5 FHBDRN O=[N+]([O-])c1ccc2ccnc(N3CCC(Oc4ncccc4F)CC3)c2c1 ZINC000413266026 942584793 /nfs/dbraw/zinc/58/47/93/942584793.db2.gz LPQQNAWOYCPSJZ-UHFFFAOYSA-N 0 0 368.368 3.725 20 5 FHBDRN O=C(c1c(Cl)cccc1[N+](=O)[O-])N1CCC[C@@H](Oc2ccccc2)C1 ZINC000416271229 942585804 /nfs/dbraw/zinc/58/58/04/942585804.db2.gz POQUMSUCLKPDNP-CQSZACIVSA-N 0 0 360.797 3.932 20 5 FHBDRN O=C(c1c[nH]c2cc([N+](=O)[O-])ccc21)N1CCC[C@@H](Oc2ccccc2)C1 ZINC000416272969 942588107 /nfs/dbraw/zinc/58/81/07/942588107.db2.gz YPVYGDZHOKLOBV-MRXNPFEDSA-N 0 0 365.389 3.760 20 5 FHBDRN CC(C)(C)Oc1cccc(CNC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)n1 ZINC000502626261 942590943 /nfs/dbraw/zinc/59/09/43/942590943.db2.gz DXVJLUKGNFJMHC-UHFFFAOYSA-N 0 0 371.437 3.761 20 5 FHBDRN CC(C)n1ncc2c1C[C@@H](Nc1nccc3ccc([N+](=O)[O-])cc31)CC2 ZINC000413273435 942595733 /nfs/dbraw/zinc/59/57/33/942595733.db2.gz ZFNYDDBQGUMASA-HNNXBMFYSA-N 0 0 351.410 3.890 20 5 FHBDRN CCOC(=O)CN(C(=O)c1ccc([N+](=O)[O-])c(C)c1)[C@@H](C)c1ccccc1 ZINC000513910791 942602409 /nfs/dbraw/zinc/60/24/09/942602409.db2.gz GINBZYNFDINOHI-HNNXBMFYSA-N 0 0 370.405 3.670 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CCC(F)(c3cccnc3)CC2)c(C(F)(F)F)c1 ZINC000413284146 942603594 /nfs/dbraw/zinc/60/35/94/942603594.db2.gz AUNCDZCEANNOLX-UHFFFAOYSA-N 0 0 370.306 3.869 20 5 FHBDRN Cc1ccc2c(c1)CN(c1ncc([N+](=O)[O-])cc1C(F)(F)F)CCO2 ZINC000413286042 942604939 /nfs/dbraw/zinc/60/49/39/942604939.db2.gz YCBAEUULCJPCKY-UHFFFAOYSA-N 0 0 353.300 3.716 20 5 FHBDRN COC(=O)[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])c(C)cc2C)c2ccccc21 ZINC000421494166 942607275 /nfs/dbraw/zinc/60/72/75/942607275.db2.gz DVYMSGPWQSFKGU-OAHLLOKOSA-N 0 0 368.389 3.519 20 5 FHBDRN CC[C@@H](CSc1ccccc1)NC(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000501690896 942614792 /nfs/dbraw/zinc/61/47/92/942614792.db2.gz FAYLLKIRZYGXSK-AWEZNQCLSA-N 0 0 360.435 3.661 20 5 FHBDRN COC(=O)[C@H](C)Cc1ccc(NC(=O)c2cc([N+](=O)[O-])c(C)cc2C)cc1 ZINC000421516541 942622934 /nfs/dbraw/zinc/62/29/34/942622934.db2.gz MYCXKRDSAKRAPE-CQSZACIVSA-N 0 0 370.405 3.816 20 5 FHBDRN CC[C@H](CSc1ccccc1)NC(=O)c1ccc([N+](=O)[O-])c(OC)c1 ZINC000501719466 942626794 /nfs/dbraw/zinc/62/67/94/942626794.db2.gz QTCNVZMFWOZLFR-CQSZACIVSA-N 0 0 360.435 3.904 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N[C@H]1CCO[C@H](c2ccccc2)C1 ZINC000421523280 942628205 /nfs/dbraw/zinc/62/82/05/942628205.db2.gz SSHZQPXMXHOCBQ-LPHOPBHVSA-N 0 0 354.406 3.862 20 5 FHBDRN CCOC(=O)c1ccc(F)c(C)c1NC(=O)c1cc(C)ccc1[N+](=O)[O-] ZINC000505414763 942631122 /nfs/dbraw/zinc/63/11/22/942631122.db2.gz MHGYOMNBOBFITQ-UHFFFAOYSA-N 0 0 360.341 3.780 20 5 FHBDRN CO[C@@H]1CCOc2c(NC(=O)c3cc([N+](=O)[O-])c(C)cc3C)cccc21 ZINC000421538735 942633412 /nfs/dbraw/zinc/63/34/12/942633412.db2.gz QNNHPVPDNWFKNZ-QGZVFWFLSA-N 0 0 356.378 3.934 20 5 FHBDRN CC[C@@H](CC(=O)NCc1ccc(OC)c([N+](=O)[O-])c1)c1ccc(OC)cc1 ZINC000501722816 942633463 /nfs/dbraw/zinc/63/34/63/942633463.db2.gz WILHGDVCLCKHPO-HNNXBMFYSA-N 0 0 372.421 3.812 20 5 FHBDRN Cc1ccccc1[C@H](NC(=O)c1c([N+](=O)[O-])cnn1C)[C@H]1CCC[C@@H](C)C1 ZINC000501730484 942637904 /nfs/dbraw/zinc/63/79/04/942637904.db2.gz PTPBKAILEIMZPE-QIIPPGSGSA-N 0 0 370.453 3.934 20 5 FHBDRN Nc1ccc([N+](=O)[O-])cc1C(=O)NCc1ccc(-c2ccccc2)s1 ZINC001167735612 942638763 /nfs/dbraw/zinc/63/87/63/942638763.db2.gz IGXZIZAXNXYPBN-UHFFFAOYSA-N 0 0 353.403 3.836 20 5 FHBDRN COc1cc(NC(=O)c2cc([N+](=O)[O-])c(C)cc2C)c(OC)c(C)c1OC ZINC000421534037 942644420 /nfs/dbraw/zinc/64/44/20/942644420.db2.gz LACFYQTWDGZCSD-UHFFFAOYSA-N 0 0 374.393 3.798 20 5 FHBDRN CC(C)c1[nH]nc(C(=O)Nc2ccc3cn(C(C)C)nc3c2)c1[N+](=O)[O-] ZINC000434394103 942645873 /nfs/dbraw/zinc/64/58/73/942645873.db2.gz JVTCNBDRNWWPHT-UHFFFAOYSA-N 0 0 356.386 3.624 20 5 FHBDRN CCc1ccc(C(=O)N(CC(=O)OC(C)(C)C)[C@@H](C)CC)cc1[N+](=O)[O-] ZINC000502677311 942651702 /nfs/dbraw/zinc/65/17/02/942651702.db2.gz VLQOUWQXVUYCNZ-ZDUSSCGKSA-N 0 0 364.442 3.740 20 5 FHBDRN CC(C)COC1CCN(C(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)CC1 ZINC000293742525 942653295 /nfs/dbraw/zinc/65/32/95/942653295.db2.gz HTJZLFBLZYSZPA-UHFFFAOYSA-N 0 0 374.359 3.891 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N2CCC[C@H](c3ccccn3)C2)c1 ZINC000590399180 942661062 /nfs/dbraw/zinc/66/10/62/942661062.db2.gz CINFOZJKHKQBFY-ZDUSSCGKSA-N 0 0 357.435 3.732 20 5 FHBDRN CCOc1cc(NC(=O)N(C)[C@H](C)C(C)C)c([N+](=O)[O-])cc1OCC ZINC000501759301 942662871 /nfs/dbraw/zinc/66/28/71/942662871.db2.gz NMCCXKDLYGCENL-GFCCVEGCSA-N 0 0 353.419 3.900 20 5 FHBDRN CC(C)Oc1cc(C(=O)Nc2ccnn2[C@H](C)C2CC2)ccc1[N+](=O)[O-] ZINC000413329029 942666520 /nfs/dbraw/zinc/66/65/20/942666520.db2.gz CCLKZIYRVJWQND-GFCCVEGCSA-N 0 0 358.398 3.802 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](CO)CC1CCCCC1 ZINC000416328521 942667894 /nfs/dbraw/zinc/66/78/94/942667894.db2.gz SWDYWARFURVEBZ-CQSZACIVSA-N 0 0 366.483 3.768 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCC[C@H]1OC(F)F ZINC000501779048 942669893 /nfs/dbraw/zinc/66/98/93/942669893.db2.gz IILASPKDOUYZRZ-CHWSQXEVSA-N 0 0 374.409 3.987 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)NC[C@@H](c2ccccc2)C2CC2)c1F ZINC000412364504 942670796 /nfs/dbraw/zinc/67/07/96/942670796.db2.gz PZSYKAAVUGIGCW-INIZCTEOSA-N 0 0 372.396 3.595 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H]1CC12CCSCC2 ZINC000421586256 942673480 /nfs/dbraw/zinc/67/34/80/942673480.db2.gz FJCABOGTDMQRAV-OLZOCXBDSA-N 0 0 366.508 3.725 20 5 FHBDRN CC(C)Oc1cc(C(=O)NC[C@@H]2CC23CCSCC3)ccc1[N+](=O)[O-] ZINC000421596164 942678873 /nfs/dbraw/zinc/67/88/73/942678873.db2.gz OXHBLZNNAXHEBW-AWEZNQCLSA-N 0 0 364.467 3.645 20 5 FHBDRN CNC(=O)c1cnc(/C=C\c2ccc(-c3ccccc3[N+](=O)[O-])o2)s1 ZINC000502711094 942687220 /nfs/dbraw/zinc/68/72/20/942687220.db2.gz IIBPLTIJDAKYQQ-CLFYSBASSA-N 0 0 355.375 3.841 20 5 FHBDRN C[C@@H](NC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21)[C@@H](C)c1ccccc1 ZINC000473540304 942687614 /nfs/dbraw/zinc/68/76/14/942687614.db2.gz GSUQBVOYWAJGDT-HUUCEWRRSA-N 0 0 351.406 3.858 20 5 FHBDRN CC(C)(CC(F)F)c1nc(Cc2c[nH]c3ccc([N+](=O)[O-])cc23)no1 ZINC000420487845 942692200 /nfs/dbraw/zinc/69/22/00/942692200.db2.gz NOUZQIGDWCHTED-UHFFFAOYSA-N 0 0 350.325 3.983 20 5 FHBDRN CCOc1ccc([C@@H](C)NC(=O)c2ccc([N+](=O)[O-])s2)cc1OC ZINC000501825242 942693804 /nfs/dbraw/zinc/69/38/04/942693804.db2.gz LVNNXKMLUJCICG-SNVBAGLBSA-N 0 0 350.396 3.555 20 5 FHBDRN O=C(N[C@@H]1C[C@H]1c1ccco1)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000413873073 942696724 /nfs/dbraw/zinc/69/67/24/942696724.db2.gz XEGIPQAJIPDTRO-DJIMGWMZSA-N 0 0 355.394 3.633 20 5 FHBDRN O=C(N[C@@H]1C[C@H]1c1ccco1)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000413873074 942697721 /nfs/dbraw/zinc/69/77/21/942697721.db2.gz XEGIPQAJIPDTRO-USXIJHARSA-N 0 0 355.394 3.633 20 5 FHBDRN O=[N+]([O-])c1ccccc1NCCc1noc([C@H]2C[C@@H]2c2ccccc2)n1 ZINC000420499133 942699340 /nfs/dbraw/zinc/69/93/40/942699340.db2.gz FJEYIOUHSCUCGX-CABCVRRESA-N 0 0 350.378 3.904 20 5 FHBDRN O=[N+]([O-])c1ccc2c(ccnc2N[C@@H]2CCO[C@@H](c3cccs3)C2)c1 ZINC000413347688 942705574 /nfs/dbraw/zinc/70/55/74/942705574.db2.gz AZYRZMCKBQGCFD-CZUORRHYSA-N 0 0 355.419 3.959 20 5 FHBDRN COc1cc(C(=O)N2CCC[C@@]2(C)Cc2ccc(F)cc2)ccc1[N+](=O)[O-] ZINC000421620768 942705664 /nfs/dbraw/zinc/70/56/64/942705664.db2.gz QOWXTTZPIISRKQ-FQEVSTJZSA-N 0 0 372.396 3.980 20 5 FHBDRN CC[C@@H](CC(F)F)c1nc(Cc2cc(OC)cc(OC)c2[N+](=O)[O-])no1 ZINC000420498552 942706075 /nfs/dbraw/zinc/70/60/75/942706075.db2.gz BBZGWORVUPHRAN-VIFPVBQESA-N 0 0 371.340 3.735 20 5 FHBDRN O=[N+]([O-])c1ccccc1NCCc1noc([C@H]2C[C@]2(F)c2ccccc2)n1 ZINC000420498655 942706191 /nfs/dbraw/zinc/70/61/91/942706191.db2.gz DGCAXUQYVDSWCN-KUHUBIRLSA-N 0 0 368.368 3.985 20 5 FHBDRN CC[C@H](CC(F)F)c1nc(Cc2cc(OC)cc(OC)c2[N+](=O)[O-])no1 ZINC000420498551 942706220 /nfs/dbraw/zinc/70/62/20/942706220.db2.gz BBZGWORVUPHRAN-SECBINFHSA-N 0 0 371.340 3.735 20 5 FHBDRN COc1ccc(Cc2noc([C@@H]3C[C@H]3c3ccc([N+](=O)[O-])cc3)n2)cc1F ZINC000420479510 942708816 /nfs/dbraw/zinc/70/88/16/942708816.db2.gz UGYMCAKTGLWORA-LSDHHAIUSA-N 0 0 369.352 3.987 20 5 FHBDRN Cn1ccnc1[C@H](NCCCOC1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000514081037 942731823 /nfs/dbraw/zinc/73/18/23/942731823.db2.gz AFOXQOZLBKSGNQ-LJQANCHMSA-N 0 0 372.469 3.747 20 5 FHBDRN Cc1cc(CN[C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)ccc1F ZINC000514084182 942736316 /nfs/dbraw/zinc/73/63/16/942736316.db2.gz OOKUETSFRGCUSZ-GOSISDBHSA-N 0 0 354.385 3.655 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCO[C@@H](CC)C1 ZINC000421672484 942737361 /nfs/dbraw/zinc/73/73/61/942737361.db2.gz UOCZZEASJYSPPX-OCCSQVGLSA-N 0 0 352.456 3.784 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N(C)Cc1ccc(Cl)s1 ZINC000122927566 942738357 /nfs/dbraw/zinc/73/83/57/942738357.db2.gz QZUDQYYRLYVARA-UHFFFAOYSA-N 0 0 355.803 3.982 20 5 FHBDRN C[C@@H](C(=O)N(C)C1CC(OC(C)(C)C)C1)c1ccc([N+](=O)[O-])cc1F ZINC000421691765 942747606 /nfs/dbraw/zinc/74/76/06/942747606.db2.gz CYKXXAUWOQOHFA-LMWSTFAQSA-N 0 0 352.406 3.642 20 5 FHBDRN CNC(=O)COc1cccc(Oc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 ZINC000502781001 942755084 /nfs/dbraw/zinc/75/50/84/942755084.db2.gz MUGCKEWPGSFUOF-UHFFFAOYSA-N 0 0 370.283 3.531 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)NCc1ccc(F)cc1Br ZINC000502783962 942757180 /nfs/dbraw/zinc/75/71/80/942757180.db2.gz ACDAOHWUNGGLDC-UHFFFAOYSA-N 0 0 367.174 3.735 20 5 FHBDRN COc1ccc([C@H]2CCN(C(=O)c3c(Cl)cccc3[N+](=O)[O-])C2)cc1 ZINC000110265519 942758580 /nfs/dbraw/zinc/75/85/80/942758580.db2.gz RFSUKVKIOCEWHK-ZDUSSCGKSA-N 0 0 360.797 3.887 20 5 FHBDRN CCOc1cc(NC(=O)NCCC(C)(C)C)c([N+](=O)[O-])cc1OCC ZINC000505431515 942761479 /nfs/dbraw/zinc/76/14/79/942761479.db2.gz VKFUEQHBXDZHHU-UHFFFAOYSA-N 0 0 353.419 3.950 20 5 FHBDRN CCN(CCc1cccs1)C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514129392 942762768 /nfs/dbraw/zinc/76/27/68/942762768.db2.gz WJABJFBJVLISGM-UHFFFAOYSA-N 0 0 370.377 3.963 20 5 FHBDRN Cn1cc(NC(=O)c2cc([N+](=O)[O-])ccc2SC2CCCC2)ccc1=O ZINC000137262420 942764461 /nfs/dbraw/zinc/76/44/61/942764461.db2.gz KNSVNDOJQIRLQX-UHFFFAOYSA-N 0 0 373.434 3.581 20 5 FHBDRN COc1cc(C(=O)Nc2ccc3c(c2)C(=O)CCCC3)ccc1[N+](=O)[O-] ZINC000421713084 942765251 /nfs/dbraw/zinc/76/52/51/942765251.db2.gz GINRGVPOLCYKKB-UHFFFAOYSA-N 0 0 354.362 3.765 20 5 FHBDRN O=C(COc1ccccc1[N+](=O)[O-])Nc1ccc2c(c1)C(=O)CCCC2 ZINC000421716936 942767812 /nfs/dbraw/zinc/76/78/12/942767812.db2.gz UVCKKVSFRMPVCV-UHFFFAOYSA-N 0 0 354.362 3.521 20 5 FHBDRN O=[N+]([O-])c1cc(CS(=O)(=O)c2ccc(Cl)cc2Cl)cs1 ZINC000549435013 942768099 /nfs/dbraw/zinc/76/80/99/942768099.db2.gz LIBDSWLGQFYXFV-UHFFFAOYSA-N 0 0 352.220 3.937 20 5 FHBDRN C[C@H](CCc1ccccc1)NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000514140793 942777600 /nfs/dbraw/zinc/77/76/00/942777600.db2.gz USPKSGJSGZTMBQ-OAHLLOKOSA-N 0 0 364.405 3.532 20 5 FHBDRN C[C@@H](CCc1ccccc1)NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000514140792 942777627 /nfs/dbraw/zinc/77/76/27/942777627.db2.gz USPKSGJSGZTMBQ-HNNXBMFYSA-N 0 0 364.405 3.532 20 5 FHBDRN CCOC(=O)CC[C@@H](C)Sc1nc2cc3ccccc3cc2c(=O)n1C ZINC000505443561 942800254 /nfs/dbraw/zinc/80/02/54/942800254.db2.gz JVLTXSGCEDOBBL-CYBMUJFWSA-N 0 0 370.474 3.911 20 5 FHBDRN Cc1ccc(N[C@H](CO)c2cccc(Br)c2)c([N+](=O)[O-])c1 ZINC000514176552 942802528 /nfs/dbraw/zinc/80/25/28/942802528.db2.gz RKCOEUXUTBRUHM-CQSZACIVSA-N 0 0 351.200 3.811 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCCc2cc(F)cc(F)c21 ZINC000434617252 942804527 /nfs/dbraw/zinc/80/45/27/942804527.db2.gz SKMKDGSUXRHXPF-UHFFFAOYSA-N 0 0 361.348 3.573 20 5 FHBDRN Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)N1CCOc2c(F)cccc2C1 ZINC000367074397 942809303 /nfs/dbraw/zinc/80/93/03/942809303.db2.gz XLFFWQPPCZZOOR-UHFFFAOYSA-N 0 0 363.320 3.608 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCC[C@H](Nc2ccccc2)C1 ZINC000421785714 942810302 /nfs/dbraw/zinc/81/03/02/942810302.db2.gz OCXZXLLNWBBWOP-KRWDZBQOSA-N 0 0 353.422 3.928 20 5 FHBDRN Cc1nn(Cc2ccc(Oc3ccccc3)nn2)c2ccc([N+](=O)[O-])cc12 ZINC000502870254 942816400 /nfs/dbraw/zinc/81/64/00/942816400.db2.gz KNIYARQLLFBCFZ-UHFFFAOYSA-N 0 0 361.361 3.884 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC2(CCOCC2)[C@@H]1c1ccccc1 ZINC000413951980 942818349 /nfs/dbraw/zinc/81/83/49/942818349.db2.gz HPSHTCMIMNFBQJ-IBGZPJMESA-N 0 0 366.417 3.897 20 5 FHBDRN CC(=O)NCc1ccc(Nc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1 ZINC000514192318 942818542 /nfs/dbraw/zinc/81/85/42/942818542.db2.gz HQRHOYGZKDSBAG-UHFFFAOYSA-N 0 0 353.300 3.993 20 5 FHBDRN CC(C)CSCCCNC(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000511552898 942819466 /nfs/dbraw/zinc/81/94/66/942819466.db2.gz LWKIEVLVMNDLFR-UHFFFAOYSA-N 0 0 353.488 3.558 20 5 FHBDRN CCCNc1ccccc1NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000190121213 942824620 /nfs/dbraw/zinc/82/46/20/942824620.db2.gz NTKJWUPREYBWDD-UHFFFAOYSA-N 0 0 365.393 3.855 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1F)N1CC[C@H](C(F)(F)F)C2(CCC2)C1 ZINC000514218054 942826063 /nfs/dbraw/zinc/82/60/63/942826063.db2.gz HLJMYWRNXAUYPQ-AWEZNQCLSA-N 0 0 374.334 3.858 20 5 FHBDRN C[C@H](CNC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)Cc1cccs1 ZINC000514217247 942826189 /nfs/dbraw/zinc/82/61/89/942826189.db2.gz CVGNIBJAKNIORR-JTQLQIEISA-N 0 0 370.377 3.866 20 5 FHBDRN COc1cccc(COCCNc2ccc3ncccc3c2[N+](=O)[O-])c1 ZINC000514206633 942830329 /nfs/dbraw/zinc/83/03/29/942830329.db2.gz RRYYWBOCKFXGFG-UHFFFAOYSA-N 0 0 353.378 3.780 20 5 FHBDRN COc1ccc([C@H](NCc2cc([N+](=O)[O-])ccc2OC)C2CC2)c(F)c1 ZINC000421824685 942833622 /nfs/dbraw/zinc/83/36/22/942833622.db2.gz JURRYMGJBCNOEJ-LJQANCHMSA-N 0 0 360.385 3.992 20 5 FHBDRN O=[N+]([O-])c1ccccc1OCCN[C@@H](c1cc(F)ccc1F)C(F)F ZINC000434660609 942844642 /nfs/dbraw/zinc/84/46/42/942844642.db2.gz ALHSJYLNUHMTJH-HNNXBMFYSA-N 0 0 358.291 3.848 20 5 FHBDRN O=[N+]([O-])c1cccc(OCCN[C@@H](c2cc(F)ccc2F)C(F)F)c1 ZINC000434665130 942847753 /nfs/dbraw/zinc/84/77/53/942847753.db2.gz ZFECDRIDPQFWEG-HNNXBMFYSA-N 0 0 358.291 3.848 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CCC[C@H]1COc1ccccc1 ZINC000412378340 942854916 /nfs/dbraw/zinc/85/49/16/942854916.db2.gz DJNPMQRWXQDPBR-YSIASYRMSA-N 0 0 366.417 3.768 20 5 FHBDRN CCOC(=O)c1csc(CCNc2ccc(Cl)cc2[N+](=O)[O-])n1 ZINC000190207961 942858037 /nfs/dbraw/zinc/85/80/37/942858037.db2.gz XVNFNHGVVDVYIR-UHFFFAOYSA-N 0 0 355.803 3.536 20 5 FHBDRN C[C@@H]1C[C@H](NC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)C[C@@H](c2ccccc2)C1 ZINC000413977966 942858203 /nfs/dbraw/zinc/85/82/03/942858203.db2.gz HYQWCWZBAIMENT-XIRDDKMYSA-N 0 0 370.453 3.615 20 5 FHBDRN C[C@@H](C(=O)NC[C@@H]1CCO[C@H]1c1ccccc1)c1ccc([N+](=O)[O-])cc1F ZINC000190208297 942858723 /nfs/dbraw/zinc/85/87/23/942858723.db2.gz TXNVSAUMGSTEOR-WTANOLMUSA-N 0 0 372.396 3.731 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N[C@H]2CCC[C@@H]2C(C)(C)C)cc1OC ZINC000413983051 942867309 /nfs/dbraw/zinc/86/73/09/942867309.db2.gz GNSCZSTWRSBVSA-KBPBESRZSA-N 0 0 364.442 3.947 20 5 FHBDRN CCOc1ccc(C(=O)Nc2ccc([C@H](C)C(=O)OC)cc2)cc1[N+](=O)[O-] ZINC000413990609 942869096 /nfs/dbraw/zinc/86/90/96/942869096.db2.gz NIVIMUWANZBZIA-LBPRGKRZSA-N 0 0 372.377 3.522 20 5 FHBDRN C[C@@H]1C[C@@H](NC(=O)c2c(N)cccc2[N+](=O)[O-])C[C@H](c2ccccc2)C1 ZINC000413995315 942875132 /nfs/dbraw/zinc/87/51/32/942875132.db2.gz STXXGWMMUGVSSW-NUEKZKHPSA-N 0 0 353.422 3.879 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NC[C@@](C)(Cc1ccccc1)[C@H](C)O ZINC000421900098 942877952 /nfs/dbraw/zinc/87/79/52/942877952.db2.gz XAVILWSYBADJJL-HRAATJIYSA-N 0 0 370.449 3.571 20 5 FHBDRN COc1cccc([C@H]2C[C@H](NC(=O)c3cc([N+](=O)[O-])c(C)cc3C)C2)c1 ZINC000421901291 942877979 /nfs/dbraw/zinc/87/79/79/942877979.db2.gz RCZQMTPUUBPOBH-WKILWMFISA-N 0 0 354.406 3.896 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1nccn1-c1ccccc1 ZINC000430087657 942882942 /nfs/dbraw/zinc/88/29/42/942882942.db2.gz DTUAZFKXXBWXKW-ZDUSSCGKSA-N 0 0 368.418 3.900 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc(C)c2nccn2c1 ZINC000502987763 942885672 /nfs/dbraw/zinc/88/56/72/942885672.db2.gz VBVHHPVNEFRJKD-HNNXBMFYSA-N 0 0 352.394 3.758 20 5 FHBDRN O=C(NCCc1c[nH]c2cc(Cl)ccc12)c1ccc(F)cc1[N+](=O)[O-] ZINC000133617502 942892372 /nfs/dbraw/zinc/89/23/72/942892372.db2.gz GNEWCFYCEWHQRZ-UHFFFAOYSA-N 0 0 361.760 3.841 20 5 FHBDRN COc1cc(OC)cc(Oc2ncc(Br)cc2[N+](=O)[O-])c1 ZINC000104926544 942894764 /nfs/dbraw/zinc/89/47/64/942894764.db2.gz WODHBLXOPUEFFF-UHFFFAOYSA-N 0 0 355.144 3.562 20 5 FHBDRN CCc1cccc(CC(=O)Nc2cc(C)nn2-c2ccc([N+](=O)[O-])cc2)c1 ZINC000502997840 942899756 /nfs/dbraw/zinc/89/97/56/942899756.db2.gz FUBSPDOJNAFYKJ-UHFFFAOYSA-N 0 0 364.405 3.833 20 5 FHBDRN CC(C)(C)C1CN(S(=O)(=O)c2c(Cl)cc(Cl)cc2[N+](=O)[O-])C1 ZINC000416518858 942901019 /nfs/dbraw/zinc/90/10/19/942901019.db2.gz HNFLXHMTDIFYDR-UHFFFAOYSA-N 0 0 367.254 3.568 20 5 FHBDRN CC(C)Cn1cnnc1[C@@H]1CCCN1c1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000078022034 942909261 /nfs/dbraw/zinc/90/92/61/942909261.db2.gz KOJONBDWXPIKMU-KRWDZBQOSA-N 0 0 366.425 3.732 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)N(C)Cc1cc(Cl)cc(Cl)c1 ZINC000046752078 942915971 /nfs/dbraw/zinc/91/59/71/942915971.db2.gz ZUMADJRDVGIBQL-UHFFFAOYSA-N 0 0 354.193 3.877 20 5 FHBDRN Cn1ccnc1[C@@H](NCCc1cccc(Cl)c1)c1ccc([N+](=O)[O-])cc1 ZINC000513762058 942918400 /nfs/dbraw/zinc/91/84/00/942918400.db2.gz PNWKEJJNMOATSD-SFHVURJKSA-N 0 0 370.840 3.903 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1OC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000760019771 942932096 /nfs/dbraw/zinc/93/20/96/942932096.db2.gz KLAXAXJMEZNMFW-UHFFFAOYSA-N 0 0 371.349 3.631 20 5 FHBDRN CC(C)Cn1c(-c2cccc([N+](=O)[O-])c2)nnc1N1CC[C@H](C2CC2)C1 ZINC000549445639 942933074 /nfs/dbraw/zinc/93/30/74/942933074.db2.gz BXVKISRFKNGMEW-INIZCTEOSA-N 0 0 355.442 3.746 20 5 FHBDRN Cc1ccc(C(=O)COC(=O)CSc2ccc([N+](=O)[O-])cc2)cc1C ZINC000016620197 942936835 /nfs/dbraw/zinc/93/68/35/942936835.db2.gz DQUQDGLOUUGPET-UHFFFAOYSA-N 0 0 359.403 3.730 20 5 FHBDRN COc1cc(C(=O)N2C[C@H](C)C[C@@H]2c2cccnc2)cc([N+](=O)[O-])c1C ZINC000190218128 942939869 /nfs/dbraw/zinc/93/98/69/942939869.db2.gz VIOQDVVAMXZREO-SJKOYZFVSA-N 0 0 355.394 3.530 20 5 FHBDRN CCC[C@@H](CC(=O)OCC)Oc1cccc([N+](=O)[O-])c1Br ZINC001225756162 942946094 /nfs/dbraw/zinc/94/60/94/942946094.db2.gz ABAXCFLFYRWFAX-JTQLQIEISA-N 0 0 360.204 3.858 20 5 FHBDRN COc1cc(C(=O)N2C[C@H](C)C[C@H]2c2cccnc2)cc([N+](=O)[O-])c1C ZINC000190218159 942947358 /nfs/dbraw/zinc/94/73/58/942947358.db2.gz VIOQDVVAMXZREO-PXAZEXFGSA-N 0 0 355.394 3.530 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N[C@@H]2CCC[C@@H]2C(C)(C)C)c1F ZINC000412825937 942948338 /nfs/dbraw/zinc/94/83/38/942948338.db2.gz PZTLVEBRWLZXQI-QWHCGFSZSA-N 0 0 352.406 3.616 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N[C@H]2CCC[C@H]2C(C)(C)C)c1F ZINC000412825936 942948504 /nfs/dbraw/zinc/94/85/04/942948504.db2.gz PZTLVEBRWLZXQI-OLZOCXBDSA-N 0 0 352.406 3.616 20 5 FHBDRN C[C@@H]1CC[C@@H](O)CN1C(=O)c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1 ZINC000422036494 942949370 /nfs/dbraw/zinc/94/93/70/942949370.db2.gz QBNQYBULAMMGEC-CZUORRHYSA-N 0 0 372.446 3.731 20 5 FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCC(C)(C)C1 ZINC000509958679 942981657 /nfs/dbraw/zinc/98/16/57/942981657.db2.gz PSDVFOMSNBDQIN-GFCCVEGCSA-N 0 0 352.456 3.642 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@H](CCO)CC1 ZINC000422071433 942983102 /nfs/dbraw/zinc/98/31/02/942983102.db2.gz KRHXLPHCVKBISZ-AWEZNQCLSA-N 0 0 366.483 3.720 20 5 FHBDRN Cc1c(NC(=O)[C@H](OC2CCOCC2)c2ccccc2)cccc1[N+](=O)[O-] ZINC000536253841 942986119 /nfs/dbraw/zinc/98/61/19/942986119.db2.gz LTMAAKMEJBOKHG-LJQANCHMSA-N 0 0 370.405 3.779 20 5 FHBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)N1C[C@H](c2ccccc2)C2(CCC2)C1 ZINC000416582107 942987424 /nfs/dbraw/zinc/98/74/24/942987424.db2.gz AQOPHMVQBHIEHL-MRXNPFEDSA-N 0 0 372.446 3.553 20 5 FHBDRN Cc1cc(-n2cccn2)ccc1NC(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000190221562 942989346 /nfs/dbraw/zinc/98/93/46/942989346.db2.gz CSPVTDSEIWAKOF-UHFFFAOYSA-N 0 0 365.393 3.530 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N2CCCC[C@@H]2Cc2ccccc2)c1[N+](=O)[O-] ZINC000434187041 942998239 /nfs/dbraw/zinc/99/82/39/942998239.db2.gz OVELGCMEVWEZCH-OAHLLOKOSA-N 0 0 356.426 3.679 20 5 FHBDRN COc1ccc(C)cc1CCNC(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000514431389 943000695 /nfs/dbraw/zinc/00/06/95/943000695.db2.gz GJQOLSDFPWPZOJ-UHFFFAOYSA-N 0 0 354.362 3.631 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)N1CC2(C1)CCCCC2 ZINC000503138413 943005177 /nfs/dbraw/zinc/00/51/77/943005177.db2.gz JMXREAZPBPCHDF-UHFFFAOYSA-N 0 0 367.243 3.693 20 5 FHBDRN CO[C@](C)(CNC(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1)c1ccccc1 ZINC000412383530 943005435 /nfs/dbraw/zinc/00/54/35/943005435.db2.gz OCLHGAFIPVMPRC-HXUWFJFHSA-N 0 0 372.421 3.674 20 5 FHBDRN CCC1CCC(N(C(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)C2CC2)CC1 ZINC000514424906 943006659 /nfs/dbraw/zinc/00/66/59/943006659.db2.gz SRDIHCKPKOXMBQ-UHFFFAOYSA-N 0 0 360.410 3.897 20 5 FHBDRN CC(C)c1ccccc1OCCC(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000505548590 943008298 /nfs/dbraw/zinc/00/82/98/943008298.db2.gz CVZOWBRFTVESGD-UHFFFAOYSA-N 0 0 356.422 3.846 20 5 FHBDRN Cc1cnc([C@H]2CCCCN2C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)s1 ZINC000367123540 943009025 /nfs/dbraw/zinc/00/90/25/943009025.db2.gz SXQYXKHNSAENHY-CQSZACIVSA-N 0 0 371.422 3.603 20 5 FHBDRN COC(=O)c1cc(N[C@@H](c2cnn(C)c2)C(C)(C)C)cc(C)c1[N+](=O)[O-] ZINC000425232194 943027629 /nfs/dbraw/zinc/02/76/29/943027629.db2.gz FHBOZHUEBTUAJT-INIZCTEOSA-N 0 0 360.414 3.623 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)N[C@H]2COCc3ccccc32)cc1[N+](=O)[O-] ZINC000416683993 943039264 /nfs/dbraw/zinc/03/92/64/943039264.db2.gz KYGZVMTVKNRKIZ-DYVFJYSZSA-N 0 0 355.394 3.535 20 5 FHBDRN CCOC(=O)c1cccnc1SCc1c(F)cc([N+](=O)[O-])cc1F ZINC000505577547 943055610 /nfs/dbraw/zinc/05/56/10/943055610.db2.gz XVLKKDNLGUBOSY-UHFFFAOYSA-N 0 0 354.334 3.737 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCC[C@H](c3nc(C(F)(F)F)cs3)C2)cn1 ZINC000434942736 943057242 /nfs/dbraw/zinc/05/72/42/943057242.db2.gz LLQMYRFASSQEPN-VIFPVBQESA-N 0 0 358.345 3.849 20 5 FHBDRN COc1cc(F)cc(C[C@H](C)NC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)c1 ZINC000412410505 943066764 /nfs/dbraw/zinc/06/67/64/943066764.db2.gz PDMWHANRYGAYRC-YXKWSERDSA-N 0 0 372.396 3.593 20 5 FHBDRN C[C@@H]1[C@@H](c2ccccc2)c2ccccc2CCN1c1c([N+](=O)[O-])ncn1C ZINC000434947332 943067605 /nfs/dbraw/zinc/06/76/05/943067605.db2.gz PIZBDSTYJBPTGX-BEFAXECRSA-N 0 0 362.433 3.911 20 5 FHBDRN C[C@@H]1[C@H](c2ccccc2)c2ccccc2CCN1c1c([N+](=O)[O-])ncn1C ZINC000434947336 943067879 /nfs/dbraw/zinc/06/78/79/943067879.db2.gz PIZBDSTYJBPTGX-DNVCBOLYSA-N 0 0 362.433 3.911 20 5 FHBDRN O=[N+]([O-])c1ccc(CNCc2cccc(-c3cccnc3)c2)c([N+](=O)[O-])c1 ZINC000365829694 943071025 /nfs/dbraw/zinc/07/10/25/943071025.db2.gz YITFFWGYPSBIOM-UHFFFAOYSA-N 0 0 364.361 3.855 20 5 FHBDRN Cc1ccc(C(C)C)cc1OCC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000514520460 943078599 /nfs/dbraw/zinc/07/85/99/943078599.db2.gz CDTDFUFNGNZQML-UHFFFAOYSA-N 0 0 354.406 3.995 20 5 FHBDRN O=C(Oc1cccc([N+](=O)[O-])c1)c1cccc(OCc2cscn2)c1 ZINC000016708415 943083822 /nfs/dbraw/zinc/08/38/22/943083822.db2.gz YGZRAHLSLOTBOX-UHFFFAOYSA-N 0 0 356.359 3.850 20 5 FHBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])Nc1ncsc1C1CC1 ZINC000893271607 943086360 /nfs/dbraw/zinc/08/63/60/943086360.db2.gz PPRIJUOQWXCGGM-UHFFFAOYSA-N 0 0 367.814 3.990 20 5 FHBDRN Cc1ccc(SCCC(=O)NCCNc2ccc([N+](=O)[O-])cc2)cc1 ZINC000008175100 943086869 /nfs/dbraw/zinc/08/68/69/943086869.db2.gz JNZFYCFIGUAEOC-UHFFFAOYSA-N 0 0 359.451 3.614 20 5 FHBDRN CC(C)(NC(=O)Nc1ccc(OC(F)F)nc1)c1ccc([N+](=O)[O-])cc1 ZINC000549454456 943091835 /nfs/dbraw/zinc/09/18/35/943091835.db2.gz QLLYNTWJVKPDCL-UHFFFAOYSA-N 0 0 366.324 3.648 20 5 FHBDRN O=C(NCc1ncc(-c2ccccc2)cn1)c1ccc([N+](=O)[O-])cc1Cl ZINC000183906982 943092169 /nfs/dbraw/zinc/09/21/69/943092169.db2.gz YNMJHXQPIBCLRZ-UHFFFAOYSA-N 0 0 368.780 3.635 20 5 FHBDRN Cc1c(Cl)cc(S(=O)(=O)N(C)[C@@H]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000514537129 943093285 /nfs/dbraw/zinc/09/32/85/943093285.db2.gz JVTOAFJSJIIGBV-QMTHXVAHSA-N 0 0 360.863 3.756 20 5 FHBDRN Cc1c(Cl)cc(S(=O)(=O)N(C)[C@H]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000514537127 943093316 /nfs/dbraw/zinc/09/33/16/943093316.db2.gz JVTOAFJSJIIGBV-HZMBPMFUSA-N 0 0 360.863 3.756 20 5 FHBDRN Cc1ccc(C2=CCN(S(=O)(=O)c3cc([N+](=O)[O-])ccc3C)CC2)cc1 ZINC000016736850 943101016 /nfs/dbraw/zinc/10/10/16/943101016.db2.gz ZGXLRHGSEUJOIM-UHFFFAOYSA-N 0 0 372.446 3.690 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2noc(N3CC[C@H](COc4ccccc4)C3)n2)cc1 ZINC000503281568 943102730 /nfs/dbraw/zinc/10/27/30/943102730.db2.gz LPVBOPYOWMLDRD-AWEZNQCLSA-N 0 0 366.377 3.550 20 5 FHBDRN CCOc1ccc(OC[C@@H](O)CSCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000513785667 943103542 /nfs/dbraw/zinc/10/35/42/943103542.db2.gz QUTMOFYKZDZYCO-MRXNPFEDSA-N 0 0 363.435 3.667 20 5 FHBDRN O=[N+]([O-])c1ccc(OC(F)F)c(CN2CCOc3c(F)cccc3C2)c1 ZINC000435038275 943105248 /nfs/dbraw/zinc/10/52/48/943105248.db2.gz QNSZFWFALFAZTI-UHFFFAOYSA-N 0 0 368.311 3.730 20 5 FHBDRN Cc1cc(C(=O)Oc2c(C)cccc2[N+](=O)[O-])c2cnn(C(C)C)c2n1 ZINC000760017176 943107661 /nfs/dbraw/zinc/10/76/61/943107661.db2.gz MYLPUPQOYAGVCX-UHFFFAOYSA-N 0 0 354.366 3.756 20 5 FHBDRN COc1ccc(OC)c([C@H]2CCCN2C(=O)c2csc([N+](=O)[O-])c2)c1 ZINC000514568542 943115936 /nfs/dbraw/zinc/11/59/36/943115936.db2.gz JTKMVUMRKZYRHF-CQSZACIVSA-N 0 0 362.407 3.651 20 5 FHBDRN O=C1CCc2cc([N+](=O)[O-])c(NCCc3cc(F)c(F)c(F)c3)cc2N1 ZINC000503310056 943117259 /nfs/dbraw/zinc/11/72/59/943117259.db2.gz ISUURBACKNYSMN-UHFFFAOYSA-N 0 0 365.311 3.551 20 5 FHBDRN COc1cc(C(=O)NCc2csc3ccccc23)c([N+](=O)[O-])cc1OC ZINC000514577407 943134828 /nfs/dbraw/zinc/13/48/28/943134828.db2.gz WXLWEJKDRSFJHL-UHFFFAOYSA-N 0 0 372.402 3.757 20 5 FHBDRN CC(=O)N1CCc2c1cccc2NC(=O)c1cc(Cl)c(C)cc1[N+](=O)[O-] ZINC001269900258 943148830 /nfs/dbraw/zinc/14/88/30/943148830.db2.gz OWMSHCDMQAIBRJ-UHFFFAOYSA-N 0 0 373.796 3.718 20 5 FHBDRN Cc1c(C(=O)N[C@@H](CC(=O)OC(C)C)c2ccccc2)cccc1[N+](=O)[O-] ZINC000014398581 943157247 /nfs/dbraw/zinc/15/72/47/943157247.db2.gz KKTKMZRHUHVFCZ-KRWDZBQOSA-N 0 0 370.405 3.716 20 5 FHBDRN O=C(Nc1c[nH]nc1-c1ccccc1F)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000513788728 943163470 /nfs/dbraw/zinc/16/34/70/943163470.db2.gz WKQYRCONJQEJHR-UHFFFAOYSA-N 0 0 365.324 3.858 20 5 FHBDRN CN(Cc1nc2ccccc2s1)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000016848269 943177903 /nfs/dbraw/zinc/17/79/03/943177903.db2.gz YEBISBAVFAWING-UHFFFAOYSA-N 0 0 353.407 3.644 20 5 FHBDRN O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)N1CC[C@@]2(C1)OCc1ccccc12 ZINC000183933592 943181723 /nfs/dbraw/zinc/18/17/23/943181723.db2.gz UCJGGWHUAHPYBU-SFHVURJKSA-N 0 0 373.796 3.912 20 5 FHBDRN COC(=O)c1ccc(OC(=O)[C@@H]2CC[C@H]2c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC001267794906 943185664 /nfs/dbraw/zinc/18/56/64/943185664.db2.gz MBOADZNUCMZNEX-LSDHHAIUSA-N 0 0 373.336 3.620 20 5 FHBDRN C[C@H](C(=O)N1C[C@H]2CCC(=O)c3cccc1c32)c1ccc([N+](=O)[O-])cc1F ZINC000183801969 943186393 /nfs/dbraw/zinc/18/63/93/943186393.db2.gz BCIQEULCTTXCFD-NWDGAFQWSA-N 0 0 368.364 3.944 20 5 FHBDRN CC(C)c1[nH]nc(C(=O)Nc2ccc3[nH]c(C4CCC4)nc3c2)c1[N+](=O)[O-] ZINC000434178143 943186683 /nfs/dbraw/zinc/18/66/83/943186683.db2.gz BHLUYQNKUYSBCB-UHFFFAOYSA-N 0 0 368.397 3.837 20 5 FHBDRN CCC[C@H](NS(=O)(=O)CCc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000503450673 943188444 /nfs/dbraw/zinc/18/84/44/943188444.db2.gz UIEFFRYLBUDCMA-SFHVURJKSA-N 0 0 362.451 3.598 20 5 FHBDRN CCOC(=O)c1cc(C(=O)N[C@@H](C)[C@H](C)c2ccccc2)cc([N+](=O)[O-])c1 ZINC000473552253 943191654 /nfs/dbraw/zinc/19/16/54/943191654.db2.gz YLQKDWOKUYTQKI-KBPBESRZSA-N 0 0 370.405 3.694 20 5 FHBDRN CC[C@@H]1CCCCN1C(=O)COc1ccc([N+](=O)[O-])cc1Br ZINC000133689440 943197183 /nfs/dbraw/zinc/19/71/83/943197183.db2.gz YLHRDEFUGMCYMP-LLVKDONJSA-N 0 0 371.231 3.527 20 5 FHBDRN Cc1cc(C(=O)NCc2ccnc(OC3CCCCC3)c2)ccc1[N+](=O)[O-] ZINC000503475804 943210152 /nfs/dbraw/zinc/21/01/52/943210152.db2.gz LXDRFMZZEKARNH-UHFFFAOYSA-N 0 0 369.421 3.940 20 5 FHBDRN CN(C)c1ccc(NC(=O)c2ccc(Br)c([N+](=O)[O-])c2)cc1 ZINC000014426699 943217080 /nfs/dbraw/zinc/21/70/80/943217080.db2.gz JNGVQDFHAHPCAS-UHFFFAOYSA-N 0 0 364.199 3.676 20 5 FHBDRN CC(C)c1[nH]nc(C(=O)Nc2scnc2-c2ccccc2)c1[N+](=O)[O-] ZINC000434197959 943233642 /nfs/dbraw/zinc/23/36/42/943233642.db2.gz SYFBIIMIUGBKPF-UHFFFAOYSA-N 0 0 357.395 3.817 20 5 FHBDRN O=C(Nc1nnc(C2CC2)s1)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000514708100 943236651 /nfs/dbraw/zinc/23/66/51/943236651.db2.gz PZNHDLOWBRWSHK-UHFFFAOYSA-N 0 0 362.414 3.663 20 5 FHBDRN CC(C)(C)Oc1cccc(CCC(=O)Nc2ccc([N+](=O)[O-])cc2F)n1 ZINC000468691147 943238902 /nfs/dbraw/zinc/23/89/02/943238902.db2.gz VONSOHZBPFCQEJ-UHFFFAOYSA-N 0 0 361.373 3.878 20 5 FHBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1C[C@@H](C)CC1(C)C ZINC000514742244 943254336 /nfs/dbraw/zinc/25/43/36/943254336.db2.gz QEIJKXXHLPDWOQ-VIFPVBQESA-N 0 0 355.232 3.926 20 5 FHBDRN CC(C)CCSc1ccc(C(=O)N2CCO[C@@H](CF)C2)cc1[N+](=O)[O-] ZINC000412439805 943269700 /nfs/dbraw/zinc/26/97/00/943269700.db2.gz VCRUQBDCDWGMCT-AWEZNQCLSA-N 0 0 370.446 3.544 20 5 FHBDRN Cc1ccc2ncc(-c3noc(C(C)(C)c4ccc([N+](=O)[O-])cc4)n3)n2c1 ZINC000514757379 943270079 /nfs/dbraw/zinc/27/00/79/943270079.db2.gz MQGLQUANMRQGLM-UHFFFAOYSA-N 0 0 363.377 3.927 20 5 FHBDRN CC[C@@H](NC(=O)N(C)CCc1cccc([N+](=O)[O-])c1)c1c(C)noc1C ZINC000511596476 943279373 /nfs/dbraw/zinc/27/93/73/943279373.db2.gz UMKVNUBYSZTBDF-MRXNPFEDSA-N 0 0 360.414 3.535 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CCC[C@H]1COc1cccnc1C ZINC000416998118 943281720 /nfs/dbraw/zinc/28/17/20/943281720.db2.gz PDZNICQTZURERE-INIZCTEOSA-N 0 0 370.409 3.682 20 5 FHBDRN O=C(Nc1cc(F)c(F)cc1Br)c1cccc([N+](=O)[O-])c1 ZINC000435252920 943282674 /nfs/dbraw/zinc/28/26/74/943282674.db2.gz YNIMJGIGGGTFQE-UHFFFAOYSA-N 0 0 357.110 3.888 20 5 FHBDRN O=C(Nc1cc(F)c(F)cc1Br)c1ccc([N+](=O)[O-])s1 ZINC000435265973 943290770 /nfs/dbraw/zinc/29/07/70/943290770.db2.gz DQDMHJIYJDQBKF-UHFFFAOYSA-N 0 0 363.139 3.949 20 5 FHBDRN Cc1c(CNC(=O)N2CC(C)(C)[C@H]2c2ccncc2)cccc1[N+](=O)[O-] ZINC000431915592 943292667 /nfs/dbraw/zinc/29/26/67/943292667.db2.gz DAIYNCMGQIPDRA-QGZVFWFLSA-N 0 0 354.410 3.591 20 5 FHBDRN C[C@@H](Cc1ccccc1C(F)(F)F)NC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000503628859 943299731 /nfs/dbraw/zinc/29/97/31/943299731.db2.gz OMKKHXJBHSPYOC-NSHDSACASA-N 0 0 352.312 3.975 20 5 FHBDRN CC(C)(C)c1ccc(NCc2ccc(S(C)(=O)=O)o2)cc1[N+](=O)[O-] ZINC000417039722 943305893 /nfs/dbraw/zinc/30/58/93/943305893.db2.gz XHZMBFDCFXVNKT-UHFFFAOYSA-N 0 0 352.412 3.501 20 5 FHBDRN C[C@H](Cc1ccccc1C(F)(F)F)NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000503650477 943311398 /nfs/dbraw/zinc/31/13/98/943311398.db2.gz SOGFDPFOCZYSSP-LLVKDONJSA-N 0 0 352.312 3.975 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)NCC1(Cc2ccccc2)CC1 ZINC000435299826 943319901 /nfs/dbraw/zinc/31/99/01/943319901.db2.gz RWJUJELQQWYXLF-UHFFFAOYSA-N 0 0 356.447 3.826 20 5 FHBDRN O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CC[C@H]1c1ccccc1 ZINC000431918512 943322141 /nfs/dbraw/zinc/32/21/41/943322141.db2.gz IUDCVKSKNMGQQT-HNNXBMFYSA-N 0 0 361.195 3.945 20 5 FHBDRN Cc1c(NC(=O)N2CC[C@@](C)(F)C2)cc(Br)cc1[N+](=O)[O-] ZINC000435330530 943334094 /nfs/dbraw/zinc/33/40/94/943334094.db2.gz UEFMUQYANWLSKX-CYBMUJFWSA-N 0 0 360.183 3.632 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2C[C@H]2c2ccccc2)cc1SC ZINC000435335387 943338318 /nfs/dbraw/zinc/33/83/18/943338318.db2.gz HUCGKSHNMWTWLO-GXTWGEPZSA-N 0 0 358.419 3.611 20 5 FHBDRN Cc1cnc(COC(=O)[C@@H](C)Sc2ccc(F)cc2)c(C)c1[N+](=O)[O-] ZINC001269436489 943366736 /nfs/dbraw/zinc/36/67/36/943366736.db2.gz NZTFKXPVACEFLJ-GFCCVEGCSA-N 0 0 364.398 3.970 20 5 FHBDRN Cc1cc(F)c([N+](=O)[O-])cc1C(=O)N1CCCC[C@H]1c1noc(C2CC2)n1 ZINC001126413672 943369558 /nfs/dbraw/zinc/36/95/58/943369558.db2.gz FRYGYOJPUIMULM-AWEZNQCLSA-N 0 0 374.372 3.670 20 5 FHBDRN COc1ccc(CNC(=O)N2CC[C@@H](c3ccccc3)[C@@H]2C)cc1[N+](=O)[O-] ZINC000435384569 943372545 /nfs/dbraw/zinc/37/25/45/943372545.db2.gz NEEJBKHHVSAMDV-WMLDXEAASA-N 0 0 369.421 3.691 20 5 FHBDRN CCc1cccc2c1OCC[C@H]2NC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000514905826 943374725 /nfs/dbraw/zinc/37/47/25/943374725.db2.gz CEFYZFBLEHWIFA-FZKQIMNGSA-N 0 0 354.406 3.901 20 5 FHBDRN O=C(Nc1ncc(C(F)(F)F)s1)[C@@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1 ZINC001269446136 943376143 /nfs/dbraw/zinc/37/61/43/943376143.db2.gz WZFODTJSHVRSEP-NXEZZACHSA-N 0 0 357.313 3.812 20 5 FHBDRN O=[N+]([O-])c1cccc(CS(=O)(=O)N2CCC[C@H]2/C=C\c2ccccc2)c1 ZINC000503828754 943377650 /nfs/dbraw/zinc/37/76/50/943377650.db2.gz OBKWVZWWANHGQQ-JYBLJSLWSA-N 0 0 372.446 3.602 20 5 FHBDRN C[C@H](NC(=O)NCc1ccc2c(c1)CCCN2)c1cccc([N+](=O)[O-])c1 ZINC000417144767 943379388 /nfs/dbraw/zinc/37/93/88/943379388.db2.gz WEGFKIBELHSGOM-ZDUSSCGKSA-N 0 0 354.410 3.513 20 5 FHBDRN CCCOc1ccc2c(c1)CCN(C(=O)c1ccc([N+](=O)[O-])cc1F)C2 ZINC000435395662 943380791 /nfs/dbraw/zinc/38/07/91/943380791.db2.gz UHHWXNJJPRFCTR-UHFFFAOYSA-N 0 0 358.369 3.721 20 5 FHBDRN O=C(CCCOc1ccc(Cl)cc1)NCCc1ccc([N+](=O)[O-])cc1 ZINC000053218953 943385365 /nfs/dbraw/zinc/38/53/65/943385365.db2.gz HVYHPVFHOBKSMN-UHFFFAOYSA-N 0 0 362.813 3.766 20 5 FHBDRN Cc1cc([C@@H](C)NC(=O)NCCNc2ccc([N+](=O)[O-])cc2)ccc1F ZINC000435411807 943386294 /nfs/dbraw/zinc/38/62/94/943386294.db2.gz NOWZZJHMVXCUOI-CYBMUJFWSA-N 0 0 360.389 3.515 20 5 FHBDRN O=C(c1cc2cc([N+](=O)[O-])ccc2o1)N(Cc1ccco1)C[C@H]1CCCO1 ZINC000511608009 943398753 /nfs/dbraw/zinc/39/87/53/943398753.db2.gz ASBNZUIJPLIVPT-MRXNPFEDSA-N 0 0 370.361 3.755 20 5 FHBDRN COC(=O)c1conc1C(C)(C)NCc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000425375986 943402637 /nfs/dbraw/zinc/40/26/37/943402637.db2.gz VPZDAOKQWWIGFA-UHFFFAOYSA-N 0 0 361.398 3.518 20 5 FHBDRN O=C(CSc1ccccc1[N+](=O)[O-])N1CCC(OC2CCCC2)CC1 ZINC000503886712 943402692 /nfs/dbraw/zinc/40/26/92/943402692.db2.gz RZZQAPNTWMJEFU-UHFFFAOYSA-N 0 0 364.467 3.637 20 5 FHBDRN CC(C)[C@H](C(=O)NCCCCc1ccc([N+](=O)[O-])cc1)c1cccnc1 ZINC000435449631 943410483 /nfs/dbraw/zinc/41/04/83/943410483.db2.gz UFRSMOYYBLJHNM-IBGZPJMESA-N 0 0 355.438 3.869 20 5 FHBDRN C[C@@H](NC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)[C@H](C)c1ccccc1 ZINC000473555010 943424459 /nfs/dbraw/zinc/42/44/59/943424459.db2.gz RLAZCJSYKZJZJP-LSDHHAIUSA-N 0 0 364.405 3.703 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(-c2nc([C@H](OC)c3ccc(F)cc3)no2)c1 ZINC000514971090 943424519 /nfs/dbraw/zinc/42/45/19/943424519.db2.gz VGQWMWODGJXPOU-MRXNPFEDSA-N 0 0 373.340 3.918 20 5 FHBDRN C[C@H](NC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)[C@@H](C)c1ccccc1 ZINC000473555005 943424620 /nfs/dbraw/zinc/42/46/20/943424620.db2.gz RLAZCJSYKZJZJP-CABCVRRESA-N 0 0 364.405 3.703 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@]1(O)CCCC1(C)C ZINC000503943256 943428482 /nfs/dbraw/zinc/42/84/82/943428482.db2.gz FEUNQUSTQHXUPY-SFHVURJKSA-N 0 0 366.483 3.768 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(C(=O)OC)c(C)c1 ZINC001125899825 943432998 /nfs/dbraw/zinc/43/29/98/943432998.db2.gz ORWQICVLKQDFMI-HNNXBMFYSA-N 0 0 370.405 3.897 20 5 FHBDRN COCC[C@@H]1CCCCN(c2ncc([N+](=O)[O-])c(C)c2Br)C1 ZINC000466618215 943462596 /nfs/dbraw/zinc/46/25/96/943462596.db2.gz LIMDVTOVJKMUKB-LBPRGKRZSA-N 0 0 372.263 3.704 20 5 FHBDRN COc1cccc([C@H]2C[C@H](C)CN2CC(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000544118555 943473934 /nfs/dbraw/zinc/47/39/34/943473934.db2.gz YBKQFBGBJXCCEM-IFXJQAMLSA-N 0 0 369.421 3.625 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N(C)Cc1csc(C)n1 ZINC000122998567 943476827 /nfs/dbraw/zinc/47/68/27/943476827.db2.gz XJPGWFOKLOMHAA-UHFFFAOYSA-N 0 0 351.453 3.744 20 5 FHBDRN Cc1[nH]nc(C(=O)Nc2nc(-c3cccc(Cl)c3)cs2)c1[N+](=O)[O-] ZINC000504075645 943489296 /nfs/dbraw/zinc/48/92/96/943489296.db2.gz LOXCZOFFBKNVAY-UHFFFAOYSA-N 0 0 363.786 3.656 20 5 FHBDRN CNC(=O)c1ccc(N[C@@H]2C[C@H]2c2ccc(Cl)c(F)c2)c([N+](=O)[O-])c1 ZINC000435567694 943490099 /nfs/dbraw/zinc/49/00/99/943490099.db2.gz FFEZZZOJSNQQKR-XHDPSFHLSA-N 0 0 363.776 3.715 20 5 FHBDRN CCn1nc(C)c([N+](=O)[O-])c1N[C@@H]1C[C@H]1c1ccc(Br)cc1 ZINC000435571821 943491844 /nfs/dbraw/zinc/49/18/44/943491844.db2.gz ZGZHRRMFEXRHGQ-QWHCGFSZSA-N 0 0 365.231 3.850 20 5 FHBDRN Cn1cc([N+](=O)[O-])c(C(=O)N(CC2CCCCC2)CC2CCCCC2)n1 ZINC000504089144 943495452 /nfs/dbraw/zinc/49/54/52/943495452.db2.gz LPLYOGJNAJOFDA-UHFFFAOYSA-N 0 0 362.474 3.931 20 5 FHBDRN C[C@H](c1ccccc1)N(C(=O)c1nn(C)cc1[N+](=O)[O-])c1ccccc1 ZINC000504091544 943496730 /nfs/dbraw/zinc/49/67/30/943496730.db2.gz LICHIUXGGMIKHY-CQSZACIVSA-N 0 0 350.378 3.736 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N1CCO[C@H](c2cccc(F)c2)C1 ZINC000515097931 943503378 /nfs/dbraw/zinc/50/33/78/943503378.db2.gz YBVXHMKGDDBXFO-SFHVURJKSA-N 0 0 373.384 3.902 20 5 FHBDRN COC[C@H](NC(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-])C(C)C ZINC000515109621 943510151 /nfs/dbraw/zinc/51/01/51/943510151.db2.gz OBZTYAPZXTUKQO-SFHVURJKSA-N 0 0 372.421 3.575 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H]1c2ccccc2CC[C@@H]1C(C)C ZINC001267836163 943510321 /nfs/dbraw/zinc/51/03/21/943510321.db2.gz KKIBKSIULXKSPC-APWZRJJASA-N 0 0 353.422 3.988 20 5 FHBDRN O=[N+]([O-])c1ccc(CN2CCOCC2)cc1N[C@H]1C[C@H](c2ccccc2)C1 ZINC000435604392 943512915 /nfs/dbraw/zinc/51/29/15/943512915.db2.gz PBZWVXHPPLSGFS-WGSAOQKQSA-N 0 0 367.449 3.785 20 5 FHBDRN COc1ccc2c(c1)[C@H](NC(=O)c1cc(Cl)ccc1[N+](=O)[O-])CCO2 ZINC001267836612 943514690 /nfs/dbraw/zinc/51/46/90/943514690.db2.gz TYZOXHIBFFUIMN-CQSZACIVSA-N 0 0 362.769 3.510 20 5 FHBDRN COc1cc(OC)c(NC(=O)c2cccc(OC)c2[N+](=O)[O-])cc1Cl ZINC000435638658 943523082 /nfs/dbraw/zinc/52/30/82/943523082.db2.gz RDDDGGOZBIFWPI-UHFFFAOYSA-N 0 0 366.757 3.526 20 5 FHBDRN COc1cc(C(=O)NCCOc2cccc(C(C)(C)C)c2)ccc1[N+](=O)[O-] ZINC000504164811 943527471 /nfs/dbraw/zinc/52/74/71/943527471.db2.gz JZEDLJAKTKYVNB-UHFFFAOYSA-N 0 0 372.421 3.710 20 5 FHBDRN CC(C)(C)Oc1cccc(CNC(=O)c2ccc([N+](=O)[O-])cc2Cl)n1 ZINC000504184500 943531786 /nfs/dbraw/zinc/53/17/86/943531786.db2.gz NDZLCHMBAZUXHV-UHFFFAOYSA-N 0 0 363.801 3.751 20 5 FHBDRN Cc1cc(N2C[C@H](C)O[C@]3(CCO[C@@H]3C)C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000515156626 943537598 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367.755 3.677 20 5 FHBDRN O=C(Nc1ccc(OCC(F)(F)F)c(Cl)c1)c1cc([N+](=O)[O-])c[nH]1 ZINC000504284985 943582446 /nfs/dbraw/zinc/58/24/46/943582446.db2.gz WWVLKQFGOLBNKX-UHFFFAOYSA-N 0 0 363.679 3.770 20 5 FHBDRN Cc1ccc(C)c(OCCC(=O)N2c3ccc([N+](=O)[O-])cc3C[C@H]2C)c1 ZINC000504327895 943596158 /nfs/dbraw/zinc/59/61/58/943596158.db2.gz ALEQWHFACAPTNS-OAHLLOKOSA-N 0 0 354.406 3.958 20 5 FHBDRN O=c1[nH]nc(SCc2c(F)cccc2[N+](=O)[O-])n1CCc1ccccc1 ZINC000504495371 943639406 /nfs/dbraw/zinc/63/94/06/943639406.db2.gz DPZATGNXTUMWNX-UHFFFAOYSA-N 0 0 374.397 3.566 20 5 FHBDRN CC(C)(COCc1ccccc1)NC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000504480349 943641334 /nfs/dbraw/zinc/64/13/34/943641334.db2.gz NEHACLVQSAFRSW-UHFFFAOYSA-N 0 0 367.405 3.801 20 5 FHBDRN O=[N+]([O-])c1cccc(F)c1CSc1nncn1CCc1cccs1 ZINC000504503659 943647758 /nfs/dbraw/zinc/64/77/58/943647758.db2.gz UGRBVWYSMOAKEU-UHFFFAOYSA-N 0 0 364.427 3.922 20 5 FHBDRN CCCSc1nc(Cl)c([N+](=O)[O-])c(NC2(C3CCOCC3)CC2)n1 ZINC001167744137 943648664 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FHBDRN CCC(CC)(OC)c1noc(CCOc2ccc(Cl)cc2[N+](=O)[O-])n1 ZINC000584832056 943728619 /nfs/dbraw/zinc/72/86/19/943728619.db2.gz SPMHJFYNXRFSOU-UHFFFAOYSA-N 0 0 369.805 3.914 20 5 FHBDRN CCCC[C@@H]([NH2+]Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1)C(=O)[O-] ZINC000417586054 943731711 /nfs/dbraw/zinc/73/17/11/943731711.db2.gz ALKFZFMPGMACGI-OAHLLOKOSA-N 0 0 362.382 3.596 20 5 FHBDRN Cc1cc(OC[C@@H](O)COCc2cccs2)c(Cl)cc1[N+](=O)[O-] ZINC000504681431 943742364 /nfs/dbraw/zinc/74/23/64/943742364.db2.gz XXFYIGDYDSMZDH-NSHDSACASA-N 0 0 357.815 3.575 20 5 FHBDRN CCOc1ccccc1CCNC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000431955523 943743337 /nfs/dbraw/zinc/74/33/37/943743337.db2.gz RDPKFBFMWPMPSO-UHFFFAOYSA-N 0 0 371.437 3.771 20 5 FHBDRN C[C@@H]([NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1)[C@@H](C)C(=O)[O-] ZINC000417619854 943755332 /nfs/dbraw/zinc/75/53/32/943755332.db2.gz ZSEZUGSOTXSAFV-ZIAGYGMSSA-N 0 0 357.410 3.562 20 5 FHBDRN O=C([O-])[C@@H](CC1CC1)[NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000417620316 943755927 /nfs/dbraw/zinc/75/59/27/943755927.db2.gz JCRTYDUYHAHMQO-MRXNPFEDSA-N 0 0 374.368 3.869 20 5 FHBDRN CSc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc2c(c1)CCCC(=O)N2 ZINC001125910423 943758304 /nfs/dbraw/zinc/75/83/04/943758304.db2.gz IHVXMTVSAIOTED-UHFFFAOYSA-N 0 0 371.418 3.844 20 5 FHBDRN Cc1c(CS(=O)(=O)C2CCC(C(F)(F)F)CC2)cccc1[N+](=O)[O-] ZINC000424211762 943775217 /nfs/dbraw/zinc/77/52/17/943775217.db2.gz YLAQUNLIOOYJFH-UHFFFAOYSA-N 0 0 365.373 3.939 20 5 FHBDRN COc1cc(CCC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)ccc1Cl ZINC000126548973 943775645 /nfs/dbraw/zinc/77/56/45/943775645.db2.gz CSPBFUITRGERRR-UHFFFAOYSA-N 0 0 374.824 3.774 20 5 FHBDRN Cc1cc(OCC(=O)Nc2cc(C(F)(F)F)ccc2O)ccc1[N+](=O)[O-] ZINC000435797810 943775829 /nfs/dbraw/zinc/77/58/29/943775829.db2.gz FMVXTODYVVJJSZ-UHFFFAOYSA-N 0 0 370.283 3.645 20 5 FHBDRN Cn1cc(C(=O)NC[C@H]2CCC[C@H]2C2CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000412484589 943777888 /nfs/dbraw/zinc/77/78/88/943777888.db2.gz XKJXFMWJRZQTDP-WBVHZDCISA-N 0 0 368.437 3.551 20 5 FHBDRN O=c1c(Cl)cc([N+](=O)[O-])cn1Cc1nc(C2CCCCC2)cs1 ZINC000435800500 943778707 /nfs/dbraw/zinc/77/87/07/943778707.db2.gz QNSUCSVQRVCIFW-UHFFFAOYSA-N 0 0 353.831 3.962 20 5 FHBDRN O=C(NCc1ccc(OCC(F)(F)F)cc1)c1csc([N+](=O)[O-])c1 ZINC000515296762 943781085 /nfs/dbraw/zinc/78/10/85/943781085.db2.gz NFELINJAHPMHHI-UHFFFAOYSA-N 0 0 360.313 3.527 20 5 FHBDRN C[C@H](CC(C)(C)[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)C(=O)[O-] ZINC000417640470 943789904 /nfs/dbraw/zinc/78/99/04/943789904.db2.gz YJWOEIBTOUPMAU-LLVKDONJSA-N 0 0 363.439 3.697 20 5 FHBDRN Cc1csc(CCC(=O)N2CCS[C@@H]2c2ccc([N+](=O)[O-])cc2)n1 ZINC000435820430 943794027 /nfs/dbraw/zinc/79/40/27/943794027.db2.gz XATOCZVKWAOAOV-MRXNPFEDSA-N 0 0 363.464 3.567 20 5 FHBDRN COc1cccc(C(=O)N[C@H](C2CCCCC2)C(F)(F)F)c1[N+](=O)[O-] ZINC000435825958 943797031 /nfs/dbraw/zinc/79/70/31/943797031.db2.gz MOVXZCPCYJAXOK-CQSZACIVSA-N 0 0 360.332 3.844 20 5 FHBDRN O=C(NCc1cccs1)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000435825438 943797892 /nfs/dbraw/zinc/79/78/92/943797892.db2.gz HYHVUZUGAQDAJD-UHFFFAOYSA-N 0 0 352.390 3.812 20 5 FHBDRN O=[N+]([O-])c1cc2c(ncnc2NCCc2cc(F)c(F)c(F)c2)s1 ZINC000515319600 943799443 /nfs/dbraw/zinc/79/94/43/943799443.db2.gz LTHVBZJLWSMPRD-UHFFFAOYSA-N 0 0 354.313 3.671 20 5 FHBDRN CCCN(C(=O)c1cccc(OC)c1[N+](=O)[O-])[C@H]1C[C@@H](OCC)C1(C)C ZINC000435862214 943801164 /nfs/dbraw/zinc/80/11/64/943801164.db2.gz MRMVTDLSOXIEEP-JKSUJKDBSA-N 0 0 364.442 3.659 20 5 FHBDRN CC(C)C[C@@H]1C[C@@H](NC(=O)c2c([N+](=O)[O-])cccc2C(F)(F)F)CCO1 ZINC000515332766 943802106 /nfs/dbraw/zinc/80/21/06/943802106.db2.gz RDKWOGNCHQQWCV-NWDGAFQWSA-N 0 0 374.359 3.937 20 5 FHBDRN CCOc1cccc(/C=C/C(=O)N2CCCc3ccc([N+](=O)[O-])cc32)c1 ZINC001125911356 943807752 /nfs/dbraw/zinc/80/77/52/943807752.db2.gz MKEIPVTWZZHFDD-DHZHZOJOSA-N 0 0 352.390 3.986 20 5 FHBDRN O=C([O-])C[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000417670937 943813259 /nfs/dbraw/zinc/81/32/59/943813259.db2.gz PEFUYEUOMVQMTB-GUYCJALGSA-N 0 0 358.394 3.978 20 5 FHBDRN O=C([O-])CC[C@H]1CCCC[N@@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000424266183 943814375 /nfs/dbraw/zinc/81/43/75/943814375.db2.gz WOUKSZQOGJSENU-OAHLLOKOSA-N 0 0 373.409 3.512 20 5 FHBDRN CCOC(=O)c1cc(C(=O)N(CC(C)C)C2CCCC2)cc([N+](=O)[O-])c1 ZINC000515370852 943816274 /nfs/dbraw/zinc/81/62/74/943816274.db2.gz FWXBMOJPTRFEIE-UHFFFAOYSA-N 0 0 362.426 3.812 20 5 FHBDRN O=c1cc(CSc2nc3ccc([N+](=O)[O-])cc3s2)nc2ccccn12 ZINC000014756638 943829483 /nfs/dbraw/zinc/82/94/83/943829483.db2.gz GVWNDBULMGNSIG-UHFFFAOYSA-N 0 0 370.415 3.505 20 5 FHBDRN Cc1ccc(-c2nc(NC(=O)c3ccc([N+](=O)[O-])n3C)sc2C)s1 ZINC000504825590 943830291 /nfs/dbraw/zinc/83/02/91/943830291.db2.gz KWLGXYSHBSEKFN-UHFFFAOYSA-N 0 0 362.436 3.987 20 5 FHBDRN COC1(CNC(=O)c2cc([N+](=O)[O-])ccc2NCc2ccccc2)CCC1 ZINC000504828616 943834298 /nfs/dbraw/zinc/83/42/98/943834298.db2.gz OHIGVIXNDDIPNS-UHFFFAOYSA-N 0 0 369.421 3.506 20 5 FHBDRN Cn1ccnc1[C@H](N[C@@H]1C[C@]1(F)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000424325589 943845155 /nfs/dbraw/zinc/84/51/55/943845155.db2.gz NYSAGPYVRYHBMP-GGPKGHCWSA-N 0 0 366.396 3.645 20 5 FHBDRN C[C@@H](NC(=O)c1csc([N+](=O)[O-])c1)c1nc2ccccc2n1C(F)F ZINC000515401471 943850697 /nfs/dbraw/zinc/85/06/97/943850697.db2.gz WQVRQOGVYIBTGU-MRVPVSSYSA-N 0 0 366.349 3.892 20 5 FHBDRN C[C@H](c1noc(-c2ccc(N3CCCC3)c([N+](=O)[O-])c2)n1)c1nccs1 ZINC000424359433 943864095 /nfs/dbraw/zinc/86/40/95/943864095.db2.gz CSKFZMIFPFOCGW-LLVKDONJSA-N 0 0 371.422 3.853 20 5 FHBDRN CC[C@H](Cc1ccccc1C)c1nc(-c2c([N+](=O)[O-])nc(C)n2C)no1 ZINC000424363040 943868063 /nfs/dbraw/zinc/86/80/63/943868063.db2.gz YRGOLHNFEMCNFC-CYBMUJFWSA-N 0 0 355.398 3.731 20 5 FHBDRN C[C@@H](c1noc(-c2ccc(NC3CC3)c([N+](=O)[O-])c2)n1)c1nccs1 ZINC000424363948 943877835 /nfs/dbraw/zinc/87/78/35/943877835.db2.gz PLSARTWYXBPIIA-VIFPVBQESA-N 0 0 357.395 3.827 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)N1CCC(Cc2ccc(F)cc2)CC1 ZINC000504889861 943887874 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Cc1ccc([C@H](C)NC(=O)N[C@@H]2CCCc3cc(N)ccc32)cc1[N+](=O)[O-] ZINC000417849664 943904037 /nfs/dbraw/zinc/90/40/37/943904037.db2.gz LOJLZPDOLJULLS-SCLBCKFNSA-N 0 0 368.437 3.923 20 5 FHBDRN COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N2CC[C@@H](C)C2)cc1 ZINC000504936942 943916977 /nfs/dbraw/zinc/91/69/77/943916977.db2.gz OSVDLVRXVASRRD-CYBMUJFWSA-N 0 0 356.378 3.878 20 5 FHBDRN COc1cccc(C(=O)NCCCCc2ccc(F)c(F)c2)c1[N+](=O)[O-] ZINC000435994303 943919679 /nfs/dbraw/zinc/91/96/79/943919679.db2.gz KUXKXQNNUOSUTB-UHFFFAOYSA-N 0 0 364.348 3.634 20 5 FHBDRN CCCOc1ccc([C@H](C)Nc2ccc(C(N)=O)cc2[N+](=O)[O-])cc1OC ZINC000515480659 943920423 /nfs/dbraw/zinc/92/04/23/943920423.db2.gz UWPKYVFMCRZBLL-LBPRGKRZSA-N 0 0 373.409 3.664 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1F)N1CCC(Cc2ccc(F)cc2)CC1 ZINC000504953251 943933160 /nfs/dbraw/zinc/93/31/60/943933160.db2.gz IBMGBOWSUGLJGA-UHFFFAOYSA-N 0 0 360.360 3.968 20 5 FHBDRN Cn1c2ccccc2nc1[C@@H]1CCCN1CCOc1ccc([N+](=O)[O-])cc1 ZINC000437592481 943935825 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FHBDRN COCc1ccc([C@@H]2CCCN2C(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)o1 ZINC000515506166 943956196 /nfs/dbraw/zinc/95/61/96/943956196.db2.gz CMPWOFUAQCQEJF-GUYCJALGSA-N 0 0 358.394 3.801 20 5 FHBDRN CCN(C(=O)Cc1c(F)cc([N+](=O)[O-])cc1F)c1ccc(F)c(F)c1 ZINC000566524028 943962365 /nfs/dbraw/zinc/96/23/65/943962365.db2.gz FVHHIUFYLXXWBP-UHFFFAOYSA-N 0 0 356.275 3.747 20 5 FHBDRN COc1ccc2c(c1)CCCCN2C(=O)c1cccc(OC)c1[N+](=O)[O-] ZINC000436039658 943964690 /nfs/dbraw/zinc/96/46/90/943964690.db2.gz PEEXXIZFBACQNE-UHFFFAOYSA-N 0 0 356.378 3.595 20 5 FHBDRN C[C@H]1C[C@H]1C(=O)Nc1cccc(-c2nc(-c3cccc([N+](=O)[O-])c3)no2)c1 ZINC000505012791 943968458 /nfs/dbraw/zinc/96/84/58/943968458.db2.gz GTPABHOQWATRSX-MEDUHNTESA-N 0 0 364.361 3.906 20 5 FHBDRN CCOc1ccc(C(=O)CCc2nc(-c3cccc([N+](=O)[O-])c3)no2)cc1 ZINC000505012851 943968465 /nfs/dbraw/zinc/96/84/65/943968465.db2.gz HNPGXKKYCPQMME-UHFFFAOYSA-N 0 0 367.361 3.859 20 5 FHBDRN CC[C@H]1CCCC[C@@H]1NC(=O)CSCc1ccc(OC)c([N+](=O)[O-])c1 ZINC000027705656 943968435 /nfs/dbraw/zinc/96/84/35/943968435.db2.gz BQMGSNLBYLXHOW-GJZGRUSLSA-N 0 0 366.483 3.922 20 5 FHBDRN CC(C)(C)[C@H](NS(=O)(=O)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000515524475 943976912 /nfs/dbraw/zinc/97/69/12/943976912.db2.gz GZZDYGMLSOPCLR-MRXNPFEDSA-N 0 0 366.414 3.800 20 5 FHBDRN C[C@]1(NC(=O)CCOc2ccccc2[N+](=O)[O-])CCCc2ccccc21 ZINC000506079757 943977564 /nfs/dbraw/zinc/97/75/64/943977564.db2.gz MHEZMCDAZAOJII-FQEVSTJZSA-N 0 0 354.406 3.732 20 5 FHBDRN CSc1ccc(CCNC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000437631869 943978167 /nfs/dbraw/zinc/97/81/67/943978167.db2.gz DPVBNHYSVLJJEJ-ZDUSSCGKSA-N 0 0 359.451 3.920 20 5 FHBDRN Cc1cc(NCCCNc2ccc(C(F)(F)F)cn2)ccc1[N+](=O)[O-] ZINC000515546792 943981808 /nfs/dbraw/zinc/98/18/08/943981808.db2.gz BPVJSYZYHITLRV-UHFFFAOYSA-N 0 0 354.332 3.653 20 5 FHBDRN Cn1c(SCCOc2ccccc2[N+](=O)[O-])nnc1-c1ccccc1 ZINC000053417293 943986085 /nfs/dbraw/zinc/98/60/85/943986085.db2.gz MTYLDROPBMFJLX-UHFFFAOYSA-N 0 0 356.407 3.561 20 5 FHBDRN C[C@H]1CN(C(=O)CCc2cc(F)ccc2[N+](=O)[O-])c2ccc(F)cc2O1 ZINC001126456738 943986810 /nfs/dbraw/zinc/98/68/10/943986810.db2.gz AFCPEJUSLFVTSR-NSHDSACASA-N 0 0 362.332 3.620 20 5 FHBDRN Cc1cnc(NC(=O)c2cccc3c(=O)c4cccc(F)c4[nH]c23)s1 ZINC000436069366 943989449 /nfs/dbraw/zinc/98/94/49/943989449.db2.gz KTSXOXWJBGMVAP-UHFFFAOYSA-N 0 0 353.378 3.838 20 5 FHBDRN O=C(Nc1cccc2c1OCCO2)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000436069063 943989761 /nfs/dbraw/zinc/98/97/61/943989761.db2.gz QUMDVXVBXGUWEV-UHFFFAOYSA-N 0 0 372.380 3.705 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N[C@@]2(c3ccc(Cl)cc3)C[C@@H]2C)c1[N+](=O)[O-] ZINC000505750093 943996249 /nfs/dbraw/zinc/99/62/49/943996249.db2.gz OJROSGLIOFDWBP-BTDLBPIBSA-N 0 0 362.817 3.760 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1CN(Cc1ccccn1)C1CC1 ZINC000425458852 943998214 /nfs/dbraw/zinc/99/82/14/943998214.db2.gz NMPHXSNITRNSDH-UHFFFAOYSA-N 0 0 362.227 3.917 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N1CCO[C@H](c2ccccc2C)C1 ZINC000123045740 944003664 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Cc1csc(N2CCC(c3nc(-c4ccc([N+](=O)[O-])cc4)no3)CC2)n1 ZINC000505095224 944035827 /nfs/dbraw/zinc/03/58/27/944035827.db2.gz UONQITMTERMLLM-UHFFFAOYSA-N 0 0 371.422 3.794 20 5 FHBDRN Cc1ccc([C@@H]2C[C@@H](C)CCN2S(=O)(=O)c2ccc([N+](=O)[O-])cc2)o1 ZINC000437702752 944045620 /nfs/dbraw/zinc/04/56/20/944045620.db2.gz NLOUAOWLOGOATF-LRDDRELGSA-N 0 0 364.423 3.658 20 5 FHBDRN O=C(CCN(CC1CCC1)CC(F)(F)F)Nc1ccccc1[N+](=O)[O-] ZINC000500070859 944046904 /nfs/dbraw/zinc/04/69/04/944046904.db2.gz RQHHGDLMXLTHKZ-UHFFFAOYSA-N 0 0 359.348 3.588 20 5 FHBDRN C/C=C\c1ccc(OCC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c(OC)c1 ZINC000053453420 944055015 /nfs/dbraw/zinc/05/50/15/944055015.db2.gz WAAQYEYGSCPQSC-SDQPKGBYSA-N 0 0 370.405 3.893 20 5 FHBDRN C/C=C\c1ccc(OCC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)c(OC)c1 ZINC000053453422 944055224 /nfs/dbraw/zinc/05/52/24/944055224.db2.gz WAAQYEYGSCPQSC-KXQLTZBTSA-N 0 0 370.405 3.893 20 5 FHBDRN COC(=O)C[C@@H](NC(=O)Nc1cc([N+](=O)[O-])ccc1C)C1CCCCC1 ZINC000437725484 944056653 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CC(C)CCSc1ccc(C(=O)N2CCOC[C@H]2C)cc1[N+](=O)[O-] ZINC000436151408 944074491 /nfs/dbraw/zinc/07/44/91/944074491.db2.gz LUVCEXCMGIJPLK-CYBMUJFWSA-N 0 0 352.456 3.594 20 5 FHBDRN CC(C)[C@]1(CO)CCCN(Cc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000425478213 944076339 /nfs/dbraw/zinc/07/63/39/944076339.db2.gz MJNNKROBAVQWKE-MRXNPFEDSA-N 0 0 371.275 3.588 20 5 FHBDRN CC[C@H](C)[C@H](NC(=O)CSc1ccc([N+](=O)[O-])cc1)C(F)(F)F ZINC000436185144 944079475 /nfs/dbraw/zinc/07/94/75/944079475.db2.gz VYPULCZLBIYZED-ZANVPECISA-N 0 0 350.362 3.780 20 5 FHBDRN Cc1cc(N[C@@H]2CCC[N@H+](Cc3ccccc3)C2)cc(C(=O)[O-])c1[N+](=O)[O-] ZINC000515655654 944082155 /nfs/dbraw/zinc/08/21/55/944082155.db2.gz LNSJRXXRZMWOSC-MRXNPFEDSA-N 0 0 369.421 3.678 20 5 FHBDRN O=C1[C@@H](Nc2cccc([N+](=O)[O-])c2)CCN1c1ccc(C(F)(F)F)cc1 ZINC000505768816 944085697 /nfs/dbraw/zinc/08/56/97/944085697.db2.gz KLJFVYZHFSOSEY-HNNXBMFYSA-N 0 0 365.311 3.831 20 5 FHBDRN CC[C@H](C)[C@H](NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)C(F)(F)F ZINC000436178809 944091637 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CCc1nnc([C@@H](C)Sc2nnc(-c3ccc([N+](=O)[O-])cc3)n2CC)o1 ZINC000123670206 944402589 /nfs/dbraw/zinc/40/25/89/944402589.db2.gz OIQRDUFECHCXHA-SNVBAGLBSA-N 0 0 374.426 3.672 20 5 FHBDRN CCOCc1ccccc1CNC(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000105927051 944403420 /nfs/dbraw/zinc/40/34/20/944403420.db2.gz PSNRDEVJTLTRHK-AWEZNQCLSA-N 0 0 374.462 3.928 20 5 FHBDRN O=C(c1ccc(Cl)cc1[N+](=O)[O-])N1CCCN(c2ccccc2)CC1 ZINC000516003993 944408329 /nfs/dbraw/zinc/40/83/29/944408329.db2.gz GKQBHQJMMZBJGZ-UHFFFAOYSA-N 0 0 359.813 3.601 20 5 FHBDRN Cc1cc(F)c([N+](=O)[O-])cc1C(=O)NC[C@@H](C)Oc1ccc(Cl)cc1 ZINC001126448119 944416027 /nfs/dbraw/zinc/41/60/27/944416027.db2.gz TVYZDSLHOACSHC-LLVKDONJSA-N 0 0 366.776 3.893 20 5 FHBDRN Cc1ccc([C@@H](C)N(C)C(=O)NCCOc2ccc([N+](=O)[O-])cc2)cc1 ZINC000517590412 944420916 /nfs/dbraw/zinc/42/09/16/944420916.db2.gz WTBOQSHAUZBYMP-OAHLLOKOSA-N 0 0 357.410 3.685 20 5 FHBDRN Cc1ccc([C@@H](C)N(C)C(=O)NCCOc2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000517590494 944421272 /nfs/dbraw/zinc/42/12/72/944421272.db2.gz IRXWIRWWXXHQEB-MRXNPFEDSA-N 0 0 371.437 3.993 20 5 FHBDRN Cc1ccccc1[C@@H]1CCCN1C(=O)NCCOc1ccc([N+](=O)[O-])cc1 ZINC000517590191 944421307 /nfs/dbraw/zinc/42/13/07/944421307.db2.gz NYCXVSQJNHGKGY-IBGZPJMESA-N 0 0 369.421 3.829 20 5 FHBDRN Cc1ccc([C@@H]2CCCN2C(=O)NCCOc2ccc([N+](=O)[O-])cc2)cc1 ZINC000517589671 944421348 /nfs/dbraw/zinc/42/13/48/944421348.db2.gz NCLAGWZUMVWTDJ-IBGZPJMESA-N 0 0 369.421 3.829 20 5 FHBDRN O=C(c1cc2c(cc1[N+](=O)[O-])OCO2)N(Cc1ccccc1)CC1CCC1 ZINC000518487739 944432349 /nfs/dbraw/zinc/43/23/49/944432349.db2.gz YLVKGVUUOPFUGE-UHFFFAOYSA-N 0 0 368.389 3.766 20 5 FHBDRN Cc1cc(NC(=O)N[C@@H](C)c2ccc(-n3cccn3)cc2)ccc1[N+](=O)[O-] ZINC000473777031 944434110 /nfs/dbraw/zinc/43/41/10/944434110.db2.gz FWICAOQIEBKDGX-AWEZNQCLSA-N 0 0 365.393 3.972 20 5 FHBDRN C[C@@H]1CO[C@H](c2ccccc2)CN1C(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000110314855 944444084 /nfs/dbraw/zinc/44/40/84/944444084.db2.gz MKFICBCQTFRYGJ-WBMJQRKESA-N 0 0 360.797 3.850 20 5 FHBDRN COC(=O)/C=C/c1ccc(OCc2c(F)cccc2[N+](=O)[O-])c(OC)c1 ZINC000728791060 944444388 /nfs/dbraw/zinc/44/43/88/944444388.db2.gz NWEALXJBTCVOQG-VQHVLOKHSA-N 0 0 361.325 3.508 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N2C[C@H](c3ccccc3)OC[C@H]2C)c1 ZINC000110315559 944444769 /nfs/dbraw/zinc/44/47/69/944444769.db2.gz CDRXXKZREVLGPD-FZKQIMNGSA-N 0 0 372.446 3.919 20 5 FHBDRN O=C(OCc1cc(Cl)c2c(c1)OCCCO2)c1ccc([N+](=O)[O-])cc1 ZINC000017484005 944447120 /nfs/dbraw/zinc/44/71/20/944447120.db2.gz WHTBGZKMVNFWDM-UHFFFAOYSA-N 0 0 363.753 3.767 20 5 FHBDRN O=[N+]([O-])c1ccn(C2CCN(Cc3ccc(F)c(C(F)(F)F)c3)CC2)n1 ZINC000425970651 944455069 /nfs/dbraw/zinc/45/50/69/944455069.db2.gz HUKPBFAZXTYJIT-UHFFFAOYSA-N 0 0 372.322 3.786 20 5 FHBDRN Cc1cc(NCCc2nc(-c3ccccc3)n[nH]2)c2cccc([N+](=O)[O-])c2n1 ZINC000517636801 944458441 /nfs/dbraw/zinc/45/84/41/944458441.db2.gz QLJVACUFWPDKHY-UHFFFAOYSA-N 0 0 374.404 3.891 20 5 FHBDRN Cc1ccc(-c2noc(-c3coc(C4CCOCC4)n3)n2)cc1[N+](=O)[O-] ZINC000566643867 944458740 /nfs/dbraw/zinc/45/87/40/944458740.db2.gz PNDJHTCRMHDTOM-UHFFFAOYSA-N 0 0 356.338 3.502 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CC[C@@H](C)C[C@@H]1c1ccco1 ZINC000439235717 944466942 /nfs/dbraw/zinc/46/69/42/944466942.db2.gz QEUNTTHJBAARIK-IUODEOHRSA-N 0 0 364.423 3.658 20 5 FHBDRN C[C@H]1CCCC[C@@H]1NC(=O)COc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000518522483 944468471 /nfs/dbraw/zinc/46/84/71/944468471.db2.gz ASZANGQCAJBBNY-GWCFXTLKSA-N 0 0 360.332 3.687 20 5 FHBDRN C[C@H]1CC[C@@H](COc2c3cc(Br)ccc3ncc2[N+](=O)[O-])O1 ZINC000473789500 944469887 /nfs/dbraw/zinc/46/98/87/944469887.db2.gz YNJWVIKSIUEHQG-ONGXEEELSA-N 0 0 367.199 3.852 20 5 FHBDRN CO[C@H]1Cc2ccccc2N(C(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)C1 ZINC000500308371 944472119 /nfs/dbraw/zinc/47/21/19/944472119.db2.gz NYQDFSKMBMHNLK-BBRMVZONSA-N 0 0 372.446 3.680 20 5 FHBDRN Cc1nc(C(=O)OCCOc2cccc([N+](=O)[O-])c2)c(-c2ccccc2)o1 ZINC000759832382 944475285 /nfs/dbraw/zinc/47/52/85/944475285.db2.gz WYRQCIFFAGPKKG-UHFFFAOYSA-N 0 0 368.345 3.794 20 5 FHBDRN Cc1ccc(C)c(N(C(C)C)S(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC000517645953 944478003 /nfs/dbraw/zinc/47/80/03/944478003.db2.gz OUDXODGWSNJOIH-UHFFFAOYSA-N 0 0 362.451 3.956 20 5 FHBDRN Cc1cc(C(=O)N(Cc2ccccc2)CC2CCOCC2)cc([N+](=O)[O-])c1 ZINC000110391986 944478235 /nfs/dbraw/zinc/47/82/35/944478235.db2.gz BEGPDCIFUSSMMO-UHFFFAOYSA-N 0 0 368.433 3.972 20 5 FHBDRN COc1ccc2c(c1)CCN(C(=O)Nc1cc([N+](=O)[O-])ccc1C)CC2 ZINC000439262643 944478673 /nfs/dbraw/zinc/47/86/73/944478673.db2.gz POHDULINTQBXDM-UHFFFAOYSA-N 0 0 355.394 3.545 20 5 FHBDRN CCCN(C(=O)CCn1cc([N+](=O)[O-])nc1C)c1ccc(Cl)cc1 ZINC000110417398 944482811 /nfs/dbraw/zinc/48/28/11/944482811.db2.gz ZLJOHMULTWKLGB-UHFFFAOYSA-N 0 0 350.806 3.586 20 5 FHBDRN CNc1ccc(C(=O)NCCc2ccc(OCC(C)C)cc2)cc1[N+](=O)[O-] ZINC000518547407 944483741 /nfs/dbraw/zinc/48/37/41/944483741.db2.gz DXGHXGZMCCRKJP-UHFFFAOYSA-N 0 0 371.437 3.644 20 5 FHBDRN CO[C@H](c1ccc(F)cc1)[C@H](C)NC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000517662598 944485962 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FHBDRN COCC1(CNC(=O)c2cc(SC)ccc2[N+](=O)[O-])CCCCC1 ZINC000516122549 944506334 /nfs/dbraw/zinc/50/63/34/944506334.db2.gz ZCXWOGZTVDZHSW-UHFFFAOYSA-N 0 0 352.456 3.643 20 5 FHBDRN CN(Cc1cscn1)Cc1cccc(NC(=O)c2ccc([N+](=O)[O-])o2)c1 ZINC000110494224 944509420 /nfs/dbraw/zinc/50/94/20/944509420.db2.gz GQTCRXIELFZUQW-UHFFFAOYSA-N 0 0 372.406 3.529 20 5 FHBDRN CSc1ccc(CCC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC001270115739 944524870 /nfs/dbraw/zinc/52/48/70/944524870.db2.gz KLSJDMKNZRMKCI-UHFFFAOYSA-N 0 0 358.463 3.950 20 5 FHBDRN C[C@H]1CO[C@H](c2ccccc2Cl)CN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000110518990 944527823 /nfs/dbraw/zinc/52/78/23/944527823.db2.gz VGALHDUCTHVZQB-GWCFXTLKSA-N 0 0 366.826 3.912 20 5 FHBDRN COc1ccc(CC(=O)OCCCSc2ccccc2)cc1[N+](=O)[O-] ZINC000759844644 944534460 /nfs/dbraw/zinc/53/44/60/944534460.db2.gz WINYTJDPVKQMNX-UHFFFAOYSA-N 0 0 361.419 3.872 20 5 FHBDRN COc1ccc([C@H](C)NCc2cc(OC)c(F)cc2[N+](=O)[O-])cc1F ZINC000184299754 944534761 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CCOc1cc(N2CCC(OC[C@@H]3CCCCO3)CC2)ccc1[N+](=O)[O-] ZINC000426360205 944549559 /nfs/dbraw/zinc/54/95/59/944549559.db2.gz YZVGPIBAOLKMQY-KRWDZBQOSA-N 0 0 364.442 3.548 20 5 FHBDRN COc1cc(C(=O)Nc2ccc3c(c2)CC(C)(C)O3)cc([N+](=O)[O-])c1OC ZINC000469439604 944551700 /nfs/dbraw/zinc/55/17/00/944551700.db2.gz YGTNGPUOQVQEDS-UHFFFAOYSA-N 0 0 372.377 3.578 20 5 FHBDRN O=[N+]([O-])c1cnc2ccc(F)cc2c1N1CCc2nc(C3CC3)ncc2C1 ZINC000894758685 944562169 /nfs/dbraw/zinc/56/21/69/944562169.db2.gz LPNUCFYHLNKTFH-UHFFFAOYSA-N 0 0 365.368 3.512 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@H](C)COCc1ccccc1 ZINC000506556231 944563568 /nfs/dbraw/zinc/56/35/68/944563568.db2.gz SAMRHUHZPRGDMC-CQSZACIVSA-N 0 0 357.410 3.878 20 5 FHBDRN CC(C)(C)[C@H]1CCCN(C(=O)c2cc3c(cc2[N+](=O)[O-])OCCCO3)C1 ZINC001270340935 944565806 /nfs/dbraw/zinc/56/58/06/944565806.db2.gz FJWCJBOAZHSUGM-ZDUSSCGKSA-N 0 0 362.426 3.654 20 5 FHBDRN CCOc1c(Cl)cccc1CNCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000425993806 944565822 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3.929 20 5 FHBDRN CNc1ccc(C(=O)N[C@H](c2nccs2)c2ccccc2)cc1[N+](=O)[O-] ZINC000517765510 944584888 /nfs/dbraw/zinc/58/48/88/944584888.db2.gz DONYHZOYJBSTTA-INIZCTEOSA-N 0 0 368.418 3.612 20 5 FHBDRN Cc1ccccc1-c1nnc(Sc2nc3sccn3c2[N+](=O)[O-])o1 ZINC000008318923 944585982 /nfs/dbraw/zinc/58/59/82/944585982.db2.gz YABRHZIYCWKDCO-UHFFFAOYSA-N 0 0 359.392 3.814 20 5 FHBDRN C[C@@H](C(=O)N(C)Cc1ccccc1N1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000519576368 944586541 /nfs/dbraw/zinc/58/65/41/944586541.db2.gz TYSKHNJSTAOGGP-MRXNPFEDSA-N 0 0 367.449 3.957 20 5 FHBDRN Cc1ccc(C[C@H]2CCCN(C(=O)CNc3ccccc3[N+](=O)[O-])C2)cc1 ZINC000517768399 944587530 /nfs/dbraw/zinc/58/75/30/944587530.db2.gz AOVLPMATNPRYKM-GOSISDBHSA-N 0 0 367.449 3.796 20 5 FHBDRN Cn1cc([N+](=O)[O-])cc1C(=O)N1CCCC[C@H]1c1cc2ccccc2[nH]1 ZINC000518665733 944588025 /nfs/dbraw/zinc/58/80/25/944588025.db2.gz MMFIJHRDSQQJGM-KRWDZBQOSA-N 0 0 352.394 3.782 20 5 FHBDRN O=[N+]([O-])c1cncc(Cl)c1OCc1cc(Cl)c2c(c1)OCCO2 ZINC000506569050 944589835 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ZINC000190262475 944648069 /nfs/dbraw/zinc/64/80/69/944648069.db2.gz GYTXFOBTXISSJP-PXAZEXFGSA-N 0 0 372.446 3.975 20 5 FHBDRN C[C@H](Oc1ccc(-c2ccccc2)cc1[N+](=O)[O-])C(=O)NCC(F)(F)F ZINC000518723288 944649811 /nfs/dbraw/zinc/64/98/11/944649811.db2.gz LIDYZACBNJXYFX-NSHDSACASA-N 0 0 368.311 3.708 20 5 FHBDRN COc1cc(-c2noc(/C=C(\C)c3ccc([N+](=O)[O-])cc3)n2)ccc1O ZINC000436815625 944652405 /nfs/dbraw/zinc/65/24/05/944652405.db2.gz OZQMDKROFDJQRJ-PKNBQFBNSA-N 0 0 353.334 3.920 20 5 FHBDRN CN(CC(=O)NC[C@@H]1CCC[C@H](C(F)(F)F)C1)c1ccccc1[N+](=O)[O-] ZINC000438478179 944656602 /nfs/dbraw/zinc/65/66/02/944656602.db2.gz VQWFAKMKLZPIND-OLZOCXBDSA-N 0 0 373.375 3.516 20 5 FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N(C)C[C@@H]1CC=CCC1 ZINC000544128512 944689150 /nfs/dbraw/zinc/68/91/50/944689150.db2.gz UDBCIKSMGSJLMR-CQSZACIVSA-N 0 0 364.467 3.762 20 5 FHBDRN Cn1cc([N+](=O)[O-])cc1C(=O)N(Cc1ccc(F)cc1Cl)CC1CC1 ZINC000566753475 944690554 /nfs/dbraw/zinc/69/05/54/944690554.db2.gz 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CNc1ccc(C(=O)OCc2ncc(-c3ccc(F)cc3)o2)cc1[N+](=O)[O-] ZINC000017725041 944723429 /nfs/dbraw/zinc/72/34/29/944723429.db2.gz IUQHBCYISXYYNR-UHFFFAOYSA-N 0 0 371.324 3.788 20 5 FHBDRN O=C(Nc1cnc(CC2CC2)nc1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000500391789 944741984 /nfs/dbraw/zinc/74/19/84/944741984.db2.gz UFLIISNGNWERKE-UHFFFAOYSA-N 0 0 367.409 3.534 20 5 FHBDRN Cc1cccc2c1CC[C@H]2NS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000517868461 944744761 /nfs/dbraw/zinc/74/47/61/944744761.db2.gz SEXPDWACDGJGHD-OAHLLOKOSA-N 0 0 366.826 3.522 20 5 FHBDRN Cn1cc([C@H]2OCCC[C@@H]2Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)cn1 ZINC000509599008 944746099 /nfs/dbraw/zinc/74/60/99/944746099.db2.gz DSTHBNLAGKWFSR-DZGCQCFKSA-N 0 0 370.331 3.679 20 5 FHBDRN COc1ccc(NC(=O)CN2CCC[C@@H]2c2cccc(F)c2)c([N+](=O)[O-])c1 ZINC000053717739 944746367 /nfs/dbraw/zinc/74/63/67/944746367.db2.gz QXWDFVRWMCFMBD-QGZVFWFLSA-N 0 0 373.384 3.518 20 5 FHBDRN O=C(NCCOc1ccc([N+](=O)[O-])cc1)c1cc(Cl)cc(Cl)c1F ZINC001125945340 944756108 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366.417 3.926 20 5 FHBDRN CCc1csc(NC(=O)NCCCNc2ccc(C)cc2[N+](=O)[O-])n1 ZINC000438579973 944796336 /nfs/dbraw/zinc/79/63/36/944796336.db2.gz FQOIIOASRQYXKR-UHFFFAOYSA-N 0 0 363.443 3.546 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NS(=O)(=O)Cc1cccc(Cl)c1 ZINC000516384402 944801656 /nfs/dbraw/zinc/80/16/56/944801656.db2.gz LIXYEDXPIZBCQF-UHFFFAOYSA-N 0 0 354.815 3.807 20 5 FHBDRN C[C@@H](C(=O)NCCc1nc2ccccc2s1)c1ccc([N+](=O)[O-])cc1F ZINC000541584414 944808542 /nfs/dbraw/zinc/80/85/42/944808542.db2.gz YRMHLLTWTCGUQK-LLVKDONJSA-N 0 0 373.409 3.806 20 5 FHBDRN CN(CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)Cc1ccc(F)cc1F ZINC000024946256 944823166 /nfs/dbraw/zinc/82/31/66/944823166.db2.gz JXRSBEWODXLZFK-UHFFFAOYSA-N 0 0 369.755 3.597 20 5 FHBDRN CC(C)CCOc1ccccc1CNC(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000506633741 944824673 /nfs/dbraw/zinc/82/46/73/944824673.db2.gz KSVJEFIZWMAASS-UHFFFAOYSA-N 0 0 356.422 3.879 20 5 FHBDRN CC(C)[C@@H](CC(F)(F)F)NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000438605930 944843133 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CC(C)(C(=O)Nc1cc(-c2ccccc2)on1)c1ccc([N+](=O)[O-])cc1 ZINC000426835256 944872203 /nfs/dbraw/zinc/87/22/03/944872203.db2.gz QMGGHBWHTDFVRR-UHFFFAOYSA-N 0 0 351.362 3.588 20 5 FHBDRN O=C(N[C@@H]1CCCc2occc21)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000120720457 944875805 /nfs/dbraw/zinc/87/58/05/944875805.db2.gz DTQJMJQVHVGPRG-MRXNPFEDSA-N 0 0 355.394 3.939 20 5 FHBDRN O=[N+]([O-])c1ccc(OCc2cn3cccnc3n2)c(Cc2ccccc2)c1 ZINC000566810247 944879563 /nfs/dbraw/zinc/87/95/63/944879563.db2.gz AXSNTOLQGOVHRD-UHFFFAOYSA-N 0 0 360.373 3.807 20 5 FHBDRN O=C(Nc1cc(Br)ccc1F)c1ccc([N+](=O)[O-])cc1F ZINC000110647842 944881262 /nfs/dbraw/zinc/88/12/62/944881262.db2.gz KSHYQZLPZFYATJ-UHFFFAOYSA-N 0 0 357.110 3.888 20 5 FHBDRN CC(C)CCOc1ccccc1CNc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000507035788 944883274 /nfs/dbraw/zinc/88/32/74/944883274.db2.gz JKQLYXNICCUQPB-UHFFFAOYSA-N 0 0 357.410 3.731 20 5 FHBDRN O=C(Nc1nc(C(F)(F)F)c[nH]1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000507022634 944889168 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3.839 20 5 FHBDRN CC(C)(C)Oc1cccc(CN2CCOc3ccc([N+](=O)[O-])cc3C2)n1 ZINC000519675129 945626184 /nfs/dbraw/zinc/62/61/84/945626184.db2.gz WLZYRBNAGADSCW-UHFFFAOYSA-N 0 0 357.410 3.562 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H](C)c1ccc(-n2ccnn2)cc1 ZINC000181745303 945635358 /nfs/dbraw/zinc/63/53/58/945635358.db2.gz HHLJUFBTEZPEBW-LSDHHAIUSA-N 0 0 351.410 3.896 20 5 FHBDRN CC(=O)c1c(C)cccc1NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000125150427 945650641 /nfs/dbraw/zinc/65/06/41/945650641.db2.gz RCBOTKMGEPJQKI-UHFFFAOYSA-N 0 0 352.350 3.768 20 5 FHBDRN O=[N+]([O-])c1cc(C(F)(F)F)ccc1NCc1cccnc1-n1cccn1 ZINC000024660718 945660721 /nfs/dbraw/zinc/66/07/21/945660721.db2.gz OIZPBZVDMZKIHI-UHFFFAOYSA-N 0 0 363.299 3.806 20 5 FHBDRN CCCCCc1nnc(NC(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)s1 ZINC000519722461 945674280 /nfs/dbraw/zinc/67/42/80/945674280.db2.gz HMBFLTLFLPVPKL-UHFFFAOYSA-N 0 0 370.381 3.638 20 5 FHBDRN Cc1nc(NC(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)sc1C ZINC000519720809 945674297 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FHBDRN O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)N(CC1CCCCC1)C1CC1 ZINC000519795009 945750107 /nfs/dbraw/zinc/75/01/07/945750107.db2.gz UVLMDFMYCDDXIL-UHFFFAOYSA-N 0 0 352.381 3.987 20 5 FHBDRN COc1ccc(OC(F)F)c(NC(=O)c2ccc([N+](=O)[O-])c(C)c2)c1 ZINC000044587196 945754909 /nfs/dbraw/zinc/75/49/09/945754909.db2.gz CUYQPMKOGBENPI-UHFFFAOYSA-N 0 0 352.293 3.766 20 5 FHBDRN O=C(Nc1ccc(OC(=O)c2ccc([N+](=O)[O-])o2)cc1)c1cccs1 ZINC000027383158 945756376 /nfs/dbraw/zinc/75/63/76/945756376.db2.gz NVOFIRBNKPLMSU-UHFFFAOYSA-N 0 0 358.331 3.721 20 5 FHBDRN O=C(Oc1ccc(NC(=O)c2ccccc2)cc1)c1ccc([N+](=O)[O-])o1 ZINC000027383154 945756650 /nfs/dbraw/zinc/75/66/50/945756650.db2.gz YWDKGPRXDOCJOY-UHFFFAOYSA-N 0 0 352.302 3.659 20 5 FHBDRN CC(C)c1cccc2c1CCN(C(=O)COc1cccc([N+](=O)[O-])c1)C2 ZINC000475053460 945759420 /nfs/dbraw/zinc/75/94/20/945759420.db2.gz MGIRGUXKXPQKLG-UHFFFAOYSA-N 0 0 354.406 3.682 20 5 FHBDRN CC(C)(CNC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F)c1cccs1 ZINC000519782774 945759941 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CC[C@H](NC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1)c1ccncc1 ZINC000444084754 945831254 /nfs/dbraw/zinc/83/12/54/945831254.db2.gz LFHZBZOWUOTKFM-SFHVURJKSA-N 0 0 357.413 3.957 20 5 FHBDRN CCn1ccnc1[C@H]1CCCCN1C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000281734553 945831991 /nfs/dbraw/zinc/83/19/91/945831991.db2.gz IYGDGUUGSADBLQ-MRXNPFEDSA-N 0 0 367.409 3.660 20 5 FHBDRN O=C(c1cc(F)cc2c(=O)c3cccc(F)c3[nH]c12)N1C[C@@H]2CCC[C@@H]21 ZINC000444091388 945845536 /nfs/dbraw/zinc/84/55/36/945845536.db2.gz WVTJGOKZJPNNQZ-QFYYESIMSA-N 0 0 354.356 3.584 20 5 FHBDRN O=C(c1c(F)cccc1[N+](=O)[O-])N1CCc2ccc(Br)cc21 ZINC001126046053 945846011 /nfs/dbraw/zinc/84/60/11/945846011.db2.gz GZCOEYSPWTYFLR-UHFFFAOYSA-N 0 0 365.158 3.699 20 5 FHBDRN Nc1c(C(=O)N2CCC(CCc3ccccc3)CC2)cc(F)cc1[N+](=O)[O-] ZINC000108077866 945851249 /nfs/dbraw/zinc/85/12/49/945851249.db2.gz RHLWUPYKCFXFIB-UHFFFAOYSA-N 0 0 371.412 3.801 20 5 FHBDRN C[C@@H](Sc1nccc(C(F)(F)F)n1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000143330974 945855629 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945925406 /nfs/dbraw/zinc/92/54/06/945925406.db2.gz KJJDZJKSOVIJML-ZDUSSCGKSA-N 0 0 363.414 3.571 20 5 FHBDRN COC(=O)c1cc(C(=O)OCc2csc3ccccc23)cc([N+](=O)[O-])c1 ZINC000108317569 945928686 /nfs/dbraw/zinc/92/86/86/945928686.db2.gz UCLIWZQPQDMKBC-UHFFFAOYSA-N 0 0 371.370 3.953 20 5 FHBDRN COc1ccc(OC(=O)c2cnn(-c3cccc(Cl)c3)c2)c([N+](=O)[O-])c1 ZINC000108314266 945929007 /nfs/dbraw/zinc/92/90/07/945929007.db2.gz QNMRITRQPJRGGQ-UHFFFAOYSA-N 0 0 373.752 3.662 20 5 FHBDRN O=[N+]([O-])c1cccc(-n2ccc(-c3nc(-c4cccc(F)c4)no3)n2)c1 ZINC000546249696 945999451 /nfs/dbraw/zinc/99/94/51/945999451.db2.gz ILDRTKCIVHZITE-UHFFFAOYSA-N 0 0 351.297 3.637 20 5 FHBDRN CCOc1cc(NC(=O)NC[C@H]2CC=CCC2)c([N+](=O)[O-])cc1OCC ZINC000519990372 946002736 /nfs/dbraw/zinc/00/27/36/946002736.db2.gz YQOCIVMSRJGXNI-ZDUSSCGKSA-N 0 0 363.414 3.870 20 5 FHBDRN O=C(NCc1ccc(Br)s1)Nc1ccc([N+](=O)[O-])cc1 ZINC000045313036 946007620 /nfs/dbraw/zinc/00/76/20/946007620.db2.gz YKRXTYHPLGYRFL-UHFFFAOYSA-N 0 0 356.201 3.741 20 5 FHBDRN CC(=O)c1cccc(NC(=O)[C@@H](C)Oc2ccc([N+](=O)[O-])c(Cl)c2)c1 ZINC000127160541 946022500 /nfs/dbraw/zinc/02/25/00/946022500.db2.gz GDYAADNJKSVVFQ-LLVKDONJSA-N 0 0 362.769 3.857 20 5 FHBDRN CC1(C)CCC[C@H]1NC(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000428331200 946025578 /nfs/dbraw/zinc/02/55/78/946025578.db2.gz NCSFOFDNXNOAGG-QGZVFWFLSA-N 0 0 361.442 3.726 20 5 FHBDRN COc1ccc2cc(CNC(=O)Cc3ccc([N+](=O)[O-])cc3F)ccc2c1 ZINC000125437567 946036362 /nfs/dbraw/zinc/03/63/62/946036362.db2.gz HZWSUHSRXWBTOO-UHFFFAOYSA-N 0 0 368.364 3.755 20 5 FHBDRN O=C(N[C@H](C[NH+]1CCCC1)c1ccccc1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000522877442 946047507 /nfs/dbraw/zinc/04/75/07/946047507.db2.gz IOHYYPDNZQBDGD-GOSISDBHSA-N 0 0 373.840 3.815 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(C(=O)NC(C)C)c(C)c1 ZINC000108748245 946049417 /nfs/dbraw/zinc/04/94/17/946049417.db2.gz HHVXRHYWZXITEO-UHFFFAOYSA-N 0 0 355.394 3.602 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N(C1CC1)[C@H]1CCc2ccccc21 ZINC000108831140 946066887 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O=C(N[C@@H]1[C@H]2Cc3ccccc3[C@@H]12)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000444233044 946097829 /nfs/dbraw/zinc/09/78/29/946097829.db2.gz STBGHKOPXVYDQJ-VLCRHTCISA-N 0 0 366.420 3.749 20 5 FHBDRN CN(Cc1cccc([N+](=O)[O-])c1)[C@@H](c1ccc(F)cc1)c1ncccn1 ZINC000066881066 946098748 /nfs/dbraw/zinc/09/87/48/946098748.db2.gz PDKSEKZAQAKLOA-SFHVURJKSA-N 0 0 352.369 3.745 20 5 FHBDRN COc1ccc2c(c1)CN(c1ccc(Br)cc1[N+](=O)[O-])CC2 ZINC000108967932 946099984 /nfs/dbraw/zinc/09/99/84/946099984.db2.gz ZPPGFRGWJBGGRY-UHFFFAOYSA-N 0 0 363.211 3.929 20 5 FHBDRN COc1cc(NCCNc2cccc(Br)c2)ccc1[N+](=O)[O-] ZINC000302062968 946103707 /nfs/dbraw/zinc/10/37/07/946103707.db2.gz RPZJJTJVUIKZPL-UHFFFAOYSA-N 0 0 366.215 3.890 20 5 FHBDRN CC(C)(C)C1CCC(O)(CNC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)CC1 ZINC000522927083 946106941 /nfs/dbraw/zinc/10/69/41/946106941.db2.gz DGAKYBOBVAPXOP-UHFFFAOYSA-N 0 0 373.453 3.773 20 5 FHBDRN O=C(COc1ccccc1[N+](=O)[O-])N1CCC(c2ccccc2F)CC1 ZINC000522932670 946114779 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CCc1n[nH]c(C(=O)N2CCCCC[C@@H]2c2cccc(C)c2)c1[N+](=O)[O-] ZINC000444252525 946127398 /nfs/dbraw/zinc/12/73/98/946127398.db2.gz WZBVLHZGFSVPPJ-MRXNPFEDSA-N 0 0 356.426 3.946 20 5 FHBDRN C[C@H](Cc1ccc(O)cc1)NC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000444254637 946130427 /nfs/dbraw/zinc/13/04/27/946130427.db2.gz UIKDWALZFFMDOC-CQSZACIVSA-N 0 0 372.424 3.748 20 5 FHBDRN Cc1cc(CNC(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)no1 ZINC000109049163 946132289 /nfs/dbraw/zinc/13/22/89/946132289.db2.gz NMIRKYPUEUTLOV-UHFFFAOYSA-N 0 0 352.350 3.565 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])N[C@@H](CC(F)(F)F)c1ccccc1 ZINC000520111520 946149728 /nfs/dbraw/zinc/14/97/28/946149728.db2.gz WIPUEAJXEPNPRB-AWEZNQCLSA-N 0 0 367.327 3.817 20 5 FHBDRN O=[N+]([O-])c1cc(-c2nc(Cc3cccc(F)c3)no2)ccc1OC(F)F ZINC000546254323 946156947 /nfs/dbraw/zinc/15/69/47/946156947.db2.gz UTKDRYUMCXOVIR-UHFFFAOYSA-N 0 0 365.267 3.976 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1C(F)(F)F)N1CCC([C@@H]2CCCO2)CC1 ZINC000294911961 946158085 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3.957 20 5 FHBDRN COc1cc(C(=O)N2CCCc3cc(Cl)cc(F)c32)ccc1[N+](=O)[O-] ZINC000109221717 946198490 /nfs/dbraw/zinc/19/84/90/946198490.db2.gz VDSVWJCJXDDRJJ-UHFFFAOYSA-N 0 0 364.760 3.989 20 5 FHBDRN CC(C)(C)SCCSCC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000783555262 946200849 /nfs/dbraw/zinc/20/08/49/946200849.db2.gz WYXIRSUFCRXNLV-UHFFFAOYSA-N 0 0 372.468 3.527 20 5 FHBDRN C[C@@H](C(=O)Nc1ccccc1-c1cn[nH]c1)c1ccc([N+](=O)[O-])cc1F ZINC000439758851 946206681 /nfs/dbraw/zinc/20/66/81/946206681.db2.gz SQOBUXFUGUMDSU-LLVKDONJSA-N 0 0 354.341 3.866 20 5 FHBDRN O=C(CCc1ccc(F)cc1)O[C@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1 ZINC000759926726 946207439 /nfs/dbraw/zinc/20/74/39/946207439.db2.gz BQSQBNDXKMFIDC-HOTGVXAUSA-N 0 0 361.373 3.590 20 5 FHBDRN C[C@@H]1CCN(C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)[C@@H]2CCCC[C@H]12 ZINC000109275896 946222221 /nfs/dbraw/zinc/22/22/21/946222221.db2.gz OWZVXPZUCXWRKA-LSBZLQRGSA-N 0 0 368.437 3.821 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)Nc1nc2c(s1)CCCCC2 ZINC000109317421 946234246 /nfs/dbraw/zinc/23/42/46/946234246.db2.gz HVCSCGPZTGSSHD-UHFFFAOYSA-N 0 0 370.434 3.914 20 5 FHBDRN CN(C)c1ccc(Cl)cc1NC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000109322383 946237670 /nfs/dbraw/zinc/23/76/70/946237670.db2.gz HWIZYNMTLSYYPQ-UHFFFAOYSA-N 0 0 372.812 3.908 20 5 FHBDRN Nc1ccc(-c2noc(CCC(=O)c3ccc(Cl)cc3)n2)cc1[N+](=O)[O-] ZINC000546257359 946249464 /nfs/dbraw/zinc/24/94/64/946249464.db2.gz LUHOQEOQOIODAQ-UHFFFAOYSA-N 0 0 372.768 3.696 20 5 FHBDRN COc1cccc(C(=O)Nc2cnn(CC(C)C)c2C(F)F)c1[N+](=O)[O-] ZINC000444314776 946260260 /nfs/dbraw/zinc/26/02/60/946260260.db2.gz OYYOJVXFIQFREF-UHFFFAOYSA-N 0 0 368.340 3.646 20 5 FHBDRN CS(=O)(=O)c1cc([N+](=O)[O-])ccc1NCc1cccc(C(F)(F)F)c1 ZINC000302616515 946263198 /nfs/dbraw/zinc/26/31/98/946263198.db2.gz DBPTYUGIGHWCRP-UHFFFAOYSA-N 0 0 374.340 3.629 20 5 FHBDRN CCC[C@H](C)NC(=O)[C@@H]1CCCN(Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000783555346 946272458 /nfs/dbraw/zinc/27/24/58/946272458.db2.gz PGELJIMXVZXIPT-DZGCQCFKSA-N 0 0 367.877 3.765 20 5 FHBDRN CC[C@@H](NC(=O)c1cccc(SC)c1[N+](=O)[O-])c1nc(C)cs1 ZINC000186461015 946283088 /nfs/dbraw/zinc/28/30/88/946283088.db2.gz UTVGHJLKOVALMJ-LLVKDONJSA-N 0 0 351.453 3.963 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCCCOc1ccccc1 ZINC000025776333 946289904 /nfs/dbraw/zinc/28/99/04/946289904.db2.gz UBFCMVXASBYMML-AWEZNQCLSA-N 0 0 360.435 3.661 20 5 FHBDRN Cc1cccc(C)c1OCCC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088230886 946291427 /nfs/dbraw/zinc/29/14/27/946291427.db2.gz WRZQUEGYMPGDKY-UHFFFAOYSA-N 0 0 354.406 3.565 20 5 FHBDRN CCOc1ccccc1CCC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088230901 946297614 /nfs/dbraw/zinc/29/76/14/946297614.db2.gz FMFYGVOCIDRCGQ-UHFFFAOYSA-N 0 0 354.406 3.511 20 5 FHBDRN COc1ccccc1CC(C)(C)C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088230762 946314741 /nfs/dbraw/zinc/31/47/41/946314741.db2.gz WZTACCQQBGVLST-UHFFFAOYSA-N 0 0 368.433 3.757 20 5 FHBDRN O=[N+]([O-])c1ccccc1NCCc1nc(Cc2ccccc2Cl)no1 ZINC000109539652 946324572 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0 369.421 3.715 20 5 FHBDRN CN(C(=O)[C@H]1C[C@@H]1c1cc(F)c(F)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000186024749 946350606 /nfs/dbraw/zinc/35/06/06/946350606.db2.gz JBHMVTHCOOWYRF-OLZOCXBDSA-N 0 0 350.296 3.779 20 5 FHBDRN CC(C)Oc1ccccc1CNC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000087054163 946359291 /nfs/dbraw/zinc/35/92/91/946359291.db2.gz OJNYPTGJBFHNRS-UHFFFAOYSA-N 0 0 369.421 3.650 20 5 FHBDRN C[C@H](CSCc1ccccc1)C(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000440104398 946389181 /nfs/dbraw/zinc/38/91/81/946389181.db2.gz LPNMQCTYDWRFGJ-OAHLLOKOSA-N 0 0 358.463 3.823 20 5 FHBDRN CCc1c(C(=O)Nc2cc([N+](=O)[O-])ccc2OC)cnn1C1CCCC1 ZINC000475482364 946392427 /nfs/dbraw/zinc/39/24/27/946392427.db2.gz WNQPWINZYSEEQR-UHFFFAOYSA-N 0 0 358.398 3.730 20 5 FHBDRN COc1ccc(C(=O)N2CCc3cc([N+](=O)[O-])ccc32)c(OCC(C)C)c1 ZINC000475484731 946394692 /nfs/dbraw/zinc/39/46/92/946394692.db2.gz YJJYYIJETAUIJN-UHFFFAOYSA-N 0 0 370.405 3.841 20 5 FHBDRN O=C(CCc1ccc([N+](=O)[O-])cc1Cl)N1CCOc2cc(F)ccc21 ZINC001126120919 946397241 /nfs/dbraw/zinc/39/72/41/946397241.db2.gz MOCDBMOYXCPFGS-UHFFFAOYSA-N 0 0 364.760 3.746 20 5 FHBDRN COc1c(C(=O)NCCc2ccccc2C(F)(F)F)cccc1[N+](=O)[O-] ZINC000475118816 946416854 /nfs/dbraw/zinc/41/68/54/946416854.db2.gz MFCBWHXWFYDCRG-UHFFFAOYSA-N 0 0 368.311 3.595 20 5 FHBDRN O=C(COc1ccccc1[N+](=O)[O-])N[C@H]1CCC[C@H]1Cc1ccccc1 ZINC000121367860 946427658 /nfs/dbraw/zinc/42/76/58/946427658.db2.gz YAJWDUVYLXXDPS-IRXDYDNUSA-N 0 0 354.406 3.501 20 5 FHBDRN COc1ccc2c(c1)OC[C@@H]2Cc1nc(-c2ccc([N+](=O)[O-])cc2C)no1 ZINC000545697464 946430187 /nfs/dbraw/zinc/43/01/87/946430187.db2.gz XDAKFWLZYGOQTC-LBPRGKRZSA-N 0 0 367.361 3.681 20 5 FHBDRN CCc1ccc(C(=O)Nc2ccc(OCC(C)(C)O)cc2)cc1[N+](=O)[O-] ZINC000475498664 946433558 /nfs/dbraw/zinc/43/35/58/946433558.db2.gz XZUHFZWEKOZNPQ-UHFFFAOYSA-N 0 0 358.394 3.559 20 5 FHBDRN CC(C)(O)COc1ccc(NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)cc1 ZINC000475494201 946443479 /nfs/dbraw/zinc/44/34/79/946443479.db2.gz PJUAZWHHHIXAHZ-UHFFFAOYSA-N 0 0 364.785 3.650 20 5 FHBDRN O=C(NCCc1ccccc1)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000047864363 946445827 /nfs/dbraw/zinc/44/58/27/946445827.db2.gz GWAZELFMPMAHDI-UHFFFAOYSA-N 0 0 351.309 3.560 20 5 FHBDRN COc1ccc(CNC(=O)Nc2cccc([N+](=O)[O-])c2)cc1OC(F)F ZINC000047969419 946472039 /nfs/dbraw/zinc/47/20/39/946472039.db2.gz FJLLANLYHTUCEA-UHFFFAOYSA-N 0 0 367.308 3.527 20 5 FHBDRN CC[C@]1(C)Oc2ccc(NC(=O)c3cccc(OC)c3[N+](=O)[O-])cc2O1 ZINC000444414773 946478516 /nfs/dbraw/zinc/47/85/16/946478516.db2.gz YTCGZICSZAKYPW-GOSISDBHSA-N 0 0 358.350 3.753 20 5 FHBDRN Cc1ccc([C@@H](C)N(C)C(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)cc1 ZINC000111560943 946483851 /nfs/dbraw/zinc/48/38/51/946483851.db2.gz MQSPEHUXHHALLG-CYBMUJFWSA-N 0 0 365.389 3.578 20 5 FHBDRN C[C@H]1[C@H](C(=O)N2CCCc3ccc([N+](=O)[O-])cc32)CCN1c1ccccc1 ZINC000475502832 946488671 /nfs/dbraw/zinc/48/86/71/946488671.db2.gz OZPPLHOJEHEXQE-HNAYVOBHSA-N 0 0 365.433 3.789 20 5 FHBDRN CSc1cccc(C(=O)NC2(c3nccs3)CCCC2)c1[N+](=O)[O-] ZINC000186516029 946494547 /nfs/dbraw/zinc/49/45/47/946494547.db2.gz GSQKSCVAAFWUJP-UHFFFAOYSA-N 0 0 363.464 3.973 20 5 FHBDRN COc1ccc(CSCC(=O)N[C@@H]2C[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000067514717 946494785 /nfs/dbraw/zinc/49/47/85/946494785.db2.gz ANFIELZWYJMIIV-JKSUJKDBSA-N 0 0 372.446 3.509 20 5 FHBDRN CC(C)NC(=O)c1ccc(NC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000048108268 946500412 /nfs/dbraw/zinc/50/04/12/946500412.db2.gz FAPQZXOPXTVAES-CYBMUJFWSA-N 0 0 370.409 3.616 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]cc(-c3nc(Cc4c[nH]c5ncccc45)no3)c2c1 ZINC000545736854 946504662 /nfs/dbraw/zinc/50/46/62/946504662.db2.gz IQCJNZWQTJCSKX-UHFFFAOYSA-N 0 0 360.333 3.593 20 5 FHBDRN CSc1cccc(C(=O)N(C[C@@H]2CCCO2)c2ccncc2)c1[N+](=O)[O-] ZINC000186519866 946511425 /nfs/dbraw/zinc/51/14/25/946511425.db2.gz RBNFWFAESMPSCZ-AWEZNQCLSA-N 0 0 373.434 3.538 20 5 FHBDRN CCn1cc(CN(C(=O)NC[C@H](C)c2ccccc2[N+](=O)[O-])C(C)C)cn1 ZINC000897052658 946537626 /nfs/dbraw/zinc/53/76/26/946537626.db2.gz MEMCXDMPVKVBCG-HNNXBMFYSA-N 0 0 373.457 3.535 20 5 FHBDRN C[C@@H](CNC(=O)N(C)C1CCC(F)(F)CC1)c1ccccc1[N+](=O)[O-] ZINC000897057872 946544913 /nfs/dbraw/zinc/54/49/13/946544913.db2.gz JUEVRSZKPXZGOW-LBPRGKRZSA-N 0 0 355.385 3.918 20 5 FHBDRN COc1cccc([C@@H]2C[C@@H](C)CN2C(=O)COc2cccc([N+](=O)[O-])c2)c1 ZINC000544323082 946549145 /nfs/dbraw/zinc/54/91/45/946549145.db2.gz POWQDCSNMQURPN-KUHUBIRLSA-N 0 0 370.405 3.592 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)Cn1ccc2ccc(Cl)cc21 ZINC000052979176 946553274 /nfs/dbraw/zinc/55/32/74/946553274.db2.gz RUQACDMBNXXKDB-UHFFFAOYSA-N 0 0 359.769 3.850 20 5 FHBDRN Cc1sc(C(=O)Nc2nc3cccc(Cl)c3n2C)cc1[N+](=O)[O-] ZINC000186573606 946555223 /nfs/dbraw/zinc/55/52/23/946555223.db2.gz GEQXETKSCNQIQC-UHFFFAOYSA-N 0 0 350.787 3.757 20 5 FHBDRN Cn1ccnc1[C@@H](NCc1ccc([N+](=O)[O-])c(Cl)c1)c1ccccc1 ZINC000783594165 946563753 /nfs/dbraw/zinc/56/37/53/946563753.db2.gz DNPQOXFPLWCSCE-KRWDZBQOSA-N 0 0 356.813 3.861 20 5 FHBDRN CC(C)CN(CC(C)(C)C)C(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000475180021 946583590 /nfs/dbraw/zinc/58/35/90/946583590.db2.gz DRTJWINFQQWJDS-UHFFFAOYSA-N 0 0 358.442 3.925 20 5 FHBDRN CN(C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)c1nc2ccccc2o1 ZINC000121256083 946588692 /nfs/dbraw/zinc/58/86/92/946588692.db2.gz UHWNWFKTQQZVOC-UHFFFAOYSA-N 0 0 352.350 3.587 20 5 FHBDRN COCC(=O)N1CCc2c1cccc2N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000186588697 946605017 /nfs/dbraw/zinc/60/50/17/946605017.db2.gz QXOOWEVQLSGMIK-AWEZNQCLSA-N 0 0 369.421 3.612 20 5 FHBDRN O=C(c1cccc([N+](=O)[O-])c1)N1CCCC[C@@H]1c1nc2ccccc2[nH]1 ZINC000456688530 946605043 /nfs/dbraw/zinc/60/50/43/946605043.db2.gz JAUKTRGZVSJGLP-QGZVFWFLSA-N 0 0 350.378 3.839 20 5 FHBDRN Cc1cc(C(=O)Cn2cc([N+](=O)[O-])c(C)n2)c(C)n1CCc1cccs1 ZINC000181810661 946617345 /nfs/dbraw/zinc/61/73/45/946617345.db2.gz JJGHUDZKLZIOLC-UHFFFAOYSA-N 0 0 372.450 3.705 20 5 FHBDRN CSc1cccc(C(=O)Nc2ccc(-n3ccnc3)c(F)c2)c1[N+](=O)[O-] ZINC000186205776 946619217 /nfs/dbraw/zinc/61/92/17/946619217.db2.gz ULZFMPWZGJRZHZ-UHFFFAOYSA-N 0 0 372.381 3.894 20 5 FHBDRN Cc1c2cccc(C)c2oc1-c1nc(Cc2ccc([N+](=O)[O-])cn2)no1 ZINC000545784505 946626138 /nfs/dbraw/zinc/62/61/38/946626138.db2.gz DVGIYKAJWBXFBC-UHFFFAOYSA-N 0 0 350.334 3.994 20 5 FHBDRN COc1cccc(F)c1NC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000186226940 946634607 /nfs/dbraw/zinc/63/46/07/946634607.db2.gz HEAVEXLRVBFIBH-UHFFFAOYSA-N 0 0 359.357 3.939 20 5 FHBDRN CCN(Cc1ccccc1Cl)S(=O)(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000151780319 946640453 /nfs/dbraw/zinc/64/04/53/946640453.db2.gz FGRFXWJCNRLARL-UHFFFAOYSA-N 0 0 368.842 3.600 20 5 FHBDRN CSc1cccc(C(=O)NC[C@@H](C)COCc2ccccc2)c1[N+](=O)[O-] ZINC000186248959 946645249 /nfs/dbraw/zinc/64/52/49/946645249.db2.gz DMCOCAICJKFUJX-CQSZACIVSA-N 0 0 374.462 3.899 20 5 FHBDRN Cc1ccc(C(=O)N2CCO[C@H](c3cccc(Cl)c3)C2)cc1[N+](=O)[O-] ZINC000186249104 946645496 /nfs/dbraw/zinc/64/54/96/946645496.db2.gz KYDHHCOMAYNMID-KRWDZBQOSA-N 0 0 360.797 3.770 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N(CCCO)Cc1ccccc1 ZINC000475560451 946654014 /nfs/dbraw/zinc/65/40/14/946654014.db2.gz UMEYDLKQSNPEOU-UHFFFAOYSA-N 0 0 357.410 3.628 20 5 FHBDRN CSc1cccc(C(=O)NCCOc2cc(C)cc(C)c2)c1[N+](=O)[O-] ZINC000186254565 946660815 /nfs/dbraw/zinc/66/08/15/946660815.db2.gz OVWDHJDNXZSJDR-UHFFFAOYSA-N 0 0 360.435 3.742 20 5 FHBDRN CN(Cc1nnc(-c2ccc(Cl)cc2)n1C)Cc1ccccc1[N+](=O)[O-] ZINC000186251962 946664159 /nfs/dbraw/zinc/66/41/59/946664159.db2.gz LZMOAAFHZILNCK-UHFFFAOYSA-N 0 0 371.828 3.676 20 5 FHBDRN Cc1ccc(NCCCNC(=O)N(C)[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 ZINC000121406232 946669672 /nfs/dbraw/zinc/66/96/72/946669672.db2.gz AFCUGGOEYXVSRW-OAHLLOKOSA-N 0 0 371.441 3.503 20 5 FHBDRN O=C(O[C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)c1cc2ccccc2o1 ZINC000759927266 946669749 /nfs/dbraw/zinc/66/97/49/946669749.db2.gz CTXSKXXNJAHHOK-DZGCQCFKSA-N 0 0 355.350 3.878 20 5 FHBDRN COc1cc(CN2CCCC3(CC3)C2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000186607860 946693466 /nfs/dbraw/zinc/69/34/66/946693466.db2.gz CSALXYUBZXGJBV-UHFFFAOYSA-N 0 0 374.359 3.921 20 5 FHBDRN CCOC(=O)c1coc(CNCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)c1 ZINC000475196404 946694037 /nfs/dbraw/zinc/69/40/37/946694037.db2.gz VAEUQKWMHFCBEK-UHFFFAOYSA-N 0 0 372.299 3.673 20 5 FHBDRN CC(C)OC(=O)C[C@H]1CCCN(Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000184452071 946697776 /nfs/dbraw/zinc/69/77/76/946697776.db2.gz GHJDVQYSRRMUFQ-CYBMUJFWSA-N 0 0 354.834 3.802 20 5 FHBDRN Cc1ccc(NCCCNC(=O)N(C)[C@H](C)c2ccco2)c([N+](=O)[O-])c1 ZINC000121415639 946698882 /nfs/dbraw/zinc/69/88/82/946698882.db2.gz RVDHFLNYCVUUBK-CQSZACIVSA-N 0 0 360.414 3.701 20 5 FHBDRN CC(C)Oc1ccccc1CNC(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000125575156 946726319 /nfs/dbraw/zinc/72/63/19/946726319.db2.gz WROXHVPMSGMUDE-UHFFFAOYSA-N 0 0 365.389 3.860 20 5 FHBDRN C[C@@H](c1ccccc1Cl)N(C)S(=O)(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000151972643 946731731 /nfs/dbraw/zinc/73/17/31/946731731.db2.gz IEODISIUGBLFBO-LBPRGKRZSA-N 0 0 368.842 3.771 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NCCCCNc1ccccn1 ZINC000475577116 946736490 /nfs/dbraw/zinc/73/64/90/946736490.db2.gz ZHLXPBPLEDDCEU-UHFFFAOYSA-N 0 0 357.414 3.620 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)cc1F ZINC000125575495 946736623 /nfs/dbraw/zinc/73/66/23/946736623.db2.gz KYJAZYBPESPAAT-CYBMUJFWSA-N 0 0 357.385 3.871 20 5 FHBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccc(Cl)cn1 ZINC000026089304 946750866 /nfs/dbraw/zinc/75/08/66/946750866.db2.gz BFWHAAMSVXYTBH-UHFFFAOYSA-N 0 0 363.804 3.842 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)NC[C@H](c1ccccc1)C(F)(F)F ZINC000186626779 946752307 /nfs/dbraw/zinc/75/23/07/946752307.db2.gz MNELBGUGDDYSPH-OAHLLOKOSA-N 0 0 367.327 3.740 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)c1cnc(OCc2ccccc2)cn1 ZINC000428339809 946752856 /nfs/dbraw/zinc/75/28/56/946752856.db2.gz ZFBWELHUMWCUMQ-UHFFFAOYSA-N 0 0 364.361 3.525 20 5 FHBDRN CCc1c(C(=O)NCc2cccc([N+](=O)[O-])c2)cnn1-c1ccccc1C ZINC000546019041 946760129 /nfs/dbraw/zinc/76/01/29/946760129.db2.gz YWHBHAGQEOEXPB-UHFFFAOYSA-N 0 0 364.405 3.581 20 5 FHBDRN CC(C)(C)C(=O)CNC(=O)c1cc([N+](=O)[O-])ccc1SC1CCCC1 ZINC000127262679 946772273 /nfs/dbraw/zinc/77/22/73/946772273.db2.gz UWNGZIMNXOURMD-UHFFFAOYSA-N 0 0 364.467 3.975 20 5 FHBDRN Cc1ccc(F)c(CN(C)C(=O)CCCNc2ccc([N+](=O)[O-])cc2)c1 ZINC000444437102 946778731 /nfs/dbraw/zinc/77/87/31/946778731.db2.gz FGEFBZKLEZSSPP-UHFFFAOYSA-N 0 0 359.401 3.893 20 5 FHBDRN CCOc1ncc(C(=O)N2c3ccc([N+](=O)[O-])cc3C[C@H]2C)cc1Cl ZINC000112234771 946810054 /nfs/dbraw/zinc/81/00/54/946810054.db2.gz DWDYHUNYXGREFL-SNVBAGLBSA-N 0 0 361.785 3.633 20 5 FHBDRN Cc1c(Br)cc(C(=O)N2C[C@@H](C)S[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000125584299 946819667 /nfs/dbraw/zinc/81/96/67/946819667.db2.gz SKNUEVOFKRJHHH-DTORHVGOSA-N 0 0 373.272 3.632 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N(C)CCCOc2ccccc2)c1 ZINC000025903992 946820815 /nfs/dbraw/zinc/82/08/15/946820815.db2.gz DPBDAMAWSLBHEZ-UHFFFAOYSA-N 0 0 360.435 3.858 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@H](CC(C)C)c1ccccc1C ZINC000112257702 946830592 /nfs/dbraw/zinc/83/05/92/946830592.db2.gz BQPCFOLQPXVSBF-QGZVFWFLSA-N 0 0 358.442 3.702 20 5 FHBDRN C/C=C\C[C@H](CO)NC(=O)c1cc([N+](=O)[O-])ccc1SC1CCCC1 ZINC000613847715 946831408 /nfs/dbraw/zinc/83/14/08/946831408.db2.gz BLWSAVBJSXRYCX-XQJDBVBESA-N 0 0 364.467 3.686 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@@H](CC(C)C)c1ccccc1C ZINC000112257704 946832300 /nfs/dbraw/zinc/83/23/00/946832300.db2.gz BQPCFOLQPXVSBF-KRWDZBQOSA-N 0 0 358.442 3.702 20 5 FHBDRN Cn1nc(-c2cc(F)cc(F)c2)cc1NC(=O)c1csc([N+](=O)[O-])c1 ZINC000487467214 946833893 /nfs/dbraw/zinc/83/38/93/946833893.db2.gz VRLWVFLWFSMQGI-UHFFFAOYSA-N 0 0 364.333 3.587 20 5 FHBDRN Cc1noc(C)c1[C@@H](C)CC(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186313231 946845895 /nfs/dbraw/zinc/84/58/95/946845895.db2.gz DWCOHJUUCJSICS-VIFPVBQESA-N 0 0 351.790 3.663 20 5 FHBDRN O=C(/C=C\c1ccccc1F)O[C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1 ZINC000759928313 946849078 /nfs/dbraw/zinc/84/90/78/946849078.db2.gz ACUVHCQERLRTBD-SNPSMXBXSA-N 0 0 359.357 3.671 20 5 FHBDRN Cc1cc(C(=O)Nc2ccc([N+](=O)[O-])c(C)n2)c(Br)s1 ZINC000475319845 946854140 /nfs/dbraw/zinc/85/41/40/946854140.db2.gz VCRVZKQJYYNAGZ-UHFFFAOYSA-N 0 0 356.201 3.683 20 5 FHBDRN C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)CC[C@@H]1O ZINC000186685414 946861855 /nfs/dbraw/zinc/86/18/55/946861855.db2.gz JEGRPJMZKUBKLF-GUYCJALGSA-N 0 0 372.446 3.589 20 5 FHBDRN CCOc1ccc(C(=O)N(C)Cc2ccccc2[N+](=O)[O-])cc1OCC ZINC000043770054 946869778 /nfs/dbraw/zinc/86/97/78/946869778.db2.gz FTUXZYMDBLTQBY-UHFFFAOYSA-N 0 0 358.394 3.664 20 5 FHBDRN C[C@@H](CCc1ccco1)Nc1ccc([N+](=O)[O-])c(N2CCOCC2)c1F ZINC000519835723 946871524 /nfs/dbraw/zinc/87/15/24/946871524.db2.gz QCNWVCJXNSHOOT-ZDUSSCGKSA-N 0 0 363.389 3.597 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)c1cc(F)cc2cccnc21 ZINC000186317737 946878935 /nfs/dbraw/zinc/87/89/35/946878935.db2.gz ZJCHCMMRVNRUFP-UHFFFAOYSA-N 0 0 359.744 3.866 20 5 FHBDRN Cc1ccccc1[C@H](CC(C)C)NC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000112478584 946884740 /nfs/dbraw/zinc/88/47/40/946884740.db2.gz SRKTWSAGHFOMLX-SFHVURJKSA-N 0 0 369.421 3.745 20 5 FHBDRN CC1(C)C[C@H](NC(=O)c2cc(F)c(Cl)c([N+](=O)[O-])c2Cl)CCO1 ZINC000897197752 946887819 /nfs/dbraw/zinc/88/78/19/946887819.db2.gz IMTJBHUHCHVHIJ-SSDOTTSWSA-N 0 0 365.188 3.728 20 5 FHBDRN COc1cccc([C@H]2C[C@H](C)CN2C(=O)Cc2ccccc2[N+](=O)[O-])c1 ZINC000544323612 946908784 /nfs/dbraw/zinc/90/87/84/946908784.db2.gz XFZZUFMIYBPAMT-IFXJQAMLSA-N 0 0 354.406 3.756 20 5 FHBDRN CCc1n[nH]c(C(=O)N2CCC(c3ccc(Cl)cc3)CC2)c1[N+](=O)[O-] ZINC000186325506 946913615 /nfs/dbraw/zinc/91/36/15/946913615.db2.gz CAWUVOQHUSYCLW-UHFFFAOYSA-N 0 0 362.817 3.554 20 5 FHBDRN CC(C)(C)OC(=O)N1CC[C@@H](Nc2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000112594219 946917418 /nfs/dbraw/zinc/91/74/18/946917418.db2.gz DXGFJZWULQOGMT-GFCCVEGCSA-N 0 0 358.398 3.564 20 5 FHBDRN C[C@@H](c1ccccc1)[C@H](CO)NC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000112606933 946917492 /nfs/dbraw/zinc/91/74/92/946917492.db2.gz CKOCAPQCQOBJMF-ZBEGNZNMSA-N 0 0 363.801 3.534 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)NC1(c2nc(C)cs2)CCCC1 ZINC000112597963 946917556 /nfs/dbraw/zinc/91/75/56/946917556.db2.gz RGQXFXLANXLMOV-UHFFFAOYSA-N 0 0 361.423 3.568 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)N[C@H]1C[C@H]1c1cccc(F)c1 ZINC000184509022 946920971 /nfs/dbraw/zinc/92/09/71/946920971.db2.gz CABWWPJLKYIHSG-HOCLYGCPSA-N 0 0 363.776 3.743 20 5 FHBDRN O=C(CCc1cc(F)ccc1F)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186326537 946922039 /nfs/dbraw/zinc/92/20/39/946922039.db2.gz DIVJGSXYLIKXGJ-UHFFFAOYSA-N 0 0 354.740 3.775 20 5 FHBDRN CC(C)(C)c1cccc2c1OCCN2C(=O)COc1ccccc1[N+](=O)[O-] ZINC000444477976 946922238 /nfs/dbraw/zinc/92/22/38/946922238.db2.gz IRZUIHXQFIPCBG-UHFFFAOYSA-N 0 0 370.405 3.697 20 5 FHBDRN CCc1n[nH]c(C(=O)N2CCCC[C@@H]2c2ccc(F)cc2F)c1[N+](=O)[O-] ZINC000444339258 946923170 /nfs/dbraw/zinc/92/31/70/946923170.db2.gz SACWATWVAVOOGF-CQSZACIVSA-N 0 0 364.352 3.526 20 5 FHBDRN COc1ccc(CNCc2ccccc2Br)cc1[N+](=O)[O-] ZINC000048820868 946929583 /nfs/dbraw/zinc/92/95/83/946929583.db2.gz UAKDVYWYZBMZAX-UHFFFAOYSA-N 0 0 351.200 3.656 20 5 FHBDRN C[C@H](c1ccc(F)cc1F)N1CCN(Cc2csc([N+](=O)[O-])c2)CC1 ZINC000507747637 946936572 /nfs/dbraw/zinc/93/65/72/946936572.db2.gz MKFCSTBKYAMORE-GFCCVEGCSA-N 0 0 367.421 3.813 20 5 FHBDRN COc1ccc(N(CC(C)C)C(=O)c2cccc([N+](=O)[O-])c2OC)cc1 ZINC000475368353 946956707 /nfs/dbraw/zinc/95/67/07/946956707.db2.gz IZQYRIXNENADCX-UHFFFAOYSA-N 0 0 358.394 3.915 20 5 FHBDRN COCCC1(CNC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)CCCCC1 ZINC000186338179 946960075 /nfs/dbraw/zinc/96/00/75/946960075.db2.gz CXJRLJVZOFQCNI-HNNXBMFYSA-N 0 0 363.458 3.942 20 5 FHBDRN COc1c(NC(=O)c2cc3ccccc3c3cccnc23)cccc1C(N)=O ZINC000543875258 946961391 /nfs/dbraw/zinc/96/13/91/946961391.db2.gz QTXVYRVJWBMZFV-UHFFFAOYSA-N 0 0 371.396 3.748 20 5 FHBDRN CC(C)(C)c1cccc2c1OCCN2C(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000444500347 946964187 /nfs/dbraw/zinc/96/41/87/946964187.db2.gz IQSOZWYBGCHAHP-UHFFFAOYSA-N 0 0 354.406 3.860 20 5 FHBDRN CCOc1cccc(CCNC(=O)c2cc(SC)ccc2[N+](=O)[O-])c1 ZINC000121466853 946967494 /nfs/dbraw/zinc/96/74/94/946967494.db2.gz LJZMLFZFLKLANE-UHFFFAOYSA-N 0 0 360.435 3.688 20 5 FHBDRN CC(C)[C@@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])cc2Br)C1 ZINC000444517412 946970604 /nfs/dbraw/zinc/97/06/04/946970604.db2.gz AYMMUDOWICFMRA-LLVKDONJSA-N 0 0 355.232 3.866 20 5 FHBDRN O=C(Nc1cnccn1)c1ccccc1Sc1ccccc1[N+](=O)[O-] ZINC000440449326 947000710 /nfs/dbraw/zinc/00/07/10/947000710.db2.gz ZIQOBHYSADXWCY-UHFFFAOYSA-N 0 0 352.375 3.788 20 5 FHBDRN COc1ccc(CC(C)(C)NC(=O)CCNc2ccccc2[N+](=O)[O-])cc1 ZINC000438513853 947002470 /nfs/dbraw/zinc/00/24/70/947002470.db2.gz DMLULAQIKVASOL-UHFFFAOYSA-N 0 0 371.437 3.543 20 5 FHBDRN CC(C)[C@H](NC(=O)CCn1cc([N+](=O)[O-])cn1)c1ccc(C(C)(C)C)cc1 ZINC000511923871 947006566 /nfs/dbraw/zinc/00/65/66/947006566.db2.gz KKBVBXVEIDMTOJ-IBGZPJMESA-N 0 0 372.469 3.992 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N[C@@H]1CCc2c1cccc2Cl ZINC000511924781 947010159 /nfs/dbraw/zinc/01/01/59/947010159.db2.gz WDBHVDBKXDIFTB-CQSZACIVSA-N 0 0 366.826 3.522 20 5 FHBDRN CC[C@H](C)N(Cc1ccccc1)C(=O)CCn1nc(C)c([N+](=O)[O-])c1C ZINC000523229140 947011242 /nfs/dbraw/zinc/01/12/42/947011242.db2.gz UVFGQZHHUZEXNM-AWEZNQCLSA-N 0 0 358.442 3.626 20 5 FHBDRN Cc1nn(CCC(=O)N[C@H](CC(C)C)c2ccccc2)c(C)c1[N+](=O)[O-] ZINC000523227968 947011731 /nfs/dbraw/zinc/01/17/31/947011731.db2.gz ZWKFZBGWSJMZKG-QGZVFWFLSA-N 0 0 358.442 3.702 20 5 FHBDRN CC(C)C[C@H](C)Oc1cc(CNC(=O)Cc2ccc([N+](=O)[O-])cc2)ccn1 ZINC000609528499 947021499 /nfs/dbraw/zinc/02/14/99/947021499.db2.gz LOHHTTXWLHVKHK-HNNXBMFYSA-N 0 0 371.437 3.662 20 5 FHBDRN CC(C)[C@@H](NC(=O)c1cc([N+](=O)[O-])nn1C)c1ccc(C(C)(C)C)cc1 ZINC000511930334 947028874 /nfs/dbraw/zinc/02/88/74/947028874.db2.gz OEHIBZUSFYWKDH-QGZVFWFLSA-N 0 0 358.442 3.753 20 5 FHBDRN CC(C)(C)OC1CC(CCNC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)C1 ZINC000432272843 947043200 /nfs/dbraw/zinc/04/32/00/947043200.db2.gz YKGIPYPUIYHUME-UHFFFAOYSA-N 0 0 359.426 3.790 20 5 FHBDRN CCC[C@@]1(C(=O)OCC)CCCN1C(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000444621857 947053280 /nfs/dbraw/zinc/05/32/80/947053280.db2.gz NIHDOMJZYNRZRB-KRWDZBQOSA-N 0 0 368.817 3.586 20 5 FHBDRN C[C@H](Cc1ccccc1Cl)C(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444630947 947060309 /nfs/dbraw/zinc/06/03/09/947060309.db2.gz JJTZMDJKCXRFJP-LLVKDONJSA-N 0 0 372.812 3.620 20 5 FHBDRN O=C(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1cc(Cl)cc(Cl)c1 ZINC000444630989 947060721 /nfs/dbraw/zinc/06/07/21/947060721.db2.gz JRQKMLNXECWJGH-UHFFFAOYSA-N 0 0 365.176 3.708 20 5 FHBDRN CCN(Cc1ccc2ccccc2c1)C(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 ZINC000523275215 947061482 /nfs/dbraw/zinc/06/14/82/947061482.db2.gz NPUCSAZPXYDTNI-UHFFFAOYSA-N 0 0 366.421 3.728 20 5 FHBDRN CCC[C@@H](C(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccccc1 ZINC000444633694 947063605 /nfs/dbraw/zinc/06/36/05/947063605.db2.gz DMQHVSLWCCHUAL-OAHLLOKOSA-N 0 0 352.394 3.671 20 5 FHBDRN Cc1ccccc1[C@H]1CN(Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)[C@@H](C)CO1 ZINC000444655253 947074583 /nfs/dbraw/zinc/07/45/83/947074583.db2.gz SMUWFTLHBRPZKT-IFXJQAMLSA-N 0 0 366.421 3.742 20 5 FHBDRN O=C(/C=C/c1ccc([N+](=O)[O-])cc1)NCc1ccc(OC(F)(F)F)cc1 ZINC000021121268 947074919 /nfs/dbraw/zinc/07/49/19/947074919.db2.gz GMQHLDAWHKKLDX-BJMVGYQFSA-N 0 0 366.295 3.823 20 5 FHBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)N1CCCC[C@H]1c1cccc(Cl)c1 ZINC000444666949 947093479 /nfs/dbraw/zinc/09/34/79/947093479.db2.gz TXSDMKOUOZRKJB-HNNXBMFYSA-N 0 0 360.801 3.593 20 5 FHBDRN CCC[C@@H](C)c1cc(=NC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)[nH][nH]1 ZINC000444671862 947097001 /nfs/dbraw/zinc/09/70/01/947097001.db2.gz IZHXVLIHRZDQHT-CYBMUJFWSA-N 0 0 374.444 3.982 20 5 FHBDRN O=C(NCc1coc(-c2cccs2)n1)c1cc([N+](=O)[O-])ccc1Cl ZINC000021122903 947097028 /nfs/dbraw/zinc/09/70/28/947097028.db2.gz GQNWTAJVYZCEEU-UHFFFAOYSA-N 0 0 363.782 3.895 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)Nc1csc2ccccc12 ZINC000440518664 947104242 /nfs/dbraw/zinc/10/42/42/947104242.db2.gz KCBPSMMJZSCLLX-UHFFFAOYSA-N 0 0 355.375 3.695 20 5 FHBDRN Cc1nn(C(C)(C)C)cc1[C@@H](C)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444688358 947113494 /nfs/dbraw/zinc/11/34/94/947113494.db2.gz JFEKJKYEMOWJQL-LLVKDONJSA-N 0 0 356.430 3.582 20 5 FHBDRN CCCOc1cccc(NC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)c1 ZINC000049700054 947118602 /nfs/dbraw/zinc/11/86/02/947118602.db2.gz OJQDUGSQTSAQAJ-UHFFFAOYSA-N 0 0 366.377 3.822 20 5 FHBDRN Cc1c(NC(=O)[C@@H](C)N(C)Cc2cc(F)cc(F)c2)cccc1[N+](=O)[O-] ZINC000444699736 947124705 /nfs/dbraw/zinc/12/47/05/947124705.db2.gz FPTYGRIRLSTOLH-GFCCVEGCSA-N 0 0 363.364 3.640 20 5 FHBDRN Cc1c(C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)nnn1-c1cccc(C)c1 ZINC000444733352 947149065 /nfs/dbraw/zinc/14/90/65/947149065.db2.gz QQKLFAGMXTUBNL-UHFFFAOYSA-N 0 0 365.393 3.661 20 5 FHBDRN CCOC(=O)[C@H]1CCN(Cc2c(F)cccc2[N+](=O)[O-])c2ccccc21 ZINC000444733493 947149564 /nfs/dbraw/zinc/14/95/64/947149564.db2.gz RFHYMBDLIIIKNX-AWEZNQCLSA-N 0 0 358.369 3.791 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCN(Cc3ncc(-c4cccs4)o3)CC2)cc1 ZINC000067374673 947153218 /nfs/dbraw/zinc/15/32/18/947153218.db2.gz NWVIIJWZHZPNCU-UHFFFAOYSA-N 0 0 370.434 3.634 20 5 FHBDRN CCOC(=O)[C@H]1CCN(Cc2ccc(OC)c([N+](=O)[O-])c2)c2ccccc21 ZINC000444724999 947167791 /nfs/dbraw/zinc/16/77/91/947167791.db2.gz MBQVVVPKMZXWMJ-INIZCTEOSA-N 0 0 370.405 3.660 20 5 FHBDRN CCCCc1noc([C@H](C)OC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])n1 ZINC000725936685 947171150 /nfs/dbraw/zinc/17/11/50/947171150.db2.gz GUHQMSCIJPKODE-QMMMGPOBSA-N 0 0 355.297 3.517 20 5 FHBDRN C[C@H](N[C@@H](c1ccco1)c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000049974352 947179830 /nfs/dbraw/zinc/17/98/30/947179830.db2.gz JHCZQPZJDCFABY-IFXJQAMLSA-N 0 0 365.389 3.894 20 5 FHBDRN CC(C)[C@@H](C)NC(=O)CSc1ccc(Br)cc1[N+](=O)[O-] ZINC000088501343 947181470 /nfs/dbraw/zinc/18/14/70/947181470.db2.gz OFWFAAXDVMBIHR-SECBINFHSA-N 0 0 361.261 3.610 20 5 FHBDRN CCO[C@H](C)c1nc(CN(C)c2ncnc3cccc([N+](=O)[O-])c32)cs1 ZINC000544393382 947187958 /nfs/dbraw/zinc/18/79/58/947187958.db2.gz MFWFORKVKCADJN-LLVKDONJSA-N 0 0 373.438 3.728 20 5 FHBDRN COC(=O)c1cc(NC(=O)C/C=C\c2ccc(C)cc2)cc([N+](=O)[O-])c1 ZINC000440535834 947188202 /nfs/dbraw/zinc/18/82/02/947188202.db2.gz CRLLQNJPZNOHTB-ARJAWSKDSA-N 0 0 354.362 3.732 20 5 FHBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc2c(c1)ncn2C ZINC000440543713 947189231 /nfs/dbraw/zinc/18/92/31/947189231.db2.gz CXHPLQJAZFCJOE-JTQLQIEISA-N 0 0 374.784 3.541 20 5 FHBDRN CC1CCN(c2ccc(C(=O)NCCCC(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000440543201 947190611 /nfs/dbraw/zinc/19/06/11/947190611.db2.gz AHRRAHLCOZZJIW-UHFFFAOYSA-N 0 0 373.375 3.903 20 5 FHBDRN CC(C)[C@@H]1CCCN([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000444771297 947207368 /nfs/dbraw/zinc/20/73/68/947207368.db2.gz OQVJZXFIXSFPAG-QWHCGFSZSA-N 0 0 353.850 3.943 20 5 FHBDRN COc1ccc(CNC(=O)N(C)[C@H](C)Cc2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000523410362 947219720 /nfs/dbraw/zinc/21/97/20/947219720.db2.gz MXVCQLANUMFKTJ-OAHLLOKOSA-N 0 0 371.437 3.684 20 5 FHBDRN CN(CC1(c2ccccc2)CC1)C(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000444363161 947229761 /nfs/dbraw/zinc/22/97/61/947229761.db2.gz HNFKAGQIEYHEME-UHFFFAOYSA-N 0 0 353.422 3.587 20 5 FHBDRN CCCOc1ccccc1NC(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444822914 947236643 /nfs/dbraw/zinc/23/66/43/947236643.db2.gz NGPACEHZNUCENC-UHFFFAOYSA-N 0 0 369.381 3.582 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)Nc1ccc(OC(F)F)c2cccnc12 ZINC000186413510 947237592 /nfs/dbraw/zinc/23/75/92/947237592.db2.gz DHODHJLZYGBKGN-UHFFFAOYSA-N 0 0 373.315 3.926 20 5 FHBDRN CN(Cc1cccs1)C(=O)c1sc(Br)cc1[N+](=O)[O-] ZINC000444824953 947239139 /nfs/dbraw/zinc/23/91/39/947239139.db2.gz CTWBZNLWWMVPKC-UHFFFAOYSA-N 0 0 361.242 3.753 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H](OC)C[C@@H]1C ZINC000441435758 947240110 /nfs/dbraw/zinc/24/01/10/947240110.db2.gz FNTXLWXQQRAUAD-JSGCOSHPSA-N 0 0 352.456 3.736 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(Cl)c1N[C@@H]1CCN(Cc2ccccc2)C1=O ZINC000444828393 947244625 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359.430 3.631 20 5 FHBDRN COc1ccc(CCCNC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000523508260 947320110 /nfs/dbraw/zinc/32/01/10/947320110.db2.gz RJRGKIUVMLUTRG-UHFFFAOYSA-N 0 0 356.422 3.630 20 5 FHBDRN COCCOc1ccc(NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000523504331 947334895 /nfs/dbraw/zinc/33/48/95/947334895.db2.gz QGERJBNUDQDQDA-UHFFFAOYSA-N 0 0 358.394 3.536 20 5 FHBDRN CC(C)(C(=O)N1CCc2[nH]c3ccccc3c2C1)c1ccc([N+](=O)[O-])cc1 ZINC000523529088 947337735 /nfs/dbraw/zinc/33/77/35/947337735.db2.gz BPMSUIWWXAPGJR-UHFFFAOYSA-N 0 0 363.417 3.939 20 5 FHBDRN Cc1nc(C)c(CCNC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)s1 ZINC000152059311 947339369 /nfs/dbraw/zinc/33/93/69/947339369.db2.gz DYTYWWGCPPEWEB-UHFFFAOYSA-N 0 0 374.466 3.585 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@H](C)COc1cccc(C)c1 ZINC000444923903 947341421 /nfs/dbraw/zinc/34/14/21/947341421.db2.gz RNDZSBMELUPCQF-CYBMUJFWSA-N 0 0 359.382 3.501 20 5 FHBDRN Nc1c(C(=O)NCc2ccc3ncccc3c2)cc2ccccc2c1[N+](=O)[O-] ZINC001271527732 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FHBDRN Cc1ccc2[nH]cc(CCC(=O)NCCNc3ccccc3[N+](=O)[O-])c2c1 ZINC000072816043 947364632 /nfs/dbraw/zinc/36/46/32/947364632.db2.gz AQJQPWDVMRPGDJ-UHFFFAOYSA-N 0 0 366.421 3.545 20 5 FHBDRN O=C(Nc1ccncc1[N+](=O)[O-])N1CCCC[C@@H]1c1cccc(Cl)c1 ZINC000444944768 947365435 /nfs/dbraw/zinc/36/54/35/947365435.db2.gz STUSNXYJEIGXDF-OAHLLOKOSA-N 0 0 360.801 3.824 20 5 FHBDRN Cc1ccc(S(=O)(=O)NCCCCc2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000523567333 947375472 /nfs/dbraw/zinc/37/54/72/947375472.db2.gz XNWLSIVAHMFLQP-UHFFFAOYSA-N 0 0 362.451 3.513 20 5 FHBDRN Cc1ccc(NCCCNC(=O)N[C@@H](C)CCc2ccco2)c([N+](=O)[O-])c1 ZINC000523570258 947379483 /nfs/dbraw/zinc/37/94/83/947379483.db2.gz PAZSHWSHLGHTGB-HNNXBMFYSA-N 0 0 374.441 3.619 20 5 FHBDRN Cc1ccc(NC(=O)c2ccc(Br)cc2[N+](=O)[O-])c(C)n1 ZINC000121519129 947380163 /nfs/dbraw/zinc/38/01/63/947380163.db2.gz HDRSIULJIHHAOW-UHFFFAOYSA-N 0 0 350.172 3.621 20 5 FHBDRN O=C(c1cccc2c(=O)c3ccccc3[nH]c12)N1CCC(C(F)F)CC1 ZINC000444959878 947387906 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3.618 20 5 FHBDRN COc1ccc(CNC(=O)N(C)[C@H](C)Cc2ccccc2C)cc1[N+](=O)[O-] ZINC000444990336 947403029 /nfs/dbraw/zinc/40/30/29/947403029.db2.gz SNDRKMJBRFXEEF-OAHLLOKOSA-N 0 0 371.437 3.684 20 5 FHBDRN CC1(C)CN(C(=O)c2cccc3c(=O)c4ccccc4[nH]c23)CCS1 ZINC000444996688 947409920 /nfs/dbraw/zinc/40/99/20/947409920.db2.gz CJJRJVFIAKFZMM-UHFFFAOYSA-N 0 0 352.459 3.649 20 5 FHBDRN CC[C@@H](C)c1ccc(C(=O)N2CCC(n3ccc([N+](=O)[O-])n3)CC2)cc1 ZINC000785326487 947424372 /nfs/dbraw/zinc/42/43/72/947424372.db2.gz MYLUZGAKIJSFGW-CQSZACIVSA-N 0 0 356.426 3.782 20 5 FHBDRN O=C(Cc1c(F)cccc1Cl)Nc1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000440630504 947427954 /nfs/dbraw/zinc/42/79/54/947427954.db2.gz RBBHAFIQOXYXQW-UHFFFAOYSA-N 0 0 359.744 3.539 20 5 FHBDRN O=C(N[C@@H](c1ccc(Cl)cc1)C1CCC1)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC000445005790 947428218 /nfs/dbraw/zinc/42/82/18/947428218.db2.gz AFUCIQWNDMJUOT-OAHLLOKOSA-N 0 0 361.785 3.620 20 5 FHBDRN O=C(O[C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1)c1ccc2ccccc2n1 ZINC000759931064 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370.438 3.938 20 5 FHBDRN Nc1c(C(=O)Nc2ncc(Cc3ccccc3)s2)cc(F)cc1[N+](=O)[O-] ZINC000523720296 947533706 /nfs/dbraw/zinc/53/37/06/947533706.db2.gz ZQKKJIDFEDTNIE-UHFFFAOYSA-N 0 0 372.381 3.616 20 5 FHBDRN CCc1ccc(OCC(=O)NCCc2ccc(Cl)cc2)c([N+](=O)[O-])c1 ZINC000523711431 947542372 /nfs/dbraw/zinc/54/23/72/947542372.db2.gz CXCSJQHWVRJGAT-UHFFFAOYSA-N 0 0 362.813 3.548 20 5 FHBDRN CC[C@H](C)n1[nH]c(=NC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)cc1C ZINC000445135558 947545377 /nfs/dbraw/zinc/54/53/77/947545377.db2.gz NADGTSAGURTNIU-ZDUSSCGKSA-N 0 0 374.444 3.831 20 5 FHBDRN CSc1cccc(C)c1NC(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000445159532 947554687 /nfs/dbraw/zinc/55/46/87/947554687.db2.gz BNEGKOKZHDRMPM-UHFFFAOYSA-N 0 0 371.422 3.823 20 5 FHBDRN CCc1cc(N2CC[C@H](OC)C[C@H]2C)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000440669938 947565031 /nfs/dbraw/zinc/56/50/31/947565031.db2.gz FUVDEQWIJHVOBH-DYVFJYSZSA-N 0 0 356.426 3.618 20 5 FHBDRN CO[C@@H]1CCN(c2ccc([N+](=O)[O-])c(OCc3ccccc3)n2)[C@@H](C)C1 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0 0 362.451 3.511 20 5 FHBDRN Cc1ccc(S(=O)(=O)N[C@H]2CCCCc3ccccc32)c([N+](=O)[O-])c1 ZINC000523765380 947581605 /nfs/dbraw/zinc/58/16/05/947581605.db2.gz CWTPWIPJEGYIGN-INIZCTEOSA-N 0 0 360.435 3.649 20 5 FHBDRN O=C(c1cc2cc([N+](=O)[O-])ccc2o1)N1CCO[C@@H](c2cccs2)C1 ZINC000473166948 947583428 /nfs/dbraw/zinc/58/34/28/947583428.db2.gz PTBXFBPLOYSIPN-OAHLLOKOSA-N 0 0 358.375 3.616 20 5 FHBDRN O=C(Nc1cccc2c1CN(CC(F)(F)F)C2)c1ccc([N+](=O)[O-])cc1 ZINC000186717255 947591280 /nfs/dbraw/zinc/59/12/80/947591280.db2.gz KQWRZOIXWNDGQC-UHFFFAOYSA-N 0 0 365.311 3.725 20 5 FHBDRN Nc1ccc(-c2noc([C@@H]3SCCc4ccccc43)n2)cc1[N+](=O)[O-] ZINC000445213592 947592086 /nfs/dbraw/zinc/59/20/86/947592086.db2.gz WTGOEYJZXIMXLV-OAHLLOKOSA-N 0 0 354.391 3.606 20 5 FHBDRN Cc1sc(S(=O)(=O)N(C)c2cccc(C(C)C)c2)cc1[N+](=O)[O-] ZINC000466976604 947609868 /nfs/dbraw/zinc/60/98/68/947609868.db2.gz WIXWJCPKGYRJAW-UHFFFAOYSA-N 0 0 354.453 3.913 20 5 FHBDRN Cc1ccc(-c2cnc(NC(=O)c3c[nH]c(=O)c([N+](=O)[O-])c3)s2)c(C)c1 ZINC000445215457 947615433 /nfs/dbraw/zinc/61/54/33/947615433.db2.gz QPAZDFXSGHEDJW-UHFFFAOYSA-N 0 0 370.390 3.688 20 5 FHBDRN Cc1nc(-c2ccc(C(=O)NCCc3ccc([N+](=O)[O-])cc3)cc2)cs1 ZINC000440685934 947619927 /nfs/dbraw/zinc/61/99/27/947619927.db2.gz BDDLPNLVSHUZLV-UHFFFAOYSA-N 0 0 367.430 3.999 20 5 FHBDRN O=C(N[C@@H]1C[C@@H]1c1c(F)cccc1F)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000523822295 947640451 /nfs/dbraw/zinc/64/04/51/947640451.db2.gz OLGBYXAJEYXTPY-BLLLJJGKSA-N 0 0 373.359 3.733 20 5 FHBDRN CCOc1cc(C(=O)N2C[C@@H](C)c3ccccc32)c([N+](=O)[O-])cc1OC ZINC000060599524 947647151 /nfs/dbraw/zinc/64/71/51/947647151.db2.gz ZZMJBSJWKAHYMV-GFCCVEGCSA-N 0 0 356.378 3.766 20 5 FHBDRN Cc1ccc([C@@H]2CSCCN2C(=O)COc2ccc([N+](=O)[O-])cc2)cc1 ZINC000523849034 947649774 /nfs/dbraw/zinc/64/97/74/947649774.db2.gz LQYXJQMEQCYBQQ-SFHVURJKSA-N 0 0 372.446 3.599 20 5 FHBDRN CC(=O)c1ccccc1NC(=O)c1sc(Br)cc1[N+](=O)[O-] ZINC000445259735 947661663 /nfs/dbraw/zinc/66/16/63/947661663.db2.gz 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20 5 FHBDRN Cc1c(CN[C@@H](c2cnn(C)c2)c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000184606638 947838958 /nfs/dbraw/zinc/83/89/58/947838958.db2.gz IJJFYJCJROIGJM-LJQANCHMSA-N 0 0 354.385 3.655 20 5 FHBDRN C[C@@H](NS(=O)(=O)Cc1cccc([N+](=O)[O-])c1)c1cc2ccccc2o1 ZINC000151413502 947867358 /nfs/dbraw/zinc/86/73/58/947867358.db2.gz VIVUISGCXNFPDF-GFCCVEGCSA-N 0 0 360.391 3.522 20 5 FHBDRN Cc1cc(Br)cc(C(=O)NCc2cccc([N+](=O)[O-])c2)c1C ZINC001126249487 947868896 /nfs/dbraw/zinc/86/88/96/947868896.db2.gz MRJUMWPRBSUYOL-UHFFFAOYSA-N 0 0 363.211 3.904 20 5 FHBDRN NC(=O)C[C@@H](Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)c1ccccc1 ZINC000549604547 947869973 /nfs/dbraw/zinc/86/99/73/947869973.db2.gz RPKSWTPDNPCYCK-CYBMUJFWSA-N 0 0 353.300 3.642 20 5 FHBDRN CN(C)[C@@H](CNc1nc2ccccn2c1[N+](=O)[O-])c1ccccc1Cl ZINC000105133297 947873781 /nfs/dbraw/zinc/87/37/81/947873781.db2.gz XMMRIZWSSSKLFZ-AWEZNQCLSA-N 0 0 359.817 3.611 20 5 FHBDRN C[C@H](NCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)c1ncnn1C ZINC000473988385 947881870 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O=C(N[C@H]1C[C@@H]1Cc1ccccc1)C1(c2ccc([N+](=O)[O-])cc2)CCC1 ZINC001126288146 948101852 /nfs/dbraw/zinc/10/18/52/948101852.db2.gz AFGHADBHURVMEW-LPHOPBHVSA-N 0 0 350.418 3.764 20 5 FHBDRN O=C(Cc1cccc(Cl)c1)O[C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000759944786 948103053 /nfs/dbraw/zinc/10/30/53/948103053.db2.gz SISQCKAVNMQUAW-HUUCEWRRSA-N 0 0 363.801 3.714 20 5 FHBDRN CSc1ccc(C(=O)O[C@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)cc1 ZINC000759946941 948135693 /nfs/dbraw/zinc/13/56/93/948135693.db2.gz JTEUPGBHMIMYJG-GJZGRUSLSA-N 0 0 361.423 3.854 20 5 FHBDRN CN(Cc1nc(=O)c2sccc2[n-]1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000432335542 948143092 /nfs/dbraw/zinc/14/30/92/948143092.db2.gz NDNFYWNVLLBHRA-UHFFFAOYSA-N 0 0 350.787 3.595 20 5 FHBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])Nc1cccc(O)c1F ZINC000129571260 948144778 /nfs/dbraw/zinc/14/47/78/948144778.db2.gz BQONEKHLVPZRHP-UHFFFAOYSA-N 0 0 354.721 3.501 20 5 FHBDRN Cc1cccc(C(=O)N2CCCN(c3c(Cl)cccc3[N+](=O)[O-])CC2)c1 ZINC000432334824 948146499 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FHBDRN O=[N+]([O-])c1cccc2c(NCc3nccn3CC(F)(F)F)ccnc21 ZINC000432343304 948172311 /nfs/dbraw/zinc/17/23/11/948172311.db2.gz UKWAPACMUMMTRS-UHFFFAOYSA-N 0 0 351.288 3.514 20 5 FHBDRN CC(C)Cn1cc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2)c(C(F)F)n1 ZINC000536441352 948179644 /nfs/dbraw/zinc/17/96/44/948179644.db2.gz FFAHDVWEFNOGPU-UHFFFAOYSA-N 0 0 356.304 3.776 20 5 FHBDRN COC(=O)c1cc(NC(=O)c2cc3c(cccc3C)o2)cc([N+](=O)[O-])c1 ZINC001126300063 948213515 /nfs/dbraw/zinc/21/35/15/948213515.db2.gz JNFOJDFRYKIEAQ-UHFFFAOYSA-N 0 0 354.318 3.688 20 5 FHBDRN Cc1c(C(=O)N[C@@H]2CCc3ccc(F)cc32)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000106678777 948213583 /nfs/dbraw/zinc/21/35/83/948213583.db2.gz VUTALJYZGNRAMK-OAHLLOKOSA-N 0 0 373.340 3.676 20 5 FHBDRN CN(Cc1nc(-c2cccc3ncccc32)no1)c1ccccc1[N+](=O)[O-] ZINC000585731446 948241245 /nfs/dbraw/zinc/24/12/45/948241245.db2.gz IRADXYBOIRIALA-UHFFFAOYSA-N 0 0 361.361 3.829 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1F)C(=O)NCCc1cccs1 ZINC000585732471 948242139 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ZINC000474012197 948789903 /nfs/dbraw/zinc/78/99/03/948789903.db2.gz NWKROKOGWVODSA-YOEHRIQHSA-N 0 0 357.385 3.869 20 5 FHBDRN CCCN(CC1CC1)C(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000134150804 948800543 /nfs/dbraw/zinc/80/05/43/948800543.db2.gz UVFLUAOVFNMXHY-UHFFFAOYSA-N 0 0 355.232 3.548 20 5 FHBDRN Cc1ccc(C)c(N(C)S(=O)(=O)c2ccc([N+](=O)[O-])c3cccnc32)c1 ZINC000184816774 948816555 /nfs/dbraw/zinc/81/65/55/948816555.db2.gz IQCQZTCZTUOVBS-UHFFFAOYSA-N 0 0 371.418 3.585 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1OCC(=O)Nc1cccc(C(F)(F)F)c1 ZINC000001284374 219394230 /nfs/dbraw/zinc/39/42/30/219394230.db2.gz BLFVVVQJNURFPX-UHFFFAOYSA-N 0 0 354.284 3.940 20 5 FHBDRN COC(=O)c1cc(C(=O)Nc2ccc(C(F)(F)F)cc2)cc([N+](=O)[O-])c1 ZINC000003566776 219520422 /nfs/dbraw/zinc/52/04/22/219520422.db2.gz CGNYZKXCKOIINC-UHFFFAOYSA-N 0 0 368.267 3.653 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(OC(F)(F)F)cc1 ZINC000007919545 219833516 /nfs/dbraw/zinc/83/35/16/219833516.db2.gz SXJABPQRSWWWIK-UHFFFAOYSA-N 0 0 356.256 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/nfs/dbraw/zinc/21/62/93/220216293.db2.gz YORNKWHGXDSAKO-UHFFFAOYSA-N 0 0 371.422 3.895 20 5 FHBDRN Cc1ccc(C(=O)N2CCN(Cc3ccc(Cl)cc3)CC2)cc1[N+](=O)[O-] ZINC000018017378 220221789 /nfs/dbraw/zinc/22/17/89/220221789.db2.gz QGMBHKFUGOIQAU-UHFFFAOYSA-N 0 0 373.840 3.515 20 5 FHBDRN O=[N+]([O-])c1ccccc1CNc1ccccc1I ZINC000020360861 220324623 /nfs/dbraw/zinc/32/46/23/220324623.db2.gz LUMYPOPRQJOYAG-UHFFFAOYSA-N 0 0 354.147 3.812 20 5 FHBDRN O=[N+]([O-])c1cccc(CNc2ccccc2I)c1 ZINC000020360852 220324694 /nfs/dbraw/zinc/32/46/94/220324694.db2.gz TVEIEJQKFLWWBI-UHFFFAOYSA-N 0 0 354.147 3.812 20 5 FHBDRN COc1ccc(-c2nnc(COc3ccc([N+](=O)[O-])cc3Cl)o2)cc1 ZINC000021838872 220368958 /nfs/dbraw/zinc/36/89/58/220368958.db2.gz NHVVAIJYZLMGQE-UHFFFAOYSA-N 0 0 361.741 3.886 20 5 FHBDRN COc1cccc(SCC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000027661099 220542419 /nfs/dbraw/zinc/54/24/19/220542419.db2.gz MYYXFDQJXZGKEF-UHFFFAOYSA-N 0 0 352.799 3.988 20 5 FHBDRN CCOC(=O)c1cc(C(=O)N(C)c2cccc(C)c2C)cc([N+](=O)[O-])c1 ZINC000055896628 221075420 /nfs/dbraw/zinc/07/54/20/221075420.db2.gz NOWYXHIZMIVQSZ-UHFFFAOYSA-N 0 0 356.378 3.665 20 5 FHBDRN O=[N+]([O-])c1ccc(NCc2cn(-c3ccccc3)nc2-c2ccncc2)nc1 ZINC000057858092 221095585 /nfs/dbraw/zinc/09/55/85/221095585.db2.gz CUICJMTVPQPUNW-UHFFFAOYSA-N 0 0 372.388 3.850 20 5 FHBDRN CCOC(=O)c1c(C2CC2)csc1NC(=O)c1ccccc1[N+](=O)[O-] ZINC000060392465 221131334 /nfs/dbraw/zinc/13/13/34/221131334.db2.gz BHUPEHCWQUNHLC-UHFFFAOYSA-N 0 0 360.391 3.963 20 5 FHBDRN O=C(NCc1cccc([N+](=O)[O-])c1)c1[nH]c2ccccc2c1Br ZINC000067329430 221251517 /nfs/dbraw/zinc/25/15/17/221251517.db2.gz FRLNKUBMOGVKQU-UHFFFAOYSA-N 0 0 374.194 3.769 20 5 FHBDRN Cc1cc(NC(=O)c2ccc(F)c(F)c2)n(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000068120952 221313001 /nfs/dbraw/zinc/31/30/01/221313001.db2.gz XHUMJFQHEJDOKR-UHFFFAOYSA-N 0 0 358.304 3.619 20 5 FHBDRN O=[N+]([O-])c1cc(F)ccc1Sc1nnc(-c2cccnc2)n1C1CC1 ZINC000071814411 221379729 /nfs/dbraw/zinc/37/97/29/221379729.db2.gz LXTKRVGNOTUCAQ-UHFFFAOYSA-N 0 0 357.370 3.874 20 5 FHBDRN COC(=O)c1cccc(COc2ccc([N+](=O)[O-])cc2C(F)(F)F)c1 ZINC000072033565 221398565 /nfs/dbraw/zinc/39/85/65/221398565.db2.gz FUNQANGRNIZSNZ-UHFFFAOYSA-N 0 0 355.268 3.979 20 5 FHBDRN CC(C)c1ccc(C(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000106106221 132239901 /nfs/dbraw/zinc/23/99/01/132239901.db2.gz ONXSAZQLIWXRBF-UHFFFAOYSA-N 0 0 353.422 3.681 20 5 FHBDRN CSc1ccc(C)c(C(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)c1 ZINC000031296061 136117352 /nfs/dbraw/zinc/11/73/52/136117352.db2.gz WYLHSUVHVCQGIU-UHFFFAOYSA-N 0 0 371.462 3.588 20 5 FHBDRN Cc1c(C(=O)Nc2ccccc2N2C[C@@H](C)O[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000055681914 136127363 /nfs/dbraw/zinc/12/73/63/136127363.db2.gz WYCOUWJWICLIIW-ZIAGYGMSSA-N 0 0 369.421 3.769 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)c1cnc(-c2ccc3c(c2)OCO3)s1 ZINC000097546372 222190057 /nfs/dbraw/zinc/19/00/57/222190057.db2.gz PBRQQHYWXMKOPN-UHFFFAOYSA-N 0 0 369.358 3.699 20 5 FHBDRN Cc1c(NC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cccc1[N+](=O)[O-] ZINC000097089918 222158612 /nfs/dbraw/zinc/15/86/12/222158612.db2.gz IHTOMNXIXOGBEE-HNNXBMFYSA-N 0 0 373.434 3.598 20 5 FHBDRN CCc1c(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)n[nH]c1-c1ccncc1 ZINC000097570349 222193346 /nfs/dbraw/zinc/19/33/46/222193346.db2.gz GHSNMLSAZCTBII-UHFFFAOYSA-N 0 0 371.784 3.848 20 5 FHBDRN CCOC(=O)c1cc(C(=O)NC2(c3ccccc3)CCC2)cc([N+](=O)[O-])c1 ZINC000105315565 222366231 /nfs/dbraw/zinc/36/62/31/222366231.db2.gz AZTUXGNCMWLKJG-UHFFFAOYSA-N 0 0 368.389 3.581 20 5 FHBDRN COC(=O)c1cc(C(=O)N2CCC[C@@H]2c2ccc(C)cc2)cc([N+](=O)[O-])c1 ZINC000105729703 222374304 /nfs/dbraw/zinc/37/43/04/222374304.db2.gz ACEJGGZTLDIPKY-GOSISDBHSA-N 0 0 368.389 3.667 20 5 FHBDRN CCN(Cc1ccccc1Cl)S(=O)(=O)c1cccc([N+](=O)[O-])c1C ZINC000106267313 222384796 /nfs/dbraw/zinc/38/47/96/222384796.db2.gz XKBOJSQZXOVWTB-UHFFFAOYSA-N 0 0 368.842 3.767 20 5 FHBDRN CC(C)(C)[C@@H](NS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000109064757 222440217 /nfs/dbraw/zinc/44/02/17/222440217.db2.gz CUORZHOGLPEOQH-KRWDZBQOSA-N 0 0 362.451 3.802 20 5 FHBDRN COc1ccc(NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)c(F)c1 ZINC000601711829 567818917 /nfs/dbraw/zinc/81/89/17/567818917.db2.gz KHEGQYYIUYISRZ-UHFFFAOYSA-N 0 0 359.357 3.595 20 5 FHBDRN COCc1cccc(CC(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000452863647 567828921 /nfs/dbraw/zinc/82/89/21/567828921.db2.gz VQUZTYXNWOQPSQ-LJQANCHMSA-N 0 0 368.433 3.690 20 5 FHBDRN O=C(NCCc1cc(F)c(F)c(F)c1)Nc1ccc([N+](=O)[O-])cc1F ZINC000541784328 567829866 /nfs/dbraw/zinc/82/98/66/567829866.db2.gz HTRGSKGDEMCVIV-UHFFFAOYSA-N 0 0 357.263 3.515 20 5 FHBDRN CC(=O)c1ccc(C(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)c(F)c1 ZINC000452861708 567834706 /nfs/dbraw/zinc/83/47/06/567834706.db2.gz UHNQAXWHYVJHNS-MRXNPFEDSA-N 0 0 370.380 3.956 20 5 FHBDRN Cc1ccn2ncc(C(=O)N3CCC[C@H](c4ccc([N+](=O)[O-])cc4)C3)c2c1 ZINC000452864376 567844632 /nfs/dbraw/zinc/84/46/32/567844632.db2.gz WFAJVZJXGHAHBH-INIZCTEOSA-N 0 0 364.405 3.571 20 5 FHBDRN O=C(c1ccnn1C1CCCC1)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452866041 567844751 /nfs/dbraw/zinc/84/47/51/567844751.db2.gz XHNFMPQBUHZOJD-INIZCTEOSA-N 0 0 368.437 3.926 20 5 FHBDRN O=C(NCC1([C@H]2CCCCO2)CCC1)c1ccc([N+](=O)[O-])cc1Cl ZINC000601855600 567852614 /nfs/dbraw/zinc/85/26/14/567852614.db2.gz CWNHTZMEQVIENM-OAHLLOKOSA-N 0 0 352.818 3.717 20 5 FHBDRN O=C(NCCc1ccccc1Br)Nc1cccc([N+](=O)[O-])c1 ZINC000060973722 567858386 /nfs/dbraw/zinc/85/83/86/567858386.db2.gz OJLWQLBBZXQZOY-UHFFFAOYSA-N 0 0 364.199 3.722 20 5 FHBDRN COc1cc(C(=O)N[C@H](C)CC2CCC2)c([N+](=O)[O-])cc1OC(F)F ZINC000601871347 567868975 /nfs/dbraw/zinc/86/89/75/567868975.db2.gz RNJYWGUMRKJSCE-SECBINFHSA-N 0 0 358.341 3.513 20 5 FHBDRN CCO[C@@H](C)c1nc(CSCCn2c(C)ncc2[N+](=O)[O-])cs1 ZINC000601917938 567869923 /nfs/dbraw/zinc/86/99/23/567869923.db2.gz VEPFDGJZJLJDHL-JTQLQIEISA-N 0 0 356.473 3.587 20 5 FHBDRN CC(C)Oc1cccc([C@H](C)NC(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)c1 ZINC000481388531 567876474 /nfs/dbraw/zinc/87/64/74/567876474.db2.gz YDBKFFYHMDCKPP-LBPRGKRZSA-N 0 0 368.393 3.749 20 5 FHBDRN COC(=O)c1ccc([C@@H](NCc2csc([N+](=O)[O-])c2)C(F)(F)F)cc1 ZINC000481400881 567891494 /nfs/dbraw/zinc/89/14/94/567891494.db2.gz HKOFSZQJHXYAIV-CYBMUJFWSA-N 0 0 374.340 3.836 20 5 FHBDRN CCOc1ccc(CC(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000452894439 567908850 /nfs/dbraw/zinc/90/88/50/567908850.db2.gz XXUQWCUOYWPUKC-SFHVURJKSA-N 0 0 368.433 3.942 20 5 FHBDRN COc1cc(Cl)ccc1CNC(=O)Nc1ccc([N+](=O)[O-])cc1F ZINC000541833696 567931319 /nfs/dbraw/zinc/93/13/19/567931319.db2.gz JSKZRHPPZKLZMD-UHFFFAOYSA-N 0 0 353.737 3.718 20 5 FHBDRN CC(C)C[C@H](C)n1nccc1NC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000481449303 567947906 /nfs/dbraw/zinc/94/79/06/567947906.db2.gz OYHMPPGSMNSYSU-AWEZNQCLSA-N 0 0 371.441 3.989 20 5 FHBDRN CC(C)C[C@@H](C)n1nccc1NC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000481449304 567947920 /nfs/dbraw/zinc/94/79/20/567947920.db2.gz OYHMPPGSMNSYSU-CQSZACIVSA-N 0 0 371.441 3.989 20 5 FHBDRN Cc1cnn([C@@H]2CCN(Cc3csc(-c4cccc([N+](=O)[O-])c4)n3)C2)c1 ZINC000291013581 567958160 /nfs/dbraw/zinc/95/81/60/567958160.db2.gz XBZPVKQVARZTCZ-QGZVFWFLSA-N 0 0 369.450 3.670 20 5 FHBDRN Cc1ccccc1[C@@H](CO)Nc1ccc([N+](=O)[O-])cc1Br ZINC000541850018 567962547 /nfs/dbraw/zinc/96/25/47/567962547.db2.gz ONWQRZVCRCQGDY-OAHLLOKOSA-N 0 0 351.200 3.811 20 5 FHBDRN Cc1ccccc1[C@H](CO)Nc1ccc([N+](=O)[O-])cc1Br ZINC000541850017 567962517 /nfs/dbraw/zinc/96/25/17/567962517.db2.gz ONWQRZVCRCQGDY-HNNXBMFYSA-N 0 0 351.200 3.811 20 5 FHBDRN Cc1c(CNC(=O)c2ccn(-c3cccc(Cl)c3)n2)cccc1[N+](=O)[O-] ZINC000481464027 567964060 /nfs/dbraw/zinc/96/40/60/567964060.db2.gz HETKTKBEYYALRZ-UHFFFAOYSA-N 0 0 370.796 3.672 20 5 FHBDRN COc1ccc(S[C@H](C)C(=O)NCc2cccc([N+](=O)[O-])c2C)cc1 ZINC000481464160 567965756 /nfs/dbraw/zinc/96/57/56/567965756.db2.gz HVRPSZTYQYTKSI-CYBMUJFWSA-N 0 0 360.435 3.709 20 5 FHBDRN CCc1ccc(C(=O)CCC(=O)NCc2cccc([N+](=O)[O-])c2C)cc1 ZINC000481467399 567966062 /nfs/dbraw/zinc/96/60/62/567966062.db2.gz RZXMWEUSTOOTSO-UHFFFAOYSA-N 0 0 354.406 3.745 20 5 FHBDRN COc1cccc(-c2c[nH]cc2C(=O)NCc2cccc([N+](=O)[O-])c2C)c1 ZINC000481469614 567967702 /nfs/dbraw/zinc/96/77/02/567967702.db2.gz YVVRADDSOMMVQD-UHFFFAOYSA-N 0 0 365.389 3.837 20 5 FHBDRN CCOc1cccc([C@@H](C)NC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)c1 ZINC000063254122 567969302 /nfs/dbraw/zinc/96/93/02/567969302.db2.gz KKXDPYQSDDECHJ-GFCCVEGCSA-N 0 0 353.378 3.966 20 5 FHBDRN CC(C)(CCc1noc([C@H]2C[C@H]2c2cc(F)c(F)c(F)c2)n1)[N+](=O)[O-] ZINC000291030665 567971278 /nfs/dbraw/zinc/97/12/78/567971278.db2.gz DYIGPUYNHFISJR-UWVGGRQHSA-N 0 0 355.316 3.746 20 5 FHBDRN Cc1nc(C(F)(F)F)ccc1C(=O)NCc1cccc([N+](=O)[O-])c1C ZINC000481476039 567975367 /nfs/dbraw/zinc/97/53/67/567975367.db2.gz DSXAWEWFUWEIFC-UHFFFAOYSA-N 0 0 353.300 3.555 20 5 FHBDRN CCOCCOCCN(C)C(=O)c1cc2ccccc2c2cccnc12 ZINC000188593688 567975830 /nfs/dbraw/zinc/97/58/30/567975830.db2.gz RNWMJFAHNOQCDI-UHFFFAOYSA-N 0 0 352.434 3.513 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1C[C@H](C)O[C@H]1C ZINC000412649456 567980034 /nfs/dbraw/zinc/98/00/34/567980034.db2.gz JWIZZJWMVRFJGA-AVGNSLFASA-N 0 0 352.456 3.640 20 5 FHBDRN C[C@H](CNC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)CC(F)(F)F ZINC000412649030 567982990 /nfs/dbraw/zinc/98/29/90/567982990.db2.gz BWMUVEPIKFGCAS-ZETCQYMHSA-N 0 0 358.238 3.932 20 5 FHBDRN Cc1cc([C@H]2CCCN2C(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)on1 ZINC000481485943 567988045 /nfs/dbraw/zinc/98/80/45/567988045.db2.gz ZBQZUPLQUYUPIE-SWLSCSKDSA-N 0 0 361.423 3.736 20 5 FHBDRN Cc1c(Cl)cc(S(=O)(=O)N(CC2CC2)C2CCC2)cc1[N+](=O)[O-] ZINC000481488419 567988900 /nfs/dbraw/zinc/98/89/00/567988900.db2.gz FWEHPXJBZWOKHM-UHFFFAOYSA-N 0 0 358.847 3.510 20 5 FHBDRN CSc1nc(C(C)C)nc(C)c1C(=O)NCc1cccc([N+](=O)[O-])c1C ZINC000481491734 567991700 /nfs/dbraw/zinc/99/17/00/567991700.db2.gz MIQPNSRJSQCDGR-UHFFFAOYSA-N 0 0 374.466 3.777 20 5 FHBDRN Cc1c(CNC(=O)c2cc(C3CC3)n(C(C)(C)C)n2)cccc1[N+](=O)[O-] ZINC000481495917 568005965 /nfs/dbraw/zinc/00/59/65/568005965.db2.gz UDSLNJSSIMBHJH-UHFFFAOYSA-N 0 0 356.426 3.662 20 5 FHBDRN COc1ccc(CCC(=O)NCc2cccc([N+](=O)[O-])c2C)cc1Cl ZINC000481497906 568007187 /nfs/dbraw/zinc/00/71/87/568007187.db2.gz ZHVHXXQUMJSRRR-UHFFFAOYSA-N 0 0 362.813 3.814 20 5 FHBDRN CSc1ccc(O[C@@H](C)c2nc(CCC(C)(C)[N+](=O)[O-])no2)cc1 ZINC000291061648 568008561 /nfs/dbraw/zinc/00/85/61/568008561.db2.gz KAWZNAQEADDJLJ-NSHDSACASA-N 0 0 351.428 3.919 20 5 FHBDRN Cc1ccc([C@@H](C)NS(=O)(=O)Cc2cccc(Cl)c2)cc1[N+](=O)[O-] ZINC000568317598 568023830 /nfs/dbraw/zinc/02/38/30/568023830.db2.gz BLWXDTLVONAAEQ-GFCCVEGCSA-N 0 0 368.842 3.737 20 5 FHBDRN CN(Cc1nc(COc2ccc(Cl)cc2)no1)c1ccccc1[N+](=O)[O-] ZINC000568337553 568026324 /nfs/dbraw/zinc/02/63/24/568026324.db2.gz PLFNRWKSNNCNEQ-UHFFFAOYSA-N 0 0 374.784 3.847 20 5 FHBDRN CCC(=O)c1ccc(N[C@H]2CCO[C@@H]2c2ccc(OC)nc2)c([N+](=O)[O-])c1 ZINC000568300540 568030522 /nfs/dbraw/zinc/03/05/22/568030522.db2.gz KATOIASKLAIQSX-HNAYVOBHSA-N 0 0 371.393 3.533 20 5 FHBDRN C[C@H]1SCCN(c2nnc(-c3cccc([N+](=O)[O-])c3)n2C2CC2)[C@@H]1C ZINC000568523575 568046088 /nfs/dbraw/zinc/04/60/88/568046088.db2.gz IAMGEULYRUAUKT-VXGBXAGGSA-N 0 0 359.455 3.518 20 5 FHBDRN CCCN(C(=O)c1ccc(SC)c([N+](=O)[O-])c1)[C@H](CC)C(=O)OCC ZINC000481556565 568047225 /nfs/dbraw/zinc/04/72/25/568047225.db2.gz KQBSBQVZLFMSRF-CYBMUJFWSA-N 0 0 368.455 3.511 20 5 FHBDRN C[C@@]1(CNc2ncnc3sc([N+](=O)[O-])cc32)OCCc2sccc21 ZINC000568573861 568056283 /nfs/dbraw/zinc/05/62/83/568056283.db2.gz CIYGTAABFZGJRL-HNNXBMFYSA-N 0 0 362.436 3.561 20 5 FHBDRN CCC1(NC(=O)CSCc2ccc(OC)c([N+](=O)[O-])c2)CCCC1 ZINC000452958941 568056507 /nfs/dbraw/zinc/05/65/07/568056507.db2.gz PBTXVZGSWVFVBS-UHFFFAOYSA-N 0 0 352.456 3.676 20 5 FHBDRN CC(=O)Nc1cc(C(=O)Nc2ccc([N+](=O)[O-])cc2)cc(C(F)(F)F)c1 ZINC000159240767 568057902 /nfs/dbraw/zinc/05/79/02/568057902.db2.gz VTBCUNQHBISBHH-UHFFFAOYSA-N 0 0 367.283 3.824 20 5 FHBDRN CC(C)c1ccc([C@H]2CCCCN2C(=O)c2nn(C)cc2[N+](=O)[O-])cc1 ZINC000541877436 568058471 /nfs/dbraw/zinc/05/84/71/568058471.db2.gz APBBMTRQAPMVFE-MRXNPFEDSA-N 0 0 356.426 3.819 20 5 FHBDRN O=C(c1cc2c(cc1[N+](=O)[O-])OCO2)N1CCC[C@@H]1/C=C/c1ccccc1 ZINC000541875959 568058765 /nfs/dbraw/zinc/05/87/65/568058765.db2.gz ICVSSEIAPDOCLP-XVJNWHFHSA-N 0 0 366.373 3.642 20 5 FHBDRN CCCn1ncc(NC(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)c1C1CC1 ZINC000452961573 568059865 /nfs/dbraw/zinc/05/98/65/568059865.db2.gz DDYZZLKXCDLIBV-UHFFFAOYSA-N 0 0 364.352 3.538 20 5 FHBDRN COC(=O)c1cc(NC(=O)c2ccc(C)c([N+](=O)[O-])c2)cc(Cl)c1F ZINC000481600395 568061477 /nfs/dbraw/zinc/06/14/77/568061477.db2.gz ZHUWOUZTXBPHKS-UHFFFAOYSA-N 0 0 366.732 3.735 20 5 FHBDRN CC(C)(CCc1noc(-c2ccnc(OCc3ccccc3)c2)n1)[N+](=O)[O-] ZINC000291139482 568063226 /nfs/dbraw/zinc/06/32/26/568063226.db2.gz XPKNWQYZDAUHNQ-UHFFFAOYSA-N 0 0 368.393 3.699 20 5 FHBDRN COC(=O)c1cc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2)cc(Cl)c1F ZINC000481586584 568063319 /nfs/dbraw/zinc/06/33/19/568063319.db2.gz YEHNSXZDZFTKCP-UHFFFAOYSA-N 0 0 370.695 3.565 20 5 FHBDRN CC[C@@H](C)COc1cc([N+](=O)[O-])c(CN(C)C[C@@H]2CCCO2)cc1OC ZINC000481594595 568064078 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FHBDRN CC(C)OC1CCC(NC(=O)CCCNc2ccc([N+](=O)[O-])cc2)CC1 ZINC000159261717 568082386 /nfs/dbraw/zinc/08/23/86/568082386.db2.gz HMRYRXGBLMQNNH-UHFFFAOYSA-N 0 0 363.458 3.639 20 5 FHBDRN C[C@H](Sc1ncccc1[N+](=O)[O-])C(=O)Nc1ccc(F)cc1Cl ZINC000067807492 568083529 /nfs/dbraw/zinc/08/35/29/568083529.db2.gz VYQQTMJOAMXBRR-QMMMGPOBSA-N 0 0 355.778 3.902 20 5 FHBDRN CC(=O)C[C@H](C)NC(=O)c1ccc(SCCC(C)C)c([N+](=O)[O-])c1 ZINC000128624441 568092587 /nfs/dbraw/zinc/09/25/87/568092587.db2.gz BWHUIKROMBHZON-LBPRGKRZSA-N 0 0 352.456 3.830 20 5 FHBDRN CC(=O)c1ccc(OC[C@@H](O)Cc2ccc3ccccc3c2)c([N+](=O)[O-])c1 ZINC000481723502 568098193 /nfs/dbraw/zinc/09/81/93/568098193.db2.gz FBYDHFOIMUKXPA-IBGZPJMESA-N 0 0 365.385 3.933 20 5 FHBDRN Cn1c(=O)c2cc3ccccc3cc2nc1SCc1nnsc1Cl ZINC000069450633 568098455 /nfs/dbraw/zinc/09/84/55/568098455.db2.gz AMAODEBZHWJODF-UHFFFAOYSA-N 0 0 374.878 3.884 20 5 FHBDRN O=c1[nH]c(N2CCC[C@@H]2c2ccc(F)cc2)nc2ccc([N+](=O)[O-])cc12 ZINC000568642144 568104098 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Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N(C)Cc1ccc(Cl)s1 ZINC000481956492 568196953 /nfs/dbraw/zinc/19/69/53/568196953.db2.gz LKJOYAXUNZYTPN-UHFFFAOYSA-N 0 0 374.871 3.747 20 5 FHBDRN COc1ccc(C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)c(C)s2)cn1 ZINC000603997566 568197244 /nfs/dbraw/zinc/19/72/44/568197244.db2.gz OJYLBYNCURYYJB-UHFFFAOYSA-N 0 0 370.390 3.683 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)[N-]c1ccc2scnc2c1 ZINC000481974901 568212548 /nfs/dbraw/zinc/21/25/48/568212548.db2.gz UHWHUDRTGVUYGT-UHFFFAOYSA-N 0 0 363.420 3.622 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)Nc1ccc(F)cc1Cl ZINC000481983628 568215429 /nfs/dbraw/zinc/21/54/29/568215429.db2.gz RPODXMIIVPNKFE-UHFFFAOYSA-N 0 0 358.778 3.805 20 5 FHBDRN O=[N+]([O-])c1ccc(Oc2ncncc2Br)c(Br)c1 ZINC000481984648 568215461 /nfs/dbraw/zinc/21/54/61/568215461.db2.gz WKGJFHREDXFWKJ-UHFFFAOYSA-N 0 0 374.976 3.702 20 5 FHBDRN CCCn1c(C)cc(C(=O)Cn2cc([N+](=O)[O-])c(=O)c3ccccc32)c1C ZINC000291591545 568217105 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FHBDRN O=C(N[C@H](c1ccccc1)C(F)F)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000482009257 568226647 /nfs/dbraw/zinc/22/66/47/568226647.db2.gz KCQJVSZFTKTWPP-MRXNPFEDSA-N 0 0 372.331 3.517 20 5 FHBDRN C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000482010688 568226821 /nfs/dbraw/zinc/22/68/21/568226821.db2.gz RFLNILLIXDPMLR-NEPJUHHUSA-N 0 0 360.332 3.553 20 5 FHBDRN CC(C)[C@H](CC(=O)NCCNc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000482027824 568232576 /nfs/dbraw/zinc/23/25/76/568232576.db2.gz XMFJDQJSHNYRPR-KRWDZBQOSA-N 0 0 355.438 3.953 20 5 FHBDRN COc1ccc(NC(=O)CNc2ccccc2C(C)(C)C)c([N+](=O)[O-])c1 ZINC000011041876 568237292 /nfs/dbraw/zinc/23/72/92/568237292.db2.gz KZJMBFGMAGUZRK-UHFFFAOYSA-N 0 0 357.410 3.952 20 5 FHBDRN CC(C)[C@@H]1C[C@@H](NC(=O)c2cc(Cl)cc(Cl)c2[N+](=O)[O-])CCO1 ZINC000291650829 568241804 /nfs/dbraw/zinc/24/18/04/568241804.db2.gz GXQBBVUGDJQFSI-GWCFXTLKSA-N 0 0 361.225 3.835 20 5 FHBDRN CCS[C@H]1CCC[C@@H]1NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000541926089 568242203 /nfs/dbraw/zinc/24/22/03/568242203.db2.gz UYWMDBAGHRTNSX-GWCFXTLKSA-N 0 0 360.382 3.600 20 5 FHBDRN CCCCNC(=O)c1ccc(CNc2nc(C)cc(C)c2[N+](=O)[O-])cc1 ZINC000541932810 568247059 /nfs/dbraw/zinc/24/70/59/568247059.db2.gz AFDWMPTXECIBSR-UHFFFAOYSA-N 0 0 356.426 3.749 20 5 FHBDRN Cc1nn(-c2ccccc2C)c(C)c1CN(C)c1cccnc1[N+](=O)[O-] ZINC000604323274 568249387 /nfs/dbraw/zinc/24/93/87/568249387.db2.gz QGWCTNQQUKWCOS-UHFFFAOYSA-N 0 0 351.410 3.737 20 5 FHBDRN CC[C@@H](CNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)CC(F)(F)F ZINC000412653878 568250955 /nfs/dbraw/zinc/25/09/55/568250955.db2.gz ITJGFXVXPAXQIC-LLVKDONJSA-N 0 0 360.332 3.653 20 5 FHBDRN COc1ccc([C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])c(C)c2)c(OC)c1 ZINC000015829322 568252592 /nfs/dbraw/zinc/25/25/92/568252592.db2.gz MEUZEJLEFRRLKF-GOSISDBHSA-N 0 0 370.405 3.898 20 5 FHBDRN Cc1nc(COc2ccc(Nc3nc(C)cc(C)c3[N+](=O)[O-])cc2)no1 ZINC000541932797 568253023 /nfs/dbraw/zinc/25/30/23/568253023.db2.gz WXMQIVPUXMTMOW-UHFFFAOYSA-N 0 0 355.354 3.621 20 5 FHBDRN CSc1ccc(NC(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)nc1 ZINC000568929694 568253377 /nfs/dbraw/zinc/25/33/77/568253377.db2.gz HMKVYRHILAVRIV-UHFFFAOYSA-N 0 0 371.422 3.557 20 5 FHBDRN C[C@@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1)c1cccc(-n2cccn2)c1 ZINC000072930745 568253381 /nfs/dbraw/zinc/25/33/81/568253381.db2.gz DZFOLOJWJHIIGX-CYBMUJFWSA-N 0 0 351.366 3.663 20 5 FHBDRN CCOC1CC(N(C)C(=O)c2cc([N+](=O)[O-])ccc2SC(C)C)C1 ZINC000568914400 568254255 /nfs/dbraw/zinc/25/42/55/568254255.db2.gz KISCATJGBXVBSA-UHFFFAOYSA-N 0 0 352.456 3.735 20 5 FHBDRN O=C(Nc1ccc2c(c1)nc1n2CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000007725389 568254261 /nfs/dbraw/zinc/25/42/61/568254261.db2.gz KTQQNQVVUZGHND-UHFFFAOYSA-N 0 0 350.378 3.923 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(NCC2(c3ccc(F)cc3)CCOCC2)n1 ZINC000541936053 568257255 /nfs/dbraw/zinc/25/72/55/568257255.db2.gz DCOXJEZRVUOXCL-UHFFFAOYSA-N 0 0 359.401 3.906 20 5 FHBDRN Cc1cnc(N2CCO[C@H](c3ccccc3C(F)(F)F)C2)c([N+](=O)[O-])c1 ZINC000541935286 568257379 /nfs/dbraw/zinc/25/73/79/568257379.db2.gz LKCABYUYHVRVNW-HNNXBMFYSA-N 0 0 367.327 3.895 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N[C@H](C[NH+](C)C)c1ccc(F)cc1 ZINC000482083340 568257685 /nfs/dbraw/zinc/25/76/85/568257685.db2.gz MGRRFECDCSHXPH-QGZVFWFLSA-N 0 0 374.416 3.775 20 5 FHBDRN CCS[C@@H](C)c1noc(CN(C)c2cc(OC)c(F)cc2[N+](=O)[O-])n1 ZINC000482089657 568258429 /nfs/dbraw/zinc/25/84/29/568258429.db2.gz DDUCNWMKTSRBNY-VIFPVBQESA-N 0 0 370.406 3.576 20 5 FHBDRN O=C(c1ccc(F)cc1[N+](=O)[O-])N1CCO[C@H](c2ccc(Cl)s2)C1 ZINC000366035782 568260692 /nfs/dbraw/zinc/26/06/92/568260692.db2.gz WEMXKFUMOUJUDO-LBPRGKRZSA-N 0 0 370.789 3.663 20 5 FHBDRN CCCN1C(=O)c2ccccc2N[C@H]1c1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000007889761 568260905 /nfs/dbraw/zinc/26/09/05/568260905.db2.gz DGGRBWBHFJVCMG-GOSISDBHSA-N 0 0 371.393 3.589 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)N[C@]1(C(F)(F)F)CCc2ccccc21 ZINC000541937940 568261026 /nfs/dbraw/zinc/26/10/26/568261026.db2.gz FABSRWCLZLFRPV-QGZVFWFLSA-N 0 0 364.323 3.658 20 5 FHBDRN CN(C(=O)c1ccc([N+](=O)[O-])cc1Br)c1ccc(F)c(F)c1 ZINC000150849201 568271808 /nfs/dbraw/zinc/27/18/08/568271808.db2.gz HYTKJYHRRFHZQQ-UHFFFAOYSA-N 0 0 371.137 3.912 20 5 FHBDRN CCN(CC)S(=O)(=O)c1ccc(SC2CCCC2)c([N+](=O)[O-])c1 ZINC000008177962 568278962 /nfs/dbraw/zinc/27/89/62/568278962.db2.gz VVBSAQVCFASNOW-UHFFFAOYSA-N 0 0 358.485 3.660 20 5 FHBDRN O=C(N[C@@H](C1CC1)C(F)(F)F)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC000291726367 568282602 /nfs/dbraw/zinc/28/26/02/568282602.db2.gz HVZOWRIMKOTACB-HNNXBMFYSA-N 0 0 365.311 3.728 20 5 FHBDRN CO[C@@H](C)C(=O)Nc1cccc(N[C@@H]2CCc3c2cccc3[N+](=O)[O-])c1 ZINC000569138031 568285192 /nfs/dbraw/zinc/28/51/92/568285192.db2.gz KAAHCUOBENLCTP-YVEFUNNKSA-N 0 0 355.394 3.668 20 5 FHBDRN C[C@H]1CC[C@H](c2nc(-c3ccc(-n4cncn4)c([N+](=O)[O-])c3)no2)CC1 ZINC000569129131 568285505 /nfs/dbraw/zinc/28/55/05/568285505.db2.gz LMRDXHZTAAHICE-HAQNSBGRSA-N 0 0 354.370 3.519 20 5 FHBDRN Nc1c(C(=O)N[C@H]2CC=C(c3ccc(F)cc3)CC2)cc(F)cc1[N+](=O)[O-] ZINC000482138869 568287704 /nfs/dbraw/zinc/28/77/04/568287704.db2.gz HHKHLWKEONXZOD-HNNXBMFYSA-N 0 0 373.359 3.821 20 5 FHBDRN COc1cc(CN(C)c2ccc(F)cc2[N+](=O)[O-])ccc1OC(F)F ZINC000008051333 568295651 /nfs/dbraw/zinc/29/56/51/568295651.db2.gz MRVOSXUMPWWKKZ-UHFFFAOYSA-N 0 0 356.300 3.980 20 5 FHBDRN CC(=O)c1cc([N+](=O)[O-])ccc1N1CCC(c2noc(C(C)C)n2)CC1 ZINC000291759863 568298144 /nfs/dbraw/zinc/29/81/44/568298144.db2.gz AWMFAMABVQAPPS-UHFFFAOYSA-N 0 0 358.398 3.688 20 5 FHBDRN COc1ccccc1C(C)(C)CNC(=O)CSc1ccccc1[N+](=O)[O-] ZINC000604487284 568298884 /nfs/dbraw/zinc/29/88/84/568298884.db2.gz FIXTWUKHYDWVCN-UHFFFAOYSA-N 0 0 374.462 3.790 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)CCc1cccc(OC)c1F ZINC000569168505 568299309 /nfs/dbraw/zinc/29/93/09/568299309.db2.gz RILPSGWEOWZGBX-UHFFFAOYSA-N 0 0 362.357 3.713 20 5 FHBDRN Cc1cc(Cc2noc([C@@]3(F)CCN(C(C)(C)C)C3)n2)ccc1[N+](=O)[O-] ZINC000569159734 568300547 /nfs/dbraw/zinc/30/05/47/568300547.db2.gz XJBRHDYCOCEUGQ-GOSISDBHSA-N 0 0 362.405 3.546 20 5 FHBDRN O=C(NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)c1nc2ccccc2s1 ZINC000569185180 568306251 /nfs/dbraw/zinc/30/62/51/568306251.db2.gz FQRVMDDOKKUFDQ-UHFFFAOYSA-N 0 0 366.402 3.658 20 5 FHBDRN CCOC(=O)CCc1ccc(NC(=O)[C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000569187469 568306379 /nfs/dbraw/zinc/30/63/79/568306379.db2.gz DGQOVNKXJGALOD-CQSZACIVSA-N 0 0 370.405 3.833 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])NC[C@@H]1CCCC[C@H]1C(F)(F)F ZINC000482199174 568311259 /nfs/dbraw/zinc/31/12/59/568311259.db2.gz OOHGHABIQGJSTB-QWHCGFSZSA-N 0 0 374.359 3.849 20 5 FHBDRN Cc1cc(-c2noc(-c3cnn(-c4ccc([N+](=O)[O-])cc4)c3)n2)ccc1F ZINC000609474966 568317963 /nfs/dbraw/zinc/31/79/63/568317963.db2.gz HVMPUUUVBHRZMR-UHFFFAOYSA-N 0 0 365.324 3.945 20 5 FHBDRN Cc1c(N[C@H]2CCN([C@H](C)c3ccc(F)cc3)C2=O)cccc1[N+](=O)[O-] ZINC000453064191 568321348 /nfs/dbraw/zinc/32/13/48/568321348.db2.gz ONKWOAKAYOIUEH-DYVFJYSZSA-N 0 0 357.385 3.816 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NCCCSc1ccccn1 ZINC000569264197 568322109 /nfs/dbraw/zinc/32/21/09/568322109.db2.gz YJJACLLCEPJSGH-UHFFFAOYSA-N 0 0 359.451 3.827 20 5 FHBDRN COC(=O)c1cc(NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])ccc1Cl ZINC000031055120 568322464 /nfs/dbraw/zinc/32/24/64/568322464.db2.gz BNSBMNXTLCAPBI-UHFFFAOYSA-N 0 0 369.160 3.941 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N(CC)[C@H]1CCOC(C)(C)C1 ZINC000569275221 568325924 /nfs/dbraw/zinc/32/59/24/568325924.db2.gz DBPRDFWSNOZSTO-AWEZNQCLSA-N 0 0 365.430 3.805 20 5 FHBDRN Cc1cc(N2CC[C@@H]([C@@H]3CCOC3)C2)c(Br)cc1[N+](=O)[O-] ZINC000408297862 568367635 /nfs/dbraw/zinc/36/76/35/568367635.db2.gz MBJARZBHYZCYAD-VXGBXAGGSA-N 0 0 355.232 3.529 20 5 FHBDRN C[C@@H](Sc1ccc2c(c1)OCCCO2)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000005365802 568387147 /nfs/dbraw/zinc/38/71/47/568387147.db2.gz TVLFJEBAWOQLJB-GFCCVEGCSA-N 0 0 374.418 3.875 20 5 FHBDRN COC(=O)c1sccc1COc1ccc(Br)cc1[N+](=O)[O-] ZINC000382364335 568397024 /nfs/dbraw/zinc/39/70/24/568397024.db2.gz TVHVGVRNFMQYIV-UHFFFAOYSA-N 0 0 372.196 3.784 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)NCc1ccc2c(c1)nc(C1CC1)n2C ZINC000569384239 568400021 /nfs/dbraw/zinc/40/00/21/568400021.db2.gz ABPRIEPJXKBSEY-UHFFFAOYSA-N 0 0 364.405 3.597 20 5 FHBDRN CCc1c(C(=O)NCCOc2ccc([N+](=O)[O-])cc2)cnn1C(CC)CC ZINC000569421637 568401765 /nfs/dbraw/zinc/40/17/65/568401765.db2.gz MXDAEXQYTAMSGG-UHFFFAOYSA-N 0 0 374.441 3.524 20 5 FHBDRN Cc1noc(C)c1CO[C@H]1CCN(c2nccc3cc([N+](=O)[O-])ccc32)C1 ZINC000569425691 568402029 /nfs/dbraw/zinc/40/20/29/568402029.db2.gz GBSDFOJMDIKZCE-INIZCTEOSA-N 0 0 368.393 3.543 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H](C)c1nnc([C@H](C)CC)[nH]1 ZINC000569652540 568415149 /nfs/dbraw/zinc/41/51/49/568415149.db2.gz AJFINNQYWBKVBL-MNOVXSKESA-N 0 0 360.418 3.672 20 5 FHBDRN O=[N+]([O-])c1cnn(C[C@@H]2CCCO[C@H]2c2ccc(C(F)(F)F)cc2)c1 ZINC000569775393 568423825 /nfs/dbraw/zinc/42/38/25/568423825.db2.gz PWIVTTRNEVWASV-WFASDCNBSA-N 0 0 355.316 3.978 20 5 FHBDRN C[C@H](NC(=O)NCCC1Cc2ccccc2C1)c1cccc([N+](=O)[O-])c1 ZINC000569945432 568443995 /nfs/dbraw/zinc/44/39/95/568443995.db2.gz OTAMRJGTNAKNOO-AWEZNQCLSA-N 0 0 353.422 3.760 20 5 FHBDRN Cc1ccc(CN2CCn3c(C4CCCC4)nnc3[C@H]2C)cc1[N+](=O)[O-] ZINC000569968897 568445042 /nfs/dbraw/zinc/44/50/42/568445042.db2.gz OHPHYYIOLUQVLW-CQSZACIVSA-N 0 0 355.442 3.729 20 5 FHBDRN CN(C(=O)c1ccc(Cl)c(Br)c1)c1ccc([N+](=O)[O-])nc1 ZINC000570122824 568452366 /nfs/dbraw/zinc/45/23/66/568452366.db2.gz CLEZBSCZSNYSJD-UHFFFAOYSA-N 0 0 370.590 3.682 20 5 FHBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])N1CC2(C1)CCCCC2 ZINC000570134213 568454140 /nfs/dbraw/zinc/45/41/40/568454140.db2.gz TVGZSQYVQIBYID-UHFFFAOYSA-N 0 0 351.834 3.766 20 5 FHBDRN CCc1nn(C)c(Sc2nc(C3CC3)n(-c3ccccc3)n2)c1[N+](=O)[O-] ZINC000570074531 568457350 /nfs/dbraw/zinc/45/73/50/568457350.db2.gz UEDRFJDIYAOVSE-UHFFFAOYSA-N 0 0 370.438 3.500 20 5 FHBDRN CCCN(c1nnc(-c2ccc([N+](=O)[O-])cc2)n1C[C@@H]1CCOC1)C(C)C ZINC000570177064 568459361 /nfs/dbraw/zinc/45/93/61/568459361.db2.gz YQGPOHDYXXGFKN-HNNXBMFYSA-N 0 0 373.457 3.515 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)Cc1cnccc1C(F)(F)F ZINC000570223410 568462930 /nfs/dbraw/zinc/46/29/30/568462930.db2.gz VCWDBQCKZCNBEV-UHFFFAOYSA-N 0 0 353.300 3.807 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1CN1CCC[C@H](CC(=O)OC(C)(C)C)C1 ZINC000570232001 568463916 /nfs/dbraw/zinc/46/39/16/568463916.db2.gz MDAIHBSBLXAWFP-CQSZACIVSA-N 0 0 364.442 3.547 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(N(C)Cc2ccc(OCC(F)(F)F)cc2)n1 ZINC000570233166 568464025 /nfs/dbraw/zinc/46/40/25/568464025.db2.gz KCSJLCNFYDNDPH-UHFFFAOYSA-N 0 0 355.316 3.876 20 5 FHBDRN CC(=O)c1ccc(NC(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)cc1 ZINC000570241155 568465405 /nfs/dbraw/zinc/46/54/05/568465405.db2.gz BYLUNCLWEAXGPA-UHFFFAOYSA-N 0 0 366.377 3.643 20 5 FHBDRN CNc1ccc(C(=O)NCCOc2ccc(C(C)(C)C)cc2)cc1[N+](=O)[O-] ZINC000007179766 568468626 /nfs/dbraw/zinc/46/86/26/568468626.db2.gz FNHFUOGUCFCEOD-UHFFFAOYSA-N 0 0 371.437 3.743 20 5 FHBDRN O=C(Nc1cnc2ccccc2c1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000033243217 568471365 /nfs/dbraw/zinc/47/13/65/568471365.db2.gz REFIRLSIZLCXPY-UHFFFAOYSA-N 0 0 359.345 3.581 20 5 FHBDRN Cc1occc1-c1nnc(SCC(=O)Nc2c(C)cccc2[N+](=O)[O-])o1 ZINC000007193901 568472242 /nfs/dbraw/zinc/47/22/42/568472242.db2.gz RPTRYAMDMWHHEL-UHFFFAOYSA-N 0 0 374.378 3.585 20 5 FHBDRN O=[N+]([O-])c1cccc(N2CCN(Cc3ncc(-c4ccccc4)o3)CC2)c1 ZINC000051855681 568477053 /nfs/dbraw/zinc/47/70/53/568477053.db2.gz JPMYZKOTXYAPDD-UHFFFAOYSA-N 0 0 364.405 3.572 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)c1cccc([C@H]2CCCOC2)c1 ZINC000570503195 568488877 /nfs/dbraw/zinc/48/88/77/568488877.db2.gz VCZDBHWZDQMSFL-IBGZPJMESA-N 0 0 368.433 3.804 20 5 FHBDRN COc1cc(C(=O)N[C@H]2CCc3sc(Cl)cc32)ccc1[N+](=O)[O-] ZINC000570766044 568523532 /nfs/dbraw/zinc/52/35/32/568523532.db2.gz FFYWOZKUVOBOOR-JTQLQIEISA-N 0 0 352.799 3.736 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@H](CC)c2ccc(OC)cc2)c1 ZINC000570809391 568531076 /nfs/dbraw/zinc/53/10/76/568531076.db2.gz WOLIEPMLTNBTEC-QGZVFWFLSA-N 0 0 358.394 3.883 20 5 FHBDRN CCS[C@H]1CCC[C@H](NC(=O)CCCNc2ccc([N+](=O)[O-])cc2)C1 ZINC000482248547 568533164 /nfs/dbraw/zinc/53/31/64/568533164.db2.gz WRDRFCQBJHIZCQ-RDJZCZTQSA-N 0 0 365.499 3.967 20 5 FHBDRN CCn1ncc2ccc(NC(=O)CSc3ccccc3[N+](=O)[O-])cc21 ZINC000490396826 568551854 /nfs/dbraw/zinc/55/18/54/568551854.db2.gz HITLSWACBZZMFL-UHFFFAOYSA-N 0 0 356.407 3.695 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H](C)[C@H]1COc2ccccc21 ZINC000570890678 568612629 /nfs/dbraw/zinc/61/26/29/568612629.db2.gz WYHWJRRISRWLTG-MLGOLLRUSA-N 0 0 355.394 3.843 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])s1)N1CCC(c2nc3c(cccc3F)[nH]2)CC1 ZINC000365400107 568619684 /nfs/dbraw/zinc/61/96/84/568619684.db2.gz ZVDGLVXYRIDNBH-UHFFFAOYSA-N 0 0 374.397 3.692 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CN(Cc1ccco1)Cc1cccnc1 ZINC000182050956 568701276 /nfs/dbraw/zinc/70/12/76/568701276.db2.gz MXWDCHYREDYPGT-UHFFFAOYSA-N 0 0 353.378 3.794 20 5 FHBDRN CC[C@H](Nc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-])c1cccc(Cl)c1 ZINC000820925485 599095212 /nfs/dbraw/zinc/09/52/12/599095212.db2.gz IUTQLCJOPCCYGG-ZDUSSCGKSA-N 0 0 358.789 3.992 20 5 FHBDRN CCOc1ccccc1[C@@H](CC)Nc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-] ZINC000736653720 598246429 /nfs/dbraw/zinc/24/64/29/598246429.db2.gz LNZMJNYJDOCKJW-CQSZACIVSA-N 0 0 368.397 3.737 20 5 FHBDRN C[C@@H](Nc1nc2ccc([N+](=O)[O-])cc2s1)c1cccc(-c2nn[nH]n2)c1 ZINC000820462510 599351845 /nfs/dbraw/zinc/35/18/45/599351845.db2.gz YAWVQJAEOQTGLU-SECBINFHSA-N 0 0 367.394 3.558 20 5 FHBDRN O=C([O-])[C@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1ccccc1C(F)(F)F ZINC000739500062 599792208 /nfs/dbraw/zinc/79/22/08/599792208.db2.gz NPLDMEXAWMTOHB-OAHLLOKOSA-N 0 0 368.311 3.572 20 5 FHBDRN C[NH+](C)[C@@H](CNc1cc(Cl)c(C(=O)[O-])cc1[N+](=O)[O-])c1cccs1 ZINC000737357748 600942142 /nfs/dbraw/zinc/94/21/42/600942142.db2.gz DDEZDJDZEXJPON-ZDUSSCGKSA-N 0 0 369.830 3.723 20 5 FHBDRN O=C([O-])/C=C/c1ccc(NC2CC[NH+](C3CCCC3)CC2)c([N+](=O)[O-])c1 ZINC000833195240 601210263 /nfs/dbraw/zinc/21/02/63/601210263.db2.gz DMAGXSFXUOYKQS-SOFGYWHQSA-N 0 0 359.426 3.512 20 5 FHBDRN CC[C@H]([NH2+]Cc1cc(C)c(OCC(=O)[O-])c(C)c1)c1cccc([N+](=O)[O-])c1 ZINC000828988763 601265902 /nfs/dbraw/zinc/26/59/02/601265902.db2.gz DAQYOWRMFKKADU-SFHVURJKSA-N 0 0 372.421 3.916 20 5 FHBDRN C[C@@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C[C@H]1C(=O)[O-] ZINC000833628948 604665755 /nfs/dbraw/zinc/66/57/55/604665755.db2.gz CUDJETDLCNATKJ-QMTHXVAHSA-N 0 0 364.785 3.661 20 5 FHBDRN O=[N+]([O-])c1ccc2oc(C(Cl)=Cc3ccc(-c4nn[nH]n4)s3)nc2c1 ZINC000823644199 606339965 /nfs/dbraw/zinc/33/99/65/606339965.db2.gz GPMBZNJPHJGEEC-RMKNXTFCSA-N 0 0 374.769 3.715 20 5 FHBDRN COc1ccc(OCC(=O)Nc2ccc(C(F)(F)F)cc2)c([N+](=O)[O-])c1 ZINC000005051613 936315085 /nfs/dbraw/zinc/31/50/85/936315085.db2.gz QZJVYFJFKGHNSS-UHFFFAOYSA-N 0 0 370.283 3.640 20 5 FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1cscc1C ZINC000162056395 936341551 /nfs/dbraw/zinc/34/15/51/936341551.db2.gz ANAXWSITMGZJJC-UHFFFAOYSA-N 0 0 352.437 3.956 20 5 FHBDRN Cc1cc(F)c(-c2nc(CCNc3ccccc3[N+](=O)[O-])no2)cc1F ZINC000612929820 936344140 /nfs/dbraw/zinc/34/41/40/936344140.db2.gz AFKNWASQXOOZMI-UHFFFAOYSA-N 0 0 360.320 3.886 20 5 FHBDRN Cc1cc(S(=O)(=O)N2CC[C@H]2c2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000511223873 936356934 /nfs/dbraw/zinc/35/69/34/936356934.db2.gz SRNQRJPLWSLKCQ-INIZCTEOSA-N 0 0 366.826 3.692 20 5 FHBDRN Cc1ccc2c(Cc3nc(-c4ncc(F)cc4[N+](=O)[O-])no3)c[nH]c2c1 ZINC001211564092 936369002 /nfs/dbraw/zinc/36/90/02/936369002.db2.gz NETMNUOCCWAOEV-UHFFFAOYSA-N 0 0 353.313 3.559 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N1CCCC2(CCOCC2)C1 ZINC000278035567 936387188 /nfs/dbraw/zinc/38/71/88/936387188.db2.gz RMCQYOTVLDTTIF-UHFFFAOYSA-N 0 0 352.818 3.589 20 5 FHBDRN COc1cccc(CCNC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)c1 ZINC000437142366 945063957 /nfs/dbraw/zinc/06/39/57/945063957.db2.gz GDEKERPZOKINIB-UHFFFAOYSA-N 0 0 368.311 3.595 20 5 FHBDRN COc1ccc(CCNC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)cc1 ZINC000437143233 945064247 /nfs/dbraw/zinc/06/42/47/945064247.db2.gz DIJFJZXJVAZIGU-UHFFFAOYSA-N 0 0 368.311 3.595 20 5 FHBDRN CC(C)(C)[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)CCO1 ZINC000509554390 945067916 /nfs/dbraw/zinc/06/79/16/945067916.db2.gz GPWBCAUMWNLTSG-ZDUSSCGKSA-N 0 0 360.332 3.501 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@@H]1Cc1ccccc1 ZINC000439903708 945068711 /nfs/dbraw/zinc/06/87/11/945068711.db2.gz RCGUKMGRPOQBRS-OAHLLOKOSA-N 0 0 355.394 3.842 20 5 FHBDRN Cc1sc(C(=O)NCc2ccc(OC(F)F)c(F)c2)cc1[N+](=O)[O-] ZINC000511229453 937085369 /nfs/dbraw/zinc/08/53/69/937085369.db2.gz QAHRKLYGMVVMGK-UHFFFAOYSA-N 0 0 360.313 3.635 20 5 FHBDRN COc1cccc(F)c1[C@H](C)NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000136024484 937093772 /nfs/dbraw/zinc/09/37/72/937093772.db2.gz DLZSWKBNWMDOGX-NSHDSACASA-N 0 0 371.368 3.644 20 5 FHBDRN O=C(Nc1cc2c(cc1F)NC(=O)CC2)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000122050837 937105335 /nfs/dbraw/zinc/10/53/35/937105335.db2.gz KZGJSLIZKPJLCW-UHFFFAOYSA-N 0 0 363.732 3.524 20 5 FHBDRN O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1ccc(F)c(F)c1F ZINC000176382291 937114240 /nfs/dbraw/zinc/11/42/40/937114240.db2.gz OOTYBFOLJHDFGH-UHFFFAOYSA-N 0 0 362.210 3.866 20 5 FHBDRN CSCCCCCNC(=O)c1sc(Br)cc1[N+](=O)[O-] ZINC000278077335 937118166 /nfs/dbraw/zinc/11/81/66/937118166.db2.gz OQGBZQZAQDFXJT-UHFFFAOYSA-N 0 0 367.290 3.682 20 5 FHBDRN CCO[C@@H](CCNC(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)C(C)C ZINC000176396568 937126827 /nfs/dbraw/zinc/12/68/27/937126827.db2.gz XXRNRUXRQNNBIN-YOEHRIQHSA-N 0 0 351.447 3.715 20 5 FHBDRN Cc1cc(C(=O)NCc2csc(Br)c2)cc([N+](=O)[O-])c1 ZINC000049476987 927076678 /nfs/dbraw/zinc/07/66/78/927076678.db2.gz XOXIDGCJDYZFCS-UHFFFAOYSA-N 0 0 355.213 3.657 20 5 FHBDRN CO[C@](C)([C@H](C)NC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1)C1CC1 ZINC000579684961 927078488 /nfs/dbraw/zinc/07/84/88/927078488.db2.gz VNZAYFOXCKZUPW-WHEQGISXSA-N 0 0 364.445 3.615 20 5 FHBDRN C[C@@H](NC(=O)Cc1ccccc1[N+](=O)[O-])c1ccc(OC(F)F)cc1 ZINC000044616932 927092903 /nfs/dbraw/zinc/09/29/03/927092903.db2.gz IHVNXSNHLJXLOM-LLVKDONJSA-N 0 0 350.321 3.616 20 5 FHBDRN COc1cc(CNc2ccc([N+](=O)[O-])c(C(C)=O)c2)c2ccccc2n1 ZINC000557585701 927109003 /nfs/dbraw/zinc/10/90/03/927109003.db2.gz XUSNTWOQSSPTRY-UHFFFAOYSA-N 0 0 351.362 3.966 20 5 FHBDRN CCC[C@H](Cc1ccccc1)NC(=O)c1cc(OC)c(OC)c([N+](=O)[O-])c1 ZINC000610173991 927119958 /nfs/dbraw/zinc/11/99/58/927119958.db2.gz APNUDWOEIAXGHR-MRXNPFEDSA-N 0 0 372.421 3.753 20 5 FHBDRN COc1ccc(CN[C@H](C)c2nc(C(F)(F)F)cs2)cc1[N+](=O)[O-] ZINC000274568088 927156350 /nfs/dbraw/zinc/15/63/50/927156350.db2.gz HCUNLQJXWWHFOZ-MRVPVSSYSA-N 0 0 361.345 3.930 20 5 FHBDRN CCOc1ccc(-c2noc(COc3cc(F)ccc3[N+](=O)[O-])n2)cc1 ZINC000046583751 937139543 /nfs/dbraw/zinc/13/95/43/937139543.db2.gz FIQCCZKBQMWENN-UHFFFAOYSA-N 0 0 359.313 3.762 20 5 FHBDRN CC[C@H](C)[C@H]1CCCCN1C(=O)c1cc(OC)c(OC)c([N+](=O)[O-])c1 ZINC000610175688 927213081 /nfs/dbraw/zinc/21/30/81/927213081.db2.gz RLUWCEVOUOUTSG-GXTWGEPZSA-N 0 0 350.415 3.653 20 5 FHBDRN CCCc1[nH]nc(C(=O)Nc2ccc3ccn(CCC)c3c2)c1[N+](=O)[O-] ZINC000175281048 927255719 /nfs/dbraw/zinc/25/57/19/927255719.db2.gz NCOTUKSCYDKQCJ-UHFFFAOYSA-N 0 0 355.398 3.887 20 5 FHBDRN CO[C@@H](c1ccccc1F)[C@@H](C)Nc1ncnc2sc([N+](=O)[O-])cc21 ZINC000557646128 927275207 /nfs/dbraw/zinc/27/52/07/927275207.db2.gz ZSXPZAPNQMWANZ-YMTOWFKASA-N 0 0 362.386 3.927 20 5 FHBDRN C[C@H](C(=O)N[C@@H]1CCCN(C)c2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000583128201 937150176 /nfs/dbraw/zinc/15/01/76/937150176.db2.gz QXZHURWSWOUQMV-KBXCAEBGSA-N 0 0 353.422 3.786 20 5 FHBDRN CO[C@@H](CNC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-])C1CCCCC1 ZINC000598439087 927305123 /nfs/dbraw/zinc/30/51/23/927305123.db2.gz FIHSXUZIMLXZFM-HNNXBMFYSA-N 0 0 374.359 3.939 20 5 FHBDRN Cc1c(C(=O)N[C@H]2CCCN(c3ccccc3Cl)C2)cccc1[N+](=O)[O-] ZINC000610178504 927323559 /nfs/dbraw/zinc/32/35/59/927323559.db2.gz DTAFPYVENNXQGD-AWEZNQCLSA-N 0 0 373.840 3.955 20 5 FHBDRN O=C(Cc1ccc(F)cc1[N+](=O)[O-])Nc1cc(Br)ccc1F ZINC001125277478 927334101 /nfs/dbraw/zinc/33/41/01/927334101.db2.gz LCEZHZQCWPBVBE-UHFFFAOYSA-N 0 0 371.137 3.817 20 5 FHBDRN Cc1c(CC(=O)N[C@H]2CCC[C@H]2OCc2ccccc2)cccc1[N+](=O)[O-] ZINC000133656362 927350486 /nfs/dbraw/zinc/35/04/86/927350486.db2.gz DWCZOSDXQXVABC-AZUAARDMSA-N 0 0 368.433 3.700 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCOC[C@H]2C[C@H](O)c2ccccc2)c(Cl)c1 ZINC000153929890 937156353 /nfs/dbraw/zinc/15/63/53/937156353.db2.gz QELGPLNCACFHGJ-QAPCUYQASA-N 0 0 362.813 3.577 20 5 FHBDRN COc1ccccc1[C@]1(C)C[C@@H]1NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000610181879 927393662 /nfs/dbraw/zinc/39/36/62/927393662.db2.gz KRSAKSSPFFKKTL-HKUYNNGSSA-N 0 0 374.824 3.646 20 5 FHBDRN COc1ccccc1[C@]1(C)C[C@H]1NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000610181882 927394186 /nfs/dbraw/zinc/39/41/86/927394186.db2.gz KRSAKSSPFFKKTL-MJGOQNOKSA-N 0 0 374.824 3.646 20 5 FHBDRN Cc1cc(C(=O)Nc2cc(Br)ccc2O)ccc1[N+](=O)[O-] ZINC000176437680 937162528 /nfs/dbraw/zinc/16/25/28/937162528.db2.gz KUKHKANMAOCGMK-UHFFFAOYSA-N 0 0 351.156 3.624 20 5 FHBDRN C[C@@H](CC(=O)c1ccccc1F)C(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000079635922 937162605 /nfs/dbraw/zinc/16/26/05/937162605.db2.gz ABEFNEMPUGSPPS-STQMWFEESA-N 0 0 358.369 3.820 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)Nc1nc2cccc(Cl)c2n1C ZINC000471115201 927454007 /nfs/dbraw/zinc/45/40/07/927454007.db2.gz HKLPBKYUYBNWHQ-UHFFFAOYSA-N 0 0 374.784 3.786 20 5 FHBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)N[C@H](c1ccccc1)C(F)(F)F ZINC000120158105 927465971 /nfs/dbraw/zinc/46/59/71/927465971.db2.gz VOWAXCHVIWRFTP-OAHLLOKOSA-N 0 0 367.327 3.740 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1Cl)N1CC[C@]2(C1)OCc1ccccc12 ZINC000186892649 927477873 /nfs/dbraw/zinc/47/78/73/927477873.db2.gz ZWQSIWVECOUVGS-GOSISDBHSA-N 0 0 358.781 3.520 20 5 FHBDRN COc1ccc(C[C@H](C)CNC(=O)c2cccc(SC)c2[N+](=O)[O-])cc1 ZINC000186897369 927517002 /nfs/dbraw/zinc/51/70/02/927517002.db2.gz FPAREIZYQDGNHS-ZDUSSCGKSA-N 0 0 374.462 3.934 20 5 FHBDRN O=c1c(Br)cc([N+](=O)[O-])cn1Cc1cccc2ccccc21 ZINC000120178734 927537060 /nfs/dbraw/zinc/53/70/60/927537060.db2.gz GMIJSHKZBMBQKV-UHFFFAOYSA-N 0 0 359.179 3.721 20 5 FHBDRN Cc1ccc(Oc2ccc(NC(=O)Cc3ccccc3[N+](=O)[O-])cc2)nn1 ZINC000610184335 927547723 /nfs/dbraw/zinc/54/77/23/927547723.db2.gz SFWDPKOJTHFXFN-UHFFFAOYSA-N 0 0 364.361 3.667 20 5 FHBDRN Cc1ccc(Oc2ccc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)cc2)nn1 ZINC000610184285 927548281 /nfs/dbraw/zinc/54/82/81/927548281.db2.gz OIYSDWUVMTZORD-UHFFFAOYSA-N 0 0 368.324 3.877 20 5 FHBDRN O=C(c1c(Cl)cccc1[N+](=O)[O-])N1CC[C@]2(C1)OCc1ccccc12 ZINC000186913209 927573973 /nfs/dbraw/zinc/57/39/73/927573973.db2.gz CXCVZHRHUBZBAB-GOSISDBHSA-N 0 0 358.781 3.520 20 5 FHBDRN CCO[C@H]1C[C@H](NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C12CCC2 ZINC000610185965 927575442 /nfs/dbraw/zinc/57/54/42/927575442.db2.gz XOIVEZLBVVGRSV-HOTGVXAUSA-N 0 0 360.435 3.887 20 5 FHBDRN COc1ccc(NC(=O)Nc2cnn(C3CCCC3)c2C)cc1[N+](=O)[O-] ZINC000278104097 937180080 /nfs/dbraw/zinc/18/00/80/937180080.db2.gz REPKVDGBHQOYNK-UHFFFAOYSA-N 0 0 359.386 3.867 20 5 FHBDRN C[C@H](OC(=O)c1nc(Br)cs1)c1ccccc1[N+](=O)[O-] ZINC000784923065 927591436 /nfs/dbraw/zinc/59/14/36/927591436.db2.gz QMXUHSZRXRCTQM-ZETCQYMHSA-N 0 0 357.185 3.732 20 5 FHBDRN Nc1cc([N+](=O)[O-])ccc1C(=O)OCc1cc2ccccc2nc1Cl ZINC000023394751 927630315 /nfs/dbraw/zinc/63/03/15/927630315.db2.gz OTMGSFKVMMNCHR-UHFFFAOYSA-N 0 0 357.753 3.736 20 5 FHBDRN Cc1cc(=O)c2cc(NC(=O)c3ccc([N+](=O)[O-])cc3Cl)ccc2[nH]1 ZINC000430186218 927657837 /nfs/dbraw/zinc/65/78/37/927657837.db2.gz MGXWVWFEFZFDDQ-UHFFFAOYSA-N 0 0 357.753 3.650 20 5 FHBDRN COc1cccc(C(=O)Oc2ccc(Br)cc2C)c1[N+](=O)[O-] ZINC001266282260 927738679 /nfs/dbraw/zinc/73/86/79/927738679.db2.gz UEPBBYVNPVVMRP-UHFFFAOYSA-N 0 0 366.167 3.894 20 5 FHBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1Cc2ccccc2C[C@H]1C ZINC000610189195 927776027 /nfs/dbraw/zinc/77/60/27/927776027.db2.gz WYMVSIHCFHMQSR-CHWSQXEVSA-N 0 0 374.824 3.989 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(Cc1ccccc1)[C@H](C)C1CC1 ZINC000006314011 927779773 /nfs/dbraw/zinc/77/97/73/927779773.db2.gz RWWJIZMYUOUEDY-OAHLLOKOSA-N 0 0 374.462 3.893 20 5 FHBDRN CCNC(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2SC)c(C)c1 ZINC001125286452 927797500 /nfs/dbraw/zinc/79/75/00/927797500.db2.gz ZGWSWEHNZUVJRJ-UHFFFAOYSA-N 0 0 373.434 3.627 20 5 FHBDRN Cc1c(NC(=O)N(CCO)[C@H]2CCCc3ccccc32)cccc1[N+](=O)[O-] ZINC000175303149 927817684 /nfs/dbraw/zinc/81/76/84/927817684.db2.gz GFBBNIWVBFKEMY-IBGZPJMESA-N 0 0 369.421 3.807 20 5 FHBDRN C[C@]1(c2ccccc2)C[C@@H]1NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000610190384 927823537 /nfs/dbraw/zinc/82/35/37/927823537.db2.gz LKOBRPDNFJPNJT-PZJWPPBQSA-N 0 0 365.433 3.655 20 5 FHBDRN O=[N+]([O-])c1ccc(CC[N@@H+]2CCC[C@H]2c2nnc(-c3ccccc3)[n-]2)cc1 ZINC000120241221 927833250 /nfs/dbraw/zinc/83/32/50/927833250.db2.gz OGJJZIITGMMBGU-SFHVURJKSA-N 0 0 363.421 3.760 20 5 FHBDRN CCC[C@H]1CN(C(=O)c2cccc3c(=O)c4ccccc4[nH]c23)CCO1 ZINC000278111178 937198318 /nfs/dbraw/zinc/19/83/18/937198318.db2.gz RSWUCBSTKMQSHB-AWEZNQCLSA-N 0 0 350.418 3.735 20 5 FHBDRN C[C@@H]1CO[C@@H](c2cccc(Cl)c2)CN1C(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000187024343 927851759 /nfs/dbraw/zinc/85/17/59/927851759.db2.gz XNRUGJQGXFTPFL-FZKQIMNGSA-N 0 0 374.824 3.779 20 5 FHBDRN CC(C)(C)Oc1ccc(CNC(=O)CCOc2ccccc2[N+](=O)[O-])cc1 ZINC000145997601 937199560 /nfs/dbraw/zinc/19/95/60/937199560.db2.gz YTKBWHYUIWHLFC-UHFFFAOYSA-N 0 0 372.421 3.857 20 5 FHBDRN COC(=O)c1ccc(SCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1 ZINC000042641297 927871047 /nfs/dbraw/zinc/87/10/47/927871047.db2.gz MXFGSRZSDBNZQJ-UHFFFAOYSA-N 0 0 371.374 3.724 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)ccc1CN1CCSC[C@H]1c1nccs1 ZINC000187049616 927886717 /nfs/dbraw/zinc/88/67/17/927886717.db2.gz HLEDWJHKDBZYOR-ZDUSSCGKSA-N 0 0 355.872 3.995 20 5 FHBDRN COc1cc(C(=O)N2CCC[C@H]2CC(C)(C)C)cc([N+](=O)[O-])c1OC ZINC000610196921 927914967 /nfs/dbraw/zinc/91/49/67/927914967.db2.gz NQBDZHFMJPLMFW-ZDUSSCGKSA-N 0 0 350.415 3.653 20 5 FHBDRN CSc1cccc(C(=O)N2C[C@H](C)Oc3c(F)cccc32)c1[N+](=O)[O-] ZINC000187109325 927919600 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CC(C)OCc1cc(NC(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)ccc1O ZINC000583176210 937211783 /nfs/dbraw/zinc/21/17/83/937211783.db2.gz JYLISNHZNQBRFB-ZDUSSCGKSA-N 0 0 358.394 3.968 20 5 FHBDRN O=C(OCCSc1ccc([N+](=O)[O-])cc1)c1ccc(-n2ccnc2)cc1 ZINC000784933926 928019285 /nfs/dbraw/zinc/01/92/85/928019285.db2.gz FBFINFHVPYIFDB-UHFFFAOYSA-N 0 0 369.402 3.730 20 5 FHBDRN C[C@@H]1CO[C@H](c2cccc(Cl)c2)CN1C(=O)c1csc([N+](=O)[O-])c1 ZINC000187072086 928019610 /nfs/dbraw/zinc/01/96/10/928019610.db2.gz PNETZFAPTMKFJM-YGRLFVJLSA-N 0 0 366.826 3.912 20 5 FHBDRN Cc1cc(C(=O)OCCSc2ccc([N+](=O)[O-])cc2)nn1C(C)(C)C ZINC000784935173 928020100 /nfs/dbraw/zinc/02/01/00/928020100.db2.gz JGRLADGPTBTHOG-UHFFFAOYSA-N 0 0 363.439 3.804 20 5 FHBDRN Cc1noc(C(F)F)c1C(=O)OCCSc1ccc([N+](=O)[O-])cc1 ZINC000784936045 928029216 /nfs/dbraw/zinc/02/92/16/928029216.db2.gz FACRDKFBZZRJCA-UHFFFAOYSA-N 0 0 358.322 3.778 20 5 FHBDRN O=C([C@@H]1CCOc2ccccc21)N1CCS[C@@H]1c1ccc([N+](=O)[O-])cc1 ZINC000610209977 928072994 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FHBDRN COc1ccc(C(=O)Nc2cc(C)nn2-c2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000610222329 928287135 /nfs/dbraw/zinc/28/71/35/928287135.db2.gz LYIUVMNDOPVVKF-UHFFFAOYSA-N 0 0 366.377 3.658 20 5 FHBDRN C[C@H](NC(=O)Cc1cccc([N+](=O)[O-])c1)c1ccccc1OC(F)F ZINC000610223572 928302980 /nfs/dbraw/zinc/30/29/80/928302980.db2.gz ZKYHXYXSTPJNGQ-NSHDSACASA-N 0 0 350.321 3.616 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1CN1CCO[C@H](c2ccccc2Cl)C1 ZINC000430224756 928309752 /nfs/dbraw/zinc/30/97/52/928309752.db2.gz LGPKNFUWZDUSSQ-SFHVURJKSA-N 0 0 362.813 3.830 20 5 FHBDRN CN(CCCOc1cccc(Cl)c1)C(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000610224964 928309777 /nfs/dbraw/zinc/30/97/77/928309777.db2.gz PNHGOJNPCXCJII-UHFFFAOYSA-N 0 0 362.813 3.718 20 5 FHBDRN O=C(OCCSc1ccc([N+](=O)[O-])cc1)[C@H]1Cc2ccccc2S1 ZINC000784938769 928314118 /nfs/dbraw/zinc/31/41/18/928314118.db2.gz PYZDYSKGRBZIPM-MRXNPFEDSA-N 0 0 361.444 3.947 20 5 FHBDRN O=C(Cc1cccc([N+](=O)[O-])c1)NCCCc1cccc(C(F)(F)F)c1 ZINC000610226054 928319789 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20 5 FHBDRN COc1ccccc1[C@@H]1CCCCN1C(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000610227784 928356610 /nfs/dbraw/zinc/35/66/10/928356610.db2.gz LKLYICVHISTQTH-SFHVURJKSA-N 0 0 354.406 3.900 20 5 FHBDRN Cc1cc(C)c(C(=O)NCc2cccc([N+](=O)[O-])c2C)c(OC2CCC2)n1 ZINC000471164078 928373367 /nfs/dbraw/zinc/37/33/67/928373367.db2.gz DLHDDPCZASWOSO-UHFFFAOYSA-N 0 0 369.421 3.776 20 5 FHBDRN C[C@H](NC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)OCO2 ZINC000175339717 928382936 /nfs/dbraw/zinc/38/29/36/928382936.db2.gz SGIGPSVQLDPQRW-LBPRGKRZSA-N 0 0 371.393 3.619 20 5 FHBDRN CC(C)(C)c1csc(CSCc2ccc(C(N)=O)cc2[N+](=O)[O-])n1 ZINC000127024786 928397139 /nfs/dbraw/zinc/39/71/39/928397139.db2.gz LZWRAXNUFYFJSQ-UHFFFAOYSA-N 0 0 365.480 3.881 20 5 FHBDRN CCOC(=O)[C@@H]1CCN(Cc2ccc([N+](=O)[O-])cc2OC)c2ccccc21 ZINC000430239026 928405041 /nfs/dbraw/zinc/40/50/41/928405041.db2.gz AEYJTVNDQLTTAQ-QGZVFWFLSA-N 0 0 370.405 3.660 20 5 FHBDRN C[C@H]1C[C@H](c2ccccc2)N(c2sc(S(C)(=O)=O)cc2[N+](=O)[O-])C1 ZINC000286235507 928432118 /nfs/dbraw/zinc/43/21/18/928432118.db2.gz CPCXZEKRYRGUBG-WCQYABFASA-N 0 0 366.464 3.647 20 5 FHBDRN Cc1ccc(NC(=O)NC[C@@H](C[C@@H](C)O)c2ccccc2)cc1[N+](=O)[O-] ZINC000127065249 928499987 /nfs/dbraw/zinc/49/99/87/928499987.db2.gz BTIVKJQHWXSHLM-GDBMZVCRSA-N 0 0 357.410 3.579 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@H]2CCCCN2c2ccccc21 ZINC000583223908 937254786 /nfs/dbraw/zinc/25/47/86/937254786.db2.gz JDHYTKNGBFBBAM-MRXNPFEDSA-N 0 0 351.406 3.923 20 5 FHBDRN COc1ccc(C=O)cc1COc1ccc(Br)cc1[N+](=O)[O-] ZINC000006406465 928590557 /nfs/dbraw/zinc/59/05/57/928590557.db2.gz XRJULRIIZFSPBM-UHFFFAOYSA-N 0 0 366.167 3.757 20 5 FHBDRN COc1ccc([C@H](NC(=O)CCNc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000248146327 937263554 /nfs/dbraw/zinc/26/35/54/937263554.db2.gz SPOJAZFYKXAUCY-HXUWFJFHSA-N 0 0 369.421 3.673 20 5 FHBDRN CC(=O)[C@@H](C)CCCCC(=O)N(C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000154278003 928673521 /nfs/dbraw/zinc/67/35/21/928673521.db2.gz IOSNQBFWKUMCSL-LBPRGKRZSA-N 0 0 354.834 3.992 20 5 FHBDRN Cc1c(Br)cc(C(=O)N[C@H]2CC23CCCC3)cc1[N+](=O)[O-] ZINC000430253886 928741610 /nfs/dbraw/zinc/74/16/10/928741610.db2.gz AXVYPIQDPCMGCL-ZDUSSCGKSA-N 0 0 353.216 3.728 20 5 FHBDRN O=C(NCCc1nc2ccccc2s1)c1c[nH]c2ccc([N+](=O)[O-])cc21 ZINC000161618523 937280017 /nfs/dbraw/zinc/28/00/17/937280017.db2.gz BYTDBISVYIFMBS-UHFFFAOYSA-N 0 0 366.402 3.658 20 5 FHBDRN O=C(N[C@H](CC1CC1)c1ccccc1)c1cc([N+](=O)[O-])cc2c1OCCO2 ZINC000610236122 928869839 /nfs/dbraw/zinc/86/98/39/928869839.db2.gz KCJRITQIHMOFQW-QGZVFWFLSA-N 0 0 368.389 3.637 20 5 FHBDRN O=C(c1ccccc1Oc1ccncc1)N1CCc2c1cccc2[N+](=O)[O-] ZINC000509411047 928892857 /nfs/dbraw/zinc/89/28/57/928892857.db2.gz QMLZODDLNKIROP-UHFFFAOYSA-N 0 0 361.357 3.985 20 5 FHBDRN COc1ccc(CC(=O)Nc2ccccc2CC(F)(F)F)cc1[N+](=O)[O-] ZINC000610235655 928911826 /nfs/dbraw/zinc/91/18/26/928911826.db2.gz NEQKTJFRFJBPKB-UHFFFAOYSA-N 0 0 368.311 3.889 20 5 FHBDRN Cc1c(NC(=O)N[C@H](C)c2noc(-c3ccccc3)n2)cccc1[N+](=O)[O-] ZINC000134479093 928946224 /nfs/dbraw/zinc/94/62/24/928946224.db2.gz BWASGTHOWKQUFN-GFCCVEGCSA-N 0 0 367.365 3.836 20 5 FHBDRN Cc1nc(C2(NC(=O)Nc3c(C)ccc([N+](=O)[O-])c3C)CCCCC2)no1 ZINC000274874991 928947353 /nfs/dbraw/zinc/94/73/53/928947353.db2.gz GGMPVSNNJDRBOD-UHFFFAOYSA-N 0 0 373.413 3.884 20 5 FHBDRN COc1ccc(OCCOc2cnc3ccc(F)cc3c2)c([N+](=O)[O-])c1 ZINC000509746572 928978540 /nfs/dbraw/zinc/97/85/40/928978540.db2.gz PVBRBBCMKBOHAL-UHFFFAOYSA-N 0 0 358.325 3.749 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)NCCc2c(C)cccc2C)cc1SC ZINC000165012568 929061193 /nfs/dbraw/zinc/06/11/93/929061193.db2.gz VSAOXDRPGZTKKW-UHFFFAOYSA-N 0 0 374.462 3.915 20 5 FHBDRN O=C(c1csc([N+](=O)[O-])c1)N1CCC(c2ccc(F)c(F)c2)CC1 ZINC000609183224 929061332 /nfs/dbraw/zinc/06/13/32/929061332.db2.gz MNXPJUPPMQOTNJ-UHFFFAOYSA-N 0 0 352.362 3.954 20 5 FHBDRN O=C(CSc1ccccc1[N+](=O)[O-])N1CCCO[C@H](c2ccccc2)C1 ZINC000609233123 929088776 /nfs/dbraw/zinc/08/87/76/929088776.db2.gz QTCACUUILVVSLQ-KRWDZBQOSA-N 0 0 372.446 3.677 20 5 FHBDRN CC[C@H](C)c1ccc(NC(=O)Cn2c(=O)oc3ccc([N+](=O)[O-])cc32)cc1 ZINC000248200658 937300938 /nfs/dbraw/zinc/30/09/38/937300938.db2.gz VOCLUDBBLIZKCJ-LBPRGKRZSA-N 0 0 369.377 3.655 20 5 FHBDRN CCOc1cc2c(cc1[C@@H]1C[C@H]1Nc1cccnc1[N+](=O)[O-])O[C@H](C)C2 ZINC000609351078 929112485 /nfs/dbraw/zinc/11/24/85/929112485.db2.gz HWTZSPHAZRLOTC-PVXIVEMSSA-N 0 0 355.394 3.680 20 5 FHBDRN O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])OCc1cccnc1 ZINC000161626263 937304177 /nfs/dbraw/zinc/30/41/77/937304177.db2.gz WNEQLGLWLMALME-UHFFFAOYSA-N 0 0 369.299 3.554 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)NC[C@H]2CCN(c3ccc(Cl)cc3)C2)c1 ZINC000610238847 929142562 /nfs/dbraw/zinc/14/25/62/929142562.db2.gz RFUYNJYYYMLICX-CQSZACIVSA-N 0 0 373.840 3.813 20 5 FHBDRN CC(C)(C)OCc1cc(CNCc2cc(Cl)ccc2[N+](=O)[O-])no1 ZINC000275005215 929158883 /nfs/dbraw/zinc/15/88/83/929158883.db2.gz OUFCXQKORDTXES-UHFFFAOYSA-N 0 0 353.806 3.841 20 5 FHBDRN COc1ccc(CC(=O)N(C)CC(C)(C)c2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000610238516 929172343 /nfs/dbraw/zinc/17/23/43/929172343.db2.gz MAJJCEJUQOZWFU-UHFFFAOYSA-N 0 0 370.449 3.891 20 5 FHBDRN CO[C@@H](c1ccc(Cl)cc1)[C@@H](C)NC(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000127106442 929198953 /nfs/dbraw/zinc/19/89/53/929198953.db2.gz WFRSSLZNTUXWCX-KZULUSFZSA-N 0 0 362.813 3.683 20 5 FHBDRN COc1cccc(Cc2cnc(NC(=O)c3ccc([N+](=O)[O-])cc3)s2)c1 ZINC000023488747 929200416 /nfs/dbraw/zinc/20/04/16/929200416.db2.gz AJUUNZAHRWHNRX-UHFFFAOYSA-N 0 0 369.402 3.903 20 5 FHBDRN O=[N+]([O-])c1ccc(NCc2cnn(Cc3ccccc3)c2)c2ccncc21 ZINC000052243925 937313268 /nfs/dbraw/zinc/31/32/68/937313268.db2.gz LWEGGYIQRYGWEZ-UHFFFAOYSA-N 0 0 359.389 4.000 20 5 FHBDRN C[C@@H]1CCCCCN1S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC001211572488 937313617 /nfs/dbraw/zinc/31/36/17/937313617.db2.gz MJSBBRGALYPFEX-SNVBAGLBSA-N 0 0 366.361 3.567 20 5 FHBDRN C[C@H](NC(=O)c1ccc(Cl)cc1[N+](=O)[O-])c1cnn(CC2CCC2)c1 ZINC000890678184 929239648 /nfs/dbraw/zinc/23/96/48/929239648.db2.gz WEAQCBLLZITDDN-NSHDSACASA-N 0 0 362.817 3.736 20 5 FHBDRN Cc1ccc(OCCCC(=O)N(C)c2ccc([N+](=O)[O-])nc2)c(Cl)c1 ZINC000583286605 937314990 /nfs/dbraw/zinc/31/49/90/937314990.db2.gz WYNHHDABNWMKRP-UHFFFAOYSA-N 0 0 363.801 3.774 20 5 FHBDRN CC1=C[C@H](C)CN(CC(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)C1 ZINC000430284054 929251377 /nfs/dbraw/zinc/25/13/77/929251377.db2.gz KHIAZKJNWJYEMG-LBPRGKRZSA-N 0 0 372.450 3.555 20 5 FHBDRN C[C@H](c1ccc([S@@](C)=O)cc1)N(C)C(=O)/C=C\c1ccc([N+](=O)[O-])cc1 ZINC000255026119 929253874 /nfs/dbraw/zinc/25/38/74/929253874.db2.gz HDBBICCZYLSTOF-WHPKBXMUSA-N 0 0 372.446 3.565 20 5 FHBDRN COc1ccc(C(=O)NCCc2ccccc2[N+](=O)[O-])c(OCC(C)C)c1 ZINC000467990519 929364402 /nfs/dbraw/zinc/36/44/02/929364402.db2.gz MSRZJXQNEQSQRB-UHFFFAOYSA-N 0 0 372.421 3.611 20 5 FHBDRN O=C(Nc1ccc2nnc(C3CCC3)n2c1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000187188015 929389877 /nfs/dbraw/zinc/38/98/77/929389877.db2.gz BRHZERGRJAPACC-UHFFFAOYSA-N 0 0 371.784 3.811 20 5 FHBDRN O=C(Nc1n[nH]c2ccc([N+](=O)[O-])cc21)c1cc(F)c(Cl)cc1F ZINC000127112984 929447311 /nfs/dbraw/zinc/44/73/11/929447311.db2.gz QENWQKCZNZWYPR-UHFFFAOYSA-N 0 0 352.684 3.655 20 5 FHBDRN Cc1cccc(N2C(=O)C(=Cc3csc([N+](=O)[O-])c3)NC2=S)c1C ZINC000120706612 929447895 /nfs/dbraw/zinc/44/78/95/929447895.db2.gz OVOBFXMYGRZEQV-SDQBBNPISA-N 0 0 359.432 3.535 20 5 FHBDRN Cc1nn(C(C)(C)C)cc1[C@@H](C)NC(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000154883327 929450414 /nfs/dbraw/zinc/45/04/14/929450414.db2.gz TWODWJUJVUERLK-SNVBAGLBSA-N 0 0 364.833 3.999 20 5 FHBDRN CNc1ccc(C(=O)Nc2ccccc2CC(F)(F)F)cc1[N+](=O)[O-] ZINC000610243239 929530576 /nfs/dbraw/zinc/53/05/76/929530576.db2.gz XHLQVDMMTQKLSQ-UHFFFAOYSA-N 0 0 353.300 3.994 20 5 FHBDRN O=C(NC[C@@H]1CCCO[C@@H]1c1ccccc1)Nc1cccc([N+](=O)[O-])c1 ZINC000146220327 937346017 /nfs/dbraw/zinc/34/60/17/937346017.db2.gz OFCRYQYIPOQIMW-MAUKXSAKSA-N 0 0 355.394 3.884 20 5 FHBDRN Cc1ncc2c(n1)CC[C@@H](Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)C2 ZINC000535989003 929640892 /nfs/dbraw/zinc/64/08/92/929640892.db2.gz LYRRYRSIWSYIJR-LLVKDONJSA-N 0 0 352.316 3.681 20 5 FHBDRN O=C(NCCc1ccc(F)cc1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000064866523 929700567 /nfs/dbraw/zinc/70/05/67/929700567.db2.gz KLTXUZVWEOZWSJ-UHFFFAOYSA-N 0 0 371.393 3.830 20 5 FHBDRN COc1ccc(CN(C)Cc2cc([N+](=O)[O-])ccc2Cl)cc1[N+](=O)[O-] ZINC000052277915 937354266 /nfs/dbraw/zinc/35/42/66/937354266.db2.gz LSACDFFUUKQORG-UHFFFAOYSA-N 0 0 365.773 3.797 20 5 FHBDRN Cc1ccc(Nc2cccc([N+](=O)[O-])c2F)c(I)n1 ZINC001210381735 929725099 /nfs/dbraw/zinc/72/50/99/929725099.db2.gz OSCSVGGGBRFGCF-UHFFFAOYSA-N 0 0 373.125 3.786 20 5 FHBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N([C@H](C)C1CC1)C1CC1 ZINC000121064419 929730251 /nfs/dbraw/zinc/73/02/51/929730251.db2.gz OQBKEGARWAWTEV-GHMZBOCLSA-N 0 0 352.818 3.805 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)N1CCC(C2CCCC2)CC1 ZINC000610300268 929744467 /nfs/dbraw/zinc/74/44/67/929744467.db2.gz VZKHMGGTAPQYSC-UHFFFAOYSA-N 0 0 355.438 3.978 20 5 FHBDRN O=C(c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)N1CC[C@H]1c1cccc(F)c1 ZINC000610305291 929770029 /nfs/dbraw/zinc/77/00/29/929770029.db2.gz UAZIYPKWEYICEU-KRWDZBQOSA-N 0 0 367.336 3.575 20 5 FHBDRN O=C(c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)N1CC[C@H]1c1cccc(F)c1 ZINC000610304522 929775236 /nfs/dbraw/zinc/77/52/36/929775236.db2.gz AYOLTHACQSPLAP-SFHVURJKSA-N 0 0 366.352 3.507 20 5 FHBDRN Cc1oc(C)c(C(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)c1C ZINC000610305499 929776315 /nfs/dbraw/zinc/77/63/15/929776315.db2.gz KIPYGZQPZRQZPC-UHFFFAOYSA-N 0 0 358.394 3.797 20 5 FHBDRN CN(Cc1nnc2n1CCCCC2)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000579019362 929779370 /nfs/dbraw/zinc/77/93/70/929779370.db2.gz YBQGABLCJQLMOO-UHFFFAOYSA-N 0 0 370.240 3.856 20 5 FHBDRN CC[C@H](CNC(=O)c1cc(F)c(F)cc1[N+](=O)[O-])Oc1ccccc1F ZINC000177646539 929817594 /nfs/dbraw/zinc/81/75/94/929817594.db2.gz SLHNVLMDMPSHDF-SNVBAGLBSA-N 0 0 368.311 3.600 20 5 FHBDRN Cc1cc(F)ccc1COC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC001266535928 929830296 /nfs/dbraw/zinc/83/02/96/929830296.db2.gz BYAWEPKPCUWXLE-UHFFFAOYSA-N 0 0 358.369 4.000 20 5 FHBDRN COc1ccc(CNC(=O)c2cnn(C3CCCCC3)c2C)cc1[N+](=O)[O-] ZINC000510310127 929879052 /nfs/dbraw/zinc/87/90/52/929879052.db2.gz XXCVRFZSEWKSRK-UHFFFAOYSA-N 0 0 372.425 3.544 20 5 FHBDRN CC[C@@H]1CCc2ccccc2N1C(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000177658312 929887258 /nfs/dbraw/zinc/88/72/58/929887258.db2.gz VEKKLYGWUYLVFC-CQSZACIVSA-N 0 0 370.405 3.984 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)N(C)[C@H](C)c1ccccc1F ZINC000121102105 929892971 /nfs/dbraw/zinc/89/29/71/929892971.db2.gz OMHPGYSBYIAJBW-CYBMUJFWSA-N 0 0 373.384 3.509 20 5 FHBDRN CC[C@H](C)[C@@H](O)CNC(=O)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12 ZINC000275695959 929937566 /nfs/dbraw/zinc/93/75/66/929937566.db2.gz RPMRZVXELWMQHH-BTDLBPIBSA-N 0 0 374.387 3.509 20 5 FHBDRN Cc1ccc([C@H](C)N(C)C(=O)C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)cc1 ZINC000121108057 929944816 /nfs/dbraw/zinc/94/48/16/929944816.db2.gz GOISLLAJPGPJMT-HNNXBMFYSA-N 0 0 369.421 3.678 20 5 FHBDRN CC(C)N(C(=O)Cc1c(F)cc([N+](=O)[O-])cc1F)c1ccc(F)cc1 ZINC000579155815 929961198 /nfs/dbraw/zinc/96/11/98/929961198.db2.gz ROYUFNRETPQKNU-UHFFFAOYSA-N 0 0 352.312 3.996 20 5 FHBDRN CC(C)(C)Oc1ccc(NC(=O)NCCOc2ccc([N+](=O)[O-])cc2)cc1 ZINC000610329449 929983769 /nfs/dbraw/zinc/98/37/69/929983769.db2.gz LUZJDXVMXHZICP-UHFFFAOYSA-N 0 0 373.409 3.973 20 5 FHBDRN C[C@H](NC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)[C@@H](C)C1CCCCC1 ZINC000176695897 937378906 /nfs/dbraw/zinc/37/89/06/937378906.db2.gz FJFDIOTUFUDJBF-OLZOCXBDSA-N 0 0 371.437 3.771 20 5 FHBDRN COc1ccc(C(=O)N[C@@H]2CC[C@@H](c3ccc(F)cc3)C2)cc1[N+](=O)[O-] ZINC000471502561 930049682 /nfs/dbraw/zinc/04/96/82/930049682.db2.gz AVTQCJZAIGJKGX-CZUORRHYSA-N 0 0 358.369 3.809 20 5 FHBDRN CO[C@@H]1C[C@H](N(C)C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)C12CCC2 ZINC000458496620 937386053 /nfs/dbraw/zinc/38/60/53/937386053.db2.gz IHHPMFNLAAAYKI-XOKHGSTOSA-N 0 0 361.442 3.563 20 5 FHBDRN CCOc1ncc(C(=O)Nc2ccc3cc([N+](=O)[O-])ccc3n2)cc1Cl ZINC000176700563 937379677 /nfs/dbraw/zinc/37/96/77/937379677.db2.gz QHTISQGRLUIDTF-UHFFFAOYSA-N 0 0 372.768 3.842 20 5 FHBDRN COc1cc(C(=O)O[C@@H]2c3ccccc3OC[C@@H]2C)cc([N+](=O)[O-])c1C ZINC001266558156 930085215 /nfs/dbraw/zinc/08/52/15/930085215.db2.gz LVZIEGSBLHPACV-VOJFVSQTSA-N 0 0 357.362 3.838 20 5 FHBDRN CCCN(Cc1ccccc1F)C(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000610353700 930101790 /nfs/dbraw/zinc/10/17/90/930101790.db2.gz LKDZECBDWOUZMH-UHFFFAOYSA-N 0 0 359.401 3.898 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)NCCc2cccc(C(F)(F)F)n2)c1C ZINC000891167726 930103441 /nfs/dbraw/zinc/10/34/41/930103441.db2.gz YIMIVSOOLHYLPJ-UHFFFAOYSA-N 0 0 367.327 3.598 20 5 FHBDRN C[C@@H]1CN(C(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)C[C@@H](C)S1 ZINC000548039221 930110141 /nfs/dbraw/zinc/11/01/41/930110141.db2.gz XNBAUVHPJYEZNK-CHWSQXEVSA-N 0 0 352.459 3.647 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@@H]1CCC[C@@H](C(C)(C)C)CC1 ZINC000187333297 930111962 /nfs/dbraw/zinc/11/19/62/930111962.db2.gz ZZFOGISROFPYCF-HUUCEWRRSA-N 0 0 350.463 3.601 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CCSc3ccc(F)cc32)c1 ZINC000146153117 930123200 /nfs/dbraw/zinc/12/32/00/930123200.db2.gz VNBNKGMNRBTVDI-CQSZACIVSA-N 0 0 362.382 3.709 20 5 FHBDRN Cc1c(CC(=O)NC[C@H]2CCCO[C@@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000162963095 937393508 /nfs/dbraw/zinc/39/35/08/937393508.db2.gz YLJZGRNBGIZNIW-WIYYLYMNSA-N 0 0 368.433 3.730 20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])N[C@@H]1CC[C@@H](c2ccc(F)cc2)C1 ZINC000471530654 930185737 /nfs/dbraw/zinc/18/57/37/930185737.db2.gz RQDSDVCOCBDIJR-NVXWUHKLSA-N 0 0 371.412 3.988 20 5 FHBDRN O=C(CCCOc1ccccc1Cl)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000064898113 930190675 /nfs/dbraw/zinc/19/06/75/930190675.db2.gz BGPRMWLNOVTZOT-UHFFFAOYSA-N 0 0 360.797 3.997 20 5 FHBDRN O=C(NCCc1cccc(F)c1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000064897715 930197343 /nfs/dbraw/zinc/19/73/43/930197343.db2.gz CJPKUAMENJRBNY-UHFFFAOYSA-N 0 0 371.393 3.830 20 5 FHBDRN CCN(CC)C(=O)CCCC(=O)Nc1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000560798028 930203613 /nfs/dbraw/zinc/20/36/13/930203613.db2.gz SLSINHOILCZUJJ-UHFFFAOYSA-N 0 0 363.458 3.870 20 5 FHBDRN Cc1cccc(CCNC(=O)Cn2c3ccccc3c(=O)c3ccccc32)c1 ZINC000060323452 930205132 /nfs/dbraw/zinc/20/51/32/930205132.db2.gz QKTZCNWNYJNTJM-UHFFFAOYSA-N 0 0 370.452 3.822 20 5 FHBDRN CC[C@H](COC)NC(=O)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12 ZINC000275773259 930210553 /nfs/dbraw/zinc/21/05/53/930210553.db2.gz MGOLFRKLWAMDNE-GFCCVEGCSA-N 0 0 360.360 3.527 20 5 FHBDRN C[C@@H](Nc1ccc2cc([N+](=O)[O-])ccc2n1)c1ccc2c(c1)CC(=O)N2C ZINC000728285413 930254982 /nfs/dbraw/zinc/25/49/82/930254982.db2.gz GCAYRDAMKOAYSA-GFCCVEGCSA-N 0 0 362.389 3.835 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1F)N[C@@H]1CC[C@H](c2ccc(F)cc2)C1 ZINC000471540480 930258156 /nfs/dbraw/zinc/25/81/56/930258156.db2.gz IUABOHVBGLRRPF-XJKSGUPXSA-N 0 0 360.360 3.868 20 5 FHBDRN CCCOc1ccccc1NC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1 ZINC000049957771 930292414 /nfs/dbraw/zinc/29/24/14/930292414.db2.gz JNGFJQWJLQQOSZ-UHFFFAOYSA-N 0 0 359.338 3.853 20 5 FHBDRN O=[N+]([O-])c1ccccc1N1CCN(Cc2cc(Cl)nc(Cl)c2)CC1 ZINC000049983228 930311231 /nfs/dbraw/zinc/31/12/31/930311231.db2.gz KJVRSOZLJKMJFI-UHFFFAOYSA-N 0 0 367.236 3.619 20 5 FHBDRN C[C@@H](Cc1ccccc1F)Nc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-] ZINC000064915397 930314840 /nfs/dbraw/zinc/31/48/40/930314840.db2.gz MZCWTTRXXQXROA-LBPRGKRZSA-N 0 0 357.385 3.669 20 5 FHBDRN CC[C@@H](NC(=O)CCc1nc2c(cccc2C)[nH]1)c1cccc([N+](=O)[O-])c1 ZINC000177727622 930336386 /nfs/dbraw/zinc/33/63/86/930336386.db2.gz OQTNCEFPUZEAKD-MRXNPFEDSA-N 0 0 366.421 3.980 20 5 FHBDRN O=C(NCCc1ccccc1[N+](=O)[O-])NC1(c2ccc(F)cc2)CCC1 ZINC000610404802 930394461 /nfs/dbraw/zinc/39/44/61/930394461.db2.gz LNDDLQLFTFSHAX-UHFFFAOYSA-N 0 0 357.385 3.655 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(-c3cnco3)cc2)c1 ZINC000569330146 930394590 /nfs/dbraw/zinc/39/45/90/930394590.db2.gz LPBICMGJKZCDSD-UHFFFAOYSA-N 0 0 353.334 3.901 20 5 FHBDRN CCCOc1cc(O)ccc1NC(=O)Nc1ccc(OC)c([N+](=O)[O-])c1 ZINC000429607393 945069693 /nfs/dbraw/zinc/06/96/93/945069693.db2.gz DPORZGCYRKCCFO-UHFFFAOYSA-N 0 0 361.354 3.742 20 5 FHBDRN CC[C@@H](C)Oc1cccc(NC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2C)c1 ZINC000275812801 930426127 /nfs/dbraw/zinc/42/61/27/930426127.db2.gz ZWTACKWCEYHOFS-GFCCVEGCSA-N 0 0 371.393 3.658 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCN(Cc3ccsc3)CC2)cc1C(F)(F)F ZINC000536012197 937415501 /nfs/dbraw/zinc/41/55/01/937415501.db2.gz REJYLOHBLACYEH-UHFFFAOYSA-N 0 0 371.384 3.997 20 5 FHBDRN CCc1cc(NC(=O)c2nc(C3CC3)oc2C)c2cc([N+](=O)[O-])ccc2n1 ZINC000583404293 937416003 /nfs/dbraw/zinc/41/60/03/937416003.db2.gz NEZRDFZTTHCPMH-UHFFFAOYSA-N 0 0 366.377 3.553 20 5 FHBDRN O=C(NCCCSc1ccccn1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000579516478 930457032 /nfs/dbraw/zinc/45/70/32/930457032.db2.gz MOKCJLHIEUVMFC-UHFFFAOYSA-N 0 0 351.815 3.555 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)Oc1ccc(F)c2c1C(=O)C[C@H]2C ZINC000728290115 930458126 /nfs/dbraw/zinc/45/81/26/930458126.db2.gz ZAPMRCFDPUIMOZ-SECBINFHSA-N 0 0 359.309 3.652 20 5 FHBDRN CCOC(=O)c1sc2ncnc(Oc3cccc([N+](=O)[O-])c3)c2c1C ZINC000023744059 930458993 /nfs/dbraw/zinc/45/89/93/930458993.db2.gz RXINPQSXTBBIAF-UHFFFAOYSA-N 0 0 359.363 3.877 20 5 FHBDRN COc1c(-c2nc(COc3ccc(Cl)cc3)no2)cccc1[N+](=O)[O-] ZINC000580304974 930464303 /nfs/dbraw/zinc/46/43/03/930464303.db2.gz HRKCQILKAQWPGD-UHFFFAOYSA-N 0 0 361.741 3.886 20 5 FHBDRN COC(=O)c1cc(NCc2cc(OC)c(F)cc2[N+](=O)[O-])c(C)cc1C ZINC000471554233 930476838 /nfs/dbraw/zinc/47/68/38/930476838.db2.gz GCPQIYMMPYPXHG-UHFFFAOYSA-N 0 0 362.357 3.758 20 5 FHBDRN COc1ccc(-c2nnc(CNc3ccc(Cl)cc3[N+](=O)[O-])[nH]2)cc1 ZINC000471555011 930489762 /nfs/dbraw/zinc/48/97/62/930489762.db2.gz KZJHYRWSJUFCEB-UHFFFAOYSA-N 0 0 359.773 3.654 20 5 FHBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)O[C@@H](c1ccccn1)C(F)(F)F ZINC000255193786 930490662 /nfs/dbraw/zinc/49/06/62/930490662.db2.gz JAJAZLVWCOBZQA-AJHXJQRKSA-N 0 0 352.268 3.850 20 5 FHBDRN CC(C)[C@H](Nc1nc2sccn2c1[N+](=O)[O-])c1nc2ccccc2[nH]1 ZINC000080300110 937423425 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FHBDRN CCc1ccc(CCNC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000511471508 930577475 /nfs/dbraw/zinc/57/74/75/930577475.db2.gz AYJZPNQWVYUNKB-UHFFFAOYSA-N 0 0 355.438 3.584 20 5 FHBDRN O=[N+]([O-])c1ccccc1CNc1ccc2nccnc2c1Br ZINC000319515582 930607884 /nfs/dbraw/zinc/60/78/84/930607884.db2.gz CWNMNLULZICEAQ-UHFFFAOYSA-N 0 0 359.183 3.913 20 5 FHBDRN Cc1cc(OCC(=O)N2CCc3cccc(F)c3[C@H]2C)ccc1[N+](=O)[O-] ZINC000580389342 930612307 /nfs/dbraw/zinc/61/23/07/930612307.db2.gz JKVPMOAZGAPJPX-CYBMUJFWSA-N 0 0 358.369 3.567 20 5 FHBDRN CC[C@H]1CCC[C@H](NC(=O)CSCc2ccc(OC)c([N+](=O)[O-])c2)C1 ZINC000610120224 930614017 /nfs/dbraw/zinc/61/40/17/930614017.db2.gz OKJAOBXWBIIXEK-ZFWWWQNUSA-N 0 0 366.483 3.922 20 5 FHBDRN C[C@@H](C(=O)Nc1nc2c(s1)C(=O)CC(C)(C)C2)c1cccc([N+](=O)[O-])c1 ZINC000580393739 930620231 /nfs/dbraw/zinc/62/02/31/930620231.db2.gz OYIRZDQZCOJPTB-SNVBAGLBSA-N 0 0 373.434 3.949 20 5 FHBDRN O=C(c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)N1CCC[C@H]1C1CCCCC1 ZINC000055599022 930623947 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CCOc1cc(NC(=O)c2cc(Cl)ccn2)c([N+](=O)[O-])cc1OCC ZINC000119114827 930698844 /nfs/dbraw/zinc/69/88/44/930698844.db2.gz XHSAYTCCDIJIBG-UHFFFAOYSA-N 0 0 365.773 3.693 20 5 FHBDRN O=C(NC[C@H]1CC[C@@H](c2ccccc2)O1)Nc1ccc([N+](=O)[O-])cc1F ZINC000579657523 930722030 /nfs/dbraw/zinc/72/20/30/930722030.db2.gz WAWFGAJEXNYKKR-PBHICJAKSA-N 0 0 359.357 3.776 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(OCc2cccc(OC(F)F)c2)c1 ZINC000050248205 930726332 /nfs/dbraw/zinc/72/63/32/930726332.db2.gz UEFLNFOLBHFKCP-UHFFFAOYSA-N 0 0 353.277 3.562 20 5 FHBDRN Cn1ncc([N+](=O)[O-])c1C(=O)Nc1cc(F)ccc1Oc1ccccc1 ZINC000119144733 930747420 /nfs/dbraw/zinc/74/74/20/930747420.db2.gz UPYCWPHEPVMUCL-UHFFFAOYSA-N 0 0 356.313 3.512 20 5 FHBDRN O=C(c1n[nH]c2ccc([N+](=O)[O-])cc21)N(Cc1ccc(Cl)cc1)C1CC1 ZINC000046357818 930766627 /nfs/dbraw/zinc/76/66/27/930766627.db2.gz OJQRERGOEPJJOU-UHFFFAOYSA-N 0 0 370.796 3.929 20 5 FHBDRN O=C(/C=C/c1ccc([N+](=O)[O-])cc1)OCc1ncc(Br)s1 ZINC000785020716 930788684 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FHBDRN Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000050383100 930978056 /nfs/dbraw/zinc/97/80/56/930978056.db2.gz AOIMTPJOGCOOKA-UHFFFAOYSA-N 0 0 355.394 3.541 20 5 FHBDRN CCc1nc2cc(CNc3c([N+](=O)[O-])nc(C)n3CC)ccc2n1C1CC1 ZINC000579766095 930979241 /nfs/dbraw/zinc/97/92/41/930979241.db2.gz RNDZNXYWKUGCJR-UHFFFAOYSA-N 0 0 368.441 3.979 20 5 FHBDRN O=C(N[C@@H]1CCO[C@@H](C2CC2)C1)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000275929597 930984207 /nfs/dbraw/zinc/98/42/07/930984207.db2.gz HVWXDWYWWVMLKY-FOIQADDNSA-N 0 0 362.429 3.781 20 5 FHBDRN C[C@H](C(=O)N1C[C@@H](c2ccccc2)OC[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000579785149 931030221 /nfs/dbraw/zinc/03/02/21/931030221.db2.gz PIHSWFIYKMBNJM-VCBZYWHSSA-N 0 0 354.406 3.687 20 5 FHBDRN COc1cc(C(=O)NCC2CCC(C(C)C)CC2)c([N+](=O)[O-])cc1OC ZINC000119290351 931035090 /nfs/dbraw/zinc/03/50/90/931035090.db2.gz FGODTURKCNWXHK-UHFFFAOYSA-N 0 0 364.442 3.804 20 5 FHBDRN CCc1nc2c(s1)[C@@H](N(C)C(=O)c1ccc([N+](=O)[O-])cc1F)CCC2 ZINC000119286907 931035115 /nfs/dbraw/zinc/03/51/15/931035115.db2.gz JYEYSFPVNXFZLO-AWEZNQCLSA-N 0 0 363.414 3.902 20 5 FHBDRN Cc1nc(-c2ccccc2)ncc1C(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000177807638 931045102 /nfs/dbraw/zinc/04/51/02/931045102.db2.gz QUVCDUJGLBGWPV-UHFFFAOYSA-N 0 0 362.389 3.632 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1)[C@H](NCc1nnc(-c3ccc(F)cc3)[nH]1)CCC2 ZINC000579794170 931049040 /nfs/dbraw/zinc/04/90/40/931049040.db2.gz PUMKJRIXZGYERE-QGZVFWFLSA-N 0 0 367.384 3.686 20 5 FHBDRN CCCOc1ccc(CNc2c3c(ccc2[N+](=O)[O-])NCC3)cc1OC ZINC000430510222 931117042 /nfs/dbraw/zinc/11/70/42/931117042.db2.gz KSADPKQFLOWJRX-UHFFFAOYSA-N 0 0 357.410 3.972 20 5 FHBDRN CC[C@@H]1C[C@H](C)CN1C(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000331320068 931123972 /nfs/dbraw/zinc/12/39/72/931123972.db2.gz IULACFPTLFTVKU-CMPLNLGQSA-N 0 0 355.232 3.547 20 5 FHBDRN CSCC[C@@H](C)N(C)C(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000134314908 931167159 /nfs/dbraw/zinc/16/71/59/931167159.db2.gz RFDHQXCQOYXVMU-MNOVXSKESA-N 0 0 360.863 3.616 20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])N(Cc1ccccc1F)C1CC1 ZINC000247308758 931172746 /nfs/dbraw/zinc/17/27/46/931172746.db2.gz HTHDYLDWYDUXFU-UHFFFAOYSA-N 0 0 357.385 3.727 20 5 FHBDRN C[C@@H](Cc1ccc(O)cc1)N(C)c1ncc([N+](=O)[O-])cc1Br ZINC000580806986 931175229 /nfs/dbraw/zinc/17/52/29/931175229.db2.gz JZDUBZITXWNGRU-JTQLQIEISA-N 0 0 366.215 3.525 20 5 FHBDRN CCc1c(C(=O)COc2cc(Cl)ccc2[N+](=O)[O-])[nH]c(C)c1C(C)=O ZINC000121247617 931200097 /nfs/dbraw/zinc/20/00/97/931200097.db2.gz QEAYWNZSDUQATR-UHFFFAOYSA-N 0 0 364.785 3.911 20 5 FHBDRN COc1cc(C(=O)N2CC[C@H](C)[C@H]3CCCC[C@H]32)cc([N+](=O)[O-])c1OC ZINC000610170883 931210695 /nfs/dbraw/zinc/21/06/95/931210695.db2.gz XQCSXCCJVNAMHO-NWANDNLSSA-N 0 0 362.426 3.653 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)c2ccc(Br)o2)cc1[N+](=O)[O-] ZINC000177832558 931231984 /nfs/dbraw/zinc/23/19/84/931231984.db2.gz PUWUFLVYJFZCJP-VIFPVBQESA-N 0 0 353.172 3.750 20 5 FHBDRN CC(=O)c1cc(N2CCN([C@@H](C)c3ccsc3)CC2)ccc1[N+](=O)[O-] ZINC000557631593 931237277 /nfs/dbraw/zinc/23/72/77/931237277.db2.gz IISDQKDEQMZIEU-ZDUSSCGKSA-N 0 0 359.451 3.742 20 5 FHBDRN COc1ccc(-c2noc(COc3ccc(Cl)cc3[N+](=O)[O-])n2)cc1 ZINC000013921232 931256868 /nfs/dbraw/zinc/25/68/68/931256868.db2.gz JLEYLLDBQJSQHQ-UHFFFAOYSA-N 0 0 361.741 3.886 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2noc(Cc3ccc(Br)cc3)n2)cc1 ZINC000013921150 931265161 /nfs/dbraw/zinc/26/51/61/931265161.db2.gz IKXRCQFHZCXACH-UHFFFAOYSA-N 0 0 360.167 3.998 20 5 FHBDRN COc1cccc2c1OCC(C(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)=C2 ZINC000177837627 931267192 /nfs/dbraw/zinc/26/71/92/931267192.db2.gz JMNZTNNZGBAZNC-ZDUSSCGKSA-N 0 0 368.389 3.565 20 5 FHBDRN CCc1nc2ccccc2n1CC(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000177839320 931268478 /nfs/dbraw/zinc/26/84/78/931268478.db2.gz CLODEJRPZBROOU-AWEZNQCLSA-N 0 0 366.421 3.693 20 5 FHBDRN COc1cccc(-c2cc(NC(=O)c3ccc([N+](=O)[O-])c(C)c3)n(C)n2)c1 ZINC000119349963 931270835 /nfs/dbraw/zinc/27/08/35/931270835.db2.gz FRWIZCSREPEUHM-UHFFFAOYSA-N 0 0 366.377 3.565 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)c2coc(Br)c2)cc1[N+](=O)[O-] ZINC000177840489 931283885 /nfs/dbraw/zinc/28/38/85/931283885.db2.gz QCOQSFKIESLDFK-SECBINFHSA-N 0 0 353.172 3.750 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)[C@@H](C)Oc2ccc(F)c(F)c2)cc1[N+](=O)[O-] ZINC000177846831 931286399 /nfs/dbraw/zinc/28/63/99/931286399.db2.gz WWEHWFLLKZTSTD-NWDGAFQWSA-N 0 0 364.348 3.826 20 5 FHBDRN COCCCOc1cccc(C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000177847654 931292493 /nfs/dbraw/zinc/29/24/93/931292493.db2.gz JMBCWYITABVFKO-HNNXBMFYSA-N 0 0 372.421 3.810 20 5 FHBDRN C[C@@H](NC(=O)N[C@H](C)c1ccccc1[N+](=O)[O-])c1ccc2n[nH]cc2c1 ZINC000580897976 931314289 /nfs/dbraw/zinc/31/42/89/931314289.db2.gz DUYZULCRFAWQFV-VXGBXAGGSA-N 0 0 353.382 3.593 20 5 FHBDRN O=[N+]([O-])c1ccc(C(F)(F)F)c(CN[C@H]([C@@H]2CCOC2)C(F)(F)F)c1 ZINC000933001551 931322612 /nfs/dbraw/zinc/32/26/12/931322612.db2.gz CUCPXHQUUQEKPL-PRHODGIISA-N 0 0 372.265 3.671 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)c2ccc(NC(=O)C(C)C)cc2)cc1[N+](=O)[O-] ZINC000177855128 931326362 /nfs/dbraw/zinc/32/63/62/931326362.db2.gz JUJFMEUPJMXTFL-AWEZNQCLSA-N 0 0 369.421 3.989 20 5 FHBDRN CCc1c(NC(=O)CSc2ccc([N+](=O)[O-])cc2)cnn1CC(C)C ZINC000157789780 931327437 /nfs/dbraw/zinc/32/74/37/931327437.db2.gz MDOVAJLIMLTZEI-UHFFFAOYSA-N 0 0 362.455 3.741 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)C[C@H]2OCCc3ccccc32)cc1[N+](=O)[O-] ZINC000177862390 931331298 /nfs/dbraw/zinc/33/12/98/931331298.db2.gz JIEZKNXCOKKLOT-IFXJQAMLSA-N 0 0 354.406 3.785 20 5 FHBDRN CC(C)(C)OC(=O)NC1CCN(c2ccc3cc([N+](=O)[O-])ccc3n2)CC1 ZINC000077192188 931335230 /nfs/dbraw/zinc/33/52/30/931335230.db2.gz NNWZBMWPVJECMF-UHFFFAOYSA-N 0 0 372.425 3.637 20 5 FHBDRN Cc1cc([C@@H]2CN(c3ncnc4sc([N+](=O)[O-])cc43)CCO2)ccc1F ZINC000561239983 931338025 /nfs/dbraw/zinc/33/80/25/931338025.db2.gz DGAAYHAVCWERIU-AWEZNQCLSA-N 0 0 374.397 3.625 20 5 FHBDRN CCN(Cc1ccc(OC)c(OC)c1)C(=O)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000580929349 931362225 /nfs/dbraw/zinc/36/22/25/931362225.db2.gz UADJMSWVHBXPFY-CQSZACIVSA-N 0 0 372.421 3.764 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)OCc2csc([N+](=O)[O-])c2)c1 ZINC000050599057 931365763 /nfs/dbraw/zinc/36/57/63/931365763.db2.gz GUVJDWQDLPXASE-UHFFFAOYSA-N 0 0 354.365 3.643 20 5 FHBDRN Cc1nnc(-c2cccc(C(=O)N[C@H](C)c3ccc(C)c([N+](=O)[O-])c3)c2)o1 ZINC000177863395 931391683 /nfs/dbraw/zinc/39/16/83/931391683.db2.gz SMKWONNFHFCYGZ-GFCCVEGCSA-N 0 0 366.377 3.753 20 5 FHBDRN CO[C@H](C)c1nc(C)c(C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)s1 ZINC000177870654 931394526 /nfs/dbraw/zinc/39/45/26/931394526.db2.gz NHCMIFRULHOICA-CMPLNLGQSA-N 0 0 363.439 3.867 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)N1CCC(Oc2ccccc2Cl)CC1 ZINC000126114528 931398207 /nfs/dbraw/zinc/39/82/07/931398207.db2.gz FKTDXXOMOPYBQB-UHFFFAOYSA-N 0 0 374.824 3.861 20 5 FHBDRN CC(C)Oc1cccc(C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)n1 ZINC000165566087 931407050 /nfs/dbraw/zinc/40/70/50/931407050.db2.gz SLPQHOUCSVHZSZ-UHFFFAOYSA-N 0 0 367.308 3.631 20 5 FHBDRN CC(C)CCSc1ccc(C(=O)N(C)CC[C@H](C)O)cc1[N+](=O)[O-] ZINC000126131897 931419883 /nfs/dbraw/zinc/41/98/83/931419883.db2.gz XQUCXCVBFBWJBE-ZDUSSCGKSA-N 0 0 354.472 3.576 20 5 FHBDRN CC(C)(C)OC(=O)c1cnc(N(Cc2cccc([N+](=O)[O-])c2)C2CC2)cn1 ZINC000580970258 931429058 /nfs/dbraw/zinc/42/90/58/931429058.db2.gz YOYYQNXQHOOISW-UHFFFAOYSA-N 0 0 370.409 3.509 20 5 FHBDRN Cn1c(CC2CCCC2)nnc1N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000580979916 931442096 /nfs/dbraw/zinc/44/20/96/931442096.db2.gz PAPGVTBIBNDEAI-UHFFFAOYSA-N 0 0 355.442 3.625 20 5 FHBDRN O=C(c1ccccc1Sc1ccccc1[N+](=O)[O-])N1CC2(C1)CCOC2 ZINC000580975215 931442917 /nfs/dbraw/zinc/44/29/17/931442917.db2.gz WKVGRHGWNJEKOZ-UHFFFAOYSA-N 0 0 370.430 3.609 20 5 FHBDRN CC[C@@H](C)c1ccc(NC(=O)COC(=O)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000003365902 931477791 /nfs/dbraw/zinc/47/77/91/931477791.db2.gz FHXRXGNEBPDNEU-CQSZACIVSA-N 0 0 370.405 3.833 20 5 FHBDRN O=C(Nc1nc(-c2ccc3ccccc3c2)cs1)c1c[nH]nc1[N+](=O)[O-] ZINC000581084000 931548941 /nfs/dbraw/zinc/54/89/41/931548941.db2.gz SSRXUNUVYYWRGO-UHFFFAOYSA-N 0 0 365.374 3.847 20 5 FHBDRN C[C@@H]1CN(c2ccc(C(=O)OCc3cccc([N+](=O)[O-])c3)cc2)C[C@@H](C)O1 ZINC001125485573 931572713 /nfs/dbraw/zinc/57/27/13/931572713.db2.gz MXSSNYJRGBIJMV-HUUCEWRRSA-N 0 0 370.405 3.565 20 5 FHBDRN CC(=O)Nc1ccc(Cl)c(C(=O)OCCc2ccc([N+](=O)[O-])cc2)c1 ZINC000177914634 931574168 /nfs/dbraw/zinc/57/41/68/931574168.db2.gz APBXHMJXKVWTHK-UHFFFAOYSA-N 0 0 362.769 3.606 20 5 FHBDRN COc1cccc([C@H]2CN(Cc3cc([N+](=O)[O-])ccc3Cl)CCO2)c1 ZINC000177915302 931575610 /nfs/dbraw/zinc/57/56/10/931575610.db2.gz RPOYJKVMPGZYCA-GOSISDBHSA-N 0 0 362.813 3.830 20 5 FHBDRN CC(C)C[C@H]1OCCC[C@H]1NC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000187384149 931594436 /nfs/dbraw/zinc/59/44/36/931594436.db2.gz UHIMMMKZFJGFDX-UKRRQHHQSA-N 0 0 372.368 3.520 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CCC[C@@H](Nc2ccccc2)C1 ZINC000126201127 931607795 /nfs/dbraw/zinc/60/77/95/931607795.db2.gz PYZRXOSUDMKFLN-CQSZACIVSA-N 0 0 359.813 3.965 20 5 FHBDRN CSc1cccc(C(=O)N[C@H]2CCO[C@@H](C(C)(C)C)C2)c1[N+](=O)[O-] ZINC000334077185 931608579 /nfs/dbraw/zinc/60/85/79/931608579.db2.gz YMYYBWPMIXNHJX-SMDDNHRTSA-N 0 0 352.456 3.640 20 5 FHBDRN C[C@H]1C[C@H](c2ccccc2)N(C(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)C1 ZINC000581156092 931628272 /nfs/dbraw/zinc/62/82/72/931628272.db2.gz CLLMHBWFJKSGCL-SUMWQHHRSA-N 0 0 368.389 3.589 20 5 FHBDRN Nc1c(C(=O)Nc2ccc(Oc3ccncc3)cc2)cc(F)cc1[N+](=O)[O-] ZINC000050805421 931645461 /nfs/dbraw/zinc/64/54/61/931645461.db2.gz QEKWCUYKAIZHEP-UHFFFAOYSA-N 0 0 368.324 3.756 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)OCc1csc(-c2ccccc2F)n1 ZINC000728321119 931656425 /nfs/dbraw/zinc/65/64/25/931656425.db2.gz QRZNOSCMTQOOMO-UHFFFAOYSA-N 0 0 373.365 3.918 20 5 FHBDRN Cc1cc(OCC(=O)N(CC(F)(F)F)[C@@H](C)C(C)C)ccc1[N+](=O)[O-] ZINC000430538615 931687271 /nfs/dbraw/zinc/68/72/71/931687271.db2.gz CEHVGAWZQZYOGK-LBPRGKRZSA-N 0 0 362.348 3.717 20 5 FHBDRN Cc1ccc(NCCCNC(=O)c2c(F)cccc2Cl)c([N+](=O)[O-])c1 ZINC000156911372 931703439 /nfs/dbraw/zinc/70/34/39/931703439.db2.gz MAKBDZNFCUZQII-UHFFFAOYSA-N 0 0 365.792 3.928 20 5 FHBDRN CCOC(=O)c1sc(NC(=O)c2ccccc2[N+](=O)[O-])nc1C(C)C ZINC000156061927 931710275 /nfs/dbraw/zinc/71/02/75/931710275.db2.gz FUMKOYMKNFRLEE-UHFFFAOYSA-N 0 0 363.395 3.604 20 5 FHBDRN O=C(Nc1ccc2cc([N+](=O)[O-])ccc2n1)c1cnc([C@H]2CCCO2)s1 ZINC000127172094 931729586 /nfs/dbraw/zinc/72/95/86/931729586.db2.gz MSIJSAPAOHNMEK-CYBMUJFWSA-N 0 0 370.390 3.703 20 5 FHBDRN O=C(Nc1ccc2cc([N+](=O)[O-])ccc2n1)c1cnc([C@@H]2CCCO2)s1 ZINC000127171836 931729592 /nfs/dbraw/zinc/72/95/92/931729592.db2.gz MSIJSAPAOHNMEK-ZDUSSCGKSA-N 0 0 370.390 3.703 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)N(C)C[C@@H]1CCCO[C@@H]1c1ccccc1 ZINC000050867226 931758954 /nfs/dbraw/zinc/75/89/54/931758954.db2.gz ZGESYOUUCDZRLB-QFBILLFUSA-N 0 0 369.421 3.538 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(-c3n[nH]c(C)n3)cc2)c1 ZINC000050896960 931808684 /nfs/dbraw/zinc/80/86/84/931808684.db2.gz PGXGAFUZUZRJJH-UHFFFAOYSA-N 0 0 369.406 3.663 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N1CCCCC[C@H]1[C@H]1CCCCC1=O ZINC000126459821 931837067 /nfs/dbraw/zinc/83/70/67/931837067.db2.gz HCPGFVASXDGELN-MSOLQXFVSA-N 0 0 374.437 3.504 20 5 FHBDRN CC(C)N=c1ccccn1C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000255288494 931842930 /nfs/dbraw/zinc/84/29/30/931842930.db2.gz DITIPGCLLYGXFW-UHFFFAOYSA-N 0 0 368.418 3.517 20 5 FHBDRN CCc1cc(NC(=O)[C@@H]2CCO[C@H](CC)C2)c2cc([N+](=O)[O-])ccc2n1 ZINC000160865989 931867383 /nfs/dbraw/zinc/86/73/83/931867383.db2.gz QVYYJWSPAGZAGI-IUODEOHRSA-N 0 0 357.410 3.849 20 5 FHBDRN C[C@H]1[C@@H](c2ccccc2)[C@H]1C(=O)Nc1ccnn1-c1ccc([N+](=O)[O-])cc1 ZINC000430570071 931903898 /nfs/dbraw/zinc/90/38/98/931903898.db2.gz IEBPTWMGJRAFCP-AGRHKRQWSA-N 0 0 362.389 3.769 20 5 FHBDRN Cc1cc(OCC(=O)N(C)Cc2ccc(F)cc2Cl)ccc1[N+](=O)[O-] ZINC000430570769 931908316 /nfs/dbraw/zinc/90/83/16/931908316.db2.gz HBBAZJXPWMCUOV-UHFFFAOYSA-N 0 0 366.776 3.733 20 5 FHBDRN CCC(=O)Nc1ccc(C(=O)COc2cc(Cl)ccc2[N+](=O)[O-])cc1 ZINC000121308353 931947429 /nfs/dbraw/zinc/94/74/29/931947429.db2.gz RXFPVAPHTMRPFK-UHFFFAOYSA-N 0 0 362.769 3.858 20 5 FHBDRN COCCn1c(C)cc(C(=O)COc2cc(Cl)ccc2[N+](=O)[O-])c1C ZINC000121303990 931947516 /nfs/dbraw/zinc/94/75/16/931947516.db2.gz CKIRLBMFHDBWPN-UHFFFAOYSA-N 0 0 366.801 3.575 20 5 FHBDRN Cc1cccc(C(=O)Nc2cccc(Oc3cnccn3)c2)c1[N+](=O)[O-] ZINC000033137509 931961024 /nfs/dbraw/zinc/96/10/24/931961024.db2.gz QKRCPMCTEDIINL-UHFFFAOYSA-N 0 0 350.334 3.738 20 5 FHBDRN O=[N+]([O-])c1ccc(Cc2noc(-c3cc4cc(Cl)sc4[nH]3)n2)nc1 ZINC000581399474 931962203 /nfs/dbraw/zinc/96/22/03/931962203.db2.gz NQUBVZJMPHYWHV-UHFFFAOYSA-N 0 0 361.770 3.827 20 5 FHBDRN C[C@@H](OC(=O)CCn1cc([N+](=O)[O-])cn1)[C@@H](C)c1nc2ccccc2s1 ZINC000177990802 931970509 /nfs/dbraw/zinc/97/05/09/931970509.db2.gz VOFLDUWCCFWELT-VXGBXAGGSA-N 0 0 374.422 3.527 20 5 FHBDRN O=[N+]([O-])c1cccc(F)c1CN[C@H](CO)c1ccccc1C(F)(F)F ZINC000933246773 931972353 /nfs/dbraw/zinc/97/23/53/931972353.db2.gz QXOICQZVEHVMDP-CQSZACIVSA-N 0 0 358.291 3.576 20 5 FHBDRN Cc1ccc(C(=O)OCC(=O)Nc2ccccc2C(C)C)cc1[N+](=O)[O-] ZINC000003387385 931986731 /nfs/dbraw/zinc/98/67/31/931986731.db2.gz ZXRXHUASKYGAFC-UHFFFAOYSA-N 0 0 356.378 3.822 20 5 FHBDRN CCO[C@@H](CCNC(=O)c1ccc(Br)cc1[N+](=O)[O-])C(C)C ZINC000430591406 931987734 /nfs/dbraw/zinc/98/77/34/931987734.db2.gz AYKCSSCZILNAMR-AWEZNQCLSA-N 0 0 373.247 3.538 20 5 FHBDRN COc1ccc(OCCN2CCc3cc(F)ccc3[C@H]2C)c([N+](=O)[O-])c1 ZINC000610369816 931992350 /nfs/dbraw/zinc/99/23/50/931992350.db2.gz JCNHKPXZAMLADN-CYBMUJFWSA-N 0 0 360.385 3.741 20 5 FHBDRN C[C@@H]1CCCCCN1C(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000510418732 932000819 /nfs/dbraw/zinc/00/08/19/932000819.db2.gz ZABAQEHFOWIBED-LLVKDONJSA-N 0 0 360.332 3.941 20 5 FHBDRN O=[N+]([O-])c1cccc(CN(Cc2ccc(Br)cn2)C2CC2)c1 ZINC000178000331 932010631 /nfs/dbraw/zinc/01/06/31/932010631.db2.gz FGHULQARTJMTCL-UHFFFAOYSA-N 0 0 362.227 3.917 20 5 FHBDRN CN(C)C(=O)c1cccc(CSCCOc2cccc([N+](=O)[O-])c2)c1 ZINC000060514191 932037427 /nfs/dbraw/zinc/03/74/27/932037427.db2.gz GXGSSJJCPZEBSY-UHFFFAOYSA-N 0 0 360.435 3.609 20 5 FHBDRN COc1ccccc1[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2SC)C1 ZINC000933284801 932039291 /nfs/dbraw/zinc/03/92/91/932039291.db2.gz KRUHXZZTFFAVNF-ZDUSSCGKSA-N 0 0 372.446 3.955 20 5 FHBDRN O=C(c1ccnc(OC2CCC2)c1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000135187290 932042161 /nfs/dbraw/zinc/04/21/61/932042161.db2.gz ORKPTQRIGBJIPB-UHFFFAOYSA-N 0 0 367.405 3.726 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)N1CC[C@@H](Cc2ccc(F)cc2)C1 ZINC000135190797 932043153 /nfs/dbraw/zinc/04/31/53/932043153.db2.gz KDKAEMQHKCFNFQ-HNNXBMFYSA-N 0 0 374.437 3.917 20 5 FHBDRN CC[C@@H](CCO)Nc1ccc(C(=O)Nc2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000077232219 932053970 /nfs/dbraw/zinc/05/39/70/932053970.db2.gz UVYHTDVTTXRODI-HNNXBMFYSA-N 0 0 357.410 3.728 20 5 FHBDRN O=C(CN1CC[C@H]1c1cccc(F)c1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000610505711 932057363 /nfs/dbraw/zinc/05/73/63/932057363.db2.gz SNOWHORKMOGTON-HNNXBMFYSA-N 0 0 363.776 3.773 20 5 FHBDRN COc1ccccc1Cc1nnc(SCc2cccc([N+](=O)[O-])c2)o1 ZINC000066257934 932066477 /nfs/dbraw/zinc/06/64/77/932066477.db2.gz JXIIWUQHROYEKG-UHFFFAOYSA-N 0 0 357.391 3.870 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1F)N1CCCCC[C@H]1[C@H]1CCCCC1=O ZINC000610664430 932086529 /nfs/dbraw/zinc/08/65/29/932086529.db2.gz XQHMBESSNQXNMJ-WBVHZDCISA-N 0 0 362.401 3.878 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N(Cc1ccccc1)C[C@@H](O)CC ZINC000581458142 932092218 /nfs/dbraw/zinc/09/22/18/932092218.db2.gz CTKIPCAPCFCLTA-SFHVURJKSA-N 0 0 371.437 3.962 20 5 FHBDRN C[C@H](OC(=O)CCn1cc([N+](=O)[O-])cn1)c1ccc(C(F)(F)F)cc1 ZINC000728339120 932108425 /nfs/dbraw/zinc/10/84/25/932108425.db2.gz QQQZKTOIBWVAFD-JTQLQIEISA-N 0 0 357.288 3.505 20 5 FHBDRN O=C(NC/C=C\c1ccccc1)c1c(Br)cccc1[N+](=O)[O-] ZINC001266734758 932113973 /nfs/dbraw/zinc/11/39/73/932113973.db2.gz KZSVCMQTESKHOA-YVMONPNESA-N 0 0 361.195 3.801 20 5 FHBDRN Cc1c(CC(=O)Nc2nc3cc(Cl)ccc3n2C)cccc1[N+](=O)[O-] ZINC000119366281 932123041 /nfs/dbraw/zinc/12/30/41/932123041.db2.gz XXDWIGQFYFMFSC-UHFFFAOYSA-N 0 0 358.785 3.625 20 5 FHBDRN O=C(COC(=O)c1c[nH]c2cc(Cl)ccc12)c1ccc([N+](=O)[O-])cc1 ZINC000728339634 932127050 /nfs/dbraw/zinc/12/70/50/932127050.db2.gz OESDDJRBNISRPC-UHFFFAOYSA-N 0 0 358.737 3.769 20 5 FHBDRN COc1cc(C)c(NS(=O)(=O)c2cc([N+](=O)[O-])ccc2C)c(C)c1C ZINC000581510061 932185927 /nfs/dbraw/zinc/18/59/27/932185927.db2.gz DHPNQIYLAOUEAB-UHFFFAOYSA-N 0 0 364.423 3.638 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)C(=O)Nc2cccc(C(C)C)c2)cc1[N+](=O)[O-] ZINC000178060778 932244769 /nfs/dbraw/zinc/24/47/69/932244769.db2.gz BXGOFXYPCOLXIA-CQSZACIVSA-N 0 0 369.421 3.843 20 5 FHBDRN CC(C)c1c(C(=O)OCc2csc([N+](=O)[O-])c2)cnn1-c1ccccn1 ZINC000051077444 932259382 /nfs/dbraw/zinc/25/93/82/932259382.db2.gz MWGVPDQILZKSPH-UHFFFAOYSA-N 0 0 372.406 3.717 20 5 FHBDRN CCOc1ccc2c(c1)[C@@H](NCc1ccc(OC)c([N+](=O)[O-])c1)CCO2 ZINC000178072535 932269290 /nfs/dbraw/zinc/26/92/90/932269290.db2.gz VTIKHTLWBJLWQC-INIZCTEOSA-N 0 0 358.394 3.616 20 5 FHBDRN O=C(c1scnc1C1CC1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000126635724 932294932 /nfs/dbraw/zinc/29/49/32/932294932.db2.gz UVUIPSQZQLAEHA-UHFFFAOYSA-N 0 0 373.434 3.612 20 5 FHBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CCc3ccc(Cl)cc32)c(Cl)c1 ZINC000477105098 932297941 /nfs/dbraw/zinc/29/79/41/932297941.db2.gz AAZYEPFUTGVDIX-UHFFFAOYSA-N 0 0 373.217 3.653 20 5 FHBDRN C[C@H](NC(=O)N(C[C@@H]1CCCO1)C1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000175902620 932319582 /nfs/dbraw/zinc/31/95/82/932319582.db2.gz JARGNJUURLICHO-KSSFIOAISA-N 0 0 361.442 3.789 20 5 FHBDRN CC(C)(NC(=O)N[C@@H]1CCOC2(CCCC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000157319808 932326725 /nfs/dbraw/zinc/32/67/25/932326725.db2.gz UEDAUNKNQURZJS-OAHLLOKOSA-N 0 0 361.442 3.621 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2noc(N3CCC[C@H](Nc4ccccc4)C3)n2)cc1 ZINC000477128517 932346069 /nfs/dbraw/zinc/34/60/69/932346069.db2.gz RVXCSRMIVFCKBY-INIZCTEOSA-N 0 0 365.393 3.726 20 5 FHBDRN Cc1sc(C(=O)N2C[C@@H](C)O[C@H](c3ccsc3)C2)cc1[N+](=O)[O-] ZINC000156307615 932348440 /nfs/dbraw/zinc/34/84/40/932348440.db2.gz UBLXHFRXOAUTKF-RNCFNFMXSA-N 0 0 352.437 3.628 20 5 FHBDRN COc1c(C(=O)N[C@H]2CC[C@@H](c3ccc(F)cc3)C2)cccc1[N+](=O)[O-] ZINC000477149619 932352577 /nfs/dbraw/zinc/35/25/77/932352577.db2.gz GGADJHUOAYNFNR-HIFRSBDPSA-N 0 0 358.369 3.809 20 5 FHBDRN CC[C@@H](O)CCNc1ccc(C(=O)Nc2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000477160180 932361006 /nfs/dbraw/zinc/36/10/06/932361006.db2.gz FMXDIELSPDGAQN-MRXNPFEDSA-N 0 0 357.410 3.728 20 5 FHBDRN Cc1cc(-c2nc(-c3ccc(Br)o3)no2)ccc1[N+](=O)[O-] ZINC000477169984 932361653 /nfs/dbraw/zinc/36/16/53/932361653.db2.gz LAHBORZKNYPKNM-UHFFFAOYSA-N 0 0 350.128 3.976 20 5 FHBDRN C/C(=C/C(=O)NCCCn1cnc2ccccc21)c1ccc([N+](=O)[O-])cc1 ZINC000785056568 932386642 /nfs/dbraw/zinc/38/66/42/932386642.db2.gz AGCQHEOXFDGSPT-SQFISAMPSA-N 0 0 364.405 3.554 20 5 FHBDRN C[C@@H](NC(=O)c1ccc([N+](=O)[O-])c(Cl)c1)c1noc(-c2ccccc2)n1 ZINC000160985486 932423812 /nfs/dbraw/zinc/42/38/12/932423812.db2.gz XOULOZSLCBVHNA-SNVBAGLBSA-N 0 0 372.768 3.789 20 5 FHBDRN CCOC(=O)N1CCC([C@H](C)Nc2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC000302482119 932445407 /nfs/dbraw/zinc/44/54/07/932445407.db2.gz XXQUHFAGRNJSCV-JTQLQIEISA-N 0 0 357.357 3.542 20 5 FHBDRN Cc1cccc([C@@H](NC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)C(C)(C)C)c1 ZINC000178094960 932446141 /nfs/dbraw/zinc/44/61/41/932446141.db2.gz WBXBKCWDTCOOKX-QGZVFWFLSA-N 0 0 369.421 3.745 20 5 FHBDRN CCn1c(C)nc([N+](=O)[O-])c1NCC(C)(C)Oc1cc(F)cc(F)c1 ZINC000581674059 932462957 /nfs/dbraw/zinc/46/29/57/932462957.db2.gz FNSLAOJGAZIVHS-UHFFFAOYSA-N 0 0 354.357 3.667 20 5 FHBDRN COc1ccccc1C[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1F)C(C)C ZINC000477306851 932464227 /nfs/dbraw/zinc/46/42/27/932464227.db2.gz JJDIAKTVYDUOGA-KRWDZBQOSA-N 0 0 360.385 3.740 20 5 FHBDRN Cc1ccc(NC(=O)Cc2ccc(Br)cc2O)cc1[N+](=O)[O-] ZINC000477311039 932464945 /nfs/dbraw/zinc/46/49/45/932464945.db2.gz UKFKTVPZJPGTIL-UHFFFAOYSA-N 0 0 365.183 3.553 20 5 FHBDRN CCCOc1cc(NC(=O)Nc2cn[nH]c2)c([N+](=O)[O-])cc1OCCC ZINC000510449368 932466726 /nfs/dbraw/zinc/46/67/26/932466726.db2.gz HTRVBIVCQVEMEC-UHFFFAOYSA-N 0 0 363.374 3.540 20 5 FHBDRN O=[N+]([O-])c1c2cccnc2ccc1N1CCO[C@@]2(CCc3ccccc32)C1 ZINC000157886964 932467931 /nfs/dbraw/zinc/46/79/31/932467931.db2.gz NFTCTIHATHGYNP-NRFANRHFSA-N 0 0 361.401 3.821 20 5 FHBDRN CC(C)(O)c1nnc(NCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)o1 ZINC000276484492 932477286 /nfs/dbraw/zinc/47/72/86/932477286.db2.gz SXOXMLYGNCYBER-UHFFFAOYSA-N 0 0 360.395 3.546 20 5 FHBDRN COc1cc(C(=O)NCc2cc3ccccc3s2)c([N+](=O)[O-])cc1OC ZINC000581683615 932495086 /nfs/dbraw/zinc/49/50/86/932495086.db2.gz ZECDNDFKEKJDCN-UHFFFAOYSA-N 0 0 372.402 3.757 20 5 FHBDRN C[C@H](OC(=O)/C=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2n1C ZINC000255366245 932517915 /nfs/dbraw/zinc/51/79/15/932517915.db2.gz NAEMPWUXHUHDFM-SUIFULHWSA-N 0 0 351.362 3.799 20 5 FHBDRN O=[N+]([O-])c1cc2ccccc2nc1N1CCC(OC[C@H]2CCCCO2)CC1 ZINC000276525763 932550644 /nfs/dbraw/zinc/55/06/44/932550644.db2.gz BLKWAAPWELAMHV-QGZVFWFLSA-N 0 0 371.437 3.698 20 5 FHBDRN CCOc1ccc(C(=O)Nc2c3c(nn2C(C)C)CCC3)cc1[N+](=O)[O-] ZINC000471697510 932640856 /nfs/dbraw/zinc/64/08/56/932640856.db2.gz LNMMEBRSXMXFRG-UHFFFAOYSA-N 0 0 358.398 3.512 20 5 FHBDRN CSc1ccc(C(=O)Nc2ccnn2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000023141397 932647732 /nfs/dbraw/zinc/64/77/32/932647732.db2.gz VPPZAQWUZYUKKT-UHFFFAOYSA-N 0 0 368.418 3.814 20 5 FHBDRN COc1cc(C(=O)N(CC(C)(C)C)c2ccccn2)c([N+](=O)[O-])cc1F ZINC000891493366 932654870 /nfs/dbraw/zinc/65/48/70/932654870.db2.gz RDNCEVUEWBZRRM-UHFFFAOYSA-N 0 0 361.373 3.830 20 5 FHBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1N)c1cccc(C(F)(F)F)c1 ZINC000178149041 932677358 /nfs/dbraw/zinc/67/73/58/932677358.db2.gz DWSQYZWRNWPHTC-VIFPVBQESA-N 0 0 353.300 3.687 20 5 FHBDRN O=C(c1csc([N+](=O)[O-])c1)N1CCc2cc(Br)cc(F)c21 ZINC000178150028 932678102 /nfs/dbraw/zinc/67/81/02/932678102.db2.gz NMONTCLNPHOHIG-UHFFFAOYSA-N 0 0 371.187 3.761 20 5 FHBDRN Cc1ccc(-c2noc(-c3cnc(-c4ncccn4)s3)n2)cc1[N+](=O)[O-] ZINC000544944088 932687308 /nfs/dbraw/zinc/68/73/08/932687308.db2.gz OMCAKCNCVKPGKH-UHFFFAOYSA-N 0 0 366.362 3.534 20 5 FHBDRN Cc1cccc(CCCNC(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)n1 ZINC000561583131 932732337 /nfs/dbraw/zinc/73/23/37/932732337.db2.gz AMRWXZDWLHXCEQ-HNNXBMFYSA-N 0 0 356.426 3.600 20 5 FHBDRN CCOc1ccc(Cl)cc1CCNC(=O)c1ccc(F)cc1[N+](=O)[O-] ZINC000157970337 932734783 /nfs/dbraw/zinc/73/47/83/932734783.db2.gz YWCKDBJMSHMXTJ-UHFFFAOYSA-N 0 0 366.776 3.759 20 5 FHBDRN O=[N+]([O-])c1c(N[C@H](C[C@@H]2CCOC2)c2ccccc2)nc2sccn21 ZINC000157962492 932736427 /nfs/dbraw/zinc/73/64/27/932736427.db2.gz WQNLYRCIUKWMJO-GXTWGEPZSA-N 0 0 358.423 3.884 20 5 FHBDRN COc1ccc(CNC(=O)c2coc3cc(C)c(C)cc23)cc1[N+](=O)[O-] ZINC000471736058 932738951 /nfs/dbraw/zinc/73/89/51/932738951.db2.gz LHEDYHRSRATWKB-UHFFFAOYSA-N 0 0 354.362 3.896 20 5 FHBDRN Cn1cnc([N+](=O)[O-])c1CN[C@@H](c1cccc2ccccc21)C(F)(F)F ZINC000510469144 932742840 /nfs/dbraw/zinc/74/28/40/932742840.db2.gz CCNYOXRDAGUWAD-HNNXBMFYSA-N 0 0 364.327 3.875 20 5 FHBDRN COc1cc(C(=O)N[C@H]2c3cccc(F)c3CC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000430663540 932743699 /nfs/dbraw/zinc/74/36/99/932743699.db2.gz KBMZXMFUHCUEDC-BBATYDOGSA-N 0 0 358.369 3.796 20 5 FHBDRN Cc1csc([C@H](NC(=O)[C@@H]2C[C@H]2c2cccc([N+](=O)[O-])c2)C2CC2)n1 ZINC000933510713 932747165 /nfs/dbraw/zinc/74/71/65/932747165.db2.gz XFXNMEVLSLBFER-ARFHVFGLSA-N 0 0 357.435 3.731 20 5 FHBDRN Cc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2N)c(OCC(F)(F)F)c1 ZINC000178177786 932760941 /nfs/dbraw/zinc/76/09/41/932760941.db2.gz MCQUQJXUNRWGMN-UHFFFAOYSA-N 0 0 369.299 3.679 20 5 FHBDRN CSc1ccncc1NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000610544186 932761051 /nfs/dbraw/zinc/76/10/51/932761051.db2.gz VFCWGSAWOVMBSX-UHFFFAOYSA-N 0 0 358.423 3.564 20 5 FHBDRN Cc1csc(-c2ccc(NC(=O)c3cccc([N+](=O)[O-])c3N)cc2)n1 ZINC000178186451 932794394 /nfs/dbraw/zinc/79/43/94/932794394.db2.gz YWLFNAPXDWMWBX-UHFFFAOYSA-N 0 0 354.391 3.861 20 5 FHBDRN CC[C@H](OC(=O)c1coc(C2CCOCC2)n1)c1cccc([N+](=O)[O-])c1 ZINC001266835748 932811245 /nfs/dbraw/zinc/81/12/45/932811245.db2.gz PCQNQTHNGWIUAA-INIZCTEOSA-N 0 0 360.366 3.785 20 5 FHBDRN CC[C@H](OC(=O)c1ccnc(OCC(F)F)c1)c1cccc([N+](=O)[O-])c1 ZINC001266835624 932811313 /nfs/dbraw/zinc/81/13/13/932811313.db2.gz KQFDCKIJWPPIIM-AWEZNQCLSA-N 0 0 366.320 3.942 20 5 FHBDRN O=C(Nc1ccc(C(F)(F)F)nc1)[C@@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1 ZINC001266838285 932816824 /nfs/dbraw/zinc/81/68/24/932816824.db2.gz IOYNZDQWOHNSLG-CHWSQXEVSA-N 0 0 351.284 3.751 20 5 FHBDRN O=C(NC[C@@H]1CC[C@H](O)C1)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000276655060 932818405 /nfs/dbraw/zinc/81/84/05/932818405.db2.gz QDWAPKWSVBUISN-CJNGLKHVSA-N 0 0 371.393 3.670 20 5 FHBDRN COc1ccc(C[C@H](C)C(=O)N2CCCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000135291812 932826835 /nfs/dbraw/zinc/82/68/35/932826835.db2.gz LCFBFMPCNMSMBR-AWEZNQCLSA-N 0 0 354.406 3.761 20 5 FHBDRN CC(C)(C(=O)N1CCOC2(C1)CCCCCC2)c1ccccc1[N+](=O)[O-] ZINC000477650048 932834256 /nfs/dbraw/zinc/83/42/56/932834256.db2.gz GHKMBZQIFKGZAL-UHFFFAOYSA-N 0 0 360.454 3.824 20 5 FHBDRN C[C@@H]1CSc2ccccc2N1C(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000430672410 932854898 /nfs/dbraw/zinc/85/48/98/932854898.db2.gz ZUCGANBJOTZGKS-CYBMUJFWSA-N 0 0 358.419 3.891 20 5 FHBDRN Cc1cc(OCC(=O)N2CCc3c(Cl)cccc3C2)ccc1[N+](=O)[O-] ZINC000430676353 932860619 /nfs/dbraw/zinc/86/06/19/932860619.db2.gz HPUORJIMLXIFKT-UHFFFAOYSA-N 0 0 360.797 3.520 20 5 FHBDRN COc1cc(C(=O)N(C)Cc2ccccc2[N+](=O)[O-])ccc1OC(C)C ZINC000043770080 932860775 /nfs/dbraw/zinc/86/07/75/932860775.db2.gz WOCLFTLBAJVFOE-UHFFFAOYSA-N 0 0 358.394 3.663 20 5 FHBDRN Cc1cc(OCC(=O)N2c3ccccc3N(C)CC[C@H]2C)ccc1[N+](=O)[O-] ZINC000430677226 932861011 /nfs/dbraw/zinc/86/10/11/932861011.db2.gz JEBADMWGNQFTQP-OAHLLOKOSA-N 0 0 369.421 3.544 20 5 FHBDRN COc1cc(CNC(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)ccc1C ZINC000175965762 932885397 /nfs/dbraw/zinc/88/53/97/932885397.db2.gz RCZBTYLNJCUOAL-CQSZACIVSA-N 0 0 357.410 3.781 20 5 FHBDRN CCCCOc1ccc(OC)cc1NC(=O)c1cccc([N+](=O)[O-])c1N ZINC000175972426 932890154 /nfs/dbraw/zinc/89/01/54/932890154.db2.gz YZSNLBJAGAUEEQ-UHFFFAOYSA-N 0 0 359.382 3.617 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(N2CCC([C@H](O)c3ccc(Cl)cc3)CC2)n1 ZINC000178220840 932908318 /nfs/dbraw/zinc/90/83/18/932908318.db2.gz ZLMQAXNBYMNIKB-QGZVFWFLSA-N 0 0 361.829 3.902 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2noc(CN3CCSC4(CCCCC4)C3)n2)cc1 ZINC000175965507 932921623 /nfs/dbraw/zinc/92/16/23/932921623.db2.gz ZZKONVXIMSNTKX-UHFFFAOYSA-N 0 0 374.466 3.897 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ncnc2oc(C)c(C)c21 ZINC000588436436 932944633 /nfs/dbraw/zinc/94/46/33/932944633.db2.gz YQVPPJALSKKXCF-NTMALXAHSA-N 0 0 352.350 3.790 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)NCc1ccccc1OC(F)F ZINC000588436332 932948603 /nfs/dbraw/zinc/94/86/03/932948603.db2.gz LSVBUYXGPXZQIM-BENRWUELSA-N 0 0 362.332 3.916 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1)N1CCc2sc(Br)cc2C1 ZINC000610935100 932960210 /nfs/dbraw/zinc/96/02/10/932960210.db2.gz PLDBDZQBORUKFN-UHFFFAOYSA-N 0 0 367.224 3.617 20 5 FHBDRN CCNC(=O)c1ccc(C)c(NC(=O)/C(C)=C\c2ccc([N+](=O)[O-])cc2)c1 ZINC000588437082 932961789 /nfs/dbraw/zinc/96/17/89/932961789.db2.gz PDPFYXCOIBLRAP-KAMYIIQDSA-N 0 0 367.405 3.695 20 5 FHBDRN COc1ccccc1N(C)C(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000055744416 932963635 /nfs/dbraw/zinc/96/36/35/932963635.db2.gz NKKVHULZPYMXEG-UHFFFAOYSA-N 0 0 372.424 3.826 20 5 FHBDRN CC(C)c1ccc(C(=O)Nc2ccn(Cc3ccncc3)n2)cc1[N+](=O)[O-] ZINC000187518369 932966110 /nfs/dbraw/zinc/96/61/10/932966110.db2.gz NLDUSOUHADOJEA-UHFFFAOYSA-N 0 0 365.393 3.610 20 5 FHBDRN Cc1c(Br)cc([N+](=O)[O-])cc1-c1nc(-c2ccn(C)c2)no1 ZINC000581910746 932987481 /nfs/dbraw/zinc/98/74/81/932987481.db2.gz OVMOTFKYEVSQBK-UHFFFAOYSA-N 0 0 363.171 3.721 20 5 FHBDRN Cc1cc(Cc2noc(-c3ccc4[nH]c5ccccc5c(=O)c4c3)n2)no1 ZINC000581909992 932991356 /nfs/dbraw/zinc/99/13/56/932991356.db2.gz CVZWFPZNKDXENH-UHFFFAOYSA-N 0 0 358.357 3.619 20 5 FHBDRN COc1c(F)cc(S(=O)(=O)Nc2cc(C)ccc2Cl)cc1[N+](=O)[O-] ZINC000187568106 933004439 /nfs/dbraw/zinc/00/44/39/933004439.db2.gz XJFQHUFFFDGIDJ-UHFFFAOYSA-N 0 0 374.777 3.505 20 5 FHBDRN C[C@@H](N[C@@H](C)c1ncnn1C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000276709295 933009924 /nfs/dbraw/zinc/00/99/24/933009924.db2.gz WMILFGDCMQDGFB-NEPJUHHUSA-N 0 0 357.439 3.864 20 5 FHBDRN O=[N+]([O-])c1ccc(CN2CCOCC2)cc1NCc1ccc(Cl)cc1 ZINC000471812588 933013117 /nfs/dbraw/zinc/01/31/17/933013117.db2.gz SBWPFDJGONBGMO-UHFFFAOYSA-N 0 0 361.829 3.693 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1O[C@H]1CCOC1 ZINC000588440210 933067502 /nfs/dbraw/zinc/06/75/02/933067502.db2.gz IQZUWKIXUBGPGO-AINHQSCGSA-N 0 0 368.389 3.805 20 5 FHBDRN C[C@@H](Cc1cccs1)NC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000178298342 933071428 /nfs/dbraw/zinc/07/14/28/933071428.db2.gz VPNQNDWSXHLLNM-ZDUSSCGKSA-N 0 0 359.451 3.962 20 5 FHBDRN CNC(=O)c1ccc(NC(=O)/C(C)=C\c2ccc([N+](=O)[O-])cc2)c(Cl)c1 ZINC000588441074 933072092 /nfs/dbraw/zinc/07/20/92/933072092.db2.gz WCPORTOHKQXJTH-LUAWRHEFSA-N 0 0 373.796 3.650 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)n1ccc(=NCC(F)(F)F)cc1 ZINC000588441214 933072862 /nfs/dbraw/zinc/07/28/62/933072862.db2.gz UVBXLVWXKWMPQE-BENRWUELSA-N 0 0 365.311 3.603 20 5 FHBDRN O=C(NCCCC1CC1)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12 ZINC000548367665 933119341 /nfs/dbraw/zinc/11/93/41/933119341.db2.gz NAMIRUFOLPEMEQ-UHFFFAOYSA-N 0 0 356.372 3.880 20 5 FHBDRN Cn1ncc([N+](=O)[O-])c1N[C@H]1C[C@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 ZINC000891761416 933137137 /nfs/dbraw/zinc/13/71/37/933137137.db2.gz BUDXBLRNGGBIOS-JIGDXULJSA-N 0 0 360.258 3.650 20 5 FHBDRN Cc1noc([C@@H](C)OC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)n1 ZINC000051341294 933142969 /nfs/dbraw/zinc/14/29/69/933142969.db2.gz VGXIUMPSYQBQLJ-LLVKDONJSA-N 0 0 369.333 3.997 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)NCc1nc(C(F)(F)F)cs1 ZINC000588446048 933152702 /nfs/dbraw/zinc/15/27/02/933152702.db2.gz QWDLPWGVGGTKNW-TWGQIWQCSA-N 0 0 371.340 3.790 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N(C)Cc1nc2c(s1)CCCC2 ZINC000588446248 933154350 /nfs/dbraw/zinc/15/43/50/933154350.db2.gz IYRZDKOLOAEJPN-QBFSEMIESA-N 0 0 371.462 3.992 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N1CCO[C@@H](c2ccsc2)C1 ZINC000588446618 933159168 /nfs/dbraw/zinc/15/91/68/933159168.db2.gz GESSZCBHUDWWBG-OJNOIJSXSA-N 0 0 358.419 3.660 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N(C)[C@H](C)Cc1ccc(O)cc1 ZINC000588446883 933163579 /nfs/dbraw/zinc/16/35/79/933163579.db2.gz QSTHMIBTJHEQFN-IKESIWSLSA-N 0 0 354.406 3.793 20 5 FHBDRN Cc1cc(OCC(=O)N2CC[C@@H](C)C[C@H]2c2ccco2)ccc1[N+](=O)[O-] ZINC000430711676 933165177 /nfs/dbraw/zinc/16/51/77/933165177.db2.gz AZZZCTJJPCSMJZ-DYVFJYSZSA-N 0 0 358.394 3.875 20 5 FHBDRN Cc1cc(OCC(=O)NC2(c3cccc(Cl)c3)CC2)ccc1[N+](=O)[O-] ZINC000430713243 933173443 /nfs/dbraw/zinc/17/34/43/933173443.db2.gz GMPDQWDNKZZVBP-UHFFFAOYSA-N 0 0 360.797 3.741 20 5 FHBDRN Cc1ccc(S(=O)(=O)N([C@H](C)c2ccccc2)C2CC2)cc1[N+](=O)[O-] ZINC000510524583 933180105 /nfs/dbraw/zinc/18/01/05/933180105.db2.gz QIEDEHWXTLPRHY-CQSZACIVSA-N 0 0 360.435 3.818 20 5 FHBDRN CN(C)C(=O)c1cccc(-c2noc(/C=C\c3ccc([N+](=O)[O-])cc3)n2)c1 ZINC000544953003 933180357 /nfs/dbraw/zinc/18/03/57/933180357.db2.gz ABMGCBRVFPQKBY-FLIBITNWSA-N 0 0 364.361 3.517 20 5 FHBDRN CCCc1csc(NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)n1 ZINC000127347285 933181717 /nfs/dbraw/zinc/18/17/17/933181717.db2.gz VLPLUSKUUFZDJE-UHFFFAOYSA-N 0 0 374.466 3.859 20 5 FHBDRN COCc1nc2cc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4o3)ccc2o1 ZINC000430784650 933228667 /nfs/dbraw/zinc/22/86/67/933228667.db2.gz IKJORWTVIVBKOX-UHFFFAOYSA-N 0 0 367.317 3.881 20 5 FHBDRN Cc1cc(OCC(=O)N2CCC[C@@H]2/C=C/c2ccccc2)ccc1[N+](=O)[O-] ZINC000430786308 933230368 /nfs/dbraw/zinc/23/03/68/933230368.db2.gz PFLMAWRHEINFQT-QZEKMECESA-N 0 0 366.417 3.986 20 5 FHBDRN COC(=O)c1cc(NC(=O)[C@@H]2[C@H](C)[C@@H]2c2ccccc2)c(C)c([N+](=O)[O-])c1 ZINC000430800794 933237742 /nfs/dbraw/zinc/23/77/42/933237742.db2.gz UYDCEXZDYWFBCP-NXOUGTEYSA-N 0 0 368.389 3.678 20 5 FHBDRN CCCn1nccc1C1CCN(Cc2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC000510578903 933243663 /nfs/dbraw/zinc/24/36/63/933243663.db2.gz LUHIZNZLXWSQPV-UHFFFAOYSA-N 0 0 364.396 3.859 20 5 FHBDRN C[C@@H]1[C@H](C(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000430801449 933247943 /nfs/dbraw/zinc/24/79/43/933247943.db2.gz CHVYLCPAOKHWQI-RZAIGCCYSA-N 0 0 358.825 3.957 20 5 FHBDRN Cc1cc(OCC(=O)Nc2ccccc2OCC(F)F)ccc1[N+](=O)[O-] ZINC000430812521 933255526 /nfs/dbraw/zinc/25/55/26/933255526.db2.gz DOXKRCAYVQBFTH-UHFFFAOYSA-N 0 0 366.320 3.565 20 5 FHBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)N1[C@@H]2CC[C@H]1C[C@@H](c1ccccc1)C2 ZINC000510599229 933259294 /nfs/dbraw/zinc/25/92/94/933259294.db2.gz JYHYJJZMMKJZCR-BJWYYQGGSA-N 0 0 372.446 3.694 20 5 FHBDRN Cc1cc(OCC(=O)Nc2cc(F)ccc2OCC2CC2)ccc1[N+](=O)[O-] ZINC000430828514 933274615 /nfs/dbraw/zinc/27/46/15/933274615.db2.gz BJSQMWJAIGJCDK-UHFFFAOYSA-N 0 0 374.368 3.849 20 5 FHBDRN Cc1cc(OCC(=O)N[C@H]2CC[C@H](c3ccc(F)cc3)C2)ccc1[N+](=O)[O-] ZINC000430836182 933293384 /nfs/dbraw/zinc/29/33/84/933293384.db2.gz DLLOVSCVMYVZBJ-RDJZCZTQSA-N 0 0 372.396 3.874 20 5 FHBDRN C[C@@H]1CO[C@@H](c2ccccc2)CN1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610581370 933318760 /nfs/dbraw/zinc/31/87/60/933318760.db2.gz LNHNYIXWXDRVJY-FZKQIMNGSA-N 0 0 353.378 3.698 20 5 FHBDRN C[C@@H](c1cccc([N+](=O)[O-])c1)N1C(=O)[C@H](C)N(Cc2ccccc2)C1=O ZINC000430854280 933321186 /nfs/dbraw/zinc/32/11/86/933321186.db2.gz ZUNTXANCOZYGNM-KBPBESRZSA-N 0 0 353.378 3.509 20 5 FHBDRN C[C@@H](c1ccccc1)N1CC(=O)N([C@@H](C)c2cccc([N+](=O)[O-])c2)C1=O ZINC000430856605 933327006 /nfs/dbraw/zinc/32/70/06/933327006.db2.gz GPZSEUVWFXGYIQ-KBPBESRZSA-N 0 0 353.378 3.681 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CCC[C@@H]2OCc2ccccc2)c1 ZINC000430866146 933339933 /nfs/dbraw/zinc/33/99/33/933339933.db2.gz YLSHYRNPUIPVBA-MJGOQNOKSA-N 0 0 354.406 3.771 20 5 FHBDRN CN1CCCN(Cc2nc3cc([N+](=O)[O-])ccc3o2)c2cc(F)ccc21 ZINC000610582767 933357646 /nfs/dbraw/zinc/35/76/46/933357646.db2.gz XSIBZWOBPJJNKY-UHFFFAOYSA-N 0 0 356.357 3.722 20 5 FHBDRN C[C@H]1SCCN(C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)[C@@H]1C ZINC000158003574 933358917 /nfs/dbraw/zinc/35/89/17/933358917.db2.gz LZPWXLXLOYASNY-RKDXNWHRSA-N 0 0 361.370 3.554 20 5 FHBDRN O=C(Nc1cccc2c1CCO2)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000510658555 933372920 /nfs/dbraw/zinc/37/29/20/933372920.db2.gz AWHGLXYLBMOZEU-UHFFFAOYSA-N 0 0 352.268 3.801 20 5 FHBDRN O=C1N[C@@H](c2ccc(Cl)cc2Cl)C(=O)N1c1cccc([N+](=O)[O-])c1 ZINC000430910463 933396027 /nfs/dbraw/zinc/39/60/27/933396027.db2.gz ULXDBXBJMUDRKR-ZDUSSCGKSA-N 0 0 366.160 3.699 20 5 FHBDRN COc1ccc(-c2ccc(CN3CCO[C@H]4CCC[C@@H]43)o2)c([N+](=O)[O-])c1 ZINC000510693842 933441252 /nfs/dbraw/zinc/44/12/52/933441252.db2.gz UBQRXOPFDIWEES-LPHOPBHVSA-N 0 0 358.394 3.617 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)NCc2cccnc2OC(C)C)cc1[N+](=O)[O-] ZINC000610593326 933443768 /nfs/dbraw/zinc/44/37/68/933443768.db2.gz QXRIKQHEVYURKP-CQSZACIVSA-N 0 0 372.425 3.646 20 5 FHBDRN O=C(c1cc(Cl)cc(Cl)c1[N+](=O)[O-])N1CCC(=O)CC12CCC2 ZINC000891823931 933471094 /nfs/dbraw/zinc/47/10/94/933471094.db2.gz CEOJOINNVMBWRG-UHFFFAOYSA-N 0 0 357.193 3.629 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)N[C@H]2C[C@]2(C)c2ccccc2)cc1[N+](=O)[O-] ZINC000610594880 933472516 /nfs/dbraw/zinc/47/25/16/933472516.db2.gz DNSBHTNRKKLYPS-ADLFWFRXSA-N 0 0 353.422 3.994 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)Nc1cccc(NCC(F)(F)F)c1 ZINC000548406715 933476781 /nfs/dbraw/zinc/47/67/81/933476781.db2.gz AWZPGUIGEWMLFE-UHFFFAOYSA-N 0 0 353.300 3.750 20 5 FHBDRN CCc1c(C(=O)NCc2ccc([N+](=O)[O-])cc2)cnn1-c1ccc(C)cc1 ZINC000055798402 933495002 /nfs/dbraw/zinc/49/50/02/933495002.db2.gz YTDLLGVFJHGYLG-UHFFFAOYSA-N 0 0 364.405 3.581 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N2C[C@H](C(F)(F)F)[C@@H](C(F)(F)F)C2)c1 ZINC000610605540 933513208 /nfs/dbraw/zinc/51/32/08/933513208.db2.gz SGXDKCSJGMYMCO-UWVGGRQHSA-N 0 0 370.249 3.716 20 5 FHBDRN COc1ccc(CN2C[C@H](C(F)(F)F)[C@@H](C(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000610604866 933513885 /nfs/dbraw/zinc/51/38/85/933513885.db2.gz QDJWXOUKJZUCMU-UWVGGRQHSA-N 0 0 372.265 3.776 20 5 FHBDRN CC[C@H](c1ccncc1)N(C)C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000135397275 933519444 /nfs/dbraw/zinc/51/94/44/933519444.db2.gz PBZXJZGVQGQOJH-GOSISDBHSA-N 0 0 352.394 3.623 20 5 FHBDRN Cc1noc([C@@H](OC(=O)c2ccc(Cl)cc2[N+](=O)[O-])c2ccccc2)n1 ZINC000176089076 933521677 /nfs/dbraw/zinc/52/16/77/933521677.db2.gz FPNSCGWMUDVHCF-HNNXBMFYSA-N 0 0 373.752 3.886 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)c2ccc3c(c2)CCCC(=O)N3)cc1[N+](=O)[O-] ZINC000610620906 933539800 /nfs/dbraw/zinc/53/98/00/933539800.db2.gz ZGGXHPSXHQEWON-CYBMUJFWSA-N 0 0 367.405 3.669 20 5 FHBDRN COc1ccc2c(c1)CCCN(C(=O)Nc1cc(F)cc([N+](=O)[O-])c1)C2 ZINC000548416309 933560366 /nfs/dbraw/zinc/56/03/66/933560366.db2.gz DGKMYODLEBNUFH-UHFFFAOYSA-N 0 0 359.357 3.723 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)Nc1cnc2c(cnn2C(C)C)c1 ZINC000548422355 933586404 /nfs/dbraw/zinc/58/64/04/933586404.db2.gz LFSICRINFMJWEV-UHFFFAOYSA-N 0 0 369.381 3.571 20 5 FHBDRN C[C@@H]1Sc2ccccc2N(Cc2ccc(C(N)=O)cc2[N+](=O)[O-])[C@H]1C ZINC000430999019 933640694 /nfs/dbraw/zinc/64/06/94/933640694.db2.gz HZKZTRCXFLQTLK-RYUDHWBXSA-N 0 0 357.435 3.583 20 5 FHBDRN Cc1occc1CN(C)C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000431035375 933719081 /nfs/dbraw/zinc/71/90/81/933719081.db2.gz RRARTJYVRGMVMO-UHFFFAOYSA-N 0 0 353.172 3.531 20 5 FHBDRN CCCN(C(=O)c1coc(C2CCOCC2)n1)c1cccc([N+](=O)[O-])c1 ZINC000510785903 933720382 /nfs/dbraw/zinc/72/03/82/933720382.db2.gz BJACENZITCYRGQ-UHFFFAOYSA-N 0 0 359.382 3.534 20 5 FHBDRN CC[C@@H]1CN(C)c2ccccc2CN1C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000610673523 933726853 /nfs/dbraw/zinc/72/68/53/933726853.db2.gz VCJXYVAWPRMVIT-MRXNPFEDSA-N 0 0 354.410 3.857 20 5 FHBDRN O=C(NC1CCN(c2cccs2)CC1)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000610673942 933743326 /nfs/dbraw/zinc/74/33/26/933743326.db2.gz BONZBTAPEAPNPK-UHFFFAOYSA-N 0 0 370.434 3.536 20 5 FHBDRN O=C(c1cccc(Cl)c1[N+](=O)[O-])N1CCO[C@@H](c2ccccc2F)C1 ZINC000176128057 933761848 /nfs/dbraw/zinc/76/18/48/933761848.db2.gz GRRYZICNYNXPFZ-OAHLLOKOSA-N 0 0 364.760 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FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N(C)C1CC(C)(C)C1 ZINC000458196153 934368755 /nfs/dbraw/zinc/36/87/55/934368755.db2.gz XXAWQSBSDKAZFE-UHFFFAOYSA-N 0 0 352.456 3.594 20 5 FHBDRN COc1cc(N[C@@H](c2nccn2C)c2ccccc2)c(F)cc1[N+](=O)[O-] ZINC000535784117 934373811 /nfs/dbraw/zinc/37/38/11/934373811.db2.gz GZVIWGPDCIRUCS-QGZVFWFLSA-N 0 0 356.357 3.678 20 5 FHBDRN C[C@H](Cc1cccc(F)c1)N(C)C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000458239006 934403786 /nfs/dbraw/zinc/40/37/86/934403786.db2.gz GJQRYKJRIOBDOS-CQSZACIVSA-N 0 0 372.396 3.786 20 5 FHBDRN C[C@@H]1Cc2cc(F)ccc2[C@H](C)N1C(=O)COc1cccc([N+](=O)[O-])c1 ZINC000535807436 934413822 /nfs/dbraw/zinc/41/38/22/934413822.db2.gz KPBPOJOPLLAYOA-OLZOCXBDSA-N 0 0 358.369 3.647 20 5 FHBDRN C[C@H](Cc1cccc(F)c1)N(C)C(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000458237593 934418651 /nfs/dbraw/zinc/41/86/51/934418651.db2.gz FNMQYHDGMQRIDC-LLVKDONJSA-N 0 0 366.339 3.644 20 5 FHBDRN CCCOc1ccc(OCC(=O)OCc2ccc([N+](=O)[O-])c(F)c2)cc1 ZINC000780374616 934434241 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ZINC000458292714 934585031 /nfs/dbraw/zinc/58/50/31/934585031.db2.gz DDEZCVCVEXEZDE-MJGOQNOKSA-N 0 0 369.421 3.504 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])Nc1c(F)cccc1Br ZINC000084245980 934594774 /nfs/dbraw/zinc/59/47/74/934594774.db2.gz VEQXHRYPEAYYGS-UHFFFAOYSA-N 0 0 353.147 3.678 20 5 FHBDRN Cc1nn(Cc2ccc(C(=O)NC(C(C)C)C(C)C)cc2)c(C)c1[N+](=O)[O-] ZINC000610911925 934612102 /nfs/dbraw/zinc/61/21/02/934612102.db2.gz DQNLNTLVABRGOU-UHFFFAOYSA-N 0 0 372.469 3.867 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2noc(CN(CC3CCC3)CC(F)(F)F)n2)c1 ZINC000178461290 934614170 /nfs/dbraw/zinc/61/41/70/934614170.db2.gz WYKRGRDVXRXGAY-UHFFFAOYSA-N 0 0 370.331 3.809 20 5 FHBDRN O=C(c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1)N1CCC[C@H](CCO)C1 ZINC000610927616 934629429 /nfs/dbraw/zinc/62/94/29/934629429.db2.gz KRCMDAJGEHBCMO-OAHLLOKOSA-N 0 0 369.421 3.573 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])s1)N1CCc2sc(Br)cc2C1 ZINC000610934143 934633803 /nfs/dbraw/zinc/63/38/03/934633803.db2.gz OKNLHTHCTPFWQJ-UHFFFAOYSA-N 0 0 373.253 3.679 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934720994 /nfs/dbraw/zinc/72/09/94/934720994.db2.gz AAISDMQZVIWIGP-NSHDSACASA-N 0 0 370.833 3.606 20 5 FHBDRN CC(C)(C)[C@@H](CC(=O)[O-])[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000277172061 934731897 /nfs/dbraw/zinc/73/18/97/934731897.db2.gz DUBYKGATJPDFKN-CQSZACIVSA-N 0 0 363.439 3.697 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)[C@H]2CCN(C)c3ccccc32)cc1[N+](=O)[O-] ZINC000611010433 934744542 /nfs/dbraw/zinc/74/45/42/934744542.db2.gz HWHSEPOKBMRCQA-PBHICJAKSA-N 0 0 353.422 3.704 20 5 FHBDRN CC(=O)c1ccc(OCc2ccn(-c3cccc(F)c3)n2)c([N+](=O)[O-])c1 ZINC000610999993 934745774 /nfs/dbraw/zinc/74/57/74/934745774.db2.gz IENRFVWDFKLDTD-UHFFFAOYSA-N 0 0 355.325 3.701 20 5 FHBDRN CCc1cccc(OC[C@@H](O)COc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000535908963 934776248 /nfs/dbraw/zinc/77/62/48/934776248.db2.gz DHPKGLZVPBZHDD-CQSZACIVSA-N 0 0 351.786 3.629 20 5 FHBDRN CC(C)C[C@H](CCO)CNC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000176297031 934789383 /nfs/dbraw/zinc/78/93/83/934789383.db2.gz JAPUJMBCJYDVIX-LBPRGKRZSA-N 0 0 350.440 3.584 20 5 FHBDRN COc1ccc(C[C@@H](C)C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000135453907 934798076 /nfs/dbraw/zinc/79/80/76/934798076.db2.gz JKSHESAUVVCSEO-MRXNPFEDSA-N 0 0 370.449 3.921 20 5 FHBDRN C[C@@H](NC(=O)N1CCO[C@@](C)(c2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000119463632 934826371 /nfs/dbraw/zinc/82/63/71/934826371.db2.gz LRVVGXQGTQSTGC-FOIQADDNSA-N 0 0 369.421 3.613 20 5 FHBDRN O=C(N[C@H]1CCCOc2c(Cl)cccc21)c1ccc([N+](=O)[O-])s1 ZINC000538334452 934830291 /nfs/dbraw/zinc/83/02/91/934830291.db2.gz VPMROWUKDXTXSK-NSHDSACASA-N 0 0 352.799 3.953 20 5 FHBDRN O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CC=C(c2c(F)cccc2F)CC1 ZINC000472027454 934850527 /nfs/dbraw/zinc/85/05/27/934850527.db2.gz NDGHICYJCCFTPS-UHFFFAOYSA-N 0 0 362.307 3.942 20 5 FHBDRN CCN(C(=O)Cc1cc2c(cc1[N+](=O)[O-])OCCO2)c1cc(C)ccc1C ZINC000465069158 934860558 /nfs/dbraw/zinc/86/05/58/934860558.db2.gz AMZYQWFSSAFKCK-UHFFFAOYSA-N 0 0 370.405 3.578 20 5 FHBDRN C[C@H](CC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)c1ccc(F)cc1F ZINC000121709836 934876703 /nfs/dbraw/zinc/87/67/03/934876703.db2.gz SPCOONFWVRWRET-GFCCVEGCSA-N 0 0 360.360 3.952 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NCc1ccc(SC(=O)N(C)C)cc1 ZINC000084490585 934883605 /nfs/dbraw/zinc/88/36/05/934883605.db2.gz YHKOTIURUTUDAV-UHFFFAOYSA-N 0 0 361.423 3.989 20 5 FHBDRN Cc1cc(C(=O)NCc2cccc([N+](=O)[O-])c2)nn1-c1ccc(Cl)cc1 ZINC000538671965 934883906 /nfs/dbraw/zinc/88/39/06/934883906.db2.gz MMFHEPXTXQOIDM-UHFFFAOYSA-N 0 0 370.796 3.672 20 5 FHBDRN COc1c(C)ccc(NC(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)c1C ZINC000533876720 934895559 /nfs/dbraw/zinc/89/55/59/934895559.db2.gz SFGOZLJIWYGWOV-UHFFFAOYSA-N 0 0 355.394 3.810 20 5 FHBDRN Cc1cccc(C2(NC(=O)c3[nH]nc(C(C)C)c3[N+](=O)[O-])CCCC2)c1 ZINC000434180517 934903570 /nfs/dbraw/zinc/90/35/70/934903570.db2.gz CSIBRTUYHWGMOK-UHFFFAOYSA-N 0 0 356.426 3.949 20 5 FHBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NCCCc1cccs1 ZINC000538805120 934913810 /nfs/dbraw/zinc/91/38/10/934913810.db2.gz CDWIMKJJTXVUDQ-LLVKDONJSA-N 0 0 368.842 3.826 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)N(Cc1ccco1)c1ccccn1 ZINC000119611050 934915555 /nfs/dbraw/zinc/91/55/55/934915555.db2.gz OCWSWIGCVIWGSF-UHFFFAOYSA-N 0 0 369.402 3.908 20 5 FHBDRN O=C1CCCN1Cc1cccc(CNc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000071895752 934951508 /nfs/dbraw/zinc/95/15/08/934951508.db2.gz ZXQUYFRJMHUHRA-UHFFFAOYSA-N 0 0 359.813 3.983 20 5 FHBDRN C[C@@H](NC(=O)NCc1cccc([N+](=O)[O-])c1)c1ccc2ncsc2c1 ZINC000548599389 934961328 /nfs/dbraw/zinc/96/13/28/934961328.db2.gz KUJCTZWEXHBPCG-LLVKDONJSA-N 0 0 356.407 3.765 20 5 FHBDRN C[C@H]1C[C@H](c2ccccc2)N(S(=O)(=O)Cc2cccc([N+](=O)[O-])c2)C1 ZINC000511030232 934966652 /nfs/dbraw/zinc/96/66/52/934966652.db2.gz ONGSNZUSJNKZJC-KBXCAEBGSA-N 0 0 360.435 3.508 20 5 FHBDRN C[C@@H](c1cccnc1)N(C)C(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000178508148 934972545 /nfs/dbraw/zinc/97/25/45/934972545.db2.gz FOKXRDIAFIJNGT-JTQLQIEISA-N 0 0 353.300 3.842 20 5 FHBDRN COc1cccc(CC(=O)Nc2ccc([N+](=O)[O-])c(Br)c2)c1 ZINC000119643630 934977542 /nfs/dbraw/zinc/97/75/42/934977542.db2.gz CPWPAIJXPYKBCW-UHFFFAOYSA-N 0 0 365.183 3.547 20 5 FHBDRN COc1ccc(C)cc1-n1ccc(C(=O)Nc2cccc([N+](=O)[O-])c2C)n1 ZINC000065536086 934980061 /nfs/dbraw/zinc/98/00/61/934980061.db2.gz DDFIJVLHGIOSGC-UHFFFAOYSA-N 0 0 366.377 3.658 20 5 FHBDRN CC(C)CC(=O)Nc1ccc(C(=O)COc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000071912231 934992095 /nfs/dbraw/zinc/99/20/95/934992095.db2.gz ZPHAUWDXCSVOSG-UHFFFAOYSA-N 0 0 374.368 3.980 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)NC2CCC3(CC3)CC2)cc1SC ZINC000277340186 934999068 /nfs/dbraw/zinc/99/90/68/934999068.db2.gz FLAFODLWOSPDFR-UHFFFAOYSA-N 0 0 350.440 3.778 20 5 FHBDRN C[C@@H]1C[C@@H](c2ccccc2)N(S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000511036850 935002684 /nfs/dbraw/zinc/00/26/84/935002684.db2.gz WYDBTKUSXUZUQB-WBMJQRKESA-N 0 0 364.398 3.506 20 5 FHBDRN C[C@@H]1CC[C@H](C(F)(F)F)CN1C(=O)c1c[nH]c2cc([N+](=O)[O-])ccc21 ZINC000611566907 935004362 /nfs/dbraw/zinc/00/43/62/935004362.db2.gz PPYSRLXWKIKHNA-ZJUUUORDSA-N 0 0 355.316 3.879 20 5 FHBDRN COc1cc(CN[C@H](C)c2cncs2)c([N+](=O)[O-])cc1OC(F)F ZINC000934203662 935005413 /nfs/dbraw/zinc/00/54/13/935005413.db2.gz YQWYMEWTRYDIQQ-MRVPVSSYSA-N 0 0 359.354 3.512 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1NC1CCN(C(=O)CCc2ccccc2)CC1 ZINC000548613048 935007424 /nfs/dbraw/zinc/00/74/24/935007424.db2.gz UQKVKDYEUXQUFQ-UHFFFAOYSA-N 0 0 367.449 3.939 20 5 FHBDRN CCOC(=O)[C@H](NC(=O)c1cc(C)ccc1[N+](=O)[O-])c1cccc(C)c1C ZINC000472101659 935035357 /nfs/dbraw/zinc/03/53/57/935035357.db2.gz IPTHXQIJKUJKMG-GOSISDBHSA-N 0 0 370.405 3.554 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1C[C@@H](C)C[C@H]1c1ccccc1 ZINC000511044331 935040340 /nfs/dbraw/zinc/04/03/40/935040340.db2.gz PMROJCZBNNDFLU-GUYCJALGSA-N 0 0 360.435 3.675 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1C[C@@H](C)C[C@@H]1c1ccccc1 ZINC000511044334 935040476 /nfs/dbraw/zinc/04/04/76/935040476.db2.gz PMROJCZBNNDFLU-SUMWQHHRSA-N 0 0 360.435 3.675 20 5 FHBDRN Cc1cc(OCC(=O)N(C)Cc2ccc(F)cc2)c(Cl)cc1[N+](=O)[O-] ZINC000506377969 945072330 /nfs/dbraw/zinc/07/23/30/945072330.db2.gz BUSHATGWSATCGU-UHFFFAOYSA-N 0 0 366.776 3.733 20 5 FHBDRN O=C(NCCCOc1ccccc1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000437153428 945072662 /nfs/dbraw/zinc/07/26/62/945072662.db2.gz QKUPHHTZLQCTFQ-UHFFFAOYSA-N 0 0 368.311 3.813 20 5 FHBDRN Cc1cc(OCC(=O)Nc2cc(F)ccc2F)c(Cl)cc1[N+](=O)[O-] ZINC000506378098 945073103 /nfs/dbraw/zinc/07/31/03/945073103.db2.gz CNVDHPQKHDVPOG-UHFFFAOYSA-N 0 0 356.712 3.852 20 5 FHBDRN CC(C)c1nc(-c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2F)n[nH]1 ZINC000119693736 935054712 /nfs/dbraw/zinc/05/47/12/935054712.db2.gz YDWCXTNFHLFQGB-UHFFFAOYSA-N 0 0 369.356 3.895 20 5 FHBDRN CCCOc1cn(-c2ccccc2)nc1C(=O)Oc1cccc([N+](=O)[O-])c1 ZINC000728456079 935057905 /nfs/dbraw/zinc/05/79/05/935057905.db2.gz YQGXFCHDJXAKRQ-UHFFFAOYSA-N 0 0 367.361 3.789 20 5 FHBDRN Cc1cc(C)c(-c2nnc(SCCn3ccc([N+](=O)[O-])n3)o2)c(C)c1 ZINC000178516014 935071121 /nfs/dbraw/zinc/07/11/21/935071121.db2.gz SDJZJSVRZVMFNC-UHFFFAOYSA-N 0 0 359.411 3.559 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)NCc1ccc(C)cc1OC ZINC000439892434 945074608 /nfs/dbraw/zinc/07/46/08/945074608.db2.gz SDOXSGJWLAZFLT-UHFFFAOYSA-N 0 0 359.382 3.632 20 5 FHBDRN CC[C@H]1CN(Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)c2ccccc2O1 ZINC001167516300 935101291 /nfs/dbraw/zinc/10/12/91/935101291.db2.gz DISIHCLZARGNJX-ZDUSSCGKSA-N 0 0 366.377 3.822 20 5 FHBDRN O=C(Cn1ncc2cc([N+](=O)[O-])cc(Cl)c21)Nc1cc(F)cc(F)c1 ZINC000539245886 935104751 /nfs/dbraw/zinc/10/47/51/935104751.db2.gz NUAHPSBLHDBMAF-UHFFFAOYSA-N 0 0 366.711 3.515 20 5 FHBDRN C[C@@H]1c2c(F)cccc2CCN1C(=O)c1c[nH]c2cccc([N+](=O)[O-])c21 ZINC000536505607 935113743 /nfs/dbraw/zinc/11/37/43/935113743.db2.gz JWFYUXYDPCIVMX-LLVKDONJSA-N 0 0 353.353 3.975 20 5 FHBDRN CC(C)(CNC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12)Oc1ccccc1 ZINC000536506289 935114243 /nfs/dbraw/zinc/11/42/43/935114243.db2.gz ZELCSNSXADAIFF-UHFFFAOYSA-N 0 0 353.378 3.664 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N(CCOC)C(CC)CC ZINC000439896765 945078201 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351.366 3.503 20 5 FHBDRN CCCCN1C(=O)N=NC1SCc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000511057471 935166010 /nfs/dbraw/zinc/16/60/10/935166010.db2.gz LCHBBYPIQHQSIU-UHFFFAOYSA-N 0 0 366.443 3.772 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H](C)Oc1ccccc1 ZINC000439900022 945081761 /nfs/dbraw/zinc/08/17/61/945081761.db2.gz LAJCTXPEXKPBKB-ZDUSSCGKSA-N 0 0 359.382 3.583 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)NCCCc1ccc(OC)cc1 ZINC000439899470 945081781 /nfs/dbraw/zinc/08/17/81/945081781.db2.gz KITQAYXDBXSXGJ-UHFFFAOYSA-N 0 0 373.409 3.756 20 5 FHBDRN Cc1ccc(NC(=O)[C@@H](C)N(C)CCc2ccccc2[N+](=O)[O-])c(C)c1 ZINC000511060380 935182649 /nfs/dbraw/zinc/18/26/49/935182649.db2.gz ROXMEAHEKDUDQA-MRXNPFEDSA-N 0 0 355.438 3.713 20 5 FHBDRN CCO[C@@H]1C[C@@H](NC(=O)Cc2cccc([N+](=O)[O-])c2C)C12CCCCC2 ZINC000438826991 945082404 /nfs/dbraw/zinc/08/24/04/945082404.db2.gz HHKCENFNGKQIEU-QZTJIDSGSA-N 0 0 360.454 3.690 20 5 FHBDRN CN(Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)Cc1ccc(F)c(F)c1 ZINC000046511293 935201839 /nfs/dbraw/zinc/20/18/39/935201839.db2.gz FEESGYXJBWVINY-UHFFFAOYSA-N 0 0 360.320 3.555 20 5 FHBDRN O=C(N[C@H]1C[C@H]1c1ccccc1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000431347521 935210750 /nfs/dbraw/zinc/21/07/50/935210750.db2.gz BXIXAAQGQWXEOX-GJZGRUSLSA-N 0 0 350.296 3.900 20 5 FHBDRN COc1cc(CN(C)[C@@H](C)c2ccncc2)c([N+](=O)[O-])cc1OC(F)F ZINC000091989566 935211640 /nfs/dbraw/zinc/21/16/40/935211640.db2.gz LVEBFACJVSHJRF-NSHDSACASA-N 0 0 367.352 3.793 20 5 FHBDRN CN(C[C@H](O)COc1cccc([N+](=O)[O-])c1)c1cccc2ccccc21 ZINC000072020349 935217822 /nfs/dbraw/zinc/21/78/22/935217822.db2.gz BQRKGCWMIMEUAE-KRWDZBQOSA-N 0 0 352.390 3.624 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2noc(CN3CCC=C(c4ccco4)C3)n2)cc1 ZINC000511067847 935219436 /nfs/dbraw/zinc/21/94/36/935219436.db2.gz XFWCANUKJDXEHI-UHFFFAOYSA-N 0 0 352.350 3.527 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1)N1CCC[C@@H](c2nc3c(s2)CCCC3)C1 ZINC000119787012 935222289 /nfs/dbraw/zinc/22/22/89/935222289.db2.gz ONZYJMVIJHXACP-CQSZACIVSA-N 0 0 371.462 3.950 20 5 FHBDRN CCc1ccc(C(=O)N[C@@H](C)c2nc3ccccc3n2C)cc1[N+](=O)[O-] ZINC000472155761 935229032 /nfs/dbraw/zinc/22/90/32/935229032.db2.gz JOKLJHGOJQIHEB-LBPRGKRZSA-N 0 0 352.394 3.535 20 5 FHBDRN Cc1ccsc1[C@@H]1C[C@H]1C(=O)NCCCNc1ccc(C)cc1[N+](=O)[O-] ZINC000438829059 945085699 /nfs/dbraw/zinc/08/56/99/945085699.db2.gz OSUCKRAAXSVUMY-HUUCEWRRSA-N 0 0 373.478 3.995 20 5 FHBDRN O=[N+]([O-])c1cc(F)c(CN2CCCN3c4ccccc4C[C@H]3C2)c(F)c1 ZINC000582091557 935241648 /nfs/dbraw/zinc/24/16/48/935241648.db2.gz XWUNOCBXWJBDOO-HNNXBMFYSA-N 0 0 359.376 3.510 20 5 FHBDRN CCC(CC)N(C(=O)Cn1cc([N+](=O)[O-])ccc1=O)c1ccc(C)c(C)c1 ZINC000728470380 935245017 /nfs/dbraw/zinc/24/50/17/935245017.db2.gz LHYXZQABCIHKCX-UHFFFAOYSA-N 0 0 371.437 3.595 20 5 FHBDRN CC(=O)Nc1cc(F)c(F)cc1NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000119807994 935248879 /nfs/dbraw/zinc/24/88/79/935248879.db2.gz FXYAVLDACILFCQ-UHFFFAOYSA-N 0 0 369.711 3.737 20 5 FHBDRN Nc1ccc(-c2noc(COc3ccc(Cl)c(F)c3)n2)cc1[N+](=O)[O-] ZINC000551319210 935252923 /nfs/dbraw/zinc/25/29/23/935252923.db2.gz KIFOWPBBVDRDKQ-UHFFFAOYSA-N 0 0 364.720 3.599 20 5 FHBDRN O=C(Cc1cccc(F)c1F)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000551336406 935258897 /nfs/dbraw/zinc/25/88/97/935258897.db2.gz QNOLWWSCNUFEOT-UHFFFAOYSA-N 0 0 371.137 3.817 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N1CCN(c2ccccc2)CC1 ZINC000518152402 945088655 /nfs/dbraw/zinc/08/86/55/945088655.db2.gz IFEFPIFFNLCHSK-UHFFFAOYSA-N 0 0 354.410 3.511 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@H](C)c1cccc(N2CCCC2=O)c1 ZINC000072064346 935263321 /nfs/dbraw/zinc/26/33/21/935263321.db2.gz UMZBXSSOYMWXGG-CQSZACIVSA-N 0 0 367.405 3.521 20 5 FHBDRN Cc1[nH]nc(C(=O)Nc2cccc(CO[C@H]3CCC[C@H](C)C3)c2)c1[N+](=O)[O-] ZINC000072061722 935263552 /nfs/dbraw/zinc/26/35/52/935263552.db2.gz XTPQFSVIHGTVCD-LRDDRELGSA-N 0 0 372.425 3.974 20 5 FHBDRN O=[N+]([O-])c1ccccc1CN(Cc1ccccc1)C[C@@H](O)C(F)(F)F ZINC000611575793 935278288 /nfs/dbraw/zinc/27/82/88/935278288.db2.gz KIJAOEQFEZBLQG-MRXNPFEDSA-N 0 0 354.328 3.520 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(-n2ccnc2)c(Cl)c1 ZINC000072077333 935286770 /nfs/dbraw/zinc/28/67/70/935286770.db2.gz ZKLILACDZOEOGG-UHFFFAOYSA-N 0 0 356.769 3.995 20 5 FHBDRN CCCOc1ccc(OCCn2cnc(-c3cccc([N+](=O)[O-])c3)n2)cc1 ZINC000072086040 935290517 /nfs/dbraw/zinc/29/05/17/935290517.db2.gz MQGZURXHNVJGDN-UHFFFAOYSA-N 0 0 368.393 3.721 20 5 FHBDRN CN(Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)Cc1ccccc1Cl ZINC000051454035 935304510 /nfs/dbraw/zinc/30/45/10/935304510.db2.gz DFIUPVDVIWJEAK-UHFFFAOYSA-N 0 0 358.785 3.930 20 5 FHBDRN O=[N+]([O-])c1cc(CN(Cc2ccccc2)C[C@@H](O)C(F)(F)F)cs1 ZINC000611578170 935305444 /nfs/dbraw/zinc/30/54/44/935305444.db2.gz YKLIMNLRNRDRJI-CYBMUJFWSA-N 0 0 360.357 3.582 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N[C@@H]1CCCn2nc(C(C)C)nc21 ZINC000119883274 935319019 /nfs/dbraw/zinc/31/90/19/935319019.db2.gz YGMYKDIDSISIPX-CYBMUJFWSA-N 0 0 372.429 3.583 20 5 FHBDRN CC(C)(C)Oc1ccncc1NC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000551635660 935322878 /nfs/dbraw/zinc/32/28/78/935322878.db2.gz URDNQZPCYILYHK-UHFFFAOYSA-N 0 0 354.366 3.901 20 5 FHBDRN Cc1sc(C(=O)N2CC[C@@](F)(c3cc(F)cc(F)c3)C2)cc1[N+](=O)[O-] ZINC000551698081 935336532 /nfs/dbraw/zinc/33/65/32/935336532.db2.gz LJSRCAVQYOBHKZ-INIZCTEOSA-N 0 0 370.352 3.954 20 5 FHBDRN C[C@@H]1SCCN(C(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@H]1C ZINC000118283601 935338848 /nfs/dbraw/zinc/33/88/48/935338848.db2.gz QHLQNDXWNQWWRE-QWRGUYRKSA-N 0 0 363.464 3.684 20 5 FHBDRN CSc1cccc(NC(=O)[C@@H](C)N(C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000511083386 935341092 /nfs/dbraw/zinc/34/10/92/935341092.db2.gz YUURSOGMJAOZLP-CQSZACIVSA-N 0 0 373.478 3.818 20 5 FHBDRN CC(C)[C@H]1OCCC[C@H]1CNC(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000551742246 935341441 /nfs/dbraw/zinc/34/14/41/935341441.db2.gz OOCIMLVBTRKLER-XHDPSFHLSA-N 0 0 374.359 3.795 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N1CCN(c2ccccc2Cl)CC1 ZINC000511086737 935356144 /nfs/dbraw/zinc/35/61/44/935356144.db2.gz UCLYAXGODQIJCY-UHFFFAOYSA-N 0 0 359.813 3.519 20 5 FHBDRN CCc1c(C(=O)N2CCc3ccc([N+](=O)[O-])cc32)cnn1CCC(C)C ZINC000427109952 945095542 /nfs/dbraw/zinc/09/55/42/945095542.db2.gz TWUBBWZMJWMEPI-UHFFFAOYSA-N 0 0 356.426 3.603 20 5 FHBDRN CCO[C@H]1C[C@@H](N(C)C(=O)c2ccc([N+](=O)[O-])c(Cl)c2)C12CCC2 ZINC000161170130 935363890 /nfs/dbraw/zinc/36/38/90/935363890.db2.gz BGIDLRJREZFLFS-CABCVRRESA-N 0 0 352.818 3.668 20 5 FHBDRN COc1ccccc1C(C)(C)CNC(=O)[C@H]1C[C@H]1c1cccc([N+](=O)[O-])c1 ZINC001125585674 935377811 /nfs/dbraw/zinc/37/78/11/935377811.db2.gz CMZXEWNMDLYCBP-IRXDYDNUSA-N 0 0 368.433 3.801 20 5 FHBDRN COc1ccccc1[C@@H](C)NC(=O)CNc1c(C)ccc([N+](=O)[O-])c1C ZINC000085288914 935416737 /nfs/dbraw/zinc/41/67/37/935416737.db2.gz MTDHQOCAIDOYFZ-CQSZACIVSA-N 0 0 357.410 3.510 20 5 FHBDRN CCOC(=O)c1c(C)csc1NC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000582218680 935420545 /nfs/dbraw/zinc/42/05/45/935420545.db2.gz VUYBLCVRCVGIKB-NSHDSACASA-N 0 0 362.407 3.884 20 5 FHBDRN CN(C(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C(C)(C)C ZINC000516652900 945099783 /nfs/dbraw/zinc/09/97/83/945099783.db2.gz OFSWWSXOAGIHMP-UHFFFAOYSA-N 0 0 350.362 3.963 20 5 FHBDRN CCOc1ccccc1CN(C)C(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000047320043 945101111 /nfs/dbraw/zinc/10/11/11/945101111.db2.gz DQJOXQFHMOQWPY-UHFFFAOYSA-N 0 0 359.382 3.666 20 5 FHBDRN COc1ccc(C(C)(C)C(=O)N(C)c2cccc([N+](=O)[O-])c2)cc1OC ZINC000158227732 935455568 /nfs/dbraw/zinc/45/55/68/935455568.db2.gz CUHJMHROWAPEHL-UHFFFAOYSA-N 0 0 358.394 3.553 20 5 FHBDRN Cc1nc(COC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)oc1C ZINC000051551229 935460730 /nfs/dbraw/zinc/46/07/30/935460730.db2.gz MTTUXFJAYIVYJT-UHFFFAOYSA-N 0 0 359.363 3.680 20 5 FHBDRN O=C(OCCOc1ccccc1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000051551786 935463403 /nfs/dbraw/zinc/46/34/03/935463403.db2.gz IPQMEZGWHCFVGE-UHFFFAOYSA-N 0 0 370.386 3.954 20 5 FHBDRN Cc1cc(C(=O)N2CCC[C@H]2c2ccc3c(c2)OCO3)ccc1[N+](=O)[O-] ZINC000077329789 935496340 /nfs/dbraw/zinc/49/63/40/935496340.db2.gz DOPRWDZKDROCFR-INIZCTEOSA-N 0 0 354.362 3.609 20 5 FHBDRN O=c1oc(-c2ccc([N+](=O)[O-])cc2)nn1CC1CCC(C(F)(F)F)CC1 ZINC000472212237 935500312 /nfs/dbraw/zinc/50/03/12/935500312.db2.gz VEZJBOOYGYFCAP-UHFFFAOYSA-N 0 0 371.315 3.780 20 5 FHBDRN O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC[C@H](OC(F)F)C1 ZINC000611587308 935537523 /nfs/dbraw/zinc/53/75/23/935537523.db2.gz VYJMIFCLWWUXKN-NSHDSACASA-N 0 0 356.350 3.653 20 5 FHBDRN CO[C@H]1CCOc2c(NC(=O)[C@H](C)c3cccc([N+](=O)[O-])c3)cccc21 ZINC000548728747 935541128 /nfs/dbraw/zinc/54/11/28/935541128.db2.gz VCHUHTWIBADKHB-PXAZEXFGSA-N 0 0 356.378 3.807 20 5 FHBDRN Cc1ccccc1CC1CN(C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)C1 ZINC000085479879 935545560 /nfs/dbraw/zinc/54/55/60/935545560.db2.gz ROMFGBCYNSKECU-UHFFFAOYSA-N 0 0 365.433 3.792 20 5 FHBDRN O=C(Oc1ccc(Cc2ccccc2)cc1[N+](=O)[O-])[C@@H]1C[C@H]2CC[C@@H]1O2 ZINC000176661204 935552423 /nfs/dbraw/zinc/55/24/23/935552423.db2.gz YIRBAXJXLDXMKN-NUJGCVRESA-N 0 0 353.374 3.659 20 5 FHBDRN COCc1cccc(NC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)c1 ZINC000158098676 935557045 /nfs/dbraw/zinc/55/70/45/935557045.db2.gz LAQOJOYVMZGOIU-UHFFFAOYSA-N 0 0 357.410 3.886 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H]1CCSc2c(F)cccc21 ZINC000427122097 945108402 /nfs/dbraw/zinc/10/84/02/945108402.db2.gz OXXXMICBWBSQPR-AWEZNQCLSA-N 0 0 362.382 3.709 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)Nc1nc2cc(F)c(C)cc2s1 ZINC000478102589 935569785 /nfs/dbraw/zinc/56/97/85/935569785.db2.gz OXYMMNISLPYVLJ-UHFFFAOYSA-N 0 0 361.354 3.913 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(N(CCO)Cc2ccc(Br)s2)c1 ZINC000478130598 935572955 /nfs/dbraw/zinc/57/29/55/935572955.db2.gz DTZDJPOEPGZHFB-UHFFFAOYSA-N 0 0 371.256 3.726 20 5 FHBDRN O=C(Nc1ccc(Br)nc1)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000161248041 935575899 /nfs/dbraw/zinc/57/58/99/935575899.db2.gz DCXBCVGYCJLKMZ-UHFFFAOYSA-N 0 0 356.563 3.658 20 5 FHBDRN Cc1ccc(C)c(S(=O)(=O)N2CCc3sccc3[C@@H]2C)c1[N+](=O)[O-] ZINC000478140400 935577513 /nfs/dbraw/zinc/57/75/13/935577513.db2.gz DUBPKDNQGWCIMC-LBPRGKRZSA-N 0 0 366.464 3.581 20 5 FHBDRN O=[N+]([O-])c1cc(CN(CCO)Cc2ccc(Cl)c(Cl)c2)cs1 ZINC000158127737 935578186 /nfs/dbraw/zinc/57/81/86/935578186.db2.gz SZZNIPWUIBWEDV-UHFFFAOYSA-N 0 0 361.250 3.958 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NCCCN(C)c1ccccc1 ZINC000478162355 935581962 /nfs/dbraw/zinc/58/19/62/935581962.db2.gz XSJRWHJGVQYZHV-UHFFFAOYSA-N 0 0 373.478 3.963 20 5 FHBDRN C[C@@H](C(=O)Nc1ccc(Cl)cc1)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000511105787 935582559 /nfs/dbraw/zinc/58/25/59/935582559.db2.gz KITCVKUXWHASGC-ZDUSSCGKSA-N 0 0 361.829 3.750 20 5 FHBDRN O=C(N[C@@H]1C[C@H]1c1ccc(OC(F)F)cc1)c1cc(F)cc([N+](=O)[O-])c1 ZINC000478180692 935583632 /nfs/dbraw/zinc/58/36/32/935583632.db2.gz LEOKPHQPWFONQJ-LSDHHAIUSA-N 0 0 366.295 3.621 20 5 FHBDRN O=C(OCc1cc(Cl)ccc1[N+](=O)[O-])[C@H]1CCCN1c1ccccc1 ZINC000785125597 935584415 /nfs/dbraw/zinc/58/44/15/935584415.db2.gz HVKBMUSWUFNITO-QGZVFWFLSA-N 0 0 360.797 3.960 20 5 FHBDRN Cc1ccc(NC(=O)N[C@H](C)c2nccn2-c2ccccc2)cc1[N+](=O)[O-] ZINC000562033401 935587309 /nfs/dbraw/zinc/58/73/09/935587309.db2.gz YEHZMOYQBAVHKF-CQSZACIVSA-N 0 0 365.393 3.972 20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])N[C@@H]1CC[C@@H](c2cccc(F)c2)C1 ZINC000478222529 935593678 /nfs/dbraw/zinc/59/36/78/935593678.db2.gz DIRBNTXQCRYBRC-NVXWUHKLSA-N 0 0 371.412 3.988 20 5 FHBDRN COC(=O)c1cnc(NCC(C)(C)c2ccc(Cl)cc2)c([N+](=O)[O-])c1 ZINC000478266539 935594949 /nfs/dbraw/zinc/59/49/49/935594949.db2.gz KJQUDFHEJJPISN-UHFFFAOYSA-N 0 0 363.801 3.820 20 5 FHBDRN CN(C(=O)COc1ccc([N+](=O)[O-])c2cccnc12)[C@H]1CCC(C)(C)C1 ZINC000478242448 935596189 /nfs/dbraw/zinc/59/61/89/935596189.db2.gz SPGZHQRMFPFJHS-ZDUSSCGKSA-N 0 0 357.410 3.559 20 5 FHBDRN O=[N+]([O-])c1ccccc1-c1nnc(CN2CCCc3c(F)cccc32)o1 ZINC001167568482 935599880 /nfs/dbraw/zinc/59/98/80/935599880.db2.gz TWJRWYSLJNPCOW-UHFFFAOYSA-N 0 0 354.341 3.737 20 5 FHBDRN CSc1cccc(-c2nc(-c3ccc4c(c3)ncn4C)no2)c1[N+](=O)[O-] ZINC000582386290 935603711 /nfs/dbraw/zinc/60/37/11/935603711.db2.gz TYYNWGXNNKSZGB-UHFFFAOYSA-N 0 0 367.390 3.920 20 5 FHBDRN O=C(c1cc2ccccc2c2cccnc12)N1CC[C@H](N2CCC2)[C@@H](F)C1 ZINC000684845801 935604609 /nfs/dbraw/zinc/60/46/09/935604609.db2.gz UVYSQBASXGBMCP-PMACEKPBSA-N 0 0 363.436 3.646 20 5 FHBDRN CC(C)c1ccc(C(=O)N2CCC(=O)Nc3ccccc32)cc1[N+](=O)[O-] ZINC000187739414 935609574 /nfs/dbraw/zinc/60/95/74/935609574.db2.gz HEEDKSIVHMCCNH-UHFFFAOYSA-N 0 0 353.378 3.707 20 5 FHBDRN COc1ccc(C(=O)N[C@@H]2CC[C@@H](c3cccc(F)c3)C2)cc1[N+](=O)[O-] ZINC000478295980 935611356 /nfs/dbraw/zinc/61/13/56/935611356.db2.gz UTBUTHUXVAIPHH-CZUORRHYSA-N 0 0 358.369 3.809 20 5 FHBDRN CCOc1cc(C(=O)Nc2cnc([C@@H](C)CC)nc2)c([N+](=O)[O-])cc1OC ZINC000478299621 935611930 /nfs/dbraw/zinc/61/19/30/935611930.db2.gz BHFKDEHEUUPUOX-NSHDSACASA-N 0 0 374.397 3.558 20 5 FHBDRN C[C@@H](C1CC1)n1nccc1NC(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000187742213 935620826 /nfs/dbraw/zinc/62/08/26/935620826.db2.gz SNSWXTLHBYFIBM-JTQLQIEISA-N 0 0 363.805 3.737 20 5 FHBDRN C[C@H](C1CC1)n1nccc1NC(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000187742236 935620866 /nfs/dbraw/zinc/62/08/66/935620866.db2.gz SNSWXTLHBYFIBM-SNVBAGLBSA-N 0 0 363.805 3.737 20 5 FHBDRN Cc1nc(C2CC[NH+](Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)CC2)no1 ZINC000127557235 935622049 /nfs/dbraw/zinc/62/20/49/935622049.db2.gz XWYHHBLHOUIGJQ-UHFFFAOYSA-N 0 0 368.393 3.926 20 5 FHBDRN Cc1c(CNC(=O)NCc2nc3ccccc3s2)cccc1[N+](=O)[O-] ZINC000478461383 935629615 /nfs/dbraw/zinc/62/96/15/935629615.db2.gz KRCQIGNSSIWGOT-UHFFFAOYSA-N 0 0 356.407 3.512 20 5 FHBDRN CC[C@H](C[C@H](C)CO)NC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000478432014 935631755 /nfs/dbraw/zinc/63/17/55/935631755.db2.gz MFHYTFTWFPBZML-GOEBONIOSA-N 0 0 371.437 3.865 20 5 FHBDRN CCCCOc1ccc(N[C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])cn1 ZINC000478430202 935631959 /nfs/dbraw/zinc/63/19/59/935631959.db2.gz QJAOJMJGHHUVSR-CYBMUJFWSA-N 0 0 358.398 3.608 20 5 FHBDRN CCCOc1cc(O)ccc1NC(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000429616983 945113611 /nfs/dbraw/zinc/11/36/11/945113611.db2.gz SQECBLJWPUSDBD-UHFFFAOYSA-N 0 0 361.354 3.742 20 5 FHBDRN C[C@@H](C(=O)N(Cc1ccco1)Cc1cccnc1)c1cccc([N+](=O)[O-])c1 ZINC000582397326 935650195 /nfs/dbraw/zinc/65/01/95/935650195.db2.gz AENCLGNJVUGTIR-OAHLLOKOSA-N 0 0 365.389 3.915 20 5 FHBDRN Cc1c(CNC(=O)NCc2ccccc2C(F)(F)F)cccc1[N+](=O)[O-] ZINC000478548379 935651020 /nfs/dbraw/zinc/65/10/20/935651020.db2.gz QJKUJOFHWVTMII-UHFFFAOYSA-N 0 0 367.327 3.921 20 5 FHBDRN Cc1c(CC(=O)NC[C@H](Nc2ccccc2)C(C)C)cccc1[N+](=O)[O-] ZINC000158264381 935665415 /nfs/dbraw/zinc/66/54/15/935665415.db2.gz SHAOWLPSWSBNHX-SFHVURJKSA-N 0 0 355.438 3.699 20 5 FHBDRN CC(C)c1ncc(NC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])cn1 ZINC000478637026 935668573 /nfs/dbraw/zinc/66/85/73/935668573.db2.gz XYYFWXRURPTRNA-UHFFFAOYSA-N 0 0 366.830 3.892 20 5 FHBDRN Cc1ccc(NC(=O)c2cccc(C)c2[N+](=O)[O-])cc1NC(=O)N(C)C ZINC000478649521 935675286 /nfs/dbraw/zinc/67/52/86/935675286.db2.gz PXBZNJDTAIVYFU-UHFFFAOYSA-N 0 0 356.382 3.557 20 5 FHBDRN COc1cc(C(=O)N2CCC[C@@H]2Cc2cccc(F)c2)cc([N+](=O)[O-])c1C ZINC000478696737 935680878 /nfs/dbraw/zinc/68/08/78/935680878.db2.gz WMLYJGWHIRBXQO-QGZVFWFLSA-N 0 0 372.396 3.898 20 5 FHBDRN O=C(O[C@@H]([C@H]1CCCO1)C(F)(F)F)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000158281436 935684200 /nfs/dbraw/zinc/68/42/00/935684200.db2.gz TWKZSJVORUUQIK-MNOVXSKESA-N 0 0 353.680 3.515 20 5 FHBDRN COc1ccc(CNC(=O)[C@@]2(C)CCCc3ccccc32)cc1[N+](=O)[O-] ZINC000511788093 945116972 /nfs/dbraw/zinc/11/69/72/945116972.db2.gz QEJZYDUTUMXOGL-FQEVSTJZSA-N 0 0 354.406 3.514 20 5 FHBDRN O=c1c([N+](=O)[O-])cc(Br)cn1Cc1ccc2ccccc2c1 ZINC000158294708 935691412 /nfs/dbraw/zinc/69/14/12/935691412.db2.gz HZHUTUBMUJHJKF-UHFFFAOYSA-N 0 0 359.179 3.721 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H]1CC(=O)c1ccccc1 ZINC000085491393 935707993 /nfs/dbraw/zinc/70/79/93/935707993.db2.gz WXFBJFCYKLNRTQ-MRXNPFEDSA-N 0 0 352.390 3.781 20 5 FHBDRN COC(=O)c1cccc(Cl)c1CN(C)CCc1ccccc1[N+](=O)[O-] ZINC000511127760 935717781 /nfs/dbraw/zinc/71/77/81/935717781.db2.gz XAALFIRRTGYFAS-UHFFFAOYSA-N 0 0 362.813 3.709 20 5 FHBDRN Cc1cc(C)cc(OC[C@@H](O)Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)c1 ZINC000478792817 935721970 /nfs/dbraw/zinc/72/19/70/935721970.db2.gz FEEWEMALALKILI-IBGZPJMESA-N 0 0 367.405 3.515 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)OCc1nnc(-c2ccccc2)o1 ZINC001125597179 935724488 /nfs/dbraw/zinc/72/44/88/935724488.db2.gz PNLXEMNCEGSXER-UHFFFAOYSA-N 0 0 353.334 3.619 20 5 FHBDRN COc1ccc(COc2ccc(F)cc2-c2ccnn2C)cc1[N+](=O)[O-] ZINC000478809574 935729911 /nfs/dbraw/zinc/72/99/11/935729911.db2.gz ATTKGEMEIBWCGD-UHFFFAOYSA-N 0 0 357.341 3.722 20 5 FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H](C)C[C@H]1C ZINC000158333043 935736913 /nfs/dbraw/zinc/73/69/13/935736913.db2.gz KRTGJOBCZQPCJP-CHWSQXEVSA-N 0 0 352.456 3.594 20 5 FHBDRN Cc1cccc(Cn2nccc2NC(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000582463647 935741223 /nfs/dbraw/zinc/74/12/23/935741223.db2.gz WQVAGGYATQRIJJ-HNNXBMFYSA-N 0 0 364.405 3.890 20 5 FHBDRN Cc1cc(OCC(=O)N[C@H](C)c2ccccc2Cl)c(F)cc1[N+](=O)[O-] ZINC000478889413 935752137 /nfs/dbraw/zinc/75/21/37/935752137.db2.gz PKVAAADRTPXSKG-LLVKDONJSA-N 0 0 366.776 3.952 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NCCOc1ccccc1F ZINC000478938315 935759202 /nfs/dbraw/zinc/75/92/02/935759202.db2.gz ULPISWOTICPPMO-UHFFFAOYSA-N 0 0 364.398 3.655 20 5 FHBDRN Cc1nc(N[C@H]2CCC[C@@H](NC(=O)OC(C)(C)C)C2)ccc1[N+](=O)[O-] ZINC000127742539 935765376 /nfs/dbraw/zinc/76/53/76/935765376.db2.gz IJFDHSIANIBCAO-QWHCGFSZSA-N 0 0 350.419 3.546 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])Cc1ccn(-c2c(F)cccc2F)n1 ZINC000511137880 935768094 /nfs/dbraw/zinc/76/80/94/935768094.db2.gz MOJOVYHBAKBCNO-UHFFFAOYSA-N 0 0 372.375 3.733 20 5 FHBDRN O=C(N[C@H]1CCO[C@@H](c2ccccc2)C1)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000158422974 935786713 /nfs/dbraw/zinc/78/67/13/935786713.db2.gz XVOMAZQIAFVLIS-IFXJQAMLSA-N 0 0 365.389 3.726 20 5 FHBDRN Cc1cc(NC(=O)c2cccc([N+](=O)[O-])c2C)nn1-c1cccc(Cl)c1 ZINC000540789071 935796714 /nfs/dbraw/zinc/79/67/14/935796714.db2.gz QNHVHYYVTXBKBX-UHFFFAOYSA-N 0 0 370.796 3.725 20 5 FHBDRN CC(C)(CNC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)[C@@H]1CCCCO1 ZINC000611618302 935819966 /nfs/dbraw/zinc/81/99/66/935819966.db2.gz NKZNQZQGSASFHK-AWEZNQCLSA-N 0 0 372.368 3.521 20 5 FHBDRN CCC(=O)c1ccc(N[C@H]2CCc3cnn(C(C)C)c3C2)c([N+](=O)[O-])c1 ZINC000479310173 935824010 /nfs/dbraw/zinc/82/40/10/935824010.db2.gz GJALXJUGWGFMJP-HNNXBMFYSA-N 0 0 356.426 3.934 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)c1ccc(S(=O)(=O)C2CCCC2)cc1 ZINC000050292838 935827436 /nfs/dbraw/zinc/82/74/36/935827436.db2.gz VQZHXYRPMXUEOI-UHFFFAOYSA-N 0 0 374.418 3.563 20 5 FHBDRN CCOc1cc(COC(=O)[C@@H]2CCCN2c2ccccc2)ccc1[N+](=O)[O-] ZINC000785134485 935827667 /nfs/dbraw/zinc/82/76/67/935827667.db2.gz UHQKDFURNGKWJC-SFHVURJKSA-N 0 0 370.405 3.706 20 5 FHBDRN O=C(NCCc1ccsc1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000050312718 935829953 /nfs/dbraw/zinc/82/99/53/935829953.db2.gz BCKBXOLJUUTMIH-UHFFFAOYSA-N 0 0 359.432 3.752 20 5 FHBDRN Cc1ncc(CN(C)C(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)s1 ZINC000050333087 935833420 /nfs/dbraw/zinc/83/34/20/935833420.db2.gz JFQKEBSHTDHOOA-UHFFFAOYSA-N 0 0 374.447 3.755 20 5 FHBDRN CCC(=O)c1ccc(Sc2nc3nc(C)c(C)c(C)n3n2)c([N+](=O)[O-])c1 ZINC000479390603 935834848 /nfs/dbraw/zinc/83/48/48/935834848.db2.gz YTPRDJUKVKEJRV-UHFFFAOYSA-N 0 0 371.422 3.702 20 5 FHBDRN COc1ccc(OCC(=O)Nc2ccc(Cl)c(Cl)c2)cc1[N+](=O)[O-] ZINC000479401894 935835293 /nfs/dbraw/zinc/83/52/93/935835293.db2.gz IZEVXIPAPMXZHI-UHFFFAOYSA-N 0 0 371.176 3.928 20 5 FHBDRN Cc1cc(C(=O)N2CC[C@H](OCCCc3ccccc3)C2)cc([N+](=O)[O-])c1 ZINC000176335236 935835405 /nfs/dbraw/zinc/83/54/05/935835405.db2.gz ICSWVGWGJQMKGB-FQEVSTJZSA-N 0 0 368.433 3.767 20 5 FHBDRN CCn1nc(C)c([N+](=O)[O-])c1NCCOc1cccc(C(F)(F)F)c1 ZINC000479378478 935835799 /nfs/dbraw/zinc/83/57/99/935835799.db2.gz MHSAIJJETBRRAM-UHFFFAOYSA-N 0 0 358.320 3.629 20 5 FHBDRN CC(C)(C)c1ncsc1C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000479436437 935836281 /nfs/dbraw/zinc/83/62/81/935836281.db2.gz DNVSOAHWSCZPTJ-UHFFFAOYSA-N 0 0 367.858 3.975 20 5 FHBDRN C[C@@H](c1ccncc1)N(C)C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000050355278 935837717 /nfs/dbraw/zinc/83/77/17/935837717.db2.gz JEIQAGLPGBVNKQ-LBPRGKRZSA-N 0 0 368.418 3.947 20 5 FHBDRN Cc1cccc(O[C@@H](C)C(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000479418374 935838070 /nfs/dbraw/zinc/83/80/70/935838070.db2.gz WFKMQRKOSFIEBV-ZDUSSCGKSA-N 0 0 362.813 3.683 20 5 FHBDRN O=C(NC[C@@H]1CCO[C@H]1c1ccccc1)Nc1ccc([N+](=O)[O-])cc1F ZINC000277709502 935844621 /nfs/dbraw/zinc/84/46/21/935844621.db2.gz SCQFXTWZQMDUSC-GUYCJALGSA-N 0 0 359.357 3.633 20 5 FHBDRN CCc1cc(NC(=O)c2c(C)nn(CC)c2C)c2cc([N+](=O)[O-])ccc2n1 ZINC000277714723 935849575 /nfs/dbraw/zinc/84/95/75/935849575.db2.gz SBTWHBCTYOZFJN-UHFFFAOYSA-N 0 0 367.409 3.791 20 5 FHBDRN Cc1noc([C@H](OC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)n1 ZINC000176687232 935850488 /nfs/dbraw/zinc/85/04/88/935850488.db2.gz WLJIHMAFFYERGB-OAHLLOKOSA-N 0 0 373.752 3.886 20 5 FHBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)NC[C@@H](c1ccccc1)C1CC1 ZINC000431458881 935851870 /nfs/dbraw/zinc/85/18/70/935851870.db2.gz MFOQEYLMEIFKGL-IBGZPJMESA-N 0 0 353.422 3.630 20 5 FHBDRN O=C(NCCCCOCc1ccccc1)c1ccc([N+](=O)[O-])cc1Cl ZINC000050423389 935853153 /nfs/dbraw/zinc/85/31/53/935853153.db2.gz KFMREZXAGXFVFC-UHFFFAOYSA-N 0 0 362.813 3.975 20 5 FHBDRN Cc1cc(C(=O)Nc2ccc3cnn(C(C)C)c3c2)c(N)c([N+](=O)[O-])c1 ZINC000176337265 935858623 /nfs/dbraw/zinc/85/86/23/935858623.db2.gz LBOVZMLKCCOJMC-UHFFFAOYSA-N 0 0 353.382 3.668 20 5 FHBDRN COc1ccc([C@@H](C)NC(=O)c2cc(F)cc(C)c2[N+](=O)[O-])cc1F ZINC000176693988 935863462 /nfs/dbraw/zinc/86/34/62/935863462.db2.gz BEOTUIHYOKMNBZ-SNVBAGLBSA-N 0 0 350.321 3.681 20 5 FHBDRN C[C@@H](c1ccco1)N(C)C(=O)c1sc(Br)cc1[N+](=O)[O-] ZINC000277730347 935864500 /nfs/dbraw/zinc/86/45/00/935864500.db2.gz BGOWDCZOENHNSP-ZETCQYMHSA-N 0 0 359.201 3.845 20 5 FHBDRN Cc1cc(F)cc(C(=O)N(C)Cc2cnn(-c3ccccc3)c2)c1[N+](=O)[O-] ZINC000176695100 935866243 /nfs/dbraw/zinc/86/62/43/935866243.db2.gz FREOERKXWQYIPU-UHFFFAOYSA-N 0 0 368.368 3.500 20 5 FHBDRN Cc1cc(F)cc(C(=O)NCc2ccc(C(F)(F)F)cc2)c1[N+](=O)[O-] ZINC000176696240 935868280 /nfs/dbraw/zinc/86/82/80/935868280.db2.gz PYEOPGKAOKKMEJ-UHFFFAOYSA-N 0 0 356.275 3.991 20 5 FHBDRN Cc1cc(C(=O)Nc2ccc3cc([N+](=O)[O-])ccc3n2)ccc1[N+](=O)[O-] ZINC000176701377 935870758 /nfs/dbraw/zinc/87/07/58/935870758.db2.gz CEARZRSVIVNXLK-UHFFFAOYSA-N 0 0 352.306 3.612 20 5 FHBDRN O=C(NCCc1cc(Br)ccc1F)c1ccc([N+](=O)[O-])s1 ZINC000065567129 935873125 /nfs/dbraw/zinc/87/31/25/935873125.db2.gz KZWNXGHSDGGBBY-UHFFFAOYSA-N 0 0 373.203 3.530 20 5 FHBDRN CCc1ccc(-c2noc(COc3ccc(C=O)cc3[N+](=O)[O-])n2)cc1 ZINC000050511035 935876565 /nfs/dbraw/zinc/87/65/65/935876565.db2.gz XFZVNJCHEUVCQY-UHFFFAOYSA-N 0 0 353.334 3.599 20 5 FHBDRN COc1ccc(CNC(=O)NCc2cccc([N+](=O)[O-])c2C)cc1Cl ZINC000479698413 935881017 /nfs/dbraw/zinc/88/10/17/935881017.db2.gz CGHPUZZVQNQLTJ-UHFFFAOYSA-N 0 0 363.801 3.565 20 5 FHBDRN O=C(Nc1nc(-c2ccccc2)c[nH]1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000611662187 935882195 /nfs/dbraw/zinc/88/21/95/935882195.db2.gz AHIVCSAARRVFDZ-UHFFFAOYSA-N 0 0 374.303 3.839 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)NCCc1cc(OC)ccc1OC ZINC000562110861 935882253 /nfs/dbraw/zinc/88/22/53/935882253.db2.gz RFHJUBKTVFPPRN-UHFFFAOYSA-N 0 0 373.409 3.539 20 5 FHBDRN Cc1cc(NC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)ccc1C(=O)N(C)C ZINC000187765020 935886456 /nfs/dbraw/zinc/88/64/56/935886456.db2.gz RWBDCWGKGMIOAS-UHFFFAOYSA-N 0 0 369.421 3.981 20 5 FHBDRN O=C(Nc1ccc2cc([N+](=O)[O-])ccc2n1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000176712214 935887951 /nfs/dbraw/zinc/88/79/51/935887951.db2.gz CVIQOCOOKQHVLZ-UHFFFAOYSA-N 0 0 372.724 3.957 20 5 FHBDRN COc1cc(CN[C@@H](C)c2cnn(CC3CCC3)c2)c([N+](=O)[O-])cc1F ZINC000934562486 935890719 /nfs/dbraw/zinc/89/07/19/935890719.db2.gz QLQUTUWXJYVSGT-LBPRGKRZSA-N 0 0 362.405 3.590 20 5 FHBDRN CCOc1cccc([C@@H]2C[C@H]2NC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)c1 ZINC000437225183 945131763 /nfs/dbraw/zinc/13/17/63/945131763.db2.gz AZQHIDNMJMJASF-JKSUJKDBSA-N 0 0 365.389 3.761 20 5 FHBDRN Cc1c(NC(=O)N2CCC[C@@]3(C2)OCc2ccccc23)cccc1[N+](=O)[O-] ZINC000479821830 935899664 /nfs/dbraw/zinc/89/96/64/935899664.db2.gz IRKJWPKCODZEFN-FQEVSTJZSA-N 0 0 367.405 3.957 20 5 FHBDRN CCC(CC)c1nnc(NC(=O)c2cc(OC)ccc2[N+](=O)[O-])s1 ZINC000115857808 935906191 /nfs/dbraw/zinc/90/61/91/935906191.db2.gz HOBHSGJWSQWDEK-UHFFFAOYSA-N 0 0 350.400 3.611 20 5 FHBDRN CSc1cc(C)ccc1CNC(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000151242974 945132942 /nfs/dbraw/zinc/13/29/42/945132942.db2.gz KAEBRTMPCNFASC-UHFFFAOYSA-N 0 0 360.435 3.710 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)N1CCc2cc(F)c(F)cc21 ZINC000479868436 935909550 /nfs/dbraw/zinc/90/95/50/935909550.db2.gz UFYHQJUCPREKLW-UHFFFAOYSA-N 0 0 361.348 3.654 20 5 FHBDRN CCCCNC(=O)c1ccc(CNCc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000479885213 935912222 /nfs/dbraw/zinc/91/22/22/935912222.db2.gz HUPXNXSRQUZTCW-UHFFFAOYSA-N 0 0 359.401 3.554 20 5 FHBDRN O=C(CCc1ncc(-c2ccccc2)o1)OCCc1ccc([N+](=O)[O-])cc1 ZINC000050626258 935915925 /nfs/dbraw/zinc/91/59/25/935915925.db2.gz PPIWRWURZNVUJV-UHFFFAOYSA-N 0 0 366.373 3.968 20 5 FHBDRN CCC(=O)c1ccc(NCc2ccccc2N2CCOCC2)c([N+](=O)[O-])c1 ZINC000479949099 935927495 /nfs/dbraw/zinc/92/74/95/935927495.db2.gz XMNVKMKNUDUVRS-UHFFFAOYSA-N 0 0 369.421 3.636 20 5 FHBDRN COc1cc(CNc2ccc(C)nc2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000128068795 935931595 /nfs/dbraw/zinc/93/15/95/935931595.db2.gz FPCVGNKLKVWNCJ-UHFFFAOYSA-N 0 0 371.315 3.860 20 5 FHBDRN CCn1nc(C)c([N+](=O)[O-])c1NCCc1ccccc1Br ZINC000479966780 935932741 /nfs/dbraw/zinc/93/27/41/935932741.db2.gz XYMRVVFOSRBXSX-UHFFFAOYSA-N 0 0 353.220 3.537 20 5 FHBDRN Cc1cc(F)cc(C(=O)NCCCO[C@H](C)c2ccccc2)c1[N+](=O)[O-] ZINC000176726447 935935247 /nfs/dbraw/zinc/93/52/47/935935247.db2.gz CJMVQJLLKNUGET-CQSZACIVSA-N 0 0 360.385 3.940 20 5 FHBDRN C[C@H]1CCc2ccccc2[C@@H]1NC(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000548751628 935936692 /nfs/dbraw/zinc/93/66/92/935936692.db2.gz QFUNGUHDRKKCCY-IFXJQAMLSA-N 0 0 353.422 3.760 20 5 FHBDRN O=[N+]([O-])c1ccc2ncnc(N(Cc3ccc(F)cc3F)C3CC3)c2c1 ZINC000611701026 935940635 /nfs/dbraw/zinc/94/06/35/935940635.db2.gz NHJOOMPJBYWKBV-UHFFFAOYSA-N 0 0 356.332 3.985 20 5 FHBDRN COc1cccc(C2=CCN(C(=O)NCc3cccc([N+](=O)[O-])c3C)C2)c1 ZINC000480052707 935948809 /nfs/dbraw/zinc/94/88/09/935948809.db2.gz GXALWJYEYQLOEC-UHFFFAOYSA-N 0 0 367.405 3.521 20 5 FHBDRN Cc1c(CNC(=O)N(Cc2ccccc2F)C2CC2)cccc1[N+](=O)[O-] ZINC000480062316 935950940 /nfs/dbraw/zinc/95/09/40/935950940.db2.gz DSHXAHWMBGTZTA-UHFFFAOYSA-N 0 0 357.385 3.917 20 5 FHBDRN O=C(Oc1cc(F)cc(F)c1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC001125616563 935955317 /nfs/dbraw/zinc/95/53/17/935955317.db2.gz FTHKQJQTHRKXNF-UHFFFAOYSA-N 0 0 358.094 3.855 20 5 FHBDRN COc1cc(CN2CC=CCC2)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000611521148 935976600 /nfs/dbraw/zinc/97/66/00/935976600.db2.gz GUVDNHSYTAUVGU-UHFFFAOYSA-N 0 0 354.406 3.944 20 5 FHBDRN Cc1ccc([C@@H]2OCCC[C@@H]2NC(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1 ZINC000074521978 935985219 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FHBDRN COC(=O)c1cc([N+](=O)[O-])c(Cl)cc1NCc1c(F)cccc1OC ZINC001167608074 936034884 /nfs/dbraw/zinc/03/48/84/936034884.db2.gz CYTIFLWSPNELFP-UHFFFAOYSA-N 0 0 368.748 3.795 20 5 FHBDRN O=C(OCc1nnc(-c2ccccc2)o1)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000135628399 936038565 /nfs/dbraw/zinc/03/85/65/936038565.db2.gz QQZOXZFBULZRLF-UHFFFAOYSA-N 0 0 359.725 3.655 20 5 FHBDRN O=[N+]([O-])c1ccc2ncnc(N3CC[C@@H](Oc4ccccc4Cl)C3)c2c1 ZINC000611712134 936040424 /nfs/dbraw/zinc/04/04/24/936040424.db2.gz GQAWFGUZBBYANF-CYBMUJFWSA-N 0 0 370.796 3.849 20 5 FHBDRN C[C@H]1CN(c2ncnc3ccc([N+](=O)[O-])cc32)C[C@H](c2ccsc2)O1 ZINC000611712186 936041718 /nfs/dbraw/zinc/04/17/18/936041718.db2.gz XQUVMJQHWIFWBA-MEDUHNTESA-N 0 0 356.407 3.566 20 5 FHBDRN Cc1c(OCC(=O)NCc2ccccc2COC(C)C)cccc1[N+](=O)[O-] ZINC000077250920 936042941 /nfs/dbraw/zinc/04/29/41/936042941.db2.gz XDJOJTILNLASET-UHFFFAOYSA-N 0 0 372.421 3.523 20 5 FHBDRN CN(C(=O)c1csc([N+](=O)[O-])c1)C1CCN(c2ccc(F)cc2)CC1 ZINC000077294210 936043604 /nfs/dbraw/zinc/04/36/04/936043604.db2.gz PPVINQIGEPOSQC-UHFFFAOYSA-N 0 0 363.414 3.536 20 5 FHBDRN CO[C@H](CNC(=O)c1ccc([N+](=O)[O-])cc1F)c1ccccc1Cl ZINC000121890160 936045379 /nfs/dbraw/zinc/04/53/79/936045379.db2.gz YZQBDACCCPCKFC-OAHLLOKOSA-N 0 0 352.749 3.505 20 5 FHBDRN COc1ccc(NC(=O)COc2cc(C)ccc2Cl)cc1[N+](=O)[O-] ZINC000611777662 936046672 /nfs/dbraw/zinc/04/66/72/936046672.db2.gz SHOHGCJNNKBSPO-UHFFFAOYSA-N 0 0 350.758 3.583 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)CSc1ccc(C)cc1 ZINC000472254511 936058269 /nfs/dbraw/zinc/05/82/69/936058269.db2.gz DBAQBRGLYWHBGE-CYBMUJFWSA-N 0 0 360.435 3.822 20 5 FHBDRN CC(C)c1ccc(C(=O)N[C@H](C)c2nc(C(C)(C)C)no2)cc1[N+](=O)[O-] ZINC000187804188 936063399 /nfs/dbraw/zinc/06/33/99/936063399.db2.gz VKXFVBDGWNWTOM-LLVKDONJSA-N 0 0 360.414 3.890 20 5 FHBDRN CCC(=O)Nc1cccc(COC(=O)c2c(C)c(F)ccc2[N+](=O)[O-])c1 ZINC001270552863 945143129 /nfs/dbraw/zinc/14/31/29/945143129.db2.gz LYBGZGNAWNLJLQ-UHFFFAOYSA-N 0 0 360.341 3.748 20 5 FHBDRN CCc1ccc(CN2CCN(c3nc(C)cc(C)c3[N+](=O)[O-])CC2)s1 ZINC000582744733 936067340 /nfs/dbraw/zinc/06/73/40/936067340.db2.gz BJCJYIPBLZBDDH-UHFFFAOYSA-N 0 0 360.483 3.553 20 5 FHBDRN COC[C@@H](Nc1ncnc2ccc([N+](=O)[O-])cc21)c1ccc(F)c(F)c1 ZINC000611714700 936068588 /nfs/dbraw/zinc/06/85/88/936068588.db2.gz XBHITXSEDYKMPW-MRXNPFEDSA-N 0 0 360.320 3.616 20 5 FHBDRN Cc1ncc([N+](=O)[O-])n1CCOC(=O)CCc1ccc(Cl)c(Cl)c1 ZINC000102123770 936083221 /nfs/dbraw/zinc/08/32/21/936083221.db2.gz SBCCTYYJKMCWIH-UHFFFAOYSA-N 0 0 372.208 3.583 20 5 FHBDRN O=C(Nc1cc(F)ccc1Cl)N1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000582755546 936083701 /nfs/dbraw/zinc/08/37/01/936083701.db2.gz ZMLLQEUAHZUJLH-UHFFFAOYSA-N 0 0 365.748 3.814 20 5 FHBDRN CN(C)C(=O)C[C@@H]1CN(c2ccccc2[N+](=O)[O-])c2ccc(Cl)cc21 ZINC000078331807 936109381 /nfs/dbraw/zinc/10/93/81/936109381.db2.gz FVQFPHLEXJWPFG-GFCCVEGCSA-N 0 0 359.813 3.962 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])Nc1ccc(OCC(F)(F)F)cc1 ZINC000061109814 936121133 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FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)Nc1nc(-c2ccccc2)cs1 ZINC000061191411 936202913 /nfs/dbraw/zinc/20/29/13/936202913.db2.gz NDMPQOSFEGDTTE-UHFFFAOYSA-N 0 0 355.375 3.979 20 5 FHBDRN CCOc1ccc([C@@H]2C[C@H]2NC(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)cc1 ZINC000437222816 945149449 /nfs/dbraw/zinc/14/94/49/945149449.db2.gz QSRMORDNHUABEW-DLBZAZTESA-N 0 0 370.405 3.596 20 5 FHBDRN CCCOCc1ccccc1CNC(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000046534772 936204342 /nfs/dbraw/zinc/20/43/42/936204342.db2.gz OHGSQELJHAWHQB-UHFFFAOYSA-N 0 0 374.462 3.930 20 5 FHBDRN CCN(CCCNC(=O)CSc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000046541346 936219372 /nfs/dbraw/zinc/21/93/72/936219372.db2.gz XUXKKIBLNFTPGI-UHFFFAOYSA-N 0 0 373.478 3.720 20 5 FHBDRN O=C(NCC1(CO)CCC1)c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1 ZINC000612386085 936234315 /nfs/dbraw/zinc/23/43/15/936234315.db2.gz LVJLSWDWXKMICJ-UHFFFAOYSA-N 0 0 372.446 3.638 20 5 FHBDRN O=C(NC1CCCC1)c1ccccc1OCCc1ccc([N+](=O)[O-])cc1 ZINC000582867625 936237677 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CN(Cc1cccc(C(F)(F)F)c1)C(=O)c1cc(F)cc([N+](=O)[O-])c1N ZINC000519131901 945157271 /nfs/dbraw/zinc/15/72/71/945157271.db2.gz OVSZOQDHKNJJOG-UHFFFAOYSA-N 0 0 371.290 3.607 20 5 FHBDRN C[C@@H](c1ccc(F)cc1)N(C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000047406708 945157719 /nfs/dbraw/zinc/15/77/19/945157719.db2.gz WJLVRTDDLNEKBR-LBPRGKRZSA-N 0 0 356.357 3.977 20 5 FHBDRN O=[N+]([O-])c1ccccc1/C=C/CNc1ccccc1N1CCC(O)CC1 ZINC000187914751 938250057 /nfs/dbraw/zinc/25/00/57/938250057.db2.gz PKCHENMZFFADNQ-FNORWQNLSA-N 0 0 353.422 3.681 20 5 FHBDRN CCN(Cc1cccc(Cl)c1)c1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000052355963 938258852 /nfs/dbraw/zinc/25/88/52/938258852.db2.gz SMYZKBFYBZEWNL-UHFFFAOYSA-N 0 0 368.842 3.678 20 5 FHBDRN Cc1ccc(C(=O)N2CCO[C@H](c3ccc(Cl)cc3)C2)cc1[N+](=O)[O-] ZINC000080425824 938261728 /nfs/dbraw/zinc/26/17/28/938261728.db2.gz MQGWJZIDZIGDPG-KRWDZBQOSA-N 0 0 360.797 3.770 20 5 FHBDRN COc1ccc(C(=O)Nc2cc(C)nc3ccc([N+](=O)[O-])cc32)cc1OC ZINC000161747550 938281790 /nfs/dbraw/zinc/28/17/90/938281790.db2.gz GYCOOMIROGPIAX-UHFFFAOYSA-N 0 0 367.361 3.721 20 5 FHBDRN O=C(N[C@@H]1CCOC2(CCC2)C1)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000278292035 938287124 /nfs/dbraw/zinc/28/71/24/938287124.db2.gz ZXQDBUMMIHOGBW-CQSZACIVSA-N 0 0 362.429 3.925 20 5 FHBDRN O=C(c1ccc(OC(F)F)c([N+](=O)[O-])c1)N(CC(F)(F)F)C1CCC1 ZINC000583519086 938287351 /nfs/dbraw/zinc/28/73/51/938287351.db2.gz GYDMUXPYQZBHHG-UHFFFAOYSA-N 0 0 368.258 3.753 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])Nc1cccc(OCc2cccnc2)c1 ZINC000046598501 938289529 /nfs/dbraw/zinc/28/95/29/938289529.db2.gz AXDSDAHJYBFRPP-UHFFFAOYSA-N 0 0 363.373 3.750 20 5 FHBDRN O=C(Cn1cc(Cl)cn1)N(Cc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000583522329 938291209 /nfs/dbraw/zinc/29/12/09/938291209.db2.gz AXNBITUCZOLCHC-UHFFFAOYSA-N 0 0 370.796 3.678 20 5 FHBDRN CCCCN(Cc1ccccc1F)C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC001125675041 938299412 /nfs/dbraw/zinc/29/94/12/938299412.db2.gz RNXSYMDSTXNLGU-UHFFFAOYSA-N 0 0 374.368 3.905 20 5 FHBDRN COc1ccc(OC)c([C@H]2C[C@@H]2c2nc(-c3ccc([N+](=O)[O-])s3)no2)c1 ZINC000583590666 938311197 /nfs/dbraw/zinc/31/11/97/938311197.db2.gz CIVIKEPCUVHOMW-PWSUYJOCSA-N 0 0 373.390 3.995 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1CN1CCO[C@H](c2ccc(F)cc2)C1 ZINC000507351225 945164030 /nfs/dbraw/zinc/16/40/30/945164030.db2.gz CWQKXKYIYPUZOF-IBGZPJMESA-N 0 0 360.385 3.706 20 5 FHBDRN Cc1ccc(-c2csc(Cn3cc(Cl)cc([N+](=O)[O-])c3=O)n2)cc1 ZINC000506419893 945164159 /nfs/dbraw/zinc/16/41/59/945164159.db2.gz BLXUJISAQLGNRN-UHFFFAOYSA-N 0 0 361.810 3.890 20 5 FHBDRN COc1ccc([C@@H](NCCOc2cccc([N+](=O)[O-])c2)C(F)(F)F)cc1 ZINC000506004315 945167252 /nfs/dbraw/zinc/16/72/52/945167252.db2.gz ZIOWJISYTPPWPW-MRXNPFEDSA-N 0 0 370.327 3.875 20 5 FHBDRN COc1ccc(CC(=O)N2CCC[C@@H]2c2ccc(F)cc2C)cc1[N+](=O)[O-] ZINC000583677620 938355032 /nfs/dbraw/zinc/35/50/32/938355032.db2.gz HANUZZXFYZGKSJ-QGZVFWFLSA-N 0 0 372.396 3.957 20 5 FHBDRN COc1ccc(CC(=O)N2CCC[C@H]2c2ccc(F)cc2C)cc1[N+](=O)[O-] ZINC000583677619 938355199 /nfs/dbraw/zinc/35/51/99/938355199.db2.gz HANUZZXFYZGKSJ-KRWDZBQOSA-N 0 0 372.396 3.957 20 5 FHBDRN Cc1cc(NC(=O)CCc2nc(C(C)C)no2)c2cc([N+](=O)[O-])ccc2n1 ZINC000161826263 938355607 /nfs/dbraw/zinc/35/56/07/938355607.db2.gz ANNKJFAFRJECBY-UHFFFAOYSA-N 0 0 369.381 3.529 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)N[C@@H]2CCC[C@H](C(C)C)CC2)cc1F ZINC001211593932 938360506 /nfs/dbraw/zinc/36/05/06/938360506.db2.gz AOENIUFIKXOGAW-UONOGXRCSA-N 0 0 372.462 3.926 20 5 FHBDRN O=[N+]([O-])c1ncccc1-c1nc(-c2cc(F)cc(OC(F)(F)F)c2)no1 ZINC001213172159 938367647 /nfs/dbraw/zinc/36/76/47/938367647.db2.gz ORJOTQNVPVCCNH-UHFFFAOYSA-N 0 0 370.218 3.745 20 5 FHBDRN CN(C(=O)[C@@H]1CCN(c2c(Cl)cccc2[N+](=O)[O-])C1)c1ccccc1 ZINC000432137179 945168611 /nfs/dbraw/zinc/16/86/11/945168611.db2.gz CZKCLPHCCAEDQC-CYBMUJFWSA-N 0 0 359.813 3.738 20 5 FHBDRN Cc1cc(NC(=O)CCc2nnc(C(C)C)o2)c2cc([N+](=O)[O-])ccc2n1 ZINC000161850486 938370726 /nfs/dbraw/zinc/37/07/26/938370726.db2.gz MJXFDYGVDRZLSO-UHFFFAOYSA-N 0 0 369.381 3.529 20 5 FHBDRN Cc1cc(OCC(=O)NCc2ccc3sccc3c2)ccc1[N+](=O)[O-] ZINC000583724599 938377317 /nfs/dbraw/zinc/37/73/17/938377317.db2.gz UPBADOZUCDEEMR-UHFFFAOYSA-N 0 0 356.403 3.813 20 5 FHBDRN C[C@H]1CO[C@H](c2ccccc2Cl)CN1c1ncc([N+](=O)[O-])cc1F ZINC000583739482 938386114 /nfs/dbraw/zinc/38/61/14/938386114.db2.gz KKOBLFFYDXPPOY-BONVTDFDSA-N 0 0 351.765 3.749 20 5 FHBDRN CSc1ccc(NC(=O)[C@H](C)N(C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000046599476 938396215 /nfs/dbraw/zinc/39/62/15/938396215.db2.gz NENJRSNOYLWRTC-ZDUSSCGKSA-N 0 0 359.451 3.776 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)C(F)(F)F)cc1S[C@H]1CCCOC1 ZINC000278418966 938406106 /nfs/dbraw/zinc/40/61/06/938406106.db2.gz IITGRDZXWFSJHP-ZETCQYMHSA-N 0 0 358.288 3.915 20 5 FHBDRN CCCOc1cc(NC(=O)[C@H]2CCO[C@H]2C)c([N+](=O)[O-])cc1OCCC ZINC000536125142 938406711 /nfs/dbraw/zinc/40/67/11/938406711.db2.gz FMKXRKIWOMTWMV-STQMWFEESA-N 0 0 366.414 3.536 20 5 FHBDRN Cc1cccn2cc(COc3c(Br)cccc3[N+](=O)[O-])nc12 ZINC000583789351 938410134 /nfs/dbraw/zinc/41/01/34/938410134.db2.gz BHBOESRHIIRMFT-UHFFFAOYSA-N 0 0 362.183 3.892 20 5 FHBDRN CCc1c(NC(=O)Cc2cccc([N+](=O)[O-])c2C)cnn1CCC(C)C ZINC000427203928 945173667 /nfs/dbraw/zinc/17/36/67/945173667.db2.gz JCGKYFMQFSXDBR-UHFFFAOYSA-N 0 0 358.442 3.889 20 5 FHBDRN CC(=O)c1cc(F)c(NC(=O)c2ccc([N+](=O)[O-])c(C)c2)c(F)c1F ZINC000536136023 938428621 /nfs/dbraw/zinc/42/86/21/938428621.db2.gz OQYXODSPHISDAV-UHFFFAOYSA-N 0 0 352.268 3.775 20 5 FHBDRN COc1cc([C@@H]2Nc3ccccc3C(=O)N2CC(C)C)ccc1[N+](=O)[O-] ZINC000536141013 938439078 /nfs/dbraw/zinc/43/90/78/938439078.db2.gz NHQATJJGXQSQRK-GOSISDBHSA-N 0 0 355.394 3.826 20 5 FHBDRN CCS[C@@H]1CCCC[C@@H]1NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000427206419 945175462 /nfs/dbraw/zinc/17/54/62/945175462.db2.gz RMAWOAZJMFISMD-LSDHHAIUSA-N 0 0 356.875 3.971 20 5 FHBDRN CCS[C@H]1CCCC[C@H]1NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000427206410 945175592 /nfs/dbraw/zinc/17/55/92/945175592.db2.gz RMAWOAZJMFISMD-CABCVRRESA-N 0 0 356.875 3.971 20 5 FHBDRN COCc1ccc([C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000161918290 938452330 /nfs/dbraw/zinc/45/23/30/938452330.db2.gz KVBFKCIUOGLDCY-OAHLLOKOSA-N 0 0 364.785 3.965 20 5 FHBDRN Cc1cc([N+](=O)[O-])cnc1N1CCN(c2cccc(C(F)(F)F)c2)CC1 ZINC000110933435 945176492 /nfs/dbraw/zinc/17/64/92/945176492.db2.gz AEKHOPBYJVNIHF-UHFFFAOYSA-N 0 0 366.343 3.644 20 5 FHBDRN C[C@@H]1COCC[C@H]1NC(=O)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12 ZINC000278476877 938464602 /nfs/dbraw/zinc/46/46/02/938464602.db2.gz KHBSSHPVPFSYHT-QLJPJBMISA-N 0 0 372.371 3.527 20 5 FHBDRN CSc1cc(C)ccc1CNC(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000536155669 938470593 /nfs/dbraw/zinc/47/05/93/938470593.db2.gz NYSKBJBVLMUKSB-UHFFFAOYSA-N 0 0 359.451 3.667 20 5 FHBDRN CC(=O)c1cc([N+](=O)[O-])ccc1OCc1noc(-c2ccccc2C)n1 ZINC000536158316 938476335 /nfs/dbraw/zinc/47/63/35/938476335.db2.gz PXTHWJREZGGTKO-UHFFFAOYSA-N 0 0 353.334 3.735 20 5 FHBDRN Cc1ccc([C@@]2(C)CCN(C(=O)c3n[nH]c4ccc([N+](=O)[O-])cc43)C2)cc1 ZINC000583927863 938486402 /nfs/dbraw/zinc/48/64/02/938486402.db2.gz NQLIPZJYBUBUJI-FQEVSTJZSA-N 0 0 364.405 3.583 20 5 FHBDRN C[C@@H]1CCC[C@H](NC(=O)COc2ccc([N+](=O)[O-])cc2C(F)(F)F)[C@@H]1C ZINC000516715117 945179364 /nfs/dbraw/zinc/17/93/64/945179364.db2.gz OIHNQXNPTPQRAF-GYSYKLTISA-N 0 0 374.359 3.933 20 5 FHBDRN Cc1cnccc1OC1CCN(c2ccnc3c2cccc3[N+](=O)[O-])CC1 ZINC000432140051 945179943 /nfs/dbraw/zinc/17/99/43/945179943.db2.gz OLOZWKCQWUVDIQ-UHFFFAOYSA-N 0 0 364.405 3.894 20 5 FHBDRN Cc1ccc(NC(=O)c2ccccc2[N+](=O)[O-])cc1C(=O)N1CCCCC1 ZINC000278513415 938494073 /nfs/dbraw/zinc/49/40/73/938494073.db2.gz PCQZAHZKFZFUNA-UHFFFAOYSA-N 0 0 367.405 3.782 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C(=O)NCCc2cc(F)cc(F)c2)cc1Cl ZINC001125695777 938494285 /nfs/dbraw/zinc/49/42/85/938494285.db2.gz BVVHFGKCLLIKGN-UHFFFAOYSA-N 0 0 354.740 3.807 20 5 FHBDRN O=C(CCc1c(Cl)cccc1[N+](=O)[O-])N1CCC[C@@H]1[C@H]1CCCC1=O ZINC000935142649 938501356 /nfs/dbraw/zinc/50/13/56/938501356.db2.gz MPJMRMGOTMPRSM-UKRRQHHQSA-N 0 0 364.829 3.541 20 5 FHBDRN CSc1cccc(-c2nc(-c3nccc4[nH]ccc43)no2)c1[N+](=O)[O-] ZINC000583961266 938505480 /nfs/dbraw/zinc/50/54/80/938505480.db2.gz RDLGHOZBYOLSSP-UHFFFAOYSA-N 0 0 353.363 3.910 20 5 FHBDRN Cc1cc([N+](=O)[O-])cnc1N(C)CCCc1cc(-c2cccc(F)c2)n[nH]1 ZINC000536188156 938532484 /nfs/dbraw/zinc/53/24/84/938532484.db2.gz QUMQHBRWIDPZBQ-UHFFFAOYSA-N 0 0 369.400 3.896 20 5 FHBDRN CN(Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)[C@H](CO)c1ccccc1 ZINC000584007120 938535221 /nfs/dbraw/zinc/53/52/21/938535221.db2.gz IHTUTPGREANUCT-MRXNPFEDSA-N 0 0 354.328 3.779 20 5 FHBDRN Cc1csc(NC2CCN(C/C=C\c3ccccc3[N+](=O)[O-])CC2)n1 ZINC000473076546 945186707 /nfs/dbraw/zinc/18/67/07/945186707.db2.gz SSRRCMAUYDKIMG-XQRVVYSFSA-N 0 0 358.467 3.949 20 5 FHBDRN C=C1c2ccccc2C(=O)N1CC(=O)Nc1cc([N+](=O)[O-])c(Cl)cc1C ZINC000135500485 938599027 /nfs/dbraw/zinc/59/90/27/938599027.db2.gz RQWDIKGGFURWHZ-UHFFFAOYSA-N 0 0 371.780 3.622 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCc1ccncc1CC ZINC000507371032 945189628 /nfs/dbraw/zinc/18/96/28/945189628.db2.gz QDAGMTBVAYGXJD-UHFFFAOYSA-N 0 0 359.451 3.984 20 5 FHBDRN COc1cccc2cc(C(=O)N3CCCc4c([N+](=O)[O-])cccc43)oc21 ZINC000162052969 938616906 /nfs/dbraw/zinc/61/69/06/938616906.db2.gz WTTIAMMQPCOVQJ-UHFFFAOYSA-N 0 0 352.346 3.943 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1OC[C@@H](O)c1ccccc1C(F)(F)F ZINC000179055992 938627381 /nfs/dbraw/zinc/62/73/81/938627381.db2.gz GIJFGMCLEKEZFP-CYBMUJFWSA-N 0 0 357.284 3.735 20 5 FHBDRN Cc1cc(S(=O)(=O)N2CCCC[C@@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000545191411 938636131 /nfs/dbraw/zinc/63/61/31/938636131.db2.gz FAUUJJCDZJZJSA-GOSISDBHSA-N 0 0 360.435 3.819 20 5 FHBDRN Cc1ccc(-c2noc(-c3ncccc3Br)n2)cc1[N+](=O)[O-] ZINC000584197507 938636722 /nfs/dbraw/zinc/63/67/22/938636722.db2.gz PEFJFWZIDYVFIA-UHFFFAOYSA-N 0 0 361.155 3.778 20 5 FHBDRN CCS[C@H]1CCC[C@@H](Nc2nc(C)cc(C(=O)OC)c2[N+](=O)[O-])C1 ZINC000584249104 938658558 /nfs/dbraw/zinc/65/85/58/938658558.db2.gz ULHUJKDIPGRMKT-NEPJUHHUSA-N 0 0 353.444 3.561 20 5 FHBDRN CSc1ccccc1NC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000052935006 938663080 /nfs/dbraw/zinc/66/30/80/938663080.db2.gz JJPHPKVDANSSRV-UHFFFAOYSA-N 0 0 368.418 3.970 20 5 FHBDRN O=C(NC/C=C\c1ccccc1)c1cccc([N+](=O)[O-])c1Br ZINC000588590865 938664076 /nfs/dbraw/zinc/66/40/76/938664076.db2.gz VXNYDRJVOZOSEF-YVMONPNESA-N 0 0 361.195 3.801 20 5 FHBDRN Cc1cc(Cc2noc(CCc3ncc(C(C)(C)C)o3)n2)ccc1[N+](=O)[O-] ZINC000584283843 938670177 /nfs/dbraw/zinc/67/01/77/938670177.db2.gz HFDBCFJKJYEBOJ-UHFFFAOYSA-N 0 0 370.409 3.948 20 5 FHBDRN O=C(OCc1cccnc1Cl)c1ccc(Br)cc1[N+](=O)[O-] ZINC000176817685 938674422 /nfs/dbraw/zinc/67/44/22/938674422.db2.gz AUIACBMEBYGPKA-UHFFFAOYSA-N 0 0 371.574 3.763 20 5 FHBDRN Cc1ccc([C@@H]2C[C@@H](C)N(C(=O)c3cc4c(cc3[N+](=O)[O-])OCO4)C2)cc1 ZINC000573182160 938678881 /nfs/dbraw/zinc/67/88/81/938678881.db2.gz KIMRIQZFAVSRQC-UKRRQHHQSA-N 0 0 368.389 3.650 20 5 FHBDRN Cn1cc(CNCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)c(C(C)(C)C)n1 ZINC000278728537 938693120 /nfs/dbraw/zinc/69/31/20/938693120.db2.gz LNYOTIKLVFXYOW-UHFFFAOYSA-N 0 0 370.375 3.934 20 5 FHBDRN Cc1cc(N2CCC[C@@]3(CCCOC3)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000080706582 938698004 /nfs/dbraw/zinc/69/80/04/938698004.db2.gz MAEQIBZOKXMWSH-HXUWFJFHSA-N 0 0 368.437 3.757 20 5 FHBDRN Cc1cc(Sc2nnc(C3CC3)n2-c2ccccc2)ncc1[N+](=O)[O-] ZINC000074738958 938707943 /nfs/dbraw/zinc/70/79/43/938707943.db2.gz MPFDJSPCFFNHSG-UHFFFAOYSA-N 0 0 353.407 3.908 20 5 FHBDRN CCN(Cc1ccoc1)C(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000102290363 938713191 /nfs/dbraw/zinc/71/31/91/938713191.db2.gz GDXNRUWGLBGOKF-UHFFFAOYSA-N 0 0 357.410 3.840 20 5 FHBDRN Cc1ccc(S(=O)(=O)N(CC2CCC2)c2ccccc2)c([N+](=O)[O-])c1 ZINC000437284717 945199362 /nfs/dbraw/zinc/19/93/62/945199362.db2.gz CAFRPNAGZQKNJX-UHFFFAOYSA-N 0 0 360.435 3.899 20 5 FHBDRN O=C1NCCN1c1cccc(N[C@H]2CCCc3ccc([N+](=O)[O-])cc32)c1 ZINC000278750066 938794347 /nfs/dbraw/zinc/79/43/47/938794347.db2.gz NTVMMSVBWGIFDK-SFHVURJKSA-N 0 0 352.394 3.614 20 5 FHBDRN CCc1ccc(C(=O)Nc2ccc(C(=O)NC(C)(C)C)cc2)cc1[N+](=O)[O-] ZINC000081828445 938804525 /nfs/dbraw/zinc/80/45/25/938804525.db2.gz BSWFRBYOFWEMLU-UHFFFAOYSA-N 0 0 369.421 3.938 20 5 FHBDRN CC(C)[C@H]1C[C@H](NC(=O)CCc2c(Cl)cccc2[N+](=O)[O-])CCO1 ZINC000935224987 938816847 /nfs/dbraw/zinc/81/68/47/938816847.db2.gz DKSCAIMQPCBVPI-MLGOLLRUSA-N 0 0 354.834 3.501 20 5 FHBDRN CN(C(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1)c1cccc2ncccc21 ZINC001267368462 938829002 /nfs/dbraw/zinc/82/90/02/938829002.db2.gz PAFKFQMUZLJKPE-UHFFFAOYSA-N 0 0 373.372 3.605 20 5 FHBDRN CCc1nc(CN(C)C(=O)[C@H](CC)Cc2ccc([N+](=O)[O-])cc2)cs1 ZINC000545196106 938830623 /nfs/dbraw/zinc/83/06/23/938830623.db2.gz VBFDCXIPJZBIKG-CQSZACIVSA-N 0 0 361.467 3.841 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N[C@H](c1ccccc1)c1ccccn1 ZINC000087054124 938841228 /nfs/dbraw/zinc/84/12/28/938841228.db2.gz AULPHYSFNNQPQL-OAQYLSRUSA-N 0 0 361.401 3.828 20 5 FHBDRN Cc1ccccc1CCNC(=O)COc1cc(C)c([N+](=O)[O-])cc1Cl ZINC000506435294 945214198 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FHBDRN O=C(Nc1cnns1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000188229236 939056565 /nfs/dbraw/zinc/05/65/65/939056565.db2.gz XHSONBWIKROELS-UHFFFAOYSA-N 0 0 358.404 3.850 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1N1CCC([C@@H]2CCOC2)CC1 ZINC000612099177 939059015 /nfs/dbraw/zinc/05/90/15/939059015.db2.gz RUMFUQUZNGASDW-GFCCVEGCSA-N 0 0 355.232 3.610 20 5 FHBDRN COC(=O)c1c(F)cccc1NCc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000179282034 939061922 /nfs/dbraw/zinc/06/19/22/939061922.db2.gz SHGPLUKMHQARIW-UHFFFAOYSA-N 0 0 371.324 3.788 20 5 FHBDRN COCc1cccc(CNc2ccc(/C=C\C(=O)OC)cc2[N+](=O)[O-])c1 ZINC000255676105 939083271 /nfs/dbraw/zinc/08/32/71/939083271.db2.gz KPWROAVWTIPOHE-CLFYSBASSA-N 0 0 356.378 3.540 20 5 FHBDRN C[C@@H](C[C@H](O)c1ccco1)NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000179325212 939086397 /nfs/dbraw/zinc/08/63/97/939086397.db2.gz PPYVDCURTFNBFS-GWCFXTLKSA-N 0 0 360.391 3.645 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)Nc1nc2c(s1)CCCC2 ZINC000179366210 939097247 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20 5 FHBDRN O=C(C=Cc1ccc([N+](=O)[O-])cc1)N1CCC[C@@H]1CC(=O)c1ccccc1 ZINC000255765055 939175803 /nfs/dbraw/zinc/17/58/03/939175803.db2.gz BALSVPSHKDKPPU-QTJNJRLBSA-N 0 0 364.401 3.872 20 5 FHBDRN C/C(=C/C(=O)NC[C@H]1CCN(c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000785226542 939185721 /nfs/dbraw/zinc/18/57/21/939185721.db2.gz UQLBFOPUDTYBAX-VZVUQDNOSA-N 0 0 365.433 3.641 20 5 FHBDRN Cc1cc(C(=O)NC[C@H]2CCCO[C@H]2c2ccccc2)cc([N+](=O)[O-])c1 ZINC000148416738 939202331 /nfs/dbraw/zinc/20/23/31/939202331.db2.gz PEBNWWQHVBTHAU-APWZRJJASA-N 0 0 354.406 3.801 20 5 FHBDRN COc1cc(C(=O)Nc2cccc(NC(=O)C(C)C)c2)cc([N+](=O)[O-])c1C ZINC000188368827 939216167 /nfs/dbraw/zinc/21/61/67/939216167.db2.gz WXSJUQUJONRNQS-UHFFFAOYSA-N 0 0 371.393 3.759 20 5 FHBDRN O=C(OCC/C=C/Br)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000835795008 939219572 /nfs/dbraw/zinc/21/95/72/939219572.db2.gz JKUKASGXOPZSBF-ORCRQEGFSA-N 0 0 366.114 3.652 20 5 FHBDRN C/C(=C\C(=O)NCc1ncc(-c2ccccc2)o1)c1ccc([N+](=O)[O-])cc1 ZINC000785232977 939222399 /nfs/dbraw/zinc/22/23/99/939222399.db2.gz PXZDGQIWALPNFQ-SDNWHVSQSA-N 0 0 363.373 3.970 20 5 FHBDRN O=[N+]([O-])c1cccc2c(NC3CCN(CC(F)(F)F)CC3)ccnc21 ZINC000432168556 945244767 /nfs/dbraw/zinc/24/47/67/945244767.db2.gz YDEGREDZLPDTJL-UHFFFAOYSA-N 0 0 354.332 3.582 20 5 FHBDRN CCOc1ccc(CN(C)C(=O)c2cc(SC)ccc2[N+](=O)[O-])cc1 ZINC000018074287 945252328 /nfs/dbraw/zinc/25/23/28/945252328.db2.gz YCCRFHDDNIOQIA-UHFFFAOYSA-N 0 0 360.435 3.988 20 5 FHBDRN Cc1ccnc(OC2CCN(c3ccnc4c3cccc4[N+](=O)[O-])CC2)c1 ZINC000432172195 945252857 /nfs/dbraw/zinc/25/28/57/945252857.db2.gz LAMGPRGLRWMOPL-UHFFFAOYSA-N 0 0 364.405 3.894 20 5 FHBDRN Cc1ccc(S(=O)(=O)N(C)CCCCc2ccccc2)c([N+](=O)[O-])c1 ZINC000507469237 945255725 /nfs/dbraw/zinc/25/57/25/945255725.db2.gz IZNUYWIOVCABQD-UHFFFAOYSA-N 0 0 362.451 3.547 20 5 FHBDRN Cc1c(Cc2noc(-c3cccnc3OC(C)C)n2)cccc1[N+](=O)[O-] ZINC000518254995 945256366 /nfs/dbraw/zinc/25/63/66/945256366.db2.gz QEIIPQSTXMWHAC-UHFFFAOYSA-N 0 0 354.366 3.726 20 5 FHBDRN CC(C)c1ccc(C(=O)N[C@H](C)c2ccc([S@@](C)=O)cc2)cc1[N+](=O)[O-] ZINC000438951877 945259168 /nfs/dbraw/zinc/25/91/68/945259168.db2.gz WKGRDIDEXBKZAV-ZBSNKRKSSA-N 0 0 374.462 3.947 20 5 FHBDRN CCOC(=O)c1ccc(NC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000047523996 945259920 /nfs/dbraw/zinc/25/99/20/945259920.db2.gz BOOQTYOHBMEKEL-LBPRGKRZSA-N 0 0 357.366 3.654 20 5 FHBDRN O=[N+]([O-])c1ccc(S(=O)(=O)Nc2cccc(Cl)c2F)c(Cl)c1 ZINC000047521879 945260111 /nfs/dbraw/zinc/26/01/11/945260111.db2.gz CTEMCLSGRLTPEH-UHFFFAOYSA-N 0 0 365.169 3.842 20 5 FHBDRN Cc1cc(OCC(=O)NC[C@@H](Nc2ccccc2)C(C)C)ccc1[N+](=O)[O-] ZINC000437350703 945262904 /nfs/dbraw/zinc/26/29/04/945262904.db2.gz WOQBZODTOMZAIT-GOSISDBHSA-N 0 0 371.437 3.535 20 5 FHBDRN CC[C@@H]1CN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C[C@@H](C)[S@@]1=O ZINC000516815516 945264759 /nfs/dbraw/zinc/26/47/59/945264759.db2.gz UNIZQBAWJDVQQW-URHRGWDJSA-N 0 0 362.451 3.586 20 5 FHBDRN C[C@@H](CCO)N(Cc1ccccc1)c1ccc([N+](=O)[O-])c2cnccc21 ZINC000092962840 945266403 /nfs/dbraw/zinc/26/64/03/945266403.db2.gz OUOQIMKZHYMLNQ-HNNXBMFYSA-N 0 0 351.406 3.921 20 5 FHBDRN CCOC(=O)c1cccc(NC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000047524385 945275640 /nfs/dbraw/zinc/27/56/40/945275640.db2.gz AQIFUFKWFSWXHL-LBPRGKRZSA-N 0 0 357.366 3.654 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@H]1c1ccc(Cl)c(F)c1 ZINC000437368223 945276942 /nfs/dbraw/zinc/27/69/42/945276942.db2.gz ZIIXVBLIPUPTGY-XHDPSFHLSA-N 0 0 364.760 3.682 20 5 FHBDRN Cc1cn(-c2c(F)cccc2F)nc1C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000188414407 939874067 /nfs/dbraw/zinc/87/40/67/939874067.db2.gz TYNHVNJNXTUDSH-UHFFFAOYSA-N 0 0 358.304 3.619 20 5 FHBDRN Cc1c(C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)cnn1CC(C)C ZINC000179523392 939881641 /nfs/dbraw/zinc/88/16/41/939881641.db2.gz QORFBQDTDFKAOU-UHFFFAOYSA-N 0 0 358.442 3.807 20 5 FHBDRN Nc1c(C(=O)NCCc2c(Cl)cccc2Cl)cc(F)cc1[N+](=O)[O-] ZINC000065825861 939887166 /nfs/dbraw/zinc/88/71/66/939887166.db2.gz SNAGKWAHHYSRKM-UHFFFAOYSA-N 0 0 372.183 3.595 20 5 FHBDRN CCc1nn(C)c(OC)c1CNc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000092962472 945279298 /nfs/dbraw/zinc/27/92/98/945279298.db2.gz SHGYTVHBKKWCDH-UHFFFAOYSA-N 0 0 358.320 3.530 20 5 FHBDRN COc1cccc(CC2CCN(C(=O)c3ccc(F)cc3[N+](=O)[O-])CC2)c1 ZINC000612215092 939888927 /nfs/dbraw/zinc/88/89/27/939888927.db2.gz WFOPONXZCAPJBZ-UHFFFAOYSA-N 0 0 372.396 3.837 20 5 FHBDRN COc1ccc(C(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)cc1 ZINC000091963542 939889807 /nfs/dbraw/zinc/88/98/07/939889807.db2.gz REZSLNXDGSQBOG-UHFFFAOYSA-N 0 0 351.156 3.618 20 5 FHBDRN CN(CCCCNC(=O)c1cc(Cl)ccc1[N+](=O)[O-])c1ccccc1 ZINC000065819455 939891762 /nfs/dbraw/zinc/89/17/62/939891762.db2.gz WOFDOHDKGIEUKH-UHFFFAOYSA-N 0 0 361.829 3.895 20 5 FHBDRN Cc1c(C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)oc2c1C(=O)CCC2 ZINC000179619277 939895872 /nfs/dbraw/zinc/89/58/72/939895872.db2.gz PFILQFYZZCWYEE-UHFFFAOYSA-N 0 0 368.389 3.820 20 5 FHBDRN O=C(Nc1ccnn1-c1ccc([N+](=O)[O-])cc1)[C@@H]1C[C@]1(F)c1ccccc1 ZINC001125792075 939899159 /nfs/dbraw/zinc/89/91/59/939899159.db2.gz YJEBUXKCAVXHJY-LPHOPBHVSA-N 0 0 366.352 3.604 20 5 FHBDRN O=C(c1ccc(Cl)cc1[N+](=O)[O-])N1CC=C(c2cncc(F)c2)CC1 ZINC000364032125 939900285 /nfs/dbraw/zinc/90/02/85/939900285.db2.gz HSOJVLQVSKQAGD-UHFFFAOYSA-N 0 0 361.760 3.712 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N(Cc1c(F)cccc1F)C1CC1 ZINC000427336938 945280264 /nfs/dbraw/zinc/28/02/64/945280264.db2.gz KMOSCSYMSWONHP-UHFFFAOYSA-N 0 0 362.332 3.686 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NCCc1cccc(OC)c1 ZINC000136238129 939903409 /nfs/dbraw/zinc/90/34/09/939903409.db2.gz XGAZIGVMDGHLNV-UHFFFAOYSA-N 0 0 360.435 3.688 20 5 FHBDRN COc1c(O)ccc(CN[C@H]2CCSc3ccc(F)cc32)c1[N+](=O)[O-] ZINC000892474736 939912223 /nfs/dbraw/zinc/91/22/23/939912223.db2.gz AFEZXCGBHWSVEM-ZDUSSCGKSA-N 0 0 364.398 3.775 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(NCc2cc(Br)cs2)c1 ZINC000136297941 939914952 /nfs/dbraw/zinc/91/49/52/939914952.db2.gz GUIRANWVKBKDFQ-UHFFFAOYSA-N 0 0 371.212 3.818 20 5 FHBDRN Cn1cc([N+](=O)[O-])cc1C(=O)Nc1cccc(Cl)c1Br ZINC000236081455 939916538 /nfs/dbraw/zinc/91/65/38/939916538.db2.gz ABKRSEPHKJXRDB-UHFFFAOYSA-N 0 0 358.579 3.602 20 5 FHBDRN COc1ccc(NC(=O)c2csc(Br)c2)cc1[N+](=O)[O-] ZINC000136331520 939922526 /nfs/dbraw/zinc/92/25/26/939922526.db2.gz RKCTXLGXZZPBQT-UHFFFAOYSA-N 0 0 357.185 3.680 20 5 FHBDRN CCOc1cc(NC(=O)N2CC[C@H]3CCC[C@@H]32)c([N+](=O)[O-])cc1OCC ZINC000614678835 939924182 /nfs/dbraw/zinc/92/41/82/939924182.db2.gz OZJSKCSJCFBRLE-OCCSQVGLSA-N 0 0 363.414 3.799 20 5 FHBDRN C[C@@H](C(=O)NCc1cccc([N+](=O)[O-])c1)c1ccc(Br)cc1 ZINC000179787480 939934904 /nfs/dbraw/zinc/93/49/04/939934904.db2.gz LRHRZLZRUFGQPV-LLVKDONJSA-N 0 0 363.211 3.777 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NC1CCN(c2cccs2)CC1 ZINC000179785508 939935445 /nfs/dbraw/zinc/93/54/45/939935445.db2.gz ILPKCGHRXBFNJD-UHFFFAOYSA-N 0 0 373.478 3.980 20 5 FHBDRN O=C(N[C@@H](c1cccnc1)C1CC1)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000410627171 939939532 /nfs/dbraw/zinc/93/95/32/939939532.db2.gz TUINZKBTHVEJDN-OAHLLOKOSA-N 0 0 365.311 3.890 20 5 FHBDRN COc1ccc(NC(=O)CCCOc2ccc(C(C)=O)cc2)cc1[N+](=O)[O-] ZINC000543858004 939943533 /nfs/dbraw/zinc/94/35/33/939943533.db2.gz JUFVKLOBRAVKJO-UHFFFAOYSA-N 0 0 372.377 3.604 20 5 FHBDRN CCc1c(C(=O)Nc2ccc([N+](=O)[O-])c3ncccc23)cnn1C(C)(C)C ZINC000410705504 939947766 /nfs/dbraw/zinc/94/77/66/939947766.db2.gz PQQXQEBIDQPMMW-UHFFFAOYSA-N 0 0 367.409 3.909 20 5 FHBDRN COc1cccc(CNC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)c1OC ZINC000438958973 945284002 /nfs/dbraw/zinc/28/40/02/945284002.db2.gz MZPQTIJMOGGNRH-UHFFFAOYSA-N 0 0 358.394 3.665 20 5 FHBDRN CCc1ccc(-c2noc([C@@H](C)NC(=O)c3csc([N+](=O)[O-])c3)n2)cc1 ZINC000472409337 939953991 /nfs/dbraw/zinc/95/39/91/939953991.db2.gz YCNQNCVNUKZSHB-SNVBAGLBSA-N 0 0 372.406 3.760 20 5 FHBDRN COc1ccccc1COC1CCN(c2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000091980482 939956847 /nfs/dbraw/zinc/95/68/47/939956847.db2.gz HLVCYWFMPLFOHT-UHFFFAOYSA-N 0 0 360.385 3.928 20 5 FHBDRN COc1cc(NC2CCC(C(=O)OC(C)(C)C)CC2)ccc1[N+](=O)[O-] ZINC000091982882 939957214 /nfs/dbraw/zinc/95/72/14/939957214.db2.gz DYHLKCKCOKMLGO-UHFFFAOYSA-N 0 0 350.415 3.916 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)OCCc1ccccc1 ZINC000410816387 939961646 /nfs/dbraw/zinc/96/16/46/939961646.db2.gz GGHXGQLYHADCCE-CQSZACIVSA-N 0 0 358.394 3.580 20 5 FHBDRN COCC[C@@H](NC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-])C(C)(C)C ZINC000410841802 939964963 /nfs/dbraw/zinc/96/49/63/939964963.db2.gz IVQQFPZAUBGYOT-CYBMUJFWSA-N 0 0 362.348 3.795 20 5 FHBDRN O=C(Nc1ccc(-n2cccn2)c(Cl)c1)c1cc(F)cc([N+](=O)[O-])c1 ZINC000518283713 945290505 /nfs/dbraw/zinc/29/05/05/945290505.db2.gz LWEPFGPFBDARSL-UHFFFAOYSA-N 0 0 360.732 3.825 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1CCC(=O)N(C)[C@@H]1c1cccs1 ZINC000364619409 939972146 /nfs/dbraw/zinc/97/21/46/939972146.db2.gz CJILENPUOAABDP-DYVFJYSZSA-N 0 0 373.434 3.513 20 5 FHBDRN COc1cc(C(=O)N[C@@H]2C[C@H]2c2ccc(Cl)c(F)c2)ccc1[N+](=O)[O-] ZINC000437360256 945286483 /nfs/dbraw/zinc/28/64/83/945286483.db2.gz SVYDVUNAIOJTBM-SMDDNHRTSA-N 0 0 364.760 3.682 20 5 FHBDRN Cc1cccc(CNC(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)n1 ZINC000516402403 939983329 /nfs/dbraw/zinc/98/33/29/939983329.db2.gz XCMKUYKELUKDFK-UHFFFAOYSA-N 0 0 362.389 3.972 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])Nc1cccc(OCC(F)(F)F)c1 ZINC000065866584 939984659 /nfs/dbraw/zinc/98/46/59/939984659.db2.gz SCYKAZHQVWWLAV-UHFFFAOYSA-N 0 0 369.299 3.587 20 5 FHBDRN CCC[C@H](NC(=O)c1cc(OC)c(OCC)cc1[N+](=O)[O-])C(C)(C)C ZINC000411034280 939985914 /nfs/dbraw/zinc/98/59/14/939985914.db2.gz LLSOBOICJMMRAQ-INIZCTEOSA-N 0 0 352.431 3.947 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N1CC(C)(C)[C@H]1c1nccn1C ZINC000411018563 939986512 /nfs/dbraw/zinc/98/65/12/939986512.db2.gz LIKNDQHCPHMTMZ-CQSZACIVSA-N 0 0 362.817 3.513 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])NCc1ccc(Cl)cc1Cl ZINC000065857533 939989341 /nfs/dbraw/zinc/98/93/41/939989341.db2.gz HNTKBSHCFVWWJF-UHFFFAOYSA-N 0 0 354.193 3.630 20 5 FHBDRN COc1cc(N2CC[C@H](n3ncc4ccccc43)C2)c([N+](=O)[O-])cc1F ZINC000511339482 939991508 /nfs/dbraw/zinc/99/15/08/939991508.db2.gz AAVHTNUZPPYWDH-ZDUSSCGKSA-N 0 0 356.357 3.544 20 5 FHBDRN COc1ccc2c(c1)CC[C@H](NC(=O)Nc1c(C)ccc([N+](=O)[O-])c1C)C2 ZINC000612313874 939991714 /nfs/dbraw/zinc/99/17/14/939991714.db2.gz AOUGEKXMNQKVHH-INIZCTEOSA-N 0 0 369.421 3.899 20 5 FHBDRN CCC1(O)CCC(NC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000612315289 939992373 /nfs/dbraw/zinc/99/23/73/939992373.db2.gz JPEATWIEXQXVOC-UHFFFAOYSA-N 0 0 372.874 3.540 20 5 FHBDRN Cc1ccncc1[C@@H](C)NC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000612314929 939992779 /nfs/dbraw/zinc/99/27/79/939992779.db2.gz MODQEUNLRCQCRB-LLVKDONJSA-N 0 0 365.842 3.921 20 5 FHBDRN CCCCc1cnc(NC(=O)[C@@H](CC)Cc2ccc([N+](=O)[O-])cc2)nc1 ZINC000411080727 939994544 /nfs/dbraw/zinc/99/45/44/939994544.db2.gz SRGCMWFJPYRJOM-INIZCTEOSA-N 0 0 356.426 3.935 20 5 FHBDRN Cc1cc(OCC(=O)N[C@@H]2C[C@H]2c2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000437362698 945288493 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370.405 3.620 20 5 FHBDRN C[C@@H]1[C@@H](CO)CCCN1C(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 ZINC000414067371 940475141 /nfs/dbraw/zinc/47/51/41/940475141.db2.gz KYFUSKSJNMFSMH-HUUCEWRRSA-N 0 0 370.405 3.620 20 5 FHBDRN CC[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1OC)c1cc(F)ccc1F ZINC000427395717 945323892 /nfs/dbraw/zinc/32/38/92/945323892.db2.gz ALHIDZGMTQXHAQ-OAHLLOKOSA-N 0 0 350.321 3.763 20 5 FHBDRN O=C(c1cccc2ccc(=O)[nH]c21)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000580478230 940476407 /nfs/dbraw/zinc/47/64/07/940476407.db2.gz UWPMOHQBEBVOMI-UHFFFAOYSA-N 0 0 363.373 3.653 20 5 FHBDRN Cc1nc(C)c([C@@H](C)N(C)C(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)s1 ZINC000580491793 940476846 /nfs/dbraw/zinc/47/68/46/940476846.db2.gz UOBCWLWCAXYHOU-SECBINFHSA-N 0 0 369.393 3.708 20 5 FHBDRN C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)N[C@H]3CCC[C@H]3F)cc2[N+](=O)[O-])C1 ZINC000580595463 940481901 /nfs/dbraw/zinc/48/19/01/940481901.db2.gz ICMXDZJDAQVHOW-CLWVCHIJSA-N 0 0 363.433 3.698 20 5 FHBDRN 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ZINC000581256467 940497752 /nfs/dbraw/zinc/49/77/52/940497752.db2.gz AWMBLPRIWJSHQJ-GOEBONIOSA-N 0 0 369.421 3.857 20 5 FHBDRN C[C@H](CCOCc1ccccc1)NC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000581327968 940499255 /nfs/dbraw/zinc/49/92/55/940499255.db2.gz BBZIPYSKFGYGEU-CVEARBPZSA-N 0 0 356.422 3.810 20 5 FHBDRN O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)N[C@@H](C1CCCC1)C(F)(F)F ZINC000581332995 940499509 /nfs/dbraw/zinc/49/95/09/940499509.db2.gz KSUCUDJWTAUMHR-AWEZNQCLSA-N 0 0 366.286 3.653 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(-c2nc(-c3ccc(F)c(OC)c3)no2)c1 ZINC000581573360 940506785 /nfs/dbraw/zinc/50/67/85/940506785.db2.gz RLZGBHLNEJVVJN-UHFFFAOYSA-N 0 0 359.313 3.858 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2nnc(N3CCc4sccc4C3)n2C2CC2)c1 ZINC000581613961 940510234 /nfs/dbraw/zinc/51/02/34/940510234.db2.gz FWAYHFKYCJRAMC-UHFFFAOYSA-N 0 0 367.434 3.812 20 5 FHBDRN CCS[C@H](C)c1noc(CN(C)Cc2cc(F)ccc2[N+](=O)[O-])n1 ZINC000178036585 940598901 /nfs/dbraw/zinc/59/89/01/940598901.db2.gz FDNYGQUFLNJBEU-SNVBAGLBSA-N 0 0 354.407 3.563 20 5 FHBDRN Cc1ccc(S(=O)(=O)N(CC(F)F)c2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000613328549 940600304 /nfs/dbraw/zinc/60/03/04/940600304.db2.gz GJIOHZMWVHACMO-UHFFFAOYSA-N 0 0 370.377 3.672 20 5 FHBDRN CC(C)c1nnc(COc2cc(F)c(Br)cc2[N+](=O)[O-])o1 ZINC000188637341 940607162 /nfs/dbraw/zinc/60/71/62/940607162.db2.gz JCUOGLFDGGKIGP-UHFFFAOYSA-N 0 0 360.139 3.582 20 5 FHBDRN COc1ccc(CNC(=O)NC[C@@H](c2ccccc2)C2CC2)cc1[N+](=O)[O-] ZINC000431806408 940620915 /nfs/dbraw/zinc/62/09/15/940620915.db2.gz BFLKCQFYIDVOEZ-KRWDZBQOSA-N 0 0 369.421 3.596 20 5 FHBDRN Cc1noc(C)c1[C@H](C)CNC(=O)c1c([N+](=O)[O-])cccc1C(F)(F)F ZINC000581851992 940627081 /nfs/dbraw/zinc/62/70/81/940627081.db2.gz NFDQCXIFPSIVDO-MRVPVSSYSA-N 0 0 371.315 3.752 20 5 FHBDRN CC[C@@H](c1cccc(OC)c1)N(C)C(=O)c1ccc(OC)c([N+](=O)[O-])c1 ZINC000581964417 940635369 /nfs/dbraw/zinc/63/53/69/940635369.db2.gz KWTOKQQDBFUFNZ-INIZCTEOSA-N 0 0 358.394 3.835 20 5 FHBDRN CCOC(=O)c1ccc(F)c(C)c1NC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000581980863 940637626 /nfs/dbraw/zinc/63/76/26/940637626.db2.gz FJFLJBSJNPVGPO-NSHDSACASA-N 0 0 374.368 3.961 20 5 FHBDRN CCOc1ccc2c(c1)CCN(C(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1)C2 ZINC000582156317 940651461 /nfs/dbraw/zinc/65/14/61/940651461.db2.gz OBMVMVVHAMKKJP-AWEZNQCLSA-N 0 0 354.406 3.682 20 5 FHBDRN COc1ccc2c(c1)N(C(=O)[C@H](C)c1cccc([N+](=O)[O-])c1)C[C@H](C)O2 ZINC000582278417 940663318 /nfs/dbraw/zinc/66/33/18/940663318.db2.gz KACLWRVJLCPLKT-QWHCGFSZSA-N 0 0 356.378 3.521 20 5 FHBDRN Cc1cc(NC(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)nn1-c1ccc(C)cc1 ZINC000582463772 940667337 /nfs/dbraw/zinc/66/73/37/940667337.db2.gz VVUAGXRRJJQSBO-HNNXBMFYSA-N 0 0 364.405 3.561 20 5 FHBDRN CC(C)COC[C@@H](O)CNc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000582416310 940670309 /nfs/dbraw/zinc/67/03/09/940670309.db2.gz IBVSAJVUGKCGNR-KRWDZBQOSA-N 0 0 360.410 3.833 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CCCCc3c(OC)cccc32)c1 ZINC000582427378 940670838 /nfs/dbraw/zinc/67/08/38/940670838.db2.gz PKOOGSDMFZNHEA-UHFFFAOYSA-N 0 0 370.405 3.985 20 5 FHBDRN CCOc1cc(OCC[C@H]2Sc3ccccc3NC2=O)ccc1[N+](=O)[O-] ZINC000582498908 940675569 /nfs/dbraw/zinc/67/55/69/940675569.db2.gz ZXUAJCBKFQLRJY-QGZVFWFLSA-N 0 0 374.418 3.875 20 5 FHBDRN CCS[C@H]1CCC[C@@H]1NC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C ZINC000178127339 940695924 /nfs/dbraw/zinc/69/59/24/940695924.db2.gz XGPNCVBTNSJUOV-JSGCOSHPSA-N 0 0 367.427 3.524 20 5 FHBDRN CCOC(=O)c1ccc(C(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000582517879 940699142 /nfs/dbraw/zinc/69/91/42/940699142.db2.gz DGNOGBIZUIXWBO-UHFFFAOYSA-N 0 0 368.389 3.576 20 5 FHBDRN Cc1nc(CS(=O)(=O)[C@H](C)c2cc([N+](=O)[O-])ccc2C)sc1C ZINC000180149726 940699337 /nfs/dbraw/zinc/69/93/37/940699337.db2.gz MFFHWZBKKWIOSN-GFCCVEGCSA-N 0 0 354.453 3.653 20 5 FHBDRN C[C@H](CNC(=O)Cc1ccc([N+](=O)[O-])cc1Cl)c1ccc(F)cc1F ZINC000174340100 940723962 /nfs/dbraw/zinc/72/39/62/940723962.db2.gz FOWXYOPHZVERAH-SNVBAGLBSA-N 0 0 368.767 3.989 20 5 FHBDRN Cc1ccc([C@@H](C)N[C@H]2c3sccc3OC(C)(C)[C@@H]2O)cc1[N+](=O)[O-] ZINC000414184983 940726818 /nfs/dbraw/zinc/72/68/18/940726818.db2.gz PARBAFIMTNFXLV-XQAQDONZSA-N 0 0 362.451 3.889 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N1CC[C@@](F)(c2ccccc2F)C1 ZINC000549025772 940737417 /nfs/dbraw/zinc/73/74/17/940737417.db2.gz PZCYDQAAUJKOLK-IBGZPJMESA-N 0 0 360.360 3.764 20 5 FHBDRN COC(=O)c1cccc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)c1O ZINC000066635918 940749668 /nfs/dbraw/zinc/74/96/68/940749668.db2.gz QIRSRKIQEMOQLK-UHFFFAOYSA-N 0 0 372.358 3.554 20 5 FHBDRN O=C1CCc2cc([N+](=O)[O-])c(Oc3c(F)c(F)cc(F)c3F)cc2N1 ZINC000170639256 940755070 /nfs/dbraw/zinc/75/50/70/940755070.db2.gz SDAHINMZJGZYSP-UHFFFAOYSA-N 0 0 356.231 3.828 20 5 FHBDRN Cn1c(=O)oc2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc21 ZINC000170659052 940768344 /nfs/dbraw/zinc/76/83/44/940768344.db2.gz OLQTUJJGYWKARG-UHFFFAOYSA-N 0 0 369.358 3.507 20 5 FHBDRN C[C@H](NC(=O)N[C@@H](c1ccccc1)[C@@H]1CCCO1)c1cccc([N+](=O)[O-])c1 ZINC000170684107 940779959 /nfs/dbraw/zinc/77/99/59/940779959.db2.gz GWPLZNDGLHMDHS-JVPBZIDWSA-N 0 0 369.421 3.875 20 5 FHBDRN C[C@H](NC(=O)N[C@H](c1ccccc1)[C@@H]1CCCO1)c1cccc([N+](=O)[O-])c1 ZINC000170684112 940780128 /nfs/dbraw/zinc/78/01/28/940780128.db2.gz GWPLZNDGLHMDHS-ZOCIIQOWSA-N 0 0 369.421 3.875 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)NCc1ccc(OCCOC)cc1 ZINC000582636349 940780508 /nfs/dbraw/zinc/78/05/08/940780508.db2.gz JIDSBBLHMBWUJC-UHFFFAOYSA-N 0 0 373.409 3.504 20 5 FHBDRN O=[N+]([O-])c1cccc(Cc2nc(-c3ccc(N4CCCCC4)nc3)no2)c1 ZINC000174835291 940783669 /nfs/dbraw/zinc/78/36/69/940783669.db2.gz BDKYVIASGBKWOP-UHFFFAOYSA-N 0 0 365.393 3.621 20 5 FHBDRN COCCOC(=O)Nc1cccc(N[C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000180187463 940786907 /nfs/dbraw/zinc/78/69/07/940786907.db2.gz DUKCIMYPYIIYDU-CYBMUJFWSA-N 0 0 359.382 3.963 20 5 FHBDRN O=C(N[C@H]1CCc2ccc(F)cc21)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000540918728 940790970 /nfs/dbraw/zinc/79/09/70/940790970.db2.gz OXWRSYKSVLYUBC-AWEZNQCLSA-N 0 0 366.295 3.753 20 5 FHBDRN C[C@@H](CC(=O)Nc1ccnn1-c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000609453391 940802062 /nfs/dbraw/zinc/80/20/62/940802062.db2.gz FZXPCOOTXKRMCP-AWEZNQCLSA-N 0 0 350.378 3.913 20 5 FHBDRN C[C@@H](NC(=O)c1ccc(N2CCCC2)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000106624811 945351019 /nfs/dbraw/zinc/35/10/19/945351019.db2.gz HLWTZNMKYKRBIC-CYBMUJFWSA-N 0 0 357.385 3.825 20 5 FHBDRN Cc1ccc(S[C@@H](C)C(=O)NCCOc2ccc([N+](=O)[O-])cc2)cc1 ZINC000609455147 940830757 /nfs/dbraw/zinc/83/07/57/940830757.db2.gz NAXYLEZYYVNZFV-AWEZNQCLSA-N 0 0 360.435 3.579 20 5 FHBDRN O=C(Nc1ccc2cc([N+](=O)[O-])ccc2n1)c1ncccc1C(F)(F)F ZINC000180225170 940842592 /nfs/dbraw/zinc/84/25/92/940842592.db2.gz NVMHGHNIVUFBKD-UHFFFAOYSA-N 0 0 362.267 3.809 20 5 FHBDRN O=C(N[C@@H]1CCO[C@@H]1c1ccc(Cl)c(F)c1)c1ccccc1[N+](=O)[O-] ZINC000180241883 940853205 /nfs/dbraw/zinc/85/32/05/940853205.db2.gz RZNMNMAIURXJRL-GDBMZVCRSA-N 0 0 364.760 3.647 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N[C@H](Cc2ccc(F)cc2)C(C)C)c1 ZINC000175423256 940862623 /nfs/dbraw/zinc/86/26/23/940862623.db2.gz FWTIDEPDSWFUHB-QGZVFWFLSA-N 0 0 360.385 3.740 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N2C[C@H](C)OC[C@@H]2c2ccccc2)c1 ZINC000175433622 940869320 /nfs/dbraw/zinc/86/93/20/940869320.db2.gz RXSBOYGWPABEHK-SCLBCKFNSA-N 0 0 372.446 3.919 20 5 FHBDRN C[C@@H]1Cc2ccccc2N1C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000175492827 940871417 /nfs/dbraw/zinc/87/14/17/940871417.db2.gz GSBGUFBBAJINEU-SNVBAGLBSA-N 0 0 361.195 3.949 20 5 FHBDRN Cc1cc(F)ccc1[C@@H]1CCCN1S(=O)(=O)c1ccc([N+](=O)[O-])s1 ZINC000452039325 940881144 /nfs/dbraw/zinc/88/11/44/940881144.db2.gz GPOULSMWRIGIJM-ZDUSSCGKSA-N 0 0 370.427 3.630 20 5 FHBDRN Cc1cn2c(nc(C)c2-c2noc(Cc3cccc([N+](=O)[O-])c3C)n2)s1 ZINC000426619698 945359704 /nfs/dbraw/zinc/35/97/04/945359704.db2.gz LZNHUFMVMNHCNC-UHFFFAOYSA-N 0 0 369.406 3.870 20 5 FHBDRN Cc1ccc(-c2cnc(CCC(=O)Nc3ccc([N+](=O)[O-])c(C)n3)o2)cc1 ZINC000175675229 940907302 /nfs/dbraw/zinc/90/73/02/940907302.db2.gz BBFXNDHMUIFIMZ-UHFFFAOYSA-N 0 0 366.377 3.833 20 5 FHBDRN COc1cc(C(=O)N2CC[C@@H](c3ccccc3)[C@@H]2C)c([N+](=O)[O-])cc1OC ZINC000175699112 940914346 /nfs/dbraw/zinc/91/43/46/940914346.db2.gz JKVZXVFALDEFLX-DZGCQCFKSA-N 0 0 370.405 3.630 20 5 FHBDRN CCOc1ccc(NC(=O)CSc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000613526689 940916988 /nfs/dbraw/zinc/91/69/88/940916988.db2.gz KSYLGWOMORJNRB-UHFFFAOYSA-N 0 0 350.371 3.863 20 5 FHBDRN O=c1[nH]c(N2CCS[C@H](c3ccccc3)C2)nc2ccc([N+](=O)[O-])cc12 ZINC000376405373 940931650 /nfs/dbraw/zinc/93/16/50/940931650.db2.gz FAVLBRPUWBSMIK-INIZCTEOSA-N 0 0 368.418 3.538 20 5 FHBDRN O=C(c1cccs1)C1CCN(c2ncnc3sc([N+](=O)[O-])cc32)CC1 ZINC000376409833 940938152 /nfs/dbraw/zinc/93/81/52/940938152.db2.gz UTIPLBMTAUPCKA-UHFFFAOYSA-N 0 0 374.447 3.760 20 5 FHBDRN CC1(C)C[C@H](Nc2cccc(O[C@@H]3CC(=O)N3)c2)c2cc([N+](=O)[O-])ccc21 ZINC000414318039 940958491 /nfs/dbraw/zinc/95/84/91/940958491.db2.gz LIMNBUBAQOIJIT-PKOBYXMFSA-N 0 0 367.405 3.654 20 5 FHBDRN O=C(N[C@@H]1C[C@H]2OCCC[C@H]12)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 ZINC000188691741 940970771 /nfs/dbraw/zinc/97/07/71/940970771.db2.gz YTGNOGSBACGEHA-SZVBFZGTSA-N 0 0 368.389 3.684 20 5 FHBDRN O=C(c1ncccc1C(F)(F)F)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000180325427 940972802 /nfs/dbraw/zinc/97/28/02/940972802.db2.gz AKZVLYWMKOBVDF-UHFFFAOYSA-N 0 0 365.311 3.813 20 5 FHBDRN C[C@H](NCC(=O)N(C)c1nc2ccccc2s1)c1cccc([N+](=O)[O-])c1 ZINC000180399182 941004216 /nfs/dbraw/zinc/00/42/16/941004216.db2.gz DDDMFHZRXWIIMD-LBPRGKRZSA-N 0 0 370.434 3.518 20 5 FHBDRN COc1cc(-c2noc(CN[C@@H](C)c3cccc([N+](=O)[O-])c3)n2)ccc1C ZINC000180418737 941008072 /nfs/dbraw/zinc/00/80/72/941008072.db2.gz VILODSWEVZSXJE-ZDUSSCGKSA-N 0 0 368.393 3.813 20 5 FHBDRN Cc1cc(C(=O)N2CC[C@@H](OCCCc3ccccc3)C2)cc([N+](=O)[O-])c1 ZINC000176335253 941020096 /nfs/dbraw/zinc/02/00/96/941020096.db2.gz ICSWVGWGJQMKGB-HXUWFJFHSA-N 0 0 368.433 3.767 20 5 FHBDRN O=[N+]([O-])c1cccc(OCCN(Cc2ccco2)Cc2cccnc2)c1 ZINC000180465748 941023971 /nfs/dbraw/zinc/02/39/71/941023971.db2.gz CUGDKMBJCVJKBL-UHFFFAOYSA-N 0 0 353.378 3.664 20 5 FHBDRN Cc1cc(C)n([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)n1 ZINC000180468104 941024041 /nfs/dbraw/zinc/02/40/41/941024041.db2.gz FQUKQPBCNQRBNR-JTQLQIEISA-N 0 0 356.304 3.627 20 5 FHBDRN CCOc1cccc(CNC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)c1 ZINC000180528886 941037519 /nfs/dbraw/zinc/03/75/19/941037519.db2.gz ZXRMAQZNTREHEQ-UHFFFAOYSA-N 0 0 366.320 3.525 20 5 FHBDRN CS[C@H]1CCC[C@H](NC(=O)c2cccc([N+](=O)[O-])c2Br)C1 ZINC000180568147 941044027 /nfs/dbraw/zinc/04/40/27/941044027.db2.gz KGZLOQNLIJSQBE-UWVGGRQHSA-N 0 0 373.272 3.761 20 5 FHBDRN CC(=O)c1cc([N+](=O)[O-])ccc1N1CCC(O)(Cc2ccccc2F)CC1 ZINC000376460041 941049297 /nfs/dbraw/zinc/04/92/97/941049297.db2.gz HRFNJFHIPLTUTI-UHFFFAOYSA-N 0 0 372.396 3.511 20 5 FHBDRN CC(C)(NC(=O)Cc1csc(-c2ccoc2)n1)c1ccc([N+](=O)[O-])cc1 ZINC000176503846 941053546 /nfs/dbraw/zinc/05/35/46/941053546.db2.gz ZHQXAFOJWCFSOA-UHFFFAOYSA-N 0 0 371.418 3.905 20 5 FHBDRN Cc1nn(CCC(=O)N[C@@H](CC2CCC2)c2ccccc2)c(C)c1[N+](=O)[O-] ZINC000180649381 941058185 /nfs/dbraw/zinc/05/81/85/941058185.db2.gz LWQHJSMZZILTCR-SFHVURJKSA-N 0 0 370.453 3.846 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1N1CCC(c2cnccn2)CC1 ZINC000376476905 941066883 /nfs/dbraw/zinc/06/68/83/941066883.db2.gz AVAYJRLUJPPZTE-UHFFFAOYSA-N 0 0 363.215 3.531 20 5 FHBDRN CC(=O)c1cc(N2CCC(O)(Cc3cccc(F)c3)CC2)ccc1[N+](=O)[O-] ZINC000376482015 941070791 /nfs/dbraw/zinc/07/07/91/941070791.db2.gz ZJHLOFTZIZAFSC-UHFFFAOYSA-N 0 0 372.396 3.511 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCC(c3cnccn3)CC2)c(Br)c1 ZINC000376480988 941071914 /nfs/dbraw/zinc/07/19/14/941071914.db2.gz UEBDJPAFEZOGPU-UHFFFAOYSA-N 0 0 363.215 3.531 20 5 FHBDRN CN(C(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)C1CCC(C)(C)CC1 ZINC000176726060 941073951 /nfs/dbraw/zinc/07/39/51/941073951.db2.gz VZSIXRFNKOPNAO-UHFFFAOYSA-N 0 0 356.426 3.821 20 5 FHBDRN CCC(CC)[C@H]1C[C@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)CCO1 ZINC000180823076 941081274 /nfs/dbraw/zinc/08/12/74/941081274.db2.gz QJYFZTKCMUAVOE-RHSMWYFYSA-N 0 0 368.861 3.891 20 5 FHBDRN CCC(CC)[C@@H]1C[C@@H](NC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])CCO1 ZINC000180843892 941083330 /nfs/dbraw/zinc/08/33/30/941083330.db2.gz UTITYNYNSSNWSB-ZBEGNZNMSA-N 0 0 356.369 3.587 20 5 FHBDRN Cc1occc1-c1nnc(SCc2nc3cc([N+](=O)[O-])ccc3o2)n1C ZINC000176932491 941085646 /nfs/dbraw/zinc/08/56/46/941085646.db2.gz TVGGESPGPVUDEU-UHFFFAOYSA-N 0 0 371.378 3.725 20 5 FHBDRN Cc1cc(CCNC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cc(C)c1O ZINC000188802153 941090751 /nfs/dbraw/zinc/09/07/51/941090751.db2.gz QLWOSXYSQNHQHH-AWEZNQCLSA-N 0 0 357.410 3.520 20 5 FHBDRN Cc1ccc(C(C)(C)C(=O)OCC(=O)Nc2cc([N+](=O)[O-])ccc2F)cc1 ZINC000728666788 941093305 /nfs/dbraw/zinc/09/33/05/941093305.db2.gz UNDKWMAONCECIE-UHFFFAOYSA-N 0 0 374.368 3.502 20 5 FHBDRN O=[N+]([O-])c1ccc2oc(CN3CCO[C@H](c4ccc(Cl)cc4)C3)nc2c1 ZINC000177016354 941094073 /nfs/dbraw/zinc/09/40/73/941094073.db2.gz HHNBGDWKCQIYPK-KRWDZBQOSA-N 0 0 373.796 3.963 20 5 FHBDRN COc1ccc(COCCNC(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)cc1 ZINC000180970309 941098375 /nfs/dbraw/zinc/09/83/75/941098375.db2.gz UQIJJUSHYQIHTC-UHFFFAOYSA-N 0 0 373.409 3.559 20 5 FHBDRN C[C@H]1CC[C@@]2(CCN(C(=O)c3ccc(N4CCCC4)c([N+](=O)[O-])c3)C2)C1 ZINC000541009855 941101228 /nfs/dbraw/zinc/10/12/28/941101228.db2.gz TZXFVOOSXMTNNV-MGPUTAFESA-N 0 0 357.454 3.847 20 5 FHBDRN CC(C)(C(=O)NC1CCC(c2ccc(F)cc2)CC1)n1cc([N+](=O)[O-])cn1 ZINC000541006778 941101258 /nfs/dbraw/zinc/10/12/58/941101258.db2.gz UTOQSGKPVOGCBQ-UHFFFAOYSA-N 0 0 374.416 3.508 20 5 FHBDRN O=C(Nc1ccc(OCc2cccnc2)cc1)c1cc(F)ccc1[N+](=O)[O-] ZINC000103046593 941108398 /nfs/dbraw/zinc/10/83/98/941108398.db2.gz YDZBEAFQWMVAGS-UHFFFAOYSA-N 0 0 367.336 3.960 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CCO[C@H](c2cccc(F)c2)C1 ZINC000188840448 941109273 /nfs/dbraw/zinc/10/92/73/941109273.db2.gz QJGPJYFBGIFOTF-KRWDZBQOSA-N 0 0 359.357 3.648 20 5 FHBDRN COC[C@H](NC(=O)c1ccc(Cl)cc1[N+](=O)[O-])c1ccc(F)c(F)c1 ZINC000181130858 941110278 /nfs/dbraw/zinc/11/02/78/941110278.db2.gz HICMJZZXMJPJTA-AWEZNQCLSA-N 0 0 370.739 3.644 20 5 FHBDRN CCOc1ccc(C(=O)Nc2cn(-c3ccccc3)nc2C)cc1[N+](=O)[O-] ZINC000181232680 941113373 /nfs/dbraw/zinc/11/33/73/941113373.db2.gz JCCRRZJNPBEYBS-UHFFFAOYSA-N 0 0 366.377 3.740 20 5 FHBDRN CCOC(=O)CC[C@@H]1CCCN(c2ccc([N+](=O)[O-])c(OC(F)F)c2)C1 ZINC000181232846 941113513 /nfs/dbraw/zinc/11/35/13/941113513.db2.gz WDVSEQDLSYFDEY-LBPRGKRZSA-N 0 0 372.368 3.756 20 5 FHBDRN CCOc1cc(C(=O)N[C@@H]2CCC[C@@H](C)CC2)c([N+](=O)[O-])cc1OC ZINC000188850132 941118567 /nfs/dbraw/zinc/11/85/67/941118567.db2.gz ZASPYDWFOYNMJF-CHWSQXEVSA-N 0 0 350.415 3.701 20 5 FHBDRN C[C@@H]1c2nnc(C3CCCC3)n2CCN1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000376534506 941119320 /nfs/dbraw/zinc/11/93/20/941119320.db2.gz USMQKXXRWWTCCX-GFCCVEGCSA-N 0 0 359.405 3.560 20 5 FHBDRN COc1ccc(CS(=O)(=O)Cc2c(C)cccc2Cl)cc1[N+](=O)[O-] ZINC000414419265 941120155 /nfs/dbraw/zinc/12/01/55/941120155.db2.gz SZLGVPQPXIHAKG-UHFFFAOYSA-N 0 0 369.826 3.680 20 5 FHBDRN CSc1cccc(C(=O)N[C@@H](C)CC(=O)c2ccccc2)c1[N+](=O)[O-] ZINC000188971742 941135744 /nfs/dbraw/zinc/13/57/44/941135744.db2.gz SOWRWESTNWIDFC-LBPRGKRZSA-N 0 0 358.419 3.708 20 5 FHBDRN C[C@H](OCC1CC1)C(=O)Nc1ccc(OCc2ccccc2)cc1[N+](=O)[O-] ZINC000188968999 941135805 /nfs/dbraw/zinc/13/58/05/941135805.db2.gz PPKFNPZKBIVNIN-AWEZNQCLSA-N 0 0 370.405 3.927 20 5 FHBDRN CCSc1cc(CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])ccn1 ZINC000189030847 941142417 /nfs/dbraw/zinc/14/24/17/941142417.db2.gz UYBPBENCCPNKLI-UHFFFAOYSA-N 0 0 351.815 3.685 20 5 FHBDRN O=C(c1cc(Cl)ccc1[N+](=O)[O-])N1CCO[C@H](c2ccccc2F)C1 ZINC000066691053 941149874 /nfs/dbraw/zinc/14/98/74/941149874.db2.gz ZNGVNCQKYDHDBM-INIZCTEOSA-N 0 0 364.760 3.601 20 5 FHBDRN C[C@@H]1CCC[C@@H](NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)CC1 ZINC000189247421 941155301 /nfs/dbraw/zinc/15/53/01/941155301.db2.gz OKFPEKDCGDTFML-NVXWUHKLSA-N 0 0 359.470 3.896 20 5 FHBDRN Cc1cnccc1CNC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000189325606 941156329 /nfs/dbraw/zinc/15/63/29/941156329.db2.gz LTLZZXRAEPOELI-UHFFFAOYSA-N 0 0 354.288 3.639 20 5 FHBDRN CCCCOc1ccc(NC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000189279262 941156678 /nfs/dbraw/zinc/15/66/78/941156678.db2.gz CDPCMAFTHXEMNL-UHFFFAOYSA-N 0 0 371.393 3.659 20 5 FHBDRN Cc1cn(-c2c(F)cccc2F)nc1C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000189455882 941158293 /nfs/dbraw/zinc/15/82/93/941158293.db2.gz VIKHCPHJZMQRGZ-UHFFFAOYSA-N 0 0 358.304 3.619 20 5 FHBDRN COc1cc(C(=O)N2CCC[C@H]2c2cccc(C)n2)cc([N+](=O)[O-])c1C ZINC000189502286 941159363 /nfs/dbraw/zinc/15/93/63/941159363.db2.gz AAUWRMSCRDEZEN-INIZCTEOSA-N 0 0 355.394 3.593 20 5 FHBDRN COC[C@H](Cc1ccccc1)N(C)C(=O)c1cccc(SC)c1[N+](=O)[O-] ZINC000189516953 941159502 /nfs/dbraw/zinc/15/95/02/941159502.db2.gz CBZDCNVRVRNFLS-HNNXBMFYSA-N 0 0 374.462 3.646 20 5 FHBDRN CCN(Cc1c[nH]c2ccccc12)C(=O)CNc1ccccc1[N+](=O)[O-] ZINC000189571121 941161276 /nfs/dbraw/zinc/16/12/76/941161276.db2.gz JWQNYJIJQALIQF-UHFFFAOYSA-N 0 0 352.394 3.537 20 5 FHBDRN CCC[C@H](NC(=O)C(=O)Nc1cc(F)cc([N+](=O)[O-])c1)C1CCCCC1 ZINC000472624299 941161345 /nfs/dbraw/zinc/16/13/45/941161345.db2.gz POPKXMNQVJCPRG-INIZCTEOSA-N 0 0 365.405 3.538 20 5 FHBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)N1C[C@@H]2CCCC[C@H]2C1 ZINC000178311295 941222805 /nfs/dbraw/zinc/22/28/05/941222805.db2.gz QDXXOPDIRSXQOF-IRXDYDNUSA-N 0 0 360.457 3.803 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCCCC[C@@H]1c1ncon1 ZINC000189635474 941235667 /nfs/dbraw/zinc/23/56/67/941235667.db2.gz YGQKQNSDIYNVHC-DOTOQJQBSA-N 0 0 372.425 3.690 20 5 FHBDRN CC(=O)c1ccc(NC[C@@](C)(Cc2ccccc2)[C@H](C)O)c([N+](=O)[O-])c1 ZINC000189652598 941242415 /nfs/dbraw/zinc/24/24/15/941242415.db2.gz ZBPYITLDYDFSJN-MGPUTAFESA-N 0 0 356.422 3.839 20 5 FHBDRN O=C(NCCc1ccc(Cl)s1)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000122222829 941250328 /nfs/dbraw/zinc/25/03/28/941250328.db2.gz IXGZUNMKGNPSMB-UHFFFAOYSA-N 0 0 365.842 3.620 20 5 FHBDRN Cc1c(CC(=O)NCc2ccc(OC(F)(F)F)cc2)cccc1[N+](=O)[O-] ZINC000178564860 941277238 /nfs/dbraw/zinc/27/72/38/941277238.db2.gz ILMRMQAGPYBCBD-UHFFFAOYSA-N 0 0 368.311 3.661 20 5 FHBDRN Cc1cn(-c2c(F)cccc2F)nc1C(=O)Nc1ccc([N+](=O)[O-])c(C)c1 ZINC000189806668 941279449 /nfs/dbraw/zinc/27/94/49/941279449.db2.gz FITHRISQGADLCF-UHFFFAOYSA-N 0 0 372.331 3.928 20 5 FHBDRN Cc1c(CC(=O)Nc2cccc(OC[C@H]3CCCO3)c2)cccc1[N+](=O)[O-] ZINC000178576835 941279845 /nfs/dbraw/zinc/27/98/45/941279845.db2.gz YHHILKUYENYOKF-GOSISDBHSA-N 0 0 370.405 3.642 20 5 FHBDRN Cc1ccc(-n2cccn2)cc1NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000189823702 941283870 /nfs/dbraw/zinc/28/38/70/941283870.db2.gz PJBPALSUPWCKSM-UHFFFAOYSA-N 0 0 370.796 3.924 20 5 FHBDRN COC[C@@H](Cc1ccccc1)N(C)C(=O)Nc1ccc([N+](=O)[O-])c(C)c1 ZINC000189858108 941290122 /nfs/dbraw/zinc/29/01/22/941290122.db2.gz YUQZBUAFEULJRI-QGZVFWFLSA-N 0 0 357.410 3.625 20 5 FHBDRN CCN(Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@H](O)C(F)(F)F ZINC000189876771 941292852 /nfs/dbraw/zinc/29/28/52/941292852.db2.gz XRVRGIOKRUAMPS-HNNXBMFYSA-N 0 0 358.316 3.600 20 5 FHBDRN CCN(Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C[C@@H](O)C(F)(F)F ZINC000189874868 941293060 /nfs/dbraw/zinc/29/30/60/941293060.db2.gz FSXMICDXFGEQHV-OAHLLOKOSA-N 0 0 358.316 3.600 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)NCCc1cc2ccccc2o1 ZINC000549109033 941303667 /nfs/dbraw/zinc/30/36/67/941303667.db2.gz MMHMQOFQWKGNBH-UHFFFAOYSA-N 0 0 367.405 3.768 20 5 FHBDRN Cc1ccc(NC(=O)c2ccc(Br)cc2[N+](=O)[O-])c(C)c1O ZINC000178798220 941305985 /nfs/dbraw/zinc/30/59/85/941305985.db2.gz GUWMELYPKKDNAA-UHFFFAOYSA-N 0 0 365.183 3.932 20 5 FHBDRN Cc1ccc(C(=O)O[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1Cl ZINC000728673359 941306557 /nfs/dbraw/zinc/30/65/57/941306557.db2.gz YTDFODFLSHQFBM-NSHDSACASA-N 0 0 362.769 3.741 20 5 FHBDRN Cc1ccc(C(=O)OCC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1Cl ZINC000728673001 941312175 /nfs/dbraw/zinc/31/21/75/941312175.db2.gz VGOWHLQGAICDNB-UHFFFAOYSA-N 0 0 362.769 3.661 20 5 FHBDRN CCn1ccc(CNCc2ccc(N(C)c3ccccc3)c([N+](=O)[O-])c2)n1 ZINC000414478821 941322884 /nfs/dbraw/zinc/32/28/84/941322884.db2.gz HBJRTKNDYJWOPZ-UHFFFAOYSA-N 0 0 365.437 3.869 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCC3(C2)Oc2ccccc2O3)cc1OC(F)F ZINC000584521848 941341212 /nfs/dbraw/zinc/34/12/12/941341212.db2.gz GSJKZFZQOFIOOP-UHFFFAOYSA-N 0 0 364.304 3.574 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CC[C@@H](c2cccc(F)c2)C1 ZINC000412044205 941344878 /nfs/dbraw/zinc/34/48/78/941344878.db2.gz WJDSPKOVGUVIPO-AYOQOUSVSA-N 0 0 354.381 3.854 20 5 FHBDRN COc1cc(NCc2cc(OC)c(O)cc2[N+](=O)[O-])c(Cl)c(OC)c1 ZINC000414486155 941353325 /nfs/dbraw/zinc/35/33/25/941353325.db2.gz MZIRVQZRCUARBD-UHFFFAOYSA-N 0 0 368.773 3.592 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)NC[C@]1(C)CCCC[C@@H]1O ZINC000181497376 941355235 /nfs/dbraw/zinc/35/52/35/941355235.db2.gz RCXFJHJBMRVJJN-WMZOPIPTSA-N 0 0 366.483 3.766 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)NC[C@]1(C)CCCC[C@H]1O ZINC000181497422 941355351 /nfs/dbraw/zinc/35/53/51/941355351.db2.gz RCXFJHJBMRVJJN-AEFFLSMTSA-N 0 0 366.483 3.766 20 5 FHBDRN COCC[C@@H]1CCCCN(C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000376624368 941373112 /nfs/dbraw/zinc/37/31/12/941373112.db2.gz VPGYMGDHHHTCOJ-LBPRGKRZSA-N 0 0 355.822 3.919 20 5 FHBDRN C[C@H]1COc2ccccc2N1C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000072533240 941374416 /nfs/dbraw/zinc/37/44/16/941374416.db2.gz IUYNORQPIVYWRO-AWEZNQCLSA-N 0 0 367.405 3.623 20 5 FHBDRN C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1cnn(-c2ccccc2F)c1 ZINC000103375546 941379693 /nfs/dbraw/zinc/37/96/93/941379693.db2.gz UHRPVIXADDRYIQ-LBPRGKRZSA-N 0 0 366.352 3.511 20 5 FHBDRN CNC(=O)c1ccc(Cl)cc1NC(=O)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000122275939 941397522 /nfs/dbraw/zinc/39/75/22/941397522.db2.gz WBVSPCRAEYWMKF-UHFFFAOYSA-N 0 0 368.176 3.514 20 5 FHBDRN O=C([O-])[C@@H]1CCCC[N@@H+]1Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000414677201 941434382 /nfs/dbraw/zinc/43/43/82/941434382.db2.gz HVNXSRABXVXRFR-INIZCTEOSA-N 0 0 374.368 3.965 20 5 FHBDRN Cn1cc([N+](=O)[O-])c(C(=O)Nc2cccc(-c3c(F)cccc3F)c2)n1 ZINC000376804578 941434760 /nfs/dbraw/zinc/43/47/60/941434760.db2.gz OJYMFKPTBKCMQQ-UHFFFAOYSA-N 0 0 358.304 3.526 20 5 FHBDRN O=C(Nc1cc2c(cc1[N+](=O)[O-])OCCCO2)[C@H]1C[C@]1(F)c1ccccc1 ZINC000414733076 941451459 /nfs/dbraw/zinc/45/14/59/941451459.db2.gz CINBUVUINPAICC-YJYMSZOUSA-N 0 0 372.352 3.580 20 5 FHBDRN C[C@@H]1CCN(C(=O)c2nn(C)cc2[N+](=O)[O-])c2cc(Cl)ccc2S1 ZINC000376852087 941452208 /nfs/dbraw/zinc/45/22/08/941452208.db2.gz PFLAQWKOXCLWOQ-SECBINFHSA-N 0 0 366.830 3.513 20 5 FHBDRN COC(=O)Nc1cc(NC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc32)ccc1F ZINC000066745951 941458826 /nfs/dbraw/zinc/45/88/26/941458826.db2.gz UIGVWRLUSPBZKB-UHFFFAOYSA-N 0 0 372.312 3.646 20 5 FHBDRN Cc1nccc(-c2cccc(NC(=O)c3cc(F)c([N+](=O)[O-])cc3F)c2)n1 ZINC000376926971 941468169 /nfs/dbraw/zinc/46/81/69/941468169.db2.gz XGTGOGDJKNSMCL-UHFFFAOYSA-N 0 0 370.315 3.891 20 5 FHBDRN CC(=O)N1C[C@H](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)c2ccccc21 ZINC000376955865 941477311 /nfs/dbraw/zinc/47/73/11/941477311.db2.gz PZJUCJTYFDVVCW-ZDUSSCGKSA-N 0 0 371.368 3.603 20 5 FHBDRN COc1cc(C(=O)N2C[C@H](c3ccccc3)C(C)(C)C2)ccc1[N+](=O)[O-] ZINC000122317656 941504302 /nfs/dbraw/zinc/50/43/02/941504302.db2.gz HXALQSNOBUEZNU-MRXNPFEDSA-N 0 0 354.406 3.869 20 5 FHBDRN O=C(COc1ccccc1[N+](=O)[O-])N1CCC[C@H](c2ccccc2)CC1 ZINC000066765471 941516071 /nfs/dbraw/zinc/51/60/71/941516071.db2.gz HMFSQHQLSBMVQX-KRWDZBQOSA-N 0 0 354.406 3.770 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)N1CCC[C@H](c2ccccc2)CC1 ZINC000066764054 941518724 /nfs/dbraw/zinc/51/87/24/941518724.db2.gz RTCUAGLAORFKBN-HNNXBMFYSA-N 0 0 369.377 3.913 20 5 FHBDRN CC(=O)c1ccc([N+](=O)[O-])cc1N1CCC(C(=O)c2cccs2)CC1 ZINC000377142816 941530269 /nfs/dbraw/zinc/53/02/69/941530269.db2.gz RYYIXMKCHNHFEU-UHFFFAOYSA-N 0 0 358.419 3.958 20 5 FHBDRN C[C@@H](NC(=O)c1c[nH]nc1[N+](=O)[O-])c1ccc(Oc2ccccc2)c(F)c1 ZINC000549157536 941551923 /nfs/dbraw/zinc/55/19/23/941551923.db2.gz AZXJZCPKQKIPHS-LLVKDONJSA-N 0 0 370.340 3.740 20 5 FHBDRN COc1ccc(NC(=O)N2CCC[C@H]2c2cccc(C)n2)cc1[N+](=O)[O-] ZINC000541106999 941588851 /nfs/dbraw/zinc/58/88/51/941588851.db2.gz KBELEEULHQZAED-HNNXBMFYSA-N 0 0 356.382 3.676 20 5 FHBDRN Nc1ccc(-c2noc(CCCCC(=O)c3ccccc3)n2)cc1[N+](=O)[O-] ZINC000472699204 941595521 /nfs/dbraw/zinc/59/55/21/941595521.db2.gz QEMZSZAZBNCCKJ-UHFFFAOYSA-N 0 0 366.377 3.823 20 5 FHBDRN COc1ccc(NC(=O)NCc2ccccc2OC(C)C)cc1[N+](=O)[O-] ZINC000541106083 941605553 /nfs/dbraw/zinc/60/55/53/941605553.db2.gz CCEFMEUEDBZUGB-UHFFFAOYSA-N 0 0 359.382 3.712 20 5 FHBDRN CC(=O)N1CCN(c2ccc3cc([N+](=O)[O-])ccc3n2)CC12CCCCC2 ZINC000408039634 941606792 /nfs/dbraw/zinc/60/67/92/941606792.db2.gz ZZGVRPPMBCUWSU-UHFFFAOYSA-N 0 0 368.437 3.514 20 5 FHBDRN COC(=O)c1cc(C(=O)N2CCCC[C@H]2CCC(C)C)cc([N+](=O)[O-])c1 ZINC000472713117 941617733 /nfs/dbraw/zinc/61/77/33/941617733.db2.gz QCXSWXMDYRWJRH-INIZCTEOSA-N 0 0 362.426 3.812 20 5 FHBDRN CC(C)Oc1cc(C(=O)NC[C@@H]2CCOc3ccccc32)ccc1[N+](=O)[O-] ZINC000412065492 941619623 /nfs/dbraw/zinc/61/96/23/941619623.db2.gz FTDXDLLRDLRAFE-HNNXBMFYSA-N 0 0 370.405 3.678 20 5 FHBDRN CC(=O)c1cc(N2CC(C)(C)O[C@](C)(C(F)(F)F)C2)ccc1[N+](=O)[O-] ZINC000549194706 941620945 /nfs/dbraw/zinc/62/09/45/941620945.db2.gz BIUBDVWJCWSAEV-HNNXBMFYSA-N 0 0 360.332 3.734 20 5 FHBDRN COc1cccc([C@H](Nc2cc(F)ccc2[N+](=O)[O-])c2nccn2C)c1 ZINC000365552303 941632343 /nfs/dbraw/zinc/63/23/43/941632343.db2.gz AHEOKIFLKCPVLW-KRWDZBQOSA-N 0 0 356.357 3.678 20 5 FHBDRN O=[N+]([O-])c1ccccc1OS(=O)(=O)Cc1c(Cl)cccc1Cl ZINC000729267691 941705399 /nfs/dbraw/zinc/70/53/99/941705399.db2.gz ZYEPBJVLIUSHDJ-UHFFFAOYSA-N 0 0 362.190 3.810 20 5 FHBDRN Cc1cc(C(=O)N[C@@H](C)CC(C)(C)c2ccccc2)c(N)c([N+](=O)[O-])c1 ZINC000729284813 941708915 /nfs/dbraw/zinc/70/89/15/941708915.db2.gz NPVBIQYMQUOHNP-AWEZNQCLSA-N 0 0 355.438 3.972 20 5 FHBDRN C[C@H](Oc1c(Cl)nccc1[N+](=O)[O-])c1cccc(Br)n1 ZINC001225432136 941714332 /nfs/dbraw/zinc/71/43/32/941714332.db2.gz YQNKJFVYXFSHMF-ZETCQYMHSA-N 0 0 358.579 3.941 20 5 FHBDRN CNc1nc(C(=O)Nc2cccc(NC3CCCC3)c2)ccc1[N+](=O)[O-] ZINC000412088952 941715210 /nfs/dbraw/zinc/71/52/10/941715210.db2.gz OVWDIDUEBFFXFG-UHFFFAOYSA-N 0 0 355.398 3.638 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1-c1noc([C@H]2Cc3ccc(F)cc3C(=O)O2)n1 ZINC000377436738 941722639 /nfs/dbraw/zinc/72/26/39/941722639.db2.gz SACZEROEAFCDIN-OAHLLOKOSA-N 0 0 369.308 3.547 20 5 FHBDRN CC(C)(C)[C@H](Cn1ccnc1)NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000729339893 941723254 /nfs/dbraw/zinc/72/32/54/941723254.db2.gz DTLYESKHENEXQP-INIZCTEOSA-N 0 0 372.450 3.851 20 5 FHBDRN COc1ccc(CC(=O)Nc2cc3c(cc2Cl)CCC3=O)cc1[N+](=O)[O-] ZINC000760012377 941731531 /nfs/dbraw/zinc/73/15/31/941731531.db2.gz TXMISJBJTROFOO-UHFFFAOYSA-N 0 0 374.780 3.567 20 5 FHBDRN C[C@H]1C[C@@H](CC(=O)OCC(=O)Nc2cccc([N+](=O)[O-])c2)CC(C)(C)C1 ZINC001125859765 941734628 /nfs/dbraw/zinc/73/46/28/941734628.db2.gz YCQVLIGZZZRXJT-KBPBESRZSA-N 0 0 362.426 3.929 20 5 FHBDRN C[C@@H]1C[C@H](CC(=O)OCC(=O)Nc2cccc([N+](=O)[O-])c2)CC(C)(C)C1 ZINC001125859769 941735280 /nfs/dbraw/zinc/73/52/80/941735280.db2.gz YCQVLIGZZZRXJT-ZIAGYGMSSA-N 0 0 362.426 3.929 20 5 FHBDRN CCOC(=O)Cc1cccc(NC(=O)c2c(C)ccc([N+](=O)[O-])c2C)c1 ZINC001126388998 941736749 /nfs/dbraw/zinc/73/67/49/941736749.db2.gz TYPMDPQSZGLTTJ-UHFFFAOYSA-N 0 0 356.378 3.570 20 5 FHBDRN O=C(N[C@@H](c1ccc(F)cc1)C1CCC1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000729380160 941739507 /nfs/dbraw/zinc/73/95/07/941739507.db2.gz NSNDJCRFFMHLGQ-QGZVFWFLSA-N 0 0 373.340 3.913 20 5 FHBDRN O=C(Nc1ccc(OCc2ccncc2)cc1)c1cc(F)ccc1[N+](=O)[O-] ZINC000729375874 941741319 /nfs/dbraw/zinc/74/13/19/941741319.db2.gz DHFLZMZAOAWDTN-UHFFFAOYSA-N 0 0 367.336 3.960 20 5 FHBDRN Nc1c(F)c(N2CC[C@@H](Oc3ccc(Cl)cc3)C2)ccc1[N+](=O)[O-] ZINC000549251668 941750456 /nfs/dbraw/zinc/75/04/56/941750456.db2.gz ZIHPXAIMCVLGOG-GFCCVEGCSA-N 0 0 351.765 3.627 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[C@@H](Oc2cccc(Cl)c2)C1 ZINC000536250176 941754306 /nfs/dbraw/zinc/75/43/06/941754306.db2.gz OJYYWBLKOINPDI-MRXNPFEDSA-N 0 0 360.797 3.850 20 5 FHBDRN COc1cc2c(cc1OC)CN(c1nc3ccccc3cc1[N+](=O)[O-])CC2 ZINC000473523469 941760526 /nfs/dbraw/zinc/76/05/26/941760526.db2.gz MWWKKCBUEVTBQE-UHFFFAOYSA-N 0 0 365.389 3.723 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2nnc(CN3CCCc4cc(F)ccc43)o2)cc1 ZINC000072561624 941786177 /nfs/dbraw/zinc/78/61/77/941786177.db2.gz HULXQCIHMZYBGG-UHFFFAOYSA-N 0 0 354.341 3.737 20 5 FHBDRN CC(C)c1ccc(C(=O)NC[C@H](CCO)c2ccccc2)cc1[N+](=O)[O-] ZINC000190068453 941808719 /nfs/dbraw/zinc/80/87/19/941808719.db2.gz AHXZQXMSFTYLDO-KRWDZBQOSA-N 0 0 356.422 3.614 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(OCc2ccc(OC)c(Cl)c2)c1 ZINC000513245800 941813203 /nfs/dbraw/zinc/81/32/03/941813203.db2.gz LLSVLJLREPPNDT-UHFFFAOYSA-N 0 0 351.742 3.622 20 5 FHBDRN CCn1cc([C@H]2OCCC[C@@H]2Nc2ccc([N+](=O)[O-])cc2Cl)cn1 ZINC000433642740 941818840 /nfs/dbraw/zinc/81/88/40/941818840.db2.gz PTHXAWCMRULFMX-JKSUJKDBSA-N 0 0 350.806 3.797 20 5 FHBDRN CCOC(=O)c1ccc(NC2CC(C)(C)N(O)C(C)(C)C2)c([N+](=O)[O-])c1 ZINC001167718588 941831571 /nfs/dbraw/zinc/83/15/71/941831571.db2.gz VUSSKOAEQCONHQ-UHFFFAOYSA-N 0 0 365.430 3.594 20 5 FHBDRN CCOC(=O)c1ccccc1N(CC)C(=O)c1cccc([N+](=O)[O-])c1C ZINC000118621051 941832081 /nfs/dbraw/zinc/83/20/81/941832081.db2.gz WATWHFRCAAZBFR-UHFFFAOYSA-N 0 0 356.378 3.747 20 5 FHBDRN CCOC(=O)c1ccccc1N(CC)C(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000118620888 941832238 /nfs/dbraw/zinc/83/22/38/941832238.db2.gz YGVXRQYXXGMGPS-UHFFFAOYSA-N 0 0 356.378 3.747 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)c1c(Cl)cncc1Cl ZINC000513298947 941841712 /nfs/dbraw/zinc/84/17/12/941841712.db2.gz QEJXXKNWPAEJIP-UHFFFAOYSA-N 0 0 354.193 3.611 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N(C)Cc2ccc3ccccc3c2)c1[N+](=O)[O-] ZINC000433711645 941845785 /nfs/dbraw/zinc/84/57/85/941845785.db2.gz FTEPTBOKPCBDIW-UHFFFAOYSA-N 0 0 352.394 3.867 20 5 FHBDRN CCO[C@H]1C[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)C12CCCC2 ZINC000412149530 941845873 /nfs/dbraw/zinc/84/58/73/941845873.db2.gz JUOIYFLKZCKDSS-MLHJIOFPSA-N 0 0 358.438 3.552 20 5 FHBDRN CSc1nnc(CNc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)s1 ZINC000275535533 941846354 /nfs/dbraw/zinc/84/63/54/941846354.db2.gz YFSRCBLHBLJACK-UHFFFAOYSA-N 0 0 350.347 3.799 20 5 FHBDRN Cc1oc(C(C)C)nc1C(=O)N1CCS[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000513316505 941851285 /nfs/dbraw/zinc/85/12/85/941851285.db2.gz DYCYCOLVSUZBGJ-KRWDZBQOSA-N 0 0 361.423 3.902 20 5 FHBDRN O=C(NCCc1ccccc1[N+](=O)[O-])NCC1CC(c2ccccc2)C1 ZINC000549288680 941851550 /nfs/dbraw/zinc/85/15/50/941851550.db2.gz SBNLWYYZXHBTLM-UHFFFAOYSA-N 0 0 353.422 3.630 20 5 FHBDRN CC(C)Oc1ccc([C@H](C)NC(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])cc1 ZINC000433708458 941851924 /nfs/dbraw/zinc/85/19/24/941851924.db2.gz RHVYITWFVUYWCM-LBPRGKRZSA-N 0 0 360.414 3.720 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2ccccc2OCC(F)F)c1 ZINC000549289806 941855303 /nfs/dbraw/zinc/85/53/03/941855303.db2.gz GYTXEBZGTKTVGR-UHFFFAOYSA-N 0 0 366.320 3.890 20 5 FHBDRN Cc1cnc([C@H](C)NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)s1 ZINC000545828213 941855332 /nfs/dbraw/zinc/85/53/32/941855332.db2.gz SPNAUUVEXXVZBB-JTQLQIEISA-N 0 0 351.403 3.654 20 5 FHBDRN C[C@H](NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)[C@@H]1Oc2ccccc2[C@H]1C ZINC000412171366 941861178 /nfs/dbraw/zinc/86/11/78/941861178.db2.gz JPAMKDASBVKPJA-VBHADHFHSA-N 0 0 366.417 3.768 20 5 FHBDRN CC(C)c1[nH]nc(C(=O)Nc2cccc(Oc3ccncc3)c2)c1[N+](=O)[O-] ZINC000433745636 941862437 /nfs/dbraw/zinc/86/24/37/941862437.db2.gz SVTFDSGJMIXBQV-UHFFFAOYSA-N 0 0 367.365 3.881 20 5 FHBDRN O=C(NC1CC1)c1ccc(NCCCc2ccccc2F)c([N+](=O)[O-])c1 ZINC000480779810 941862899 /nfs/dbraw/zinc/86/28/99/941862899.db2.gz LOQVWFNOODRIBW-UHFFFAOYSA-N 0 0 357.385 3.671 20 5 FHBDRN C[C@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1c(F)cncc1F ZINC000513347347 941867355 /nfs/dbraw/zinc/86/73/55/941867355.db2.gz IMPJXNDRUNNARL-ZETCQYMHSA-N 0 0 356.716 3.804 20 5 FHBDRN COc1ccccc1O[C@@H]1CCCN(Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000513360973 941868224 /nfs/dbraw/zinc/86/82/24/941868224.db2.gz GUNRIHRERHKVHK-MRXNPFEDSA-N 0 0 360.385 3.786 20 5 FHBDRN COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1ccc(F)cc1[N+](=O)[O-] ZINC000119085398 941870599 /nfs/dbraw/zinc/87/05/99/941870599.db2.gz RESPAWKNXPVZOJ-CYBMUJFWSA-N 0 0 358.369 3.592 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NC(C)(C)c2ccccc2OC)c1 ZINC000549295664 941872153 /nfs/dbraw/zinc/87/21/53/941872153.db2.gz CUGPBTJVGGDISH-UHFFFAOYSA-N 0 0 358.394 3.667 20 5 FHBDRN Cc1cn([C@H](C)c2ccccc2)[nH]c1=NC(=O)c1cc(C)ccc1[N+](=O)[O-] ZINC000472823404 941874266 /nfs/dbraw/zinc/87/42/66/941874266.db2.gz APNUJAFUJHOVOS-OAHLLOKOSA-N 0 0 364.405 3.692 20 5 FHBDRN COC(=O)c1cc(NC(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)c(C)cc1C ZINC000472826062 941877023 /nfs/dbraw/zinc/87/70/23/941877023.db2.gz GDVVSKCWFLZYFO-GFCCVEGCSA-N 0 0 374.368 3.880 20 5 FHBDRN CC(C)c1[nH]nc(C(=O)Nc2ccc(Oc3ccccn3)cc2)c1[N+](=O)[O-] ZINC000433766198 941882231 /nfs/dbraw/zinc/88/22/31/941882231.db2.gz LWVNYVPLMHVZOJ-UHFFFAOYSA-N 0 0 367.365 3.881 20 5 FHBDRN CC(C)c1[nH]nc(C(=O)Nc2nc(-c3cccs3)cs2)c1[N+](=O)[O-] ZINC000433765349 941882781 /nfs/dbraw/zinc/88/27/81/941882781.db2.gz HHXBQICBSDAMTF-UHFFFAOYSA-N 0 0 363.424 3.879 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CCC(OCC2CCCC2)CC1 ZINC000412185532 941883474 /nfs/dbraw/zinc/88/34/74/941883474.db2.gz YATNSUZSKUUQHE-VQTJNVASSA-N 0 0 372.465 3.896 20 5 FHBDRN CC[C@H]1CCCC[C@H]1N(C)C(=O)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC000412186438 941884501 /nfs/dbraw/zinc/88/45/01/941884501.db2.gz SAQBEFYETRGKGG-GXTWGEPZSA-N 0 0 352.406 3.712 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N(c1ccccc1)[C@H]1CCOC1 ZINC000415541923 941887824 /nfs/dbraw/zinc/88/78/24/941887824.db2.gz PAAKONRFTKAVQM-GBESFXJTSA-N 0 0 352.390 3.520 20 5 FHBDRN CC(C)O[C@@H]1C[C@@H](NC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)C1(C)C ZINC001267677489 941890188 /nfs/dbraw/zinc/89/01/88/941890188.db2.gz VBASOLVOHBDDGQ-DAXOMENPSA-N 0 0 366.483 3.784 20 5 FHBDRN Cc1c(C(=O)N[C@@H]2CCC[C@H]2OCc2ccccc2)cccc1[N+](=O)[O-] ZINC000119638239 941891953 /nfs/dbraw/zinc/89/19/53/941891953.db2.gz BWKMBBMTAHGUNA-IEBWSBKVSA-N 0 0 354.406 3.771 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)NC(C)(C)Cc2ccccc2Cl)c1[N+](=O)[O-] ZINC000433775658 941893482 /nfs/dbraw/zinc/89/34/82/941893482.db2.gz SCRPKBCOTNJKTK-UHFFFAOYSA-N 0 0 364.833 3.846 20 5 FHBDRN CC(C)(CNC(=O)CSc1ccc([N+](=O)[O-])cc1)Oc1ccccc1 ZINC000513397577 941894467 /nfs/dbraw/zinc/89/44/67/941894467.db2.gz WBXPJYZUPPBPIB-UHFFFAOYSA-N 0 0 360.435 3.661 20 5 FHBDRN C[C@@H]1CC[C@@H](c2nc(-c3ccc(-n4cncn4)c([N+](=O)[O-])c3)no2)C[C@H]1C ZINC000453204078 941896916 /nfs/dbraw/zinc/89/69/16/941896916.db2.gz VIHXZVZTDCELNL-YRGRVCCFSA-N 0 0 368.397 3.765 20 5 FHBDRN CS[C@H]1CCCCN(C(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)C1 ZINC000412194139 941897342 /nfs/dbraw/zinc/89/73/42/941897342.db2.gz GPSDIJAXFOCOJA-AWEZNQCLSA-N 0 0 352.456 3.740 20 5 FHBDRN O=C(Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1)Nc1cccc(Cl)c1 ZINC000103463500 941901677 /nfs/dbraw/zinc/90/16/77/941901677.db2.gz PEVYIFUISFEFCY-UHFFFAOYSA-N 0 0 356.769 3.750 20 5 FHBDRN O=C(c1ccc(C2OCCO2)cc1)N1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000893024180 941901725 /nfs/dbraw/zinc/90/17/25/941901725.db2.gz BJOFNQMAFHSXRU-UHFFFAOYSA-N 0 0 368.389 3.623 20 5 FHBDRN O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CCC[C@@H]([C@@H](O)C(F)(F)F)C1 ZINC000433794371 941902295 /nfs/dbraw/zinc/90/22/95/941902295.db2.gz XIGZWIMVHCUBDX-PRHODGIISA-N 0 0 372.265 3.753 20 5 FHBDRN O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CCC[C@@H]([C@H](O)C(F)(F)F)C1 ZINC000433794370 941902512 /nfs/dbraw/zinc/90/25/12/941902512.db2.gz XIGZWIMVHCUBDX-PELKAZGASA-N 0 0 372.265 3.753 20 5 FHBDRN O=C([C@@H]1C[C@@]1(F)c1ccccc1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000412201848 941904037 /nfs/dbraw/zinc/90/40/37/941904037.db2.gz KDGAKOUNZYDPOE-FXAWDEMLSA-N 0 0 354.381 3.971 20 5 FHBDRN CC(C)[C@H](CNC(=O)COc1ccc(F)cc1[N+](=O)[O-])c1ccccc1 ZINC000549306070 941904772 /nfs/dbraw/zinc/90/47/72/941904772.db2.gz NHMOLPWSZBASPB-INIZCTEOSA-N 0 0 360.385 3.669 20 5 FHBDRN O=C([C@@H]1C[C@]1(F)c1ccccc1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000412212838 941921277 /nfs/dbraw/zinc/92/12/77/941921277.db2.gz SZRABDZVVCDZPT-ICSRJNTNSA-N 0 0 354.381 3.971 20 5 FHBDRN O=C(N[C@@H]1CCO[C@H]1c1ccc(Cl)cc1)c1csc([N+](=O)[O-])c1 ZINC000182443832 941925463 /nfs/dbraw/zinc/92/54/63/941925463.db2.gz FCGADUHUNPIHNH-OCCSQVGLSA-N 0 0 352.799 3.570 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N(Cc2ccc([C@H]3C[C@H]3C)o2)C2CC2)c1[N+](=O)[O-] ZINC000433830075 941925841 /nfs/dbraw/zinc/92/58/41/941925841.db2.gz HCJATALRSNIZOF-RISCZKNCSA-N 0 0 372.425 3.963 20 5 FHBDRN Cc1n[nH]c(C)c1[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1 ZINC000412217740 941926154 /nfs/dbraw/zinc/92/61/54/941926154.db2.gz LRSASIIDRAPNGL-MRXNPFEDSA-N 0 0 372.425 3.699 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CCc3cccc(F)c3C2)ccc1[N+](=O)[O-] ZINC000412227061 941936036 /nfs/dbraw/zinc/93/60/36/941936036.db2.gz MMIUERUSUDVOLH-UHFFFAOYSA-N 0 0 358.369 3.720 20 5 FHBDRN Cc1[nH]nc(C(F)F)c1NC(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1 ZINC000412225584 941940471 /nfs/dbraw/zinc/94/04/71/941940471.db2.gz KFGKAEPOZSNPFX-UHFFFAOYSA-N 0 0 354.313 3.603 20 5 FHBDRN CCCOc1nc(C(=O)NCc2ccc([N+](=O)[O-])cc2)cc2ccccc21 ZINC000513461960 941940560 /nfs/dbraw/zinc/94/05/60/941940560.db2.gz AUKSOEBJXPEATD-UHFFFAOYSA-N 0 0 365.389 3.862 20 5 FHBDRN O=[N+]([O-])c1cc2ccccc2nc1NCc1ccc(-n2ccnc2)c(F)c1 ZINC000473527967 941941129 /nfs/dbraw/zinc/94/11/29/941941129.db2.gz TWVXIWAWSIPDTD-UHFFFAOYSA-N 0 0 363.352 3.502 20 5 FHBDRN CC(C)(C)c1nc(CCNC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)cs1 ZINC000412229498 941942655 /nfs/dbraw/zinc/94/26/55/941942655.db2.gz KBUYCWVPGINHFU-JKSUJKDBSA-N 0 0 373.478 3.811 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)COc2cccc3cccnc32)cc1[N+](=O)[O-] ZINC000182564045 941943927 /nfs/dbraw/zinc/94/39/27/941943927.db2.gz WCPKKQUUUUFREI-AWEZNQCLSA-N 0 0 365.389 3.708 20 5 FHBDRN C[C@@H](NS(=O)(=O)Cc1ccc(C(F)F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000549321968 941947634 /nfs/dbraw/zinc/94/76/34/941947634.db2.gz LLFVCMFBVYYPTK-LLVKDONJSA-N 0 0 370.377 3.713 20 5 FHBDRN CO[C@H](c1ccc(F)cc1)[C@@H](C)NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412235026 941949855 /nfs/dbraw/zinc/94/98/55/941949855.db2.gz WMLUSZZQFKYHKG-UCVSXLDNSA-N 0 0 372.396 3.730 20 5 FHBDRN CCOc1cc(F)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000182650621 941958323 /nfs/dbraw/zinc/95/83/23/941958323.db2.gz ZYTSDCIQWMJVCO-UHFFFAOYSA-N 0 0 370.283 3.986 20 5 FHBDRN Cc1cnn([C@H]2CCN(Cc3ccc([N+](=O)[O-])cc3C(F)(F)F)C2)c1 ZINC000377759663 941966562 /nfs/dbraw/zinc/96/65/62/941966562.db2.gz IAMOVFKVIKVZDF-AWEZNQCLSA-N 0 0 354.332 3.566 20 5 FHBDRN COC[C@H](C)SCc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-] ZINC000182835025 941978047 /nfs/dbraw/zinc/97/80/47/941978047.db2.gz AHKCQMFYJIBADS-VIFPVBQESA-N 0 0 351.371 3.515 20 5 FHBDRN Cn1c(CNc2nc3ccccc3cc2[N+](=O)[O-])nc2cccc(Cl)c21 ZINC000473530844 941991756 /nfs/dbraw/zinc/99/17/56/941991756.db2.gz XSXLOOLDTSHHGF-UHFFFAOYSA-N 0 0 367.796 3.717 20 5 FHBDRN COc1ccccc1-n1nccc1CNCc1ccc([N+](=O)[O-])cc1Cl ZINC000430029369 941992941 /nfs/dbraw/zinc/99/29/41/941992941.db2.gz FQLONAXSLLGIKS-UHFFFAOYSA-N 0 0 372.812 3.732 20 5 FHBDRN C[C@H](C(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1)c1ccccc1 ZINC000182924658 941998729 /nfs/dbraw/zinc/99/87/29/941998729.db2.gz HAMNJPQNAYFKFD-HNNXBMFYSA-N 0 0 354.406 3.768 20 5 FHBDRN C[C@@H]1C[C@H](c2cccs2)CN1C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000377805577 942003521 /nfs/dbraw/zinc/00/35/21/942003521.db2.gz VTTRKDSVSZGUHK-MNOVXSKESA-N 0 0 356.407 3.551 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@](C)(c3ccc(C)cc3)C2)c1 ZINC000433960163 942017893 /nfs/dbraw/zinc/01/78/93/942017893.db2.gz XEHHXZUWPVHXPD-FQEVSTJZSA-N 0 0 354.406 3.716 20 5 FHBDRN COc1ccccc1CCNC(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000024549642 942018433 /nfs/dbraw/zinc/01/84/33/942018433.db2.gz YVEHILBMPJAPSB-UHFFFAOYSA-N 0 0 356.422 3.873 20 5 FHBDRN COc1cc(C(=O)N2CC[C@](C)(c3ccc(C)cc3)C2)ccc1[N+](=O)[O-] ZINC000433960867 942019076 /nfs/dbraw/zinc/01/90/76/942019076.db2.gz ZGGQTHFXZVRHIU-FQEVSTJZSA-N 0 0 354.406 3.716 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CC[C@@H](Nc2ccccc2)C1 ZINC000085621075 942020729 /nfs/dbraw/zinc/02/07/29/942020729.db2.gz SNXCFXFGAPRDHO-MRXNPFEDSA-N 0 0 354.410 3.930 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CCN(Cc2ccccc2)CC1 ZINC000085620713 942022537 /nfs/dbraw/zinc/02/25/37/942022537.db2.gz NWXTXSBKPRBBHI-UHFFFAOYSA-N 0 0 368.437 3.561 20 5 FHBDRN Cc1cc(Br)ccc1CN(C)C(=O)c1ccccc1[N+](=O)[O-] ZINC000433987284 942025269 /nfs/dbraw/zinc/02/52/69/942025269.db2.gz CYJULOBUQNKGML-UHFFFAOYSA-N 0 0 363.211 3.938 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)Nc1nc2c(s1)CCCC2 ZINC000513606304 942029657 /nfs/dbraw/zinc/02/96/57/942029657.db2.gz LXAXYPWMZOEVJI-UHFFFAOYSA-N 0 0 360.439 3.637 20 5 FHBDRN C[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000182963231 942029854 /nfs/dbraw/zinc/02/98/54/942029854.db2.gz MDOLVNTWPFCWTO-SUNKGSAMSA-N 0 0 354.353 3.989 20 5 FHBDRN Cc1cc(C(=O)NC[C@H]2CCCN(c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000433998691 942034820 /nfs/dbraw/zinc/03/48/20/942034820.db2.gz HXTQVBOMTWLLRK-MRXNPFEDSA-N 0 0 353.422 3.550 20 5 FHBDRN COc1cc(C(=O)N(C)Cc2cc(C)cc(C)c2)c([N+](=O)[O-])cc1OC ZINC000434000975 942036027 /nfs/dbraw/zinc/03/60/27/942036027.db2.gz ANKJXLSOCSCFTI-UHFFFAOYSA-N 0 0 358.394 3.501 20 5 FHBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NC1CCC2(CC2)CC1 ZINC000434007783 942037267 /nfs/dbraw/zinc/03/72/67/942037267.db2.gz JDWKSNSTEOTFEB-NSHDSACASA-N 0 0 352.818 3.855 20 5 FHBDRN CCOc1ccc(CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])cc1OC ZINC000110215010 942037305 /nfs/dbraw/zinc/03/73/05/942037305.db2.gz YLITUBNJXOTGJX-UHFFFAOYSA-N 0 0 364.785 3.586 20 5 FHBDRN CC(=O)N1Cc2ccc(NC(=O)Nc3cccc([N+](=O)[O-])c3Cl)cc2C1 ZINC000377872364 942044477 /nfs/dbraw/zinc/04/44/77/942044477.db2.gz DIYZOTCJHQQHAZ-UHFFFAOYSA-N 0 0 374.784 3.754 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1Cl)N1CC[C@@H](O)c2ccccc2C1 ZINC000377874416 942045615 /nfs/dbraw/zinc/04/56/15/942045615.db2.gz NMMRVCITWQGARH-OAHLLOKOSA-N 0 0 361.785 3.719 20 5 FHBDRN C[C@@H](NC(=O)CNc1ccc(F)c([N+](=O)[O-])c1)c1ccccc1Cl ZINC000025601260 942047472 /nfs/dbraw/zinc/04/74/72/942047472.db2.gz FJLQOHPJNJDHMC-SNVBAGLBSA-N 0 0 351.765 3.677 20 5 FHBDRN C[C@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)c1cc([N+](=O)[O-])n[nH]1 ZINC000513634183 942047713 /nfs/dbraw/zinc/04/77/13/942047713.db2.gz XGFWAFLPFWNLHT-CYBMUJFWSA-N 0 0 350.378 3.818 20 5 FHBDRN CCCCc1nc(-c2cccc(Oc3c([N+](=O)[O-])c(C)nn3C)c2)no1 ZINC000513635142 942047873 /nfs/dbraw/zinc/04/78/73/942047873.db2.gz JZTSNNYFIIVBLI-UHFFFAOYSA-N 0 0 357.370 3.822 20 5 FHBDRN C[C@@H](c1cccc([N+](=O)[O-])c1)N1CCN(C(=O)c2ccc(Cl)cc2)CC1 ZINC000025604308 942052083 /nfs/dbraw/zinc/05/20/83/942052083.db2.gz WHCWBNSDKLSVRZ-AWEZNQCLSA-N 0 0 373.840 3.767 20 5 FHBDRN Cn1ccnc1[C@H](NCc1cccc(Cl)c1)c1cccc([N+](=O)[O-])c1 ZINC000513656826 942059528 /nfs/dbraw/zinc/05/95/28/942059528.db2.gz XXGKOTZVBWRKES-QGZVFWFLSA-N 0 0 356.813 3.861 20 5 FHBDRN Cc1nn(-c2ccccc2)cc1CNC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000183004276 942062841 /nfs/dbraw/zinc/06/28/41/942062841.db2.gz ANTVDVKHCDNOET-UHFFFAOYSA-N 0 0 365.393 3.719 20 5 FHBDRN CC(C)c1nc(CCNC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)cs1 ZINC000102482732 942065311 /nfs/dbraw/zinc/06/53/11/942065311.db2.gz MIFZVXODGWBTIG-UHFFFAOYSA-N 0 0 358.423 3.629 20 5 FHBDRN COCCN(C[C@H]1CC=CCC1)C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412289963 942066364 /nfs/dbraw/zinc/06/63/64/942066364.db2.gz UPVBXJVADVCMQZ-ZYSHUDEJSA-N 0 0 358.438 3.530 20 5 FHBDRN Cc1cccc(O)c1NC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000183034046 942069748 /nfs/dbraw/zinc/06/97/48/942069748.db2.gz DHIGXZNKQGGVPK-UHFFFAOYSA-N 0 0 351.156 3.624 20 5 FHBDRN C[C@H](c1ccc(F)c(F)c1)N(C)C(=O)COc1ccc(F)cc1[N+](=O)[O-] ZINC000102599615 942072403 /nfs/dbraw/zinc/07/24/03/942072403.db2.gz FJBMONBUUMCTLI-SNVBAGLBSA-N 0 0 368.311 3.611 20 5 FHBDRN O=C(c1cccc(COc2ccc(F)cc2[N+](=O)[O-])c1)N1CCCCC1 ZINC000102599431 942072719 /nfs/dbraw/zinc/07/27/19/942072719.db2.gz OHTDKDKMKYSNBL-UHFFFAOYSA-N 0 0 358.369 3.939 20 5 FHBDRN CCC[C@]1(COC)CCCN1C(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1 ZINC000412295409 942074738 /nfs/dbraw/zinc/07/47/38/942074738.db2.gz UPUKNDIBWMYETI-LJQANCHMSA-N 0 0 364.442 3.803 20 5 FHBDRN CN(CCc1ccccc1)C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513686137 942079943 /nfs/dbraw/zinc/07/99/43/942079943.db2.gz WJVMJOSREFSYFT-UHFFFAOYSA-N 0 0 350.321 3.511 20 5 FHBDRN CC(C)c1ccccc1NC(=O)Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000102715290 942086775 /nfs/dbraw/zinc/08/67/75/942086775.db2.gz KBEVDVRLFCQKHY-UHFFFAOYSA-N 0 0 365.393 3.615 20 5 FHBDRN Cc1cc(Br)ccc1CC(=O)Nc1ccc([N+](=O)[O-])c(C)n1 ZINC000183091248 942098422 /nfs/dbraw/zinc/09/84/22/942098422.db2.gz PZFHPHLARUJDER-UHFFFAOYSA-N 0 0 364.199 3.550 20 5 FHBDRN COc1ccccc1CC(C)(C)NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000413368575 942101235 /nfs/dbraw/zinc/10/12/35/942101235.db2.gz JXJDUJJDRFPEAV-ZWKOTPCHSA-N 0 0 368.433 3.844 20 5 FHBDRN COc1cc(CNc2ccc([N+](=O)[O-])c3ncccc23)cc(OC)c1OC ZINC000501880920 942101391 /nfs/dbraw/zinc/10/13/91/942101391.db2.gz VLTLCFFBHZZMMJ-UHFFFAOYSA-N 0 0 369.377 3.781 20 5 FHBDRN COc1ccc([C@H](C)NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)cc1 ZINC000513724468 942101397 /nfs/dbraw/zinc/10/13/97/942101397.db2.gz KENFALCELRUHHP-JTQLQIEISA-N 0 0 366.320 3.696 20 5 FHBDRN Cc1ccc(NC(=S)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c(C)c1 ZINC000006964582 942102229 /nfs/dbraw/zinc/10/22/29/942102229.db2.gz LKMHINXITDYOOU-UHFFFAOYSA-N 0 0 370.478 3.731 20 5 FHBDRN O=C(NCc1ccc(-c2nc3ccccc3[nH]2)cc1)c1ccc([N+](=O)[O-])o1 ZINC000102819105 942112064 /nfs/dbraw/zinc/11/20/64/942112064.db2.gz JTARJBPXGUHLSG-UHFFFAOYSA-N 0 0 362.345 3.661 20 5 FHBDRN Cn1cnc([N+](=O)[O-])c1N1CCCC[C@@H]1c1nc2cc(Cl)ccc2[nH]1 ZINC000413378153 942113245 /nfs/dbraw/zinc/11/32/45/942113245.db2.gz PHLIEAPRKPQDMA-CYBMUJFWSA-N 0 0 360.805 3.590 20 5 FHBDRN COc1cc(C(=O)N(c2ccccc2)[C@@H]2C[C@@H]2C)cc([N+](=O)[O-])c1OC ZINC000415885964 942114856 /nfs/dbraw/zinc/11/48/56/942114856.db2.gz DDOAJQYLNBZXGN-SWLSCSKDSA-N 0 0 356.378 3.667 20 5 FHBDRN CCC(CC)[C@H]1C[C@@H](NC(=O)c2ccc([N+](=O)[O-])c3cccnc23)CCO1 ZINC000183357521 942117778 /nfs/dbraw/zinc/11/77/78/942117778.db2.gz IWAVJNXYEAFFSI-KBXCAEBGSA-N 0 0 371.437 3.857 20 5 FHBDRN O=C(Nc1c(F)cc(Cl)cc1F)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000183362081 942119448 /nfs/dbraw/zinc/11/94/48/942119448.db2.gz HFTWHQJCPKITQE-UHFFFAOYSA-N 0 0 356.668 3.507 20 5 FHBDRN Cc1nc2ccccc2n1C1CCN(c2ncc(C)cc2[N+](=O)[O-])CC1 ZINC000280159866 942120057 /nfs/dbraw/zinc/12/00/57/942120057.db2.gz GGZQJVJEJTZILI-UHFFFAOYSA-N 0 0 351.410 3.798 20 5 FHBDRN CO[C@]1(C)CCCN(C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000280165952 942121628 /nfs/dbraw/zinc/12/16/28/942121628.db2.gz FXIKUNFIKBJPIM-LJQANCHMSA-N 0 0 363.458 3.518 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)Nc1cc(C(=O)OC)c(C)cc1C ZINC000280164761 942121682 /nfs/dbraw/zinc/12/16/82/942121682.db2.gz XHHXTSFBLUNRRT-UHFFFAOYSA-N 0 0 372.377 3.649 20 5 FHBDRN COc1cc(C(=O)N2C[C@@H](c3ccccc3)O[C@@H](C)C2)cc([N+](=O)[O-])c1C ZINC000190102370 942122963 /nfs/dbraw/zinc/12/29/63/942122963.db2.gz AVIDZCMYTCGBQY-DJJJIMSYSA-N 0 0 370.405 3.514 20 5 FHBDRN COc1cc(C(=O)N[C@H](C)[C@@H](C)c2ccccc2)cc([N+](=O)[O-])c1OC ZINC000473541649 942136137 /nfs/dbraw/zinc/13/61/37/942136137.db2.gz PQQDNORRNXHZDY-CHWSQXEVSA-N 0 0 358.394 3.534 20 5 FHBDRN C[C@H](NC(=O)c1c(Cl)cccc1[N+](=O)[O-])c1ccc2c(c1)CCC(=O)N2 ZINC000110224050 942139619 /nfs/dbraw/zinc/13/96/19/942139619.db2.gz FKWZOFPUNSNSTB-JTQLQIEISA-N 0 0 373.796 3.624 20 5 FHBDRN CO[C@](C)([C@H](C)NC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])C1CC1 ZINC000415917922 942142139 /nfs/dbraw/zinc/14/21/39/942142139.db2.gz KATXLHPWUKDUKM-BJOHPYRUSA-N 0 0 360.332 3.547 20 5 FHBDRN CO[C@@](C)([C@H](C)NC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])C1CC1 ZINC000415917925 942142965 /nfs/dbraw/zinc/14/29/65/942142965.db2.gz KATXLHPWUKDUKM-VFZGTOFNSA-N 0 0 360.332 3.547 20 5 FHBDRN Cc1nc2ccc(C(=O)N(Cc3cccc([N+](=O)[O-])c3)C3CC3)cc2o1 ZINC000280259556 942144676 /nfs/dbraw/zinc/14/46/76/942144676.db2.gz XPBBXGWGTCNOBL-UHFFFAOYSA-N 0 0 351.362 3.849 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)[C@@](C)(OC)C1CC1 ZINC000415922212 942148902 /nfs/dbraw/zinc/14/89/02/942148902.db2.gz TUPCRHCGJWBPNE-APPDUMDISA-N 0 0 352.456 3.640 20 5 FHBDRN COc1ccc(C2(NC(=O)[C@@H]3C[C@H]3c3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000413410218 942154736 /nfs/dbraw/zinc/15/47/36/942154736.db2.gz CCSWSAFPEGELKP-ZWKOTPCHSA-N 0 0 352.390 3.512 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCCc1cccc2[nH]ccc21 ZINC000501973065 942156378 /nfs/dbraw/zinc/15/63/78/942156378.db2.gz IRWZQUMLRPPMCP-ZDUSSCGKSA-N 0 0 369.446 3.916 20 5 FHBDRN CC(C)(CNC(=O)Cc1ccc(Cl)c([N+](=O)[O-])c1)CC(F)(F)F ZINC001167725274 942157228 /nfs/dbraw/zinc/15/72/28/942157228.db2.gz GASFQQSQIQIINN-UHFFFAOYSA-N 0 0 352.740 3.886 20 5 FHBDRN NC(=O)c1cccc(NCC2(Cc3cccc(Cl)c3)CC2)c1[N+](=O)[O-] ZINC000413413112 942160783 /nfs/dbraw/zinc/16/07/83/942160783.db2.gz XYOPAJDDKDIOFO-UHFFFAOYSA-N 0 0 359.813 3.782 20 5 FHBDRN CCOCCC1(C(=O)Nc2cc(-c3cccc([N+](=O)[O-])c3)[nH]n2)CCC1 ZINC000128374991 942169942 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CC(C)[C@H]1N(C(=O)N[C@H](C)c2ccccc2[N+](=O)[O-])CC12CCOCC2 ZINC000413438159 942185979 /nfs/dbraw/zinc/18/59/79/942185979.db2.gz POHWNSVZJQXLLW-RHSMWYFYSA-N 0 0 361.442 3.502 20 5 FHBDRN Cc1ccc(S(=O)(=O)N[C@H](CC(F)F)c2ccccc2)c([N+](=O)[O-])c1 ZINC000420735890 942186830 /nfs/dbraw/zinc/18/68/30/942186830.db2.gz KNDDVBKOWAZKTO-CYBMUJFWSA-N 0 0 370.377 3.578 20 5 FHBDRN CC[C@@H](NS(=O)(=O)CCc1ccc([N+](=O)[O-])cc1)c1ccc(C)cc1 ZINC000183406523 942188919 /nfs/dbraw/zinc/18/89/19/942188919.db2.gz RQQLDKPBHWWZCN-GOSISDBHSA-N 0 0 362.451 3.516 20 5 FHBDRN C[C@H](NC(=O)N1C[C@H](C)C[C@H]1c1cccnc1)c1cccc([N+](=O)[O-])c1 ZINC000183156976 942192258 /nfs/dbraw/zinc/19/22/58/942192258.db2.gz SHOFAGZXVFKMPA-GLJUWKHASA-N 0 0 354.410 3.844 20 5 FHBDRN COc1ccccc1-c1nnc(CN2CCc3cc(C)c([N+](=O)[O-])cc32)o1 ZINC000366679263 942196037 /nfs/dbraw/zinc/19/60/37/942196037.db2.gz MZNIIQZZFHSMJY-UHFFFAOYSA-N 0 0 366.377 3.525 20 5 FHBDRN C[C@H](N[C@@H](c1ccn(C)n1)c1ccc(F)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000366691969 942204823 /nfs/dbraw/zinc/20/48/23/942204823.db2.gz CLGNLUKWUDKPNN-ORAYPTAESA-N 0 0 354.385 3.908 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N(C)[C@H](C)c2ccc(F)cc2)c1C ZINC000480930736 942210948 /nfs/dbraw/zinc/21/09/48/942210948.db2.gz OXGUELDPEJDRCZ-CYBMUJFWSA-N 0 0 366.414 3.732 20 5 FHBDRN CCCc1c(C(=O)N2CCc3ccc([N+](=O)[O-])cc32)[nH]c(C)c1C(C)=O ZINC000128386484 942213422 /nfs/dbraw/zinc/21/34/22/942213422.db2.gz MRTMBGCYJPDQIT-UHFFFAOYSA-N 0 0 355.394 3.589 20 5 FHBDRN CN(CCCNC(=O)c1c(Cl)cccc1[N+](=O)[O-])c1ccccc1F ZINC000110237878 942214321 /nfs/dbraw/zinc/21/43/21/942214321.db2.gz CEUBOZBQGHITPS-UHFFFAOYSA-N 0 0 365.792 3.644 20 5 FHBDRN CO[C@H]1Cc2ccccc2N(C(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)C1 ZINC000412318149 942217663 /nfs/dbraw/zinc/21/76/63/942217663.db2.gz GDJOWSXNAWULJL-INIZCTEOSA-N 0 0 370.405 3.600 20 5 FHBDRN O=C(c1csc(C(F)(F)F)n1)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000472933910 942220699 /nfs/dbraw/zinc/22/06/99/942220699.db2.gz XEULWDHXYYWNJC-UHFFFAOYSA-N 0 0 357.313 3.663 20 5 FHBDRN CCNc1ccc(C(=O)N[C@@H]2CCOc3c(CC)cccc32)cc1[N+](=O)[O-] ZINC000513701408 942225219 /nfs/dbraw/zinc/22/52/19/942225219.db2.gz STGAUZSCQSXFQZ-MRXNPFEDSA-N 0 0 369.421 3.843 20 5 FHBDRN O=c1c([N+](=O)[O-])cc(Cl)cn1CCOc1cc(Cl)ccc1Cl ZINC000502102774 942226938 /nfs/dbraw/zinc/22/69/38/942226938.db2.gz GGFAJFXXOSJJBG-UHFFFAOYSA-N 0 0 363.584 3.796 20 5 FHBDRN O=c1c([N+](=O)[O-])cc(Br)cn1CCc1ccc2ccccc2c1 ZINC000502109157 942231460 /nfs/dbraw/zinc/23/14/60/942231460.db2.gz JQJWFTWRPLWXHE-UHFFFAOYSA-N 0 0 373.206 3.915 20 5 FHBDRN CC(C)(C)c1nnc(COc2c(Br)cccc2[N+](=O)[O-])o1 ZINC000122787842 942232605 /nfs/dbraw/zinc/23/26/05/942232605.db2.gz YECSJHKTFQWMNP-UHFFFAOYSA-N 0 0 356.176 3.617 20 5 FHBDRN CCC(=O)c1ccc(NC2CCN(C(=O)CC(C)C)CC2)c([N+](=O)[O-])c1 ZINC000280681870 942233059 /nfs/dbraw/zinc/23/30/59/942233059.db2.gz INEHMBKPGOXURO-UHFFFAOYSA-N 0 0 361.442 3.637 20 5 FHBDRN C[C@@H](NC(=O)N1CC[C@@H](c2ccccc2F)C1)c1cccc([N+](=O)[O-])c1 ZINC000502123874 942233822 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/nfs/dbraw/zinc/30/27/70/942302770.db2.gz BCPQPJVGGMKERI-LBPRGKRZSA-N 0 0 356.426 3.553 20 5 FHBDRN Cc1ccc(C)c(S(=O)(=O)N(C)C[C@@H](C)c2ccccc2)c1[N+](=O)[O-] ZINC000481060308 942308697 /nfs/dbraw/zinc/30/86/97/942308697.db2.gz NDEZIJKOVUDJMH-OAHLLOKOSA-N 0 0 362.451 3.636 20 5 FHBDRN CC[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1SCCOC)[C@H]1CC1(C)C ZINC000416067359 942314379 /nfs/dbraw/zinc/31/43/79/942314379.db2.gz BYHQNIBWJZMBPF-CABCVRRESA-N 0 0 366.483 3.888 20 5 FHBDRN COc1ccc(/C=C/C(=O)OCc2ccc(Cl)c([N+](=O)[O-])c2)cc1O ZINC000783080089 942315499 /nfs/dbraw/zinc/31/54/99/942315499.db2.gz NAQMUEADUAXYFB-QPJJXVBHSA-N 0 0 363.753 3.719 20 5 FHBDRN CCN(C(=O)Cc1ccccc1[N+](=O)[O-])c1ccc(Br)cc1 ZINC000501118682 942318174 /nfs/dbraw/zinc/31/81/74/942318174.db2.gz HUSHYWQAQSGEKY-UHFFFAOYSA-N 0 0 363.211 3.953 20 5 FHBDRN C[C@H](Nc1ccc(C(=O)NC[C@H]2CC23CC3)cc1[N+](=O)[O-])c1ccccn1 ZINC000416071884 942318695 /nfs/dbraw/zinc/31/86/95/942318695.db2.gz MKQSMGLYCHYMLF-DZGCQCFKSA-N 0 0 366.421 3.693 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N[C@H](CC)[C@@H]2CC2(C)C)cc1OC ZINC000416084206 942324578 /nfs/dbraw/zinc/32/45/78/942324578.db2.gz OSGGXFHBBMIYAP-QWHCGFSZSA-N 0 0 350.415 3.557 20 5 FHBDRN O=[N+]([O-])c1ccc(NC[C@@H](CO)c2ccc(F)cc2)c(OC(F)F)c1 ZINC000413535186 942324936 /nfs/dbraw/zinc/32/49/36/942324936.db2.gz DMURGPMSUIGGEU-NSHDSACASA-N 0 0 356.300 3.523 20 5 FHBDRN CC[C@](C)(NC(=O)c1cc(OC)c(C)c([N+](=O)[O-])c1)c1nc(C)cs1 ZINC000188072561 942325829 /nfs/dbraw/zinc/32/58/29/942325829.db2.gz LXAWDKJGSHLIJT-KRWDZBQOSA-N 0 0 363.439 3.732 20 5 FHBDRN CNC(=O)C[C@H](Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)c1ccccc1 ZINC000481084909 942327302 /nfs/dbraw/zinc/32/73/02/942327302.db2.gz BVZACIPDRJSBDI-AWEZNQCLSA-N 0 0 367.327 3.903 20 5 FHBDRN CNC(=O)c1ccc(N[C@H]2CC[C@H](c3ccccc3F)C2)c([N+](=O)[O-])c1 ZINC000481092465 942328181 /nfs/dbraw/zinc/32/81/81/942328181.db2.gz PDAUHHAITWIRGV-JSGCOSHPSA-N 0 0 357.385 3.842 20 5 FHBDRN CC[C@H](NC(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-])[C@@H]1CC1(C)C ZINC000416086909 942334315 /nfs/dbraw/zinc/33/43/15/942334315.db2.gz WPCUWLHAQMDCAA-RYUDHWBXSA-N 0 0 352.456 3.880 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N[C@@H](C)c2cccc(F)c2F)c1C ZINC000501153860 942335873 /nfs/dbraw/zinc/33/58/73/942335873.db2.gz ITUZHEICYFOWKZ-NSHDSACASA-N 0 0 370.377 3.529 20 5 FHBDRN COCCCCN(C)C(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 ZINC000416096275 942338824 /nfs/dbraw/zinc/33/88/24/942338824.db2.gz DPSSUSXGXJXMHT-UHFFFAOYSA-N 0 0 358.394 3.886 20 5 FHBDRN CC[C@@H]1CC[C@H](C)N1CC(=O)Nc1ccc([N+](=O)[O-])cc1Br ZINC000330636944 942339278 /nfs/dbraw/zinc/33/92/78/942339278.db2.gz AUCIJIADIOJFCM-WDEREUQCSA-N 0 0 370.247 3.559 20 5 FHBDRN CC(C)NC(=O)[C@@H]1CCC[C@@H](Nc2ncc([N+](=O)[O-])cc2C(F)(F)F)C1 ZINC000413150504 942344323 /nfs/dbraw/zinc/34/43/23/942344323.db2.gz VEVABCPLUVXXOI-GHMZBOCLSA-N 0 0 374.363 3.504 20 5 FHBDRN COc1ccc(Cl)cc1C(=O)Nc1ccnn1-c1ccc([N+](=O)[O-])cc1 ZINC000103931442 942347732 /nfs/dbraw/zinc/34/77/32/942347732.db2.gz KUTMOZKSPFDRLT-UHFFFAOYSA-N 0 0 372.768 3.695 20 5 FHBDRN Cn1ccnc1[C@@H](NCCc1cccc(F)c1F)c1ccc([N+](=O)[O-])cc1 ZINC000513708740 942348036 /nfs/dbraw/zinc/34/80/36/942348036.db2.gz WQJQKFWFSYBAQL-SFHVURJKSA-N 0 0 372.375 3.528 20 5 FHBDRN CCCCCn1cc(CNC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c(C)n1 ZINC000502290931 942348717 /nfs/dbraw/zinc/34/87/17/942348717.db2.gz HEPLODAHNBDXLS-AWEZNQCLSA-N 0 0 373.457 3.850 20 5 FHBDRN Cc1nc([C@H]2CCCN(Cc3ccc([N+](=O)[O-])cc3C(F)(F)F)C2)no1 ZINC000366455665 942350159 /nfs/dbraw/zinc/35/01/59/942350159.db2.gz YZQHZFGCUKBDBD-LBPRGKRZSA-N 0 0 370.331 3.685 20 5 FHBDRN COCCCCN(C)C(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000416105634 942352487 /nfs/dbraw/zinc/35/24/87/942352487.db2.gz UPRQLNSIPPUINL-UHFFFAOYSA-N 0 0 357.410 3.837 20 5 FHBDRN Cc1c(CC(=O)Oc2cccc(NC(=O)C(C)C)c2)cccc1[N+](=O)[O-] ZINC000122879031 942354197 /nfs/dbraw/zinc/35/41/97/942354197.db2.gz JJONNIJXEWACMC-UHFFFAOYSA-N 0 0 356.378 3.646 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1OC(F)F)N1CCSC[C@@H]1C1CCC1 ZINC000416114858 942358375 /nfs/dbraw/zinc/35/83/75/942358375.db2.gz PHFQMHZQMHXHRI-CYBMUJFWSA-N 0 0 372.393 3.554 20 5 FHBDRN Cn1nc2c(c1C(=O)Nc1cc([N+](=O)[O-])ccc1C(C)(C)C)CSCC2 ZINC000893170390 942358968 /nfs/dbraw/zinc/35/89/68/942358968.db2.gz YEWBFKZYDYCKDD-UHFFFAOYSA-N 0 0 374.466 3.667 20 5 FHBDRN O=C1CCCN1[C@H]1CCCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000413572303 942366582 /nfs/dbraw/zinc/36/65/82/942366582.db2.gz RLIGKGXBDOHSSV-ZDUSSCGKSA-N 0 0 371.359 3.595 20 5 FHBDRN Cc1nn(CC(=O)Nc2c(Cl)cc(Cl)cc2Cl)cc1[N+](=O)[O-] ZINC000501260957 942368373 /nfs/dbraw/zinc/36/83/73/942368373.db2.gz KXNHMMMCVHAFPT-UHFFFAOYSA-N 0 0 363.588 3.699 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)C[C@H](c1ccc(O)cc1)C1CC1 ZINC000412328541 942369415 /nfs/dbraw/zinc/36/94/15/942369415.db2.gz CAGBFYRPFHMDTN-IBGZPJMESA-N 0 0 368.433 3.885 20 5 FHBDRN O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CC[C@H](Oc2ccccc2Cl)C1 ZINC000502345121 942372292 /nfs/dbraw/zinc/37/22/92/942372292.db2.gz XSXSGQMFBAVSHO-AWEZNQCLSA-N 0 0 364.760 3.681 20 5 FHBDRN COc1ccc([C@H]2C[C@H](NC(=O)CCc3cccc([N+](=O)[O-])c3)C2)cc1F ZINC000501296500 942384143 /nfs/dbraw/zinc/38/41/43/942384143.db2.gz TWEZHFLPAJCTBX-WKILWMFISA-N 0 0 372.396 3.738 20 5 FHBDRN COc1cc(CN(C)c2ncc([N+](=O)[O-])cc2F)c(SC)cc1OC ZINC000413163573 942390317 /nfs/dbraw/zinc/39/03/17/942390317.db2.gz PWTORDTXQFOAML-UHFFFAOYSA-N 0 0 367.402 3.504 20 5 FHBDRN Cc1cc(NC(=O)C(=O)N(C)[C@H]2CCC[C@H]2C(C)(C)C)ccc1[N+](=O)[O-] ZINC000419788736 942391804 /nfs/dbraw/zinc/39/18/04/942391804.db2.gz QNSRYWAZJFWERL-ZBFHGGJFSA-N 0 0 361.442 3.515 20 5 FHBDRN COc1ccc2c(c1)[C@H](OC(=O)[C@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1)CCO2 ZINC001268850273 942402711 /nfs/dbraw/zinc/40/27/11/942402711.db2.gz VPHWHNNXHVMKBN-JTDSTZFVSA-N 0 0 369.373 3.774 20 5 FHBDRN COc1cc(Cl)ccc1OCc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000421209284 942411081 /nfs/dbraw/zinc/41/10/81/942411081.db2.gz YLOQYXUHLSRNII-UHFFFAOYSA-N 0 0 351.742 3.702 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])c2ncccc12)C1([C@H]2CCCCO2)CCC1 ZINC001268853847 942414079 /nfs/dbraw/zinc/41/40/79/942414079.db2.gz LOBRPBYDCOWLOP-MRXNPFEDSA-N 0 0 355.394 3.821 20 5 FHBDRN Cc1cc(C(=O)Nc2ccc([N+](=O)[O-])c3ncccc23)ccc1-n1cccn1 ZINC001268853775 942414575 /nfs/dbraw/zinc/41/45/75/942414575.db2.gz ISKUEAIHIUEDGJ-UHFFFAOYSA-N 0 0 373.372 3.889 20 5 FHBDRN COc1ccc([C@H]2C[C@H](NC(=O)c3cc([N+](=O)[O-])ccc3C)C2)cc1F ZINC000501330510 942414981 /nfs/dbraw/zinc/41/49/81/942414981.db2.gz QTPDRCDKHZCJIQ-HDJSIYSDSA-N 0 0 358.369 3.727 20 5 FHBDRN Cc1c(NCc2nn(C)cc2Cl)cc(Br)cc1[N+](=O)[O-] ZINC000421201010 942425435 /nfs/dbraw/zinc/42/54/35/942425435.db2.gz HWUKRTMPMQSAGL-UHFFFAOYSA-N 0 0 359.611 3.665 20 5 FHBDRN CCn1c2ccccc2nc1[C@@H]1CCCN1c1ncc([N+](=O)[O-])cc1F ZINC000413184829 942437696 /nfs/dbraw/zinc/43/76/96/942437696.db2.gz KQENMUBDRHIJHC-INIZCTEOSA-N 0 0 355.373 3.840 20 5 FHBDRN CCC(CC)N(CCOC)C(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1 ZINC000413186030 942438506 /nfs/dbraw/zinc/43/85/06/942438506.db2.gz OBWXQYDVHUFOCQ-UHFFFAOYSA-N 0 0 352.431 3.659 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CCOc2c(Cl)cccc21 ZINC000413617334 942441373 /nfs/dbraw/zinc/44/13/73/942441373.db2.gz JLVCVHHIWJZXNH-UONOGXRCSA-N 0 0 358.781 3.777 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)C(F)(F)F)cc1N[C@H]1CCC[C@@H](CO)C1 ZINC000413620995 942442106 /nfs/dbraw/zinc/44/21/06/942442106.db2.gz XWXQFQGUSRUPAJ-BDAKNGLRSA-N 0 0 369.290 3.607 20 5 FHBDRN CN(C)C(=O)[C@@H]1CCC[C@@H](Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)C1 ZINC000513745411 942442230 /nfs/dbraw/zinc/44/22/30/942442230.db2.gz YOBJTZBHEPVWFJ-GHMZBOCLSA-N 0 0 359.348 3.673 20 5 FHBDRN CN(CC(=O)Nc1ccc(F)c(F)c1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000016312691 942443056 /nfs/dbraw/zinc/44/30/56/942443056.db2.gz UEOMJGMLBSSXJO-UHFFFAOYSA-N 0 0 369.755 3.597 20 5 FHBDRN C[C@@]1(c2nc(Cc3ccc([N+](=O)[O-])cc3Br)no2)CC1(F)F ZINC000421250953 942443580 /nfs/dbraw/zinc/44/35/80/942443580.db2.gz LPQYQYAWEOCAGK-LBPRGKRZSA-N 0 0 374.141 3.628 20 5 FHBDRN CCC(=O)c1ccc(NC2CCN(Cc3cscn3)CC2)c([N+](=O)[O-])c1 ZINC000366496716 942456499 /nfs/dbraw/zinc/45/64/99/942456499.db2.gz YPRWTPMLLHJNMM-UHFFFAOYSA-N 0 0 374.466 3.721 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CCO[C@@H](c3ccsc3)C2)c(C(F)(F)F)c1 ZINC000413192526 942459255 /nfs/dbraw/zinc/45/92/55/942459255.db2.gz NFQIQYRPXSWOIQ-GFCCVEGCSA-N 0 0 359.329 3.648 20 5 FHBDRN O=[N+]([O-])c1ccc(S(=O)(=O)Nc2ccc(Oc3ccccn3)cc2)cc1 ZINC000505304120 942459416 /nfs/dbraw/zinc/45/94/16/942459416.db2.gz FFPMDXAWMMLYQT-UHFFFAOYSA-N 0 0 371.374 3.583 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1-c1nc(COCC(F)(F)C(F)F)no1 ZINC000421269925 942462080 /nfs/dbraw/zinc/46/20/80/942462080.db2.gz VHTWEUOKRWINEH-UHFFFAOYSA-N 0 0 363.267 3.679 20 5 FHBDRN CC[C@@]1(c2ccccc2)NC(=O)N([C@@H](C)c2ccc([N+](=O)[O-])cc2)C1=O ZINC000419970234 942471445 /nfs/dbraw/zinc/47/14/45/942471445.db2.gz UEMQKARNVUWLKS-DJJJIMSYSA-N 0 0 353.378 3.513 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1C(=O)NC[C@H](CC(C)C)C(=O)OC(C)(C)C ZINC000424959031 942471736 /nfs/dbraw/zinc/47/17/36/942471736.db2.gz XXMGFHPENAOPCF-AWEZNQCLSA-N 0 0 364.442 3.637 20 5 FHBDRN CCOc1cc(C)ccc1NC(=O)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC000413200940 942473492 /nfs/dbraw/zinc/47/34/92/942473492.db2.gz VLCUHQRPEOLNPH-UHFFFAOYSA-N 0 0 362.357 3.631 20 5 FHBDRN Cc1sc(C(=O)N[C@H](C)c2ccc(-n3cccn3)c(F)c2)cc1[N+](=O)[O-] ZINC000505318357 942473789 /nfs/dbraw/zinc/47/37/89/942473789.db2.gz UBRKYUGGHAYAAS-SNVBAGLBSA-N 0 0 374.397 3.781 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1nnc(C2CCC2)[nH]1 ZINC000545444386 942479975 /nfs/dbraw/zinc/47/99/75/942479975.db2.gz PZOWSTZYRDELLC-UHFFFAOYSA-N 0 0 361.427 3.735 20 5 FHBDRN CN1CC[C@@H](Nc2ncc([N+](=O)[O-])cc2F)[C@H]1c1ccc(Cl)c(F)c1 ZINC000413212434 942487352 /nfs/dbraw/zinc/48/73/52/942487352.db2.gz YSKZOARHPCJHPV-HUUCEWRRSA-N 0 0 368.771 3.779 20 5 FHBDRN Cc1nnc(Sc2ncc([N+](=O)[O-])cc2F)n1[C@H]1CCC[C@H](C)C1 ZINC000413214796 942489014 /nfs/dbraw/zinc/48/90/14/942489014.db2.gz WQAHINATVBUSTG-ONGXEEELSA-N 0 0 351.407 3.931 20 5 FHBDRN O=C(COc1cccc([N+](=O)[O-])c1)N1CCC[C@@H]1/C=C/c1ccccc1 ZINC000505373372 942492627 /nfs/dbraw/zinc/49/26/27/942492627.db2.gz SCZMEQVPJMFHOI-FMQWLBJXSA-N 0 0 352.390 3.678 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NCc2cc(C3CC3)ccc2F)c1 ZINC000452308208 942494070 /nfs/dbraw/zinc/49/40/70/942494070.db2.gz XXHVYDOXLOKVTH-UHFFFAOYSA-N 0 0 358.369 3.940 20 5 FHBDRN CC(C)Oc1cc(C(=O)NCC[C@@H]2C[C@@H](C)O[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000412331301 942499362 /nfs/dbraw/zinc/49/93/62/942499362.db2.gz NLKKHWPKBGEQRI-QDMKHBRRSA-N 0 0 364.442 3.706 20 5 FHBDRN Cc1ccc(CN(C)C(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000518876309 942503257 /nfs/dbraw/zinc/50/32/57/942503257.db2.gz NQTZHYWAROXIIP-ZDUSSCGKSA-N 0 0 362.813 3.983 20 5 FHBDRN Cc1ccccc1C(C)(C)CNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000505364766 942503934 /nfs/dbraw/zinc/50/39/34/942503934.db2.gz VJSNNKYKEREXIV-UHFFFAOYSA-N 0 0 365.433 3.952 20 5 FHBDRN Cc1cc(N2CCCC2)ccc1N[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000052774371 942505459 /nfs/dbraw/zinc/50/54/59/942505459.db2.gz BJBQPHPTYKMKNC-HNNXBMFYSA-N 0 0 368.437 3.943 20 5 FHBDRN Cc1csc(NC2CCN(c3nccc4ccc([N+](=O)[O-])cc43)CC2)n1 ZINC000413222803 942506638 /nfs/dbraw/zinc/50/66/38/942506638.db2.gz CBHWXIXZCHLUOW-UHFFFAOYSA-N 0 0 369.450 3.989 20 5 FHBDRN COCCN(C(=O)c1ccco1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 ZINC000014790534 942509741 /nfs/dbraw/zinc/50/97/41/942509741.db2.gz NSDZUNBDTVPIJK-UHFFFAOYSA-N 0 0 373.390 3.605 20 5 FHBDRN O=C(Nc1ncccc1O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 ZINC000541238113 942511548 /nfs/dbraw/zinc/51/15/48/942511548.db2.gz UZHQLNRJTIACBS-UHFFFAOYSA-N 0 0 364.361 3.560 20 5 FHBDRN CC(C)(C(=O)NCc1ccc(Cl)cc1F)c1ccccc1[N+](=O)[O-] ZINC000501505730 942515847 /nfs/dbraw/zinc/51/58/47/942515847.db2.gz VMNGYRFQRHGJFV-UHFFFAOYSA-N 0 0 350.777 3.981 20 5 FHBDRN CC(C)(C)OC(=O)[C@H]1CCCN(c2nccc3ccc([N+](=O)[O-])cc32)C1 ZINC000413229704 942517085 /nfs/dbraw/zinc/51/70/85/942517085.db2.gz KNSZDQYLHZTLFR-AWEZNQCLSA-N 0 0 357.410 3.701 20 5 FHBDRN COc1cc(C(=O)OCc2ccc(OCC3CC3)cc2)ccc1[N+](=O)[O-] ZINC001269123857 942523162 /nfs/dbraw/zinc/52/31/62/942523162.db2.gz NTOLYITXJFBQCG-UHFFFAOYSA-N 0 0 357.362 3.749 20 5 FHBDRN Cc1ccccc1C1=CCN(C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)C1 ZINC000501550270 942533616 /nfs/dbraw/zinc/53/36/16/942533616.db2.gz CKIMLIZDMABKSY-UHFFFAOYSA-N 0 0 374.400 3.628 20 5 FHBDRN CCCOc1ccc(OCC(=O)N2CCCc3c([N+](=O)[O-])cccc32)cc1 ZINC000513833425 942548012 /nfs/dbraw/zinc/54/80/12/942548012.db2.gz BZVKVVYFZRNHGM-UHFFFAOYSA-N 0 0 370.405 3.742 20 5 FHBDRN CC(C)c1[nH]nc(C(=O)Nc2cc(Cl)ccc2NC2CC2)c1[N+](=O)[O-] ZINC000434249426 942548851 /nfs/dbraw/zinc/54/88/51/942548851.db2.gz MLUZIQCEQNAIEH-UHFFFAOYSA-N 0 0 363.805 3.921 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)NCC2(Cc3ccccc3)CCC2)c1[N+](=O)[O-] ZINC000434251393 942550097 /nfs/dbraw/zinc/55/00/97/942550097.db2.gz VONAGCZNONXRGO-UHFFFAOYSA-N 0 0 356.426 3.584 20 5 FHBDRN O=C([C@@H]1C[C@]12CCOc1ccccc12)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000513838587 942550383 /nfs/dbraw/zinc/55/03/83/942550383.db2.gz UGTKZFPGOBWMAN-KKSFZXQISA-N 0 0 364.401 3.614 20 5 FHBDRN O=C(CCOc1ccc(Cl)cc1)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000513841290 942552203 /nfs/dbraw/zinc/55/22/03/942552203.db2.gz OREGEXIPUGOVTQ-UHFFFAOYSA-N 0 0 360.797 3.997 20 5 FHBDRN CC[C@@H](Oc1ccccc1F)C(=O)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000513842529 942552759 /nfs/dbraw/zinc/55/27/59/942552759.db2.gz JOQQHWOOFOCIGT-QGZVFWFLSA-N 0 0 358.369 3.871 20 5 FHBDRN CC(C)Oc1ccccc1CC(=O)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000513842592 942552812 /nfs/dbraw/zinc/55/28/12/942552812.db2.gz KZWQFTSXEUKKMU-UHFFFAOYSA-N 0 0 354.406 3.904 20 5 FHBDRN CCO[C@H](C)c1ncc(C(=O)N2CCCc3c([N+](=O)[O-])cccc32)s1 ZINC000513841090 942552838 /nfs/dbraw/zinc/55/28/38/942552838.db2.gz LXDOMLCBELZSCL-LLVKDONJSA-N 0 0 361.423 3.742 20 5 FHBDRN COc1ccc(OC)c([C@@H](C)NC(=O)c2cc([N+](=O)[O-])c(C)cc2C)c1 ZINC000421425209 942553733 /nfs/dbraw/zinc/55/37/33/942553733.db2.gz JNGQPIDYTDTMAX-CYBMUJFWSA-N 0 0 358.394 3.720 20 5 FHBDRN Nc1c(C(=O)N2CC=C(c3cccc4ccccc43)C2)cccc1[N+](=O)[O-] ZINC000501589886 942554918 /nfs/dbraw/zinc/55/49/18/942554918.db2.gz QGGLWINPBFDTSI-UHFFFAOYSA-N 0 0 359.385 3.870 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)C1(c2c(F)cccc2F)CCC1 ZINC000421414192 942561832 /nfs/dbraw/zinc/56/18/32/942561832.db2.gz ALHXRNWEZNMIFM-UHFFFAOYSA-N 0 0 362.332 3.942 20 5 FHBDRN O=C(Nc1cccc2ccsc21)c1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000501602424 942563565 /nfs/dbraw/zinc/56/35/65/942563565.db2.gz BIQFBXZSCKOUGM-UHFFFAOYSA-N 0 0 356.359 3.833 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1C[C@H](c2ccccc2)OC[C@H]1C ZINC000421452691 942564795 /nfs/dbraw/zinc/56/47/95/942564795.db2.gz BKHUNONXRRHYCY-DNVCBOLYSA-N 0 0 354.406 3.814 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@H](C)Cc1ccccc1Cl ZINC000513855582 942565518 /nfs/dbraw/zinc/56/55/18/942565518.db2.gz HQWQJIAANOMRCP-GFCCVEGCSA-N 0 0 362.813 3.752 20 5 FHBDRN CC[C@@H](C)NC(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])c(C)cc2C)cc1 ZINC000421443402 942576760 /nfs/dbraw/zinc/57/67/60/942576760.db2.gz IQKWBDRGNMHHPC-CQSZACIVSA-N 0 0 369.421 3.992 20 5 FHBDRN Cn1c(C(=O)Nc2cccc(OCCc3ccccc3)c2)ccc1[N+](=O)[O-] ZINC000501645883 942579563 /nfs/dbraw/zinc/57/95/63/942579563.db2.gz GAVZVNYJHNFMPA-UHFFFAOYSA-N 0 0 365.389 3.807 20 5 FHBDRN O=[N+]([O-])c1ccc2ccnc(NC[C@]3(CO)C[C@@H]3c3ccc(F)cc3)c2c1 ZINC000413268110 942585409 /nfs/dbraw/zinc/58/54/09/942585409.db2.gz RLRGDEXREPCNMJ-QUCCMNQESA-N 0 0 367.380 3.860 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N[C@H](C)Cc2ccc(C(C)C)cc2)c1[N+](=O)[O-] ZINC000501653380 942587936 /nfs/dbraw/zinc/58/79/36/942587936.db2.gz BJOWPHYYNAARBD-CYBMUJFWSA-N 0 0 358.442 3.926 20 5 FHBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)C1(Oc2ccccc2)CC1 ZINC000421469036 942589084 /nfs/dbraw/zinc/58/90/84/942589084.db2.gz GQDZVXVORRRKKJ-UHFFFAOYSA-N 0 0 354.406 3.645 20 5 FHBDRN Cc1nc(-c2ccccc2)sc1[C@@H](C)NC(=O)c1ccc([N+](=O)[O-])[nH]1 ZINC000501648394 942595239 /nfs/dbraw/zinc/59/52/39/942595239.db2.gz UKXUXTSKIKAGEK-SNVBAGLBSA-N 0 0 356.407 3.846 20 5 FHBDRN COC(=O)c1cc(Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)c(C)s1 ZINC000501681588 942596749 /nfs/dbraw/zinc/59/67/49/942596749.db2.gz VGUUETGEJLLLLD-UHFFFAOYSA-N 0 0 357.391 3.663 20 5 FHBDRN CCOC(=O)CN(C(=O)c1cc([N+](=O)[O-])ccc1C)[C@H](C)c1ccccc1 ZINC000513921953 942597215 /nfs/dbraw/zinc/59/72/15/942597215.db2.gz KCEUTXNOPHGKCI-OAHLLOKOSA-N 0 0 370.405 3.670 20 5 FHBDRN CC(=O)N1CC[C@@H](NC(=O)Nc2cccc([N+](=O)[O-])c2C)c2ccccc21 ZINC000366964088 942599225 /nfs/dbraw/zinc/59/92/25/942599225.db2.gz XOPXJGPCLGKFGL-MRXNPFEDSA-N 0 0 368.393 3.523 20 5 FHBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1CCCC[C@H]1c1ccccc1 ZINC000545899477 942599307 /nfs/dbraw/zinc/59/93/07/942599307.db2.gz PDFSQMLSTBDDLZ-KRWDZBQOSA-N 0 0 360.435 3.819 20 5 FHBDRN CCCCN(C(=O)[C@@H](C)NC(=O)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000434332850 942600256 /nfs/dbraw/zinc/60/02/56/942600256.db2.gz CIUWISMEFNNGLA-OAHLLOKOSA-N 0 0 369.421 3.546 20 5 FHBDRN CCCOc1cccc(CCNC(=O)CSc2ccc([N+](=O)[O-])cc2)c1 ZINC000434333320 942600262 /nfs/dbraw/zinc/60/02/62/942600262.db2.gz JRMNFWRKBLIUQB-UHFFFAOYSA-N 0 0 374.462 3.835 20 5 FHBDRN COC(=O)CCN(C(=O)c1cc([N+](=O)[O-])c(C)cc1C)c1cccc(F)c1 ZINC000421486575 942601775 /nfs/dbraw/zinc/60/17/75/942601775.db2.gz XKZNNOOYYHWQLJ-UHFFFAOYSA-N 0 0 374.368 3.561 20 5 FHBDRN CCN(C(=O)Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1)C1CCCCC1 ZINC000501674022 942604597 /nfs/dbraw/zinc/60/45/97/942604597.db2.gz KYXNRONMLLTLLL-UHFFFAOYSA-N 0 0 356.426 3.640 20 5 FHBDRN CC(C)(CO)CCNC(=O)c1ccccc1Sc1ccccc1[N+](=O)[O-] ZINC000452431493 942606992 /nfs/dbraw/zinc/60/69/92/942606992.db2.gz WWHPXMFNLJMGAO-UHFFFAOYSA-N 0 0 374.462 3.884 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NCCc1nc2c(s1)CCCC2 ZINC000421494683 942607280 /nfs/dbraw/zinc/60/72/80/942607280.db2.gz GLAQKFRYABONRY-UHFFFAOYSA-N 0 0 359.451 3.519 20 5 FHBDRN COc1cc(C)c(NC(=O)Cc2c(F)c(OC)ccc2[N+](=O)[O-])cc1C ZINC000413792217 942609601 /nfs/dbraw/zinc/60/96/01/942609601.db2.gz ZQXSNADMWJLGIE-UHFFFAOYSA-N 0 0 362.357 3.549 20 5 FHBDRN C[C@@H]1c2c(Cl)cc(Cl)cc2CCN1C(=O)c1ccc([N+](=O)[O-])n1C ZINC000434151368 942610791 /nfs/dbraw/zinc/61/07/91/942610791.db2.gz QDCUYAVPJXGLFD-SECBINFHSA-N 0 0 368.220 4.000 20 5 FHBDRN COCC1CCC(NC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)CC1 ZINC000413783200 942612471 /nfs/dbraw/zinc/61/24/71/942612471.db2.gz LXBWVDJJERZAGQ-UHFFFAOYSA-N 0 0 373.356 3.523 20 5 FHBDRN O=[N+]([O-])c1ccc(NCc2cccc(N3CCOCC3)c2)c2cccnc21 ZINC000413291546 942613025 /nfs/dbraw/zinc/61/30/25/942613025.db2.gz DVWLIZOMZSIHHN-UHFFFAOYSA-N 0 0 364.405 3.592 20 5 FHBDRN CC(C)c1nnc(CCNc2ncc([N+](=O)[O-])cc2C(F)(F)F)s1 ZINC000413297115 942615106 /nfs/dbraw/zinc/61/51/06/942615106.db2.gz DZPCGSHTIILMGC-UHFFFAOYSA-N 0 0 361.349 3.638 20 5 FHBDRN C[C@H](Oc1ccccc1NC(=O)c1n[nH]cc1[N+](=O)[O-])c1ccccc1 ZINC000137104217 942616391 /nfs/dbraw/zinc/61/63/91/942616391.db2.gz DOCMHKXSYYUPPF-LBPRGKRZSA-N 0 0 352.350 3.710 20 5 FHBDRN COc1cc(N2CCC(O)(c3ccccc3Cl)CC2)ccc1[N+](=O)[O-] ZINC000302858130 942632189 /nfs/dbraw/zinc/63/21/89/942632189.db2.gz SVPQVMBWRNUOKK-UHFFFAOYSA-N 0 0 362.813 3.745 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCC(F)(c2cccnc2)CC1 ZINC000421536098 942632595 /nfs/dbraw/zinc/63/25/95/942632595.db2.gz CETCZKXTSSSHKO-UHFFFAOYSA-N 0 0 357.385 3.708 20 5 FHBDRN CC[C@H](CC(=O)NCc1ccc(OC)c([N+](=O)[O-])c1)c1ccc(OC)cc1 ZINC000501722817 942633167 /nfs/dbraw/zinc/63/31/67/942633167.db2.gz WILHGDVCLCKHPO-OAHLLOKOSA-N 0 0 372.421 3.812 20 5 FHBDRN Cc1ccc(NC(=O)N(C)C[C@H]2OCCc3ccccc32)cc1[N+](=O)[O-] ZINC000513955048 942633358 /nfs/dbraw/zinc/63/33/58/942633358.db2.gz STBUJWHYAFVTJZ-GOSISDBHSA-N 0 0 355.394 3.681 20 5 FHBDRN COC(=O)c1cc(NC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)c(C)cc1C ZINC000472968951 942636997 /nfs/dbraw/zinc/63/69/97/942636997.db2.gz XHIVYAPWVCKAEG-UHFFFAOYSA-N 0 0 367.361 3.732 20 5 FHBDRN O=[N+]([O-])c1cnc(NC[C@@]2(CO)C[C@H]2c2ccccc2)c(C(F)(F)F)c1 ZINC000413309258 942642534 /nfs/dbraw/zinc/64/25/34/942642534.db2.gz LHJWAHQHQITGJG-GOEBONIOSA-N 0 0 367.327 3.587 20 5 FHBDRN O=[N+]([O-])c1ccc2ccnc(N[C@@H]3CCO[C@H](c4ccncc4)C3)c2c1 ZINC000413309532 942642765 /nfs/dbraw/zinc/64/27/65/942642765.db2.gz BORTWIIMIZWTIJ-QAPCUYQASA-N 0 0 350.378 3.870 20 5 FHBDRN Cc1c2ccc(NC(=O)c3ccc([N+](=O)[O-])c(OC(C)C)c3)cc2nn1C ZINC000413814130 942645123 /nfs/dbraw/zinc/64/51/23/942645123.db2.gz FBYQVVHNFFDGSK-UHFFFAOYSA-N 0 0 368.393 3.829 20 5 FHBDRN Cn1cc(C(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)c(C2CCC2)n1 ZINC000413830237 942650172 /nfs/dbraw/zinc/65/01/72/942650172.db2.gz FERVWXBSQHLUHK-MRXNPFEDSA-N 0 0 368.437 3.616 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)Nc2cc3n[nH]cc3c(C)c2)cc1SC ZINC000501750036 942650926 /nfs/dbraw/zinc/65/09/26/942650926.db2.gz WXLFEYBHFSNXGS-UHFFFAOYSA-N 0 0 372.406 3.762 20 5 FHBDRN CCCn1nccc1C1CCN(C(=O)c2cc([N+](=O)[O-])c(C)cc2C)CC1 ZINC000421546944 942651672 /nfs/dbraw/zinc/65/16/72/942651672.db2.gz WBFJJTCLLBHDAD-UHFFFAOYSA-N 0 0 370.453 3.838 20 5 FHBDRN C[C@H]1[C@@H](C)N(C(=O)c2cccc3c(=O)c4cccc(F)c4[nH]c23)C[C@H]1C ZINC000416322427 942656425 /nfs/dbraw/zinc/65/64/25/942656425.db2.gz MVMPCQAOPXYNEU-JHJVBQTASA-N 0 0 352.409 3.937 20 5 FHBDRN O=[N+]([O-])c1cnc(N[C@@H](CCO)c2cccc(C(F)(F)F)c2)c(F)c1 ZINC000413316621 942656713 /nfs/dbraw/zinc/65/67/13/942656713.db2.gz PWKVEIWWKONSHB-ZDUSSCGKSA-N 0 0 359.279 3.683 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CC[C@H](c3cccc(Br)c3)C2)c(F)c1 ZINC000413318612 942657540 /nfs/dbraw/zinc/65/75/40/942657540.db2.gz NRIHIWGIVDZUHZ-NSHDSACASA-N 0 0 366.190 3.885 20 5 FHBDRN Cc1cc(CNC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc(C)n1 ZINC000421576392 942668123 /nfs/dbraw/zinc/66/81/23/942668123.db2.gz MEUWSKHMWGSDKX-UHFFFAOYSA-N 0 0 353.300 3.555 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H]1CC12CCSCC2 ZINC000421586258 942673521 /nfs/dbraw/zinc/67/35/21/942673521.db2.gz FJCABOGTDMQRAV-STQMWFEESA-N 0 0 366.508 3.725 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H]1CC12CCSCC2 ZINC000421586255 942673596 /nfs/dbraw/zinc/67/35/96/942673596.db2.gz FJCABOGTDMQRAV-CHWSQXEVSA-N 0 0 366.508 3.725 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H]1CC12CCSCC2 ZINC000421587213 942674815 /nfs/dbraw/zinc/67/48/15/942674815.db2.gz HIHOPGDDKUJBHE-JKSUJKDBSA-N 0 0 362.495 3.813 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H]1CC12CCSCC2 ZINC000421587207 942674865 /nfs/dbraw/zinc/67/48/65/942674865.db2.gz HIHOPGDDKUJBHE-CVEARBPZSA-N 0 0 362.495 3.813 20 5 FHBDRN CCN(C(=O)Cc1c(F)c(OC)ccc1[N+](=O)[O-])[C@@H]1CCCC[C@@H]1C ZINC000413335682 942684841 /nfs/dbraw/zinc/68/48/41/942684841.db2.gz LVRDQBQBLVIQKY-GXTWGEPZSA-N 0 0 352.406 3.712 20 5 FHBDRN O=[N+]([O-])c1ccc2nc(N[C@@H]3CCO[C@@H](c4cccs4)C3)ccc2c1 ZINC000413350742 942684910 /nfs/dbraw/zinc/68/49/10/942684910.db2.gz KIYLTLJGRIKEFA-CZUORRHYSA-N 0 0 355.419 3.959 20 5 FHBDRN O=C(N[C@H](c1c(F)cccc1F)C(F)(F)F)c1ccc([N+](=O)[O-])cc1 ZINC000505424391 942697102 /nfs/dbraw/zinc/69/71/02/942697102.db2.gz ZDBAJHZCHPCSIT-CYBMUJFWSA-N 0 0 360.238 3.906 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(Cc2noc([C@@H]3C[C@@]3(F)c3ccccc3)n2)c1 ZINC000420491071 942697254 /nfs/dbraw/zinc/69/72/54/942697254.db2.gz DQVQALZHQQBAOJ-HNAYVOBHSA-N 0 0 369.352 3.930 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1C[S@@](C)=O ZINC000183619693 942698078 /nfs/dbraw/zinc/69/80/78/942698078.db2.gz SMHWOESYOTZYTO-QWXGXRTQSA-N 0 0 374.462 3.681 20 5 FHBDRN O=[N+]([O-])c1c(-c2nc([C@H]3CCCOC3)no2)ccnc1-c1ccccc1 ZINC000420496547 942703076 /nfs/dbraw/zinc/70/30/76/942703076.db2.gz WLGFNNFPUFERGJ-ZDUSSCGKSA-N 0 0 352.350 3.601 20 5 FHBDRN O=C(/C=C/c1ccc([N+](=O)[O-])cc1)N[C@@H](c1ccccc1)[C@H]1CCOC1 ZINC000378394616 942703607 /nfs/dbraw/zinc/70/36/07/942703607.db2.gz YJVZFMJCHHJPMY-GZVGFQSESA-N 0 0 352.390 3.502 20 5 FHBDRN O=C(NCCOCc1ccc(Cl)cc1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000514045341 942703646 /nfs/dbraw/zinc/70/36/46/942703646.db2.gz YTPUVWAKOZCXEK-UHFFFAOYSA-N 0 0 369.204 3.848 20 5 FHBDRN COc1ccc(C(=O)N2CCC[C@]2(C)Cc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000421621874 942706144 /nfs/dbraw/zinc/70/61/44/942706144.db2.gz YAQZQJUGWIYIOG-HXUWFJFHSA-N 0 0 372.396 3.980 20 5 FHBDRN CC[C@](C)(OC)c1noc(-c2ccnc(-c3ccccc3)c2[N+](=O)[O-])n1 ZINC000420498437 942706303 /nfs/dbraw/zinc/70/63/03/942706303.db2.gz BJORQUVYIOSQCM-SFHVURJKSA-N 0 0 354.366 3.978 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)N[C@H]1C[C@H](c2ccc(F)cc2)C1 ZINC000431864954 942707247 /nfs/dbraw/zinc/70/72/47/942707247.db2.gz MDAKEVBNVZUUBW-JCNLHEQBSA-N 0 0 357.385 3.522 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)Nc1nc2c(s1)CCC2(C)C ZINC000421632963 942709922 /nfs/dbraw/zinc/70/99/22/942709922.db2.gz SVSSUGYLOIVLLV-UHFFFAOYSA-N 0 0 361.423 3.926 20 5 FHBDRN Cc1nc([C@H]2CCCCCN2C(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)no1 ZINC000501842491 942710086 /nfs/dbraw/zinc/71/00/86/942710086.db2.gz OZYPCEZJQWEHQH-OAHLLOKOSA-N 0 0 369.381 3.525 20 5 FHBDRN Cc1sc(C(=O)N2C[C@H](C(=O)OC(C)(C)C)CC[C@@H]2C)cc1[N+](=O)[O-] ZINC000421634371 942712580 /nfs/dbraw/zinc/71/25/80/942712580.db2.gz PKTXUAHRYWIIIO-CMPLNLGQSA-N 0 0 368.455 3.547 20 5 FHBDRN Cn1cc([N+](=O)[O-])c(-c2nc([C@@H]3CCC(C)(C)c4ccccc43)no2)n1 ZINC000420512876 942716349 /nfs/dbraw/zinc/71/63/49/942716349.db2.gz YLKAAZGFDXMIFF-GFCCVEGCSA-N 0 0 353.382 3.582 20 5 FHBDRN CN(C(=O)CN1CCC(F)(c2ccccc2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000434503121 942728645 /nfs/dbraw/zinc/72/86/45/942728645.db2.gz MXNSAWGLDFFUET-UHFFFAOYSA-N 0 0 371.412 3.518 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])N1CCCc2cccc(Cl)c21 ZINC000502770721 942729527 /nfs/dbraw/zinc/72/95/27/942729527.db2.gz PTASZDRUHSOTBL-UHFFFAOYSA-N 0 0 360.797 3.997 20 5 FHBDRN O=[N+]([O-])c1cccc2ncnc(N3Cc4cccc(Br)c4C3)c21 ZINC000613704887 942755095 /nfs/dbraw/zinc/75/50/95/942755095.db2.gz UDROLFMOWGXUNY-UHFFFAOYSA-N 0 0 371.194 3.821 20 5 FHBDRN O=C(NCc1csc(CCc2ccccc2)n1)c1cccc([N+](=O)[O-])c1 ZINC000434564025 942769525 /nfs/dbraw/zinc/76/95/25/942769525.db2.gz ILXKJIFCPMLFOL-UHFFFAOYSA-N 0 0 367.430 3.767 20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])N[C@H](CC(F)F)c1ccccc1 ZINC000421698320 942771466 /nfs/dbraw/zinc/77/14/66/942771466.db2.gz IYVQFFIPTIAXNK-OAHLLOKOSA-N 0 0 363.364 3.910 20 5 FHBDRN CC(C)N(Cc1ccco1)C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514147469 942773130 /nfs/dbraw/zinc/77/31/30/942773130.db2.gz LYAFUZZPMBMECP-UHFFFAOYSA-N 0 0 354.309 3.840 20 5 FHBDRN Cc1cc(C(=O)N(C)c2ccc(C(=O)NC(C)(C)C)cc2)ccc1[N+](=O)[O-] ZINC000413918757 942777758 /nfs/dbraw/zinc/77/77/58/942777758.db2.gz FBJMQTICYBNDQI-UHFFFAOYSA-N 0 0 369.421 3.708 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1OC(=O)c1cc(Br)cnc1Cl ZINC000760016360 942782593 /nfs/dbraw/zinc/78/25/93/942782593.db2.gz LOHUPKUSTPXNSP-UHFFFAOYSA-N 0 0 371.574 3.933 20 5 FHBDRN CC[C@@H](NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)c1nccs1 ZINC000514181237 942791214 /nfs/dbraw/zinc/79/12/14/942791214.db2.gz ZVLQRYHPNXKSCT-SECBINFHSA-N 0 0 357.338 3.534 20 5 FHBDRN CCc1ccc(C(=O)N2CC[C@@H](O)[C@H]2c2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000425105892 942799047 /nfs/dbraw/zinc/79/90/47/942799047.db2.gz IRGBZNVLYZDZFP-QZTJIDSGSA-N 0 0 374.824 3.759 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)NCC1(c2c(F)cccc2F)CCC1 ZINC000413942854 942812370 /nfs/dbraw/zinc/81/23/70/942812370.db2.gz HMZGUEFYVRRTBJ-UHFFFAOYSA-N 0 0 360.360 3.654 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CC[C@@H](O)[C@H]1c1ccc(Cl)cc1 ZINC000425111252 942813036 /nfs/dbraw/zinc/81/30/36/942813036.db2.gz XISWUGTXZMTDMW-QZTJIDSGSA-N 0 0 374.824 3.813 20 5 FHBDRN CCOc1cc(CS(=O)(=O)Cc2cc(C)cc(C)c2)ccc1[N+](=O)[O-] ZINC000434641836 942819689 /nfs/dbraw/zinc/81/96/89/942819689.db2.gz ZTDQSXJLHNZCKS-UHFFFAOYSA-N 0 0 363.435 3.725 20 5 FHBDRN O=C(Nc1cccc2ccsc21)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000502894072 942823081 /nfs/dbraw/zinc/82/30/81/942823081.db2.gz KLCOFZOJSVYITL-UHFFFAOYSA-N 0 0 365.374 3.643 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCC(Cc2cccnc2)CC1 ZINC000421794163 942829533 /nfs/dbraw/zinc/82/95/33/942829533.db2.gz ADJJTZSEEZLIES-UHFFFAOYSA-N 0 0 353.422 3.702 20 5 FHBDRN O=[N+]([O-])c1cc(F)c(CSc2nnc(-c3ccncc3)o2)c(F)c1 ZINC000505456288 942831530 /nfs/dbraw/zinc/83/15/30/942831530.db2.gz YBKJDKCGORTNFL-UHFFFAOYSA-N 0 0 350.306 3.610 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]c(CN[C@@H](c3cc(F)ccc3F)C(F)F)nc2c1 ZINC000434680117 942850244 /nfs/dbraw/zinc/85/02/44/942850244.db2.gz HHJXORWAMTWGEB-HNNXBMFYSA-N 0 0 368.290 3.845 20 5 FHBDRN COc1ccc(OCc2nnc(-c3cccc(Cl)c3)o2)cc1[N+](=O)[O-] ZINC000190196520 942853317 /nfs/dbraw/zinc/85/33/17/942853317.db2.gz CZJRAFMGCRSHQU-UHFFFAOYSA-N 0 0 361.741 3.886 20 5 FHBDRN COc1ccc(OCc2cccc(C(=O)N3CCCCC3)c2)cc1[N+](=O)[O-] ZINC000190195725 942853572 /nfs/dbraw/zinc/85/35/72/942853572.db2.gz HAFPHAYJDITRGO-UHFFFAOYSA-N 0 0 370.405 3.809 20 5 FHBDRN C[C@@H](O)[C@@H]1CCCCN1C(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000181611207 942857162 /nfs/dbraw/zinc/85/71/62/942857162.db2.gz JINPAYRYIMKTPP-KDOFPFPSSA-N 0 0 369.421 3.714 20 5 FHBDRN Cc1cc([C@H](C)NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)c(C)o1 ZINC000514245879 942860774 /nfs/dbraw/zinc/86/07/74/942860774.db2.gz DOOMTAKSRNRWRC-VIFPVBQESA-N 0 0 354.309 3.897 20 5 FHBDRN CCCn1ccnc1CCCN(C)C(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC000421886841 942865688 /nfs/dbraw/zinc/86/56/88/942865688.db2.gz HGWAWCGJGUIUCZ-UHFFFAOYSA-N 0 0 358.442 3.523 20 5 FHBDRN CCc1ccc(NC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)cc1F ZINC000502952776 942866249 /nfs/dbraw/zinc/86/62/49/942866249.db2.gz ODNWTRYDDBKIJI-UHFFFAOYSA-N 0 0 354.341 3.734 20 5 FHBDRN C[C@@H](CNC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-])CC(F)(F)F ZINC000413989642 942869169 /nfs/dbraw/zinc/86/91/69/942869169.db2.gz OLLCSNMBYSZLPO-SECBINFHSA-N 0 0 368.739 3.722 20 5 FHBDRN CC(C)OCC(C)(C)NC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000413994831 942874788 /nfs/dbraw/zinc/87/47/88/942874788.db2.gz YTGBJBZMGXIVNE-UHFFFAOYSA-N 0 0 360.863 3.660 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)Nc2cc(C)c3nccn3c2)cc1SC ZINC000502959581 942877376 /nfs/dbraw/zinc/87/73/76/942877376.db2.gz LKPPFSCFUWAZFC-UHFFFAOYSA-N 0 0 372.406 3.534 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N(CC(C)=O)CC(C)C ZINC000421910344 942881774 /nfs/dbraw/zinc/88/17/74/942881774.db2.gz YBWFMQWVRCGUBY-UHFFFAOYSA-N 0 0 352.456 3.784 20 5 FHBDRN O=C(Cc1cccc([N+](=O)[O-])c1)N[C@@H]1CCCc2cn(C3CCCC3)nc21 ZINC000378552973 942883886 /nfs/dbraw/zinc/88/38/86/942883886.db2.gz NSOROAPIVMFWHX-GOSISDBHSA-N 0 0 368.437 3.643 20 5 FHBDRN CC(C)(CNc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2)Oc1ccccc1 ZINC000513761271 942886691 /nfs/dbraw/zinc/88/66/91/942886691.db2.gz SQRNIVOIVYMLHD-UHFFFAOYSA-N 0 0 355.394 3.749 20 5 FHBDRN O=C(NC[C@@H]1C[C@H]1c1ccccc1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000509981036 942891920 /nfs/dbraw/zinc/89/19/20/942891920.db2.gz DZZFAKSDOIKXBN-RDJZCZTQSA-N 0 0 351.406 3.703 20 5 FHBDRN CCN(CCc1ccc(C(F)(F)F)cc1)C(=O)c1ccc([N+](=O)[O-])[nH]1 ZINC000425158492 942894342 /nfs/dbraw/zinc/89/43/42/942894342.db2.gz JCHZBNQPYMUPEB-UHFFFAOYSA-N 0 0 355.316 3.647 20 5 FHBDRN COc1cc(C(=O)N2CCC[C@@H](CC(F)(F)F)C2)c([N+](=O)[O-])cc1F ZINC000421965418 942896864 /nfs/dbraw/zinc/89/68/64/942896864.db2.gz OHOALASHHBIQQS-VIFPVBQESA-N 0 0 364.295 3.547 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])c2cccnc12)N1CC[C@@H](C2CCCC2)C1 ZINC000421942164 942897338 /nfs/dbraw/zinc/89/73/38/942897338.db2.gz CFHPSRRSJPDPRL-OAHLLOKOSA-N 0 0 369.421 3.561 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CCC[C@@H](CC(F)(F)F)C1 ZINC000421958985 942908593 /nfs/dbraw/zinc/90/85/93/942908593.db2.gz JPRLDNFXAZOGTN-NSHDSACASA-N 0 0 369.343 3.810 20 5 FHBDRN O=c1[nH]cnc2cc(N3CCC[C@@H](c4ccccc4)CC3)c([N+](=O)[O-])cc12 ZINC000066818530 942913187 /nfs/dbraw/zinc/91/31/87/942913187.db2.gz WBGBGLLRHRYYFQ-OAHLLOKOSA-N 0 0 364.405 3.605 20 5 FHBDRN O=C(c1c[nH]c2cccc([N+](=O)[O-])c12)N1CCC[C@@H](CC(F)(F)F)C1 ZINC000421977939 942914546 /nfs/dbraw/zinc/91/45/46/942914546.db2.gz YFVSSYVUEAELBT-JTQLQIEISA-N 0 0 355.316 3.881 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)ccc1CNCc1cccnc1OCC(F)F ZINC000893254923 942916235 /nfs/dbraw/zinc/91/62/35/942916235.db2.gz DTCPEURUBBLPFT-UHFFFAOYSA-N 0 0 357.744 3.577 20 5 FHBDRN O=c1[nH]cnc2cc(NCC3(c4ccc(Cl)cc4)CC3)c([N+](=O)[O-])cc12 ZINC000066818438 942923565 /nfs/dbraw/zinc/92/35/65/942923565.db2.gz PXPNKZMPICOXNG-UHFFFAOYSA-N 0 0 370.796 3.628 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCC[C@H]2c2cccc3c2OCCO3)c([N+](=O)[O-])c1 ZINC000066818767 942925981 /nfs/dbraw/zinc/92/59/81/942925981.db2.gz OAVDBFWDRKSNRA-AWEZNQCLSA-N 0 0 371.349 3.616 20 5 FHBDRN COc1cc(CSc2nnnn2C2CCCCC2)c([N+](=O)[O-])cc1F ZINC000183844420 942927033 /nfs/dbraw/zinc/92/70/33/942927033.db2.gz QZXYZMUUKHXBMR-UHFFFAOYSA-N 0 0 367.406 3.527 20 5 FHBDRN CC[C@@H]1C[C@H](NC(=O)c2cccc3c(=O)c4cccc(F)c4[nH]c23)CCO1 ZINC000421993427 942927448 /nfs/dbraw/zinc/92/74/48/942927448.db2.gz RULAASGYZDMZFE-CHWSQXEVSA-N 0 0 368.408 3.508 20 5 FHBDRN O=C(c1cc(Cl)ccc1[N+](=O)[O-])N1CC[C@H](n2ncc3ccccc32)C1 ZINC000378592112 942932956 /nfs/dbraw/zinc/93/29/56/942932956.db2.gz RIZLNAQXMDZZDJ-AWEZNQCLSA-N 0 0 370.796 3.685 20 5 FHBDRN Cc1cc(F)c([N+](=O)[O-])cc1C(=O)N[C@H]1CCO[C@@H](c2ccccc2)C1 ZINC001269854055 942935185 /nfs/dbraw/zinc/93/51/85/942935185.db2.gz NOJQJFQIEUEPSS-KBXCAEBGSA-N 0 0 358.369 3.692 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N(C)CCc2cccc3ccccc32)c1[N+](=O)[O-] ZINC000434183851 942940945 /nfs/dbraw/zinc/94/09/45/942940945.db2.gz PJOBJISSJDMIHA-UHFFFAOYSA-N 0 0 366.421 3.909 20 5 FHBDRN COc1cc(C(=O)N2C[C@@H](C)C[C@@H]2c2cccnc2)cc([N+](=O)[O-])c1C ZINC000190218143 942941121 /nfs/dbraw/zinc/94/11/21/942941121.db2.gz VIOQDVVAMXZREO-YVEFUNNKSA-N 0 0 355.394 3.530 20 5 FHBDRN Cc1cc(C)cc(CN(C)S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000434781325 942960179 /nfs/dbraw/zinc/96/01/79/942960179.db2.gz DWLXKCVPRMEDLF-UHFFFAOYSA-N 0 0 368.842 3.686 20 5 FHBDRN Cn1cc([N+](=O)[O-])c(C(=O)N(Cc2ccccc2Cl)C2CCCC2)n1 ZINC000503105468 942977091 /nfs/dbraw/zinc/97/70/91/942977091.db2.gz IMLFHEOHMGBCOX-UHFFFAOYSA-N 0 0 362.817 3.567 20 5 FHBDRN O=[N+]([O-])C[C@H](Oc1ccc(Br)c(C(F)(F)F)c1)C1CC1 ZINC001225651483 942998825 /nfs/dbraw/zinc/99/88/25/942998825.db2.gz XVAIZFRHOHOWKF-NSHDSACASA-N 0 0 354.122 3.902 20 5 FHBDRN O=C(NCCCO[C@H]1CCCc2ccccc21)c1cc(F)cc([N+](=O)[O-])c1 ZINC000505550087 943014698 /nfs/dbraw/zinc/01/46/98/943014698.db2.gz IWIXPVMXMHLUMB-IBGZPJMESA-N 0 0 372.396 3.948 20 5 FHBDRN O=C(CCC(=O)N1CC(c2cccc(Cl)c2)C1)c1cccc([N+](=O)[O-])c1 ZINC000412390662 943022885 /nfs/dbraw/zinc/02/28/85/943022885.db2.gz WOAXLMQFJPXCFE-UHFFFAOYSA-N 0 0 372.808 3.837 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)N[C@H]1C[C@H]1c1ccccc1C(F)(F)F ZINC000505559314 943028444 /nfs/dbraw/zinc/02/84/44/943028444.db2.gz VFVNVVVMDQCJFS-HOCLYGCPSA-N 0 0 364.323 3.828 20 5 FHBDRN C[C@@H](NS(=O)(=O)Cc1ccccc1[N+](=O)[O-])c1ccc(C2CC2)cc1 ZINC000416672432 943034424 /nfs/dbraw/zinc/03/44/24/943034424.db2.gz YQQSOUNTLXQZOS-CYBMUJFWSA-N 0 0 360.435 3.653 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)N2CCC(OC3CCC3)CC2)cc1[N+](=O)[O-] ZINC000416701550 943043648 /nfs/dbraw/zinc/04/36/48/943043648.db2.gz YQEOYEHHBYUHEH-CQSZACIVSA-N 0 0 361.442 3.707 20 5 FHBDRN COc1ccc(C)cc1-c1csc(NC(=O)c2ccc([N+](=O)[O-])n2C)n1 ZINC000514486086 943047372 /nfs/dbraw/zinc/04/73/72/943047372.db2.gz KSQXXNNFDLXLBO-UHFFFAOYSA-N 0 0 372.406 3.626 20 5 FHBDRN C[C@@H](NC(=O)c1ccccc1[N+](=O)[O-])c1ccc(OC(F)(F)F)cc1 ZINC000505568610 943049026 /nfs/dbraw/zinc/04/90/26/943049026.db2.gz LRSQOMIPTBMEIT-SNVBAGLBSA-N 0 0 354.284 3.984 20 5 FHBDRN O=C(N[C@@H]1CCO[C@@H](c2cccs2)C1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412398061 943050708 /nfs/dbraw/zinc/05/07/08/943050708.db2.gz WUYOYOYGQMJVCR-XLNGHYISSA-N 0 0 372.446 3.796 20 5 FHBDRN O=C(CCC(=O)N1CC(c2ccc(Cl)cc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000412398055 943051133 /nfs/dbraw/zinc/05/11/33/943051133.db2.gz KNLSZYSKUVDUTG-UHFFFAOYSA-N 0 0 372.808 3.837 20 5 FHBDRN Cc1cc(NC(=O)c2cc([N+](=O)[O-])cnc2C)cnc1N1CCCC[C@@H]1C ZINC000503206125 943059068 /nfs/dbraw/zinc/05/90/68/943059068.db2.gz DSNZVZWZPBDOOF-ZDUSSCGKSA-N 0 0 369.425 3.633 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])s1)N1CC(c2cccc(C(F)(F)F)c2)C1 ZINC000412401720 943060959 /nfs/dbraw/zinc/06/09/59/943060959.db2.gz XZYUPMZHMZPQAS-UHFFFAOYSA-N 0 0 356.325 3.915 20 5 FHBDRN COc1ccc([C@@H](C)NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)cc1 ZINC000514495154 943062689 /nfs/dbraw/zinc/06/26/89/943062689.db2.gz CZOMSHUIBBWLGA-GFCCVEGCSA-N 0 0 355.394 3.669 20 5 FHBDRN Cc1sc(NC(=O)[C@H]2CCCOCC2)nc1-c1cccc([N+](=O)[O-])c1 ZINC000365837622 943064807 /nfs/dbraw/zinc/06/48/07/943064807.db2.gz WNMDGQNCFFADPA-LBPRGKRZSA-N 0 0 361.423 3.782 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC[C@@H]1COc1cccnc1C ZINC000416729900 943065756 /nfs/dbraw/zinc/06/57/56/943065756.db2.gz MZOOOUFOQFHUNJ-MRXNPFEDSA-N 0 0 370.409 3.682 20 5 FHBDRN C[C@@H](c1cccc(Nc2ncc(Cl)cc2[N+](=O)[O-])c1)N1CCOCC1 ZINC000434945714 943066500 /nfs/dbraw/zinc/06/65/00/943066500.db2.gz FPKAARYKMUOLID-LBPRGKRZSA-N 0 0 362.817 3.780 20 5 FHBDRN CCOc1ccc(C(=O)Nc2ccnn2-c2cccc(F)c2)cc1[N+](=O)[O-] ZINC000183908892 943086438 /nfs/dbraw/zinc/08/64/38/943086438.db2.gz HCJCTYNLHTWQLJ-UHFFFAOYSA-N 0 0 370.340 3.571 20 5 FHBDRN CC[C@@H](c1ccccc1)N(CC)C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000514535291 943091846 /nfs/dbraw/zinc/09/18/46/943091846.db2.gz PZRMNEGLTPNPHO-HNNXBMFYSA-N 0 0 356.378 3.937 20 5 FHBDRN Cc1ccc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)cc1C(=O)N(C)C ZINC000434193365 943120073 /nfs/dbraw/zinc/12/00/73/943120073.db2.gz JBVINVDBGZFPHM-UHFFFAOYSA-N 0 0 367.361 3.604 20 5 FHBDRN C[C@@H](Oc1cccc(Cl)c1)C(=O)N1CCCc2ccc([N+](=O)[O-])cc21 ZINC000509966515 943154548 /nfs/dbraw/zinc/15/45/48/943154548.db2.gz GWIZEAJOHDFSIQ-GFCCVEGCSA-N 0 0 360.797 3.995 20 5 FHBDRN Cc1cc(C(=O)NCc2sccc2Br)ccc1[N+](=O)[O-] ZINC000058766913 943156047 /nfs/dbraw/zinc/15/60/47/943156047.db2.gz XLMZQKJNQGGKML-UHFFFAOYSA-N 0 0 355.213 3.657 20 5 FHBDRN CC(C)Oc1cc(C(=O)NC2CCC(C(F)F)CC2)ccc1[N+](=O)[O-] ZINC000412425210 943164988 /nfs/dbraw/zinc/16/49/88/943164988.db2.gz WUGOCXNSYYGXEJ-UHFFFAOYSA-N 0 0 356.369 3.936 20 5 FHBDRN Cc1ccc2nc(CNc3cc(C(F)(F)F)ncc3[N+](=O)[O-])cn2c1 ZINC000514639222 943170282 /nfs/dbraw/zinc/17/02/82/943170282.db2.gz VIEDWBZTNYGWFJ-UHFFFAOYSA-N 0 0 351.288 3.577 20 5 FHBDRN COC(=O)c1ccc(OC(=O)C[C@@H]2CCCc3ccccc32)cc1[N+](=O)[O-] ZINC001267794377 943182889 /nfs/dbraw/zinc/18/28/89/943182889.db2.gz IUPNEQAPTARYPW-AWEZNQCLSA-N 0 0 369.373 3.797 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])c2cccnc12)N1C[C@H]2CCC(=O)c3cccc1c32 ZINC000183801196 943186748 /nfs/dbraw/zinc/18/67/48/943186748.db2.gz VVSTZTKPSBYLHW-GFCCVEGCSA-N 0 0 373.368 3.864 20 5 FHBDRN O=C(CCC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1)c1cccc(F)c1 ZINC000503451765 943189239 /nfs/dbraw/zinc/18/92/39/943189239.db2.gz LOLMGJOTWISYFJ-UHFFFAOYSA-N 0 0 370.380 3.888 20 5 FHBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)NC2(c3ccccc3)CCCC2)cc1 ZINC000503446380 943195579 /nfs/dbraw/zinc/19/55/79/943195579.db2.gz GZTNHDRAJFQVJD-UHFFFAOYSA-N 0 0 374.462 3.526 20 5 FHBDRN CCOC(=O)C[C@@](C)(NC(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1)C(C)C ZINC001269911325 943195941 /nfs/dbraw/zinc/19/59/41/943195941.db2.gz FDBKMXRAKVXPRK-LJQANCHMSA-N 0 0 364.442 3.816 20 5 FHBDRN COC(=O)c1ccc(OC(=O)c2ccc(-c3ccccc3)o2)cc1[N+](=O)[O-] ZINC001267795728 943200272 /nfs/dbraw/zinc/20/02/72/943200272.db2.gz RDLCFZYSMCJOAZ-UHFFFAOYSA-N 0 0 367.313 3.861 20 5 FHBDRN Cc1cccc(C(=O)NCc2ccnc(OC3CCCCC3)c2)c1[N+](=O)[O-] ZINC000503458532 943205843 /nfs/dbraw/zinc/20/58/43/943205843.db2.gz BVZNWMKCWCCHAC-UHFFFAOYSA-N 0 0 369.421 3.940 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)cnc1N1CC[C@@H](O)[C@H]1c1ccc(Cl)cc1 ZINC000425289957 943216713 /nfs/dbraw/zinc/21/67/13/943216713.db2.gz ZWQQNRZZNBKSDE-ZIAGYGMSSA-N 0 0 354.193 3.609 20 5 FHBDRN Cc1c(NC(=O)N2CC[C@@]3(C2)OCc2ccccc23)cccc1[N+](=O)[O-] ZINC000183940575 943217338 /nfs/dbraw/zinc/21/73/38/943217338.db2.gz VVFWJZVSFNYCPN-IBGZPJMESA-N 0 0 353.378 3.567 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)/C=C\Sc1ccccc1 ZINC000214970467 943218518 /nfs/dbraw/zinc/21/85/18/943218518.db2.gz WFIUWYBZCOTEOW-KHPPLWFESA-N 0 0 372.402 3.691 20 5 FHBDRN C[C@@H]1[C@@H](C(=O)Nc2cc3c(cc2[N+](=O)[O-])OCCCO3)[C@H]1c1ccccc1 ZINC000430125985 943221188 /nfs/dbraw/zinc/22/11/88/943221188.db2.gz UZERUGBXZSMZIW-GESALYCCSA-N 0 0 368.389 3.744 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1C[C@H](O)C[C@@H]1c1ccccc1 ZINC000416914460 943222691 /nfs/dbraw/zinc/22/26/91/943222691.db2.gz GXMSFDJVOXNWCI-NVXWUHKLSA-N 0 0 355.394 3.551 20 5 FHBDRN C[C@@H]1CCC[C@H](C)N(C(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000514700152 943231404 /nfs/dbraw/zinc/23/14/04/943231404.db2.gz UQYRBZJWYIEBMW-KGLIPLIRSA-N 0 0 358.442 3.839 20 5 FHBDRN CC(C)(C(=O)NCCCSc1ccccn1)c1ccc([N+](=O)[O-])cc1 ZINC000425299717 943236693 /nfs/dbraw/zinc/23/66/93/943236693.db2.gz SPGGSXJXARMWOY-UHFFFAOYSA-N 0 0 359.451 3.566 20 5 FHBDRN O=[N+]([O-])c1ccc(CNc2ccnc3ccc(Br)cc32)cc1 ZINC000503542484 943238462 /nfs/dbraw/zinc/23/84/62/943238462.db2.gz XAXPYAJLMQGJHI-UHFFFAOYSA-N 0 0 358.195 3.940 20 5 FHBDRN CC1(C)CCC[C@H](NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3F)n2)C1 ZINC001269388832 943249217 /nfs/dbraw/zinc/24/92/17/943249217.db2.gz ARFBDCUFTSQWIQ-LBPRGKRZSA-N 0 0 360.389 3.618 20 5 FHBDRN O=c1[nH]c2ccc(CNc3ccc([N+](=O)[O-])cc3Br)cc2[nH]1 ZINC000503569194 943266563 /nfs/dbraw/zinc/26/65/63/943266563.db2.gz OORPHFIRFSLAAF-UHFFFAOYSA-N 0 0 363.171 3.551 20 5 FHBDRN CC[C@]1(C)CN(C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CCO1 ZINC000190239322 943268498 /nfs/dbraw/zinc/26/84/98/943268498.db2.gz ILWJPNFORTVACD-CQSZACIVSA-N 0 0 361.320 3.646 20 5 FHBDRN COC1([C@@H](C)NC(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CCC1 ZINC000416980799 943272523 /nfs/dbraw/zinc/27/25/23/943272523.db2.gz GFZGBICAIYLUJY-SECBINFHSA-N 0 0 361.320 3.693 20 5 FHBDRN CC(C)(C(=O)NCCCSc1ccccn1)c1ccccc1[N+](=O)[O-] ZINC000425311432 943278455 /nfs/dbraw/zinc/27/84/55/943278455.db2.gz ZERGMEIEJZGTNK-UHFFFAOYSA-N 0 0 359.451 3.566 20 5 FHBDRN Cc1cc(NCc2cc(Br)cc3c2OCC3)ncc1[N+](=O)[O-] ZINC000302149436 943280682 /nfs/dbraw/zinc/28/06/82/943280682.db2.gz KWRGESIUWMHLFE-UHFFFAOYSA-N 0 0 364.199 3.608 20 5 FHBDRN COc1ccc([C@@H](Cc2ccccc2)NC(=O)c2ccc([N+](=O)[O-])[nH]2)cc1 ZINC000514763331 943285758 /nfs/dbraw/zinc/28/57/58/943285758.db2.gz DTABNNLCCAJKNU-GOSISDBHSA-N 0 0 365.389 3.645 20 5 FHBDRN COC(=O)c1cc(C(=O)Oc2ccc(Cl)cc2Cl)cc([N+](=O)[O-])c1 ZINC000014471579 943294794 /nfs/dbraw/zinc/29/47/94/943294794.db2.gz GUORITWHEOHRMO-UHFFFAOYSA-N 0 0 370.144 3.907 20 5 FHBDRN CCCCCn1cc(CNC(=O)Nc2cccc([N+](=O)[O-])c2C)c(C)n1 ZINC000503617805 943303204 /nfs/dbraw/zinc/30/32/04/943303204.db2.gz ZCFYBSWOFLWUDD-UHFFFAOYSA-N 0 0 359.430 3.920 20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])NCC1(Cc2ccccc2)CC1 ZINC000435287545 943304762 /nfs/dbraw/zinc/30/47/62/943304762.db2.gz HDMQUTPUHKQCMM-UHFFFAOYSA-N 0 0 353.422 3.536 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N[C@@H]1CCN(c2ccc(F)cc2)C1 ZINC000417045980 943315980 /nfs/dbraw/zinc/31/59/80/943315980.db2.gz RWDMDNFCMJRXOG-OAHLLOKOSA-N 0 0 372.400 3.751 20 5 FHBDRN COc1cc(C(=O)Nc2c(C)cccc2Cl)c([N+](=O)[O-])cc1OC ZINC000085738021 943316125 /nfs/dbraw/zinc/31/61/25/943316125.db2.gz TVPDZQJYOHAKAI-UHFFFAOYSA-N 0 0 350.758 3.826 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N(C)c1ncccc1OC ZINC000503664564 943317495 /nfs/dbraw/zinc/31/74/95/943317495.db2.gz VORGVTONWFZHFT-UHFFFAOYSA-N 0 0 361.423 3.777 20 5 FHBDRN COc1ccc(C2(C(=O)Nc3cc([N+](=O)[O-])ccc3C)CCOCC2)cc1 ZINC000016985467 943320808 /nfs/dbraw/zinc/32/08/08/943320808.db2.gz DGIUTAYCBRUHDT-UHFFFAOYSA-N 0 0 370.405 3.599 20 5 FHBDRN Cc1ncccc1OC[C@H]1CCCN1C(=O)Nc1cc(F)cc([N+](=O)[O-])c1 ZINC000417063580 943323356 /nfs/dbraw/zinc/32/33/56/943323356.db2.gz ILPZCUIZWIFHGI-OAHLLOKOSA-N 0 0 374.372 3.513 20 5 FHBDRN Cc1c(NC(=O)NCC2(C)CCC2)cc(Br)cc1[N+](=O)[O-] ZINC000435323974 943323711 /nfs/dbraw/zinc/32/37/11/943323711.db2.gz RCUIODADIKRCBY-UHFFFAOYSA-N 0 0 356.220 3.977 20 5 FHBDRN COC(=O)c1cnoc1COc1ccc([N+](=O)[O-])cc1-c1cccs1 ZINC000505658958 943330639 /nfs/dbraw/zinc/33/06/39/943330639.db2.gz GSMVTUDIFKJYAB-UHFFFAOYSA-N 0 0 360.347 3.677 20 5 FHBDRN CC(C)(C)c1ccc(O)c(NC(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)c1 ZINC000514862490 943331864 /nfs/dbraw/zinc/33/18/64/943331864.db2.gz FKUAJXTZLLHEAT-UHFFFAOYSA-N 0 0 372.377 3.621 20 5 FHBDRN COCCCCN(C)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000417083312 943337653 /nfs/dbraw/zinc/33/76/53/943337653.db2.gz ZWYYBNMKKLTKGE-UHFFFAOYSA-N 0 0 374.235 3.556 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])Nc1ccc(Nc2ccccc2)nc1 ZINC000503703939 943346013 /nfs/dbraw/zinc/34/60/13/943346013.db2.gz SYQCANZZXLWHGB-UHFFFAOYSA-N 0 0 363.377 3.784 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)NCCCn1ccc2ccccc21 ZINC000503778061 943366395 /nfs/dbraw/zinc/36/63/95/943366395.db2.gz JGVRYJMAIHDRMS-UHFFFAOYSA-N 0 0 368.393 3.770 20 5 FHBDRN Cc1cccc(CN(CC(C)C)C(=O)COc2cccc([N+](=O)[O-])c2)c1 ZINC000514902193 943372688 /nfs/dbraw/zinc/37/26/88/943372688.db2.gz RBLRWSLQGWQHJR-UHFFFAOYSA-N 0 0 356.422 3.967 20 5 FHBDRN CCCOc1ccc2c(c1)CCN(C(=O)c1cccc(C)c1[N+](=O)[O-])C2 ZINC000435391230 943378379 /nfs/dbraw/zinc/37/83/79/943378379.db2.gz DNRIKDAUPABJCD-UHFFFAOYSA-N 0 0 354.406 3.891 20 5 FHBDRN CCCOc1ccc([C@@H](C)NC(=O)COc2ccccc2[N+](=O)[O-])cc1 ZINC000503869726 943391691 /nfs/dbraw/zinc/39/16/91/943391691.db2.gz GDTCQDXWNFVWLJ-CQSZACIVSA-N 0 0 358.394 3.640 20 5 FHBDRN CC(C)[C@H](C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-])c1ccncc1 ZINC000503889175 943404395 /nfs/dbraw/zinc/40/43/95/943404395.db2.gz ZZQXRSLEYKZQDO-KRWDZBQOSA-N 0 0 361.829 3.742 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N1CC[C@H](c2cccnc2)C1 ZINC000514940059 943408204 /nfs/dbraw/zinc/40/82/04/943408204.db2.gz NDXNBHATGIFAAI-LBPRGKRZSA-N 0 0 365.311 3.638 20 5 FHBDRN COc1cccc(-c2nc(-c3ccc(OCC4CC4)nc3)no2)c1[N+](=O)[O-] ZINC000514971069 943424383 /nfs/dbraw/zinc/42/43/83/943424383.db2.gz UPGLLJUFRJPYAM-UHFFFAOYSA-N 0 0 368.349 3.504 20 5 FHBDRN COc1ccc(NC(=O)Nc2nn(C3CCCCC3)cc2C)cc1[N+](=O)[O-] ZINC000434211264 943430393 /nfs/dbraw/zinc/43/03/93/943430393.db2.gz HSPVSKVRLUQLQG-UHFFFAOYSA-N 0 0 373.413 3.679 20 5 FHBDRN CCOC(=O)c1cc(C(=O)N2CC[C@H](C)[C@@H]3CCCC[C@@H]32)cc([N+](=O)[O-])c1 ZINC000515058551 943480019 /nfs/dbraw/zinc/48/00/19/943480019.db2.gz QQEXPQFYQULVGF-KKXDTOCCSA-N 0 0 374.437 3.812 20 5 FHBDRN COc1ccc(NC(=O)c2cccc(OC)c2[N+](=O)[O-])c(C(F)(F)F)c1 ZINC000435554603 943484200 /nfs/dbraw/zinc/48/42/00/943484200.db2.gz SGOGAVNGPMOOAK-UHFFFAOYSA-N 0 0 370.283 3.883 20 5 FHBDRN Cc1nn(CCC(=O)NCc2ccc(C)c3ccccc23)c(C)c1[N+](=O)[O-] ZINC000412476527 943484379 /nfs/dbraw/zinc/48/43/79/943484379.db2.gz REBRJYXATXYQFP-UHFFFAOYSA-N 0 0 366.421 3.576 20 5 FHBDRN CC(C)(NC(=O)Cc1cnccc1C(F)(F)F)c1ccccc1[N+](=O)[O-] ZINC000566461718 943506662 /nfs/dbraw/zinc/50/66/62/943506662.db2.gz NGTNUDCETQSQMR-UHFFFAOYSA-N 0 0 367.327 3.603 20 5 FHBDRN C[C@@H](C1CC1)n1cc(N[C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)cn1 ZINC000584736042 943510428 /nfs/dbraw/zinc/51/04/28/943510428.db2.gz JJOYCADLHPAEJU-UGSOOPFHSA-N 0 0 366.425 3.697 20 5 FHBDRN Cn1c2ccc(N[C@H]3CCCCc4ccc([N+](=O)[O-])cc43)cc2n(C)c1=O ZINC000417323563 943515509 /nfs/dbraw/zinc/51/55/09/943515509.db2.gz YNIXITHGGQGJAZ-KRWDZBQOSA-N 0 0 366.421 3.665 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1)[C@H](NCc1ncc(C(F)(F)F)cn1)CCCC2 ZINC000417324545 943515613 /nfs/dbraw/zinc/51/56/13/943515613.db2.gz AJKVMSLLHWHLAS-OAHLLOKOSA-N 0 0 366.343 3.961 20 5 FHBDRN COc1ccc(N(CC(C)C)C(=O)c2cccc(OC)c2[N+](=O)[O-])cc1 ZINC000435636355 943522291 /nfs/dbraw/zinc/52/22/91/943522291.db2.gz KTRFEXQSVGNPGR-UHFFFAOYSA-N 0 0 358.394 3.915 20 5 FHBDRN COc1cccc(C(=O)N(C)[C@@H](C)c2c(F)cccc2F)c1[N+](=O)[O-] ZINC000435638798 943522475 /nfs/dbraw/zinc/52/24/75/943522475.db2.gz ULURDYYNZKUBSI-JTQLQIEISA-N 0 0 350.321 3.715 20 5 FHBDRN C[C@@H](NC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1)c1ccc2n[nH]cc2c1 ZINC000511618624 943524300 /nfs/dbraw/zinc/52/43/00/943524300.db2.gz RSHOGYZSCZHRTD-GFCCVEGCSA-N 0 0 367.409 3.767 20 5 FHBDRN CC(C)(CCc1ccccc1)NC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000584743038 943525493 /nfs/dbraw/zinc/52/54/93/943525493.db2.gz XGSNBTFRTWYIQW-UHFFFAOYSA-N 0 0 362.376 3.943 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CCc3cc(F)c(OC)cc32)c1 ZINC000515154740 943536736 /nfs/dbraw/zinc/53/67/36/943536736.db2.gz SIGVCCYHCKDBDS-INIZCTEOSA-N 0 0 374.368 3.559 20 5 FHBDRN C[C@@H](Oc1ccccc1Cl)C(=O)N1c2ccc([N+](=O)[O-])cc2C[C@@H]1C ZINC000504278469 943569983 /nfs/dbraw/zinc/56/99/83/943569983.db2.gz CHNMVVMIRRNDRK-NWDGAFQWSA-N 0 0 360.797 3.993 20 5 FHBDRN COc1cc(C[NH2+]CCc2ccc(SC)cc2)c([N+](=O)[O-])cc1OC ZINC000435727464 943571309 /nfs/dbraw/zinc/57/13/09/943571309.db2.gz XZQPUBLZYOFKNL-UHFFFAOYSA-N 0 0 362.451 3.666 20 5 FHBDRN NC(=O)c1ccc(CN2CCC[C@H]2c2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000053278719 943577217 /nfs/dbraw/zinc/57/72/17/943577217.db2.gz PGLGBUAVQJNRAH-INIZCTEOSA-N 0 0 359.813 3.684 20 5 FHBDRN Cc1cc(S(=O)(=O)N(C)c2cccc([N+](=O)[O-])c2)ccc1OC(C)C ZINC000513813545 943585302 /nfs/dbraw/zinc/58/53/02/943585302.db2.gz GTXMFCYLGIDIMV-UHFFFAOYSA-N 0 0 364.423 3.516 20 5 FHBDRN CCCOc1cccc(CNC(=O)CSCc2ccc([N+](=O)[O-])cc2)c1 ZINC000513813461 943587163 /nfs/dbraw/zinc/58/71/63/943587163.db2.gz FHYQXOVIWMEVPB-UHFFFAOYSA-N 0 0 374.462 3.933 20 5 FHBDRN Cc1ccc(C(F)(F)F)cc1S(=O)(=O)N(C)c1cccc([N+](=O)[O-])c1 ZINC000513813245 943587196 /nfs/dbraw/zinc/58/71/96/943587196.db2.gz ZXKCCAOXWRKEHG-UHFFFAOYSA-N 0 0 374.340 3.747 20 5 FHBDRN C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)CCOc1ccc(Cl)cc1 ZINC000504318888 943588787 /nfs/dbraw/zinc/58/87/87/943588787.db2.gz QRPSRPSUODMFPJ-LBPRGKRZSA-N 0 0 360.797 3.995 20 5 FHBDRN CCCCCn1cc(CNC(=O)c2ccc([N+](=O)[O-])cc2Cl)c(C)n1 ZINC000504328548 943596758 /nfs/dbraw/zinc/59/67/58/943596758.db2.gz IUBCXRUNLMRSKV-UHFFFAOYSA-N 0 0 364.833 3.873 20 5 FHBDRN C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)CCCOCc1ccccc1 ZINC000504353888 943602833 /nfs/dbraw/zinc/60/28/33/943602833.db2.gz PWNKIMNPLBNJCN-OAHLLOKOSA-N 0 0 354.406 3.869 20 5 FHBDRN O=C(c1cccc2c1CCCN2)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000423732272 943603635 /nfs/dbraw/zinc/60/36/35/943603635.db2.gz YWXDWZFCXHRUMF-UHFFFAOYSA-N 0 0 351.406 3.758 20 5 FHBDRN CN(C)c1cc(F)c(C(=O)Oc2cccc(Cl)c2F)cc1[N+](=O)[O-] ZINC001269550809 943610361 /nfs/dbraw/zinc/61/03/61/943610361.db2.gz CYDNZMFYDDTHKA-UHFFFAOYSA-N 0 0 356.712 3.812 20 5 FHBDRN CC(C)(C(=O)NCCNc1ccccc1[N+](=O)[O-])c1ccccc1Cl ZINC000504401538 943616460 /nfs/dbraw/zinc/61/64/60/943616460.db2.gz PDCCBIHSZOHFSV-UHFFFAOYSA-N 0 0 361.829 3.754 20 5 FHBDRN CC(C)(C)c1ccc2c(c1)CCN2S(=O)(=O)c1ccccc1[N+](=O)[O-] ZINC000504478177 943641425 /nfs/dbraw/zinc/64/14/25/943641425.db2.gz SSSJBDIMQRCWGO-UHFFFAOYSA-N 0 0 360.435 3.644 20 5 FHBDRN CC(C)(COCc1ccccc1)NC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000504506092 943647616 /nfs/dbraw/zinc/64/76/16/943647616.db2.gz MDAUOXGYPAJEPQ-UHFFFAOYSA-N 0 0 367.405 3.801 20 5 FHBDRN CC(C)(C)c1cccc(OCCn2cc(Br)c([N+](=O)[O-])n2)c1 ZINC000504555897 943659053 /nfs/dbraw/zinc/65/90/53/943659053.db2.gz PMAPEMBWICAXCT-UHFFFAOYSA-N 0 0 368.231 3.930 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccnc(N(C)C)c1 ZINC000504541191 943664199 /nfs/dbraw/zinc/66/41/99/943664199.db2.gz ZHZWDBKWJXPDHJ-UHFFFAOYSA-N 0 0 360.439 3.810 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])Nc1nnc(CC2CCCCC2)s1 ZINC000504602279 943694178 /nfs/dbraw/zinc/69/41/78/943694178.db2.gz VMFDGTWIXIPJDB-UHFFFAOYSA-N 0 0 360.439 3.750 20 5 FHBDRN C[C@@](NC(=O)Cc1ccc([N+](=O)[O-])cc1F)(c1ccccc1)C(F)(F)F ZINC000504585444 943697565 /nfs/dbraw/zinc/69/75/65/943697565.db2.gz MVXJEFMWIQSPGX-MRXNPFEDSA-N 0 0 370.302 3.870 20 5 FHBDRN CCc1cccc2c1N(CC(=O)Nc1c(C)cccc1[N+](=O)[O-])CCC2 ZINC000511636474 943707166 /nfs/dbraw/zinc/70/71/66/943707166.db2.gz WNLLHRVNRWILIV-UHFFFAOYSA-N 0 0 353.422 3.857 20 5 FHBDRN COc1cc(NC(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)c(C)c(OC)c1 ZINC000504652982 943717936 /nfs/dbraw/zinc/71/79/36/943717936.db2.gz AHBWKHOTJFCSQS-UHFFFAOYSA-N 0 0 361.354 3.573 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)N1CCC[C@H](Oc2ccccc2Cl)C1 ZINC000504661122 943733766 /nfs/dbraw/zinc/73/37/66/943733766.db2.gz FBGYESYSMPLKSH-INIZCTEOSA-N 0 0 374.824 3.861 20 5 FHBDRN Cc1cccc(OC[C@@H](O)COc2cc(C)c([N+](=O)[O-])cc2Cl)c1 ZINC000504673469 943739118 /nfs/dbraw/zinc/73/91/18/943739118.db2.gz MNLMVDQQVMLTBE-CYBMUJFWSA-N 0 0 351.786 3.684 20 5 FHBDRN C[C@H](CCC(=O)[O-])[NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000417608637 943748499 /nfs/dbraw/zinc/74/84/99/943748499.db2.gz JMHZBDRZSGPBCI-CQSZACIVSA-N 0 0 357.410 3.706 20 5 FHBDRN O=C(CSc1ccccc1[N+](=O)[O-])N[C@@H]1CCCOc2ccccc21 ZINC000504709769 943753664 /nfs/dbraw/zinc/75/36/64/943753664.db2.gz VZOLBDDDVJJPAI-CQSZACIVSA-N 0 0 358.419 3.717 20 5 FHBDRN O=C(N[C@H]1C[C@H](c2cccc(F)c2)C1)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000437391886 943758475 /nfs/dbraw/zinc/75/84/75/943758475.db2.gz IYFUOFFZGQTWOZ-MQMHXKEQSA-N 0 0 353.353 3.891 20 5 FHBDRN COCCSc1ccc([C@@H](C)NC(=O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000504719831 943768244 /nfs/dbraw/zinc/76/82/44/943768244.db2.gz DYEOKWYXWNSRTM-CYBMUJFWSA-N 0 0 360.435 3.824 20 5 FHBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@H]2C[C@H](c3ccccc3Cl)C2)s1 ZINC000549990694 943774860 /nfs/dbraw/zinc/77/48/60/943774860.db2.gz XENSQGWIYLTFRC-MGCOHNPYSA-N 0 0 372.855 3.534 20 5 FHBDRN CCNc1nc(SCc2ccc(OC)c([N+](=O)[O-])c2)nc2ccccc21 ZINC000515289856 943776055 /nfs/dbraw/zinc/77/60/55/943776055.db2.gz YESBMLMZCQRXEE-UHFFFAOYSA-N 0 0 370.434 3.693 20 5 FHBDRN Cc1c(C(=O)N[C@H]2C[C@@H]2c2ccccc2OC(F)F)cccc1[N+](=O)[O-] ZINC000437403433 943779414 /nfs/dbraw/zinc/77/94/14/943779414.db2.gz KAMAXMMQFQLLNT-KGLIPLIRSA-N 0 0 362.332 3.791 20 5 FHBDRN CC(C)c1ccc(C[NH2+]Cc2cc(F)c(C(=O)[O-])c(F)c2)cc1[N+](=O)[O-] ZINC000417646980 943780755 /nfs/dbraw/zinc/78/07/55/943780755.db2.gz JZYOWSDRVGHICM-UHFFFAOYSA-N 0 0 364.348 3.984 20 5 FHBDRN O=C(N[C@H]1C[C@H](c2cccc(Cl)c2)C1)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000437406468 943781113 /nfs/dbraw/zinc/78/11/13/943781113.db2.gz NKQFPJAWEIQDMP-AULYBMBSSA-N 0 0 370.796 3.801 20 5 FHBDRN Cc1c(CS(=O)(=O)c2ncc(C(C)(C)C)s2)cccc1[N+](=O)[O-] ZINC000424203975 943787191 /nfs/dbraw/zinc/78/71/91/943787191.db2.gz JXGJAIFILXHLII-UHFFFAOYSA-N 0 0 354.453 3.631 20 5 FHBDRN CC(=Cc1cccc([N+](=O)[O-])c1)CNc1ccn(CCC(F)(F)F)n1 ZINC000424204818 943787948 /nfs/dbraw/zinc/78/79/48/943787948.db2.gz MIJNRKAAAGCOFP-FMIVXFBMSA-N 0 0 354.332 3.681 20 5 FHBDRN COc1ccc(C(=O)N(C)Cc2cc([N+](=O)[O-])ccc2Cl)c(OC)c1 ZINC000053334300 943796877 /nfs/dbraw/zinc/79/68/77/943796877.db2.gz RNCIUFDFEBCANG-UHFFFAOYSA-N 0 0 364.785 3.538 20 5 FHBDRN CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)CCC(=O)c1cccs1 ZINC000053334594 943798081 /nfs/dbraw/zinc/79/80/81/943798081.db2.gz OOEVBOFGGPIGPT-UHFFFAOYSA-N 0 0 366.826 3.931 20 5 FHBDRN C[C@@H](NC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1)[C@H]1Oc2ccccc2[C@@H]1C ZINC000437447955 943807911 /nfs/dbraw/zinc/80/79/11/943807911.db2.gz FKJCJJWDHOLJQB-PJHJGJPPSA-N 0 0 369.421 3.908 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)NCc1c(F)cccc1Cl ZINC000515369793 943815821 /nfs/dbraw/zinc/81/58/21/943815821.db2.gz DTTDXBAPMUMFRV-UHFFFAOYSA-N 0 0 354.790 3.796 20 5 FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)NC1CC(C(C)(C)C)C1 ZINC000504834172 943821387 /nfs/dbraw/zinc/82/13/87/943821387.db2.gz WAEDQBZTICFLFM-UHFFFAOYSA-N 0 0 366.483 3.888 20 5 FHBDRN Cc1oc(-c2ccccc2)nc1Cn1c2cc([N+](=O)[O-])ccc2oc1=O ZINC000123013520 943822826 /nfs/dbraw/zinc/82/28/26/943822826.db2.gz UIFRLAPYYWOFSB-UHFFFAOYSA-N 0 0 351.318 3.514 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NC(C)(C)COCc1ccccc1 ZINC000504837975 943826133 /nfs/dbraw/zinc/82/61/33/943826133.db2.gz ZZBFYJSYYZJNMJ-UHFFFAOYSA-N 0 0 373.409 3.720 20 5 FHBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1COc1ccc(C(=O)N(C)C)cc1 ZINC000105393613 943830550 /nfs/dbraw/zinc/83/05/50/943830550.db2.gz QBNGBUNLMMZAGD-UHFFFAOYSA-N 0 0 358.394 3.663 20 5 FHBDRN CCOc1cc(C(=O)N[C@H]2C[C@H](c3ccccc3)C2)c([N+](=O)[O-])cc1OC ZINC000437462748 943831971 /nfs/dbraw/zinc/83/19/71/943831971.db2.gz WKZSSXMUJPUDQJ-SHTZXODSSA-N 0 0 370.405 3.678 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)c1cccc(OC(F)F)c1 ZINC000515390239 943834656 /nfs/dbraw/zinc/83/46/56/943834656.db2.gz SGJJTGNOPKXENO-JTQLQIEISA-N 0 0 366.320 3.696 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)c1cccc(OC(F)F)c1 ZINC000515390240 943835219 /nfs/dbraw/zinc/83/52/19/943835219.db2.gz SGJJTGNOPKXENO-SNVBAGLBSA-N 0 0 366.320 3.696 20 5 FHBDRN O=C(Nc1n[nH]c2ccc([N+](=O)[O-])cc21)c1ncoc1-c1ccc(F)cc1 ZINC000515390865 943836406 /nfs/dbraw/zinc/83/64/06/943836406.db2.gz XFESBGIEMXVJRX-UHFFFAOYSA-N 0 0 367.296 3.518 20 5 FHBDRN COc1ccc(-c2ccc(C[NH2+][C@H](CC3CCC3)C(=O)[O-])o2)c([N+](=O)[O-])c1 ZINC000417702015 943837934 /nfs/dbraw/zinc/83/79/34/943837934.db2.gz KCOJBMTXKCMGGI-MRXNPFEDSA-N 0 0 374.393 3.596 20 5 FHBDRN CSc1ccc(CCNC(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)cc1 ZINC000437467867 943839797 /nfs/dbraw/zinc/83/97/97/943839797.db2.gz NVORZSIDMGBYBR-GFCCVEGCSA-N 0 0 362.426 3.918 20 5 FHBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)NCC1(OC)CCC1 ZINC000504843757 943852629 /nfs/dbraw/zinc/85/26/29/943852629.db2.gz XONZTGOIEKGXEK-UHFFFAOYSA-N 0 0 352.456 3.786 20 5 FHBDRN O=[N+]([O-])c1ccc2oc(-c3nc(-c4ccc5c(c4)OCO5)no3)cc2c1 ZINC000504843519 943853166 /nfs/dbraw/zinc/85/31/66/943853166.db2.gz VQQCSQXSONNZPH-UHFFFAOYSA-N 0 0 351.274 3.787 20 5 FHBDRN CCC[C@@]1(C(F)(F)F)CCCN1C(=O)c1cccc(OC)c1[N+](=O)[O-] ZINC000435923693 943859008 /nfs/dbraw/zinc/85/90/08/943859008.db2.gz SYJCFQFOJJDCGD-HNNXBMFYSA-N 0 0 360.332 3.941 20 5 FHBDRN O=C(NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)C1(C(F)(F)F)CCCC1 ZINC000516959130 943865498 /nfs/dbraw/zinc/86/54/98/943865498.db2.gz XPZIWSQCEYHXHI-UHFFFAOYSA-N 0 0 369.343 3.858 20 5 FHBDRN C[C@@H](c1cccnc1)N(C)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425417385 943871738 /nfs/dbraw/zinc/87/17/38/943871738.db2.gz HQYYKPLCKHFOBK-NSHDSACASA-N 0 0 350.216 3.945 20 5 FHBDRN O=C(NC[C@H]1CCC(F)(F)C1)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000435954921 943876328 /nfs/dbraw/zinc/87/63/28/943876328.db2.gz RRFCMXKFYLUONP-NSHDSACASA-N 0 0 374.362 3.986 20 5 FHBDRN Cc1cc(N2CCOC3(CCOCC3)CC2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000515447396 943881147 /nfs/dbraw/zinc/88/11/47/943881147.db2.gz NABFBYHPKNIYRO-UHFFFAOYSA-N 0 0 374.359 3.698 20 5 FHBDRN O=C(N[C@@H]1[C@@H]2CCc3ccccc3[C@@H]21)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000435960926 943881812 /nfs/dbraw/zinc/88/18/12/943881812.db2.gz BNSPTNJANIVJTN-LSTHTHJFSA-N 0 0 363.417 3.627 20 5 FHBDRN C[C@@H]1C[C@H]1[C@@H](Nc1nccc(C(N)=O)c1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000290761439 943888833 /nfs/dbraw/zinc/88/88/33/943888833.db2.gz KAUVKYQKWWQOJH-FZQKWOKYSA-N 0 0 360.801 3.551 20 5 FHBDRN Cc1c(NC(=O)N[C@H]2CCC[C@H]2C)cc(Br)cc1[N+](=O)[O-] ZINC000504895151 943893807 /nfs/dbraw/zinc/89/38/07/943893807.db2.gz MWXUVPKQCFTQNT-KCJUWKMLSA-N 0 0 356.220 3.976 20 5 FHBDRN CC(C)(COCc1ccccc1)NC(=O)Nc1cc(F)cc([N+](=O)[O-])c1 ZINC000504896162 943895170 /nfs/dbraw/zinc/89/51/70/943895170.db2.gz RQRFRTNSXUZAME-UHFFFAOYSA-N 0 0 361.373 3.851 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)N[C@H]2CCCc3cc(N)ccc32)cc1[N+](=O)[O-] ZINC000417849665 943903622 /nfs/dbraw/zinc/90/36/22/943903622.db2.gz LOJLZPDOLJULLS-UGSOOPFHSA-N 0 0 368.437 3.923 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)N[C@@H]2CCCc3cc(N)ccc32)cc1[N+](=O)[O-] ZINC000417849663 943903953 /nfs/dbraw/zinc/90/39/53/943903953.db2.gz LOJLZPDOLJULLS-FZKQIMNGSA-N 0 0 368.437 3.923 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N[C@@H]2C[C@H]2c2cccc3ccccc32)c1[N+](=O)[O-] ZINC000435962557 943904410 /nfs/dbraw/zinc/90/44/10/943904410.db2.gz AXSPRRLFQKLSEN-JKSUJKDBSA-N 0 0 364.405 3.880 20 5 FHBDRN Cc1cc(Cc2noc([C@H]3CCC(=O)c4ccccc43)n2)ccc1[N+](=O)[O-] ZINC000515479032 943918351 /nfs/dbraw/zinc/91/83/51/943918351.db2.gz VMOFMFQEFMZDPU-INIZCTEOSA-N 0 0 363.373 3.985 20 5 FHBDRN Cc1cc([C@H]2CCCN2C(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)on1 ZINC000435996198 943921611 /nfs/dbraw/zinc/92/16/11/943921611.db2.gz PQRIHPXWGRFQMY-LJQANCHMSA-N 0 0 373.412 3.955 20 5 FHBDRN COc1ccc([C@H]2CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4o3)C2)cc1 ZINC000504926080 943923982 /nfs/dbraw/zinc/92/39/82/943923982.db2.gz WVNINBSZVMLMLY-AWEZNQCLSA-N 0 0 366.373 3.979 20 5 FHBDRN CC(C)(C(=O)N[C@H]1CCOc2c(F)cccc21)c1ccccc1[N+](=O)[O-] ZINC000504929725 943926708 /nfs/dbraw/zinc/92/67/08/943926708.db2.gz LAEVWUCJERSYTO-HNNXBMFYSA-N 0 0 358.369 3.652 20 5 FHBDRN CN(C[C@H]1CC=CCC1)C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000544122779 943928350 /nfs/dbraw/zinc/92/83/50/943928350.db2.gz DQEYDSCZMTTYOK-NSHDSACASA-N 0 0 353.216 3.786 20 5 FHBDRN O=C(Oc1cc(F)ccc1Cl)c1cc2c(cc1[N+](=O)[O-])OCCCO2 ZINC001270040245 943938333 /nfs/dbraw/zinc/93/83/33/943938333.db2.gz JPGUTQJQZWNUEH-UHFFFAOYSA-N 0 0 367.716 3.768 20 5 FHBDRN Cc1ccc(S(=O)(=O)N(CC2CCCCC2)C2CC2)cc1[N+](=O)[O-] ZINC000515519114 943951498 /nfs/dbraw/zinc/95/14/98/943951498.db2.gz DJDLQNZXNCABTF-UHFFFAOYSA-N 0 0 352.456 3.637 20 5 FHBDRN O=[N+]([O-])c1ccc(-n2ccc(-c3nc(CCc4ccccc4)no3)n2)cc1 ZINC000504987372 943958970 /nfs/dbraw/zinc/95/89/70/943958970.db2.gz XTVZJMRUYAJAGI-UHFFFAOYSA-N 0 0 361.361 3.616 20 5 FHBDRN CC1=C[C@H](C)CN(C(=O)c2cc(F)cc3c(=O)c4cc(F)ccc4[nH]c23)C1 ZINC000436019752 943958944 /nfs/dbraw/zinc/95/89/44/943958944.db2.gz IJIIXARMHRMYPK-NSHDSACASA-N 0 0 368.383 3.998 20 5 FHBDRN CSc1cc(-c2nc(-c3cccc([N+](=O)[O-])c3)no2)ccc1NC(C)=O ZINC000505014962 943970256 /nfs/dbraw/zinc/97/02/56/943970256.db2.gz UYXMCXUGYGHSOW-UHFFFAOYSA-N 0 0 370.390 3.992 20 5 FHBDRN O=C(N[C@H]1C[C@@H]1c1ccccc1)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000436049401 943972418 /nfs/dbraw/zinc/97/24/18/943972418.db2.gz XNJGBGZXPBRSCP-UTKZUKDTSA-N 0 0 354.409 3.967 20 5 FHBDRN CC(C)[C@H](C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-])c1cccnc1 ZINC000436051770 943974832 /nfs/dbraw/zinc/97/48/32/943974832.db2.gz MWOGKRNLLWERAX-KRWDZBQOSA-N 0 0 361.829 3.742 20 5 FHBDRN CC(C)NC(=O)Nc1ccccc1NC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000584506720 943977084 /nfs/dbraw/zinc/97/70/84/943977084.db2.gz NWZSAKCSBKMSSY-CYBMUJFWSA-N 0 0 370.409 3.867 20 5 FHBDRN CCOc1ccc2c(c1)C[C@@H](c1nc(-c3cccc([N+](=O)[O-])c3)no1)CO2 ZINC000505040405 943977312 /nfs/dbraw/zinc/97/73/12/943977312.db2.gz TZZHAFZVBINCNZ-CQSZACIVSA-N 0 0 367.361 3.762 20 5 FHBDRN Cn1cc(C(=O)NCCCC2CCCC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000053422179 943984805 /nfs/dbraw/zinc/98/48/05/943984805.db2.gz HEMDAHAULAQAML-UHFFFAOYSA-N 0 0 356.426 3.696 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)N[C@H]1C[C@H](c2cc(F)cc(F)c2)C1 ZINC000437645715 943995824 /nfs/dbraw/zinc/99/58/24/943995824.db2.gz KXYGLNXPQKCVIL-SAZUREKKSA-N 0 0 361.348 3.618 20 5 FHBDRN Cc1ccc(-c2cc(C(=O)N(C)Cc3ccccc3[N+](=O)[O-])[nH]n2)cc1C ZINC000436086081 944003941 /nfs/dbraw/zinc/00/39/41/944003941.db2.gz GZYJSWCWBZRUHB-UHFFFAOYSA-N 0 0 364.405 3.874 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCc1cn2ccccc2n1 ZINC000505753488 944004298 /nfs/dbraw/zinc/00/42/98/944004298.db2.gz UCHLYXBCXVNDMS-UHFFFAOYSA-N 0 0 370.434 3.675 20 5 FHBDRN CC(C)(C)c1nnc(SCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)o1 ZINC000515571907 944006166 /nfs/dbraw/zinc/00/61/66/944006166.db2.gz PICSGTAZBQPUEU-UHFFFAOYSA-N 0 0 361.383 3.618 20 5 FHBDRN O=C(N[C@H](c1ccc(F)c(Cl)c1)C(F)(F)F)c1cc([N+](=O)[O-])c[nH]1 ZINC000436101744 944017383 /nfs/dbraw/zinc/01/73/83/944017383.db2.gz LWRYMRWKIKLNRD-LLVKDONJSA-N 0 0 365.670 3.749 20 5 FHBDRN CCNc1ccc(C(=O)N2CC[C@@H](c3ccc(OC)cc3)C2)cc1[N+](=O)[O-] ZINC000505083284 944024755 /nfs/dbraw/zinc/02/47/55/944024755.db2.gz FAAGXUGBEIJIHN-MRXNPFEDSA-N 0 0 369.421 3.665 20 5 FHBDRN CCCCO[C@@H]1C[C@H](N(C)C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1(C)C ZINC000500058849 944029319 /nfs/dbraw/zinc/02/93/19/944029319.db2.gz WTACEMISHBKJFQ-JKSUJKDBSA-N 0 0 374.441 3.527 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2noc(-c3cccc(OC[C@@H]4CCCO4)c3)n2)cc1 ZINC000505088685 944029821 /nfs/dbraw/zinc/02/98/21/944029821.db2.gz BUXARVUWQYECCF-KRWDZBQOSA-N 0 0 367.361 3.870 20 5 FHBDRN Cc1cc([N+](=O)[O-])cnc1Sc1nnc(C2CC2)n1-c1ccccc1 ZINC000092584871 944037837 /nfs/dbraw/zinc/03/78/37/944037837.db2.gz PZUIVHBMYMDJEA-UHFFFAOYSA-N 0 0 353.407 3.908 20 5 FHBDRN Cc1ccc([C@H]2C[C@H](C)CCN2S(=O)(=O)c2ccc([N+](=O)[O-])cc2)o1 ZINC000437702754 944045923 /nfs/dbraw/zinc/04/59/23/944045923.db2.gz NLOUAOWLOGOATF-MLGOLLRUSA-N 0 0 364.423 3.658 20 5 FHBDRN COC(=O)C(C)(C)c1ccc(NC(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000437708062 944049026 /nfs/dbraw/zinc/04/90/26/944049026.db2.gz WOFLFJUGIGRWOJ-UHFFFAOYSA-N 0 0 357.366 3.689 20 5 FHBDRN CC(C)CN(CC(F)(F)F)C(=O)CSc1ccccc1[N+](=O)[O-] ZINC000500072546 944051223 /nfs/dbraw/zinc/05/12/23/944051223.db2.gz DLLUQKZNWVAANO-UHFFFAOYSA-N 0 0 350.362 3.734 20 5 FHBDRN C[C@@H](NC(=O)N1CC2(CCC2)[C@@H]1C1CCOCC1)c1ccccc1[N+](=O)[O-] ZINC000425477504 944056278 /nfs/dbraw/zinc/05/62/78/944056278.db2.gz AZFABGHHJFRWTK-KDOFPFPSSA-N 0 0 373.453 3.647 20 5 FHBDRN CCOc1cc(Nc2ccc(CN3CCCC3=O)cc2)ccc1[N+](=O)[O-] ZINC000092612258 944064109 /nfs/dbraw/zinc/06/41/09/944064109.db2.gz IIOQYEZYVVNVRQ-UHFFFAOYSA-N 0 0 355.394 3.860 20 5 FHBDRN CCc1nn(C)c(Sc2nnc(-c3ccc(Cl)cc3)o2)c1[N+](=O)[O-] ZINC000517196784 944079457 /nfs/dbraw/zinc/07/94/57/944079457.db2.gz JZBSWWWQVYVLBU-UHFFFAOYSA-N 0 0 365.802 3.745 20 5 FHBDRN O=C(CCCOc1ccc(Cl)cc1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000515648914 944092306 /nfs/dbraw/zinc/09/23/06/944092306.db2.gz YUTBLLINZZKUEV-UHFFFAOYSA-N 0 0 360.797 3.997 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)Nc1nc(C2CCC2)cs1 ZINC000436199745 944095883 /nfs/dbraw/zinc/09/58/83/944095883.db2.gz QLKYCUJBXFDAJC-UHFFFAOYSA-N 0 0 356.407 3.912 20 5 FHBDRN CC(F)(F)CCCNC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000452594250 944114386 /nfs/dbraw/zinc/11/43/86/944114386.db2.gz HCKKIYOHNSIUFU-UHFFFAOYSA-N 0 0 352.790 3.892 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CC[C@H](c2cccc(F)c2)C1 ZINC000515678004 944121832 /nfs/dbraw/zinc/12/18/32/944121832.db2.gz JIXDCKFDGGVFTG-AWEZNQCLSA-N 0 0 367.380 3.774 20 5 FHBDRN C[C@@H](Nc1ccc([N+](=O)[O-])c(OC(F)F)c1)[C@@H](O)c1ccc(F)cc1 ZINC000092653344 944138545 /nfs/dbraw/zinc/13/85/45/944138545.db2.gz QJKWKTFGCOOGIU-RFAUZJTJSA-N 0 0 356.300 3.869 20 5 FHBDRN Cc1c(NC(=O)N2CC[C@]3(C2)CCc2ccccc2O3)cccc1[N+](=O)[O-] ZINC000517264136 944144177 /nfs/dbraw/zinc/14/41/77/944144177.db2.gz ORZBCRPRKVCVKF-FQEVSTJZSA-N 0 0 367.405 3.905 20 5 FHBDRN Cc1oc(Br)cc1C(=O)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000424837867 944147306 /nfs/dbraw/zinc/14/73/06/944147306.db2.gz OKKBLYFGBUCPFG-UHFFFAOYSA-N 0 0 367.199 3.573 20 5 FHBDRN COC(=O)c1cc(F)ccc1CN(Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000505781261 944147950 /nfs/dbraw/zinc/14/79/50/944147950.db2.gz DZYSOAUTKARSGU-UHFFFAOYSA-N 0 0 360.385 3.931 20 5 FHBDRN CCCOc1cc(NC(=O)NCC2CC2)c([N+](=O)[O-])cc1OCCC ZINC000506143403 944161797 /nfs/dbraw/zinc/16/17/97/944161797.db2.gz KYUXWIIAALCKNS-UHFFFAOYSA-N 0 0 351.403 3.704 20 5 FHBDRN CC(C)(C)c1cccc(OCCNC(=O)NCc2ccc([N+](=O)[O-])cc2)c1 ZINC000506144882 944164676 /nfs/dbraw/zinc/16/46/76/944164676.db2.gz WSXPKLQXJSFXAY-UHFFFAOYSA-N 0 0 371.437 3.771 20 5 FHBDRN Cc1nc2ccccc2n1CCNc1cc(C(F)(F)F)ncc1[N+](=O)[O-] ZINC000436270318 944168688 /nfs/dbraw/zinc/16/86/88/944168688.db2.gz ALDZJZFXZIAZSQ-UHFFFAOYSA-N 0 0 365.315 3.779 20 5 FHBDRN Cc1c(CNC(=O)N[C@@H]2C[C@H]2c2ccc(Cl)cc2)cccc1[N+](=O)[O-] ZINC000437855082 944174764 /nfs/dbraw/zinc/17/47/64/944174764.db2.gz SSEUTXSSYIKVOY-JKSUJKDBSA-N 0 0 359.813 3.912 20 5 FHBDRN NC(=O)c1ccc(CSCCOc2ccc(Cl)cc2)c([N+](=O)[O-])c1 ZINC000517284709 944179891 /nfs/dbraw/zinc/17/98/91/944179891.db2.gz HVDYGUGMBNICTI-UHFFFAOYSA-N 0 0 366.826 3.659 20 5 FHBDRN CC(=O)N(C)c1cccc(Nc2ccc([N+](=O)[O-])c(OC(F)F)c2)c1 ZINC000092663043 944195826 /nfs/dbraw/zinc/19/58/26/944195826.db2.gz IZKBYEGEPPMGLV-UHFFFAOYSA-N 0 0 351.309 3.923 20 5 FHBDRN CO[C@@]1(C)C[C@H](N(C)C(=O)c2ccc(SC)c([N+](=O)[O-])c2)C1(C)C ZINC000436331816 944210673 /nfs/dbraw/zinc/21/06/73/944210673.db2.gz GESVNWYUDYJEQN-YOEHRIQHSA-N 0 0 352.456 3.592 20 5 FHBDRN COc1cccc2c1CCN(c1cc(C(F)(F)F)ncc1[N+](=O)[O-])C2 ZINC000436331376 944210758 /nfs/dbraw/zinc/21/07/58/944210758.db2.gz FTVSWGXREZZKDB-UHFFFAOYSA-N 0 0 353.300 3.580 20 5 FHBDRN Cc1nn(Cc2ccc(C(=O)N3C[C@@H](C)CC[C@H]3C)cc2)c(C)c1[N+](=O)[O-] ZINC000436333469 944211567 /nfs/dbraw/zinc/21/15/67/944211567.db2.gz JRXLRWUKQDVAAX-UONOGXRCSA-N 0 0 370.453 3.717 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)N[C@@H]1[C@@H]2CCc3ccccc3[C@@H]21 ZINC000500174004 944212658 /nfs/dbraw/zinc/21/26/58/944212658.db2.gz RTSAWKGHZGZKJW-YZGWKJHDSA-N 0 0 365.433 3.507 20 5 FHBDRN Cc1cccnc1/C=C\C(=O)OCc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000759788945 944241272 /nfs/dbraw/zinc/24/12/72/944241272.db2.gz DICZSLXCEKNYSD-CLFYSBASSA-N 0 0 356.378 3.842 20 5 FHBDRN Cc1noc2ncc(NC(=O)c3ccc4[nH]c5ccccc5c(=O)c4c3)cc12 ZINC000436371880 944243425 /nfs/dbraw/zinc/24/34/25/944243425.db2.gz UAAFRHRPGQURQD-UHFFFAOYSA-N 0 0 370.368 3.778 20 5 FHBDRN COc1ccc(CNC(=O)N[C@@H](c2ccc(C)cc2)C2CC2)cc1[N+](=O)[O-] ZINC000515831381 944250146 /nfs/dbraw/zinc/25/01/46/944250146.db2.gz ODLPLJXOLYKWRX-IBGZPJMESA-N 0 0 369.421 3.862 20 5 FHBDRN CC1=CCCN(C(=O)c2cc(F)cc3c(=O)c4cc(F)ccc4[nH]c23)C1 ZINC000437958768 944254011 /nfs/dbraw/zinc/25/40/11/944254011.db2.gz XPRNBLINKNUELU-UHFFFAOYSA-N 0 0 354.356 3.752 20 5 FHBDRN C[C@H](N(C)C(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)C1(C)CC1 ZINC000426253414 944257364 /nfs/dbraw/zinc/25/73/64/944257364.db2.gz AQZUCGOBQJYXJI-JTQLQIEISA-N 0 0 359.348 3.944 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)F)cc1N1CC[C@@H](Nc2ccccc2)C1 ZINC000436387500 944257703 /nfs/dbraw/zinc/25/77/03/944257703.db2.gz LPRZXBQTUUFQLG-GFCCVEGCSA-N 0 0 352.316 3.699 20 5 FHBDRN CN(C(=O)CCCNc1ccc([N+](=O)[O-])cc1)c1ccc2cc[nH]c2c1 ZINC000473571007 944258316 /nfs/dbraw/zinc/25/83/16/944258316.db2.gz NTWWHNPQMGFIDK-UHFFFAOYSA-N 0 0 352.394 3.931 20 5 FHBDRN C[C@H](Nc1cc(C(F)(F)F)ncc1[N+](=O)[O-])[C@H]1COc2ccccc21 ZINC000436392031 944263270 /nfs/dbraw/zinc/26/32/70/944263270.db2.gz PUVSOOHLENCDTD-GXSJLCMTSA-N 0 0 353.300 3.985 20 5 FHBDRN CCOc1cc2c(cc1[C@@H]1C[C@H]1Nc1ncccc1[N+](=O)[O-])O[C@@H](C)C2 ZINC000517393315 944263995 /nfs/dbraw/zinc/26/39/95/944263995.db2.gz MTUKTVRQMVBHHL-CORIIIEPSA-N 0 0 355.394 3.680 20 5 FHBDRN COc1ccc(NC(=O)N[C@@H]2C[C@H]2c2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000436379264 944265507 /nfs/dbraw/zinc/26/55/07/944265507.db2.gz PFXKWHBNUMCSRB-UONOGXRCSA-N 0 0 361.785 3.934 20 5 FHBDRN C[C@@H](Sc1ccc(Cl)nn1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000010653489 944268127 /nfs/dbraw/zinc/26/81/27/944268127.db2.gz CQYBQURPORJRNF-SSDOTTSWSA-N 0 0 373.221 3.811 20 5 FHBDRN O=C(NCCOc1ccc([N+](=O)[O-])cc1)c1ccc(-c2ccccc2F)o1 ZINC000518309511 944271871 /nfs/dbraw/zinc/27/18/71/944271871.db2.gz PVLWOLQYCBNIGS-UHFFFAOYSA-N 0 0 370.336 3.803 20 5 FHBDRN COC(=O)CCc1ccc(Nc2cc(C(F)(F)F)ncc2[N+](=O)[O-])cc1 ZINC000436396073 944272519 /nfs/dbraw/zinc/27/25/19/944272519.db2.gz XYZFHSBMKCYRSM-UHFFFAOYSA-N 0 0 369.299 3.858 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)F)cc1NCCOc1ccc(F)c(F)c1 ZINC000436396645 944272710 /nfs/dbraw/zinc/27/27/10/944272710.db2.gz ZERSVURPKVNTRS-UHFFFAOYSA-N 0 0 363.242 3.778 20 5 FHBDRN CCOC(=O)c1cc(C(=O)Nc2cc(C)c(OC)cc2C)cc([N+](=O)[O-])c1 ZINC000436402799 944278411 /nfs/dbraw/zinc/27/84/11/944278411.db2.gz BCXKVDOSPCTVKE-UHFFFAOYSA-N 0 0 372.377 3.649 20 5 FHBDRN COCCNC(=O)c1cccc(Sc2ccc(Cl)cc2)c1[N+](=O)[O-] ZINC000184219585 944278581 /nfs/dbraw/zinc/27/85/81/944278581.db2.gz HPMYAUUPYLACGC-UHFFFAOYSA-N 0 0 366.826 3.776 20 5 FHBDRN C/C=C\C[C@H](CO)NC(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000473710415 944278803 /nfs/dbraw/zinc/27/88/03/944278803.db2.gz OSFUVFGULINXQK-MPNWYJEXSA-N 0 0 371.393 3.836 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)F)cc1Oc1cccc(-n2cccn2)c1 ZINC000436404786 944280991 /nfs/dbraw/zinc/28/09/91/944280991.db2.gz NLPIHLBUXGAWMT-UHFFFAOYSA-N 0 0 350.256 3.987 20 5 FHBDRN COc1c2ccccc2oc1CNC(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000473720872 944282539 /nfs/dbraw/zinc/28/25/39/944282539.db2.gz IUVOFPQWHZWNGE-UHFFFAOYSA-N 0 0 369.377 3.691 20 5 FHBDRN COc1ccc(CC(=O)N2CC(c3ccccc3)(C(C)C)C2)cc1[N+](=O)[O-] ZINC000518336023 944283452 /nfs/dbraw/zinc/28/34/52/944283452.db2.gz LKLBQCBVLGXOBN-UHFFFAOYSA-N 0 0 368.433 3.582 20 5 FHBDRN COc1ccc([C@H](OC)[C@@H](C)Nc2c3c(ccc2[N+](=O)[O-])NCC3)cc1 ZINC000436418472 944292126 /nfs/dbraw/zinc/29/21/26/944292126.db2.gz OZUWJTGQVMIFDR-CWTRNNRKSA-N 0 0 357.410 3.760 20 5 FHBDRN O=C(c1cccc([N+](=O)[O-])c1)N1CCO[C@H](c2ccc(F)cc2Cl)C1 ZINC000184240415 944307296 /nfs/dbraw/zinc/30/72/96/944307296.db2.gz HSWZDBJDJCTNBO-INIZCTEOSA-N 0 0 364.760 3.601 20 5 FHBDRN CCS[C@@H]1CCCC[C@@H]1NC(=O)Nc1ccc(OC)c([N+](=O)[O-])c1 ZINC000543889159 944313258 /nfs/dbraw/zinc/31/32/58/944313258.db2.gz CNDITYZWFNLFOH-SWLSCSKDSA-N 0 0 353.444 3.789 20 5 FHBDRN O=[N+]([O-])c1cc2cc(Br)cnc2c(NCC(F)(F)F)c1 ZINC001161630407 944319149 /nfs/dbraw/zinc/31/91/49/944319149.db2.gz HTSWTDXFGXIAQF-UHFFFAOYSA-N 0 0 350.094 3.880 20 5 FHBDRN CCCCc1nc(CSCc2ccc(C(N)=O)cc2[N+](=O)[O-])cs1 ZINC000105634036 944320381 /nfs/dbraw/zinc/32/03/81/944320381.db2.gz FJJHIRQXIHQMDN-UHFFFAOYSA-N 0 0 365.480 3.926 20 5 FHBDRN CCCOc1ccc(CNC(=O)NCCc2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000473740669 944325329 /nfs/dbraw/zinc/32/53/29/944325329.db2.gz QDJSUYKTMWAZFI-UHFFFAOYSA-N 0 0 371.437 3.734 20 5 FHBDRN Cc1ccc(C(=O)Nc2ccc(C(=O)NC(C)C)c(C)c2)cc1[N+](=O)[O-] ZINC000517482977 944327043 /nfs/dbraw/zinc/32/70/43/944327043.db2.gz SJHDOVGJQLBHHM-UHFFFAOYSA-N 0 0 355.394 3.602 20 5 FHBDRN O=C(COc1cccc([N+](=O)[O-])c1)N(Cc1cscn1)c1ccccc1 ZINC000517483752 944328552 /nfs/dbraw/zinc/32/85/52/944328552.db2.gz CICIDFWSNCPFFW-UHFFFAOYSA-N 0 0 369.402 3.664 20 5 FHBDRN CC(C)(CNc1ncc([N+](=O)[O-])cn1)c1ccc(Br)cc1 ZINC000302149048 944329558 /nfs/dbraw/zinc/32/95/58/944329558.db2.gz JKDZHFLHXIQDBS-UHFFFAOYSA-N 0 0 351.204 3.537 20 5 FHBDRN C[C@@H](CC[NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1)CC(=O)[O-] ZINC000426666048 944332199 /nfs/dbraw/zinc/33/21/99/944332199.db2.gz NJVPOQUITKFHMF-HNNXBMFYSA-N 0 0 371.437 3.953 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCc1ccc(O)c(F)c1 ZINC000506483301 944335349 /nfs/dbraw/zinc/33/53/49/944335349.db2.gz WAJRXEBFQCWRHD-UHFFFAOYSA-N 0 0 364.398 3.872 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)Nc2cc(-c3ccc(C)s3)[nH]n2)c1 ZINC000105648642 944345710 /nfs/dbraw/zinc/34/57/10/944345710.db2.gz CVHLYWZQSSVDLJ-UHFFFAOYSA-N 0 0 358.379 3.616 20 5 FHBDRN C[C@@H]1CN(C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)c2ccccc2O1 ZINC000518392759 944347783 /nfs/dbraw/zinc/34/77/83/944347783.db2.gz WQWZPUVCJOVHCV-GFCCVEGCSA-N 0 0 353.378 3.597 20 5 FHBDRN CC(C)O[C@@H]1C[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)C1(C)C ZINC000500260033 944348454 /nfs/dbraw/zinc/34/84/54/944348454.db2.gz DKJFEXOWYHJRCT-UONOGXRCSA-N 0 0 374.359 3.936 20 5 FHBDRN CC(C)[C@@H](NC(=O)c1ccc([N+](=O)[O-])s1)c1ccc2c(c1)OCCO2 ZINC000015026953 944350988 /nfs/dbraw/zinc/35/09/88/944350988.db2.gz QDGOCWMZVNZTPZ-MRXNPFEDSA-N 0 0 362.407 3.555 20 5 FHBDRN CC[C@@H]1C[C@H]1NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 ZINC000438113621 944351402 /nfs/dbraw/zinc/35/14/02/944351402.db2.gz LHXLFOLOXWFJLV-OGHNNQOOSA-N 0 0 354.410 3.691 20 5 FHBDRN COc1ccc(C(=O)N2CCC(OC3CCCCC3)CC2)cc1[N+](=O)[O-] ZINC000123387492 944353794 /nfs/dbraw/zinc/35/37/94/944353794.db2.gz CEVZJKZGPHXVHV-UHFFFAOYSA-N 0 0 362.426 3.557 20 5 FHBDRN C[NH+](C)[C@@H](CNc1ccc([N+](=O)[O-])c2cccnc12)c1cccc(F)c1 ZINC000105701089 944356960 /nfs/dbraw/zinc/35/69/60/944356960.db2.gz HTGAXHZGDUASSZ-SFHVURJKSA-N 0 0 354.385 3.997 20 5 FHBDRN Cc1c(CNC(=O)Cc2cscc2Br)cccc1[N+](=O)[O-] ZINC000506178197 944359757 /nfs/dbraw/zinc/35/97/57/944359757.db2.gz INBCZPKRVOGKIZ-UHFFFAOYSA-N 0 0 369.240 3.586 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)N[C@H]1CCO[C@H]1c1ccc(F)c(F)c1 ZINC000123458632 944363652 /nfs/dbraw/zinc/36/36/52/944363652.db2.gz QPYAATXKEVAKOV-HOTGVXAUSA-N 0 0 363.320 3.525 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)N[C@H]1CCO[C@@H]1c1ccc(F)c(F)c1 ZINC000123458157 944363787 /nfs/dbraw/zinc/36/37/87/944363787.db2.gz QPYAATXKEVAKOV-JKSUJKDBSA-N 0 0 363.320 3.525 20 5 FHBDRN Cc1c(NC(=O)N[C@H](c2cccs2)C(C)(C)CO)cccc1[N+](=O)[O-] ZINC000436498070 944366163 /nfs/dbraw/zinc/36/61/63/944366163.db2.gz RHLSBDJDUKEXMQ-OAHLLOKOSA-N 0 0 363.439 3.846 20 5 FHBDRN Cc1sc(S(=O)(=O)N[C@@H](c2ccccc2C)C2CC2)cc1[N+](=O)[O-] ZINC000467404019 944378131 /nfs/dbraw/zinc/37/81/31/944378131.db2.gz YCGUENKYSABDMU-MRXNPFEDSA-N 0 0 366.464 3.703 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H](COC)C1 ZINC000506494719 944380114 /nfs/dbraw/zinc/38/01/14/944380114.db2.gz MTNLQHKCMFJEKR-CYBMUJFWSA-N 0 0 352.456 3.596 20 5 FHBDRN O=C(NCCNc1ccc([N+](=O)[O-])cc1)N[C@@H]1C[C@H]1c1cccc(Cl)c1 ZINC000437888389 944380464 /nfs/dbraw/zinc/38/04/64/944380464.db2.gz JNRHJSSYUDABRH-DLBZAZTESA-N 0 0 374.828 3.515 20 5 FHBDRN C[C@@H](NC(=O)[C@@H](c1cccc(Cl)c1)N(C)C)c1cccc([N+](=O)[O-])c1 ZINC000518443808 944381753 /nfs/dbraw/zinc/38/17/53/944381753.db2.gz SDVIFEVQONEKIO-SJKOYZFVSA-N 0 0 361.829 3.728 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])Cn1nc(-c2ccccc2)n(C)c1=S ZINC000025478967 944382182 /nfs/dbraw/zinc/38/21/82/944382182.db2.gz MABROSFPWLSLCP-UHFFFAOYSA-N 0 0 369.450 3.616 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(N2CCC[C@@H](c3ccccc3)CC2)n1 ZINC000439168515 944391078 /nfs/dbraw/zinc/39/10/78/944391078.db2.gz LNRWHTZXRRZZBY-OAHLLOKOSA-N 0 0 355.394 3.551 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)Nc1ccc(OCC(F)(F)F)cc1 ZINC000073694691 944391632 /nfs/dbraw/zinc/39/16/32/944391632.db2.gz RKDAUULPXVPJJI-UHFFFAOYSA-N 0 0 354.284 3.717 20 5 FHBDRN COc1ccccc1[C@@]1(C)C[C@H]1NC(=O)Nc1ccc([N+](=O)[O-])c(C)c1 ZINC000473765629 944392136 /nfs/dbraw/zinc/39/21/36/944392136.db2.gz BKCONBWWFBXPHP-IEBWSBKVSA-N 0 0 355.394 3.764 20 5 FHBDRN O=C(Nc1ccc(N2CCCCC2)c2ncccc12)c1ccc([N+](=O)[O-])[nH]1 ZINC000473599496 944394787 /nfs/dbraw/zinc/39/47/87/944394787.db2.gz ODHKTDPLKFMAQK-UHFFFAOYSA-N 0 0 365.393 3.714 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@](C)(O)[C@H](C)CC ZINC000506500598 944400348 /nfs/dbraw/zinc/40/03/48/944400348.db2.gz QTISGIBQAXNRHM-SJKOYZFVSA-N 0 0 354.472 3.624 20 5 FHBDRN CCC[C@H](NC(=O)Nc1ccc([N+](=O)[O-])c(C)c1)c1nnc2ccccn21 ZINC000473770333 944402951 /nfs/dbraw/zinc/40/29/51/944402951.db2.gz SXXHGPPPRNJHRC-AWEZNQCLSA-N 0 0 368.397 3.609 20 5 FHBDRN CCc1oc2ccccc2c1CN(C)C(=O)COc1cccc([N+](=O)[O-])c1 ZINC000105978665 944406417 /nfs/dbraw/zinc/40/64/17/944406417.db2.gz HSOLPERGTSLYJR-UHFFFAOYSA-N 0 0 368.389 3.941 20 5 FHBDRN C[C@@H](Cc1cccc(O)c1)NC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000438189664 944406602 /nfs/dbraw/zinc/40/66/02/944406602.db2.gz UIFINVXLUOLGBG-JTQLQIEISA-N 0 0 368.311 3.680 20 5 FHBDRN Cc1cc(NC(=O)N[C@@H]2CCCN(c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000473774133 944412897 /nfs/dbraw/zinc/41/28/97/944412897.db2.gz GFGIUJVLMINCRY-MRXNPFEDSA-N 0 0 354.410 3.694 20 5 FHBDRN Cc1ccc([C@H](C)N(C)C(=O)NCCOc2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000517590493 944421233 /nfs/dbraw/zinc/42/12/33/944421233.db2.gz IRXWIRWWXXHQEB-INIZCTEOSA-N 0 0 371.437 3.993 20 5 FHBDRN CC(C)(C)CN(CC(F)(F)F)C(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000566642599 944421953 /nfs/dbraw/zinc/42/19/53/944421953.db2.gz VTRGYAXWQMGXMH-UHFFFAOYSA-N 0 0 368.302 3.853 20 5 FHBDRN CO[C@@H](c1ccccc1F)[C@@H](C)NC(=O)Nc1ccc([N+](=O)[O-])c(C)c1 ZINC000473776322 944423322 /nfs/dbraw/zinc/42/33/22/944423322.db2.gz NAPXZGXNPPTOIK-SJKOYZFVSA-N 0 0 361.373 3.940 20 5 FHBDRN CC1(C)C[C@@H]1CNC(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000426309636 944424275 /nfs/dbraw/zinc/42/42/75/944424275.db2.gz KLULFBBBSKQTIT-OAHLLOKOSA-N 0 0 354.406 3.950 20 5 FHBDRN Cc1cc(NC(=O)N[C@@H](C)c2ccc([S@@](C)=O)cc2)ccc1[N+](=O)[O-] ZINC000473774325 944427271 /nfs/dbraw/zinc/42/72/71/944427271.db2.gz SFJUOEUWEYFWHE-UOXLDJKESA-N 0 0 361.423 3.523 20 5 FHBDRN Cc1cn(Cc2coc(-c3ccc(C(F)(F)F)cc3)n2)nc1[N+](=O)[O-] ZINC000439199927 944429554 /nfs/dbraw/zinc/42/95/54/944429554.db2.gz PHNXCIUKBHTBKL-UHFFFAOYSA-N 0 0 352.272 3.822 20 5 FHBDRN CSc1ccc(C(=O)c2ccccc2C(=O)NCC(C)C)cc1[N+](=O)[O-] ZINC000024597015 944431457 /nfs/dbraw/zinc/43/14/57/944431457.db2.gz OASACBQWIMZWDL-UHFFFAOYSA-N 0 0 372.446 3.934 20 5 FHBDRN C/C=C/c1ccc(OC[C@H](O)COc2ccc(C)cc2[N+](=O)[O-])c(OC)c1 ZINC000516020601 944432723 /nfs/dbraw/zinc/43/27/23/944432723.db2.gz PNXLGTZLQCXRCO-DWTRPJMMSA-N 0 0 373.405 3.764 20 5 FHBDRN Cc1ccc(S(=O)(=O)N2CC[C@H](C)C[C@@H]2c2ccco2)c([N+](=O)[O-])c1 ZINC000439219478 944434935 /nfs/dbraw/zinc/43/49/35/944434935.db2.gz AEKVRJDLXLAMHC-UONOGXRCSA-N 0 0 364.423 3.658 20 5 FHBDRN Cc1cc(NC(=O)N[C@H](C)COc2ccc(F)cc2F)ccc1[N+](=O)[O-] ZINC000473780347 944437074 /nfs/dbraw/zinc/43/70/74/944437074.db2.gz UGBLPSRNBUNPMD-LLVKDONJSA-N 0 0 365.336 3.770 20 5 FHBDRN C[C@H]1Sc2ccccc2N(S(=O)(=O)c2csc([N+](=O)[O-])c2)[C@@H]1C ZINC000123857730 944437841 /nfs/dbraw/zinc/43/78/41/944437841.db2.gz GSXOAUUVLQUWDV-NXEZZACHSA-N 0 0 370.477 3.734 20 5 FHBDRN CC1(c2ccccc2)CCC(NC(=O)c2c(N)cccc2[N+](=O)[O-])CC1 ZINC000500296536 944443982 /nfs/dbraw/zinc/44/39/82/944443982.db2.gz KOAHWEDMGMLTKM-UHFFFAOYSA-N 0 0 353.422 3.807 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NCC(=O)N(C)[C@H]1CCCc2ccccc21 ZINC000500297761 944444454 /nfs/dbraw/zinc/44/44/54/944444454.db2.gz VGUKOZKIWSJTLG-IBGZPJMESA-N 0 0 353.422 3.851 20 5 FHBDRN CCn1c(C)nc([N+](=O)[O-])c1Sc1nc(C2CC2)n(-c2ccccc2)n1 ZINC000517613723 944444577 /nfs/dbraw/zinc/44/45/77/944444577.db2.gz RILSLMCOPPUIEP-UHFFFAOYSA-N 0 0 370.438 3.729 20 5 FHBDRN COC(=O)/C=C\c1ccc(OCc2c(F)cccc2[N+](=O)[O-])c(OC)c1 ZINC000728791059 944444662 /nfs/dbraw/zinc/44/46/62/944444662.db2.gz NWEALXJBTCVOQG-CLFYSBASSA-N 0 0 361.325 3.508 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)C1(Oc2ccc(Cl)cc2)CC1 ZINC000550212104 944447607 /nfs/dbraw/zinc/44/76/07/944447607.db2.gz OPHHJCNSRAQOFJ-UHFFFAOYSA-N 0 0 360.797 3.818 20 5 FHBDRN O=[N+]([O-])c1ccn(C2CCN(Cc3csc(Cl)c3Cl)CC2)n1 ZINC000425971182 944455584 /nfs/dbraw/zinc/45/55/84/944455584.db2.gz NFHAXJYWONKMQO-UHFFFAOYSA-N 0 0 361.254 3.997 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2nc(CNc3ccnn3CC3CC3)cs2)c1 ZINC000123863937 944457809 /nfs/dbraw/zinc/45/78/09/944457809.db2.gz XLTSCNVATRBSGY-UHFFFAOYSA-N 0 0 355.423 3.937 20 5 FHBDRN O=C(c1cc(Cl)cc(Cl)c1[N+](=O)[O-])N1CC[C@@H]([C@@H]2CCCO2)C1 ZINC000894703815 944457931 /nfs/dbraw/zinc/45/79/31/944457931.db2.gz HGNKITZZPFVTSU-RNCFNFMXSA-N 0 0 359.209 3.543 20 5 FHBDRN COc1cc(C)c([C@H](C)NC(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1OC ZINC000046816644 944458950 /nfs/dbraw/zinc/45/89/50/944458950.db2.gz CAFPZZYHYOGUEA-ZDUSSCGKSA-N 0 0 358.394 3.720 20 5 FHBDRN O=C(N[C@@H]1C[C@H]1c1ccccc1C(F)(F)F)c1cc([O-])cc([N+](=O)[O-])c1 ZINC000506198791 944459363 /nfs/dbraw/zinc/45/93/63/944459363.db2.gz KWTOEIXCNFNOOH-DZGCQCFKSA-N 0 0 366.295 3.605 20 5 FHBDRN O=C(NC1(C(F)F)CC1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000500303305 944459345 /nfs/dbraw/zinc/45/93/45/944459345.db2.gz IDXRYPZYZIJFRW-UHFFFAOYSA-N 0 0 361.348 3.734 20 5 FHBDRN CN(Cc1ccccc1F)C(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000584563269 944462450 /nfs/dbraw/zinc/46/24/50/944462450.db2.gz HJCADICQZWQGFV-UHFFFAOYSA-N 0 0 370.384 3.599 20 5 FHBDRN CCOc1cc(NC(=O)N[C@H]2CCC[C@@H](F)C2)c([N+](=O)[O-])cc1OCC ZINC000518524663 944471036 /nfs/dbraw/zinc/47/10/36/944471036.db2.gz JEMYDKCXIIEMFD-NEPJUHHUSA-N 0 0 369.393 3.794 20 5 FHBDRN CN(Cn1c2cc([N+](=O)[O-])ccc2oc1=S)[C@@H]1CCCc2c1cnn2C ZINC000162674139 944477958 /nfs/dbraw/zinc/47/79/58/944477958.db2.gz QFUJHVHKPANKRG-CYBMUJFWSA-N 0 0 373.438 3.572 20 5 FHBDRN Cc1nc(-c2ccccc2)sc1[C@@H](C)NC(=O)c1cc([N+](=O)[O-])cn1C ZINC000517657960 944483212 /nfs/dbraw/zinc/48/32/12/944483212.db2.gz QVWRMEMFLTWVLI-LLVKDONJSA-N 0 0 370.434 3.856 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)c1ccc(Oc2ccccc2)nc1 ZINC000054167553 944483540 /nfs/dbraw/zinc/48/35/40/944483540.db2.gz AHNVTJMEGZKQKH-UHFFFAOYSA-N 0 0 363.373 3.755 20 5 FHBDRN Cc1cc(NC(=O)N2CC[C@@H](COc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000473788143 944484183 /nfs/dbraw/zinc/48/41/83/944484183.db2.gz OYKQVNAVZHKDEX-OAHLLOKOSA-N 0 0 355.394 3.836 20 5 FHBDRN CC(=O)c1ccc(OCc2cncn2Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000438309108 944493096 /nfs/dbraw/zinc/49/30/96/944493096.db2.gz XKPJGNOLVQZCLM-UHFFFAOYSA-N 0 0 351.362 3.621 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(Sc2nnc(-c3ccccc3Cl)n2C)n1 ZINC000120707914 944493936 /nfs/dbraw/zinc/49/39/36/944493936.db2.gz OIUAQFJZDJWNDL-UHFFFAOYSA-N 0 0 361.814 3.898 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](c1nc2ccccc2[nH]1)C(C)C ZINC000072752945 944495665 /nfs/dbraw/zinc/49/56/65/944495665.db2.gz VPGWVGMJGLIUMC-QGZVFWFLSA-N 0 0 368.393 3.607 20 5 FHBDRN CCOCc1nc(C)cc(Oc2cc(Br)ccc2[N+](=O)[O-])n1 ZINC000894721164 944496909 /nfs/dbraw/zinc/49/69/09/944496909.db2.gz BSQHOEDDNCPMPF-UHFFFAOYSA-N 0 0 368.187 3.785 20 5 FHBDRN O=C(NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)c1cccc2cnccc21 ZINC000516113540 944498266 /nfs/dbraw/zinc/49/82/66/944498266.db2.gz DIEXMWNGUXOXBI-UHFFFAOYSA-N 0 0 360.373 3.597 20 5 FHBDRN CC(C)c1ccc(CN2CCC(Oc3cnccn3)CC2)cc1[N+](=O)[O-] ZINC000425982411 944499146 /nfs/dbraw/zinc/49/91/46/944499146.db2.gz WQNUPMPFUJCOJU-UHFFFAOYSA-N 0 0 356.426 3.552 20 5 FHBDRN CN(c1cc2nc[nH]c(=O)c2cc1[N+](=O)[O-])[C@H]1CC[C@@H](C(F)(F)F)CC1 ZINC000516109333 944510740 /nfs/dbraw/zinc/51/07/40/944510740.db2.gz BEIIUDIGWVOOJY-AOOOYVTPSA-N 0 0 370.331 3.801 20 5 FHBDRN Cc1ccc2c(c1)[C@H](NC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1)CO2 ZINC000123895214 944511335 /nfs/dbraw/zinc/51/13/35/944511335.db2.gz NUSTXBSQUNXPMZ-GOSISDBHSA-N 0 0 367.405 3.711 20 5 FHBDRN CC(C)n1nc2c(c1NC(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1)CCC2 ZINC000473800991 944523197 /nfs/dbraw/zinc/52/31/97/944523197.db2.gz AKRAOQJFFCRGQE-GFCCVEGCSA-N 0 0 357.414 3.744 20 5 FHBDRN Cc1c(OC(=O)[C@H](OC2CCOCC2)c2ccccc2)cccc1[N+](=O)[O-] ZINC000759840790 944524358 /nfs/dbraw/zinc/52/43/58/944524358.db2.gz AUVYZBXJDZDLGS-LJQANCHMSA-N 0 0 371.389 3.746 20 5 FHBDRN Cc1ccc(NC(=O)N(C)C)cc1NC(=O)c1ccc([N+](=O)[O-])cc1C ZINC000437907219 944535055 /nfs/dbraw/zinc/53/50/55/944535055.db2.gz ISULLVCRPOGKKN-UHFFFAOYSA-N 0 0 356.382 3.557 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])NCCc1cc2ccccc2s1 ZINC000506548060 944538850 /nfs/dbraw/zinc/53/88/50/944538850.db2.gz MIOCNBFSLMUDKH-UHFFFAOYSA-N 0 0 355.419 3.580 20 5 FHBDRN C[C@H](Cc1ccc(C(F)(F)F)cc1)NC(=O)Cc1ccccc1[N+](=O)[O-] ZINC000110557331 944541044 /nfs/dbraw/zinc/54/10/44/944541044.db2.gz CXWMBJNBSBVKKP-GFCCVEGCSA-N 0 0 366.339 3.904 20 5 FHBDRN Cc1ccc(NC(=O)[C@@H](NC(=O)CC(C)C)c2ccccc2)cc1[N+](=O)[O-] ZINC000110577412 944547305 /nfs/dbraw/zinc/54/73/05/944547305.db2.gz YHLGRLNQSIWPQI-IBGZPJMESA-N 0 0 369.421 3.745 20 5 FHBDRN CSc1ccc(C(=O)NCCc2cc(F)cc(F)c2)cc1[N+](=O)[O-] ZINC000500340355 944567613 /nfs/dbraw/zinc/56/76/13/944567613.db2.gz KYROQUFDCUBTIG-UHFFFAOYSA-N 0 0 352.362 3.567 20 5 FHBDRN C[C@H]1C[C@H](C)CN(c2ccc(C(=O)NC3(C(F)F)CC3)cc2[N+](=O)[O-])C1 ZINC000500340971 944568813 /nfs/dbraw/zinc/56/88/13/944568813.db2.gz FEAAZPCJHRRYQM-RYUDHWBXSA-N 0 0 367.396 3.605 20 5 FHBDRN Cc1nnc([C@H](C)NCc2ccc(N(C)c3ccccc3)c([N+](=O)[O-])c2)[nH]1 ZINC000894771758 944568986 /nfs/dbraw/zinc/56/89/86/944568986.db2.gz UVOCTRZUPOARPN-ZDUSSCGKSA-N 0 0 366.425 3.640 20 5 FHBDRN CO[C@@H](c1ccc(F)cc1)[C@H](C)Nc1ncnc2cccc([N+](=O)[O-])c21 ZINC000541578929 944571921 /nfs/dbraw/zinc/57/19/21/944571921.db2.gz ORUPFPFNLVUAPJ-APPDUMDISA-N 0 0 356.357 3.865 20 5 FHBDRN CCOC(=O)c1cc(C(=O)N(C)CCC2CCCCC2)cc([N+](=O)[O-])c1 ZINC000506224436 944578258 /nfs/dbraw/zinc/57/82/58/944578258.db2.gz QSBHRGCAGNPYJQ-UHFFFAOYSA-N 0 0 362.426 3.814 20 5 FHBDRN O=C(NCCOc1cccc(Cl)c1Cl)c1cccc([N+](=O)[O-])c1 ZINC000516221853 944583648 /nfs/dbraw/zinc/58/36/48/944583648.db2.gz MDHCSWYDGRHQHP-UHFFFAOYSA-N 0 0 355.177 3.710 20 5 FHBDRN CC(C)N(Cc1cccs1)S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000518659639 944584844 /nfs/dbraw/zinc/58/48/44/944584844.db2.gz AFZYYROFSYERGK-UHFFFAOYSA-N 0 0 374.871 3.909 20 5 FHBDRN O=[N+]([O-])c1cncc(Cl)c1OCCOc1cccc(Br)c1 ZINC000506569582 944596129 /nfs/dbraw/zinc/59/61/29/944596129.db2.gz CVKHOAUIUUCBDF-UHFFFAOYSA-N 0 0 373.590 3.864 20 5 FHBDRN C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1cccc2c1OCC2(C)C ZINC000518685477 944596392 /nfs/dbraw/zinc/59/63/92/944596392.db2.gz TXCKYUBRGIASSR-LBPRGKRZSA-N 0 0 352.390 3.856 20 5 FHBDRN CC[C@H](NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)c1ccc(C)cc1 ZINC000506570884 944598618 /nfs/dbraw/zinc/59/86/18/944598618.db2.gz JJVGGJGWNFLPPD-IBGZPJMESA-N 0 0 364.405 3.970 20 5 FHBDRN CC(C)c1ccc(C(=O)NCc2cn3cc(Cl)ccc3n2)cc1[N+](=O)[O-] ZINC000439413706 944602858 /nfs/dbraw/zinc/60/28/58/944602858.db2.gz YPBRICFPHSPZBM-UHFFFAOYSA-N 0 0 372.812 3.949 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCS[C@@H]2CCCC[C@@H]21 ZINC000438449893 944614730 /nfs/dbraw/zinc/61/47/30/944614730.db2.gz UFVRSQZDWPSWHO-VBNZEHGJSA-N 0 0 366.508 3.962 20 5 FHBDRN CN(C(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1)c1nncs1 ZINC000184327612 944621560 /nfs/dbraw/zinc/62/15/60/944621560.db2.gz VNCIQRFEIKMDOU-UHFFFAOYSA-N 0 0 372.431 3.874 20 5 FHBDRN O=C(c1ccccc1)c1ccc(N[C@H](CCO)c2ccco2)c([N+](=O)[O-])c1 ZINC000184346598 944625394 /nfs/dbraw/zinc/62/53/94/944625394.db2.gz HUALEZADUTXBFE-QGZVFWFLSA-N 0 0 366.373 3.954 20 5 FHBDRN CCSc1ccc(Cc2nc(-c3ccc(N)c([N+](=O)[O-])c3)no2)cc1 ZINC000545548945 944625775 /nfs/dbraw/zinc/62/57/75/944625775.db2.gz WDFNZFNOHORKAU-UHFFFAOYSA-N 0 0 356.407 3.930 20 5 FHBDRN CC(=O)N(C)c1ccccc1NC(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000473840980 944637221 /nfs/dbraw/zinc/63/72/21/944637221.db2.gz FLRHURBJRIWYKA-UHFFFAOYSA-N 0 0 355.394 3.953 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@H+](C)C[C@@H](C)c1ccccc1 ZINC000066854637 944639490 /nfs/dbraw/zinc/63/94/90/944639490.db2.gz OMZNJNLZNMEOBX-CABCVRRESA-N 0 0 371.437 3.666 20 5 FHBDRN Cc1nc(-c2ccc(CNc3ccc(C(N)=O)cc3[N+](=O)[O-])s2)cs1 ZINC000015118309 944646594 /nfs/dbraw/zinc/64/65/94/944646594.db2.gz JOGNNPBNDNMJNG-UHFFFAOYSA-N 0 0 374.447 3.799 20 5 FHBDRN COc1cc(-c2noc(/C=C(/C)c3ccc([N+](=O)[O-])cc3)n2)ccc1O ZINC000436815623 944652809 /nfs/dbraw/zinc/65/28/09/944652809.db2.gz OZQMDKROFDJQRJ-LUAWRHEFSA-N 0 0 353.334 3.920 20 5 FHBDRN O=[N+]([O-])c1cccc(CCc2nc(-c3ccnc(C(F)(F)F)c3)no2)c1 ZINC000566705924 944658516 /nfs/dbraw/zinc/65/85/16/944658516.db2.gz TVPUUQURPUGSPH-UHFFFAOYSA-N 0 0 364.283 3.844 20 5 FHBDRN CN(Cc1ccccc1OC(F)(F)F)C(=O)c1csc([N+](=O)[O-])c1 ZINC000044467838 944669358 /nfs/dbraw/zinc/66/93/58/944669358.db2.gz RKKRIXWSEKOQOI-UHFFFAOYSA-N 0 0 360.313 3.827 20 5 FHBDRN C[C@@H](NC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F)c1ccc2n[nH]cc2c1 ZINC000516300697 944685160 /nfs/dbraw/zinc/68/51/60/944685160.db2.gz HCGSVZBMHXTMGN-LLVKDONJSA-N 0 0 370.384 3.765 20 5 FHBDRN Cc1c(NC(=O)N[C@H](C)[C@@H]2Oc3ccccc3[C@H]2C)cccc1[N+](=O)[O-] ZINC000438492370 944685254 /nfs/dbraw/zinc/68/52/54/944685254.db2.gz MQSHFADABSKMJR-AEDCBLDQSA-N 0 0 355.394 3.978 20 5 FHBDRN CC(C)(C(=O)NCCc1cccc2[nH]ccc21)c1ccc([N+](=O)[O-])cc1F ZINC000506252796 944694577 /nfs/dbraw/zinc/69/45/77/944694577.db2.gz HQGLFDYSKWRILT-UHFFFAOYSA-N 0 0 369.396 3.852 20 5 FHBDRN COc1cc(C(=O)NC[C@@H]2CCC[C@@H](C(F)(F)F)C2)ccc1[N+](=O)[O-] ZINC000438514632 944706860 /nfs/dbraw/zinc/70/68/60/944706860.db2.gz FIHZUIOQRUFQCX-ZYHUDNBSSA-N 0 0 360.332 3.702 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])N[C@@H](c1ccc(F)cc1)C1CCC1 ZINC000517843536 944707030 /nfs/dbraw/zinc/70/70/30/944707030.db2.gz WCWVXHOLGLTWPD-LJQANCHMSA-N 0 0 357.385 3.803 20 5 FHBDRN COc1ccc(CC(=O)N[C@@H](c2ccccc2)C2CCC2)cc1[N+](=O)[O-] ZINC000517843509 944707072 /nfs/dbraw/zinc/70/70/72/944707072.db2.gz VFFFXNWTMNQLNR-FQEVSTJZSA-N 0 0 354.406 3.804 20 5 FHBDRN CCC1(CC)[C@H](OC)C[C@H]1N(C)C(=O)Nc1ccc(OC)c([N+](=O)[O-])c1 ZINC000543887522 944716993 /nfs/dbraw/zinc/71/69/93/944716993.db2.gz WHPWWIWTWPWKBQ-HZPDHXFCSA-N 0 0 365.430 3.661 20 5 FHBDRN CCC1(CC)[C@H](N(C)C(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)C[C@@H]1OC ZINC000543887520 944717546 /nfs/dbraw/zinc/71/75/46/944717546.db2.gz WHPWWIWTWPWKBQ-CVEARBPZSA-N 0 0 365.430 3.661 20 5 FHBDRN O=C([O-])[C@H](Cc1c[nH]c2ccc([N+](=O)[O-])cc12)[NH2+]CC1CCCCCC1 ZINC000426722847 944723894 /nfs/dbraw/zinc/72/38/94/944723894.db2.gz JCPXSMMLCOUXHS-SFHVURJKSA-N 0 0 359.426 3.632 20 5 FHBDRN Cc1ccc(N2CCN(C(=O)c3cc(Cl)ccc3[N+](=O)[O-])CC2)cc1C ZINC000759884958 944729421 /nfs/dbraw/zinc/72/94/21/944729421.db2.gz CTBLVDYNBUSVGF-UHFFFAOYSA-N 0 0 373.840 3.827 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])Nc1ccc(OC2CCCC2)cc1 ZINC000516332082 944732228 /nfs/dbraw/zinc/73/22/28/944732228.db2.gz QONCQMQJSQIACM-UHFFFAOYSA-N 0 0 355.394 3.967 20 5 FHBDRN CCc1ccc(-c2nc(Cc3c[nH]c4ccc([N+](=O)[O-])cc34)no2)c(O)c1 ZINC000436867528 944734907 /nfs/dbraw/zinc/73/49/07/944734907.db2.gz CNULXCZMGQDXCJ-UHFFFAOYSA-N 0 0 364.361 3.985 20 5 FHBDRN CCn1c(C)nc([N+](=O)[O-])c1N[C@@H]1CC[C@@H](c2ccccc2)C[C@@H]1OC ZINC000516337411 944738905 /nfs/dbraw/zinc/73/89/05/944738905.db2.gz JIXFRSPYMNSSCA-ZACQAIPSSA-N 0 0 358.442 3.883 20 5 FHBDRN CCN(c1cccc(C)c1)S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000516341658 944744486 /nfs/dbraw/zinc/74/44/86/944744486.db2.gz PWIARMUJUVVDBR-UHFFFAOYSA-N 0 0 354.815 3.772 20 5 FHBDRN Cc1cccc2c1CC[C@@H]2NS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000517868460 944745140 /nfs/dbraw/zinc/74/51/40/944745140.db2.gz SEXPDWACDGJGHD-HNNXBMFYSA-N 0 0 366.826 3.522 20 5 FHBDRN COC1CCC(CC(=O)N2CCS[C@@H]2c2ccc([N+](=O)[O-])cc2)CC1 ZINC000759887950 944751106 /nfs/dbraw/zinc/75/11/06/944751106.db2.gz DXHDKXLCWOFXKM-PVCYVWKFSA-N 0 0 364.467 3.764 20 5 FHBDRN O=C([O-])[C@@H](CC1CCCC1)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000426738453 944751220 /nfs/dbraw/zinc/75/12/20/944751220.db2.gz WKBQHFWSCLIVFM-MRXNPFEDSA-N 0 0 358.394 3.978 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)NCc2cccc(Cl)c2Cl)c1 ZINC000517872033 944751365 /nfs/dbraw/zinc/75/13/65/944751365.db2.gz YTDSKTCKVREYOU-UHFFFAOYSA-N 0 0 355.177 3.840 20 5 FHBDRN O=C([O-])[C@@H](Cc1cc(Cl)cc(Cl)c1)[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000426739389 944752147 /nfs/dbraw/zinc/75/21/47/944752147.db2.gz BYYDDGKFAHVRJJ-OAHLLOKOSA-N 0 0 369.204 3.687 20 5 FHBDRN CC(C)(C)OCc1cccc(CNC(=O)c2cc(F)cc([N+](=O)[O-])c2)c1 ZINC000518786876 944766583 /nfs/dbraw/zinc/76/65/83/944766583.db2.gz DYHJXWYFPMLIML-UHFFFAOYSA-N 0 0 360.385 3.979 20 5 FHBDRN COc1ccc(NC(=O)NCC(C)(C)c2cccc(F)c2)cc1[N+](=O)[O-] ZINC000543887383 944767319 /nfs/dbraw/zinc/76/73/19/944767319.db2.gz QODRBQMYRKFHDX-UHFFFAOYSA-N 0 0 361.373 3.842 20 5 FHBDRN COc1ccc(-c2ccc(C[NH2+][C@@H]3CCC[C@@]3(C)C(=O)[O-])o2)c([N+](=O)[O-])c1 ZINC000426748955 944768147 /nfs/dbraw/zinc/76/81/47/944768147.db2.gz BJYDKJPDUZGBMN-IEBWSBKVSA-N 0 0 374.393 3.596 20 5 FHBDRN O=C(NCCSc1ccccc1)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000015136739 944771640 /nfs/dbraw/zinc/77/16/40/944771640.db2.gz PSGVBEQGDIAEMP-UHFFFAOYSA-N 0 0 371.462 3.717 20 5 FHBDRN C[C@@]1(C(=O)[O-])CCCC[C@@H]1[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000426755217 944775723 /nfs/dbraw/zinc/77/57/23/944775723.db2.gz XPCCIEZBNFMJIE-PKOBYXMFSA-N 0 0 358.394 3.978 20 5 FHBDRN C[C@](O)(CNC(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F)C1CCCCC1 ZINC000506278740 944776283 /nfs/dbraw/zinc/77/62/83/944776283.db2.gz GTSFIZOUXQMWRY-INIZCTEOSA-N 0 0 374.359 3.675 20 5 FHBDRN CC1(C)C(=O)N[C@@H]1C1CCN(c2c(Cl)cc(Cl)cc2[N+](=O)[O-])CC1 ZINC000518799651 944793316 /nfs/dbraw/zinc/79/33/16/944793316.db2.gz NHRNVCBPSDOMJP-CQSZACIVSA-N 0 0 372.252 3.643 20 5 FHBDRN CC(C)(C)OC(=O)C[C@@H]1CCCN(c2c3c(ccc2[N+](=O)[O-])NCC3)C1 ZINC000516383626 944800659 /nfs/dbraw/zinc/80/06/59/944800659.db2.gz ADKJXRLNHPRCPA-ZDUSSCGKSA-N 0 0 361.442 3.511 20 5 FHBDRN O=[N+]([O-])c1cnc(N(CCC(F)(F)F)CC2CC2)c(Br)c1 ZINC000439608604 944806923 /nfs/dbraw/zinc/80/69/23/944806923.db2.gz YKXKZGYVCUGMME-UHFFFAOYSA-N 0 0 368.153 3.921 20 5 FHBDRN CO[C@@H](C)c1nc(CNc2ncc([N+](=O)[O-])cc2Br)cs1 ZINC000439611438 944810831 /nfs/dbraw/zinc/81/08/31/944810831.db2.gz MJRDYDUVRWJRRQ-ZETCQYMHSA-N 0 0 373.232 3.528 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)c1ccc(OC(F)F)c(F)c1 ZINC000500409859 944811036 /nfs/dbraw/zinc/81/10/36/944811036.db2.gz JSEJANLCXWIKHB-UHFFFAOYSA-N 0 0 374.702 3.919 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])NCCCc1cccc(C(F)(F)F)c1 ZINC000506984951 944831160 /nfs/dbraw/zinc/83/11/60/944831160.db2.gz VRSWMXLYYYAGRH-UHFFFAOYSA-N 0 0 366.339 3.905 20 5 FHBDRN COC(=O)c1c(C)c(NC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc32)ccc1F ZINC000426809521 944831383 /nfs/dbraw/zinc/83/13/83/944831383.db2.gz DTFRRTKIMVTSCF-UHFFFAOYSA-N 0 0 371.324 3.563 20 5 FHBDRN Cc1ccc(C(C)(C)CNC(=O)NCCOc2ccc([N+](=O)[O-])cc2)cc1 ZINC000518827750 944838164 /nfs/dbraw/zinc/83/81/64/944838164.db2.gz MFYOWECNJOYSJY-UHFFFAOYSA-N 0 0 371.437 3.559 20 5 FHBDRN O=C(NCCOc1ccc([N+](=O)[O-])cc1)C1(c2ccccc2)CCCC1 ZINC000518846673 944838915 /nfs/dbraw/zinc/83/89/15/944838915.db2.gz ICBHMLZVECGQEM-UHFFFAOYSA-N 0 0 354.406 3.602 20 5 FHBDRN Cc1ccc(-c2noc([C@@H](C)c3ccc4c(c3)OCO4)n2)cc1[N+](=O)[O-] ZINC000426456700 944842430 /nfs/dbraw/zinc/84/24/30/944842430.db2.gz WIFOAYAWKJKDPB-NSHDSACASA-N 0 0 353.334 3.834 20 5 FHBDRN Nc1c(C(=O)Nc2cccc(OC3CCCC3)c2)cc(F)cc1[N+](=O)[O-] ZINC000516435274 944845346 /nfs/dbraw/zinc/84/53/46/944845346.db2.gz QJAAVRASVBCQCP-UHFFFAOYSA-N 0 0 359.357 3.890 20 5 FHBDRN CCNc1ccc(C(=O)N(CCOC)[C@H](C)c2ccccc2)cc1[N+](=O)[O-] ZINC000500421069 944848294 /nfs/dbraw/zinc/84/82/94/944848294.db2.gz FILBDKDKLMURKA-OAHLLOKOSA-N 0 0 371.437 3.876 20 5 FHBDRN CC(C)N(c1ccc(Cl)cc1)S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000518842558 944852609 /nfs/dbraw/zinc/85/26/09/944852609.db2.gz ZUZBWHSPLITZLJ-UHFFFAOYSA-N 0 0 368.842 3.993 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)NCCCO[C@@H](C)c2ccccc2)c1 ZINC000517946451 944860385 /nfs/dbraw/zinc/86/03/85/944860385.db2.gz PFPWQMQWKHJDIT-AWEZNQCLSA-N 0 0 358.394 3.501 20 5 FHBDRN COc1ccc2c(c1)CCN(C(=O)Nc1ccc([N+](=O)[O-])cc1C)CC2 ZINC000439678236 944862217 /nfs/dbraw/zinc/86/22/17/944862217.db2.gz NDKPWUPFQHDGJX-UHFFFAOYSA-N 0 0 355.394 3.545 20 5 FHBDRN CCOc1ccc(CNC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc32)cc1F ZINC000106033579 944867676 /nfs/dbraw/zinc/86/76/76/944867676.db2.gz ZALQXWYJLOKEAW-UHFFFAOYSA-N 0 0 357.341 3.544 20 5 FHBDRN C[C@H](NC(=O)C(=O)Nc1ccc(C(C)(C)C)c([N+](=O)[O-])c1)C1CCCC1 ZINC000454071117 944874472 /nfs/dbraw/zinc/87/44/72/944874472.db2.gz WRCAMDYLNGNQAK-LBPRGKRZSA-N 0 0 361.442 3.526 20 5 FHBDRN O=[N+]([O-])c1c(NCCc2ccn(-c3ccccc3)n2)ccc2ncccc21 ZINC000507029722 944876931 /nfs/dbraw/zinc/87/69/31/944876931.db2.gz JUCSKWTVMHSKER-UHFFFAOYSA-N 0 0 359.389 3.983 20 5 FHBDRN Cc1csc(Sc2ccc(C(=O)NCC[C@H](C)F)cc2[N+](=O)[O-])n1 ZINC000507031497 944879174 /nfs/dbraw/zinc/87/91/74/944879174.db2.gz KLKHRXKDZMDXGO-VIFPVBQESA-N 0 0 369.443 3.989 20 5 FHBDRN O=[N+]([O-])c1ccc(C[NH2+]CCc2sccc2Br)c(F)c1 ZINC000713093902 944884461 /nfs/dbraw/zinc/88/44/61/944884461.db2.gz OSXNXUFLRVCPJU-UHFFFAOYSA-N 0 0 359.220 3.890 20 5 FHBDRN COc1cc(CN(C)c2ccc3cc([N+](=O)[O-])ccc3n2)cc(OC)c1 ZINC000511670531 944895473 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FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)N[C@H]1CC[C@H](Cc2ccccc2)C1 ZINC000438677046 944917679 /nfs/dbraw/zinc/91/76/79/944917679.db2.gz HNAMJCKMWMPPGM-SJORKVTESA-N 0 0 354.406 3.501 20 5 FHBDRN O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCCCC[C@@H]1[C@H]1CCCCC1=O ZINC000426893702 944922960 /nfs/dbraw/zinc/92/29/60/944922960.db2.gz JIYVLFYFDWRHHC-IAGOWNOFSA-N 0 0 362.401 3.878 20 5 FHBDRN O=C(Nc1nc(C2CCC2)cs1)N1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000518014098 944932395 /nfs/dbraw/zinc/93/23/95/944932395.db2.gz DJJAOYHMQUQYOD-UHFFFAOYSA-N 0 0 374.422 3.745 20 5 FHBDRN CC[C@H](C)Oc1ccc(NS(=O)(=O)c2cc([N+](=O)[O-])ccc2C)cc1 ZINC000511709474 944934631 /nfs/dbraw/zinc/93/46/31/944934631.db2.gz APKXHEJFKNOUBG-ZDUSSCGKSA-N 0 0 364.423 3.881 20 5 FHBDRN Cc1ccc(C(=O)NCCOc2ccccc2C(F)(F)F)cc1[N+](=O)[O-] ZINC000518020403 944938829 /nfs/dbraw/zinc/93/88/29/944938829.db2.gz OFABVGXOMBVOSJ-UHFFFAOYSA-N 0 0 368.311 3.731 20 5 FHBDRN COc1cc(N2CCC[C@@H](CC(=O)OC(C)(C)C)C2)ccc1[N+](=O)[O-] ZINC000518031027 944951570 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3.605 20 5 FHBDRN COc1cc(C(=O)NCCc2cc(Cl)cc(Cl)c2)ccc1[N+](=O)[O-] ZINC000511740394 944973648 /nfs/dbraw/zinc/97/36/48/944973648.db2.gz GVLVNHQMSVSQOR-UHFFFAOYSA-N 0 0 369.204 3.883 20 5 FHBDRN Cc1cc(Br)cc(Cl)c1NC(=O)c1cc([N+](=O)[O-])cn1C ZINC000516535247 944987477 /nfs/dbraw/zinc/98/74/77/944987477.db2.gz LHHCBRYZSMZZOX-UHFFFAOYSA-N 0 0 372.606 3.910 20 5 FHBDRN O=C1CCc2cc([N+](=O)[O-])c(Oc3ccccc3OC(F)F)cc2N1 ZINC000106066113 944993889 /nfs/dbraw/zinc/99/38/89/944993889.db2.gz NPZNETAMOJFITD-UHFFFAOYSA-N 0 0 350.277 3.873 20 5 FHBDRN Cc1ccc([C@@H](C)NCc2ncn(Cc3cccc(F)c3)n2)cc1[N+](=O)[O-] ZINC000437088651 945009124 /nfs/dbraw/zinc/00/91/24/945009124.db2.gz MBSVUKIJGMDFOD-CQSZACIVSA-N 0 0 369.400 3.533 20 5 FHBDRN CC[C@H](CNC(=O)c1cc([N+](=O)[O-])c(C)s1)Oc1cccc(F)c1 ZINC000439832181 945011692 /nfs/dbraw/zinc/01/16/92/945011692.db2.gz XCUIGCOYDFIHHT-GFCCVEGCSA-N 0 0 352.387 3.691 20 5 FHBDRN C[C@H](NC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)c1ccc(F)cc1F ZINC000437968528 945023788 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FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@H]1CCCO[C@@H]1C(C)C ZINC000439867076 945039917 /nfs/dbraw/zinc/03/99/17/945039917.db2.gz PVJGTGUOZHLSRL-SUMWQHHRSA-N 0 0 365.430 3.566 20 5 FHBDRN O=C1CCN1c1cccc(-c2noc(/C=C\c3ccccc3[N+](=O)[O-])n2)c1 ZINC000438812423 945044135 /nfs/dbraw/zinc/04/41/35/945044135.db2.gz HLCGHUFSMOQMPZ-HJWRWDBZSA-N 0 0 362.345 3.552 20 5 FHBDRN COc1cc(Cc2noc(C3(C(F)F)CCCC3)n2)ccc1[N+](=O)[O-] ZINC000519031814 945044473 /nfs/dbraw/zinc/04/44/73/945044473.db2.gz WGHRDJGBPIORBG-UHFFFAOYSA-N 0 0 353.325 3.654 20 5 FHBDRN COc1cc(OCC(=O)N[C@@H]2C[C@@H](C)CC[C@H]2C(C)C)ccc1[N+](=O)[O-] ZINC000519032925 945045416 /nfs/dbraw/zinc/04/54/16/945045416.db2.gz FXEJBKIOXSZTKJ-CWRNSKLLSA-N 0 0 364.442 3.559 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)NCc1cc(F)cc(F)c1 ZINC000439890406 945053522 /nfs/dbraw/zinc/05/35/22/945053522.db2.gz AMSCZVGPDQIMEW-UHFFFAOYSA-N 0 0 351.309 3.593 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H]1CCOc2ccccc21 ZINC000439891584 945054455 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FHBDRN CCOc1cc(C(=O)NC[C@@H](C)c2ccccc2)c([N+](=O)[O-])cc1OC ZINC000008332815 945389949 /nfs/dbraw/zinc/38/99/49/945389949.db2.gz DTRVOSJZWFXAAP-CYBMUJFWSA-N 0 0 358.394 3.536 20 5 FHBDRN CCN(Cc1cccc(Cl)c1)S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1 ZINC000467410375 945393007 /nfs/dbraw/zinc/39/30/07/945393007.db2.gz GQWZBQRMZFFJDD-UHFFFAOYSA-N 0 0 374.871 3.829 20 5 FHBDRN O=C(N[C@@H](c1nccs1)C(F)(F)F)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000507650987 945403961 /nfs/dbraw/zinc/40/39/61/945403961.db2.gz WYDJAUNYACKMHA-NSHDSACASA-N 0 0 370.312 3.566 20 5 FHBDRN Cc1nsc(C)c1-c1noc(-c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)n1 ZINC000426635895 945404251 /nfs/dbraw/zinc/40/42/51/945404251.db2.gz CDVISSYKGNOFOT-UHFFFAOYSA-N 0 0 369.362 3.639 20 5 FHBDRN CC(C)(C)Cc1cc(=NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)[nH][nH]1 ZINC000438019239 945409802 /nfs/dbraw/zinc/40/98/02/945409802.db2.gz BCWRPQZVHWCQNB-UHFFFAOYSA-N 0 0 370.331 3.600 20 5 FHBDRN COc1ccc(-c2ccc(C[NH2+][C@H](C)CCCC(=O)[O-])o2)c([N+](=O)[O-])c1 ZINC000426633663 945416158 /nfs/dbraw/zinc/41/61/58/945416158.db2.gz IIXQADLUAVYFRE-GFCCVEGCSA-N 0 0 362.382 3.596 20 5 FHBDRN CC(C)OC(=O)CC[C@H](C)NC(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000473612415 945420850 /nfs/dbraw/zinc/42/08/50/945420850.db2.gz RFFUAUFLGMLXGQ-ZDUSSCGKSA-N 0 0 350.415 3.568 20 5 FHBDRN Cc1cc(CC(=O)Nc2cccc(Oc3ccc([N+](=O)[O-])cc3)c2)no1 ZINC000522682787 945436605 /nfs/dbraw/zinc/43/66/05/945436605.db2.gz BQKBQWHCIITVOA-UHFFFAOYSA-N 0 0 353.334 3.865 20 5 FHBDRN CN(C)[C@@H](CNC(=O)Nc1cccc([N+](=O)[O-])c1)c1ccccc1Cl ZINC000018180697 945445659 /nfs/dbraw/zinc/44/56/59/945445659.db2.gz NFXQCFGHWUKWSU-INIZCTEOSA-N 0 0 362.817 3.673 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000054168174 945449072 /nfs/dbraw/zinc/44/90/72/945449072.db2.gz YBOAPWVOHPMPTB-UHFFFAOYSA-N 0 0 371.374 3.690 20 5 FHBDRN C[C@H](c1cccc([N+](=O)[O-])c1)N1C(=O)[C@@H]2CC[C@@H](c3ccccc3)N2C1=O ZINC000280882080 945450623 /nfs/dbraw/zinc/45/06/23/945450623.db2.gz AHMYXZXWQVNAHV-BVGQSLNGSA-N 0 0 365.389 3.824 20 5 FHBDRN Cc1c(CC(=O)N[C@@H]2CCCC[C@H]2OCCC(C)C)cccc1[N+](=O)[O-] ZINC000438027028 945476832 /nfs/dbraw/zinc/47/68/32/945476832.db2.gz NZOQXVQSGZZFLN-IEBWSBKVSA-N 0 0 362.470 3.936 20 5 FHBDRN CCOc1ccc(NC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2)cc1F ZINC000125021595 945480927 /nfs/dbraw/zinc/48/09/27/945480927.db2.gz VBLLYYSYQHDHGE-UHFFFAOYSA-N 0 0 363.301 3.602 20 5 FHBDRN Cc1ccc(C[C@@H](C)NC(=O)NCCc2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000519490496 945481251 /nfs/dbraw/zinc/48/12/51/945481251.db2.gz FTTCNSBSNVRVHN-MRXNPFEDSA-N 0 0 355.438 3.685 20 5 FHBDRN Cc1cc(C(=O)Nc2nnc(Cc3cccc(F)c3)s2)cc([N+](=O)[O-])c1 ZINC000107164923 945496405 /nfs/dbraw/zinc/49/64/05/945496405.db2.gz TVZIKPRXHGVLBI-UHFFFAOYSA-N 0 0 372.381 3.737 20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])N1C[C@H]2CCC(=O)c3cccc1c32 ZINC000184392179 945497177 /nfs/dbraw/zinc/49/71/77/945497177.db2.gz JOPVKEPUNLGIIK-CYBMUJFWSA-N 0 0 365.389 3.504 20 5 FHBDRN COc1ccc(NC(=O)c2cc(C)n(C3CCCCC3)n2)cc1[N+](=O)[O-] ZINC000543849279 945499672 /nfs/dbraw/zinc/49/96/72/945499672.db2.gz UKFJHKIYHSPXJS-UHFFFAOYSA-N 0 0 358.398 3.866 20 5 FHBDRN CC(C)c1nn(C)cc1NC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000280784847 945502877 /nfs/dbraw/zinc/50/28/77/945502877.db2.gz POZHPUPKEINIFI-UHFFFAOYSA-N 0 0 359.430 3.894 20 5 FHBDRN CCCc1ccc([C@H](C)N(CC(N)=O)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000511876917 945503138 /nfs/dbraw/zinc/50/31/38/945503138.db2.gz XWTLMKUITDCPOA-HNNXBMFYSA-N 0 0 355.438 3.596 20 5 FHBDRN Cc1c(C(=O)Nc2c(-c3cccnc3)nc3ccccn32)cccc1[N+](=O)[O-] ZINC000440403097 945508307 /nfs/dbraw/zinc/50/83/07/945508307.db2.gz DUVJPEYHSYCUMJ-UHFFFAOYSA-N 0 0 373.372 3.865 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H](C)c1nc(-c2ccccc2)cs1 ZINC000107176328 945510840 /nfs/dbraw/zinc/51/08/40/945510840.db2.gz JJXGWTAPTKSZRS-LBPRGKRZSA-N 0 0 368.418 3.913 20 5 FHBDRN C[C@@H]1CCN(c2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])[C@H]1c1cccc(F)c1 ZINC000820727426 945540708 /nfs/dbraw/zinc/54/07/08/945540708.db2.gz LYFDDGJSVRYHDA-PIGZYNQJSA-N 0 0 368.372 3.502 20 5 FHBDRN CC(C)(C)c1csc(CCNC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)n1 ZINC000729441915 945542547 /nfs/dbraw/zinc/54/25/47/945542547.db2.gz OQWVMHSMJGMTRW-RMKNXTFCSA-N 0 0 359.451 3.721 20 5 FHBDRN CNC(=O)COc1ccc(N[C@@H](C)c2cccc([N+](=O)[O-])c2C)c(C)c1 ZINC000281226857 945559913 /nfs/dbraw/zinc/55/99/13/945559913.db2.gz UKZSDDPGZYJVHG-AWEZNQCLSA-N 0 0 357.410 3.510 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)N1CCO[C@@H](c2cccc(Cl)c2)C1 ZINC000184112779 945562796 /nfs/dbraw/zinc/56/27/96/945562796.db2.gz KTMRJMBKEXOZPU-MRXNPFEDSA-N 0 0 361.785 3.854 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1C(=O)NCCc1ccc(F)cc1Cl ZINC001126005274 945569258 /nfs/dbraw/zinc/56/92/58/945569258.db2.gz GTLLFFTYZGRCIV-UHFFFAOYSA-N 0 0 350.777 3.977 20 5 FHBDRN COc1cc(-c2noc(-c3ccc([N+](=O)[O-])cn3)n2)ccc1OC(C)C ZINC000546236501 945577568 /nfs/dbraw/zinc/57/75/68/945577568.db2.gz VUMJVXKEWLMCLH-UHFFFAOYSA-N 0 0 356.338 3.503 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)c1csc([C@@H]2CCCO2)n1 ZINC000281259815 945582234 /nfs/dbraw/zinc/58/22/34/945582234.db2.gz GRTGGTKQIOLUBF-AWEZNQCLSA-N 0 0 363.395 3.554 20 5 FHBDRN Cc1c(NC(=O)N2CCC[C@@H]2[C@@H]2C[C@@H](C)CC[C@@H]2O)cccc1[N+](=O)[O-] ZINC000281312306 945586534 /nfs/dbraw/zinc/58/65/34/945586534.db2.gz IPETZFHWDRXNMB-KYABYICQSA-N 0 0 361.442 3.697 20 5 FHBDRN CCCCOC[C@@H](C)Oc1c(Br)cc(OC)cc1[N+](=O)[O-] ZINC001226279225 945589572 /nfs/dbraw/zinc/58/95/72/945589572.db2.gz HDCLGVRFNREBAV-SNVBAGLBSA-N 0 0 362.220 3.950 20 5 FHBDRN O=[N+]([O-])c1ccc(-n2cc(-c3nc([C@@H]4CCC(F)(F)C4)no3)cn2)cc1 ZINC000281327385 945592822 /nfs/dbraw/zinc/59/28/22/945592822.db2.gz JCYNBCJCSVDBLQ-SNVBAGLBSA-N 0 0 361.308 3.733 20 5 FHBDRN CO[C@@H]1CCC[C@H]1C(=O)N(Cc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC001126572037 945601829 /nfs/dbraw/zinc/60/18/29/945601829.db2.gz BDTMPWNREGATBM-RTBURBONSA-N 0 0 354.406 3.943 20 5 FHBDRN Cc1nc(N2CCc3cc(Br)cc(F)c3C2)ccc1[N+](=O)[O-] ZINC000519634296 945603253 /nfs/dbraw/zinc/60/32/53/945603253.db2.gz KPKUTODXGBFDSQ-UHFFFAOYSA-N 0 0 366.190 3.763 20 5 FHBDRN Cc1cc(N[C@H]2CCC[C@@H](C(=O)N(C)C)C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000549524562 945614315 /nfs/dbraw/zinc/61/43/15/945614315.db2.gz WSVJUQPUHJJGRG-NEPJUHHUSA-N 0 0 373.375 3.981 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1OC(=O)c1cc2cnn(C(C)C)c2nc1C ZINC000760022999 945616791 /nfs/dbraw/zinc/61/67/91/945616791.db2.gz QBJIXPCRZAJDAQ-UHFFFAOYSA-N 0 0 354.366 3.756 20 5 FHBDRN CC(C)n1cc(Cl)c(NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)n1 ZINC000894881792 945617300 /nfs/dbraw/zinc/61/73/00/945617300.db2.gz GJMMNFRYUSPNQD-UHFFFAOYSA-N 0 0 374.731 3.879 20 5 FHBDRN O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC[C@@H]1[C@@H]1CCCOC1 ZINC000519662659 945636413 /nfs/dbraw/zinc/63/64/13/945636413.db2.gz ZXGSKIKVROXVKC-IUODEOHRSA-N 0 0 360.435 3.841 20 5 FHBDRN CCO[C@@H]1C[C@@H](NC(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)C12CCCC2 ZINC000248612047 945642542 /nfs/dbraw/zinc/64/25/42/945642542.db2.gz XVCIXQDPUIJGSP-CSMYWGQOSA-N 0 0 364.417 3.691 20 5 FHBDRN CC[C@@H]1CN(C(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)CCCO1 ZINC000281513531 945673770 /nfs/dbraw/zinc/67/37/70/945673770.db2.gz IIJLYIZXTZNNCK-OAHLLOKOSA-N 0 0 350.418 3.735 20 5 FHBDRN Cc1c(Br)c(NCc2coc3ccccc23)ncc1[N+](=O)[O-] ZINC000519720718 945674284 /nfs/dbraw/zinc/67/42/84/945674284.db2.gz HAUAJPNGXPIUMW-UHFFFAOYSA-N 0 0 362.183 3.841 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)c1c[nH]cc1-c1ccccc1 ZINC000544307046 945683220 /nfs/dbraw/zinc/68/32/20/945683220.db2.gz MARZDIPTYWGFHU-UHFFFAOYSA-N 0 0 351.362 3.529 20 5 FHBDRN COC[C@H](C)CNC(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000522708622 945689513 /nfs/dbraw/zinc/68/95/13/945689513.db2.gz BEGKGWRXIMJELD-CYBMUJFWSA-N 0 0 359.382 3.791 20 5 FHBDRN CCOc1ccccc1/C=C\c1nc(Cc2ccc([N+](=O)[O-])cn2)no1 ZINC000546486131 945696138 /nfs/dbraw/zinc/69/61/38/945696138.db2.gz ORPCRMZTBYRTTF-YFHOEESVSA-N 0 0 352.350 3.533 20 5 FHBDRN O=C(Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1)[C@@H]1[C@@H]2CCC(=O)[C@@H]21 ZINC001126031713 945716770 /nfs/dbraw/zinc/71/67/70/945716770.db2.gz NAAMHZWPRDRVQN-KBAYOESNSA-N 0 0 352.346 3.551 20 5 FHBDRN C[C@H](NCc1nccn1CCc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000164297813 945725106 /nfs/dbraw/zinc/72/51/06/945725106.db2.gz HJPMBEAJVVCNSZ-INIZCTEOSA-N 0 0 350.422 3.885 20 5 FHBDRN C[C@@H](CNC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1)Oc1ccccc1 ZINC000444018571 945728087 /nfs/dbraw/zinc/72/80/87/945728087.db2.gz DZPMGIIIIDNBLR-HNNXBMFYSA-N 0 0 372.424 3.879 20 5 FHBDRN Cc1c([N+](=O)[O-])cccc1S(=O)(=O)NC1(C(C)(C)c2ccccc2)CC1 ZINC001211850888 945738735 /nfs/dbraw/zinc/73/87/35/945738735.db2.gz YBQWZHKXUNPSGG-UHFFFAOYSA-N 0 0 374.462 3.692 20 5 FHBDRN Cc1cc(C)cc(N(C)C(=O)c2cc([N+](=O)[O-])ccc2SCCO)c1 ZINC000136554186 945739445 /nfs/dbraw/zinc/73/94/45/945739445.db2.gz RQPLMJLECUQSHL-UHFFFAOYSA-N 0 0 360.435 3.573 20 5 FHBDRN CC(C)c1ccc(C(=O)NC[C@@H](O)[C@@H](C)c2ccccc2)cc1[N+](=O)[O-] ZINC001167775692 945740660 /nfs/dbraw/zinc/74/06/60/945740660.db2.gz QVQGFVIIWMGXJP-IFXJQAMLSA-N 0 0 356.422 3.613 20 5 FHBDRN O=C(c1ccc2[nH]c3ccccc3c(=O)c2c1)N1CCOc2cc(F)ccc21 ZINC000444038986 945745407 /nfs/dbraw/zinc/74/54/07/945745407.db2.gz KJAKDNABMNCIFI-UHFFFAOYSA-N 0 0 374.371 3.860 20 5 FHBDRN COc1ccc(C[C@@H](C)Nc2c3c(ccc2[N+](=O)[O-])NCC3)cc1OC ZINC000519797061 945748052 /nfs/dbraw/zinc/74/80/52/945748052.db2.gz OBODLAUPEPJXGQ-GFCCVEGCSA-N 0 0 357.410 3.623 20 5 FHBDRN CCCN(C(=O)c1[nH]nc(CC)c1[N+](=O)[O-])[C@H](C)c1ccccc1OC ZINC000444049108 945749164 /nfs/dbraw/zinc/74/91/64/945749164.db2.gz SDAFKTYYHGCLQN-GFCCVEGCSA-N 0 0 360.414 3.502 20 5 FHBDRN Cc1cc(NC(=O)[C@H](C)c2ccccc2)n(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000181759983 945749967 /nfs/dbraw/zinc/74/99/67/945749967.db2.gz AMIVKFDHEZMLTF-CQSZACIVSA-N 0 0 350.378 3.831 20 5 FHBDRN C[C@@H](C(=O)Nc1cccc(Nc2cnn(C)c2)c1)c1cccc([N+](=O)[O-])c1 ZINC000579067424 945769440 /nfs/dbraw/zinc/76/94/40/945769440.db2.gz JFAJODKPZWOHBL-CYBMUJFWSA-N 0 0 365.393 3.814 20 5 FHBDRN Cc1nc(-c2ncccn2)sc1C(=O)Nc1c(C)ccc([N+](=O)[O-])c1C ZINC000129418096 945773319 /nfs/dbraw/zinc/77/33/19/945773319.db2.gz QJKUNGDKKQHCGC-UHFFFAOYSA-N 0 0 369.406 3.686 20 5 FHBDRN COc1ccc(CNC(=O)Nc2nc3ccsc3s2)cc1[N+](=O)[O-] ZINC000522778993 945782591 /nfs/dbraw/zinc/78/25/91/945782591.db2.gz IEDSNBUEAHRJAK-UHFFFAOYSA-N 0 0 364.408 3.596 20 5 FHBDRN CCOc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2F)c2ncccc12 ZINC000184149939 945796975 /nfs/dbraw/zinc/79/69/75/945796975.db2.gz VSQMLEVCJCQWQB-UHFFFAOYSA-N 0 0 355.325 3.933 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(C(=O)Oc2c(C)cc(F)cc2Br)n1 ZINC001271535315 945798123 /nfs/dbraw/zinc/79/81/23/945798123.db2.gz MSAGTQTZUHQLEC-UHFFFAOYSA-N 0 0 369.146 3.727 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NS(=O)(=O)Cc1ccccc1C(F)(F)F ZINC000127150307 945798181 /nfs/dbraw/zinc/79/81/81/945798181.db2.gz OULVSWLCQAEPMU-UHFFFAOYSA-N 0 0 374.340 3.864 20 5 FHBDRN Cc1nc2ccc(NC(=O)c3cc4c(cc3[N+](=O)[O-])OCCO4)cc2s1 ZINC000020676032 945801904 /nfs/dbraw/zinc/80/19/04/945801904.db2.gz FBWXPEMQGPEWTI-UHFFFAOYSA-N 0 0 371.374 3.536 20 5 FHBDRN O=C(Nc1ccc(Cl)cc1Cl)c1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000020674668 945802039 /nfs/dbraw/zinc/80/20/39/945802039.db2.gz QGIRMNYXJQWTPP-UHFFFAOYSA-N 0 0 369.160 3.925 20 5 FHBDRN CCc1n[nH]c(C(=O)N[C@H]2c3ccccc3CC[C@@H]2C(C)C)c1[N+](=O)[O-] ZINC000444366532 945808349 /nfs/dbraw/zinc/80/83/49/945808349.db2.gz FNIGJSUNIRJYPD-CZUORRHYSA-N 0 0 356.426 3.570 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N1CCC[C@H]1c1ccccc1 ZINC000044771535 945814709 /nfs/dbraw/zinc/81/47/09/945814709.db2.gz DDAXWIVQPSCRHP-AWEZNQCLSA-N 0 0 366.826 3.774 20 5 FHBDRN COc1cc(CN2CCCc3occc3C2)c([N+](=O)[O-])cc1OC(F)F ZINC000519846134 945816564 /nfs/dbraw/zinc/81/65/64/945816564.db2.gz KAPNSCVYYZWNAN-UHFFFAOYSA-N 0 0 368.336 3.746 20 5 FHBDRN COc1ccc(Cc2nc(-c3cc(F)c(F)c(F)c3)no2)c([N+](=O)[O-])c1 ZINC001211852556 945817722 /nfs/dbraw/zinc/81/77/22/945817722.db2.gz UQYHPPVAFXGJQD-UHFFFAOYSA-N 0 0 365.267 3.662 20 5 FHBDRN CNc1c(C(=O)N[C@@H]2CC[C@H](c3ccc(F)cc3)C2)cccc1[N+](=O)[O-] ZINC000473662360 945820441 /nfs/dbraw/zinc/82/04/41/945820441.db2.gz QBQMHILMGWDUGK-DZGCQCFKSA-N 0 0 357.385 3.842 20 5 FHBDRN CCSCc1ccccc1C(=O)NCCOc1ccc([N+](=O)[O-])cc1 ZINC000519853867 945823975 /nfs/dbraw/zinc/82/39/75/945823975.db2.gz NCGKALQELYASRY-UHFFFAOYSA-N 0 0 360.435 3.657 20 5 FHBDRN COc1ccc(Cc2nc(-c3cc(Cl)cnc3C)no2)c([N+](=O)[O-])c1 ZINC001211852649 945827009 /nfs/dbraw/zinc/82/70/09/945827009.db2.gz WSZHPQNJWFEFKF-UHFFFAOYSA-N 0 0 360.757 3.601 20 5 FHBDRN CO[C@H]1CCN(C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)[C@@H](C)C1 ZINC000281747261 945828903 /nfs/dbraw/zinc/82/89/03/945828903.db2.gz IUBIPTQIDGELDD-ONGXEEELSA-N 0 0 361.320 3.645 20 5 FHBDRN O=C(NCc1ccc(Oc2ccc(F)cc2)nc1)c1ccc([N+](=O)[O-])s1 ZINC000107967809 945835705 /nfs/dbraw/zinc/83/57/05/945835705.db2.gz KCGGJCKMMVJQQX-UHFFFAOYSA-N 0 0 373.365 3.913 20 5 FHBDRN O=C(c1cc(F)cc2c(=O)c3cccc(F)c3[nH]c12)N1C[C@H]2CCC[C@H]21 ZINC000444091389 945845119 /nfs/dbraw/zinc/84/51/19/945845119.db2.gz WVTJGOKZJPNNQZ-QLJPJBMISA-N 0 0 354.356 3.584 20 5 FHBDRN NC(=O)c1cc([N+](=O)[O-])cnc1N1CC=C(c2cccc3ccccc32)CC1 ZINC000519887931 945858071 /nfs/dbraw/zinc/85/80/71/945858071.db2.gz DRPAODXFLSUEEP-UHFFFAOYSA-N 0 0 374.400 3.536 20 5 FHBDRN CC(C)Sc1ccc(Cn2cnc3cc([N+](=O)[O-])ccc3c2=O)cc1 ZINC000511888814 945858185 /nfs/dbraw/zinc/85/81/85/945858185.db2.gz QHJGGFFBOGQZDQ-UHFFFAOYSA-N 0 0 355.419 3.854 20 5 FHBDRN CC(C)CN(C1CCCC1)S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000519890398 945860815 /nfs/dbraw/zinc/86/08/15/945860815.db2.gz XLKXPZZVPKDSTD-UHFFFAOYSA-N 0 0 360.863 3.838 20 5 FHBDRN CCOc1ccc(NC(=O)c2ccc(OC)c([N+](=O)[O-])c2)c2ncccc12 ZINC000184156300 945861739 /nfs/dbraw/zinc/86/17/39/945861739.db2.gz YIJDGJPJWVJZBM-UHFFFAOYSA-N 0 0 367.361 3.803 20 5 FHBDRN CC(C)(C)[C@H]1OCCC[C@H]1CNC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000522808417 945867481 /nfs/dbraw/zinc/86/74/81/945867481.db2.gz NYROAYURBBWRAB-GUYCJALGSA-N 0 0 359.426 3.647 20 5 FHBDRN Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)CC[C@H]1Cc2ccccc2NC1=O ZINC000281848306 945879637 /nfs/dbraw/zinc/87/96/37/945879637.db2.gz AZLAGCUXEAVBKE-ZDUSSCGKSA-N 0 0 371.368 3.572 20 5 FHBDRN C[C@H](C(=O)N1CCCC[C@H]1c1cccn1C)c1ccc([N+](=O)[O-])cc1F ZINC000184410781 945890471 /nfs/dbraw/zinc/89/04/71/945890471.db2.gz DHZGIITZXSXBEY-UGSOOPFHSA-N 0 0 359.401 3.930 20 5 FHBDRN C[C@@H]1CCN(C(=O)c2cc(F)cc3c(=O)c4cccc(F)c4[nH]c23)[C@@H]1C ZINC000444107641 945893353 /nfs/dbraw/zinc/89/33/53/945893353.db2.gz WNXONLJGCVGJIA-GHMZBOCLSA-N 0 0 356.372 3.830 20 5 FHBDRN Cc1nc(NCc2ccc(OCc3ccccn3)cc2)ccc1[N+](=O)[O-] ZINC000301655817 945897425 /nfs/dbraw/zinc/89/74/25/945897425.db2.gz RXAJUMPMGVBGRY-UHFFFAOYSA-N 0 0 350.378 3.884 20 5 FHBDRN COc1cccnc1NC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000522821580 945921313 /nfs/dbraw/zinc/92/13/13/945921313.db2.gz QPAWPAFOJVRWKB-UHFFFAOYSA-N 0 0 364.361 3.994 20 5 FHBDRN COc1ccccc1C1(NC(=O)/C=C(/C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000843672063 945930660 /nfs/dbraw/zinc/93/06/60/945930660.db2.gz YWFSLZSLYUHPBJ-YPKPFQOOSA-N 0 0 352.390 3.812 20 5 FHBDRN Cc1cc(NC(=O)NCc2ccccc2N2CCCC2)ccc1[N+](=O)[O-] ZINC000613778073 945943967 /nfs/dbraw/zinc/94/39/67/945943967.db2.gz VLOVPNZFUSZKIC-UHFFFAOYSA-N 0 0 354.410 3.825 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)N[C@@H]1CCCN(c2cccc(F)c2)C1 ZINC000303627874 945947805 /nfs/dbraw/zinc/94/78/05/945947805.db2.gz FFRYVNDXKGCGOR-OAHLLOKOSA-N 0 0 358.373 3.524 20 5 FHBDRN Cc1cccc(C(=O)N2CCC([C@@H](O)c3ccc(F)cc3)CC2)c1[N+](=O)[O-] ZINC000108458442 945978075 /nfs/dbraw/zinc/97/80/75/945978075.db2.gz NQWJHDNAGNIYCA-IBGZPJMESA-N 0 0 372.396 3.628 20 5 FHBDRN CCOc1cc(NC(=O)N[C@H]2CC[C@H](C)C2)c([N+](=O)[O-])cc1OCC ZINC000444148680 945994273 /nfs/dbraw/zinc/99/42/73/945994273.db2.gz QIGBUOZMIGGWRV-RYUDHWBXSA-N 0 0 351.403 3.702 20 5 FHBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])c1nc(Cc2ccccn2)no1 ZINC000546249918 945998846 /nfs/dbraw/zinc/99/88/46/945998846.db2.gz APUCYAQPDULKQP-JTQLQIEISA-N 0 0 360.757 3.757 20 5 FHBDRN C[C@@H]1Cc2ccccc2N(CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000729483333 946003097 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O=[N+]([O-])c1ccc(CN2CC[C@H](n3cnc4c3CCCC4)C2)c(Cl)c1 ZINC000614740428 946390745 /nfs/dbraw/zinc/39/07/45/946390745.db2.gz BMBYZNAZJSNELJ-HNNXBMFYSA-N 0 0 360.845 3.771 20 5 FHBDRN CCCO[C@@H]1CCCN(C(=O)c2cccc(SC)c2[N+](=O)[O-])CC1 ZINC000186474440 946391504 /nfs/dbraw/zinc/39/15/04/946391504.db2.gz GYUHMIZAMQSUJD-CYBMUJFWSA-N 0 0 352.456 3.738 20 5 FHBDRN COc1ccc(CNC(=O)[C@@H](C)CSCc2ccccc2)cc1[N+](=O)[O-] ZINC000440118017 946396226 /nfs/dbraw/zinc/39/62/26/946396226.db2.gz LKIKOPMAFOVNER-AWEZNQCLSA-N 0 0 374.462 3.789 20 5 FHBDRN COc1cc(OC)cc(C(=O)Oc2cc([N+](=O)[O-])c(Cl)cc2C)c1 ZINC001126121070 946398180 /nfs/dbraw/zinc/39/81/80/946398180.db2.gz PQLQLOABYXTZEP-UHFFFAOYSA-N 0 0 351.742 3.793 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])Nc1cccc(Br)c1 ZINC000047688503 946402473 /nfs/dbraw/zinc/40/24/73/946402473.db2.gz SEAWPKQZOQDILX-UHFFFAOYSA-N 0 0 350.172 3.679 20 5 FHBDRN CCOc1ccc(C(=O)NCCCn2ccc3ccccc32)cc1[N+](=O)[O-] ZINC000019006032 946405401 /nfs/dbraw/zinc/40/54/01/946405401.db2.gz XSLYBSXGFZPBIP-UHFFFAOYSA-N 0 0 367.405 3.768 20 5 FHBDRN Cn1c(SCCOc2ccc([N+](=O)[O-])cc2)nnc1-c1ccccc1 ZINC000120894132 946405611 /nfs/dbraw/zinc/40/56/11/946405611.db2.gz OALIOKVPKZBLBN-UHFFFAOYSA-N 0 0 356.407 3.561 20 5 FHBDRN Cc1nnc(-c2ccccc2NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)o1 ZINC000129486072 946407111 /nfs/dbraw/zinc/40/71/11/946407111.db2.gz ABHXUULABKSLRH-UHFFFAOYSA-N 0 0 358.741 3.859 20 5 FHBDRN C[C@@H]1CCCC[C@H]1c1noc(Cc2cc3c(cc2[N+](=O)[O-])OCCO3)n1 ZINC000545688937 946407877 /nfs/dbraw/zinc/40/78/77/946407877.db2.gz RPVXATUDPXDRKO-DGCLKSJQSA-N 0 0 359.382 3.634 20 5 FHBDRN COc1cc(NC(=O)NCc2ccccc2[N+](=O)[O-])c(OC)cc1Cl ZINC000047743398 946416068 /nfs/dbraw/zinc/41/60/68/946416068.db2.gz SUYXILCGOJZSPQ-UHFFFAOYSA-N 0 0 365.773 3.587 20 5 FHBDRN Cc1cc(N2CCCC2)ccc1NC(=O)NCc1ccccc1[N+](=O)[O-] ZINC000047747320 946418322 /nfs/dbraw/zinc/41/83/22/946418322.db2.gz IBGHPMJDAGVYHH-UHFFFAOYSA-N 0 0 354.410 3.825 20 5 FHBDRN Cc1ccc(-n2cc(NC(=O)c3ccc(F)cc3[N+](=O)[O-])cn2)c(C)c1 ZINC000190271820 946419978 /nfs/dbraw/zinc/41/99/78/946419978.db2.gz KPTPENGSYWCLOD-UHFFFAOYSA-N 0 0 354.341 3.789 20 5 FHBDRN Cc1ccccc1CN(C1CC1)S(=O)(=O)c1c(C)cccc1[N+](=O)[O-] ZINC000519891958 946426066 /nfs/dbraw/zinc/42/60/66/946426066.db2.gz DSAKZNHTJTYUHG-UHFFFAOYSA-N 0 0 360.435 3.565 20 5 FHBDRN CC(=O)Nc1nc2ccc(NC(=O)c3ccc(C)c([N+](=O)[O-])c3)cc2s1 ZINC000043244306 946437357 /nfs/dbraw/zinc/43/73/57/946437357.db2.gz FZGBUNLIFQAARM-UHFFFAOYSA-N 0 0 370.390 3.724 20 5 FHBDRN CC(=Cc1cccc([N+](=O)[O-])c1)CNc1ccc(N2CCNC2=O)cc1C ZINC000441335030 946440499 /nfs/dbraw/zinc/44/04/99/946440499.db2.gz XHUOWHPSFFHULZ-GXDHUFHOSA-N 0 0 366.421 3.948 20 5 FHBDRN COc1ccc(OC)c(CN(C(=O)c2ccc([N+](=O)[O-])c(C)c2)C2CC2)c1 ZINC000025804242 946445807 /nfs/dbraw/zinc/44/58/07/946445807.db2.gz IOSIWCCKGRJWJV-UHFFFAOYSA-N 0 0 370.405 3.725 20 5 FHBDRN C[C@H](C(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1)n1cnc2ccccc21 ZINC000129502870 946449981 /nfs/dbraw/zinc/44/99/81/946449981.db2.gz CGAPQKKXWPMWGD-CQSZACIVSA-N 0 0 364.405 3.697 20 5 FHBDRN CC(C)c1ccccc1OCCNC(=O)NCc1ccccc1[N+](=O)[O-] ZINC000111458555 946466660 /nfs/dbraw/zinc/46/66/60/946466660.db2.gz XWMYWAJATBYYLB-UHFFFAOYSA-N 0 0 357.410 3.596 20 5 FHBDRN CC[C@@]1(C)Oc2ccc(NC(=O)c3cccc(OC)c3[N+](=O)[O-])cc2O1 ZINC000444414774 946482150 /nfs/dbraw/zinc/48/21/50/946482150.db2.gz YTCGZICSZAKYPW-SFHVURJKSA-N 0 0 358.350 3.753 20 5 FHBDRN CSCc1ccc(NC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)cc1 ZINC000111598615 946489600 /nfs/dbraw/zinc/48/96/00/946489600.db2.gz FLTDURGGJSQCPA-UHFFFAOYSA-N 0 0 369.402 3.552 20 5 FHBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)N[C@@H]1C[C@H]1c1ccccc1 ZINC000067513802 946497156 /nfs/dbraw/zinc/49/71/56/946497156.db2.gz LPHYGECHCRCGCL-VQTJNVASSA-N 0 0 368.436 3.827 20 5 FHBDRN CC(C)c1ccc(C(=O)N[C@@H]2CCCC[C@@H]2n2cccn2)cc1[N+](=O)[O-] ZINC000473899293 946499461 /nfs/dbraw/zinc/49/94/61/946499461.db2.gz XNBZHPOFRPPZCT-SJORKVTESA-N 0 0 356.426 3.828 20 5 FHBDRN Cc1cc(C)cc([C@H](C)NC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)c1 ZINC000111616148 946505310 /nfs/dbraw/zinc/50/53/10/946505310.db2.gz OZJMHEMOKMWGRA-ZDUSSCGKSA-N 0 0 365.389 3.544 20 5 FHBDRN Cc1ccc(NC(=O)c2ccnc(N3CCC[C@@H](C)C3)c2)cc1[N+](=O)[O-] ZINC000463126967 946506598 /nfs/dbraw/zinc/50/65/98/946506598.db2.gz KLQBWRHIKNQWTE-CYBMUJFWSA-N 0 0 354.410 3.787 20 5 FHBDRN CCOC(=O)c1cc(C(=O)NCC[C@H]2CCCC[C@@H]2C)cc([N+](=O)[O-])c1 ZINC001126127450 946507415 /nfs/dbraw/zinc/50/74/15/946507415.db2.gz RQDXDQKWEVUWCT-UONOGXRCSA-N 0 0 362.426 3.718 20 5 FHBDRN CC1(C)CCN(S(=O)(=O)c2ccc([N+](=O)[O-])s2)c2ccccc21 ZINC000519719941 946508727 /nfs/dbraw/zinc/50/87/27/946508727.db2.gz CSUYKWFDGDVQRK-UHFFFAOYSA-N 0 0 352.437 3.533 20 5 FHBDRN COc1ccccc1CC(C)(C)NC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000104513262 946514691 /nfs/dbraw/zinc/51/46/91/946514691.db2.gz ULAQYIBNSSIIKX-UHFFFAOYSA-N 0 0 367.405 3.836 20 5 FHBDRN C[C@H](NCc1ccc([N+](=O)[O-])cc1F)c1ccc(Br)cn1 ZINC000475509795 946520188 /nfs/dbraw/zinc/52/01/88/946520188.db2.gz MXGQUABLNBRTRT-VIFPVBQESA-N 0 0 354.179 3.742 20 5 FHBDRN CSc1ccccc1[C@H](C)NC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000441376873 946531267 /nfs/dbraw/zinc/53/12/67/946531267.db2.gz AVNKDFVICSIEME-JTQLQIEISA-N 0 0 360.391 3.536 20 5 FHBDRN CC[C@](C)(NC(=O)c1cccc(SC)c1[N+](=O)[O-])c1nccs1 ZINC000186551526 946535417 /nfs/dbraw/zinc/53/54/17/946535417.db2.gz ANRQSZQCZNZPJL-HNNXBMFYSA-N 0 0 351.453 3.828 20 5 FHBDRN C[C@H](CNC(=O)N1CCC[C@]2(CC2(F)F)C1)c1ccccc1[N+](=O)[O-] ZINC000897052149 946537938 /nfs/dbraw/zinc/53/79/38/946537938.db2.gz IZZMNCYLLUTUEP-WBMJQRKESA-N 0 0 353.369 3.529 20 5 FHBDRN C[C@@H](CNC(=O)N1CCC(OC(C)(C)C)CC1)c1ccccc1[N+](=O)[O-] ZINC000897068246 946561831 /nfs/dbraw/zinc/56/18/31/946561831.db2.gz SCZCFHJDAIMRFQ-AWEZNQCLSA-N 0 0 363.458 3.687 20 5 FHBDRN CC(C)[C@@H](NCc1cc(Br)c([N+](=O)[O-])s1)c1cnn(C)c1 ZINC000897081113 946571139 /nfs/dbraw/zinc/57/11/39/946571139.db2.gz KDTDYVHOQSIGCP-GFCCVEGCSA-N 0 0 373.276 3.639 20 5 FHBDRN O=C(N[C@@H]1COc2ccc(Cl)cc21)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000475519011 946579815 /nfs/dbraw/zinc/57/98/15/946579815.db2.gz NDPRGYGJVNDLGZ-OAHLLOKOSA-N 0 0 357.753 3.593 20 5 FHBDRN C[C@H](CNC(=O)N(C)Cc1ccc(Cl)nc1)c1ccccc1[N+](=O)[O-] ZINC000897076181 946582980 /nfs/dbraw/zinc/58/29/80/946582980.db2.gz VGERMQNKCFNDQN-GFCCVEGCSA-N 0 0 362.817 3.588 20 5 FHBDRN CSc1cccc(C(=O)NCc2coc(-c3ccccc3)n2)c1[N+](=O)[O-] ZINC000186576537 946586120 /nfs/dbraw/zinc/58/61/20/946586120.db2.gz BMLIHXDKXYUTLM-UHFFFAOYSA-N 0 0 369.402 3.902 20 5 FHBDRN Cc1ccc(-c2csc(NC(=O)C(C)(C)n3cc([N+](=O)[O-])cn3)n2)cc1 ZINC000102216113 946586496 /nfs/dbraw/zinc/58/64/96/946586496.db2.gz ULLXTGQCFMKCCM-UHFFFAOYSA-N 0 0 371.422 3.597 20 5 FHBDRN CSc1cccc(C(=O)NCCCOCCc2ccccc2)c1[N+](=O)[O-] ZINC000186197563 946597146 /nfs/dbraw/zinc/59/71/46/946597146.db2.gz PEOCSTPCQTVFCC-UHFFFAOYSA-N 0 0 374.462 3.696 20 5 FHBDRN CCNC(=O)c1ccc(NC(=O)c2cccc(SC)c2[N+](=O)[O-])c(C)c1 ZINC000186195320 946598590 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CC[C@H](NC(=O)Nc1cc(C)c([N+](=O)[O-])cc1C)c1c(C)nn(C)c1C ZINC000475544810 946628665 /nfs/dbraw/zinc/62/86/65/946628665.db2.gz HOYOMPMHKVPYQS-AWEZNQCLSA-N 0 0 359.430 3.835 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N2c3ccccc3CC[C@H]2C)c1F ZINC000414721673 946639681 /nfs/dbraw/zinc/63/96/81/946639681.db2.gz CJTDQGGUUFNEHG-GFCCVEGCSA-N 0 0 358.369 3.653 20 5 FHBDRN Cn1c(Sc2ccc3ncccc3c2[N+](=O)[O-])nnc1-c1ccco1 ZINC000112073370 946656034 /nfs/dbraw/zinc/65/60/34/946656034.db2.gz LHWSVKSWINGHCP-UHFFFAOYSA-N 0 0 353.363 3.683 20 5 FHBDRN Cc1nccc(NC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)n1 ZINC000545819750 946658739 /nfs/dbraw/zinc/65/87/39/946658739.db2.gz OAKMDAGBGXVOLB-UHFFFAOYSA-N 0 0 363.377 3.558 20 5 FHBDRN CO[C@@H]1C[C@H](NC(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1(C)C ZINC000475192497 946661141 /nfs/dbraw/zinc/66/11/41/946661141.db2.gz TZNFYZBAPFEXPM-NWDGAFQWSA-N 0 0 361.320 3.549 20 5 FHBDRN Cc1ccc(C(=O)Nc2ccc([N+](=O)[O-])c(C)n2)cc1Br ZINC000134022080 946662899 /nfs/dbraw/zinc/66/28/99/946662899.db2.gz SUYGMKCALAWYPI-UHFFFAOYSA-N 0 0 350.172 3.621 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)c2cc(COC(C)(C)C)on2)cc1[N+](=O)[O-] ZINC000186259793 946663564 /nfs/dbraw/zinc/66/35/64/946663564.db2.gz PVTLWUHYKAIQKO-GFCCVEGCSA-N 0 0 361.398 3.697 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1-c1nc(-c2cc(OCC(F)F)ccn2)no1 ZINC000545845203 946671408 /nfs/dbraw/zinc/67/14/08/946671408.db2.gz YCFHGXLUUBPMTH-UHFFFAOYSA-N 0 0 362.292 3.659 20 5 FHBDRN Cc1ccc(OC2CCN(C(=O)CCc3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000151951740 946680535 /nfs/dbraw/zinc/68/05/35/946680535.db2.gz LOBBJFDHLYYUPS-UHFFFAOYSA-N 0 0 368.433 3.906 20 5 FHBDRN O=C(c1ccccc1)C1CCN(CCOc2ccccc2[N+](=O)[O-])CC1 ZINC000051379552 946690484 /nfs/dbraw/zinc/69/04/84/946690484.db2.gz DKTFOFGIONUMGE-UHFFFAOYSA-N 0 0 354.406 3.569 20 5 FHBDRN CO[C@@H]1CCC[C@H]1CNC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000475198129 946708333 /nfs/dbraw/zinc/70/83/33/946708333.db2.gz VUMJYHPBQCEGHG-TVQRCGJNSA-N 0 0 361.320 3.550 20 5 FHBDRN Cc1cc(CNC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)ccc1Cl ZINC000541640958 946709766 /nfs/dbraw/zinc/70/97/66/946709766.db2.gz XRLZVAGYRMFSPH-UHFFFAOYSA-N 0 0 370.796 3.672 20 5 FHBDRN COc1ccnc(NC(=O)c2cc([N+](=O)[O-])ccc2SCC(C)C)c1 ZINC000127239550 946711500 /nfs/dbraw/zinc/71/15/00/946711500.db2.gz OYDUANMTKUWHSI-UHFFFAOYSA-N 0 0 361.423 3.999 20 5 FHBDRN C[C@@]1(NC(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CCO[C@H]1C1CC1 ZINC000475206242 946721197 /nfs/dbraw/zinc/72/11/97/946721197.db2.gz BMKRWSDJLWQOMK-DZGCQCFKSA-N 0 0 373.331 3.693 20 5 FHBDRN C[C@]1(NC(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CCO[C@H]1C1CC1 ZINC000475206245 946721391 /nfs/dbraw/zinc/72/13/91/946721391.db2.gz BMKRWSDJLWQOMK-ZFWWWQNUSA-N 0 0 373.331 3.693 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)N[C@@H]1CCOC2(CCC2)C1 ZINC000475208850 946725440 /nfs/dbraw/zinc/72/54/40/946725440.db2.gz RVPOUCNMAQLLFQ-LLVKDONJSA-N 0 0 373.331 3.837 20 5 FHBDRN Cc1cc(N2CCC(n3ccc([N+](=O)[O-])n3)CC2)c2ccc(F)c(F)c2n1 ZINC000575419501 946732837 /nfs/dbraw/zinc/73/28/37/946732837.db2.gz UKKMDSXAPFOUOV-UHFFFAOYSA-N 0 0 373.363 3.768 20 5 FHBDRN CCC1(NC(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CCOCC1 ZINC000475226951 946735525 /nfs/dbraw/zinc/73/55/25/946735525.db2.gz BAPUXUHHOJCZGX-UHFFFAOYSA-N 0 0 361.320 3.694 20 5 FHBDRN O=C(c1cc(F)cc2c(=O)c3cccc(F)c3[nH]c12)N1CC2(C1)CCCC2 ZINC000444333582 946737318 /nfs/dbraw/zinc/73/73/18/946737318.db2.gz ABLRKHLVIUDGDZ-UHFFFAOYSA-N 0 0 368.383 3.976 20 5 FHBDRN COC(=O)[C@H](C)NCc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000475219521 946740265 /nfs/dbraw/zinc/74/02/65/946740265.db2.gz MHXVUVQZEWGBFK-NSHDSACASA-N 0 0 364.785 3.692 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NCc1cccc2c1OCCCO2 ZINC000475581018 946748712 /nfs/dbraw/zinc/74/87/12/946748712.db2.gz MYVLHZYOQZUTRO-UHFFFAOYSA-N 0 0 371.393 3.695 20 5 FHBDRN COc1cccc([C@H]2C[C@H](N(C)C(=O)c3cc(C)ccc3[N+](=O)[O-])C2)c1 ZINC000456922404 946753122 /nfs/dbraw/zinc/75/31/22/946753122.db2.gz MFNDJLVCYFXIPL-WKILWMFISA-N 0 0 354.406 3.930 20 5 FHBDRN COc1cccc([C@H]2C[C@H](N(C)C(=O)c3ccc([N+](=O)[O-])cc3OC)C2)c1 ZINC000456925489 946753555 /nfs/dbraw/zinc/75/35/55/946753555.db2.gz QUDAZIPGIMEVIG-KOMQPUFPSA-N 0 0 370.405 3.630 20 5 FHBDRN CCOc1ccc([C@H](C)NC(=O)c2cc(OC)c(OC)cc2[N+](=O)[O-])cc1 ZINC000025877255 946756432 /nfs/dbraw/zinc/75/64/32/946756432.db2.gz GTSYUIJKCPTBTM-LBPRGKRZSA-N 0 0 374.393 3.502 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(C)c1ccc(C(C)C)cc1 ZINC000150762940 946760308 /nfs/dbraw/zinc/76/03/08/946760308.db2.gz VTMOOHZMWVZGFC-UHFFFAOYSA-N 0 0 364.423 3.552 20 5 FHBDRN O=C(NCCOc1ccc([N+](=O)[O-])cc1)N[C@H]1CCSc2ccccc21 ZINC000523106096 946767234 /nfs/dbraw/zinc/76/72/34/946767234.db2.gz PRZGCRAGGIUCPU-INIZCTEOSA-N 0 0 373.434 3.510 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1CN1CCSC[C@H]1c1nccs1 ZINC000186638686 946768446 /nfs/dbraw/zinc/76/84/46/946768446.db2.gz OENDEWJRPZWCQT-AWEZNQCLSA-N 0 0 365.480 3.740 20 5 FHBDRN COc1ccc2c(c1)OC[C@@H]2CC(=O)Nc1cc([N+](=O)[O-])c(C)cc1C ZINC000536275225 946769256 /nfs/dbraw/zinc/76/92/56/946769256.db2.gz OYFVGGWWTLTQGA-ZDUSSCGKSA-N 0 0 356.378 3.725 20 5 FHBDRN CCOc1ccc(C(=O)N2CC[C@H](C)c3cccc(O)c32)cc1[N+](=O)[O-] ZINC000186288392 946769608 /nfs/dbraw/zinc/76/96/08/946769608.db2.gz LEGXPQQHXJBGLD-LBPRGKRZSA-N 0 0 356.378 3.853 20 5 FHBDRN CCOc1ccc(C(=O)N2CC[C@@H](C)c3cccc(O)c32)cc1[N+](=O)[O-] ZINC000186288412 946769858 /nfs/dbraw/zinc/76/98/58/946769858.db2.gz LEGXPQQHXJBGLD-GFCCVEGCSA-N 0 0 356.378 3.853 20 5 FHBDRN CCc1ccc([C@H](N[C@H](C)CC[S@](C)=O)c2ccc([N+](=O)[O-])cc2)o1 ZINC000544380946 946770604 /nfs/dbraw/zinc/77/06/04/946770604.db2.gz VLKCSGKFLQBVIO-RSNNCKTBSA-N 0 0 364.467 3.586 20 5 FHBDRN CCc1ccc([C@H](N[C@H](C)CC[S@@](C)=O)c2ccc([N+](=O)[O-])cc2)o1 ZINC000544380947 946770906 /nfs/dbraw/zinc/77/09/06/946770906.db2.gz VLKCSGKFLQBVIO-XMRYCRAHSA-N 0 0 364.467 3.586 20 5 FHBDRN Cc1ccccc1[C@H]1CCCN1S(=O)(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000151994172 946771089 /nfs/dbraw/zinc/77/10/89/946771089.db2.gz VUOYXSMJFKTKEO-GOSISDBHSA-N 0 0 360.435 3.570 20 5 FHBDRN CCOC(=O)c1cc(C(=O)N(C)[C@H](C)c2ccccc2F)cc([N+](=O)[O-])c1 ZINC000121454249 946774925 /nfs/dbraw/zinc/77/49/25/946774925.db2.gz OZYVMNNKUVABKY-GFCCVEGCSA-N 0 0 374.368 3.744 20 5 FHBDRN CNC(=O)c1cnc(/C=C/c2csc(-c3cccc([N+](=O)[O-])c3)n2)s1 ZINC000112770484 946776599 /nfs/dbraw/zinc/77/65/99/946776599.db2.gz LMRAIKOMAFAJTK-AATRIKPKSA-N 0 0 372.431 3.705 20 5 FHBDRN CCOC(=O)c1ccnc(NCCSc2ccc(C)cc2)c1[N+](=O)[O-] ZINC000523110984 946780150 /nfs/dbraw/zinc/78/01/50/946780150.db2.gz QYMHRLSKNIKPJN-UHFFFAOYSA-N 0 0 361.423 3.679 20 5 FHBDRN CCOC(=O)c1ccnc(N[C@@H](C)CCc2ccc(OC)cc2)c1[N+](=O)[O-] ZINC000523112473 946782493 /nfs/dbraw/zinc/78/24/93/946782493.db2.gz GPTFVEIQDXMKFP-ZDUSSCGKSA-N 0 0 373.409 3.608 20 5 FHBDRN Cc1cc2cc[nH]c2cc1NC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000444445202 946803995 /nfs/dbraw/zinc/80/39/95/946803995.db2.gz BZNKJMUXKHGODX-UHFFFAOYSA-N 0 0 361.361 3.823 20 5 FHBDRN CCOC(=O)c1ccnc(N(Cc2ccccc2C)C2CC2)c1[N+](=O)[O-] ZINC000523115582 946804790 /nfs/dbraw/zinc/80/47/90/946804790.db2.gz PHARFBQXYOGYDR-UHFFFAOYSA-N 0 0 355.394 3.644 20 5 FHBDRN Cc1cc(F)ccc1N1CCC[C@H](NC(=O)c2ccc([N+](=O)[O-])s2)C1 ZINC000609757662 946815209 /nfs/dbraw/zinc/81/52/09/946815209.db2.gz PMWKJKLYNNYYAQ-ZDUSSCGKSA-N 0 0 363.414 3.503 20 5 FHBDRN CCC[C@H](NC(=O)CNc1cc([N+](=O)[O-])ccc1OC)c1ccccc1 ZINC000025908605 946822275 /nfs/dbraw/zinc/82/22/75/946822275.db2.gz AVNKDFFSZSQCBJ-INIZCTEOSA-N 0 0 357.410 3.673 20 5 FHBDRN CC(C)(C)c1coc(CNc2ncc(Br)cc2[N+](=O)[O-])n1 ZINC000897172813 946828770 /nfs/dbraw/zinc/82/87/70/946828770.db2.gz XBBJPLXQWUDAJF-UHFFFAOYSA-N 0 0 355.192 3.650 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1)N1CCC[C@H]1C[C@@H](O)c1ccc(F)cc1 ZINC000162818785 946837642 /nfs/dbraw/zinc/83/76/42/946837642.db2.gz KFJQVRCMVMKSQO-FUHWJXTLSA-N 0 0 373.384 3.854 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H](C)[C@H]1Oc2ccccc2[C@H]1C ZINC000438509491 946838756 /nfs/dbraw/zinc/83/87/56/946838756.db2.gz YKPHCZIGYRGFNL-VFVRVIDISA-N 0 0 355.394 3.978 20 5 FHBDRN CCOc1ccc(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)cc1OC ZINC000186309627 946841144 /nfs/dbraw/zinc/84/11/44/946841144.db2.gz OPVFLEATSLHCBA-UHFFFAOYSA-N 0 0 364.785 3.586 20 5 FHBDRN CCOc1cccc(N2CCC(c3noc(C4CC4)n3)CC2)c1[N+](=O)[O-] ZINC000302164139 946856550 /nfs/dbraw/zinc/85/65/50/946856550.db2.gz IPWUXGDZQLABEL-UHFFFAOYSA-N 0 0 358.398 3.638 20 5 FHBDRN CC[C@H](C)c1ccccc1OCC(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000536278118 946868451 /nfs/dbraw/zinc/86/84/51/946868451.db2.gz ANIRFYYSQMQHPT-HNNXBMFYSA-N 0 0 356.422 3.846 20 5 FHBDRN O=C(c1ccccc1[N+](=O)[O-])N1CCO[C@H](c2ccc(F)cc2Cl)C1 ZINC000186316247 946876107 /nfs/dbraw/zinc/87/61/07/946876107.db2.gz GMNWTKQBSJUUKO-INIZCTEOSA-N 0 0 364.760 3.601 20 5 FHBDRN C[C@@H](C(=O)NCc1ccc([N+](=O)[O-])cc1Cl)c1c(F)cccc1F ZINC000186321248 946885469 /nfs/dbraw/zinc/88/54/69/946885469.db2.gz TXGLJRSYPBKHNR-SECBINFHSA-N 0 0 354.740 3.946 20 5 FHBDRN C[C@@H](C(=O)Nc1cccc(-c2ncon2)c1)c1ccc([N+](=O)[O-])cc1F ZINC000184506390 946891249 /nfs/dbraw/zinc/89/12/49/946891249.db2.gz XDJABLVPEBMQSX-SNVBAGLBSA-N 0 0 356.313 3.526 20 5 FHBDRN C[C@H](NC(=O)Nc1cccc(OCC(F)F)n1)c1cccc([N+](=O)[O-])c1 ZINC000184497216 946905047 /nfs/dbraw/zinc/90/50/47/946905047.db2.gz OEOGMDAMLKXEBH-JTQLQIEISA-N 0 0 366.324 3.516 20 5 FHBDRN C[C@@H](NC(=O)Nc1cccc(OCC(F)F)n1)c1cccc([N+](=O)[O-])c1 ZINC000184497239 946905444 /nfs/dbraw/zinc/90/54/44/946905444.db2.gz OEOGMDAMLKXEBH-SNVBAGLBSA-N 0 0 366.324 3.516 20 5 FHBDRN COCCOc1ccc(NC(=O)c2c(C)c(F)ccc2[N+](=O)[O-])c(C)c1 ZINC000843770535 946909914 /nfs/dbraw/zinc/90/99/14/946909914.db2.gz ZMYKDHWSWPRNNM-UHFFFAOYSA-N 0 0 362.357 3.628 20 5 FHBDRN O=[N+]([O-])c1ccc(N[C@@H]2CCN(Cc3ccc(Cl)cc3Cl)C2)nc1 ZINC000112656699 946920028 /nfs/dbraw/zinc/92/00/28/946920028.db2.gz YJLPHBXSAJLANO-CYBMUJFWSA-N 0 0 367.236 3.983 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N(Cc1ccco1)CC(F)(F)F ZINC000087062255 946920608 /nfs/dbraw/zinc/92/06/08/946920608.db2.gz HUUNTTWJVKRLJD-UHFFFAOYSA-N 0 0 356.300 3.712 20 5 FHBDRN CCOc1cc2c(cc1OCC)CN(c1cccc(OC)c1[N+](=O)[O-])CC2 ZINC000475350814 946924753 /nfs/dbraw/zinc/92/47/53/946924753.db2.gz DSYIODKWHKLFBY-UHFFFAOYSA-N 0 0 372.421 3.964 20 5 FHBDRN COc1cccc(NCc2nn(-c3ccccc3)c3c2CCC3)c1[N+](=O)[O-] ZINC000475347482 946928502 /nfs/dbraw/zinc/92/85/02/946928502.db2.gz AQOAPQMVRMKZGX-UHFFFAOYSA-N 0 0 364.405 3.890 20 5 FHBDRN Cc1nc(CN2CCN([C@H](C)c3cc([N+](=O)[O-])ccc3C)CC2)cs1 ZINC000182616329 946940417 /nfs/dbraw/zinc/94/04/17/946940417.db2.gz GFVOILKVDIXALB-CQSZACIVSA-N 0 0 360.483 3.547 20 5 FHBDRN C[C@H](NC(=O)NCCCNc1cccc(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000458890387 946942704 /nfs/dbraw/zinc/94/27/04/946942704.db2.gz OUGMRTDUAVQBRR-ZDUSSCGKSA-N 0 0 360.389 3.596 20 5 FHBDRN CCO[C@@H]1C[C@H](N(C)C(=O)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)C12CCC2 ZINC000458892016 946944071 /nfs/dbraw/zinc/94/40/71/946944071.db2.gz UCGHFRUYMIHXQI-RRQGHBQHSA-N 0 0 361.442 3.645 20 5 FHBDRN Cc1ccc(NC(=O)C(=O)N(C)[C@H](c2ccccc2)C(C)C)cc1[N+](=O)[O-] ZINC000112754805 946944896 /nfs/dbraw/zinc/94/48/96/946944896.db2.gz TYXKUDSTRBKAPJ-SFHVURJKSA-N 0 0 369.421 3.697 20 5 FHBDRN C[C@@H](Oc1ccc(F)cc1Cl)C(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000112781344 946954225 /nfs/dbraw/zinc/95/42/25/946954225.db2.gz NJJXJFCGPUNWKM-SNVBAGLBSA-N 0 0 352.749 3.818 20 5 FHBDRN Cc1cccnc1CNc1ccc(I)cc1[N+](=O)[O-] ZINC000112828095 946958184 /nfs/dbraw/zinc/95/81/84/946958184.db2.gz DCAPAWJTGBCUHE-UHFFFAOYSA-N 0 0 369.162 3.515 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCCN(C(=O)c2ccccc2)CC1 ZINC000182624646 946959064 /nfs/dbraw/zinc/95/90/64/946959064.db2.gz DMRMUHFJHNSKRD-QGZVFWFLSA-N 0 0 367.449 3.812 20 5 FHBDRN CCOC(C)(C)CNC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 ZINC000444526108 946975314 /nfs/dbraw/zinc/97/53/14/946975314.db2.gz UBBDIUNYXVMRPX-UHFFFAOYSA-N 0 0 371.437 3.752 20 5 FHBDRN CC(C)[C@@H]1CCCN(C(=O)c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000444527559 946976530 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C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCc2ccc(Cl)cc2C1 ZINC000536428096 948075119 /nfs/dbraw/zinc/07/51/19/948075119.db2.gz YMSLCTRNESHPQM-LBPRGKRZSA-N 0 0 359.813 3.634 20 5 FHBDRN Cc1nn(C)c(C(=O)N2CCCc3cc(C(C)(C)C)ccc32)c1[N+](=O)[O-] ZINC000128743856 948077409 /nfs/dbraw/zinc/07/74/09/948077409.db2.gz ZIWSDEUZGIRNSS-UHFFFAOYSA-N 0 0 356.426 3.527 20 5 FHBDRN CC(C)Oc1ccc(CCNC(=O)CSc2ccc([N+](=O)[O-])cc2)cc1 ZINC000025885429 948079206 /nfs/dbraw/zinc/07/92/06/948079206.db2.gz DFQUJPKSGCDDGG-UHFFFAOYSA-N 0 0 374.462 3.833 20 5 FHBDRN O=C(CCc1c(Cl)cccc1[N+](=O)[O-])N[C@H]1C[C@H]1Cc1ccccc1 ZINC001126288662 948105429 /nfs/dbraw/zinc/10/54/29/948105429.db2.gz HEJLGQZQBNQGSD-PBHICJAKSA-N 0 0 358.825 3.928 20 5 FHBDRN C[C@@H](Oc1ccc([N+](=O)[O-])c(CO)c1)C(=O)Nc1ccc(C(C)(C)C)cc1 ZINC000432331805 948113803 /nfs/dbraw/zinc/11/38/03/948113803.db2.gz QOGHTVHUCDEMHK-CYBMUJFWSA-N 0 0 372.421 3.791 20 5 FHBDRN CC1(CC(F)(F)F)CN(C(=O)CCc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000909436979 948114223 /nfs/dbraw/zinc/11/42/23/948114223.db2.gz DUTJBKPQUDCUOB-UHFFFAOYSA-N 0 0 364.751 3.982 20 5 FHBDRN Cc1ccc(CCC(=O)O[C@@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)cc1 ZINC000759945959 948129832 /nfs/dbraw/zinc/12/98/32/948129832.db2.gz ULYTYCMJJYJALY-DLBZAZTESA-N 0 0 357.410 3.759 20 5 FHBDRN O=C(Nc1cc(F)ccc1N1CCCCC1)c1cc([O-])cc([N+](=O)[O-])c1 ZINC000613928899 948139137 /nfs/dbraw/zinc/13/91/37/948139137.db2.gz ZKSZKTIZBGDUNG-UHFFFAOYSA-N 0 0 359.357 3.682 20 5 FHBDRN O=[N+]([O-])c1cccc2c(N3CCN(c4cc(F)ccc4F)CC3)ccnc21 ZINC000432336126 948150039 /nfs/dbraw/zinc/15/00/39/948150039.db2.gz NIIHMNLSQQFNNH-UHFFFAOYSA-N 0 0 370.359 3.748 20 5 FHBDRN O=[N+]([O-])c1cccc(Cl)c1NCCNc1nccc(C(F)(F)F)n1 ZINC000432339736 948153663 /nfs/dbraw/zinc/15/36/63/948153663.db2.gz KDVMZFYUADXQFU-UHFFFAOYSA-N 0 0 361.711 3.581 20 5 FHBDRN COC(=O)[C@H](CNc1ccnc2c1cccc2[N+](=O)[O-])c1ccccc1 ZINC000432339727 948154124 /nfs/dbraw/zinc/15/41/24/948154124.db2.gz KCKCBWWZCLRDEK-OAHLLOKOSA-N 0 0 351.362 3.512 20 5 FHBDRN O=[N+]([O-])c1cccc2c(N3CC[NH+](CCc4ccccc4)CC3)ccnc21 ZINC000432337822 948156436 /nfs/dbraw/zinc/15/64/36/948156436.db2.gz SRJOXBDTJZHPBD-UHFFFAOYSA-N 0 0 362.433 3.508 20 5 FHBDRN C[C@H](Sc1ccccn1)C(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000129563485 948160341 /nfs/dbraw/zinc/16/03/41/948160341.db2.gz CJCXFVZSWZSMLO-ZDUSSCGKSA-N 0 0 357.435 3.662 20 5 FHBDRN COC(=O)c1ccc(CN(C)c2ccnc3c2cccc3[N+](=O)[O-])cc1 ZINC000432342268 948173545 /nfs/dbraw/zinc/17/35/45/948173545.db2.gz IAKUOGPPWYCGDB-UHFFFAOYSA-N 0 0 351.362 3.566 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)NCCC(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC000019161258 948189099 /nfs/dbraw/zinc/18/90/99/948189099.db2.gz HAIOTPTUADZDRS-UHFFFAOYSA-N 0 0 369.421 3.651 20 5 FHBDRN COC(=O)[C@H]1CC[C@H](Nc2cc(OC(C)C)c([N+](=O)[O-])cc2C)CC1 ZINC001167831050 948194460 /nfs/dbraw/zinc/19/44/60/948194460.db2.gz PWSIEYXELDXBBH-HDJSIYSDSA-N 0 0 350.415 3.834 20 5 FHBDRN Cc1cccc(-c2nnc(SC[C@@H](O)c3cccc([N+](=O)[O-])c3)n2C)c1 ZINC000136839848 948203437 /nfs/dbraw/zinc/20/34/37/948203437.db2.gz JEKNXHANQMLUAS-MRXNPFEDSA-N 0 0 370.434 3.524 20 5 FHBDRN COc1ccc(CCCNc2ccc([N+](=O)[O-])c(C(C)=O)c2)cc1OC ZINC000585706127 948215726 /nfs/dbraw/zinc/21/57/26/948215726.db2.gz NMLFTNFGKVHZOO-UHFFFAOYSA-N 0 0 358.394 3.859 20 5 FHBDRN CCOc1ccc(C(=O)Nc2ncc(Cl)cc2Cl)cc1[N+](=O)[O-] ZINC000585715336 948226015 /nfs/dbraw/zinc/22/60/15/948226015.db2.gz MCABFOUEVSQNBW-UHFFFAOYSA-N 0 0 356.165 3.948 20 5 FHBDRN Cc1ccc([C@H]2C[C@H](C)N(S(=O)(=O)c3ccc([N+](=O)[O-])cc3C)C2)cc1 ZINC001211697556 948230204 /nfs/dbraw/zinc/23/02/04/948230204.db2.gz UDCLCCNRMJBQTD-RDJZCZTQSA-N 0 0 374.462 3.778 20 5 FHBDRN Cc1ccc([C@@H]2C[C@H](C)N(S(=O)(=O)c3ccc([N+](=O)[O-])cc3C)C2)cc1 ZINC001211697554 948230576 /nfs/dbraw/zinc/23/05/76/948230576.db2.gz UDCLCCNRMJBQTD-DOTOQJQBSA-N 0 0 374.462 3.778 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)NC[C@@H]1CCC[C@@H](C)[C@@H]1C ZINC001211697624 948234057 /nfs/dbraw/zinc/23/40/57/948234057.db2.gz VVGQIJUWPGMWDD-UGFHNGPFSA-N 0 0 354.472 3.562 20 5 FHBDRN O=C(COc1c(Br)cccc1[N+](=O)[O-])c1ccncc1Cl ZINC000585732305 948241271 /nfs/dbraw/zinc/24/12/71/948241271.db2.gz JBITYVDRWGUKBT-UHFFFAOYSA-N 0 0 371.574 3.667 20 5 FHBDRN CN(C)C(=O)c1ccc(NCc2ccc([N+](=O)[O-])cc2F)cc1Cl ZINC000585731636 948242352 /nfs/dbraw/zinc/24/23/52/948242352.db2.gz JJHHPDSIDIKZSN-UHFFFAOYSA-N 0 0 351.765 3.701 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)NC[C@](C)(O)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000759953479 948243247 /nfs/dbraw/zinc/24/32/47/948243247.db2.gz DKJSPCWCRCGYBS-FQEVSTJZSA-N 0 0 374.412 3.669 20 5 FHBDRN C[C@@H](c1ccccc1[N+](=O)[O-])N1CCN(C(=O)CC2CCCCC2)CC1 ZINC000441547995 948244540 /nfs/dbraw/zinc/24/45/40/948244540.db2.gz RWZSYGSAATXCHL-INIZCTEOSA-N 0 0 359.470 3.770 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1cccc([C@@H](C)N2CCOCC2)c1 ZINC000520543315 948258208 /nfs/dbraw/zinc/25/82/08/948258208.db2.gz BUNJFKGOSGHMQW-OAHLLOKOSA-N 0 0 369.421 3.549 20 5 FHBDRN CC(C)c1nc(C(=O)O[C@@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)cs1 ZINC000759955426 948281230 /nfs/dbraw/zinc/28/12/30/948281230.db2.gz XSBXEDVVOLUVBB-QWHCGFSZSA-N 0 0 364.427 3.712 20 5 FHBDRN CC1(C)CN(C(=O)c2c([N+](=O)[O-])cccc2C(F)(F)F)[C@@H]2CCC[C@H]2O1 ZINC000441575898 948295181 /nfs/dbraw/zinc/29/51/81/948295181.db2.gz PKLYYDYYTUUQEI-DGCLKSJQSA-N 0 0 372.343 3.786 20 5 FHBDRN CN(CCOc1ccc(F)cc1)C(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000070725615 948297655 /nfs/dbraw/zinc/29/76/55/948297655.db2.gz RJJPJNNKRIODJS-UHFFFAOYSA-N 0 0 352.749 3.538 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1C[C@H]1c1cc(F)c(F)c(F)c1 ZINC000184726700 948300768 /nfs/dbraw/zinc/30/07/68/948300768.db2.gz NWFJTLYVNHWPLV-WDEREUQCSA-N 0 0 366.295 3.763 20 5 FHBDRN CCCn1c(C)nnc1SCc1ccc(Br)cc1[N+](=O)[O-] ZINC000520580895 948320045 /nfs/dbraw/zinc/32/00/45/948320045.db2.gz TWZCOOFVFMTTBL-UHFFFAOYSA-N 0 0 371.260 3.960 20 5 FHBDRN CC(C)(C)c1ccc(NC(=O)N2CCC[C@@H](n3ccnc3)C2)cc1[N+](=O)[O-] ZINC000585808434 948329334 /nfs/dbraw/zinc/32/93/34/948329334.db2.gz HBNIGSNLPXSOFL-OAHLLOKOSA-N 0 0 371.441 3.958 20 5 FHBDRN Cc1c(CC(=O)NCc2ccsc2Br)cccc1[N+](=O)[O-] ZINC000512076501 948365407 /nfs/dbraw/zinc/36/54/07/948365407.db2.gz XPRMKKZJQQXSAA-UHFFFAOYSA-N 0 0 369.240 3.586 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1CCS[C@H](C)[C@@H]1c1ccccc1 ZINC000427603962 948387835 /nfs/dbraw/zinc/38/78/35/948387835.db2.gz MNIJXNUMUCJEGF-FZKQIMNGSA-N 0 0 372.446 3.922 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1CCS[C@@H](C)[C@@H]1c1ccccc1 ZINC000427603963 948388192 /nfs/dbraw/zinc/38/81/92/948388192.db2.gz MNIJXNUMUCJEGF-SCLBCKFNSA-N 0 0 372.446 3.922 20 5 FHBDRN O=C(c1cc2cccc([N+](=O)[O-])c2[nH]1)N1CCc2[nH]c3ccccc3c2C1 ZINC000512089078 948395150 /nfs/dbraw/zinc/39/51/50/948395150.db2.gz CYIDPUMZOGJXSC-UHFFFAOYSA-N 0 0 360.373 3.756 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N(CC(F)(F)F)c1ccccc1 ZINC000427606179 948396094 /nfs/dbraw/zinc/39/60/94/948396094.db2.gz IEVLIJMQVVYMSZ-UHFFFAOYSA-N 0 0 354.284 3.813 20 5 FHBDRN Cc1nc(-c2ccsc2)ccc1C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000125981274 948396833 /nfs/dbraw/zinc/39/68/33/948396833.db2.gz PZZOJRSWRARTBG-UHFFFAOYSA-N 0 0 367.430 3.999 20 5 FHBDRN C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)[C@H](C)CN1C ZINC000512101889 948418825 /nfs/dbraw/zinc/41/88/25/948418825.db2.gz VTRKPMVQFRRXRA-HUUCEWRRSA-N 0 0 369.421 3.552 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2ncn(Cc3ncc(-c4cccs4)o3)n2)cc1 ZINC000067429787 948419898 /nfs/dbraw/zinc/41/98/98/948419898.db2.gz GBHYHPWNLZIMMK-UHFFFAOYSA-N 0 0 353.363 3.618 20 5 FHBDRN C[C@H](OC[C@H](O)COc1c(F)cccc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000184775656 948427456 /nfs/dbraw/zinc/42/74/56/948427456.db2.gz DXRNFTKQTKYIDL-FZMZJTMJSA-N 0 0 369.776 3.905 20 5 FHBDRN Cc1ccc(NC(=O)C2CCC(NC(=O)C(C)(C)C)CC2)cc1[N+](=O)[O-] ZINC000279073177 948465645 /nfs/dbraw/zinc/46/56/45/948465645.db2.gz TUJKZZKZCDJEGA-UHFFFAOYSA-N 0 0 361.442 3.563 20 5 FHBDRN C[C@@H]1C[C@H](c2ccccc2)CCN1C(=O)COc1ccccc1[N+](=O)[O-] ZINC000466894267 948493199 /nfs/dbraw/zinc/49/31/99/948493199.db2.gz PRLIOINMFOYDIT-NVXWUHKLSA-N 0 0 354.406 3.768 20 5 FHBDRN O=[N+]([O-])c1cc(CNCc2cc(Cl)c3c(c2)OCCCO3)cs1 ZINC000066989667 948505163 /nfs/dbraw/zinc/50/51/63/948505163.db2.gz YMYZBEFUQZDHCZ-UHFFFAOYSA-N 0 0 354.815 3.761 20 5 FHBDRN O=C(NCCC1CC(O)C1)c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1 ZINC000432469470 948515273 /nfs/dbraw/zinc/51/52/73/948515273.db2.gz DDVREZCMGNAYIL-UHFFFAOYSA-N 0 0 372.446 3.637 20 5 FHBDRN Cc1cc(CNC(=O)Nc2ccc([N+](=O)[O-])cc2C)cc(N2CCCC2)n1 ZINC000520666690 948536201 /nfs/dbraw/zinc/53/62/01/948536201.db2.gz GOUWCGBKXREFAX-UHFFFAOYSA-N 0 0 369.425 3.529 20 5 FHBDRN CCCCOCCOC(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000125994498 948554414 /nfs/dbraw/zinc/55/44/14/948554414.db2.gz BGVHNXTYECTNLZ-UHFFFAOYSA-N 0 0 353.418 3.515 20 5 FHBDRN COCCOc1ccccc1NC(=O)c1ccc(SC)c([N+](=O)[O-])c1 ZINC000512146337 948557000 /nfs/dbraw/zinc/55/70/00/948557000.db2.gz PBIGNUMYJZKOLT-UHFFFAOYSA-N 0 0 362.407 3.594 20 5 FHBDRN CN(C(=O)Nc1cccc([N+](=O)[O-])c1)[C@@H](c1ncc[nH]1)c1ccccc1 ZINC000432485860 948558766 /nfs/dbraw/zinc/55/87/66/948558766.db2.gz OWWHYNKLKGFBBM-MRXNPFEDSA-N 0 0 351.366 3.571 20 5 FHBDRN CC(=O)Nc1cccc2c1CCN(c1ccc3ncccc3c1[N+](=O)[O-])C2 ZINC000054125458 948590873 /nfs/dbraw/zinc/59/08/73/948590873.db2.gz WXPVWMRWRNEUQL-UHFFFAOYSA-N 0 0 362.389 3.664 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)c2cnccc2C(F)(F)F)cc1[N+](=O)[O-] ZINC000584728275 948595761 /nfs/dbraw/zinc/59/57/61/948595761.db2.gz HEERIEDXMDMPDR-JTQLQIEISA-N 0 0 353.300 3.808 20 5 FHBDRN C[C@H](NC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)[C@@H](C)c1ccccc1 ZINC000087132251 948607689 /nfs/dbraw/zinc/60/76/89/948607689.db2.gz IGPDYCPPUFAYSF-CABCVRRESA-N 0 0 353.422 3.855 20 5 FHBDRN COC(=O)COc1ccc(CNc2ccc(C3CC3)c(C)c2)cc1[N+](=O)[O-] ZINC000474005651 948611392 /nfs/dbraw/zinc/61/13/92/948611392.db2.gz MBHPIORGHCUDAV-UHFFFAOYSA-N 0 0 370.405 3.945 20 5 FHBDRN CC(C)[C@]1(CO)CCCN(Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000550433269 948615182 /nfs/dbraw/zinc/61/51/82/948615182.db2.gz HCKONCATVKHDFR-MRXNPFEDSA-N 0 0 360.376 3.844 20 5 FHBDRN COc1cccc(Br)c1OCc1ccc([N+](=O)[O-])cc1OC ZINC000429806761 948635040 /nfs/dbraw/zinc/63/50/40/948635040.db2.gz HRQXRIKKRNPMPO-UHFFFAOYSA-N 0 0 368.183 3.954 20 5 FHBDRN Cc1ncc(-c2ccccc2)cc1NC(=O)c1cc(F)cc([N+](=O)[O-])c1N ZINC000536452800 948637316 /nfs/dbraw/zinc/63/73/16/948637316.db2.gz FTEIMYGKLFMDNA-UHFFFAOYSA-N 0 0 366.352 3.939 20 5 FHBDRN Cc1cc(N2CC[C@H](Cc3cnn(C)c3)C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000571583940 948638657 /nfs/dbraw/zinc/63/86/57/948638657.db2.gz GOCNYKKPALITBQ-GFCCVEGCSA-N 0 0 368.359 3.725 20 5 FHBDRN CCc1n[nH]c(C(=O)N[C@H]2C[C@H](c3ccccc3)C[C@H](C)C2)c1[N+](=O)[O-] ZINC000412686320 948679368 /nfs/dbraw/zinc/67/93/68/948679368.db2.gz CQJPBAOCPUESLB-NWANDNLSSA-N 0 0 356.426 3.583 20 5 FHBDRN O=C(NCCc1c[nH]c2cc(F)ccc12)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000050765765 948693381 /nfs/dbraw/zinc/69/33/81/948693381.db2.gz YVTZDFMWPAAUDR-UHFFFAOYSA-N 0 0 366.352 3.669 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)C1(c2ccccc2F)CCCC1 ZINC000056147129 948712195 /nfs/dbraw/zinc/71/21/95/948712195.db2.gz XQESXEDHXHXYMJ-UHFFFAOYSA-N 0 0 356.397 3.905 20 5 FHBDRN COCCOc1cc(C)ccc1NC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000536485467 948733160 /nfs/dbraw/zinc/73/31/60/948733160.db2.gz KQMKUMODSHIQSW-UHFFFAOYSA-N 0 0 369.377 3.662 20 5 FHBDRN Cc1ccc(-c2noc(COC(=O)c3c(C)cccc3[N+](=O)[O-])n2)cc1 ZINC000026119024 948733924 /nfs/dbraw/zinc/73/39/24/948733924.db2.gz ZEDOQKBKKHEMJF-UHFFFAOYSA-N 0 0 353.334 3.619 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1)N[C@H]1CCCN(c2ccccc2F)C1 ZINC000536486561 948736462 /nfs/dbraw/zinc/73/64/62/948736462.db2.gz XUNBRXBJQJMYFY-AWEZNQCLSA-N 0 0 358.373 3.524 20 5 FHBDRN CCn1c(COc2ccc(C)cc2)nnc1Sc1ncccc1[N+](=O)[O-] ZINC000152106342 948743075 /nfs/dbraw/zinc/74/30/75/948743075.db2.gz MWTJXJFJBNOMPE-UHFFFAOYSA-N 0 0 371.422 3.640 20 5 FHBDRN COc1cc(C)c(C(=O)N2c3ccc([N+](=O)[O-])cc3C[C@@H]2C)cc1OC ZINC000087142101 948748158 /nfs/dbraw/zinc/74/81/58/948748158.db2.gz OPHAYSIOIJSHKT-LBPRGKRZSA-N 0 0 356.378 3.512 20 5 FHBDRN CC(F)(F)c1cccc(N[C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)c1 ZINC000187048581 948751775 /nfs/dbraw/zinc/75/17/75/948751775.db2.gz KTPYWYIIESMNSU-MRXNPFEDSA-N 0 0 361.348 3.924 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1C(=O)O[C@@H](C)C(=O)c1ccc2c(c1)CCC2 ZINC000026119198 948751854 /nfs/dbraw/zinc/75/18/54/948751854.db2.gz VVHSOJUGKFFOPJ-ZDUSSCGKSA-N 0 0 353.374 3.820 20 5 FHBDRN C[C@@H](NC(=O)c1c[nH]nc1-c1ccccc1F)c1cccc([N+](=O)[O-])c1 ZINC000087142561 948757008 /nfs/dbraw/zinc/75/70/08/948757008.db2.gz OSYLSQIBRCONGV-LLVKDONJSA-N 0 0 354.341 3.615 20 5 FHBDRN CC(C)Oc1ccc(N[C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)cc1 ZINC000067452385 948758776 /nfs/dbraw/zinc/75/87/76/948758776.db2.gz BTTXCXAVLFXJOM-SFHVURJKSA-N 0 0 355.394 3.599 20 5 FHBDRN CCOc1cc(-c2noc(-c3c[nH]c4ccc([N+](=O)[O-])cc43)n2)ccc1O ZINC000445425051 948784471 /nfs/dbraw/zinc/78/44/71/948784471.db2.gz ARAMZBYOVOOKQI-UHFFFAOYSA-N 0 0 366.333 3.897 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1C(=O)O[C@@H](C)C(=O)Nc1ccccc1Cl ZINC000026121522 948787411 /nfs/dbraw/zinc/78/74/11/948787411.db2.gz XFVMCPWDMRHGGW-NSHDSACASA-N 0 0 362.769 3.741 20 5 FHBDRN COC(=O)[C@H](N[C@H](C)CCc1ccccc1[N+](=O)[O-])c1ccc(F)c(C)c1 ZINC000428403155 948809548 /nfs/dbraw/zinc/80/95/48/948809548.db2.gz JIILFZCIQOPXCR-AUUYWEPGSA-N 0 0 374.412 3.867 20 5 FHBDRN CCOc1ccc(NC(=O)COc2cc(C)ccc2[N+](=O)[O-])cc1OCC ZINC000021615362 948819039 /nfs/dbraw/zinc/81/90/39/948819039.db2.gz FOIGIGVXWCQHFU-UHFFFAOYSA-N 0 0 374.393 3.718 20 5 FHBDRN COCCOc1ccc(C(=O)Nc2cc([N+](=O)[O-])ccc2C)c(Cl)c1 ZINC000184819738 948819239 /nfs/dbraw/zinc/81/92/39/948819239.db2.gz FLLPQIWFHHDJIP-UHFFFAOYSA-N 0 0 364.785 3.834 20 5 FHBDRN Cc1ccc(OCC(=O)Nc2ccccc2Br)c([N+](=O)[O-])c1 ZINC000007461259 219806167 /nfs/dbraw/zinc/80/61/67/219806167.db2.gz LTOVKVRCJDUVHV-UHFFFAOYSA-N 0 0 365.183 3.683 20 5 FHBDRN COC(=O)c1cc(CNc2ccc([N+](=O)[O-])cc2Cl)ccc1OC ZINC000007984285 219838342 /nfs/dbraw/zinc/83/83/42/219838342.db2.gz WONCTNURULAMTA-UHFFFAOYSA-N 0 0 350.758 3.656 20 5 FHBDRN COc1ccc(CCNc2ccc([N+](=O)[O-])c3cnccc23)cc1OC ZINC000012606565 220013478 /nfs/dbraw/zinc/01/34/78/220013478.db2.gz KMSIYDUOIIGFHC-UHFFFAOYSA-N 0 0 353.378 3.815 20 5 FHBDRN O=C(Nc1cc([N+](=O)[O-])ccc1F)c1ccc(OC[C@@H]2CCCO2)cc1 ZINC000013619127 220079530 /nfs/dbraw/zinc/07/95/30/220079530.db2.gz JTGYFNOWMZBBIP-HNNXBMFYSA-N 0 0 360.341 3.544 20 5 FHBDRN CCOC(=O)c1cc(C(=O)Nc2cc(Cl)ccc2F)cc([N+](=O)[O-])c1 ZINC000014424404 220123684 /nfs/dbraw/zinc/12/36/84/220123684.db2.gz DOGWFYLYDNESSI-UHFFFAOYSA-N 0 0 366.732 3.816 20 5 FHBDRN Cc1nn(Cc2nc(-c3cccc(C(F)(F)F)c3)no2)c(C)c1[N+](=O)[O-] ZINC000014271938 220122202 /nfs/dbraw/zinc/12/22/02/220122202.db2.gz QAGXUJVSOAEZDM-UHFFFAOYSA-N 0 0 367.287 3.525 20 5 FHBDRN C[C@H](Oc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(Br)c1 ZINC000014553030 220125666 /nfs/dbraw/zinc/12/56/66/220125666.db2.gz JFYXLOFZYSTMBB-JTQLQIEISA-N 0 0 365.183 3.763 20 5 FHBDRN COc1cc(Cl)c(C)cc1NC(=O)CNc1cccc([N+](=O)[O-])c1C ZINC000015124416 220148347 /nfs/dbraw/zinc/14/83/47/220148347.db2.gz XMGZTVHKQXXAER-UHFFFAOYSA-N 0 0 363.801 3.924 20 5 FHBDRN Cc1nc2cc(NC(=O)c3ccc(N4CCCC4)c([N+](=O)[O-])c3)ccc2o1 ZINC000015539004 220156050 /nfs/dbraw/zinc/15/60/50/220156050.db2.gz QYRKMKBJAIPECG-UHFFFAOYSA-N 0 0 366.377 3.897 20 5 FHBDRN COc1ccc(Br)c(C(=O)Nc2cccc([N+](=O)[O-])c2)c1 ZINC000019009069 220234050 /nfs/dbraw/zinc/23/40/50/220234050.db2.gz IRWFSVUMSXUUHD-UHFFFAOYSA-N 0 0 351.156 3.618 20 5 FHBDRN Cc1c(Cl)cc(S(=O)(=O)Nc2c(F)cccc2F)cc1[N+](=O)[O-] ZINC000018707230 220231425 /nfs/dbraw/zinc/23/14/25/220231425.db2.gz FFZJCDKTYPSZFP-UHFFFAOYSA-N 0 0 362.741 3.636 20 5 FHBDRN CCOc1cc(Cl)ccc1C(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000021125784 220352462 /nfs/dbraw/zinc/35/24/62/220352462.db2.gz LZZVCAJGDCAPQL-UHFFFAOYSA-N 0 0 350.758 3.908 20 5 FHBDRN CNc1nnc(Sc2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])s1 ZINC000022062044 220375378 /nfs/dbraw/zinc/37/53/78/220375378.db2.gz YRIQTJHMGFYLJK-UHFFFAOYSA-N 0 0 372.431 3.870 20 5 FHBDRN Cc1ccc(NC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1[N+](=O)[O-] ZINC000025594541 220492953 /nfs/dbraw/zinc/49/29/53/220492953.db2.gz DHCSSFAXOKPNBW-AWEZNQCLSA-N 0 0 373.434 3.598 20 5 FHBDRN O=C1c2cccc([N+](=O)[O-])c2C(=O)N1Cc1ccc(Cl)c2cccnc12 ZINC000031645723 220642286 /nfs/dbraw/zinc/64/22/86/220642286.db2.gz UWMWHTIKEVMVAF-UHFFFAOYSA-N 0 0 367.748 3.593 20 5 FHBDRN CN(Cc1ccccc1Br)C(=O)c1ccc([N+](=O)[O-])cc1F ZINC000054126038 221050262 /nfs/dbraw/zinc/05/02/62/221050262.db2.gz AXRWQUWAUQTENH-UHFFFAOYSA-N 0 0 367.174 3.769 20 5 FHBDRN CN(CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccc(F)c(F)c1 ZINC000055021042 221057048 /nfs/dbraw/zinc/05/70/48/221057048.db2.gz WWYHZKXRUPLDEA-UHFFFAOYSA-N 0 0 355.728 3.601 20 5 FHBDRN C[C@H](NC(=O)c1ccc(NC(=O)[C@H]2C[C@H]2C)cc1)c1cccc([N+](=O)[O-])c1 ZINC000055467114 221070359 /nfs/dbraw/zinc/07/03/59/221070359.db2.gz VPZGNUBONDMSOF-VBHSOAQHSA-N 0 0 367.405 3.680 20 5 FHBDRN Cc1cc(C)n(-c2ccc(NC(=O)Cc3ccc([N+](=O)[O-])cc3)cc2F)n1 ZINC000055716765 221073587 /nfs/dbraw/zinc/07/35/87/221073587.db2.gz KFMGKHYEOPFETP-UHFFFAOYSA-N 0 0 368.368 3.718 20 5 FHBDRN O=C(Nc1ccc(-n2nccc2C(F)(F)F)cc1)c1ccc([N+](=O)[O-])o1 ZINC000056200607 221078824 /nfs/dbraw/zinc/07/88/24/221078824.db2.gz LJAKQCYUZVRZOZ-UHFFFAOYSA-N 0 0 366.255 3.645 20 5 FHBDRN COc1ccc2c(c1)CCC[C@@H]2CC(=O)NCc1ccccc1[N+](=O)[O-] ZINC000057174482 221084908 /nfs/dbraw/zinc/08/49/08/221084908.db2.gz IWYYGZJQARQZHB-OAHLLOKOSA-N 0 0 354.406 3.730 20 5 FHBDRN Cc1ccc(NC(=O)C2(c3ccc(F)cc3)CCOCC2)cc1[N+](=O)[O-] ZINC000057179534 221084946 /nfs/dbraw/zinc/08/49/46/221084946.db2.gz JTCCNHNTJWRIHX-UHFFFAOYSA-N 0 0 358.369 3.729 20 5 FHBDRN Cc1cc(NC(=O)c2ccccc2Cl)n(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000068120607 221312926 /nfs/dbraw/zinc/31/29/26/221312926.db2.gz GXNOJLARELLDCE-UHFFFAOYSA-N 0 0 356.769 3.995 20 5 FHBDRN C[C@@H](c1cccnc1)N(C)C(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000068169993 221314407 /nfs/dbraw/zinc/31/44/07/221314407.db2.gz DNMXOEBWXXOIFG-INIZCTEOSA-N 0 0 371.440 3.769 20 5 FHBDRN O=C(c1ccc(N2CCCC2)c([N+](=O)[O-])c1)N1CCCc2cccc(F)c21 ZINC000071835889 136141226 /nfs/dbraw/zinc/14/12/26/136141226.db2.gz CUXVJEZPSLNHOA-UHFFFAOYSA-N 0 0 369.396 3.927 20 5 FHBDRN CC(C)n1cc(Br)cc1C(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000097454383 222182287 /nfs/dbraw/zinc/18/22/87/222182287.db2.gz NNZXURGQLBJAAJ-UHFFFAOYSA-N 0 0 366.215 3.670 20 5 FHBDRN Cc1nc2ccccc2c(S[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)n1 ZINC000097605447 222198144 /nfs/dbraw/zinc/19/81/44/222198144.db2.gz HVPBGPCLDSDLCC-NSHDSACASA-N 0 0 368.418 3.966 20 5 FHBDRN CC(=O)Nc1cccc(NCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)c1C ZINC000097704353 222207379 /nfs/dbraw/zinc/20/73/79/222207379.db2.gz WAVGJJQIHZIHPF-UHFFFAOYSA-N 0 0 367.365 3.524 20 5 FHBDRN C[C@@H](Cc1ccc(Br)cc1)NC(=O)c1ccc([N+](=O)[O-])s1 ZINC000107601627 222397843 /nfs/dbraw/zinc/39/78/43/222397843.db2.gz PDPAOMXXQXJBKR-VIFPVBQESA-N 0 0 369.240 3.780 20 5 FHBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)N[C@H]1CCCc2occc21 ZINC000125125367 222530262 /nfs/dbraw/zinc/53/02/62/222530262.db2.gz DRJVTXKULDXGTN-SFHVURJKSA-N 0 0 372.424 3.942 20 5 FHBDRN CC(C)(C)OC(=O)N1CCC(CSc2ncccc2[N+](=O)[O-])CC1 ZINC000085332978 518802291 /nfs/dbraw/zinc/80/22/91/518802291.db2.gz GYWGUXDUJBIIDN-UHFFFAOYSA-N 0 0 353.444 3.729 20 5 FHBDRN CC(C)(C)CC(=O)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000023558374 534564559 /nfs/dbraw/zinc/56/45/59/534564559.db2.gz ZOAGWOXMSHECHL-UHFFFAOYSA-N 0 0 373.375 3.698 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1F)N[C@@H](c1ccccc1)[C@H]1CCOC1 ZINC000541784555 567821035 /nfs/dbraw/zinc/82/10/35/567821035.db2.gz CZMFDZCWQBSCFE-GUYCJALGSA-N 0 0 359.357 3.633 20 5 FHBDRN CCOc1cccc([C@H]2C[C@@H]2NC(=O)Nc2ccc([N+](=O)[O-])cc2F)c1 ZINC000541785529 567823126 /nfs/dbraw/zinc/82/31/26/567823126.db2.gz VVDJMWUYJWDLJL-PBHICJAKSA-N 0 0 359.357 3.810 20 5 FHBDRN CCCc1nc(C)c(C(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)o1 ZINC000452862814 567829115 /nfs/dbraw/zinc/82/91/15/567829115.db2.gz VEBYEVAAOYUREL-OAHLLOKOSA-N 0 0 357.410 3.864 20 5 FHBDRN Cc1cncc(CCC(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000452864369 567829166 /nfs/dbraw/zinc/82/91/66/567829166.db2.gz WEJDRFHHDVEXDU-GOSISDBHSA-N 0 0 353.422 3.637 20 5 FHBDRN O=C(NCCc1nc2ccccc2s1)Nc1ccc([N+](=O)[O-])cc1F ZINC000541786606 567830602 /nfs/dbraw/zinc/83/06/02/567830602.db2.gz YARYUTCHZHIZET-UHFFFAOYSA-N 0 0 360.370 3.708 20 5 FHBDRN CC(=O)c1ccc(C(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)c(F)c1 ZINC000452861707 567836679 /nfs/dbraw/zinc/83/66/79/567836679.db2.gz UHNQAXWHYVJHNS-INIZCTEOSA-N 0 0 370.380 3.956 20 5 FHBDRN C[C@@H](c1cccc(NCCc2ccc([N+](=O)[O-])cc2)c1)N1CCOCC1 ZINC000541799391 567861371 /nfs/dbraw/zinc/86/13/71/567861371.db2.gz GKJYYVVUPFMHGL-INIZCTEOSA-N 0 0 355.438 3.643 20 5 FHBDRN CSc1cccc(NS(=O)(=O)c2cc(C)cc([N+](=O)[O-])c2C)c1 ZINC000541799446 567868378 /nfs/dbraw/zinc/86/83/78/567868378.db2.gz HXVVQMNXKNWBPE-UHFFFAOYSA-N 0 0 352.437 3.734 20 5 FHBDRN COc1cc(C(=O)N[C@@H](C)CC2CCC2)c([N+](=O)[O-])cc1OC(F)F ZINC000601871348 567868982 /nfs/dbraw/zinc/86/89/82/567868982.db2.gz RNJYWGUMRKJSCE-VIFPVBQESA-N 0 0 358.341 3.513 20 5 FHBDRN CCO[C@@H]1CCN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])C[C@H]1C ZINC000452875744 567874523 /nfs/dbraw/zinc/87/45/23/567874523.db2.gz SNMIQPQPNVKVTN-QMTHXVAHSA-N 0 0 360.332 3.501 20 5 FHBDRN CC[C@H](CNC(=O)CSc1ccccc1[N+](=O)[O-])CC(F)(F)F ZINC000412632828 567881073 /nfs/dbraw/zinc/88/10/73/567881073.db2.gz VAYPMPXBZSSUGI-JTQLQIEISA-N 0 0 350.362 3.782 20 5 FHBDRN CC[C@@H](CNC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)CC(F)(F)F ZINC000412633477 567881249 /nfs/dbraw/zinc/88/12/49/567881249.db2.gz XGXCIMCCNKSIGA-SNVBAGLBSA-N 0 0 359.348 3.878 20 5 FHBDRN CSC[C@H]1CCCN1c1nnc(-c2cccc([N+](=O)[O-])c2)n1C1CC1 ZINC000568102990 567883405 /nfs/dbraw/zinc/88/34/05/567883405.db2.gz ZCUGMXUDWVOYSE-OAHLLOKOSA-N 0 0 359.455 3.520 20 5 FHBDRN CCCN1CCN(C(=O)c2ccc(OC)c([N+](=O)[O-])c2)c2ccc(F)cc21 ZINC000481408716 567905109 /nfs/dbraw/zinc/90/51/09/567905109.db2.gz SXGSEETYRPTXTL-UHFFFAOYSA-N 0 0 373.384 3.619 20 5 FHBDRN Cc1cc(C(=O)N[C@H](C[C@H]2CCOC2)c2ccccc2)cc([N+](=O)[O-])c1 ZINC000159187029 567906748 /nfs/dbraw/zinc/90/67/48/567906748.db2.gz WZVMZCBEHRLHDE-DNVCBOLYSA-N 0 0 354.406 3.801 20 5 FHBDRN CN1CCc2ccc(NC(=O)NCCc3ccc(Cl)cc3[N+](=O)[O-])cc21 ZINC000481428180 567924898 /nfs/dbraw/zinc/92/48/98/567924898.db2.gz SOPYDHSCSUODHB-UHFFFAOYSA-N 0 0 374.828 3.605 20 5 FHBDRN CCCn1ncc(NC(=O)CCOc2cc(C)ccc2[N+](=O)[O-])c1C1CC1 ZINC000452913403 567934704 /nfs/dbraw/zinc/93/47/04/567934704.db2.gz HXDQNJDBSIFYIP-UHFFFAOYSA-N 0 0 372.425 3.795 20 5 FHBDRN O=C(NCc1cccc(OC(F)F)c1)Nc1ccc([N+](=O)[O-])cc1F ZINC000541833977 567937764 /nfs/dbraw/zinc/93/77/64/567937764.db2.gz RVNJXZROZZJVPV-UHFFFAOYSA-N 0 0 355.272 3.657 20 5 FHBDRN Cn1ncc2c1CCC[C@H]2NCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000264975834 567947158 /nfs/dbraw/zinc/94/71/58/567947158.db2.gz RZAOBWLJLBJODV-MRXNPFEDSA-N 0 0 369.450 3.619 20 5 FHBDRN CC[C@@H]1[C@H](CO)CCN1C(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000452924196 567956069 /nfs/dbraw/zinc/95/60/69/567956069.db2.gz KTWXIPVWQFGHPC-MAUKXSAKSA-N 0 0 369.421 3.571 20 5 FHBDRN Cn1c2ccccc2nc1[C@H]1CCCN1C(=O)c1csc([N+](=O)[O-])c1 ZINC000299394457 567956985 /nfs/dbraw/zinc/95/69/85/567956985.db2.gz KMRQFSRDWMHHHX-CQSZACIVSA-N 0 0 356.407 3.520 20 5 FHBDRN O=C1CCCN1c1ccc(CNc2ccc3ncccc3c2[N+](=O)[O-])cc1 ZINC000051454260 567958794 /nfs/dbraw/zinc/95/87/94/567958794.db2.gz YILHNMWWDJJQGO-UHFFFAOYSA-N 0 0 362.389 3.882 20 5 FHBDRN C[C@@H](NCc1ccc([N+](=O)[O-])cc1F)c1ccc(N2CCCNC2=O)cc1 ZINC000291020976 567963260 /nfs/dbraw/zinc/96/32/60/567963260.db2.gz CPTJLHAHBDTAPY-CYBMUJFWSA-N 0 0 372.400 3.504 20 5 FHBDRN COc1cc(C2(C(=O)NCc3cccc([N+](=O)[O-])c3C)CC2)ccc1C ZINC000481468467 567970128 /nfs/dbraw/zinc/97/01/28/567970128.db2.gz WFMWOOYOVOBHIU-UHFFFAOYSA-N 0 0 354.406 3.568 20 5 FHBDRN Cc1c(CNC(=O)[C@@H]2C[C@@]23CCCc2ccccc23)cccc1[N+](=O)[O-] ZINC000481465708 567970386 /nfs/dbraw/zinc/97/03/86/567970386.db2.gz LKNPKVCQLSYWCW-GHTZIAJQSA-N 0 0 350.418 3.814 20 5 FHBDRN CC(C)(C)[C@H]1CCCN(S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000481474422 567972138 /nfs/dbraw/zinc/97/21/38/567972138.db2.gz PLUNYDYHLYTNJQ-NSHDSACASA-N 0 0 360.863 3.695 20 5 FHBDRN CC[C@H](CNC(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F)CC(F)(F)F ZINC000412643062 567976732 /nfs/dbraw/zinc/97/67/32/567976732.db2.gz ZKJOYDQUCKKSQU-ZJUUUORDSA-N 0 0 350.312 3.932 20 5 FHBDRN CC[C@H](CNC(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F)CC(F)(F)F ZINC000412643058 567976773 /nfs/dbraw/zinc/97/67/73/567976773.db2.gz ZKJOYDQUCKKSQU-UWVGGRQHSA-N 0 0 350.312 3.932 20 5 FHBDRN Cc1c(CNC(=O)[C@H](C)CC(=O)c2ccccc2F)cccc1[N+](=O)[O-] ZINC000481482132 567977494 /nfs/dbraw/zinc/97/74/94/567977494.db2.gz WNLCVEAOVJATFE-GFCCVEGCSA-N 0 0 358.369 3.568 20 5 FHBDRN COCCCOc1ccc(CNC(=O)Nc2ccc([N+](=O)[O-])cc2C)cc1 ZINC000481486832 567988211 /nfs/dbraw/zinc/98/82/11/567988211.db2.gz SPMWAERMKCYKRC-UHFFFAOYSA-N 0 0 373.409 3.640 20 5 FHBDRN O=[N+]([O-])c1ccc2oc(CNCc3ccccc3OC3CCC3)nc2c1 ZINC000602548432 567990386 /nfs/dbraw/zinc/99/03/86/567990386.db2.gz ZFJLIDJIYXWYBJ-UHFFFAOYSA-N 0 0 353.378 3.957 20 5 FHBDRN Cc1nc(C)c(CNCc2cc(Br)c([N+](=O)[O-])s2)s1 ZINC000602572910 567996330 /nfs/dbraw/zinc/99/63/30/567996330.db2.gz ZCFOFAKLMDKYRR-UHFFFAOYSA-N 0 0 362.274 3.782 20 5 FHBDRN CCOc1cccc2[nH]cc(Cc3nc(CCC(C)(C)[N+](=O)[O-])no3)c21 ZINC000291081387 568013369 /nfs/dbraw/zinc/01/33/69/568013369.db2.gz NOXSKJJPEWORAM-UHFFFAOYSA-N 0 0 358.398 3.528 20 5 FHBDRN CC(C)(CCc1noc(CCC(=O)c2ccc3c(c2)CCCC3)n1)[N+](=O)[O-] ZINC000291074956 568014110 /nfs/dbraw/zinc/01/41/10/568014110.db2.gz MLXTWCQPZNYGED-UHFFFAOYSA-N 0 0 371.437 3.752 20 5 FHBDRN O=[N+]([O-])c1ccc2oc(CN3CCC(Cc4nccs4)CC3)nc2c1 ZINC000602735797 568026044 /nfs/dbraw/zinc/02/60/44/568026044.db2.gz YEGNCVMGWZCMDV-UHFFFAOYSA-N 0 0 358.423 3.647 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CC[C@@H](CC(C)(C)C)C1(C)C ZINC000412834990 568030538 /nfs/dbraw/zinc/03/05/38/568030538.db2.gz YZVCTAYQZKBQKS-AWEZNQCLSA-N 0 0 350.463 3.553 20 5 FHBDRN CSc1cccc(F)c1CNC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000568494104 568044656 /nfs/dbraw/zinc/04/46/56/568044656.db2.gz MOSYSODEELDFHF-UHFFFAOYSA-N 0 0 359.382 3.867 20 5 FHBDRN O=C(NCc1ccccc1N1CCCCC1)Nc1cccc([N+](=O)[O-])c1 ZINC000481553227 568047437 /nfs/dbraw/zinc/04/74/37/568047437.db2.gz AIFIPIHJEMHWSZ-UHFFFAOYSA-N 0 0 354.410 3.907 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@H]2C[C@H](c3ccc(F)cc3)C2)c1 ZINC000481543189 568049733 /nfs/dbraw/zinc/04/97/33/568049733.db2.gz NGLADRVDALNJQT-JCNLHEQBSA-N 0 0 372.396 3.874 20 5 FHBDRN O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)N1CCC[C@@H]1C1CCCCC1 ZINC000568554633 568050955 /nfs/dbraw/zinc/05/09/55/568050955.db2.gz JSAUPVBIZKQLGO-QGZVFWFLSA-N 0 0 352.381 3.987 20 5 FHBDRN O=C(Nc1ccc2cccc(Cl)c2n1)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000541876661 568058776 /nfs/dbraw/zinc/05/87/76/568058776.db2.gz PMSGWVMPKNRVFS-UHFFFAOYSA-N 0 0 371.736 3.777 20 5 FHBDRN CCC1(NC(=O)c2ccc(Cn3nc(C)c([N+](=O)[O-])c3C)cc2)CCCC1 ZINC000452964869 568059104 /nfs/dbraw/zinc/05/91/04/568059104.db2.gz TZRFAUGNUBRZHD-UHFFFAOYSA-N 0 0 370.453 3.909 20 5 FHBDRN C[C@H](CNC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1)Oc1ccc(Cl)cc1 ZINC000568579513 568059108 /nfs/dbraw/zinc/05/91/08/568059108.db2.gz OXJQZGGORFAIHH-OLZOCXBDSA-N 0 0 362.813 3.935 20 5 FHBDRN COC(=O)[C@H](Cc1ccc(C)cc1)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000481581804 568060524 /nfs/dbraw/zinc/06/05/24/568060524.db2.gz OQKSXYLKIZMRBJ-QAPCUYQASA-N 0 0 356.422 3.647 20 5 FHBDRN CC[C@H](C)COc1cc([N+](=O)[O-])c(CN(C)C[C@@H]2CCCO2)cc1OC ZINC000481594594 568061576 /nfs/dbraw/zinc/06/15/76/568061576.db2.gz DUWOOQQYHVXIJT-HOCLYGCPSA-N 0 0 366.458 3.639 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)NCCCc1nc2c(s1)CCCC2 ZINC000066157081 568061916 /nfs/dbraw/zinc/06/19/16/568061916.db2.gz FVARYCYOTPKWAJ-UHFFFAOYSA-N 0 0 374.466 3.993 20 5 FHBDRN COCc1cccc(NC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000481588033 568063529 /nfs/dbraw/zinc/06/35/29/568063529.db2.gz VZBCRQJPCDXXJZ-UHFFFAOYSA-N 0 0 363.801 3.759 20 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/nfs/dbraw/zinc/09/38/36/568093836.db2.gz UCNPYQSMSXUGRS-SFHVURJKSA-N 0 0 353.374 3.739 20 5 FHBDRN COc1ccc([C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])c(OC)c2)cc1 ZINC000159288195 568097778 /nfs/dbraw/zinc/09/77/78/568097778.db2.gz FFVXSTHADXVLSP-MRXNPFEDSA-N 0 0 356.378 3.589 20 5 FHBDRN COc1ccc(OC[C@H](O)Cc2ccc3ccccc3c2)cc1[N+](=O)[O-] ZINC000481727902 568098122 /nfs/dbraw/zinc/09/81/22/568098122.db2.gz RAPRBJVYJXAJOR-QGZVFWFLSA-N 0 0 353.374 3.739 20 5 FHBDRN Cc1ncc(-c2ccc(NC(=O)c3cc4c(cc3[N+](=O)[O-])OCO4)cc2)o1 ZINC000603495135 568108226 /nfs/dbraw/zinc/10/82/26/568108226.db2.gz UQRCIYJMKZNKGB-UHFFFAOYSA-N 0 0 367.317 3.539 20 5 FHBDRN Cc1ccc(OC(F)F)c(CNC(=O)c2ccc([N+](=O)[O-])cc2F)c1 ZINC000128647056 568114459 /nfs/dbraw/zinc/11/44/59/568114459.db2.gz SKCIMYLXBTUVKT-UHFFFAOYSA-N 0 0 354.284 3.574 20 5 FHBDRN CS[C@@H](CN[C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1)C(C)(C)C ZINC000568671653 568116932 /nfs/dbraw/zinc/11/69/32/568116932.db2.gz ITDBALRHUQSPBM-HOTGVXAUSA-N 0 0 362.499 3.785 20 5 FHBDRN C[C@@H](NC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1)c1ccc(F)c2ccccc21 ZINC000568672507 568117034 /nfs/dbraw/zinc/11/70/34/568117034.db2.gz FXJJWRFXGIFBSL-GFCCVEGCSA-N 0 0 370.384 3.696 20 5 FHBDRN Cc1c(C(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)cnn1C1CCCCC1 ZINC000541897304 568117966 /nfs/dbraw/zinc/11/79/66/568117966.db2.gz NIIYSYRANNYSDY-UHFFFAOYSA-N 0 0 368.437 3.803 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C(C)C)[C@@H](CO)C(C)C ZINC000452980371 568118607 /nfs/dbraw/zinc/11/86/07/568118607.db2.gz INJCYBSAOSCICZ-DOTOQJQBSA-N 0 0 368.499 3.726 20 5 FHBDRN O=C(NCc1ccc(Cl)cc1Cl)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000481780347 568123104 /nfs/dbraw/zinc/12/31/04/568123104.db2.gz OETBOYNFFLBIHR-UHFFFAOYSA-N 0 0 365.176 3.708 20 5 FHBDRN O=[N+]([O-])c1ccc(Cc2noc(CSc3ccc(Cl)cc3)n2)nc1 ZINC000568691124 568123524 /nfs/dbraw/zinc/12/35/24/568123524.db2.gz IVQLBNYUSSMYNJ-UHFFFAOYSA-N 0 0 362.798 3.909 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(O[C@H]2CCOC2)cc1 ZINC000291359667 568123716 /nfs/dbraw/zinc/12/37/16/568123716.db2.gz BFMSKVGXNBAHCH-KRWDZBQOSA-N 0 0 356.378 3.577 20 5 FHBDRN CCOc1ccc(C(=O)NC2CCC(CSC)CC2)cc1[N+](=O)[O-] ZINC000452980417 568126098 /nfs/dbraw/zinc/12/60/98/568126098.db2.gz NZPAYUOTESMQLX-UHFFFAOYSA-N 0 0 352.456 3.645 20 5 FHBDRN Cn1nc([N+](=O)[O-])cc1C(=O)N1CCCc2cc(-c3ccccc3)ccc21 ZINC000481794962 568127377 /nfs/dbraw/zinc/12/73/77/568127377.db2.gz KHQGRRIPZYQCDM-UHFFFAOYSA-N 0 0 362.389 3.588 20 5 FHBDRN CC[C@@]1(CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])OCCc2ccccc21 ZINC000291380292 568127837 /nfs/dbraw/zinc/12/78/37/568127837.db2.gz CEMSWTJUMOXSTC-IBGZPJMESA-N 0 0 374.824 3.856 20 5 FHBDRN CSC1CCN(C(=O)c2cc([N+](=O)[O-])cc(Br)c2C)CC1 ZINC000601690200 568134300 /nfs/dbraw/zinc/13/43/00/568134300.db2.gz UFOXVTOACAKVNH-UHFFFAOYSA-N 0 0 373.272 3.633 20 5 FHBDRN CSc1cccc(C(=O)NC[C@H]2CCC3(CCCCC3)O2)c1[N+](=O)[O-] ZINC000481890278 568153563 /nfs/dbraw/zinc/15/35/63/568153563.db2.gz IKXDTINYMJAPIM-CYBMUJFWSA-N 0 0 364.467 3.928 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)NCc2ccnc(OC(C)C)c2)cc1[N+](=O)[O-] ZINC000159348597 568159186 /nfs/dbraw/zinc/15/91/86/568159186.db2.gz KXSYYIMHWQBOSA-CQSZACIVSA-N 0 0 372.425 3.646 20 5 FHBDRN Cc1ccc(F)c(OCC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)c1 ZINC000481866735 568162820 /nfs/dbraw/zinc/16/28/20/568162820.db2.gz SXHCMNGTLMGQDR-UHFFFAOYSA-N 0 0 360.385 3.560 20 5 FHBDRN O=C(CSc1ccccc1[N+](=O)[O-])NC[C@@H]1CCC2(CCCCC2)O1 ZINC000481853685 568162992 /nfs/dbraw/zinc/16/29/92/568162992.db2.gz IIQDFZCKVCLKAO-AWEZNQCLSA-N 0 0 364.467 3.685 20 5 FHBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)NCCNc1ccccn1 ZINC000481898771 568164504 /nfs/dbraw/zinc/16/45/04/568164504.db2.gz HEJGKAUHXQNZAL-UHFFFAOYSA-N 0 0 374.466 3.580 20 5 FHBDRN CC(C)(C)n1nccc1NC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000159351606 568188160 /nfs/dbraw/zinc/18/81/60/568188160.db2.gz PPQMQGDADCNJGY-UHFFFAOYSA-N 0 0 367.203 3.561 20 5 FHBDRN C[C@H]1C[C@@H]1c1ccc(CNC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)o1 ZINC000603971922 568188540 /nfs/dbraw/zinc/18/85/40/568188540.db2.gz WCFXYHKHSCAPSX-BBRMVZONSA-N 0 0 369.421 3.841 20 5 FHBDRN COC(=O)c1cc(OCc2cccc(Br)c2)ccc1[N+](=O)[O-] ZINC000481946064 568195265 /nfs/dbraw/zinc/19/52/65/568195265.db2.gz UAJMYSCQYKVIFQ-UHFFFAOYSA-N 0 0 366.167 3.723 20 5 FHBDRN COc1ccc(Cl)c(NS(=O)(=O)c2c(C)cc([N+](=O)[O-])cc2C)c1 ZINC000481949652 568195387 /nfs/dbraw/zinc/19/53/87/568195387.db2.gz BXCKTQFHYOCYBF-UHFFFAOYSA-N 0 0 370.814 3.674 20 5 FHBDRN O=C(Nc1ccc2c(c1)OC1(CCCC1)O2)c1ccc([O-])c([N+](=O)[O-])c1 ZINC000436633871 568195813 /nfs/dbraw/zinc/19/58/13/568195813.db2.gz CWLGEAVSOHVXJB-UHFFFAOYSA-N 0 0 356.334 3.594 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N[C@@H](C)c1ccc(Cl)cc1 ZINC000604021458 568199971 /nfs/dbraw/zinc/19/99/71/568199971.db2.gz VORDAPXNJGCGGJ-NSHDSACASA-N 0 0 354.815 3.596 20 5 FHBDRN Cc1cc(NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)n(C(C)(C)C)n1 ZINC000541911502 568210354 /nfs/dbraw/zinc/21/03/54/568210354.db2.gz CWENICYBQPEOBZ-UHFFFAOYSA-N 0 0 368.340 3.708 20 5 FHBDRN COC(=O)c1cc(OCCOc2ccc3ccccc3c2)ccc1[N+](=O)[O-] ZINC000481987015 568215707 /nfs/dbraw/zinc/21/57/07/568215707.db2.gz VIEMKKJTQRHIDC-UHFFFAOYSA-N 0 0 367.357 3.992 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(N2CCN([C@H](C)c3ccc(Cl)cc3)CC2)n1 ZINC000481995557 568221705 /nfs/dbraw/zinc/22/17/05/568221705.db2.gz YUDVEVJJVOSSNW-CQSZACIVSA-N 0 0 360.845 3.835 20 5 FHBDRN CCCC1CCC(NC(=O)c2cc(OC)c(OC)cc2[N+](=O)[O-])CC1 ZINC000055432775 568227075 /nfs/dbraw/zinc/22/70/75/568227075.db2.gz IKJNANSFYJVWSW-UHFFFAOYSA-N 0 0 350.415 3.701 20 5 FHBDRN CCN(Cc1ccc(OC)cc1OC)C(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000568823703 568230275 /nfs/dbraw/zinc/23/02/75/568230275.db2.gz UUMHHCUUTOABRF-AWEZNQCLSA-N 0 0 372.421 3.764 20 5 FHBDRN CCC(=O)c1ccc([O-])c(NC(=O)c2ccc([N+](=O)[O-])c3cccnc23)c1 ZINC000436649300 568232561 /nfs/dbraw/zinc/23/25/61/568232561.db2.gz OPLLVAUVLNOMBT-UHFFFAOYSA-N 0 0 365.345 3.694 20 5 FHBDRN CCOC(=O)c1ccc(NC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)cc1 ZINC000007473734 568234792 /nfs/dbraw/zinc/23/47/92/568234792.db2.gz FNXBZZBMVBTJPL-GFCCVEGCSA-N 0 0 374.418 3.891 20 5 FHBDRN COc1ccc(CSCC(=O)N2C[C@@H](C)c3ccccc32)cc1[N+](=O)[O-] ZINC000482034670 568234993 /nfs/dbraw/zinc/23/49/93/568234993.db2.gz CSNJWTBABZIDIR-CYBMUJFWSA-N 0 0 372.446 3.987 20 5 FHBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N(Cc2ccco2)c2ccccc2)cc1 ZINC000054533770 568247115 /nfs/dbraw/zinc/24/71/15/568247115.db2.gz CNTSAVPMOANZCD-UHFFFAOYSA-N 0 0 358.375 3.583 20 5 FHBDRN Cc1cc(N[C@@H](c2ccc([N+](=O)[O-])cc2)C(F)(F)F)cc(OCCO)c1 ZINC000568889997 568248236 /nfs/dbraw/zinc/24/82/36/568248236.db2.gz QFJWWFSVBUCYAW-INIZCTEOSA-N 0 0 370.327 3.990 20 5 FHBDRN CCS[C@@H]1CCCC[C@H]1NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000541927806 568248881 /nfs/dbraw/zinc/24/88/81/568248881.db2.gz NONGCDKUKIPDFE-BXUZGUMPSA-N 0 0 374.409 3.990 20 5 FHBDRN Cc1nc(N[C@H](CCO)c2ccccc2Br)ccc1[N+](=O)[O-] ZINC000541932942 568250644 /nfs/dbraw/zinc/25/06/44/568250644.db2.gz AIRZQUSGXKMJNS-CYBMUJFWSA-N 0 0 366.215 3.596 20 5 FHBDRN O=C(Nc1cccc(OCCF)c1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000541927626 568250944 /nfs/dbraw/zinc/25/09/44/568250944.db2.gz KNAMLWMINDTSLQ-UHFFFAOYSA-N 0 0 370.283 3.797 20 5 FHBDRN Cn1nc(NC(=O)c2cc(Cl)cc(Cl)c2[N+](=O)[O-])cc1C1CC1 ZINC000291670433 568252554 /nfs/dbraw/zinc/25/25/54/568252554.db2.gz RDVIZZSJIRLQOR-UHFFFAOYSA-N 0 0 355.181 3.765 20 5 FHBDRN COc1ccc(OC)c([C@@H]2CCCN2C(=O)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC000015827707 568252576 /nfs/dbraw/zinc/25/25/76/568252576.db2.gz LWLJIZPVDGXKDW-SFHVURJKSA-N 0 0 370.405 3.518 20 5 FHBDRN COc1ccc([C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])cc2)c(OC)c1 ZINC000015829194 568252587 /nfs/dbraw/zinc/25/25/87/568252587.db2.gz RQOBGWOOLNGCGE-QGZVFWFLSA-N 0 0 356.378 3.589 20 5 FHBDRN O=[N+]([O-])c1cnc(NCCCc2ccc(O)cc2)c(Br)c1 ZINC000436663650 568253787 /nfs/dbraw/zinc/25/37/87/568253787.db2.gz GFOZQZBDBMLYPS-UHFFFAOYSA-N 0 0 352.188 3.503 20 5 FHBDRN CCOC(=O)c1cc(C(=O)Nc2nc3ccccc3s2)cc([N+](=O)[O-])c1 ZINC000007767675 568254377 /nfs/dbraw/zinc/25/43/77/568254377.db2.gz UAAYMARWHKUZMQ-UHFFFAOYSA-N 0 0 371.374 3.634 20 5 FHBDRN CCCc1n[nH]c(C(=O)N2C[C@H](c3ccccc3)C3(CCC3)C2)c1[N+](=O)[O-] ZINC000412664046 568254455 /nfs/dbraw/zinc/25/44/55/568254455.db2.gz CIAQUSOIZCAOOS-OAHLLOKOSA-N 0 0 368.437 3.680 20 5 FHBDRN CCS[C@H](C)c1noc(CN(C)c2ccc([N+](=O)[O-])c3cccnc32)n1 ZINC000482080743 568254972 /nfs/dbraw/zinc/25/49/72/568254972.db2.gz VRUZMLKKZPFVNO-LLVKDONJSA-N 0 0 373.438 3.977 20 5 FHBDRN CNc1ccc(C(=O)N2CC[C@](C)(c3ccc(C)cc3)C2)cc1[N+](=O)[O-] ZINC000568949290 568254993 /nfs/dbraw/zinc/25/49/93/568254993.db2.gz RAHVITFTZTVCMF-FQEVSTJZSA-N 0 0 353.422 3.749 20 5 FHBDRN Cc1cc(-c2noc([C@H]3CC(=O)N(C4CCCCC4)C3)n2)cc([N+](=O)[O-])c1 ZINC000568959533 568255934 /nfs/dbraw/zinc/25/59/34/568255934.db2.gz IWKVCFWYEUZKMC-AWEZNQCLSA-N 0 0 370.409 3.602 20 5 FHBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1C[C@H](C)O[C@H]1C ZINC000412665661 568258587 /nfs/dbraw/zinc/25/85/87/568258587.db2.gz XWZMFIJYJCKFKC-IHRRRGAJSA-N 0 0 366.483 3.886 20 5 FHBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1C[C@@H](C)O[C@@H]1C ZINC000412665662 568258623 /nfs/dbraw/zinc/25/86/23/568258623.db2.gz XWZMFIJYJCKFKC-MCIONIFRSA-N 0 0 366.483 3.886 20 5 FHBDRN CCCc1[nH]nc(C(=O)Nc2cccc(OC3CCCC3)c2)c1[N+](=O)[O-] ZINC000609473672 568261057 /nfs/dbraw/zinc/26/10/57/568261057.db2.gz XPKLUTYMKYTXME-UHFFFAOYSA-N 0 0 358.398 3.844 20 5 FHBDRN C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1[O-])c1nc(-c2ccccc2)cs1 ZINC000436665053 568262493 /nfs/dbraw/zinc/26/24/93/568262493.db2.gz MVTMOOOSLRWXCB-LLVKDONJSA-N 0 0 369.402 3.915 20 5 FHBDRN CCCCOC1CCN(C(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)CC1 ZINC000541944875 568271121 /nfs/dbraw/zinc/27/11/21/568271121.db2.gz KSJFKNLFNYSNQV-UHFFFAOYSA-N 0 0 372.368 3.618 20 5 FHBDRN CSc1cccc(C(=O)N[C@H]2c3ccc(F)cc3O[C@@H]2C)c1[N+](=O)[O-] ZINC000569027978 568275583 /nfs/dbraw/zinc/27/55/83/568275583.db2.gz XWMJPMYUDRAMHV-RFAUZJTJSA-N 0 0 362.382 3.708 20 5 FHBDRN O=C(N[C@H](C1CC1)C(F)(F)F)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC000291726368 568282556 /nfs/dbraw/zinc/28/25/56/568282556.db2.gz HVZOWRIMKOTACB-OAHLLOKOSA-N 0 0 365.311 3.728 20 5 FHBDRN CC[C@H](C)n1ncc(NC(=O)N(C)CCc2ccccc2[N+](=O)[O-])c1C ZINC000482143770 568285066 /nfs/dbraw/zinc/28/50/66/568285066.db2.gz SMHYDYBTYAWNTA-ZDUSSCGKSA-N 0 0 359.430 3.777 20 5 FHBDRN O=C(NC[C@@H]1CCO[C@@H]1c1ccccc1)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000569047951 568285465 /nfs/dbraw/zinc/28/54/65/568285465.db2.gz YXQGWGGFYVRQDL-HNAYVOBHSA-N 0 0 365.389 3.584 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N1CCN(c2cccc(C)c2)CC1 ZINC000569055917 568292914 /nfs/dbraw/zinc/29/29/14/568292914.db2.gz PZDBHRDHDMWRRD-UHFFFAOYSA-N 0 0 368.437 3.820 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)N2CCOC[C@H]2CC2CCC2)cc1[N+](=O)[O-] ZINC000569146281 568293329 /nfs/dbraw/zinc/29/33/29/568293329.db2.gz GYSASUWGCPMVSN-MRXNPFEDSA-N 0 0 360.454 3.924 20 5 FHBDRN C[C@H](C(=O)Nc1cc2c(cc1Cl)OCCO2)c1cccc([N+](=O)[O-])c1 ZINC000569063288 568295897 /nfs/dbraw/zinc/29/58/97/568295897.db2.gz ADTBCXVVOCEZTJ-JTQLQIEISA-N 0 0 362.769 3.762 20 5 FHBDRN O=[N+]([O-])c1sccc1NCc1cc(Br)c2c(c1)OCCO2 ZINC000604460154 568296097 /nfs/dbraw/zinc/29/60/97/568296097.db2.gz NQCZHEHXFHWHSG-UHFFFAOYSA-N 0 0 371.212 3.802 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N[C@H]2CC=C(c3ccc(F)cc3)CC2)c1[N+](=O)[O-] ZINC000482161117 568297588 /nfs/dbraw/zinc/29/75/88/568297588.db2.gz VQTCYUGSHSJETG-HNNXBMFYSA-N 0 0 372.400 3.946 20 5 FHBDRN CC(C)C[C@@H]1OCCC[C@@H]1NC(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000482180728 568302201 /nfs/dbraw/zinc/30/22/01/568302201.db2.gz LQPXGQYRIJHYML-COXVUDFISA-N 0 0 366.483 3.785 20 5 FHBDRN CO[C@H]1CCN(C(=O)c2ccc(Sc3ccc(C)cc3)c([N+](=O)[O-])c2)C1 ZINC000482181219 568302253 /nfs/dbraw/zinc/30/22/53/568302253.db2.gz MGOAXQJFGDHCOU-HNNXBMFYSA-N 0 0 372.446 3.915 20 5 FHBDRN CCOc1cc(SCC(=O)Nc2ccc(F)cc2)ccc1[N+](=O)[O-] ZINC000541993175 568302562 /nfs/dbraw/zinc/30/25/62/568302562.db2.gz BRMAVYAYOSTLCU-UHFFFAOYSA-N 0 0 350.371 3.863 20 5 FHBDRN CCc1cc(NC(=O)c2snnc2C2CC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000291782241 568310150 /nfs/dbraw/zinc/31/01/50/568310150.db2.gz QDQHDEWMRFZMHJ-UHFFFAOYSA-N 0 0 369.406 3.687 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])NC[C@H]1CCCC[C@@H]1C(F)(F)F ZINC000482199172 568311222 /nfs/dbraw/zinc/31/12/22/568311222.db2.gz OOHGHABIQGJSTB-OLZOCXBDSA-N 0 0 374.359 3.849 20 5 FHBDRN COc1ccc(-c2noc(/C=C\c3ccc(F)cc3[N+](=O)[O-])n2)cc1OC ZINC000609474026 568314236 /nfs/dbraw/zinc/31/42/36/568314236.db2.gz ZFYRXDMLBNJZBL-YVMONPNESA-N 0 0 371.324 3.972 20 5 FHBDRN COc1ccc(COCCCC(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)cc1 ZINC000541992238 568315265 /nfs/dbraw/zinc/31/52/65/568315265.db2.gz VKHQTWHOQCNGSF-UHFFFAOYSA-N 0 0 374.393 3.548 20 5 FHBDRN O=[N+]([O-])c1ccccc1Cc1noc([C@@H]2CCN(c3ccccc3)C2)n1 ZINC000453061305 568321664 /nfs/dbraw/zinc/32/16/64/568321664.db2.gz SPCXCYUANYUCDC-OAHLLOKOSA-N 0 0 350.378 3.563 20 5 FHBDRN CCc1n[nH]c(C(=O)NCC2(c3cccc(C)c3)CCCCC2)c1[N+](=O)[O-] ZINC000609476596 568323772 /nfs/dbraw/zinc/32/37/72/568323772.db2.gz JOESTZKTHDBWMN-UHFFFAOYSA-N 0 0 370.453 3.821 20 5 FHBDRN O=[N+]([O-])c1ccccc1Cc1noc([C@H]2CCN(c3ccccc3)C2)n1 ZINC000453061302 568324436 /nfs/dbraw/zinc/32/44/36/568324436.db2.gz SPCXCYUANYUCDC-HNNXBMFYSA-N 0 0 350.378 3.563 20 5 FHBDRN O=C(N[C@H]1COc2cccc(F)c21)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000365216936 568327520 /nfs/dbraw/zinc/32/75/20/568327520.db2.gz CXULKUVNWCYVPZ-KRWDZBQOSA-N 0 0 374.371 3.684 20 5 FHBDRN CC1(C)CN(C(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)[C@H]1c1cccs1 ZINC000569289222 568337471 /nfs/dbraw/zinc/33/74/71/568337471.db2.gz PABUDHSQBNIGDH-INIZCTEOSA-N 0 0 374.418 3.651 20 5 FHBDRN Cc1nn(Cc2ccc(C(=O)NCCC(C)(C)C)cc2)c(C)c1[N+](=O)[O-] ZINC000031760011 568337511 /nfs/dbraw/zinc/33/75/11/568337511.db2.gz HWWNORDIYFIIDU-UHFFFAOYSA-N 0 0 358.442 3.622 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc2cnncc21 ZINC000617146724 568361461 /nfs/dbraw/zinc/36/14/61/568361461.db2.gz MZLSQRVOARXZFQ-LLVKDONJSA-N 0 0 354.391 3.657 20 5 FHBDRN Cc1ccc2[nH]c(SCC(=O)Nc3c(C)cccc3[N+](=O)[O-])nc2c1 ZINC000005356430 568386815 /nfs/dbraw/zinc/38/68/15/568386815.db2.gz CSRLZUVJSNTWSY-UHFFFAOYSA-N 0 0 356.407 3.819 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)NC[C@]2(C)CCCc3ccccc32)c1 ZINC000182010572 568389117 /nfs/dbraw/zinc/38/91/17/568389117.db2.gz FPXLMKNRWZBHDS-FQEVSTJZSA-N 0 0 354.406 3.627 20 5 FHBDRN Cc1ccc(NC(=O)COc2ccccc2Br)cc1[N+](=O)[O-] ZINC000005754114 568392797 /nfs/dbraw/zinc/39/27/97/568392797.db2.gz PUDRAXHOGLUVON-UHFFFAOYSA-N 0 0 365.183 3.683 20 5 FHBDRN CCc1ccc(C(=O)CCC(=O)Nc2cc([N+](=O)[O-])ccc2NC)cc1 ZINC000569460633 568398967 /nfs/dbraw/zinc/39/89/67/568398967.db2.gz LBSCYOMWPLCDTL-UHFFFAOYSA-N 0 0 355.394 3.801 20 5 FHBDRN COc1ccc(NC(=O)c2cnc3onc(C(C)(C)C)c3c2)cc1[N+](=O)[O-] ZINC000541999108 568399374 /nfs/dbraw/zinc/39/93/74/568399374.db2.gz MNRHAKUQBSYWLC-UHFFFAOYSA-N 0 0 370.365 3.689 20 5 FHBDRN COc1cc(-c2nc(Cc3ccc(F)cc3F)no2)cc([N+](=O)[O-])c1C ZINC000569527774 568405537 /nfs/dbraw/zinc/40/55/37/568405537.db2.gz PEDOGLIPDVFFCP-UHFFFAOYSA-N 0 0 361.304 3.831 20 5 FHBDRN O=C(NCCOc1ccccc1F)c1c([N+](=O)[O-])cccc1C(F)(F)F ZINC000569532365 568405930 /nfs/dbraw/zinc/40/59/30/568405930.db2.gz SGPMEVNHRYJMMG-UHFFFAOYSA-N 0 0 372.274 3.562 20 5 FHBDRN O=[N+]([O-])c1ccccc1N1CCN(Cc2ccccc2C(F)(F)F)CC1 ZINC000032831953 568410199 /nfs/dbraw/zinc/41/01/99/568410199.db2.gz LMICTXUJPWAKPF-UHFFFAOYSA-N 0 0 365.355 3.936 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)ccc1N1CC[C@@](CO)(Cc2ccc(F)cc2)C1 ZINC000569731706 568414462 /nfs/dbraw/zinc/41/44/62/568414462.db2.gz UNPZANSUMWMVGV-GOSISDBHSA-N 0 0 364.804 3.819 20 5 FHBDRN COc1cc(C(=O)NC[C@H]2CC[C@H](c3ccccc3)O2)cc([N+](=O)[O-])c1C ZINC000569735373 568414893 /nfs/dbraw/zinc/41/48/93/568414893.db2.gz VMHUZYLRXXOSEO-SJLPKXTDSA-N 0 0 370.405 3.562 20 5 FHBDRN COc1ccc(NC(=O)c2csc(-c3ncccc3F)n2)cc1[N+](=O)[O-] ZINC000541999576 568422893 /nfs/dbraw/zinc/42/28/93/568422893.db2.gz LYEORKWXNRGJJI-UHFFFAOYSA-N 0 0 374.353 3.513 20 5 FHBDRN C[C@@H](CCCC(F)(F)F)NC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000569849439 568429014 /nfs/dbraw/zinc/42/90/14/568429014.db2.gz CRJLBHBJQSALBQ-QMMMGPOBSA-N 0 0 354.275 3.653 20 5 FHBDRN CC[C@@H](c1ccccc1OC)N(C)c1nc(C)cc(C(=O)OC)c1[N+](=O)[O-] ZINC000569881996 568433334 /nfs/dbraw/zinc/43/33/34/568433334.db2.gz JJVHOEOCHAMXTJ-HNNXBMFYSA-N 0 0 373.409 3.681 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)NCCOCc1cccc(OC)c1 ZINC000569892750 568433953 /nfs/dbraw/zinc/43/39/53/568433953.db2.gz SAJZZKWPZRTLOA-UHFFFAOYSA-N 0 0 373.409 3.504 20 5 FHBDRN Cc1cc(NC[C@@H]2CCC[N@@H+]2C2CCCCC2)cc(C(=O)[O-])c1[N+](=O)[O-] ZINC000569852022 568439066 /nfs/dbraw/zinc/43/90/66/568439066.db2.gz OYBWWDGTQHRTAI-INIZCTEOSA-N 0 0 361.442 3.810 20 5 FHBDRN CNc1ccc([N+](=O)[O-])cc1NC(=O)CO[C@H]1CCCc2ccccc21 ZINC000570096173 568450638 /nfs/dbraw/zinc/45/06/38/568450638.db2.gz GTZHLBVAYZWTRZ-SFHVURJKSA-N 0 0 355.394 3.669 20 5 FHBDRN CNc1ccc([N+](=O)[O-])cc1NC(=O)c1cc(C2CC2)n(C(C)(C)C)n1 ZINC000570096842 568450704 /nfs/dbraw/zinc/45/07/04/568450704.db2.gz UWWWQGMISWOYRA-UHFFFAOYSA-N 0 0 357.414 3.718 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)[C@H]1C[C@@H]1c1c(F)cccc1F ZINC000570113367 568451634 /nfs/dbraw/zinc/45/16/34/568451634.db2.gz JHJVABGDTSHZNB-KBPBESRZSA-N 0 0 360.360 3.678 20 5 FHBDRN CCCOc1ccc(CNC(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)cc1 ZINC000570121725 568452369 /nfs/dbraw/zinc/45/23/69/568452369.db2.gz MBFCGCGYOSOGCI-UHFFFAOYSA-N 0 0 364.348 3.521 20 5 FHBDRN CN(C(=O)CCCOc1ccc2c(c1)CCCC2)c1ccc([N+](=O)[O-])nc1 ZINC000570123087 568452534 /nfs/dbraw/zinc/45/25/34/568452534.db2.gz GAROTQMUEUBTQD-UHFFFAOYSA-N 0 0 369.421 3.691 20 5 FHBDRN Cc1ccc(-c2nc(C(C)(C)NC(=O)c3ccccc3)no2)cc1[N+](=O)[O-] ZINC000570127075 568452983 /nfs/dbraw/zinc/45/29/83/568452983.db2.gz KWEIUGDGNCBSRK-UHFFFAOYSA-N 0 0 366.377 3.618 20 5 FHBDRN O=C(NC1(c2ccc(C(F)(F)F)cc2)CCCC1)c1c[nH]nc1[N+](=O)[O-] ZINC000570184777 568460024 /nfs/dbraw/zinc/46/00/24/568460024.db2.gz RRLNSGLQKRTBTA-UHFFFAOYSA-N 0 0 368.315 3.536 20 5 FHBDRN Cc1cc(Cl)cc(CN2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)c1 ZINC000570232811 568463872 /nfs/dbraw/zinc/46/38/72/568463872.db2.gz PJOSOPBNVBTTTI-UHFFFAOYSA-N 0 0 373.840 3.515 20 5 FHBDRN COc1ccc(CC(=O)N2CC(C)(C)[C@H]2c2cccs2)cc1[N+](=O)[O-] ZINC000570238667 568465095 /nfs/dbraw/zinc/46/50/95/568465095.db2.gz SIKOYWYEPKXNOC-QGZVFWFLSA-N 0 0 360.435 3.817 20 5 FHBDRN Cc1noc(C)c1C[C@@H](C)Nc1ncc([N+](=O)[O-])c(C)c1Br ZINC000570318087 568467789 /nfs/dbraw/zinc/46/77/89/568467789.db2.gz AZTSQAVCCKYJRL-SSDOTTSWSA-N 0 0 369.219 3.709 20 5 FHBDRN CCc1ccc(C(=O)N2CC[C@@]3(C2)CCc2ccccc2O3)cc1[N+](=O)[O-] ZINC000570326378 568469776 /nfs/dbraw/zinc/46/97/76/568469776.db2.gz RUVJJBFBZQDRSC-OAQYLSRUSA-N 0 0 366.417 3.767 20 5 FHBDRN O=C(NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccc([N+](=O)[O-])o1 ZINC000033195098 568470503 /nfs/dbraw/zinc/47/05/03/568470503.db2.gz SQMWCOAFGHZZEW-RNFRBKRXSA-N 0 0 374.237 3.827 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)c1ccc2c(c1)CCCCC2=O ZINC000570442623 568476694 /nfs/dbraw/zinc/47/66/94/568476694.db2.gz MJUDEWANKHSDNX-UHFFFAOYSA-N 0 0 366.417 3.819 20 5 FHBDRN COc1ccc(CN[C@H](C)c2ncc(-c3ccccc3)n2C)cc1[N+](=O)[O-] ZINC000453084761 568506178 /nfs/dbraw/zinc/50/61/78/568506178.db2.gz NRROYIPTLSIEKF-CQSZACIVSA-N 0 0 366.421 3.855 20 5 FHBDRN CCN(C(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1)[C@@H](COC)Cc1ccccc1 ZINC000570778857 568525904 /nfs/dbraw/zinc/52/59/04/568525904.db2.gz NDLLSQXXJLHOGY-OXJNMPFZSA-N 0 0 370.449 3.805 20 5 FHBDRN Cc1cc(OCC(=O)N(C)Cc2nc3ccccc3s2)ccc1[N+](=O)[O-] ZINC000007549355 568530405 /nfs/dbraw/zinc/53/04/05/568530405.db2.gz KUIGSJPQBFUPDO-UHFFFAOYSA-N 0 0 371.418 3.550 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](CC)c2ccc(OC)cc2)c1 ZINC000570809390 568531012 /nfs/dbraw/zinc/53/10/12/568531012.db2.gz WOLIEPMLTNBTEC-KRWDZBQOSA-N 0 0 358.394 3.883 20 5 FHBDRN O=[N+]([O-])c1cnc(Oc2ccc3c(c2)[nH]c2ccccc23)c(-c2nn[nH]n2)c1 ZINC000823652275 599276225 /nfs/dbraw/zinc/27/62/25/599276225.db2.gz YEAJITUAKRFALV-UHFFFAOYSA-N 0 0 373.332 3.597 20 5 FHBDRN C[C@@H](SCc1ccc(F)cc1-c1nn[nH]n1)c1cccc([N+](=O)[O-])c1 ZINC000736192125 598314535 /nfs/dbraw/zinc/31/45/35/598314535.db2.gz KYHQLSMTVIHELR-SNVBAGLBSA-N 0 0 359.386 3.908 20 5 FHBDRN O=[N+]([O-])c1ccc(N[C@H](c2ccccc2)C2CCC2)c(-c2nn[nH]n2)c1 ZINC000738370378 598796986 /nfs/dbraw/zinc/79/69/86/598796986.db2.gz PGKOLLGCMVJJPX-QGZVFWFLSA-N 0 0 350.382 3.728 20 5 FHBDRN C[C@H](c1cc2ccccc2o1)N(C)c1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-] ZINC000736194905 598813830 /nfs/dbraw/zinc/81/38/30/598813830.db2.gz DUMROMFKILDXIJ-LLVKDONJSA-N 0 0 364.365 3.719 20 5 FHBDRN O=[N+]([O-])c1cnc(Nc2ccc(Nc3ccccc3)cc2)c(-c2nn[nH]n2)c1 ZINC000823650776 599446307 /nfs/dbraw/zinc/44/63/07/599446307.db2.gz AOYUWLNAKTVXON-UHFFFAOYSA-N 0 0 374.364 3.657 20 5 FHBDRN C[C@@H](CNc1ccc(/C=C\C(=O)[O-])cc1[N+](=O)[O-])[N@H+](C)Cc1ccccc1 ZINC000736606910 600239741 /nfs/dbraw/zinc/23/97/41/600239741.db2.gz NDBDJUCVJZUXOF-KLQCNHIUSA-N 0 0 369.421 3.625 20 5 FHBDRN O=C([O-])[C@H]([NH2+]CCc1ccccc1[N+](=O)[O-])c1ccc(Cl)cc1Cl ZINC000833166350 600756997 /nfs/dbraw/zinc/75/69/97/600756997.db2.gz PDALJEYDBGBEME-OAHLLOKOSA-N 0 0 369.204 3.860 20 5 FHBDRN CC[C@@](C)(CC(=O)[O-])[NH2+]Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000828664634 601432218 /nfs/dbraw/zinc/43/22/18/601432218.db2.gz DHDWZRLLEVHTRG-SFHVURJKSA-N 0 0 362.382 3.596 20 5 FHBDRN Cc1c(C[N@@H+](C)[C@@H](C(=O)[O-])c2cc(F)c(F)c(F)c2)cccc1[N+](=O)[O-] ZINC000832853754 601902040 /nfs/dbraw/zinc/90/20/40/601902040.db2.gz UKKKVNPZCLXDGA-MRXNPFEDSA-N 0 0 368.311 3.578 20 5 FHBDRN C[C@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)[C@H]1CCCN(C(=O)[O-])C1 ZINC000739030652 602270490 /nfs/dbraw/zinc/27/04/90/602270490.db2.gz BNMGNDWIVBDWHR-ZFWWWQNUSA-N 0 0 373.409 3.723 20 5 FHBDRN Cc1ccc([C@H](CNc2cc(C)c([N+](=O)[O-])c(C(=O)[O-])c2)[NH+]2CCCC2)o1 ZINC000566291486 602315540 /nfs/dbraw/zinc/31/55/40/602315540.db2.gz KFPNRNOJQYRFBV-INIZCTEOSA-N 0 0 373.409 3.752 20 5 FHBDRN Cc1cc(NC2CCC([NH+]3CCCCC3)CC2)cc(C(=O)[O-])c1[N+](=O)[O-] ZINC000832897705 602323834 /nfs/dbraw/zinc/32/38/34/602323834.db2.gz UPZWHRCPZUUWQQ-UHFFFAOYSA-N 0 0 361.442 3.810 20 5 FHBDRN O=C([O-])N1CCC([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 ZINC000739924775 602648138 /nfs/dbraw/zinc/64/81/38/602648138.db2.gz MOEOZNZNQOIOJY-UHFFFAOYSA-N 0 0 361.423 3.555 20 5 FHBDRN C[N@@H+]1CC[C@H](Nc2ccc(/C=C/C(=O)[O-])cc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000833697934 604679386 /nfs/dbraw/zinc/67/93/86/604679386.db2.gz JXEHSQQOBLQAHA-UILBMPDPSA-N 0 0 367.405 3.550 20 5 FHBDRN Cc1ccc([C@H](C)[NH2+]Cc2ccc(CCNC(=O)[O-])cc2)cc1[N+](=O)[O-] ZINC000830256911 604943101 /nfs/dbraw/zinc/94/31/01/604943101.db2.gz NPJMHTTZKPIQQA-AWEZNQCLSA-N 0 0 357.410 3.564 20 5 FHBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@H](C(C)(C)C(=O)[O-])C1 ZINC000593747754 604944274 /nfs/dbraw/zinc/94/42/74/604944274.db2.gz BJACGJZPORHKPL-OAHLLOKOSA-N 0 0 364.442 3.705 20 5 FHBDRN CC(C)(C(=O)[O-])[C@@H]1CCC[N@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000593747875 604946277 /nfs/dbraw/zinc/94/62/77/604946277.db2.gz DXGODKKYXYCRPC-CQSZACIVSA-N 0 0 373.409 3.573 20 5 FHBDRN C[C@@H](Sc1nccc(-c2nn[nH]n2)c1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000820555738 606702638 /nfs/dbraw/zinc/70/26/38/606702638.db2.gz OTKVMGUHRURJRH-MRVPVSSYSA-N 0 0 362.802 3.677 20 5 FHBDRN CC(C)(C)Sc1ccc(Nc2nccc(-c3nn[nH]n3)c2[N+](=O)[O-])cc1 ZINC000819950248 606706474 /nfs/dbraw/zinc/70/64/74/606706474.db2.gz GGWSIDNUAOVXIB-UHFFFAOYSA-N 0 0 371.426 3.804 20 5 FHBDRN O=[N+]([O-])c1c(-c2nn[nH]n2)ccnc1Oc1ccc(-c2ccccc2)cc1 ZINC000823630257 607162231 /nfs/dbraw/zinc/16/22/31/607162231.db2.gz UQEWOXPTGPTDHG-UHFFFAOYSA-N 0 0 360.333 3.629 20 5 FHBDRN O=[N+]([O-])c1ccc2oc(C(Cl)=Cc3ccccc3-c3nn[nH]n3)nc2c1 ZINC000826499241 607885081 /nfs/dbraw/zinc/88/50/81/607885081.db2.gz AVAZWHNAHXVWOJ-KPKJPENVSA-N 0 0 368.740 3.653 20 5 FHBDRN O=[N+]([O-])c1c(Oc2cc(Cl)ccc2-c2nn[nH]n2)ccc2ncccc21 ZINC000826497434 608123977 /nfs/dbraw/zinc/12/39/77/608123977.db2.gz HFSUESWTNUHCML-UHFFFAOYSA-N 0 0 368.740 3.769 20 5 FHBDRN CCOc1cc(Oc2ccc(-c3nn[nH]n3)cc2Cl)ccc1[N+](=O)[O-] ZINC000825615866 608172420 /nfs/dbraw/zinc/17/24/20/608172420.db2.gz NVEQKOCQEJTTFK-UHFFFAOYSA-N 0 0 361.745 3.619 20 5 FHBDRN O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1N[C@@H]1CCSc2c(F)cccc21 ZINC000826497678 609601299 /nfs/dbraw/zinc/60/12/99/609601299.db2.gz PTEOLMADANYBFD-GFCCVEGCSA-N 0 0 372.385 3.563 20 5 FHBDRN Cc1ccnc([C@@H]2CCN(C(=O)[C@@H](C)c3ccc([N+](=O)[O-])cc3F)C2)c1 ZINC000572899027 936324895 /nfs/dbraw/zinc/32/48/95/936324895.db2.gz QIWLZLSFPKPMNU-UONOGXRCSA-N 0 0 357.385 3.557 20 5 FHBDRN COc1ccc(-c2nc(Cc3ccc4ccccc4n3)no2)cc1[N+](=O)[O-] ZINC000612893615 936335767 /nfs/dbraw/zinc/33/57/67/936335767.db2.gz DIOFRZSTCANPPC-UHFFFAOYSA-N 0 0 362.345 3.792 20 5 FHBDRN CCOCCOCc1cccc(NC(=O)Cc2cccc([N+](=O)[O-])c2C)c1 ZINC000162035112 936336512 /nfs/dbraw/zinc/33/65/12/936336512.db2.gz XSANTLABMJBACF-UHFFFAOYSA-N 0 0 372.421 3.638 20 5 FHBDRN C[C@@H]1CCCC[C@H]1CNC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC001125640079 936338872 /nfs/dbraw/zinc/33/88/72/936338872.db2.gz YJPLGQDRIVYMBI-MNOVXSKESA-N 0 0 355.232 3.913 20 5 FHBDRN COCc1ccc([C@H]2CCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])o1 ZINC000162017430 936339735 /nfs/dbraw/zinc/33/97/35/936339735.db2.gz JJDDRKLZXWLSBC-VGMNTSGFSA-N 0 0 356.378 3.711 20 5 FHBDRN CC[C@H](C)n1ncc(C(=O)N(C)CCc2ccccc2[N+](=O)[O-])c1C1CC1 ZINC000572907944 936343232 /nfs/dbraw/zinc/34/32/32/936343232.db2.gz JNHQKQKWHKMRSC-AWEZNQCLSA-N 0 0 370.453 3.954 20 5 FHBDRN CN(C(=O)CCNc1ccccc1[N+](=O)[O-])c1nc2ccccc2s1 ZINC000046567131 936367867 /nfs/dbraw/zinc/36/78/67/936367867.db2.gz BEASVYVOKHEICC-UHFFFAOYSA-N 0 0 356.407 3.670 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N(C)c1ccc(OC)c(OC)c1 ZINC000583010007 936369129 /nfs/dbraw/zinc/36/91/29/936369129.db2.gz FHVWBAKEAFEEPA-UHFFFAOYSA-N 0 0 359.382 3.843 20 5 FHBDRN CC(C)c1sc(NC(=O)c2n[nH]cc2[N+](=O)[O-])nc1-c1ccccc1 ZINC000135958318 936370671 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Cc1noc(C)c1[C@H](C)CNC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000178873955 937412046 /nfs/dbraw/zinc/41/20/46/937412046.db2.gz QXGWTWDERFYGPZ-SECBINFHSA-N 0 0 359.407 3.948 20 5 FHBDRN CC[C@@](C)(NC(=O)CSc1ccccc1[N+](=O)[O-])c1nccs1 ZINC000124663215 930420989 /nfs/dbraw/zinc/42/09/89/930420989.db2.gz BYLOELRUBCKTTH-OAHLLOKOSA-N 0 0 351.453 3.585 20 5 FHBDRN CCn1cc([C@H]2OCCC[C@@H]2Nc2ccc(Cl)cc2[N+](=O)[O-])cn1 ZINC000471549199 930423782 /nfs/dbraw/zinc/42/37/82/930423782.db2.gz VOBJLYYOEHSTSB-GOEBONIOSA-N 0 0 350.806 3.797 20 5 FHBDRN O=C(COc1cccc([N+](=O)[O-])c1)N[C@H]1CC[C@H](c2ccc(F)cc2)C1 ZINC000471550369 930447265 /nfs/dbraw/zinc/44/72/65/930447265.db2.gz XXBZSPJDEJLAHS-HOCLYGCPSA-N 0 0 358.369 3.565 20 5 FHBDRN C[C@@H]1CN(c2ccc(Br)cc2[N+](=O)[O-])C[C@H](C(F)(F)F)O1 ZINC000610412493 930469751 /nfs/dbraw/zinc/46/97/51/930469751.db2.gz YVPLBNXVFFVYIE-RDDDGLTNSA-N 0 0 369.137 3.513 20 5 FHBDRN C[C@H]1C[C@@H](Nc2cc(C(=O)[O-])ccc2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1 ZINC000379603568 930473330 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FHBDRN CC(=O)c1cc(N[C@@H](c2nccn2C)c2ccccc2)ccc1[N+](=O)[O-] ZINC000561111901 930663447 /nfs/dbraw/zinc/66/34/47/930663447.db2.gz JAAWMUQUCAHRDP-GOSISDBHSA-N 0 0 350.378 3.732 20 5 FHBDRN O=[N+]([O-])c1cc2c(ncnc2Sc2nnc(-c3cccs3)o2)s1 ZINC000561105982 930663814 /nfs/dbraw/zinc/66/38/14/930663814.db2.gz QIQXZSZJYMZQNC-UHFFFAOYSA-N 0 0 363.405 3.862 20 5 FHBDRN COc1ccc(Br)c(C(=O)Nc2cc(F)cc([N+](=O)[O-])c2)c1 ZINC000319613667 930689484 /nfs/dbraw/zinc/68/94/84/930689484.db2.gz KSZFDXJPRPPQAQ-UHFFFAOYSA-N 0 0 369.146 3.757 20 5 FHBDRN COc1ccc(NC(=O)N(C)Cc2nc3ccccc3s2)cc1[N+](=O)[O-] ZINC000580459664 930701100 /nfs/dbraw/zinc/70/11/00/930701100.db2.gz COJQCJIIMVGPPH-UHFFFAOYSA-N 0 0 372.406 3.877 20 5 FHBDRN CCc1ccc(-c2noc(COc3ccc(C(C)=O)cc3[N+](=O)[O-])n2)cc1 ZINC000119126217 930715726 /nfs/dbraw/zinc/71/57/26/930715726.db2.gz BBIWEQYUEDGPQX-UHFFFAOYSA-N 0 0 367.361 3.989 20 5 FHBDRN O=C(NC[C@@H]1Cc2ccccc21)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000119127540 930723122 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FHBDRN Cc1ccc(C(C)C)c(O[C@H](C)C(=O)N(C)c2ccc([N+](=O)[O-])nc2)c1 ZINC000579696023 930805705 /nfs/dbraw/zinc/80/57/05/930805705.db2.gz FMLASQWBMHFFIA-CQSZACIVSA-N 0 0 357.410 3.852 20 5 FHBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)N[C@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000255208378 930819390 /nfs/dbraw/zinc/81/93/90/930819390.db2.gz YZXSITQWPSDJKI-XTIRWZRGSA-N 0 0 366.417 3.892 20 5 FHBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)N[C@H](C[C@H]1CCOC1)c1ccccc1 ZINC000255208377 930819665 /nfs/dbraw/zinc/81/96/65/930819665.db2.gz YZXSITQWPSDJKI-NLLDUDLESA-N 0 0 366.417 3.892 20 5 FHBDRN COc1ccc2c(c1)CCCN(c1ncc([N+](=O)[O-])cc1C(F)(F)F)C2 ZINC000580534367 930820972 /nfs/dbraw/zinc/82/09/72/930820972.db2.gz WZXKSIITUVLKQU-UHFFFAOYSA-N 0 0 367.327 3.970 20 5 FHBDRN CCN(c1ccc2[nH]ccc2c1)S(=O)(=O)c1cc([N+](=O)[O-])cc(C)c1C ZINC000471591129 930834621 /nfs/dbraw/zinc/83/46/21/930834621.db2.gz RLNSEUWVSOCOJY-UHFFFAOYSA-N 0 0 373.434 3.908 20 5 FHBDRN COc1ccc(CCCN(C)C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)cc1 ZINC000119185597 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COc1ccc(C(=O)Nc2ccc([N+](=O)[O-])c(C)n2)cc1-c1ccccn1 ZINC000119277894 931018316 /nfs/dbraw/zinc/01/83/16/931018316.db2.gz ZOSTYFGDAYFHCL-UHFFFAOYSA-N 0 0 364.361 3.621 20 5 FHBDRN C[C@@H](Cc1ccsc1)Nc1cc(CN2CCOCC2)ccc1[N+](=O)[O-] ZINC000580694578 931023400 /nfs/dbraw/zinc/02/34/00/931023400.db2.gz YTIJUIPUKBGPTF-AWEZNQCLSA-N 0 0 361.467 3.532 20 5 FHBDRN CC[C@H](NC(=O)c1cccc(-n2ccnc2)c1)c1cccc([N+](=O)[O-])c1 ZINC000177808899 931045978 /nfs/dbraw/zinc/04/59/78/931045978.db2.gz BOFBXVAHIDRHKZ-SFHVURJKSA-N 0 0 350.378 3.662 20 5 FHBDRN CC[C@@H](NC(=O)c1cccc(-n2ccnc2)c1)c1cccc([N+](=O)[O-])c1 ZINC000177808912 931046297 /nfs/dbraw/zinc/04/62/97/931046297.db2.gz BOFBXVAHIDRHKZ-GOSISDBHSA-N 0 0 350.378 3.662 20 5 FHBDRN Cc1c(Nc2ncc(Br)cc2F)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC001211292028 931081243 /nfs/dbraw/zinc/08/12/43/931081243.db2.gz GWVUNDVXZWVDQS-UHFFFAOYSA-N 0 0 371.122 3.852 20 5 FHBDRN Cc1c(C(=O)Nc2cccc(CN3CCCCC3=O)c2)cccc1[N+](=O)[O-] ZINC000050474770 931105514 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FHBDRN O=C(CCCOc1ccccc1)Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1 ZINC000247313075 931202479 /nfs/dbraw/zinc/20/24/79/931202479.db2.gz JEVMYVXXRVNOQR-UHFFFAOYSA-N 0 0 366.377 3.783 20 5 FHBDRN COc1ccc(CNC(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1F ZINC000175867145 931203269 /nfs/dbraw/zinc/20/32/69/931203269.db2.gz DRZOMZUWYONFJJ-GFCCVEGCSA-N 0 0 361.373 3.611 20 5 FHBDRN C[C@H](c1ccncc1)N(C)C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000119331812 931217368 /nfs/dbraw/zinc/21/73/68/931217368.db2.gz GNAOJAVZUAKXNZ-SNVBAGLBSA-N 0 0 364.199 3.586 20 5 FHBDRN CC[C@@H](Nc1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1)c1cccc(Cl)c1 ZINC000561201581 931230564 /nfs/dbraw/zinc/23/05/64/931230564.db2.gz ZHGMRJDRQSPUTC-CQSZACIVSA-N 0 0 358.785 3.882 20 5 FHBDRN Cc1nn(CC(C)C)c(C)c1CC(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000177840917 931262351 /nfs/dbraw/zinc/26/23/51/931262351.db2.gz PRWIAYCOOKZZPU-AWEZNQCLSA-N 0 0 372.469 3.792 20 5 FHBDRN Cc1nc(C)c([C@@H](C)N(C)c2nnc(-c3ccc([N+](=O)[O-])cc3)n2C)s1 ZINC000580861684 931278640 /nfs/dbraw/zinc/27/86/40/931278640.db2.gz MCWWJCKCZYKXGE-LLVKDONJSA-N 0 0 372.454 3.661 20 5 FHBDRN Cc1ccc(C(=O)NOCc2ccc(C(F)(F)F)cc2)cc1[N+](=O)[O-] ZINC000160676731 931297705 /nfs/dbraw/zinc/29/77/05/931297705.db2.gz NUVLSONAAUKOLB-UHFFFAOYSA-N 0 0 354.284 3.784 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])c(Cl)c1)N1CCCC[C@@H]([C@@H]2CCOC2)C1 ZINC000891338218 931304774 /nfs/dbraw/zinc/30/47/74/931304774.db2.gz YJEQGXZHEIFLMA-ZIAGYGMSSA-N 0 0 352.818 3.527 20 5 FHBDRN COCCOc1ccc(NC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000255237992 931307008 /nfs/dbraw/zinc/30/70/08/931307008.db2.gz FNHZPTHGKNVMLF-YHYXMXQVSA-N 0 0 356.378 3.580 20 5 FHBDRN C[C@@H](NC(=O)N[C@@H](C)c1ccc2n[nH]cc2c1)c1ccccc1[N+](=O)[O-] ZINC000580897974 931314223 /nfs/dbraw/zinc/31/42/23/931314223.db2.gz DUYZULCRFAWQFV-NWDGAFQWSA-N 0 0 353.382 3.593 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)c2ccc(N3CCCC3=O)cc2)cc1[N+](=O)[O-] ZINC000177859500 931330744 /nfs/dbraw/zinc/33/07/44/931330744.db2.gz YBCPHANNUWEANJ-CQSZACIVSA-N 0 0 367.405 3.521 20 5 FHBDRN CCc1cc(C)c(C(=O)Nc2cc(C)nn2-c2ccc([N+](=O)[O-])cc2)o1 ZINC000119352896 931365131 /nfs/dbraw/zinc/36/51/31/931365131.db2.gz YMGHYSJAPQWMFE-UHFFFAOYSA-N 0 0 354.366 3.805 20 5 FHBDRN CN1C(=O)c2cc(Br)ccc2N[C@@H]1c1cccc([N+](=O)[O-])c1 ZINC000135078635 931366901 /nfs/dbraw/zinc/36/69/01/931366901.db2.gz GMQPHSAZWWFCEU-AWEZNQCLSA-N 0 0 362.183 3.554 20 5 FHBDRN C[C@]1(c2ccccc2)CN(C(=O)c2ccc([N+](=O)[O-])cc2Cl)CCO1 ZINC000156695766 931377113 /nfs/dbraw/zinc/37/71/13/931377113.db2.gz KEBZILHVXHPKKA-GOSISDBHSA-N 0 0 360.797 3.636 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)c2ccccc2OC(F)F)cc1[N+](=O)[O-] ZINC000177866459 931390279 /nfs/dbraw/zinc/39/02/79/931390279.db2.gz XJBJMRZXDWABDR-LLVKDONJSA-N 0 0 350.321 3.996 20 5 FHBDRN COc1ccc2c(c1)ncc([N+](=O)[O-])c2N1CCC[C@H]1[C@@H]1CCCOC1 ZINC000580949722 931397151 /nfs/dbraw/zinc/39/71/51/931397151.db2.gz WUNWIZOSRPXQJI-DYVFJYSZSA-N 0 0 357.410 3.547 20 5 FHBDRN COc1ccc(OCCCC(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000177872659 931397292 /nfs/dbraw/zinc/39/72/92/931397292.db2.gz LHIFVUVPZIYVFH-OAHLLOKOSA-N 0 0 372.421 3.948 20 5 FHBDRN CCC[C@@H](O)CNC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000177875663 931430824 /nfs/dbraw/zinc/43/08/24/931430824.db2.gz MCRBUMIWBDIMRF-CQSZACIVSA-N 0 0 360.435 3.637 20 5 FHBDRN COC(=O)c1cc(C(C)C)ccc1NC(=O)Cc1cccc([N+](=O)[O-])c1C ZINC001125482382 931452999 /nfs/dbraw/zinc/45/29/99/931452999.db2.gz RZHBZFRYRQLQEN-UHFFFAOYSA-N 0 0 370.405 3.994 20 5 FHBDRN CC(C)NC(=O)c1ccc(N2CCC=C(c3ccco3)C2)c([N+](=O)[O-])c1 ZINC000581028767 931480789 /nfs/dbraw/zinc/48/07/89/931480789.db2.gz HOUPXRVGHDNDHQ-UHFFFAOYSA-N 0 0 355.394 3.620 20 5 FHBDRN Cc1c(Br)c(NC[C@@](C)(O)CCC(C)C)ncc1[N+](=O)[O-] ZINC000581038391 931513716 /nfs/dbraw/zinc/51/37/16/931513716.db2.gz HMDDDZFDNFMBAN-AWEZNQCLSA-N 0 0 360.252 3.660 20 5 FHBDRN Cc1cccc([C@@H]2CCCN2C(=O)CNc2ccccc2[N+](=O)[O-])c1C ZINC000610199359 931534103 /nfs/dbraw/zinc/53/41/03/931534103.db2.gz UJPMQNLSCJQUKO-SFHVURJKSA-N 0 0 353.422 3.987 20 5 FHBDRN C[C@@](CO)(NCc1ccc([N+](=O)[O-])cc1F)c1cccc(C(F)(F)F)c1 ZINC000610476370 931537973 /nfs/dbraw/zinc/53/79/73/931537973.db2.gz AZOUFKAQAHFOBP-INIZCTEOSA-N 0 0 372.318 3.750 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H](C)Oc3c(F)cccc32)c1 ZINC000187376596 931586101 /nfs/dbraw/zinc/58/61/01/931586101.db2.gz BXRJUNHXVSHMPS-SNVBAGLBSA-N 0 0 362.382 3.884 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CCCO[C@@H]2CC(C)C)c1 ZINC000187383416 931589265 /nfs/dbraw/zinc/58/92/65/931589265.db2.gz CZZKBWBGWMCQAP-GOEBONIOSA-N 0 0 352.456 3.640 20 5 FHBDRN C[C@H]1C[C@@H](c2ccccc2)N(C(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)C1 ZINC000581156091 931628236 /nfs/dbraw/zinc/62/82/36/931628236.db2.gz CLLMHBWFJKSGCL-GUYCJALGSA-N 0 0 368.389 3.589 20 5 FHBDRN C[C@@H]1C[C@H](c2ccccc2)N(C(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)C1 ZINC000581156089 931628290 /nfs/dbraw/zinc/62/82/90/931628290.db2.gz CLLMHBWFJKSGCL-CXAGYDPISA-N 0 0 368.389 3.589 20 5 FHBDRN O=C(Nc1nc(-c2cccc3ccccc32)cs1)c1c[nH]nc1[N+](=O)[O-] ZINC000581178914 931644869 /nfs/dbraw/zinc/64/48/69/931644869.db2.gz GHYFJXFYRKWRSW-UHFFFAOYSA-N 0 0 365.374 3.847 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N[C@H]1CCc2ccccc2OC1 ZINC000511644162 931678662 /nfs/dbraw/zinc/67/86/62/931678662.db2.gz NNAVEHSULQAWFA-AWEZNQCLSA-N 0 0 360.797 3.680 20 5 FHBDRN O=[N+]([O-])c1ccc(S(=O)(=O)Cc2nc(-c3ccccc3)cs2)cc1 ZINC000477031358 931711047 /nfs/dbraw/zinc/71/10/47/931711047.db2.gz FTRUAIZIGNVIIM-UHFFFAOYSA-N 0 0 360.416 3.692 20 5 FHBDRN Cc1ccc([C@H]2C[C@H](C)N(c3nc4ccc([N+](=O)[O-])cc4c(=O)[nH]3)C2)cc1 ZINC000561326326 931734983 /nfs/dbraw/zinc/73/49/83/931734983.db2.gz UFLYGPPQZJZSAN-ZFWWWQNUSA-N 0 0 364.405 3.934 20 5 FHBDRN CN(C[C@@H]1CCCO[C@H]1c1ccccc1)C(=O)c1ccc([N+](=O)[O-])cc1F ZINC000050861879 931738707 /nfs/dbraw/zinc/73/87/07/931738707.db2.gz WBBRPLSAPRKZRC-KXBFYZLASA-N 0 0 372.396 3.974 20 5 FHBDRN CCc1nc2cc(NC(=O)CCOc3ccccc3[N+](=O)[O-])ccc2o1 ZINC000060395760 931746487 /nfs/dbraw/zinc/74/64/87/931746487.db2.gz HWTLBSMVOXVAIA-UHFFFAOYSA-N 0 0 355.350 3.706 20 5 FHBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1Cn1cc(NC(=O)C(C)(C)C)cn1 ZINC000156971288 931752278 /nfs/dbraw/zinc/75/22/78/931752278.db2.gz ZYUKMSNSURJLNC-UHFFFAOYSA-N 0 0 360.414 3.611 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)N1CC[C@H](Cc2ccccc2)C1 ZINC000126350785 931756812 /nfs/dbraw/zinc/75/68/12/931756812.db2.gz PBCXKLFPXFVUMV-MRXNPFEDSA-N 0 0 356.447 3.778 20 5 FHBDRN CCc1noc(CC)c1CC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000087174091 931765202 /nfs/dbraw/zinc/76/52/02/931765202.db2.gz DCXQTTLTRVTBLP-UHFFFAOYSA-N 0 0 359.426 3.687 20 5 FHBDRN CCn1c(SCc2noc(C(C)C)n2)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000157058385 931813434 /nfs/dbraw/zinc/81/34/34/931813434.db2.gz QPOBXQBOLFTXMI-UHFFFAOYSA-N 0 0 374.426 3.672 20 5 FHBDRN CCCc1nc(COC(=O)CCOc2cccc([N+](=O)[O-])c2)cs1 ZINC000728326246 931824322 /nfs/dbraw/zinc/82/43/22/931824322.db2.gz VAXROUZEWOJBRB-UHFFFAOYSA-N 0 0 350.396 3.516 20 5 FHBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)NCC1(Cc2ccc(F)cc2)CC1 ZINC001266700431 931824986 /nfs/dbraw/zinc/82/49/86/931824986.db2.gz KPBFJQLQNKXTJG-YHYXMXQVSA-N 0 0 354.381 3.886 20 5 FHBDRN CC1(C)CC(NC(=O)[C@@H]2CC(c3ccccc3[N+](=O)[O-])=NO2)CC(C)(C)C1 ZINC001266700387 931825519 /nfs/dbraw/zinc/82/55/19/931825519.db2.gz JGOVCXFJBSHUPH-KRWDZBQOSA-N 0 0 373.453 3.809 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)Nc1ccccc1OC(F)(F)F ZINC000247327784 931833700 /nfs/dbraw/zinc/83/37/00/931833700.db2.gz NVNMDWYVBNTURH-UHFFFAOYSA-N 0 0 356.256 3.511 20 5 FHBDRN COc1cccc(N(CC(C)C)C(=O)Cc2ccc([N+](=O)[O-])cc2F)c1 ZINC000477070507 931849379 /nfs/dbraw/zinc/84/93/79/931849379.db2.gz AUZAFVKGTXEGJW-UHFFFAOYSA-N 0 0 360.385 3.974 20 5 FHBDRN CC(=O)c1ccc(NCc2nc(-c3cccc([N+](=O)[O-])c3)no2)cc1C ZINC000135098901 931924944 /nfs/dbraw/zinc/92/49/44/931924944.db2.gz YYOASFJTVOAPGA-UHFFFAOYSA-N 0 0 352.350 3.768 20 5 FHBDRN Cc1cccc([C@H]2CCCN2S(=O)(=O)c2ccccc2[N+](=O)[O-])c1C ZINC000610266188 931939273 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367.361 3.745 20 5 FHBDRN COC(=O)CC1(CSc2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000234609262 932833735 /nfs/dbraw/zinc/83/37/35/932833735.db2.gz ZWNCEHMFFOLDQP-UHFFFAOYSA-N 0 0 360.229 3.793 20 5 FHBDRN Cc1nc(C2(NCCOc3ccccc3[N+](=O)[O-])CCCCCC2)no1 ZINC000101546053 932865711 /nfs/dbraw/zinc/86/57/11/932865711.db2.gz DTLJPNZDEDMICB-UHFFFAOYSA-N 0 0 360.414 3.504 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N[C@@H](C)CC(=O)c1ccco1 ZINC000276670271 932881144 /nfs/dbraw/zinc/88/11/44/932881144.db2.gz ZANWHAWGCATUSM-JTQLQIEISA-N 0 0 350.758 3.541 20 5 FHBDRN CC(C)c1[nH]nc(C(=O)Nc2cc(-c3cccc(Cl)c3)[nH]n2)c1[N+](=O)[O-] ZINC000610924499 932949000 /nfs/dbraw/zinc/94/90/00/932949000.db2.gz VROPBXNIKBHIBI-UHFFFAOYSA-N 0 0 374.788 3.737 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)NCc1nc2cc(Cl)ccc2n1C ZINC000548324402 932979644 /nfs/dbraw/zinc/97/96/44/932979644.db2.gz AGESFRYGGXZHFK-UHFFFAOYSA-N 0 0 373.800 3.765 20 5 FHBDRN CC(C)c1ccc(C(=O)Nc2ccc(-n3ccnn3)cc2)cc1[N+](=O)[O-] ZINC000187571674 933005735 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3.529 20 5 FHBDRN COCCCOc1cccc(NC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)c1 ZINC000430744258 933195813 /nfs/dbraw/zinc/19/58/13/933195813.db2.gz RKSDHTBMLXPHOM-UHFFFAOYSA-N 0 0 369.377 3.744 20 5 FHBDRN C[C@H]1CCCC[C@@H]1CCNC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000510542811 933206608 /nfs/dbraw/zinc/20/66/08/933206608.db2.gz CEOOARAZGYKEMU-LSDHHAIUSA-N 0 0 356.426 3.727 20 5 FHBDRN COc1ccc2c(c1)CCCCN2C(=O)COc1ccc([N+](=O)[O-])c(C)c1 ZINC000430801208 933237777 /nfs/dbraw/zinc/23/77/77/933237777.db2.gz YDEZBOXVDQRHTM-UHFFFAOYSA-N 0 0 370.405 3.660 20 5 FHBDRN COc1cc(NC[C@](C)(Cc2ccccc2)[C@H](C)O)c([N+](=O)[O-])cc1F ZINC000477719879 933238918 /nfs/dbraw/zinc/23/89/18/933238918.db2.gz QKJWRGJDPKMRSS-DJJJIMSYSA-N 0 0 362.401 3.784 20 5 FHBDRN Cc1cc(OCC(=O)Nc2ccc(-c3ccc[nH]3)cc2)ccc1[N+](=O)[O-] ZINC000430802673 933248477 /nfs/dbraw/zinc/24/84/77/933248477.db2.gz OAFIGTLIEXXJIE-UHFFFAOYSA-N 0 0 351.362 3.916 20 5 FHBDRN C[C@H](NC(=O)Nc1cc2c(cc1F)CCC(=O)N2)c1cccc([N+](=O)[O-])c1 ZINC000510603653 933264206 /nfs/dbraw/zinc/26/42/06/933264206.db2.gz ZFZIDLOMGWYLKS-JTQLQIEISA-N 0 0 372.356 3.501 20 5 FHBDRN Cc1oc2ccccc2c1CCNC(=O)COc1ccc([N+](=O)[O-])c(C)c1 ZINC000430822425 933264467 /nfs/dbraw/zinc/26/44/67/933264467.db2.gz QHGSCRNPOVGOPL-UHFFFAOYSA-N 0 0 368.389 3.696 20 5 FHBDRN Cc1cccc(C2=CCN(C(=O)COc3ccc([N+](=O)[O-])c(C)c3)CC2)c1 ZINC000430824568 933270413 /nfs/dbraw/zinc/27/04/13/933270413.db2.gz QGSAXNXUPYQVOK-UHFFFAOYSA-N 0 0 366.417 3.906 20 5 FHBDRN CCN(CCO)C(=O)c1ccc(Sc2ccc(C)cc2)c([N+](=O)[O-])c1 ZINC000098075356 933301229 /nfs/dbraw/zinc/30/12/29/933301229.db2.gz XPUBAJXEKDMGGK-UHFFFAOYSA-N 0 0 360.435 3.509 20 5 FHBDRN O=[N+]([O-])c1cc(F)c(CN(Cc2ccccc2)CC2(CO)CC2)c(F)c1 ZINC000510623753 933313010 /nfs/dbraw/zinc/31/30/10/933313010.db2.gz BWUAAYKWDGAUCA-UHFFFAOYSA-N 0 0 362.376 3.648 20 5 FHBDRN O=[N+]([O-])c1ccc2oc(CN3CCCO[C@@H](c4ccccc4)C3)nc2c1 ZINC000610581954 933325134 /nfs/dbraw/zinc/32/51/34/933325134.db2.gz YVQOMZABYQMGRE-GOSISDBHSA-N 0 0 353.378 3.700 20 5 FHBDRN CCN(CC(C)(C)O)c1ccc(C(=O)Nc2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000510638393 933340599 /nfs/dbraw/zinc/34/05/99/933340599.db2.gz MNUGCFBPALKNGL-UHFFFAOYSA-N 0 0 371.437 3.753 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(N2C[C@@H](C(F)(F)F)[C@H](C(F)(F)F)C2)c1 ZINC000610587577 933438250 /nfs/dbraw/zinc/43/82/50/933438250.db2.gz JLNUYFOPVPKHOO-RKDXNWHRSA-N 0 0 358.238 3.780 20 5 FHBDRN Cc1ccc2c(ccnc2NCc2cc(Br)no2)c1[N+](=O)[O-] ZINC001167493155 933444104 /nfs/dbraw/zinc/44/41/04/933444104.db2.gz VQNVXYJPLZTXSJ-UHFFFAOYSA-N 0 0 363.171 3.814 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)NC[C@H]2OCCc3ccccc32)cc1[N+](=O)[O-] ZINC000610597068 933482427 /nfs/dbraw/zinc/48/24/27/933482427.db2.gz VAHVOZPZLSYVEN-IFXJQAMLSA-N 0 0 369.421 3.577 20 5 FHBDRN COc1ccc(CCNC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)cc1F ZINC000728388918 933486364 /nfs/dbraw/zinc/48/63/64/933486364.db2.gz YZMFNYXYXSXWTB-UHFFFAOYSA-N 0 0 367.764 3.760 20 5 FHBDRN O=[N+]([O-])c1ccccc1OCCN1C[C@H](C(F)(F)F)[C@@H](C(F)(F)F)C1 ZINC000610604701 933513175 /nfs/dbraw/zinc/51/31/75/933513175.db2.gz HCKDWJOMUINFPV-UWVGGRQHSA-N 0 0 372.265 3.646 20 5 FHBDRN COc1ccc(CN2C[C@@H](C(F)(F)F)[C@H](C(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000610604865 933514176 /nfs/dbraw/zinc/51/41/76/933514176.db2.gz QDJWXOUKJZUCMU-NXEZZACHSA-N 0 0 372.265 3.776 20 5 FHBDRN O=[N+]([O-])c1ccc(OCCN2C[C@H](C(F)(F)F)[C@@H](C(F)(F)F)C2)cc1 ZINC000610604772 933514594 /nfs/dbraw/zinc/51/45/94/933514594.db2.gz LELSYDIMOQEQOW-RYUDHWBXSA-N 0 0 372.265 3.646 20 5 FHBDRN C[C@H](OC(=O)Cc1ccccc1[N+](=O)[O-])c1nc2ccc(Cl)cc2n1C ZINC000176018538 933517736 /nfs/dbraw/zinc/51/77/36/933517736.db2.gz OPOWJPMLNKJSRD-NSHDSACASA-N 0 0 373.796 3.982 20 5 FHBDRN Cc1c(NC(=O)NCc2c(F)cc(F)c(F)c2F)cccc1[N+](=O)[O-] ZINC000430971588 933530462 /nfs/dbraw/zinc/53/04/62/933530462.db2.gz LSUPMBKTDWTWPF-UHFFFAOYSA-N 0 0 357.263 3.781 20 5 FHBDRN CC[C@@H](OC1CCCCC1)C(=O)Nc1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000471895815 933543141 /nfs/dbraw/zinc/54/31/41/933543141.db2.gz AMMWGCIZEGJCEC-QGZVFWFLSA-N 0 0 357.410 3.631 20 5 FHBDRN O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])N1C[C@@H]2CCCC[C@@H]2C1 ZINC000178367576 933577434 /nfs/dbraw/zinc/57/74/34/933577434.db2.gz OTGTXWJDRBGIDH-BETUJISGSA-N 0 0 352.818 3.666 20 5 FHBDRN Cc1cc(C)cc([C@H]2CCN(C(=O)NCCc3ccccc3[N+](=O)[O-])C2)c1 ZINC000548423151 933595218 /nfs/dbraw/zinc/59/52/18/933595218.db2.gz POYVEKZXRPMMMZ-SFHVURJKSA-N 0 0 367.449 3.953 20 5 FHBDRN O=C(COC(=O)c1cc(Cl)ccc1[N+](=O)[O-])c1cccc(Cl)c1 ZINC000003485334 933595571 /nfs/dbraw/zinc/59/55/71/933595571.db2.gz SPLJADPUUBFFPI-UHFFFAOYSA-N 0 0 354.145 3.941 20 5 FHBDRN Cn1ccc(CNc2cc([N+](=O)[O-])ccc2Nc2ccccc2)cc1=O ZINC000610647892 933596803 /nfs/dbraw/zinc/59/68/03/933596803.db2.gz JNMHZKJDIJPIED-UHFFFAOYSA-N 0 0 350.378 3.649 20 5 FHBDRN CC(C)CCSc1ccc(C(=O)N2CCO[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000510738133 933623969 /nfs/dbraw/zinc/62/39/69/933623969.db2.gz ZPDWJMCTGNMXAJ-ZDUSSCGKSA-N 0 0 352.456 3.594 20 5 FHBDRN Cc1nn(C)c(C(=O)Nc2ccc(Oc3ccc(C)cc3)cc2)c1[N+](=O)[O-] ZINC000098094596 933638084 /nfs/dbraw/zinc/63/80/84/933638084.db2.gz MXHVFJHZHWNCKM-UHFFFAOYSA-N 0 0 366.377 3.990 20 5 FHBDRN Cc1nn(C)c(C(=O)N[C@H](CC(C)(C)C)c2ccc(F)cc2)c1[N+](=O)[O-] ZINC000098099100 933639497 /nfs/dbraw/zinc/63/94/97/933639497.db2.gz SQVMLHVXMHBTRQ-CQSZACIVSA-N 0 0 362.405 3.683 20 5 FHBDRN CCOc1ccc([C@@H](C)NC(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)cc1 ZINC000121603896 933650896 /nfs/dbraw/zinc/65/08/96/933650896.db2.gz WZTVXKKZAKWECN-CQSZACIVSA-N 0 0 369.421 3.822 20 5 FHBDRN Cc1nn(C)c(C(=O)N2CCCCC[C@@H]2/C=C\c2ccccc2)c1[N+](=O)[O-] ZINC000610655082 933653555 /nfs/dbraw/zinc/65/35/55/933653555.db2.gz QRKWRSNFCDMQEI-MUSGIIIZSA-N 0 0 368.437 3.735 20 5 FHBDRN CCC1(CC)CCCN(S(=O)(=O)Cc2cccc([N+](=O)[O-])c2)CC1 ZINC001211525780 933671558 /nfs/dbraw/zinc/67/15/58/933671558.db2.gz DRRZLUKLDKJPGK-UHFFFAOYSA-N 0 0 354.472 3.717 20 5 FHBDRN COc1cc(C(=O)Nc2nc3cc(C)cc(C)c3o2)c([N+](=O)[O-])cc1OC ZINC000610661892 933687372 /nfs/dbraw/zinc/68/73/72/933687372.db2.gz GZPSHLLOGQSQSB-UHFFFAOYSA-N 0 0 371.349 3.622 20 5 FHBDRN CC[C@H](NC(=O)COc1ccccc1[N+](=O)[O-])c1ccc(Cl)s1 ZINC000510769221 933689315 /nfs/dbraw/zinc/68/93/15/933689315.db2.gz XXKZWYHFSNWKIP-JTQLQIEISA-N 0 0 354.815 3.956 20 5 FHBDRN O=C(NC[C@H]1CCO[C@@H]1c1ccccc1)c1c[nH]c2ccc([N+](=O)[O-])cc21 ZINC000431045609 933729357 /nfs/dbraw/zinc/72/93/57/933729357.db2.gz QZMIBMWLWHIILP-AUUYWEPGSA-N 0 0 365.389 3.584 20 5 FHBDRN COc1cc(C(=O)NCCc2cccc3ccccc32)ccc1[N+](=O)[O-] ZINC000510795956 933752734 /nfs/dbraw/zinc/75/27/34/933752734.db2.gz HIQACVPLOOXYQG-UHFFFAOYSA-N 0 0 350.374 3.729 20 5 FHBDRN O=C(Nc1cccc(COCC2CC2)c1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000065080090 933766648 /nfs/dbraw/zinc/76/66/48/933766648.db2.gz URPFHOGCTMUGNX-UHFFFAOYSA-N 0 0 371.349 3.682 20 5 FHBDRN COc1ccc(CCCCC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])cc1 ZINC000098100270 933798931 /nfs/dbraw/zinc/79/89/31/933798931.db2.gz CBSMJTZFKAXPLZ-UHFFFAOYSA-N 0 0 358.394 3.964 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])N1CC[C@@H](C(F)(F)F)C2(CCC2)C1 ZINC000510830678 933823114 /nfs/dbraw/zinc/82/31/14/933823114.db2.gz AJCJWXKCKRQMDS-CQSZACIVSA-N 0 0 371.359 3.859 20 5 FHBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NC[C@H]1CCC(F)(F)C1 ZINC000431115438 933846810 /nfs/dbraw/zinc/84/68/10/933846810.db2.gz RMAOOSROHBFFRV-UWVGGRQHSA-N 0 0 362.760 3.567 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)N[C@@H]1COc2c1cccc2Cl ZINC000610709649 933871832 /nfs/dbraw/zinc/87/18/32/933871832.db2.gz ICQYXODXBQNBIJ-CQSZACIVSA-N 0 0 364.810 3.590 20 5 FHBDRN CC1(C)CN(C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)c2ccccc21 ZINC000610708996 933875925 /nfs/dbraw/zinc/87/59/25/933875925.db2.gz HQPHKPHDZWJUQB-UHFFFAOYSA-N 0 0 362.389 3.719 20 5 FHBDRN CC1(C)CN(C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)c2ccccc21 ZINC000610708976 933875954 /nfs/dbraw/zinc/87/59/54/933875954.db2.gz FWGXKFRUUGMMIW-UHFFFAOYSA-N 0 0 362.389 3.719 20 5 FHBDRN O=C1CCc2cc([N+](=O)[O-])c(N[C@@H]3COc4c3cccc4Cl)cc2N1 ZINC000610709855 933881296 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CCOc1cc(CN2CCSC[C@H]2c2nccs2)ccc1[N+](=O)[O-] ZINC000276931387 934038529 /nfs/dbraw/zinc/03/85/29/934038529.db2.gz QYVZKEIYPUKVJI-AWEZNQCLSA-N 0 0 365.480 3.740 20 5 FHBDRN COc1ccc(NC(=O)CCSC[C@@H]2C[C@H]3C[C@H]3C2)c([N+](=O)[O-])c1 ZINC000600581576 934045412 /nfs/dbraw/zinc/04/54/12/934045412.db2.gz UFWFIIYQDUSRMM-CLLJXQQHSA-N 0 0 350.440 3.711 20 5 FHBDRN CCc1nc(CCNC(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cs1 ZINC000176090008 934051918 /nfs/dbraw/zinc/05/19/18/934051918.db2.gz RVOPJCUWHZOQEZ-GFCCVEGCSA-N 0 0 362.455 3.525 20 5 FHBDRN O=C(c1c[nH]c2cc([N+](=O)[O-])ccc12)N1CCc2ccc(Cl)cc2C1 ZINC000535664828 934059272 /nfs/dbraw/zinc/05/92/72/934059272.db2.gz CPKJLRYJESHKKX-UHFFFAOYSA-N 0 0 355.781 3.928 20 5 FHBDRN Cc1nc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)sc1C ZINC000024042449 934070961 /nfs/dbraw/zinc/07/09/61/934070961.db2.gz SZXOZAZYCBZIPL-UHFFFAOYSA-N 0 0 360.439 3.911 20 5 FHBDRN CC[C@H]1c2ccsc2CCN1C(=O)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000067812623 934078104 /nfs/dbraw/zinc/07/81/04/934078104.db2.gz ITCLPEIGMIFPQB-AWEZNQCLSA-N 0 0 360.435 3.743 20 5 FHBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CCC[C@H](C)[C@@H]1C ZINC000581991734 934081988 /nfs/dbraw/zinc/08/19/88/934081988.db2.gz ZRVUWXQPZASGSW-ONGXEEELSA-N 0 0 355.232 3.926 20 5 FHBDRN Cc1nc(N2CCc3c(F)cc(Br)cc3C2)ccc1[N+](=O)[O-] ZINC000610755431 934096142 /nfs/dbraw/zinc/09/61/42/934096142.db2.gz DYPLANRILYTZHY-UHFFFAOYSA-N 0 0 366.190 3.763 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)c1cccc2c3c([nH]c21)CCCC3 ZINC000065123972 934112327 /nfs/dbraw/zinc/11/23/27/934112327.db2.gz XYZFNGBEBSOMLK-UHFFFAOYSA-N 0 0 363.417 3.927 20 5 FHBDRN CC(C)(C)OC(=O)C[C@@H]1CCCN(Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000610763308 934122202 /nfs/dbraw/zinc/12/22/02/934122202.db2.gz DOKYNAJNVWSSKE-ZDUSSCGKSA-N 0 0 352.406 3.678 20 5 FHBDRN CC(C)(C)c1ccccc1NC(=O)COC(=O)c1ccccc1[N+](=O)[O-] ZINC000003502329 934145646 /nfs/dbraw/zinc/14/56/46/934145646.db2.gz NWVGSJMGDMTVSX-UHFFFAOYSA-N 0 0 356.378 3.688 20 5 FHBDRN CC[C@@H](C)c1nnc([C@@H](C)NC(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)[nH]1 ZINC000276966627 934155582 /nfs/dbraw/zinc/15/55/82/934155582.db2.gz PVIIIAZJLBGZIK-BXKDBHETSA-N 0 0 360.418 3.726 20 5 FHBDRN O=C1CCc2cc([N+](=O)[O-])c(NC[C@@H]3CCO[C@H]3c3ccccc3)cc2N1 ZINC000276971842 934175130 /nfs/dbraw/zinc/17/51/30/934175130.db2.gz DQIHXLRCGVYQNT-YWZLYKJASA-N 0 0 367.405 3.669 20 5 FHBDRN O=[N+]([O-])c1cnc2ccc(Br)cc2c1N[C@H]1CCC(F)(F)C1 ZINC000610786032 934188209 /nfs/dbraw/zinc/18/82/09/934188209.db2.gz QERAPJDEWCCAFN-VIFPVBQESA-N 0 0 372.169 3.927 20 5 FHBDRN COc1ccc(CC(=O)N2CCc3ccccc3[C@H]2C(C)C)cc1[N+](=O)[O-] ZINC000610790870 934206408 /nfs/dbraw/zinc/20/64/08/934206408.db2.gz KGMNWDVJCXZVAQ-OAQYLSRUSA-N 0 0 368.433 3.928 20 5 FHBDRN COc1ccccc1C1(CNC(=O)c2ccc([N+](=O)[O-])cc2F)CCCC1 ZINC000065140272 934219265 /nfs/dbraw/zinc/21/92/65/934219265.db2.gz XWJYQPOPAVTNHL-UHFFFAOYSA-N 0 0 372.396 3.984 20 5 FHBDRN Cc1sc(S(=O)(=O)N2C[C@@H](C)C[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000510967587 934238575 /nfs/dbraw/zinc/23/85/75/934238575.db2.gz KTWBWGXEWWFNGA-NHYWBVRUSA-N 0 0 366.464 3.737 20 5 FHBDRN COc1cccc(C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2C)c1 ZINC000431253569 934251612 /nfs/dbraw/zinc/25/16/12/934251612.db2.gz CKDGMLURGXGVDX-UHFFFAOYSA-N 0 0 365.183 3.927 20 5 FHBDRN CCC(CC)c1cc(CNC(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)on1 ZINC000535694412 934271982 /nfs/dbraw/zinc/27/19/82/934271982.db2.gz BPJQPRXFGYVPID-UHFFFAOYSA-N 0 0 356.382 3.898 20 5 FHBDRN CN(CCCCNC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12)c1ccccc1 ZINC000535682444 934273835 /nfs/dbraw/zinc/27/38/35/934273835.db2.gz ZLAXXPAPBDREGO-UHFFFAOYSA-N 0 0 366.421 3.723 20 5 FHBDRN CCc1nnc([C@H](C)NCc2ccc(-c3ccccc3[N+](=O)[O-])s2)[nH]1 ZINC000535685117 934278667 /nfs/dbraw/zinc/27/86/67/934278667.db2.gz CYLZEYPQEZXWCX-NSHDSACASA-N 0 0 357.439 3.855 20 5 FHBDRN CC[C@H](NC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12)c1ccc(OC)cc1 ZINC000535695574 934287904 /nfs/dbraw/zinc/28/79/04/934287904.db2.gz FBKVKQWENQEYGT-HNNXBMFYSA-N 0 0 353.378 3.966 20 5 FHBDRN CC(C)N(CC(=O)N[C@@H](C)c1cccs1)Cc1ccc([N+](=O)[O-])cc1 ZINC000098135173 934293987 /nfs/dbraw/zinc/29/39/87/934293987.db2.gz CGZCIJUOLPNYJN-AWEZNQCLSA-N 0 0 361.467 3.744 20 5 FHBDRN C[C@H]1CN(C(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)[C@H](c2ccccc2)CO1 ZINC000535705670 934302579 /nfs/dbraw/zinc/30/25/79/934302579.db2.gz XQXALSFSDWXBGD-UGSOOPFHSA-N 0 0 365.389 3.678 20 5 FHBDRN COCCCOc1cccc(CNc2ncc([N+](=O)[O-])cc2Cl)c1 ZINC000127421701 934314753 /nfs/dbraw/zinc/31/47/53/934314753.db2.gz OILFTIDUZWHGSM-UHFFFAOYSA-N 0 0 351.790 3.671 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1C[C@@H](C)C[C@@H]1c1ccccc1 ZINC000510985665 934420855 /nfs/dbraw/zinc/42/08/55/934420855.db2.gz QRNJQLCGTMPQMP-SUMWQHHRSA-N 0 0 360.435 3.675 20 5 FHBDRN CSCC[C@H]([NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C(=O)[O-] ZINC000277004427 934431046 /nfs/dbraw/zinc/43/10/46/934431046.db2.gz LVKLNTZOXYMINK-ZDUSSCGKSA-N 0 0 366.464 3.619 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NS(=O)(=O)/C=C\c1ccc(F)cc1 ZINC000588471277 934443927 /nfs/dbraw/zinc/44/39/27/934443927.db2.gz LQGVKGJVNWTTST-FPLPWBNLSA-N 0 0 350.371 3.763 20 5 FHBDRN CCOC(=O)/C=C\c1ccc(NCc2cc(OC)c(F)cc2[N+](=O)[O-])cc1 ZINC000588471294 934445642 /nfs/dbraw/zinc/44/56/42/934445642.db2.gz DSJRJELXVBSDKS-TWGQIWQCSA-N 0 0 374.368 3.931 20 5 FHBDRN CCOc1cc(CSCc2nc([C@@H](C)OC)no2)ccc1[N+](=O)[O-] ZINC000277069680 934475341 /nfs/dbraw/zinc/47/53/41/934475341.db2.gz NKTDPUATAMVJNM-SNVBAGLBSA-N 0 0 353.400 3.517 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H](C)[C@H](C)C1CCCCC1 ZINC000176158465 934481096 /nfs/dbraw/zinc/48/10/96/934481096.db2.gz DXHUIACPOFPVJN-KBPBESRZSA-N 0 0 361.442 3.563 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)N[C@@H]2CCOc3ccc(F)cc32)cc1[N+](=O)[O-] ZINC000176178756 934498760 /nfs/dbraw/zinc/49/87/60/934498760.db2.gz ADCKRWJJPHRVBN-MLGOLLRUSA-N 0 0 373.384 3.926 20 5 FHBDRN COC(=O)C(C)(C)[C@@H](NC(=O)c1ccc(C)c([N+](=O)[O-])c1)c1ccccc1 ZINC000610825183 934500208 /nfs/dbraw/zinc/50/02/08/934500208.db2.gz FGMONBTXFNWESW-KRWDZBQOSA-N 0 0 370.405 3.574 20 5 FHBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CC(c2nc3ccccc3[nH]2)C1 ZINC000610846801 934514970 /nfs/dbraw/zinc/51/49/70/934514970.db2.gz JCGSBCRWHRVZBU-UHFFFAOYSA-N 0 0 366.421 3.858 20 5 FHBDRN COc1cc(CSCc2cc(C)n(C)n2)c([N+](=O)[O-])cc1OC(F)F ZINC000610857585 934522260 /nfs/dbraw/zinc/52/22/60/934522260.db2.gz GVEGUBBLNVFQRO-UHFFFAOYSA-N 0 0 373.381 3.680 20 5 FHBDRN CN(C(=O)/C=C\c1ccc([N+](=O)[O-])cc1)C(C)(C)c1ccc2c(c1)OCO2 ZINC000255419352 934561252 /nfs/dbraw/zinc/56/12/52/934561252.db2.gz NAXPGLVSFVXNFN-WDZFZDKYSA-N 0 0 368.389 3.730 20 5 FHBDRN O=C(N[C@H]1CCOC2(CCCCC2)C1)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000610887967 934565514 /nfs/dbraw/zinc/56/55/14/934565514.db2.gz ZLYJPWDBAIXJGS-ZDUSSCGKSA-N 0 0 357.410 3.688 20 5 FHBDRN C[C@H](NC(=O)c1cc2cc([N+](=O)[O-])ccc2o1)[C@@H]1COc2ccccc21 ZINC000535860823 934606526 /nfs/dbraw/zinc/60/65/26/934606526.db2.gz OVSJBUCURGGWLB-NHYWBVRUSA-N 0 0 352.346 3.636 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CC(c3nc4ccccc4[nH]3)C2)cc1OC(F)F ZINC000610915181 934615913 /nfs/dbraw/zinc/61/59/13/934615913.db2.gz VTQFMXRSPRXYPT-UHFFFAOYSA-N 0 0 360.320 3.676 20 5 FHBDRN CCCN(Cc1ccc(OC)cc1)C(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-] ZINC000610917355 934624584 /nfs/dbraw/zinc/62/45/84/934624584.db2.gz HQRIPKHLEQRAHT-UHFFFAOYSA-N 0 0 360.414 3.502 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NS(=O)(=O)/C=C\c1cccc(Cl)c1 ZINC000588481581 934657408 /nfs/dbraw/zinc/65/74/08/934657408.db2.gz SJIOUWHNOMQDCY-FPLPWBNLSA-N 0 0 352.799 3.969 20 5 FHBDRN Cc1c(CC(=O)NCc2ccc(OC(C)(C)C)cc2)cccc1[N+](=O)[O-] ZINC000610968960 934664109 /nfs/dbraw/zinc/66/41/09/934664109.db2.gz CQKHQMCBFFGXSF-UHFFFAOYSA-N 0 0 356.422 3.939 20 5 FHBDRN C[C@H](c1ccc([S@@](C)=O)cc1)N(C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000176248447 934665056 /nfs/dbraw/zinc/66/50/56/934665056.db2.gz HRROJAMEWFXGLA-XELLLNAOSA-N 0 0 361.423 3.557 20 5 FHBDRN C[C@@H](c1ccc([S@@](C)=O)cc1)N(C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000176248434 934665127 /nfs/dbraw/zinc/66/51/27/934665127.db2.gz HRROJAMEWFXGLA-UOXLDJKESA-N 0 0 361.423 3.557 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)NCCc1cc2ccccc2o1 ZINC000135452424 934673620 /nfs/dbraw/zinc/67/36/20/934673620.db2.gz RXOIGRVMKQJBDZ-UHFFFAOYSA-N 0 0 363.373 3.724 20 5 FHBDRN O=C(c1c(Cl)cccc1[N+](=O)[O-])N1CCC(C2CCOCC2)CC1 ZINC000158075443 934713838 /nfs/dbraw/zinc/71/38/38/934713838.db2.gz BIWDEHDMYWEVAH-UHFFFAOYSA-N 0 0 352.818 3.527 20 5 FHBDRN O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CC[C@@H](O)[C@H](C2CCCC2)C1 ZINC000458334986 934718647 /nfs/dbraw/zinc/71/86/47/934718647.db2.gz KDKSSDNDMVCXHV-JKSUJKDBSA-N 0 0 374.462 3.823 20 5 FHBDRN C[C@@H]1CC(C)(C)CC[C@H]1NC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000176282359 934734980 /nfs/dbraw/zinc/73/49/80/934734980.db2.gz UEAWGMGAYIWNHQ-ZWNOBZJWSA-N 0 0 367.833 3.518 20 5 FHBDRN Cn1cc(-c2nc(CN(Cc3ccccc3[N+](=O)[O-])C3CC3)cs2)cn1 ZINC000610995110 934741726 /nfs/dbraw/zinc/74/17/26/934741726.db2.gz HTKVOFMKZOWEAC-UHFFFAOYSA-N 0 0 369.450 3.616 20 5 FHBDRN O=C(c1ccccc1)c1ccc(N2CCc3ncccc3C2)c([N+](=O)[O-])c1 ZINC000611006330 934742735 /nfs/dbraw/zinc/74/27/35/934742735.db2.gz FHRPUEFWPLAIJB-UHFFFAOYSA-N 0 0 359.385 3.784 20 5 FHBDRN CCC[C@H](NC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)C1CCCC1 ZINC000458351807 934751106 /nfs/dbraw/zinc/75/11/06/934751106.db2.gz YMOARCLTJZDATM-INIZCTEOSA-N 0 0 357.410 3.937 20 5 FHBDRN Cn1c(=O)c2cc3ccccc3cc2nc1SCCO[C@@H]1CC1(F)F ZINC000657236895 934799432 /nfs/dbraw/zinc/79/94/32/934799432.db2.gz NXJLKLHHLQHCKW-OAHLLOKOSA-N 0 0 362.401 3.603 20 5 FHBDRN Cc1nn(CN2CCC[C@@H]2c2cccc(C)n2)c2cc([N+](=O)[O-])ccc12 ZINC000121264405 934806719 /nfs/dbraw/zinc/80/67/19/934806719.db2.gz HHORTGSHCNBNGW-GOSISDBHSA-N 0 0 351.410 3.751 20 5 FHBDRN CCCN(Cc1ccccc1)S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000146457556 934808789 /nfs/dbraw/zinc/80/87/89/934808789.db2.gz IUUREYPQMZSEKC-UHFFFAOYSA-N 0 0 368.842 3.849 20 5 FHBDRN COC(=O)CC1(NC(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)CCCCC1 ZINC000538249892 934817670 /nfs/dbraw/zinc/81/76/70/934817670.db2.gz JDHFRLWFEJASBP-UHFFFAOYSA-N 0 0 363.414 3.599 20 5 FHBDRN CC(C)(C)c1ccc(C[NH2+][C@@H](Cc2ccc([N+](=O)[O-])cc2)C(=O)[O-])cc1 ZINC000277240634 934826798 /nfs/dbraw/zinc/82/67/98/934826798.db2.gz JFTIDQLSCNIBJD-SFHVURJKSA-N 0 0 356.422 3.678 20 5 FHBDRN C[C@@H](CCO)C1(CNC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CCC1 ZINC000538309829 934827231 /nfs/dbraw/zinc/82/72/31/934827231.db2.gz DHFOFZXYHLLJQE-LBPRGKRZSA-N 0 0 362.451 3.728 20 5 FHBDRN COc1ccc(NC(=O)c2c(C)cccc2Br)cc1[N+](=O)[O-] ZINC000320319293 934827507 /nfs/dbraw/zinc/82/75/07/934827507.db2.gz FHMZVWYFIIYYCI-UHFFFAOYSA-N 0 0 365.183 3.927 20 5 FHBDRN Cc1ccc(C(=O)NCCc2ccc(Br)cc2)cc1[N+](=O)[O-] ZINC000320339214 934830517 /nfs/dbraw/zinc/83/05/17/934830517.db2.gz JFGOKFBQYIRMKW-UHFFFAOYSA-N 0 0 363.211 3.638 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N2CC=C(c3c(F)cccc3F)CC2)c1 ZINC000472020464 934846911 /nfs/dbraw/zinc/84/69/11/934846911.db2.gz SNLCMHHQLBZGIE-UHFFFAOYSA-N 0 0 374.343 3.811 20 5 FHBDRN Cc1cc(Cl)c(S(=O)(=O)N(C)[C@@H](C)c2ccccc2)cc1[N+](=O)[O-] ZINC000176642159 934863287 /nfs/dbraw/zinc/86/32/87/934863287.db2.gz VLRMFYGHSFJHDC-LBPRGKRZSA-N 0 0 368.842 3.938 20 5 FHBDRN COc1cc(C(=O)N(C)c2ccc(OC(C)C)cc2)c([N+](=O)[O-])cc1OC ZINC000277280783 934865480 /nfs/dbraw/zinc/86/54/80/934865480.db2.gz SGYYDBRURRLEHY-UHFFFAOYSA-N 0 0 374.393 3.676 20 5 FHBDRN O=C(Nc1ccc2c(c1)CCO2)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000178496428 934883723 /nfs/dbraw/zinc/88/37/23/934883723.db2.gz ZVZPXJRINLCHSK-UHFFFAOYSA-N 0 0 352.268 3.801 20 5 FHBDRN Cc1cc(Br)ccc1Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000538656901 934887035 /nfs/dbraw/zinc/88/70/35/934887035.db2.gz LSONKTIBRZUZOH-UHFFFAOYSA-N 0 0 373.210 3.973 20 5 FHBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N1CCC[C@H]1C1CCCC1 ZINC000119578927 934895848 /nfs/dbraw/zinc/89/58/48/934895848.db2.gz DIMBAMQNEFPJRJ-ZDUSSCGKSA-N 0 0 358.847 3.592 20 5 FHBDRN Cn1ncc([N+](=O)[O-])c1C(=O)N[C@@H](c1ccc(Cl)cc1)C1CCCC1 ZINC000119596213 934907197 /nfs/dbraw/zinc/90/71/97/934907197.db2.gz QLTJMANWPHQFEE-OAHLLOKOSA-N 0 0 362.817 3.643 20 5 FHBDRN Cc1n[nH]c2cc(NC(=O)[C@@H](C)Oc3ccc(Cl)cc3[N+](=O)[O-])ccc12 ZINC000538806150 934913787 /nfs/dbraw/zinc/91/37/87/934913787.db2.gz KROLJLZMPFKPMM-SNVBAGLBSA-N 0 0 374.784 3.839 20 5 FHBDRN Cc1cnn(-c2ccccc2)c1NC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000084563514 934918599 /nfs/dbraw/zinc/91/85/99/934918599.db2.gz OWHOICRCPQPQOX-UHFFFAOYSA-N 0 0 356.769 3.995 20 5 FHBDRN COC(=O)c1c(C2CC2)csc1NC(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000084577032 934923642 /nfs/dbraw/zinc/92/36/42/934923642.db2.gz ZERVFQRWYDSUHA-UHFFFAOYSA-N 0 0 360.391 3.502 20 5 FHBDRN C[C@@H]1CCC[C@H](OC(=O)c2ccc(Cn3cc([N+](=O)[O-])cn3)cc2)[C@H]1C ZINC001267053596 934936354 /nfs/dbraw/zinc/93/63/54/934936354.db2.gz UEQHMWPJUQJUOQ-GLJUWKHASA-N 0 0 357.410 3.821 20 5 FHBDRN COc1ccc(CN2CCC[C@@H]2CC(=O)c2cccs2)cc1[N+](=O)[O-] ZINC000121719780 934941192 /nfs/dbraw/zinc/94/11/92/934941192.db2.gz SYBZMMQTIRJHJW-CQSZACIVSA-N 0 0 360.435 3.902 20 5 FHBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N1CCN(C)[C@@H](C)[C@@H]1C ZINC000538917600 934948585 /nfs/dbraw/zinc/94/85/85/934948585.db2.gz CLQFDYDAFMINAY-KBPBESRZSA-N 0 0 365.499 3.508 20 5 FHBDRN COc1cc(CNc2cc(C)c([N+](=O)[O-])cc2Br)ccn1 ZINC000234897898 934960924 /nfs/dbraw/zinc/96/09/24/934960924.db2.gz DVPFCVQPRYNMGB-UHFFFAOYSA-N 0 0 352.188 3.681 20 5 FHBDRN C[C@H]1C[C@H](C(=O)[O-])C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000263094346 935018604 /nfs/dbraw/zinc/01/86/04/935018604.db2.gz UYSGKDDNADUTRZ-JSGCOSHPSA-N 0 0 360.435 3.866 20 5 FHBDRN O=C(c1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCC[C@@H]([C@@H]2CCOC2)C1 ZINC000439907641 945070772 /nfs/dbraw/zinc/07/07/72/945070772.db2.gz FUSABGOKCVYOER-VXGBXAGGSA-N 0 0 372.343 3.502 20 5 FHBDRN CSc1cccc(C(=O)N2CCC[C@H](c3ccncc3)C2)c1[N+](=O)[O-] ZINC000563201958 935029318 /nfs/dbraw/zinc/02/93/18/935029318.db2.gz ZWGXWTIMQDSVMQ-AWEZNQCLSA-N 0 0 357.435 3.732 20 5 FHBDRN COC[C@]1(C)CCN(c2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])C1 ZINC000450604616 935032431 /nfs/dbraw/zinc/03/24/31/935032431.db2.gz LQXSMFATPGWPFR-HXUWFJFHSA-N 0 0 354.406 3.689 20 5 FHBDRN CC(C)(C(=O)N1CCC(c2ccncc2)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000277375237 935036147 /nfs/dbraw/zinc/03/61/47/935036147.db2.gz VSJQICMQOPLYBK-UHFFFAOYSA-N 0 0 371.412 3.813 20 5 FHBDRN O=[N+]([O-])c1cccc(N2CCN(Cc3coc(-c4ccccc4)n3)CC2)c1 ZINC000071952349 935075694 /nfs/dbraw/zinc/07/56/94/935075694.db2.gz OQBXNGDLEYSSPR-UHFFFAOYSA-N 0 0 364.405 3.572 20 5 FHBDRN CNc1ccc(C(=O)NCCOc2ccc(C(C)C)cc2)cc1[N+](=O)[O-] ZINC000071961157 935096380 /nfs/dbraw/zinc/09/63/80/935096380.db2.gz YNIJZYFMKMKNTB-UHFFFAOYSA-N 0 0 357.410 3.569 20 5 FHBDRN CCN(C(=O)c1cccc([N+](=O)[O-])c1C)c1ccc(Br)cn1 ZINC000119714986 935104493 /nfs/dbraw/zinc/10/44/93/935104493.db2.gz JWVQPUMYLFFOMG-UHFFFAOYSA-N 0 0 364.199 3.727 20 5 FHBDRN CC(=O)Nc1nc(CSc2nc3ccc([N+](=O)[O-])cc3s2)cs1 ZINC000024132428 935106844 /nfs/dbraw/zinc/10/68/44/935106844.db2.gz PVSRMHGICSRHJM-UHFFFAOYSA-N 0 0 366.449 3.912 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N(C)Cc1cccc(N(C)C)c1 ZINC000439896190 945077355 /nfs/dbraw/zinc/07/73/55/945077355.db2.gz GLILXLKPSGLNPB-UHFFFAOYSA-N 0 0 372.425 3.723 20 5 FHBDRN CC(=O)c1c(C)[nH]c(C(=O)Nc2ccc3cc([N+](=O)[O-])ccc3n2)c1C ZINC000084776210 935168297 /nfs/dbraw/zinc/16/82/97/935168297.db2.gz OWYMTPOHWCROIU-UHFFFAOYSA-N 0 0 352.350 3.543 20 5 FHBDRN COc1cccc([C@H]2C[C@H]2C(=O)Nc2ccc3cc([N+](=O)[O-])ccc3n2)c1 ZINC000084776550 935169663 /nfs/dbraw/zinc/16/96/63/935169663.db2.gz KVUMYIFSKIGYPG-IAGOWNOFSA-N 0 0 363.373 3.894 20 5 FHBDRN CC[C@@H](C)C(=O)O[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000023520618 945081112 /nfs/dbraw/zinc/08/11/12/945081112.db2.gz YHSHVZXIPIRQTA-BDAKNGLRSA-N 0 0 362.304 3.530 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2noc(CNc3ccccc3OC(F)F)n2)c1 ZINC000071981855 935172749 /nfs/dbraw/zinc/17/27/49/935172749.db2.gz DRZZRJCQGGCISC-UHFFFAOYSA-N 0 0 362.292 3.858 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H]1CCCc2c(O)cccc21 ZINC000439900360 945081548 /nfs/dbraw/zinc/08/15/48/945081548.db2.gz LIHAXKGSEVUWFI-HNNXBMFYSA-N 0 0 371.393 3.898 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)NCCCCn1ccnc1 ZINC000539354266 935184936 /nfs/dbraw/zinc/18/49/36/935184936.db2.gz NVUCRHTUWGNQAK-UHFFFAOYSA-N 0 0 362.455 3.502 20 5 FHBDRN Cn1cc(CCNC(=O)Nc2cccc([N+](=O)[O-])c2)c2ccc(F)cc21 ZINC000472145296 935185335 /nfs/dbraw/zinc/18/53/35/935185335.db2.gz FGTIGBYADHOZCR-UHFFFAOYSA-N 0 0 356.357 3.590 20 5 FHBDRN O=C([O-])c1ccc(C[NH2+][C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])cc1 ZINC000263408388 935199042 /nfs/dbraw/zinc/19/90/42/935199042.db2.gz KNUZCZKBQWZHHM-AEFFLSMTSA-N 0 0 354.406 3.794 20 5 FHBDRN Cc1c(CC(=O)NCc2ccc(-c3ccncc3)cc2)cccc1[N+](=O)[O-] ZINC000438826829 945083412 /nfs/dbraw/zinc/08/34/12/945083412.db2.gz PMCUSCTZGLGESB-UHFFFAOYSA-N 0 0 361.401 3.824 20 5 FHBDRN C[C@@H]1[C@H](c2ccccc2)CCN1c1nnc(-c2cccc([N+](=O)[O-])c2)n1C ZINC000562011562 935215396 /nfs/dbraw/zinc/21/53/96/935215396.db2.gz FWVVCRMRRCPLCV-RDTXWAMCSA-N 0 0 363.421 3.773 20 5 FHBDRN CCCN(C(=O)Cc1ccc([N+](=O)[O-])cc1)[C@@H]1CCc2ccccc2C1 ZINC000072024123 935217636 /nfs/dbraw/zinc/21/76/36/935217636.db2.gz FBUXROMZSVOHOI-HXUWFJFHSA-N 0 0 352.434 3.933 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H](C)c1nc(C)cs1 ZINC000439930084 945084874 /nfs/dbraw/zinc/08/48/74/945084874.db2.gz LPUGWFYSKYONAB-JTQLQIEISA-N 0 0 364.427 3.684 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H](C)c1ccc(OC)cc1 ZINC000439930077 945085193 /nfs/dbraw/zinc/08/51/93/945085193.db2.gz LOLSSNVWIGHXOF-GFCCVEGCSA-N 0 0 359.382 3.885 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)N2CCC[C@H](OC(F)F)C2)cc1[N+](=O)[O-] ZINC000611573710 935233062 /nfs/dbraw/zinc/23/30/62/935233062.db2.gz UCMXIATWOYXRPB-LBPRGKRZSA-N 0 0 356.369 3.736 20 5 FHBDRN CCCCOc1ncccc1CNC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000072038221 935239254 /nfs/dbraw/zinc/23/92/54/935239254.db2.gz QCTPDXAMZWWJKJ-UHFFFAOYSA-N 0 0 363.801 3.752 20 5 FHBDRN COC(=O)c1cc(NC(=O)c2cc(F)c3ccccc3c2)cc([N+](=O)[O-])c1 ZINC000551289684 935241433 /nfs/dbraw/zinc/24/14/33/935241433.db2.gz UHWVCQFQMRORQZ-UHFFFAOYSA-N 0 0 368.320 3.926 20 5 FHBDRN C[C@H](NC(=O)c1cccc(Cl)c1[N+](=O)[O-])c1nc2ccccc2n1C ZINC000176651424 935242438 /nfs/dbraw/zinc/24/24/38/935242438.db2.gz NGTUPIQEIPPHMG-JTQLQIEISA-N 0 0 358.785 3.626 20 5 FHBDRN Cc1c(Cc2nc(=O)c3c4c(sc3[nH]2)CSCC4)cccc1[N+](=O)[O-] ZINC000119806232 935248883 /nfs/dbraw/zinc/24/88/83/935248883.db2.gz IUXJQPYYVMZCBD-UHFFFAOYSA-N 0 0 373.459 3.581 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)CCSc1ccc(Cl)cn1 ZINC000119819166 935258964 /nfs/dbraw/zinc/25/89/64/935258964.db2.gz BGQXNOVCJKHWLK-UHFFFAOYSA-N 0 0 367.814 3.773 20 5 FHBDRN Cc1cc(OCC(=O)NCc2ccc(Cl)cc2)c(Cl)cc1[N+](=O)[O-] ZINC000506384497 945088448 /nfs/dbraw/zinc/08/84/48/945088448.db2.gz XDHNBZPGDGGHMR-UHFFFAOYSA-N 0 0 369.204 3.905 20 5 FHBDRN CC[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F)c1nccs1 ZINC000551342208 935261502 /nfs/dbraw/zinc/26/15/02/935261502.db2.gz KMZUEUWNDPVOJU-LLVKDONJSA-N 0 0 359.329 3.951 20 5 FHBDRN CCc1nc(C)c([C@@H](C)N(C)C(=O)COc2cccc([N+](=O)[O-])c2)s1 ZINC000119830040 935267788 /nfs/dbraw/zinc/26/77/88/935267788.db2.gz QWBWIBQXUZELPJ-GFCCVEGCSA-N 0 0 363.439 3.521 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)Nc1cc(N2CCCC2=O)ccc1Cl ZINC000072068788 935280137 /nfs/dbraw/zinc/28/01/37/935280137.db2.gz UTJJWQVBMKDJQO-UHFFFAOYSA-N 0 0 373.796 3.936 20 5 FHBDRN CC1(C)[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)[C@H]2CCCO[C@@H]21 ZINC000551455110 935281221 /nfs/dbraw/zinc/28/12/21/935281221.db2.gz SPRVFUHZMADJPF-HONMWMINSA-N 0 0 372.343 3.547 20 5 FHBDRN COc1ccc(C(=O)Nc2cc(-c3ccccc3C)[nH]n2)cc1[N+](=O)[O-] ZINC000051437981 935281529 /nfs/dbraw/zinc/28/15/29/935281529.db2.gz MLKKGOYDVRXHMM-UHFFFAOYSA-N 0 0 352.350 3.554 20 5 FHBDRN Cc1c(C(=O)NC[C@@H](O)c2cc3ccccc3s2)cccc1[N+](=O)[O-] ZINC000119854649 935294270 /nfs/dbraw/zinc/29/42/70/935294270.db2.gz JKMOXAKISNEGAP-OAHLLOKOSA-N 0 0 356.403 3.581 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])c1cc2c(cccc2OC(F)F)[nH]1 ZINC000119859938 935297149 /nfs/dbraw/zinc/29/71/49/935297149.db2.gz QLNTXADPVXKJOQ-UHFFFAOYSA-N 0 0 361.304 3.608 20 5 FHBDRN C[C@@H](C(=O)NCc1c(F)cc(F)cc1F)c1ccc([N+](=O)[O-])cc1F ZINC000511078184 935303229 /nfs/dbraw/zinc/30/32/29/935303229.db2.gz VNLNRACHUABXIX-MRVPVSSYSA-N 0 0 356.275 3.571 20 5 FHBDRN O=C(Nc1nc(C2CCC2)cs1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000519070311 945093462 /nfs/dbraw/zinc/09/34/62/945093462.db2.gz LSTOBRGUUQZPSY-UHFFFAOYSA-N 0 0 358.423 3.909 20 5 FHBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)N1CCC=C(c2ccccc2)C1 ZINC000551637258 935323261 /nfs/dbraw/zinc/32/32/61/935323261.db2.gz JAAWCGRNUADGON-UHFFFAOYSA-N 0 0 351.406 3.636 20 5 FHBDRN COc1ccc(C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)c(F)c1 ZINC000551667179 935326030 /nfs/dbraw/zinc/32/60/30/935326030.db2.gz BXIVDOIMGPVNAE-UHFFFAOYSA-N 0 0 369.146 3.757 20 5 FHBDRN CSc1ccc(C(=O)NC[C@@H]2CCCO[C@H]2C(C)(C)C)cc1[N+](=O)[O-] ZINC000118269298 935334873 /nfs/dbraw/zinc/33/48/73/935334873.db2.gz KVIGHIOXUPNVGP-XJKSGUPXSA-N 0 0 366.483 3.888 20 5 FHBDRN CN(C(=O)C[NH2+]C1(c2ccc(Cl)cc2)CCC1)c1ccc([N+](=O)[O-])cc1 ZINC000551748763 935341771 /nfs/dbraw/zinc/34/17/71/935341771.db2.gz YYHWZHPQAZPOKD-UHFFFAOYSA-N 0 0 373.840 3.880 20 5 FHBDRN CCOc1ccc([C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])cc2OC)cc1 ZINC000427109230 945094283 /nfs/dbraw/zinc/09/42/83/945094283.db2.gz QITKSBDBYHYBRP-SFHVURJKSA-N 0 0 370.405 3.979 20 5 FHBDRN Cn1c(C(=O)N(Cc2ccco2)c2ccc(F)cc2F)ccc1[N+](=O)[O-] ZINC000511086865 935355089 /nfs/dbraw/zinc/35/50/89/935355089.db2.gz UBLNRKUMTQFKIK-UHFFFAOYSA-N 0 0 361.304 3.652 20 5 FHBDRN Cc1ccc([C@@H]2CN(C(=O)Nc3cc([N+](=O)[O-])c(C)cc3C)CCO2)o1 ZINC000119945065 935357937 /nfs/dbraw/zinc/35/79/37/935357937.db2.gz IZCKDVMZNPWSFZ-KRWDZBQOSA-N 0 0 359.382 3.718 20 5 FHBDRN O=c1c2ccc([N+](=O)[O-])cc2ncn1CC1CCC(C(F)(F)F)CC1 ZINC000472189140 935360251 /nfs/dbraw/zinc/36/02/51/935360251.db2.gz NWILOXNWQYBSKT-UHFFFAOYSA-N 0 0 355.316 3.673 20 5 FHBDRN COC(=O)c1sc2cccc(F)c2c1COc1cccnc1[N+](=O)[O-] ZINC000119955839 935360779 /nfs/dbraw/zinc/36/07/79/935360779.db2.gz NEIWZLPZHXDJGI-UHFFFAOYSA-N 0 0 362.338 3.709 20 5 FHBDRN CCCC(=O)Nc1ccc(Cl)c(NC(=O)c2cc([N+](=O)[O-])cn2C)c1 ZINC000551909786 935372192 /nfs/dbraw/zinc/37/21/92/935372192.db2.gz VXPDBXRRGMLHAB-UHFFFAOYSA-N 0 0 364.789 3.578 20 5 FHBDRN Cc1cc(S(=O)(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)sc1C ZINC000540213800 935384745 /nfs/dbraw/zinc/38/47/45/935384745.db2.gz RHZDSXJSPWUSLU-NSHDSACASA-N 0 0 354.453 3.621 20 5 FHBDRN Cc1cc(N(Cc2ccccc2[N+](=O)[O-])C2CC2)nc(-c2ccncc2)n1 ZINC000119981157 935386622 /nfs/dbraw/zinc/38/66/22/935386622.db2.gz OYCCVGUWBACYNP-UHFFFAOYSA-N 0 0 361.405 3.924 20 5 FHBDRN CCc1coc(NC(=O)c2ccc(N3CCC[C@H](C)C3)c([N+](=O)[O-])c2)n1 ZINC000551957540 935391183 /nfs/dbraw/zinc/39/11/83/935391183.db2.gz KYXQQUJDRMVLLE-LBPRGKRZSA-N 0 0 358.398 3.634 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(NCc2ccc(COC3CCOCC3)cc2)n1 ZINC000178552116 935398809 /nfs/dbraw/zinc/39/88/09/935398809.db2.gz GGPQFEOOCIAKIJ-UHFFFAOYSA-N 0 0 357.410 3.606 20 5 FHBDRN Cc1cccc(Cl)c1NC(=O)Cc1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000085296815 935417481 /nfs/dbraw/zinc/41/74/81/935417481.db2.gz BMHISOKQLDGJEF-UHFFFAOYSA-N 0 0 362.769 3.509 20 5 FHBDRN COc1ccccc1CN(Cc1cccs1)C(=O)c1cc([N+](=O)[O-])c[nH]1 ZINC000051530418 935431211 /nfs/dbraw/zinc/43/12/11/935431211.db2.gz OMJAXBRHDPUAIS-UHFFFAOYSA-N 0 0 371.418 3.836 20 5 FHBDRN C[C@@H](c1nc(-c2cccs2)no1)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000511093606 935440522 /nfs/dbraw/zinc/44/05/22/935440522.db2.gz DELSKCPQRREPCW-LBPRGKRZSA-N 0 0 358.423 3.942 20 5 FHBDRN Cc1cc(C)n(-c2ccccc2CNC(=O)c2cc(C)cc([N+](=O)[O-])c2)n1 ZINC000472205670 935469809 /nfs/dbraw/zinc/46/98/09/935469809.db2.gz LEQLLJNYVAILNH-UHFFFAOYSA-N 0 0 364.405 3.636 20 5 FHBDRN O=C1NCC[C@@H]1CCSc1nc2ccccc2c2nc3ccccc3n21 ZINC000582279680 935475464 /nfs/dbraw/zinc/47/54/64/935475464.db2.gz XZTFCYPQKNEWOW-CYBMUJFWSA-N 0 0 362.458 3.654 20 5 FHBDRN Cc1c(NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])cnn1-c1ccccc1 ZINC000120044719 935493587 /nfs/dbraw/zinc/49/35/87/935493587.db2.gz IDZKJZHCWYJPLF-UHFFFAOYSA-N 0 0 356.769 3.995 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@H](OC(F)F)C1 ZINC000611586471 935507042 /nfs/dbraw/zinc/50/70/42/935507042.db2.gz OHQOXFPQTYDMIJ-LBPRGKRZSA-N 0 0 374.409 3.941 20 5 FHBDRN CC(C)(C)[C@@H](NC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F)C(F)(F)F ZINC000582323907 935522158 /nfs/dbraw/zinc/52/21/58/935522158.db2.gz WELGMAINTCPCEL-GFCCVEGCSA-N 0 0 354.275 3.509 20 5 FHBDRN CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)[C@H]1CCOc2ccccc21 ZINC000263992199 935525878 /nfs/dbraw/zinc/52/58/78/935525878.db2.gz OBIAVZBLJRFMLX-HNNXBMFYSA-N 0 0 360.797 3.773 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)N[C@H](C)Cc2cccs2)cc1SC ZINC000264002718 935526913 /nfs/dbraw/zinc/52/69/13/935526913.db2.gz LIWDKJNDJWUYJN-SNVBAGLBSA-N 0 0 366.464 3.748 20 5 FHBDRN Cc1cc(C)n(-c2ccccc2CNC(=O)c2ccc([N+](=O)[O-])c(C)c2)n1 ZINC000472216950 935531207 /nfs/dbraw/zinc/53/12/07/935531207.db2.gz MLMOZDVCFIXIRT-UHFFFAOYSA-N 0 0 364.405 3.636 20 5 FHBDRN Cc1cccc(C(=O)N[C@H](C)c2cccc(N3CCCC3)c2)c1[N+](=O)[O-] ZINC000120079966 935539747 /nfs/dbraw/zinc/53/97/47/935539747.db2.gz SJZMXNLJGGUERI-OAHLLOKOSA-N 0 0 353.422 3.994 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)N[C@@H](C1CCCC1)C(F)(F)F ZINC000437982708 945107622 /nfs/dbraw/zinc/10/76/22/945107622.db2.gz FUOAGPPGXSQJRH-INIZCTEOSA-N 0 0 369.343 3.787 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)NCc2ccc(C)s2)cc1SC ZINC000264036926 935543700 /nfs/dbraw/zinc/54/37/00/935543700.db2.gz WVVMEAJSVUSPKQ-UHFFFAOYSA-N 0 0 352.437 3.625 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N2CC(Cc3ccccc3C)C2)c1 ZINC000085478823 935545031 /nfs/dbraw/zinc/54/50/31/935545031.db2.gz IFEALSLZMFTALF-UHFFFAOYSA-N 0 0 356.447 3.940 20 5 FHBDRN Cc1cc(C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)nn1-c1ccc(C)cc1 ZINC000540731240 935545599 /nfs/dbraw/zinc/54/55/99/935545599.db2.gz WXRQXQVDEVSOOM-OAHLLOKOSA-N 0 0 364.405 3.888 20 5 FHBDRN CCC[C@@H](NC(=O)c1cc([N+](=O)[O-])nn1C)c1ccc(Cl)c(Cl)c1 ZINC000478062289 935557138 /nfs/dbraw/zinc/55/71/38/935557138.db2.gz NXYMICNTUGMPEX-GFCCVEGCSA-N 0 0 371.224 3.906 20 5 FHBDRN COc1ccc(NC(=O)c2ccc(OC3CCCC3)nc2)cc1[N+](=O)[O-] ZINC000543849397 935564657 /nfs/dbraw/zinc/56/46/57/935564657.db2.gz ZJWCFGCDTXBBGT-UHFFFAOYSA-N 0 0 357.366 3.572 20 5 FHBDRN COc1cc(C(=O)NCc2ccccc2C(F)(F)F)cc([N+](=O)[O-])c1C ZINC000478078323 935565900 /nfs/dbraw/zinc/56/59/00/935565900.db2.gz MAWMDKCQSFVFDU-UHFFFAOYSA-N 0 0 368.311 3.861 20 5 FHBDRN C[C@@H]1CC[C@H](CNC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])C1 ZINC000478112385 935574284 /nfs/dbraw/zinc/57/42/84/935574284.db2.gz OSZGUIHVHBEYBQ-MNOVXSKESA-N 0 0 360.332 3.702 20 5 FHBDRN Cc1nn(CC(C)C)c(C)c1CCC(=O)N(C)c1cccc([N+](=O)[O-])c1 ZINC000158463113 935579777 /nfs/dbraw/zinc/57/97/77/935579777.db2.gz UITZIECCNWNMKP-UHFFFAOYSA-N 0 0 358.442 3.660 20 5 FHBDRN COc1ccc(S(=O)(=O)Oc2cc(C(C)C)ccc2C)c([N+](=O)[O-])c1 ZINC000023392105 935584720 /nfs/dbraw/zinc/58/47/20/935584720.db2.gz CVUUIXTWRWHVPS-UHFFFAOYSA-N 0 0 365.407 3.803 20 5 FHBDRN Cc1cc(SCc2cccc(C(N)=O)n2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000549518371 945110543 /nfs/dbraw/zinc/11/05/43/945110543.db2.gz JXCJVIHLSNOMKM-UHFFFAOYSA-N 0 0 371.340 3.708 20 5 FHBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)[C@@H]1CCCO1 ZINC000135045803 935587183 /nfs/dbraw/zinc/58/71/83/935587183.db2.gz OYKAAIMGAWJIRZ-DOMZBBRYSA-N 0 0 352.456 3.640 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H](C(=O)OC(C)(C)C)c1ccccc1 ZINC000478165820 935588040 /nfs/dbraw/zinc/58/80/40/935588040.db2.gz KGMPEXZGQOTEIA-QGZVFWFLSA-N 0 0 370.405 3.716 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@H](CC(F)(F)F)C1 ZINC000277565659 935589985 /nfs/dbraw/zinc/58/99/85/935589985.db2.gz ZGTWLDIRDJRADJ-GHMZBOCLSA-N 0 0 362.373 3.876 20 5 FHBDRN COc1ccccc1-c1noc([C@H](C)NCc2ccc([N+](=O)[O-])cc2F)n1 ZINC000478272176 935594878 /nfs/dbraw/zinc/59/48/78/935594878.db2.gz JBDKQFCEKSOKPW-NSHDSACASA-N 0 0 372.356 3.643 20 5 FHBDRN C[C@H](c1ccccc1)N(C)C(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000519106810 945112049 /nfs/dbraw/zinc/11/20/49/945112049.db2.gz UBVDMMIWCBGXJO-CQSZACIVSA-N 0 0 350.378 3.614 20 5 FHBDRN CC(C)(C)CC[C@H](CO)NC(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000511110404 935614616 /nfs/dbraw/zinc/61/46/16/935614616.db2.gz YEQMGCBCPPHRPO-SNVBAGLBSA-N 0 0 362.348 3.531 20 5 FHBDRN CCS(=O)(=O)c1c(Cl)cccc1/C=C\c1ccc([N+](=O)[O-])cn1 ZINC000478371939 935619573 /nfs/dbraw/zinc/61/95/73/935619573.db2.gz BIRCWIBIJZZUKU-SREVYHEPSA-N 0 0 352.799 3.607 20 5 FHBDRN O=C([C@@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1)N(Cc1ccco1)c1ccccn1 ZINC001125595887 935622865 /nfs/dbraw/zinc/62/28/65/935622865.db2.gz RCWCPKBEGJPFAZ-QZTJIDSGSA-N 0 0 363.373 3.920 20 5 FHBDRN COC(=O)/C(=C/c1ccc(-c2cccc([N+](=O)[O-])c2)o1)c1ccncc1 ZINC000255504808 935624093 /nfs/dbraw/zinc/62/40/93/935624093.db2.gz XIUUQZKBAWTQFU-SFQUDFHCSA-N 0 0 350.330 3.963 20 5 FHBDRN O=[N+]([O-])c1ccccc1OC[C@@H](O)CSCc1ccccc1Cl ZINC000478391337 935625969 /nfs/dbraw/zinc/62/59/69/935625969.db2.gz QURJIYALZXTOPQ-CYBMUJFWSA-N 0 0 353.827 3.921 20 5 FHBDRN CN(Cc1ccc(Br)cc1)C(=O)Cc1ccccc1[N+](=O)[O-] ZINC000023490954 935644448 /nfs/dbraw/zinc/64/44/48/935644448.db2.gz ZATZUVPJFBSWFN-UHFFFAOYSA-N 0 0 363.211 3.558 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@@H]1Cc1ccccc1 ZINC000478559287 935646997 /nfs/dbraw/zinc/64/69/97/935646997.db2.gz XGNUPDVVGZUQNP-RHSMWYFYSA-N 0 0 356.447 3.919 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])s1)N1CCC(c2nc3ccccc3o2)CC1 ZINC000023534444 935664444 /nfs/dbraw/zinc/66/44/44/935664444.db2.gz DOSSXNKDIKZLSG-UHFFFAOYSA-N 0 0 357.391 3.817 20 5 FHBDRN CCOc1cc(OCC(=O)N(C)Cc2ccc(CC)cc2)ccc1[N+](=O)[O-] ZINC000478721765 935686431 /nfs/dbraw/zinc/68/64/31/935686431.db2.gz RPGOOJOXWUXDOB-UHFFFAOYSA-N 0 0 372.421 3.593 20 5 FHBDRN CN(Cc1ccccc1Br)C(=O)Cc1ccccc1[N+](=O)[O-] ZINC000023572481 935689034 /nfs/dbraw/zinc/68/90/34/935689034.db2.gz ZESQMSXDGWQLNE-UHFFFAOYSA-N 0 0 363.211 3.558 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H](CO)c1ccccc1 ZINC000507289178 945117356 /nfs/dbraw/zinc/11/73/56/945117356.db2.gz DSDWBPDDHZIMOD-OAHLLOKOSA-N 0 0 374.462 3.603 20 5 FHBDRN O=C(Nc1ccc(O[C@H]2CCOC2)cc1)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000158306861 935697795 /nfs/dbraw/zinc/69/77/95/935697795.db2.gz UKUCKHUSGAVJFR-AWEZNQCLSA-N 0 0 362.769 3.668 20 5 FHBDRN CCCOc1ccc(CNC(=O)NCc2cccc([N+](=O)[O-])c2C)cc1 ZINC000478761432 935708116 /nfs/dbraw/zinc/70/81/16/935708116.db2.gz LZTMJQAXGUAEJL-UHFFFAOYSA-N 0 0 357.410 3.691 20 5 FHBDRN CCOc1ccc(C(=O)N[C@H]2CCCOc3c(F)cccc32)cc1[N+](=O)[O-] ZINC000478772426 935715508 /nfs/dbraw/zinc/71/55/08/935715508.db2.gz QRMWUEQPRJOJRU-HNNXBMFYSA-N 0 0 374.368 3.776 20 5 FHBDRN CCSc1ccccc1OS(=O)(=O)c1cc([N+](=O)[O-])c(C)s1 ZINC000124075940 945119327 /nfs/dbraw/zinc/11/93/27/945119327.db2.gz UYGPUQJKUCXPFO-UHFFFAOYSA-N 0 0 359.450 3.844 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)OCc1cccc(OC)c1 ZINC000582454325 935734782 /nfs/dbraw/zinc/73/47/82/935734782.db2.gz VNLSZZQABUKBSG-CYBMUJFWSA-N 0 0 374.393 3.546 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N[C@H](C)c1nc(C(C)(C)C)no1 ZINC000127694193 935743244 /nfs/dbraw/zinc/74/32/44/935743244.db2.gz FHKBGQDRKDKYMU-LLVKDONJSA-N 0 0 361.402 3.775 20 5 FHBDRN Cc1nn(C)c(C(=O)N[C@H](c2ccc(C(C)C)cc2)C(C)C)c1[N+](=O)[O-] ZINC000127693689 935743394 /nfs/dbraw/zinc/74/33/94/935743394.db2.gz WDKVMHSOSFQHDY-INIZCTEOSA-N 0 0 358.442 3.887 20 5 FHBDRN Cc1cccnc1[C@H](NC(=O)NCc1cccc([N+](=O)[O-])c1C)C(C)C ZINC000478861540 935745838 /nfs/dbraw/zinc/74/58/38/935745838.db2.gz GIMNILJXBVNJQT-QGZVFWFLSA-N 0 0 356.426 3.803 20 5 FHBDRN O=C(N[C@H](c1cccc(F)c1)c1ccccn1)c1ccccc1[N+](=O)[O-] ZINC000152568544 935747683 /nfs/dbraw/zinc/74/76/83/935747683.db2.gz POZSYAGQPZZULN-GOSISDBHSA-N 0 0 351.337 3.648 20 5 FHBDRN CC(C)COc1ccccc1CNC(=O)NCc1ccccc1[N+](=O)[O-] ZINC000050115642 935771845 /nfs/dbraw/zinc/77/18/45/935771845.db2.gz MIHBCUWWJPQYNM-UHFFFAOYSA-N 0 0 357.410 3.629 20 5 FHBDRN CC(C)CCSc1ccc(C(=O)N(C)c2cccnn2)cc1[N+](=O)[O-] ZINC000582494745 935777456 /nfs/dbraw/zinc/77/74/56/935777456.db2.gz HAYYZYGCZVDZAQ-UHFFFAOYSA-N 0 0 360.439 3.800 20 5 FHBDRN Cc1ccc(Sc2ccc(C(=O)NCCC(C)(C)O)cc2[N+](=O)[O-])cc1 ZINC000479048958 935779005 /nfs/dbraw/zinc/77/90/05/935779005.db2.gz AEMUPHMRCFXDCA-UHFFFAOYSA-N 0 0 374.462 3.945 20 5 FHBDRN O=C(c1ccc(C(F)(F)F)c(F)c1)N1CCc2c1cccc2[N+](=O)[O-] ZINC000187751165 935781844 /nfs/dbraw/zinc/78/18/44/935781844.db2.gz ZMCUXWNDTLBZFS-UHFFFAOYSA-N 0 0 354.259 3.956 20 5 FHBDRN C[C@H](SCC(=O)N(C)c1cccc([N+](=O)[O-])c1)c1nc2ccccc2[nH]1 ZINC000158428234 935786691 /nfs/dbraw/zinc/78/66/91/935786691.db2.gz MTPRINDVXGHWMA-LBPRGKRZSA-N 0 0 370.434 3.928 20 5 FHBDRN Cn1cc(Oc2ccccc2-c2nc(-c3cccc([N+](=O)[O-])c3)no2)cn1 ZINC000511150902 935803071 /nfs/dbraw/zinc/80/30/71/935803071.db2.gz LTMZJVFWSIWLDR-UHFFFAOYSA-N 0 0 363.333 3.838 20 5 FHBDRN CC(C)N(CC(F)(F)F)C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000611614794 935806397 /nfs/dbraw/zinc/80/63/97/935806397.db2.gz WOMUEMKLJDECKH-UHFFFAOYSA-N 0 0 356.247 3.609 20 5 FHBDRN Cc1cc(OCC(=O)c2ccccc2OC(F)F)c(F)cc1[N+](=O)[O-] ZINC000479162722 935810902 /nfs/dbraw/zinc/81/09/02/935810902.db2.gz MKMMVCSSXLDYNL-UHFFFAOYSA-N 0 0 355.268 3.905 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(N2CCc3sc(Br)cc3C2)n1 ZINC000611617273 935812799 /nfs/dbraw/zinc/81/27/99/935812799.db2.gz BIABVIKZCSMXCZ-UHFFFAOYSA-N 0 0 368.256 3.993 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(OCC(=O)c2cc(C)c(F)cc2Cl)n1 ZINC000479169515 935814225 /nfs/dbraw/zinc/81/42/25/935814225.db2.gz WZLLLKQUNZATNE-UHFFFAOYSA-N 0 0 352.749 3.969 20 5 FHBDRN O=C(N[C@@H]1[C@@H]2CCO[C@@H]2C12CCC2)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000277684602 935815108 /nfs/dbraw/zinc/81/51/08/935815108.db2.gz ADAVNIIXXNGJEP-DQLDELGASA-N 0 0 374.440 3.781 20 5 FHBDRN Cc1cc(OCC(=O)N(C)[C@@H]2CCCc3ccccc32)c(F)cc1[N+](=O)[O-] ZINC000479187854 935816774 /nfs/dbraw/zinc/81/67/74/935816774.db2.gz KUHWMLSUIGWKFU-QGZVFWFLSA-N 0 0 372.396 3.957 20 5 FHBDRN CC1(C)C[C@@H](NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C(C)(C)O1 ZINC000479216973 935819272 /nfs/dbraw/zinc/81/92/72/935819272.db2.gz NZMPELSKADJOQS-GFCCVEGCSA-N 0 0 360.332 3.690 20 5 FHBDRN O=C(c1csc(-c2ccc([N+](=O)[O-])cc2)n1)N1CCc2ccccc21 ZINC000050256746 935821482 /nfs/dbraw/zinc/82/14/82/935821482.db2.gz KIMIQPYMEFTGRQ-UHFFFAOYSA-N 0 0 351.387 3.921 20 5 FHBDRN O=C(Nc1n[nH]c(-c2cccc([N+](=O)[O-])c2)n1)c1coc2cc(F)ccc12 ZINC000479367787 935831258 /nfs/dbraw/zinc/83/12/58/935831258.db2.gz SPBHNTHZTSUFDY-UHFFFAOYSA-N 0 0 367.296 3.518 20 5 FHBDRN CCn1nc(C)c([N+](=O)[O-])c1N(C)CCCOc1cccc(Cl)c1 ZINC000479370814 935831301 /nfs/dbraw/zinc/83/13/01/935831301.db2.gz KPUKLJUZMUWPPY-UHFFFAOYSA-N 0 0 352.822 3.678 20 5 FHBDRN CCC(=O)c1ccc(NC2CCN(c3ccccn3)CC2)c([N+](=O)[O-])c1 ZINC000479395419 935835056 /nfs/dbraw/zinc/83/50/56/935835056.db2.gz NQAYIKAQAOERTH-UHFFFAOYSA-N 0 0 354.410 3.663 20 5 FHBDRN CSc1ncc(C(=O)N(C)c2cccc([N+](=O)[O-])c2)n1-c1ccccc1 ZINC000158560231 935836108 /nfs/dbraw/zinc/83/61/08/935836108.db2.gz VBQUJUCKWZQPHF-UHFFFAOYSA-N 0 0 368.418 3.779 20 5 FHBDRN COc1ccc(OCC(=O)N(Cc2ccccc2)C(C)(C)C)cc1[N+](=O)[O-] ZINC000479406675 935837307 /nfs/dbraw/zinc/83/73/07/935837307.db2.gz JRQRQDZPZYUONP-UHFFFAOYSA-N 0 0 372.421 3.810 20 5 FHBDRN Cc1cc(C(=O)Nc2ccc(C(=O)NCC(C)C)cc2C)cc([N+](=O)[O-])c1 ZINC000050382008 935839545 /nfs/dbraw/zinc/83/95/45/935839545.db2.gz HNPGCXCZYVSSDW-UHFFFAOYSA-N 0 0 369.421 3.850 20 5 FHBDRN C[C@H]1CCCC[C@@H]1OCC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000479470081 935840143 /nfs/dbraw/zinc/84/01/43/935840143.db2.gz IIBOCOYRTBJIKP-LRDDRELGSA-N 0 0 354.834 3.502 20 5 FHBDRN C[C@@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1)C1(c2ccccc2)CCCC1 ZINC001211549657 935845269 /nfs/dbraw/zinc/84/52/69/935845269.db2.gz PQKGNRMVWDJPIQ-OAHLLOKOSA-N 0 0 374.462 3.774 20 5 FHBDRN C[C@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1)C1(c2ccccc2)CCCC1 ZINC001211549654 935846034 /nfs/dbraw/zinc/84/60/34/935846034.db2.gz PQKGNRMVWDJPIQ-HNNXBMFYSA-N 0 0 374.462 3.774 20 5 FHBDRN CC(C)(C)c1ccc(C2(NC(=O)Cn3ccc([N+](=O)[O-])n3)CCCC2)cc1 ZINC000511171033 935856305 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Cc1c(CNC(=O)NC[C@H]2SCCc3ccccc32)cccc1[N+](=O)[O-] ZINC000479682083 935876261 /nfs/dbraw/zinc/87/62/61/935876261.db2.gz DQQJSAADPULODV-GOSISDBHSA-N 0 0 371.462 3.733 20 5 FHBDRN CCc1cc(N(C)[C@H](C)c2nc(C)no2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000582616273 935877608 /nfs/dbraw/zinc/87/76/08/935877608.db2.gz KRWPJUHMXPYNQY-LLVKDONJSA-N 0 0 368.397 3.503 20 5 FHBDRN CC(C)(C)n1cc(NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)cn1 ZINC000127982850 935879611 /nfs/dbraw/zinc/87/96/11/935879611.db2.gz PFMBFFSUTBLKGJ-UHFFFAOYSA-N 0 0 356.304 3.817 20 5 FHBDRN CCCN(c1nnc(-c2cccc([N+](=O)[O-])c2)n1C[C@@H]1CCOC1)C(C)C ZINC000582617412 935879701 /nfs/dbraw/zinc/87/97/01/935879701.db2.gz VXYWCZKAGRHDOI-HNNXBMFYSA-N 0 0 373.457 3.515 20 5 FHBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)N1CC2(CCC2)c2ccccc21 ZINC000479716650 935882837 /nfs/dbraw/zinc/88/28/37/935882837.db2.gz POKQNCAQGQJTPJ-UHFFFAOYSA-N 0 0 351.406 3.789 20 5 FHBDRN C[C@H]1c2cccn2CCN1C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000050560502 935892993 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CC(C)(NC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21)c1ccc(F)cc1 ZINC000728500603 935964613 /nfs/dbraw/zinc/96/46/13/935964613.db2.gz XHLOJHJVDYBZPA-UHFFFAOYSA-N 0 0 355.369 3.740 20 5 FHBDRN CC[C@H](CC(=O)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccccc1 ZINC000135529479 935966427 /nfs/dbraw/zinc/96/64/27/935966427.db2.gz MMBADAYFVAJESW-NVXWUHKLSA-N 0 0 368.437 3.587 20 5 FHBDRN CCOC(=O)c1c(F)cccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000611450974 935968070 /nfs/dbraw/zinc/96/80/70/935968070.db2.gz CJLQGHWFRGEEHF-UHFFFAOYSA-N 0 0 366.732 3.816 20 5 FHBDRN COc1ccc(C2CCN(c3ncnc4ccc([N+](=O)[O-])cc43)CC2)cc1 ZINC000611709715 935970305 /nfs/dbraw/zinc/97/03/05/935970305.db2.gz VDNKCZMVQGSKIZ-UHFFFAOYSA-N 0 0 364.405 3.931 20 5 FHBDRN Cc1ccc(NC(=O)[C@H](c2ccccc2)N2C[C@@H](C)[C@H]2C)c([N+](=O)[O-])c1 ZINC000519115172 945137364 /nfs/dbraw/zinc/13/73/64/945137364.db2.gz LVSMVOFPGQCLEC-CLCXKQKWSA-N 0 0 353.422 3.923 20 5 FHBDRN C[C@@H](c1ccccc1)n1ccc(Nc2ncnc3ccc([N+](=O)[O-])cc32)n1 ZINC000611711434 935977292 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COC[C@@H](NC(=O)c1ccc(Cl)cc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000075368039 936010221 /nfs/dbraw/zinc/01/02/21/936010221.db2.gz OUXIEFDWMVFRGG-CQSZACIVSA-N 0 0 352.749 3.505 20 5 FHBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1CN(C)[C@@H]1CCCc2c1cnn2C ZINC000135603785 936023573 /nfs/dbraw/zinc/02/35/73/936023573.db2.gz JPLIFZAZAQVGAM-QGZVFWFLSA-N 0 0 358.442 3.625 20 5 FHBDRN O=[N+]([O-])c1ccc2ncnc(N[C@@H]3CCN(c4ccc(Cl)cc4)C3)c2c1 ZINC000611713899 936032156 /nfs/dbraw/zinc/03/21/56/936032156.db2.gz LFNFXFNCPNZJBN-CYBMUJFWSA-N 0 0 369.812 3.882 20 5 FHBDRN O=[N+]([O-])c1ccc2nc(N3CCO[C@H](c4ccc(F)cc4)C3)ccc2c1 ZINC000076648834 936032287 /nfs/dbraw/zinc/03/22/87/936032287.db2.gz YMFYFABHTRVQSR-SFHVURJKSA-N 0 0 353.353 3.860 20 5 FHBDRN CN(C(=O)c1cc2cc([N+](=O)[O-])ccc2s1)[C@@H]1CCCc2c1cnn2C ZINC000178651048 936035613 /nfs/dbraw/zinc/03/56/13/936035613.db2.gz IAEZQZSHKNTSND-CQSZACIVSA-N 0 0 370.434 3.693 20 5 FHBDRN O=C(c1cc([O-])cc([N+](=O)[O-])c1)N1CCC[C@@H]1CCCc1ccccc1 ZINC000507321173 945140684 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C[C@@H](OC(=O)/C=C\c1ccc([N+](=O)[O-])cc1)c1noc(-c2ccccc2)n1 ZINC000588552136 936176712 /nfs/dbraw/zinc/17/67/12/936176712.db2.gz HCZLOQPJPVWKIC-KIWPFMIBSA-N 0 0 365.345 3.962 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1N1CCC(NC(=O)Nc2ccccc2)CC1 ZINC000091458360 936179894 /nfs/dbraw/zinc/17/98/94/936179894.db2.gz SDCVBYVOLUTYBQ-UHFFFAOYSA-N 0 0 354.410 3.694 20 5 FHBDRN CN(C(=O)c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1)[C@H]1CCCOC1 ZINC000582836799 936198868 /nfs/dbraw/zinc/19/88/68/936198868.db2.gz PQINLFZQGMABFU-INIZCTEOSA-N 0 0 372.446 3.997 20 5 FHBDRN Cc1cccc(OC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)c1C ZINC000061198461 936202866 /nfs/dbraw/zinc/20/28/66/936202866.db2.gz PMUFRCCSYXAHLF-UHFFFAOYSA-N 0 0 370.361 3.505 20 5 FHBDRN O=C(N[C@@H]1CCCC(F)(F)C1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000431496759 936203846 /nfs/dbraw/zinc/20/38/46/936203846.db2.gz TXPRZPLFIWSSRA-SNVBAGLBSA-N 0 0 363.158 3.665 20 5 FHBDRN CCn1c(C)nc([N+](=O)[O-])c1N1C[C@@H](c2cc(C)ccc2C)OC[C@@H]1C ZINC000572875876 936218406 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FHBDRN O=C(CCc1cc(Cl)cs1)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000536041737 938268030 /nfs/dbraw/zinc/26/80/30/938268030.db2.gz JWIVZBYUECJEGK-UHFFFAOYSA-N 0 0 350.827 3.827 20 5 FHBDRN C[C@H](NC(=O)c1cccc2c(=O)c3ccccc3[nH]c12)C1CCOCC1 ZINC000278275525 938274215 /nfs/dbraw/zinc/27/42/15/938274215.db2.gz YOVYOGCVKXCYHJ-ZDUSSCGKSA-N 0 0 350.418 3.639 20 5 FHBDRN Cc1cc(NC(=O)c2ccc3c(c2)ncn3C)c2cc([N+](=O)[O-])ccc2n1 ZINC000161748407 938281805 /nfs/dbraw/zinc/28/18/05/938281805.db2.gz MDPUOBNKJWVDLC-UHFFFAOYSA-N 0 0 361.361 3.590 20 5 FHBDRN CCc1ccc(C(=O)N2CCC(c3ccc(O)cc3)CC2)cc1[N+](=O)[O-] ZINC000472291387 938287079 /nfs/dbraw/zinc/28/70/79/938287079.db2.gz FYLQCBDALZBAHP-UHFFFAOYSA-N 0 0 354.406 3.883 20 5 FHBDRN C[C@H](CC(=O)c1ccccc1F)C(=O)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000536063665 938295368 /nfs/dbraw/zinc/29/53/68/938295368.db2.gz ACZFLMPIGWTERP-CYBMUJFWSA-N 0 0 370.380 3.528 20 5 FHBDRN COc1ccc(C(=O)Nc2cc(C)nc3ccc([N+](=O)[O-])cc32)c(F)c1 ZINC000161770725 938299699 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373.752 3.964 20 5 FHBDRN O=C(N[C@H]1CC[C@H](O)CC1)c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1 ZINC000511241555 938310996 /nfs/dbraw/zinc/31/09/96/938310996.db2.gz PEUJDPYEJMSRAK-KOMQPUFPSA-N 0 0 372.446 3.779 20 5 FHBDRN CCO[C@@H]1C[C@@H](N(C)C(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C1(C)C ZINC000437240932 945164456 /nfs/dbraw/zinc/16/44/56/945164456.db2.gz OSNLKXXSUIJXIV-ZIAGYGMSSA-N 0 0 374.359 3.889 20 5 FHBDRN O=[N+]([O-])c1cccc2c(N3CCO[C@@H](CCc4ccccc4)C3)ccnc21 ZINC000432132906 945164511 /nfs/dbraw/zinc/16/45/11/945164511.db2.gz IQZJZUJJFNGVQQ-KRWDZBQOSA-N 0 0 363.417 3.981 20 5 FHBDRN CCC(CC)C(=O)N1CCC(Nc2ccc([N+](=O)[O-])c3cccnc23)CC1 ZINC000052473027 938322955 /nfs/dbraw/zinc/32/29/55/938322955.db2.gz NPWWHLRNOBXXKC-UHFFFAOYSA-N 0 0 370.453 3.982 20 5 FHBDRN O=[N+]([O-])c1c(N2CCO[C@H](c3ccc(Cl)cc3)C2)nc2sccn21 ZINC000052489701 938339604 /nfs/dbraw/zinc/33/96/04/938339604.db2.gz GDBZWGRIOSKEIY-LBPRGKRZSA-N 0 0 364.814 3.535 20 5 FHBDRN O=[N+]([O-])c1ccc2ccnc(N3C[C@@H]4CN(c5ccccc5)C[C@H]4C3)c2c1 ZINC000583680199 938358276 /nfs/dbraw/zinc/35/82/76/938358276.db2.gz KHOOWZXXAFSXGA-IRXDYDNUSA-N 0 0 360.417 3.716 20 5 FHBDRN Cc1c(Br)cccc1-c1noc(-c2cccnc2[N+](=O)[O-])n1 ZINC001213172609 938372519 /nfs/dbraw/zinc/37/25/19/938372519.db2.gz ZKIQXUYLOMTALW-UHFFFAOYSA-N 0 0 361.155 3.778 20 5 FHBDRN O=C(NC1(C2CC2)CCC1)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000925708059 945169139 /nfs/dbraw/zinc/16/91/39/945169139.db2.gz BQOOCWBQAMBVJY-UHFFFAOYSA-N 0 0 357.179 3.559 20 5 FHBDRN O=C(c1csc([N+](=O)[O-])c1)N1CCCCC[C@@H]1C[C@@H](O)c1ccco1 ZINC000178964252 938376399 /nfs/dbraw/zinc/37/63/99/938376399.db2.gz DEKYMRAPOSGSDF-ZIAGYGMSSA-N 0 0 364.423 3.758 20 5 FHBDRN Cc1cc(NC(=O)c2cnn(-c3ccccc3)c2)c2cc([N+](=O)[O-])ccc2n1 ZINC000161857020 938379721 /nfs/dbraw/zinc/37/97/21/938379721.db2.gz JUQCTZLQDWHGMO-UHFFFAOYSA-N 0 0 373.372 3.889 20 5 FHBDRN COC[C@H](OC(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1)c1nccs1 ZINC000278395017 938382957 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360.410 3.549 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])[C@@H]1c2cc(Cl)cc(Cl)c2C[C@@H]1O ZINC000052638622 938458056 /nfs/dbraw/zinc/45/80/56/938458056.db2.gz DIXXVTUYCGMBIX-DLBZAZTESA-N 0 0 367.232 3.992 20 5 FHBDRN CCOc1cc(CNC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)ccc1OC ZINC000074628799 938467932 /nfs/dbraw/zinc/46/79/32/938467932.db2.gz HFZMVGNRNLIHJU-UHFFFAOYSA-N 0 0 364.785 3.586 20 5 FHBDRN CCOCOc1ccc(COC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)cc1 ZINC000588585986 938471912 /nfs/dbraw/zinc/47/19/12/938471912.db2.gz LQJRTQQZHVZRQI-GHXNOFRVSA-N 0 0 357.362 3.724 20 5 FHBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])NC[C@H]1CCCSC1 ZINC000583897500 938475555 /nfs/dbraw/zinc/47/55/55/938475555.db2.gz XETLDLADHXUYFA-SNVBAGLBSA-N 0 0 360.888 3.600 20 5 FHBDRN CCC1(C)CCN(C(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)CC1 ZINC000583905566 938476484 /nfs/dbraw/zinc/47/64/84/938476484.db2.gz SPGNYMXLZCRUJI-UHFFFAOYSA-N 0 0 358.442 3.840 20 5 FHBDRN Cc1cc(-c2noc(-c3ccn(-c4ccccc4[N+](=O)[O-])n3)n2)ccc1O ZINC000583911037 938479872 /nfs/dbraw/zinc/47/98/72/938479872.db2.gz FRHRVWWKHXIPOK-UHFFFAOYSA-N 0 0 363.333 3.512 20 5 FHBDRN C[C@@H](C(=O)N1CCC[C@H]1c1cccs1)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000046599764 938481126 /nfs/dbraw/zinc/48/11/26/938481126.db2.gz CPYHZCGTOBVIBO-YOEHRIQHSA-N 0 0 373.478 3.840 20 5 FHBDRN C[C@H](C(=O)N1CCC[C@@H]1c1cccs1)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000046599762 938481219 /nfs/dbraw/zinc/48/12/19/938481219.db2.gz CPYHZCGTOBVIBO-RHSMWYFYSA-N 0 0 373.478 3.840 20 5 FHBDRN Cc1ccc([C@H](NC(=O)NCCc2cccc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000536169454 938502049 /nfs/dbraw/zinc/50/20/49/938502049.db2.gz LSGDPIHOGIFMSQ-IBGZPJMESA-N 0 0 353.422 3.896 20 5 FHBDRN CCN(CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)[C@H](C)c1cccc(OC)c1 ZINC000052706032 938504013 /nfs/dbraw/zinc/50/40/13/938504013.db2.gz MKJKKBOCEZINNG-OAHLLOKOSA-N 0 0 371.437 3.649 20 5 FHBDRN C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1Cc2ccccc2C(C)(C)C1 ZINC000536181078 938520484 /nfs/dbraw/zinc/52/04/84/938520484.db2.gz UCHGVIPPLSTKBE-CQSZACIVSA-N 0 0 353.422 3.715 20 5 FHBDRN Cc1cc(F)cc(C(=O)NCCc2nc(C(C)(C)C)cs2)c1[N+](=O)[O-] ZINC000176805562 938544849 /nfs/dbraw/zinc/54/48/49/938544849.db2.gz XUSVTBVJRQYLFD-UHFFFAOYSA-N 0 0 365.430 3.769 20 5 FHBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)N1CCC(Cc2ccccc2)CC1 ZINC000536206469 938579124 /nfs/dbraw/zinc/57/91/24/938579124.db2.gz DEWABHYUSVWJJF-UHFFFAOYSA-N 0 0 367.449 3.802 20 5 FHBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)N1CCC[C@H]1Cc1ccc(F)cc1 ZINC000536207025 938581034 /nfs/dbraw/zinc/58/10/34/938581034.db2.gz HHOIRWNLZWTWGJ-SFHVURJKSA-N 0 0 371.412 3.693 20 5 FHBDRN CCO[C@@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2SCC)C12CCC2 ZINC000158803828 938584756 /nfs/dbraw/zinc/58/47/56/938584756.db2.gz VJTQOVOWHGPFCW-HZPDHXFCSA-N 0 0 364.467 3.784 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000158809915 938588097 /nfs/dbraw/zinc/58/80/97/938588097.db2.gz BHKIWLDYURPBBS-KXBFYZLASA-N 0 0 354.406 3.801 20 5 FHBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)N1CC=C(c2ccc(O)cc2)CC1 ZINC000255587639 938598081 /nfs/dbraw/zinc/59/80/81/938598081.db2.gz IWYSXLPCXQDTFU-KMKOMSMNSA-N 0 0 350.374 3.630 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCC1([C@@H](O)C(C)C)CC1 ZINC000507369921 945188790 /nfs/dbraw/zinc/18/87/90/945188790.db2.gz NIKLFLWFJPDDHN-INIZCTEOSA-N 0 0 366.483 3.624 20 5 FHBDRN Cc1ccc(NC(=O)N2CC3(CCC3)[C@@H]2C2CCOCC2)cc1[N+](=O)[O-] ZINC000584109470 938600763 /nfs/dbraw/zinc/60/07/63/938600763.db2.gz DUGUHERFVHAZCL-KRWDZBQOSA-N 0 0 359.426 3.716 20 5 FHBDRN CC(C)NC(=O)c1ccc(N2CC[C@](F)(c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000584125360 938607636 /nfs/dbraw/zinc/60/76/36/938607636.db2.gz GRXBVFLEOYGHSU-HXUWFJFHSA-N 0 0 371.412 3.808 20 5 FHBDRN O=[N+]([O-])c1ccccc1/C=C\CN1CCC(Oc2ccc(F)nc2)CC1 ZINC000588587917 938611909 /nfs/dbraw/zinc/61/19/09/938611909.db2.gz HUOZEJVWVDTBTF-HYXAFXHYSA-N 0 0 357.385 3.686 20 5 FHBDRN O=C(NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CCC[C@H]2CCC[C@@H]21 ZINC000584146605 938616955 /nfs/dbraw/zinc/61/69/55/938616955.db2.gz SNJJPPJVCZZWHA-ACJLOTCBSA-N 0 0 356.426 3.593 20 5 FHBDRN CC(C)n1ncnc1CSCc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000278648092 938617502 /nfs/dbraw/zinc/61/75/02/938617502.db2.gz JLSVHZSXYSGPEM-UHFFFAOYSA-N 0 0 359.411 3.856 20 5 FHBDRN CCC(=O)c1cccc(S(=O)(=O)Oc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000162057895 938619015 /nfs/dbraw/zinc/61/90/15/938619015.db2.gz LCKJIJPTMWBLJL-UHFFFAOYSA-N 0 0 369.782 3.609 20 5 FHBDRN CC(C)(NC(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)c1ccccc1 ZINC000584205699 938640356 /nfs/dbraw/zinc/64/03/56/938640356.db2.gz ZRWHLICYSWHPOG-UHFFFAOYSA-N 0 0 366.421 3.853 20 5 FHBDRN Cc1cc(OCc2csc(-c3ccc(C(N)=O)cc3)n2)ccc1[N+](=O)[O-] ZINC000052889910 938645989 /nfs/dbraw/zinc/64/59/89/938645989.db2.gz POXVAIPLDHWMAL-UHFFFAOYSA-N 0 0 369.402 3.705 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCc2csc(-c3ccc(C(N)=O)cc3)n2)c1 ZINC000052889912 938646118 /nfs/dbraw/zinc/64/61/18/938646118.db2.gz GMOXBYTZBWZAML-UHFFFAOYSA-N 0 0 369.402 3.705 20 5 FHBDRN O=C(c1csc([N+](=O)[O-])c1)N1CC[C@@H](Oc2ccccc2Cl)C1 ZINC000179065750 938649390 /nfs/dbraw/zinc/64/93/90/938649390.db2.gz JVVODRZZHSWNMB-LLVKDONJSA-N 0 0 352.799 3.603 20 5 FHBDRN COc1cc(Cl)c(C(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1OC ZINC000124239337 945193138 /nfs/dbraw/zinc/19/31/38/945193138.db2.gz GTCUFTXGOFIROF-UHFFFAOYSA-N 0 0 350.758 3.826 20 5 FHBDRN COc1ccc(C)cc1NC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000052934081 938662627 /nfs/dbraw/zinc/66/26/27/938662627.db2.gz NYFBZCSOXXPKAK-UHFFFAOYSA-N 0 0 366.377 3.565 20 5 FHBDRN Cn1cc(C(=O)Nc2ccc(F)c(F)c2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000052933258 938662655 /nfs/dbraw/zinc/66/26/55/938662655.db2.gz HSHPTUXMIRGPSB-UHFFFAOYSA-N 0 0 358.304 3.526 20 5 FHBDRN CCc1ccccc1NC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000052954349 938676817 /nfs/dbraw/zinc/67/68/17/938676817.db2.gz JKCCIWRYTLSGOS-UHFFFAOYSA-N 0 0 350.378 3.810 20 5 FHBDRN COc1cc(NCCc2cccc(C(F)(F)F)n2)c(F)cc1[N+](=O)[O-] ZINC000432146796 945195217 /nfs/dbraw/zinc/19/52/17/945195217.db2.gz CTBGGFCPZLSHPG-UHFFFAOYSA-N 0 0 359.279 3.811 20 5 FHBDRN O=[N+]([O-])c1c(NCc2c(F)cccc2OC(F)F)nc2sccn21 ZINC000080699387 938691035 /nfs/dbraw/zinc/69/10/35/938691035.db2.gz AZKYDYIVAFDYJB-UHFFFAOYSA-N 0 0 358.301 3.657 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)NCc1cc(-c2ccccc2)no1 ZINC000052990476 938692817 /nfs/dbraw/zinc/69/28/17/938692817.db2.gz MXHDPGMUMFWTLA-UHFFFAOYSA-N 0 0 369.402 3.658 20 5 FHBDRN Cc1nn(C(C)(C)C)cc1[C@H](C)NC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000584344191 938693767 /nfs/dbraw/zinc/69/37/67/938693767.db2.gz SBTOOWUZMDXWKN-STQMWFEESA-N 0 0 358.442 3.836 20 5 FHBDRN O=[N+]([O-])c1cccc(Cl)c1N1CC[C@@](CO)(Cc2ccc(F)cc2)C1 ZINC000432147975 945196773 /nfs/dbraw/zinc/19/67/73/945196773.db2.gz JAMRXRXDRNVMMQ-GOSISDBHSA-N 0 0 364.804 3.819 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1N1CCC[C@]2(CCCOC2)C1 ZINC000080706564 938698065 /nfs/dbraw/zinc/69/80/65/938698065.db2.gz GTEWBWHPIAQGHT-HNNXBMFYSA-N 0 0 355.232 3.754 20 5 FHBDRN COc1ccc(NC(=O)N2C[C@@H](C(F)(F)F)CC[C@H]2C)cc1[N+](=O)[O-] ZINC000611825135 938703355 /nfs/dbraw/zinc/70/33/55/938703355.db2.gz MFWLFARNEKOPNS-ZJUUUORDSA-N 0 0 361.320 3.798 20 5 FHBDRN COc1ccc(Br)cc1CNc1cc(C)c([N+](=O)[O-])cn1 ZINC000074744943 938704469 /nfs/dbraw/zinc/70/44/69/938704469.db2.gz VGTOGRDOGDKNBX-UHFFFAOYSA-N 0 0 352.188 3.681 20 5 FHBDRN Cc1cc(NCc2ccc(NC(=O)c3cccnc3)cc2)ncc1[N+](=O)[O-] ZINC000074745201 938707935 /nfs/dbraw/zinc/70/79/35/938707935.db2.gz DOHUSLYUCWQXBQ-UHFFFAOYSA-N 0 0 363.377 3.558 20 5 FHBDRN COCCOc1cc(C)ccc1NC(=O)c1cc([N+](=O)[O-])cc(C)c1F ZINC000278739453 938709050 /nfs/dbraw/zinc/70/90/50/938709050.db2.gz DPPUMONODLSNOV-UHFFFAOYSA-N 0 0 362.357 3.628 20 5 FHBDRN CCOc1cc(C)ccc1NC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000124251501 945198862 /nfs/dbraw/zinc/19/88/62/945198862.db2.gz BSJMFUNFIHOMQT-UHFFFAOYSA-N 0 0 355.394 3.892 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)c1cc(-c2ccccc2)ns1 ZINC000437283071 945199370 /nfs/dbraw/zinc/19/93/70/945199370.db2.gz GJBGVGVGLDDYLS-UHFFFAOYSA-N 0 0 355.375 3.979 20 5 FHBDRN CC[C@@H](C)c1ccc(C(=O)Cn2cnc3sc([N+](=O)[O-])cc3c2=O)cc1 ZINC000519603173 945201232 /nfs/dbraw/zinc/20/12/32/945201232.db2.gz SHEBQVAMXGPRPW-LLVKDONJSA-N 0 0 371.418 3.763 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)N(CC(C)C)C1CCCC1 ZINC000437286195 945202046 /nfs/dbraw/zinc/20/20/46/945202046.db2.gz CLFDZFOALUEMEW-UHFFFAOYSA-N 0 0 361.442 3.577 20 5 FHBDRN COc1cc(C(=O)Nc2ncc(C(C)(C)C)s2)c([N+](=O)[O-])cc1OC ZINC000081234435 938780391 /nfs/dbraw/zinc/78/03/91/938780391.db2.gz LCEZHRSZDAKFIL-UHFFFAOYSA-N 0 0 365.411 3.618 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)NCc1ccc(F)c(COC)c1 ZINC000584380653 938782891 /nfs/dbraw/zinc/78/28/91/938782891.db2.gz MWPSNDWQHCBXHN-UHFFFAOYSA-N 0 0 361.373 3.764 20 5 FHBDRN COc1ccc(CSCC(=O)OCCc2cccs2)cc1[N+](=O)[O-] ZINC000065664607 938788585 /nfs/dbraw/zinc/78/85/85/938788585.db2.gz RQCFRBGEHYPWRK-UHFFFAOYSA-N 0 0 367.448 3.684 20 5 FHBDRN CCC(=O)Nc1cccc(CNc2c3ccccc3ncc2[N+](=O)[O-])c1 ZINC000584386364 938795260 /nfs/dbraw/zinc/79/52/60/938795260.db2.gz JIOUUFRTROIXAM-UHFFFAOYSA-N 0 0 350.378 3.526 20 5 FHBDRN CCn1c2ccc(C)cc2nc1NC(=O)c1cc(F)c([N+](=O)[O-])cc1F ZINC000124256446 945206206 /nfs/dbraw/zinc/20/62/06/945206206.db2.gz MNEBPJNNDYZBCE-UHFFFAOYSA-N 0 0 360.320 3.803 20 5 FHBDRN CCS[C@@H]1CCCC[C@@H]1NC(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000427212922 945206807 /nfs/dbraw/zinc/20/68/07/945206807.db2.gz OFIRKTABLPFSRP-GOEBONIOSA-N 0 0 351.472 3.577 20 5 FHBDRN CC[C@H](CNC(=O)Cc1cccc([N+](=O)[O-])c1C)Oc1ccccc1F ZINC000128182487 938823439 /nfs/dbraw/zinc/82/34/39/938823439.db2.gz OBTWKKZLQPBEFI-OAHLLOKOSA-N 0 0 360.385 3.559 20 5 FHBDRN COc1ccc(/C=C\C(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)cc1OC ZINC000255591152 938824423 /nfs/dbraw/zinc/82/44/23/938824423.db2.gz WYTXPIDXJMKYNF-SDQBBNPISA-N 0 0 370.405 3.677 20 5 FHBDRN Cc1n[nH]c(C(=O)N2CCCCC[C@@H]2/C=C/c2ccccc2)c1[N+](=O)[O-] ZINC000084839378 938832624 /nfs/dbraw/zinc/83/26/24/938832624.db2.gz OQAWVAYBRBXBTL-LPQFERQCSA-N 0 0 354.410 3.725 20 5 FHBDRN C[C@@H](c1ccccc1)N(C)S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000044762007 945209053 /nfs/dbraw/zinc/20/90/53/945209053.db2.gz GXTJOWUJZYITDH-NSHDSACASA-N 0 0 354.815 3.630 20 5 FHBDRN CC(C)(C(=O)N[C@H]1CCOC2(CCCCC2)C1)c1ccccc1[N+](=O)[O-] ZINC000480319583 938851439 /nfs/dbraw/zinc/85/14/39/938851439.db2.gz RLIPMOVYYQHGHV-HNNXBMFYSA-N 0 0 360.454 3.871 20 5 FHBDRN COc1ccccc1[C@H](Nc1cc(C)ccc1[N+](=O)[O-])c1nccn1C ZINC000088699110 938852430 /nfs/dbraw/zinc/85/24/30/938852430.db2.gz RFQYPZLSTPCIJV-SFHVURJKSA-N 0 0 352.394 3.847 20 5 FHBDRN COC(=O)c1cc(C)nc(N(C)[C@H](C)c2c(F)cccc2F)c1[N+](=O)[O-] ZINC000584427805 938857011 /nfs/dbraw/zinc/85/70/11/938857011.db2.gz OQUFEDSFXWVOFP-SNVBAGLBSA-N 0 0 365.336 3.560 20 5 FHBDRN COc1ccc(C2(CNc3c(F)cccc3[N+](=O)[O-])CCOCC2)cc1 ZINC000584427860 938857085 /nfs/dbraw/zinc/85/70/85/938857085.db2.gz SEZKKHIQEMKHCF-UHFFFAOYSA-N 0 0 360.385 3.903 20 5 FHBDRN O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)N[C@@H]1C[C@H]1c1cccc(Cl)c1 ZINC000584433812 938872730 /nfs/dbraw/zinc/87/27/30/938872730.db2.gz QOQSHNWQCUYDCY-BLLLJJGKSA-N 0 0 366.751 3.741 20 5 FHBDRN CC(C)C(=O)Nc1cccc(NC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])c1 ZINC000065669462 938874171 /nfs/dbraw/zinc/87/41/71/938874171.db2.gz OCEVPTFNXTVQOD-UHFFFAOYSA-N 0 0 363.320 3.720 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCO[C@@H](c3ccco3)C2)nc1-c1ccccc1 ZINC000090109652 938876420 /nfs/dbraw/zinc/87/64/20/938876420.db2.gz AMTRXNOFTDGCCZ-QGZVFWFLSA-N 0 0 351.362 3.828 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CC[C@@]3(O)CCCC[C@@H]3C2)nc1-c1ccccc1 ZINC000090112824 938876769 /nfs/dbraw/zinc/87/67/69/938876769.db2.gz KBLWHNRPVDUIIZ-UZLBHIALSA-N 0 0 353.422 3.788 20 5 FHBDRN Cc1cc(OCCCS(=O)(=O)c2ccccc2)c(Cl)cc1[N+](=O)[O-] ZINC000506434126 945212060 /nfs/dbraw/zinc/21/20/60/945212060.db2.gz QOWYAKYIPPMRQB-UHFFFAOYSA-N 0 0 369.826 3.799 20 5 FHBDRN COc1cc(N2CCC(OCc3ccc(F)cc3)CC2)ccc1[N+](=O)[O-] ZINC000091668482 938904483 /nfs/dbraw/zinc/90/44/83/938904483.db2.gz LFCFOALGKNBXTN-UHFFFAOYSA-N 0 0 360.385 3.928 20 5 FHBDRN Cc1nn(CCC(=O)Nc2cnc(-c3ccccc3)s2)c(C)c1[N+](=O)[O-] ZINC000091773471 938905311 /nfs/dbraw/zinc/90/53/11/938905311.db2.gz OGIVSTBPKYIICD-UHFFFAOYSA-N 0 0 371.422 3.560 20 5 FHBDRN Cn1cc(-c2noc(-c3cc(Cl)cc([N+](=O)[O-])c3)n2)c(C(F)(F)F)n1 ZINC000426226985 945214561 /nfs/dbraw/zinc/21/45/61/945214561.db2.gz NWATXMILCDDLDD-UHFFFAOYSA-N 0 0 373.678 3.718 20 5 FHBDRN Cc1cc(OCC(=O)N[C@@H](C)c2ccc(F)cc2)c(Cl)cc1[N+](=O)[O-] ZINC000506434969 945214593 /nfs/dbraw/zinc/21/45/93/945214593.db2.gz YSWKZYKBRUFCPW-NSHDSACASA-N 0 0 366.776 3.952 20 5 FHBDRN CS(=O)(=O)c1ccc(N[C@@H]2CCCc3ccc(F)cc32)c([N+](=O)[O-])c1 ZINC000092964340 938924034 /nfs/dbraw/zinc/92/40/34/938924034.db2.gz YVMJVGRBEPABNT-OAHLLOKOSA-N 0 0 364.398 3.627 20 5 FHBDRN Nc1c(C(=O)N2CCC3(CC3(F)F)CC2)cc2ccccc2c1[N+](=O)[O-] ZINC000892383066 938936193 /nfs/dbraw/zinc/93/61/93/938936193.db2.gz BIWCTMRNUPQBPE-UHFFFAOYSA-N 0 0 361.348 3.592 20 5 FHBDRN CCOC(=O)CC1(CNC(=O)c2cccc([N+](=O)[O-])c2C)CCCCC1 ZINC000536216417 938946242 /nfs/dbraw/zinc/94/62/42/938946242.db2.gz TTZRRHUOWWRAGO-UHFFFAOYSA-N 0 0 362.426 3.537 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@@H](CC(C)(C)C)c1ccccc1 ZINC000149371419 938956795 /nfs/dbraw/zinc/95/67/95/938956795.db2.gz NLGQYAKZGYVNDG-INIZCTEOSA-N 0 0 358.442 3.784 20 5 FHBDRN CN(Cc1ccc(F)cc1)C(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000198701061 938965680 /nfs/dbraw/zinc/96/56/80/938965680.db2.gz GASLKHKNHTYWRE-UHFFFAOYSA-N 0 0 374.415 3.952 20 5 FHBDRN COc1ccc(CC(C)(C)NC(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)cc1 ZINC000480510135 938966207 /nfs/dbraw/zinc/96/62/07/938966207.db2.gz OZZFQZYXXAXKCP-UHFFFAOYSA-N 0 0 372.421 3.672 20 5 FHBDRN Cc1ncsc1NC(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000511265290 938971130 /nfs/dbraw/zinc/97/11/30/938971130.db2.gz IXWDLSSMQMBSCP-UHFFFAOYSA-N 0 0 356.201 3.683 20 5 FHBDRN CC(C)[C@H](NC(=O)NCCc1ccccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000409631574 938977512 /nfs/dbraw/zinc/97/75/12/938977512.db2.gz OKBCAMWVPUPJGY-SFHVURJKSA-N 0 0 359.401 3.973 20 5 FHBDRN C[C@H](c1cccc([N+](=O)[O-])c1)S(=O)(=O)Cc1ncccc1C(F)(F)F ZINC000431573613 938979458 /nfs/dbraw/zinc/97/94/58/938979458.db2.gz BWFXTRSXALZMOJ-SNVBAGLBSA-N 0 0 374.340 3.685 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)Nc1cccc(-c2ncco2)c1 ZINC000179154726 938980103 /nfs/dbraw/zinc/98/01/03/938980103.db2.gz ZCBVJYSAMCMLQE-UHFFFAOYSA-N 0 0 352.350 3.914 20 5 FHBDRN COc1ccc(CCCC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)c(OC)c1 ZINC000179158761 938980772 /nfs/dbraw/zinc/98/07/72/938980772.db2.gz UFDWSJJBDDYPMV-CQSZACIVSA-N 0 0 372.421 3.812 20 5 FHBDRN Cc1ccc(NS(=O)(=O)c2ccc(C(=O)C(C)C)cc2)cc1[N+](=O)[O-] ZINC000135606135 938981687 /nfs/dbraw/zinc/98/16/87/938981687.db2.gz NLDCFCHMTWBNMV-UHFFFAOYSA-N 0 0 362.407 3.543 20 5 FHBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)c1ccnc(Br)c1 ZINC000135654367 938986117 /nfs/dbraw/zinc/98/61/17/938986117.db2.gz PBSQOUIMKXIYSV-UHFFFAOYSA-N 0 0 370.590 3.966 20 5 FHBDRN CCN(C(=O)c1cc2c(cc1[N+](=O)[O-])OCCCO2)[C@H]1CCCC[C@@H]1C ZINC001125732244 938986201 /nfs/dbraw/zinc/98/62/01/938986201.db2.gz CDEVKNHNCKQHMD-ZFWWWQNUSA-N 0 0 362.426 3.797 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(O[C@H]2CCCC[C@H]2O)cc1 ZINC000135665387 938987588 /nfs/dbraw/zinc/98/75/88/938987588.db2.gz UHOLWOJKFKLFPJ-MOPGFXCFSA-N 0 0 370.405 3.838 20 5 FHBDRN O=C(NCCOc1ccc(C(F)(F)F)cc1)Nc1cccc([N+](=O)[O-])c1 ZINC000409673485 938991098 /nfs/dbraw/zinc/99/10/98/938991098.db2.gz ZXWUBKYWEMNZEZ-UHFFFAOYSA-N 0 0 369.299 3.814 20 5 FHBDRN CCCC[C@H](Sc1cc(C(F)(F)F)ncc1[N+](=O)[O-])C(=O)OC ZINC000480557915 938991272 /nfs/dbraw/zinc/99/12/72/938991272.db2.gz AMTAZVQHIDPWTI-VIFPVBQESA-N 0 0 352.334 3.833 20 5 FHBDRN CCC[C@@H](C)[C@H]1CCCN1C(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000785180643 938991464 /nfs/dbraw/zinc/99/14/64/938991464.db2.gz TUGCKMOZEXKEAN-IAQYHMDHSA-N 0 0 367.833 3.614 20 5 FHBDRN C[C@@H]1[C@H](C(F)(F)F)CCN1c1ncc([N+](=O)[O-])cc1Br ZINC000480560599 938991806 /nfs/dbraw/zinc/99/18/06/938991806.db2.gz YFKYAHIMDXIYHO-HTRCEHHLSA-N 0 0 354.126 3.529 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2noc(C[C@@H]3CCC[C@H](C(F)(F)F)O3)n2)c1 ZINC000923774423 938994522 /nfs/dbraw/zinc/99/45/22/938994522.db2.gz XLBNUGOGCMQGLD-NWDGAFQWSA-N 0 0 357.288 3.687 20 5 FHBDRN COC(=O)[C@H](NCCc1ccc([N+](=O)[O-])cc1)c1ccc2ccccc2c1 ZINC000611943734 938994530 /nfs/dbraw/zinc/99/45/30/938994530.db2.gz SJQVPTQQKDZAHK-HXUWFJFHSA-N 0 0 364.401 3.794 20 5 FHBDRN COC(=O)c1nc([C@H]2CCCN2c2ccc([N+](=O)[O-])c(C)c2)sc1C ZINC000480582565 938996095 /nfs/dbraw/zinc/99/60/95/938996095.db2.gz UOJNJUPSGKTGFT-CQSZACIVSA-N 0 0 361.423 3.796 20 5 FHBDRN CCc1n[nH]c(C(=O)N[C@@H](C)Cc2c(Cl)cccc2Cl)c1[N+](=O)[O-] ZINC000179242719 938996482 /nfs/dbraw/zinc/99/64/82/938996482.db2.gz KYWVBHGMHYPPLZ-QMMMGPOBSA-N 0 0 371.224 3.548 20 5 FHBDRN COc1ccc(NC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)cc1Cl ZINC000065713483 938996739 /nfs/dbraw/zinc/99/67/39/938996739.db2.gz MMENDEAIEZJQIY-UHFFFAOYSA-N 0 0 359.769 3.850 20 5 FHBDRN CC[C@H](C)Oc1ccc(NC(=O)c2cc(C(=O)OC)cc([N+](=O)[O-])c2)cc1 ZINC000065709849 938996962 /nfs/dbraw/zinc/99/69/62/938996962.db2.gz NYLAPCRXBNZSDT-LBPRGKRZSA-N 0 0 372.377 3.811 20 5 FHBDRN COc1cc(Oc2cccc(Oc3cnccn3)c2)c([N+](=O)[O-])cc1OC ZINC000480588359 938997226 /nfs/dbraw/zinc/99/72/26/938997226.db2.gz ZTANGTYYAIAZTQ-UHFFFAOYSA-N 0 0 369.333 3.987 20 5 FHBDRN O=[N+]([O-])c1ccc(Cl)c(NS(=O)(=O)/C=C\c2ccc(F)cc2)c1 ZINC000588619844 939000175 /nfs/dbraw/zinc/00/01/75/939000175.db2.gz BROJHAKFHCPVIU-FPLPWBNLSA-N 0 0 356.762 3.800 20 5 FHBDRN C[C@H]1C[C@@H](c2ccccc2)CCN1C(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000466887086 939004061 /nfs/dbraw/zinc/00/40/61/939004061.db2.gz IQBDPKZBCPDWAF-RDJZCZTQSA-N 0 0 354.406 3.768 20 5 FHBDRN O=C(c1cc2c(cc1[N+](=O)[O-])OCCCO2)N(CC1CC1)C1CCCCC1 ZINC001125771222 939005815 /nfs/dbraw/zinc/00/58/15/939005815.db2.gz UOXYCAJIBVYKRC-UHFFFAOYSA-N 0 0 374.437 3.941 20 5 FHBDRN CCN(Cc1cccc(F)c1)C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000065719514 939006156 /nfs/dbraw/zinc/00/61/56/939006156.db2.gz AKQAXINXPJYZRG-UHFFFAOYSA-N 0 0 355.369 3.737 20 5 FHBDRN C[C@H]1CCN(CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)[C@H]1c1cccc(F)c1 ZINC000472344991 939006174 /nfs/dbraw/zinc/00/61/74/939006174.db2.gz BNTUFKKTUDHFKZ-VBKZILBWSA-N 0 0 371.412 3.780 20 5 FHBDRN CCN(Cc1ccccc1C)C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000065724941 939007144 /nfs/dbraw/zinc/00/71/44/939007144.db2.gz OIOCBQGREKALIC-UHFFFAOYSA-N 0 0 351.406 3.907 20 5 FHBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)C1(CCOCc2ccccc2)CC1 ZINC000472346276 939007449 /nfs/dbraw/zinc/00/74/49/939007449.db2.gz GIENYFQVLDJCSX-UHFFFAOYSA-N 0 0 368.433 3.641 20 5 FHBDRN CO[C@@H]1Cc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3SC)cc2C1 ZINC000935347478 939010123 /nfs/dbraw/zinc/01/01/23/939010123.db2.gz WPHSQQKGVCHPLL-OAHLLOKOSA-N 0 0 358.419 3.683 20 5 FHBDRN Cc1ccc(O[C@H](C)CNC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)cc1 ZINC000136164574 939012394 /nfs/dbraw/zinc/01/23/94/939012394.db2.gz ABBMRKGSVYTAMN-CQSZACIVSA-N 0 0 367.405 3.511 20 5 FHBDRN O=C(OC[C@@H]1CCOC1)c1cc([N+](=O)[O-])ccc1SC1CCCC1 ZINC000135850402 939013176 /nfs/dbraw/zinc/01/31/76/939013176.db2.gz ZGVVAHCOGSIAGZ-GFCCVEGCSA-N 0 0 351.424 3.823 20 5 FHBDRN C[C@@H](O)C[C@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1SC1CCCC1 ZINC000611985002 939013506 /nfs/dbraw/zinc/01/35/06/939013506.db2.gz VYJWGRCWSBKAQO-NWDGAFQWSA-N 0 0 352.456 3.519 20 5 FHBDRN CN(Cc1ccc(Br)s1)C(=O)c1cc(F)cc([N+](=O)[O-])c1 ZINC000609442476 939016452 /nfs/dbraw/zinc/01/64/52/939016452.db2.gz JODHUBWBZUGZII-UHFFFAOYSA-N 0 0 373.203 3.830 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@@H](CC(C)(C)C)c1ccc(F)cc1 ZINC000065734336 939017646 /nfs/dbraw/zinc/01/76/46/939017646.db2.gz YMWIGWQLPYLPJI-HNNXBMFYSA-N 0 0 362.405 3.533 20 5 FHBDRN COC(=O)[C@H](OC(=O)c1csc([N+](=O)[O-])c1)c1c(F)cccc1Cl ZINC000785190012 939020096 /nfs/dbraw/zinc/02/00/96/939020096.db2.gz RWWFCRRPIUAKJB-GFCCVEGCSA-N 0 0 373.745 3.520 20 5 FHBDRN O=[N+]([O-])c1ccc(Cc2nc(COc3cccc(F)c3)no2)c(Cl)c1 ZINC000188159931 939020434 /nfs/dbraw/zinc/02/04/34/939020434.db2.gz GZHVIEPCKMKIOH-UHFFFAOYSA-N 0 0 363.732 3.940 20 5 FHBDRN C[C@H](c1nc(COc2cccc(F)c2)no1)c1ccc([N+](=O)[O-])cc1F ZINC000188155722 939020457 /nfs/dbraw/zinc/02/04/57/939020457.db2.gz KMSAFQMNHUMWMT-JTQLQIEISA-N 0 0 361.304 3.987 20 5 FHBDRN O=[N+]([O-])c1ccc2oc(CSc3nnc(C(F)(F)F)s3)nc2c1 ZINC000188164186 939021375 /nfs/dbraw/zinc/02/13/75/939021375.db2.gz LYPVSHFORYTGKW-UHFFFAOYSA-N 0 0 362.314 3.899 20 5 FHBDRN CO[C@H](CNC(=O)c1cccc(SC)c1[N+](=O)[O-])c1ccc(F)cc1 ZINC000188181987 939028030 /nfs/dbraw/zinc/02/80/30/939028030.db2.gz RGYKDUNLUZRKSW-CQSZACIVSA-N 0 0 364.398 3.573 20 5 FHBDRN CC(C)c1ccc(C(=O)N(C)c2nc3ccccc3n2C)cc1[N+](=O)[O-] ZINC000188213489 939046995 /nfs/dbraw/zinc/04/69/95/939046995.db2.gz NEJZFBQOWBHWMM-UHFFFAOYSA-N 0 0 352.394 3.882 20 5 FHBDRN COc1cc(OC)cc(N(C)C(=O)c2c(Cl)cccc2[N+](=O)[O-])c1 ZINC000188236534 939072330 /nfs/dbraw/zinc/07/23/30/939072330.db2.gz FIFPVLDZWFSOLV-UHFFFAOYSA-N 0 0 350.758 3.542 20 5 FHBDRN O=C(N=c1cc(-c2cccc([N+](=O)[O-])c2)[nH][nH]1)c1cc(O)c2ccccc2c1 ZINC000438922259 945226002 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FHBDRN Cc1c2ccccc2oc1CNC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000124315245 945230233 /nfs/dbraw/zinc/23/02/33/945230233.db2.gz SQQFZXRRRHVOMS-UHFFFAOYSA-N 0 0 365.389 3.917 20 5 FHBDRN CSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H](C)c1nc(C)cs1 ZINC000935372325 939144590 /nfs/dbraw/zinc/14/45/90/939144590.db2.gz UFPTZYVWTFTQMJ-SECBINFHSA-N 0 0 351.453 3.615 20 5 FHBDRN CC1CCN(c2ccc(C(=O)Nc3ccc(O)cc3F)cc2[N+](=O)[O-])CC1 ZINC000124319274 945230463 /nfs/dbraw/zinc/23/04/63/945230463.db2.gz GVMYIHOXRPVOSR-UHFFFAOYSA-N 0 0 373.384 3.928 20 5 FHBDRN CCC(=O)c1cccc(NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)c1 ZINC000179422880 939148328 /nfs/dbraw/zinc/14/83/28/939148328.db2.gz HIMSABNUDPKJHA-UHFFFAOYSA-N 0 0 351.362 3.850 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NCc1ccc(OC)c(F)c1 ZINC000179461738 939162931 /nfs/dbraw/zinc/16/29/31/939162931.db2.gz XEDJVQPBRLCEKP-UHFFFAOYSA-N 0 0 364.398 3.785 20 5 FHBDRN CCOc1cccc2[nH]cc(CC(=O)N[C@H](C)c3cccc([N+](=O)[O-])c3)c21 ZINC000188310871 939167501 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374.368 3.728 20 5 FHBDRN CCN(c1ccnc(NC(=O)c2cc(C)ccc2[N+](=O)[O-])n1)C1CCCC1 ZINC000411105340 939998776 /nfs/dbraw/zinc/99/87/76/939998776.db2.gz SKPQUCNJCLZGTO-UHFFFAOYSA-N 0 0 369.425 3.714 20 5 FHBDRN O=C(Nc1ncc(-c2ccccc2)s1)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000047541996 945288243 /nfs/dbraw/zinc/28/82/43/945288243.db2.gz FKQDQEFIUJGBOU-UHFFFAOYSA-N 0 0 365.374 3.847 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)C(=O)N[C@@H]1CC[C@@H]2CCCC[C@@H]2C1 ZINC000411143475 940003241 /nfs/dbraw/zinc/00/32/41/940003241.db2.gz YZYJCPUCPFZJOV-ARFHVFGLSA-N 0 0 373.453 3.625 20 5 FHBDRN CC[C@H](NC(=O)Cc1c(F)c(OC)ccc1[N+](=O)[O-])c1ccc(C)cc1 ZINC000411123823 940005713 /nfs/dbraw/zinc/00/57/13/940005713.db2.gz FPBNMECGOPLGHH-HNNXBMFYSA-N 0 0 360.385 3.861 20 5 FHBDRN CC[C@@H](C)NC(=O)c1ccc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2)c(C)c1 ZINC000518282294 945289615 /nfs/dbraw/zinc/28/96/15/945289615.db2.gz ZBTCMRGFBRVKTF-GFCCVEGCSA-N 0 0 373.384 3.823 20 5 FHBDRN 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O=[N+]([O-])c1ccc(NC[C@@H](c2ccc(Cl)cc2)N2CCOCC2)s1 ZINC000065945833 940087609 /nfs/dbraw/zinc/08/76/09/940087609.db2.gz ADDZWMCKANZPNY-AWEZNQCLSA-N 0 0 367.858 3.795 20 5 FHBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N(C)C[C@@H]1CCC[C@H]1O ZINC000124425548 945295067 /nfs/dbraw/zinc/29/50/67/945295067.db2.gz SOWLPWVLJQPDGF-XJKSGUPXSA-N 0 0 366.483 3.576 20 5 FHBDRN COC[C@@H](NC(=O)c1cc2cc([N+](=O)[O-])ccc2o1)c1ccc(F)cc1 ZINC000437390364 945295228 /nfs/dbraw/zinc/29/52/28/945295228.db2.gz DUHYJQMMFKXMSU-OAHLLOKOSA-N 0 0 358.325 3.598 20 5 FHBDRN CCc1ccc(-c2noc(CN(C)CCc3cccc([N+](=O)[O-])c3)n2)cc1 ZINC000548933306 940093830 /nfs/dbraw/zinc/09/38/30/940093830.db2.gz BLPKIJGRUORKDY-UHFFFAOYSA-N 0 0 366.421 3.882 20 5 FHBDRN CCC[C@@H](NC(=O)C(=O)Nc1cc(C)c([N+](=O)[O-])cc1C)C1CCCC1 ZINC000411718220 940095115 /nfs/dbraw/zinc/09/51/15/940095115.db2.gz PPFYDLDRPVRUDC-OAHLLOKOSA-N 0 0 361.442 3.625 20 5 FHBDRN CCC[C@H](NC(=O)C(=O)Nc1cc([N+](=O)[O-])c(C)cc1C)C1CCCC1 ZINC000411714368 940095245 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FHBDRN CN(C(=O)CCOc1ccccc1[N+](=O)[O-])[C@@H]1CCCc2ccccc21 ZINC000055011720 940248148 /nfs/dbraw/zinc/24/81/48/940248148.db2.gz CUYLNQSWTHEWNR-QGZVFWFLSA-N 0 0 354.406 3.900 20 5 FHBDRN O=[N+]([O-])C[C@H](Oc1ccc(Br)cc1Cl)c1cccnc1 ZINC001226069869 945306866 /nfs/dbraw/zinc/30/68/66/945306866.db2.gz WMZZAYIHWQUIPA-ZDUSSCGKSA-N 0 0 357.591 3.894 20 5 FHBDRN O=C(N[C@@H]1CCOc2c(F)cccc21)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000507552408 945309425 /nfs/dbraw/zinc/30/94/25/945309425.db2.gz OEOBSVBDLWZVMZ-CYBMUJFWSA-N 0 0 350.733 3.641 20 5 FHBDRN O=[N+]([O-])c1ccc(Cl)c(CN2CCC(OC[C@H]3CCCCO3)CC2)c1 ZINC000177585507 940299255 /nfs/dbraw/zinc/29/92/55/940299255.db2.gz ALEZOYIJBLMWEO-QGZVFWFLSA-N 0 0 368.861 3.798 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)NCc1ncc(-c2ccccc2)cn1 ZINC000184379903 945310088 /nfs/dbraw/zinc/31/00/88/945310088.db2.gz SVDAUOPXHJCSEX-UHFFFAOYSA-N 0 0 363.377 3.682 20 5 FHBDRN O=C(N[C@H](Cc1ccccc1)C1CC1)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000124586658 945310924 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FHBDRN CCO[C@@H]1C[C@H](NC(=O)c2cccc(Cl)c2[N+](=O)[O-])C12CCCC2 ZINC000177653432 940338510 /nfs/dbraw/zinc/33/85/10/940338510.db2.gz DXLSVYNHRVZEIB-UONOGXRCSA-N 0 0 352.818 3.716 20 5 FHBDRN O=[N+]([O-])c1ccc(-n2ccc(-c3nc([C@H]4CCc5ccccc54)no3)n2)cc1 ZINC000612932858 940343347 /nfs/dbraw/zinc/34/33/47/940343347.db2.gz GCMXDFIRVPGFLE-KRWDZBQOSA-N 0 0 373.372 3.909 20 5 FHBDRN CN(Cc1nc([C@H]2CCc3ccccc3C2)no1)c1ccccc1[N+](=O)[O-] ZINC000612951584 940355989 /nfs/dbraw/zinc/35/59/89/940355989.db2.gz JRZRKPKOWDEHHI-INIZCTEOSA-N 0 0 364.405 3.887 20 5 FHBDRN CC(C)OCC(C)(C)NC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000413983327 940357664 /nfs/dbraw/zinc/35/76/64/940357664.db2.gz CQIXNCPRGRXKNH-UHFFFAOYSA-N 0 0 352.434 3.615 20 5 FHBDRN Cc1cc(Cc2noc(CN(C)c3ccc(Cl)cn3)n2)ccc1[N+](=O)[O-] ZINC000612958014 940361056 /nfs/dbraw/zinc/36/10/56/940361056.db2.gz GPOCYDZNRSDLHV-UHFFFAOYSA-N 0 0 373.800 3.562 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N[C@H]2CCCC[C@H]2CC)cc1OC ZINC000124618694 945312872 /nfs/dbraw/zinc/31/28/72/945312872.db2.gz ZVPLOOWBROXTMC-OCCSQVGLSA-N 0 0 350.415 3.701 20 5 FHBDRN Cc1ccc(CC[C@@H](C)NC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)o1 ZINC000511406544 940383708 /nfs/dbraw/zinc/38/37/08/940383708.db2.gz XCPLAMFPIAUNKK-CQSZACIVSA-N 0 0 359.426 3.701 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1cc(C)ccc1-n1cc(C)cn1 ZINC000427381899 945313501 /nfs/dbraw/zinc/31/35/01/945313501.db2.gz BCPYGDAQSDWNBW-UHFFFAOYSA-N 0 0 366.377 3.658 20 5 FHBDRN CC(=O)c1cc(NC2CCN(C(=O)C3CCCCC3)CC2)ccc1[N+](=O)[O-] ZINC000376158462 940389863 /nfs/dbraw/zinc/38/98/63/940389863.db2.gz PIDUVORIDHBGAT-UHFFFAOYSA-N 0 0 373.453 3.781 20 5 FHBDRN CC(C)(CNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F)c1ccncc1 ZINC000613024053 940398131 /nfs/dbraw/zinc/39/81/31/940398131.db2.gz LIOZQIKJSBFGJK-UHFFFAOYSA-N 0 0 359.401 3.501 20 5 FHBDRN CSc1ccc([C@H](C)NC(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)cc1 ZINC000066304982 940404685 /nfs/dbraw/zinc/40/46/85/940404685.db2.gz BGVHSDLHGAZJCY-NSHDSACASA-N 0 0 374.418 3.579 20 5 FHBDRN CC(C)c1nccn1C[C@@H]1CCCN1c1ncnc2sc([N+](=O)[O-])cc21 ZINC000376170617 940410567 /nfs/dbraw/zinc/41/05/67/940410567.db2.gz GFFFDIZYHNQUEV-LBPRGKRZSA-N 0 0 372.454 3.588 20 5 FHBDRN COC(=O)c1ccc(NC(=O)[C@H](C)c2cccc([N+](=O)[O-])c2)cc1Cl ZINC000579902923 940420833 /nfs/dbraw/zinc/42/08/33/940420833.db2.gz NJQFRGRNKLDSBW-SNVBAGLBSA-N 0 0 362.769 3.777 20 5 FHBDRN O=[N+]([O-])c1ccc([C@H](NC[C@@H]2COc3ccccc32)C(F)(F)F)cc1 ZINC000579966490 940425896 /nfs/dbraw/zinc/42/58/96/940425896.db2.gz IYHIVICFODJHTH-WBMJQRKESA-N 0 0 352.312 3.964 20 5 FHBDRN CCOc1cc(OCC(=O)Nc2sc(C)c(C)c2C)ccc1[N+](=O)[O-] ZINC000188616177 940426150 /nfs/dbraw/zinc/42/61/50/940426150.db2.gz BDUNEUCXAPMKPN-UHFFFAOYSA-N 0 0 364.423 3.998 20 5 FHBDRN CC(C)CN(Cc1ccccc1)c1sc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000580000879 940432721 /nfs/dbraw/zinc/43/27/21/940432721.db2.gz BXBZHYYAVJSWEI-UHFFFAOYSA-N 0 0 368.480 3.722 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)N[C@H](Cc1ccccc1)C1CC1 ZINC000511420958 940436410 /nfs/dbraw/zinc/43/64/10/940436410.db2.gz HTPZRGSYKNUTBD-HXUWFJFHSA-N 0 0 367.449 3.800 20 5 FHBDRN CC(=O)c1cc([N+](=O)[O-])ccc1N1CCC[C@@H](n2ccnc2C(C)C)C1 ZINC000376189244 940441445 /nfs/dbraw/zinc/44/14/45/940441445.db2.gz UQEZQIIRLUUQKI-MRXNPFEDSA-N 0 0 356.426 3.959 20 5 FHBDRN O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CC[C@@H](C2CCOCC2)C1 ZINC000376192871 940446007 /nfs/dbraw/zinc/44/60/07/940446007.db2.gz CMXAMICYPUQMQD-CYBMUJFWSA-N 0 0 360.435 3.698 20 5 FHBDRN CCOc1ccc(C(=O)Nc2cc(F)cc(F)c2OC)cc1[N+](=O)[O-] ZINC000472507298 940451004 /nfs/dbraw/zinc/45/10/04/940451004.db2.gz YEDBQBBEAHTKEY-UHFFFAOYSA-N 0 0 352.293 3.533 20 5 FHBDRN CCOc1ccc(C(C)=O)cc1COc1ccc(C(=O)OC)c([N+](=O)[O-])c1 ZINC000613109291 940451864 /nfs/dbraw/zinc/45/18/64/940451864.db2.gz ACENDNYYIAEZKA-UHFFFAOYSA-N 0 0 373.361 3.562 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@H](Oc2ccccc2)C1 ZINC000580076769 940451908 /nfs/dbraw/zinc/45/19/08/940451908.db2.gz GAZHHJGODBZZLE-XLIONFOSSA-N 0 0 368.433 3.843 20 5 FHBDRN COC(=O)c1ccc(OCc2nc(-c3ccccc3)oc2C)cc1[N+](=O)[O-] ZINC000613109125 940452029 /nfs/dbraw/zinc/45/20/29/940452029.db2.gz NMDALROAVOZEHN-UHFFFAOYSA-N 0 0 368.345 3.924 20 5 FHBDRN COC(=O)c1ccc(Oc2ncnc3cc(Cl)ccc32)cc1[N+](=O)[O-] ZINC000613114308 940453880 /nfs/dbraw/zinc/45/38/80/940453880.db2.gz WHFNHIAALQWMCI-UHFFFAOYSA-N 0 0 359.725 3.770 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)NCC(C)(C)Oc1ccccc1 ZINC000511431090 940458763 /nfs/dbraw/zinc/45/87/63/940458763.db2.gz ZBYSOZKRAUGSIY-UHFFFAOYSA-N 0 0 371.437 3.636 20 5 FHBDRN Cc1nc2cc(CNC(=O)c3cc([N+](=O)[O-])ccc3C)ccc2n1C1CC1 ZINC000580349593 940473604 /nfs/dbraw/zinc/47/36/04/940473604.db2.gz KQLFYDNEPDGARP-UHFFFAOYSA-N 0 0 364.405 3.826 20 5 FHBDRN Cc1c(CC(=O)N[C@@H](C)c2cccc(OC(F)F)c2)cccc1[N+](=O)[O-] ZINC000161715642 940475832 /nfs/dbraw/zinc/47/58/32/940475832.db2.gz DHPTUCNIACEFRY-LBPRGKRZSA-N 0 0 364.348 3.925 20 5 FHBDRN C[C@]1(C(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)C[C@@H]1c1ccccc1 ZINC000580526697 940478508 /nfs/dbraw/zinc/47/85/08/940478508.db2.gz QGDATNOQHZBZNE-NQIIRXRSSA-N 0 0 363.417 3.929 20 5 FHBDRN CC(C)(C)C[C@@H](NC(=O)CCNc1ccccc1[N+](=O)[O-])C(F)(F)F ZINC000540899218 940479168 /nfs/dbraw/zinc/47/91/68/940479168.db2.gz HZTNSUMPZXUATF-CYBMUJFWSA-N 0 0 361.364 3.880 20 5 FHBDRN COc1cccc(-c2nc(COc3ccc(Cl)cc3)no2)c1[N+](=O)[O-] ZINC000580629152 940480976 /nfs/dbraw/zinc/48/09/76/940480976.db2.gz HIGHRMVBZCXWEX-UHFFFAOYSA-N 0 0 361.741 3.886 20 5 FHBDRN CCn1c(C)nc([N+](=O)[O-])c1NCCc1cccc(OCC(F)(F)F)c1 ZINC000580672951 940481860 /nfs/dbraw/zinc/48/18/60/940481860.db2.gz UCKAPSNWWNYDGG-UHFFFAOYSA-N 0 0 372.347 3.715 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CCO[C@@H](c3ccccc3)C2)c1 ZINC000549005328 940484102 /nfs/dbraw/zinc/48/41/02/940484102.db2.gz BBMNPHHWNKJEGA-HNAYVOBHSA-N 0 0 370.405 3.644 20 5 FHBDRN CCSc1cccc(NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000580770325 940485291 /nfs/dbraw/zinc/48/52/91/940485291.db2.gz YJBUPNDZXCIXIJ-UHFFFAOYSA-N 0 0 366.464 3.593 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2nc3cc(F)ccc3n2CC)c1 ZINC000549007649 940486382 /nfs/dbraw/zinc/48/63/82/940486382.db2.gz URAYUQHZEXQIEI-UHFFFAOYSA-N 0 0 372.356 3.755 20 5 FHBDRN CCn1ncc2ccc(NC(=O)Cc3c[nH]c4ccc([N+](=O)[O-])cc34)cc21 ZINC000120113112 940487591 /nfs/dbraw/zinc/48/75/91/940487591.db2.gz NSBFWACRDNZAFP-UHFFFAOYSA-N 0 0 363.377 3.627 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1)CN(Cc1sccc1Br)CCO2 ZINC000580803150 940487744 /nfs/dbraw/zinc/48/77/44/940487744.db2.gz KCILMHTVGOAXJU-UHFFFAOYSA-N 0 0 369.240 3.813 20 5 FHBDRN COc1ccc(CC(=O)N(C)Cc2ccc(F)c(Cl)c2)cc1[N+](=O)[O-] ZINC000580926817 940489195 /nfs/dbraw/zinc/48/91/95/940489195.db2.gz OAZZCFZYZQIZRT-UHFFFAOYSA-N 0 0 366.776 3.597 20 5 FHBDRN CN(CC(=O)N1CC(C)(C)[C@H]1c1cccs1)c1ccccc1[N+](=O)[O-] ZINC000581032591 940490504 /nfs/dbraw/zinc/49/05/04/940490504.db2.gz YUNJVWLXVLNMHF-QGZVFWFLSA-N 0 0 359.451 3.702 20 5 FHBDRN CCOc1cc(CCO)ccc1OCc1c(Cl)cccc1[N+](=O)[O-] ZINC000580973757 940491235 /nfs/dbraw/zinc/49/12/35/940491235.db2.gz CHOZPZALCDHCDM-UHFFFAOYSA-N 0 0 351.786 3.761 20 5 FHBDRN O=C(Nc1nc2c(s1)CSCC2)c1c[nH]c2cc([N+](=O)[O-])ccc21 ZINC000581088308 940493401 /nfs/dbraw/zinc/49/34/01/940493401.db2.gz APAUIMAJXZVJTJ-UHFFFAOYSA-N 0 0 360.420 3.574 20 5 FHBDRN O=[N+]([O-])c1c(N[C@H]2CCCN(CC(F)(F)F)C2)ccc2ncccc21 ZINC000581064594 940494633 /nfs/dbraw/zinc/49/46/33/940494633.db2.gz OFQUGZDMZIENIP-NSHDSACASA-N 0 0 354.332 3.582 20 5 FHBDRN CCOc1cc(C(=O)N(C)C[C@@H](C)c2ccccc2)c([N+](=O)[O-])cc1OC ZINC000066459545 940494852 /nfs/dbraw/zinc/49/48/52/940494852.db2.gz DJKPVGALQYSXBQ-CQSZACIVSA-N 0 0 372.421 3.878 20 5 FHBDRN O=C(N1CCc2ccc([N+](=O)[O-])cc21)C1(CCOCc2ccccc2)CC1 ZINC000472532724 940497250 /nfs/dbraw/zinc/49/72/50/940497250.db2.gz KGTXQLHUNVXJEO-UHFFFAOYSA-N 0 0 366.417 3.871 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N[C@H]1c2ccc(F)cc2O[C@@H]1C ZINC000581335180 940499683 /nfs/dbraw/zinc/49/96/83/940499683.db2.gz AJJGLJFVURREOY-JDNHERCYSA-N 0 0 364.760 3.948 20 5 FHBDRN CN(Cc1ccc(Br)cc1)C(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000172942006 940505735 /nfs/dbraw/zinc/50/57/35/940505735.db2.gz PFMDWCHVXGCYQL-UHFFFAOYSA-N 0 0 363.211 3.558 20 5 FHBDRN CC[C@@H](c1cccc(OC)c1)N(C)C(=O)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000581508537 940507727 /nfs/dbraw/zinc/50/77/27/940507727.db2.gz SCOMNTDHXLARGM-KRWDZBQOSA-N 0 0 372.421 3.764 20 5 FHBDRN O=C1OC(c2cccnc2)=N/C1=C\c1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000178015210 940509823 /nfs/dbraw/zinc/50/98/23/940509823.db2.gz YWHBQASCGMXWEF-YBEGLDIGSA-N 0 0 361.313 3.594 20 5 FHBDRN CCOCc1ccc(NC(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)cc1 ZINC000124875123 945330874 /nfs/dbraw/zinc/33/08/74/945330874.db2.gz GQYAPDFIUIZYBX-UHFFFAOYSA-N 0 0 355.394 3.722 20 5 FHBDRN C[C@H](Sc1ccccc1Cl)C(=O)N(C)c1ccc([N+](=O)[O-])nc1 ZINC000581690239 940589129 /nfs/dbraw/zinc/58/91/29/940589129.db2.gz ARINOZHILCMOLU-JTQLQIEISA-N 0 0 351.815 3.787 20 5 FHBDRN CC(C)(C)OC(=O)Nc1ccc(NC(=O)c2ccc([N+](=O)[O-])s2)cn1 ZINC000066510968 940592379 /nfs/dbraw/zinc/59/23/79/940592379.db2.gz CMNUBLFJQNVGKH-UHFFFAOYSA-N 0 0 364.383 3.651 20 5 FHBDRN CCNc1ccc(C(=O)N[C@H](CC)c2nc3ccccc3[nH]2)cc1[N+](=O)[O-] ZINC000066523818 940598397 /nfs/dbraw/zinc/59/83/97/940598397.db2.gz XAYGJGITMCKYMW-CYBMUJFWSA-N 0 0 367.409 3.784 20 5 FHBDRN COc1cc(C(=O)NCc2ccc(-c3csc(C)n3)o2)ccc1[N+](=O)[O-] ZINC000511487715 940622780 /nfs/dbraw/zinc/62/27/80/940622780.db2.gz CPKLMJJANJAXOT-UHFFFAOYSA-N 0 0 373.390 3.558 20 5 FHBDRN COc1ccc(OCCN(Cc2ccco2)Cc2ccco2)c([N+](=O)[O-])c1 ZINC000173441757 940623523 /nfs/dbraw/zinc/62/35/23/940623523.db2.gz HTIBNFDQYFCQHQ-UHFFFAOYSA-N 0 0 372.377 3.871 20 5 FHBDRN COc1ccc2c(c1)C[C@@H](C)N(C(=O)c1ccc([N+](=O)[O-])cc1OC)[C@@H]2C ZINC000427391336 945335196 /nfs/dbraw/zinc/33/51/96/945335196.db2.gz QEDRVSAKWFHEQP-CHWSQXEVSA-N 0 0 370.405 3.760 20 5 FHBDRN CCc1ccc([C@H]2CCN(C(=O)NCc3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000431812158 940627642 /nfs/dbraw/zinc/62/76/42/940627642.db2.gz MRUDUKPGPRWIOK-SFHVURJKSA-N 0 0 353.422 3.856 20 5 FHBDRN Cc1ccc([C@H]2C[C@H](C)CCN2C(=O)COc2cccc([N+](=O)[O-])c2)o1 ZINC000173574842 940637531 /nfs/dbraw/zinc/63/75/31/940637531.db2.gz WMBBFHCHKDRHAE-CXAGYDPISA-N 0 0 358.394 3.875 20 5 FHBDRN CCOc1cc(NC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)ccc1OC ZINC000047582402 945336724 /nfs/dbraw/zinc/33/67/24/945336724.db2.gz REGVEHPFRNGRCE-LBPRGKRZSA-N 0 0 359.382 3.885 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)NCc1coc2ccccc12 ZINC000511496312 940642189 /nfs/dbraw/zinc/64/21/89/940642189.db2.gz DMGWXIDZAYHIJB-UHFFFAOYSA-N 0 0 353.378 3.725 20 5 FHBDRN CC(=O)[C@@H]1C[C@H](C(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)C1(C)C ZINC000582044604 940644359 /nfs/dbraw/zinc/64/43/59/940644359.db2.gz CXMMFOMEIRZTBL-BPQIPLTHSA-N 0 0 358.438 3.552 20 5 FHBDRN C/C(=C\c1ccccc1)CN(C)c1cc2nc[nH]c(=O)c2cc1[N+](=O)[O-] ZINC000582157743 940651478 /nfs/dbraw/zinc/65/14/78/940651478.db2.gz MDEXKELJBKKOHD-MDWZMJQESA-N 0 0 350.378 3.783 20 5 FHBDRN CC[C@@]1(CNC(=O)c2ccc(C)c([N+](=O)[O-])c2)OCCc2ccccc21 ZINC000582093701 940652902 /nfs/dbraw/zinc/65/29/02/940652902.db2.gz BEMXEYGWRAJDSS-FQEVSTJZSA-N 0 0 354.406 3.511 20 5 FHBDRN COc1cc(CN2CC[C@@H](Oc3cccc(F)c3)C2)c([N+](=O)[O-])cc1F ZINC000613384129 940659279 /nfs/dbraw/zinc/65/92/79/940659279.db2.gz ZODYGZJHYBOZPY-OAHLLOKOSA-N 0 0 364.348 3.535 20 5 FHBDRN O=[N+]([O-])c1ccc(N[C@@H]2CCCN(CC(F)(F)F)C2)c2ncccc12 ZINC000582452061 940672308 /nfs/dbraw/zinc/67/23/08/940672308.db2.gz ROXSFNJYPWCLND-LLVKDONJSA-N 0 0 354.332 3.582 20 5 FHBDRN O=C(N[C@@H](C1CC1)C(F)(F)F)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000290184187 940677025 /nfs/dbraw/zinc/67/70/25/940677025.db2.gz SNFPDBTYEFXLLL-JTQLQIEISA-N 0 0 356.222 3.684 20 5 FHBDRN C[C@@H](N[C@@H](c1cnn(C)c1)c1ccc(F)cc1)c1ccccc1[N+](=O)[O-] ZINC000480670310 940701851 /nfs/dbraw/zinc/70/18/51/940701851.db2.gz DFVKNXPFGLKRSP-BFUOFWGJSA-N 0 0 354.385 3.908 20 5 FHBDRN Cc1cc(C(=O)Nc2ccc(Br)cc2F)c(N)c([N+](=O)[O-])c1 ZINC000178146537 940716811 /nfs/dbraw/zinc/71/68/11/940716811.db2.gz QSZZGIKBJTXAJT-UHFFFAOYSA-N 0 0 368.162 3.639 20 5 FHBDRN CC[C@@H](N[C@@H](C)c1ncc(Br)cn1)c1cccc([N+](=O)[O-])c1 ZINC000582596351 940754049 /nfs/dbraw/zinc/75/40/49/940754049.db2.gz IJWUUYBOGORHCE-IINYFYTJSA-N 0 0 365.231 3.949 20 5 FHBDRN CC(C)[C@H]1C[C@]([NH2+]Cc2cccc([N+](=O)[O-])c2)(C(=O)[O-])c2ccccc21 ZINC000582621657 940760391 /nfs/dbraw/zinc/76/03/91/940760391.db2.gz OBMGICPJRQPHAP-YLJYHZDGSA-N 0 0 354.406 3.808 20 5 FHBDRN Cc1ccc(-c2noc(-c3cncc([N+](=O)[O-])c3)n2)cc1Br ZINC001213821962 940763583 /nfs/dbraw/zinc/76/35/83/940763583.db2.gz NRSUJRNSSDQRRC-UHFFFAOYSA-N 0 0 361.155 3.778 20 5 FHBDRN Cc1c(CC(=O)N[C@H]2C[C@H]2c2c(F)cccc2Cl)cccc1[N+](=O)[O-] ZINC000124902950 945346949 /nfs/dbraw/zinc/34/69/49/945346949.db2.gz QBKZHBZHBKZYOE-DOMZBBRYSA-N 0 0 362.788 3.911 20 5 FHBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)NCC1(C2CC2)CC1 ZINC000582679859 940801391 /nfs/dbraw/zinc/80/13/91/940801391.db2.gz UYTFPINZUKCNBJ-UHFFFAOYSA-N 0 0 353.216 3.586 20 5 FHBDRN CC(C)NC(=O)Nc1ccccc1NC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000584506721 940807365 /nfs/dbraw/zinc/80/73/65/940807365.db2.gz NWZSAKCSBKMSSY-ZDUSSCGKSA-N 0 0 370.409 3.867 20 5 FHBDRN CCn1c(-c2cccc([N+](=O)[O-])c2)nnc1N(C)Cc1cccc(C)c1 ZINC000549044356 940829815 /nfs/dbraw/zinc/82/98/15/940829815.db2.gz KCIDOWLSIPZBCU-UHFFFAOYSA-N 0 0 351.410 3.818 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)CNc1cccc(-c2ncco2)c1C ZINC000427429904 945352023 /nfs/dbraw/zinc/35/20/23/945352023.db2.gz WUFPFMSEPXEHDI-UHFFFAOYSA-N 0 0 366.377 3.917 20 5 FHBDRN CCS[C@@H]1CCCC[C@@H]1NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000175257092 940832493 /nfs/dbraw/zinc/83/24/93/940832493.db2.gz OVOZGLNLOGSSNG-DLBZAZTESA-N 0 0 374.466 3.575 20 5 FHBDRN CC(C)[C@H](CNC(=O)CSc1ccc([N+](=O)[O-])cc1)c1cccnc1 ZINC000175258715 940833122 /nfs/dbraw/zinc/83/31/22/940833122.db2.gz SMFHEUIYIPWBPP-KRWDZBQOSA-N 0 0 359.451 3.638 20 5 FHBDRN O=C(NCc1cccc([N+](=O)[O-])c1)N1CCC[C@H]1/C=C\c1ccccc1 ZINC000540941793 940834913 /nfs/dbraw/zinc/83/49/13/940834913.db2.gz IGTIFKDCQDYQAQ-JYBLJSLWSA-N 0 0 351.406 3.982 20 5 FHBDRN CC(C)Oc1ccc(CNC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)cn1 ZINC000175384618 940858860 /nfs/dbraw/zinc/85/88/60/940858860.db2.gz VKJMMKCXSIXRDZ-UHFFFAOYSA-N 0 0 372.425 3.512 20 5 FHBDRN Cc1nc(-c2cccc(NC(=O)N[C@@H](C)c3cccc([N+](=O)[O-])c3)c2)n[nH]1 ZINC000170878288 940875947 /nfs/dbraw/zinc/87/59/47/940875947.db2.gz WBMZLHAMLZRSHR-NSHDSACASA-N 0 0 366.381 3.571 20 5 FHBDRN Cc1ccc(CCCC(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)s1 ZINC000175524726 940877140 /nfs/dbraw/zinc/87/71/40/940877140.db2.gz OYSUCUNBZNMZLZ-UHFFFAOYSA-N 0 0 373.478 3.636 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)Nc2ccccc2C(=O)N(C)C(C)C)c1C ZINC000892593888 940883101 /nfs/dbraw/zinc/88/31/01/940883101.db2.gz ZULAFUNXSHJEIK-UHFFFAOYSA-N 0 0 369.421 3.944 20 5 FHBDRN CC(C)c1cc(CNC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)on1 ZINC000122111704 940906955 /nfs/dbraw/zinc/90/69/55/940906955.db2.gz VUCDVCDZUOICJN-UHFFFAOYSA-N 0 0 358.398 3.580 20 5 FHBDRN O=[N+]([O-])c1cc2c(ncnc2N2CCC3(CC2)OCc2ccccc23)s1 ZINC000376402625 940924183 /nfs/dbraw/zinc/92/41/83/940924183.db2.gz JTUFRBCDWXPZAK-UHFFFAOYSA-N 0 0 368.418 3.625 20 5 FHBDRN O=C(N[C@@H](c1nccs1)C(F)(F)F)c1ccc([N+](=O)[O-])cc1Cl ZINC000507602018 945363508 /nfs/dbraw/zinc/36/35/08/945363508.db2.gz NVLVNVDCJVGODV-VIFPVBQESA-N 0 0 365.720 3.738 20 5 FHBDRN CC(=O)c1cc(N2CCO[C@H](c3ccc(F)cc3F)C2)ccc1[N+](=O)[O-] ZINC000376419833 940963746 /nfs/dbraw/zinc/96/37/46/940963746.db2.gz IJYHRRPRPPSYRP-SFHVURJKSA-N 0 0 362.332 3.654 20 5 FHBDRN Cc1cc(Cc2noc([C@@H]3CCCCN3C(=O)C(C)C)n2)ccc1[N+](=O)[O-] ZINC000290198063 940968783 /nfs/dbraw/zinc/96/87/83/940968783.db2.gz XCLXQCZXZYLSEO-INIZCTEOSA-N 0 0 372.425 3.587 20 5 FHBDRN COC(=O)c1cc(C)nc(N2CC(C)(C)[C@@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000587439368 940969495 /nfs/dbraw/zinc/96/94/95/940969495.db2.gz YODRPUPLDITKKI-INIZCTEOSA-N 0 0 355.394 3.672 20 5 FHBDRN COC(=O)c1cc(C(=O)N[C@@H]2CCC[C@H]2CCC(C)C)cc([N+](=O)[O-])c1 ZINC001125823991 940971608 /nfs/dbraw/zinc/97/16/08/940971608.db2.gz OBLAJQBMMBWGSM-SUMWQHHRSA-N 0 0 362.426 3.716 20 5 FHBDRN C[C@H](CC(=O)c1ccc(Cl)cc1)C(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000186274090 940972830 /nfs/dbraw/zinc/97/28/30/940972830.db2.gz JMCRKTYSQJMYEL-GFCCVEGCSA-N 0 0 360.797 3.774 20 5 FHBDRN C[C@H](NCc1nc(-c2ccc(F)c(F)c2)no1)c1cccc([N+](=O)[O-])c1 ZINC000180407504 941005687 /nfs/dbraw/zinc/00/56/87/941005687.db2.gz WBUQKLNPBRWMFJ-JTQLQIEISA-N 0 0 360.320 3.774 20 5 FHBDRN COc1ccc(-c2noc(CN[C@H](C)c3cccc([N+](=O)[O-])c3)n2)cc1 ZINC000180443000 941014924 /nfs/dbraw/zinc/01/49/24/941014924.db2.gz BHCQRMIMNIQBHR-GFCCVEGCSA-N 0 0 354.366 3.504 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)ccc1Oc1ccc(CNc2cccnn2)cc1 ZINC000472592807 941016976 /nfs/dbraw/zinc/01/69/76/941016976.db2.gz XMJAUKNNNWIVJH-UHFFFAOYSA-N 0 0 356.769 3.865 20 5 FHBDRN Cc1ccc2c(n1)OCCN2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000180446169 941017744 /nfs/dbraw/zinc/01/77/44/941017744.db2.gz HJHYHMDGFCCGRH-UHFFFAOYSA-N 0 0 355.375 3.552 20 5 FHBDRN CCCn1cc(C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)cn1 ZINC000180485222 941028152 /nfs/dbraw/zinc/02/81/52/941028152.db2.gz KWXWGFCPZJQCFX-UHFFFAOYSA-N 0 0 357.395 3.577 20 5 FHBDRN CSc1cccc(C(=O)NCCc2cc(C)c(O)c(C)c2)c1[N+](=O)[O-] ZINC000188704410 941028345 /nfs/dbraw/zinc/02/83/45/941028345.db2.gz VNEWEFLAVBMNMN-UHFFFAOYSA-N 0 0 360.435 3.612 20 5 FHBDRN C[C@@H](c1nnc(-c2ccc(Cl)cc2Cl)o1)n1cc([N+](=O)[O-])cn1 ZINC000180505878 941034964 /nfs/dbraw/zinc/03/49/64/941034964.db2.gz SJABOTDZSCWEJN-ZETCQYMHSA-N 0 0 354.153 3.757 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC(C)(C)OC1(C)C ZINC000180535477 941040360 /nfs/dbraw/zinc/04/03/60/941040360.db2.gz HDFZMOARLRKFHI-CQSZACIVSA-N 0 0 352.456 3.783 20 5 FHBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1OC(=O)c1cccc(Br)n1 ZINC000180535455 941040738 /nfs/dbraw/zinc/04/07/38/941040738.db2.gz RZSQYDSWRPFPHQ-UHFFFAOYSA-N 0 0 371.574 3.933 20 5 FHBDRN C[C@@H]1C[C@@H]1[C@@H](NC(=O)Nc1ccncc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000540979396 941042787 /nfs/dbraw/zinc/04/27/87/941042787.db2.gz NATSZKWWRXRJTP-HICWGWBUSA-N 0 0 360.801 3.584 20 5 FHBDRN CS[C@@H]1CCC[C@@H](NC(=O)c2cccc([N+](=O)[O-])c2Br)C1 ZINC000180568161 941044041 /nfs/dbraw/zinc/04/40/41/941044041.db2.gz KGZLOQNLIJSQBE-NXEZZACHSA-N 0 0 373.272 3.761 20 5 FHBDRN CC(=O)c1cc(N[C@@H](c2cnn(C)c2)c2ccc(F)cc2)ccc1[N+](=O)[O-] ZINC000376458699 941051606 /nfs/dbraw/zinc/05/16/06/941051606.db2.gz BECSWJSKHPOBCY-LJQANCHMSA-N 0 0 368.368 3.872 20 5 FHBDRN CC(C)(NC(=O)[C@@H]1SCCc2ccccc21)c1ccc([N+](=O)[O-])cc1 ZINC000176497051 941055344 /nfs/dbraw/zinc/05/53/44/941055344.db2.gz RFSSJQOQBLIVFP-QGZVFWFLSA-N 0 0 356.447 3.977 20 5 FHBDRN CCc1cc(NC(=O)C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)ccc1C ZINC000180617214 941055500 /nfs/dbraw/zinc/05/55/00/941055500.db2.gz CTIVXUSBMKFGKX-CQSZACIVSA-N 0 0 369.421 3.590 20 5 FHBDRN CCCn1nccc1C1CCN(c2ccc([N+](=O)[O-])c(C(C)=O)c2)CC1 ZINC000376468978 941060248 /nfs/dbraw/zinc/06/02/48/941060248.db2.gz XNPGBIVFRZCGMZ-UHFFFAOYSA-N 0 0 356.426 3.788 20 5 FHBDRN Cc1c(OC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cccc1[N+](=O)[O-] ZINC000120134327 941071079 /nfs/dbraw/zinc/07/10/79/941071079.db2.gz SIKJKXFXWGJQHS-AWEZNQCLSA-N 0 0 374.418 3.565 20 5 FHBDRN COc1ccc2nc(C(=O)Nc3ccc4cc([N+](=O)[O-])ccc4n3)ccc2c1 ZINC000176698914 941071865 /nfs/dbraw/zinc/07/18/65/941071865.db2.gz GREBHYMXPGHULI-UHFFFAOYSA-N 0 0 374.356 3.952 20 5 FHBDRN CC(C)[C@@H](c1ccccc1)N(C)C(=O)C(=O)Nc1cc(F)cc([N+](=O)[O-])c1 ZINC000472603123 941073841 /nfs/dbraw/zinc/07/38/41/941073841.db2.gz SHHVACFVCZPLSB-KRWDZBQOSA-N 0 0 373.384 3.528 20 5 FHBDRN O=C(c1cc2c(c([N+](=O)[O-])c1)OCO2)N1CCC[C@@H]1CCc1ccccc1 ZINC000180776516 941074772 /nfs/dbraw/zinc/07/47/72/941074772.db2.gz SVINFTLLGAFPMJ-MRXNPFEDSA-N 0 0 368.389 3.561 20 5 FHBDRN CCC(CC)[C@@H]1C[C@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)CCO1 ZINC000180823061 941081292 /nfs/dbraw/zinc/08/12/92/941081292.db2.gz QJYFZTKCMUAVOE-PBHICJAKSA-N 0 0 368.861 3.891 20 5 FHBDRN C[C@@H](NC(=O)c1c(N)cccc1[N+](=O)[O-])c1ccc(-c2cccnc2)cc1 ZINC000180840771 941084350 /nfs/dbraw/zinc/08/43/50/941084350.db2.gz WQFRFKBHYSIJAE-CYBMUJFWSA-N 0 0 362.389 3.730 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)NC(C)(C)c2ccc(F)c(F)c2)c1 ZINC000176902255 941085122 /nfs/dbraw/zinc/08/51/22/941085122.db2.gz BXQKGEMKYQBGOZ-UHFFFAOYSA-N 0 0 350.321 3.547 20 5 FHBDRN Cc1ccccc1-n1cnnc1SCc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000176929125 941085335 /nfs/dbraw/zinc/08/53/35/941085335.db2.gz LLGDFQFHTQUSOP-UHFFFAOYSA-N 0 0 367.390 3.917 20 5 FHBDRN CCCn1cc(C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)c(C)s2)cn1 ZINC000180888203 941088433 /nfs/dbraw/zinc/08/84/33/941088433.db2.gz CGJNKYSMARVMPQ-UHFFFAOYSA-N 0 0 371.422 3.886 20 5 FHBDRN CSc1cc(C)ccc1NS(=O)(=O)CCc1ccccc1[N+](=O)[O-] ZINC000414393226 941088874 /nfs/dbraw/zinc/08/88/74/941088874.db2.gz HGCZVKIBABHXJQ-UHFFFAOYSA-N 0 0 366.464 3.610 20 5 FHBDRN CCn1c(NC(=O)c2csc([N+](=O)[O-])c2)nc2cc(Cl)ccc21 ZINC000180904142 941091913 /nfs/dbraw/zinc/09/19/13/941091913.db2.gz YFJGPAOCXHFGKB-UHFFFAOYSA-N 0 0 350.787 3.932 20 5 FHBDRN Cc1ccc(C)c([C@H](C)N(C)C(=O)C(=O)Nc2cc(F)cc([N+](=O)[O-])c2)c1 ZINC000472609267 941092361 /nfs/dbraw/zinc/09/23/61/941092361.db2.gz QBVWABDLWFQQGZ-ZDUSSCGKSA-N 0 0 373.384 3.509 20 5 FHBDRN CCS[C@H]1CCCC[C@@H]1NC(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000511512473 941093972 /nfs/dbraw/zinc/09/39/72/941093972.db2.gz LBTVUELSEKZKKS-IRXDYDNUSA-N 0 0 365.499 3.843 20 5 FHBDRN COc1ccc(C(=O)N2C[C@@H](c3ccccc3)C(C)(C)C2)cc1[N+](=O)[O-] ZINC000122160839 941094631 /nfs/dbraw/zinc/09/46/31/941094631.db2.gz OJIRPNBTPYLVRQ-INIZCTEOSA-N 0 0 354.406 3.869 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[C@]2(C1)OCc1ccccc12 ZINC000188823706 941096616 /nfs/dbraw/zinc/09/66/16/941096616.db2.gz TUUSTHDQTHCSDI-LJQANCHMSA-N 0 0 353.378 3.567 20 5 FHBDRN Cc1nc(NC(=O)c2csc(Cc3cccc(F)c3)n2)ccc1[N+](=O)[O-] ZINC000180984200 941099476 /nfs/dbraw/zinc/09/94/76/941099476.db2.gz OBQSVQOPQOWGNC-UHFFFAOYSA-N 0 0 372.381 3.737 20 5 FHBDRN CO[C@H](CNC(=O)c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1)C1CC1 ZINC000511512272 941099814 /nfs/dbraw/zinc/09/98/14/941099814.db2.gz BKQTZGJRHHENIH-GOSISDBHSA-N 0 0 372.446 3.901 20 5 FHBDRN Cc1c(Br)cccc1NC(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000181018212 941103919 /nfs/dbraw/zinc/10/39/19/941103919.db2.gz WRBWXXFKHRGHHB-UHFFFAOYSA-N 0 0 350.172 3.500 20 5 FHBDRN C[C@H](NC(=O)c1c(N)cccc1[N+](=O)[O-])c1cccc(OC(F)(F)F)c1 ZINC000181177227 941112006 /nfs/dbraw/zinc/11/20/06/941112006.db2.gz IIBJUZAYYMKEJE-VIFPVBQESA-N 0 0 369.299 3.567 20 5 FHBDRN Nc1cccc([N+](=O)[O-])c1C(=O)Nc1cccc(CCC(F)(F)F)c1 ZINC000181176634 941112111 /nfs/dbraw/zinc/11/21/11/941112111.db2.gz FRDYWKLRJDFSLL-UHFFFAOYSA-N 0 0 353.300 3.924 20 5 FHBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)[C@@H]1CCc2c1cccc2Cl ZINC000414413354 941114311 /nfs/dbraw/zinc/11/43/11/941114311.db2.gz KJEKYZOBWUJFJY-MRXNPFEDSA-N 0 0 351.811 3.851 20 5 FHBDRN C[C@H](NC(=O)c1ccccc1[N+](=O)[O-])c1cccc(OC(F)(F)F)c1 ZINC000177322378 941116885 /nfs/dbraw/zinc/11/68/85/941116885.db2.gz IVXKPBKFYSQTJW-JTQLQIEISA-N 0 0 354.284 3.984 20 5 FHBDRN Cc1ccc(C(F)(F)F)cc1NC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000181288836 941120101 /nfs/dbraw/zinc/12/01/01/941120101.db2.gz OWBHTBRNGWJLLO-UHFFFAOYSA-N 0 0 368.267 3.903 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1c2ccccc2SC[C@H]1C ZINC000177394396 941120891 /nfs/dbraw/zinc/12/08/91/941120891.db2.gz IVNPFJGEWUNLGT-GFCCVEGCSA-N 0 0 364.448 3.593 20 5 FHBDRN COc1cc(C(=O)N2CCCc3cc(F)c(F)cc32)cc([N+](=O)[O-])c1C ZINC000188923629 941131132 /nfs/dbraw/zinc/13/11/32/941131132.db2.gz CCJLUJTWMPAAPF-UHFFFAOYSA-N 0 0 362.332 3.783 20 5 FHBDRN COc1cc(CS(=O)(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)ccc1Cl ZINC000414429859 941136656 /nfs/dbraw/zinc/13/66/56/941136656.db2.gz VKSWFHIYTBPCAB-NSHDSACASA-N 0 0 369.826 3.933 20 5 FHBDRN COc1cc(C(=O)Nc2cccc(-c3nccn3C)c2)cc([N+](=O)[O-])c1C ZINC000189005594 941143137 /nfs/dbraw/zinc/14/31/37/941143137.db2.gz OHXGRAHXOQIGTH-UHFFFAOYSA-N 0 0 366.377 3.565 20 5 FHBDRN C[C@H](NC(=O)N1CCOC2(C1)CCCCCC2)c1cccc([N+](=O)[O-])c1 ZINC000177805071 941150765 /nfs/dbraw/zinc/15/07/65/941150765.db2.gz BZTFCIACXKENQR-HNNXBMFYSA-N 0 0 361.442 3.791 20 5 FHBDRN COc1ccc(F)cc1CNCc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000189208103 941153247 /nfs/dbraw/zinc/15/32/47/941153247.db2.gz NLEOOKVKZHYVKV-UHFFFAOYSA-N 0 0 356.300 3.634 20 5 FHBDRN CCc1n[nH]c(C(=O)N[C@H](C)c2cc(Cl)ccc2Cl)c1[N+](=O)[O-] ZINC000189313581 941155908 /nfs/dbraw/zinc/15/59/08/941155908.db2.gz JRJPQJKVXWIRGA-SSDOTTSWSA-N 0 0 357.197 3.678 20 5 FHBDRN Cc1ccc(Br)c(C(=O)N(C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000178045300 941157669 /nfs/dbraw/zinc/15/76/69/941157669.db2.gz DLKXLBZXAMQKTO-UHFFFAOYSA-N 0 0 363.211 3.938 20 5 FHBDRN CCOCCC1(CNC(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)CCCC1 ZINC000189373841 941157692 /nfs/dbraw/zinc/15/76/92/941157692.db2.gz FJFLHEPMTXVVDE-UHFFFAOYSA-N 0 0 364.442 3.629 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cn1)N1CCC(c2c[nH]c3ccc(F)cc32)CC1 ZINC000376569843 941157699 /nfs/dbraw/zinc/15/76/99/941157699.db2.gz QMPKMWDZWQJEKC-UHFFFAOYSA-N 0 0 368.368 3.630 20 5 FHBDRN COc1cc(C(=O)Nc2cc(C3CCCCC3)nn2C)cc([N+](=O)[O-])c1C ZINC000189474955 941158672 /nfs/dbraw/zinc/15/86/72/941158672.db2.gz PZDQXXLOIPUFCU-UHFFFAOYSA-N 0 0 372.425 3.945 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)NCCc1ccccc1OC(F)F ZINC000189435449 941159804 /nfs/dbraw/zinc/15/98/04/941159804.db2.gz ADGFDMQOWBGLDN-UHFFFAOYSA-N 0 0 365.336 3.869 20 5 FHBDRN Cc1nn(-c2ccccc2)cc1NC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000181419624 941161564 /nfs/dbraw/zinc/16/15/64/941161564.db2.gz HHQFUFPJAVCLBJ-UHFFFAOYSA-N 0 0 356.769 3.995 20 5 FHBDRN COc1ccc(NC(=O)[C@H](C)Nc2cccc3ccn(C)c32)c([N+](=O)[O-])c1 ZINC000189585245 941166002 /nfs/dbraw/zinc/16/60/02/941166002.db2.gz GLPUTCRJXYAVKL-LBPRGKRZSA-N 0 0 368.393 3.534 20 5 FHBDRN COc1cnccc1[C@@H](C)NC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000189612574 941221788 /nfs/dbraw/zinc/22/17/88/941221788.db2.gz UAIBOSPEAOXKHQ-SECBINFHSA-N 0 0 369.299 3.508 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1Br)N1C[C@@H]2CCCC[C@@H]2C1 ZINC000178351096 941234268 /nfs/dbraw/zinc/23/42/68/941234268.db2.gz YDJBSDYDYFDZMO-PHIMTYICSA-N 0 0 353.216 3.620 20 5 FHBDRN O=C(c1cc(Cl)ccc1[N+](=O)[O-])N1CC2(CCOCC2)c2ccccc21 ZINC000189792135 941280894 /nfs/dbraw/zinc/28/08/94/941280894.db2.gz WHSDOJCNHQLPSM-UHFFFAOYSA-N 0 0 372.808 3.957 20 5 FHBDRN COC[C@@H](C)n1ccc(NCc2csc(-c3cccc([N+](=O)[O-])c3)n2)n1 ZINC000189852391 941290656 /nfs/dbraw/zinc/29/06/56/941290656.db2.gz XCEVHDHMGJKQIU-GFCCVEGCSA-N 0 0 373.438 3.734 20 5 FHBDRN C[C@H](SCc1ccc([N+](=O)[O-])cc1)c1ccc(S(C)(=O)=O)cc1 ZINC000189865505 941294281 /nfs/dbraw/zinc/29/42/81/941294281.db2.gz LHPSFQIBGBCRKJ-LBPRGKRZSA-N 0 0 351.449 3.993 20 5 FHBDRN Cn1nccc1[C@@H]1CCCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1 ZINC000376601486 941309311 /nfs/dbraw/zinc/30/93/11/941309311.db2.gz ZZIJOJARTXNNKA-GFCCVEGCSA-N 0 0 370.434 3.563 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1F)N(Cc1c(F)cccc1F)C1CC1 ZINC000190008087 941339767 /nfs/dbraw/zinc/33/97/67/941339767.db2.gz FNDKJOKMTBOVKR-UHFFFAOYSA-N 0 0 350.296 3.817 20 5 FHBDRN Cc1nc(Br)ccc1NC(=O)c1cccc(Cl)c1[N+](=O)[O-] ZINC000180701088 941357410 /nfs/dbraw/zinc/35/74/10/941357410.db2.gz FBJUBSLDOAAALF-UHFFFAOYSA-N 0 0 370.590 3.966 20 5 FHBDRN Cc1ccc(C(=O)OCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1Cl ZINC000728675834 941364851 /nfs/dbraw/zinc/36/48/51/941364851.db2.gz UXFUXENJVLLDQR-UHFFFAOYSA-N 0 0 373.752 3.964 20 5 FHBDRN C[C@@H](NC(=O)N1CCC(F)(c2cccnc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000376715247 941387846 /nfs/dbraw/zinc/38/78/46/941387846.db2.gz ITWKAGSWHWJSEF-CQSZACIVSA-N 0 0 372.400 3.721 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC(c2cccc(N)c2)CC1 ZINC000414648883 941424666 /nfs/dbraw/zinc/42/46/66/941424666.db2.gz BSKGPAFAQDKICT-UHFFFAOYSA-N 0 0 370.409 3.597 20 5 FHBDRN CC(C)[N@H+](CC(=O)[O-])Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000414652134 941425601 /nfs/dbraw/zinc/42/56/01/941425601.db2.gz GXGJSAYCNKMMSH-UHFFFAOYSA-N 0 0 357.410 3.658 20 5 FHBDRN Cc1c(NC(=O)CCCCCNC(=O)OC(C)(C)C)cccc1[N+](=O)[O-] ZINC000122286401 941434770 /nfs/dbraw/zinc/43/47/70/941434770.db2.gz BTISVQPMHBYVNV-UHFFFAOYSA-N 0 0 365.430 3.927 20 5 FHBDRN CN(c1ccccc1)c1ccc(C[N@@H+]2CCCC[C@@H]2C(=O)[O-])cc1[N+](=O)[O-] ZINC000414682995 941435939 /nfs/dbraw/zinc/43/59/39/941435939.db2.gz OMPQUWRBKODSMN-GOSISDBHSA-N 0 0 369.421 3.802 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N1CCC(Nc2cccnc2)CC1 ZINC000376824213 941444624 /nfs/dbraw/zinc/44/46/24/941444624.db2.gz UNJWRJCHVGIFQC-UHFFFAOYSA-N 0 0 368.437 3.632 20 5 FHBDRN CN(CCOc1ccccc1F)C(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000110185364 941449071 /nfs/dbraw/zinc/44/90/71/941449071.db2.gz NZXIBAXMOOROSV-UHFFFAOYSA-N 0 0 352.749 3.538 20 5 FHBDRN CCn1c(SCc2cc(F)ccc2[N+](=O)[O-])nnc1-c1cccnc1 ZINC000178283302 941480429 /nfs/dbraw/zinc/48/04/29/941480429.db2.gz AKQMIVNUMLXJJK-UHFFFAOYSA-N 0 0 359.386 3.700 20 5 FHBDRN CCCn1ncc(C(=O)Nc2ccc([N+](=O)[O-])c(OCC)c2)c1C1CC1 ZINC000892744310 941508653 /nfs/dbraw/zinc/50/86/53/941508653.db2.gz BWCHJJRXCXNPAX-UHFFFAOYSA-N 0 0 358.398 3.730 20 5 FHBDRN O=C(C1CCN(c2ccccc2[N+](=O)[O-])CC1)N1CCCC12CCCC2 ZINC000365539092 941537415 /nfs/dbraw/zinc/53/74/15/941537415.db2.gz PJBXUCOTBBGXFD-UHFFFAOYSA-N 0 0 357.454 3.746 20 5 FHBDRN Cc1nc(CO[C@@H]2CCN(c3ccc4cc([N+](=O)[O-])ccc4n3)C2)cs1 ZINC000377179357 941538457 /nfs/dbraw/zinc/53/84/57/941538457.db2.gz NAFSISFPLNBGNT-MRXNPFEDSA-N 0 0 370.434 3.703 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)OCc1ccc(C(F)(F)F)cc1 ZINC000024423191 941542662 /nfs/dbraw/zinc/54/26/62/941542662.db2.gz VTAIEBALVIECQU-UHFFFAOYSA-N 0 0 355.268 3.979 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCCC[C@@H]1c1cccc(Cl)c1 ZINC000377200327 941554364 /nfs/dbraw/zinc/55/43/64/941554364.db2.gz XVABWGLYLAGYHD-OAHLLOKOSA-N 0 0 362.817 3.507 20 5 FHBDRN O=C(c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)N1CC[C@H](CC2CCCC2)C1 ZINC000377247957 941592796 /nfs/dbraw/zinc/59/27/96/941592796.db2.gz CUMMUXDOWYFIBC-CQSZACIVSA-N 0 0 369.421 3.891 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N2CC3(CCOCC3)[C@H]2c2ccco2)c1C ZINC000892842103 941609637 /nfs/dbraw/zinc/60/96/37/941609637.db2.gz ABZKZHBDVPBONH-GOSISDBHSA-N 0 0 370.405 3.799 20 5 FHBDRN Cc1ccc(C(=O)Nc2ccnn2-c2ccc([N+](=O)[O-])cc2)c(F)c1F ZINC001125857895 941611195 /nfs/dbraw/zinc/61/11/95/941611195.db2.gz RJKSNIOYBZZUAX-UHFFFAOYSA-N 0 0 358.304 3.619 20 5 FHBDRN O=C(N[C@@H](c1cccc2ccccc21)C(F)(F)F)c1c[nH]nc1[N+](=O)[O-] ZINC000549189989 941614528 /nfs/dbraw/zinc/61/45/28/941614528.db2.gz GMFQLMUNLMXYHK-ZDUSSCGKSA-N 0 0 364.283 3.505 20 5 FHBDRN O=[N+]([O-])c1cc(I)ccc1N[C@@H]1CC[C@H](F)C1 ZINC000549196133 941621018 /nfs/dbraw/zinc/62/10/18/941621018.db2.gz FWTXLIMONURYHR-IONNQARKSA-N 0 0 350.131 3.502 20 5 FHBDRN CN(Cc1noc(C2CC2)n1)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000412071139 941621720 /nfs/dbraw/zinc/62/17/20/941621720.db2.gz JBOOMCBRFLLBFD-UHFFFAOYSA-N 0 0 356.304 3.506 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NCc2cc3c(s2)CCCC3)c1 ZINC000549197093 941629063 /nfs/dbraw/zinc/62/90/63/941629063.db2.gz NJCGLYOIZKOFDT-UHFFFAOYSA-N 0 0 360.435 3.864 20 5 FHBDRN CCCCCn1nc(C)cc1NC(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000549213179 941654836 /nfs/dbraw/zinc/65/48/36/941654836.db2.gz HFYRXDFADZFMBD-UHFFFAOYSA-N 0 0 373.457 3.996 20 5 FHBDRN Cn1cc([N+](=O)[O-])cc1C(=O)Nc1nc(-c2ccc(Cl)cc2)cs1 ZINC000024465763 941660350 /nfs/dbraw/zinc/66/03/50/941660350.db2.gz GXSDTHRWFGSYNQ-UHFFFAOYSA-N 0 0 362.798 3.963 20 5 FHBDRN CCc1nocc1CN(C)c1cc(CC)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000549221614 941668752 /nfs/dbraw/zinc/66/87/52/941668752.db2.gz LAIOEYJDQGPGIM-UHFFFAOYSA-N 0 0 367.409 3.801 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N[C@H]1CCCC[C@H]1n1cccn1 ZINC000120177318 941673111 /nfs/dbraw/zinc/67/31/11/941673111.db2.gz SULRNVQBYSQGCA-GOEBONIOSA-N 0 0 357.414 3.714 20 5 FHBDRN O=[N+]([O-])c1cnccc1Sc1nnc(-c2ccc(OC(F)F)cc2)o1 ZINC000066796725 941685857 /nfs/dbraw/zinc/68/58/57/941685857.db2.gz IJCYUKHMPVWGNA-UHFFFAOYSA-N 0 0 366.305 3.792 20 5 FHBDRN COC(=O)c1cccc(COc2ccc([N+](=O)[O-])cc2OC)c1Cl ZINC000381912570 941699459 /nfs/dbraw/zinc/69/94/59/941699459.db2.gz NLNZVWSMAUOFOC-UHFFFAOYSA-N 0 0 351.742 3.622 20 5 FHBDRN O=C(C1CCCC1)N1CCCC[C@@H]1c1nc(-c2ccccc2[N+](=O)[O-])no1 ZINC000377423044 941709995 /nfs/dbraw/zinc/70/99/95/941709995.db2.gz HDYHXUIIKINKFX-MRXNPFEDSA-N 0 0 370.409 3.889 20 5 FHBDRN C[C@H](OC(=O)C[C@H](C)n1cccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000729291520 941711260 /nfs/dbraw/zinc/71/12/60/941711260.db2.gz SZIDXMLJBNUZDL-STQMWFEESA-N 0 0 370.365 3.702 20 5 FHBDRN C[C@@H](OC(=O)C[C@H](C)n1cccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000729291519 941711356 /nfs/dbraw/zinc/71/13/56/941711356.db2.gz SZIDXMLJBNUZDL-QWHCGFSZSA-N 0 0 370.365 3.702 20 5 FHBDRN Nc1ccc([N+](=O)[O-])cc1-c1noc([C@H]2CC[C@@H](c3ccccc3)O2)n1 ZINC000377419598 941712465 /nfs/dbraw/zinc/71/24/65/941712465.db2.gz LNZVFQVYZBYIBN-JKSUJKDBSA-N 0 0 352.350 3.820 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CN1CCCC[C@H]1c1noc(C2CC2)n1 ZINC000377431024 941718003 /nfs/dbraw/zinc/71/80/03/941718003.db2.gz HFBHPQGRDLJFQC-HNNXBMFYSA-N 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ZINC000412105917 941764054 /nfs/dbraw/zinc/76/40/54/941764054.db2.gz BASWNMRNRJRVJW-HSALFYBXSA-N 0 0 350.418 3.714 20 5 FHBDRN Cc1c(NC(=O)[C@H](C)N2CCC[C@H]2c2nccs2)cccc1[N+](=O)[O-] ZINC000377502479 941768813 /nfs/dbraw/zinc/76/88/13/941768813.db2.gz MGZHRCZLXSJSFD-WFASDCNBSA-N 0 0 360.439 3.524 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N[C@@H](C)c2cccc(C)c2C)c1F ZINC000412117902 941794849 /nfs/dbraw/zinc/79/48/49/941794849.db2.gz AUAZALMOEBMGDA-ZDUSSCGKSA-N 0 0 360.385 3.779 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)NCC1CC(c2ccccc2)C1 ZINC000549269605 941805051 /nfs/dbraw/zinc/80/50/51/941805051.db2.gz URUHFWQFBBYWPJ-UHFFFAOYSA-N 0 0 367.449 3.973 20 5 FHBDRN COc1ccccc1[C@H]1CCN(C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)C1 ZINC000412123339 941808127 /nfs/dbraw/zinc/80/81/27/941808127.db2.gz LSVAWBCXUQYIAA-ZYSHUDEJSA-N 0 0 366.417 3.723 20 5 FHBDRN Cc1ccc(CN(C)C(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])nc1 ZINC000616171922 941809068 /nfs/dbraw/zinc/80/90/68/941809068.db2.gz KWNYJJNCUHKKSL-UHFFFAOYSA-N 0 0 353.300 3.589 20 5 FHBDRN O=C(COc1cc(F)cc([N+](=O)[O-])c1)c1sccc1Br ZINC000433635964 941813213 /nfs/dbraw/zinc/81/32/13/941813213.db2.gz VAIAZWDOCQJRPI-UHFFFAOYSA-N 0 0 360.160 3.820 20 5 FHBDRN CCOC(=O)c1ccccc1N(CC)C(=O)c1ccc(C)c([N+](=O)[O-])c1 ZINC000118620922 941832068 /nfs/dbraw/zinc/83/20/68/941832068.db2.gz KUADSYQJAIXCHS-UHFFFAOYSA-N 0 0 356.378 3.747 20 5 FHBDRN Cc1c(NC2CC(C)(C)N(O)C(C)(C)C2)ccc([N+](=O)[O-])c1[N+](=O)[O-] ZINC001167718688 941832241 /nfs/dbraw/zinc/83/22/41/941832241.db2.gz WZLHPUTVMVIMHX-UHFFFAOYSA-N 0 0 352.391 3.634 20 5 FHBDRN Cc1cnc([C@@H](NC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)C2CC2)s1 ZINC000412139653 941834045 /nfs/dbraw/zinc/83/40/45/941834045.db2.gz SJVIPTWKJNGZPB-XHSDSOJGSA-N 0 0 357.435 3.731 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)C1(c2cccnc2)CCCC1 ZINC000377601184 941835451 /nfs/dbraw/zinc/83/54/51/941835451.db2.gz ASZACPJUPOGIRZ-UHFFFAOYSA-N 0 0 353.422 3.503 20 5 FHBDRN Cc1cc(C)cc(OS(=O)(=O)c2cc(Cl)c(C)c([N+](=O)[O-])c2)c1 ZINC000019680890 941837882 /nfs/dbraw/zinc/83/78/82/941837882.db2.gz QRBAIDLDEFNBFU-UHFFFAOYSA-N 0 0 355.799 3.941 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N[C@H](C)c2ccc(C(F)(F)F)cc2)c1[N+](=O)[O-] ZINC000433688751 941841856 /nfs/dbraw/zinc/84/18/56/941841856.db2.gz LRTHUNUCDMLBEN-SECBINFHSA-N 0 0 370.331 3.951 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N(Cc2ccco2)Cc2ccccc2)c1[N+](=O)[O-] ZINC000433714319 941847092 /nfs/dbraw/zinc/84/70/92/941847092.db2.gz QVYNAFNQHVVGPS-UHFFFAOYSA-N 0 0 368.393 3.877 20 5 FHBDRN CC(C)Oc1cc(C(=O)NC[C@H]2CCCO[C@H]2C(C)C)ccc1[N+](=O)[O-] ZINC000412159515 941853552 /nfs/dbraw/zinc/85/35/52/941853552.db2.gz JFDWCZFPOVPROC-QAPCUYQASA-N 0 0 364.442 3.563 20 5 FHBDRN CC1(C)C[C@H](C(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)c2ccccc2O1 ZINC000412174392 941863298 /nfs/dbraw/zinc/86/32/98/941863298.db2.gz PIPOYNLKNDQBJY-SFHVURJKSA-N 0 0 366.417 3.824 20 5 FHBDRN O=C(NC1CC(C(F)(F)F)C1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000513341451 941864212 /nfs/dbraw/zinc/86/42/12/941864212.db2.gz VHYLYENTUVMEEU-UHFFFAOYSA-N 0 0 357.332 3.610 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@@H](COc3ccccc3)C2)c1 ZINC000549294538 941867589 /nfs/dbraw/zinc/86/75/89/941867589.db2.gz QNTRWJXYGKIVQS-OAHLLOKOSA-N 0 0 370.405 3.535 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](c2ccccc2)[C@@H]2CCCO2)c1 ZINC000549295640 941873411 /nfs/dbraw/zinc/87/34/11/941873411.db2.gz XCGGSQAHVUYYSB-OALUTQOASA-N 0 0 370.405 3.644 20 5 FHBDRN COC(=O)c1cc(NC(=O)[C@@H]2C[C@]2(F)c2ccccc2)c(C)c([N+](=O)[O-])c1 ZINC000415519454 941873654 /nfs/dbraw/zinc/87/36/54/941873654.db2.gz PASLGPMTSNWDRT-LIRRHRJNSA-N 0 0 372.352 3.513 20 5 FHBDRN CNC(=O)c1cc([N+](=O)[O-])ccc1N[C@H]1CC[C@@H](c2cccc(F)c2)C1 ZINC000480779400 941873920 /nfs/dbraw/zinc/87/39/20/941873920.db2.gz KGXKYWLYOLPSSS-HIFRSBDPSA-N 0 0 357.385 3.842 20 5 FHBDRN COc1cccc(CCC(=O)N2CCCc3ccc([N+](=O)[O-])cc32)c1F ZINC000513380265 941876220 /nfs/dbraw/zinc/87/62/20/941876220.db2.gz DWDDMNLUPYWNTG-UHFFFAOYSA-N 0 0 358.369 3.655 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NCC(C)(C)Oc2ccccc2)c1 ZINC000549301380 941890526 /nfs/dbraw/zinc/89/05/26/941890526.db2.gz VMTNOWGJIWPZJA-UHFFFAOYSA-N 0 0 358.394 3.581 20 5 FHBDRN O=C(NCc1cc2ccccc2[nH]1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000119659179 941896046 /nfs/dbraw/zinc/89/60/46/941896046.db2.gz QKLKHJRLYQSBEU-UHFFFAOYSA-N 0 0 364.405 3.950 20 5 FHBDRN C[C@H](NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)c1ccncc1F ZINC000513399523 941896475 /nfs/dbraw/zinc/89/64/75/941896475.db2.gz NFVFOZLBYHTZSW-JTQLQIEISA-N 0 0 372.381 3.743 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N(C)[C@H](C)c2sc(C)nc2C)c1 ZINC000549305180 941899557 /nfs/dbraw/zinc/89/95/57/941899557.db2.gz CMVXAIYULRYOII-LLVKDONJSA-N 0 0 363.439 3.900 20 5 FHBDRN Cn1ncc([N+](=O)[O-])c1-c1nc(C2CCC(c3ccccc3)CC2)no1 ZINC000453200347 941902173 /nfs/dbraw/zinc/90/21/73/941902173.db2.gz QWVVPBIZLZXYKR-UHFFFAOYSA-N 0 0 353.382 3.820 20 5 FHBDRN CN(Cc1cc(F)cc(F)c1)c1ncc([N+](=O)[O-])cc1Br ZINC000433807342 941905215 /nfs/dbraw/zinc/90/52/15/941905215.db2.gz GBNWNKVAEVNAAQ-UHFFFAOYSA-N 0 0 358.142 3.667 20 5 FHBDRN CC(=O)N1CCc2cc(NC(=O)Nc3cc([N+](=O)[O-])c(C)cc3C)ccc21 ZINC000119900440 941905853 /nfs/dbraw/zinc/90/58/53/941905853.db2.gz AZFPUZUKGRMXGQ-UHFFFAOYSA-N 0 0 368.393 3.765 20 5 FHBDRN Cc1ccc([C@@H]2C[C@H](C)CCN2S(=O)(=O)c2csc([N+](=O)[O-])c2)o1 ZINC000119898193 941906071 /nfs/dbraw/zinc/90/60/71/941906071.db2.gz URFJVRSNFNYTRO-MFKMUULPSA-N 0 0 370.452 3.720 20 5 FHBDRN O=[N+]([O-])c1ccc(NCCOCC(F)(F)C(F)F)cc1OC(F)F ZINC000433809735 941906158 /nfs/dbraw/zinc/90/61/58/941906158.db2.gz WNRJWOIIWVRIRW-UHFFFAOYSA-N 0 0 362.226 3.525 20 5 FHBDRN O=[N+]([O-])c1ccc(NCCOCC(F)(F)C(F)F)c(OC(F)F)c1 ZINC000433801414 941911272 /nfs/dbraw/zinc/91/12/72/941911272.db2.gz KEWGFEVUNCVNST-UHFFFAOYSA-N 0 0 362.226 3.525 20 5 FHBDRN O=C([C@H]1C[C@]1(F)c1ccccc1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000412212840 941920983 /nfs/dbraw/zinc/92/09/83/941920983.db2.gz SZRABDZVVCDZPT-QUCCMNQESA-N 0 0 354.381 3.971 20 5 FHBDRN CCCCOc1ccc(CCNC(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])cc1 ZINC000433837222 941922083 /nfs/dbraw/zinc/92/20/83/941922083.db2.gz SCVYPTKPSRIAKC-UHFFFAOYSA-N 0 0 374.441 3.593 20 5 FHBDRN CCC[C@@]1(CO)CCN(C(=O)c2cc([N+](=O)[O-])ccc2SC(C)C)C1 ZINC000365662350 941922222 /nfs/dbraw/zinc/92/22/22/941922222.db2.gz NOWPJQCMTMHBTK-GOSISDBHSA-N 0 0 366.483 3.720 20 5 FHBDRN CNC(=O)c1ccc(Oc2ccc(Br)cc2)c([N+](=O)[O-])c1 ZINC000053548314 941924580 /nfs/dbraw/zinc/92/45/80/941924580.db2.gz AICCQUCCCOUWFV-UHFFFAOYSA-N 0 0 351.156 3.509 20 5 FHBDRN Cc1cc(NC(=O)C2CCC(NC(=O)C3CCCC3)CC2)ccc1[N+](=O)[O-] ZINC000182436111 941924773 /nfs/dbraw/zinc/92/47/73/941924773.db2.gz OUWRHUSRCCMWGR-UHFFFAOYSA-N 0 0 373.453 3.707 20 5 FHBDRN C[C@@H](C(=O)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F)C(C)(F)F ZINC000293657477 941925129 /nfs/dbraw/zinc/92/51/29/941925129.db2.gz IZJLHSIBPKGNOL-VIFPVBQESA-N 0 0 354.275 3.777 20 5 FHBDRN Cc1sc(C(=O)NCc2cccc(OCC(F)(F)F)c2)cc1[N+](=O)[O-] ZINC000046678857 941925355 /nfs/dbraw/zinc/92/53/55/941925355.db2.gz RCDYRRQCAPTSBV-UHFFFAOYSA-N 0 0 374.340 3.836 20 5 FHBDRN O=C(N[C@H]1CCO[C@H]1c1ccc(Cl)cc1)c1csc([N+](=O)[O-])c1 ZINC000182443864 941925542 /nfs/dbraw/zinc/92/55/42/941925542.db2.gz FCGADUHUNPIHNH-JSGCOSHPSA-N 0 0 352.799 3.570 20 5 FHBDRN Cc1c(CC(=O)N[C@@H]2CCO[C@@H]2c2ccc(Cl)cc2)cccc1[N+](=O)[O-] ZINC000182451156 941926073 /nfs/dbraw/zinc/92/60/73/941926073.db2.gz JVIKJRHQWCXVQS-VQIMIIECSA-N 0 0 374.824 3.746 20 5 FHBDRN COCCC1(CNC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)CCCC1 ZINC000182410885 941930782 /nfs/dbraw/zinc/93/07/82/941930782.db2.gz PMOFRMMSNKQAKA-UHFFFAOYSA-N 0 0 372.368 3.523 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N2CCC(Cc3cccc(F)c3)CC2)c1[N+](=O)[O-] ZINC000433843353 941931789 /nfs/dbraw/zinc/93/17/89/941931789.db2.gz TWQSQLZHMKIURQ-UHFFFAOYSA-N 0 0 374.416 3.675 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCO[C@H]1c1ccc(Cl)cc1 ZINC000182467985 941932345 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O=[N+]([O-])c1ccc(N2CCC[C@H](CCO)CC2)nc1OCc1ccccc1 ZINC000420635491 942131636 /nfs/dbraw/zinc/13/16/36/942131636.db2.gz FLZNYOYBNRJTSH-INIZCTEOSA-N 0 0 371.437 3.558 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)NCCOc1cccc(C(F)(F)F)c1 ZINC000501935960 942134125 /nfs/dbraw/zinc/13/41/25/942134125.db2.gz RIDYAJDKVIZHIU-UHFFFAOYSA-N 0 0 368.311 3.731 20 5 FHBDRN CO[C@@](C)([C@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F)C1CC1 ZINC000415916343 942139442 /nfs/dbraw/zinc/13/94/42/942139442.db2.gz HCIBTNGJROCPOA-VFZGTOFNSA-N 0 0 360.332 3.547 20 5 FHBDRN COc1c(C(=O)NCCCc2c[nH]c3ccc(F)cc23)cccc1[N+](=O)[O-] ZINC000501967705 942143010 /nfs/dbraw/zinc/14/30/10/942143010.db2.gz SBDOJJZJJIOELT-UHFFFAOYSA-N 0 0 371.368 3.586 20 5 FHBDRN C[C@H](CN(C)C(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-])c1nccs1 ZINC000280286410 942151119 /nfs/dbraw/zinc/15/11/19/942151119.db2.gz WAABOUXZBLBJDD-SECBINFHSA-N 0 0 371.821 3.648 20 5 FHBDRN O=C(NCCCc1c[nH]c2ccc(F)cc12)c1ccc(F)cc1[N+](=O)[O-] ZINC000501976383 942158024 /nfs/dbraw/zinc/15/80/24/942158024.db2.gz JBWPMDRYADYMLR-UHFFFAOYSA-N 0 0 359.332 3.717 20 5 FHBDRN CCN(Cc1ccccc1)C(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-] ZINC000102974800 942163385 /nfs/dbraw/zinc/16/33/85/942163385.db2.gz VXVICNPAIBKWGC-UHFFFAOYSA-N 0 0 360.435 3.988 20 5 FHBDRN C[C@H](C(=O)Nc1c[nH]nc1-c1ccccc1)c1ccc([N+](=O)[O-])cc1F ZINC000183383579 942164496 /nfs/dbraw/zinc/16/44/96/942164496.db2.gz OJLNYDDZFKAKGB-NSHDSACASA-N 0 0 354.341 3.866 20 5 FHBDRN Cc1ccccc1OCCN(C)C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000016147404 942170341 /nfs/dbraw/zinc/17/03/41/942170341.db2.gz MNYAHURAMCYLSF-UHFFFAOYSA-N 0 0 369.421 3.629 20 5 FHBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)c1ncsc1C(F)(F)F ZINC000280357660 942170657 /nfs/dbraw/zinc/17/06/57/942170657.db2.gz KXCOUHFCMVJHIJ-UHFFFAOYSA-N 0 0 373.356 3.823 20 5 FHBDRN CCCN(CCc1cccc(F)c1)C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000181896898 942173580 /nfs/dbraw/zinc/17/35/80/942173580.db2.gz FOLMLSRUQUEPID-UHFFFAOYSA-N 0 0 374.368 3.558 20 5 FHBDRN Cc1nn(CCC(=O)Nc2ccc3cccc(Cl)c3n2)c(C)c1[N+](=O)[O-] ZINC000182728640 942175216 /nfs/dbraw/zinc/17/52/16/942175216.db2.gz DGEFUMZUHLXDER-UHFFFAOYSA-N 0 0 373.800 3.639 20 5 FHBDRN C[C@@H](CNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21)c1ccc(F)cc1 ZINC000502034377 942181490 /nfs/dbraw/zinc/18/14/90/942181490.db2.gz SZWKVIBJZNZPCQ-ZDUSSCGKSA-N 0 0 355.369 3.609 20 5 FHBDRN CC(C)NC(=O)c1ccc(NC2CCC(C(F)F)CC2)c([N+](=O)[O-])c1 ZINC000413437022 942185240 /nfs/dbraw/zinc/18/52/40/942185240.db2.gz HEFJGXGJODRXQE-UHFFFAOYSA-N 0 0 355.385 3.969 20 5 FHBDRN Cc1ccc(S(=O)(=O)N[C@@H](CC(F)F)c2ccccc2)c([N+](=O)[O-])c1 ZINC000420735892 942186389 /nfs/dbraw/zinc/18/63/89/942186389.db2.gz KNDDVBKOWAZKTO-ZDUSSCGKSA-N 0 0 370.377 3.578 20 5 FHBDRN Cc1nc2c(s1)[C@@H](N(C)C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)CCC2 ZINC000413438805 942186866 /nfs/dbraw/zinc/18/68/66/942186866.db2.gz QDOHUDFWROQRKC-UXLLHSPISA-N 0 0 371.462 3.999 20 5 FHBDRN CC(C)[C@H]1N(c2sc(S(C)(=O)=O)cc2[N+](=O)[O-])CC12CCCCC2 ZINC000413444707 942190887 /nfs/dbraw/zinc/19/08/87/942190887.db2.gz SOMAWCAHWJCZLY-CQSZACIVSA-N 0 0 372.512 3.855 20 5 FHBDRN COc1ccc(C(=O)N(C)[C@@H](c2ccccc2)C(F)(F)F)cc1[N+](=O)[O-] ZINC000103050824 942193497 /nfs/dbraw/zinc/19/34/97/942193497.db2.gz DVLPQROUJDVPFI-HNNXBMFYSA-N 0 0 368.311 3.979 20 5 FHBDRN O=C(N[C@H]1C[C@H](c2cccc(F)c2)C1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412317017 942195965 /nfs/dbraw/zinc/19/59/65/942195965.db2.gz WTFJSQBUTYZBAG-OYSPMZIOSA-N 0 0 354.381 3.900 20 5 FHBDRN Cc1csc(C2(NC(=O)[C@@H]3C[C@H]3c3ccc([N+](=O)[O-])cc3)CCC2)n1 ZINC000413456391 942208341 /nfs/dbraw/zinc/20/83/41/942208341.db2.gz KHGPBAJEQRZCRM-LSDHHAIUSA-N 0 0 357.435 3.659 20 5 FHBDRN CCOc1cc(NC(=O)c2ccc(SC)c([N+](=O)[O-])c2)ccc1OC ZINC000502066230 942210378 /nfs/dbraw/zinc/21/03/78/942210378.db2.gz IVJFKBXNCIBAEQ-UHFFFAOYSA-N 0 0 362.407 3.976 20 5 FHBDRN CCOc1ccc(NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)cc1F ZINC000513699196 942210382 /nfs/dbraw/zinc/21/03/82/942210382.db2.gz KJXWRRKGZWVVTE-UHFFFAOYSA-N 0 0 370.283 3.986 20 5 FHBDRN COc1cccc(Cl)c1CNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000480938498 942216442 /nfs/dbraw/zinc/21/64/42/942216442.db2.gz VNMRCCSATNLUPD-UHFFFAOYSA-N 0 0 362.813 3.851 20 5 FHBDRN COc1ccc(C(=O)N(C)CC23CC4CC(CC(C4)C2)C3)cc1[N+](=O)[O-] ZINC000016180251 942219421 /nfs/dbraw/zinc/21/94/21/942219421.db2.gz FEXOUVAQKIIYLP-UHFFFAOYSA-N 0 0 358.438 3.892 20 5 FHBDRN Cc1c(NC(=O)N2CCCSCC2)cc(Br)cc1[N+](=O)[O-] ZINC000280642338 942220050 /nfs/dbraw/zinc/22/00/50/942220050.db2.gz BISOWDANCPVDBM-UHFFFAOYSA-N 0 0 374.260 3.637 20 5 FHBDRN Cc1sc(C(=O)Nc2ccc(O)c(COC(C)C)c2)cc1[N+](=O)[O-] ZINC000290484664 942223311 /nfs/dbraw/zinc/22/33/11/942223311.db2.gz DYDJFOSNCZRBED-UHFFFAOYSA-N 0 0 350.396 3.848 20 5 FHBDRN Cc1cc(F)c2[nH]c(=O)cc(C(=O)N(C)c3cccc([N+](=O)[O-])c3)c2c1 ZINC000183187803 942224228 /nfs/dbraw/zinc/22/42/28/942224228.db2.gz XCAKLFZHJPWKGM-UHFFFAOYSA-N 0 0 355.325 3.573 20 5 FHBDRN Cc1cc(C(=O)N[C@@H](CC(=O)OC(C)C)c2ccccc2[N+](=O)[O-])c(C)o1 ZINC000024483225 942228347 /nfs/dbraw/zinc/22/83/47/942228347.db2.gz UQQIFWXBAXPTCX-INIZCTEOSA-N 0 0 374.393 3.617 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N[C@H]2C[C@H](c3ccccc3C)C2)c1F ZINC000412320304 942229051 /nfs/dbraw/zinc/22/90/51/942229051.db2.gz VRMJUECAKPVQRJ-HDJSIYSDSA-N 0 0 372.396 3.656 20 5 FHBDRN CC[C@H]1C[C@H](C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2C)CCO1 ZINC000280698895 942231161 /nfs/dbraw/zinc/23/11/61/942231161.db2.gz LFBKMLSGQGXUPZ-PWSUYJOCSA-N 0 0 371.231 3.809 20 5 FHBDRN COc1ccc(CNC(=O)N[C@@H](C)c2cc(C)cc(C)c2)cc1[N+](=O)[O-] ZINC000502128919 942235789 /nfs/dbraw/zinc/23/57/89/942235789.db2.gz XTGKUGIJXFOQJN-AWEZNQCLSA-N 0 0 357.410 3.781 20 5 FHBDRN O=C(NCc1cccc2cccnc21)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513731546 942237204 /nfs/dbraw/zinc/23/72/04/942237204.db2.gz XLBYOXYHJUJUDS-UHFFFAOYSA-N 0 0 373.315 3.674 20 5 FHBDRN CCS(=O)(=O)c1cc(Cl)cc(CNc2ccc([N+](=O)[O-])cc2C)c1 ZINC000413490439 942240811 /nfs/dbraw/zinc/24/08/11/942240811.db2.gz WHKRXVWJEWTECJ-UHFFFAOYSA-N 0 0 368.842 3.962 20 5 FHBDRN C[C@@H](NC(=O)N1CC[C@H](c2ccccc2F)C1)c1cccc([N+](=O)[O-])c1 ZINC000502123089 942241788 /nfs/dbraw/zinc/24/17/88/942241788.db2.gz JJFXIZKGXWPCQR-HIFRSBDPSA-N 0 0 357.385 3.994 20 5 FHBDRN Cn1c(C(=O)NCC2(c3cccc(F)c3)CCCCC2)ccc1[N+](=O)[O-] ZINC000502153049 942248003 /nfs/dbraw/zinc/24/80/03/942248003.db2.gz AKRJWTVWCKGANE-UHFFFAOYSA-N 0 0 359.401 3.704 20 5 FHBDRN COc1ccc2nc(C(=O)N3c4ccc([N+](=O)[O-])cc4C[C@H]3C)ccc2c1 ZINC000103376505 942248458 /nfs/dbraw/zinc/24/84/58/942248458.db2.gz SZIGRVMUJHPLOU-GFCCVEGCSA-N 0 0 363.373 3.743 20 5 FHBDRN CCc1cc(NC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)ccc1C ZINC000183198468 942248483 /nfs/dbraw/zinc/24/84/83/942248483.db2.gz ORFDTBNBELKJHL-UHFFFAOYSA-N 0 0 351.362 3.559 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CC[C@H](C)[C@@H](C)C2)cc1SC ZINC000183449724 942248813 /nfs/dbraw/zinc/24/88/13/942248813.db2.gz WZOJYYSVEACKQT-SDDRHHMPSA-N 0 0 352.456 3.880 20 5 FHBDRN C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1ccc(NC(=O)C2CC2)cc1 ZINC000103377702 942249098 /nfs/dbraw/zinc/24/90/98/942249098.db2.gz IEOZVLKCQAFRLD-LBPRGKRZSA-N 0 0 365.389 3.535 20 5 FHBDRN C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1ccn(-c2ccccc2F)n1 ZINC000103375869 942249162 /nfs/dbraw/zinc/24/91/62/942249162.db2.gz GSHUZMRLKFNFNV-GFCCVEGCSA-N 0 0 366.352 3.511 20 5 FHBDRN CCOC(=O)C1CCC(Nc2ncc([N+](=O)[O-])cc2C(F)(F)F)CC1 ZINC000413064918 942249669 /nfs/dbraw/zinc/24/96/69/942249669.db2.gz CHZNWVPKAQIFIT-UHFFFAOYSA-N 0 0 361.320 3.542 20 5 FHBDRN Cc1oc(-c2ccco2)nc1CC(=O)N1c2ccc([N+](=O)[O-])cc2C[C@@H]1C ZINC000103375315 942249782 /nfs/dbraw/zinc/24/97/82/942249782.db2.gz YMPRDXFIMKQZPB-NSHDSACASA-N 0 0 367.361 3.672 20 5 FHBDRN CCN(C(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-])C1CC(C)(C)C1 ZINC000416008280 942256938 /nfs/dbraw/zinc/25/69/38/942256938.db2.gz BXFCVUBBBGRNJK-UHFFFAOYSA-N 0 0 352.456 3.976 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@H]1CCCOc2ccccc21 ZINC000122852167 942257680 /nfs/dbraw/zinc/25/76/80/942257680.db2.gz UBGXEAJZTOZOSA-AWEZNQCLSA-N 0 0 357.366 3.639 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N(C)[C@@H](C)c2ccc(F)cc2)c1F ZINC000413075920 942260135 /nfs/dbraw/zinc/26/01/35/942260135.db2.gz SIMGLJSHUAPRJM-NSHDSACASA-N 0 0 364.348 3.644 20 5 FHBDRN COc1ccccc1SC[C@@H](C)CNC(=O)c1cccc([N+](=O)[O-])c1 ZINC000103422056 942261985 /nfs/dbraw/zinc/26/19/85/942261985.db2.gz PHFZPNWQTMRSKE-ZDUSSCGKSA-N 0 0 360.435 3.762 20 5 FHBDRN C[C@@H](NC(=O)NCc1cccc(OC(C)(C)C)n1)c1cccc([N+](=O)[O-])c1 ZINC000502172640 942263009 /nfs/dbraw/zinc/26/30/09/942263009.db2.gz ZDDHUJQKBTZOGK-CYBMUJFWSA-N 0 0 372.425 3.728 20 5 FHBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)N1CCc2cccc(F)c2C1 ZINC000502172742 942263115 /nfs/dbraw/zinc/26/31/15/942263115.db2.gz ZTNULVRLNNUUQZ-UHFFFAOYSA-N 0 0 371.412 3.825 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2noc(CN3CCC[C@H](CC(F)(F)F)C3)n2)cc1 ZINC000420952862 942272873 /nfs/dbraw/zinc/27/28/73/942272873.db2.gz SLBJGIZWQUJDGF-LLVKDONJSA-N 0 0 370.331 3.809 20 5 FHBDRN COCCNc1ccc(CNc2ncc([N+](=O)[O-])cc2C(F)(F)F)cc1 ZINC000413089286 942273060 /nfs/dbraw/zinc/27/30/60/942273060.db2.gz BEVGIRVNJLVYTQ-UHFFFAOYSA-N 0 0 370.331 3.679 20 5 FHBDRN O=C(CSc1ccccc1[N+](=O)[O-])NCCc1ccc(Cl)cc1 ZINC000015617445 942280288 /nfs/dbraw/zinc/28/02/88/942280288.db2.gz QEHFVIVTUKFWLD-UHFFFAOYSA-N 0 0 350.827 3.699 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])s1)N1CCC[C@H]1Cc1cc(F)ccc1F ZINC000416041363 942286949 /nfs/dbraw/zinc/28/69/49/942286949.db2.gz DFBAQERCIMARQG-LBPRGKRZSA-N 0 0 352.362 3.782 20 5 FHBDRN C[C@H](c1cccc(O)c1)N(C)C(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000137040550 942287264 /nfs/dbraw/zinc/28/72/64/942287264.db2.gz QMRCNVCHGFHWLV-CQSZACIVSA-N 0 0 357.410 3.712 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCc1cccc(F)c1 ZINC000103598835 942295294 /nfs/dbraw/zinc/29/52/94/942295294.db2.gz GONGCKLBYQKDFL-UHFFFAOYSA-N 0 0 359.401 3.897 20 5 FHBDRN CC[C@@H](CC(=O)NCCNc1ccc([N+](=O)[O-])cc1)c1ccc(OC)cc1 ZINC000502222217 942298021 /nfs/dbraw/zinc/29/80/21/942298021.db2.gz OWTPOCMJLPCFFG-HNNXBMFYSA-N 0 0 371.437 3.715 20 5 FHBDRN CC(C)(C)c1ccc(NC(=O)N2CCC(O)(C(F)F)CC2)cc1[N+](=O)[O-] ZINC000501077452 942298518 /nfs/dbraw/zinc/29/85/18/942298518.db2.gz VIEKMIIJKSAWKM-UHFFFAOYSA-N 0 0 371.384 3.516 20 5 FHBDRN CO[C@H](CNC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C)CC(C)C ZINC000419520699 942299205 /nfs/dbraw/zinc/29/92/05/942299205.db2.gz QIEFGEKMFMPBLC-KRWDZBQOSA-N 0 0 351.447 3.576 20 5 FHBDRN CCn1cc([C@@H]2OCC[C@H]2CNc2c(C)cc([N+](=O)[O-])cc2Cl)cn1 ZINC000413512127 942299342 /nfs/dbraw/zinc/29/93/42/942299342.db2.gz JXANGXOXSUOXLC-YVEFUNNKSA-N 0 0 364.833 3.963 20 5 FHBDRN C[C@H](NC(=O)Nc1cc(Br)cc([N+](=O)[O-])c1)c1ccccn1 ZINC000501085899 942302119 /nfs/dbraw/zinc/30/21/19/942302119.db2.gz OZGHISPTQLNVTD-VIFPVBQESA-N 0 0 365.187 3.635 20 5 FHBDRN Cc1cc(C)cc([C@@H](C)NC(=O)NCCNc2ccccc2[N+](=O)[O-])c1 ZINC000502249794 942312947 /nfs/dbraw/zinc/31/29/47/942312947.db2.gz OSVRGCITONFXQX-OAHLLOKOSA-N 0 0 356.426 3.684 20 5 FHBDRN CC[C@@H](Cc1ccccc1)NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513739502 942316296 /nfs/dbraw/zinc/31/62/96/942316296.db2.gz JDGMUGRYEFWYCE-AWEZNQCLSA-N 0 0 364.348 3.947 20 5 FHBDRN O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])NC[C@H]1CC12CC2 ZINC000416069559 942316920 /nfs/dbraw/zinc/31/69/20/942316920.db2.gz KSQVIJOBYPDQTB-SNVBAGLBSA-N 0 0 360.357 3.622 20 5 FHBDRN Cc1cc(N2CC[C@]3(C2)CC(=O)c2ccccc2O3)c(F)cc1[N+](=O)[O-] ZINC000413531257 942319545 /nfs/dbraw/zinc/31/95/45/942319545.db2.gz LZJPXMYGHKVUSD-LJQANCHMSA-N 0 0 356.353 3.657 20 5 FHBDRN O=C(CCSCCOCC1CCCC1)Nc1ccccc1[N+](=O)[O-] ZINC000419605249 942321191 /nfs/dbraw/zinc/32/11/91/942321191.db2.gz RXPAJDROLMUBSS-UHFFFAOYSA-N 0 0 352.456 3.863 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](C)c2nc3ccccc3[nH]2)c1 ZINC000183492552 942321685 /nfs/dbraw/zinc/32/16/85/942321685.db2.gz ZUAJDJHWXBTWKI-JTQLQIEISA-N 0 0 356.407 3.684 20 5 FHBDRN Cc1nn(C)c(C)c1[C@@H]1CCCN1c1ccc([N+](=O)[O-])c2ncccc12 ZINC000413125822 942323851 /nfs/dbraw/zinc/32/38/51/942323851.db2.gz JEMAEVIGCAHXGE-INIZCTEOSA-N 0 0 351.410 3.835 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]c(N3CC4(CCOCC4)[C@H]3c3ccccc3)nc2c1 ZINC000413535990 942325933 /nfs/dbraw/zinc/32/59/33/942325933.db2.gz FHFYLQMFNORJOO-GOSISDBHSA-N 0 0 364.405 3.829 20 5 FHBDRN CO[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2SC(C)C)CC[C@@H]1C ZINC000188071609 942326017 /nfs/dbraw/zinc/32/60/17/942326017.db2.gz JEFDQQUHALUTGF-WFASDCNBSA-N 0 0 352.456 3.592 20 5 FHBDRN CSc1cccc(C(=O)NCCCOc2ccc(F)cc2)c1[N+](=O)[O-] ZINC000188094390 942334989 /nfs/dbraw/zinc/33/49/89/942334989.db2.gz HLAQSXIIECUDIS-UHFFFAOYSA-N 0 0 364.398 3.655 20 5 FHBDRN CC[C@@H](Oc1ccccc1C)c1nc(Cc2ccc([N+](=O)[O-])cn2)no1 ZINC000274074992 942337966 /nfs/dbraw/zinc/33/79/66/942337966.db2.gz WUTOFYQBLFVWPT-OAHLLOKOSA-N 0 0 354.366 3.802 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cn1)N1CCc2sccc2[C@H]1c1cccs1 ZINC000378158515 942341495 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O=[N+]([O-])c1cnc2ccc(N3Cc4ccccc4[C@H](c4ccccc4)C3)nn21 ZINC000502382687 942393228 /nfs/dbraw/zinc/39/32/28/942393228.db2.gz JVJVOYCBMCJGNU-SFHVURJKSA-N 0 0 371.400 3.790 20 5 FHBDRN CC(C)(CNC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)c1ccccc1 ZINC000513744466 942404531 /nfs/dbraw/zinc/40/45/31/942404531.db2.gz LEFSEQIBQGYLOD-UHFFFAOYSA-N 0 0 364.348 3.904 20 5 FHBDRN Cc1cc(NC(=O)[C@@H]2Cc3ccc(Cl)cc32)c2cc([N+](=O)[O-])ccc2n1 ZINC001268853732 942414103 /nfs/dbraw/zinc/41/41/03/942414103.db2.gz GVQIEOYKYSTIPW-OAHLLOKOSA-N 0 0 367.792 3.805 20 5 FHBDRN CC[C@H](NCc1nnc(-c2ccncc2F)s1)c1cccc([N+](=O)[O-])c1 ZINC000366825044 942424635 /nfs/dbraw/zinc/42/46/35/942424635.db2.gz JZNOWTPWDQYYBG-HNNXBMFYSA-N 0 0 373.413 3.888 20 5 FHBDRN CC(C)OCc1cc(NC(=O)CCc2cccc([N+](=O)[O-])c2)ccc1O ZINC000290703989 942430919 /nfs/dbraw/zinc/43/09/19/942430919.db2.gz WDUUALISGMNSPP-UHFFFAOYSA-N 0 0 358.394 3.797 20 5 FHBDRN COC(=O)c1cc(C)ccc1NC(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000505274302 942440847 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353.422 3.758 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(CO)c(Cl)c1 ZINC000416207547 942487592 /nfs/dbraw/zinc/48/75/92/942487592.db2.gz YDXVHEPHKVMKML-CYBMUJFWSA-N 0 0 362.813 3.948 20 5 FHBDRN CC[C@](C)(C(=O)OC)N(CC1CC1)C(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000425029417 942492903 /nfs/dbraw/zinc/49/29/03/942492903.db2.gz IMFWNSKKGMWQFW-LJQANCHMSA-N 0 0 374.393 3.535 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N([C@H](C)c2ccco2)C2CC2)c1F ZINC000413219977 942497752 /nfs/dbraw/zinc/49/77/52/942497752.db2.gz NPUMTTMPHLAIKM-LLVKDONJSA-N 0 0 362.357 3.630 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)[C@@H]1CC(C)(C)Oc2ccccc21 ZINC000412338776 942503198 /nfs/dbraw/zinc/50/31/98/942503198.db2.gz SQAXBMQFZOZFSE-QGZVFWFLSA-N 0 0 368.433 3.941 20 5 FHBDRN Cc1ccccc1C(C)(C)CNC(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000505363888 942503611 /nfs/dbraw/zinc/50/36/11/942503611.db2.gz IHPQHMRFBKEYAO-UHFFFAOYSA-N 0 0 355.438 3.799 20 5 FHBDRN COc1cc(CN(C)C(=O)c2c(C)cc(C)c([N+](=O)[O-])c2C)ccc1O 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CC(C)(C)c1csc(CCNC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)n1 ZINC000104578349 942538096 /nfs/dbraw/zinc/53/80/96/942538096.db2.gz FEADVSUVSKVESG-UHFFFAOYSA-N 0 0 372.450 3.803 20 5 FHBDRN COc1cc(Cl)ccc1CNC(=O)c1cc(SC)ccc1[N+](=O)[O-] ZINC000502564369 942544419 /nfs/dbraw/zinc/54/44/19/942544419.db2.gz VCKWBKMRLFJCPP-UHFFFAOYSA-N 0 0 366.826 3.909 20 5 FHBDRN Cc1cc(CN(C)c2ncc([N+](=O)[O-])cn2)cc(C)c1OCC(F)(F)F ZINC000545445688 942547900 /nfs/dbraw/zinc/54/79/00/942547900.db2.gz IIOMRFOCLOTSOP-UHFFFAOYSA-N 0 0 370.331 3.579 20 5 FHBDRN O=C(NC[C@@H]1CCCCS1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000541272117 942548037 /nfs/dbraw/zinc/54/80/37/942548037.db2.gz HWZMVEISYDNDOC-ZDUSSCGKSA-N 0 0 363.464 3.734 20 5 FHBDRN COc1ccccc1C1(C(=O)N2CCCc3c([N+](=O)[O-])cccc32)CC1 ZINC000513837428 942550419 /nfs/dbraw/zinc/55/04/19/942550419.db2.gz ZYUJGPJRTXMSSF-UHFFFAOYSA-N 0 0 352.390 3.614 20 5 FHBDRN CN(Cc1ccc(C(F)(F)F)cc1)C(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000104655165 942559102 /nfs/dbraw/zinc/55/91/02/942559102.db2.gz FOSRKJPSLNEGGD-UHFFFAOYSA-N 0 0 352.312 3.815 20 5 FHBDRN CO[C@H](CNC(=O)c1cccc2c(=O)c3cccc(F)c3[nH]c12)CC(C)C ZINC000416260945 942561752 /nfs/dbraw/zinc/56/17/52/942561752.db2.gz LBENFKYIRPITLI-ZDUSSCGKSA-N 0 0 370.424 3.611 20 5 FHBDRN COc1ccc(Br)cc1-c1nc2cc([N+](=O)[O-])ccc2n1C ZINC000513856263 942565388 /nfs/dbraw/zinc/56/53/88/942565388.db2.gz SHVKDUDTOVTKNT-UHFFFAOYSA-N 0 0 362.183 3.920 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@@H](C)Cc1ccccc1Cl ZINC000513855583 942565631 /nfs/dbraw/zinc/56/56/31/942565631.db2.gz HQWQJIAANOMRCP-LBPRGKRZSA-N 0 0 362.813 3.752 20 5 FHBDRN CC(C)Cn1ncc(NC(=O)Cc2ccc([N+](=O)[O-])cc2F)c1C(C)C ZINC000501609137 942566101 /nfs/dbraw/zinc/56/61/01/942566101.db2.gz UMHDYVZLYHAHOW-UHFFFAOYSA-N 0 0 362.405 3.891 20 5 FHBDRN CC(C)C[C@H](CO)NC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 ZINC000502594685 942568704 /nfs/dbraw/zinc/56/87/04/942568704.db2.gz JRDQKQMRFSXPDG-CQSZACIVSA-N 0 0 358.394 3.524 20 5 FHBDRN CC(=O)Nc1c2cccc(C)c2n(C)c1OCc1ccccc1[N+](=O)[O-] ZINC000502595883 942569336 /nfs/dbraw/zinc/56/93/36/942569336.db2.gz QZKNYRRKBKYGDR-UHFFFAOYSA-N 0 0 353.378 3.932 20 5 FHBDRN COc1cc(C)c(CN(C)C(=O)c2cc([N+](=O)[O-])c(C)cc2C)cc1OC ZINC000421433150 942570106 /nfs/dbraw/zinc/57/01/06/942570106.db2.gz VECQLGZYWLYHLM-UHFFFAOYSA-N 0 0 372.421 3.809 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)Nc1ccc(CC(=O)NC(C)C)cc1 ZINC000421435247 942570817 /nfs/dbraw/zinc/57/08/17/942570817.db2.gz VIQKXCSWJKWIBR-UHFFFAOYSA-N 0 0 369.421 3.531 20 5 FHBDRN COc1ccc(-n2ccnc2SCC(=O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000501624276 942571565 /nfs/dbraw/zinc/57/15/65/942571565.db2.gz MUNZQWKMRFPLER-UHFFFAOYSA-N 0 0 369.402 3.764 20 5 FHBDRN CC(C)Cn1ncc(NC(=O)CNc2ccccc2[N+](=O)[O-])c1C(C)C ZINC000501616900 942577654 /nfs/dbraw/zinc/57/76/54/942577654.db2.gz KHNKENHLSZRULX-UHFFFAOYSA-N 0 0 359.430 3.621 20 5 FHBDRN COc1cc(Cl)ccc1C(=O)OCc1ccc(N(C)C)c([N+](=O)[O-])c1 ZINC001268935665 942578560 /nfs/dbraw/zinc/57/85/60/942578560.db2.gz BGMDENAHTLQRCI-UHFFFAOYSA-N 0 0 364.785 3.680 20 5 FHBDRN CC(=O)N1CCCc2cc(NC(=O)c3cc([N+](=O)[O-])c(C)cc3C)ccc21 ZINC000421447320 942578861 /nfs/dbraw/zinc/57/88/61/942578861.db2.gz CUIKUBUDAUZAKT-UHFFFAOYSA-N 0 0 367.405 3.763 20 5 FHBDRN C[C@H](CNC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1)CC(F)(F)F ZINC000413762727 942580380 /nfs/dbraw/zinc/58/03/80/942580380.db2.gz MBEJJEDTMVIXOT-NSHDSACASA-N 0 0 359.348 3.857 20 5 FHBDRN O=C(N[C@@H](CCO)c1ccc(Cl)cc1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412344485 942583301 /nfs/dbraw/zinc/58/33/01/942583301.db2.gz XRBZYKKESJINSP-KSZLIROESA-N 0 0 374.824 3.592 20 5 FHBDRN CCCc1n[nH]c(C(=O)N[C@@H](C)Cc2ccc(C(C)C)cc2)c1[N+](=O)[O-] ZINC000501653223 942587888 /nfs/dbraw/zinc/58/78/88/942587888.db2.gz AONKIDGMFNHKIS-ZDUSSCGKSA-N 0 0 358.442 3.755 20 5 FHBDRN CC(C)[C@@H](NC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2)c1ccc(F)cc1 ZINC000501657541 942589382 /nfs/dbraw/zinc/58/93/82/942589382.db2.gz SCMMYCVHWWBDBQ-MRXNPFEDSA-N 0 0 360.341 3.590 20 5 FHBDRN Cc1cnn(-c2ccccc2)c1NC(=O)CSc1ccccc1[N+](=O)[O-] ZINC000541307235 942590657 /nfs/dbraw/zinc/59/06/57/942590657.db2.gz RPSYGQRVDCHWHI-UHFFFAOYSA-N 0 0 368.418 3.820 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCCC[C@H]1OC(F)F ZINC000501659082 942591243 /nfs/dbraw/zinc/59/12/43/942591243.db2.gz OPYLEDLYCQRZAQ-NUEKZKHPSA-N 0 0 370.396 3.830 20 5 FHBDRN Cn1cc(-c2cc(F)ccc2NC(=O)/C=C/c2cccc([N+](=O)[O-])c2)cn1 ZINC000366564720 942593726 /nfs/dbraw/zinc/59/37/26/942593726.db2.gz UMOPKJUTJASAMU-VMPITWQZSA-N 0 0 366.352 3.786 20 5 FHBDRN CCOC(=O)CN(C(=O)c1cccc([N+](=O)[O-])c1C)[C@@H](C)c1ccccc1 ZINC000513920357 942595100 /nfs/dbraw/zinc/59/51/00/942595100.db2.gz NKPMNFCEWOMSQE-HNNXBMFYSA-N 0 0 370.405 3.670 20 5 FHBDRN COCCN(C(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1)[C@@H]1CCC[C@H]1C ZINC000413791293 942598326 /nfs/dbraw/zinc/59/83/26/942598326.db2.gz XZIQUSFBYVUKRU-GDBMZVCRSA-N 0 0 364.442 3.659 20 5 FHBDRN COCCN(C(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1)[C@@H]1CCC[C@@H]1C ZINC000413791294 942598394 /nfs/dbraw/zinc/59/83/94/942598394.db2.gz XZIQUSFBYVUKRU-GOEBONIOSA-N 0 0 364.442 3.659 20 5 FHBDRN COCCN(C(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1)[C@H]1CCC[C@@H]1C ZINC000413791295 942598558 /nfs/dbraw/zinc/59/85/58/942598558.db2.gz XZIQUSFBYVUKRU-HOCLYGCPSA-N 0 0 364.442 3.659 20 5 FHBDRN COC(=O)C(C)(C)c1ccc(NC(=O)c2cc([N+](=O)[O-])c(C)cc2C)cc1 ZINC000421484199 942600789 /nfs/dbraw/zinc/60/07/89/942600789.db2.gz UHESNJAAPDRSBA-UHFFFAOYSA-N 0 0 370.405 3.915 20 5 FHBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1CNc1cccc2c1OCCC2=O ZINC000502637676 942604779 /nfs/dbraw/zinc/60/47/79/942604779.db2.gz VZHKNCJMTAQNIK-UHFFFAOYSA-N 0 0 356.378 3.959 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N(C)Cc2cc(Cl)ccc2F)c1[N+](=O)[O-] ZINC000434343541 942606760 /nfs/dbraw/zinc/60/67/60/942606760.db2.gz WOAVJYQYUFTLSI-UHFFFAOYSA-N 0 0 354.769 3.506 20 5 FHBDRN COc1ccc(CNC(=O)Nc2cccc(C(F)F)c2)cc1[N+](=O)[O-] ZINC000513928626 942612611 /nfs/dbraw/zinc/61/26/11/942612611.db2.gz WOCNUJJVKIDNCC-UHFFFAOYSA-N 0 0 351.309 3.863 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N2C[C@@H](C)C[C@H]2c2ccccc2)c1F ZINC000412347154 942612866 /nfs/dbraw/zinc/61/28/66/942612866.db2.gz NZBQWXVDZLSIJD-GUYCJALGSA-N 0 0 372.396 3.895 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCC(CO)(c3ccccc3)CC2)c2cccnc21 ZINC000413300165 942617418 /nfs/dbraw/zinc/61/74/18/942617418.db2.gz IWBXUAAJCRWCGE-UHFFFAOYSA-N 0 0 363.417 3.674 20 5 FHBDRN O=[N+]([O-])c1ccc(NC[C@@H](O)CCc2ccccc2)cc1OC(F)F ZINC000541335961 942619971 /nfs/dbraw/zinc/61/99/71/942619971.db2.gz GJYIMQOSJDYNSS-AWEZNQCLSA-N 0 0 352.337 3.602 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)Nc1ccnc(OCc2ccccc2)c1 ZINC000501720611 942626549 /nfs/dbraw/zinc/62/65/49/942626549.db2.gz TWMCWAUVIZUINA-UHFFFAOYSA-N 0 0 363.373 3.750 20 5 FHBDRN Cc1c(C(F)(F)F)nn(C)c1NC(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC000421523823 942628330 /nfs/dbraw/zinc/62/83/30/942628330.db2.gz UITZINJPNQMIQA-UHFFFAOYSA-N 0 0 356.304 3.525 20 5 FHBDRN COc1cccc(C=C2CCN(C(=O)c3cccc([N+](=O)[O-])c3N)CC2)c1 ZINC000472966906 942631708 /nfs/dbraw/zinc/63/17/08/942631708.db2.gz WLQHIGRBENMPKZ-UHFFFAOYSA-N 0 0 367.405 3.505 20 5 FHBDRN Cc1noc(C)c1C(C)(C)NC(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1 ZINC000413816086 942631980 /nfs/dbraw/zinc/63/19/80/942631980.db2.gz RKKSAQAPXIHWPL-UHFFFAOYSA-N 0 0 361.398 3.652 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)NCc1ccc(F)c(Cl)c1 ZINC000513955198 942633583 /nfs/dbraw/zinc/63/35/83/942633583.db2.gz WQCRZYOYTRXFQN-UHFFFAOYSA-N 0 0 353.737 3.718 20 5 FHBDRN O=[N+]([O-])c1cnc(N2CCC(c3noc4cc(F)ccc43)CC2)c(F)c1 ZINC000413309087 942642640 /nfs/dbraw/zinc/64/26/40/942642640.db2.gz KXNDKJVTRJSLBN-UHFFFAOYSA-N 0 0 360.320 3.793 20 5 FHBDRN C[C@H](NC(=O)c1ccc(N2CCC[C@H](C)C2)c([N+](=O)[O-])c1)C(C)(F)F ZINC000452467315 942643146 /nfs/dbraw/zinc/64/31/46/942643146.db2.gz WFPFZIOOBOKEIC-RYUDHWBXSA-N 0 0 355.385 3.605 20 5 FHBDRN CCN(Cc1nc2ccccc2c(=O)[nH]1)[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000434392189 942643639 /nfs/dbraw/zinc/64/36/39/942643639.db2.gz YZJXOSCEZXKVEP-CYBMUJFWSA-N 0 0 352.394 3.827 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CC[NH+](C(c3ccccc3)c3ccccc3)CC2)cn1 ZINC000513968517 942649240 /nfs/dbraw/zinc/64/92/40/942649240.db2.gz FHXDIVWXUNUDDG-UHFFFAOYSA-N 0 0 374.444 3.901 20 5 FHBDRN CC(C)[C@@H](CC(F)(F)F)NC(=O)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000502692451 942650270 /nfs/dbraw/zinc/65/02/70/942650270.db2.gz DYCJRAROAALQEV-CYBMUJFWSA-N 0 0 361.364 3.756 20 5 FHBDRN CCN(C(=O)COc1ccc([N+](=O)[O-])c(OC)c1)c1ccc2[nH]ccc2c1 ZINC000472970284 942650362 /nfs/dbraw/zinc/65/03/62/942650362.db2.gz UMDGWRLZRZECOG-UHFFFAOYSA-N 0 0 369.377 3.517 20 5 FHBDRN O=[N+]([O-])c1ccc2ccnc(N[C@@H]3CCO[C@@H](c4cccnc4)C3)c2c1 ZINC000413319601 942658560 /nfs/dbraw/zinc/65/85/60/942658560.db2.gz OOXVMCMKBQNMAB-CRAIPNDOSA-N 0 0 350.378 3.870 20 5 FHBDRN Cc1cccc2c1N(C(=O)c1ccc(Br)cc1[N+](=O)[O-])CC2 ZINC000430050386 942662094 /nfs/dbraw/zinc/66/20/94/942662094.db2.gz IQKHYMOPWZBDIG-UHFFFAOYSA-N 0 0 361.195 3.869 20 5 FHBDRN CC1(C)CN(C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)[C@@H]1c1cccnc1 ZINC000412357720 942662315 /nfs/dbraw/zinc/66/23/15/942662315.db2.gz OLTOTEIJABJPSW-RCCFBDPRSA-N 0 0 351.406 3.703 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)cnc1N1CCC2(CC1)OCCc1ccccc12 ZINC000413330158 942667490 /nfs/dbraw/zinc/66/74/90/942667490.db2.gz KGPAEWUKOZXCAU-UHFFFAOYSA-N 0 0 359.813 3.712 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)NCC[C@@H]2CCc3ccccc32)c1F ZINC000412364300 942670767 /nfs/dbraw/zinc/67/07/67/942670767.db2.gz CMHGKYKXWAIEEH-AWEZNQCLSA-N 0 0 372.396 3.521 20 5 FHBDRN C[C@@H]([C@@H]1Cc2ccccc2O1)N(C)C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000434435339 942676148 /nfs/dbraw/zinc/67/61/48/942676148.db2.gz SMKTXIHWKKVMEN-SGTLLEGYSA-N 0 0 365.389 3.540 20 5 FHBDRN CCCOc1ccc(OCC(=O)Nc2cc([N+](=O)[O-])ccc2OCC)cc1 ZINC000545959445 942689343 /nfs/dbraw/zinc/68/93/43/942689343.db2.gz LZSJIPHZDONZMI-UHFFFAOYSA-N 0 0 374.393 3.800 20 5 FHBDRN COc1ccccc1CCN(C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000104768924 942691703 /nfs/dbraw/zinc/69/17/03/942691703.db2.gz TUEPVPJYBLITGR-UHFFFAOYSA-N 0 0 363.801 3.963 20 5 FHBDRN Cc1cc(Cc2noc([C@@H]3C[C@H]3c3cccc(O)c3)n2)ccc1[N+](=O)[O-] ZINC000420487834 942692370 /nfs/dbraw/zinc/69/23/70/942692370.db2.gz NKXRPIYUHYBYCJ-JKSUJKDBSA-N 0 0 351.362 3.854 20 5 FHBDRN CCOc1ccc([C@H](C)NC(=O)c2ccc([N+](=O)[O-])s2)cc1OC ZINC000501825240 942693827 /nfs/dbraw/zinc/69/38/27/942693827.db2.gz LVNNXKMLUJCICG-JTQLQIEISA-N 0 0 350.396 3.555 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H](C)c1ncc(C)s1 ZINC000183617765 942696190 /nfs/dbraw/zinc/69/61/90/942696190.db2.gz BPSASWNTBVDNTR-WFASDCNBSA-N 0 0 361.467 3.848 20 5 FHBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)N[C@@H]1C[C@H]1c1cccc(F)c1 ZINC000434155251 942697691 /nfs/dbraw/zinc/69/76/91/942697691.db2.gz WMDZPUGMRKVHLD-RBUKOAKNSA-N 0 0 371.412 3.912 20 5 FHBDRN CN(C)c1cc(F)c(C(=O)NCc2ccc(C3CCC3)cc2)cc1[N+](=O)[O-] ZINC001269156529 942704729 /nfs/dbraw/zinc/70/47/29/942704729.db2.gz FBOPANMOEZTHMM-UHFFFAOYSA-N 0 0 371.412 3.997 20 5 FHBDRN C[C@H](c1ccccc1)N(C(=O)Cn1ccc([N+](=O)[O-])n1)c1ccccc1 ZINC000502744656 942709506 /nfs/dbraw/zinc/70/95/06/942709506.db2.gz SNOWTFZVZQFCNJ-OAHLLOKOSA-N 0 0 350.378 3.586 20 5 FHBDRN COc1cc(C(=O)Nc2nc3c(s2)CCC3(C)C)c([N+](=O)[O-])cc1F ZINC000421633652 942711183 /nfs/dbraw/zinc/71/11/83/942711183.db2.gz WKIKAHGNLHGJLV-UHFFFAOYSA-N 0 0 365.386 3.675 20 5 FHBDRN C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCC(F)(c2ccccc2)CC1 ZINC000434496371 942722641 /nfs/dbraw/zinc/72/26/41/942722641.db2.gz HTYLCVBOCJMGJT-HNNXBMFYSA-N 0 0 371.412 3.883 20 5 FHBDRN CC[C@@H](C)c1ncc(NC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)cn1 ZINC000434517919 942730163 /nfs/dbraw/zinc/73/01/63/942730163.db2.gz NXCNWNIGIUZUTE-GFCCVEGCSA-N 0 0 357.414 3.955 20 5 FHBDRN CCc1ccc(C(=O)N2CCC[C@H]2COc2cccnc2C)cc1[N+](=O)[O-] ZINC000416363111 942734380 /nfs/dbraw/zinc/73/43/80/942734380.db2.gz ZJBBFGUSBUAJPK-KRWDZBQOSA-N 0 0 369.421 3.544 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(N[C@H](CO)c2ccc(Br)cc2)c1 ZINC000502791343 942745237 /nfs/dbraw/zinc/74/52/37/942745237.db2.gz VFRKCIGAZYIZRJ-CQSZACIVSA-N 0 0 351.200 3.811 20 5 FHBDRN Cc1cc(NC(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])cn2ccnc12 ZINC000502800042 942753356 /nfs/dbraw/zinc/75/33/56/942753356.db2.gz VOQQFSGKUQSROD-LLVKDONJSA-N 0 0 374.784 3.610 20 5 FHBDRN CC(C)(C)Oc1cccc(CNc2ccc3cc([N+](=O)[O-])ccc3n2)n1 ZINC000502784305 942757174 /nfs/dbraw/zinc/75/71/74/942757174.db2.gz DTMXROHGDRNMEZ-UHFFFAOYSA-N 0 0 352.394 3.749 20 5 FHBDRN O=C(NC12CC3CC(CC(C3)C1)C2)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514147787 942772386 /nfs/dbraw/zinc/77/23/86/942772386.db2.gz PZUDZNYRXXEXQO-UHFFFAOYSA-N 0 0 366.364 3.895 20 5 FHBDRN O=C(Nc1ccc2ccccc2n1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514147551 942773091 /nfs/dbraw/zinc/77/30/91/942773091.db2.gz MOMTXFLDPRSVAG-UHFFFAOYSA-N 0 0 359.288 3.997 20 5 FHBDRN CC1(C)[C@H](c2ccccc2)CCN1C(=O)COc1ccccc1[N+](=O)[O-] ZINC000421722732 942777356 /nfs/dbraw/zinc/77/73/56/942777356.db2.gz PXMBKYAUNQSWHB-INIZCTEOSA-N 0 0 354.406 3.768 20 5 FHBDRN CCCCc1nnc(NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)s1 ZINC000514160482 942782064 /nfs/dbraw/zinc/78/20/64/942782064.db2.gz PGBAHIWNLDPKNU-UHFFFAOYSA-N 0 0 372.353 3.643 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccc(C(=O)N(C)C)c(Cl)c1 ZINC000513755794 942788059 /nfs/dbraw/zinc/78/80/59/942788059.db2.gz BHYHOIBWGBLVEJ-UHFFFAOYSA-N 0 0 361.785 3.511 20 5 FHBDRN C[C@H]1c2c(Cl)cc(Cl)cc2CCN1C(=O)c1ccc([N+](=O)[O-])[nH]1 ZINC000434599949 942789293 /nfs/dbraw/zinc/78/92/93/942789293.db2.gz UPUUTCIUATXWJS-QMMMGPOBSA-N 0 0 354.193 3.989 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N(C)c1ccc(C(=O)NC(C)(C)C)cc1 ZINC000413929513 942800272 /nfs/dbraw/zinc/80/02/72/942800272.db2.gz UIEBZGADKGIQRY-UHFFFAOYSA-N 0 0 369.421 3.708 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N1CCC(c2c[nH]cn2)CC1 ZINC000378463573 942801119 /nfs/dbraw/zinc/80/11/19/942801119.db2.gz RESUANFYVLFBKJ-UHFFFAOYSA-N 0 0 374.466 3.838 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)NCc2cnccc2C(C)(C)C)c1 ZINC000413934241 942804969 /nfs/dbraw/zinc/80/49/69/942804969.db2.gz ADRQSWFLVZURKV-UHFFFAOYSA-N 0 0 371.437 3.681 20 5 FHBDRN CCOc1ccc(C(=O)Nc2cccc([C@H](C)C(=O)OC)c2)cc1[N+](=O)[O-] ZINC000413940703 942806127 /nfs/dbraw/zinc/80/61/27/942806127.db2.gz SQRRWCRNMSIHSV-LBPRGKRZSA-N 0 0 372.377 3.522 20 5 FHBDRN Cc1nn(Cc2cnc3c(cnn3C(C)C)c2)c2ccc([N+](=O)[O-])cc12 ZINC000502867989 942815804 /nfs/dbraw/zinc/81/58/04/942815804.db2.gz CAGWLWSKCZMXMA-UHFFFAOYSA-N 0 0 350.382 3.627 20 5 FHBDRN Cc1nn(CC(=O)N[C@@H](c2ccccc2)C(C)C)c2ccc([N+](=O)[O-])cc12 ZINC000502889678 942818589 /nfs/dbraw/zinc/81/85/89/942818589.db2.gz SDWOGVKDNAAXFM-HXUWFJFHSA-N 0 0 366.421 3.766 20 5 FHBDRN CS[C@H]1CCC[C@@H](NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)C1 ZINC000514194800 942819697 /nfs/dbraw/zinc/81/96/97/942819697.db2.gz LZSYPCOWGKEATK-MNOVXSKESA-N 0 0 360.382 3.600 20 5 FHBDRN CCCNc1ccccc1NC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000190135794 942821681 /nfs/dbraw/zinc/82/16/81/942821681.db2.gz KHOBEMBBDXJMHG-UHFFFAOYSA-N 0 0 365.393 3.855 20 5 FHBDRN COc1cccc(C(=O)N2CC[C@@H](C(F)(F)F)C3(CCC3)C2)c1[N+](=O)[O-] ZINC000514211215 942822130 /nfs/dbraw/zinc/82/21/30/942822130.db2.gz PEBJILQJHAOEAI-CYBMUJFWSA-N 0 0 372.343 3.798 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1C[C@@H](c2ccsc2)O[C@@H](C)C1 ZINC000421788807 942826901 /nfs/dbraw/zinc/82/69/01/942826901.db2.gz TUWIITYPHLOOIQ-GUYCJALGSA-N 0 0 360.435 3.875 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1C[C@@H](C)O[C@@H](c2ccsc2)C1 ZINC000421788805 942827035 /nfs/dbraw/zinc/82/70/35/942827035.db2.gz TUWIITYPHLOOIQ-CXAGYDPISA-N 0 0 360.435 3.875 20 5 FHBDRN CC(C)c1ccc(C(=O)N2CCC[C@H]2C(=O)OC(C)(C)C)cc1[N+](=O)[O-] ZINC000190157110 942833311 /nfs/dbraw/zinc/83/33/11/942833311.db2.gz XJQSKKGDWBVIQQ-HNNXBMFYSA-N 0 0 362.426 3.665 20 5 FHBDRN C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CC[C@H](C(F)(F)F)C(C)(C)C1 ZINC000190160213 942834300 /nfs/dbraw/zinc/83/43/00/942834300.db2.gz NZWIVKWZLAYMAS-FZMZJTMJSA-N 0 0 373.375 3.832 20 5 FHBDRN O=C(N[C@H]1C[C@@H]1c1cccc(F)c1)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000067333950 942839809 /nfs/dbraw/zinc/83/98/09/942839809.db2.gz NWSGGLWPGWZQEK-AEFFLSMTSA-N 0 0 369.396 3.620 20 5 FHBDRN CCc1ccc(C(=O)N2CC3(CCC3)[C@@H]2C2CCOCC2)cc1[N+](=O)[O-] ZINC000425128539 942849117 /nfs/dbraw/zinc/84/91/17/942849117.db2.gz ZKSZVVTWGRBAGB-SFHVURJKSA-N 0 0 358.438 3.579 20 5 FHBDRN Cc1cccc2c1OCC[C@H]2NC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000190193334 942849935 /nfs/dbraw/zinc/84/99/35/942849935.db2.gz RYTIVJKATVYZBN-SUMWQHHRSA-N 0 0 355.394 3.787 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)N1C[C@@H](c2ccccc2)C2(CCC2)C1 ZINC000413971457 942856207 /nfs/dbraw/zinc/85/62/07/942856207.db2.gz BHVVPWYQBHZBLX-IBGZPJMESA-N 0 0 350.418 3.934 20 5 FHBDRN CSc1cccc(C(=O)N2CC3(CCOCC3)[C@@H]2C(C)C)c1[N+](=O)[O-] ZINC000413979042 942858812 /nfs/dbraw/zinc/85/88/12/942858812.db2.gz QBFWCYYRAOJMPF-INIZCTEOSA-N 0 0 364.467 3.594 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1cccc(O)c1)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000412378834 942863270 /nfs/dbraw/zinc/86/32/70/942863270.db2.gz MYAOJMPLRPQVHT-FFZOFVMBSA-N 0 0 366.417 3.810 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN(Cc1cccc(F)c1)C(C)C ZINC000434715329 942878263 /nfs/dbraw/zinc/87/82/63/942878263.db2.gz XSZFLJNWOYXEGN-UHFFFAOYSA-N 0 0 359.401 3.891 20 5 FHBDRN CCCN(C(=O)COc1cccc([N+](=O)[O-])c1)[C@H]1CCc2ccccc2C1 ZINC000509983402 942893410 /nfs/dbraw/zinc/89/34/10/942893410.db2.gz BLUFYONZXOHBNA-SFHVURJKSA-N 0 0 368.433 3.770 20 5 FHBDRN Cc1c(C(=O)N(CC(C)C)C2CCCC2)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000514323978 942898998 /nfs/dbraw/zinc/89/89/98/942898998.db2.gz UXZVLBDHDSTAQZ-UHFFFAOYSA-N 0 0 371.441 3.525 20 5 FHBDRN O=C(c1c[nH]c2ccc([N+](=O)[O-])cc12)N1CCC[C@H](CC(F)(F)F)C1 ZINC000421946552 942900424 /nfs/dbraw/zinc/90/04/24/942900424.db2.gz SWMNJJIKONARNE-SNVBAGLBSA-N 0 0 355.316 3.881 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)N1CCC[C@@H](CC(F)(F)F)C1 ZINC000421955566 942907305 /nfs/dbraw/zinc/90/73/05/942907305.db2.gz FULBAAOBCAIMJH-NSHDSACASA-N 0 0 362.373 3.878 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)Nc1cccc2c1OCC[C@@H]2O ZINC000183838733 942908762 /nfs/dbraw/zinc/90/87/62/942908762.db2.gz UIHAVAKIUWPXRU-AWEZNQCLSA-N 0 0 363.757 3.708 20 5 FHBDRN CC[C@H]1CN(C(=O)c2cccc3c(=O)c4ccccc4[nH]c23)C[C@H](CC)O1 ZINC000421961165 942909195 /nfs/dbraw/zinc/90/91/95/942909195.db2.gz FTUIANXIGGGYMW-GJZGRUSLSA-N 0 0 364.445 3.711 20 5 FHBDRN C[C@@H](CNC(=O)c1c[nH]c2cccc([N+](=O)[O-])c21)Oc1ccc(Cl)cc1 ZINC000430103198 942915481 /nfs/dbraw/zinc/91/54/81/942915481.db2.gz RNPXCGRDOWBPBU-NSHDSACASA-N 0 0 373.796 3.927 20 5 FHBDRN C[C@@H](CNC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc21)Oc1ccc(Cl)cc1 ZINC000430107046 942919273 /nfs/dbraw/zinc/91/92/73/942919273.db2.gz SKWJAYCMYHMXLN-NSHDSACASA-N 0 0 373.796 3.927 20 5 FHBDRN CCC[C@@H](Cc1ccccc1)N(CCC)C(=O)c1nn(C)cc1[N+](=O)[O-] ZINC000503029724 942921288 /nfs/dbraw/zinc/92/12/88/942921288.db2.gz SUPCPHQWNCIBFF-INIZCTEOSA-N 0 0 358.442 3.592 20 5 FHBDRN CN([C@@H]1CCC[C@H]1c1ccccc1)S(=O)(=O)Cc1ccccc1[N+](=O)[O-] ZINC000416540148 942931667 /nfs/dbraw/zinc/93/16/67/942931667.db2.gz GRYACHFLCYWGPE-PKOBYXMFSA-N 0 0 374.462 3.693 20 5 FHBDRN CN(C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)C1CC(c2ccccc2)C1 ZINC000363880386 942942734 /nfs/dbraw/zinc/94/27/34/942942734.db2.gz VLPMEOZEKPRNSI-UHFFFAOYSA-N 0 0 355.350 3.521 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])Nc1ccc2c(c1)C(=O)CCCC2 ZINC000422036255 942949329 /nfs/dbraw/zinc/94/93/29/942949329.db2.gz IIOZYAOZZSGZIB-UHFFFAOYSA-N 0 0 353.378 3.555 20 5 FHBDRN CN(C1CC(C)(C)C1)S(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000416549770 942949521 /nfs/dbraw/zinc/94/95/21/942949521.db2.gz DJPXBRUXKFNFFS-UHFFFAOYSA-N 0 0 367.254 3.711 20 5 FHBDRN COc1ccccc1C1(CNC(=O)Nc2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000503068119 942950370 /nfs/dbraw/zinc/95/03/70/942950370.db2.gz ITQRUPUGUWKTAG-UHFFFAOYSA-N 0 0 355.394 3.765 20 5 FHBDRN Cc1noc(-c2ccccc2)c1NC(=O)NCc1ccccc1[N+](=O)[O-] ZINC000126447053 942959358 /nfs/dbraw/zinc/95/93/58/942959358.db2.gz FZKYLWVDZHQPBY-UHFFFAOYSA-N 0 0 352.350 3.880 20 5 FHBDRN C[C@H]1CCCC[C@@H]1OCCNC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000503097877 942984680 /nfs/dbraw/zinc/98/46/80/942984680.db2.gz GXKBEPHAWGWISV-NHYWBVRUSA-N 0 0 355.822 3.965 20 5 FHBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)N1C[C@@H](c2ccccc2)C2(CCC2)C1 ZINC000416582097 942987322 /nfs/dbraw/zinc/98/73/22/942987322.db2.gz AQOPHMVQBHIEHL-INIZCTEOSA-N 0 0 372.446 3.553 20 5 FHBDRN CC[C@@H](CC(F)(F)F)NC(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000545463870 942991531 /nfs/dbraw/zinc/99/15/31/942991531.db2.gz GNSUVJKLMWVLSE-UWVGGRQHSA-N 0 0 350.362 3.923 20 5 FHBDRN CC(C)CCSc1ccc(C(=O)N2CC[C@]23CCOC3)cc1[N+](=O)[O-] ZINC000422085793 942992949 /nfs/dbraw/zinc/99/29/49/942992949.db2.gz HCBAWCIUQOXCNT-GOSISDBHSA-N 0 0 364.467 3.738 20 5 FHBDRN CCN(Cc1nc2cc([N+](=O)[O-])ccc2o1)Cc1ccc(OC)cc1OC ZINC000434835364 942993728 /nfs/dbraw/zinc/99/37/28/942993728.db2.gz BEPDLYHVPXCECU-UHFFFAOYSA-N 0 0 371.393 3.775 20 5 FHBDRN CC(C)OCC(C)(C)NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000414001364 943012300 /nfs/dbraw/zinc/01/23/00/943012300.db2.gz PGQUOQRBGDZUMU-UHFFFAOYSA-N 0 0 363.439 3.652 20 5 FHBDRN Cc1ccc(NC(=O)c2cc([N+](=O)[O-])c(F)cc2N)cc1-c1ncco1 ZINC000367125287 943012683 /nfs/dbraw/zinc/01/26/83/943012683.db2.gz DJWABFGMRLEHGW-UHFFFAOYSA-N 0 0 356.313 3.532 20 5 FHBDRN CCCc1ccc(C(=O)COc2cc(C(=O)OC)ccc2[N+](=O)[O-])cc1 ZINC000514434156 943014171 /nfs/dbraw/zinc/01/41/71/943014171.db2.gz CWUXPVLAOGRDPQ-UHFFFAOYSA-N 0 0 357.362 3.596 20 5 FHBDRN CCCNC(=O)CNc1cc([N+](=O)[O-])ccc1Sc1cccs1 ZINC000434878464 943025693 /nfs/dbraw/zinc/02/56/93/943025693.db2.gz DBZWJUMZKQFLHG-UHFFFAOYSA-N 0 0 351.453 3.746 20 5 FHBDRN O=[N+]([O-])c1cnn(CCN2CCc3cc(-c4cccc(F)c4)ccc32)c1 ZINC001167948816 943027930 /nfs/dbraw/zinc/02/79/30/943027930.db2.gz CSEHQCYBDAFHEW-UHFFFAOYSA-N 0 0 352.369 3.660 20 5 FHBDRN Cc1c(CC(=O)Nc2c(-c3ccc(F)cc3)ncn2C)cccc1[N+](=O)[O-] ZINC000163982892 943033850 /nfs/dbraw/zinc/03/38/50/943033850.db2.gz JQAFRXGIXIPEFK-UHFFFAOYSA-N 0 0 368.368 3.624 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CC[C@H](c2ccccc2)[C@H]1C ZINC000434901220 943038102 /nfs/dbraw/zinc/03/81/02/943038102.db2.gz TUVNFSYFENRJME-WBVHZDCISA-N 0 0 353.422 3.720 20 5 FHBDRN O=C1c2cc(Cl)c(Cl)cc2C(=O)N1Cc1c(F)cccc1[N+](=O)[O-] ZINC000505571439 943050410 /nfs/dbraw/zinc/05/04/10/943050410.db2.gz ZQLVPVDUOOZPJB-UHFFFAOYSA-N 0 0 369.135 3.837 20 5 FHBDRN C[C@@H](c1ccccc1[N+](=O)[O-])N(C)CC(=O)N(C)[C@@H](C)c1ccccc1 ZINC000503190391 943050787 /nfs/dbraw/zinc/05/07/87/943050787.db2.gz QDDMATXSDRCYMW-HOTGVXAUSA-N 0 0 355.438 3.807 20 5 FHBDRN CC(C)(NC(=O)NC[C@H]1CC12CCSCC2)c1ccc([N+](=O)[O-])cc1 ZINC000422229632 943053652 /nfs/dbraw/zinc/05/36/52/943053652.db2.gz QSUBLDFONIUMKP-CQSZACIVSA-N 0 0 363.483 3.662 20 5 FHBDRN O=C(Nc1n[nH]c2ccc([N+](=O)[O-])cc21)c1cc(-c2ccccc2)ns1 ZINC000536254779 943054029 /nfs/dbraw/zinc/05/40/29/943054029.db2.gz OAQVYGIRKWQNDJ-UHFFFAOYSA-N 0 0 365.374 3.847 20 5 FHBDRN C[C@H](NC(=O)N1CCC[C@@H](Oc2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000416708497 943056639 /nfs/dbraw/zinc/05/66/39/943056639.db2.gz SAVUSZWOMJHGDG-DOTOQJQBSA-N 0 0 369.421 3.909 20 5 FHBDRN COc1cc(C(=O)Oc2ccccc2OC(F)F)c([N+](=O)[O-])cc1F ZINC001125889967 943074177 /nfs/dbraw/zinc/07/41/77/943074177.db2.gz BAZJSJBFAXKYDR-UHFFFAOYSA-N 0 0 357.240 3.563 20 5 FHBDRN Cc1ccc(OCCC(=O)N2CCCc3ccc([N+](=O)[O-])cc32)c(C)c1 ZINC000509959219 943081339 /nfs/dbraw/zinc/08/13/39/943081339.db2.gz PWFGEQZETJLSMO-UHFFFAOYSA-N 0 0 354.406 3.960 20 5 FHBDRN C[C@H](CCNC(=O)c1cc2c(cc1[N+](=O)[O-])OCCCO2)CC(C)(C)C ZINC001269250953 943094439 /nfs/dbraw/zinc/09/44/39/943094439.db2.gz LFKDBNADCGENIN-CYBMUJFWSA-N 0 0 364.442 3.948 20 5 FHBDRN CS(=O)(=O)c1ccc(N2CCC[C@H]2/C=C/c2ccccc2)c([N+](=O)[O-])c1 ZINC000503277341 943096931 /nfs/dbraw/zinc/09/69/31/943096931.db2.gz XWLXWHDFADIYMK-SCOAYWHSSA-N 0 0 372.446 3.681 20 5 FHBDRN COc1cc(C2(C(=O)N3CCc4ccc([N+](=O)[O-])cc43)CCC2)ccc1C ZINC000503298851 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/nfs/dbraw/zinc/52/71/59/943527159.db2.gz KZQRDBUTNFYTRJ-UHFFFAOYSA-N 0 0 354.406 3.933 20 5 FHBDRN C[C@H](COc1ccc(F)cc1F)NC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000584754580 943536750 /nfs/dbraw/zinc/53/67/50/943536750.db2.gz BNVDHTNNGRNDGC-VXGBXAGGSA-N 0 0 364.348 3.560 20 5 FHBDRN Cc1cc(N2C[C@H](C)O[C@]3(CCO[C@H]3C)C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000515156628 943537682 /nfs/dbraw/zinc/53/76/82/943537682.db2.gz YYUMWPCWSISHFJ-MQIPJXDCSA-N 0 0 374.359 3.695 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1)[C@H](NCc1nccc(C(F)(F)F)n1)CCCC2 ZINC000417358075 943538797 /nfs/dbraw/zinc/53/87/97/943538797.db2.gz HMTRAVNPGHTRAI-CQSZACIVSA-N 0 0 366.343 3.961 20 5 FHBDRN CC(C)(C)Oc1cccc(CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])n1 ZINC000504188230 943541360 /nfs/dbraw/zinc/54/13/60/943541360.db2.gz ULBVCYZQRWUYNA-UHFFFAOYSA-N 0 0 363.801 3.751 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@](C)(CO)Cc1ccccc1 ZINC000515190492 943545939 /nfs/dbraw/zinc/54/59/39/943545939.db2.gz CRZJDIDYVORCHK-FQEVSTJZSA-N 0 0 371.437 3.520 20 5 FHBDRN Cc1cc(C)cc([C@H]2NC(=O)N([C@H](C)c3ccc(C)c([N+](=O)[O-])c3)C2=O)c1 ZINC000431940509 943551024 /nfs/dbraw/zinc/55/10/24/943551024.db2.gz VAAHHZCMHLCAAU-RDTXWAMCSA-N 0 0 367.405 3.874 20 5 FHBDRN CCn1cc(NC(=O)c2ccc(N3C[C@H](C)C[C@@H](C)C3)c([N+](=O)[O-])c2)cn1 ZINC000515193207 943558128 /nfs/dbraw/zinc/55/81/28/943558128.db2.gz ABYHDMJHHWLJNA-ZIAGYGMSSA-N 0 0 371.441 3.546 20 5 FHBDRN CN(C)[C@@H](c1nc(-c2cccc([N+](=O)[O-])c2)no1)c1cccc(Cl)c1 ZINC000504252765 943563754 /nfs/dbraw/zinc/56/37/54/943563754.db2.gz KEUVPSLYSRHHCN-OAHLLOKOSA-N 0 0 358.785 3.949 20 5 FHBDRN COC(=O)[C@H](C)c1ccc(NC(=O)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000417391985 943568863 /nfs/dbraw/zinc/56/88/63/943568863.db2.gz MDYLTRHYQTUDCG-OLZOCXBDSA-N 0 0 371.393 3.754 20 5 FHBDRN COc1cc(NC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)c(C)c(OC)c1 ZINC000504267000 943574805 /nfs/dbraw/zinc/57/48/05/943574805.db2.gz WVGYAJWERZITLW-UHFFFAOYSA-N 0 0 355.350 3.654 20 5 FHBDRN Cc1ccnn1-c1ccc(C(=O)N2c3ccc([N+](=O)[O-])cc3C[C@@H]2C)cc1 ZINC000504293350 943576570 /nfs/dbraw/zinc/57/65/70/943576570.db2.gz NPWMTSXDSRLGEW-AWEZNQCLSA-N 0 0 362.389 3.680 20 5 FHBDRN CCOc1cccc([C@@H]2C[C@H]2NC(=O)Nc2ccc([N+](=O)[O-])cc2F)c1 ZINC000435736265 943589222 /nfs/dbraw/zinc/58/92/22/943589222.db2.gz VVDJMWUYJWDLJL-WMLDXEAASA-N 0 0 359.357 3.810 20 5 FHBDRN C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)CCCOCCc1ccccc1 ZINC000504303933 943591569 /nfs/dbraw/zinc/59/15/69/943591569.db2.gz KTJFBPMGDVJIFC-MRXNPFEDSA-N 0 0 368.433 3.912 20 5 FHBDRN COc1cc(COc2ccc(C(=O)N3CCCC3)cc2)c([N+](=O)[O-])cc1F ZINC000183963813 943600283 /nfs/dbraw/zinc/60/02/83/943600283.db2.gz CVKDMZPJZAWESA-UHFFFAOYSA-N 0 0 374.368 3.558 20 5 FHBDRN Cc1cc(-c2nc(CC(=O)Nc3ccc(Cl)cc3)no2)cc([N+](=O)[O-])c1 ZINC000504351065 943601560 /nfs/dbraw/zinc/60/15/60/943601560.db2.gz VYSUBDDOLCFRQI-UHFFFAOYSA-N 0 0 372.768 3.788 20 5 FHBDRN Cc1cc(OCC(=O)Nc2cccc3ccc(O)cc32)ccc1[N+](=O)[O-] ZINC000435758144 943606554 /nfs/dbraw/zinc/60/65/54/943606554.db2.gz DXRXIQOOTWQZAM-UHFFFAOYSA-N 0 0 352.346 3.780 20 5 FHBDRN CCOC(=O)c1cc(N2CCC(c3ccc(O)cc3)CC2)ccc1[N+](=O)[O-] ZINC000468718061 943607895 /nfs/dbraw/zinc/60/78/95/943607895.db2.gz QOEIRQQDTROMPY-UHFFFAOYSA-N 0 0 370.405 3.861 20 5 FHBDRN C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1ccc(OCC2CC2)cc1 ZINC000504376974 943608488 /nfs/dbraw/zinc/60/84/88/943608488.db2.gz SFQWOJQQABQOLH-ZDUSSCGKSA-N 0 0 352.390 3.975 20 5 FHBDRN CC[C@H](CC(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1)c1ccccc1 ZINC000504389251 943618254 /nfs/dbraw/zinc/61/82/54/943618254.db2.gz VRZWXXRSTXDKQH-QGZVFWFLSA-N 0 0 367.449 3.827 20 5 FHBDRN Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N(CC(F)F)C1CC1 ZINC000584794380 943618796 /nfs/dbraw/zinc/61/87/96/943618796.db2.gz SVBJKCPKSFUKKV-UHFFFAOYSA-N 0 0 363.158 3.535 20 5 FHBDRN O=C(Nc1ccc(OCC2(O)CCCC2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000504417010 943623150 /nfs/dbraw/zinc/62/31/50/943623150.db2.gz WXSDRYKSFAYXIU-UHFFFAOYSA-N 0 0 356.378 3.531 20 5 FHBDRN CCOc1ccc(NC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)c(F)c1 ZINC000417492460 943638428 /nfs/dbraw/zinc/63/84/28/943638428.db2.gz WKZCONBUBFWWKF-UHFFFAOYSA-N 0 0 359.357 3.723 20 5 FHBDRN CCn1c(SCc2c(F)cccc2[N+](=O)[O-])nnc1-c1ccncc1 ZINC000504535862 943651339 /nfs/dbraw/zinc/65/13/39/943651339.db2.gz IGPSATPSDBATRQ-UHFFFAOYSA-N 0 0 359.386 3.700 20 5 FHBDRN C[C@@H]1CCC[C@@H](NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])C1 ZINC000048189282 943664233 /nfs/dbraw/zinc/66/42/33/943664233.db2.gz XLVBHAIZXLYCJV-GHMZBOCLSA-N 0 0 360.332 3.844 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1F)Nc1ncccc1-c1ccccc1 ZINC000504579594 943694659 /nfs/dbraw/zinc/69/46/59/943694659.db2.gz XSOXIQUPTBTSPV-UHFFFAOYSA-N 0 0 351.337 3.977 20 5 FHBDRN Cn1c(SCc2ccc(Br)cc2[N+](=O)[O-])nnc1C1CC1 ZINC000424099892 943718561 /nfs/dbraw/zinc/71/85/61/943718561.db2.gz NBWASTSEKHVNMX-UHFFFAOYSA-N 0 0 369.244 3.656 20 5 FHBDRN CCN(C)C(=O)c1cccc(NC(=O)c2c(Cl)cccc2[N+](=O)[O-])c1 ZINC000517768968 943719452 /nfs/dbraw/zinc/71/94/52/943719452.db2.gz XAQDYHJXRKBKFT-UHFFFAOYSA-N 0 0 361.785 3.592 20 5 FHBDRN CCO[C@H](C)c1nccn1Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000424089063 943725259 /nfs/dbraw/zinc/72/52/59/943725259.db2.gz IGEGLNNRXSKZQX-SNVBAGLBSA-N 0 0 354.204 3.700 20 5 FHBDRN Cc1nc(C2CCC2)nn1Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000424096333 943730083 /nfs/dbraw/zinc/73/00/83/943730083.db2.gz ZPNKJLZXFAQRMJ-UHFFFAOYSA-N 0 0 351.204 3.573 20 5 FHBDRN Cc1ccc([C@@H](C)N2C(=O)CN(Cc3ccc(F)cc3)C2=O)cc1[N+](=O)[O-] ZINC000431957364 943736313 /nfs/dbraw/zinc/73/63/13/943736313.db2.gz WMSAGAHNGMTZJH-CYBMUJFWSA-N 0 0 371.368 3.568 20 5 FHBDRN COc1cc(C(=O)N2CCc3c2cccc3[N+](=O)[O-])cc(OC)c1C(C)C ZINC000511638166 943739443 /nfs/dbraw/zinc/73/94/43/943739443.db2.gz FGDQBCWBFYUWNP-UHFFFAOYSA-N 0 0 370.405 3.938 20 5 FHBDRN COc1c(C)cc(CN(C)C(=O)COc2ccc([N+](=O)[O-])c(C)c2)cc1C ZINC000431955578 943740954 /nfs/dbraw/zinc/74/09/54/943740954.db2.gz VRMRJLUWOJFMNZ-UHFFFAOYSA-N 0 0 372.421 3.566 20 5 FHBDRN O=C1CC[C@H](CSCc2ccc(Br)cc2[N+](=O)[O-])CCN1 ZINC000424119746 943742234 /nfs/dbraw/zinc/74/22/34/943742234.db2.gz GBIXJFXEPQDDEI-JTQLQIEISA-N 0 0 373.272 3.507 20 5 FHBDRN O=C(c1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCc2cccc(F)c2C1 ZINC000504695487 943746904 /nfs/dbraw/zinc/74/69/04/943746904.db2.gz PEZFEWYJEQVPBP-UHFFFAOYSA-N 0 0 368.286 3.951 20 5 FHBDRN COc1cc(CSC[C@@H](OC)C2CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000424149010 943752439 /nfs/dbraw/zinc/75/24/39/943752439.db2.gz GIHMCIAXIYEMQS-CQSZACIVSA-N 0 0 363.382 3.863 20 5 FHBDRN O=C(CSc1ccccc1[N+](=O)[O-])N[C@H]1CCCOc2ccccc21 ZINC000504709768 943753937 /nfs/dbraw/zinc/75/39/37/943753937.db2.gz VZOLBDDDVJJPAI-AWEZNQCLSA-N 0 0 358.419 3.717 20 5 FHBDRN C[C@@H]1C[C@@H](C)CN(C(=O)c2cccc3c(=O)c4cccc(F)c4[nH]c23)C1 ZINC000435815407 943772742 /nfs/dbraw/zinc/77/27/42/943772742.db2.gz FHQFFJKPISMKMF-CHWSQXEVSA-N 0 0 352.409 3.939 20 5 FHBDRN CCCCO[C@@H]1C[C@@H](N(C)C(=O)c2cccc(OC)c2[N+](=O)[O-])C1(C)C ZINC000435818152 943774295 /nfs/dbraw/zinc/77/42/95/943774295.db2.gz LKVALOABUCQFTG-HZPDHXFCSA-N 0 0 364.442 3.659 20 5 FHBDRN COc1cccc(C(=O)N2CC[C@H](Cc3ccccc3)[C@H]2C)c1[N+](=O)[O-] ZINC000435818459 943775156 /nfs/dbraw/zinc/77/51/56/943775156.db2.gz MPBGCNWPQLZAJZ-GDBMZVCRSA-N 0 0 354.406 3.697 20 5 FHBDRN COc1cc(C(=O)NCc2ccc(OC3CCCC3)cc2)ccc1[N+](=O)[O-] ZINC000504744675 943777617 /nfs/dbraw/zinc/77/76/17/943777617.db2.gz CXHPAKSTOZCJHZ-UHFFFAOYSA-N 0 0 370.405 3.855 20 5 FHBDRN COc1cccc(C(=O)N2CCc3c(F)cc(F)cc3[C@H]2C)c1[N+](=O)[O-] ZINC000435808052 943782653 /nfs/dbraw/zinc/78/26/53/943782653.db2.gz KQHWXYZPSCNYIV-SNVBAGLBSA-N 0 0 362.332 3.641 20 5 FHBDRN CCCc1n[nH]c(C(=O)N[C@H]2C[C@H](c3cccc(Cl)c3)C2)c1[N+](=O)[O-] ZINC000437411680 943784620 /nfs/dbraw/zinc/78/46/20/943784620.db2.gz NZHHILYITNAPIG-AULYBMBSSA-N 0 0 362.817 3.600 20 5 FHBDRN Cc1ccccc1C1=CCN(C(=O)COc2ccc([N+](=O)[O-])c(C)c2)C1 ZINC000435811551 943786405 /nfs/dbraw/zinc/78/64/05/943786405.db2.gz XGGMFFRSHBFYON-UHFFFAOYSA-N 0 0 352.390 3.516 20 5 FHBDRN C[C@H]([C@@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C(=O)[O-])C1CC1 ZINC000417639317 943788693 /nfs/dbraw/zinc/78/86/93/943788693.db2.gz LUHKNOSPKGROGF-APPDUMDISA-N 0 0 360.435 3.912 20 5 FHBDRN COC(=O)c1cnc([C@@H](C)NCc2ccc(C(C)C)c([N+](=O)[O-])c2)s1 ZINC000424208445 943788770 /nfs/dbraw/zinc/78/87/70/943788770.db2.gz ZPQKRGALRYBUNO-LLVKDONJSA-N 0 0 363.439 3.812 20 5 FHBDRN CCc1nn(C)c(Nc2ccc(Oc3ccc(CO)cc3)cc2)c1[N+](=O)[O-] ZINC000515325132 943789195 /nfs/dbraw/zinc/78/91/95/943789195.db2.gz KVJZDKWXKYJBDY-UHFFFAOYSA-N 0 0 368.393 3.919 20 5 FHBDRN C[C@@H](CC(C)(C)[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)C(=O)[O-] ZINC000417640471 943789797 /nfs/dbraw/zinc/78/97/97/943789797.db2.gz YJWOEIBTOUPMAU-NSHDSACASA-N 0 0 363.439 3.697 20 5 FHBDRN COc1cccc(CN(C)C(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)c1 ZINC000435835982 943790818 /nfs/dbraw/zinc/79/08/18/943790818.db2.gz PGUOHYHIFDHBCL-UHFFFAOYSA-N 0 0 372.424 3.962 20 5 FHBDRN O=C(N[C@H]1C[C@H](c2ccccc2)C1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000437418415 943791826 /nfs/dbraw/zinc/79/18/26/943791826.db2.gz MJUPHHLTYURYJS-JCNLHEQBSA-N 0 0 351.406 3.845 20 5 FHBDRN CC(=O)Nc1cc(Cl)ccc1C(=O)OCc1ccc([N+](=O)[O-])c(F)c1 ZINC000783405261 943796977 /nfs/dbraw/zinc/79/69/77/943796977.db2.gz ORWKHFMETQKUDU-UHFFFAOYSA-N 0 0 366.732 3.703 20 5 FHBDRN COc1cccc(C(=O)N[C@@H](C2CCCCC2)C(F)(F)F)c1[N+](=O)[O-] ZINC000435825956 943797138 /nfs/dbraw/zinc/79/71/38/943797138.db2.gz MOVXZCPCYJAXOK-AWEZNQCLSA-N 0 0 360.332 3.844 20 5 FHBDRN O=C([O-])[C@@H]1CCC[C@@H]1C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000417651593 943798176 /nfs/dbraw/zinc/79/81/76/943798176.db2.gz XJUAGPUDUHBYNR-TZMCWYRMSA-N 0 0 360.435 3.914 20 5 FHBDRN COc1cccc(C(=O)NCc2ccc(C)cc2OC(C)C)c1[N+](=O)[O-] ZINC000435828520 943799630 /nfs/dbraw/zinc/79/96/30/943799630.db2.gz UMRSUADZOWMULY-UHFFFAOYSA-N 0 0 358.394 3.629 20 5 FHBDRN CCCN(C(=O)c1cccc(OC)c1[N+](=O)[O-])[C@H]1C[C@H](OCC)C1(C)C ZINC000435862210 943801215 /nfs/dbraw/zinc/80/12/15/943801215.db2.gz MRMVTDLSOXIEEP-HOTGVXAUSA-N 0 0 364.442 3.659 20 5 FHBDRN COc1cc(C(=O)N[C@H]2C[C@H](c3cccc(Cl)c3)C2)ccc1[N+](=O)[O-] ZINC000437431223 943809505 /nfs/dbraw/zinc/80/95/05/943809505.db2.gz YRTHAXYXYXMHDU-CTYIDZIISA-N 0 0 360.797 3.933 20 5 FHBDRN COC(=O)c1cc(NC(=O)C2CCC(C(F)(F)F)CC2)cc([N+](=O)[O-])c1 ZINC000435859774 943813371 /nfs/dbraw/zinc/81/33/71/943813371.db2.gz BLMSBZFGKWRBKE-UHFFFAOYSA-N 0 0 374.315 3.689 20 5 FHBDRN CC[C@H](C(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1)[N@H+](C)Cc1ccccc1 ZINC000516897982 943814638 /nfs/dbraw/zinc/81/46/38/943814638.db2.gz KMQXBXIYIMGSNI-VQIMIIECSA-N 0 0 369.465 3.991 20 5 FHBDRN COc1cccc(C(=O)Nc2cccc(-c3nccc(C)n3)c2)c1[N+](=O)[O-] ZINC000435865737 943820421 /nfs/dbraw/zinc/82/04/21/943820421.db2.gz CWQARAXKNXQIBN-UHFFFAOYSA-N 0 0 364.361 3.621 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1C[C@@H]1c1ccccc1OC(F)F ZINC000437456396 943825938 /nfs/dbraw/zinc/82/59/38/943825938.db2.gz XRRXQOZPLGCTQX-OLZOCXBDSA-N 0 0 362.332 3.791 20 5 FHBDRN CCC(O)(CC)C(C)(C)CN[C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000566501999 943838780 /nfs/dbraw/zinc/83/87/80/943838780.db2.gz WHIAMSPULNDFDN-KRWDZBQOSA-N 0 0 374.485 3.585 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1N1CCC2(C[C@@H]2C(=O)N2CCCCC2)CC1 ZINC000505720941 943845124 /nfs/dbraw/zinc/84/51/24/943845124.db2.gz RKJIZLQCPPHDNI-MRXNPFEDSA-N 0 0 357.454 3.522 20 5 FHBDRN Cc1nc2ccc(Cl)cn2c1NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC001269632312 943863093 /nfs/dbraw/zinc/86/30/93/943863093.db2.gz PXDGXRINMJUJBB-LSDHHAIUSA-N 0 0 370.796 3.947 20 5 FHBDRN C[C@@H]1CC(CCNC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)C[C@@H](C)O1 ZINC000584482306 943863481 /nfs/dbraw/zinc/86/34/81/943863481.db2.gz NIOUYJNSOQTYKR-VXGBXAGGSA-N 0 0 369.849 3.641 20 5 FHBDRN Cc1ccccc1[C@@H]1CCN(C(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)C1 ZINC000504875124 943865309 /nfs/dbraw/zinc/86/53/09/943865309.db2.gz GQDXRHPJBFZVQP-QGZVFWFLSA-N 0 0 363.417 3.874 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])N[C@@H]1CC[C@H](c2ccccc2F)C1 ZINC000435938049 943871337 /nfs/dbraw/zinc/87/13/37/943871337.db2.gz QJDGQFNAGYCPOL-UONOGXRCSA-N 0 0 357.385 3.598 20 5 FHBDRN CSc1ccc(CCNC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)cc1 ZINC000437517097 943876924 /nfs/dbraw/zinc/87/69/24/943876924.db2.gz SNNLAURGPYPBFE-UHFFFAOYSA-N 0 0 355.419 3.771 20 5 FHBDRN CC(C)c1[nH]nc(-c2nc(C3(c4ccc(F)cc4)CC3)no2)c1[N+](=O)[O-] ZINC000424364203 943877852 /nfs/dbraw/zinc/87/78/52/943877852.db2.gz QOPHWNNAZSYVKD-UHFFFAOYSA-N 0 0 357.345 3.710 20 5 FHBDRN CCOc1ccc(C(=O)N[C@@H]2CCCOc3ccc(F)cc32)cc1[N+](=O)[O-] ZINC000053365636 943895253 /nfs/dbraw/zinc/89/52/53/943895253.db2.gz XNHKSFSFTYKYHV-OAHLLOKOSA-N 0 0 374.368 3.776 20 5 FHBDRN CC(=O)N(c1ccc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2)cc1)[C@H]1C[C@@H]1C ZINC000516991581 943895592 /nfs/dbraw/zinc/89/55/92/943895592.db2.gz XRARVGXMQPFQFT-VOJFVSQTSA-N 0 0 371.368 3.748 20 5 FHBDRN COc1cccc(C(=O)Nc2ccc(C(=O)C3CCC3)cc2)c1[N+](=O)[O-] ZINC000435974202 943896874 /nfs/dbraw/zinc/89/68/74/943896874.db2.gz HHJUIHDAANWTCD-UHFFFAOYSA-N 0 0 354.362 3.839 20 5 FHBDRN Cc1ccsc1[C@H](CO)NCc1ccc(Br)cc1[N+](=O)[O-] ZINC000425432433 943907715 /nfs/dbraw/zinc/90/77/15/943907715.db2.gz KPDCSTAAHCKTDO-LBPRGKRZSA-N 0 0 371.256 3.550 20 5 FHBDRN CCOC(=O)c1cc(NC(=O)c2c(C)cccc2[N+](=O)[O-])c(F)cc1C ZINC000515470202 943909763 /nfs/dbraw/zinc/90/97/63/943909763.db2.gz MHRGQTMQDBCXEG-UHFFFAOYSA-N 0 0 360.341 3.780 20 5 FHBDRN COc1ccc(-c2ccc(C[N@@H+]3CCC[C@@H](C)[C@H]3C(=O)[O-])o2)c([N+](=O)[O-])c1 ZINC000424414103 943911260 /nfs/dbraw/zinc/91/12/60/943911260.db2.gz GXPZNNWWPMFHHY-XIKOKIGWSA-N 0 0 374.393 3.549 20 5 FHBDRN O=C(NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CCc2ccc(F)cc21 ZINC000517003755 943919050 /nfs/dbraw/zinc/91/90/50/943919050.db2.gz ZSWQRDCZKDYCNQ-UHFFFAOYSA-N 0 0 368.368 3.530 20 5 FHBDRN Cc1oc(Br)cc1C(=O)N1c2ccc([N+](=O)[O-])cc2C[C@@H]1C ZINC000425437558 943919824 /nfs/dbraw/zinc/91/98/24/943919824.db2.gz ZWXYOUYNEUKXNV-QMMMGPOBSA-N 0 0 365.183 3.850 20 5 FHBDRN Cc1ccc(OCCCNC(=O)CSc2ccc([N+](=O)[O-])cc2)cc1 ZINC000504943401 943920849 /nfs/dbraw/zinc/92/08/49/943920849.db2.gz KJBOUXFGMBUTLP-UHFFFAOYSA-N 0 0 360.435 3.581 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)Nc1cccc2c1OCCC2=O ZINC000504952430 943932372 /nfs/dbraw/zinc/93/23/72/943932372.db2.gz XWSQGOILJJFFFH-UHFFFAOYSA-N 0 0 354.362 3.738 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)N1CCC(Cc2ccc(F)cc2)CC1 ZINC000504953683 943932961 /nfs/dbraw/zinc/93/29/61/943932961.db2.gz MZXIMGFWTSLHMK-UHFFFAOYSA-N 0 0 357.385 3.532 20 5 FHBDRN Cc1cccc(C(=O)N[C@@H](C)c2nc(C(F)(F)F)cs2)c1[N+](=O)[O-] ZINC000278829444 943938689 /nfs/dbraw/zinc/93/86/89/943938689.db2.gz UUYKKCXVHKVVSQ-QMMMGPOBSA-N 0 0 359.329 3.870 20 5 FHBDRN COCC[C@H](NC(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1)c1ccco1 ZINC000504963886 943938749 /nfs/dbraw/zinc/93/87/49/943938749.db2.gz UEEAYKYDCDGSLM-HNNXBMFYSA-N 0 0 360.410 3.993 20 5 FHBDRN COc1cccc(C(=O)NCCc2c(C)oc3ccccc32)c1[N+](=O)[O-] ZINC000436030647 943951634 /nfs/dbraw/zinc/95/16/34/943951634.db2.gz VXKRZCXMYLEKHN-UHFFFAOYSA-N 0 0 354.362 3.631 20 5 FHBDRN COCc1ccc([C@@H]2CCCN2C(=O)[C@H](C)c2cccc([N+](=O)[O-])c2)o1 ZINC000515506165 943956035 /nfs/dbraw/zinc/95/60/35/943956035.db2.gz CMPWOFUAQCQEJF-DYVFJYSZSA-N 0 0 358.394 3.801 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1CN1CCC([C@H]2CCCO2)CC1 ZINC000425444243 943956189 /nfs/dbraw/zinc/95/61/89/943956189.db2.gz MCOUKBTWZCHIIT-MRXNPFEDSA-N 0 0 369.259 3.748 20 5 FHBDRN COc1cn(-c2ccccc2)nc1-c1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000504986921 943957498 /nfs/dbraw/zinc/95/74/98/943957498.db2.gz QJOFJLQIBXPWTD-UHFFFAOYSA-N 0 0 363.333 3.506 20 5 FHBDRN Cn1c(-c2cccc([N+](=O)[O-])c2)nnc1N1CCc2c(Cl)cccc2C1 ZINC000517059773 943958932 /nfs/dbraw/zinc/95/89/32/943958932.db2.gz YHTODJOZIWIYMF-UHFFFAOYSA-N 0 0 369.812 3.606 20 5 FHBDRN CC(C)(C)[C@@H](NS(=O)(=O)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000515524474 943976586 /nfs/dbraw/zinc/97/65/86/943976586.db2.gz GZZDYGMLSOPCLR-INIZCTEOSA-N 0 0 366.414 3.800 20 5 FHBDRN CSc1ccc(CCNC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000437631867 943978262 /nfs/dbraw/zinc/97/82/62/943978262.db2.gz DPVBNHYSVLJJEJ-CYBMUJFWSA-N 0 0 359.451 3.920 20 5 FHBDRN Cc1nc(-c2ccccc2)sc1[C@@H](C)NC(=O)c1cc([N+](=O)[O-])c[nH]1 ZINC000053424458 943983290 /nfs/dbraw/zinc/98/32/90/943983290.db2.gz DPRRIIBVFORTGV-SNVBAGLBSA-N 0 0 356.407 3.846 20 5 FHBDRN O=C(c1c[nH]c2ccc([N+](=O)[O-])cc12)N1CC[C@@H](c2c(F)cccc2F)C1 ZINC000184028247 943985099 /nfs/dbraw/zinc/98/50/99/943985099.db2.gz HMGQNWFJCPMBMS-LLVKDONJSA-N 0 0 371.343 3.984 20 5 FHBDRN CC(=O)Nc1ccc(/C=C/c2nc(-c3cccc([N+](=O)[O-])c3)no2)cc1 ZINC000505035996 943991301 /nfs/dbraw/zinc/99/13/01/943991301.db2.gz OWFXFAMUKNHVES-JXMROGBWSA-N 0 0 350.334 3.774 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2noc(-c3ccc(OC[C@H]4CCCO4)cc3)n2)c1 ZINC000505036280 943993460 /nfs/dbraw/zinc/99/34/60/943993460.db2.gz QDUKYFFGSYWKFB-QGZVFWFLSA-N 0 0 367.361 3.870 20 5 FHBDRN Cc1ccc(F)c(CN(C)C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)c1 ZINC000436072844 943994467 /nfs/dbraw/zinc/99/44/67/943994467.db2.gz SYVFTJKGLUPSPU-UHFFFAOYSA-N 0 0 368.368 3.500 20 5 FHBDRN Cc1cc(C(=O)N[C@H](c2nccs2)c2ccccc2)ccc1[N+](=O)[O-] ZINC000505038352 943995247 /nfs/dbraw/zinc/99/52/47/943995247.db2.gz BANUKXUVJDRFKX-INIZCTEOSA-N 0 0 353.403 3.879 20 5 FHBDRN Cc1ccc(F)c(CN(C)C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)c1 ZINC000436087051 944004901 /nfs/dbraw/zinc/00/49/01/944004901.db2.gz JTQHHFVNHMSVRB-UHFFFAOYSA-N 0 0 368.368 3.500 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)N[C@@H]1C[C@H]1c1c(F)cccc1Cl ZINC000437652382 944010276 /nfs/dbraw/zinc/01/02/76/944010276.db2.gz QSACELAHBIABRD-IUODEOHRSA-N 0 0 363.776 3.743 20 5 FHBDRN COCCc1cc(O)ccc1NC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000436096632 944028057 /nfs/dbraw/zinc/02/80/57/944028057.db2.gz GODIQPGGVFUMQZ-UHFFFAOYSA-N 0 0 365.773 3.787 20 5 FHBDRN Nc1cccc([N+](=O)[O-])c1C(=O)N1CC=C(c2ccccc2Cl)CC1 ZINC000500057417 944029073 /nfs/dbraw/zinc/02/90/73/944029073.db2.gz UPPWBNGRVWHLKV-UHFFFAOYSA-N 0 0 357.797 3.760 20 5 FHBDRN CC[C@@H]1CCCN1CC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000436097787 944029466 /nfs/dbraw/zinc/02/94/66/944029466.db2.gz IMZAZOTVPADXAZ-CYBMUJFWSA-N 0 0 360.439 3.531 20 5 FHBDRN COCC[C@@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(OC)cc1 ZINC000505090484 944031554 /nfs/dbraw/zinc/03/15/54/944031554.db2.gz FMYRVGOARPIOJQ-CYBMUJFWSA-N 0 0 374.393 3.551 20 5 FHBDRN Cc1nc([N+](=O)[O-])c(Br)n1CC(=O)c1cc(C)c(F)c(C)c1 ZINC000126561134 944038722 /nfs/dbraw/zinc/03/87/22/944038722.db2.gz BMZJAYNTUNLAND-UHFFFAOYSA-N 0 0 370.178 3.501 20 5 FHBDRN Nc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1CC=C(c2ccc(F)cc2)CC1 ZINC000500067499 944051348 /nfs/dbraw/zinc/05/13/48/944051348.db2.gz QCMRMNQUPOKCOV-HNNXBMFYSA-N 0 0 355.369 3.682 20 5 FHBDRN CCCc1nnc(NC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)s1 ZINC000436147456 944056089 /nfs/dbraw/zinc/05/60/89/944056089.db2.gz DCPSCSUYQBCQRO-UHFFFAOYSA-N 0 0 364.430 3.738 20 5 FHBDRN C[C@@H](NC(=O)N1CC2(CCC2)[C@H]1C1CCOCC1)c1ccccc1[N+](=O)[O-] ZINC000425477506 944057012 /nfs/dbraw/zinc/05/70/12/944057012.db2.gz AZFABGHHJFRWTK-RDTXWAMCSA-N 0 0 373.453 3.647 20 5 FHBDRN COC(=O)c1cc(NC(=O)c2cc(C)ccc2C2CC2)cc([N+](=O)[O-])c1 ZINC000424674951 944057830 /nfs/dbraw/zinc/05/78/30/944057830.db2.gz FABVLHUTAIRMOH-UHFFFAOYSA-N 0 0 354.362 3.820 20 5 FHBDRN CN(Cc1ccoc1)C(=O)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000436155532 944059948 /nfs/dbraw/zinc/05/99/48/944059948.db2.gz SFUNBDJZFWIMMJ-UHFFFAOYSA-N 0 0 350.349 3.686 20 5 FHBDRN C[C@@]1(CCc2ccccc2)CCN(C(=O)c2c(N)cccc2[N+](=O)[O-])C1 ZINC000500080443 944061788 /nfs/dbraw/zinc/06/17/88/944061788.db2.gz DUEBVGIWWPGBTD-HXUWFJFHSA-N 0 0 353.422 3.662 20 5 FHBDRN O=C(Nc1nc(C2CCC2)cs1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000436160016 944064617 /nfs/dbraw/zinc/06/46/17/944064617.db2.gz JSQWWYXONTUNBF-UHFFFAOYSA-N 0 0 369.406 3.757 20 5 FHBDRN CCc1ccnc(CNC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)c1 ZINC000437741714 944069173 /nfs/dbraw/zinc/06/91/73/944069173.db2.gz DEBPJQOLQNKPKZ-UHFFFAOYSA-N 0 0 357.413 3.569 20 5 FHBDRN CSc1c(F)cccc1C(=O)Nc1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000436168368 944071581 /nfs/dbraw/zinc/07/15/81/944071581.db2.gz XRLASAZBEAPYSP-UHFFFAOYSA-N 0 0 357.366 3.678 20 5 FHBDRN O=C(NCC1(c2ccc(F)cc2)CC1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000500085732 944071667 /nfs/dbraw/zinc/07/16/67/944071667.db2.gz ASZPXHJKETWTHM-UHFFFAOYSA-N 0 0 369.396 3.770 20 5 FHBDRN CC(=O)N(C)c1ccc(Nc2ccc([N+](=O)[O-])c(OC(F)F)c2)cc1 ZINC000092624329 944071787 /nfs/dbraw/zinc/07/17/87/944071787.db2.gz MQXBEIGBODHHAS-UHFFFAOYSA-N 0 0 351.309 3.923 20 5 FHBDRN O=C(Nc1cccc(-c2ncc3n2CCCC3)c1)c1ccc([N+](=O)[O-])o1 ZINC000436171276 944074300 /nfs/dbraw/zinc/07/43/00/944074300.db2.gz NPIIJQJOHGRWLE-UHFFFAOYSA-N 0 0 352.350 3.640 20 5 FHBDRN O=C1[C@H](Nc2cccc([N+](=O)[O-])c2)CCN1c1ccc(C(F)(F)F)cc1 ZINC000505768817 944085916 /nfs/dbraw/zinc/08/59/16/944085916.db2.gz KLJFVYZHFSOSEY-OAHLLOKOSA-N 0 0 365.311 3.831 20 5 FHBDRN CO[C@@]1(C)C[C@H](N(C)C(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1(C)C ZINC000437756614 944087852 /nfs/dbraw/zinc/08/78/52/944087852.db2.gz VGMQBCWFRZECPQ-BBRMVZONSA-N 0 0 374.359 3.889 20 5 FHBDRN Cc1sc(C(=O)N2CC(C)(C)O[C@@](C)(C(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000505768602 944093217 /nfs/dbraw/zinc/09/32/17/944093217.db2.gz KIONTWJHJIQBPV-CYBMUJFWSA-N 0 0 366.361 3.537 20 5 FHBDRN COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)NC[C@@H]2C[C@@H]2C)cc1 ZINC000032392509 944105205 /nfs/dbraw/zinc/10/52/05/944105205.db2.gz PCURRHCBNWNKKX-STQMWFEESA-N 0 0 356.378 3.782 20 5 FHBDRN CCc1cncc(C(=O)N(Cc2ccccc2[N+](=O)[O-])CC(F)(F)F)c1 ZINC000517229435 944108391 /nfs/dbraw/zinc/10/83/91/944108391.db2.gz SPFHTFYIMKCHMO-UHFFFAOYSA-N 0 0 367.327 3.757 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)c2[nH]nc3ccc(Cl)cc32)cc1[N+](=O)[O-] ZINC000500108388 944113150 /nfs/dbraw/zinc/11/31/50/944113150.db2.gz UXCYYMYLUNFVJY-JTQLQIEISA-N 0 0 358.785 3.924 20 5 FHBDRN O=C1NCCCN1c1cccc(Nc2ccc([N+](=O)[O-])c3cccnc23)c1 ZINC000092658216 944116674 /nfs/dbraw/zinc/11/66/74/944116674.db2.gz XYMDNFSTTBDTOC-UHFFFAOYSA-N 0 0 363.377 3.806 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1-c1noc(C2CCC(NC(=O)C3CC3)CC2)n1 ZINC000515707398 944131506 /nfs/dbraw/zinc/13/15/06/944131506.db2.gz HZQFTGDMMDZMCC-UHFFFAOYSA-N 0 0 370.409 3.506 20 5 FHBDRN C[C@@H]1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)[C@@H]2CCCC[C@@H]12 ZINC000515711097 944135750 /nfs/dbraw/zinc/13/57/50/944135750.db2.gz FTINWEVPNFKABJ-OSAQELSMSA-N 0 0 372.874 3.838 20 5 FHBDRN CC(C)c1ccc(CN2CCN(c3cccc(O)c3)CC2)cc1[N+](=O)[O-] ZINC000506136855 944136400 /nfs/dbraw/zinc/13/64/00/944136400.db2.gz LGQOSIVACSYVDW-UHFFFAOYSA-N 0 0 355.438 3.746 20 5 FHBDRN O=C(Nc1ccc(O[C@@H]2CCCC[C@@H]2O)cc1)c1cc(F)cc([N+](=O)[O-])c1 ZINC000505209188 944137659 /nfs/dbraw/zinc/13/76/59/944137659.db2.gz FPIXEHKSBMAOHZ-ZWKOTPCHSA-N 0 0 374.368 3.669 20 5 FHBDRN Cc1cc(C(=O)N2CCO[C@H](c3ccc(Cl)cc3)C2)ccc1[N+](=O)[O-] ZINC000517257405 944152321 /nfs/dbraw/zinc/15/23/21/944152321.db2.gz NNKYESMMFSCFRU-KRWDZBQOSA-N 0 0 360.797 3.770 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)F)cc1NCCCn1cnc2ccccc21 ZINC000436281607 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FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])NCc1ccccc1OC1CCCC1 ZINC000046782080 944436210 /nfs/dbraw/zinc/43/62/10/944436210.db2.gz AZCUOTBWXDUJBR-UHFFFAOYSA-N 0 0 354.406 3.775 20 5 FHBDRN COC(=O)c1ccc(-c2noc(/C=C\c3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000517619396 944447906 /nfs/dbraw/zinc/44/79/06/944447906.db2.gz CQVDTKHKGTXHBG-WCIBSUBMSA-N 0 0 351.318 3.602 20 5 FHBDRN C[C@H](CCc1ccco1)NC(=O)c1cccc([N+](=O)[O-])c1Br ZINC000277325859 944453193 /nfs/dbraw/zinc/45/31/93/944453193.db2.gz XUBISWFSGKTHBI-SNVBAGLBSA-N 0 0 367.199 3.701 20 5 FHBDRN CCCc1n[nH]c(C(=O)N(C)CCc2cccc3ccccc32)c1[N+](=O)[O-] ZINC000517633976 944454630 /nfs/dbraw/zinc/45/46/30/944454630.db2.gz YVFSCHLCXOVXPC-UHFFFAOYSA-N 0 0 366.421 3.738 20 5 FHBDRN CCOc1cccc2[nH]cc(CC(=O)N[C@H](C)c3ccccc3[N+](=O)[O-])c21 ZINC000438270092 944455014 /nfs/dbraw/zinc/45/50/14/944455014.db2.gz GXESKTXUYHUPMK-CYBMUJFWSA-N 0 0 367.405 3.895 20 5 FHBDRN CCOc1cc(NC(=O)N(C)Cc2ccoc2)c([N+](=O)[O-])cc1OCC ZINC000516077722 944469700 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3.698 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N[C@@]2(Cc3ccc(Cl)cc3)CCOC2)c1 ZINC000500313203 944480935 /nfs/dbraw/zinc/48/09/35/944480935.db2.gz DSHLEHMHFTZWEI-LJQANCHMSA-N 0 0 374.824 3.688 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]([C@H]2CCCO2)C1 ZINC000894709096 944482542 /nfs/dbraw/zinc/48/25/42/944482542.db2.gz ADIHLSJUUHMDPK-XJKSGUPXSA-N 0 0 364.467 3.736 20 5 FHBDRN O=C(NCCNc1ccccc1[N+](=O)[O-])c1cnc(-c2ccccc2)s1 ZINC000046912642 944483760 /nfs/dbraw/zinc/48/37/60/944483760.db2.gz HBVIVAVHNXREDX-UHFFFAOYSA-N 0 0 368.418 3.560 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]([C@@H]2CCCO2)C1 ZINC000894710134 944485458 /nfs/dbraw/zinc/48/54/58/944485458.db2.gz HLLXOCZSYVHPQU-CJNGLKHVSA-N 0 0 364.467 3.738 20 5 FHBDRN CO[C@H](c1ccc(F)cc1)[C@@H](C)NC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000517662596 944485929 /nfs/dbraw/zinc/48/59/29/944485929.db2.gz HLYNEEXHVBLCJY-JCGVRSQUSA-N 0 0 360.385 3.730 20 5 FHBDRN 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374.441 3.861 20 5 FHBDRN Cc1c(F)ccc([N+](=O)[O-])c1C(=O)NCCCO[C@@H](C)c1ccccc1 ZINC000843758092 944543568 /nfs/dbraw/zinc/54/35/68/944543568.db2.gz KLOYUQMQBSFNER-AWEZNQCLSA-N 0 0 360.385 3.940 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@@H](COc2ccccc2)C1 ZINC000506214540 944543657 /nfs/dbraw/zinc/54/36/57/944543657.db2.gz JPUSCPURDQFWAY-CQSZACIVSA-N 0 0 371.393 3.536 20 5 FHBDRN Cn1ccnc1[C@@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000017590317 944543732 /nfs/dbraw/zinc/54/37/32/944543732.db2.gz NLCLBPPPXAYUHL-INIZCTEOSA-N 0 0 371.328 3.577 20 5 FHBDRN CCC(CC)[C@H](O)CNC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000517714737 944545402 /nfs/dbraw/zinc/54/54/02/944545402.db2.gz WCMKOAASWCFISS-LJQANCHMSA-N 0 0 371.437 3.865 20 5 FHBDRN C[C@H]1CN(C(=O)c2cc3cc([N+](=O)[O-])ccc3o2)C[C@H](c2ccccc2)O1 ZINC000518621691 944551721 /nfs/dbraw/zinc/55/17/21/944551721.db2.gz KFLLGSNVUSIPGC-ORAYPTAESA-N 0 0 366.373 3.943 20 5 FHBDRN 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374.418 3.997 20 5 FHBDRN O=C(NCc1cc(F)c(C(F)(F)F)cc1F)c1ccccc1[N+](=O)[O-] ZINC000516190346 944579427 /nfs/dbraw/zinc/57/94/27/944579427.db2.gz YFYMJBIMWPEVFI-UHFFFAOYSA-N 0 0 360.238 3.822 20 5 FHBDRN Cc1cccc(O[C@H](C)C(=O)N(C)Cc2cc([N+](=O)[O-])ccc2Cl)c1 ZINC000140238814 944582492 /nfs/dbraw/zinc/58/24/92/944582492.db2.gz KFYKHCOOBHUFSU-CYBMUJFWSA-N 0 0 362.813 3.983 20 5 FHBDRN O=C(N[C@@H]1CCc2c1cccc2O)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000517763997 944583731 /nfs/dbraw/zinc/58/37/31/944583731.db2.gz UNCPGKMWIDGPFA-CQSZACIVSA-N 0 0 366.295 3.737 20 5 FHBDRN CCCn1nc(C)c(C(=O)OCc2cc([N+](=O)[O-])ccc2Cl)c1C ZINC000759858436 944584991 /nfs/dbraw/zinc/58/49/91/944584991.db2.gz QAXVVIKZTVTCBI-UHFFFAOYSA-N 0 0 351.790 3.829 20 5 FHBDRN CO[C@@H]1C[C@H](c2ccccc2)CC[C@H]1NC(=O)Cc1ccccc1[N+](=O)[O-] ZINC000517767007 944587021 /nfs/dbraw/zinc/58/70/21/944587021.db2.gz QIIHCWYRNUGUSP-YVWKXTFCSA-N 0 0 368.433 3.605 20 5 FHBDRN CCOc1ccc([C@@H]2C[C@H]2NC(=O)N[C@H](C)c2ccccc2[N+](=O)[O-])cc1 ZINC000437806065 944587592 /nfs/dbraw/zinc/58/75/92/944587592.db2.gz VSTJMSBHZDFXQF-JEBQAFNWSA-N 0 0 369.421 3.910 20 5 FHBDRN Cc1c(C(=O)N[C@@]2(Cc3ccc(Cl)cc3)CCOC2)cccc1[N+](=O)[O-] ZINC000500349436 944588753 /nfs/dbraw/zinc/58/87/53/944588753.db2.gz RCRXOHUFPRIWHE-LJQANCHMSA-N 0 0 374.824 3.688 20 5 FHBDRN Cc1ccc(CN2CCN(C(=O)CCC3CCCC3)CC2)cc1[N+](=O)[O-] ZINC000506568830 944589819 /nfs/dbraw/zinc/58/98/19/944589819.db2.gz RYKAOMPVUVRZGV-UHFFFAOYSA-N 0 0 359.470 3.518 20 5 FHBDRN Cc1ccc(C[NH2+]CCC[C@H](Cc2ccccc2)C(=O)[O-])cc1[N+](=O)[O-] ZINC000426672321 944591314 /nfs/dbraw/zinc/59/13/14/944591314.db2.gz AAOGEUZQIKWEND-GOSISDBHSA-N 0 0 356.422 3.717 20 5 FHBDRN O=C(Nc1ccc(OC(F)F)c2cccnc12)c1cccc([N+](=O)[O-])c1 ZINC000184318990 944592901 /nfs/dbraw/zinc/59/29/01/944592901.db2.gz WRQFIJJKEBNARB-UHFFFAOYSA-N 0 0 359.288 3.997 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)Nc2cnc(C)nc2C2CC2)cc1[N+](=O)[O-] ZINC000439420385 944593427 /nfs/dbraw/zinc/59/34/27/944593427.db2.gz LZLNEUSHJCODNS-LLVKDONJSA-N 0 0 355.398 3.762 20 5 FHBDRN Cn1c(CN[C@H]2CCc3c2cccc3[N+](=O)[O-])nc2cccc(Cl)c21 ZINC000566688633 944595198 /nfs/dbraw/zinc/59/51/98/944595198.db2.gz GDYMNIXMDBXQGE-AWEZNQCLSA-N 0 0 356.813 3.912 20 5 FHBDRN CC[C@@H](C)Oc1cc(-c2noc(-c3cccc(OC)c3[N+](=O)[O-])n2)ccn1 ZINC000516214209 944595957 /nfs/dbraw/zinc/59/59/57/944595957.db2.gz ZFWPOAUSSFNZOR-LLVKDONJSA-N 0 0 370.365 3.893 20 5 FHBDRN Cc1c(F)ccc([N+](=O)[O-])c1C(=O)Nc1ccc(C(=O)N2CCCC2)cc1 ZINC000843760529 944600826 /nfs/dbraw/zinc/60/08/26/944600826.db2.gz MKQPLNCLPXNDBM-UHFFFAOYSA-N 0 0 371.368 3.531 20 5 FHBDRN CCC(CC)(CNC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C)OC ZINC000426014657 944620833 /nfs/dbraw/zinc/62/08/33/944620833.db2.gz ROTKZEYOMWJXHC-UHFFFAOYSA-N 0 0 351.447 3.720 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N1C[C@@H]2CCC[C@]2(C(F)(F)F)C1 ZINC000894382352 944626599 /nfs/dbraw/zinc/62/65/99/944626599.db2.gz SHZAWHQYZXZDJF-BBRMVZONSA-N 0 0 356.344 3.718 20 5 FHBDRN 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Cc1ccc([C@H]2CCCN2S(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1C ZINC000518734155 944685700 /nfs/dbraw/zinc/68/57/00/944685700.db2.gz JDXPJYKJWGVFCY-GOSISDBHSA-N 0 0 360.435 3.737 20 5 FHBDRN C[C@@H](NC(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1)[C@@H]1CCOC1 ZINC000438497170 944693008 /nfs/dbraw/zinc/69/30/08/944693008.db2.gz ZVMIWAYRLYIERA-ZIAGYGMSSA-N 0 0 371.393 3.934 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)c1ccc2ccccc2c1O ZINC000436826265 944694420 /nfs/dbraw/zinc/69/44/20/944694420.db2.gz JTISZZOXPYYISW-UHFFFAOYSA-N 0 0 350.374 3.768 20 5 FHBDRN COC(=O)c1cc2cc(COc3c(Cl)cncc3[N+](=O)[O-])ccc2o1 ZINC000506601255 944700745 /nfs/dbraw/zinc/70/07/45/944700745.db2.gz POXRESGSEICTTG-UHFFFAOYSA-N 0 0 362.725 3.755 20 5 FHBDRN COc1ccc(C(=O)NC[C@H]2CCC[C@H](C(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000438511706 944700928 /nfs/dbraw/zinc/70/09/28/944700928.db2.gz HDVYGQATDZMJTO-JQWIXIFHSA-N 0 0 360.332 3.702 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)NC[C@H]2CCC[C@@H](C(F)(F)F)C2)c1 ZINC000438512390 944701574 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20 5 FHBDRN Cc1c(NS(=O)(=O)CCc2cccc(Cl)c2)cccc1[N+](=O)[O-] ZINC000506597035 944708273 /nfs/dbraw/zinc/70/82/73/944708273.db2.gz WXAYXRQSNZTXRA-UHFFFAOYSA-N 0 0 354.815 3.541 20 5 FHBDRN CC(C)[C@H]([NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1)C(=O)[O-] ZINC000426691246 944711000 /nfs/dbraw/zinc/71/10/00/944711000.db2.gz GQWDQCKOVSXIPN-SFHVURJKSA-N 0 0 357.410 3.562 20 5 FHBDRN CC(C)c1ccc(C(=O)N(C)CCCC(=O)OC(C)(C)C)cc1[N+](=O)[O-] ZINC000439534599 944718476 /nfs/dbraw/zinc/71/84/76/944718476.db2.gz FCBKLRMUNDVDEX-UHFFFAOYSA-N 0 0 364.442 3.912 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)Nc2cc(-c3nc(C)no3)ccc2C)c1 ZINC000516316159 944718769 /nfs/dbraw/zinc/71/87/69/944718769.db2.gz BBJLLFVGRWGLDF-UHFFFAOYSA-N 0 0 368.349 3.523 20 5 FHBDRN COc1cc(CN(Cc2cccc(F)c2)C2CC2)c([N+](=O)[O-])cc1OC ZINC000506602006 944719632 /nfs/dbraw/zinc/71/96/32/944719632.db2.gz UELNJMWROBMPOT-UHFFFAOYSA-N 0 0 360.385 3.916 20 5 FHBDRN CC(=O)N(C)c1ccc(-c2nc(-c3ccc([N+](=O)[O-])cc3C)no2)cc1 ZINC000566762922 944734204 /nfs/dbraw/zinc/73/42/04/944734204.db2.gz DFDGPENHSIGJQL-UHFFFAOYSA-N 0 0 352.350 3.603 20 5 FHBDRN Cc1cc(NCC2CC[NH+](CCC(C)C)CC2)c(C(=O)[O-])cc1[N+](=O)[O-] ZINC000518776414 944734472 /nfs/dbraw/zinc/73/44/72/944734472.db2.gz ALKKVDMKKHGWHP-UHFFFAOYSA-N 0 0 363.458 3.771 20 5 FHBDRN O=C(N[C@H]1COc2ccc(F)cc21)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000500395152 944743924 /nfs/dbraw/zinc/74/39/24/944743924.db2.gz KIMJEPUANCWODA-ZDUSSCGKSA-N 0 0 370.258 3.616 20 5 FHBDRN CN(C(=O)CN1CCC[C@H]1c1cccc(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000053718301 944747761 /nfs/dbraw/zinc/74/77/61/944747761.db2.gz SPOQRJWWCMXSGP-SFHVURJKSA-N 0 0 357.385 3.534 20 5 FHBDRN Cc1nc(C)n(Cc2cccc(NCc3c(F)cc([N+](=O)[O-])cc3F)c2)n1 ZINC000506273835 944748083 /nfs/dbraw/zinc/74/80/83/944748083.db2.gz RPVFJPXRRZQVRZ-UHFFFAOYSA-N 0 0 373.363 3.742 20 5 FHBDRN O=C(c1nc(Cl)ccc1F)N1CCS[C@@H]1c1ccc([N+](=O)[O-])cc1 ZINC000759888124 944748780 /nfs/dbraw/zinc/74/87/80/944748780.db2.gz FCPRLPPDCCOVCJ-OAHLLOKOSA-N 0 0 367.789 3.670 20 5 FHBDRN Cc1ncsc1/C=C/c1nc(CCNc2ccccc2[N+](=O)[O-])no1 ZINC000516345845 944751561 /nfs/dbraw/zinc/75/15/61/944751561.db2.gz SXTHOKAJGWSSIG-VOTSOKGWSA-N 0 0 357.395 3.568 20 5 FHBDRN CC(C)(c1nc(-c2ccc(O)c(F)c2)no1)c1ccc([N+](=O)[O-])cc1F ZINC000436879402 944753091 /nfs/dbraw/zinc/75/30/91/944753091.db2.gz NCRTVVSPYLKNMF-UHFFFAOYSA-N 0 0 361.304 3.955 20 5 FHBDRN CC(C)Cn1cc(NC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)cn1 ZINC000438548315 944754994 /nfs/dbraw/zinc/75/49/94/944754994.db2.gz ABPLHRYXSYZBQQ-UHFFFAOYSA-N 0 0 359.430 3.592 20 5 FHBDRN Cc1c(C(=O)N(C)CCCc2ccccc2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000047165074 944756303 /nfs/dbraw/zinc/75/63/03/944756303.db2.gz JYHZAJZRCCOVBT-UHFFFAOYSA-N 0 0 357.366 3.516 20 5 FHBDRN O=C(NCCNc1ccc([N+](=O)[O-])cc1)c1cc2c(s1)CCCCC2 ZINC000015138901 944763335 /nfs/dbraw/zinc/76/33/35/944763335.db2.gz CCLRNBXGUFQFHY-UHFFFAOYSA-N 0 0 359.451 3.767 20 5 FHBDRN CCOCc1ccc(N[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 ZINC000439569740 944771392 /nfs/dbraw/zinc/77/13/92/944771392.db2.gz LQLKIMSWHWPXDH-AWEZNQCLSA-N 0 0 357.410 3.879 20 5 FHBDRN CC(=O)c1ccc(N(C)Cc2cnn(-c3ccccc3)c2)c([N+](=O)[O-])c1 ZINC000015140752 944773110 /nfs/dbraw/zinc/77/31/10/944773110.db2.gz YUQYTKXCEGUJKE-UHFFFAOYSA-N 0 0 350.378 3.620 20 5 FHBDRN CCSc1cc(CNC(=O)Nc2ccc([N+](=O)[O-])cc2F)ccn1 ZINC000426062512 944777378 /nfs/dbraw/zinc/77/73/78/944777378.db2.gz XTUWHHPEORHSPN-UHFFFAOYSA-N 0 0 350.375 3.563 20 5 FHBDRN Cn1ccnc1[C@H](N[C@@H]1CCCC(F)(F)C1)c1cccc([N+](=O)[O-])c1 ZINC000518805898 944786007 /nfs/dbraw/zinc/78/60/07/944786007.db2.gz BWNVPACGIGYGHO-UKRRQHHQSA-N 0 0 350.369 3.585 20 5 FHBDRN CNC(=O)c1cc([N+](=O)[O-])ccc1NC[C@H]1CCC[C@H](C(F)(F)F)C1 ZINC000439598229 944787341 /nfs/dbraw/zinc/78/73/41/944787341.db2.gz POMOAZKJAYTAIV-QWRGUYRKSA-N 0 0 359.348 3.735 20 5 FHBDRN CNc1ccc(C(=O)NC[C@@H]2CCCO[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000140336823 944796035 /nfs/dbraw/zinc/79/60/35/944796035.db2.gz UBUWXIRFVJJPIX-QFBILLFUSA-N 0 0 369.421 3.534 20 5 FHBDRN O=C(c1ccccc1)c1ccc(N2CCN(C3CCC3)CC2)c([N+](=O)[O-])c1 ZINC000500409107 944797393 /nfs/dbraw/zinc/79/73/93/944797393.db2.gz LLTGXYZJMMADNE-UHFFFAOYSA-N 0 0 365.433 3.500 20 5 FHBDRN Cc1ccc2c(CC(=O)NCCOc3ccc([N+](=O)[O-])cc3)coc2c1C ZINC000518830779 944819379 /nfs/dbraw/zinc/81/93/79/944819379.db2.gz IZBHXQQDJRGGSK-UHFFFAOYSA-N 0 0 368.389 3.696 20 5 FHBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1CSCCCNc1ncccn1 ZINC000518823756 944828327 /nfs/dbraw/zinc/82/83/27/944828327.db2.gz MHOSPQGAJMYDJY-UHFFFAOYSA-N 0 0 362.455 3.907 20 5 FHBDRN COc1cc(COc2cccc3c2CCCC(=O)N3)c([N+](=O)[O-])cc1F ZINC000506295220 944829824 /nfs/dbraw/zinc/82/98/24/944829824.db2.gz PDNARTCYQMERTR-UHFFFAOYSA-N 0 0 360.341 3.596 20 5 FHBDRN CC1(C)CCC[C@@H]1NC(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000426081523 944833313 /nfs/dbraw/zinc/83/33/13/944833313.db2.gz VYSCCMFVXLPAMD-ZDUSSCGKSA-N 0 0 359.348 3.992 20 5 FHBDRN Cc1ccc([C@@H]2CCCN2C(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 ZINC000516426628 944838412 /nfs/dbraw/zinc/83/84/12/944838412.db2.gz FONXEKNCKWQWDK-SFHVURJKSA-N 0 0 367.405 3.514 20 5 FHBDRN CC(C)(c1nc(Cc2cn3ccccc3n2)no1)c1ccccc1[N+](=O)[O-] ZINC000426454589 944858166 /nfs/dbraw/zinc/85/81/66/944858166.db2.gz QUUDSZWGBULTOC-UHFFFAOYSA-N 0 0 363.377 3.542 20 5 FHBDRN COc1c(Cl)cc(NC(=O)COc2ccc([N+](=O)[O-])cc2)cc1Cl ZINC000506304989 944873258 /nfs/dbraw/zinc/87/32/58/944873258.db2.gz KUQMAYIVHUFWOC-UHFFFAOYSA-N 0 0 371.176 3.928 20 5 FHBDRN Cc1cccc(OCCCNC(=O)N(C)Cc2ccccc2[N+](=O)[O-])c1C ZINC000426858281 944873424 /nfs/dbraw/zinc/87/34/24/944873424.db2.gz SOXHJPMWJBGGSN-UHFFFAOYSA-N 0 0 371.437 3.822 20 5 FHBDRN CC(C)(NC(=O)N[C@H]1CCCc2cc(N)ccc21)c1ccc([N+](=O)[O-])cc1 ZINC000418555232 944876444 /nfs/dbraw/zinc/87/64/44/944876444.db2.gz OHBLQOLPQAGKOS-SFHVURJKSA-N 0 0 368.437 3.789 20 5 FHBDRN COc1ccc(C(=O)Nc2cc(Br)ccc2F)cc1[N+](=O)[O-] ZINC000110649956 944882481 /nfs/dbraw/zinc/88/24/81/944882481.db2.gz ZDRTYBWVIZTTCU-UHFFFAOYSA-N 0 0 369.146 3.757 20 5 FHBDRN CCOc1ccccc1[C@@H](CC)Nc1ccc(C(=O)NC)cc1[N+](=O)[O-] ZINC000507025725 944891279 /nfs/dbraw/zinc/89/12/79/944891279.db2.gz ACNBESGTGBIZKL-OAHLLOKOSA-N 0 0 357.410 3.916 20 5 FHBDRN CCOc1ccc(CNC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1F ZINC000517988876 944898247 /nfs/dbraw/zinc/89/82/47/944898247.db2.gz ZDXOMIFTBLDBCI-UHFFFAOYSA-N 0 0 352.749 3.716 20 5 FHBDRN COc1ccc(C(=O)N[C@@H]2CC[C@H](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000438670995 944901262 /nfs/dbraw/zinc/90/12/62/944901262.db2.gz FFTBKASQWAOQHC-NVXWUHKLSA-N 0 0 354.406 3.745 20 5 FHBDRN CC[C@H](NC(=O)c1ccccc1)c1noc(-c2ccc([N+](=O)[O-])s2)n1 ZINC000566823888 944903441 /nfs/dbraw/zinc/90/34/41/944903441.db2.gz JVMZVXDNJHCFMK-NSHDSACASA-N 0 0 358.379 3.587 20 5 FHBDRN CC[C@H](NC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)C1CCOCC1 ZINC000437006069 944904877 /nfs/dbraw/zinc/90/48/77/944904877.db2.gz GXTAZTXCLOSQAI-AWEZNQCLSA-N 0 0 360.332 3.549 20 5 FHBDRN O=C(N[C@H](c1cc2ccccc2o1)c1ccccc1)c1cc([N+](=O)[O-])n[nH]1 ZINC000505928199 944910192 /nfs/dbraw/zinc/91/01/92/944910192.db2.gz KMFUYBGRJIYULV-SFHVURJKSA-N 0 0 362.345 3.584 20 5 FHBDRN O=[N+]([O-])c1cccc2nc(/C=C/c3cnnn3Cc3ccccc3)ccc21 ZINC000426903752 944913407 /nfs/dbraw/zinc/91/34/07/944913407.db2.gz REHFLQQNJDXFEX-PKNBQFBNSA-N 0 0 357.373 3.953 20 5 FHBDRN CC[C@@H](c1cccc(OC)c1)N(C)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000518000545 944921687 /nfs/dbraw/zinc/92/16/87/944921687.db2.gz PEFYYICHBPTVOL-KRWDZBQOSA-N 0 0 357.410 3.625 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N[C@H]2CC[C@@H](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000438690199 944929530 /nfs/dbraw/zinc/92/95/30/944929530.db2.gz HYAGBZWQKYPMEF-GJZGRUSLSA-N 0 0 356.426 3.583 20 5 FHBDRN CC[C@H](C)Oc1ccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2C)cc1 ZINC000511710474 944935863 /nfs/dbraw/zinc/93/58/63/944935863.db2.gz QVJDAOOUSPDFGC-LBPRGKRZSA-N 0 0 364.423 3.881 20 5 FHBDRN Cc1cc2c(cc1NC(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1)OCO2 ZINC000511709224 944936288 /nfs/dbraw/zinc/93/62/88/944936288.db2.gz YXEHRNRMSWHTRK-LLVKDONJSA-N 0 0 360.391 3.751 20 5 FHBDRN COc1cc(NC(=O)Cc2ccc([N+](=O)[O-])cc2)ccc1C(F)(F)F ZINC000426924155 944943833 /nfs/dbraw/zinc/94/38/33/944943833.db2.gz FBUVMZGMINNQHZ-UHFFFAOYSA-N 0 0 354.284 3.803 20 5 FHBDRN CCN(c1cc(C)cc(C)c1)S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1 ZINC000466956978 944947508 /nfs/dbraw/zinc/94/75/08/944947508.db2.gz DEUHQJNZHRJEON-UHFFFAOYSA-N 0 0 354.453 3.797 20 5 FHBDRN C[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)CC1(F)F ZINC000507115188 944948375 /nfs/dbraw/zinc/94/83/75/944948375.db2.gz GKIHUKRDAKELNL-QMMMGPOBSA-N 0 0 352.259 3.731 20 5 FHBDRN COc1cc(N2CCC[C@H](CC(=O)OC(C)(C)C)C2)ccc1[N+](=O)[O-] ZINC000518031026 944951672 /nfs/dbraw/zinc/95/16/72/944951672.db2.gz IGIQWHINAFHHCC-CYBMUJFWSA-N 0 0 350.415 3.552 20 5 FHBDRN COc1ccc(Br)c(CN(C)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC000507119424 944965181 /nfs/dbraw/zinc/96/51/81/944965181.db2.gz HEUBHXKLKGBKMW-UHFFFAOYSA-N 0 0 365.227 3.998 20 5 FHBDRN C[C@@H](Cc1ccccc1F)NC(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000054166737 944966913 /nfs/dbraw/zinc/96/69/13/944966913.db2.gz IROHJAAFFUFMCJ-STQMWFEESA-N 0 0 362.426 3.962 20 5 FHBDRN Cc1cnc(N(CCCO)Cc2ccc(Cl)c(Cl)c2)c([N+](=O)[O-])c1 ZINC000432064937 944973940 /nfs/dbraw/zinc/97/39/40/944973940.db2.gz VFQLMLILJDDOFJ-UHFFFAOYSA-N 0 0 370.236 3.994 20 5 FHBDRN CCOC(=O)c1cc(NCc2cccc3c2OCCCO3)ccc1[N+](=O)[O-] ZINC000432066697 944981606 /nfs/dbraw/zinc/98/16/06/944981606.db2.gz XUHSCNIEOMOEPY-UHFFFAOYSA-N 0 0 372.377 3.545 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N1CCC(C2CCOCC2)CC1 ZINC000516533141 944985629 /nfs/dbraw/zinc/98/56/29/944985629.db2.gz VMGDZXQHQVKAMD-UHFFFAOYSA-N 0 0 366.845 3.835 20 5 FHBDRN O=C(COc1ccccc1[N+](=O)[O-])N[C@H](C1CCCCC1)C(F)(F)F ZINC000439817368 945007340 /nfs/dbraw/zinc/00/73/40/945007340.db2.gz BPALUQFIRKEOHA-OAHLLOKOSA-N 0 0 360.332 3.601 20 5 FHBDRN Cc1ccc(O[C@H](C)C(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000437089686 945010122 /nfs/dbraw/zinc/01/01/22/945010122.db2.gz HKGKTUODRAYCHM-OAHLLOKOSA-N 0 0 354.406 3.862 20 5 FHBDRN COc1ccc(C(=O)N[C@@H](C2CCCCC2)C(F)(F)F)cc1[N+](=O)[O-] ZINC000439832251 945012362 /nfs/dbraw/zinc/01/23/62/945012362.db2.gz XJDRGSAKXKPFDH-AWEZNQCLSA-N 0 0 360.332 3.844 20 5 FHBDRN Cc1cc(C(=O)Nc2ccnn2-c2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000437094467 945013019 /nfs/dbraw/zinc/01/30/19/945013019.db2.gz KLSVAAIXHLPHHP-UHFFFAOYSA-N 0 0 356.769 3.995 20 5 FHBDRN CCOc1cccc(N2CCc3c(cccc3NC(C)=O)C2)c1[N+](=O)[O-] ZINC000184066214 945023147 /nfs/dbraw/zinc/02/31/47/945023147.db2.gz NIWDXWIFFWJPOK-UHFFFAOYSA-N 0 0 355.394 3.515 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C2CCCCC2)C(F)(F)F)c1 ZINC000439847257 945025467 /nfs/dbraw/zinc/02/54/67/945025467.db2.gz BKZWNLHPEVXGLW-CQSZACIVSA-N 0 0 360.332 3.844 20 5 FHBDRN CCN(Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1cccc(OC)c1 ZINC000438783533 945026873 /nfs/dbraw/zinc/02/68/73/945026873.db2.gz GEPYNVDFZBZHCL-UHFFFAOYSA-N 0 0 354.366 3.680 20 5 FHBDRN C[C@H](C(=O)N[C@H]1c2ccc(F)cc2O[C@@H]1C)c1ccc([N+](=O)[O-])cc1F ZINC000519021547 945035276 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FHBDRN CCO[C@H]1C[C@H](NC(=O)c2ccc(SC)c([N+](=O)[O-])c2)C12CCCC2 ZINC000437123446 945052645 /nfs/dbraw/zinc/05/26/45/945052645.db2.gz DWIFZOSRAYSDPH-HOTGVXAUSA-N 0 0 364.467 3.784 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CCO[C@H](c2ccccc2)C1 ZINC000439876588 945056291 /nfs/dbraw/zinc/05/62/91/945056291.db2.gz VLCVCVCIGGAZQS-SFHVURJKSA-N 0 0 371.393 3.599 20 5 FHBDRN Cc1cc(C)n([C@H](C)CC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)n1 ZINC000437126663 945057277 /nfs/dbraw/zinc/05/72/77/945057277.db2.gz UXYHVZXXZFXLDN-OAHLLOKOSA-N 0 0 356.426 3.550 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N(C)CCOc1cccc(C)c1 ZINC000439881490 945060297 /nfs/dbraw/zinc/06/02/97/945060297.db2.gz VVZPCSQFGGNIDN-UHFFFAOYSA-N 0 0 373.409 3.845 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)NCc1ncc(C(C)(C)C)o1 ZINC000439882799 945061586 /nfs/dbraw/zinc/06/15/86/945061586.db2.gz LAZGOQQVNQDPCM-UHFFFAOYSA-N 0 0 362.386 3.601 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)Nc2cccc(C[S@@](C)=O)c2C)c1C ZINC000889028860 945382708 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CC(C)[C@H]1C[C@H](Cc2nc(CCNc3ccccc3[N+](=O)[O-])no2)CCO1 ZINC000545670366 946383248 /nfs/dbraw/zinc/38/32/48/946383248.db2.gz VXQYETZXXBHNMT-RHSMWYFYSA-N 0 0 374.441 3.626 20 5 FHBDRN C[C@@H]1CC[C@@H](NC(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000444320784 946389002 /nfs/dbraw/zinc/38/90/02/946389002.db2.gz RVCMIHPATURXGP-ZYHUDNBSSA-N 0 0 359.348 3.720 20 5 FHBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1OC(=O)CCc1cccc2c1OCO2 ZINC001126121130 946398943 /nfs/dbraw/zinc/39/89/43/946398943.db2.gz QXKIVGNRCCIFMH-UHFFFAOYSA-N 0 0 363.753 3.824 20 5 FHBDRN O=C(c1cc(F)c(Cl)c([N+](=O)[O-])c1Cl)N1CCC[C@H]1c1ncc[nH]1 ZINC000897294900 946402663 /nfs/dbraw/zinc/40/26/63/946402663.db2.gz CINMAAFAUITBPQ-VIFPVBQESA-N 0 0 373.171 3.741 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)N[C@@H]1CCSc2ccccc21 ZINC000043166244 946407562 /nfs/dbraw/zinc/40/75/62/946407562.db2.gz JVFYUEOPHWHSHC-OAHLLOKOSA-N 0 0 357.435 3.973 20 5 FHBDRN CN1CCC[C@H](NC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)c2ccccc21 ZINC000456594357 946410150 /nfs/dbraw/zinc/41/01/50/946410150.db2.gz KDZYXUNOUBBUBU-SFHVURJKSA-N 0 0 364.405 3.777 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)N[C@@H]1C[C@H]1c1ccc(OC(F)F)cc1 ZINC000475487774 946411498 /nfs/dbraw/zinc/41/14/98/946411498.db2.gz SRCLDZGNKIXWOB-LSDHHAIUSA-N 0 0 363.320 3.874 20 5 FHBDRN CN(C)c1ccccc1NC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000121368883 946423388 /nfs/dbraw/zinc/42/33/88/946423388.db2.gz LKARIJKHQYVZJG-UHFFFAOYSA-N 0 0 354.410 3.857 20 5 FHBDRN O=[N+]([O-])c1c(Oc2ncnc3c2ncn3C2CC2)cccc1C(F)(F)F ZINC000896988065 946430964 /nfs/dbraw/zinc/43/09/64/946430964.db2.gz WFKMOACVXYRRNW-UHFFFAOYSA-N 0 0 365.271 3.881 20 5 FHBDRN CN(Cc1cccc(F)c1)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000047864512 946445757 /nfs/dbraw/zinc/44/57/57/946445757.db2.gz UEPLNOBRJXUUAE-UHFFFAOYSA-N 0 0 369.299 3.999 20 5 FHBDRN CSc1cccc(NC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2C)c1C ZINC000441323133 946449117 /nfs/dbraw/zinc/44/91/17/946449117.db2.gz MIVJYIBMJYKRRZ-UHFFFAOYSA-N 0 0 359.407 3.511 20 5 FHBDRN O=C(c1c2c(nc3ccccc31)CCC2)N1CCc2c1cccc2[N+](=O)[O-] ZINC000523092244 946466087 /nfs/dbraw/zinc/46/60/87/946466087.db2.gz VUOLNQRKCBVKJM-UHFFFAOYSA-N 0 0 359.385 3.835 20 5 FHBDRN CC[C@H](C)[C@H]1CCCCN1C(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000523094686 946467246 /nfs/dbraw/zinc/46/72/46/946467246.db2.gz WGARMUZGXRWTEA-KBXCAEBGSA-N 0 0 356.426 3.821 20 5 FHBDRN Cc1cc(Cl)ccc1O[C@H](C)C(=O)N1CCc2c1cccc2[N+](=O)[O-] ZINC000523093293 946467437 /nfs/dbraw/zinc/46/74/37/946467437.db2.gz SRPQPFLWKKGPNW-GFCCVEGCSA-N 0 0 360.797 3.913 20 5 FHBDRN CC[C@@H](COC)Nc1ccc(C(=O)Nc2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000523087479 946484666 /nfs/dbraw/zinc/48/46/66/946484666.db2.gz HYRAIWFFORVZCW-HNNXBMFYSA-N 0 0 357.410 3.992 20 5 FHBDRN O=C(Nc1ccc(Nc2ncccn2)cc1)c1ccc([N+](=O)[O-])cc1F ZINC000444414050 946484887 /nfs/dbraw/zinc/48/48/87/946484887.db2.gz DWSRJVVSGCYNIZ-UHFFFAOYSA-N 0 0 353.313 3.520 20 5 FHBDRN Cc1nn(CCC(=O)N[C@H]2CCC[C@@H](C(C)C)CC2)c(C)c1[N+](=O)[O-] ZINC000186116766 946487547 /nfs/dbraw/zinc/48/75/47/946487547.db2.gz IYZFNVDFRUJIPQ-CVEARBPZSA-N 0 0 350.463 3.519 20 5 FHBDRN C[C@H]1[C@@H](C(=O)N2CCCc3ccc([N+](=O)[O-])cc32)CCN1c1ccccc1 ZINC000475502833 946489051 /nfs/dbraw/zinc/48/90/51/946489051.db2.gz OZPPLHOJEHEXQE-KXBFYZLASA-N 0 0 365.433 3.789 20 5 FHBDRN COC(=O)[C@H](CC(F)F)NCc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000475144371 946490852 /nfs/dbraw/zinc/49/08/52/946490852.db2.gz MLYVYDSEDBJWCM-LBPRGKRZSA-N 0 0 370.377 3.610 20 5 FHBDRN O=[N+]([O-])c1ccc(OCCOc2cccc(Br)c2)c(F)c1 ZINC000048022690 946492540 /nfs/dbraw/zinc/49/25/40/946492540.db2.gz KBIWIHOCVHXAAH-UHFFFAOYSA-N 0 0 356.147 3.954 20 5 FHBDRN CC[C@H](NC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)c1ccc(C)cc1 ZINC000111538769 946492768 /nfs/dbraw/zinc/49/27/68/946492768.db2.gz WQXIQLLWEHAKGZ-KRWDZBQOSA-N 0 0 365.389 3.626 20 5 FHBDRN CC[C@@H](NC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)c1ccc(C)cc1 ZINC000111538773 946492848 /nfs/dbraw/zinc/49/28/48/946492848.db2.gz WQXIQLLWEHAKGZ-QGZVFWFLSA-N 0 0 365.389 3.626 20 5 FHBDRN COc1ccc(CSCC(=O)N[C@@H]2C[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000067514712 946496213 /nfs/dbraw/zinc/49/62/13/946496213.db2.gz ANFIELZWYJMIIV-HZPDHXFCSA-N 0 0 372.446 3.509 20 5 FHBDRN CC[C@H](C)C(=O)Nc1cccc(CNC(=O)c2cccc([N+](=O)[O-])c2C)c1 ZINC000049082842 946496554 /nfs/dbraw/zinc/49/65/54/946496554.db2.gz CLUXOHKCTGTVSL-ZDUSSCGKSA-N 0 0 369.421 3.818 20 5 FHBDRN Cc1cc(NC(=O)c2cc(COc3ccccc3F)on2)ccc1[N+](=O)[O-] ZINC000186124409 946504605 /nfs/dbraw/zinc/50/46/05/946504605.db2.gz PFFNZWYTWCFHMV-UHFFFAOYSA-N 0 0 371.324 3.862 20 5 FHBDRN COCc1ccc([C@@H]2CCCN2Cc2cc(OC)c(F)cc2[N+](=O)[O-])o1 ZINC000186145095 946516606 /nfs/dbraw/zinc/51/66/06/946516606.db2.gz SMNXDAMEAFIQHJ-HNNXBMFYSA-N 0 0 364.373 3.819 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)NCc1sccc1Br ZINC000111776937 946531481 /nfs/dbraw/zinc/53/14/81/946531481.db2.gz LRNXFIDKDVRPEH-UHFFFAOYSA-N 0 0 355.213 3.657 20 5 FHBDRN O=C(NCc1cccc([N+](=O)[O-])c1)Nc1cc(Br)ccc1F ZINC000111771532 946531510 /nfs/dbraw/zinc/53/15/10/946531510.db2.gz QPKAAANVVHLPPR-UHFFFAOYSA-N 0 0 368.162 3.818 20 5 FHBDRN CCOC(=O)c1cc(C(=O)NC[C@H](C)c2ccc(C)cc2)cc([N+](=O)[O-])c1 ZINC000523097849 946537595 /nfs/dbraw/zinc/53/75/95/946537595.db2.gz RGMUEXOYBFNJSJ-AWEZNQCLSA-N 0 0 370.405 3.613 20 5 FHBDRN O=C(CN1CCC(CCc2ccccc2)CC1)Nc1ccccc1[N+](=O)[O-] ZINC000025832398 946537910 /nfs/dbraw/zinc/53/79/10/946537910.db2.gz QDSOAPXGVQCFDV-UHFFFAOYSA-N 0 0 367.449 3.878 20 5 FHBDRN CCOc1cc(N2CCN(Cc3ccc(Cl)o3)CC2)ccc1[N+](=O)[O-] ZINC000475514091 946541657 /nfs/dbraw/zinc/54/16/57/946541657.db2.gz VOLLZOIPWXJBLA-UHFFFAOYSA-N 0 0 365.817 3.562 20 5 FHBDRN C[C@@H](CNC(=O)N1CCC[C@H](C(F)(F)F)C1)c1ccccc1[N+](=O)[O-] ZINC000897049730 946549225 /nfs/dbraw/zinc/54/92/25/946549225.db2.gz IXUZMMUEESGETC-RYUDHWBXSA-N 0 0 359.348 3.682 20 5 FHBDRN O=[N+]([O-])c1cccc([C@@H](N[C@H](CCO)c2ccco2)c2ccccc2)c1 ZINC000186555422 946550830 /nfs/dbraw/zinc/55/08/30/946550830.db2.gz WLBFKOJPMWUXPS-QUCCMNQESA-N 0 0 352.390 3.991 20 5 FHBDRN CC(C)c1ncc(CN(C)C(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)cn1 ZINC000441403788 946554403 /nfs/dbraw/zinc/55/44/03/946554403.db2.gz LYAMXGQVWCOISK-ZDUSSCGKSA-N 0 0 374.466 3.647 20 5 FHBDRN C[C@@H](CNC(=O)N1CCC(C(F)(F)F)CC1)c1ccccc1[N+](=O)[O-] ZINC000897067578 946562301 /nfs/dbraw/zinc/56/23/01/946562301.db2.gz MAKOJGKNTQWWIO-NSHDSACASA-N 0 0 359.348 3.682 20 5 FHBDRN CCCO[C@H]1CCCN(C(=O)NC[C@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000897070224 946565796 /nfs/dbraw/zinc/56/57/96/946565796.db2.gz BPSXTELBTQHVHS-HOTGVXAUSA-N 0 0 363.458 3.689 20 5 FHBDRN CC(C)COC1CCN(C(=O)NC[C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000897070113 946566275 /nfs/dbraw/zinc/56/62/75/946566275.db2.gz CCEJRJUQJJAVGD-OAHLLOKOSA-N 0 0 363.458 3.545 20 5 FHBDRN Cc1csc(N2CCN(c3cc(C)nc4c3cccc4[N+](=O)[O-])CC2)n1 ZINC000302031188 946583997 /nfs/dbraw/zinc/58/39/97/946583997.db2.gz SEYUGQMVWAOTJN-UHFFFAOYSA-N 0 0 369.450 3.543 20 5 FHBDRN O=[N+]([O-])c1cccc(Oc2ccc(-c3noc(-c4cnccn4)n3)cc2)c1 ZINC000545765298 946586335 /nfs/dbraw/zinc/58/63/35/946586335.db2.gz OMBTWPUMQSBUOA-UHFFFAOYSA-N 0 0 361.317 3.894 20 5 FHBDRN CSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H](C)Cc1cccs1 ZINC001126581467 946588446 /nfs/dbraw/zinc/58/84/46/946588446.db2.gz FZWBXSNTCWLLDZ-LLVKDONJSA-N 0 0 350.465 3.987 20 5 FHBDRN COCc1nc(C)c(C(=O)Nc2cc([N+](=O)[O-])ccc2NC(C)C)s1 ZINC000456186164 946588670 /nfs/dbraw/zinc/58/86/70/946588670.db2.gz LDQRXAHIIGOPDA-UHFFFAOYSA-N 0 0 364.427 3.579 20 5 FHBDRN COc1ccc(Cl)cc1CCNC(=O)[C@@H]1C[C@H]1c1cccc([N+](=O)[O-])c1 ZINC001126141819 946596072 /nfs/dbraw/zinc/59/60/72/946596072.db2.gz QAYMWRNJWHFDPD-DLBZAZTESA-N 0 0 374.824 3.719 20 5 FHBDRN Cc1ccc(NC(=O)C(C)(C)C)cc1NC(=O)c1cc([N+](=O)[O-])cnc1C ZINC000112020672 946602845 /nfs/dbraw/zinc/60/28/45/946602845.db2.gz NHUIHKVRHAXFHD-UHFFFAOYSA-N 0 0 370.409 3.844 20 5 FHBDRN C[C@H](Cc1ccccc1)C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2 ZINC000112002516 946608662 /nfs/dbraw/zinc/60/86/62/946608662.db2.gz VBVYVFVMEQUZAM-CYBMUJFWSA-N 0 0 356.378 3.573 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N(C)CCN(C)c1ccccc1 ZINC000475547000 946617762 /nfs/dbraw/zinc/61/77/62/946617762.db2.gz MNKKRIJNEMASGI-UHFFFAOYSA-N 0 0 356.426 3.812 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N1CCO[C@@H](c2cccc(Cl)c2)C1 ZINC000186206179 946619171 /nfs/dbraw/zinc/61/91/71/946619171.db2.gz OSUXTUZIAFXWLZ-GOSISDBHSA-N 0 0 374.824 3.781 20 5 FHBDRN Cc1ccc(CNc2ccc(NC(=O)c3ccccc3)cn2)cc1[N+](=O)[O-] ZINC000475550577 946620951 /nfs/dbraw/zinc/62/09/51/946620951.db2.gz OUJQYZMDXLOTLY-UHFFFAOYSA-N 0 0 362.389 3.585 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N[C@H](C)[C@@H](O)c1ccc(F)cc1 ZINC000267971255 946625081 /nfs/dbraw/zinc/62/50/81/946625081.db2.gz NCCKTWFPUXZUIO-SJKOYZFVSA-N 0 0 361.373 3.594 20 5 FHBDRN CCc1c(C(=O)Nc2cccc([N+](=O)[O-])c2)cnn1-c1ccccc1OC ZINC000186599765 946633026 /nfs/dbraw/zinc/63/30/26/946633026.db2.gz ZWXPUHOAHSGIAJ-UHFFFAOYSA-N 0 0 366.377 3.604 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NC[C@H](C)Oc1ccc(F)cc1 ZINC000475554816 946637210 /nfs/dbraw/zinc/63/72/10/946637210.db2.gz NPDFNQOEFZLEBC-ZDUSSCGKSA-N 0 0 361.373 3.940 20 5 FHBDRN COC[C@H](Cc1ccccc1)NC(=O)Nc1cc(C)c([N+](=O)[O-])cc1C ZINC000475556844 946640861 /nfs/dbraw/zinc/64/08/61/946640861.db2.gz UKSVHMPZQYNNCR-INIZCTEOSA-N 0 0 357.410 3.591 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NCCSCC(F)(F)F ZINC000475558427 946646918 /nfs/dbraw/zinc/64/69/18/946646918.db2.gz JGGKCSPQKAHAOI-UHFFFAOYSA-N 0 0 351.350 3.629 20 5 FHBDRN O=C(c1cccc2c(=O)c3cccc(F)c3[nH]c12)N1CCCC2(CC2)C1 ZINC000444330370 946662376 /nfs/dbraw/zinc/66/23/76/946662376.db2.gz LPQGTZMMHOQBPD-UHFFFAOYSA-N 0 0 350.393 3.837 20 5 FHBDRN C[C@H](NC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2)c1ccc2c(c1)CCCC2 ZINC000027805976 946675580 /nfs/dbraw/zinc/67/55/80/946675580.db2.gz BTADHFYOHWUTIN-LBPRGKRZSA-N 0 0 368.389 3.693 20 5 FHBDRN COc1ccc([C@H](C)CCNC(=O)c2ccc([N+](=O)[O-])c(OC)c2)cc1 ZINC000151950764 946682046 /nfs/dbraw/zinc/68/20/46/946682046.db2.gz ZSCCCJITZUBECV-CYBMUJFWSA-N 0 0 358.394 3.536 20 5 FHBDRN O=c1[nH]c(-c2ccc(N3CCC(O)CC3)nc2)nc2cc3ccccc3cc12 ZINC000487498704 946696051 /nfs/dbraw/zinc/69/60/51/946696051.db2.gz FTKMTNXLLLBTOL-UHFFFAOYSA-N 0 0 372.428 3.512 20 5 FHBDRN COc1cc2c(cc1F)CN(C(=O)Nc1cc(C)c([N+](=O)[O-])cc1C)CC2 ZINC000475572400 946715683 /nfs/dbraw/zinc/71/56/83/946715683.db2.gz XXRVKUMZYCPNTB-UHFFFAOYSA-N 0 0 373.384 3.950 20 5 FHBDRN CCc1c(C(=O)N2CCc3ccc([N+](=O)[O-])cc32)cnn1-c1ccccc1 ZINC000074410977 946731312 /nfs/dbraw/zinc/73/13/12/946731312.db2.gz UFTGZDRMZZYFMQ-UHFFFAOYSA-N 0 0 362.389 3.546 20 5 FHBDRN CCc1onc(C)c1NC(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000278849460 946742964 /nfs/dbraw/zinc/74/29/64/946742964.db2.gz LSYSHMUFBJOCHA-UHFFFAOYSA-N 0 0 372.303 3.794 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NC[C@H](C)Oc1ccccc1F ZINC000475583729 946750582 /nfs/dbraw/zinc/75/05/82/946750582.db2.gz XIOVEHYLNRLKSZ-ZDUSSCGKSA-N 0 0 361.373 3.940 20 5 FHBDRN CCc1c(C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)cnn1C1CCCC1 ZINC000475243193 946752814 /nfs/dbraw/zinc/75/28/14/946752814.db2.gz DUQPPPPKSUAMRV-CYBMUJFWSA-N 0 0 356.426 3.960 20 5 FHBDRN CCc1c(C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cnn1C1CCCC1 ZINC000475243195 946753086 /nfs/dbraw/zinc/75/30/86/946753086.db2.gz DUQPPPPKSUAMRV-ZDUSSCGKSA-N 0 0 356.426 3.960 20 5 FHBDRN Cc1c2ccccc2oc1[C@@H](NC(=O)CCn1cc([N+](=O)[O-])cn1)C(C)C ZINC000112187110 946756876 /nfs/dbraw/zinc/75/68/76/946756876.db2.gz UQDRUCYFFJUGBY-SFHVURJKSA-N 0 0 370.409 3.750 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)c2cnc(N(C)C)c(Cl)c2)cc1[N+](=O)[O-] ZINC001126610875 946758500 /nfs/dbraw/zinc/75/85/00/946758500.db2.gz MECNCMSGGQWIPH-LLVKDONJSA-N 0 0 362.817 3.509 20 5 FHBDRN CCOc1cccc(NCC2CCN(CC(F)(F)F)CC2)c1[N+](=O)[O-] ZINC000186642249 946769901 /nfs/dbraw/zinc/76/99/01/946769901.db2.gz GPCPIQLOLHSNNK-UHFFFAOYSA-N 0 0 361.364 3.680 20 5 FHBDRN CCC(C)(C)[C@@H]1CCCN1C(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000134025408 946771958 /nfs/dbraw/zinc/77/19/58/946771958.db2.gz ZNRWYRWOGSJLDR-KRWDZBQOSA-N 0 0 356.426 3.821 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CN(Cc1cccs1)C[C@H]1CCCO1 ZINC000020954564 946775072 /nfs/dbraw/zinc/77/50/72/946775072.db2.gz IURCSCNJACSIKW-MRXNPFEDSA-N 0 0 362.451 3.846 20 5 FHBDRN Cc1c(Br)scc1C(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000186646883 946779958 /nfs/dbraw/zinc/77/99/58/946779958.db2.gz ZJWKUEDIJHQEGO-UHFFFAOYSA-N 0 0 367.224 3.930 20 5 FHBDRN CCOC(=O)c1ccnc(N(C)Cc2c(F)cccc2Cl)c1[N+](=O)[O-] ZINC000523112300 946781049 /nfs/dbraw/zinc/78/10/49/946781049.db2.gz VBXPUCWDORDGAL-UHFFFAOYSA-N 0 0 367.764 3.595 20 5 FHBDRN C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1cc(=O)[nH]c2ccc(F)cc21 ZINC000523113366 946789257 /nfs/dbraw/zinc/78/92/57/946789257.db2.gz NKERTQCWYGDHQQ-JTQLQIEISA-N 0 0 367.336 3.579 20 5 FHBDRN C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)Nc3ccccc3N)cc2[N+](=O)[O-])C1 ZINC000119404701 946794895 /nfs/dbraw/zinc/79/48/95/946794895.db2.gz UMQPHARGPRGJQY-ZIAGYGMSSA-N 0 0 368.437 3.912 20 5 FHBDRN O=[N+]([O-])C[C@H](Oc1cc(OC(F)(F)F)ccc1Br)C1CC1 ZINC001227877613 946814978 /nfs/dbraw/zinc/81/49/78/946814978.db2.gz NLKRRESPQVKGBI-NSHDSACASA-N 0 0 370.121 3.782 20 5 FHBDRN CC(C)OC(=O)C[C@H]1CCCN(Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000184471552 946821781 /nfs/dbraw/zinc/82/17/81/946821781.db2.gz CLBAFRBYJHFFDT-CYBMUJFWSA-N 0 0 354.834 3.802 20 5 FHBDRN O=[N+]([O-])c1cc(F)ccc1Cc1nc([C@@H]2CCOC3(CCCC3)C2)no1 ZINC000897184094 946832202 /nfs/dbraw/zinc/83/22/02/946832202.db2.gz OGQFPVMMGQYCCW-CYBMUJFWSA-N 0 0 361.373 3.915 20 5 FHBDRN CCCC(=O)Nc1ccc(CNC(=O)c2c(C)c(F)ccc2[N+](=O)[O-])cc1 ZINC000843767944 946836026 /nfs/dbraw/zinc/83/60/26/946836026.db2.gz PNPGPUUSSGWEBC-UHFFFAOYSA-N 0 0 373.384 3.711 20 5 FHBDRN COc1ccc(C)c2c1N(C(=O)c1cccc([N+](=O)[O-])c1OC)CCC2 ZINC000475598555 946844224 /nfs/dbraw/zinc/84/42/24/946844224.db2.gz ATFPXNWPOPBRKJ-UHFFFAOYSA-N 0 0 356.378 3.513 20 5 FHBDRN C/C=C\c1ccc(OC[C@@H](O)COc2cccc([N+](=O)[O-])c2C)c(OC)c1 ZINC000575335195 946844637 /nfs/dbraw/zinc/84/46/37/946844637.db2.gz SECVYMFEWHLMBA-LEXSJLIMSA-N 0 0 373.405 3.764 20 5 FHBDRN CCC(=O)Nc1cccc(-c2noc(-c3n[nH]c(C(C)C)c3[N+](=O)[O-])n2)c1 ZINC000546273144 946846573 /nfs/dbraw/zinc/84/65/73/946846573.db2.gz RJTNHBHOXWTMRF-UHFFFAOYSA-N 0 0 370.369 3.507 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1ccn(Cc2ccccc2)n1 ZINC000475319784 946852907 /nfs/dbraw/zinc/85/29/07/946852907.db2.gz IGMRECJWWHWRTJ-UHFFFAOYSA-N 0 0 350.378 3.709 20 5 FHBDRN COCC1CCN(C(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)CC1 ZINC000112312972 946854830 /nfs/dbraw/zinc/85/48/30/946854830.db2.gz ABWWAWIEFNPUAA-UHFFFAOYSA-N 0 0 369.421 3.837 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)[C@H](O)Cc1c(F)cccc1Cl ZINC000475322679 946866451 /nfs/dbraw/zinc/86/64/51/946866451.db2.gz QZANNPYCNJFMGH-MRXNPFEDSA-N 0 0 366.776 3.546 20 5 FHBDRN O=[N+]([O-])c1cccc(CCc2nc([C@H]3CCOC4(CCCC4)C3)no2)c1 ZINC000897189854 946878914 /nfs/dbraw/zinc/87/89/14/946878914.db2.gz NEBXBBFJDNYPEI-HNNXBMFYSA-N 0 0 357.410 3.970 20 5 FHBDRN COc1c(C(=O)N[C@H](C)Cc2nc3ccccc3s2)cccc1[N+](=O)[O-] ZINC000475326028 946886050 /nfs/dbraw/zinc/88/60/50/946886050.db2.gz QNCNEBHLXNFBAA-LLVKDONJSA-N 0 0 371.418 3.574 20 5 FHBDRN CN(C)c1c(Cl)cccc1NC(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000048739509 946902680 /nfs/dbraw/zinc/90/26/80/946902680.db2.gz RQXKQZNVTLWGOB-UHFFFAOYSA-N 0 0 362.817 3.978 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2ncn(Cc3ccc(Br)s3)n2)c1 ZINC000112521521 946905291 /nfs/dbraw/zinc/90/52/91/946905291.db2.gz WTXGUAXMSMQYJS-UHFFFAOYSA-N 0 0 365.212 3.726 20 5 FHBDRN COc1cccc([C@@H]2C[C@H](C)CN2C(=O)c2cc([N+](=O)[O-])cnc2C)c1 ZINC000544323745 946906596 /nfs/dbraw/zinc/90/65/96/946906596.db2.gz ZKTFRKCDRVCUHW-SGTLLEGYSA-N 0 0 355.394 3.530 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2nc(CN[C@@H](CCO)c3ccco3)cs2)c1 ZINC000184500178 946907788 /nfs/dbraw/zinc/90/77/88/946907788.db2.gz ZEJZHJBMJOKPCM-HNNXBMFYSA-N 0 0 359.407 3.525 20 5 FHBDRN C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)[C@@H]1CCN(c2ccccc2)[C@@H]1C ZINC000475341677 946910167 /nfs/dbraw/zinc/91/01/67/946910167.db2.gz DMEODHXCGMANKI-SPYBWZPUSA-N 0 0 365.433 3.787 20 5 FHBDRN CCCOc1cc(OC)ccc1C(=O)N1c2ccc([N+](=O)[O-])cc2C[C@H]1C ZINC000475341457 946911602 /nfs/dbraw/zinc/91/16/02/946911602.db2.gz GEXSZQFGILFNIU-CYBMUJFWSA-N 0 0 370.405 3.984 20 5 FHBDRN Cc1csc(C2(NC(=O)c3cc([N+](=O)[O-])c(C)s3)CCCC2)n1 ZINC000112598247 946917795 /nfs/dbraw/zinc/91/77/95/946917795.db2.gz ZKQGKQLROQTIDW-UHFFFAOYSA-N 0 0 351.453 3.929 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1C[C@H]1c1ccc(F)c(F)c1 ZINC000186331596 946919201 /nfs/dbraw/zinc/91/92/01/946919201.db2.gz AFBYXNZHBFLSJP-QWHCGFSZSA-N 0 0 366.751 3.946 20 5 FHBDRN CCOC(=O)c1cc(C(=O)Nc2cnc3ccccc3c2)cc([N+](=O)[O-])c1 ZINC000025156710 946930313 /nfs/dbraw/zinc/93/03/13/946930313.db2.gz GPHBGCXQOVPFTJ-UHFFFAOYSA-N 0 0 365.345 3.572 20 5 FHBDRN C[C@H](Oc1ccc(F)c(F)c1)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186333748 946937014 /nfs/dbraw/zinc/93/70/14/946937014.db2.gz KPNBICRDFCCGPG-VIFPVBQESA-N 0 0 370.739 3.610 20 5 FHBDRN CCO[C@@H]1C[C@@H](N(C)C(=O)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)C12CCC2 ZINC000458892014 946943472 /nfs/dbraw/zinc/94/34/72/946943472.db2.gz UCGHFRUYMIHXQI-IAOVAPTHSA-N 0 0 361.442 3.645 20 5 FHBDRN CCCN(C(=O)Cn1cc([N+](=O)[O-])cn1)[C@H](C)c1cc2ccccc2o1 ZINC000053370923 946945599 /nfs/dbraw/zinc/94/55/99/946945599.db2.gz BZJXZXPKTHUMBQ-CYBMUJFWSA-N 0 0 356.382 3.537 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1OC(F)F ZINC000186335829 946948455 /nfs/dbraw/zinc/94/84/55/946948455.db2.gz ARDWEMBVCRYLRU-UHFFFAOYSA-N 0 0 356.712 3.780 20 5 FHBDRN CC[C@@H](CO)N(Cc1ccccc1)C(=O)N[C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000458894597 946949873 /nfs/dbraw/zinc/94/98/73/946949873.db2.gz ZWEXMPQVDQOSHX-YJBOKZPZSA-N 0 0 371.437 3.639 20 5 FHBDRN O=C(NC[C@H]1CCCO1)c1ccccc1Sc1ccccc1[N+](=O)[O-] ZINC000440436082 946968675 /nfs/dbraw/zinc/96/86/75/946968675.db2.gz FEUIJYQKRZVPAU-CYBMUJFWSA-N 0 0 358.419 3.655 20 5 FHBDRN CC(C)(C)OCc1cccc(CNC(=O)Cc2ccccc2[N+](=O)[O-])c1 ZINC000523185049 946974280 /nfs/dbraw/zinc/97/42/80/946974280.db2.gz LQEULPDTFPNGBP-UHFFFAOYSA-N 0 0 356.422 3.769 20 5 FHBDRN Nc1c(C(=O)N2C[C@H](c3ccccc3)c3ccccc32)cccc1[N+](=O)[O-] ZINC000444510947 946982298 /nfs/dbraw/zinc/98/22/98/946982298.db2.gz SBAMOOWTSCEARL-QGZVFWFLSA-N 0 0 359.385 3.969 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H](CC(C)C)c1ccccc1 ZINC000048975670 946983956 /nfs/dbraw/zinc/98/39/56/946983956.db2.gz QVJLAAORHRVCLQ-SFHVURJKSA-N 0 0 369.421 3.745 20 5 FHBDRN Cc1cc(C(=O)N(Cc2ccncc2)Cc2cccnc2)cc([N+](=O)[O-])c1 ZINC000112902797 946985645 /nfs/dbraw/zinc/98/56/45/946985645.db2.gz QKFJKZUGUYIGFO-UHFFFAOYSA-N 0 0 362.389 3.536 20 5 FHBDRN O=C(CCn1cc([N+](=O)[O-])c(-c2ccncc2)n1)Nc1ccc(Cl)cc1 ZINC000432260450 946999182 /nfs/dbraw/zinc/99/91/82/946999182.db2.gz XNRUGYKBKPMLRL-UHFFFAOYSA-N 0 0 371.784 3.536 20 5 FHBDRN COc1ccc2c(c1)CCC[C@@H]2N(C)C(=O)c1cccc([N+](=O)[O-])c1OC ZINC000475388465 947006697 /nfs/dbraw/zinc/00/66/97/947006697.db2.gz PGSLYOPSPYTJIC-KRWDZBQOSA-N 0 0 370.405 3.762 20 5 FHBDRN CCCc1ccc(-c2csc(NC(=O)Cn3cnc([N+](=O)[O-])c3)n2)cc1 ZINC000026122735 947016677 /nfs/dbraw/zinc/01/66/77/947016677.db2.gz UDMJDALLXHENDQ-UHFFFAOYSA-N 0 0 371.422 3.506 20 5 FHBDRN Cc1ccc2c(c1)CC[C@H]2NS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000511927695 947016736 /nfs/dbraw/zinc/01/67/36/947016736.db2.gz QIRHALBXDLFMKH-OAHLLOKOSA-N 0 0 366.826 3.522 20 5 FHBDRN Cc1cc(C(=O)N2C[C@@H](C)O[C@@H](c3ccc(F)cc3)C2)ccc1[N+](=O)[O-] ZINC000152013618 947021754 /nfs/dbraw/zinc/02/17/54/947021754.db2.gz DJAZXFQIZSNLSU-FZKQIMNGSA-N 0 0 358.369 3.645 20 5 FHBDRN COc1c(C(=O)Nc2scnc2-c2ccccc2)cccc1[N+](=O)[O-] ZINC000475608789 947025222 /nfs/dbraw/zinc/02/52/22/947025222.db2.gz PDRBWIDHKNNCMH-UHFFFAOYSA-N 0 0 355.375 3.979 20 5 FHBDRN COc1ccc(SCC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000186351769 947027650 /nfs/dbraw/zinc/02/76/50/947027650.db2.gz SHVNSXFLQIGBFR-UHFFFAOYSA-N 0 0 366.826 3.665 20 5 FHBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1CN(C)Cc1cnc(C(C)C)nc1 ZINC000440482668 947031353 /nfs/dbraw/zinc/03/13/53/947031353.db2.gz PPFFZCMMLKOQPV-UHFFFAOYSA-N 0 0 358.442 3.927 20 5 FHBDRN C[C@H](NCc1noc(-c2ccc(F)cc2F)n1)c1ccccc1[N+](=O)[O-] ZINC000444608350 947034980 /nfs/dbraw/zinc/03/49/80/947034980.db2.gz KWOHVCUPIZQRSZ-JTQLQIEISA-N 0 0 360.320 3.774 20 5 FHBDRN Cc1ccc(C(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)c(Cl)c1C ZINC000444635422 947047237 /nfs/dbraw/zinc/04/72/37/947047237.db2.gz KQJCVEHBUFXHLU-UHFFFAOYSA-N 0 0 358.785 3.671 20 5 FHBDRN COCCN(Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@@H](C)c1ccccc1 ZINC000444620606 947052580 /nfs/dbraw/zinc/05/25/80/947052580.db2.gz OKXNKXNCWUOIFX-AWEZNQCLSA-N 0 0 354.410 3.681 20 5 FHBDRN O=C(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)C1(c2ccccc2)CCCC1 ZINC000444632013 947061743 /nfs/dbraw/zinc/06/17/43/947061743.db2.gz NGBQKQXMOPVTCR-UHFFFAOYSA-N 0 0 364.405 3.599 20 5 FHBDRN CC[C@@H](CC(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccccc1 ZINC000444633233 947064293 /nfs/dbraw/zinc/06/42/93/947064293.db2.gz BNGHDCSBVYHVEA-ZDUSSCGKSA-N 0 0 352.394 3.671 20 5 FHBDRN CC(C)[C@@H](Cc1ccccc1)C(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444633364 947064725 /nfs/dbraw/zinc/06/47/25/947064725.db2.gz BXKFZYUWJSIEIJ-MRXNPFEDSA-N 0 0 366.421 3.602 20 5 FHBDRN O=C(N[C@@H]1CCc2ccccc2C1)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000079301789 947069064 /nfs/dbraw/zinc/06/90/64/947069064.db2.gz VZXNMRPFHXIDPI-CQSZACIVSA-N 0 0 364.323 3.901 20 5 FHBDRN CNc1ccc(C(=O)N2CCCC[C@@H]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000523282441 947079446 /nfs/dbraw/zinc/07/94/46/947079446.db2.gz MQXXXMSTCHSSTB-QGZVFWFLSA-N 0 0 353.422 3.874 20 5 FHBDRN CN(c1ccccc1)c1ccc(C(=O)N2CCc3ccc([N+](=O)[O-])cc32)cn1 ZINC000049624261 947091355 /nfs/dbraw/zinc/09/13/55/947091355.db2.gz OOTYWFFHMZDUKT-UHFFFAOYSA-N 0 0 374.400 3.961 20 5 FHBDRN Nc1ncc([N+](=O)[O-])cc1C(=O)N1CCCC[C@@H]1c1cccc(Cl)c1 ZINC000444666950 947093329 /nfs/dbraw/zinc/09/33/29/947093329.db2.gz TXSDMKOUOZRKJB-OAHLLOKOSA-N 0 0 360.801 3.593 20 5 FHBDRN CCCOc1ccc2c(c1)CCN(Cc1nc3cc([N+](=O)[O-])ccc3[nH]1)C2 ZINC000444673507 947098584 /nfs/dbraw/zinc/09/85/84/947098584.db2.gz IXMREQKKKHODKF-UHFFFAOYSA-N 0 0 366.421 3.818 20 5 FHBDRN CN(CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])CC1(c2ccccc2)CC1 ZINC000444675614 947100117 /nfs/dbraw/zinc/10/01/17/947100117.db2.gz OELBATLXUUUIOZ-UHFFFAOYSA-N 0 0 373.840 3.850 20 5 FHBDRN C[C@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@@H]1Oc2ccccc2[C@@H]1C ZINC000444678588 947103118 /nfs/dbraw/zinc/10/31/18/947103118.db2.gz ZLAZOJUVXMMVRJ-SYTFOFBDSA-N 0 0 352.394 3.514 20 5 FHBDRN O=[N+]([O-])c1cc2c(cc1F)ncnc2N[C@@H]1C[C@H]1c1ccc(F)c(F)c1 ZINC001168065283 947103417 /nfs/dbraw/zinc/10/34/17/947103417.db2.gz ZYNCYBMFQKFZIY-BJOHPYRUSA-N 0 0 360.295 3.923 20 5 FHBDRN C[C@H](NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccc(OC(F)F)cc1 ZINC000444682497 947107268 /nfs/dbraw/zinc/10/72/68/947107268.db2.gz ACDORVYTUDJCMV-JTQLQIEISA-N 0 0 362.336 3.923 20 5 FHBDRN Cc1ccc(CN(CC2CC2)C(=O)c2cc(F)c(F)cc2[N+](=O)[O-])cn1 ZINC000843683376 947111102 /nfs/dbraw/zinc/11/11/02/947111102.db2.gz OOBZWTAMNWRRFF-UHFFFAOYSA-N 0 0 361.348 3.629 20 5 FHBDRN COc1ccc(NC(=O)[C@H](C)N(C)Cc2cc(C)cc(C)c2)c([N+](=O)[O-])c1 ZINC000444694969 947119808 /nfs/dbraw/zinc/11/98/08/947119808.db2.gz KWTCZJKVYOZRAC-HNNXBMFYSA-N 0 0 371.437 3.679 20 5 FHBDRN Cc1cc(C)cc(C[N@@H+](C)[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)c1 ZINC000444696649 947121382 /nfs/dbraw/zinc/12/13/82/947121382.db2.gz WEFBKVNULVPZLY-MRXNPFEDSA-N 0 0 355.438 3.979 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]c(CN(Cc3c(F)cccc3F)C3CC3)nc2c1 ZINC000444701974 947127455 /nfs/dbraw/zinc/12/74/55/947127455.db2.gz QHCYZENLPMZEBD-UHFFFAOYSA-N 0 0 358.348 3.914 20 5 FHBDRN CCOC(=O)[C@H]1CCN(CCOc2ccccc2[N+](=O)[O-])c2ccccc21 ZINC000444718930 947159658 /nfs/dbraw/zinc/15/96/58/947159658.db2.gz XAQILPYGTXLHGL-INIZCTEOSA-N 0 0 370.405 3.531 20 5 FHBDRN CCOC(=O)[C@@H]1CCN(Cc2cccc([N+](=O)[O-])c2C)c2ccccc21 ZINC000444718725 947159765 /nfs/dbraw/zinc/15/97/65/947159765.db2.gz PEIZXJJNGFYGRY-QGZVFWFLSA-N 0 0 354.406 3.960 20 5 FHBDRN Cc1ccc(F)c(CN(C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000444740022 947166463 /nfs/dbraw/zinc/16/64/63/947166463.db2.gz VJFOPDQCCQXUDX-UHFFFAOYSA-N 0 0 365.792 3.766 20 5 FHBDRN Cc1cc(NC(=O)c2cccc3c(=O)c4cccc(F)c4[nH]c23)sn1 ZINC000444741224 947177616 /nfs/dbraw/zinc/17/76/16/947177616.db2.gz CZNYECQSIBNNJD-UHFFFAOYSA-N 0 0 353.378 3.838 20 5 FHBDRN C[C@@H](N[C@@H](c1ccco1)c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000049974355 947179683 /nfs/dbraw/zinc/17/96/83/947179683.db2.gz JHCZQPZJDCFABY-AUUYWEPGSA-N 0 0 365.389 3.894 20 5 FHBDRN CC(C)(C)OC(=O)CCSc1cc(C(F)(F)F)ncc1[N+](=O)[O-] ZINC000440542755 947180007 /nfs/dbraw/zinc/18/00/07/947180007.db2.gz GJYPWQQISWGMKX-UHFFFAOYSA-N 0 0 352.334 3.833 20 5 FHBDRN CCOC(=O)c1cc(NC(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)cn1C ZINC000440572398 947240700 /nfs/dbraw/zinc/24/07/00/947240700.db2.gz UCQKIKMYERUFJY-UHFFFAOYSA-N 0 0 373.409 3.660 20 5 FHBDRN O=C(NCCc1ccc(F)cc1)c1sc(Br)cc1[N+](=O)[O-] ZINC000444829368 947245354 /nfs/dbraw/zinc/24/53/54/947245354.db2.gz QWKBODQUTUQEFS-UHFFFAOYSA-N 0 0 373.203 3.530 20 5 FHBDRN CCOc1ccccc1[C@H](CC)NC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000523415476 947246729 /nfs/dbraw/zinc/24/67/29/947246729.db2.gz LPGBPMGEVYNWJX-AWEZNQCLSA-N 0 0 372.377 3.603 20 5 FHBDRN O=C(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)Nc1cc(Cl)ccc1F ZINC000444819142 947253762 /nfs/dbraw/zinc/25/37/62/947253762.db2.gz QVETXMDFVNRTNV-UHFFFAOYSA-N 0 0 363.736 3.585 20 5 FHBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N(c1ccccc1)C1CC1 ZINC001211861696 947258140 /nfs/dbraw/zinc/25/81/40/947258140.db2.gz XDWCQHFSBBTSQF-UHFFFAOYSA-N 0 0 352.799 3.606 20 5 FHBDRN C[C@@H](c1ccc(C(F)(F)F)cc1)N(C)C(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC000444848660 947259364 /nfs/dbraw/zinc/25/93/64/947259364.db2.gz MEGAFLXCTOTUEG-VIFPVBQESA-N 0 0 369.299 3.547 20 5 FHBDRN O=C(Nc1cnn(Cc2ccccc2)c1)c1ccc([N+](=O)[O-])cc1Cl ZINC000384245966 947261542 /nfs/dbraw/zinc/26/15/42/947261542.db2.gz NIWPUHBQVVRPDZ-UHFFFAOYSA-N 0 0 356.769 3.745 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N(CC)CCc1nccs1 ZINC000439894355 947278695 /nfs/dbraw/zinc/27/86/95/947278695.db2.gz CVNNKMVHZBTPTD-UHFFFAOYSA-N 0 0 364.427 3.547 20 5 FHBDRN CSc1nsc(NC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)n1 ZINC000444844773 947278759 /nfs/dbraw/zinc/27/87/59/947278759.db2.gz CVBVCKUVJBXNJS-UHFFFAOYSA-N 0 0 368.443 3.507 20 5 FHBDRN O=C(O[C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1)c1cc2occc2s1 ZINC000759928878 947282286 /nfs/dbraw/zinc/28/22/86/947282286.db2.gz HQKUJYZZDJMWDR-GHMZBOCLSA-N 0 0 361.379 3.940 20 5 FHBDRN COCc1ccc(CNC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)cc1 ZINC000444856866 947283570 /nfs/dbraw/zinc/28/35/70/947283570.db2.gz JWJDHIWSNQGTRI-UHFFFAOYSA-N 0 0 372.424 3.758 20 5 FHBDRN CN(Cc1cc(C(C)(C)C)n[nH]1)c1cc(C(F)(F)F)ncc1[N+](=O)[O-] ZINC000444869693 947296338 /nfs/dbraw/zinc/29/63/38/947296338.db2.gz JNSXKXHTUFJJJR-UHFFFAOYSA-N 0 0 357.336 3.666 20 5 FHBDRN O=C(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)N[C@@H]1CC[C@@H]2CCCC[C@@H]2C1 ZINC000444873087 947298505 /nfs/dbraw/zinc/29/85/05/947298505.db2.gz JGMQTGDGMHQSCO-BFHYXJOUSA-N 0 0 371.441 3.629 20 5 FHBDRN C[C@@H]1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2Br)[C@@H](C)C1 ZINC000523491894 947310640 /nfs/dbraw/zinc/31/06/40/947310640.db2.gz PWMITXXSADBPON-BFVZDQMLSA-N 0 0 355.232 3.912 20 5 FHBDRN CCC[C@@H](NC(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccccc1 ZINC000444887365 947314439 /nfs/dbraw/zinc/31/44/39/947314439.db2.gz HMJRZUOPOTUZLS-OAHLLOKOSA-N 0 0 367.409 3.812 20 5 FHBDRN O=C(Cn1ccc2ccccc21)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000523496630 947315766 /nfs/dbraw/zinc/31/57/66/947315766.db2.gz GBRWHFHOCXJUMQ-UHFFFAOYSA-N 0 0 351.406 3.689 20 5 FHBDRN CN(CCCOc1ccc(F)cc1)C(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000523509066 947321879 /nfs/dbraw/zinc/32/18/79/947321879.db2.gz GFEYIWFTQHAYHY-UHFFFAOYSA-N 0 0 374.412 3.939 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)Nc1c[nH]nc1-c1ccccc1 ZINC000444904586 947325432 /nfs/dbraw/zinc/32/54/32/947325432.db2.gz IFXMSNSUVNNMMN-UHFFFAOYSA-N 0 0 353.338 3.638 20 5 FHBDRN CO[C@@H](C)c1cccc(NC(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)c1 ZINC000444905807 947326284 /nfs/dbraw/zinc/32/62/84/947326284.db2.gz KVVZJMUOUTWKPN-NSHDSACASA-N 0 0 369.381 3.500 20 5 FHBDRN Cc1ccc(-n2nc(C(C)C)cc2NC(=O)c2ccc([N+](=O)[O-])n2C)cc1 ZINC000523516437 947327597 /nfs/dbraw/zinc/32/75/97/947327597.db2.gz FTOKMDGKCXHSMF-UHFFFAOYSA-N 0 0 367.409 3.803 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)Nc1ccc(C)c(NC(C)=O)c1 ZINC000444892358 947330904 /nfs/dbraw/zinc/33/09/04/947330904.db2.gz ATMBHJKSTVXGCO-UHFFFAOYSA-N 0 0 358.354 3.514 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@@H](C)Oc1cccc(C)c1 ZINC000444895760 947335082 /nfs/dbraw/zinc/33/50/82/947335082.db2.gz KWUOHRQDDGHQKC-CYBMUJFWSA-N 0 0 359.382 3.501 20 5 FHBDRN C[C@@H](CNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1)N(C)c1ccccc1 ZINC000523528821 947338261 /nfs/dbraw/zinc/33/82/61/947338261.db2.gz RDWKVZCDVJOCOX-HNNXBMFYSA-N 0 0 355.438 3.514 20 5 FHBDRN CCc1nnsc1C(=O)N(Cc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000440600682 947352272 /nfs/dbraw/zinc/35/22/72/947352272.db2.gz IREPOYSVQPHXMP-UHFFFAOYSA-N 0 0 368.418 3.856 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[C@H](c2cccc(C)c2)C1 ZINC000444935986 947358452 /nfs/dbraw/zinc/35/84/52/947358452.db2.gz IRLVYASNRUEUBH-HNNXBMFYSA-N 0 0 355.394 3.933 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[C@H](COc2ccccc2)C1 ZINC000444938085 947360217 /nfs/dbraw/zinc/36/02/17/947360217.db2.gz VINLQYZYRJLIIS-AWEZNQCLSA-N 0 0 371.393 3.536 20 5 FHBDRN CCOc1ccc(NC(=O)NCCCNc2ccc(C)cc2[N+](=O)[O-])cc1 ZINC000523556699 947369530 /nfs/dbraw/zinc/36/95/30/947369530.db2.gz JQICJUPLOBVJFA-UHFFFAOYSA-N 0 0 372.425 3.926 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@H](C)[C@H]1Oc2ccccc2[C@@H]1C ZINC000444931118 947370578 /nfs/dbraw/zinc/37/05/78/947370578.db2.gz NDSXPYHAFZTARS-IUUKEHGRSA-N 0 0 371.393 3.678 20 5 FHBDRN O=C(NCc1ccc2c(c1)COC2)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000444967500 947376928 /nfs/dbraw/zinc/37/69/28/947376928.db2.gz AJDJYNXDPNTCDK-UHFFFAOYSA-N 0 0 370.408 3.642 20 5 FHBDRN CCc1cnc(CNC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)s1 ZINC000444988944 947401599 /nfs/dbraw/zinc/40/15/99/947401599.db2.gz FQDMYWBJXBOIGU-UHFFFAOYSA-N 0 0 363.442 3.630 20 5 FHBDRN CC(C)CC[C@@](C)(O)CNC(=O)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000444993246 947405861 /nfs/dbraw/zinc/40/58/61/947405861.db2.gz QXLJSELEBMSEQB-JOCHJYFZSA-N 0 0 366.461 3.598 20 5 FHBDRN C/C(=C\c1ccc(Cl)cc1)C(=O)N1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000785327916 947432711 /nfs/dbraw/zinc/43/27/11/947432711.db2.gz VVKPLBFTZKRHCK-OUKQBFOZSA-N 0 0 374.828 3.712 20 5 FHBDRN CCCC[C@H]1CCC[C@@H]1NC(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000445028032 947450436 /nfs/dbraw/zinc/45/04/36/947450436.db2.gz GUYUKJQFELPZHX-JSGCOSHPSA-N 0 0 359.430 3.629 20 5 FHBDRN O=C(O[C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1)[C@@H]1CSc2ccccc21 ZINC000759931183 947457860 /nfs/dbraw/zinc/45/78/60/947457860.db2.gz LARVGOVMMAWCPJ-RBSFLKMASA-N 0 0 373.434 3.708 20 5 FHBDRN CC[C@@H]1CN(C(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)c2ccccc2O1 ZINC000188243607 947469179 /nfs/dbraw/zinc/46/91/79/947469179.db2.gz NARWABHFBFNDEX-CQSZACIVSA-N 0 0 356.378 3.730 20 5 FHBDRN O=C(CCc1cc(F)ccc1[N+](=O)[O-])N1CC[C@@H](Cc2ccc(F)cc2)C1 ZINC001126205800 947472707 /nfs/dbraw/zinc/47/27/07/947472707.db2.gz FCCRGJLBXLAPAL-HNNXBMFYSA-N 0 0 374.387 3.897 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)N(C)Cc2cc(C(C)(C)C)n[nH]2)cc1[N+](=O)[O-] ZINC000445093652 947508194 /nfs/dbraw/zinc/50/81/94/947508194.db2.gz QBVWJIXZZSQXAP-ZDUSSCGKSA-N 0 0 373.457 3.826 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)N1CCC[C@H]1C[C@@H](O)c1ccc(F)cc1 ZINC000162829865 947514206 /nfs/dbraw/zinc/51/42/06/947514206.db2.gz QWPGGTLMQBXXEN-ZWKOTPCHSA-N 0 0 373.384 3.854 20 5 FHBDRN COCc1nc(CNc2cc(C)c([N+](=O)[O-])cn2)c(-c2ccccc2)s1 ZINC000440656760 947518166 /nfs/dbraw/zinc/51/81/66/947518166.db2.gz ZVMFRZYTMSQYAX-UHFFFAOYSA-N 0 0 370.434 3.602 20 5 FHBDRN C[C@@H]1CN(C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)[C@@H]2CCCC[C@H]21 ZINC000248388606 947524313 /nfs/dbraw/zinc/52/43/13/947524313.db2.gz RHAFZNAUSLNXGV-HYVNUMGLSA-N 0 0 357.454 3.846 20 5 FHBDRN CO[C@@H]1CCN(c2ccc([N+](=O)[O-])c(OCc3ccccc3)n2)[C@H](C)C1 ZINC000440669330 947535762 /nfs/dbraw/zinc/53/57/62/947535762.db2.gz FAUJYEHSVFIONW-GDBMZVCRSA-N 0 0 357.410 3.573 20 5 FHBDRN O=C(c1ccc(F)cc1[N+](=O)[O-])N1CC[C@@H](OCCCc2ccccc2)C1 ZINC000150782661 947541609 /nfs/dbraw/zinc/54/16/09/947541609.db2.gz XQLKJVUYUOEOID-QGZVFWFLSA-N 0 0 372.396 3.598 20 5 FHBDRN CCOC(=O)c1cc(N[C@H](C)c2cc(OC)ccc2OC)ccc1[N+](=O)[O-] ZINC000467733412 947559577 /nfs/dbraw/zinc/55/95/77/947559577.db2.gz VVKDOKZLWHEXOS-GFCCVEGCSA-N 0 0 374.393 3.962 20 5 FHBDRN CO[C@H]1CCN(c2ccc([N+](=O)[O-])c(OCc3ccccc3)n2)[C@H](C)C1 ZINC000440669333 947563055 /nfs/dbraw/zinc/56/30/55/947563055.db2.gz FAUJYEHSVFIONW-ZBFHGGJFSA-N 0 0 357.410 3.573 20 5 FHBDRN CCOc1cc(CN(C)c2nccc(C)c2[N+](=O)[O-])ccc1OC(F)F ZINC000523755289 947572305 /nfs/dbraw/zinc/57/23/05/947572305.db2.gz JVQBBKYAPJCIKN-UHFFFAOYSA-N 0 0 367.352 3.935 20 5 FHBDRN O=C(Nc1ccc2c(c1)nc1n2CCCCC1)c1ccc([N+](=O)[O-])s1 ZINC000014910489 947572661 /nfs/dbraw/zinc/57/26/61/947572661.db2.gz YTCXMZUTVDPVNS-UHFFFAOYSA-N 0 0 356.407 3.985 20 5 FHBDRN Cc1cc(S(=O)(=O)N(C)[C@@H]2CCCc3ccccc32)ccc1[N+](=O)[O-] ZINC000523757615 947574660 /nfs/dbraw/zinc/57/46/60/947574660.db2.gz RTEVSSMRTRWQBU-GOSISDBHSA-N 0 0 360.435 3.601 20 5 FHBDRN O=C(COC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1)C1CCCCC1 ZINC000021441458 947576370 /nfs/dbraw/zinc/57/63/70/947576370.db2.gz CDKGNLVGMLRQLE-UHFFFAOYSA-N 0 0 360.410 3.501 20 5 FHBDRN Cc1cnc(NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c(Br)c1 ZINC000162881824 947579036 /nfs/dbraw/zinc/57/90/36/947579036.db2.gz COTDKGSLZBQHTO-UHFFFAOYSA-N 0 0 370.590 3.966 20 5 FHBDRN O=C(NCC1(Sc2ccccc2)CCCC1)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC000445193545 947583846 /nfs/dbraw/zinc/58/38/46/947583846.db2.gz ZVSILBYYKQWOPY-UHFFFAOYSA-N 0 0 373.434 3.530 20 5 FHBDRN C[C@@H](Nc1ccc(C(N)=O)cc1[N+](=O)[O-])c1ccc(Br)cc1 ZINC000008054479 947599481 /nfs/dbraw/zinc/59/94/81/947599481.db2.gz VPGDQXXHRYZKIJ-SECBINFHSA-N 0 0 364.199 3.629 20 5 FHBDRN Cc1ccc([C@@H]2CCCCN2S(=O)(=O)Cc2ccccc2[N+](=O)[O-])o1 ZINC000184572045 947611858 /nfs/dbraw/zinc/61/18/58/947611858.db2.gz RESYDYDEMVDJTM-INIZCTEOSA-N 0 0 364.423 3.553 20 5 FHBDRN Cc1ccc(-n2nnnc2SCc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000523792058 947616362 /nfs/dbraw/zinc/61/63/62/947616362.db2.gz ARMASQLESGZMGT-UHFFFAOYSA-N 0 0 361.814 3.825 20 5 FHBDRN CCO[C@@H](CNC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)c1ccccc1 ZINC000445215841 947616456 /nfs/dbraw/zinc/61/64/56/947616456.db2.gz DERVFIZDBYKJJP-KRWDZBQOSA-N 0 0 353.378 3.584 20 5 FHBDRN O=C(Nc1nc(-c2ccc(O)cc2)cs1)c1ccc(F)cc1[N+](=O)[O-] ZINC000136910040 947616438 /nfs/dbraw/zinc/61/64/38/947616438.db2.gz IHSCGUFWSWQIQT-UHFFFAOYSA-N 0 0 359.338 3.815 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1F)N1CCn2c(cc3c2cccc3Cl)C1 ZINC000785332449 947616547 /nfs/dbraw/zinc/61/65/47/947616547.db2.gz SHBNSLMVUKGZRU-UHFFFAOYSA-N 0 0 373.771 3.998 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CN1C[C@@H](c2ccccc2C)OC[C@@H]1C ZINC000441463596 947634291 /nfs/dbraw/zinc/63/42/91/947634291.db2.gz KTHYWUQMYJAGJJ-YWZLYKJASA-N 0 0 356.422 3.874 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1C(=O)OCC(=O)Nc1ccc(C(C)C)cc1 ZINC000026113259 947651015 /nfs/dbraw/zinc/65/10/15/947651015.db2.gz LGIWBIRBPCNXAQ-UHFFFAOYSA-N 0 0 356.378 3.822 20 5 FHBDRN Cc1ccc(NC(=O)COC(=O)c2c(C)cccc2[N+](=O)[O-])cc1Cl ZINC000026113391 947651128 /nfs/dbraw/zinc/65/11/28/947651128.db2.gz GIOWSAMIOXURTE-UHFFFAOYSA-N 0 0 362.769 3.661 20 5 FHBDRN CC(C)C[C@H]1COCCN1C(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000074951440 947662647 /nfs/dbraw/zinc/66/26/47/947662647.db2.gz CMRJSWVMHCVQNE-LBPRGKRZSA-N 0 0 360.332 3.501 20 5 FHBDRN CC(C)(C(=O)Nc1cccc(CCC(F)(F)F)c1)n1cc([N+](=O)[O-])cn1 ZINC000440707166 947682811 /nfs/dbraw/zinc/68/28/11/947682811.db2.gz XGCVGFQKULHKOE-UHFFFAOYSA-N 0 0 370.331 3.660 20 5 FHBDRN Cc1[nH]c2ccccc2c1C(=O)COC(=O)c1c(C)cccc1[N+](=O)[O-] ZINC000026115096 947683818 /nfs/dbraw/zinc/68/38/18/947683818.db2.gz BTLDJJMJGUPJQP-UHFFFAOYSA-N 0 0 352.346 3.733 20 5 FHBDRN Cc1cc(C)cc(OCC(=O)O[C@@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)c1 ZINC000759936057 947691851 /nfs/dbraw/zinc/69/18/51/947691851.db2.gz DRSOCCYDPZQCID-DLBZAZTESA-N 0 0 373.409 3.514 20 5 FHBDRN Cn1c(C(=O)N(CCc2ccc(Cl)cc2)CC2CC2)ccc1[N+](=O)[O-] ZINC000523891151 947694575 /nfs/dbraw/zinc/69/45/75/947694575.db2.gz KWHGTBFFBHPPDB-UHFFFAOYSA-N 0 0 361.829 3.682 20 5 FHBDRN CCCc1ncc(C(=O)O[C@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)s1 ZINC000759936164 947698048 /nfs/dbraw/zinc/69/80/48/947698048.db2.gz SYONHIMOQCQXAK-RYUDHWBXSA-N 0 0 364.427 3.541 20 5 FHBDRN CC(C)COc1cccc(CNC(=O)NCCc2ccc([N+](=O)[O-])cc2)c1 ZINC000523876670 947700733 /nfs/dbraw/zinc/70/07/33/947700733.db2.gz OSDOFDVYLVFOBD-UHFFFAOYSA-N 0 0 371.437 3.672 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H]1[C@@H]2c3ccccc3C[C@H]12 ZINC000248392402 947702445 /nfs/dbraw/zinc/70/24/45/947702445.db2.gz KPBHZRNGCRWQME-NMSZZDKCSA-N 0 0 364.445 3.866 20 5 FHBDRN Cc1cccc(NC(=O)Cc2noc(/C=C\c3ccccc3[N+](=O)[O-])n2)c1 ZINC000445324287 947728098 /nfs/dbraw/zinc/72/80/98/947728098.db2.gz UNUDOLBCLYSEAV-KTKRTIGZSA-N 0 0 364.361 3.638 20 5 FHBDRN CC(C)c1ccc(CCCNS(=O)(=O)c2ccc([N+](=O)[O-])s2)cc1 ZINC000523940027 947747201 /nfs/dbraw/zinc/74/72/01/947747201.db2.gz QHHJSIPLJZYFHT-UHFFFAOYSA-N 0 0 368.480 3.691 20 5 FHBDRN C[C@H](c1ccccc1)c1ccc(OC(=O)CCn2cc([N+](=O)[O-])cn2)cc1 ZINC000728853146 947755388 /nfs/dbraw/zinc/75/53/88/947755388.db2.gz XTNJSRAUEVPQBI-OAHLLOKOSA-N 0 0 365.389 3.939 20 5 FHBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(NC[C@@H]2CCCc3ccccc32)s1 ZINC000129117915 947775359 /nfs/dbraw/zinc/77/53/59/947775359.db2.gz BYNNGIVLZDWJRR-LBPRGKRZSA-N 0 0 366.464 3.592 20 5 FHBDRN COc1cc(NC2CCN(c3cccs3)CC2)c([N+](=O)[O-])cc1F ZINC000129024110 947792957 /nfs/dbraw/zinc/79/29/57/947792957.db2.gz BMCDHUNDQXQUJN-UHFFFAOYSA-N 0 0 351.403 3.885 20 5 FHBDRN O=C(NC[C@@H]1CCOC2(CCC2)C1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000459005116 947793219 /nfs/dbraw/zinc/79/32/19/947793219.db2.gz JVLMLWKTKKWSHM-OAHLLOKOSA-N 0 0 373.453 3.618 20 5 FHBDRN COc1ccc([C@H]2CCN(C(=O)Nc3ccc([N+](=O)[O-])c(C)c3)C2)cc1 ZINC000184601163 947803551 /nfs/dbraw/zinc/80/35/51/947803551.db2.gz AWJBXUUMCFPNGT-HNNXBMFYSA-N 0 0 355.394 3.933 20 5 FHBDRN Cc1cc(NC(=O)NCc2ncc(-c3ccccc3)cn2)ccc1[N+](=O)[O-] ZINC000184602383 947808431 /nfs/dbraw/zinc/80/84/31/947808431.db2.gz ZCSJONIGXAQICZ-UHFFFAOYSA-N 0 0 363.377 3.682 20 5 FHBDRN O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)c1ccc([N+](=O)[O-])[nH]1 ZINC000487388978 947811723 /nfs/dbraw/zinc/81/17/23/947811723.db2.gz SADQPDRLCPENEX-UHFFFAOYSA-N 0 0 364.333 3.501 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)NC[C@H](Nc2ccccc2)C(C)C)c1 ZINC000549599936 947817434 /nfs/dbraw/zinc/81/74/34/947817434.db2.gz SJFWICFQLROQDW-SFHVURJKSA-N 0 0 371.437 3.860 20 5 FHBDRN CO[C@](C)(CNC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000459018312 947850262 /nfs/dbraw/zinc/85/02/62/947850262.db2.gz LLLRPBAJBGJNPR-HXUWFJFHSA-N 0 0 371.437 3.691 20 5 FHBDRN CCCN(C(=O)[C@@H]1COc2ccc(OC)cc2C1)c1cccc([N+](=O)[O-])c1 ZINC000441479863 947892238 /nfs/dbraw/zinc/89/22/38/947892238.db2.gz WTBCSZASHIFFMA-HNNXBMFYSA-N 0 0 370.405 3.598 20 5 FHBDRN C[C@@H](NC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)c1ccccn1 ZINC000184621972 947924021 /nfs/dbraw/zinc/92/40/21/947924021.db2.gz LKWHHMGSOYGVFX-SECBINFHSA-N 0 0 354.288 3.891 20 5 FHBDRN O=C(NC[C@H]1CCCC1(F)F)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000459030619 947924199 /nfs/dbraw/zinc/92/41/99/947924199.db2.gz PULJYIYWTXMWPB-CYBMUJFWSA-N 0 0 353.369 3.704 20 5 FHBDRN CC[C@@H]1CCC[C@H](NC(=O)c2ccc(Cn3cc([N+](=O)[O-])cn3)cc2)C1 ZINC001126275038 947976291 /nfs/dbraw/zinc/97/62/91/947976291.db2.gz GNCWFFNJOKBEJK-PBHICJAKSA-N 0 0 356.426 3.538 20 5 FHBDRN O=[N+]([O-])c1ccc2cnn(CN3CCC(OCc4ccccc4)CC3)c2c1 ZINC000105324966 948004530 /nfs/dbraw/zinc/00/45/30/948004530.db2.gz HCIMTBFEAKZCRC-UHFFFAOYSA-N 0 0 366.421 3.583 20 5 FHBDRN COc1cccc(Br)c1OC(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000150834285 948013220 /nfs/dbraw/zinc/01/32/20/948013220.db2.gz XECLSCDIQGPCOV-UHFFFAOYSA-N 0 0 366.167 3.514 20 5 FHBDRN Cc1c(OC(=O)CCc2cnn(-c3ccccc3)c2)cccc1[N+](=O)[O-] ZINC000051705160 948017065 /nfs/dbraw/zinc/01/70/65/948017065.db2.gz LQPLNECOJWTTDK-UHFFFAOYSA-N 0 0 351.362 3.627 20 5 FHBDRN CC(C)c1ccc(CN2CCc3nc[nH]c3C23CCOCC3)cc1[N+](=O)[O-] ZINC000895070654 948019356 /nfs/dbraw/zinc/01/93/56/948019356.db2.gz HPLVJZCUNOSSDY-UHFFFAOYSA-N 0 0 370.453 3.505 20 5 FHBDRN COCCOc1cccc(CNc2ccnc3c2cccc3[N+](=O)[O-])c1 ZINC000432321368 948027200 /nfs/dbraw/zinc/02/72/00/948027200.db2.gz FULWKINCHDIXDR-UHFFFAOYSA-N 0 0 353.378 3.780 20 5 FHBDRN Cc1ccccc1-c1noc([C@@H](C)Oc2ccc([N+](=O)[O-])cc2C=O)n1 ZINC000072919544 948039991 /nfs/dbraw/zinc/03/99/91/948039991.db2.gz SVMRFLRQCYCWMS-GFCCVEGCSA-N 0 0 353.334 3.906 20 5 FHBDRN O=C1C[C@@H](CNc2c(Cl)cccc2[N+](=O)[O-])CN1Cc1ccccc1 ZINC000432325775 948062456 /nfs/dbraw/zinc/06/24/56/948062456.db2.gz NBLKYQXWHWZFDU-AWEZNQCLSA-N 0 0 359.813 3.709 20 5 FHBDRN COCCOc1ccccc1CNc1ccnc2c1cccc2[N+](=O)[O-] ZINC000432325441 948066239 /nfs/dbraw/zinc/06/62/39/948066239.db2.gz KMRHEKXKUCKVSZ-UHFFFAOYSA-N 0 0 353.378 3.780 20 5 FHBDRN CCOc1cccc(C(=O)O[C@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)c1 ZINC000759945473 948071739 /nfs/dbraw/zinc/07/17/39/948071739.db2.gz GOSOXCCPSCJKBE-CVEARBPZSA-N 0 0 359.382 3.531 20 5 FHBDRN C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCc2ccc(Cl)cc2C1 ZINC000536428095 948074836 /nfs/dbraw/zinc/07/48/36/948074836.db2.gz YMSLCTRNESHPQM-GFCCVEGCSA-N 0 0 359.813 3.634 20 5 FHBDRN CCC[C@@H](C)NC(=O)[C@H]1CCCN(c2ccnc3c2cccc3[N+](=O)[O-])C1 ZINC000432330668 948092478 /nfs/dbraw/zinc/09/24/78/948092478.db2.gz DJGPRBJAKCMNFX-CABCVRRESA-N 0 0 370.453 3.664 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(N2CCCC2)nc1 ZINC000184661080 948094708 /nfs/dbraw/zinc/09/47/08/948094708.db2.gz RMOXXTQINSVMMB-MRXNPFEDSA-N 0 0 368.437 3.797 20 5 FHBDRN CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1CCC(Cc2ccccc2)CC1 ZINC000008071993 948101879 /nfs/dbraw/zinc/10/18/79/948101879.db2.gz DLCCEGKAVBYGNZ-UHFFFAOYSA-N 0 0 367.449 3.756 20 5 FHBDRN O=[N+]([O-])c1cccc2c(N3CCC(Oc4ccccn4)CC3)ccnc21 ZINC000432330886 948116541 /nfs/dbraw/zinc/11/65/41/948116541.db2.gz GVKJZXVZIOZZQH-UHFFFAOYSA-N 0 0 350.378 3.586 20 5 FHBDRN CC[C@H](NC(=O)COc1ccc([N+](=O)[O-])c(F)c1)c1ccc(F)cc1F ZINC000125901367 948123959 /nfs/dbraw/zinc/12/39/59/948123959.db2.gz ZRTYXFJRJNEFKZ-HNNXBMFYSA-N 0 0 368.311 3.658 20 5 FHBDRN CSc1ccc(C(=O)O[C@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)cc1 ZINC000759946937 948135960 /nfs/dbraw/zinc/13/59/60/948135960.db2.gz JTEUPGBHMIMYJG-CABCVRRESA-N 0 0 361.423 3.854 20 5 FHBDRN CCSCc1ccnc(NC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)c1 ZINC000536435274 948142390 /nfs/dbraw/zinc/14/23/90/948142390.db2.gz AKCQSNIUNLGIEX-UHFFFAOYSA-N 0 0 370.434 3.836 20 5 FHBDRN Cc1cccc(C)c1NC(=O)CNc1ccnc2c1cccc2[N+](=O)[O-] ZINC000432337161 948148036 /nfs/dbraw/zinc/14/80/36/948148036.db2.gz SCPLVOOZCKLWPS-UHFFFAOYSA-N 0 0 350.378 3.810 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N(C)Cc1ccc(F)c(Cl)c1 ZINC000432340183 948159722 /nfs/dbraw/zinc/15/97/22/948159722.db2.gz LSMHXIBLGLOEDI-UHFFFAOYSA-N 0 0 372.805 3.516 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@H](C)Cn1ccc2ccccc21 ZINC000507771207 948162720 /nfs/dbraw/zinc/16/27/20/948162720.db2.gz ZGZMYCNVDYLUTI-CQSZACIVSA-N 0 0 367.405 3.511 20 5 FHBDRN CCOc1ccccc1OCCCC(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000019159524 948164636 /nfs/dbraw/zinc/16/46/36/948164636.db2.gz AIMSPPXYYQNMFQ-UHFFFAOYSA-N 0 0 374.393 3.800 20 5 FHBDRN CSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H](C)Oc1cccc(C)c1 ZINC001126298464 948206822 /nfs/dbraw/zinc/20/68/22/948206822.db2.gz NNLBJXMEBXXWGY-CYBMUJFWSA-N 0 0 360.435 3.822 20 5 FHBDRN COC(=O)c1cc(C)nc(N[C@H]2CCC[C@@H](C(F)(F)F)C2)c1[N+](=O)[O-] ZINC000585702613 948208967 /nfs/dbraw/zinc/20/89/67/948208967.db2.gz SPBYYFBIKVDZAL-ZJUUUORDSA-N 0 0 361.320 3.618 20 5 FHBDRN O=C(/C=C\c1cccc(F)c1)O[C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1 ZINC000759949037 948210255 /nfs/dbraw/zinc/21/02/55/948210255.db2.gz NLBSLBQIJJVCJC-LWULTOEVSA-N 0 0 359.357 3.671 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ZINC000520542554 948258955 /nfs/dbraw/zinc/25/89/55/948258955.db2.gz HZDSRGNJRJUWRM-QGZVFWFLSA-N 0 0 371.412 3.770 20 5 FHBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N[C@@H]2CCCC[C@@H]2c2ccccc2)cc1 ZINC000512039336 948268385 /nfs/dbraw/zinc/26/83/85/948268385.db2.gz WZPYYJCNJODANQ-QZTJIDSGSA-N 0 0 360.435 3.600 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCCC[C@@H]1c1ncc[nH]1 ZINC000184717372 948268763 /nfs/dbraw/zinc/26/87/63/948268763.db2.gz DZAWUCUYUFCDDU-NVXWUHKLSA-N 0 0 356.426 3.640 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)N2CCC3(CCOCC3)CC2)cc1[N+](=O)[O-] ZINC000585763597 948273632 /nfs/dbraw/zinc/27/36/32/948273632.db2.gz ZSQQYBBZAAGQCQ-UHFFFAOYSA-N 0 0 360.454 3.925 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1OCc1nc(-c2ccc(F)c(F)c2)no1 ZINC000134122428 948275005 /nfs/dbraw/zinc/27/50/05/948275005.db2.gz CZHOKFFERFNAIW-UHFFFAOYSA-N 0 0 363.276 3.511 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N([C@@H](C)[C@H](C)CC)C1CC1 ZINC000520555824 948276453 /nfs/dbraw/zinc/27/64/53/948276453.db2.gz 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FHBDRN CC(C)c1[nH]nc(C(=O)Nc2cc(-c3ccco3)nn2C(C)C)c1[N+](=O)[O-] ZINC000279125546 948530715 /nfs/dbraw/zinc/53/07/15/948530715.db2.gz VFAAKLALSZIQOJ-UHFFFAOYSA-N 0 0 372.385 3.731 20 5 FHBDRN Cc1c(C(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)nnn1CC1CCCC1 ZINC000279133088 948539383 /nfs/dbraw/zinc/53/93/83/948539383.db2.gz YZESGGHZXXRPET-UHFFFAOYSA-N 0 0 357.414 3.554 20 5 FHBDRN CCOc1ccc(CN(C)Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)cc1 ZINC000728895715 948545163 /nfs/dbraw/zinc/54/51/63/948545163.db2.gz FPTOVGKDHYKKKQ-UHFFFAOYSA-N 0 0 366.421 3.947 20 5 FHBDRN COC(=O)[C@H](C)N(Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C1CCC1 ZINC000571027869 948545692 /nfs/dbraw/zinc/54/56/92/948545692.db2.gz SSYKFZJEPXUOSC-JTQLQIEISA-N 0 0 360.332 3.530 20 5 FHBDRN C[C@H]1OCCN(c2c3cc(Br)ccc3ncc2[N+](=O)[O-])[C@@H]1C ZINC000408344389 948554506 /nfs/dbraw/zinc/55/45/06/948554506.db2.gz XGPYOLVDJAMSTJ-NXEZZACHSA-N 0 0 366.215 3.519 20 5 FHBDRN O=[N+]([O-])c1ccc(N[C@@H]2CCOC3(CCOCC3)C2)cc1C(F)(F)F ZINC000550431236 948560747 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FHBDRN CC(C)CCOC1CCN(Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)CC1 ZINC000728897371 948617190 /nfs/dbraw/zinc/61/71/90/948617190.db2.gz PWQKLDHXWODCRF-UHFFFAOYSA-N 0 0 372.469 3.943 20 5 FHBDRN COc1ccc(CC[C@@H](C)NC(=O)c2c(C)c(F)ccc2[N+](=O)[O-])cc1 ZINC000843776669 948620404 /nfs/dbraw/zinc/62/04/04/948620404.db2.gz UXPWCMNVZZVCDF-GFCCVEGCSA-N 0 0 360.385 3.802 20 5 FHBDRN CC[C@@H](C)[C@@H](C(=O)OCC(=O)Nc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000005682616 948628822 /nfs/dbraw/zinc/62/88/22/948628822.db2.gz CQOMHHGHOHPMCE-AUUYWEPGSA-N 0 0 370.405 3.906 20 5 FHBDRN Cc1cc(C)cc([C@@H](C)NS(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])c1 ZINC000500449838 948637463 /nfs/dbraw/zinc/63/74/63/948637463.db2.gz CLNLDTIXPZXIQW-GFCCVEGCSA-N 0 0 368.842 3.905 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H]1CCOC(C)(C)C1 ZINC000459135740 948664926 /nfs/dbraw/zinc/66/49/26/948664926.db2.gz LCFHMKHIBONGBV-INIZCTEOSA-N 0 0 363.458 3.720 20 5 FHBDRN COC(=O)CCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(C)cc1 ZINC000536466552 948685776 /nfs/dbraw/zinc/68/57/76/948685776.db2.gz GCCVGCBMANVZOC-UHFFFAOYSA-N 0 0 374.418 3.811 20 5 FHBDRN COc1ccc(-c2nnc(SCCOc3ccc([N+](=O)[O-])cc3)o2)cc1 ZINC000067006490 948688595 /nfs/dbraw/zinc/68/85/95/948688595.db2.gz SMRGQCYUSRMJPV-UHFFFAOYSA-N 0 0 373.390 3.825 20 5 FHBDRN Cc1ccc(C[C@H]2CCCN(C(=O)c3cc([N+](=O)[O-])cnc3C)C2)cc1 ZINC000050768752 948699283 /nfs/dbraw/zinc/69/92/83/948699283.db2.gz HVECHAJGYKZHFQ-QGZVFWFLSA-N 0 0 353.422 3.702 20 5 FHBDRN O=c1oc2ccc([N+](=O)[O-])cc2n1Cc1ncc(-c2ccccc2Cl)o1 ZINC000150873356 948730455 /nfs/dbraw/zinc/73/04/55/948730455.db2.gz YQVPLUWLMCJVRF-UHFFFAOYSA-N 0 0 371.736 3.859 20 5 FHBDRN O=C(NCCNc1ccc([N+](=O)[O-])cc1)c1ccc2nc(Cl)ccc2c1 ZINC000107666113 948732528 /nfs/dbraw/zinc/73/25/28/948732528.db2.gz UYPLWMCCHMVVIM-UHFFFAOYSA-N 0 0 370.796 3.638 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)Oc2ccc3c(c2)OC(=O)C[C@@H]3C)c1 ZINC000785378950 948753972 /nfs/dbraw/zinc/75/39/72/948753972.db2.gz DJZWEHZJIBGEAO-JTQLQIEISA-N 0 0 373.386 3.949 20 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/nfs/dbraw/zinc/78/09/15/948780915.db2.gz POHMWQYTUHVAKM-UHFFFAOYSA-N 0 0 372.446 3.997 20 5 FHBDRN C[C@H]1COc2ccccc2CN1C(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000542039009 948781634 /nfs/dbraw/zinc/78/16/34/948781634.db2.gz NHKKIKUGYQPYHU-ZDUSSCGKSA-N 0 0 363.373 3.566 20 5 FHBDRN Cc1cccc(C)c1NC(=O)[C@H](C)OC(=O)c1c(C)cccc1[N+](=O)[O-] ZINC000026122045 948785581 /nfs/dbraw/zinc/78/55/81/948785581.db2.gz CEODBFOGDMTUDE-AWEZNQCLSA-N 0 0 356.378 3.704 20 5 FHBDRN O=C(COc1ccccc1[N+](=O)[O-])NC1(c2ccc(F)cc2)CCCC1 ZINC000141631043 948794038 /nfs/dbraw/zinc/79/40/38/948794038.db2.gz VATROYBXKDRZBS-UHFFFAOYSA-N 0 0 358.369 3.698 20 5 FHBDRN Cc1cnc(N[C@@H]2CCCN([C@H](C)c3ccc(F)cc3)C2=O)c([N+](=O)[O-])c1 ZINC000549645215 948795669 /nfs/dbraw/zinc/79/56/69/948795669.db2.gz NCXZFBQUBHORIZ-CZUORRHYSA-N 0 0 372.400 3.601 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NCCc1cccc2ccccc21 ZINC000520739167 948817842 /nfs/dbraw/zinc/81/78/42/948817842.db2.gz BGBWQJPDWIKSAP-UHFFFAOYSA-N 0 0 370.430 3.577 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCC(=O)Nc2ccc(C(F)(F)F)cc2)c1 ZINC000021614255 948818030 /nfs/dbraw/zinc/81/80/30/948818030.db2.gz ZGVQZJVJKFTGBW-UHFFFAOYSA-N 0 0 354.284 3.940 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N(C)Cc1cnc(C(C)C)nc1 ZINC000441765907 948819422 /nfs/dbraw/zinc/81/94/22/948819422.db2.gz MIZGCTXRRRJSKV-UHFFFAOYSA-N 0 0 373.413 3.571 20 5 FHBDRN O=C(COc1ccc(Br)cc1F)Nc1cccc([N+](=O)[O-])c1 ZINC000007200730 219795006 /nfs/dbraw/zinc/79/50/06/219795006.db2.gz ACRUOIMWGZZAQC-UHFFFAOYSA-N 0 0 369.146 3.514 20 5 FHBDRN O=C(Nc1ccc(F)cc1F)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000007968376 219835356 /nfs/dbraw/zinc/83/53/56/219835356.db2.gz OMSOBYZCQPAITK-UHFFFAOYSA-N 0 0 357.110 3.888 20 5 FHBDRN CC(C)c1cccc(NC(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])c1 ZINC000014597646 220127584 /nfs/dbraw/zinc/12/75/84/220127584.db2.gz GTOOMZTUDUTGJU-UHFFFAOYSA-N 0 0 373.434 3.548 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CNc1cc(Cl)ccc1Cl ZINC000015086174 220148312 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O=C(Nc1cccc([N+](=O)[O-])c1)C1(c2cccc(Cl)c2)CCOCC1 ZINC000052979323 221042071 /nfs/dbraw/zinc/04/20/71/221042071.db2.gz HFPIEIBUAUXAMI-UHFFFAOYSA-N 0 0 360.797 3.935 20 5 FHBDRN Cn1cc(C(=O)Nc2ccc3c(c2)CCC3)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000052953289 221042091 /nfs/dbraw/zinc/04/20/91/221042091.db2.gz LGJAZZIAFCSRHP-UHFFFAOYSA-N 0 0 362.389 3.736 20 5 FHBDRN CC(C)[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1F)c1ccc2c(c1)OCCO2 ZINC000054513870 221054333 /nfs/dbraw/zinc/05/43/33/221054333.db2.gz GTYBYNIZIVNJNV-GOSISDBHSA-N 0 0 374.368 3.632 20 5 FHBDRN Cc1ccc(C)c(OC2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000055708840 221074065 /nfs/dbraw/zinc/07/40/65/221074065.db2.gz BWTIGPDAIXWRHM-UHFFFAOYSA-N 0 0 354.406 3.895 20 5 FHBDRN COc1ccc(Cl)c(NS(=O)(=O)c2cc([N+](=O)[O-])cc(C)c2C)c1 ZINC000064374579 221146641 /nfs/dbraw/zinc/14/66/41/221146641.db2.gz AXGIYPRZTKZMEY-UHFFFAOYSA-N 0 0 370.814 3.674 20 5 FHBDRN CCOc1cc(NC(=O)c2cnc(CC)s2)c([N+](=O)[O-])cc1OCC ZINC000065051949 221166229 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O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1cccc(O)c1 ZINC000096965296 222146952 /nfs/dbraw/zinc/14/69/52/222146952.db2.gz LHTQHAYWSJWTER-UHFFFAOYSA-N 0 0 369.299 3.760 20 5 FHBDRN NC(=O)c1ccc(CSc2cccc(Br)c2)c([N+](=O)[O-])c1 ZINC000097529682 222188667 /nfs/dbraw/zinc/18/86/67/222188667.db2.gz KLXVZGZFWBYIGC-UHFFFAOYSA-N 0 0 367.224 3.749 20 5 FHBDRN CCOc1cc(C(=O)N2CCC[C@@H]3CCCC[C@@H]32)c([N+](=O)[O-])cc1OC ZINC000104952164 222363514 /nfs/dbraw/zinc/36/35/14/222363514.db2.gz RWSJOAANQDQMIQ-ZFWWWQNUSA-N 0 0 362.426 3.797 20 5 FHBDRN COCCOCCCNc1cc(Cl)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000105135139 222364956 /nfs/dbraw/zinc/36/49/56/222364956.db2.gz LVJQQDYPKSRZKY-UHFFFAOYSA-N 0 0 356.728 3.732 20 5 FHBDRN COC(=O)c1c(CC(C)C)csc1NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000105446838 222369833 /nfs/dbraw/zinc/36/98/33/222369833.db2.gz UBMGUPOTUGDDNT-UHFFFAOYSA-N 0 0 362.407 3.894 20 5 FHBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccc2n[nH]cc2c1 ZINC000105604384 222371875 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O=C(NCc1cc(Br)cs1)Nc1ccc([N+](=O)[O-])cc1F ZINC000541786528 567833830 /nfs/dbraw/zinc/83/38/30/567833830.db2.gz VPKBYFMAPBUBNU-UHFFFAOYSA-N 0 0 374.191 3.880 20 5 FHBDRN O=C(c1ccc2nsnc2c1)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452863660 567834446 /nfs/dbraw/zinc/83/44/46/567834446.db2.gz VRGBRCVOSWBPFN-CQSZACIVSA-N 0 0 368.418 3.619 20 5 FHBDRN C[C@@H](Oc1ccccc1F)C(=O)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452866910 567835533 /nfs/dbraw/zinc/83/55/33/567835533.db2.gz HACPXLMPIYRWBR-ZBFHGGJFSA-N 0 0 372.396 3.907 20 5 FHBDRN COCCC1(C(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)CCCC1 ZINC000452864327 567838962 /nfs/dbraw/zinc/83/89/62/567838962.db2.gz WBNWXXAPAWZKPK-QGZVFWFLSA-N 0 0 360.454 3.898 20 5 FHBDRN CO[C@@H]1CCN(C(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1(C)C ZINC000452876442 567864467 /nfs/dbraw/zinc/86/44/67/567864467.db2.gz WDZFXEXVNQELJN-CYBMUJFWSA-N 0 0 360.332 3.501 20 5 FHBDRN C[C@@H](Oc1ccccc1)C(=O)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452872841 567873555 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368.433 3.942 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H]1c2ccc(F)cc2O[C@H]1C ZINC000517910420 567909064 /nfs/dbraw/zinc/90/90/64/567909064.db2.gz FTRBLLZEOYAKPC-DYZYQPBXSA-N 0 0 359.357 3.940 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)c1cc(C)sc1Br ZINC000471103624 567925476 /nfs/dbraw/zinc/92/54/76/567925476.db2.gz ISCDOAZHJXYHEA-UHFFFAOYSA-N 0 0 371.212 3.988 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@H]1CC[C@@H](c2ccccc2)O1 ZINC000568144590 567939093 /nfs/dbraw/zinc/93/90/93/567939093.db2.gz QTDCVNODRHICRC-AEFFLSMTSA-N 0 0 355.394 3.945 20 5 FHBDRN COc1cc(C(=O)N2CC3(CCC3)c3ccccc32)cc([N+](=O)[O-])c1OC ZINC000481442338 567941445 /nfs/dbraw/zinc/94/14/45/567941445.db2.gz WJQDBGQWRRRSCV-UHFFFAOYSA-N 0 0 368.389 3.694 20 5 FHBDRN O=[N+]([O-])c1ccc(SC[C@@H](O)COc2cccc(C(F)(F)F)c2)nc1 ZINC000159196710 567947045 /nfs/dbraw/zinc/94/70/45/567947045.db2.gz YBXXVXVCEBZXAV-LBPRGKRZSA-N 0 0 374.340 3.541 20 5 FHBDRN CC(C)(CCc1noc(C[C@H](O)c2cc(Cl)cc(Cl)c2)n1)[N+](=O)[O-] ZINC000291014068 567957708 /nfs/dbraw/zinc/95/77/08/567957708.db2.gz BOGMFZJMHUQALE-LBPRGKRZSA-N 0 0 374.224 3.640 20 5 FHBDRN Cc1cc(C)cc(OC[C@H](O)Cn2ccnc2-c2ccc([N+](=O)[O-])cc2)c1 ZINC000051451926 567958621 /nfs/dbraw/zinc/95/86/21/567958621.db2.gz VGUOXCOUFBAROZ-GOSISDBHSA-N 0 0 367.405 3.515 20 5 FHBDRN C[C@H](NCc1ccc([N+](=O)[O-])cc1F)c1ccc(N2CCCNC2=O)cc1 ZINC000291020978 567965388 /nfs/dbraw/zinc/96/53/88/567965388.db2.gz CPTJLHAHBDTAPY-ZDUSSCGKSA-N 0 0 372.400 3.504 20 5 FHBDRN Cc1c(CNC(=O)c2cccc(-c3cscn3)c2)cccc1[N+](=O)[O-] ZINC000481466284 567967777 /nfs/dbraw/zinc/96/77/77/567967777.db2.gz MUJMRCSHSOLVJL-UHFFFAOYSA-N 0 0 353.403 3.957 20 5 FHBDRN Cc1cc([C@@H]2CCCN2C(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)on1 ZINC000481485944 567992210 /nfs/dbraw/zinc/99/22/10/567992210.db2.gz ZBQZUPLQUYUPIE-WFASDCNBSA-N 0 0 361.423 3.736 20 5 FHBDRN CCCc1ccc(C(=O)CCc2nc(CCC(C)(C)[N+](=O)[O-])no2)cc1 ZINC000291047972 567996504 /nfs/dbraw/zinc/99/65/04/567996504.db2.gz HTDWTOMMQXWYPC-UHFFFAOYSA-N 0 0 359.426 3.826 20 5 FHBDRN Cc1c(CNC(=O)c2cccn2Cc2cccs2)cccc1[N+](=O)[O-] ZINC000481498630 567997052 /nfs/dbraw/zinc/99/70/52/567997052.db2.gz ZOPAYEACPZFWCD-UHFFFAOYSA-N 0 0 355.419 3.745 20 5 FHBDRN CC(C)(CCc1noc(Cc2csc(-c3cccs3)n2)n1)[N+](=O)[O-] ZINC000291065151 567999919 /nfs/dbraw/zinc/99/99/19/567999919.db2.gz KPEFVHAMIXKOJV-UHFFFAOYSA-N 0 0 364.452 3.833 20 5 FHBDRN CC(=O)c1cccc(C(=O)Nc2cc(C)nn2-c2ccc([N+](=O)[O-])cc2)c1 ZINC000481531038 568010741 /nfs/dbraw/zinc/01/07/41/568010741.db2.gz QZQHUHNZUTXFKF-UHFFFAOYSA-N 0 0 364.361 3.544 20 5 FHBDRN CC[C@@H]([NH2+]Cc1ccc(CN2CCCC2=O)cc1)c1cccc([N+](=O)[O-])c1 ZINC000128565075 568016854 /nfs/dbraw/zinc/01/68/54/568016854.db2.gz WIRRAEWIKUVZES-HXUWFJFHSA-N 0 0 367.449 3.958 20 5 FHBDRN C[C@](CO)(NCc1csc(C2CCCC2)n1)c1cccc([N+](=O)[O-])c1 ZINC000602965776 568024414 /nfs/dbraw/zinc/02/44/14/568024414.db2.gz NUXKVOZDNXHTFO-GOSISDBHSA-N 0 0 361.467 3.706 20 5 FHBDRN Cc1c(CNC(=O)c2ncsc2-c2ccccc2)cccc1[N+](=O)[O-] ZINC000481504471 568026743 /nfs/dbraw/zinc/02/67/43/568026743.db2.gz WWZUJJNZAMCDCN-UHFFFAOYSA-N 0 0 353.403 3.957 20 5 FHBDRN C[C@H](c1nc(CCc2ccc3c(c2)CCO3)no1)c1cccc([N+](=O)[O-])c1 ZINC000568445873 568038640 /nfs/dbraw/zinc/03/86/40/568038640.db2.gz ZSDZPVISAZHGEC-ZDUSSCGKSA-N 0 0 365.389 3.850 20 5 FHBDRN CC(=O)Nc1cccc([C@@H](C)NC(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000568466268 568040684 /nfs/dbraw/zinc/04/06/84/568040684.db2.gz RALOWVBXAFIRBW-QWHCGFSZSA-N 0 0 355.394 3.534 20 5 FHBDRN C[C@@H]1CSC[C@H]1NC(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000568493982 568044617 /nfs/dbraw/zinc/04/46/17/568044617.db2.gz GVLNMAHWKJBNBE-CXAGYDPISA-N 0 0 372.446 3.655 20 5 FHBDRN CCN(C[C@H]1CCN(c2cc([N+](=O)[O-])ccc2C(C)=O)C1)CC(F)(F)F ZINC000568495663 568044624 /nfs/dbraw/zinc/04/46/24/568044624.db2.gz VAUIDZVSYUZSIC-CYBMUJFWSA-N 0 0 373.375 3.508 20 5 FHBDRN C[C@H]1CSC[C@@H]1NC(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000568493984 568044628 /nfs/dbraw/zinc/04/46/28/568044628.db2.gz GVLNMAHWKJBNBE-GUYCJALGSA-N 0 0 372.446 3.655 20 5 FHBDRN C[C@@H]1[C@@H](C(F)(F)F)CCCN1c1nnc(-c2ccc([N+](=O)[O-])cc2)n1C ZINC000568566545 568048603 /nfs/dbraw/zinc/04/86/03/568048603.db2.gz FRZWPHZKSPTSMY-MFKMUULPSA-N 0 0 369.347 3.558 20 5 FHBDRN C[C@@H]([NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1)c1cccc(N2CCCC2)c1 ZINC000181873141 568049499 /nfs/dbraw/zinc/04/94/99/568049499.db2.gz HVEWWEXITLBLRI-FOIQADDNSA-N 0 0 355.438 3.579 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1N1CC2(CCC2)[C@H]1[C@H]1CCCO1 ZINC000408223957 568051261 /nfs/dbraw/zinc/05/12/61/568051261.db2.gz FUZOOPSLGHXUQB-HUUCEWRRSA-N 0 0 367.243 3.895 20 5 FHBDRN COc1cc(F)c(F)cc1NC(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000568569219 568056491 /nfs/dbraw/zinc/05/64/91/568056491.db2.gz JJEGQVSNZXEKGV-SECBINFHSA-N 0 0 351.309 3.764 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CCc1ccccc1O2 ZINC000568572584 568058394 /nfs/dbraw/zinc/05/83/94/568058394.db2.gz PRJCIPZHOIFAJT-HXUWFJFHSA-N 0 0 352.390 3.513 20 5 FHBDRN Cc1ccc(C(=O)N(C)C)cc1NC(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000481578418 568060466 /nfs/dbraw/zinc/06/04/66/568060466.db2.gz ZHPKKGROLIBBGE-UHFFFAOYSA-N 0 0 367.361 3.604 20 5 FHBDRN CCOc1ccc(/C=C/c2nc(CCC(C)(C)[N+](=O)[O-])no2)cc1OC ZINC000291138215 568063322 /nfs/dbraw/zinc/06/33/22/568063322.db2.gz XKCRBJCLFJASEK-VQHVLOKHSA-N 0 0 361.398 3.635 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)N[C@H]1C[C@H](c2ccc(F)cc2)C1 ZINC000481613795 568071118 /nfs/dbraw/zinc/07/11/18/568071118.db2.gz PVMFPSVABNGXND-CTYIDZIISA-N 0 0 360.410 3.888 20 5 FHBDRN CCNc1ccc(C(=O)NC[C@@H]2CCC3(CCCCC3)O2)cc1[N+](=O)[O-] ZINC000481636422 568075148 /nfs/dbraw/zinc/07/51/48/568075148.db2.gz WRGUSLVOXDZOSD-HNNXBMFYSA-N 0 0 361.442 3.638 20 5 FHBDRN COc1ccc(Br)cc1CNc1nc(C)ccc1[N+](=O)[O-] ZINC000481686154 568089215 /nfs/dbraw/zinc/08/92/15/568089215.db2.gz KGDZAVHWCWWWMB-UHFFFAOYSA-N 0 0 352.188 3.681 20 5 FHBDRN Cc1cc(C)n(-c2ccc(CCNc3nc(C)ccc3[N+](=O)[O-])cc2)n1 ZINC000481688183 568089235 /nfs/dbraw/zinc/08/92/35/568089235.db2.gz BMNMZISAXVCAIQ-UHFFFAOYSA-N 0 0 351.410 3.755 20 5 FHBDRN Cc1c(NC(=O)NCc2cccc(OC(F)F)c2)cccc1[N+](=O)[O-] ZINC000051584468 568090038 /nfs/dbraw/zinc/09/00/38/568090038.db2.gz SIAOYKBVFAHWJM-UHFFFAOYSA-N 0 0 351.309 3.826 20 5 FHBDRN CCOc1cc(CN(C)c2nc(C)ccc2[N+](=O)[O-])ccc1OC(F)F ZINC000481698329 568092074 /nfs/dbraw/zinc/09/20/74/568092074.db2.gz SNZPJNKTNCXCMB-UHFFFAOYSA-N 0 0 367.352 3.935 20 5 FHBDRN O=C(Nc1cc2c(cc1[N+](=O)[O-])OCCCO2)c1ccoc1C(F)(F)F ZINC000291257719 568092857 /nfs/dbraw/zinc/09/28/57/568092857.db2.gz WQIOFAWERVNHBD-UHFFFAOYSA-N 0 0 372.255 3.620 20 5 FHBDRN CCc1noc(-c2ccc(CCNc3nc(C)ccc3[N+](=O)[O-])cc2)n1 ZINC000481714110 568093874 /nfs/dbraw/zinc/09/38/74/568093874.db2.gz TWEYCGRWFPJENC-UHFFFAOYSA-N 0 0 353.382 3.565 20 5 FHBDRN C[C@@H](SC1=N[C@H](C)CS1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000155568520 568094853 /nfs/dbraw/zinc/09/48/53/568094853.db2.gz QPRQXGVJDACXQL-HTQZYQBOSA-N 0 0 359.860 3.800 20 5 FHBDRN CCOc1cc(C)ccc1CNc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 ZINC000128637442 568096711 /nfs/dbraw/zinc/09/67/11/568096711.db2.gz VMFXEUXDWWZQGT-UHFFFAOYSA-N 0 0 355.394 3.799 20 5 FHBDRN CC(=O)c1cc([N+](=O)[O-])ccc1OC[C@@H](O)Cc1ccc2ccccc2c1 ZINC000481729445 568098394 /nfs/dbraw/zinc/09/83/94/568098394.db2.gz XBDUWTUZEPJMET-IBGZPJMESA-N 0 0 365.385 3.933 20 5 FHBDRN CC(C)Oc1nc(N[C@H]2CCO[C@H](c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000568647624 568106902 /nfs/dbraw/zinc/10/69/02/568106902.db2.gz USVGLXQOAIKQFC-RDJZCZTQSA-N 0 0 357.410 3.531 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2nnc(CSc3ccc4c(c3)OCCO4)o2)cc1 ZINC000006916231 568113169 /nfs/dbraw/zinc/11/31/69/568113169.db2.gz ZDMQPKFQMWUNED-UHFFFAOYSA-N 0 0 371.374 3.708 20 5 FHBDRN COCCCCc1cccnc1NC(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000291341510 568117147 /nfs/dbraw/zinc/11/71/47/568117147.db2.gz VYSHPEGPGVQPSD-UHFFFAOYSA-N 0 0 363.801 3.865 20 5 FHBDRN CC(C)(Oc1ccc(F)cc1)c1nc(-c2ccc(N)c([N+](=O)[O-])c2)no1 ZINC000568680636 568120406 /nfs/dbraw/zinc/12/04/06/568120406.db2.gz NASQQPZAEQGELN-UHFFFAOYSA-N 0 0 358.329 3.680 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1Cl)C1(c2ccccc2)CCOCC1 ZINC000291352622 568120989 /nfs/dbraw/zinc/12/09/89/568120989.db2.gz ACCPYDCAETXZBS-UHFFFAOYSA-N 0 0 360.797 3.935 20 5 FHBDRN C[C@@H](CCc1ccccc1)NC(=O)N1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000568692559 568123795 /nfs/dbraw/zinc/12/37/95/568123795.db2.gz YZOFGRADPSIJNC-HNNXBMFYSA-N 0 0 369.421 3.520 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)C1(c2cccc(F)c2)CCOCC1 ZINC000291366432 568126812 /nfs/dbraw/zinc/12/68/12/568126812.db2.gz CGVZZQWPCIOZRX-UHFFFAOYSA-N 0 0 372.396 3.983 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)c1snnc1C1CC1 ZINC000291469396 568140493 /nfs/dbraw/zinc/14/04/93/568140493.db2.gz BYMUROHCKOUORT-UHFFFAOYSA-N 0 0 358.301 3.595 20 5 FHBDRN COc1ccc([C@@H](NC(=O)COc2cc([N+](=O)[O-])ccc2C)C(C)C)cc1 ZINC000603725942 568143204 /nfs/dbraw/zinc/14/32/04/568143204.db2.gz OBRZAKVGUVTFLO-FQEVSTJZSA-N 0 0 372.421 3.804 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ncc(Cl)cc2C)cc1OC ZINC000291455932 568145367 /nfs/dbraw/zinc/14/53/67/568145367.db2.gz MTDISKXLKAWANS-UHFFFAOYSA-N 0 0 365.773 3.611 20 5 FHBDRN CCOc1cc(NC(=O)c2ccc(Cl)cn2)c([N+](=O)[O-])cc1OCC ZINC000128673716 568148902 /nfs/dbraw/zinc/14/89/02/568148902.db2.gz YASSZOLEDLSSMJ-UHFFFAOYSA-N 0 0 365.773 3.693 20 5 FHBDRN COCCCCc1cccnc1NC(=O)c1cc([N+](=O)[O-])cc(C)c1F ZINC000291447201 568163532 /nfs/dbraw/zinc/16/35/32/568163532.db2.gz LKLTXEWLVIXATB-UHFFFAOYSA-N 0 0 361.373 3.659 20 5 FHBDRN O=C(NCc1ccc(C2CC2)cc1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000481864499 568163775 /nfs/dbraw/zinc/16/37/75/568163775.db2.gz ZIOKIBQMTAMLOG-UHFFFAOYSA-N 0 0 362.389 3.588 20 5 FHBDRN CC[C@@H](C)c1ccc([C@@H](NC(=O)Cn2ccc([N+](=O)[O-])n2)C(C)C)cc1 ZINC000603950547 568187181 /nfs/dbraw/zinc/18/71/81/568187181.db2.gz SCNPSRBAQZXAEO-KUHUBIRLSA-N 0 0 358.442 3.818 20 5 FHBDRN O=C(Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)c1ccnc(C2CC2)n1 ZINC000481946049 568195198 /nfs/dbraw/zinc/19/51/98/568195198.db2.gz TVSNVJXGNOARRZ-UHFFFAOYSA-N 0 0 367.390 3.638 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N(c1ccc(Cl)c(Cl)c1)C(C)C ZINC000132202837 568202155 /nfs/dbraw/zinc/20/21/55/568202155.db2.gz GBGBFKGPUOPENZ-UHFFFAOYSA-N 0 0 371.224 3.848 20 5 FHBDRN Cc1ccc(NC(=O)c2ccc(N3CCO[C@@H](C)[C@H]3C)c([N+](=O)[O-])c2)cc1 ZINC000481980945 568213256 /nfs/dbraw/zinc/21/32/56/568213256.db2.gz ZDFLKFUYNHUMBC-CABCVRRESA-N 0 0 369.421 3.769 20 5 FHBDRN C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)CSc1ccccc1[N+](=O)[O-] ZINC000481982761 568213511 /nfs/dbraw/zinc/21/35/11/568213511.db2.gz HAPDZEWZUGHTBM-QWRGUYRKSA-N 0 0 362.373 3.876 20 5 FHBDRN CC(C)n1cc2c(n1)C[C@H](Nc1ccc([N+](=O)[O-])c(OC(F)F)c1)CC2 ZINC000481979648 568214791 /nfs/dbraw/zinc/21/47/91/568214791.db2.gz HSZBHQGPFPYJIE-GFCCVEGCSA-N 0 0 366.368 3.943 20 5 FHBDRN O=C(CCc1cncnc1)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000568787277 568215611 /nfs/dbraw/zinc/21/56/11/568215611.db2.gz JJKKXZQVOQWKHH-UHFFFAOYSA-N 0 0 364.361 3.748 20 5 FHBDRN O=C(N[C@@H]1CCCOc2c(F)cccc21)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000481991268 568215955 /nfs/dbraw/zinc/21/59/55/568215955.db2.gz REJJLURUMICNLV-CQSZACIVSA-N 0 0 369.352 3.859 20 5 FHBDRN Cc1ccc(S(=O)(=O)N(Cc2ccccc2)[C@H](C)C2CC2)cc1[N+](=O)[O-] ZINC000007213424 568216308 /nfs/dbraw/zinc/21/63/08/568216308.db2.gz SWNYLRIZZFZBJW-OAHLLOKOSA-N 0 0 374.462 3.893 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])N[C@H]1CCCC[C@H]1CC(F)(F)F ZINC000453005075 568221492 /nfs/dbraw/zinc/22/14/92/568221492.db2.gz GQADTJPPKNQQHT-STQMWFEESA-N 0 0 374.359 3.991 20 5 FHBDRN CCOc1cc(NC(=O)N2CCCCCC2)c([N+](=O)[O-])cc1OCC ZINC000043839048 568230737 /nfs/dbraw/zinc/23/07/37/568230737.db2.gz QJKFKUXLEFFAFT-UHFFFAOYSA-N 0 0 351.403 3.800 20 5 FHBDRN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N[C@@H](c1ccccc1)C(F)F ZINC000482017448 568230958 /nfs/dbraw/zinc/23/09/58/568230958.db2.gz JQDLAWDTZDZDRV-KRWDZBQOSA-N 0 0 359.332 3.741 20 5 FHBDRN CCC(=O)c1ccc([O-])c(NC(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)c1 ZINC000436653191 568231865 /nfs/dbraw/zinc/23/18/65/568231865.db2.gz STQWNOSSYRYMGZ-UHFFFAOYSA-N 0 0 353.334 3.627 20 5 FHBDRN Cn1cc(CNc2cccc(CCCO)c2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000541921017 568234039 /nfs/dbraw/zinc/23/40/39/568234039.db2.gz UBVIULWZFGDNMI-UHFFFAOYSA-N 0 0 366.421 3.532 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(Cc2noc(-c3cccc4[nH]ccc43)n2)c1 ZINC000568829618 568234043 /nfs/dbraw/zinc/23/40/43/568234043.db2.gz FKERJCSTMGXSOG-UHFFFAOYSA-N 0 0 350.334 3.726 20 5 FHBDRN CCc1ccc([C@H]2CN(C(=O)c3ccc(CC)c([N+](=O)[O-])c3)CCO2)cc1 ZINC000482047409 568238547 /nfs/dbraw/zinc/23/85/47/568238547.db2.gz VMZZKZCWNUYPRZ-HXUWFJFHSA-N 0 0 368.433 3.933 20 5 FHBDRN CC1(C)CN(C(=O)Cc2ccc([N+](=O)[O-])cc2F)CC[C@H]1C(F)(F)F ZINC000482048689 568238635 /nfs/dbraw/zinc/23/86/35/568238635.db2.gz XXCHAWBROTXNFI-CYBMUJFWSA-N 0 0 362.323 3.713 20 5 FHBDRN CCN(Cc1cccc(Nc2ncnc3sc([N+](=O)[O-])cc32)c1)C(C)=O ZINC000568896773 568249610 /nfs/dbraw/zinc/24/96/10/568249610.db2.gz OMPLGJQCKPQEGG-UHFFFAOYSA-N 0 0 371.422 3.712 20 5 FHBDRN COc1cc([C@H](C)Nc2nc(C)cc(C)c2[N+](=O)[O-])cc(OC)c1OC ZINC000541931841 568250617 /nfs/dbraw/zinc/25/06/17/568250617.db2.gz CQOVVOOABIXPEK-LBPRGKRZSA-N 0 0 361.398 3.806 20 5 FHBDRN CC(C)(NCc1ccc(Br)cn1)c1ccccc1[N+](=O)[O-] ZINC000291669155 568252522 /nfs/dbraw/zinc/25/25/22/568252522.db2.gz GBBLHTSSRWUTKF-UHFFFAOYSA-N 0 0 350.216 3.777 20 5 FHBDRN O=[N+]([O-])c1cccc(OC[C@H](O)C[N@@H+]2CC3(CCC3)[C@@H]2c2ccccc2)c1 ZINC000453023918 568254616 /nfs/dbraw/zinc/25/46/16/568254616.db2.gz SBTLSFZKNYHGDU-QUCCMNQESA-N 0 0 368.433 3.562 20 5 FHBDRN O=C(Nc1ccc(-c2ccccc2)nn1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000150844922 568256829 /nfs/dbraw/zinc/25/68/29/568256829.db2.gz RLMDRFTTWZZOPW-UHFFFAOYSA-N 0 0 354.753 3.958 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N[C@@H](C[NH+](C)C)c1ccc(F)cc1 ZINC000482083339 568257658 /nfs/dbraw/zinc/25/76/58/568257658.db2.gz MGRRFECDCSHXPH-KRWDZBQOSA-N 0 0 374.416 3.775 20 5 FHBDRN COc1ccc(OC2CCN(c3nc(C)cc(C)c3[N+](=O)[O-])CC2)cc1 ZINC000541934624 568258502 /nfs/dbraw/zinc/25/85/02/568258502.db2.gz RWYVLDOAFXURHJ-UHFFFAOYSA-N 0 0 357.410 3.663 20 5 FHBDRN O=C(NCCNc1ccc([N+](=O)[O-])cc1)c1ccc(Oc2ccccc2)o1 ZINC000482091434 568258735 /nfs/dbraw/zinc/25/87/35/568258735.db2.gz VSMMQJSGCSVOHC-UHFFFAOYSA-N 0 0 367.361 3.822 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(Sc2nnc(-c3ccncc3)n2C2CC2)n1 ZINC000541936473 568258835 /nfs/dbraw/zinc/25/88/35/568258835.db2.gz ZLOCKYGYBJSWNS-UHFFFAOYSA-N 0 0 368.422 3.746 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(NCc2nccn2CCc2ccccc2)n1 ZINC000541935314 568259094 /nfs/dbraw/zinc/25/90/94/568259094.db2.gz NWAHKAOKNAMYAI-UHFFFAOYSA-N 0 0 351.410 3.658 20 5 FHBDRN CCC(CC)[C@@H]1C[C@@H](NC(=O)N(C)Cc2ccccc2[N+](=O)[O-])CCO1 ZINC000181959941 568260888 /nfs/dbraw/zinc/26/08/88/568260888.db2.gz LGBOKBOSLPTKEI-WMZOPIPTSA-N 0 0 363.458 3.720 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(NCc2nn(-c3ccccc3)c3c2CCC3)n1 ZINC000541936168 568261049 /nfs/dbraw/zinc/26/10/49/568261049.db2.gz QYIUETYOGZXWFC-UHFFFAOYSA-N 0 0 363.421 3.893 20 5 FHBDRN C[N@@H+](Cc1ccccc1)CC1CC[NH+](Cc2cc([O-])ccc2[N+](=O)[O-])CC1 ZINC000569014929 568268584 /nfs/dbraw/zinc/26/85/84/568268584.db2.gz YCEWBYNKHHXBAX-UHFFFAOYSA-N 0 0 369.465 3.644 20 5 FHBDRN Cc1cc(C)cc([C@H]2CCN(C(=O)c3n[nH]c4ccc([N+](=O)[O-])cc43)C2)c1 ZINC000181956445 568268905 /nfs/dbraw/zinc/26/89/05/568268905.db2.gz VUTSRHUATASMTB-AWEZNQCLSA-N 0 0 364.405 3.718 20 5 FHBDRN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCc1noc2ccccc21 ZINC000569017866 568271453 /nfs/dbraw/zinc/27/14/53/568271453.db2.gz WNWINFFCAVRLSB-AWEZNQCLSA-N 0 0 353.378 3.621 20 5 FHBDRN Cc1ccccc1[C@@H](NS(=O)(=O)c1ccc([N+](=O)[O-])s1)C(C)C ZINC000482104543 568274848 /nfs/dbraw/zinc/27/48/48/568274848.db2.gz OOIRPOXPVQGVAE-HNNXBMFYSA-N 0 0 354.453 3.640 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)Nc1nc(Cc2ccccc2)ns1 ZINC000150856494 568275481 /nfs/dbraw/zinc/27/54/81/568275481.db2.gz KNXFBTFQNPRWFN-UHFFFAOYSA-N 0 0 368.418 3.608 20 5 FHBDRN O=C(CSc1ccccc1[N+](=O)[O-])N[C@H](c1ccccc1)C(F)F ZINC000482108816 568275503 /nfs/dbraw/zinc/27/55/03/568275503.db2.gz ZJBVLARZTUJDEO-OAHLLOKOSA-N 0 0 352.362 3.810 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@@H]2C[C@@H](C)Oc3ccccc32)c1 ZINC000453044267 568276332 /nfs/dbraw/zinc/27/63/32/568276332.db2.gz YBBMQOGYYBQENB-GDBMZVCRSA-N 0 0 370.405 3.701 20 5 FHBDRN CC(C)c1nnc2c(NCCCCc3ccc([N+](=O)[O-])cc3)nccn21 ZINC000489616209 568276514 /nfs/dbraw/zinc/27/65/14/568276514.db2.gz DEUURLKWIZWTMQ-UHFFFAOYSA-N 0 0 354.414 3.591 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(OCC(=O)N[C@H](CC(C)C)c2ccccc2)n1 ZINC000541981557 568278427 /nfs/dbraw/zinc/27/84/27/568278427.db2.gz ROVYZTMUBNWKQY-QGZVFWFLSA-N 0 0 371.437 3.889 20 5 FHBDRN CO[C@@H](C)C(=O)Nc1cccc(N[C@H]2CCc3c2cccc3[N+](=O)[O-])c1 ZINC000569138029 568285075 /nfs/dbraw/zinc/28/50/75/568285075.db2.gz KAAHCUOBENLCTP-SJCJKPOMSA-N 0 0 355.394 3.668 20 5 FHBDRN CC(=O)c1ccc(NC(=O)N2CCOc3ccc([N+](=O)[O-])cc3C2)cc1C ZINC000569055307 568292813 /nfs/dbraw/zinc/29/28/13/568292813.db2.gz FPAPPVRBGUWBQB-UHFFFAOYSA-N 0 0 369.377 3.532 20 5 FHBDRN C[C@@H](Sc1nccc(C(F)(F)F)n1)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000026479381 568294401 /nfs/dbraw/zinc/29/44/01/568294401.db2.gz CCAZFWZZIAVFDB-MRVPVSSYSA-N 0 0 372.328 3.523 20 5 FHBDRN Cc1ccccc1[C@@H]1CN(C(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)[C@H](C)CO1 ZINC000569061353 568295684 /nfs/dbraw/zinc/29/56/84/568295684.db2.gz RZDXDWBBEAXYNZ-GUXCAODWSA-N 0 0 368.433 3.995 20 5 FHBDRN C[C@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1F)[C@H]1OCCc2sccc21 ZINC000291761754 568298227 /nfs/dbraw/zinc/29/82/27/568298227.db2.gz LRABUPHCLBNLFB-BJOHPYRUSA-N 0 0 365.386 3.619 20 5 FHBDRN CN(C(=O)CCc1ccc(-c2ccccc2)o1)c1ccc([N+](=O)[O-])nc1 ZINC000569168551 568299330 /nfs/dbraw/zinc/29/93/30/568299330.db2.gz ULBCKJKDRUZPHS-UHFFFAOYSA-N 0 0 351.362 3.845 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCc3c(ncn3CCc3ccccc3)C2)c(F)c1 ZINC000302006973 568301101 /nfs/dbraw/zinc/30/11/01/568301101.db2.gz AMLURSPBEOBPOF-UHFFFAOYSA-N 0 0 366.396 3.736 20 5 FHBDRN C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000482177643 568301881 /nfs/dbraw/zinc/30/18/81/568301881.db2.gz KDIQNTHESFWJIT-GXFFZTMASA-N 0 0 371.359 3.972 20 5 FHBDRN CS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1cccc(C(F)(F)F)c1 ZINC000302731723 568313172 /nfs/dbraw/zinc/31/31/72/568313172.db2.gz WNFLQDSLMUZSFZ-UHFFFAOYSA-N 0 0 361.297 3.809 20 5 FHBDRN CN(C(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1)[C@H]1CCc2ccccc21 ZINC000031275280 568328207 /nfs/dbraw/zinc/32/82/07/568328207.db2.gz MAULXLXDTWYFCE-IBGZPJMESA-N 0 0 362.389 3.540 20 5 FHBDRN C[C@@H]1CCCN(c2ccc(C(=O)N3CCCC4(CC4)C3)cc2[N+](=O)[O-])C1 ZINC000408289344 568329311 /nfs/dbraw/zinc/32/93/11/568329311.db2.gz FMNFKWLWXAVEPH-OAHLLOKOSA-N 0 0 357.454 3.847 20 5 FHBDRN Cc1c(C(=O)NCc2ccc(N3CCCCCC3)nc2)cccc1[N+](=O)[O-] ZINC000048935526 568345398 /nfs/dbraw/zinc/34/53/98/568345398.db2.gz UHMDGFUYSBNYQH-UHFFFAOYSA-N 0 0 368.437 3.609 20 5 FHBDRN C[C@@H](CNC(=O)c1cc(Br)cc([N+](=O)[O-])c1)CC(F)(F)F ZINC000412671537 568345854 /nfs/dbraw/zinc/34/58/54/568345854.db2.gz HTZOQTBEDCSRBI-SSDOTTSWSA-N 0 0 369.137 3.676 20 5 FHBDRN COC(=O)c1ccc(Cl)c(NC(=O)[C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000569301496 568346276 /nfs/dbraw/zinc/34/62/76/568346276.db2.gz LQZUNCOWDGKTAJ-SNVBAGLBSA-N 0 0 362.769 3.777 20 5 FHBDRN COc1cc(C(=O)NC[C@H]2CCCC[C@H]2C(F)(F)F)ccc1[N+](=O)[O-] ZINC000482224109 568356788 /nfs/dbraw/zinc/35/67/88/568356788.db2.gz IMVSVQCFSBUQMZ-VXGBXAGGSA-N 0 0 360.332 3.702 20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])NC[C@@H]1CCCC[C@H]1C(F)(F)F ZINC000482226175 568370338 /nfs/dbraw/zinc/37/03/38/568370338.db2.gz WISMNHPREJNARX-QWHCGFSZSA-N 0 0 373.375 3.882 20 5 FHBDRN C[C@H](Sc1ccc2c(c1)OCCCO2)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000005365800 568387114 /nfs/dbraw/zinc/38/71/14/568387114.db2.gz TVLFJEBAWOQLJB-LBPRGKRZSA-N 0 0 374.418 3.875 20 5 FHBDRN O=C(c1csc(-c2ccccc2)n1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000054451522 568390850 /nfs/dbraw/zinc/39/08/50/568390850.db2.gz REZZVUHAYKZWKY-UHFFFAOYSA-N 0 0 351.387 3.921 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])s1)N(Cc1ccc2c(c1)OCO2)C1CCCC1 ZINC000032505653 568393619 /nfs/dbraw/zinc/39/36/19/568393619.db2.gz JOXVEIBEEBTOJL-UHFFFAOYSA-N 0 0 374.418 3.970 20 5 FHBDRN C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CC[C@@H](c2ccccc2F)C1 ZINC000569345245 568395729 /nfs/dbraw/zinc/39/57/29/568395729.db2.gz LHPANDPUTYHYHS-ZIAGYGMSSA-N 0 0 357.385 3.550 20 5 FHBDRN C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CC[C@H](c2ccccc2F)C1 ZINC000569345242 568395762 /nfs/dbraw/zinc/39/57/62/568395762.db2.gz LHPANDPUTYHYHS-KBPBESRZSA-N 0 0 357.385 3.550 20 5 FHBDRN COc1ccc(NC(=O)Cc2csc(-c3ccccc3)n2)cc1[N+](=O)[O-] ZINC000541998513 568396255 /nfs/dbraw/zinc/39/62/55/568396255.db2.gz INENPMHIHBXWIG-UHFFFAOYSA-N 0 0 369.402 3.908 20 5 FHBDRN Cc1nn(C)c(NCc2cc(Cl)ccc2Br)c1[N+](=O)[O-] ZINC000569479802 568402627 /nfs/dbraw/zinc/40/26/27/568402627.db2.gz MFSIRJZYOQJHGQ-UHFFFAOYSA-N 0 0 359.611 3.665 20 5 FHBDRN CCCN(Cc1ccc(C)cc1)C(=O)C(=O)Nc1ccc([N+](=O)[O-])c(C)c1 ZINC000569448196 568402772 /nfs/dbraw/zinc/40/27/72/568402772.db2.gz WABKQAQSQRBTLY-UHFFFAOYSA-N 0 0 369.421 3.589 20 5 FHBDRN C[C@H]1CN(Cc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2N(C)C1=O ZINC000541999677 568412489 /nfs/dbraw/zinc/41/24/89/568412489.db2.gz RVGNYYWOCDQZGZ-LBPRGKRZSA-N 0 0 359.813 3.867 20 5 FHBDRN CCn1c(C)nc([N+](=O)[O-])c1N[C@@H](C)c1c(C)nn(CC(F)(F)F)c1C ZINC000569731461 568414506 /nfs/dbraw/zinc/41/45/06/568414506.db2.gz UCSRTICKKZMHKH-QMMMGPOBSA-N 0 0 374.367 3.668 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H](C)c1nnc([C@@H](C)CC)[nH]1 ZINC000569652546 568415146 /nfs/dbraw/zinc/41/51/46/568415146.db2.gz AJFINNQYWBKVBL-WDEREUQCSA-N 0 0 360.418 3.672 20 5 FHBDRN CN(C(=O)CCOc1ccc2ccccc2c1)c1ccc([N+](=O)[O-])nc1 ZINC000570004484 568449269 /nfs/dbraw/zinc/44/92/69/568449269.db2.gz DDROXRMOJYTXNC-UHFFFAOYSA-N 0 0 351.362 3.575 20 5 FHBDRN Cc1nc(COC(C)(C)C)oc1C(=O)Nc1ccc([N+](=O)[O-])cc1F ZINC000570098369 568450812 /nfs/dbraw/zinc/45/08/12/568450812.db2.gz QJHFXFKUCFWBBR-UHFFFAOYSA-N 0 0 351.334 3.598 20 5 FHBDRN CC(C)Nc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1CCc2cccc(O)c21 ZINC000570170490 568455446 /nfs/dbraw/zinc/45/54/46/568455446.db2.gz UJLSIELQRCPHGT-CQSZACIVSA-N 0 0 355.394 3.789 20 5 FHBDRN CC[C@H](NC(=O)c1ccccc1)c1noc(-c2ccc(F)cc2[N+](=O)[O-])n1 ZINC000570083198 568457629 /nfs/dbraw/zinc/45/76/29/568457629.db2.gz JMRFIVPSRKSBCL-AWEZNQCLSA-N 0 0 370.340 3.665 20 5 FHBDRN O=C(NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)[C@H]1C[C@@]1(F)c1ccccc1 ZINC000570179868 568459513 /nfs/dbraw/zinc/45/95/13/568459513.db2.gz CEDWRYFBGPIVTN-YLJYHZDGSA-N 0 0 367.380 3.620 20 5 FHBDRN O=C(Nc1cc(C2CCCC2)[nH]n1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000182019249 568462427 /nfs/dbraw/zinc/46/24/27/568462427.db2.gz LPFAHPPCVFGSNW-UHFFFAOYSA-N 0 0 366.324 3.829 20 5 FHBDRN C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)N[C@@H]3CC[C@H](F)C3)cc2[N+](=O)[O-])C1 ZINC000570340104 568467477 /nfs/dbraw/zinc/46/74/77/568467477.db2.gz ILINYXGTVPSGNB-LQKXBSAESA-N 0 0 363.433 3.698 20 5 FHBDRN COc1ccc([C@H](C)NCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)cc1F ZINC000182023139 568469373 /nfs/dbraw/zinc/46/93/73/568469373.db2.gz NEVFPYYCXVYQAY-NSHDSACASA-N 0 0 372.356 3.643 20 5 FHBDRN COc1ccc(CNC(=O)N2CCc3ccc(Cl)cc32)cc1[N+](=O)[O-] ZINC000482231505 568471574 /nfs/dbraw/zinc/47/15/74/568471574.db2.gz LMTMYIXDOVTSDZ-UHFFFAOYSA-N 0 0 361.785 3.529 20 5 FHBDRN Cc1ncsc1NC(=O)c1cc([N+](=O)[O-])cc(Br)c1C ZINC000570416473 568475313 /nfs/dbraw/zinc/47/53/13/568475313.db2.gz VZCCYBYPQOWSOM-UHFFFAOYSA-N 0 0 356.201 3.683 20 5 FHBDRN O=[N+]([O-])c1cc(C(F)(F)F)ccc1NC[C@@H]1CCC2(CCOCC2)[C@H]1O ZINC000570346210 568479601 /nfs/dbraw/zinc/47/96/01/568479601.db2.gz FETKWJJFSXNIMF-NHYWBVRUSA-N 0 0 374.359 3.593 20 5 FHBDRN CC(=O)N1CCCc2cc(NC(=O)[C@H](C)c3cccc([N+](=O)[O-])c3)ccc21 ZINC000570385153 568482342 /nfs/dbraw/zinc/48/23/42/568482342.db2.gz LNLHERNCBFDZOF-CYBMUJFWSA-N 0 0 367.405 3.636 20 5 FHBDRN CCN(C(=O)Nc1ccc([N+](=O)[O-])cc1F)c1ccc(OC)c(OC)c1 ZINC000570387031 568482441 /nfs/dbraw/zinc/48/24/41/568482441.db2.gz FGWISVZAUDPXLF-UHFFFAOYSA-N 0 0 363.345 3.810 20 5 FHBDRN Cc1nn(-c2ccccc2)c(C)c1CNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000007366429 568503227 /nfs/dbraw/zinc/50/32/27/568503227.db2.gz XFKOKMIJMQVIFI-UHFFFAOYSA-N 0 0 367.365 3.918 20 5 FHBDRN Cc1cccc(C)c1NS(=O)(=O)c1cc(Cl)c(C)c([N+](=O)[O-])c1 ZINC000007419378 568505538 /nfs/dbraw/zinc/50/55/38/568505538.db2.gz HIGIWFVNPDHCGQ-UHFFFAOYSA-N 0 0 354.815 3.974 20 5 FHBDRN Cc1ccc(OCC(=O)Nc2ccc(C(F)(F)F)cc2)c([N+](=O)[O-])c1 ZINC000007442985 568511417 /nfs/dbraw/zinc/51/14/17/568511417.db2.gz PLHNFZYMAOMJLL-UHFFFAOYSA-N 0 0 354.284 3.940 20 5 FHBDRN CN(Cc1ccc(Cl)c(Cl)c1)C(=O)COc1cccc([N+](=O)[O-])c1 ZINC000007489174 568521312 /nfs/dbraw/zinc/52/13/12/568521312.db2.gz OSAGRVBJFJRHND-UHFFFAOYSA-N 0 0 369.204 3.939 20 5 FHBDRN Cc1ccc([C@H](C)N(C)C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)cc1 ZINC000049655414 568556110 /nfs/dbraw/zinc/55/61/10/568556110.db2.gz HGNBCFHBRRRMSG-HNNXBMFYSA-N 0 0 364.405 3.922 20 5 FHBDRN O=[N+]([O-])c1c(Sc2ccc(-c3nn[nH]n3)cc2F)ccc2ncccc21 ZINC000823630102 599059232 /nfs/dbraw/zinc/05/92/32/599059232.db2.gz ROXSKVYNLJRUSC-UHFFFAOYSA-N 0 0 368.353 3.613 20 5 FHBDRN C[C@@H]1C[C@H](c2cccc(F)c2)N(c2ccc([N+](=O)[O-])cc2-c2nn[nH]n2)C1 ZINC000820668313 599059809 /nfs/dbraw/zinc/05/98/09/599059809.db2.gz RNDDRPHLWKVWNV-PIGZYNQJSA-N 0 0 368.372 3.502 20 5 FHBDRN C[C@@H]1C[C@@H](c2cccc(F)c2)N(c2ccc([N+](=O)[O-])cc2-c2nn[nH]n2)C1 ZINC000820668311 599060233 /nfs/dbraw/zinc/06/02/33/599060233.db2.gz RNDDRPHLWKVWNV-DIFFPNOSSA-N 0 0 368.372 3.502 20 5 FHBDRN COc1ccccc1[C@H](C)Sc1ccc([N+](=O)[O-])cc1-c1nn[nH]n1 ZINC000821883375 599068832 /nfs/dbraw/zinc/06/88/32/599068832.db2.gz UQSLMNZKXHOJBD-JTQLQIEISA-N 0 0 357.395 3.637 20 5 FHBDRN C[C@H]1C[C@@H](c2ccccc2F)N(c2ccc([N+](=O)[O-])cc2-c2nn[nH]n2)C1 ZINC000820667144 599077140 /nfs/dbraw/zinc/07/71/40/599077140.db2.gz LGBLCYJNCMBEDS-GTNSWQLSSA-N 0 0 368.372 3.502 20 5 FHBDRN C[C@H]1C[C@H](c2ccccc2F)N(c2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])C1 ZINC000820667099 599077222 /nfs/dbraw/zinc/07/72/22/599077222.db2.gz LBHLZFHTEKSKLW-MEDUHNTESA-N 0 0 368.372 3.502 20 5 FHBDRN O=[N+]([O-])c1ccc(Nc2cccc(CC(F)(F)F)c2)c(-c2nn[nH]n2)c1 ZINC000823645978 599086126 /nfs/dbraw/zinc/08/61/26/599086126.db2.gz YWQOVRZUFXYCRK-UHFFFAOYSA-N 0 0 364.287 3.623 20 5 FHBDRN O=[N+]([O-])c1ccc(Nc2cccc(NC3CCCC3)c2)c(-c2nn[nH]n2)c1 ZINC000738366664 599351546 /nfs/dbraw/zinc/35/15/46/599351546.db2.gz GYCXPSIQYNSXDC-UHFFFAOYSA-N 0 0 365.397 3.873 20 5 FHBDRN O=C([O-])[C@@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1ccccc1C(F)(F)F ZINC000739500061 599792050 /nfs/dbraw/zinc/79/20/50/599792050.db2.gz NPLDMEXAWMTOHB-HNNXBMFYSA-N 0 0 368.311 3.572 20 5 FHBDRN C[NH+](C)CCc1ccc(Nc2ccc(/C=C/C(=O)[O-])cc2[N+](=O)[O-])cc1 ZINC000737368360 599854842 /nfs/dbraw/zinc/85/48/42/599854842.db2.gz NNOFBQCJYNUGEG-UXBLZVDNSA-N 0 0 355.394 3.540 20 5 FHBDRN C[C@H](C[N@H+](Cc1ccccc1)Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)[O-] ZINC000736584092 600402253 /nfs/dbraw/zinc/40/22/53/600402253.db2.gz PBDYVEUAYBDPOU-CYBMUJFWSA-N 0 0 362.813 3.971 20 5 FHBDRN C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCN(c2ccc(C(=O)[O-])cc2)C[C@@H]1C ZINC000828495052 600821886 /nfs/dbraw/zinc/82/18/86/600821886.db2.gz UWQQRBMTCRVCSJ-GJZGRUSLSA-N 0 0 369.421 3.565 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2nc(-c3cccc(-c4nn[nH]n4)c3)cs2)cc1 ZINC000826498435 607645187 /nfs/dbraw/zinc/64/51/87/607645187.db2.gz UTLWUXDIOFPMJX-UHFFFAOYSA-N 0 0 350.363 3.565 20 5 FHBDRN O=C([O-])[C@H]1CC12CC[NH+](Cc1ccc(-c3ccccc3[N+](=O)[O-])o1)CC2 ZINC000833771552 604650113 /nfs/dbraw/zinc/65/01/13/604650113.db2.gz ISVXSCXTMKUJBE-OAHLLOKOSA-N 0 0 356.378 3.542 20 5 FHBDRN O=C([O-])[C@@H]1CC12CC[NH+](Cc1ccc(-c3cccc([N+](=O)[O-])c3)o1)CC2 ZINC000833771604 604650278 /nfs/dbraw/zinc/65/02/78/604650278.db2.gz KQPZRTQSYHHJQM-INIZCTEOSA-N 0 0 356.378 3.542 20 5 FHBDRN C[C@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C[C@H]1C(=O)[O-] ZINC000833628946 604665665 /nfs/dbraw/zinc/66/56/65/604665665.db2.gz CUDJETDLCNATKJ-IINYFYTJSA-N 0 0 364.785 3.661 20 5 FHBDRN O=[N+]([O-])c1ccc(NC[C@H]2CCC[C@@H](C(F)(F)F)C2)c(-c2nn[nH]n2)c1 ZINC000823640061 606595799 /nfs/dbraw/zinc/59/57/99/606595799.db2.gz QSFWOTYPYDXZNW-VHSXEESVSA-N 0 0 370.335 3.556 20 5 FHBDRN O=[N+]([O-])c1c(-c2nn[nH]n2)ccnc1SCc1cccc2ccccc21 ZINC000823629743 606706453 /nfs/dbraw/zinc/70/64/53/606706453.db2.gz GFOHVYFNRPWMNB-UHFFFAOYSA-N 0 0 364.390 3.615 20 5 FHBDRN COc1ccc(OCC(=O)N[C@H](C)c2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000005051959 936315121 /nfs/dbraw/zinc/31/51/21/936315121.db2.gz FETAKPSUOXAKRX-LLVKDONJSA-N 0 0 364.785 3.513 20 5 FHBDRN Cc1nnc([C@@H]2Cc3ccccc3CN2c2ncc(Cl)cc2[N+](=O)[O-])o1 ZINC000153607392 936315171 /nfs/dbraw/zinc/31/51/71/936315171.db2.gz WKLAYHOGXFZHDQ-HNNXBMFYSA-N 0 0 371.784 3.639 20 5 FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N(C)Cc1ccsc1 ZINC000122000396 936315920 /nfs/dbraw/zinc/31/59/20/936315920.db2.gz DXULURHZUKLDBT-UHFFFAOYSA-N 0 0 366.464 3.667 20 5 FHBDRN O=C(Nc1cccc(C(=O)N2CCCc3c([N+](=O)[O-])cccc32)c1)C1CC1 ZINC000161875832 936320556 /nfs/dbraw/zinc/32/05/56/936320556.db2.gz NKTXGAHFKCGODF-UHFFFAOYSA-N 0 0 365.389 3.536 20 5 FHBDRN Cn1c(SCc2ccc(Cl)c([N+](=O)[O-])c2)nnc1-c1ccco1 ZINC000135277373 936321306 /nfs/dbraw/zinc/32/13/06/936321306.db2.gz ULHKWYDBZXLIMF-UHFFFAOYSA-N 0 0 350.787 3.929 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)N(C)CCOc2ccccc2F)c1 ZINC000024214864 936325514 /nfs/dbraw/zinc/32/55/14/936325514.db2.gz IFTWLIOOKNIYLJ-UHFFFAOYSA-N 0 0 364.398 3.607 20 5 FHBDRN O=C(Nc1nnc(Cc2ccccc2)s1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000033745410 936325987 /nfs/dbraw/zinc/32/59/87/936325987.db2.gz AGXFVJXJYSHION-UHFFFAOYSA-N 0 0 374.809 3.943 20 5 FHBDRN C[C@@H](NC(=O)N[C@H]1CCOc2c(F)cccc21)c1cccc([N+](=O)[O-])c1 ZINC000187881476 936332568 /nfs/dbraw/zinc/33/25/68/936332568.db2.gz VJUWINXAGZYKPR-BZNIZROVSA-N 0 0 359.357 3.618 20 5 FHBDRN COCc1ccc([C@H]2CCCN2C(=O)c2cc(F)c([N+](=O)[O-])cc2F)o1 ZINC000162066105 936342875 /nfs/dbraw/zinc/34/28/75/936342875.db2.gz VJBAKADWEPUJSY-CQSZACIVSA-N 0 0 366.320 3.590 20 5 FHBDRN O=[N+]([O-])c1ccc(Cc2noc(-c3ccc(OC4CCCC4)cc3)n2)nc1 ZINC000612969865 936351438 /nfs/dbraw/zinc/35/14/38/936351438.db2.gz HFTHBGKEJZFQNR-UHFFFAOYSA-N 0 0 366.377 3.952 20 5 FHBDRN COc1cccc(Cc2noc(-c3cc4cc([N+](=O)[O-])ccc4s3)n2)n1 ZINC000612980186 936352710 /nfs/dbraw/zinc/35/27/10/936352710.db2.gz ZKZWCIOOEIELNE-UHFFFAOYSA-N 0 0 368.374 3.854 20 5 FHBDRN Cc1ccc(Nc2ncc(I)cc2F)cc1[N+](=O)[O-] ZINC001213663458 936356661 /nfs/dbraw/zinc/35/66/61/936356661.db2.gz HNLRKWADRVXYEA-UHFFFAOYSA-N 0 0 373.125 3.786 20 5 FHBDRN CS(=O)(=O)c1cccc(NC[C@H](c2ccccc2)C2CC2)c1[N+](=O)[O-] ZINC000431513284 936360791 /nfs/dbraw/zinc/36/07/91/936360791.db2.gz KMWGWMBOQQXTGP-OAHLLOKOSA-N 0 0 360.435 3.604 20 5 FHBDRN CC1(C)CN(C(=O)COc2ccccc2[N+](=O)[O-])C[C@@H]1c1ccccc1 ZINC000122014190 936365053 /nfs/dbraw/zinc/36/50/53/936365053.db2.gz YPODWOGRVIDJKV-MRXNPFEDSA-N 0 0 354.406 3.626 20 5 FHBDRN O=C(NCc1ccc(F)cc1F)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000437144032 945065218 /nfs/dbraw/zinc/06/52/18/945065218.db2.gz STZWOJBNRQORET-UHFFFAOYSA-N 0 0 360.238 3.822 20 5 FHBDRN Cc1ccccc1-c1noc([C@H](C)SCCn2cc([N+](=O)[O-])cn2)n1 ZINC000162379028 937085029 /nfs/dbraw/zinc/08/50/29/937085029.db2.gz CKOHNNYRGWLUOK-LBPRGKRZSA-N 0 0 359.411 3.644 20 5 FHBDRN C[C@@H](NC(=O)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1)c1cccc(O)c1 ZINC000458373606 937085486 /nfs/dbraw/zinc/08/54/86/937085486.db2.gz CAFHQYMIOXEPEV-PBHICJAKSA-N 0 0 369.421 3.951 20 5 FHBDRN Cc1onc(-c2cccnc2)c1C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000514879707 937103635 /nfs/dbraw/zinc/10/36/35/937103635.db2.gz FDBCRTBDRDATMK-UHFFFAOYSA-N 0 0 372.768 3.537 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2noc(CN3CC[C@](F)(c4ccccc4)C3)n2)c1 ZINC000583096557 937116462 /nfs/dbraw/zinc/11/64/62/937116462.db2.gz MVLLMSAUIJFNOD-LJQANCHMSA-N 0 0 368.368 3.716 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)N[C@H]2CCCC[C@@H]2n2cccn2)cc1[N+](=O)[O-] ZINC000176398896 937126927 /nfs/dbraw/zinc/12/69/27/937126927.db2.gz JDAYYVFCJUZMIT-XIRDDKMYSA-N 0 0 371.441 3.644 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2noc(-c3c(C(F)F)nc4n3CCCC4)n2)cc1 ZINC000866837887 927044113 /nfs/dbraw/zinc/04/41/13/927044113.db2.gz HRNULMRAJPZDJE-UHFFFAOYSA-N 0 0 361.308 3.782 20 5 FHBDRN CC(=O)c1ccc(NC(=O)c2ccc([N+](=O)[O-])c(-n3ccnc3)c2)cc1C ZINC001266245630 927047079 /nfs/dbraw/zinc/04/70/79/927047079.db2.gz SGYFAOONBPOSLL-UHFFFAOYSA-N 0 0 364.361 3.544 20 5 FHBDRN O=[N+]([O-])c1ccc2nc(NC3CCC(O)(c4cccnc4)CC3)ccc2c1 ZINC000274514062 927064837 /nfs/dbraw/zinc/06/48/37/927064837.db2.gz YEBQRUCTUYDKOY-UHFFFAOYSA-N 0 0 364.405 3.780 20 5 FHBDRN C[C@@H](CNC(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)CC(F)(F)F ZINC000579686126 927080762 /nfs/dbraw/zinc/08/07/62/927080762.db2.gz PZTDGALWHMSLRB-SNVBAGLBSA-N 0 0 372.347 3.506 20 5 FHBDRN Cc1cc(C(=O)Nc2cccc(Nc3cnn(C)c3)c2)ccc1[N+](=O)[O-] ZINC000471101749 927091386 /nfs/dbraw/zinc/09/13/86/927091386.db2.gz OVVDDRREXYHYDK-UHFFFAOYSA-N 0 0 351.366 3.633 20 5 FHBDRN C[C@@H](CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])Oc1ccccc1F ZINC000175270230 927147462 /nfs/dbraw/zinc/14/74/62/927147462.db2.gz JJAULQUIUUDAPW-JTQLQIEISA-N 0 0 352.749 3.585 20 5 FHBDRN C[C@H](CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])Oc1ccccc1F ZINC000175270254 927147526 /nfs/dbraw/zinc/14/75/26/927147526.db2.gz JJAULQUIUUDAPW-SNVBAGLBSA-N 0 0 352.749 3.585 20 5 FHBDRN O=[N+]([O-])c1cc2c(ncnc2NCCc2nc3c(s2)CCCC3)s1 ZINC000557609472 927160105 /nfs/dbraw/zinc/16/01/05/927160105.db2.gz WOQLNLGSMQZKHI-UHFFFAOYSA-N 0 0 361.452 3.589 20 5 FHBDRN CCC[C@@H]1CCCC[C@@H]1NC(=O)c1cc(OC)c(OC)c([N+](=O)[O-])c1 ZINC000610174208 927170458 /nfs/dbraw/zinc/17/04/58/927170458.db2.gz POZJBSCFSCLHMV-OCCSQVGLSA-N 0 0 350.415 3.701 20 5 FHBDRN CN(C[C@H]1CCCC[C@@H]1O)C(=O)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000278088541 937142068 /nfs/dbraw/zinc/14/20/68/937142068.db2.gz PXMYZIRQRHOFOD-KUHUBIRLSA-N 0 0 364.445 3.717 20 5 FHBDRN COc1cc(C(=O)N[C@@H](c2ccccc2)C2CCC2)cc([N+](=O)[O-])c1OC ZINC000610174380 927199425 /nfs/dbraw/zinc/19/94/25/927199425.db2.gz FOESSMNKSXPQQR-SFHVURJKSA-N 0 0 370.405 3.883 20 5 FHBDRN CC[C@H](C)n1ncc2c1nc(C)cc2C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000133635897 927218138 /nfs/dbraw/zinc/21/81/38/927218138.db2.gz WHGBNTCQEDRGCI-LBPRGKRZSA-N 0 0 353.382 3.871 20 5 FHBDRN COC(=O)CC1CCC(OC(=O)/C=C(\C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000784901671 927233542 /nfs/dbraw/zinc/23/35/42/927233542.db2.gz LWONTDAHNJGWIR-ACCUITESSA-N 0 0 361.394 3.663 20 5 FHBDRN O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N(CCc1ccccc1)[C@H]1CCOC1 ZINC000175276931 927244302 /nfs/dbraw/zinc/24/43/02/927244302.db2.gz UQAKHNPSGYMYSY-KRWDZBQOSA-N 0 0 374.824 3.722 20 5 FHBDRN O=[N+]([O-])c1cccc(Nc2nc(Br)cnc2Br)c1 ZINC001204414926 927261265 /nfs/dbraw/zinc/26/12/65/927261265.db2.gz DYVJJBRJPLMYIC-UHFFFAOYSA-N 0 0 373.992 3.653 20 5 FHBDRN CC[C@H](C)n1ncc2c1nc(C)cc2C(=O)Nc1ccc([N+](=O)[O-])c(C)n1 ZINC000133649490 927281036 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Cc1ccc(CNC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)cc1 ZINC000064868428 929851167 /nfs/dbraw/zinc/85/11/67/929851167.db2.gz CCXDQFXOMCVSFX-UHFFFAOYSA-N 0 0 353.403 3.957 20 5 FHBDRN O=C(c1csc([N+](=O)[O-])c1)N1CCC(Oc2ccccc2Cl)CC1 ZINC000178865654 937369573 /nfs/dbraw/zinc/36/95/73/937369573.db2.gz FXMUWAXBBQCPBC-UHFFFAOYSA-N 0 0 366.826 3.993 20 5 FHBDRN CC(C)=CCSc1ccccc1C(=O)OCCn1cc([N+](=O)[O-])cn1 ZINC000748130139 929948277 /nfs/dbraw/zinc/94/82/77/929948277.db2.gz WFBRNWZVACTXCC-UHFFFAOYSA-N 0 0 361.423 3.707 20 5 FHBDRN Cc1nc(NC(=O)c2ccc(OCc3ccccc3)nc2)ccc1[N+](=O)[O-] ZINC000177665205 929998632 /nfs/dbraw/zinc/99/86/32/929998632.db2.gz ZQOWPKJBLLPEOI-UHFFFAOYSA-N 0 0 364.361 3.525 20 5 FHBDRN COc1cc(Cl)c(Cl)cc1C(=O)Nc1ccc([N+](=O)[O-])c(C)n1 ZINC000177667233 929998976 /nfs/dbraw/zinc/99/89/76/929998976.db2.gz DUIDANLTLZFCBP-UHFFFAOYSA-N 0 0 356.165 3.866 20 5 FHBDRN COc1ccc(Cl)c(NC(=O)c2cc(OC)c(F)cc2[N+](=O)[O-])c1 ZINC001125404493 930005397 /nfs/dbraw/zinc/00/53/97/930005397.db2.gz 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CCOc1cccc(NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)n1 ZINC000610434608 930566780 /nfs/dbraw/zinc/56/67/80/930566780.db2.gz BBQAGMISHBBZEX-UHFFFAOYSA-N 0 0 370.390 3.764 20 5 FHBDRN Cn1ccnc1C(=O)c1ccc(N[C@H]2CC23CCCCC3)c([N+](=O)[O-])c1 ZINC000536625847 930580945 /nfs/dbraw/zinc/58/09/45/930580945.db2.gz WVVVCBZPUXCHED-INIZCTEOSA-N 0 0 354.410 3.694 20 5 FHBDRN COc1ccc(F)c(NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)c1 ZINC000155723550 930589052 /nfs/dbraw/zinc/58/90/52/930589052.db2.gz OXLNVJOAPYMAHY-UHFFFAOYSA-N 0 0 373.384 3.598 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])cc1)Nc1cccc(NC2CCCC2)c1 ZINC000109898161 930622461 /nfs/dbraw/zinc/62/24/61/930622461.db2.gz DQVPELHLGIRVNN-UHFFFAOYSA-N 0 0 355.394 3.967 20 5 FHBDRN Cc1ccc(CN[C@@H](C)c2noc(Cc3ccccc3)n2)cc1[N+](=O)[O-] ZINC000080345401 937432701 /nfs/dbraw/zinc/43/27/01/937432701.db2.gz VJSJGAFGNKGHSB-AWEZNQCLSA-N 0 0 352.394 3.728 20 5 FHBDRN CN(C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2)c1c(Cl)cccc1Cl ZINC000536791961 930650301 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FHBDRN CC(C)c1ccc(C(=O)Nc2cccc(N3CCNC3=O)c2)cc1[N+](=O)[O-] ZINC000275897384 930751507 /nfs/dbraw/zinc/75/15/07/930751507.db2.gz MPVYTEBWDBSZHW-UHFFFAOYSA-N 0 0 368.393 3.500 20 5 FHBDRN CCc1[nH]nc(C(=O)Nc2ccc(OC3CCCCC3)cc2)c1[N+](=O)[O-] ZINC000579696703 930810137 /nfs/dbraw/zinc/81/01/37/930810137.db2.gz KYAMIQPMKUHNRH-UHFFFAOYSA-N 0 0 358.398 3.844 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc([N+](=O)[O-])c(C)n1 ZINC000160545532 930850675 /nfs/dbraw/zinc/85/06/75/930850675.db2.gz YHWPDHNHHSSVFE-UHFFFAOYSA-N 0 0 362.367 3.571 20 5 FHBDRN Cc1cc(C(=O)NCc2cccc(C(=O)OC(C)(C)C)c2)cc([N+](=O)[O-])c1 ZINC001266620903 930851525 /nfs/dbraw/zinc/85/15/25/930851525.db2.gz JKTYKLBRECKBNI-UHFFFAOYSA-N 0 0 370.405 3.789 20 5 FHBDRN Cc1cccc(CO[C@H](C)C(=O)N2CCc3cc(C)c([N+](=O)[O-])cc32)c1 ZINC001266623304 930871571 /nfs/dbraw/zinc/87/15/71/930871571.db2.gz LUWWVCXIBPFIMY-OAHLLOKOSA-N 0 0 354.406 3.706 20 5 FHBDRN CN(C(=O)/C=C\c1cccnc1)c1nc(-c2ccccc2[N+](=O)[O-])cs1 ZINC000588382932 930879098 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Cc1ccc(C)c(N(C)S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000055674773 931327739 /nfs/dbraw/zinc/32/77/39/931327739.db2.gz UNBSCJBJYYSIBH-UHFFFAOYSA-N 0 0 354.815 3.690 20 5 FHBDRN COc1cc(C(=O)N2CCCC[C@@H]2c2ccc(C)o2)cc([N+](=O)[O-])c1OC ZINC000610179379 931358485 /nfs/dbraw/zinc/35/84/85/931358485.db2.gz QLBKJMANJHODDC-CQSZACIVSA-N 0 0 374.393 3.881 20 5 FHBDRN CCC[C@H](C)C(=O)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000060388573 931367082 /nfs/dbraw/zinc/36/70/82/931367082.db2.gz GWUVSVUWAOQQDX-LBPRGKRZSA-N 0 0 373.375 3.698 20 5 FHBDRN COc1cc(C(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)cc(OC)c1C ZINC000430527885 931374936 /nfs/dbraw/zinc/37/49/36/931374936.db2.gz WLKIBCRTOLBCRQ-UHFFFAOYSA-N 0 0 358.394 3.586 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)c2ccc3c(c2)OCCCO3)cc1[N+](=O)[O-] ZINC000177866147 931389688 /nfs/dbraw/zinc/38/96/88/931389688.db2.gz DPVRPNLOLWMHKA-ZDUSSCGKSA-N 0 0 356.378 3.556 20 5 FHBDRN CCCc1[nH]nc(C(=O)Nc2ccc(-c3ccccc3)cn2)c1[N+](=O)[O-] ZINC000156725274 931391303 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3.629 20 5 FHBDRN CCc1cccc(OC[C@@H](O)COc2c(Cl)cccc2[N+](=O)[O-])c1 ZINC000581025031 931477802 /nfs/dbraw/zinc/47/78/02/931477802.db2.gz SIWQNDZMQVHVFB-CYBMUJFWSA-N 0 0 351.786 3.629 20 5 FHBDRN O=C(NCCCCOCc1ccccc1)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000050689531 931522227 /nfs/dbraw/zinc/52/22/27/931522227.db2.gz DTBAZEUPYAKWPD-UHFFFAOYSA-N 0 0 367.405 3.803 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1CN1CCCC[C@H]1c1noc(C2CC2)n1 ZINC000610476247 931533101 /nfs/dbraw/zinc/53/31/01/931533101.db2.gz NVPXESOENFJYBZ-INIZCTEOSA-N 0 0 372.425 3.981 20 5 FHBDRN O=[N+]([O-])c1c(N[C@@H]2CCCN(CC(F)(F)F)C2)ccc2ncccc21 ZINC000581064592 931534970 /nfs/dbraw/zinc/53/49/70/931534970.db2.gz OFQUGZDMZIENIP-LLVKDONJSA-N 0 0 354.332 3.582 20 5 FHBDRN CC(C)(C)C[C@H](CO)NC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000276023159 931541670 /nfs/dbraw/zinc/54/16/70/931541670.db2.gz VFERPQMZJFZNGN-CQSZACIVSA-N 0 0 352.434 3.621 20 5 FHBDRN O=C(c1cc(OCc2ccccc2)ccc1[N+](=O)[O-])N1CCC[C@@H](F)C1 ZINC000581078034 931544076 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O=C(c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1)N1CCCCC1 ZINC000134469381 932011400 /nfs/dbraw/zinc/01/14/00/932011400.db2.gz IEKBUOWRMHBTDY-UHFFFAOYSA-N 0 0 369.208 3.713 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)N1CC[C@@H]1c1cccc(F)c1 ZINC000610505435 932012555 /nfs/dbraw/zinc/01/25/55/932012555.db2.gz LKJQLBAYGRSQEJ-YVEFUNNKSA-N 0 0 373.384 3.517 20 5 FHBDRN C[C@H]1CN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[C@H](C(F)(F)F)O1 ZINC000610411883 932022728 /nfs/dbraw/zinc/02/27/28/932022728.db2.gz BGKMWXHOPHKYQT-WRWORJQWSA-N 0 0 358.238 3.770 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2noc(CN3CC[C@@H]3c3cccc(F)c3)n2)cc1 ZINC000610505863 932040130 /nfs/dbraw/zinc/04/01/30/932040130.db2.gz ZJZNVDHHVQNNNK-MRXNPFEDSA-N 0 0 354.341 3.731 20 5 FHBDRN O=[N+]([O-])c1ccc2oc(CN3CCCO[C@H](c4ccccc4)C3)nc2c1 ZINC000610581955 932071711 /nfs/dbraw/zinc/07/17/11/932071711.db2.gz YVQOMZABYQMGRE-SFHVURJKSA-N 0 0 353.378 3.700 20 5 FHBDRN CCS[C@H](C)c1noc(CN(Cc2ccccc2[N+](=O)[O-])C2CC2)n1 ZINC000135228087 932076422 /nfs/dbraw/zinc/07/64/22/932076422.db2.gz PSVBABGYKYQQJO-GFCCVEGCSA-N 0 0 362.455 3.957 20 5 FHBDRN CCC(CC)N(CC(C)C)C(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000178015049 932094168 /nfs/dbraw/zinc/09/41/68/932094168.db2.gz CQIYSTXVOFSMAM-UHFFFAOYSA-N 0 0 359.426 3.723 20 5 FHBDRN C[C@@H](NC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F)c1cccc(Cl)c1 ZINC000581453020 932098971 /nfs/dbraw/zinc/09/89/71/932098971.db2.gz UMPRCQHTQQMPQQ-SECBINFHSA-N 0 0 354.740 3.946 20 5 FHBDRN CNc1ccc(C(=O)NC2(Cc3cccc(F)c3)CCC2)cc1[N+](=O)[O-] ZINC000548175386 932104536 /nfs/dbraw/zinc/10/45/36/932104536.db2.gz XIJLJPYGRCNBOV-UHFFFAOYSA-N 0 0 357.385 3.671 20 5 FHBDRN Cc1ccc([C@H]2CN(C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)CCO2)o1 ZINC000165797648 932123153 /nfs/dbraw/zinc/12/31/53/932123153.db2.gz GQUGRVPGDLGSPQ-OAHLLOKOSA-N 0 0 365.773 3.755 20 5 FHBDRN CO[C@@H](C)[C@H](C)NC(=O)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12 ZINC000276257195 932135539 /nfs/dbraw/zinc/13/55/39/932135539.db2.gz WDERPPWEFBIYAS-UWVGGRQHSA-N 0 0 360.360 3.525 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]c(CN3CCC(OCc4ccccc4)CC3)nc2c1 ZINC000548180455 932138126 /nfs/dbraw/zinc/13/81/26/932138126.db2.gz MUECDBLEFFWLDB-UHFFFAOYSA-N 0 0 366.421 3.652 20 5 FHBDRN CCCN(c1nnc(-c2ccc([N+](=O)[O-])cc2)n1C[C@H]1CCCO1)C(C)C ZINC000581498836 932170451 /nfs/dbraw/zinc/17/04/51/932170451.db2.gz LELBIPZTNCSNDW-QGZVFWFLSA-N 0 0 373.457 3.657 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CCCOc3ccccc32)c1 ZINC000581501325 932175028 /nfs/dbraw/zinc/17/50/28/932175028.db2.gz RTDVPBMYCOUYOE-INIZCTEOSA-N 0 0 356.378 3.637 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N1C[C@@H](C)C[C@H]1c1ccccc1 ZINC000561480803 932184367 /nfs/dbraw/zinc/18/43/67/932184367.db2.gz ORIHUXKAKDSXPA-KSSFIOAISA-N 0 0 369.421 3.896 20 5 FHBDRN CC1(C)[C@@H](NC(=O)c2ccc([N+](=O)[O-])s2)C[C@@H]1OCc1ccccc1 ZINC000471670882 932226287 /nfs/dbraw/zinc/22/62/87/932226287.db2.gz JHGFZUWGZGMSSK-GJZGRUSLSA-N 0 0 360.435 3.770 20 5 FHBDRN Cc1ccn(-c2ccccc2CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])n1 ZINC000157195121 932245191 /nfs/dbraw/zinc/24/51/91/932245191.db2.gz GALJDTAMSDDXEA-UHFFFAOYSA-N 0 0 370.796 3.672 20 5 FHBDRN CC[C@H](c1ccncc1)N(CC)C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000157227766 932263149 /nfs/dbraw/zinc/26/31/49/932263149.db2.gz QNPMNVGSAMTNKB-MRXNPFEDSA-N 0 0 358.354 3.511 20 5 FHBDRN C[C@H](CNc1cccnc1[N+](=O)[O-])Oc1ccccc1Br ZINC000610511337 932269385 /nfs/dbraw/zinc/26/93/85/932269385.db2.gz NSAMSTGYALYTON-SNVBAGLBSA-N 0 0 352.188 3.632 20 5 FHBDRN Cc1cc(C)cc(C(=O)OCC(=O)Nc2cc([N+](=O)[O-])ccc2Cl)c1 ZINC000003401920 932273766 /nfs/dbraw/zinc/27/37/66/932273766.db2.gz RGAQLSLHTIDBMJ-UHFFFAOYSA-N 0 0 362.769 3.661 20 5 FHBDRN Cc1cccc(NS(=O)(=O)CCc2ccccc2[N+](=O)[O-])c1Cl ZINC000157280391 932286220 /nfs/dbraw/zinc/28/62/20/932286220.db2.gz PMYRDIFVRVEUBT-UHFFFAOYSA-N 0 0 354.815 3.541 20 5 FHBDRN CCOc1cc(NC(=O)CC[C@H](C)SC)c([N+](=O)[O-])cc1OCC ZINC000538048516 932298627 /nfs/dbraw/zinc/29/86/27/932298627.db2.gz NXEWMQOQCHOUKC-NSHDSACASA-N 0 0 356.444 3.862 20 5 FHBDRN Cc1cnc(OCC(=O)N(Cc2ccccc2)[C@H](C)C2CC2)c([N+](=O)[O-])c1 ZINC000477114595 932339957 /nfs/dbraw/zinc/33/99/57/932339957.db2.gz LKHHDIXNKLHTNX-OAHLLOKOSA-N 0 0 369.421 3.504 20 5 FHBDRN CCc1cc(NC(=O)c2ccc(C)cc2F)c2cc([N+](=O)[O-])ccc2n1 ZINC001266776846 932360796 /nfs/dbraw/zinc/36/07/96/932360796.db2.gz IASHWXIYBWWVLV-UHFFFAOYSA-N 0 0 353.353 3.827 20 5 FHBDRN CCc1cc(NC(=O)[C@@H]2C[C@@H]3C[C@@H]3C[C@@H]2C)c2cc([N+](=O)[O-])ccc2n1 ZINC001266777456 932363706 /nfs/dbraw/zinc/36/37/06/932363706.db2.gz QORNWJBAZZBYAU-WFGGJUAMSA-N 0 0 353.422 3.748 20 5 FHBDRN Cc1c(NC(=O)N2CC[C@H]2C(F)F)cc([N+](=O)[O-])cc1C(F)(F)F ZINC000933344903 932376162 /nfs/dbraw/zinc/37/61/62/932376162.db2.gz JCBDACFUBSCIPF-JTQLQIEISA-N 0 0 353.247 3.793 20 5 FHBDRN CC1(C)[C@@H](C(F)(F)F)CCN1C(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000276421389 932381507 /nfs/dbraw/zinc/38/15/07/932381507.db2.gz ZLGIEAVRRKKMRE-ZDUSSCGKSA-N 0 0 360.332 3.553 20 5 FHBDRN Cc1ccc(C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)c(Br)n1 ZINC000157379254 932400674 /nfs/dbraw/zinc/40/06/74/932400674.db2.gz CUCWSROZHJWGBM-UHFFFAOYSA-N 0 0 350.172 3.621 20 5 FHBDRN Cc1ccc(NC(=O)c2ccc(F)cc2[N+](=O)[O-])cc1OCC(F)F ZINC000127215747 932408975 /nfs/dbraw/zinc/40/89/75/932408975.db2.gz QPYCHQMBTURSGZ-UHFFFAOYSA-N 0 0 354.284 3.939 20 5 FHBDRN Cc1c(Br)c(Sc2ccc(CO)cc2)ncc1[N+](=O)[O-] ZINC000165806662 932409355 /nfs/dbraw/zinc/40/93/55/932409355.db2.gz JBEHLVYKGKHHBW-UHFFFAOYSA-N 0 0 355.213 3.704 20 5 FHBDRN C[C@H](NC(=O)c1ccc([N+](=O)[O-])c(Cl)c1)c1noc(-c2ccccc2)n1 ZINC000160985363 932422410 /nfs/dbraw/zinc/42/24/10/932422410.db2.gz XOULOZSLCBVHNA-JTQLQIEISA-N 0 0 372.768 3.789 20 5 FHBDRN C[C@H](NC(=O)c1cc(F)cc([N+](=O)[O-])c1N)c1c(F)cccc1Cl ZINC000477248392 932432819 /nfs/dbraw/zinc/43/28/19/932432819.db2.gz KEXJRTOANXADNS-ZETCQYMHSA-N 0 0 355.728 3.600 20 5 FHBDRN C[C@H](NC(=O)CN(C)c1ccccc1[N+](=O)[O-])c1c(F)cccc1Cl ZINC000477259574 932435479 /nfs/dbraw/zinc/43/54/79/932435479.db2.gz NWEZCTZHERBRRA-NSHDSACASA-N 0 0 365.792 3.701 20 5 FHBDRN CC[C@@H](C)n1ncc(NC(=O)c2ccc([N+](=O)[O-])c(OC)c2)c1C1CC1 ZINC000477336349 932485018 /nfs/dbraw/zinc/48/50/18/932485018.db2.gz HAEGIIJIXSNTHV-LLVKDONJSA-N 0 0 358.398 3.901 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1nc2cccnc2n1CC ZINC000477361821 932502202 /nfs/dbraw/zinc/50/22/02/932502202.db2.gz SOGMAYUSDGYZFD-CQSZACIVSA-N 0 0 367.409 3.567 20 5 FHBDRN CC(C)c1ccc(NC(=O)NCCn2cc([N+](=O)[O-])cn2)c(C(C)C)c1 ZINC000178104498 932512419 /nfs/dbraw/zinc/51/24/19/932512419.db2.gz IMYDIHUEKQAALT-UHFFFAOYSA-N 0 0 359.430 3.860 20 5 FHBDRN O=[N+]([O-])c1cc2ccccc2nc1N1CCC(OC[C@@H]2CCCCO2)CC1 ZINC000276525756 932550411 /nfs/dbraw/zinc/55/04/11/932550411.db2.gz BLKWAAPWELAMHV-KRWDZBQOSA-N 0 0 371.437 3.698 20 5 FHBDRN O=C(N[C@H](c1cccc(Cl)c1)c1ccccn1)c1ccc([N+](=O)[O-])o1 ZINC000126799631 932559187 /nfs/dbraw/zinc/55/91/87/932559187.db2.gz PQPOGUZJUCENCB-MRXNPFEDSA-N 0 0 357.753 3.756 20 5 FHBDRN Cc1sc(S(=O)(=O)N([C@@H](C)c2ccccc2)C2CC2)cc1[N+](=O)[O-] ZINC000510458890 932581293 /nfs/dbraw/zinc/58/12/93/932581293.db2.gz RSZKIHQVYUWSEZ-NSHDSACASA-N 0 0 366.464 3.879 20 5 FHBDRN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N[C@@H](C)C[C@H](O)c1cccs1 ZINC000276542851 932613472 /nfs/dbraw/zinc/61/34/72/932613472.db2.gz GMHGRMLAKNSVSL-GWCFXTLKSA-N 0 0 368.842 3.860 20 5 FHBDRN CCc1ccc(C(=O)Nc2cccc(OCCCOC)c2)cc1[N+](=O)[O-] ZINC000430655759 932618231 /nfs/dbraw/zinc/61/82/31/932618231.db2.gz UZKLNYCOFVAUNB-UHFFFAOYSA-N 0 0 358.394 3.825 20 5 FHBDRN Cc1nnc(-c2ccccc2C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)o1 ZINC000127287274 932622491 /nfs/dbraw/zinc/62/24/91/932622491.db2.gz PWMZTGLBXJSSAL-LBPRGKRZSA-N 0 0 366.377 3.753 20 5 FHBDRN CCc1oc(CN(Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc1C(=O)OC ZINC000559069587 932622599 /nfs/dbraw/zinc/62/25/99/932622599.db2.gz QHQLTJLTIALDNZ-UHFFFAOYSA-N 0 0 360.410 3.947 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)NCCc2cn(C)c3cc(F)ccc23)c1 ZINC000471701307 932650161 /nfs/dbraw/zinc/65/01/61/932650161.db2.gz HBSOSBFJNCVFFZ-UHFFFAOYSA-N 0 0 355.369 3.507 20 5 FHBDRN O=C(Nc1c(-c2ccncc2)nc2ccccn21)c1csc([N+](=O)[O-])c1 ZINC000430657467 932656103 /nfs/dbraw/zinc/65/61/03/932656103.db2.gz HOOKRMTUHFNSOP-UHFFFAOYSA-N 0 0 365.374 3.618 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1Cc2cccc(Cl)c2C1 ZINC000561559425 932657649 /nfs/dbraw/zinc/65/76/49/932657649.db2.gz OQYKOLGCPNSYLK-UHFFFAOYSA-N 0 0 366.826 3.515 20 5 FHBDRN O=C(c1cccc([N+](=O)[O-])c1)N1CCc2cc(Br)cc(F)c21 ZINC000178149292 932677066 /nfs/dbraw/zinc/67/70/66/932677066.db2.gz NBJWHIBKPGGMIO-UHFFFAOYSA-N 0 0 365.158 3.699 20 5 FHBDRN CCCc1[nH]nc(C(=O)Nc2cnn([C@H](C)CC)c2C2CC2)c1[N+](=O)[O-] ZINC000477538558 932677229 /nfs/dbraw/zinc/67/72/29/932677229.db2.gz FMANEQXNPIWINX-SNVBAGLBSA-N 0 0 360.418 3.568 20 5 FHBDRN CCOc1ccc([C@@H]2CCCN2C(=O)c2cccc([N+](=O)[O-])c2N)cc1 ZINC000178153639 932701539 /nfs/dbraw/zinc/70/15/39/932701539.db2.gz ULTHHQCYQGOYTG-INIZCTEOSA-N 0 0 355.394 3.553 20 5 FHBDRN C[C@@H]1C[C@H](C(C)(C)C)CCN1S(=O)(=O)Cc1ccccc1[N+](=O)[O-] ZINC000561563656 932701645 /nfs/dbraw/zinc/70/16/45/932701645.db2.gz PJPXJTSLMXXHPG-UKRRQHHQSA-N 0 0 354.472 3.571 20 5 FHBDRN Cc1nn(Cc2ccccc2)c(C)c1CNc1nc(C)ccc1[N+](=O)[O-] ZINC000178154520 932702393 /nfs/dbraw/zinc/70/23/93/932702393.db2.gz ZUCUPHHRYXVIOO-UHFFFAOYSA-N 0 0 351.410 3.772 20 5 FHBDRN CSc1nc(C(F)F)cc(N2CCc3c(cccc3[N+](=O)[O-])C2)n1 ZINC000581834856 932712150 /nfs/dbraw/zinc/71/21/50/932712150.db2.gz BXCFWGSTULDNKV-UHFFFAOYSA-N 0 0 352.366 3.607 20 5 FHBDRN COc1cc(NCCOc2ccc(C(F)(F)F)cn2)ccc1[N+](=O)[O-] ZINC000471727568 932724409 /nfs/dbraw/zinc/72/44/09/932724409.db2.gz QJDUZGVSNVFXSS-UHFFFAOYSA-N 0 0 357.288 3.508 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cn1)N1C[C@H](c2ccccc2)[C@H]2CCCC[C@H]21 ZINC000548254605 932735905 /nfs/dbraw/zinc/73/59/05/932735905.db2.gz KFRKUGIZMDVNEB-ZHALLVOQSA-N 0 0 351.406 3.788 20 5 FHBDRN Cc1cc2c(cc1C)[C@H](C(=O)N1c3ccc([N+](=O)[O-])cc3C[C@H]1C)CO2 ZINC000471734393 932737363 /nfs/dbraw/zinc/73/73/63/932737363.db2.gz FTVMHLNALHHHPR-CXAGYDPISA-N 0 0 352.390 3.665 20 5 FHBDRN Cc1ccoc1CN(C)C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000561582175 932738107 /nfs/dbraw/zinc/73/81/07/932738107.db2.gz FPRQYPRWBCEWAM-UHFFFAOYSA-N 0 0 353.172 3.531 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)Nc1cccc(C(C)C)c1 ZINC000581854833 932750359 /nfs/dbraw/zinc/75/03/59/932750359.db2.gz UWXBOQOEJVBQFS-UHFFFAOYSA-N 0 0 355.394 3.858 20 5 FHBDRN CCn1ccnc1[C@H]1OCCC[C@@H]1Nc1nc2ccccc2cc1[N+](=O)[O-] ZINC000276587273 932751187 /nfs/dbraw/zinc/75/11/87/932751187.db2.gz JCGKNXWNAUETIU-RDJZCZTQSA-N 0 0 367.409 3.692 20 5 FHBDRN Cc1c(C(=O)OCC(=O)Nc2ccc(C(C)C)cc2)cccc1[N+](=O)[O-] ZINC000003444507 932760224 /nfs/dbraw/zinc/76/02/24/932760224.db2.gz PXPDWXFGQUTMNK-UHFFFAOYSA-N 0 0 356.378 3.822 20 5 FHBDRN COc1cnccc1[C@H](C)NC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000187438656 932771257 /nfs/dbraw/zinc/77/12/57/932771257.db2.gz IDRBJAVJWJFQLF-VIFPVBQESA-N 0 0 350.762 3.535 20 5 FHBDRN Cc1c(Br)cc(C(=O)N2C[C@H](C)CC2(C)C)cc1[N+](=O)[O-] ZINC000510474325 932846679 /nfs/dbraw/zinc/84/66/79/932846679.db2.gz LXEIJHWRLIQXLY-SECBINFHSA-N 0 0 355.232 3.926 20 5 FHBDRN CCOc1ccccc1CNC(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000175957396 932850611 /nfs/dbraw/zinc/85/06/11/932850611.db2.gz MQPJMZTTZVCNCF-CQSZACIVSA-N 0 0 357.410 3.862 20 5 FHBDRN Cc1ccccc1[C@@H]1CCN(C(=O)NCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000510478558 932859342 /nfs/dbraw/zinc/85/93/42/932859342.db2.gz WHAWEMJUWJRGQP-QGZVFWFLSA-N 0 0 353.422 3.645 20 5 FHBDRN Cc1cc(OCC(=O)N2c3ccccc3N(C)CC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000430677224 932860553 /nfs/dbraw/zinc/86/05/53/932860553.db2.gz JEBADMWGNQFTQP-HNNXBMFYSA-N 0 0 369.421 3.544 20 5 FHBDRN CC(C)c1ccc(NC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)cc1 ZINC000109983495 932866471 /nfs/dbraw/zinc/86/64/71/932866471.db2.gz MKAVOQRHEFPOSA-UHFFFAOYSA-N 0 0 351.362 3.812 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(N2CCO[C@H](c3ccc(F)c(Cl)c3)C2)n1 ZINC000178208686 932880594 /nfs/dbraw/zinc/88/05/94/932880594.db2.gz WEEURIJSLQRQFD-HNNXBMFYSA-N 0 0 351.765 3.669 20 5 FHBDRN Cc1c(NC(=O)[C@H](C)Nc2cnn([C@@H](C)C3CC3)c2)cccc1[N+](=O)[O-] ZINC000187475432 932910048 /nfs/dbraw/zinc/91/00/48/932910048.db2.gz XSUYPGPCAMMCBB-STQMWFEESA-N 0 0 357.414 3.510 20 5 FHBDRN Cc1ccc(S(=O)(=O)N2CCC[C@@H]2c2cccc(F)c2)c([N+](=O)[O-])c1 ZINC000101573526 932928365 /nfs/dbraw/zinc/92/83/65/932928365.db2.gz PWTMAGMWBHPZDN-OAHLLOKOSA-N 0 0 364.398 3.568 20 5 FHBDRN COc1cnccc1[C@H](C)NC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000187487964 932948186 /nfs/dbraw/zinc/94/81/86/932948186.db2.gz NBUCGKCNPHFPOK-AWEZNQCLSA-N 0 0 372.425 3.680 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)Nc1nnc(-c2ccccn2)s1 ZINC000588437265 932963761 /nfs/dbraw/zinc/96/37/61/932963761.db2.gz MFKMPAVRBDKULK-KHPPLWFESA-N 0 0 367.390 3.550 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc(C(=O)N(C)C)ccc1C ZINC000588436960 932965337 /nfs/dbraw/zinc/96/53/37/932965337.db2.gz HWFCHXKTFFJUJP-KAMYIIQDSA-N 0 0 367.405 3.647 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cn1)C(=O)c1ccc(OC(F)F)cc1 ZINC000610946334 932983658 /nfs/dbraw/zinc/98/36/58/932983658.db2.gz UPCFXMUTFSDPTA-SECBINFHSA-N 0 0 354.334 3.955 20 5 FHBDRN COCC(C)(C)N(Cc1ccccc1)C(=O)c1ccc(OC)c([N+](=O)[O-])c1 ZINC000187536063 932997962 /nfs/dbraw/zinc/99/79/62/932997962.db2.gz ORMFBLKVQXLJAK-UHFFFAOYSA-N 0 0 372.421 3.671 20 5 FHBDRN CS(=O)(=O)c1cc(SCc2cc(F)cc(F)c2)ccc1[N+](=O)[O-] ZINC000187547417 933000836 /nfs/dbraw/zinc/00/08/36/933000836.db2.gz RMQAGXZAKNLYCN-UHFFFAOYSA-N 0 0 359.375 3.569 20 5 FHBDRN O=C(CSCC(=O)c1ccc(Cl)cc1)Nc1ccc([N+](=O)[O-])cc1 ZINC000187547029 933000987 /nfs/dbraw/zinc/00/09/87/933000987.db2.gz FBQWFSJXLXXBGM-UHFFFAOYSA-N 0 0 364.810 3.803 20 5 FHBDRN COc1ccc(-c2nc(-c3ccc(Br)o3)no2)cc1[N+](=O)[O-] ZINC000178269918 933003954 /nfs/dbraw/zinc/00/39/54/933003954.db2.gz AGWUKCLFVPIRMX-UHFFFAOYSA-N 0 0 366.127 3.676 20 5 FHBDRN C[C@H](N[C@@H](C)c1ncnn1C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000276709302 933009754 /nfs/dbraw/zinc/00/97/54/933009754.db2.gz WMILFGDCMQDGFB-RYUDHWBXSA-N 0 0 357.439 3.864 20 5 FHBDRN C[C@H](C1CC1)n1cc(N[C@@H](C)CC(=O)Nc2cccc([N+](=O)[O-])c2)cn1 ZINC000187621921 933066857 /nfs/dbraw/zinc/06/68/57/933066857.db2.gz NHYHZPVFKVLVIA-QWHCGFSZSA-N 0 0 357.414 3.592 20 5 FHBDRN COCCN(Cc1ccc(C)o1)C(=O)/C(C)=C\c1ccc([N+](=O)[O-])cc1 ZINC000588440284 933068041 /nfs/dbraw/zinc/06/80/41/933068041.db2.gz UPIZSIWEHXDKCP-OWBHPGMISA-N 0 0 358.394 3.575 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)NCc1cccc(N2CC=CC2)c1 ZINC000588440738 933071383 /nfs/dbraw/zinc/07/13/83/933071383.db2.gz FKVAETYGMNFFHE-SSZFMOIBSA-N 0 0 363.417 3.691 20 5 FHBDRN COc1cccc2c1CCN(C(=O)/C(C)=C\c1ccc([N+](=O)[O-])cc1)C2 ZINC000588441747 933074242 /nfs/dbraw/zinc/07/42/42/933074242.db2.gz ODRGHQTVPQKAHU-OWBHPGMISA-N 0 0 352.390 3.592 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N1CCO[C@@H](c2ccccc2)C1 ZINC000588443867 933085885 /nfs/dbraw/zinc/08/58/85/933085885.db2.gz OKINDVHYVUBEIG-RXHHAWBHSA-N 0 0 352.390 3.598 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@H](Nc2ccccc2)C1 ZINC000588445323 933112466 /nfs/dbraw/zinc/11/24/66/933112466.db2.gz XSCCDTWILHXXSU-OJSRQPNCSA-N 0 0 351.406 3.711 20 5 FHBDRN CC(C)(CNC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1)C(F)(F)F ZINC000581956710 933114687 /nfs/dbraw/zinc/11/46/87/933114687.db2.gz ZDDRFUNKHVNIFQ-UHFFFAOYSA-N 0 0 359.348 3.857 20 5 FHBDRN COC(=O)[C@H]1CCC[C@@H](C(=O)N(c2cccc([N+](=O)[O-])c2)C2CCCC2)C1 ZINC000610570945 933125357 /nfs/dbraw/zinc/12/53/57/933125357.db2.gz QITKXODBJRNKKU-CABCVRRESA-N 0 0 374.437 3.850 20 5 FHBDRN COC(=O)[C@@H]1CCC[C@H](C(=O)N(c2cccc([N+](=O)[O-])c2)C2CCCC2)C1 ZINC000610570948 933125384 /nfs/dbraw/zinc/12/53/84/933125384.db2.gz QITKXODBJRNKKU-LSDHHAIUSA-N 0 0 374.437 3.850 20 5 FHBDRN C[C@H]1CC[C@H](c2ccccc2)N(S(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000510507607 933164205 /nfs/dbraw/zinc/16/42/05/933164205.db2.gz IHPHPXGXSRLPLF-HNAYVOBHSA-N 0 0 374.462 3.898 20 5 FHBDRN Cc1cc(OCC(=O)N2CC[C@H](C)C[C@H]2c2ccco2)ccc1[N+](=O)[O-] ZINC000430711678 933165010 /nfs/dbraw/zinc/16/50/10/933165010.db2.gz AZZZCTJJPCSMJZ-GUYCJALGSA-N 0 0 358.394 3.875 20 5 FHBDRN CC[C@H](C)n1ncc(Nc2ncc(Br)cc2[N+](=O)[O-])c1C ZINC000477690978 933169626 /nfs/dbraw/zinc/16/96/26/933169626.db2.gz GMBPLSXSJVPTIZ-QMMMGPOBSA-N 0 0 354.208 3.972 20 5 FHBDRN Cc1cc(OCC(=O)N2CCC[C@H]2/C=C\c2ccccc2)ccc1[N+](=O)[O-] ZINC000430786307 933230681 /nfs/dbraw/zinc/23/06/81/933230681.db2.gz PFLMAWRHEINFQT-LPADLIQXSA-N 0 0 366.417 3.986 20 5 FHBDRN C[C@H]1CCCC[C@H]1CCNC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000510576008 933240941 /nfs/dbraw/zinc/24/09/41/933240941.db2.gz UTUMJZTZJJGEAQ-GJZGRUSLSA-N 0 0 356.426 3.727 20 5 FHBDRN C[C@@H]1CCCC[C@@H]1CCNC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000510576009 933241288 /nfs/dbraw/zinc/24/12/88/933241288.db2.gz UTUMJZTZJJGEAQ-HUUCEWRRSA-N 0 0 356.426 3.727 20 5 FHBDRN CCO[C@@H]1C[C@H](N(C)C(=O)c2ccc(SC)c([N+](=O)[O-])c2)C1(C)C ZINC000127356765 933250383 /nfs/dbraw/zinc/25/03/83/933250383.db2.gz HMCYTRHMSUULGF-LSDHHAIUSA-N 0 0 352.456 3.592 20 5 FHBDRN Cc1cc(OCC(=O)N(c2ccccn2)C2CCCC2)ccc1[N+](=O)[O-] ZINC000430813463 933256445 /nfs/dbraw/zinc/25/64/45/933256445.db2.gz IIUDDNMXDHLHBX-UHFFFAOYSA-N 0 0 355.394 3.653 20 5 FHBDRN C[C@H](C(=O)NCc1c(F)cc(F)c(F)c1F)c1ccc([N+](=O)[O-])cc1F ZINC000430811326 933262056 /nfs/dbraw/zinc/26/20/56/933262056.db2.gz PEEHIPQBPXLXTJ-ZETCQYMHSA-N 0 0 374.265 3.710 20 5 FHBDRN COc1ccc2c(c1)N(C(=O)COc1ccc([N+](=O)[O-])c(C)c1)CCCC2 ZINC000430830071 933276035 /nfs/dbraw/zinc/27/60/35/933276035.db2.gz KLLRMOSFQWNERF-UHFFFAOYSA-N 0 0 370.405 3.660 20 5 FHBDRN CC[C@H]1Cc2ccccc2CN1C(=O)COc1ccc([N+](=O)[O-])c(C)c1 ZINC000430830574 933280755 /nfs/dbraw/zinc/28/07/55/933280755.db2.gz ORFFATYJXVWMTE-KRWDZBQOSA-N 0 0 354.406 3.646 20 5 FHBDRN C[C@@H]1CCCC[C@H]1CCNC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000510611047 933282811 /nfs/dbraw/zinc/28/28/11/933282811.db2.gz MQEYMRCQVDTACM-CABCVRRESA-N 0 0 370.453 3.942 20 5 FHBDRN C[C@H]1CO[C@@H](c2ccccc2)CN1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610581371 933318475 /nfs/dbraw/zinc/31/84/75/933318475.db2.gz LNHNYIXWXDRVJY-SCLBCKFNSA-N 0 0 353.378 3.698 20 5 FHBDRN CCc1csc(NC(=O)c2ccc(Br)cc2[N+](=O)[O-])n1 ZINC000430914275 933400339 /nfs/dbraw/zinc/40/03/39/933400339.db2.gz IWAVTRRHCFIWAR-UHFFFAOYSA-N 0 0 356.201 3.629 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(N2C[C@H](C(F)(F)F)[C@H](C(F)(F)F)C2)c1 ZINC000610587575 933432369 /nfs/dbraw/zinc/43/23/69/933432369.db2.gz JLNUYFOPVPKHOO-DTORHVGOSA-N 0 0 358.238 3.780 20 5 FHBDRN CCOc1ccc([C@H]2CCCN2C(=O)c2cc([N+](=O)[O-])cnc2C)cc1 ZINC000178343025 933433546 /nfs/dbraw/zinc/43/35/46/933433546.db2.gz ASKFHHIZYSXCSW-GOSISDBHSA-N 0 0 355.394 3.674 20 5 FHBDRN CN(CCCNc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2)c1ccccc1F ZINC000510697694 933449872 /nfs/dbraw/zinc/44/98/72/933449872.db2.gz ITBHWIVHMUQCJN-UHFFFAOYSA-N 0 0 372.400 3.557 20 5 FHBDRN CCn1ccnc1[C@@H]1CCCCN1C(=O)NCc1cccc([N+](=O)[O-])c1C ZINC000430947059 933464442 /nfs/dbraw/zinc/46/44/42/933464442.db2.gz CSQONMKFTJEAJD-KRWDZBQOSA-N 0 0 371.441 3.556 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)NC[C@@H]2OCCc3ccccc32)cc1[N+](=O)[O-] ZINC000610597069 933482959 /nfs/dbraw/zinc/48/29/59/933482959.db2.gz VAHVOZPZLSYVEN-KUHUBIRLSA-N 0 0 369.421 3.577 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)C[C@@H](C)C(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000610599101 933492509 /nfs/dbraw/zinc/49/25/09/933492509.db2.gz RGJITJHQIFDEOM-CABCVRRESA-N 0 0 354.406 3.990 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)C[C@H](C)C(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000610599104 933492708 /nfs/dbraw/zinc/49/27/08/933492708.db2.gz RGJITJHQIFDEOM-LSDHHAIUSA-N 0 0 354.406 3.990 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N1C[C@H](C(F)(F)F)[C@H](C(F)(F)F)C1 ZINC000610598055 933497105 /nfs/dbraw/zinc/49/71/05/933497105.db2.gz QFBSUHIVBCCEAY-PHIMTYICSA-N 0 0 370.249 3.716 20 5 FHBDRN O=[N+]([O-])c1ccc(OCCN2C[C@@H](C(F)(F)F)[C@H](C(F)(F)F)C2)cc1 ZINC000610604774 933514276 /nfs/dbraw/zinc/51/42/76/933514276.db2.gz LELSYDIMOQEQOW-VXGBXAGGSA-N 0 0 372.265 3.646 20 5 FHBDRN Cc1ccc(NC(=O)NCc2c(F)cc(F)c(F)c2F)cc1[N+](=O)[O-] ZINC000430971855 933529240 /nfs/dbraw/zinc/52/92/40/933529240.db2.gz MZARLCJTCPGNPC-UHFFFAOYSA-N 0 0 357.263 3.781 20 5 FHBDRN CC(C)(C)OCc1ccc(NC(=O)COc2ccccc2[N+](=O)[O-])cc1 ZINC000610624620 933544986 /nfs/dbraw/zinc/54/49/86/933544986.db2.gz MUHDCASFARUOOV-UHFFFAOYSA-N 0 0 358.394 3.927 20 5 FHBDRN O=C(NCCc1ccccc1[N+](=O)[O-])C1(Cc2ccc(Cl)cc2)CC1 ZINC000548418130 933569094 /nfs/dbraw/zinc/56/90/94/933569094.db2.gz YJGRIIYTCXRCEC-UHFFFAOYSA-N 0 0 358.825 3.930 20 5 FHBDRN O=C(Nc1ccccc1NCc1ccc(Cl)cc1)c1c[nH]nc1[N+](=O)[O-] ZINC000548417699 933573295 /nfs/dbraw/zinc/57/32/95/933573295.db2.gz AJHCUUIYNHAZGQ-UHFFFAOYSA-N 0 0 371.784 3.836 20 5 FHBDRN CC(C)(NC(=O)N[C@@H]1C[C@]1(C)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000610643673 933584321 /nfs/dbraw/zinc/58/43/21/933584321.db2.gz VRZYABLUWXKSNP-YLJYHZDGSA-N 0 0 353.422 3.859 20 5 FHBDRN Cc1[nH]c2ccc(CNC(=O)NCCc3ccccc3[N+](=O)[O-])cc2c1C ZINC000548423165 933595580 /nfs/dbraw/zinc/59/55/80/933595580.db2.gz QVRGHRZFMGTHPT-UHFFFAOYSA-N 0 0 366.421 3.735 20 5 FHBDRN COc1cc(C(=O)Nc2nc3c(s2)C[C@@H](C)CC3)cc([N+](=O)[O-])c1C ZINC000477817413 933622659 /nfs/dbraw/zinc/62/26/59/933622659.db2.gz LJQCUSXIGQLKTN-VIFPVBQESA-N 0 0 361.423 3.745 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@H](C)c1ccc(NC(=O)C2CC2)cc1 ZINC000510754084 933636134 /nfs/dbraw/zinc/63/61/34/933636134.db2.gz NEGLOXDKHWQBMR-CYBMUJFWSA-N 0 0 367.405 3.743 20 5 FHBDRN CC(C)c1ccc(C(=O)Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000158027381 933636226 /nfs/dbraw/zinc/63/62/26/933636226.db2.gz NHWUCTKSASBPDD-UHFFFAOYSA-N 0 0 350.378 3.860 20 5 FHBDRN Cc1cc(C(=O)COc2c(C)cc(Br)cc2[N+](=O)[O-])c(C)[nH]1 ZINC000610654544 933650753 /nfs/dbraw/zinc/65/07/53/933650753.db2.gz CBAMCRMPWROPCX-UHFFFAOYSA-N 0 0 367.199 3.872 20 5 FHBDRN CCc1ccc(C(=O)N[C@@H]2CCCN(c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000471910205 933661231 /nfs/dbraw/zinc/66/12/31/933661231.db2.gz HPPCHHCMOVBJJX-QGZVFWFLSA-N 0 0 353.422 3.556 20 5 FHBDRN Cc1cccc(CC2CN(C(=O)CCCNc3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000610659826 933671896 /nfs/dbraw/zinc/67/18/96/933671896.db2.gz ZSGHYQFBYANYHM-UHFFFAOYSA-N 0 0 367.449 3.796 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)N1CCCO[C@H](c2ccccc2)C1 ZINC000610667055 933693368 /nfs/dbraw/zinc/69/33/68/933693368.db2.gz UXUYPTRJDTVYLH-IBGZPJMESA-N 0 0 354.406 3.518 20 5 FHBDRN CN(C[C@@H](O)C1CC1)C(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000610670000 933710549 /nfs/dbraw/zinc/71/05/49/933710549.db2.gz STSSQJDFMSQIEY-QGZVFWFLSA-N 0 0 372.446 3.589 20 5 FHBDRN O=[N+]([O-])c1cc(F)c(CN[C@H]2CCO[C@H]2c2ccc(F)c(F)c2)c(F)c1 ZINC000510793445 933731241 /nfs/dbraw/zinc/73/12/41/933731241.db2.gz AFILTMRZAAMPKZ-IRXDYDNUSA-N 0 0 370.302 3.771 20 5 FHBDRN O=C(N[C@@H]1CCCN(c2ccsc2[N+](=O)[O-])C1)c1cc2ccccc2o1 ZINC000610678323 933759817 /nfs/dbraw/zinc/75/98/17/933759817.db2.gz XVZMJSMLCOUPPR-CYBMUJFWSA-N 0 0 371.418 3.801 20 5 FHBDRN CCCOc1ccc([C@H](C)NC(=O)COc2ccc([N+](=O)[O-])c(C)c2)cc1 ZINC000510818326 933805646 /nfs/dbraw/zinc/80/56/46/933805646.db2.gz XXIHLWYBXLRPHM-HNNXBMFYSA-N 0 0 372.421 3.948 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)NCCCOC1CCCCC1 ZINC000510823780 933815316 /nfs/dbraw/zinc/81/53/16/933815316.db2.gz GHRWDNNQSGNPJB-UHFFFAOYSA-N 0 0 363.458 3.518 20 5 FHBDRN O=C(NCc1ccccc1[N+](=O)[O-])N1CC[C@H](C(F)(F)F)C2(CCC2)C1 ZINC000510830677 933823183 /nfs/dbraw/zinc/82/31/83/933823183.db2.gz AJCJWXKCKRQMDS-AWEZNQCLSA-N 0 0 371.359 3.859 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)NC[C@H]1CCCc2ccccc21 ZINC000510842069 933843885 /nfs/dbraw/zinc/84/38/85/933843885.db2.gz IYTRGUGHFIJLJX-GOSISDBHSA-N 0 0 367.449 3.899 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)O[C@@H](C)c1nc2cc(Cl)ccc2n1C ZINC000176043942 933854837 /nfs/dbraw/zinc/85/48/37/933854837.db2.gz IONOKSLUDJMGCZ-JTQLQIEISA-N 0 0 374.784 3.756 20 5 FHBDRN O=C(NCc1ccnc(Oc2ccccc2)c1)c1ccc(F)cc1[N+](=O)[O-] ZINC000610706119 933856218 /nfs/dbraw/zinc/85/62/18/933856218.db2.gz PIKHNMXLCOXKQQ-UHFFFAOYSA-N 0 0 367.336 3.851 20 5 FHBDRN Cc1ccc(Oc2ccc(NC(=O)c3ccc(F)cc3[N+](=O)[O-])cc2)nn1 ZINC000610707308 933859159 /nfs/dbraw/zinc/85/91/59/933859159.db2.gz PSTNBLLBVVYUQS-UHFFFAOYSA-N 0 0 368.324 3.877 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N2CC(C)(C)c3ccccc32)cc1OC ZINC000610709187 933876160 /nfs/dbraw/zinc/87/61/60/933876160.db2.gz WPRNVVAAZXYQSU-UHFFFAOYSA-N 0 0 370.405 3.940 20 5 FHBDRN O=[N+]([O-])c1ccccc1CSc1nnc(-c2cccnc2)n1C1CC1 ZINC000043868861 933890219 /nfs/dbraw/zinc/89/02/19/933890219.db2.gz RGYBPNFIDYAELW-UHFFFAOYSA-N 0 0 353.407 3.876 20 5 FHBDRN CC(C)(CNC(=O)Cc1ccc([N+](=O)[O-])cc1Cl)[C@H]1CCCCO1 ZINC000610719664 933938247 /nfs/dbraw/zinc/93/82/47/933938247.db2.gz JZWDKUNKMVYKON-OAHLLOKOSA-N 0 0 354.834 3.502 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCC(C)(C)[C@H]1CCCCO1 ZINC000610718810 933945195 /nfs/dbraw/zinc/94/51/95/933945195.db2.gz MYPDPCNOSPLDJL-CZUORRHYSA-N 0 0 366.483 3.787 20 5 FHBDRN CCc1ccc(C(=O)NCc2cccc(OCC(F)F)c2)cc1[N+](=O)[O-] ZINC000471937111 933945456 /nfs/dbraw/zinc/94/54/56/933945456.db2.gz OOHNOGZZFRSKQO-UHFFFAOYSA-N 0 0 364.348 3.731 20 5 FHBDRN O=C(COc1cccc([N+](=O)[O-])c1)N[C@@H]1C[C@H]1c1cccc2ccccc21 ZINC000431160144 933964140 /nfs/dbraw/zinc/96/41/40/933964140.db2.gz KLCUFDFKTWIOCC-VQTJNVASSA-N 0 0 362.385 3.799 20 5 FHBDRN C[C@@H](c1nc(-c2cccc([N+](=O)[O-])c2)no1)[C@H](C)NC(=O)OC(C)(C)C ZINC000276923738 934008380 /nfs/dbraw/zinc/00/83/80/934008380.db2.gz POMSLZGGSPTTNP-MNOVXSKESA-N 0 0 362.386 3.662 20 5 FHBDRN Cc1ccc(C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2C)c(C)n1 ZINC000431177816 934013715 /nfs/dbraw/zinc/01/37/15/934013715.db2.gz GWBWPVFQUDERKP-UHFFFAOYSA-N 0 0 364.199 3.930 20 5 FHBDRN Cc1cccc(OC[C@@H](C)NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)c1 ZINC000065116421 934028445 /nfs/dbraw/zinc/02/84/45/934028445.db2.gz IWYRAAKUMBFNEC-CQSZACIVSA-N 0 0 369.421 3.675 20 5 FHBDRN CC[C@H](C)[C@@H](OC)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC000431182707 934055332 /nfs/dbraw/zinc/05/53/32/934055332.db2.gz VPCGYSPMZKBZIP-ISVAXAHUSA-N 0 0 359.220 3.665 20 5 FHBDRN Cc1c(NC(=O)CC[C@H]2CCCCO2)cc(Br)cc1[N+](=O)[O-] ZINC000431183948 934060943 /nfs/dbraw/zinc/06/09/43/934060943.db2.gz RDRZBTPMDYNGSB-GFCCVEGCSA-N 0 0 371.231 3.954 20 5 FHBDRN C[C@@H](Cc1nc2ccccc2s1)NC(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000176100743 934080058 /nfs/dbraw/zinc/08/00/58/934080058.db2.gz UGDWPIMCLYCVIG-ZDUSSCGKSA-N 0 0 369.446 3.885 20 5 FHBDRN COc1ccc(CNCc2cc(Br)ccc2F)cc1[N+](=O)[O-] ZINC000132680572 934081254 /nfs/dbraw/zinc/08/12/54/934081254.db2.gz TVMNLKKNWGMROB-UHFFFAOYSA-N 0 0 369.190 3.795 20 5 FHBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)N1CC(CC(F)(F)F)C1 ZINC000610750849 934083983 /nfs/dbraw/zinc/08/39/83/934083983.db2.gz INSSPWJGZWVBCU-UHFFFAOYSA-N 0 0 359.348 3.511 20 5 FHBDRN CN(Cc1ccc([S@](C)=O)cc1)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000178437081 934143339 /nfs/dbraw/zinc/14/33/39/934143339.db2.gz PUMBWSIQYULLEU-QHCPKHFHSA-N 0 0 352.843 3.618 20 5 FHBDRN COC(=O)c1cc(N[C@@H]2CCOc3c(OC)cccc32)cc(C)c1[N+](=O)[O-] ZINC000610769854 934145687 /nfs/dbraw/zinc/14/56/87/934145687.db2.gz KGLBUCPSGNKKIY-OAHLLOKOSA-N 0 0 372.377 3.634 20 5 FHBDRN O=C1[C@@H](Nc2cccc([N+](=O)[O-])c2)CCN1c1ccccc1C(F)(F)F ZINC000471969689 934147827 /nfs/dbraw/zinc/14/78/27/934147827.db2.gz JUQCWHKKNMALBK-AWEZNQCLSA-N 0 0 365.311 3.831 20 5 FHBDRN O=C(Nc1cc(Br)c(F)cc1Cl)c1ccc([N+](=O)[O-])cn1 ZINC000610774694 934155930 /nfs/dbraw/zinc/15/59/30/934155930.db2.gz WJCZYJLGERLPAR-UHFFFAOYSA-N 0 0 374.553 3.797 20 5 FHBDRN CN(Cc1cccs1)C(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000754975500 934211795 /nfs/dbraw/zinc/21/17/95/934211795.db2.gz XVDXGXHYZRAGLA-UHFFFAOYSA-N 0 0 373.203 3.830 20 5 FHBDRN C[C@@H](CNC(=O)Cc1ccc([N+](=O)[O-])cc1F)Oc1ccc(Cl)cc1 ZINC000158046674 934216373 /nfs/dbraw/zinc/21/63/73/934216373.db2.gz HGUAETWOJFFIJH-NSHDSACASA-N 0 0 366.776 3.514 20 5 FHBDRN CN(CCCOc1ccc(F)cc1)C(=O)c1c[nH]c2cccc([N+](=O)[O-])c21 ZINC000535672585 934265645 /nfs/dbraw/zinc/26/56/45/934265645.db2.gz UVEWZZQGJRHLRP-UHFFFAOYSA-N 0 0 371.368 3.756 20 5 FHBDRN O=[N+]([O-])c1ccc(NS(=O)(=O)/C=C\c2ccc(F)cc2)c2cccnc21 ZINC000588467844 934271298 /nfs/dbraw/zinc/27/12/98/934271298.db2.gz PSXLJINEDJVSQJ-LUAWRHEFSA-N 0 0 373.365 3.695 20 5 FHBDRN O=[N+]([O-])c1cccc(CN2CCCC[C@H]2c2nnc(C3CCOCC3)o2)c1 ZINC000276982026 934276524 /nfs/dbraw/zinc/27/65/24/934276524.db2.gz RKUKGJZCOWJHSC-KRWDZBQOSA-N 0 0 372.425 3.599 20 5 FHBDRN C[C@@H]1CN(C(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)[C@@H](c2ccccc2)CO1 ZINC000535705667 934287437 /nfs/dbraw/zinc/28/74/37/934287437.db2.gz XQXALSFSDWXBGD-FZKQIMNGSA-N 0 0 365.389 3.678 20 5 FHBDRN COc1ccccc1C[C@H](C)N(C)C(=O)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000535694885 934288522 /nfs/dbraw/zinc/28/85/22/934288522.db2.gz KFHKCXROIFWHGA-ZDUSSCGKSA-N 0 0 367.405 3.788 20 5 FHBDRN O=C(N[C@H](c1ccccc1)c1ccccn1)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000535696596 934289721 /nfs/dbraw/zinc/28/97/21/934289721.db2.gz PIDDJKPJBIYXID-HXUWFJFHSA-N 0 0 372.384 3.991 20 5 FHBDRN O=C(NCCCCOc1ccc(F)cc1)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000535696520 934289957 /nfs/dbraw/zinc/28/99/57/934289957.db2.gz OJUWFSPPXCZBSO-UHFFFAOYSA-N 0 0 371.368 3.804 20 5 FHBDRN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])N1CC(C2CCCC2)C1 ZINC000477919584 934292213 /nfs/dbraw/zinc/29/22/13/934292213.db2.gz SILCLFLHSPASDL-UHFFFAOYSA-N 0 0 354.859 3.989 20 5 FHBDRN CC[C@@H](C)n1ncc(N[C@H](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2)c1C ZINC000477918500 934294042 /nfs/dbraw/zinc/29/40/42/934294042.db2.gz JGGPNGKRIMDIPJ-CHWSQXEVSA-N 0 0 359.430 3.900 20 5 FHBDRN Nc1c(C(=O)Nc2ccc(Oc3ccccc3)nc2)cccc1[N+](=O)[O-] ZINC000176135825 934306563 /nfs/dbraw/zinc/30/65/63/934306563.db2.gz SZLPFHXPMMQMLC-UHFFFAOYSA-N 0 0 350.334 3.617 20 5 FHBDRN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N(C)C1CCOCC1 ZINC000535723040 934309938 /nfs/dbraw/zinc/30/99/38/934309938.db2.gz ONVRCUUMDJMDSP-UHFFFAOYSA-N 0 0 352.456 3.594 20 5 FHBDRN CCN(C(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])[C@H](C)C(F)(F)F ZINC000477940963 934311448 /nfs/dbraw/zinc/31/14/48/934311448.db2.gz DMWHXGTVJCTULF-DTWKUNHWSA-N 0 0 368.739 3.815 20 5 FHBDRN CCC[C@@]1(C(F)(F)F)CCCN1C(=O)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000535752556 934329842 /nfs/dbraw/zinc/32/98/42/934329842.db2.gz ZPDWHZGXGYJYGG-INIZCTEOSA-N 0 0 374.359 3.870 20 5 FHBDRN O=C(NC1CCC(C(F)F)CC1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000458188718 934362975 /nfs/dbraw/zinc/36/29/75/934362975.db2.gz ZRMHDQLATQJOLH-UHFFFAOYSA-N 0 0 364.295 3.750 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N2[C@H](C)Cc3cc(F)ccc3[C@H]2C)c1 ZINC000535804012 934409703 /nfs/dbraw/zinc/40/97/03/934409703.db2.gz KZDHREZQJLAEST-VXGBXAGGSA-N 0 0 358.369 3.891 20 5 FHBDRN CN(Cc1nc2c(s1)CCCC2)C(=O)[C@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1 ZINC000934047631 934444752 /nfs/dbraw/zinc/44/47/52/934444752.db2.gz ULQZWAXXZYQEOR-CABCVRRESA-N 0 0 371.462 3.692 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N2CCc3cccc(Cl)c32)c1C ZINC000610800176 934447396 /nfs/dbraw/zinc/44/73/96/934447396.db2.gz REGOMRTUATWDCJ-UHFFFAOYSA-N 0 0 366.826 3.616 20 5 FHBDRN Cc1nn(C(C)(C)C)cc1[C@H](C)NC(=O)/C=C\c1ccc([N+](=O)[O-])cc1 ZINC000588473018 934471851 /nfs/dbraw/zinc/47/18/51/934471851.db2.gz PVIHKQMIEISFOE-ZWXCPPHNSA-N 0 0 356.426 3.745 20 5 FHBDRN Cc1ccc(Cl)cc1NC(=O)COC(=O)c1ccc(C)c([N+](=O)[O-])c1 ZINC000003511589 934475103 /nfs/dbraw/zinc/47/51/03/934475103.db2.gz ZWRVOJQKUSSVPS-UHFFFAOYSA-N 0 0 362.769 3.661 20 5 FHBDRN O=C(c1cccc([N+](=O)[O-])c1)N(Cc1ccc(F)cc1)C1CCOCC1 ZINC000277105938 934497068 /nfs/dbraw/zinc/49/70/68/934497068.db2.gz MRINLTQJXHHJJZ-UHFFFAOYSA-N 0 0 358.369 3.555 20 5 FHBDRN Cc1cc(F)cc(C(=O)NCc2ccc(Br)cc2)c1[N+](=O)[O-] ZINC000176208513 934508451 /nfs/dbraw/zinc/50/84/51/934508451.db2.gz KIACVMRISOEVQE-UHFFFAOYSA-N 0 0 367.174 3.735 20 5 FHBDRN Cc1ccc(C[C@@H]2CCCN(C(=O)Cc3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000065163687 934519214 /nfs/dbraw/zinc/51/92/14/934519214.db2.gz SQPYSINZOUHTQI-IBGZPJMESA-N 0 0 352.434 3.927 20 5 FHBDRN COC(=O)[C@@H](C)[C@@H](NCc1cc([N+](=O)[O-])ccc1Cl)c1ccccc1 ZINC000176225438 934533493 /nfs/dbraw/zinc/53/34/93/934533493.db2.gz MBMNHNKDVJRYEF-YVEFUNNKSA-N 0 0 362.813 3.888 20 5 FHBDRN Cc1cc2cc(NC(=O)C(=O)Nc3cc([N+](=O)[O-])ccc3Cl)ccc2[nH]1 ZINC000121668440 934571909 /nfs/dbraw/zinc/57/19/09/934571909.db2.gz LZVOBVHXERKVRJ-UHFFFAOYSA-N 0 0 372.768 3.615 20 5 FHBDRN C[C@H](CC(=O)c1ccco1)NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000178454579 934583739 /nfs/dbraw/zinc/58/37/39/934583739.db2.gz GUHUUPDSRRIROE-SNVBAGLBSA-N 0 0 358.375 3.794 20 5 FHBDRN Cc1cc(F)cc(C(=O)Nc2ccc(N3CCCCC3)cn2)c1[N+](=O)[O-] ZINC000176201854 934594898 /nfs/dbraw/zinc/59/48/98/934594898.db2.gz CUNABWWWZFAYQZ-UHFFFAOYSA-N 0 0 358.373 3.680 20 5 FHBDRN C[C@H](NC(=O)c1cc2cc([N+](=O)[O-])ccc2o1)[C@H]1COc2ccccc21 ZINC000535860824 934606609 /nfs/dbraw/zinc/60/66/09/934606609.db2.gz OVSJBUCURGGWLB-XHDPSFHLSA-N 0 0 352.346 3.636 20 5 FHBDRN O=[N+]([O-])c1cc2cnn(Cc3ccn(-c4ccc(F)cc4)n3)c2c(Cl)c1 ZINC000538149221 934614233 /nfs/dbraw/zinc/61/42/33/934614233.db2.gz OCOPJMCHCLWBSK-UHFFFAOYSA-N 0 0 371.759 3.971 20 5 FHBDRN O=[N+]([O-])c1cnc(N2Cc3ccccc3C(F)(F)C2)c(Br)c1 ZINC000610915502 934619934 /nfs/dbraw/zinc/61/99/34/934619934.db2.gz JMUIFXWLPWTFAF-UHFFFAOYSA-N 0 0 370.153 3.864 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N1Cc2ccccc2C(F)(F)C1 ZINC000610921756 934622567 /nfs/dbraw/zinc/62/25/67/934622567.db2.gz VVZYGOYONIVZOE-UHFFFAOYSA-N 0 0 363.320 3.743 20 5 FHBDRN CC(C)c1nc([C@H]2CCCN(c3ncc(Cl)cc3[N+](=O)[O-])C2)no1 ZINC000610929223 934626103 /nfs/dbraw/zinc/62/61/03/934626103.db2.gz FVWBMJQDIPPPIQ-JTQLQIEISA-N 0 0 351.794 3.534 20 5 FHBDRN CC(C)c1nc([C@@H]2CCCN(c3ncc(Cl)cc3[N+](=O)[O-])C2)no1 ZINC000610929224 934626154 /nfs/dbraw/zinc/62/61/54/934626154.db2.gz FVWBMJQDIPPPIQ-SNVBAGLBSA-N 0 0 351.794 3.534 20 5 FHBDRN O=C(c1cccc([N+](=O)[O-])c1)N1CCc2sc(Br)cc2C1 ZINC000610934045 934633981 /nfs/dbraw/zinc/63/39/81/934633981.db2.gz AACAUOFDDCEUKY-UHFFFAOYSA-N 0 0 367.224 3.617 20 5 FHBDRN C[C@H]1COCCCN1C(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000610949090 934645546 /nfs/dbraw/zinc/64/55/46/934645546.db2.gz ZMLYALIRPNQBHV-AWEZNQCLSA-N 0 0 355.394 3.589 20 5 FHBDRN O=C(NC[C@@H]1Cc2ccccc21)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000610963572 934650510 /nfs/dbraw/zinc/65/05/10/934650510.db2.gz XAVDPMMRUJSRMU-LBPRGKRZSA-N 0 0 350.296 3.683 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N1CCOc2ccccc2C1 ZINC000610959671 934657332 /nfs/dbraw/zinc/65/73/32/934657332.db2.gz SBRHLWJDVKIDGW-UHFFFAOYSA-N 0 0 366.295 3.648 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)N1CCC[C@@H]1C[C@@H](O)c1cccs1 ZINC000176243686 934662180 /nfs/dbraw/zinc/66/21/80/934662180.db2.gz OUVGZOFXPQVHRK-CZUORRHYSA-N 0 0 360.435 3.693 20 5 FHBDRN CCCN(Cc1ccc(OC)cc1)C(=O)Cc1cccc([N+](=O)[O-])c1C ZINC000610968534 934663515 /nfs/dbraw/zinc/66/35/15/934663515.db2.gz DFNVMHYIRYROPS-UHFFFAOYSA-N 0 0 356.422 3.893 20 5 FHBDRN C[C@@H](c1ccc([S@](C)=O)cc1)N(C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000176248406 934665103 /nfs/dbraw/zinc/66/51/03/934665103.db2.gz HRROJAMEWFXGLA-VDBVYFBLSA-N 0 0 361.423 3.557 20 5 FHBDRN COc1ccccc1C(C)(C)CNC(=O)Cc1cccc([N+](=O)[O-])c1C ZINC000610969493 934665920 /nfs/dbraw/zinc/66/59/20/934665920.db2.gz PMROAALNRJDCQP-UHFFFAOYSA-N 0 0 356.422 3.548 20 5 FHBDRN O=[N+]([O-])c1ccc(Oc2cccc(F)c2I)nc1 ZINC000611001874 934747446 /nfs/dbraw/zinc/74/74/46/934747446.db2.gz UKLXSBNRWZBDGB-UHFFFAOYSA-N 0 0 360.082 3.526 20 5 FHBDRN O=C([O-])C[C@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)C12CC3CC(CC(C3)C1)C2 ZINC000277187036 934767318 /nfs/dbraw/zinc/76/73/18/934767318.db2.gz FPEZZNGYQXOIKI-LMFLDHGRSA-N 0 0 358.438 3.744 20 5 FHBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)Nc1cc(F)ccc1OC(F)F ZINC000255430575 934788939 /nfs/dbraw/zinc/78/89/39/934788939.db2.gz FIXLEZXCTGZPBW-BAQGIRSFSA-N 0 0 352.268 3.987 20 5 FHBDRN Cc1nn(CN2CCC[C@H]2c2cccc(C)n2)c2cc([N+](=O)[O-])ccc12 ZINC000121264235 934806892 /nfs/dbraw/zinc/80/68/92/934806892.db2.gz HHORTGSHCNBNGW-SFHVURJKSA-N 0 0 351.410 3.751 20 5 FHBDRN Cc1cc(Cl)c(S(=O)(=O)N(C)Cc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000176635435 934811406 /nfs/dbraw/zinc/81/14/06/934811406.db2.gz JAPQOKKVFRUDTD-UHFFFAOYSA-N 0 0 372.805 3.516 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N2CC3(CCC3)[C@H]2C2CCOCC2)c1C ZINC000891991830 934814480 /nfs/dbraw/zinc/81/44/80/934814480.db2.gz BEJCDUFXMBZKIP-GOSISDBHSA-N 0 0 358.438 3.633 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C(=O)N2CC3(CCC3)[C@@H]2C2CCOCC2)c1C ZINC000891991832 934814578 /nfs/dbraw/zinc/81/45/78/934814578.db2.gz BEJCDUFXMBZKIP-SFHVURJKSA-N 0 0 358.438 3.633 20 5 FHBDRN Cn1ccnc1[C@@H](NCC(C)(C)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000611560352 934822603 /nfs/dbraw/zinc/82/26/03/934822603.db2.gz WJNMIPRSXDQMOV-IBGZPJMESA-N 0 0 364.449 3.985 20 5 FHBDRN C[C@@H]1CC[C@@H](C(F)(F)F)CN1C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000611560030 934827182 /nfs/dbraw/zinc/82/71/82/934827182.db2.gz BDLAFWQESLVZMF-MWLCHTKSSA-N 0 0 355.316 3.879 20 5 FHBDRN CCOc1cccc([C@H]2C[C@@H]2NC(=O)c2c(Cl)cccc2[N+](=O)[O-])c1 ZINC000538334093 934830120 /nfs/dbraw/zinc/83/01/20/934830120.db2.gz QGIKTVNEABDKKP-HIFRSBDPSA-N 0 0 360.797 3.933 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1c[nH]nc1-c1c(F)cccc1F ZINC000178483240 934833058 /nfs/dbraw/zinc/83/30/58/934833058.db2.gz OQCDJCQMSJHZBT-UHFFFAOYSA-N 0 0 372.331 3.535 20 5 FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)NCc1ccccc1C ZINC000119492946 934834952 /nfs/dbraw/zinc/83/49/52/934834952.db2.gz FPGIVLLDBJOMRY-UHFFFAOYSA-N 0 0 360.435 3.572 20 5 FHBDRN O=C(c1n[nH]c2ccc([N+](=O)[O-])cc21)N1CCCCC[C@H]1c1ccco1 ZINC000119501842 934845437 /nfs/dbraw/zinc/84/54/37/934845437.db2.gz NJEKCISCKAGIHV-HNNXBMFYSA-N 0 0 354.366 3.822 20 5 FHBDRN Cc1ccc(NC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)c(Cl)c1 ZINC000110039114 934862454 /nfs/dbraw/zinc/86/24/54/934862454.db2.gz VOIDUWDWBFFFFY-UHFFFAOYSA-N 0 0 357.753 3.650 20 5 FHBDRN O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N1CCC[C@@H]1c1ccccc1 ZINC000119526308 934864337 /nfs/dbraw/zinc/86/43/37/934864337.db2.gz DVPMFUDUWBKMTE-CQSZACIVSA-N 0 0 366.826 3.774 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CS(=O)(=O)[C@H](C)c1cccc(Cl)c1 ZINC000119526594 934864769 /nfs/dbraw/zinc/86/47/69/934864769.db2.gz HJBOYHPXRSXKRE-LLVKDONJSA-N 0 0 369.826 3.933 20 5 FHBDRN C[C@H]1CC[C@H](C(F)(F)F)CN1C(=O)c1c[nH]c2cccc([N+](=O)[O-])c21 ZINC000611561777 934872272 /nfs/dbraw/zinc/87/22/72/934872272.db2.gz MWAFCZCMCKCBOW-UWVGGRQHSA-N 0 0 355.316 3.879 20 5 FHBDRN COc1cc(C(=O)N(C(C)C)C2CCC2)c([N+](=O)[O-])cc1OC(F)F ZINC000121709618 934873737 /nfs/dbraw/zinc/87/37/37/934873737.db2.gz SCFSZQNKGSRPKA-UHFFFAOYSA-N 0 0 358.341 3.608 20 5 FHBDRN C[C@@H]1C[C@@H](c2ccccc2)N(S(=O)(=O)Cc2ccccc2[N+](=O)[O-])C1 ZINC000511013883 934883686 /nfs/dbraw/zinc/88/36/86/934883686.db2.gz OURSRLQHTHDJMN-KDOFPFPSSA-N 0 0 360.435 3.508 20 5 FHBDRN C[C@H]1CCN(C(=O)CN(C)c2ccccc2[N+](=O)[O-])[C@@H]1c1cccc(F)c1 ZINC000472046589 934890821 /nfs/dbraw/zinc/89/08/21/934890821.db2.gz AQTPCLAFXKHGPM-XOBRGWDASA-N 0 0 371.412 3.780 20 5 FHBDRN Cc1noc(CSc2ccccc2C(=O)Nc2ccc([N+](=O)[O-])cc2)n1 ZINC000071838471 934893488 /nfs/dbraw/zinc/89/34/88/934893488.db2.gz LDIKCBUWFLUSKP-UHFFFAOYSA-N 0 0 370.390 3.831 20 5 FHBDRN COC(=O)c1c(C2CC2)csc1NC(=O)Cc1ccccc1[N+](=O)[O-] ZINC000084577134 934923459 /nfs/dbraw/zinc/92/34/59/934923459.db2.gz NVNHORBEOWNCJL-UHFFFAOYSA-N 0 0 360.391 3.502 20 5 FHBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@]2(C1)OCc1ccccc12 ZINC000588490000 934943184 /nfs/dbraw/zinc/94/31/84/934943184.db2.gz GZKGNIKFNATICX-OKULMJQMSA-N 0 0 364.401 3.656 20 5 FHBDRN CN(Cc1cn[nH]c1)Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000611271864 934949832 /nfs/dbraw/zinc/94/98/32/934949832.db2.gz ALZQBCHWBOUIDA-UHFFFAOYSA-N 0 0 356.357 3.881 20 5 FHBDRN C[C@H]1C[C@@H](c2ccccc2)N(S(=O)(=O)CCc2ccccc2[N+](=O)[O-])C1 ZINC000511028825 934951237 /nfs/dbraw/zinc/95/12/37/934951237.db2.gz MECJMQGQEHKFDY-KXBFYZLASA-N 0 0 374.462 3.550 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1C[C@H](C)C[C@H]1c1ccccc1 ZINC000511030498 934965556 /nfs/dbraw/zinc/96/55/56/934965556.db2.gz NLHGXBQENJNCHW-DYVFJYSZSA-N 0 0 360.435 3.675 20 5 FHBDRN O=C(c1ccc2c(c1)OCCCO2)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000178505885 934970439 /nfs/dbraw/zinc/97/04/39/934970439.db2.gz NOISOJIPYPOPDD-UHFFFAOYSA-N 0 0 368.389 3.561 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)c2ccncc2Br)cc1[N+](=O)[O-] ZINC000119661590 934979543 /nfs/dbraw/zinc/97/95/43/934979543.db2.gz YALKEYXBGYNFJX-SNVBAGLBSA-N 0 0 364.199 3.552 20 5 FHBDRN Cc1ccnc2c1cccc2S(=O)(=O)[N-]c1cc([N+](=O)[O-])c(C)cc1C ZINC000548611508 934996512 /nfs/dbraw/zinc/99/65/12/934996512.db2.gz XMUKJHPJVYTAMP-UHFFFAOYSA-N 0 0 371.418 3.869 20 5 FHBDRN C[C@H](NC(=O)N1CCCC[C@H]([C@H]2CCOC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000892109454 935014354 /nfs/dbraw/zinc/01/43/54/935014354.db2.gz ANHKDKSYEIKGAJ-XIRDDKMYSA-N 0 0 361.442 3.504 20 5 FHBDRN Cc1sc(C(=O)NCCc2ccc(OC(F)(F)F)cc2)cc1[N+](=O)[O-] ZINC000071929524 935019573 /nfs/dbraw/zinc/01/95/73/935019573.db2.gz DGPQUUJMUJSHPN-UHFFFAOYSA-N 0 0 374.340 3.836 20 5 FHBDRN CC[C@@H](CNC(=O)c1ccc(Cl)cc1[N+](=O)[O-])Oc1cccc(F)c1 ZINC000439906528 945070752 /nfs/dbraw/zinc/07/07/52/945070752.db2.gz YINPLAMDKKSCIK-ZDUSSCGKSA-N 0 0 366.776 3.975 20 5 FHBDRN O=C(c1ccnc(-c2ccccc2)c1[N+](=O)[O-])N1CCCc2occc2C1 ZINC000426171059 945070830 /nfs/dbraw/zinc/07/08/30/945070830.db2.gz SKHPEUPSRALTRL-UHFFFAOYSA-N 0 0 363.373 3.838 20 5 FHBDRN CCc1nc(-c2ccc(C(=O)Nc3cc([N+](=O)[O-])ccc3C)cc2)n[nH]1 ZINC000119686678 935029753 /nfs/dbraw/zinc/02/97/53/935029753.db2.gz QEYWBQLCWQRKBR-UHFFFAOYSA-N 0 0 351.366 3.503 20 5 FHBDRN CCc1nc(C)c(NC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)s1 ZINC000548624032 935040656 /nfs/dbraw/zinc/04/06/56/935040656.db2.gz MRDOQOWKRQVOJN-UHFFFAOYSA-N 0 0 371.422 3.575 20 5 FHBDRN O=C(N[C@@H]1C[C@@H]1c1ccccc1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000431323772 935042687 /nfs/dbraw/zinc/04/26/87/935042687.db2.gz PUQWCOXURGXORF-QZTJIDSGSA-N 0 0 351.406 3.825 20 5 FHBDRN CCc1c(NC(=O)c2ccc([N+](=O)[O-])cc2F)cnn1-c1ccccc1 ZINC000468196706 935045320 /nfs/dbraw/zinc/04/53/20/935045320.db2.gz XARNCBPZYWEBOH-UHFFFAOYSA-N 0 0 354.341 3.734 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)Nc1ccc(-c2c[nH]cn2)cc1 ZINC000519061282 945072811 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O=C(COc1ccccc1Cl)Nc1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000084776209 935170277 /nfs/dbraw/zinc/17/02/77/935170277.db2.gz QGICIRFWOPOPSB-UHFFFAOYSA-N 0 0 357.753 3.814 20 5 FHBDRN O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)C(=O)N1CCC[C@H]1c1ccccc1 ZINC000119741268 935172726 /nfs/dbraw/zinc/17/27/26/935172726.db2.gz QWLJFSVRLJOCSE-HNNXBMFYSA-N 0 0 373.796 3.550 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])N(Cc1ccccn1)c1ccc(F)cc1 ZINC000071981620 935174661 /nfs/dbraw/zinc/17/46/61/935174661.db2.gz AFXDJLBPTMBRPF-UHFFFAOYSA-N 0 0 365.364 3.905 20 5 FHBDRN O=[N+]([O-])c1cnc2ccc(Cl)cc2c1N1CCC(n2ccnc2)CC1 ZINC000892159096 935176193 /nfs/dbraw/zinc/17/61/93/935176193.db2.gz HBFRUQGATSSUPF-UHFFFAOYSA-N 0 0 357.801 3.834 20 5 FHBDRN CC[C@@H](CNC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)c1ccccc1 ZINC000519075572 945082843 /nfs/dbraw/zinc/08/28/43/945082843.db2.gz RDZXDSGKUQIKDB-HNNXBMFYSA-N 0 0 364.405 3.704 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H]1CCC[C@H]1SCC ZINC000439927683 945083917 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CC(C)(C)c1ccc(C(=O)N2CCC[C@@H](OC(F)F)C2)cc1[N+](=O)[O-] ZINC000611573709 935233053 /nfs/dbraw/zinc/23/30/53/935233053.db2.gz UCMXIATWOYXRPB-GFCCVEGCSA-N 0 0 356.369 3.736 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2CC=C(c3ccccc3F)C2)c1 ZINC000539524099 935235659 /nfs/dbraw/zinc/23/56/59/935235659.db2.gz VWCBXTDNEZZDLN-UHFFFAOYSA-N 0 0 370.380 3.737 20 5 FHBDRN COc1ccc(OCc2ccc(OC)c([N+](=O)[O-])c2)c(Br)c1 ZINC000388336392 935239949 /nfs/dbraw/zinc/23/99/49/935239949.db2.gz FTWHKUIBMFBKBJ-UHFFFAOYSA-N 0 0 368.183 3.954 20 5 FHBDRN COc1ccc(CNc2cc(C)c([N+](=O)[O-])cc2Br)cn1 ZINC000234933959 935242007 /nfs/dbraw/zinc/24/20/07/935242007.db2.gz RFTRETPCSNBFGV-UHFFFAOYSA-N 0 0 352.188 3.681 20 5 FHBDRN Cc1ccc(C)n1C1CCN(Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000434847829 935248272 /nfs/dbraw/zinc/24/82/72/935248272.db2.gz YWNIJHURTMHQGC-UHFFFAOYSA-N 0 0 354.410 3.991 20 5 FHBDRN O=C1[C@@H](c2nc(-c3cccc([N+](=O)[O-])c3)no2)CCCN1c1ccccc1 ZINC000551329105 935250093 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FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)Nc1cc2c(cc1Cl)OCCCO2 ZINC000072068682 935275244 /nfs/dbraw/zinc/27/52/44/935275244.db2.gz GLCVKYQQLBXZPP-UHFFFAOYSA-N 0 0 362.769 3.970 20 5 FHBDRN O=[N+]([O-])c1ccccc1CN(Cc1ccccc1)C[C@H](O)C(F)(F)F ZINC000611575792 935278441 /nfs/dbraw/zinc/27/84/41/935278441.db2.gz KIJAOEQFEZBLQG-INIZCTEOSA-N 0 0 354.328 3.520 20 5 FHBDRN O=[N+]([O-])c1cccc(CN(Cc2ccccc2)C[C@@H](O)C(F)(F)F)c1 ZINC000611576642 935282908 /nfs/dbraw/zinc/28/29/08/935282908.db2.gz PURIZQKSPSWTMR-MRXNPFEDSA-N 0 0 354.328 3.520 20 5 FHBDRN COCC[C@@H]1CCCCN(C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000468213921 935301120 /nfs/dbraw/zinc/30/11/20/935301120.db2.gz CRMSAOTZSGLZGS-CVEARBPZSA-N 0 0 363.458 3.812 20 5 FHBDRN O=[N+]([O-])c1cc(CN(Cc2ccccc2)C[C@H](O)C(F)(F)F)cs1 ZINC000611578177 935306199 /nfs/dbraw/zinc/30/61/99/935306199.db2.gz YKLIMNLRNRDRJI-ZDUSSCGKSA-N 0 0 360.357 3.582 20 5 FHBDRN C[C@H](CCc1ccccc1[N+](=O)[O-])Nc1ccc2ccn(C)c(=O)c2c1 ZINC000551569545 935311390 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FHBDRN C[C@H](NC(=O)CSc1ccc([N+](=O)[O-])cc1)c1ccc(F)c(F)c1 ZINC000014575339 935391020 /nfs/dbraw/zinc/39/10/20/935391020.db2.gz REDFPCFDESDENI-JTQLQIEISA-N 0 0 352.362 3.843 20 5 FHBDRN Cc1c(C[S@](C)=O)cccc1NC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000582215474 935409995 /nfs/dbraw/zinc/40/99/95/935409995.db2.gz AAJRFDHIPFBXSX-SHZVTRLKSA-N 0 0 360.435 3.524 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NCC(=O)Nc1ccnn1C1CCCC1 ZINC000085288837 935416660 /nfs/dbraw/zinc/41/66/60/935416660.db2.gz YPALSUUIRQNTCU-UHFFFAOYSA-N 0 0 357.414 3.574 20 5 FHBDRN Cc1cc(-c2noc(CN(C)CCc3ccccc3[N+](=O)[O-])n2)ccc1F ZINC000511093925 935431491 /nfs/dbraw/zinc/43/14/91/935431491.db2.gz RNLAJNJIMSSVMH-UHFFFAOYSA-N 0 0 370.384 3.767 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NCCOc1cccc(C)c1 ZINC000120037737 935475315 /nfs/dbraw/zinc/47/53/15/935475315.db2.gz NVSAGQPAAORBRO-UHFFFAOYSA-N 0 0 360.435 3.824 20 5 FHBDRN CC(C)CCSc1ccc(C(=O)N[C@@H](C)C[C@H](C)O)cc1[N+](=O)[O-] ZINC000544028071 935481187 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HIKXRYRHJDEIFC-DZGCQCFKSA-N 0 0 372.446 3.920 20 5 FHBDRN COc1ccc(OC)c([C@@H]2CCCN2Cc2ccc(OC)c([N+](=O)[O-])c2)c1 ZINC000051589227 935513818 /nfs/dbraw/zinc/51/38/18/935513818.db2.gz MMPGAALQLAZPPP-KRWDZBQOSA-N 0 0 372.421 3.958 20 5 FHBDRN CC(C)(C)OC(=O)c1cccc(CNC(=O)Nc2ccc([N+](=O)[O-])cc2)c1 ZINC000611418521 935528649 /nfs/dbraw/zinc/52/86/49/935528649.db2.gz PLOSSVNZVSXXDL-UHFFFAOYSA-N 0 0 371.393 3.872 20 5 FHBDRN CCN1CCc2ccc(NC(=O)CSc3ccc([N+](=O)[O-])cc3)cc21 ZINC000110816506 945106979 /nfs/dbraw/zinc/10/69/79/945106979.db2.gz ZNRICGWRNQYKEE-UHFFFAOYSA-N 0 0 357.435 3.708 20 5 FHBDRN Cn1c(-c2cccc([N+](=O)[O-])c2)nnc1N1CCC[C@@H]1c1cccc(F)c1 ZINC000582329075 935532572 /nfs/dbraw/zinc/53/25/72/935532572.db2.gz ZFQMVMDVQAFCGB-QGZVFWFLSA-N 0 0 367.384 3.871 20 5 FHBDRN Cc1cc(NC(=O)Cc2ccc(Br)c(F)c2)ccc1[N+](=O)[O-] ZINC000540745211 935554397 /nfs/dbraw/zinc/55/43/97/935554397.db2.gz LSFIBPVWJSKJHF-UHFFFAOYSA-N 0 0 367.174 3.986 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H]1CCSc2c(F)cccc21 ZINC000427122098 945108801 /nfs/dbraw/zinc/10/88/01/945108801.db2.gz OXXXMICBWBSQPR-CQSZACIVSA-N 0 0 362.382 3.709 20 5 FHBDRN Cc1cc(C(=O)N(C)Cc2cc(Br)cs2)ccc1[N+](=O)[O-] ZINC000044631573 935569386 /nfs/dbraw/zinc/56/93/86/935569386.db2.gz YDWDVHHOMAZNEV-UHFFFAOYSA-N 0 0 369.240 3.999 20 5 FHBDRN Cc1c(CC(=O)Nc2cc3c(cc2Cl)OCCO3)cccc1[N+](=O)[O-] ZINC000178563750 935573439 /nfs/dbraw/zinc/57/34/39/935573439.db2.gz SRIRHDAJWIOXFY-UHFFFAOYSA-N 0 0 362.769 3.509 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)NCCCc1ccccc1F ZINC000478165543 935588141 /nfs/dbraw/zinc/58/81/41/935588141.db2.gz DVPXBNXGNQBTEA-UHFFFAOYSA-N 0 0 350.777 3.679 20 5 FHBDRN Cc1sc(C(=O)N2C[C@H](c3ccccc3)[C@H]3COCC[C@H]32)cc1[N+](=O)[O-] ZINC000287797803 935591742 /nfs/dbraw/zinc/59/17/42/935591742.db2.gz JESLQPVQRGAZFX-BZUAXINKSA-N 0 0 372.446 3.609 20 5 FHBDRN O=C(CCNc1ccccc1[N+](=O)[O-])N[C@@H]1CC[C@H](c2cccc(F)c2)C1 ZINC000478222524 935593555 /nfs/dbraw/zinc/59/35/55/935593555.db2.gz DIRBNTXQCRYBRC-DOTOQJQBSA-N 0 0 371.412 3.988 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)/C=C\c1nc2ccccc2s1 ZINC000255501987 935597918 /nfs/dbraw/zinc/59/79/18/935597918.db2.gz SVFDKLFWIIVGHC-HJWRWDBZSA-N 0 0 369.402 3.543 20 5 FHBDRN COC(=O)c1cnc(NCCOc2ccc(C(C)(C)C)cc2)c([N+](=O)[O-])c1 ZINC000478257122 935598907 /nfs/dbraw/zinc/59/89/07/935598907.db2.gz LWOITHKVKDNNNF-UHFFFAOYSA-N 0 0 373.409 3.565 20 5 FHBDRN CCc1nc2c(s1)[C@H](N(C)C(=O)c1cc(F)cc([N+](=O)[O-])c1)CCC2 ZINC000478292749 935608064 /nfs/dbraw/zinc/60/80/64/935608064.db2.gz PXNLNHYIMJFDNX-CQSZACIVSA-N 0 0 363.414 3.902 20 5 FHBDRN COc1cc(C(=O)Nc2cnn(CCC(C)C)c2C)cc([N+](=O)[O-])c1C ZINC000478328401 935610717 /nfs/dbraw/zinc/61/07/17/935610717.db2.gz QFQNKMHZJNPXMP-UHFFFAOYSA-N 0 0 360.414 3.715 20 5 FHBDRN CCN(Cc1cccc(F)c1)C(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000519106863 945112210 /nfs/dbraw/zinc/11/22/10/945112210.db2.gz WDKSFPXWHDKJFB-UHFFFAOYSA-N 0 0 368.368 3.582 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(C)[C@@H](C)c1ccc(F)c(F)c1 ZINC000023440151 935615801 /nfs/dbraw/zinc/61/58/01/935615801.db2.gz IXTPROOROWSWPX-NSHDSACASA-N 0 0 370.377 3.563 20 5 FHBDRN COCc1ccccc1NC(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000158190417 935617161 /nfs/dbraw/zinc/61/71/61/935617161.db2.gz QKZABERMOHGPNA-UHFFFAOYSA-N 0 0 357.410 3.886 20 5 FHBDRN Cc1cc(OCC(=O)NC[C@H](C)Sc2ccccc2)ccc1[N+](=O)[O-] ZINC000432116622 945112480 /nfs/dbraw/zinc/11/24/80/945112480.db2.gz QDVYTKNQQLDSID-AWEZNQCLSA-N 0 0 360.435 3.579 20 5 FHBDRN Cc1cc2ccc(C)nc2c(OC[C@@H](O)COc2cccc([N+](=O)[O-])c2)c1 ZINC000478366344 935619584 /nfs/dbraw/zinc/61/95/84/935619584.db2.gz DOAKFCMWVVDBMF-KRWDZBQOSA-N 0 0 368.389 3.579 20 5 FHBDRN COCCOc1cccc(NC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000431395879 935620809 /nfs/dbraw/zinc/62/08/09/935620809.db2.gz HWHMLDMNFNIOSJ-UHFFFAOYSA-N 0 0 373.409 3.677 20 5 FHBDRN Cc1cc(NC(=O)Cc2cccc([N+](=O)[O-])c2C)ccc1N1CCCC1 ZINC000178567157 935630344 /nfs/dbraw/zinc/63/03/44/935630344.db2.gz RLHKJEJNSFJRMF-UHFFFAOYSA-N 0 0 353.422 3.993 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N1CCCCc2ccccc21 ZINC000511113175 935634957 /nfs/dbraw/zinc/63/49/57/935634957.db2.gz BCHDZYACWIWNEM-UHFFFAOYSA-N 0 0 366.826 3.780 20 5 FHBDRN CCS[C@@H]1CCCC[C@H]1NC(=O)c1cc(OC)c(C)c([N+](=O)[O-])c1 ZINC000478490702 935636264 /nfs/dbraw/zinc/63/62/64/935636264.db2.gz QHRDYOIAUGGTSH-CZUORRHYSA-N 0 0 352.456 3.706 20 5 FHBDRN Cc1c(C(=O)N(C)Cc2ccc(Br)cc2)cccc1[N+](=O)[O-] ZINC000023490937 935644480 /nfs/dbraw/zinc/64/44/80/935644480.db2.gz BCTNCTNRPDTBSD-UHFFFAOYSA-N 0 0 363.211 3.938 20 5 FHBDRN CCc1ccc(C(=O)O[C@H](c2nc(C)no2)c2ccccc2)cc1[N+](=O)[O-] ZINC000176669083 935664326 /nfs/dbraw/zinc/66/43/26/935664326.db2.gz NPSVGJPDHFPUBF-KRWDZBQOSA-N 0 0 367.361 3.795 20 5 FHBDRN Cc1nn(C)c(C(=O)Nc2ccccc2Oc2ccccc2)c1[N+](=O)[O-] ZINC000127631349 935670817 /nfs/dbraw/zinc/67/08/17/935670817.db2.gz PEQWGKGCJQAHSR-UHFFFAOYSA-N 0 0 352.350 3.681 20 5 FHBDRN CC(C)COC[C@H](O)CNc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000582416311 935677035 /nfs/dbraw/zinc/67/70/35/935677035.db2.gz IBVSAJVUGKCGNR-QGZVFWFLSA-N 0 0 360.410 3.833 20 5 FHBDRN CC1(C)CCC(CC(=O)N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)CC1 ZINC000152494854 935681632 /nfs/dbraw/zinc/68/16/32/935681632.db2.gz MGQSAHVAZXOIQD-HNNXBMFYSA-N 0 0 360.458 3.609 20 5 FHBDRN COc1cc(C(=O)Nc2cccc(Cl)c2N(C)C)cc([N+](=O)[O-])c1C ZINC000478707681 935682418 /nfs/dbraw/zinc/68/24/18/935682418.db2.gz XXWYEQHYDPJRCN-UHFFFAOYSA-N 0 0 363.801 3.884 20 5 FHBDRN O=C(OCc1ccc(Cl)cc1[N+](=O)[O-])[C@H]1CCCN1c1ccccc1 ZINC000785127026 935684836 /nfs/dbraw/zinc/68/48/36/935684836.db2.gz PFEBVYPHKAESGY-MRXNPFEDSA-N 0 0 360.797 3.960 20 5 FHBDRN CCOc1cc(CSc2nnc(Cc3ccccc3)[nH]2)ccc1[N+](=O)[O-] ZINC000478755705 935708084 /nfs/dbraw/zinc/70/80/84/935708084.db2.gz DSNSLBMMZWSJCW-UHFFFAOYSA-N 0 0 370.434 3.995 20 5 FHBDRN Cc1cc(C(=O)N2CCC[C@H]2CC(=O)c2ccccc2)ccc1[N+](=O)[O-] ZINC000085490654 935708716 /nfs/dbraw/zinc/70/87/16/935708716.db2.gz NWJZTLLSJRWBNV-KRWDZBQOSA-N 0 0 352.390 3.781 20 5 FHBDRN CCOc1ccccc1OCCCC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000018234534 945118463 /nfs/dbraw/zinc/11/84/63/945118463.db2.gz XVWCIRDNFIRZPA-UHFFFAOYSA-N 0 0 370.405 3.742 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2nc(CN3CCC[C@@H](OC(F)F)C3)cs2)c1 ZINC000611608107 935730653 /nfs/dbraw/zinc/73/06/53/935730653.db2.gz FKPSFDPGQNDTSB-CQSZACIVSA-N 0 0 369.393 3.922 20 5 FHBDRN CN(C(=O)Cc1cc(Br)ccc1F)c1cccc([N+](=O)[O-])c1 ZINC000158324054 935731091 /nfs/dbraw/zinc/73/10/91/935731091.db2.gz UPEOVZJYEVQPCD-UHFFFAOYSA-N 0 0 367.174 3.702 20 5 FHBDRN CC(C)(C)C[C@H](O)CNC(=O)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000277622534 935738508 /nfs/dbraw/zinc/73/85/08/935738508.db2.gz AOUASUZJIASCOX-ZDUSSCGKSA-N 0 0 352.434 3.621 20 5 FHBDRN CCCC(=O)Nc1cccc(NC(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)c1 ZINC000478862572 935745816 /nfs/dbraw/zinc/74/58/16/935745816.db2.gz AAQJIBYCHJIXSO-UHFFFAOYSA-N 0 0 371.393 3.903 20 5 FHBDRN CCc1c(C(=O)N(C)Cc2ccccc2[N+](=O)[O-])cnn1C(CC)CC ZINC000478881640 935747969 /nfs/dbraw/zinc/74/79/69/935747969.db2.gz HLMMISWONUYCKX-UHFFFAOYSA-N 0 0 358.442 3.987 20 5 FHBDRN Cc1c2ccccc2n(C)c1CNC(=O)Nc1ccc([N+](=O)[O-])cc1F ZINC000478890967 935752154 /nfs/dbraw/zinc/75/21/54/935752154.db2.gz WFNXDHVGPQXPPS-UHFFFAOYSA-N 0 0 356.357 3.856 20 5 FHBDRN COc1ccccc1C[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000478897680 935753034 /nfs/dbraw/zinc/75/30/34/935753034.db2.gz OWUTUGGZWFTIDZ-KRWDZBQOSA-N 0 0 354.406 3.759 20 5 FHBDRN CC[C@@]1(c2ccc(C)cc2)CC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C1=O ZINC000158362756 935754724 /nfs/dbraw/zinc/75/47/24/935754724.db2.gz UDYDMBYEVUPYEM-FQEVSTJZSA-N 0 0 352.390 3.510 20 5 FHBDRN Cc1cc(N[C@H]2CCC[C@@H](NC(=O)OC(C)(C)C)C2)ncc1[N+](=O)[O-] ZINC000127741594 935765468 /nfs/dbraw/zinc/76/54/68/935765468.db2.gz BYJJNMFHCYXCPG-QWHCGFSZSA-N 0 0 350.419 3.546 20 5 FHBDRN CC(C)COc1ccccc1CNC(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000050124476 935780252 /nfs/dbraw/zinc/78/02/52/935780252.db2.gz NPEWZJFWJJQYEL-UHFFFAOYSA-N 0 0 371.437 3.971 20 5 FHBDRN Cc1ccc(NC(=O)[C@@H](C)N(C)CCc2ccccc2[N+](=O)[O-])cc1C ZINC000511142463 935784188 /nfs/dbraw/zinc/78/41/88/935784188.db2.gz OSUZCISJMPMWMZ-MRXNPFEDSA-N 0 0 355.438 3.713 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])Nc1ccn(-c2ccccc2Cl)n1 ZINC000158429364 935786116 /nfs/dbraw/zinc/78/61/16/935786116.db2.gz MEKRXFWYHVWOPC-UHFFFAOYSA-N 0 0 356.769 3.615 20 5 FHBDRN COC[C@@H](C)n1c(C)cc(C(=O)COc2cccc([N+](=O)[O-])c2C)c1C ZINC000047355603 945123612 /nfs/dbraw/zinc/12/36/12/945123612.db2.gz GQXUYGCDWRYIKF-CYBMUJFWSA-N 0 0 360.410 3.791 20 5 FHBDRN CC(=O)Nc1ccc(C)c(NC(=O)CSc2ccccc2[N+](=O)[O-])c1 ZINC000479119668 935796782 /nfs/dbraw/zinc/79/67/82/935796782.db2.gz GZVUIMOIPPHPKA-UHFFFAOYSA-N 0 0 359.407 3.592 20 5 FHBDRN CCOC[C@@H]1CCCN(C(=O)c2cccc3c(=O)c4ccccc4[nH]c23)C1 ZINC000277666725 935800493 /nfs/dbraw/zinc/80/04/93/935800493.db2.gz HDOQHEQYPPHHOL-OAHLLOKOSA-N 0 0 364.445 3.982 20 5 FHBDRN O=C(NC[C@@H](O)c1cc2ccccc2s1)Nc1cccc([N+](=O)[O-])c1 ZINC000176679947 935802669 /nfs/dbraw/zinc/80/26/69/935802669.db2.gz ASBFEZSXUNNVBF-CQSZACIVSA-N 0 0 357.391 3.665 20 5 FHBDRN CC(C)(CCO)CNC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000178596823 935810907 /nfs/dbraw/zinc/81/09/07/935810907.db2.gz PBKXCIYCGNYYIS-UHFFFAOYSA-N 0 0 374.462 3.884 20 5 FHBDRN CCCC(=O)Nc1ccc(C(=O)COc2nc(C)cc(C)c2[N+](=O)[O-])cc1 ZINC000479171835 935814069 /nfs/dbraw/zinc/81/40/69/935814069.db2.gz ZLUVHXSLRJOZQS-UHFFFAOYSA-N 0 0 371.393 3.607 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(N2CCC[C@H]2c2nc3ccccc3n2C)n1 ZINC000611617164 935814266 /nfs/dbraw/zinc/81/42/66/935814266.db2.gz LWSGTQSVGMOBFE-INIZCTEOSA-N 0 0 351.410 3.835 20 5 FHBDRN COc1ccc(OCCN(C)C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)cc1 ZINC000127813621 935814532 /nfs/dbraw/zinc/81/45/32/935814532.db2.gz XMEVMDGFPZAOHG-UHFFFAOYSA-N 0 0 373.409 3.763 20 5 FHBDRN CN(C(=O)c1cnn(Cc2ccccc2Cl)c1)c1cccc([N+](=O)[O-])c1 ZINC000158464630 935817220 /nfs/dbraw/zinc/81/72/20/935817220.db2.gz UPGQFJDMKSALBE-UHFFFAOYSA-N 0 0 370.796 3.770 20 5 FHBDRN C[C@H](NC(=O)[C@H](C)Oc1cccnc1[N+](=O)[O-])c1cccc2ccccc21 ZINC000023754159 935818417 /nfs/dbraw/zinc/81/84/17/935818417.db2.gz DSLPOHRTVNXAJY-KBPBESRZSA-N 0 0 365.389 3.788 20 5 FHBDRN CCS[C@H](C)c1noc(CN(C)Cc2c(F)cccc2[N+](=O)[O-])n1 ZINC000127825924 935819145 /nfs/dbraw/zinc/81/91/45/935819145.db2.gz AIBAWNFXWDKOID-SNVBAGLBSA-N 0 0 354.407 3.563 20 5 FHBDRN Cc1csc([C@H](NC(=O)NCc2cccc([N+](=O)[O-])c2C)C2CC2)n1 ZINC000479312698 935824515 /nfs/dbraw/zinc/82/45/15/935824515.db2.gz GCZJMWLEZOJCED-OAHLLOKOSA-N 0 0 360.439 3.619 20 5 FHBDRN CC(C)(C)C[C@@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1F)C(F)(F)F ZINC000479321648 935826790 /nfs/dbraw/zinc/82/67/90/935826790.db2.gz WSZWUJPSSRSFEZ-GFCCVEGCSA-N 0 0 350.312 3.760 20 5 FHBDRN COc1ccccc1NC1CCN(C(=O)c2ccc([N+](=O)[O-])c(C)c2)CC1 ZINC000085499265 935827746 /nfs/dbraw/zinc/82/77/46/935827746.db2.gz STQHKLJCNRDTED-UHFFFAOYSA-N 0 0 369.421 3.629 20 5 FHBDRN CCN(Cc1ccc(OC)c(OC)c1)C(=O)c1cc(C)ccc1[N+](=O)[O-] ZINC000479336076 935827831 /nfs/dbraw/zinc/82/78/31/935827831.db2.gz SWDQJSLRDQQRED-UHFFFAOYSA-N 0 0 358.394 3.583 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H](OCCCc2ccccc2)C1 ZINC000176338201 935835792 /nfs/dbraw/zinc/83/57/92/935835792.db2.gz BIZSIFHZQZDHKO-IBGZPJMESA-N 0 0 368.433 3.767 20 5 FHBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])C1(c2cccc(F)c2)CC1 ZINC000479438870 935836701 /nfs/dbraw/zinc/83/67/01/935836701.db2.gz JSUOGNPLHGJPNQ-UHFFFAOYSA-N 0 0 362.788 3.778 20 5 FHBDRN Cc1cccc(O[C@H](C)C(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000479418359 935838265 /nfs/dbraw/zinc/83/82/65/935838265.db2.gz WFKMQRKOSFIEBV-CYBMUJFWSA-N 0 0 362.813 3.683 20 5 FHBDRN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])c1ccnn1C1CCCC1 ZINC000479419402 935838385 /nfs/dbraw/zinc/83/83/85/935838385.db2.gz XHVXCPWRAUKLNB-UHFFFAOYSA-N 0 0 362.817 3.532 20 5 FHBDRN O=[N+]([O-])c1ccc(OCCSc2nc3cc(F)c(F)cc3[nH]2)cc1 ZINC000519104383 945127847 /nfs/dbraw/zinc/12/78/47/945127847.db2.gz OJBWLQUZKQKTLG-UHFFFAOYSA-N 0 0 351.334 3.920 20 5 FHBDRN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)N1CCSC[C@@H]1c1ccccc1 ZINC000255516168 935845261 /nfs/dbraw/zinc/84/52/61/935845261.db2.gz URBZVTRBBOGWIP-IBWPDUFMSA-N 0 0 354.431 3.925 20 5 FHBDRN CC[C@@H]1CN(C(=O)c2cccc3c(=O)c4ccccc4[nH]c23)C[C@H](C)O1 ZINC000277715512 935850171 /nfs/dbraw/zinc/85/01/71/935850171.db2.gz MHIXBLROSWUSLW-UONOGXRCSA-N 0 0 350.418 3.733 20 5 FHBDRN Cc1cc(Cl)c(S(=O)(=O)Oc2cccc(F)c2F)cc1[N+](=O)[O-] ZINC000176692047 935854085 /nfs/dbraw/zinc/85/40/85/935854085.db2.gz INWQDKRLDOWMJG-UHFFFAOYSA-N 0 0 363.725 3.603 20 5 FHBDRN CC(C)(C)OC(=O)[C@H]1CCCN1C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000479561290 935857528 /nfs/dbraw/zinc/85/75/28/935857528.db2.gz UCPKOURXKPTJGC-CYBMUJFWSA-N 0 0 369.805 3.586 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N[C@@H]1c2ccc(F)cc2O[C@@H]1C ZINC000479561324 935857886 /nfs/dbraw/zinc/85/78/86/935857886.db2.gz HSMBGMNFBBUAAE-DIFFPNOSSA-N 0 0 359.357 3.994 20 5 FHBDRN COc1ccc(OC)c([C@@H](C)NC(=O)c2cc(F)cc(C)c2[N+](=O)[O-])c1 ZINC000176693339 935863508 /nfs/dbraw/zinc/86/35/08/935863508.db2.gz MWDJRNPIOROARE-LLVKDONJSA-N 0 0 362.357 3.551 20 5 FHBDRN Cc1cc(F)cc(C(=O)N(C)Cc2ccccc2N2CCCC2)c1[N+](=O)[O-] ZINC000176695157 935866551 /nfs/dbraw/zinc/86/65/51/935866551.db2.gz ORHPJTAZXLCYNG-UHFFFAOYSA-N 0 0 371.412 3.915 20 5 FHBDRN CS[C@@H]1CCC[C@@H](NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000431462925 935868580 /nfs/dbraw/zinc/86/85/80/935868580.db2.gz DSAZXKSVTWSCPC-DGCLKSJQSA-N 0 0 373.272 3.761 20 5 FHBDRN Cc1ncc([N+](=O)[O-])n1CCN1CCc2sccc2[C@@H]1c1cccs1 ZINC000611658567 935879910 /nfs/dbraw/zinc/87/99/10/935879910.db2.gz LSJXBYMSJOBEFY-QGZVFWFLSA-N 0 0 374.491 3.870 20 5 FHBDRN CCS[C@H](C)c1noc(CN(C)Cc2cccc([N+](=O)[O-])c2C)n1 ZINC000127996498 935880995 /nfs/dbraw/zinc/88/09/95/935880995.db2.gz BWQZUTFFHXHEDJ-GFCCVEGCSA-N 0 0 350.444 3.732 20 5 FHBDRN COCC[C@@H](NC(=O)c1c(C)cc(C)c([N+](=O)[O-])c1C)c1ccc(C)o1 ZINC000479760564 935887683 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CS(=O)(=O)c1ccc(NC[C@@H](c2ccccc2)C2CC2)c([N+](=O)[O-])c1 ZINC000431493013 936185475 /nfs/dbraw/zinc/18/54/75/936185475.db2.gz HAKWZTIMBWWNRG-INIZCTEOSA-N 0 0 360.435 3.604 20 5 FHBDRN O=C(CSc1ccccc1[N+](=O)[O-])N(CC1CCC1)CC(F)(F)F ZINC000121955000 936196144 /nfs/dbraw/zinc/19/61/44/936196144.db2.gz FGOFWPVAUACPNV-UHFFFAOYSA-N 0 0 362.373 3.878 20 5 FHBDRN O=[N+]([O-])c1ccc2nc(N3CCC(CO)(c4ccccc4)CC3)ccc2c1 ZINC000431496856 936203527 /nfs/dbraw/zinc/20/35/27/936203527.db2.gz ULQLXJXAEYYLMZ-UHFFFAOYSA-N 0 0 363.417 3.674 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)N[C@@H](c1ccccc1)C1CCC1 ZINC000511205744 936204380 /nfs/dbraw/zinc/20/43/80/936204380.db2.gz ZACRQEWGLZNYSZ-IBGZPJMESA-N 0 0 369.421 3.944 20 5 FHBDRN C[C@H](c1ccccc1)N1CC(=O)N([C@H](C)c2ccccc2[N+](=O)[O-])C1=O ZINC000277931260 936206337 /nfs/dbraw/zinc/20/63/37/936206337.db2.gz QSSWDGPQDCRZBD-ZIAGYGMSSA-N 0 0 353.378 3.681 20 5 FHBDRN CC(C)c1cccc(CNS(=O)(=O)c2cc(Cl)ccc2[N+](=O)[O-])c1 ZINC001211560730 936222118 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COc1ccc(C2(C(=O)Nc3ccc([N+](=O)[O-])cc3)CCC2)cc1OC ZINC000612443335 936240865 /nfs/dbraw/zinc/24/08/65/936240865.db2.gz SDLVROCTGVCMOI-UHFFFAOYSA-N 0 0 356.378 3.672 20 5 FHBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCC1(CCO)CCCCC1 ZINC000135820316 936252493 /nfs/dbraw/zinc/25/24/93/936252493.db2.gz DVSRNTGTAOJUSM-AWEZNQCLSA-N 0 0 366.483 3.525 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCC(CO)(c3ccccc3)CC2)c2ccncc21 ZINC000431503589 936255567 /nfs/dbraw/zinc/25/55/67/936255567.db2.gz BNQKGFJARNYRRO-UHFFFAOYSA-N 0 0 363.417 3.674 20 5 FHBDRN Cc1cccc(-c2nnc(Sc3ncc(Cl)cc3[N+](=O)[O-])n2C)c1 ZINC000153543421 936257792 /nfs/dbraw/zinc/25/77/92/936257792.db2.gz SSNVEOQBNZSSBR-UHFFFAOYSA-N 0 0 361.814 3.898 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1F)N1CCCO[C@H](c2ccccc2)C1 ZINC000612611924 936283754 /nfs/dbraw/zinc/28/37/54/936283754.db2.gz UQHGMKZDVGOYJV-KRWDZBQOSA-N 0 0 359.357 3.729 20 5 FHBDRN CC[C@H]1CN(C)c2ccccc2CN1C(=O)Nc1ccc([N+](=O)[O-])cc1F ZINC000612616034 936284260 /nfs/dbraw/zinc/28/42/60/936284260.db2.gz ONVDIFUARNEYFL-AWEZNQCLSA-N 0 0 372.400 3.996 20 5 FHBDRN CC[C@@H](C)NC(=O)c1cccc(CNc2ncc(Cl)cc2[N+](=O)[O-])c1 ZINC000153593515 936295167 /nfs/dbraw/zinc/29/51/67/936295167.db2.gz IEFHQAKKFAQPHK-LLVKDONJSA-N 0 0 362.817 3.784 20 5 FHBDRN CCOc1cc(OCc2nc(-c3ccc(C)cc3)no2)ccc1[N+](=O)[O-] ZINC000516697985 945154326 /nfs/dbraw/zinc/15/43/26/945154326.db2.gz PZBIHZFCMWZCSC-UHFFFAOYSA-N 0 0 355.350 3.931 20 5 FHBDRN O=[N+]([O-])c1ccccc1-n1ccc(-c2nc([C@@H]3CCCCS3)no2)n1 ZINC000545102875 936297244 /nfs/dbraw/zinc/29/72/44/936297244.db2.gz VDZDVMHSHZTTIC-AWEZNQCLSA-N 0 0 357.395 3.789 20 5 FHBDRN Cn1cc(-c2noc(/C=C\c3ccccc3[N+](=O)[O-])n2)c(C(F)(F)F)n1 ZINC000426208802 945159632 /nfs/dbraw/zinc/15/96/32/945159632.db2.gz FNCRSQHKLODQAY-SREVYHEPSA-N 0 0 365.271 3.568 20 5 FHBDRN COc1cc(F)cc(CNc2c(Br)cncc2[N+](=O)[O-])c1 ZINC000091684707 938254197 /nfs/dbraw/zinc/25/41/97/938254197.db2.gz XDOIZNAOJAKIGA-UHFFFAOYSA-N 0 0 356.151 3.512 20 5 FHBDRN O=C(NCC1(O)CCCCC1)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000278281173 938278338 /nfs/dbraw/zinc/27/83/38/938278338.db2.gz ZBAQUBMPEMWPFM-UHFFFAOYSA-N 0 0 350.418 3.519 20 5 FHBDRN CCC(=O)Nc1ccc(Cl)c(NC(=O)c2ccc([N+](=O)[O-])cc2F)c1 ZINC000055410773 938290442 /nfs/dbraw/zinc/29/04/42/938290442.db2.gz KLQAIVZAZFLRIW-UHFFFAOYSA-N 0 0 365.748 3.988 20 5 FHBDRN C[C@@H]1Oc2ccccc2[C@H]1NC(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000583521269 938290781 /nfs/dbraw/zinc/29/07/81/938290781.db2.gz BIVAZRXNUPAKSG-QFYYESIMSA-N 0 0 361.785 3.570 20 5 FHBDRN CC(C)(C)n1nccc1NC(=O)c1sc(Br)cc1[N+](=O)[O-] ZINC000278299852 938293374 /nfs/dbraw/zinc/29/33/74/938293374.db2.gz SETNJSXOEDGKAE-UHFFFAOYSA-N 0 0 373.232 3.623 20 5 FHBDRN Cc1cc(Cl)c(C(=O)NCc2nc(C)c3ccccc3n2)cc1[N+](=O)[O-] ZINC001125673243 938295251 /nfs/dbraw/zinc/29/52/51/938295251.db2.gz SOBQKQZBRULEQH-UHFFFAOYSA-N 0 0 370.796 3.738 20 5 FHBDRN CCCOc1ccc2c(c1)CCN(C(=O)NCc1cccc([N+](=O)[O-])c1)C2 ZINC000178919269 938300169 /nfs/dbraw/zinc/30/01/69/938300169.db2.gz MJVJTXKAILCIMO-UHFFFAOYSA-N 0 0 369.421 3.652 20 5 FHBDRN CN(C(=O)c1ccn(-c2ccc(Cl)cc2)n1)c1ccc([N+](=O)[O-])cc1 ZINC000536078445 938310049 /nfs/dbraw/zinc/31/00/49/938310049.db2.gz QHIHQLMTLZCAPO-UHFFFAOYSA-N 0 0 356.769 3.711 20 5 FHBDRN COc1ccc(OC)c([C@@H]2C[C@@H]2c2nc(-c3ccc([N+](=O)[O-])s3)no2)c1 ZINC000583590665 938311175 /nfs/dbraw/zinc/31/11/75/938311175.db2.gz CIVIKEPCUVHOMW-JQWIXIFHSA-N 0 0 373.390 3.995 20 5 FHBDRN O=[N+]([O-])c1c(NCCCCOCCc2ccccc2)nc2sccn21 ZINC000052457894 938312596 /nfs/dbraw/zinc/31/25/96/938312596.db2.gz JZHPAUJRRFIDOU-UHFFFAOYSA-N 0 0 360.439 3.755 20 5 FHBDRN Cc1cc(F)c([N+](=O)[O-])cc1C(=O)NCc1cccc(OCC(F)F)c1 ZINC001125683876 938312787 /nfs/dbraw/zinc/31/27/87/938312787.db2.gz YPTFHRFOHBKFGL-UHFFFAOYSA-N 0 0 368.311 3.616 20 5 FHBDRN O=[N+]([O-])c1cnn(CCSCc2ccc(Br)cc2F)c1 ZINC000162088429 938325689 /nfs/dbraw/zinc/32/56/89/938325689.db2.gz DIYZWYOXICZQCN-UHFFFAOYSA-N 0 0 360.208 3.626 20 5 FHBDRN O=C(CN1CCc2c1cccc2[N+](=O)[O-])Nc1ccccc1C(F)(F)F ZINC000178947776 938336048 /nfs/dbraw/zinc/33/60/48/938336048.db2.gz HFPABVZZTJJIRG-UHFFFAOYSA-N 0 0 365.311 3.615 20 5 FHBDRN C[C@@H](NC(=O)N1CCOC[C@@H]1c1ccc(F)cc1)c1ccccc1[N+](=O)[O-] ZINC000458624358 938337435 /nfs/dbraw/zinc/33/74/35/938337435.db2.gz RONCFGGRLQHSRV-FZKQIMNGSA-N 0 0 373.384 3.578 20 5 FHBDRN Cc1nc(N[C@H](c2ccn(C)n2)c2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000545165466 938343353 /nfs/dbraw/zinc/34/33/53/938343353.db2.gz JZOOYPUSVXWZSY-KRWDZBQOSA-N 0 0 357.801 3.887 20 5 FHBDRN O=[N+]([O-])c1ccc2ccnc(N3C[C@H]4CN(c5ccccc5)C[C@H]4C3)c2c1 ZINC000583680197 938358261 /nfs/dbraw/zinc/35/82/61/938358261.db2.gz KHOOWZXXAFSXGA-CALCHBBNSA-N 0 0 360.417 3.716 20 5 FHBDRN C[S@](=O)Cc1ccc(CNc2ccnc3c2cccc3[N+](=O)[O-])cc1 ZINC000432137167 945168529 /nfs/dbraw/zinc/16/85/29/945168529.db2.gz CVZSLQHOHBMFEQ-VWLOTQADSA-N 0 0 355.419 3.634 20 5 FHBDRN CS(=O)(=O)c1ccc(N2CC3(CCC3)[C@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000432135063 945169065 /nfs/dbraw/zinc/16/90/65/945169065.db2.gz XLIGRTAYRGGUFG-GOSISDBHSA-N 0 0 372.446 3.730 20 5 FHBDRN COC(=O)c1cc(C)nc(N2CC3(CCC3)[C@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000432134760 945170262 /nfs/dbraw/zinc/17/02/62/945170262.db2.gz VSSIKBFQKSOXQQ-QGZVFWFLSA-N 0 0 367.405 3.816 20 5 FHBDRN CC(C)CO[C@H](C)c1noc(COc2c(Cl)cccc2[N+](=O)[O-])n1 ZINC000130652266 938426612 /nfs/dbraw/zinc/42/66/12/938426612.db2.gz CATZHDMJAKURQC-SNVBAGLBSA-N 0 0 355.778 3.944 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)NCC1(Cc2ccc(F)cc2)CC1 ZINC000536135572 938429651 /nfs/dbraw/zinc/42/96/51/938429651.db2.gz JRBDASRSRHCHPL-UHFFFAOYSA-N 0 0 371.412 3.599 20 5 FHBDRN Cc1c(NC(=O)C(=O)N[C@@H]2CCC[C@@H]2CCC(C)C)cccc1[N+](=O)[O-] ZINC000070026187 938435793 /nfs/dbraw/zinc/43/57/93/938435793.db2.gz UWYODNVXOMDWPF-GDBMZVCRSA-N 0 0 361.442 3.563 20 5 FHBDRN C[C@@H]1C[C@H](CNC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)CCO1 ZINC000536149604 938459635 /nfs/dbraw/zinc/45/96/35/938459635.db2.gz HMBXPVPVOHICNX-HUUCEWRRSA-N 0 0 370.405 3.932 20 5 FHBDRN CN(CC(F)(F)F)C(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000065640949 938462168 /nfs/dbraw/zinc/46/21/68/938462168.db2.gz WQIQBHYOYMBLOX-UHFFFAOYSA-N 0 0 367.327 3.841 20 5 FHBDRN CC1(C)CN(c2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])Cc2ccccc21 ZINC000536154496 938467431 /nfs/dbraw/zinc/46/74/31/938467431.db2.gz HRYZQSMVKLDJNU-UHFFFAOYSA-N 0 0 365.433 3.785 20 5 FHBDRN Cc1nnc(N(Cc2cccc([N+](=O)[O-])c2)C2CC2)n1Cc1ccccc1 ZINC000583905206 938476807 /nfs/dbraw/zinc/47/68/07/938476807.db2.gz OGSMUFRUQCMPJH-UHFFFAOYSA-N 0 0 363.421 3.712 20 5 FHBDRN Cc1ccc(NC(=O)c2csc([N+](=O)[O-])c2)cc1C(=O)N1CCCCC1 ZINC000278491537 938477421 /nfs/dbraw/zinc/47/74/21/938477421.db2.gz MEBRLCVGCYTYSB-UHFFFAOYSA-N 0 0 373.434 3.843 20 5 FHBDRN C[C@H](C(=O)N1CCC[C@H]1c1cccs1)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000046599766 938481141 /nfs/dbraw/zinc/48/11/41/938481141.db2.gz CPYHZCGTOBVIBO-PBHICJAKSA-N 0 0 373.478 3.840 20 5 FHBDRN COc1ccc(F)cc1[C@@H](C)NC(=O)c1cc(F)c([N+](=O)[O-])cc1F ZINC000135456826 938490740 /nfs/dbraw/zinc/49/07/40/938490740.db2.gz NFZNNORDTPCNAN-MRVPVSSYSA-N 0 0 354.284 3.512 20 5 FHBDRN CN(C[C@H]1CCCOC1)c1cc(C(F)(F)C(F)(F)F)ncc1[N+](=O)[O-] ZINC000278510037 938492510 /nfs/dbraw/zinc/49/25/10/938492510.db2.gz RGUWPDXPUMAQOZ-SECBINFHSA-N 0 0 369.290 3.507 20 5 FHBDRN Cc1ccnc([C@@H](NC(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)C2CC2)n1 ZINC000135467399 938510424 /nfs/dbraw/zinc/51/04/24/938510424.db2.gz YKHGPPHNWJAGBA-KRWDZBQOSA-N 0 0 368.437 3.872 20 5 FHBDRN Cc1ccc(CC[C@@H](C)NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)o1 ZINC000536180187 938521934 /nfs/dbraw/zinc/52/19/34/938521934.db2.gz FLXRSHGPKHEQGP-GFCCVEGCSA-N 0 0 355.394 3.658 20 5 FHBDRN CCc1cnc(CNc2cc(C(F)(F)C(F)(F)F)ncc2[N+](=O)[O-])o1 ZINC000278549327 938525201 /nfs/dbraw/zinc/52/52/01/938525201.db2.gz VPZRFQMLKFNNEB-UHFFFAOYSA-N 0 0 366.246 3.806 20 5 FHBDRN CC(C)[C@H](Nc1ncc([N+](=O)[O-])cc1Br)C(=O)OC(C)(C)C ZINC000302002884 938533015 /nfs/dbraw/zinc/53/30/15/938533015.db2.gz SWQWOCHRRPYHHU-NSHDSACASA-N 0 0 374.235 3.531 20 5 FHBDRN C[C@H]1C[C@@H](Nc2cc(C(F)(F)C(F)(F)F)ncc2[N+](=O)[O-])CCO1 ZINC000278582844 938553944 /nfs/dbraw/zinc/55/39/44/938553944.db2.gz YFYBPIVBQNAEMT-YUMQZZPRSA-N 0 0 355.263 3.623 20 5 FHBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)N[C@@H]1CCC[C@@H]1c1ccccc1 ZINC000536207702 938581283 /nfs/dbraw/zinc/58/12/83/938581283.db2.gz CLHAUGQQFGZOBJ-RTBURBONSA-N 0 0 353.422 3.773 20 5 FHBDRN CN(CCCCc1ccccc1)C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000536207740 938581294 /nfs/dbraw/zinc/58/12/94/938581294.db2.gz CDEMCFYOELKQEJ-UHFFFAOYSA-N 0 0 355.438 3.802 20 5 FHBDRN CCc1ccc(C(=O)N(Cc2ccccc2)C[C@@](C)(O)CC)cc1[N+](=O)[O-] ZINC000440027671 945187548 /nfs/dbraw/zinc/18/75/48/945187548.db2.gz ONJPESYNCUZKEO-NRFANRHFSA-N 0 0 370.449 3.961 20 5 FHBDRN Cc1ccc2c(c1)CCN(C(=O)CCOc1cc(C)ccc1[N+](=O)[O-])C2 ZINC000584071285 938583802 /nfs/dbraw/zinc/58/38/02/938583802.db2.gz XGFDYQKGOLGFOW-UHFFFAOYSA-N 0 0 354.406 3.565 20 5 FHBDRN Cc1c(C(=O)Nc2ccc3c(c2)CCCN3)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000179037864 938584125 /nfs/dbraw/zinc/58/41/25/938584125.db2.gz NZTIPWURVIBHQM-UHFFFAOYSA-N 0 0 370.365 3.730 20 5 FHBDRN Cc1cc(OS(=O)(=O)CCc2ccc(Cl)cc2)c(F)cc1[N+](=O)[O-] ZINC001211609571 938585425 /nfs/dbraw/zinc/58/54/25/938585425.db2.gz WWEDTGOMWLMGSR-UHFFFAOYSA-N 0 0 373.789 3.647 20 5 FHBDRN CC(C)(CNC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1ccncc1 ZINC000091837140 938586177 /nfs/dbraw/zinc/58/61/77/938586177.db2.gz FNKWDSBNDJCHEC-UHFFFAOYSA-N 0 0 367.327 3.716 20 5 FHBDRN COc1cc(C(=O)Nc2ccc(F)cc2-n2cccc2)ccc1[N+](=O)[O-] ZINC000546049227 945188270 /nfs/dbraw/zinc/18/82/70/945188270.db2.gz XMPLXNYXLCSCFO-UHFFFAOYSA-N 0 0 355.325 3.786 20 5 FHBDRN Cc1noc2nc(C)cc(C(=O)Nc3cc([N+](=O)[O-])c(Cl)cc3C)c12 ZINC000135494550 938595457 /nfs/dbraw/zinc/59/54/57/938595457.db2.gz KSKPVWUVSASKRA-UHFFFAOYSA-N 0 0 360.757 3.962 20 5 FHBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)c1cc2c(s1)CCOC2 ZINC000135496755 938596866 /nfs/dbraw/zinc/59/68/66/938596866.db2.gz JGNVNJZVXAVBPD-UHFFFAOYSA-N 0 0 352.799 3.943 20 5 FHBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)CCc1nc(C(C)C)no1 ZINC000135494370 938599010 /nfs/dbraw/zinc/59/90/10/938599010.db2.gz OXMNUNMXZDAIIE-UHFFFAOYSA-N 0 0 352.778 3.634 20 5 FHBDRN Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)c1cccc(C(=O)N(C)C)c1 ZINC000135497666 938599914 /nfs/dbraw/zinc/59/99/14/938599914.db2.gz UJXGNBCCRYRRPX-UHFFFAOYSA-N 0 0 361.785 3.511 20 5 FHBDRN CN(CCCNC(=O)OC(C)(C)C)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000782475624 938602281 /nfs/dbraw/zinc/60/22/81/938602281.db2.gz JIBODHQBLDOZKP-UHFFFAOYSA-N 0 0 357.838 3.595 20 5 FHBDRN C[C@@H](c1cccc(Cl)c1)N(C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1F ZINC000056119023 938625034 /nfs/dbraw/zinc/62/50/34/938625034.db2.gz UHADSCIGOXKNNX-JTQLQIEISA-N 0 0 372.805 3.769 20 5 FHBDRN COC(=O)c1cc(C(=O)Nc2cc(C)c(F)cc2Cl)cc([N+](=O)[O-])c1 ZINC000584196204 938636452 /nfs/dbraw/zinc/63/64/52/938636452.db2.gz IIELPVLTHSHUHN-UHFFFAOYSA-N 0 0 366.732 3.735 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H](CSC)C1 ZINC000584190109 938636561 /nfs/dbraw/zinc/63/65/61/938636561.db2.gz KKJNGJGGQNMZHG-GFCCVEGCSA-N 0 0 354.497 3.922 20 5 FHBDRN CCc1ccc(C(=O)NC[C@H]2CC[C@H](c3ccccc3)O2)cc1[N+](=O)[O-] ZINC000584254763 938660988 /nfs/dbraw/zinc/66/09/88/938660988.db2.gz DMTBJHCPFUEDIS-IEBWSBKVSA-N 0 0 354.406 3.807 20 5 FHBDRN Cc1cc(C)cc(NC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)c1 ZINC000052933655 938662582 /nfs/dbraw/zinc/66/25/82/938662582.db2.gz HKFRUVLAOYIRGM-UHFFFAOYSA-N 0 0 350.378 3.864 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(NC2(Cc3ccc(F)cc3)CCOCC2)n1 ZINC000432144099 945194028 /nfs/dbraw/zinc/19/40/28/945194028.db2.gz VAOMHTDVJMOUTC-UHFFFAOYSA-N 0 0 359.401 3.950 20 5 FHBDRN CC(C)(C(=O)NCCC1Cc2ccccc2C1)c1ccc([N+](=O)[O-])cc1F ZINC000584264729 938664842 /nfs/dbraw/zinc/66/48/42/938664842.db2.gz PFFDNYGXQGIGRZ-UHFFFAOYSA-N 0 0 370.424 3.933 20 5 FHBDRN CCNC(=O)Nc1cccc(NC(=O)[C@H](C)c2cccc([N+](=O)[O-])c2)c1C ZINC000584266165 938665416 /nfs/dbraw/zinc/66/54/16/938665416.db2.gz NURQAIFKKYOQKB-GFCCVEGCSA-N 0 0 370.409 3.787 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)Oc1ccc(NC(=O)c2ccco2)cc1 ZINC000065651351 938674123 /nfs/dbraw/zinc/67/41/23/938674123.db2.gz QJHRXZXTHVFCRM-UHFFFAOYSA-N 0 0 366.329 3.968 20 5 FHBDRN CCCN(C(=O)c1ccc(NC)c([N+](=O)[O-])c1)[C@H]1CCCc2cccnc21 ZINC000573179045 938678533 /nfs/dbraw/zinc/67/85/33/938678533.db2.gz HOGDUZNWCMAGEN-KRWDZBQOSA-N 0 0 368.437 3.961 20 5 FHBDRN C[C@H](CNC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1)Oc1ccccc1Cl ZINC000584325730 938687724 /nfs/dbraw/zinc/68/77/24/938687724.db2.gz YKCKDPLXOCPQPP-OLZOCXBDSA-N 0 0 362.813 3.935 20 5 FHBDRN CCN(Cc1ccccc1NC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1)C(C)=O ZINC000573185291 938689713 /nfs/dbraw/zinc/68/97/13/938689713.db2.gz ASKVJRYPHAKEDD-CQSZACIVSA-N 0 0 369.421 3.705 20 5 FHBDRN COc1cccc(CCC(=O)NC(C)(C)c2ccccc2[N+](=O)[O-])c1OC ZINC000573193207 938694551 /nfs/dbraw/zinc/69/45/51/938694551.db2.gz WTZIITIMTQAXFY-UHFFFAOYSA-N 0 0 372.421 3.596 20 5 FHBDRN C[C@@H](NC(=O)c1ccc([N+](=O)[O-])s1)c1nc(C(F)(F)F)cs1 ZINC000278731267 938697427 /nfs/dbraw/zinc/69/74/27/938697427.db2.gz LVIKTSJPRSWOJG-RXMQYKEDSA-N 0 0 351.331 3.623 20 5 FHBDRN CCOC(=O)c1ccnc(N2CC3(CCC3)[C@@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000432148575 945197322 /nfs/dbraw/zinc/19/73/22/945197322.db2.gz NBMZAPAKUSGLOY-KRWDZBQOSA-N 0 0 367.405 3.898 20 5 FHBDRN COc1cc(N(C)CC(=O)Nc2c(C)cc(C)cc2C)ccc1[N+](=O)[O-] ZINC000080946506 938709073 /nfs/dbraw/zinc/70/90/73/938709073.db2.gz MEJATIVIQQCDHB-UHFFFAOYSA-N 0 0 357.410 3.604 20 5 FHBDRN O=C(N[C@@H]1C[C@H]1c1c(F)cccc1F)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000437286748 945201338 /nfs/dbraw/zinc/20/13/38/945201338.db2.gz DFNRIQAOENQDNP-BDJLRTHQSA-N 0 0 357.316 3.640 20 5 FHBDRN CCOc1cc(NC(=O)NCc2cccs2)c([N+](=O)[O-])cc1OCC ZINC000047466899 945208019 /nfs/dbraw/zinc/20/80/19/945208019.db2.gz MJXBUDUWYVOHGF-UHFFFAOYSA-N 0 0 365.411 3.775 20 5 FHBDRN O=C(c1cnc([C@H]2CCCO2)s1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000128167689 938788072 /nfs/dbraw/zinc/78/80/72/938788072.db2.gz UADQXLLMUMTTIA-OAHLLOKOSA-N 0 0 373.434 3.708 20 5 FHBDRN O=C(Nc1ncc(Br)s1)c1ccc([N+](=O)[O-])cc1Cl ZINC000070192782 938788910 /nfs/dbraw/zinc/78/89/10/938788910.db2.gz NCCLEHKEVIPBGF-UHFFFAOYSA-N 0 0 362.592 3.720 20 5 FHBDRN Cc1ccc(OCCN(C)C(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)cc1 ZINC000024184864 938798521 /nfs/dbraw/zinc/79/85/21/938798521.db2.gz WVUKXXOMMGIOOH-OAHLLOKOSA-N 0 0 374.462 3.921 20 5 FHBDRN CCc1ccc(C(=O)Nc2ccccc2-c2noc(C)n2)cc1[N+](=O)[O-] ZINC000081848171 938805224 /nfs/dbraw/zinc/80/52/24/938805224.db2.gz WOJBJSYVYIJGGP-UHFFFAOYSA-N 0 0 352.350 3.768 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCc2cc(N)ccc21 ZINC000573221951 938805446 /nfs/dbraw/zinc/80/54/46/938805446.db2.gz WOLZSHJGXNWOOR-LJQANCHMSA-N 0 0 368.437 3.785 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(N2CCC[C@@H](CNC(=O)c3ccccc3)C2)c1 ZINC000088727292 938852209 /nfs/dbraw/zinc/85/22/09/938852209.db2.gz CXOJSHKHANHRHR-INIZCTEOSA-N 0 0 353.422 3.550 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(N2CCC[C@H](CNC(=O)c3ccccc3)C2)c1 ZINC000088727291 938852267 /nfs/dbraw/zinc/85/22/67/938852267.db2.gz CXOJSHKHANHRHR-MRXNPFEDSA-N 0 0 353.422 3.550 20 5 FHBDRN Cn1ccc2ccc(NC(=O)N3CCc4ccc([N+](=O)[O-])cc4C3)cc21 ZINC000088390921 938854768 /nfs/dbraw/zinc/85/47/68/938854768.db2.gz KHZPAFHYMTUTID-UHFFFAOYSA-N 0 0 350.378 3.677 20 5 FHBDRN Cc1cccc(C)c1OCCCNC(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000065670939 938858057 /nfs/dbraw/zinc/85/80/57/938858057.db2.gz CRSHFMBJWQBSAR-UHFFFAOYSA-N 0 0 374.462 3.889 20 5 FHBDRN O=C(NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CC[C@@H]2CCCC[C@@H]21 ZINC000573241423 938859943 /nfs/dbraw/zinc/85/99/43/938859943.db2.gz DMCCGHSOOYJVGM-UGSOOPFHSA-N 0 0 356.426 3.593 20 5 FHBDRN CCCOC(=O)c1ccc(NC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])cc1 ZINC000065668197 938861064 /nfs/dbraw/zinc/86/10/64/938861064.db2.gz NQLNBNFQWDVLGM-UHFFFAOYSA-N 0 0 364.304 3.692 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])o1)N(Cc1ccccc1)C[C@H](O)c1ccsc1 ZINC000162214520 938863730 /nfs/dbraw/zinc/86/37/30/938863730.db2.gz PSLUCTHOZRFYAY-HNNXBMFYSA-N 0 0 372.402 3.625 20 5 FHBDRN CCn1nnnc1-c1cccc(N[C@H](C)c2cc([N+](=O)[O-])ccc2C)c1 ZINC000540826621 938870408 /nfs/dbraw/zinc/87/04/08/938870408.db2.gz KBIJFTIIQRDZIT-CYBMUJFWSA-N 0 0 352.398 3.750 20 5 FHBDRN Cc1cc(OCC(=O)NCc2cc(F)cc(F)c2)c(Cl)cc1[N+](=O)[O-] ZINC000506433870 945212155 /nfs/dbraw/zinc/21/21/55/945212155.db2.gz POHQJNAKPNYEBW-UHFFFAOYSA-N 0 0 370.739 3.530 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc2c(c1)NC(=O)CC2 ZINC000158848145 938890836 /nfs/dbraw/zinc/89/08/36/938890836.db2.gz CHDMTKJVJQFIFR-UHFFFAOYSA-N 0 0 371.418 3.844 20 5 FHBDRN Cc1c(CC(=O)Nc2ccc(Br)cc2F)cccc1[N+](=O)[O-] ZINC000158845407 938891743 /nfs/dbraw/zinc/89/17/43/938891743.db2.gz YDSRJWYRXOWKAV-UHFFFAOYSA-N 0 0 367.174 3.986 20 5 FHBDRN CC[C@@H](OC(=O)c1cc(C(F)(F)F)nn1C)c1cccc([N+](=O)[O-])c1 ZINC001267373912 938896991 /nfs/dbraw/zinc/89/69/91/938896991.db2.gz BNXQFZXESJFOFV-GFCCVEGCSA-N 0 0 357.288 3.655 20 5 FHBDRN Cc1c(C(=O)N[C@@H](C[C@H]2CCOC2)c2ccccc2)cccc1[N+](=O)[O-] ZINC000158853582 938911360 /nfs/dbraw/zinc/91/13/60/938911360.db2.gz FJXWBEMMCUGNRW-QAPCUYQASA-N 0 0 354.406 3.801 20 5 FHBDRN Cc1c(C(=O)N[C@H](C[C@H]2CCOC2)c2ccccc2)cccc1[N+](=O)[O-] ZINC000158853723 938911386 /nfs/dbraw/zinc/91/13/86/938911386.db2.gz FJXWBEMMCUGNRW-CRAIPNDOSA-N 0 0 354.406 3.801 20 5 FHBDRN O=[N+]([O-])c1cccc(Oc2ccc3nnc(-c4ccccc4F)n3n2)c1 ZINC000092581604 938920200 /nfs/dbraw/zinc/92/02/00/938920200.db2.gz NSLDZLZWBMJSIY-UHFFFAOYSA-N 0 0 351.297 3.631 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N1CCO[C@@H](c2ccccc2)C1 ZINC000093916420 938931854 /nfs/dbraw/zinc/93/18/54/938931854.db2.gz PMGNXXORWGDUSS-QGZVFWFLSA-N 0 0 354.406 3.734 20 5 FHBDRN C[C@@H]1CN(C(=O)c2ccc(Cl)cc2[N+](=O)[O-])C[C@H](c2ccccc2)O1 ZINC000140074125 938944715 /nfs/dbraw/zinc/94/47/15/938944715.db2.gz YJOPBTGRVWASQN-SJKOYZFVSA-N 0 0 360.797 3.850 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1c2ccccc2CC[C@@H]1C ZINC000065685343 938944999 /nfs/dbraw/zinc/94/49/99/938944999.db2.gz YSBKCJXXPUITSS-ZDUSSCGKSA-N 0 0 360.435 3.687 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(S(=O)(=O)NC(C)(C)c2ccc(F)cc2)cc1C ZINC000728591856 938953096 /nfs/dbraw/zinc/95/30/96/938953096.db2.gz NDYMTOJCTCDMFY-UHFFFAOYSA-N 0 0 366.414 3.564 20 5 FHBDRN CN(C)c1cc(F)c(C(=O)Nc2cccc3c2ccn3C)cc1[N+](=O)[O-] ZINC001125716335 938977224 /nfs/dbraw/zinc/97/72/24/938977224.db2.gz NKFCOBAIXVCWJA-UHFFFAOYSA-N 0 0 356.357 3.544 20 5 FHBDRN CC[C@@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](O)c1ccccc1 ZINC000728593945 938978274 /nfs/dbraw/zinc/97/82/74/938978274.db2.gz KSMYIFRSHVNQIW-ZBFHGGJFSA-N 0 0 363.801 3.882 20 5 FHBDRN Cc1sc2[nH]c(Cc3c[nH]c4ccc([N+](=O)[O-])cc34)nc(=O)c2c1C ZINC000179150768 938979779 /nfs/dbraw/zinc/97/97/79/938979779.db2.gz BXCGBPASHMZDDP-UHFFFAOYSA-N 0 0 354.391 3.582 20 5 FHBDRN CN(C(=O)COc1ccc([N+](=O)[O-])c2cccnc12)C1CCCCCC1 ZINC000431576352 938980754 /nfs/dbraw/zinc/98/07/54/938980754.db2.gz CSFUJJJWKLOEJK-UHFFFAOYSA-N 0 0 357.410 3.703 20 5 FHBDRN O=[N+]([O-])c1cc(Br)cnc1NC[C@@H]1CCCC(F)(F)C1 ZINC000409647492 938981683 /nfs/dbraw/zinc/98/16/83/938981683.db2.gz JNKZLQYZXVTEGF-MRVPVSSYSA-N 0 0 350.163 3.990 20 5 FHBDRN CCOc1cc(NC(=O)N2CCC(C)=C(C)C2)c([N+](=O)[O-])cc1OCC ZINC000431577948 938981966 /nfs/dbraw/zinc/98/19/66/938981966.db2.gz JARAMAXYMSOKML-UHFFFAOYSA-N 0 0 363.414 3.966 20 5 FHBDRN COc1ccc2cccc(CC(=O)NCc3cccc([N+](=O)[O-])c3)c2c1 ZINC000179182266 938983332 /nfs/dbraw/zinc/98/33/32/938983332.db2.gz RKHFZECSXFCSMM-UHFFFAOYSA-N 0 0 350.374 3.616 20 5 FHBDRN COC(=O)/C=C\c1ccc(NCc2ccc3ncccc3c2)c([N+](=O)[O-])c1 ZINC000588616312 938989336 /nfs/dbraw/zinc/98/93/36/938989336.db2.gz KNFDWOXJKNVGCH-TWGQIWQCSA-N 0 0 363.373 3.941 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2nc(CN3CCOC4(CCCCC4)C3)co2)cc1 ZINC000179208536 938990645 /nfs/dbraw/zinc/99/06/45/938990645.db2.gz YGWLKKPKDFEENO-UHFFFAOYSA-N 0 0 357.410 3.785 20 5 FHBDRN COc1ccc([C@@H](C)NC(=O)c2ccc(SC)c([N+](=O)[O-])c2)cc1F ZINC000024314055 938991830 /nfs/dbraw/zinc/99/18/30/938991830.db2.gz WLNZPXOJFQBFQD-SNVBAGLBSA-N 0 0 364.398 3.955 20 5 FHBDRN CCOCCOc1cc(C)ccc1CNC(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000128269202 938991975 /nfs/dbraw/zinc/99/19/75/938991975.db2.gz QKKUHUGRVHMZIP-UHFFFAOYSA-N 0 0 373.409 3.640 20 5 FHBDRN Cc1c(NC(=O)[C@@H](C)Sc2ncc3ccccn32)cccc1[N+](=O)[O-] ZINC000024309320 938992391 /nfs/dbraw/zinc/99/23/91/938992391.db2.gz NZUZTSFZPOAHDD-GFCCVEGCSA-N 0 0 356.407 3.670 20 5 FHBDRN C[C@@H]1c2cccc(Br)c2CCN1c1ncc([N+](=O)[O-])s1 ZINC000409717667 938992548 /nfs/dbraw/zinc/99/25/48/938992548.db2.gz ROWDGADWOQZTNR-MRVPVSSYSA-N 0 0 354.229 3.938 20 5 FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N(C)[C@@H]1CCC[C@H](C)C1 ZINC000179238316 938996420 /nfs/dbraw/zinc/99/64/20/938996420.db2.gz KLCCLFAHLPISMS-UONOGXRCSA-N 0 0 366.483 3.984 20 5 FHBDRN C[C@@H](c1ccccc1)N(C)C(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000179240024 938996463 /nfs/dbraw/zinc/99/64/63/938996463.db2.gz FJASZEMLTJQHPU-AWEZNQCLSA-N 0 0 350.378 3.614 20 5 FHBDRN COc1ccc(CSCc2ccc(C(N)=O)cc2[N+](=O)[O-])cc1Cl ZINC000179235569 938996477 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CCc1n[nH]c(C(=O)N(CC)[C@@H](C)c2cc3ccccc3o2)c1[N+](=O)[O-] ZINC000188271332 939126217 /nfs/dbraw/zinc/12/62/17/939126217.db2.gz BGYUWJJSKWHJFZ-NSHDSACASA-N 0 0 356.382 3.850 20 5 FHBDRN C[C@@H](c1ccc(F)cc1)N(C)C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000179384236 939139613 /nfs/dbraw/zinc/13/96/13/939139613.db2.gz HOYWQHVNUVARSK-LBPRGKRZSA-N 0 0 355.369 3.977 20 5 FHBDRN CC(C)(C)N1C[C@H](NC(=O)c2cc3ccccc3c3cccnc23)CC1=O ZINC000472367437 939140318 /nfs/dbraw/zinc/14/03/18/939140318.db2.gz JEXUUZSJQWUYIT-OAHLLOKOSA-N 0 0 361.445 3.517 20 5 FHBDRN C[C@H](CNC(=O)CCc1c(Cl)cccc1[N+](=O)[O-])c1nccs1 ZINC000935375111 939159897 /nfs/dbraw/zinc/15/98/97/939159897.db2.gz FZEHKXUKUXMILU-SNVBAGLBSA-N 0 0 353.831 3.557 20 5 FHBDRN O=C(N[C@@H]1CCCC[C@H]1O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000179458909 939163028 /nfs/dbraw/zinc/16/30/28/939163028.db2.gz XWNYIKKDWUXJGR-IAGOWNOFSA-N 0 0 372.446 3.779 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N1CCCN(c2ccccc2)CC1 ZINC000179452841 939163812 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FHBDRN CCCCc1cnc(NC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)nc1 ZINC000411077139 939993954 /nfs/dbraw/zinc/99/39/54/939993954.db2.gz YGCYGPRNRRCGSZ-GFCCVEGCSA-N 0 0 360.439 3.847 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc2c(n1)CCCC2=O ZINC000411066779 939996583 /nfs/dbraw/zinc/99/65/83/939996583.db2.gz BHHUIZPUBIZOFQ-UHFFFAOYSA-N 0 0 371.418 3.873 20 5 FHBDRN COc1cccc(C(=O)N2CCC[C@@H]2c2ccc(F)cc2F)c1[N+](=O)[O-] ZINC000411074881 939998287 /nfs/dbraw/zinc/99/82/87/939998287.db2.gz NMVOWGCFNDNLPH-OAHLLOKOSA-N 0 0 362.332 3.859 20 5 FHBDRN COc1ccc(OC)c([C@@H](C)NC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)c1 ZINC000411174346 940006890 /nfs/dbraw/zinc/00/68/90/940006890.db2.gz BJFYSISTMUPUOV-OCBCSQNSSA-N 0 0 370.405 3.593 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc2[nH]c(C(F)F)nc2c1 ZINC000179862207 940014136 /nfs/dbraw/zinc/01/41/36/940014136.db2.gz VHDKUWMTRMITEZ-UHFFFAOYSA-N 0 0 360.320 3.980 20 5 FHBDRN CC(C)Oc1cc(C(=O)Nc2nc3c(s2)CCCC3)ccc1[N+](=O)[O-] ZINC000411212061 940018732 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3.555 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)C(=O)NCc1cccc(C(C)C)c1 ZINC000411373080 940033017 /nfs/dbraw/zinc/03/30/17/940033017.db2.gz XINWYELFXYVYMR-UHFFFAOYSA-N 0 0 369.421 3.590 20 5 FHBDRN Cc1nc(CC2CC2)sc1C(=O)N1c2ccc([N+](=O)[O-])cc2C[C@H]1C ZINC000188530935 940037465 /nfs/dbraw/zinc/03/74/65/940037465.db2.gz LLIMSIGDGMPMIK-SNVBAGLBSA-N 0 0 357.435 3.904 20 5 FHBDRN CC[C@@H]1CCCC[C@H]1N(C)C(=O)C(=O)Nc1cc([N+](=O)[O-])c(C)cc1C ZINC000411420076 940040537 /nfs/dbraw/zinc/04/05/37/940040537.db2.gz UPPYYLGBGRYWDV-GDBMZVCRSA-N 0 0 361.442 3.577 20 5 FHBDRN COc1ccc(NC(=O)COc2ccc(Cl)cc2C)c([N+](=O)[O-])c1 ZINC000005535540 940048458 /nfs/dbraw/zinc/04/84/58/940048458.db2.gz ROELYVMOSTUATI-UHFFFAOYSA-N 0 0 350.758 3.583 20 5 FHBDRN CC[C@@]1(c2ccccc2)NC(=O)N([C@H](C)c2cccc([N+](=O)[O-])c2)C1=O ZINC000511349047 940049662 /nfs/dbraw/zinc/04/96/62/940049662.db2.gz CAAFSKKEFSVFRJ-YJYMSZOUSA-N 0 0 353.378 3.513 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cn1)N1CCC([C@@H](F)c2ccccc2F)CC1 ZINC000375909592 940055035 /nfs/dbraw/zinc/05/50/35/940055035.db2.gz LHXPVXYZNRKDCG-QGZVFWFLSA-N 0 0 361.348 3.692 20 5 FHBDRN O=C(Nc1cccc(N2CCCC2)c1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000411509639 940059220 /nfs/dbraw/zinc/05/92/20/940059220.db2.gz VFLCKHFCHPSTOE-RBUKOAKNSA-N 0 0 351.406 3.937 20 5 FHBDRN COc1ccc(CNC(=O)[C@@H]2CC(C)(C)Oc3ccccc32)cc1[N+](=O)[O-] ZINC000411548156 940061054 /nfs/dbraw/zinc/06/10/54/940061054.db2.gz FDMUNONQWVDVAR-OAHLLOKOSA-N 0 0 370.405 3.565 20 5 FHBDRN CC1(C)C[C@H](C(=O)NCCc2ccc([N+](=O)[O-])cc2)c2ccccc2O1 ZINC000411578883 940065054 /nfs/dbraw/zinc/06/50/54/940065054.db2.gz CSRGESUXENFQOC-KRWDZBQOSA-N 0 0 354.406 3.598 20 5 FHBDRN C[C@@H]1CN(C(=O)c2c(Cl)cccc2[N+](=O)[O-])C[C@H](c2ccccc2)O1 ZINC000136651199 940075879 /nfs/dbraw/zinc/07/58/79/940075879.db2.gz REXOQIJSGVEWSG-MLGOLLRUSA-N 0 0 360.797 3.850 20 5 FHBDRN Cc1ccc(NC(=O)c2ccc(NCCOC(C)C)c([N+](=O)[O-])c2)cc1 ZINC000612454909 940077487 /nfs/dbraw/zinc/07/74/87/940077487.db2.gz AWXNSCWPQDGSLO-UHFFFAOYSA-N 0 0 357.410 3.992 20 5 FHBDRN CCn1c(CCNC(=O)c2ccc([N+](=O)[O-])cc2Cl)nc2ccccc21 ZINC000065929544 940079244 /nfs/dbraw/zinc/07/92/44/940079244.db2.gz SHFCSHWUUPQQJC-UHFFFAOYSA-N 0 0 372.812 3.590 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)N(CCCO)[C@@H]1CCc2ccccc21 ZINC000085545555 940082697 /nfs/dbraw/zinc/08/26/97/940082697.db2.gz WDIUSBIXDJQHJJ-LJQANCHMSA-N 0 0 369.421 3.807 20 5 FHBDRN O=C(Nc1ccncc1)c1ccc(CNc2ccc(F)cc2[N+](=O)[O-])cc1 ZINC000065947023 940106869 /nfs/dbraw/zinc/10/68/69/940106869.db2.gz YUKHOLYHLLFKDF-UHFFFAOYSA-N 0 0 366.352 3.993 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])c2cccnc12)N1CCO[C@H](C2CCCCC2)C1 ZINC000612505897 940109972 /nfs/dbraw/zinc/10/99/72/940109972.db2.gz FOBOXJBRLMERKG-SFHVURJKSA-N 0 0 369.421 3.564 20 5 FHBDRN O=C(Nc1ccc(OC(=O)c2ccccc2[N+](=O)[O-])cc1)c1ccco1 ZINC000051036556 940120646 /nfs/dbraw/zinc/12/06/46/940120646.db2.gz HEQASLKOLQOASF-UHFFFAOYSA-N 0 0 352.302 3.659 20 5 FHBDRN COc1ccc(C)cc1CNC(=O)c1c([N+](=O)[O-])cccc1C(F)(F)F ZINC000612523891 940121650 /nfs/dbraw/zinc/12/16/50/940121650.db2.gz YFTKKMMUYLZMEK-UHFFFAOYSA-N 0 0 368.311 3.861 20 5 FHBDRN Cc1cc(C(=O)Oc2ccc(NC(=O)c3ccco3)cc2)ccc1[N+](=O)[O-] ZINC000051035736 940122097 /nfs/dbraw/zinc/12/20/97/940122097.db2.gz CCIKBNVTKKNWEZ-UHFFFAOYSA-N 0 0 366.329 3.968 20 5 FHBDRN COc1ccccc1-c1noc([C@@H](C)NCc2c(F)cccc2[N+](=O)[O-])n1 ZINC000612527339 940123647 /nfs/dbraw/zinc/12/36/47/940123647.db2.gz JIFYLVREYFDKJE-LLVKDONJSA-N 0 0 372.356 3.643 20 5 FHBDRN Cc1cccc(CC2CN(C(=O)[C@H](C)c3ccc([N+](=O)[O-])cc3F)C2)c1 ZINC000612552447 940135978 /nfs/dbraw/zinc/13/59/78/940135978.db2.gz BXASLKLODNRWLL-CQSZACIVSA-N 0 0 356.397 3.847 20 5 FHBDRN Cc1cccnc1-c1noc(-c2cc(Br)cc([N+](=O)[O-])c2)n1 ZINC000545606997 945298539 /nfs/dbraw/zinc/29/85/39/945298539.db2.gz RACIVLHHQNNNOV-UHFFFAOYSA-N 0 0 361.155 3.778 20 5 FHBDRN C[C@@H](CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)c1ccc(F)cc1F ZINC000136717635 940143002 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COc1ccc([N+](=O)[O-])c(CC(=O)N(C)C[C@@H](C)c2ccccc2)c1F ZINC000411947449 940161220 /nfs/dbraw/zinc/16/12/20/940161220.db2.gz TYRSULFUPMOMAO-CYBMUJFWSA-N 0 0 360.385 3.547 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N(C)C[C@H](C)c2ccccc2)c1F ZINC000411947450 940162242 /nfs/dbraw/zinc/16/22/42/940162242.db2.gz TYRSULFUPMOMAO-ZDUSSCGKSA-N 0 0 360.385 3.547 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N1CCC2(CC1)OCc1ccccc12 ZINC000365460730 940167710 /nfs/dbraw/zinc/16/77/10/940167710.db2.gz KXJAJAKOZPQNRL-UHFFFAOYSA-N 0 0 352.390 3.565 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cn1)N1CCC(F)(c2cccc(Cl)c2)CC1 ZINC000375997244 940168159 /nfs/dbraw/zinc/16/81/59/940168159.db2.gz AAUVPESWFOKAAE-UHFFFAOYSA-N 0 0 363.776 3.744 20 5 FHBDRN CC(C)C[C@@H](C)OCCC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000540893603 940170891 /nfs/dbraw/zinc/17/08/91/940170891.db2.gz KQQNTSGERNFHRQ-CYBMUJFWSA-N 0 0 356.850 3.748 20 5 FHBDRN Cc1ccc(CN(C(C)C)S(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)s1 ZINC000066001978 940175730 /nfs/dbraw/zinc/17/57/30/940175730.db2.gz FMHUXNRCVUJRFO-UHFFFAOYSA-N 0 0 368.480 3.872 20 5 FHBDRN Cc1ccc2c(c1C)OC[C@H]2NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000411995516 940179651 /nfs/dbraw/zinc/17/96/51/940179651.db2.gz QAEBAVKZFOMACC-RCCFBDPRSA-N 0 0 352.390 3.565 20 5 FHBDRN Cc1c2ccccc2oc1[C@@H](C)NC(=O)COc1ccccc1[N+](=O)[O-] ZINC000046649976 940181541 /nfs/dbraw/zinc/18/15/41/940181541.db2.gz RKXQKAKTAIAADG-CYBMUJFWSA-N 0 0 354.362 3.906 20 5 FHBDRN COc1cc(OCC(=O)Nc2ccc3nc(C)sc3c2)ccc1[N+](=O)[O-] ZINC000066014553 940188255 /nfs/dbraw/zinc/18/82/55/940188255.db2.gz FXBHIXCRPFOKII-UHFFFAOYSA-N 0 0 373.390 3.539 20 5 FHBDRN COc1cc(OCC(=O)N2CCCSc3ccccc32)ccc1[N+](=O)[O-] ZINC000066016741 940188704 /nfs/dbraw/zinc/18/87/04/940188704.db2.gz LMRNKMCZUDWQET-UHFFFAOYSA-N 0 0 374.418 3.511 20 5 FHBDRN COc1ccc(CNC(=O)N[C@H]2CC(C)(C)c3ccccc32)cc1[N+](=O)[O-] ZINC000431663379 940196460 /nfs/dbraw/zinc/19/64/60/940196460.db2.gz UMGZGGMQSLMJLF-INIZCTEOSA-N 0 0 369.421 3.825 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)Sc1nnc(-c2ccncc2)n1C ZINC000179984535 940197346 /nfs/dbraw/zinc/19/73/46/940197346.db2.gz WIPJJCVNFBMGRE-GFCCVEGCSA-N 0 0 355.423 3.947 20 5 FHBDRN CCCOc1ccc(C(=O)N2CCc3cc([N+](=O)[O-])ccc32)cc1OCC ZINC000612645885 940200482 /nfs/dbraw/zinc/20/04/82/940200482.db2.gz XYVIEMQWITXOIL-UHFFFAOYSA-N 0 0 370.405 3.985 20 5 FHBDRN Cc1cc(COc2c3cc(Br)ccc3ncc2[N+](=O)[O-])on1 ZINC000612660810 940208342 /nfs/dbraw/zinc/20/83/42/940208342.db2.gz VZBMIFOOBJZIGW-UHFFFAOYSA-N 0 0 364.155 3.781 20 5 FHBDRN CC(C)CCn1nccc1NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000612674606 940212939 /nfs/dbraw/zinc/21/29/39/940212939.db2.gz ZPAAKFIBRDAQTF-UHFFFAOYSA-N 0 0 371.441 3.690 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1OCC(=O)Nc1ccc(C(C)(C)C)cc1 ZINC000506782668 945304097 /nfs/dbraw/zinc/30/40/97/945304097.db2.gz OJEVWLVQEOIUIA-UHFFFAOYSA-N 0 0 358.394 3.918 20 5 FHBDRN C[C@H](C(=O)NCc1coc(-c2ccccc2)n1)c1cccc([N+](=O)[O-])c1 ZINC000570284701 940234003 /nfs/dbraw/zinc/23/40/03/940234003.db2.gz VXDJNIRULJWHCL-ZDUSSCGKSA-N 0 0 351.362 3.670 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])cc1[N+](=O)[O-] ZINC000177498039 940236128 /nfs/dbraw/zinc/23/61/28/940236128.db2.gz RZIWFJUHXZIEDK-VIFPVBQESA-N 0 0 365.292 3.581 20 5 FHBDRN O=C(c1cccc2c(=O)c3ccccc3[nH]c12)N1CC[C@@H]2[C@H]1[C@H]2C(F)(F)F ZINC000376097867 940307704 /nfs/dbraw/zinc/30/77/04/940307704.db2.gz OPKPGVRDRDZBTP-KCTSRDHCSA-N 0 0 372.346 3.704 20 5 FHBDRN O=C(N[C@@H](Cc1ccccc1)C1CC1)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000124586456 945310936 /nfs/dbraw/zinc/31/09/36/945310936.db2.gz WINZGQLMPNEDNB-IBGZPJMESA-N 0 0 365.433 3.684 20 5 FHBDRN Nc1ccc(-c2noc(C3CC(OCc4ccccc4)C3)n2)cc1[N+](=O)[O-] ZINC000612856753 940314987 /nfs/dbraw/zinc/31/49/87/940314987.db2.gz XVOPFPDQSWRMGZ-UHFFFAOYSA-N 0 0 366.377 3.690 20 5 FHBDRN O=[N+]([O-])c1ccccc1Cc1noc(-c2ccn(-c3cccc(F)c3)n2)n1 ZINC000612864221 940318627 /nfs/dbraw/zinc/31/86/27/940318627.db2.gz KOJHTNZGLZIOFN-UHFFFAOYSA-N 0 0 365.324 3.560 20 5 FHBDRN COc1ccc(-n2cnnc2S[C@@H](C)c2cc([N+](=O)[O-])ccc2C)cn1 ZINC000180050074 940326395 /nfs/dbraw/zinc/32/63/95/940326395.db2.gz OBFGCRUFTKEBBU-LBPRGKRZSA-N 0 0 371.422 3.741 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)cc(-c2nc(Cc3ccc4c(c3)OCCO4)no2)c1 ZINC000612894416 940331817 /nfs/dbraw/zinc/33/18/17/940331817.db2.gz YPJLNOYLEZMVQG-UHFFFAOYSA-N 0 0 373.752 3.660 20 5 FHBDRN COCc1ccccc1-c1noc(-c2c[nH]c3cc([N+](=O)[O-])ccc32)n1 ZINC000612901612 940335170 /nfs/dbraw/zinc/33/51/70/940335170.db2.gz AHKJLPACFHWCGE-UHFFFAOYSA-N 0 0 350.334 3.940 20 5 FHBDRN CNc1ccc(-c2nc([C@@H](C)c3cccc(OC)c3)no2)cc1[N+](=O)[O-] ZINC000612917849 940335747 /nfs/dbraw/zinc/33/57/47/940335747.db2.gz QWVYWSZEVQBZFN-NSHDSACASA-N 0 0 354.366 3.847 20 5 FHBDRN COc1cccc([C@@H](C)c2noc(COc3ccc([N+](=O)[O-])cc3)n2)c1 ZINC000612918333 940336124 /nfs/dbraw/zinc/33/61/24/940336124.db2.gz ZPKZVNVLXCVCFP-GFCCVEGCSA-N 0 0 355.350 3.717 20 5 FHBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)c1nc([C@@H]2CCC[C@@H](C)C2)no1 ZINC000612911190 940337361 /nfs/dbraw/zinc/33/73/61/940337361.db2.gz PCYHJRZWLRJDFY-FRRDWIJNSA-N 0 0 358.398 3.763 20 5 FHBDRN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)c1nc([C@H]2CCC[C@@H](C)C2)no1 ZINC000612911192 940337547 /nfs/dbraw/zinc/33/75/47/940337547.db2.gz PCYHJRZWLRJDFY-UPJWGTAASA-N 0 0 358.398 3.763 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCC(=O)Cc2ccccc2Br)c1 ZINC000544086634 940345380 /nfs/dbraw/zinc/34/53/80/940345380.db2.gz IIZLRWDPAWYCRZ-UHFFFAOYSA-N 0 0 364.195 3.856 20 5 FHBDRN O=[N+]([O-])c1ccccc1OCc1nc([C@H]2CCc3ccccc3C2)no1 ZINC000612951725 940356127 /nfs/dbraw/zinc/35/61/27/940356127.db2.gz MBOSUOVGWBFYTJ-HNNXBMFYSA-N 0 0 351.362 3.829 20 5 FHBDRN O=[N+]([O-])c1ccccc1NCc1nc([C@H]2CCc3ccccc3C2)no1 ZINC000612952227 940356799 /nfs/dbraw/zinc/35/67/99/940356799.db2.gz YLGFQGARVBKSKW-HNNXBMFYSA-N 0 0 350.378 3.862 20 5 FHBDRN Cc1cc(Cc2noc(-c3cncc(OC(C)C)c3)n2)ccc1[N+](=O)[O-] ZINC000612958721 940360390 /nfs/dbraw/zinc/36/03/90/940360390.db2.gz DWDUUQQLXZPNTQ-UHFFFAOYSA-N 0 0 354.366 3.726 20 5 FHBDRN O=C(Nc1ccc2c(c1)OCCO2)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000548967628 940363982 /nfs/dbraw/zinc/36/39/82/940363982.db2.gz MCIVTHFNKHWFAS-UHFFFAOYSA-N 0 0 368.267 3.637 20 5 FHBDRN Cc1c(Cc2noc(C[C@H]3CCO[C@H](C(C)C)C3)n2)cccc1[N+](=O)[O-] ZINC000612967344 940366187 /nfs/dbraw/zinc/36/61/87/940366187.db2.gz LKBIOBLUAOIDKA-YOEHRIQHSA-N 0 0 359.426 3.871 20 5 FHBDRN COc1cccc(Cc2noc(/C(C)=C\c3ccc([N+](=O)[O-])cc3)n2)n1 ZINC000612979747 940375087 /nfs/dbraw/zinc/37/50/87/940375087.db2.gz CRYOBBVJDDSTQL-BENRWUELSA-N 0 0 352.350 3.533 20 5 FHBDRN CN(Cc1nc2c(s1)CCCC2)C(=O)c1cccc(Cl)c1[N+](=O)[O-] ZINC000177703201 940375416 /nfs/dbraw/zinc/37/54/16/940375416.db2.gz KSFKETCGAKUCJQ-UHFFFAOYSA-N 0 0 365.842 3.856 20 5 FHBDRN Cc1ccc(-c2csc(NC(=O)c3ncccc3C)n2)cc1[N+](=O)[O-] ZINC000427381939 945313200 /nfs/dbraw/zinc/31/32/00/945313200.db2.gz JZFKDAQJPPKFFA-UHFFFAOYSA-N 0 0 354.391 3.982 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])cc2c1OCCO2)N1CCCc2cc(Cl)ccc21 ZINC000066302969 940405250 /nfs/dbraw/zinc/40/52/50/940405250.db2.gz NWTLOJHPMNJJBZ-UHFFFAOYSA-N 0 0 374.780 3.612 20 5 FHBDRN CC(=O)c1cc(N2CCC[C@H](n3ccnc3C(C)C)C2)ccc1[N+](=O)[O-] ZINC000376172087 940412910 /nfs/dbraw/zinc/41/29/10/940412910.db2.gz KCEQQNORRZNRTI-INIZCTEOSA-N 0 0 356.426 3.959 20 5 FHBDRN COc1c(F)cc(F)cc1NC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000472493630 940416693 /nfs/dbraw/zinc/41/66/93/940416693.db2.gz DGGYUGZRMNMGNU-UHFFFAOYSA-N 0 0 350.321 3.798 20 5 FHBDRN Cc1sc(S(=O)(=O)Nc2cc(C)c(F)cc2Cl)cc1[N+](=O)[O-] ZINC000507546368 945319365 /nfs/dbraw/zinc/31/93/65/945319365.db2.gz FVHGFFLQFDEZMT-UHFFFAOYSA-N 0 0 364.807 3.866 20 5 FHBDRN CCO[C@@H]1C[C@H](NC(=O)c2c(C)cc(Cl)cc2[N+](=O)[O-])C12CCC2 ZINC000613072682 940435209 /nfs/dbraw/zinc/43/52/09/940435209.db2.gz NSMPJPRYBQSMEO-UONOGXRCSA-N 0 0 352.818 3.634 20 5 FHBDRN CC(C)c1nccn1[C@H]1CCCN(c2ncnc3sc([N+](=O)[O-])cc32)C1 ZINC000376188064 940439001 /nfs/dbraw/zinc/43/90/01/940439001.db2.gz NPZYDNBWFRPYLB-LBPRGKRZSA-N 0 0 372.454 3.761 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)C1(c2cccc(C(F)(F)F)c2)CC1 ZINC000066330233 940439043 /nfs/dbraw/zinc/43/90/43/940439043.db2.gz RVJRYIZPKTXLBN-UHFFFAOYSA-N 0 0 364.323 3.962 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)Cc1cnc2ccccc2n1 ZINC000548987469 940442305 /nfs/dbraw/zinc/44/23/05/940442305.db2.gz JMTCNHFZBOIDJN-CYBMUJFWSA-N 0 0 350.378 3.664 20 5 FHBDRN CC(C)[C@@](C)(O)CNC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 ZINC000440211089 945321520 /nfs/dbraw/zinc/32/15/20/945321520.db2.gz FRASZLULLWOOIP-IBGZPJMESA-N 0 0 358.394 3.524 20 5 FHBDRN COC(=O)c1ccc(OCc2ccc(OC(F)F)cc2)cc1[N+](=O)[O-] ZINC000613112855 940456075 /nfs/dbraw/zinc/45/60/75/940456075.db2.gz IPDODTGZTFJZAC-UHFFFAOYSA-N 0 0 353.277 3.562 20 5 FHBDRN CCn1c(C)nc([N+](=O)[O-])c1N[C@H](CCO)c1ccc(Cl)c(Cl)c1 ZINC000580117269 940461556 /nfs/dbraw/zinc/46/15/56/940461556.db2.gz ATRYFLBZYWQJTI-CYBMUJFWSA-N 0 0 373.240 3.962 20 5 FHBDRN O=C(Nc1nc(C2CCOCC2)cs1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000376206521 940467956 /nfs/dbraw/zinc/46/79/56/940467956.db2.gz JLMZFPHFQYVZIE-UHFFFAOYSA-N 0 0 367.814 3.851 20 5 FHBDRN O=[N+]([O-])c1c2cccnc2ccc1N1CCN(c2ccc(Cl)cn2)CC1 ZINC000066372596 940468000 /nfs/dbraw/zinc/46/80/00/940468000.db2.gz HUAPCPACEARQHX-UHFFFAOYSA-N 0 0 369.812 3.518 20 5 FHBDRN O=[N+]([O-])c1ccc(NCCCS(=O)(=O)c2ccccc2)c(Cl)c1 ZINC000066373126 940468212 /nfs/dbraw/zinc/46/82/12/940468212.db2.gz SKNCDUXJLRLAKJ-UHFFFAOYSA-N 0 0 354.815 3.524 20 5 FHBDRN O=[N+]([O-])c1cccc(OC[C@H](O)CNc2ccc(CC(F)(F)F)cc2)c1 ZINC000580185758 940469575 /nfs/dbraw/zinc/46/95/75/940469575.db2.gz VIPDYCRKDKNPBP-OAHLLOKOSA-N 0 0 370.327 3.551 20 5 FHBDRN CC(C)CCSc1ccc(C(=O)NC[C@@](C)(O)C2CC2)cc1[N+](=O)[O-] ZINC000440213952 945323418 /nfs/dbraw/zinc/32/34/18/945323418.db2.gz IGOHPHCRKILAJJ-GOSISDBHSA-N 0 0 366.483 3.624 20 5 FHBDRN C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N1CC[C@H](CC2CC2)C1 ZINC000580336090 940473292 /nfs/dbraw/zinc/47/32/92/940473292.db2.gz XPBFGMJTPFNYLR-WCQYABFASA-N 0 0 351.834 3.697 20 5 FHBDRN Cc1c(NC(=O)[C@@H](C)C(C)(F)F)cc(Br)cc1[N+](=O)[O-] ZINC000511440600 940474962 /nfs/dbraw/zinc/47/49/62/940474962.db2.gz AASKVBJWPZVCBE-SSDOTTSWSA-N 0 0 351.147 3.896 20 5 FHBDRN C[C@H]1[C@@H](CO)CCCN1C(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 ZINC000414067372 940475169 /nfs/dbraw/zinc/47/51/69/940475169.db2.gz KYFUSKSJNMFSMH-LSDHHAIUSA-N 0 0 370.405 3.620 20 5 FHBDRN Cc1ccccc1-n1nccc1NC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000580509652 940477468 /nfs/dbraw/zinc/47/74/68/940477468.db2.gz LXJBUJZHJVJIKX-CQSZACIVSA-N 0 0 350.378 3.831 20 5 FHBDRN O=C(Cn1c2ccccc2c(=O)c2ccccc21)N1CCC[C@H](C2CC2)C1 ZINC000685857375 940479378 /nfs/dbraw/zinc/47/93/78/940479378.db2.gz FYMOFPKUNWPLKS-KRWDZBQOSA-N 0 0 360.457 3.803 20 5 FHBDRN C[C@@H](NC(=O)c1ccc2c(c1)CCCCC2=O)c1cccc([N+](=O)[O-])c1 ZINC000580645116 940481092 /nfs/dbraw/zinc/48/10/92/940481092.db2.gz WJFYGOKSYWIALB-CYBMUJFWSA-N 0 0 352.390 3.995 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)NCC1(c2cccc(F)c2)CC1 ZINC000511447234 940481566 /nfs/dbraw/zinc/48/15/66/940481566.db2.gz WGCBDIRNLJVSFD-UHFFFAOYSA-N 0 0 371.412 3.650 20 5 FHBDRN CC(C)C(=O)c1ccc([C@H](C)C(=O)NCCc2cccc([N+](=O)[O-])c2)cc1 ZINC000549005722 940483593 /nfs/dbraw/zinc/48/35/93/940483593.db2.gz AWDWLMAMAWPSMM-HNNXBMFYSA-N 0 0 368.433 3.896 20 5 FHBDRN O=C1[C@H](Nc2ccc(-c3ccccn3)cc2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000580682884 940483700 /nfs/dbraw/zinc/48/37/00/940483700.db2.gz IVDSDRGJMLUKEE-HXUWFJFHSA-N 0 0 374.400 3.874 20 5 FHBDRN COCCOc1ccc(F)cc1NC(=O)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000066432475 940486715 /nfs/dbraw/zinc/48/67/15/940486715.db2.gz UHAGJNGMOHUCLC-UHFFFAOYSA-N 0 0 368.748 3.665 20 5 FHBDRN C[C@@H](C(=O)NC[C@H](C)COCc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000580808353 940488101 /nfs/dbraw/zinc/48/81/01/940488101.db2.gz YPQOYQGDABTDLQ-JKSUJKDBSA-N 0 0 356.422 3.667 20 5 FHBDRN Cc1ccc(C(=O)N[C@H]2c3ccccc3CC23CCOCC3)cc1[N+](=O)[O-] ZINC000580922857 940488970 /nfs/dbraw/zinc/48/89/70/940488970.db2.gz FACVVEUTXQFLBT-IBGZPJMESA-N 0 0 366.417 3.727 20 5 FHBDRN CC(C)C(=O)c1ccc([C@H](C)C(=O)NCc2cccc([N+](=O)[O-])c2)cc1 ZINC000549009329 940490158 /nfs/dbraw/zinc/49/01/58/940490158.db2.gz ITLUIZULWPLIEW-AWEZNQCLSA-N 0 0 354.406 3.853 20 5 FHBDRN Cc1csc2c1ncn(Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)c2=O ZINC000581024071 940492230 /nfs/dbraw/zinc/49/22/30/940492230.db2.gz CJSBUEMCBPKYFO-UHFFFAOYSA-N 0 0 369.324 3.742 20 5 FHBDRN CCOC(=O)c1cc(C(=O)N(C)C[C@@H](C)c2ccccc2)cc([N+](=O)[O-])c1 ZINC000066460107 940494967 /nfs/dbraw/zinc/49/49/67/940494967.db2.gz NWJRJOPRKVFLLT-CQSZACIVSA-N 0 0 370.405 3.647 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N(C)C[C@H](C)c2ccccc2)cc1OC ZINC000066459430 940495045 /nfs/dbraw/zinc/49/50/45/940495045.db2.gz UDTNEOXJGOOCRB-AWEZNQCLSA-N 0 0 372.421 3.878 20 5 FHBDRN C[C@H](CN(C)C(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)c1ccccc1 ZINC000066460376 940495067 /nfs/dbraw/zinc/49/50/67/940495067.db2.gz JVOAFANAZOYCHR-OAHLLOKOSA-N 0 0 364.405 3.656 20 5 FHBDRN Cc1cccc(O[C@H](C)CNC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000511466095 940498097 /nfs/dbraw/zinc/49/80/97/940498097.db2.gz RTLSYULPIPSYTE-MRXNPFEDSA-N 0 0 371.437 3.555 20 5 FHBDRN C[C@H](CCOCc1ccccc1)NC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000581327970 940499322 /nfs/dbraw/zinc/49/93/22/940499322.db2.gz BBZIPYSKFGYGEU-HZPDHXFCSA-N 0 0 356.422 3.810 20 5 FHBDRN O=[N+]([O-])c1ccc2ncnc(NC3CC(OCc4ccccc4)C3)c2c1 ZINC000613285254 940502786 /nfs/dbraw/zinc/50/27/86/940502786.db2.gz GQNQXOLKYXIGJL-UHFFFAOYSA-N 0 0 350.378 3.698 20 5 FHBDRN COC(=O)Nc1cc(NC(=O)c2cc([N+](=O)[O-])c(C)s2)ccc1F ZINC000066488712 940507671 /nfs/dbraw/zinc/50/76/71/940507671.db2.gz LMVQGZGSSHEWCO-UHFFFAOYSA-N 0 0 353.331 3.534 20 5 FHBDRN COc1ccccc1OCCCNC(=O)Nc1cc([N+](=O)[O-])c(C)cc1C ZINC000613294794 940508128 /nfs/dbraw/zinc/50/81/28/940508128.db2.gz SFCGELQAJNSKKD-UHFFFAOYSA-N 0 0 373.409 3.811 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1)CCN2Cc1nnc(-c2ccccc2Cl)o1 ZINC000178013732 940509515 /nfs/dbraw/zinc/50/95/15/940509515.db2.gz PHTJHKOMSKCQKO-UHFFFAOYSA-N 0 0 356.769 3.861 20 5 FHBDRN CCOc1ccc(CNC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000431793796 940509945 /nfs/dbraw/zinc/50/99/45/940509945.db2.gz CWQIEIYNJDHZDM-UHFFFAOYSA-N 0 0 357.410 3.728 20 5 FHBDRN CCN(C(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1)c1ccc(F)c(F)c1 ZINC000124764976 945327676 /nfs/dbraw/zinc/32/76/76/945327676.db2.gz VHFJZZRRBSXHJG-UHFFFAOYSA-N 0 0 365.292 3.756 20 5 FHBDRN CC(C)[C@](C)(CO)NC(=O)c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1 ZINC000427385250 945331116 /nfs/dbraw/zinc/33/11/16/945331116.db2.gz UGVKXZNKJLHLHF-IBGZPJMESA-N 0 0 374.462 3.883 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NCCC[C@H]1CCCC[C@H]1O ZINC000160567773 940601930 /nfs/dbraw/zinc/60/19/30/940601930.db2.gz UQBRGCKJRHBFNQ-CZUORRHYSA-N 0 0 366.483 3.768 20 5 FHBDRN O=C(c1cccc(F)c1Br)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000431800659 940604461 /nfs/dbraw/zinc/60/44/61/940604461.db2.gz LSLNXRYEEPEEHT-UHFFFAOYSA-N 0 0 365.158 3.699 20 5 FHBDRN COc1ccc(OCCN2CCc3[nH]c4ccccc4c3C2)c([N+](=O)[O-])c1 ZINC000173329722 940609632 /nfs/dbraw/zinc/60/96/32/940609632.db2.gz LBGMZWGSSFSJNA-UHFFFAOYSA-N 0 0 367.405 3.522 20 5 FHBDRN CC(C)CCSc1ccc(C(=O)NC[C@@](C)(O)C(C)C)cc1[N+](=O)[O-] ZINC000440220226 945334122 /nfs/dbraw/zinc/33/41/22/945334122.db2.gz UZHAXSKNZOCCIU-GOSISDBHSA-N 0 0 368.499 3.870 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H](C)Cc1nc2ccccc2s1 ZINC000427391785 945335072 /nfs/dbraw/zinc/33/50/72/945335072.db2.gz SAYGVUDVQWUCHW-LLVKDONJSA-N 0 0 371.418 3.574 20 5 FHBDRN CC[C@H](NC(=O)c1ccc(-c2cc[nH]n2)s1)c1cccc([N+](=O)[O-])c1 ZINC000431810458 940627279 /nfs/dbraw/zinc/62/72/79/940627279.db2.gz OPIWCHKFIAPYGZ-ZDUSSCGKSA-N 0 0 356.407 3.928 20 5 FHBDRN C[C@H](C(=O)N(C)[C@@H](C)c1ccc([S@](C)=O)cc1)c1cccc([N+](=O)[O-])c1 ZINC000581858806 940627791 /nfs/dbraw/zinc/62/77/91/940627791.db2.gz VXMGCZQGFIEFOJ-SYMLIENRSA-N 0 0 374.462 3.655 20 5 FHBDRN Cc1ccc([C@H]2C[C@@H](C)CCN2C(=O)COc2cccc([N+](=O)[O-])c2)o1 ZINC000173574865 940637278 /nfs/dbraw/zinc/63/72/78/940637278.db2.gz WMBBFHCHKDRHAE-SUMWQHHRSA-N 0 0 358.394 3.875 20 5 FHBDRN O=C(NC12C[C@@H]3C[C@H](C1)CC(C(F)(F)F)(C3)C2)c1ccc([N+](=O)[O-])cn1 ZINC000376264373 940648828 /nfs/dbraw/zinc/64/88/28/940648828.db2.gz GSJUHCGKSMUZGZ-IUOZQUQDSA-N 0 0 369.343 3.621 20 5 FHBDRN CCN(C[C@H](O)c1ccc(C)cc1)C(=O)c1cc(SC)ccc1[N+](=O)[O-] ZINC000178089859 940651929 /nfs/dbraw/zinc/65/19/29/940651929.db2.gz AKXATPHJEGCZLO-SFHVURJKSA-N 0 0 374.462 3.821 20 5 FHBDRN COC(=O)c1cc(C)nc(N2C[C@@H](C)C[C@H]2c2ccccc2F)c1[N+](=O)[O-] ZINC000582292940 940664418 /nfs/dbraw/zinc/66/44/18/940664418.db2.gz SZROAQWXYHJAMJ-ZBEGNZNMSA-N 0 0 373.384 3.811 20 5 FHBDRN Cc1cc(NS(=O)(=O)c2ccc([N+](=O)[O-])c(C)c2)c(Cl)cc1F ZINC000507579184 945338597 /nfs/dbraw/zinc/33/85/97/945338597.db2.gz BPSRPMBWICMFOJ-UHFFFAOYSA-N 0 0 358.778 3.805 20 5 FHBDRN COc1ccccc1C1(c2noc(Cc3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000582501504 940676431 /nfs/dbraw/zinc/67/64/31/940676431.db2.gz KGPVRRZILMYYQZ-UHFFFAOYSA-N 0 0 351.362 3.657 20 5 FHBDRN COc1cc(OC)c(NC(=O)CCc2cccc([N+](=O)[O-])c2)cc1Cl ZINC000086988031 945341093 /nfs/dbraw/zinc/34/10/93/945341093.db2.gz GYZVNFMWLBYGDH-UHFFFAOYSA-N 0 0 364.785 3.837 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1)CN(c1nc(-c3ccccc3)ns1)CCO2 ZINC000582520029 940700876 /nfs/dbraw/zinc/70/08/76/940700876.db2.gz WEHARTVJZIOPQM-UHFFFAOYSA-N 0 0 354.391 3.512 20 5 FHBDRN CCOC(=O)c1ccc(/C=C2/C(=O)Nc3cc(Cl)c([N+](=O)[O-])cc32)o1 ZINC000255888812 940704375 /nfs/dbraw/zinc/70/43/75/940704375.db2.gz KIHXCCDOBYRAFR-BJMVGYQFSA-N 0 0 362.725 3.511 20 5 FHBDRN O=C(NCc1cccc([N+](=O)[O-])c1)N[C@@H](c1ccc(F)cc1)C(F)(F)F ZINC000582581670 940739496 /nfs/dbraw/zinc/73/94/96/940739496.db2.gz PAVHMGQRVMJITN-AWEZNQCLSA-N 0 0 371.290 3.837 20 5 FHBDRN CSc1ccc(C(=O)Nc2nc3cc(F)ccc3n2C)cc1[N+](=O)[O-] ZINC000174594280 940751550 /nfs/dbraw/zinc/75/15/50/940751550.db2.gz JKOSPYPVABTIFB-UHFFFAOYSA-N 0 0 360.370 3.595 20 5 FHBDRN COc1ccc(C(=O)Nc2ccnn2-c2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000174821208 940780534 /nfs/dbraw/zinc/78/05/34/940780534.db2.gz XJPHBTREOMHMPS-UHFFFAOYSA-N 0 0 372.768 3.695 20 5 FHBDRN Cc1ccc(-c2noc([C@@H](C)NC(=O)c3ccc([N+](=O)[O-])cc3)n2)cc1F ZINC000472556116 940785847 /nfs/dbraw/zinc/78/58/47/940785847.db2.gz MURNGKGDXNGUAF-LLVKDONJSA-N 0 0 370.340 3.583 20 5 FHBDRN COC(=O)c1cccc(-c2noc(Cc3ccc([N+](=O)[O-])cc3Cl)n2)c1 ZINC000174878655 940788570 /nfs/dbraw/zinc/78/85/70/940788570.db2.gz YJMIMLPOVDEEOG-UHFFFAOYSA-N 0 0 373.752 3.676 20 5 FHBDRN Cc1ccn(C2CCN(C(=O)/C=C/c3ccc(Cl)c([N+](=O)[O-])c3)CC2)n1 ZINC000365515873 940789256 /nfs/dbraw/zinc/78/92/56/940789256.db2.gz VLNLBRZSZBAXFN-HWKANZROSA-N 0 0 374.828 3.630 20 5 FHBDRN Nc1c(C(=O)Nc2nc(-c3cccs3)cs2)cc(F)cc1[N+](=O)[O-] ZINC000175092278 940810948 /nfs/dbraw/zinc/81/09/48/940810948.db2.gz BWVAWOQKJVAZJN-UHFFFAOYSA-N 0 0 364.383 3.753 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000180219639 940829123 /nfs/dbraw/zinc/82/91/23/940829123.db2.gz PBFAXKKOSAFIOV-WQVCFCJDSA-N 0 0 364.467 3.639 20 5 FHBDRN Cc1ccc(S[C@H](C)C(=O)NCCOc2ccc([N+](=O)[O-])cc2)cc1 ZINC000609455148 940830691 /nfs/dbraw/zinc/83/06/91/940830691.db2.gz NAXYLEZYYVNZFV-CQSZACIVSA-N 0 0 360.435 3.579 20 5 FHBDRN CCS[C@@H]1CCCC[C@@H]1NC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000175267451 940839035 /nfs/dbraw/zinc/83/90/35/940839035.db2.gz VABDGMKYRCIRJS-DOTOQJQBSA-N 0 0 374.466 3.575 20 5 FHBDRN Cc1cn2c(nc(C)c2-c2noc(-c3cc(F)cc([N+](=O)[O-])c3)n2)s1 ZINC000426619082 945352847 /nfs/dbraw/zinc/35/28/47/945352847.db2.gz ISDMVHPJGIMMEQ-UHFFFAOYSA-N 0 0 359.342 3.777 20 5 FHBDRN CN(CCc1ccc(Br)cc1)C(=O)c1ccc([N+](=O)[O-])s1 ZINC000106667650 945353989 /nfs/dbraw/zinc/35/39/89/945353989.db2.gz KSIVWZGZPIUZAP-UHFFFAOYSA-N 0 0 369.240 3.734 20 5 FHBDRN CCOc1ccc(OCC)c(NC(=O)Cc2ccc([N+](=O)[O-])cc2F)c1 ZINC000124919120 945354106 /nfs/dbraw/zinc/35/41/06/945354106.db2.gz MENYNBPOPYFITQ-UHFFFAOYSA-N 0 0 362.357 3.713 20 5 FHBDRN Cc1ccc(OS(=O)(=O)Cc2ccc(F)c(Cl)c2)cc1[N+](=O)[O-] ZINC000755961950 940853924 /nfs/dbraw/zinc/85/39/24/940853924.db2.gz YCJRETIWCXHVFH-UHFFFAOYSA-N 0 0 359.762 3.605 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C[S@](=O)C1CCC(C(F)(F)F)CC1 ZINC000414263448 940859446 /nfs/dbraw/zinc/85/94/46/940859446.db2.gz JNESVSFEHAFBTM-NOGQZVQESA-N 0 0 365.373 3.973 20 5 FHBDRN COC(=O)c1ccc2c(c1)CCN2C(=O)c1c(C)cc(C)c([N+](=O)[O-])c1C ZINC000091848218 940862612 /nfs/dbraw/zinc/86/26/12/940862612.db2.gz ACHODXIOACVBGY-UHFFFAOYSA-N 0 0 368.389 3.510 20 5 FHBDRN Cc1cc(C(=O)N[C@H](C)c2ccc(-n3cccn3)cc2)ccc1[N+](=O)[O-] ZINC000175426395 940863006 /nfs/dbraw/zinc/86/30/06/940863006.db2.gz RBDHXPSSOFAEMD-CQSZACIVSA-N 0 0 350.378 3.580 20 5 FHBDRN CC(C)(NC(=O)N[C@H]1C[C@@H]1c1cccc(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000175458843 940866619 /nfs/dbraw/zinc/86/66/19/940866619.db2.gz SMEMHBAMLGDKOV-SJORKVTESA-N 0 0 357.385 3.824 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)NCc2ccc(Cl)s2)cc1SC ZINC000170866825 940869068 /nfs/dbraw/zinc/86/90/68/940869068.db2.gz ZOQGSQGXLJWNQL-UHFFFAOYSA-N 0 0 372.855 3.970 20 5 FHBDRN O=C(N[C@H]1CCO[C@@H]1c1ccc(Cl)c(F)c1)c1csc([N+](=O)[O-])c1 ZINC000180244985 940875212 /nfs/dbraw/zinc/87/52/12/940875212.db2.gz GOKQRKRBSKXPSL-GXTWGEPZSA-N 0 0 370.789 3.709 20 5 FHBDRN CC(C)(NC(=O)N[C@H](CCCO)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000175573688 940890277 /nfs/dbraw/zinc/89/02/77/940890277.db2.gz GNXZKVFLNDFWLM-GOSISDBHSA-N 0 0 371.437 3.643 20 5 FHBDRN CC(C)[C@@H]1OCCC[C@H]1CNC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000175621533 940900999 /nfs/dbraw/zinc/90/09/99/940900999.db2.gz LYOLUGGXUOJYOF-YOEHRIQHSA-N 0 0 363.458 3.580 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)[C@H]1C[C@@]12CCCc1ccccc12 ZINC000175621665 940901032 /nfs/dbraw/zinc/90/10/32/940901032.db2.gz PWBFHUFJZMAZMJ-TZIWHRDSSA-N 0 0 350.418 3.548 20 5 FHBDRN CC[C@H](C)n1ncc2c1nc(C)cc2C(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000124924926 945358338 /nfs/dbraw/zinc/35/83/38/945358338.db2.gz XMAAWUXPIRZBMC-ZDUSSCGKSA-N 0 0 367.409 3.549 20 5 FHBDRN O=C(OCc1cccc([N+](=O)[O-])c1)c1cccc(OCc2cscn2)c1 ZINC000024360378 940909658 /nfs/dbraw/zinc/90/96/58/940909658.db2.gz KMCGZXDFDDHBLT-UHFFFAOYSA-N 0 0 370.386 3.987 20 5 FHBDRN O=C(NC[C@H](O)Cc1ccccc1)c1cc2ccccc2c2cccnc12 ZINC000170923637 940912894 /nfs/dbraw/zinc/91/28/94/940912894.db2.gz VDYNNIDVMOUKNR-GOSISDBHSA-N 0 0 356.425 3.721 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N2CCc3ccccc3[C@H]2C)cc1OC ZINC000106681847 945360868 /nfs/dbraw/zinc/36/08/68/945360868.db2.gz ZMGGWVPFVVSBRF-CYBMUJFWSA-N 0 0 370.405 3.762 20 5 FHBDRN Cc1nccn1-c1ccc([C@H](C)NC(=O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000175799836 940931711 /nfs/dbraw/zinc/93/17/11/940931711.db2.gz ATRKTORAZKGBLA-ZDUSSCGKSA-N 0 0 350.378 3.580 20 5 FHBDRN Cc1nc(NCc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)n[nH]1 ZINC000472580619 940934161 /nfs/dbraw/zinc/93/41/61/940934161.db2.gz RNVIEUQKRVSFKQ-UHFFFAOYSA-N 0 0 359.773 3.501 20 5 FHBDRN CCOC(=O)/C=C\c1ccc(NC(=O)c2c(C)cccc2[N+](=O)[O-])cc1 ZINC000255898709 940939427 /nfs/dbraw/zinc/93/94/27/940939427.db2.gz DLURXBDXLLKZFN-XFXZXTDPSA-N 0 0 354.362 3.732 20 5 FHBDRN Cc1ccc(NC(=O)N(CCc2ccccc2)[C@H]2CCOC2)cc1[N+](=O)[O-] ZINC000175861468 940940673 /nfs/dbraw/zinc/94/06/73/940940673.db2.gz MJKFJOBMDMZKKI-SFHVURJKSA-N 0 0 369.421 3.769 20 5 FHBDRN C[C@H]1c2ccccc2CCN1C(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000106684180 945362171 /nfs/dbraw/zinc/36/21/71/945362171.db2.gz XPBZUYHWEAHJRL-AWEZNQCLSA-N 0 0 362.389 3.540 20 5 FHBDRN O=C1CC[C@@H](c2cccc(N[C@@H](Cc3ccccc3[N+](=O)[O-])C3CC3)c2)N1 ZINC000414313137 940945434 /nfs/dbraw/zinc/94/54/34/940945434.db2.gz KBHUIDMYQNLWOF-OALUTQOASA-N 0 0 365.433 3.979 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N1CC[C@@H](Cc2ccncc2)C1 ZINC000376414526 940947793 /nfs/dbraw/zinc/94/77/93/940947793.db2.gz LLARYNDLSKCBQQ-INIZCTEOSA-N 0 0 354.410 3.703 20 5 FHBDRN Cc1n[nH]c2cc(NC(=O)CCOc3ccc(Cl)cc3[N+](=O)[O-])ccc12 ZINC000180320302 940958565 /nfs/dbraw/zinc/95/85/65/940958565.db2.gz HNNWMTMKFMZQSI-UHFFFAOYSA-N 0 0 374.784 3.841 20 5 FHBDRN Cc1ccc(-c2nc(NC(=O)[C@@H](C)c3ccc([N+](=O)[O-])cc3F)n[nH]2)cc1 ZINC000186293566 940975487 /nfs/dbraw/zinc/97/54/87/940975487.db2.gz WQCCAAVLWANSLQ-NSHDSACASA-N 0 0 369.356 3.570 20 5 FHBDRN C[C@@H](Cc1cccs1)NC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000180353186 940986604 /nfs/dbraw/zinc/98/66/04/940986604.db2.gz UVPXUOVTNJVQBH-VIFPVBQESA-N 0 0 356.350 3.619 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)F)cc1N1CC[C@]2(C1)OCc1ccccc12 ZINC000376429275 940988381 /nfs/dbraw/zinc/98/83/81/940988381.db2.gz TXNFMEQDRWJIFD-MRXNPFEDSA-N 0 0 365.311 3.644 20 5 FHBDRN CCOC(=O)c1cccc(N(CC)C(=O)c2cc(C)cc([N+](=O)[O-])c2)c1 ZINC000122121726 940993804 /nfs/dbraw/zinc/99/38/04/940993804.db2.gz QYGCZMNHKAAJRN-UHFFFAOYSA-N 0 0 356.378 3.747 20 5 FHBDRN O=C(Nc1cccc(-c2noc(C3CC3)n2)c1)c1ccccc1[N+](=O)[O-] ZINC000176197371 941001480 /nfs/dbraw/zinc/00/14/80/941001480.db2.gz MOWBUSMOTAKVEW-UHFFFAOYSA-N 0 0 350.334 3.775 20 5 FHBDRN Cc1c([C@@H](C)NCc2ccc([N+](=O)[O-])cc2)nnn1-c1ccc(Cl)cc1 ZINC000180416887 941004525 /nfs/dbraw/zinc/00/45/25/941004525.db2.gz LGSOQLQVLJKHBQ-GFCCVEGCSA-N 0 0 371.828 3.988 20 5 FHBDRN Cc1cc(C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)nc(C(F)(F)F)n1 ZINC000186466249 941006856 /nfs/dbraw/zinc/00/68/56/941006856.db2.gz WMBBGEYLIHPONA-UHFFFAOYSA-N 0 0 354.288 3.581 20 5 FHBDRN C[C@H]1CO[C@H](c2ccccc2)CN1c1ncnc2sc([N+](=O)[O-])cc21 ZINC000376446258 941023336 /nfs/dbraw/zinc/02/33/36/941023336.db2.gz FZHNBZXWKLFRKZ-FZMZJTMJSA-N 0 0 356.407 3.566 20 5 FHBDRN CC(C)[C@H](CNC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12)c1cccnc1 ZINC000176332210 941024195 /nfs/dbraw/zinc/02/41/95/941024195.db2.gz WLUCPBWWONXHDM-INIZCTEOSA-N 0 0 352.394 3.641 20 5 FHBDRN CCc1nc(CC(=O)Nc2cc(CC)nc3ccc([N+](=O)[O-])cc32)cs1 ZINC000180504939 941034884 /nfs/dbraw/zinc/03/48/84/941034884.db2.gz OCTRKQGKSXRRND-UHFFFAOYSA-N 0 0 370.434 3.906 20 5 FHBDRN Cc1ccc(Cl)cc1NC(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000122131189 941044387 /nfs/dbraw/zinc/04/43/87/941044387.db2.gz USTDYCMWVYMVBK-UHFFFAOYSA-N 0 0 374.828 3.911 20 5 FHBDRN Cc1cc(OCC(=O)N2CCC[C@@H]2Cc2ccc(F)cc2)ccc1[N+](=O)[O-] ZINC000431829273 941048682 /nfs/dbraw/zinc/04/86/82/941048682.db2.gz WIERRUXTBDWVKL-QGZVFWFLSA-N 0 0 372.396 3.655 20 5 FHBDRN O=C(c1n[nH]c2ccc([N+](=O)[O-])cc21)N1CCC(c2ccsc2)CC1 ZINC000188714736 941049882 /nfs/dbraw/zinc/04/98/82/941049882.db2.gz FOIJZLRCAFCOAN-UHFFFAOYSA-N 0 0 356.407 3.552 20 5 FHBDRN Nc1cccc([N+](=O)[O-])c1C(=O)Nc1cccc(-c2nc3ccccc3[nH]2)c1 ZINC000180612761 941052609 /nfs/dbraw/zinc/05/26/09/941052609.db2.gz MUJGNCDXWVWVAA-UHFFFAOYSA-N 0 0 373.372 3.973 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)N1CCc2cc(Cl)ccc21 ZINC000583102506 941053185 /nfs/dbraw/zinc/05/31/85/941053185.db2.gz GEURRSDGMMBILP-UHFFFAOYSA-N 0 0 355.781 3.792 20 5 FHBDRN COc1ccc(C(=O)CCC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000176504115 941053736 /nfs/dbraw/zinc/05/37/36/941053736.db2.gz ZFYBQZDHYMWTKZ-UHFFFAOYSA-N 0 0 370.405 3.618 20 5 FHBDRN CC(C)n1cnnc1[C@H]1CCCN(Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000180618527 941055726 /nfs/dbraw/zinc/05/57/26/941055726.db2.gz WDNKHSRTHUZGRQ-ZDUSSCGKSA-N 0 0 363.849 3.800 20 5 FHBDRN Cc1csc([C@@H](C)CNC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)n1 ZINC000186801642 941056961 /nfs/dbraw/zinc/05/69/61/941056961.db2.gz VGLAXVYRWLQVNU-NSHDSACASA-N 0 0 362.455 3.698 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)N[C@H]2CC23CCCCC3)cc1SC ZINC000180666454 941061529 /nfs/dbraw/zinc/06/15/29/941061529.db2.gz QHTVKYYIUYWQMN-HNNXBMFYSA-N 0 0 350.440 3.778 20 5 FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC12CCCCC2 ZINC000180685720 941063896 /nfs/dbraw/zinc/06/38/96/941063896.db2.gz HYAPQHIDMYCMBA-MRXNPFEDSA-N 0 0 364.467 3.786 20 5 FHBDRN Cc1ccc(S(=O)(=O)CCCOc2cc(Cl)ccc2[N+](=O)[O-])cc1 ZINC000180689196 941065494 /nfs/dbraw/zinc/06/54/94/941065494.db2.gz GPBVQYRKHZDUPD-UHFFFAOYSA-N 0 0 369.826 3.799 20 5 FHBDRN COC(=O)c1cc(NC(=O)[C@H](C)c2ccc(Cl)s2)cc([N+](=O)[O-])c1 ZINC000176645911 941068007 /nfs/dbraw/zinc/06/80/07/941068007.db2.gz GWQKYCQLFXQAES-MRVPVSSYSA-N 0 0 368.798 3.839 20 5 FHBDRN Cc1cc(C(=O)COc2ncc(C)cc2[N+](=O)[O-])c(C)n1Cc1ccco1 ZINC000176704925 941070337 /nfs/dbraw/zinc/07/03/37/941070337.db2.gz SBOXYXRYINEUAF-UHFFFAOYSA-N 0 0 369.377 3.620 20 5 FHBDRN O=C(Nc1ccc2cc([N+](=O)[O-])ccc2n1)c1ccc(Br)o1 ZINC000176706857 941070784 /nfs/dbraw/zinc/07/07/84/941070784.db2.gz BVQXEMMSJPGZAR-UHFFFAOYSA-N 0 0 362.139 3.751 20 5 FHBDRN CC(C)[C@@H](CNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-])c1cccnc1 ZINC000176746415 941072862 /nfs/dbraw/zinc/07/28/62/941072862.db2.gz HMKZUKIOUUEUHC-QGZVFWFLSA-N 0 0 368.437 3.734 20 5 FHBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N(CC2CC2)c2ccccc2)c(Cl)c1 ZINC000176773101 941075996 /nfs/dbraw/zinc/07/59/96/941075996.db2.gz PVASAFNOLIMWSU-UHFFFAOYSA-N 0 0 366.826 3.854 20 5 FHBDRN Cc1cnc([C@@H](C)CNC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)s1 ZINC000187079143 941077862 /nfs/dbraw/zinc/07/78/62/941077862.db2.gz PCVLMYRUQBPNTQ-LBPRGKRZSA-N 0 0 374.466 3.837 20 5 FHBDRN CC(C)(NC(=O)Cc1c[nH]c2cc(F)ccc12)c1ccc([N+](=O)[O-])cc1 ZINC000176881741 941082557 /nfs/dbraw/zinc/08/25/57/941082557.db2.gz SHWAWITYTWOUTA-UHFFFAOYSA-N 0 0 355.369 3.809 20 5 FHBDRN Cc1ccc(C(=O)NCC2CC2)cc1NC(=O)c1cccc(C)c1[N+](=O)[O-] ZINC000188778923 941082925 /nfs/dbraw/zinc/08/29/25/941082925.db2.gz BRUAASDLYBWPQC-UHFFFAOYSA-N 0 0 367.405 3.604 20 5 FHBDRN Cn1cc(C(=O)Nc2ccc3cc([N+](=O)[O-])ccc3n2)c(-c2ccccc2)n1 ZINC000180834043 941084496 /nfs/dbraw/zinc/08/44/96/941084496.db2.gz VYXPTQPGCGHBRF-UHFFFAOYSA-N 0 0 373.372 3.796 20 5 FHBDRN O=C(Nc1nc(C2CC2)cs1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000180878971 941085441 /nfs/dbraw/zinc/08/54/41/941085441.db2.gz IKGUVLRHVIUYBD-UHFFFAOYSA-N 0 0 355.322 3.782 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N[C@H]2CCC[C@H](C)CC2)cc1OC ZINC000188791521 941086565 /nfs/dbraw/zinc/08/65/65/941086565.db2.gz YFOWRWDVIMTIDJ-STQMWFEESA-N 0 0 350.415 3.701 20 5 FHBDRN Cc1cc(CCNC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)cc(C)c1O ZINC000188802176 941090736 /nfs/dbraw/zinc/09/07/36/941090736.db2.gz QLWOSXYSQNHQHH-CQSZACIVSA-N 0 0 357.410 3.520 20 5 FHBDRN O=C(NCc1ccc(Br)cc1)c1cccc(Cl)c1[N+](=O)[O-] ZINC000149166012 941094802 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FHBDRN Cc1ccc(-c2csc(NC(=O)c3c(N)cccc3[N+](=O)[O-])n2)s1 ZINC000181057733 941106211 /nfs/dbraw/zinc/10/62/11/941106211.db2.gz AMTCSCXOPNVOFY-UHFFFAOYSA-N 0 0 360.420 3.923 20 5 FHBDRN COC[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccc(F)c(F)c1 ZINC000181132773 941110290 /nfs/dbraw/zinc/11/02/90/941110290.db2.gz NKBKQULWZMMWTG-HNNXBMFYSA-N 0 0 370.739 3.644 20 5 FHBDRN C[C@@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1)c1cccc(OC(F)(F)F)c1 ZINC000177316069 941116257 /nfs/dbraw/zinc/11/62/57/941116257.db2.gz PBVCKJRCYUZPCP-LLVKDONJSA-N 0 0 368.311 3.913 20 5 FHBDRN Cc1ccccc1[C@H]1C[C@@H](C)N(C(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)C1 ZINC000181255964 941117798 /nfs/dbraw/zinc/11/77/98/941117798.db2.gz YUUXVVNTOYEPOZ-HIFRSBDPSA-N 0 0 368.389 3.650 20 5 FHBDRN Cc1nc(CC(C)C)oc1C(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000188852957 941119014 /nfs/dbraw/zinc/11/90/14/941119014.db2.gz LKKPRGLTXDTVAQ-UHFFFAOYSA-N 0 0 359.426 3.842 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H](C)c1cn(-c2ccccc2)nn1 ZINC000181337323 941124762 /nfs/dbraw/zinc/12/47/62/941124762.db2.gz IEWKOJZBFWVPDB-LSDHHAIUSA-N 0 0 351.410 3.896 20 5 FHBDRN CC(=O)Nc1ccc(C)cc1NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000128311753 941125679 /nfs/dbraw/zinc/12/56/79/941125679.db2.gz YKUOWRARFJJBOB-UHFFFAOYSA-N 0 0 366.377 3.524 20 5 FHBDRN COC(=O)c1c(C2CC2)csc1NC(=O)c1ccc([N+](=O)[O-])s1 ZINC000177521569 941132291 /nfs/dbraw/zinc/13/22/91/941132291.db2.gz AFAPLKROTNKEPD-UHFFFAOYSA-N 0 0 352.393 3.634 20 5 FHBDRN COCc1ccc(CS(=O)(=O)[C@H](C)c2cc([N+](=O)[O-])ccc2C)cc1 ZINC000414428118 941133017 /nfs/dbraw/zinc/13/30/17/941133017.db2.gz NJXWNYLERHFACY-CQSZACIVSA-N 0 0 363.435 3.726 20 5 FHBDRN CCCc1csc(NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)n1 ZINC000541035988 941134312 /nfs/dbraw/zinc/13/43/12/941134312.db2.gz XABNSRQUWZHVON-UHFFFAOYSA-N 0 0 357.338 3.858 20 5 FHBDRN Cc1c(NCC(=O)Nc2ccccc2Br)cccc1[N+](=O)[O-] ZINC000007975212 941135932 /nfs/dbraw/zinc/13/59/32/941135932.db2.gz LGGYBDJGCKGSJN-UHFFFAOYSA-N 0 0 364.199 3.716 20 5 FHBDRN O=C(Nc1cc(F)cc(F)c1Br)c1ccc([N+](=O)[O-])s1 ZINC000189054419 941146031 /nfs/dbraw/zinc/14/60/31/941146031.db2.gz MJWUQIZJSWQFRZ-UHFFFAOYSA-N 0 0 363.139 3.949 20 5 FHBDRN COc1ccc(CN(C)C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)cc1F ZINC000023734477 941146911 /nfs/dbraw/zinc/14/69/11/941146911.db2.gz CMZXSDGKJBCMMJ-UHFFFAOYSA-N 0 0 373.384 3.589 20 5 FHBDRN C[C@H](CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])Oc1ccc(F)cc1 ZINC000072500511 941155255 /nfs/dbraw/zinc/15/52/55/941155255.db2.gz FHXBNYMOPCXGCN-SNVBAGLBSA-N 0 0 352.749 3.585 20 5 FHBDRN O=C(Nc1ccc(F)c(Cl)c1)c1cc([N+](=O)[O-])ccc1SCCO ZINC000136057399 941155798 /nfs/dbraw/zinc/15/57/98/941155798.db2.gz JFTRJZFBNIKLJK-UHFFFAOYSA-N 0 0 370.789 3.724 20 5 FHBDRN O=[N+]([O-])c1cc(Cc2ccccc2)ccc1OC[C@H](O)CC(F)(F)F ZINC000189421007 941157357 /nfs/dbraw/zinc/15/73/57/941157357.db2.gz IGAUQHBUNNNVPJ-CQSZACIVSA-N 0 0 355.312 3.878 20 5 FHBDRN Cc1ccc(CNc2ccc(I)cn2)cc1[N+](=O)[O-] ZINC000189362461 941157512 /nfs/dbraw/zinc/15/75/12/941157512.db2.gz RBSOBUJXYFVAPH-UHFFFAOYSA-N 0 0 369.162 3.515 20 5 FHBDRN CCc1n[nH]c(C(=O)N[C@@H](C)c2cc(Cl)ccc2Cl)c1[N+](=O)[O-] ZINC000189454267 941158413 /nfs/dbraw/zinc/15/84/13/941158413.db2.gz JRJPQJKVXWIRGA-ZETCQYMHSA-N 0 0 357.197 3.678 20 5 FHBDRN COc1cc(C(=O)Nc2ccccc2OCC(F)F)cc([N+](=O)[O-])c1C ZINC000189435251 941159828 /nfs/dbraw/zinc/15/98/28/941159828.db2.gz QWIWPBCUMHRAPD-UHFFFAOYSA-N 0 0 366.320 3.808 20 5 FHBDRN COc1ccc(NC(=O)c2c(C)onc2-c2ccccc2)cc1[N+](=O)[O-] ZINC000541071977 941161255 /nfs/dbraw/zinc/16/12/55/941161255.db2.gz SFRREFAFBCJIDT-UHFFFAOYSA-N 0 0 353.334 3.819 20 5 FHBDRN CCN(Cc1c[nH]c2ccccc12)C(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000189557732 941161273 /nfs/dbraw/zinc/16/12/73/941161273.db2.gz ZICBQCZOVGZYEG-UHFFFAOYSA-N 0 0 367.405 3.894 20 5 FHBDRN O=C(N[C@H]1CCOc2c(F)cccc21)c1c(Cl)cccc1[N+](=O)[O-] ZINC000189618799 941226634 /nfs/dbraw/zinc/22/66/34/941226634.db2.gz LPAMNLRPYUJQSD-LBPRGKRZSA-N 0 0 350.733 3.641 20 5 FHBDRN C[C@@H](C1CC1)n1cc(NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)cn1 ZINC000189753296 941271021 /nfs/dbraw/zinc/27/10/21/941271021.db2.gz NDTIOMLHDVEJBY-ZDUSSCGKSA-N 0 0 369.425 3.959 20 5 FHBDRN CC(C)c1ccc(C(=O)Nc2nncn2-c2ccccc2)cc1[N+](=O)[O-] ZINC000189770541 941277558 /nfs/dbraw/zinc/27/75/58/941277558.db2.gz TXNVWQNSUVWMMU-UHFFFAOYSA-N 0 0 351.366 3.551 20 5 FHBDRN Cc1cc(NC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)ccc1O ZINC000189793462 941280833 /nfs/dbraw/zinc/28/08/33/941280833.db2.gz WKRKEAZOJQJAJT-UHFFFAOYSA-N 0 0 353.281 3.854 20 5 FHBDRN CCN(Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@@H](O)C(F)(F)F ZINC000189876788 941292815 /nfs/dbraw/zinc/29/28/15/941292815.db2.gz XRVRGIOKRUAMPS-OAHLLOKOSA-N 0 0 358.316 3.600 20 5 FHBDRN Cc1cc(NCc2cccc(C(N)=O)c2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000549107197 941296513 /nfs/dbraw/zinc/29/65/13/941296513.db2.gz FXAHETTXXQEHCB-UHFFFAOYSA-N 0 0 353.300 3.633 20 5 FHBDRN C[C@@H]1C[C@@H]1N(c1ccccc1)S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000414473029 941298420 /nfs/dbraw/zinc/29/84/20/941298420.db2.gz PRJBCPUZRQIMFE-ABAIWWIYSA-N 0 0 366.826 3.852 20 5 FHBDRN COc1cc(C(=O)Nc2ccc(-c3ncco3)cc2)cc([N+](=O)[O-])c1C ZINC000189906412 941298802 /nfs/dbraw/zinc/29/88/02/941298802.db2.gz SAJQDUILUKHCND-UHFFFAOYSA-N 0 0 353.334 3.819 20 5 FHBDRN C[C@@H](CNC(=O)c1c(N)cccc1[N+](=O)[O-])c1ccc(C(F)(F)F)cc1 ZINC000189919908 941303374 /nfs/dbraw/zinc/30/33/74/941303374.db2.gz PMMAMLPRGKUTDT-JTQLQIEISA-N 0 0 367.327 3.729 20 5 FHBDRN O=[N+]([O-])c1ccccc1CN(Cc1cc(F)cc2c1OCOC2)C1CC1 ZINC000179241763 941342059 /nfs/dbraw/zinc/34/20/59/941342059.db2.gz APZQNDPWFNNXIU-UHFFFAOYSA-N 0 0 358.369 3.765 20 5 FHBDRN CC(C)[C@H]1CCCC[C@@H]1NC(=O)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000103326265 941353001 /nfs/dbraw/zinc/35/30/01/941353001.db2.gz PVDYFGVZNRKDLV-OCCSQVGLSA-N 0 0 367.833 3.518 20 5 FHBDRN COc1cc(CNCc2cnccc2C(C)(C)C)c([N+](=O)[O-])cc1OC ZINC000414498184 941367613 /nfs/dbraw/zinc/36/76/13/941367613.db2.gz MJENQCAPBJOJLL-UHFFFAOYSA-N 0 0 359.426 3.594 20 5 FHBDRN CCOC(=O)[C@H](N[C@H](C)CCc1ccccc1[N+](=O)[O-])c1cccc(O)c1 ZINC000190027776 941368144 /nfs/dbraw/zinc/36/81/44/941368144.db2.gz BOLISHGWVCEDLH-AUUYWEPGSA-N 0 0 372.421 3.516 20 5 FHBDRN O=[N+]([O-])c1ccccc1-c1ccc(CNCc2nnc(C3CC3)s2)o1 ZINC000414551351 941377740 /nfs/dbraw/zinc/37/77/40/941377740.db2.gz FLIMTUUZEKYPDQ-UHFFFAOYSA-N 0 0 356.407 3.874 20 5 FHBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N(C)c1ccc(N(C)C)cc1 ZINC000103415738 941400489 /nfs/dbraw/zinc/40/04/89/941400489.db2.gz NWRHTTHYMUBKRG-CYBMUJFWSA-N 0 0 359.451 3.804 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)Nc1ccc(-c2cc[nH]n2)cc1 ZINC000376785571 941429769 /nfs/dbraw/zinc/42/97/69/941429769.db2.gz DOXKSZGTVIPKRS-UHFFFAOYSA-N 0 0 365.393 3.691 20 5 FHBDRN Cc1nc(COC(C)(C)C)oc1-c1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000573123643 941442128 /nfs/dbraw/zinc/44/21/28/941442128.db2.gz LRYVXPUNGUBGBK-UHFFFAOYSA-N 0 0 358.354 3.923 20 5 FHBDRN Cc1cccc(N[C@@H]2CCc3nnc(-c4ccc(F)cc4)n3C2)c1[N+](=O)[O-] ZINC000549137549 941513705 /nfs/dbraw/zinc/51/37/05/941513705.db2.gz OKMLGOSGZGVQJW-OAHLLOKOSA-N 0 0 367.384 3.728 20 5 FHBDRN O=C(c1c[nH]c2cc([N+](=O)[O-])ccc12)N1CC[C@](F)(c2ccccc2F)C1 ZINC000549141890 941517810 /nfs/dbraw/zinc/51/78/10/941517810.db2.gz MBLYDPOYISEJLH-LJQANCHMSA-N 0 0 371.343 3.926 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(F)c(F)c1F ZINC000549157879 941550842 /nfs/dbraw/zinc/55/08/42/941550842.db2.gz SEDCQSOWIBEANV-UHFFFAOYSA-N 0 0 353.300 3.719 20 5 FHBDRN CCOc1ccc(Oc2ccc(NC(=O)c3c[nH]nc3[N+](=O)[O-])cc2)cc1 ZINC000549158048 941551043 /nfs/dbraw/zinc/55/10/43/941551043.db2.gz ZXQHLZWZNSNNMG-UHFFFAOYSA-N 0 0 368.349 3.761 20 5 FHBDRN Cc1cc(C(=O)Nc2ccc(Cl)cc2-n2cccn2)cc([N+](=O)[O-])c1 ZINC000472680987 941552835 /nfs/dbraw/zinc/55/28/35/941552835.db2.gz YHMOQSJSTQATDE-UHFFFAOYSA-N 0 0 356.769 3.995 20 5 FHBDRN C[C@H](C(=O)N[C@@H](c1ccc(F)cc1)[C@@H]1CCCO1)c1cccc([N+](=O)[O-])c1 ZINC000564700335 941563882 /nfs/dbraw/zinc/56/38/82/941563882.db2.gz YRSACRWGAHKNPB-AGRHKRQWSA-N 0 0 372.396 3.874 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(N[C@@H](C)[C@H](OC)c2ccccc2F)c1 ZINC000541113645 941580218 /nfs/dbraw/zinc/58/02/18/941580218.db2.gz MKJXISGUJDGICA-GTNSWQLSSA-N 0 0 362.357 3.709 20 5 FHBDRN Cc1nc(CC(C)C)c(NC(=O)CCNc2ccccc2[N+](=O)[O-])s1 ZINC000472691599 941584741 /nfs/dbraw/zinc/58/47/41/941584741.db2.gz PIYODKSPZTZCMV-UHFFFAOYSA-N 0 0 362.455 3.999 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(N[C@H](C)[C@@H](OC)c2ccc(F)cc2)c1 ZINC000541113104 941591102 /nfs/dbraw/zinc/59/11/02/941591102.db2.gz HLBRGWBEIXCARA-PIGZYNQJSA-N 0 0 362.357 3.709 20 5 FHBDRN C[C@@]1(F)CCCN(C(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000836478126 941601714 /nfs/dbraw/zinc/60/17/14/941601714.db2.gz SWANRYFYAHWFKX-CYBMUJFWSA-N 0 0 360.183 3.713 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(N2CCc3c(ncn3-c3ccc(C)cc3)C2)c1 ZINC000549183361 941604382 /nfs/dbraw/zinc/60/43/82/941604382.db2.gz MUMHIWHHVLSFLE-UHFFFAOYSA-N 0 0 364.405 3.660 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(N[C@H](C)[C@H](OC)c2ccc(OC)cc2)c1 ZINC000541113246 941605496 /nfs/dbraw/zinc/60/54/96/941605496.db2.gz VHKYTHIJJZAYKJ-XIKOKIGWSA-N 0 0 374.393 3.578 20 5 FHBDRN CCOc1cccc(C(=O)N2CCS[C@H]2c2ccc([N+](=O)[O-])cc2)c1 ZINC000460352168 941612856 /nfs/dbraw/zinc/61/28/56/941612856.db2.gz NRQQQTOTWAPTRV-SFHVURJKSA-N 0 0 358.419 3.881 20 5 FHBDRN O=C(c1ccc2c(c1)CCOC2)N1CCCCc2cc([N+](=O)[O-])ccc21 ZINC000892852719 941619562 /nfs/dbraw/zinc/61/95/62/941619562.db2.gz CYYMBMJSVQKMSX-UHFFFAOYSA-N 0 0 352.390 3.651 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])c1cccc(C(=O)OC(C)(C)C)n1 ZINC000549198198 941634494 /nfs/dbraw/zinc/63/44/94/941634494.db2.gz CBMLLKFZWXBDPD-UHFFFAOYSA-N 0 0 357.410 3.624 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N(CCOC)[C@@H](C)c2ccccc2)c1 ZINC000549208263 941644730 /nfs/dbraw/zinc/64/47/30/941644730.db2.gz KLLSFGZHAMQLHU-HNNXBMFYSA-N 0 0 372.421 3.843 20 5 FHBDRN COC(=O)c1ccc([N+](=O)[O-])c(NCCc2nc3ccccc3s2)c1 ZINC000302083414 941649335 /nfs/dbraw/zinc/64/93/35/941649335.db2.gz JZOSGPLOFVRDSJ-UHFFFAOYSA-N 0 0 357.391 3.646 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2nccc(/C=C\c3cccnc3Cl)[n+]2[O-])c1 ZINC000728698409 941673107 /nfs/dbraw/zinc/67/31/07/941673107.db2.gz JMGFWUKHVRIWOB-SREVYHEPSA-N 0 0 354.753 3.509 20 5 FHBDRN CC(=O)c1cc(N2CCC(Cn3nc(C)cc3C)CC2)ccc1[N+](=O)[O-] ZINC000377390327 941688709 /nfs/dbraw/zinc/68/87/09/941688709.db2.gz GRZMJCDMBIKEMK-UHFFFAOYSA-N 0 0 356.426 3.527 20 5 FHBDRN O=[N+]([O-])c1ccc2[nH]c(C(Cl)=Cc3cn(-c4ccccc4)nn3)nc2c1 ZINC000728700291 941689088 /nfs/dbraw/zinc/68/90/88/941689088.db2.gz NMHKWOLCBKKXLX-RIYZIHGNSA-N 0 0 366.768 3.789 20 5 FHBDRN COc1ccccc1[C@H](Nc1cc(F)ccc1[N+](=O)[O-])c1nccn1C ZINC000365561351 941694424 /nfs/dbraw/zinc/69/44/24/941694424.db2.gz NIYJPNPDCNQCCD-KRWDZBQOSA-N 0 0 356.357 3.678 20 5 FHBDRN O=C(Nc1ccnn1-c1ccc([N+](=O)[O-])cc1)[C@@H]1Cc2ccc(Cl)cc21 ZINC001125859343 941704105 /nfs/dbraw/zinc/70/41/05/941704105.db2.gz RHPSOQHADCMPJT-MRXNPFEDSA-N 0 0 368.780 3.712 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)[C@@H]2COCC[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000415292474 941733021 /nfs/dbraw/zinc/73/30/21/941733021.db2.gz HEXWWSAANIQFST-ATZDWAIDSA-N 0 0 368.433 3.901 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1OC(F)F)N1CCS[C@H]2CCCC[C@@H]21 ZINC000182341200 941738083 /nfs/dbraw/zinc/73/80/83/941738083.db2.gz YBVXPWAVXIVJPV-JSGCOSHPSA-N 0 0 372.393 3.696 20 5 FHBDRN O=C(Nc1cc(F)c(F)cc1F)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000729406776 941747146 /nfs/dbraw/zinc/74/71/46/941747146.db2.gz ACFMYFRXWHORCO-UHFFFAOYSA-N 0 0 365.311 3.865 20 5 FHBDRN CN(Cc1cc(Cl)ccc1F)C(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000433566104 941772228 /nfs/dbraw/zinc/77/22/28/941772228.db2.gz RMOWTJOMTBKCMM-UHFFFAOYSA-N 0 0 351.765 3.729 20 5 FHBDRN C[C@@H]1COC[C@H](c2ccccc2)N1C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000415363209 941776172 /nfs/dbraw/zinc/77/61/72/941776172.db2.gz RFYUKMKYNYORML-ZVEHZALQSA-N 0 0 366.417 3.687 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N2CCC[C@]3(CC=CCC3)C2)c1F ZINC000412111874 941790588 /nfs/dbraw/zinc/79/05/88/941790588.db2.gz OOXTVLBOPXOUIT-LJQANCHMSA-N 0 0 362.401 3.634 20 5 FHBDRN O=[N+]([O-])c1ccc(NC2CCN(Cc3cscn3)CC2)c2ncccc12 ZINC000377539145 941795834 /nfs/dbraw/zinc/79/58/34/941795834.db2.gz CHNLCMUGOGECDI-UHFFFAOYSA-N 0 0 369.450 3.676 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CCCc2ccc(F)c(F)c21 ZINC000415387608 941796700 /nfs/dbraw/zinc/79/67/00/941796700.db2.gz QQAGLZCGFRVQTK-LSDHHAIUSA-N 0 0 358.344 3.956 20 5 FHBDRN O=[N+]([O-])c1cnn(CCN(Cc2c(Cl)cccc2Cl)C2CC2)c1 ZINC000513228761 941800076 /nfs/dbraw/zinc/80/00/76/941800076.db2.gz MCYWEKDGNQKZGJ-UHFFFAOYSA-N 0 0 355.225 3.763 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N2CCC[C@H]2c2ccc(C)o2)c1F ZINC000412121883 941803679 /nfs/dbraw/zinc/80/36/79/941803679.db2.gz DATMHFMTSBFLET-AWEZNQCLSA-N 0 0 362.357 3.550 20 5 FHBDRN COc1ccccc1[C@@H]1CCN(C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)C1 ZINC000412123328 941808002 /nfs/dbraw/zinc/80/80/02/941808002.db2.gz LSVAWBCXUQYIAA-AYOQOUSVSA-N 0 0 366.417 3.723 20 5 FHBDRN COC(=O)[C@H](C)[C@H](NCc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000182348141 941812993 /nfs/dbraw/zinc/81/29/93/941812993.db2.gz WTRCOSTVWJYSQT-PXAZEXFGSA-N 0 0 362.813 3.888 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)N1CCC[C@H](c2ccccc2)C1 ZINC000431844504 941813200 /nfs/dbraw/zinc/81/32/00/941813200.db2.gz MMZBBZLNUMXYGH-SFHVURJKSA-N 0 0 353.422 3.727 20 5 FHBDRN Cn1cnc([N+](=O)[O-])c1CSCCc1cccc(OC(F)(F)F)c1 ZINC000433661124 941823733 /nfs/dbraw/zinc/82/37/33/941823733.db2.gz UBEHWGSSGZUSGW-UHFFFAOYSA-N 0 0 361.345 3.703 20 5 FHBDRN Cc1ccc(O[C@H](C)CNC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)cc1 ZINC000412143621 941841367 /nfs/dbraw/zinc/84/13/67/941841367.db2.gz DSKCKKGRJUHZKP-MDASCCDHSA-N 0 0 354.406 3.590 20 5 FHBDRN COc1ccccc1C1CC(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000377615745 941845789 /nfs/dbraw/zinc/84/57/89/941845789.db2.gz QMQLCRWCUPZOAH-UHFFFAOYSA-N 0 0 360.797 3.933 20 5 FHBDRN C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F)c1ccncc1F ZINC000513333929 941858091 /nfs/dbraw/zinc/85/80/91/941858091.db2.gz RQQZRWXSVPCLOJ-QMMMGPOBSA-N 0 0 357.263 3.639 20 5 FHBDRN Cc1c(NCc2nnsc2Cl)cc(Br)cc1[N+](=O)[O-] ZINC000517476674 941859797 /nfs/dbraw/zinc/85/97/97/941859797.db2.gz XWYLRJIBQKCWES-UHFFFAOYSA-N 0 0 363.624 3.783 20 5 FHBDRN CCOc1ccc2cc(C(=O)N(C)CCc3cccc([N+](=O)[O-])c3)[nH]c2c1 ZINC000513348041 941860457 /nfs/dbraw/zinc/86/04/57/941860457.db2.gz HLQAHUMDKYPXGJ-UHFFFAOYSA-N 0 0 367.405 3.790 20 5 FHBDRN C[C@@H]1CN(C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)[C@@H](c2ccccc2)CO1 ZINC000412178388 941860522 /nfs/dbraw/zinc/86/05/22/941860522.db2.gz WIEYJOFIFSPALI-ZVEHZALQSA-N 0 0 366.417 3.687 20 5 FHBDRN C[C@H](NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)[C@H]1Oc2ccccc2[C@@H]1C ZINC000412171368 941861298 /nfs/dbraw/zinc/86/12/98/941861298.db2.gz JPAMKDASBVKPJA-WVDHAAHHSA-N 0 0 366.417 3.768 20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CCS[C@@H]3CCCC[C@@H]32)ccc1[N+](=O)[O-] ZINC000412175798 941864206 /nfs/dbraw/zinc/86/42/06/941864206.db2.gz PBIKQQWBZVOGMO-DOTOQJQBSA-N 0 0 364.467 3.882 20 5 FHBDRN COc1cc2c(cc1Cl)CN(c1cc(OC)c([N+](=O)[O-])cc1F)CC2 ZINC000549293219 941864359 /nfs/dbraw/zinc/86/43/59/941864359.db2.gz HUADEHNBULVJRQ-UHFFFAOYSA-N 0 0 366.776 3.967 20 5 FHBDRN CC(C)c1[nH]nc(C(=O)Nc2ccc3nn(C(C)C)cc3c2)c1[N+](=O)[O-] ZINC000433768201 941875316 /nfs/dbraw/zinc/87/53/16/941875316.db2.gz IGFIUGPTPOLVIV-UHFFFAOYSA-N 0 0 356.386 3.624 20 5 FHBDRN COc1cc(C(=O)NCCc2ccc(Cl)cc2Cl)ccc1[N+](=O)[O-] ZINC000511529141 941881061 /nfs/dbraw/zinc/88/10/61/941881061.db2.gz AUHSPWUZXRZGKU-UHFFFAOYSA-N 0 0 369.204 3.883 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N2CC[C@H](c3ccccc3)[C@H]2C)c1F ZINC000412182227 941881883 /nfs/dbraw/zinc/88/18/83/941881883.db2.gz ZGHHTKJCNYENLR-HIFRSBDPSA-N 0 0 372.396 3.690 20 5 FHBDRN CC(C)Cn1c(-c2ccc[nH]2)nnc1N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000460606027 941885268 /nfs/dbraw/zinc/88/52/68/941885268.db2.gz LIHVGJYWKJKRMR-UHFFFAOYSA-N 0 0 368.441 3.516 20 5 FHBDRN COc1cc2c(cc1N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1)NC(=O)CC2 ZINC000274398413 941887073 /nfs/dbraw/zinc/88/70/73/941887073.db2.gz PRWYPNQYEDSBNN-GFCCVEGCSA-N 0 0 355.394 3.970 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CCCN(C)c3ccc(F)cc32)c1 ZINC000549301178 941887239 /nfs/dbraw/zinc/88/72/39/941887239.db2.gz YPZOMRBWBQTEEZ-UHFFFAOYSA-N 0 0 373.384 3.619 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])c(F)c1)N1CCCc2cccc(Cl)c21 ZINC000728705780 941890115 /nfs/dbraw/zinc/89/01/15/941890115.db2.gz XIHHGCUIEFBRRH-UHFFFAOYSA-N 0 0 364.760 3.746 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(N[C@H](CO)c2ccccc2OC(F)(F)F)c1 ZINC000480790330 941890380 /nfs/dbraw/zinc/89/03/80/941890380.db2.gz VHLHDGAIXSGVRN-CYBMUJFWSA-N 0 0 356.300 3.947 20 5 FHBDRN O=C1CCCN1C[C@@H](NCc1c(Cl)cccc1[N+](=O)[O-])c1ccccc1 ZINC000119657119 941896416 /nfs/dbraw/zinc/89/64/16/941896416.db2.gz NCRDPRCUMPEYCH-QGZVFWFLSA-N 0 0 373.840 3.702 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)NCC(C)(C)C2CCCC2)c1F ZINC000412201050 941900667 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Cc1n[nH]c(C)c1[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1 ZINC000412217738 941925844 /nfs/dbraw/zinc/92/58/44/941925844.db2.gz LRSASIIDRAPNGL-INIZCTEOSA-N 0 0 372.425 3.699 20 5 FHBDRN O=C(N[C@H]1CCO[C@H]1c1ccc(Cl)cc1)c1ccc(F)cc1[N+](=O)[O-] ZINC000182453047 941926052 /nfs/dbraw/zinc/92/60/52/941926052.db2.gz QYZLEDYKKRQNQZ-HOCLYGCPSA-N 0 0 364.760 3.647 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N(Cc2ccc([C@H]3C[C@@H]3C)o2)C2CC2)c1[N+](=O)[O-] ZINC000433830073 941926068 /nfs/dbraw/zinc/92/60/68/941926068.db2.gz HCJATALRSNIZOF-FZMZJTMJSA-N 0 0 372.425 3.963 20 5 FHBDRN CCOc1ccc([C@H]2CCCN2C(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])cc1 ZINC000433840143 941937095 /nfs/dbraw/zinc/93/70/95/941937095.db2.gz CGYJFUBYCPWCDD-OAHLLOKOSA-N 0 0 372.425 3.817 20 5 FHBDRN CC[C@@H](NC(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1)c1c(C)noc1C ZINC000412221596 941937820 /nfs/dbraw/zinc/93/78/20/941937820.db2.gz XDKSMQKLHWERSJ-CQSZACIVSA-N 0 0 361.398 3.868 20 5 FHBDRN CC(C)Oc1cc(C(=O)N[C@@H]2CCO[C@H](C(C)(C)C)C2)ccc1[N+](=O)[O-] ZINC000412230100 941942423 /nfs/dbraw/zinc/94/24/23/941942423.db2.gz KRFUNZOKKQYXKW-PBHICJAKSA-N 0 0 364.442 3.706 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N2CCC(CCc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000433855731 941943521 /nfs/dbraw/zinc/94/35/21/941943521.db2.gz VEFIQHXQLPDLMZ-UHFFFAOYSA-N 0 0 370.453 3.926 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1F)N1CC[C@](F)(c2ccccc2F)C1 ZINC000549320507 941943487 /nfs/dbraw/zinc/94/34/87/941943487.db2.gz BKDDERBHWGJTMH-QGZVFWFLSA-N 0 0 350.296 3.584 20 5 FHBDRN O=C(c1cc([N+](=O)[O-])ccc1OC(F)F)N1CCc2ccc(F)cc2C1 ZINC000182566392 941944639 /nfs/dbraw/zinc/94/46/39/941944639.db2.gz CSCWQSQCMZGRFC-UHFFFAOYSA-N 0 0 366.295 3.534 20 5 FHBDRN O=C(Nc1cc(Cl)ccc1O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000182595837 941946377 /nfs/dbraw/zinc/94/63/77/941946377.db2.gz DLNOFRBZGPEWNR-UHFFFAOYSA-N 0 0 358.684 3.808 20 5 FHBDRN O=C(N[C@H]1CCCc2occc21)c1cccc([N+](=O)[O-])c1Br ZINC000182660973 941949634 /nfs/dbraw/zinc/94/96/34/941949634.db2.gz WKVZHIMPVFVMSL-NSHDSACASA-N 0 0 365.183 3.758 20 5 FHBDRN Cc1cccc(OC[C@@H](O)C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1 ZINC000513483484 941950331 /nfs/dbraw/zinc/95/03/31/941950331.db2.gz DJTFBWJPUANMLX-IBGZPJMESA-N 0 0 358.438 3.554 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1COCC[C@@H]1c1ccccc1 ZINC000415620331 941956657 /nfs/dbraw/zinc/95/66/57/941956657.db2.gz IPIHLFCFZDQRQZ-IAGOWNOFSA-N 0 0 370.405 3.752 20 5 FHBDRN COc1ccc([C@H](NC(=O)Cc2ccccc2[N+](=O)[O-])C(F)(F)F)cc1 ZINC000182639540 941957166 /nfs/dbraw/zinc/95/71/66/941957166.db2.gz ZERQINYQKXIBAA-INIZCTEOSA-N 0 0 368.311 3.566 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])N[C@H](c1c(F)cccc1F)C(F)(F)F ZINC000182776657 941959403 /nfs/dbraw/zinc/95/94/03/941959403.db2.gz GELXAZADBAOTMT-OAHLLOKOSA-N 0 0 374.265 3.835 20 5 FHBDRN Cc1cnn([C@@H]2CCN(Cc3ccc([N+](=O)[O-])cc3C(F)(F)F)C2)c1 ZINC000377759667 941966447 /nfs/dbraw/zinc/96/64/47/941966447.db2.gz IAMOVFKVIKVZDF-CQSZACIVSA-N 0 0 354.332 3.566 20 5 FHBDRN COc1cc(CS[C@@H]2CCO[C@@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000182788312 941966843 /nfs/dbraw/zinc/96/68/43/941966843.db2.gz SDYDRQAZWJKDDW-YMTOWFKASA-N 0 0 363.382 3.658 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCn2c(nnc2-c2ccccc2)C1 ZINC000182818598 941971835 /nfs/dbraw/zinc/97/18/35/941971835.db2.gz MMCMHAAMTBVAFF-OAHLLOKOSA-N 0 0 363.421 3.739 20 5 FHBDRN CC(C)Oc1cc(C(=O)N(C)c2nc3ccccc3n2C)ccc1[N+](=O)[O-] ZINC000412258575 941988373 /nfs/dbraw/zinc/98/83/73/941988373.db2.gz YUAFPUZYTIUMMR-UHFFFAOYSA-N 0 0 368.393 3.545 20 5 FHBDRN CN(C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000377792480 941991947 /nfs/dbraw/zinc/99/19/47/941991947.db2.gz YBMPLSSGZYCPHW-ZLKJLUDKSA-N 0 0 353.806 3.525 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)N1CC[C@@H](CC(F)(F)F)C1 ZINC000433918340 941996323 /nfs/dbraw/zinc/99/63/23/941996323.db2.gz JINVCFIYBYTJTC-VIFPVBQESA-N 0 0 365.739 3.732 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)N1CCC(CCCn2ccnc2)CC1 ZINC000541171751 942005645 /nfs/dbraw/zinc/00/56/45/942005645.db2.gz CJABOGVWMDBSLC-UHFFFAOYSA-N 0 0 357.414 3.516 20 5 FHBDRN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CC[C@H](COc2ccccc2)C1 ZINC000412263183 942012386 /nfs/dbraw/zinc/01/23/86/942012386.db2.gz ZFEIGBIWKKBDIY-RYGJVYDSSA-N 0 0 366.417 3.626 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1Cl)N1CCC([C@H]2CCOC2)CC1 ZINC000377820241 942012851 /nfs/dbraw/zinc/01/28/51/942012851.db2.gz BXBMXDLHSYLZJH-LBPRGKRZSA-N 0 0 353.806 3.529 20 5 FHBDRN CSc1cccc(N(C)S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000101849680 942014898 /nfs/dbraw/zinc/01/48/98/942014898.db2.gz NXAZBEMNCNQIOU-UHFFFAOYSA-N 0 0 372.855 3.795 20 5 FHBDRN CSc1cccc(F)c1CNC(=O)Nc1ccc([N+](=O)[O-])cc1F ZINC000513559243 942016283 /nfs/dbraw/zinc/01/62/83/942016283.db2.gz UZKQHDJCRJTXCN-UHFFFAOYSA-N 0 0 353.350 3.917 20 5 FHBDRN COCc1ccc([C@H]2CCCN2C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)o1 ZINC000412269845 942016515 /nfs/dbraw/zinc/01/65/15/942016515.db2.gz LXFWMBOGANSEQV-RCCFBDPRSA-N 0 0 370.405 3.801 20 5 FHBDRN 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HBOVDUVPLCFIRY-UHFFFAOYSA-N 0 0 368.397 3.506 20 5 FHBDRN O=c1c2cc([N+](=O)[O-])ccc2nc2n1CC/C2=C\c1cc(F)c(F)c(F)c1 ZINC000102713975 942086712 /nfs/dbraw/zinc/08/67/12/942086712.db2.gz VKZKYYHHBVYDSY-BJMVGYQFSA-N 0 0 373.290 3.666 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])c(Cl)c1)c1ncccc1-c1ccccn1 ZINC001125864161 942088022 /nfs/dbraw/zinc/08/80/22/942088022.db2.gz KSRUGBITWFESNW-UHFFFAOYSA-N 0 0 354.753 3.958 20 5 FHBDRN Cc1[nH]c(-c2ccccc2)nc1C(=O)OCc1cccc([N+](=O)[O-])c1C ZINC000728724706 942089353 /nfs/dbraw/zinc/08/93/53/942089353.db2.gz DTJFQQRQNMQRTP-UHFFFAOYSA-N 0 0 351.362 3.959 20 5 FHBDRN CC(C)(C)OC(=O)[C@]1(C)CCN(c2nccc3ccc([N+](=O)[O-])cc32)C1 ZINC000413359392 942091940 /nfs/dbraw/zinc/09/19/40/942091940.db2.gz OBHRWUFGYDZKNU-LJQANCHMSA-N 0 0 357.410 3.701 20 5 FHBDRN Cc1sc(S(=O)(=O)N(Cc2ccccc2)C(C)C)cc1[N+](=O)[O-] ZINC000122720746 942092239 /nfs/dbraw/zinc/09/22/39/942092239.db2.gz MDZPBJWPLJKMTF-UHFFFAOYSA-N 0 0 354.453 3.564 20 5 FHBDRN O=C(Cc1cc(F)c(Cl)cc1[N+](=O)[O-])N[C@H]1CCOC2(CCCC2)C1 ZINC000280060531 942094829 /nfs/dbraw/zinc/09/48/29/942094829.db2.gz GVSVXEGBRDQKAQ-LBPRGKRZSA-N 0 0 370.808 3.538 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N[C@@H](C)c1ccc2c(c1)CCC(=O)N2 ZINC001125864198 942095657 /nfs/dbraw/zinc/09/56/57/942095657.db2.gz MGTJHZBUIWHENW-ZDUSSCGKSA-N 0 0 367.405 3.587 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C[C@H](O)COc1ccc(C(C)(C)C)cc1 ZINC000501876645 942099135 /nfs/dbraw/zinc/09/91/35/942099135.db2.gz VEKQQQFFWBSMGA-SFHVURJKSA-N 0 0 372.465 3.764 20 5 FHBDRN C[C@H]1CN(C(=O)c2cccc3c(=O)c4ccccc4[nH]c23)C[C@H](C2CC2)O1 ZINC000280085829 942099493 /nfs/dbraw/zinc/09/94/93/942099493.db2.gz QLMSSKJGKCEUFT-ORAYPTAESA-N 0 0 362.429 3.733 20 5 FHBDRN Cc1ccn(-c2ccc(NC(=O)c3c(Cl)cccc3[N+](=O)[O-])cc2)n1 ZINC000501887385 942103393 /nfs/dbraw/zinc/10/33/93/942103393.db2.gz ISMZXLYVFUXWDI-UHFFFAOYSA-N 0 0 356.769 3.995 20 5 FHBDRN NC(=O)c1cccc([N+](=O)[O-])c1N1CCC(c2c[nH]c3ccccc32)CC1 ZINC000420591705 942111920 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COc1cc(N2CC[C@@H](C(F)(F)F)C3(CCOCC3)C2)ccc1[N+](=O)[O-] ZINC000413391314 942128867 /nfs/dbraw/zinc/12/88/67/942128867.db2.gz GBEJBBCOEQFUEO-OAHLLOKOSA-N 0 0 374.359 3.789 20 5 FHBDRN CO[C@@](C)([C@@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F)C1CC1 ZINC000415916340 942139326 /nfs/dbraw/zinc/13/93/26/942139326.db2.gz HCIBTNGJROCPOA-PSLIRLAXSA-N 0 0 360.332 3.547 20 5 FHBDRN COc1ccccc1C1(F)CCN(C(=O)c2csc([N+](=O)[O-])c2)CC1 ZINC000366652023 942141567 /nfs/dbraw/zinc/14/15/67/942141567.db2.gz IAAGCRUSBAJTBV-UHFFFAOYSA-N 0 0 364.398 3.766 20 5 FHBDRN COC(=O)c1cc(C)nc(N[C@@H](C)c2cc(C)ccc2OC)c1[N+](=O)[O-] ZINC000413395749 942142967 /nfs/dbraw/zinc/14/29/67/942142967.db2.gz CGCYGGIYRSNMBS-LBPRGKRZSA-N 0 0 359.382 3.575 20 5 FHBDRN C[C@H](Nc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2)c1nc2c(s1)CCC2 ZINC000413396340 942143911 /nfs/dbraw/zinc/14/39/11/942143911.db2.gz OPRLKIKOAPCEDO-VIFPVBQESA-N 0 0 358.423 3.598 20 5 FHBDRN COc1cccc(-c2nsc(NC(=O)c3cccc(C)c3[N+](=O)[O-])n2)c1 ZINC000102911048 942145505 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FHBDRN C[C@H](CC(F)F)C(=O)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F ZINC000413430373 942170398 /nfs/dbraw/zinc/17/03/98/942170398.db2.gz DZLFAKFEAASGLR-SECBINFHSA-N 0 0 354.275 3.777 20 5 FHBDRN CC(C)[C@@H]1N(c2sc(S(C)(=O)=O)cc2[N+](=O)[O-])CC12CCCCC2 ZINC000413444702 942191282 /nfs/dbraw/zinc/19/12/82/942191282.db2.gz SOMAWCAHWJCZLY-AWEZNQCLSA-N 0 0 372.512 3.855 20 5 FHBDRN CN(C(=O)COc1ccc([N+](=O)[O-])cc1)[C@@H](c1ccccc1)C(F)(F)F ZINC000103051242 942192613 /nfs/dbraw/zinc/19/26/13/942192613.db2.gz LETFZPYYBMVLNL-INIZCTEOSA-N 0 0 368.311 3.736 20 5 FHBDRN Cc1nc2ccc(NC(=O)c3ccc(OC(F)F)c([N+](=O)[O-])c3)cc2o1 ZINC000513729060 942211028 /nfs/dbraw/zinc/21/10/28/942211028.db2.gz DBMBVRSZKHJDEA-UHFFFAOYSA-N 0 0 363.276 3.898 20 5 FHBDRN O=C(NCCc1ccc([N+](=O)[O-])cc1)N1CCC[C@H](CC(F)(F)F)C1 ZINC000420823263 942213015 /nfs/dbraw/zinc/21/30/15/942213015.db2.gz PEDXSOFGGXTIDI-CYBMUJFWSA-N 0 0 359.348 3.511 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)NC[C@@H]1CC12CCSCC2 ZINC000420828157 942214880 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20 5 FHBDRN CC(C)Oc1cc(C(=O)N2CCCN(C)c3ccccc32)ccc1[N+](=O)[O-] ZINC000413476727 942222794 /nfs/dbraw/zinc/22/27/94/942222794.db2.gz FMKHCZHAQFIWQS-UHFFFAOYSA-N 0 0 369.421 3.869 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])Nc1ccc(OC2CCC2)c(F)c1 ZINC000480958974 942230000 /nfs/dbraw/zinc/23/00/00/942230000.db2.gz RONLYGPVKSVUBM-UHFFFAOYSA-N 0 0 359.357 3.716 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)N2CCc3cc(C)ccc3C2)cc1SC ZINC000480956633 942230112 /nfs/dbraw/zinc/23/01/12/942230112.db2.gz FLBBXFPREWYKAN-UHFFFAOYSA-N 0 0 372.446 3.832 20 5 FHBDRN CC(C)OC(=O)C[C@@H](NCc1ccc([N+](=O)[O-])cc1F)c1ccccc1 ZINC000541190970 942231233 /nfs/dbraw/zinc/23/12/33/942231233.db2.gz XGRSPHVDLMISNJ-GOSISDBHSA-N 0 0 360.385 3.907 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N1CCC[C@H]1Cc1cccc(F)c1 ZINC000122791845 942232489 /nfs/dbraw/zinc/23/24/89/942232489.db2.gz IKQWIMGJDQSRQX-HNNXBMFYSA-N 0 0 373.384 3.982 20 5 FHBDRN Cc1nn(C)c(N2CC(Cc3ccccc3)(c3ccccc3)C2)c1[N+](=O)[O-] ZINC000413484402 942238030 /nfs/dbraw/zinc/23/80/30/942238030.db2.gz UCZXMMTWRAFLRS-UHFFFAOYSA-N 0 0 362.433 3.637 20 5 FHBDRN CCS(=O)(=O)c1cc(Cl)cc(CNc2ccc(C)cc2[N+](=O)[O-])c1 ZINC000413487709 942240050 /nfs/dbraw/zinc/24/00/50/942240050.db2.gz NIUDBJZBWUNQMY-UHFFFAOYSA-N 0 0 368.842 3.962 20 5 FHBDRN O=C(NC[C@H]1CCC(F)(F)C1)c1cc([N+](=O)[O-])ccc1Br ZINC000280728640 942241103 /nfs/dbraw/zinc/24/11/03/942241103.db2.gz NXACPQXIOXXRFQ-QMMMGPOBSA-N 0 0 363.158 3.523 20 5 FHBDRN CC(C)[C@@H]1CCCC[C@@H]1NC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000103326276 942244398 /nfs/dbraw/zinc/24/43/98/942244398.db2.gz KPNONADDNNUHSP-JSGCOSHPSA-N 0 0 367.833 3.518 20 5 FHBDRN O=C(NC[C@@H]1CCC(F)(F)C1)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000280750735 942244569 /nfs/dbraw/zinc/24/45/69/942244569.db2.gz PUUPWRORVWIWLU-MRVPVSSYSA-N 0 0 352.259 3.779 20 5 FHBDRN COCCOc1cccc(CNc2ncc([N+](=O)[O-])cc2C(F)(F)F)c1 ZINC000413070017 942250900 /nfs/dbraw/zinc/25/09/00/942250900.db2.gz DZPQVMCXVZJSHX-UHFFFAOYSA-N 0 0 371.315 3.646 20 5 FHBDRN COc1cc(C(=O)N2C[C@H]3CCCCC[C@H]32)c([N+](=O)[O-])cc1OC(F)F ZINC000378082465 942256919 /nfs/dbraw/zinc/25/69/19/942256919.db2.gz HDARENKJRGRPHQ-ZYHUDNBSSA-N 0 0 370.352 3.610 20 5 FHBDRN Cc1c(Cl)cc2c(c1Cl)CCCN2C(=O)c1nn(C)cc1[N+](=O)[O-] ZINC000416010233 942258931 /nfs/dbraw/zinc/25/89/31/942258931.db2.gz GVFROXUMVSYPOI-UHFFFAOYSA-N 0 0 369.208 3.537 20 5 FHBDRN CCC(CC)C(=O)N1CCC(Nc2ccc([N+](=O)[O-])c3ncccc23)CC1 ZINC000413073959 942259676 /nfs/dbraw/zinc/25/96/76/942259676.db2.gz QXNAAFQNGRNIIA-UHFFFAOYSA-N 0 0 370.453 3.982 20 5 FHBDRN CC(C)=CCCNC(=O)c1ccc(Cn2nc(C)c([N+](=O)[O-])c2C)cc1 ZINC000480995486 942269874 /nfs/dbraw/zinc/26/98/74/942269874.db2.gz XBXSVWFTPMTAQJ-UHFFFAOYSA-N 0 0 356.426 3.543 20 5 FHBDRN CC(C)(CNC(=O)c1cc2cc([N+](=O)[O-])ccc2s1)c1ccncc1 ZINC000179731605 942276633 /nfs/dbraw/zinc/27/66/33/942276633.db2.gz AWXWARPYVVERIM-UHFFFAOYSA-N 0 0 355.419 3.912 20 5 FHBDRN CC(C)N(CC(=O)Nc1ccc(F)cc1)Cc1csc([N+](=O)[O-])c1 ZINC000103491383 942276759 /nfs/dbraw/zinc/27/67/59/942276759.db2.gz FDAOYEPAPXJRLU-UHFFFAOYSA-N 0 0 351.403 3.645 20 5 FHBDRN O=[N+]([O-])c1cc(CN2CCC[C@H](CC(F)(F)F)C2)c2c(c1)COCO2 ZINC000420941510 942279357 /nfs/dbraw/zinc/27/93/57/942279357.db2.gz FSSISQUOFOYXHJ-LLVKDONJSA-N 0 0 360.332 3.626 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1c2ccccc2SC[C@H]1C ZINC000434108277 942282198 /nfs/dbraw/zinc/28/21/98/942282198.db2.gz FKKPSIAYAOPMIZ-GFCCVEGCSA-N 0 0 364.448 3.593 20 5 FHBDRN CC(C)(C)OC(=O)CC[C@@H]1CCCCN1C(=O)c1cccc([N+](=O)[O-])c1 ZINC000416033779 942282446 /nfs/dbraw/zinc/28/24/46/942282446.db2.gz MEIQPGPOZSMZTN-HNNXBMFYSA-N 0 0 362.426 3.711 20 5 FHBDRN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N(C)C[C@H]1CCCC[C@H]1O ZINC000183471262 942293550 /nfs/dbraw/zinc/29/35/50/942293550.db2.gz VUOYIVAYVKBUMM-CZUORRHYSA-N 0 0 366.483 3.718 20 5 FHBDRN CCn1cc([C@@H]2OCC[C@H]2CNc2ccc(Cl)cc2[N+](=O)[O-])cn1 ZINC000413511445 942299547 /nfs/dbraw/zinc/29/95/47/942299547.db2.gz JEGMSQKBPOAFMV-MEDUHNTESA-N 0 0 350.806 3.654 20 5 FHBDRN CCC(=O)c1ccc(N[C@H](C)c2noc(COC(C)C)n2)c([N+](=O)[O-])c1 ZINC000290608228 942302202 /nfs/dbraw/zinc/30/22/02/942302202.db2.gz COUWGJQKSFBEEL-LLVKDONJSA-N 0 0 362.386 3.669 20 5 FHBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1CSc1n[nH]c(-c2cccnc2)n1 ZINC000103719122 942303857 /nfs/dbraw/zinc/30/38/57/942303857.db2.gz CDZITGDSJFODGD-UHFFFAOYSA-N 0 0 371.422 3.854 20 5 FHBDRN Cc1ccc(NC(=O)[C@H](C)OC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)cc1F ZINC000015655145 942307254 /nfs/dbraw/zinc/30/72/54/942307254.db2.gz NKKRYDCLECMTTF-PPOCWRSBSA-N 0 0 372.352 3.626 20 5 FHBDRN Cc1nc([C@@H](NCc2ccc([N+](=O)[O-])cc2C)c2ccccc2F)no1 ZINC000183480497 942309222 /nfs/dbraw/zinc/30/92/22/942309222.db2.gz RJOYGRJJWIPMRE-KRWDZBQOSA-N 0 0 356.357 3.613 20 5 FHBDRN CCC[C@H](Cc1ccccc1)N(CCC)C(=O)c1c([N+](=O)[O-])cnn1C ZINC000501124928 942312820 /nfs/dbraw/zinc/31/28/20/942312820.db2.gz MPDXGNBQZJUUGB-MRXNPFEDSA-N 0 0 358.442 3.592 20 5 FHBDRN O=c1cc(CSCc2c(F)cc([N+](=O)[O-])cc2F)nc(C2CC2)[nH]1 ZINC000419581869 942314317 /nfs/dbraw/zinc/31/43/17/942314317.db2.gz DYPPMQYONOSFEN-UHFFFAOYSA-N 0 0 353.350 3.679 20 5 FHBDRN COc1ccc(/C=C\C(=O)OCc2ccc(Cl)c([N+](=O)[O-])c2)cc1O ZINC000783080087 942315330 /nfs/dbraw/zinc/31/53/30/942315330.db2.gz NAQMUEADUAXYFB-DAXSKMNVSA-N 0 0 363.753 3.719 20 5 FHBDRN O=C(N[C@H]1COCc2ccccc21)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000419561392 942315983 /nfs/dbraw/zinc/31/59/83/942315983.db2.gz SIIRAFQFXWBESV-SFHVURJKSA-N 0 0 367.405 3.540 20 5 FHBDRN O=C(N[C@@H]1COCc2ccccc21)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000419561390 942316154 /nfs/dbraw/zinc/31/61/54/942316154.db2.gz SIIRAFQFXWBESV-GOSISDBHSA-N 0 0 367.405 3.540 20 5 FHBDRN C[C@@H]1[C@H](C)CN(C(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])[C@H]1C ZINC000416070317 942316671 /nfs/dbraw/zinc/31/66/71/942316671.db2.gz KVHDDVZIUFJCIE-MXWKQRLJSA-N 0 0 360.332 3.652 20 5 FHBDRN O=C1NC(=O)/C(=C\c2ccc(-c3ccc([N+](=O)[O-])cc3)o2)c2ccccc21 ZINC000015662006 942317444 /nfs/dbraw/zinc/31/74/44/942317444.db2.gz CCWGXBVWOUSQPZ-BOPFTXTBSA-N 0 0 360.325 3.665 20 5 FHBDRN COC(=O)c1cnc(N2C[C@H](c3ccccc3)C3(CCC3)C2)c([N+](=O)[O-])c1 ZINC000413530337 942318844 /nfs/dbraw/zinc/31/88/44/942318844.db2.gz KHFIWHQRRDCRIU-MRXNPFEDSA-N 0 0 367.405 3.551 20 5 FHBDRN CSc1cccc(C(=O)NC[C@@H]2CCN(c3ccccc3)C2)c1[N+](=O)[O-] ZINC000188045496 942319299 /nfs/dbraw/zinc/31/92/99/942319299.db2.gz HKKPRJLEKNSZPS-AWEZNQCLSA-N 0 0 371.462 3.573 20 5 FHBDRN C[C@@H](NC(=O)N1CCC[C@H](Oc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000413134842 942336088 /nfs/dbraw/zinc/33/60/88/942336088.db2.gz DHTDQBLQAPSZPR-BEFAXECRSA-N 0 0 369.421 3.909 20 5 FHBDRN COC(=O)c1cnc(N[C@@H]2CC[C@H](c3ccccc3F)C2)c([N+](=O)[O-])c1 ZINC000481096570 942336218 /nfs/dbraw/zinc/33/62/18/942336218.db2.gz SJJHDAHSCGUUHR-WCQYABFASA-N 0 0 359.357 3.664 20 5 FHBDRN CCC(CC)[C@@H]1C[C@H](NC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)CCO1 ZINC000183224114 942336339 /nfs/dbraw/zinc/33/63/39/942336339.db2.gz UOFDYPBPNOCREF-ACJLOTCBSA-N 0 0 359.426 3.790 20 5 FHBDRN CCC(CC)[C@H]1C[C@H](NC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)CCO1 ZINC000183224134 942336499 /nfs/dbraw/zinc/33/64/99/942336499.db2.gz UOFDYPBPNOCREF-FZKQIMNGSA-N 0 0 359.426 3.790 20 5 FHBDRN C[C@@H](CNc1ccc(C(=O)c2nccn2C)cc1[N+](=O)[O-])CC(F)(F)F ZINC000413542389 942340519 /nfs/dbraw/zinc/34/05/19/942340519.db2.gz WYWVPKYLGPGUFD-SNVBAGLBSA-N 0 0 370.331 3.560 20 5 FHBDRN CC(C)NC(=O)[C@H]1CCC[C@@H](Nc2nccc3ccc([N+](=O)[O-])cc32)C1 ZINC000413149282 942343590 /nfs/dbraw/zinc/34/35/90/942343590.db2.gz ROXSCLPDWPKJQM-LSDHHAIUSA-N 0 0 356.426 3.638 20 5 FHBDRN COc1ccc(NC(=O)N2CCC[C@@H](CC(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000421099356 942346352 /nfs/dbraw/zinc/34/63/52/942346352.db2.gz YVXRCIIKIILHSX-JTQLQIEISA-N 0 0 361.320 3.800 20 5 FHBDRN Cn1ccnc1[C@H](NCCc1cccc(F)c1F)c1ccc([N+](=O)[O-])cc1 ZINC000513708739 942348196 /nfs/dbraw/zinc/34/81/96/942348196.db2.gz WQJQKFWFSYBAQL-GOSISDBHSA-N 0 0 372.375 3.528 20 5 FHBDRN Cc1nc([C@@H]2CCCOC2)sc1-c1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000366455475 942350083 /nfs/dbraw/zinc/35/00/83/942350083.db2.gz DSCXQGUXFOJNGI-GFCCVEGCSA-N 0 0 372.406 3.971 20 5 FHBDRN C[C@H](C(=O)N1CCC(OC2CCCC2)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000183518925 942354229 /nfs/dbraw/zinc/35/42/29/942354229.db2.gz NMRIYTYBAFMXQP-ZDUSSCGKSA-N 0 0 364.417 3.788 20 5 FHBDRN CC(C)Oc1cc(C(=O)NC[C@H]2CCCC(F)(F)C2)ccc1[N+](=O)[O-] ZINC000412321437 942354809 /nfs/dbraw/zinc/35/48/09/942354809.db2.gz PFHRBOOXKJLJBO-LBPRGKRZSA-N 0 0 356.369 3.937 20 5 FHBDRN O=[N+]([O-])c1ccc(NC[C@H](CO)c2ccc(F)cc2)cc1OC(F)F ZINC000413556559 942354847 /nfs/dbraw/zinc/35/48/47/942354847.db2.gz ZYZPTKBOMGQPQY-LLVKDONJSA-N 0 0 356.300 3.523 20 5 FHBDRN CO[C@@H]1CCCC[C@H]1C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000513741742 942354880 /nfs/dbraw/zinc/35/48/80/942354880.db2.gz PPHFRXLQQSKDEX-CHWSQXEVSA-N 0 0 357.204 3.501 20 5 FHBDRN CC(C)(C)c1ccc(NC(=O)N2CCC[C@@H](CCO)CC2)cc1[N+](=O)[O-] ZINC000421117887 942355256 /nfs/dbraw/zinc/35/52/56/942355256.db2.gz YCLCCZCHCKRZPI-CQSZACIVSA-N 0 0 363.458 3.909 20 5 FHBDRN Cc1ccccc1[C@@H]1CCCN1S(=O)(=O)CCc1ccc([N+](=O)[O-])cc1 ZINC000183521753 942356131 /nfs/dbraw/zinc/35/61/31/942356131.db2.gz DPVCGYFYCQDCEG-IBGZPJMESA-N 0 0 374.462 3.613 20 5 FHBDRN Cc1cc(F)cc([C@]2(F)CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)C2)c1 ZINC000501241496 942357425 /nfs/dbraw/zinc/35/74/25/942357425.db2.gz BSKIXWLKQYKSTL-SFHVURJKSA-N 0 0 364.323 3.892 20 5 FHBDRN COc1ccc([C@@H](C)Nc2ccncc2[N+](=O)[O-])cc1Br ZINC000066797034 942359969 /nfs/dbraw/zinc/35/99/69/942359969.db2.gz UCXDKMYQHKCHRB-SECBINFHSA-N 0 0 352.188 3.934 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)NCCc1ccc(F)cc1Cl ZINC000502338745 942368553 /nfs/dbraw/zinc/36/85/53/942368553.db2.gz DUIUAUMOWWRHFI-UHFFFAOYSA-N 0 0 367.764 3.760 20 5 FHBDRN CSc1ccc(C(=O)N2CCSC[C@H]2C2CCC2)cc1[N+](=O)[O-] ZINC000416117745 942370027 /nfs/dbraw/zinc/37/00/27/942370027.db2.gz UXPFWEBMEYGIKB-AWEZNQCLSA-N 0 0 352.481 3.674 20 5 FHBDRN CCc1n[nH]c(C(=O)N[C@H]2CCc3c2ccc(Cl)c3Cl)c1[N+](=O)[O-] ZINC000501264791 942370625 /nfs/dbraw/zinc/37/06/25/942370625.db2.gz RQTBIGPJWKDXAS-NSHDSACASA-N 0 0 369.208 3.604 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N(Cc2ccccc2)c2ccncc2)c1 ZINC000183237186 942379010 /nfs/dbraw/zinc/37/90/10/942379010.db2.gz JITLSNMNSDFDNY-UHFFFAOYSA-N 0 0 363.373 3.845 20 5 FHBDRN O=C(NC1CC1)c1ccc(N2CC[C@@H](c3ccccc3F)C2)c([N+](=O)[O-])c1 ZINC000501287363 942390741 /nfs/dbraw/zinc/39/07/41/942390741.db2.gz XLQRBVIPQUSTHN-CQSZACIVSA-N 0 0 369.396 3.620 20 5 FHBDRN O=C(N[C@H](C1CCCC1)C(F)(F)F)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000413594855 942391381 /nfs/dbraw/zinc/39/13/81/942391381.db2.gz NNLYYYUDQPXCAG-RRFJBIMHSA-N 0 0 356.344 3.936 20 5 FHBDRN CCCCCC(=O)Nc1ccc(C(=O)COc2cccnc2[N+](=O)[O-])cc1 ZINC000005971125 942400737 /nfs/dbraw/zinc/40/07/37/942400737.db2.gz MAHBFAQHJWUOCK-UHFFFAOYSA-N 0 0 371.393 3.770 20 5 FHBDRN CC[C@@H](NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)c1nc(C)cs1 ZINC000513744242 942409008 /nfs/dbraw/zinc/40/90/08/942409008.db2.gz IQXNVJIOZFMTDR-SNVBAGLBSA-N 0 0 371.365 3.842 20 5 FHBDRN CO[C@@H](CNc1ncc([N+](=O)[O-])cc1C(F)(F)F)c1ccc(F)cc1 ZINC000413181207 942410413 /nfs/dbraw/zinc/41/04/13/942410413.db2.gz ZVBCEJBJLIQCIM-ZDUSSCGKSA-N 0 0 359.279 3.947 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)NCc1ccc(C(F)(F)F)cc1 ZINC000016301780 942411025 /nfs/dbraw/zinc/41/10/25/942411025.db2.gz FLMKUNLIBWIRJQ-UHFFFAOYSA-N 0 0 354.284 3.552 20 5 FHBDRN O=C(CSc1ccccc1[N+](=O)[O-])Nc1ccc(OC(F)F)cc1 ZINC000015797521 942411875 /nfs/dbraw/zinc/41/18/75/942411875.db2.gz NOENORORULOADE-UHFFFAOYSA-N 0 0 354.334 3.927 20 5 FHBDRN Cc1cccc(C)c1NC(=O)[C@@H](C)OC(=O)c1cccc([N+](=O)[O-])c1C ZINC000015800749 942412032 /nfs/dbraw/zinc/41/20/32/942412032.db2.gz RJEUFJMORBAHAQ-CQSZACIVSA-N 0 0 356.378 3.704 20 5 FHBDRN C[C@@H](NC(=O)c1ccc(F)cc1[N+](=O)[O-])c1ccc(-n2cccn2)c(F)c1 ZINC000505244672 942414526 /nfs/dbraw/zinc/41/45/26/942414526.db2.gz LJPHTIRFAFQMIN-LLVKDONJSA-N 0 0 372.331 3.550 20 5 FHBDRN Cc1cc(NC(=O)CCO[C@H](C)CC(C)C)c2cc([N+](=O)[O-])ccc2n1 ZINC001268853952 942415025 /nfs/dbraw/zinc/41/50/25/942415025.db2.gz OYOKMCPQBJXJHZ-CQSZACIVSA-N 0 0 359.426 3.653 20 5 FHBDRN C[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2Br)C[C@@H](C)C1 ZINC000502395806 942421178 /nfs/dbraw/zinc/42/11/78/942421178.db2.gz YGPSFFDCLUDEFZ-MNOVXSKESA-N 0 0 355.232 3.866 20 5 FHBDRN C[C@H](NS(=O)(=O)Cc1ccc(C(F)F)cc1)c1ccccc1[N+](=O)[O-] ZINC000549403652 942431396 /nfs/dbraw/zinc/43/13/96/942431396.db2.gz DOAFIBIFKUCWHO-NSHDSACASA-N 0 0 370.377 3.713 20 5 FHBDRN CCO[C@@H](C(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1)c1ccccc1 ZINC000413621518 942431815 /nfs/dbraw/zinc/43/18/15/942431815.db2.gz CMYXIRBVMQHCSW-LJQANCHMSA-N 0 0 354.406 3.864 20 5 FHBDRN C[C@@H]1[C@H](Cc2ccccc2)CCN1C(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000472944511 942432714 /nfs/dbraw/zinc/43/27/14/942432714.db2.gz ADLGOUQLJHRPOX-QAPCUYQASA-N 0 0 353.422 3.758 20 5 FHBDRN O=C(N[C@@H]1CCC[C@H]1OC(F)F)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000501366672 942436858 /nfs/dbraw/zinc/43/68/58/942436858.db2.gz YOWVCMPFIPGXOQ-GHMZBOCLSA-N 0 0 368.258 3.504 20 5 FHBDRN CC[C@@H](C)N(CC(=O)OC(C)(C)C)C(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000505278305 942441850 /nfs/dbraw/zinc/44/18/50/942441850.db2.gz WDSCSOOKHVFSQW-LLVKDONJSA-N 0 0 370.833 3.831 20 5 FHBDRN O=C(NCCOc1ccccc1Cl)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000501389471 942444793 /nfs/dbraw/zinc/44/47/93/942444793.db2.gz UELNZWGAYXKWPI-UHFFFAOYSA-N 0 0 359.769 3.538 20 5 FHBDRN COc1cc(Cl)ccc1CNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000502436228 942452094 /nfs/dbraw/zinc/45/20/94/942452094.db2.gz PXXKTOXUJKVRFH-UHFFFAOYSA-N 0 0 373.796 3.528 20 5 FHBDRN CC(C)(C)OC(=O)C(C)(C)CCNC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000424945247 942457319 /nfs/dbraw/zinc/45/73/19/942457319.db2.gz YOOKEEIVSIQWDP-UHFFFAOYSA-N 0 0 370.833 3.736 20 5 FHBDRN CCS[C@H](C)c1noc(CN(C)c2nccc3ccc([N+](=O)[O-])cc32)n1 ZINC000413195886 942459685 /nfs/dbraw/zinc/45/96/85/942459685.db2.gz NMXZMBXGCYQYIZ-LLVKDONJSA-N 0 0 373.438 3.977 20 5 FHBDRN O=C(C1CCCCC1)N1CC[C@@H](Nc2ccc([N+](=O)[O-])c3ncccc23)C1 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20 5 FHBDRN Cc1cc(CCNC(=O)C(C)(C)c2ccccc2[N+](=O)[O-])cc(C)c1O ZINC000505387448 942518310 /nfs/dbraw/zinc/51/83/10/942518310.db2.gz GRULWACWFWPGJJ-UHFFFAOYSA-N 0 0 356.422 3.554 20 5 FHBDRN O=C(c1c[nH]c2cc([N+](=O)[O-])ccc12)N(Cc1ccco1)CC(F)(F)F ZINC000502544624 942523986 /nfs/dbraw/zinc/52/39/86/942523986.db2.gz FURDDAYOZZHELR-UHFFFAOYSA-N 0 0 367.283 3.874 20 5 FHBDRN C[C@@H](CNC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N(C)c1ccccc1 ZINC000501516147 942529352 /nfs/dbraw/zinc/52/93/52/942529352.db2.gz OVDLITBLCYGMJZ-LBPRGKRZSA-N 0 0 362.817 3.895 20 5 FHBDRN Cc1cccc(OCCCNC(=O)CSCc2ccc([N+](=O)[O-])cc2)c1 ZINC000513815687 942533428 /nfs/dbraw/zinc/53/34/28/942533428.db2.gz ZBVWUEYAUKBGAP-UHFFFAOYSA-N 0 0 374.462 3.722 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N[C@@H]2CCCC[C@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000434228872 942535538 /nfs/dbraw/zinc/53/55/38/942535538.db2.gz PRDFDAVRSYNQCZ-LSDHHAIUSA-N 0 0 356.426 3.898 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)[C@H]1CCc2ccccc2O1 ZINC000413234465 942537921 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20 5 FHBDRN O=C(c1cc(=O)[nH]c2ccc(F)cc21)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000513833043 942548048 /nfs/dbraw/zinc/54/80/48/942548048.db2.gz VBAGOQSNGNCBMI-UHFFFAOYSA-N 0 0 367.336 3.581 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N[C@@H]2C[C@H]2c2c(F)cccc2Cl)c1[N+](=O)[O-] ZINC000434252404 942549796 /nfs/dbraw/zinc/54/97/96/942549796.db2.gz ZVTOUAWRSOISEI-LDYMZIIASA-N 0 0 366.780 3.520 20 5 FHBDRN Cc1c2nc(NC(=O)c3n[nH]c(C(C)C)c3[N+](=O)[O-])sc2ccc1F ZINC000434251816 942550545 /nfs/dbraw/zinc/55/05/45/942550545.db2.gz XFTAOQOEXQNFSH-UHFFFAOYSA-N 0 0 363.374 3.751 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)Nc1cccc(NC(=O)C2CC2)c1 ZINC000421423695 942552327 /nfs/dbraw/zinc/55/23/27/942552327.db2.gz QETNPWOTMBEOIX-UHFFFAOYSA-N 0 0 353.378 3.812 20 5 FHBDRN CC(C)(NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)c1ccccc1F ZINC000452363605 942553229 /nfs/dbraw/zinc/55/32/29/942553229.db2.gz RZGZXENKKLUZEA-UHFFFAOYSA-N 0 0 358.369 3.748 20 5 FHBDRN COc1cc(Cl)c(-c2nc(-c3ccc([N+](=O)[O-])cc3)no2)cc1OC ZINC000513826635 942555753 /nfs/dbraw/zinc/55/57/53/942555753.db2.gz ZATCUJFEIRIZJO-UHFFFAOYSA-N 0 0 361.741 3.982 20 5 FHBDRN Cc1nc([C@@H]2CCCOC2)sc1-c1nc(-c2ccccc2[N+](=O)[O-])no1 ZINC000366545804 942557129 /nfs/dbraw/zinc/55/71/29/942557129.db2.gz RCJIKQOJNVGJAN-LLVKDONJSA-N 0 0 372.406 3.971 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC(OC2CCC2)CC1 ZINC000416257781 942564351 /nfs/dbraw/zinc/56/43/51/942564351.db2.gz KEZBCLQITFJAFA-MRXNPFEDSA-N 0 0 360.454 3.724 20 5 FHBDRN CC[C@@H]1C[C@]1(NC(=O)CCn1nc(C)c([N+](=O)[O-])c1C)c1cccc(C)c1 ZINC000501608021 942566434 /nfs/dbraw/zinc/56/64/34/942566434.db2.gz OFGVKNMVIQCXCQ-OXQOHEQNSA-N 0 0 370.453 3.548 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])C(=O)C1(c2c(F)cccc2F)CCC1 ZINC000421430541 942567636 /nfs/dbraw/zinc/56/76/36/942567636.db2.gz OIHQWIWTWRAGSR-UHFFFAOYSA-N 0 0 360.360 3.953 20 5 FHBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)NCc1cc(F)c(Cl)cc1F ZINC000434303273 942574758 /nfs/dbraw/zinc/57/47/58/942574758.db2.gz YEGPRFJEBICDBJ-UHFFFAOYSA-N 0 0 369.755 3.568 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)N1CC=C(c2ccccc2F)C1 ZINC000501615556 942576056 /nfs/dbraw/zinc/57/60/56/942576056.db2.gz QWSLIFRPVQFXRV-UHFFFAOYSA-N 0 0 358.394 3.752 20 5 FHBDRN C[C@@H]1COc2ccccc2CN1C(=O)CCc1ccc([N+](=O)[O-])cc1Cl ZINC001268949022 942579477 /nfs/dbraw/zinc/57/94/77/942579477.db2.gz WLGGHONFKTZIOJ-CYBMUJFWSA-N 0 0 374.824 3.991 20 5 FHBDRN O=C(Nc1cc(-c2ccco2)nn1-c1cccc([N+](=O)[O-])c1)[C@H]1CC12CC2 ZINC000421468134 942588208 /nfs/dbraw/zinc/58/82/08/942588208.db2.gz FXOFJKOYVWBPFA-CQSZACIVSA-N 0 0 364.361 3.779 20 5 FHBDRN CC[C@@H](NC(=O)N1CCOc2c(F)cccc2C1)c1cccc([N+](=O)[O-])c1 ZINC000434310277 942593076 /nfs/dbraw/zinc/59/30/76/942593076.db2.gz YBCBTQCYSXXXFE-QGZVFWFLSA-N 0 0 373.384 3.789 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)Nc1ccc(O[C@H]2CCOC2)cc1 ZINC000421476585 942593270 /nfs/dbraw/zinc/59/32/70/942593270.db2.gz NPLCHCHGUDEUIQ-INIZCTEOSA-N 0 0 356.378 3.632 20 5 FHBDRN Cn1cc(-c2cc(F)ccc2NC(=O)/C=C/c2ccccc2[N+](=O)[O-])cn1 ZINC000366565193 942593748 /nfs/dbraw/zinc/59/37/48/942593748.db2.gz VJUXWEMLJWUBQV-RMKNXTFCSA-N 0 0 366.352 3.786 20 5 FHBDRN C[C@@H]1CCCC[C@@H]1OCCNC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513719378 942595096 /nfs/dbraw/zinc/59/50/96/942595096.db2.gz BSGMIOVCNRKAEW-RISCZKNCSA-N 0 0 372.368 3.521 20 5 FHBDRN Cc1nc2cc(NC(=O)c3ccc(OC(F)F)c([N+](=O)[O-])c3)ccc2o1 ZINC000513749616 942599015 /nfs/dbraw/zinc/59/90/15/942599015.db2.gz UPIIIUYJLXUYMB-UHFFFAOYSA-N 0 0 363.276 3.898 20 5 FHBDRN CCOc1cc(C(=O)Nc2cccc(C(=O)CC)c2)c([N+](=O)[O-])cc1OC ZINC000434334358 942600994 /nfs/dbraw/zinc/60/09/94/942600994.db2.gz NUEKXYOVFAGBRD-UHFFFAOYSA-N 0 0 372.377 3.847 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NCCc1csc(C(C)(C)C)n1 ZINC000421493826 942606383 /nfs/dbraw/zinc/60/63/83/942606383.db2.gz DEMDXNWGQBQAGP-UHFFFAOYSA-N 0 0 361.467 3.938 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N[C@H](c1nc(C2CC2)no1)C(C)C ZINC000421480585 942613688 /nfs/dbraw/zinc/61/36/88/942613688.db2.gz ZSVYYBCLSGWMJN-HNNXBMFYSA-N 0 0 358.398 3.599 20 5 FHBDRN O=C(Nc1cccc2c1CN(c1nccs1)C2)c1ccc([N+](=O)[O-])cc1 ZINC000366971353 942615431 /nfs/dbraw/zinc/61/54/31/942615431.db2.gz WORISUTXUZIZEG-UHFFFAOYSA-N 0 0 366.402 3.824 20 5 FHBDRN CCN1C(=O)CCc2cc(NC(=O)c3cc([N+](=O)[O-])c(C)cc3C)ccc21 ZINC000421510866 942616951 /nfs/dbraw/zinc/61/69/51/942616951.db2.gz HTPVYQRKEZAJTH-UHFFFAOYSA-N 0 0 367.405 3.763 20 5 FHBDRN CO[C@H](c1ccccc1F)[C@H](C)NC(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC000421513412 942619608 /nfs/dbraw/zinc/61/96/08/942619608.db2.gz QADSCMCBWUOUJF-UGSOOPFHSA-N 0 0 360.385 3.857 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N(C)Cc1nc(C(F)(F)F)cs1 ZINC000421517911 942622937 /nfs/dbraw/zinc/62/29/37/942622937.db2.gz YDYBIWLJJOGXBQ-UHFFFAOYSA-N 0 0 373.356 3.959 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N(CCc1ccccc1)[C@H]1CCOC1 ZINC000421523446 942628304 /nfs/dbraw/zinc/62/83/04/942628304.db2.gz NUVUEWADSDAWTA-SFHVURJKSA-N 0 0 368.433 3.685 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N(C)Cc1cc(C)c(OC)c(C)c1 ZINC000513954722 942632139 /nfs/dbraw/zinc/63/21/39/942632139.db2.gz LKWMADOYKDXABG-UHFFFAOYSA-N 0 0 373.409 3.893 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N[C@H](C)[C@H](c1ccccc1)[NH+](C)C ZINC000421526898 942637719 /nfs/dbraw/zinc/63/77/19/942637719.db2.gz XPFLPZBVZDGTBJ-DNVCBOLYSA-N 0 0 355.438 3.633 20 5 FHBDRN COC(=O)[C@@H](C)c1cccc(NC(=O)c2cc([N+](=O)[O-])c(C)cc2C)c1 ZINC000421550882 942654311 /nfs/dbraw/zinc/65/43/11/942654311.db2.gz DJIQXQLXUFKCNE-ZDUSSCGKSA-N 0 0 356.378 3.740 20 5 FHBDRN CCc1ccc(C(=O)N2CCN[C@H](c3cccc(Cl)c3)C2)cc1[N+](=O)[O-] ZINC000513995691 942655910 /nfs/dbraw/zinc/65/59/10/942655910.db2.gz ZOJJEAQTOVDJGI-KRWDZBQOSA-N 0 0 373.840 3.597 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCCN3c4ccccc4C[C@@H]3C2)c2cccnc21 ZINC000413315121 942656908 /nfs/dbraw/zinc/65/69/08/942656908.db2.gz UTYOBRNRVPWPIQ-MRXNPFEDSA-N 0 0 360.417 3.784 20 5 FHBDRN CO[C@@H](CNc1ncc([N+](=O)[O-])cc1C(F)(F)F)Cc1ccccc1 ZINC000413320426 942658590 /nfs/dbraw/zinc/65/85/90/942658590.db2.gz DVYPLDNIFHKVRD-CYBMUJFWSA-N 0 0 355.316 3.678 20 5 FHBDRN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1Br)c1ccsc1 ZINC000159104219 942659269 /nfs/dbraw/zinc/65/92/69/942659269.db2.gz CLTWRAVSJHILKN-QMMMGPOBSA-N 0 0 355.213 3.910 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NCc1cccc(C(F)(F)F)n1 ZINC000421567116 942661477 /nfs/dbraw/zinc/66/14/77/942661477.db2.gz CAYZRJLVUHGTDG-UHFFFAOYSA-N 0 0 353.300 3.555 20 5 FHBDRN COc1cc(CN(C)CCC(F)(F)F)c([N+](=O)[O-])cc1OC(F)F ZINC000514009312 942668013 /nfs/dbraw/zinc/66/80/13/942668013.db2.gz COTNXCYEKQFFMF-UHFFFAOYSA-N 0 0 358.263 3.589 20 5 FHBDRN CNC(=O)c1cnc(/C=C\c2ccc(-c3ccc([N+](=O)[O-])cc3)o2)s1 ZINC000502713039 942677935 /nfs/dbraw/zinc/67/79/35/942677935.db2.gz URWMZJHACBTIHY-CLFYSBASSA-N 0 0 355.375 3.841 20 5 FHBDRN O=C(NC[C@H]1CC12CCSCC2)c1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC000421597350 942678523 /nfs/dbraw/zinc/67/85/23/942678523.db2.gz VAFPKRBWLWKDOF-LLVKDONJSA-N 0 0 374.384 3.877 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)CSc1nc2ccccc2[nH]1 ZINC000514004114 942679481 /nfs/dbraw/zinc/67/94/81/942679481.db2.gz BMRJRIKAQJZMNI-UHFFFAOYSA-N 0 0 356.407 3.819 20 5 FHBDRN CCc1ccc([C@H](C)NC(=O)[C@H](C)N(C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000501799423 942682549 /nfs/dbraw/zinc/68/25/49/942682549.db2.gz GLSSOHWMFHGFLO-HOTGVXAUSA-N 0 0 369.465 3.855 20 5 FHBDRN CCc1[nH]nc(-c2nc(-c3ccccc3OCC(C)C)no2)c1[N+](=O)[O-] ZINC000420484450 942688920 /nfs/dbraw/zinc/68/89/20/942688920.db2.gz SDLUBZCAWBRUDQ-UHFFFAOYSA-N 0 0 357.370 3.632 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)NCCC[C@@H]2CCCC[C@@H]2O)cc1[N+](=O)[O-] ZINC000434469976 942690675 /nfs/dbraw/zinc/69/06/75/942690675.db2.gz LTLKNLVFZUVBBX-KSSFIOAISA-N 0 0 362.470 3.953 20 5 FHBDRN O=C(/C=C/c1cccc([N+](=O)[O-])c1)N[C@H](c1ccccc1)[C@@H]1CCOC1 ZINC000378386788 942697497 /nfs/dbraw/zinc/69/74/97/942697497.db2.gz BQCMEYPRTDTVDA-DSHSFFHVSA-N 0 0 352.390 3.502 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CCC[C@@H](C[C@H]2CCOC2)C1 ZINC000378398027 942703674 /nfs/dbraw/zinc/70/36/74/942703674.db2.gz GPDOHNUYQLFIPR-QWHCGFSZSA-N 0 0 352.818 3.527 20 5 FHBDRN Cc1ncccc1Cc1noc(-c2ccc(NC3CC3)c([N+](=O)[O-])c2)n1 ZINC000420509177 942712157 /nfs/dbraw/zinc/71/21/57/942712157.db2.gz CGCRVKBLZIKOGD-UHFFFAOYSA-N 0 0 351.366 3.513 20 5 FHBDRN COCCC1(c2noc(Cc3ccc([N+](=O)[O-])cc3Cl)n2)CCC1 ZINC000420511734 942714643 /nfs/dbraw/zinc/71/46/43/942714643.db2.gz BCTBBKUVXFEZBY-UHFFFAOYSA-N 0 0 351.790 3.680 20 5 FHBDRN O=C(c1ccc(OC(F)F)c([N+](=O)[O-])c1)N1CC[C@@H](C2CCCC2)C1 ZINC000421647903 942720923 /nfs/dbraw/zinc/72/09/23/942720923.db2.gz XUVCAPFHXOMRSF-CYBMUJFWSA-N 0 0 354.353 3.849 20 5 FHBDRN CCOC(=O)c1ccc(F)c(C)c1NC(=O)c1cc(C)cc([N+](=O)[O-])c1 ZINC000505429234 942746816 /nfs/dbraw/zinc/74/68/16/942746816.db2.gz QOZLDTICMPENGU-UHFFFAOYSA-N 0 0 360.341 3.780 20 5 FHBDRN CCCNc1ccc(CNC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)cc1 ZINC000434553182 942752461 /nfs/dbraw/zinc/75/24/61/942752461.db2.gz FQERTBBWRSPFBZ-UHFFFAOYSA-N 0 0 366.421 3.688 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N(c1ccccc1)[C@H](C)c1ccccc1 ZINC000502781308 942754458 /nfs/dbraw/zinc/75/44/58/942754458.db2.gz PNMGTJXSPBHHMA-OAHLLOKOSA-N 0 0 364.405 3.894 20 5 FHBDRN Cc1oc(-c2cccs2)nc1Cn1cc(Br)c([N+](=O)[O-])n1 ZINC000502817777 942768562 /nfs/dbraw/zinc/76/85/62/942768562.db2.gz LUOKFLMSRGYXRI-UHFFFAOYSA-N 0 0 369.200 3.627 20 5 FHBDRN CN(CC(=O)N[C@H](CC(F)F)c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000421699214 942771376 /nfs/dbraw/zinc/77/13/76/942771376.db2.gz NCFWTOIODSEEOU-CQSZACIVSA-N 0 0 363.364 3.544 20 5 FHBDRN C[C@@H](NCc1nc(-c2cccc([N+](=O)[O-])c2)no1)c1ccc(F)cc1F ZINC000181585986 942775779 /nfs/dbraw/zinc/77/57/79/942775779.db2.gz NTEQLJYXKPQITR-SNVBAGLBSA-N 0 0 360.320 3.774 20 5 FHBDRN CCN(Cc1cccs1)C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514140076 942777183 /nfs/dbraw/zinc/77/71/83/942777183.db2.gz KUDYGHQTKJGMDM-UHFFFAOYSA-N 0 0 356.350 3.920 20 5 FHBDRN O=C(Nc1cccc2cccnc21)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514140831 942777640 /nfs/dbraw/zinc/77/76/40/942777640.db2.gz VFDUBMXDYPQTQQ-UHFFFAOYSA-N 0 0 359.288 3.997 20 5 FHBDRN Cc1cc(C(=O)N2CC[C@@H](O)[C@H]2c2ccc(Cl)cc2)cc([N+](=O)[O-])c1 ZINC000425103849 942784217 /nfs/dbraw/zinc/78/42/17/942784217.db2.gz CAOZUGKRLQUNBM-IAGOWNOFSA-N 0 0 360.797 3.505 20 5 FHBDRN O=C(Nc1ccc(F)c(F)c1F)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514150664 942785665 /nfs/dbraw/zinc/78/56/65/942785665.db2.gz DCOAWFOCWHEWJG-UHFFFAOYSA-N 0 0 362.210 3.866 20 5 FHBDRN CCO[C@@H](C)c1noc(CN(C)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])n1 ZINC000514183747 942792359 /nfs/dbraw/zinc/79/23/59/942792359.db2.gz XPPCEEBPXXTUGN-VIFPVBQESA-N 0 0 374.319 3.731 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N2CCC[C@@]2(C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000469177245 942793221 /nfs/dbraw/zinc/79/32/21/942793221.db2.gz XDNYXDXFUHYANU-IBGZPJMESA-N 0 0 356.426 3.679 20 5 FHBDRN CCC(CC)Nc1cc([N+](=O)[O-])c(OC)c(Br)c1[N+](=O)[O-] ZINC000014206446 942805029 /nfs/dbraw/zinc/80/50/29/942805029.db2.gz UZKPHRDJQYRZBY-UHFFFAOYSA-N 0 0 362.180 3.875 20 5 FHBDRN C[C@@H](C(=O)N(Cc1cc[nH]n1)Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000584566645 942805606 /nfs/dbraw/zinc/80/56/06/942805606.db2.gz SQYCPSONPCYFES-OAHLLOKOSA-N 0 0 364.405 3.650 20 5 FHBDRN CC(C)c1ccc(C(=O)N2C[C@@H](O)C[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000413936198 942805617 /nfs/dbraw/zinc/80/56/17/942805617.db2.gz HKEWJYJCCSPNJP-FUHWJXTLSA-N 0 0 354.406 3.666 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCC[C@@H]1CC(=O)c1ccco1 ZINC000421786332 942806116 /nfs/dbraw/zinc/80/61/16/942806116.db2.gz MRWWGHQMGAJCKC-CQSZACIVSA-N 0 0 356.378 3.682 20 5 FHBDRN CCOc1cccc([N+](=O)[O-])c1C(=O)NCc1cnccc1C(C)(C)C ZINC000413941789 942812261 /nfs/dbraw/zinc/81/22/61/942812261.db2.gz VMMDECXDAKUPKO-UHFFFAOYSA-N 0 0 357.410 3.616 20 5 FHBDRN CN(C)C(=O)[C@@H]1CCC[C@@H](Nc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000514187152 942812605 /nfs/dbraw/zinc/81/26/05/942812605.db2.gz OWGLGVLEYHVRPT-ZYHUDNBSSA-N 0 0 359.348 3.673 20 5 FHBDRN CCCc1[nH]nc(C(=O)Nc2ccc(Cl)c(SC)c2)c1[N+](=O)[O-] ZINC000413949041 942812986 /nfs/dbraw/zinc/81/29/86/942812986.db2.gz XFQAVAKLWFRKTC-UHFFFAOYSA-N 0 0 354.819 3.898 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1C[C@@H](C)O[C@H](c2ccc(F)cc2)C1 ZINC000421774163 942816491 /nfs/dbraw/zinc/81/64/91/942816491.db2.gz LBNGDYMWVXDXPW-KUHUBIRLSA-N 0 0 372.396 3.953 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1)N1CC2(CCOCC2)[C@@H]1c1ccccc1 ZINC000413955951 942819583 /nfs/dbraw/zinc/81/95/83/942819583.db2.gz NIKRWXLRYXHPKN-FQEVSTJZSA-N 0 0 366.417 3.518 20 5 FHBDRN O=[N+]([O-])c1cc(C(F)(F)F)ccc1NCc1ccc(OCCO)cc1 ZINC000514211780 942821253 /nfs/dbraw/zinc/82/12/53/942821253.db2.gz XTWMXTSLBLJPCS-UHFFFAOYSA-N 0 0 356.300 3.597 20 5 FHBDRN O=C(c1cc2cc([N+](=O)[O-])ccc2o1)N1CC2(CCC2)[C@@H]1C1CCOCC1 ZINC000425121092 942821677 /nfs/dbraw/zinc/82/16/77/942821677.db2.gz LQKDSKKIOAOJKF-SFHVURJKSA-N 0 0 370.405 3.762 20 5 FHBDRN Cc1nn(CC(=O)N2c3ccccc3CC[C@H]2C)c2ccc([N+](=O)[O-])cc12 ZINC000502896436 942823889 /nfs/dbraw/zinc/82/38/89/942823889.db2.gz OOWOOJUURSBDSM-CYBMUJFWSA-N 0 0 364.405 3.621 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)N(Cc1ccc([C@@H]2C[C@@H]2C)o1)C1CC1 ZINC000041894914 942824165 /nfs/dbraw/zinc/82/41/65/942824165.db2.gz DULHSWGNMOVYFT-MEDUHNTESA-N 0 0 355.394 3.819 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])N1CC[C@@H](C(F)(F)F)C2(CCC2)C1 ZINC000514215687 942824259 /nfs/dbraw/zinc/82/42/59/942824259.db2.gz VVILLOQSNURJRG-CQSZACIVSA-N 0 0 371.359 3.588 20 5 FHBDRN Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)N1CCOc2ccc(F)cc2C1 ZINC000367079613 942826959 /nfs/dbraw/zinc/82/69/59/942826959.db2.gz VYSNTUAJLAGYSJ-UHFFFAOYSA-N 0 0 363.320 3.608 20 5 FHBDRN Cc1cc(C(=O)Nc2c([N+](=O)[O-])cnn2C)sc1-c1ccc(F)cc1 ZINC001269828476 942827635 /nfs/dbraw/zinc/82/76/35/942827635.db2.gz QMBOYWZIDHTDSY-UHFFFAOYSA-N 0 0 360.370 3.757 20 5 FHBDRN CCCNc1ccccc1NC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000190131224 942828433 /nfs/dbraw/zinc/82/84/33/942828433.db2.gz SKAWGQSMKAXZCU-UHFFFAOYSA-N 0 0 365.393 3.855 20 5 FHBDRN COc1cccc(-c2noc(CN[C@H](C)c3cccc([N+](=O)[O-])c3)n2)c1 ZINC000378510736 942845245 /nfs/dbraw/zinc/84/52/45/942845245.db2.gz IQIRAKKJQSZREW-GFCCVEGCSA-N 0 0 354.366 3.504 20 5 FHBDRN CC(C)c1ccc(CNc2cc(-c3nncn3C)ccn2)cc1[N+](=O)[O-] ZINC000367103612 942848416 /nfs/dbraw/zinc/84/84/16/942848416.db2.gz PMRXZYFBPHVEAQ-UHFFFAOYSA-N 0 0 352.398 3.521 20 5 FHBDRN Cc1ccc(CC[C@H](C)NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)o1 ZINC000514220314 942848482 /nfs/dbraw/zinc/84/84/82/942848482.db2.gz ZIZQYZRWPWBIRW-JTQLQIEISA-N 0 0 368.336 3.849 20 5 FHBDRN CC(C)c1ccc(C(=O)N2CCC[C@@H](Cc3nccn3C)C2)cc1[N+](=O)[O-] ZINC000190172883 942849221 /nfs/dbraw/zinc/84/92/21/942849221.db2.gz QFORFBVGZLTILP-HNNXBMFYSA-N 0 0 370.453 3.547 20 5 FHBDRN CC(C)[C@@H]1N(C(=O)C(C)(C)c2ccccc2[N+](=O)[O-])CC12CCOCC2 ZINC000413972948 942856527 /nfs/dbraw/zinc/85/65/27/942856527.db2.gz JIXZADVMGAADHP-KRWDZBQOSA-N 0 0 360.454 3.536 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)Nc1cccc([C@H]2CCC(=O)N2)c1 ZINC000413981108 942859912 /nfs/dbraw/zinc/85/99/12/942859912.db2.gz YUJBSCDBUOPASV-MRXNPFEDSA-N 0 0 367.405 3.723 20 5 FHBDRN O=[N+]([O-])c1cc(F)ccc1-c1nc(-c2ccc(Br)o2)no1 ZINC000161944873 942866888 /nfs/dbraw/zinc/86/68/88/942866888.db2.gz NKHJYJCDCMTCAU-UHFFFAOYSA-N 0 0 354.091 3.806 20 5 FHBDRN CC(C)Oc1cc(C(=O)NC[C@H]2CCCCC2(F)F)ccc1[N+](=O)[O-] ZINC000412379297 942866912 /nfs/dbraw/zinc/86/69/12/942866912.db2.gz WAYYNDKKYGAVGG-CYBMUJFWSA-N 0 0 356.369 3.937 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CCC[C@@H]2C(C)(C)C)cc1OC ZINC000413983053 942867418 /nfs/dbraw/zinc/86/74/18/942867418.db2.gz GNSCZSTWRSBVSA-UONOGXRCSA-N 0 0 364.442 3.947 20 5 FHBDRN CC(C)[C@H](NC(=O)c1cc(Br)cc([N+](=O)[O-])c1)C(F)(F)F ZINC000413995929 942875029 /nfs/dbraw/zinc/87/50/29/942875029.db2.gz KQCHBTWUJRALBJ-JTQLQIEISA-N 0 0 369.137 3.674 20 5 FHBDRN CC(C)(C)[C@@H]1CCC[C@@H]1NC(=O)c1cc([N+](=O)[O-])ccc1SCCO ZINC000413997611 942876201 /nfs/dbraw/zinc/87/62/01/942876201.db2.gz WFEFLVBOVGQESN-CABCVRRESA-N 0 0 366.483 3.624 20 5 FHBDRN CCO[C@@H]1C[C@@H](N(C)C(=O)c2ccc([N+](=O)[O-])c(OC)c2)C1(CC)CC ZINC000434184154 942898560 /nfs/dbraw/zinc/89/85/60/942898560.db2.gz REJSHVYERHAEGL-IAGOWNOFSA-N 0 0 364.442 3.659 20 5 FHBDRN CCNc1ccc(C(=O)N2CCCc3cc(F)c(F)cc32)cc1[N+](=O)[O-] ZINC000514323898 942899099 /nfs/dbraw/zinc/89/90/99/942899099.db2.gz SQTSNVWUNFMSPQ-UHFFFAOYSA-N 0 0 361.348 3.898 20 5 FHBDRN Cc1nc(-c2ccccc2)sc1CNc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000066819123 942911050 /nfs/dbraw/zinc/91/10/50/942911050.db2.gz UPECPLOHWUGOQL-UHFFFAOYSA-N 0 0 368.418 3.738 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc2c(c1)C(=O)NC2 ZINC000503018671 942911523 /nfs/dbraw/zinc/91/15/23/942911523.db2.gz NBCRLJKLRCTKDS-UHFFFAOYSA-N 0 0 371.418 3.593 20 5 FHBDRN O=C(N[C@@H](C[C@H]1CCOC1)c1ccccc1)c1cc(F)cc([N+](=O)[O-])c1 ZINC000510009221 942923030 /nfs/dbraw/zinc/92/30/30/942923030.db2.gz FYDLVRNKZWFCDJ-ACJLOTCBSA-N 0 0 358.369 3.632 20 5 FHBDRN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@H](CO)C[C@H](C)C1 ZINC000421990896 942926923 /nfs/dbraw/zinc/92/69/23/942926923.db2.gz WBUQHJKORCLNAM-UONOGXRCSA-N 0 0 366.483 3.578 20 5 FHBDRN Cc1cc(NCc2ccc(O)c(F)c2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000078020023 942940746 /nfs/dbraw/zinc/94/07/46/942940746.db2.gz GBVVKCUKAJJYDO-UHFFFAOYSA-N 0 0 354.341 3.817 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N[C@@H]2CCC[C@H]2C(C)(C)C)c1F ZINC000412825935 942948611 /nfs/dbraw/zinc/94/86/11/942948611.db2.gz PZTLVEBRWLZXQI-CHWSQXEVSA-N 0 0 352.406 3.616 20 5 FHBDRN CCOc1ccc(N(CC)C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)cc1 ZINC000505516230 942953950 /nfs/dbraw/zinc/95/39/50/942953950.db2.gz QINHGSAWZFIOHS-UHFFFAOYSA-N 0 0 354.366 3.537 20 5 FHBDRN Cc1c(N[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)cnn1-c1ccccc1 ZINC000126444355 942955189 /nfs/dbraw/zinc/95/51/89/942955189.db2.gz ZODUJZBYXQSNPT-ZDUSSCGKSA-N 0 0 365.393 3.528 20 5 FHBDRN O=C(c1ccccc1Sc1ccccc1[N+](=O)[O-])N1CC[C@@]12CCOC2 ZINC000422076504 942972680 /nfs/dbraw/zinc/97/26/80/942972680.db2.gz SZOSAYYIGPWKDP-IBGZPJMESA-N 0 0 370.430 3.751 20 5 FHBDRN COc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2OC)c(C(F)(F)F)c1 ZINC000503104045 942975119 /nfs/dbraw/zinc/97/51/19/942975119.db2.gz CVJOWMYFJKOUFJ-UHFFFAOYSA-N 0 0 370.283 3.883 20 5 FHBDRN O=c1c(Cl)cc(C(F)(F)F)cn1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000434808707 942978923 /nfs/dbraw/zinc/97/89/23/942978923.db2.gz KVDXRUXSQIHBSY-UHFFFAOYSA-N 0 0 373.674 3.618 20 5 FHBDRN C[C@H](Nc1ccc2c(c1)C(=O)CCCC2)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000422086832 942992924 /nfs/dbraw/zinc/99/29/24/942992924.db2.gz PLENATNVVPEMMN-ZDUSSCGKSA-N 0 0 367.405 3.943 20 5 FHBDRN O=C(N[C@@H]1CC[C@@H]2CCCC[C@H]2C1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000514431042 943000658 /nfs/dbraw/zinc/00/06/58/943000658.db2.gz BOAFJUWZDAUAAJ-YQQAZPJKSA-N 0 0 368.437 3.869 20 5 FHBDRN COC(=O)c1c(C)cccc1NC(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000514432171 943001055 /nfs/dbraw/zinc/00/10/55/943001055.db2.gz WZZLAUQFRBTMGH-UHFFFAOYSA-N 0 0 354.318 3.688 20 5 FHBDRN O=C(Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1)[C@@H]1[C@H]2CCCO[C@H]21 ZINC000503135951 943003688 /nfs/dbraw/zinc/00/36/88/943003688.db2.gz ZVKYVJZAXLVHQR-KZNAEPCWSA-N 0 0 354.362 3.751 20 5 FHBDRN Cc1cnc([C@@H]2CCCCN2C(=O)CNc2ccccc2[N+](=O)[O-])s1 ZINC000367122848 943007380 /nfs/dbraw/zinc/00/73/80/943007380.db2.gz HYOOGWKJWCDTLL-HNNXBMFYSA-N 0 0 360.439 3.525 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)c1ccc(N(C)C)cc1F ZINC000505548779 943008362 /nfs/dbraw/zinc/00/83/62/943008362.db2.gz FQBIWTHLJUZIKV-UHFFFAOYSA-N 0 0 359.401 3.851 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)N2CCCC[C@H]2c2ncc[nH]2)cc1[N+](=O)[O-] ZINC000120255823 943015818 /nfs/dbraw/zinc/01/58/18/943015818.db2.gz GSIOKTCVFPVWRM-HNNXBMFYSA-N 0 0 356.426 3.983 20 5 FHBDRN COc1cc(NC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)c(C)cc1C ZINC000434892088 943022264 /nfs/dbraw/zinc/02/22/64/943022264.db2.gz NWSZSILJEOGZRN-UHFFFAOYSA-N 0 0 355.394 3.810 20 5 FHBDRN CCOc1ccccc1CN(C)C(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000122967227 943023512 /nfs/dbraw/zinc/02/35/12/943023512.db2.gz ZQPXTPLZMCMTGN-UHFFFAOYSA-N 0 0 359.382 3.666 20 5 FHBDRN O=[N+]([O-])c1ccc(Sc2n[nH]c(CCC3CCCC3)n2)c([N+](=O)[O-])c1 ZINC000014321182 943024227 /nfs/dbraw/zinc/02/42/27/943024227.db2.gz BWWOBDATUJOVBW-UHFFFAOYSA-N 0 0 363.399 3.895 20 5 FHBDRN C[C@@H]1c2c(Cl)cc(Cl)cc2CCN1CCn1cc([N+](=O)[O-])cn1 ZINC000434894269 943024922 /nfs/dbraw/zinc/02/49/22/943024922.db2.gz FCDZXRPQLRSEKD-SNVBAGLBSA-N 0 0 355.225 3.717 20 5 FHBDRN CCN(C)C(=O)CNc1cc([N+](=O)[O-])ccc1Sc1cccs1 ZINC000434880310 943026836 /nfs/dbraw/zinc/02/68/36/943026836.db2.gz MRXUMIXZSJSDFU-UHFFFAOYSA-N 0 0 351.453 3.698 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)N[C@@H]2COCc3ccccc32)cc1[N+](=O)[O-] ZINC000416683987 943039353 /nfs/dbraw/zinc/03/93/53/943039353.db2.gz KYGZVMTVKNRKIZ-CXAGYDPISA-N 0 0 355.394 3.535 20 5 FHBDRN Cc1ccccc1C1=CCN(C(=O)c2cc([N+](=O)[O-])c(N(C)C)cc2F)C1 ZINC000828030176 943046388 /nfs/dbraw/zinc/04/63/88/943046388.db2.gz BIUOXJRZUXXRTL-UHFFFAOYSA-N 0 0 369.396 3.648 20 5 FHBDRN Cc1cc(OCC(=O)N2CC(c3cccc(Cl)c3)C2)ccc1[N+](=O)[O-] ZINC000412391614 943046771 /nfs/dbraw/zinc/04/67/71/943046771.db2.gz YRTVMBZSWWBGOQ-UHFFFAOYSA-N 0 0 360.797 3.561 20 5 FHBDRN O=C(Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1)Nc1ccc2c(c1)CCC2 ZINC000505571443 943050323 /nfs/dbraw/zinc/05/03/23/943050323.db2.gz ZQVIDXGPCROLSA-UHFFFAOYSA-N 0 0 362.389 3.586 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC[C@H](Oc2ccccc2)C1 ZINC000416715891 943053396 /nfs/dbraw/zinc/05/33/96/943053396.db2.gz ADNGPGNKLOGQEE-INIZCTEOSA-N 0 0 371.393 3.679 20 5 FHBDRN O=C(Nc1cccc2cccnc21)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000514512403 943064435 /nfs/dbraw/zinc/06/44/35/943064435.db2.gz PLELFGAVTXQWHS-UHFFFAOYSA-N 0 0 359.345 3.581 20 5 FHBDRN Cn1ccnc1[C@@H](Nc1ncc(Cl)cc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000434957535 943072239 /nfs/dbraw/zinc/07/22/39/943072239.db2.gz FUAHJDSZWLUMCT-AWEZNQCLSA-N 0 0 361.764 3.717 20 5 FHBDRN O=C(c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])N1CC2(C1)CCCCC2 ZINC000503229505 943073166 /nfs/dbraw/zinc/07/31/66/943073166.db2.gz HEIRYVPVWRRLLR-UHFFFAOYSA-N 0 0 372.343 3.942 20 5 FHBDRN C[C@H](CCCc1cccnc1)NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412413908 943074029 /nfs/dbraw/zinc/07/40/29/943074029.db2.gz GUOYLSIZHRONRD-MDASCCDHSA-N 0 0 353.422 3.621 20 5 FHBDRN Cc1ccc(NC(=O)N([C@@H](C)C(=O)OC(C)(C)C)C2CC2)cc1[N+](=O)[O-] ZINC000416742335 943077591 /nfs/dbraw/zinc/07/75/91/943077591.db2.gz ZNWMJODXQZCLBS-LBPRGKRZSA-N 0 0 363.414 3.630 20 5 FHBDRN Cc1nc(C(C)(C)NC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)sc1C ZINC000412412943 943079111 /nfs/dbraw/zinc/07/91/11/943079111.db2.gz DTCSLBPIRKBHCC-LSDHHAIUSA-N 0 0 359.451 3.823 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)Nc1ccnn1-c1cccc(F)c1 ZINC000183893500 943079396 /nfs/dbraw/zinc/07/93/96/943079396.db2.gz RENLLODXDNVCNX-UHFFFAOYSA-N 0 0 372.381 3.650 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)NC(C)(C)c1nc2ccccc2n1C ZINC000183893922 943083273 /nfs/dbraw/zinc/08/32/73/943083273.db2.gz HIBBZPUHVUDKKC-UHFFFAOYSA-N 0 0 367.409 3.847 20 5 FHBDRN Cc1nn(CCC(=O)N[C@@H]2c3ccccc3CCC[C@H]2C)c(C)c1[N+](=O)[O-] ZINC000183908604 943085885 /nfs/dbraw/zinc/08/58/85/943085885.db2.gz VKUGQNLRROMJLT-YJYMSZOUSA-N 0 0 370.453 3.628 20 5 FHBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ncsc1C1CC1 ZINC000893272237 943088128 /nfs/dbraw/zinc/08/81/28/943088128.db2.gz KNGIZVHOKFNEGI-MRVPVSSYSA-N 0 0 367.814 3.988 20 5 FHBDRN Cc1cc(Nc2ccc(C(N)=O)cc2[N+](=O)[O-])cnc1N1CCCC[C@@H]1C ZINC000503279140 943096898 /nfs/dbraw/zinc/09/68/98/943096898.db2.gz HKCXSJKSONMZHR-ZDUSSCGKSA-N 0 0 369.425 3.520 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(CC(=O)N2CC3(CCCC3)[C@H]2C(C)C)c1F ZINC000412417741 943099365 /nfs/dbraw/zinc/09/93/65/943099365.db2.gz ZNLZYCSJHBOQQY-GOSISDBHSA-N 0 0 364.417 3.712 20 5 FHBDRN C[C@H](C[N@H+](C)Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)C(=O)[O-] ZINC000414652224 943103491 /nfs/dbraw/zinc/10/34/91/943103491.db2.gz GQPMFXYICHOTQT-GFCCVEGCSA-N 0 0 362.357 3.679 20 5 FHBDRN C/C(=C\c1cccc([N+](=O)[O-])c1)CNCc1noc(-c2ccccc2F)n1 ZINC000435030294 943113022 /nfs/dbraw/zinc/11/30/22/943113022.db2.gz QGHDQODPNBVIFM-UKTHLTGXSA-N 0 0 368.368 3.977 20 5 FHBDRN CC1=NN(c2ccc(C(=O)NCc3ccc([N+](=O)[O-])cc3Cl)cc2)CC1 ZINC000183761057 943128645 /nfs/dbraw/zinc/12/86/45/943128645.db2.gz XUMCCZPWUJHQOG-UHFFFAOYSA-N 0 0 372.812 3.764 20 5 FHBDRN Cc1[nH]n(C)c2nnc(NC(=O)c3cc4ccccc4c4cccnc34)c1-2 ZINC000503328063 943128887 /nfs/dbraw/zinc/12/88/87/943128887.db2.gz HQLSGWXXEAEZQG-UHFFFAOYSA-N 0 0 356.389 3.559 20 5 FHBDRN COc1cc(C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)cc(C)n1 ZINC000503346824 943132229 /nfs/dbraw/zinc/13/22/29/943132229.db2.gz QFBKAYXOEOSJAB-UHFFFAOYSA-N 0 0 370.390 3.683 20 5 FHBDRN O=C(CCOc1ccccc1[N+](=O)[O-])NCCCc1ccc(Cl)cc1 ZINC000503360917 943147583 /nfs/dbraw/zinc/14/75/83/943147583.db2.gz KORCMDOMMPLASK-UHFFFAOYSA-N 0 0 362.813 3.766 20 5 FHBDRN CC1(C)C[C@H](c2ccccc2)N(c2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])C1 ZINC000425276050 943151045 /nfs/dbraw/zinc/15/10/45/943151045.db2.gz CIJGYXOZJPBXDS-GOSISDBHSA-N 0 0 374.462 3.976 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)Cc1ccncc1 ZINC000503388072 943153004 /nfs/dbraw/zinc/15/30/04/943153004.db2.gz IXARKBGOXPEWIN-CYBMUJFWSA-N 0 0 359.451 3.853 20 5 FHBDRN CSCC1(Cc2noc(CCc3cc(F)ccc3[N+](=O)[O-])n2)CC1 ZINC000924119988 943194787 /nfs/dbraw/zinc/19/47/87/943194787.db2.gz WGHVUXSIUOXPGJ-UHFFFAOYSA-N 0 0 351.403 3.588 20 5 FHBDRN Cc1ccc(NC(=O)[C@@H](C)OC(=O)c2ccc(C)c([N+](=O)[O-])c2)c(C)c1 ZINC000016862095 943197954 /nfs/dbraw/zinc/19/79/54/943197954.db2.gz RMOAWWSQWFRVAS-CQSZACIVSA-N 0 0 356.378 3.704 20 5 FHBDRN O=[N+]([O-])c1ccc(-c2cnn(Cc3cc(Cl)c4c(c3)OCCO4)c2)cc1 ZINC000505617533 943199795 /nfs/dbraw/zinc/19/97/95/943199795.db2.gz ZMDOBRLIVNRUFI-UHFFFAOYSA-N 0 0 371.780 3.931 20 5 FHBDRN O=[N+]([O-])c1ccc(CCS(=O)(=O)N2CCC3(CCCCC3)CC2)cc1 ZINC000503492413 943207499 /nfs/dbraw/zinc/20/74/99/943207499.db2.gz UPRYDBSISCKHDC-UHFFFAOYSA-N 0 0 366.483 3.513 20 5 FHBDRN O=C(NCCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])NC1CCCCC1 ZINC000503484960 943215050 /nfs/dbraw/zinc/21/50/50/943215050.db2.gz CEDJRYGQUXTEPV-UHFFFAOYSA-N 0 0 374.363 3.657 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)NCc1ccc2ncccc2c1 ZINC000503488800 943216411 /nfs/dbraw/zinc/21/64/11/943216411.db2.gz PBTZLADPTXJNCM-UHFFFAOYSA-N 0 0 364.405 3.527 20 5 FHBDRN Cc1c(NC(=O)N2CC[C@]3(C2)OCc2ccccc23)cccc1[N+](=O)[O-] ZINC000183940553 943217270 /nfs/dbraw/zinc/21/72/70/943217270.db2.gz VVFWJZVSFNYCPN-LJQANCHMSA-N 0 0 353.378 3.567 20 5 FHBDRN Cc1nn(C(C)(C)C)cc1[C@H](C)NCc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000274305138 943220833 /nfs/dbraw/zinc/22/08/33/943220833.db2.gz PBEGOISWCPXXTR-LBPRGKRZSA-N 0 0 374.441 3.572 20 5 FHBDRN O=C(c1c(Cl)cccc1[N+](=O)[O-])N1CC[C@@H](COc2ccccc2)C1 ZINC000505627447 943247645 /nfs/dbraw/zinc/24/76/45/943247645.db2.gz ASILYLTYEZXQPE-CYBMUJFWSA-N 0 0 360.797 3.789 20 5 FHBDRN O=C(N[C@@H]1CCC[C@H](c2nc3ccccc3[nH]2)C1)c1ccc([N+](=O)[O-])o1 ZINC000514728434 943256774 /nfs/dbraw/zinc/25/67/74/943256774.db2.gz VELDNIINOKAQJW-NWDGAFQWSA-N 0 0 354.366 3.520 20 5 FHBDRN CC(C)Oc1cc(CN(C(=O)c2cc(F)cc([N+](=O)[O-])c2)C2CC2)ccn1 ZINC000503571500 943267796 /nfs/dbraw/zinc/26/77/96/943267796.db2.gz PDFWGYFEVHQMKP-UHFFFAOYSA-N 0 0 373.384 3.721 20 5 FHBDRN O=C(Nc1cc(F)c(F)cc1Br)c1ccc([N+](=O)[O-])cc1 ZINC000435251662 943281227 /nfs/dbraw/zinc/28/12/27/943281227.db2.gz HZJPVVRUEYEVBT-UHFFFAOYSA-N 0 0 357.110 3.888 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CCC[C@@H](Oc2ccccc2)C1 ZINC000416998589 943288976 /nfs/dbraw/zinc/28/89/76/943288976.db2.gz PRJZEARWHKXQTB-QGZVFWFLSA-N 0 0 355.394 3.979 20 5 FHBDRN COc1ccc(CN(C)C(=O)Nc2ccc([N+](=O)[O-])cc2OC)cc1C ZINC000122986921 943303431 /nfs/dbraw/zinc/30/34/31/943303431.db2.gz ULNLWHFDIIWUGV-UHFFFAOYSA-N 0 0 359.382 3.584 20 5 FHBDRN COC(=O)c1ccc(OCc2ccc([N+](=O)[O-])cc2Cl)cc1OC ZINC000514820074 943311333 /nfs/dbraw/zinc/31/13/33/943311333.db2.gz MHBZNDBWHPWRFM-UHFFFAOYSA-N 0 0 351.742 3.622 20 5 FHBDRN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N1C[C@H](O)C[C@@H]1c1ccccc1 ZINC000417045426 943315455 /nfs/dbraw/zinc/31/54/55/943315455.db2.gz RFVOPFRAVRIKMO-CRAIPNDOSA-N 0 0 355.394 3.551 20 5 FHBDRN Cc1c(NC(=O)N2C[C@H](C)[C@@H](C)C2)cc(Br)cc1[N+](=O)[O-] ZINC000435323764 943323194 /nfs/dbraw/zinc/32/31/94/943323194.db2.gz PBKDUJMLUJXBRF-IUCAKERBSA-N 0 0 356.220 3.785 20 5 FHBDRN Cc1c(NC(=O)NC[C@@H]2CC23CC3)cc(Br)cc1[N+](=O)[O-] ZINC000417068503 943325014 /nfs/dbraw/zinc/32/50/14/943325014.db2.gz DVUOSHFHVZVFND-VIFPVBQESA-N 0 0 354.204 3.587 20 5 FHBDRN CC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1Br)c1nccs1 ZINC000159119553 943330737 /nfs/dbraw/zinc/33/07/37/943330737.db2.gz WQUOPXFPELQYDD-VIFPVBQESA-N 0 0 370.228 3.695 20 5 FHBDRN Cc1c(NC(=O)NC[C@@H]2CCSC2)cc(Br)cc1[N+](=O)[O-] ZINC000435328230 943332736 /nfs/dbraw/zinc/33/27/36/943332736.db2.gz KJMGORJHWPIIKZ-VIFPVBQESA-N 0 0 374.260 3.540 20 5 FHBDRN Cc1c(NC(=O)N(C)CCC2CC2)cc(Br)cc1[N+](=O)[O-] ZINC000435329359 943333155 /nfs/dbraw/zinc/33/31/55/943333155.db2.gz OYRGYFZETCQAAZ-UHFFFAOYSA-N 0 0 356.220 3.930 20 5 FHBDRN CC[C@H]1CCN(C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2C)C1 ZINC000435330693 943333786 /nfs/dbraw/zinc/33/37/86/943333786.db2.gz VLXLTMCIBBDNFI-JTQLQIEISA-N 0 0 356.220 3.930 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1Cc2ccc(C(C)=O)cc2C1 ZINC000417072400 943333901 /nfs/dbraw/zinc/33/39/01/943333901.db2.gz IJXSLQMIJFSPOM-UHFFFAOYSA-N 0 0 369.377 3.744 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CCSC2(CCC2)CC1 ZINC000417081985 943337579 /nfs/dbraw/zinc/33/75/79/943337579.db2.gz XGMITWHWXPJKLU-UHFFFAOYSA-N 0 0 365.455 3.887 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1NC(=O)NCc1nc2ccccc2s1 ZINC000503716245 943343606 /nfs/dbraw/zinc/34/36/06/943343606.db2.gz KJEBVFTWKAPTEH-UHFFFAOYSA-N 0 0 358.379 3.535 20 5 FHBDRN O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CCC[C@H](n3ccnn3)C2)s1 ZINC000425355113 943361335 /nfs/dbraw/zinc/36/13/35/943361335.db2.gz UGYFXBCZEVQPTQ-AWEZNQCLSA-N 0 0 369.450 3.752 20 5 FHBDRN CC[C@@H](NC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-])C1CCOCC1 ZINC000543120869 943361770 /nfs/dbraw/zinc/36/17/70/943361770.db2.gz WMBLRGBCTCPERD-CYBMUJFWSA-N 0 0 372.874 3.662 20 5 FHBDRN CC[C@@H]1CN(C(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)C[C@H](C)[NH2+]1 ZINC001167958811 943362158 /nfs/dbraw/zinc/36/21/58/943362158.db2.gz HNGQWTOEWKDQKJ-GOEBONIOSA-N 0 0 368.437 3.551 20 5 FHBDRN O=C(/C=C/c1ccc(Cl)s1)NCCNc1ccc([N+](=O)[O-])cc1 ZINC000014529094 943372313 /nfs/dbraw/zinc/37/23/13/943372313.db2.gz WTFNDPHBDNUXOX-SOFGYWHQSA-N 0 0 351.815 3.551 20 5 FHBDRN CCc1cccc2c1OCC[C@H]2NC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000514905827 943374937 /nfs/dbraw/zinc/37/49/37/943374937.db2.gz CEFYZFBLEHWIFA-SCLBCKFNSA-N 0 0 354.406 3.901 20 5 FHBDRN CN(C(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)c1ccc2cc[nH]c2c1 ZINC000473555556 943378133 /nfs/dbraw/zinc/37/81/33/943378133.db2.gz SUILBRGTQFFMGQ-UHFFFAOYSA-N 0 0 361.361 3.538 20 5 FHBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)N2CCC[C@@H]2/C=C\c2ccccc2)cc1 ZINC000503835627 943380258 /nfs/dbraw/zinc/38/02/58/943380258.db2.gz ZDMQDCCHXNGODD-IBWPDUFMSA-N 0 0 372.446 3.602 20 5 FHBDRN O=C(Cn1ccc2ccc(Cl)cc21)NCCc1ccc([N+](=O)[O-])cc1 ZINC000053219256 943381940 /nfs/dbraw/zinc/38/19/40/943381940.db2.gz JGPVDECFZYOVLU-UHFFFAOYSA-N 0 0 357.797 3.562 20 5 FHBDRN CC(C)c1cc(C(=O)NCCc2ccc([N+](=O)[O-])cc2)nn1C(C)(C)C ZINC000053218870 943384954 /nfs/dbraw/zinc/38/49/54/943384954.db2.gz GOSLDHJHCMFNFP-UHFFFAOYSA-N 0 0 358.442 3.642 20 5 FHBDRN CCCCOc1ccc(C(=O)NCCc2ccc([N+](=O)[O-])cc2)cc1OC ZINC000053216305 943385601 /nfs/dbraw/zinc/38/56/01/943385601.db2.gz OGYMHIOGWBJGND-UHFFFAOYSA-N 0 0 372.421 3.755 20 5 FHBDRN CC(C)[C@@H](C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-])c1ccncc1 ZINC000503889176 943405351 /nfs/dbraw/zinc/40/53/51/943405351.db2.gz ZZQXRSLEYKZQDO-QGZVFWFLSA-N 0 0 361.829 3.742 20 5 FHBDRN Cc1cnn(-c2ccc(C)cc2NC(=O)c2cc(F)cc([N+](=O)[O-])c2)c1 ZINC000435449042 943410281 /nfs/dbraw/zinc/41/02/81/943410281.db2.gz NHOCATCFFKIPQY-UHFFFAOYSA-N 0 0 354.341 3.789 20 5 FHBDRN Cc1ccncc1C1=CCN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)CC1 ZINC000364047481 943410617 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FHBDRN COc1c(CN[C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)c(C)nn1C ZINC000162381026 943491985 /nfs/dbraw/zinc/49/19/85/943491985.db2.gz NLHQVTPDQUBKLH-IBGZPJMESA-N 0 0 366.421 3.525 20 5 FHBDRN Nc1nccc(C(=O)N[C@H]2CCC[C@H](c3ccc(Cl)cc3)C2)c1[N+](=O)[O-] ZINC000515071261 943497694 /nfs/dbraw/zinc/49/76/94/943497694.db2.gz COPYXRQPWZQIHM-JSGCOSHPSA-N 0 0 374.828 3.512 20 5 FHBDRN Cc1c(Cc2noc(CCc3ncc(C(C)(C)C)o3)n2)cccc1[N+](=O)[O-] ZINC000515092194 943499622 /nfs/dbraw/zinc/49/96/22/943499622.db2.gz BRZYYRNMNIYLPZ-UHFFFAOYSA-N 0 0 370.409 3.948 20 5 FHBDRN O=C(Nc1ccnn1-c1cccc(F)c1)[C@H]1C[C@H]1c1cccc([N+](=O)[O-])c1 ZINC001269499002 943507001 /nfs/dbraw/zinc/50/70/01/943507001.db2.gz NBPGYVMSQYUHPO-IRXDYDNUSA-N 0 0 366.352 3.662 20 5 FHBDRN COc1ccc2c(c1)[C@H](NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1)CCO2 ZINC001267835915 943507999 /nfs/dbraw/zinc/50/79/99/943507999.db2.gz DWECXYDUMBNZAA-OAHLLOKOSA-N 0 0 362.769 3.510 20 5 FHBDRN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)Nc1cccc2c1CCO2 ZINC000434218229 943511879 /nfs/dbraw/zinc/51/18/79/943511879.db2.gz QILVHEBPKXBZFJ-UHFFFAOYSA-N 0 0 355.394 3.674 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)CN(c1ccc(F)cc1)C(C)C ZINC000504146562 943514857 /nfs/dbraw/zinc/51/48/57/943514857.db2.gz UUOMHQWUXUQYHD-UHFFFAOYSA-N 0 0 361.373 3.596 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1)[C@@H](NCc1nncn1-c1ccccc1)CCCC2 ZINC000417326100 943518101 /nfs/dbraw/zinc/51/81/01/943518101.db2.gz QZEIFXOOUWEMEF-IBGZPJMESA-N 0 0 363.421 3.733 20 5 FHBDRN Cc1c(C(=O)N2CCC(OCc3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000105310720 943520194 /nfs/dbraw/zinc/52/01/94/943520194.db2.gz PFTMWRPKFTVHCY-UHFFFAOYSA-N 0 0 354.406 3.725 20 5 FHBDRN Cc1nn(CC(=O)Nc2cccc([N+](=O)[O-])c2C)cc1-c1ccccc1 ZINC000435643613 943524810 /nfs/dbraw/zinc/52/48/10/943524810.db2.gz FRZNSUFEQKYXAL-UHFFFAOYSA-N 0 0 350.378 3.714 20 5 FHBDRN Cc1nc(CN(C)Cc2ccc(Br)cc2[N+](=O)[O-])cs1 ZINC000425398132 943534923 /nfs/dbraw/zinc/53/49/23/943534923.db2.gz NDRYERUHYIDAOR-UHFFFAOYSA-N 0 0 356.245 3.754 20 5 FHBDRN Cc1nn(Cc2c(C)nn(Cc3ccc(Cl)cc3)c2C)cc1[N+](=O)[O-] ZINC000435655003 943539701 /nfs/dbraw/zinc/53/97/01/943539701.db2.gz MFULKHPFLZTCIY-UHFFFAOYSA-N 0 0 359.817 3.663 20 5 FHBDRN COc1ccccc1[C@@H]1C[C@H]1C(=O)N1c2ccc([N+](=O)[O-])cc2C[C@@H]1C ZINC000414872272 943540363 /nfs/dbraw/zinc/54/03/63/943540363.db2.gz PHKJATSYKWPBFP-AFAVFJNCSA-N 0 0 352.390 3.685 20 5 FHBDRN O=[N+]([O-])c1cccc2c1CCCN2S(=O)(=O)c1cc(F)ccc1Cl ZINC000513812661 943552394 /nfs/dbraw/zinc/55/23/94/943552394.db2.gz OZBKGVIMTDSTBC-UHFFFAOYSA-N 0 0 370.789 3.529 20 5 FHBDRN CN(C)[C@@H](c1nc(-c2ccc([N+](=O)[O-])cc2)no1)c1cccc(Cl)c1 ZINC000504223901 943554377 /nfs/dbraw/zinc/55/43/77/943554377.db2.gz ZJLMWNRMYJLUBQ-OAHLLOKOSA-N 0 0 358.785 3.949 20 5 FHBDRN Cc1cc(CCNc2cc3nc[nH]c(=O)c3cc2[N+](=O)[O-])ccc1Cl ZINC000515183533 943555960 /nfs/dbraw/zinc/55/59/60/943555960.db2.gz FAZLWZGFUCYZEQ-UHFFFAOYSA-N 0 0 358.785 3.860 20 5 FHBDRN Nc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(OCC(F)(F)F)c(F)c1 ZINC000504277193 943568550 /nfs/dbraw/zinc/56/85/50/943568550.db2.gz PGUVALQZZQQOSN-UHFFFAOYSA-N 0 0 373.262 3.510 20 5 FHBDRN O=c1[nH]c2ccccc2cc1CCc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000504278283 943570099 /nfs/dbraw/zinc/57/00/99/943570099.db2.gz BONXUZSDHWBYTR-UHFFFAOYSA-N 0 0 362.345 3.684 20 5 FHBDRN C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)[C@H]1COc2ccc(Cl)cc2C1 ZINC000504278675 943570186 /nfs/dbraw/zinc/57/01/86/943570186.db2.gz DYJMQKJPJKNVKX-SMDDNHRTSA-N 0 0 372.808 3.777 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1)N[C@@H]1C[C@H]1c1cc(F)c(F)c(F)c1 ZINC000435730718 943572854 /nfs/dbraw/zinc/57/28/54/943572854.db2.gz ZOBNCZTULCRNKG-SMDDNHRTSA-N 0 0 351.284 3.690 20 5 FHBDRN Cc1cc(F)c([N+](=O)[O-])cc1C(=O)Nc1nc2cccc(Cl)c2n1C ZINC001267843291 943578411 /nfs/dbraw/zinc/57/84/11/943578411.db2.gz DGFZINRPOJFVEO-UHFFFAOYSA-N 0 0 362.748 3.835 20 5 FHBDRN CC(C)(C)[C@H]1CN(S(=O)(=O)c2ccc([N+](=O)[O-])s2)c2ccccc21 ZINC000435721881 943579757 /nfs/dbraw/zinc/57/97/57/943579757.db2.gz KEQWQPRVBPCJQN-LBPRGKRZSA-N 0 0 366.464 3.995 20 5 FHBDRN C[C@@H]1C[C@@H](c2ccccc2)N(C(=O)CN(C)c2ccccc2[N+](=O)[O-])C1 ZINC000515226674 943581472 /nfs/dbraw/zinc/58/14/72/943581472.db2.gz MYSJMNKUZDONOW-BEFAXECRSA-N 0 0 353.422 3.641 20 5 FHBDRN COc1cc(NC(=O)CCCNc2ccc([N+](=O)[O-])cc2)c(C)c(OC)c1 ZINC000504283605 943581620 /nfs/dbraw/zinc/58/16/20/943581620.db2.gz FUXFCWFZVYEJCG-UHFFFAOYSA-N 0 0 373.409 3.751 20 5 FHBDRN O=C(NCCc1ccccc1[N+](=O)[O-])N(Cc1cccc(F)c1)C1CC1 ZINC000074764265 943589540 /nfs/dbraw/zinc/58/95/40/943589540.db2.gz GZTOJUWPCDWLSD-UHFFFAOYSA-N 0 0 357.385 3.651 20 5 FHBDRN Cc1ccc(C)n1C1CCN(C(=O)NCCc2ccccc2[N+](=O)[O-])CC1 ZINC000074763979 943595016 /nfs/dbraw/zinc/59/50/16/943595016.db2.gz KUZWLMUZTVCWPL-UHFFFAOYSA-N 0 0 370.453 3.602 20 5 FHBDRN COC(=O)[C@@H](C)c1ccc(NC(=O)N[C@H](C)c2ccccc2[N+](=O)[O-])cc1 ZINC000417425237 943599989 /nfs/dbraw/zinc/59/99/89/943599989.db2.gz VTUYGIOHVBVHSY-QWHCGFSZSA-N 0 0 371.393 3.754 20 5 FHBDRN CC(C)[C@@H](NC(=O)NCc1ccc([N+](=O)[O-])cc1Cl)C(F)(F)F ZINC000417427164 943603184 /nfs/dbraw/zinc/60/31/84/943603184.db2.gz PJCVKWCSRUTZES-LLVKDONJSA-N 0 0 353.728 3.634 20 5 FHBDRN CC(C)COc1ncccc1C(=O)N1c2ccc([N+](=O)[O-])cc2C[C@@H]1C ZINC000504381931 943610190 /nfs/dbraw/zinc/61/01/90/943610190.db2.gz PQIHRPFHBBMYCZ-ZDUSSCGKSA-N 0 0 355.394 3.616 20 5 FHBDRN Cc1ccc(N2CCN(C(=O)c3cccc(Cl)c3[N+](=O)[O-])CC2)cc1C ZINC000760018101 943617220 /nfs/dbraw/zinc/61/72/20/943617220.db2.gz AFYMDAULGFDILL-UHFFFAOYSA-N 0 0 373.840 3.827 20 5 FHBDRN CSc1ccc([N+](=O)[O-])c(C(=O)NCCc2nc3ccccc3s2)c1 ZINC000053287155 943618474 /nfs/dbraw/zinc/61/84/74/943618474.db2.gz QEQXYOAHJVBWTK-UHFFFAOYSA-N 0 0 373.459 3.899 20 5 FHBDRN C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)C1CCC(OC(F)F)CC1 ZINC000584801822 943635823 /nfs/dbraw/zinc/63/58/23/943635823.db2.gz KLOIVZNSHLDRFY-CDWSIMAYSA-N 0 0 354.353 3.670 20 5 FHBDRN COc1cc(Cn2nc(C(F)(F)F)c3cnccc32)c([N+](=O)[O-])cc1F ZINC000183976461 943646819 /nfs/dbraw/zinc/64/68/19/943646819.db2.gz YXZPTVFXYKEOTL-UHFFFAOYSA-N 0 0 370.262 3.554 20 5 FHBDRN CC[C@@]1(c2ccc(Cl)cc2)NC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O ZINC000504551927 943674813 /nfs/dbraw/zinc/67/48/13/943674813.db2.gz HSPGGPCHQPWMNL-KRWDZBQOSA-N 0 0 359.769 3.610 20 5 FHBDRN C[C@](NC(=O)Cc1ccc([N+](=O)[O-])cc1)(c1ccccc1)C(F)(F)F ZINC000504571505 943686243 /nfs/dbraw/zinc/68/62/43/943686243.db2.gz WIKCBRUBEQRIHY-INIZCTEOSA-N 0 0 352.312 3.731 20 5 FHBDRN Cc1c(Br)cc(C(=O)Nc2ccc(F)cc2O)cc1[N+](=O)[O-] ZINC000511635419 943692130 /nfs/dbraw/zinc/69/21/30/943692130.db2.gz GHXFBFJOHBDQEU-UHFFFAOYSA-N 0 0 369.146 3.763 20 5 FHBDRN CCc1ccc2c(c1)[C@@H](NC(=O)/C=C/c1ccc([N+](=O)[O-])cc1)CCO2 ZINC001267861765 943696513 /nfs/dbraw/zinc/69/65/13/943696513.db2.gz OJSXHPCFFIZVGX-OPUMOTSWSA-N 0 0 352.390 3.810 20 5 FHBDRN Nc1cccc(C2CCN(C(=O)c3c(Cl)cccc3[N+](=O)[O-])CC2)c1 ZINC000424036119 943698270 /nfs/dbraw/zinc/69/82/70/943698270.db2.gz RGELDOWSGAVVPK-UHFFFAOYSA-N 0 0 359.813 3.850 20 5 FHBDRN Cc1ccc([C@H](C)N2C(=O)N[C@@H](CC3CCCCC3)C2=O)cc1[N+](=O)[O-] ZINC000431954089 943703397 /nfs/dbraw/zinc/70/33/97/943703397.db2.gz OWEZOUBOUMPPBR-BBRMVZONSA-N 0 0 359.426 3.855 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)c1nnc([C@@H]2CCCS2)n1C ZINC000424084665 943722659 /nfs/dbraw/zinc/72/26/59/943722659.db2.gz CDUIFHRGDGPPHP-HNNXBMFYSA-N 0 0 361.471 3.706 20 5 FHBDRN Cc1ccc([C@H](C)N2C(=O)CN([C@@H](C)c3ccccc3)C2=O)cc1[N+](=O)[O-] ZINC000431955492 943742271 /nfs/dbraw/zinc/74/22/71/943742271.db2.gz QULWQYCQKLWIHH-GJZGRUSLSA-N 0 0 367.405 3.990 20 5 FHBDRN CCCC[N@H+](C)CC1CCN(c2cc(C)c([N+](=O)[O-])cc2C(=O)[O-])CC1 ZINC000584842721 943748592 /nfs/dbraw/zinc/74/85/92/943748592.db2.gz DXKJIUHOPRRQOU-UHFFFAOYSA-N 0 0 363.458 3.550 20 5 FHBDRN O=C(N[C@H]1C[C@H](c2ccccc2F)C1)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000437391257 943758482 /nfs/dbraw/zinc/75/84/82/943758482.db2.gz GJWZQOOVSWHJGR-HAQNSBGRSA-N 0 0 353.353 3.891 20 5 FHBDRN CCOc1cc(NC(=O)[C@@H]2CCC[C@@H](F)C2)c([N+](=O)[O-])cc1OCC ZINC000425409562 943761346 /nfs/dbraw/zinc/76/13/46/943761346.db2.gz AWQUKGLQXDYFFF-VXGBXAGGSA-N 0 0 354.378 3.859 20 5 FHBDRN CC(C)Oc1ccc(C(=O)N2CCS[C@H]2c2ccc([N+](=O)[O-])cc2)nc1 ZINC000435817485 943774080 /nfs/dbraw/zinc/77/40/80/943774080.db2.gz LIKRTBMAPCYCIJ-SFHVURJKSA-N 0 0 373.434 3.665 20 5 FHBDRN Cc1ccccc1CCNC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000435819246 943774502 /nfs/dbraw/zinc/77/45/02/943774502.db2.gz VREYEQLURDKMLS-UHFFFAOYSA-N 0 0 356.425 3.962 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](CCSc1ccccc1)C(=O)[O-] ZINC000417623200 943774684 /nfs/dbraw/zinc/77/46/84/943774684.db2.gz PACJVZLWMZRZGT-QGZVFWFLSA-N 0 0 360.435 3.628 20 5 FHBDRN Cn1cc(C(=O)NC[C@@H]2CCC[C@H]2C2CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000412484588 943776547 /nfs/dbraw/zinc/77/65/47/943776547.db2.gz XKJXFMWJRZQTDP-RDJZCZTQSA-N 0 0 368.437 3.551 20 5 FHBDRN CCN(CC)C(=O)c1ccc(C(=O)O[C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000103804207 943780193 /nfs/dbraw/zinc/78/01/93/943780193.db2.gz FUXWLTXRHDASGZ-AWEZNQCLSA-N 0 0 370.405 3.995 20 5 FHBDRN Cc1cc(Cl)cc(NC(=O)COc2ccc([N+](=O)[O-])c(C)c2)c1O ZINC000435809079 943784109 /nfs/dbraw/zinc/78/41/09/943784109.db2.gz OJXWJHNLBBFKFR-UHFFFAOYSA-N 0 0 350.758 3.588 20 5 FHBDRN CC(=Cc1cccc([N+](=O)[O-])c1)CNc1ccn(CCC(F)(F)F)n1 ZINC000424204819 943788159 /nfs/dbraw/zinc/78/81/59/943788159.db2.gz MIJNRKAAAGCOFP-XFXZXTDPSA-N 0 0 354.332 3.681 20 5 FHBDRN COc1ccccc1CCNC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000435834035 943790239 /nfs/dbraw/zinc/79/02/39/943790239.db2.gz HVWPKMMTJKVWIU-UHFFFAOYSA-N 0 0 372.424 3.662 20 5 FHBDRN CCCCc1c(C)nc2nc(Sc3ccc([N+](=O)[O-])nc3)nn2c1C ZINC000515327809 943791852 /nfs/dbraw/zinc/79/18/52/943791852.db2.gz BPXXBGKNPOVNJS-UHFFFAOYSA-N 0 0 358.427 3.538 20 5 FHBDRN O=[N+]([O-])c1cc(Br)ccc1CSc1nncn1C1CC1 ZINC000515351193 943801220 /nfs/dbraw/zinc/80/12/20/943801220.db2.gz BRHQQTAWVPCEMW-UHFFFAOYSA-N 0 0 355.217 3.576 20 5 FHBDRN CCOc1cc(CSCc2cccc(C(=O)OC)n2)ccc1[N+](=O)[O-] ZINC000516906603 943804941 /nfs/dbraw/zinc/80/49/41/943804941.db2.gz ZNXITTCFZMHMRI-UHFFFAOYSA-N 0 0 362.407 3.609 20 5 FHBDRN CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCCC[C@H]1CCC(=O)[O-] ZINC000424256623 943807895 /nfs/dbraw/zinc/80/78/95/943807895.db2.gz JIQPLIKEWKIEIW-HNNXBMFYSA-N 0 0 350.415 3.601 20 5 FHBDRN Cn1cc([N+](=O)[O-])cc1C(=O)N(Cc1ccc(F)cc1F)C1CCCC1 ZINC000515371241 943815814 /nfs/dbraw/zinc/81/58/14/943815814.db2.gz GJNPFBJLBMVAPA-UHFFFAOYSA-N 0 0 363.364 3.797 20 5 FHBDRN Cc1cc([C@@H]2CCCN2Cc2ccc(Br)cc2[N+](=O)[O-])on1 ZINC000425412153 943818731 /nfs/dbraw/zinc/81/87/31/943818731.db2.gz ZKBDSYDQQSFUKG-ZDUSSCGKSA-N 0 0 366.215 3.991 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)NC[C@@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000437460715 943830174 /nfs/dbraw/zinc/83/01/74/943830174.db2.gz HXLDQVAGJBERDO-CHWSQXEVSA-N 0 0 359.348 3.763 20 5 FHBDRN COc1ccc(CN(C)c2ccc(F)cc2[N+](=O)[O-])cc1OC(F)F ZINC000506051394 943831667 /nfs/dbraw/zinc/83/16/67/943831667.db2.gz KHBOVLXRVCCUAQ-UHFFFAOYSA-N 0 0 356.300 3.980 20 5 FHBDRN COc1cccc(C(=O)N[C@H]2C[C@H](c3cc(F)cc(F)c3)C2)c1[N+](=O)[O-] ZINC000437483745 943835918 /nfs/dbraw/zinc/83/59/18/943835918.db2.gz MVRPHLVCDCGAPQ-YEORSEQZSA-N 0 0 362.332 3.558 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)NCC1CCC(F)(F)CC1 ZINC000504849682 943841435 /nfs/dbraw/zinc/84/14/35/943841435.db2.gz YGZUJWIZENERJS-UHFFFAOYSA-N 0 0 357.357 3.941 20 5 FHBDRN COC(=O)c1cnc([C@@H](C)N[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)s1 ZINC000424322181 943843700 /nfs/dbraw/zinc/84/37/00/943843700.db2.gz HZYLIXDPBXYIHA-QMTHXVAHSA-N 0 0 361.423 3.566 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1N1CCC2(C[C@H]2C(=O)N2CCCCC2)CC1 ZINC000505720937 943844627 /nfs/dbraw/zinc/84/46/27/943844627.db2.gz RKJIZLQCPPHDNI-INIZCTEOSA-N 0 0 357.454 3.522 20 5 FHBDRN O=C(NCc1c(F)cc(F)c(F)c1F)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000435915745 943853989 /nfs/dbraw/zinc/85/39/89/943853989.db2.gz RURSUDGDTSHVFO-UHFFFAOYSA-N 0 0 362.666 3.735 20 5 FHBDRN COc1ccc(F)cc1[C@H](C)NC(=O)Nc1ccc(OC)c([N+](=O)[O-])c1 ZINC000543885671 943855345 /nfs/dbraw/zinc/85/53/45/943855345.db2.gz DGXIPFJQRAVHCR-JTQLQIEISA-N 0 0 363.345 3.634 20 5 FHBDRN O=[N+]([O-])c1ccccc1NCCc1nc(C2(c3ccc(F)cc3)CC2)no1 ZINC000424353002 943860882 /nfs/dbraw/zinc/86/08/82/943860882.db2.gz HVMKFSZSPFJPGH-UHFFFAOYSA-N 0 0 368.368 3.851 20 5 FHBDRN O=C(Nc1ccc2n[nH]cc2c1)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000435934215 943868043 /nfs/dbraw/zinc/86/80/43/943868043.db2.gz IKGQRDSQOAKAHV-UHFFFAOYSA-N 0 0 354.369 3.810 20 5 FHBDRN CN(C(=O)c1cc(F)cc2c(=O)c3cccc(F)c3[nH]c12)C1CCCC1 ZINC000435934576 943869050 /nfs/dbraw/zinc/86/90/50/943869050.db2.gz ALXFPXLFGCNANM-UHFFFAOYSA-N 0 0 356.372 3.974 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])N[C@H]1CC[C@@H](c2ccccc2F)C1 ZINC000435938048 943871636 /nfs/dbraw/zinc/87/16/36/943871636.db2.gz QJDGQFNAGYCPOL-KGLIPLIRSA-N 0 0 357.385 3.598 20 5 FHBDRN Cc1nn(CCC(=O)N(Cc2ccccc2)CC(C)(C)C)c(C)c1[N+](=O)[O-] ZINC000504880531 943878810 /nfs/dbraw/zinc/87/88/10/943878810.db2.gz BKDIOMMPGSSANE-UHFFFAOYSA-N 0 0 372.469 3.873 20 5 FHBDRN CCc1ccc(CC)c(NCC(=O)Nc2ccc([N+](=O)[O-])cc2OC)c1 ZINC000435962844 943888325 /nfs/dbraw/zinc/88/83/25/943888325.db2.gz INRHWORMBMTRAN-UHFFFAOYSA-N 0 0 357.410 3.779 20 5 FHBDRN CC(C)(C)[C@H](Nc1nccc(C(N)=O)c1[N+](=O)[O-])c1ccc(F)cc1F ZINC000290757580 943889672 /nfs/dbraw/zinc/88/96/72/943889672.db2.gz JOTKGQNBBTWHMV-CQSZACIVSA-N 0 0 364.352 3.566 20 5 FHBDRN COc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)c(O)c1 ZINC000504899681 943896990 /nfs/dbraw/zinc/89/69/90/943896990.db2.gz KEUZBNIALQDJBA-UHFFFAOYSA-N 0 0 356.256 3.580 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])N1CCC(Cc2ccc(F)cc2)CC1 ZINC000504902934 943902482 /nfs/dbraw/zinc/90/24/82/943902482.db2.gz NVLVAZBKYLXLEE-UHFFFAOYSA-N 0 0 356.397 3.758 20 5 FHBDRN COc1cc(CCNc2ncnc3scc(C)c32)c([N+](=O)[O-])cc1OC ZINC000505733513 943905337 /nfs/dbraw/zinc/90/53/37/943905337.db2.gz LVPPYFJQYSYJAA-UHFFFAOYSA-N 0 0 374.422 3.580 20 5 FHBDRN O=[N+]([O-])c1ccc(NC2(C3CCOCC3)CC2)nc1OCc1ccccc1 ZINC001167745192 943911528 /nfs/dbraw/zinc/91/15/28/943911528.db2.gz HSXIFAPGDWPITB-UHFFFAOYSA-N 0 0 369.421 3.940 20 5 FHBDRN COc1cccc(C(=O)N(C)Cc2ccc(F)c(Cl)c2)c1[N+](=O)[O-] ZINC000435986179 943912038 /nfs/dbraw/zinc/91/20/38/943912038.db2.gz RIJGWUPOBDIRDM-UHFFFAOYSA-N 0 0 352.749 3.668 20 5 FHBDRN CCCN1CCN(C(=O)c2cccc(OC)c2[N+](=O)[O-])c2ccc(F)cc21 ZINC000435991396 943917258 /nfs/dbraw/zinc/91/72/58/943917258.db2.gz DLJUCBZAZUIYKX-UHFFFAOYSA-N 0 0 373.384 3.619 20 5 FHBDRN O=C(NCCc1cc(F)c(F)c(F)c1)c1ccc([N+](=O)[O-])cc1Cl ZINC000504924572 943922432 /nfs/dbraw/zinc/92/24/32/943922432.db2.gz PZNOPSOHCUHZJX-UHFFFAOYSA-N 0 0 358.703 3.638 20 5 FHBDRN CC(C)(C(=O)NCCNc1ccc([N+](=O)[O-])cc1)c1ccccc1Cl ZINC000504927705 943924999 /nfs/dbraw/zinc/92/49/99/943924999.db2.gz SVXGWIBZLQJKGT-UHFFFAOYSA-N 0 0 361.829 3.754 20 5 FHBDRN Cc1ccc(C(=O)NCc2ccnc(OC3CCCCC3)c2)cc1[N+](=O)[O-] ZINC000500000415 943925160 /nfs/dbraw/zinc/92/51/60/943925160.db2.gz OSVXOQDGYFTDNW-UHFFFAOYSA-N 0 0 369.421 3.940 20 5 FHBDRN COC[C@H](C)Nc1ccccc1NC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000437592082 943935597 /nfs/dbraw/zinc/93/55/97/943935597.db2.gz KODQGXKYZFBRJX-NSHDSACASA-N 0 0 363.801 3.947 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2noc(Cc3cc(Cl)c4c(c3)OCCO4)n2)c1 ZINC000504968866 943944558 /nfs/dbraw/zinc/94/45/58/943944558.db2.gz JNJCYMNXAGVNQJ-UHFFFAOYSA-N 0 0 373.752 3.660 20 5 FHBDRN COCCOCCCCNC(=O)c1cc2ccccc2c2cccnc12 ZINC000504974255 943946638 /nfs/dbraw/zinc/94/66/38/943946638.db2.gz FYBLHUQGCNNAPT-UHFFFAOYSA-N 0 0 352.434 3.561 20 5 FHBDRN O=[N+]([O-])c1cccc(-c2noc(CCCOc3ccc(F)cc3F)n2)c1 ZINC000504975498 943946925 /nfs/dbraw/zinc/94/69/25/943946925.db2.gz SOFLQYROQZMQDB-UHFFFAOYSA-N 0 0 361.304 3.935 20 5 FHBDRN COC[C@H](C)Nc1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000437585436 943947143 /nfs/dbraw/zinc/94/71/43/943947143.db2.gz AHKIKWMHWXINPT-NSHDSACASA-N 0 0 363.801 3.947 20 5 FHBDRN CCOC(=O)c1cc(-c2nc(-c3ccccc3C)no2)cc([N+](=O)[O-])c1 ZINC000504975109 943947728 /nfs/dbraw/zinc/94/77/28/943947728.db2.gz NTTIQYSWCZJHGW-UHFFFAOYSA-N 0 0 353.334 3.797 20 5 FHBDRN CCC(CC)[C@H](CCNC(=O)N(C)Cc1ccccc1[N+](=O)[O-])OC ZINC000437604842 943961382 /nfs/dbraw/zinc/96/13/82/943961382.db2.gz KLKBAVLGVLPNSV-KRWDZBQOSA-N 0 0 351.447 3.578 20 5 FHBDRN C[C@H](C(=O)N1CCC[C@]2(C1)OCc1ccccc12)c1cccc([N+](=O)[O-])c1 ZINC000517065136 943966139 /nfs/dbraw/zinc/96/61/39/943966139.db2.gz IZVYLVGSTMVTDE-YCRPNKLZSA-N 0 0 366.417 3.746 20 5 FHBDRN COc1ccccc1N(CCO)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000566530156 943973645 /nfs/dbraw/zinc/97/36/45/943973645.db2.gz WCWGMIFMMCEETI-UHFFFAOYSA-N 0 0 368.389 3.862 20 5 FHBDRN COc1cccc(C(=O)Nc2ccccc2C(=O)OC(C)(C)C)c1[N+](=O)[O-] ZINC000436055973 943977518 /nfs/dbraw/zinc/97/75/18/943977518.db2.gz XLJLOCJWKMWWAZ-UHFFFAOYSA-N 0 0 372.377 3.811 20 5 FHBDRN CC(C)[C@@H]1CCC[C@H](NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000505041172 943978176 /nfs/dbraw/zinc/97/81/76/943978176.db2.gz JQRKZUFGRBITOX-CABCVRRESA-N 0 0 356.426 3.725 20 5 FHBDRN O=C(c1n[nH]c2ccc([N+](=O)[O-])cc21)N1CCCC[C@@H]1c1ccc(F)cc1 ZINC000500033021 943978480 /nfs/dbraw/zinc/97/84/80/943978480.db2.gz XFOFNODMIKOFGN-QGZVFWFLSA-N 0 0 368.368 3.978 20 5 FHBDRN Cc1nn(CC(C)C)c(C)c1CCc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000505031208 943988466 /nfs/dbraw/zinc/98/84/66/943988466.db2.gz URCJNWZMYHAHFH-UHFFFAOYSA-N 0 0 369.425 3.899 20 5 FHBDRN Cc1cc(CN(C)C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)ccc1F ZINC000436069215 943989231 /nfs/dbraw/zinc/98/92/31/943989231.db2.gz XYBUGVZEVFHCHC-UHFFFAOYSA-N 0 0 368.368 3.500 20 5 FHBDRN O=C(CSCc1nc(-c2cccc([N+](=O)[O-])c2)no1)c1ccccc1 ZINC000505035234 943991215 /nfs/dbraw/zinc/99/12/15/943991215.db2.gz IZVRZQUWTNAJAX-UHFFFAOYSA-N 0 0 355.375 3.761 20 5 FHBDRN COc1ccc(OCCCc2nc(-c3cccc([N+](=O)[O-])c3)no2)cc1 ZINC000505035739 943991469 /nfs/dbraw/zinc/99/14/69/943991469.db2.gz MCGPQKYZICZSFJ-UHFFFAOYSA-N 0 0 355.350 3.665 20 5 FHBDRN Cc1c(NC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)cnn1CC(C)C ZINC000500038415 943992649 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COCc1ccc(CNC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)cc1 ZINC000436090597 944007531 /nfs/dbraw/zinc/00/75/31/944007531.db2.gz QZIANCZMYVJVNO-UHFFFAOYSA-N 0 0 372.424 3.758 20 5 FHBDRN CC(C)c1ccc(OCCNC(=O)N(C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000506092758 944008548 /nfs/dbraw/zinc/00/85/48/944008548.db2.gz RLOQRIITAZPPIW-UHFFFAOYSA-N 0 0 371.437 3.939 20 5 FHBDRN COc1ccc(N(C)C(=O)c2ccc(SC)c([N+](=O)[O-])c2)c(OC)c1 ZINC000505072121 944016241 /nfs/dbraw/zinc/01/62/41/944016241.db2.gz RPNRYWCRKHCCBL-UHFFFAOYSA-N 0 0 362.407 3.611 20 5 FHBDRN CO[C@]1(C)CCCN(Cc2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000425466504 944022955 /nfs/dbraw/zinc/02/29/55/944022955.db2.gz AYDULJHGQBICJO-OAHLLOKOSA-N 0 0 357.248 3.748 20 5 FHBDRN CCn1c2ccc(Cl)cc2[nH]c1=NC(=O)c1cc(C)ccc1[N+](=O)[O-] ZINC000092570469 944026056 /nfs/dbraw/zinc/02/60/56/944026056.db2.gz OJFIBBUJHMFMCR-UHFFFAOYSA-N 0 0 358.785 3.600 20 5 FHBDRN COc1cc(F)c([N+](=O)[O-])c(Sc2nnc(-c3ccoc3C)o2)c1 ZINC000092583285 944032681 /nfs/dbraw/zinc/03/26/81/944032681.db2.gz SPCSHPNOSUSXNP-UHFFFAOYSA-N 0 0 351.315 3.845 20 5 FHBDRN C[C@@H](NC(=O)NCc1cccc2c1CCCN2)c1ccccc1[N+](=O)[O-] ZINC000417994801 944052974 /nfs/dbraw/zinc/05/29/74/944052974.db2.gz ZBXPDPJWXCLCRV-CYBMUJFWSA-N 0 0 354.410 3.513 20 5 FHBDRN COC(=O)C[C@H](NC(=O)Nc1cc([N+](=O)[O-])ccc1C)C1CCCCC1 ZINC000437725483 944056538 /nfs/dbraw/zinc/05/65/38/944056538.db2.gz NKWPOKJSXRWVHN-INIZCTEOSA-N 0 0 363.414 3.537 20 5 FHBDRN O=C(COc1c(Cl)cccc1Cl)NCc1ccc([N+](=O)[O-])cc1 ZINC000515625013 944076400 /nfs/dbraw/zinc/07/64/00/944076400.db2.gz YKFKARYESUOIOD-UHFFFAOYSA-N 0 0 355.177 3.597 20 5 FHBDRN CCNC(=O)c1cccc(Oc2ccc([N+](=O)[O-])c(OC(F)F)c2)c1 ZINC000092631087 944086107 /nfs/dbraw/zinc/08/61/07/944086107.db2.gz BUVRTWLQXYBVQN-UHFFFAOYSA-N 0 0 352.293 3.738 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1OC(=O)c1ccc(NC(=O)[C@@H]2C[C@@H]2C)cc1 ZINC000760020386 944088868 /nfs/dbraw/zinc/08/88/68/944088868.db2.gz YDWRUEVQOYATKM-SWLSCSKDSA-N 0 0 354.362 3.717 20 5 FHBDRN Cn1cc(C(=O)NCCC2CCCCC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000053465728 944096934 /nfs/dbraw/zinc/09/69/34/944096934.db2.gz VWIXANYWDUQBLE-UHFFFAOYSA-N 0 0 356.426 3.696 20 5 FHBDRN CC(C)n1cnnc1[C@@H]1CCCN(c2ccc([N+](=O)[O-])c3cccnc32)C1 ZINC000092655526 944100768 /nfs/dbraw/zinc/10/07/68/944100768.db2.gz LMKZIWFCLLZMHW-CQSZACIVSA-N 0 0 366.425 3.699 20 5 FHBDRN O=C(c1ccc(Cl)cc1[N+](=O)[O-])N1CC2(CCOCC2)[C@@H]2CCC[C@@H]21 ZINC000517219507 944115835 /nfs/dbraw/zinc/11/58/35/944115835.db2.gz KFOHBHWLCOJKDS-CABCVRRESA-N 0 0 364.829 3.670 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CNC(=O)C[C@H]1CCCc2ccccc21 ZINC000544124809 944117890 /nfs/dbraw/zinc/11/78/90/944117890.db2.gz MOOVAJRSPABZQV-OAHLLOKOSA-N 0 0 354.406 3.730 20 5 FHBDRN COc1cc(F)c([N+](=O)[O-])c(Oc2ccc(C(=O)N3CCCC3)cc2)c1 ZINC000092649955 944128829 /nfs/dbraw/zinc/12/88/29/944128829.db2.gz RDTAGIIGKBTRDP-UHFFFAOYSA-N 0 0 360.341 3.771 20 5 FHBDRN CCOC(=O)c1cccc(N(CC)C(=O)c2cccc([N+](=O)[O-])c2C)c1 ZINC000126500749 944131629 /nfs/dbraw/zinc/13/16/29/944131629.db2.gz QMTASRAOKGLQDR-UHFFFAOYSA-N 0 0 356.378 3.747 20 5 FHBDRN CC[C@H](Cc1ccccc1C)C(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000424815296 944137097 /nfs/dbraw/zinc/13/70/97/944137097.db2.gz XPQRIDCAGKQJCL-CQSZACIVSA-N 0 0 366.421 3.665 20 5 FHBDRN CC[C@H](N[C@@H]1CCc2c1cccc2[N+](=O)[O-])c1nnc2n1CCCCC2 ZINC000517245746 944138880 /nfs/dbraw/zinc/13/88/80/944138880.db2.gz AJHVUWNNHZYEBY-JKSUJKDBSA-N 0 0 355.442 3.641 20 5 FHBDRN CC(=O)N(c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2C)cc1)[C@@H]1C[C@@H]1C ZINC000515697866 944139949 /nfs/dbraw/zinc/13/99/49/944139949.db2.gz KDXFHLUBPFMXMI-ORAYPTAESA-N 0 0 367.405 3.917 20 5 FHBDRN CC(C)(C)c1cccc(OCCNC(=O)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC000505216935 944144616 /nfs/dbraw/zinc/14/46/16/944144616.db2.gz QCZJFAHYEZEHIS-UHFFFAOYSA-N 0 0 356.422 3.630 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1CCC[C@](C)(c2ccccc2)C1 ZINC000500134751 944152680 /nfs/dbraw/zinc/15/26/80/944152680.db2.gz FPXVPRAPQBVYKV-IBGZPJMESA-N 0 0 374.462 3.646 20 5 FHBDRN Cc1ccc(S(=O)(=O)N2CCC[C@](C)(c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000500140148 944161893 /nfs/dbraw/zinc/16/18/93/944161893.db2.gz LQMOTDYGVINXDP-IBGZPJMESA-N 0 0 374.462 3.646 20 5 FHBDRN Cn1cc([N+](=O)[O-])cc1C(=O)Nc1ccccc1COc1ccccc1 ZINC000515742270 944161827 /nfs/dbraw/zinc/16/18/27/944161827.db2.gz OTLGTDLBWHLQQX-UHFFFAOYSA-N 0 0 351.362 3.765 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)N(C)CCOc1ccc(OC)cc1 ZINC000517265877 944168168 /nfs/dbraw/zinc/16/81/68/944168168.db2.gz ZUMKRVFDJTWNSF-UHFFFAOYSA-N 0 0 373.409 3.709 20 5 FHBDRN CCCCc1ccc(CC(=O)NCc2ccc(OC)c([N+](=O)[O-])c2)cc1 ZINC000515731841 944170337 /nfs/dbraw/zinc/17/03/37/944170337.db2.gz SESPTZZGOIKVDK-UHFFFAOYSA-N 0 0 356.422 3.805 20 5 FHBDRN Cc1ccc(S(=O)(=O)N2CCC[C@@](C)(c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000500152370 944175275 /nfs/dbraw/zinc/17/52/75/944175275.db2.gz XPALGYLTEJVDFB-LJQANCHMSA-N 0 0 374.462 3.646 20 5 FHBDRN CCOc1cc(Nc2cccc(N3CCCNC3=O)c2)ccc1[N+](=O)[O-] ZINC000092658213 944179553 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FHBDRN Cc1cc(N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)ccc1[N+](=O)[O-] ZINC000092688872 944224965 /nfs/dbraw/zinc/22/49/65/944224965.db2.gz HCJHCBGMAFVTNU-SFHVURJKSA-N 0 0 353.422 3.549 20 5 FHBDRN CCOC(=O)CC[C@H]1CCCN(c2ccc([N+](=O)[O-])c3cccnc32)C1 ZINC000092687741 944233477 /nfs/dbraw/zinc/23/34/77/944233477.db2.gz JITLVWWUYSSBMZ-CQSZACIVSA-N 0 0 357.410 3.703 20 5 FHBDRN Cc1cccc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2)c1C(=O)N1CCCC1 ZINC000518285070 944234225 /nfs/dbraw/zinc/23/42/25/944234225.db2.gz GEWSFQPZBUBUJG-UHFFFAOYSA-N 0 0 371.368 3.531 20 5 FHBDRN CC[C@H]1C[C@H](C)CN1C(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000426253315 944241486 /nfs/dbraw/zinc/24/14/86/944241486.db2.gz AFXQNSWADAGOLN-GWCFXTLKSA-N 0 0 359.348 3.944 20 5 FHBDRN O=[N+]([O-])c1ccc(Cc2noc(CCCc3ccc(Cl)cc3)n2)nc1 ZINC000566593926 944242558 /nfs/dbraw/zinc/24/25/58/944242558.db2.gz PIPDKHTYKVCNMQ-UHFFFAOYSA-N 0 0 358.785 3.792 20 5 FHBDRN CC(C)c1ccoc1-c1noc(-c2cn(-c3cccc([N+](=O)[O-])c3)nn2)n1 ZINC000426254096 944245330 /nfs/dbraw/zinc/24/53/30/944245330.db2.gz CRJZLCPCJZNXAO-UHFFFAOYSA-N 0 0 366.337 3.609 20 5 FHBDRN Cn1cc(-c2noc(/C=C/c3cccc([N+](=O)[O-])c3)n2)c(C(F)(F)F)n1 ZINC000426257196 944255970 /nfs/dbraw/zinc/25/59/70/944255970.db2.gz QXBDVGOUCWPMPF-AATRIKPKSA-N 0 0 365.271 3.568 20 5 FHBDRN COc1cc(CNc2c3c(ccc2[N+](=O)[O-])NCC3)c2ccccc2n1 ZINC000436390216 944260590 /nfs/dbraw/zinc/26/05/90/944260590.db2.gz PTOJDWYPLJCSPD-UHFFFAOYSA-N 0 0 350.378 3.732 20 5 FHBDRN C[C@@H]1CCCN(C(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)[C@@H]1C ZINC000426259622 944265684 /nfs/dbraw/zinc/26/56/84/944265684.db2.gz ZKCKVFKGVFEKNU-GHMZBOCLSA-N 0 0 359.348 3.944 20 5 FHBDRN CCCOc1ccc(CNc2ccc(C(=O)NC)cc2[N+](=O)[O-])c(C)c1 ZINC000473706860 944271765 /nfs/dbraw/zinc/27/17/65/944271765.db2.gz RRHCESQEGMJSDL-UHFFFAOYSA-N 0 0 357.410 3.664 20 5 FHBDRN Cc1cc([C@H](C)NC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)c(C)s1 ZINC000025015394 944272534 /nfs/dbraw/zinc/27/25/34/944272534.db2.gz UBIORIOGHLRCJX-LBPRGKRZSA-N 0 0 370.434 3.950 20 5 FHBDRN O=[N+]([O-])c1cnc(C(F)(F)F)cc1NCCc1nc2cc(F)ccc2[nH]1 ZINC000436397584 944273182 /nfs/dbraw/zinc/27/31/82/944273182.db2.gz OXJSGOCZNBHSQZ-UHFFFAOYSA-N 0 0 369.278 3.679 20 5 FHBDRN COc1ccc(C2CCN(c3c4c(ccc3[N+](=O)[O-])NCC4)CC2)cc1 ZINC000436397067 944274321 /nfs/dbraw/zinc/27/43/21/944274321.db2.gz YNHIJZKTNVSYIP-UHFFFAOYSA-N 0 0 353.422 3.955 20 5 FHBDRN CCCN(CCc1cccs1)c1sc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000184214285 944277316 /nfs/dbraw/zinc/27/73/16/944277316.db2.gz KVCMDYOUBMZBOX-UHFFFAOYSA-N 0 0 374.509 3.580 20 5 FHBDRN COc1cc(Cl)ccc1CNC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000517412624 944280829 /nfs/dbraw/zinc/28/08/29/944280829.db2.gz CPJYEIADFMZRHQ-UHFFFAOYSA-N 0 0 355.177 3.840 20 5 FHBDRN Cc1cc(-c2csc(NC(=O)COc3ccccc3[N+](=O)[O-])n2)c(C)o1 ZINC000515873388 944290272 /nfs/dbraw/zinc/29/02/72/944290272.db2.gz XOQDNFZGTHDCES-UHFFFAOYSA-N 0 0 373.390 3.946 20 5 FHBDRN C[C@]1(O)CCCC[C@@H]1[C@H]1CCCN1C(=O)Nc1cc(F)cc([N+](=O)[O-])c1 ZINC000500224421 944290914 /nfs/dbraw/zinc/29/09/14/944290914.db2.gz RIEGOIGJVVBVFC-NUJGCVRESA-N 0 0 365.405 3.671 20 5 FHBDRN CCNc1ccc(C(=O)Nc2cc(CC(C)(C)C)nn2C)cc1[N+](=O)[O-] ZINC000517433972 944292670 /nfs/dbraw/zinc/29/26/70/944292670.db2.gz JLZUOTXRGBOXDB-UHFFFAOYSA-N 0 0 359.430 3.601 20 5 FHBDRN NC(=O)c1ccc(CSCCCOc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000105624006 944293629 /nfs/dbraw/zinc/29/36/29/944293629.db2.gz RYKKHXTYLBYKGB-UHFFFAOYSA-N 0 0 364.398 3.535 20 5 FHBDRN Cc1[nH]c2ccccc2c1C1CCN(C(=O)c2cc([N+](=O)[O-])cn2C)CC1 ZINC000517437157 944295310 /nfs/dbraw/zinc/29/53/10/944295310.db2.gz DNPGLCYNZFXTFR-UHFFFAOYSA-N 0 0 366.421 3.743 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)Nc1ccc(-c2csnn2)cc1 ZINC000518338896 944296864 /nfs/dbraw/zinc/29/68/64/944296864.db2.gz BKALOWWFEYGQIN-UHFFFAOYSA-N 0 0 372.431 3.844 20 5 FHBDRN CC1(C)CCN(C(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CC1 ZINC000426268731 944300840 /nfs/dbraw/zinc/30/08/40/944300840.db2.gz QYZYNDOPCBWDMM-UHFFFAOYSA-N 0 0 359.348 3.945 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1CN1CC[C@@H](O)[C@H]1c1ccc(Cl)cc1 ZINC000425549555 944302024 /nfs/dbraw/zinc/30/20/24/944302024.db2.gz LIPBZNOVRCSDQL-SJLPKXTDSA-N 0 0 362.813 3.565 20 5 FHBDRN Cc1sc(S(=O)(=O)N(C)[C@H](C)c2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000123198990 944306388 /nfs/dbraw/zinc/30/63/88/944306388.db2.gz ONAMPUSJNYLJSI-LLVKDONJSA-N 0 0 354.453 3.655 20 5 FHBDRN CC[C@@H]1CCCN(C(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C1 ZINC000426271383 944306632 /nfs/dbraw/zinc/30/66/32/944306632.db2.gz NVOVYPJAVYHSFN-LLVKDONJSA-N 0 0 359.348 3.945 20 5 FHBDRN Cc1cc(C)cc(OC[C@@H](O)COc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000550153789 944307836 /nfs/dbraw/zinc/30/78/36/944307836.db2.gz YJTYEEHDFSWHHM-CQSZACIVSA-N 0 0 351.786 3.684 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC[C@H](CO)Cc1cc(F)c(F)c(F)c1 ZINC000436427869 944310674 /nfs/dbraw/zinc/31/06/74/944310674.db2.gz CDQOHQQNORXPAO-GFCCVEGCSA-N 0 0 354.328 3.584 20 5 FHBDRN Cc1cc(F)cc(C(=O)NCc2ncc(-c3ccccc3)o2)c1[N+](=O)[O-] ZINC000123257348 944314185 /nfs/dbraw/zinc/31/41/85/944314185.db2.gz CAOXNLXTLIOOJD-UHFFFAOYSA-N 0 0 355.325 3.627 20 5 FHBDRN O=C(NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N1C[C@@H]2CCC[C@H]2C1 ZINC000426274785 944318827 /nfs/dbraw/zinc/31/88/27/944318827.db2.gz DFVXVOKKBOTXIK-RYUDHWBXSA-N 0 0 357.332 3.555 20 5 FHBDRN C[C@H](SCc1ccc(C(N)=O)cc1[N+](=O)[O-])c1ccc(F)c(F)c1 ZINC000105633679 944320556 /nfs/dbraw/zinc/32/05/56/944320556.db2.gz YWFNELYMJGHLAO-VIFPVBQESA-N 0 0 352.362 3.966 20 5 FHBDRN C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CCc2c1cccc2F ZINC000184043270 944322501 /nfs/dbraw/zinc/32/25/01/944322501.db2.gz YTRSLZDJYGTWRP-LLVKDONJSA-N 0 0 354.341 3.908 20 5 FHBDRN O=C(CSc1ccc([N+](=O)[O-])cc1)Nc1cnn(Cc2ccccc2)c1 ZINC000517467728 944325688 /nfs/dbraw/zinc/32/56/88/944325688.db2.gz JADJHGFAQRIUNI-UHFFFAOYSA-N 0 0 368.418 3.570 20 5 FHBDRN COC(=O)[C@H]1CC[C@H](C(=O)N(c2cccc([N+](=O)[O-])c2)C2CCCC2)CC1 ZINC000439091934 944331418 /nfs/dbraw/zinc/33/14/18/944331418.db2.gz XOGNAZLKMDUPEL-SHTZXODSSA-N 0 0 374.437 3.850 20 5 FHBDRN Cc1c(Cl)cc(S(=O)(=O)N[C@H](C)Cc2ccsc2)cc1[N+](=O)[O-] ZINC000517494450 944340865 /nfs/dbraw/zinc/34/08/65/944340865.db2.gz AXUPOPBMOTZTDV-SECBINFHSA-N 0 0 374.871 3.528 20 5 FHBDRN Cc1ccc2c(c1)N(S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])CCC2 ZINC000518387996 944343927 /nfs/dbraw/zinc/34/39/27/944343927.db2.gz IRFJOGPVQILCOI-UHFFFAOYSA-N 0 0 366.826 3.698 20 5 FHBDRN COc1cc(CN2C[C@H](C)O[C@@H](c3ccccc3)C2)c([N+](=O)[O-])cc1F ZINC000184251284 944350550 /nfs/dbraw/zinc/35/05/50/944350550.db2.gz BCZGXAYNIQRBNB-ORAYPTAESA-N 0 0 360.385 3.705 20 5 FHBDRN Cc1nn([C@@H](C)c2cccc(NC(=O)c3ccccc3)c2)cc1[N+](=O)[O-] ZINC000436473361 944353521 /nfs/dbraw/zinc/35/35/21/944353521.db2.gz HNVCNEQEOWRIBT-AWEZNQCLSA-N 0 0 350.378 3.961 20 5 FHBDRN O=C(NCc1ccc(F)c(Cl)c1)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000123450675 944362946 /nfs/dbraw/zinc/36/29/46/944362946.db2.gz QVWGQBXCLGJCQR-UHFFFAOYSA-N 0 0 363.776 3.655 20 5 FHBDRN C[C@@]1(CNC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)CCOC2(CCC2)C1 ZINC000894655043 944365120 /nfs/dbraw/zinc/36/51/20/944365120.db2.gz JURNOTZURNVHLC-YQVWRLOYSA-N 0 0 358.438 3.554 20 5 FHBDRN Cc1cc([N+](=O)[O-])cc(C(=O)NC[C@]2(C)CCOC3(CCC3)C2)c1F ZINC000894655881 944365857 /nfs/dbraw/zinc/36/58/57/944365857.db2.gz KIYJGKIJNPMGOE-QGZVFWFLSA-N 0 0 350.390 3.512 20 5 FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCCC1(C)C ZINC000518426131 944370431 /nfs/dbraw/zinc/37/04/31/944370431.db2.gz XGIJLIYPGQLQJA-ZDUSSCGKSA-N 0 0 366.483 3.889 20 5 FHBDRN Cc1nn(C)c(C(=O)N[C@@H](C)c2ccc(Cl)c3ccccc32)c1[N+](=O)[O-] ZINC000184268757 944371868 /nfs/dbraw/zinc/37/18/68/944371868.db2.gz CQGPMEGPIUITDX-JTQLQIEISA-N 0 0 372.812 3.934 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])N1CCCc2c(OC(F)F)cccc21 ZINC000566625579 944375330 /nfs/dbraw/zinc/37/53/30/944375330.db2.gz CBJXZEOGKMELAH-UHFFFAOYSA-N 0 0 362.332 3.718 20 5 FHBDRN COc1ccc(NC(=O)NC[C@@H](C)Oc2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000543890799 944376476 /nfs/dbraw/zinc/37/64/76/944376476.db2.gz ZBNJSCMGUMXSDS-CYBMUJFWSA-N 0 0 359.382 3.501 20 5 FHBDRN CNC(=O)c1ccc(N2CCC[C@H]2c2cccc(Cl)c2)c([N+](=O)[O-])c1 ZINC000053573738 944386692 /nfs/dbraw/zinc/38/66/92/944386692.db2.gz ZDOXQDFARBCGKL-HNNXBMFYSA-N 0 0 359.813 3.949 20 5 FHBDRN O=C1[C@@H](Sc2c(F)cc(F)cc2F)CCN1c1cccc([N+](=O)[O-])c1 ZINC000517554771 944387392 /nfs/dbraw/zinc/38/73/92/944387392.db2.gz IYXOVQGPMNUIKE-AWEZNQCLSA-N 0 0 368.336 3.910 20 5 FHBDRN COc1ccc(Cc2noc(C(C)(C)c3ccccc3[N+](=O)[O-])n2)cc1 ZINC000426293781 944389305 /nfs/dbraw/zinc/38/93/05/944389305.db2.gz RPOFFAVKYYBPAO-UHFFFAOYSA-N 0 0 353.378 3.903 20 5 FHBDRN CC(C)Oc1ccccc1CNc1c(Br)cncc1[N+](=O)[O-] ZINC000500276954 944394989 /nfs/dbraw/zinc/39/49/89/944394989.db2.gz VPWGEDNNRFABMK-UHFFFAOYSA-N 0 0 366.215 3.574 20 5 FHBDRN Cc1nn(C(F)F)c(C)c1CC(=O)O[C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000123740937 944409038 /nfs/dbraw/zinc/40/90/38/944409038.db2.gz AGUJDTZMIPGDOA-LLVKDONJSA-N 0 0 353.325 3.650 20 5 FHBDRN CNc1ccc(C(=O)Nc2ccc(Cc3ccncc3)cc2)cc1[N+](=O)[O-] ZINC000017446703 944413055 /nfs/dbraw/zinc/41/30/55/944413055.db2.gz UAHQQMBYCCUWSO-UHFFFAOYSA-N 0 0 362.389 3.875 20 5 FHBDRN O=C(NCCc1cccc([N+](=O)[O-])c1)N[C@H]1C[C@H](c2ccccc2F)C1 ZINC000437777626 944414145 /nfs/dbraw/zinc/41/41/45/944414145.db2.gz UAFAMMKVVNWFJJ-SHTZXODSSA-N 0 0 357.385 3.522 20 5 FHBDRN CC(C)(C)c1ccc(NC(=O)C(=O)N[C@@H]2CCCC2(C)C)cc1[N+](=O)[O-] ZINC000517580809 944415863 /nfs/dbraw/zinc/41/58/63/944415863.db2.gz MYUWAQATDMQDBG-OAHLLOKOSA-N 0 0 361.442 3.526 20 5 FHBDRN O=[N+]([O-])c1cc(F)cc(OC[C@H](O)COc2cccc3ccccc32)c1 ZINC000550207256 944423538 /nfs/dbraw/zinc/42/35/38/944423538.db2.gz QVKDXEPHIVUNQZ-INIZCTEOSA-N 0 0 357.337 3.706 20 5 FHBDRN C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CCc2ccsc2C1 ZINC000123784815 944424038 /nfs/dbraw/zinc/42/40/38/944424038.db2.gz UYERWUBTOQYUHN-SNVBAGLBSA-N 0 0 366.826 3.662 20 5 FHBDRN C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CCc2ccsc2C1 ZINC000123784571 944424291 /nfs/dbraw/zinc/42/42/91/944424291.db2.gz UYERWUBTOQYUHN-JTQLQIEISA-N 0 0 366.826 3.662 20 5 FHBDRN Cc1cc(Cl)ccc1NC(=O)[C@H](C)OC(=O)c1ccc([N+](=O)[O-])s1 ZINC000023344305 944427477 /nfs/dbraw/zinc/42/74/77/944427477.db2.gz AIYYIFCLSOAZFB-VIFPVBQESA-N 0 0 368.798 3.802 20 5 FHBDRN O=C(Nc1cnc(CC2CC2)nc1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000500289900 944429024 /nfs/dbraw/zinc/42/90/24/944429024.db2.gz BVCOSBUISMLWDN-UHFFFAOYSA-N 0 0 367.409 3.534 20 5 FHBDRN O=C(Nc1cnc(-c2ccccc2)nc1)c1cc([N+](=O)[O-])ccc1Cl ZINC000053598932 944429614 /nfs/dbraw/zinc/42/96/14/944429614.db2.gz PGNFYEUYOHPVCS-UHFFFAOYSA-N 0 0 354.753 3.958 20 5 FHBDRN CO[C@@H](CC(C)C)C(=O)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F ZINC000414887434 944433044 /nfs/dbraw/zinc/43/30/44/944433044.db2.gz IUAOJYLMIXKKBZ-AWEZNQCLSA-N 0 0 362.348 3.547 20 5 FHBDRN Cc1nc(C(=O)OCC(=O)c2cccc([N+](=O)[O-])c2)c(-c2ccccc2)o1 ZINC000759824737 944437403 /nfs/dbraw/zinc/43/74/03/944437403.db2.gz ODCWUWGCPIXXOJ-UHFFFAOYSA-N 0 0 366.329 3.598 20 5 FHBDRN Cc1nc2cc(CNc3nccc(Br)c3[N+](=O)[O-])ccc2o1 ZINC001167757073 944442997 /nfs/dbraw/zinc/44/29/97/944442997.db2.gz AFFWBVHCZUZRFU-UHFFFAOYSA-N 0 0 363.171 3.814 20 5 FHBDRN O=C(Nc1ccn(Cc2ccccc2)n1)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000046794254 944445656 /nfs/dbraw/zinc/44/56/56/944445656.db2.gz XCOIRXXVLPIHCS-UHFFFAOYSA-N 0 0 356.769 3.745 20 5 FHBDRN Cc1cc(Br)ccc1C(=O)Nc1ccc([N+](=O)[O-])c(C)n1 ZINC000133898114 944452310 /nfs/dbraw/zinc/45/23/10/944452310.db2.gz GAKCFJUSVSDEGX-UHFFFAOYSA-N 0 0 350.172 3.621 20 5 FHBDRN COCCCOc1cccc(NC(=O)Nc2ccc([N+](=O)[O-])c(C)c2)c1 ZINC000473783752 944457881 /nfs/dbraw/zinc/45/78/81/944457881.db2.gz LQBPBQOUDFKUBT-UHFFFAOYSA-N 0 0 359.382 3.963 20 5 FHBDRN CCc1ccc(C(=O)Nc2cc3[nH]ccc3c(C(=O)OC)c2)cc1[N+](=O)[O-] ZINC000425973237 944460050 /nfs/dbraw/zinc/46/00/50/944460050.db2.gz HATXQBSGQPLWRK-UHFFFAOYSA-N 0 0 367.361 3.677 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CC[C@H](C)C[C@H]1c1ccco1 ZINC000439235719 944467008 /nfs/dbraw/zinc/46/70/08/944467008.db2.gz QEUNTTHJBAARIK-WFASDCNBSA-N 0 0 364.423 3.658 20 5 FHBDRN Nc1c(C(=O)NCc2c(Cl)cccc2Cl)cc(F)cc1[N+](=O)[O-] ZINC000516077838 944469387 /nfs/dbraw/zinc/46/93/87/944469387.db2.gz MXEGBFXSTSBOBL-UHFFFAOYSA-N 0 0 358.156 3.553 20 5 FHBDRN Cc1cc(NC(=O)NCc2ccccc2-c2cnn(C)c2)ccc1[N+](=O)[O-] ZINC000473790041 944469859 /nfs/dbraw/zinc/46/98/59/944469859.db2.gz SXTMMXSMAJKZHV-UHFFFAOYSA-N 0 0 365.393 3.625 20 5 FHBDRN COC(=O)[C@@H](Cc1ccc(Cl)cc1)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000438295768 944471326 /nfs/dbraw/zinc/47/13/26/944471326.db2.gz WBOVXWSXHYXIJJ-SJKOYZFVSA-N 0 0 362.813 3.683 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1CNc1ccccc1C(=O)NC(C)(C)C ZINC000429799952 944474283 /nfs/dbraw/zinc/47/42/83/944474283.db2.gz GZRAXOOOIGRJRV-UHFFFAOYSA-N 0 0 357.410 3.744 20 5 FHBDRN Cc1cc(NC(=O)NCCc2c[nH]c3ccc(F)cc23)ccc1[N+](=O)[O-] ZINC000473790892 944475161 /nfs/dbraw/zinc/47/51/61/944475161.db2.gz WTTDOULISNMRDZ-UHFFFAOYSA-N 0 0 356.357 3.888 20 5 FHBDRN O=C(Nc1ccc(Cl)cn1)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC000439260036 944477577 /nfs/dbraw/zinc/47/75/77/944477577.db2.gz QQKCUCGALIFHFD-UHFFFAOYSA-N 0 0 354.753 3.958 20 5 FHBDRN CCOc1cc(C(=O)N2CCCc3ccc(C)cc32)c([N+](=O)[O-])cc1OC ZINC000110395402 944477935 /nfs/dbraw/zinc/47/79/35/944477935.db2.gz ARPOOIWHXVBSJD-UHFFFAOYSA-N 0 0 370.405 3.904 20 5 FHBDRN COc1ccccc1[C@@H]1CCN(C(=O)Nc2ccc([N+](=O)[O-])c(C)c2)C1 ZINC000473786244 944483779 /nfs/dbraw/zinc/48/37/79/944483779.db2.gz KVTKGOBDKDODJN-CQSZACIVSA-N 0 0 355.394 3.933 20 5 FHBDRN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]([C@H]2CCCO2)C1 ZINC000894710136 944485152 /nfs/dbraw/zinc/48/51/52/944485152.db2.gz HLLXOCZSYVHPQU-XJKSGUPXSA-N 0 0 364.467 3.738 20 5 FHBDRN COc1cc(C(=O)N(CC(C)C)c2ccccc2)c([N+](=O)[O-])cc1OC ZINC000500316296 944494563 /nfs/dbraw/zinc/49/45/63/944494563.db2.gz ZDDQGQDCPWHMRL-UHFFFAOYSA-N 0 0 358.394 3.915 20 5 FHBDRN O=[N+]([O-])c1cncc(Cl)c1OCc1ccc(Oc2ccccc2)nn1 ZINC000506537422 944495577 /nfs/dbraw/zinc/49/55/77/944495577.db2.gz BWTLGBBWMFFNBU-UHFFFAOYSA-N 0 0 358.741 3.805 20 5 FHBDRN Cc1ccccc1Cc1nnc(COc2c(Cl)cncc2[N+](=O)[O-])o1 ZINC000506536905 944496509 /nfs/dbraw/zinc/49/65/09/944496509.db2.gz DETQGBOYHDQXSQ-UHFFFAOYSA-N 0 0 360.757 3.504 20 5 FHBDRN CC(=O)N1CCc2cc(NCc3ccc4oc(C)nc4c3)cc([N+](=O)[O-])c21 ZINC001167758368 944497460 /nfs/dbraw/zinc/49/74/60/944497460.db2.gz LXSDILCVYNYXBP-UHFFFAOYSA-N 0 0 366.377 3.566 20 5 FHBDRN CCNc1nnc(Sc2ccc(Br)cc2[N+](=O)[O-])s1 ZINC000110454558 944501467 /nfs/dbraw/zinc/50/14/67/944501467.db2.gz NORUKJWGMAQNNV-UHFFFAOYSA-N 0 0 361.246 3.792 20 5 FHBDRN Cc1ccc(Oc2ccc(NC(=O)c3cc([N+](=O)[O-])cn3C)cn2)cc1C ZINC000516118569 944503081 /nfs/dbraw/zinc/50/30/81/944503081.db2.gz FWTBRPDLLXRIRC-UHFFFAOYSA-N 0 0 366.377 3.990 20 5 FHBDRN CNc1ccc(C(=O)Nc2c(C)nn(-c3ccccc3)c2C)cc1[N+](=O)[O-] ZINC000053636236 944505009 /nfs/dbraw/zinc/50/50/09/944505009.db2.gz HHZKILGYQZDLHB-UHFFFAOYSA-N 0 0 365.393 3.691 20 5 FHBDRN Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@@H](C)c1ccc(Cl)c2ccccc21 ZINC000184287553 944522506 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CC(C)c1ccc(OCCNC(=O)NCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000516150160 944538156 /nfs/dbraw/zinc/53/81/56/944538156.db2.gz ATVZMTTVPXYCBD-UHFFFAOYSA-N 0 0 357.410 3.596 20 5 FHBDRN CC(=O)N1C[C@@H]2CCC[C@H](Nc3ccc(C(F)(F)F)cc3[N+](=O)[O-])[C@H]2C1 ZINC000517725344 944539647 /nfs/dbraw/zinc/53/96/47/944539647.db2.gz RFUQBLYLMYTRQD-UBHSHLNASA-N 0 0 371.359 3.673 20 5 FHBDRN O=C(NCCNc1ccccc1[N+](=O)[O-])c1ccc(-c2ccccc2F)o1 ZINC000015093674 944552805 /nfs/dbraw/zinc/55/28/05/944552805.db2.gz XKAVKMYTLQMAQT-UHFFFAOYSA-N 0 0 369.352 3.836 20 5 FHBDRN O=C(COc1cccc([N+](=O)[O-])c1)Nc1csnc1-c1ccccc1 ZINC000436719136 944556826 /nfs/dbraw/zinc/55/68/26/944556826.db2.gz NNQYTRACKUWHJY-UHFFFAOYSA-N 0 0 355.375 3.736 20 5 FHBDRN C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)NC3(C(F)F)CC3)cc2[N+](=O)[O-])C1 ZINC000500340975 944568893 /nfs/dbraw/zinc/56/88/93/944568893.db2.gz FEAAZPCJHRRYQM-VXGBXAGGSA-N 0 0 367.396 3.605 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C[NH2+]CCC[C@H](Cc1ccccc1)C(=O)[O-] ZINC000426672352 944591213 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COc1ccc(NC(=O)c2sc(-c3ccccn3)nc2C)c([N+](=O)[O-])c1 ZINC000506577853 944624372 /nfs/dbraw/zinc/62/43/72/944624372.db2.gz KMADQBBCCDAQJY-UHFFFAOYSA-N 0 0 370.390 3.683 20 5 FHBDRN C[C@H](OC(=O)c1ccc2c(c1)CCCC2)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000017669395 944627520 /nfs/dbraw/zinc/62/75/20/944627520.db2.gz JUJYPKYPEZPTKJ-ZDUSSCGKSA-N 0 0 368.389 3.658 20 5 FHBDRN CCCc1nnc(NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)s1 ZINC000136427000 944628768 /nfs/dbraw/zinc/62/87/68/944628768.db2.gz KVTMPPPYHBJXHN-UHFFFAOYSA-N 0 0 361.427 3.595 20 5 FHBDRN CC(C)(CNS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1 ZINC000506239378 944630727 /nfs/dbraw/zinc/63/07/27/944630727.db2.gz DUNJQQRUZUBKFB-UHFFFAOYSA-N 0 0 368.842 3.504 20 5 FHBDRN CCOCCN(CC)C(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000426391852 944634332 /nfs/dbraw/zinc/63/43/32/944634332.db2.gz TWMODPQQZVTWFG-UHFFFAOYSA-N 0 0 372.421 3.672 20 5 FHBDRN COc1cc(COc2c(Cl)cncc2[N+](=O)[O-])ccc1OC(F)F ZINC000506584427 944637966 /nfs/dbraw/zinc/63/79/66/944637966.db2.gz PDCBJKMMUMNOIH-UHFFFAOYSA-N 0 0 360.700 3.832 20 5 FHBDRN O=C(N1CCc2c(cccc2[N+](=O)[O-])C1)C1(c2c(F)cccc2F)CCC1 ZINC000516271239 944663864 /nfs/dbraw/zinc/66/38/64/944663864.db2.gz COFHDGLVULUXRL-UHFFFAOYSA-N 0 0 372.371 3.880 20 5 FHBDRN O=[N+]([O-])c1cc(Cl)ccc1OCCc1nc(-c2ccc(O)cc2)no1 ZINC000436815048 944672196 /nfs/dbraw/zinc/67/21/96/944672196.db2.gz UGNJTMXLESAXBF-UHFFFAOYSA-N 0 0 361.741 3.625 20 5 FHBDRN CCOc1ccc(CN(C(=O)COc2ccccc2[N+](=O)[O-])C(C)C)cc1 ZINC000500379107 944677569 /nfs/dbraw/zinc/67/75/69/944677569.db2.gz CYBHBHHGPDSLSE-UHFFFAOYSA-N 0 0 372.421 3.810 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NC1(c2ccccc2)CCCC1 ZINC000506256190 944682927 /nfs/dbraw/zinc/68/29/27/944682927.db2.gz WAOXTCOOHMKAKE-UHFFFAOYSA-N 0 0 360.435 3.651 20 5 FHBDRN CCC[C@H]([NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1)C(=O)[O-] ZINC000426687848 944687599 /nfs/dbraw/zinc/68/75/99/944687599.db2.gz MSLQKIPDFDWLSM-INIZCTEOSA-N 0 0 357.410 3.706 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C[NH2+]C[C@H](CC(=O)[O-])c1ccc(Cl)cc1 ZINC000426702014 944701577 /nfs/dbraw/zinc/70/15/77/944701577.db2.gz CQTZCULYGKXUSW-HNNXBMFYSA-N 0 0 362.813 3.905 20 5 FHBDRN COc1ccc2c(c1)CCC[C@H]2N(C)C(=O)c1ccc(OC)c([N+](=O)[O-])c1 ZINC000516308562 944709775 /nfs/dbraw/zinc/70/97/75/944709775.db2.gz SZJMNIXMBZYLPV-QGZVFWFLSA-N 0 0 370.405 3.762 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1CN1CC=C(c2ccc(O)cc2)CC1 ZINC000506260919 944712356 /nfs/dbraw/zinc/71/23/56/944712356.db2.gz AWMDWRBGIMTNTC-UHFFFAOYSA-N 0 0 354.406 3.988 20 5 FHBDRN CN(c1ccccc1)c1ccc(C[NH2+]CC(C)(C)C(=O)[O-])cc1[N+](=O)[O-] ZINC000426692969 944712699 /nfs/dbraw/zinc/71/26/99/944712699.db2.gz WYZCQFKNLJIKKP-UHFFFAOYSA-N 0 0 357.410 3.563 20 5 FHBDRN CC1(C)CCCCN(C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C1 ZINC000438505005 944714930 /nfs/dbraw/zinc/71/49/30/944714930.db2.gz MHSBXSBDSYDSCI-UHFFFAOYSA-N 0 0 359.470 3.850 20 5 FHBDRN CSc1nc(N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc(C(F)F)n1 ZINC000516315187 944716102 /nfs/dbraw/zinc/71/61/02/944716102.db2.gz JCTINTBGJJGPIP-VIFPVBQESA-N 0 0 354.382 3.948 20 5 FHBDRN Cc1cc(Cc2noc([C@H](C)c3ccc4c(c3)OCO4)n2)ccc1[N+](=O)[O-] ZINC000426410535 944720020 /nfs/dbraw/zinc/72/00/20/944720020.db2.gz JGDLSXHJSARVAI-GFCCVEGCSA-N 0 0 367.361 3.758 20 5 FHBDRN CC(C)c1ccc(C(=O)N2CCC[C@@H]2C(=O)OC(C)(C)C)cc1[N+](=O)[O-] ZINC000439517852 944720950 /nfs/dbraw/zinc/72/09/50/944720950.db2.gz XJQSKKGDWBVIQQ-OAHLLOKOSA-N 0 0 362.426 3.665 20 5 FHBDRN CC1(NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])Cc2ccccc2C1 ZINC000092895523 944730157 /nfs/dbraw/zinc/73/01/57/944730157.db2.gz WGAPZRLWGSYRKO-UHFFFAOYSA-N 0 0 364.323 3.901 20 5 FHBDRN CCc1cccc2c1N(C(=O)c1n[nH]c3ccc([N+](=O)[O-])cc31)CCC2 ZINC000436868010 944733404 /nfs/dbraw/zinc/73/34/04/944733404.db2.gz GATPARWSDPUUHP-UHFFFAOYSA-N 0 0 350.378 3.627 20 5 FHBDRN CCO[C@H]1C[C@H](N(C)C(=O)c2ccc([N+](=O)[O-])cc2[O-])C12CCCCC2 ZINC000436869117 944734649 /nfs/dbraw/zinc/73/46/49/944734649.db2.gz LLARQFMCRBFBPY-IRXDYDNUSA-N 0 0 362.426 3.500 20 5 FHBDRN Cc1ccc(S(=O)(=O)NC2(c3ccccc3)CCCC2)cc1[N+](=O)[O-] ZINC000506265859 944736588 /nfs/dbraw/zinc/73/65/88/944736588.db2.gz AANKGEWBGBPEPO-UHFFFAOYSA-N 0 0 360.435 3.651 20 5 FHBDRN O=C(NCCOc1ccc2ccccc2c1)Nc1cccc([N+](=O)[O-])c1 ZINC000017743898 944739349 /nfs/dbraw/zinc/73/93/49/944739349.db2.gz XFKLWGHYRBOSOM-UHFFFAOYSA-N 0 0 351.362 3.949 20 5 FHBDRN O=C(COc1ccccc1[N+](=O)[O-])NCCc1cc2ccccc2s1 ZINC000506612101 944746965 /nfs/dbraw/zinc/74/69/65/944746965.db2.gz FUOYWTDHEIQABE-UHFFFAOYSA-N 0 0 356.403 3.547 20 5 FHBDRN COc1ccc([N+](=O)[O-])c(C(=O)N(C)[C@H](C)c2c(F)cccc2F)c1 ZINC000517872019 944751032 /nfs/dbraw/zinc/75/10/32/944751032.db2.gz XDQJZKNIOABUOS-SNVBAGLBSA-N 0 0 350.321 3.715 20 5 FHBDRN CC(C)(c1nc(-c2ccc(O)cc2F)no1)c1ccc([N+](=O)[O-])cc1F ZINC000436880162 944751912 /nfs/dbraw/zinc/75/19/12/944751912.db2.gz PMBDRHIASJVJLG-UHFFFAOYSA-N 0 0 361.304 3.955 20 5 FHBDRN CC[C@H](C)[C@H](NC(=O)Cc1ccccc1[N+](=O)[O-])c1nc2ccccc2[nH]1 ZINC000047174019 944757122 /nfs/dbraw/zinc/75/71/22/944757122.db2.gz LQUGESLYSSEOLD-DJJJIMSYSA-N 0 0 366.421 3.917 20 5 FHBDRN C[C@H](F)CCNC(=O)c1ccc(N2C[C@@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000506929697 944768158 /nfs/dbraw/zinc/76/81/58/944768158.db2.gz DZZJUOHGVNCKQW-IHRRRGAJSA-N 0 0 351.422 3.555 20 5 FHBDRN COc1cc(C(=O)N2CC[C@@](F)(c3ccccc3)C2)cc([N+](=O)[O-])c1C ZINC000518798781 944795112 /nfs/dbraw/zinc/79/51/12/944795112.db2.gz WENHFATZLLPSQK-IBGZPJMESA-N 0 0 358.369 3.623 20 5 FHBDRN O=[N+]([O-])c1cc(Br)cnc1NCCCc1ccc(O)cc1 ZINC000436920485 944805580 /nfs/dbraw/zinc/80/55/80/944805580.db2.gz PNKSCDSZFPZXAM-UHFFFAOYSA-N 0 0 352.188 3.503 20 5 FHBDRN COc1cccc(C(=O)CCCc2nc(-c3ccc([N+](=O)[O-])s3)no2)c1 ZINC000426437988 944810650 /nfs/dbraw/zinc/81/06/50/944810650.db2.gz AJJMGCVIIVACJS-UHFFFAOYSA-N 0 0 373.390 3.921 20 5 FHBDRN COc1c(C(=O)Nc2cc(F)ccc2Br)cccc1[N+](=O)[O-] ZINC000389482145 944816060 /nfs/dbraw/zinc/81/60/60/944816060.db2.gz XRBRSTMZGCTKDO-UHFFFAOYSA-N 0 0 369.146 3.757 20 5 FHBDRN C[C@@H]1[C@H](c2ccccc2)CCN1C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000126522959 944819321 /nfs/dbraw/zinc/81/93/21/944819321.db2.gz NOADTUYMIXXTQM-DNVCBOLYSA-N 0 0 353.422 3.725 20 5 FHBDRN CC(C)[C@@H](CC(F)(F)F)NC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000438595203 944819990 /nfs/dbraw/zinc/81/99/90/944819990.db2.gz AFRXBCLQCGOJSX-CYBMUJFWSA-N 0 0 357.332 3.643 20 5 FHBDRN CCN(Cc1ccccc1NCc1c(F)cc([N+](=O)[O-])cc1F)C(C)=O ZINC000506293210 944837733 /nfs/dbraw/zinc/83/77/33/944837733.db2.gz FKOLJJKWLBNAHD-UHFFFAOYSA-N 0 0 363.364 3.854 20 5 FHBDRN COc1ccc(CNC(=O)c2ncsc2-c2ccccc2)cc1[N+](=O)[O-] ZINC000437824761 944843790 /nfs/dbraw/zinc/84/37/90/944843790.db2.gz VCEWVGBHRLFCLC-UHFFFAOYSA-N 0 0 369.402 3.657 20 5 FHBDRN Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)COc1cccc2c1OC(C)(C)C2 ZINC001270145548 944845236 /nfs/dbraw/zinc/84/52/36/944845236.db2.gz ZKBVOXFKTYQLNF-UHFFFAOYSA-N 0 0 374.368 3.773 20 5 FHBDRN COc1ccc(C[NH2+][C@H](CC(=O)[O-])c2cccc(Cl)c2)cc1[N+](=O)[O-] ZINC000426825027 944849178 /nfs/dbraw/zinc/84/91/78/944849178.db2.gz KKJBVGAHZRHDDX-CQSZACIVSA-N 0 0 364.785 3.562 20 5 FHBDRN CCc1cccc2c1OCC[C@H]2NC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000507015215 944864327 /nfs/dbraw/zinc/86/43/27/944864327.db2.gz KIIKNGRHQMLJKD-OAHLLOKOSA-N 0 0 365.389 3.892 20 5 FHBDRN C[C@H](Nc1ncc([N+](=O)[O-])c(N)n1)c1ccc(Oc2ccccc2)cc1 ZINC000507030015 944877189 /nfs/dbraw/zinc/87/71/89/944877189.db2.gz NCDDUBPPDYQWIC-LBPRGKRZSA-N 0 0 351.366 3.763 20 5 FHBDRN CO[C@@H]1CCOc2c(NCc3c(F)cc([N+](=O)[O-])cc3F)cccc21 ZINC000506311206 944880327 /nfs/dbraw/zinc/88/03/27/944880327.db2.gz UYWSIZFQUATSAB-MRXNPFEDSA-N 0 0 350.321 3.955 20 5 FHBDRN CCOc1ccccc1[C@@H](CC)NC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000505915006 944883346 /nfs/dbraw/zinc/88/33/46/944883346.db2.gz HGIAYPHFSBABQS-OAHLLOKOSA-N 0 0 368.393 3.751 20 5 FHBDRN O=C(NCC1(c2ccccc2Cl)CCOCC1)c1cccc([N+](=O)[O-])c1 ZINC000517978416 944886826 /nfs/dbraw/zinc/88/68/26/944886826.db2.gz UBQIBWSGBDHDLD-UHFFFAOYSA-N 0 0 374.824 3.726 20 5 FHBDRN CC(C)C[C@@H](C)n1nccc1NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000426878013 944898256 /nfs/dbraw/zinc/89/82/56/944898256.db2.gz BVQLWSYZQWRXHS-LLVKDONJSA-N 0 0 356.386 3.527 20 5 FHBDRN Cc1c(CC(=O)N2CC[C@@H](Oc3ccc(Cl)cc3)C2)cccc1[N+](=O)[O-] ZINC000517992281 944902359 /nfs/dbraw/zinc/90/23/59/944902359.db2.gz GUMVNQVGVQXBOY-QGZVFWFLSA-N 0 0 374.824 3.779 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)NCc1ccc(F)cc1Br ZINC000511676869 944903885 /nfs/dbraw/zinc/90/38/85/944903885.db2.gz BNGNMCHXINUZRR-UHFFFAOYSA-N 0 0 367.174 3.735 20 5 FHBDRN O=C(COc1cccc([N+](=O)[O-])c1)N[C@@H]1CC[C@@H](Cc2ccccc2)C1 ZINC000438686301 944910739 /nfs/dbraw/zinc/91/07/39/944910739.db2.gz CUOMICHANMDFDY-DLBZAZTESA-N 0 0 354.406 3.501 20 5 FHBDRN Cc1ccc(NC(=O)c2ccc(SC[C@H](C)CO)c([N+](=O)[O-])c2)cc1 ZINC000426906999 944915669 /nfs/dbraw/zinc/91/56/69/944915669.db2.gz LBMUKWJHXGBPTP-CYBMUJFWSA-N 0 0 360.435 3.876 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H]1CCSc2ccc(F)cc21 ZINC000426906780 944916337 /nfs/dbraw/zinc/91/63/37/944916337.db2.gz ITCIXEBFAWUEBY-CQSZACIVSA-N 0 0 362.382 3.709 20 5 FHBDRN Cc1c(NC(=O)NC[C@H]2CCO[C@@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000432003866 944917230 /nfs/dbraw/zinc/91/72/30/944917230.db2.gz VCVBSYDFQCADSW-CRAIPNDOSA-N 0 0 355.394 3.803 20 5 FHBDRN CCc1cc(N[C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)ccc1F ZINC000506662990 944917324 /nfs/dbraw/zinc/91/73/24/944917324.db2.gz UNCCIMGYNUOROU-NSHDSACASA-N 0 0 361.373 3.744 20 5 FHBDRN C[C@H](CC(=O)c1ccccc1)NC(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000426908924 944917428 /nfs/dbraw/zinc/91/74/28/944917428.db2.gz IYXCNYCIUMDXDP-GFCCVEGCSA-N 0 0 352.346 3.732 20 5 FHBDRN O=C(CNc1ccccc1[N+](=O)[O-])N[C@@H]1CC[C@@H](Cc2ccccc2)C1 ZINC000438676892 944917977 /nfs/dbraw/zinc/91/79/77/944917977.db2.gz WUGPHABKDYSJIC-DLBZAZTESA-N 0 0 353.422 3.534 20 5 FHBDRN CCNc1ccc(C(=O)N[C@@H](C2CCCC2)C(F)(F)F)cc1[N+](=O)[O-] ZINC000437949551 944922597 /nfs/dbraw/zinc/92/25/97/944922597.db2.gz SERDDYQMAJIBJI-AWEZNQCLSA-N 0 0 359.348 3.878 20 5 FHBDRN COc1cccc([N+](=O)[O-])c1NCc1cccnc1OCC(F)(F)F ZINC000518003786 944924386 /nfs/dbraw/zinc/92/43/86/944924386.db2.gz DIXHLYGKFMJGPY-UHFFFAOYSA-N 0 0 357.288 3.552 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N(Cc1ccc(F)cc1)C(C)C ZINC000507064085 944926145 /nfs/dbraw/zinc/92/61/45/944926145.db2.gz ILJCTHSGOMCZEK-UHFFFAOYSA-N 0 0 366.414 3.642 20 5 FHBDRN C[C@@H](Nc1ncnc2sc([N+](=O)[O-])cc21)c1noc(-c2ccccc2)n1 ZINC000516481502 944927529 /nfs/dbraw/zinc/92/75/29/944927529.db2.gz CSTBMQYZLMCPLH-SECBINFHSA-N 0 0 368.378 3.823 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N[C@@H]2CC[C@@H](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000438690203 944929486 /nfs/dbraw/zinc/92/94/86/944929486.db2.gz HYAGBZWQKYPMEF-LSDHHAIUSA-N 0 0 356.426 3.583 20 5 FHBDRN O=C(c1ccc(N2CCCC2)c([N+](=O)[O-])c1)N1CCCC2(CCCC2)C1 ZINC000438690885 944929742 /nfs/dbraw/zinc/92/97/42/944929742.db2.gz KPQAYIGUSKYRHT-UHFFFAOYSA-N 0 0 357.454 3.991 20 5 FHBDRN COc1cc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)ccc1C(F)(F)F ZINC000426930416 944930357 /nfs/dbraw/zinc/93/03/57/944930357.db2.gz AOFMLMBUUUYYOY-UHFFFAOYSA-N 0 0 373.262 3.596 20 5 FHBDRN O=C(Nc1cc(F)cc([N+](=O)[O-])c1)N1CC2(CCC2)[C@@H]1C1CCOCC1 ZINC000425684798 944933241 /nfs/dbraw/zinc/93/32/41/944933241.db2.gz QRLWZYRMQJVEOT-INIZCTEOSA-N 0 0 363.389 3.547 20 5 FHBDRN CCSCC[C@H](C)NC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000437024387 944935623 /nfs/dbraw/zinc/93/56/23/944935623.db2.gz ZMWVLOSPJLULNQ-VIFPVBQESA-N 0 0 350.362 3.875 20 5 FHBDRN CC[C@@H](C)Oc1ccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2C)cc1 ZINC000511710473 944935983 /nfs/dbraw/zinc/93/59/83/944935983.db2.gz QVJDAOOUSPDFGC-GFCCVEGCSA-N 0 0 364.423 3.881 20 5 FHBDRN CCOCc1ccc(NS(=O)(=O)c2cc([N+](=O)[O-])cc(C)c2C)cc1 ZINC000438716511 944943600 /nfs/dbraw/zinc/94/36/00/944943600.db2.gz HXZCMPDKILVPOF-UHFFFAOYSA-N 0 0 364.423 3.549 20 5 FHBDRN Cc1cccc([C@@H]2NC(=O)N(Cc3ccc([N+](=O)[O-])cc3Cl)C2=O)c1C ZINC000432046338 944947190 /nfs/dbraw/zinc/94/71/90/944947190.db2.gz LFHNRPCVJSOCKD-INIZCTEOSA-N 0 0 373.796 3.658 20 5 FHBDRN CCO[C@@H]1C[C@@H](N(C)C(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)C1(C)C ZINC001126450579 944951373 /nfs/dbraw/zinc/95/13/73/944951373.db2.gz DAPSFVJGXLMMIA-IAGOWNOFSA-N 0 0 364.442 3.658 20 5 FHBDRN COc1ccc(OCCSCCc2scnc2C)c([N+](=O)[O-])c1 ZINC000507100102 944952937 /nfs/dbraw/zinc/95/29/37/944952937.db2.gz CKXWJUZODZQUKQ-UHFFFAOYSA-N 0 0 354.453 3.723 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)N2C[C@]3(CCCO3)[C@H]2C2CC2)cc1[N+](=O)[O-] ZINC000516506528 944955146 /nfs/dbraw/zinc/95/51/46/944955146.db2.gz GATNKKUMVXJLLV-YLJYHZDGSA-N 0 0 358.438 3.676 20 5 FHBDRN C[C@H]1CCc2sc(C(=O)NCCNc3ccc([N+](=O)[O-])cc3)cc2C1 ZINC000008175473 944960198 /nfs/dbraw/zinc/96/01/98/944960198.db2.gz KHBBDKJXQQXSFO-LBPRGKRZSA-N 0 0 359.451 3.623 20 5 FHBDRN COc1ccc(C(=O)NCCc2cc3ccccc3s2)cc1[N+](=O)[O-] ZINC000506676083 944971375 /nfs/dbraw/zinc/97/13/75/944971375.db2.gz JSJGKYAGSZSJLP-UHFFFAOYSA-N 0 0 356.403 3.791 20 5 FHBDRN CC[C@@H](C)Oc1cccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2C)c1 ZINC000511740120 944974649 /nfs/dbraw/zinc/97/46/49/944974649.db2.gz UIWJAQOWVALNQT-GFCCVEGCSA-N 0 0 364.423 3.881 20 5 FHBDRN CC[C@H](C)Oc1cccc(NS(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000511730972 944977927 /nfs/dbraw/zinc/97/79/27/944977927.db2.gz VPQYIFDAJSPGAF-ZDUSSCGKSA-N 0 0 364.423 3.881 20 5 FHBDRN O=C(Nc1ccccc1C(F)F)N1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000425706346 944981696 /nfs/dbraw/zinc/98/16/96/944981696.db2.gz VDEZOJVEHSQQKY-UHFFFAOYSA-N 0 0 365.340 3.598 20 5 FHBDRN CCCOc1ccc(CNC(=O)c2cccc([N+](=O)[O-])c2C)cc1OC ZINC000106066841 944993995 /nfs/dbraw/zinc/99/39/95/944993995.db2.gz XTFWIEKDZMGECQ-UHFFFAOYSA-N 0 0 358.394 3.631 20 5 FHBDRN O=[N+]([O-])c1cc(COc2ccccc2OC(F)F)c2c(c1)COCO2 ZINC000106068094 944994274 /nfs/dbraw/zinc/99/42/74/944994274.db2.gz YEBOYRVBCYOAIO-UHFFFAOYSA-N 0 0 353.277 3.642 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)c1cccc2c1C(=O)OC2(C)C ZINC001270536218 944998880 /nfs/dbraw/zinc/99/88/80/944998880.db2.gz LLQXTSUZNUPMHP-UHFFFAOYSA-N 0 0 370.361 3.651 20 5 FHBDRN O=C(NCCCNc1ccccc1F)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000544295945 945008904 /nfs/dbraw/zinc/00/89/04/945008904.db2.gz LECOEAVWGGJFQA-UHFFFAOYSA-N 0 0 351.765 3.619 20 5 FHBDRN C[C@@H](Oc1ccc(F)cc1)C(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000437097261 945016284 /nfs/dbraw/zinc/01/62/84/945016284.db2.gz MSLWDSWUNAUOHG-CYBMUJFWSA-N 0 0 358.369 3.692 20 5 FHBDRN COc1cc(OC)c(CN(Cc2cccc([N+](=O)[O-])c2)C2CC2)c(OC)c1 ZINC000507167257 945017197 /nfs/dbraw/zinc/01/71/97/945017197.db2.gz KPZDGPMTNNOJKR-UHFFFAOYSA-N 0 0 372.421 3.785 20 5 FHBDRN O=C(Nc1cccc(OCc2ccc(Cl)cc2)c1)c1cc([N+](=O)[O-])n[nH]1 ZINC000511752478 945018818 /nfs/dbraw/zinc/01/88/18/945018818.db2.gz CYARSTQQSDBUOC-UHFFFAOYSA-N 0 0 372.768 3.803 20 5 FHBDRN Cc1c(CNC(=O)N[C@H]2C[C@H](c3ccccc3F)C2)cccc1[N+](=O)[O-] ZINC000437850206 945020804 /nfs/dbraw/zinc/02/08/04/945020804.db2.gz GLBHCIGXOHIXSB-SHTZXODSSA-N 0 0 357.385 3.788 20 5 FHBDRN Cc1ccsc1CCCC(=O)Nc1n[nH]c(-c2cccc([N+](=O)[O-])c2)n1 ZINC000439842567 945023534 /nfs/dbraw/zinc/02/35/34/945023534.db2.gz OYLJOELPFGPDAE-UHFFFAOYSA-N 0 0 371.422 3.711 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)N1CCC[C@@]2(CC=CCC2)C1 ZINC000511761139 945032267 /nfs/dbraw/zinc/03/22/67/945032267.db2.gz WBISQSOBKQSIRP-FQEVSTJZSA-N 0 0 353.422 3.898 20 5 FHBDRN C[C@H]1CCCN(c2ccc(C(=O)NC[C@H]3CC=CCC3)cc2[N+](=O)[O-])C1 ZINC000519021578 945035344 /nfs/dbraw/zinc/03/53/44/945035344.db2.gz OEFWMCKUZOQOFD-HOTGVXAUSA-N 0 0 357.454 3.917 20 5 FHBDRN CC(C)[C@@H](Cc1ccc(F)cc1)N(C)C(=O)CNc1ccccc1[N+](=O)[O-] ZINC000437116172 945037059 /nfs/dbraw/zinc/03/70/59/945037059.db2.gz MXMIKFYNFXUDHK-LJQANCHMSA-N 0 0 373.428 3.872 20 5 FHBDRN COC(=O)c1cccc(-c2noc(/C=C/c3ccccc3[N+](=O)[O-])n2)c1 ZINC000438819270 945049407 /nfs/dbraw/zinc/04/94/07/945049407.db2.gz LWDSQSQZIJXWAZ-MDZDMXLPSA-N 0 0 351.318 3.602 20 5 FHBDRN CC(C)[C@H](Cc1ccc(F)cc1)N(C)C(=O)COc1cccc([N+](=O)[O-])c1 ZINC000437121954 945052544 /nfs/dbraw/zinc/05/25/44/945052544.db2.gz ZCMKIPARUBZVLG-IBGZPJMESA-N 0 0 374.412 3.838 20 5 FHBDRN O=C([C@@H]1Cc2ccccc2S1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000437124449 945053329 /nfs/dbraw/zinc/05/33/29/945053329.db2.gz BNCQLVNBCBJSIM-SFHVURJKSA-N 0 0 354.431 3.803 20 5 FHBDRN C[C@@H](c1ccccc1)[N@@H+]1CC[C@@H](NC(=O)Nc2cccc([N+](=O)[O-])c2)C1 ZINC000516593747 945055592 /nfs/dbraw/zinc/05/55/92/945055592.db2.gz OGFFDDHMQVIXOR-WMLDXEAASA-N 0 0 354.410 3.552 20 5 FHBDRN Cc1cccc2c1CC[C@H]2Nc1ccc([N+](=O)[O-])cc1C(=O)NC1CC1 ZINC000729471500 945056003 /nfs/dbraw/zinc/05/60/03/945056003.db2.gz ZNALQFAGSGCOFX-GOSISDBHSA-N 0 0 351.406 3.895 20 5 FHBDRN CCn1ncc(NC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c1C(F)(F)F ZINC000439879124 945056835 /nfs/dbraw/zinc/05/68/35/945056835.db2.gz NKUZFOFVXATSRS-VIFPVBQESA-N 0 0 371.319 3.713 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1)N1CC[C@@H](c2cccc(Cl)c2)C1 ZINC000432091062 945059161 /nfs/dbraw/zinc/05/91/61/945059161.db2.gz UIBPOOLPFSTIFG-OAHLLOKOSA-N 0 0 359.813 3.947 20 5 FHBDRN COCCc1nc2cc(NC(=O)Nc3cccc([N+](=O)[O-])c3C)ccc2o1 ZINC000440276327 945370453 /nfs/dbraw/zinc/37/04/53/945370453.db2.gz VSMJLDBJECFHBX-UHFFFAOYSA-N 0 0 370.365 3.877 20 5 FHBDRN O=C(c1cc2c(s1)CCCCC2)N1CCc2ncc([N+](=O)[O-])cc2C1 ZINC000408130031 945373249 /nfs/dbraw/zinc/37/32/49/945373249.db2.gz AHSBAXAVOWUPBD-UHFFFAOYSA-N 0 0 357.435 3.519 20 5 FHBDRN CC(C)(C)C(=O)N1CCC(COc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000181712255 945377733 /nfs/dbraw/zinc/37/77/33/945377733.db2.gz SHZOBMPOXLMOAN-UHFFFAOYSA-N 0 0 354.834 3.912 20 5 FHBDRN COc1ccc(-c2nc(COc3ccc([N+](=O)[O-])c(Cl)c3)no2)cc1 ZINC000124945065 945386254 /nfs/dbraw/zinc/38/62/54/945386254.db2.gz ZFTSJHMAXGXPBM-UHFFFAOYSA-N 0 0 361.741 3.886 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1CCCC[C@H]1Cc1ccccc1 ZINC000427449587 945388596 /nfs/dbraw/zinc/38/85/96/945388596.db2.gz OZESPCGHZYIJFB-INIZCTEOSA-N 0 0 354.406 3.841 20 5 FHBDRN CN(Cc1ccccc1[N+](=O)[O-])c1ccnc2cc(Br)cnc21 ZINC000475046915 945389645 /nfs/dbraw/zinc/38/96/45/945389645.db2.gz MJQGCQLUEBQROY-UHFFFAOYSA-N 0 0 373.210 3.937 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1nc2cc(F)c(F)cc2s1 ZINC000427453630 945392790 /nfs/dbraw/zinc/39/27/90/945392790.db2.gz QPOULFHMZSHKLM-UHFFFAOYSA-N 0 0 365.317 3.744 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1C[C@H](C)OC[C@@H]1c1ccccc1 ZINC001126484870 945397900 /nfs/dbraw/zinc/39/79/00/945397900.db2.gz ZAKUGBVPSXKNNQ-HNAYVOBHSA-N 0 0 354.406 3.814 20 5 FHBDRN COc1cc2nc(C)sc2cc1NC(=O)c1ccc([N+](=O)[O-])cc1OC ZINC000427474854 945404369 /nfs/dbraw/zinc/40/43/69/945404369.db2.gz XLPMFQJHFHEMOS-UHFFFAOYSA-N 0 0 373.390 3.782 20 5 FHBDRN CCn1cc([N+](=O)[O-])c(C(=O)N2C[C@H](c3ccccc3)[C@@H]3CCCC[C@H]32)n1 ZINC000427477697 945406859 /nfs/dbraw/zinc/40/68/59/945406859.db2.gz AVSQGOPMQGNCTC-GVDBMIGSSA-N 0 0 368.437 3.610 20 5 FHBDRN CCOc1ccccc1[C@H](CC)NC(=O)c1ccc([N+](=O)[O-])cc1OC ZINC000427464466 945409344 /nfs/dbraw/zinc/40/93/44/945409344.db2.gz WJNKICDGVVOQIM-INIZCTEOSA-N 0 0 358.394 3.883 20 5 FHBDRN C[C@@H]1CC[C@@](C[NH2+]Cc2cc([N+](=O)[O-])ccc2OC(F)F)(CC(=O)[O-])C1 ZINC000426632169 945409487 /nfs/dbraw/zinc/40/94/87/945409487.db2.gz SVWAEHMAWAWNAJ-DIFFPNOSSA-N 0 0 372.368 3.567 20 5 FHBDRN Cc1cn2c(nc(C)c2-c2noc(COc3cccc([N+](=O)[O-])c3)n2)s1 ZINC000426633309 945412149 /nfs/dbraw/zinc/41/21/49/945412149.db2.gz DWVBUQAMDQBBRD-UHFFFAOYSA-N 0 0 371.378 3.550 20 5 FHBDRN C[C@@H](CCC(=O)[O-])C[NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000426635066 945416165 /nfs/dbraw/zinc/41/61/65/945416165.db2.gz UBKQXYFDIJUFGM-HNNXBMFYSA-N 0 0 371.437 3.953 20 5 FHBDRN O=C(NCCOC1CCCCC1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000438014930 945418247 /nfs/dbraw/zinc/41/82/47/945418247.db2.gz RNEZMFUXNQOTPX-UHFFFAOYSA-N 0 0 361.442 3.618 20 5 FHBDRN Cc1nc(C)c([C@@H](C)N(C)CC(=O)Nc2cc([N+](=O)[O-])ccc2C)s1 ZINC000106877549 945422130 /nfs/dbraw/zinc/42/21/30/945422130.db2.gz QTLFVCUUXUZRBP-GFCCVEGCSA-N 0 0 362.455 3.608 20 5 FHBDRN CC(C)C(=O)Nc1ccc(NC(=O)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000086998998 945425071 /nfs/dbraw/zinc/42/50/71/945425071.db2.gz TVENYTVPXAYGBT-UHFFFAOYSA-N 0 0 355.394 3.761 20 5 FHBDRN CN(Cc1cccc(F)c1)C(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000120879978 945463996 /nfs/dbraw/zinc/46/39/96/945463996.db2.gz UXTNIJVCZOGPFE-UHFFFAOYSA-N 0 0 367.174 3.769 20 5 FHBDRN O=C([O-])c1ccccc1CC[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000426645584 945469139 /nfs/dbraw/zinc/46/91/39/945469139.db2.gz HKXRIZIDFBKGOK-UHFFFAOYSA-N 0 0 366.373 3.885 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)Nc1cc2c(cc1Cl)OCCO2 ZINC000087026760 945472059 /nfs/dbraw/zinc/47/20/59/945472059.db2.gz QSVGNIKPPOHTFV-UHFFFAOYSA-N 0 0 362.769 3.591 20 5 FHBDRN CC(C)(C(=O)N1CC(Cc2ccc(F)c(F)c2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000426652662 945481637 /nfs/dbraw/zinc/48/16/37/945481637.db2.gz WDRGIOMCBOLMKD-UHFFFAOYSA-N 0 0 374.387 3.852 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1)C1(c2ccccc2Cl)CCOCC1 ZINC000107103616 945484344 /nfs/dbraw/zinc/48/43/44/945484344.db2.gz ZJINMFOPOSJKEG-UHFFFAOYSA-N 0 0 360.797 3.935 20 5 FHBDRN Cc1cc(N2CCCC2)ccc1NC(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000047624921 945490970 /nfs/dbraw/zinc/49/09/70/945490970.db2.gz PNOADWJRLUKRFN-UHFFFAOYSA-N 0 0 369.421 3.911 20 5 FHBDRN CC(C)c1csc(CNC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)n1 ZINC000151276663 945493471 /nfs/dbraw/zinc/49/34/71/945493471.db2.gz POABKGKLMNODNK-LLVKDONJSA-N 0 0 365.480 3.972 20 5 FHBDRN CC(C)Sc1ccc(Cn2cnc3ccc([N+](=O)[O-])cc3c2=O)cc1 ZINC000511877851 945494209 /nfs/dbraw/zinc/49/42/09/945494209.db2.gz GBZJQNUYKLHXGP-UHFFFAOYSA-N 0 0 355.419 3.854 20 5 FHBDRN CC(C)Oc1ccc(CNC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)cc1 ZINC000087032791 945502530 /nfs/dbraw/zinc/50/25/30/945502530.db2.gz JTCAAMVPWUQDGE-UHFFFAOYSA-N 0 0 369.421 3.650 20 5 FHBDRN COc1cc(C(=O)N(C)Cc2ccc(F)cc2Cl)ccc1[N+](=O)[O-] ZINC000107159360 945503309 /nfs/dbraw/zinc/50/33/09/945503309.db2.gz YOZCLAILXTXVNP-UHFFFAOYSA-N 0 0 352.749 3.668 20 5 FHBDRN COc1ccc(/C=C/C(=O)N2c3ccc([N+](=O)[O-])cc3C[C@@H]2C)cc1OC ZINC000728811219 945511403 /nfs/dbraw/zinc/51/14/03/945511403.db2.gz JJDCLFDJRGZSRS-NEXMIYJRSA-N 0 0 368.389 3.603 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1nc(Cc2ccccc2)ns1 ZINC000107199259 945518470 /nfs/dbraw/zinc/51/84/70/945518470.db2.gz PKYUWEBSKUCSDL-UHFFFAOYSA-N 0 0 354.391 3.598 20 5 FHBDRN COc1ccccc1[C@H](NC(=O)c1ccc([N+](=O)[O-])s1)c1ccccn1 ZINC000129396398 945522667 /nfs/dbraw/zinc/52/26/67/945522667.db2.gz MYFUCPKHEGKAEO-KRWDZBQOSA-N 0 0 369.402 3.579 20 5 FHBDRN COC(=O)c1ccsc1NC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000129398331 945523329 /nfs/dbraw/zinc/52/33/29/945523329.db2.gz JEYQBDOWRKQEKG-UHFFFAOYSA-N 0 0 374.296 3.714 20 5 FHBDRN COc1cc(CN(C)Cc2cccs2)c([N+](=O)[O-])cc1OC(F)F ZINC000053778833 945541150 /nfs/dbraw/zinc/54/11/50/945541150.db2.gz WQWGHSXNBPZRGU-UHFFFAOYSA-N 0 0 358.366 3.898 20 5 FHBDRN C[C@@H](Nc1cnn(-c2ccc([N+](=O)[O-])cc2)c(=O)c1Cl)c1ccccc1 ZINC000107296090 945543729 /nfs/dbraw/zinc/54/37/29/945543729.db2.gz WEUFTNPERIZHOW-GFCCVEGCSA-N 0 0 370.796 3.967 20 5 FHBDRN C[C@@H](SCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C(=O)OC(C)(C)C ZINC000281151579 945544412 /nfs/dbraw/zinc/54/44/12/945544412.db2.gz OMZGCCJUFWMUSI-SNVBAGLBSA-N 0 0 365.411 3.608 20 5 FHBDRN C[C@@H]1CC[C@H](O)[C@@H]([C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000281185094 945548786 /nfs/dbraw/zinc/54/87/86/945548786.db2.gz AFFZKHRJJPEDBD-ZAUVIXRXSA-N 0 0 366.845 3.650 20 5 FHBDRN CC(=O)CCc1ccc(O[C@@H](C)C(=O)Oc2c(C)cccc2[N+](=O)[O-])cc1 ZINC000760022084 945558820 /nfs/dbraw/zinc/55/88/20/945558820.db2.gz GWXCEYXCDFFDBJ-HNNXBMFYSA-N 0 0 371.389 3.798 20 5 FHBDRN CCCCN1CCc2ccc(NC(=O)c3n[nH]c(CCC)c3[N+](=O)[O-])cc21 ZINC000473082126 945580259 /nfs/dbraw/zinc/58/02/59/945580259.db2.gz USDNYBDHMXBORS-UHFFFAOYSA-N 0 0 371.441 3.685 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)c1csc([C@H]2CCCO2)n1 ZINC000281259821 945582447 /nfs/dbraw/zinc/58/24/47/945582447.db2.gz GRTGGTKQIOLUBF-CQSZACIVSA-N 0 0 363.395 3.554 20 5 FHBDRN Cn1c(-c2nc(Cc3csc(-c4ccccc4)n3)no2)ccc1[N+](=O)[O-] ZINC000546237478 945582889 /nfs/dbraw/zinc/58/28/89/945582889.db2.gz PMANRNJALNKDBE-UHFFFAOYSA-N 0 0 367.390 3.698 20 5 FHBDRN C[C@@H](SCC(=O)Nc1cc([N+](=O)[O-])ccc1Cl)C(=O)OC(C)(C)C ZINC000281308365 945585332 /nfs/dbraw/zinc/58/53/32/945585332.db2.gz ZAPASRWWUSWEDD-SECBINFHSA-N 0 0 374.846 3.650 20 5 FHBDRN O=C(NC[C@H]1Cc2ccccc21)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000215799861 945586914 /nfs/dbraw/zinc/58/69/14/945586914.db2.gz LATPTWGEFBFBSW-CQSZACIVSA-N 0 0 365.414 3.788 20 5 FHBDRN C[C@H]1CC[C@@H](CNC(=O)c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)C1 ZINC001271265149 945600366 /nfs/dbraw/zinc/60/03/66/945600366.db2.gz IHBVAAGPFWSODB-JKSUJKDBSA-N 0 0 359.470 3.997 20 5 FHBDRN Cc1ccc(C(=O)Oc2c(C)cccc2[N+](=O)[O-])c(Br)n1 ZINC000760023293 945604949 /nfs/dbraw/zinc/60/49/49/945604949.db2.gz QYGDQTMTVAORMS-UHFFFAOYSA-N 0 0 351.156 3.588 20 5 FHBDRN Cc1cc(N[C@@H]2CCC[C@H](C(=O)N(C)C)C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000549524563 945614011 /nfs/dbraw/zinc/61/40/11/945614011.db2.gz WSVJUQPUHJJGRG-NWDGAFQWSA-N 0 0 373.375 3.981 20 5 FHBDRN C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCN2C(=O)c2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000281391746 945620776 /nfs/dbraw/zinc/62/07/76/945620776.db2.gz MXWQWFQIYWXVRN-HWHUXHBOSA-N 0 0 366.845 3.650 20 5 FHBDRN CC(C)(C)N1CC[C@@H](NC(=O)c2cc3ccccc3c3cccnc23)C1=O ZINC000519651365 945621058 /nfs/dbraw/zinc/62/10/58/945621058.db2.gz NGCLHMSFTOIATQ-GOSISDBHSA-N 0 0 361.445 3.517 20 5 FHBDRN Cc1ccc([C@H](C)NC(=O)Nc2ccc(N3CCC3=O)cc2)cc1[N+](=O)[O-] ZINC000281423482 945627488 /nfs/dbraw/zinc/62/74/88/945627488.db2.gz ZRDKNQBGMJEETE-ZDUSSCGKSA-N 0 0 368.393 3.523 20 5 FHBDRN CCOc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CC[C@@H](C)[C@@H](C)C2)cc1OC ZINC000248616932 945641255 /nfs/dbraw/zinc/64/12/55/945641255.db2.gz RUCLERGBJIINHB-FRRDWIJNSA-N 0 0 350.415 3.557 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)c1cn2cc(Cl)cc(Cl)c2n1 ZINC000440426006 945652344 /nfs/dbraw/zinc/65/23/44/945652344.db2.gz AEENKZCLEVFKHJ-UHFFFAOYSA-N 0 0 351.149 3.802 20 5 FHBDRN CC(C)n1cc(Cl)c(NC(=O)CSc2ccccc2[N+](=O)[O-])n1 ZINC000894882899 945654660 /nfs/dbraw/zinc/65/46/60/945654660.db2.gz NAAJAACCPYQXEA-UHFFFAOYSA-N 0 0 354.819 3.756 20 5 FHBDRN Cc1c(F)c(C(F)(F)F)ccc1-c1nc(-c2c([N+](=O)[O-])ncn2C)no1 ZINC000519691655 945663353 /nfs/dbraw/zinc/66/33/53/945663353.db2.gz GDNAWIBUPLZNGQ-UHFFFAOYSA-N 0 0 371.250 3.512 20 5 FHBDRN COC(=O)c1ccc(Cl)c(COc2cc([N+](=O)[O-])ccc2OC)c1 ZINC000511886047 945677734 /nfs/dbraw/zinc/67/77/34/945677734.db2.gz GRKQEEBNCGIVPU-UHFFFAOYSA-N 0 0 351.742 3.622 20 5 FHBDRN CC(C)NC(=O)c1ccccc1NC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000027242679 945688508 /nfs/dbraw/zinc/68/85/08/945688508.db2.gz JLAHYGNMGGCHSP-UHFFFAOYSA-N 0 0 361.785 3.639 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)c1cnn(Cc2ccccc2)c1 ZINC000129390776 945690600 /nfs/dbraw/zinc/69/06/00/945690600.db2.gz UWCXCQVMWHFUFX-UHFFFAOYSA-N 0 0 350.378 3.709 20 5 FHBDRN COc1coc(COc2ccc([N+](=O)[O-])cc2Cc2ccccc2)cc1=O ZINC000444003958 945712227 /nfs/dbraw/zinc/71/22/27/945712227.db2.gz PDZJSRWOHBCAFC-UHFFFAOYSA-N 0 0 367.357 3.726 20 5 FHBDRN O=C(OCc1ccc(F)c(F)c1)c1ccc([N+](=O)[O-])cc1Br ZINC000740410332 945715907 /nfs/dbraw/zinc/71/59/07/945715907.db2.gz NZMQSYIEMMMCRR-UHFFFAOYSA-N 0 0 372.121 3.993 20 5 FHBDRN O=C(N[C@@H]1CCc2c1cccc2O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000444027327 945731619 /nfs/dbraw/zinc/73/16/19/945731619.db2.gz CDCYBMLTWOYWFQ-LJQANCHMSA-N 0 0 370.408 3.804 20 5 FHBDRN COc1cccc(C(=O)NC[C@@H](C)Oc2ccc(C(C)C)cc2)c1[N+](=O)[O-] ZINC000519773965 945732071 /nfs/dbraw/zinc/73/20/71/945732071.db2.gz KZGBNTIFQUNPJM-CQSZACIVSA-N 0 0 372.421 3.924 20 5 FHBDRN CCCOc1ccc(CNC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000522740240 945734164 /nfs/dbraw/zinc/73/41/64/945734164.db2.gz JOMDEXCOAZGBMH-UHFFFAOYSA-N 0 0 362.813 3.896 20 5 FHBDRN O=C(N[C@@H]1CCSC1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000487349761 945734530 /nfs/dbraw/zinc/73/45/30/945734530.db2.gz DCMMICMATNLETI-GFCCVEGCSA-N 0 0 360.460 3.981 20 5 FHBDRN CNC(=O)c1ccc(Cl)c(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])c1 ZINC000125344828 945734809 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/nfs/dbraw/zinc/81/10/89/945811089.db2.gz SHWAKEBMTYZLIQ-UHFFFAOYSA-N 0 0 372.385 3.537 20 5 FHBDRN CNc1c(C(=O)N[C@H]2CC[C@H](c3ccc(F)cc3)C2)cccc1[N+](=O)[O-] ZINC000473662366 945820019 /nfs/dbraw/zinc/82/00/19/945820019.db2.gz QBQMHILMGWDUGK-ZFWWWQNUSA-N 0 0 357.385 3.842 20 5 FHBDRN CC1(C)CC(CNC(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C1 ZINC000519858008 945827088 /nfs/dbraw/zinc/82/70/88/945827088.db2.gz JOBGAHIFCFZHME-UHFFFAOYSA-N 0 0 359.348 3.849 20 5 FHBDRN CC1(C)CO[C@@H](CCNC(=O)c2c([N+](=O)[O-])cccc2C(F)(F)F)C1 ZINC000894500940 945840194 /nfs/dbraw/zinc/84/01/94/945840194.db2.gz SKYDJIJYMOAEMF-JTQLQIEISA-N 0 0 360.332 3.549 20 5 FHBDRN CCCN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2C)c2cc(F)ccc21 ZINC001271356631 945849556 /nfs/dbraw/zinc/84/95/56/945849556.db2.gz OIIUDIYUAYOPRD-UHFFFAOYSA-N 0 0 357.385 3.919 20 5 FHBDRN CCCN(Cc1ccc(F)cc1)c1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000519887444 945857554 /nfs/dbraw/zinc/85/75/54/945857554.db2.gz OQOKBEFUCREUEV-UHFFFAOYSA-N 0 0 366.414 3.554 20 5 FHBDRN CCc1ccc(CC)c(C(=O)Cn2c(=O)oc3ccc([N+](=O)[O-])cc32)c1 ZINC000519900609 945865275 /nfs/dbraw/zinc/86/52/75/945865275.db2.gz WFNXPYKAUVJTJP-UHFFFAOYSA-N 0 0 354.362 3.510 20 5 FHBDRN C[C@H](OC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1)c1ccnn1C ZINC001271557938 945865993 /nfs/dbraw/zinc/86/59/93/945865993.db2.gz UYGPTPSUEQJQTO-ZDUSSCGKSA-N 0 0 366.377 3.990 20 5 FHBDRN CCOc1ccc(C(=O)NCc2ccccc2OC2CCC2)cc1[N+](=O)[O-] ZINC000522808866 945875505 /nfs/dbraw/zinc/87/55/05/945875505.db2.gz JXVPLBOOOFLRGK-UHFFFAOYSA-N 0 0 370.405 3.855 20 5 FHBDRN O=C(c1cc(F)ccc1F)C1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000108154182 945877302 /nfs/dbraw/zinc/87/73/02/945877302.db2.gz AWMSYVOSMPBLTL-UHFFFAOYSA-N 0 0 374.343 3.608 20 5 FHBDRN COC(=O)c1cc(NC(=O)c2scc(C)c2Cl)c(C)c([N+](=O)[O-])c1 ZINC000550106277 945878814 /nfs/dbraw/zinc/87/88/14/945878814.db2.gz KOPJFVVXIBIPSK-UHFFFAOYSA-N 0 0 368.798 3.965 20 5 FHBDRN Cc1cccc(-c2nc(C(C)C)no2)c1NC(=O)c1ccc([N+](=O)[O-])o1 ZINC000108168267 945879457 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FHBDRN COc1cccc2c1OCC[C@@H]2NC(=O)Nc1ccc([N+](=O)[O-])c(C)c1 ZINC000613779204 945958158 /nfs/dbraw/zinc/95/81/58/945958158.db2.gz LXAVNHZDHCHHKO-AWEZNQCLSA-N 0 0 357.366 3.557 20 5 FHBDRN Cc1cc(NC(=O)N[C@H](Cn2cccn2)c2ccccc2)ccc1[N+](=O)[O-] ZINC000613779199 945958166 /nfs/dbraw/zinc/95/81/66/945958166.db2.gz JLSJESRQPJDUSG-QGZVFWFLSA-N 0 0 365.393 3.663 20 5 FHBDRN Cc1nn(Cc2ccc(C(=O)NC[C@@H]3CC=CCC3)cc2)c(C)c1[N+](=O)[O-] ZINC000519976138 945964209 /nfs/dbraw/zinc/96/42/09/945964209.db2.gz JANIPSORQPFAEX-MRXNPFEDSA-N 0 0 368.437 3.543 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H](C)c1ccc(Br)s1 ZINC000440862107 945967369 /nfs/dbraw/zinc/96/73/69/945967369.db2.gz ULGSEQWBZIPAHW-QMMMGPOBSA-N 0 0 370.228 3.613 20 5 FHBDRN CCCO[C@H]1CCCN(C(=O)Nc2cc([N+](=O)[O-])ccc2OCC)CC1 ZINC000281941780 945968098 /nfs/dbraw/zinc/96/80/98/945968098.db2.gz LKMHOLRTLXMJFM-HNNXBMFYSA-N 0 0 365.430 3.807 20 5 FHBDRN Cc1nc(COc2ccc(NC(=O)Nc3ccc([N+](=O)[O-])cc3)cc2)no1 ZINC000108432207 945971220 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3.667 20 5 FHBDRN Cc1ccc([C@@H](C)NC(=O)N2CC[C@H](Cc3nccs3)C2)cc1[N+](=O)[O-] ZINC000893451006 946015313 /nfs/dbraw/zinc/01/53/13/946015313.db2.gz FMTZDENFALAGPQ-ZIAGYGMSSA-N 0 0 374.466 3.695 20 5 FHBDRN COC(=O)c1cc(NC(=O)c2ccc3c(c2)CCCC3)cc([N+](=O)[O-])c1 ZINC000522866280 946017028 /nfs/dbraw/zinc/01/70/28/946017028.db2.gz QNRDMRWQFFFCNS-UHFFFAOYSA-N 0 0 354.362 3.513 20 5 FHBDRN COC(=O)c1cc(NC(=O)C2(c3cccc(F)c3)CCC2)cc([N+](=O)[O-])c1 ZINC000522869059 946033763 /nfs/dbraw/zinc/03/37/63/946033763.db2.gz ZIYWCADLUKIAQQ-UHFFFAOYSA-N 0 0 372.352 3.581 20 5 FHBDRN O=C(COc1ccc([N+](=O)[O-])c(F)c1)Nc1ccc(CC(F)(F)F)cc1 ZINC000127086235 946047799 /nfs/dbraw/zinc/04/77/99/946047799.db2.gz IBMVFRLZRVGFHM-UHFFFAOYSA-N 0 0 372.274 3.856 20 5 FHBDRN COc1ccc(NC(=O)COc2ccc([N+](=O)[O-])cc2C)cc1Cl ZINC000001284388 946052769 /nfs/dbraw/zinc/05/27/69/946052769.db2.gz UYIBXLRNXFEMOI-UHFFFAOYSA-N 0 0 350.758 3.583 20 5 FHBDRN Cc1ccc(NC(=O)c2csc(Nc3ccccn3)n2)cc1[N+](=O)[O-] ZINC000522884262 946054154 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353.422 3.704 20 5 FHBDRN O=[N+]([O-])c1cccc(OCCSc2nnc(C(F)(F)F)s2)c1 ZINC000188156036 946087309 /nfs/dbraw/zinc/08/73/09/946087309.db2.gz WSZKVKAKEADQGC-UHFFFAOYSA-N 0 0 351.331 3.636 20 5 FHBDRN COc1cccc([C@@H]2CCCN2C(=O)NCc2ccccc2[N+](=O)[O-])c1 ZINC000045621896 946094066 /nfs/dbraw/zinc/09/40/66/946094066.db2.gz ZNXBNUMKNLTAKH-KRWDZBQOSA-N 0 0 355.394 3.650 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1CCN(C)[C@H]1c1ccc(Cl)cc1 ZINC000248741938 946096709 /nfs/dbraw/zinc/09/67/09/946096709.db2.gz DNFHHLMQYQQKHP-QAPCUYQASA-N 0 0 373.840 3.732 20 5 FHBDRN C[C@@H]1CN(c2cc(Cl)ccc2[N+](=O)[O-])C[C@H]1NC(=O)OC(C)(C)C ZINC000804653990 946101271 /nfs/dbraw/zinc/10/12/71/946101271.db2.gz FEMPELDNMLDFLC-ZYHUDNBSSA-N 0 0 355.822 3.598 20 5 FHBDRN C[C@H](C(=O)N[C@@H]1CCO[C@H](c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000184416878 946121594 /nfs/dbraw/zinc/12/15/94/946121594.db2.gz CCUVWPGRASYASL-OHNRDTAOSA-N 0 0 372.396 3.874 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)NCc1cc2c(s1)CCCC2 ZINC000520100198 946122703 /nfs/dbraw/zinc/12/27/03/946122703.db2.gz JZWIWVDKWRBDKF-UHFFFAOYSA-N 0 0 369.446 3.806 20 5 FHBDRN CC1=CCN(C(=O)c2cc(F)cc3c(=O)c4cccc(F)c4[nH]c23)CC1 ZINC000444251737 946127936 /nfs/dbraw/zinc/12/79/36/946127936.db2.gz ZRQLHHLSXNQFGI-UHFFFAOYSA-N 0 0 354.356 3.752 20 5 FHBDRN Cc1ccc(NC(=O)c2cc(F)cc3c(=O)c4cccc(F)c4[nH]c23)cn1 ZINC000444254855 946133012 /nfs/dbraw/zinc/13/30/12/946133012.db2.gz VORTYZMNAQJAGD-UHFFFAOYSA-N 0 0 365.339 3.915 20 5 FHBDRN C[C@H](NC(=O)c1csc(Nc2ccccn2)n1)c1cccc([N+](=O)[O-])c1 ZINC000522936653 946135518 /nfs/dbraw/zinc/13/55/18/946135518.db2.gz VSXOFFQCDBZHER-NSHDSACASA-N 0 0 369.406 3.681 20 5 FHBDRN CCc1[nH]nc(C(=O)Nc2nc(C=Cc3ccccc3)cs2)c1[N+](=O)[O-] ZINC000444262994 946138317 /nfs/dbraw/zinc/13/83/17/946138317.db2.gz WQSSLPAFRAKTDK-HJWRWDBZSA-N 0 0 369.406 3.760 20 5 FHBDRN CCc1n[nH]c(C(=O)N(CC2CCC2)[C@@H](C)c2ccccc2)c1[N+](=O)[O-] ZINC000444260575 946142687 /nfs/dbraw/zinc/14/26/87/946142687.db2.gz OSNCIASTYYZZJQ-ZDUSSCGKSA-N 0 0 356.426 3.884 20 5 FHBDRN C[C@@H](C1CC1)n1cc(NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)cn1 ZINC000186447256 946143940 /nfs/dbraw/zinc/14/39/40/946143940.db2.gz KLOOTIOYKBIGIH-VIFPVBQESA-N 0 0 366.324 3.616 20 5 FHBDRN C[C@@H](OC(=O)c1ccc(Cl)cc1F)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000018807475 946155064 /nfs/dbraw/zinc/15/50/64/946155064.db2.gz YEPWNNKFMOKQBY-SECBINFHSA-N 0 0 366.732 3.571 20 5 FHBDRN CCN(CC(=O)Nc1cc([N+](=O)[O-])ccc1C)[C@@H](C)c1cccc(OC)c1 ZINC000045806109 946160443 /nfs/dbraw/zinc/16/04/43/946160443.db2.gz HNJJLWANGAHRME-HNNXBMFYSA-N 0 0 371.437 3.933 20 5 FHBDRN COc1ccc(Cl)c(NCc2nc(-c3cccc([N+](=O)[O-])c3)no2)c1 ZINC000109149602 946166662 /nfs/dbraw/zinc/16/66/62/946166662.db2.gz QZNRUOSMXLHWJN-UHFFFAOYSA-N 0 0 360.757 3.919 20 5 FHBDRN COc1cccc(CCCNC(=O)c2cccc(SC)c2[N+](=O)[O-])c1 ZINC000186450948 946172004 /nfs/dbraw/zinc/17/20/04/946172004.db2.gz BGBJEBAXVDYXCP-UHFFFAOYSA-N 0 0 360.435 3.688 20 5 FHBDRN C[C@@H](NC(=O)c1cccc2c(=O)c3cccc(F)c3[nH]c12)[C@H]1CCCCO1 ZINC000444284598 946173648 /nfs/dbraw/zinc/17/36/48/946173648.db2.gz HMUJAISFTGPMKZ-SJKOYZFVSA-N 0 0 368.408 3.508 20 5 FHBDRN COC(=O)c1cc(NC(=O)C[C@H](C)c2cccc(OC)c2)cc([N+](=O)[O-])c1 ZINC000439746487 946178783 /nfs/dbraw/zinc/17/87/83/946178783.db2.gz PZTDLBKUTKNIOX-LBPRGKRZSA-N 0 0 372.377 3.522 20 5 FHBDRN CC1(NC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)Cc2ccccc2C1 ZINC000444295331 946181646 /nfs/dbraw/zinc/18/16/46/946181646.db2.gz SFCYRFBJWAREKW-UHFFFAOYSA-N 0 0 368.436 3.969 20 5 FHBDRN O=C(c1cc(F)cc2c(=O)c3cccc(F)c3[nH]c12)N1CC[C@H](C2CC2)C1 ZINC000444298215 946184383 /nfs/dbraw/zinc/18/43/83/946184383.db2.gz MJCNJWICCXJWMB-LBPRGKRZSA-N 0 0 368.383 3.832 20 5 FHBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)N[C@@H]1CCCN(c2ccccc2F)C1 ZINC000536500722 946185556 /nfs/dbraw/zinc/18/55/56/946185556.db2.gz AZCWZBXPTPCRBI-CQSZACIVSA-N 0 0 358.373 3.524 20 5 FHBDRN CCc1cccc2c(CC(=O)Nc3ccc(OC)cc3[N+](=O)[O-])c[nH]c21 ZINC000109202797 946191390 /nfs/dbraw/zinc/19/13/90/946191390.db2.gz RFMZPEUFZAZCCG-UHFFFAOYSA-N 0 0 353.378 3.828 20 5 FHBDRN CC[C@@H](CSC)NC(=O)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000444293983 946194908 /nfs/dbraw/zinc/19/49/08/946194908.db2.gz VNZHXNDGJKZJFY-NSHDSACASA-N 0 0 358.438 3.692 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)N1CCOc2cc(Cl)c(Cl)cc21 ZINC000484640579 946219886 /nfs/dbraw/zinc/21/98/86/946219886.db2.gz NIYVBWOXFDHNRI-UHFFFAOYSA-N 0 0 368.176 3.644 20 5 FHBDRN CCCCN(CC(F)(F)F)C(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000109276050 946222140 /nfs/dbraw/zinc/22/21/40/946222140.db2.gz ZKPVWJDNHUWJKH-UHFFFAOYSA-N 0 0 370.331 3.585 20 5 FHBDRN C[C@H]1C[C@@H](N(C)Cc2cc([O-])ccc2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1 ZINC000093318021 946262128 /nfs/dbraw/zinc/26/21/28/946262128.db2.gz XELLHNLKQYUGMT-LPHOPBHVSA-N 0 0 369.465 3.785 20 5 FHBDRN CCCC[C@H](COC)NC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000522996411 946267101 /nfs/dbraw/zinc/26/71/01/946267101.db2.gz MJNDHGUKMPUMLY-MRXNPFEDSA-N 0 0 351.447 3.720 20 5 FHBDRN CCC(=O)c1ccc(OCC(=O)N2c3ccc([N+](=O)[O-])cc3C[C@@H]2C)cc1 ZINC000103377259 946268815 /nfs/dbraw/zinc/26/88/15/946268815.db2.gz CJGCMGFCKGQXKK-ZDUSSCGKSA-N 0 0 368.389 3.544 20 5 FHBDRN CC(C)(CNC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)c1cccc(Cl)c1 ZINC000109403762 946273469 /nfs/dbraw/zinc/27/34/69/946273469.db2.gz RRJLQQRZEGBPSO-UHFFFAOYSA-N 0 0 372.812 3.832 20 5 FHBDRN COc1c(C(=O)Nc2c(C)cccc2OC(F)F)cccc1[N+](=O)[O-] ZINC000475466590 946279906 /nfs/dbraw/zinc/27/99/06/946279906.db2.gz ZAMVWNZGKCIISU-UHFFFAOYSA-N 0 0 352.293 3.766 20 5 FHBDRN CC(C)Oc1ccc(NC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)cc1 ZINC000045993069 946280378 /nfs/dbraw/zinc/28/03/78/946280378.db2.gz HEGSJKHLKIQTPD-UHFFFAOYSA-N 0 0 366.377 3.820 20 5 FHBDRN COc1ccccc1CCN(C)C(=O)c1cccc(SC)c1[N+](=O)[O-] ZINC000186459930 946280683 /nfs/dbraw/zinc/28/06/83/946280683.db2.gz JSBHPGDZPDNRFJ-UHFFFAOYSA-N 0 0 360.435 3.640 20 5 FHBDRN COc1cc(CNC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)ccc1C ZINC000054282437 946281874 /nfs/dbraw/zinc/28/18/74/946281874.db2.gz CSVVCUDRVXEQHY-CYBMUJFWSA-N 0 0 360.435 3.709 20 5 FHBDRN COc1cccc([C@@H]2C[C@H]2NC(=O)c2c(C)cc(C)c([N+](=O)[O-])c2C)c1 ZINC000456533785 946283882 /nfs/dbraw/zinc/28/38/82/946283882.db2.gz NCYNRKIQFAPKMN-DLBZAZTESA-N 0 0 354.406 3.815 20 5 FHBDRN COc1ccccc1-c1nc(C(=O)NCc2ccccc2[N+](=O)[O-])cs1 ZINC000109450830 946288548 /nfs/dbraw/zinc/28/85/48/946288548.db2.gz YMRGBYPUJZWRFA-UHFFFAOYSA-N 0 0 369.402 3.657 20 5 FHBDRN Cc1ccc(NC(=O)Cc2noc(/C=C/c3cccc([N+](=O)[O-])c3)n2)cc1 ZINC000109442536 946289674 /nfs/dbraw/zinc/28/96/74/946289674.db2.gz XGFWWHRRVLWAMO-JXMROGBWSA-N 0 0 364.361 3.638 20 5 FHBDRN Cc1ccc2[nH]cc(CCC(=O)N3CCc4ccc([N+](=O)[O-])cc4C3)c2c1 ZINC000088231801 946291532 /nfs/dbraw/zinc/29/15/32/946291532.db2.gz CWPGPHMOFACSKR-UHFFFAOYSA-N 0 0 363.417 3.902 20 5 FHBDRN O=C(CCSc1ccccc1F)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088232069 946293203 /nfs/dbraw/zinc/29/32/03/946293203.db2.gz HSZPJXMXWYWJAM-UHFFFAOYSA-N 0 0 360.410 3.801 20 5 FHBDRN CC(C)c1cc(C(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)nn1C(C)(C)C ZINC000088230829 946294641 /nfs/dbraw/zinc/29/46/41/946294641.db2.gz RAIQKSCZAYDXPN-UHFFFAOYSA-N 0 0 370.453 3.868 20 5 FHBDRN CS[C@H]1CCC[C@@H](NC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000186017636 946296556 /nfs/dbraw/zinc/29/65/56/946296556.db2.gz GHSTYNWGFIHAJN-YPMHNXCESA-N 0 0 357.863 3.722 20 5 FHBDRN Cc1cc(C(=O)N[C@@H](c2ccc3c(c2)OCCO3)C2CC2)cc([N+](=O)[O-])c1 ZINC000148296710 946304254 /nfs/dbraw/zinc/30/42/54/946304254.db2.gz ZKVFCRNHMLYBPO-LJQANCHMSA-N 0 0 368.389 3.556 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1)CN(Cc1cnc(-c3ccccn3)s1)CC2 ZINC000093338430 946317168 /nfs/dbraw/zinc/31/71/68/946317168.db2.gz MSPWPTDLUHAVDR-UHFFFAOYSA-N 0 0 352.419 3.672 20 5 FHBDRN C[C@H](NC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2)c1cc2cccc(F)c2o1 ZINC000475079309 946326588 /nfs/dbraw/zinc/32/65/88/946326588.db2.gz PQWYXFZQPJERJM-VIFPVBQESA-N 0 0 372.308 3.700 20 5 FHBDRN COc1ccc(Cc2noc(-c3cc([N+](=O)[O-])c(C)s3)n2)cc1OC ZINC000109577993 946338704 /nfs/dbraw/zinc/33/87/04/946338704.db2.gz UBNFNWJFCQHCAX-UHFFFAOYSA-N 0 0 361.379 3.623 20 5 FHBDRN CCOc1ccc(C(=O)Nc2nc3c(cccc3Cl)n2C)cc1[N+](=O)[O-] ZINC000184423767 946351303 /nfs/dbraw/zinc/35/13/03/946351303.db2.gz IJQHMSCIBNJTIG-UHFFFAOYSA-N 0 0 374.784 3.786 20 5 FHBDRN CS(=O)(=O)c1cc([N+](=O)[O-])c(Oc2cccc3c2CCCC3)s1 ZINC000302152713 946361831 /nfs/dbraw/zinc/36/18/31/946361831.db2.gz ICECGVSKTWEBKK-UHFFFAOYSA-N 0 0 353.421 3.731 20 5 FHBDRN COc1cccc(C[C@@H](C)NC(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)c1 ZINC000541621594 946362659 /nfs/dbraw/zinc/36/26/59/946362659.db2.gz LRXAYZFKLQKELM-OLZOCXBDSA-N 0 0 360.385 3.593 20 5 FHBDRN O=C(CCCc1ncc(-c2ccccc2)o1)NCc1ccccc1[N+](=O)[O-] ZINC000046150062 946373866 /nfs/dbraw/zinc/37/38/66/946373866.db2.gz NLKXPQYTIJSDDU-UHFFFAOYSA-N 0 0 365.389 3.889 20 5 FHBDRN COC[C@@H]1CCCCN(C(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)C1 ZINC000444320162 946383751 /nfs/dbraw/zinc/38/37/51/946383751.db2.gz RGGYAGOKTDRWSO-OAHLLOKOSA-N 0 0 364.445 3.570 20 5 FHBDRN C[C@@H]1CC[C@H](NC(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000444320783 946388857 /nfs/dbraw/zinc/38/88/57/946388857.db2.gz RVCMIHPATURXGP-PWSUYJOCSA-N 0 0 359.348 3.720 20 5 FHBDRN COc1cc(-c2noc(CCCNc3ccc([N+](=O)[O-])cc3)n2)ccc1F ZINC000545697139 946411584 /nfs/dbraw/zinc/41/15/84/946411584.db2.gz RAVSLLQNVSCFGU-UHFFFAOYSA-N 0 0 372.356 3.837 20 5 FHBDRN Cn1ccc([C@@H](NC(=O)c2cccc([N+](=O)[O-])c2)c2ccc(Cl)cc2)n1 ZINC000546522553 946419224 /nfs/dbraw/zinc/41/92/24/946419224.db2.gz ZRUDGSSXXYVVED-KRWDZBQOSA-N 0 0 370.796 3.501 20 5 FHBDRN CC(=O)N(c1nnc(S[C@@H](C)c2cccc([N+](=O)[O-])c2)s1)C1CC1 ZINC000025772873 946435757 /nfs/dbraw/zinc/43/57/57/946435757.db2.gz XVXGNIMMFVJPCG-VIFPVBQESA-N 0 0 364.452 3.815 20 5 FHBDRN Cc1cc(C)cc(C[C@@H](C)NC(=O)c2cc([N+](=O)[O-])c(N(C)C)cc2F)c1 ZINC001126600547 946439025 /nfs/dbraw/zinc/43/90/25/946439025.db2.gz PMGLEUYGHLFNMY-CQSZACIVSA-N 0 0 373.428 3.778 20 5 FHBDRN CN(C(=O)CNc1ccccc1[N+](=O)[O-])[C@H]1CCC[C@@H]1c1ccccc1 ZINC001299178975 946441032 /nfs/dbraw/zinc/44/10/32/946441032.db2.gz LURJFVVRIFILSD-AEFFLSMTSA-N 0 0 353.422 3.801 20 5 FHBDRN CSc1cccc(C(=O)N(C)[C@H]2CCc3ccccc3C2)c1[N+](=O)[O-] ZINC000186510188 946441968 /nfs/dbraw/zinc/44/19/68/946441968.db2.gz CRKIRFDTLATTBG-HNNXBMFYSA-N 0 0 356.447 3.946 20 5 FHBDRN O=C(NCCc1cccs1)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000047864743 946445560 /nfs/dbraw/zinc/44/55/60/946445560.db2.gz SUEQVFAPVYHFQU-UHFFFAOYSA-N 0 0 357.338 3.622 20 5 FHBDRN O=c1[nH]c2ccccc2cc1CSCCOc1ccc([N+](=O)[O-])cc1 ZINC000111381177 946447159 /nfs/dbraw/zinc/44/71/59/946447159.db2.gz DFVRNILATLBKOO-UHFFFAOYSA-N 0 0 356.403 3.749 20 5 FHBDRN CCc1cccnc1-c1noc(-c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)n1 ZINC000545713259 946449671 /nfs/dbraw/zinc/44/96/71/946449671.db2.gz XQBOXPYLAYJYFZ-UHFFFAOYSA-N 0 0 363.333 3.523 20 5 FHBDRN COc1c(C(=O)Nc2ccccc2Br)cccc1[N+](=O)[O-] ZINC000137551653 946453285 /nfs/dbraw/zinc/45/32/85/946453285.db2.gz QDPJXQJCUBMFNY-UHFFFAOYSA-N 0 0 351.156 3.618 20 5 FHBDRN Cc1ccsc1[C@H]1C[C@@H]1C(=O)N=c1cc(-c2cccc([N+](=O)[O-])c2)[nH][nH]1 ZINC000440145074 946462647 /nfs/dbraw/zinc/46/26/47/946462647.db2.gz KUCJDBBWUGSHIR-KBPBESRZSA-N 0 0 368.418 3.519 20 5 FHBDRN Cc1c(CC(=O)Nc2ccc(Nc3ncccn3)cc2)cccc1[N+](=O)[O-] ZINC000444419064 946465119 /nfs/dbraw/zinc/46/51/19/946465119.db2.gz NCGXGXDBNJYYJH-UHFFFAOYSA-N 0 0 363.377 3.618 20 5 FHBDRN COc1ccc(CSCC(=O)N[C@H]2C[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000067514719 946494908 /nfs/dbraw/zinc/49/49/08/946494908.db2.gz ANFIELZWYJMIIV-HOTGVXAUSA-N 0 0 372.446 3.509 20 5 FHBDRN COc1cc(F)ccc1N1CCN([C@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000441382179 946505140 /nfs/dbraw/zinc/50/51/40/946505140.db2.gz NMFIPEWWMHEIBN-CQSZACIVSA-N 0 0 359.401 3.626 20 5 FHBDRN O=C(c1cc(F)cc([N+](=O)[O-])c1)N(Cc1ccccc1)CC1(O)CCCC1 ZINC000475505316 946506222 /nfs/dbraw/zinc/50/62/22/946506222.db2.gz XHBWKJFOLGLMSD-UHFFFAOYSA-N 0 0 372.396 3.681 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCCC(=O)NC[C@H]2C[C@@H]2c2ccccc2)c1 ZINC000111672218 946509741 /nfs/dbraw/zinc/50/97/41/946509741.db2.gz MNFUYWMNIJCFIG-IAGOWNOFSA-N 0 0 354.406 3.592 20 5 FHBDRN Cc1cc([C@@H](C)NC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)c(C)s1 ZINC000049675578 946530195 /nfs/dbraw/zinc/53/01/95/946530195.db2.gz QWHDKGHKWHGSEU-GFCCVEGCSA-N 0 0 370.434 3.950 20 5 FHBDRN Cc1cccc(C(=O)N2CCC(c3nc4ccccc4[nH]3)CC2)c1[N+](=O)[O-] ZINC000025831852 946538053 /nfs/dbraw/zinc/53/80/53/946538053.db2.gz CFTKOWWPTSPHQI-UHFFFAOYSA-N 0 0 364.405 3.799 20 5 FHBDRN C[C@@H](CNC(=O)N1CCC[C@@]2(CC2(F)F)C1)c1ccccc1[N+](=O)[O-] ZINC000897052146 946538072 /nfs/dbraw/zinc/53/80/72/946538072.db2.gz IZZMNCYLLUTUEP-BLLLJJGKSA-N 0 0 353.369 3.529 20 5 FHBDRN COc1cccc([C@H]2C[C@@H](C)CN2C(=O)COc2cccc([N+](=O)[O-])c2)c1 ZINC000544323078 946548960 /nfs/dbraw/zinc/54/89/60/946548960.db2.gz POWQDCSNMQURPN-AUUYWEPGSA-N 0 0 370.405 3.592 20 5 FHBDRN C[C@@H](CNC(=O)N1CC[C@@](C)(C(F)(F)F)C1)c1ccccc1[N+](=O)[O-] ZINC000897050244 946549163 /nfs/dbraw/zinc/54/91/63/946549163.db2.gz POPKUGYFNKCUPP-XHDPSFHLSA-N 0 0 359.348 3.682 20 5 FHBDRN C[C@H](CNC(=O)N[C@@H](c1ccncc1)C1CC1)c1ccccc1[N+](=O)[O-] ZINC000897050339 946549298 /nfs/dbraw/zinc/54/92/98/946549298.db2.gz NNFVUDIJRZNMLC-FZKQIMNGSA-N 0 0 354.410 3.544 20 5 FHBDRN C[C@@H](CNC(=O)N1CC[C@](C)(C(F)(F)F)C1)c1ccccc1[N+](=O)[O-] ZINC000897050243 946549335 /nfs/dbraw/zinc/54/93/35/946549335.db2.gz POPKUGYFNKCUPP-NHYWBVRUSA-N 0 0 359.348 3.682 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)N[C@H]2CCO[C@@H]2c2ccncc2)cc1[N+](=O)[O-] ZINC000614757687 946555253 /nfs/dbraw/zinc/55/52/53/946555253.db2.gz WKCVLSLCHUVSRK-FUHWJXTLSA-N 0 0 369.421 3.547 20 5 FHBDRN COc1cc(C(=O)N(CC(C)C)CC(C)(C)C)cc([N+](=O)[O-])c1OC ZINC000475172969 946561773 /nfs/dbraw/zinc/56/17/73/946561773.db2.gz JSDAYEVTVUWOQZ-UHFFFAOYSA-N 0 0 352.431 3.756 20 5 FHBDRN C[C@@H](CNC(=O)N(C)Cc1cc(Cl)cn1C)c1ccccc1[N+](=O)[O-] ZINC000897067836 946562235 /nfs/dbraw/zinc/56/22/35/946562235.db2.gz OJWNFYKPHDFIEW-LBPRGKRZSA-N 0 0 364.833 3.532 20 5 FHBDRN Cc1c(CS(=O)(=O)Cc2csc(C(C)C)n2)cccc1[N+](=O)[O-] ZINC000048278537 946565073 /nfs/dbraw/zinc/56/50/73/946565073.db2.gz FTASINXTDVLOQH-UHFFFAOYSA-N 0 0 354.453 3.598 20 5 FHBDRN C[C@@H]1CN(Cc2ccccc2NCc2ccccc2[N+](=O)[O-])C[C@H](C)O1 ZINC000475174158 946564931 /nfs/dbraw/zinc/56/49/31/946564931.db2.gz MYDXGTMIFFTKEK-IYBDPMFKSA-N 0 0 355.438 3.816 20 5 FHBDRN O=C(Nc1ccccc1OCC(F)F)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000475517375 946567164 /nfs/dbraw/zinc/56/71/64/946567164.db2.gz SYZNURMYFDLFIR-UHFFFAOYSA-N 0 0 361.304 3.972 20 5 FHBDRN CN1CCc2c(N[C@@H]3C[C@H]3c3ccc(F)c(F)c3)ccc([N+](=O)[O-])c2C1 ZINC001168069788 946573737 /nfs/dbraw/zinc/57/37/37/946573737.db2.gz IXYQWBPIKOMZFM-SCLBCKFNSA-N 0 0 359.376 3.829 20 5 FHBDRN Cc1c(C(=O)N2CCC3(CC2)OCCc2ccsc23)cccc1[N+](=O)[O-] ZINC000487489851 946586417 /nfs/dbraw/zinc/58/64/17/946586417.db2.gz YJHFBUABUQHYPS-UHFFFAOYSA-N 0 0 372.446 3.669 20 5 FHBDRN Cc1cccc2cc(C(=O)N3CCN(c4ccccc4[N+](=O)[O-])CC3)oc21 ZINC000148334621 946588789 /nfs/dbraw/zinc/58/87/89/946588789.db2.gz WMNDFWIUCDYFRS-UHFFFAOYSA-N 0 0 365.389 3.612 20 5 FHBDRN COc1ccc(Cl)cc1CCNC(=O)[C@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1 ZINC001126141824 946595800 /nfs/dbraw/zinc/59/58/00/946595800.db2.gz QAYMWRNJWHFDPD-SJORKVTESA-N 0 0 374.824 3.719 20 5 FHBDRN O=C(c1ccc([N+](=O)[O-])s1)N1CCCCC[C@@H]1[C@H]1CCCCC1=O ZINC000164514455 946608285 /nfs/dbraw/zinc/60/82/85/946608285.db2.gz XNCZAIMQOWWWLA-CHWSQXEVSA-N 0 0 350.440 3.800 20 5 FHBDRN C[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccccc1-n1cccn1 ZINC000121384373 946610084 /nfs/dbraw/zinc/61/00/84/946610084.db2.gz GUMSCRIWWIJGFB-LBPRGKRZSA-N 0 0 370.796 3.925 20 5 FHBDRN C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)CCc1ccc(N(C)C)cc1 ZINC000728810802 946610162 /nfs/dbraw/zinc/61/01/62/946610162.db2.gz DLNFHMRMIHNJCW-CQSZACIVSA-N 0 0 353.422 3.571 20 5 FHBDRN COc1ccc(CNC(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)c(OC)c1 ZINC000475549142 946619321 /nfs/dbraw/zinc/61/93/21/946619321.db2.gz DLMQVNNHHWWSOR-UHFFFAOYSA-N 0 0 359.382 3.551 20 5 FHBDRN O=C(N[C@H](c1ccccc1)C1(CO)CCCC1)c1cc(F)cc([N+](=O)[O-])c1 ZINC001143517743 946620789 /nfs/dbraw/zinc/62/07/89/946620789.db2.gz WGIDXZWPJFWKAW-GOSISDBHSA-N 0 0 372.396 3.758 20 5 FHBDRN O=C(CC[S@](=O)c1ccc(F)c(Cl)c1)Nc1ccccc1[N+](=O)[O-] ZINC000507740936 946620827 /nfs/dbraw/zinc/62/08/27/946620827.db2.gz JNQBPWZDEIHMPE-DEOSSOPVSA-N 0 0 370.789 3.524 20 5 FHBDRN COc1ccc(CNC(=S)Nc2ccc(Cl)c([N+](=O)[O-])c2)cc1 ZINC000007521346 946625213 /nfs/dbraw/zinc/62/52/13/946625213.db2.gz NPEWXIFTEODFRN-UHFFFAOYSA-N 0 0 351.815 3.743 20 5 FHBDRN CN(C)C(=O)Cc1ccc(Nc2ccc3ncccc3c2[N+](=O)[O-])cc1 ZINC000112074842 946656600 /nfs/dbraw/zinc/65/66/00/946656600.db2.gz NWHYMEJWEYNPFX-UHFFFAOYSA-N 0 0 350.378 3.517 20 5 FHBDRN Cc1cc(Cc2noc(-c3ccc4c(c3)OCCCO4)n2)ccc1[N+](=O)[O-] ZINC000545854678 946674441 /nfs/dbraw/zinc/67/44/41/946674441.db2.gz MLFNFPHEDQGDNR-UHFFFAOYSA-N 0 0 367.361 3.705 20 5 FHBDRN O=[N+]([O-])c1ccc2c(ccn2Cc2nc([C@H]3CCOC4(CCC4)C3)no2)c1 ZINC000897103422 946682661 /nfs/dbraw/zinc/68/26/61/946682661.db2.gz IRQVALGFLFEQEJ-AWEZNQCLSA-N 0 0 368.393 3.798 20 5 FHBDRN CN(Cc1cccc(Cl)c1)C(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000015990118 946685003 /nfs/dbraw/zinc/68/50/03/946685003.db2.gz POOKRPDXJWUZER-UHFFFAOYSA-N 0 0 350.827 3.999 20 5 FHBDRN O=C(c1c[nH]cc1-c1ccc(F)cc1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088349532 946685158 /nfs/dbraw/zinc/68/51/58/946685158.db2.gz BVNCSMNORFZYHS-UHFFFAOYSA-N 0 0 365.364 3.928 20 5 FHBDRN Cc1c(NC(=O)NC[C@H](O)c2ccc3ccccc3c2)cccc1[N+](=O)[O-] ZINC000067536923 946692456 /nfs/dbraw/zinc/69/24/56/946692456.db2.gz YFHCAGMWDLZYHE-IBGZPJMESA-N 0 0 365.389 3.912 20 5 FHBDRN CSc1ccc(C(=O)N[C@@H]2CCCc3cc(N)ccc32)cc1[N+](=O)[O-] ZINC000186611008 946701386 /nfs/dbraw/zinc/70/13/86/946701386.db2.gz USESTDVARXKUMT-OAHLLOKOSA-N 0 0 357.435 3.706 20 5 FHBDRN CC(C)(C)c1ccc(C(=O)N2CC[C@H](c3nccs3)C2)cc1[N+](=O)[O-] ZINC000893523186 946715559 /nfs/dbraw/zinc/71/55/59/946715559.db2.gz IYOSKFVJFGAFSB-ZDUSSCGKSA-N 0 0 359.451 3.979 20 5 FHBDRN CCOC(=O)CCCCCOc1ccc([N+](=O)[O-])cc1Br ZINC000609961853 946727379 /nfs/dbraw/zinc/72/73/79/946727379.db2.gz NGZICPABCZDTFK-UHFFFAOYSA-N 0 0 360.204 3.860 20 5 FHBDRN Cc1c(C(=O)Nc2ccc([N+](=O)[O-])cc2)cnn1-c1ccccc1Cl ZINC000112164282 946734705 /nfs/dbraw/zinc/73/47/05/946734705.db2.gz DZNKLWLKRAZLBW-UHFFFAOYSA-N 0 0 356.769 3.995 20 5 FHBDRN COc1cc(OC)c(NC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)cc1F ZINC000088402669 946748701 /nfs/dbraw/zinc/74/87/01/946748701.db2.gz HBQQJXGAQHBBDQ-SNVBAGLBSA-N 0 0 363.345 3.634 20 5 FHBDRN C[C@@H](N[C@@H](C)c1ncc(Br)cn1)c1cccc([N+](=O)[O-])c1 ZINC000579261129 946755017 /nfs/dbraw/zinc/75/50/17/946755017.db2.gz ZQOUASLMVCGFIK-ZJUUUORDSA-N 0 0 351.204 3.559 20 5 FHBDRN Cc1nn(CCC(=O)N[C@H](c2ccccc2C)C(C)C)c(C)c1[N+](=O)[O-] ZINC000112190362 946758449 /nfs/dbraw/zinc/75/84/49/946758449.db2.gz USGSINRDKXXGOP-SFHVURJKSA-N 0 0 358.442 3.620 20 5 FHBDRN COc1c(C(=O)Nc2cc(C)nn2-c2ccccc2C)cccc1[N+](=O)[O-] ZINC000475586465 946761115 /nfs/dbraw/zinc/76/11/15/946761115.db2.gz UCFXCAWPOTVOAD-UHFFFAOYSA-N 0 0 366.377 3.658 20 5 FHBDRN CCc1n[nH]c(C(=O)N[C@@H](CC2CCCC2)c2ccccc2)c1[N+](=O)[O-] ZINC000444334699 946766502 /nfs/dbraw/zinc/76/65/02/946766502.db2.gz IEMYFBXCTFZYPS-INIZCTEOSA-N 0 0 356.426 3.932 20 5 FHBDRN COc1ccc2c(CC(=O)N3Cc4ccc([N+](=O)[O-])cc4C3)coc2c1C ZINC001126611217 946767596 /nfs/dbraw/zinc/76/75/96/946767596.db2.gz HEAFGSMNRJGPNQ-UHFFFAOYSA-N 0 0 366.373 3.743 20 5 FHBDRN CCOC(=O)c1ccnc(N[C@@H](Cc2ccccc2)C2CC2)c1[N+](=O)[O-] ZINC000523111216 946774850 /nfs/dbraw/zinc/77/48/50/946774850.db2.gz FVADHIBCOCAPHN-INIZCTEOSA-N 0 0 355.394 3.600 20 5 FHBDRN COCCN(CCc1ccccc1)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000519905768 946775225 /nfs/dbraw/zinc/77/52/25/946775225.db2.gz ICHVSGRIFHZKKG-UHFFFAOYSA-N 0 0 357.410 3.626 20 5 FHBDRN CCCc1[nH]nc(C(=O)Nc2cccc(Oc3ccncc3)c2)c1[N+](=O)[O-] ZINC000112206320 946781252 /nfs/dbraw/zinc/78/12/52/946781252.db2.gz IRRLFDJUFFNPPT-UHFFFAOYSA-N 0 0 367.365 3.710 20 5 FHBDRN CC1CCN(c2ccc(C(=O)N3Cc4ccc([N+](=O)[O-])cc4C3)cc2)CC1 ZINC001126613469 946812717 /nfs/dbraw/zinc/81/27/17/946812717.db2.gz WCAMMQFVNVUYAH-UHFFFAOYSA-N 0 0 365.433 3.987 20 5 FHBDRN C[C@@H]1[C@@H](C(F)(F)F)CCN1Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000475279851 946816257 /nfs/dbraw/zinc/81/62/57/946816257.db2.gz OQXSRJZHNBYDLE-KCJUWKMLSA-N 0 0 354.275 3.969 20 5 FHBDRN Cc1ncc([N+](=O)[O-])n1CC(=O)Nc1ccccc1Oc1ccccc1 ZINC000026102592 946824877 /nfs/dbraw/zinc/82/48/77/946824877.db2.gz YSDZJLAKEAROKH-UHFFFAOYSA-N 0 0 352.350 3.531 20 5 FHBDRN CC(C)[C@@H](c1ccccc1Cl)N(C)C(=O)CCn1cc([N+](=O)[O-])cn1 ZINC000113076597 946827143 /nfs/dbraw/zinc/82/71/43/946827143.db2.gz FSUKXYVVYITBKJ-KRWDZBQOSA-N 0 0 364.833 3.691 20 5 FHBDRN CCN(C(=O)CCOc1ccccc1[N+](=O)[O-])[C@@H](C)Cc1ccsc1 ZINC000186304091 946829366 /nfs/dbraw/zinc/82/93/66/946829366.db2.gz PLNVHXOTLKISRE-AWEZNQCLSA-N 0 0 362.451 3.905 20 5 FHBDRN C/C=C/C[C@H](CO)NC(=O)c1cc([N+](=O)[O-])ccc1SC1CCCC1 ZINC000613847716 946831766 /nfs/dbraw/zinc/83/17/66/946831766.db2.gz BLWSAVBJSXRYCX-YWVDXFKGSA-N 0 0 364.467 3.686 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1)N1CCC[C@@H]1C[C@@H](O)c1ccc(F)cc1 ZINC000162818631 946835772 /nfs/dbraw/zinc/83/57/72/946835772.db2.gz KFJQVRCMVMKSQO-SJLPKXTDSA-N 0 0 373.384 3.854 20 5 FHBDRN C[C@@H](NC(=O)NCCCOc1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000063799714 946838748 /nfs/dbraw/zinc/83/87/48/946838748.db2.gz HJAYFZUFGMCBJL-CYBMUJFWSA-N 0 0 361.373 3.563 20 5 FHBDRN Cc1cc2cc[nH]c2cc1NC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000444448840 946849267 /nfs/dbraw/zinc/84/92/67/946849267.db2.gz OUGYDWJPWWJWRT-UHFFFAOYSA-N 0 0 361.361 3.823 20 5 FHBDRN CC[C@@H](C)c1ccccc1OCC(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000536278119 946867812 /nfs/dbraw/zinc/86/78/12/946867812.db2.gz ANIRFYYSQMQHPT-OAHLLOKOSA-N 0 0 356.422 3.846 20 5 FHBDRN COc1cc(C(=O)N2Cc3ccccc3C(C)(C)C2)cc([N+](=O)[O-])c1OC ZINC000536278134 946868331 /nfs/dbraw/zinc/86/83/31/946868331.db2.gz BFVZNKMNHNYSCO-UHFFFAOYSA-N 0 0 370.405 3.546 20 5 FHBDRN COc1c(C(=O)Nc2ccccc2NCC(F)(F)F)cccc1[N+](=O)[O-] ZINC000475312855 946872416 /nfs/dbraw/zinc/87/24/16/946872416.db2.gz MHKJIQMWSQSVCD-UHFFFAOYSA-N 0 0 369.299 3.830 20 5 FHBDRN O=C(c1ccccc1[N+](=O)[O-])N1CCO[C@@H](c2ccc(F)cc2Cl)C1 ZINC000186316269 946876749 /nfs/dbraw/zinc/87/67/49/946876749.db2.gz GMNWTKQBSJUUKO-MRXNPFEDSA-N 0 0 364.760 3.601 20 5 FHBDRN CC(C)(C)c1ncsc1C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186317235 946879048 /nfs/dbraw/zinc/87/90/48/946879048.db2.gz JQYNXMVUZYYHHT-UHFFFAOYSA-N 0 0 353.831 3.932 20 5 FHBDRN CCc1ccc([C@H](C)CC(=O)NCCNc2ccccc2[N+](=O)[O-])cc1 ZINC000523127054 946885750 /nfs/dbraw/zinc/88/57/50/946885750.db2.gz JACZCDLQJJGEJZ-OAHLLOKOSA-N 0 0 355.438 3.879 20 5 FHBDRN CCOc1ccc(F)c(NC(=O)c2cc([N+](=O)[O-])ccc2OC)c1F ZINC000536279503 946886331 /nfs/dbraw/zinc/88/63/31/946886331.db2.gz FYLLJZRWIVVICI-UHFFFAOYSA-N 0 0 352.293 3.533 20 5 FHBDRN Cc1ccc([C@@H]2CCCCCN2C(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)o1 ZINC000523136604 946888203 /nfs/dbraw/zinc/88/82/03/946888203.db2.gz YSLDZNJLBXFSGN-AWEZNQCLSA-N 0 0 372.377 3.982 20 5 FHBDRN O=C(COc1ccccc1C(F)(F)F)N1CCc2c1cccc2[N+](=O)[O-] ZINC000523132427 946899487 /nfs/dbraw/zinc/89/94/87/946899487.db2.gz YRTBFSPRRDKCAV-UHFFFAOYSA-N 0 0 366.295 3.582 20 5 FHBDRN CCc1cc(C(=O)NCc2cccc([N+](=O)[O-])c2)ccc1Br ZINC001126173282 946901169 /nfs/dbraw/zinc/90/11/69/946901169.db2.gz XHWKHXCOZZPKGE-UHFFFAOYSA-N 0 0 363.211 3.850 20 5 FHBDRN CC(C)(C)c1ncc(COC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])s1 ZINC000785411199 946902648 /nfs/dbraw/zinc/90/26/48/946902648.db2.gz NFLKPPWIQJXUEX-UHFFFAOYSA-N 0 0 356.350 3.984 20 5 FHBDRN COc1cccc([C@H]2C[C@@H](C)CN2C(=O)c2cc([N+](=O)[O-])cnc2C)c1 ZINC000544323744 946906855 /nfs/dbraw/zinc/90/68/55/946906855.db2.gz ZKTFRKCDRVCUHW-KZULUSFZSA-N 0 0 355.394 3.530 20 5 FHBDRN O=C(Nc1ccncc1Br)c1cc([N+](=O)[O-])ccc1Cl ZINC000147520333 946907778 /nfs/dbraw/zinc/90/77/78/946907778.db2.gz QURPTJSYVSTFEA-UHFFFAOYSA-N 0 0 356.563 3.658 20 5 FHBDRN Cc1cc([N+](=O)[O-])cnc1N1CCC([C@H](O)c2ccc(Cl)cc2)CC1 ZINC000067373839 946912602 /nfs/dbraw/zinc/91/26/02/946912602.db2.gz ZVMLDSPMMDGLFW-QGZVFWFLSA-N 0 0 361.829 3.902 20 5 FHBDRN Cc1c(Oc2ncc(Br)cc2[N+](=O)[O-])cccc1[N+](=O)[O-] ZINC000048760169 946916638 /nfs/dbraw/zinc/91/66/38/946916638.db2.gz GBMQUCOPSVZCNU-UHFFFAOYSA-N 0 0 354.116 3.761 20 5 FHBDRN COc1cc(C(=O)Nc2cc(C)ccc2Br)ccc1[N+](=O)[O-] ZINC000121269188 946918849 /nfs/dbraw/zinc/91/88/49/946918849.db2.gz QAUQVQGHGGSETH-UHFFFAOYSA-N 0 0 365.183 3.927 20 5 FHBDRN CCOC(=O)c1cc(C(=O)N(C)Cc2ccc(CC)cc2)cc([N+](=O)[O-])c1 ZINC000024634105 946920188 /nfs/dbraw/zinc/92/01/88/946920188.db2.gz KNJBOVQMSWSKHV-UHFFFAOYSA-N 0 0 370.405 3.606 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@H]1C[C@@]12CCc1ccccc12 ZINC000186327276 946923362 /nfs/dbraw/zinc/92/33/62/946923362.db2.gz GPECHDWADMMHBC-VQIMIIECSA-N 0 0 356.809 3.769 20 5 FHBDRN O=[N+]([O-])c1c(NCc2cccc(Br)c2)nc2sccn21 ZINC000048819029 946929573 /nfs/dbraw/zinc/92/95/73/946929573.db2.gz SKEPNDDLPZUALW-UHFFFAOYSA-N 0 0 353.201 3.679 20 5 FHBDRN CC1(C)CCCN(C(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])C1 ZINC000112684658 946929675 /nfs/dbraw/zinc/92/96/75/946929675.db2.gz DAGQDWIHIHNDQY-UHFFFAOYSA-N 0 0 360.332 3.798 20 5 FHBDRN CC(C)COC1CCN(C(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)CC1 ZINC000079203615 946931256 /nfs/dbraw/zinc/93/12/56/946931256.db2.gz NCRYQJLZRWJQLQ-CQSZACIVSA-N 0 0 366.483 3.739 20 5 FHBDRN CC(C)COC1CCN(C(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)CC1 ZINC000079203620 946931332 /nfs/dbraw/zinc/93/13/32/946931332.db2.gz NCRYQJLZRWJQLQ-AWEZNQCLSA-N 0 0 366.483 3.739 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)N[C@@H]1CCCc2c(F)cccc21 ZINC000458891775 946945232 /nfs/dbraw/zinc/94/52/32/946945232.db2.gz VQZRUKKPSVSLQZ-LJQANCHMSA-N 0 0 371.412 3.995 20 5 FHBDRN COc1cccc(Cl)c1CC(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186335725 946948725 /nfs/dbraw/zinc/94/87/25/946948725.db2.gz DUJOPMJYNDRXES-UHFFFAOYSA-N 0 0 369.204 3.769 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N1CCCO[C@H](c2ccccc2)C1 ZINC000609785810 946952757 /nfs/dbraw/zinc/95/27/57/946952757.db2.gz VMHRLSISQJHSDU-SFHVURJKSA-N 0 0 374.824 3.781 20 5 FHBDRN Cn1nc(C2CC2)cc1CNCc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000897224165 946954110 /nfs/dbraw/zinc/95/41/10/946954110.db2.gz JBHRAZPZPJBKDF-UHFFFAOYSA-N 0 0 354.332 3.514 20 5 FHBDRN O=[N+]([O-])c1cc(Br)cnc1N1CCC[C@H](C(F)(F)F)C1 ZINC000088437480 946955995 /nfs/dbraw/zinc/95/59/95/946955995.db2.gz FUMJRQVMTNIIOH-ZETCQYMHSA-N 0 0 354.126 3.531 20 5 FHBDRN COc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CC[C@@H](C)C[C@H]2C)cc1SC ZINC000112833740 946958086 /nfs/dbraw/zinc/95/80/86/946958086.db2.gz CUPXFTICYJAYFK-NQBHXWOUSA-N 0 0 352.456 3.880 20 5 FHBDRN COc1ccc([C@H](NC(=O)c2ccc([N+](=O)[O-])cc2)C(F)(F)F)cc1 ZINC000182625021 946958883 /nfs/dbraw/zinc/95/88/83/946958883.db2.gz FDVBJXVKLYSCMY-AWEZNQCLSA-N 0 0 354.284 3.637 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCCN(C(=O)c2ccccc2)CC1 ZINC000182624665 946959009 /nfs/dbraw/zinc/95/90/09/946959009.db2.gz DMRMUHFJHNSKRD-KRWDZBQOSA-N 0 0 367.449 3.812 20 5 FHBDRN O=[N+]([O-])c1ccc(S(=O)(=O)[N-]c2ccc3[nH]ccc3c2)c(Cl)c1 ZINC000112850693 946973695 /nfs/dbraw/zinc/97/36/95/946973695.db2.gz KRIIIKIHFYIRAV-UHFFFAOYSA-N 0 0 351.771 3.530 20 5 FHBDRN Cn1nc(CNCc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1C1CC1 ZINC000897230377 946974952 /nfs/dbraw/zinc/97/49/52/946974952.db2.gz KQOGDRZSALCMIT-UHFFFAOYSA-N 0 0 354.332 3.514 20 5 FHBDRN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)NCc1ccc(C2CC2)cc1 ZINC000511917600 946977217 /nfs/dbraw/zinc/97/72/17/946977217.db2.gz JBCLJHUVAWDUHD-UHFFFAOYSA-N 0 0 353.422 3.856 20 5 FHBDRN CC(C)(C)c1ccc(CNC(=O)NCCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000523203655 946987856 /nfs/dbraw/zinc/98/78/56/946987856.db2.gz IELKXSHFEBAWKW-UHFFFAOYSA-N 0 0 355.438 3.934 20 5 FHBDRN COc1ccc(CNC(=O)N[C@@H]2C[C@H](C)CC[C@H]2C(C)C)cc1[N+](=O)[O-] ZINC000523204777 946988949 /nfs/dbraw/zinc/98/89/49/946988949.db2.gz XUWDWTZDLIXSBI-VNQPRFMTSA-N 0 0 363.458 3.863 20 5 FHBDRN COc1cccc(NC[C@H](c2c(F)cccc2F)N(C)C)c1[N+](=O)[O-] ZINC000475385428 946995483 /nfs/dbraw/zinc/99/54/83/946995483.db2.gz AUIRVWKOGPIVDY-CQSZACIVSA-N 0 0 351.353 3.596 20 5 FHBDRN C[C@@H](OCCCNC(=O)CSc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000025967760 946998082 /nfs/dbraw/zinc/99/80/82/946998082.db2.gz VQBBZUPJVOBEBQ-OAHLLOKOSA-N 0 0 374.462 3.971 20 5 FHBDRN Cc1ccc2c(c1)CC[C@H]2NS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000511923602 947007568 /nfs/dbraw/zinc/00/75/68/947007568.db2.gz QQKGOLISHULGAV-CQSZACIVSA-N 0 0 366.826 3.522 20 5 FHBDRN C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCS[C@@H](c2ccccc2)C1 ZINC000609800704 947007992 /nfs/dbraw/zinc/00/79/92/947007992.db2.gz QLQCFMRNEJCEDA-RDTXWAMCSA-N 0 0 371.462 3.712 20 5 FHBDRN CC(C)(C)OC1CC(CCNC(=O)CSc2ccccc2[N+](=O)[O-])C1 ZINC000432262461 947014911 /nfs/dbraw/zinc/01/49/11/947014911.db2.gz BARASQYQTBRFPT-UHFFFAOYSA-N 0 0 366.483 3.787 20 5 FHBDRN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)c1sccc1OC(F)F ZINC000186348070 947023969 /nfs/dbraw/zinc/02/39/69/947023969.db2.gz ZUQMGJXIXBBOSP-UHFFFAOYSA-N 0 0 362.741 3.841 20 5 FHBDRN CO[C@@H](C)c1nc(C)c(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)s1 ZINC000186353693 947030329 /nfs/dbraw/zinc/03/03/29/947030329.db2.gz XCFHEJCDYSSPIY-VIFPVBQESA-N 0 0 369.830 3.651 20 5 FHBDRN COc1ccccc1[C@@H]1CCCN1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444606805 947032509 /nfs/dbraw/zinc/03/25/09/947032509.db2.gz HFRWGTXGUOBIDG-KRWDZBQOSA-N 0 0 352.394 3.817 20 5 FHBDRN CCOCc1cccc(NC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)c1 ZINC000523259534 947038274 /nfs/dbraw/zinc/03/82/74/947038274.db2.gz KMKWRMBTVHAUKA-UHFFFAOYSA-N 0 0 366.377 3.569 20 5 FHBDRN C[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2Br)CC1(C)C ZINC000546133452 947041192 /nfs/dbraw/zinc/04/11/92/947041192.db2.gz CSJOJIIFTUUWNT-SNVBAGLBSA-N 0 0 355.232 3.866 20 5 FHBDRN Cc1ccc(C(=O)N(C)[C@H]2CCC[N@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000074445748 947068028 /nfs/dbraw/zinc/06/80/28/947068028.db2.gz HUJHRCNQSSTSPJ-IBGZPJMESA-N 0 0 367.449 3.640 20 5 FHBDRN CCOc1ccc(NC(=O)CSc2ccc(OC)cc2)c([N+](=O)[O-])c1 ZINC000021117368 947075212 /nfs/dbraw/zinc/07/52/12/947075212.db2.gz GHEPOZMEEQDHDF-UHFFFAOYSA-N 0 0 362.407 3.733 20 5 FHBDRN CC(C)(CCC(=O)N[C@H]1CCC[C@@H](c2nc3ccccc3[nH]2)C1)[N+](=O)[O-] ZINC000843683576 947079140 /nfs/dbraw/zinc/07/91/40/947079140.db2.gz AAKPSTWBXTXAFR-KGLIPLIRSA-N 0 0 358.442 3.541 20 5 FHBDRN CC(C)(CCC(=O)N[C@H]1CCC[C@H](c2nc3ccccc3[nH]2)C1)[N+](=O)[O-] ZINC000843683571 947079288 /nfs/dbraw/zinc/07/92/88/947079288.db2.gz AAKPSTWBXTXAFR-KBPBESRZSA-N 0 0 358.442 3.541 20 5 FHBDRN COC(=O)[C@H](NC/C=C/c1ccccc1[N+](=O)[O-])c1ccc(C)c(C)c1 ZINC000428373228 947079476 /nfs/dbraw/zinc/07/94/76/947079476.db2.gz NOPLHWFEFNMMPT-ZLQZBKBYSA-N 0 0 354.406 3.729 20 5 FHBDRN O=C(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@@H]1C[C@H]1c1ccccc1Cl ZINC000444639208 947081486 /nfs/dbraw/zinc/08/14/86/947081486.db2.gz YHVUHSAYXLKCHF-QWHCGFSZSA-N 0 0 370.796 3.544 20 5 FHBDRN O=C(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1occc1-c1ccccc1 ZINC000444644825 947087179 /nfs/dbraw/zinc/08/71/79/947087179.db2.gz NYTHZXVBUZTOLC-UHFFFAOYSA-N 0 0 362.345 3.661 20 5 FHBDRN Cc1ccc(NC(=O)COCc2nc3ccccc3s2)cc1[N+](=O)[O-] ZINC000020893719 947099314 /nfs/dbraw/zinc/09/93/14/947099314.db2.gz KXCZSLFKQKNXQO-UHFFFAOYSA-N 0 0 357.391 3.668 20 5 FHBDRN Cc1ccc(NC(=O)c2cc(Cl)c3c(c2)OCCCO3)cc1[N+](=O)[O-] ZINC000020893620 947099726 /nfs/dbraw/zinc/09/97/26/947099726.db2.gz NDZFZZZIBMJPGP-UHFFFAOYSA-N 0 0 362.769 3.970 20 5 FHBDRN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC[C@@H]1c1c(C)n[nH]c1C ZINC000282001693 947100517 /nfs/dbraw/zinc/10/05/17/947100517.db2.gz QMDKTUWTOBBLKH-OAHLLOKOSA-N 0 0 373.413 3.702 20 5 FHBDRN CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)Cc1c[nH]c2ccccc12 ZINC000054259754 947103425 /nfs/dbraw/zinc/10/34/25/947103425.db2.gz BPSAPQAIAPUZRC-UHFFFAOYSA-N 0 0 357.797 3.931 20 5 FHBDRN Cc1nc(-c2ccc([C@H](C)NC(=O)c3cc([N+](=O)[O-])cn3C)cc2)cs1 ZINC000029105024 947107242 /nfs/dbraw/zinc/10/72/42/947107242.db2.gz KDUDSDDOWKJRNT-NSHDSACASA-N 0 0 370.434 3.856 20 5 FHBDRN CCCc1ccccc1NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000049683168 947110414 /nfs/dbraw/zinc/11/04/14/947110414.db2.gz IVKHLNKKWGUEEB-UHFFFAOYSA-N 0 0 350.378 3.985 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)Nc1ccc(OC(F)F)c2cccnc12 ZINC000186389506 947132228 /nfs/dbraw/zinc/13/22/28/947132228.db2.gz UFHLIYQWFSYMBU-UHFFFAOYSA-N 0 0 374.303 3.700 20 5 FHBDRN C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N(C)Cc1cc(Cl)ccc1F ZINC000444706758 947133760 /nfs/dbraw/zinc/13/37/60/947133760.db2.gz MVADTJWVLAPEHE-NSHDSACASA-N 0 0 365.792 3.846 20 5 FHBDRN Cc1ccc(CN(C)C(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)o1 ZINC000511953962 947150057 /nfs/dbraw/zinc/15/00/57/947150057.db2.gz RNFFJQRVEMLHCT-UHFFFAOYSA-N 0 0 371.315 3.857 20 5 FHBDRN CCCN(C(=O)CCCNC(=O)[C@H]1CC=CCC1)c1cccc([N+](=O)[O-])c1 ZINC000441432013 947157635 /nfs/dbraw/zinc/15/76/35/947157635.db2.gz FDKGCBFDEDGAEO-INIZCTEOSA-N 0 0 373.453 3.591 20 5 FHBDRN O=[N+]([O-])c1ccc(S(=O)(=O)N2CC3(CCC3)[C@H]2c2ccccc2)s1 ZINC000432299411 947175295 /nfs/dbraw/zinc/17/52/95/947175295.db2.gz DOWZLQYFIHQLNL-OAHLLOKOSA-N 0 0 364.448 3.572 20 5 FHBDRN CN(Cc1ccc(C(F)(F)F)cc1)C(=O)COc1ccccc1[N+](=O)[O-] ZINC000049940698 947183796 /nfs/dbraw/zinc/18/37/96/947183796.db2.gz DVECKALIGUEONM-UHFFFAOYSA-N 0 0 368.311 3.651 20 5 FHBDRN O=C(N[C@H](c1ccc(F)c(Cl)c1)C(F)(F)F)c1ccc([N+](=O)[O-])[nH]1 ZINC000444755921 947192187 /nfs/dbraw/zinc/19/21/87/947192187.db2.gz GVGYRAGHPHAGHG-LLVKDONJSA-N 0 0 365.670 3.749 20 5 FHBDRN O=[N+]([O-])c1ccccc1S(=O)(=O)N[C@H](c1ccc(Cl)cc1)C1CC1 ZINC000021183454 947212691 /nfs/dbraw/zinc/21/26/91/947212691.db2.gz WWPOXYMBYQRBDM-INIZCTEOSA-N 0 0 366.826 3.678 20 5 FHBDRN CC(C)NC(=O)c1ccc(NCCc2ccc3[nH]ccc3c2)c([N+](=O)[O-])c1 ZINC000440549826 947215082 /nfs/dbraw/zinc/21/50/82/947215082.db2.gz PNVKBTFXRPUPHR-UHFFFAOYSA-N 0 0 366.421 3.869 20 5 FHBDRN CC1(C)CN(Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C[C@]2(C[C@@H]3CC[C@H]2C3)O1 ZINC000440554644 947222228 /nfs/dbraw/zinc/22/22/28/947222228.db2.gz VDIPSXIHSUECKH-CKNLXJGOSA-N 0 0 370.453 3.641 20 5 FHBDRN Cc1ccccc1[C@@H]1C[C@@H](C)N(C(=O)NCc2ccccc2[N+](=O)[O-])C1 ZINC000523413351 947222369 /nfs/dbraw/zinc/22/23/69/947222369.db2.gz IDASKZJQQHKTGJ-NVXWUHKLSA-N 0 0 353.422 3.991 20 5 FHBDRN Cc1ccc(C[C@@H](C)NS(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)s1 ZINC000523415372 947223587 /nfs/dbraw/zinc/22/35/87/947223587.db2.gz WPUDNRRHQBCQGD-SECBINFHSA-N 0 0 374.871 3.528 20 5 FHBDRN CCc1ccccc1CNC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000485659677 947231869 /nfs/dbraw/zinc/23/18/69/947231869.db2.gz YQPDKLWFQNIXPV-UHFFFAOYSA-N 0 0 350.321 3.689 20 5 FHBDRN COc1cccc(CNC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)c1 ZINC000444822585 947236762 /nfs/dbraw/zinc/23/67/62/947236762.db2.gz ADTROMBDJNEBGK-UHFFFAOYSA-N 0 0 358.397 3.620 20 5 FHBDRN COc1ccc(CC(C)(C)NC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)cc1 ZINC000438531265 947238653 /nfs/dbraw/zinc/23/86/53/947238653.db2.gz UANNBHZQTZZDQQ-UHFFFAOYSA-N 0 0 367.405 3.836 20 5 FHBDRN Cn1cnc([N+](=O)[O-])c1CN[C@H](c1ccc(F)c(Cl)c1)C(F)(F)F ZINC000444818639 947253883 /nfs/dbraw/zinc/25/38/83/947253883.db2.gz SLVBIRHVHZJXSX-LLVKDONJSA-N 0 0 366.702 3.514 20 5 FHBDRN COc1cc(Br)c(C=O)cc1OCc1ccccc1[N+](=O)[O-] ZINC000021220774 947264083 /nfs/dbraw/zinc/26/40/83/947264083.db2.gz WVINHFUIIKEDKR-UHFFFAOYSA-N 0 0 366.167 3.757 20 5 FHBDRN O=C(O[C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)c1cc2occc2s1 ZINC000759928881 947283480 /nfs/dbraw/zinc/28/34/80/947283480.db2.gz HQKUJYZZDJMWDR-WDEREUQCSA-N 0 0 361.379 3.940 20 5 FHBDRN CC(C)Oc1ccccc1NC(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444858187 947284164 /nfs/dbraw/zinc/28/41/64/947284164.db2.gz KAMQHKGSYOAJMK-UHFFFAOYSA-N 0 0 369.381 3.580 20 5 FHBDRN O=C(COC(=O)c1cc2c(s1)CCCCC2)Nc1ccccc1[N+](=O)[O-] ZINC000021239734 947288156 /nfs/dbraw/zinc/28/81/56/947288156.db2.gz VOEDQYDPWQECAK-UHFFFAOYSA-N 0 0 374.418 3.721 20 5 FHBDRN C[C@@H](CC(=O)N1CCc2c1cccc2[N+](=O)[O-])C(=O)c1cccc(F)c1 ZINC000073848812 947294108 /nfs/dbraw/zinc/29/41/08/947294108.db2.gz QINOKAZFTDFWIA-LBPRGKRZSA-N 0 0 356.353 3.532 20 5 FHBDRN C[C@@H]1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2Br)[C@H](C)C1 ZINC000523491895 947309938 /nfs/dbraw/zinc/30/99/38/947309938.db2.gz PWMITXXSADBPON-GPCCPHFNSA-N 0 0 355.232 3.912 20 5 FHBDRN C[C@@H]1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2Br)[C@@H](C)C1 ZINC000523491896 947310232 /nfs/dbraw/zinc/31/02/32/947310232.db2.gz PWMITXXSADBPON-ISTVAULSSA-N 0 0 355.232 3.912 20 5 FHBDRN COc1c(F)cc(NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)cc1F ZINC000523508237 947319567 /nfs/dbraw/zinc/31/95/67/947319567.db2.gz QJLFXMYVVFQHBP-UHFFFAOYSA-N 0 0 350.321 3.798 20 5 FHBDRN CSc1cccc(C(=O)N2CCC(OC3CCCC3)CC2)c1[N+](=O)[O-] ZINC000186428835 947321355 /nfs/dbraw/zinc/32/13/55/947321355.db2.gz SVABTTMBZUATAS-UHFFFAOYSA-N 0 0 364.467 3.881 20 5 FHBDRN Cc1ccc(NCCCNC(=O)C2(c3ccccc3C)CC2)c([N+](=O)[O-])c1 ZINC000523512797 947326102 /nfs/dbraw/zinc/32/61/02/947326102.db2.gz SAXIDBDJLAIHBS-UHFFFAOYSA-N 0 0 367.449 3.862 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N1CC=C(c2ccccc2C)C1 ZINC000444908193 947327054 /nfs/dbraw/zinc/32/70/54/947327054.db2.gz QWJYNTWIQAWYFG-UHFFFAOYSA-N 0 0 353.378 3.843 20 5 FHBDRN Cc1cccc2nc(CNc3ccc([N+](=O)[O-])cc3Br)cn21 ZINC000301403320 947327582 /nfs/dbraw/zinc/32/75/82/947327582.db2.gz RURCKQPJIAIRQI-UHFFFAOYSA-N 0 0 361.199 3.926 20 5 FHBDRN CNC(=O)c1cc([N+](=O)[O-])ccc1NCC1(c2cccc(Cl)c2)CC1 ZINC000523515001 947327858 /nfs/dbraw/zinc/32/78/58/947327858.db2.gz MKSQVARKRNOVGP-UHFFFAOYSA-N 0 0 359.813 3.752 20 5 FHBDRN CC(C)(C(=O)N1CCO[C@H](c2ccc(F)cc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000523528713 947338072 /nfs/dbraw/zinc/33/80/72/947338072.db2.gz MFZBUKJMAOOAKJ-SFHVURJKSA-N 0 0 372.396 3.612 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NCc1ccccc1OCC1CC1 ZINC000444921921 947339508 /nfs/dbraw/zinc/33/95/08/947339508.db2.gz CFOJLUAHBICQOL-UHFFFAOYSA-N 0 0 371.393 3.714 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)NCCSc1ccc(C)cc1 ZINC000444922959 947340445 /nfs/dbraw/zinc/34/04/45/947340445.db2.gz QHWOJSVJKLRWAU-UHFFFAOYSA-N 0 0 361.423 3.826 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H]1COc2ccc(Cl)cc21 ZINC000444925856 947343548 /nfs/dbraw/zinc/34/35/48/947343548.db2.gz AUFWLSIQQQTKDF-CYBMUJFWSA-N 0 0 363.757 3.512 20 5 FHBDRN CCOc1ccc2c(c1)CCN(C(=O)Nc1ccc([N+](=O)[O-])cc1OC)C2 ZINC000444915988 947351991 /nfs/dbraw/zinc/35/19/91/947351991.db2.gz ZPNDIMORTCWMDN-UHFFFAOYSA-N 0 0 371.393 3.592 20 5 FHBDRN Cn1ccnc1[C@H](Nc1c(F)cc([N+](=O)[O-])cc1F)c1cccc(F)c1 ZINC000440596570 947352558 /nfs/dbraw/zinc/35/25/58/947352558.db2.gz JEUSUGYJMLHPAH-OAHLLOKOSA-N 0 0 362.311 3.947 20 5 FHBDRN CNC(=O)c1cc([N+](=O)[O-])ccc1NCc1cccc(COC(C)(C)C)c1 ZINC000523547755 947362836 /nfs/dbraw/zinc/36/28/36/947362836.db2.gz HUDNOKRIMWFJDG-UHFFFAOYSA-N 0 0 371.437 3.882 20 5 FHBDRN Cc1cccc2cc(C(=O)N=c3cc(-c4cccc([N+](=O)[O-])c4)[nH][nH]3)oc21 ZINC000523550754 947364893 /nfs/dbraw/zinc/36/48/93/947364893.db2.gz XGBCUULEVHVKCJ-UHFFFAOYSA-N 0 0 362.345 3.714 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(-n2ccnc2)c(Cl)c1 ZINC000523552139 947365263 /nfs/dbraw/zinc/36/52/63/947365263.db2.gz HDDHULHWQSRMNH-UHFFFAOYSA-N 0 0 372.768 3.695 20 5 FHBDRN O=C(NC1CCCC1)c1ccccc1OCCOc1cccc([N+](=O)[O-])c1 ZINC000543908973 947372706 /nfs/dbraw/zinc/37/27/06/947372706.db2.gz QVORJTVLBQQFFD-UHFFFAOYSA-N 0 0 370.405 3.725 20 5 FHBDRN CO[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2SC(C)C)[C@@H](C)C1 ZINC000441439792 947392371 /nfs/dbraw/zinc/39/23/71/947392371.db2.gz VCAZIRJNSCXSJP-JSGCOSHPSA-N 0 0 352.456 3.735 20 5 FHBDRN CCc1nc(CCNC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)cs1 ZINC000120324237 947397838 /nfs/dbraw/zinc/39/78/38/947397838.db2.gz JCJFEOHJYQKPEC-UHFFFAOYSA-N 0 0 374.466 3.530 20 5 FHBDRN Cc1ncc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H](c2cc(F)ccc2F)C1 ZINC000190290080 947414002 /nfs/dbraw/zinc/41/40/02/947414002.db2.gz JXJHUIXAMAXGHD-GFCCVEGCSA-N 0 0 361.348 3.596 20 5 FHBDRN Cc1cnc2c(c1)N(C(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1)CCO2 ZINC000126630003 947421071 /nfs/dbraw/zinc/42/10/71/947421071.db2.gz PIYDVBBFLPQKDV-UHFFFAOYSA-N 0 0 355.394 3.635 20 5 FHBDRN C/C(=C/C(=O)N1CCC(n2ccc([N+](=O)[O-])n2)CC1)c1cccc(Cl)c1 ZINC000785326493 947424602 /nfs/dbraw/zinc/42/46/02/947424602.db2.gz NBYBZIPFWAILEL-QBFSEMIESA-N 0 0 374.828 3.712 20 5 FHBDRN CSc1cccc(C(=O)NC[C@H](C[C@H](C)O)c2ccccc2)c1[N+](=O)[O-] ZINC000188208331 947428880 /nfs/dbraw/zinc/42/88/80/947428880.db2.gz QHFRZERVMAXNHE-ZFWWWQNUSA-N 0 0 374.462 3.601 20 5 FHBDRN COCCc1ccccc1NC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000188213122 947447174 /nfs/dbraw/zinc/44/71/74/947447174.db2.gz RHCXVXGJKDUIDL-UHFFFAOYSA-N 0 0 366.320 3.637 20 5 FHBDRN O=C(O[C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1)c1ccc2ccccc2n1 ZINC000759931059 947449737 /nfs/dbraw/zinc/44/97/37/947449737.db2.gz MLYFVOLPWPVSCB-IAGOWNOFSA-N 0 0 366.377 3.680 20 5 FHBDRN O=C(NCCC1=CCCCCC1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000184533985 947450126 /nfs/dbraw/zinc/45/01/26/947450126.db2.gz XVGUGYHKDNQEDO-UHFFFAOYSA-N 0 0 365.817 3.584 20 5 FHBDRN CCN(C(=O)COc1ccccc1[N+](=O)[O-])C12CC3CC(CC(C3)C1)C2 ZINC000021345374 947463084 /nfs/dbraw/zinc/46/30/84/947463084.db2.gz DUAJQZULBWYKPS-UHFFFAOYSA-N 0 0 358.438 3.791 20 5 FHBDRN COc1cccc(NC[C@H]2CCN(c3ccc(F)c(F)c3)C2)c1[N+](=O)[O-] ZINC000613874982 947474156 /nfs/dbraw/zinc/47/41/56/947474156.db2.gz FSNSDDBGPMOMCD-GFCCVEGCSA-N 0 0 363.364 3.820 20 5 FHBDRN Cc1c(F)ccc([N+](=O)[O-])c1C(=O)NCc1ccccc1N1CCCC1 ZINC000843771944 947490368 /nfs/dbraw/zinc/49/03/68/947490368.db2.gz NYMHGEHTUUALSY-UHFFFAOYSA-N 0 0 357.385 3.573 20 5 FHBDRN CCCN(C(=O)Cc1cc(F)c(F)cc1F)c1cccc([N+](=O)[O-])c1 ZINC000441451369 947492545 /nfs/dbraw/zinc/49/25/45/947492545.db2.gz MZIOAYVNDKNQHJ-UHFFFAOYSA-N 0 0 352.312 3.998 20 5 FHBDRN CC(C)[C@@H](NC(=O)c1nn(C)cc1[N+](=O)[O-])c1ccc(C(C)(C)C)cc1 ZINC000511962076 947501216 /nfs/dbraw/zinc/50/12/16/947501216.db2.gz ABXWOEIWXGDDRO-MRXNPFEDSA-N 0 0 358.442 3.753 20 5 FHBDRN Cc1c(OCC(=O)NCc2cccc(COC(C)C)c2)cccc1[N+](=O)[O-] ZINC000053837962 947553772 /nfs/dbraw/zinc/55/37/72/947553772.db2.gz IFJCTSYBQIWKNC-UHFFFAOYSA-N 0 0 372.421 3.523 20 5 FHBDRN CC(=O)Nc1ccc2c(COc3cccc([N+](=O)[O-])c3C)cc(=O)oc2c1 ZINC000053837476 947554089 /nfs/dbraw/zinc/55/40/89/947554089.db2.gz CAFNNSQRKHRLPX-UHFFFAOYSA-N 0 0 368.345 3.547 20 5 FHBDRN Cc1cnc(NC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)c(Br)c1 ZINC000162851545 947562855 /nfs/dbraw/zinc/56/28/55/947562855.db2.gz TZOWNEPBPQIUPO-QPJJXVBHSA-N 0 0 362.183 3.713 20 5 FHBDRN C[C@@H]1C(=O)CC[C@@H](C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)C1(C)C ZINC000440672868 947568012 /nfs/dbraw/zinc/56/80/12/947568012.db2.gz RCCUIDQXBFGRCU-MFKMUULPSA-N 0 0 352.818 3.506 20 5 FHBDRN COc1cc(F)ccc1N1CCN(c2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000523753590 947569007 /nfs/dbraw/zinc/56/90/07/947569007.db2.gz KFWOZTBWDBHFFU-UHFFFAOYSA-N 0 0 365.792 3.723 20 5 FHBDRN Cc1ccccc1OCCNC(=O)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000445177444 947569018 /nfs/dbraw/zinc/56/90/18/947569018.db2.gz GRGDPFUPRRGKBY-UHFFFAOYSA-N 0 0 372.424 3.799 20 5 FHBDRN CCO[C@H]1C[C@@H](N(C)C(=O)c2ccc([N+](=O)[O-])cc2F)C12CCCC2 ZINC000150791240 947583350 /nfs/dbraw/zinc/58/33/50/947583350.db2.gz ZNUXDYJGELLKFG-CVEARBPZSA-N 0 0 350.390 3.544 20 5 FHBDRN Cn1cc(NC(=O)c2ccccc2Sc2ccccc2[N+](=O)[O-])cn1 ZINC000440683831 947599396 /nfs/dbraw/zinc/59/93/96/947599396.db2.gz NVMNUBQFIJAUPQ-UHFFFAOYSA-N 0 0 354.391 3.732 20 5 FHBDRN O=C(CCc1cccc([N+](=O)[O-])c1)Nc1cccc(Oc2cnccn2)c1 ZINC000087088464 947603653 /nfs/dbraw/zinc/60/36/53/947603653.db2.gz AEBOSSCBKVLHTA-UHFFFAOYSA-N 0 0 364.361 3.748 20 5 FHBDRN C[C@@H]1CCC[C@@H](C)N1C(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000087086909 947622334 /nfs/dbraw/zinc/62/23/34/947622334.db2.gz PIGDHSDNZOJKDT-GHMZBOCLSA-N 0 0 355.232 3.689 20 5 FHBDRN CCOCCCNC(=O)c1ccccc1Sc1ccccc1[N+](=O)[O-] ZINC000440694189 947625562 /nfs/dbraw/zinc/62/55/62/947625562.db2.gz PNXHDFIBKGUVSG-UHFFFAOYSA-N 0 0 360.435 3.902 20 5 FHBDRN COc1ccccc1-c1nc(Cc2c[nH]c3ccc([N+](=O)[O-])cc23)no1 ZINC000445235379 947630474 /nfs/dbraw/zinc/63/04/74/947630474.db2.gz ILOZVOXMDKOBIL-UHFFFAOYSA-N 0 0 350.334 3.726 20 5 FHBDRN Cc1n[nH]c(C)c1[C@H](C)c1nc(Cc2c[nH]c3ccc([N+](=O)[O-])cc23)no1 ZINC000445237206 947633838 /nfs/dbraw/zinc/63/38/38/947633838.db2.gz SJSUWFQELZOKRR-VIFPVBQESA-N 0 0 366.381 3.542 20 5 FHBDRN Cc1cc(N(C)C)cc(C)c1NC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000125744847 947653886 /nfs/dbraw/zinc/65/38/86/947653886.db2.gz OJQWKBBAMXCZFJ-UHFFFAOYSA-N 0 0 368.437 3.868 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1C(=O)OCC(=O)Nc1ccc2ccccc2c1 ZINC000026113713 947656600 /nfs/dbraw/zinc/65/66/00/947656600.db2.gz YYTQLGKJWUWIHC-UHFFFAOYSA-N 0 0 364.357 3.852 20 5 FHBDRN O=C(O[C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)c1ccc(Cl)cc1F ZINC000759934885 947658053 /nfs/dbraw/zinc/65/80/53/947658053.db2.gz QPPYFEBHOPAZPJ-UONOGXRCSA-N 0 0 367.764 3.925 20 5 FHBDRN Cn1cc(CCNC(=O)c2ccc([N+](=O)[O-])s2)c2ccc(Cl)cc21 ZINC000440717828 947704961 /nfs/dbraw/zinc/70/49/61/947704961.db2.gz YHLCROFFSKAQRN-UHFFFAOYSA-N 0 0 363.826 3.774 20 5 FHBDRN CC[C@@H](C)COc1cc([N+](=O)[O-])c(COC(=O)C2(C)CC2)cc1OC ZINC000781665123 947707573 /nfs/dbraw/zinc/70/75/73/947707573.db2.gz YBOWQNRFHVIRJB-GFCCVEGCSA-N 0 0 351.399 3.872 20 5 FHBDRN Cc1ccc2c(COC(=O)c3c(C)cccc3[N+](=O)[O-])cc(=O)oc2c1 ZINC000026116044 947709829 /nfs/dbraw/zinc/70/98/29/947709829.db2.gz ZONLXOWARGNLFH-UHFFFAOYSA-N 0 0 353.330 3.675 20 5 FHBDRN COc1ccc(/C=C/C(=O)O[C@@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)cc1 ZINC000759937312 947710148 /nfs/dbraw/zinc/71/01/48/947710148.db2.gz WMDQAIKYYXSBMB-VESHTZQJSA-N 0 0 371.393 3.540 20 5 FHBDRN CCOc1cnc(-c2noc(-c3cc4cc([N+](=O)[O-])ccc4s3)n2)cn1 ZINC000445304166 947711982 /nfs/dbraw/zinc/71/19/82/947711982.db2.gz ZSTVMLONMLGDLC-UHFFFAOYSA-N 0 0 369.362 3.715 20 5 FHBDRN Cc1cccc(NC(=O)Cc2noc(-c3cc(Cl)cc([N+](=O)[O-])c3)n2)c1 ZINC000445325473 947713088 /nfs/dbraw/zinc/71/30/88/947713088.db2.gz XOSVEBXHNDYNRL-UHFFFAOYSA-N 0 0 372.768 3.788 20 5 FHBDRN CCc1ccc(-c2nc(CC(=O)Nc3cccc(C)c3)no2)cc1[N+](=O)[O-] ZINC000445313698 947717188 /nfs/dbraw/zinc/71/71/88/947717188.db2.gz BERCNFBEJCGPHF-UHFFFAOYSA-N 0 0 366.377 3.697 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1C(=O)O[C@@H](C)C(=O)Nc1ccc(Cl)cc1 ZINC000026117300 947738949 /nfs/dbraw/zinc/73/89/49/947738949.db2.gz MVJVQSSEUXJWIO-NSHDSACASA-N 0 0 362.769 3.741 20 5 FHBDRN CCOc1ccc(C(=O)O[C@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)cc1 ZINC000759939417 947743740 /nfs/dbraw/zinc/74/37/40/947743740.db2.gz MITSCPRRNZZVBN-CVEARBPZSA-N 0 0 359.382 3.531 20 5 FHBDRN Cc1cc(Cl)cc(NC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)c1O ZINC000523942043 947749960 /nfs/dbraw/zinc/74/99/60/947749960.db2.gz QMJAATVOIFZTRS-UHFFFAOYSA-N 0 0 359.769 3.856 20 5 FHBDRN O=[N+]([O-])c1cccnc1SCc1nn(-c2ccccc2)c2c1CCC2 ZINC000121553683 947752522 /nfs/dbraw/zinc/75/25/22/947752522.db2.gz RYBKDBSPTKPVDM-UHFFFAOYSA-N 0 0 352.419 3.957 20 5 FHBDRN CC(C)Oc1ccc(NC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)cc1Cl ZINC000523947397 947752878 /nfs/dbraw/zinc/75/28/78/947752878.db2.gz AXAPRGCZRXMZKB-UHFFFAOYSA-N 0 0 366.805 3.606 20 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947832706 /nfs/dbraw/zinc/83/27/06/947832706.db2.gz JFXFJDNYLYURRW-CQSZACIVSA-N 0 0 358.394 3.814 20 5 FHBDRN Cc1noc(C2CCC(Nc3ccnc4c3cccc4[N+](=O)[O-])CC2)n1 ZINC000432311524 947871951 /nfs/dbraw/zinc/87/19/51/947871951.db2.gz GCBOBABUICQMOU-UHFFFAOYSA-N 0 0 353.382 3.973 20 5 FHBDRN O=[N+]([O-])c1cccc2c(NCCc3cnn(-c4ccccc4)c3)ccnc21 ZINC000432311074 947878050 /nfs/dbraw/zinc/87/80/50/947878050.db2.gz DHMMWYJPEWDTIK-UHFFFAOYSA-N 0 0 359.389 3.983 20 5 FHBDRN O=[N+]([O-])c1sccc1OCc1cc2c(cc1Br)OCO2 ZINC001307345120 947884309 /nfs/dbraw/zinc/88/43/09/947884309.db2.gz DBYDXKOABRNDSY-UHFFFAOYSA-N 0 0 358.169 3.727 20 5 FHBDRN O=C(NC[C@@H]1CCCC1(F)F)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000459030620 947923893 /nfs/dbraw/zinc/92/38/93/947923893.db2.gz PULJYIYWTXMWPB-ZDUSSCGKSA-N 0 0 353.369 3.704 20 5 FHBDRN O=C(NCc1ccccc1)C1CCN(c2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000432315385 947946854 /nfs/dbraw/zinc/94/68/54/947946854.db2.gz UKEJCUCXVPSHEU-UHFFFAOYSA-N 0 0 373.840 3.781 20 5 FHBDRN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H]1CCCC1(F)F ZINC000459033732 947948126 /nfs/dbraw/zinc/94/81/26/947948126.db2.gz RVAGNKPZKJQTMR-AWEZNQCLSA-N 0 0 355.385 3.950 20 5 FHBDRN CCN(Cc1ccccc1)C(=O)CNc1ccnc2c1cccc2[N+](=O)[O-] ZINC000432317371 947974341 /nfs/dbraw/zinc/97/43/41/947974341.db2.gz HXGPMXXVNBHIOL-UHFFFAOYSA-N 0 0 364.405 3.604 20 5 FHBDRN CC1(C)CO[C@@H](CC(=O)OCc2ccc([N+](=O)[O-])cc2Br)C1 ZINC001126274680 947977488 /nfs/dbraw/zinc/97/74/88/947977488.db2.gz CRZSMMDSMSFKKP-LBPRGKRZSA-N 0 0 372.215 3.606 20 5 FHBDRN CN(C)c1ccc(NCc2csc(-c3cccc([N+](=O)[O-])c3)n2)cn1 ZINC000162944687 947982991 /nfs/dbraw/zinc/98/29/91/947982991.db2.gz UCUOWMKWEHENQK-UHFFFAOYSA-N 0 0 355.423 3.791 20 5 FHBDRN O=C(COC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])Cc1ccccc1 ZINC000785349839 947995437 /nfs/dbraw/zinc/99/54/37/947995437.db2.gz SOKDHMNVNWVKKV-UHFFFAOYSA-N 0 0 367.279 3.582 20 5 FHBDRN CCc1nn(C)c(N2CCC[C@@H](c3nc(C(C)C)cs3)C2)c1[N+](=O)[O-] ZINC000094167896 948027677 /nfs/dbraw/zinc/02/76/77/948027677.db2.gz OOYASVBDUHJXHV-GFCCVEGCSA-N 0 0 363.487 3.855 20 5 FHBDRN O=[N+]([O-])c1cccc(Cl)c1NCCCS(=O)(=O)c1ccccc1 ZINC000432320901 948029820 /nfs/dbraw/zinc/02/98/20/948029820.db2.gz CEVPNOFDPOQRJI-UHFFFAOYSA-N 0 0 354.815 3.524 20 5 FHBDRN CCO[C@@H]1CCCC[C@H]1NC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000459085984 948068877 /nfs/dbraw/zinc/06/88/77/948068877.db2.gz AJYWZKQZCSFWQT-QZTJIDSGSA-N 0 0 361.442 3.617 20 5 FHBDRN CCOCc1ccc(NC(=O)CCCNc2ccc([N+](=O)[O-])cc2)cc1 ZINC000075356491 948078248 /nfs/dbraw/zinc/07/82/48/948078248.db2.gz QHXXSTPXRHIIOL-UHFFFAOYSA-N 0 0 357.410 3.962 20 5 FHBDRN O=C(CCc1ccccc1)N1CC[C@H](Nc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000432328202 948082248 /nfs/dbraw/zinc/08/22/48/948082248.db2.gz VROFXFGCXZJSOV-HNNXBMFYSA-N 0 0 373.840 3.894 20 5 FHBDRN O=[N+]([O-])c1cccc(Cl)c1N1CCc2c(cnn2-c2ccccc2)C1 ZINC000432329489 948086464 /nfs/dbraw/zinc/08/64/64/948086464.db2.gz QGZXSICBUGJKAD-UHFFFAOYSA-N 0 0 354.797 3.997 20 5 FHBDRN CC1CCN(C(=O)C2CCN(c3c(Cl)cccc3[N+](=O)[O-])CC2)CC1 ZINC000432330427 948095712 /nfs/dbraw/zinc/09/57/12/948095712.db2.gz AXHLVDPLFLJMQP-UHFFFAOYSA-N 0 0 365.861 3.723 20 5 FHBDRN Cc1nc(COC(=O)Cn2c3ccccc3c(=O)c3ccccc32)oc1C ZINC000128782874 948122787 /nfs/dbraw/zinc/12/27/87/948122787.db2.gz SKCPMZDOYRTXFP-UHFFFAOYSA-N 0 0 362.385 3.503 20 5 FHBDRN CCC[C@H](C)NC(=O)[C@@H]1CCCN(c2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000432331904 948129845 /nfs/dbraw/zinc/12/98/45/948129845.db2.gz RQCHGWOLWLRMRE-QWHCGFSZSA-N 0 0 353.850 3.769 20 5 FHBDRN O=[N+]([O-])c1cccc2c(N[C@H]3CCN(c4ncccc4Cl)C3)ccnc21 ZINC000432332951 948140542 /nfs/dbraw/zinc/14/05/42/948140542.db2.gz DNVOCZSNHIOYOP-LBPRGKRZSA-N 0 0 369.812 3.882 20 5 FHBDRN O=[N+]([O-])c1cccc2c(NCc3cccc(Cn4ccnc4)c3)ccnc21 ZINC000432336685 948147815 /nfs/dbraw/zinc/14/78/15/948147815.db2.gz OOYIHHTUKJLUAV-UHFFFAOYSA-N 0 0 359.389 4.000 20 5 FHBDRN COC(=O)[C@@H](CNc1ccnc2c1cccc2[N+](=O)[O-])c1ccccc1 ZINC000432339726 948153766 /nfs/dbraw/zinc/15/37/66/948153766.db2.gz KCKCBWWZCLRDEK-HNNXBMFYSA-N 0 0 351.362 3.512 20 5 FHBDRN O=C(NCCCNc1ccnc2c1cccc2[N+](=O)[O-])c1cccc(F)c1 ZINC000432338468 948157687 /nfs/dbraw/zinc/15/76/87/948157687.db2.gz WJCKTDZMJGYPCI-UHFFFAOYSA-N 0 0 368.368 3.514 20 5 FHBDRN COc1ccc(NC(=O)Cc2cccc(C(F)(F)F)c2)c([N+](=O)[O-])c1 ZINC000019160039 948164746 /nfs/dbraw/zinc/16/47/46/948164746.db2.gz PYHLJWLCYGPDOL-UHFFFAOYSA-N 0 0 354.284 3.803 20 5 FHBDRN Cc1c(NC(=O)[C@H]2CCN(c3ccc(Cl)cc3)C2=O)cccc1[N+](=O)[O-] ZINC000053085062 948174174 /nfs/dbraw/zinc/17/41/74/948174174.db2.gz NSKCQTBBVMBZON-CQSZACIVSA-N 0 0 373.796 3.548 20 5 FHBDRN O=[N+]([O-])c1ccc(CS(=O)(=O)N[C@H]2CCCC[C@@H]2c2ccccc2)cc1 ZINC000512008050 948175571 /nfs/dbraw/zinc/17/55/71/948175571.db2.gz LKRUSNMONNTTJS-MOPGFXCFSA-N 0 0 374.462 3.741 20 5 FHBDRN CCOc1ccc(C(=O)N2Cc3ccccc3C3(CC3)C2)cc1[N+](=O)[O-] ZINC000184683779 948177008 /nfs/dbraw/zinc/17/70/08/948177008.db2.gz TYTWBYYOLLPRPS-UHFFFAOYSA-N 0 0 352.390 3.681 20 5 FHBDRN C[C@@H]1CC(=O)Oc2cc(OC(=O)CSc3ccccc3[N+](=O)[O-])ccc21 ZINC000785367997 948206830 /nfs/dbraw/zinc/20/68/30/948206830.db2.gz ZNYUXMGMVOWZBM-LLVKDONJSA-N 0 0 373.386 3.705 20 5 FHBDRN O=C(O[C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1)c1cc2ccsc2[nH]1 ZINC000759948877 948213122 /nfs/dbraw/zinc/21/31/22/948213122.db2.gz ZRGJGSURIBKRAK-OLZOCXBDSA-N 0 0 360.395 3.675 20 5 FHBDRN CCOc1ccc(C(=O)Nc2nccc(-c3ccccc3)n2)cc1[N+](=O)[O-] ZINC000585709317 948222838 /nfs/dbraw/zinc/22/28/38/948222838.db2.gz ILIFXAUGDZKNNE-UHFFFAOYSA-N 0 0 364.361 3.703 20 5 FHBDRN CCc1ccc(C(=O)N2C[C@]3(C[C@@H]4CC[C@H]3C4)OC(C)(C)C2)cc1[N+](=O)[O-] ZINC000507774249 948224961 /nfs/dbraw/zinc/22/49/61/948224961.db2.gz LFVWRGQIBJZQEV-FNXXIHLHSA-N 0 0 372.465 3.967 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1C(=O)N1CCSC[C@@H]1c1ccccc1 ZINC000427593388 948253940 /nfs/dbraw/zinc/25/39/40/948253940.db2.gz KGLHAWYIMHDDRG-MRXNPFEDSA-N 0 0 358.419 3.534 20 5 FHBDRN CCOC(=O)c1cc(NC(=O)CCc2cccc([N+](=O)[O-])c2)c(F)cc1C ZINC000585751206 948257083 /nfs/dbraw/zinc/25/70/83/948257083.db2.gz MHABYXSRWDMTOS-UHFFFAOYSA-N 0 0 374.368 3.790 20 5 FHBDRN COC(=O)Cc1cccc(C(=O)Nc2ccc(C(C)(C)C)c([N+](=O)[O-])c2)c1 ZINC000585750313 948261910 /nfs/dbraw/zinc/26/19/10/948261910.db2.gz CPOVJECQNQIXML-UHFFFAOYSA-N 0 0 370.405 3.860 20 5 FHBDRN Cc1ccc([C@@H]2C[C@@H](C)N(S(=O)(=O)c3cccc([N+](=O)[O-])c3C)C2)cc1 ZINC001211698936 948270370 /nfs/dbraw/zinc/27/03/70/948270370.db2.gz BFMUEMGISAUWTB-RHSMWYFYSA-N 0 0 374.462 3.778 20 5 FHBDRN Cc1c(NC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)cnn1CCC(C)C ZINC000441569740 948276710 /nfs/dbraw/zinc/27/67/10/948276710.db2.gz SOJGWPSSIYKCKK-UHFFFAOYSA-N 0 0 369.425 3.739 20 5 FHBDRN CN(CCOc1ccc(F)cc1)C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000070725580 948297863 /nfs/dbraw/zinc/29/78/63/948297863.db2.gz VBGJLLJYOVVDMD-UHFFFAOYSA-N 0 0 352.749 3.538 20 5 FHBDRN COc1ccc(OC(=O)CCSc2ccccc2F)c([N+](=O)[O-])c1 ZINC000070809913 948300513 /nfs/dbraw/zinc/30/05/13/948300513.db2.gz YVEZAMRHEARBNG-UHFFFAOYSA-N 0 0 351.355 3.830 20 5 FHBDRN O=C(NCc1c(F)cc(F)c(F)c1F)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000432395832 948320540 /nfs/dbraw/zinc/32/05/40/948320540.db2.gz RPWQLJXJGDYXET-UHFFFAOYSA-N 0 0 367.258 3.563 20 5 FHBDRN O=C(Nc1cc(Br)cc([N+](=O)[O-])c1)N[C@H]1CCC(F)(F)C1 ZINC000585808278 948330887 /nfs/dbraw/zinc/33/08/87/948330887.db2.gz UFLJKUHWFOKEMH-QMMMGPOBSA-N 0 0 364.146 3.667 20 5 FHBDRN COc1cc(C(=O)N(C)C(C)(C)c2ccccc2)c([N+](=O)[O-])cc1OC ZINC000585810057 948339679 /nfs/dbraw/zinc/33/96/79/948339679.db2.gz GCIKLWCKKSGKRA-UHFFFAOYSA-N 0 0 358.394 3.619 20 5 FHBDRN O=C(Cc1ccc([N+](=O)[O-])cc1Br)N1CCC[C@H]1C1CCC1 ZINC000151422654 948351254 /nfs/dbraw/zinc/35/12/54/948351254.db2.gz QYHQVPMBIVFTSI-HNNXBMFYSA-N 0 0 367.243 3.691 20 5 FHBDRN O=C(CC1=CCCCC1)OCC1CCN(c2ncccc2[N+](=O)[O-])CC1 ZINC000106988214 948377743 /nfs/dbraw/zinc/37/77/43/948377743.db2.gz DPASGVLVMKTBAU-UHFFFAOYSA-N 0 0 359.426 3.640 20 5 FHBDRN O=C(c1cccc(-n2cccn2)c1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000129582477 948386276 /nfs/dbraw/zinc/38/62/76/948386276.db2.gz GHYACKFAHYLTST-UHFFFAOYSA-N 0 0 362.389 3.585 20 5 FHBDRN CC(=O)c1c(C)oc2ncnc(NCc3ccc([N+](=O)[O-])cc3Cl)c21 ZINC000184768287 948401229 /nfs/dbraw/zinc/40/12/29/948401229.db2.gz XPXUUKCSGYVEKX-UHFFFAOYSA-N 0 0 360.757 3.908 20 5 FHBDRN CCc1nocc1CN(C)C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000512101561 948419764 /nfs/dbraw/zinc/41/97/64/948419764.db2.gz DFVHGHGEDUSNHF-UHFFFAOYSA-N 0 0 372.406 3.541 20 5 FHBDRN COC(=O)c1ccc(OCc2ncc(-c3cccs3)o2)c([N+](=O)[O-])c1 ZINC000067428788 948421079 /nfs/dbraw/zinc/42/10/79/948421079.db2.gz FCRZCDDEAFLVAW-UHFFFAOYSA-N 0 0 360.347 3.677 20 5 FHBDRN C[C@@H](OC[C@H](O)COc1c(F)cccc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000184775673 948427675 /nfs/dbraw/zinc/42/76/75/948427675.db2.gz DXRNFTKQTKYIDL-RISCZKNCSA-N 0 0 369.776 3.905 20 5 FHBDRN CC(C)CCSc1ccc(C(=O)NCCC2CC(O)C2)cc1[N+](=O)[O-] ZINC000432442831 948429428 /nfs/dbraw/zinc/42/94/28/948429428.db2.gz RACUGWYLEHYXJD-UHFFFAOYSA-N 0 0 366.483 3.624 20 5 FHBDRN COc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[C@](C)(c2ccc(F)cc2)C1 ZINC000432450205 948456133 /nfs/dbraw/zinc/45/61/33/948456133.db2.gz WZIMGTNQKJJAJE-IBGZPJMESA-N 0 0 373.384 3.938 20 5 FHBDRN CCn1cc(Br)cc1C(=O)Nc1cc(F)cc([N+](=O)[O-])c1 ZINC000229560744 948483339 /nfs/dbraw/zinc/48/33/39/948483339.db2.gz MKFVYFLWSVCHKW-UHFFFAOYSA-N 0 0 356.151 3.570 20 5 FHBDRN O=C([C@H]1C[C@@H]1c1cc(F)c(F)c(F)c1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000184786733 948483614 /nfs/dbraw/zinc/48/36/14/948483614.db2.gz FWOCKNUCCRGLON-OLZOCXBDSA-N 0 0 362.307 3.705 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccc(OC[C@@H]2CCCO2)cc1 ZINC000512131777 948511406 /nfs/dbraw/zinc/51/14/06/948511406.db2.gz PKTQQVSMFJMRHC-KRWDZBQOSA-N 0 0 356.378 3.713 20 5 FHBDRN Cc1ccc(NC(=O)N2CCN(c3cccc(F)c3)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000432483078 948553098 /nfs/dbraw/zinc/55/30/98/948553098.db2.gz MACZSFLFTUFWIK-AWEZNQCLSA-N 0 0 372.400 3.785 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)Nc1ccc(C)c(OC(C)C)c1 ZINC000279152736 948562618 /nfs/dbraw/zinc/56/26/18/948562618.db2.gz AOJPMRQDHCUOCW-UHFFFAOYSA-N 0 0 371.393 3.576 20 5 FHBDRN CC[C@H](NS(=O)(=O)c1ccccc1[N+](=O)[O-])c1ccc(Cl)s1 ZINC000512153077 948564677 /nfs/dbraw/zinc/56/46/77/948564677.db2.gz HCZOEPOPAUBQQM-VIFPVBQESA-N 0 0 360.844 3.739 20 5 FHBDRN O=[N+]([O-])c1ccc(N2CCC[C@H]2C2CCCC2)c(F)c1N1CCOCC1 ZINC000574842678 948566965 /nfs/dbraw/zinc/56/69/65/948566965.db2.gz HZHOSQJNXDVSKU-HNNXBMFYSA-N 0 0 363.433 3.730 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1C(=O)OCc1cccc(Br)c1 ZINC000019284986 948568448 /nfs/dbraw/zinc/56/84/48/948568448.db2.gz JAAPHKACPCOWQL-UHFFFAOYSA-N 0 0 366.167 3.723 20 5 FHBDRN O=[N+]([O-])c1cc2cnn(Cc3ncc(Br)s3)c2c(Cl)c1 ZINC000432493218 948585207 /nfs/dbraw/zinc/58/52/07/948585207.db2.gz JBYYPSDYLVAGEB-UHFFFAOYSA-N 0 0 373.619 3.865 20 5 FHBDRN Cc1nc(CCCC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)cs1 ZINC000129583386 948588269 /nfs/dbraw/zinc/58/82/69/948588269.db2.gz JAGXZQFEGAYGPL-UHFFFAOYSA-N 0 0 359.451 3.874 20 5 FHBDRN CC(C)(C)[C@H]1CN(C(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)CCO1 ZINC000279197479 948605838 /nfs/dbraw/zinc/60/58/38/948605838.db2.gz CUJGGYFSISIXEE-LJQANCHMSA-N 0 0 364.445 3.981 20 5 FHBDRN Cc1nc2ccc(NC(=O)c3cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c3)cc2o1 ZINC000126004196 948619898 /nfs/dbraw/zinc/61/98/98/948619898.db2.gz FRUURXBOYGDLPT-UHFFFAOYSA-N 0 0 356.294 3.513 20 5 FHBDRN Cc1cc(C(=O)NCc2c(Cl)cccc2Cl)c(N)c([N+](=O)[O-])c1 ZINC000729522616 948642072 /nfs/dbraw/zinc/64/20/72/948642072.db2.gz RYUDDOMCFHLHHU-UHFFFAOYSA-N 0 0 354.193 3.722 20 5 FHBDRN CCN(c1ccc(C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cn1)C(C)C ZINC000512172662 948642974 /nfs/dbraw/zinc/64/29/74/948642974.db2.gz MZPHASOTFHUICK-AWEZNQCLSA-N 0 0 356.426 3.716 20 5 FHBDRN CCSCc1ccnc(NC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)c1 ZINC000536461221 948662917 /nfs/dbraw/zinc/66/29/17/948662917.db2.gz TXBWJLWGVFBSBC-UHFFFAOYSA-N 0 0 356.407 3.977 20 5 FHBDRN CCOC1CC(N(C)C(=O)c2cc([N+](=O)[O-])ccc2SCC(C)C)C1 ZINC000571719256 948669498 /nfs/dbraw/zinc/66/94/98/948669498.db2.gz XVQCOAZXMRADBN-UHFFFAOYSA-N 0 0 366.483 3.982 20 5 FHBDRN C[C@H]1C[C@@H](c2cccnc2)N(C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000182109261 948706566 /nfs/dbraw/zinc/70/65/66/948706566.db2.gz DKUMSOGUVPAEQC-DJJJIMSYSA-N 0 0 364.405 3.623 20 5 FHBDRN O=C(c1c[nH]c2cccc([N+](=O)[O-])c12)N(Cc1ccco1)CC(F)(F)F ZINC000536479929 948716627 /nfs/dbraw/zinc/71/66/27/948716627.db2.gz GKPVQVUZTFPJQZ-UHFFFAOYSA-N 0 0 367.283 3.874 20 5 FHBDRN C[C@@H](Cc1cccc(O)c1)NC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000427631750 948733142 /nfs/dbraw/zinc/73/31/42/948733142.db2.gz SMHMDKXGOVMYQA-JTQLQIEISA-N 0 0 368.311 3.680 20 5 FHBDRN COc1ccc(CNC(=O)[C@@H](C)Cn2ccc3ccccc32)cc1[N+](=O)[O-] ZINC000507809664 948745176 /nfs/dbraw/zinc/74/51/76/948745176.db2.gz VIJVFDBKVFMQSB-AWEZNQCLSA-N 0 0 367.405 3.511 20 5 FHBDRN Cc1cccc([N+](=O)[O-])c1C(=O)O[C@H](C)C(=O)c1ccc2c(c1)CCC2 ZINC000026119191 948752022 /nfs/dbraw/zinc/75/20/22/948752022.db2.gz VVHSOJUGKFFOPJ-CYBMUJFWSA-N 0 0 353.374 3.820 20 5 FHBDRN C[C@@H]1CO[C@@H](C)CN1C(=O)c1ccccc1Sc1ccccc1[N+](=O)[O-] ZINC000440743768 948755320 /nfs/dbraw/zinc/75/53/20/948755320.db2.gz BFXHMDJEEKVHDG-KGLIPLIRSA-N 0 0 372.446 3.995 20 5 FHBDRN C[C@H](NC(=O)CCC(=O)c1ccc(F)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000087142612 948756811 /nfs/dbraw/zinc/75/68/11/948756811.db2.gz DQCRDBMMTLFRBC-NSHDSACASA-N 0 0 362.332 3.713 20 5 FHBDRN COc1ccc(C(=O)NCCCSc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000015497499 948759116 /nfs/dbraw/zinc/75/91/16/948759116.db2.gz QXILSWZTOXBUHA-UHFFFAOYSA-N 0 0 364.398 3.655 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1)[nH]cc2-c1nc(-c2ccc(-c3nnco3)cc2)no1 ZINC000445394059 948763084 /nfs/dbraw/zinc/76/30/84/948763084.db2.gz RJASVJLVPXURNQ-UHFFFAOYSA-N 0 0 374.316 3.843 20 5 FHBDRN CCOc1cc(-c2noc(CCc3cccc([N+](=O)[O-])c3)n2)ccc1O ZINC000445427219 948787597 /nfs/dbraw/zinc/78/75/97/948787597.db2.gz OCLXMCGZASEAGR-UHFFFAOYSA-N 0 0 355.350 3.534 20 5 FHBDRN Cn1c(-c2ccc([N+](=O)[O-])cc2)nnc1N1CCCC2(CCCCC2)C1 ZINC000508528947 948799113 /nfs/dbraw/zinc/79/91/13/948799113.db2.gz WSPFPLVNPBWCHI-UHFFFAOYSA-N 0 0 355.442 3.941 20 5 FHBDRN COCCCCNC(=O)c1ccccc1Sc1ccccc1[N+](=O)[O-] ZINC000440760579 948806354 /nfs/dbraw/zinc/80/63/54/948806354.db2.gz MWLCZJKYTOWLAS-UHFFFAOYSA-N 0 0 360.435 3.902 20 5 FHBDRN Cc1ccccc1[C@@H]1CN(C(=O)NCc2cccc([N+](=O)[O-])c2)[C@H](C)CO1 ZINC000073900252 948816606 /nfs/dbraw/zinc/81/66/06/948816606.db2.gz TYEQBXBNIHFUAB-BEFAXECRSA-N 0 0 369.421 3.575 20 5 FHBDRN CCCC(=O)Nc1ccc(C(=O)COc2cc(C)ccc2[N+](=O)[O-])cc1 ZINC000021615803 948818124 /nfs/dbraw/zinc/81/81/24/948818124.db2.gz MUUSBJUPQJPEGA-UHFFFAOYSA-N 0 0 356.378 3.904 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCC(=O)Nc2cccc(C(F)(F)F)c2)c1 ZINC000021613985 948819147 /nfs/dbraw/zinc/81/91/47/948819147.db2.gz IARYNZOIHPDGOS-UHFFFAOYSA-N 0 0 354.284 3.940 20 5 FHBDRN COc1ccc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)c2ccccc12 ZINC000003103932 219486233 /nfs/dbraw/zinc/48/62/33/219486233.db2.gz LZTLVCBIGNEDSJ-UHFFFAOYSA-N 0 0 367.317 3.917 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1OCC(=O)Nc1ccccc1C(F)(F)F ZINC000006290786 219723859 /nfs/dbraw/zinc/72/38/59/219723859.db2.gz WVDMXSPHJWRPEH-UHFFFAOYSA-N 0 0 370.283 3.640 20 5 FHBDRN Cc1nnc(-c2cccc(NCc3ccc(Cl)c([N+](=O)[O-])c3)c2)n1C ZINC000359975076 223140850 /nfs/dbraw/zinc/14/08/50/223140850.db2.gz CONIYVYFDWCKFZ-UHFFFAOYSA-N 0 0 357.801 3.964 20 5 FHBDRN O=C(NCc1ccc(Cl)cc1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000015340636 220152197 /nfs/dbraw/zinc/15/21/97/220152197.db2.gz WPOHDGIROKYVPY-UHFFFAOYSA-N 0 0 359.813 3.778 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)Cc1csc(-c2ccccn2)n1 ZINC000015629636 220157986 /nfs/dbraw/zinc/15/79/86/220157986.db2.gz ARGAGAQYILASQM-UHFFFAOYSA-N 0 0 354.391 3.603 20 5 FHBDRN C[C@@H](NC(=O)Cc1ccccc1[N+](=O)[O-])c1ccc(Br)cc1 ZINC000015621311 220158011 /nfs/dbraw/zinc/15/80/11/220158011.db2.gz FVNLLFLCVDMYTK-LLVKDONJSA-N 0 0 363.211 3.777 20 5 FHBDRN CSc1ccc(C(=O)NCCc2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000017297238 220211195 /nfs/dbraw/zinc/21/11/95/220211195.db2.gz BTBRHXMVNPSMAX-UHFFFAOYSA-N 0 0 350.827 3.943 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1)N1CCC[C@H]1c1ccc2c(c1)OCCO2 ZINC000018175878 220226537 /nfs/dbraw/zinc/22/65/37/220226537.db2.gz WFKIZIXKMBIPLF-INIZCTEOSA-N 0 0 369.377 3.735 20 5 FHBDRN Cc1cc(C)n(-c2ccc(C(=O)Nc3cc([N+](=O)[O-])ccc3C)cc2)n1 ZINC000019160795 220239423 /nfs/dbraw/zinc/23/94/23/220239423.db2.gz XQUZPUUQSFCBOF-UHFFFAOYSA-N 0 0 350.378 3.958 20 5 FHBDRN Cc1nn([C@H](C)C(=O)Nc2c(C)cc(C)cc2Cl)c(C)c1[N+](=O)[O-] ZINC000021549706 220359399 /nfs/dbraw/zinc/35/93/99/220359399.db2.gz KCGCJNUUBXFYFV-GFCCVEGCSA-N 0 0 350.806 3.878 20 5 FHBDRN O=C(Nc1nc(-c2ccc3c(c2)OCO3)cs1)c1ccccc1[N+](=O)[O-] ZINC000021273027 220355763 /nfs/dbraw/zinc/35/57/63/220355763.db2.gz IGELTWWMWDFYEI-UHFFFAOYSA-N 0 0 369.358 3.699 20 5 FHBDRN NC(=O)Nc1ccc(CNC(=O)c2cc3ccccc3c3cccnc23)cc1 ZINC000042108130 220935586 /nfs/dbraw/zinc/93/55/86/220935586.db2.gz CEDKMOCANSCGCO-UHFFFAOYSA-N 0 0 370.412 3.809 20 5 FHBDRN CCC(=O)Nc1ccc(Cl)c(NC(=O)Cc2ccccc2[N+](=O)[O-])c1 ZINC000046184453 220982265 /nfs/dbraw/zinc/98/22/65/220982265.db2.gz QJCWLERNQYCCQH-UHFFFAOYSA-N 0 0 361.785 3.778 20 5 FHBDRN Cc1ccc(O)c(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])c1 ZINC000050177294 221030629 /nfs/dbraw/zinc/03/06/29/221030629.db2.gz CBXDTUUYCGCKCF-UHFFFAOYSA-N 0 0 370.283 3.802 20 5 FHBDRN CCCN(CC(=O)Nc1ccccc1C)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000051452262 221036148 /nfs/dbraw/zinc/03/61/48/221036148.db2.gz WXFXRORALUYIGF-UHFFFAOYSA-N 0 0 371.437 3.763 20 5 FHBDRN O=[N+]([O-])c1cc(CN(Cc2ccco2)C2CCCC2)c2c(c1)COCO2 ZINC000052077145 221037576 /nfs/dbraw/zinc/03/75/76/221037576.db2.gz UYEVAWHFQCIEBJ-UHFFFAOYSA-N 0 0 358.394 3.999 20 5 FHBDRN Nc1ccc(C(=O)Nc2nc(-c3cccc(F)c3)cs2)cc1[N+](=O)[O-] ZINC000052611790 221039260 /nfs/dbraw/zinc/03/92/60/221039260.db2.gz YOUINNWEEUNPEB-UHFFFAOYSA-N 0 0 358.354 3.692 20 5 FHBDRN CN(Cc1csc2ccccc12)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000056063517 221076803 /nfs/dbraw/zinc/07/68/03/221076803.db2.gz YAEYHSDYTDKLCF-UHFFFAOYSA-N 0 0 362.432 3.630 20 5 FHBDRN O=C(Nc1cccc([N+](=O)[O-])c1)N[C@@H](c1ccc(F)cc1)[C@@H]1CCCO1 ZINC000056347153 221080412 /nfs/dbraw/zinc/08/04/12/221080412.db2.gz WFOPMSGSMPQOIO-IRXDYDNUSA-N 0 0 359.357 3.776 20 5 FHBDRN CCN(Cc1ccc(Cl)s1)S(=O)(=O)c1ccccc1[N+](=O)[O-] ZINC000057525282 221090245 /nfs/dbraw/zinc/09/02/45/221090245.db2.gz FZXKGZZFYANPEK-UHFFFAOYSA-N 0 0 360.844 3.521 20 5 FHBDRN O=C(CSc1ccc(C(F)(F)F)cn1)Nc1ccccc1[N+](=O)[O-] ZINC000057605857 221092363 /nfs/dbraw/zinc/09/23/63/221092363.db2.gz KQYZUQSIFYIAEY-UHFFFAOYSA-N 0 0 357.313 3.739 20 5 FHBDRN Cc1ncc([N+](=O)[O-])n1CCOc1ccc(Cl)cc1Br ZINC000060803880 221132469 /nfs/dbraw/zinc/13/24/69/221132469.db2.gz FMODOIAKVVGBTR-UHFFFAOYSA-N 0 0 360.595 3.595 20 5 FHBDRN Cc1c(OCC(=O)Nc2ccc(C(F)(F)F)cc2)cccc1[N+](=O)[O-] ZINC000060810134 221132573 /nfs/dbraw/zinc/13/25/73/221132573.db2.gz BMIPFQXACWFTFG-UHFFFAOYSA-N 0 0 354.284 3.940 20 5 FHBDRN COc1ccc(C(=O)Nc2ccc(C)c(Br)c2)cc1[N+](=O)[O-] ZINC000071845715 221382693 /nfs/dbraw/zinc/38/26/93/221382693.db2.gz CYBDEJXKLCPSGU-UHFFFAOYSA-N 0 0 365.183 3.927 20 5 FHBDRN Cc1ccc([C@@H](CNc2ccc([N+](=O)[O-])cc2F)N2CCOCC2)cc1 ZINC000071968899 221391429 /nfs/dbraw/zinc/39/14/29/221391429.db2.gz HKXQCEAPKAQWSO-LJQANCHMSA-N 0 0 359.401 3.528 20 5 FHBDRN O=C(/C=C/c1ccc(Cl)cc1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000005394814 132304380 /nfs/dbraw/zinc/30/43/80/132304380.db2.gz UIUCAFUQIUOCNO-XCVCLJGOSA-N 0 0 371.824 3.610 20 5 FHBDRN CC(=O)c1ccc(NCc2cc(Cl)c3c(c2)OCCO3)c([N+](=O)[O-])c1 ZINC000097286522 222173570 /nfs/dbraw/zinc/17/35/70/222173570.db2.gz IZMNLUQLKJNLIA-UHFFFAOYSA-N 0 0 362.769 3.834 20 5 FHBDRN CN(Cc1ccc(C(F)(F)F)cc1)c1nc2ccccn2c1[N+](=O)[O-] ZINC000105133130 222364902 /nfs/dbraw/zinc/36/49/02/222364902.db2.gz AMOMNIZOEOSBIZ-UHFFFAOYSA-N 0 0 350.300 3.898 20 5 FHBDRN CCOc1ccc([C@@H](C)NC(=O)c2cc([N+](=O)[O-])ccc2N(C)C)cc1 ZINC000105376068 222368376 /nfs/dbraw/zinc/36/83/76/222368376.db2.gz DWHHYJGAEBZIQN-CYBMUJFWSA-N 0 0 357.410 3.551 20 5 FHBDRN Cc1cccc(C(=O)NCCc2ccccc2Br)c1[N+](=O)[O-] ZINC000109483819 222462403 /nfs/dbraw/zinc/46/24/03/222462403.db2.gz YRAUROWOEJSLGO-UHFFFAOYSA-N 0 0 363.211 3.638 20 5 FHBDRN Cc1ccc([N+](=O)[O-])c(OCC(=O)c2ccc(Br)s2)c1 ZINC000021614342 263384319 /nfs/dbraw/zinc/38/43/19/263384319.db2.gz CTAJVKOEALSUDC-UHFFFAOYSA-N 0 0 356.197 3.989 20 5 FHBDRN Cc1ccc(N(C)C(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)nc1 ZINC000584651914 567823133 /nfs/dbraw/zinc/82/31/33/567823133.db2.gz GBOGOLMTDQANQG-UHFFFAOYSA-N 0 0 354.391 3.698 20 5 FHBDRN COCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H](C2CC2)C1 ZINC000290929594 567823718 /nfs/dbraw/zinc/82/37/18/567823718.db2.gz OTZIKVXAOZPSNX-CQSZACIVSA-N 0 0 364.467 3.596 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)NCc1c(F)cccc1N1CCCC1 ZINC000568063362 567823744 /nfs/dbraw/zinc/82/37/44/567823744.db2.gz DHUIKXAPZSIEFL-UHFFFAOYSA-N 0 0 372.400 3.964 20 5 FHBDRN Cc1c(C(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)sc2nccn12 ZINC000452861766 567830480 /nfs/dbraw/zinc/83/04/80/567830480.db2.gz UPLRLBAHCJQJRZ-CQSZACIVSA-N 0 0 370.434 3.632 20 5 FHBDRN O=C(COc1ccccc1F)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452863882 567835644 /nfs/dbraw/zinc/83/56/44/567835644.db2.gz FEMCJQXKIMDSMF-OAHLLOKOSA-N 0 0 358.369 3.519 20 5 FHBDRN C[C@@H]1C[N@@H+](Cc2ccccc2NCCc2ccc([N+](=O)[O-])cc2)C[C@H](C)O1 ZINC000541798912 567852436 /nfs/dbraw/zinc/85/24/36/567852436.db2.gz AWBBALITSUUEPH-CALCHBBNSA-N 0 0 369.465 3.859 20 5 FHBDRN COc1c(C)ccc(NS(=O)(=O)c2cc(C)cc([N+](=O)[O-])c2C)c1C ZINC000541801179 567856868 /nfs/dbraw/zinc/85/68/68/567856868.db2.gz XOOCUQLWYHYJLQ-UHFFFAOYSA-N 0 0 364.423 3.638 20 5 FHBDRN C[C@H](c1cccc(NCCc2ccc([N+](=O)[O-])cc2)c1)N1CCOCC1 ZINC000541799393 567857273 /nfs/dbraw/zinc/85/72/73/567857273.db2.gz GKJYYVVUPFMHGL-MRXNPFEDSA-N 0 0 355.438 3.643 20 5 FHBDRN CC(C)(CNC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)C1CCCCC1 ZINC000120360230 567880837 /nfs/dbraw/zinc/88/08/37/567880837.db2.gz VTEBOWKJONHROZ-UHFFFAOYSA-N 0 0 371.437 3.773 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N[C@H]1CC[C@H](Nc2ccccn2)CC1 ZINC000568146702 567942383 /nfs/dbraw/zinc/94/23/83/567942383.db2.gz XEYJKDKCJMFEIQ-WKILWMFISA-N 0 0 368.437 3.760 20 5 FHBDRN CN(C(=O)CCc1cccc(OC(C)(C)C)n1)c1ccc([N+](=O)[O-])cc1 ZINC000159191861 567946227 /nfs/dbraw/zinc/94/62/27/567946227.db2.gz VAIGYNYVTZCAFH-UHFFFAOYSA-N 0 0 357.410 3.763 20 5 FHBDRN COC(=O)c1cc(C)nc(N[C@@H]2CCc3sc(Cl)cc32)c1[N+](=O)[O-] ZINC000568151019 567947915 /nfs/dbraw/zinc/94/79/15/567947915.db2.gz DMQQFGQZFRSWNH-SNVBAGLBSA-N 0 0 367.814 3.899 20 5 FHBDRN Cc1cccc(C)c1OC[C@H](O)Cn1ccnc1-c1ccc([N+](=O)[O-])cc1 ZINC000051451855 567958746 /nfs/dbraw/zinc/95/87/46/567958746.db2.gz NWWOCOIBAWUKMO-GOSISDBHSA-N 0 0 367.405 3.515 20 5 FHBDRN Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN[C@H](C(C)(C)C)C(F)(F)F ZINC000541846217 567960186 /nfs/dbraw/zinc/96/01/86/567960186.db2.gz CQLDTOFWPSZCTP-CQSZACIVSA-N 0 0 361.364 3.798 20 5 FHBDRN Cc1c(CNC(=O)Cc2csc(-c3ccccc3)n2)cccc1[N+](=O)[O-] ZINC000481468158 567965573 /nfs/dbraw/zinc/96/55/73/567965573.db2.gz WDTAMNCUQUZTSF-UHFFFAOYSA-N 0 0 367.430 3.886 20 5 FHBDRN Cc1c(CNC(=O)c2c[nH]nc2-c2c(F)cccc2F)cccc1[N+](=O)[O-] ZINC000481465994 567965796 /nfs/dbraw/zinc/96/57/96/567965796.db2.gz LKQFNUOWNPFUHA-UHFFFAOYSA-N 0 0 372.331 3.502 20 5 FHBDRN Cc1onc(-c2ccccc2)c1C(=O)NCc1cccc([N+](=O)[O-])c1C ZINC000481467242 567970340 /nfs/dbraw/zinc/97/03/40/567970340.db2.gz UGKTUPXFAHNZEO-UHFFFAOYSA-N 0 0 351.362 3.797 20 5 FHBDRN Cc1c(CNC(=O)COc2cc(Cl)cc(Cl)c2)cccc1[N+](=O)[O-] ZINC000481468291 567970356 /nfs/dbraw/zinc/97/03/56/567970356.db2.gz SEMSIIYERXALIA-UHFFFAOYSA-N 0 0 369.204 3.905 20 5 FHBDRN Cc1c(CNC(=O)[C@@H](C)CC(=O)c2ccccc2F)cccc1[N+](=O)[O-] ZINC000481482133 567976466 /nfs/dbraw/zinc/97/64/66/567976466.db2.gz WNLCVEAOVJATFE-LBPRGKRZSA-N 0 0 358.369 3.568 20 5 FHBDRN Cc1c(CNC(=O)C[C@H](C)C(=O)c2cccc(F)c2)cccc1[N+](=O)[O-] ZINC000481476491 567977344 /nfs/dbraw/zinc/97/73/44/567977344.db2.gz MIVDWIJGEKGAGG-LBPRGKRZSA-N 0 0 358.369 3.568 20 5 FHBDRN COCCCOc1ccccc1NCc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602490016 567986072 /nfs/dbraw/zinc/98/60/72/567986072.db2.gz BRZDZRBOCNLBLC-UHFFFAOYSA-N 0 0 357.366 3.763 20 5 FHBDRN Cn1nc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000481489659 567988452 /nfs/dbraw/zinc/98/84/52/567988452.db2.gz DYZZHPBYNRSAFU-GFCCVEGCSA-N 0 0 369.208 3.612 20 5 FHBDRN Cn1nc([N+](=O)[O-])cc1C(=O)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000481489660 567992325 /nfs/dbraw/zinc/99/23/25/567992325.db2.gz DYZZHPBYNRSAFU-LBPRGKRZSA-N 0 0 369.208 3.612 20 5 FHBDRN Cn1ccc2cccc(NC3CCN(c4ccc([N+](=O)[O-])nc4)CC3)c21 ZINC000602630203 568007620 /nfs/dbraw/zinc/00/76/20/568007620.db2.gz LPFKYRBEFILOPO-UHFFFAOYSA-N 0 0 351.410 3.562 20 5 FHBDRN CN(CCc1ccccc1[N+](=O)[O-])C(=O)c1ccc2c(c1)CCCCC2=O ZINC000568338250 568026257 /nfs/dbraw/zinc/02/62/57/568026257.db2.gz YWXIIOSSXUMFBY-UHFFFAOYSA-N 0 0 366.417 3.819 20 5 FHBDRN Cc1sc(C(=O)N[C@@H]2CCO[C@@H]2c2ccc(F)c(F)c2)cc1[N+](=O)[O-] ZINC000181863508 568029229 /nfs/dbraw/zinc/02/92/29/568029229.db2.gz JGYMCVZOTDUUBC-IUODEOHRSA-N 0 0 368.361 3.503 20 5 FHBDRN C[C@H](C(=O)Nc1cc(Br)ccc1O)c1cccc([N+](=O)[O-])c1 ZINC000568361949 568033494 /nfs/dbraw/zinc/03/34/94/568033494.db2.gz RTECRMVWRHQKQO-VIFPVBQESA-N 0 0 365.183 3.805 20 5 FHBDRN C[C@H](C(=O)NCCc1c[nH]c2ccc(F)cc12)c1ccc([N+](=O)[O-])cc1F ZINC000568496771 568037388 /nfs/dbraw/zinc/03/73/88/568037388.db2.gz YMGCDAMJXFOVEY-NSHDSACASA-N 0 0 373.359 3.817 20 5 FHBDRN Cc1cc(N2CCCC[C@@H]2C)ccc1Nc1nccc(C(N)=O)c1[N+](=O)[O-] ZINC000568497177 568037409 /nfs/dbraw/zinc/03/74/09/568037409.db2.gz IHDWLZQHRVQUMJ-ZDUSSCGKSA-N 0 0 369.425 3.520 20 5 FHBDRN COC[C@@H](NC(=O)c1c[nH]c2cccc([N+](=O)[O-])c21)c1cccc(Cl)c1 ZINC000568456638 568040016 /nfs/dbraw/zinc/04/00/16/568040016.db2.gz JBCHZELINLFTHK-OAHLLOKOSA-N 0 0 373.796 3.847 20 5 FHBDRN C[C@@H](c1ccc2ccccc2c1)N(C(=O)c1cc([N+](=O)[O-])nn1C)C1CC1 ZINC000481561802 568048145 /nfs/dbraw/zinc/04/81/45/568048145.db2.gz ZHASTKJZWCBFEL-ZDUSSCGKSA-N 0 0 364.405 3.847 20 5 FHBDRN C[C@H]([NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1)c1cccc(N2CCCC2)c1 ZINC000181873122 568049540 /nfs/dbraw/zinc/04/95/40/568049540.db2.gz HVEWWEXITLBLRI-MGPUTAFESA-N 0 0 355.438 3.579 20 5 FHBDRN CC[C@H](N[C@@H](Cc1ccc(C)cc1)C(=O)OC)c1cccc([N+](=O)[O-])c1 ZINC000481578065 568060539 /nfs/dbraw/zinc/06/05/39/568060539.db2.gz BTHAMHQWEQGOLU-OALUTQOASA-N 0 0 356.422 3.728 20 5 FHBDRN CCN(C(=O)NCc1cc([N+](=O)[O-])ccc1Cl)[C@H]1CCOC(C)(C)C1 ZINC000291149493 568064003 /nfs/dbraw/zinc/06/40/03/568064003.db2.gz XRTVSVHSIXPJQM-AWEZNQCLSA-N 0 0 369.849 3.737 20 5 FHBDRN CN(Cc1cnn(-c2ccccc2)c1)C(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000128595460 568064774 /nfs/dbraw/zinc/06/47/74/568064774.db2.gz IMHHFEBPYFUBRG-UHFFFAOYSA-N 0 0 370.796 3.706 20 5 FHBDRN CC(C)n1cc(NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)cn1 ZINC000066386826 568066193 /nfs/dbraw/zinc/06/61/93/568066193.db2.gz IEXHSUFMFSWKLL-UHFFFAOYSA-N 0 0 357.395 3.748 20 5 FHBDRN O=C(NC[C@@H]1CCC2(CCCCC2)O1)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000481631909 568072138 /nfs/dbraw/zinc/07/21/38/568072138.db2.gz UYQUAUDRZXOZKE-AWEZNQCLSA-N 0 0 369.421 3.755 20 5 FHBDRN CCOc1ccc(C(=O)NC[C@@H]2CCC3(CCCCC3)O2)cc1[N+](=O)[O-] ZINC000481623543 568072147 /nfs/dbraw/zinc/07/21/47/568072147.db2.gz NGQYNYKKJLMEJO-HNNXBMFYSA-N 0 0 362.426 3.605 20 5 FHBDRN O=C(Nc1ccccc1OC(F)F)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000067021707 568073266 /nfs/dbraw/zinc/07/32/66/568073266.db2.gz LICQCABUIRRGGL-UHFFFAOYSA-N 0 0 374.303 3.634 20 5 FHBDRN O=C(CCCNc1ccc([N+](=O)[O-])cc1)N[C@@H]1C[C@@H]1c1cccc(F)c1 ZINC000067333991 568077127 /nfs/dbraw/zinc/07/71/27/568077127.db2.gz QDXTYLNKGXGQEW-QZTJIDSGSA-N 0 0 357.385 3.598 20 5 FHBDRN O=C(Nc1ccccc1Cl)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000051559838 568080072 /nfs/dbraw/zinc/08/00/72/568080072.db2.gz VYPDEMHGNOGFBA-UHFFFAOYSA-N 0 0 360.801 3.602 20 5 FHBDRN O=C(NCc1ccc(C2CC2)cc1)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000481646968 568080177 /nfs/dbraw/zinc/08/01/77/568080177.db2.gz QNDGWCZXUBDVFY-UHFFFAOYSA-N 0 0 362.389 3.588 20 5 FHBDRN Cc1c2ccccc2oc1[C@@H](C)NC(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000481652294 568080554 /nfs/dbraw/zinc/08/05/54/568080554.db2.gz GLGMNPOPUKANHZ-CYBMUJFWSA-N 0 0 354.362 3.906 20 5 FHBDRN COCCOCc1cccc(NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000056979316 568089195 /nfs/dbraw/zinc/08/91/95/568089195.db2.gz YWWPRUFRAZTPBQ-UHFFFAOYSA-N 0 0 364.785 3.664 20 5 FHBDRN CCOc1ccc(C2(CNc3nc(C)ccc3[N+](=O)[O-])CCOCC2)cc1 ZINC000481694401 568092354 /nfs/dbraw/zinc/09/23/54/568092354.db2.gz TZHHSYHFAXPKLT-UHFFFAOYSA-N 0 0 371.437 3.857 20 5 FHBDRN CC(C)N(C(=O)CCn1cc([N+](=O)[O-])cn1)c1cccc(C(F)(F)F)c1 ZINC000159290603 568097753 /nfs/dbraw/zinc/09/77/53/568097753.db2.gz QCYOSHSWMGPZJZ-UHFFFAOYSA-N 0 0 370.331 3.642 20 5 FHBDRN CCNc1ccc(C(=O)Nc2ccc(OCC(F)F)cc2)cc1[N+](=O)[O-] ZINC000481726582 568098348 /nfs/dbraw/zinc/09/83/48/568098348.db2.gz HBTVJEAXXJQLMX-UHFFFAOYSA-N 0 0 365.336 3.923 20 5 FHBDRN CCc1nc(CNC(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)cs1 ZINC000568657928 568112925 /nfs/dbraw/zinc/11/29/25/568112925.db2.gz FRHBXHLTFMGALP-UHFFFAOYSA-N 0 0 359.329 3.563 20 5 FHBDRN CCCn1ncc(NC(=O)c2c(OCC)cccc2[N+](=O)[O-])c1C1CC1 ZINC000452990183 568121797 /nfs/dbraw/zinc/12/17/97/568121797.db2.gz OMYXIIATARJUPZ-UHFFFAOYSA-N 0 0 358.398 3.730 20 5 FHBDRN CCOc1ccccc1N(C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000159306036 568122528 /nfs/dbraw/zinc/12/25/28/568122528.db2.gz XWGVNRDNFRCSNB-UHFFFAOYSA-N 0 0 363.801 3.722 20 5 FHBDRN CCSc1ccc([N+](=O)[O-])cc1C(=O)NCCOc1ccc(F)cc1 ZINC000481774093 568123558 /nfs/dbraw/zinc/12/35/58/568123558.db2.gz ILHRLCFHVMHYLY-UHFFFAOYSA-N 0 0 364.398 3.655 20 5 FHBDRN CC1(C)C[C@@H](Nc2ccc(C(N)=O)cc2[N+](=O)[O-])c2ccc(F)cc2O1 ZINC000481810719 568129044 /nfs/dbraw/zinc/12/90/44/568129044.db2.gz AFOFIEIGYIXRTL-CQSZACIVSA-N 0 0 359.357 3.547 20 5 FHBDRN O=[N+]([O-])c1cccc(CSc2nnc([C@@H]3COc4ccccc4O3)o2)c1 ZINC000026435703 568133840 /nfs/dbraw/zinc/13/38/40/568133840.db2.gz QSQQYZZGXPVUKI-HNNXBMFYSA-N 0 0 371.374 3.783 20 5 FHBDRN COc1cc(C(=O)N[C@@H](c2ccccc2)C(F)F)cc([N+](=O)[O-])c1C ZINC000481825734 568138463 /nfs/dbraw/zinc/13/84/63/568138463.db2.gz ORYHPQUKCGITSL-HNNXBMFYSA-N 0 0 350.321 3.648 20 5 FHBDRN O=[N+]([O-])c1ccc(NCC[C@H]2COc3ccccc3O2)c2ccncc21 ZINC000481839447 568145886 /nfs/dbraw/zinc/14/58/86/568145886.db2.gz NBKXHXBRTVIVCQ-ZDUSSCGKSA-N 0 0 351.362 3.785 20 5 FHBDRN CCc1ccc([C@H]2CCN(C(=O)c3cccc(OC)c3[N+](=O)[O-])C2)cc1 ZINC000584672947 568146378 /nfs/dbraw/zinc/14/63/78/568146378.db2.gz SMGBDNNKHSWSRE-INIZCTEOSA-N 0 0 354.406 3.796 20 5 FHBDRN O=C(c1cccc([N+](=O)[O-])c1)N1CCc2c(Br)cccc2C1 ZINC000128674222 568153489 /nfs/dbraw/zinc/15/34/89/568153489.db2.gz FOVUYOXVUUVJCY-UHFFFAOYSA-N 0 0 361.195 3.556 20 5 FHBDRN Cc1ccc(C(=O)N[C@@H](C[C@H]2CCOC2)c2ccccc2)cc1[N+](=O)[O-] ZINC000159350211 568159039 /nfs/dbraw/zinc/15/90/39/568159039.db2.gz RGXANZAZLOWXMP-QAPCUYQASA-N 0 0 354.406 3.801 20 5 FHBDRN COC(=O)c1cc(OCC(=O)C23CC4CC(CC(C4)C2)C3)ccc1[N+](=O)[O-] ZINC000481894416 568167941 /nfs/dbraw/zinc/16/79/41/568167941.db2.gz ATVSFSASXPYXBD-UHFFFAOYSA-N 0 0 373.405 3.546 20 5 FHBDRN CCCc1ccc(C(=O)COc2ccc([N+](=O)[O-])c(C(=O)OC)c2)cc1 ZINC000481901846 568168458 /nfs/dbraw/zinc/16/84/58/568168458.db2.gz RSMDMXSCJMKWMS-UHFFFAOYSA-N 0 0 357.362 3.596 20 5 FHBDRN Cc1cc(C(=O)N2CCN(Cc3ccccc3Cl)CC2)cc([N+](=O)[O-])c1 ZINC000481912523 568178251 /nfs/dbraw/zinc/17/82/51/568178251.db2.gz XRNBLRARUJZGHQ-UHFFFAOYSA-N 0 0 373.840 3.515 20 5 FHBDRN COC(=O)c1cc(OCc2cccc(OC(F)F)c2)ccc1[N+](=O)[O-] ZINC000481903502 568180895 /nfs/dbraw/zinc/18/08/95/568180895.db2.gz WERSQSISDCXVLX-UHFFFAOYSA-N 0 0 353.277 3.562 20 5 FHBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)c1cccc(NC(=O)C2CC2)c1 ZINC000291510866 568182030 /nfs/dbraw/zinc/18/20/30/568182030.db2.gz WMWDEXYXROFEGZ-UHFFFAOYSA-N 0 0 353.378 3.758 20 5 FHBDRN Cc1c(OC(=O)CCc2nnc(-c3ccsc3)o2)cccc1[N+](=O)[O-] ZINC000051705738 568186551 /nfs/dbraw/zinc/18/65/51/568186551.db2.gz PAJCZMKBKWGKLK-UHFFFAOYSA-N 0 0 359.363 3.553 20 5 FHBDRN O=C(CCC1CCCCC1)N1CCN(Cc2ccccc2[N+](=O)[O-])CC1 ZINC000603935566 568188115 /nfs/dbraw/zinc/18/81/15/568188115.db2.gz KZBKRELTYJEHBP-UHFFFAOYSA-N 0 0 359.470 3.600 20 5 FHBDRN Cc1ccc(NC(=O)CNc2ccccc2[N+](=O)[O-])cc1-c1ncco1 ZINC000128709620 568193825 /nfs/dbraw/zinc/19/38/25/568193825.db2.gz ABLGTVUECWPQKS-UHFFFAOYSA-N 0 0 352.350 3.609 20 5 FHBDRN COC(=O)c1cc(OCc2coc(-c3ccc(C)cc3)n2)ccc1[N+](=O)[O-] ZINC000481942516 568195097 /nfs/dbraw/zinc/19/50/97/568195097.db2.gz KWESAXRKNMBGLU-UHFFFAOYSA-N 0 0 368.345 3.924 20 5 FHBDRN CC(C)[C@@H](C)NC(=O)COc1ccc(Cc2ccccc2)cc1[N+](=O)[O-] ZINC000481954331 568196863 /nfs/dbraw/zinc/19/68/63/568196863.db2.gz BCAPXKZUPSADBD-OAHLLOKOSA-N 0 0 356.422 3.725 20 5 FHBDRN Cc1ccc([C@@H](C)NS(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000604040079 568202830 /nfs/dbraw/zinc/20/28/30/568202830.db2.gz FPDAYJGFNZOIHU-LLVKDONJSA-N 0 0 354.815 3.596 20 5 FHBDRN NC(=O)c1cccc(COc2ccc(Cc3ccccc3)cc2[N+](=O)[O-])c1 ZINC000481984136 568215476 /nfs/dbraw/zinc/21/54/76/568215476.db2.gz UQYLCLIXCQKKAK-UHFFFAOYSA-N 0 0 362.385 3.864 20 5 FHBDRN COC(=O)c1cc(OCc2cc(Cl)ccc2OC)ccc1[N+](=O)[O-] ZINC000481990226 568215908 /nfs/dbraw/zinc/21/59/08/568215908.db2.gz PISMDHJVGAPNCA-UHFFFAOYSA-N 0 0 351.742 3.622 20 5 FHBDRN Cc1ccc(S(=O)(=O)N2CC(C)(C)[C@@H]2c2cccs2)c([N+](=O)[O-])c1 ZINC000568784349 568216419 /nfs/dbraw/zinc/21/64/19/568216419.db2.gz POVMGABWPBBFNA-HNNXBMFYSA-N 0 0 366.464 3.737 20 5 FHBDRN O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)N[C@@H](c1ccccc1)C(F)F ZINC000481993368 568221396 /nfs/dbraw/zinc/22/13/96/568221396.db2.gz XDMGREKZFRPZEZ-HNNXBMFYSA-N 0 0 356.275 3.538 20 5 FHBDRN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)N[C@H](c1ccccc1)C(F)F ZINC000481993886 568221414 /nfs/dbraw/zinc/22/14/14/568221414.db2.gz YONHTBHXJSBSFC-QGZVFWFLSA-N 0 0 359.332 3.672 20 5 FHBDRN CCSc1nnc(NC(=O)c2cc([N+](=O)[O-])ccc2SCC)s1 ZINC000481994548 568221548 /nfs/dbraw/zinc/22/15/48/568221548.db2.gz WKMAYGMDUQEMII-UHFFFAOYSA-N 0 0 370.481 3.923 20 5 FHBDRN CC(C)COc1ccccc1CNC(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000604199694 568225249 /nfs/dbraw/zinc/22/52/49/568225249.db2.gz XTLNNTCRZCCDLN-UHFFFAOYSA-N 0 0 371.437 3.748 20 5 FHBDRN C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000482004098 568226238 /nfs/dbraw/zinc/22/62/38/568226238.db2.gz BLIBJGDEGKNRPJ-WFASDCNBSA-N 0 0 373.375 3.976 20 5 FHBDRN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)c1nc(Cc2c(C)noc2C)no1 ZINC000568812290 568229624 /nfs/dbraw/zinc/22/96/24/568229624.db2.gz ACYNGNCWRHHPPB-CQSZACIVSA-N 0 0 356.382 3.910 20 5 FHBDRN CCOc1cc(NC(=O)N[C@H](C)c2ccccn2)c([N+](=O)[O-])cc1OCC ZINC000043838886 568230650 /nfs/dbraw/zinc/23/06/50/568230650.db2.gz GNJDZEQNXJWALG-GFCCVEGCSA-N 0 0 374.397 3.670 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1ncccc1OCC(F)F ZINC000482024094 568231912 /nfs/dbraw/zinc/23/19/12/568231912.db2.gz GLUVOFOCUAKYNF-UHFFFAOYSA-N 0 0 351.309 3.503 20 5 FHBDRN CC(C)[C@@H](CC(=O)NCCNc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000482027825 568232595 /nfs/dbraw/zinc/23/25/95/568232595.db2.gz XMFJDQJSHNYRPR-QGZVFWFLSA-N 0 0 355.438 3.953 20 5 FHBDRN CCOC(=O)c1ccc(NC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)cc1 ZINC000007473737 568234764 /nfs/dbraw/zinc/23/47/64/568234764.db2.gz FNXBZZBMVBTJPL-LBPRGKRZSA-N 0 0 374.418 3.891 20 5 FHBDRN C[C@H](CNC(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1)CC(F)(F)F ZINC000412652923 568246924 /nfs/dbraw/zinc/24/69/24/568246924.db2.gz JJISBQJNDWPNST-UWVGGRQHSA-N 0 0 350.362 3.780 20 5 FHBDRN CCO[C@H](C)c1nc(CN(C)c2nc(C)cc(C)c2[N+](=O)[O-])cs1 ZINC000541932921 568250790 /nfs/dbraw/zinc/25/07/90/568250790.db2.gz GMEXODFDYMRECT-GFCCVEGCSA-N 0 0 350.444 3.797 20 5 FHBDRN CCS[C@@H]1CCC[C@H]1NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000541926092 568251746 /nfs/dbraw/zinc/25/17/46/568251746.db2.gz UYWMDBAGHRTNSX-ZWNOBZJWSA-N 0 0 360.382 3.600 20 5 FHBDRN CC(C)c1n[nH]c(C(=O)N[C@H]2C[C@H](c3ccccc3Cl)C2)c1[N+](=O)[O-] ZINC000568909118 568251889 /nfs/dbraw/zinc/25/18/89/568251889.db2.gz RBMVEPAALNEQGD-XYPYZODXSA-N 0 0 362.817 3.771 20 5 FHBDRN Cc1cnc(C(C)(C)NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)s1 ZINC000541925865 568253201 /nfs/dbraw/zinc/25/32/01/568253201.db2.gz IKLQJHXKQCIKDR-UHFFFAOYSA-N 0 0 371.365 3.626 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(NCCOc2cccc(C(F)(F)F)n2)n1 ZINC000541933371 568253256 /nfs/dbraw/zinc/25/32/56/568253256.db2.gz IDRGHZGVNWRCND-UHFFFAOYSA-N 0 0 356.304 3.511 20 5 FHBDRN COc1ccc2c(c1NC(=O)c1c[nH]c3cccc([N+](=O)[O-])c13)CCC2 ZINC000482063658 568253425 /nfs/dbraw/zinc/25/34/25/568253425.db2.gz UXGRZNRJVCUSSJ-UHFFFAOYSA-N 0 0 351.362 3.826 20 5 FHBDRN C[C@@H]1CCCCN1C(=O)COc1ccc([N+](=O)[O-])cc1Cc1ccccc1 ZINC000016458845 568256495 /nfs/dbraw/zinc/25/64/95/568256495.db2.gz XRBHSEDKTVDMII-MRXNPFEDSA-N 0 0 368.433 3.965 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(N2CCC[C@@H]2Cn2cnc3ccccc32)n1 ZINC000541935191 568257258 /nfs/dbraw/zinc/25/72/58/568257258.db2.gz MPFPARAUOPTJPT-OAHLLOKOSA-N 0 0 351.410 3.625 20 5 FHBDRN O=C(N[C@@]1(C(F)(F)F)CCc2ccccc21)c1csc([N+](=O)[O-])c1 ZINC000541939600 568259428 /nfs/dbraw/zinc/25/94/28/568259428.db2.gz TUNAUOPFUZMKNR-AWEZNQCLSA-N 0 0 356.325 3.790 20 5 FHBDRN O=C(N[C@@H]1CCc2ccc(F)cc21)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000541935882 568260075 /nfs/dbraw/zinc/26/00/75/568260075.db2.gz OEDCVMLKQMKGAN-CYBMUJFWSA-N 0 0 366.295 3.753 20 5 FHBDRN C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1[O-])c1ccc(-c2ccncc2)cc1 ZINC000436671034 568260767 /nfs/dbraw/zinc/26/07/67/568260767.db2.gz UAFQOJOXOUWGOH-CYBMUJFWSA-N 0 0 363.373 3.853 20 5 FHBDRN CCOc1ccc(C(=O)N[C@@H]2C[C@@H](C)Oc3ccccc32)cc1[N+](=O)[O-] ZINC000453037041 568262974 /nfs/dbraw/zinc/26/29/74/568262974.db2.gz OSPNXMBVDRDRIE-IUODEOHRSA-N 0 0 356.378 3.636 20 5 FHBDRN Cc1ncc([N+](=O)[O-])c(OCC(=O)c2cccc(C(F)(F)F)c2)c1C ZINC000569001864 568263007 /nfs/dbraw/zinc/26/30/07/568263007.db2.gz NDXICRJLBOCGRX-UHFFFAOYSA-N 0 0 354.284 3.887 20 5 FHBDRN CCO[C@H]1C[C@@H](N(C)C(=O)c2cc([N+](=O)[O-])ccc2[O-])C12CCCCC2 ZINC000436670562 568263811 /nfs/dbraw/zinc/26/38/11/568263811.db2.gz FQFCNEWYPRGLLI-SJORKVTESA-N 0 0 362.426 3.500 20 5 FHBDRN CCN(C(=O)c1cc(SC)ccc1[N+](=O)[O-])[C@@H]1CCOC(C)(C)C1 ZINC000291718565 568268598 /nfs/dbraw/zinc/26/85/98/568268598.db2.gz VWSCLBXWWHWQQD-GFCCVEGCSA-N 0 0 352.456 3.736 20 5 FHBDRN COc1cc(C(=O)Nc2ccc(C(F)(F)F)cc2)c([N+](=O)[O-])cc1OC ZINC000007970963 568269405 /nfs/dbraw/zinc/26/94/05/568269405.db2.gz JBZIBSWZJDUOHU-UHFFFAOYSA-N 0 0 370.283 3.883 20 5 FHBDRN Cc1ccc(-c2noc(-c3cc([N+](=O)[O-])cn3C)n2)cc1N1CCCC1 ZINC000569067543 568270332 /nfs/dbraw/zinc/27/03/32/568270332.db2.gz VCJGXCQANDTKQB-UHFFFAOYSA-N 0 0 353.382 3.559 20 5 FHBDRN O=C(CSc1ccccc1[N+](=O)[O-])N[C@@H](c1ccccc1)C(F)F ZINC000482108815 568275499 /nfs/dbraw/zinc/27/54/99/568275499.db2.gz ZJBVLARZTUJDEO-HNNXBMFYSA-N 0 0 352.362 3.810 20 5 FHBDRN CCOc1c(OC)cc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)cc1OC ZINC000482122881 568275880 /nfs/dbraw/zinc/27/58/80/568275880.db2.gz GIFPDVBKCANSFB-CYBMUJFWSA-N 0 0 360.410 3.862 20 5 FHBDRN CC1(C)CN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)[C@H]1c1ccccc1 ZINC000604374252 568276794 /nfs/dbraw/zinc/27/67/94/568276794.db2.gz ZQYDUHNSUYGGIX-INIZCTEOSA-N 0 0 364.398 3.506 20 5 FHBDRN CNc1ccc(C(=O)NCCc2ccc(Cl)cc2Cl)cc1[N+](=O)[O-] ZINC000008021073 568280171 /nfs/dbraw/zinc/28/01/71/568280171.db2.gz YHBVHZJRTGMXNJ-UHFFFAOYSA-N 0 0 368.220 3.916 20 5 FHBDRN O=[N+]([O-])c1ccccc1CS(=O)(=O)C1CCC(C(F)(F)F)CC1 ZINC000453045989 568289831 /nfs/dbraw/zinc/28/98/31/568289831.db2.gz JVBBFGOHBBAKON-UHFFFAOYSA-N 0 0 351.346 3.631 20 5 FHBDRN Cc1ccccc1NC(=O)Cc1noc(/C=C\c2ccccc2[N+](=O)[O-])n1 ZINC000609473861 568292016 /nfs/dbraw/zinc/29/20/16/568292016.db2.gz BOXOUGPUGRVGFH-KHPPLWFESA-N 0 0 364.361 3.638 20 5 FHBDRN C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000482172069 568300485 /nfs/dbraw/zinc/30/04/85/568300485.db2.gz BTIMGJOGGYSATI-GXFFZTMASA-N 0 0 362.373 3.876 20 5 FHBDRN O=[N+]([O-])c1ccc2c(c1)CN(Cc1cnc(-c3ccncc3)s1)CCO2 ZINC000569162350 568300931 /nfs/dbraw/zinc/30/09/31/568300931.db2.gz KMGSZIQZKASTIG-UHFFFAOYSA-N 0 0 368.418 3.508 20 5 FHBDRN Cc1cc(C)c([N+](=O)[O-])c(OCC(=O)N[C@@H](C)c2ccc(Cl)cc2)n1 ZINC000541985347 568307357 /nfs/dbraw/zinc/30/73/57/568307357.db2.gz XNPXUCFWTGLEDX-LBPRGKRZSA-N 0 0 363.801 3.516 20 5 FHBDRN COc1cc2c(cc1F)CC[C@H]2NC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000569211136 568308825 /nfs/dbraw/zinc/30/88/25/568308825.db2.gz GLKWTUMTBHYLTN-CQSZACIVSA-N 0 0 364.760 3.813 20 5 FHBDRN O=C(N[C@@H]1[C@@H]2CCO[C@H]2C12CCC2)c1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000291784640 568309353 /nfs/dbraw/zinc/30/93/53/568309353.db2.gz QGYGJWSBDXYAHH-CUOATXAZSA-N 0 0 371.220 3.589 20 5 FHBDRN CN(Cc1ccc(F)cc1F)C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000030804309 568313167 /nfs/dbraw/zinc/31/31/67/568313167.db2.gz ZZXVIDJRGYNJBB-UHFFFAOYSA-N 0 0 361.348 3.720 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1N[C@@H]1CCN([C@H](C)c2ccc(F)cc2)C1=O ZINC000453065399 568318131 /nfs/dbraw/zinc/31/81/31/568318131.db2.gz UVYPAMSOJDHOER-CXAGYDPISA-N 0 0 357.385 3.816 20 5 FHBDRN COC(=O)c1cc(NC(=O)c2[nH]c3ccc(C)cc3c2C)cc([N+](=O)[O-])c1 ZINC000482215942 568320674 /nfs/dbraw/zinc/32/06/74/568320674.db2.gz RBNRGNGUHORSAY-UHFFFAOYSA-N 0 0 367.361 3.732 20 5 FHBDRN Cc1ccc(C(=O)Nc2ccc(NC(=O)NC(C)C)cc2)cc1[N+](=O)[O-] ZINC000031021275 568321549 /nfs/dbraw/zinc/32/15/49/568321549.db2.gz ZMTVCTHKNMGWSF-UHFFFAOYSA-N 0 0 356.382 3.685 20 5 FHBDRN CSc1ccc(C(=O)NCc2nc3cc(F)ccc3o2)cc1[N+](=O)[O-] ZINC000569276953 568326538 /nfs/dbraw/zinc/32/65/38/568326538.db2.gz NDMSKJNAVQCYSQ-UHFFFAOYSA-N 0 0 361.354 3.527 20 5 FHBDRN O=C(CCCc1nc(-c2ccc(F)cc2)no1)Nc1cccc([N+](=O)[O-])c1 ZINC000031701888 568336002 /nfs/dbraw/zinc/33/60/02/568336002.db2.gz GLHCLFXOHXGUMD-UHFFFAOYSA-N 0 0 370.340 3.745 20 5 FHBDRN Cc1c(C(=O)Nc2ccc(C)cc2Cl)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000031873447 568342552 /nfs/dbraw/zinc/34/25/52/568342552.db2.gz PIAVOMIMUOTRFA-UHFFFAOYSA-N 0 0 371.784 3.698 20 5 FHBDRN Nc1c(C(=O)N2C[C@@H](c3ccccc3)C3(CCC3)C2)cccc1[N+](=O)[O-] ZINC000412673643 568362786 /nfs/dbraw/zinc/36/27/86/568362786.db2.gz MRFYPBHJLDJSPM-INIZCTEOSA-N 0 0 351.406 3.587 20 5 FHBDRN CS[C@@H]1CCC[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000181995529 568371782 /nfs/dbraw/zinc/37/17/82/568371782.db2.gz BZQJGAITJZLUJY-MWLCHTKSSA-N 0 0 360.382 3.600 20 5 FHBDRN CS(=O)(=O)c1ccc(Oc2cccc(C(F)(F)F)c2)c([N+](=O)[O-])c1 ZINC000005702663 568389684 /nfs/dbraw/zinc/38/96/84/568389684.db2.gz UGZORIPTZXWJNG-UHFFFAOYSA-N 0 0 361.297 3.809 20 5 FHBDRN CC(=O)c1ccc(CC(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)cc1 ZINC000541997697 568393102 /nfs/dbraw/zinc/39/31/02/568393102.db2.gz ZHRZQVBSUMWRCU-UHFFFAOYSA-N 0 0 366.295 3.997 20 5 FHBDRN C[C@@H](Nc1ccc(Br)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000032512461 568393694 /nfs/dbraw/zinc/39/36/94/568393694.db2.gz ZHFKTPOSUDULFU-SNVBAGLBSA-N 0 0 364.199 3.796 20 5 FHBDRN COC[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1F)c1cccc(Cl)c1 ZINC000569341471 568395373 /nfs/dbraw/zinc/39/53/73/568395373.db2.gz ASOLTJXDXXFGOF-OAHLLOKOSA-N 0 0 352.749 3.505 20 5 FHBDRN CC(C)(NC(=O)c1cnn(Cc2ccccc2)c1)c1ccccc1[N+](=O)[O-] ZINC000569444152 568402716 /nfs/dbraw/zinc/40/27/16/568402716.db2.gz VBBYTGJRPAQZBU-UHFFFAOYSA-N 0 0 364.405 3.505 20 5 FHBDRN O=C(Cc1ccccc1[N+](=O)[O-])N1C[C@H](c2ccccc2)[C@@H]2CCC[C@H]21 ZINC000569484185 568403253 /nfs/dbraw/zinc/40/32/53/568403253.db2.gz CONDUDQFDHAHIE-NLWGTHIKSA-N 0 0 350.418 3.932 20 5 FHBDRN O=[N+]([O-])c1ccccc1Cc1noc(-c2cnc(-c3ccccc3)nc2)n1 ZINC000569552116 568405088 /nfs/dbraw/zinc/40/50/88/568405088.db2.gz CADACBGFQKZCBS-UHFFFAOYSA-N 0 0 359.345 3.693 20 5 FHBDRN Cc1cc(N2CCC(C(C)(C)C(=O)[O-])CC2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000569813241 568426887 /nfs/dbraw/zinc/42/68/87/568426887.db2.gz BGNJSQKNYZUTQD-UHFFFAOYSA-N 0 0 357.410 3.779 20 5 FHBDRN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H](CC(=O)N(C)C)c1ccccc1 ZINC000569877027 568433051 /nfs/dbraw/zinc/43/30/51/568433051.db2.gz IZRFKUCKYUENAB-BEFAXECRSA-N 0 0 355.438 3.773 20 5 FHBDRN CC(C)n1cc([C@H](C)NC(=O)c2c([N+](=O)[O-])cccc2C(F)(F)F)cn1 ZINC000569968721 568444971 /nfs/dbraw/zinc/44/49/71/568444971.db2.gz LTVIQRAUJULDQR-JTQLQIEISA-N 0 0 370.331 3.882 20 5 FHBDRN Cc1ccc(CN2CCn3c(C4CCCC4)nnc3[C@@H]2C)cc1[N+](=O)[O-] ZINC000569968896 568445005 /nfs/dbraw/zinc/44/50/05/568445005.db2.gz OHPHYYIOLUQVLW-AWEZNQCLSA-N 0 0 355.442 3.729 20 5 FHBDRN CCCOCc1ccccc1CNC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000569998295 568448010 /nfs/dbraw/zinc/44/80/10/568448010.db2.gz OKFJKSMJIUGMGE-HNNXBMFYSA-N 0 0 356.422 3.941 20 5 FHBDRN CN(C/C=C/c1ccccc1[N+](=O)[O-])Cc1nc(-c2cccs2)no1 ZINC000570008760 568449522 /nfs/dbraw/zinc/44/95/22/568449522.db2.gz IHEUWURPICWRTC-QPJJXVBHSA-N 0 0 356.407 3.852 20 5 FHBDRN C[C@@H](C(=O)N(Cc1ccco1)c1ccccn1)c1cccc([N+](=O)[O-])c1 ZINC000570235308 568464993 /nfs/dbraw/zinc/46/49/93/568464993.db2.gz IZQHLSZBCISBNI-CQSZACIVSA-N 0 0 351.362 3.920 20 5 FHBDRN CC[C@H](c1cccc(OC)c1)N(C)C(=O)COc1cccc([N+](=O)[O-])c1 ZINC000570312359 568466675 /nfs/dbraw/zinc/46/66/75/568466675.db2.gz ZPAUSUGPFHUMJD-GOSISDBHSA-N 0 0 358.394 3.592 20 5 FHBDRN CC(C)(C)c1ncc(C(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cn1 ZINC000570281305 568472362 /nfs/dbraw/zinc/47/23/62/568472362.db2.gz XDHTVJBSDRIRAC-OAHLLOKOSA-N 0 0 368.437 3.702 20 5 FHBDRN CC1(C)CN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)[C@@H]1C1CC1 ZINC000570493796 568488328 /nfs/dbraw/zinc/48/83/28/568488328.db2.gz AUTJAJWWOUIETP-CYBMUJFWSA-N 0 0 353.216 3.618 20 5 FHBDRN CNc1ccc(C(=O)Nc2cccc(C)c2Br)cc1[N+](=O)[O-] ZINC000317097192 568497970 /nfs/dbraw/zinc/49/79/70/568497970.db2.gz BEPFCEYNUJRVJW-UHFFFAOYSA-N 0 0 364.199 3.960 20 5 FHBDRN COc1ccc([N+](=O)[O-])cc1OCC(=O)N[C@@H](CC(C)C)c1ccccc1 ZINC000007510113 568525386 /nfs/dbraw/zinc/52/53/86/568525386.db2.gz SJPSVQRIAQVSDT-KRWDZBQOSA-N 0 0 372.421 3.886 20 5 FHBDRN C[C@H](NC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1)[C@@H](C)c1ccccc1 ZINC000482250115 568528341 /nfs/dbraw/zinc/52/83/41/568528341.db2.gz XYPPJLKAVOQUIX-CABCVRRESA-N 0 0 364.405 3.703 20 5 FHBDRN COc1ccc(C(=O)N2CCCCC[C@H]2c2ccncc2)cc1[N+](=O)[O-] ZINC000049764631 568589558 /nfs/dbraw/zinc/58/95/58/568589558.db2.gz RVGPCFRXBNRKTG-INIZCTEOSA-N 0 0 355.394 3.756 20 5 FHBDRN CC(=O)Nc1cccc2c1CCCN2C(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000365438111 568671376 /nfs/dbraw/zinc/67/13/76/568671376.db2.gz QJKXLSIJSPBGBP-UHFFFAOYSA-N 0 0 373.796 3.800 20 5 FHBDRN Cc1cc(NCc2ccccc2C[NH+]2CCCC2)cc(C(=O)[O-])c1[N+](=O)[O-] ZINC000574456564 602312645 /nfs/dbraw/zinc/31/26/45/602312645.db2.gz PTCPBRGFNXXGNC-UHFFFAOYSA-N 0 0 369.421 3.809 20 5 FHBDRN O=C([O-])N1CCC([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC1 ZINC000738640059 602648180 /nfs/dbraw/zinc/64/81/80/602648180.db2.gz NINPJIIXZIWWQT-UHFFFAOYSA-N 0 0 361.423 3.555 20 5 FHBDRN O=C([O-])c1cc([N+](=O)[O-])c(NC2CC[NH+](C3CCCC3)CC2)cc1Cl ZINC000833307306 604271307 /nfs/dbraw/zinc/27/13/07/604271307.db2.gz MCGRCCZIQCQHQY-UHFFFAOYSA-N 0 0 367.833 3.765 20 5 FHBDRN CC(C)[N@H+](C)CC1CCN(c2cc(Cl)c(C(=O)[O-])cc2[N+](=O)[O-])CC1 ZINC000833495937 605036184 /nfs/dbraw/zinc/03/61/84/605036184.db2.gz HIOAHFIGFNDVRZ-UHFFFAOYSA-N 0 0 369.849 3.503 20 5 FHBDRN CC(C)(C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)C(=O)[O-] ZINC000833458112 605115146 /nfs/dbraw/zinc/11/51/46/605115146.db2.gz CXFKOZOIPHCNBO-UHFFFAOYSA-N 0 0 352.774 3.709 20 5 FHBDRN O=[N+]([O-])c1ccc2oc(C(Cl)=Cc3cc(-c4nn[nH]n4)cs3)nc2c1 ZINC000823643878 606340182 /nfs/dbraw/zinc/34/01/82/606340182.db2.gz DQSISXJJHWPYRJ-BJMVGYQFSA-N 0 0 374.769 3.715 20 5 FHBDRN O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1N1CCCC[C@H]1c1ccc(F)cc1 ZINC000823629700 606476233 /nfs/dbraw/zinc/47/62/33/606476233.db2.gz FHQHRPBMLJRZAD-HNNXBMFYSA-N 0 0 368.372 3.646 20 5 FHBDRN